smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1cccc(-c2nn[nH]n2)c1 ZINC000542337996 944638144 /nfs/dbraw/zinc/63/81/44/944638144.db2.gz PAEAQRCRUBLKSU-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN CCOc1cc(-c2nn[nH]n2)ccc1OC(=O)C=C(C)c1ccc([N+](=O)[O-])cc1 ZINC000825609492 947257526 /nfs/dbraw/zinc/25/75/26/947257526.db2.gz NRZBCRKRJZPBHL-ZRDIBKRKSA-N 0 0 395.375 3.183 20 5 GGBDRN C[C@@H](c1cccc(-c2nn[nH]n2)c1)N(C)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001575508970 949108300 /nfs/dbraw/zinc/10/83/00/949108300.db2.gz AIAVHYPTKDTAKU-JTQLQIEISA-N 0 0 386.799 3.262 20 5 GGBDRN CC(C)(C)O[C@H]1C[C@H](Nc2cc(F)c(-c3nn[nH]n3)cc2[N+](=O)[O-])C12CCC2 ZINC001573863367 950478107 /nfs/dbraw/zinc/47/81/07/950478107.db2.gz FJHAISKXIZTJKU-GJZGRUSLSA-N 0 0 390.419 3.452 20 5 GGBDRN C[C@@H]1CCc2ccccc2N1CCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001576214793 950682702 /nfs/dbraw/zinc/68/27/02/950682702.db2.gz CFYTZYCQIHEMSR-CYBMUJFWSA-N 0 0 379.424 3.028 20 5 GGBDRN CC(C)(C)n1cc(-c2nn[nH]n2)cc1NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001573887979 950860777 /nfs/dbraw/zinc/86/07/77/950860777.db2.gz MDGPJNFQJADOLF-HUUCEWRRSA-N 0 0 395.423 3.074 20 5 GGBDRN C[C@H](CNc1cc(F)c(-c2nn[nH]n2)cc1[N+](=O)[O-])Oc1ccc(Cl)cc1 ZINC001575121980 952000530 /nfs/dbraw/zinc/00/05/30/952000530.db2.gz ITQDMOPJIMMXPJ-SECBINFHSA-N 0 0 392.778 3.447 20 5 GGBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@](C)(C(=O)[O-])C2)cc1OC ZINC000568074575 953642826 /nfs/dbraw/zinc/64/28/26/953642826.db2.gz MQRHOYOSBFBUAL-DJJJIMSYSA-N 0 0 380.441 3.325 20 5 GGBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](C(=O)[O-])C2)cc1OC ZINC000593742466 953754674 /nfs/dbraw/zinc/75/46/74/953754674.db2.gz MTRMNEAAJXVVEJ-KGLIPLIRSA-N 0 0 380.441 3.325 20 5 GGBDRN O=C([O-])[C@@H](NCc1c(Br)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC001594844392 954121372 /nfs/dbraw/zinc/12/13/72/954121372.db2.gz ZMJIFSQMAQXYMM-AWEZNQCLSA-N 0 0 383.173 3.412 20 5 GGBDRN C[N@H+](CCC(=O)[O-])[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC001593736871 954342655 /nfs/dbraw/zinc/34/26/55/954342655.db2.gz AOWGITSKWHNRJI-KRWDZBQOSA-N 0 0 391.811 3.335 20 5 GGBDRN C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(N2CCC[C@H](C(=O)[O-])C2)o1 ZINC001593755329 954447084 /nfs/dbraw/zinc/44/70/84/954447084.db2.gz HKIBCLYEQJVCTL-INIZCTEOSA-N 0 0 387.436 3.163 20 5 GGBDRN C[C@]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)(C(=O)[O-])c1ccccc1 ZINC001589128158 956175967 /nfs/dbraw/zinc/17/59/67/956175967.db2.gz AHHKJOXKFDFPFE-MRXNPFEDSA-N 0 0 379.210 3.447 20 5 GGBDRN COc1ccc(-c2ccc(C[NH2+][C@H](Cc3ccncc3)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC001594071310 958187106 /nfs/dbraw/zinc/18/71/06/958187106.db2.gz RWYHRMBTUDAVKL-QGZVFWFLSA-N 0 0 397.387 3.044 20 5 GGBDRN C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(N2CCC(C(=O)[O-])CC2)o1 ZINC001604180833 972604535 /nfs/dbraw/zinc/60/45/35/972604535.db2.gz XHBMVKFYZBKGDS-UHFFFAOYSA-N 0 0 387.436 3.163 20 5 GGBDRN CCOc1cc(N2CC[NH+](Cc3ccc(C(=O)[O-])cc3)CC2)ccc1[N+](=O)[O-] ZINC000414635062 973945655 /nfs/dbraw/zinc/94/56/55/973945655.db2.gz FLOJFPYNUUQXAI-UHFFFAOYSA-N 0 0 385.420 3.014 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000563205122 974519696 /nfs/dbraw/zinc/51/96/96/974519696.db2.gz KGKUHZWLRWTKHJ-MQVJKMGUSA-N 0 0 382.420 3.296 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)n1 ZINC000563538163 974536030 /nfs/dbraw/zinc/53/60/30/974536030.db2.gz RVWMCGSYTVGMAD-HNNXBMFYSA-N 0 0 390.484 3.477 20 5 GGBDRN O=C([O-])CC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCOCC1 ZINC000564969844 974560510 /nfs/dbraw/zinc/56/05/10/974560510.db2.gz CREDAOLCWSSTOM-UHFFFAOYSA-N 0 0 391.449 3.174 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)n1 ZINC000566072400 974593461 /nfs/dbraw/zinc/59/34/61/974593461.db2.gz YSUQQQNVHXVEQS-CQSZACIVSA-N 0 0 398.463 3.262 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NCC2CC[NH+](Cc3cccs3)CC2)n1 ZINC000568753085 974677702 /nfs/dbraw/zinc/67/77/02/974677702.db2.gz YAXLXAYKXZPQGG-UHFFFAOYSA-N 0 0 376.438 3.074 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(N2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)n1 ZINC000569490067 974692984 /nfs/dbraw/zinc/69/29/84/974692984.db2.gz XVGZHDXZEZDKNU-UHFFFAOYSA-N 0 0 396.447 3.181 20 5 GGBDRN CC(C)Oc1ccc([C@@H](CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000569697016 974696729 /nfs/dbraw/zinc/69/67/29/974696729.db2.gz FVYVPOJWCRISJQ-QGZVFWFLSA-N 0 0 388.424 3.190 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)n1 ZINC000571093487 974722876 /nfs/dbraw/zinc/72/28/76/974722876.db2.gz PNUSCWPSUSJTGG-UHFFFAOYSA-N 0 0 398.463 3.345 20 5 GGBDRN COc1cc(C[N@H+](C)C2(C(=O)[O-])CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000573817628 974771583 /nfs/dbraw/zinc/77/15/83/974771583.db2.gz QZBREPVGBFJNPY-UHFFFAOYSA-N 0 0 388.367 3.077 20 5 GGBDRN O=C([O-])c1ccnc(N2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000575062452 974794719 /nfs/dbraw/zinc/79/47/19/974794719.db2.gz MMXRGKBMGLPLIQ-WMZOPIPTSA-N 0 0 396.447 3.179 20 5 GGBDRN C[C@H]1C[C@H](CCNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000577183283 974830179 /nfs/dbraw/zinc/83/01/79/974830179.db2.gz WZWMWLLRJYZWOM-HOCLYGCPSA-N 0 0 384.436 3.401 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1CCC1CCN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])CC1 ZINC000578536757 974857316 /nfs/dbraw/zinc/85/73/16/974857316.db2.gz MDSOAFDYTQDQDO-AWEZNQCLSA-N 0 0 376.457 3.169 20 5 GGBDRN O=C([O-])CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)c(F)c1 ZINC000579133046 974869425 /nfs/dbraw/zinc/86/94/25/974869425.db2.gz UCOXEGWENQMCEB-UHFFFAOYSA-N 0 0 380.347 3.229 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)n1 ZINC000582362302 974924963 /nfs/dbraw/zinc/92/49/63/974924963.db2.gz DDGSAOJHRUPAOW-OAQYLSRUSA-N 0 0 396.447 3.099 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c1 ZINC000593741920 974986969 /nfs/dbraw/zinc/98/69/69/974986969.db2.gz SUQMHZLMUAGKQR-QWFCFKBJSA-N 0 0 382.416 3.298 20 5 GGBDRN CCOc1cc(C[N@H+](CC(=O)[O-])Cc2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000593747106 974987001 /nfs/dbraw/zinc/98/70/01/974987001.db2.gz SCFQHENQRBEAAM-UHFFFAOYSA-N 0 0 380.347 3.359 20 5 GGBDRN O=C([O-])c1ccnc(N2CC[NH+](Cc3cccc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000738692696 978589904 /nfs/dbraw/zinc/58/99/04/978589904.db2.gz AQCZNLUSDQCWMU-UHFFFAOYSA-N 0 0 392.415 3.163 20 5 GGBDRN C[C@@H](C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)Oc1cccc(Cl)c1 ZINC001592711914 979201518 /nfs/dbraw/zinc/20/15/18/979201518.db2.gz BZYNHWCLIQETTL-LBPRGKRZSA-N 0 0 394.811 3.269 20 5 GGBDRN C[C@H](C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)Oc1cccc(Cl)c1 ZINC001592711909 979201548 /nfs/dbraw/zinc/20/15/48/979201548.db2.gz BZYNHWCLIQETTL-GFCCVEGCSA-N 0 0 394.811 3.269 20 5 GGBDRN C[C@@H](C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)Oc1ccc(Cl)cc1 ZINC001592712887 979208793 /nfs/dbraw/zinc/20/87/93/979208793.db2.gz VXSUJTJPMAYWCH-LBPRGKRZSA-N 0 0 394.811 3.269 20 5 GGBDRN CC1CC[NH+](C[C@@H]2CCCN(c3ccc(CC(=O)[O-])cc3[N+](=O)[O-])C2)CC1 ZINC000844207322 979355764 /nfs/dbraw/zinc/35/57/64/979355764.db2.gz HKAIPPOVRYVJSY-KRWDZBQOSA-N 0 0 375.469 3.170 20 5 GGBDRN O=C([O-])Cc1ccc(N2CCC(CCC[NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000844211992 979368050 /nfs/dbraw/zinc/36/80/50/979368050.db2.gz NHMUAWZCXADBJN-UHFFFAOYSA-N 0 0 375.469 3.314 20 5 GGBDRN C[C@@H]1CCN(c2ccc(CC(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000844212077 979368055 /nfs/dbraw/zinc/36/80/55/979368055.db2.gz QIUJLJLUIMTZPG-MRXNPFEDSA-N 0 0 383.448 3.323 20 5 GGBDRN CCC(CC)[C@@H](CNC(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C)[NH+](C)C ZINC001595105898 979426946 /nfs/dbraw/zinc/42/69/46/979426946.db2.gz FHWKPPJQQRITTA-MRXNPFEDSA-N 0 0 380.445 3.089 20 5 GGBDRN Cc1ccc2c(c1)[C@H]1C[N@H+](C)CC[C@H]1N2C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC000864172272 979803948 /nfs/dbraw/zinc/80/39/48/979803948.db2.gz RFXCODQPOKXPSC-IEBWSBKVSA-N 0 0 395.415 3.050 20 5 GGBDRN O=C([O-])[C@]1(c2ccccc2)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000901826607 980546411 /nfs/dbraw/zinc/54/64/11/980546411.db2.gz ITGBHGDKDYKGOF-LJQANCHMSA-N 0 0 392.358 3.425 20 5 GGBDRN Cc1cc([C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C(=O)[O-])ccc1F ZINC000901843014 980563412 /nfs/dbraw/zinc/56/34/12/980563412.db2.gz CIBXEMIHRBVQJG-LJQANCHMSA-N 0 0 387.411 3.427 20 5 GGBDRN O=C([O-])[C@]12C[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C[C@H]1COCC2 ZINC000901952852 980648727 /nfs/dbraw/zinc/64/87/27/980648727.db2.gz YVEFTJGZOMTBOH-ORAYPTAESA-N 0 0 388.445 3.246 20 5 GGBDRN CO[C@@H]1CC[N@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[C@@H](C(=O)[O-])C1 ZINC000902031718 980703379 /nfs/dbraw/zinc/70/33/79/980703379.db2.gz LFBQMHRQBZTIOE-YLJYHZDGSA-N 0 0 399.447 3.427 20 5 GGBDRN CCCC[C@@H](C(=O)[O-])[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC001595628235 981782479 /nfs/dbraw/zinc/78/24/79/981782479.db2.gz QWLGOYCZKVWAAA-HNNXBMFYSA-N 0 0 389.374 3.379 20 5 GGBDRN O=C([O-])C1CC[NH+](CCCNC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000911378670 982396255 /nfs/dbraw/zinc/39/62/55/982396255.db2.gz GTKLOVUAWJPZHU-UHFFFAOYSA-N 0 0 391.471 3.305 20 5 GGBDRN CCCCNC(=O)C1([NH2+]Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CCCCC1 ZINC001595756298 982456952 /nfs/dbraw/zinc/45/69/52/982456952.db2.gz YYCNPCSNVWKESI-UHFFFAOYSA-N 0 0 377.441 3.002 20 5 GGBDRN O=C([O-])/C=C\c1ccc(NCC2([NH+]3CCSCC3)CCCC2)c([N+](=O)[O-])c1 ZINC000915213374 982665215 /nfs/dbraw/zinc/66/52/15/982665215.db2.gz WPNGUVNFHSQPBS-XQRVVYSFSA-N 0 0 391.493 3.466 20 5 GGBDRN O=C([O-])/C=C/c1ccc(NC2CC[NH+](Cc3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000917086237 982679623 /nfs/dbraw/zinc/67/96/23/982679623.db2.gz USYSGMFGPFUJNP-DUXPYHPUSA-N 0 0 382.420 3.164 20 5 GGBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]3C[C@@]32C(=O)[O-])cc1OC ZINC001594964481 982719092 /nfs/dbraw/zinc/71/90/92/982719092.db2.gz JJJYHYBKMYDQLR-AGKSTNPPSA-N 0 0 392.452 3.467 20 5 GGBDRN CCC[N@H+](Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC001595899826 982949700 /nfs/dbraw/zinc/94/97/00/982949700.db2.gz NWOPZCDCDYBODP-NIKGAXFTSA-N 0 0 392.452 3.084 20 5 GGBDRN CCCc1[nH+]c(C)cc(OCc2cc([N+](=O)[O-])cc3c2OCOC3)c1C(=O)[O-] ZINC001596090341 983416084 /nfs/dbraw/zinc/41/60/84/983416084.db2.gz ZVDAWMMYKUNCDK-UHFFFAOYSA-N 0 0 388.376 3.394 20 5 GGBDRN CC[NH+](CC)CCN(Cc1ccccc1)C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC001596268742 983686827 /nfs/dbraw/zinc/68/68/27/983686827.db2.gz NFYYRKOKOAHRIP-UHFFFAOYSA-N 0 0 399.447 3.277 20 5 GGBDRN CC[NH+]1CCN(c2ccc(Nc3ccc(CC(=O)[O-])cc3[N+](=O)[O-])cc2)CC1 ZINC001596441830 984130162 /nfs/dbraw/zinc/13/01/62/984130162.db2.gz BTRHIPNTFAEGKD-UHFFFAOYSA-N 0 0 384.436 3.107 20 5 GGBDRN C[C@H]([NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-])c1ccc(-n2cccn2)c(F)c1 ZINC001599901302 984835468 /nfs/dbraw/zinc/83/54/68/984835468.db2.gz ICHYWRQSOLPOHM-LBPRGKRZSA-N 0 0 384.367 3.469 20 5 GGBDRN CCO[C@H]1C[C@@]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)(C(=O)[O-])C1(C)C ZINC001596836949 985488995 /nfs/dbraw/zinc/48/89/95/985488995.db2.gz GSUPAWTXFZEVPB-QFBILLFUSA-N 0 0 380.441 3.130 20 5 GGBDRN CCOCCC[N@@H+]1CC[C@H](Nc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])[C@H](C)C1 ZINC001596917456 985961632 /nfs/dbraw/zinc/96/16/32/985961632.db2.gz WYLFPHURNKTHBS-AKTONZINSA-N 0 0 391.468 3.242 20 5 GGBDRN C[C@@H]1CN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC001594543838 986196340 /nfs/dbraw/zinc/19/63/40/986196340.db2.gz BSTBAKOLFKDDBB-INIZCTEOSA-N 0 0 383.448 3.247 20 5 GGBDRN CC(C)(CC[NH+]1CCCCCC1)NC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC001590670653 990373081 /nfs/dbraw/zinc/37/30/81/990373081.db2.gz DSQIDCBHUQYYST-UHFFFAOYSA-N 0 0 377.441 3.068 20 5 GGBDRN C[NH+](C)[C@H](CNc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC001598176036 990726327 /nfs/dbraw/zinc/72/63/27/990726327.db2.gz KEIACPIJOYIYIQ-LJQANCHMSA-N 0 0 397.431 3.276 20 5 GGBDRN C[NH+](C)C[C@@H](CNc1ncc(C(=O)[O-])cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC001598200738 990818910 /nfs/dbraw/zinc/81/89/10/990818910.db2.gz ROZKHFCDOZEWDM-CYBMUJFWSA-N 0 0 378.816 3.099 20 5 GGBDRN C[NH+](C)C[C@H](CNc1ncc(C(=O)[O-])cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC001598200740 990819082 /nfs/dbraw/zinc/81/90/82/990819082.db2.gz ROZKHFCDOZEWDM-ZDUSSCGKSA-N 0 0 378.816 3.099 20 5 GGBDRN CN(C)c1ncc(C[NH2+][C@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC001598359186 991488553 /nfs/dbraw/zinc/48/85/53/991488553.db2.gz JEKCNLYIYREXPB-NRFANRHFSA-N 0 0 394.431 3.299 20 5 GGBDRN CN(c1ccccc1)c1ccc(C[NH2+][C@]2(CC(=O)[O-])CCOC2)cc1[N+](=O)[O-] ZINC001598545038 992935831 /nfs/dbraw/zinc/93/58/31/992935831.db2.gz LYTXUXDALSPXDX-FQEVSTJZSA-N 0 0 385.420 3.086 20 5 GGBDRN C[N@H+]1CC=C(CNc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC001598577586 993301202 /nfs/dbraw/zinc/30/12/02/993301202.db2.gz DILIGVNTOVQPMZ-UHFFFAOYSA-N 0 0 395.415 3.198 20 5 GGBDRN C[N@@H+]1CCC[C@@H](CNc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])C1 ZINC001598591869 993446204 /nfs/dbraw/zinc/44/62/04/993446204.db2.gz DYQPDIKCPBKQTB-AWEZNQCLSA-N 0 0 397.431 3.278 20 5 GGBDRN C[C@]([NH2+]Cc1ccc(Br)cc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593291708 994670068 /nfs/dbraw/zinc/67/00/68/994670068.db2.gz BOBJKNWOBSLMOK-MRXNPFEDSA-N 0 0 379.210 3.447 20 5 GGBDRN C[C@@]([NH2+]Cc1cc2ccc(F)cc2[nH]c1=O)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593293300 994682748 /nfs/dbraw/zinc/68/27/48/994682748.db2.gz UBIXASDOTULRLA-IBGZPJMESA-N 0 0 385.351 3.077 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC001593298084 994709871 /nfs/dbraw/zinc/70/98/71/994709871.db2.gz DLZLCGVQDOGZMD-AWEZNQCLSA-N 0 0 396.403 3.095 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[C@@H]1Oc2ccccc2[C@H]1C ZINC001593298212 994711605 /nfs/dbraw/zinc/71/16/05/994711605.db2.gz FQTZKPZIADHYPY-MTJIALIYSA-N 0 0 386.404 3.101 20 5 GGBDRN C[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](Cc1ccccc1)C(=O)[O-] ZINC001593317311 994818077 /nfs/dbraw/zinc/81/80/77/994818077.db2.gz OZAIIRCIFBHGQQ-CXAGYDPISA-N 0 0 396.403 3.066 20 5 GGBDRN C[C@@]([NH2+]Cc1ccc2c(c1)COC(C)(C)O2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593980917 997196209 /nfs/dbraw/zinc/19/62/09/997196209.db2.gz PAMKKSDIXUVOTJ-FQEVSTJZSA-N 0 0 386.404 3.330 20 5 GGBDRN COc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)cc1F ZINC001599509809 997277267 /nfs/dbraw/zinc/27/72/67/997277267.db2.gz PTTOXAPTODBOHY-LLVKDONJSA-N 0 0 378.356 3.057 20 5 GGBDRN CO[C@@H]1CCC[C@H]([C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C(=O)[O-])C1 ZINC001599108712 997527590 /nfs/dbraw/zinc/52/75/90/997527590.db2.gz LRPDPGMMRUWWDG-FDQGKXFDSA-N 0 0 380.441 3.130 20 5 GGBDRN COc1ccc([C@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C(=O)[O-])cc1Cl ZINC001599527990 997596923 /nfs/dbraw/zinc/59/69/23/997596923.db2.gz RSKKORCCRYOECS-INIZCTEOSA-N 0 0 380.784 3.051 20 5 GGBDRN COc1ccc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C(=O)[O-])c(OC)c1 ZINC001599533211 997696399 /nfs/dbraw/zinc/69/63/99/997696399.db2.gz WSVXAEXERYRCAB-INIZCTEOSA-N 0 0 380.784 3.181 20 5 GGBDRN COc1ccc(C[N@@H+]2CC[C@H]2CNc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC001599561049 998195764 /nfs/dbraw/zinc/19/57/64/998195764.db2.gz CCTIWQWTKHXNRV-MPNRVQBSSA-N 0 0 397.431 3.388 20 5 GGBDRN C[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@@H+]1Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594297400 999147070 /nfs/dbraw/zinc/14/70/70/999147070.db2.gz WXJACUKWTNBMJM-GXTWGEPZSA-N 0 0 378.425 3.235 20 5 GGBDRN C[C@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@@H+]1Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594297401 999147202 /nfs/dbraw/zinc/14/72/02/999147202.db2.gz WXJACUKWTNBMJM-JSGCOSHPSA-N 0 0 378.425 3.235 20 5 GGBDRN COc1cc(C)ccc1C[NH2+][C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)[O-] ZINC000417559529 1126080428 /nfs/dbraw/zinc/08/04/28/1126080428.db2.gz IOWSGEJCBOZSBG-GOSISDBHSA-N 0 0 383.404 3.179 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnc(C2CCCC2)s1 ZINC000417569768 1126080511 /nfs/dbraw/zinc/08/05/11/1126080511.db2.gz MCPVYQZLLUDICB-HNNXBMFYSA-N 0 0 375.450 3.494 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426648625 1126081127 /nfs/dbraw/zinc/08/11/27/1126081127.db2.gz UAHHHBYESFQDMK-KRWDZBQOSA-N 0 0 382.372 3.346 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc(F)c(F)c1 ZINC000426740262 1126085393 /nfs/dbraw/zinc/08/53/93/1126085393.db2.gz AKVPZZOECAYGBU-KRWDZBQOSA-N 0 0 375.331 3.140 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc2[nH]ccc21 ZINC000426723520 1126082651 /nfs/dbraw/zinc/08/26/51/1126082651.db2.gz ZJDWGVIUTFSQGC-LJQANCHMSA-N 0 0 378.388 3.343 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc2ncccc2c1 ZINC000426727480 1126083320 /nfs/dbraw/zinc/08/33/20/1126083320.db2.gz OYLVDWCNXHBHOP-FQEVSTJZSA-N 0 0 390.399 3.410 20 5 GGBDRN Cc1cnn(C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C(=O)[O-])c1 ZINC000426728163 1126083637 /nfs/dbraw/zinc/08/36/37/1126083637.db2.gz UAFVRMPUCHEOPF-HNNXBMFYSA-N 0 0 386.433 3.071 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC000426800585 1126091136 /nfs/dbraw/zinc/09/11/36/1126091136.db2.gz OCBMOXDYIQHDES-AWEZNQCLSA-N 0 0 384.310 3.121 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(-c2cccnc2)c1 ZINC000426807669 1126091484 /nfs/dbraw/zinc/09/14/84/1126091484.db2.gz INRUUXBPHZOJDO-IBGZPJMESA-N 0 0 377.400 3.442 20 5 GGBDRN COc1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])c(Cl)c1OC ZINC000426805692 1126091548 /nfs/dbraw/zinc/09/15/48/1126091548.db2.gz DVTXCFSDQRFTBE-ZDUSSCGKSA-N 0 0 394.811 3.051 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(OC(F)(F)F)cc1 ZINC000426806767 1126091551 /nfs/dbraw/zinc/09/15/51/1126091551.db2.gz DGZVVNSLIQUJSE-AWEZNQCLSA-N 0 0 384.310 3.279 20 5 GGBDRN Cc1ccc(C[NH2+][C@@H](Cc2ccc(OC(F)F)cc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426821563 1126092817 /nfs/dbraw/zinc/09/28/17/1126092817.db2.gz UOXSQUOYHCPMNR-HNNXBMFYSA-N 0 0 380.347 3.290 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc2c1CCC2 ZINC000593007133 1126098623 /nfs/dbraw/zinc/09/86/23/1126098623.db2.gz KRIKCCVLDAKISU-HXUWFJFHSA-N 0 0 379.416 3.350 20 5 GGBDRN COc1ccc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)cc1OC ZINC000096759275 203834346 /nfs/dbraw/zinc/83/43/46/203834346.db2.gz HHNXETCOBVQIDV-LCYFTJDESA-N 0 0 379.372 3.266 20 5 GGBDRN Cc1cc(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)c2ccccc2n1 ZINC000002629681 203952157 /nfs/dbraw/zinc/95/21/57/203952157.db2.gz UNAKPCINQHIKMN-UHFFFAOYSA-N 0 0 383.335 3.386 20 5 GGBDRN O=C(COC(=O)CCC(=O)c1ccc(Cl)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000003325905 203997509 /nfs/dbraw/zinc/99/75/09/203997509.db2.gz CSXKXTHPGATBKD-UHFFFAOYSA-N 0 0 390.779 3.393 20 5 GGBDRN COc1ccc(OC)c(NC(=O)COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000003373413 204002378 /nfs/dbraw/zinc/00/23/78/204002378.db2.gz GQVNZUQVLBBTHO-UHFFFAOYSA-N 0 0 394.767 3.061 20 5 GGBDRN CC(C)(C)N(Cc1ccccc1)C(=O)Cn1cnc2cc([N+](=O)[O-])ccc2c1=O ZINC000003433147 204006102 /nfs/dbraw/zinc/00/61/02/204006102.db2.gz DOACJBNYBASRCC-UHFFFAOYSA-N 0 0 394.431 3.132 20 5 GGBDRN COc1ccc(C(=O)OCC(=O)Nc2ccc(C)cc2Cl)cc1[N+](=O)[O-] ZINC000003442481 204007579 /nfs/dbraw/zinc/00/75/79/204007579.db2.gz JAUQMRCADQSEPZ-UHFFFAOYSA-N 0 0 378.768 3.361 20 5 GGBDRN COc1ccccc1N1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000003451464 204007944 /nfs/dbraw/zinc/00/79/44/204007944.db2.gz ZATAGSQODAMLGF-UHFFFAOYSA-N 0 0 387.461 3.044 20 5 GGBDRN Cc1cc(C)n2nc(SCC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)nc2n1 ZINC000003467492 204008899 /nfs/dbraw/zinc/00/88/99/204008899.db2.gz NFZPIANINRRKON-UHFFFAOYSA-N 0 0 392.828 3.034 20 5 GGBDRN C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc2c(c1)OCO2 ZINC000003514117 204011918 /nfs/dbraw/zinc/01/19/18/204011918.db2.gz VDPWCINIHBQSHK-SECBINFHSA-N 0 0 392.751 3.161 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](OC(=O)C2=COCCO2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000004871194 204085063 /nfs/dbraw/zinc/08/50/63/204085063.db2.gz LOXDTAQNXFPNHI-GOSISDBHSA-N 0 0 398.371 3.014 20 5 GGBDRN Cc1cc(C)n2nc(SCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])nc2n1 ZINC000004523455 204050716 /nfs/dbraw/zinc/05/07/16/204050716.db2.gz QEMMYWSVCDODKP-UHFFFAOYSA-N 0 0 392.828 3.034 20 5 GGBDRN COC(=O)c1cc(C(=O)OCc2cc3c(c(Cl)c2)OCO3)cc([N+](=O)[O-])c1 ZINC000005279793 204123635 /nfs/dbraw/zinc/12/36/35/204123635.db2.gz AADURSGYVGHWID-UHFFFAOYSA-N 0 0 393.735 3.121 20 5 GGBDRN CNc1ccc(C(=O)OCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000005363783 204127800 /nfs/dbraw/zinc/12/78/00/204127800.db2.gz QQELIWUFXNNPQF-UHFFFAOYSA-N 0 0 397.309 3.451 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCO2)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000005839407 204152527 /nfs/dbraw/zinc/15/25/27/204152527.db2.gz XGKPNPUBIREAAL-UHFFFAOYSA-N 0 0 383.404 3.244 20 5 GGBDRN O=C(COC(=O)CCOc1ccccc1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000005857059 204154871 /nfs/dbraw/zinc/15/48/71/204154871.db2.gz SIFKNJBCNQECCQ-UHFFFAOYSA-N 0 0 378.768 3.199 20 5 GGBDRN COc1cc(CN2CCN(C/C=C\c3ccccc3)CC2)c([N+](=O)[O-])cc1OC ZINC000006008358 204161331 /nfs/dbraw/zinc/16/13/31/204161331.db2.gz SUSHZKJWXCYYRB-TWGQIWQCSA-N 0 0 397.475 3.443 20 5 GGBDRN Cc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000005414878 204131164 /nfs/dbraw/zinc/13/11/64/204131164.db2.gz WUYPJMOSJRKJJQ-CYBMUJFWSA-N 0 0 398.448 3.307 20 5 GGBDRN O=C(Nc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000005635863 204144773 /nfs/dbraw/zinc/14/47/73/204144773.db2.gz UHARKOSKFMVCHX-UHFFFAOYSA-N 0 0 389.433 3.022 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)COC(=O)c1cccc([N+](=O)[O-])c1 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Cc1ccc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)n[nH]2)cc1 ZINC000011494126 534182999 /nfs/dbraw/zinc/18/29/99/534182999.db2.gz UTSUIBDPDXBWAU-CYBMUJFWSA-N 0 0 394.387 3.477 20 5 GGBDRN CCO[C@H](C)c1nc(Cn2cc([N+](=O)[O-])cc(Br)c2=O)cs1 ZINC000120178089 564307478 /nfs/dbraw/zinc/30/74/78/564307478.db2.gz QUHWBBLVBBZCNG-MRVPVSSYSA-N 0 0 388.243 3.121 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000121499831 564371487 /nfs/dbraw/zinc/37/14/87/564371487.db2.gz ZCJIVHRUDBHYSR-NXEZZACHSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1ccccc1I ZINC000046136747 564496623 /nfs/dbraw/zinc/49/66/23/564496623.db2.gz SRKSNMLGZAUDCT-UHFFFAOYSA-N 0 0 382.157 3.129 20 5 GGBDRN CSC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000135391982 564829773 /nfs/dbraw/zinc/82/97/73/564829773.db2.gz XDOAVSYZFFXVDI-UHFFFAOYSA-N 0 0 394.234 3.071 20 5 GGBDRN Cc1oc(C(N)=O)cc1-c1csc(NC(=O)c2ccc([N+](=O)[O-])s2)n1 ZINC000114701937 564180291 /nfs/dbraw/zinc/18/02/91/564180291.db2.gz SUHGKJAGCYRPCB-UHFFFAOYSA-N 0 0 378.391 3.032 20 5 GGBDRN O=C(CCC1CC1)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000114997361 564185197 /nfs/dbraw/zinc/18/51/97/564185197.db2.gz CYPTZAAJHPQBCP-UHFFFAOYSA-N 0 0 381.435 3.013 20 5 GGBDRN COc1ccc(C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)cc1[N+](=O)[O-] ZINC000115268711 564188585 /nfs/dbraw/zinc/18/85/85/564188585.db2.gz YECAYWGLAFQZCZ-RUZDIDTESA-N 0 0 382.825 3.388 20 5 GGBDRN COc1ccc(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)cc1[N+](=O)[O-] ZINC000115268713 564188658 /nfs/dbraw/zinc/18/86/58/564188658.db2.gz YECAYWGLAFQZCZ-VWLOTQADSA-N 0 0 382.825 3.388 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)ccc1[N+](=O)[O-] ZINC000115268409 564188760 /nfs/dbraw/zinc/18/87/60/564188760.db2.gz VMNAJWQXRWRTHG-RUZDIDTESA-N 0 0 382.825 3.388 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(I)c[nH]1 ZINC000115316253 564190445 /nfs/dbraw/zinc/19/04/45/564190445.db2.gz HHESJDUQTQBBTL-UHFFFAOYSA-N 0 0 385.161 3.397 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCSC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000115590531 564196459 /nfs/dbraw/zinc/19/64/59/564196459.db2.gz HEAQQYIUARZCIA-KRWDZBQOSA-N 0 0 378.475 3.382 20 5 GGBDRN C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116276589 564207262 /nfs/dbraw/zinc/20/72/62/564207262.db2.gz AGTTUPJQXHVLLI-LLVKDONJSA-N 0 0 383.857 3.089 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC1(c2nccs2)CCCC1 ZINC000116366684 564208716 /nfs/dbraw/zinc/20/87/16/564208716.db2.gz AYRKUXQYWURABS-UHFFFAOYSA-N 0 0 387.870 3.453 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@@H](C)CCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000116449311 564210235 /nfs/dbraw/zinc/21/02/35/564210235.db2.gz SLOIRKUYKCNFBK-VIFPVBQESA-N 0 0 381.230 3.140 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000116676536 564214153 /nfs/dbraw/zinc/21/41/53/564214153.db2.gz PPQWNSLHBSJQIH-UHFFFAOYSA-N 0 0 382.825 3.354 20 5 GGBDRN O=C(Cn1cc(C(F)(F)F)cc(Cl)c1=O)Nc1ccccc1[N+](=O)[O-] ZINC000005317744 564215733 /nfs/dbraw/zinc/21/57/33/564215733.db2.gz INXRGBLHBYIVCM-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN C[S@@](=O)c1cccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116759175 564216192 /nfs/dbraw/zinc/21/61/92/564216192.db2.gz RDVRJCOLTFYZHE-VWLOTQADSA-N 0 0 382.825 3.393 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ncnc2sccc21 ZINC000006115666 564221385 /nfs/dbraw/zinc/22/13/85/564221385.db2.gz WCHJIMAYYBLYQK-UHFFFAOYSA-N 0 0 376.419 3.339 20 5 GGBDRN COc1ccc(NC(=O)CSc2ncnc3sccc32)c([N+](=O)[O-])c1 ZINC000006115662 564221720 /nfs/dbraw/zinc/22/17/20/564221720.db2.gz JWZZGUXWTFJHIE-UHFFFAOYSA-N 0 0 376.419 3.339 20 5 GGBDRN NC(=O)CSc1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117581966 564229454 /nfs/dbraw/zinc/22/94/54/564229454.db2.gz WPQZZRGHJPPTSF-UHFFFAOYSA-N 0 0 379.825 3.007 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)c1ccc(I)cc1 ZINC000007168739 564232870 /nfs/dbraw/zinc/23/28/70/564232870.db2.gz OQQWLTICZOBMBZ-UHFFFAOYSA-N 0 0 383.141 3.461 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)c1ccc(I)cc1 ZINC000007171137 564233010 /nfs/dbraw/zinc/23/30/10/564233010.db2.gz PJGHZZAFGKCULR-UHFFFAOYSA-N 0 0 383.141 3.461 20 5 GGBDRN CN(Cc1ccc(Br)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000007218208 564233844 /nfs/dbraw/zinc/23/38/44/564233844.db2.gz IJLKGZHIPOYPQC-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1F ZINC000007256847 564234459 /nfs/dbraw/zinc/23/44/59/564234459.db2.gz PCMOGUMVMJUJPL-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000007305756 564235181 /nfs/dbraw/zinc/23/51/81/564235181.db2.gz CVDIOTPYNZTBDC-SNVBAGLBSA-N 0 0 385.239 3.397 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000007473798 564237210 /nfs/dbraw/zinc/23/72/10/564237210.db2.gz CDUZPVZAUDJJNT-LLVKDONJSA-N 0 0 382.825 3.358 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)NCCOc1ccc(Cl)cc1 ZINC000007489955 564238037 /nfs/dbraw/zinc/23/80/37/564238037.db2.gz CINGRDMQZJDQJB-UHFFFAOYSA-N 0 0 385.203 3.476 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118384551 564239875 /nfs/dbraw/zinc/23/98/75/564239875.db2.gz ZKRXQTVNXQDYEV-OAHLLOKOSA-N 0 0 384.219 3.407 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2ccc(F)cc2)C(F)(F)F)cc1 ZINC000118435613 564240590 /nfs/dbraw/zinc/24/05/90/564240590.db2.gz QTVPUICPUNBYSK-ZDUSSCGKSA-N 0 0 378.303 3.316 20 5 GGBDRN NS(=O)(=O)c1ccc(NCCSc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000007903249 564243069 /nfs/dbraw/zinc/24/30/69/564243069.db2.gz MBDSXQYNNHDCBM-UHFFFAOYSA-N 0 0 387.870 3.100 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Br)cc1 ZINC000008007185 564244134 /nfs/dbraw/zinc/24/41/34/564244134.db2.gz HZXLKWKIFPOGKQ-JTQLQIEISA-N 0 0 392.209 3.114 20 5 GGBDRN O=C(CCc1ccc(Cl)s1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689089 564244354 /nfs/dbraw/zinc/24/43/54/564244354.db2.gz SVRSZEPDHRJAKV-LLVKDONJSA-N 0 0 380.857 3.350 20 5 GGBDRN CN(Cc1cccc(Cl)c1Cl)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000008050936 564244563 /nfs/dbraw/zinc/24/45/63/564244563.db2.gz QUNKSZNAZQYMSP-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN COc1ccc(Br)cc1CN(C)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000008051310 564244627 /nfs/dbraw/zinc/24/46/27/564244627.db2.gz MLZNLYLVBDNLIU-UHFFFAOYSA-N 0 0 394.225 3.101 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000008058587 564245495 /nfs/dbraw/zinc/24/54/95/564245495.db2.gz DRHYSRXCRRTLAO-UHFFFAOYSA-N 0 0 377.447 3.334 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000008059459 564245548 /nfs/dbraw/zinc/24/55/48/564245548.db2.gz XDEFKVYGTFRPHR-UHFFFAOYSA-N 0 0 377.447 3.034 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc(Br)ccc1F ZINC000008146337 564246206 /nfs/dbraw/zinc/24/62/06/564246206.db2.gz IJJKWEUEXKBPBW-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CN(CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(Br)s1 ZINC000008165344 564247340 /nfs/dbraw/zinc/24/73/40/564247340.db2.gz KAOSKSVKUATQDU-UHFFFAOYSA-N 0 0 384.255 3.489 20 5 GGBDRN COc1ccc(Br)c(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000008175294 564247352 /nfs/dbraw/zinc/24/73/52/564247352.db2.gz YHBSKVYVQCJBNS-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc(Br)cc3)C2)nc1 ZINC000118866507 564247587 /nfs/dbraw/zinc/24/75/87/564247587.db2.gz UNSONDYQFYOBKO-AWEZNQCLSA-N 0 0 377.242 3.439 20 5 GGBDRN O=C(Nc1nnc(C(F)F)s1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000118941196 564248515 /nfs/dbraw/zinc/24/85/15/564248515.db2.gz IBHRKKXLMLGFQF-UHFFFAOYSA-N 0 0 379.142 3.399 20 5 GGBDRN CC(C)[C@H]1OCCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000118978208 564249341 /nfs/dbraw/zinc/24/93/41/564249341.db2.gz YSPBXDDXHDTTMH-CXAGYDPISA-N 0 0 399.285 3.467 20 5 GGBDRN COc1ccc(Br)cc1Cn1cnc2ccc([N+](=O)[O-])cc2c1=O ZINC000008512430 564249989 /nfs/dbraw/zinc/24/99/89/564249989.db2.gz ZZQHABAOHHDDQG-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@H]1Cc2ccccc2O1 ZINC000119087480 564253992 /nfs/dbraw/zinc/25/39/92/564253992.db2.gz WJPHWZUHMGDNDT-CQSZACIVSA-N 0 0 391.221 3.020 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCO[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000119109970 564255075 /nfs/dbraw/zinc/25/50/75/564255075.db2.gz UHHOYEHPRMIBON-HIFRSBDPSA-N 0 0 383.242 3.449 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cncc(Br)c1 ZINC000119119322 564255153 /nfs/dbraw/zinc/25/51/53/564255153.db2.gz DNBGBVINBRAKAM-UHFFFAOYSA-N 0 0 394.181 3.166 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCO[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000119110061 564255387 /nfs/dbraw/zinc/25/53/87/564255387.db2.gz UHHOYEHPRMIBON-UKRRQHHQSA-N 0 0 383.242 3.449 20 5 GGBDRN COCc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000119151500 564256783 /nfs/dbraw/zinc/25/67/83/564256783.db2.gz DKLPMHZZGKKMEK-UHFFFAOYSA-N 0 0 393.237 3.363 20 5 GGBDRN C[C@H](Sc1ccc(Br)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCO1 ZINC000119161614 564257060 /nfs/dbraw/zinc/25/70/60/564257060.db2.gz PXPOMVCRAOGNHD-ONGXEEELSA-N 0 0 389.271 3.133 20 5 GGBDRN C[C@H](NC(=O)c1cccs1)C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000010904543 564261055 /nfs/dbraw/zinc/26/10/55/564261055.db2.gz QSAUAJGPBHFBIX-JTQLQIEISA-N 0 0 381.841 3.087 20 5 GGBDRN CN(Cc1ccccc1Br)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000011037355 564261795 /nfs/dbraw/zinc/26/17/95/564261795.db2.gz JDTWFJGGHRUPIZ-UHFFFAOYSA-N 0 0 379.210 3.395 20 5 GGBDRN CN(Cc1ccc(Br)cc1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000011037362 564261878 /nfs/dbraw/zinc/26/18/78/564261878.db2.gz ADNBPMOAQBZELK-UHFFFAOYSA-N 0 0 379.210 3.395 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(Br)c1 ZINC000012924197 564272272 /nfs/dbraw/zinc/27/22/72/564272272.db2.gz BSHUEVKKZRXSBL-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CCOC(=O)C1CCC(NC(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000119482686 564273643 /nfs/dbraw/zinc/27/36/43/564273643.db2.gz XDKPVAKLTBYPDN-UHFFFAOYSA-N 0 0 399.241 3.209 20 5 GGBDRN CN(CCCOc1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119551686 564276110 /nfs/dbraw/zinc/27/61/10/564276110.db2.gz QNPJYXORAKYXTA-UHFFFAOYSA-N 0 0 384.841 3.338 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccccc1Br)CC2 ZINC000014099086 564279373 /nfs/dbraw/zinc/27/93/73/564279373.db2.gz GBAPECGKLYJPEE-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN Cn1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccs1 ZINC000014062466 564279472 /nfs/dbraw/zinc/27/94/72/564279472.db2.gz KMPLMXXEOOHSOM-UHFFFAOYSA-N 0 0 375.435 3.183 20 5 GGBDRN CCN(C(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000119690652 564283053 /nfs/dbraw/zinc/28/30/53/564283053.db2.gz PSOQLFJCVUHKSW-UHFFFAOYSA-N 0 0 380.198 3.184 20 5 GGBDRN CC(C)(C)c1csc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)n1 ZINC000014793621 564283695 /nfs/dbraw/zinc/28/36/95/564283695.db2.gz LYBYWOIGIKDCMP-UHFFFAOYSA-N 0 0 383.451 3.005 20 5 GGBDRN O=C(CNc1ccc(Br)cc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000119699768 564283898 /nfs/dbraw/zinc/28/38/98/564283898.db2.gz JXOSCZJNCIXUIW-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1nc(C(F)(F)F)cs1 ZINC000119705800 564283938 /nfs/dbraw/zinc/28/39/38/564283938.db2.gz CZBVMSIGBXXXKD-UHFFFAOYSA-N 0 0 384.133 3.043 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2nnnn2-c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000015130744 564284054 /nfs/dbraw/zinc/28/40/54/564284054.db2.gz QNVMATYKMRUDFH-UHFFFAOYSA-N 0 0 378.757 3.283 20 5 GGBDRN CNS(=O)(=O)c1cccc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000119713298 564284671 /nfs/dbraw/zinc/28/46/71/564284671.db2.gz DXQNNZMDNSUYDX-NSHDSACASA-N 0 0 383.857 3.007 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2ccc(F)cc2Cl)c([N+](=O)[O-])c1 ZINC000015009739 564284756 /nfs/dbraw/zinc/28/47/56/564284756.db2.gz KDWNCJVXQMLNGA-UHFFFAOYSA-N 0 0 383.788 3.217 20 5 GGBDRN CNS(=O)(=O)c1ccc(NCCCSc2ccccc2)c([N+](=O)[O-])c1 ZINC000015168462 564284762 /nfs/dbraw/zinc/28/47/62/564284762.db2.gz IZZXFQMPRMTVQZ-UHFFFAOYSA-N 0 0 381.479 3.097 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCc1ccc(Cl)cc1Cl ZINC000015209590 564285155 /nfs/dbraw/zinc/28/51/55/564285155.db2.gz ZRQLTGDGPNCERC-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN O=C(CNc1cccc([N+](=O)[O-])c1)Nc1ccc(I)cc1 ZINC000015288898 564285663 /nfs/dbraw/zinc/28/56/63/564285663.db2.gz KEPLMYKOOKGUIH-UHFFFAOYSA-N 0 0 397.172 3.250 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000015365395 564286316 /nfs/dbraw/zinc/28/63/16/564286316.db2.gz AFIUKNDBDJHBMU-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000015365353 564286435 /nfs/dbraw/zinc/28/64/35/564286435.db2.gz VZAGYXMNADOIDR-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(=O)c1cccc(Br)c1 ZINC000015410891 564287592 /nfs/dbraw/zinc/28/75/92/564287592.db2.gz SMJMLRSHWVSFRX-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN COC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 ZINC000015789769 564289784 /nfs/dbraw/zinc/28/97/84/564289784.db2.gz AMNBGBUXKLXBHR-UHFFFAOYSA-N 0 0 380.809 3.302 20 5 GGBDRN Cc1c(NC(=O)CNC(=O)c2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000015790824 564290119 /nfs/dbraw/zinc/29/01/19/564290119.db2.gz HOTCQMLYLOGOCH-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN COc1ccc(CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1Br ZINC000015809420 564290306 /nfs/dbraw/zinc/29/03/06/564290306.db2.gz XLXOZCBTIOADEC-UHFFFAOYSA-N 0 0 391.177 3.162 20 5 GGBDRN CS(=O)(=O)c1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000016140312 564292409 /nfs/dbraw/zinc/29/24/09/564292409.db2.gz XAPMQBKRSPHDAX-UHFFFAOYSA-N 0 0 376.415 3.465 20 5 GGBDRN C[C@H](Sc1nnnn1C(C)(C)C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000016290644 564292658 /nfs/dbraw/zinc/29/26/58/564292658.db2.gz RRVSHLUOMYDCIX-QMMMGPOBSA-N 0 0 384.849 3.109 20 5 GGBDRN O=C(CSc1nnnn1C1CCCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000016371588 564293972 /nfs/dbraw/zinc/29/39/72/564293972.db2.gz UQDFIUKVRRNCGI-UHFFFAOYSA-N 0 0 382.833 3.081 20 5 GGBDRN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)Cc1ccccc1 ZINC000016444809 564294378 /nfs/dbraw/zinc/29/43/78/564294378.db2.gz CNVNFOUQKCYKEC-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN O=C(COc1ccc(Br)cc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000016743994 564295952 /nfs/dbraw/zinc/29/59/52/564295952.db2.gz SHAIVCRVJUAWIK-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN NS(=O)(=O)c1ccc(Sc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000016738013 564296289 /nfs/dbraw/zinc/29/62/89/564296289.db2.gz PVPMAOLHHTUXEN-UHFFFAOYSA-N 0 0 389.252 3.156 20 5 GGBDRN O=[N+]([O-])c1ccccc1CSc1ccc(S(=O)(=O)N2CCCC2)cn1 ZINC000017226241 564297290 /nfs/dbraw/zinc/29/72/90/564297290.db2.gz SOUNLDJAJULZEM-UHFFFAOYSA-N 0 0 379.463 3.067 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1 ZINC000017333938 564298205 /nfs/dbraw/zinc/29/82/05/564298205.db2.gz IQGLBWILCOHMDE-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(Cc3cccs3)CC2)cc1[N+](=O)[O-] ZINC000018147709 564301408 /nfs/dbraw/zinc/30/14/08/564301408.db2.gz BTLJAEHVSKJHAR-UHFFFAOYSA-N 0 0 377.491 3.336 20 5 GGBDRN COc1ccccc1CN(C)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000019683168 564303263 /nfs/dbraw/zinc/30/32/63/564303263.db2.gz DESLMXROGUMYCO-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc(F)cc1Br ZINC000020430708 564306834 /nfs/dbraw/zinc/30/68/34/564306834.db2.gz DVTAOPUHQHDUOW-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN O=C(CSc1nncs1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000020890622 564307804 /nfs/dbraw/zinc/30/78/04/564307804.db2.gz FTKHVVJMOQPZMD-UHFFFAOYSA-N 0 0 379.448 3.301 20 5 GGBDRN CS(=O)(=O)c1ccc(Sc2nnc(-c3cccs3)o2)c([N+](=O)[O-])c1 ZINC000020667455 564308140 /nfs/dbraw/zinc/30/81/40/564308140.db2.gz RMXXFWAINHPCEY-UHFFFAOYSA-N 0 0 383.432 3.261 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ccc(OC(F)(F)F)cc1 ZINC000120186131 564308691 /nfs/dbraw/zinc/30/86/91/564308691.db2.gz SACAOAQMDHKSFN-UHFFFAOYSA-N 0 0 393.115 3.466 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCc2cc(=O)n3cc(Br)ccc3n2)c1 ZINC000021614652 564311140 /nfs/dbraw/zinc/31/11/40/564311140.db2.gz OTRBIFBLKIJUOH-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(S(C)(=O)=O)ccc2F)cc1[N+](=O)[O-] ZINC000021833366 564311796 /nfs/dbraw/zinc/31/17/96/564311796.db2.gz MEBSIKJCJPNIIP-UHFFFAOYSA-N 0 0 384.410 3.112 20 5 GGBDRN CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1Br ZINC000022059015 564314260 /nfs/dbraw/zinc/31/42/60/564314260.db2.gz HFBPXRROEIVJLX-UHFFFAOYSA-N 0 0 392.253 3.452 20 5 GGBDRN O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1ccsc1 ZINC000022424218 564317709 /nfs/dbraw/zinc/31/77/09/564317709.db2.gz JPNIDEOFTHZNQK-UHFFFAOYSA-N 0 0 395.443 3.198 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CN(C)c1ccc([N+](=O)[O-])cn1 ZINC000022801799 564320419 /nfs/dbraw/zinc/32/04/19/564320419.db2.gz DRJCUCAETBUCEK-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1 ZINC000023227735 564323454 /nfs/dbraw/zinc/32/34/54/564323454.db2.gz FTIVDYHIXHPPRF-LLVKDONJSA-N 0 0 380.447 3.118 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1O ZINC000120532914 564325046 /nfs/dbraw/zinc/32/50/46/564325046.db2.gz KKQXZVLWXCYTPU-UHFFFAOYSA-N 0 0 395.209 3.344 20 5 GGBDRN O=C(Nc1cccc(-n2ccnn2)c1)c1ccc([N+](=O)[O-])cc1Br ZINC000120538917 564325165 /nfs/dbraw/zinc/32/51/65/564325165.db2.gz FDYODIPIUMXCDI-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NC2CCC(C(F)(F)F)CC2)cc1 ZINC000120611439 564328314 /nfs/dbraw/zinc/32/83/14/564328314.db2.gz RMNDOXKQKPTOOE-UHFFFAOYSA-N 0 0 380.388 3.178 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000120605204 564328763 /nfs/dbraw/zinc/32/87/63/564328763.db2.gz BDDMIUCBPLMLGS-STQMWFEESA-N 0 0 380.388 3.178 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000024434738 564330236 /nfs/dbraw/zinc/33/02/36/564330236.db2.gz LYOBWRRBKOIWSJ-OAHLLOKOSA-N 0 0 381.841 3.477 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)Nc3ccn(C)n3)cc2[N+](=O)[O-])n1 ZINC000024472826 564330455 /nfs/dbraw/zinc/33/04/55/564330455.db2.gz YNSDVJIKNNWHHS-UHFFFAOYSA-N 0 0 375.435 3.497 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC2(c3nccs3)CCCC2)c1C ZINC000120669886 564331630 /nfs/dbraw/zinc/33/16/30/564331630.db2.gz MUEFGKZSSUFFJF-UHFFFAOYSA-N 0 0 381.479 3.416 20 5 GGBDRN C[C@@H](Sc1nnc(C2CC2)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000024853048 564333284 /nfs/dbraw/zinc/33/32/84/564333284.db2.gz BLRCTYMDJWEGIV-MRVPVSSYSA-N 0 0 381.845 3.373 20 5 GGBDRN C[C@H](Sc1nnc(C2CC2)n1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000024966527 564334320 /nfs/dbraw/zinc/33/43/20/564334320.db2.gz JWHHIWOKTOMEPG-QMMMGPOBSA-N 0 0 381.845 3.373 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000120743116 564334677 /nfs/dbraw/zinc/33/46/77/564334677.db2.gz IJSXUASZKUEKSA-LBPRGKRZSA-N 0 0 377.447 3.119 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])sc1C ZINC000120756289 564336185 /nfs/dbraw/zinc/33/61/85/564336185.db2.gz HMURTMYYSQFTDA-UHFFFAOYSA-N 0 0 383.495 3.499 20 5 GGBDRN C[C@H](NC(=O)c1cc(I)cc([N+](=O)[O-])c1)c1cccnc1 ZINC000120809534 564338082 /nfs/dbraw/zinc/33/80/82/564338082.db2.gz LJMMXUPMFUZTFF-VIFPVBQESA-N 0 0 397.172 3.085 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000025376484 564338703 /nfs/dbraw/zinc/33/87/03/564338703.db2.gz ZZDKAOWJVRKMMF-ZJUUUORDSA-N 0 0 382.360 3.003 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2nccn2C(F)F)cc1[N+](=O)[O-] ZINC000120853211 564339783 /nfs/dbraw/zinc/33/97/83/564339783.db2.gz LPBVQLSIIXPZEM-UHFFFAOYSA-N 0 0 389.156 3.187 20 5 GGBDRN COCc1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000120943710 564344041 /nfs/dbraw/zinc/34/40/41/564344041.db2.gz UMPZXCOZRFNFEX-UHFFFAOYSA-N 0 0 393.237 3.363 20 5 GGBDRN O=C(NCc1ccc(Cl)s1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000026168605 564344482 /nfs/dbraw/zinc/34/44/82/564344482.db2.gz FVNFHVDWBXWRFI-UHFFFAOYSA-N 0 0 380.857 3.342 20 5 GGBDRN CC(=O)N(c1nnc(Sc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])s1)C1CC1 ZINC000026142083 564344770 /nfs/dbraw/zinc/34/47/70/564344770.db2.gz CYPJPMHVYCFDDH-UHFFFAOYSA-N 0 0 381.395 3.021 20 5 GGBDRN CN(CC(=O)Nc1ccccc1Br)Cc1ccccc1[N+](=O)[O-] ZINC000026346272 564345562 /nfs/dbraw/zinc/34/55/62/564345562.db2.gz HIYAHXLLJXPBKN-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN Cc1cnc([C@H](NS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C2CC2)s1 ZINC000120970166 564346322 /nfs/dbraw/zinc/34/63/22/564346322.db2.gz QFVDCSFEWMRPGW-CQSZACIVSA-N 0 0 381.479 3.406 20 5 GGBDRN CCNc1nnc(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)s1 ZINC000026415444 564347162 /nfs/dbraw/zinc/34/71/62/564347162.db2.gz VIJCHSDHGNGWDR-UHFFFAOYSA-N 0 0 383.455 3.008 20 5 GGBDRN CN(Cc1ccccc1Br)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000026711974 564348579 /nfs/dbraw/zinc/34/85/79/564348579.db2.gz DYPWMLPLXDFIDV-HNNXBMFYSA-N 0 0 395.253 3.229 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(S(C)(=O)=O)ccc2C)c1 ZINC000026863074 564350558 /nfs/dbraw/zinc/35/05/58/564350558.db2.gz OZUZTJGHGOSMLL-UHFFFAOYSA-N 0 0 380.447 3.281 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cccc(Br)c3)CC2)cn1 ZINC000027231195 564352979 /nfs/dbraw/zinc/35/29/79/564352979.db2.gz UNKAWIOPXIMSDY-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCC[C@H]2c2ccccc2Br)c1[N+](=O)[O-] ZINC000121100386 564353188 /nfs/dbraw/zinc/35/31/88/564353188.db2.gz KYMVBWJRHQZGPV-ZDUSSCGKSA-N 0 0 393.241 3.377 20 5 GGBDRN O=C(COc1cccc(I)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000027252299 564353599 /nfs/dbraw/zinc/35/35/99/564353599.db2.gz CITCFNNVKROSPO-UHFFFAOYSA-N 0 0 398.156 3.217 20 5 GGBDRN CCOC(=O)[C@H]1CCCCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000121109915 564354247 /nfs/dbraw/zinc/35/42/47/564354247.db2.gz UCUGXANLZDXSRR-CYBMUJFWSA-N 0 0 399.241 3.224 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3nc(C)cs3)CC2)c1 ZINC000027777080 564356751 /nfs/dbraw/zinc/35/67/51/564356751.db2.gz DFGANXZVBSYBLN-UHFFFAOYSA-N 0 0 378.479 3.044 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCOc1cccc(Br)c1 ZINC000028004935 564359021 /nfs/dbraw/zinc/35/90/21/564359021.db2.gz HJUZEVQTTNJSHF-UHFFFAOYSA-N 0 0 379.166 3.344 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(Br)s1 ZINC000028060254 564359600 /nfs/dbraw/zinc/35/96/00/564359600.db2.gz KRBMNKNKYQPUOV-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Br)cc1 ZINC000028091371 564360637 /nfs/dbraw/zinc/36/06/37/564360637.db2.gz HZXLKWKIFPOGKQ-SNVBAGLBSA-N 0 0 392.209 3.114 20 5 GGBDRN C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000121241783 564360990 /nfs/dbraw/zinc/36/09/90/564360990.db2.gz AKMWPXAVDFZKIP-JTQLQIEISA-N 0 0 386.239 3.029 20 5 GGBDRN COc1ccc(C)cc1CNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000028321079 564361655 /nfs/dbraw/zinc/36/16/55/564361655.db2.gz MNFDSWBQRWJTME-UHFFFAOYSA-N 0 0 384.841 3.352 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ncc(Cc2ccccc2Cl)s1 ZINC000028505781 564363672 /nfs/dbraw/zinc/36/36/72/564363672.db2.gz AWXABRXSISRQDU-UHFFFAOYSA-N 0 0 377.813 3.131 20 5 GGBDRN COC(=O)[C@@H](C)CN(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)C1CC1 ZINC000121300253 564363913 /nfs/dbraw/zinc/36/39/13/564363913.db2.gz XBOPVEGHLOORIN-VIFPVBQESA-N 0 0 399.241 3.079 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cc3c(cc2Cl)OCO3)c1C ZINC000028782441 564364849 /nfs/dbraw/zinc/36/48/49/564364849.db2.gz HGPIHTLHJGBLTR-UHFFFAOYSA-N 0 0 384.797 3.395 20 5 GGBDRN O=C(Nc1n[nH]c(-c2ccccc2Br)n1)c1ccccc1[N+](=O)[O-] ZINC000028899502 564365674 /nfs/dbraw/zinc/36/56/74/564365674.db2.gz GRPVKXMUWCUTHJ-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(C(N)=O)c1 ZINC000029019524 564366184 /nfs/dbraw/zinc/36/61/84/564366184.db2.gz XXWVFCGDBJRADG-SECBINFHSA-N 0 0 379.825 3.466 20 5 GGBDRN O=C(NCc1ccc(Br)s1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000029166724 564368203 /nfs/dbraw/zinc/36/82/03/564368203.db2.gz MBGGAVNRDLWNKM-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN O=C(c1ccc(I)cc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000029250638 564368335 /nfs/dbraw/zinc/36/83/35/564368335.db2.gz RXKJAEFQXGODSN-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000029387649 564369792 /nfs/dbraw/zinc/36/97/92/564369792.db2.gz IKLXBBGEFRHUEY-WDEREUQCSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CSc1nnc(NC[C@H]2CCCO2)s1 ZINC000029741492 564372386 /nfs/dbraw/zinc/37/23/86/564372386.db2.gz AFXUESODNRGMJT-GFCCVEGCSA-N 0 0 382.467 3.338 20 5 GGBDRN COc1cc(-c2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)ccn1 ZINC000121528490 564372887 /nfs/dbraw/zinc/37/28/87/564372887.db2.gz NJUOIHKZBRGHFS-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000121548754 564373699 /nfs/dbraw/zinc/37/36/99/564373699.db2.gz WJGUHHWCYPMPNL-UHFFFAOYSA-N 0 0 382.825 3.354 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c(C)n1 ZINC000121537557 564373708 /nfs/dbraw/zinc/37/37/08/564373708.db2.gz SZQCCXHALXYYQK-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121547046 564373899 /nfs/dbraw/zinc/37/38/99/564373899.db2.gz MYYIXBAXPAVORA-ZNMIVQPWSA-N 0 0 395.253 3.435 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1cccc(Cl)c1 ZINC000029940213 564375847 /nfs/dbraw/zinc/37/58/47/564375847.db2.gz YNAFXKKMEWLBCR-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN COc1ccc(C)cc1CCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000029969891 564375876 /nfs/dbraw/zinc/37/58/76/564375876.db2.gz BWBYTWUAVIHZDI-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN Cc1ccc(OCCNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(C)c1 ZINC000029969589 564375937 /nfs/dbraw/zinc/37/59/37/564375937.db2.gz CEMLFCUJGYTLHA-UHFFFAOYSA-N 0 0 384.841 3.222 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)cc1 ZINC000121600705 564376887 /nfs/dbraw/zinc/37/68/87/564376887.db2.gz LNSCZQFIVWOPPC-IUODEOHRSA-N 0 0 384.816 3.363 20 5 GGBDRN O=C(Nc1cc(Br)cc(C(F)(F)F)c1)c1n[nH]cc1[N+](=O)[O-] ZINC000121658232 564379866 /nfs/dbraw/zinc/37/98/66/564379866.db2.gz XSPHAVXXMGBFDZ-UHFFFAOYSA-N 0 0 379.092 3.352 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1csc(Br)c1 ZINC000030444639 564381305 /nfs/dbraw/zinc/38/13/05/564381305.db2.gz GKUUUOUDPHJFST-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1csc(Br)c1 ZINC000030444699 564381239 /nfs/dbraw/zinc/38/12/39/564381239.db2.gz OOOKEDYWSVNMAQ-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1csc(Br)c1 ZINC000031202903 564387234 /nfs/dbraw/zinc/38/72/34/564387234.db2.gz WOILRQCCJNFUTC-UHFFFAOYSA-N 0 0 399.270 3.330 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCSc1nnc(-c2ccc(Cl)cc2)o1 ZINC000121840782 564389359 /nfs/dbraw/zinc/38/93/59/564389359.db2.gz DAQOJQCJZRCLOC-UHFFFAOYSA-N 0 0 378.797 3.252 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(NC4CC4)s3)n2)c1 ZINC000031845575 564393883 /nfs/dbraw/zinc/39/38/83/564393883.db2.gz YUUBNKURWGLUKE-UHFFFAOYSA-N 0 0 376.423 3.363 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)nc1 ZINC000121982867 564395299 /nfs/dbraw/zinc/39/52/99/564395299.db2.gz NJDVJIWOKZGRTC-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000032412647 564398389 /nfs/dbraw/zinc/39/83/89/564398389.db2.gz LOGHBTQJGOOBMS-UWVGGRQHSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3ccc(Cl)cc3C2)cc1[N+](=O)[O-] ZINC000122075972 564398976 /nfs/dbraw/zinc/39/89/76/564398976.db2.gz VXVUYFOURJRCET-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN Cc1nc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)sc1C ZINC000122075939 564399325 /nfs/dbraw/zinc/39/93/25/564399325.db2.gz MXGJYSDKUUXAFI-UHFFFAOYSA-N 0 0 384.255 3.290 20 5 GGBDRN O=[N+]([O-])c1cc(CS(=O)(=O)Cc2cccc(Cl)c2)c2c(c1)COCO2 ZINC000122119934 564401632 /nfs/dbraw/zinc/40/16/32/564401632.db2.gz YUZYFDCKCYMSCR-UHFFFAOYSA-N 0 0 383.809 3.230 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc(C2SCCCS2)cc1 ZINC000122212100 564404434 /nfs/dbraw/zinc/40/44/34/564404434.db2.gz ZALGMNDYIPVHSW-UHFFFAOYSA-N 0 0 378.479 3.090 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1ccc(CCO)cc1 ZINC000122276610 564406815 /nfs/dbraw/zinc/40/68/15/564406815.db2.gz UIKOVSYSXMIGNJ-UHFFFAOYSA-N 0 0 379.210 3.073 20 5 GGBDRN O=[N+]([O-])c1cc(CS(=O)(=O)Cc2ccccc2Cl)c2c(c1)COCO2 ZINC000122269260 564406879 /nfs/dbraw/zinc/40/68/79/564406879.db2.gz KNCPUEBEXSSUSJ-UHFFFAOYSA-N 0 0 383.809 3.230 20 5 GGBDRN O=C(c1cc(Cl)cc(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000033110455 564410594 /nfs/dbraw/zinc/41/05/94/564410594.db2.gz BLIRVNJDWNEOOU-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000033193768 564412137 /nfs/dbraw/zinc/41/21/37/564412137.db2.gz RHQSSHRBNQAFLO-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc([N+](=O)[O-])c1 ZINC000122446011 564414847 /nfs/dbraw/zinc/41/48/47/564414847.db2.gz NUSBRZIBBWHNEQ-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN CCOCCC1(CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000122543125 564418402 /nfs/dbraw/zinc/41/84/02/564418402.db2.gz XSLJKEZMYJHPCA-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN O=C(Cc1ccccc1Br)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122586750 564420232 /nfs/dbraw/zinc/42/02/32/564420232.db2.gz LTOSOKZBMYOISE-UHFFFAOYSA-N 0 0 375.182 3.415 20 5 GGBDRN O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1ccc(Br)cc1 ZINC000122687272 564423255 /nfs/dbraw/zinc/42/32/55/564423255.db2.gz GWWNOAQQBUZCMC-UHFFFAOYSA-N 0 0 377.150 3.148 20 5 GGBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])NCc1ccc(F)cc1 ZINC000122767174 564426529 /nfs/dbraw/zinc/42/65/29/564426529.db2.gz DPVDUCNEJFNGGI-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN COc1ccccc1CNC(=O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000122759336 564427019 /nfs/dbraw/zinc/42/70/19/564427019.db2.gz MOASNJAVKXCDEH-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN Cc1cccc(CNC(=O)COc2c(Br)cccc2[N+](=O)[O-])c1 ZINC000122833863 564428557 /nfs/dbraw/zinc/42/85/57/564428557.db2.gz UXHXGTDBJMYSAT-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](c1cccs1)c1ccc(Cl)cc1 ZINC000041136539 564429321 /nfs/dbraw/zinc/42/93/21/564429321.db2.gz LSJCGSJWPIKGMU-INIZCTEOSA-N 0 0 376.825 3.412 20 5 GGBDRN C[C@H](Sc1ccc(Br)cc1[N+](=O)[O-])c1nc(-c2nc[nH]n2)no1 ZINC000122852340 564429828 /nfs/dbraw/zinc/42/98/28/564429828.db2.gz MTONJJDWNYAPOZ-LURJTMIESA-N 0 0 397.214 3.379 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C2CC2)cc1 ZINC000122923845 564432383 /nfs/dbraw/zinc/43/23/83/564432383.db2.gz UOMOFDKNXLOXBK-MRXNPFEDSA-N 0 0 382.463 3.403 20 5 GGBDRN COC(=O)c1cc(C(=O)N(C)Cc2ccc(Br)o2)cc([N+](=O)[O-])c1 ZINC000041396010 564432955 /nfs/dbraw/zinc/43/29/55/564432955.db2.gz GQHKOOAZKLOJLF-UHFFFAOYSA-N 0 0 397.181 3.009 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)CCCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000123105552 564438629 /nfs/dbraw/zinc/43/86/29/564438629.db2.gz JNHADAVNVHOUQL-UHFFFAOYSA-N 0 0 388.442 3.193 20 5 GGBDRN CN(Cc1ccc(Br)o1)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000042107618 564441599 /nfs/dbraw/zinc/44/15/99/564441599.db2.gz FJHIGMCWCVVYQS-UHFFFAOYSA-N 0 0 394.225 3.479 20 5 GGBDRN O=C(NCc1csc(Br)c1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000042079145 564441653 /nfs/dbraw/zinc/44/16/53/564441653.db2.gz VKJUNQRVIUAHEI-UHFFFAOYSA-N 0 0 381.211 3.225 20 5 GGBDRN CS(=O)(=O)c1ccc(NCc2csc(Br)c2)c([N+](=O)[O-])c1 ZINC000042110659 564441874 /nfs/dbraw/zinc/44/18/74/564441874.db2.gz MVPWKOAWEQCQFA-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2cc(Br)cs2)cc1[N+](=O)[O-] ZINC000123212851 564441941 /nfs/dbraw/zinc/44/19/41/564441941.db2.gz JQADJMVAHKIAFM-UHFFFAOYSA-N 0 0 397.297 3.267 20 5 GGBDRN CCCOCc1ccccc1CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000123223109 564442081 /nfs/dbraw/zinc/44/20/81/564442081.db2.gz YHDQMCVYOYYXHA-UHFFFAOYSA-N 0 0 384.479 3.370 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cccc3c2C(=O)NC3)cc1[N+](=O)[O-] ZINC000123214734 564442228 /nfs/dbraw/zinc/44/22/28/564442228.db2.gz SVZLOWGPRVVFFD-UHFFFAOYSA-N 0 0 390.193 3.161 20 5 GGBDRN CN(Cc1cc(Br)cs1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000042266996 564444509 /nfs/dbraw/zinc/44/45/09/564444509.db2.gz FWGRTOVOKSNJNJ-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN C[C@@]1(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000123368764 564446047 /nfs/dbraw/zinc/44/60/47/564446047.db2.gz BLSPPTZRKHWGTB-AWEZNQCLSA-N 0 0 378.372 3.391 20 5 GGBDRN Cc1csc(CCCCNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)n1 ZINC000123550970 564452297 /nfs/dbraw/zinc/45/22/97/564452297.db2.gz BFXQKTLVKMVMIR-UHFFFAOYSA-N 0 0 375.497 3.031 20 5 GGBDRN Cc1cc(Oc2ncc(I)cn2)c(F)cc1[N+](=O)[O-] ZINC000123661155 564457107 /nfs/dbraw/zinc/45/71/07/564457107.db2.gz YHFOQWLFQFMLED-UHFFFAOYSA-N 0 0 375.097 3.229 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCc2c(F)cc(F)cc2C1 ZINC000123694198 564458046 /nfs/dbraw/zinc/45/80/46/564458046.db2.gz CMXFBHMBDULVBA-UHFFFAOYSA-N 0 0 388.779 3.273 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cn(Cc2sc3ccccc3c2Cl)c1=O ZINC000043929455 564463222 /nfs/dbraw/zinc/46/32/22/564463222.db2.gz VYPNBQABKRRJPU-UHFFFAOYSA-N 0 0 378.793 3.460 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCCC[C@H]1c1ncon1 ZINC000123873521 564464377 /nfs/dbraw/zinc/46/43/77/564464377.db2.gz UAEMPJAFVGLMAN-NSHDSACASA-N 0 0 381.186 3.108 20 5 GGBDRN CN(Cc1cc(Br)cs1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000044631339 564470717 /nfs/dbraw/zinc/47/07/17/564470717.db2.gz DKVFTKSJXVJXMS-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000124157941 564473271 /nfs/dbraw/zinc/47/32/71/564473271.db2.gz LMUAKRSNDWISSH-FZMZJTMJSA-N 0 0 376.500 3.084 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000124158609 564473516 /nfs/dbraw/zinc/47/35/16/564473516.db2.gz LMUAKRSNDWISSH-BXUZGUMPSA-N 0 0 376.500 3.084 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)sc1C ZINC000124184186 564473861 /nfs/dbraw/zinc/47/38/61/564473861.db2.gz SONVYXDWQNKQDH-UHFFFAOYSA-N 0 0 375.497 3.252 20 5 GGBDRN O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)Nc1cc(Cl)ccc1Cl ZINC000045021864 564477118 /nfs/dbraw/zinc/47/71/18/564477118.db2.gz UBTWTMRLHRLNCP-UHFFFAOYSA-N 0 0 382.159 3.448 20 5 GGBDRN CC[C@](C)(NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)c1nc(C)cs1 ZINC000124599235 564487429 /nfs/dbraw/zinc/48/74/29/564487429.db2.gz GHAAPHVYNGBQAS-ZDUSSCGKSA-N 0 0 375.497 3.333 20 5 GGBDRN CC[C@@](C)(NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)c1nc(C)cs1 ZINC000124599462 564487738 /nfs/dbraw/zinc/48/77/38/564487738.db2.gz GHAAPHVYNGBQAS-CYBMUJFWSA-N 0 0 375.497 3.333 20 5 GGBDRN Cc1cnc(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)s1 ZINC000124642955 564488166 /nfs/dbraw/zinc/48/81/66/564488166.db2.gz WWWXUUKVYCIABJ-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1cc(Br)ccc1F ZINC000045931455 564491490 /nfs/dbraw/zinc/49/14/90/564491490.db2.gz WKTGGPYCMVDAMH-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000124779780 564492207 /nfs/dbraw/zinc/49/22/07/564492207.db2.gz YLETVZNUGNJESB-NSHDSACASA-N 0 0 384.479 3.225 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)Cc1ccccc1Br ZINC000046034208 564493071 /nfs/dbraw/zinc/49/30/71/564493071.db2.gz KHQNOJOSTIAEFB-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN C[C@H](Oc1ccc(Br)cc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000046136769 564496354 /nfs/dbraw/zinc/49/63/54/564496354.db2.gz BYNUAJHKVAYAHW-NSHDSACASA-N 0 0 379.210 3.441 20 5 GGBDRN O=C(COc1ccc(Br)cc1F)NCc1ccccc1[N+](=O)[O-] ZINC000046135916 564496418 /nfs/dbraw/zinc/49/64/18/564496418.db2.gz PINXROQUEDYCLR-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN CN1CCN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])c2cc(Cl)ccc21 ZINC000124914575 564497388 /nfs/dbraw/zinc/49/73/88/564497388.db2.gz JQNHTUGYJMRGDZ-UHFFFAOYSA-N 0 0 381.841 3.034 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2cc(Br)cs2)cc([N+](=O)[O-])c1 ZINC000046257310 564500737 /nfs/dbraw/zinc/50/07/37/564500737.db2.gz WZGNAIDHXKJZEG-UHFFFAOYSA-N 0 0 399.222 3.135 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000125060064 564501809 /nfs/dbraw/zinc/50/18/09/564501809.db2.gz PBAJKOGMNVCBNN-UHFFFAOYSA-N 0 0 387.230 3.127 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000046868965 564508685 /nfs/dbraw/zinc/50/86/85/564508685.db2.gz BJKVCPRRAQNLDB-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN CN(Cc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1Br ZINC000046814778 564509489 /nfs/dbraw/zinc/50/94/89/564509489.db2.gz JTIJAFIILVOSIT-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN O=C(NC[C@H]1CCN(CC(F)(F)F)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000046956430 564510675 /nfs/dbraw/zinc/51/06/75/564510675.db2.gz GVOWOWQIYVPODR-SECBINFHSA-N 0 0 380.754 3.254 20 5 GGBDRN CNc1ccc(C(=O)NCCNc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000047163646 564514683 /nfs/dbraw/zinc/51/46/83/564514683.db2.gz GAAHQCOREYQKQH-UHFFFAOYSA-N 0 0 384.223 3.180 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3nccn3C)cs2)c1 ZINC000125547556 564518494 /nfs/dbraw/zinc/51/84/94/564518494.db2.gz MCALCOCTFQHCEV-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN O=c1c2cc(Br)ccc2ncn1CCOc1ccccc1[N+](=O)[O-] ZINC000047368636 564519263 /nfs/dbraw/zinc/51/92/63/564519263.db2.gz GJBCTRLCANWMDC-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN CN(C)c1cccc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000125591550 564519367 /nfs/dbraw/zinc/51/93/67/564519367.db2.gz OICAHGZDFFDEAM-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN CN(Cc1ccc(O)cc1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000125653718 564521944 /nfs/dbraw/zinc/52/19/44/564521944.db2.gz ISICDSRNPKZWCC-UHFFFAOYSA-N 0 0 379.210 3.264 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2nc3ccccc3s2)c(Cl)c1 ZINC000047543160 564522769 /nfs/dbraw/zinc/52/27/69/564522769.db2.gz VSWZCMLMWUPMJZ-UHFFFAOYSA-N 0 0 383.838 3.336 20 5 GGBDRN C[C@H](Oc1cccc(Br)c1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125823182 564528013 /nfs/dbraw/zinc/52/80/13/564528013.db2.gz JVCHCFVHJQPVJP-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCCc2nc3ccccc3s2)s1 ZINC000125901276 564530218 /nfs/dbraw/zinc/53/02/18/564530218.db2.gz BFJSBKBDFLNWEF-UHFFFAOYSA-N 0 0 383.476 3.324 20 5 GGBDRN O=C(CCOc1ccccc1Br)NCCc1cccc([N+](=O)[O-])c1 ZINC000125919075 564531172 /nfs/dbraw/zinc/53/11/72/564531172.db2.gz MGBBECMFWQGIAZ-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN O=C(N[C@@H]1CCc2c1cccc2O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000125950204 564532006 /nfs/dbraw/zinc/53/20/06/564532006.db2.gz VIKKXEWHIZMMPE-CQSZACIVSA-N 0 0 377.194 3.480 20 5 GGBDRN CN(Cc1ccccc1Br)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000048244839 564534647 /nfs/dbraw/zinc/53/46/47/564534647.db2.gz DFSZCSZZUQMOBV-UHFFFAOYSA-N 0 0 382.189 3.351 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126054078 564534881 /nfs/dbraw/zinc/53/48/81/564534881.db2.gz WMPZYTYZKUVKRG-UHFFFAOYSA-N 0 0 395.257 3.080 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc(I)cc1 ZINC000048442560 564540297 /nfs/dbraw/zinc/54/02/97/564540297.db2.gz QOQZXYFHLBCZTA-UHFFFAOYSA-N 0 0 382.157 3.129 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc(Br)s1)c1cccc([N+](=O)[O-])c1 ZINC000048445470 564540454 /nfs/dbraw/zinc/54/04/54/564540454.db2.gz BYRWYLDHBCDREG-MRVPVSSYSA-N 0 0 391.268 3.458 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccccc1I ZINC000048442562 564540467 /nfs/dbraw/zinc/54/04/67/564540467.db2.gz RWOXXTJJOXHUDB-UHFFFAOYSA-N 0 0 382.157 3.129 20 5 GGBDRN CCCN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000126212826 564540949 /nfs/dbraw/zinc/54/09/49/564540949.db2.gz SBKNPSQYJXLOLB-SNVBAGLBSA-N 0 0 386.239 3.493 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCc1cc(Cl)cc(Cl)c1OC(F)F ZINC000126276644 564543588 /nfs/dbraw/zinc/54/35/88/564543588.db2.gz ZHGRFKGCUFUNNT-UHFFFAOYSA-N 0 0 395.149 3.167 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2nc(-c3cccs3)no2)cccc1[N+](=O)[O-] ZINC000048717591 564544395 /nfs/dbraw/zinc/54/43/95/564544395.db2.gz LJKXWHYCWUDXNZ-UHFFFAOYSA-N 0 0 379.419 3.130 20 5 GGBDRN COc1ccc(CS(=O)(=O)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000048720860 564544585 /nfs/dbraw/zinc/54/45/85/564544585.db2.gz IDWWMWVFSNVRDS-UHFFFAOYSA-N 0 0 378.431 3.328 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cccc(I)c1 ZINC000048729504 564544758 /nfs/dbraw/zinc/54/47/58/564544758.db2.gz MNFTXLZVSNKGTF-UHFFFAOYSA-N 0 0 396.184 3.172 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cccc(I)c1 ZINC000049379776 564551340 /nfs/dbraw/zinc/55/13/40/564551340.db2.gz FMOLUTNLXDKKNO-UHFFFAOYSA-N 0 0 382.157 3.129 20 5 GGBDRN NC(=O)[C@@H](Sc1ncccc1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000126539446 564552252 /nfs/dbraw/zinc/55/22/52/564552252.db2.gz PUVPFLOWBJTGCN-NSHDSACASA-N 0 0 386.202 3.210 20 5 GGBDRN CN(Cc1ccc(Br)o1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126554009 564553417 /nfs/dbraw/zinc/55/34/17/564553417.db2.gz KDAPTDKLMKLJCX-UHFFFAOYSA-N 0 0 382.214 3.334 20 5 GGBDRN Cc1ccc(Br)c(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000126623776 564556346 /nfs/dbraw/zinc/55/63/46/564556346.db2.gz TZUUYTZEBSTBFL-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=C(COc1ccccc1I)c1cccc([N+](=O)[O-])c1 ZINC000050161568 564556544 /nfs/dbraw/zinc/55/65/44/564556544.db2.gz CVNRYODOFUPYLQ-UHFFFAOYSA-N 0 0 383.141 3.461 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000050120582 564556656 /nfs/dbraw/zinc/55/66/56/564556656.db2.gz BGIWROUZNQOSRR-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)CCO2 ZINC000126663254 564557470 /nfs/dbraw/zinc/55/74/70/564557470.db2.gz OAJRIDDKRLMQBB-UHFFFAOYSA-N 0 0 392.209 3.408 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1cccc(OC(F)F)c1 ZINC000051157518 564562159 /nfs/dbraw/zinc/56/21/59/564562159.db2.gz PAGBOKZJKASHLP-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN O=C(Nc1cc(Br)ccc1-n1cncn1)c1ccc([N+](=O)[O-])cc1 ZINC000051987441 564567824 /nfs/dbraw/zinc/56/78/24/564567824.db2.gz XPTCJOIHNMOVFY-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(CSc1nncn1CC(F)(F)F)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000051974580 564568035 /nfs/dbraw/zinc/56/80/35/564568035.db2.gz LBWSLGLHSLXYPF-UHFFFAOYSA-N 0 0 395.750 3.133 20 5 GGBDRN Cc1sc2nc(Sc3nc4sccn4c3[N+](=O)[O-])n(C)c(=O)c2c1C ZINC000052712994 564576579 /nfs/dbraw/zinc/57/65/79/564576579.db2.gz IRVNISDHVZFLGY-UHFFFAOYSA-N 0 0 393.475 3.380 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(O)(C(F)(F)F)CC1 ZINC000127205487 564577081 /nfs/dbraw/zinc/57/70/81/564577081.db2.gz LUVLVAIBRAVJMA-UHFFFAOYSA-N 0 0 378.372 3.236 20 5 GGBDRN CSCc1noc(CCC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)n1 ZINC000127198416 564577267 /nfs/dbraw/zinc/57/72/67/564577267.db2.gz SKGZXQFXWPDNGX-UHFFFAOYSA-N 0 0 384.845 3.085 20 5 GGBDRN CN(Cc1cc(Br)cs1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000052847924 564577613 /nfs/dbraw/zinc/57/76/13/564577613.db2.gz LGUVJNWFIWCYLV-UHFFFAOYSA-N 0 0 384.255 3.150 20 5 GGBDRN O=C(CSc1nnc(N2CCCC2)s1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000052911989 564578308 /nfs/dbraw/zinc/57/83/08/564578308.db2.gz STRVHARYSGAEAI-UHFFFAOYSA-N 0 0 399.885 3.431 20 5 GGBDRN O=C(CCSc1nnc(N2CCCC2)s1)Nc1ccccc1[N+](=O)[O-] ZINC000052911593 564578525 /nfs/dbraw/zinc/57/85/25/564578525.db2.gz SHUALFWLTSCGFS-UHFFFAOYSA-N 0 0 379.467 3.167 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(N2CCCC2)s1 ZINC000052912726 564579404 /nfs/dbraw/zinc/57/94/04/564579404.db2.gz XTSPCGKUWFJGED-UHFFFAOYSA-N 0 0 379.467 3.086 20 5 GGBDRN Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(C[NH+](C)C)c1 ZINC000127303239 564580337 /nfs/dbraw/zinc/58/03/37/564580337.db2.gz HXXPDABTKYASQM-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN Cc1cccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)n1 ZINC000127378815 564581636 /nfs/dbraw/zinc/58/16/36/564581636.db2.gz DBCBVSFZIUZKTJ-UHFFFAOYSA-N 0 0 375.328 3.142 20 5 GGBDRN O=C(COc1ccc(Br)cc1F)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053215838 564583000 /nfs/dbraw/zinc/58/30/00/564583000.db2.gz YFYZGMYIZLUHRB-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN O=C(COc1ccc(F)cc1Br)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053215937 564583275 /nfs/dbraw/zinc/58/32/75/564583275.db2.gz KXUYFAMSPVAOAL-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN O=C(CSc1ncccc1Br)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000127550096 564587858 /nfs/dbraw/zinc/58/78/58/564587858.db2.gz YGYRMMLZGYHDMU-UHFFFAOYSA-N 0 0 394.250 3.434 20 5 GGBDRN COc1cc(Cn2cc([N+](=O)[O-])cc(Br)c2=O)ccc1SC ZINC000127580761 564588828 /nfs/dbraw/zinc/58/88/28/564588828.db2.gz WPPBHDBUYNIKQM-UHFFFAOYSA-N 0 0 385.239 3.298 20 5 GGBDRN C[C@@H]1CN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)CO1 ZINC000127582867 564589129 /nfs/dbraw/zinc/58/91/29/564589129.db2.gz FZYQXZLDMRYVBY-NXEZZACHSA-N 0 0 378.372 3.342 20 5 GGBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000127638442 564590661 /nfs/dbraw/zinc/59/06/61/564590661.db2.gz FYYVRHLLMOFCJV-HNNXBMFYSA-N 0 0 387.274 3.059 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@@H]32)cc1[N+](=O)[O-] ZINC000127642613 564590706 /nfs/dbraw/zinc/59/07/06/564590706.db2.gz WNDCGPRVDMBQGT-UXIGCNINSA-N 0 0 383.242 3.353 20 5 GGBDRN Cc1nc(NC(=O)[C@@H]2COc3ccc(Br)cc32)ccc1[N+](=O)[O-] ZINC000127730914 564593417 /nfs/dbraw/zinc/59/34/17/564593417.db2.gz RFBZSAGQFDUURM-LLVKDONJSA-N 0 0 378.182 3.175 20 5 GGBDRN CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000127745804 564594309 /nfs/dbraw/zinc/59/43/09/564594309.db2.gz WHLRSINVVDTGAS-LLVKDONJSA-N 0 0 399.241 3.081 20 5 GGBDRN O=C(Cn1cnc([N+](=O)[O-])n1)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000053835036 564595266 /nfs/dbraw/zinc/59/52/66/564595266.db2.gz FUIXLEGBKYAGOL-UHFFFAOYSA-N 0 0 399.219 3.255 20 5 GGBDRN CNS(=O)(=O)c1ccc(Sc2c(F)cc(F)cc2F)c([N+](=O)[O-])c1 ZINC000054125353 564599418 /nfs/dbraw/zinc/59/94/18/564599418.db2.gz DGFMJPBOBOPBAA-UHFFFAOYSA-N 0 0 378.353 3.071 20 5 GGBDRN CC(C)CN(Cc1ccccc1Br)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000127882879 564599953 /nfs/dbraw/zinc/59/99/53/564599953.db2.gz GYHRNIDQFRGWLI-UHFFFAOYSA-N 0 0 395.257 3.389 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC[C@H]3OCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000127899974 564600159 /nfs/dbraw/zinc/60/01/59/564600159.db2.gz NKLDGGVCXBUMRA-IAQYHMDHSA-N 0 0 383.242 3.307 20 5 GGBDRN O=C(CSCC(F)(F)F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000127929212 564600449 /nfs/dbraw/zinc/60/04/49/564600449.db2.gz ZTXPPWCSBLSEBY-UHFFFAOYSA-N 0 0 378.372 3.260 20 5 GGBDRN CNc1ccc(C(=O)NCc2ccc(F)cc2Br)cc1[N+](=O)[O-] ZINC000054263853 564601965 /nfs/dbraw/zinc/60/19/65/564601965.db2.gz VAUVFSVEZHHMTK-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN O=C(NCCN1CCc2sccc2C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000054355285 564603304 /nfs/dbraw/zinc/60/33/04/564603304.db2.gz WDKGRGUPEZAHIM-UHFFFAOYSA-N 0 0 380.857 3.490 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](C)C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000127993883 564603767 /nfs/dbraw/zinc/60/37/67/564603767.db2.gz OIESIEKVXDKQAH-VIFPVBQESA-N 0 0 387.230 3.126 20 5 GGBDRN Cc1nnc(NC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)s1 ZINC000128092284 564606759 /nfs/dbraw/zinc/60/67/59/564606759.db2.gz XWAXVUSPPZUMPU-UHFFFAOYSA-N 0 0 399.219 3.500 20 5 GGBDRN O=C(NCCc1c(Cl)cccc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000054904768 564611573 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564799132 /nfs/dbraw/zinc/79/91/32/564799132.db2.gz NEUMHNCAWCFEKB-AWEZNQCLSA-N 0 0 391.225 3.337 20 5 GGBDRN COc1ccc(CC(=O)NCc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000067800110 564799835 /nfs/dbraw/zinc/79/98/35/564799835.db2.gz MQBOUZPANHHNNB-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN COc1ccc(CC(=O)NCc2cc(F)ccc2Br)cc1[N+](=O)[O-] ZINC000067817136 564800004 /nfs/dbraw/zinc/80/00/04/564800004.db2.gz OHXLWBGHIHQFDI-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN O=[N+]([O-])c1cccnc1SCc1nnnn1-c1ccccc1Br ZINC000067952491 564803970 /nfs/dbraw/zinc/80/39/70/564803970.db2.gz VJNYUSXCIWDMRM-UHFFFAOYSA-N 0 0 393.226 3.020 20 5 GGBDRN O=[N+]([O-])c1cc(C[S@](=O)Cc2csc(C3CC3)n2)c2c(c1)COCO2 ZINC000134516331 564805597 /nfs/dbraw/zinc/80/55/97/564805597.db2.gz UJGZYEAODREGEY-RUZDIDTESA-N 0 0 380.447 3.244 20 5 GGBDRN CC(C)(C(=O)N[C@@H]1CCc2c1cccc2Br)n1cc([N+](=O)[O-])cn1 ZINC000068031280 564806668 /nfs/dbraw/zinc/80/66/68/564806668.db2.gz LNINWHKAVSGBBG-CQSZACIVSA-N 0 0 393.241 3.093 20 5 GGBDRN O=C(NCCNC(=O)c1ccccc1Cl)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134597085 564808216 /nfs/dbraw/zinc/80/82/16/564808216.db2.gz ZSSJEICJUPJUNX-UHFFFAOYSA-N 0 0 382.203 3.061 20 5 GGBDRN COc1ccc(Br)c(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000068186755 564810826 /nfs/dbraw/zinc/81/08/26/564810826.db2.gz IGXPHCRQJGHCSP-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN O=C(NCCOc1ncc(Cl)cc1Cl)NCc1ccccc1[N+](=O)[O-] ZINC000134649202 564810938 /nfs/dbraw/zinc/81/09/38/564810938.db2.gz HNUXKCDNRJXLGS-UHFFFAOYSA-N 0 0 385.207 3.175 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCOC3(CCCCC3)C2)c(Cl)c1 ZINC000134671527 564811402 /nfs/dbraw/zinc/81/14/02/564811402.db2.gz JPWHQZACAKLJDC-LBPRGKRZSA-N 0 0 388.873 3.408 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000068218006 564811611 /nfs/dbraw/zinc/81/16/11/564811611.db2.gz KVNNRSRGKUDIFY-AWEZNQCLSA-N 0 0 393.241 3.226 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000068302223 564814248 /nfs/dbraw/zinc/81/42/48/564814248.db2.gz NEQWZQGUPQWQPA-UHFFFAOYSA-N 0 0 376.722 3.279 20 5 GGBDRN O=C(NCc1n[nH]cc1Br)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000068393411 564816981 /nfs/dbraw/zinc/81/69/81/564816981.db2.gz OHLPUJLLTNNBQB-UHFFFAOYSA-N 0 0 381.211 3.225 20 5 GGBDRN Cn1c(C2CCN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])CC2)n[nH]c1=S ZINC000068428250 564818193 /nfs/dbraw/zinc/81/81/93/564818193.db2.gz WFOUNEKSQPFYRU-UHFFFAOYSA-N 0 0 381.845 3.059 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H]1CCCc2sccc21 ZINC000135030604 564821888 /nfs/dbraw/zinc/82/18/88/564821888.db2.gz WVONVHGFPMCWRV-LBPRGKRZSA-N 0 0 379.825 3.442 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000135056537 564822894 /nfs/dbraw/zinc/82/28/94/564822894.db2.gz ZJZHGGMUZKQEBJ-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N[C@@H]1CCCc2sccc21 ZINC000135055355 564823360 /nfs/dbraw/zinc/82/33/60/564823360.db2.gz OHKOWJOHMKXUBR-GFCCVEGCSA-N 0 0 379.825 3.442 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000135191580 564825339 /nfs/dbraw/zinc/82/53/39/564825339.db2.gz OCBORTLIHABSJE-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN COc1ccc(Br)c(NC(=O)CNc2ccccc2[N+](=O)[O-])c1 ZINC000068768623 564826411 /nfs/dbraw/zinc/82/64/11/564826411.db2.gz HSOPECXOYAUOPY-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cccc3cccnc32)c(Cl)c1 ZINC000068838731 564827593 /nfs/dbraw/zinc/82/75/93/564827593.db2.gz OBQPIMJRMMWGNI-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN CSC[C@@H]1CCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000135431508 564831153 /nfs/dbraw/zinc/83/11/53/564831153.db2.gz AGQOPJTWIPBAOM-NSHDSACASA-N 0 0 388.287 3.123 20 5 GGBDRN CN(Cc1ccc(Br)o1)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000069149142 564833996 /nfs/dbraw/zinc/83/39/96/564833996.db2.gz ZCBJXVRPCAYBQE-UHFFFAOYSA-N 0 0 398.213 3.171 20 5 GGBDRN CC(C)(C(=O)N1CCc2c(Cl)cc(Cl)cc2C1)n1cc([N+](=O)[O-])cn1 ZINC000135610908 564836655 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O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCN(c2ncccc2Cl)CC1 ZINC000136950884 564856738 /nfs/dbraw/zinc/85/67/38/564856738.db2.gz ZQWOIRIQQFAUMM-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCCN(Cc2cscn2)CC1 ZINC000136874410 564856745 /nfs/dbraw/zinc/85/67/45/564856745.db2.gz OFTLMWGUJMOTHI-UHFFFAOYSA-N 0 0 380.857 3.053 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCOc1cccc(Br)c1 ZINC000072001194 564859404 /nfs/dbraw/zinc/85/94/04/564859404.db2.gz DJJCONKAFIWGPN-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN COc1cc(Br)c(CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000072088731 564862005 /nfs/dbraw/zinc/86/20/05/564862005.db2.gz BXVLDJRFYSMXOL-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=C(Cc1ccccc1I)NCc1cccc([N+](=O)[O-])c1 ZINC000137417832 564862386 /nfs/dbraw/zinc/86/23/86/564862386.db2.gz ATKWGWKWGLIGBV-UHFFFAOYSA-N 0 0 396.184 3.058 20 5 GGBDRN O=C(Cc1ccccc1I)NCc1ccc([N+](=O)[O-])cc1 ZINC000137346272 564862414 /nfs/dbraw/zinc/86/24/14/564862414.db2.gz XWRQVWKXPXEIRM-UHFFFAOYSA-N 0 0 396.184 3.058 20 5 GGBDRN O=C(Cc1cc(Br)ccc1F)NCCc1ccc([N+](=O)[O-])cc1 ZINC000137370929 564862486 /nfs/dbraw/zinc/86/24/86/564862486.db2.gz KZNKZEVFAWWNMO-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN CS(=O)(=O)c1cccc(NCc2cc(Br)cs2)c1[N+](=O)[O-] ZINC000137973316 564865007 /nfs/dbraw/zinc/86/50/07/564865007.db2.gz MTGLFIDABYSVCR-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN Cc1csc(C2(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3C)CCCC2)n1 ZINC000079035804 564865792 /nfs/dbraw/zinc/86/57/92/564865792.db2.gz MQXJXIFHFSBNNL-UHFFFAOYSA-N 0 0 381.479 3.416 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(CC(F)(F)F)CC2)c1 ZINC000078959858 564866126 /nfs/dbraw/zinc/86/61/26/564866126.db2.gz URXACVAYPBDRDL-UHFFFAOYSA-N 0 0 377.388 3.027 20 5 GGBDRN CC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000083843739 564867569 /nfs/dbraw/zinc/86/75/69/564867569.db2.gz KZOFOROXVXIHOS-UHFFFAOYSA-N 0 0 382.825 3.272 20 5 GGBDRN Cc1nnc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000079335621 564867814 /nfs/dbraw/zinc/86/78/14/564867814.db2.gz BEPLVFVNAWDZGK-UHFFFAOYSA-N 0 0 375.332 3.214 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1 ZINC000139448980 564868869 /nfs/dbraw/zinc/86/88/69/564868869.db2.gz PJMQMDFQVQYYSO-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN CS(=O)(=O)Nc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000139799113 564869852 /nfs/dbraw/zinc/86/98/52/564869852.db2.gz MVTHLTYEGDCPGL-UHFFFAOYSA-N 0 0 384.801 3.264 20 5 GGBDRN COc1ccc(S(=O)(=O)[N-]c2cc(C)c(Cl)cc2OC)c([N+](=O)[O-])c1 ZINC000142067465 564874371 /nfs/dbraw/zinc/87/43/71/564874371.db2.gz SBDOGSLPOHYADV-UHFFFAOYSA-N 0 0 386.813 3.375 20 5 GGBDRN O=C(NC[C@H](O)COc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000143783152 564876270 /nfs/dbraw/zinc/87/62/70/564876270.db2.gz UYJSYMPYKXREHW-LBPRGKRZSA-N 0 0 385.203 3.071 20 5 GGBDRN CCc1nn(C)c(NCC(=O)Nc2ccc(Br)cc2C)c1[N+](=O)[O-] ZINC000092826988 564882394 /nfs/dbraw/zinc/88/23/94/564882394.db2.gz GZGWLIKELFHQBG-UHFFFAOYSA-N 0 0 396.245 3.012 20 5 GGBDRN CCc1nn(C)c(N2CCO[C@@H](c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000092829152 564882759 /nfs/dbraw/zinc/88/27/59/564882759.db2.gz SAOJLRTUGUDMON-CQSZACIVSA-N 0 0 395.257 3.231 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCC[C@H]2c2ccsc2)cc([N+](=O)[O-])c1 ZINC000147037278 564882784 /nfs/dbraw/zinc/88/27/84/564882784.db2.gz FMPGDMUTJBVTPE-HNNXBMFYSA-N 0 0 380.447 3.037 20 5 GGBDRN CCc1nc(CN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 ZINC000147493676 564883102 /nfs/dbraw/zinc/88/31/02/564883102.db2.gz AXIKWHKJIMVXNW-UHFFFAOYSA-N 0 0 375.859 3.088 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1sccc1Br ZINC000148293059 564883978 /nfs/dbraw/zinc/88/39/78/564883978.db2.gz RFZUIRWORVTBKG-UHFFFAOYSA-N 0 0 391.268 3.038 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])sc1Br ZINC000150113781 564886726 /nfs/dbraw/zinc/88/67/26/564886726.db2.gz XJDUMOBJNQLGSZ-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN C[C@@H]1[C@@H](C)S(=O)(=O)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000093559409 564887534 /nfs/dbraw/zinc/88/75/34/564887534.db2.gz MJFUZWKOOGDPIY-CHWSQXEVSA-N 0 0 380.491 3.331 20 5 GGBDRN CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccc(Br)c([N+](=O)[O-])c1)CC2 ZINC000093613477 564887662 /nfs/dbraw/zinc/88/76/62/564887662.db2.gz BXCTXKAXBOGTDD-JKSUJKDBSA-N 0 0 399.285 3.109 20 5 GGBDRN COc1cccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000150718760 564887809 /nfs/dbraw/zinc/88/78/09/564887809.db2.gz YOESSYGSWFAGAN-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN COc1ccc(Br)c(CC(=O)Nc2ccc([N+](=O)[O-])c(C)n2)c1 ZINC000150697731 564888398 /nfs/dbraw/zinc/88/83/98/564888398.db2.gz ITHUSSMITCVJBD-UHFFFAOYSA-N 0 0 380.198 3.251 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H]2CCCC[C@@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000150782513 564889929 /nfs/dbraw/zinc/88/99/29/564889929.db2.gz RBBBRCKLJBYNMH-WDEREUQCSA-N 0 0 382.360 3.003 20 5 GGBDRN Cn1cc(C[C@H]2CCN(Cc3ccc(Br)c([N+](=O)[O-])c3)C2)cn1 ZINC000093870089 564891834 /nfs/dbraw/zinc/89/18/34/564891834.db2.gz NOPZUTMFAUFPIM-CYBMUJFWSA-N 0 0 379.258 3.155 20 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LUZJPXQXMNQIDV-SNVBAGLBSA-N 0 0 395.213 3.341 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000183619029 565082083 /nfs/dbraw/zinc/08/20/83/565082083.db2.gz XVVDSEBHUPOKFN-YVEFUNNKSA-N 0 0 384.885 3.494 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000183619010 565082233 /nfs/dbraw/zinc/08/22/33/565082233.db2.gz XVVDSEBHUPOKFN-PXAZEXFGSA-N 0 0 384.885 3.494 20 5 GGBDRN COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291887013 565083410 /nfs/dbraw/zinc/08/34/10/565083410.db2.gz WKHYXMPDTQEERO-QMMMGPOBSA-N 0 0 389.113 3.125 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCC1(CCO)CCCCC1 ZINC000156416280 565085886 /nfs/dbraw/zinc/08/58/86/565085886.db2.gz JMMOJMVKLRGIEK-UHFFFAOYSA-N 0 0 399.285 3.349 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1c2ccccc2C[C@@H]1O ZINC000183662082 565085992 /nfs/dbraw/zinc/08/59/92/565085992.db2.gz YFLPDUFIKYHEDQ-YOEHRIQHSA-N 0 0 378.837 3.115 20 5 GGBDRN 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O=[N+]([O-])c1cnc(NC[C@H]2CCN(CC(F)(F)F)C2)c(Br)c1 ZINC000267291354 565113059 /nfs/dbraw/zinc/11/30/59/565113059.db2.gz XVBBVMMJMSVRES-MRVPVSSYSA-N 0 0 383.168 3.048 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCC(OCC2CC2)CC1 ZINC000369828175 565114402 /nfs/dbraw/zinc/11/44/02/565114402.db2.gz CUQIONORVWGZKG-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000184116977 565114992 /nfs/dbraw/zinc/11/49/92/565114992.db2.gz VWCITPWONRAESP-LLVKDONJSA-N 0 0 380.857 3.224 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)Cc1nncn1C(C)C ZINC000292425878 565115298 /nfs/dbraw/zinc/11/52/98/565115298.db2.gz CNKUYOWENSXBSH-UHFFFAOYSA-N 0 0 396.245 3.110 20 5 GGBDRN C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H]1OCCc2sccc21 ZINC000292443621 565116432 /nfs/dbraw/zinc/11/64/32/565116432.db2.gz YMZLWFGCLJZKIE-MGPLVRAMSA-N 0 0 382.463 3.174 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCSCc1ccccc1F ZINC000184132301 565116577 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GGBDRN O=[N+]([O-])c1cccc(F)c1COc1c(CO)cc(Br)cc1CO ZINC000184172298 565117890 /nfs/dbraw/zinc/11/78/90/565117890.db2.gz BCAVGNMOHPPSKR-UHFFFAOYSA-N 0 0 386.173 3.060 20 5 GGBDRN COCCn1nc(C)c(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1C ZINC000267488312 565119870 /nfs/dbraw/zinc/11/98/70/565119870.db2.gz FIZHBTMOGLRHHL-UHFFFAOYSA-N 0 0 397.229 3.069 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1cccnc1 ZINC000292532951 565121074 /nfs/dbraw/zinc/12/10/74/565121074.db2.gz GKILQGQPZSXSEN-OAHLLOKOSA-N 0 0 381.841 3.415 20 5 GGBDRN Cc1nn(CCC(=O)N2Cc3cccc(Br)c3C2)c(C)c1[N+](=O)[O-] ZINC000184236440 565121468 /nfs/dbraw/zinc/12/14/68/565121468.db2.gz DZHIYGIUPQLEBB-UHFFFAOYSA-N 0 0 393.241 3.103 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2cccc3cnccc32)c(Cl)c1 ZINC000184251097 565122690 /nfs/dbraw/zinc/12/26/90/565122690.db2.gz IFCSBYVICILCJA-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2cccc3cccnc32)c(Cl)c1 ZINC000184248022 565122821 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Cc1nc(C)c(CS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000267888895 565133498 /nfs/dbraw/zinc/13/34/98/565133498.db2.gz SRZHYWOAZQGYGN-UHFFFAOYSA-N 0 0 391.268 3.405 20 5 GGBDRN Cc1nn(C)cc1[C@@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267907486 565133759 /nfs/dbraw/zinc/13/37/59/565133759.db2.gz BRNBBVNTVCWDND-SSDOTTSWSA-N 0 0 385.193 3.029 20 5 GGBDRN CCOC(=O)c1csc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)n1 ZINC000292780564 565134342 /nfs/dbraw/zinc/13/43/42/565134342.db2.gz LXZPLFSKZHQKHR-UHFFFAOYSA-N 0 0 382.419 3.064 20 5 GGBDRN C[C@]1(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCCC[C@H]1O ZINC000267915746 565134461 /nfs/dbraw/zinc/13/44/61/565134461.db2.gz HCOOUQWLDVLSJE-IUODEOHRSA-N 0 0 389.221 3.167 20 5 GGBDRN C[C@@H]1CCCCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000184410314 565134736 /nfs/dbraw/zinc/13/47/36/565134736.db2.gz OZHCKSQTRKSYAI-SNVBAGLBSA-N 0 0 388.205 3.462 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])[C@H]1c1cccnc1 ZINC000292780971 565134865 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GGBDRN COCCC1(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1 ZINC000269106192 565178386 /nfs/dbraw/zinc/17/83/86/565178386.db2.gz DQCUAXXQGFINFV-UHFFFAOYSA-N 0 0 375.194 3.043 20 5 GGBDRN COc1cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)sc1Br ZINC000158781772 565181234 /nfs/dbraw/zinc/18/12/34/565181234.db2.gz PYGYUPDEFJRETG-UHFFFAOYSA-N 0 0 385.239 3.400 20 5 GGBDRN O=C(NCCc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1Br ZINC000158798503 565182628 /nfs/dbraw/zinc/18/26/28/565182628.db2.gz PJVRIGMEXXEUPD-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN COC(=O)[C@H](NCc1ccccc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000158833392 565183273 /nfs/dbraw/zinc/18/32/73/565183273.db2.gz HXJZCBMQINXNEY-OAHLLOKOSA-N 0 0 379.210 3.361 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])c(C2CC2)n1)Nc1cccc(Br)c1 ZINC000185165217 565183375 /nfs/dbraw/zinc/18/33/75/565183375.db2.gz JHYRECCLSFRTEB-UHFFFAOYSA-N 0 0 379.214 3.460 20 5 GGBDRN CN(Cc1ccccc1Br)C(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1 ZINC000185175789 565184157 /nfs/dbraw/zinc/18/41/57/565184157.db2.gz 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/nfs/dbraw/zinc/19/82/72/565198272.db2.gz XCBDHCRDCHESDY-RUZDIDTESA-N 0 0 385.804 3.446 20 5 GGBDRN CC[C@@H]1[C@@H](C)CCN1C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000185413496 565200584 /nfs/dbraw/zinc/20/05/84/565200584.db2.gz FRVVUOKUNXGICG-TVQRCGJNSA-N 0 0 388.205 3.460 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCSC[C@H]2c2nccs2)c1C ZINC000185423961 565200697 /nfs/dbraw/zinc/20/06/97/565200697.db2.gz BTGUQWWAZSYEEQ-ZDUSSCGKSA-N 0 0 399.519 3.147 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCSC[C@@H]1c1nccs1 ZINC000185431355 565201748 /nfs/dbraw/zinc/20/17/48/565201748.db2.gz KNTVZRJVWCNAOY-CYBMUJFWSA-N 0 0 399.519 3.147 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000269918464 565203270 /nfs/dbraw/zinc/20/32/70/565203270.db2.gz FAABYIYUBCRAPD-FZQKWOKYSA-N 0 0 399.216 3.184 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000269918469 565203580 /nfs/dbraw/zinc/20/35/80/565203580.db2.gz FAABYIYUBCRAPD-OWYVNGRQSA-N 0 0 399.216 3.184 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](O)C12CCCC2 ZINC000294242656 565203838 /nfs/dbraw/zinc/20/38/38/565203838.db2.gz RBDCEUFHIISMJW-CQSZACIVSA-N 0 0 383.242 3.185 20 5 GGBDRN COC(=O)C(C)(C)c1csc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000294224038 565203941 /nfs/dbraw/zinc/20/39/41/565203941.db2.gz YQPLLDJIQVVPFN-UHFFFAOYSA-N 0 0 383.813 3.408 20 5 GGBDRN CC(C)OC1CCC(NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000159379770 565204104 /nfs/dbraw/zinc/20/41/04/565204104.db2.gz DYEPHLZRDITOKL-UHFFFAOYSA-N 0 0 376.862 3.263 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](O)C12CCCC2 ZINC000294242651 565204524 /nfs/dbraw/zinc/20/45/24/565204524.db2.gz RBDCEUFHIISMJW-AWEZNQCLSA-N 0 0 383.242 3.185 20 5 GGBDRN CC1(C)C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000270011431 565205455 /nfs/dbraw/zinc/20/54/55/565205455.db2.gz RGGMXSVYLJVJTF-SECBINFHSA-N 0 0 375.194 3.184 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000270040168 565206853 /nfs/dbraw/zinc/20/68/53/565206853.db2.gz JZLCMAOTXZUJFC-BPLDGKMQSA-N 0 0 395.253 3.435 20 5 GGBDRN CCOC(=O)[C@@H]1CCCc2sc(NC(=O)c3csc([N+](=O)[O-])c3)nc21 ZINC000294304569 565207681 /nfs/dbraw/zinc/20/76/81/565207681.db2.gz UYGRJNODAJTYDL-SECBINFHSA-N 0 0 381.435 3.348 20 5 GGBDRN CCOCCC1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000159471254 565207811 /nfs/dbraw/zinc/20/78/11/565207811.db2.gz SIDSRPZCXAZACS-UHFFFAOYSA-N 0 0 385.258 3.223 20 5 GGBDRN Cc1ccc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)s1 ZINC000185587321 565209640 /nfs/dbraw/zinc/20/96/40/565209640.db2.gz PDEHKYXLTHRZIC-UHFFFAOYSA-N 0 0 377.447 3.334 20 5 GGBDRN C[C@@H]1[C@H](c2ccc(Br)cc2)OCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000270150563 565210121 /nfs/dbraw/zinc/21/01/21/565210121.db2.gz ASXIOKGAFSSNAE-MEBBXXQBSA-N 0 0 394.225 3.288 20 5 GGBDRN C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000270150560 565210279 /nfs/dbraw/zinc/21/02/79/565210279.db2.gz ASXIOKGAFSSNAE-BMIGLBTASA-N 0 0 394.225 3.288 20 5 GGBDRN C[C@H]1[C@H](c2ccc(Br)cc2)OCCN1c1c([N+](=O)[O-])ncn1C ZINC000270209009 565212159 /nfs/dbraw/zinc/21/21/59/565212159.db2.gz LBGDAQLTYABLIG-GXFFZTMASA-N 0 0 381.230 3.057 20 5 GGBDRN C[C@H]1[C@@H](c2ccc(Br)cc2)OCCN1c1c([N+](=O)[O-])ncn1C ZINC000270209008 565212650 /nfs/dbraw/zinc/21/26/50/565212650.db2.gz LBGDAQLTYABLIG-GWCFXTLKSA-N 0 0 381.230 3.057 20 5 GGBDRN O=C(c1ccoc1)N1CCC(Nc2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000270302658 565214687 /nfs/dbraw/zinc/21/46/87/565214687.db2.gz BALNDQNSGQONGL-UHFFFAOYSA-N 0 0 395.213 3.062 20 5 GGBDRN O=[N+]([O-])c1ccc(SCc2nnnn2-c2ccccc2Br)nc1 ZINC000159670837 565215202 /nfs/dbraw/zinc/21/52/02/565215202.db2.gz DBJCBZVCEFRBEG-UHFFFAOYSA-N 0 0 393.226 3.020 20 5 GGBDRN O=C(NCCCOCC(F)(F)F)c1ccc([N+](=O)[O-])cc1Br ZINC000159677195 565215301 /nfs/dbraw/zinc/21/53/01/565215301.db2.gz BYPSYVQLYWNVMR-UHFFFAOYSA-N 0 0 385.136 3.056 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCSC[C@H]2c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000185674980 565215714 /nfs/dbraw/zinc/21/57/14/565215714.db2.gz YQBKDTYOJCYCQR-ZDUSSCGKSA-N 0 0 380.857 3.464 20 5 GGBDRN COc1ccc(OC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000185690057 565216779 /nfs/dbraw/zinc/21/67/79/565216779.db2.gz MTTUTGUHAGLDBY-LBPRGKRZSA-N 0 0 398.209 3.185 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000185741723 565219528 /nfs/dbraw/zinc/21/95/28/565219528.db2.gz DNHDVGVTZCXLON-UHFFFAOYSA-N 0 0 376.356 3.057 20 5 GGBDRN Cc1ccc([C@@H]2CSCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000185807151 565222990 /nfs/dbraw/zinc/22/29/90/565222990.db2.gz OBPIQNJHVXSGFY-KRWDZBQOSA-N 0 0 378.475 3.382 20 5 GGBDRN CCS[C@@H]1CCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185822809 565223803 /nfs/dbraw/zinc/22/38/03/565223803.db2.gz DQZCDRHQPIJBDH-GXTWGEPZSA-N 0 0 381.479 3.096 20 5 GGBDRN O=C(NCCOc1ccc(Cl)cn1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185870391 565225780 /nfs/dbraw/zinc/22/57/80/565225780.db2.gz LAURYRRAXAWHOO-UHFFFAOYSA-N 0 0 385.207 3.175 20 5 GGBDRN CO[C@@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl)C1CC1 ZINC000294749958 565225952 /nfs/dbraw/zinc/22/59/52/565225952.db2.gz YFRXFYIEQHCAFF-NSHDSACASA-N 0 0 377.622 3.166 20 5 GGBDRN CO[C@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl)C1CC1 ZINC000294749957 565226056 /nfs/dbraw/zinc/22/60/56/565226056.db2.gz YFRXFYIEQHCAFF-LLVKDONJSA-N 0 0 377.622 3.166 20 5 GGBDRN O=C(NCCCCSc1ccccc1Br)c1[nH]ncc1[N+](=O)[O-] ZINC000159985559 565226493 /nfs/dbraw/zinc/22/64/93/565226493.db2.gz VXIGUCMMHBQTSQ-UHFFFAOYSA-N 0 0 399.270 3.383 20 5 GGBDRN Cc1cc(Cl)c(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000294767217 565226886 /nfs/dbraw/zinc/22/68/86/565226886.db2.gz FMXIWESIDZDIBC-SNVBAGLBSA-N 0 0 379.766 3.171 20 5 GGBDRN COc1ccc(OCc2ccc(C(N)=O)cc2[N+](=O)[O-])c(Br)c1 ZINC000185914038 565228915 /nfs/dbraw/zinc/22/89/15/565228915.db2.gz LBWIXXSSULMNNS-UHFFFAOYSA-N 0 0 381.182 3.044 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CN(C)c1c(Br)cncc1[N+](=O)[O-] ZINC000270868088 565231200 /nfs/dbraw/zinc/23/12/00/565231200.db2.gz AZTJYOLLGCKPLU-UHFFFAOYSA-N 0 0 393.241 3.444 20 5 GGBDRN COc1ccc(CNc2c(Br)cncc2[N+](=O)[O-])c(OC)c1OC ZINC000270864962 565231677 /nfs/dbraw/zinc/23/16/77/565231677.db2.gz ALUKQXBCVHZLEN-UHFFFAOYSA-N 0 0 398.213 3.390 20 5 GGBDRN CCc1nc2c(s1)[C@H](N(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000185969195 565232135 /nfs/dbraw/zinc/23/21/35/565232135.db2.gz WXLDQWCHKYDUNT-CQSZACIVSA-N 0 0 381.479 3.312 20 5 GGBDRN Cn1ncc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1Cl ZINC000294883632 565233085 /nfs/dbraw/zinc/23/30/85/565233085.db2.gz DXGCFUYTPXMGLM-UHFFFAOYSA-N 0 0 376.722 3.186 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCc1ccnc(N2CCCC2)c1 ZINC000270958609 565233240 /nfs/dbraw/zinc/23/32/40/565233240.db2.gz NRIAYFMMUMLDFM-UHFFFAOYSA-N 0 0 378.230 3.360 20 5 GGBDRN CS(=O)(=O)CC1CCC(Nc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000294863715 565233444 /nfs/dbraw/zinc/23/34/44/565233444.db2.gz DJPJOMXVCGKRDH-UHFFFAOYSA-N 0 0 391.287 3.373 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CCN(CC(F)(F)F)C1 ZINC000271000778 565234779 /nfs/dbraw/zinc/23/47/79/565234779.db2.gz WAMIIRPHPSXNNN-MRVPVSSYSA-N 0 0 383.168 3.048 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)c1 ZINC000186007101 565234797 /nfs/dbraw/zinc/23/47/97/565234797.db2.gz MZRAFSBBUOUOSK-OAHLLOKOSA-N 0 0 382.825 3.090 20 5 GGBDRN CS(=O)(=O)CC1CCC(Nc2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000294908227 565235996 /nfs/dbraw/zinc/23/59/96/565235996.db2.gz IXEXFHDIHKUJST-UHFFFAOYSA-N 0 0 391.287 3.373 20 5 GGBDRN CN(C(=O)Cc1cccc(I)c1)c1ccc([N+](=O)[O-])cc1 ZINC000160225708 565236290 /nfs/dbraw/zinc/23/62/90/565236290.db2.gz IYXVMLHZAKYABS-UHFFFAOYSA-N 0 0 396.184 3.405 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(CSCCO)ccn2)cc1[N+](=O)[O-] ZINC000271078046 565237120 /nfs/dbraw/zinc/23/71/20/565237120.db2.gz QEAMRFCKPPJFMZ-UHFFFAOYSA-N 0 0 379.463 3.190 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000186046334 565237288 /nfs/dbraw/zinc/23/72/88/565237288.db2.gz QSUKOBCQWGVVND-GFCCVEGCSA-N 0 0 380.447 3.082 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000295012970 565239281 /nfs/dbraw/zinc/23/92/81/565239281.db2.gz VSOPXESVHNQECS-GOEBONIOSA-N 0 0 381.226 3.141 20 5 GGBDRN CC(C)[C@]1(CO)CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000294996047 565239680 /nfs/dbraw/zinc/23/96/80/565239680.db2.gz ZZDMVZBUNKZFKT-MRXNPFEDSA-N 0 0 385.258 3.228 20 5 GGBDRN CN(Cc1ncc(Cl)n1C)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000295029070 565240573 /nfs/dbraw/zinc/24/05/73/565240573.db2.gz MUEUSONMTBAMFQ-UHFFFAOYSA-N 0 0 376.722 3.273 20 5 GGBDRN COc1nc(C)c(Br)cc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000186118124 565240682 /nfs/dbraw/zinc/24/06/82/565240682.db2.gz VAZGEHATOYNXTB-UHFFFAOYSA-N 0 0 394.225 3.342 20 5 GGBDRN CSc1cccc(C(=O)N2CCOC[C@H]2c2nc(C)cs2)c1[N+](=O)[O-] ZINC000372471521 565240764 /nfs/dbraw/zinc/24/07/64/565240764.db2.gz HBLBROPXCKUHFD-LBPRGKRZSA-N 0 0 379.463 3.295 20 5 GGBDRN COc1cc(C(=O)NCCNc2ncc(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000160347917 565241615 /nfs/dbraw/zinc/24/16/15/565241615.db2.gz AJKSVURDYNJIOW-UHFFFAOYSA-N 0 0 385.207 3.147 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc([S@@](C)=O)cc1 ZINC000160384958 565242335 /nfs/dbraw/zinc/24/23/35/565242335.db2.gz BUQFNBHPZLJMBR-VWLOTQADSA-N 0 0 378.475 3.374 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl)c1nccs1 ZINC000295077701 565243004 /nfs/dbraw/zinc/24/30/04/565243004.db2.gz DQYKOGCEIOIDSC-ZETCQYMHSA-N 0 0 396.277 3.440 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1cc(Br)cs1 ZINC000160403721 565243882 /nfs/dbraw/zinc/24/38/82/565243882.db2.gz MCTRWZADZWVLNQ-UHFFFAOYSA-N 0 0 384.255 3.461 20 5 GGBDRN Cn1cnnc1Sc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1Cl ZINC000160436331 565245072 /nfs/dbraw/zinc/24/50/72/565245072.db2.gz JLONCYQPMZAVTD-UHFFFAOYSA-N 0 0 379.785 3.373 20 5 GGBDRN C[C@@H]1C[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCO1 ZINC000271261484 565245093 /nfs/dbraw/zinc/24/50/93/565245093.db2.gz KVUBGHVHKUURGK-APPZFPTMSA-N 0 0 377.622 3.308 20 5 GGBDRN CS(=O)(=O)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000160452224 565245378 /nfs/dbraw/zinc/24/53/78/565245378.db2.gz LYZBMWSOECHHQK-UHFFFAOYSA-N 0 0 386.788 3.184 20 5 GGBDRN O=[N+]([O-])c1cccc(CCNS(=O)(=O)C2CCC(C(F)(F)F)CC2)c1 ZINC000295128102 565246669 /nfs/dbraw/zinc/24/66/69/565246669.db2.gz JOMKMRVTVXWFIX-UHFFFAOYSA-N 0 0 380.388 3.178 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2c(Br)ccc(F)c2C1 ZINC000186229558 565248409 /nfs/dbraw/zinc/24/84/09/565248409.db2.gz JOBWHMJYXDNUGP-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000186251181 565249564 /nfs/dbraw/zinc/24/95/64/565249564.db2.gz HOYLAAVGSUWMFU-LBPRGKRZSA-N 0 0 386.426 3.330 20 5 GGBDRN CC(C)[C@@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000271351162 565249706 /nfs/dbraw/zinc/24/97/06/565249706.db2.gz DXWPKJPAVKYVHH-MFKMUULPSA-N 0 0 389.221 3.430 20 5 GGBDRN C[C@@H]1C[C@H](NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000271351301 565249799 /nfs/dbraw/zinc/24/97/99/565249799.db2.gz XLLMPMUBBNTMRE-MWLCHTKSSA-N 0 0 378.372 3.389 20 5 GGBDRN C[C@H]1C[C@@H](NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000271351303 565249820 /nfs/dbraw/zinc/24/98/20/565249820.db2.gz XLLMPMUBBNTMRE-ONGXEEELSA-N 0 0 378.372 3.389 20 5 GGBDRN CSc1cccc(C(=O)NCC(=O)Nc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000186243204 565250001 /nfs/dbraw/zinc/25/00/01/565250001.db2.gz RFYSGNHGCFWJDB-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000186251160 565250072 /nfs/dbraw/zinc/25/00/72/565250072.db2.gz HOYLAAVGSUWMFU-GFCCVEGCSA-N 0 0 386.426 3.330 20 5 GGBDRN C[C@@H]1C[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000271379912 565250946 /nfs/dbraw/zinc/25/09/46/565250946.db2.gz QTOXCWBTIAHJOX-BDAKNGLRSA-N 0 0 375.194 3.041 20 5 GGBDRN CC1(C)C[C@@H](NS(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CCO1 ZINC000295212117 565251940 /nfs/dbraw/zinc/25/19/40/565251940.db2.gz USYXXQCAQIOGNA-QMMMGPOBSA-N 0 0 383.253 3.138 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC[C@H](Nc3ccccc3)C2)s1 ZINC000271401262 565252151 /nfs/dbraw/zinc/25/21/51/565252151.db2.gz NVSLKPORUSYRQU-ZDUSSCGKSA-N 0 0 381.479 3.141 20 5 GGBDRN COc1ccccc1[C@H]1CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000271414009 565252735 /nfs/dbraw/zinc/25/27/35/565252735.db2.gz QAXWTRLPVNISRE-NSHDSACASA-N 0 0 382.463 3.062 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCSC3(CCCCC3)C2)s1 ZINC000271413960 565252952 /nfs/dbraw/zinc/25/29/52/565252952.db2.gz PYXGZFRINUBHPI-UHFFFAOYSA-N 0 0 376.525 3.316 20 5 GGBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OS(=O)(=O)C[C@H]1CCCCC1(F)F ZINC000295220720 565253032 /nfs/dbraw/zinc/25/30/32/565253032.db2.gz VPZHSYBQCAZPTB-LLVKDONJSA-N 0 0 377.365 3.332 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(Cc2cccs2)C2CC2)cc1[N+](=O)[O-] ZINC000186310722 565254887 /nfs/dbraw/zinc/25/48/87/565254887.db2.gz QAMPGZWNZSNFDQ-UHFFFAOYSA-N 0 0 386.426 3.157 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCN(CC(F)(F)F)C1 ZINC000186344343 565255829 /nfs/dbraw/zinc/25/58/29/565255829.db2.gz IPGDOAXTFZYQNC-NSHDSACASA-N 0 0 379.766 3.139 20 5 GGBDRN COCCOc1c(Cl)cc(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])cc1Cl ZINC000271482682 565256177 /nfs/dbraw/zinc/25/61/77/565256177.db2.gz GMIHBFIZXFJEHS-UHFFFAOYSA-N 0 0 389.195 3.211 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C(F)(F)F)n1 ZINC000295379118 565262474 /nfs/dbraw/zinc/26/24/74/565262474.db2.gz MDXPLBOFRUEMHJ-SNVBAGLBSA-N 0 0 377.348 3.240 20 5 GGBDRN CNS(=O)(=O)c1ccc([C@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000271652773 565262741 /nfs/dbraw/zinc/26/27/41/565262741.db2.gz IOJJVDPNQLDDKS-NSHDSACASA-N 0 0 383.857 3.007 20 5 GGBDRN Cc1csc([C@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000186488357 565263083 /nfs/dbraw/zinc/26/30/83/565263083.db2.gz LINCKMJXEUSWLI-MRVPVSSYSA-N 0 0 375.859 3.095 20 5 GGBDRN Cc1csc([C@@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000186488337 565263412 /nfs/dbraw/zinc/26/34/12/565263412.db2.gz LINCKMJXEUSWLI-QMMMGPOBSA-N 0 0 375.859 3.095 20 5 GGBDRN CC[C@@H](COCC(F)(F)F)NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000295385382 565263788 /nfs/dbraw/zinc/26/37/88/565263788.db2.gz JHJUHNBXDWQSMQ-QMMMGPOBSA-N 0 0 399.163 3.445 20 5 GGBDRN Cn1ccnc1[C@@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000373004978 565264667 /nfs/dbraw/zinc/26/46/67/565264667.db2.gz XIXGAXOJHVJTCM-CYBMUJFWSA-N 0 0 379.258 3.470 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186525522 565265973 /nfs/dbraw/zinc/26/59/73/565265973.db2.gz LPUPCCYPDPEHAF-ABAIWWIYSA-N 0 0 381.841 3.415 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OS(=O)(=O)C1CCC(C(F)(F)F)CC1 ZINC000295435026 565266359 /nfs/dbraw/zinc/26/63/59/565266359.db2.gz ZKPALCMPLNMDQV-UHFFFAOYSA-N 0 0 383.344 3.433 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000295484713 565269036 /nfs/dbraw/zinc/26/90/36/565269036.db2.gz CJIMDUHOFNDDFN-HOCLYGCPSA-N 0 0 381.226 3.141 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])[C@@H]2CCCO[C@@H]21 ZINC000373095631 565269310 /nfs/dbraw/zinc/26/93/10/565269310.db2.gz TVXPTLXLWPYLGD-BPTDKIDVSA-N 0 0 389.271 3.352 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000295484733 565269383 /nfs/dbraw/zinc/26/93/83/565269383.db2.gz CJIMDUHOFNDDFN-ZBFHGGJFSA-N 0 0 381.226 3.141 20 5 GGBDRN CC(C)(CNC(=O)c1cccc([N+](=O)[O-])c1Br)c1ccccn1 ZINC000295498621 565270086 /nfs/dbraw/zinc/27/00/86/565270086.db2.gz OZNRJKXSDQAHCE-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN CO[C@@H](c1ccccc1F)[C@@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271870893 565271246 /nfs/dbraw/zinc/27/12/46/565271246.db2.gz SAVGTNBVSNMWKY-YMTOWFKASA-N 0 0 388.442 3.387 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1nccs1 ZINC000186671630 565276835 /nfs/dbraw/zinc/27/68/35/565276835.db2.gz CLVDULRBLDYWLG-QMMMGPOBSA-N 0 0 395.384 3.152 20 5 GGBDRN CC(C)[C@]1(CO)CCCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000295625903 565276860 /nfs/dbraw/zinc/27/68/60/565276860.db2.gz PIZOGULBUBZXIR-MRXNPFEDSA-N 0 0 385.258 3.228 20 5 GGBDRN O=C(c1ccccc1Br)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373256276 565276894 /nfs/dbraw/zinc/27/68/94/565276894.db2.gz AKCXHEYYHHKOJJ-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC(C(=O)C(F)(F)F)CC2)c1 ZINC000186690642 565278172 /nfs/dbraw/zinc/27/81/72/565278172.db2.gz UJUYTTSVPIBYKX-UHFFFAOYSA-N 0 0 376.356 3.300 20 5 GGBDRN COCCCn1cc(C)c(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000295649354 565279637 /nfs/dbraw/zinc/27/96/37/565279637.db2.gz MCLOEYNARQEJHI-UHFFFAOYSA-N 0 0 397.229 3.151 20 5 GGBDRN CC(C)n1cnnc1C1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000272161926 565279842 /nfs/dbraw/zinc/27/98/42/565279842.db2.gz AURPVXMACGBILN-UHFFFAOYSA-N 0 0 395.261 3.309 20 5 GGBDRN COC(=O)C(C)(C)c1csc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)n1 ZINC000295674800 565280418 /nfs/dbraw/zinc/28/04/18/565280418.db2.gz UWIOWGHPTOKICH-UHFFFAOYSA-N 0 0 383.813 3.408 20 5 GGBDRN CSc1cccc(C(=O)N2CCN([C@H](C)C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000186717066 565280770 /nfs/dbraw/zinc/28/07/70/565280770.db2.gz WNNKJEMTETZFNT-SNVBAGLBSA-N 0 0 377.388 3.025 20 5 GGBDRN C[C@@H](Sc1ncnc2[nH]cnc21)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000161344810 565281297 /nfs/dbraw/zinc/28/12/97/565281297.db2.gz NCGLEIITGCSIFF-SSDOTTSWSA-N 0 0 378.801 3.034 20 5 GGBDRN CC(C)(C)CN(CCCO)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000161341434 565281693 /nfs/dbraw/zinc/28/16/93/565281693.db2.gz AFGGSIASZWNASV-UHFFFAOYSA-N 0 0 399.296 3.321 20 5 GGBDRN COC[C@@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1cccc(Cl)c1 ZINC000295737533 565283489 /nfs/dbraw/zinc/28/34/89/565283489.db2.gz XGQXBZBTTDTGTK-OAHLLOKOSA-N 0 0 384.841 3.451 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H](CCO)c1ccc(Cl)cc1 ZINC000295719813 565283502 /nfs/dbraw/zinc/28/35/02/565283502.db2.gz UCHOBLRHCSBKHN-CQSZACIVSA-N 0 0 384.841 3.187 20 5 GGBDRN CNc1c(C(=O)Nc2cccc(I)c2)cccc1[N+](=O)[O-] ZINC000161425289 565284209 /nfs/dbraw/zinc/28/42/09/565284209.db2.gz KHVWSCWHCZZCLM-UHFFFAOYSA-N 0 0 397.172 3.493 20 5 GGBDRN CN(Cc1ncc(Cl)n1C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272408935 565285982 /nfs/dbraw/zinc/28/59/82/565285982.db2.gz YYSLVWXOJFDLMA-UHFFFAOYSA-N 0 0 386.239 3.019 20 5 GGBDRN CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000272459716 565287970 /nfs/dbraw/zinc/28/79/70/565287970.db2.gz KPWPNAFNCHUQGD-RNCFNFMXSA-N 0 0 389.221 3.120 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)c1nnc(NC2CCCCC2)s1 ZINC000295836853 565289125 /nfs/dbraw/zinc/28/91/25/565289125.db2.gz HSZHHPFKWMZJDD-UHFFFAOYSA-N 0 0 382.467 3.165 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)c(OS(=O)(=O)CC2CC(F)(F)C2)c1 ZINC000295824969 565289527 /nfs/dbraw/zinc/28/95/27/565289527.db2.gz CCLXENKCDSRSIL-UHFFFAOYSA-N 0 0 386.170 3.111 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c2cccc(F)c2O1 ZINC000186865608 565291593 /nfs/dbraw/zinc/29/15/93/565291593.db2.gz YENKLQPBXNGPDK-VIFPVBQESA-N 0 0 386.788 3.364 20 5 GGBDRN CSc1nnc(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])s1 ZINC000295884474 565291943 /nfs/dbraw/zinc/29/19/43/565291943.db2.gz HMYHACOOFNDPDV-UHFFFAOYSA-N 0 0 378.357 3.117 20 5 GGBDRN COCC[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccco1 ZINC000272671831 565293383 /nfs/dbraw/zinc/29/33/83/565293383.db2.gz KIYKZEVMELWPOD-LBPRGKRZSA-N 0 0 383.198 3.458 20 5 GGBDRN CC(C)N1CCO[C@H](c2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)C1 ZINC000272702786 565294314 /nfs/dbraw/zinc/29/43/14/565294314.db2.gz WNZOPHYQRJUDNJ-ZDUSSCGKSA-N 0 0 397.229 3.189 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(CC(F)(F)F)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000186905414 565294398 /nfs/dbraw/zinc/29/43/98/565294398.db2.gz QREAQLKFRMSIAA-JTQLQIEISA-N 0 0 377.388 3.025 20 5 GGBDRN CN1CCc2nc(NC(=O)c3cccc([N+](=O)[O-])c3Br)sc2C1 ZINC000272779277 565297157 /nfs/dbraw/zinc/29/71/57/565297157.db2.gz XZZLHSVIJQRFFB-UHFFFAOYSA-N 0 0 397.254 3.054 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1I)N1CCC(CF)CC1 ZINC000296001971 565297581 /nfs/dbraw/zinc/29/75/81/565297581.db2.gz RZPLHWLDXDZHMV-UHFFFAOYSA-N 0 0 392.168 3.021 20 5 GGBDRN CC[C@H]1CN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CCCO1 ZINC000295988596 565297627 /nfs/dbraw/zinc/29/76/27/565297627.db2.gz LIXRHUAJVBFRNE-VIFPVBQESA-N 0 0 383.253 3.091 20 5 GGBDRN C[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H]1CCCN(C2CCC2)C1 ZINC000272792393 565298367 /nfs/dbraw/zinc/29/83/67/565298367.db2.gz CLBQTURPBBRUMW-RYUDHWBXSA-N 0 0 387.527 3.125 20 5 GGBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H]1c1ccc(Br)s1 ZINC000373701726 565298425 /nfs/dbraw/zinc/29/84/25/565298425.db2.gz MNJHSUFHDBIENE-GHMZBOCLSA-N 0 0 382.239 3.408 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2ccc(N3CCSCC3)cc2)s1 ZINC000272836666 565299250 /nfs/dbraw/zinc/29/92/50/565299250.db2.gz LYEUAOLDRLFPSM-UHFFFAOYSA-N 0 0 399.519 3.357 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSCc2ccc(I)cc2)c1 ZINC000162339717 565314224 /nfs/dbraw/zinc/31/42/24/565314224.db2.gz HBFRCQQAZSSUFJ-UHFFFAOYSA-N 0 0 389.218 3.329 20 5 GGBDRN Cc1nn(C)c(C(=O)N(Cc2csc(Br)c2)C2CC2)c1[N+](=O)[O-] ZINC000161973752 565299800 /nfs/dbraw/zinc/29/98/00/565299800.db2.gz IHQKUEVSKGYFCH-UHFFFAOYSA-N 0 0 399.270 3.266 20 5 GGBDRN Cc1cc(N2CCC(O)(c3scnc3Br)CC2)ncc1[N+](=O)[O-] ZINC000373764972 565301588 /nfs/dbraw/zinc/30/15/88/565301588.db2.gz GBCMOQXXMZDTDP-UHFFFAOYSA-N 0 0 399.270 3.005 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1csc(Br)c1)C1CC1 ZINC000162036092 565302591 /nfs/dbraw/zinc/30/25/91/565302591.db2.gz WSSSXQMJRQTOKW-UHFFFAOYSA-N 0 0 399.270 3.115 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000187011967 565303003 /nfs/dbraw/zinc/30/30/03/565303003.db2.gz PIAIDKKLAGPEGU-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN CSCCCCCCNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000273047389 565305212 /nfs/dbraw/zinc/30/52/12/565305212.db2.gz BSAVFOFDTCUTOG-UHFFFAOYSA-N 0 0 387.889 3.018 20 5 GGBDRN C[C@H]1C[C@H](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000273112966 565307618 /nfs/dbraw/zinc/30/76/18/565307618.db2.gz CPKFLMKDXCQCBJ-VHSXEESVSA-N 0 0 389.221 3.431 20 5 GGBDRN Cn1ccnc1[C@H]1N(C(=O)c2sc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000296310012 565311263 /nfs/dbraw/zinc/31/12/63/565311263.db2.gz RISBDJBIQYWTQB-LLVKDONJSA-N 0 0 399.270 3.376 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H](c2ncc[nH]2)C1 ZINC000273179149 565312039 /nfs/dbraw/zinc/31/20/39/565312039.db2.gz JKQKBYCYDOBOCT-NSHDSACASA-N 0 0 380.857 3.470 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@H](c3ccc(Cl)s3)C2)cc(F)cc1[N+](=O)[O-] ZINC000374076627 565318718 /nfs/dbraw/zinc/31/87/18/565318718.db2.gz FRSQGMRISOFRMW-NSHDSACASA-N 0 0 385.804 3.245 20 5 GGBDRN CN(C)C(=O)CN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000162494732 565318833 /nfs/dbraw/zinc/31/88/33/565318833.db2.gz WATRRYAQCXOFFB-UHFFFAOYSA-N 0 0 396.241 3.137 20 5 GGBDRN CNC(=O)c1ccc(N2CCO[C@H](c3ccc(Cl)s3)C2)c([N+](=O)[O-])c1 ZINC000374097888 565319996 /nfs/dbraw/zinc/31/99/96/565319996.db2.gz WAAGUNUERIILPD-ZDUSSCGKSA-N 0 0 381.841 3.247 20 5 GGBDRN Cc1cccnc1CCCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000296546856 565322908 /nfs/dbraw/zinc/32/29/08/565322908.db2.gz YJZVTGTYIKLWOT-UHFFFAOYSA-N 0 0 378.226 3.423 20 5 GGBDRN CSCC1CCC(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000296542632 565323090 /nfs/dbraw/zinc/32/30/90/565323090.db2.gz ZKKKFLBELKNGGZ-UHFFFAOYSA-N 0 0 385.873 3.225 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1[C@@H](O)C(F)(F)F ZINC000162703157 565325771 /nfs/dbraw/zinc/32/57/71/565325771.db2.gz GLUOUZDNJREXRL-DGCLKSJQSA-N 0 0 378.372 3.235 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1[C@H](O)C(F)(F)F ZINC000162703031 565325864 /nfs/dbraw/zinc/32/58/64/565325864.db2.gz GLUOUZDNJREXRL-AAEUAGOBSA-N 0 0 378.372 3.235 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000187366312 565326713 /nfs/dbraw/zinc/32/67/13/565326713.db2.gz FACFDMQOEOSFEL-UHFFFAOYSA-N 0 0 386.788 3.147 20 5 GGBDRN Nc1c(C(=O)N2Cc3cccc(Br)c3C2)cc(F)cc1[N+](=O)[O-] ZINC000187381273 565327851 /nfs/dbraw/zinc/32/78/51/565327851.db2.gz YFNYHCLJYBWSDK-UHFFFAOYSA-N 0 0 380.173 3.235 20 5 GGBDRN CCOC(=O)[C@H]1CCCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000162808327 565328655 /nfs/dbraw/zinc/32/86/55/565328655.db2.gz WHLRSINVVDTGAS-NSHDSACASA-N 0 0 399.241 3.081 20 5 GGBDRN Cc1csc(Sc2ccc(NC(=O)c3c([N+](=O)[O-])cnn3C)cc2)n1 ZINC000162817878 565328666 /nfs/dbraw/zinc/32/86/66/565328666.db2.gz HCNXLAMATFWGHD-UHFFFAOYSA-N 0 0 375.435 3.497 20 5 GGBDRN O=C(NCC1(c2ccc(Br)cc2)CCCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000162806555 565329277 /nfs/dbraw/zinc/32/92/77/565329277.db2.gz BFDUGZVRXHYTCW-UHFFFAOYSA-N 0 0 393.241 3.322 20 5 GGBDRN CC[C@@H]1[C@H](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000187408529 565329731 /nfs/dbraw/zinc/32/97/31/565329731.db2.gz BYTHIGMVBYAWIP-NOZJJQNGSA-N 0 0 388.205 3.460 20 5 GGBDRN Cc1nc2cc(Br)cc(NC(=O)CCn3cc([N+](=O)[O-])cn3)c2o1 ZINC000187440018 565332239 /nfs/dbraw/zinc/33/22/39/565332239.db2.gz RYKGIBJJMXDMHE-UHFFFAOYSA-N 0 0 394.185 3.032 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@H](C2CCOCC2)C1 ZINC000374364789 565333917 /nfs/dbraw/zinc/33/39/17/565333917.db2.gz HPJFNOWOXBKUGE-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN Cc1nc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 ZINC000163061910 565335215 /nfs/dbraw/zinc/33/52/15/565335215.db2.gz IBIHIAXHSNRJPK-UHFFFAOYSA-N 0 0 395.384 3.199 20 5 GGBDRN Cc1cc(Cl)c(NC(=O)C(=O)NCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000163207254 565339917 /nfs/dbraw/zinc/33/99/17/565339917.db2.gz BSKGODOWQWCDTB-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN COC(=O)N(Cc1noc(-c2cc(Br)cc([N+](=O)[O-])c2)n1)C1CC1 ZINC000273885663 565342850 /nfs/dbraw/zinc/34/28/50/565342850.db2.gz OUGBHTMMXLPKKA-UHFFFAOYSA-N 0 0 397.185 3.138 20 5 GGBDRN CCCCN(CCOC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163351039 565343831 /nfs/dbraw/zinc/34/38/31/565343831.db2.gz STHLHEZKIQTCMC-UHFFFAOYSA-N 0 0 384.376 3.051 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CC2CC2)CC2CC2)c(C(F)(F)F)c1 ZINC000163363982 565344008 /nfs/dbraw/zinc/34/40/08/565344008.db2.gz VNBYZAIKBAHLCL-UHFFFAOYSA-N 0 0 378.372 3.424 20 5 GGBDRN CC(C)(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1nccs1 ZINC000163365971 565344198 /nfs/dbraw/zinc/34/41/98/565344198.db2.gz ULUILIWRHGLQHD-UHFFFAOYSA-N 0 0 395.384 3.284 20 5 GGBDRN CCCC[C@H](COC)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163370226 565344572 /nfs/dbraw/zinc/34/45/72/565344572.db2.gz HYNMUUZASSOFNO-SNVBAGLBSA-N 0 0 384.376 3.097 20 5 GGBDRN C[C@H]1SCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)[C@H]1C ZINC000163369433 565345444 /nfs/dbraw/zinc/34/54/44/565345444.db2.gz ROWONIMIEJJVAI-DTWKUNHWSA-N 0 0 384.401 3.128 20 5 GGBDRN CCc1nocc1CN(C)S(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC000296915841 565345751 /nfs/dbraw/zinc/34/57/51/565345751.db2.gz FMVCKRCBKSXZEX-UHFFFAOYSA-N 0 0 394.236 3.273 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCc2c(Cl)cccc2C1 ZINC000163477247 565346152 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397.280 3.075 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000187709253 565349518 /nfs/dbraw/zinc/34/95/18/565349518.db2.gz VDVRSGOHLMYXIJ-LKFCYVNXSA-N 0 0 380.750 3.462 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3cc4n(n3)CCC4)n2)c(Br)c1 ZINC000296989650 565350054 /nfs/dbraw/zinc/35/00/54/565350054.db2.gz SHUXEKWZGZJMDV-UHFFFAOYSA-N 0 0 390.197 3.141 20 5 GGBDRN CC[C@](C)(NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000163669748 565350125 /nfs/dbraw/zinc/35/01/25/565350125.db2.gz YVKHLBPGHAERQV-INIZCTEOSA-N 0 0 383.495 3.147 20 5 GGBDRN NC(=O)c1ccc(SCc2nc([C@H]3CCCCS3)no2)c([N+](=O)[O-])c1 ZINC000274001308 565350598 /nfs/dbraw/zinc/35/05/98/565350598.db2.gz MIUBVBJSOBDBJE-GFCCVEGCSA-N 0 0 380.451 3.327 20 5 GGBDRN C[C@H](CNS(=O)(=O)CCc1ccccc1[N+](=O)[O-])Sc1ccccc1 ZINC000163876563 565352845 /nfs/dbraw/zinc/35/28/45/565352845.db2.gz DQPROSVFIZKMCZ-CQSZACIVSA-N 0 0 380.491 3.238 20 5 GGBDRN O=C(N[C@@H](CC1CC1)c1cc(F)cc(Br)c1)c1[nH]ncc1[N+](=O)[O-] ZINC000187766383 565353377 /nfs/dbraw/zinc/35/33/77/565353377.db2.gz XJQMUHBILPDTAA-LBPRGKRZSA-N 0 0 397.204 3.491 20 5 GGBDRN O=C(N[C@H](CC1CC1)c1cc(F)cc(Br)c1)c1[nH]ncc1[N+](=O)[O-] ZINC000187766364 565353476 /nfs/dbraw/zinc/35/34/76/565353476.db2.gz XJQMUHBILPDTAA-GFCCVEGCSA-N 0 0 397.204 3.491 20 5 GGBDRN C[C@H]1OCC[C@H]1SCC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000164052410 565354617 /nfs/dbraw/zinc/35/46/17/565354617.db2.gz GLOITZCNUKZYHZ-PRHODGIISA-N 0 0 375.244 3.206 20 5 GGBDRN Cc1n[nH]cc1CCCNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000164065011 565354759 /nfs/dbraw/zinc/35/47/59/565354759.db2.gz ILHZTVWWAPCAQC-UHFFFAOYSA-N 0 0 381.230 3.060 20 5 GGBDRN CCN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H](C)Cc1ccsc1 ZINC000187784523 565354906 /nfs/dbraw/zinc/35/49/06/565354906.db2.gz WRDPOLJCWIEPDT-CQSZACIVSA-N 0 0 382.507 3.383 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(Br)cc2F)c(C)c1[N+](=O)[O-] ZINC000164065369 565355117 /nfs/dbraw/zinc/35/51/17/565355117.db2.gz UPOZEKBBNSMOQQ-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN CC(=O)N(CCc1noc(-c2ccc([N+](=O)[O-])cc2Br)n1)C(C)C ZINC000274081119 565355312 /nfs/dbraw/zinc/35/53/12/565355312.db2.gz XDTPCMYZADUSES-UHFFFAOYSA-N 0 0 397.229 3.207 20 5 GGBDRN C[C@@H](C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccc(Cl)s1 ZINC000297098551 565355988 /nfs/dbraw/zinc/35/59/88/565355988.db2.gz YWJNADXKGMUXLL-LLVKDONJSA-N 0 0 380.857 3.157 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c1 ZINC000164179439 565356532 /nfs/dbraw/zinc/35/65/32/565356532.db2.gz XHIYCNRZEUUIML-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N(CCC(F)(F)F)CC1CC1 ZINC000164353333 565359062 /nfs/dbraw/zinc/35/90/62/565359062.db2.gz YQMJBOQPWIBTQU-UHFFFAOYSA-N 0 0 380.388 3.132 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(I)cc1 ZINC000164819173 565364429 /nfs/dbraw/zinc/36/44/29/565364429.db2.gz VDLOIALJWNXLHI-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cnc3c(c2)COCC3)cc1[N+](=O)[O-] ZINC000375055573 565365512 /nfs/dbraw/zinc/36/55/12/565365512.db2.gz UAVOQWNNTQFTHV-UHFFFAOYSA-N 0 0 392.209 3.386 20 5 GGBDRN NC(=O)c1ccc(CNc2cc(Br)c(F)cc2F)c([N+](=O)[O-])c1 ZINC000187977755 565367658 /nfs/dbraw/zinc/36/76/58/565367658.db2.gz OURIRHWUFPHIDH-UHFFFAOYSA-N 0 0 386.152 3.347 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCSC3(CCOCC3)C2)ccc1Br ZINC000274446221 565370732 /nfs/dbraw/zinc/37/07/32/565370732.db2.gz DDKMDXIXMHBEHH-UHFFFAOYSA-N 0 0 387.299 3.455 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1csc(C)n1 ZINC000188015257 565371216 /nfs/dbraw/zinc/37/12/16/565371216.db2.gz HNTNOEPEQNDXMD-HNNXBMFYSA-N 0 0 381.479 3.448 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1)c1[nH]ncc1[N+](=O)[O-] ZINC000188056230 565374748 /nfs/dbraw/zinc/37/47/48/565374748.db2.gz KLRAQJDMARCBDE-JTQLQIEISA-N 0 0 384.223 3.024 20 5 GGBDRN O=c1c(Br)cn(CCOc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000188081462 565376659 /nfs/dbraw/zinc/37/66/59/565376659.db2.gz ULLODPMVZMYPPD-UHFFFAOYSA-N 0 0 391.580 3.391 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCO[C@@H](c2ccc(F)c(Br)c2)C1 ZINC000274679355 565376801 /nfs/dbraw/zinc/37/68/01/565376801.db2.gz NKTOQFZHWBAJHR-CYBMUJFWSA-N 0 0 398.188 3.038 20 5 GGBDRN CS(=O)(=O)N(CCOc1c(Cl)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000188078153 565376708 /nfs/dbraw/zinc/37/67/08/565376708.db2.gz HVSTZGZRLCMEHW-UHFFFAOYSA-N 0 0 384.841 3.089 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1CCOc1ccc(Cl)c(F)c1 ZINC000188081951 565376975 /nfs/dbraw/zinc/37/69/75/565376975.db2.gz FKFHERHROAAKSW-UHFFFAOYSA-N 0 0 391.580 3.391 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1[C@@H]1CCCO1 ZINC000375264824 565377957 /nfs/dbraw/zinc/37/79/57/565377957.db2.gz CSBSLLNKHJODOK-GJZGRUSLSA-N 0 0 383.242 3.070 20 5 GGBDRN CCc1cnc(CNc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])o1 ZINC000274710790 565378421 /nfs/dbraw/zinc/37/84/21/565378421.db2.gz XWOJLZMRKVBACH-UHFFFAOYSA-N 0 0 379.316 3.051 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H]1CCCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000167701758 565379518 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5 GGBDRN CCn1cc(Br)cc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188579755 565410452 /nfs/dbraw/zinc/41/04/52/565410452.db2.gz CJNDGFZLWRZNFE-UHFFFAOYSA-N 0 0 394.225 3.082 20 5 GGBDRN Cc1c(Br)cccc1NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000171120354 565411572 /nfs/dbraw/zinc/41/15/72/565411572.db2.gz GTPSRSYWCUHUPP-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1cccc(Br)c1 ZINC000171168059 565415101 /nfs/dbraw/zinc/41/51/01/565415101.db2.gz RWXFBVOVMUYLEV-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN CCSc1cc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)ccn1 ZINC000188640462 565415834 /nfs/dbraw/zinc/41/58/34/565415834.db2.gz XKVLZHVAVLFSKF-UHFFFAOYSA-N 0 0 387.870 3.234 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NCc1ccc(Br)c(F)c1 ZINC000171202644 565416952 /nfs/dbraw/zinc/41/69/52/565416952.db2.gz BXLQMHRPFYLUIQ-UHFFFAOYSA-N 0 0 382.189 3.496 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Br)cc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000171203532 565417153 /nfs/dbraw/zinc/41/71/53/565417153.db2.gz QVIFVGDLEDMITE-LLVKDONJSA-N 0 0 396.266 3.428 20 5 GGBDRN CSc1nnc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000275596520 565419583 /nfs/dbraw/zinc/41/95/83/565419583.db2.gz FABKKBUSSCCVRO-UHFFFAOYSA-N 0 0 379.467 3.042 20 5 GGBDRN C[C@@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1)Oc1ccc(Cl)c(Cl)c1 ZINC000188806768 565425048 /nfs/dbraw/zinc/42/50/48/565425048.db2.gz BIDVKJYCSORRCX-JTQLQIEISA-N 0 0 387.223 3.024 20 5 GGBDRN CSc1nnc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)s1 ZINC000275750845 565425485 /nfs/dbraw/zinc/42/54/85/565425485.db2.gz NRMGCCNYAMOYJC-UHFFFAOYSA-N 0 0 378.357 3.117 20 5 GGBDRN CCSc1nnc(Sc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)s1 ZINC000276019273 565433714 /nfs/dbraw/zinc/43/37/14/565433714.db2.gz BBLBTDVSRLFPSS-UHFFFAOYSA-N 0 0 377.494 3.113 20 5 GGBDRN CC(C)Oc1nnc(S[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)s1 ZINC000299081790 565438564 /nfs/dbraw/zinc/43/85/64/565438564.db2.gz YMDOGQFUZDVKEV-QMMMGPOBSA-N 0 0 386.430 3.492 20 5 GGBDRN CS(=O)(=O)N(Cc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1F ZINC000171610739 565439324 /nfs/dbraw/zinc/43/93/24/565439324.db2.gz MPUALGGDQOLOCM-UHFFFAOYSA-N 0 0 376.768 3.493 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H]1CCCC1=O ZINC000376526388 565440841 /nfs/dbraw/zinc/44/08/41/565440841.db2.gz HZJMTNQOWVIKNH-UONOGXRCSA-N 0 0 381.226 3.331 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@H]1[C@H]1CCCC1=O ZINC000376526387 565441162 /nfs/dbraw/zinc/44/11/62/565441162.db2.gz HZJMTNQOWVIKNH-KGLIPLIRSA-N 0 0 381.226 3.331 20 5 GGBDRN C[C@H](CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1)Oc1ccc(Cl)c(Cl)c1 ZINC000189054972 565441143 /nfs/dbraw/zinc/44/11/43/565441143.db2.gz LDAXJYGUHQTMGH-SNVBAGLBSA-N 0 0 387.223 3.024 20 5 GGBDRN CCS[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2Cl)C1 ZINC000299190642 565443317 /nfs/dbraw/zinc/44/33/17/565443317.db2.gz CYIJOZHIQNSURA-WDEREUQCSA-N 0 0 385.873 3.367 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCc1nc(C(F)(F)F)cs1 ZINC000276340416 565444710 /nfs/dbraw/zinc/44/47/10/565444710.db2.gz SFBPTOFJRYMVHB-UHFFFAOYSA-N 0 0 395.384 3.128 20 5 GGBDRN Cn1nccc1[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000376598298 565444973 /nfs/dbraw/zinc/44/49/73/565444973.db2.gz BFFWCOFOGLPMBA-LLVKDONJSA-N 0 0 393.241 3.111 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ccc(Br)cc1 ZINC000171720619 565446511 /nfs/dbraw/zinc/44/65/11/565446511.db2.gz UPEOFUDJRCQUAN-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN C[C@H]1CN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C[C@@H](c2ccsc2)O1 ZINC000276377130 565446774 /nfs/dbraw/zinc/44/67/74/565446774.db2.gz YAXDZROPDWCHLE-NHYWBVRUSA-N 0 0 382.463 3.026 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1ccc(Br)cc1)C(C)C ZINC000299327321 565447031 /nfs/dbraw/zinc/44/70/31/565447031.db2.gz HLDPEDZTKBZPKV-UHFFFAOYSA-N 0 0 395.257 3.299 20 5 GGBDRN C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C[C@H](c2ccsc2)O1 ZINC000276377127 565447416 /nfs/dbraw/zinc/44/74/16/565447416.db2.gz YAXDZROPDWCHLE-IAQYHMDHSA-N 0 0 382.463 3.026 20 5 GGBDRN CCOC(CCNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)OCC ZINC000276398647 565448209 /nfs/dbraw/zinc/44/82/09/565448209.db2.gz UAIXSBIEQQODOU-UHFFFAOYSA-N 0 0 389.246 3.185 20 5 GGBDRN Cc1cc(N2CCC[C@H](c3nncn3C)C2)c(Br)cc1[N+](=O)[O-] ZINC000276410594 565448657 /nfs/dbraw/zinc/44/86/57/565448657.db2.gz AUZRNCOMMJJQLP-NSHDSACASA-N 0 0 380.246 3.178 20 5 GGBDRN C[C@@H](N[C@H](C(N)=O)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000171758624 565449814 /nfs/dbraw/zinc/44/98/14/565449814.db2.gz RICYSDYHQIHKRV-BMIGLBTASA-N 0 0 378.226 3.235 20 5 GGBDRN O=C(NCc1ccc(Cl)cc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000189193782 565450172 /nfs/dbraw/zinc/45/01/72/565450172.db2.gz ACDYZAAAGMODIU-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN Cc1ccccc1NC(=O)[C@H]1CSCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000171795462 565450376 /nfs/dbraw/zinc/45/03/76/565450376.db2.gz CSANETPZBPLPGA-CYBMUJFWSA-N 0 0 377.447 3.119 20 5 GGBDRN CCN(CCc1cccs1)C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000299424107 565450495 /nfs/dbraw/zinc/45/04/95/565450495.db2.gz LAYMFGKXVFYWHS-UHFFFAOYSA-N 0 0 381.841 3.339 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000171795797 565450647 /nfs/dbraw/zinc/45/06/47/565450647.db2.gz YKZZCLRMWKMNKQ-ZDUSSCGKSA-N 0 0 377.447 3.119 20 5 GGBDRN Cc1ccccc1NC(=O)[C@@H]1CSCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000171795460 565451066 /nfs/dbraw/zinc/45/10/66/565451066.db2.gz CSANETPZBPLPGA-ZDUSSCGKSA-N 0 0 377.447 3.119 20 5 GGBDRN CCOC(=O)[C@H](CC)N(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CC1 ZINC000189203611 565451454 /nfs/dbraw/zinc/45/14/54/565451454.db2.gz XAMVBJNVEPERKK-AWEZNQCLSA-N 0 0 399.241 3.304 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC(C)(C)c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000171803864 565451584 /nfs/dbraw/zinc/45/15/84/565451584.db2.gz YBQRHUHHWXGEFI-UHFFFAOYSA-N 0 0 395.257 3.350 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(Br)cc2Cl)c1[N+](=O)[O-] ZINC000171805652 565451805 /nfs/dbraw/zinc/45/18/05/565451805.db2.gz VOOKJISVMIMIHM-UHFFFAOYSA-N 0 0 387.621 3.226 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)Cc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000171805359 565452053 /nfs/dbraw/zinc/45/20/53/565452053.db2.gz UHZRLXWVYFGORE-VIFPVBQESA-N 0 0 381.230 3.004 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)Cc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000171805362 565452166 /nfs/dbraw/zinc/45/21/66/565452166.db2.gz UHZRLXWVYFGORE-SECBINFHSA-N 0 0 381.230 3.004 20 5 GGBDRN Cc1cc(N2CCC(Cn3cncn3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000276597954 565454106 /nfs/dbraw/zinc/45/41/06/565454106.db2.gz KERLBIVOTVHTFP-UHFFFAOYSA-N 0 0 380.246 3.174 20 5 GGBDRN O=[N+]([O-])c1cc(Br)c(F)cc1OCc1nnc2n1CCCCC2 ZINC000276587309 565454476 /nfs/dbraw/zinc/45/44/76/565454476.db2.gz OAAQXZLESATCMH-UHFFFAOYSA-N 0 0 385.193 3.393 20 5 GGBDRN C[S@](=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000171849107 565454407 /nfs/dbraw/zinc/45/44/07/565454407.db2.gz ZTOQWWMPLPIXAR-VWLOTQADSA-N 0 0 378.475 3.244 20 5 GGBDRN Cc1cc(N2CCC(CC(=O)N(C)C)CC2)c(Br)cc1[N+](=O)[O-] ZINC000276669137 565456527 /nfs/dbraw/zinc/45/65/27/565456527.db2.gz SUKKGPYYRFEBFK-UHFFFAOYSA-N 0 0 384.274 3.360 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)C3CC3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000276692566 565457263 /nfs/dbraw/zinc/45/72/63/565457263.db2.gz WLQGAGYXFFVBBH-UHFFFAOYSA-N 0 0 382.258 3.161 20 5 GGBDRN Cc1nnc(NC(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)s1 ZINC000299661801 565457808 /nfs/dbraw/zinc/45/78/08/565457808.db2.gz NVTDMZWEGYIHHR-UHFFFAOYSA-N 0 0 398.242 3.107 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)c2c1CN(Cc1nc(C3CC3)no1)CC2 ZINC000299690808 565459330 /nfs/dbraw/zinc/45/93/30/565459330.db2.gz UOUBUZRMIREFMZ-UHFFFAOYSA-N 0 0 379.214 3.176 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)c2ccc(OC)c(Br)c2)c1[N+](=O)[O-] ZINC000171945924 565459489 /nfs/dbraw/zinc/45/94/89/565459489.db2.gz BCXWLHKUFNADGR-MRVPVSSYSA-N 0 0 397.229 3.142 20 5 GGBDRN Cc1noc(C)c1CC(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000299698857 565459548 /nfs/dbraw/zinc/45/95/48/565459548.db2.gz WXGTZVBHKGEENN-UHFFFAOYSA-N 0 0 394.225 3.090 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCO[C@@H](c3ccc(Cl)s3)C2)c1 ZINC000376926120 565460087 /nfs/dbraw/zinc/46/00/87/565460087.db2.gz HQJYUBCAAAOTQF-GFCCVEGCSA-N 0 0 388.854 3.072 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NCc1cccnc1N1CCOCC1 ZINC000301056487 565460967 /nfs/dbraw/zinc/46/09/67/565460967.db2.gz AFBRABKPBSCUDY-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN COc1ccc(CNc2ccc(I)cn2)cc1[N+](=O)[O-] ZINC000189362155 565461636 /nfs/dbraw/zinc/46/16/36/565461636.db2.gz PANHWMWNYGYEFR-UHFFFAOYSA-N 0 0 385.161 3.215 20 5 GGBDRN O=C(CCOCC(F)(F)C(F)F)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000276808422 565462018 /nfs/dbraw/zinc/46/20/18/565462018.db2.gz LWSIVUVKONUIIT-UHFFFAOYSA-N 0 0 386.729 3.214 20 5 GGBDRN NS(=O)(=O)c1cc(NCCc2cc(Cl)cc(Cl)c2)cc([N+](=O)[O-])c1 ZINC000301071728 565462287 /nfs/dbraw/zinc/46/22/87/565462287.db2.gz ALDTVIQZDMQNHT-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2coc(-c3cccs3)n2)ccc1[N+](=O)[O-] ZINC000172016150 565462774 /nfs/dbraw/zinc/46/27/74/565462774.db2.gz UMHISIHDNTVFJI-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN NS(=O)(=O)c1ccc(N[C@@H]2CCSc3c(F)cccc32)c([N+](=O)[O-])c1 ZINC000301098267 565463906 /nfs/dbraw/zinc/46/39/06/565463906.db2.gz SALMMJIBKAFCRG-GFCCVEGCSA-N 0 0 383.426 3.030 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cccnc3)CC2)c(Br)c1 ZINC000301107300 565464637 /nfs/dbraw/zinc/46/46/37/565464637.db2.gz QIXSORJRYYMWDO-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCc1cc(Cl)cc(Cl)c1 ZINC000301120964 565464838 /nfs/dbraw/zinc/46/48/38/565464838.db2.gz NSMLCFSXWNRGGO-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCn2c3ccccc3nc21 ZINC000377057252 565464830 /nfs/dbraw/zinc/46/48/30/565464830.db2.gz PJYIWHLWOMUWHJ-UHFFFAOYSA-N 0 0 393.222 3.429 20 5 GGBDRN C[C@H]1CCSCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000276884217 565465576 /nfs/dbraw/zinc/46/55/76/565465576.db2.gz PSHXDNWEYYCJTQ-QMMMGPOBSA-N 0 0 377.235 3.464 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)Cc1nc(C(F)(F)F)cs1 ZINC000276885307 565465599 /nfs/dbraw/zinc/46/55/99/565465599.db2.gz BCDURARUPOMKLW-UHFFFAOYSA-N 0 0 375.328 3.351 20 5 GGBDRN CS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000301126560 565465727 /nfs/dbraw/zinc/46/57/27/565465727.db2.gz ZKOMNNYVYHFULN-UHFFFAOYSA-N 0 0 385.239 3.373 20 5 GGBDRN CNC(=O)c1ccc(N2CCc3c(Br)cccc3C2)c([N+](=O)[O-])c1 ZINC000301131430 565465920 /nfs/dbraw/zinc/46/59/20/565465920.db2.gz RWNDHAUHZFTPQC-UHFFFAOYSA-N 0 0 390.237 3.280 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCOC[C@H]1c1nc2ccccc2s1 ZINC000377121474 565467246 /nfs/dbraw/zinc/46/72/46/565467246.db2.gz VBGVBEBETWMIDP-LBPRGKRZSA-N 0 0 375.431 3.480 20 5 GGBDRN O=[N+]([O-])c1cccnc1NCCc1ccc(I)s1 ZINC000301156310 565468094 /nfs/dbraw/zinc/46/80/94/565468094.db2.gz QCHZOEGYFUGIOP-UHFFFAOYSA-N 0 0 375.191 3.311 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCc1ccc(Br)cc1 ZINC000172175625 565470310 /nfs/dbraw/zinc/47/03/10/565470310.db2.gz YQOUUPWJSDBFCY-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN CC(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000172183188 565470659 /nfs/dbraw/zinc/47/06/59/565470659.db2.gz JSPACPCQMDLKTM-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCC(n2cc(Br)cn2)CC1 ZINC000377225346 565471352 /nfs/dbraw/zinc/47/13/52/565471352.db2.gz PVOIXPWKSQEUSP-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN Cc1cccnc1CNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000301207728 565471511 /nfs/dbraw/zinc/47/15/11/565471511.db2.gz SJFUORWVRATNFK-UHFFFAOYSA-N 0 0 375.328 3.204 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301205980 565472003 /nfs/dbraw/zinc/47/20/03/565472003.db2.gz ZAHTWZWUYPUZKX-LBPRGKRZSA-N 0 0 384.274 3.490 20 5 GGBDRN CC[C@@H]1CN(c2ccc(I)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000301229355 565473062 /nfs/dbraw/zinc/47/30/62/565473062.db2.gz DPODVTSPSJGIJU-MWLCHTKSSA-N 0 0 376.194 3.203 20 5 GGBDRN CS(=O)(=O)c1cc(SCC2CCC3(CC2)OCCO3)ccc1[N+](=O)[O-] ZINC000277053111 565473741 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O=C(NCCc1ccc(Br)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000172287324 565475785 /nfs/dbraw/zinc/47/57/85/565475785.db2.gz QUEYZHQZXWSMAD-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN COCC1CCN(c2ccc(I)cc2[N+](=O)[O-])CC1 ZINC000301277100 565476321 /nfs/dbraw/zinc/47/63/21/565476321.db2.gz ZCKBTXOMVGFLOZ-UHFFFAOYSA-N 0 0 376.194 3.062 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCSCc1ccccc1F ZINC000189584183 565476340 /nfs/dbraw/zinc/47/63/40/565476340.db2.gz FHDCCZUWUGDDTL-UHFFFAOYSA-N 0 0 384.454 3.483 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CN(C)c1ncc([N+](=O)[O-])cc1Cl ZINC000301288383 565476382 /nfs/dbraw/zinc/47/63/82/565476382.db2.gz RXQGTPQKKXBEOO-UHFFFAOYSA-N 0 0 385.207 3.380 20 5 GGBDRN Cc1ccnc(N2CCN(Cc3ccc(Br)s3)CC2)c1[N+](=O)[O-] ZINC000301280453 565476755 /nfs/dbraw/zinc/47/67/55/565476755.db2.gz JXJOERCKGKXCTG-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN COC[C@H]1CCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000301272175 565476844 /nfs/dbraw/zinc/47/68/44/565476844.db2.gz NWSWXOZXAVJFBA-JTQLQIEISA-N 0 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ZINC000301345782 565480535 /nfs/dbraw/zinc/48/05/35/565480535.db2.gz GULBMMWOFFCUTJ-LBPRGKRZSA-N 0 0 396.368 3.095 20 5 GGBDRN O=C(NCC1CC1)[C@@H]1CCCN(c2cc(Br)ccc2[N+](=O)[O-])C1 ZINC000301364858 565481222 /nfs/dbraw/zinc/48/12/22/565481222.db2.gz RTVWOYVLUGMIPA-GFCCVEGCSA-N 0 0 382.258 3.100 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1Br ZINC000172358888 565481209 /nfs/dbraw/zinc/48/12/09/565481209.db2.gz UXCZFSPUIVTNQB-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN O=C(NCC1CC1)[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301373817 565481507 /nfs/dbraw/zinc/48/15/07/565481507.db2.gz UTUFFGDRIBZLCI-LBPRGKRZSA-N 0 0 382.258 3.100 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1N1CCN(Cc2cccnc2)CC1 ZINC000301357266 565481812 /nfs/dbraw/zinc/48/18/12/565481812.db2.gz OYXAGMRYDSSEOA-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)COc2ccc(F)cc2)c(Br)c1 ZINC000301357548 565481837 /nfs/dbraw/zinc/48/18/37/565481837.db2.gz MTJFEWIHCNHHGD-GFCCVEGCSA-N 0 0 385.189 3.348 20 5 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CC[C@@H]1CN(c2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)CCS1 ZINC000301423432 565485011 /nfs/dbraw/zinc/48/50/11/565485011.db2.gz FYNQAVAPZSTRGI-CYBMUJFWSA-N 0 0 380.857 3.126 20 5 GGBDRN Cc1cc(N2CCC(C(=O)Nc3nncs3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000301431331 565486156 /nfs/dbraw/zinc/48/61/56/565486156.db2.gz GPYBIRUEBNQRAW-UHFFFAOYSA-N 0 0 381.845 3.263 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 ZINC000277262245 565486150 /nfs/dbraw/zinc/48/61/50/565486150.db2.gz LQHIHKVXCCOJRG-UHFFFAOYSA-N 0 0 399.241 3.163 20 5 GGBDRN CCC[C@@]1(CO)CCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000377583174 565486138 /nfs/dbraw/zinc/48/61/38/565486138.db2.gz LOJNIBRGEYYJRX-OAHLLOKOSA-N 0 0 386.246 3.374 20 5 GGBDRN Cc1cc(NCc2ccc(S(=O)(=O)N(C)C)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000301429178 565486584 /nfs/dbraw/zinc/48/65/84/565486584.db2.gz FNQGNSAOUNZGAC-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN C[C@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)S1 ZINC000301461115 565487582 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383.857 3.218 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Br)ccc2NC2CC2)c1[N+](=O)[O-] ZINC000278436634 565559209 /nfs/dbraw/zinc/55/92/09/565559209.db2.gz DXOHEDXDSSYPMH-UHFFFAOYSA-N 0 0 394.229 3.469 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3ncc(Br)cc3Cl)C2)nc1 ZINC000302814031 565559354 /nfs/dbraw/zinc/55/93/54/565559354.db2.gz ZTYUPGUJAVAYAJ-SNVBAGLBSA-N 0 0 398.648 3.492 20 5 GGBDRN NS(=O)(=O)c1cccc(Sc2nc(-c3ccccc3)co2)c1[N+](=O)[O-] ZINC000302827892 565559399 /nfs/dbraw/zinc/55/93/99/565559399.db2.gz NVOAVWGCSIXWRJ-UHFFFAOYSA-N 0 0 377.403 3.048 20 5 GGBDRN CN(CC(=O)Nc1cccc(Cl)c1)c1c(Br)cncc1[N+](=O)[O-] ZINC000302831063 565559417 /nfs/dbraw/zinc/55/94/17/565559417.db2.gz QPGKTQNSXGKTSA-UHFFFAOYSA-N 0 0 399.632 3.481 20 5 GGBDRN Cc1csc([C@H](NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C2CC2)n1 ZINC000173465772 565559616 /nfs/dbraw/zinc/55/96/16/565559616.db2.gz SREXBIHVEOHSCW-OAHLLOKOSA-N 0 0 381.479 3.406 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000173474791 565560100 /nfs/dbraw/zinc/56/01/00/565560100.db2.gz XTYBHFXUACKLEO-UHFFFAOYSA-N 0 0 382.825 3.466 20 5 GGBDRN CCCS(=O)(=O)N1CCC(Nc2c(C)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000302834499 565560400 /nfs/dbraw/zinc/56/04/00/565560400.db2.gz UAGQWNOAAGIHHX-UHFFFAOYSA-N 0 0 375.878 3.173 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC(C(=O)Nc2nncs2)CC1 ZINC000302837537 565560680 /nfs/dbraw/zinc/56/06/80/565560680.db2.gz XRCVXBOLTKCVBY-UHFFFAOYSA-N 0 0 381.845 3.263 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2ccc(OC(F)F)cn2)c(Br)c1 ZINC000302833677 565560712 /nfs/dbraw/zinc/56/07/12/565560712.db2.gz SQGULTLANJLDMZ-UHFFFAOYSA-N 0 0 375.129 3.361 20 5 GGBDRN CS[C@H](CO)[C@@H](C)Nc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278483030 565560777 /nfs/dbraw/zinc/56/07/77/565560777.db2.gz OWWPTPRQSMWFLC-HZGVNTEJSA-N 0 0 375.319 3.168 20 5 GGBDRN CSC1(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)CCC1 ZINC000302870650 565561384 /nfs/dbraw/zinc/56/13/84/565561384.db2.gz YLKCBGLYGVDWME-UHFFFAOYSA-N 0 0 385.511 3.077 20 5 GGBDRN COc1c(C(=O)NCCc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000391749611 565561665 /nfs/dbraw/zinc/56/16/65/565561665.db2.gz YDHGALJKUJCMMV-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN COc1cccc2c1CCN(c1c(Br)cncc1[N+](=O)[O-])CC2 ZINC000302865959 565561920 /nfs/dbraw/zinc/56/19/20/565561920.db2.gz UUGPHNGNNNOLFL-UHFFFAOYSA-N 0 0 378.226 3.366 20 5 GGBDRN Cc1nnc(CCNc2ccc(I)cc2[N+](=O)[O-])s1 ZINC000391930661 565563096 /nfs/dbraw/zinc/56/30/96/565563096.db2.gz XSLJAHILISILKH-UHFFFAOYSA-N 0 0 390.206 3.014 20 5 GGBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1Sc1nnnn1C1CC1 ZINC000278531975 565564140 /nfs/dbraw/zinc/56/41/40/565564140.db2.gz UFVLNHIQDHZNKA-UHFFFAOYSA-N 0 0 382.274 3.117 20 5 GGBDRN O=C(NCc1cc(Br)cc2c1OCC2)c1cc(F)cc([N+](=O)[O-])c1 ZINC000392333011 565564525 /nfs/dbraw/zinc/56/45/25/565564525.db2.gz SLZAFOAAPKBLLV-UHFFFAOYSA-N 0 0 395.184 3.361 20 5 GGBDRN CC(C)n1nnnc1Sc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278536895 565564634 /nfs/dbraw/zinc/56/46/34/565564634.db2.gz 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ZINC000173579695 565568488 /nfs/dbraw/zinc/56/84/88/565568488.db2.gz BTONIJOUFWFDJO-UHFFFAOYSA-N 0 0 384.255 3.171 20 5 GGBDRN Cn1cc(Br)c(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])n1 ZINC000393368121 565568831 /nfs/dbraw/zinc/56/88/31/565568831.db2.gz HYMGRSWNULBVBN-UHFFFAOYSA-N 0 0 380.124 3.117 20 5 GGBDRN O=C(N[C@@H]1CCC[C@@H]2OCC[C@H]21)c1sc(Br)cc1[N+](=O)[O-] ZINC000278627312 565569346 /nfs/dbraw/zinc/56/93/46/565569346.db2.gz MGFIUSLSHVYMEC-XKSSXDPKSA-N 0 0 375.244 3.106 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCCc2ccccc2OC(F)F)s1 ZINC000190906539 565569516 /nfs/dbraw/zinc/56/95/16/565569516.db2.gz DBIIKHCQIAELRI-UHFFFAOYSA-N 0 0 392.405 3.316 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(Br)cc1 ZINC000303357771 565570076 /nfs/dbraw/zinc/57/00/76/565570076.db2.gz ZXHUYSNXMJESJH-UHFFFAOYSA-N 0 0 399.266 3.398 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000303670108 565572821 /nfs/dbraw/zinc/57/28/21/565572821.db2.gz DBDILXWNUAAYRV-MEDUHNTESA-N 0 0 384.841 3.303 20 5 GGBDRN CN([C@H]1CCc2ccccc2C1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000303590280 565572883 /nfs/dbraw/zinc/57/28/83/565572883.db2.gz RUKZHEXAAWVJNN-HNNXBMFYSA-N 0 0 380.853 3.426 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c1Br ZINC000190972041 565573476 /nfs/dbraw/zinc/57/34/76/565573476.db2.gz ONHNWOJRXMXCIL-UHFFFAOYSA-N 0 0 399.266 3.285 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])c1Br ZINC000190973773 565574667 /nfs/dbraw/zinc/57/46/67/565574667.db2.gz CXHKVSAELSPRPN-UHFFFAOYSA-N 0 0 399.266 3.285 20 5 GGBDRN Cc1ccccc1CCNC(=O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000303862515 565574708 /nfs/dbraw/zinc/57/47/08/565574708.db2.gz GUTIBRSNCHXKIJ-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccc(C)o1 ZINC000173692870 565576658 /nfs/dbraw/zinc/57/66/58/565576658.db2.gz UMNXKLYLPYGDKG-ZDUSSCGKSA-N 0 0 383.198 3.376 20 5 GGBDRN O=[N+]([O-])c1cnc(N[C@H]2CCN(Cc3ccccc3)C2)c(Br)c1 ZINC000309865780 565578326 /nfs/dbraw/zinc/57/83/26/565578326.db2.gz FJMLBBGSUULIOX-ZDUSSCGKSA-N 0 0 377.242 3.439 20 5 GGBDRN COc1cc(C(=O)N(C)Cc2nc(C(F)(F)F)cs2)ccc1[N+](=O)[O-] ZINC000173725855 565579503 /nfs/dbraw/zinc/57/95/03/565579503.db2.gz PQYCCAQAGZDXBH-UHFFFAOYSA-N 0 0 375.328 3.351 20 5 GGBDRN CN1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c2cc(F)ccc21 ZINC000173776746 565585073 /nfs/dbraw/zinc/58/50/73/565585073.db2.gz WQIFDPAZAHUPGC-UHFFFAOYSA-N 0 0 385.804 3.032 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(Br)c(F)cc1C ZINC000191180090 565586517 /nfs/dbraw/zinc/58/65/17/565586517.db2.gz DAZLWCWRNMBKNK-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1cccc(Br)c1 ZINC000314739242 565587362 /nfs/dbraw/zinc/58/73/62/565587362.db2.gz BSTBATMAYZWYBH-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1cccc(Br)c1 ZINC000314800129 565588601 /nfs/dbraw/zinc/58/86/01/565588601.db2.gz MYPVOXFPRVAICY-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C)C1 ZINC000407979360 565589405 /nfs/dbraw/zinc/58/94/05/565589405.db2.gz XQLNERKQCAJWID-VIFPVBQESA-N 0 0 388.205 3.380 20 5 GGBDRN Cc1csc([C@@H]2CCCN(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)C2)n1 ZINC000173820569 565589567 /nfs/dbraw/zinc/58/95/67/565589567.db2.gz IARXENUJVGLDRY-CYBMUJFWSA-N 0 0 381.479 3.236 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2cc3c(cc2Cl)CCC3=O)cc1[N+](=O)[O-] ZINC000191226769 565589720 /nfs/dbraw/zinc/58/97/20/565589720.db2.gz ZMZQLSJEXYDLHB-UHFFFAOYSA-N 0 0 380.809 3.486 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cc2c(cc1Cl)CCC2=O ZINC000191227369 565589974 /nfs/dbraw/zinc/58/99/74/565589974.db2.gz QCIOHDPHQPZTDB-UHFFFAOYSA-N 0 0 380.809 3.486 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCCC[C@H](C)O)cc2[N+](=O)[O-])n1 ZINC000279036180 565591072 /nfs/dbraw/zinc/59/10/72/565591072.db2.gz CEZPDOXWNZWYJX-NSHDSACASA-N 0 0 381.479 3.402 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCOC2(CCCC2)C1 ZINC000408006406 565591119 /nfs/dbraw/zinc/59/11/19/565591119.db2.gz YYWVTYXKMGICRA-UHFFFAOYSA-N 0 0 383.242 3.451 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000173835980 565591926 /nfs/dbraw/zinc/59/19/26/565591926.db2.gz LNBSMKGPXYCDEM-SNVBAGLBSA-N 0 0 395.384 3.500 20 5 GGBDRN Cc1c(CNS(=O)(=O)c2ccccc2Br)cccc1[N+](=O)[O-] ZINC000318455200 565595115 /nfs/dbraw/zinc/59/51/15/565595115.db2.gz CGITYTWWIALAHP-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1c(CNS(=O)(=O)c2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000318215506 565595670 /nfs/dbraw/zinc/59/56/70/565595670.db2.gz AOTVIPMHEIYWOW-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN C[C@@H](SC[C@@H](C)CO)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000173930318 565599143 /nfs/dbraw/zinc/59/91/43/565599143.db2.gz ORDNAAXIKMDMMV-WDEREUQCSA-N 0 0 381.479 3.407 20 5 GGBDRN O=C(NCCCn1cc(Br)cn1)c1ccc([N+](=O)[O-])cc1Cl ZINC000319449506 565599371 /nfs/dbraw/zinc/59/93/71/565599371.db2.gz JPCWNFMQAOWWRO-UHFFFAOYSA-N 0 0 387.621 3.027 20 5 GGBDRN C[C@H](CO)CS[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000173930306 565599459 /nfs/dbraw/zinc/59/94/59/565599459.db2.gz ORDNAAXIKMDMMV-MNOVXSKESA-N 0 0 381.479 3.407 20 5 GGBDRN CC[C@@H]1CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Br)CCS1 ZINC000173933300 565600881 /nfs/dbraw/zinc/60/08/81/565600881.db2.gz KOBFMMWRMGAFJL-LLVKDONJSA-N 0 0 388.287 3.123 20 5 GGBDRN C[C@H](N[C@H](C(N)=O)c1ccc(Br)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000173964367 565601799 /nfs/dbraw/zinc/60/17/99/565601799.db2.gz SHCYRJLYYQDESU-VFZGTOFNSA-N 0 0 396.216 3.374 20 5 GGBDRN Cc1ccc(NS(C)(=O)=O)c(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000173971485 565602620 /nfs/dbraw/zinc/60/26/20/565602620.db2.gz BLHZHUUKWSYRHT-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN Cn1cc([C@@H]2CSCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000191434091 565603859 /nfs/dbraw/zinc/60/38/59/565603859.db2.gz KCIQFIYPBUVECE-AWEZNQCLSA-N 0 0 381.845 3.304 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000173987149 565604516 /nfs/dbraw/zinc/60/45/16/565604516.db2.gz AWHAUTULUQBUHK-INIZCTEOSA-N 0 0 384.841 3.055 20 5 GGBDRN Cc1c(C(=O)NCCCCn2cc(Br)cn2)cccc1[N+](=O)[O-] ZINC000279268393 565605015 /nfs/dbraw/zinc/60/50/15/565605015.db2.gz ANNZQYPPYGOBBJ-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN CN1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccc(F)cc21 ZINC000174016571 565606272 /nfs/dbraw/zinc/60/62/72/565606272.db2.gz AZYVPCRKWNVWCE-UHFFFAOYSA-N 0 0 385.804 3.032 20 5 GGBDRN CN1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccc(F)cc21 ZINC000174019247 565606519 /nfs/dbraw/zinc/60/65/19/565606519.db2.gz OHGUIPVYEPFGIU-UHFFFAOYSA-N 0 0 385.804 3.032 20 5 GGBDRN C[C@@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC[S@@]1=O ZINC000408372942 565606540 /nfs/dbraw/zinc/60/65/40/565606540.db2.gz CJLPSTUKSWCVCA-WYVULQQZSA-N 0 0 398.282 3.253 20 5 GGBDRN CC(C)C[C@@]1(CO)CCCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000191473426 565607123 /nfs/dbraw/zinc/60/71/23/565607123.db2.gz GORMXAATMQGKPA-MRXNPFEDSA-N 0 0 385.258 3.371 20 5 GGBDRN CCOC(=O)C(C)(C)C(=O)COc1c(C)cc(Br)cc1[N+](=O)[O-] ZINC000322113432 565607746 /nfs/dbraw/zinc/60/77/46/565607746.db2.gz GNOWKDUJOKDAAF-UHFFFAOYSA-N 0 0 388.214 3.203 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@@H]3CCCC[C@@H]3C2)c(Br)c1 ZINC000408447302 565609887 /nfs/dbraw/zinc/60/98/87/565609887.db2.gz WOGMQNPUQZHZID-PHIMTYICSA-N 0 0 389.271 3.168 20 5 GGBDRN COc1c(C(=O)NCc2cc(Br)ccc2F)cccc1[N+](=O)[O-] ZINC000322691386 565610454 /nfs/dbraw/zinc/61/04/54/565610454.db2.gz MFXVGGLCJMCUJV-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1c(Br)c(NC[C@H]2CCN(CC(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000322571257 565610825 /nfs/dbraw/zinc/61/08/25/565610825.db2.gz SMTNVUMVWLFNLB-SECBINFHSA-N 0 0 397.195 3.357 20 5 GGBDRN O=C(Nc1cccnc1Br)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191554250 565612360 /nfs/dbraw/zinc/61/23/60/565612360.db2.gz OXBNNHBEEUPKSR-UHFFFAOYSA-N 0 0 393.197 3.047 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCc2cc(Br)ccc2C1 ZINC000191552971 565612631 /nfs/dbraw/zinc/61/26/31/565612631.db2.gz ULOMWPXKOGYCMN-UHFFFAOYSA-N 0 0 375.222 3.485 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(F)c(Br)c2)c(C)c1[N+](=O)[O-] ZINC000174106947 565613261 /nfs/dbraw/zinc/61/32/61/565613261.db2.gz ADVOZGMMUGDGRQ-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCc3cc(Br)ccc32)n1 ZINC000191561048 565613648 /nfs/dbraw/zinc/61/36/48/565613648.db2.gz DZJFXRFUVXNHAR-UHFFFAOYSA-N 0 0 379.214 3.167 20 5 GGBDRN Cc1c(Br)c(N2CCC[C@@](O)(C(F)(F)F)CC2)ncc1[N+](=O)[O-] ZINC000323748964 565615138 /nfs/dbraw/zinc/61/51/38/565615138.db2.gz RXAAFYDTQUPQKI-LBPRGKRZSA-N 0 0 398.179 3.344 20 5 GGBDRN Cc1c(Br)c(N2CCC[C@](O)(C(F)(F)F)CC2)ncc1[N+](=O)[O-] ZINC000323748963 565615494 /nfs/dbraw/zinc/61/54/94/565615494.db2.gz RXAAFYDTQUPQKI-GFCCVEGCSA-N 0 0 398.179 3.344 20 5 GGBDRN CO[C@@H]1[C@@H](C)[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C1(C)C ZINC000409543698 565623076 /nfs/dbraw/zinc/62/30/76/565623076.db2.gz MNXWPGHSBDZLSK-NRZXQICZSA-N 0 0 377.260 3.208 20 5 GGBDRN COC(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000409550670 565623571 /nfs/dbraw/zinc/62/35/71/565623571.db2.gz FTWYQNMMKAYJQA-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Br)cc1 ZINC000326217334 565623842 /nfs/dbraw/zinc/62/38/42/565623842.db2.gz ZBRAEZZYERXLIC-UHFFFAOYSA-N 0 0 387.193 3.499 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc2cc(Br)cnc21 ZINC000325978377 565623881 /nfs/dbraw/zinc/62/38/81/565623881.db2.gz ZXSVCXMYQOXWKE-UHFFFAOYSA-N 0 0 388.181 3.135 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000279643741 565624143 /nfs/dbraw/zinc/62/41/43/565624143.db2.gz GRWVRAUBKFEWLH-LBPRGKRZSA-N 0 0 395.213 3.195 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000279643739 565624832 /nfs/dbraw/zinc/62/48/32/565624832.db2.gz GRWVRAUBKFEWLH-GFCCVEGCSA-N 0 0 395.213 3.195 20 5 GGBDRN O=C(NCCSCC(F)(F)F)c1sc(Br)cc1[N+](=O)[O-] ZINC000409558997 565624800 /nfs/dbraw/zinc/62/48/00/565624800.db2.gz WZZZTHBQAHWKTK-UHFFFAOYSA-N 0 0 393.206 3.444 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000279696357 565628312 /nfs/dbraw/zinc/62/83/12/565628312.db2.gz MHFXHNZGGNPBMT-ZDUSSCGKSA-N 0 0 395.213 3.195 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1NCc1ccc(I)c(Cl)c1 ZINC000409637267 565628699 /nfs/dbraw/zinc/62/86/99/565628699.db2.gz XDEARVFOFDTJNB-UHFFFAOYSA-N 0 0 392.584 3.198 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC000409648468 565630071 /nfs/dbraw/zinc/63/00/71/565630071.db2.gz RVZFHPBVJONJRP-NSHDSACASA-N 0 0 377.413 3.083 20 5 GGBDRN Cc1csc(NC(=O)CSc2ncc(Br)cc2[N+](=O)[O-])n1 ZINC000409650248 565630266 /nfs/dbraw/zinc/63/02/66/565630266.db2.gz CAAJSYBXIONZHL-UHFFFAOYSA-N 0 0 389.256 3.248 20 5 GGBDRN O=C(CCNC(=O)c1csc([N+](=O)[O-])c1)Nc1ccc(Br)cc1 ZINC000409652658 565630402 /nfs/dbraw/zinc/63/04/02/565630402.db2.gz PWQCEWXETIHFPN-UHFFFAOYSA-N 0 0 398.238 3.177 20 5 GGBDRN C[S@@](=O)C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000174368708 565631286 /nfs/dbraw/zinc/63/12/86/565631286.db2.gz LGQQIEHSPLZPPZ-ODCWNRFASA-N 0 0 381.841 3.490 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000279826700 565634980 /nfs/dbraw/zinc/63/49/80/565634980.db2.gz CLGYJVDGILEXMQ-BZNIZROVSA-N 0 0 388.848 3.101 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N(c1ccccc1)[C@H]1CCOC1 ZINC000191825280 565635559 /nfs/dbraw/zinc/63/55/59/565635559.db2.gz YVWOBXVJRXAFRL-AWEZNQCLSA-N 0 0 382.825 3.232 20 5 GGBDRN C[C@H](O)C[C@H]1CCCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000279862807 565637320 /nfs/dbraw/zinc/63/73/20/565637320.db2.gz SKTLUKKUYKUFLM-GXSJLCMTSA-N 0 0 389.221 3.262 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@@H](C2CC2)O1 ZINC000279864489 565637330 /nfs/dbraw/zinc/63/73/30/565637330.db2.gz GNFKROOPIWYSPW-SDBXPKJASA-N 0 0 387.205 3.136 20 5 GGBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000279881182 565638734 /nfs/dbraw/zinc/63/87/34/565638734.db2.gz HFFQKGVMFNOMOX-VIFPVBQESA-N 0 0 395.213 3.227 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCC[C@H]1OC(F)F ZINC000409753122 565639106 /nfs/dbraw/zinc/63/91/06/565639106.db2.gz PBKJWJZFSVOYAT-DGCLKSJQSA-N 0 0 377.775 3.250 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc(Br)c(F)cc2F)cc1 ZINC000191879038 565639232 /nfs/dbraw/zinc/63/92/32/565639232.db2.gz KTYBWZJXXRSGLB-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CCC(F)(F)F)CC(F)(F)F)cc1 ZINC000279924214 565640839 /nfs/dbraw/zinc/64/08/39/565640839.db2.gz ILWSSGFDTSZLRO-UHFFFAOYSA-N 0 0 380.266 3.100 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)c1cc(C)c(Cl)s1 ZINC000191905135 565641264 /nfs/dbraw/zinc/64/12/64/565641264.db2.gz JUEFZQKRODTFHF-UHFFFAOYSA-N 0 0 376.843 3.105 20 5 GGBDRN CO[C@H]1Cc2ccccc2N(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000409822745 565642199 /nfs/dbraw/zinc/64/21/99/565642199.db2.gz IRVMHJODRIHZEK-ZDUSSCGKSA-N 0 0 382.825 3.015 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCC[C@H](c3nccs3)C2)cc1[N+](=O)[O-] ZINC000191974504 565647545 /nfs/dbraw/zinc/64/75/45/565647545.db2.gz HLXSJDIOIJAJHW-ZDUSSCGKSA-N 0 0 381.479 3.236 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000280049848 565649482 /nfs/dbraw/zinc/64/94/82/565649482.db2.gz PXTMJPVCOYOIBS-QMMMGPOBSA-N 0 0 382.218 3.090 20 5 GGBDRN O=[N+]([O-])c1cccc(NS(=O)(=O)c2ccc(F)c(Br)c2)c1 ZINC000174648173 565649630 /nfs/dbraw/zinc/64/96/30/565649630.db2.gz AAFPROQTBOFRLG-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000174647891 565649647 /nfs/dbraw/zinc/64/96/47/565649647.db2.gz FIZAMTXVIURGGC-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c(C)o1 ZINC000174660973 565650055 /nfs/dbraw/zinc/65/00/55/565650055.db2.gz CIAIJUPBQUKIMK-INIZCTEOSA-N 0 0 397.225 3.205 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c(C)o1 ZINC000174660962 565650220 /nfs/dbraw/zinc/65/02/20/565650220.db2.gz CIAIJUPBQUKIMK-MRXNPFEDSA-N 0 0 397.225 3.205 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)CSc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000174669104 565651361 /nfs/dbraw/zinc/65/13/61/565651361.db2.gz GXVUBEKOLCSDSI-SECBINFHSA-N 0 0 382.751 3.012 20 5 GGBDRN C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCS1(=O)=O ZINC000192049128 565653068 /nfs/dbraw/zinc/65/30/68/565653068.db2.gz WEKFZZMXUZCFAH-ZDUSSCGKSA-N 0 0 380.491 3.332 20 5 GGBDRN CC(C)c1nnc2n1C[C@@H](Nc1ccc([N+](=O)[O-])cc1Br)CC2 ZINC000174713489 565653540 /nfs/dbraw/zinc/65/35/40/565653540.db2.gz ATDLYNPAESPOIF-JTQLQIEISA-N 0 0 380.246 3.499 20 5 GGBDRN C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCS(=O)(=O)C1 ZINC000192065866 565654676 /nfs/dbraw/zinc/65/46/76/565654676.db2.gz RYBZKSVDSCMFGU-ZDUSSCGKSA-N 0 0 380.491 3.190 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(CCC(F)(F)F)CC(F)(F)F ZINC000280166853 565656130 /nfs/dbraw/zinc/65/61/30/565656130.db2.gz SPUBSXWSQZZRSC-UHFFFAOYSA-N 0 0 394.293 3.409 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(CCC(F)(F)F)CC(F)(F)F ZINC000280173983 565656533 /nfs/dbraw/zinc/65/65/33/565656533.db2.gz TVNMPMQTLMKNLI-UHFFFAOYSA-N 0 0 394.293 3.241 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@@H](C)CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000192092403 565657682 /nfs/dbraw/zinc/65/76/82/565657682.db2.gz YOSMYGKNBDLFSM-LBPRGKRZSA-N 0 0 382.463 3.213 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@@H](C)c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000280209284 565658591 /nfs/dbraw/zinc/65/85/91/565658591.db2.gz KBCOKIACNFJCGG-VIFPVBQESA-N 0 0 395.213 3.497 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCS1 ZINC000192163589 565664742 /nfs/dbraw/zinc/66/47/42/565664742.db2.gz BEHKGXWFQHAKER-SECBINFHSA-N 0 0 384.401 3.130 20 5 GGBDRN C[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000280323959 565666331 /nfs/dbraw/zinc/66/63/31/565666331.db2.gz RDHDFCZMMQGRFT-NSHDSACASA-N 0 0 393.241 3.355 20 5 GGBDRN Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c1O ZINC000174936705 565668821 /nfs/dbraw/zinc/66/88/21/565668821.db2.gz ABRCRJOAPPIWHE-UHFFFAOYSA-N 0 0 398.156 3.466 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@@H]2CCCC[C@H]2OC(F)F)c1 ZINC000410173518 565669333 /nfs/dbraw/zinc/66/93/33/565669333.db2.gz YJAVNWRYORJDCZ-DGCLKSJQSA-N 0 0 378.397 3.040 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000410179125 565669587 /nfs/dbraw/zinc/66/95/87/565669587.db2.gz OQFILTYVMAHHHJ-CHWSQXEVSA-N 0 0 378.397 3.040 20 5 GGBDRN CCCn1ccnc1CCCN(C)c1ncc(Br)cc1[N+](=O)[O-] ZINC000192236417 565672968 /nfs/dbraw/zinc/67/29/68/565672968.db2.gz VVDGVFGJRZHRGE-UHFFFAOYSA-N 0 0 382.262 3.428 20 5 GGBDRN CCC[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000280496655 565674885 /nfs/dbraw/zinc/67/48/85/565674885.db2.gz OYTOJPQMBAEGSZ-IUODEOHRSA-N 0 0 384.479 3.374 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCC(c2ccncc2)CC1 ZINC000192261441 565675100 /nfs/dbraw/zinc/67/51/00/565675100.db2.gz BQRBGRMYDQGQBQ-UHFFFAOYSA-N 0 0 381.841 3.212 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CCCN(C)C(=O)OC(C)(C)C ZINC000280494770 565675450 /nfs/dbraw/zinc/67/54/50/565675450.db2.gz BZGOXTCZLDUDDB-UHFFFAOYSA-N 0 0 377.239 3.119 20 5 GGBDRN C[C@H](N[C@@H](C)c1ccc(Br)cn1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000280536620 565678830 /nfs/dbraw/zinc/67/88/30/565678830.db2.gz PLEKLGPPFQSFCW-QWRGUYRKSA-N 0 0 393.241 3.430 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCCC[C@@H]1c1ncon1 ZINC000192336434 565680584 /nfs/dbraw/zinc/68/05/84/565680584.db2.gz UEFLDTHAJRLDCQ-LLVKDONJSA-N 0 0 381.186 3.108 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cccc(Br)c1F ZINC000410379457 565680773 /nfs/dbraw/zinc/68/07/73/565680773.db2.gz GGLUJQLLISUCMS-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN C[C@@H](N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1)C(F)(F)F ZINC000175142735 565681447 /nfs/dbraw/zinc/68/14/47/565681447.db2.gz IDCSBMOYVXPDCU-SECBINFHSA-N 0 0 380.754 3.349 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])nc1 ZINC000175244364 565686991 /nfs/dbraw/zinc/68/69/91/565686991.db2.gz NYRDTKZBPFGNKV-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN Cc1c(NC(=O)N2CCO[C@H]3CCC[C@@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000280694271 565689616 /nfs/dbraw/zinc/68/96/16/565689616.db2.gz HCBKVQREKLDSOU-JSGCOSHPSA-N 0 0 384.230 3.451 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC000280754407 565693934 /nfs/dbraw/zinc/69/39/34/565693934.db2.gz QCKDHNNNSZSHHS-CQSZACIVSA-N 0 0 397.204 3.057 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2ccc(Br)cc2N2CCOCC2)s1 ZINC000192499613 565696257 /nfs/dbraw/zinc/69/62/57/565696257.db2.gz XIBGJCTZEJVRHV-UHFFFAOYSA-N 0 0 399.270 3.263 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1cc2c(c(Br)c1)OCO2 ZINC000192531105 565698166 /nfs/dbraw/zinc/69/81/66/565698166.db2.gz IZIUUGMNSADILF-UHFFFAOYSA-N 0 0 383.202 3.223 20 5 GGBDRN O=C(Nc1cc(F)c(F)cc1I)c1ccc([N+](=O)[O-])o1 ZINC000175413201 565698749 /nfs/dbraw/zinc/69/87/49/565698749.db2.gz LVUAOZKHXSUKLO-UHFFFAOYSA-N 0 0 394.071 3.323 20 5 GGBDRN C[C@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000175409626 565698769 /nfs/dbraw/zinc/69/87/69/565698769.db2.gz HGWHBNKNURUFIS-LLVKDONJSA-N 0 0 379.869 3.486 20 5 GGBDRN NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 ZINC000175452814 565700732 /nfs/dbraw/zinc/70/07/32/565700732.db2.gz UHWUGPSJEHIRHO-UHFFFAOYSA-N 0 0 379.825 3.005 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1nc2c(s1)CCCC2 ZINC000175474578 565701434 /nfs/dbraw/zinc/70/14/34/565701434.db2.gz WCAXTWVYKLGCRC-UHFFFAOYSA-N 0 0 381.479 3.059 20 5 GGBDRN CN(C(=O)C1(c2cncc(Br)c2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000280926992 565703672 /nfs/dbraw/zinc/70/36/72/565703672.db2.gz BMAMRYBBOUVOJO-UHFFFAOYSA-N 0 0 376.210 3.447 20 5 GGBDRN COC(=O)c1cc(Br)ccc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000192645616 565704458 /nfs/dbraw/zinc/70/44/58/565704458.db2.gz VAYJOOVEJCRIHM-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000175530294 565704920 /nfs/dbraw/zinc/70/49/20/565704920.db2.gz PNNQSGJIIFYEHT-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000411026411 565705176 /nfs/dbraw/zinc/70/51/76/565705176.db2.gz UHOYAUXERFFIQF-ZBFHGGJFSA-N 0 0 381.226 3.141 20 5 GGBDRN CSc1nsc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000175526010 565705452 /nfs/dbraw/zinc/70/54/52/565705452.db2.gz JOEXDLOWOWXEHH-UHFFFAOYSA-N 0 0 375.229 3.183 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000411026408 565705560 /nfs/dbraw/zinc/70/55/60/565705560.db2.gz UHOYAUXERFFIQF-HOCLYGCPSA-N 0 0 381.226 3.141 20 5 GGBDRN COc1ccc2c(n1)N(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000411050249 565707354 /nfs/dbraw/zinc/70/73/54/565707354.db2.gz QZRAQAUJLVLBBS-UHFFFAOYSA-N 0 0 379.825 3.333 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(Br)cn(C)c2=O)cc1[N+](=O)[O-] ZINC000175543276 565707469 /nfs/dbraw/zinc/70/74/69/565707469.db2.gz WLGRBPRIUJYMIK-UHFFFAOYSA-N 0 0 398.238 3.030 20 5 GGBDRN COc1ccc2c(n1)N(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)CC2 ZINC000411048266 565707495 /nfs/dbraw/zinc/70/74/95/565707495.db2.gz OFZVKVFPFLGUJY-UHFFFAOYSA-N 0 0 392.209 3.272 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCN(C)C[C@@H]1C(C)C ZINC000330482308 565708564 /nfs/dbraw/zinc/70/85/64/565708564.db2.gz RDZMPVZQFFNNKU-OAHLLOKOSA-N 0 0 384.274 3.078 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(Br)cn(C)c2=O)c1 ZINC000175555582 565708602 /nfs/dbraw/zinc/70/86/02/565708602.db2.gz BWFKQZZRSSPNER-UHFFFAOYSA-N 0 0 398.238 3.030 20 5 GGBDRN Cc1nc(C2(NC(=O)c3ccc(Br)cc3[N+](=O)[O-])CCCC2)no1 ZINC000175557112 565708724 /nfs/dbraw/zinc/70/87/24/565708724.db2.gz YJLOCABLKUYFGG-UHFFFAOYSA-N 0 0 395.213 3.248 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)C[C@H]1C(N)=O ZINC000330503540 565709708 /nfs/dbraw/zinc/70/97/08/565709708.db2.gz FFDOSCSHRVEWAL-SDBXPKJASA-N 0 0 384.230 3.442 20 5 GGBDRN CN(C1CCCCC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000330502830 565710121 /nfs/dbraw/zinc/71/01/21/565710121.db2.gz XSAIUDQSHJQKKR-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN CC(C)CN(Cc1cnn(C)c1)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000411101062 565711496 /nfs/dbraw/zinc/71/14/96/565711496.db2.gz VYJJIDFMOZXBPA-UHFFFAOYSA-N 0 0 395.257 3.389 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1csc(-c2ccccc2)n1 ZINC000192813452 565711889 /nfs/dbraw/zinc/71/18/89/565711889.db2.gz FKNPTVWCUHAPKR-UHFFFAOYSA-N 0 0 375.431 3.197 20 5 GGBDRN C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1cc(F)c(Cl)cc1Cl ZINC000192821955 565712112 /nfs/dbraw/zinc/71/21/12/565712112.db2.gz ODMGSWVWEZDPGV-MRVPVSSYSA-N 0 0 388.182 3.080 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCCc2cc(Cl)cc(Br)c21 ZINC000411107029 565712201 /nfs/dbraw/zinc/71/22/01/565712201.db2.gz DLZYYPZJJRXILH-UHFFFAOYSA-N 0 0 399.632 3.337 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C[C@H](C)O ZINC000330624726 565714587 /nfs/dbraw/zinc/71/45/87/565714587.db2.gz RUYLYONGQWOGRQ-JQWIXIFHSA-N 0 0 385.258 3.431 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@@H]2CCO[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000330630511 565715642 /nfs/dbraw/zinc/71/56/42/565715642.db2.gz OLKTYNXSIBYCLH-ABAIWWIYSA-N 0 0 376.862 3.039 20 5 GGBDRN CC(C)[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000330631074 565715825 /nfs/dbraw/zinc/71/58/25/565715825.db2.gz PBLDFTUGUABDMI-WFASDCNBSA-N 0 0 385.258 3.220 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@H]2CCO[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000330630513 565715916 /nfs/dbraw/zinc/71/59/16/565715916.db2.gz OLKTYNXSIBYCLH-NHYWBVRUSA-N 0 0 376.862 3.039 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000175777485 565723918 /nfs/dbraw/zinc/72/39/18/565723918.db2.gz HLEQTGMTDUSHIK-UHFFFAOYSA-N 0 0 394.225 3.471 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])s1 ZINC000281477562 565731895 /nfs/dbraw/zinc/73/18/95/565731895.db2.gz MWZGEFORBUGSEH-UHFFFAOYSA-N 0 0 395.384 3.476 20 5 GGBDRN CN(Cc1cc(Br)ccc1F)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000175927724 565734701 /nfs/dbraw/zinc/73/47/01/565734701.db2.gz FKKFWMIRJHHBQC-UHFFFAOYSA-N 0 0 382.189 3.351 20 5 GGBDRN CC[C@H](NS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000331001852 565734699 /nfs/dbraw/zinc/73/46/99/565734699.db2.gz QUCQOKIKSXPORA-AWEZNQCLSA-N 0 0 376.862 3.040 20 5 GGBDRN Cc1ncc(CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Br)s1 ZINC000175955044 565735783 /nfs/dbraw/zinc/73/57/83/565735783.db2.gz BVOJVGIJBHTHAM-UHFFFAOYSA-N 0 0 384.255 3.323 20 5 GGBDRN CC[C@H]1[C@H](C)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331073388 565737717 /nfs/dbraw/zinc/73/77/17/565737717.db2.gz TWZOVSMTKNDHTH-SKDRFNHKSA-N 0 0 377.260 3.166 20 5 GGBDRN CC[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCCO1 ZINC000281575008 565737880 /nfs/dbraw/zinc/73/78/80/565737880.db2.gz LSJGAGWHVFJINM-JTQLQIEISA-N 0 0 375.194 3.138 20 5 GGBDRN CC[C@@H]1[C@@H](C)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331073387 565737994 /nfs/dbraw/zinc/73/79/94/565737994.db2.gz TWZOVSMTKNDHTH-JOYOIKCWSA-N 0 0 377.260 3.166 20 5 GGBDRN CSc1ccc(C(=O)Nc2nc(-c3cccs3)nn2C)cc1[N+](=O)[O-] ZINC000193207453 565738752 /nfs/dbraw/zinc/73/87/52/565738752.db2.gz QBOIRLPTKLEIRG-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN Cc1nc(NC(=O)C2(c3cncc(Br)c3)CC2)ccc1[N+](=O)[O-] ZINC000281593828 565739024 /nfs/dbraw/zinc/73/90/24/565739024.db2.gz RIXKEPFRSJPQKF-UHFFFAOYSA-N 0 0 377.198 3.126 20 5 GGBDRN Cc1cc([C@H](C)NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c(C)s1 ZINC000193247306 565739798 /nfs/dbraw/zinc/73/97/98/565739798.db2.gz HRZRVSYRVYLDDC-JTQLQIEISA-N 0 0 382.463 3.168 20 5 GGBDRN CCC(C)(C)NC(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193247067 565739827 /nfs/dbraw/zinc/73/98/27/565739827.db2.gz CHAYWKOPICDEAI-UHFFFAOYSA-N 0 0 376.194 3.426 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)Nc1nccs1 ZINC000193237510 565740282 /nfs/dbraw/zinc/74/02/82/565740282.db2.gz NTRYSOPCEAYHQU-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN CC1=C(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000331128130 565741183 /nfs/dbraw/zinc/74/11/83/565741183.db2.gz PDRDSXKCLOUGTE-UHFFFAOYSA-N 0 0 375.244 3.088 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)cc1 ZINC000331162139 565743513 /nfs/dbraw/zinc/74/35/13/565743513.db2.gz LBSSYCQYTBFSEY-TZMCWYRMSA-N 0 0 380.388 3.383 20 5 GGBDRN CCC[C@H](NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C1CCC1 ZINC000411708801 565746722 /nfs/dbraw/zinc/74/67/22/565746722.db2.gz JQBGOAWPLGHKLB-AWEZNQCLSA-N 0 0 398.257 3.381 20 5 GGBDRN CCC[C@@H](NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C1CCC1 ZINC000411708803 565747277 /nfs/dbraw/zinc/74/72/77/565747277.db2.gz JQBGOAWPLGHKLB-CQSZACIVSA-N 0 0 398.257 3.381 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(I)c(C)n2)c1 ZINC000176106119 565749219 /nfs/dbraw/zinc/74/92/19/565749219.db2.gz KDJWOPMFEKLMOI-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N(C)c1ccccn1 ZINC000193396786 565749309 /nfs/dbraw/zinc/74/93/09/565749309.db2.gz ZNSLIULRXFGGGP-UHFFFAOYSA-N 0 0 397.172 3.179 20 5 GGBDRN Cc1nc(C)c(-c2csc(NC(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)n2)s1 ZINC000193425035 565750178 /nfs/dbraw/zinc/75/01/78/565750178.db2.gz KIHHOPRACUSPCO-UHFFFAOYSA-N 0 0 377.407 3.145 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1Cc2cc(Br)ccc2O1 ZINC000193460970 565752969 /nfs/dbraw/zinc/75/29/69/565752969.db2.gz KZNQQCVPRAYWKM-HNNXBMFYSA-N 0 0 393.193 3.308 20 5 GGBDRN O=C([C@@H]1Cc2cc(Br)ccc2O1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000193479273 565754731 /nfs/dbraw/zinc/75/47/31/565754731.db2.gz CZEZQTYVSNWGFH-INIZCTEOSA-N 0 0 389.205 3.250 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NCC(C)(C)C ZINC000193487955 565755505 /nfs/dbraw/zinc/75/55/05/565755505.db2.gz SLSBNEGFODNTMY-UHFFFAOYSA-N 0 0 376.194 3.284 20 5 GGBDRN O=C([C@H]1Cc2cc(Br)ccc2O1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000193487952 565755533 /nfs/dbraw/zinc/75/55/33/565755533.db2.gz QVZZPDZKOSFQOP-MRXNPFEDSA-N 0 0 389.205 3.250 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCCOc1ccccc1 ZINC000176225679 565758121 /nfs/dbraw/zinc/75/81/21/565758121.db2.gz DISLMMLGURTDKN-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN O=C(N[C@H]1CCCC12CCOCC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000281991674 565759048 /nfs/dbraw/zinc/75/90/48/565759048.db2.gz LJDULAACGYGJTK-AWEZNQCLSA-N 0 0 383.242 3.436 20 5 GGBDRN CCS[C@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000176303038 565763051 /nfs/dbraw/zinc/76/30/51/565763051.db2.gz VPJYTVQQHIPYOP-PWSUYJOCSA-N 0 0 385.873 3.367 20 5 GGBDRN CCS[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000176302991 565763598 /nfs/dbraw/zinc/76/35/98/565763598.db2.gz VPJYTVQQHIPYOP-CMPLNLGQSA-N 0 0 385.873 3.367 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1ccc(Br)cc1 ZINC000193584490 565763923 /nfs/dbraw/zinc/76/39/23/565763923.db2.gz KBZUKKWWOWRVNW-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN CO[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 ZINC000176318711 565764431 /nfs/dbraw/zinc/76/44/31/565764431.db2.gz FIFCAWFCPRFLMK-MRXNPFEDSA-N 0 0 393.237 3.404 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NCc1ccoc1 ZINC000193630043 565766755 /nfs/dbraw/zinc/76/67/55/565766755.db2.gz IRWZBLRABXIXHG-UHFFFAOYSA-N 0 0 386.145 3.031 20 5 GGBDRN O=C(N[C@H]1CCCC12CCOCC2)c1sc(Br)cc1[N+](=O)[O-] ZINC000282156352 565766624 /nfs/dbraw/zinc/76/66/24/565766624.db2.gz XIOQRSWXXPAYBF-JTQLQIEISA-N 0 0 389.271 3.498 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[C@@H]1C ZINC000193735078 565772850 /nfs/dbraw/zinc/77/28/50/565772850.db2.gz ZNERGBAKRZWFBF-SCZZXKLOSA-N 0 0 388.205 3.378 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[C@H]1C ZINC000193735094 565773089 /nfs/dbraw/zinc/77/30/89/565773089.db2.gz ZNERGBAKRZWFBF-WCBMZHEXSA-N 0 0 388.205 3.378 20 5 GGBDRN COc1cccc(C(=O)Nc2ccccc2I)c1[N+](=O)[O-] ZINC000193761951 565773251 /nfs/dbraw/zinc/77/32/51/565773251.db2.gz GTHVQPCPTJKHOD-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412183798 565773717 /nfs/dbraw/zinc/77/37/17/565773717.db2.gz MXBCEIADMMGOTQ-JKSUJKDBSA-N 0 0 392.253 3.458 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N(Cc1csc(Br)c1)C1CC1 ZINC000193748423 565773954 /nfs/dbraw/zinc/77/39/54/565773954.db2.gz PYLILBQQBQSOEG-UHFFFAOYSA-N 0 0 398.238 3.324 20 5 GGBDRN CCC(=O)c1ccc(N2CCn3c(Br)cnc3C2)c([N+](=O)[O-])c1 ZINC000282335317 565774345 /nfs/dbraw/zinc/77/43/45/565774345.db2.gz VMGNTFPEVIOOTP-UHFFFAOYSA-N 0 0 379.214 3.167 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000282334018 565774731 /nfs/dbraw/zinc/77/47/31/565774731.db2.gz FZUHLFJYAPAFMR-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCC[C@@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000331672916 565775395 /nfs/dbraw/zinc/77/53/95/565775395.db2.gz UZDAVJRHKLGCGH-GFCCVEGCSA-N 0 0 379.214 3.366 20 5 GGBDRN Cc1cc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])n[nH]2)ccc1Br ZINC000331666359 565776039 /nfs/dbraw/zinc/77/60/39/565776039.db2.gz UJCAUNXOFRBIPA-ZDUSSCGKSA-N 0 0 379.214 3.366 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000193812058 565776989 /nfs/dbraw/zinc/77/69/89/565776989.db2.gz ZAVIKNQQSLYGNF-UHFFFAOYSA-N 0 0 382.203 3.499 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc(I)c2C)ccn1 ZINC000193827557 565777868 /nfs/dbraw/zinc/77/78/68/565777868.db2.gz HTKRMPHFEJROSR-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN O=C(N1CCc2c1cccc2[N+](=O)[O-])C1(c2cncc(Br)c2)CC1 ZINC000282483698 565781963 /nfs/dbraw/zinc/78/19/63/565781963.db2.gz FHYAUJVTFJOBHM-UHFFFAOYSA-N 0 0 388.221 3.373 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000282502777 565782473 /nfs/dbraw/zinc/78/24/73/565782473.db2.gz SBICKENQJMSFHM-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN CS(=O)(=O)c1ccc(-c2nc(-c3cccc(Cl)c3)no2)cc1[N+](=O)[O-] ZINC000193934464 565783767 /nfs/dbraw/zinc/78/37/67/565783767.db2.gz GYZQRLBAJAZLOF-UHFFFAOYSA-N 0 0 379.781 3.369 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000331780816 565783935 /nfs/dbraw/zinc/78/39/35/565783935.db2.gz GBMSHXVGGHOEPS-KCPJHIHWSA-N 0 0 383.242 3.353 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000193940128 565784903 /nfs/dbraw/zinc/78/49/03/565784903.db2.gz QUDLPWKJGIRAEO-JTQLQIEISA-N 0 0 392.209 3.173 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1C1CCOCC1 ZINC000331811678 565785630 /nfs/dbraw/zinc/78/56/30/565785630.db2.gz BHGCOIWPLHZOOM-INIZCTEOSA-N 0 0 397.269 3.317 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000331843276 565787688 /nfs/dbraw/zinc/78/76/88/565787688.db2.gz CUEGLPMFNJKFLZ-HNNXBMFYSA-N 0 0 381.841 3.477 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(Cc2ccncc2)C2CC2)cc1[N+](=O)[O-] ZINC000176658506 565791121 /nfs/dbraw/zinc/79/11/21/565791121.db2.gz JHOSKRJAJYMQJW-UHFFFAOYSA-N 0 0 381.841 3.305 20 5 GGBDRN COc1cccc(C(=O)NCc2cc(F)ccc2Br)c1[N+](=O)[O-] ZINC000194095378 565794672 /nfs/dbraw/zinc/79/46/72/565794672.db2.gz KTWGMVUSMJNZOH-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000331952316 565795262 /nfs/dbraw/zinc/79/52/62/565795262.db2.gz PJNKMDAFSXOHLG-OAHLLOKOSA-N 0 0 388.873 3.136 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000331948191 565795315 /nfs/dbraw/zinc/79/53/15/565795315.db2.gz GDBNJKYZGUGVPT-FVQBIDKESA-N 0 0 397.269 3.052 20 5 GGBDRN CCC[C@]1(COC)CCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000194125236 565795721 /nfs/dbraw/zinc/79/57/21/565795721.db2.gz ILQXXNHXIMQAPJ-OAHLLOKOSA-N 0 0 376.862 3.218 20 5 GGBDRN CCC[C@@]1(COC)CCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000194128704 565795765 /nfs/dbraw/zinc/79/57/65/565795765.db2.gz LXOGLECHAMYTEM-HNNXBMFYSA-N 0 0 376.862 3.218 20 5 GGBDRN CCC[C@@]1(COC)CCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000194125255 565795838 /nfs/dbraw/zinc/79/58/38/565795838.db2.gz ILQXXNHXIMQAPJ-HNNXBMFYSA-N 0 0 376.862 3.218 20 5 GGBDRN CCC1(C)CN(C(=O)c2cc([N+](=O)[O-])cc(I)c2C)C1 ZINC000331965035 565796426 /nfs/dbraw/zinc/79/64/26/565796426.db2.gz KQJGJKGFZGHQPS-UHFFFAOYSA-N 0 0 388.205 3.380 20 5 GGBDRN Cn1cc(Br)cc1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000176705399 565796695 /nfs/dbraw/zinc/79/66/95/565796695.db2.gz MSWBSFHMXAUGET-UHFFFAOYSA-N 0 0 375.182 3.496 20 5 GGBDRN CC(C)n1cc(Br)cc1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000332002302 565798639 /nfs/dbraw/zinc/79/86/39/565798639.db2.gz QBJVBALYXGXEQN-UHFFFAOYSA-N 0 0 393.241 3.333 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cc(F)c(F)cc2Cl)cc1[N+](=O)[O-] ZINC000176725409 565798646 /nfs/dbraw/zinc/79/86/46/565798646.db2.gz KWINGMKDFQESDZ-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CC(=O)N(C2CCCC2)C1 ZINC000332011920 565799935 /nfs/dbraw/zinc/79/99/35/565799935.db2.gz ZQNRVGZOXUGHIG-JTQLQIEISA-N 0 0 396.241 3.087 20 5 GGBDRN Cn1cc([N+](=O)[O-])c(C(=O)N2CCC(C)(C)c3ccc(Br)cc32)n1 ZINC000332037246 565801734 /nfs/dbraw/zinc/80/17/34/565801734.db2.gz JXXQKKFSKSSJJI-UHFFFAOYSA-N 0 0 393.241 3.419 20 5 GGBDRN O=C(Cc1csc(N2CCCC2=O)n1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000282894650 565801935 /nfs/dbraw/zinc/80/19/35/565801935.db2.gz DPDIQXKMNJTXQR-UHFFFAOYSA-N 0 0 380.813 3.013 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCCOc1cccc(Br)c1 ZINC000194220538 565802294 /nfs/dbraw/zinc/80/22/94/565802294.db2.gz BXOXKPXZCPJBRF-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCc3c(F)cc(Br)cc32)n1 ZINC000332066977 565802618 /nfs/dbraw/zinc/80/26/18/565802618.db2.gz SSIJDEYBVFSXHY-UHFFFAOYSA-N 0 0 397.204 3.306 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCS[C@H]2CCCC[C@@H]21 ZINC000176781071 565802516 /nfs/dbraw/zinc/80/25/16/565802516.db2.gz NIFLZRFYTIKSNQ-AAEUAGOBSA-N 0 0 376.887 3.297 20 5 GGBDRN C[C@@H](N(C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])C1(C)CC1 ZINC000176783810 565802587 /nfs/dbraw/zinc/80/25/87/565802587.db2.gz SGUWLJAEGWSXFY-SECBINFHSA-N 0 0 377.260 3.166 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCS[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000176781010 565802981 /nfs/dbraw/zinc/80/29/81/565802981.db2.gz ICZBONHCVJGAAO-QWHCGFSZSA-N 0 0 376.887 3.297 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCS[C@@H]2CCCC[C@@H]21 ZINC000176780515 565803087 /nfs/dbraw/zinc/80/30/87/565803087.db2.gz HUUCQZZHEGIHHK-WCQYABFASA-N 0 0 376.887 3.297 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCS[C@@H]2CCCC[C@@H]21 ZINC000176781086 565803256 /nfs/dbraw/zinc/80/32/56/565803256.db2.gz NIFLZRFYTIKSNQ-WCQYABFASA-N 0 0 376.887 3.297 20 5 GGBDRN Cc1ccc(Br)c(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c1 ZINC000412646943 565803655 /nfs/dbraw/zinc/80/36/55/565803655.db2.gz WGTRHRHHIIINKZ-UHFFFAOYSA-N 0 0 381.230 3.442 20 5 GGBDRN O=C(NC[C@@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1Br ZINC000176798954 565803710 /nfs/dbraw/zinc/80/37/10/565803710.db2.gz DKDIGPXOJQIEFJ-CYBMUJFWSA-N 0 0 393.237 3.253 20 5 GGBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3cncc(Br)c3)CC2)c1 ZINC000194277452 565805886 /nfs/dbraw/zinc/80/58/86/565805886.db2.gz RLODSWUNEBTPGT-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NC1CC(F)(F)C1 ZINC000283005733 565806068 /nfs/dbraw/zinc/80/60/68/565806068.db2.gz XQDBUIMYEVLULU-UHFFFAOYSA-N 0 0 396.131 3.035 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(Br)c[nH]c2=O)cc1[N+](=O)[O-] ZINC000194288527 565806207 /nfs/dbraw/zinc/80/62/07/565806207.db2.gz OBWFMLUAYKWGQB-UHFFFAOYSA-N 0 0 384.211 3.020 20 5 GGBDRN CSc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000176821041 565806635 /nfs/dbraw/zinc/80/66/35/565806635.db2.gz VCUWIRXUQIEMBI-UHFFFAOYSA-N 0 0 379.825 3.225 20 5 GGBDRN COCC1CCC(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000412689565 565806876 /nfs/dbraw/zinc/80/68/76/565806876.db2.gz BQUHYSGNZAAXES-UHFFFAOYSA-N 0 0 385.258 3.221 20 5 GGBDRN C[C@H](N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)C1(C)CC1 ZINC000332139442 565809764 /nfs/dbraw/zinc/80/97/64/565809764.db2.gz LRUSDKJEVWZXAZ-VIFPVBQESA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@@H](N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)C1(C)CC1 ZINC000332139440 565809876 /nfs/dbraw/zinc/80/98/76/565809876.db2.gz LRUSDKJEVWZXAZ-SECBINFHSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C(CCN1CCSC[C@@H]1c1nccs1)Nc1ccccc1[N+](=O)[O-] ZINC000283228728 565812553 /nfs/dbraw/zinc/81/25/53/565812553.db2.gz IMRRUSVFVXFKEI-CQSZACIVSA-N 0 0 378.479 3.170 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N(C)CC(C)(C)O)cc2[N+](=O)[O-])n1 ZINC000176898793 565813258 /nfs/dbraw/zinc/81/32/58/565813258.db2.gz CWLFTMSDFJACIW-UHFFFAOYSA-N 0 0 381.479 3.354 20 5 GGBDRN CO[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000176954609 565818659 /nfs/dbraw/zinc/81/86/59/565818659.db2.gz RTNZTNBOFNIFSY-OAHLLOKOSA-N 0 0 379.210 3.475 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCCOc1ccc(Br)cc1 ZINC000194497074 565818903 /nfs/dbraw/zinc/81/89/03/565818903.db2.gz WZONBBZRVZNNJK-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1ccc(Br)c(F)c1 ZINC000194519623 565820051 /nfs/dbraw/zinc/82/00/51/565820051.db2.gz RAOOUBVDSWFWRV-UHFFFAOYSA-N 0 0 382.189 3.225 20 5 GGBDRN CSC1(CNC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000194526843 565820266 /nfs/dbraw/zinc/82/02/66/565820266.db2.gz KVHKUNLNZJALQU-UHFFFAOYSA-N 0 0 377.388 3.427 20 5 GGBDRN COCC[C@H]1CCCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000332245367 565821034 /nfs/dbraw/zinc/82/10/34/565821034.db2.gz KJCPFFRKXRGVTP-GFCCVEGCSA-N 0 0 376.862 3.076 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1cccc2cccnc21 ZINC000194546919 565821961 /nfs/dbraw/zinc/82/19/61/565821961.db2.gz UYXFGRHYIJPTCV-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN CC(C)CCO[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000177011395 565822991 /nfs/dbraw/zinc/82/29/91/565822991.db2.gz OCGOAUURDVKFRO-CYBMUJFWSA-N 0 0 376.862 3.074 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)Cc1noc(C2CC2)n1 ZINC000412949399 565823656 /nfs/dbraw/zinc/82/36/56/565823656.db2.gz DRVJHJGZHMUFRY-UHFFFAOYSA-N 0 0 395.213 3.198 20 5 GGBDRN O=C(Nc1cc(Br)ccc1-n1cncn1)c1ccc([N+](=O)[O-])s1 ZINC000194582284 565824313 /nfs/dbraw/zinc/82/43/13/565824313.db2.gz CYWQPTJGNBXBLL-UHFFFAOYSA-N 0 0 394.210 3.252 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000332285917 565825670 /nfs/dbraw/zinc/82/56/70/565825670.db2.gz XHOPJGNCAKLZOW-PHIMTYICSA-N 0 0 378.372 3.424 20 5 GGBDRN Cc1csc([C@@H]2CCCN(S(=O)(=O)c3ccc(C)cc3[N+](=O)[O-])C2)n1 ZINC000332384150 565832989 /nfs/dbraw/zinc/83/29/89/565832989.db2.gz ZICOKPCLUGGJBG-CYBMUJFWSA-N 0 0 381.479 3.236 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CCCCCO1 ZINC000332369711 565833276 /nfs/dbraw/zinc/83/32/76/565833276.db2.gz WMIMTLXNDUWKTL-UHFFFAOYSA-N 0 0 390.177 3.066 20 5 GGBDRN Cc1nc(C(C)(C)NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)no1 ZINC000283869231 565833797 /nfs/dbraw/zinc/83/37/97/565833797.db2.gz IUDHZXDVLPTVAI-UHFFFAOYSA-N 0 0 383.202 3.022 20 5 GGBDRN CC(=O)NC(C)(C)c1noc(-c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000283909124 565834757 /nfs/dbraw/zinc/83/47/57/565834757.db2.gz MIZAYBPGKXOOBC-UHFFFAOYSA-N 0 0 383.202 3.087 20 5 GGBDRN CC(C)(C)c1cnc([S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000283902739 565834780 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COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000284171738 565845588 /nfs/dbraw/zinc/84/55/88/565845588.db2.gz WZNWCUBFWGFBRZ-DZGCQCFKSA-N 0 0 388.251 3.329 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(SCCCSC)c([N+](=O)[O-])c1 ZINC000413321709 565846075 /nfs/dbraw/zinc/84/60/75/565846075.db2.gz AZPMHZVEZPLYQQ-UHFFFAOYSA-N 0 0 378.541 3.471 20 5 GGBDRN COc1ccc(CNC(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000284213720 565846469 /nfs/dbraw/zinc/84/64/69/565846469.db2.gz ZPQCYZRPIGXZSB-DZGCQCFKSA-N 0 0 388.251 3.329 20 5 GGBDRN CSCCCSc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000413339287 565847247 /nfs/dbraw/zinc/84/72/47/565847247.db2.gz UVJSYOCOBUYRNN-UHFFFAOYSA-N 0 0 376.525 3.225 20 5 GGBDRN CC(C)(C)OC(=O)[C@]1(C)CCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000413354231 565848194 /nfs/dbraw/zinc/84/81/94/565848194.db2.gz GRZWCHPMMCFKQH-OAHLLOKOSA-N 0 0 386.246 3.310 20 5 GGBDRN COC(=O)c1cccc2c1CCN(c1ncc(Br)cc1[N+](=O)[O-])C2 ZINC000413353998 565848297 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Cc1c(Br)c(N2C[C@H](O)C[C@H]2c2ccccc2)ncc1[N+](=O)[O-] ZINC000413501962 565856140 /nfs/dbraw/zinc/85/61/40/565856140.db2.gz MLADXWQFJCZEKM-OLZOCXBDSA-N 0 0 378.226 3.373 20 5 GGBDRN C[C@H](NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1csnn1 ZINC000413508320 565857108 /nfs/dbraw/zinc/85/71/08/565857108.db2.gz XJGLOKPFKLPXAI-ZETCQYMHSA-N 0 0 375.332 3.026 20 5 GGBDRN CC[C@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413525578 565858034 /nfs/dbraw/zinc/85/80/34/565858034.db2.gz ZRDINESHAZILEK-JTQLQIEISA-N 0 0 383.392 3.236 20 5 GGBDRN O=C(CN1C[C@@H]2CCCC[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000177537808 565858493 /nfs/dbraw/zinc/85/84/93/565858493.db2.gz AGDAQDXWVSTCBK-RYUDHWBXSA-N 0 0 382.258 3.418 20 5 GGBDRN COCc1ncsc1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000284557010 565858721 /nfs/dbraw/zinc/85/87/21/565858721.db2.gz DUMZFZXURQHQAK-UHFFFAOYSA-N 0 0 375.328 3.147 20 5 GGBDRN CN1C(=O)CCc2cc(Nc3ncc([N+](=O)[O-])cc3Br)ccc21 ZINC000177545348 565858792 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C[C@@H]1CC[C@H](NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000556552317 566312706 /nfs/dbraw/zinc/31/27/06/566312706.db2.gz DHOZGIPSKMOZPL-FOGDFJRCSA-N 0 0 398.257 3.237 20 5 GGBDRN C[C@@H]1CC[C@@H](NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000556552318 566312948 /nfs/dbraw/zinc/31/29/48/566312948.db2.gz DHOZGIPSKMOZPL-JFGNBEQYSA-N 0 0 398.257 3.237 20 5 GGBDRN O=C(Cc1noc(-c2ccc([N+](=O)[O-])s2)n1)NCc1cccc(Cl)c1 ZINC000445828370 566313555 /nfs/dbraw/zinc/31/35/55/566313555.db2.gz VLBLFKKEELUYBO-UHFFFAOYSA-N 0 0 378.797 3.219 20 5 GGBDRN Cc1cnc(CCNC(=O)c2c(Br)cccc2[N+](=O)[O-])c(C)c1 ZINC000600086978 566313802 /nfs/dbraw/zinc/31/38/02/566313802.db2.gz OLVHNFGAGVTILI-UHFFFAOYSA-N 0 0 378.226 3.342 20 5 GGBDRN C[C@@H](CNC(=O)c1c(Br)cccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000600086191 566313911 /nfs/dbraw/zinc/31/39/11/566313911.db2.gz LAVLFTCMUIBBIQ-VIFPVBQESA-N 0 0 387.230 3.065 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[C@H]1C ZINC000509526614 566314250 /nfs/dbraw/zinc/31/42/50/566314250.db2.gz LIWAJCPCDZCWGS-OQPBUACISA-N 0 0 388.205 3.426 20 5 GGBDRN Cc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ncc1Br ZINC000600116135 566315508 /nfs/dbraw/zinc/31/55/08/566315508.db2.gz LASKDIRAKLOYDO-LBPRGKRZSA-N 0 0 392.257 3.142 20 5 GGBDRN CC(C)[C@@H]1N(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1(C)C ZINC000556601607 566316810 /nfs/dbraw/zinc/31/68/10/566316810.db2.gz PZKQIQGZQSVZJG-ZDUSSCGKSA-N 0 0 398.257 3.189 20 5 GGBDRN Cn1cc([C@H]2N(C(=O)c3c(Br)cccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000600124446 566317459 /nfs/dbraw/zinc/31/74/59/566317459.db2.gz LZXPLNPBXBPCFL-CQSZACIVSA-N 0 0 393.241 3.314 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCC[C@H](CC(F)(F)F)C2)cc1 ZINC000420763598 566317928 /nfs/dbraw/zinc/31/79/28/566317928.db2.gz TXAQKROXGYGOLX-CYBMUJFWSA-N 0 0 380.388 3.132 20 5 GGBDRN Cc1cc(Br)c(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)s1 ZINC000462532118 566318743 /nfs/dbraw/zinc/31/87/43/566318743.db2.gz XKXWAYNVDRVKQR-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN O=C(Nc1cc(Br)c[nH]c1=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535678295 566318903 /nfs/dbraw/zinc/31/89/03/566318903.db2.gz XRTRXYIBANOMBW-UHFFFAOYSA-N 0 0 377.154 3.192 20 5 GGBDRN CCN(CC(F)(F)F)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462534094 566319071 /nfs/dbraw/zinc/31/90/71/566319071.db2.gz YFMCMGPJDGILBR-UHFFFAOYSA-N 0 0 381.159 3.475 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])cc1Br ZINC000462541085 566320404 /nfs/dbraw/zinc/32/04/04/566320404.db2.gz YHEKDIWOSPDQEW-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN C[C@H](Cc1ccncc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000445945083 566320429 /nfs/dbraw/zinc/32/04/29/566320429.db2.gz VQYWLSMSBBPWRL-LLVKDONJSA-N 0 0 378.226 3.042 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC(C)(C)O1 ZINC000462555096 566321844 /nfs/dbraw/zinc/32/18/44/566321844.db2.gz RMZWJQSHNGIWRW-MRVPVSSYSA-N 0 0 383.253 3.090 20 5 GGBDRN Cc1ncccc1NC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000535736143 566322341 /nfs/dbraw/zinc/32/23/41/566322341.db2.gz MPFMTIORFGGBIW-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C(C)(C)C1 ZINC000535735996 566322939 /nfs/dbraw/zinc/32/29/39/566322939.db2.gz VWPDYMCHWVDXHV-SECBINFHSA-N 0 0 388.205 3.460 20 5 GGBDRN O=C([N-]c1c[nH+]ccc1-n1cccn1)c1sc(Br)cc1[N+](=O)[O-] ZINC000446034451 566324176 /nfs/dbraw/zinc/32/41/76/566324176.db2.gz YKLBQRUTULWCMP-UHFFFAOYSA-N 0 0 394.210 3.252 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c2cc(Cl)ccc2O1 ZINC000462574498 566325039 /nfs/dbraw/zinc/32/50/39/566325039.db2.gz CCZRXAYVOBWCNF-SECBINFHSA-N 0 0 386.788 3.364 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H](Sc2ccc(Br)cc2)C1 ZINC000600214628 566325315 /nfs/dbraw/zinc/32/53/15/566325315.db2.gz CRNHYVZCJQRSOA-LLVKDONJSA-N 0 0 397.254 3.087 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000509656892 566326511 /nfs/dbraw/zinc/32/65/11/566326511.db2.gz WDDOTPNRUBSDKE-ZDUSSCGKSA-N 0 0 391.221 3.399 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H](C)Oc1ccc(Cl)cc1 ZINC000462576096 566327315 /nfs/dbraw/zinc/32/73/15/566327315.db2.gz OXILVMOZCZREHV-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN CCCCN1CCCC[C@@H]1CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000535798594 566327620 /nfs/dbraw/zinc/32/76/20/566327620.db2.gz QIBTWQUVKLBGQE-GFCCVEGCSA-N 0 0 375.516 3.126 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2CCCc3c2cnn3C)cc1[N+](=O)[O-] ZINC000509679224 566328541 /nfs/dbraw/zinc/32/85/41/566328541.db2.gz HJRQBFPDYXISMV-ZDUSSCGKSA-N 0 0 393.241 3.207 20 5 GGBDRN CN1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cc(F)ccc21 ZINC000462594566 566329672 /nfs/dbraw/zinc/32/96/72/566329672.db2.gz PZEJZLGYFSQCMG-UHFFFAOYSA-N 0 0 385.804 3.032 20 5 GGBDRN CO[C@@]1(C)C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1(C)C ZINC000446106884 566331130 /nfs/dbraw/zinc/33/11/30/566331130.db2.gz DVINQDSTJANJHJ-CJNGLKHVSA-N 0 0 385.258 3.220 20 5 GGBDRN CN(Cc1ccc(F)cc1Br)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000482773532 566331873 /nfs/dbraw/zinc/33/18/73/566331873.db2.gz PKZFXACZCUIJGJ-UHFFFAOYSA-N 0 0 399.220 3.087 20 5 GGBDRN COc1ccc(S(=O)(=O)NC[C@H](C)Sc2ccccc2)c([N+](=O)[O-])c1 ZINC000462600436 566332266 /nfs/dbraw/zinc/33/22/66/566332266.db2.gz FSFMQFOOZYMZTL-LBPRGKRZSA-N 0 0 382.463 3.063 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN1CCC[C@H]1Cc1ccccc1Br ZINC000420973539 566333604 /nfs/dbraw/zinc/33/36/04/566333604.db2.gz NMHUPMAQBXHLMY-ZDUSSCGKSA-N 0 0 379.258 3.298 20 5 GGBDRN CCCc1n[nH]c(C(=O)N(C)Cc2ccc(F)cc2Br)c1[N+](=O)[O-] ZINC000482798224 566334509 /nfs/dbraw/zinc/33/45/09/566334509.db2.gz QXHCACAHVRWRIQ-UHFFFAOYSA-N 0 0 399.220 3.444 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCc3cc(Br)ccc32)c([N+](=O)[O-])c1 ZINC000509779503 566336521 /nfs/dbraw/zinc/33/65/21/566336521.db2.gz UVFMXADYRJICFN-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N(CC(F)(F)F)[C@H]1CCCOC1 ZINC000446218401 566336889 /nfs/dbraw/zinc/33/68/89/566336889.db2.gz CWCDSDUONAJSCM-LBPRGKRZSA-N 0 0 380.750 3.361 20 5 GGBDRN CCO[C@H]1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C12CCCC2 ZINC000462656860 566336996 /nfs/dbraw/zinc/33/69/96/566336996.db2.gz LVNOOUVGOSGWBG-GJZGRUSLSA-N 0 0 388.873 3.264 20 5 GGBDRN CCO[C@@H]1C[C@@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C12CCCC2 ZINC000462662822 566338046 /nfs/dbraw/zinc/33/80/46/566338046.db2.gz YLTICDWUWJEULJ-ZIAGYGMSSA-N 0 0 388.873 3.264 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000462668175 566338365 /nfs/dbraw/zinc/33/83/65/566338365.db2.gz KNWASBXSBNPETM-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN CN1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccc(F)cc21 ZINC000462670388 566338572 /nfs/dbraw/zinc/33/85/72/566338572.db2.gz YNFITVQEPISLSU-UHFFFAOYSA-N 0 0 385.804 3.032 20 5 GGBDRN CC(C)[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCS1 ZINC000446268702 566339791 /nfs/dbraw/zinc/33/97/91/566339791.db2.gz GDSNLSZPAXTJTB-CQSZACIVSA-N 0 0 387.299 3.500 20 5 GGBDRN CCO[C@H]1C[C@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C12CCCC2 ZINC000462673392 566339825 /nfs/dbraw/zinc/33/98/25/566339825.db2.gz FQSJCHOBIUPUEM-GJZGRUSLSA-N 0 0 388.873 3.264 20 5 GGBDRN COC(=O)c1csc(Sc2ncc([N+](=O)[O-])cc2Br)n1 ZINC000576364129 566340569 /nfs/dbraw/zinc/34/05/69/566340569.db2.gz JOOUBDRLYGBKDU-UHFFFAOYSA-N 0 0 376.213 3.147 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1C)c1cccc(Cl)c1 ZINC000462679029 566340630 /nfs/dbraw/zinc/34/06/30/566340630.db2.gz MWVNKVRPXOKSJQ-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN CC[S@](=O)c1ccccc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482909286 566342924 /nfs/dbraw/zinc/34/29/24/566342924.db2.gz GMYWANQFWHNKKW-VWLOTQADSA-N 0 0 380.853 3.348 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])Oc1ccccc1F ZINC000462702583 566343307 /nfs/dbraw/zinc/34/33/07/566343307.db2.gz LYZOFKISFHJSJD-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN O=C(NC[C@@H](CO)C1CCCCC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000509865136 566343771 /nfs/dbraw/zinc/34/37/71/566343771.db2.gz RJUYMJOHROWQJG-ZDUSSCGKSA-N 0 0 385.258 3.276 20 5 GGBDRN O=C(NC[C@H](CO)C1CCCCC1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000509867601 566343954 /nfs/dbraw/zinc/34/39/54/566343954.db2.gz ZNIRUHLLKNLWMF-GFCCVEGCSA-N 0 0 385.258 3.276 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H](C)Oc1ccccc1Cl ZINC000462707536 566344534 /nfs/dbraw/zinc/34/45/34/566344534.db2.gz FOMCZBCPJUXBAH-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1ccc(O[C@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000462705335 566344595 /nfs/dbraw/zinc/34/45/95/566344595.db2.gz AAOFZUQWGBLIBN-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@@H](C)Oc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000462705517 566344708 /nfs/dbraw/zinc/34/47/08/566344708.db2.gz OHUDXBVKVWTNGF-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)Oc1cccc(F)c1 ZINC000462703591 566344826 /nfs/dbraw/zinc/34/48/26/566344826.db2.gz LKCLSDZRUKYUBT-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN CC1CCC(N(C[C@H]2CCCO2)S(=O)(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000462705039 566344957 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O=[N+]([O-])c1ccccc1CCNS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000462714515 566346721 /nfs/dbraw/zinc/34/67/21/566346721.db2.gz NOXZIHIEWRLBNJ-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Br)cn1 ZINC000482976394 566347237 /nfs/dbraw/zinc/34/72/37/566347237.db2.gz HRHBCCAFJUVNAL-VIFPVBQESA-N 0 0 376.214 3.479 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](C)c1ccc(Br)cn1 ZINC000482976652 566347989 /nfs/dbraw/zinc/34/79/89/566347989.db2.gz XLFIKVCSEJCJKC-NSHDSACASA-N 0 0 393.241 3.350 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@@H](C)Oc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000462721687 566348135 /nfs/dbraw/zinc/34/81/35/566348135.db2.gz UOOSRWRONFFIRF-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1ccncc1CN(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000482984266 566348626 /nfs/dbraw/zinc/34/86/26/566348626.db2.gz WQLABBORBFMNIK-UHFFFAOYSA-N 0 0 393.241 3.131 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N(CCO)Cc1ccc(Br)s1 ZINC000482993970 566350490 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C[S@@](=O)c1cccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000485500051 566504638 /nfs/dbraw/zinc/50/46/38/566504638.db2.gz YDOFYAGDDXFBNK-OAQYLSRUSA-N 0 0 389.252 3.409 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCCN2c3ccccc3C[C@@H]2C1 ZINC000578243258 566504907 /nfs/dbraw/zinc/50/49/07/566504907.db2.gz KYPQUIBYLNDCPV-CYBMUJFWSA-N 0 0 389.253 3.394 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCCN2c3ccccc3C[C@H]2C1 ZINC000578243259 566505085 /nfs/dbraw/zinc/50/50/85/566505085.db2.gz KYPQUIBYLNDCPV-ZDUSSCGKSA-N 0 0 389.253 3.394 20 5 GGBDRN C[S@](=O)c1cccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000485500050 566505558 /nfs/dbraw/zinc/50/55/58/566505558.db2.gz YDOFYAGDDXFBNK-NRFANRHFSA-N 0 0 389.252 3.409 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2ccsc2Br)cc([N+](=O)[O-])c1 ZINC000512010665 566505483 /nfs/dbraw/zinc/50/54/83/566505483.db2.gz RVJPOBXIFUIPPD-UHFFFAOYSA-N 0 0 399.222 3.135 20 5 GGBDRN COCCCn1cnnc1SCc1ccc(Br)cc1[N+](=O)[O-] ZINC000424079980 566509322 /nfs/dbraw/zinc/50/93/22/566509322.db2.gz 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566514493 /nfs/dbraw/zinc/51/44/93/566514493.db2.gz RCNKTUSZMOAWBV-UHFFFAOYSA-N 0 0 384.177 3.218 20 5 GGBDRN O=c1[nH]ccc(Cc2nc(Cc3ccccc3[N+](=O)[O-])no2)c1Br ZINC000578365602 566516086 /nfs/dbraw/zinc/51/60/86/566516086.db2.gz RZMMCQTUIDKTNB-UHFFFAOYSA-N 0 0 391.181 3.023 20 5 GGBDRN C[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@H](C)[N@H+]1C ZINC000558962876 566516185 /nfs/dbraw/zinc/51/61/85/566516185.db2.gz DHTMQOCWUUEPEV-PHIMTYICSA-N 0 0 379.258 3.434 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1ccsc1Br ZINC000512149485 566516387 /nfs/dbraw/zinc/51/63/87/566516387.db2.gz QKSQPBNBVHRNQW-UHFFFAOYSA-N 0 0 384.255 3.461 20 5 GGBDRN CC[C@H](NC(=O)c1c([N+](=O)[O-])c(C)nn1C)c1cc(F)cc(Br)c1 ZINC000485675778 566516371 /nfs/dbraw/zinc/51/63/71/566516371.db2.gz ZGWKAPALNOJDQZ-LBPRGKRZSA-N 0 0 399.220 3.419 20 5 GGBDRN Cc1c(Br)c(N[C@@H](CC(N)=O)c2ccccc2)ncc1[N+](=O)[O-] ZINC000558967112 566516559 /nfs/dbraw/zinc/51/65/59/566516559.db2.gz VYKPGMGGDSGEKI-NSHDSACASA-N 0 0 379.214 3.089 20 5 GGBDRN CC[C@@H](NC(=O)c1c([N+](=O)[O-])c(C)nn1C)c1cc(F)cc(Br)c1 ZINC000485675776 566516914 /nfs/dbraw/zinc/51/69/14/566516914.db2.gz ZGWKAPALNOJDQZ-GFCCVEGCSA-N 0 0 399.220 3.419 20 5 GGBDRN CC(C)CCCSc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000538510988 566517175 /nfs/dbraw/zinc/51/71/75/566517175.db2.gz YPLZYLQTIQDBQY-UHFFFAOYSA-N 0 0 388.511 3.144 20 5 GGBDRN CC[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)c1cc(F)cc(Br)c1 ZINC000485664817 566517151 /nfs/dbraw/zinc/51/71/51/566517151.db2.gz DATGCBQLOUGAGB-CQSZACIVSA-N 0 0 399.220 3.351 20 5 GGBDRN CC1(C)CN(C(=O)c2sc(Br)cc2[N+](=O)[O-])CC(C)(C)O1 ZINC000485686249 566518343 /nfs/dbraw/zinc/51/83/43/566518343.db2.gz SGNQSURATUCHAI-UHFFFAOYSA-N 0 0 377.260 3.448 20 5 GGBDRN Cn1ncc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1C(F)(F)F ZINC000485685755 566518350 /nfs/dbraw/zinc/51/83/50/566518350.db2.gz VMJJMFGQVBYQFE-UHFFFAOYSA-N 0 0 399.148 3.423 20 5 GGBDRN CN(Cc1csc(Br)c1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000512170628 566518580 /nfs/dbraw/zinc/51/85/80/566518580.db2.gz SPRAIWZFKZVCSW-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN CO[C@H](CNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C)C ZINC000465198929 566522755 /nfs/dbraw/zinc/52/27/55/566522755.db2.gz VPRZFBUJDHISNY-GFCCVEGCSA-N 0 0 380.388 3.493 20 5 GGBDRN O=C(Cc1ccc(F)cc1Br)NCCNc1ccccc1[N+](=O)[O-] ZINC000485742710 566523481 /nfs/dbraw/zinc/52/34/81/566523481.db2.gz JCQZJXMUCUZEEA-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCc3c(Br)cccc3[C@H]2C)c1[N+](=O)[O-] ZINC000512313799 566525647 /nfs/dbraw/zinc/52/56/47/566525647.db2.gz LLTNJZWDNPIGAW-SNVBAGLBSA-N 0 0 393.241 3.159 20 5 GGBDRN CSc1cccc(C(=O)Nc2ccccc2SCC(N)=O)c1[N+](=O)[O-] ZINC000485772703 566526053 /nfs/dbraw/zinc/52/60/53/566526053.db2.gz UHLDAQHYNMNIPG-UHFFFAOYSA-N 0 0 377.447 3.146 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(NCc2noc(C3CCOCC3)n2)c1 ZINC000578491563 566527090 /nfs/dbraw/zinc/52/70/90/566527090.db2.gz ZARHJKPOMWQYOM-UHFFFAOYSA-N 0 0 383.202 3.246 20 5 GGBDRN O=[N+]([O-])c1ccc(SC2CCCCC2)c(S(=O)(=O)N2CCOCC2)c1 ZINC000603476086 566529238 /nfs/dbraw/zinc/52/92/38/566529238.db2.gz OMTCLZUTBJNEOQ-UHFFFAOYSA-N 0 0 386.495 3.041 20 5 GGBDRN COc1cc(CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2C)ccc1Cl ZINC000559158218 566530995 /nfs/dbraw/zinc/53/09/95/566530995.db2.gz UMTUMNCESRDVOZ-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CCN(Cc1cc(Br)ccc1F)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000603524794 566532211 /nfs/dbraw/zinc/53/22/11/566532211.db2.gz WARTZNUAPZDZRD-UHFFFAOYSA-N 0 0 384.205 3.497 20 5 GGBDRN C[NH+](C)CCN(C1CCCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000465495022 566532881 /nfs/dbraw/zinc/53/28/81/566532881.db2.gz VWVMEMOJHBQCCL-UHFFFAOYSA-N 0 0 389.905 3.133 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000603568538 566533911 /nfs/dbraw/zinc/53/39/11/566533911.db2.gz SHFWMXPUWQYDKH-UHFFFAOYSA-N 0 0 378.475 3.483 20 5 GGBDRN CCS(=O)(=O)c1ccccc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000603571925 566534650 /nfs/dbraw/zinc/53/46/50/566534650.db2.gz FNDZHPRPKKIXOT-UHFFFAOYSA-N 0 0 380.447 3.363 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2ccc(C)cc2SC)cc1[N+](=O)[O-] ZINC000465498243 566534782 /nfs/dbraw/zinc/53/47/82/566534782.db2.gz BAJCMNDYXRZENO-UHFFFAOYSA-N 0 0 382.463 3.112 20 5 GGBDRN COC[C@H](NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)c1cccc(Cl)c1 ZINC000578573659 566535478 /nfs/dbraw/zinc/53/54/78/566535478.db2.gz FGNVMJLGGMLOKB-LBPRGKRZSA-N 0 0 390.870 3.284 20 5 GGBDRN Cc1nn(C)c(NCc2ccc(I)c(C)c2)c1[N+](=O)[O-] ZINC000512454205 566536006 /nfs/dbraw/zinc/53/60/06/566536006.db2.gz PRKOAYWHODJFRO-UHFFFAOYSA-N 0 0 386.193 3.162 20 5 GGBDRN CCc1nn(C)cc1NCc1cc(I)cc([N+](=O)[O-])c1 ZINC000578581928 566536099 /nfs/dbraw/zinc/53/60/99/566536099.db2.gz NGXWLUACTWEIRJ-UHFFFAOYSA-N 0 0 386.193 3.107 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCSCc1ccccc1F ZINC000603630359 566536475 /nfs/dbraw/zinc/53/64/75/566536475.db2.gz FBIRILJKQGWYTM-UHFFFAOYSA-N 0 0 384.454 3.254 20 5 GGBDRN CC(C)[C@H]1N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC12CCOCC2 ZINC000578607961 566537195 /nfs/dbraw/zinc/53/71/95/566537195.db2.gz STSUWBUDIPWWTG-OAHLLOKOSA-N 0 0 388.873 3.074 20 5 GGBDRN CCc1nn(C)c(N(C)Cc2cc(Br)ccc2OC)c1[N+](=O)[O-] ZINC000538788299 566537671 /nfs/dbraw/zinc/53/76/71/566537671.db2.gz UUWWQYKDKOPQKK-UHFFFAOYSA-N 0 0 383.246 3.298 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)Cc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000559281007 566538199 /nfs/dbraw/zinc/53/81/99/566538199.db2.gz LYXFLBOSWDSOLN-MRVPVSSYSA-N 0 0 399.220 3.143 20 5 GGBDRN C[C@@H](Cc1ccc(Br)cc1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000603759799 566538382 /nfs/dbraw/zinc/53/83/82/566538382.db2.gz QFRRUBHDGVDQNE-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C12CCC2 ZINC000485906138 566538553 /nfs/dbraw/zinc/53/85/53/566538553.db2.gz KRWNSLIQWSWJQK-VHSXEESVSA-N 0 0 389.271 3.496 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1sc(Br)cc1[N+](=O)[O-])CCO2 ZINC000485906142 566538406 /nfs/dbraw/zinc/53/84/06/566538406.db2.gz KSDYWHVHWDSMQJ-UHFFFAOYSA-N 0 0 399.222 3.467 20 5 GGBDRN Cn1c(C(=O)Nc2ccccc2-n2cc(Br)cn2)ccc1[N+](=O)[O-] ZINC000603744330 566538797 /nfs/dbraw/zinc/53/87/97/566538797.db2.gz IWQXOBUQTAZQQJ-UHFFFAOYSA-N 0 0 390.197 3.134 20 5 GGBDRN Cc1c(OC[C@@H](O)COc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000559286210 566539247 /nfs/dbraw/zinc/53/92/47/566539247.db2.gz UPNMOOUEPRSNMW-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN O=C(c1cc(Cl)cc(Cl)c1)N1CCN(c2cccnc2[N+](=O)[O-])CC1 ZINC000603845671 566541993 /nfs/dbraw/zinc/54/19/93/566541993.db2.gz GZXNJMXBIKUQEV-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN C[C@@H](Cc1ccc(Br)cc1)Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000603860548 566542351 /nfs/dbraw/zinc/54/23/51/566542351.db2.gz MFEYRQWDZGMMBD-JTQLQIEISA-N 0 0 378.226 3.499 20 5 GGBDRN CNS(=O)(=O)c1ccc(NCc2csc3ccccc23)c([N+](=O)[O-])c1 ZINC000603862331 566542774 /nfs/dbraw/zinc/54/27/74/566542774.db2.gz OKAZBAHUZKJQLW-UHFFFAOYSA-N 0 0 377.447 3.330 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](CO)c2ccc(Br)cc2)cc([N+](=O)[O-])c1 ZINC000538881973 566543245 /nfs/dbraw/zinc/54/32/45/566543245.db2.gz CXDFZZOUFXWJTO-HNNXBMFYSA-N 0 0 379.210 3.129 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1ccsc1Br ZINC000512596316 566544524 /nfs/dbraw/zinc/54/45/24/566544524.db2.gz BXLQXTGBPONNNO-UHFFFAOYSA-N 0 0 399.270 3.330 20 5 GGBDRN Cc1ccc(C(=O)N[C@@H](CO)c2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000538886346 566545228 /nfs/dbraw/zinc/54/52/28/566545228.db2.gz OBWLEQZHNXPJJJ-AWEZNQCLSA-N 0 0 379.210 3.129 20 5 GGBDRN NS(=O)(=O)c1cc(NCCc2ccc(Cl)cc2Cl)cc([N+](=O)[O-])c1 ZINC000603928386 566545549 /nfs/dbraw/zinc/54/55/49/566545549.db2.gz BCNJJAZZKMBNPP-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])NCc1cccc(Br)c1 ZINC000465769733 566545601 /nfs/dbraw/zinc/54/56/01/566545601.db2.gz HXWOMUYKDRFHIV-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN NS(=O)(=O)c1c(NCCc2ccc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000603928394 566546143 /nfs/dbraw/zinc/54/61/43/566546143.db2.gz BLXXGYWHROQHAX-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN COC(=O)c1cc(NS(=O)(=O)c2ccc(Cl)cc2)c(C)c([N+](=O)[O-])c1 ZINC000485996562 566547217 /nfs/dbraw/zinc/54/72/17/566547217.db2.gz RYOUQQURDLZEER-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN Cc1nn(C)c(N[C@@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000486008174 566549009 /nfs/dbraw/zinc/54/90/09/566549009.db2.gz PHOKOIIALVIOEH-GFCCVEGCSA-N 0 0 380.246 3.090 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC1(C)C ZINC000512660231 566549059 /nfs/dbraw/zinc/54/90/59/566549059.db2.gz FDUJCFBTAHZMHH-VIFPVBQESA-N 0 0 388.205 3.284 20 5 GGBDRN CC(C)OCCCN(C)c1ccc(I)cc1[N+](=O)[O-] ZINC000578717293 566549088 /nfs/dbraw/zinc/54/90/88/566549088.db2.gz KCFDZRVJENODGE-UHFFFAOYSA-N 0 0 378.210 3.451 20 5 GGBDRN COc1ccc(CNC(=O)COc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000604018946 566549779 /nfs/dbraw/zinc/54/97/79/566549779.db2.gz XQYOSTGLDURKFY-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1NCc1nnc(C2CC2)o1 ZINC000486024280 566549910 /nfs/dbraw/zinc/54/99/10/566549910.db2.gz BHPKLPVALCMDOF-UHFFFAOYSA-N 0 0 390.197 3.200 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@H](Oc2ncccc2F)C1 ZINC000486024935 566549986 /nfs/dbraw/zinc/54/99/86/566549986.db2.gz AYRKYCURKVBLIQ-NSHDSACASA-N 0 0 397.204 3.334 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCSCc2ccccc2F)c(F)c1 ZINC000604021652 566550484 /nfs/dbraw/zinc/55/04/84/566550484.db2.gz IFARNEJTOKCRCB-UHFFFAOYSA-N 0 0 388.417 3.085 20 5 GGBDRN O=C(NCc1cc(F)ccc1Br)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000604006715 566550986 /nfs/dbraw/zinc/55/09/86/566550986.db2.gz LBIPWIPJVHIFDK-UHFFFAOYSA-N 0 0 397.156 3.155 20 5 GGBDRN C[C@H](Cc1ccc(Br)cc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000604034165 566552061 /nfs/dbraw/zinc/55/20/61/566552061.db2.gz LYDUIYZPHHLQNM-LLVKDONJSA-N 0 0 399.266 3.267 20 5 GGBDRN O=C(c1cscc1Br)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000512714733 566552248 /nfs/dbraw/zinc/55/22/48/566552248.db2.gz XMNSOZYPADNEIW-SECBINFHSA-N 0 0 397.254 3.140 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N(C)C(C)(C)C ZINC000578751976 566552557 /nfs/dbraw/zinc/55/25/57/566552557.db2.gz ZLYKJBLQECPKDS-UHFFFAOYSA-N 0 0 376.194 3.378 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCOc3ccccc3C2)cc1[N+](=O)[O-] ZINC000604041858 566552651 /nfs/dbraw/zinc/55/26/51/566552651.db2.gz IGVMKSFKJJMGJH-UHFFFAOYSA-N 0 0 382.825 3.140 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CC[C@](C)(F)C1 ZINC000512715363 566552861 /nfs/dbraw/zinc/55/28/61/566552861.db2.gz FBAVDXJGLAYSPP-ZDUSSCGKSA-N 0 0 392.168 3.082 20 5 GGBDRN Cc1ccc(C(=O)NCCOc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000604118132 566554267 /nfs/dbraw/zinc/55/42/67/566554267.db2.gz IKUUPJDRQJSFHG-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Br)c2ccccc12 ZINC000539100501 566557620 /nfs/dbraw/zinc/55/76/20/566557620.db2.gz YEEHFVZXISKTII-UHFFFAOYSA-N 0 0 375.182 3.346 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC(C)(C)[C@@H](O)C(C)C ZINC000559577006 566558722 /nfs/dbraw/zinc/55/87/22/566558722.db2.gz YXDMSRNDBDIFBB-AWEZNQCLSA-N 0 0 387.274 3.439 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(Cc3cccs3)CC2)c1[N+](=O)[O-] ZINC000486113136 566559502 /nfs/dbraw/zinc/55/95/02/566559502.db2.gz BIHUERXJIGDXRS-UHFFFAOYSA-N 0 0 377.491 3.336 20 5 GGBDRN COc1ccc(C(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1Cl ZINC000466271612 566561292 /nfs/dbraw/zinc/56/12/92/566561292.db2.gz OCHRBOFZLNSIIK-UHFFFAOYSA-N 0 0 383.187 3.409 20 5 GGBDRN CC[C@H](CSC)N(C)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000539116045 566561523 /nfs/dbraw/zinc/56/15/23/566561523.db2.gz XASZLZCZTBHMAX-SNVBAGLBSA-N 0 0 397.316 3.119 20 5 GGBDRN CCOc1c(Cl)cc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)cc1Cl ZINC000466283513 566562004 /nfs/dbraw/zinc/56/20/04/566562004.db2.gz QNHMACCKNFUZBG-UHFFFAOYSA-N 0 0 386.191 3.101 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCC(=O)Nc1cccc(Br)c1 ZINC000486142304 566562153 /nfs/dbraw/zinc/56/21/53/566562153.db2.gz FZHLAUHPRZGFLB-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN Cc1ccccc1[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000559619260 566562396 /nfs/dbraw/zinc/56/23/96/566562396.db2.gz KAYWVVNGKDEZCN-INIZCTEOSA-N 0 0 393.237 3.438 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CN2CCC(CF)CC2)c1 ZINC000449452531 566564140 /nfs/dbraw/zinc/56/41/40/566564140.db2.gz GDCHCIWIUOBZSE-UHFFFAOYSA-N 0 0 378.185 3.381 20 5 GGBDRN Cc1nnc([C@@H](C)NC(=O)c2sc(Br)cc2[N+](=O)[O-])s1 ZINC000486166305 566564968 /nfs/dbraw/zinc/56/49/68/566564968.db2.gz QCXKFLSQKYNRGB-SCSAIBSYSA-N 0 0 377.245 3.070 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C1=Cc2cc(Br)ccc2OC1 ZINC000604470994 566566352 /nfs/dbraw/zinc/56/63/52/566566352.db2.gz OAURNOIMVXNRQD-UHFFFAOYSA-N 0 0 389.205 3.450 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)Nc1cccc(O)c1 ZINC000512891624 566566716 /nfs/dbraw/zinc/56/67/16/566566716.db2.gz RITAMVXGFLHBFY-UHFFFAOYSA-N 0 0 398.156 3.466 20 5 GGBDRN COc1cccc2sc(NC(=O)CSc3ncccc3[N+](=O)[O-])nc21 ZINC000604475566 566567277 /nfs/dbraw/zinc/56/72/77/566567277.db2.gz VDBRJXUHTCAABG-UHFFFAOYSA-N 0 0 376.419 3.339 20 5 GGBDRN CNc1ccc(C(=O)NCc2ccc(Br)c(F)c2)cc1[N+](=O)[O-] ZINC000604498599 566567313 /nfs/dbraw/zinc/56/73/13/566567313.db2.gz QKZAFVYDWRTMQZ-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(c3ncc(C)s3)CC2)c1[N+](=O)[O-] ZINC000486217829 566568634 /nfs/dbraw/zinc/56/86/34/566568634.db2.gz CEQHSVCQORSQCU-UHFFFAOYSA-N 0 0 378.479 3.044 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1c(Cl)cccc1Cl ZINC000604508320 566568923 /nfs/dbraw/zinc/56/89/23/566568923.db2.gz WBGWKOAFZVWLOD-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2cc3c(cc2Cl)OCCO3)c([N+](=O)[O-])c1 ZINC000604571258 566571767 /nfs/dbraw/zinc/57/17/67/566571767.db2.gz UPHKVQGOMYIWKE-UHFFFAOYSA-N 0 0 384.797 3.129 20 5 GGBDRN CCn1cc(Br)cc1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000513000371 566572114 /nfs/dbraw/zinc/57/21/14/566572114.db2.gz YSNMINLLGIRDTE-UHFFFAOYSA-N 0 0 380.242 3.493 20 5 GGBDRN O=C(CNc1cc(F)ccc1Br)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000466384529 566572350 /nfs/dbraw/zinc/57/23/50/566572350.db2.gz YDXKNWFHQPKCQY-UHFFFAOYSA-N 0 0 394.200 3.498 20 5 GGBDRN COc1cc(OC)cc(N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000466422213 566574945 /nfs/dbraw/zinc/57/49/45/566574945.db2.gz RDUDADHCROYCHF-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN O=C(c1c(Cl)cncc1Cl)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000559891340 566574908 /nfs/dbraw/zinc/57/49/08/566574908.db2.gz QDWWNIDLQXHTMS-VIFPVBQESA-N 0 0 382.207 3.018 20 5 GGBDRN Cc1cc(NCCCNS(=O)(=O)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000513042789 566575594 /nfs/dbraw/zinc/57/55/94/566575594.db2.gz SZLOVSUKQUVYLX-UHFFFAOYSA-N 0 0 383.857 3.337 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1NCCCNS(=O)(=O)c1ccccc1Cl ZINC000513069677 566577559 /nfs/dbraw/zinc/57/75/59/566577559.db2.gz PEOKBHONJZNBEW-UHFFFAOYSA-N 0 0 387.820 3.168 20 5 GGBDRN O=[N+]([O-])c1nn(Cc2ccn(-c3ccc(Cl)cc3)n2)cc1Br ZINC000466495244 566579893 /nfs/dbraw/zinc/57/98/93/566579893.db2.gz KOZKXONXRSKHJU-UHFFFAOYSA-N 0 0 382.605 3.441 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)C1(c2c(Cl)cccc2Cl)CCC1 ZINC000486340194 566580711 /nfs/dbraw/zinc/58/07/11/566580711.db2.gz YVEKONMSFZPLHC-UHFFFAOYSA-N 0 0 383.235 3.336 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(C)c1C ZINC000466517331 566581210 /nfs/dbraw/zinc/58/12/10/566581210.db2.gz VFYFIDLZRPXMNY-UHFFFAOYSA-N 0 0 384.841 3.352 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(C)c1F ZINC000466519529 566581505 /nfs/dbraw/zinc/58/15/05/566581505.db2.gz RBYXJLUIFBEAFK-UHFFFAOYSA-N 0 0 388.804 3.183 20 5 GGBDRN O=C([O-])C1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 ZINC000559980295 566582049 /nfs/dbraw/zinc/58/20/49/566582049.db2.gz HRQULLQHDXJNGT-UHFFFAOYSA-N 0 0 381.182 3.324 20 5 GGBDRN O=C(Nc1cccc2c1OCCO2)c1sc(Br)cc1[N+](=O)[O-] ZINC000486425238 566587634 /nfs/dbraw/zinc/58/76/34/566587634.db2.gz MNNMALLCZUZFTJ-UHFFFAOYSA-N 0 0 385.195 3.442 20 5 GGBDRN CN(C(=O)c1sc(Br)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000486424263 566587794 /nfs/dbraw/zinc/58/77/94/566587794.db2.gz LWDGIIRGCQHYRT-UHFFFAOYSA-N 0 0 385.195 3.424 20 5 GGBDRN Cn1c(C(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000466609198 566588897 /nfs/dbraw/zinc/58/88/97/566588897.db2.gz LEUABDOOQZUKEP-UHFFFAOYSA-N 0 0 383.235 3.203 20 5 GGBDRN O=C(CN1CCC[C@@H]1C(F)F)Nc1ccc([N+](=O)[O-])cc1Br ZINC000513191914 566589440 /nfs/dbraw/zinc/58/94/40/566589440.db2.gz BGBVMPRSVDEQEK-LLVKDONJSA-N 0 0 378.173 3.025 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)NCCCCc1ccc(Cl)s1 ZINC000560056219 566591475 /nfs/dbraw/zinc/59/14/75/566591475.db2.gz DOKJRSCNDBTHIY-UHFFFAOYSA-N 0 0 375.859 3.006 20 5 GGBDRN C[C@]1(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CCO[C@@H]1C1CC1 ZINC000466708594 566593213 /nfs/dbraw/zinc/59/32/13/566593213.db2.gz ZJXFFGMXEDEIPP-GDBMZVCRSA-N 0 0 383.242 3.292 20 5 GGBDRN COC(=O)c1cnc([C@H](C)NC(=O)c2cccc(SC)c2[N+](=O)[O-])s1 ZINC000424987670 566593640 /nfs/dbraw/zinc/59/36/40/566593640.db2.gz ZSVAICZBJRIZRL-QMMMGPOBSA-N 0 0 381.435 3.051 20 5 GGBDRN COCCN([C@@H]1CCC[C@@H]1C)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000486613907 566603960 /nfs/dbraw/zinc/60/39/60/566603960.db2.gz BJRQDZPQZYQERX-XHDPSFHLSA-N 0 0 390.889 3.382 20 5 GGBDRN CC(C)CCN(C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C1CC1 ZINC000560170061 566604539 /nfs/dbraw/zinc/60/45/39/566604539.db2.gz FPZMSWWZKQBOKH-UHFFFAOYSA-N 0 0 398.257 3.333 20 5 GGBDRN CC[C@H]1CCCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560168903 566605021 /nfs/dbraw/zinc/60/50/21/566605021.db2.gz UVWHAAFTBXGJEA-LBPRGKRZSA-N 0 0 384.230 3.087 20 5 GGBDRN CCC[C@H]1CCCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560183308 566605748 /nfs/dbraw/zinc/60/57/48/566605748.db2.gz HHIOCPFWIGWEJX-ZDUSSCGKSA-N 0 0 398.257 3.477 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCCc2ccc3ccccc3n2)s1 ZINC000539843142 566606091 /nfs/dbraw/zinc/60/60/91/566606091.db2.gz WYCZZVKPPPOSJU-UHFFFAOYSA-N 0 0 377.447 3.263 20 5 GGBDRN COCCN([C@@H]1CCC[C@@H]1C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000486642278 566606236 /nfs/dbraw/zinc/60/62/36/566606236.db2.gz UAEWPOZMLFKWJN-WCQYABFASA-N 0 0 376.862 3.074 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560177197 566606247 /nfs/dbraw/zinc/60/62/47/566606247.db2.gz URPROGDHKCWNSB-GHMZBOCLSA-N 0 0 398.257 3.238 20 5 GGBDRN C[C@H]1CCCC[C@@H]1CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560177200 566606433 /nfs/dbraw/zinc/60/64/33/566606433.db2.gz URPROGDHKCWNSB-WDEREUQCSA-N 0 0 398.257 3.238 20 5 GGBDRN CCC[C@@H]1CCCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000560188506 566606966 /nfs/dbraw/zinc/60/69/66/566606966.db2.gz GJEUQSNOZOWPLM-LLVKDONJSA-N 0 0 398.257 3.335 20 5 GGBDRN CC[C@@H](C)C[C@@H](C)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560224503 566608762 /nfs/dbraw/zinc/60/87/62/566608762.db2.gz CFQKOHRCMPGGJF-NXEZZACHSA-N 0 0 386.246 3.237 20 5 GGBDRN CC[C@@H]1C[C@H](C)CN1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000466929378 566609122 /nfs/dbraw/zinc/60/91/22/566609122.db2.gz AUCPYORJBHGGHD-GXSJLCMTSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1sc(S(=O)(=O)Nc2cc3c(cc2Cl)OCO3)cc1[N+](=O)[O-] ZINC000466963733 566612133 /nfs/dbraw/zinc/61/21/33/566612133.db2.gz LHZGRDMPHMQEQE-UHFFFAOYSA-N 0 0 376.799 3.148 20 5 GGBDRN C[C@H]1COC(C)(C)CN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000486678785 566612358 /nfs/dbraw/zinc/61/23/58/566612358.db2.gz SNDXIMJXXWLKKU-QMMMGPOBSA-N 0 0 383.253 3.090 20 5 GGBDRN O=C(c1ccsc1Br)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000449889082 566613283 /nfs/dbraw/zinc/61/32/83/566613283.db2.gz RLRIFEKKYDMCTF-SECBINFHSA-N 0 0 397.254 3.140 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCSCC(F)(F)F)cc1OC ZINC000539907551 566613441 /nfs/dbraw/zinc/61/34/41/566613441.db2.gz XOKWWNPMMJMJCY-UHFFFAOYSA-N 0 0 382.360 3.027 20 5 GGBDRN O=C(NCCSCC(F)(F)F)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000539908546 566613596 /nfs/dbraw/zinc/61/35/96/566613596.db2.gz GFMSNUMTYQGXHK-UHFFFAOYSA-N 0 0 387.177 3.383 20 5 GGBDRN CCOc1cc(N[C@H](C(N)=O)c2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000539969992 566618594 /nfs/dbraw/zinc/61/85/94/566618594.db2.gz IRJCMUOJXZHFMC-HNNXBMFYSA-N 0 0 394.225 3.395 20 5 GGBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467049669 566621478 /nfs/dbraw/zinc/62/14/78/566621478.db2.gz VKTLPBYIKHBMFC-BJOHPYRUSA-N 0 0 388.442 3.158 20 5 GGBDRN CCC1(CC)[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C[C@@H]1OC ZINC000467061670 566622100 /nfs/dbraw/zinc/62/21/00/566622100.db2.gz DVJARSWDMGWGDF-OLZOCXBDSA-N 0 0 376.500 3.179 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000467065521 566622445 /nfs/dbraw/zinc/62/24/45/566622445.db2.gz ZJAGVMYKNCBSNI-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CCC1(CC)[C@H](OC)C[C@@H]1N(C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467061671 566622885 /nfs/dbraw/zinc/62/28/85/566622885.db2.gz DVJARSWDMGWGDF-QWHCGFSZSA-N 0 0 376.500 3.179 20 5 GGBDRN CO[C@H](c1ccccc1F)[C@@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467064285 566623048 /nfs/dbraw/zinc/62/30/48/566623048.db2.gz UWZWEELVUHLMCO-PSLIRLAXSA-N 0 0 388.442 3.158 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@@H](C)Oc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000467070800 566624270 /nfs/dbraw/zinc/62/42/70/566624270.db2.gz GGEZQIWEFWTIBH-SECBINFHSA-N 0 0 390.870 3.364 20 5 GGBDRN CCCCCn1cc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c(C)n1 ZINC000467078083 566624412 /nfs/dbraw/zinc/62/44/12/566624412.db2.gz FQRLZEMDRPOJQT-UHFFFAOYSA-N 0 0 386.499 3.138 20 5 GGBDRN CCO[C@H](CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C1CCCC1 ZINC000467081134 566625086 /nfs/dbraw/zinc/62/50/86/566625086.db2.gz KQUYDPDXXCSQOK-CQSZACIVSA-N 0 0 376.500 3.228 20 5 GGBDRN CCO[C@@H](CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C1CCCC1 ZINC000467081033 566625177 /nfs/dbraw/zinc/62/51/77/566625177.db2.gz KQUYDPDXXCSQOK-AWEZNQCLSA-N 0 0 376.500 3.228 20 5 GGBDRN Cc1ccc(Br)cc1S(=O)(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000513812134 566625283 /nfs/dbraw/zinc/62/52/83/566625283.db2.gz FKQTZWNSIJUKID-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN CC[C@@H](C)N(CC(=O)OC(C)(C)C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467085700 566625589 /nfs/dbraw/zinc/62/55/89/566625589.db2.gz NTOYHCNFLFVUPJ-SNVBAGLBSA-N 0 0 392.499 3.096 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)c([N+](=O)[O-])c1 ZINC000486836129 566626967 /nfs/dbraw/zinc/62/69/67/566626967.db2.gz XSTBWKWNVNWHPC-QMMMGPOBSA-N 0 0 395.384 3.418 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)[C@@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000486835698 566627005 /nfs/dbraw/zinc/62/70/05/566627005.db2.gz SKOOHENIZAIZRZ-GFCCVEGCSA-N 0 0 377.260 3.085 20 5 GGBDRN C[C@H]1Cc2cc(S(=O)(=O)N(C)c3cccc([N+](=O)[O-])c3)cc(Cl)c2O1 ZINC000513814063 566626976 /nfs/dbraw/zinc/62/69/76/566626976.db2.gz QTGUGJSAFZDWIC-JTQLQIEISA-N 0 0 382.825 3.397 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)c2cccc([N+](=O)[O-])c2)ccc1Br ZINC000513816063 566627312 /nfs/dbraw/zinc/62/73/12/566627312.db2.gz HIZNYYYHNPWBNZ-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N[C@H]2C=CCCC2)cc1[N+](=O)[O-] ZINC000467125034 566627521 /nfs/dbraw/zinc/62/75/21/566627521.db2.gz GPVUAQFKKVBHAR-JTQLQIEISA-N 0 0 375.244 3.053 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1Cl ZINC000513814681 566627813 /nfs/dbraw/zinc/62/78/13/566627813.db2.gz FBWZILYMHWFZKV-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN COc1ccc(COCCNc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000540078818 566628398 /nfs/dbraw/zinc/62/83/98/566628398.db2.gz XCYYNZSRVJIVOQ-UHFFFAOYSA-N 0 0 382.214 3.390 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000486845156 566628456 /nfs/dbraw/zinc/62/84/56/566628456.db2.gz MHXLDEJBUZNQKI-MRVPVSSYSA-N 0 0 395.384 3.418 20 5 GGBDRN Cc1nc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])ccc1Br ZINC000467131076 566628531 /nfs/dbraw/zinc/62/85/31/566628531.db2.gz VNDNAGZUQAHCNS-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN O=C(CN1CCOc2ccc(Br)cc21)Nc1ccccc1[N+](=O)[O-] ZINC000467140363 566628577 /nfs/dbraw/zinc/62/85/77/566628577.db2.gz XGPKZAKQXRVZQZ-UHFFFAOYSA-N 0 0 392.209 3.195 20 5 GGBDRN COC[C@H](c1ccc(Cl)cc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000486853947 566629793 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Cc1noc(C2CCN(Cc3ccc(Br)cc3[N+](=O)[O-])CC2)n1 ZINC000425406564 566639965 /nfs/dbraw/zinc/63/99/65/566639965.db2.gz MSZIZGUELRZUFB-UHFFFAOYSA-N 0 0 381.230 3.428 20 5 GGBDRN COC(=O)[C@@H]1CC12CCN(Cc1ccc(Br)cc1[N+](=O)[O-])CC2 ZINC000425411256 566640314 /nfs/dbraw/zinc/64/03/14/566640314.db2.gz YIAJXLDVDLEVFZ-ZDUSSCGKSA-N 0 0 383.242 3.132 20 5 GGBDRN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000540257670 566640598 /nfs/dbraw/zinc/64/05/98/566640598.db2.gz WGGJYQVJXXPONT-YMTOWFKASA-N 0 0 382.214 3.191 20 5 GGBDRN CC(C)(C)CNC(=O)C(C)(C)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000425415883 566642162 /nfs/dbraw/zinc/64/21/62/566642162.db2.gz FXYJMXUCOTVWBL-UHFFFAOYSA-N 0 0 386.290 3.388 20 5 GGBDRN COc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c(F)c1 ZINC000467336401 566642191 /nfs/dbraw/zinc/64/21/91/566642191.db2.gz WTDSWCPOBKWGRR-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC(Oc2ccccn2)CC1 ZINC000540296534 566642553 /nfs/dbraw/zinc/64/25/53/566642553.db2.gz BPKILLOCTUCGOU-UHFFFAOYSA-N 0 0 379.214 3.195 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H](C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000467395778 566643168 /nfs/dbraw/zinc/64/31/68/566643168.db2.gz VFIFDYBVIHEQFY-LBPRGKRZSA-N 0 0 384.479 3.096 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000467399786 566643267 /nfs/dbraw/zinc/64/32/67/566643267.db2.gz QNLXWMDWQVBBDS-HOCLYGCPSA-N 0 0 382.463 3.163 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2csc(Br)c2)cc1[N+](=O)[O-] ZINC000467403423 566643344 /nfs/dbraw/zinc/64/33/44/566643344.db2.gz WJYWZQAZHVEDLL-UHFFFAOYSA-N 0 0 397.297 3.267 20 5 GGBDRN Cn1cccc1[C@H]1COCCN1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425435847 566643513 /nfs/dbraw/zinc/64/35/13/566643513.db2.gz UJUUJVCJHDMJQO-MRXNPFEDSA-N 0 0 380.242 3.269 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CC[C@@](CO)(c2ccccc2)C1 ZINC000425447921 566643908 /nfs/dbraw/zinc/64/39/08/566643908.db2.gz QESBQEVQFDTMFH-GOSISDBHSA-N 0 0 391.265 3.493 20 5 GGBDRN COc1ccc([C@H]2CCN(S(=O)(=O)c3cc([N+](=O)[O-])c(C)s3)C2)cc1 ZINC000467398829 566643927 /nfs/dbraw/zinc/64/39/27/566643927.db2.gz LYTGHTZLIFHKOB-ZDUSSCGKSA-N 0 0 382.463 3.152 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)CCOc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000467415626 566644908 /nfs/dbraw/zinc/64/49/08/566644908.db2.gz FALMHBDBHXQCHM-UHFFFAOYSA-N 0 0 390.870 3.318 20 5 GGBDRN O=C1CN(c2ncc([N+](=O)[O-])cc2Cl)CCN1Cc1cccc(Cl)c1 ZINC000467450730 566647582 /nfs/dbraw/zinc/64/75/82/566647582.db2.gz XBMHEXUGCAAMNP-UHFFFAOYSA-N 0 0 381.219 3.145 20 5 GGBDRN C[NH+](C)[C@H]1CCC[C@H]([N-]S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000487092834 566648054 /nfs/dbraw/zinc/64/80/54/566648054.db2.gz IFHRGLPXROWJKL-QWRGUYRKSA-N 0 0 396.296 3.053 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000425481412 566648547 /nfs/dbraw/zinc/64/85/47/566648547.db2.gz PTTUWDQJYKHXSQ-GXFFZTMASA-N 0 0 397.191 3.493 20 5 GGBDRN Cc1c(CNC(=O)c2cn3ccc(Br)cc3n2)cccc1[N+](=O)[O-] ZINC000560667867 566649141 /nfs/dbraw/zinc/64/91/41/566649141.db2.gz UZKMGCKOJRAQSE-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN COc1cc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)ccc1Br ZINC000487117575 566649840 /nfs/dbraw/zinc/64/98/40/566649840.db2.gz PMLHNOGNLVHODD-UHFFFAOYSA-N 0 0 395.165 3.347 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H]1SCCc2ccccc21 ZINC000487126069 566651157 /nfs/dbraw/zinc/65/11/57/566651157.db2.gz YOVDPLSXHJTVIN-MRXNPFEDSA-N 0 0 378.475 3.212 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H]1SCCc2ccccc21 ZINC000487124355 566651336 /nfs/dbraw/zinc/65/13/36/566651336.db2.gz XBCXEBNTZDZJSB-MRXNPFEDSA-N 0 0 378.475 3.212 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1SCCc2ccccc21 ZINC000487124272 566651466 /nfs/dbraw/zinc/65/14/66/566651466.db2.gz WSVVOTVFSMBAFT-INIZCTEOSA-N 0 0 378.475 3.212 20 5 GGBDRN CCC1(CC)CN(C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000467535773 566651784 /nfs/dbraw/zinc/65/17/84/566651784.db2.gz BKDBILCEFWVUHD-UHFFFAOYSA-N 0 0 385.873 3.321 20 5 GGBDRN Cc1nc(N[C@H](C)c2cc3c(cc2Br)OCCO3)ncc1[N+](=O)[O-] ZINC000450275075 566653028 /nfs/dbraw/zinc/65/30/28/566653028.db2.gz IQYZGBDPVNGUOU-MRVPVSSYSA-N 0 0 395.213 3.400 20 5 GGBDRN Cc1cccc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1Br ZINC000487182680 566653534 /nfs/dbraw/zinc/65/35/34/566653534.db2.gz BQMLZCYKHPKWHA-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN Cc1nc(N2CCO[C@@H](c3cccc(Br)c3)C2)ncc1[N+](=O)[O-] ZINC000450293565 566653856 /nfs/dbraw/zinc/65/38/56/566653856.db2.gz KHEPEJLRPZJLOW-CQSZACIVSA-N 0 0 379.214 3.034 20 5 GGBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1n[nH]c(C(C)C)c1Br ZINC000579957120 566654476 /nfs/dbraw/zinc/65/44/76/566654476.db2.gz ZHNIJQCNZNVBTJ-UHFFFAOYSA-N 0 0 382.218 3.498 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCc3ccc(Br)cc3C2)c1[N+](=O)[O-] ZINC000560766034 566655867 /nfs/dbraw/zinc/65/58/67/566655867.db2.gz UGXWCRALQCEHAH-UHFFFAOYSA-N 0 0 393.241 3.231 20 5 GGBDRN O=C(NCCc1ccc(Br)cc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000487216837 566656789 /nfs/dbraw/zinc/65/67/89/566656789.db2.gz FZEKXPHAIKDVBZ-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN CO[C@@H]1[C@@H](C)[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1(C)C ZINC000540538114 566657654 /nfs/dbraw/zinc/65/76/54/566657654.db2.gz RRYBKDIYTWNFQR-TZTCFGBESA-N 0 0 385.258 3.076 20 5 GGBDRN CC[C@@H]1Cc2c(Br)cccc2CN1Cc1c([N+](=O)[O-])ncn1C ZINC000514651714 566658168 /nfs/dbraw/zinc/65/81/68/566658168.db2.gz QLISCIFNZFIWFM-GFCCVEGCSA-N 0 0 379.258 3.428 20 5 GGBDRN Cc1nc(N[C@H]2CCN(c3ccccc3Br)C2)ncc1[N+](=O)[O-] ZINC000450334819 566659941 /nfs/dbraw/zinc/65/99/41/566659941.db2.gz JDLSZVNOKAWIAN-NSHDSACASA-N 0 0 378.230 3.147 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCc2ccc(Br)cc21 ZINC000487267974 566660532 /nfs/dbraw/zinc/66/05/32/566660532.db2.gz LPNPKJHAHGXLIF-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN O=C(CNc1ccc(Br)c(F)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000487333547 566663898 /nfs/dbraw/zinc/66/38/98/566663898.db2.gz AZWQSLYHTKASIX-UHFFFAOYSA-N 0 0 394.200 3.498 20 5 GGBDRN 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CCC(CC)n1ccc(Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)n1 ZINC000541288025 566710589 /nfs/dbraw/zinc/71/05/89/566710589.db2.gz BOTGVHFDKUCIKM-UHFFFAOYSA-N 0 0 383.246 3.433 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000541290538 566712209 /nfs/dbraw/zinc/71/22/09/566712209.db2.gz NTASRTMREJXCHS-UHFFFAOYSA-N 0 0 389.209 3.061 20 5 GGBDRN CS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2OC(F)F)s1 ZINC000468599096 566713192 /nfs/dbraw/zinc/71/31/92/566713192.db2.gz OGXQGKAILFMXRM-UHFFFAOYSA-N 0 0 378.378 3.273 20 5 GGBDRN O=[N+]([O-])c1cccnc1NC[C@H](CO)Cc1cc(Br)ccc1F ZINC000450851284 566713455 /nfs/dbraw/zinc/71/34/55/566713455.db2.gz XKTCQLKWJSOYOP-SNVBAGLBSA-N 0 0 384.205 3.155 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000541308462 566713503 /nfs/dbraw/zinc/71/35/03/566713503.db2.gz IJGKLPBDTDLTFD-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN CC(C)(c1noc(Cn2ccc([N+](=O)[O-])n2)n1)c1ccccc1Br ZINC000580680440 566713594 /nfs/dbraw/zinc/71/35/94/566713594.db2.gz HWNBMCYPOBCELO-UHFFFAOYSA-N 0 0 392.213 3.311 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1c2cccc(Br)c2CC1(C)C ZINC000561522334 566714224 /nfs/dbraw/zinc/71/42/24/566714224.db2.gz AYMYZQGOMKAOCK-AWEZNQCLSA-N 0 0 393.241 3.144 20 5 GGBDRN CCn1[nH]c(=NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cc1C1CC1 ZINC000541302050 566714245 /nfs/dbraw/zinc/71/42/45/566714245.db2.gz HNGWAXNSRRPWTH-UHFFFAOYSA-N 0 0 380.857 3.495 20 5 GGBDRN CS(=O)(=O)c1cccc(N[C@H]2CCO[C@@H](c3cccs3)C2)c1[N+](=O)[O-] ZINC000450864018 566714471 /nfs/dbraw/zinc/71/44/71/566714471.db2.gz QUBUFYXSBVVEJS-WCQYABFASA-N 0 0 382.463 3.392 20 5 GGBDRN CC[C@@H](C)[C@](C)(O)CNc1ccc(I)cc1[N+](=O)[O-] ZINC000488209512 566714687 /nfs/dbraw/zinc/71/46/87/566714687.db2.gz MCNHTKYDHKNIFE-NOZJJQNGSA-N 0 0 378.210 3.408 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)c1ccc(C(C)(C)C)s1 ZINC000541312137 566715336 /nfs/dbraw/zinc/71/53/36/566715336.db2.gz FEZIHWPKYKTOQM-UHFFFAOYSA-N 0 0 384.479 3.441 20 5 GGBDRN NS(=O)(=O)c1cccc(SC2CCC(C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000450871400 566715864 /nfs/dbraw/zinc/71/58/64/566715864.db2.gz NJPKOBZYRDJMNZ-UHFFFAOYSA-N 0 0 384.401 3.455 20 5 GGBDRN O=[N+]([O-])c1cccnc1NC[C@H](CO)Cc1ccc(F)c(Br)c1 ZINC000450890092 566716628 /nfs/dbraw/zinc/71/66/28/566716628.db2.gz UDJHVMYKPQNCSP-LLVKDONJSA-N 0 0 384.205 3.155 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000580736719 566718035 /nfs/dbraw/zinc/71/80/35/566718035.db2.gz NAOFMEUZKFZVGX-RDJZCZTQSA-N 0 0 395.253 3.449 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000580736720 566718045 /nfs/dbraw/zinc/71/80/45/566718045.db2.gz NAOFMEUZKFZVGX-WBVHZDCISA-N 0 0 395.253 3.449 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@@H]2CCCCS2)c(S(=O)(=O)N2CCCC2)c1 ZINC000541332526 566718257 /nfs/dbraw/zinc/71/82/57/566718257.db2.gz XUAQCJWPGRVUFF-AWEZNQCLSA-N 0 0 385.511 3.077 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)c2cccc(SC)c2)cc1[N+](=O)[O-] ZINC000488258292 566718272 /nfs/dbraw/zinc/71/82/72/566718272.db2.gz AIJOVLUBOOMFDK-UHFFFAOYSA-N 0 0 386.426 3.290 20 5 GGBDRN COC(=O)c1ccc(Cn2cc([N+](=O)[O-])c(C3CC3)n2)c(Br)c1 ZINC000450898850 566718640 /nfs/dbraw/zinc/71/86/40/566718640.db2.gz CRHVXFZHGLHORN-UHFFFAOYSA-N 0 0 380.198 3.266 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@H]2CCCCS2)c(S(=O)(=O)N2CCCC2)c1 ZINC000541332528 566718635 /nfs/dbraw/zinc/71/86/35/566718635.db2.gz XUAQCJWPGRVUFF-CQSZACIVSA-N 0 0 385.511 3.077 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000580736717 566718758 /nfs/dbraw/zinc/71/87/58/566718758.db2.gz NAOFMEUZKFZVGX-DOTOQJQBSA-N 0 0 395.253 3.449 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H](COC(F)F)C1 ZINC000580766011 566720910 /nfs/dbraw/zinc/72/09/10/566720910.db2.gz OHKGYSKIWQTXEM-SECBINFHSA-N 0 0 380.800 3.428 20 5 GGBDRN CN(C[C@@H](O)COCc1ccccc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488335904 566720922 /nfs/dbraw/zinc/72/09/22/566720922.db2.gz YWOWWECOFVAFAP-OAHLLOKOSA-N 0 0 395.253 3.371 20 5 GGBDRN O=C(Nc1cccc(N2CCC2=O)c1)c1ccc([N+](=O)[O-])cc1Br ZINC000468697511 566720974 /nfs/dbraw/zinc/72/09/74/566720974.db2.gz SUGSCTKPLZYAHZ-UHFFFAOYSA-N 0 0 390.193 3.346 20 5 GGBDRN CO[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccc(Cl)cc1 ZINC000468706327 566721100 /nfs/dbraw/zinc/72/11/00/566721100.db2.gz JXJLWRARBPZGPI-HNNXBMFYSA-N 0 0 384.841 3.451 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000468696740 566721464 /nfs/dbraw/zinc/72/14/64/566721464.db2.gz OBBCMHMNFPCYLB-SNVBAGLBSA-N 0 0 378.226 3.301 20 5 GGBDRN COc1ccc(OCCSc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000468701508 566721568 /nfs/dbraw/zinc/72/15/68/566721568.db2.gz CPMDEYCCSZSBJX-UHFFFAOYSA-N 0 0 383.447 3.178 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)c1nc2c(cccc2Cl)s1 ZINC000515582318 566722177 /nfs/dbraw/zinc/72/21/77/566722177.db2.gz VJNWOSGJSUHOGR-UHFFFAOYSA-N 0 0 379.829 3.416 20 5 GGBDRN CN(C[C@H](O)COCc1ccccc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488335903 566722062 /nfs/dbraw/zinc/72/20/62/566722062.db2.gz YWOWWECOFVAFAP-HNNXBMFYSA-N 0 0 395.253 3.371 20 5 GGBDRN O=C(Nc1cccc(N2CCC2=O)c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000468723981 566722631 /nfs/dbraw/zinc/72/26/31/566722631.db2.gz KAUKROAAQFRXKZ-UHFFFAOYSA-N 0 0 390.193 3.346 20 5 GGBDRN NC(=O)Nc1cccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000541407107 566723014 /nfs/dbraw/zinc/72/30/14/566723014.db2.gz ITSMQYIOCYOUPH-UHFFFAOYSA-N 0 0 380.813 3.470 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCN(CC(F)(F)F)CC1 ZINC000541406895 566723517 /nfs/dbraw/zinc/72/35/17/566723517.db2.gz AZEDZVDPQYLILF-UHFFFAOYSA-N 0 0 397.806 3.047 20 5 GGBDRN Cn1ccnc1[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000450950652 566723926 /nfs/dbraw/zinc/72/39/26/566723926.db2.gz NHRPJMBJRHQPND-YGRLFVJLSA-N 0 0 381.230 3.423 20 5 GGBDRN Cn1ccnc1[C@@H]1C[C@@H](Nc2ccc(Br)cc2[N+](=O)[O-])CCO1 ZINC000450952607 566723944 /nfs/dbraw/zinc/72/39/44/566723944.db2.gz UMJLOYPJGQQZQO-FZMZJTMJSA-N 0 0 381.230 3.423 20 5 GGBDRN Cn1ccnc1[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000450950647 566724097 /nfs/dbraw/zinc/72/40/97/566724097.db2.gz NHRPJMBJRHQPND-HZMBPMFUSA-N 0 0 381.230 3.423 20 5 GGBDRN COCCOc1ccc(Sc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000468735202 566724202 /nfs/dbraw/zinc/72/42/02/566724202.db2.gz QARPXMYLGVKEAB-UHFFFAOYSA-N 0 0 383.447 3.175 20 5 GGBDRN O=C(N[C@H]1CCC[C@@H](F)C1)c1ccc([N+](=O)[O-])cc1I ZINC000515652176 566724780 /nfs/dbraw/zinc/72/47/80/566724780.db2.gz JPLIFXXPDXYHBZ-BDAKNGLRSA-N 0 0 392.168 3.210 20 5 GGBDRN CC[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@H](O)C(F)(F)F ZINC000541466994 566726206 /nfs/dbraw/zinc/72/62/06/566726206.db2.gz XQHHMDQVFPRULK-PELKAZGASA-N 0 0 386.779 3.158 20 5 GGBDRN CSc1cccc(C(=O)NC[C@H](CO)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000561651936 566726381 /nfs/dbraw/zinc/72/63/81/566726381.db2.gz IZZTXARAFMYTSW-LLVKDONJSA-N 0 0 380.853 3.476 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(OCCO)cc1 ZINC000541466169 566726312 /nfs/dbraw/zinc/72/63/12/566726312.db2.gz XSCIUDMDZCFAIJ-UHFFFAOYSA-N 0 0 382.825 3.350 20 5 GGBDRN Cc1cc(Br)ccc1C[NH2+][C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)[O-] ZINC000426763709 566727859 /nfs/dbraw/zinc/72/78/59/566727859.db2.gz DAMPRDIMENKAPJ-INIZCTEOSA-N 0 0 393.237 3.451 20 5 GGBDRN CCc1n[nH]c(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1Br ZINC000468766179 566728180 /nfs/dbraw/zinc/72/81/80/566728180.db2.gz AJPOROJIMXEYJR-UHFFFAOYSA-N 0 0 381.230 3.308 20 5 GGBDRN Cc1ccc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cc1Br ZINC000426779699 566728488 /nfs/dbraw/zinc/72/84/88/566728488.db2.gz KLDXWJVWUVZAMD-INIZCTEOSA-N 0 0 393.237 3.451 20 5 GGBDRN C[C@H](C[S@@](C)=O)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000541502685 566729377 /nfs/dbraw/zinc/72/93/77/566729377.db2.gz DJFFTXBWNNIUPK-XELLLNAOSA-N 0 0 378.475 3.243 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCc3cc(Br)ccc32)cc1 ZINC000515752308 566730201 /nfs/dbraw/zinc/73/02/01/566730201.db2.gz IUWANACYPFJFOF-UHFFFAOYSA-N 0 0 397.250 3.499 20 5 GGBDRN CN(CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000515730155 566730544 /nfs/dbraw/zinc/73/05/44/566730544.db2.gz XCGHQABLJSGDBN-UHFFFAOYSA-N 0 0 383.857 3.053 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(Br)cc1 ZINC000426810572 566730655 /nfs/dbraw/zinc/73/06/55/566730655.db2.gz IXMKFTLPMQLHGV-AWEZNQCLSA-N 0 0 379.210 3.143 20 5 GGBDRN Cc1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])cc1Br ZINC000426806080 566731307 /nfs/dbraw/zinc/73/13/07/566731307.db2.gz IITIWOOERMJQEN-HNNXBMFYSA-N 0 0 393.237 3.451 20 5 GGBDRN C[C@@H]1CCCC[C@H]1OCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000515758843 566732158 /nfs/dbraw/zinc/73/21/58/566732158.db2.gz RKPHBCMMTIWMTG-BXUZGUMPSA-N 0 0 376.862 3.122 20 5 GGBDRN C[C@@H]1CC(C)(C)CN1C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000515798680 566733764 /nfs/dbraw/zinc/73/37/64/566733764.db2.gz AOTQAFINKSBKRD-SECBINFHSA-N 0 0 388.205 3.460 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@H]2CCSc3ccccc32)ccc1[N+](=O)[O-] ZINC000468829084 566734175 /nfs/dbraw/zinc/73/41/75/566734175.db2.gz FHTPQVLKPCUHEG-ZDUSSCGKSA-N 0 0 380.447 3.119 20 5 GGBDRN Cc1cc(C2CCN(c3ncc([N+](=O)[O-])c(C)c3Br)CC2)n[nH]1 ZINC000541576247 566734408 /nfs/dbraw/zinc/73/44/08/566734408.db2.gz BNTJFVBFFBRFBO-UHFFFAOYSA-N 0 0 380.246 3.476 20 5 GGBDRN CCc1nccn1C[C@H]1CCCN1c1ncc([N+](=O)[O-])c(C)c1Br ZINC000541577688 566734467 /nfs/dbraw/zinc/73/44/67/566734467.db2.gz WMXRCMVGTNUPBQ-GFCCVEGCSA-N 0 0 394.273 3.489 20 5 GGBDRN COc1ccc(COCCNc2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000541575842 566734558 /nfs/dbraw/zinc/73/45/58/566734558.db2.gz GLEHZZLFLBJBFY-UHFFFAOYSA-N 0 0 396.241 3.120 20 5 GGBDRN CC[C@@H]1CN(c2ncc([N+](=O)[O-])c(C)c2Br)[C@H](CC)CN1C(C)=O ZINC000541576894 566734724 /nfs/dbraw/zinc/73/47/24/566734724.db2.gz UQTIAEDVWPCTNJ-CHWSQXEVSA-N 0 0 399.289 3.286 20 5 GGBDRN Cc1c(Br)c(N[C@@H](C)[C@H](O)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000541578855 566734851 /nfs/dbraw/zinc/73/48/51/566734851.db2.gz QUIMQAODRREUFT-SMDDNHRTSA-N 0 0 380.242 3.465 20 5 GGBDRN Cc1c(Br)c(N(C)CC(=O)Nc2ccccc2)ncc1[N+](=O)[O-] ZINC000541576724 566734981 /nfs/dbraw/zinc/73/49/81/566734981.db2.gz QLYVUIQJPRJEHV-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN CC[C@H]1CN(c2ncc([N+](=O)[O-])c(C)c2Br)[C@@H](CC)CN1C(C)=O ZINC000541576897 566735091 /nfs/dbraw/zinc/73/50/91/566735091.db2.gz UQTIAEDVWPCTNJ-STQMWFEESA-N 0 0 399.289 3.286 20 5 GGBDRN Cc1c(Br)c(NCC2(C(=O)N(C)C)CCCC2)ncc1[N+](=O)[O-] ZINC000541576001 566735174 /nfs/dbraw/zinc/73/51/74/566735174.db2.gz PSGJMRCIZPLNDR-UHFFFAOYSA-N 0 0 385.262 3.121 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CSc2ccc(Br)cc21 ZINC000488556355 566735286 /nfs/dbraw/zinc/73/52/86/566735286.db2.gz CNXGXVFERWYZCC-NSHDSACASA-N 0 0 395.238 3.143 20 5 GGBDRN CC[C@@H]1CN(C(C)=O)[C@@H](CC)CN1c1ncc([N+](=O)[O-])c(C)c1Br ZINC000541576896 566735290 /nfs/dbraw/zinc/73/52/90/566735290.db2.gz UQTIAEDVWPCTNJ-QWHCGFSZSA-N 0 0 399.289 3.286 20 5 GGBDRN CNC(=O)c1ccc(CN(C)c2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000541577377 566735407 /nfs/dbraw/zinc/73/54/07/566735407.db2.gz TWOPXFZYZKTPKW-UHFFFAOYSA-N 0 0 393.241 3.057 20 5 GGBDRN CS(=O)(=O)Cc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000468835488 566735596 /nfs/dbraw/zinc/73/55/96/566735596.db2.gz DPECIHDXJOBSBX-UHFFFAOYSA-N 0 0 386.788 3.184 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000608809694 566735892 /nfs/dbraw/zinc/73/58/92/566735892.db2.gz MYFLPPXERAATQE-NSHDSACASA-N 0 0 381.841 3.327 20 5 GGBDRN Cc1c(Br)c(N[C@@H](C)C(=O)N2CCCC[C@@H]2C)ncc1[N+](=O)[O-] ZINC000541589554 566736959 /nfs/dbraw/zinc/73/69/59/566736959.db2.gz CDJIHJREPGESHR-ONGXEEELSA-N 0 0 385.262 3.262 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCN(CC(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000541579286 566737022 /nfs/dbraw/zinc/73/70/22/566737022.db2.gz VMEAQOGUNIYVQG-QMMMGPOBSA-N 0 0 383.168 3.109 20 5 GGBDRN Nc1c(C(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)cc(F)cc1[N+](=O)[O-] ZINC000608826623 566737259 /nfs/dbraw/zinc/73/72/59/566737259.db2.gz JICSHDMQUUDWOU-YPMHNXCESA-N 0 0 394.200 3.365 20 5 GGBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000468856525 566737215 /nfs/dbraw/zinc/73/72/15/566737215.db2.gz GHHQMYXPBXASDD-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN O=C(N[C@H](CO)c1ccc(Br)c(F)c1)c1ccc([N+](=O)[O-])s1 ZINC000561774077 566738527 /nfs/dbraw/zinc/73/85/27/566738527.db2.gz MFGQHQQXAYZSSQ-SNVBAGLBSA-N 0 0 389.202 3.021 20 5 GGBDRN CC1(NS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CCCCC1 ZINC000488643827 566738606 /nfs/dbraw/zinc/73/86/06/566738606.db2.gz KBELIBVFEJHCLZ-UHFFFAOYSA-N 0 0 377.260 3.358 20 5 GGBDRN CC1(C)CN(c2c(Br)cncc2[N+](=O)[O-])C[C@H](C(F)(F)F)O1 ZINC000488688247 566741162 /nfs/dbraw/zinc/74/11/62/566741162.db2.gz SPSFCASCHSDVQR-SECBINFHSA-N 0 0 384.152 3.298 20 5 GGBDRN COc1cc(S(=O)(=O)NCCCSc2ccccc2)ccc1[N+](=O)[O-] ZINC000468887301 566741640 /nfs/dbraw/zinc/74/16/40/566741640.db2.gz INSZVRSYNKZVOI-UHFFFAOYSA-N 0 0 382.463 3.064 20 5 GGBDRN O=C(NCc1ccc(O)c(Br)c1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000488684656 566741778 /nfs/dbraw/zinc/74/17/78/566741778.db2.gz KHFKMKLJCKBNQQ-UHFFFAOYSA-N 0 0 390.193 3.474 20 5 GGBDRN COc1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000608901051 566742026 /nfs/dbraw/zinc/74/20/26/566742026.db2.gz SARODPGWATVBIZ-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN COc1cc(Br)c(CNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000608898705 566742283 /nfs/dbraw/zinc/74/22/83/566742283.db2.gz YIYYXOKJWOFPRU-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN Cc1cc(N2CCC(CS(C)(=O)=O)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000488718479 566742436 /nfs/dbraw/zinc/74/24/36/566742436.db2.gz HAFBIHXDDZVEMB-UHFFFAOYSA-N 0 0 380.388 3.183 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000608907745 566742361 /nfs/dbraw/zinc/74/23/61/566742361.db2.gz RHAVZJHSLXTHPF-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN COc1cc(S(=O)(=O)NC[C@H](C)Sc2ccccc2)ccc1[N+](=O)[O-] ZINC000468911096 566742966 /nfs/dbraw/zinc/74/29/66/566742966.db2.gz JSIDQELOUFFKRJ-LBPRGKRZSA-N 0 0 382.463 3.063 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NC(C)(C)Cc1ccc(Br)cc1 ZINC000608949805 566743231 /nfs/dbraw/zinc/74/32/31/566743231.db2.gz YAYGSJGFGAWAEP-UHFFFAOYSA-N 0 0 380.242 3.447 20 5 GGBDRN O=C1[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)CN1c1ccc(Br)cc1 ZINC000488718962 566743410 /nfs/dbraw/zinc/74/34/10/566743410.db2.gz HQPBVWIMUJKGLV-LBPRGKRZSA-N 0 0 397.616 3.233 20 5 GGBDRN O=C1[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CN1c1ccc(Br)cc1 ZINC000488723631 566743989 /nfs/dbraw/zinc/74/39/89/566743989.db2.gz WZYRDUMZYCQKBH-NSHDSACASA-N 0 0 397.616 3.233 20 5 GGBDRN Cc1ccc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc1I ZINC000581035137 566744352 /nfs/dbraw/zinc/74/43/52/566744352.db2.gz KBSQKWPTURYAFV-UHFFFAOYSA-N 0 0 397.172 3.179 20 5 GGBDRN O=C(N[C@@H]1CC[S@](=O)C1)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000541728901 566744473 /nfs/dbraw/zinc/74/44/73/566744473.db2.gz VXNQAXLPQVOTKS-SHZVTRLKSA-N 0 0 382.507 3.128 20 5 GGBDRN O=C(N[C@H]1CC[S@@](=O)C1)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000541728903 566744486 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O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCC[C@@H]1C1CCC1 ZINC000609134500 566751359 /nfs/dbraw/zinc/75/13/59/566751359.db2.gz DWDBNQHVQXQABB-GFCCVEGCSA-N 0 0 389.271 3.311 20 5 GGBDRN O=[N+]([O-])c1cc2ccccc2nc1NCCCn1cc(Br)cn1 ZINC000516208671 566751574 /nfs/dbraw/zinc/75/15/74/566751574.db2.gz XMHXAXKWTGVZLD-UHFFFAOYSA-N 0 0 376.214 3.026 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C1(CO)CCC1 ZINC000516192646 566751614 /nfs/dbraw/zinc/75/16/14/566751614.db2.gz HIVYGUBPMAAADY-CQSZACIVSA-N 0 0 385.258 3.274 20 5 GGBDRN Cc1cc(=O)[nH]c(C=Cc2cc(I)cc([N+](=O)[O-])c2)n1 ZINC000516221015 566753741 /nfs/dbraw/zinc/75/37/41/566753741.db2.gz LIRJCNYQYWYLKG-IHWYPQMZSA-N 0 0 383.145 3.174 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCc1nc(C(C)(C)C)cs1 ZINC000609199451 566753867 /nfs/dbraw/zinc/75/38/67/566753867.db2.gz YXJJIVKHIMUNHA-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN Cc1ccccc1CNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488862807 566754107 /nfs/dbraw/zinc/75/41/07/566754107.db2.gz TZYACEFXGIMDQU-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN COc1ccc(CNC(=O)c2cccc(Br)c2F)cc1[N+](=O)[O-] ZINC000469036698 566754431 /nfs/dbraw/zinc/75/44/31/566754431.db2.gz PVQUUFHGWNVGBH-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1ccccc1CN(C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488887631 566755522 /nfs/dbraw/zinc/75/55/22/566755522.db2.gz DPLSHRYNVGCMRA-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000541854790 566755538 /nfs/dbraw/zinc/75/55/38/566755538.db2.gz JWHUBNRMWREBDM-DGCLKSJQSA-N 0 0 376.210 3.225 20 5 GGBDRN CCn1cc(CN(C)C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cn1 ZINC000581179845 566755991 /nfs/dbraw/zinc/75/59/91/566755991.db2.gz VPTNNYOFMOMKDG-UHFFFAOYSA-N 0 0 381.230 3.154 20 5 GGBDRN CCn1cc(S(=O)(=O)N(CC(C)C)c2ccccc2Cl)c([N+](=O)[O-])n1 ZINC000451102141 566758452 /nfs/dbraw/zinc/75/84/52/566758452.db2.gz IEDMNYRLCVSSCY-UHFFFAOYSA-N 0 0 386.861 3.316 20 5 GGBDRN O=[N+]([O-])c1cccc(CNS(=O)(=O)c2csc(-c3ccccc3)n2)c1 ZINC000609333920 566758724 /nfs/dbraw/zinc/75/87/24/566758724.db2.gz SAEGPUFSDNKIBN-UHFFFAOYSA-N 0 0 375.431 3.197 20 5 GGBDRN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541925119 566759407 /nfs/dbraw/zinc/75/94/07/566759407.db2.gz UFMHNFLYZMJJBX-SECBINFHSA-N 0 0 397.204 3.066 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)c1 ZINC000488998005 566762008 /nfs/dbraw/zinc/76/20/08/566762008.db2.gz AMOVEWRIGXDXRG-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CNCc2ncccc2F)c1 ZINC000562071630 566762276 /nfs/dbraw/zinc/76/22/76/566762276.db2.gz ITTKILAEBHJOIG-UHFFFAOYSA-N 0 0 387.152 3.023 20 5 GGBDRN C[C@H]1CC[C@H](NS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000609387857 566762618 /nfs/dbraw/zinc/76/26/18/566762618.db2.gz LFCXVSHKRKJJRJ-HOMQSWHASA-N 0 0 377.260 3.214 20 5 GGBDRN O=C(N[C@H](CCO)c1ccccc1Br)c1ccc([N+](=O)[O-])cc1F ZINC000541979369 566763874 /nfs/dbraw/zinc/76/38/74/566763874.db2.gz DSKPAXZLUOOXAP-OAHLLOKOSA-N 0 0 397.200 3.350 20 5 GGBDRN CC[C@@H]1CCCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000609418443 566763966 /nfs/dbraw/zinc/76/39/66/566763966.db2.gz ZWHGJMPUVDWQNG-SNVBAGLBSA-N 0 0 377.260 3.168 20 5 GGBDRN Cc1cccc2c1CCN2S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000609411247 566764015 /nfs/dbraw/zinc/76/40/15/566764015.db2.gz MNJZENQVIKGXOG-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN O=C(N[C@@H](CCO)c1ccccc1Br)c1ccc([N+](=O)[O-])cc1F ZINC000541979368 566763926 /nfs/dbraw/zinc/76/39/26/566763926.db2.gz DSKPAXZLUOOXAP-HNNXBMFYSA-N 0 0 397.200 3.350 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCNS(=O)(=O)c2cc(Cl)sc2Cl)cc1 ZINC000609465946 566765094 /nfs/dbraw/zinc/76/50/94/566765094.db2.gz OOWSALVGDNYAFZ-UHFFFAOYSA-N 0 0 397.261 3.320 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCc2n[nH]cc2Br)cc1[N+](=O)[O-] ZINC000609459709 566765166 /nfs/dbraw/zinc/76/51/66/566765166.db2.gz NVADGVCEDBMBAF-UHFFFAOYSA-N 0 0 381.230 3.308 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)Nc2ccc(Br)cc2)n1 ZINC000541983460 566765907 /nfs/dbraw/zinc/76/59/07/566765907.db2.gz NZPQZJKRLLUWEA-UHFFFAOYSA-N 0 0 380.198 3.387 20 5 GGBDRN CCC[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)OCC ZINC000516537037 566767533 /nfs/dbraw/zinc/76/75/33/566767533.db2.gz WWLGELSXSREFQP-SNVBAGLBSA-N 0 0 387.230 3.067 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCSCCOc2cccc(Br)c2)nc1 ZINC000609513707 566768184 /nfs/dbraw/zinc/76/81/84/566768184.db2.gz FDIUWMCTSKAMBE-UHFFFAOYSA-N 0 0 398.282 3.398 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2Br)C1)c1ccccc1[N+](=O)[O-] ZINC000609509158 566768316 /nfs/dbraw/zinc/76/83/16/566768316.db2.gz JMNSNGIFVYMCBM-LBPRGKRZSA-N 0 0 390.237 3.366 20 5 GGBDRN CN(Cc1ccccc1Br)C(=O)CCNc1cccnc1[N+](=O)[O-] ZINC000609513077 566768367 /nfs/dbraw/zinc/76/83/67/566768367.db2.gz PMNCDMRMONYFIH-UHFFFAOYSA-N 0 0 393.241 3.213 20 5 GGBDRN Cc1cc(Br)ccc1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000609528326 566768717 /nfs/dbraw/zinc/76/87/17/566768717.db2.gz WUUKCEOYSKFBRH-UHFFFAOYSA-N 0 0 389.209 3.472 20 5 GGBDRN Cc1ccc(C(=O)N(CCO)Cc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000489091033 566769790 /nfs/dbraw/zinc/76/97/90/566769790.db2.gz LODXKJAQPSFVQC-UHFFFAOYSA-N 0 0 393.237 3.300 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCc3c(Br)cccc3[C@@H]2C)n1 ZINC000427372509 566770564 /nfs/dbraw/zinc/77/05/64/566770564.db2.gz NZAOACNOYKPIJI-JTQLQIEISA-N 0 0 393.241 3.333 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc2cc(Br)ccc2[nH]1 ZINC000427376087 566770752 /nfs/dbraw/zinc/77/07/52/566770752.db2.gz KGGLLRCKZPMKNK-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N(CCO)Cc1cccc(Br)c1 ZINC000489106814 566771303 /nfs/dbraw/zinc/77/13/03/566771303.db2.gz XNSYDNPXJYZSGW-UHFFFAOYSA-N 0 0 385.239 3.054 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCc3ccc(Br)cc32)c1 ZINC000609571397 566771523 /nfs/dbraw/zinc/77/15/23/566771523.db2.gz NZOADENCZUMWFR-OAHLLOKOSA-N 0 0 393.237 3.160 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCC(CCCO)CC1 ZINC000542056417 566772429 /nfs/dbraw/zinc/77/24/29/566772429.db2.gz JTVKUNQMOLSURB-UHFFFAOYSA-N 0 0 397.280 3.075 20 5 GGBDRN CS(=O)(=O)c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000469216917 566772851 /nfs/dbraw/zinc/77/28/51/566772851.db2.gz SLUVZCOHZYEWAK-UHFFFAOYSA-N 0 0 389.842 3.035 20 5 GGBDRN C[C@@H](CCc1ccc(Br)cc1)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000516632476 566773589 /nfs/dbraw/zinc/77/35/89/566773589.db2.gz NBBUYBGTBDCWNG-NSHDSACASA-N 0 0 380.242 3.447 20 5 GGBDRN CC(C)(CNc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccccc1Br ZINC000562235402 566773687 /nfs/dbraw/zinc/77/36/87/566773687.db2.gz CNDNZDRLHJFKFP-UHFFFAOYSA-N 0 0 393.241 3.241 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSCc1cn(-c2ccc(F)c(Cl)c2)nn1 ZINC000542104234 566774909 /nfs/dbraw/zinc/77/49/09/566774909.db2.gz BMUDJHBBONRAMZ-UHFFFAOYSA-N 0 0 382.808 3.135 20 5 GGBDRN CCOc1cccc([C@@H]2C[C@@H]2Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000542119859 566775003 /nfs/dbraw/zinc/77/50/03/566775003.db2.gz MKYMIJMOZBAOFT-STQMWFEESA-N 0 0 382.463 3.427 20 5 GGBDRN 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GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000610338367 566825413 /nfs/dbraw/zinc/82/54/13/566825413.db2.gz MERTVBPRIPFUSW-ZDUSSCGKSA-N 0 0 389.271 3.229 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(CC2CC2)C(C)C)cc1[N+](=O)[O-] ZINC000610338292 566825353 /nfs/dbraw/zinc/82/53/53/566825353.db2.gz LRWNVJKBLHUAQB-UHFFFAOYSA-N 0 0 391.287 3.475 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2cc3c(s2)CCCC3)cc1 ZINC000542797473 566827739 /nfs/dbraw/zinc/82/77/39/566827739.db2.gz KJYULGJJWGIDLX-UHFFFAOYSA-N 0 0 380.491 3.197 20 5 GGBDRN O=C1C[C@H](Nc2nc3sccn3c2[N+](=O)[O-])CN1c1ccccc1Cl ZINC000517490209 566828516 /nfs/dbraw/zinc/82/85/16/566828516.db2.gz AHGAQCHRTGHNOM-VIFPVBQESA-N 0 0 377.813 3.175 20 5 GGBDRN Cc1cccc(CNC(=O)COc2cccc([N+](=O)[O-])c2)c1Br ZINC000469944489 566828695 /nfs/dbraw/zinc/82/86/95/566828695.db2.gz QRNARSAKCLTBPU-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(Sc2cc3c(cc2Cl)OCCO3)n1 ZINC000562864554 566828845 /nfs/dbraw/zinc/82/88/45/566828845.db2.gz FTITURJMPYXKGZ-UHFFFAOYSA-N 0 0 382.781 3.352 20 5 GGBDRN C[C@@H](N(C)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(C)(C)C ZINC000517495809 566829395 /nfs/dbraw/zinc/82/93/95/566829395.db2.gz AXYUWPPRXGNSAA-SECBINFHSA-N 0 0 379.276 3.412 20 5 GGBDRN O=C(CCC(F)(F)F)N1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000562869505 566830810 /nfs/dbraw/zinc/83/08/10/566830810.db2.gz OESOFEMXIIYFNJ-SECBINFHSA-N 0 0 380.754 3.389 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000490132789 566832046 /nfs/dbraw/zinc/83/20/46/566832046.db2.gz LMZDYQJEBQZGER-ZJUUUORDSA-N 0 0 381.376 3.023 20 5 GGBDRN O=[N+]([O-])c1ccn(CCN2CCc3[nH]c4c(cccc4Br)c3C2)n1 ZINC000610485101 566835209 /nfs/dbraw/zinc/83/52/09/566835209.db2.gz UGXCCBOMKJZZHM-UHFFFAOYSA-N 0 0 390.241 3.093 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CC[C@@H](C2CC2)C1 ZINC000490194042 566835357 /nfs/dbraw/zinc/83/53/57/566835357.db2.gz SDQIDKMYIBGJRL-SNVBAGLBSA-N 0 0 386.189 3.072 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 ZINC000582143957 566835464 /nfs/dbraw/zinc/83/54/64/566835464.db2.gz QKZBBUOAIRLYPJ-CYBMUJFWSA-N 0 0 381.479 3.230 20 5 GGBDRN Cc1cccc(C(=O)N(CCO)Cc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000490211086 566837047 /nfs/dbraw/zinc/83/70/47/566837047.db2.gz VMMWOXIOWMBQLD-UHFFFAOYSA-N 0 0 393.237 3.300 20 5 GGBDRN C[C@H]1CC[C@H](N(C)S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000428392785 566837750 /nfs/dbraw/zinc/83/77/50/566837750.db2.gz KSOWHEGAMWGOKT-ONGXEEELSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@H]1CC[C@@H](N(C)S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000428391239 566837860 /nfs/dbraw/zinc/83/78/60/566837860.db2.gz WLYCFSQPIYMXEY-GXSJLCMTSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@@H]1CC[C@@H](N(C)S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000428391241 566837869 /nfs/dbraw/zinc/83/78/69/566837869.db2.gz WLYCFSQPIYMXEY-MWLCHTKSSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@@H]1CC[C@@H](N(C)S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000428392784 566837963 /nfs/dbraw/zinc/83/79/63/566837963.db2.gz KSOWHEGAMWGOKT-MWLCHTKSSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@H]1CC[C@H](N(C)S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000428391243 566838067 /nfs/dbraw/zinc/83/80/67/566838067.db2.gz WLYCFSQPIYMXEY-ONGXEEELSA-N 0 0 377.260 3.166 20 5 GGBDRN NS(=O)(=O)c1c(NC[C@@H]2CCCC[C@@H]2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000610510570 566838471 /nfs/dbraw/zinc/83/84/71/566838471.db2.gz ADMIIRXZXLSCRD-UWVGGRQHSA-N 0 0 381.376 3.023 20 5 GGBDRN Cc1nccc([C@H]2CCCN(c3ncc([N+](=O)[O-])cc3Br)C2)n1 ZINC000610512437 566838687 /nfs/dbraw/zinc/83/86/87/566838687.db2.gz MGFPMSIASBMWNW-NSHDSACASA-N 0 0 378.230 3.235 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)[C@@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000428397126 566839401 /nfs/dbraw/zinc/83/94/01/566839401.db2.gz GYYAFDBCGUJADT-MWLCHTKSSA-N 0 0 391.287 3.475 20 5 GGBDRN Nc1c(C(=O)NCCCc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000610522688 566840138 /nfs/dbraw/zinc/84/01/38/566840138.db2.gz KGBDMYKPENMZRY-UHFFFAOYSA-N 0 0 378.226 3.302 20 5 GGBDRN Cc1nn(C)c2ncc(NC(=O)c3ccc(Br)cc3[N+](=O)[O-])cc12 ZINC000610570517 566843057 /nfs/dbraw/zinc/84/30/57/566843057.db2.gz SUNWBECOQSJDOV-UHFFFAOYSA-N 0 0 390.197 3.200 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000610571965 566843787 /nfs/dbraw/zinc/84/37/87/566843787.db2.gz SBEZKWWISCYWJZ-SNVBAGLBSA-N 0 0 379.214 3.100 20 5 GGBDRN Cc1nc([C@H]2CCCCN2C(=O)c2ccc(Br)cc2[N+](=O)[O-])no1 ZINC000610571204 566843947 /nfs/dbraw/zinc/84/39/47/566843947.db2.gz ZBUHZMRGSJBMGQ-GFCCVEGCSA-N 0 0 395.213 3.416 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H](C(F)(F)F)O1 ZINC000610572687 566844252 /nfs/dbraw/zinc/84/42/52/566844252.db2.gz PVOOPMPGNQJVMY-HQJQHLMTSA-N 0 0 397.147 3.149 20 5 GGBDRN CC(C)Nc1ccc(Br)cc1NC(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000470091694 566844872 /nfs/dbraw/zinc/84/48/72/566844872.db2.gz IDIOPIWNTOVMGT-UHFFFAOYSA-N 0 0 382.218 3.013 20 5 GGBDRN CC(C)Nc1ccc(Br)cc1NC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000470109024 566846328 /nfs/dbraw/zinc/84/63/28/566846328.db2.gz GUDWVJYYKMHTPD-UHFFFAOYSA-N 0 0 382.218 3.013 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1c(F)c(F)cc(F)c1F ZINC000610591636 566846448 /nfs/dbraw/zinc/84/64/48/566846448.db2.gz AZAIJDIEFGYNQT-UHFFFAOYSA-N 0 0 398.721 3.283 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000563054221 566848716 /nfs/dbraw/zinc/84/87/16/566848716.db2.gz UIVPRQSTQUAWHS-LBPRGKRZSA-N 0 0 382.825 3.203 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000470135731 566849668 /nfs/dbraw/zinc/84/96/68/566849668.db2.gz ZCFXPUSWSAUCNK-IINYFYTJSA-N 0 0 380.447 3.167 20 5 GGBDRN CCSc1cccc(CNS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000490433244 566850483 /nfs/dbraw/zinc/85/04/83/566850483.db2.gz BNRZDRHDKFJUBX-UHFFFAOYSA-N 0 0 382.463 3.194 20 5 GGBDRN Cc1cc(N2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c(Br)cc1[N+](=O)[O-] ZINC000517847258 566850904 /nfs/dbraw/zinc/85/09/04/566850904.db2.gz ZJNUWCFXENOPRF-MQIPJXDCSA-N 0 0 385.258 3.438 20 5 GGBDRN Cc1ccoc1CN(C)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000490444576 566851817 /nfs/dbraw/zinc/85/18/17/566851817.db2.gz DXFMXJKOVFPPKM-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC(=O)Nc2c(F)cccc21 ZINC000543109651 566852888 /nfs/dbraw/zinc/85/28/88/566852888.db2.gz RBNOACIFQLDLQU-UHFFFAOYSA-N 0 0 394.156 3.095 20 5 GGBDRN Cc1noc([C@H]2CCCCN2C(=O)c2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000582352696 566854373 /nfs/dbraw/zinc/85/43/73/566854373.db2.gz UHTCTHSZTULWHH-GFCCVEGCSA-N 0 0 395.213 3.416 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1ccc(Cl)cc1 ZINC000517913039 566855078 /nfs/dbraw/zinc/85/50/78/566855078.db2.gz WNXIFLOGGRFAAA-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=c1c2cc(Br)c(F)cc2ncn1Cc1cccc([N+](=O)[O-])c1 ZINC000543145972 566855469 /nfs/dbraw/zinc/85/54/69/566855469.db2.gz QRNZGEPUPSPOKY-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1COc2c1cccc2Cl ZINC000610711745 566855607 /nfs/dbraw/zinc/85/56/07/566855607.db2.gz BDYJWPBBYSRSEO-LLVKDONJSA-N 0 0 389.216 3.314 20 5 GGBDRN CS(=O)(=O)C[C@@H]1CCCCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000451648597 566855612 /nfs/dbraw/zinc/85/56/12/566855612.db2.gz FIJXOLGAXMXYGM-ZDUSSCGKSA-N 0 0 380.388 3.013 20 5 GGBDRN CNc1nccc(C(=O)N[C@H](C)Cc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000517959679 566856341 /nfs/dbraw/zinc/85/63/41/566856341.db2.gz JHMGGPBYAUCOBT-SECBINFHSA-N 0 0 383.235 3.121 20 5 GGBDRN CNc1nccc(C(=O)N[C@@H](C)Cc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000517959680 566856354 /nfs/dbraw/zinc/85/63/54/566856354.db2.gz JHMGGPBYAUCOBT-VIFPVBQESA-N 0 0 383.235 3.121 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCc2c(F)cc(Br)cc2C1 ZINC000610727890 566856821 /nfs/dbraw/zinc/85/68/21/566856821.db2.gz GMSSDTIWUOJHFP-UHFFFAOYSA-N 0 0 382.189 3.033 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CN(c3ccc(F)cc3)C2=O)ncc1[N+](=O)[O-] ZINC000518007540 566859281 /nfs/dbraw/zinc/85/92/81/566859281.db2.gz KLNYTOFSAMZOSQ-LLVKDONJSA-N 0 0 395.188 3.027 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1nc2cc(Cl)ccc2s1 ZINC000518003395 566859549 /nfs/dbraw/zinc/85/95/49/566859549.db2.gz YDMBQEYWCPCIAZ-UHFFFAOYSA-N 0 0 383.838 3.336 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N(C2CCC2)C2CCC2)c1 ZINC000490510936 566860231 /nfs/dbraw/zinc/86/02/31/566860231.db2.gz YXDPTMHZIHUBJE-UHFFFAOYSA-N 0 0 389.271 3.453 20 5 GGBDRN CC[C@@H]1CCCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000582435942 566861223 /nfs/dbraw/zinc/86/12/23/566861223.db2.gz YZUGOBJBILPUJY-LLVKDONJSA-N 0 0 398.257 3.335 20 5 GGBDRN Cc1nccc([C@@H]2CCCN(c3ncc(Br)cc3[N+](=O)[O-])C2)n1 ZINC000610769650 566861463 /nfs/dbraw/zinc/86/14/63/566861463.db2.gz NOVCRNFMYMLSSI-LLVKDONJSA-N 0 0 378.230 3.235 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000490523943 566861958 /nfs/dbraw/zinc/86/19/58/566861958.db2.gz KTNFZVBWLNQFRP-LLVKDONJSA-N 0 0 382.825 3.220 20 5 GGBDRN CN(CCc1ccc(Br)cc1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000518047497 566862779 /nfs/dbraw/zinc/86/27/79/566862779.db2.gz SOBFFZZCSRHRGM-UHFFFAOYSA-N 0 0 378.226 3.135 20 5 GGBDRN O=C(N[C@@H]1CCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1I ZINC000610792485 566863568 /nfs/dbraw/zinc/86/35/68/566863568.db2.gz WXNDSFVFGCPBPJ-SSDOTTSWSA-N 0 0 396.131 3.117 20 5 GGBDRN COCc1ccc(Sc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])cc1 ZINC000610786354 566863684 /nfs/dbraw/zinc/86/36/84/566863684.db2.gz LLSAFMASQUAHND-UHFFFAOYSA-N 0 0 382.463 3.143 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C)c1ccccc1Cl ZINC000610786540 566864231 /nfs/dbraw/zinc/86/42/31/566864231.db2.gz FPEGKRSMZOGESI-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN O=C(N[C@H]1CCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1I ZINC000610792486 566865856 /nfs/dbraw/zinc/86/58/56/566865856.db2.gz WXNDSFVFGCPBPJ-ZETCQYMHSA-N 0 0 396.131 3.117 20 5 GGBDRN Cc1ccnc(NC[C@H](CO)Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000428667386 566866296 /nfs/dbraw/zinc/86/62/96/566866296.db2.gz VIZUHFBBMLISRN-GFCCVEGCSA-N 0 0 380.242 3.324 20 5 GGBDRN Cc1ccnc(NC[C@@H](CO)Cc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000428666100 566866416 /nfs/dbraw/zinc/86/64/16/566866416.db2.gz GAXYYBARNCPZDP-ZDUSSCGKSA-N 0 0 380.242 3.324 20 5 GGBDRN Cc1ccnc(NC[C@H](CO)Cc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000428666098 566866970 /nfs/dbraw/zinc/86/69/70/566866970.db2.gz GAXYYBARNCPZDP-CYBMUJFWSA-N 0 0 380.242 3.324 20 5 GGBDRN Cc1ccnc(NC[C@H](CO)Cc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000428674316 566868004 /nfs/dbraw/zinc/86/80/04/566868004.db2.gz IHJBYTLTUBXCOV-CYBMUJFWSA-N 0 0 380.242 3.324 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@]1(CO)C[C@@H]1c1ccc(F)cc1 ZINC000428688999 566869589 /nfs/dbraw/zinc/86/95/89/566869589.db2.gz IEVOGPAHVUYFOG-CJNGLKHVSA-N 0 0 396.216 3.470 20 5 GGBDRN CSc1ccc(F)cc1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000582541744 566871849 /nfs/dbraw/zinc/87/18/49/566871849.db2.gz PFOPNMNJQVRDGD-UHFFFAOYSA-N 0 0 384.454 3.019 20 5 GGBDRN CC1(CNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CCCC1 ZINC000518215965 566872123 /nfs/dbraw/zinc/87/21/23/566872123.db2.gz DGTRWHKNIWZRFZ-UHFFFAOYSA-N 0 0 377.260 3.216 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](C)[C@@H]2OCCc3sccc32)cc1[N+](=O)[O-] ZINC000490624821 566872331 /nfs/dbraw/zinc/87/23/31/566872331.db2.gz BFRPKTLIRCTWBL-CLAHSXSESA-N 0 0 388.492 3.007 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OCc1nc(-c2ccccn2)no1 ZINC000610898339 566872541 /nfs/dbraw/zinc/87/25/41/566872541.db2.gz MJNNSVHCDDUJPQ-UHFFFAOYSA-N 0 0 377.154 3.381 20 5 GGBDRN CC(C)Oc1ncccc1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000610899987 566872962 /nfs/dbraw/zinc/87/29/62/566872962.db2.gz JHYPHGLMNVCOSC-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN C[C@H](CN(C)C(=O)c1cc([N+](=O)[O-])ccc1SCCO)c1nccs1 ZINC000543375815 566873281 /nfs/dbraw/zinc/87/32/81/566873281.db2.gz NNQLSIJMZGHPQI-LLVKDONJSA-N 0 0 381.479 3.011 20 5 GGBDRN COc1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(OC)n1 ZINC000610904189 566874342 /nfs/dbraw/zinc/87/43/42/566874342.db2.gz LFBLBRNGOSITSA-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H](C(F)(F)F)O1 ZINC000610906197 566874655 /nfs/dbraw/zinc/87/46/55/566874655.db2.gz XMANYDUYVAQADU-CPCISQLKSA-N 0 0 397.147 3.149 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCc3sc(Br)cc3C2)c1[N+](=O)[O-] ZINC000610938086 566875659 /nfs/dbraw/zinc/87/56/59/566875659.db2.gz OZLHVNCSTCOKIY-UHFFFAOYSA-N 0 0 399.270 3.464 20 5 GGBDRN COc1cc(Br)ccc1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000518309127 566876042 /nfs/dbraw/zinc/87/60/42/566876042.db2.gz JGZZKMZKGSAUCI-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN CC[C@H](Cc1ccc(Cl)cc1)Nc1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000582574426 566876160 /nfs/dbraw/zinc/87/61/60/566876160.db2.gz GEHFYLHROBVTGI-CYBMUJFWSA-N 0 0 383.857 3.329 20 5 GGBDRN CCN(Cc1ccoc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000610956842 566877118 /nfs/dbraw/zinc/87/71/18/566877118.db2.gz OKBJDVGMXOVTLC-UHFFFAOYSA-N 0 0 389.227 3.161 20 5 GGBDRN CN(Cc1ccsc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000610955460 566877428 /nfs/dbraw/zinc/87/74/28/566877428.db2.gz BYSBHTPBKLICJQ-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN CC(C)c1cnc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)s1 ZINC000543393661 566877602 /nfs/dbraw/zinc/87/76/02/566877602.db2.gz IMFAVEKXCFTEHL-UHFFFAOYSA-N 0 0 380.495 3.194 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC(CF)CC2)cc1[N+](=O)[O-] ZINC000451768152 566878971 /nfs/dbraw/zinc/87/89/71/566878971.db2.gz HKOZPJLJPJZPTN-UHFFFAOYSA-N 0 0 395.250 3.036 20 5 GGBDRN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H](CO)c3ccc(Br)cc3)nc2c1 ZINC000428791864 566879582 /nfs/dbraw/zinc/87/95/82/566879582.db2.gz UUFYMUWCOXDTOI-HNNXBMFYSA-N 0 0 391.225 3.057 20 5 GGBDRN COc1ccc(CSCC(=O)Nc2cccc(SC)n2)cc1[N+](=O)[O-] ZINC000582631010 566880554 /nfs/dbraw/zinc/88/05/54/566880554.db2.gz BIBWVFANGCLGLO-UHFFFAOYSA-N 0 0 379.463 3.014 20 5 GGBDRN Cc1c(Br)c(N[C@@H](CO)c2c(F)cccc2F)ncc1[N+](=O)[O-] ZINC000543436096 566880878 /nfs/dbraw/zinc/88/08/78/566880878.db2.gz GIHJHWSUHUNBBW-JTQLQIEISA-N 0 0 388.168 3.484 20 5 GGBDRN CC(=O)Nc1ccc(CCNc2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000543436486 566882518 /nfs/dbraw/zinc/88/25/18/566882518.db2.gz ISEXIQOLEJWGBW-UHFFFAOYSA-N 0 0 393.241 3.096 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)c2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000543449488 566882580 /nfs/dbraw/zinc/88/25/80/566882580.db2.gz NJMQCOIOMMOHAR-UHFFFAOYSA-N 0 0 393.241 3.444 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@@H]1c1ccc(O)cc1 ZINC000611019722 566883769 /nfs/dbraw/zinc/88/37/69/566883769.db2.gz CTSAQDGYQSVBMA-CQSZACIVSA-N 0 0 382.825 3.480 20 5 GGBDRN Cc1csc(CCNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000611072458 566886398 /nfs/dbraw/zinc/88/63/98/566886398.db2.gz KDZKCAGAYCUZBN-UHFFFAOYSA-N 0 0 384.255 3.403 20 5 GGBDRN COc1cccc2c1CC[C@@H]2NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000470610296 566886924 /nfs/dbraw/zinc/88/69/24/566886924.db2.gz DJTBIIWQKPPSHY-ZDUSSCGKSA-N 0 0 382.825 3.223 20 5 GGBDRN COc1cccc2c1CC[C@H]2NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000470610295 566887126 /nfs/dbraw/zinc/88/71/26/566887126.db2.gz DJTBIIWQKPPSHY-CYBMUJFWSA-N 0 0 382.825 3.223 20 5 GGBDRN Cc1ccc(C(=O)N2CCOc3ncc(Br)cc32)cc1[N+](=O)[O-] ZINC000543502164 566887193 /nfs/dbraw/zinc/88/71/93/566887193.db2.gz QAJSHPMBKGTAAG-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN CC(C)(Cc1ccc(Br)cc1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000582717907 566887208 /nfs/dbraw/zinc/88/72/08/566887208.db2.gz FJPYRMIBGNGPBB-UHFFFAOYSA-N 0 0 393.241 3.284 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)NC[C@@H]1CCCC1(F)F ZINC000451820055 566887333 /nfs/dbraw/zinc/88/73/33/566887333.db2.gz CKVIMVBKISRWQU-QMMMGPOBSA-N 0 0 399.213 3.071 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)NC[C@H]1CCCC1(F)F ZINC000451820054 566887372 /nfs/dbraw/zinc/88/73/72/566887372.db2.gz CKVIMVBKISRWQU-MRVPVSSYSA-N 0 0 399.213 3.071 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cn1 ZINC000611073684 566887536 /nfs/dbraw/zinc/88/75/36/566887536.db2.gz HEHRIIUBMSJIGT-UHFFFAOYSA-N 0 0 394.225 3.342 20 5 GGBDRN COC(=O)C[C@H]1CCCCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000611073071 566887946 /nfs/dbraw/zinc/88/79/46/566887946.db2.gz ZKBSPFJHGMVMER-GFCCVEGCSA-N 0 0 399.241 3.224 20 5 GGBDRN COC(=O)c1c(C)c(C)sc1NC(=O)CSc1ncccc1[N+](=O)[O-] ZINC000518520957 566888539 /nfs/dbraw/zinc/88/85/39/566888539.db2.gz WOVZGHMTLVRCKX-UHFFFAOYSA-N 0 0 381.435 3.186 20 5 GGBDRN CCn1cc(S(=O)(=O)N[C@H](c2ccc(Cl)cc2)C(C)C)c([N+](=O)[O-])n1 ZINC000611104828 566889208 /nfs/dbraw/zinc/88/92/08/566889208.db2.gz OCULIVGROVCHBG-AWEZNQCLSA-N 0 0 386.861 3.140 20 5 GGBDRN Cc1c(C(=O)N2CCOc3ncc(Br)cc32)cccc1[N+](=O)[O-] ZINC000543560771 566889324 /nfs/dbraw/zinc/88/93/24/566889324.db2.gz ASJLFMNUIKAQQK-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN COc1cc(C(=O)Nc2ncc(C)cc2Br)cc([N+](=O)[O-])c1OC ZINC000611094517 566889931 /nfs/dbraw/zinc/88/99/31/566889931.db2.gz NOUVSXSTWLTIDO-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN CCn1cc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2Cl)c([N+](=O)[O-])n1 ZINC000611107602 566890759 /nfs/dbraw/zinc/89/07/59/566890759.db2.gz WAZYTYQAIHJTKK-MRVPVSSYSA-N 0 0 393.252 3.158 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)NC[C@H]2CCCC2(F)F)c1 ZINC000451830882 566890877 /nfs/dbraw/zinc/89/08/77/566890877.db2.gz YUINMGVSSNTLFH-MRVPVSSYSA-N 0 0 399.213 3.071 20 5 GGBDRN CC(C)CSCCNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000611118329 566891709 /nfs/dbraw/zinc/89/17/09/566891709.db2.gz CMHWFNBQVXLWJQ-UHFFFAOYSA-N 0 0 397.316 3.025 20 5 GGBDRN CCO[C@@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451836022 566892295 /nfs/dbraw/zinc/89/22/95/566892295.db2.gz GNOOPXPTETYCQZ-TVQRCGJNSA-N 0 0 397.280 3.337 20 5 GGBDRN COc1ccsc1S(=O)(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451842072 566893025 /nfs/dbraw/zinc/89/30/25/566893025.db2.gz FTCHBWCGKMAYPC-CYBMUJFWSA-N 0 0 382.463 3.233 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000518595169 566893983 /nfs/dbraw/zinc/89/39/83/566893983.db2.gz NDJJDQBTVUVVKV-QWHCGFSZSA-N 0 0 397.250 3.192 20 5 GGBDRN COc1ccc2[nH]cc(CCNc3c(Br)cncc3[N+](=O)[O-])c2c1 ZINC000611153134 566894868 /nfs/dbraw/zinc/89/48/68/566894868.db2.gz JBWRBCVOARTSEC-UHFFFAOYSA-N 0 0 391.225 3.319 20 5 GGBDRN COc1cccc(OC(F)(F)F)c1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000582802281 566895331 /nfs/dbraw/zinc/89/53/31/566895331.db2.gz SVIUWLBFDSBMCM-UHFFFAOYSA-N 0 0 376.312 3.494 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCc1cnn2ccccc12 ZINC000563552682 566895402 /nfs/dbraw/zinc/89/54/02/566895402.db2.gz YTMZTTNMALXYGY-UHFFFAOYSA-N 0 0 394.172 3.459 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N[C@H]1CCC[C@@H]1CCO ZINC000491121114 566895922 /nfs/dbraw/zinc/89/59/22/566895922.db2.gz FVOUGHLUTNEVHS-MFKMUULPSA-N 0 0 380.242 3.290 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)c1ccc(Br)c(F)c1 ZINC000428995302 566896684 /nfs/dbraw/zinc/89/66/84/566896684.db2.gz AAJBQBQLVPIXEN-HNNXBMFYSA-N 0 0 399.216 3.328 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000470719335 566897808 /nfs/dbraw/zinc/89/78/08/566897808.db2.gz FHOJPSFWVVVEGB-JTQLQIEISA-N 0 0 385.207 3.227 20 5 GGBDRN CC(C)[C@@H]1CCCN1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000518704327 566898124 /nfs/dbraw/zinc/89/81/24/566898124.db2.gz GUTYAPMOTRTTFY-ZDUSSCGKSA-N 0 0 377.260 3.166 20 5 GGBDRN CCN(Cc1cccs1)C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000518654661 566898759 /nfs/dbraw/zinc/89/87/59/566898759.db2.gz NEKVOSHIPNLVLJ-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN Cc1n[nH]c(C(=O)N(C)C[C@@H](C)Oc2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000470733665 566899092 /nfs/dbraw/zinc/89/90/92/566899092.db2.gz SYQMNAVDSBIENL-MRVPVSSYSA-N 0 0 387.223 3.473 20 5 GGBDRN O=C(NC[C@@]1(O)CCSC1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611211351 566900373 /nfs/dbraw/zinc/90/03/73/566900373.db2.gz KRYNATVQOYYKRL-KRWDZBQOSA-N 0 0 382.507 3.227 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1CN[C@H](CO)c1ccc(Br)c(F)c1 ZINC000429018534 566901182 /nfs/dbraw/zinc/90/11/82/566901182.db2.gz IQZUNDNQGSTPSD-OAHLLOKOSA-N 0 0 399.216 3.328 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1CN[C@@H](CO)c1ccc(Br)c(F)c1 ZINC000429022443 566901324 /nfs/dbraw/zinc/90/13/24/566901324.db2.gz SEOXFSBPEKIFFF-AWEZNQCLSA-N 0 0 387.180 3.459 20 5 GGBDRN NS(=O)(=O)c1cccc(NCc2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000543693510 566901680 /nfs/dbraw/zinc/90/16/80/566901680.db2.gz RISUBULLOAHTEF-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN C[C@H](Cc1ccccc1Br)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000470760343 566901778 /nfs/dbraw/zinc/90/17/78/566901778.db2.gz PEABUYYHXWMOEJ-SNVBAGLBSA-N 0 0 378.226 3.301 20 5 GGBDRN C[S@](=O)c1ccc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000611223554 566901800 /nfs/dbraw/zinc/90/18/00/566901800.db2.gz ZBVDRUJLYGZJSA-NSYGIPOTSA-N 0 0 376.459 3.220 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1CCC2(CC2)CC1 ZINC000611223193 566901916 /nfs/dbraw/zinc/90/19/16/566901916.db2.gz JGIGXKJQDDGBNR-UHFFFAOYSA-N 0 0 386.189 3.216 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCc1nc2ccccc2s1 ZINC000470773925 566903790 /nfs/dbraw/zinc/90/37/90/566903790.db2.gz QFLBGIZSOSDZKJ-UHFFFAOYSA-N 0 0 377.447 3.034 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@@H]2c2ccsc2)cc1[N+](=O)[O-] ZINC000491349444 566903999 /nfs/dbraw/zinc/90/39/99/566903999.db2.gz VBCXZROWSAAKEN-CYBMUJFWSA-N 0 0 386.426 3.330 20 5 GGBDRN COc1ccc(Br)c(CNc2cccc(C(N)=O)c2[N+](=O)[O-])c1 ZINC000518809452 566904089 /nfs/dbraw/zinc/90/40/89/566904089.db2.gz VSKAGRMPQNEPJU-UHFFFAOYSA-N 0 0 380.198 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCSC[C@@H]2C2CC2)c(C(F)(F)F)c1 ZINC000451903625 566904261 /nfs/dbraw/zinc/90/42/61/566904261.db2.gz JIZBNEHGONISBH-GFCCVEGCSA-N 0 0 396.412 3.130 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000491470778 566905813 /nfs/dbraw/zinc/90/58/13/566905813.db2.gz UIZWOXAYHMHVDB-IINYFYTJSA-N 0 0 380.447 3.167 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCSC[C@@H]1C1CC1 ZINC000451913511 566906487 /nfs/dbraw/zinc/90/64/87/566906487.db2.gz SSMSPQLMTDBQHK-GFCCVEGCSA-N 0 0 397.305 3.418 20 5 GGBDRN CC[C@H]1CCCC[C@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000563680108 566907351 /nfs/dbraw/zinc/90/73/51/566907351.db2.gz NGTIDPHXTAMDIL-IINYFYTJSA-N 0 0 398.257 3.381 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491512140 566907724 /nfs/dbraw/zinc/90/77/24/566907724.db2.gz MIOFPIYPALENAT-MNOVXSKESA-N 0 0 392.474 3.037 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)c1ccc(Br)cn1 ZINC000470833518 566908227 /nfs/dbraw/zinc/90/82/27/566908227.db2.gz WEAZFXSQJHOMFP-UHFFFAOYSA-N 0 0 380.198 3.428 20 5 GGBDRN CCS[C@H]1CCC[C@@H](NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491533802 566908346 /nfs/dbraw/zinc/90/83/46/566908346.db2.gz SQWRDRKPBNOLIY-MNOVXSKESA-N 0 0 392.474 3.085 20 5 GGBDRN CCN(Cc1cccc(Br)c1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000543766860 566909020 /nfs/dbraw/zinc/90/90/20/566909020.db2.gz OTCURZGJRUSEKF-UHFFFAOYSA-N 0 0 379.214 3.228 20 5 GGBDRN CC[C@H]1CN(CC)CCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000451927970 566910099 /nfs/dbraw/zinc/91/00/99/566910099.db2.gz CRGAAEKAXZVVQS-NSHDSACASA-N 0 0 396.296 3.006 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N(C)[C@@H](C)CCSC)c([N+](=O)[O-])c1 ZINC000470870487 566910983 /nfs/dbraw/zinc/91/09/83/566910983.db2.gz XWKTYSKTHZULEI-ZDUSSCGKSA-N 0 0 389.543 3.203 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@H]1Cc2cc(Br)ccc2O1 ZINC000470867919 566911846 /nfs/dbraw/zinc/91/18/46/566911846.db2.gz HAGMLBRRCDOGLR-CQSZACIVSA-N 0 0 381.157 3.439 20 5 GGBDRN CCS[C@@H]1CCCCN(S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491590800 566912019 /nfs/dbraw/zinc/91/20/19/566912019.db2.gz DVEIHVKLWVUUDP-LLVKDONJSA-N 0 0 392.474 3.039 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000563745225 566912441 /nfs/dbraw/zinc/91/24/41/566912441.db2.gz CALLJRKERUNKGB-MWLCHTKSSA-N 0 0 381.376 3.023 20 5 GGBDRN COc1cc(Cl)ccc1S(=O)(=O)N1CCc2cc(C)c([N+](=O)[O-])cc21 ZINC000611343762 566912788 /nfs/dbraw/zinc/91/27/88/566912788.db2.gz GMUACWOUXHHGCV-UHFFFAOYSA-N 0 0 382.825 3.317 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000611343416 566912818 /nfs/dbraw/zinc/91/28/18/566912818.db2.gz GNEIYHIJBSWGFI-CHWSQXEVSA-N 0 0 388.873 3.076 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000611343419 566913368 /nfs/dbraw/zinc/91/33/68/566913368.db2.gz GNEIYHIJBSWGFI-STQMWFEESA-N 0 0 388.873 3.076 20 5 GGBDRN CCOC(=O)Cc1cc(Cl)c(=O)n(Cc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000583025179 566915329 /nfs/dbraw/zinc/91/53/29/566915329.db2.gz RHULKFMDSPPPGQ-UHFFFAOYSA-N 0 0 385.203 3.217 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CCNc2sccc2[N+](=O)[O-])s1 ZINC000611412655 566916345 /nfs/dbraw/zinc/91/63/45/566916345.db2.gz KIAHWWYWBDGPMK-UHFFFAOYSA-N 0 0 389.524 3.403 20 5 GGBDRN C[C@H]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000429252891 566917128 /nfs/dbraw/zinc/91/71/28/566917128.db2.gz IQYZEBSYSXAVND-VHSXEESVSA-N 0 0 388.205 3.460 20 5 GGBDRN CC1(C)C[C@H](O)CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000451986420 566918366 /nfs/dbraw/zinc/91/83/66/566918366.db2.gz XNYKFQHWHXFGPI-SNVBAGLBSA-N 0 0 397.280 3.073 20 5 GGBDRN O=C(Nc1cnc2c(c1)COCC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000611476207 566919599 /nfs/dbraw/zinc/91/95/99/566919599.db2.gz DKZJIYLHGRDGCI-UHFFFAOYSA-N 0 0 378.182 3.077 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC1(Cc2cccc(Cl)c2)CC1 ZINC000452007567 566921396 /nfs/dbraw/zinc/92/13/96/566921396.db2.gz QPSPHHDDGDUVOL-UHFFFAOYSA-N 0 0 380.853 3.443 20 5 GGBDRN CSc1ccccc1CN(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000471023741 566921349 /nfs/dbraw/zinc/92/13/49/566921349.db2.gz VTQAURYQPAOIIN-UHFFFAOYSA-N 0 0 380.491 3.222 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCc1nc(C(C)(C)C)cs1 ZINC000519151797 566923275 /nfs/dbraw/zinc/92/32/75/566923275.db2.gz HJQFHOHYBRZYNQ-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1Cc2cc(Br)ccc2O1 ZINC000471034970 566923644 /nfs/dbraw/zinc/92/36/44/566923644.db2.gz WUZQUBSUBNMJJB-INIZCTEOSA-N 0 0 391.221 3.020 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCCOc1ccc(Br)cc1CCO ZINC000429327478 566924037 /nfs/dbraw/zinc/92/40/37/566924037.db2.gz NFFDUCCDDNJFLV-UHFFFAOYSA-N 0 0 382.210 3.350 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cc(F)ccc3Br)CC2)cn1 ZINC000519160625 566924042 /nfs/dbraw/zinc/92/40/42/566924042.db2.gz SKIRIMATEPUTPQ-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN C[C@H](c1ccccc1)[C@@H](CO)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000611508957 566924139 /nfs/dbraw/zinc/92/41/39/566924139.db2.gz VOKMTGNGJAEFPS-BDJLRTHQSA-N 0 0 393.237 3.252 20 5 GGBDRN C[C@@H]1CC[C@H](C(F)(F)F)CN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000611542574 566927164 /nfs/dbraw/zinc/92/71/64/566927164.db2.gz QQXWRMRLYHQEOB-YPMHNXCESA-N 0 0 380.388 3.130 20 5 GGBDRN CC(C)(NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000611598808 566930065 /nfs/dbraw/zinc/93/00/65/566930065.db2.gz RLLSOZIZKZDREC-UHFFFAOYSA-N 0 0 379.214 3.231 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000492289608 566930148 /nfs/dbraw/zinc/93/01/48/566930148.db2.gz FVLLJQIRBLVFCB-UHFFFAOYSA-N 0 0 383.832 3.407 20 5 GGBDRN O=C(NCCCCn1cc(Br)cn1)Nc1cccc([N+](=O)[O-])c1 ZINC000471117952 566930702 /nfs/dbraw/zinc/93/07/02/566930702.db2.gz ZGRWRWKAGFVTCU-UHFFFAOYSA-N 0 0 382.218 3.156 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)CSc2ccccc2[N+](=O)[O-])nc1C ZINC000544045683 566931878 /nfs/dbraw/zinc/93/18/78/566931878.db2.gz RMEHIZVEUBQVOG-UHFFFAOYSA-N 0 0 381.435 3.267 20 5 GGBDRN O=[N+]([O-])c1ccc2ncnc(N[C@H](CO)c3ccc(Br)cc3)c2c1 ZINC000611712235 566933365 /nfs/dbraw/zinc/93/33/65/566933365.db2.gz IVKLXZSZIARCCW-OAHLLOKOSA-N 0 0 389.209 3.446 20 5 GGBDRN CCS(=O)(=O)c1ccc(NC(=O)CSc2ccccc2[N+](=O)[O-])cc1 ZINC000544053287 566933528 /nfs/dbraw/zinc/93/35/28/566933528.db2.gz WDJDMMXHLZMKPU-UHFFFAOYSA-N 0 0 380.447 3.119 20 5 GGBDRN O=[N+]([O-])c1ccc2ncnc(NCc3ccc(O)c(Br)c3)c2c1 ZINC000611711790 566934296 /nfs/dbraw/zinc/93/42/96/566934296.db2.gz QRNWLMAFPYVIFO-UHFFFAOYSA-N 0 0 375.182 3.040 20 5 GGBDRN COc1ccc(Br)c(CNc2ncnc3ccc([N+](=O)[O-])cc32)c1 ZINC000611700993 566934323 /nfs/dbraw/zinc/93/43/23/566934323.db2.gz LTPXFWOFLOVWQL-UHFFFAOYSA-N 0 0 389.209 3.343 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCOc3c(Cl)cccc32)c1C ZINC000471190507 566934675 /nfs/dbraw/zinc/93/46/75/566934675.db2.gz ICVFGWOCJUTANP-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCc2ccc(Br)cc21 ZINC000544070606 566934589 /nfs/dbraw/zinc/93/45/89/566934589.db2.gz CBGZZRCRRQNMCY-CQSZACIVSA-N 0 0 393.237 3.160 20 5 GGBDRN COC(=O)[C@H](C)CN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000544075501 566934720 /nfs/dbraw/zinc/93/47/20/566934720.db2.gz YEGOBIABVAXDBC-SNVBAGLBSA-N 0 0 386.857 3.140 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCc2ccc(Br)cc21 ZINC000544070605 566934846 /nfs/dbraw/zinc/93/48/46/566934846.db2.gz CBGZZRCRRQNMCY-AWEZNQCLSA-N 0 0 393.237 3.160 20 5 GGBDRN CN(CCn1cc(Br)cn1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000563993370 566935797 /nfs/dbraw/zinc/93/57/97/566935797.db2.gz GJZPWJSUHQNVKL-UHFFFAOYSA-N 0 0 391.172 3.292 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2noc(C3CCCCC3)n2)cc1[N+](=O)[O-] ZINC000544079615 566935774 /nfs/dbraw/zinc/93/57/74/566935774.db2.gz OBZQGFFXFYOMAV-UHFFFAOYSA-N 0 0 397.229 3.306 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCCc1ccc(Cl)cc1Cl ZINC000611737348 566936266 /nfs/dbraw/zinc/93/62/66/566936266.db2.gz YPGYTKFELJPGOP-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN COC[C@@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000452105556 566936570 /nfs/dbraw/zinc/93/65/70/566936570.db2.gz YWVAOOXAEUFZFV-JTQLQIEISA-N 0 0 383.253 3.091 20 5 GGBDRN O=c1c(Br)cn(CCCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000583299527 566937384 /nfs/dbraw/zinc/93/73/84/566937384.db2.gz DUFPEFJBECTLCK-UHFFFAOYSA-N 0 0 377.198 3.028 20 5 GGBDRN COC[C@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000452105557 566937723 /nfs/dbraw/zinc/93/77/23/566937723.db2.gz YWVAOOXAEUFZFV-SNVBAGLBSA-N 0 0 383.253 3.091 20 5 GGBDRN CCOC(=O)[C@H](CC)N(C(=O)c1ccc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000471260433 566938699 /nfs/dbraw/zinc/93/86/99/566938699.db2.gz PYALHBKMRAMXLL-ZDUSSCGKSA-N 0 0 399.241 3.304 20 5 GGBDRN Cn1c(C(=O)NCCc2ccc(Br)cc2Cl)ccc1[N+](=O)[O-] ZINC000564047595 566938930 /nfs/dbraw/zinc/93/89/30/566938930.db2.gz HKVODIAGTQTLGL-UHFFFAOYSA-N 0 0 386.633 3.322 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCOC[C@@H]1C1CCC1 ZINC000583319196 566938925 /nfs/dbraw/zinc/93/89/25/566938925.db2.gz FWOMIZATWOPXDU-CYBMUJFWSA-N 0 0 395.264 3.091 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(Br)c(F)c1 ZINC000544123886 566940420 /nfs/dbraw/zinc/94/04/20/566940420.db2.gz TXCYAELXNKEEAU-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN CCCN(CC)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC ZINC000493134300 566942785 /nfs/dbraw/zinc/94/27/85/566942785.db2.gz SKVOCIKIOITUJJ-UHFFFAOYSA-N 0 0 395.275 3.095 20 5 GGBDRN C[C@H](NS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000519491931 566943206 /nfs/dbraw/zinc/94/32/06/566943206.db2.gz RJUYEORVCOQCHP-JTQLQIEISA-N 0 0 385.239 3.397 20 5 GGBDRN CCN(C(C)C)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC ZINC000493036430 566943894 /nfs/dbraw/zinc/94/38/94/566943894.db2.gz VTEMPGFPPKOKHW-UHFFFAOYSA-N 0 0 395.275 3.093 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@@H]2CCC3(CCOCC3)[C@@H]2O)c(Br)c1 ZINC000519529604 566944646 /nfs/dbraw/zinc/94/46/46/566944646.db2.gz VNKWBCVQQASYSE-XHDPSFHLSA-N 0 0 385.258 3.337 20 5 GGBDRN CCCN(Cc1ccc(OC)cc1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000611921951 566944495 /nfs/dbraw/zinc/94/44/95/566944495.db2.gz SUYVDDARJWJKLF-UHFFFAOYSA-N 0 0 384.479 3.485 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])s1 ZINC000471293617 566944654 /nfs/dbraw/zinc/94/46/54/566944654.db2.gz VNYSYCWNWMVSOR-UHFFFAOYSA-N 0 0 388.854 3.033 20 5 GGBDRN COCCN(C(C)=O)c1nc(COc2c(Cl)cccc2[N+](=O)[O-])cs1 ZINC000471295260 566945057 /nfs/dbraw/zinc/94/50/57/566945057.db2.gz FNQKKDNPRUFWLC-UHFFFAOYSA-N 0 0 385.829 3.283 20 5 GGBDRN COc1ccc(C2(NS(=O)(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)cc1 ZINC000519533234 566945109 /nfs/dbraw/zinc/94/51/09/566945109.db2.gz RBAFUXZJPFYJNI-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN O=C(N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1)c1cscc1Br ZINC000493319868 566945488 /nfs/dbraw/zinc/94/54/88/566945488.db2.gz KSMDUGDPSDDJDM-UHFFFAOYSA-N 0 0 393.222 3.483 20 5 GGBDRN COC[C@@H](NS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000564100634 566945570 /nfs/dbraw/zinc/94/55/70/566945570.db2.gz BWNISDOGPBWKSF-CQSZACIVSA-N 0 0 384.841 3.223 20 5 GGBDRN CSC1(C(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000493240093 566945817 /nfs/dbraw/zinc/94/58/17/566945817.db2.gz UQRRNGRHXIELFN-UHFFFAOYSA-N 0 0 377.388 3.427 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1F ZINC000429704925 566946402 /nfs/dbraw/zinc/94/64/02/566946402.db2.gz BWQDXFYLAOPTGZ-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN O=C(Cc1sccc1Br)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000452169026 566946436 /nfs/dbraw/zinc/94/64/36/566946436.db2.gz ZLVOMTCMYPHGCM-UHFFFAOYSA-N 0 0 397.250 3.383 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N=c1cc([C@@H]2C[C@@H]2C)[nH][nH]1 ZINC000493345285 566947550 /nfs/dbraw/zinc/94/75/50/566947550.db2.gz XBHLYNVKJFWQKG-OIBJUYFYSA-N 0 0 379.214 3.186 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N=c1cc([C@@H]2C[C@H]2C)[nH][nH]1 ZINC000493345284 566947622 /nfs/dbraw/zinc/94/76/22/566947622.db2.gz XBHLYNVKJFWQKG-GMSGAONNSA-N 0 0 379.214 3.186 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N=c1cc([C@H]2C[C@H]2C)[nH][nH]1 ZINC000493345286 566947856 /nfs/dbraw/zinc/94/78/56/566947856.db2.gz XBHLYNVKJFWQKG-XCBNKYQSSA-N 0 0 379.214 3.186 20 5 GGBDRN C[C@@H]1CC[C@@H](N(C)C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000519575111 566948579 /nfs/dbraw/zinc/94/85/79/566948579.db2.gz BZMHAVXBVMWSMB-BXKDBHETSA-N 0 0 388.205 3.460 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CC(=O)N(c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000519565761 566948855 /nfs/dbraw/zinc/94/88/55/566948855.db2.gz FOXBPYVBJONZOD-LLVKDONJSA-N 0 0 391.225 3.278 20 5 GGBDRN Cc1ccccc1[C@H](CO)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544241731 566950364 /nfs/dbraw/zinc/95/03/64/566950364.db2.gz SJLFFZNKWPJXCO-AWEZNQCLSA-N 0 0 380.853 3.499 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)c1c(Cl)ccc(F)c1F)CC2 ZINC000583432366 566950871 /nfs/dbraw/zinc/95/08/71/566950871.db2.gz PYFSPHCEQJUDEU-UHFFFAOYSA-N 0 0 388.779 3.273 20 5 GGBDRN COc1ccc2c(c1)CC[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C2 ZINC000612098136 566952395 /nfs/dbraw/zinc/95/23/95/566952395.db2.gz DXCKXANYCFIRNZ-LBPRGKRZSA-N 0 0 382.463 3.038 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1cccs1 ZINC000429815606 566952881 /nfs/dbraw/zinc/95/28/81/566952881.db2.gz TZQIGXBYVOUEOS-LBPRGKRZSA-N 0 0 399.222 3.063 20 5 GGBDRN Cn1c(C(=O)N[C@@H]2C[C@H]2c2ccc(Br)c(F)c2)ccc1[N+](=O)[O-] ZINC000471461082 566954411 /nfs/dbraw/zinc/95/44/11/566954411.db2.gz YSDNYYDCQYQSOU-JOYOIKCWSA-N 0 0 382.189 3.121 20 5 GGBDRN C[C@H]1CC[C@H](C(F)(F)F)CN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000612121815 566955163 /nfs/dbraw/zinc/95/51/63/566955163.db2.gz OVLLSDXIMNKHRA-RYUDHWBXSA-N 0 0 380.388 3.031 20 5 GGBDRN C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H](C)S1(=O)=O ZINC000519674614 566958612 /nfs/dbraw/zinc/95/86/12/566958612.db2.gz PZVGTTAVNZAQEB-STQMWFEESA-N 0 0 380.491 3.331 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(=O)n1Cc1cc2c(cc1Br)OCCCO2 ZINC000471518228 566958528 /nfs/dbraw/zinc/95/85/28/566958528.db2.gz OFUBLGAPTOZZRF-UHFFFAOYSA-N 0 0 395.209 3.037 20 5 GGBDRN Cc1c(Br)c(NCc2ccc(OCC3CC3)nc2)ncc1[N+](=O)[O-] ZINC000544394322 566959134 /nfs/dbraw/zinc/95/91/34/566959134.db2.gz MYNUWMKPWZFVJB-UHFFFAOYSA-N 0 0 393.241 3.279 20 5 GGBDRN Cc1c(Br)c(N[C@@H](CC(N)=O)C2CCCCC2)ncc1[N+](=O)[O-] ZINC000544395736 566959332 /nfs/dbraw/zinc/95/93/32/566959332.db2.gz JIKPHLDYSXBTKR-NSHDSACASA-N 0 0 385.262 3.297 20 5 GGBDRN Cc1c(Br)c(N[C@H](CC(N)=O)C2CCCCC2)ncc1[N+](=O)[O-] ZINC000544395735 566959541 /nfs/dbraw/zinc/95/95/41/566959541.db2.gz JIKPHLDYSXBTKR-LLVKDONJSA-N 0 0 385.262 3.297 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000544393968 566959593 /nfs/dbraw/zinc/95/95/93/566959593.db2.gz BUFSDSXKCRCHSY-JTQLQIEISA-N 0 0 396.241 3.371 20 5 GGBDRN Cc1c(Br)c(N2CC[C@H](C)[C@@H](n3ccnc3)C2)ncc1[N+](=O)[O-] ZINC000544394532 566959626 /nfs/dbraw/zinc/95/96/26/566959626.db2.gz CXPGXGVGNBHHIX-GWCFXTLKSA-N 0 0 380.246 3.345 20 5 GGBDRN O=C(N[C@H]1COc2cc(F)cc(F)c21)c1ccc([N+](=O)[O-])cc1Br ZINC000612222554 566959788 /nfs/dbraw/zinc/95/97/88/566959788.db2.gz FNEJWKDLHVNIAR-LBPRGKRZSA-N 0 0 399.147 3.499 20 5 GGBDRN O=C(Nc1nnc(C(F)F)s1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429873067 566960633 /nfs/dbraw/zinc/96/06/33/566960633.db2.gz ZGMUJFKSLWXTFA-UHFFFAOYSA-N 0 0 379.142 3.399 20 5 GGBDRN COCCNc1ccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000544409842 566961435 /nfs/dbraw/zinc/96/14/35/566961435.db2.gz IPCRZMZDAFIAJQ-UHFFFAOYSA-N 0 0 395.257 3.153 20 5 GGBDRN COC(=O)[C@@H]1CCCCCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000612320862 566964910 /nfs/dbraw/zinc/96/49/10/566964910.db2.gz GFUKPDWKPANHHY-LBPRGKRZSA-N 0 0 386.857 3.285 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CNc1ccc(Cl)cc1I ZINC000471672985 566970414 /nfs/dbraw/zinc/97/04/14/566970414.db2.gz ASXOOSPQZKWXCL-UHFFFAOYSA-N 0 0 392.584 3.198 20 5 GGBDRN COc1cc(Br)ccc1CCC(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000583657214 566970681 /nfs/dbraw/zinc/97/06/81/566970681.db2.gz DQQRFDNPXVYKJC-UHFFFAOYSA-N 0 0 394.225 3.357 20 5 GGBDRN O=C(NC[C@@H]1Cc2ccccc2O1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429964034 566971332 /nfs/dbraw/zinc/97/13/32/566971332.db2.gz MBSKUZLDHSHXQL-LBPRGKRZSA-N 0 0 377.194 3.091 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)NC[C@@H]2CCC(F)(F)C2)c1 ZINC000429979281 566972315 /nfs/dbraw/zinc/97/23/15/566972315.db2.gz YNXYAEYNRNCMFF-MRVPVSSYSA-N 0 0 399.213 3.071 20 5 GGBDRN COc1cccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)c1OC ZINC000612438651 566972643 /nfs/dbraw/zinc/97/26/43/566972643.db2.gz XOJDFJUSIKZJNG-UHFFFAOYSA-N 0 0 382.214 3.112 20 5 GGBDRN CC(C)(CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccn1 ZINC000452388261 566972657 /nfs/dbraw/zinc/97/26/57/566972657.db2.gz YALJRFWQNYAFMI-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN Cc1c(Br)c(N2CCN(Cc3cccs3)CC2)ncc1[N+](=O)[O-] ZINC000612437932 566973307 /nfs/dbraw/zinc/97/33/07/566973307.db2.gz VSCVZRFBWNUDJR-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN COc1cccc2c1OC[C@H](Nc1ncc([N+](=O)[O-])c(C)c1Br)C2 ZINC000612444735 566974236 /nfs/dbraw/zinc/97/42/36/566974236.db2.gz LPGUPGNHCFSMOC-LLVKDONJSA-N 0 0 394.225 3.485 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccccc2Br)c1 ZINC000430017056 566976324 /nfs/dbraw/zinc/97/63/24/566976324.db2.gz IIVQSAPMULBNSD-DZGCQCFKSA-N 0 0 397.250 3.192 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000519891550 566976921 /nfs/dbraw/zinc/97/69/21/566976921.db2.gz GULCEVSUPMPYFS-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCn1cc(Br)cn1 ZINC000564442439 566976979 /nfs/dbraw/zinc/97/69/79/566976979.db2.gz JTFFWZZTGCQLJI-UHFFFAOYSA-N 0 0 396.245 3.280 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000519891657 566977406 /nfs/dbraw/zinc/97/74/06/566977406.db2.gz LWEROPALJHKDND-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccccc1Br ZINC000519891067 566977429 /nfs/dbraw/zinc/97/74/29/566977429.db2.gz FHOFDKGKEMHXDJ-UHFFFAOYSA-N 0 0 399.266 3.398 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCOc2ccc(Br)cc2C1 ZINC000564472976 566977931 /nfs/dbraw/zinc/97/79/31/566977931.db2.gz FSXIZMLIKCEOHI-UHFFFAOYSA-N 0 0 377.194 3.392 20 5 GGBDRN CCOCc1nc([C@@H](C)Nc2ncc([N+](=O)[O-])c(C)c2Br)no1 ZINC000583725611 566978865 /nfs/dbraw/zinc/97/88/65/566978865.db2.gz WRCFCHAXHJHRGZ-MRVPVSSYSA-N 0 0 386.206 3.153 20 5 GGBDRN NS(=O)(=O)c1cccc(NCc2nc3cc(Cl)ccc3s2)c1[N+](=O)[O-] ZINC000544678410 566979238 /nfs/dbraw/zinc/97/92/38/566979238.db2.gz XPARCINWENEVGR-UHFFFAOYSA-N 0 0 398.853 3.117 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000583767161 566981483 /nfs/dbraw/zinc/98/14/83/566981483.db2.gz RCAPNUFZCNGJMB-HONMWMINSA-N 0 0 383.242 3.209 20 5 GGBDRN C[C@@H](Cc1cccc(Br)c1)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000520028243 566982365 /nfs/dbraw/zinc/98/23/65/566982365.db2.gz HYYNHOCIMZMWHT-NSHDSACASA-N 0 0 399.266 3.267 20 5 GGBDRN C[C@@H](Cc1cccc(Br)c1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000520028240 566982585 /nfs/dbraw/zinc/98/25/85/566982585.db2.gz HWBPYKSWJBJGEZ-NSHDSACASA-N 0 0 399.266 3.267 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000520028242 566982767 /nfs/dbraw/zinc/98/27/67/566982767.db2.gz HYYNHOCIMZMWHT-LLVKDONJSA-N 0 0 399.266 3.267 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1N1CCC(Oc2cccc(Br)c2)CC1 ZINC000544703908 566982944 /nfs/dbraw/zinc/98/29/44/566982944.db2.gz KRZYLQNBCDZUPB-UHFFFAOYSA-N 0 0 381.230 3.139 20 5 GGBDRN Cc1nn(C)c(NCCc2cn3cc(Br)cc(C)c3n2)c1[N+](=O)[O-] ZINC000544700564 566983298 /nfs/dbraw/zinc/98/32/98/566983298.db2.gz BEUUDKCNJLWTKJ-UHFFFAOYSA-N 0 0 393.245 3.010 20 5 GGBDRN CN(Cc1ccc(Cl)cc1Cl)c1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000612653859 566985350 /nfs/dbraw/zinc/98/53/50/566985350.db2.gz GQJGQMCFUHYPBB-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN NS(=O)(=O)c1c(NCc2cccc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000520152616 566986020 /nfs/dbraw/zinc/98/60/20/566986020.db2.gz OPBFHPQFQSEYMK-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN CCN(Cc1ccc(Cl)cc1)c1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-] ZINC000520152482 566986062 /nfs/dbraw/zinc/98/60/62/566986062.db2.gz GYEFUQUFTHAJJZ-UHFFFAOYSA-N 0 0 383.857 3.183 20 5 GGBDRN CCSc1cc(CNS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)ccn1 ZINC000494307194 566986445 /nfs/dbraw/zinc/98/64/45/566986445.db2.gz DWWNRGPPXLDPGL-UHFFFAOYSA-N 0 0 381.479 3.197 20 5 GGBDRN COCc1noc(COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])n1 ZINC000612661173 566986940 /nfs/dbraw/zinc/98/69/40/566986940.db2.gz RCZBTYGHRBVMRL-UHFFFAOYSA-N 0 0 395.169 3.014 20 5 GGBDRN CC(C)[C@H](C)NC(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612661130 566987041 /nfs/dbraw/zinc/98/70/41/566987041.db2.gz LPSHXZNFNNTUGK-JTQLQIEISA-N 0 0 396.241 3.445 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1OCCOC[C@@H]1CCCO1 ZINC000612660806 566987174 /nfs/dbraw/zinc/98/71/74/566987174.db2.gz BJWCOCDVSVEYTB-LBPRGKRZSA-N 0 0 397.225 3.480 20 5 GGBDRN C[C@H](Cn1ccnc1)Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000564558515 566987556 /nfs/dbraw/zinc/98/75/56/566987556.db2.gz JAYLQXWKTKNSII-SNVBAGLBSA-N 0 0 376.214 3.025 20 5 GGBDRN NS(=O)(=O)c1cccc(NC[C@@H]2CCCC[C@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000612660630 566987666 /nfs/dbraw/zinc/98/76/66/566987666.db2.gz FIEPXIMVPCRKIQ-VHSXEESVSA-N 0 0 381.376 3.023 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)NCc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000520155514 566987865 /nfs/dbraw/zinc/98/78/65/566987865.db2.gz KYZPWZZPFHLFHB-UHFFFAOYSA-N 0 0 376.768 3.313 20 5 GGBDRN CCN(Cc1ccc(Cl)cc1)S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-] ZINC000520156550 566988139 /nfs/dbraw/zinc/98/81/39/566988139.db2.gz POJMTBRBCOXPPL-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN CCn1cc(S(=O)(=O)N[C@@H](C)c2cc(Cl)ccc2Cl)c([N+](=O)[O-])n1 ZINC000494338285 566990313 /nfs/dbraw/zinc/99/03/13/566990313.db2.gz JOLSDVHELJUHBM-QMMMGPOBSA-N 0 0 393.252 3.158 20 5 GGBDRN CS[C@@H]1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000452555538 566990261 /nfs/dbraw/zinc/99/02/61/566990261.db2.gz IWQVBEDYUQHOAQ-LLVKDONJSA-N 0 0 377.388 3.380 20 5 GGBDRN COc1cnc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c(Br)c1 ZINC000583897165 566994372 /nfs/dbraw/zinc/99/43/72/566994372.db2.gz GTJJSLVRIRHYCG-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN Cc1cc(Br)ccc1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000612790232 566997751 /nfs/dbraw/zinc/99/77/51/566997751.db2.gz KOZWKXYIFIVKJA-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1(F)F ZINC000494412548 566998423 /nfs/dbraw/zinc/99/84/23/566998423.db2.gz LOUNDWBJQQBZBI-MRVPVSSYSA-N 0 0 399.213 3.023 20 5 GGBDRN C[C@H]1CN(Cc2cc(I)cc([N+](=O)[O-])c2)CC(C)(C)O1 ZINC000583963343 566999120 /nfs/dbraw/zinc/99/91/20/566999120.db2.gz FRUNTWNBOYCOQC-JTQLQIEISA-N 0 0 390.221 3.199 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000520347672 566999906 /nfs/dbraw/zinc/99/99/06/566999906.db2.gz XRIMPFOEZNLSOM-HZPDHXFCSA-N 0 0 391.221 3.408 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H](CO)c1ccc(Br)c(F)c1 ZINC000494425585 567000339 /nfs/dbraw/zinc/00/03/39/567000339.db2.gz MISCFMHZESOETL-CQSZACIVSA-N 0 0 398.188 3.352 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000544840055 567000718 /nfs/dbraw/zinc/00/07/18/567000718.db2.gz QTOWDXZMDOKXPW-OAHLLOKOSA-N 0 0 382.825 3.440 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000544842345 567000812 /nfs/dbraw/zinc/00/08/12/567000812.db2.gz DAPYVGBLFUSFPD-BDJLRTHQSA-N 0 0 384.841 3.303 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(COCC(F)(F)F)no2)c(Br)c1 ZINC000612874418 567000884 /nfs/dbraw/zinc/00/08/84/567000884.db2.gz UTPYTFYGNUWABA-UHFFFAOYSA-N 0 0 382.092 3.486 20 5 GGBDRN CCNc1ccc(C(=O)N2CCSC[C@H]2c2nccs2)cc1[N+](=O)[O-] ZINC000472098623 567001227 /nfs/dbraw/zinc/00/12/27/567001227.db2.gz VLQGRJRXYPIWCN-AWEZNQCLSA-N 0 0 378.479 3.413 20 5 GGBDRN Cn1c(-c2nc(-c3cccc(I)c3)no2)ccc1[N+](=O)[O-] ZINC000612887232 567002923 /nfs/dbraw/zinc/00/29/23/567002923.db2.gz AGBUHXPNJCGEBZ-UHFFFAOYSA-N 0 0 396.144 3.255 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1-c1nc(-c2cccc(I)c2)no1 ZINC000612885745 567003300 /nfs/dbraw/zinc/00/33/00/567003300.db2.gz NLCZEUAUGCCODC-UHFFFAOYSA-N 0 0 396.144 3.255 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2Cc3cccc(O)c3C2)cc1[N+](=O)[O-] ZINC000430265642 567003576 /nfs/dbraw/zinc/00/35/76/567003576.db2.gz ZRDREJSIISEQMR-GFCCVEGCSA-N 0 0 391.221 3.269 20 5 GGBDRN CC[C@@H](CSC)NS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000564746091 567004541 /nfs/dbraw/zinc/00/45/41/567004541.db2.gz OFWQZXDEYMUUNE-VIFPVBQESA-N 0 0 397.316 3.086 20 5 GGBDRN CCCC1(CNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CC1 ZINC000430305636 567006490 /nfs/dbraw/zinc/00/64/90/567006490.db2.gz REXSBZBKYBQAHC-UHFFFAOYSA-N 0 0 398.257 3.301 20 5 GGBDRN O=C(c1c[nH]c2ncc(Br)cc12)N1CCc2c1cccc2[N+](=O)[O-] ZINC000472188212 567006731 /nfs/dbraw/zinc/00/67/31/567006731.db2.gz DNPJGUNSVPRQRJ-UHFFFAOYSA-N 0 0 387.193 3.437 20 5 GGBDRN CC[C@H]1CCC[C@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430308581 567006787 /nfs/dbraw/zinc/00/67/87/567006787.db2.gz YDNXDVBFALAHKD-CMPLNLGQSA-N 0 0 398.257 3.299 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(CC(C)C)C2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000430301279 567006872 /nfs/dbraw/zinc/00/68/72/567006872.db2.gz IEDPUELSAGWSAC-UHFFFAOYSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCC(C)(C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430310163 567006912 /nfs/dbraw/zinc/00/69/12/567006912.db2.gz ZWLXGDVSXAFXEF-LLVKDONJSA-N 0 0 398.257 3.299 20 5 GGBDRN Cc1ncsc1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000452703949 567007038 /nfs/dbraw/zinc/00/70/38/567007038.db2.gz RBZZYIPSWSALAS-UHFFFAOYSA-N 0 0 384.255 3.024 20 5 GGBDRN Cc1ncsc1CCNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000452703191 567007134 /nfs/dbraw/zinc/00/71/34/567007134.db2.gz TWHKELWJKAFGKZ-UHFFFAOYSA-N 0 0 384.255 3.403 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCC(C)(C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430310165 567007132 /nfs/dbraw/zinc/00/71/32/567007132.db2.gz ZWLXGDVSXAFXEF-NSHDSACASA-N 0 0 398.257 3.299 20 5 GGBDRN CC[C@H](C)[C@@H](C)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430307766 567007365 /nfs/dbraw/zinc/00/73/65/567007365.db2.gz WFWMGKHEUSKCRG-WCBMZHEXSA-N 0 0 386.246 3.155 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCCC(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430305577 567007411 /nfs/dbraw/zinc/00/74/11/567007411.db2.gz NKCCCAZNAKTQIK-UHFFFAOYSA-N 0 0 386.246 3.157 20 5 GGBDRN CC[C@@H]1[C@H](C)CCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430318953 567007992 /nfs/dbraw/zinc/00/79/92/567007992.db2.gz LPRXEBPEWYBQIG-NOZJJQNGSA-N 0 0 398.257 3.251 20 5 GGBDRN COc1cccc(Cc2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)n1 ZINC000612980189 567007980 /nfs/dbraw/zinc/00/79/80/567007980.db2.gz ZNSUDHYEGPOWFH-UHFFFAOYSA-N 0 0 391.181 3.402 20 5 GGBDRN CCC[C@H](C)N(C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430314238 567008577 /nfs/dbraw/zinc/00/85/77/567008577.db2.gz JANMZTMWSBCMAQ-VIFPVBQESA-N 0 0 386.246 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@H](C)CC2(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430318315 567008737 /nfs/dbraw/zinc/00/87/37/567008737.db2.gz TWSVMWQRWLOYTA-SECBINFHSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@H](C)CC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430325760 567009614 /nfs/dbraw/zinc/00/96/14/567009614.db2.gz XSXGVKLJGBLHLP-NXEZZACHSA-N 0 0 398.257 3.251 20 5 GGBDRN CCC(C)(C)CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430333548 567009720 /nfs/dbraw/zinc/00/97/20/567009720.db2.gz ROQGZCYMSRHNPG-UHFFFAOYSA-N 0 0 386.246 3.157 20 5 GGBDRN CC[C@@H]1CCCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430325277 567009732 /nfs/dbraw/zinc/00/97/32/567009732.db2.gz SAVCHGXUUBVLBY-GFCCVEGCSA-N 0 0 398.257 3.395 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H]2CC[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430328232 567009762 /nfs/dbraw/zinc/00/97/62/567009762.db2.gz DJVMWRGMKXYYOO-MWLCHTKSSA-N 0 0 398.257 3.157 20 5 GGBDRN Cc1sc(S(=O)(=O)NCCc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000472211015 567009971 /nfs/dbraw/zinc/00/99/71/567009971.db2.gz XRPQFFYBJXNVMK-UHFFFAOYSA-N 0 0 392.405 3.087 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@@H](C)CC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430325761 567009980 /nfs/dbraw/zinc/00/99/80/567009980.db2.gz XSXGVKLJGBLHLP-UWVGGRQHSA-N 0 0 398.257 3.251 20 5 GGBDRN CC[C@H]1CCCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430325279 567010205 /nfs/dbraw/zinc/01/02/05/567010205.db2.gz SAVCHGXUUBVLBY-LBPRGKRZSA-N 0 0 398.257 3.395 20 5 GGBDRN O=C(NC[C@H]1CCOC2(CCC2)C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000452736744 567010382 /nfs/dbraw/zinc/01/03/82/567010382.db2.gz WDJMLYCHVDOJNQ-NSHDSACASA-N 0 0 383.242 3.436 20 5 GGBDRN O=C(NC[C@@H]1CCOC2(CCC2)C1)c1sc(Br)cc1[N+](=O)[O-] ZINC000452735315 567010615 /nfs/dbraw/zinc/01/06/15/567010615.db2.gz SQUXWZXEUDEGCP-SECBINFHSA-N 0 0 389.271 3.498 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@@H]1CCOC2(CCC2)C1 ZINC000452738395 567010853 /nfs/dbraw/zinc/01/08/53/567010853.db2.gz ZJWWZCDSNQEJKX-GFCCVEGCSA-N 0 0 397.269 3.365 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCCC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430342333 567011065 /nfs/dbraw/zinc/01/10/65/567011065.db2.gz JTTZYVQXNSPHKT-CABZTGNLSA-N 0 0 398.257 3.299 20 5 GGBDRN CSc1cccc(C)c1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000472243189 567011101 /nfs/dbraw/zinc/01/11/01/567011101.db2.gz WAXJMIORXMQLNJ-UHFFFAOYSA-N 0 0 380.447 3.281 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[S@@](=O)CC1 ZINC000430339172 567011182 /nfs/dbraw/zinc/01/11/82/567011182.db2.gz COKCLPDLDJCIST-SHZVTRLKSA-N 0 0 384.523 3.470 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@H](C)[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430338387 567011271 /nfs/dbraw/zinc/01/12/71/567011271.db2.gz HQFRQFJGXNGBNU-ONGXEEELSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)CC2CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430342022 567011400 /nfs/dbraw/zinc/01/14/00/567011400.db2.gz LERPJQPJKKFLON-UHFFFAOYSA-N 0 0 398.257 3.253 20 5 GGBDRN COc1ccc(Br)cc1[C@H]1CCCN1CCn1cc([N+](=O)[O-])cn1 ZINC000472231267 567011489 /nfs/dbraw/zinc/01/14/89/567011489.db2.gz PFESIEDGJQIRPH-OAHLLOKOSA-N 0 0 395.257 3.400 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC3(C2)CCCC3)cc(Br)cc1[N+](=O)[O-] ZINC000430353737 567011473 /nfs/dbraw/zinc/01/14/73/567011473.db2.gz OLKMOMGHYWQJLB-UHFFFAOYSA-N 0 0 396.241 3.007 20 5 GGBDRN Cc1cc(OCC(=O)NCc2ccc(Br)s2)ccc1[N+](=O)[O-] ZINC000430341547 567011614 /nfs/dbraw/zinc/01/16/14/567011614.db2.gz IMENMMHHBLKLHT-UHFFFAOYSA-N 0 0 385.239 3.422 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@@H]3CCC[C@@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000430358417 567012277 /nfs/dbraw/zinc/01/22/77/567012277.db2.gz XSAGMASTWOHNIS-GWCFXTLKSA-N 0 0 396.241 3.005 20 5 GGBDRN CN(Cc1nc(-c2cncc(Br)c2)no1)c1ccccc1[N+](=O)[O-] ZINC000545021198 567013427 /nfs/dbraw/zinc/01/34/27/567013427.db2.gz VNVKCMVEVWEWNR-UHFFFAOYSA-N 0 0 390.197 3.439 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000494644718 567013736 /nfs/dbraw/zinc/01/37/36/567013736.db2.gz ALPXZYMDIDJUNA-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN Cc1cc(OCC(=O)NCc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000430398727 567014903 /nfs/dbraw/zinc/01/49/03/567014903.db2.gz YTMFYUPSEIQFQD-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCc1nc(-c2cncc(Br)c2)no1 ZINC000545029027 567016109 /nfs/dbraw/zinc/01/61/09/567016109.db2.gz LBSKLPGSMWRLQU-UHFFFAOYSA-N 0 0 376.170 3.414 20 5 GGBDRN Cc1cc(Cc2noc(-c3csc(S(C)(=O)=O)c3)n2)ccc1[N+](=O)[O-] ZINC000545077791 567019047 /nfs/dbraw/zinc/01/90/47/567019047.db2.gz RVCNRGNFYORLPN-UHFFFAOYSA-N 0 0 379.419 3.009 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CC[C@H](Oc2ccccc2)C1 ZINC000564912363 567019909 /nfs/dbraw/zinc/01/99/09/567019909.db2.gz QQFBURUHCFDNSM-ZDUSSCGKSA-N 0 0 382.825 3.090 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC[C@@H](c2cccc(Br)c2)C1 ZINC000452839782 567022116 /nfs/dbraw/zinc/02/21/16/567022116.db2.gz FKXQFJKOPIXTDW-LLVKDONJSA-N 0 0 392.209 3.088 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CC[C@@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000452838964 567022558 /nfs/dbraw/zinc/02/25/58/567022558.db2.gz DGEKWLIUCNJDRP-GFCCVEGCSA-N 0 0 393.241 3.029 20 5 GGBDRN COc1cc(F)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000520763893 567023835 /nfs/dbraw/zinc/02/38/35/567023835.db2.gz HMDXUBRIBGAHIF-UHFFFAOYSA-N 0 0 390.776 3.205 20 5 GGBDRN CCOC(=O)c1cc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cn1C ZINC000430617298 567024499 /nfs/dbraw/zinc/02/44/99/567024499.db2.gz LNFGJQCHQBMRCA-UHFFFAOYSA-N 0 0 396.197 3.125 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC(OCC2CC2)CC1 ZINC000430625215 567024615 /nfs/dbraw/zinc/02/46/15/567024615.db2.gz QAFHYUPPNKFVSB-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN CCSc1nccnc1C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000430680114 567028794 /nfs/dbraw/zinc/02/87/94/567028794.db2.gz XKQNHOXCGGVOQT-INIZCTEOSA-N 0 0 376.463 3.385 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(c2ncc(I)cn2)C2CC2)cc1 ZINC000545207707 567029122 /nfs/dbraw/zinc/02/91/22/567029122.db2.gz LDCPMNPBUKZCHF-UHFFFAOYSA-N 0 0 396.188 3.158 20 5 GGBDRN Cc1sc(S(=O)(=O)NCCc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000545229117 567030543 /nfs/dbraw/zinc/03/05/43/567030543.db2.gz CTXJIQKADFUKSA-UHFFFAOYSA-N 0 0 392.405 3.087 20 5 GGBDRN C[C@@](O)(C1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545221565 567031032 /nfs/dbraw/zinc/03/10/32/567031032.db2.gz FYQVNJXYAGLJAH-GFCCVEGCSA-N 0 0 398.179 3.282 20 5 GGBDRN CCCN(CC(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000613339692 567031650 /nfs/dbraw/zinc/03/16/50/567031650.db2.gz WNISEOLPLIFWOT-UHFFFAOYSA-N 0 0 377.344 3.106 20 5 GGBDRN CSCCCN(C)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000545255815 567033405 /nfs/dbraw/zinc/03/34/05/567033405.db2.gz 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ZINC000613477096 567040494 /nfs/dbraw/zinc/04/04/94/567040494.db2.gz BXZDBNPPTJRFRU-CYBMUJFWSA-N 0 0 390.870 3.284 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000613475705 567041162 /nfs/dbraw/zinc/04/11/62/567041162.db2.gz XJDXEWIMIHOSSY-HNNXBMFYSA-N 0 0 382.463 3.117 20 5 GGBDRN C[C@H](CC(=O)OC(C)(C)C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430949779 567042279 /nfs/dbraw/zinc/04/22/79/567042279.db2.gz FDNGIYIDYXTATB-SECBINFHSA-N 0 0 387.230 3.207 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCCN3c4ccccc4C[C@@H]3C2)c(Br)c1 ZINC000521130540 567043176 /nfs/dbraw/zinc/04/31/76/567043176.db2.gz HAJBMMOHQISUMN-CQSZACIVSA-N 0 0 389.253 3.394 20 5 GGBDRN Cc1c(Br)c(N2CCSC3(CCOCC3)C2)ncc1[N+](=O)[O-] ZINC000472685065 567045028 /nfs/dbraw/zinc/04/50/28/567045028.db2.gz SGYQEVUGZIVOSY-UHFFFAOYSA-N 0 0 388.287 3.163 20 5 GGBDRN CC(C)(C)c1nn(C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1Br ZINC000453031986 567045469 /nfs/dbraw/zinc/04/54/69/567045469.db2.gz ZJDXCVJDJWXGLZ-LLVKDONJSA-N 0 0 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/nfs/dbraw/zinc/08/67/93/567086793.db2.gz YLLFKZZONBTYKL-ZDUSSCGKSA-N 0 0 380.242 3.101 20 5 GGBDRN C[C@@H](Oc1ccc(Oc2ccc([N+](=O)[O-])cc2Br)cc1)C(N)=O ZINC000497250859 567087036 /nfs/dbraw/zinc/08/70/36/567087036.db2.gz XIRHGFMENIGLRF-SECBINFHSA-N 0 0 381.182 3.402 20 5 GGBDRN O=C(NCCC1CCCCC1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000585756554 567087399 /nfs/dbraw/zinc/08/73/99/567087399.db2.gz JNNLCUPHOVQYPU-UHFFFAOYSA-N 0 0 398.257 3.382 20 5 GGBDRN CC[C@@H]1CO[C@H](C)CN1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000521990270 567091736 /nfs/dbraw/zinc/09/17/36/567091736.db2.gz HWDGRABUOCXWMB-ZWNOBZJWSA-N 0 0 390.221 3.199 20 5 GGBDRN CC(C)OC(=O)CC[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000473590883 567091966 /nfs/dbraw/zinc/09/19/66/567091966.db2.gz QTXWWRKXPSNGGI-SNVBAGLBSA-N 0 0 387.230 3.207 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(Cc2cc(Br)cs2)CC1 ZINC000453580446 567092803 /nfs/dbraw/zinc/09/28/03/567092803.db2.gz UCOXRTHTWDLBPA-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(Cc2csc(Br)c2)CC1 ZINC000453574965 567092889 /nfs/dbraw/zinc/09/28/89/567092889.db2.gz JPTLVUZHFSZSHV-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)CCSc2ccccc2)cc1[N+](=O)[O-] ZINC000546045012 567098741 /nfs/dbraw/zinc/09/87/41/567098741.db2.gz FZFSKANRJGYJOX-UHFFFAOYSA-N 0 0 381.479 3.049 20 5 GGBDRN CC[C@@H](Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1S(N)(=O)=O ZINC000565805714 567100880 /nfs/dbraw/zinc/10/08/80/567100880.db2.gz AQZIUOFTWQYTEK-ZDUSSCGKSA-N 0 0 383.857 3.329 20 5 GGBDRN O=[N+]([O-])c1c[nH]c(-c2nc(-c3cn4ccc(Br)cc4n3)no2)c1 ZINC000565805343 567101304 /nfs/dbraw/zinc/10/13/04/567101304.db2.gz LCANGWHGMJTHIO-UHFFFAOYSA-N 0 0 375.142 3.050 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000546074483 567103301 /nfs/dbraw/zinc/10/33/01/567103301.db2.gz VHFCOXATOZPUDN-AAEUAGOBSA-N 0 0 380.388 3.383 20 5 GGBDRN Cc1cc2c(cc1[N+](=O)[O-])N(S(=O)(=O)c1ccc(Br)o1)CC2 ZINC000546074827 567103458 /nfs/dbraw/zinc/10/34/58/567103458.db2.gz KTMVSHRMFYEIQE-UHFFFAOYSA-N 0 0 387.211 3.010 20 5 GGBDRN CO[C@@H]1[C@H]2C[C@H]3CN(C(=O)c4cc([N+](=O)[O-])cc(Br)c4C)[C@H]1[C@H]3C2 ZINC000587520099 567104410 /nfs/dbraw/zinc/10/44/10/567104410.db2.gz VRLPHGDJBCTCCL-VSGLDEAGSA-N 0 0 395.253 3.161 20 5 GGBDRN CN(Cc1cc(Br)ccc1F)c1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000587560536 567104478 /nfs/dbraw/zinc/10/44/78/567104478.db2.gz CPXSFZOAPQVRPF-UHFFFAOYSA-N 0 0 382.189 3.232 20 5 GGBDRN CCOC(=O)c1sc(CNc2ncnc3sc([N+](=O)[O-])cc32)nc1C ZINC000587993043 567106290 /nfs/dbraw/zinc/10/62/90/567106290.db2.gz XEOUTPYSUSTFIY-UHFFFAOYSA-N 0 0 379.423 3.153 20 5 GGBDRN COc1cc(C(C)=O)ccc1Sc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497537590 567106654 /nfs/dbraw/zinc/10/66/54/567106654.db2.gz HUCHVCKYIUXJBQ-UHFFFAOYSA-N 0 0 381.431 3.361 20 5 GGBDRN CS(=O)(=O)c1cccc(NCCc2ccccc2Br)c1[N+](=O)[O-] ZINC000497541204 567106702 /nfs/dbraw/zinc/10/67/02/567106702.db2.gz CZOXABLNCXNQCW-UHFFFAOYSA-N 0 0 399.266 3.415 20 5 GGBDRN Cn1c2cc(NCc3ccc(Br)cc3)c([N+](=O)[O-])cc2n(C)c1=O ZINC000587972437 567106854 /nfs/dbraw/zinc/10/68/54/567106854.db2.gz BSHSBEOQRPTJQP-UHFFFAOYSA-N 0 0 391.225 3.160 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCc3sc(Br)cc3C2)n1 ZINC000588003536 567107698 /nfs/dbraw/zinc/10/76/98/567107698.db2.gz XCCBJXSBZHBTJS-UHFFFAOYSA-N 0 0 398.238 3.163 20 5 GGBDRN Cc1ccn2cc(CNC(=O)c3cc(Br)cc([N+](=O)[O-])c3)nc2c1 ZINC000431775758 567107624 /nfs/dbraw/zinc/10/76/24/567107624.db2.gz KPISZOYZDMWTBC-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431789624 567107777 /nfs/dbraw/zinc/10/77/77/567107777.db2.gz BOAVBFDKMRMIBD-NEPJUHHUSA-N 0 0 384.274 3.208 20 5 GGBDRN CS(=O)(=O)c1cccc(NCCOCc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000497548646 567109310 /nfs/dbraw/zinc/10/93/10/567109310.db2.gz BWTPAUNQGNXUNC-UHFFFAOYSA-N 0 0 384.841 3.280 20 5 GGBDRN Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NCc3ccsc3Br)cc21 ZINC000588042986 567111192 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C[C@H](Oc1ccc([N+](=O)[O-])c(CO)c1)C(=O)Nc1ccc(Br)cc1 ZINC000431879831 567114237 /nfs/dbraw/zinc/11/42/37/567114237.db2.gz FGEJBUWDCQMCJH-JTQLQIEISA-N 0 0 395.209 3.256 20 5 GGBDRN CSc1ccc(C(=O)NCc2ccc(C[S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000588088325 567114393 /nfs/dbraw/zinc/11/43/93/567114393.db2.gz ZLGSJLAHFSCPAN-VWLOTQADSA-N 0 0 378.475 3.125 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCNc2ccc([N+](=O)[O-])cc2)sc1Cl ZINC000473916588 567114918 /nfs/dbraw/zinc/11/49/18/567114918.db2.gz STOIROJRLNVVES-UHFFFAOYSA-N 0 0 375.859 3.009 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCc1ccc2c(c1)COC2 ZINC000431899495 567115067 /nfs/dbraw/zinc/11/50/67/567115067.db2.gz CANFUNGWWMFPNP-UHFFFAOYSA-N 0 0 391.221 3.246 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000522415029 567115857 /nfs/dbraw/zinc/11/58/57/567115857.db2.gz XZRRPNOIYLBOKZ-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000522416274 567115880 /nfs/dbraw/zinc/11/58/80/567115880.db2.gz 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CC(C)CS(=O)(=O)N1CCC(Nc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432146714 567133568 /nfs/dbraw/zinc/13/35/68/567133568.db2.gz COKUOYCQOGBOKX-UHFFFAOYSA-N 0 0 375.878 3.110 20 5 GGBDRN Cc1cc(F)cc(S(=O)(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000497940382 567133891 /nfs/dbraw/zinc/13/38/91/567133891.db2.gz XMAVZRPPTVYAPW-MRXNPFEDSA-N 0 0 382.438 3.479 20 5 GGBDRN C[S@@](=O)Cc1ccccc1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000546525332 567135114 /nfs/dbraw/zinc/13/51/14/567135114.db2.gz GXWOXNDGWWXPLS-HSZRJFAPSA-N 0 0 397.250 3.488 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2SCCN2S(=O)(=O)c2cncc(Cl)c2)cc1 ZINC000497955269 567135051 /nfs/dbraw/zinc/13/50/51/567135051.db2.gz XTKGCWKUJQAGGR-AWEZNQCLSA-N 0 0 385.854 3.080 20 5 GGBDRN Cc1ccc(F)cc1S(=O)(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497952829 567135468 /nfs/dbraw/zinc/13/54/68/567135468.db2.gz ULWSFDJSHYRMLU-MRXNPFEDSA-N 0 0 382.438 3.479 20 5 GGBDRN Cc1nn(C)c(N2CC[C@H](Cc3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000432172947 567135687 /nfs/dbraw/zinc/13/56/87/567135687.db2.gz RASGDJRQZHYVKV-CYBMUJFWSA-N 0 0 379.258 3.468 20 5 GGBDRN Cc1ccc(Br)c(S(=O)(=O)NCCc2ccccc2[N+](=O)[O-])c1 ZINC000497948715 567135888 /nfs/dbraw/zinc/13/58/88/567135888.db2.gz GPBKECSAQCNPIP-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN CSC[C@H](C)NC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000522906192 567136434 /nfs/dbraw/zinc/13/64/34/567136434.db2.gz IINJLFQKDBOFLJ-VIFPVBQESA-N 0 0 380.392 3.076 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H](CO)c1ccc(Cl)cc1 ZINC000588786796 567136874 /nfs/dbraw/zinc/13/68/74/567136874.db2.gz FEJIFDRDEBADQM-ZDUSSCGKSA-N 0 0 380.853 3.233 20 5 GGBDRN Cc1ccc(F)c(S(=O)(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000497966747 567136961 /nfs/dbraw/zinc/13/69/61/567136961.db2.gz GAEJDPBOQWVGKJ-INIZCTEOSA-N 0 0 382.438 3.479 20 5 GGBDRN CSc1cccc(C(=O)NC[C@H](CO)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000588788783 567137114 /nfs/dbraw/zinc/13/71/14/567137114.db2.gz OZHMLQDKBQEPQM-GFCCVEGCSA-N 0 0 380.853 3.476 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H](CO)c1ccccc1Cl ZINC000588780645 567137268 /nfs/dbraw/zinc/13/72/68/567137268.db2.gz SJAVFSSZXYTZIM-LBPRGKRZSA-N 0 0 380.853 3.233 20 5 GGBDRN Cn1cc([C@H]2OCCC[C@@H]2Nc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000614770294 567137397 /nfs/dbraw/zinc/13/73/97/567137397.db2.gz NXTOQCUAPVFTDE-DZGCQCFKSA-N 0 0 381.230 3.423 20 5 GGBDRN CCc1nn(C)c(Oc2cccc(F)c2I)c1[N+](=O)[O-] ZINC000588823838 567138498 /nfs/dbraw/zinc/13/84/98/567138498.db2.gz MSGSRVMSFGQVBJ-UHFFFAOYSA-N 0 0 391.140 3.427 20 5 GGBDRN CCN1C[C@@H](C)N(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000497979444 567138674 /nfs/dbraw/zinc/13/86/74/567138674.db2.gz VAOQJUXKVSFQTQ-NXEZZACHSA-N 0 0 396.296 3.005 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1cc(Br)c2c(c1)OCCO2 ZINC000588816161 567138907 /nfs/dbraw/zinc/13/89/07/567138907.db2.gz MBZJJCFUSPBVHN-UHFFFAOYSA-N 0 0 397.229 3.265 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2ccc(Cl)cc2Cl)cc1CO ZINC000432237761 567139204 /nfs/dbraw/zinc/13/92/04/567139204.db2.gz KFKCZDGQRXNRCQ-LBPRGKRZSA-N 0 0 388.203 3.213 20 5 GGBDRN CCCN(CC1CC1)S(=O)(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497982561 567139516 /nfs/dbraw/zinc/13/95/16/567139516.db2.gz KBZSTJMZSYWMHX-INIZCTEOSA-N 0 0 385.511 3.009 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)c(C)cc1Br ZINC000588862671 567140653 /nfs/dbraw/zinc/14/06/53/567140653.db2.gz AHMFXXOQTVKLES-UHFFFAOYSA-N 0 0 382.170 3.033 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN1CC=C(c2cccc(Br)c2)CC1 ZINC000546586235 567141286 /nfs/dbraw/zinc/14/12/86/567141286.db2.gz GLJCKIYMMWZCIX-UHFFFAOYSA-N 0 0 377.242 3.380 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cnc2ncc(Br)cc2c1 ZINC000614809366 567141665 /nfs/dbraw/zinc/14/16/65/567141665.db2.gz ZHFZJWWLBPMOCS-UHFFFAOYSA-N 0 0 387.193 3.231 20 5 GGBDRN COc1cc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)ncc1Br ZINC000432257803 567142531 /nfs/dbraw/zinc/14/25/31/567142531.db2.gz XKJUMPNOPHPUEK-UHFFFAOYSA-N 0 0 396.197 3.087 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NCc1cc2cc(Br)ccc2[nH]1 ZINC000546634858 567144371 /nfs/dbraw/zinc/14/43/71/567144371.db2.gz UVYQFOWRQIJKEQ-UHFFFAOYSA-N 0 0 377.198 3.107 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCC[C@H](C2CC2)C1 ZINC000588904074 567144520 /nfs/dbraw/zinc/14/45/20/567144520.db2.gz RSHYVEOAXMDYSN-NSHDSACASA-N 0 0 389.271 3.168 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H](C3CC3)C2)c(C(F)(F)F)c1 ZINC000588904156 567144705 /nfs/dbraw/zinc/14/47/05/567144705.db2.gz XBXMZOCEWGDVOM-LLVKDONJSA-N 0 0 378.372 3.424 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCN(C)c3ccc(Cl)cc32)ccc1[N+](=O)[O-] ZINC000474182442 567145033 /nfs/dbraw/zinc/14/50/33/567145033.db2.gz IJFGHNGYACVKIX-UHFFFAOYSA-N 0 0 381.841 3.202 20 5 GGBDRN C[C@H](CC(C)(C)C)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000454111888 567145049 /nfs/dbraw/zinc/14/50/49/567145049.db2.gz UMMMYDNCJKIEAL-SECBINFHSA-N 0 0 386.246 3.237 20 5 GGBDRN CO[C@]1(C(F)(F)F)CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000614870869 567145026 /nfs/dbraw/zinc/14/50/26/567145026.db2.gz XWFBMDLJWXECSJ-CQSZACIVSA-N 0 0 378.372 3.257 20 5 GGBDRN Cn1c(C(=O)N2CC[C@@H](Cc3ccc(Br)cc3)C2)ccc1[N+](=O)[O-] ZINC000498039242 567145273 /nfs/dbraw/zinc/14/52/73/567145273.db2.gz FUCWHGOQKDWILS-ZDUSSCGKSA-N 0 0 392.253 3.401 20 5 GGBDRN O=C(N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1)c1sccc1Br ZINC000523164645 567146651 /nfs/dbraw/zinc/14/66/51/567146651.db2.gz YYHYNNFFBNMPOS-UHFFFAOYSA-N 0 0 393.222 3.483 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@@H](C2CC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000588931562 567146721 /nfs/dbraw/zinc/14/67/21/567146721.db2.gz YVADGTBJAIQGBK-AWEZNQCLSA-N 0 0 378.372 3.294 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000546643562 567146842 /nfs/dbraw/zinc/14/68/42/567146842.db2.gz SKKZXNLEHIYYDX-UHFFFAOYSA-N 0 0 383.235 3.203 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@H](C2CC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000588931563 567146921 /nfs/dbraw/zinc/14/69/21/567146921.db2.gz YVADGTBJAIQGBK-CQSZACIVSA-N 0 0 378.372 3.294 20 5 GGBDRN COc1cccc2c1CCCN2S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000432295996 567147304 /nfs/dbraw/zinc/14/73/04/567147304.db2.gz YDXUKZHXYFTKFB-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN CCN(Cc1cccc(Br)c1)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000523222945 567147737 /nfs/dbraw/zinc/14/77/37/567147737.db2.gz BNWCHOXEWMYDHN-UHFFFAOYSA-N 0 0 395.257 3.338 20 5 GGBDRN CC[C@@]1(C(C)C)C[C@@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000454141706 567148480 /nfs/dbraw/zinc/14/84/80/567148480.db2.gz LTUCVKVKUGYBCI-BBRMVZONSA-N 0 0 398.257 3.237 20 5 GGBDRN C[C@@H](Oc1ccc([N+](=O)[O-])c(CO)c1)C(=O)Nc1cccc(Br)c1 ZINC000432325773 567149939 /nfs/dbraw/zinc/14/99/39/567149939.db2.gz MJPQSVZYJOXBAH-SNVBAGLBSA-N 0 0 395.209 3.256 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1cncc(Cl)c1Br ZINC000589015988 567150038 /nfs/dbraw/zinc/15/00/38/567150038.db2.gz UQKKIMVWHBFMFZ-UHFFFAOYSA-N 0 0 386.589 3.423 20 5 GGBDRN CC(=O)Nc1ncccc1NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000474224740 567149950 /nfs/dbraw/zinc/14/99/50/567149950.db2.gz BFJYHHKKXXFYBK-UHFFFAOYSA-N 0 0 393.197 3.271 20 5 GGBDRN COCCOCCN(C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000566342645 567150927 /nfs/dbraw/zinc/15/09/27/567150927.db2.gz CXSDEPULHDHCLV-UHFFFAOYSA-N 0 0 384.230 3.005 20 5 GGBDRN CS(=O)(=O)N[C@@H]1CCC[C@H]1CNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000566345700 567152584 /nfs/dbraw/zinc/15/25/84/567152584.db2.gz WTIWWDNLUKBLMY-GZMMTYOYSA-N 0 0 382.269 3.031 20 5 GGBDRN Cc1nc(NC(=O)c2cnc3ncc(Br)cc3c2)ccc1[N+](=O)[O-] ZINC000614991937 567152521 /nfs/dbraw/zinc/15/25/21/567152521.db2.gz MHJWDJNTSXSTOG-UHFFFAOYSA-N 0 0 388.181 3.256 20 5 GGBDRN CCCN(Cc1ccccc1Br)C(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000523354064 567152554 /nfs/dbraw/zinc/15/25/54/567152554.db2.gz JRJULHXZQXLCBD-UHFFFAOYSA-N 0 0 381.230 3.441 20 5 GGBDRN Cc1cc(Br)cn2cc(CCNc3cc(C)c([N+](=O)[O-])cn3)nc12 ZINC000546761905 567154827 /nfs/dbraw/zinc/15/48/27/567154827.db2.gz OMUFBFKMTOBFOC-UHFFFAOYSA-N 0 0 390.241 3.093 20 5 GGBDRN NS(=O)(=O)c1cccc(SCc2cccc(OC(F)F)c2)c1[N+](=O)[O-] ZINC000546759740 567155083 /nfs/dbraw/zinc/15/50/83/567155083.db2.gz MMMMXLUJGLXIBS-UHFFFAOYSA-N 0 0 390.389 3.136 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(Cc2cnn(C)c2)no1 ZINC000589105534 567156938 /nfs/dbraw/zinc/15/69/38/567156938.db2.gz OCLDYXDOGGDBPQ-UHFFFAOYSA-N 0 0 378.186 3.040 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000546777076 567158364 /nfs/dbraw/zinc/15/83/64/567158364.db2.gz MVVQZCDSEGIRBM-SMDDNHRTSA-N 0 0 384.816 3.363 20 5 GGBDRN COc1ccc(Cl)c(S(=O)(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000546795136 567159430 /nfs/dbraw/zinc/15/94/30/567159430.db2.gz SBUHJZIOKZBXEF-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1cc(-c2ccc(F)cc2)no1 ZINC000474345777 567160450 /nfs/dbraw/zinc/16/04/50/567160450.db2.gz ACIRDEZTPCQWEU-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CC[S@](=O)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000523536951 567160902 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O=c1c(Br)cc([N+](=O)[O-])cn1Cc1cc(-c2ccccc2)no1 ZINC000474348885 567162493 /nfs/dbraw/zinc/16/24/93/567162493.db2.gz HPIVXXFTFXWJCW-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(OCC(F)(F)F)cc2)c1 ZINC000589190804 567163996 /nfs/dbraw/zinc/16/39/96/567163996.db2.gz SYXSZDIHDOTPPT-UHFFFAOYSA-N 0 0 376.312 3.337 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(COc2ccc(CO)cc2)c1 ZINC000566531461 567165008 /nfs/dbraw/zinc/16/50/08/567165008.db2.gz NWCLMQIFMQFYML-UHFFFAOYSA-N 0 0 385.157 3.271 20 5 GGBDRN CCN(CCC1CC1)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000546888757 567168061 /nfs/dbraw/zinc/16/80/61/567168061.db2.gz LGQJXCYQIJGFDR-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)c1 ZINC000546879325 567168169 /nfs/dbraw/zinc/16/81/69/567168169.db2.gz YDXBTGJSOHUJOE-LSDHHAIUSA-N 0 0 397.250 3.192 20 5 GGBDRN COc1c(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)oc2ccccc21 ZINC000474397592 567168688 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C[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1noc(C(F)F)n1 ZINC000591783072 567296270 /nfs/dbraw/zinc/29/62/70/567296270.db2.gz DCQHBVIGYIENHY-RXMQYKEDSA-N 0 0 391.128 3.169 20 5 GGBDRN Nc1c(F)c(NC[C@H](O)COc2cccc(Cl)c2Cl)ccc1[N+](=O)[O-] ZINC000476099683 567297030 /nfs/dbraw/zinc/29/70/30/567297030.db2.gz PCSLXTHMTOEBKU-QMMMGPOBSA-N 0 0 390.198 3.475 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCOc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000434193668 567298881 /nfs/dbraw/zinc/29/88/81/567298881.db2.gz LTOKFWQZTQKIBY-UHFFFAOYSA-N 0 0 397.229 3.013 20 5 GGBDRN CCCC(=O)NC1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000591840807 567300681 /nfs/dbraw/zinc/30/06/81/567300681.db2.gz RGZGIMDFMDBSOO-UHFFFAOYSA-N 0 0 384.274 3.238 20 5 GGBDRN COC(=O)C1(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CCCCC1 ZINC000568049976 567300872 /nfs/dbraw/zinc/30/08/72/567300872.db2.gz CIPROXVGLVCVHO-UHFFFAOYSA-N 0 0 399.241 3.271 20 5 GGBDRN COc1ccc(C[NH2+][C@@H](C(=O)[O-])c2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000617345471 567300972 /nfs/dbraw/zinc/30/09/72/567300972.db2.gz WPDGIJBNLVJKRD-OAHLLOKOSA-N 0 0 395.209 3.281 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCSC2(CCOCC2)C1 ZINC000591845463 567301690 /nfs/dbraw/zinc/30/16/90/567301690.db2.gz XXJPVMUZRVXIAE-UHFFFAOYSA-N 0 0 387.299 3.455 20 5 GGBDRN C[C@H]1CN(Cc2ccc(Br)cc2[N+](=O)[O-])C[C@]2(CCCOC2)O1 ZINC000591846120 567302176 /nfs/dbraw/zinc/30/21/76/567302176.db2.gz IMFDRKWSLSHYHT-LRDDRELGSA-N 0 0 385.258 3.127 20 5 GGBDRN COc1c(C(=O)Nc2nc3cc(Br)ccc3[nH]2)cccc1[N+](=O)[O-] ZINC000476214576 567305062 /nfs/dbraw/zinc/30/50/62/567305062.db2.gz CCNPJFULUMATAZ-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN COc1c(C(=O)N(C)Cc2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000476210117 567305116 /nfs/dbraw/zinc/30/51/16/567305116.db2.gz RFHFBYBLKGNNTJ-UHFFFAOYSA-N 0 0 375.328 3.351 20 5 GGBDRN CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000476211531 567305273 /nfs/dbraw/zinc/30/52/73/567305273.db2.gz VHYWTXGPNZKQOJ-NSHDSACASA-N 0 0 395.264 3.424 20 5 GGBDRN CC(C)(C)OC(=O)Cn1cc(Nc2ncc(Br)cc2[N+](=O)[O-])cn1 ZINC000591956598 567305239 /nfs/dbraw/zinc/30/52/39/567305239.db2.gz SXTRZBUWNQAURS-UHFFFAOYSA-N 0 0 398.217 3.034 20 5 GGBDRN CN1CCN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)c2ccc(Br)cc21 ZINC000568120834 567306477 /nfs/dbraw/zinc/30/64/77/567306477.db2.gz INSYXDJWIOWVEY-UHFFFAOYSA-N 0 0 392.209 3.160 20 5 GGBDRN CC[C@@H](Nc1ncc([N+](=O)[O-])cc1Br)C(=O)NCc1cccs1 ZINC000591974973 567306899 /nfs/dbraw/zinc/30/68/99/567306899.db2.gz MHUWGJFPPLGUOY-GFCCVEGCSA-N 0 0 399.270 3.321 20 5 GGBDRN C[C@@H]1Cc2ccc(Br)cc2CN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000500207420 567306939 /nfs/dbraw/zinc/30/69/39/567306939.db2.gz OHYPXYGQVPYOMW-SNVBAGLBSA-N 0 0 378.226 3.283 20 5 GGBDRN Cc1[nH]nc(C(=O)N2CC3(CCC3)c3cc(Br)ccc32)c1[N+](=O)[O-] ZINC000434386980 567306981 /nfs/dbraw/zinc/30/69/81/567306981.db2.gz XAAHKLAJTQRERQ-UHFFFAOYSA-N 0 0 391.225 3.471 20 5 GGBDRN C[C@@H]1SCC[C@@H]1Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000592002739 567308593 /nfs/dbraw/zinc/30/85/93/567308593.db2.gz VRCKVFOZTWXMAA-JSGCOSHPSA-N 0 0 385.511 3.075 20 5 GGBDRN COc1cc(CNc2c(Br)cncc2[N+](=O)[O-])c2ccccc2n1 ZINC000500272372 567310758 /nfs/dbraw/zinc/31/07/58/567310758.db2.gz PLHIOZFLAFZBLG-UHFFFAOYSA-N 0 0 389.209 3.343 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H]2[C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000592060395 567311461 /nfs/dbraw/zinc/31/14/61/567311461.db2.gz LVYLNKYEOOBTKB-WFASDCNBSA-N 0 0 388.873 3.136 20 5 GGBDRN C[C@@H](C(=O)NCCCCn1cc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000527073071 567311551 /nfs/dbraw/zinc/31/15/51/567311551.db2.gz KEMKBOSTWUINTC-GFCCVEGCSA-N 0 0 395.257 3.254 20 5 GGBDRN COCCOc1cc(C)ccc1CNc1c(Br)cncc1[N+](=O)[O-] ZINC000500297267 567311819 /nfs/dbraw/zinc/31/18/19/567311819.db2.gz SIJLGDPBARAXNW-UHFFFAOYSA-N 0 0 396.241 3.120 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC1(c2ccccc2Cl)CC1 ZINC000592067518 567312896 /nfs/dbraw/zinc/31/28/96/567312896.db2.gz YKSITYMRVLMJCS-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN Cc1cc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)ccc1S(C)(=O)=O ZINC000500313357 567313918 /nfs/dbraw/zinc/31/39/18/567313918.db2.gz UTPIZUAEZMCSCM-UHFFFAOYSA-N 0 0 380.447 3.038 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2cc(Br)ccc2OC(C)C)c1[N+](=O)[O-] ZINC000434556298 567314371 /nfs/dbraw/zinc/31/43/71/567314371.db2.gz ZLXCAPVCTCCTEZ-UHFFFAOYSA-N 0 0 383.202 3.428 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC3(C[C@H]2C)CCOCC3)cc1[N+](=O)[O-] ZINC000592102950 567315129 /nfs/dbraw/zinc/31/51/29/567315129.db2.gz DMNTWXMBIBOSQW-LLVKDONJSA-N 0 0 388.873 3.136 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1cc(F)cc(F)c1 ZINC000500398755 567317274 /nfs/dbraw/zinc/31/72/74/567317274.db2.gz NZKOVHNUUDOGGY-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN CCOc1cc(CS(=O)(=O)Cc2ncc(Cl)s2)ccc1[N+](=O)[O-] ZINC000434637405 567317488 /nfs/dbraw/zinc/31/74/88/567317488.db2.gz MUEIIVPRFCNTKB-UHFFFAOYSA-N 0 0 376.843 3.218 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)COc2ccc(F)c(Br)c2)c1 ZINC000568308479 567318252 /nfs/dbraw/zinc/31/82/52/567318252.db2.gz DHVKGWCRKQXFFV-NSHDSACASA-N 0 0 386.173 3.315 20 5 GGBDRN O=C1c2ccc(Br)cc2C(=O)N1CCOc1cccc([N+](=O)[O-])c1 ZINC000434647976 567318287 /nfs/dbraw/zinc/31/82/87/567318287.db2.gz WVPUSCOMZPWGOZ-UHFFFAOYSA-N 0 0 391.177 3.032 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1C(=O)c2ccc(Br)cc2C1=O ZINC000434650892 567318992 /nfs/dbraw/zinc/31/89/92/567318992.db2.gz SQVFHEFCHQRQNR-UHFFFAOYSA-N 0 0 391.177 3.162 20 5 GGBDRN O=C(CNC(=O)c1ccc(Cl)cc1Cl)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000527179823 567319018 /nfs/dbraw/zinc/31/90/18/567319018.db2.gz DZKAJKDOYFTLRY-UHFFFAOYSA-N 0 0 386.166 3.409 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000434649341 567319183 /nfs/dbraw/zinc/31/91/83/567319183.db2.gz XCNRPHQJXRJITA-UHFFFAOYSA-N 0 0 389.209 3.061 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1cccc(Br)c1 ZINC000476366595 567319207 /nfs/dbraw/zinc/31/92/07/567319207.db2.gz WXZUPWFRFCOVDA-GFCCVEGCSA-N 0 0 379.214 3.068 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCC2CCSCC2)c([N+](=O)[O-])c1 ZINC000500426419 567320838 /nfs/dbraw/zinc/32/08/38/567320838.db2.gz PNKNXXAPQSJOFP-UHFFFAOYSA-N 0 0 387.527 3.180 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H](CO)c1c(Cl)cccc1Cl ZINC000527222549 567321411 /nfs/dbraw/zinc/32/14/11/567321411.db2.gz CBDYXKMBUXICAB-CQSZACIVSA-N 0 0 384.219 3.434 20 5 GGBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN(C)CC(F)F ZINC000527256243 567325391 /nfs/dbraw/zinc/32/53/91/567325391.db2.gz NPKWDGUHSUTLQS-UHFFFAOYSA-N 0 0 375.441 3.366 20 5 GGBDRN O=C(NC[C@@H](CO)CC1CCCC1)c1ccc([N+](=O)[O-])cc1Br ZINC000500494705 567325857 /nfs/dbraw/zinc/32/58/57/567325857.db2.gz FDKIIWMKPGWSNL-LBPRGKRZSA-N 0 0 385.258 3.276 20 5 GGBDRN CNc1ccc(C(=O)N[C@H](CO)c2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000527278258 567326485 /nfs/dbraw/zinc/32/64/85/567326485.db2.gz NFTQJGVQUJGWOE-CYBMUJFWSA-N 0 0 384.219 3.407 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cc(C(C)=O)ccc1Cl ZINC000476483008 567327087 /nfs/dbraw/zinc/32/70/87/567327087.db2.gz OEFYGTMQLWNMPI-UHFFFAOYSA-N 0 0 384.797 3.260 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSc1nnc(Cc2c(F)cccc2Cl)o1 ZINC000476486688 567328756 /nfs/dbraw/zinc/32/87/56/567328756.db2.gz RPAIWOJCVTVWNP-UHFFFAOYSA-N 0 0 383.792 3.387 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1COc1c(Br)cccc1Br ZINC000476500779 567328790 /nfs/dbraw/zinc/32/87/90/567328790.db2.gz XIYIUBLGGMYWGA-UHFFFAOYSA-N 0 0 391.019 3.432 20 5 GGBDRN Cc1cccc(F)c1S(=O)(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000476507453 567330117 /nfs/dbraw/zinc/33/01/17/567330117.db2.gz ICZWARMKANHPBY-INIZCTEOSA-N 0 0 382.438 3.479 20 5 GGBDRN CNc1nc(C(=O)N(C)Cc2ccc(Br)cc2C)ccc1[N+](=O)[O-] ZINC000456037597 567333308 /nfs/dbraw/zinc/33/33/08/567333308.db2.gz LELYSPWRADPFTF-UHFFFAOYSA-N 0 0 393.241 3.375 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1CO ZINC000617783475 567334299 /nfs/dbraw/zinc/33/42/99/567334299.db2.gz JWYGBHXPPAKMOH-LLVKDONJSA-N 0 0 388.203 3.213 20 5 GGBDRN C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000434908315 567334921 /nfs/dbraw/zinc/33/49/21/567334921.db2.gz ZNWNLUQTJUZBAS-QMTHXVAHSA-N 0 0 385.251 3.078 20 5 GGBDRN C[C@H]1c2c(Cl)cc(Cl)cc2CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000434908314 567335013 /nfs/dbraw/zinc/33/50/13/567335013.db2.gz ZNWNLUQTJUZBAS-IINYFYTJSA-N 0 0 385.251 3.078 20 5 GGBDRN COC(=O)C[C@H]1CCCN1c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000434959365 567335727 /nfs/dbraw/zinc/33/57/27/567335727.db2.gz USLJOYLABXKXRM-LLVKDONJSA-N 0 0 394.225 3.437 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(F)(F)F ZINC000476574634 567336285 /nfs/dbraw/zinc/33/62/85/567336285.db2.gz NDWLHHSJJHEOSG-ZCFIWIBFSA-N 0 0 380.266 3.090 20 5 GGBDRN O=C(NCc1cccc(Cl)c1Cl)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000527460057 567336510 /nfs/dbraw/zinc/33/65/10/567336510.db2.gz ONQSJTNLEMIDLB-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN C[C@@H]1SCCN(c2nnc(CSc3ccccc3[N+](=O)[O-])n2C)[C@H]1C ZINC000592402469 567336857 /nfs/dbraw/zinc/33/68/57/567336857.db2.gz HLXUZKHMZHMBHJ-RYUDHWBXSA-N 0 0 379.511 3.346 20 5 GGBDRN CN(Cc1cscn1)c1nnc(CSc2ccccc2[N+](=O)[O-])n1C ZINC000592404344 567336893 /nfs/dbraw/zinc/33/68/93/567336893.db2.gz XSUKRNBBEBUYSQ-UHFFFAOYSA-N 0 0 376.467 3.109 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCCCc1ccc(Cl)cc1 ZINC000500671947 567338302 /nfs/dbraw/zinc/33/83/02/567338302.db2.gz RMLGRJQTBUUHMW-UHFFFAOYSA-N 0 0 382.869 3.343 20 5 GGBDRN C[C@H](CCc1ccc(Br)cc1)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000500672226 567338799 /nfs/dbraw/zinc/33/87/99/567338799.db2.gz YHGOWJPFHNSQEY-LLVKDONJSA-N 0 0 380.242 3.447 20 5 GGBDRN CC(C)(C(=O)NC/C=C/c1ccc(Br)cc1)n1cc([N+](=O)[O-])cn1 ZINC000456096168 567339340 /nfs/dbraw/zinc/33/93/40/567339340.db2.gz LRSZSUNGYLHUQQ-ONEGZZNKSA-N 0 0 393.241 3.119 20 5 GGBDRN CC(=O)N(C[C@H]1CCCN1c1ccc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000617840231 567340205 /nfs/dbraw/zinc/34/02/05/567340205.db2.gz APZGJNTYPCZXGW-CQSZACIVSA-N 0 0 382.258 3.337 20 5 GGBDRN COc1c(C(=O)NCCNc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000476629812 567341166 /nfs/dbraw/zinc/34/11/66/567341166.db2.gz GSSIBRPWFDAFHJ-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN CCN(CC(=O)Nc1c(Cl)cccc1Cl)Cc1c([N+](=O)[O-])ncn1C ZINC000476656796 567342861 /nfs/dbraw/zinc/34/28/61/567342861.db2.gz IEZMSAQGWDYIAT-UHFFFAOYSA-N 0 0 386.239 3.096 20 5 GGBDRN Cc1cc(Br)cn2cc(CCNc3ccc([N+](=O)[O-])c(C)n3)nc12 ZINC000548691782 567343515 /nfs/dbraw/zinc/34/35/15/567343515.db2.gz RKVSKCCSIDOCMU-UHFFFAOYSA-N 0 0 390.241 3.093 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000476668678 567343631 /nfs/dbraw/zinc/34/36/31/567343631.db2.gz XCJQXMOJIFMBIA-UHFFFAOYSA-N 0 0 380.857 3.379 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N(Cc1cc(Br)ccc1F)C1CC1 ZINC000500785790 567344215 /nfs/dbraw/zinc/34/42/15/567344215.db2.gz LNHZRNDJOTUHOA-UHFFFAOYSA-N 0 0 397.204 3.035 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccc(Cl)c(CN(C)C)c1 ZINC000500789170 567345744 /nfs/dbraw/zinc/34/57/44/567345744.db2.gz YDWHQCFUPJPWRU-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN Cc1cccc(S(=O)(=O)N2CCc3c2cccc3[N+](=O)[O-])c1Br ZINC000435212646 567347667 /nfs/dbraw/zinc/34/76/67/567347667.db2.gz GZRPNADZSUJIEL-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)Cn1cc(Br)cn1 ZINC000456173484 567347965 /nfs/dbraw/zinc/34/79/65/567347965.db2.gz GOMICYWDFJZKFZ-UHFFFAOYSA-N 0 0 382.218 3.013 20 5 GGBDRN COC(=O)[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1 ZINC000500836954 567348181 /nfs/dbraw/zinc/34/81/81/567348181.db2.gz GYSJZCCZIYRRLF-MRXNPFEDSA-N 0 0 393.237 3.404 20 5 GGBDRN COC(=O)[C@@H](NCCc1ccccc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000500846224 567349120 /nfs/dbraw/zinc/34/91/20/567349120.db2.gz IJEHVUFSXJAOFG-INIZCTEOSA-N 0 0 393.237 3.404 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21 ZINC000435215248 567349662 /nfs/dbraw/zinc/34/96/62/567349662.db2.gz HQIKEFWKBZIJEG-UHOFOFEASA-N 0 0 378.837 3.255 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12 ZINC000435215063 567349792 /nfs/dbraw/zinc/34/97/92/567349792.db2.gz HQIKEFWKBZIJEG-APHBMKBZSA-N 0 0 378.837 3.255 20 5 GGBDRN C[C@@H](CC(=O)N1CCCc2c([N+](=O)[O-])cccc21)n1cc(Br)cn1 ZINC000592614943 567350251 /nfs/dbraw/zinc/35/02/51/567350251.db2.gz UEYKWKSVDPWQEN-NSHDSACASA-N 0 0 393.241 3.484 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCCc1ccc(F)cc1Cl ZINC000500914899 567353506 /nfs/dbraw/zinc/35/35/06/567353506.db2.gz QUQRHAPVBPHVNN-UHFFFAOYSA-N 0 0 386.832 3.092 20 5 GGBDRN O=C1N[C@@H](c2ccc(Br)cc2)C(=O)N1Cc1cccc([N+](=O)[O-])c1 ZINC000548825490 567353919 /nfs/dbraw/zinc/35/39/19/567353919.db2.gz XRZSJCBOQGDOGL-AWEZNQCLSA-N 0 0 390.193 3.150 20 5 GGBDRN Cc1c(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cnn1[C@@H]1CCOC1 ZINC000456254262 567354517 /nfs/dbraw/zinc/35/45/17/567354517.db2.gz IPHSYRHQZOPBNG-GFCCVEGCSA-N 0 0 395.213 3.076 20 5 GGBDRN Cc1c(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cnn1[C@H]1CCOC1 ZINC000456254265 567354736 /nfs/dbraw/zinc/35/47/36/567354736.db2.gz IPHSYRHQZOPBNG-LBPRGKRZSA-N 0 0 395.213 3.076 20 5 GGBDRN C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000568770678 567355043 /nfs/dbraw/zinc/35/50/43/567355043.db2.gz LDPDCRGFMMUZEA-JMCQJSRRSA-N 0 0 397.254 3.293 20 5 GGBDRN Cc1c(NC(=O)N2CCC[C@H](C)[C@H]2CO)cc(Br)cc1[N+](=O)[O-] ZINC000435322223 567355159 /nfs/dbraw/zinc/35/51/59/567355159.db2.gz BATDKKIJWAHLBQ-LKFCYVNXSA-N 0 0 386.246 3.290 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2CCC[C@]2(C)CO)cc(Br)cc1[N+](=O)[O-] ZINC000435322539 567355167 /nfs/dbraw/zinc/35/51/67/567355167.db2.gz DQDMUAIMCDEUMY-UKRRQHHQSA-N 0 0 386.246 3.338 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCc1cccs1 ZINC000592692143 567355487 /nfs/dbraw/zinc/35/54/87/567355487.db2.gz OADDIMZNHNGVNM-CQSZACIVSA-N 0 0 381.841 3.135 20 5 GGBDRN C[C@H]1CC2(CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br)CCOCC2 ZINC000592718450 567356918 /nfs/dbraw/zinc/35/69/18/567356918.db2.gz ALPUVGXWFGMHMQ-LBPRGKRZSA-N 0 0 397.269 3.317 20 5 GGBDRN O=C(COc1ccc(Br)cc1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000500994416 567357431 /nfs/dbraw/zinc/35/74/31/567357431.db2.gz JZCCKWBZBLXKEA-UHFFFAOYSA-N 0 0 395.165 3.104 20 5 GGBDRN COc1cnc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c(Br)c1 ZINC000568811882 567357773 /nfs/dbraw/zinc/35/77/73/567357773.db2.gz ZRFQQEDVDMMAGZ-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1N1CCC(n3cc(Br)cn3)CC1)CCN2 ZINC000618153252 567357999 /nfs/dbraw/zinc/35/79/99/567357999.db2.gz YBTPDGLJKPZWQI-UHFFFAOYSA-N 0 0 392.257 3.363 20 5 GGBDRN CCc1noc(C)c1CNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000501007924 567358607 /nfs/dbraw/zinc/35/86/07/567358607.db2.gz ZYBACQMYDZXMGL-UHFFFAOYSA-N 0 0 382.214 3.455 20 5 GGBDRN C[C@@H]1SCC[C@@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000592737357 567359075 /nfs/dbraw/zinc/35/90/75/567359075.db2.gz WIMICLXVPMTMSK-ONGXEEELSA-N 0 0 377.388 3.426 20 5 GGBDRN C[C@H]1SCC[C@@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000592737353 567359336 /nfs/dbraw/zinc/35/93/36/567359336.db2.gz WIMICLXVPMTMSK-KOLCDFICSA-N 0 0 377.388 3.426 20 5 GGBDRN CCN(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000501073111 567362627 /nfs/dbraw/zinc/36/26/27/567362627.db2.gz DSOJYMSHJREUIY-UHFFFAOYSA-N 0 0 382.825 3.318 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000456316243 567362530 /nfs/dbraw/zinc/36/25/30/567362530.db2.gz KGKKHVIPAVCRDK-MBNYWOFBSA-N 0 0 384.885 3.350 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000456333884 567363713 /nfs/dbraw/zinc/36/37/13/567363713.db2.gz LYSVYEXZPXBAKM-MBNYWOFBSA-N 0 0 397.269 3.289 20 5 GGBDRN COc1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)ncc1Br ZINC000477006091 567363801 /nfs/dbraw/zinc/36/38/01/567363801.db2.gz VCJFQCNDSRFRTO-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000435432921 567364101 /nfs/dbraw/zinc/36/41/01/567364101.db2.gz LLWKHQHCXJBWMD-PRHODGIISA-N 0 0 388.779 3.361 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](C)n2ccnc21 ZINC000456349533 567365326 /nfs/dbraw/zinc/36/53/26/567365326.db2.gz ADZPXECXTWIRGB-OQPBUACISA-N 0 0 379.214 3.298 20 5 GGBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H](C)n1cc(Br)cn1 ZINC000592825755 567366030 /nfs/dbraw/zinc/36/60/30/567366030.db2.gz HLAHJGBDHBIAAV-VIFPVBQESA-N 0 0 382.218 3.185 20 5 GGBDRN CCOC(=O)C[C@H](C)N(C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501108660 567366195 /nfs/dbraw/zinc/36/61/95/567366195.db2.gz QWMSHOHYOZNKDU-VIFPVBQESA-N 0 0 388.218 3.163 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nnc(-c3ccccc3Cl)o2)cc1 ZINC000477051693 567366484 /nfs/dbraw/zinc/36/64/84/567366484.db2.gz VPSXASTYMVLZBQ-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Sc1cccs1)[C@H]1CCS(=O)(=O)C1 ZINC000435441593 567367628 /nfs/dbraw/zinc/36/76/28/567367628.db2.gz CWGSQBOFFUGKKM-JTQLQIEISA-N 0 0 398.487 3.181 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccnc(C)c2Br)c1 ZINC000549006424 567368189 /nfs/dbraw/zinc/36/81/89/567368189.db2.gz HQDRFIHBCYRTFM-UHFFFAOYSA-N 0 0 380.198 3.134 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1cc(Br)cnc1N ZINC000477071032 567368237 /nfs/dbraw/zinc/36/82/37/567368237.db2.gz RFHJHKNYBBDXEH-UHFFFAOYSA-N 0 0 394.229 3.103 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000501154722 567369372 /nfs/dbraw/zinc/36/93/72/567369372.db2.gz LFABLZGHLOPZPW-NXEZZACHSA-N 0 0 377.260 3.024 20 5 GGBDRN CCOC(=O)[C@@H]1CCC[C@@H]1NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000456409458 567372134 /nfs/dbraw/zinc/37/21/34/567372134.db2.gz UKKRUEPLCBIIPI-NEPJUHHUSA-N 0 0 386.857 3.188 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1cccc(Br)c1Cl ZINC000549062928 567372343 /nfs/dbraw/zinc/37/23/43/567372343.db2.gz ZURWXHYNDRAFKR-UHFFFAOYSA-N 0 0 388.609 3.029 20 5 GGBDRN O=c1ccn(Cc2ccc(I)c(Cl)c2)cc1[N+](=O)[O-] ZINC000435496143 567373137 /nfs/dbraw/zinc/37/31/37/567373137.db2.gz QJTOUIRPHMHFCF-UHFFFAOYSA-N 0 0 390.564 3.063 20 5 GGBDRN COc1cc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)ccc1Cl ZINC000569023786 567374038 /nfs/dbraw/zinc/37/40/38/567374038.db2.gz YYDIFSUUYSFYQM-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2C[C@@H](C)n3ccnc32)cc1[N+](=O)[O-] ZINC000456420962 567374360 /nfs/dbraw/zinc/37/43/60/567374360.db2.gz MWOSEGYNGZJUDI-PELKAZGASA-N 0 0 379.214 3.298 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@H](c2ccc(Br)cc2)C1 ZINC000569042936 567375025 /nfs/dbraw/zinc/37/50/25/567375025.db2.gz FDDBWGDSDFISDJ-AWEZNQCLSA-N 0 0 395.257 3.460 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@@H]2C[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000435570181 567375556 /nfs/dbraw/zinc/37/55/56/567375556.db2.gz MKGAJLLAFVGFCO-DZGCQCFKSA-N 0 0 381.841 3.124 20 5 GGBDRN CC(C)c1ncsc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000456456324 567375781 /nfs/dbraw/zinc/37/57/81/567375781.db2.gz NTAVKKBZXSGSRO-UHFFFAOYSA-N 0 0 382.829 3.197 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCc1ccn2ccnc2c1 ZINC000549143333 567375826 /nfs/dbraw/zinc/37/58/26/567375826.db2.gz YHALHLMTVHRXGB-UHFFFAOYSA-N 0 0 394.172 3.459 20 5 GGBDRN Cc1nn(C)c2ncc(NC(=O)c3sc(Br)cc3[N+](=O)[O-])cc12 ZINC000618345138 567376123 /nfs/dbraw/zinc/37/61/23/567376123.db2.gz TYDCQABYABMNGJ-UHFFFAOYSA-N 0 0 396.226 3.261 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@H]2CCCN2C2CCCCC2)s1 ZINC000435592224 567377159 /nfs/dbraw/zinc/37/71/59/567377159.db2.gz JWLATCUSDJPYIA-CYBMUJFWSA-N 0 0 387.527 3.269 20 5 GGBDRN O=C(N[C@H](c1ccc(Br)cc1)C1CCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000549176628 567377459 /nfs/dbraw/zinc/37/74/59/567377459.db2.gz OUHTXYXIROZZBW-ZDUSSCGKSA-N 0 0 379.214 3.352 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCc2c(F)cccc2Cl)c([N+](=O)[O-])c1 ZINC000477178058 567377695 /nfs/dbraw/zinc/37/76/95/567377695.db2.gz CNOOARZBOAOEOO-UHFFFAOYSA-N 0 0 387.820 3.250 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CC[C@H](COC(F)F)C1 ZINC000549195010 567378111 /nfs/dbraw/zinc/37/81/11/567378111.db2.gz VULJDNZQSAYGMQ-QMMMGPOBSA-N 0 0 398.147 3.265 20 5 GGBDRN O=[N+]([O-])c1cccc2ncnc(NCc3cc(Br)ccc3F)c21 ZINC000549192803 567378531 /nfs/dbraw/zinc/37/85/31/567378531.db2.gz GVWWYOJFTAVBCC-UHFFFAOYSA-N 0 0 377.173 3.474 20 5 GGBDRN CSc1ccc(CCNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000435608670 567379671 /nfs/dbraw/zinc/37/96/71/567379671.db2.gz VWVNRGOHQUBCEN-UHFFFAOYSA-N 0 0 380.491 3.021 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000477200795 567380626 /nfs/dbraw/zinc/38/06/26/567380626.db2.gz YJHQQLBGLCGQDU-UHFFFAOYSA-N 0 0 383.857 3.153 20 5 GGBDRN C[C@@H]1CC(CCNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000549240687 567380705 /nfs/dbraw/zinc/38/07/05/567380705.db2.gz HJABIRRNTULHLV-GHMZBOCLSA-N 0 0 376.862 3.120 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CCC[C@H]1OC(F)F ZINC000501345685 567381482 /nfs/dbraw/zinc/38/14/82/567381482.db2.gz APCPNHZIIPWQLC-MKPLZMMCSA-N 0 0 378.759 3.292 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CCC[C@H]1OC(F)F ZINC000501345684 567381881 /nfs/dbraw/zinc/38/18/81/567381881.db2.gz APCPNHZIIPWQLC-HLUHBDAQSA-N 0 0 378.759 3.292 20 5 GGBDRN CS(=O)(=O)C1(CNc2ccc([N+](=O)[O-])cc2Br)CCCC1 ZINC000569154382 567382213 /nfs/dbraw/zinc/38/22/13/567382213.db2.gz FXVXNVVDFULDGJ-UHFFFAOYSA-N 0 0 377.260 3.127 20 5 GGBDRN O=C(NCCO)c1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])cc1Cl ZINC000435659919 567383300 /nfs/dbraw/zinc/38/33/00/567383300.db2.gz PQEPBSXKJDZTSI-UHFFFAOYSA-N 0 0 384.219 3.236 20 5 GGBDRN Cc1cc(Br)cc(C)c1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000477267861 567384324 /nfs/dbraw/zinc/38/43/24/567384324.db2.gz UHCRQZGKQHYFGB-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN CN(c1ccc(O)cc1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000435722807 567385578 /nfs/dbraw/zinc/38/55/78/567385578.db2.gz OTBUBUHKTUXGDZ-UHFFFAOYSA-N 0 0 377.205 3.432 20 5 GGBDRN Cc1nccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1Cl ZINC000618393452 567386269 /nfs/dbraw/zinc/38/62/69/567386269.db2.gz UCBAQBSLBRSELS-UHFFFAOYSA-N 0 0 376.619 3.450 20 5 GGBDRN O=C(Nc1ccccc1-n1cncn1)c1sc(Br)cc1[N+](=O)[O-] ZINC000618398475 567386493 /nfs/dbraw/zinc/38/64/93/567386493.db2.gz QOQGQKLHUOCMLS-UHFFFAOYSA-N 0 0 394.210 3.252 20 5 GGBDRN CC(C)c1nnc([C@@H](C)NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[nH]1 ZINC000477323787 567387896 /nfs/dbraw/zinc/38/78/96/567387896.db2.gz QHHKMGIUWGZEDU-MRVPVSSYSA-N 0 0 382.218 3.090 20 5 GGBDRN CC(C)c1nnc([C@@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000477325993 567387937 /nfs/dbraw/zinc/38/79/37/567387937.db2.gz VFZVZFYAWRYERN-SECBINFHSA-N 0 0 396.245 3.019 20 5 GGBDRN C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](CO)c1cccc(Br)c1 ZINC000501429282 567389034 /nfs/dbraw/zinc/38/90/34/567389034.db2.gz XINWOTHXSNKVPH-QGZVFWFLSA-N 0 0 395.253 3.402 20 5 GGBDRN COC(=O)c1[nH]c(C)cc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000618454439 567389298 /nfs/dbraw/zinc/38/92/98/567389298.db2.gz PMAYREHCPYWRBJ-UHFFFAOYSA-N 0 0 388.199 3.094 20 5 GGBDRN Cc1csc([C@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C(F)(F)F)n1 ZINC000593167212 567392112 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COCCCSc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000435989673 567399221 /nfs/dbraw/zinc/39/92/21/567399221.db2.gz MGRFTUXDQLVETO-UHFFFAOYSA-N 0 0 388.511 3.288 20 5 GGBDRN Cc1sc(S(=O)(=O)N(CCO)c2cccc(C(C)C)c2)cc1[N+](=O)[O-] ZINC000593218280 567400028 /nfs/dbraw/zinc/40/00/28/567400028.db2.gz QMBZKTBDFBGDFM-UHFFFAOYSA-N 0 0 384.479 3.276 20 5 GGBDRN CN(C)c1ccccc1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000569382823 567400678 /nfs/dbraw/zinc/40/06/78/567400678.db2.gz GSFZZHGVWNHFLQ-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc(Br)c(Cl)c1F ZINC000436012445 567401379 /nfs/dbraw/zinc/40/13/79/567401379.db2.gz IVSCOPNIEFAJBL-UHFFFAOYSA-N 0 0 377.557 3.136 20 5 GGBDRN COc1ccc(Br)c(CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 ZINC000549619924 567401544 /nfs/dbraw/zinc/40/15/44/567401544.db2.gz SZKGDPRAKQNXOK-UHFFFAOYSA-N 0 0 391.177 3.162 20 5 GGBDRN CS(=O)(=O)c1ccc(CNc2cccnc2[N+](=O)[O-])cc1C(F)(F)F ZINC000618585794 567402076 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GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](C)Sc2ccccc21 ZINC000619468114 567456117 /nfs/dbraw/zinc/45/61/17/567456117.db2.gz YDDSJNCEKWULDO-NSHDSACASA-N 0 0 380.447 3.293 20 5 GGBDRN CN(C)Cc1csc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)n1 ZINC000457314154 567456489 /nfs/dbraw/zinc/45/64/89/567456489.db2.gz MVAZPJKDOKSRDR-UHFFFAOYSA-N 0 0 399.270 3.057 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H]1CCSc2ccccc21 ZINC000619473777 567457094 /nfs/dbraw/zinc/45/70/94/567457094.db2.gz LUWAVTKPZVXNCO-LBPRGKRZSA-N 0 0 380.447 3.119 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H]1CCSc2ccccc21 ZINC000619473776 567457391 /nfs/dbraw/zinc/45/73/91/567457391.db2.gz LUWAVTKPZVXNCO-GFCCVEGCSA-N 0 0 380.447 3.119 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1csc2ccccc12 ZINC000619476962 567457568 /nfs/dbraw/zinc/45/75/68/567457568.db2.gz JOHCZDAIEUJFKD-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCCSc1ccccc1 ZINC000619473169 567457881 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O=[N+]([O-])c1cc(Br)ccc1NC[C@@H]1CCC2(CCOCC2)[C@H]1O ZINC000619793179 567481593 /nfs/dbraw/zinc/48/15/93/567481593.db2.gz GYKMJBPOPHHKRN-NHYWBVRUSA-N 0 0 385.258 3.337 20 5 GGBDRN O=C(CSCCC(F)(F)F)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000478764342 567481789 /nfs/dbraw/zinc/48/17/89/567481789.db2.gz IDVVBPWGWKRXEG-UHFFFAOYSA-N 0 0 380.344 3.380 20 5 GGBDRN CCc1nn(C)c(N2CCOc3ccc(Br)cc3C2)c1[N+](=O)[O-] ZINC000619793676 567481942 /nfs/dbraw/zinc/48/19/42/567481942.db2.gz UDAOIRPXLWIQOF-UHFFFAOYSA-N 0 0 381.230 3.052 20 5 GGBDRN CC[C@@H]1Cc2c(Br)cccc2CN1CCn1ccc([N+](=O)[O-])n1 ZINC000570392941 567482003 /nfs/dbraw/zinc/48/20/03/567482003.db2.gz TWCICCOAORXMCG-CYBMUJFWSA-N 0 0 379.258 3.391 20 5 GGBDRN CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1ccnc(N)c1[N+](=O)[O-] ZINC000570410333 567482966 /nfs/dbraw/zinc/48/29/66/567482966.db2.gz VGUGYAIAHPWWEP-NSHDSACASA-N 0 0 383.235 3.460 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCS[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000437222769 567483639 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O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000437288901 567488123 /nfs/dbraw/zinc/48/81/23/567488123.db2.gz FHCQCPUECUCRPA-OLZOCXBDSA-N 0 0 380.388 3.383 20 5 GGBDRN COc1cc(COc2ccc(I)cc2[N+](=O)[O-])ccn1 ZINC000478896288 567489863 /nfs/dbraw/zinc/48/98/63/567489863.db2.gz HJZCLLLRJQCLQD-UHFFFAOYSA-N 0 0 386.145 3.182 20 5 GGBDRN CC(C)[C@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000594602133 567490163 /nfs/dbraw/zinc/49/01/63/567490163.db2.gz XDAPCARQSQHUBO-JTQLQIEISA-N 0 0 392.499 3.086 20 5 GGBDRN CN(Cc1cccc(Br)c1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000503499764 567490183 /nfs/dbraw/zinc/49/01/83/567490183.db2.gz HQAWIDZNDQYQDJ-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN COC(=O)C1(N(C)C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CCCC1 ZINC000570533108 567493241 /nfs/dbraw/zinc/49/32/41/567493241.db2.gz QWHVTQHGNMFTAF-UHFFFAOYSA-N 0 0 399.241 3.224 20 5 GGBDRN CC[C@H](C)N(CC(=O)OC)C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000551285190 567493664 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CN(C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000570651359 567502018 /nfs/dbraw/zinc/50/20/18/567502018.db2.gz SWZJWCCVUUOICA-LLVKDONJSA-N 0 0 378.372 3.343 20 5 GGBDRN CCc1cc(Br)ccc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000479078151 567502656 /nfs/dbraw/zinc/50/26/56/567502656.db2.gz NFKTXQBVXHTWTQ-UHFFFAOYSA-N 0 0 381.230 3.490 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CCN(CC(F)(F)F)C1 ZINC000570664986 567503721 /nfs/dbraw/zinc/50/37/21/567503721.db2.gz NVGQCUXLUHIOSO-QMMMGPOBSA-N 0 0 381.738 3.083 20 5 GGBDRN C[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)[C@H]1C ZINC000551423524 567504817 /nfs/dbraw/zinc/50/48/17/567504817.db2.gz KUXLUQLPDUHUKV-ISTVAULSSA-N 0 0 398.257 3.237 20 5 GGBDRN Cn1cnnc1Sc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1Cl ZINC000503766513 567505520 /nfs/dbraw/zinc/50/55/20/567505520.db2.gz STFWRZULOIMZDG-UHFFFAOYSA-N 0 0 378.801 3.108 20 5 GGBDRN C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000479127186 567505721 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C[C@H]1CCC[C@H](NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000551483555 567510275 /nfs/dbraw/zinc/51/02/75/567510275.db2.gz NCZRQDPAAWBXEX-JQWIXIFHSA-N 0 0 398.257 3.381 20 5 GGBDRN CC1(C)CCN(S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])CCS1 ZINC000594770028 567510716 /nfs/dbraw/zinc/51/07/16/567510716.db2.gz NINSQGPQBPRTHT-UHFFFAOYSA-N 0 0 381.479 3.049 20 5 GGBDRN CC[C@@H](CC(F)(F)F)NS(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000594767011 567510819 /nfs/dbraw/zinc/51/08/19/567510819.db2.gz AJUOVSCELUYXAE-VIFPVBQESA-N 0 0 377.344 3.152 20 5 GGBDRN C[C@H](CC(F)(F)F)CS(=O)(=O)n1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000594773342 567510884 /nfs/dbraw/zinc/51/08/84/567510884.db2.gz QBEPLOXGBITJGK-SNVBAGLBSA-N 0 0 377.344 3.225 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]2CCC[C@@H]21 ZINC000551496992 567511770 /nfs/dbraw/zinc/51/17/70/567511770.db2.gz UWFTYSSVVSBFCN-HZMBPMFUSA-N 0 0 396.241 3.087 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1cc(F)ccc1Cl ZINC000594781493 567512076 /nfs/dbraw/zinc/51/20/76/567512076.db2.gz UATGNWLVNMLMEB-UHFFFAOYSA-N 0 0 386.832 3.392 20 5 GGBDRN CS[C@@H]1CCCCN(S(=O)(=O)c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000594774520 567512390 /nfs/dbraw/zinc/51/23/90/567512390.db2.gz FYZCMGRYTDBXPG-GFCCVEGCSA-N 0 0 381.479 3.049 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000570790649 567513865 /nfs/dbraw/zinc/51/38/65/567513865.db2.gz KRUYNZXZMFAMHP-TZMCWYRMSA-N 0 0 381.841 3.258 20 5 GGBDRN CS[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000594795929 567513950 /nfs/dbraw/zinc/51/39/50/567513950.db2.gz OIIWYSOXTJJHFR-ZIAGYGMSSA-N 0 0 381.479 3.096 20 5 GGBDRN CSCC1(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000594815952 567515781 /nfs/dbraw/zinc/51/57/81/567515781.db2.gz LCGAPDAXASFBRB-UHFFFAOYSA-N 0 0 398.428 3.425 20 5 GGBDRN COC(=O)[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000479232828 567517673 /nfs/dbraw/zinc/51/76/73/567517673.db2.gz ADGRNEWUNADDEP-HNNXBMFYSA-N 0 0 386.191 3.048 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCc3ccc(Br)cc3C2)c1 ZINC000551555260 567517879 /nfs/dbraw/zinc/51/78/79/567517879.db2.gz WEYZNILTISGANT-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN COc1cc(S(=O)(=O)NC(C)(C)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000551571404 567518610 /nfs/dbraw/zinc/51/86/10/567518610.db2.gz GSWLYRDAIISLCQ-UHFFFAOYSA-N 0 0 384.841 3.470 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1ccc(Br)c(O)c1 ZINC000570874152 567519851 /nfs/dbraw/zinc/51/98/51/567519851.db2.gz QNTBAMDFTHOJJI-UHFFFAOYSA-N 0 0 379.210 3.378 20 5 GGBDRN COC(=O)[C@](C)(NC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000479262746 567520593 /nfs/dbraw/zinc/52/05/93/567520593.db2.gz XFGJSYKAPXFXTC-OAHLLOKOSA-N 0 0 386.191 3.048 20 5 GGBDRN CCOC[C@H]1CCCCN1C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000458090235 567521287 /nfs/dbraw/zinc/52/12/87/567521287.db2.gz OTJQTNYITPKHGD-SECBINFHSA-N 0 0 377.260 3.450 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC([C@H]2CCCCO2)CC1 ZINC000594867891 567521940 /nfs/dbraw/zinc/52/19/40/567521940.db2.gz SWSBSCXVIXLKEC-OAHLLOKOSA-N 0 0 388.873 3.218 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]([C@@H]3CCCCO3)C2)c(Cl)c1 ZINC000594870408 567522032 /nfs/dbraw/zinc/52/20/32/567522032.db2.gz BJKMPRMAGJTONJ-WFASDCNBSA-N 0 0 388.873 3.218 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000594872162 567523554 /nfs/dbraw/zinc/52/35/54/567523554.db2.gz VODBFFBVQHCJKO-SWLSCSKDSA-N 0 0 388.873 3.218 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ncc(Br)cn1 ZINC000570939426 567523757 /nfs/dbraw/zinc/52/37/57/567523757.db2.gz HGHSGXLQRKFYLT-GFCCVEGCSA-N 0 0 393.241 3.379 20 5 GGBDRN CCc1nc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[nH]c(=O)c1C ZINC000594905005 567525329 /nfs/dbraw/zinc/52/53/29/567525329.db2.gz LVOZOEQGJVPPCE-UHFFFAOYSA-N 0 0 382.829 3.345 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1-c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000504223656 567525443 /nfs/dbraw/zinc/52/54/43/567525443.db2.gz VUUUBAXZYIJEIZ-UHFFFAOYSA-N 0 0 377.154 3.483 20 5 GGBDRN O=c1onc(-c2cccc(Br)c2)n1Cc1ccccc1[N+](=O)[O-] ZINC000504196639 567525451 /nfs/dbraw/zinc/52/54/51/567525451.db2.gz WDYQFXBZGGPXBO-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=c1onc(-c2cccc(Br)c2)n1Cc1ccc([N+](=O)[O-])cc1 ZINC000504217903 567525511 /nfs/dbraw/zinc/52/55/11/567525511.db2.gz DSOPVIPOPUAMGN-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1NCc1cc(Br)ccc1OC(F)F ZINC000504197142 567525889 /nfs/dbraw/zinc/52/58/89/567525889.db2.gz ZIONXLUFHCFJOD-UHFFFAOYSA-N 0 0 377.145 3.304 20 5 GGBDRN O=C(CCCNC(=O)c1ccco1)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000551669893 567528292 /nfs/dbraw/zinc/52/82/92/567528292.db2.gz LLMKFRAAFBAQGO-UHFFFAOYSA-N 0 0 396.197 3.099 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CC[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000479391924 567530928 /nfs/dbraw/zinc/53/09/28/567530928.db2.gz OKGZTMJJFKLHSG-LLVKDONJSA-N 0 0 389.271 3.086 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1N(C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000551723024 567531216 /nfs/dbraw/zinc/53/12/16/567531216.db2.gz CHEUKNQNBFVABW-YGRLFVJLSA-N 0 0 398.257 3.333 20 5 GGBDRN C[C@@H]1CCC[C@H](CNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000551721071 567531835 /nfs/dbraw/zinc/53/18/35/567531835.db2.gz ZEJQTNBFFVUUCE-MNOVXSKESA-N 0 0 398.257 3.238 20 5 GGBDRN C[C@@H]1C[C@H](C)CCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000551727675 567532550 /nfs/dbraw/zinc/53/25/50/567532550.db2.gz GZGHOCPOKVCEOB-GHMZBOCLSA-N 0 0 398.257 3.190 20 5 GGBDRN CC1(C)CCCC[C@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000551731119 567532889 /nfs/dbraw/zinc/53/28/89/567532889.db2.gz MHYHKWVBIARITB-CYBMUJFWSA-N 0 0 398.257 3.381 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccncc1Br ZINC000479404941 567533106 /nfs/dbraw/zinc/53/31/06/567533106.db2.gz GLGSNIOIZBRYLT-UHFFFAOYSA-N 0 0 384.617 3.378 20 5 GGBDRN Cn1cc(Br)cc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000479432390 567534871 /nfs/dbraw/zinc/53/48/71/567534871.db2.gz YPAXNEKYWYNFKA-UHFFFAOYSA-N 0 0 386.633 3.322 20 5 GGBDRN C[C@@H]1CN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC000551765817 567534844 /nfs/dbraw/zinc/53/48/44/567534844.db2.gz OYIPHONAWXYSAA-JTQLQIEISA-N 0 0 398.257 3.190 20 5 GGBDRN CCOC(=O)CC(=O)CSCc1ccc(Br)cc1[N+](=O)[O-] ZINC000571082206 567536734 /nfs/dbraw/zinc/53/67/34/567536734.db2.gz YGBVKPGWAVVFGD-UHFFFAOYSA-N 0 0 376.228 3.113 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@@H]3CCCC[C@@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000595048714 567539318 /nfs/dbraw/zinc/53/93/18/567539318.db2.gz LUFNCTXPHZTZQA-GWCFXTLKSA-N 0 0 396.241 3.005 20 5 GGBDRN Cc1c(C(=O)NCC(=O)Nc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000479476331 567539567 /nfs/dbraw/zinc/53/95/67/567539567.db2.gz XUXAKSDBUIVFRR-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN COC(=O)c1cc(NS(=O)(=O)c2ccc(Cl)cc2C)cc([N+](=O)[O-])c1 ZINC000438719520 567540009 /nfs/dbraw/zinc/54/00/09/567540009.db2.gz GKRMVHDGRVMQFV-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN CN(Cc1ccc2c(c1)OCCO2)c1c(Br)cncc1[N+](=O)[O-] ZINC000551872235 567540551 /nfs/dbraw/zinc/54/05/51/567540551.db2.gz OZOUZOPVPVBLDX-UHFFFAOYSA-N 0 0 380.198 3.160 20 5 GGBDRN CC[C@H](C)N(CC)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000595060870 567540989 /nfs/dbraw/zinc/54/09/89/567540989.db2.gz IITQBKZAFVPLAX-VIFPVBQESA-N 0 0 386.246 3.251 20 5 GGBDRN CCCN(CC(F)F)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000504576033 567541264 /nfs/dbraw/zinc/54/12/64/567541264.db2.gz VDNRZWRHTQBRQN-UHFFFAOYSA-N 0 0 398.147 3.317 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@H](c2cccnc2)C1 ZINC000571211413 567545922 /nfs/dbraw/zinc/54/59/22/567545922.db2.gz FUMPUAWCVYNRBJ-LBPRGKRZSA-N 0 0 376.210 3.382 20 5 GGBDRN COC(=O)[C@H]1C[C@H](C)CCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000479581475 567546297 /nfs/dbraw/zinc/54/62/97/567546297.db2.gz ICTCVABJLRHTLQ-YMTOWFKASA-N 0 0 399.241 3.079 20 5 GGBDRN Cc1ncc2c(n1)CCN(C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C2 ZINC000551967685 567546530 /nfs/dbraw/zinc/54/65/30/567546530.db2.gz OZXSKMAGNXXGOX-UHFFFAOYSA-N 0 0 392.213 3.046 20 5 GGBDRN CC(C)[C@@H](CNS(=O)(=O)c1cccnc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000551993214 567547519 /nfs/dbraw/zinc/54/75/19/567547519.db2.gz ZMSLDSVKODHKIH-CQSZACIVSA-N 0 0 383.857 3.361 20 5 GGBDRN COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000479604768 567547944 /nfs/dbraw/zinc/54/79/44/567547944.db2.gz WJBUNZPFCVATPI-MFKMUULPSA-N 0 0 386.857 3.140 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2cc(F)cc(Br)c2)cc1 ZINC000438859180 567550985 /nfs/dbraw/zinc/55/09/85/567550985.db2.gz OMONLFGKMAEZQW-CYBMUJFWSA-N 0 0 386.173 3.315 20 5 GGBDRN Cc1noc(CN2CCO[C@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000595298996 567551543 /nfs/dbraw/zinc/55/15/43/567551543.db2.gz UOWFXTPYFRAYGS-ZDUSSCGKSA-N 0 0 382.214 3.227 20 5 GGBDRN O=C(NCc1cc(Br)ccc1OC(F)F)c1cc([N+](=O)[O-])c[nH]1 ZINC000504916679 567551899 /nfs/dbraw/zinc/55/18/99/567551899.db2.gz AOZFKLSYEPWAAC-UHFFFAOYSA-N 0 0 390.140 3.217 20 5 GGBDRN COc1ccc(S(=O)(=O)NC(C)(C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000571305917 567552421 /nfs/dbraw/zinc/55/24/21/567552421.db2.gz WPULGIYNBZBGRF-UHFFFAOYSA-N 0 0 384.841 3.470 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1ccc(I)cc1Cl ZINC000479717940 567555373 /nfs/dbraw/zinc/55/53/73/567555373.db2.gz RBGQYFWGZJJTGP-UHFFFAOYSA-N 0 0 390.564 3.063 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CC[C@@H](Oc2ccccc2)C1 ZINC000595364448 567559308 /nfs/dbraw/zinc/55/93/08/567559308.db2.gz QQFBURUHCFDNSM-CYBMUJFWSA-N 0 0 382.825 3.090 20 5 GGBDRN Cc1noc(CNC2(c3cccc(Br)c3)CCOCC2)c1[N+](=O)[O-] ZINC000595360558 567559439 /nfs/dbraw/zinc/55/94/39/567559439.db2.gz VYBXZVPGOKOZCW-UHFFFAOYSA-N 0 0 396.241 3.449 20 5 GGBDRN COc1cc(Cl)c(Cl)cc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000552134738 567561680 /nfs/dbraw/zinc/56/16/80/567561680.db2.gz IKPMLOIYQQNEIN-UHFFFAOYSA-N 0 0 381.175 3.461 20 5 GGBDRN Cc1noc(CN[C@H](C)c2cc3c(cc2Br)OCCO3)c1[N+](=O)[O-] ZINC000595413665 567562051 /nfs/dbraw/zinc/56/20/51/567562051.db2.gz FGTSWBHGMCEWLK-MRVPVSSYSA-N 0 0 398.213 3.276 20 5 GGBDRN C[C@H]1c2ccccc2OCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000595414002 567562449 /nfs/dbraw/zinc/56/24/49/567562449.db2.gz ZJQCYEIXQADHIP-NSHDSACASA-N 0 0 382.825 3.393 20 5 GGBDRN C[C@@H](NC(=O)c1c(Cl)cccc1S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000439101185 567565100 /nfs/dbraw/zinc/56/51/00/567565100.db2.gz NUWNTQYOCGPRON-SNVBAGLBSA-N 0 0 382.825 3.143 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(CC1CCC1)[C@H](C)CO ZINC000552158108 567565378 /nfs/dbraw/zinc/56/53/78/567565378.db2.gz BQBNCFQGBMJWNF-SNVBAGLBSA-N 0 0 385.258 3.289 20 5 GGBDRN COC(=O)[C@](C)(NCc1onc(C)c1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000595441001 567565398 /nfs/dbraw/zinc/56/53/98/567565398.db2.gz IKSAKWCYVRHKRB-OAHLLOKOSA-N 0 0 388.207 3.376 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)c1ccc(C(F)(F)F)cc1Cl ZINC000439113282 567566092 /nfs/dbraw/zinc/56/60/92/567566092.db2.gz CPSLYZLUQKNILY-UHFFFAOYSA-N 0 0 376.722 3.435 20 5 GGBDRN Cc1noc(CN[C@H](CO)c2ccc(Cl)cc2C(F)(F)F)c1[N+](=O)[O-] ZINC000595465308 567566735 /nfs/dbraw/zinc/56/67/35/567566735.db2.gz CBDFTMKOPWONIL-LLVKDONJSA-N 0 0 379.722 3.387 20 5 GGBDRN COc1ncc(Br)cc1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000595482870 567566958 /nfs/dbraw/zinc/56/69/58/567566958.db2.gz CHDJSKNXKAVXSJ-UHFFFAOYSA-N 0 0 380.242 3.435 20 5 GGBDRN COC(=O)[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000552205321 567567251 /nfs/dbraw/zinc/56/72/51/567567251.db2.gz ZESAHJNPEURPDD-INIZCTEOSA-N 0 0 393.237 3.404 20 5 GGBDRN COc1cc(S(=O)(=O)N2c3ccccc3SC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000439128321 567567753 /nfs/dbraw/zinc/56/77/53/567567753.db2.gz GLCMHIMCBSKPBI-NSHDSACASA-N 0 0 380.447 3.293 20 5 GGBDRN CS(=O)(=O)c1cccc(NCc2nc(-c3cccs3)c[nH]2)c1[N+](=O)[O-] ZINC000439127989 567567812 /nfs/dbraw/zinc/56/78/12/567567812.db2.gz DWIPARDLUSIWRC-UHFFFAOYSA-N 0 0 378.435 3.062 20 5 GGBDRN CN(C[C@@H]1COc2ccccc2O1)c1ncc([N+](=O)[O-])cc1Br ZINC000479932322 567568378 /nfs/dbraw/zinc/56/83/78/567568378.db2.gz POWHCZKGAJYTFU-LLVKDONJSA-N 0 0 380.198 3.029 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1cc(F)cc(F)c1 ZINC000479920314 567568385 /nfs/dbraw/zinc/56/83/85/567568385.db2.gz RAFPNBGCMKHBAE-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](O)Cc2ccccc21 ZINC000552214417 567569160 /nfs/dbraw/zinc/56/91/60/567569160.db2.gz NXGDCHHIIAGOGH-ZDUSSCGKSA-N 0 0 391.221 3.230 20 5 GGBDRN CN(C[C@H]1COc2ccccc2O1)c1ncc([N+](=O)[O-])cc1Br ZINC000479932325 567570319 /nfs/dbraw/zinc/57/03/19/567570319.db2.gz POWHCZKGAJYTFU-NSHDSACASA-N 0 0 380.198 3.029 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](c2ccncc2)C1 ZINC000571535639 567570820 /nfs/dbraw/zinc/57/08/20/567570820.db2.gz RZUWIZLUNOGWCV-LBPRGKRZSA-N 0 0 376.210 3.382 20 5 GGBDRN COC(=O)C1(N(Cc2ccc(Br)cc2[N+](=O)[O-])C2CC2)CCC1 ZINC000595542859 567570920 /nfs/dbraw/zinc/57/09/20/567570920.db2.gz VYEPXGAWEKLPBU-UHFFFAOYSA-N 0 0 383.242 3.417 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)COc1cccc(Br)c1 ZINC000552264677 567571634 /nfs/dbraw/zinc/57/16/34/567571634.db2.gz SMHZWJPAXIWXAD-UHFFFAOYSA-N 0 0 393.237 3.437 20 5 GGBDRN COCc1csc(CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000595584622 567572420 /nfs/dbraw/zinc/57/24/20/567572420.db2.gz HXZJQSPWEJCBEJ-UHFFFAOYSA-N 0 0 383.857 3.498 20 5 GGBDRN CC1=C(C)CN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)CC1 ZINC000571589190 567572791 /nfs/dbraw/zinc/57/27/91/567572791.db2.gz AAGVGQODMUKEHB-UHFFFAOYSA-N 0 0 386.189 3.382 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1ccc(Br)s1 ZINC000479984895 567573326 /nfs/dbraw/zinc/57/33/26/567573326.db2.gz CDSHPVBXYXVTLK-QMMMGPOBSA-N 0 0 385.243 3.130 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2C[C@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000439222201 567573572 /nfs/dbraw/zinc/57/35/72/567573572.db2.gz DXVYSDRYZIPANE-BDAKNGLRSA-N 0 0 377.260 3.085 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N[C@@H]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000439241544 567574419 /nfs/dbraw/zinc/57/44/19/567574419.db2.gz XOFAODCURNTAKW-QPUJVOFHSA-N 0 0 377.260 3.133 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000439242416 567574351 /nfs/dbraw/zinc/57/43/51/567574351.db2.gz BLVSTXDYHZELCP-UHFFFAOYSA-N 0 0 391.287 3.476 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000439240681 567574365 /nfs/dbraw/zinc/57/43/65/567574365.db2.gz UWIGSUYUIRISHY-CYBMUJFWSA-N 0 0 391.287 3.475 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)NC/C=C/c1ccccc1 ZINC000480001570 567575058 /nfs/dbraw/zinc/57/50/58/567575058.db2.gz ZDNTXXDCEBZCPT-QPJJXVBHSA-N 0 0 397.250 3.349 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1cnn2ccccc12 ZINC000552301150 567575361 /nfs/dbraw/zinc/57/53/61/567575361.db2.gz PCZSPMSOFOCAGK-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN CCCN(CC1CC1)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000439245619 567575760 /nfs/dbraw/zinc/57/57/60/567575760.db2.gz JJLSCWRBZJCJJC-UHFFFAOYSA-N 0 0 391.287 3.476 20 5 GGBDRN CCc1[nH][nH]c(=NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1Br ZINC000480017922 567575951 /nfs/dbraw/zinc/57/59/51/567575951.db2.gz QDXAQIXMISONGB-UHFFFAOYSA-N 0 0 385.243 3.039 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000439252316 567575994 /nfs/dbraw/zinc/57/59/94/567575994.db2.gz YGNRQDIAGQRINK-UHFFFAOYSA-N 0 0 377.260 3.230 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000439245894 567576245 /nfs/dbraw/zinc/57/62/45/567576245.db2.gz BIQQXGNIWJCHQP-VIFPVBQESA-N 0 0 377.260 3.086 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(CC(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000439245384 567576252 /nfs/dbraw/zinc/57/62/52/567576252.db2.gz JWSIGYICKXJJEC-UHFFFAOYSA-N 0 0 391.287 3.475 20 5 GGBDRN CC[C@@H]1CCCN(S(=O)(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000439245530 567576326 /nfs/dbraw/zinc/57/63/26/567576326.db2.gz KWXPNGDUYGOTGC-LLVKDONJSA-N 0 0 391.287 3.476 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000439250242 567576613 /nfs/dbraw/zinc/57/66/13/567576613.db2.gz TUHXOLIZTSVRIF-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)CC2CCCC2)cc1[N+](=O)[O-] ZINC000439247279 567576655 /nfs/dbraw/zinc/57/66/55/567576655.db2.gz NFOZJHHEDIYUIF-UHFFFAOYSA-N 0 0 391.287 3.476 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)NCCc2ccccc2)cc1[N+](=O)[O-] ZINC000439250196 567576862 /nfs/dbraw/zinc/57/68/62/567576862.db2.gz SUPBGSWKKPKYSS-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN C[C@H]1CSC[C@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000552322878 567577452 /nfs/dbraw/zinc/57/74/52/567577452.db2.gz COENNWCHNZHYDC-JOYOIKCWSA-N 0 0 377.388 3.283 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](COC(F)F)C2)cc1SC ZINC000552348146 567580361 /nfs/dbraw/zinc/58/03/61/567580361.db2.gz IBZJWKOUTIDZPF-VIFPVBQESA-N 0 0 376.381 3.027 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(NCc2nnnn2-c2ccccc2Br)c1 ZINC000480162463 567584243 /nfs/dbraw/zinc/58/42/43/567584243.db2.gz BSERZVPIIACZLW-UHFFFAOYSA-N 0 0 393.176 3.084 20 5 GGBDRN CC1(c2cccc(Br)c2)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 ZINC000552382408 567584311 /nfs/dbraw/zinc/58/43/11/567584311.db2.gz KEEWDGJJKTYQND-UHFFFAOYSA-N 0 0 393.241 3.274 20 5 GGBDRN COCC[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccco1 ZINC000505627177 567588538 /nfs/dbraw/zinc/58/85/38/567588538.db2.gz BVNCHFFPGKFTII-CYBMUJFWSA-N 0 0 383.198 3.458 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000552431161 567590316 /nfs/dbraw/zinc/59/03/16/567590316.db2.gz WVZHVYGJQUAJDB-LBPRGKRZSA-N 0 0 383.177 3.197 20 5 GGBDRN O=C(N[C@H](Cc1cccc(Br)c1)CC1CC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000552461656 567591462 /nfs/dbraw/zinc/59/14/62/567591462.db2.gz VYHBKHTYLXNCNO-ZDUSSCGKSA-N 0 0 393.241 3.222 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1Oc1ncnc2[nH]ccc21 ZINC000480310446 567596005 /nfs/dbraw/zinc/59/60/05/567596005.db2.gz SFRADDQMELAQHP-UHFFFAOYSA-N 0 0 382.117 3.263 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000439609896 567596052 /nfs/dbraw/zinc/59/60/52/567596052.db2.gz CKGVIHQKDUDHOF-UWVGGRQHSA-N 0 0 381.376 3.023 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@H]2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000439609897 567596183 /nfs/dbraw/zinc/59/61/83/567596183.db2.gz CKGVIHQKDUDHOF-VHSXEESVSA-N 0 0 381.376 3.023 20 5 GGBDRN CCOc1cc(Oc2ccc(I)cc2[N+](=O)[O-])ncn1 ZINC000480327199 567597565 /nfs/dbraw/zinc/59/75/65/567597565.db2.gz NBPUDXVIHFIIIN-UHFFFAOYSA-N 0 0 387.133 3.180 20 5 GGBDRN CCOC1(C)CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000552625521 567599089 /nfs/dbraw/zinc/59/90/89/567599089.db2.gz CPQWDRJGXMPZSO-UHFFFAOYSA-N 0 0 385.258 3.317 20 5 GGBDRN CO[C@]1(C)CCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000530426499 567601723 /nfs/dbraw/zinc/60/17/23/567601723.db2.gz DPCANCKQWGFDMW-CYBMUJFWSA-N 0 0 376.194 3.205 20 5 GGBDRN Cc1ccc(-c2nc(CS(=O)(=O)Cc3onc(C)c3[N+](=O)[O-])cs2)o1 ZINC000596038079 567601861 /nfs/dbraw/zinc/60/18/61/567601861.db2.gz JEKUMUOSOBOWMD-UHFFFAOYSA-N 0 0 383.407 3.031 20 5 GGBDRN Cc1noc(CS(=O)(=O)Cc2ccc(Br)cc2C)c1[N+](=O)[O-] ZINC000596038970 567601892 /nfs/dbraw/zinc/60/18/92/567601892.db2.gz ULEUCTJBKLZJGW-UHFFFAOYSA-N 0 0 389.227 3.077 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H](COC(F)F)C1 ZINC000552694878 567602253 /nfs/dbraw/zinc/60/22/53/567602253.db2.gz KFFQOIGOIANRSM-JTQLQIEISA-N 0 0 378.759 3.105 20 5 GGBDRN Cc1cn2c(n1)[C@@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])CCC2 ZINC000505899474 567603091 /nfs/dbraw/zinc/60/30/91/567603091.db2.gz RFISYSBHCKCEDF-LLVKDONJSA-N 0 0 393.241 3.170 20 5 GGBDRN O=C1CCCN1Cc1nnc(Sc2c(Br)cccc2[N+](=O)[O-])o1 ZINC000596057171 567605324 /nfs/dbraw/zinc/60/53/24/567605324.db2.gz IXIKBAJXYDNDLT-UHFFFAOYSA-N 0 0 399.226 3.014 20 5 GGBDRN NS(=O)(=O)c1ccc(N2CCC[C@@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000596072759 567606294 /nfs/dbraw/zinc/60/62/94/567606294.db2.gz HLDWNPPVQCJNMW-CQSZACIVSA-N 0 0 381.841 3.237 20 5 GGBDRN CCCCNC(=O)C1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596079025 567606788 /nfs/dbraw/zinc/60/67/88/567606788.db2.gz IEVUWKPQUXFQMT-UHFFFAOYSA-N 0 0 384.274 3.490 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCCN(CC(F)(F)F)CC1 ZINC000596079179 567606907 /nfs/dbraw/zinc/60/69/07/567606907.db2.gz KIVOPLOTIRSWBU-UHFFFAOYSA-N 0 0 382.180 3.432 20 5 GGBDRN Cc1cc(N(C)CCCOc2ccc(S(C)(=O)=O)cc2)c([N+](=O)[O-])s1 ZINC000596089821 567607838 /nfs/dbraw/zinc/60/78/38/567607838.db2.gz KDCCOGBZHFMTEO-UHFFFAOYSA-N 0 0 384.479 3.274 20 5 GGBDRN O=c1[nH]ccc(N2CCO[C@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000596097000 567607999 /nfs/dbraw/zinc/60/79/99/567607999.db2.gz BPIJYJMHFLMDCS-ZDUSSCGKSA-N 0 0 380.198 3.036 20 5 GGBDRN O=[N+]([O-])c1c(NCCCCn2cc(Br)cn2)nc2sccn21 ZINC000480508399 567608743 /nfs/dbraw/zinc/60/87/43/567608743.db2.gz GRLQNJONMSKKPB-UHFFFAOYSA-N 0 0 385.247 3.155 20 5 GGBDRN O=c1[nH]ccc(N[C@H]2CCN(c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000596112529 567609483 /nfs/dbraw/zinc/60/94/83/567609483.db2.gz RSMIUYSGAHHPLT-NSHDSACASA-N 0 0 379.214 3.149 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596109197 567609900 /nfs/dbraw/zinc/60/99/00/567609900.db2.gz GSGBJNPHUHNDOJ-LBPRGKRZSA-N 0 0 384.274 3.490 20 5 GGBDRN Cc1ccc(Br)cc1CNC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000439961441 567610427 /nfs/dbraw/zinc/61/04/27/567610427.db2.gz NCUKMXDBXITCAJ-UHFFFAOYSA-N 0 0 378.226 3.394 20 5 GGBDRN O=C1CN(c2c(Cl)cncc2[N+](=O)[O-])CCN1Cc1ccc(Cl)cc1 ZINC000596134155 567611063 /nfs/dbraw/zinc/61/10/63/567611063.db2.gz DQRBNMGMLMGNEG-UHFFFAOYSA-N 0 0 381.219 3.145 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000506145145 567611724 /nfs/dbraw/zinc/61/17/24/567611724.db2.gz AZONRPOCXZDISF-UHFFFAOYSA-N 0 0 385.193 3.273 20 5 GGBDRN COC(=O)[C@@H](Cc1ccc(C)cc1)Sc1nc2sccn2c1[N+](=O)[O-] ZINC000480583874 567613374 /nfs/dbraw/zinc/61/33/74/567613374.db2.gz SXZAWCZQGIZBPX-GFCCVEGCSA-N 0 0 377.447 3.489 20 5 GGBDRN CNC(=O)c1cccc(NCc2cc([N+](=O)[O-])ccc2OC)c1Br ZINC000506194175 567614198 /nfs/dbraw/zinc/61/41/98/567614198.db2.gz ZGGBUJXRBOFVOJ-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN NS(=O)(=O)c1ccc(NCC2(c3ccccc3Cl)CC2)cc1[N+](=O)[O-] ZINC000596179069 567614221 /nfs/dbraw/zinc/61/42/21/567614221.db2.gz LLUSOZHLUFJUMU-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(c2ncccc2F)CC1 ZINC000596178251 567614243 /nfs/dbraw/zinc/61/42/43/567614243.db2.gz JLPNRXVIMCSIIZ-UHFFFAOYSA-N 0 0 381.205 3.218 20 5 GGBDRN COc1ccc(CS(C)(=O)=O)cc1NCc1c(Cl)cccc1[N+](=O)[O-] ZINC000506192194 567614430 /nfs/dbraw/zinc/61/44/30/567614430.db2.gz UOGIFGSXNNPMGC-UHFFFAOYSA-N 0 0 384.841 3.414 20 5 GGBDRN Cc1cc(N2CCC[C@H](S(=O)(=O)Nc3ccccc3)C2)c([N+](=O)[O-])s1 ZINC000596190132 567615078 /nfs/dbraw/zinc/61/50/78/567615078.db2.gz ODNSLGYJJAPPIK-AWEZNQCLSA-N 0 0 381.479 3.375 20 5 GGBDRN CN(C)S(=O)(=O)c1ccccc1NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000596187122 567615118 /nfs/dbraw/zinc/61/51/18/567615118.db2.gz NVENUYWTHZSPRD-UHFFFAOYSA-N 0 0 383.857 3.153 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000530617760 567615379 /nfs/dbraw/zinc/61/53/79/567615379.db2.gz UWTCENHLMDANDR-NEPJUHHUSA-N 0 0 383.857 3.456 20 5 GGBDRN COCCN(Cc1cc(Br)cs1)c1ccc(N)c([N+](=O)[O-])n1 ZINC000596211246 567616161 /nfs/dbraw/zinc/61/61/61/567616161.db2.gz UXNYHSNELQISJX-UHFFFAOYSA-N 0 0 387.259 3.049 20 5 GGBDRN Cc1cccnc1N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000480610240 567616229 /nfs/dbraw/zinc/61/62/29/567616229.db2.gz IFZYONVZAWKYJO-UHFFFAOYSA-N 0 0 375.328 3.142 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 ZINC000596232843 567617121 /nfs/dbraw/zinc/61/71/21/567617121.db2.gz ZJZGMXCCHHACMY-RKDXNWHRSA-N 0 0 383.164 3.354 20 5 GGBDRN CS(=O)(=O)N[C@@H]1CCCC[C@H]1CNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000596230512 567617433 /nfs/dbraw/zinc/61/74/33/567617433.db2.gz BIIAHXUCRPHIMX-NWDGAFQWSA-N 0 0 377.413 3.052 20 5 GGBDRN NS(=O)(=O)c1ccc(N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000596219125 567617643 /nfs/dbraw/zinc/61/76/43/567617643.db2.gz NGEBGYDBOCEBMQ-YEORSEQZSA-N 0 0 381.841 3.254 20 5 GGBDRN COCCN(C[C@H]1CC=CCC1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000480632523 567617660 /nfs/dbraw/zinc/61/76/60/567617660.db2.gz CTYVNFFOWWLFSY-ZDUSSCGKSA-N 0 0 388.873 3.242 20 5 GGBDRN CN(C)S(=O)(=O)c1cc(NCc2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000506245654 567618063 /nfs/dbraw/zinc/61/80/63/567618063.db2.gz KBCYTCSSXBQYBR-UHFFFAOYSA-N 0 0 387.820 3.250 20 5 GGBDRN O=[N+]([O-])c1cc(N2CCC[C@]3(CCS(=O)(=O)C3)C2)ccc1C(F)(F)F ZINC000596257510 567618255 /nfs/dbraw/zinc/61/82/55/567618255.db2.gz PNOYJCQKUQHHGN-AWEZNQCLSA-N 0 0 378.372 3.019 20 5 GGBDRN CC(C)(C[C@@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])C1)C(N)=O ZINC000596248151 567618383 /nfs/dbraw/zinc/61/83/83/567618383.db2.gz FODSOQKXOFVTSB-NSHDSACASA-N 0 0 384.274 3.475 20 5 GGBDRN Cn1nccc1[C@H]1C[C@H](Nc2c(Br)cccc2[N+](=O)[O-])CCO1 ZINC000596256488 567618729 /nfs/dbraw/zinc/61/87/29/567618729.db2.gz AXZDTJFPYAEOEW-QMTHXVAHSA-N 0 0 381.230 3.423 20 5 GGBDRN O=C(NCCc1ccc2c(c1)OCO2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000530710661 567618952 /nfs/dbraw/zinc/61/89/52/567618952.db2.gz NXMKJGLVEBPKOK-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CC[C@@](CO)(c2ccccc2)C1 ZINC000596242012 567618980 /nfs/dbraw/zinc/61/89/80/567618980.db2.gz NGPSZQNXAIYZOC-QGZVFWFLSA-N 0 0 377.238 3.498 20 5 GGBDRN O=[N+]([O-])c1cc(N2CCC3(CCC3)S(=O)(=O)CC2)ccc1C(F)(F)F ZINC000596271656 567620135 /nfs/dbraw/zinc/62/01/35/567620135.db2.gz URJFDMYTRXVWGQ-UHFFFAOYSA-N 0 0 378.372 3.161 20 5 GGBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCc1cc(=O)n2ccccc2n1 ZINC000530766755 567622061 /nfs/dbraw/zinc/62/20/61/567622061.db2.gz WKSMSSYWXCGHLL-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN CN(C)S(=O)(=O)c1cccc(CSCc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000596321895 567622384 /nfs/dbraw/zinc/62/23/84/567622384.db2.gz NGRDJIUEAVYKRQ-UHFFFAOYSA-N 0 0 384.454 3.418 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H]2COc3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000480707920 567622720 /nfs/dbraw/zinc/62/27/20/567622720.db2.gz KZGIKXYFKPRCJE-ZDUSSCGKSA-N 0 0 382.825 3.277 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(Br)ccc2O)cc1[N+](=O)[O-] ZINC000530776979 567623347 /nfs/dbraw/zinc/62/33/47/567623347.db2.gz BQBMXKUITSGHRU-UHFFFAOYSA-N 0 0 381.182 3.253 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C1CCCCC1 ZINC000530801490 567625747 /nfs/dbraw/zinc/62/57/47/567625747.db2.gz NWXQVGCJBKDXHO-CQSZACIVSA-N 0 0 399.241 3.209 20 5 GGBDRN O=c1[nH]c(NCCc2ccc(Br)cc2)nc2ccc([N+](=O)[O-])cc12 ZINC000553104735 567626626 /nfs/dbraw/zinc/62/66/26/567626626.db2.gz MHBDFIDKALHCOS-UHFFFAOYSA-N 0 0 389.209 3.083 20 5 GGBDRN COCCN([C@H]1CC[C@H](C)C1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000480756005 567627622 /nfs/dbraw/zinc/62/76/22/567627622.db2.gz IWQNSNHXKYVYJA-RYUDHWBXSA-N 0 0 376.862 3.074 20 5 GGBDRN COCCN([C@H]1CC[C@@H](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000480760642 567628330 /nfs/dbraw/zinc/62/83/30/567628330.db2.gz RRALMWJFUDDGMN-NEPJUHHUSA-N 0 0 376.862 3.074 20 5 GGBDRN O=c1onc(-c2cccc(Br)c2)n1Cc1ccc([N+](=O)[O-])cc1F ZINC000530867954 567628818 /nfs/dbraw/zinc/62/88/18/567628818.db2.gz JLKHCZVOCBRDNH-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)COCC(F)(F)F ZINC000572307590 567630055 /nfs/dbraw/zinc/63/00/55/567630055.db2.gz UTGQGAGJRNMCDJ-SSDOTTSWSA-N 0 0 399.163 3.363 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)c2ncnc3sc([N+](=O)[O-])cc32)n1 ZINC000553148843 567630806 /nfs/dbraw/zinc/63/08/06/567630806.db2.gz GGIQWFQMURLCGA-MRVPVSSYSA-N 0 0 380.455 3.433 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(N(C)CC(=O)Nc2ccccc2Br)c1 ZINC000530910071 567631678 /nfs/dbraw/zinc/63/16/78/567631678.db2.gz NWMABWFEIYPRSP-UHFFFAOYSA-N 0 0 394.225 3.441 20 5 GGBDRN COc1cccc(OC)c1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000596415487 567631818 /nfs/dbraw/zinc/63/18/18/567631818.db2.gz JXZVYYBFORPWPV-UHFFFAOYSA-N 0 0 382.214 3.112 20 5 GGBDRN COC(=O)c1cnc(N[C@@H](C)c2ccc(Br)cn2)c([N+](=O)[O-])c1 ZINC000480812089 567632192 /nfs/dbraw/zinc/63/21/92/567632192.db2.gz LBWNXRZFXGOFLV-QMMMGPOBSA-N 0 0 381.186 3.107 20 5 GGBDRN NC(=O)c1ccc(N[C@@H]2C[C@H]2c2ccc(Br)s2)c([N+](=O)[O-])c1 ZINC000480813723 567632569 /nfs/dbraw/zinc/63/25/69/567632569.db2.gz QRADNYRKHWOSIE-PSASIEDQSA-N 0 0 382.239 3.486 20 5 GGBDRN O=C(COc1c(Cl)cncc1[N+](=O)[O-])NCCCSc1ccccc1 ZINC000506583440 567632640 /nfs/dbraw/zinc/63/26/40/567632640.db2.gz CEPWOZKSOXQKQQ-UHFFFAOYSA-N 0 0 381.841 3.321 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC[C@H](COC(F)F)C1 ZINC000553196829 567633493 /nfs/dbraw/zinc/63/34/93/567633493.db2.gz GATVKMKILTWTBU-QMMMGPOBSA-N 0 0 379.157 3.059 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1SCc1nnn(CC(F)(F)F)n1 ZINC000440599536 567634024 /nfs/dbraw/zinc/63/40/24/567634024.db2.gz GRCGLTWVHISFHZ-UHFFFAOYSA-N 0 0 398.164 3.198 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2cc(Br)ccc2C)n1 ZINC000553202643 567634598 /nfs/dbraw/zinc/63/45/98/567634598.db2.gz CZEYJFNLMOLILC-UHFFFAOYSA-N 0 0 380.198 3.459 20 5 GGBDRN CNC(=O)c1ccc(N[C@H](C)c2ccc(Br)cn2)c([N+](=O)[O-])c1 ZINC000480843737 567634742 /nfs/dbraw/zinc/63/47/42/567634742.db2.gz INJPVNQPRWBWJI-SECBINFHSA-N 0 0 379.214 3.285 20 5 GGBDRN CCC[C@@H](CC)Sc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1 ZINC000480845478 567634918 /nfs/dbraw/zinc/63/49/18/567634918.db2.gz MBWPEBAESQHKME-CQSZACIVSA-N 0 0 388.511 3.287 20 5 GGBDRN CC1(c2ccc(Br)cc2)CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 ZINC000440634058 567635416 /nfs/dbraw/zinc/63/54/16/567635416.db2.gz ABTZTDVSCJIOGM-UHFFFAOYSA-N 0 0 392.257 3.118 20 5 GGBDRN NS(=O)(=O)c1c(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000530995031 567635518 /nfs/dbraw/zinc/63/55/18/567635518.db2.gz JJFOETXDPAJODF-NXEZZACHSA-N 0 0 381.376 3.023 20 5 GGBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCC(=O)NCc1cccs1 ZINC000531004779 567635824 /nfs/dbraw/zinc/63/58/24/567635824.db2.gz RVVRGTOOQSZELH-UHFFFAOYSA-N 0 0 385.239 3.422 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1cccc(O)c1Br)CCO2 ZINC000459553887 567635924 /nfs/dbraw/zinc/63/59/24/567635924.db2.gz CDCVMYPQHZZXEO-UHFFFAOYSA-N 0 0 379.210 3.458 20 5 GGBDRN CCC[C@H](CC)Sc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000480851220 567636658 /nfs/dbraw/zinc/63/66/58/567636658.db2.gz JEILNAJBHWSFPB-ZDUSSCGKSA-N 0 0 388.511 3.287 20 5 GGBDRN C[C@H](CCc1ccc(I)cc1)Nc1ncc([N+](=O)[O-])cn1 ZINC000480855522 567636689 /nfs/dbraw/zinc/63/66/89/567636689.db2.gz WRJYVZIIUHSYMT-SNVBAGLBSA-N 0 0 398.204 3.423 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)c1ccc(Br)cn1 ZINC000480859931 567637732 /nfs/dbraw/zinc/63/77/32/567637732.db2.gz ZPTKTMIJHSLKBQ-VIFPVBQESA-N 0 0 379.214 3.285 20 5 GGBDRN CNS(=O)(=O)c1ccc(CNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])s1 ZINC000572431595 567638115 /nfs/dbraw/zinc/63/81/15/567638115.db2.gz VPWGHRVKJSYVET-UHFFFAOYSA-N 0 0 396.277 3.483 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1cc(F)c(F)cc1Br ZINC000553249089 567639128 /nfs/dbraw/zinc/63/91/28/567639128.db2.gz URSDIUDXANJSEY-UHFFFAOYSA-N 0 0 385.164 3.494 20 5 GGBDRN Cc1nnc(CN(C)c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])s1 ZINC000596556089 567640113 /nfs/dbraw/zinc/64/01/13/567640113.db2.gz JSQNQQACXINFFJ-UHFFFAOYSA-N 0 0 383.302 3.440 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCC3(CCCCC3)O2)c(Cl)c1 ZINC000480899616 567641233 /nfs/dbraw/zinc/64/12/33/567641233.db2.gz PUCNWRRTSLQSHO-ZDUSSCGKSA-N 0 0 388.873 3.408 20 5 GGBDRN CCc1nnc(NC(=O)[C@H](C)[C@H](C)Nc2ncc([N+](=O)[O-])cc2Cl)s1 ZINC000553318924 567642882 /nfs/dbraw/zinc/64/28/82/567642882.db2.gz HLGQQVKCZPVFEL-SFYZADRCSA-N 0 0 384.849 3.132 20 5 GGBDRN COc1cc(C(=O)Nc2nc3c(s2)CSCC3)cc([N+](=O)[O-])c1OC ZINC000553310953 567643181 /nfs/dbraw/zinc/64/31/81/567643181.db2.gz OFPNNWNCGJQRMQ-UHFFFAOYSA-N 0 0 381.435 3.110 20 5 GGBDRN COC(=O)c1ccc(OCCNc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000531141598 567643461 /nfs/dbraw/zinc/64/34/61/567643461.db2.gz UDSGDCZANRNJLS-UHFFFAOYSA-N 0 0 396.197 3.030 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N(C)Cc2cc(Br)ccc2F)n1 ZINC000553328903 567644558 /nfs/dbraw/zinc/64/45/58/567644558.db2.gz MWEKVLNYYOKDIF-UHFFFAOYSA-N 0 0 398.188 3.314 20 5 GGBDRN C[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1nc2c(s1)CCC2 ZINC000459638212 567644636 /nfs/dbraw/zinc/64/46/36/567644636.db2.gz SYYXJWKEZSBONU-VIFPVBQESA-N 0 0 380.857 3.483 20 5 GGBDRN Cc1cccc2c1N(S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)CC2 ZINC000531204497 567646671 /nfs/dbraw/zinc/64/66/71/567646671.db2.gz GLGILRKBYFCGFO-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN COc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000507004732 567653907 /nfs/dbraw/zinc/65/39/07/567653907.db2.gz OWMUEBCZOZGHOM-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000481045475 567654586 /nfs/dbraw/zinc/65/45/86/567654586.db2.gz XPHYURLIURAKQO-AULYBMBSSA-N 0 0 381.841 3.254 20 5 GGBDRN CCc1nc(CN2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)no1 ZINC000553436436 567654828 /nfs/dbraw/zinc/65/48/28/567654828.db2.gz ALSQUGYNAZZNQU-UHFFFAOYSA-N 0 0 386.239 3.169 20 5 GGBDRN O=[N+]([O-])c1ccn(CCSc2n[nH]c(-c3ccc(Br)cc3)n2)n1 ZINC000531367043 567655239 /nfs/dbraw/zinc/65/52/39/567655239.db2.gz JXAHXLZERWIYGC-UHFFFAOYSA-N 0 0 395.242 3.131 20 5 GGBDRN Cc1cc(N(CCCO)Cc2ccccn2)c(Br)cc1[N+](=O)[O-] ZINC000481063816 567655626 /nfs/dbraw/zinc/65/56/26/567655626.db2.gz UKTIPBSQADFOAS-UHFFFAOYSA-N 0 0 380.242 3.450 20 5 GGBDRN O=C(NCC1(c2ccc(Br)cc2Cl)CC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000507120990 567659643 /nfs/dbraw/zinc/65/96/43/567659643.db2.gz IANJPPZAFMJLLZ-UHFFFAOYSA-N 0 0 399.632 3.195 20 5 GGBDRN C[C@H]1CC[C@@H](CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000481219888 567663652 /nfs/dbraw/zinc/66/36/52/567663652.db2.gz HNGMQSGLECJYQN-VHSXEESVSA-N 0 0 377.260 3.072 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccncc2Br)cc1[N+](=O)[O-] ZINC000507175806 567664240 /nfs/dbraw/zinc/66/42/40/567664240.db2.gz MIBXXZIOKXDCED-SNVBAGLBSA-N 0 0 379.214 3.365 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccncc2Br)cc1[N+](=O)[O-] ZINC000507175804 567664501 /nfs/dbraw/zinc/66/45/01/567664501.db2.gz MIBXXZIOKXDCED-JTQLQIEISA-N 0 0 379.214 3.365 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCOc3c(Br)cccc32)c1 ZINC000441515300 567666854 /nfs/dbraw/zinc/66/68/54/567666854.db2.gz UTJCSSWPTVETMO-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCOc2c(Br)cccc21 ZINC000441525061 567666939 /nfs/dbraw/zinc/66/69/39/567666939.db2.gz PSSSWSDSFHQVRQ-UHFFFAOYSA-N 0 0 393.193 3.162 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCOc2c(Br)cccc21 ZINC000441526207 567667656 /nfs/dbraw/zinc/66/76/56/567667656.db2.gz SYDYXZWNEAGUKB-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC[C@H]1CCN(S(=O)(=O)c2cccs2)C1 ZINC000553579087 567668853 /nfs/dbraw/zinc/66/88/53/567668853.db2.gz XDSXRMDWMVIPLS-CYBMUJFWSA-N 0 0 381.479 3.087 20 5 GGBDRN Cc1c(Br)cncc1CN1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000596989463 567668983 /nfs/dbraw/zinc/66/89/83/567668983.db2.gz SWQBXGRQMYTGFY-UHFFFAOYSA-N 0 0 391.269 3.383 20 5 GGBDRN Cc1cc(CNc2c3cc(Br)ccc3ncc2[N+](=O)[O-])nc(C)n1 ZINC000553592291 567669784 /nfs/dbraw/zinc/66/97/84/567669784.db2.gz XSBURUCEWJUXKI-UHFFFAOYSA-N 0 0 388.225 3.346 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@@H](OCC(F)(F)F)C1 ZINC000531627687 567670246 /nfs/dbraw/zinc/67/02/46/567670246.db2.gz JHNOVUMXFAAYGV-SECBINFHSA-N 0 0 384.152 3.300 20 5 GGBDRN CC(C)[C@@](C)(NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccc(Br)cc1 ZINC000481318122 567670583 /nfs/dbraw/zinc/67/05/83/567670583.db2.gz FURGCMFTFVXBHA-MRXNPFEDSA-N 0 0 395.257 3.392 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)Nc2cc(Cl)cc(F)c2F)cc([N+](=O)[O-])c1 ZINC000441612887 567671393 /nfs/dbraw/zinc/67/13/93/567671393.db2.gz PWESPGVREQURNV-UHFFFAOYSA-N 0 0 390.751 3.182 20 5 GGBDRN COc1cc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])ccc1Br ZINC000572870852 567671839 /nfs/dbraw/zinc/67/18/39/567671839.db2.gz HKUVEFMIDYIITJ-LBPRGKRZSA-N 0 0 397.225 3.218 20 5 GGBDRN O=C(Nc1ccc(OCCCO)cc1)c1ccc([N+](=O)[O-])cc1Br ZINC000553628630 567672721 /nfs/dbraw/zinc/67/27/21/567672721.db2.gz IUVQCZGKTGSPLP-UHFFFAOYSA-N 0 0 395.209 3.371 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@H](F)C1 ZINC000553663034 567673814 /nfs/dbraw/zinc/67/38/14/567673814.db2.gz WYSCABAUHUNFHO-IUCAKERBSA-N 0 0 392.168 3.128 20 5 GGBDRN COC(=O)[C@H](CNc1ccc([N+](=O)[O-])cc1)Oc1ccc(Br)cc1 ZINC000553683998 567675375 /nfs/dbraw/zinc/67/53/75/567675375.db2.gz BFOMRLAPCPAAEY-HNNXBMFYSA-N 0 0 395.209 3.390 20 5 GGBDRN CC(C)(C)Oc1cccc(Cn2cc(Br)cc([N+](=O)[O-])c2=O)n1 ZINC000507374735 567676927 /nfs/dbraw/zinc/67/69/27/567676927.db2.gz JGLFMNDRJSPTLS-UHFFFAOYSA-N 0 0 382.214 3.140 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1nc2cc(Cl)ccc2s1 ZINC000531758592 567677163 /nfs/dbraw/zinc/67/71/63/567677163.db2.gz WIXAWYGKACOWIL-UHFFFAOYSA-N 0 0 398.853 3.117 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc2cccc(Br)c2n1 ZINC000531798138 567678338 /nfs/dbraw/zinc/67/83/38/567678338.db2.gz QYPBYXZQBKTTSP-UHFFFAOYSA-N 0 0 375.182 3.496 20 5 GGBDRN O=C(CCS(=O)(=O)c1cc(Cl)ccc1F)Nc1ccccc1[N+](=O)[O-] ZINC000507434843 567679406 /nfs/dbraw/zinc/67/94/06/567679406.db2.gz URQRFZCGUDHATK-UHFFFAOYSA-N 0 0 386.788 3.190 20 5 GGBDRN O=C(Nc1cc(F)ccc1Br)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000531811947 567680778 /nfs/dbraw/zinc/68/07/78/567680778.db2.gz LGSSMVDLQYAAEN-UHFFFAOYSA-N 0 0 383.129 3.477 20 5 GGBDRN Cc1cc(Br)cnc1N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000531823176 567681423 /nfs/dbraw/zinc/68/14/23/567681423.db2.gz YSHRQYCVERXOBD-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN COc1nc(C)c(Br)cc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481495558 567682517 /nfs/dbraw/zinc/68/25/17/567682517.db2.gz UCDNSUXNWDGURQ-UHFFFAOYSA-N 0 0 394.225 3.308 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)Cc1ccccc1Br)CC2 ZINC000553773566 567683296 /nfs/dbraw/zinc/68/32/96/567683296.db2.gz IRAFMRVFCYNNDD-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ncc(Cc2cccc(Cl)c2)s1 ZINC000481510209 567683628 /nfs/dbraw/zinc/68/36/28/567683628.db2.gz LWWDMFTZLVTKGJ-UHFFFAOYSA-N 0 0 377.813 3.281 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000553783753 567683763 /nfs/dbraw/zinc/68/37/63/567683763.db2.gz RVBHIZRDDWVGFI-LLVKDONJSA-N 0 0 382.825 3.358 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cc(Cl)cc(F)c1F ZINC000442225582 567686902 /nfs/dbraw/zinc/68/69/02/567686902.db2.gz VZHBHLWGACKMMT-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(C(=O)OC)s1 ZINC000442236358 567687396 /nfs/dbraw/zinc/68/73/96/567687396.db2.gz KEXWKXLHZREUJQ-UHFFFAOYSA-N 0 0 384.435 3.048 20 5 GGBDRN Cc1c(Br)c(N2CC[C@H](C(F)(F)F)[C@H](CO)C2)ncc1[N+](=O)[O-] ZINC000573118366 567689266 /nfs/dbraw/zinc/68/92/66/567689266.db2.gz RUAPIJRRLVCRCV-IUCAKERBSA-N 0 0 398.179 3.058 20 5 GGBDRN Cc1c(Br)c(N2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ncc1[N+](=O)[O-] ZINC000573118365 567689677 /nfs/dbraw/zinc/68/96/77/567689677.db2.gz RUAPIJRRLVCRCV-DTWKUNHWSA-N 0 0 398.179 3.058 20 5 GGBDRN Cc1ccc2c(c1)CN(S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)C2 ZINC000481584375 567689835 /nfs/dbraw/zinc/68/98/35/567689835.db2.gz SOBSAQQXEPEZJD-UHFFFAOYSA-N 0 0 397.250 3.370 20 5 GGBDRN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000573118636 567690015 /nfs/dbraw/zinc/69/00/15/567690015.db2.gz SQYDIVRNWVDRLS-JMHSHNQBSA-N 0 0 395.253 3.161 20 5 GGBDRN C[C@@H](Oc1ccc(Br)cc1)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000460494917 567690598 /nfs/dbraw/zinc/69/05/98/567690598.db2.gz VZTZNFDFXPWLAO-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN C[C@H](Oc1cccc(Br)c1)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000460481880 567690754 /nfs/dbraw/zinc/69/07/54/567690754.db2.gz WCOKMPHFNKJKRT-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN C[C@@H](Oc1ccccc1Br)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000460481993 567691015 /nfs/dbraw/zinc/69/10/15/567691015.db2.gz XIBXNWKVSPLVRX-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN CC(C)Oc1ccc(Br)cc1NC(=O)c1cc([N+](=O)[O-])nn1C ZINC000481669480 567694318 /nfs/dbraw/zinc/69/43/18/567694318.db2.gz VKGBGOOCLSLZQG-UHFFFAOYSA-N 0 0 383.202 3.130 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)c2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000507668485 567694681 /nfs/dbraw/zinc/69/46/81/567694681.db2.gz QJKWIZXUUZGCJN-SSDOTTSWSA-N 0 0 385.193 3.273 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000507668487 567695585 /nfs/dbraw/zinc/69/55/85/567695585.db2.gz QJKWIZXUUZGCJN-ZETCQYMHSA-N 0 0 385.193 3.273 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(Br)s1 ZINC000442548577 567695954 /nfs/dbraw/zinc/69/59/54/567695954.db2.gz NHLNFZKQOGXPNN-QMMMGPOBSA-N 0 0 398.238 3.235 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(Br)s1 ZINC000442578447 567696195 /nfs/dbraw/zinc/69/61/95/567696195.db2.gz NHLNFZKQOGXPNN-MRVPVSSYSA-N 0 0 398.238 3.235 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CCN2S(=O)(=O)c1ccccc1Br ZINC000460633659 567696239 /nfs/dbraw/zinc/69/62/39/567696239.db2.gz FRTJFUJMCPIQHV-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN C[C@@H](NC(=O)c1cn2ccc(Br)cc2n1)c1cccc([N+](=O)[O-])c1 ZINC000507685575 567696657 /nfs/dbraw/zinc/69/66/57/567696657.db2.gz CYFOEMMTADVTMU-SNVBAGLBSA-N 0 0 389.209 3.496 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000507681928 567696672 /nfs/dbraw/zinc/69/66/72/567696672.db2.gz DZSHNMALCCOIDV-MRVPVSSYSA-N 0 0 380.198 3.257 20 5 GGBDRN COc1cc(OC[C@@H](O)COc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000481706579 567696858 /nfs/dbraw/zinc/69/68/58/567696858.db2.gz KBYVWRXQVNYZDE-LBPRGKRZSA-N 0 0 398.209 3.185 20 5 GGBDRN CC[C@@H](Cc1ccccc1Br)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000532110042 567696910 /nfs/dbraw/zinc/69/69/10/567696910.db2.gz WMRVMRDHMJMWFC-LBPRGKRZSA-N 0 0 380.242 3.447 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000507681929 567697387 /nfs/dbraw/zinc/69/73/87/567697387.db2.gz DZSHNMALCCOIDV-QMMMGPOBSA-N 0 0 380.198 3.257 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NCC(=O)Nc2ccc(Br)c(C)c2)n1 ZINC000481701134 567697536 /nfs/dbraw/zinc/69/75/36/567697536.db2.gz ZBRROASHHWJVNH-UHFFFAOYSA-N 0 0 379.214 3.420 20 5 GGBDRN O=[N+]([O-])c1ccn(Cc2nc(C3(c4cccc(Br)c4)CC3)no2)n1 ZINC000442606136 567698106 /nfs/dbraw/zinc/69/81/06/567698106.db2.gz NLLUQUZKAFZQIH-UHFFFAOYSA-N 0 0 390.197 3.065 20 5 GGBDRN C[C@@H]1Oc2cc(F)ccc2[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000553906269 567698455 /nfs/dbraw/zinc/69/84/55/567698455.db2.gz ORVSFABGHYLLEQ-VXJOIVPMSA-N 0 0 386.788 3.188 20 5 GGBDRN O=[N+]([O-])c1nn(C[C@H](O)Cc2ccc3ccccc3c2)cc1Br ZINC000481713673 567698606 /nfs/dbraw/zinc/69/86/06/567698606.db2.gz SKYDLGWQIMQGAW-CQSZACIVSA-N 0 0 376.210 3.311 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H](C)c2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000507696936 567698586 /nfs/dbraw/zinc/69/85/86/567698586.db2.gz FGMDFQVLCLJPCB-ZETCQYMHSA-N 0 0 385.193 3.029 20 5 GGBDRN CC(C)(C)n1cc(Br)c(C(=O)NCCc2cccc([N+](=O)[O-])c2)n1 ZINC000597451371 567700196 /nfs/dbraw/zinc/70/01/96/567700196.db2.gz YUSYILRXAZCLGT-UHFFFAOYSA-N 0 0 395.257 3.281 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN[C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000481732879 567700222 /nfs/dbraw/zinc/70/02/22/567700222.db2.gz DXHNLKRAWJWZHH-AWEZNQCLSA-N 0 0 383.221 3.471 20 5 GGBDRN CC(C)CC[C@@H](O)COc1ccc(I)cc1[N+](=O)[O-] ZINC000481730977 567700253 /nfs/dbraw/zinc/70/02/53/567700253.db2.gz BEVLFPFIPGIMQL-LLVKDONJSA-N 0 0 379.194 3.375 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCCc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000532165079 567701628 /nfs/dbraw/zinc/70/16/28/567701628.db2.gz WDOGVBVNHYHRSV-UHFFFAOYSA-N 0 0 383.857 3.153 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)s1 ZINC000442720711 567701744 /nfs/dbraw/zinc/70/17/44/567701744.db2.gz LKILSYIMJBUUMZ-MRVPVSSYSA-N 0 0 391.268 3.458 20 5 GGBDRN CSCc1cccc(Nc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])c1 ZINC000532166827 567701748 /nfs/dbraw/zinc/70/17/48/567701748.db2.gz LMEISDQYFUMNPN-UHFFFAOYSA-N 0 0 381.479 3.452 20 5 GGBDRN O=C(CC[S@@](=O)c1cccc(Br)c1)Nc1ccccc1[N+](=O)[O-] ZINC000507753132 567703123 /nfs/dbraw/zinc/70/31/23/567703123.db2.gz VBIJEGJPCTZNHW-HSZRJFAPSA-N 0 0 397.250 3.494 20 5 GGBDRN C[C@@H](O)[C@H]1C[C@H](C)CCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000442723307 567703213 /nfs/dbraw/zinc/70/32/13/567703213.db2.gz SAAAVHDJGUKBNO-KBVBSXBZSA-N 0 0 397.280 3.072 20 5 GGBDRN COc1cc(-c2nc(-c3ccc(Br)cn3)no2)ccc1[N+](=O)[O-] ZINC000460823904 567703464 /nfs/dbraw/zinc/70/34/64/567703464.db2.gz OKMPGLLEMCUZEU-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCc1nc(-c2ccc(Br)cn2)no1 ZINC000460818289 567703661 /nfs/dbraw/zinc/70/36/61/567703661.db2.gz WKPOLVOUEOVQDL-UHFFFAOYSA-N 0 0 376.170 3.414 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1nc(-c2ccc(Br)cn2)no1 ZINC000460822646 567703675 /nfs/dbraw/zinc/70/36/75/567703675.db2.gz FTOLDOLFRFTBPU-UHFFFAOYSA-N 0 0 390.197 3.457 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(NC[C@H](O)COc2ccccc2Br)c1 ZINC000532217539 567704288 /nfs/dbraw/zinc/70/42/88/567704288.db2.gz WXNPYJMDKMWQTE-NSHDSACASA-N 0 0 397.225 3.218 20 5 GGBDRN O=C(N[C@H](c1ccc(Br)cc1)C1CCC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000507787364 567705332 /nfs/dbraw/zinc/70/53/32/567705332.db2.gz PRYGBGFECNXUMZ-AWEZNQCLSA-N 0 0 379.214 3.352 20 5 GGBDRN 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Cc1ccc([N+](=O)[O-])c(NCCNS(=O)(=O)c2ccc(Cl)s2)c1 ZINC000443896569 567779396 /nfs/dbraw/zinc/77/93/96/567779396.db2.gz MEQISAUJKCSCFG-UHFFFAOYSA-N 0 0 375.859 3.009 20 5 GGBDRN CSc1ccc(CSc2ncnc(N3CCOCC3)c2[N+](=O)[O-])cc1 ZINC000598624592 567780416 /nfs/dbraw/zinc/78/04/16/567780416.db2.gz KNOMABDXZLMGSI-UHFFFAOYSA-N 0 0 378.479 3.236 20 5 GGBDRN C[C@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@H]1CO ZINC000598636429 567780594 /nfs/dbraw/zinc/78/05/94/567780594.db2.gz IQEOHMLRBFBKGU-QWRGUYRKSA-N 0 0 380.242 3.360 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1ccc2c(n1)CCCC2 ZINC000443949651 567781484 /nfs/dbraw/zinc/78/14/84/567781484.db2.gz XHRBJCDGCCVKGP-UHFFFAOYSA-N 0 0 381.841 3.001 20 5 GGBDRN Cc1cc(N2CCCC[C@@H](S(C)(=O)=O)C2)c(Br)cc1[N+](=O)[O-] ZINC000443952045 567781522 /nfs/dbraw/zinc/78/15/22/567781522.db2.gz YDORVZJFTMTMFO-LLVKDONJSA-N 0 0 391.287 3.069 20 5 GGBDRN CC(C)CSCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000533697398 567782916 /nfs/dbraw/zinc/78/29/16/567782916.db2.gz NVNNGKVKFGZEQY-UHFFFAOYSA-N 0 0 386.417 3.281 20 5 GGBDRN Cc1ccc(OC[C@H](O)COc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000533709010 567783767 /nfs/dbraw/zinc/78/37/67/567783767.db2.gz ULHREYUFHUEIPO-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN Cc1cc(OC[C@H](O)COc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000533709068 567783789 /nfs/dbraw/zinc/78/37/89/567783789.db2.gz WXAMMACQUAJSJH-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN CC(C)CSCCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000533711199 567784012 /nfs/dbraw/zinc/78/40/12/567784012.db2.gz KVVPCNJIULWORS-UHFFFAOYSA-N 0 0 387.527 3.180 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000555462840 567785171 /nfs/dbraw/zinc/78/51/71/567785171.db2.gz WRPSWWPDFPHYSP-CYBMUJFWSA-N 0 0 380.388 3.013 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](c2cccs2)C(C)(C)CO)ccc1[N+](=O)[O-] ZINC000574558340 567785478 /nfs/dbraw/zinc/78/54/78/567785478.db2.gz HHDROWAQRQHKBX-OAHLLOKOSA-N 0 0 384.479 3.003 20 5 GGBDRN CC[C@@H](NC(=O)c1sc(Br)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000555505276 567786090 /nfs/dbraw/zinc/78/60/90/567786090.db2.gz WLWPSPLFGHOORP-SSDOTTSWSA-N 0 0 393.259 3.269 20 5 GGBDRN Cc1cc(Br)cc(S(=O)(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000444060936 567788201 /nfs/dbraw/zinc/78/82/01/567788201.db2.gz YCJWUSAMLKBCLB-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN C[S@](=O)[C@@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000598756992 567788580 /nfs/dbraw/zinc/78/85/80/567788580.db2.gz JVKVUWWMZKTBPC-OZGSTZEOSA-N 0 0 378.372 3.033 20 5 GGBDRN C[S@](=O)[C@H]1CCC[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000598757088 567788934 /nfs/dbraw/zinc/78/89/34/567788934.db2.gz SWEFTLIHZRJHFF-JJPWZELDSA-N 0 0 378.372 3.033 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC[C@@H](O)COc1ccc(Br)cc1 ZINC000555566845 567789007 /nfs/dbraw/zinc/78/90/07/567789007.db2.gz VKFVAYYHSFMADG-AWEZNQCLSA-N 0 0 382.210 3.484 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)COc1ccc(Br)cc1 ZINC000555566846 567789038 /nfs/dbraw/zinc/78/90/38/567789038.db2.gz VKFVAYYHSFMADG-CQSZACIVSA-N 0 0 382.210 3.484 20 5 GGBDRN CNc1ccc(C(=O)N=c2cc(-c3ccc(Cl)s3)[nH][nH]2)cc1[N+](=O)[O-] ZINC000533843240 567789682 /nfs/dbraw/zinc/78/96/82/567789682.db2.gz UOUZIPOWKSAPRA-UHFFFAOYSA-N 0 0 377.813 3.416 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N=c1cc(-c2ccc(Cl)s2)[nH][nH]1 ZINC000533841627 567789710 /nfs/dbraw/zinc/78/97/10/567789710.db2.gz NYWHBWUUZBWBSQ-UHFFFAOYSA-N 0 0 378.797 3.139 20 5 GGBDRN C[C@@H]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000533880883 567791704 /nfs/dbraw/zinc/79/17/04/567791704.db2.gz LZMXWLLSEBERJH-NXEZZACHSA-N 0 0 388.205 3.365 20 5 GGBDRN COc1cc(CCNc2cc(C)c(Br)cn2)c([N+](=O)[O-])cc1OC ZINC000533885033 567791775 /nfs/dbraw/zinc/79/17/75/567791775.db2.gz VBFVZALLNDWGNH-UHFFFAOYSA-N 0 0 396.241 3.154 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCc2cccc([N+](=O)[O-])c2)cc1Br ZINC000533913013 567793009 /nfs/dbraw/zinc/79/30/09/567793009.db2.gz ICLJWLMRAMCDMP-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN O=C(CN1CC[C@@H](CC2CC2)C1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000555696640 567795574 /nfs/dbraw/zinc/79/55/74/567795574.db2.gz JUBZZKDUBCTLDL-LBPRGKRZSA-N 0 0 382.258 3.418 20 5 GGBDRN CSc1ccccc1S(=O)(=O)n1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000444200563 567796031 /nfs/dbraw/zinc/79/60/31/567796031.db2.gz CLGQPZVWORQMPP-UHFFFAOYSA-N 0 0 375.431 3.417 20 5 GGBDRN CSc1ccccc1S(=O)(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000444204352 567797307 /nfs/dbraw/zinc/79/73/07/567797307.db2.gz HZSHTDPDQOCMQR-UHFFFAOYSA-N 0 0 386.882 3.491 20 5 GGBDRN Cc1nn(CCC(=O)N(C)c2ccccc2Br)c(C)c1[N+](=O)[O-] ZINC000598889141 567798278 /nfs/dbraw/zinc/79/82/78/567798278.db2.gz TVRZKZDKPKJABX-UHFFFAOYSA-N 0 0 381.230 3.224 20 5 GGBDRN O=C(N[C@H]1CCC[C@@H](F)C1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000574811910 567798690 /nfs/dbraw/zinc/79/86/90/567798690.db2.gz MKXMALCRLVDNBV-KOLCDFICSA-N 0 0 392.168 3.210 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)s1 ZINC000444276083 567800498 /nfs/dbraw/zinc/80/04/98/567800498.db2.gz LKILSYIMJBUUMZ-QMMMGPOBSA-N 0 0 391.268 3.458 20 5 GGBDRN Cc1nc(N2CC[C@H](Oc3cncc(Br)c3)C2)ccc1[N+](=O)[O-] ZINC000599106438 567805444 /nfs/dbraw/zinc/80/54/44/567805444.db2.gz IDZWHXOOYVGREH-LBPRGKRZSA-N 0 0 379.214 3.113 20 5 GGBDRN Cn1cc([C@@H]2C[C@H](Nc3ccc([N+](=O)[O-])cc3Br)CCO2)cn1 ZINC000599104403 567805484 /nfs/dbraw/zinc/80/54/84/567805484.db2.gz BLVPXGNRIPATFN-ABAIWWIYSA-N 0 0 381.230 3.423 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCO[C@@H](c3cnn(C)c3)C2)ncc1[N+](=O)[O-] ZINC000599106796 567805507 /nfs/dbraw/zinc/80/55/07/567805507.db2.gz HJEXBTYQHHPIER-DGCLKSJQSA-N 0 0 396.245 3.126 20 5 GGBDRN Cn1cc([C@@H]2C[C@H](Nc3ccc(Br)cc3[N+](=O)[O-])CCO2)cn1 ZINC000599106411 567805643 /nfs/dbraw/zinc/80/56/43/567805643.db2.gz GLQUPVTVPVUEKL-DOMZBBRYSA-N 0 0 381.230 3.423 20 5 GGBDRN Cn1cc([C@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cc3Br)CCO2)cn1 ZINC000599104414 567805650 /nfs/dbraw/zinc/80/56/50/567805650.db2.gz BLVPXGNRIPATFN-XHDPSFHLSA-N 0 0 381.230 3.423 20 5 GGBDRN Cn1cc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cc3Br)CCO2)cn1 ZINC000599104407 567805685 /nfs/dbraw/zinc/80/56/85/567805685.db2.gz BLVPXGNRIPATFN-NHYWBVRUSA-N 0 0 381.230 3.423 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCO[C@@H](c3cnn(C)c3)C2)ncc1[N+](=O)[O-] ZINC000599106799 567805773 /nfs/dbraw/zinc/80/57/73/567805773.db2.gz HJEXBTYQHHPIER-WCQYABFASA-N 0 0 396.245 3.126 20 5 GGBDRN CNc1ccc(C(=O)Nc2cc(OC)c(Br)cn2)cc1[N+](=O)[O-] ZINC000534263996 567805856 /nfs/dbraw/zinc/80/58/56/567805856.db2.gz QSIHUPJBBGUYGF-UHFFFAOYSA-N 0 0 381.186 3.055 20 5 GGBDRN Cc1c(Br)c(N2C[C@H](c3cnn(C)c3)C(C)(C)C2)ncc1[N+](=O)[O-] ZINC000599109415 567805981 /nfs/dbraw/zinc/80/59/81/567805981.db2.gz WGBCKBPOIMAVRS-GFCCVEGCSA-N 0 0 394.273 3.424 20 5 GGBDRN Cc1sc(C(=O)NC[C@@H](CO)Cc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000444498550 567806387 /nfs/dbraw/zinc/80/63/87/567806387.db2.gz ZLPSPTPKOVOUGV-JTQLQIEISA-N 0 0 386.832 3.338 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1N1CC[C@H](Sc2ccc(Br)cc2)C1 ZINC000599126070 567806554 /nfs/dbraw/zinc/80/65/54/567806554.db2.gz LXHUSGCXKKECRH-LBPRGKRZSA-N 0 0 383.271 3.462 20 5 GGBDRN C[C@H]1CN(c2c(I)cncc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000599116942 567806565 /nfs/dbraw/zinc/80/65/65/567806565.db2.gz HABCQXVFUBCRLF-YUMQZZPRSA-N 0 0 397.163 3.322 20 5 GGBDRN Cc1ccc(O)c(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)c1 ZINC000534293551 567806727 /nfs/dbraw/zinc/80/67/27/567806727.db2.gz MUPQYEAYXGTSAT-UHFFFAOYSA-N 0 0 398.156 3.466 20 5 GGBDRN CC(C)(C)c1ncc2c(n1)CCN(c1c(Br)cncc1[N+](=O)[O-])C2 ZINC000599127616 567807077 /nfs/dbraw/zinc/80/70/77/567807077.db2.gz YXYDLEIFDOFSCG-UHFFFAOYSA-N 0 0 392.257 3.403 20 5 GGBDRN CCC[C@]1(CO)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000444559791 567807878 /nfs/dbraw/zinc/80/78/78/567807878.db2.gz TUUCUZXFOUZGGR-MRXNPFEDSA-N 0 0 385.258 3.053 20 5 GGBDRN Cc1c(Br)c(N2CCc3nc(C4CC4)ncc3C2)ncc1[N+](=O)[O-] ZINC000599160835 567807870 /nfs/dbraw/zinc/80/78/70/567807870.db2.gz PZEUAXDNOUIQIL-UHFFFAOYSA-N 0 0 390.241 3.291 20 5 GGBDRN Cc1ccc(CN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(Br)c1 ZINC000534336862 567808313 /nfs/dbraw/zinc/80/83/13/567808313.db2.gz QGVUDEHXARZXKK-UHFFFAOYSA-N 0 0 391.269 3.383 20 5 GGBDRN COC(=O)[C@H]1CN(c2c(Br)cncc2[N+](=O)[O-])Cc2ccccc21 ZINC000599187073 567809314 /nfs/dbraw/zinc/80/93/14/567809314.db2.gz DPXWYIWRAUZOOI-LBPRGKRZSA-N 0 0 392.209 3.029 20 5 GGBDRN Cc1cc(Br)oc1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444640901 567809393 /nfs/dbraw/zinc/80/93/93/567809393.db2.gz SXBOTFDBFMESEX-UHFFFAOYSA-N 0 0 379.170 3.065 20 5 GGBDRN C[C@H](COCC(F)(F)F)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599185413 567809417 /nfs/dbraw/zinc/80/94/17/567809417.db2.gz ZTYVVCAQHMJLSL-SSDOTTSWSA-N 0 0 385.136 3.055 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1sccc1Br ZINC000534391901 567809654 /nfs/dbraw/zinc/80/96/54/567809654.db2.gz GRZXJOLJYBTGDS-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(Br)c1 ZINC000444632743 567809635 /nfs/dbraw/zinc/80/96/35/567809635.db2.gz QLJJDASYEKALPD-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN O=C(Cc1ccc(Br)cc1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444632257 567809794 /nfs/dbraw/zinc/80/97/94/567809794.db2.gz OOXAHHLZCJYMEA-UHFFFAOYSA-N 0 0 389.209 3.093 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Br)s1 ZINC000444632596 567809911 /nfs/dbraw/zinc/80/99/11/567809911.db2.gz GNGSONGAOYCAKD-UHFFFAOYSA-N 0 0 381.211 3.225 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N[C@@H]1CCCc2ccc(Cl)cc21 ZINC000599203958 567810077 /nfs/dbraw/zinc/81/00/77/567810077.db2.gz YKUKUQPPAJEGMM-CQSZACIVSA-N 0 0 381.841 3.385 20 5 GGBDRN COC(=O)[C@@H]1CN(c2ncc(Br)cc2[N+](=O)[O-])Cc2ccccc21 ZINC000599189285 567810249 /nfs/dbraw/zinc/81/02/49/567810249.db2.gz ZLAKCGMOMNXTAL-CYBMUJFWSA-N 0 0 392.209 3.029 20 5 GGBDRN Cc1nc(C(C)C)sc1[C@H](C)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000534413147 567810695 /nfs/dbraw/zinc/81/06/95/567810695.db2.gz XHLPHENJUFVGAE-NSHDSACASA-N 0 0 384.483 3.260 20 5 GGBDRN O=[N+]([O-])c1cccc(CCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 ZINC000534639021 567815329 /nfs/dbraw/zinc/81/53/29/567815329.db2.gz SEBWEMRQKNWLHM-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=C(NCCc1ccc(Br)cc1)NCCc1cccc([N+](=O)[O-])c1 ZINC000534642434 567815699 /nfs/dbraw/zinc/81/56/99/567815699.db2.gz IRAHJYDQVSQIFJ-UHFFFAOYSA-N 0 0 392.253 3.442 20 5 GGBDRN Cc1cc(CNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)ccc1F ZINC000026054650 570246251 /nfs/dbraw/zinc/24/62/51/570246251.db2.gz LGCCMHYCRFJUGO-UHFFFAOYSA-N 0 0 387.367 3.047 20 5 GGBDRN C[C@H](OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(=O)NC(C)(C)C ZINC000015816534 570264415 /nfs/dbraw/zinc/26/44/15/570264415.db2.gz YMAWGQOKSIWAIC-AWEZNQCLSA-N 0 0 391.468 3.291 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@@H]1C(F)(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000117235154 570265851 /nfs/dbraw/zinc/26/58/51/570265851.db2.gz WLQCCVLDICUAER-GXTWGEPZSA-N 0 0 383.326 3.287 20 5 GGBDRN CC(=O)Nc1ccc2c(COC(=O)c3cccc(C)c3[N+](=O)[O-])cc(=O)oc2c1 ZINC000049579205 570270231 /nfs/dbraw/zinc/27/02/31/570270231.db2.gz VGAJDEXGNJALHB-UHFFFAOYSA-N 0 0 396.355 3.325 20 5 GGBDRN Cc1nc(C2(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)CCCCCC2)no1 ZINC000024688981 570279024 /nfs/dbraw/zinc/27/90/24/570279024.db2.gz YMXLRAITENPGIV-UHFFFAOYSA-N 0 0 394.453 3.123 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000014199059 570295813 /nfs/dbraw/zinc/29/58/13/570295813.db2.gz DRVFPLPGDJJNRW-CYBMUJFWSA-N 0 0 387.417 3.100 20 5 GGBDRN O=C(N[C@H]1CCSc2c(F)cccc21)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000014244957 570303035 /nfs/dbraw/zinc/30/30/35/570303035.db2.gz RXVZMZIZWWXEPL-AWEZNQCLSA-N 0 0 399.407 3.282 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000012943500 570316257 /nfs/dbraw/zinc/31/62/57/570316257.db2.gz PARYCRVWEWRDRZ-OAHLLOKOSA-N 0 0 384.388 3.352 20 5 GGBDRN O=C(CCC(=O)N1CCC(c2ccccc2)=N1)OCc1cccc([N+](=O)[O-])c1 ZINC000023938005 570339451 /nfs/dbraw/zinc/33/94/51/570339451.db2.gz GZKLXJWIHVQPJH-UHFFFAOYSA-N 0 0 381.388 3.055 20 5 GGBDRN C[C@]12CCC(=O)N1[C@H](C(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1)CS2 ZINC000109734418 570389091 /nfs/dbraw/zinc/38/90/91/570389091.db2.gz SXDHSUMFFAQBRC-LPHOPBHVSA-N 0 0 389.477 3.324 20 5 GGBDRN Cc1nc(CCNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cs1 ZINC000024924800 570398577 /nfs/dbraw/zinc/39/85/77/570398577.db2.gz VFCALVUFQPLXRE-UHFFFAOYSA-N 0 0 377.469 3.279 20 5 GGBDRN CC(C)(C)c1cnc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)o1 ZINC000072282479 570471897 /nfs/dbraw/zinc/47/18/97/570471897.db2.gz HAUZOWIQWKJALW-UHFFFAOYSA-N 0 0 389.408 3.074 20 5 GGBDRN CCOC(=O)c1c(CC)c(C)sc1NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000006619277 570506084 /nfs/dbraw/zinc/50/60/84/570506084.db2.gz RBJOISHYBAUDHL-UHFFFAOYSA-N 0 0 394.453 3.156 20 5 GGBDRN CCc1ccc([C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])N(C)C)cc1 ZINC000007979770 570596599 /nfs/dbraw/zinc/59/65/99/570596599.db2.gz SAMZVMWJWJPUIH-IBGZPJMESA-N 0 0 391.493 3.276 20 5 GGBDRN Cc1nn(CC(=O)N2N=C(c3cccs3)C[C@@H]2c2ccco2)c(C)c1[N+](=O)[O-] ZINC000022986426 570614541 /nfs/dbraw/zinc/61/45/41/570614541.db2.gz QHVJRMZPAZODLU-CQSZACIVSA-N 0 0 399.432 3.441 20 5 GGBDRN Cc1nn(CC(=O)N2N=C(c3cccs3)C[C@H]2c2ccco2)c(C)c1[N+](=O)[O-] ZINC000022986427 570614631 /nfs/dbraw/zinc/61/46/31/570614631.db2.gz QHVJRMZPAZODLU-AWEZNQCLSA-N 0 0 399.432 3.441 20 5 GGBDRN COc1ccc(OC)c(CN2CCN(c3ccc(C(C)=O)cc3[N+](=O)[O-])CC2)c1 ZINC000033010973 570622742 /nfs/dbraw/zinc/62/27/42/570622742.db2.gz AWCUNECAUZRZDO-UHFFFAOYSA-N 0 0 399.447 3.137 20 5 GGBDRN Cc1c(NCC(=O)Nc2cc(Cl)ccc2-n2cncn2)cccc1[N+](=O)[O-] ZINC000012632001 570693646 /nfs/dbraw/zinc/69/36/46/570693646.db2.gz HGWHCRVUQPXESI-UHFFFAOYSA-N 0 0 386.799 3.188 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000025514925 570756925 /nfs/dbraw/zinc/75/69/25/570756925.db2.gz JAIFHACXSIFYNQ-MRXNPFEDSA-N 0 0 381.392 3.065 20 5 GGBDRN COc1cc(CCNC(=O)c2cc3cc(C)ccc3[nH]2)c([N+](=O)[O-])cc1OC ZINC000032753160 570796041 /nfs/dbraw/zinc/79/60/41/570796041.db2.gz AHWZIENCHGWEQP-UHFFFAOYSA-N 0 0 383.404 3.374 20 5 GGBDRN CN(CCOc1ccc(F)cc1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000032788801 570810467 /nfs/dbraw/zinc/81/04/67/570810467.db2.gz JDXCCGSKNJYYPG-UHFFFAOYSA-N 0 0 384.367 3.071 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCc3cc(F)cc(F)c32)c([N+](=O)[O-])c1 ZINC000032824840 570838798 /nfs/dbraw/zinc/83/87/98/570838798.db2.gz DOAPRZVQLLEQES-UHFFFAOYSA-N 0 0 384.360 3.023 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(Cc2nc(C3CC3)no2)CC1 ZINC000012544976 570845941 /nfs/dbraw/zinc/84/59/41/570845941.db2.gz COZMWOAPACJIRG-UHFFFAOYSA-N 0 0 397.357 3.196 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cnc(-c3ccccc3)nc2)cc([N+](=O)[O-])c1 ZINC000032844985 570852416 /nfs/dbraw/zinc/85/24/16/570852416.db2.gz FDVDOVBVZRRTKO-UHFFFAOYSA-N 0 0 392.371 3.481 20 5 GGBDRN COC(=O)N1CCC([C@H](C)NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000170600785 570858962 /nfs/dbraw/zinc/85/89/62/570858962.db2.gz VARUQINDBFTCOM-QWHCGFSZSA-N 0 0 395.481 3.059 20 5 GGBDRN COC(=O)N1CCC([C@H](C)NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000170600787 570859045 /nfs/dbraw/zinc/85/90/45/570859045.db2.gz VARUQINDBFTCOM-STQMWFEESA-N 0 0 395.481 3.059 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H](O)[C@@H](CO)Nc2ncc(C(F)(F)F)cc2Cl)cc1 ZINC000024527621 570887141 /nfs/dbraw/zinc/88/71/41/570887141.db2.gz UKEKRUWTNRFOOU-OLZOCXBDSA-N 0 0 391.733 3.168 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCN(Cc2ccccc2)CC1 ZINC000015345272 570898595 /nfs/dbraw/zinc/89/85/95/570898595.db2.gz YAYIYICWGBGSBA-UHFFFAOYSA-N 0 0 394.475 3.153 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1 ZINC000089767971 570912173 /nfs/dbraw/zinc/91/21/73/570912173.db2.gz KDQMFFZEIHRVQK-UHFFFAOYSA-N 0 0 387.783 3.033 20 5 GGBDRN CC(C)c1nnc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000016965915 570919635 /nfs/dbraw/zinc/91/96/35/570919635.db2.gz LIESVBYZHSUVFE-UHFFFAOYSA-N 0 0 375.454 3.425 20 5 GGBDRN C[C@@H](CCc1ccccc1)NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000017116051 570927458 /nfs/dbraw/zinc/92/74/58/570927458.db2.gz IXALXCUUEHGJGJ-KRWDZBQOSA-N 0 0 382.464 3.448 20 5 GGBDRN C[C@H](CCc1ccccc1)NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000017116052 570927487 /nfs/dbraw/zinc/92/74/87/570927487.db2.gz IXALXCUUEHGJGJ-QGZVFWFLSA-N 0 0 382.464 3.448 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1Cl)N(C)C ZINC000012748289 570993102 /nfs/dbraw/zinc/99/31/02/570993102.db2.gz IIBPZOMYPLJJEO-INIZCTEOSA-N 0 0 377.828 3.290 20 5 GGBDRN COc1ccc(OC)c2c1CN(c1ccc([N+](=O)[O-])c3cccnc31)C[C@H]2O ZINC000012757070 571008995 /nfs/dbraw/zinc/00/89/95/571008995.db2.gz VAWKWMIUPCMORQ-MRXNPFEDSA-N 0 0 381.388 3.214 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nc(CN2CCCCC2)cs1 ZINC000012780565 571034040 /nfs/dbraw/zinc/03/40/40/571034040.db2.gz PWEPNOXRCSJMEM-UHFFFAOYSA-N 0 0 376.438 3.055 20 5 GGBDRN Cc1ccc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)n[nH]2)cc1 ZINC000011494125 571049020 /nfs/dbraw/zinc/04/90/20/571049020.db2.gz UTSUIBDPDXBWAU-ZDUSSCGKSA-N 0 0 394.387 3.477 20 5 GGBDRN O=[N+]([O-])c1ccc(CCCCNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])cc1 ZINC000738358994 598854598 /nfs/dbraw/zinc/85/45/98/598854598.db2.gz HVJRQEPVZRLAJK-UHFFFAOYSA-N 0 0 383.368 3.118 20 5 GGBDRN Cc1ccc(NCCCNc2snc(Cl)c2-c2nn[nH]n2)c([N+](=O)[O-])c1 ZINC000737362449 598857217 /nfs/dbraw/zinc/85/72/17/598857217.db2.gz PFZVLCLTJKESGO-UHFFFAOYSA-N 0 0 394.848 3.107 20 5 GGBDRN O=C(C=Cc1ccccc1-c1nn[nH]n1)OCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000737801999 598913208 /nfs/dbraw/zinc/91/32/08/598913208.db2.gz OGIACKOIKJGFNR-SOFGYWHQSA-N 0 0 385.767 3.185 20 5 GGBDRN COc1cc(F)c([C@H](C)Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])cc1OC ZINC000737053728 598914090 /nfs/dbraw/zinc/91/40/90/598914090.db2.gz LCSCMVUDQWBPAS-VIFPVBQESA-N 0 0 388.359 3.104 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H](c1ccccc1)C1CCOCC1 ZINC000738357656 599061552 /nfs/dbraw/zinc/06/15/52/599061552.db2.gz HQYGKCKIDVECPS-GOSISDBHSA-N 0 0 380.408 3.355 20 5 GGBDRN C[C@@H](Sc1ccc(-c2nn[nH]n2)cc1F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000736194301 599065283 /nfs/dbraw/zinc/06/52/83/599065283.db2.gz ZMZJWRUSLWDGAD-SECBINFHSA-N 0 0 388.384 3.033 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CSc3ccc(-c4nn[nH]n4)cc3F)n2)cc1 ZINC000738359832 599067171 /nfs/dbraw/zinc/06/71/71/599067171.db2.gz OCRPPOZGPKUXSK-UHFFFAOYSA-N 0 0 399.367 3.256 20 5 GGBDRN Cc1ccc(-c2nn[nH]n2)cc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000822220633 599149055 /nfs/dbraw/zinc/14/90/55/599149055.db2.gz ZNHGTUQVMXCUFC-UHFFFAOYSA-N 0 0 392.297 3.354 20 5 GGBDRN CC(C)(C)c1ccc([C@H](O)CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000735648872 599170534 /nfs/dbraw/zinc/17/05/34/599170534.db2.gz IETTXTIAGJMKLF-QGZVFWFLSA-N 0 0 382.424 3.218 20 5 GGBDRN CN(Cc1cccc(Cl)c1Cl)c1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000821613333 599212800 /nfs/dbraw/zinc/21/28/00/599212800.db2.gz INHYOMCOPSZLKY-UHFFFAOYSA-N 0 0 380.195 3.113 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N[C@H]3CCOc4ccccc43)cc(-c3nn[nH]n3)c2c1 ZINC000738367559 599260685 /nfs/dbraw/zinc/26/06/85/599260685.db2.gz VQUBOKBUMNFKGA-INIZCTEOSA-N 0 0 389.375 3.259 20 5 GGBDRN COc1ccc(C)cc1CNc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000737077054 599270843 /nfs/dbraw/zinc/27/08/43/599270843.db2.gz MGCIBPQLAISANS-UHFFFAOYSA-N 0 0 391.391 3.252 20 5 GGBDRN Cc1cccc(C2(CNc3ncc([N+](=O)[O-])cc3-c3nn[nH]n3)CCCC2)c1 ZINC000737387964 598395563 /nfs/dbraw/zinc/39/55/63/598395563.db2.gz CKBGPAVCYZEZHH-UHFFFAOYSA-N 0 0 379.424 3.402 20 5 GGBDRN C[C@H](OC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1cccc(-c2nn[nH]n2)c1 ZINC000736160952 598484611 /nfs/dbraw/zinc/48/46/11/598484611.db2.gz UHDJYESBKYCOBJ-JTQLQIEISA-N 0 0 378.348 3.174 20 5 GGBDRN CCNc1ccc(C(=O)Nc2cc(-c3nn[nH]n3)cn2C(C)(C)C)cc1[N+](=O)[O-] ZINC000736584607 598488337 /nfs/dbraw/zinc/48/83/37/598488337.db2.gz VFKHEXFLLIRNFV-UHFFFAOYSA-N 0 0 398.427 3.016 20 5 GGBDRN CSc1ccc(C(=O)O[C@H](C)c2cccc(-c3nn[nH]n3)c2)cc1[N+](=O)[O-] ZINC000737193877 598489566 /nfs/dbraw/zinc/48/95/66/598489566.db2.gz YNVHYBZORZENBX-SNVBAGLBSA-N 0 0 385.405 3.415 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1c(-c2nn[nH]n2)cnc2c(F)cc(F)cc21 ZINC000736828150 598770249 /nfs/dbraw/zinc/77/02/49/598770249.db2.gz IETCQRYFQJCPKW-UHFFFAOYSA-N 0 0 397.345 3.238 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)C=Cc1ccccc1-c1nn[nH]n1 ZINC000737262653 599302167 /nfs/dbraw/zinc/30/21/67/599302167.db2.gz FINQVUAOBZLZOL-VOTSOKGWSA-N 0 0 385.767 3.356 20 5 GGBDRN COC(=O)C=Cc1ccc(N[C@H](C)c2cccc(-c3nn[nH]n3)c2)c([N+](=O)[O-])c1 ZINC000821657752 599356240 /nfs/dbraw/zinc/35/62/40/599356240.db2.gz VGEOIDRIJWWRSQ-ZVTBTPLYSA-N 0 0 394.391 3.134 20 5 GGBDRN CCOc1ccc(-c2nn[nH]n2)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000736633651 599372710 /nfs/dbraw/zinc/37/27/10/599372710.db2.gz DOELHVNWBUONFJ-UHFFFAOYSA-N 0 0 388.771 3.079 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccc(OC(C)C)c(-c2nn[nH]n2)c1 ZINC000821846141 607374523 /nfs/dbraw/zinc/37/45/23/607374523.db2.gz NLWCVIDWAZJXQX-UHFFFAOYSA-N 0 0 384.396 3.183 20 5 GGBDRN C[C@@H]1CCCC[C@H]1OCCNc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000820705924 599476482 /nfs/dbraw/zinc/47/64/82/599476482.db2.gz WVQDXDNPZUSSHT-SJKOYZFVSA-N 0 0 397.439 3.330 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N3CC4C[C@@H]5CC3C[C@H](C4)C5)cc(-c3nn[nH]n3)c2c1 ZINC000823645948 599501300 /nfs/dbraw/zinc/50/13/00/599501300.db2.gz XJLPYRCUDBTRLQ-DOOHLRMFSA-N 0 0 391.435 3.338 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2ccc(-c3nn[nH]n3)cc2F)c(Br)c1 ZINC000738367377 599523672 /nfs/dbraw/zinc/52/36/72/599523672.db2.gz SJKBTKXTVSUAQY-UHFFFAOYSA-N 0 0 394.160 3.256 20 5 GGBDRN CN(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(-c2nn[nH]n2)c1 ZINC000821573129 599630759 /nfs/dbraw/zinc/63/07/59/599630759.db2.gz CEBILNIFXFTJJH-UHFFFAOYSA-N 0 0 392.297 3.070 20 5 GGBDRN O=C([O-])c1cc(C(=O)N[C@@H](C[NH+]2CCCCC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000738672058 599742183 /nfs/dbraw/zinc/74/21/83/599742183.db2.gz BTVOYCLVNFOZPO-IBGZPJMESA-N 0 0 397.431 3.250 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C(=O)[O-])c1ccc(Br)cc1 ZINC000738069125 599790763 /nfs/dbraw/zinc/79/07/63/599790763.db2.gz YDHRZTUPXHOIPM-HNNXBMFYSA-N 0 0 395.209 3.281 20 5 GGBDRN Cc1cc(-c2nn[nH]n2)ccc1COC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000826253670 607413303 /nfs/dbraw/zinc/41/33/03/607413303.db2.gz YMRQZSLUXYXCMQ-UHFFFAOYSA-N 0 0 396.407 3.019 20 5 GGBDRN C[NH+]1CCC(Nc2ccccc2NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC000737515309 600024389 /nfs/dbraw/zinc/02/43/89/600024389.db2.gz SMFYQWKRGZOTPR-UHFFFAOYSA-N 0 0 398.419 3.051 20 5 GGBDRN C[C@]([NH2+]Cc1ccccc1[N+](=O)[O-])(C(=O)[O-])c1cccc(Br)c1 ZINC000736664681 600079321 /nfs/dbraw/zinc/07/93/21/600079321.db2.gz QLOUVIUOLHEYNQ-MRXNPFEDSA-N 0 0 379.210 3.447 20 5 GGBDRN CC[N@@H+]1CCC[C@@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000737114139 600432610 /nfs/dbraw/zinc/43/26/10/600432610.db2.gz GXAXSLWGEBNJER-OAHLLOKOSA-N 0 0 397.431 3.420 20 5 GGBDRN C[NH+]1CCC(N(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000737508764 600478109 /nfs/dbraw/zinc/47/81/09/600478109.db2.gz LZKSQLZNYWUQHZ-UHFFFAOYSA-N 0 0 383.404 3.034 20 5 GGBDRN CN(C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000737334047 600623803 /nfs/dbraw/zinc/62/38/03/600623803.db2.gz QCHJTBKMPYXPMY-UHFFFAOYSA-N 0 0 397.431 3.030 20 5 GGBDRN C[NH+](C)C1(CNc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])Cc2ccccc2C1 ZINC000830590794 600816178 /nfs/dbraw/zinc/81/61/78/600816178.db2.gz CBPDLPXEPSBLOO-CSKARUKUSA-N 0 0 381.432 3.204 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000828284831 600961595 /nfs/dbraw/zinc/96/15/95/600961595.db2.gz ILVZTYNORNSXBE-HNNXBMFYSA-N 0 0 397.431 3.030 20 5 GGBDRN CN(C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000830524394 600984175 /nfs/dbraw/zinc/98/41/75/600984175.db2.gz XIGACYWEFGUEIY-SFHVURJKSA-N 0 0 397.431 3.030 20 5 GGBDRN C[C@@H](C[N@@H+](Cc1ccccc1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C(=O)[O-] ZINC000736584169 601089415 /nfs/dbraw/zinc/08/94/15/601089415.db2.gz QECPCDSJFAFDDA-HNNXBMFYSA-N 0 0 395.419 3.034 20 5 GGBDRN O=C([O-])C1CC[NH+](CCCNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000566296962 601197183 /nfs/dbraw/zinc/19/71/83/601197183.db2.gz AQZYJTUHEDLAJU-UHFFFAOYSA-N 0 0 375.347 3.212 20 5 GGBDRN C[C@@H](C(=O)[O-])[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000826055032 601201740 /nfs/dbraw/zinc/20/17/40/601201740.db2.gz UTMYSOAKOKAAHV-DIFFPNOSSA-N 0 0 391.811 3.238 20 5 GGBDRN C[C@@H](C(=O)[O-])[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000826053096 601202545 /nfs/dbraw/zinc/20/25/45/601202545.db2.gz IERLVTIITGFQIM-DIFFPNOSSA-N 0 0 391.811 3.238 20 5 GGBDRN C[C@@H](C(=O)[O-])[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000826053100 601202597 /nfs/dbraw/zinc/20/25/97/601202597.db2.gz IERLVTIITGFQIM-PIGZYNQJSA-N 0 0 391.811 3.238 20 5 GGBDRN Cc1c(NC(=O)CC[NH2+][C@H](c2ccccc2)[C@H](C)C(=O)[O-])cccc1[N+](=O)[O-] ZINC000832857514 601205508 /nfs/dbraw/zinc/20/55/08/601205508.db2.gz QVFUPWFANAYVBL-LIRRHRJNSA-N 0 0 385.420 3.283 20 5 GGBDRN Cc1ccc([C@H](C)[NH2+][C@H]2CCN(c3sccc3C(=O)[O-])C2=O)cc1[N+](=O)[O-] ZINC000832920811 601368981 /nfs/dbraw/zinc/36/89/81/601368981.db2.gz HXFNOXUGOHADGD-FZMZJTMJSA-N 0 0 389.433 3.119 20 5 GGBDRN CC[C@@H]([NH2+][C@H](C)C(=O)NCc1ccc(C(=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000828982951 601380586 /nfs/dbraw/zinc/38/05/86/601380586.db2.gz KGJYRUBUWBJXJQ-FZKQIMNGSA-N 0 0 385.420 3.039 20 5 GGBDRN C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830791592 601899194 /nfs/dbraw/zinc/89/91/94/601899194.db2.gz GQMJEGHKOGOEJS-MRXNPFEDSA-N 0 0 384.310 3.149 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2CC[C@@](C)(C(=O)[O-])C2)c([N+](=O)[O-])c1 ZINC000263577296 601946939 /nfs/dbraw/zinc/94/69/39/601946939.db2.gz RJXKUCJVIQLCQD-GHTZIAJQSA-N 0 0 397.431 3.380 20 5 GGBDRN O=C(Nc1sccc1-c1nn[nH]n1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000826461080 607577226 /nfs/dbraw/zinc/57/72/26/607577226.db2.gz FMGWDZOVKHKVJL-UHFFFAOYSA-N 0 0 384.299 3.108 20 5 GGBDRN Cc1ccc(-c2nn[nH]n2)cc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000826278394 607578479 /nfs/dbraw/zinc/57/84/79/607578479.db2.gz ABGJTMOWIHTEKB-UHFFFAOYSA-N 0 0 392.297 3.354 20 5 GGBDRN COc1ccc(-c2nn[nH]n2)cc1CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000826181990 607642463 /nfs/dbraw/zinc/64/24/63/607642463.db2.gz VXNQIRCQMISSGY-UHFFFAOYSA-N 0 0 388.815 3.069 20 5 GGBDRN C[C@@H]1C[NH+](CCCCNc2cc(Cl)c(C(=O)[O-])cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000828449316 604775951 /nfs/dbraw/zinc/77/59/51/604775951.db2.gz JXXSGBQWXXJWHE-VXGBXAGGSA-N 0 0 385.848 3.248 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000826497658 607737068 /nfs/dbraw/zinc/73/70/68/607737068.db2.gz OUXBQQZQJOVHQA-GFCCVEGCSA-N 0 0 386.799 3.086 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](Oc3ccccc3Cl)C2)c(-c2nn[nH]n2)c1 ZINC000826499199 607737896 /nfs/dbraw/zinc/73/78/96/607737896.db2.gz ZMEDLVXOAJITIS-GFCCVEGCSA-N 0 0 386.799 3.086 20 5 GGBDRN CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[C@@H]1c1ccccc1 ZINC000820995410 606039333 /nfs/dbraw/zinc/03/93/33/606039333.db2.gz QXSNBNYZVVKRGW-CJNGLKHVSA-N 0 0 379.424 3.190 20 5 GGBDRN C[C@@H](OC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(-c2nn[nH]n2)cc1 ZINC000820500331 606356000 /nfs/dbraw/zinc/35/60/00/606356000.db2.gz DGJUWUCARZKDBV-GFCCVEGCSA-N 0 0 392.375 3.034 20 5 GGBDRN C[C@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@H](O)c1c(F)cccc1Cl ZINC000820455805 606419500 /nfs/dbraw/zinc/41/95/00/606419500.db2.gz NEXGNVVABYPOGA-AYVTZFPOSA-N 0 0 392.778 3.101 20 5 GGBDRN CC[C@H](NC(=O)C=Cc1ccccc1-c1nn[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000820914866 606588754 /nfs/dbraw/zinc/58/87/54/606588754.db2.gz QTPKLVXQMSYVFL-DVQDXYAYSA-N 0 0 378.392 3.056 20 5 GGBDRN CC[C@H](NC(=S)Nc1ccccc1-c1nn[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000820919876 606618456 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379.424 3.190 20 5 GGBDRN O=C(Oc1ccc(-c2ccc(-c3nn[nH]n3)cc2)cc1)c1ccc([N+](=O)[O-])cn1 ZINC000823444426 606779277 /nfs/dbraw/zinc/77/92/77/606779277.db2.gz MPXMUMCWEBUKDP-UHFFFAOYSA-N 0 0 388.343 3.056 20 5 GGBDRN CC[C@H](C)Oc1cc(C)ccc1CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000820875692 606801003 /nfs/dbraw/zinc/80/10/03/606801003.db2.gz CMQCHHHYWMHWRF-LBPRGKRZSA-N 0 0 383.412 3.268 20 5 GGBDRN Cc1ccc(-c2nn[nH]n2)cc1NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000822220647 606834915 /nfs/dbraw/zinc/83/49/15/606834915.db2.gz ZWQAPEQDFFBQLB-UHFFFAOYSA-N 0 0 387.787 3.058 20 5 GGBDRN CCOC(=O)c1cc(N[C@@H](C)c2ccc(-c3nn[nH]n3)cc2)ccc1[N+](=O)[O-] ZINC000821337770 606920312 /nfs/dbraw/zinc/92/03/12/606920312.db2.gz NJGSOSNLXNLIFR-NSHDSACASA-N 0 0 382.380 3.125 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N[C@H]3CCCC(F)(F)C3)cc(-c3nn[nH]n3)c2c1 ZINC000823645955 607131811 /nfs/dbraw/zinc/13/18/11/607131811.db2.gz XQHCQQHCMSBONK-VIFPVBQESA-N 0 0 375.339 3.313 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1NCC(c1ccccc1)c1ccccc1 ZINC000823621043 607163210 /nfs/dbraw/zinc/16/32/10/607163210.db2.gz VVJHYRXGDCJOQL-UHFFFAOYSA-N 0 0 387.403 3.414 20 5 GGBDRN O=[N+]([O-])c1ccc(N(Cc2cccc(F)c2)C[C@H]2CCCO2)c(-c2nn[nH]n2)c1 ZINC000826498245 607849827 /nfs/dbraw/zinc/84/98/27/607849827.db2.gz MQFFHDGCIQLDPM-MRXNPFEDSA-N 0 0 398.398 3.100 20 5 GGBDRN Cc1cccc(OCc2ccc(-c3nn[nH]n3)cc2OC(F)F)c1[N+](=O)[O-] ZINC000826299926 607862891 /nfs/dbraw/zinc/86/28/91/607862891.db2.gz BEOHPSNHTSVEPR-UHFFFAOYSA-N 0 0 377.307 3.264 20 5 GGBDRN CCN(C(=O)c1cccc([N+](=O)[O-])c1C)c1ccc(-c2nn[nH]n2)c(Cl)c1 ZINC000825385387 607879039 /nfs/dbraw/zinc/87/90/39/607879039.db2.gz DRRCJLHBEYYAGE-UHFFFAOYSA-N 0 0 386.799 3.403 20 5 GGBDRN Cn1c2ccc(Nc3nccc(-c4nn[nH]n4)c3[N+](=O)[O-])cc2nc1C(C)(C)C ZINC000826355301 608018602 /nfs/dbraw/zinc/01/86/02/608018602.db2.gz SKRMIGPVOCNFNG-UHFFFAOYSA-N 0 0 393.411 3.098 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000825673816 608115513 /nfs/dbraw/zinc/11/55/13/608115513.db2.gz CXXQGRQFPFPOLU-LLVKDONJSA-N 0 0 398.448 3.378 20 5 GGBDRN Cc1ccc(-c2nn[nH]n2)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000826277759 608119153 /nfs/dbraw/zinc/11/91/53/608119153.db2.gz FZOGQURBTWJGEA-UHFFFAOYSA-N 0 0 393.407 3.280 20 5 GGBDRN Cc1c(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cccc1-c1nn[nH]n1 ZINC000826241405 608119692 /nfs/dbraw/zinc/11/96/92/608119692.db2.gz CFZNYPOKQMRNNI-UHFFFAOYSA-N 0 0 393.407 3.280 20 5 GGBDRN O=C(Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl)[C@@H]1C[C@@H]1Cc1ccccc1 ZINC000826450185 608160515 /nfs/dbraw/zinc/16/05/15/608160515.db2.gz ACYXPUPQOKITEI-WCQYABFASA-N 0 0 398.810 3.246 20 5 GGBDRN O=C(Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl)C(F)(F)c1ccccc1 ZINC000826450201 608161738 /nfs/dbraw/zinc/16/17/38/608161738.db2.gz ASLBLSZVEMWMQN-UHFFFAOYSA-N 0 0 394.725 3.159 20 5 GGBDRN O=C(CCCC(F)(F)F)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000826405503 608162038 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381.335 3.262 20 5 GGBDRN COC1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000053886281 1406543396 /nfs/dbraw/zinc/54/33/96/1406543396.db2.gz PCLYPMJGBAGBKS-UHFFFAOYSA-N 0 0 375.347 3.053 20 5 GGBDRN Cc1cccc2c1N(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)CCC2 ZINC000053896230 1406548787 /nfs/dbraw/zinc/54/87/87/1406548787.db2.gz UIFGPQJXPPIJPO-UHFFFAOYSA-N 0 0 381.432 3.333 20 5 GGBDRN Cc1cccc2c1N(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])CCC2 ZINC000053896239 1406549018 /nfs/dbraw/zinc/54/90/18/1406549018.db2.gz VBSKAEGCSHMLCT-UHFFFAOYSA-N 0 0 385.445 3.074 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCc3nnc(C)o3)cc2[N+](=O)[O-])n1 ZINC000053965696 1406573198 /nfs/dbraw/zinc/57/31/98/1406573198.db2.gz FYRHKYDKPNNNKN-UHFFFAOYSA-N 0 0 391.434 3.132 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCCc2cnn(C)c2)cc1 ZINC000053971472 1406574968 /nfs/dbraw/zinc/57/49/68/1406574968.db2.gz ZUPZXFLNAXIPGW-UHFFFAOYSA-N 0 0 396.403 3.102 20 5 GGBDRN COc1cc([C@@H](C)NC(=O)Cn2ccc([N+](=O)[O-])n2)ccc1OCCC(C)C 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CCCCNS(=O)(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000054151615 1406633443 /nfs/dbraw/zinc/63/34/43/1406633443.db2.gz KAXHDYZQZWJZFW-UHFFFAOYSA-N 0 0 395.412 3.065 20 5 GGBDRN C[C@H]1CN(Cc2csc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n2)C[C@H](C)O1 ZINC000054152219 1406633696 /nfs/dbraw/zinc/63/36/96/1406633696.db2.gz NGEFPEBAPDFUQI-QWRGUYRKSA-N 0 0 394.428 3.052 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000054168317 1406637440 /nfs/dbraw/zinc/63/74/40/1406637440.db2.gz AYRZFPFXMMHAIS-UHFFFAOYSA-N 0 0 398.419 3.466 20 5 GGBDRN CC[C@@]1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC(=O)NC1=O ZINC000054199380 1406651139 /nfs/dbraw/zinc/65/11/39/1406651139.db2.gz SCHNLQBGTCCSTQ-FQEVSTJZSA-N 0 0 399.378 3.071 20 5 GGBDRN O=c1c2cccnc2nc(SCc2ccc([N+](=O)[O-])cc2)n1C[C@@H]1CCCO1 ZINC000054206522 1406651965 /nfs/dbraw/zinc/65/19/65/1406651965.db2.gz FBHBMFYNTRBBSG-HNNXBMFYSA-N 0 0 398.444 3.171 20 5 GGBDRN O=C(NC1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1)c1ccccc1 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CC(C)(C)NC(=O)c1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000054405710 1406721149 /nfs/dbraw/zinc/72/11/49/1406721149.db2.gz PQSJOKYSCOGYHW-UHFFFAOYSA-N 0 0 384.436 3.487 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 ZINC000054406650 1406721928 /nfs/dbraw/zinc/72/19/28/1406721928.db2.gz SBCWPEIUPCYABY-SFHVURJKSA-N 0 0 398.419 3.077 20 5 GGBDRN CCN(Cc1ccccc1NC(=O)NCCc1ccc([N+](=O)[O-])cc1)C(C)=O ZINC000054409516 1406724522 /nfs/dbraw/zinc/72/45/22/1406724522.db2.gz LMYCIMLHHMZVLL-UHFFFAOYSA-N 0 0 384.436 3.327 20 5 GGBDRN COC(=O)c1cc2cc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC000054412659 1406728309 /nfs/dbraw/zinc/72/83/09/1406728309.db2.gz JUOCDQMPXGEHKZ-UHFFFAOYSA-N 0 0 383.360 3.492 20 5 GGBDRN O=C(Nc1cnn(C[C@H]2CCCO2)c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000054439634 1406736089 /nfs/dbraw/zinc/73/60/89/1406736089.db2.gz FJNCZWCHFOTAMF-GFCCVEGCSA-N 0 0 397.338 3.216 20 5 GGBDRN O=C(CSc1c(F)cc(F)cc1F)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000054477026 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O=C(NCCCOC1CCCCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000010083540 1398874937 /nfs/dbraw/zinc/87/49/37/1398874937.db2.gz NPZWCFGVIATJFA-UHFFFAOYSA-N 0 0 390.484 3.166 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2nnnn2C2CC2)c1 ZINC000010093413 1398875240 /nfs/dbraw/zinc/87/52/40/1398875240.db2.gz OBOYXAZISPEYGG-UHFFFAOYSA-N 0 0 396.432 3.314 20 5 GGBDRN COc1cc(C(=O)OCC(=O)Nc2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000010209069 1398880695 /nfs/dbraw/zinc/88/06/95/1398880695.db2.gz CJRCIZMRUCVZKA-UHFFFAOYSA-N 0 0 396.302 3.000 20 5 GGBDRN COc1cc(C(=O)OCC(=O)c2ccccc2F)c([N+](=O)[O-])cc1OC(F)F ZINC000010209158 1398880765 /nfs/dbraw/zinc/88/07/65/1398880765.db2.gz RZDFCJYIAWDRTJ-UHFFFAOYSA-N 0 0 399.277 3.384 20 5 GGBDRN CC1CCN(c2ccc(C(=O)OCC(=O)N3CCCCC3)cc2[N+](=O)[O-])CC1 ZINC000010210207 1398880830 /nfs/dbraw/zinc/88/08/30/1398880830.db2.gz XRKGDIRNUVMHGE-UHFFFAOYSA-N 0 0 389.452 3.000 20 5 GGBDRN COc1cccc([C@H]2CCCN2CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000010228901 1398881743 /nfs/dbraw/zinc/88/17/43/1398881743.db2.gz LAQBXWWHJNLEJG-LJQANCHMSA-N 0 0 381.432 3.330 20 5 GGBDRN Cc1cc(C(=O)N2CCC(C(=O)Nc3ccccc3O)CC2)ccc1[N+](=O)[O-] ZINC000010293414 1398885022 /nfs/dbraw/zinc/88/50/22/1398885022.db2.gz CPVMPQUGJNMMRF-UHFFFAOYSA-N 0 0 383.404 3.100 20 5 GGBDRN O=C(Nc1ccc(-c2cn3ccccc3n2)cc1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000010322290 1398886358 /nfs/dbraw/zinc/88/63/58/1398886358.db2.gz WXODNKMPDNBRSX-UHFFFAOYSA-N 0 0 375.344 3.262 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)COc2cc(C)ccc2[N+](=O)[O-])cc1C ZINC000010347163 1398887303 /nfs/dbraw/zinc/88/73/03/1398887303.db2.gz OLQCHJPFKARCFK-UHFFFAOYSA-N 0 0 378.406 3.467 20 5 GGBDRN CCc1ccc2c(CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)cc(=O)oc2c1 ZINC000010386970 1398889418 /nfs/dbraw/zinc/88/94/18/1398889418.db2.gz PYCIWBIFIPDWGL-UHFFFAOYSA-N 0 0 378.340 3.060 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccc(C(=O)N2CCCCC2)cc1 ZINC000010460573 1398894080 /nfs/dbraw/zinc/89/40/80/1398894080.db2.gz JCCHYBJIYQDNDP-UHFFFAOYSA-N 0 0 381.432 3.080 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1cc2ccccc2nc1C ZINC000010465429 1398895273 /nfs/dbraw/zinc/89/52/73/1398895273.db2.gz ORKBGWWLUWTZDF-UHFFFAOYSA-N 0 0 395.371 3.256 20 5 GGBDRN COC(=O)c1cccn2cc(COC(=O)c3ccc(Cl)cc3[N+](=O)[O-])nc12 ZINC000010486444 1398895655 /nfs/dbraw/zinc/89/56/55/1398895655.db2.gz LEBQTVBJVSQLAA-UHFFFAOYSA-N 0 0 389.751 3.040 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)CCc2ccc(C)cc2C)c([N+](=O)[O-])c1 ZINC000010493492 1398896340 /nfs/dbraw/zinc/89/63/40/1398896340.db2.gz NNJZCGVSPYSQFY-UHFFFAOYSA-N 0 0 386.404 3.335 20 5 GGBDRN CCNc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000010531050 1398897967 /nfs/dbraw/zinc/89/79/67/1398897967.db2.gz XPTZLEKBQCKFAM-SNVBAGLBSA-N 0 0 392.799 3.259 20 5 GGBDRN CCNc1ccc(C(=O)OCc2cc(=O)oc3cc(OC)ccc23)cc1[N+](=O)[O-] ZINC000010530927 1398898039 /nfs/dbraw/zinc/89/80/39/1398898039.db2.gz KMPQGMUMCXTVIG-UHFFFAOYSA-N 0 0 398.371 3.499 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)N2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000010531170 1398898096 /nfs/dbraw/zinc/89/80/96/1398898096.db2.gz RANTZKRJEDLJAG-UHFFFAOYSA-N 0 0 383.404 3.163 20 5 GGBDRN CCNc1ccc(C(=O)O[C@@H](C)C(=O)N2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000010531017 1398898150 /nfs/dbraw/zinc/89/81/50/1398898150.db2.gz WFGXPEPVQANAJA-ZDUSSCGKSA-N 0 0 383.404 3.161 20 5 GGBDRN COc1cc(COC(=O)c2cc(C(C)=O)c[nH]2)c([N+](=O)[O-])cc1OC(F)F ZINC000010604160 1398902764 /nfs/dbraw/zinc/90/27/64/1398902764.db2.gz XSKMCYGNPSWFHU-UHFFFAOYSA-N 0 0 384.291 3.093 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1ccccc1OC(F)F ZINC000010616867 1398903455 /nfs/dbraw/zinc/90/34/55/1398903455.db2.gz YHGJNEQWZZXOHL-UHFFFAOYSA-N 0 0 380.351 3.108 20 5 GGBDRN C[C@H](OC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010615513 1398903556 /nfs/dbraw/zinc/90/35/56/1398903556.db2.gz XQSWOCBRWFTWOQ-QFYYESIMSA-N 0 0 390.779 3.122 20 5 GGBDRN C[C@@H](OC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000010617371 1398904199 /nfs/dbraw/zinc/90/41/99/1398904199.db2.gz UXMYRYXDHBBCQB-QLJPJBMISA-N 0 0 390.779 3.122 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000010621969 1398904204 /nfs/dbraw/zinc/90/42/04/1398904204.db2.gz WGPCLGPFGCNQSI-AWEZNQCLSA-N 0 0 381.388 3.428 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000010621960 1398904282 /nfs/dbraw/zinc/90/42/82/1398904282.db2.gz VSPPDADMNBOPOJ-CQSZACIVSA-N 0 0 381.388 3.428 20 5 GGBDRN CC(=O)Nc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000010622624 1398904700 /nfs/dbraw/zinc/90/47/00/1398904700.db2.gz UQRGAZJGYCICEC-UHFFFAOYSA-N 0 0 391.767 3.002 20 5 GGBDRN COC(=O)c1ccccc1N(C)C(=O)COc1ccc(Cl)cc1[N+](=O)[O-] ZINC000010634183 1398905410 /nfs/dbraw/zinc/90/54/10/1398905410.db2.gz JJLHGWDTESVBPU-UHFFFAOYSA-N 0 0 378.768 3.077 20 5 GGBDRN Cc1nn(C)c2nc(C)c(CCC(=O)OCc3ccc([N+](=O)[O-])cc3)c(C)c12 ZINC000010636941 1398905502 /nfs/dbraw/zinc/90/55/02/1398905502.db2.gz ILJPMGRRKJTNDS-UHFFFAOYSA-N 0 0 382.420 3.478 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010646876 1398906558 /nfs/dbraw/zinc/90/65/58/1398906558.db2.gz NAVCUEBUEDOURJ-SECBINFHSA-N 0 0 393.739 3.340 20 5 GGBDRN O=C(OCc1nnc(-c2ccc(Br)o2)o1)c1ccc([N+](=O)[O-])cc1 ZINC000010646890 1398906804 /nfs/dbraw/zinc/90/68/04/1398906804.db2.gz QUELRHVFMOBKAI-UHFFFAOYSA-N 0 0 394.137 3.357 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000010682678 1398911036 /nfs/dbraw/zinc/91/10/36/1398911036.db2.gz AKGZAASUZCHRKT-GOSISDBHSA-N 0 0 376.434 3.341 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCc2ccc(N3CCOCC3)nc2)cc1[N+](=O)[O-] ZINC000010719563 1398914421 /nfs/dbraw/zinc/91/44/21/1398914421.db2.gz PBJPSFMIYXZXMI-UHFFFAOYSA-N 0 0 398.463 3.054 20 5 GGBDRN CCOc1ccc(NC(=O)COC(=O)c2ccc(Cl)cc2N)c([N+](=O)[O-])c1 ZINC000010731696 1398915951 /nfs/dbraw/zinc/91/59/51/1398915951.db2.gz GBYTUDVYRBCPEZ-UHFFFAOYSA-N 0 0 393.783 3.025 20 5 GGBDRN CC(=O)c1ccc(NC(=O)[C@H](C)OC(=O)C=Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000010757290 1398917357 /nfs/dbraw/zinc/91/73/57/1398917357.db2.gz ARCLWINKAJQDPS-CLUXPMKYSA-N 0 0 382.372 3.381 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000010748443 1398917425 /nfs/dbraw/zinc/91/74/25/1398917425.db2.gz NUFBTCNKVLEGQI-UHFFFAOYSA-N 0 0 393.739 3.260 20 5 GGBDRN O=C(COC(=O)CCC1CCCC1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000010789046 1398920683 /nfs/dbraw/zinc/92/06/83/1398920683.db2.gz PENNCVVXPWAKBC-UHFFFAOYSA-N 0 0 392.408 3.208 20 5 GGBDRN C[C@@H](OC(=O)C1CCC1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000010808549 1398922359 /nfs/dbraw/zinc/92/23/59/1398922359.db2.gz FVXLEEGTTZYXSE-SNVBAGLBSA-N 0 0 375.406 3.389 20 5 GGBDRN C[C@H](OC(=O)Cc1cccc2cccnc21)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000010829624 1398923117 /nfs/dbraw/zinc/92/31/17/1398923117.db2.gz KSCFQHNBHBMFMG-ZDUSSCGKSA-N 0 0 379.372 3.256 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1cc(Cl)c(OC)cc1OC ZINC000010826706 1398923264 /nfs/dbraw/zinc/92/32/64/1398923264.db2.gz JLJBRBHECSTWPC-UHFFFAOYSA-N 0 0 395.799 3.325 20 5 GGBDRN C[C@H](OC(=O)c1ccc(C=O)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010870591 1398926767 /nfs/dbraw/zinc/92/67/67/1398926767.db2.gz UEFXXTWRVKSNPH-JTQLQIEISA-N 0 0 376.752 3.245 20 5 GGBDRN CN(C(=O)COC(=O)Cc1cccc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000010884230 1398927691 /nfs/dbraw/zinc/92/76/91/1398927691.db2.gz WSJGMUAWZDOVRO-UHFFFAOYSA-N 0 0 396.321 3.362 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000010893370 1398929013 /nfs/dbraw/zinc/92/90/13/1398929013.db2.gz DROJBVWLWSDIIO-MRXNPFEDSA-N 0 0 396.447 3.274 20 5 GGBDRN COc1ccc(/C=C/C(=O)O[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC000010899900 1398930084 /nfs/dbraw/zinc/93/00/84/1398930084.db2.gz PBVKQEKLINSDEC-DJTWPOEFSA-N 0 0 388.351 3.326 20 5 GGBDRN O=C(COC(=O)[C@H]1Cc2ccccc2S1)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000010904773 1398930928 /nfs/dbraw/zinc/93/09/28/1398930928.db2.gz PZLLMGQJXMRGKR-OAHLLOKOSA-N 0 0 392.820 3.447 20 5 GGBDRN CCOC(=O)c1[nH]c(C)c(C(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])c1C ZINC000010912868 1398931592 /nfs/dbraw/zinc/93/15/92/1398931592.db2.gz QWKLMFFLHOEXCD-UHFFFAOYSA-N 0 0 388.376 3.065 20 5 GGBDRN CN(C(=O)COC(=O)Cc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000010914698 1398932538 /nfs/dbraw/zinc/93/25/38/1398932538.db2.gz YXFGKIOEDXMBKK-UHFFFAOYSA-N 0 0 378.384 3.497 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(NC(=O)C2CC2)cc1 ZINC000010942063 1398933848 /nfs/dbraw/zinc/93/38/48/1398933848.db2.gz AAJAKHPQLPBLAV-UHFFFAOYSA-N 0 0 384.392 3.003 20 5 GGBDRN CCOc1cc(NC(=O)COc2ccccc2OC)c([N+](=O)[O-])cc1OCC ZINC000010962261 1398936492 /nfs/dbraw/zinc/93/64/92/1398936492.db2.gz IEORUFSQZAVENE-UHFFFAOYSA-N 0 0 390.392 3.418 20 5 GGBDRN CCOc1cc(NC(=O)c2cccnc2OCC)c([N+](=O)[O-])cc1OCC ZINC000010962138 1398936642 /nfs/dbraw/zinc/93/66/42/1398936642.db2.gz CNGMYSWSWMRCSB-UHFFFAOYSA-N 0 0 375.381 3.438 20 5 GGBDRN Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1O ZINC000010980361 1398939220 /nfs/dbraw/zinc/93/92/20/1398939220.db2.gz BBZMLTAMUJMUJP-JTQLQIEISA-N 0 0 378.768 3.446 20 5 GGBDRN COc1ccc(CNC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000010991520 1398941107 /nfs/dbraw/zinc/94/11/07/1398941107.db2.gz JXMQFYXWGSVQES-UHFFFAOYSA-N 0 0 398.341 3.136 20 5 GGBDRN COC(=O)c1cc(C(=O)NCCOc2ccc3ccccc3c2)cc([N+](=O)[O-])c1 ZINC000010995262 1398941146 /nfs/dbraw/zinc/94/11/46/1398941146.db2.gz QRLZIOUYPMMXKQ-UHFFFAOYSA-N 0 0 394.383 3.343 20 5 GGBDRN O=C(NCCOc1ccc2ccccc2c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000010996088 1398941172 /nfs/dbraw/zinc/94/11/72/1398941172.db2.gz XCIZMBGPUKWODO-UHFFFAOYSA-N 0 0 394.383 3.328 20 5 GGBDRN COC(=O)c1sccc1NC(=O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000011013268 1398944315 /nfs/dbraw/zinc/94/43/15/1398944315.db2.gz GTNAMVQXIHBHBI-UHFFFAOYSA-N 0 0 397.840 3.167 20 5 GGBDRN O=C(COC(=O)Cc1c(F)cccc1Cl)Nc1cc([N+](=O)[O-])ccc1F ZINC000011028586 1398944907 /nfs/dbraw/zinc/94/49/07/1398944907.db2.gz NXOJBKPFICBKOX-UHFFFAOYSA-N 0 0 384.722 3.251 20 5 GGBDRN C[C@@H](OC(=O)c1ccccn1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000011026840 1398945028 /nfs/dbraw/zinc/94/50/28/1398945028.db2.gz WLOMCAMEOZIJHB-LLVKDONJSA-N 0 0 398.400 3.297 20 5 GGBDRN C[C@@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000011026069 1398945182 /nfs/dbraw/zinc/94/51/82/1398945182.db2.gz RFXJOLOJSMZLBR-SNVBAGLBSA-N 0 0 380.303 3.380 20 5 GGBDRN COc1ccc(CN(C)C(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000011028963 1398945629 /nfs/dbraw/zinc/94/56/29/1398945629.db2.gz BHOCUYNGRQSBQN-UHFFFAOYSA-N 0 0 392.795 3.072 20 5 GGBDRN CCOC(=O)c1ccc(NCC(=O)Nc2ccc(OCC)cc2[N+](=O)[O-])cc1 ZINC000011035283 1398945889 /nfs/dbraw/zinc/94/58/89/1398945889.db2.gz BSIXANHKCRUCAO-UHFFFAOYSA-N 0 0 387.392 3.221 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2c(C)nn(-c3ccccc3)c2C)cc([N+](=O)[O-])c1 ZINC000011059024 1398947278 /nfs/dbraw/zinc/94/72/78/1398947278.db2.gz 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377.296 3.390 20 5 GGBDRN COc1ccc2[nH]c(SCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000021829296 1399412088 /nfs/dbraw/zinc/41/20/88/1399412088.db2.gz KQDTYTISJFVILV-UHFFFAOYSA-N 0 0 384.417 3.161 20 5 GGBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc(OC)cc1 ZINC000021837057 1399413430 /nfs/dbraw/zinc/41/34/30/1399413430.db2.gz NXDQZXGCYXUMPQ-LJQANCHMSA-N 0 0 399.447 3.321 20 5 GGBDRN CCC[C@H](NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000021838722 1399413550 /nfs/dbraw/zinc/41/35/50/1399413550.db2.gz RECSYTDOGFPNPR-HNNXBMFYSA-N 0 0 387.461 3.443 20 5 GGBDRN Cc1cc(=O)c(C(=O)Nc2ccccc2Cl)nn1-c1ccccc1[N+](=O)[O-] ZINC000021858086 1399415701 /nfs/dbraw/zinc/41/57/01/1399415701.db2.gz ZRCPEGFNNJXMAG-UHFFFAOYSA-N 0 0 384.779 3.355 20 5 GGBDRN CCCC[C@@H](CC)CNC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000021887235 1399419518 /nfs/dbraw/zinc/41/95/18/1399419518.db2.gz CPHGUMJWKMLOFD-OAHLLOKOSA-N 0 0 386.452 3.395 20 5 GGBDRN 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ZINC000021978036 1399429160 /nfs/dbraw/zinc/42/91/60/1399429160.db2.gz WNLMLVGAMGPZJE-GFCCVEGCSA-N 0 0 380.360 3.030 20 5 GGBDRN CCOc1cc(C(=O)O[C@@H](C)C(=O)N(C(C)C)C(C)C)c([N+](=O)[O-])cc1OC ZINC000022006407 1399430688 /nfs/dbraw/zinc/43/06/88/1399430688.db2.gz IOXXMPOQIUMWEG-ZDUSSCGKSA-N 0 0 396.440 3.193 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)CSc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000022015031 1399431372 /nfs/dbraw/zinc/43/13/72/1399431372.db2.gz BUHCQGCOEMCNLV-UHFFFAOYSA-N 0 0 394.380 3.017 20 5 GGBDRN C[C@@H](OC(=O)CSc1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000022015212 1399431692 /nfs/dbraw/zinc/43/16/92/1399431692.db2.gz JIUZIFMIUCVRMQ-LLVKDONJSA-N 0 0 378.381 3.396 20 5 GGBDRN CNc1ccc(C(=O)OCC(=O)N2c3ccccc3CC[C@H]2C)cc1[N+](=O)[O-] ZINC000022066209 1399434914 /nfs/dbraw/zinc/43/49/14/1399434914.db2.gz CNHGRJJIMJZYID-CYBMUJFWSA-N 0 0 383.404 3.161 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccc3c(c2)OCO3)cs1 ZINC000022066890 1399435013 /nfs/dbraw/zinc/43/50/13/1399435013.db2.gz REDFWVXDHBSHRY-UHFFFAOYSA-N 0 0 399.384 3.465 20 5 GGBDRN CSc1ccc(NC(=O)[C@@H](C)OC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000022095540 1399436102 /nfs/dbraw/zinc/43/61/02/1399436102.db2.gz QOPYTCZRCZQXIT-GFCCVEGCSA-N 0 0 390.417 3.266 20 5 GGBDRN Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)OC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000022095389 1399436190 /nfs/dbraw/zinc/43/61/90/1399436190.db2.gz RCMXKOYXGDVWNT-HUUCEWRRSA-N 0 0 386.404 3.091 20 5 GGBDRN C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2ncccc21 ZINC000022096048 1399436238 /nfs/dbraw/zinc/43/62/38/1399436238.db2.gz XQLMUGVCKPHSSG-CYBMUJFWSA-N 0 0 395.371 3.092 20 5 GGBDRN COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1C ZINC000022112428 1399437782 /nfs/dbraw/zinc/43/77/82/1399437782.db2.gz NVTRIOVJGVQXOY-UHFFFAOYSA-N 0 0 394.767 3.019 20 5 GGBDRN CSc1ccc(C(=O)O[C@H](C)C(=O)NCc2ccccc2C)cc1[N+](=O)[O-] ZINC000022161665 1399441411 /nfs/dbraw/zinc/44/14/11/1399441411.db2.gz LDTRTAXELHFBCW-CYBMUJFWSA-N 0 0 388.445 3.487 20 5 GGBDRN CSc1ccc(C(=O)O[C@H](C)C(=O)NCc2ccccc2F)cc1[N+](=O)[O-] ZINC000022162108 1399441815 /nfs/dbraw/zinc/44/18/15/1399441815.db2.gz LSXKLEIWXSDHHY-LLVKDONJSA-N 0 0 392.408 3.318 20 5 GGBDRN CCCCCNC(=O)[C@@H](C)OC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000022184128 1399442369 /nfs/dbraw/zinc/44/23/69/1399442369.db2.gz JYMLQXDYSCQDJK-SNVBAGLBSA-N 0 0 387.230 3.209 20 5 GGBDRN COC(=O)c1ccc(OCC(=O)Nc2cc(Cl)ccc2C)c([N+](=O)[O-])c1 ZINC000022222699 1399446098 /nfs/dbraw/zinc/44/60/98/1399446098.db2.gz LKJWORCPPOXOKL-UHFFFAOYSA-N 0 0 378.768 3.361 20 5 GGBDRN O=[N+]([O-])c1ccc2[nH]c(CNS(=O)(=O)c3ccc4ccccc4c3)nc2c1 ZINC000022262653 1399448850 /nfs/dbraw/zinc/44/88/50/1399448850.db2.gz SVMTXCPAZJSKAU-UHFFFAOYSA-N 0 0 382.401 3.103 20 5 GGBDRN CNc1ccc(C(=O)O[C@@H](C)C(=O)N(C)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000022273137 1399449628 /nfs/dbraw/zinc/44/96/28/1399449628.db2.gz JNNJQODLXQGQRX-AWEZNQCLSA-N 0 0 385.420 3.149 20 5 GGBDRN CNc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000022273030 1399449644 /nfs/dbraw/zinc/44/96/44/1399449644.db2.gz SQYZPOQPPINWSI-KBPBESRZSA-N 0 0 385.420 3.368 20 5 GGBDRN CNc1ccc(C(=O)OCC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000022272658 1399449649 /nfs/dbraw/zinc/44/96/49/1399449649.db2.gz FPXSGEYGIKCZFO-FQEVSTJZSA-N 0 0 397.431 3.369 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(CN2CCCCC2)cs1 ZINC000022290051 1399450804 /nfs/dbraw/zinc/45/08/04/1399450804.db2.gz SVQPJAIUBFNNRP-UHFFFAOYSA-N 0 0 376.438 3.298 20 5 GGBDRN CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000022357809 1399456482 /nfs/dbraw/zinc/45/64/82/1399456482.db2.gz GZDIKESNJRTVSU-NRFANRHFSA-N 0 0 395.390 3.144 20 5 GGBDRN CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000022357811 1399456543 /nfs/dbraw/zinc/45/65/43/1399456543.db2.gz GZDIKESNJRTVSU-OAQYLSRUSA-N 0 0 395.390 3.144 20 5 GGBDRN C[C@@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)C12CC3CC(CC(C3)C1)C2 ZINC000022398162 1399461118 /nfs/dbraw/zinc/46/11/18/1399461118.db2.gz GSPOSLXGBSSZPA-CSNVJCEJSA-N 0 0 399.447 3.224 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccnc1Cl ZINC000022414669 1399462342 /nfs/dbraw/zinc/46/23/42/1399462342.db2.gz LQFBVOIASFGHEH-MRVPVSSYSA-N 0 0 384.175 3.481 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000022414667 1399462364 /nfs/dbraw/zinc/46/23/64/1399462364.db2.gz QJKWLFZXQNABQL-JTQLQIEISA-N 0 0 378.768 3.441 20 5 GGBDRN COc1ccc([C@H](NC(=O)COC(=O)c2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000022443409 1399464154 /nfs/dbraw/zinc/46/41/54/1399464154.db2.gz UEYXRSZSCXNOBS-LJQANCHMSA-N 0 0 384.388 3.028 20 5 GGBDRN C[C@@H](OC(=O)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000022445000 1399464454 /nfs/dbraw/zinc/46/44/54/1399464454.db2.gz LMBPAWQEASTYRG-SECBINFHSA-N 0 0 394.286 3.100 20 5 GGBDRN Cc1cc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])o2)ccc1Br ZINC000022445938 1399464963 /nfs/dbraw/zinc/46/49/63/1399464963.db2.gz RRDIZDRUPRCBCX-VIFPVBQESA-N 0 0 397.181 3.443 20 5 GGBDRN O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000022465421 1399466177 /nfs/dbraw/zinc/46/61/77/1399466177.db2.gz OYWRFNYTPUCSIT-HNNXBMFYSA-N 0 0 395.868 3.113 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCc1ccccc1F ZINC000022469142 1399466286 /nfs/dbraw/zinc/46/62/86/1399466286.db2.gz JFOPCTCGXRWLGJ-SNVBAGLBSA-N 0 0 380.759 3.249 20 5 GGBDRN Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)COc1ccccc1[N+](=O)[O-] ZINC000022478106 1399467479 /nfs/dbraw/zinc/46/74/79/1399467479.db2.gz NJYUQIBQQWOJOF-CABCVRRESA-N 0 0 386.404 3.091 20 5 GGBDRN CSc1cccc(NC(=O)[C@@H](C)OC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000022477957 1399467519 /nfs/dbraw/zinc/46/75/19/1399467519.db2.gz HWUJIOJWISOSLK-GFCCVEGCSA-N 0 0 390.417 3.266 20 5 GGBDRN Cc1ccc([C@H](NC(=O)COC(=O)COc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000022477986 1399467591 /nfs/dbraw/zinc/46/75/91/1399467591.db2.gz QZSTUEIXGKIRPU-NRFANRHFSA-N 0 0 398.415 3.093 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000022488200 1399468669 /nfs/dbraw/zinc/46/86/69/1399468669.db2.gz XNARMXSQKOLXTH-SNVBAGLBSA-N 0 0 377.784 3.323 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N[C@H](C)c1ccc(Cl)cc1 ZINC000022488423 1399468847 /nfs/dbraw/zinc/46/88/47/1399468847.db2.gz IRQIXGAKBJNYHC-GHMZBOCLSA-N 0 0 391.811 3.253 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)N[C@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000022486375 1399468857 /nfs/dbraw/zinc/46/88/57/1399468857.db2.gz ZDABQPAEMSVJDA-HXUWFJFHSA-N 0 0 397.431 3.451 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)CCC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000022486817 1399468936 /nfs/dbraw/zinc/46/89/36/1399468936.db2.gz YTLXRKRUILNQSA-GFCCVEGCSA-N 0 0 390.417 3.498 20 5 GGBDRN CCNc1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccccc2C)cc1[N+](=O)[O-] ZINC000022486615 1399468975 /nfs/dbraw/zinc/46/89/75/1399468975.db2.gz KJFZXRHJZCIUJH-OAHLLOKOSA-N 0 0 399.447 3.239 20 5 GGBDRN C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]1c1cccs1 ZINC000022489088 1399469374 /nfs/dbraw/zinc/46/93/74/1399469374.db2.gz BTHOOIGBUSXCIP-SMDDNHRTSA-N 0 0 389.433 3.148 20 5 GGBDRN O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Cl)NCC1(c2ccccc2)CC1 ZINC000022495340 1399470107 /nfs/dbraw/zinc/47/01/07/1399470107.db2.gz PSFWSTNZXMECDG-UHFFFAOYSA-N 0 0 388.807 3.253 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000022495768 1399470245 /nfs/dbraw/zinc/47/02/45/1399470245.db2.gz IVVLENCFJTYZRI-LBPRGKRZSA-N 0 0 376.796 3.418 20 5 GGBDRN C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)N1CCc2sccc2C1 ZINC000022495099 1399470292 /nfs/dbraw/zinc/47/02/92/1399470292.db2.gz IXXPIJLBVJFWJO-JTQLQIEISA-N 0 0 394.836 3.440 20 5 GGBDRN O=C(COC(=O)c1c(F)cccc1Cl)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022499219 1399470689 /nfs/dbraw/zinc/47/06/89/1399470689.db2.gz YFZVQNVUUBCYEZ-UHFFFAOYSA-N 0 0 378.743 3.133 20 5 GGBDRN O=C(COC(=O)c1ccc(C(F)(F)F)cc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022544600 1399473712 /nfs/dbraw/zinc/47/37/12/1399473712.db2.gz RKYVVRHMTMDIET-UHFFFAOYSA-N 0 0 394.305 3.360 20 5 GGBDRN O=C(COC(=O)c1cccc(C(F)(F)F)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022545741 1399474620 /nfs/dbraw/zinc/47/46/20/1399474620.db2.gz IWTNTNIMJLRDNL-UHFFFAOYSA-N 0 0 394.305 3.360 20 5 GGBDRN COc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000022550877 1399475165 /nfs/dbraw/zinc/47/51/65/1399475165.db2.gz AMWOODKMAVHDOK-CMOQBRTCSA-N 0 0 398.415 3.426 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCC(=O)N[C@H](c1ccccc1)C1CC1 ZINC000022550594 1399475347 /nfs/dbraw/zinc/47/53/47/1399475347.db2.gz OITIVXYKJWEJJH-CDDKBXLESA-N 0 0 380.400 3.419 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000022550777 1399475409 /nfs/dbraw/zinc/47/54/09/1399475409.db2.gz WLRNKERQOHKETP-YKWSONSWSA-N 0 0 397.387 3.137 20 5 GGBDRN Cc1cccc(OCCNC(=O)[C@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000022550902 1399475446 /nfs/dbraw/zinc/47/54/46/1399475446.db2.gz YCAHLPVPNHEIPJ-KXKDPZRNSA-N 0 0 398.415 3.043 20 5 GGBDRN C[C@H](OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCOc2ccccc21 ZINC000022550896 1399475451 /nfs/dbraw/zinc/47/54/51/1399475451.db2.gz ZNBXVQZSLXPYKJ-APGAYVOGSA-N 0 0 396.399 3.180 20 5 GGBDRN CCC(C)(C)NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559468 1399477416 /nfs/dbraw/zinc/47/74/16/1399477416.db2.gz GALIZVQUBWPYIK-CYBMUJFWSA-N 0 0 377.441 3.045 20 5 GGBDRN CCOc1cc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)ccc1OC ZINC000055631809 1407031873 /nfs/dbraw/zinc/03/18/73/1407031873.db2.gz CFTZHEUULLSOPL-UHFFFAOYSA-N 0 0 380.422 3.420 20 5 GGBDRN CC(=O)Nc1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000022570517 1399478606 /nfs/dbraw/zinc/47/86/06/1399478606.db2.gz OREPLQBOFPXWCZ-GFCCVEGCSA-N 0 0 385.376 3.046 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(F)cc1F)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000022593769 1399480672 /nfs/dbraw/zinc/48/06/72/1399480672.db2.gz 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CCOC(=O)c1cc(C(=O)NCCOc2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000022655820 1399487760 /nfs/dbraw/zinc/48/77/60/1399487760.db2.gz IXFPALPZPWJDKM-UHFFFAOYSA-N 0 0 392.795 3.234 20 5 GGBDRN COc1cccc(CNC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000022668549 1399488428 /nfs/dbraw/zinc/48/84/28/1399488428.db2.gz CDXCEZQGBRCKSN-LLVKDONJSA-N 0 0 392.795 3.119 20 5 GGBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCc2sccc2C1 ZINC000022667947 1399488479 /nfs/dbraw/zinc/48/84/79/1399488479.db2.gz XXMAFMVTVGXHII-JTQLQIEISA-N 0 0 394.836 3.440 20 5 GGBDRN COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000022679307 1399489656 /nfs/dbraw/zinc/48/96/56/1399489656.db2.gz YCHXUWRWVWVNBL-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN COc1cccc(OC)c1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000022680821 1399490233 /nfs/dbraw/zinc/49/02/33/1399490233.db2.gz RZPIHJDZWJASRE-GFCCVEGCSA-N 0 0 388.376 3.104 20 5 GGBDRN CC[NH+](CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)c1cccc(OC)c1 ZINC000022700948 1399493033 /nfs/dbraw/zinc/49/30/33/1399493033.db2.gz KHRNLGNTXVCFRN-SFHVURJKSA-N 0 0 387.436 3.122 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)COC(=O)c1ccccc1[N+](=O)[O-] ZINC000022702604 1399493591 /nfs/dbraw/zinc/49/35/91/1399493591.db2.gz WZZDLXHSPDJQTH-UHFFFAOYSA-N 0 0 394.330 3.012 20 5 GGBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(C)n1CCc1ccc(F)cc1 ZINC000022714815 1399494854 /nfs/dbraw/zinc/49/48/54/1399494854.db2.gz DHKUIVDVDYKJMH-UHFFFAOYSA-N 0 0 397.406 3.440 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)c2ccc(Cl)c(N)c2)cccc1[N+](=O)[O-] ZINC000022752627 1399498049 /nfs/dbraw/zinc/49/80/49/1399498049.db2.gz CFZZGOXPYGFSFL-JTQLQIEISA-N 0 0 377.784 3.323 20 5 GGBDRN C[C@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)N1CCc2sccc2C1 ZINC000022791938 1399504302 /nfs/dbraw/zinc/50/43/02/1399504302.db2.gz JVOHIJFOTUPSAP-JTQLQIEISA-N 0 0 394.836 3.440 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cn2)cc1 ZINC000022806955 1399506411 /nfs/dbraw/zinc/50/64/11/1399506411.db2.gz HGVFRSNBTUIDPF-CYBMUJFWSA-N 0 0 378.454 3.193 20 5 GGBDRN COc1ccc([C@H](NC(=O)COC(=O)c2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000022910748 1399516115 /nfs/dbraw/zinc/51/61/15/1399516115.db2.gz DEGDSYOOAZHAEI-HXUWFJFHSA-N 0 0 398.415 3.336 20 5 GGBDRN COc1ccc(C(=O)OCC(=O)N[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000022907234 1399516151 /nfs/dbraw/zinc/51/61/51/1399516151.db2.gz OJJFMIRTNKXHCE-IBGZPJMESA-N 0 0 384.388 3.028 20 5 GGBDRN COc1ccc(C(=O)O[C@H](C)C(=O)N[C@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000022907652 1399516159 /nfs/dbraw/zinc/51/61/59/1399516159.db2.gz YITBDVSLIYUDGP-ZIAGYGMSSA-N 0 0 386.404 3.335 20 5 GGBDRN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)c1cccc([N+](=O)[O-])c1C ZINC000022911225 1399516171 /nfs/dbraw/zinc/51/61/71/1399516171.db2.gz KJSDCIMBUPMNRN-KGLIPLIRSA-N 0 0 386.404 3.335 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2C)cccc1[N+](=O)[O-] ZINC000022910633 1399516177 /nfs/dbraw/zinc/51/61/77/1399516177.db2.gz VPFPAYYPYUYWSN-GFCCVEGCSA-N 0 0 387.348 3.304 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)OC(=O)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000022911180 1399516179 /nfs/dbraw/zinc/51/61/79/1399516179.db2.gz QSKSWHZOXFEEJI-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN Cc1c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cccc1[N+](=O)[O-] ZINC000022911558 1399516926 /nfs/dbraw/zinc/51/69/26/1399516926.db2.gz OMFMJDYSZBCNIM-CQSZACIVSA-N 0 0 395.415 3.289 20 5 GGBDRN O=C(COC(=O)c1ccc(F)cc1Cl)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022936376 1399518390 /nfs/dbraw/zinc/51/83/90/1399518390.db2.gz HWMFCKUHTQPQGQ-UHFFFAOYSA-N 0 0 378.743 3.133 20 5 GGBDRN COc1ccc(SCC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000022974692 1399520531 /nfs/dbraw/zinc/52/05/31/1399520531.db2.gz LSUFFGKYSJHTRP-UHFFFAOYSA-N 0 0 387.461 3.044 20 5 GGBDRN Cc1nn(Cc2nnc(-c3c(C)onc3-c3ccccc3)o2)c(C)c1[N+](=O)[O-] ZINC000022986448 1399521770 /nfs/dbraw/zinc/52/17/70/1399521770.db2.gz RCXZWLQTUIAFMV-UHFFFAOYSA-N 0 0 380.364 3.470 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1cccc(S(=O)(=O)N2CCCC2)c1 ZINC000023003943 1399524863 /nfs/dbraw/zinc/52/48/63/1399524863.db2.gz SCXJJWDOISLQJN-UHFFFAOYSA-N 0 0 391.449 3.000 20 5 GGBDRN CCCC(=O)Nc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000055638666 1407035008 /nfs/dbraw/zinc/03/50/08/1407035008.db2.gz XCQIDTSTDXIBTI-UHFFFAOYSA-N 0 0 377.422 3.443 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccnc1-n1cccn1 ZINC000023170746 1399536184 /nfs/dbraw/zinc/53/61/84/1399536184.db2.gz YKDUKYAYJBKWAW-UHFFFAOYSA-N 0 0 395.422 3.374 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000023204917 1399538755 /nfs/dbraw/zinc/53/87/55/1399538755.db2.gz SNVCZUQCFNMHOV-CABCVRRESA-N 0 0 391.468 3.291 20 5 GGBDRN CCCCNC(=O)[C@@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000023204921 1399538903 /nfs/dbraw/zinc/53/89/03/1399538903.db2.gz RFUSJJMKGRFKHG-OAHLLOKOSA-N 0 0 391.468 3.293 20 5 GGBDRN O=C(NC[C@@H]1COc2ccccc2C1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000023240487 1399543368 /nfs/dbraw/zinc/54/33/68/1399543368.db2.gz MLYYMVXGOYSWSP-MRXNPFEDSA-N 0 0 395.459 3.179 20 5 GGBDRN CCc1ccc(OCC(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000023279871 1399547292 /nfs/dbraw/zinc/54/72/92/1399547292.db2.gz ZRGQSPHKFRYYJC-CQSZACIVSA-N 0 0 386.404 3.415 20 5 GGBDRN Cc1ccc(C)c(OCCC(=O)OCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000023296931 1399548409 /nfs/dbraw/zinc/54/84/09/1399548409.db2.gz VGADNSZCIDXFNI-UHFFFAOYSA-N 0 0 398.415 3.113 20 5 GGBDRN COc1ccc([C@H](NC(=O)COC(=O)c2ccc([N+](=O)[O-])s2)C2CC2)cc1 ZINC000023344061 1399550653 /nfs/dbraw/zinc/55/06/53/1399550653.db2.gz VCXDBHTWXBEBHR-QGZVFWFLSA-N 0 0 390.417 3.089 20 5 GGBDRN O=C(CSc1nnc(-c2ccccc2)o1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000023346130 1399551319 /nfs/dbraw/zinc/55/13/19/1399551319.db2.gz CDRXBMLROWFARP-UHFFFAOYSA-N 0 0 382.401 3.326 20 5 GGBDRN CC(=O)c1ccc(NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c([N+](=O)[O-])c1 ZINC000023381263 1399554531 /nfs/dbraw/zinc/55/45/31/1399554531.db2.gz HKOHGUDNCGIPLN-FQEVSTJZSA-N 0 0 387.411 3.422 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000023393636 1399556454 /nfs/dbraw/zinc/55/64/54/1399556454.db2.gz SUBGTQCZDSVVIY-UHFFFAOYSA-N 0 0 390.339 3.101 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H]2CCSc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000023404277 1399557394 /nfs/dbraw/zinc/55/73/94/1399557394.db2.gz PJYQGIROHOQMIM-ZDUSSCGKSA-N 0 0 398.437 3.258 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H](c2ccc(F)cc2)C(C)C)c([N+](=O)[O-])c1 ZINC000023403295 1399557450 /nfs/dbraw/zinc/55/74/50/1399557450.db2.gz YWKWTLXSDGBKMB-KRWDZBQOSA-N 0 0 382.413 3.418 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)OCC(=O)c3cccn3C)cc2[N+](=O)[O-])C1 ZINC000023419824 1399558575 /nfs/dbraw/zinc/55/85/75/1399558575.db2.gz PHYGRKCRZZCDPH-GJZGRUSLSA-N 0 0 399.447 3.455 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)Oc2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000023439577 1399561339 /nfs/dbraw/zinc/56/13/39/1399561339.db2.gz LDDZXJHRDCPMFE-UHFFFAOYSA-N 0 0 396.808 3.209 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 ZINC000023457979 1399562621 /nfs/dbraw/zinc/56/26/21/1399562621.db2.gz ZTZSWSQWHJFHHL-ZDUSSCGKSA-N 0 0 395.481 3.155 20 5 GGBDRN Cc1cc(C)cc(COC(=O)c2cc([N+](=O)[O-])ccc2Sc2nnnn2C)c1 ZINC000023474108 1399563351 /nfs/dbraw/zinc/56/33/51/1399563351.db2.gz YYFQZCWJOWSRAX-UHFFFAOYSA-N 0 0 399.432 3.243 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCc1ccccc1C(F)(F)F ZINC000023472526 1399563446 /nfs/dbraw/zinc/56/34/46/1399563446.db2.gz BSUDPALLSDNDRO-UHFFFAOYSA-N 0 0 382.294 3.087 20 5 GGBDRN C[C@@H](NC(=O)COC(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000023502579 1399566292 /nfs/dbraw/zinc/56/62/92/1399566292.db2.gz SPIOKFCRVNBPMR-GFCCVEGCSA-N 0 0 376.796 3.211 20 5 GGBDRN COCCOc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c(C)c1 ZINC000055643350 1407038305 /nfs/dbraw/zinc/03/83/05/1407038305.db2.gz RREFXUFPXGQTBW-UHFFFAOYSA-N 0 0 380.422 3.038 20 5 GGBDRN O=C(CSCc1ccc(F)cc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000023596495 1399572885 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GGBDRN CC(C)n1nccc1NC(=O)[C@H](C)OC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000023875059 1399587724 /nfs/dbraw/zinc/58/77/24/1399587724.db2.gz GNAMIRWRGMMIEX-JTQLQIEISA-N 0 0 380.788 3.210 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(CCc3cccs3)CC2)c1 ZINC000055643681 1407039641 /nfs/dbraw/zinc/03/96/41/1407039641.db2.gz WXPLSHUPEQMFIH-UHFFFAOYSA-N 0 0 391.518 3.379 20 5 GGBDRN Cc1c(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cccc1[N+](=O)[O-] ZINC000023879771 1399588311 /nfs/dbraw/zinc/58/83/11/1399588311.db2.gz XXSLXLUGTPYHJG-OAHLLOKOSA-N 0 0 383.452 3.241 20 5 GGBDRN CC1CCN(c2ccc(C(=O)OCC(=O)c3ccn(C)c3)cc2[N+](=O)[O-])CC1 ZINC000023892680 1399588641 /nfs/dbraw/zinc/58/86/41/1399588641.db2.gz NZHFFTBEKILFST-UHFFFAOYSA-N 0 0 385.420 3.209 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(-n2cccn2)c(F)c1 ZINC000055649231 1407041486 /nfs/dbraw/zinc/04/14/86/1407041486.db2.gz NCANPRSYMLYHCO-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN CCN(C(C)=O)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000023943111 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20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1F ZINC000027493687 1400047198 /nfs/dbraw/zinc/04/71/98/1400047198.db2.gz TZRQAIHWMHSFLJ-INIZCTEOSA-N 0 0 391.424 3.224 20 5 GGBDRN CCOc1ccc(C2(CNC(=O)c3cccc([N+](=O)[O-])c3)CCOCC2)cc1 ZINC000055762778 1407078252 /nfs/dbraw/zinc/07/82/52/1407078252.db2.gz NLSKFSYUFGVPJX-UHFFFAOYSA-N 0 0 384.432 3.472 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c1 ZINC000027507257 1400049220 /nfs/dbraw/zinc/04/92/20/1400049220.db2.gz UNLUTPZZBVACPG-UHFFFAOYSA-N 0 0 389.433 3.084 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)CN1C(=O)NC2(CCCCCC2)C1=O ZINC000027532938 1400050443 /nfs/dbraw/zinc/05/04/43/1400050443.db2.gz KORXGXYLIKUJQV-UHFFFAOYSA-N 0 0 394.859 3.282 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCN(Cc3ccsc3)CC2)cccc1[N+](=O)[O-] ZINC000027515940 1400050508 /nfs/dbraw/zinc/05/05/08/1400050508.db2.gz QRESQLGCEJETDD-HNNXBMFYSA-N 0 0 388.493 3.110 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000027570582 1400058923 /nfs/dbraw/zinc/05/89/23/1400058923.db2.gz YFRFOTZTOTWACF-HZPDHXFCSA-N 0 0 396.447 3.273 20 5 GGBDRN COc1cccc(SCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000027661735 1400072726 /nfs/dbraw/zinc/07/27/26/1400072726.db2.gz NWUTXFMUAVSRSM-UHFFFAOYSA-N 0 0 387.461 3.044 20 5 GGBDRN CC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000027696048 1400077649 /nfs/dbraw/zinc/07/76/49/1400077649.db2.gz RBYLNWNFNMEBNV-LLVKDONJSA-N 0 0 376.390 3.351 20 5 GGBDRN CC[C@H]1CCCC[C@H]1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000027700298 1400078391 /nfs/dbraw/zinc/07/83/91/1400078391.db2.gz RGZXPHOFQKEBLY-DZGCQCFKSA-N 0 0 375.425 3.368 20 5 GGBDRN CC[C@@H]1CCCC[C@H]1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000027700295 1400078455 /nfs/dbraw/zinc/07/84/55/1400078455.db2.gz RGZXPHOFQKEBLY-UKRRQHHQSA-N 0 0 375.425 3.368 20 5 GGBDRN CC[C@@H]1CCCC[C@@H]1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000027700288 1400078509 /nfs/dbraw/zinc/07/85/09/1400078509.db2.gz RGZXPHOFQKEBLY-HIFRSBDPSA-N 0 0 375.425 3.368 20 5 GGBDRN CC(C)NC(=O)c1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000055756688 1407075666 /nfs/dbraw/zinc/07/56/66/1407075666.db2.gz LTUXHDUIJVECEX-UHFFFAOYSA-N 0 0 393.403 3.171 20 5 GGBDRN CC(C)CNc1nnc(SCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)s1 ZINC000027776379 1400091009 /nfs/dbraw/zinc/09/10/09/1400091009.db2.gz WRZZUQRAVPUPPM-UHFFFAOYSA-N 0 0 393.494 3.196 20 5 GGBDRN CCn1c(=O)c2sccc2nc1SCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000027819801 1400096646 /nfs/dbraw/zinc/09/66/46/1400096646.db2.gz JDBWVMBQLPMMMB-UHFFFAOYSA-N 0 0 390.446 3.117 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000027826575 1400097339 /nfs/dbraw/zinc/09/73/39/1400097339.db2.gz YQYGTDOCBNMXTB-HNNXBMFYSA-N 0 0 397.431 3.028 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000027828676 1400097784 /nfs/dbraw/zinc/09/77/84/1400097784.db2.gz GAOHMTLOITZBKA-QGZVFWFLSA-N 0 0 382.464 3.430 20 5 GGBDRN O=C(NC[C@H]1CCN(c2ccccc2)C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000027846319 1400099314 /nfs/dbraw/zinc/09/93/14/1400099314.db2.gz ZVSAIWDFFVTESD-QGZVFWFLSA-N 0 0 394.475 3.451 20 5 GGBDRN Cc1cccc(N2CCN([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000027877766 1400101300 /nfs/dbraw/zinc/10/13/00/1400101300.db2.gz IVMGWLCIFFGGJX-QGZVFWFLSA-N 0 0 382.464 3.361 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2)C1 ZINC000027898494 1400103221 /nfs/dbraw/zinc/10/32/21/1400103221.db2.gz SPYWULAHZPYVDZ-FQEVSTJZSA-N 0 0 381.432 3.409 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCO[C@H](c3ccccc3)C2)cc1OC ZINC000027909948 1400104981 /nfs/dbraw/zinc/10/49/81/1400104981.db2.gz NFANQLPAKJQCMH-IBGZPJMESA-N 0 0 386.404 3.216 20 5 GGBDRN Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1)C2=O ZINC000027917416 1400105464 /nfs/dbraw/zinc/10/54/64/1400105464.db2.gz YWPBZANOOKTPFV-QWHCGFSZSA-N 0 0 382.372 3.192 20 5 GGBDRN 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ZINC000028393862 1400159871 /nfs/dbraw/zinc/15/98/71/1400159871.db2.gz WERZBYTUDACMCA-SNVBAGLBSA-N 0 0 377.784 3.323 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000055796837 1407085064 /nfs/dbraw/zinc/08/50/64/1407085064.db2.gz SPDHYWRBFIPVTP-UHFFFAOYSA-N 0 0 384.392 3.423 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000055798099 1407085073 /nfs/dbraw/zinc/08/50/73/1407085073.db2.gz WIYXMXXEDIEBMT-KRWDZBQOSA-N 0 0 375.812 3.132 20 5 GGBDRN C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000055797057 1407085097 /nfs/dbraw/zinc/08/50/97/1407085097.db2.gz FKZMPKWRJFKHJQ-LBPRGKRZSA-N 0 0 391.424 3.111 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)NCc3ccc([N+](=O)[O-])cc3)cc2)C[C@@H](C)O1 ZINC000055798074 1407085184 /nfs/dbraw/zinc/08/51/84/1407085184.db2.gz QFVMPWLZIGQPFG-HZPDHXFCSA-N 0 0 383.448 3.134 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCc1nc(COc2ccc(F)cc2)no1 ZINC000028423142 1400164351 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ZINC000028631688 1400178985 /nfs/dbraw/zinc/17/89/85/1400178985.db2.gz AIBKURMCHNKYAN-GFCCVEGCSA-N 0 0 388.807 3.378 20 5 GGBDRN COc1cc([C@H]2Nc3ccccc3C(=O)N2CC(F)(F)F)c([N+](=O)[O-])cc1O ZINC000028660041 1400182036 /nfs/dbraw/zinc/18/20/36/1400182036.db2.gz FMXFTUOICQDTLT-HNNXBMFYSA-N 0 0 397.309 3.438 20 5 GGBDRN Cc1nnc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)s1 ZINC000028701327 1400188280 /nfs/dbraw/zinc/18/82/80/1400188280.db2.gz WJUMXEBBUNNGRG-QWRGUYRKSA-N 0 0 375.454 3.489 20 5 GGBDRN CC(=O)Nc1c(C)cccc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000028753914 1400192502 /nfs/dbraw/zinc/19/25/02/1400192502.db2.gz XCXQUTBSAKSQEA-ZDUSSCGKSA-N 0 0 399.403 3.354 20 5 GGBDRN CCCCCNC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775166 1400194379 /nfs/dbraw/zinc/19/43/79/1400194379.db2.gz WQVFCUUCPUEIGO-MRXNPFEDSA-N 0 0 394.471 3.393 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775154 1400194410 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393.739 3.260 20 5 GGBDRN Cc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000028829459 1400200366 /nfs/dbraw/zinc/20/03/66/1400200366.db2.gz UGMVXUQBRPYPOG-UHFFFAOYSA-N 0 0 393.739 3.260 20 5 GGBDRN Cc1ccc([C@H](CNC(=O)c2cccc(C)c2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000055807886 1407087980 /nfs/dbraw/zinc/08/79/80/1407087980.db2.gz HCZMZOIDZLKKCC-IBGZPJMESA-N 0 0 383.448 3.015 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)c2ccccc2SC)c([N+](=O)[O-])c1 ZINC000028928859 1400213309 /nfs/dbraw/zinc/21/33/09/1400213309.db2.gz HGBSWTIZSSIJHA-UHFFFAOYSA-N 0 0 376.390 3.121 20 5 GGBDRN CC(C)c1cccc(NC(=O)CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000028928261 1400213323 /nfs/dbraw/zinc/21/33/23/1400213323.db2.gz IXTYEUTYJUWQJZ-UHFFFAOYSA-N 0 0 382.464 3.479 20 5 GGBDRN Cc1cccc(C)c1OCC(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000028931520 1400213419 /nfs/dbraw/zinc/21/34/19/1400213419.db2.gz SKSMWJSLWBFEAA-UHFFFAOYSA-N 0 0 392.795 3.426 20 5 GGBDRN CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccc(OC(F)F)cc1 ZINC000028933834 1400214173 /nfs/dbraw/zinc/21/41/73/1400214173.db2.gz HYURHNAECJDPTQ-UHFFFAOYSA-N 0 0 379.363 3.291 20 5 GGBDRN CC(=O)Nc1ccc2c(COC(=O)c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 ZINC000028938944 1400214828 /nfs/dbraw/zinc/21/48/28/1400214828.db2.gz OZFFVQUFBFFHFG-UHFFFAOYSA-N 0 0 382.328 3.017 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000028947105 1400214909 /nfs/dbraw/zinc/21/49/09/1400214909.db2.gz ZMGZUJYGSWUIIS-INIZCTEOSA-N 0 0 385.811 3.083 20 5 GGBDRN COc1ccc(F)cc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000028953563 1400215548 /nfs/dbraw/zinc/21/55/48/1400215548.db2.gz FEDDQOQBWLEHDC-NSHDSACASA-N 0 0 376.340 3.235 20 5 GGBDRN O=C(CSc1nccc(C(F)(F)F)n1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000028989047 1400220906 /nfs/dbraw/zinc/22/09/06/1400220906.db2.gz GKSUUVWDSZBSGK-UHFFFAOYSA-N 0 0 384.339 3.085 20 5 GGBDRN CN(C[C@@H]1COc2ccccc2O1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000029006434 1400224479 /nfs/dbraw/zinc/22/44/79/1400224479.db2.gz RYICXJFNOMXCPS-QGZVFWFLSA-N 0 0 385.420 3.085 20 5 GGBDRN COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H](C)CCc2ccccc2)c([N+](=O)[O-])c1 ZINC000029067026 1400232286 /nfs/dbraw/zinc/23/22/86/1400232286.db2.gz KPYCSBHTVVTXGB-LSDHHAIUSA-N 0 0 399.447 3.319 20 5 GGBDRN COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@H](C)CCc2ccccc2)c([N+](=O)[O-])c1 ZINC000029067035 1400232308 /nfs/dbraw/zinc/23/23/08/1400232308.db2.gz KPYCSBHTVVTXGB-HUUCEWRRSA-N 0 0 399.447 3.319 20 5 GGBDRN COC(=O)[C@@H](C)NC(=O)c1ccc(NCCC2=CCCCC2)c([N+](=O)[O-])c1 ZINC000029067535 1400233108 /nfs/dbraw/zinc/23/31/08/1400233108.db2.gz ASQVVDNXBLHGFU-CYBMUJFWSA-N 0 0 375.425 3.189 20 5 GGBDRN CCc1ccc(CN(C)c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])cc1 ZINC000029068476 1400233118 /nfs/dbraw/zinc/23/31/18/1400233118.db2.gz CSKGWXFIZFJESY-CQSZACIVSA-N 0 0 399.447 3.085 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@H](C)c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000029069879 1400233299 /nfs/dbraw/zinc/23/32/99/1400233299.db2.gz WKKVTBXJBXUIHH-LLVKDONJSA-N 0 0 391.811 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CCOc1cc2c(cc1CNc1cc3nc[nH]c(=O)c3cc1[N+](=O)[O-])O[C@H](C)C2 ZINC000029187485 1400256212 /nfs/dbraw/zinc/25/62/12/1400256212.db2.gz FRBLKLRANLUVNN-LLVKDONJSA-N 0 0 396.403 3.166 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(N2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000029219027 1400259709 /nfs/dbraw/zinc/25/97/09/1400259709.db2.gz PDKBXGRSLURKPS-OKILXGFUSA-N 0 0 398.415 3.226 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2nc(-c3cccnc3)cs2)cc([N+](=O)[O-])c1 ZINC000029253196 1400266737 /nfs/dbraw/zinc/26/67/37/1400266737.db2.gz AMIPTMVWHIRNKR-UHFFFAOYSA-N 0 0 384.373 3.152 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NCc1nnnn1-c1ccc(C(F)(F)F)cc1 ZINC000055824216 1407094471 /nfs/dbraw/zinc/09/44/71/1407094471.db2.gz DSBGQUBBRUWUAF-UHFFFAOYSA-N 0 0 394.313 3.210 20 5 GGBDRN COCC(=O)Nc1cccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000029260837 1400268236 /nfs/dbraw/zinc/26/82/36/1400268236.db2.gz YKTBXLQLTRQQTI-UHFFFAOYSA-N 0 0 399.428 3.324 20 5 GGBDRN CCn1c2nnc(COc3ccc([N+](=O)[O-])cc3Cl)n2c2ccccc2c1=O ZINC000029271284 1400272126 /nfs/dbraw/zinc/27/21/26/1400272126.db2.gz GDAFKKWUAKXAOS-UHFFFAOYSA-N 0 0 399.794 3.205 20 5 GGBDRN O=C(NCCOc1ccc(F)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000029297356 1400277965 /nfs/dbraw/zinc/27/79/65/1400277965.db2.gz SKPJJKUEENOTFI-UHFFFAOYSA-N 0 0 387.411 3.146 20 5 GGBDRN CNC(=O)Nc1cccc(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1 ZINC000029324994 1400283491 /nfs/dbraw/zinc/28/34/91/1400283491.db2.gz ATPZAVXSKAMAKC-UHFFFAOYSA-N 0 0 398.828 3.109 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1noc(-c2ccc(Cl)cc2)n1 ZINC000029325903 1400283682 /nfs/dbraw/zinc/28/36/82/1400283682.db2.gz XXHDIWZVWJSAJK-UHFFFAOYSA-N 0 0 384.735 3.094 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCN(Cc2csc(-c3ccco3)n2)CC1 ZINC000029325695 1400283705 /nfs/dbraw/zinc/28/37/05/1400283705.db2.gz VOVJYQDGNPZFRD-UHFFFAOYSA-N 0 0 398.444 3.269 20 5 GGBDRN C[C@H](CN1CCCC1=O)NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000055815137 1407090751 /nfs/dbraw/zinc/09/07/51/1407090751.db2.gz WPBSVIRQUHJITL-CQSZACIVSA-N 0 0 383.404 3.128 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2nc(-c3ccc[nH]3)cs2)cc([N+](=O)[O-])c1 ZINC000029351431 1400285926 /nfs/dbraw/zinc/28/59/26/1400285926.db2.gz XFHDAZVYDKQQJB-UHFFFAOYSA-N 0 0 386.389 3.475 20 5 GGBDRN CC(=O)NCCCNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000029369724 1400289199 /nfs/dbraw/zinc/28/91/99/1400289199.db2.gz YEUNICVXNFBSSV-UHFFFAOYSA-N 0 0 387.461 3.310 20 5 GGBDRN Cc1ccc(NC(=O)NC(=O)[C@H](C)OC(=O)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000029407452 1400293671 /nfs/dbraw/zinc/29/36/71/1400293671.db2.gz MAYNNECARXEJBI-ZDUSSCGKSA-N 0 0 385.376 3.105 20 5 GGBDRN O=C(NC1CC1)c1ccc(N2CCC([C@@H](O)c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000029414424 1400295432 /nfs/dbraw/zinc/29/54/32/1400295432.db2.gz RLMSZFCKMJQNBI-NRFANRHFSA-N 0 0 395.459 3.437 20 5 GGBDRN Cc1ccc(NC(=O)NC(=O)[C@@H](C)OC(=O)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000029468247 1400303172 /nfs/dbraw/zinc/30/31/72/1400303172.db2.gz KZVNSHKOUACHMY-CQSZACIVSA-N 0 0 399.403 3.034 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC(c3ccc(O)cc3)CC2)c([N+](=O)[O-])c1 ZINC000029530940 1400310329 /nfs/dbraw/zinc/31/03/29/1400310329.db2.gz KIZLISFQHDPYNI-UHFFFAOYSA-N 0 0 376.434 3.088 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)c1 ZINC000029531729 1400310910 /nfs/dbraw/zinc/31/09/10/1400310910.db2.gz QSHMNYSTZSOGKA-UHFFFAOYSA-N 0 0 384.392 3.164 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCO[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000029532893 1400310981 /nfs/dbraw/zinc/31/09/81/1400310981.db2.gz ZGRUQXBKRIZQDK-LJQANCHMSA-N 0 0 385.420 3.006 20 5 GGBDRN O=C(CN1CCO[C@H](c2ccc(F)cc2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000029537909 1400312441 /nfs/dbraw/zinc/31/24/41/1400312441.db2.gz DSKKLWXBDMPTEN-KRWDZBQOSA-N 0 0 393.802 3.399 20 5 GGBDRN O=C(CN1CCO[C@@H](c2ccc(F)cc2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000029537950 1400312583 /nfs/dbraw/zinc/31/25/83/1400312583.db2.gz OAVXHRIRASPGOT-QGZVFWFLSA-N 0 0 393.802 3.399 20 5 GGBDRN Cc1c(C(=O)NCc2cccc(NC(=O)c3ccccn3)c2)cccc1[N+](=O)[O-] ZINC000055830942 1407096226 /nfs/dbraw/zinc/09/62/26/1407096226.db2.gz IUFZHGXGXXRSBY-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1cccc(NC(=O)c2ccccn2)c1 ZINC000055830986 1407096440 /nfs/dbraw/zinc/09/64/40/1407096440.db2.gz LBRVSCCKZHGSHU-UHFFFAOYSA-N 0 0 390.399 3.101 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1N1CCN(Cc2nc(-c3ccccc3)no2)CC1 ZINC000029585819 1400317953 /nfs/dbraw/zinc/31/79/53/1400317953.db2.gz DPSXPQZWBUOBPE-UHFFFAOYSA-N 0 0 383.383 3.106 20 5 GGBDRN COc1ccc(OC)c(CN2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000029584957 1400318315 /nfs/dbraw/zinc/31/83/15/1400318315.db2.gz IQSGHOPQXUUHMX-UHFFFAOYSA-N 0 0 375.400 3.073 20 5 GGBDRN CCCCN1C(=O)N=NC1SCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000029616513 1400323562 /nfs/dbraw/zinc/32/35/62/1400323562.db2.gz MWORMHRUEIDMRP-UHFFFAOYSA-N 0 0 376.398 3.034 20 5 GGBDRN O=C(NC1CC1)c1ccc(NC[C@@H]2CCN(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000029624731 1400324172 /nfs/dbraw/zinc/32/41/72/1400324172.db2.gz CWZZVMSZOGTVBJ-HNNXBMFYSA-N 0 0 380.448 3.425 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000029631884 1400325859 /nfs/dbraw/zinc/32/58/59/1400325859.db2.gz RBNDGMCJNGCLNB-UHFFFAOYSA-N 0 0 385.468 3.147 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCN(c2ccc(C(C)=O)cc2F)CC1 ZINC000029633057 1400326246 /nfs/dbraw/zinc/32/62/46/1400326246.db2.gz YDYPETJVWDEMLV-UHFFFAOYSA-N 0 0 387.411 3.267 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N2CCO[C@@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000029658650 1400332245 /nfs/dbraw/zinc/33/22/45/1400332245.db2.gz LRMJPJIUTRWZJV-AUUYWEPGSA-N 0 0 387.411 3.443 20 5 GGBDRN Cc1nccc(CNC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)n1 ZINC000055837168 1407099376 /nfs/dbraw/zinc/09/93/76/1407099376.db2.gz OOUPIPYEHMOGFL-UHFFFAOYSA-N 0 0 377.404 3.235 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cc(-c4ccc(F)cc4)no3)CC2)cn1 ZINC000029820712 1400357794 /nfs/dbraw/zinc/35/77/94/1400357794.db2.gz RZNGGTKOKDEJEF-UHFFFAOYSA-N 0 0 383.383 3.106 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000029829213 1400359348 /nfs/dbraw/zinc/35/93/48/1400359348.db2.gz UIRWTKCQPBRVIY-UHFFFAOYSA-N 0 0 391.449 3.019 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc2oc(SCc3cccc([N+](=O)[O-])c3)nc2c1 ZINC000029876875 1400370293 /nfs/dbraw/zinc/37/02/93/1400370293.db2.gz KGGUANVWIVJJTR-UHFFFAOYSA-N 0 0 393.446 3.279 20 5 GGBDRN CCc1ccccc1N1C[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000029890667 1400372702 /nfs/dbraw/zinc/37/27/02/1400372702.db2.gz RGAYPYOOZSSJGT-MRXNPFEDSA-N 0 0 379.416 3.099 20 5 GGBDRN Cc1ccc(NC(=O)CSCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000029890693 1400372755 /nfs/dbraw/zinc/37/27/55/1400372755.db2.gz JWBRBXQGXMGITB-UHFFFAOYSA-N 0 0 385.445 3.164 20 5 GGBDRN COc1ccc(OC)c(NC(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000055843349 1407101319 /nfs/dbraw/zinc/10/13/19/1407101319.db2.gz YIZSUTOMUWOJRF-UHFFFAOYSA-N 0 0 397.334 3.264 20 5 GGBDRN COc1ccc(NC(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)c(OC)c1 ZINC000055843402 1407101418 /nfs/dbraw/zinc/10/14/18/1407101418.db2.gz FPECCFPDQNJNOI-UHFFFAOYSA-N 0 0 397.334 3.264 20 5 GGBDRN COc1cc(NC(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)cc(OC)c1 ZINC000055843389 1407101453 /nfs/dbraw/zinc/10/14/53/1407101453.db2.gz DAVQONGDKCBUGH-UHFFFAOYSA-N 0 0 397.334 3.264 20 5 GGBDRN O=C(CNc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2sccc2C1 ZINC000055843280 1407101496 /nfs/dbraw/zinc/10/14/96/1407101496.db2.gz UTDBBIPGJKRIHW-UHFFFAOYSA-N 0 0 383.376 3.255 20 5 GGBDRN O=C(NC[C@H]1COCCO1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000055844678 1407101768 /nfs/dbraw/zinc/10/17/68/1407101768.db2.gz RGNBSTJSEUYZGI-HNNXBMFYSA-N 0 0 392.795 3.186 20 5 GGBDRN C[C@H](Oc1ccccc1Cl)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000029973682 1400390172 /nfs/dbraw/zinc/39/01/72/1400390172.db2.gz GWDAWOOGGAQTKA-AWEZNQCLSA-N 0 0 389.839 3.364 20 5 GGBDRN Cc1cc2nnc(SCc3ccc(C(N)=O)cc3[N+](=O)[O-])n2c2ccccc12 ZINC000030025729 1400400933 /nfs/dbraw/zinc/40/09/33/1400400933.db2.gz GESOEGAQMYZEIG-UHFFFAOYSA-N 0 0 393.428 3.490 20 5 GGBDRN CCOc1ccc(NC(=O)CNc2ccccc2-n2cccn2)c([N+](=O)[O-])c1 ZINC000055851140 1407103052 /nfs/dbraw/zinc/10/30/52/1407103052.db2.gz VODDIXKHULIEDU-UHFFFAOYSA-N 0 0 381.392 3.230 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCc2nnc3n2CCCCC3)cc1[N+](=O)[O-] ZINC000042766285 1400413067 /nfs/dbraw/zinc/41/30/67/1400413067.db2.gz QGEBXFRDVNWESY-UHFFFAOYSA-N 0 0 385.468 3.183 20 5 GGBDRN Cc1cc(C)n(CCOC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 ZINC000042777384 1400413719 /nfs/dbraw/zinc/41/37/19/1400413719.db2.gz PXNOYVDCTDKMCF-UHFFFAOYSA-N 0 0 375.428 3.211 20 5 GGBDRN CC(C)(C)n1nc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1C1CC1 ZINC000042769904 1400413743 /nfs/dbraw/zinc/41/37/43/1400413743.db2.gz QRUAGXWJDNRZLV-UHFFFAOYSA-N 0 0 397.479 3.386 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000042786267 1400414455 /nfs/dbraw/zinc/41/44/55/1400414455.db2.gz KCPUTFHIKDRELZ-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN COc1ccc(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1NC(C)=O ZINC000042786352 1400414462 /nfs/dbraw/zinc/41/44/62/1400414462.db2.gz NORUOEJNXUXZOW-UHFFFAOYSA-N 0 0 387.392 3.278 20 5 GGBDRN CCc1ccccc1NC(=O)CN(C)C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000042785567 1400414638 /nfs/dbraw/zinc/41/46/38/1400414638.db2.gz LIXDTIOQPTZMMW-UHFFFAOYSA-N 0 0 399.447 3.332 20 5 GGBDRN Cc1cc(C)cc(OCCCN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000042788239 1400415460 /nfs/dbraw/zinc/41/54/60/1400415460.db2.gz FOPGSKMFFCXGBD-NRFANRHFSA-N 0 0 397.431 3.448 20 5 GGBDRN COc1cc(C(=O)NC[C@H](Nc2ccccc2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000042790307 1400415468 /nfs/dbraw/zinc/41/54/68/1400415468.db2.gz FHEJODFHCRARBS-INIZCTEOSA-N 0 0 387.436 3.479 20 5 GGBDRN Cc1c(NC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)cccc1[N+](=O)[O-] ZINC000042847794 1400421115 /nfs/dbraw/zinc/42/11/15/1400421115.db2.gz VMDMGEFNZGWHPI-UHFFFAOYSA-N 0 0 388.445 3.194 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CC(c2ccccc2)=NO1 ZINC000042918022 1400429834 /nfs/dbraw/zinc/42/98/34/1400429834.db2.gz RSGFCMCBYPQDLC-HNNXBMFYSA-N 0 0 377.303 3.328 20 5 GGBDRN Cc1ccc(-n2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)nn2)cc1 ZINC000042918007 1400429838 /nfs/dbraw/zinc/42/98/38/1400429838.db2.gz IQBOXBDPNUPVJS-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN O=C(CCCNC(=O)c1ccccc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000042918390 1400429862 /nfs/dbraw/zinc/42/98/62/1400429862.db2.gz HRTPQCYMNCFERI-UHFFFAOYSA-N 0 0 393.346 3.345 20 5 GGBDRN C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000042918216 1400429922 /nfs/dbraw/zinc/42/99/22/1400429922.db2.gz REASNHABIYOXCT-BJOHPYRUSA-N 0 0 380.303 3.363 20 5 GGBDRN O=C(NCCC(=O)N1CCC[C@@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000055862593 1407107258 /nfs/dbraw/zinc/10/72/58/1407107258.db2.gz IZKQKFGEJLDNIE-GOSISDBHSA-N 0 0 385.395 3.218 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(C)c(NC(C)=O)c1C ZINC000055892407 1407121071 /nfs/dbraw/zinc/12/10/71/1407121071.db2.gz HLWHSLYMDCAVIW-UHFFFAOYSA-N 0 0 386.408 3.229 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccc(C)c(NC(C)=O)c2C)c([N+](=O)[O-])c1 ZINC000055892400 1407121112 /nfs/dbraw/zinc/12/11/12/1407121112.db2.gz ZEONRVZPTVCQFA-UHFFFAOYSA-N 0 0 386.408 3.229 20 5 GGBDRN CNC(=O)c1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1Cl ZINC000055892518 1407121410 /nfs/dbraw/zinc/12/14/10/1407121410.db2.gz GYRFHAMYIZCXOP-UHFFFAOYSA-N 0 0 387.783 3.270 20 5 GGBDRN CC1CCN(C(=O)c2ccccc2NCc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000055893252 1407121959 /nfs/dbraw/zinc/12/19/59/1407121959.db2.gz YEBDNLSWRFERTC-UHFFFAOYSA-N 0 0 396.447 3.178 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1Cl ZINC000055906098 1407128136 /nfs/dbraw/zinc/12/81/36/1407128136.db2.gz ADLBITFVGCHWBF-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN COC(=O)COc1ccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c(C)c1 ZINC000055907417 1407129036 /nfs/dbraw/zinc/12/90/36/1407129036.db2.gz NGZDEJFYIGEATM-UHFFFAOYSA-N 0 0 390.417 3.429 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000055910601 1407132069 /nfs/dbraw/zinc/13/20/69/1407132069.db2.gz FTHBVRHGBWUKSJ-INIZCTEOSA-N 0 0 383.404 3.408 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@@H]3CCCOC3)cc2[N+](=O)[O-])C1 ZINC000055921361 1407133828 /nfs/dbraw/zinc/13/38/28/1407133828.db2.gz MNOFTTAJKFILME-XHSDSOJGSA-N 0 0 375.469 3.234 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccc(Br)cc2)c(F)c1 ZINC000055942440 1407141144 /nfs/dbraw/zinc/14/11/44/1407141144.db2.gz NXZOKPNHGWLDID-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN O=[N+]([O-])c1cccc(OS(=O)(=O)c2cc(Br)cnc2Cl)c1 ZINC000055943027 1407141652 /nfs/dbraw/zinc/14/16/52/1407141652.db2.gz IPOYGVGEDSDFOY-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN O=c1ccc2ccc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2o1 ZINC000055950292 1407146209 /nfs/dbraw/zinc/14/62/09/1407146209.db2.gz UESNIWVXSCHSQT-UHFFFAOYSA-N 0 0 381.749 3.122 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Cn1cncn1 ZINC000055968933 1407152151 /nfs/dbraw/zinc/15/21/51/1407152151.db2.gz NRCWHPMAIQCLQX-ZDUSSCGKSA-N 0 0 383.433 3.354 20 5 GGBDRN COc1ccc([C@H]2CCCN2S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000055972710 1407154537 /nfs/dbraw/zinc/15/45/37/1407154537.db2.gz FWSCBVKIYCATDU-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(F)cc1C ZINC000055977563 1407156835 /nfs/dbraw/zinc/15/68/35/1407156835.db2.gz UDADZILWCVPYCZ-CYBMUJFWSA-N 0 0 395.412 3.126 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(Oc2ccccc2)CC1 ZINC000055976872 1407157012 /nfs/dbraw/zinc/15/70/12/1407157012.db2.gz NHAOUZJZYYXMTJ-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000055986102 1407159071 /nfs/dbraw/zinc/15/90/71/1407159071.db2.gz RGXUHAMASCYPDO-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN Cc1c(C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)cccc1[N+](=O)[O-] ZINC000055986723 1407159316 /nfs/dbraw/zinc/15/93/16/1407159316.db2.gz WNSWHFUKBPZZAI-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000055987513 1407159697 /nfs/dbraw/zinc/15/96/97/1407159697.db2.gz DLQKULZKRBBUFF-HUUCEWRRSA-N 0 0 397.431 3.405 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000055987635 1407160628 /nfs/dbraw/zinc/16/06/28/1407160628.db2.gz ZRRSKMCNZRFYAN-GJZGRUSLSA-N 0 0 397.431 3.405 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)ccc1[N+](=O)[O-] ZINC000055987985 1407160723 /nfs/dbraw/zinc/16/07/23/1407160723.db2.gz FCRIOGZWHVKSTG-GJZGRUSLSA-N 0 0 397.431 3.405 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1 ZINC000055987711 1407160839 /nfs/dbraw/zinc/16/08/39/1407160839.db2.gz ZKGFQCOOSNRYDD-KBPBESRZSA-N 0 0 383.404 3.097 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1 ZINC000055988164 1407161461 /nfs/dbraw/zinc/16/14/61/1407161461.db2.gz FYQXZNZVLUKTGE-GJZGRUSLSA-N 0 0 397.431 3.025 20 5 GGBDRN CCCOc1ccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000055989794 1407163116 /nfs/dbraw/zinc/16/31/16/1407163116.db2.gz IIVAEOCVSYOFHW-UHFFFAOYSA-N 0 0 385.420 3.451 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NC(=O)c3csc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 ZINC000055989387 1407163241 /nfs/dbraw/zinc/16/32/41/1407163241.db2.gz GUJDHBNHAUXAHE-VXGBXAGGSA-N 0 0 389.433 3.158 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000056000517 1407167690 /nfs/dbraw/zinc/16/76/90/1407167690.db2.gz KUGQXMQVMHCZMX-INIZCTEOSA-N 0 0 399.472 3.458 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000056035795 1407177216 /nfs/dbraw/zinc/17/72/16/1407177216.db2.gz RAMCJOBRAHWYMX-SNVBAGLBSA-N 0 0 397.840 3.246 20 5 GGBDRN CCOc1ccc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000056039523 1407178522 /nfs/dbraw/zinc/17/85/22/1407178522.db2.gz GBFWIFMTSUAUDD-UHFFFAOYSA-N 0 0 399.447 3.121 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1ccnc(OC2CCCC2)c1 ZINC000056054015 1407183310 /nfs/dbraw/zinc/18/33/10/1407183310.db2.gz WPLGQCAUFPOAON-UHFFFAOYSA-N 0 0 391.449 3.098 20 5 GGBDRN COc1cc(C)c([C@@H](C)NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1OC ZINC000056058628 1407184423 /nfs/dbraw/zinc/18/44/23/1407184423.db2.gz YOHMGPDOOWKCIM-CYBMUJFWSA-N 0 0 394.449 3.268 20 5 GGBDRN COc1cc(C)c([C@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000056058790 1407184500 /nfs/dbraw/zinc/18/45/00/1407184500.db2.gz RCMPAPYGLLBXCB-ZDUSSCGKSA-N 0 0 394.449 3.268 20 5 GGBDRN COc1cc(C)c([C@@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000056058791 1407184797 /nfs/dbraw/zinc/18/47/97/1407184797.db2.gz RCMPAPYGLLBXCB-CYBMUJFWSA-N 0 0 394.449 3.268 20 5 GGBDRN COc1cc(C)c([C@H](C)NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1OC ZINC000056058654 1407184900 /nfs/dbraw/zinc/18/49/00/1407184900.db2.gz NWRUOPMZUMMECX-ZDUSSCGKSA-N 0 0 394.449 3.268 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccnc(OCc3ccccc3)c2)cc1 ZINC000056060854 1407185575 /nfs/dbraw/zinc/18/55/75/1407185575.db2.gz UMDLKSAUSHUVDA-UHFFFAOYSA-N 0 0 399.428 3.047 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1cccc(OCC(F)(F)F)c1 ZINC000056064120 1407187233 /nfs/dbraw/zinc/18/72/33/1407187233.db2.gz UKJQIZBNMNOYFN-UHFFFAOYSA-N 0 0 390.339 3.014 20 5 GGBDRN CC(C)[C@@H](C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)n1nnc(-c2ccccc2)n1 ZINC000056083388 1407196814 /nfs/dbraw/zinc/19/68/14/1407196814.db2.gz IYNSXVHUXMXKSN-KSSFIOAISA-N 0 0 394.435 3.323 20 5 GGBDRN CCCCOc1cccc(CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000056076438 1407193523 /nfs/dbraw/zinc/19/35/23/1407193523.db2.gz ZCFULNBDPWXBQZ-UHFFFAOYSA-N 0 0 378.450 3.393 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000056079803 1407195166 /nfs/dbraw/zinc/19/51/66/1407195166.db2.gz NECWWEJBVZIIQG-ZDUSSCGKSA-N 0 0 391.449 3.058 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000056079782 1407195344 /nfs/dbraw/zinc/19/53/44/1407195344.db2.gz OHEBCPWXNFFNIJ-ZDUSSCGKSA-N 0 0 391.449 3.058 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1C ZINC000056098416 1407202505 /nfs/dbraw/zinc/20/25/05/1407202505.db2.gz LXTYKYGRIJMNCC-UHFFFAOYSA-N 0 0 390.461 3.444 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(OCc3ccccn3)cc2)cc1 ZINC000056117782 1407211653 /nfs/dbraw/zinc/21/16/53/1407211653.db2.gz OWDSTGJNOJQHFG-UHFFFAOYSA-N 0 0 399.428 3.047 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000056119863 1407212879 /nfs/dbraw/zinc/21/28/79/1407212879.db2.gz GMVGDSKAPSZIMP-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN O=C(NCc1cccc(NC(=O)N2CCCC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000056119996 1407213035 /nfs/dbraw/zinc/21/30/35/1407213035.db2.gz DFHWOVZKVYQEBX-UHFFFAOYSA-N 0 0 386.383 3.292 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000056119878 1407213059 /nfs/dbraw/zinc/21/30/59/1407213059.db2.gz CETDSRBDBTZHQH-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN CC(C)(C)[C@@H](NC(=O)CS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000056130558 1407217872 /nfs/dbraw/zinc/21/78/72/1407217872.db2.gz ONZBIHKPLDZSIC-INIZCTEOSA-N 0 0 396.490 3.334 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000056126802 1407216110 /nfs/dbraw/zinc/21/61/10/1407216110.db2.gz KHICIAFYSNZFSP-QGZVFWFLSA-N 0 0 396.852 3.319 20 5 GGBDRN CCc1ccccc1NC(=O)CN(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000056127004 1407216490 /nfs/dbraw/zinc/21/64/90/1407216490.db2.gz XVEABEGJXPKEJD-UHFFFAOYSA-N 0 0 380.404 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)c(F)c1 ZINC000056137556 1407221525 /nfs/dbraw/zinc/22/15/25/1407221525.db2.gz LEUNSJLLSAKYCX-NVXWUHKLSA-N 0 0 398.387 3.072 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000056137601 1407221595 /nfs/dbraw/zinc/22/15/95/1407221595.db2.gz FTWCLNJTWVJNHT-DLBZAZTESA-N 0 0 394.424 3.241 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000056138132 1407222365 /nfs/dbraw/zinc/22/23/65/1407222365.db2.gz OMXWTBDXFBYLGN-SJLPKXTDSA-N 0 0 394.424 3.241 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000056138044 1407222638 /nfs/dbraw/zinc/22/26/38/1407222638.db2.gz YCUJUEVUHYWIMN-ROUUACIJSA-N 0 0 394.424 3.241 20 5 GGBDRN CCOC(=O)c1cccc(N(CC)S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000056141520 1407223928 /nfs/dbraw/zinc/22/39/28/1407223928.db2.gz VNNJLWDNVOIJEY-UHFFFAOYSA-N 0 0 392.433 3.295 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@H]1c1cccc(C)c1 ZINC000056140563 1407224173 /nfs/dbraw/zinc/22/41/73/1407224173.db2.gz LGQUBLXKIKLKPY-INIZCTEOSA-N 0 0 376.434 3.438 20 5 GGBDRN CCCNC(=O)c1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl ZINC000056150610 1407228913 /nfs/dbraw/zinc/22/89/13/1407228913.db2.gz AGLNLIWITVOMSY-UHFFFAOYSA-N 0 0 391.811 3.406 20 5 GGBDRN C[C@@H](Nc1ccc(OCC(F)(F)F)nc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000056156143 1407232776 /nfs/dbraw/zinc/23/27/76/1407232776.db2.gz QTPGERATLBGHPS-SNVBAGLBSA-N 0 0 384.314 3.370 20 5 GGBDRN CCC(=O)Nc1ccc(N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000056163413 1407235589 /nfs/dbraw/zinc/23/55/89/1407235589.db2.gz UXYGKJGNHAZXKQ-LBPRGKRZSA-N 0 0 386.408 3.391 20 5 GGBDRN COc1ccc(CSCC(=O)NCc2ccc(C)c(OC)c2)cc1[N+](=O)[O-] ZINC000056192487 1407246694 /nfs/dbraw/zinc/24/66/94/1407246694.db2.gz SLGSWUWWBZINJI-UHFFFAOYSA-N 0 0 390.461 3.470 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCO[C@@H]2CCC[C@H]21 ZINC000056195592 1407247490 /nfs/dbraw/zinc/24/74/90/1407247490.db2.gz PRDCZTOLQARFQE-UKRRQHHQSA-N 0 0 387.358 3.196 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCO[C@@H]2CCC[C@@H]21 ZINC000056195588 1407247796 /nfs/dbraw/zinc/24/77/96/1407247796.db2.gz PRDCZTOLQARFQE-DZGCQCFKSA-N 0 0 387.358 3.196 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Nc2cccc(N3CCOCC3)c2)cccc1[N+](=O)[O-] ZINC000056206090 1407251418 /nfs/dbraw/zinc/25/14/18/1407251418.db2.gz WWKZTWMPMFHMQK-HNNXBMFYSA-N 0 0 384.436 3.179 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)C1(c2ccc(Br)cc2)CC1 ZINC000056219598 1407257205 /nfs/dbraw/zinc/25/72/05/1407257205.db2.gz OOKREFAXDJAVFD-UHFFFAOYSA-N 0 0 394.225 3.137 20 5 GGBDRN Cc1nc(Cc2ccccc2)sc1C(=O)OCCn1c(C)ncc1[N+](=O)[O-] ZINC000056220051 1407257296 /nfs/dbraw/zinc/25/72/96/1407257296.db2.gz YQISLPUWBBTRIT-UHFFFAOYSA-N 0 0 386.433 3.312 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@H](C)Oc1ccc(Cl)c(Cl)c1 ZINC000056219833 1407257369 /nfs/dbraw/zinc/25/73/69/1407257369.db2.gz BQUMNEZUUMRLIT-VIFPVBQESA-N 0 0 388.207 3.417 20 5 GGBDRN CN(C(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)c1cccc2ccccc21 ZINC000056225156 1407259349 /nfs/dbraw/zinc/25/93/49/1407259349.db2.gz YRWCOGDFYFDXRH-UHFFFAOYSA-N 0 0 389.367 3.007 20 5 GGBDRN O=C(OCCc1c[nH]nc1C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000056230607 1407262313 /nfs/dbraw/zinc/26/23/13/1407262313.db2.gz KJVTUXLZYQGXAC-UHFFFAOYSA-N 0 0 398.341 3.336 20 5 GGBDRN CC1CCC(CNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)CC1 ZINC000056268242 1407271603 /nfs/dbraw/zinc/27/16/03/1407271603.db2.gz SRBNNCKRMRJIHI-UHFFFAOYSA-N 0 0 389.481 3.431 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@@H](C)C2)cc1OC ZINC000056267034 1407271705 /nfs/dbraw/zinc/27/17/05/1407271705.db2.gz LJKBCGAKPVUUMI-KGLIPLIRSA-N 0 0 380.441 3.185 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCC1(c2ccc(F)cc2)CCOCC1 ZINC000056251123 1407267474 /nfs/dbraw/zinc/26/74/74/1407267474.db2.gz XRJVHBAUKFERBL-UHFFFAOYSA-N 0 0 388.395 3.221 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000056251358 1407267598 /nfs/dbraw/zinc/26/75/98/1407267598.db2.gz ZTBULKIKBNPPNE-UHFFFAOYSA-N 0 0 398.394 3.088 20 5 GGBDRN O=C(N[C@H]1CCOc2c(Cl)cccc21)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000056253115 1407268089 /nfs/dbraw/zinc/26/80/89/1407268089.db2.gz QSDGYTOUSXVDRE-AWEZNQCLSA-N 0 0 399.794 3.083 20 5 GGBDRN CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000056253302 1407268170 /nfs/dbraw/zinc/26/81/70/1407268170.db2.gz ATBSOMUFBNFASK-UHFFFAOYSA-N 0 0 391.449 3.065 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000056271061 1407273453 /nfs/dbraw/zinc/27/34/53/1407273453.db2.gz JCWVAZXYDRZKQY-INIZCTEOSA-N 0 0 376.796 3.152 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(CS(C)(=O)=O)c1 ZINC000056287956 1407279958 /nfs/dbraw/zinc/27/99/58/1407279958.db2.gz WJDRMFCHYJFUQO-UHFFFAOYSA-N 0 0 390.461 3.190 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(S(C)(=O)=O)c1 ZINC000056287999 1407279972 /nfs/dbraw/zinc/27/99/72/1407279972.db2.gz JHJBFIZUDNJRAE-UHFFFAOYSA-N 0 0 376.434 3.049 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CSc1nncn1C(C)C ZINC000056288226 1407280972 /nfs/dbraw/zinc/28/09/72/1407280972.db2.gz ZGMQCHJTMADMCB-UHFFFAOYSA-N 0 0 377.470 3.297 20 5 GGBDRN CCOC(=O)N1CCC[C@@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000056288447 1407281115 /nfs/dbraw/zinc/28/11/15/1407281115.db2.gz UGRPCSFSFGZNAL-MRXNPFEDSA-N 0 0 377.441 3.200 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1cc2ccccc2[nH]c1=O ZINC000056288755 1407281174 /nfs/dbraw/zinc/28/11/74/1407281174.db2.gz ZFPHKBIHHQGXOA-UHFFFAOYSA-N 0 0 379.416 3.416 20 5 GGBDRN CCOC(=O)N1CCC[C@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000056288446 1407281296 /nfs/dbraw/zinc/28/12/96/1407281296.db2.gz UGRPCSFSFGZNAL-INIZCTEOSA-N 0 0 377.441 3.200 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(=O)n(-c2ccccc2)n1 ZINC000056288436 1407281312 /nfs/dbraw/zinc/28/13/12/1407281312.db2.gz TZADXDAWBUKVHH-UHFFFAOYSA-N 0 0 392.415 3.192 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(N2CCNC2=O)cc1 ZINC000056288192 1407281321 /nfs/dbraw/zinc/28/13/21/1407281321.db2.gz OPKNIYWJWYNYEM-UHFFFAOYSA-N 0 0 382.420 3.175 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)n2)cc1 ZINC000056289359 1407282589 /nfs/dbraw/zinc/28/25/89/1407282589.db2.gz 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ZINC000047338610 1404810960 /nfs/dbraw/zinc/81/09/60/1404810960.db2.gz URVRWGPEARKYPS-UHFFFAOYSA-N 0 0 379.800 3.283 20 5 GGBDRN CCCCc1nc(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cs1 ZINC000047347292 1404812438 /nfs/dbraw/zinc/81/24/38/1404812438.db2.gz PCYRLAYDJGVQPL-GOSISDBHSA-N 0 0 388.449 3.361 20 5 GGBDRN CCC[C@@]1(c2ccccc2)NC(=O)N(CCOc2cccc([N+](=O)[O-])c2)C1=O ZINC000047348404 1404812792 /nfs/dbraw/zinc/81/27/92/1404812792.db2.gz JKZHPXJEOSYBFU-FQEVSTJZSA-N 0 0 383.404 3.221 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@](C)(c3cc4ccccc4o3)C2=O)cc1[N+](=O)[O-] ZINC000047354290 1404814274 /nfs/dbraw/zinc/81/42/74/1404814274.db2.gz OKIBGPGFBVMYFH-HXUWFJFHSA-N 0 0 395.371 3.317 20 5 GGBDRN C[C@]1(c2cc3ccccc3o2)NC(=O)N(CCOc2cccc([N+](=O)[O-])c2)C1=O ZINC000047354308 1404814388 /nfs/dbraw/zinc/81/43/88/1404814388.db2.gz FXHDPAGEPVALAU-HXUWFJFHSA-N 0 0 395.371 3.187 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2csc(-c3ccco3)n2)C1=O ZINC000047357350 1404814946 /nfs/dbraw/zinc/81/49/46/1404814946.db2.gz WGVNVAJEFDVGKR-GOSISDBHSA-N 0 0 398.400 3.279 20 5 GGBDRN CCCCc1nc(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cs1 ZINC000047357243 1404815008 /nfs/dbraw/zinc/81/50/08/1404815008.db2.gz MGYGUOGINRWHEP-SFHVURJKSA-N 0 0 388.449 3.361 20 5 GGBDRN COc1ccc(-c2noc(COc3ccc([N+](=O)[O-])cc3F)n2)c(OC)c1 ZINC000047355098 1404815033 /nfs/dbraw/zinc/81/50/33/1404815033.db2.gz NRMTUOFBXBYGRR-UHFFFAOYSA-N 0 0 375.312 3.380 20 5 GGBDRN Cc1c(CN2C(=O)N[C@@](C)(c3ccc(F)cc3F)C2=O)cccc1[N+](=O)[O-] ZINC000047358021 1404815062 /nfs/dbraw/zinc/81/50/62/1404815062.db2.gz RGJLRHGIEXXLOC-SFHVURJKSA-N 0 0 375.331 3.149 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cc(-c3ccccc3)no2)C1=O ZINC000047357433 1404815118 /nfs/dbraw/zinc/81/51/18/1404815118.db2.gz VTOFMEXXXUMHSI-HXUWFJFHSA-N 0 0 392.371 3.217 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)COc1ccc([N+](=O)[O-])cc1F ZINC000047355073 1404815124 /nfs/dbraw/zinc/81/51/24/1404815124.db2.gz HBCJZNXHYDUINU-UHFFFAOYSA-N 0 0 392.383 3.179 20 5 GGBDRN Cc1cc(C)cc(-n2ncc3c2ncn(Cc2cccc([N+](=O)[O-])c2C)c3=O)c1 ZINC000047368677 1404818412 /nfs/dbraw/zinc/81/84/12/1404818412.db2.gz KTIQVNOWSBAKCO-UHFFFAOYSA-N 0 0 389.415 3.464 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000047393660 1404825059 /nfs/dbraw/zinc/82/50/59/1404825059.db2.gz ZHZCJGFPWASALX-LBPRGKRZSA-N 0 0 377.422 3.189 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCN(Cc4cccs4)CC3)n2)cc1 ZINC000047406661 1404827893 /nfs/dbraw/zinc/82/78/93/1404827893.db2.gz ZARAOIJBLPRYSV-UHFFFAOYSA-N 0 0 385.449 3.024 20 5 GGBDRN Cc1ccccc1CN1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000047406786 1404828031 /nfs/dbraw/zinc/82/80/31/1404828031.db2.gz WTYCDVZBZCNCSA-UHFFFAOYSA-N 0 0 393.447 3.271 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCN(Cc4ccsc4)CC3)n2)cc1 ZINC000047406838 1404828834 /nfs/dbraw/zinc/82/88/34/1404828834.db2.gz LPYBKLQSKYMYPO-UHFFFAOYSA-N 0 0 385.449 3.024 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Nc1ccccc1Br ZINC000047417627 1404830941 /nfs/dbraw/zinc/83/09/41/1404830941.db2.gz KESSKDXVACBVIE-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN CCc1nc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)sc1C ZINC000047423933 1404832817 /nfs/dbraw/zinc/83/28/17/1404832817.db2.gz HFDJEGDSKMSJSN-UHFFFAOYSA-N 0 0 390.421 3.249 20 5 GGBDRN Cn1c(SCc2cccc(C(N)=O)c2)nc2cc3ccccc3cc2c1=O ZINC000047438863 1404836657 /nfs/dbraw/zinc/83/66/57/1404836657.db2.gz IPUWPFCCNKPCFT-UHFFFAOYSA-N 0 0 375.453 3.478 20 5 GGBDRN O=C(CCc1ccccc1)N1CCC(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000047442557 1404837563 /nfs/dbraw/zinc/83/75/63/1404837563.db2.gz GYVXVSPYXLUGTQ-UHFFFAOYSA-N 0 0 381.432 3.405 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)NCc3nncn3C)cc2[N+](=O)[O-])cc1 ZINC000047471515 1404846919 /nfs/dbraw/zinc/84/69/19/1404846919.db2.gz YUHFHUCZDUJSEA-UHFFFAOYSA-N 0 0 383.433 3.113 20 5 GGBDRN CCOC(=O)COc1cccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047498168 1404852611 /nfs/dbraw/zinc/85/26/11/1404852611.db2.gz YCOYIJKOVJNLLS-ZDUSSCGKSA-N 0 0 387.392 3.419 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O ZINC000047502732 1404853904 /nfs/dbraw/zinc/85/39/04/1404853904.db2.gz QUTUEIUNOGDFRA-MRVPVSSYSA-N 0 0 387.339 3.421 20 5 GGBDRN CNC(=O)c1ccc(CNc2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000047511061 1404855292 /nfs/dbraw/zinc/85/52/92/1404855292.db2.gz FLYUQUFBZQVUFP-UHFFFAOYSA-N 0 0 398.297 3.494 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000047543243 1404863825 /nfs/dbraw/zinc/86/38/25/1404863825.db2.gz QFESFWCAUYBNTO-LLVKDONJSA-N 0 0 384.392 3.369 20 5 GGBDRN COc1ncccc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000047553784 1404866497 /nfs/dbraw/zinc/86/64/97/1404866497.db2.gz MJSGHODZVBKVFM-UHFFFAOYSA-N 0 0 381.392 3.112 20 5 GGBDRN C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000047557774 1404867139 /nfs/dbraw/zinc/86/71/39/1404867139.db2.gz 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Cc1cccc(CN2CCN(C(=O)CCOc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000047609944 1404879158 /nfs/dbraw/zinc/87/91/58/1404879158.db2.gz GSJFVGPPFOVIEY-UHFFFAOYSA-N 0 0 383.448 3.017 20 5 GGBDRN COc1cc(CCNC(=O)c2ccc(-c3cnco3)cc2)c([N+](=O)[O-])cc1OC ZINC000047623569 1404881092 /nfs/dbraw/zinc/88/10/92/1404881092.db2.gz NEEXPXXGARAWFU-UHFFFAOYSA-N 0 0 397.387 3.240 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000047623604 1404881118 /nfs/dbraw/zinc/88/11/18/1404881118.db2.gz HSXAFMCBLOKXJI-UHFFFAOYSA-N 0 0 385.420 3.484 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000047623894 1404881236 /nfs/dbraw/zinc/88/12/36/1404881236.db2.gz ZKZYILDQZYXUQX-LJQANCHMSA-N 0 0 398.394 3.142 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1cc2c(cc1Cl)OCCO2 ZINC000047625335 1404881761 /nfs/dbraw/zinc/88/17/61/1404881761.db2.gz FIBOCSCXYYJCOT-UHFFFAOYSA-N 0 0 378.768 3.427 20 5 GGBDRN CN(Cc1nc2ccccc2s1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000047671240 1404890668 /nfs/dbraw/zinc/89/06/68/1404890668.db2.gz SRMYYKNABFOTRQ-UHFFFAOYSA-N 0 0 381.410 3.164 20 5 GGBDRN COc1ccc([C@@H]2CCCN2S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 ZINC000047671088 1404890745 /nfs/dbraw/zinc/89/07/45/1404890745.db2.gz RIDYRMTZHUESIW-HNNXBMFYSA-N 0 0 380.397 3.268 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCc1ccccc1OC(F)(F)F ZINC000047671387 1404890835 /nfs/dbraw/zinc/89/08/35/1404890835.db2.gz CEDVCMKRABRIAJ-UHFFFAOYSA-N 0 0 394.302 3.111 20 5 GGBDRN Cc1ccc(NC(=O)NCCc2cc(F)cc3c2OCOC3)cc1[N+](=O)[O-] ZINC000047697562 1404894578 /nfs/dbraw/zinc/89/45/78/1404894578.db2.gz VNKKTIGDCPDYPU-UHFFFAOYSA-N 0 0 375.356 3.273 20 5 GGBDRN Cc1c(NC(=O)NCCc2cc(F)cc3c2OCOC3)cccc1[N+](=O)[O-] ZINC000047707025 1404897119 /nfs/dbraw/zinc/89/71/19/1404897119.db2.gz LJBMKEJPBUTDBA-UHFFFAOYSA-N 0 0 375.356 3.273 20 5 GGBDRN O=C(Nc1nccn1Cc1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000047709408 1404897342 /nfs/dbraw/zinc/89/73/42/1404897342.db2.gz VHLVPFYDBJSKAG-UHFFFAOYSA-N 0 0 391.431 3.114 20 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ZINC000047744213 1404916869 /nfs/dbraw/zinc/91/68/69/1404916869.db2.gz RPRFPEQBTOYFMA-QGZVFWFLSA-N 0 0 386.496 3.112 20 5 GGBDRN C[C@H](C(=O)Nc1c(F)cccc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745497 1404918020 /nfs/dbraw/zinc/91/80/20/1404918020.db2.gz NMOSQKMSLUKTPG-CYBMUJFWSA-N 0 0 390.390 3.022 20 5 GGBDRN C[C@@H](C(=O)Nc1cc(F)ccc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745562 1404918235 /nfs/dbraw/zinc/91/82/35/1404918235.db2.gz APEMOYBFZBMQNP-ZDUSSCGKSA-N 0 0 390.390 3.022 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(F)c(F)c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745566 1404918409 /nfs/dbraw/zinc/91/84/09/1404918409.db2.gz VZRIOHQTSCRPLS-ZDUSSCGKSA-N 0 0 390.390 3.022 20 5 GGBDRN CCOc1cc(C)ccc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000047764933 1404932370 /nfs/dbraw/zinc/93/23/70/1404932370.db2.gz JZGJWXPRADNBPH-UHFFFAOYSA-N 0 0 385.424 3.051 20 5 GGBDRN CNC(=O)c1cc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000047815427 1404961837 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CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000067116709 1409012125 /nfs/dbraw/zinc/01/21/25/1409012125.db2.gz QVARUBHEXLSMBC-UHFFFAOYSA-N 0 0 389.433 3.085 20 5 GGBDRN CCN(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000067113694 1409012171 /nfs/dbraw/zinc/01/21/71/1409012171.db2.gz KYPCKNUTUKLDRV-LBPRGKRZSA-N 0 0 377.470 3.381 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(F)c(NC(C)=O)c1 ZINC000067116746 1409012381 /nfs/dbraw/zinc/01/23/81/1409012381.db2.gz WXNTVZGHVIAALC-UHFFFAOYSA-N 0 0 381.385 3.056 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OCCOC)c(F)c1 ZINC000067124050 1409014032 /nfs/dbraw/zinc/01/40/32/1409014032.db2.gz GVZZSBYPLUGPBH-UHFFFAOYSA-N 0 0 398.412 3.122 20 5 GGBDRN O=C(NCCCSc1ccccc1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067133544 1409016657 /nfs/dbraw/zinc/01/66/57/1409016657.db2.gz FNIZGZUFQSCCPM-UHFFFAOYSA-N 0 0 383.433 3.088 20 5 GGBDRN C[C@H](NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)c1cc2ccccc2o1 ZINC000067133900 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ZINC000067138133 1409019296 /nfs/dbraw/zinc/01/92/96/1409019296.db2.gz FPNSRQTXIXKUTP-UHFFFAOYSA-N 0 0 378.348 3.131 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC2)cc1 ZINC000067144168 1409021175 /nfs/dbraw/zinc/02/11/75/1409021175.db2.gz PGIGCOJQZNELHX-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN CCOc1cccc([C@H](C)NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1 ZINC000067149058 1409022399 /nfs/dbraw/zinc/02/23/99/1409022399.db2.gz UNGJGTWBNORYID-ZDUSSCGKSA-N 0 0 381.392 3.065 20 5 GGBDRN O=C(OCc1nc2ccccc2s1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067153299 1409024015 /nfs/dbraw/zinc/02/40/15/1409024015.db2.gz VAINLENOYRDYGA-UHFFFAOYSA-N 0 0 381.373 3.142 20 5 GGBDRN Cc1c(C(=O)Oc2cccc([N+](=O)[O-])c2)nnn1-c1cccc2cccnc21 ZINC000067152481 1409024049 /nfs/dbraw/zinc/02/40/49/1409024049.db2.gz JXOFDHPYLUADEH-UHFFFAOYSA-N 0 0 375.344 3.251 20 5 GGBDRN CCS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000067154865 1409024901 /nfs/dbraw/zinc/02/49/01/1409024901.db2.gz WDSWCMYLRVHQFD-UHFFFAOYSA-N 0 0 394.836 3.245 20 5 GGBDRN C[C@H](CC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)NC(=O)C1CCCCC1 ZINC000067157749 1409025745 /nfs/dbraw/zinc/02/57/45/1409025745.db2.gz WWZGQXNURHNXPN-CYBMUJFWSA-N 0 0 399.451 3.399 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N(C1CC1)[C@H]1CCc2ccccc21 ZINC000067166401 1409030558 /nfs/dbraw/zinc/03/05/58/1409030558.db2.gz DDNNMUDZRMMFTN-FQEVSTJZSA-N 0 0 389.415 3.468 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1c(F)cccc1N1CCCC1 ZINC000067167433 1409030989 /nfs/dbraw/zinc/03/09/89/1409030989.db2.gz XECFYYXUIWCVQK-UHFFFAOYSA-N 0 0 377.347 3.491 20 5 GGBDRN CCNC(=O)c1cc(Cl)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000067171237 1409031772 /nfs/dbraw/zinc/03/17/72/1409031772.db2.gz YNADOCNLWUBEMG-UHFFFAOYSA-N 0 0 391.811 3.406 20 5 GGBDRN CCNC(=O)c1cc(Cl)ccc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000067170925 1409031872 /nfs/dbraw/zinc/03/18/72/1409031872.db2.gz ANGKIFPBCWUVFE-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN 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O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000067725034 1409215727 /nfs/dbraw/zinc/21/57/27/1409215727.db2.gz OBOSJHNODSZUBB-KRWDZBQOSA-N 0 0 383.404 3.413 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000067753397 1409222262 /nfs/dbraw/zinc/22/22/62/1409222262.db2.gz YSXXYAZOOUYSQN-IBGZPJMESA-N 0 0 384.388 3.256 20 5 GGBDRN CCCCOc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000067753614 1409222474 /nfs/dbraw/zinc/22/24/74/1409222474.db2.gz AFLPUFKFYWBJCP-UHFFFAOYSA-N 0 0 392.433 3.430 20 5 GGBDRN CCCCOc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000067753323 1409222482 /nfs/dbraw/zinc/22/24/82/1409222482.db2.gz LDPQBRVLIDPFEI-UHFFFAOYSA-N 0 0 392.433 3.430 20 5 GGBDRN CCCCC1CCC(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CC1 ZINC000067754939 1409222937 /nfs/dbraw/zinc/22/29/37/1409222937.db2.gz DOZKGJCYQOXWAS-UHFFFAOYSA-N 0 0 382.482 3.477 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1SC(F)F ZINC000067766023 1409225218 /nfs/dbraw/zinc/22/52/18/1409225218.db2.gz ZXTSMWYLHORBPI-UHFFFAOYSA-N 0 0 381.360 3.164 20 5 GGBDRN CCCCOc1ccc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000067766063 1409225429 /nfs/dbraw/zinc/22/54/29/1409225429.db2.gz JMUIIJKBLXUADF-UHFFFAOYSA-N 0 0 385.420 3.337 20 5 GGBDRN Cc1cc([C@H](C)NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c(C)o1 ZINC000067766992 1409225690 /nfs/dbraw/zinc/22/56/90/1409225690.db2.gz CRNJOQKRBXBYTB-VIFPVBQESA-N 0 0 397.334 3.222 20 5 GGBDRN CC(C)c1cccc(N(C)C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000067768474 1409226105 /nfs/dbraw/zinc/22/61/05/1409226105.db2.gz MLDIJKPCHLQMNQ-UHFFFAOYSA-N 0 0 376.434 3.398 20 5 GGBDRN COc1ccc([C@@H](C)CC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000176628832 1428384604 /nfs/dbraw/zinc/38/46/04/1428384604.db2.gz CGOYHWCSVDCOJY-HOCLYGCPSA-N 0 0 384.436 3.205 20 5 GGBDRN C[S@@](=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000176628718 1428384845 /nfs/dbraw/zinc/38/48/45/1428384845.db2.gz CFOSVQWSKKDTKK-HSZRJFAPSA-N 0 0 397.250 3.025 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-] ZINC000067793111 1409232294 /nfs/dbraw/zinc/23/22/94/1409232294.db2.gz OFNAKYXNGRSGHO-NRFANRHFSA-N 0 0 377.400 3.447 20 5 GGBDRN CCN(CC)C(=O)c1cccc(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000067792639 1409232495 /nfs/dbraw/zinc/23/24/95/1409232495.db2.gz PGPAQEWGACRVFM-UHFFFAOYSA-N 0 0 385.420 3.267 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067795471 1409232661 /nfs/dbraw/zinc/23/26/61/1409232661.db2.gz NNCLRQKWHZQPKW-UHFFFAOYSA-N 0 0 378.812 3.467 20 5 GGBDRN COc1ccc(CC(=O)NCc2c(C)nn(-c3ccccc3)c2C)cc1[N+](=O)[O-] ZINC000067794708 1409232689 /nfs/dbraw/zinc/23/26/89/1409232689.db2.gz JQYXASXTZSDEJX-UHFFFAOYSA-N 0 0 394.431 3.265 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccnn2Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000067795604 1409232819 /nfs/dbraw/zinc/23/28/19/1409232819.db2.gz LQHCEXSZOCYMLO-UHFFFAOYSA-N 0 0 380.404 3.338 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)ccc1Cl ZINC000067798723 1409233808 /nfs/dbraw/zinc/23/38/08/1409233808.db2.gz VTRXERYGQDFKFX-UHFFFAOYSA-N 0 0 378.768 3.225 20 5 GGBDRN CCN(C[C@H]1COc2ccccc2O1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000067803836 1409234303 /nfs/dbraw/zinc/23/43/03/1409234303.db2.gz VQAKNQUDLZHRCX-NSHDSACASA-N 0 0 378.331 3.175 20 5 GGBDRN COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)Sc2ncccc2[N+](=O)[O-])c1 ZINC000067807356 1409234741 /nfs/dbraw/zinc/23/47/41/1409234741.db2.gz FCRBPHOLNDFEDM-NWDGAFQWSA-N 0 0 391.449 3.365 20 5 GGBDRN COc1ccc(CC(=O)NCc2cccnc2OC2CCCC2)cc1[N+](=O)[O-] ZINC000067813148 1409236631 /nfs/dbraw/zinc/23/66/31/1409236631.db2.gz LKMNCBNDIQUVPY-UHFFFAOYSA-N 0 0 385.420 3.179 20 5 GGBDRN COc1ccc(CC(=O)NCC2(c3ccccc3)CCOCC2)cc1[N+](=O)[O-] ZINC000067812814 1409236750 /nfs/dbraw/zinc/23/67/50/1409236750.db2.gz UAQACCQSEDJUDH-UHFFFAOYSA-N 0 0 384.432 3.011 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000067817630 1409237098 /nfs/dbraw/zinc/23/70/98/1409237098.db2.gz GAZBFSOFHYQVHI-AZUAARDMSA-N 0 0 388.395 3.322 20 5 GGBDRN O=C(COc1ccccc1OCC(F)(F)F)NCc1ccccc1[N+](=O)[O-] ZINC000067815796 1409237161 /nfs/dbraw/zinc/23/71/61/1409237161.db2.gz NPFILPKUCYVPMX-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN CC[C@H](NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 ZINC000067817712 1409237257 /nfs/dbraw/zinc/23/72/57/1409237257.db2.gz WPANROUJJAGIBE-HNNXBMFYSA-N 0 0 386.404 3.185 20 5 GGBDRN COc1ccc(CC(=O)NCCOc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000067816129 1409237344 /nfs/dbraw/zinc/23/73/44/1409237344.db2.gz MRBUIGNOQJGBEY-UHFFFAOYSA-N 0 0 398.337 3.360 20 5 GGBDRN O=C(COc1ccccc1OCC(F)(F)F)NCc1ccc([N+](=O)[O-])cc1 ZINC000067817037 1409237363 /nfs/dbraw/zinc/23/73/63/1409237363.db2.gz PYXRFDZNLQLYEI-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(Cl)c(NC(C)=O)c2)cc1[N+](=O)[O-] ZINC000067819778 1409237731 /nfs/dbraw/zinc/23/77/31/1409237731.db2.gz UZSGTDNOBKZUBC-UHFFFAOYSA-N 0 0 377.784 3.396 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1[N+](=O)[O-] ZINC000067818282 1409237757 /nfs/dbraw/zinc/23/77/57/1409237757.db2.gz SXGFRBLWOJOQOE-NRFANRHFSA-N 0 0 398.415 3.185 20 5 GGBDRN COc1ccc(CC(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000067818713 1409237823 /nfs/dbraw/zinc/23/78/23/1409237823.db2.gz JIZVNQYVECAXRU-SFHVURJKSA-N 0 0 384.432 3.354 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(CN3CCCCC3=O)c2)cc1[N+](=O)[O-] ZINC000067822431 1409238138 /nfs/dbraw/zinc/23/81/38/1409238138.db2.gz GEKOITNWDUBSFZ-UHFFFAOYSA-N 0 0 397.431 3.297 20 5 GGBDRN COc1ccc(CC(=O)NCC(=O)Nc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000067823355 1409238265 /nfs/dbraw/zinc/23/82/65/1409238265.db2.gz ZAJCLSFINCBYOJ-UHFFFAOYSA-N 0 0 393.399 3.054 20 5 GGBDRN COc1ccc(C)cc1-c1csc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)n1 ZINC000067824464 1409238590 /nfs/dbraw/zinc/23/85/90/1409238590.db2.gz PVHBKCIGVNCFDJ-UHFFFAOYSA-N 0 0 387.421 3.179 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cnc(-c2ccccc2)nc1 ZINC000067825078 1409238657 /nfs/dbraw/zinc/23/86/57/1409238657.db2.gz AZLRADHMEWTFLW-UHFFFAOYSA-N 0 0 392.371 3.465 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(F)c(F)cc2NC(C)=O)cc1[N+](=O)[O-] ZINC000067823543 1409238876 /nfs/dbraw/zinc/23/88/76/1409238876.db2.gz TXWMKYLIEKGFOJ-UHFFFAOYSA-N 0 0 379.319 3.021 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1nccn1CCc1ccccc1 ZINC000176633883 1428385900 /nfs/dbraw/zinc/38/59/00/1428385900.db2.gz GTILJIXJZWXLTL-DHZHZOJOSA-N 0 0 376.416 3.364 20 5 GGBDRN Cc1cccc(C(=O)Oc2cccc(NC(=O)c3cnn(C)c3)c2)c1[N+](=O)[O-] ZINC000067841247 1409241812 /nfs/dbraw/zinc/24/18/12/1409241812.db2.gz CNEBTUAGIUDQEX-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN Cc1c(C(=O)Oc2cccc(NC(=O)c3cnn(C)c3)c2)cccc1[N+](=O)[O-] ZINC000067841535 1409242423 /nfs/dbraw/zinc/24/24/23/1409242423.db2.gz VDAMCSJJPBCKKA-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN Cn1cc(C(=O)Nc2cccc(OC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)c2)cn1 ZINC000067841780 1409242489 /nfs/dbraw/zinc/24/24/89/1409242489.db2.gz WTXWKJRSFLYHPC-JXMROGBWSA-N 0 0 392.371 3.199 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)CCOc2ccccc2)cc1[N+](=O)[O-] ZINC000176634407 1428386308 /nfs/dbraw/zinc/38/63/08/1428386308.db2.gz OHUXKKHIXJNMKI-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN COCCN(Cc1ccccc1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000176634711 1428386549 /nfs/dbraw/zinc/38/65/49/1428386549.db2.gz SIQZIRWGWLLMSE-UHFFFAOYSA-N 0 0 398.868 3.394 20 5 GGBDRN Cc1cccc(C)c1OC[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000067858063 1409245244 /nfs/dbraw/zinc/24/52/44/1409245244.db2.gz BBBKHVMBRQLGAF-AWEZNQCLSA-N 0 0 378.812 3.035 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000067860216 1409245724 /nfs/dbraw/zinc/24/57/24/1409245724.db2.gz XSGFGPLZLMMPPP-SGTLLEGYSA-N 0 0 385.376 3.414 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067860218 1409245812 /nfs/dbraw/zinc/24/58/12/1409245812.db2.gz XSGFGPLZLMMPPP-XIKOKIGWSA-N 0 0 385.376 3.414 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccn(Cc2ccccc2)n1 ZINC000067865638 1409246068 /nfs/dbraw/zinc/24/60/68/1409246068.db2.gz RTPBNCFFFNTDNA-UHFFFAOYSA-N 0 0 375.388 3.433 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000067868595 1409246532 /nfs/dbraw/zinc/24/65/32/1409246532.db2.gz RWQXJWFEGJBZGO-SFHVURJKSA-N 0 0 383.404 3.350 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nc2c(s1)C[C@@H](c1ccccc1)CC2 ZINC000067870427 1409247124 /nfs/dbraw/zinc/24/71/24/1409247124.db2.gz RGWJZILEWKCAIG-AWEZNQCLSA-N 0 0 397.460 3.467 20 5 GGBDRN Cc1nn(CN2CCO[C@H](c3ccc(Br)cc3)C2)c(C)c1[N+](=O)[O-] ZINC000067873745 1409247488 /nfs/dbraw/zinc/24/74/88/1409247488.db2.gz TXRHKZSZFBFEGS-HNNXBMFYSA-N 0 0 395.257 3.202 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](c2ccccc2)O1 ZINC000067879075 1409248285 /nfs/dbraw/zinc/24/82/85/1409248285.db2.gz XQPJROSBKQOFRS-BLLLJJGKSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000067879441 1409248662 /nfs/dbraw/zinc/24/86/62/1409248662.db2.gz WCEMWOIMDCIVFG-BLLLJJGKSA-N 0 0 396.852 3.399 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C12CCCCC2 ZINC000176642697 1428388669 /nfs/dbraw/zinc/38/86/69/1428388669.db2.gz KVBNEJOTOXZLFO-QZTJIDSGSA-N 0 0 399.447 3.294 20 5 GGBDRN CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2N)c1 ZINC000176641705 1428388798 /nfs/dbraw/zinc/38/87/98/1428388798.db2.gz CMJXPKTWYXAAKC-UHFFFAOYSA-N 0 0 391.449 3.143 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCc3c(C)ccc(OC)c32)cc1[N+](=O)[O-] ZINC000067899502 1409252293 /nfs/dbraw/zinc/25/22/93/1409252293.db2.gz REORPSAZCDFWEZ-UHFFFAOYSA-N 0 0 392.433 3.062 20 5 GGBDRN COc1ccc(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000067901948 1409252785 /nfs/dbraw/zinc/25/27/85/1409252785.db2.gz FNPOTRLCZZZDCW-MRXNPFEDSA-N 0 0 398.415 3.281 20 5 GGBDRN C[C@@H]1CN(Cc2cccc(CNc3nc4sccn4c3[N+](=O)[O-])c2)CCO1 ZINC000067903833 1409252996 /nfs/dbraw/zinc/25/29/96/1409252996.db2.gz URZOLCIYMRCSQJ-CYBMUJFWSA-N 0 0 387.465 3.137 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(Sc3nncn3C)cc2)cc1[N+](=O)[O-] ZINC000067904648 1409253029 /nfs/dbraw/zinc/25/30/29/1409253029.db2.gz OOXMFRFNQZQKKX-UHFFFAOYSA-N 0 0 399.432 3.064 20 5 GGBDRN COc1cccc(C[C@H]2CCCN2C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000067908912 1409253764 /nfs/dbraw/zinc/25/37/64/1409253764.db2.gz GIIYPWACTSBFMK-QGZVFWFLSA-N 0 0 384.432 3.388 20 5 GGBDRN COc1ccc(CC(=O)N2CCC[C@H]2c2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000067924499 1409256455 /nfs/dbraw/zinc/25/64/55/1409256455.db2.gz XRSLFWWTQUHGGZ-INIZCTEOSA-N 0 0 398.415 3.281 20 5 GGBDRN CCOCCCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000067949806 1409262490 /nfs/dbraw/zinc/26/24/90/1409262490.db2.gz XRMKAHOZDZSHFR-UHFFFAOYSA-N 0 0 379.438 3.234 20 5 GGBDRN COc1ccc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)cc1 ZINC000067949657 1409262655 /nfs/dbraw/zinc/26/26/55/1409262655.db2.gz KEDZLEAGTIPEBV-UHFFFAOYSA-N 0 0 391.449 3.000 20 5 GGBDRN O=C(Nc1ccc(N2C(=O)CCCC2=O)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000067972410 1409267032 /nfs/dbraw/zinc/26/70/32/1409267032.db2.gz OGHVWUGNHSAVOO-UHFFFAOYSA-N 0 0 389.314 3.169 20 5 GGBDRN CN(CC(=O)Nc1cccc(Cl)c1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000067971744 1409267137 /nfs/dbraw/zinc/26/71/37/1409267137.db2.gz BSQXNKXZTVZHJZ-UHFFFAOYSA-N 0 0 383.738 3.237 20 5 GGBDRN O=C(Nc1ccc(CCN2CCOCC2)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000067988456 1409270754 /nfs/dbraw/zinc/27/07/54/1409270754.db2.gz SSFQZGVIIQRTDP-UHFFFAOYSA-N 0 0 391.374 3.000 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c(Cl)c1 ZINC000067991572 1409272037 /nfs/dbraw/zinc/27/20/37/1409272037.db2.gz VBUOXHKGWXDRIX-UHFFFAOYSA-N 0 0 383.738 3.203 20 5 GGBDRN C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000176659724 1428394283 /nfs/dbraw/zinc/39/42/83/1428394283.db2.gz GLJWRLQWUBEYDW-YPMHNXCESA-N 0 0 381.860 3.309 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1nc(-c2ccncc2)no1)C(C)C ZINC000067995382 1409272763 /nfs/dbraw/zinc/27/27/63/1409272763.db2.gz ZWTDNNSMJVOALA-INIZCTEOSA-N 0 0 381.392 3.475 20 5 GGBDRN Cn1c2ccccc2nc1[C@@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000068002547 1409274262 /nfs/dbraw/zinc/27/42/62/1409274262.db2.gz VREPCHMPFBTADX-SFHVURJKSA-N 0 0 380.404 3.224 20 5 GGBDRN O=C(NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000068019554 1409278182 /nfs/dbraw/zinc/27/81/82/1409278182.db2.gz XAFSYJCDZYZGPP-GOSISDBHSA-N 0 0 389.839 3.052 20 5 GGBDRN CC[C@H](C)NC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000068020822 1409278670 /nfs/dbraw/zinc/27/86/70/1409278670.db2.gz XJXCNLQJZIVTBG-LSDHHAIUSA-N 0 0 398.463 3.240 20 5 GGBDRN CC(=O)Nc1ccc(C)cc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068025469 1409282436 /nfs/dbraw/zinc/28/24/36/1409282436.db2.gz YTRCNEZPGZQVRJ-UHFFFAOYSA-N 0 0 379.376 3.300 20 5 GGBDRN 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1428399547 /nfs/dbraw/zinc/39/95/47/1428399547.db2.gz ODRPTOPRQDGFFL-DAFODLJHSA-N 0 0 390.705 3.115 20 5 GGBDRN O=C(Nc1cc(N2CCCS2(=O)=O)ccc1Cl)c1ccccc1[N+](=O)[O-] ZINC000068315588 1409364118 /nfs/dbraw/zinc/36/41/18/1409364118.db2.gz KIGRUHGBBCPIFD-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN O=C(c1ccc(I)c([N+](=O)[O-])c1)N1CCc2ccccc21 ZINC000068315928 1409364170 /nfs/dbraw/zinc/36/41/70/1409364170.db2.gz ABCSWVXUTGWMJB-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN Cc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ncccn2)ccc1[N+](=O)[O-] ZINC000068315380 1409364283 /nfs/dbraw/zinc/36/42/83/1409364283.db2.gz LKVNQAOKVRTACP-UHFFFAOYSA-N 0 0 380.408 3.429 20 5 GGBDRN Cc1csc(NC(=O)c2ccc(I)c([N+](=O)[O-])c2)n1 ZINC000068315997 1409364938 /nfs/dbraw/zinc/36/49/38/1409364938.db2.gz ADUADSYLIMJGEL-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN Cc1c(Br)cccc1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000068348891 1409374790 /nfs/dbraw/zinc/37/47/90/1409374790.db2.gz DSHIRUCPWBUDCH-UHFFFAOYSA-N 0 0 393.193 3.496 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCC2(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 ZINC000068352449 1409376131 /nfs/dbraw/zinc/37/61/31/1409376131.db2.gz QZIPNHFMARZUHW-UHFFFAOYSA-N 0 0 388.807 3.288 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCc2ccc(O)cc2C1 ZINC000068352965 1409376747 /nfs/dbraw/zinc/37/67/47/1409376747.db2.gz FDNKDLWIKFWATO-LLVKDONJSA-N 0 0 376.796 3.306 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCOc2ccccc2C1 ZINC000068360579 1409378459 /nfs/dbraw/zinc/37/84/59/1409378459.db2.gz UNMOWTDEHCYKAK-GFCCVEGCSA-N 0 0 376.796 3.437 20 5 GGBDRN Cc1ccc(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2F)cc1[N+](=O)[O-] ZINC000068362518 1409379426 /nfs/dbraw/zinc/37/94/26/1409379426.db2.gz WQCXLWPAMLDTFC-MRXNPFEDSA-N 0 0 389.408 3.196 20 5 GGBDRN COc1ccccc1-n1cnnc1SCCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000068376894 1409383271 /nfs/dbraw/zinc/38/32/71/1409383271.db2.gz XQWUHWXVOVEGDD-UHFFFAOYSA-N 0 0 399.432 3.305 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCOCC3(C)C)cc2[N+](=O)[O-])C1 ZINC000068379952 1409384137 /nfs/dbraw/zinc/38/41/37/1409384137.db2.gz SZYNGNSKZBWVEG-HUUCEWRRSA-N 0 0 375.469 3.328 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccnc1-n1cccn1 ZINC000068378297 1409384201 /nfs/dbraw/zinc/38/42/01/1409384201.db2.gz YCKLXSVCTLETCW-LLVKDONJSA-N 0 0 387.783 3.235 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CCC[C@@H](C(N)=O)C2)cc1[N+](=O)[O-] ZINC000068418800 1409396011 /nfs/dbraw/zinc/39/60/11/1409396011.db2.gz RCJOSZXMHCUDJE-CQSZACIVSA-N 0 0 379.482 3.071 20 5 GGBDRN COc1ccc(C)cc1-c1csc(NC(=O)CCn2cc([N+](=O)[O-])cn2)n1 ZINC000068422028 1409397899 /nfs/dbraw/zinc/39/78/99/1409397899.db2.gz FDEMVCRZDFNBMY-UHFFFAOYSA-N 0 0 387.421 3.261 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000068428265 1409399062 /nfs/dbraw/zinc/39/90/62/1409399062.db2.gz KDVBXUMZCNJQDF-JTQLQIEISA-N 0 0 377.784 3.474 20 5 GGBDRN CC(C)n1c(C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)n[nH]c1=S ZINC000068435371 1409401907 /nfs/dbraw/zinc/40/19/07/1409401907.db2.gz KYAXRZOYEONEMI-UHFFFAOYSA-N 0 0 389.481 3.378 20 5 GGBDRN Cc1[nH]c2ccc(CNC(=O)[C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)cc2c1C ZINC000068437713 1409402697 /nfs/dbraw/zinc/40/26/97/1409402697.db2.gz OQSOBHHXBYDROU-CQSZACIVSA-N 0 0 394.431 3.128 20 5 GGBDRN CCn1c(C2CCN(C(=O)C=Cc3ccc([N+](=O)[O-])cc3)CC2)n[nH]c1=S ZINC000068452626 1409406702 /nfs/dbraw/zinc/40/67/02/1409406702.db2.gz NNHTVHNGSKSKIR-VMPITWQZSA-N 0 0 387.465 3.288 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)c2cc(F)cc(C)c2[N+](=O)[O-])CC1 ZINC000176684411 1428405101 /nfs/dbraw/zinc/40/51/01/1428405101.db2.gz WALJOZILZQRJJH-UHFFFAOYSA-N 0 0 387.411 3.403 20 5 GGBDRN O=C(NCCCNc1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000068508571 1409421571 /nfs/dbraw/zinc/42/15/71/1409421571.db2.gz AQCPTIFLSSGRCN-UHFFFAOYSA-N 0 0 382.464 3.430 20 5 GGBDRN CC(=O)Nc1ccc2nc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)sc2c1 ZINC000068512412 1409422641 /nfs/dbraw/zinc/42/26/41/1409422641.db2.gz TZIVAOVMLBUIAA-UHFFFAOYSA-N 0 0 385.405 3.306 20 5 GGBDRN Cc1cc(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000068514117 1409423405 /nfs/dbraw/zinc/42/34/05/1409423405.db2.gz ONJMNPJDNNIRHQ-GFCCVEGCSA-N 0 0 382.420 3.325 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)N3CCC[C@@H](C(N)=O)C3)cc2[N+](=O)[O-])cc1 ZINC000068517826 1409424643 /nfs/dbraw/zinc/42/46/43/1409424643.db2.gz XFCALDXPWOPFMV-OAHLLOKOSA-N 0 0 399.472 3.392 20 5 GGBDRN Cc1nn(Cc2ccccc2)c(C)c1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068520197 1409425912 /nfs/dbraw/zinc/42/59/12/1409425912.db2.gz IUQRLTHXPPDSLB-UHFFFAOYSA-N 0 0 394.431 3.265 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@@H](C)[C@@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000176678996 1428403203 /nfs/dbraw/zinc/40/32/03/1428403203.db2.gz KXHRRZREHVCVSS-KGLIPLIRSA-N 0 0 391.468 3.054 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2cccn2C)cc([N+](=O)[O-])c1 ZINC000068536612 1409431610 /nfs/dbraw/zinc/43/16/10/1409431610.db2.gz NSVGLJBCAZKBLO-GOSISDBHSA-N 0 0 385.420 3.477 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)c1 ZINC000068549669 1409436194 /nfs/dbraw/zinc/43/61/94/1409436194.db2.gz FEEMITGJIZSBST-ZDUSSCGKSA-N 0 0 384.436 3.400 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)cn21 ZINC000068569186 1409441368 /nfs/dbraw/zinc/44/13/68/1409441368.db2.gz AAJVSDQGDMWSIZ-UHFFFAOYSA-N 0 0 393.447 3.471 20 5 GGBDRN CC[C@H](NC(=O)N1CCC(C(=O)N2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000176684696 1428404852 /nfs/dbraw/zinc/40/48/52/1428404852.db2.gz QAPDIDQSLGMIPX-SFHVURJKSA-N 0 0 388.468 3.090 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(CCN(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000176683346 1428404898 /nfs/dbraw/zinc/40/48/98/1428404898.db2.gz SGNFFUYUVZPYRG-UHFFFAOYSA-N 0 0 397.884 3.314 20 5 GGBDRN O=C(CSc1cccc2cccc(Cl)c21)OCCn1cnc([N+](=O)[O-])n1 ZINC000176683793 1428405330 /nfs/dbraw/zinc/40/53/30/1428405330.db2.gz ILCMQJJMYZEYJT-UHFFFAOYSA-N 0 0 392.824 3.328 20 5 GGBDRN C[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000068654337 1409457119 /nfs/dbraw/zinc/45/71/19/1409457119.db2.gz XBIHTPJCGROGOI-OAHLLOKOSA-N 0 0 397.431 3.368 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)c1 ZINC000068654084 1409457267 /nfs/dbraw/zinc/45/72/67/1409457267.db2.gz RSQJRPAQZXONMZ-CYBMUJFWSA-N 0 0 383.404 3.221 20 5 GGBDRN C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccc(N2CCCC2=O)cc1 ZINC000068662329 1409461460 /nfs/dbraw/zinc/46/14/60/1409461460.db2.gz GZNYSJNKFDFLJD-GFCCVEGCSA-N 0 0 393.403 3.089 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(CNC(=O)C2CCCC2)cc1 ZINC000068672967 1409465614 /nfs/dbraw/zinc/46/56/14/1409465614.db2.gz FCHKBSIWUOLDDZ-UHFFFAOYSA-N 0 0 395.459 3.374 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)Oc2cccc(F)c2F)cc1[N+](=O)[O-] ZINC000068680869 1409467264 /nfs/dbraw/zinc/46/72/64/1409467264.db2.gz XVSNOHNUHGAOGU-UHFFFAOYSA-N 0 0 392.343 3.372 20 5 GGBDRN CCC[C@H](Cc1ccccc1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000068707710 1409472365 /nfs/dbraw/zinc/47/23/65/1409472365.db2.gz ZDUVOBJSTNQYFM-QGZVFWFLSA-N 0 0 379.420 3.317 20 5 GGBDRN CCC[C@H](Cc1ccccc1)NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000068708327 1409473039 /nfs/dbraw/zinc/47/30/39/1409473039.db2.gz HFXYERPIKCMPAT-MRXNPFEDSA-N 0 0 390.461 3.140 20 5 GGBDRN CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000068715723 1409475380 /nfs/dbraw/zinc/47/53/80/1409475380.db2.gz UQHVAEABKDVBPT-ZFWWWQNUSA-N 0 0 382.482 3.333 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCCC2=O)cc1 ZINC000068719010 1409477776 /nfs/dbraw/zinc/47/77/76/1409477776.db2.gz XSXFLSZGTFLVTE-CQSZACIVSA-N 0 0 382.420 3.282 20 5 GGBDRN COc1ccc(OC(=O)c2ccc(I)cc2)c([N+](=O)[O-])c1 ZINC000068720199 1409478324 /nfs/dbraw/zinc/47/83/24/1409478324.db2.gz XZASKBLFMMFGGL-UHFFFAOYSA-N 0 0 399.140 3.427 20 5 GGBDRN CCOc1cc(-c2ccccc2)sc1C(=O)OCCn1cnc([N+](=O)[O-])n1 ZINC000176686340 1428407365 /nfs/dbraw/zinc/40/73/65/1428407365.db2.gz UTTTWSUOGCZCRK-UHFFFAOYSA-N 0 0 388.405 3.171 20 5 GGBDRN CCOc1cccc([C@@H](C)NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1 ZINC000068747749 1409485242 /nfs/dbraw/zinc/48/52/42/1409485242.db2.gz XTHXOJHUDIFQSA-CYBMUJFWSA-N 0 0 395.419 3.374 20 5 GGBDRN C[C@H](OC[C@@H]1CCCO1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000068752709 1409485953 /nfs/dbraw/zinc/48/59/53/1409485953.db2.gz ITVVUPSGKUKISR-FZMZJTMJSA-N 0 0 377.422 3.241 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H]2CCSc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000068764182 1409487295 /nfs/dbraw/zinc/48/72/95/1409487295.db2.gz URKXJCDVZXIFQN-CQSZACIVSA-N 0 0 392.408 3.475 20 5 GGBDRN C[C@H](OC[C@@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000068765302 1409487988 /nfs/dbraw/zinc/48/79/88/1409487988.db2.gz BOMORPLADKCOCT-YOEHRIQHSA-N 0 0 398.415 3.348 20 5 GGBDRN COc1cc(OCC(=O)Nc2nc3c(s2)CCCCC3)ccc1[N+](=O)[O-] ZINC000068766895 1409488012 /nfs/dbraw/zinc/48/80/12/1409488012.db2.gz CGHYCPMUGFYRNW-UHFFFAOYSA-N 0 0 377.422 3.346 20 5 GGBDRN CCS(=O)(=O)N(Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(C(C)=O)cc1 ZINC000068777827 1409490364 /nfs/dbraw/zinc/49/03/64/1409490364.db2.gz UWZIXOAITVGMLZ-UHFFFAOYSA-N 0 0 392.433 3.162 20 5 GGBDRN Cc1cc(C)n(CCN2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 ZINC000068784309 1409491942 /nfs/dbraw/zinc/49/19/42/1409491942.db2.gz MYJSFTXONHVFCI-UHFFFAOYSA-N 0 0 397.401 3.249 20 5 GGBDRN COc1cc(OCC(=O)Nc2cccc(Oc3cnccn3)c2)ccc1[N+](=O)[O-] ZINC000068789089 1409493106 /nfs/dbraw/zinc/49/31/06/1409493106.db2.gz MMFKIEMVNCJIDA-UHFFFAOYSA-N 0 0 396.359 3.203 20 5 GGBDRN COc1ccc(CCCN(C)C(=O)COc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000068797196 1409494964 /nfs/dbraw/zinc/49/49/64/1409494964.db2.gz ZMFAKIBUQSOSKN-UHFFFAOYSA-N 0 0 388.420 3.082 20 5 GGBDRN C[C@H]1CC(C)(C)CC[C@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000176689259 1428408925 /nfs/dbraw/zinc/40/89/25/1428408925.db2.gz KZQUQJDTIHKTFX-WCQYABFASA-N 0 0 379.482 3.117 20 5 GGBDRN CCC[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000068829901 1409503627 /nfs/dbraw/zinc/50/36/27/1409503627.db2.gz 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O=C(NCc1cccc2cccnc21)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000068893346 1409518081 /nfs/dbraw/zinc/51/80/81/1409518081.db2.gz YWWWSMCDGOZHFT-UHFFFAOYSA-N 0 0 384.779 3.051 20 5 GGBDRN CCOc1cccc([C@H](C)NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000068894363 1409518579 /nfs/dbraw/zinc/51/85/79/1409518579.db2.gz IASPEWKBWGAASE-NSHDSACASA-N 0 0 391.811 3.463 20 5 GGBDRN CCOc1cccc([C@H](C)NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000068894347 1409518761 /nfs/dbraw/zinc/51/87/61/1409518761.db2.gz FOTWPOCZLMHQIC-NSHDSACASA-N 0 0 391.811 3.463 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(N2CCN(C)c3ccccc3C2)c([N+](=O)[O-])c1 ZINC000068917731 1409524114 /nfs/dbraw/zinc/52/41/14/1409524114.db2.gz DARQANINSGIEOY-UHFFFAOYSA-N 0 0 391.431 3.016 20 5 GGBDRN CCOC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 ZINC000068919852 1409524651 /nfs/dbraw/zinc/52/46/51/1409524651.db2.gz AJBGAYFFFZDJQE-UHFFFAOYSA-N 0 0 388.376 3.079 20 5 GGBDRN COc1ccc(-n2cnnc2SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000068926192 1409525638 /nfs/dbraw/zinc/52/56/38/1409525638.db2.gz RNXOSIJZDQQZDS-UHFFFAOYSA-N 0 0 399.432 3.223 20 5 GGBDRN CCOc1ccccc1N1C[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1=O ZINC000068927357 1409526413 /nfs/dbraw/zinc/52/64/13/1409526413.db2.gz NBEGZVWUWRTTSX-LBPRGKRZSA-N 0 0 387.367 3.124 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)c1 ZINC000068928367 1409526493 /nfs/dbraw/zinc/52/64/93/1409526493.db2.gz PFARTKJOWSRZIT-GFCCVEGCSA-N 0 0 391.374 3.138 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000068937979 1409529450 /nfs/dbraw/zinc/52/94/50/1409529450.db2.gz LNYXIOPHISAOAN-LBPRGKRZSA-N 0 0 386.788 3.189 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000068937977 1409529559 /nfs/dbraw/zinc/52/95/59/1409529559.db2.gz LNYXIOPHISAOAN-GFCCVEGCSA-N 0 0 386.788 3.189 20 5 GGBDRN O=C(OCCn1cnc([N+](=O)[O-])n1)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000176692456 1428411202 /nfs/dbraw/zinc/41/12/02/1428411202.db2.gz RXNBBULVGDTKER-UHFFFAOYSA-N 0 0 388.767 3.489 20 5 GGBDRN C[C@@H]1CN(Cc2csc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])n2)C[C@@H](C)O1 ZINC000068975448 1409536764 /nfs/dbraw/zinc/53/67/64/1409536764.db2.gz FIRYGBKXPXTPCM-GHMZBOCLSA-N 0 0 394.428 3.052 20 5 GGBDRN Cc1c(NC(=O)N[C@H](C)c2ccccc2NS(C)(=O)=O)cccc1[N+](=O)[O-] ZINC000069027651 1409546668 /nfs/dbraw/zinc/54/66/68/1409546668.db2.gz ZBZDQBWUQLTCKE-GFCCVEGCSA-N 0 0 392.437 3.157 20 5 GGBDRN Cc1c(NC(=O)N[C@@H](C)c2ccccc2NS(C)(=O)=O)cccc1[N+](=O)[O-] ZINC000069027647 1409547000 /nfs/dbraw/zinc/54/70/00/1409547000.db2.gz ZBZDQBWUQLTCKE-LBPRGKRZSA-N 0 0 392.437 3.157 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1cccc(OC(F)F)c1 ZINC000069089516 1409562394 /nfs/dbraw/zinc/56/23/94/1409562394.db2.gz QWGKCNGQOVTBCG-UHFFFAOYSA-N 0 0 381.335 3.074 20 5 GGBDRN C[C@@H]1Sc2ccccc2N(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@H]1C ZINC000176694441 1428413442 /nfs/dbraw/zinc/41/34/42/1428413442.db2.gz RBHDJZCUOBGGBK-RYUDHWBXSA-N 0 0 399.428 3.419 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000069114585 1409569719 /nfs/dbraw/zinc/56/97/19/1409569719.db2.gz SLOKSKWFVAZPIV-ZDUSSCGKSA-N 0 0 390.390 3.199 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000069114588 1409569740 /nfs/dbraw/zinc/56/97/40/1409569740.db2.gz SLOKSKWFVAZPIV-CYBMUJFWSA-N 0 0 390.390 3.199 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc2c(c1)COC2 ZINC000069114965 1409569959 /nfs/dbraw/zinc/56/99/59/1409569959.db2.gz PRLFBHHXNKBERC-UHFFFAOYSA-N 0 0 376.434 3.224 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](c2nc(C3CC3)no2)C(C)C)cc1C ZINC000069128237 1409573026 /nfs/dbraw/zinc/57/30/26/1409573026.db2.gz AVHBOSUSFAGGIN-OAHLLOKOSA-N 0 0 394.453 3.148 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000069130480 1409573649 /nfs/dbraw/zinc/57/36/49/1409573649.db2.gz XLFGPUFKWSQYFB-OAHLLOKOSA-N 0 0 376.434 3.438 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000069130664 1409574176 /nfs/dbraw/zinc/57/41/76/1409574176.db2.gz BOZVGOKOUIEZDS-HNNXBMFYSA-N 0 0 392.433 3.138 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000069130651 1409574184 /nfs/dbraw/zinc/57/41/84/1409574184.db2.gz WRORAINRMOZVFB-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000069130637 1409574233 /nfs/dbraw/zinc/57/42/33/1409574233.db2.gz JPIHRLYRVLWSOY-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1cccnc1 ZINC000069149504 1409575466 /nfs/dbraw/zinc/57/54/66/1409575466.db2.gz MJUGWNQWRRFVCN-FQEVSTJZSA-N 0 0 392.415 3.457 20 5 GGBDRN COc1ccc(CCCN(C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000069149429 1409575577 /nfs/dbraw/zinc/57/55/77/1409575577.db2.gz IVTPRDZCLVQDNH-UHFFFAOYSA-N 0 0 387.436 3.256 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1ccc(OC(F)F)cc1 ZINC000069149270 1409575778 /nfs/dbraw/zinc/57/57/78/1409575778.db2.gz BNLKAJDTKYFCCY-UHFFFAOYSA-N 0 0 381.335 3.074 20 5 GGBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000069149662 1409576344 /nfs/dbraw/zinc/57/63/44/1409576344.db2.gz YQTQUONTNKAKMH-LBPRGKRZSA-N 0 0 378.454 3.450 20 5 GGBDRN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCCn1cnc([N+](=O)[O-])n1 ZINC000176695228 1428414913 /nfs/dbraw/zinc/41/49/13/1428414913.db2.gz BUYAYYAOYXPDAQ-UHFFFAOYSA-N 0 0 393.812 3.129 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000069208310 1409587188 /nfs/dbraw/zinc/58/71/88/1409587188.db2.gz HHTKXXGTBJPGAC-AWEZNQCLSA-N 0 0 390.390 3.199 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000069257221 1409596151 /nfs/dbraw/zinc/59/61/51/1409596151.db2.gz CWJNRPOKXGWYPM-UHFFFAOYSA-N 0 0 398.419 3.031 20 5 GGBDRN CCOc1cc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000069292657 1409606522 /nfs/dbraw/zinc/60/65/22/1409606522.db2.gz MEPVNYYTSDXPKQ-UHFFFAOYSA-N 0 0 375.381 3.203 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)Nc1ccc(-n2cccn2)c(F)c1 ZINC000069293177 1409606936 /nfs/dbraw/zinc/60/69/36/1409606936.db2.gz VWGYKHYKJUNNPG-UHFFFAOYSA-N 0 0 385.355 3.120 20 5 GGBDRN COCCOc1cc(C)ccc1NC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000069293347 1409607194 /nfs/dbraw/zinc/60/71/94/1409607194.db2.gz NLBZNYJAZMWBGR-UHFFFAOYSA-N 0 0 389.408 3.129 20 5 GGBDRN CC(=O)Nc1c(C)ccc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1C ZINC000069293871 1409607253 /nfs/dbraw/zinc/60/72/53/1409607253.db2.gz ZXYYLZYZYPGNOA-UHFFFAOYSA-N 0 0 386.408 3.371 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(-n3ccnc3)cc2)cc1OC ZINC000069393617 1409626383 /nfs/dbraw/zinc/62/63/83/1409626383.db2.gz ZXFLJUSUSJUVMM-UHFFFAOYSA-N 0 0 396.403 3.118 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCN(C(=O)C2CCCCC2)CC1 ZINC000069395532 1409627030 /nfs/dbraw/zinc/62/70/30/1409627030.db2.gz HWZKBCMKSASDPF-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCCc2cc(Cl)c3c(c2)OCCO3)c1[N+](=O)[O-] ZINC000176700396 1428417430 /nfs/dbraw/zinc/41/74/30/1428417430.db2.gz HFJPVGSVXFHGBK-UHFFFAOYSA-N 0 0 394.786 3.439 20 5 GGBDRN COCCOc1c(Cl)cccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000069409520 1409630786 /nfs/dbraw/zinc/63/07/86/1409630786.db2.gz HLEIIZSEPCGREK-UHFFFAOYSA-N 0 0 380.784 3.291 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 ZINC000176700140 1428417941 /nfs/dbraw/zinc/41/79/41/1428417941.db2.gz WPXOPPATLITNIM-OAHLLOKOSA-N 0 0 397.435 3.009 20 5 GGBDRN O=C(OCCn1cnc([N+](=O)[O-])n1)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000176699359 1428417978 /nfs/dbraw/zinc/41/79/78/1428417978.db2.gz BRLBBCJPKLUVDS-QWHCGFSZSA-N 0 0 399.432 3.089 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N[C@H](C)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000069425820 1409633567 /nfs/dbraw/zinc/63/35/67/1409633567.db2.gz WQLNPLKKPCGCJA-KUHUBIRLSA-N 0 0 397.431 3.091 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@H]1CCCN(C(=O)N2CCCC2)C1 ZINC000176700156 1428418099 /nfs/dbraw/zinc/41/80/99/1428418099.db2.gz WPXOPPATLITNIM-HNNXBMFYSA-N 0 0 397.435 3.009 20 5 GGBDRN O=C(NC[C@H](c1ccccc1)N1CCOCC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000069495602 1409643434 /nfs/dbraw/zinc/64/34/34/1409643434.db2.gz UFTUEBNLOCEDBH-GOSISDBHSA-N 0 0 389.839 3.052 20 5 GGBDRN O=C(NC[C@@H](c1ccccc1)N1CCOCC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000069495604 1409643576 /nfs/dbraw/zinc/64/35/76/1409643576.db2.gz UFTUEBNLOCEDBH-SFHVURJKSA-N 0 0 389.839 3.052 20 5 GGBDRN CC(C)N(C)c1cccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000069519058 1409647273 /nfs/dbraw/zinc/64/72/73/1409647273.db2.gz OXEIPGVSVVIPPX-AWEZNQCLSA-N 0 0 384.436 3.255 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cnn(-c2ccc(F)cc2)n1 ZINC000176700718 1428418687 /nfs/dbraw/zinc/41/86/87/1428418687.db2.gz FCENPRAQEBVHBX-UHFFFAOYSA-N 0 0 378.323 3.115 20 5 GGBDRN COC(=O)c1cc(C(=O)N2C[C@H](C(C)C)Nc3ccccc32)cc([N+](=O)[O-])c1 ZINC000176703482 1428420904 /nfs/dbraw/zinc/42/09/04/1428420904.db2.gz DMYPDYGRFLVKJD-QGZVFWFLSA-N 0 0 383.404 3.478 20 5 GGBDRN COc1cc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1OCC(N)=O ZINC000069692352 1409676531 /nfs/dbraw/zinc/67/65/31/1409676531.db2.gz NVYRMZBIXIDTBE-UHFFFAOYSA-N 0 0 399.325 3.098 20 5 GGBDRN CC(=O)N[C@H](C)CCc1ccc(C(=O)COc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000176703066 1428421582 /nfs/dbraw/zinc/42/15/82/1428421582.db2.gz ACITVGVARFJEAC-CQSZACIVSA-N 0 0 385.420 3.017 20 5 GGBDRN O=C(c1ccc(NCCc2ccc(F)cc2F)c([N+](=O)[O-])c1)N1CCOCC1 ZINC000069798294 1409701927 /nfs/dbraw/zinc/70/19/27/1409701927.db2.gz ISNCQLPXCUSIDY-UHFFFAOYSA-N 0 0 391.374 3.000 20 5 GGBDRN COC(=O)c1cc(O[C@@H](C)C(=O)Nc2cc(F)ccc2F)ccc1[N+](=O)[O-] ZINC000069801935 1409702286 /nfs/dbraw/zinc/70/22/86/1409702286.db2.gz UFCVOGXWMCQHPJ-VIFPVBQESA-N 0 0 380.303 3.066 20 5 GGBDRN CCOc1ccc(NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])c(C(=O)OC)c2)cc1 ZINC000069801916 1409702461 /nfs/dbraw/zinc/70/24/61/1409702461.db2.gz QYUZRRHVKHUBQK-GFCCVEGCSA-N 0 0 388.376 3.186 20 5 GGBDRN COC(=O)c1cc(O[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1[N+](=O)[O-] ZINC000069802080 1409703121 /nfs/dbraw/zinc/70/31/21/1409703121.db2.gz GBGKWSRJIQTSAG-OLZOCXBDSA-N 0 0 384.388 3.127 20 5 GGBDRN COC(=O)c1cc(O[C@H](C)C(=O)N(C)Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000069802131 1409703230 /nfs/dbraw/zinc/70/32/30/1409703230.db2.gz YKQZOYBULOREGU-CQSZACIVSA-N 0 0 386.404 3.116 20 5 GGBDRN COCCn1ncc2ccc(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc21 ZINC000069824906 1409710022 /nfs/dbraw/zinc/71/00/22/1409710022.db2.gz AGWUKJSCHYVKKF-ZDUSSCGKSA-N 0 0 383.408 3.474 20 5 GGBDRN O=C(CCn1c(=O)oc2ccccc21)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000176709013 1428424106 /nfs/dbraw/zinc/42/41/06/1428424106.db2.gz CZSBAKFBHVKIOF-UHFFFAOYSA-N 0 0 378.344 3.080 20 5 GGBDRN CN(CC(=O)Oc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(Br)s1 ZINC000069834234 1409712032 /nfs/dbraw/zinc/71/20/32/1409712032.db2.gz SQVCSWNGGZBUPO-UHFFFAOYSA-N 0 0 399.222 3.096 20 5 GGBDRN CC(C)(C)OC(=O)NC1(C(=O)NCc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000069854592 1409713692 /nfs/dbraw/zinc/71/36/92/1409713692.db2.gz NZMHCEXEJQCXDJ-UHFFFAOYSA-N 0 0 377.441 3.439 20 5 GGBDRN COc1cc(C(=O)Nc2ccnn2Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000069897697 1409721491 /nfs/dbraw/zinc/72/14/91/1409721491.db2.gz SOYRFIQSKWUXQU-UHFFFAOYSA-N 0 0 396.403 3.418 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@@H]1CC(=O)Nc2cc(F)ccc21 ZINC000176708895 1428424879 /nfs/dbraw/zinc/42/48/79/1428424879.db2.gz VSVVUCZEQYNMHM-CQSZACIVSA-N 0 0 380.335 3.347 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@H]1CC(=O)Nc2cc(F)ccc21 ZINC000176708912 1428424908 /nfs/dbraw/zinc/42/49/08/1428424908.db2.gz VSVVUCZEQYNMHM-AWEZNQCLSA-N 0 0 380.335 3.347 20 5 GGBDRN O=C(CCN1C(=O)CCc2ccccc21)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000176709872 1428425487 /nfs/dbraw/zinc/42/54/87/1428425487.db2.gz QXWJYPQGUDYESQ-UHFFFAOYSA-N 0 0 390.399 3.451 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CS(C)(=O)=O ZINC000069946006 1409730310 /nfs/dbraw/zinc/73/03/10/1409730310.db2.gz YDCHRQMGBOGJCM-LBPRGKRZSA-N 0 0 394.474 3.259 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000069991007 1409736257 /nfs/dbraw/zinc/73/62/57/1409736257.db2.gz JTINKCVKNXKOLE-QGZVFWFLSA-N 0 0 383.404 3.214 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000069990799 1409736486 /nfs/dbraw/zinc/73/64/86/1409736486.db2.gz HTSIQOBWDYCKSP-KRWDZBQOSA-N 0 0 383.404 3.214 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)N(CC(N)=O)C(C)C)cc2[N+](=O)[O-])cc1 ZINC000070689149 1409751463 /nfs/dbraw/zinc/75/14/63/1409751463.db2.gz TVUYZOXILMJOJC-UHFFFAOYSA-N 0 0 387.461 3.390 20 5 GGBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C1 ZINC000176712659 1428427373 /nfs/dbraw/zinc/42/73/73/1428427373.db2.gz NUDDOOJTECXSKK-CJNGLKHVSA-N 0 0 389.481 3.278 20 5 GGBDRN CCS[C@H]1CCC[C@H](NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C1 ZINC000176712624 1428427394 /nfs/dbraw/zinc/42/73/94/1428427394.db2.gz NUDDOOJTECXSKK-BBRMVZONSA-N 0 0 389.481 3.278 20 5 GGBDRN O=C(CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])Nc1ccc(F)c(F)c1F ZINC000070690729 1409751983 /nfs/dbraw/zinc/75/19/83/1409751983.db2.gz SNLMSDTYZAOGQM-UHFFFAOYSA-N 0 0 387.701 3.034 20 5 GGBDRN CC[C@H]1c2ccsc2CCN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000070695029 1409753013 /nfs/dbraw/zinc/75/30/13/1409753013.db2.gz AHBXUFVZKVDVBM-ZDUSSCGKSA-N 0 0 394.474 3.209 20 5 GGBDRN CCc1nc(CN(C)[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cs1 ZINC000070697447 1409753922 /nfs/dbraw/zinc/75/39/22/1409753922.db2.gz GNBOEILEYNTXLB-NSHDSACASA-N 0 0 378.454 3.081 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1nc(-c2ccccc2)cs1 ZINC000070717331 1409756522 /nfs/dbraw/zinc/75/65/22/1409756522.db2.gz VIIIKNPDWJPKJJ-LBPRGKRZSA-N 0 0 396.428 3.475 20 5 GGBDRN Cc1cc(C)n2nc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)nc2n1 ZINC000070718382 1409757094 /nfs/dbraw/zinc/75/70/94/1409757094.db2.gz JGFQZHFSFYEJNH-UHFFFAOYSA-N 0 0 395.404 3.025 20 5 GGBDRN COc1cc(C(=O)N(C)CCOc2cccc(Cl)c2)c([N+](=O)[O-])cc1OC ZINC000070722124 1409758577 /nfs/dbraw/zinc/75/85/77/1409758577.db2.gz ZMLSYTRISJKYSZ-UHFFFAOYSA-N 0 0 394.811 3.416 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cccc1N1CCNC1=O ZINC000176712278 1428428114 /nfs/dbraw/zinc/42/81/14/1428428114.db2.gz QXQSGSZZGRNIAL-UHFFFAOYSA-N 0 0 391.387 3.233 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000070735383 1409762723 /nfs/dbraw/zinc/76/27/23/1409762723.db2.gz WMJSRFJWRGIHTM-UHFFFAOYSA-N 0 0 399.350 3.443 20 5 GGBDRN COC(=O)c1ccc(Cl)c(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000070748259 1409763795 /nfs/dbraw/zinc/76/37/95/1409763795.db2.gz LGAGGGSSEOOEEQ-UHFFFAOYSA-N 0 0 394.767 3.304 20 5 GGBDRN O=C(NC[C@@](O)(c1ccccc1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000070762418 1409770006 /nfs/dbraw/zinc/77/00/06/1409770006.db2.gz DBKYEZBNXHZCID-OAHLLOKOSA-N 0 0 388.729 3.428 20 5 GGBDRN CCOc1ccc(C(=O)Nc2sccc2C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000070772418 1409772638 /nfs/dbraw/zinc/77/26/38/1409772638.db2.gz WVLHUMAMETVSID-UHFFFAOYSA-N 0 0 375.406 3.200 20 5 GGBDRN COc1cc(OCC(=O)NCCCn2ccc3ccccc32)ccc1[N+](=O)[O-] ZINC000070781218 1409774385 /nfs/dbraw/zinc/77/43/85/1409774385.db2.gz AYPSLZPIRNELOC-UHFFFAOYSA-N 0 0 383.404 3.143 20 5 GGBDRN Cc1cccc(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000070784867 1409775473 /nfs/dbraw/zinc/77/54/73/1409775473.db2.gz GIWPPJXEXYXQRN-UHFFFAOYSA-N 0 0 388.468 3.140 20 5 GGBDRN CSc1nnc(CCCNc2nc3sccn3c2[N+](=O)[O-])n1CC(C)C ZINC000070793980 1409776705 /nfs/dbraw/zinc/77/67/05/1409776705.db2.gz BUQOGFZTXQOZAT-UHFFFAOYSA-N 0 0 395.514 3.318 20 5 GGBDRN CCO[C@@H]1C[C@@H](OC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C1(CC)CC ZINC000176715851 1428429598 /nfs/dbraw/zinc/42/95/98/1428429598.db2.gz ZUMDZSJVASYNTB-IAGOWNOFSA-N 0 0 388.424 3.316 20 5 GGBDRN COC(=O)c1cc(CN(C)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000176715990 1428429746 /nfs/dbraw/zinc/42/97/46/1428429746.db2.gz LCSQNKVZPUDGPT-LBPRGKRZSA-N 0 0 389.408 3.494 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)cc1[N+](=O)[O-] ZINC000176715057 1428430121 /nfs/dbraw/zinc/43/01/21/1428430121.db2.gz MMZVSZMLZIICLU-CVEARBPZSA-N 0 0 390.484 3.158 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCCO[C@@H]1CCCc2ccccc21 ZINC000070874817 1409796330 /nfs/dbraw/zinc/79/63/30/1409796330.db2.gz OOVZFCBOKZTCAE-GOSISDBHSA-N 0 0 386.452 3.090 20 5 GGBDRN CCCOc1ccc(Cl)cc1NC(=O)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000070916137 1409802013 /nfs/dbraw/zinc/80/20/13/1409802013.db2.gz WWCRPPRMHKHGIP-UHFFFAOYSA-N 0 0 391.811 3.292 20 5 GGBDRN CCOC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000070920037 1409802413 /nfs/dbraw/zinc/80/24/13/1409802413.db2.gz NZYLUXGXAYSKTN-MRXNPFEDSA-N 0 0 375.469 3.474 20 5 GGBDRN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 ZINC000070932261 1409804042 /nfs/dbraw/zinc/80/40/42/1409804042.db2.gz BKZPKTGAGXUMNF-UHFFFAOYSA-N 0 0 395.774 3.471 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000070935603 1409804525 /nfs/dbraw/zinc/80/45/25/1409804525.db2.gz RSPSPSSAQFYMOL-SNVBAGLBSA-N 0 0 379.438 3.319 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NC1(c2ccccc2)CCCC1 ZINC000070956355 1409805936 /nfs/dbraw/zinc/80/59/36/1409805936.db2.gz HKSJNKRFDRYFTJ-UHFFFAOYSA-N 0 0 381.388 3.088 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N(CCc1cccc(F)c1)C1CC1 ZINC000070959061 1409806468 /nfs/dbraw/zinc/80/64/68/1409806468.db2.gz HTNUOGJLLHQJES-UHFFFAOYSA-N 0 0 395.394 3.162 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1noc(C)n1 ZINC000070981909 1409809986 /nfs/dbraw/zinc/80/99/86/1409809986.db2.gz FYACZRNMDWEDQL-KRWDZBQOSA-N 0 0 382.376 3.123 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1ccc(C)c([N+](=O)[O-])c1)c1noc(C)n1 ZINC000070983438 1409810379 /nfs/dbraw/zinc/81/03/79/1409810379.db2.gz SJNRFPJOHLWXEE-KRWDZBQOSA-N 0 0 382.376 3.123 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1ccc(C)c([N+](=O)[O-])c1)c1noc(C)n1 ZINC000070983441 1409810786 /nfs/dbraw/zinc/81/07/86/1409810786.db2.gz SJNRFPJOHLWXEE-QGZVFWFLSA-N 0 0 382.376 3.123 20 5 GGBDRN CC(C)C[C@@H]1COCCN1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000071046448 1409815866 /nfs/dbraw/zinc/81/58/66/1409815866.db2.gz PVIBNEIIRHNLFQ-QGZVFWFLSA-N 0 0 375.469 3.085 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000071053275 1409817132 /nfs/dbraw/zinc/81/71/32/1409817132.db2.gz CAZXCDOLRWYJBO-OAHLLOKOSA-N 0 0 393.321 3.149 20 5 GGBDRN O=C(NCCCC1CCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000071057775 1409817836 /nfs/dbraw/zinc/81/78/36/1409817836.db2.gz QNUTZPWVRPYJGR-UHFFFAOYSA-N 0 0 385.367 3.221 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1C(=O)N[C@](C)(c2cc3ccccc3o2)C1=O ZINC000071075120 1409819866 /nfs/dbraw/zinc/81/98/66/1409819866.db2.gz GKOKROPBGICCCC-HXUWFJFHSA-N 0 0 395.371 3.317 20 5 GGBDRN Cc1cc(Br)cnc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000071499227 1409823557 /nfs/dbraw/zinc/82/35/57/1409823557.db2.gz OAHMBNGGPLUDRI-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN COc1ccc(OCC(=O)N(Cc2ccco2)CC(F)(F)F)c([N+](=O)[O-])c1 ZINC000071798043 1409824163 /nfs/dbraw/zinc/82/41/63/1409824163.db2.gz HDSNURLGMDCIQP-UHFFFAOYSA-N 0 0 388.298 3.166 20 5 GGBDRN CCCCN(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)[C@@H](C)CC ZINC000071873928 1409828640 /nfs/dbraw/zinc/82/86/40/1409828640.db2.gz CSGMEZSPVIAQED-AWEZNQCLSA-N 0 0 386.452 3.490 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000176720513 1428433360 /nfs/dbraw/zinc/43/33/60/1428433360.db2.gz FXCRWJUVIXEPTQ-UHFFFAOYSA-N 0 0 381.841 3.202 20 5 GGBDRN CCN(CCCNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000071906060 1409829748 /nfs/dbraw/zinc/82/97/48/1409829748.db2.gz CONGVYUSKVEFRG-UHFFFAOYSA-N 0 0 377.466 3.098 20 5 GGBDRN CCC(CC)N(CCOC)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000071927060 1409830716 /nfs/dbraw/zinc/83/07/16/1409830716.db2.gz RCPJTFWORPBFDR-UHFFFAOYSA-N 0 0 377.485 3.475 20 5 GGBDRN COc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000071982301 1409834962 /nfs/dbraw/zinc/83/49/62/1409834962.db2.gz OFUWXFKRSYGDQK-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000071987176 1409835236 /nfs/dbraw/zinc/83/52/36/1409835236.db2.gz LJSRCBZFUVKQCI-HUUCEWRRSA-N 0 0 399.447 3.465 20 5 GGBDRN CC(C)(CNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(N)=O ZINC000072011207 1409837125 /nfs/dbraw/zinc/83/71/25/1409837125.db2.gz FHABOJQLQXWPEG-UHFFFAOYSA-N 0 0 391.811 3.282 20 5 GGBDRN COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000072011674 1409837253 /nfs/dbraw/zinc/83/72/53/1409837253.db2.gz ROCQJYHXSQGOFZ-SFHVURJKSA-N 0 0 384.432 3.354 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000072014997 1409838012 /nfs/dbraw/zinc/83/80/12/1409838012.db2.gz ZIRPBZBODHPPBJ-UHFFFAOYSA-N 0 0 383.832 3.378 20 5 GGBDRN O=C(Nc1cccc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1)[C@@H]1CCCO1 ZINC000072036895 1409839602 /nfs/dbraw/zinc/83/96/02/1409839602.db2.gz SLTACQBRQMIGDV-KRWDZBQOSA-N 0 0 386.364 3.233 20 5 GGBDRN CN(C[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000072034995 1409839608 /nfs/dbraw/zinc/83/96/08/1409839608.db2.gz YEQWMXHMVKYLPC-CQSZACIVSA-N 0 0 377.441 3.314 20 5 GGBDRN CCCCCCN(CCN1CCOCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000072035961 1409839674 /nfs/dbraw/zinc/83/96/74/1409839674.db2.gz GZWTXCUAUYMNGL-UHFFFAOYSA-N 0 0 378.473 3.341 20 5 GGBDRN COc1ccccc1CN(CCO)C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000176722090 1428434215 /nfs/dbraw/zinc/43/42/15/1428434215.db2.gz UAQYZMQQCDLWGV-HNNXBMFYSA-N 0 0 387.436 3.177 20 5 GGBDRN C[C@@H]1Cc2ccccc2N1CCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000072045598 1409841005 /nfs/dbraw/zinc/84/10/05/1409841005.db2.gz OUEAENOLKJWYRB-MRXNPFEDSA-N 0 0 382.464 3.354 20 5 GGBDRN O=C(NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000072044908 1409841173 /nfs/dbraw/zinc/84/11/73/1409841173.db2.gz DFCBLIUDWMEWOO-GOSISDBHSA-N 0 0 389.839 3.052 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000072051475 1409841967 /nfs/dbraw/zinc/84/19/67/1409841967.db2.gz STLLLJNMISXRGZ-MRXNPFEDSA-N 0 0 375.469 3.452 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2cc(Br)ccc2F)cc1 ZINC000072054715 1409842157 /nfs/dbraw/zinc/84/21/57/1409842157.db2.gz ZUIQENQYOHIIRZ-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)c2[nH]nc(C)c2[N+](=O)[O-])cc1 ZINC000072061696 1409843371 /nfs/dbraw/zinc/84/33/71/1409843371.db2.gz ZLCKICRUZHXPBM-QGZVFWFLSA-N 0 0 398.394 3.488 20 5 GGBDRN COC[C@H](C)n1c(C)cc(C(=O)COc2ccc([N+](=O)[O-])cc2OC)c1C ZINC000072068104 1409844802 /nfs/dbraw/zinc/84/48/02/1409844802.db2.gz JFIWSXGZSHBWOB-ZDUSSCGKSA-N 0 0 376.409 3.491 20 5 GGBDRN CCC(=O)Nc1ccc(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000072085960 1409847508 /nfs/dbraw/zinc/84/75/08/1409847508.db2.gz FYMNWOJZHWCHSP-UHFFFAOYSA-N 0 0 379.376 3.085 20 5 GGBDRN CCC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N1CCc2sccc2C1 ZINC000072088872 1409848292 /nfs/dbraw/zinc/84/82/92/1409848292.db2.gz PGLNASLSTFLZTC-INIZCTEOSA-N 0 0 387.461 3.140 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccc(OCc2ccccn2)cc1 ZINC000176723376 1428434775 /nfs/dbraw/zinc/43/47/75/1428434775.db2.gz OVUIYVRWJWYXCP-UHFFFAOYSA-N 0 0 389.367 3.365 20 5 GGBDRN O=C(Cn1cnc2ccc([N+](=O)[O-])cc2c1=O)c1cccc(C(F)(F)F)c1 ZINC000072205210 1409849376 /nfs/dbraw/zinc/84/93/76/1409849376.db2.gz BGHDJAMDRINZBP-UHFFFAOYSA-N 0 0 377.278 3.206 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc1[N+](=O)[O-] ZINC000176722520 1428435172 /nfs/dbraw/zinc/43/51/72/1428435172.db2.gz XVAKPWGRHJMTDZ-ZDUSSCGKSA-N 0 0 381.396 3.070 20 5 GGBDRN CO[C@]1(C)C[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1(C)C ZINC000073276012 1409860141 /nfs/dbraw/zinc/86/01/41/1409860141.db2.gz SFHXZCZLOSTCAC-YLJYHZDGSA-N 0 0 375.469 3.131 20 5 GGBDRN Cc1ccc2c(c1)OCCN2S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000176724678 1428436237 /nfs/dbraw/zinc/43/62/37/1428436237.db2.gz 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ZINC000097701634 1410390164 /nfs/dbraw/zinc/39/01/64/1410390164.db2.gz XUKQRXLBZDRKGK-UHFFFAOYSA-N 0 0 385.420 3.207 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCC(NC(=O)c2ccccc2)CC1 ZINC000098002240 1410393619 /nfs/dbraw/zinc/39/36/19/1410393619.db2.gz YJENBGNCKDMYOE-FLIBITNWSA-N 0 0 379.416 3.029 20 5 GGBDRN C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000098004710 1410393964 /nfs/dbraw/zinc/39/39/64/1410393964.db2.gz LCNAKEICFYAONP-ZVHGMHCTSA-N 0 0 388.445 3.231 20 5 GGBDRN O=C(c1cccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1)N1CCCC1 ZINC000098040740 1410400629 /nfs/dbraw/zinc/40/06/29/1410400629.db2.gz NAKOHIJVUBQEOU-UHFFFAOYSA-N 0 0 393.403 3.493 20 5 GGBDRN COc1cc(NCc2ccc([N+](=O)[O-])cc2)c(C(=O)N2CCCC2)cc1OC ZINC000098040830 1410400876 /nfs/dbraw/zinc/40/08/76/1410400876.db2.gz IPNLDTMEIZFPSW-UHFFFAOYSA-N 0 0 385.420 3.460 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(Cc2ccco2)C[C@@H]2CCCO2)cc1C ZINC000098038668 1410401022 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COCCn1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000101531096 1410451049 /nfs/dbraw/zinc/45/10/49/1410451049.db2.gz LTLGPWMWKOZFAE-UHFFFAOYSA-N 0 0 395.419 3.302 20 5 GGBDRN COc1ccc(Br)cc1[C@H]1CCCN1Cn1nccc1[N+](=O)[O-] ZINC000101537935 1410453888 /nfs/dbraw/zinc/45/38/88/1410453888.db2.gz QENMIUVMJXYQPB-CYBMUJFWSA-N 0 0 381.230 3.357 20 5 GGBDRN O=C(CC1CCCCC1)N1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000101537796 1410453935 /nfs/dbraw/zinc/45/39/35/1410453935.db2.gz FIGJEHRHGBDYPD-UHFFFAOYSA-N 0 0 385.468 3.017 20 5 GGBDRN O=c1ccc(-c2ccc3c(c2)OCCCO3)nn1Cc1ccccc1[N+](=O)[O-] ZINC000101541180 1410456264 /nfs/dbraw/zinc/45/62/64/1410456264.db2.gz IVZOBZQAQAEXDQ-UHFFFAOYSA-N 0 0 379.372 3.028 20 5 GGBDRN CC(=O)Nc1cc(F)c(F)cc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000101542087 1410456828 /nfs/dbraw/zinc/45/68/28/1410456828.db2.gz HXOPRAPWUBJVTK-UHFFFAOYSA-N 0 0 389.318 3.494 20 5 GGBDRN CC(C)N(CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(N2CCOCC2)cc1 ZINC000101559544 1410464401 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382.438 3.021 20 5 GGBDRN CCn1cnnc1CNCc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000101592764 1410474790 /nfs/dbraw/zinc/47/47/90/1410474790.db2.gz PNNXZEPKWKTYTJ-UHFFFAOYSA-N 0 0 397.435 3.084 20 5 GGBDRN O=C(COC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])N1CCCc2ccccc21 ZINC000101704635 1410492390 /nfs/dbraw/zinc/49/23/90/1410492390.db2.gz YQWAEZQQBBJXEG-UHFFFAOYSA-N 0 0 376.315 3.009 20 5 GGBDRN Cc1cccc(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Br)c1 ZINC000101706864 1410492428 /nfs/dbraw/zinc/49/24/28/1410492428.db2.gz VQMGGYFPYFSNBT-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@@H](c2ccco2)C1 ZINC000176828596 1428489365 /nfs/dbraw/zinc/48/93/65/1428489365.db2.gz LWVDPVYMIIUMLA-MRXNPFEDSA-N 0 0 380.784 3.210 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000101840469 1410507897 /nfs/dbraw/zinc/50/78/97/1410507897.db2.gz KCFDOUXKRGJDEF-UHFFFAOYSA-N 0 0 385.395 3.154 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC(n2ccnc2)CC1 ZINC000101864569 1410511085 /nfs/dbraw/zinc/51/10/85/1410511085.db2.gz FQPZGJWUEJIPQO-UHFFFAOYSA-N 0 0 383.452 3.259 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc([N+](=O)[O-])c1 ZINC000101899078 1410515689 /nfs/dbraw/zinc/51/56/89/1410515689.db2.gz OPNUWCYNDGFZRZ-INIZCTEOSA-N 0 0 386.383 3.079 20 5 GGBDRN CC(C)(C)OCc1cccc(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000101927217 1410527841 /nfs/dbraw/zinc/52/78/41/1410527841.db2.gz GCTYAHQQWVYTLI-UHFFFAOYSA-N 0 0 378.450 3.388 20 5 GGBDRN Cc1nn2c(nc(C)cc2C)c1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000101949886 1410530486 /nfs/dbraw/zinc/53/04/86/1410530486.db2.gz MYTRLUUYFBCILO-UHFFFAOYSA-N 0 0 391.391 3.205 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N(C)Cc3cccnc3)cc2)c(C)c1[N+](=O)[O-] ZINC000101949259 1410530685 /nfs/dbraw/zinc/53/06/85/1410530685.db2.gz YXUHVUIQYYPXRO-UHFFFAOYSA-N 0 0 379.420 3.124 20 5 GGBDRN C[C@H](NC(=O)CC1CCCCC1)C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000101949793 1410530800 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O=C(NCC(=O)N1CCC[C@@H]1C1CCCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000108448193 1411506021 /nfs/dbraw/zinc/50/60/21/1411506021.db2.gz HSUSRKSUNAYRIL-CQSZACIVSA-N 0 0 379.844 3.159 20 5 GGBDRN COc1ccc(C(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000108454850 1411506413 /nfs/dbraw/zinc/50/64/13/1411506413.db2.gz FWDIIEDMPHBXTJ-IBGZPJMESA-N 0 0 388.395 3.328 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1 ZINC000108456327 1411507988 /nfs/dbraw/zinc/50/79/88/1411507988.db2.gz BJJZMCFLJBLQQI-IBGZPJMESA-N 0 0 388.395 3.328 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000108458953 1411509252 /nfs/dbraw/zinc/50/92/52/1411509252.db2.gz NFOPLGODGIFBCG-FQEVSTJZSA-N 0 0 388.395 3.085 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccnc12 ZINC000108463879 1411510566 /nfs/dbraw/zinc/51/05/66/1411510566.db2.gz AWCGSIGVWXBTEO-UHFFFAOYSA-N 0 0 398.806 3.473 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1cccc2ncccc21 ZINC000108463729 1411510610 /nfs/dbraw/zinc/51/06/10/1411510610.db2.gz BRWAMLQEUIQLAA-UHFFFAOYSA-N 0 0 384.779 3.165 20 5 GGBDRN CCOc1c(Cl)cc(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1OC ZINC000108556873 1411538405 /nfs/dbraw/zinc/53/84/05/1411538405.db2.gz REHWDMOBOJUDAJ-UHFFFAOYSA-N 0 0 379.800 3.168 20 5 GGBDRN CC1CCN(C(=O)C2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000108555841 1411538441 /nfs/dbraw/zinc/53/84/41/1411538441.db2.gz ISFGCTBPLNHOJD-UHFFFAOYSA-N 0 0 393.871 3.359 20 5 GGBDRN Cc1ccc(-c2nnco2)cc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000108610103 1411551360 /nfs/dbraw/zinc/55/13/60/1411551360.db2.gz LWSMLUMYJRBTCW-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN COc1cc(C2(C(=O)OCCn3c(C)ncc3[N+](=O)[O-])CCCC2)ccc1C ZINC000108625018 1411559198 /nfs/dbraw/zinc/55/91/98/1411559198.db2.gz YXXVWDPNWGSFFB-UHFFFAOYSA-N 0 0 387.436 3.472 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCOCc1ccccc1 ZINC000177070464 1428576675 /nfs/dbraw/zinc/57/66/75/1428576675.db2.gz 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1411590505 /nfs/dbraw/zinc/59/05/05/1411590505.db2.gz XUVVHKMHJJQRTN-UHFFFAOYSA-N 0 0 396.407 3.102 20 5 GGBDRN O=C(NC[C@H]1CCOc2ccccc21)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000108735798 1411591981 /nfs/dbraw/zinc/59/19/81/1411591981.db2.gz LZUJBTRLHJXVGJ-MRXNPFEDSA-N 0 0 381.432 3.491 20 5 GGBDRN Cc1c(C(=O)NC[C@H]2CCOc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000108737292 1411592513 /nfs/dbraw/zinc/59/25/13/1411592513.db2.gz CJVOHMXRIIJVFD-CYBMUJFWSA-N 0 0 385.376 3.416 20 5 GGBDRN CC(C)N(Cc1cccnc1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000108740331 1411593655 /nfs/dbraw/zinc/59/36/55/1411593655.db2.gz MVJUDGRITIHPTK-UHFFFAOYSA-N 0 0 398.419 3.115 20 5 GGBDRN O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)N(c1ccccc1)C1CCCC1 ZINC000108745212 1411596041 /nfs/dbraw/zinc/59/60/41/1411596041.db2.gz PGXMDSROKIGNRG-UHFFFAOYSA-N 0 0 395.415 3.296 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1C(=O)NC(C)C ZINC000108762549 1411602472 /nfs/dbraw/zinc/60/24/72/1411602472.db2.gz MIJWWARWIFJPGQ-UHFFFAOYSA-N 0 0 391.449 3.151 20 5 GGBDRN O=C(COC(=O)c1ccc(NC2CC2)nc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000108799055 1411615099 /nfs/dbraw/zinc/61/50/99/1411615099.db2.gz QLKLNTBNAFSRJW-UHFFFAOYSA-N 0 0 390.783 3.013 20 5 GGBDRN O=C(NC[C@H]1CCOc2ccccc21)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000108824371 1411624289 /nfs/dbraw/zinc/62/42/89/1411624289.db2.gz NTZHSDCQQJADBL-OAHLLOKOSA-N 0 0 381.432 3.491 20 5 GGBDRN CC(C)c1nc2c(n1C)CCN(c1ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c1)C2 ZINC000108952453 1411648215 /nfs/dbraw/zinc/64/82/15/1411648215.db2.gz FVAMASYBQBINHG-UHFFFAOYSA-N 0 0 397.479 3.250 20 5 GGBDRN Cc1oc(-c2cnn(C)c2)nc1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000177088836 1428583737 /nfs/dbraw/zinc/58/37/37/1428583737.db2.gz SOPZHYJBDIWFIO-UHFFFAOYSA-N 0 0 383.408 3.044 20 5 GGBDRN CC(C)(C)OC(=O)NC(C)(C)c1noc(COc2ccc([N+](=O)[O-])cc2F)n1 ZINC000108964282 1411650266 /nfs/dbraw/zinc/65/02/66/1411650266.db2.gz KIRHGRGRANBCDT-UHFFFAOYSA-N 0 0 396.375 3.456 20 5 GGBDRN O=C(Nc1cccc(CN2CCOCC2)c1)c1cc([N+](=O)[O-])ccc1Cl ZINC000108999889 1411658425 /nfs/dbraw/zinc/65/84/25/1411658425.db2.gz MABYSDYROKABQN-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)Nc2ccc(C(F)(F)F)cc2)cc([N+](=O)[O-])c1 ZINC000109024970 1411664555 /nfs/dbraw/zinc/66/45/55/1411664555.db2.gz NMJFTCFQDCNYNA-UHFFFAOYSA-N 0 0 388.323 3.269 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1cccc2ccccc21 ZINC000109029978 1411666763 /nfs/dbraw/zinc/66/67/63/1411666763.db2.gz IQZKINDIIHWCQP-UHFFFAOYSA-N 0 0 384.413 3.428 20 5 GGBDRN C[C@H](C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1F ZINC000109039455 1411669853 /nfs/dbraw/zinc/66/98/53/1411669853.db2.gz WGDKNHCXSAVFEN-NSHDSACASA-N 0 0 394.786 3.464 20 5 GGBDRN C[C@@H](C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1F ZINC000109039458 1411669876 /nfs/dbraw/zinc/66/98/76/1411669876.db2.gz WGDKNHCXSAVFEN-LLVKDONJSA-N 0 0 394.786 3.464 20 5 GGBDRN Cc1nn(C)c2ncc(/C=C3/N=C(c4c(Cl)cccc4[N+](=O)[O-])OC3=O)cc12 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COc1ccc([C@@H](NC(=O)CCn2cc([N+](=O)[O-])nc2C)c2ccccc2)cc1 ZINC000109189134 1411708140 /nfs/dbraw/zinc/70/81/40/1411708140.db2.gz YTJNKACHFAXZQK-NRFANRHFSA-N 0 0 394.431 3.404 20 5 GGBDRN COc1ccc(Cn2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)cn2)cc1 ZINC000109203878 1411712019 /nfs/dbraw/zinc/71/20/19/1411712019.db2.gz TVHDIDYNEHTMBE-UHFFFAOYSA-N 0 0 378.388 3.051 20 5 GGBDRN Cc1cc(C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)ccc1[N+](=O)[O-] ZINC000109211613 1411714883 /nfs/dbraw/zinc/71/48/83/1411714883.db2.gz KMWPUCNIJFYOCJ-ZDUSSCGKSA-N 0 0 375.375 3.438 20 5 GGBDRN Cc1cc(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2F)cc([N+](=O)[O-])c1 ZINC000109213439 1411715267 /nfs/dbraw/zinc/71/52/67/1411715267.db2.gz HGLAPETZGFDJAS-MRXNPFEDSA-N 0 0 389.408 3.196 20 5 GGBDRN Cc1cc(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2F)cc([N+](=O)[O-])c1 ZINC000109213442 1411715569 /nfs/dbraw/zinc/71/55/69/1411715569.db2.gz HGLAPETZGFDJAS-INIZCTEOSA-N 0 0 389.408 3.196 20 5 GGBDRN Cc1ccccc1NC(=O)[C@@H]1CSCN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000109214986 1411716157 /nfs/dbraw/zinc/71/61/57/1411716157.db2.gz GLRISAHZBXHPDC-MZEUMTGBSA-N 0 0 397.456 3.457 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(CN(Cc3ccccc3)C[C@@H]3CCCO3)n2)cc1 ZINC000109215186 1411717249 /nfs/dbraw/zinc/71/72/49/1411717249.db2.gz QYUYKQYZVKRPKB-FQEVSTJZSA-N 0 0 393.447 3.492 20 5 GGBDRN Cc1ccccc1NC(=O)[C@@H]1CSCN1C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000109215451 1411717588 /nfs/dbraw/zinc/71/75/88/1411717588.db2.gz XGZFRUFZGPCSDB-INIZCTEOSA-N 0 0 389.408 3.196 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(CN(Cc3ccccc3)C[C@H]3CCCO3)n2)cc1 ZINC000109215188 1411717607 /nfs/dbraw/zinc/71/76/07/1411717607.db2.gz QYUYKQYZVKRPKB-HXUWFJFHSA-N 0 0 393.447 3.492 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000109216713 1411717948 /nfs/dbraw/zinc/71/79/48/1411717948.db2.gz JQQBQOLVNOXJQB-INIZCTEOSA-N 0 0 389.408 3.196 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1cccc(COCc2ccco2)c1 ZINC000109219290 1411717987 /nfs/dbraw/zinc/71/79/87/1411717987.db2.gz HTLJUPJWBRNMAL-UHFFFAOYSA-N 0 0 398.419 3.116 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000109216889 1411718201 /nfs/dbraw/zinc/71/82/01/1411718201.db2.gz XQFAUBDODVHWRB-MRXNPFEDSA-N 0 0 389.408 3.196 20 5 GGBDRN O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000109223646 1411719412 /nfs/dbraw/zinc/71/94/12/1411719412.db2.gz ZOZCOIJMQRNSAN-FQEVSTJZSA-N 0 0 387.399 3.245 20 5 GGBDRN CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)c1ccccc1C(F)(F)F ZINC000109226782 1411720311 /nfs/dbraw/zinc/72/03/11/1411720311.db2.gz CBGOBVXYBNBYEU-HNNXBMFYSA-N 0 0 383.326 3.119 20 5 GGBDRN CCOC(=O)/C=C/c1ccc(N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000177108808 1428590336 /nfs/dbraw/zinc/59/03/36/1428590336.db2.gz HKIGCNILVIWGKT-UFUQCMIWSA-N 0 0 395.415 3.389 20 5 GGBDRN CC[C@@H]1CCc2nc(NC(=O)COc3ccc(C=O)cc3[N+](=O)[O-])sc2C1 ZINC000109258462 1411727458 /nfs/dbraw/zinc/72/74/58/1411727458.db2.gz GZSANTYLERIBOG-LLVKDONJSA-N 0 0 389.433 3.396 20 5 GGBDRN 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ZINC000109326815 1411741816 /nfs/dbraw/zinc/74/18/16/1411741816.db2.gz DMJCVNWLGMMTOR-UONOGXRCSA-N 0 0 385.420 3.420 20 5 GGBDRN CC(C)(NC(=O)Nc1cnn(Cc2ccccn2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000177115050 1428591729 /nfs/dbraw/zinc/59/17/29/1428591729.db2.gz SRYWIVZXDSBGAO-UHFFFAOYSA-N 0 0 380.408 3.291 20 5 GGBDRN Cc1ccc(-n2cnnc2SCC(=O)OCc2cccc([N+](=O)[O-])c2)cc1 ZINC000109330450 1411743163 /nfs/dbraw/zinc/74/31/63/1411743163.db2.gz NHQZUAAXLSXVRG-UHFFFAOYSA-N 0 0 384.417 3.319 20 5 GGBDRN CSCc1ccc(C(=O)N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000109334813 1411743806 /nfs/dbraw/zinc/74/38/06/1411743806.db2.gz YBXFBAAFOJPENM-UHFFFAOYSA-N 0 0 385.489 3.416 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCCc3cc(OC(F)F)ccc32)cc1 ZINC000109340096 1411744584 /nfs/dbraw/zinc/74/45/84/1411744584.db2.gz ODMNMHSRCLXDJW-UHFFFAOYSA-N 0 0 398.387 3.479 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 ZINC000177116747 1428591940 /nfs/dbraw/zinc/59/19/40/1428591940.db2.gz 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IZGDYYIVJAUBLV-CZUORRHYSA-N 0 0 399.472 3.486 20 5 GGBDRN Cc1cccc2c1CC[C@H]2NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110302172 1411843309 /nfs/dbraw/zinc/84/33/09/1411843309.db2.gz KHMNGRAXKOUAGP-HZPDHXFCSA-N 0 0 399.472 3.373 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1C(=O)N1CCCc2ccccc2C1 ZINC000110305665 1411843421 /nfs/dbraw/zinc/84/34/21/1411843421.db2.gz MXARNJCWPMINDE-MRXNPFEDSA-N 0 0 399.472 3.236 20 5 GGBDRN CC[C@H](C)CN(C)C(=O)c1ccc(I)c([N+](=O)[O-])c1 ZINC000110328924 1411845180 /nfs/dbraw/zinc/84/51/80/1411845180.db2.gz IZXWWWYIXYTOKF-VIFPVBQESA-N 0 0 376.194 3.318 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2Cl)C1=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000110335046 1411845234 /nfs/dbraw/zinc/84/52/34/1411845234.db2.gz YKPYIGXXJWWPQM-ZDUSSCGKSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2Cl)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110335053 1411845361 /nfs/dbraw/zinc/84/53/61/1411845361.db2.gz VVCLFTKXRYFHBL-LBPRGKRZSA-N 0 0 394.214 3.437 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2Cl)C1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000110335745 1411845697 /nfs/dbraw/zinc/84/56/97/1411845697.db2.gz TZAIICXUBDUCIE-CYBMUJFWSA-N 0 0 394.214 3.437 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nc(-c2ccccc2Cl)ns1 ZINC000110382094 1411847912 /nfs/dbraw/zinc/84/79/12/1411847912.db2.gz JTAJUQKTYLULOH-UHFFFAOYSA-N 0 0 392.828 3.300 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000110419408 1411849826 /nfs/dbraw/zinc/84/98/26/1411849826.db2.gz URFMQSSVKXIZTG-LAPQFRIASA-N 0 0 388.395 3.490 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000110419403 1411849922 /nfs/dbraw/zinc/84/99/22/1411849922.db2.gz URFMQSSVKXIZTG-CKNLXJGOSA-N 0 0 388.395 3.490 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000110419763 1411849935 /nfs/dbraw/zinc/84/99/35/1411849935.db2.gz VSNQGRFPCMGDQH-VBHSOAQHSA-N 0 0 385.376 3.494 20 5 GGBDRN 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DETXFYMHWUKXDF-INIZCTEOSA-N 0 0 391.786 3.265 20 5 GGBDRN CN(C(=O)c1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000110914546 1411876856 /nfs/dbraw/zinc/87/68/56/1411876856.db2.gz DETXFYMHWUKXDF-MRXNPFEDSA-N 0 0 391.786 3.265 20 5 GGBDRN CCOCCN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000110920814 1411877448 /nfs/dbraw/zinc/87/74/48/1411877448.db2.gz YOZOCSALKQPTAO-UHFFFAOYSA-N 0 0 399.447 3.181 20 5 GGBDRN Cc1c(C(=O)Nc2cccc([S@@](C)=O)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000110931559 1411877653 /nfs/dbraw/zinc/87/76/53/1411877653.db2.gz ZYJSPQGCDLYCOZ-SANMLTNESA-N 0 0 377.378 3.110 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000110970018 1411879636 /nfs/dbraw/zinc/87/96/36/1411879636.db2.gz JNTJUQRDBZOXJV-UHFFFAOYSA-N 0 0 385.399 3.126 20 5 GGBDRN CNC(=O)[C@H]1CCCN(C(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)C1 ZINC000110986596 1411880728 /nfs/dbraw/zinc/88/07/28/1411880728.db2.gz UUSKVQCCXXWJJX-HNNXBMFYSA-N 0 0 393.509 3.331 20 5 GGBDRN CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C[C@H](C)O1 ZINC000111003967 1411881724 /nfs/dbraw/zinc/88/17/24/1411881724.db2.gz LGUHTERURYHTOQ-RDJZCZTQSA-N 0 0 375.469 3.471 20 5 GGBDRN CC[C@H]1CN(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)C[C@H](C)O1 ZINC000111017114 1411882284 /nfs/dbraw/zinc/88/22/84/1411882284.db2.gz QDIDNKZXZISZGM-UGSOOPFHSA-N 0 0 386.452 3.096 20 5 GGBDRN CNc1ccc([N+](=O)[O-])cc1C(=O)NCCCOc1cccc2cccnc21 ZINC000111022087 1411882600 /nfs/dbraw/zinc/88/26/00/1411882600.db2.gz WEEYBYQCKIXIIR-UHFFFAOYSA-N 0 0 380.404 3.384 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000111020725 1411882651 /nfs/dbraw/zinc/88/26/51/1411882651.db2.gz UVVNLRQSESWTMJ-DOTOQJQBSA-N 0 0 375.469 3.471 20 5 GGBDRN COCCc1noc(CN(C)C(=O)c2cc3ccccc3c3cccnc23)n1 ZINC000177157186 1428603902 /nfs/dbraw/zinc/60/39/02/1428603902.db2.gz RCBYZFRSBULPSQ-UHFFFAOYSA-N 0 0 376.416 3.232 20 5 GGBDRN CCc1nc(CN2CCC(CNC(=O)c3ccccc3[N+](=O)[O-])CC2)cs1 ZINC000111044723 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ZINC000111642268 1412006347 /nfs/dbraw/zinc/00/63/47/1412006347.db2.gz RFQZJROPPGIHNG-CQSZACIVSA-N 0 0 385.203 3.374 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](O)c2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000111642800 1412006958 /nfs/dbraw/zinc/00/69/58/1412006958.db2.gz YYADSBYNOYKQBD-CQSZACIVSA-N 0 0 385.203 3.374 20 5 GGBDRN CCC(CC)[C@@H](O)CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000111653387 1412008085 /nfs/dbraw/zinc/00/80/85/1412008085.db2.gz FHRIQTGTYBVXHB-AWEZNQCLSA-N 0 0 378.347 3.063 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(O)c(Cl)c1 ZINC000111668453 1412011031 /nfs/dbraw/zinc/01/10/31/1412011031.db2.gz ROUWFSYVAVVQSZ-UHFFFAOYSA-N 0 0 391.767 3.281 20 5 GGBDRN O=C(NCCCNC(=O)c1ccc(F)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000111706359 1412013778 /nfs/dbraw/zinc/01/37/78/1412013778.db2.gz RJFAQIOPFAWBET-UHFFFAOYSA-N 0 0 394.790 3.329 20 5 GGBDRN Cc1c(NC(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)cccc1[N+](=O)[O-] ZINC000111707155 1412013796 /nfs/dbraw/zinc/01/37/96/1412013796.db2.gz 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O=[N+]([O-])c1c(Sc2nnc(N3CCOCC3)n2C2CC2)ccc2ncccc21 ZINC000112073633 1412073584 /nfs/dbraw/zinc/07/35/84/1412073584.db2.gz XZOUPHOJRTZQGN-UHFFFAOYSA-N 0 0 398.448 3.057 20 5 GGBDRN CNS(=O)(=O)c1ccc([C@H](C)Nc2ccc3ncccc3c2[N+](=O)[O-])cc1 ZINC000112076210 1412074003 /nfs/dbraw/zinc/07/40/03/1412074003.db2.gz BNSDPWHOXXILJT-LBPRGKRZSA-N 0 0 386.433 3.224 20 5 GGBDRN COc1c(Br)c([N+](=O)[O-])c(NCc2nccs2)cc1[N+](=O)[O-] ZINC000112074581 1412074161 /nfs/dbraw/zinc/07/41/61/1412074161.db2.gz BFQAGAPXNRFQPW-UHFFFAOYSA-N 0 0 389.187 3.343 20 5 GGBDRN CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000112171300 1412087224 /nfs/dbraw/zinc/08/72/24/1412087224.db2.gz KAVGBFLBVZQOMY-BEFAXECRSA-N 0 0 383.448 3.300 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1)c1cccc([N+](=O)[O-])c1 ZINC000112171308 1412087277 /nfs/dbraw/zinc/08/72/77/1412087277.db2.gz JZBREDWFYMKLJR-DYZYQPBXSA-N 0 0 375.331 3.243 20 5 GGBDRN CCOc1cc(C(=O)NCCc2ccc(F)cc2F)c([N+](=O)[O-])cc1OC ZINC000112186008 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COCC1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC1 ZINC000112317049 1412130911 /nfs/dbraw/zinc/13/09/11/1412130911.db2.gz YOZYFFNXQNZQSY-UHFFFAOYSA-N 0 0 375.469 3.330 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCS[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000177196713 1428626158 /nfs/dbraw/zinc/62/61/58/1428626158.db2.gz BNLQWECCHLCBBH-DOTOQJQBSA-N 0 0 379.482 3.292 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCN(c2ccccc2F)C1=O ZINC000112386712 1412137444 /nfs/dbraw/zinc/13/74/44/1412137444.db2.gz SXDKXPGHDPFSTQ-AWEZNQCLSA-N 0 0 392.774 3.314 20 5 GGBDRN Cc1ccccc1[C@H](O)CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000112396973 1412140269 /nfs/dbraw/zinc/14/02/69/1412140269.db2.gz KYTGNKMIFXIWFK-QGZVFWFLSA-N 0 0 383.429 3.490 20 5 GGBDRN Cc1ccccc1[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000112398428 1412140698 /nfs/dbraw/zinc/14/06/98/1412140698.db2.gz HFEMQAFRVOMTEH-HXUWFJFHSA-N 0 0 383.448 3.357 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c(N)c([N+](=O)[O-])c1 ZINC000112402323 1412141539 /nfs/dbraw/zinc/14/15/39/1412141539.db2.gz NSOPNMJZHFYMFA-UHFFFAOYSA-N 0 0 391.449 3.061 20 5 GGBDRN CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000112404645 1412141986 /nfs/dbraw/zinc/14/19/86/1412141986.db2.gz JSRWNLRCCMHPNI-KRWDZBQOSA-N 0 0 387.461 3.014 20 5 GGBDRN CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1nc2ccccc2n1C ZINC000177197573 1428626701 /nfs/dbraw/zinc/62/67/01/1428626701.db2.gz PVLFQPGYKSOCQE-UHFFFAOYSA-N 0 0 378.392 3.164 20 5 GGBDRN COC(=O)[C@@]1(C)CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000177199990 1428627621 /nfs/dbraw/zinc/62/76/21/1428627621.db2.gz CJTXBKIWKNZDIY-FQEVSTJZSA-N 0 0 383.404 3.364 20 5 GGBDRN CCc1cc(N2CCC[C@H](NC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)ncn1 ZINC000112507951 1412159420 /nfs/dbraw/zinc/15/94/20/1412159420.db2.gz OKRKZGIWSHRDKJ-HNNXBMFYSA-N 0 0 384.440 3.046 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)COc1nc(Cc2ccc(F)cc2)no1 ZINC000112562624 1412168854 /nfs/dbraw/zinc/16/88/54/1412168854.db2.gz QJAHYAJTJQGSJQ-UHFFFAOYSA-N 0 0 386.339 3.034 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1C(=O)NC(C)C ZINC000112573403 1412170469 /nfs/dbraw/zinc/17/04/69/1412170469.db2.gz QKJSJASCFGYUMD-UHFFFAOYSA-N 0 0 386.364 3.202 20 5 GGBDRN CCOc1ccc2c(c1)CN([C@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)CC2 ZINC000112580687 1412172039 /nfs/dbraw/zinc/17/20/39/1412172039.db2.gz FYORHZMBVYHXCT-FQEVSTJZSA-N 0 0 381.432 3.157 20 5 GGBDRN CCN1C(=S)N=NC1[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000112596411 1412176335 /nfs/dbraw/zinc/17/63/35/1412176335.db2.gz QMOWXESDORDMRZ-SNVBAGLBSA-N 0 0 395.872 3.168 20 5 GGBDRN Cc1csc(C2(NC(=O)c3cn(-c4cccc([N+](=O)[O-])c4)nn3)CCCC2)n1 ZINC000112597774 1412176707 /nfs/dbraw/zinc/17/67/07/1412176707.db2.gz XKZYXAXCSZQERD-UHFFFAOYSA-N 0 0 398.448 3.140 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H](C)CC1CC1 ZINC000112604894 1412178010 /nfs/dbraw/zinc/17/80/10/1412178010.db2.gz SKJISVPQSYSNMN-ZBEGNZNMSA-N 0 0 381.860 3.307 20 5 GGBDRN C[C@H](ONC(=O)Cc1cccc2ccccc21)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000112627816 1412180424 /nfs/dbraw/zinc/18/04/24/1412180424.db2.gz VRHCSJKUHYRULD-AWEZNQCLSA-N 0 0 393.399 3.366 20 5 GGBDRN CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)Cn2ccc([N+](=O)[O-])n2)cc1 ZINC000112641243 1412184953 /nfs/dbraw/zinc/18/49/53/1412184953.db2.gz RZLCMMBNISORJU-NRFANRHFSA-N 0 0 393.447 3.387 20 5 GGBDRN CCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@@H](c1ccc(C)cc1)c1cccnc1 ZINC000112643441 1412185679 /nfs/dbraw/zinc/18/56/79/1412185679.db2.gz BGXLMIHTJJEPAC-NRFANRHFSA-N 0 0 393.447 3.441 20 5 GGBDRN CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H](c1ccc(Cl)cc1)c1cccnc1 ZINC000112646194 1412186098 /nfs/dbraw/zinc/18/60/98/1412186098.db2.gz MWGBPOHXGCUNGT-LJQANCHMSA-N 0 0 399.838 3.478 20 5 GGBDRN CCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@H](c1ccc(C)cc1)c1cccnc1 ZINC000112643443 1412186114 /nfs/dbraw/zinc/18/61/14/1412186114.db2.gz BGXLMIHTJJEPAC-OAQYLSRUSA-N 0 0 393.447 3.441 20 5 GGBDRN CSc1ccc(C(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000112677554 1412191088 /nfs/dbraw/zinc/19/10/88/1412191088.db2.gz GKRKISIBPMSDSH-CYBMUJFWSA-N 0 0 393.509 3.331 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC(C)(C)C1 ZINC000112685902 1412192343 /nfs/dbraw/zinc/19/23/43/1412192343.db2.gz VEJBGPOBAHEXTF-MRXNPFEDSA-N 0 0 393.509 3.095 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N(C)CCN2CCCC2=O)cc1[N+](=O)[O-] ZINC000112687600 1412193237 /nfs/dbraw/zinc/19/32/37/1412193237.db2.gz ZCWRSNFHFWRGAJ-UHFFFAOYSA-N 0 0 393.509 3.427 20 5 GGBDRN COc1ccc(S(=O)(=O)NC2(c3nc(C)cs3)CCCC2)cc1[N+](=O)[O-] ZINC000112707316 1412200264 /nfs/dbraw/zinc/20/02/64/1412200264.db2.gz YLWAWVRXISNMHE-UHFFFAOYSA-N 0 0 397.478 3.116 20 5 GGBDRN CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000112727231 1412204582 /nfs/dbraw/zinc/20/45/82/1412204582.db2.gz RZUDJRLQOQUQFU-LBPRGKRZSA-N 0 0 381.860 3.263 20 5 GGBDRN Nc1c(C(=O)Nc2nc(-c3ccc(F)cc3)ns2)cc(F)cc1[N+](=O)[O-] ZINC000112727731 1412204744 /nfs/dbraw/zinc/20/47/44/1412204744.db2.gz WBBLGNDALTXKNB-UHFFFAOYSA-N 0 0 377.332 3.226 20 5 GGBDRN Cc1c(NC(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000112733380 1412205250 /nfs/dbraw/zinc/20/52/50/1412205250.db2.gz YIQLRJFEDZDEGU-CQSZACIVSA-N 0 0 376.457 3.309 20 5 GGBDRN C[C@H](NC(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000112744629 1412208856 /nfs/dbraw/zinc/20/88/56/1412208856.db2.gz QUMLNJSLODZGEH-LSDHHAIUSA-N 0 0 390.484 3.240 20 5 GGBDRN C[C@H](Sc1nccn1Cc1ccccn1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000112771639 1412214775 /nfs/dbraw/zinc/21/47/75/1412214775.db2.gz NLGAJWYVLLTWLA-ZDUSSCGKSA-N 0 0 383.433 3.354 20 5 GGBDRN O=C1[C@H](Sc2nccn2Cc2ccccn2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000112772647 1412215456 /nfs/dbraw/zinc/21/54/56/1412215456.db2.gz ZRQMMLVPXUDCLY-QGZVFWFLSA-N 0 0 395.444 3.132 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1ccc(F)cc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000112791898 1412218058 /nfs/dbraw/zinc/21/80/58/1412218058.db2.gz YJZVERUNPVIKEG-ZWKOTPCHSA-N 0 0 387.386 3.325 20 5 GGBDRN CCNc1ccc(C(=O)NCc2cccc(Cn3ccnc3)c2)cc1[N+](=O)[O-] ZINC000112813291 1412220554 /nfs/dbraw/zinc/22/05/54/1412220554.db2.gz ANMJTXJAPKFEBC-UHFFFAOYSA-N 0 0 379.420 3.201 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(Cl)nn1 ZINC000112810326 1412220803 /nfs/dbraw/zinc/22/08/03/1412220803.db2.gz IRSYNTFKXIFBOO-UHFFFAOYSA-N 0 0 389.721 3.498 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000112836186 1412223322 /nfs/dbraw/zinc/22/33/22/1412223322.db2.gz NYRSARUIAHDVKD-BZPMIXESSA-N 0 0 389.481 3.429 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C[C@H](C)N1C(=O)OC(C)(C)C ZINC000112843337 1412224279 /nfs/dbraw/zinc/22/42/79/1412224279.db2.gz AAZWEQJMUZJBJR-QWRGUYRKSA-N 0 0 399.394 3.343 20 5 GGBDRN Cc1cc(=O)c(C(=O)Nc2ccc3[nH]ccc3c2)nn1-c1ccccc1[N+](=O)[O-] ZINC000112862170 1412226890 /nfs/dbraw/zinc/22/68/90/1412226890.db2.gz VMLOSUQKFAIMKT-UHFFFAOYSA-N 0 0 389.371 3.183 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccncc1)Cc1cccnc1 ZINC000112903207 1412234674 /nfs/dbraw/zinc/23/46/74/1412234674.db2.gz YYFPPXKVOGVFTO-UHFFFAOYSA-N 0 0 388.387 3.104 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N(Cc1ccncc1)Cc1cccnc1 ZINC000112903110 1412234740 /nfs/dbraw/zinc/23/47/40/1412234740.db2.gz GDNIUVYXTHNQDY-UHFFFAOYSA-N 0 0 396.378 3.132 20 5 GGBDRN COc1cc(C(=O)N(Cc2ccncc2)Cc2cccnc2)ccc1[N+](=O)[O-] ZINC000112903113 1412234931 /nfs/dbraw/zinc/23/49/31/1412234931.db2.gz FPAMPDCDQMWGCE-UHFFFAOYSA-N 0 0 378.388 3.236 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N(C)[C@H](C)c2cccnc2)c([N+](=O)[O-])c1 ZINC000112965493 1412247659 /nfs/dbraw/zinc/24/76/59/1412247659.db2.gz NCCDAETZUYUJEC-CQSZACIVSA-N 0 0 392.481 3.218 20 5 GGBDRN CCS(=O)(=O)C[C@@H](C)N(C)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000112967986 1412248284 /nfs/dbraw/zinc/24/82/84/1412248284.db2.gz IRYZPUVBASFGKB-CQSZACIVSA-N 0 0 390.461 3.085 20 5 GGBDRN O=C(CN(Cc1cccc(O)c1)CC1CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000112978964 1412250062 /nfs/dbraw/zinc/25/00/62/1412250062.db2.gz XMQVIJUZPKWKSY-UHFFFAOYSA-N 0 0 381.432 3.102 20 5 GGBDRN CN(C)c1ncc(Br)cc1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000113015976 1412255696 /nfs/dbraw/zinc/25/56/96/1412255696.db2.gz IXGUEZZDBJEMQT-UHFFFAOYSA-N 0 0 383.177 3.210 20 5 GGBDRN Cc1ccc(N(C)C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1Cl ZINC000113067896 1412258560 /nfs/dbraw/zinc/25/85/60/1412258560.db2.gz VJOJVTJBSVWTBB-UHFFFAOYSA-N 0 0 375.768 3.128 20 5 GGBDRN O=C(CCNC(=O)c1ccc(Br)c([N+](=O)[O-])c1)Nc1ccccc1 ZINC000113099533 1412262254 /nfs/dbraw/zinc/26/22/54/1412262254.db2.gz VBEGLFJQQUTIBR-UHFFFAOYSA-N 0 0 392.209 3.116 20 5 GGBDRN O=C(CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)Nc1ccccc1 ZINC000113098881 1412262337 /nfs/dbraw/zinc/26/23/37/1412262337.db2.gz AVTRHWJDNCAYSO-UHFFFAOYSA-N 0 0 396.447 3.344 20 5 GGBDRN Cc1ccc(C[C@H]2CCCN2C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000113135705 1412266787 /nfs/dbraw/zinc/26/67/87/1412266787.db2.gz VBWCWYLVAGCGMM-GOSISDBHSA-N 0 0 391.431 3.331 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccnn2-c2ccccc2C)cc([N+](=O)[O-])c1 ZINC000113138719 1412267630 /nfs/dbraw/zinc/26/76/30/1412267630.db2.gz CEYSZWIRLJGPPK-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN Cc1ccc(C[C@@H]2CCCN2C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000113136245 1412267675 /nfs/dbraw/zinc/26/76/75/1412267675.db2.gz NXTOHLDTLSYCRZ-KRWDZBQOSA-N 0 0 391.431 3.331 20 5 GGBDRN C[C@@]1(c2ccccc2)CCCN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)C1 ZINC000113213102 1412277073 /nfs/dbraw/zinc/27/70/73/1412277073.db2.gz SUUKSOMNUXKDBP-OAQYLSRUSA-N 0 0 391.431 3.369 20 5 GGBDRN C[C@]1(c2ccccc2)CCCN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C1 ZINC000113214587 1412277833 /nfs/dbraw/zinc/27/78/33/1412277833.db2.gz IUPDJNMQMAZTCN-NRFANRHFSA-N 0 0 391.431 3.369 20 5 GGBDRN COc1cccc(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1OC1CCCC1 ZINC000113216790 1412278288 /nfs/dbraw/zinc/27/82/88/1412278288.db2.gz SZHOBOWLZGMKJB-UHFFFAOYSA-N 0 0 385.420 3.437 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)CCc1ccc(Cl)cc1 ZINC000113216459 1412278305 /nfs/dbraw/zinc/27/83/05/1412278305.db2.gz GCZAGWBFURJVTA-CYBMUJFWSA-N 0 0 389.839 3.068 20 5 GGBDRN CN(CCc1ccc(Cl)cc1)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000113216434 1412278398 /nfs/dbraw/zinc/27/83/98/1412278398.db2.gz ALUZBUMIZJAOJL-UHFFFAOYSA-N 0 0 376.796 3.141 20 5 GGBDRN Cc1ccc(C[C@H]2CCCN2S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 ZINC000113303292 1412289434 /nfs/dbraw/zinc/28/94/34/1412289434.db2.gz PJNGAADTDHIYJX-OAHLLOKOSA-N 0 0 378.425 3.438 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CNCc3nnc4n3CCCCC4)cs2)c1 ZINC000113314028 1412291541 /nfs/dbraw/zinc/29/15/41/1412291541.db2.gz ZDWXVLRSWJEKBQ-UHFFFAOYSA-N 0 0 384.465 3.326 20 5 GGBDRN O=C(CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1)NCCc1ccccc1 ZINC000113341350 1412294828 /nfs/dbraw/zinc/29/48/28/1412294828.db2.gz OIIYOSYGVNOJHR-UHFFFAOYSA-N 0 0 396.472 3.167 20 5 GGBDRN COc1ccc([C@H](CO)N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000113363379 1412298112 /nfs/dbraw/zinc/29/81/12/1412298112.db2.gz YKDSQCADKARXDY-INIZCTEOSA-N 0 0 379.800 3.454 20 5 GGBDRN C[C@@H](NC(=O)NCC(=O)OCc1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000113381426 1412301458 /nfs/dbraw/zinc/30/14/58/1412301458.db2.gz UIBNMOIPYCKRRT-GFCCVEGCSA-N 0 0 391.811 3.352 20 5 GGBDRN COc1cc2[nH]c(CCCNC(=O)Cc3cccc([N+](=O)[O-])c3)cc2c(OC)c1 ZINC000177225290 1428640338 /nfs/dbraw/zinc/64/03/38/1428640338.db2.gz LXCZOJBZNQWCGR-UHFFFAOYSA-N 0 0 397.431 3.385 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1C[C@@H]1c1ccc(F)cc1F ZINC000113429301 1412305865 /nfs/dbraw/zinc/30/58/65/1412305865.db2.gz KRFBKDLDMSQRHD-KGLIPLIRSA-N 0 0 385.330 3.400 20 5 GGBDRN CN(CCc1ccc(Cl)cc1)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000113443500 1412306432 /nfs/dbraw/zinc/30/64/32/1412306432.db2.gz SZUVXSLKPNTDKL-UHFFFAOYSA-N 0 0 385.807 3.404 20 5 GGBDRN O=C(OCc1cc2ccccc2[nH]c1=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000113466091 1412307961 /nfs/dbraw/zinc/30/79/61/1412307961.db2.gz QDLGQIAMORJNGL-UHFFFAOYSA-N 0 0 393.399 3.394 20 5 GGBDRN COc1cc2[nH]c(CCCNC(=O)c3cccc([N+](=O)[O-])c3)cc2c(OC)c1 ZINC000177227435 1428640993 /nfs/dbraw/zinc/64/09/93/1428640993.db2.gz PSRLCOSCQWXLJI-UHFFFAOYSA-N 0 0 383.404 3.456 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C[C@@H]3CCOC3)cc2[N+](=O)[O-])C1 ZINC000177226875 1428641146 /nfs/dbraw/zinc/64/11/46/1428641146.db2.gz BPTUUEWVZFCQCI-OAGGEKHMSA-N 0 0 375.469 3.186 20 5 GGBDRN COc1cc2[nH]c(CCCNC(=O)c3ccc([N+](=O)[O-])cc3)cc2c(OC)c1 ZINC000177229943 1428642342 /nfs/dbraw/zinc/64/23/42/1428642342.db2.gz UUNRBJNXRJQYBA-UHFFFAOYSA-N 0 0 383.404 3.456 20 5 GGBDRN CCCN(CCc1cccc(F)c1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000113649363 1412330269 /nfs/dbraw/zinc/33/02/69/1412330269.db2.gz MAIVJOZIQPIBLL-UHFFFAOYSA-N 0 0 387.411 3.462 20 5 GGBDRN CCCN(CCc1cccc(F)c1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000113649411 1412330413 /nfs/dbraw/zinc/33/04/13/1412330413.db2.gz NOKDSQWICWAIKF-UHFFFAOYSA-N 0 0 387.411 3.462 20 5 GGBDRN C[C@H]1CCCC[C@H]1OCC(=O)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000113659635 1412331963 /nfs/dbraw/zinc/33/19/63/1412331963.db2.gz HWQVOUNYQQLFLK-MAUKXSAKSA-N 0 0 391.468 3.345 20 5 GGBDRN Cc1nn(Cc2ccc(-c3nc(C4CCOCC4)no3)cc2)c(C)c1[N+](=O)[O-] ZINC000113755322 1412340035 /nfs/dbraw/zinc/34/00/35/1412340035.db2.gz ULYWDPRAQPEYCA-UHFFFAOYSA-N 0 0 383.408 3.400 20 5 GGBDRN Cc1cc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)n(C(C)(C)C)n1 ZINC000113775088 1412342240 /nfs/dbraw/zinc/34/22/40/1412342240.db2.gz JKQVTTOVSUYLQZ-UHFFFAOYSA-N 0 0 382.424 3.357 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000113775237 1412342284 /nfs/dbraw/zinc/34/22/84/1412342284.db2.gz IFCVWEDQQYMHAJ-UHFFFAOYSA-N 0 0 381.348 3.314 20 5 GGBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)NCCc1c(F)cccc1F ZINC000113775378 1412342346 /nfs/dbraw/zinc/34/23/46/1412342346.db2.gz BAFXBDIRUXJBFN-UHFFFAOYSA-N 0 0 386.358 3.095 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2c(C)noc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000113834644 1412344364 /nfs/dbraw/zinc/34/43/64/1412344364.db2.gz VKSFMLCUSLYJKX-SSDOTTSWSA-N 0 0 385.323 3.301 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)c1[N+](=O)[O-] ZINC000113854330 1412346002 /nfs/dbraw/zinc/34/60/02/1412346002.db2.gz OCJNHUMOIMLIMN-UHFFFAOYSA-N 0 0 392.721 3.484 20 5 GGBDRN O=C(Nc1ccc2c(c1)CC(=O)N2)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000113905139 1412349145 /nfs/dbraw/zinc/34/91/45/1412349145.db2.gz HNQYJAOEQAYQQZ-UHFFFAOYSA-N 0 0 395.293 3.283 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)CC(=O)N2 ZINC000113905375 1412349178 /nfs/dbraw/zinc/34/91/78/1412349178.db2.gz GPVLXFBYUZSWLB-SECBINFHSA-N 0 0 375.768 3.149 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)CC(=O)N2 ZINC000113905374 1412349362 /nfs/dbraw/zinc/34/93/62/1412349362.db2.gz GPVLXFBYUZSWLB-VIFPVBQESA-N 0 0 375.768 3.149 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC1(c2ccccc2)CCCC1 ZINC000113914789 1412351520 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0 391.449 3.000 20 5 GGBDRN CC(C)[C@H](C)N(CC(F)(F)F)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000114268437 1412399187 /nfs/dbraw/zinc/39/91/87/1412399187.db2.gz GZHAXGYYOKVAPJ-NSHDSACASA-N 0 0 385.346 3.225 20 5 GGBDRN CN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000114282544 1412401667 /nfs/dbraw/zinc/40/16/67/1412401667.db2.gz MFRFVSCZNYQJLW-GOSISDBHSA-N 0 0 376.416 3.410 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1OC ZINC000114287202 1412403118 /nfs/dbraw/zinc/40/31/18/1412403118.db2.gz UXFNIVWLUJHOMP-LLVKDONJSA-N 0 0 391.399 3.308 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1OC ZINC000114287199 1412403540 /nfs/dbraw/zinc/40/35/40/1412403540.db2.gz UXFNIVWLUJHOMP-NSHDSACASA-N 0 0 391.399 3.308 20 5 GGBDRN CCOc1cc(CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)ccc1OC ZINC000114293456 1412404698 /nfs/dbraw/zinc/40/46/98/1412404698.db2.gz SMOMJQWAKZPWRI-UHFFFAOYSA-N 0 0 396.403 3.118 20 5 GGBDRN CCOc1cc(CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)ccc1OC ZINC000114293471 1412405031 /nfs/dbraw/zinc/40/50/31/1412405031.db2.gz ZXJSYCMGZKRHAD-UHFFFAOYSA-N 0 0 396.403 3.118 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCCOc1cccnc1 ZINC000114299398 1412405391 /nfs/dbraw/zinc/40/53/91/1412405391.db2.gz SCQNSEHPNVSSBO-UHFFFAOYSA-N 0 0 398.341 3.006 20 5 GGBDRN CC[C@@H]1c2ccccc2CCN1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000114304179 1412407857 /nfs/dbraw/zinc/40/78/57/1412407857.db2.gz ZJDAZOXQDBOPGH-MRXNPFEDSA-N 0 0 381.388 3.039 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(-c3nc[nH]n3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000114393156 1412426317 /nfs/dbraw/zinc/42/63/17/1412426317.db2.gz TZWCWRSVWBLYLD-UHFFFAOYSA-N 0 0 382.336 3.157 20 5 GGBDRN CC(C)[C@@](C)(CNC(=O)OC(C)(C)C)NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000114416510 1412428744 /nfs/dbraw/zinc/42/87/44/1412428744.db2.gz JIFHBKLKPWDUMH-GOSISDBHSA-N 0 0 383.420 3.403 20 5 GGBDRN CC(C)[C@](C)(CNC(=O)OC(C)(C)C)NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000114416512 1412429081 /nfs/dbraw/zinc/42/90/81/1412429081.db2.gz JIFHBKLKPWDUMH-SFHVURJKSA-N 0 0 383.420 3.403 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000114418306 1412429669 /nfs/dbraw/zinc/42/96/69/1412429669.db2.gz DBAMHWYHAOKLOY-SECBINFHSA-N 0 0 388.355 3.118 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000114418305 1412429797 /nfs/dbraw/zinc/42/97/97/1412429797.db2.gz DBAMHWYHAOKLOY-VIFPVBQESA-N 0 0 388.355 3.118 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(CCO)[C@H]1CCCc2ccccc21 ZINC000114468415 1412440153 /nfs/dbraw/zinc/44/01/53/1412440153.db2.gz JFLFXEGZUJGKPS-SFHVURJKSA-N 0 0 383.448 3.214 20 5 GGBDRN COc1cc(F)c([C@H](C)N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1OC ZINC000114501634 1412447368 /nfs/dbraw/zinc/44/73/68/1412447368.db2.gz NUFSDOLGFRJLOQ-RYUDHWBXSA-N 0 0 391.399 3.429 20 5 GGBDRN Cc1noc(COc2ccc(N[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)cc2)n1 ZINC000114502405 1412447380 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MGHVMCVJZPAQGQ-NRFANRHFSA-N 0 0 383.448 3.223 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@](C)(O)c1ccccc1 ZINC000114549604 1412457758 /nfs/dbraw/zinc/45/77/58/1412457758.db2.gz VWDQLOCKNHGXMJ-SGTLLEGYSA-N 0 0 378.812 3.039 20 5 GGBDRN C[C@](O)(CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1 ZINC000114549306 1412457864 /nfs/dbraw/zinc/45/78/64/1412457864.db2.gz CPSQEIAFJRORLL-DEOSSOPVSA-N 0 0 386.451 3.179 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@](C)(O)c1ccccc1 ZINC000114549608 1412458168 /nfs/dbraw/zinc/45/81/68/1412458168.db2.gz VWDQLOCKNHGXMJ-KPZWWZAWSA-N 0 0 378.812 3.039 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NC[C@@](C)(O)c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000114550425 1412458232 /nfs/dbraw/zinc/45/82/32/1412458232.db2.gz RMNYYMBQPANFAF-JOCHJYFZSA-N 0 0 397.475 3.469 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@](C)(O)c1ccc(F)cc1F ZINC000114553283 1412459270 /nfs/dbraw/zinc/45/92/70/1412459270.db2.gz OSOHMDOVXJXJFN-VOJFVSQTSA-N 0 0 396.415 3.378 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@](C)(O)c2ccc(F)cc2F)c1 ZINC000114554027 1412460037 /nfs/dbraw/zinc/46/00/37/1412460037.db2.gz DMJOUFYZLWZJFY-QGZVFWFLSA-N 0 0 382.388 3.232 20 5 GGBDRN CN(C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCc2ccccc2C1 ZINC000114609265 1412474144 /nfs/dbraw/zinc/47/41/44/1412474144.db2.gz FXVJOMOOHYKIFJ-AWEZNQCLSA-N 0 0 387.823 3.203 20 5 GGBDRN CN(C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 ZINC000114609818 1412474517 /nfs/dbraw/zinc/47/45/17/1412474517.db2.gz UUWOJHHLOJGDEX-HNNXBMFYSA-N 0 0 387.823 3.203 20 5 GGBDRN CC(=O)N(c1nc(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cs1)C1CC1 ZINC000114632154 1412481688 /nfs/dbraw/zinc/48/16/88/1412481688.db2.gz BJDSSLLIQFCNNY-UHFFFAOYSA-N 0 0 383.433 3.478 20 5 GGBDRN O=C(NCCc1nc(-c2cccc(Cl)c2)no1)c1cc(F)ccc1[N+](=O)[O-] ZINC000114647315 1412486682 /nfs/dbraw/zinc/48/66/82/1412486682.db2.gz BJQXEJQMZKSBCO-UHFFFAOYSA-N 0 0 390.758 3.410 20 5 GGBDRN Cc1oc(C(N)=O)cc1-c1csc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)n1 ZINC000114700501 1412502785 /nfs/dbraw/zinc/50/27/85/1412502785.db2.gz RMERNYZYMRPHAF-UHFFFAOYSA-N 0 0 386.389 3.279 20 5 GGBDRN Cc1oc(C(N)=O)cc1-c1csc(NC(=O)c2cccc(C)c2[N+](=O)[O-])n1 ZINC000114701212 1412503677 /nfs/dbraw/zinc/50/36/77/1412503677.db2.gz VKJKEKMFMQXSRO-UHFFFAOYSA-N 0 0 386.389 3.279 20 5 GGBDRN Cc1oc(C(N)=O)cc1-c1csc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)n1 ZINC000114701378 1412503786 /nfs/dbraw/zinc/50/37/86/1412503786.db2.gz HKUKPVHYTWNINR-UHFFFAOYSA-N 0 0 392.418 3.341 20 5 GGBDRN Cc1ccc([C@@H]2CCCN2C(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)s1 ZINC000114707867 1412506503 /nfs/dbraw/zinc/50/65/03/1412506503.db2.gz TZMDAKAGNQQRDK-BBRMVZONSA-N 0 0 387.461 3.447 20 5 GGBDRN COC(=O)CCCOc1ccc(CNc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000114710340 1412507978 /nfs/dbraw/zinc/50/79/78/1412507978.db2.gz WMLUWXVZBCRPEV-UHFFFAOYSA-N 0 0 390.421 3.248 20 5 GGBDRN Cc1ccc(N[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1OC(F)F ZINC000114756157 1412520177 /nfs/dbraw/zinc/52/01/77/1412520177.db2.gz USTOLOCBZWXQOP-CQSZACIVSA-N 0 0 391.330 3.249 20 5 GGBDRN Cc1ccc(N[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1OC(F)F ZINC000114756159 1412520229 /nfs/dbraw/zinc/52/02/29/1412520229.db2.gz USTOLOCBZWXQOP-AWEZNQCLSA-N 0 0 391.330 3.249 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000114903105 1412544750 /nfs/dbraw/zinc/54/47/50/1412544750.db2.gz BNUDVPXIUADSOR-SNVBAGLBSA-N 0 0 381.339 3.331 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)OCCc2cnn(C)c2)cc1[N+](=O)[O-])c1ccccn1 ZINC000114983072 1412560346 /nfs/dbraw/zinc/56/03/46/1412560346.db2.gz ZTCREWPPRACZQR-AWEZNQCLSA-N 0 0 395.419 3.296 20 5 GGBDRN COc1ccc([C@@H]2[C@H](C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CCC(=O)N2C)cc1 ZINC000115008150 1412565518 /nfs/dbraw/zinc/56/55/18/1412565518.db2.gz NYLIBXANTBLCBO-YLJYHZDGSA-N 0 0 397.431 3.460 20 5 GGBDRN COc1ccc([C@@H]2[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CCC(=O)N2C)cc1 ZINC000115008275 1412565541 /nfs/dbraw/zinc/56/55/41/1412565541.db2.gz APBVTTBBPAACDD-OXQOHEQNSA-N 0 0 397.431 3.460 20 5 GGBDRN COc1ccc([C@@H]2[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1 ZINC000115008119 1412565701 /nfs/dbraw/zinc/56/57/01/1412565701.db2.gz ZFLNLHPRACNPSS-PKOBYXMFSA-N 0 0 383.404 3.152 20 5 GGBDRN COc1ccc([C@H]2[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CCC(=O)N2C)cc1 ZINC000115008331 1412565784 /nfs/dbraw/zinc/56/57/84/1412565784.db2.gz NIKAJGFCNOUCAX-MJGOQNOKSA-N 0 0 383.404 3.152 20 5 GGBDRN COc1ccc([C@H]2[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CCC(=O)N2C)cc1 ZINC000115008335 1412565953 /nfs/dbraw/zinc/56/59/53/1412565953.db2.gz NIKAJGFCNOUCAX-HKUYNNGSSA-N 0 0 383.404 3.152 20 5 GGBDRN CCc1ccccc1OCC(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000115014051 1412568092 /nfs/dbraw/zinc/56/80/92/1412568092.db2.gz RRIZBKQEADHPSB-UHFFFAOYSA-N 0 0 392.795 3.371 20 5 GGBDRN CCC(CC)c1nnc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)s1 ZINC000115078541 1412586156 /nfs/dbraw/zinc/58/61/56/1412586156.db2.gz QYKQKUJMXGPEEK-JTQLQIEISA-N 0 0 391.453 3.107 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000115103955 1412587774 /nfs/dbraw/zinc/58/77/74/1412587774.db2.gz JQTGEGOYFFDUFL-OAHLLOKOSA-N 0 0 384.392 3.210 20 5 GGBDRN CCOc1cc(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000115106597 1412589618 /nfs/dbraw/zinc/58/96/18/1412589618.db2.gz BKWIUSSWIHSBDH-OAHLLOKOSA-N 0 0 399.447 3.401 20 5 GGBDRN Cc1cccnc1[C@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)C(C)C ZINC000115109210 1412590473 /nfs/dbraw/zinc/59/04/73/1412590473.db2.gz YXHLDGPCVANAHG-QGZVFWFLSA-N 0 0 380.408 3.006 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)C(C)C ZINC000115109211 1412590737 /nfs/dbraw/zinc/59/07/37/1412590737.db2.gz YXHLDGPCVANAHG-KRWDZBQOSA-N 0 0 380.408 3.006 20 5 GGBDRN C[C@H](CCC1CCCCC1)NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000115118814 1412591315 /nfs/dbraw/zinc/59/13/15/1412591315.db2.gz CJLDPKZPOWBXJM-CYBMUJFWSA-N 0 0 382.482 3.477 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000115133616 1412593585 /nfs/dbraw/zinc/59/35/85/1412593585.db2.gz MSXNHZVEYJEYGI-SJLPKXTDSA-N 0 0 395.459 3.450 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnc(-c2cc(C)cc(C)c2)s1 ZINC000115150772 1412598950 /nfs/dbraw/zinc/59/89/50/1412598950.db2.gz PADHARCGHVRLIS-UHFFFAOYSA-N 0 0 386.437 3.264 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000177268995 1428663097 /nfs/dbraw/zinc/66/30/97/1428663097.db2.gz NJPFMDKMLHMAOQ-UHFFFAOYSA-N 0 0 383.404 3.064 20 5 GGBDRN CN1C(=O)C[C@H](C(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccc(Cl)c1 ZINC000115212346 1412610925 /nfs/dbraw/zinc/61/09/25/1412610925.db2.gz KUWZYFMEXAYEOD-WMZOPIPTSA-N 0 0 387.823 3.084 20 5 GGBDRN Cc1sc(C(=O)Nc2ccc(OCC(=O)N(C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000115231501 1412614867 /nfs/dbraw/zinc/61/48/67/1412614867.db2.gz BOJPTJMEBQVFLX-UHFFFAOYSA-N 0 0 397.840 3.337 20 5 GGBDRN CN(C)C(=O)COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1Cl ZINC000115232404 1412615451 /nfs/dbraw/zinc/61/54/51/1412615451.db2.gz JFBANJNOFCMXKE-UHFFFAOYSA-N 0 0 395.774 3.107 20 5 GGBDRN O=C(Nc1cccc(C[S@@](=O)C2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000115290277 1412636884 /nfs/dbraw/zinc/63/68/84/1412636884.db2.gz DRXZYCGPRMJDQA-MHZLTWQESA-N 0 0 388.445 3.275 20 5 GGBDRN CC[C@@H]1COCCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000115307273 1412642567 /nfs/dbraw/zinc/64/25/67/1412642567.db2.gz GYPQBNLYOADDQA-GFCCVEGCSA-N 0 0 375.347 3.053 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)c1 ZINC000115410059 1412669552 /nfs/dbraw/zinc/66/95/52/1412669552.db2.gz HHLSWVZJGUMIBW-UHFFFAOYSA-N 0 0 388.767 3.237 20 5 GGBDRN O=C(NCc1nc(-c2cccc(Cl)c2)no1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000115409615 1412669565 /nfs/dbraw/zinc/66/95/65/1412669565.db2.gz HSRRGOPJVONURY-UHFFFAOYSA-N 0 0 398.766 3.105 20 5 GGBDRN CN(C)[C@@H](CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000115411486 1412670286 /nfs/dbraw/zinc/67/02/86/1412670286.db2.gz BYKULADNEGTVCV-YRYLYKBFSA-N 0 0 375.375 3.305 20 5 GGBDRN CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)OCCn1cc([N+](=O)[O-])cn1 ZINC000177278691 1428668560 /nfs/dbraw/zinc/66/85/60/1428668560.db2.gz RGNIAVWNZVVFPT-UHFFFAOYSA-N 0 0 383.408 3.132 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCSC[C@H]1c1ccccc1 ZINC000115475208 1412685480 /nfs/dbraw/zinc/68/54/80/1412685480.db2.gz VLSSNIIZFFSYEX-KDOFPFPSSA-N 0 0 399.472 3.030 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCSC[C@H]1c1ccccc1 ZINC000115475205 1412685613 /nfs/dbraw/zinc/68/56/13/1412685613.db2.gz VLSSNIIZFFSYEX-KSSFIOAISA-N 0 0 399.472 3.030 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115476694 1412686535 /nfs/dbraw/zinc/68/65/35/1412686535.db2.gz KRQSQTDSSJKDBC-AWEZNQCLSA-N 0 0 399.422 3.291 20 5 GGBDRN COC(=O)c1cccc2c1CCCN2C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000115512565 1412699184 /nfs/dbraw/zinc/69/91/84/1412699184.db2.gz IRBSRLMLIRKTLL-UHFFFAOYSA-N 0 0 383.404 3.163 20 5 GGBDRN COc1cc(CC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc(OC)c1OC ZINC000115521503 1412700248 /nfs/dbraw/zinc/70/02/48/1412700248.db2.gz JDXYOLOWFIVCDV-UHFFFAOYSA-N 0 0 382.319 3.080 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1NCCOC[C@@H]1CCCO1 ZINC000115519114 1412700540 /nfs/dbraw/zinc/70/05/40/1412700540.db2.gz HOZVUOXBELJUKB-JTQLQIEISA-N 0 0 379.291 3.129 20 5 GGBDRN NC(=O)C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000177282479 1428669878 /nfs/dbraw/zinc/66/98/78/1428669878.db2.gz LSWPQCJAABNHFK-ZDUSSCGKSA-N 0 0 387.358 3.168 20 5 GGBDRN COc1ccc(NC(=O)CN2CCSC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000115559039 1412710734 /nfs/dbraw/zinc/71/07/34/1412710734.db2.gz MHCXYBGVLONAOD-GOSISDBHSA-N 0 0 387.461 3.332 20 5 GGBDRN O=C(CN1CCSC[C@@H]1c1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000115559428 1412710774 /nfs/dbraw/zinc/71/07/74/1412710774.db2.gz OBJXSRYEXDDWPD-LJQANCHMSA-N 0 0 383.473 3.274 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCSC[C@@H]1c1ccccc1 ZINC000115559133 1412710994 /nfs/dbraw/zinc/71/09/94/1412710994.db2.gz UAFVJIVGTMXBGS-QGZVFWFLSA-N 0 0 387.461 3.332 20 5 GGBDRN COc1ccc(NC(=O)CN2CCSC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000115559042 1412711283 /nfs/dbraw/zinc/71/12/83/1412711283.db2.gz MHCXYBGVLONAOD-SFHVURJKSA-N 0 0 387.461 3.332 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000115587282 1412720947 /nfs/dbraw/zinc/72/09/47/1412720947.db2.gz HJVKXLDVCWSSBG-HIFRSBDPSA-N 0 0 376.434 3.170 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](c2ccccc2)C[C@H]1C ZINC000115587761 1412721316 /nfs/dbraw/zinc/72/13/16/1412721316.db2.gz NWGIGULEILONLU-HIFRSBDPSA-N 0 0 376.434 3.170 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CCSC[C@@H]1c1ccccc1 ZINC000115590383 1412721965 /nfs/dbraw/zinc/72/19/65/1412721965.db2.gz CTBIPOVWZRZXND-CQSZACIVSA-N 0 0 382.438 3.213 20 5 GGBDRN CN([C@@H]1CCCN(c2ccccc2)C1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000115587991 1412722568 /nfs/dbraw/zinc/72/25/68/1412722568.db2.gz INZSLRVRKAVIDH-LJQANCHMSA-N 0 0 389.477 3.025 20 5 GGBDRN CN([C@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000115588041 1412722582 /nfs/dbraw/zinc/72/25/82/1412722582.db2.gz QZDBAFOLIJVLOL-HNNXBMFYSA-N 0 0 393.440 3.023 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc1 ZINC000115627970 1412738566 /nfs/dbraw/zinc/73/85/66/1412738566.db2.gz KKNRIMUEPGYFGJ-UHFFFAOYSA-N 0 0 387.461 3.378 20 5 GGBDRN O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000115632889 1412740165 /nfs/dbraw/zinc/74/01/65/1412740165.db2.gz YJPJPTXEJMQNFM-HNNXBMFYSA-N 0 0 392.799 3.154 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1nnnn1-c1ccccc1 ZINC000115640955 1412741641 /nfs/dbraw/zinc/74/16/41/1412741641.db2.gz NDBISAMADNOSFD-JTQLQIEISA-N 0 0 387.787 3.107 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N(C2CC2)C2CCCC2)cc1OC ZINC000115643627 1412742857 /nfs/dbraw/zinc/74/28/57/1412742857.db2.gz NKJFZWIHULSSFA-UHFFFAOYSA-N 0 0 378.425 3.176 20 5 GGBDRN O=C(CCc1ccccc1)N1CCCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000177291837 1428674535 /nfs/dbraw/zinc/67/45/35/1428674535.db2.gz FWLNTBZQPFYYTJ-UHFFFAOYSA-N 0 0 397.475 3.141 20 5 GGBDRN O=C(C[C@@H]1OCCc2ccccc21)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000115712304 1412771597 /nfs/dbraw/zinc/77/15/97/1412771597.db2.gz QESVQXGUOKYVQQ-INIZCTEOSA-N 0 0 379.376 3.023 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000115721552 1412773151 /nfs/dbraw/zinc/77/31/51/1412773151.db2.gz WKXHIIUNRBTFHB-DZGCQCFKSA-N 0 0 377.400 3.455 20 5 GGBDRN O=C(Nc1cccc(C[S@](=O)c2ccccc2)c1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000115723901 1412774110 /nfs/dbraw/zinc/77/41/10/1412774110.db2.gz AJXQGPAYKNKVNJ-MUUNZHRXSA-N 0 0 397.412 3.256 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000177292619 1428675197 /nfs/dbraw/zinc/67/51/97/1428675197.db2.gz VGVYPHNWNQRWIV-PGGUUEOZSA-N 0 0 390.461 3.321 20 5 GGBDRN COc1cc(C(=O)N(CC(F)(F)F)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000115803271 1412793531 /nfs/dbraw/zinc/79/35/31/1412793531.db2.gz MHWPVDLVIZKTBX-UHFFFAOYSA-N 0 0 384.257 3.372 20 5 GGBDRN CN(C)[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000115807710 1412794502 /nfs/dbraw/zinc/79/45/02/1412794502.db2.gz JGQZCXLPZWIECF-KRWDZBQOSA-N 0 0 392.406 3.018 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2c3cccc(F)c3CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000177295829 1428676383 /nfs/dbraw/zinc/67/63/83/1428676383.db2.gz NDEXCTOSAMNEEW-KPZWWZAWSA-N 0 0 385.395 3.421 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N(C)Cc3cscn3)cc2)c(C)c1[N+](=O)[O-] ZINC000115862093 1412803545 /nfs/dbraw/zinc/80/35/45/1412803545.db2.gz PAGCPIISLLKHKK-UHFFFAOYSA-N 0 0 385.449 3.185 20 5 GGBDRN CC(C)[C@@H]1CCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000115912137 1412814397 /nfs/dbraw/zinc/81/43/97/1412814397.db2.gz SNVRFCXCHLSCSO-INIZCTEOSA-N 0 0 381.498 3.394 20 5 GGBDRN CCc1ccc(OC(=O)[C@H](C)S(=O)(=O)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000115926077 1412816195 /nfs/dbraw/zinc/81/61/95/1412816195.db2.gz RQTCGTMEKRJZQW-NSHDSACASA-N 0 0 381.381 3.064 20 5 GGBDRN CCc1ccc(OC(=O)Cn2cnc3c4ccccc4oc3c2=O)c([N+](=O)[O-])c1 ZINC000115926013 1412816206 /nfs/dbraw/zinc/81/62/06/1412816206.db2.gz PWFDHVXHKRYDJE-UHFFFAOYSA-N 0 0 393.355 3.219 20 5 GGBDRN CC[C@@H](C)C[C@@H](C)NS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000115928525 1412816661 /nfs/dbraw/zinc/81/66/61/1412816661.db2.gz IAPPGQZNMFUSEV-NXEZZACHSA-N 0 0 379.276 3.460 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2c3cccc(F)c3CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000177301606 1428678134 /nfs/dbraw/zinc/67/81/34/1428678134.db2.gz KKSGJTKRUDDMFS-VOJFVSQTSA-N 0 0 385.395 3.421 20 5 GGBDRN O=c1c2cnn(-c3ccccc3)c2ncn1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000115962985 1412818273 /nfs/dbraw/zinc/81/82/73/1412818273.db2.gz VHIKRHDCIYOTDW-UHFFFAOYSA-N 0 0 381.779 3.192 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000115965929 1412818601 /nfs/dbraw/zinc/81/86/01/1412818601.db2.gz YDBVFNDPZGMYGI-UHFFFAOYSA-N 0 0 386.751 3.428 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000115965874 1412818727 /nfs/dbraw/zinc/81/87/27/1412818727.db2.gz PAAPNEYYXJMIKN-UHFFFAOYSA-N 0 0 375.566 3.472 20 5 GGBDRN O=C([C@H]1C[C@H]1c1c(F)cccc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000115994486 1412820436 /nfs/dbraw/zinc/82/04/36/1412820436.db2.gz VCKREUSKIMSTGU-CVEARBPZSA-N 0 0 387.386 3.325 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)NC(C)(C)C ZINC000116008281 1412821217 /nfs/dbraw/zinc/82/12/17/1412821217.db2.gz SEANYVAUHREPRW-CQSZACIVSA-N 0 0 398.463 3.240 20 5 GGBDRN O=C(COC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)Nc1cccc([N+](=O)[O-])c1 ZINC000116017303 1412821880 /nfs/dbraw/zinc/82/18/80/1412821880.db2.gz RISZACIGSPKZIM-QWHCGFSZSA-N 0 0 376.315 3.158 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCc2sccc2[C@@H]1c1cccs1 ZINC000116044088 1412824288 /nfs/dbraw/zinc/82/42/88/1412824288.db2.gz ORXHKCFOVKUOFL-QGZVFWFLSA-N 0 0 388.474 3.397 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1 ZINC000116044969 1412824780 /nfs/dbraw/zinc/82/47/80/1412824780.db2.gz GWZOLBCOBIJVFW-OAHLLOKOSA-N 0 0 378.432 3.437 20 5 GGBDRN O=C(Cc1ccccc1)NCCC(=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116061770 1412826469 /nfs/dbraw/zinc/82/64/69/1412826469.db2.gz CDTASZXXLSHRRQ-UHFFFAOYSA-N 0 0 376.796 3.040 20 5 GGBDRN CCN(C[C@@H]1CCCO1)C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000116066635 1412827352 /nfs/dbraw/zinc/82/73/52/1412827352.db2.gz JMBHKSRBADJHEP-RDJZCZTQSA-N 0 0 375.469 3.472 20 5 GGBDRN CCc1cc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n(C)n1 ZINC000116078283 1412828616 /nfs/dbraw/zinc/82/86/16/1412828616.db2.gz IONQZJAURURDRC-UHFFFAOYSA-N 0 0 382.424 3.005 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000116087237 1412829786 /nfs/dbraw/zinc/82/97/86/1412829786.db2.gz XAFITOJHAYKUPY-XBXARRHUSA-N 0 0 386.839 3.001 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000116093645 1412830948 /nfs/dbraw/zinc/83/09/48/1412830948.db2.gz WPPNLBLHJYMHII-MFKMUULPSA-N 0 0 377.303 3.376 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 ZINC000116094557 1412831308 /nfs/dbraw/zinc/83/13/08/1412831308.db2.gz ACHQLEAFDQSBGX-CQSZACIVSA-N 0 0 383.379 3.214 20 5 GGBDRN Cc1sc2ncn(CCC(=O)Nc3ccc([N+](=O)[O-])cc3F)c(=O)c2c1C ZINC000116094577 1412831393 /nfs/dbraw/zinc/83/13/93/1412831393.db2.gz GXMHIIYIFAVBKL-UHFFFAOYSA-N 0 0 390.396 3.151 20 5 GGBDRN COc1cc(C(=O)NC2(c3nccs3)CCCC2)c([N+](=O)[O-])cc1OC ZINC000116104843 1412832864 /nfs/dbraw/zinc/83/28/64/1412832864.db2.gz VAQNEFXEVBXKBJ-UHFFFAOYSA-N 0 0 377.422 3.268 20 5 GGBDRN O=C(c1cccc(C(F)(F)F)c1F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000177303356 1428679515 /nfs/dbraw/zinc/67/95/15/1428679515.db2.gz ATXYZHBTQHBHNY-SNVBAGLBSA-N 0 0 398.316 3.474 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cccc(CSC2CCOCC2)c1 ZINC000116131537 1412835009 /nfs/dbraw/zinc/83/50/09/1412835009.db2.gz OEWIIJPSMBCAFP-UHFFFAOYSA-N 0 0 390.465 3.232 20 5 GGBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000177305018 1428679687 /nfs/dbraw/zinc/67/96/87/1428679687.db2.gz YJDAMYLGGZDHJZ-DQQVXTMASA-N 0 0 391.405 3.074 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NC(C)(C)c2nc(C)cs2)cc([N+](=O)[O-])c1 ZINC000116147114 1412836684 /nfs/dbraw/zinc/83/66/84/1412836684.db2.gz RJLFUKNOEUHSEL-UHFFFAOYSA-N 0 0 377.422 3.202 20 5 GGBDRN CC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116266839 1412846654 /nfs/dbraw/zinc/84/66/54/1412846654.db2.gz KEUSJTKFQYLVBV-UHFFFAOYSA-N 0 0 382.825 3.272 20 5 GGBDRN Cc1cc(C(=O)N2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c(C)o1 ZINC000116273935 1412847163 /nfs/dbraw/zinc/84/71/63/1412847163.db2.gz MJKOGXAOYJVZCS-UHFFFAOYSA-N 0 0 377.828 3.416 20 5 GGBDRN COc1ccc(CN(CCO)Cc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 ZINC000116280266 1412847442 /nfs/dbraw/zinc/84/74/42/1412847442.db2.gz SGECMNMDVVDUTC-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN NC(=O)c1ccc(COC(=O)c2ccccc2Oc2cccnc2)c([N+](=O)[O-])c1 ZINC000116308450 1412849033 /nfs/dbraw/zinc/84/90/33/1412849033.db2.gz ZRPNUEQBBOQVGL-UHFFFAOYSA-N 0 0 393.355 3.238 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000177310031 1428681354 /nfs/dbraw/zinc/68/13/54/1428681354.db2.gz HFGKALZDBFVLSD-ASHKIFAZSA-N 0 0 389.477 3.354 20 5 GGBDRN C[C@H](OC(=O)c1csc(-c2ccccn2)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000116419171 1412856929 /nfs/dbraw/zinc/85/69/29/1412856929.db2.gz PCLZHEJLXDLPBT-NSHDSACASA-N 0 0 398.400 3.297 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1C[C@H]1c1c(F)cccc1F ZINC000116420542 1412857237 /nfs/dbraw/zinc/85/72/37/1412857237.db2.gz WVMLDWLLUDHGJZ-DOMZBBRYSA-N 0 0 377.347 3.237 20 5 GGBDRN O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000116444136 1412861051 /nfs/dbraw/zinc/86/10/51/1412861051.db2.gz TVGLYAOKBJEAKJ-UHFFFAOYSA-N 0 0 375.344 3.079 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2ncc(Cc3ccc(C)c(F)c3)s2)c1[N+](=O)[O-] ZINC000116448675 1412862005 /nfs/dbraw/zinc/86/20/05/1412862005.db2.gz CEJTXHLYGHKWNW-UHFFFAOYSA-N 0 0 375.385 3.373 20 5 GGBDRN CC(C)(C)c1ccc([C@@H](O)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000116458502 1412863072 /nfs/dbraw/zinc/86/30/72/1412863072.db2.gz KHMUEWSQLXYFIC-INIZCTEOSA-N 0 0 375.400 3.077 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000116462366 1412864220 /nfs/dbraw/zinc/86/42/20/1412864220.db2.gz MOENINZFJLZMJE-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116464593 1412864619 /nfs/dbraw/zinc/86/46/19/1412864619.db2.gz IJUUJUSBINASGW-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N(C)c2cc(F)ccc2F)cc1OC ZINC000116481329 1412866276 /nfs/dbraw/zinc/86/62/76/1412866276.db2.gz SSBPDOFVAPUOAO-UHFFFAOYSA-N 0 0 396.346 3.183 20 5 GGBDRN CN1C[C@@H](NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1=O ZINC000116494351 1412868213 /nfs/dbraw/zinc/86/82/13/1412868213.db2.gz DCFBGTAUAFAJHR-ZDUSSCGKSA-N 0 0 389.795 3.001 20 5 GGBDRN Cc1ccc(C)n1C1CCN(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000116500636 1412869152 /nfs/dbraw/zinc/86/91/52/1412869152.db2.gz XVSGYMWLTDEONU-UHFFFAOYSA-N 0 0 377.466 3.347 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000116544901 1412875051 /nfs/dbraw/zinc/87/50/51/1412875051.db2.gz KBRDGEKHIYATLK-MRXNPFEDSA-N 0 0 390.367 3.167 20 5 GGBDRN NC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1 ZINC000116545567 1412875340 /nfs/dbraw/zinc/87/53/40/1412875340.db2.gz OSVRVVOHSFGHSK-UHFFFAOYSA-N 0 0 386.383 3.075 20 5 GGBDRN O=C(NCc1cccc(NC(=O)c2ccncc2)c1)c1cc(F)ccc1[N+](=O)[O-] ZINC000116545612 1412875496 /nfs/dbraw/zinc/87/54/96/1412875496.db2.gz GVIBVQKGSGUCLK-UHFFFAOYSA-N 0 0 394.362 3.311 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000116583763 1412882442 /nfs/dbraw/zinc/88/24/42/1412882442.db2.gz GOAVFKMBAIQFKE-NOZJJQNGSA-N 0 0 395.749 3.137 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000116583766 1412882499 /nfs/dbraw/zinc/88/24/99/1412882499.db2.gz GOAVFKMBAIQFKE-TVQRCGJNSA-N 0 0 395.749 3.137 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000116583309 1412882527 /nfs/dbraw/zinc/88/25/27/1412882527.db2.gz NCSIWMSBBJOQAX-LKFCYVNXSA-N 0 0 395.749 3.137 20 5 GGBDRN COc1cc(CN(C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)ccc1SC ZINC000116601438 1412885546 /nfs/dbraw/zinc/88/55/46/1412885546.db2.gz OPPJGDVZJHOVHE-UHFFFAOYSA-N 0 0 389.477 3.420 20 5 GGBDRN O=C(CC1CCCCC1)N1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000116603064 1412886049 /nfs/dbraw/zinc/88/60/49/1412886049.db2.gz XHSZMISDJGUDHM-UHFFFAOYSA-N 0 0 375.469 3.088 20 5 GGBDRN COc1ccc(CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116616573 1412887223 /nfs/dbraw/zinc/88/72/23/1412887223.db2.gz QSLUKRJLFDOGSG-UHFFFAOYSA-N 0 0 378.812 3.385 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cccc(-n2cccn2)c1 ZINC000116622562 1412887911 /nfs/dbraw/zinc/88/79/11/1412887911.db2.gz RQIOPZWHURVQQJ-UHFFFAOYSA-N 0 0 380.360 3.194 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116623542 1412888230 /nfs/dbraw/zinc/88/82/30/1412888230.db2.gz LYRQSXBKCZGPOI-UHFFFAOYSA-N 0 0 391.811 3.292 20 5 GGBDRN CN(CC(=O)Nc1ccccc1)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116627459 1412888611 /nfs/dbraw/zinc/88/86/11/1412888611.db2.gz MBELSACKCZMPHK-UHFFFAOYSA-N 0 0 391.811 3.114 20 5 GGBDRN COc1cccc(CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116629201 1412888907 /nfs/dbraw/zinc/88/89/07/1412888907.db2.gz GHIXITGRTJSUAN-UHFFFAOYSA-N 0 0 378.812 3.385 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccccc1-n1ccnn1 ZINC000116628759 1412889054 /nfs/dbraw/zinc/88/90/54/1412889054.db2.gz LEJHSGGJLSGJTO-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN CN1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2C1 ZINC000116640131 1412890391 /nfs/dbraw/zinc/89/03/91/1412890391.db2.gz FBCDUHBREURJHF-UHFFFAOYSA-N 0 0 389.839 3.496 20 5 GGBDRN Cc1cc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])ccc1C(N)=O ZINC000116640102 1412890473 /nfs/dbraw/zinc/89/04/73/1412890473.db2.gz YATZVTSRJVJIIJ-UHFFFAOYSA-N 0 0 377.784 3.063 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000116659555 1412893313 /nfs/dbraw/zinc/89/33/13/1412893313.db2.gz CESGBAJOVKKQHG-ZDUSSCGKSA-N 0 0 377.347 3.205 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000116659958 1412893601 /nfs/dbraw/zinc/89/36/01/1412893601.db2.gz ONESHXTXDURGII-LBPRGKRZSA-N 0 0 377.347 3.205 20 5 GGBDRN Cc1nn(C)c(C(=O)N(CCc2ccc(Cl)cc2)CC2CC2)c1[N+](=O)[O-] ZINC000116665666 1412894584 /nfs/dbraw/zinc/89/45/84/1412894584.db2.gz FPVCFVVNLVJOOK-UHFFFAOYSA-N 0 0 376.844 3.385 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC(COc3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000116677969 1412895589 /nfs/dbraw/zinc/89/55/89/1412895589.db2.gz IPMDFAIPQAJHAP-UHFFFAOYSA-N 0 0 386.452 3.116 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1csc(-c2ccccn2)n1 ZINC000116678351 1412895675 /nfs/dbraw/zinc/89/56/75/1412895675.db2.gz IOOMZAITFYBEDH-UHFFFAOYSA-N 0 0 398.400 3.217 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000116681026 1412896357 /nfs/dbraw/zinc/89/63/57/1412896357.db2.gz FOVSQIPRKUFNNR-SANMLTNESA-N 0 0 376.434 3.051 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000116682840 1412896549 /nfs/dbraw/zinc/89/65/49/1412896549.db2.gz DRKGYZUAZQUHQZ-SANMLTNESA-N 0 0 376.434 3.051 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000116682196 1412896574 /nfs/dbraw/zinc/89/65/74/1412896574.db2.gz XDHQYKUJSQIJCX-AREMUKBSSA-N 0 0 376.434 3.051 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000116692788 1412898094 /nfs/dbraw/zinc/89/80/94/1412898094.db2.gz GHEXWSQWLHSAKQ-SANMLTNESA-N 0 0 376.434 3.189 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)o1 ZINC000116702619 1412899229 /nfs/dbraw/zinc/89/92/29/1412899229.db2.gz XJYSQYUMUAFKNU-OAHLLOKOSA-N 0 0 389.364 3.235 20 5 GGBDRN CCc1ccc([C@@H](C)NC(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000116705307 1412899558 /nfs/dbraw/zinc/89/95/58/1412899558.db2.gz JSTPIPFEHSDYSG-CQSZACIVSA-N 0 0 379.420 3.293 20 5 GGBDRN CCc1ccc([C@H](C)NC(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000116705309 1412899628 /nfs/dbraw/zinc/89/96/28/1412899628.db2.gz JSTPIPFEHSDYSG-AWEZNQCLSA-N 0 0 379.420 3.293 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)o1 ZINC000116709230 1412899814 /nfs/dbraw/zinc/89/98/14/1412899814.db2.gz UAEDRCCTXZANOZ-AWEZNQCLSA-N 0 0 395.209 3.472 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(C[S@](C)=O)c1C ZINC000116712043 1412901391 /nfs/dbraw/zinc/90/13/91/1412901391.db2.gz MZUZSWBVPAKNDB-RUZDIDTESA-N 0 0 396.490 3.145 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC[C@@H]1Cc1ccccc1 ZINC000116713396 1412902290 /nfs/dbraw/zinc/90/22/90/1412902290.db2.gz IKXSGEWQBVRHIC-VQIMIIECSA-N 0 0 395.459 3.337 20 5 GGBDRN CN(C)c1cccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116741375 1412913746 /nfs/dbraw/zinc/91/37/46/1412913746.db2.gz FVFIIRSZYAEMFA-UHFFFAOYSA-N 0 0 377.828 3.400 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(-c2nc[nH]n2)cc1 ZINC000116759960 1412917578 /nfs/dbraw/zinc/91/75/78/1412917578.db2.gz GGPCLTKWDGXIAZ-UHFFFAOYSA-N 0 0 387.783 3.441 20 5 GGBDRN Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000116770335 1412920487 /nfs/dbraw/zinc/92/04/87/1412920487.db2.gz DAZGYHQEVLIMSG-KRWDZBQOSA-N 0 0 394.435 3.169 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CC2)cc1 ZINC000116818692 1412932057 /nfs/dbraw/zinc/93/20/57/1412932057.db2.gz NAJBINLYSQROPX-UHFFFAOYSA-N 0 0 380.404 3.463 20 5 GGBDRN O=C(Nc1cnn(CC(F)F)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000116841368 1412937790 /nfs/dbraw/zinc/93/77/90/1412937790.db2.gz NJHIYYVTHWJAQA-UHFFFAOYSA-N 0 0 379.348 3.432 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1 ZINC000116873404 1412946128 /nfs/dbraw/zinc/94/61/28/1412946128.db2.gz RBKDVOGQEDQABW-HXUWFJFHSA-N 0 0 399.447 3.420 20 5 GGBDRN Cc1cc(S(=O)(=O)Oc2cccnc2[N+](=O)[O-])c(C)cc1Br ZINC000116897386 1412952400 /nfs/dbraw/zinc/95/24/00/1412952400.db2.gz JDZRSONWCJYKAS-UHFFFAOYSA-N 0 0 387.211 3.137 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000116903422 1412952477 /nfs/dbraw/zinc/95/24/77/1412952477.db2.gz VXPKMCPKPKGVNG-UHFFFAOYSA-N 0 0 390.461 3.444 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 ZINC000116903354 1412952515 /nfs/dbraw/zinc/95/25/15/1412952515.db2.gz HTBJFCHQAOYYAZ-UHFFFAOYSA-N 0 0 390.461 3.444 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3ccc(C)cc3[N+](=O)[O-])CC2)cc1 ZINC000116903404 1412952578 /nfs/dbraw/zinc/95/25/78/1412952578.db2.gz MBUHJNQIFYTNGE-UHFFFAOYSA-N 0 0 390.461 3.444 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000116903406 1412952613 /nfs/dbraw/zinc/95/26/13/1412952613.db2.gz XQBAAYSJPRYQGZ-UHFFFAOYSA-N 0 0 376.434 3.135 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000116931221 1412956926 /nfs/dbraw/zinc/95/69/26/1412956926.db2.gz GAFCMFPFEVHAFI-SANMLTNESA-N 0 0 377.422 3.134 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC000177326242 1428690863 /nfs/dbraw/zinc/69/08/63/1428690863.db2.gz VJVBRIYMEKENCS-CQSZACIVSA-N 0 0 387.411 3.262 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116983700 1412971550 /nfs/dbraw/zinc/97/15/50/1412971550.db2.gz NSJBRITWYFETLB-QGZVFWFLSA-N 0 0 378.812 3.499 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000116983636 1412971709 /nfs/dbraw/zinc/97/17/09/1412971709.db2.gz ANXFYFSOVKMTGA-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN 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Cc1ccccc1-n1nccc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000117260472 1413020778 /nfs/dbraw/zinc/02/07/78/1413020778.db2.gz RUJWEKLQOBKYAP-UHFFFAOYSA-N 0 0 389.371 3.183 20 5 GGBDRN Cc1nn(C(C)(C)C)c(C)c1C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000117276782 1413022327 /nfs/dbraw/zinc/02/23/27/1413022327.db2.gz KCCFIQUMBHMATF-UHFFFAOYSA-N 0 0 385.468 3.126 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)C(=O)COc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000177332913 1428694880 /nfs/dbraw/zinc/69/48/80/1428694880.db2.gz YHIJYZFHAKGHFI-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2cc(C(=O)OCC)cc([N+](=O)[O-])c2)cc1 ZINC000117303315 1413023438 /nfs/dbraw/zinc/02/34/38/1413023438.db2.gz OUCFQTLHZBEDTR-UHFFFAOYSA-N 0 0 386.404 3.490 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000177333191 1428695216 /nfs/dbraw/zinc/69/52/16/1428695216.db2.gz IIIUCYCNTDATDP-LBPRGKRZSA-N 0 0 381.404 3.111 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H](C)SCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 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Cc1c(NC(=O)C(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000119042054 1413314623 /nfs/dbraw/zinc/31/46/23/1413314623.db2.gz WOYDTDHKURGJNM-SJLPKXTDSA-N 0 0 381.432 3.369 20 5 GGBDRN COc1cc(OCC(=O)N2CCCc3c(F)ccc(F)c32)ccc1[N+](=O)[O-] ZINC000119053734 1413318324 /nfs/dbraw/zinc/31/83/24/1413318324.db2.gz OZFXEDHLBYUTSE-UHFFFAOYSA-N 0 0 378.331 3.240 20 5 GGBDRN COc1ccc(CCNC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1OC(F)F ZINC000119056986 1413319883 /nfs/dbraw/zinc/31/98/83/1413319883.db2.gz LMXZLFSXDNCZMN-UHFFFAOYSA-N 0 0 394.374 3.415 20 5 GGBDRN COc1ccc(OC)c(CN(CCO)Cc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000119099261 1413336254 /nfs/dbraw/zinc/33/62/54/1413336254.db2.gz JFBLWUOZJSXVTN-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCc2c1cccc2Cl ZINC000119105069 1413338278 /nfs/dbraw/zinc/33/82/78/1413338278.db2.gz LWDIWHBKWDPPPA-UHFFFAOYSA-N 0 0 387.823 3.288 20 5 GGBDRN Cc1nc(N2CCOCC2)ccc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000119108100 1413339806 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Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000119202514 1413374294 /nfs/dbraw/zinc/37/42/94/1413374294.db2.gz VCGDUPSCOBMRCU-WBMJQRKESA-N 0 0 387.392 3.096 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCCC2)nc1 ZINC000119218419 1413378489 /nfs/dbraw/zinc/37/84/89/1413378489.db2.gz CNGOYGFRIJQFRF-UHFFFAOYSA-N 0 0 397.479 3.412 20 5 GGBDRN CC(C)OC(=O)CCCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000119221765 1413380459 /nfs/dbraw/zinc/38/04/59/1413380459.db2.gz UEKODZCWKFQNBX-UHFFFAOYSA-N 0 0 388.218 3.211 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(O[C@H]3CCCC[C@H]3O)cc2)c1[N+](=O)[O-] ZINC000119226297 1413381831 /nfs/dbraw/zinc/38/18/31/1413381831.db2.gz XPHYTHIOVKIESD-CVEARBPZSA-N 0 0 388.424 3.205 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1csc(S(C)(=O)=O)c1 ZINC000119235935 1413384734 /nfs/dbraw/zinc/38/47/34/1413384734.db2.gz HJTGCAMEANAMLG-UHFFFAOYSA-N 0 0 375.811 3.241 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)C(=O)NC(C)(C)C 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DQLWVEJHSVJXGO-UHFFFAOYSA-N 0 0 387.779 3.150 20 5 GGBDRN CCOc1ccc([C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])C(C)C)cc1OCC ZINC000119363794 1413424808 /nfs/dbraw/zinc/42/48/08/1413424808.db2.gz CJLALBJUAYUWJM-INIZCTEOSA-N 0 0 376.413 3.242 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000119376508 1413429044 /nfs/dbraw/zinc/42/90/44/1413429044.db2.gz JVBDXRJHSFSSNC-LBPRGKRZSA-N 0 0 396.852 3.149 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000119378567 1413429560 /nfs/dbraw/zinc/42/95/60/1413429560.db2.gz PNBFIGYTIAYNNF-JDNHERCYSA-N 0 0 381.791 3.476 20 5 GGBDRN O=C(CN1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1)Nc1ccc(F)cc1 ZINC000119392354 1413432755 /nfs/dbraw/zinc/43/27/55/1413432755.db2.gz SBDJTYRHJCXEQI-HWKANZROSA-N 0 0 398.438 3.003 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)NCCc2ccc(Br)s2)cs1 ZINC000119391732 1413432767 /nfs/dbraw/zinc/43/27/67/1413432767.db2.gz HYVPAXYNQWZGKG-UHFFFAOYSA-N 0 0 397.297 3.001 20 5 GGBDRN 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Cc1c(CC(=O)Nc2cc(-c3cccs3)nn2CCO)cccc1[N+](=O)[O-] ZINC000119492552 1413465184 /nfs/dbraw/zinc/46/51/84/1413465184.db2.gz VWOQIQMBVDBPIF-UHFFFAOYSA-N 0 0 386.433 3.002 20 5 GGBDRN Cn1cc(CNc2ccc(NC(=O)C3CC3)nc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119495753 1413466014 /nfs/dbraw/zinc/46/60/14/1413466014.db2.gz LFDLVXVIQCGPQB-UHFFFAOYSA-N 0 0 392.419 3.351 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC[C@H]1c1ccco1 ZINC000119505093 1413469131 /nfs/dbraw/zinc/46/91/31/1413469131.db2.gz HVNPWQQANKTKFW-PBHICJAKSA-N 0 0 385.420 3.450 20 5 GGBDRN O=C(NCc1ccc(F)cc1)c1nnc(COc2ccc([N+](=O)[O-])cc2)s1 ZINC000119511267 1413471130 /nfs/dbraw/zinc/47/11/30/1413471130.db2.gz KVAOAGDLGQDBNB-UHFFFAOYSA-N 0 0 388.380 3.094 20 5 GGBDRN CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000119512286 1413471644 /nfs/dbraw/zinc/47/16/44/1413471644.db2.gz YTUYIDTZOGHJLJ-UHFFFAOYSA-N 0 0 394.387 3.424 20 5 GGBDRN COc1cccc(COCCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000119527767 1413476055 /nfs/dbraw/zinc/47/60/55/1413476055.db2.gz JXPFBMASFCQSHX-HNNXBMFYSA-N 0 0 387.436 3.489 20 5 GGBDRN O=C(C[C@@H]1COCCN1CCCOc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000119528488 1413476687 /nfs/dbraw/zinc/47/66/87/1413476687.db2.gz DRVNBRRJDQTDKM-MRXNPFEDSA-N 0 0 390.461 3.399 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(NC(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000119530463 1413476745 /nfs/dbraw/zinc/47/67/45/1413476745.db2.gz BIFQDZAGEHPXCM-UHFFFAOYSA-N 0 0 395.459 3.175 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCC1(c2ccccc2)CCCCCC1 ZINC000119538947 1413480309 /nfs/dbraw/zinc/48/03/09/1413480309.db2.gz KJHRGTQHVZIAHD-UHFFFAOYSA-N 0 0 383.448 3.165 20 5 GGBDRN COc1ccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000119541675 1413480996 /nfs/dbraw/zinc/48/09/96/1413480996.db2.gz XRHRPQICVPREQH-UHFFFAOYSA-N 0 0 387.436 3.434 20 5 GGBDRN CCN(CC)[C@H](CNS(=O)(=O)c1csc([N+](=O)[O-])c1)c1ccsc1 ZINC000119541236 1413481057 /nfs/dbraw/zinc/48/10/57/1413481057.db2.gz WPEAIDWSLDBZIY-CYBMUJFWSA-N 0 0 389.524 3.079 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccccc1F ZINC000119546118 1413481695 /nfs/dbraw/zinc/48/16/95/1413481695.db2.gz LYHHXMOQZTXBNX-UHFFFAOYSA-N 0 0 378.425 3.445 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000177424054 1428730560 /nfs/dbraw/zinc/73/05/60/1428730560.db2.gz JHSDKTDUXIOTGM-ASHKIFAZSA-N 0 0 389.477 3.277 20 5 GGBDRN CC(=O)N1CC[C@@H](CN(C)C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC000119554969 1413483839 /nfs/dbraw/zinc/48/38/39/1413483839.db2.gz KFKVBAHIBPXNRK-INIZCTEOSA-N 0 0 397.431 3.328 20 5 GGBDRN O=C(Nc1ccc(N2CCC(O)CC2)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000119557966 1413485128 /nfs/dbraw/zinc/48/51/28/1413485128.db2.gz UPIHSIVMMGJGNB-UHFFFAOYSA-N 0 0 375.812 3.462 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c(F)c1 ZINC000119559737 1413485995 /nfs/dbraw/zinc/48/59/95/1413485995.db2.gz FGUBKRXURHCXPY-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN CCOCc1ccccc1CNS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000119570500 1413489263 /nfs/dbraw/zinc/48/92/63/1413489263.db2.gz RLIAUWIKGUSTAH-UHFFFAOYSA-N 0 0 378.450 3.227 20 5 GGBDRN C[C@@H](C1CC1)N(C1CC1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000119580039 1413492001 /nfs/dbraw/zinc/49/20/01/1413492001.db2.gz PYQJMUAYGMASRK-VIFPVBQESA-N 0 0 389.271 3.309 20 5 GGBDRN CN(Cc1cc(Br)cs1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119592523 1413496958 /nfs/dbraw/zinc/49/69/58/1413496958.db2.gz LMLOGLDHMCHLPG-UHFFFAOYSA-N 0 0 397.297 3.301 20 5 GGBDRN CC[C@@H](C)C(=O)Nc1cccc(CNS(=O)(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000119598044 1413498822 /nfs/dbraw/zinc/49/88/22/1413498822.db2.gz ASGPVAQDRSKBHC-LLVKDONJSA-N 0 0 397.478 3.119 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000177426295 1428732225 /nfs/dbraw/zinc/73/22/25/1428732225.db2.gz MMJNMNVSPKMYKH-AUUYWEPGSA-N 0 0 380.404 3.023 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N(CCN1CCOCC1)c1ccccc1 ZINC000119616232 1413505024 /nfs/dbraw/zinc/50/50/24/1413505024.db2.gz HORSLFCYKLTWDP-UHFFFAOYSA-N 0 0 389.839 3.227 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H](O)c1cc2ccccc2s1 ZINC000119618528 1413505573 /nfs/dbraw/zinc/50/55/73/1413505573.db2.gz DYFXDGOLAFVOEQ-INIZCTEOSA-N 0 0 385.445 3.461 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)NCc2cc(F)ccc2Br)cs1 ZINC000119620487 1413505960 /nfs/dbraw/zinc/50/59/60/1413505960.db2.gz IOZQMQCBKHJJBN-UHFFFAOYSA-N 0 0 395.231 3.036 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(OCC(=O)N2CCCC2)c1 ZINC000119633260 1413510530 /nfs/dbraw/zinc/51/05/30/1413510530.db2.gz RPUPHXDWTQHPHY-UHFFFAOYSA-N 0 0 397.431 3.167 20 5 GGBDRN Cc1noc(C)c1CN1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000119662548 1413521139 /nfs/dbraw/zinc/52/11/39/1413521139.db2.gz WDIGWSWPAQGBNL-UHFFFAOYSA-N 0 0 397.435 3.172 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)NCc2ccc(Br)c(F)c2)cs1 ZINC000119669191 1413523766 /nfs/dbraw/zinc/52/37/66/1413523766.db2.gz PNTIVLZIODGEJN-UHFFFAOYSA-N 0 0 395.231 3.036 20 5 GGBDRN Cc1sc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(C(N)=O)c1C ZINC000119672362 1413525854 /nfs/dbraw/zinc/52/58/54/1413525854.db2.gz NUUDFDLVSHVIHB-UHFFFAOYSA-N 0 0 388.449 3.225 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000119682635 1413530532 /nfs/dbraw/zinc/53/05/32/1413530532.db2.gz VIBZCYSCXNKYFX-XJKSGUPXSA-N 0 0 386.379 3.330 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCO[C@@H](c3ccccc3Cl)C2)cs1 ZINC000119716301 1413543385 /nfs/dbraw/zinc/54/33/85/1413543385.db2.gz QCUJJMSWVAEPIG-CYBMUJFWSA-N 0 0 388.854 3.072 20 5 GGBDRN COc1c(C)cnc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000119722531 1413545042 /nfs/dbraw/zinc/54/50/42/1413545042.db2.gz OPFVGGOSVQXZFE-UHFFFAOYSA-N 0 0 384.436 3.489 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Nc2ccc(C(=O)NC3CC3)cc2)cccc1[N+](=O)[O-] ZINC000119733380 1413549066 /nfs/dbraw/zinc/54/90/66/1413549066.db2.gz FCILJTYCCLITCY-CYBMUJFWSA-N 0 0 382.420 3.235 20 5 GGBDRN O=C(CCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)N1CCCCCC1 ZINC000119739537 1413550330 /nfs/dbraw/zinc/55/03/30/1413550330.db2.gz XBUXWXMALASLAA-UHFFFAOYSA-N 0 0 388.468 3.062 20 5 GGBDRN CCCOc1ccc(-c2csc(NC(=O)c3c([N+](=O)[O-])cnn3C)n2)cc1 ZINC000119748798 1413554222 /nfs/dbraw/zinc/55/42/22/1413554222.db2.gz AOGVFTDCLMURLW-UHFFFAOYSA-N 0 0 387.421 3.493 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@@H](C)c2cc(F)ccc2F)c([N+](=O)[O-])c1 ZINC000119750807 1413554784 /nfs/dbraw/zinc/55/47/84/1413554784.db2.gz XGDJSONWTKEXHF-JTQLQIEISA-N 0 0 386.376 3.263 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000119754006 1413556305 /nfs/dbraw/zinc/55/63/05/1413556305.db2.gz GFMBADAUPMCGLW-ZIAGYGMSSA-N 0 0 377.441 3.469 20 5 GGBDRN NC(=O)[C@H]1Cc2ccccc2CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119780522 1413566642 /nfs/dbraw/zinc/56/66/42/1413566642.db2.gz FVRFVNRAOPCDFW-LJQANCHMSA-N 0 0 377.400 3.267 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1nc(Cc2ccccc2)no1 ZINC000177439814 1428737467 /nfs/dbraw/zinc/73/74/67/1428737467.db2.gz OHZDVQUFTQQLJL-CQSZACIVSA-N 0 0 395.419 3.172 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119788099 1413569412 /nfs/dbraw/zinc/56/94/12/1413569412.db2.gz YBDFMOQSMCKDRD-OTYXRUKQSA-N 0 0 390.870 3.364 20 5 GGBDRN Cn1cc(C(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119789554 1413569924 /nfs/dbraw/zinc/56/99/24/1413569924.db2.gz KLTOKDPPZKZYOA-LZQZEXGQSA-N 0 0 396.447 3.073 20 5 GGBDRN Cc1cc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000119796175 1413572913 /nfs/dbraw/zinc/57/29/13/1413572913.db2.gz IVNIHNDXXPMKKZ-HUUCEWRRSA-N 0 0 377.441 3.469 20 5 GGBDRN Cc1c(C(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000119798848 1413573418 /nfs/dbraw/zinc/57/34/18/1413573418.db2.gz YTZMWQWYHXLJKH-UONOGXRCSA-N 0 0 377.441 3.469 20 5 GGBDRN C[C@@H](CO[C@@H]1CCOC1)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000177441002 1428738004 /nfs/dbraw/zinc/73/80/04/1428738004.db2.gz ZRJHXADMLOROQL-WMLDXEAASA-N 0 0 385.420 3.262 20 5 GGBDRN Cc1cccc(C(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000119804189 1413575098 /nfs/dbraw/zinc/57/50/98/1413575098.db2.gz RZIKXRYXQXPBMW-UONOGXRCSA-N 0 0 377.441 3.469 20 5 GGBDRN COc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1N1CCCC1=O ZINC000119809140 1413577427 /nfs/dbraw/zinc/57/74/27/1413577427.db2.gz AOSOPNLBZIMNCE-UHFFFAOYSA-N 0 0 383.404 3.302 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000119820995 1413581690 /nfs/dbraw/zinc/58/16/90/1413581690.db2.gz XHTSDHNORCSDMR-LBPRGKRZSA-N 0 0 390.415 3.295 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12 ZINC000119820695 1413581813 /nfs/dbraw/zinc/58/18/13/1413581813.db2.gz GCJOHSXZEIAKQT-HNNXBMFYSA-N 0 0 382.420 3.418 20 5 GGBDRN C[C@@H](c1ccc(F)c(F)c1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000119827141 1413583959 /nfs/dbraw/zinc/58/39/59/1413583959.db2.gz OSIDPFSHMSECIJ-ZDUSSCGKSA-N 0 0 375.375 3.392 20 5 GGBDRN COC(=O)Cc1cccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000119830336 1413585694 /nfs/dbraw/zinc/58/56/94/1413585694.db2.gz JRSKHSHFDGVSAQ-UHFFFAOYSA-N 0 0 383.404 3.163 20 5 GGBDRN C[C@@H](c1cc(F)ccc1F)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000119833178 1413586470 /nfs/dbraw/zinc/58/64/70/1413586470.db2.gz HKASDEASPWNBRJ-ZDUSSCGKSA-N 0 0 375.375 3.392 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)c2ccc(OCC3CC3)c(F)c2)c1[N+](=O)[O-] ZINC000177442475 1428739010 /nfs/dbraw/zinc/73/90/10/1428739010.db2.gz NIOXZCJJEWOCMW-SNVBAGLBSA-N 0 0 376.388 3.299 20 5 GGBDRN CCCCNC(=O)[C@H]1CCCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)C1 ZINC000119839158 1413588614 /nfs/dbraw/zinc/58/86/14/1413588614.db2.gz RDRVAWTUPMXXES-HNNXBMFYSA-N 0 0 376.457 3.372 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2csc([N+](=O)[O-])c2)s1 ZINC000119845019 1413591062 /nfs/dbraw/zinc/59/10/62/1413591062.db2.gz RAZRYDVSSKXOHA-SECBINFHSA-N 0 0 375.497 3.365 20 5 GGBDRN 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ZINC000120324851 1413786978 /nfs/dbraw/zinc/78/69/78/1413786978.db2.gz LEISRGFNFRONKO-ZDUSSCGKSA-N 0 0 381.396 3.070 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)CN2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000120331929 1413790045 /nfs/dbraw/zinc/79/00/45/1413790045.db2.gz GBEACOFOWFHUJJ-UHFFFAOYSA-N 0 0 396.447 3.078 20 5 GGBDRN CC(C)[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(=O)OC(C)(C)C ZINC000120332168 1413790142 /nfs/dbraw/zinc/79/01/42/1413790142.db2.gz VCECHCBEQSSOFZ-HNNXBMFYSA-N 0 0 376.413 3.101 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC(Oc2ccccc2)CC1 ZINC000120334837 1413791796 /nfs/dbraw/zinc/79/17/96/1413791796.db2.gz CTQXCPAFKAPFON-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000120353520 1413800250 /nfs/dbraw/zinc/80/02/50/1413800250.db2.gz NSQXYPZPBAGBIB-LRDDRELGSA-N 0 0 386.433 3.084 20 5 GGBDRN CC(C)[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)OC(C)(C)C ZINC000120357191 1413801043 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C[C@H](CC(=O)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)c1ccncc1 ZINC000121927792 1414309962 /nfs/dbraw/zinc/30/99/62/1414309962.db2.gz VQAOIXJMCJMQJT-OAHLLOKOSA-N 0 0 384.436 3.338 20 5 GGBDRN Cc1cc(C(=O)Nc2nc(CN3C[C@@H](C)O[C@H](C)C3)cs2)cc([N+](=O)[O-])c1 ZINC000121928024 1414310152 /nfs/dbraw/zinc/31/01/52/1414310152.db2.gz VSTOZSNUXUKMCB-CHWSQXEVSA-N 0 0 390.465 3.221 20 5 GGBDRN CN(CC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000121932992 1414312917 /nfs/dbraw/zinc/31/29/17/1414312917.db2.gz XNRJAQSUHLOBLP-OAQYLSRUSA-N 0 0 394.406 3.471 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1[N+](=O)[O-] ZINC000121933431 1414313026 /nfs/dbraw/zinc/31/30/26/1414313026.db2.gz YYFLVYQUGGJCSK-ZFWWWQNUSA-N 0 0 387.415 3.076 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)c1[N+](=O)[O-] ZINC000121935800 1414313676 /nfs/dbraw/zinc/31/36/76/1414313676.db2.gz XDEHGYOQPAXWAH-CYBMUJFWSA-N 0 0 380.351 3.046 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CCC[C@H]2C(=O)N(C)C)cc1[N+](=O)[O-] ZINC000121959856 1414324020 /nfs/dbraw/zinc/32/40/20/1414324020.db2.gz WLEZHDHPDBOOTN-HNNXBMFYSA-N 0 0 393.509 3.426 20 5 GGBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc2c(cc1F)NC(=O)CC2 ZINC000121961386 1414324265 /nfs/dbraw/zinc/32/42/65/1414324265.db2.gz FPGMYCDVUKYRLW-UHFFFAOYSA-N 0 0 375.381 3.349 20 5 GGBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000121968819 1414326740 /nfs/dbraw/zinc/32/67/40/1414326740.db2.gz JZHQECNDBBCSIV-UHFFFAOYSA-N 0 0 395.350 3.057 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)cc1 ZINC000121975735 1414329156 /nfs/dbraw/zinc/32/91/56/1414329156.db2.gz AGHKAVWBUGZDSN-UHFFFAOYSA-N 0 0 381.432 3.064 20 5 GGBDRN Cc1c(CC(=O)N[C@](C)(CNC(=O)OC(C)(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000121975005 1414329307 /nfs/dbraw/zinc/32/93/07/1414329307.db2.gz DWBQXUKHFAQNPT-HXUWFJFHSA-N 0 0 391.468 3.255 20 5 GGBDRN COc1cccc2c1CC[C@H]2NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000121995386 1414334856 /nfs/dbraw/zinc/33/48/56/1414334856.db2.gz LJHRARXWPFZALC-GOSISDBHSA-N 0 0 378.388 3.206 20 5 GGBDRN Cc1nc(C2(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)CCCC2)no1 ZINC000122002242 1414336744 /nfs/dbraw/zinc/33/67/44/1414336744.db2.gz WPFFUWLBNSDKMY-UHFFFAOYSA-N 0 0 389.368 3.011 20 5 GGBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000122003257 1414337880 /nfs/dbraw/zinc/33/78/80/1414337880.db2.gz ZTLLTQZJPYQRGD-UHFFFAOYSA-N 0 0 395.350 3.057 20 5 GGBDRN CSC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000122005913 1414338431 /nfs/dbraw/zinc/33/84/31/1414338431.db2.gz WDKKKEAVRTVKOT-HNNXBMFYSA-N 0 0 389.477 3.051 20 5 GGBDRN Cc1cccc([C@@H](C)CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000122010587 1414340092 /nfs/dbraw/zinc/34/00/92/1414340092.db2.gz CYVYUCOTUFDKOP-LBPRGKRZSA-N 0 0 375.812 3.415 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000122015673 1414340878 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ZNCGJFJTMBINSM-UHFFFAOYSA-N 0 0 399.447 3.364 20 5 GGBDRN CCOC(=O)C[C@H](C)CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000122059335 1414352113 /nfs/dbraw/zinc/35/21/13/1414352113.db2.gz BXGACUWPRYBAMA-NSHDSACASA-N 0 0 377.422 3.037 20 5 GGBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OS(=O)(=O)C[C@H]1CCCO1 ZINC000177578591 1428801583 /nfs/dbraw/zinc/80/15/83/1428801583.db2.gz QJIQZFQXJRSQJI-MRXNPFEDSA-N 0 0 377.418 3.073 20 5 GGBDRN Cc1cc(C(=O)NCc2cccc(C(=O)NCc3ccco3)c2)cc([N+](=O)[O-])c1 ZINC000122089120 1414360153 /nfs/dbraw/zinc/36/01/53/1414360153.db2.gz KOBOBVONEQOKCA-UHFFFAOYSA-N 0 0 393.399 3.356 20 5 GGBDRN O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])c1cc(N2CCNC2=O)ccc1F ZINC000122093894 1414361698 /nfs/dbraw/zinc/36/16/98/1414361698.db2.gz ODPAEJXVDCFVFZ-UHFFFAOYSA-N 0 0 379.731 3.136 20 5 GGBDRN CC(C)n1c2ccccc2nc1[C@H]1CCCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 ZINC000122107973 1414364796 /nfs/dbraw/zinc/36/47/96/1414364796.db2.gz PTIJKOBMZLHYBK-AWEZNQCLSA-N 0 0 396.451 3.279 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)OC1(c2ccccc2Br)CC1 ZINC000122113882 1414366204 /nfs/dbraw/zinc/36/62/04/1414366204.db2.gz BJZMVMYKMRDOBN-UHFFFAOYSA-N 0 0 380.198 3.176 20 5 GGBDRN C[C@@H]1CN(c2ccccc2NC(=O)COc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000122141207 1414372171 /nfs/dbraw/zinc/37/21/71/1414372171.db2.gz HLIMBSCYCJUPKG-GASCZTMLSA-N 0 0 385.420 3.226 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cnn1-c1ccccc1 ZINC000122142078 1414372564 /nfs/dbraw/zinc/37/25/64/1414372564.db2.gz XJMKKSALCGMPKG-UHFFFAOYSA-N 0 0 393.403 3.283 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cnn1CCC(C)C ZINC000122143992 1414373122 /nfs/dbraw/zinc/37/31/22/1414373122.db2.gz PERLQZRRECDFSG-UHFFFAOYSA-N 0 0 387.440 3.340 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000122150464 1414374294 /nfs/dbraw/zinc/37/42/94/1414374294.db2.gz WWLQPIYBWOHJGX-CYBMUJFWSA-N 0 0 399.447 3.154 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000122150288 1414374561 /nfs/dbraw/zinc/37/45/61/1414374561.db2.gz WWLQPIYBWOHJGX-ZDUSSCGKSA-N 0 0 399.447 3.154 20 5 GGBDRN COc1ccc(NC(=O)CCCNC(=O)c2ccc(F)cc2F)c([N+](=O)[O-])c1 ZINC000122155337 1414375383 /nfs/dbraw/zinc/37/53/83/1414375383.db2.gz XLMFYFPWZFIVQW-UHFFFAOYSA-N 0 0 393.346 3.030 20 5 GGBDRN C[C@@H](Oc1ccc2c(c1)oc(=O)cc2-c1ccc([N+](=O)[O-])cc1)C(=O)NC1CC1 ZINC000122167418 1414378787 /nfs/dbraw/zinc/37/87/87/1414378787.db2.gz DEFDBPXPJWFSDH-GFCCVEGCSA-N 0 0 394.383 3.414 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H](C)c1cccc(F)c1F ZINC000122176690 1414380751 /nfs/dbraw/zinc/38/07/51/1414380751.db2.gz WTKIRUOKPPKYCM-NSHDSACASA-N 0 0 377.347 3.306 20 5 GGBDRN COc1ccc(C[C@H](C)CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000122208957 1414388781 /nfs/dbraw/zinc/38/87/81/1414388781.db2.gz JGEATMLNOFUOAZ-AWEZNQCLSA-N 0 0 378.450 3.103 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000122210543 1414389163 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YJSADNGUOHFDRZ-UHFFFAOYSA-N 0 0 395.419 3.235 20 5 GGBDRN C[C@@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C(=O)N1CCCC[C@H]1C ZINC000122310800 1414420686 /nfs/dbraw/zinc/42/06/86/1414420686.db2.gz AKPUKJDJSOBALX-HUUCEWRRSA-N 0 0 388.468 3.058 20 5 GGBDRN CCc1ccccc1CNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000122325829 1414424312 /nfs/dbraw/zinc/42/43/12/1414424312.db2.gz HGWPPIZFDAKDEQ-HNNXBMFYSA-N 0 0 387.461 3.140 20 5 GGBDRN Cc1cccc([C@H](O)CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000122343374 1414429177 /nfs/dbraw/zinc/42/91/77/1414429177.db2.gz ZSPFEAHKKACJAS-CQSZACIVSA-N 0 0 381.335 3.360 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCCOCCc2ccccc2)C1=O ZINC000122346411 1414430401 /nfs/dbraw/zinc/43/04/01/1414430401.db2.gz CQFFCPWOOWHBMH-OAQYLSRUSA-N 0 0 397.431 3.011 20 5 GGBDRN Cc1cc(CN2CCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)on1 ZINC000122355556 1414433086 /nfs/dbraw/zinc/43/30/86/1414433086.db2.gz XJSDAQHISGWODJ-UHFFFAOYSA-N 0 0 382.420 3.469 20 5 GGBDRN CC(C)OCCOC[C@@H](O)CN(C)c1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000122367158 1414436764 /nfs/dbraw/zinc/43/67/64/1414436764.db2.gz OILOXQUDYYOHDK-LBPRGKRZSA-N 0 0 381.256 3.140 20 5 GGBDRN Cc1cc(CN2CCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)on1 ZINC000122378518 1414440300 /nfs/dbraw/zinc/44/03/00/1414440300.db2.gz NSVXPSWKMQXQTI-UHFFFAOYSA-N 0 0 382.420 3.469 20 5 GGBDRN CC[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000177606596 1428808899 /nfs/dbraw/zinc/80/88/99/1428808899.db2.gz ZFDQPDQQIHPRKP-SJORKVTESA-N 0 0 389.477 3.066 20 5 GGBDRN CC[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000177606630 1428809076 /nfs/dbraw/zinc/80/90/76/1428809076.db2.gz ZFDQPDQQIHPRKP-IAGOWNOFSA-N 0 0 389.477 3.066 20 5 GGBDRN COc1cccc2c1CC[C@@H]2NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000122411001 1414450385 /nfs/dbraw/zinc/45/03/85/1414450385.db2.gz QRKSDUJQZGVHHF-SFHVURJKSA-N 0 0 392.415 3.421 20 5 GGBDRN CCNC(=O)c1cccc(OC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000122414869 1414452165 /nfs/dbraw/zinc/45/21/65/1414452165.db2.gz JLQNIHSKDJABPC-UHFFFAOYSA-N 0 0 393.193 3.326 20 5 GGBDRN CCc1ccc(C(=O)OCCCc2nc3nc(C)cc(C)n3n2)cc1[N+](=O)[O-] ZINC000177608335 1428809687 /nfs/dbraw/zinc/80/96/87/1428809687.db2.gz VSAXISYJYXWMAH-UHFFFAOYSA-N 0 0 383.408 3.001 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2ncnc3sccc32)CC1 ZINC000122427203 1414456687 /nfs/dbraw/zinc/45/66/87/1414456687.db2.gz CPGLXWPYCQPUOY-UHFFFAOYSA-N 0 0 398.448 3.262 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)cc2)CCO1 ZINC000122428562 1414457129 /nfs/dbraw/zinc/45/71/29/1414457129.db2.gz BSILZBUYHWBOGZ-AWEZNQCLSA-N 0 0 394.431 3.482 20 5 GGBDRN CS(=O)(=O)c1ccc(-c2nc(CSc3ncccc3[N+](=O)[O-])co2)cc1 ZINC000122444249 1414461906 /nfs/dbraw/zinc/46/19/06/1414461906.db2.gz HVXOAVWWQHNSHM-UHFFFAOYSA-N 0 0 391.430 3.341 20 5 GGBDRN COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000122442829 1414461942 /nfs/dbraw/zinc/46/19/42/1414461942.db2.gz 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CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000122544323 1414495737 /nfs/dbraw/zinc/49/57/37/1414495737.db2.gz RZDACQOWOMKTBI-SFHVURJKSA-N 0 0 380.404 3.070 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCc2ccccc2CN2CCCC2=O)c1[N+](=O)[O-] ZINC000122554093 1414498751 /nfs/dbraw/zinc/49/87/51/1414498751.db2.gz BLRGZLDUEIEAMM-UHFFFAOYSA-N 0 0 385.395 3.095 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(C(=O)Nc3ccncc3)cc2)ccc1[N+](=O)[O-] ZINC000122572408 1414504675 /nfs/dbraw/zinc/50/46/75/1414504675.db2.gz DVZTUODGNATENF-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCO[C@H](c2ccc(F)c(C)c2)C1 ZINC000122589452 1414509379 /nfs/dbraw/zinc/50/93/79/1414509379.db2.gz ODTRDIJIBHNYKE-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1 ZINC000122591510 1414510474 /nfs/dbraw/zinc/51/04/74/1414510474.db2.gz JFHYYTPCGOPSQB-UHFFFAOYSA-N 0 0 386.364 3.122 20 5 GGBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Br)n1 ZINC000122598836 1414511982 /nfs/dbraw/zinc/51/19/82/1414511982.db2.gz HHGFWBMVQWVPSR-UHFFFAOYSA-N 0 0 380.198 3.046 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)cc1Cl ZINC000122613501 1414517559 /nfs/dbraw/zinc/51/75/59/1414517559.db2.gz CYIIKEFQGIMERO-UHFFFAOYSA-N 0 0 393.802 3.465 20 5 GGBDRN C[C@H](c1ccccc1)N1C[C@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC1=O ZINC000122618253 1414518789 /nfs/dbraw/zinc/51/87/89/1414518789.db2.gz DQMAWQOXIFHGKC-TZMCWYRMSA-N 0 0 393.403 3.019 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCO[C@@H](c3ccc(F)c(C)c3)C2)c([N+](=O)[O-])c1 ZINC000122618001 1414518842 /nfs/dbraw/zinc/51/88/42/1414518842.db2.gz HBPQBJJDROZFCZ-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCO[C@H](c3ccc(F)c(C)c3)C2)c([N+](=O)[O-])c1 ZINC000122617808 1414519050 /nfs/dbraw/zinc/51/90/50/1414519050.db2.gz HBPQBJJDROZFCZ-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)c(F)c1 ZINC000122620379 1414519497 /nfs/dbraw/zinc/51/94/97/1414519497.db2.gz NNSIPCQPDDLGNS-CYBMUJFWSA-N 0 0 382.388 3.126 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000122621924 1414520646 /nfs/dbraw/zinc/52/06/46/1414520646.db2.gz IKSVBWXMDMEPSM-HNNXBMFYSA-N 0 0 382.376 3.281 20 5 GGBDRN C[C@@H]1CCc2ccccc2[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000122624655 1414521544 /nfs/dbraw/zinc/52/15/44/1414521544.db2.gz UQUYRFGTKYXTCQ-XIKOKIGWSA-N 0 0 388.445 3.052 20 5 GGBDRN C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000122624143 1414521664 /nfs/dbraw/zinc/52/16/64/1414521664.db2.gz UQUYRFGTKYXTCQ-KZULUSFZSA-N 0 0 388.445 3.052 20 5 GGBDRN C[C@H]1CCc2ccccc2[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000122624882 1414521737 /nfs/dbraw/zinc/52/17/37/1414521737.db2.gz UQUYRFGTKYXTCQ-SGTLLEGYSA-N 0 0 388.445 3.052 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000122637128 1414525032 /nfs/dbraw/zinc/52/50/32/1414525032.db2.gz VRTJDZRARGIAEF-JSGCOSHPSA-N 0 0 394.424 3.309 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000122637616 1414525758 /nfs/dbraw/zinc/52/57/58/1414525758.db2.gz VRTJDZRARGIAEF-GXTWGEPZSA-N 0 0 394.424 3.309 20 5 GGBDRN CCO[C@@H](C)c1nc(CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cs1 ZINC000122642774 1414527079 /nfs/dbraw/zinc/52/70/79/1414527079.db2.gz OBNWJWZOTFKPHR-VIFPVBQESA-N 0 0 375.410 3.206 20 5 GGBDRN C[C@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1cccc(F)c1 ZINC000122644168 1414527675 /nfs/dbraw/zinc/52/76/75/1414527675.db2.gz PPNKDOIEABJBCF-OAHLLOKOSA-N 0 0 399.422 3.212 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000122649822 1414528710 /nfs/dbraw/zinc/52/87/10/1414528710.db2.gz AUMPCNNHJKZYET-LPHOPBHVSA-N 0 0 387.411 3.261 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000122650044 1414528727 /nfs/dbraw/zinc/52/87/27/1414528727.db2.gz AUMPCNNHJKZYET-VQIMIIECSA-N 0 0 387.411 3.261 20 5 GGBDRN CC[C@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122657341 1414530921 /nfs/dbraw/zinc/53/09/21/1414530921.db2.gz LBUZNTAJKJXMCE-QGZVFWFLSA-N 0 0 387.480 3.486 20 5 GGBDRN O=C(CCSc1ccccc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122656436 1414531203 /nfs/dbraw/zinc/53/12/03/1414531203.db2.gz CXRSDEMLZMVLRN-UHFFFAOYSA-N 0 0 399.472 3.062 20 5 GGBDRN CCc1noc(CC)c1CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000122662022 1414532473 /nfs/dbraw/zinc/53/24/73/1414532473.db2.gz NXGZXMXFRUTDEX-UHFFFAOYSA-N 0 0 383.408 3.038 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000122665200 1414533076 /nfs/dbraw/zinc/53/30/76/1414533076.db2.gz SUSKNYRODVHGHY-DGCLKSJQSA-N 0 0 382.388 3.440 20 5 GGBDRN CCc1noc(CC)c1CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000122668858 1414533372 /nfs/dbraw/zinc/53/33/72/1414533372.db2.gz SNKPXEZWRAEPSK-UHFFFAOYSA-N 0 0 386.452 3.240 20 5 GGBDRN COc1ccc(C)cc1-n1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)n1 ZINC000122673731 1414535023 /nfs/dbraw/zinc/53/50/23/1414535023.db2.gz RHIDKBLXYBZVFD-UHFFFAOYSA-N 0 0 392.375 3.226 20 5 GGBDRN Cc1cccn2cc(CCNC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)nc12 ZINC000122675723 1414535767 /nfs/dbraw/zinc/53/57/67/1414535767.db2.gz AHZVYIWNSLNXCG-UHFFFAOYSA-N 0 0 393.447 3.468 20 5 GGBDRN Cc1sc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2Cl)cc1[N+](=O)[O-] ZINC000122677059 1414536604 /nfs/dbraw/zinc/53/66/04/1414536604.db2.gz STGXOBFDNVSWBH-UHFFFAOYSA-N 0 0 378.771 3.294 20 5 GGBDRN O=C(c1cc2cc(F)ccc2o1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122688684 1414539318 /nfs/dbraw/zinc/53/93/18/1414539318.db2.gz APBAABUAWUNLMA-UHFFFAOYSA-N 0 0 397.362 3.078 20 5 GGBDRN CCc1ccc(CCC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000122699236 1414541818 /nfs/dbraw/zinc/54/18/18/1414541818.db2.gz BUVDESSGJYSWIM-UHFFFAOYSA-N 0 0 395.459 3.074 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@@H]2CCC(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000122701152 1414542317 /nfs/dbraw/zinc/54/23/17/1414542317.db2.gz XXYFRKDHQXFFSU-MRXNPFEDSA-N 0 0 398.463 3.490 20 5 GGBDRN Cc1ccc(C(C)(C)C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000122720481 1414547881 /nfs/dbraw/zinc/54/78/81/1414547881.db2.gz OHGWDAMIQZNLOT-UHFFFAOYSA-N 0 0 395.459 3.165 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000122718716 1414547897 /nfs/dbraw/zinc/54/78/97/1414547897.db2.gz QNFXAXXGZSYIEC-IAQYHMDHSA-N 0 0 384.841 3.039 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2ccc3c(c2)CCCC3)CC1 ZINC000122725325 1414549798 /nfs/dbraw/zinc/54/97/98/1414549798.db2.gz UIHLWOQGBPETIR-UHFFFAOYSA-N 0 0 393.443 3.072 20 5 GGBDRN CCC[C@@H](C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000122727735 1414550080 /nfs/dbraw/zinc/55/00/80/1414550080.db2.gz QFOBZWNLKDYUER-HXUWFJFHSA-N 0 0 395.459 3.463 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])n1 ZINC000122727381 1414550364 /nfs/dbraw/zinc/55/03/64/1414550364.db2.gz BVPHSBVUYDCJKQ-CQSZACIVSA-N 0 0 381.841 3.477 20 5 GGBDRN C[C@H]1CCc2ccccc2[C@@H]1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000122730073 1414550671 /nfs/dbraw/zinc/55/06/71/1414550671.db2.gz FNXJBNHGWSVINK-ORAYPTAESA-N 0 0 377.404 3.229 20 5 GGBDRN C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000122729825 1414550979 /nfs/dbraw/zinc/55/09/79/1414550979.db2.gz FNXJBNHGWSVINK-BFUOFWGJSA-N 0 0 377.404 3.229 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122730395 1414551399 /nfs/dbraw/zinc/55/13/99/1414551399.db2.gz YHWQNXICNCHISU-UHFFFAOYSA-N 0 0 390.403 3.455 20 5 GGBDRN CCc1ccc([C@H](C)C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000122730803 1414551589 /nfs/dbraw/zinc/55/15/89/1414551589.db2.gz IXBVSUOJIRIVDW-INIZCTEOSA-N 0 0 395.459 3.245 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1cccn(Cc2ccccc2)c1=O ZINC000122736810 1414552842 /nfs/dbraw/zinc/55/28/42/1414552842.db2.gz ZVAUBTSVBMSHKW-JLHYYAGUSA-N 0 0 375.384 3.457 20 5 GGBDRN O=C(CC[C@@H]1Cc2ccccc2NC1=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122738283 1414553270 /nfs/dbraw/zinc/55/32/70/1414553270.db2.gz ZCGGYDFQJOHRFG-GFCCVEGCSA-N 0 0 379.376 3.001 20 5 GGBDRN Cc1c2ccccc2oc1C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122739590 1414553582 /nfs/dbraw/zinc/55/35/82/1414553582.db2.gz CNIWKRSTRIELJF-UHFFFAOYSA-N 0 0 393.399 3.248 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1ccc(-n2cccn2)cc1 ZINC000122746109 1414555208 /nfs/dbraw/zinc/55/52/08/1414555208.db2.gz OCAOIPWVCHLAEH-UHFFFAOYSA-N 0 0 381.392 3.153 20 5 GGBDRN CC(C)(C)c1nc2cc(NC(=O)C(=O)NCc3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC000122749199 1414555991 /nfs/dbraw/zinc/55/59/91/1414555991.db2.gz SKSNUFNIDAMBOE-UHFFFAOYSA-N 0 0 396.403 3.288 20 5 GGBDRN Cc1[nH]c(=O)c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1-c1ccccc1 ZINC000122754698 1414557159 /nfs/dbraw/zinc/55/71/59/1414557159.db2.gz KTJKOFCSWDZSPV-UHFFFAOYSA-N 0 0 389.371 3.387 20 5 GGBDRN CN(CC(=O)Nc1ccc(Oc2cccnc2)nc1)c1ccccc1[N+](=O)[O-] ZINC000122757299 1414557433 /nfs/dbraw/zinc/55/74/33/1414557433.db2.gz DUMGOSDPFVXWNX-UHFFFAOYSA-N 0 0 379.376 3.252 20 5 GGBDRN CCC[C@H](C)[C@H]1CCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000122757294 1414557540 /nfs/dbraw/zinc/55/75/40/1414557540.db2.gz ZRWYELRSTCKYPO-GOEBONIOSA-N 0 0 398.463 3.490 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000122762507 1414558164 /nfs/dbraw/zinc/55/81/64/1414558164.db2.gz JOYWHXADHLZMIH-GFCCVEGCSA-N 0 0 377.784 3.032 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000122771970 1414560697 /nfs/dbraw/zinc/56/06/97/1414560697.db2.gz SKVHKUWPWNKBEN-SFHVURJKSA-N 0 0 388.786 3.490 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000122777183 1414562136 /nfs/dbraw/zinc/56/21/36/1414562136.db2.gz LAEAAWQKDRSQFT-ABAIWWIYSA-N 0 0 384.841 3.039 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cnn2c1nccc2-c1ccccc1 ZINC000122775894 1414562148 /nfs/dbraw/zinc/56/21/48/1414562148.db2.gz MLSAMBVKXZMQLJ-UHFFFAOYSA-N 0 0 399.370 3.433 20 5 GGBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])Nc1cccnc1Cl ZINC000122779125 1414562663 /nfs/dbraw/zinc/56/26/63/1414562663.db2.gz VNATZINZMKXHNY-UHFFFAOYSA-N 0 0 386.589 3.423 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000122782649 1414563881 /nfs/dbraw/zinc/56/38/81/1414563881.db2.gz QUTINDVWMSAOPG-UHFFFAOYSA-N 0 0 396.230 3.255 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC[C@H](COc2ccccc2Cl)C1 ZINC000122784302 1414564268 /nfs/dbraw/zinc/56/42/68/1414564268.db2.gz RVZPNKSOOZDMPM-AWEZNQCLSA-N 0 0 392.843 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(C2CC2)S(=O)(=O)c2cnn(-c3ccccc3)c2)cc1 ZINC000122784772 1414564486 /nfs/dbraw/zinc/56/44/86/1414564486.db2.gz UJBCTWDGZTZPQV-UHFFFAOYSA-N 0 0 398.444 3.134 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(C2CC2)S(=O)(=O)c2c(F)cc(F)cc2F)cc1 ZINC000122784549 1414564548 /nfs/dbraw/zinc/56/45/48/1414564548.db2.gz VLCGYMCCGXMLLN-UHFFFAOYSA-N 0 0 386.351 3.365 20 5 GGBDRN Cc1ccc(CC(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cn1 ZINC000122792492 1414566147 /nfs/dbraw/zinc/56/61/47/1414566147.db2.gz VHYBRJUWTHRZHG-QGZVFWFLSA-N 0 0 385.420 3.040 20 5 GGBDRN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122803425 1414568742 /nfs/dbraw/zinc/56/87/42/1414568742.db2.gz OUTUVSGVSYDIPR-SFHVURJKSA-N 0 0 391.387 3.374 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122805195 1414569259 /nfs/dbraw/zinc/56/92/59/1414569259.db2.gz REKCUFAYUMNCAR-SECBINFHSA-N 0 0 387.377 3.499 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3oc(=O)ccc3c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122831828 1414575499 /nfs/dbraw/zinc/57/54/99/1414575499.db2.gz IJOVGXMJGVGSIP-UHFFFAOYSA-N 0 0 383.316 3.479 20 5 GGBDRN COc1cc(C)nc(COC(=O)c2cc([N+](=O)[O-])ccc2Br)c1 ZINC000122832136 1414575723 /nfs/dbraw/zinc/57/57/23/1414575723.db2.gz BNBBCHPFRFDVRE-UHFFFAOYSA-N 0 0 381.182 3.426 20 5 GGBDRN CCn1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1cccnc1 ZINC000122834251 1414576214 /nfs/dbraw/zinc/57/62/14/1414576214.db2.gz LTHRIJOGABUERX-UHFFFAOYSA-N 0 0 398.448 3.023 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1 ZINC000122838794 1414577561 /nfs/dbraw/zinc/57/75/61/1414577561.db2.gz JWZJTYABEBASHF-LBPRGKRZSA-N 0 0 397.391 3.460 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1 ZINC000122838968 1414578247 /nfs/dbraw/zinc/57/82/47/1414578247.db2.gz JWZJTYABEBASHF-GFCCVEGCSA-N 0 0 397.391 3.460 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CC(=O)N(c2ccccc2Cl)C1 ZINC000122854556 1414581058 /nfs/dbraw/zinc/58/10/58/1414581058.db2.gz MGGKYCGESOGLLF-JTQLQIEISA-N 0 0 399.794 3.116 20 5 GGBDRN CC(C)(C(=O)NCCCOc1ccc2ccccc2c1)n1cc([N+](=O)[O-])cn1 ZINC000122871359 1414585670 /nfs/dbraw/zinc/58/56/70/1414585670.db2.gz ZYXMTJYVSAWAJO-UHFFFAOYSA-N 0 0 382.420 3.265 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000122874393 1414586609 /nfs/dbraw/zinc/58/66/09/1414586609.db2.gz YZTSBMRNFNXAPE-GFCCVEGCSA-N 0 0 386.412 3.010 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(Cc1ccccc1)[C@H](CO)C1CC1 ZINC000122881914 1414587584 /nfs/dbraw/zinc/58/75/84/1414587584.db2.gz NUZSBFXHTZRIMM-GOSISDBHSA-N 0 0 385.420 3.408 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H](CCO)c1ccccc1 ZINC000122882167 1414588163 /nfs/dbraw/zinc/58/81/63/1414588163.db2.gz HNQFTIJPCUZIDZ-HNNXBMFYSA-N 0 0 398.868 3.301 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC1(c2cccc(Cl)c2)CC1 ZINC000122912447 1414595088 /nfs/dbraw/zinc/59/50/88/1414595088.db2.gz IYOIWFLRWBGSNR-UHFFFAOYSA-N 0 0 387.823 3.343 20 5 GGBDRN COc1ccc([C@@H](CCO)NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000122914745 1414595521 /nfs/dbraw/zinc/59/55/21/1414595521.db2.gz NDPPGTIJVDYRML-RDTXWAMCSA-N 0 0 387.436 3.396 20 5 GGBDRN 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ARTVPGRXKTXGQA-MHZLTWQESA-N 0 0 387.461 3.206 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCO[C@H](c2ccco2)C1 ZINC000123011997 1414619238 /nfs/dbraw/zinc/61/92/38/1414619238.db2.gz MBAFWZRXKXUDJE-AWEZNQCLSA-N 0 0 383.307 3.395 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1(c2ccc(Cl)cc2)CCCC1 ZINC000123042491 1414626506 /nfs/dbraw/zinc/62/65/06/1414626506.db2.gz OGEBWCBGGWYJFH-UHFFFAOYSA-N 0 0 389.839 3.038 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(N3CCCCC3)cn2)cc1[N+](=O)[O-] ZINC000123050870 1414627846 /nfs/dbraw/zinc/62/78/46/1414627846.db2.gz QNANWIOFWXJCPA-UHFFFAOYSA-N 0 0 385.380 3.449 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])c(F)c1 ZINC000123050757 1414627935 /nfs/dbraw/zinc/62/79/35/1414627935.db2.gz FFROHGSNKIDXSS-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OS(=O)(=O)CC[C@H]1CCCO1 ZINC000123060090 1414630378 /nfs/dbraw/zinc/63/03/78/1414630378.db2.gz QWDBJFYJLBQDFT-QGZVFWFLSA-N 0 0 391.445 3.463 20 5 GGBDRN 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1414648110 /nfs/dbraw/zinc/64/81/10/1414648110.db2.gz HEOSYUCURPDUIB-UHFFFAOYSA-N 0 0 399.472 3.371 20 5 GGBDRN Cc1cc(C(=O)NC[C@H](O)COc2ccc(C(F)(F)F)cc2)cc([N+](=O)[O-])c1 ZINC000123134199 1414650613 /nfs/dbraw/zinc/65/06/13/1414650613.db2.gz NHTJZBTWTIPGKV-HNNXBMFYSA-N 0 0 398.337 3.092 20 5 GGBDRN CC(C)c1ncc(C(=O)OCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000123138110 1414651229 /nfs/dbraw/zinc/65/12/29/1414651229.db2.gz KKKIJUQELGNYIO-UHFFFAOYSA-N 0 0 397.840 3.415 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000123142113 1414652489 /nfs/dbraw/zinc/65/24/89/1414652489.db2.gz YWTPTWFWHBDFCO-UHFFFAOYSA-N 0 0 397.431 3.043 20 5 GGBDRN O=C(Nc1ccc(C(F)(F)F)cc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000123149126 1414654455 /nfs/dbraw/zinc/65/44/55/1414654455.db2.gz SZTVCAYIKZILEP-UHFFFAOYSA-N 0 0 393.321 3.137 20 5 GGBDRN O=C(NCc1cc2ccccc2o1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000123185966 1414663038 /nfs/dbraw/zinc/66/30/38/1414663038.db2.gz CBWKKBKZEYPGBX-UHFFFAOYSA-N 0 0 380.404 3.373 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCC2(c3ccc(F)cc3F)CC2)cc1 ZINC000123185428 1414663078 /nfs/dbraw/zinc/66/30/78/1414663078.db2.gz GKIHDZBQYXDWNN-UHFFFAOYSA-N 0 0 382.388 3.024 20 5 GGBDRN O=C(NCc1cc2ccccc2o1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000123187522 1414664145 /nfs/dbraw/zinc/66/41/45/1414664145.db2.gz OQOKMFKYTZUAIH-UHFFFAOYSA-N 0 0 380.404 3.373 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(-c1ccc([N+](=O)[O-])cc1)n2C ZINC000123202150 1414666921 /nfs/dbraw/zinc/66/69/21/1414666921.db2.gz DRNYBQVKKIWIED-UHFFFAOYSA-N 0 0 388.449 3.179 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ncccc2F)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000123208136 1414668371 /nfs/dbraw/zinc/66/83/71/1414668371.db2.gz CHNIFVKYXDQMBD-OAHLLOKOSA-N 0 0 399.426 3.082 20 5 GGBDRN CCn1cc(C(=O)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cn1 ZINC000123209056 1414668447 /nfs/dbraw/zinc/66/84/47/1414668447.db2.gz JEYTWAISISUFTE-UHFFFAOYSA-N 0 0 385.405 3.065 20 5 GGBDRN Cc1ccccc1OCCCN(C)C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000123212132 1414669738 /nfs/dbraw/zinc/66/97/38/1414669738.db2.gz LQQVNCLEQZVHTP-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN Cc1ccccc1OCCCN(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000123216897 1414670877 /nfs/dbraw/zinc/67/08/77/1414670877.db2.gz SBFRVLFQVOZWJK-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCCc1nnc(-c2ccccc2)o1 ZINC000177664837 1428826925 /nfs/dbraw/zinc/82/69/25/1428826925.db2.gz IGRWEFMVFZFLCA-UHFFFAOYSA-N 0 0 384.417 3.096 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@@H]3CCC[C@H](O)C3)cc2[N+](=O)[O-])C1 ZINC000123223622 1414672009 /nfs/dbraw/zinc/67/20/09/1414672009.db2.gz BLQLUCRYZHFZJA-HPFXQQBRSA-N 0 0 389.496 3.358 20 5 GGBDRN O=C(NC[C@](O)(c1ccccc1)C(F)(F)F)c1cccc(Cl)c1[N+](=O)[O-] ZINC000177665530 1428827654 /nfs/dbraw/zinc/82/76/54/1428827654.db2.gz WJDALQVKYLUQCV-HNNXBMFYSA-N 0 0 388.729 3.428 20 5 GGBDRN Cc1cc(-c2nnn(CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)n2)ccc1F ZINC000123268711 1414683696 /nfs/dbraw/zinc/68/36/96/1414683696.db2.gz ILHDGDSGNOHIFX-UHFFFAOYSA-N 0 0 384.371 3.033 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1ccc([S@](C)=O)cc1 ZINC000177667183 1428827954 /nfs/dbraw/zinc/82/79/54/1428827954.db2.gz AQMNANUVFLVRIW-NRRJATNASA-N 0 0 392.502 3.471 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1OC ZINC000123284464 1414686928 /nfs/dbraw/zinc/68/69/28/1414686928.db2.gz XVVAQFFYXVZEHJ-LLVKDONJSA-N 0 0 394.374 3.499 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1OC ZINC000123284270 1414687228 /nfs/dbraw/zinc/68/72/28/1414687228.db2.gz XVVAQFFYXVZEHJ-NSHDSACASA-N 0 0 394.374 3.499 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccnn2CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000123301697 1414691915 /nfs/dbraw/zinc/69/19/15/1414691915.db2.gz TVBBAFDAJJYYGS-UHFFFAOYSA-N 0 0 396.403 3.060 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000123317185 1414695080 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ZINC000177743949 1428848210 /nfs/dbraw/zinc/84/82/10/1428848210.db2.gz DQRQQASUZJFCGQ-UHFFFAOYSA-N 0 0 389.452 3.143 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@@H](C)Sc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000177756885 1428851111 /nfs/dbraw/zinc/85/11/11/1428851111.db2.gz BPCBSSZLJDBEPV-VXGBXAGGSA-N 0 0 377.470 3.269 20 5 GGBDRN O=C(CNc1ccc(Cl)c([N+](=O)[O-])c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000124280642 1414927961 /nfs/dbraw/zinc/92/79/61/1414927961.db2.gz IYUDELVWOROKQE-UHFFFAOYSA-N 0 0 376.756 3.158 20 5 GGBDRN C[C@H](C[C@H](O)c1ccco1)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000124288531 1414929946 /nfs/dbraw/zinc/92/99/46/1414929946.db2.gz DUDWOFWRIGAFDI-GYSYKLTISA-N 0 0 382.800 3.237 20 5 GGBDRN O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000124291064 1414931022 /nfs/dbraw/zinc/93/10/22/1414931022.db2.gz VXRNZZFMHWESGK-DNVCBOLYSA-N 0 0 391.493 3.324 20 5 GGBDRN Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000124328523 1414940915 /nfs/dbraw/zinc/94/09/15/1414940915.db2.gz MANYYBHHASJEKX-MRXNPFEDSA-N 0 0 397.456 3.227 20 5 GGBDRN Cc1nc(-c2ccc(NC(=O)COc3ccccc3[N+](=O)[O-])cc2Cl)n[nH]1 ZINC000124331918 1414941532 /nfs/dbraw/zinc/94/15/32/1414941532.db2.gz KXFVJSANVRZDAQ-UHFFFAOYSA-N 0 0 387.783 3.359 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000124350413 1414946635 /nfs/dbraw/zinc/94/66/35/1414946635.db2.gz NZWWWMMCRUCYND-CQSZACIVSA-N 0 0 375.381 3.026 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCSc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000124361605 1414949461 /nfs/dbraw/zinc/94/94/61/1414949461.db2.gz UHHNDGLYFWREPG-CQSZACIVSA-N 0 0 389.408 3.334 20 5 GGBDRN COc1ccc(Oc2ccc(CCNC(=O)c3[nH]ncc3[N+](=O)[O-])cc2)cc1 ZINC000124386828 1414954892 /nfs/dbraw/zinc/95/48/92/1414954892.db2.gz XRQJYAWGHONJMO-UHFFFAOYSA-N 0 0 382.376 3.091 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1csc(-c2cccc(Cl)c2)n1 ZINC000177754795 1428850732 /nfs/dbraw/zinc/85/07/32/1428850732.db2.gz QSVKDULJMVRBGO-UHFFFAOYSA-N 0 0 378.797 3.425 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000124400872 1414958942 /nfs/dbraw/zinc/95/89/42/1414958942.db2.gz RQQABBCGWRIHQP-UHFFFAOYSA-N 0 0 382.416 3.355 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000124410246 1414961917 /nfs/dbraw/zinc/96/19/17/1414961917.db2.gz VAQNYRGBXJWWHR-QGZVFWFLSA-N 0 0 382.338 3.401 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NCc2nc(C3CC3)cs2)cc([N+](=O)[O-])c1 ZINC000124437641 1414968271 /nfs/dbraw/zinc/96/82/71/1414968271.db2.gz QLTCEJVPDJLGSA-UHFFFAOYSA-N 0 0 375.406 3.035 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000124454992 1414972775 /nfs/dbraw/zinc/97/27/75/1414972775.db2.gz KGMJCYXZIIYSIH-GFCCVEGCSA-N 0 0 375.454 3.053 20 5 GGBDRN CC(C)c1c(C(=O)OCCn2cc([N+](=O)[O-])cn2)cnn1-c1ccc(F)cc1 ZINC000177761336 1428852268 /nfs/dbraw/zinc/85/22/68/1428852268.db2.gz KUKUWKIHXYCPIS-UHFFFAOYSA-N 0 0 387.371 3.097 20 5 GGBDRN O=C(Nc1cccc(C(=O)OCCn2cc([N+](=O)[O-])cn2)c1)C1CCCCC1 ZINC000177764185 1428852849 /nfs/dbraw/zinc/85/28/49/1428852849.db2.gz NTCOITJNOLEXCI-UHFFFAOYSA-N 0 0 386.408 3.167 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC(OCCc2ccccc2)CC1 ZINC000124516512 1414985115 /nfs/dbraw/zinc/98/51/15/1414985115.db2.gz ISGVXPPGIGKGOJ-UHFFFAOYSA-N 0 0 394.431 3.335 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000124515618 1414985242 /nfs/dbraw/zinc/98/52/42/1414985242.db2.gz ZWPFNJVHSCFVFX-QGZVFWFLSA-N 0 0 398.337 3.367 20 5 GGBDRN O=C1NCCN(Cc2c(F)cccc2[N+](=O)[O-])[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000124520619 1414986493 /nfs/dbraw/zinc/98/64/93/1414986493.db2.gz GECSYYUKQPTQNR-MRXNPFEDSA-N 0 0 397.328 3.426 20 5 GGBDRN CC(C)c1noc2nc(C3CC3)cc(C(=O)OCCn3cc([N+](=O)[O-])cn3)c21 ZINC000177766805 1428853834 /nfs/dbraw/zinc/85/38/34/1428853834.db2.gz HYCKJCDOUHXUON-UHFFFAOYSA-N 0 0 385.380 3.185 20 5 GGBDRN COc1cc(NC2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1 ZINC000124594799 1415001542 /nfs/dbraw/zinc/00/15/42/1415001542.db2.gz HHNMSMVKYHZTBF-UHFFFAOYSA-N 0 0 399.447 3.258 20 5 GGBDRN CS(=O)(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000124632791 1415009831 /nfs/dbraw/zinc/00/98/31/1415009831.db2.gz ZSQQULWCTFFOPO-UHFFFAOYSA-N 0 0 388.323 3.269 20 5 GGBDRN CC(C)Oc1cc(Br)ccc1C(=O)OCCn1cc([N+](=O)[O-])cn1 ZINC000177773367 1428855294 /nfs/dbraw/zinc/85/52/94/1428855294.db2.gz XBISPJVVLYUUJJ-UHFFFAOYSA-N 0 0 398.213 3.198 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cc1[N+](=O)[O-] ZINC000124649200 1415013580 /nfs/dbraw/zinc/01/35/80/1415013580.db2.gz QITGQMYELNVRTL-UHFFFAOYSA-N 0 0 382.376 3.133 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000124659854 1415015859 /nfs/dbraw/zinc/01/58/59/1415015859.db2.gz WNCJYNWTGBKKCE-SFHVURJKSA-N 0 0 392.477 3.264 20 5 GGBDRN CCN(C[C@@H](O)c1ccc(C)cc1)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000124660074 1415016177 /nfs/dbraw/zinc/01/61/77/1415016177.db2.gz WNCJYNWTGBKKCE-GOSISDBHSA-N 0 0 392.477 3.264 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1csc(-c2ccccc2Cl)n1 ZINC000177781131 1428856933 /nfs/dbraw/zinc/85/69/33/1428856933.db2.gz FGWFVQRNMHYHSY-UHFFFAOYSA-N 0 0 378.797 3.425 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccco1)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000124689433 1415021893 /nfs/dbraw/zinc/02/18/93/1415021893.db2.gz LGFCQQPJPDRKCH-ZANVPECISA-N 0 0 383.198 3.192 20 5 GGBDRN C[C@@H](O)C[C@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000124688316 1415022266 /nfs/dbraw/zinc/02/22/66/1415022266.db2.gz PZMZVQARKJDQCW-TZMCWYRMSA-N 0 0 398.868 3.081 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000124689852 1415022765 /nfs/dbraw/zinc/02/27/65/1415022765.db2.gz LGFCQQPJPDRKCH-NOZJJQNGSA-N 0 0 383.198 3.192 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccn3)n2C)cccc1[N+](=O)[O-] ZINC000124693501 1415023209 /nfs/dbraw/zinc/02/32/09/1415023209.db2.gz ZCWRSIWJOBCGRQ-LBPRGKRZSA-N 0 0 398.448 3.213 20 5 GGBDRN O=C(OCc1cnc(-c2cccs2)o1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000124701126 1415024818 /nfs/dbraw/zinc/02/48/18/1415024818.db2.gz NMWYEFOTRDKGTC-UHFFFAOYSA-N 0 0 397.372 3.249 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C[C@H](C)O)c2ccccc2)c1C ZINC000124707968 1415026459 /nfs/dbraw/zinc/02/64/59/1415026459.db2.gz MDROCLSCMYXOJZ-YOEHRIQHSA-N 0 0 392.477 3.045 20 5 GGBDRN CN(C(=O)c1ccncc1)c1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000124711643 1415027195 /nfs/dbraw/zinc/02/71/95/1415027195.db2.gz VLUHHUDTJCHDFP-UHFFFAOYSA-N 0 0 390.399 3.196 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@@H](c3ccccc3C)OC[C@H]2C)cc1[N+](=O)[O-] ZINC000124710382 1415027251 /nfs/dbraw/zinc/02/72/51/1415027251.db2.gz VYZPFVULKBOGFJ-WBMJQRKESA-N 0 0 396.490 3.424 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000124720745 1415029176 /nfs/dbraw/zinc/02/91/76/1415029176.db2.gz SWWNGHPADJJJFG-UHFFFAOYSA-N 0 0 391.786 3.174 20 5 GGBDRN C[C@H](C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000124739635 1415033575 /nfs/dbraw/zinc/03/35/75/1415033575.db2.gz PSWIKYCMRSFTNC-LBPRGKRZSA-N 0 0 376.796 3.325 20 5 GGBDRN O=C(OCc1cnc(-c2cccs2)o1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000124744816 1415034628 /nfs/dbraw/zinc/03/46/28/1415034628.db2.gz IJAMHZGCOJKSGR-UHFFFAOYSA-N 0 0 397.372 3.249 20 5 GGBDRN C[C@@H](O)C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000124750731 1415036370 /nfs/dbraw/zinc/03/63/70/1415036370.db2.gz PFIVYGRTZMRPOH-TZMCWYRMSA-N 0 0 398.868 3.081 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccn2)n1C ZINC000124760158 1415038120 /nfs/dbraw/zinc/03/81/20/1415038120.db2.gz IHPJCCJJDZDNTQ-UHFFFAOYSA-N 0 0 398.448 3.215 20 5 GGBDRN COCCC1(CNS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)CCC1 ZINC000124766374 1415039583 /nfs/dbraw/zinc/03/95/83/1415039583.db2.gz GQHBCBBFEMWBCX-UHFFFAOYSA-N 0 0 376.862 3.042 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c1[N+](=O)[O-] ZINC000124767219 1415039635 /nfs/dbraw/zinc/03/96/35/1415039635.db2.gz UWZJNWMDEMRZHJ-UHFFFAOYSA-N 0 0 382.376 3.133 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000124775652 1415041376 /nfs/dbraw/zinc/04/13/76/1415041376.db2.gz NWFCOISAUXIMMU-ZDUSSCGKSA-N 0 0 399.234 3.168 20 5 GGBDRN CCCOc1ccc(C(=O)CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000124778084 1415041906 /nfs/dbraw/zinc/04/19/06/1415041906.db2.gz GYTKPMSWRBKGAD-UHFFFAOYSA-N 0 0 395.415 3.407 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000124782063 1415042349 /nfs/dbraw/zinc/04/23/49/1415042349.db2.gz GJDXNZSTOCKQBU-MRXNPFEDSA-N 0 0 379.338 3.287 20 5 GGBDRN NC(=O)CSc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000124793839 1415045435 /nfs/dbraw/zinc/04/54/35/1415045435.db2.gz FHQPTZMQHQJXLQ-UHFFFAOYSA-N 0 0 399.350 3.443 20 5 GGBDRN CC(C)C(=O)Nc1nc(CC(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])cs1 ZINC000124802003 1415047302 /nfs/dbraw/zinc/04/73/02/1415047302.db2.gz HSGIDBYULCLECF-UHFFFAOYSA-N 0 0 383.813 3.447 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cccc1[N+](=O)[O-] ZINC000124813982 1415050430 /nfs/dbraw/zinc/05/04/30/1415050430.db2.gz VBYFVCDBUDEPNS-UHFFFAOYSA-N 0 0 382.376 3.133 20 5 GGBDRN O=C(Cn1nc(-c2ccccc2)ccc1=O)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000124848360 1415058315 /nfs/dbraw/zinc/05/83/15/1415058315.db2.gz PMABLXSMMJKEAS-UHFFFAOYSA-N 0 0 385.763 3.078 20 5 GGBDRN CC[C@@H](NC(=O)CCNC(=O)N(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000177805108 1428861915 /nfs/dbraw/zinc/86/19/15/1428861915.db2.gz GJXFCPXWPLQGAN-LJQANCHMSA-N 0 0 398.463 3.394 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000124859454 1415061068 /nfs/dbraw/zinc/06/10/68/1415061068.db2.gz VUZSYYFAUIXCOE-CQSZACIVSA-N 0 0 379.420 3.431 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000124869326 1415063347 /nfs/dbraw/zinc/06/33/47/1415063347.db2.gz JGVZUALUBJQKCM-BXUZGUMPSA-N 0 0 382.800 3.239 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccco1)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000124869086 1415063490 /nfs/dbraw/zinc/06/34/90/1415063490.db2.gz JGVZUALUBJQKCM-SMDDNHRTSA-N 0 0 382.800 3.239 20 5 GGBDRN CC[C@H](NC(=O)c1cccc(C(=O)N2CCCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000177809149 1428862467 /nfs/dbraw/zinc/86/24/67/1428862467.db2.gz NLMOIBFDGHFRPV-INIZCTEOSA-N 0 0 382.420 3.107 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2coc(-c3ccc(C)cc3)n2)cc1[N+](=O)[O-] ZINC000124897422 1415068848 /nfs/dbraw/zinc/06/88/48/1415068848.db2.gz CKTSUBAXIYJTOJ-UHFFFAOYSA-N 0 0 393.446 3.407 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccco1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000124901323 1415069071 /nfs/dbraw/zinc/06/90/71/1415069071.db2.gz BPDCBMMDRLWZGY-IINYFYTJSA-N 0 0 397.225 3.121 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000124901510 1415069727 /nfs/dbraw/zinc/06/97/27/1415069727.db2.gz BPDCBMMDRLWZGY-QMTHXVAHSA-N 0 0 397.225 3.121 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NCc1nc(C2CC2)cs1 ZINC000124901677 1415069738 /nfs/dbraw/zinc/06/97/38/1415069738.db2.gz CXKYMMHAKCSOMI-UHFFFAOYSA-N 0 0 387.870 3.369 20 5 GGBDRN Nc1c(C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)cc(F)cc1[N+](=O)[O-] ZINC000124906703 1415070349 /nfs/dbraw/zinc/07/03/49/1415070349.db2.gz FLPKDIQOZPAOFY-CYBMUJFWSA-N 0 0 379.775 3.263 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000124928462 1415075064 /nfs/dbraw/zinc/07/50/64/1415075064.db2.gz MJARXWDDPMQQFR-QGZVFWFLSA-N 0 0 386.379 3.411 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCOC2(CCCC2)C1 ZINC000124929168 1415075105 /nfs/dbraw/zinc/07/51/05/1415075105.db2.gz GJRMDLDXBBJYJH-GFCCVEGCSA-N 0 0 388.873 3.327 20 5 GGBDRN COc1ccc(-c2ccc(C(=O)OCCn3cc([N+](=O)[O-])cn3)c(F)c2)cc1 ZINC000177785408 1428857917 /nfs/dbraw/zinc/85/79/17/1428857917.db2.gz KCMLOZDVYPUEFL-UHFFFAOYSA-N 0 0 385.351 3.463 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(Cl)c1)Nc1ccc(N2CCOCC2)cc1 ZINC000124945417 1415078594 /nfs/dbraw/zinc/07/85/94/1415078594.db2.gz HDYZXCSZTLRACA-UHFFFAOYSA-N 0 0 391.811 3.102 20 5 GGBDRN CCn1c2nnc(COc3ccc([N+](=O)[O-])c(Cl)c3)n2c2ccccc2c1=O ZINC000124946937 1415078874 /nfs/dbraw/zinc/07/88/74/1415078874.db2.gz GKCILPIVBOOMQH-UHFFFAOYSA-N 0 0 399.794 3.205 20 5 GGBDRN CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1[O-] ZINC000124973953 1415083949 /nfs/dbraw/zinc/08/39/49/1415083949.db2.gz CDVXVNXEDQOIHB-SCLBCKFNSA-N 0 0 397.431 3.239 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1[O-])c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000124973515 1415084240 /nfs/dbraw/zinc/08/42/40/1415084240.db2.gz AZDZAAQLZYXTGX-UHFFFAOYSA-N 0 0 382.376 3.311 20 5 GGBDRN COc1ccc(C(=O)Nc2ccc(CN(C(C)=O)C3CC3)cc2)cc1[N+](=O)[O-] ZINC000124981326 1415086368 /nfs/dbraw/zinc/08/63/68/1415086368.db2.gz ZBIYYPAIUVNMMN-UHFFFAOYSA-N 0 0 383.404 3.367 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)Oc1cccnc1Cl ZINC000124994917 1415088702 /nfs/dbraw/zinc/08/87/02/1415088702.db2.gz MLBJMOPZNYPQAU-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN Cc1cccc(C(=O)NCc2ccc(NC(=O)C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000125023501 1415094035 /nfs/dbraw/zinc/09/40/35/1415094035.db2.gz MVQYUWIVRGITEX-UHFFFAOYSA-N 0 0 381.310 3.334 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Oc2cccnc2Br)c1C ZINC000125040156 1415097403 /nfs/dbraw/zinc/09/74/03/1415097403.db2.gz FYZGIDSITPQRHT-UHFFFAOYSA-N 0 0 387.211 3.137 20 5 GGBDRN CCOc1cccc(-c2nnc(SCc3ccc([N+](=O)[O-])cc3F)n2N)c1 ZINC000125069942 1415103144 /nfs/dbraw/zinc/10/31/44/1415103144.db2.gz APJIPUUQQIQBKF-UHFFFAOYSA-N 0 0 389.412 3.397 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)Oc1ccc(Cl)nc1 ZINC000125105866 1415110075 /nfs/dbraw/zinc/11/00/75/1415110075.db2.gz PNPSXOCRPPIGTC-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN Cc1cccc(-c2ccc(CNC(=O)NCCn3cc([N+](=O)[O-])cn3)cc2)c1 ZINC000125116142 1415112144 /nfs/dbraw/zinc/11/21/44/1415112144.db2.gz OMDHWZVGRVSCGL-UHFFFAOYSA-N 0 0 379.420 3.266 20 5 GGBDRN CN(CC(=O)Nc1cccc2ccccc21)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000125123854 1415114327 /nfs/dbraw/zinc/11/43/27/1415114327.db2.gz CXCVTQASLYXPQO-UHFFFAOYSA-N 0 0 399.428 3.007 20 5 GGBDRN COCCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1ccc(C)o1 ZINC000125161786 1415121331 /nfs/dbraw/zinc/12/13/31/1415121331.db2.gz BXNHEMMDNYIQNV-UHFFFAOYSA-N 0 0 381.816 3.237 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000177836077 1428869017 /nfs/dbraw/zinc/86/90/17/1428869017.db2.gz MCBANKLHSKYOHS-MAUKXSAKSA-N 0 0 396.447 3.028 20 5 GGBDRN Cc1cc(C(=O)NCCNc2ccccc2[N+](=O)[O-])c(C)n1-c1nccs1 ZINC000125170813 1415123249 /nfs/dbraw/zinc/12/32/49/1415123249.db2.gz CEPQDVSPBCLIDV-UHFFFAOYSA-N 0 0 385.449 3.301 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CNC(=O)c1ccc(F)c(F)c1 ZINC000125182727 1415125595 /nfs/dbraw/zinc/12/55/95/1415125595.db2.gz GOTBJPHGOMNRAU-UHFFFAOYSA-N 0 0 391.374 3.040 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CNC(=O)c1cc(F)cc(F)c1 ZINC000125182543 1415125614 /nfs/dbraw/zinc/12/56/14/1415125614.db2.gz DRHVIZHYCPXWFX-UHFFFAOYSA-N 0 0 391.374 3.040 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000125195089 1415128327 /nfs/dbraw/zinc/12/83/27/1415128327.db2.gz RGVPMWCOVPQILN-LLVKDONJSA-N 0 0 390.831 3.197 20 5 GGBDRN CCOCC(COCC)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000125199788 1415129534 /nfs/dbraw/zinc/12/95/34/1415129534.db2.gz PJFLANFPBKZZGA-UHFFFAOYSA-N 0 0 383.444 3.140 20 5 GGBDRN Cc1sc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000125205107 1415129776 /nfs/dbraw/zinc/12/97/76/1415129776.db2.gz MQYPKNMUJDYBCF-UHFFFAOYSA-N 0 0 385.423 3.087 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)Oc2ccc(Br)nc2)c1C ZINC000125207579 1415130258 /nfs/dbraw/zinc/13/02/58/1415130258.db2.gz SETXJRLOWVEAGJ-UHFFFAOYSA-N 0 0 387.211 3.137 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])CC1 ZINC000125234782 1415135509 /nfs/dbraw/zinc/13/55/09/1415135509.db2.gz QUPJXAOKFRPXAQ-UHFFFAOYSA-N 0 0 379.432 3.199 20 5 GGBDRN CN(c1ccccc1NC(=O)C(=O)NCc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000177816365 1428863937 /nfs/dbraw/zinc/86/39/37/1428863937.db2.gz MYDHXFWUUYHYAZ-UHFFFAOYSA-N 0 0 396.447 3.229 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC(Oc2ccccc2Cl)CC1 ZINC000125264659 1415146642 /nfs/dbraw/zinc/14/66/42/1415146642.db2.gz OOUZBWJZZWJSOA-UHFFFAOYSA-N 0 0 392.843 3.213 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000125271533 1415148024 /nfs/dbraw/zinc/14/80/24/1415148024.db2.gz HGCMZLUOBALZGD-CYBMUJFWSA-N 0 0 391.449 3.065 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000125273639 1415148680 /nfs/dbraw/zinc/14/86/80/1415148680.db2.gz UJSWFJGCQZQHRX-ZDUSSCGKSA-N 0 0 391.449 3.232 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000125293821 1415155635 /nfs/dbraw/zinc/15/56/35/1415155635.db2.gz HAJIBDIUWWZQOB-UHFFFAOYSA-N 0 0 388.811 3.434 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(S(C)(=O)=O)c(C)c2)cc1[N+](=O)[O-] ZINC000125307008 1415158795 /nfs/dbraw/zinc/15/87/95/1415158795.db2.gz XYJFSBAZIFWWJO-CYBMUJFWSA-N 0 0 391.449 3.498 20 5 GGBDRN C=CC(=O)NCc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000125309532 1415159691 /nfs/dbraw/zinc/15/96/91/1415159691.db2.gz GSWNUBDLKQJKFI-UHFFFAOYSA-N 0 0 391.330 3.251 20 5 GGBDRN C[S@@](=O)c1ccc(C(=O)OCc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000125328454 1415165717 /nfs/dbraw/zinc/16/57/17/1415165717.db2.gz BAMKNTMTLCHPQN-QHCPKHFHSA-N 0 0 398.234 3.452 20 5 GGBDRN C[S@](=O)c1ccc(C(=O)OCc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000125328676 1415165822 /nfs/dbraw/zinc/16/58/22/1415165822.db2.gz BAMKNTMTLCHPQN-HSZRJFAPSA-N 0 0 398.234 3.452 20 5 GGBDRN CCS(=O)(=O)c1ccccc1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177845312 1428870917 /nfs/dbraw/zinc/87/09/17/1428870917.db2.gz NIHTZNYYGBYMPN-CYBMUJFWSA-N 0 0 376.434 3.188 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000125335174 1415167872 /nfs/dbraw/zinc/16/78/72/1415167872.db2.gz ZPKOOJHKIMCERW-LLVKDONJSA-N 0 0 399.234 3.237 20 5 GGBDRN C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000125338066 1415167896 /nfs/dbraw/zinc/16/78/96/1415167896.db2.gz UWSYBUNRURCJSG-LBPRGKRZSA-N 0 0 384.417 3.233 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c1 ZINC000125341867 1415168921 /nfs/dbraw/zinc/16/89/21/1415168921.db2.gz VHQIHCLWJKKTMF-UHFFFAOYSA-N 0 0 392.755 3.077 20 5 GGBDRN Cc1ccccc1[C@H](CC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)NC(N)=O ZINC000177846033 1428871298 /nfs/dbraw/zinc/87/12/98/1428871298.db2.gz WYDRSLPHHXVEOI-PBHICJAKSA-N 0 0 384.436 3.189 20 5 GGBDRN Cc1ccccc1[C@@H](CC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)NC(N)=O ZINC000177846026 1428871464 /nfs/dbraw/zinc/87/14/64/1428871464.db2.gz WYDRSLPHHXVEOI-RHSMWYFYSA-N 0 0 384.436 3.189 20 5 GGBDRN COCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1ccc(C)o1 ZINC000125356172 1415173956 /nfs/dbraw/zinc/17/39/56/1415173956.db2.gz KHMVQMKABKZTFI-UHFFFAOYSA-N 0 0 381.816 3.237 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000177847525 1428871648 /nfs/dbraw/zinc/87/16/48/1428871648.db2.gz CLRJCOGCXUAOPM-NVXWUHKLSA-N 0 0 390.484 3.158 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000177846673 1428871677 /nfs/dbraw/zinc/87/16/77/1428871677.db2.gz BNKFHQJXZWWHDG-GOEBONIOSA-N 0 0 375.469 3.365 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000125372255 1415179494 /nfs/dbraw/zinc/17/94/94/1415179494.db2.gz WTUMNEXQCBOLCU-ZDUSSCGKSA-N 0 0 391.449 3.065 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](CC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000125381267 1415181696 /nfs/dbraw/zinc/18/16/96/1415181696.db2.gz YQWSNOAARIBUJW-HOTGVXAUSA-N 0 0 390.484 3.240 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](CC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000125381665 1415181775 /nfs/dbraw/zinc/18/17/75/1415181775.db2.gz YQWSNOAARIBUJW-CVEARBPZSA-N 0 0 390.484 3.240 20 5 GGBDRN C[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1 ZINC000125388541 1415184307 /nfs/dbraw/zinc/18/43/07/1415184307.db2.gz DZCKJYYECBMPOR-AWEZNQCLSA-N 0 0 380.404 3.497 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCn2cnc3c(C)cccc3c2=O)cc1[N+](=O)[O-] ZINC000177850143 1428872712 /nfs/dbraw/zinc/87/27/12/1428872712.db2.gz UDYWHYIXJPYXFX-HNNXBMFYSA-N 0 0 394.431 3.189 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000125416244 1415191446 /nfs/dbraw/zinc/19/14/46/1415191446.db2.gz VQHRVFWRHSEGLJ-CYBMUJFWSA-N 0 0 391.449 3.065 20 5 GGBDRN CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177851918 1428873078 /nfs/dbraw/zinc/87/30/78/1428873078.db2.gz NAJLJIBBZJLWAP-OGJUVRTPSA-N 0 0 391.493 3.338 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H](O)c2cc3ccccc3s2)cc1[N+](=O)[O-] ZINC000125435261 1415197592 /nfs/dbraw/zinc/19/75/92/1415197592.db2.gz AGDSFGIMMIXBID-LBPRGKRZSA-N 0 0 398.487 3.191 20 5 GGBDRN CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000177855671 1428873878 /nfs/dbraw/zinc/87/38/78/1428873878.db2.gz GQIWDCGPSTZHMB-AWEZNQCLSA-N 0 0 376.434 3.339 20 5 GGBDRN C[C@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000125449237 1415202149 /nfs/dbraw/zinc/20/21/49/1415202149.db2.gz JVLBTSAZASMXNU-JSGCOSHPSA-N 0 0 379.482 3.346 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000125449623 1415202309 /nfs/dbraw/zinc/20/23/09/1415202309.db2.gz JVLBTSAZASMXNU-GXTWGEPZSA-N 0 0 379.482 3.346 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1Cl ZINC000125450440 1415202604 /nfs/dbraw/zinc/20/26/04/1415202604.db2.gz GGEZNYAIFHKYGL-UHFFFAOYSA-N 0 0 384.779 3.408 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(C(=O)N3CCCC3)n2)cc1[N+](=O)[O-] ZINC000177870285 1428878742 /nfs/dbraw/zinc/87/87/42/1428878742.db2.gz IRLFGCAEOCLEIJ-CQSZACIVSA-N 0 0 382.420 3.025 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1ccncc1 ZINC000125458242 1415204796 /nfs/dbraw/zinc/20/47/96/1415204796.db2.gz LWHVFZXJOIVAFE-AWEZNQCLSA-N 0 0 381.841 3.477 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H](NC(=O)Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000177859277 1428875532 /nfs/dbraw/zinc/87/55/32/1428875532.db2.gz BKGXWZUSIHQJCZ-KKSFZXQISA-N 0 0 397.475 3.464 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000177861293 1428876015 /nfs/dbraw/zinc/87/60/15/1428876015.db2.gz OHYHWBKZSBHTDP-DOTOQJQBSA-N 0 0 388.468 3.008 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCNC(=O)N(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000177862807 1428876565 /nfs/dbraw/zinc/87/65/65/1428876565.db2.gz DPDIHYHSHZLSMH-MRXNPFEDSA-N 0 0 398.463 3.312 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(N3CCNC3=O)c2C)cc1[N+](=O)[O-] ZINC000177863314 1428876780 /nfs/dbraw/zinc/87/67/80/1428876780.db2.gz XCGJRGBKCVDKGE-CQSZACIVSA-N 0 0 382.420 3.232 20 5 GGBDRN O=C(CN1CCC(OC2CCCCC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000125484365 1415212342 /nfs/dbraw/zinc/21/23/42/1415212342.db2.gz GJTWXIINNWUAIO-UHFFFAOYSA-N 0 0 387.480 3.298 20 5 GGBDRN O=[N+]([O-])c1ccc[nH]c1=NNS(=O)(=O)c1csc2ccc(Cl)cc21 ZINC000125501748 1415215159 /nfs/dbraw/zinc/21/51/59/1415215159.db2.gz NCJRBUNQKLXJKV-UHFFFAOYSA-N 0 0 384.826 3.163 20 5 GGBDRN COc1ccc(-n2nnc(C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)c2C)cc1 ZINC000177866633 1428877673 /nfs/dbraw/zinc/87/76/73/1428877673.db2.gz OVJYAVYWTRVKDQ-ZDUSSCGKSA-N 0 0 395.419 3.292 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)COc2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000177865771 1428877685 /nfs/dbraw/zinc/87/76/85/1428877685.db2.gz UVKKNOXSDGAJJD-OAHLLOKOSA-N 0 0 397.431 3.286 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)COc2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000177865784 1428877814 /nfs/dbraw/zinc/87/78/14/1428877814.db2.gz UVKKNOXSDGAJJD-HNNXBMFYSA-N 0 0 397.431 3.286 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1cccc(F)c1F ZINC000125514476 1415218471 /nfs/dbraw/zinc/21/84/71/1415218471.db2.gz GYUWNKYEZKHAGD-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN COc1ccsc1S(=O)(=O)Oc1c(Br)cccc1[N+](=O)[O-] ZINC000125517696 1415218843 /nfs/dbraw/zinc/21/88/43/1415218843.db2.gz JDKHUSHEBKPYDI-UHFFFAOYSA-N 0 0 394.224 3.195 20 5 GGBDRN COc1ccccc1S(=O)(=O)Oc1c(Br)cccc1[N+](=O)[O-] ZINC000125518165 1415218906 /nfs/dbraw/zinc/21/89/06/1415218906.db2.gz QJLPIAGQJQDWEX-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN O=C(Nc1cnn(C[C@H]2CCCO2)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000125533293 1415221795 /nfs/dbraw/zinc/22/17/95/1415221795.db2.gz NJLCKQKHNYGVRC-GOSISDBHSA-N 0 0 385.424 3.167 20 5 GGBDRN O=C(NCc1ccc(CN2CCCC2=O)cc1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000125538304 1415222102 /nfs/dbraw/zinc/22/21/02/1415222102.db2.gz DLGJJBFRVNGOBS-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN C[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1noc(-c2ccccc2)n1 ZINC000125536313 1415222348 /nfs/dbraw/zinc/22/23/48/1415222348.db2.gz NYAKRXUMECSFSG-CYBMUJFWSA-N 0 0 382.376 3.291 20 5 GGBDRN Cc1cnn(-c2ccc(NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)cc2F)c1 ZINC000125561870 1415226975 /nfs/dbraw/zinc/22/69/75/1415226975.db2.gz YEDZJQPYTHWCRT-UHFFFAOYSA-N 0 0 386.387 3.070 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCCCN2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000177874566 1428879179 /nfs/dbraw/zinc/87/91/79/1428879179.db2.gz JBKJZCPTRBCSIJ-GDBMZVCRSA-N 0 0 385.420 3.368 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCc2nc(-c3ccccn3)no2)cc1[N+](=O)[O-] ZINC000177874146 1428879230 /nfs/dbraw/zinc/87/92/30/1428879230.db2.gz OARUJFVYAAESQZ-ZDUSSCGKSA-N 0 0 381.392 3.158 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)Cc2cccc(N(C)C)c2)c1C ZINC000125584638 1415231797 /nfs/dbraw/zinc/23/17/97/1415231797.db2.gz PTKYUSHKLCDFOK-UHFFFAOYSA-N 0 0 377.466 3.098 20 5 GGBDRN Cc1ccc(CCC(=O)NCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177875604 1428879734 /nfs/dbraw/zinc/87/97/34/1428879734.db2.gz SZSAHSRJZGQBEF-INIZCTEOSA-N 0 0 383.448 3.138 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000177876046 1428880068 /nfs/dbraw/zinc/88/00/68/1428880068.db2.gz VEMBYQHUYLSWCD-UWJYYQICSA-N 0 0 396.491 3.069 20 5 GGBDRN COc1cccc(CCCN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)c1 ZINC000125605189 1415236451 /nfs/dbraw/zinc/23/64/51/1415236451.db2.gz ODLWTIOHYOBAJK-HXUWFJFHSA-N 0 0 383.404 3.003 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000125606648 1415237167 /nfs/dbraw/zinc/23/71/67/1415237167.db2.gz QZZZOUYAXIJEPT-MRXNPFEDSA-N 0 0 396.447 3.132 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC1CCN(c2cccs2)CC1 ZINC000125626598 1415240640 /nfs/dbraw/zinc/24/06/40/1415240640.db2.gz LMXQKSOTRRMWNH-UHFFFAOYSA-N 0 0 384.461 3.465 20 5 GGBDRN CSc1nnc(CCCNC(=O)c2ccc([N+](=O)[O-])cc2F)n1CC(C)C ZINC000125637339 1415243068 /nfs/dbraw/zinc/24/30/68/1415243068.db2.gz PFSGABJHTCQVSP-UHFFFAOYSA-N 0 0 395.460 3.066 20 5 GGBDRN O=C(c1cc(C(F)(F)F)ccc1F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125647145 1415245182 /nfs/dbraw/zinc/24/51/82/1415245182.db2.gz XKZVPDUIXPIRSK-LLVKDONJSA-N 0 0 398.316 3.474 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1nnc(-c2ccccc2)s1 ZINC000125647206 1415245506 /nfs/dbraw/zinc/24/55/06/1415245506.db2.gz NWLHUHMFNMNQBQ-UHFFFAOYSA-N 0 0 391.412 3.385 20 5 GGBDRN Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000125648747 1415245715 /nfs/dbraw/zinc/24/57/15/1415245715.db2.gz DLOCEVOLZHOXTP-RDTXWAMCSA-N 0 0 399.472 3.084 20 5 GGBDRN CC[C@@H](OC1CCCCC1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125661780 1415248453 /nfs/dbraw/zinc/24/84/53/1415248453.db2.gz PQHGWBXYUVODEN-WMLDXEAASA-N 0 0 376.457 3.131 20 5 GGBDRN CCc1ccc(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)s1 ZINC000125681886 1415253817 /nfs/dbraw/zinc/25/38/17/1415253817.db2.gz FSXIAPKPLSTHEN-UHFFFAOYSA-N 0 0 399.375 3.075 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccccc1OCCn1ccnc1 ZINC000125709123 1415259276 /nfs/dbraw/zinc/25/92/76/1415259276.db2.gz LCWYMLDJEDFLFA-UHFFFAOYSA-N 0 0 380.404 3.442 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000125709192 1415259345 /nfs/dbraw/zinc/25/93/45/1415259345.db2.gz INZMRKVDOUVOMN-UHFFFAOYSA-N 0 0 379.376 3.141 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000125712317 1415259614 /nfs/dbraw/zinc/25/96/14/1415259614.db2.gz KGHRIPFVDGZOCW-QAPCUYQASA-N 0 0 397.431 3.126 20 5 GGBDRN C[C@@H](CO)NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000125714171 1415260610 /nfs/dbraw/zinc/26/06/10/1415260610.db2.gz WJPMJEPTWIHFPS-JTQLQIEISA-N 0 0 389.458 3.466 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)c1nc(-c2ccccc2)no1 ZINC000125752774 1415270084 /nfs/dbraw/zinc/27/00/84/1415270084.db2.gz VLVKVTAMABCVRM-GFCCVEGCSA-N 0 0 382.376 3.187 20 5 GGBDRN O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125757084 1415271566 /nfs/dbraw/zinc/27/15/66/1415271566.db2.gz MDZAKVNBCDXMAL-UHFFFAOYSA-N 0 0 386.383 3.160 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000125770075 1415276223 /nfs/dbraw/zinc/27/62/23/1415276223.db2.gz OPEMWDDWXNZDTK-HNNXBMFYSA-N 0 0 387.346 3.335 20 5 GGBDRN CO[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000125783815 1415279908 /nfs/dbraw/zinc/27/99/08/1415279908.db2.gz GSJUZCPLRWASNR-GOSISDBHSA-N 0 0 384.367 3.037 20 5 GGBDRN CC[C@@H](NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)c1ccc(F)cc1F ZINC000125786329 1415280419 /nfs/dbraw/zinc/28/04/19/1415280419.db2.gz CCSWATVRTXPVKD-MRXNPFEDSA-N 0 0 387.346 3.335 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1OS(=O)(=O)c1sccc1Br ZINC000125802175 1415285107 /nfs/dbraw/zinc/28/51/07/1415285107.db2.gz BNNPOYDBHUZMFH-UHFFFAOYSA-N 0 0 382.188 3.326 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@@H]2C[C@H](O)c2cccs2)cc1 ZINC000125814318 1415288154 /nfs/dbraw/zinc/28/81/54/1415288154.db2.gz PNBNUWYWJVTRGW-CVEARBPZSA-N 0 0 396.490 3.074 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCc1cccc([N+](=O)[O-])c1 ZINC000125818103 1415289409 /nfs/dbraw/zinc/28/94/09/1415289409.db2.gz NPZUQLUVEYMSCG-UHFFFAOYSA-N 0 0 393.783 3.284 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@]2(CCSC2)C1 ZINC000177917659 1428891019 /nfs/dbraw/zinc/89/10/19/1428891019.db2.gz HPTXYXWDICVIPR-QFBILLFUSA-N 0 0 393.509 3.271 20 5 GGBDRN CC(C)c1csc(CNC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000177917033 1428891083 /nfs/dbraw/zinc/89/10/83/1428891083.db2.gz QZFGCSSQABCHQD-UHFFFAOYSA-N 0 0 389.481 3.207 20 5 GGBDRN CC(C)(C)OC(=O)NCc1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)o1 ZINC000125824792 1415290706 /nfs/dbraw/zinc/29/07/06/1415290706.db2.gz WFKFPZWOFJIHFM-UHFFFAOYSA-N 0 0 389.408 3.185 20 5 GGBDRN COc1cccc(-c2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)[nH]n2)c1 ZINC000125826017 1415291264 /nfs/dbraw/zinc/29/12/64/1415291264.db2.gz IANZPMQBCKXOCV-UHFFFAOYSA-N 0 0 378.388 3.192 20 5 GGBDRN COc1ccc(CNc2cccc(C(=O)N3CCC(CO)CC3)c2)cc1[N+](=O)[O-] ZINC000125831414 1415292555 /nfs/dbraw/zinc/29/25/55/1415292555.db2.gz QLIMTOJWRJMJGB-UHFFFAOYSA-N 0 0 399.447 3.060 20 5 GGBDRN CC(C)c1csc(CNC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000177919055 1428891758 /nfs/dbraw/zinc/89/17/58/1428891758.db2.gz KNMDOLZSJMRZPH-UHFFFAOYSA-N 0 0 389.481 3.207 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000125858160 1415298537 /nfs/dbraw/zinc/29/85/37/1415298537.db2.gz JBGFMCAMNXSYDO-UHFFFAOYSA-N 0 0 397.475 3.371 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 ZINC000125869219 1415301398 /nfs/dbraw/zinc/30/13/98/1415301398.db2.gz NFJXCOVIZPAHDF-ZBEGNZNMSA-N 0 0 392.843 3.255 20 5 GGBDRN COc1ccc(C)cc1-n1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)n1 ZINC000125879343 1415303067 /nfs/dbraw/zinc/30/30/67/1415303067.db2.gz NDFYBDFPWFHHES-UHFFFAOYSA-N 0 0 380.404 3.070 20 5 GGBDRN Cc1ccc(CNc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)cc1[N+](=O)[O-] ZINC000125884847 1415304383 /nfs/dbraw/zinc/30/43/83/1415304383.db2.gz UGYNZVBQTWKAOH-QGZVFWFLSA-N 0 0 383.448 3.360 20 5 GGBDRN CCn1c(-c2cccnc2)nn(CN(C)Cc2ccccc2[N+](=O)[O-])c1=S ZINC000177942446 1428896831 /nfs/dbraw/zinc/89/68/31/1428896831.db2.gz QCOIIQKOEZXISL-UHFFFAOYSA-N 0 0 384.465 3.494 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CC[C@H](Cc2ccccc2)C1 ZINC000125900433 1415308435 /nfs/dbraw/zinc/30/84/35/1415308435.db2.gz PANYHPHVOHLMQH-GOSISDBHSA-N 0 0 395.459 3.136 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1noc(-c2ccccc2)n1 ZINC000125905094 1415308762 /nfs/dbraw/zinc/30/87/62/1415308762.db2.gz NIISUCMZOFPOEN-LBPRGKRZSA-N 0 0 381.392 3.202 20 5 GGBDRN C[C@@H](CS(C)(=O)=O)N(C)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000125914264 1415311642 /nfs/dbraw/zinc/31/16/42/1415311642.db2.gz VIXLGNQWCORPHA-HNNXBMFYSA-N 0 0 391.493 3.228 20 5 GGBDRN Cc1c(C(=O)NCCc2cccc([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1F ZINC000125917540 1415312471 /nfs/dbraw/zinc/31/24/71/1415312471.db2.gz FZAIQOSYLRVUFF-UHFFFAOYSA-N 0 0 386.358 3.340 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc([N+](=O)[O-])ccc1Br ZINC000125921841 1415313596 /nfs/dbraw/zinc/31/35/96/1415313596.db2.gz KHHKZWCLUWLEFH-UHFFFAOYSA-N 0 0 394.181 3.238 20 5 GGBDRN CC(=O)N1c2ccc(S(=O)(=O)Nc3cccc([N+](=O)[O-])c3C)cc2C[C@H]1C ZINC000125930632 1415315838 /nfs/dbraw/zinc/31/58/38/1415315838.db2.gz CZWWRARRGOJIJP-LLVKDONJSA-N 0 0 389.433 3.002 20 5 GGBDRN C[C@H]1CC(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000125932657 1415316480 /nfs/dbraw/zinc/31/64/80/1415316480.db2.gz AMTPPEXDSFBJOJ-UWVGGRQHSA-N 0 0 376.331 3.222 20 5 GGBDRN Cc1c(C(=O)NCCCc2nc3ccccc3[nH]2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000125937834 1415317166 /nfs/dbraw/zinc/31/71/66/1415317166.db2.gz PKZXJWMDGLDHBG-UHFFFAOYSA-N 0 0 397.391 3.359 20 5 GGBDRN Cn1c2ccccc2nc1[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000125958587 1415322634 /nfs/dbraw/zinc/32/26/34/1415322634.db2.gz KPYJBGJAZNWZDN-IBGZPJMESA-N 0 0 376.420 3.057 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCN(Cc3ccccc3)c3ccccc32)c1[N+](=O)[O-] ZINC000125969221 1415325155 /nfs/dbraw/zinc/32/51/55/1415325155.db2.gz YKVNTOAHEZDWBF-UHFFFAOYSA-N 0 0 391.431 3.304 20 5 GGBDRN O=C(O[C@@H](c1ncccn1)C1CCCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000125997132 1415332776 /nfs/dbraw/zinc/33/27/76/1415332776.db2.gz TZXQPBFISZQYPY-QGZVFWFLSA-N 0 0 394.391 3.054 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)NCCc3cccc([N+](=O)[O-])c3)cc2)C[C@H](C)O1 ZINC000126004915 1415334475 /nfs/dbraw/zinc/33/44/75/1415334475.db2.gz SRYVKIQFYWSEDY-CALCHBBNSA-N 0 0 397.475 3.177 20 5 GGBDRN Cc1c(C(=O)NCCc2cccc([N+](=O)[O-])c2)nnn1-c1cccc(Cl)c1 ZINC000126007368 1415335095 /nfs/dbraw/zinc/33/50/95/1415335095.db2.gz ZJDJMXDCHUXCKZ-UHFFFAOYSA-N 0 0 385.811 3.110 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1ccc2ccccc2c1 ZINC000126022745 1415338693 /nfs/dbraw/zinc/33/86/93/1415338693.db2.gz UAGODSQDWHYPBH-FQEVSTJZSA-N 0 0 379.416 3.323 20 5 GGBDRN COC(=O)c1cc(C)ccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000126045475 1415343568 /nfs/dbraw/zinc/34/35/68/1415343568.db2.gz UGUYGUXQXRUFPS-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000126046732 1415344134 /nfs/dbraw/zinc/34/41/34/1415344134.db2.gz NUUYTSBDMYUMBD-LJQANCHMSA-N 0 0 389.411 3.083 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1c(Cl)cccc1Cl ZINC000126063226 1415348722 /nfs/dbraw/zinc/34/87/22/1415348722.db2.gz JKZYAIOPQHKANM-OAHLLOKOSA-N 0 0 398.246 3.477 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(Cc2cccc(F)c2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000177969305 1428907104 /nfs/dbraw/zinc/90/71/04/1428907104.db2.gz CFVGXUHHQGCSQF-OAHLLOKOSA-N 0 0 386.427 3.322 20 5 GGBDRN O=C(Nc1ccnn1Cc1ccccc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000126095922 1415356422 /nfs/dbraw/zinc/35/64/22/1415356422.db2.gz HWORYUBIHAEAGJ-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN Cn1c2ccccc2nc1[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccccc1 ZINC000126101877 1415358792 /nfs/dbraw/zinc/35/87/92/1415358792.db2.gz RHOGIGQKQRFXMB-IBGZPJMESA-N 0 0 376.420 3.057 20 5 GGBDRN O=C(CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)OCc1ccccc1 ZINC000126102715 1415358810 /nfs/dbraw/zinc/35/88/10/1415358810.db2.gz OOILEGRYSJSBEY-UHFFFAOYSA-N 0 0 397.431 3.058 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@@H](c2ccccc2)C(C)(C)C)cc1[N+](=O)[O-] ZINC000126126215 1415364574 /nfs/dbraw/zinc/36/45/74/1415364574.db2.gz TURZUTLAZWZFDM-IBGZPJMESA-N 0 0 399.447 3.237 20 5 GGBDRN CO[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000126146903 1415369590 /nfs/dbraw/zinc/36/95/90/1415369590.db2.gz FEBFKUUFFNBSGU-KRWDZBQOSA-N 0 0 377.828 3.478 20 5 GGBDRN CO[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000126147165 1415369791 /nfs/dbraw/zinc/36/97/91/1415369791.db2.gz FEBFKUUFFNBSGU-QGZVFWFLSA-N 0 0 377.828 3.478 20 5 GGBDRN Cc1c(CC(=O)N2C[C@H](n3cccn3)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000126149235 1415370295 /nfs/dbraw/zinc/37/02/95/1415370295.db2.gz ZIBSFFIRAVXQKG-GOSISDBHSA-N 0 0 376.416 3.473 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)c(C)c1[N+](=O)[O-] ZINC000126148982 1415370371 /nfs/dbraw/zinc/37/03/71/1415370371.db2.gz XZNPGAPRDGAPNW-ZDUSSCGKSA-N 0 0 383.408 3.331 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCC[C@@H](Nc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000126160861 1415373105 /nfs/dbraw/zinc/37/31/05/1415373105.db2.gz FOAUHEIPGGHUNK-QGZVFWFLSA-N 0 0 383.404 3.098 20 5 GGBDRN CS(=O)(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126162683 1415374143 /nfs/dbraw/zinc/37/41/43/1415374143.db2.gz BNKUPSSLHMHKGA-UHFFFAOYSA-N 0 0 388.323 3.269 20 5 GGBDRN CCOc1ccc(C(=O)Nc2ccc(CN3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000126181871 1415379182 /nfs/dbraw/zinc/37/91/82/1415379182.db2.gz HIEFQPQYKHLEIF-UHFFFAOYSA-N 0 0 383.404 3.368 20 5 GGBDRN COc1ccccc1OC[C@@H](C)CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000126185526 1415379772 /nfs/dbraw/zinc/37/97/72/1415379772.db2.gz XPNTZZZIDUPFOH-HNNXBMFYSA-N 0 0 387.436 3.160 20 5 GGBDRN C[C@H](NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)c1ccc(-n2ccnn2)cc1 ZINC000126208846 1415385268 /nfs/dbraw/zinc/38/52/68/1415385268.db2.gz UWJAHAVYVYODJR-AWEZNQCLSA-N 0 0 392.419 3.004 20 5 GGBDRN C[C@@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000126227283 1415388899 /nfs/dbraw/zinc/38/88/99/1415388899.db2.gz NEYDGBSESQYCKG-CYBMUJFWSA-N 0 0 395.371 3.319 20 5 GGBDRN C[C@@H](CS(C)(=O)=O)N(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000126257148 1415395673 /nfs/dbraw/zinc/39/56/73/1415395673.db2.gz BQNWQWLKTATTLS-ZDUSSCGKSA-N 0 0 378.450 3.252 20 5 GGBDRN CCCOc1cccc(CC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000126261154 1415396924 /nfs/dbraw/zinc/39/69/24/1415396924.db2.gz JXYYDOWSGWZTIX-MRXNPFEDSA-N 0 0 384.436 3.034 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)nc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126260939 1415396991 /nfs/dbraw/zinc/39/69/91/1415396991.db2.gz SRZDISNGCLZYFO-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN CCN(C[C@H]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1)CC(F)(F)F ZINC000126263748 1415397621 /nfs/dbraw/zinc/39/76/21/1415397621.db2.gz ZGHOQXHYLIVAGB-OAHLLOKOSA-N 0 0 387.402 3.260 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2N)n(-c2ccccc2)n1 ZINC000126275050 1415400590 /nfs/dbraw/zinc/40/05/90/1415400590.db2.gz BISNKWMHFVJCKH-ZDUSSCGKSA-N 0 0 379.420 3.032 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2N)n(-c2ccccc2)n1 ZINC000126274786 1415400765 /nfs/dbraw/zinc/40/07/65/1415400765.db2.gz BISNKWMHFVJCKH-CYBMUJFWSA-N 0 0 379.420 3.032 20 5 GGBDRN Cc1nccn1-c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cn1 ZINC000126280593 1415401967 /nfs/dbraw/zinc/40/19/67/1415401967.db2.gz LZPWRPDYPPNXMI-UHFFFAOYSA-N 0 0 396.363 3.261 20 5 GGBDRN O=C(Nc1ccc2c(c1)C(=O)CCC2)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000177975088 1428910087 /nfs/dbraw/zinc/91/00/87/1428910087.db2.gz KDWOSBZAEAIJGA-UHFFFAOYSA-N 0 0 377.356 3.208 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)c2ccc(N)c([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000126293274 1415407392 /nfs/dbraw/zinc/40/73/92/1415407392.db2.gz UBYMEIMSFVZDSY-ZDUSSCGKSA-N 0 0 379.420 3.032 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)OCc1nnc(-c2ccccc2Cl)o1 ZINC000126307204 1415412789 /nfs/dbraw/zinc/41/27/89/1415412789.db2.gz AKHLAGGXNSDDRD-UHFFFAOYSA-N 0 0 389.751 3.420 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@@H](C(=O)OCc2cccc([N+](=O)[O-])c2)C1 ZINC000126323834 1415417904 /nfs/dbraw/zinc/41/79/04/1415417904.db2.gz WCODYRXCQIJXAO-GOSISDBHSA-N 0 0 382.416 3.119 20 5 GGBDRN O=Cc1ccc(OS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c(Cl)c1 ZINC000126334959 1415420503 /nfs/dbraw/zinc/42/05/03/1415420503.db2.gz UEFZZCUNVFXRSZ-UHFFFAOYSA-N 0 0 376.173 3.482 20 5 GGBDRN COCCOc1ccc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])cc1 ZINC000126351451 1415424087 /nfs/dbraw/zinc/42/40/87/1415424087.db2.gz YJNZWZDWJCTKTB-UHFFFAOYSA-N 0 0 387.436 3.370 20 5 GGBDRN CCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](C)CS(=O)(=O)CC ZINC000126362443 1415426854 /nfs/dbraw/zinc/42/68/54/1415426854.db2.gz OZTSYSFZQWHZSH-CQSZACIVSA-N 0 0 380.466 3.500 20 5 GGBDRN CC(C)(C)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1 ZINC000126362572 1415426950 /nfs/dbraw/zinc/42/69/50/1415426950.db2.gz IQKWBKRVBUOFNN-INIZCTEOSA-N 0 0 375.400 3.189 20 5 GGBDRN CN(CCCOc1ccc(F)cc1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126369029 1415428593 /nfs/dbraw/zinc/42/85/93/1415428593.db2.gz RWJQHAVJXDNQRX-UHFFFAOYSA-N 0 0 375.400 3.387 20 5 GGBDRN O=C(c1ccncc1F)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000126370055 1415428601 /nfs/dbraw/zinc/42/86/01/1415428601.db2.gz VGZLLRJZGXODDS-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCOC2(C1)CCCCCC2 ZINC000126369983 1415428715 /nfs/dbraw/zinc/42/87/15/1415428715.db2.gz OQCUIGYZYRXTJG-UHFFFAOYSA-N 0 0 398.463 3.201 20 5 GGBDRN O=C(CN[C@@H](c1ccccc1)C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000126371927 1415429302 /nfs/dbraw/zinc/42/93/02/1415429302.db2.gz HUWKTWKOPHVFTH-KRWDZBQOSA-N 0 0 379.338 3.377 20 5 GGBDRN Cc1ccccc1[C@@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCO1 ZINC000126376047 1415430428 /nfs/dbraw/zinc/43/04/28/1415430428.db2.gz YVCHYRYLUONFDZ-UXHICEINSA-N 0 0 381.432 3.082 20 5 GGBDRN C[C@@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@@H](c2ccsc2)O1 ZINC000126386029 1415433447 /nfs/dbraw/zinc/43/34/47/1415433447.db2.gz 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O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000127017445 1415639288 /nfs/dbraw/zinc/63/92/88/1415639288.db2.gz JJSNPCQQJOSEET-UZLBHIALSA-N 0 0 398.463 3.474 20 5 GGBDRN COc1ccc(Cl)c(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000178067106 1428967164 /nfs/dbraw/zinc/96/71/64/1428967164.db2.gz VEUUYJUSPAVZFD-NSHDSACASA-N 0 0 391.811 3.381 20 5 GGBDRN CCCc1n[nH]c(C(=O)N(C)Cc2cccc(OC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000127020706 1415640470 /nfs/dbraw/zinc/64/04/70/1415640470.db2.gz AGWHADLOROPIJT-UHFFFAOYSA-N 0 0 386.330 3.441 20 5 GGBDRN CCc1c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cnn1CC(C)C ZINC000127036377 1415644732 /nfs/dbraw/zinc/64/47/32/1415644732.db2.gz BRMWNDYIBCTKRW-UHFFFAOYSA-N 0 0 382.424 3.448 20 5 GGBDRN Cn1cnnc1Sc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000127046925 1415647459 /nfs/dbraw/zinc/64/74/59/1415647459.db2.gz GPNOIWBQGCIDCC-UHFFFAOYSA-N 0 0 387.396 3.195 20 5 GGBDRN CC(=O)c1ccc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1C ZINC000127058876 1415649841 /nfs/dbraw/zinc/64/98/41/1415649841.db2.gz ZNQUPEHNZVZVLG-UHFFFAOYSA-N 0 0 389.795 3.128 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)N1CC[C@@H](CO)C1 ZINC000127061381 1415650620 /nfs/dbraw/zinc/65/06/20/1415650620.db2.gz BENIDRZMAKDRGB-CYBMUJFWSA-N 0 0 389.839 3.315 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)N1CC[C@H](CO)C1 ZINC000127061161 1415650628 /nfs/dbraw/zinc/65/06/28/1415650628.db2.gz BENIDRZMAKDRGB-ZDUSSCGKSA-N 0 0 389.839 3.315 20 5 GGBDRN CC(=O)N(c1nc(Cn2cc([N+](=O)[O-])ccc2=O)cs1)c1ccc(C)cc1 ZINC000127071330 1415653960 /nfs/dbraw/zinc/65/39/60/1415653960.db2.gz IYKDZBIUGPLQCH-UHFFFAOYSA-N 0 0 384.417 3.254 20 5 GGBDRN C[C@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1noc(-c2ccccc2)n1 ZINC000178078769 1428972182 /nfs/dbraw/zinc/97/21/82/1428972182.db2.gz HERINOAYMNDTOZ-ZDUSSCGKSA-N 0 0 396.407 3.117 20 5 GGBDRN C[C@](O)(CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1cccs1 ZINC000127133535 1415667657 /nfs/dbraw/zinc/66/76/57/1415667657.db2.gz RGQMMRAVIQTLQN-AWEZNQCLSA-N 0 0 385.239 3.056 20 5 GGBDRN CC(C)(NC(=O)Nc1cccn(CC(F)(F)F)c1=O)c1ccc([N+](=O)[O-])cc1 ZINC000127145797 1415671389 /nfs/dbraw/zinc/67/13/89/1415671389.db2.gz MXJIAVNILVYZJX-UHFFFAOYSA-N 0 0 398.341 3.376 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000127147433 1415671681 /nfs/dbraw/zinc/67/16/81/1415671681.db2.gz XJNWVTJDGIIMHX-CYBMUJFWSA-N 0 0 393.802 3.405 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000127157336 1415674546 /nfs/dbraw/zinc/67/45/46/1415674546.db2.gz MGZJNGBQNQXILA-SFHVURJKSA-N 0 0 385.811 3.054 20 5 GGBDRN COc1ccc(OCC(=O)N[C@@H](C)Cc2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000127163507 1415675624 /nfs/dbraw/zinc/67/56/24/1415675624.db2.gz GNFFQOLVMCDBOW-NSHDSACASA-N 0 0 380.347 3.008 20 5 GGBDRN CC(C)[C@@H](O)C(C)(C)CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000127197967 1415684386 /nfs/dbraw/zinc/68/43/86/1415684386.db2.gz SVUFMGLEOYAIAS-JOCHJYFZSA-N 0 0 380.488 3.314 20 5 GGBDRN CCCc1cc(C(=O)OC2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)n[nH]1 ZINC000127225010 1415693153 /nfs/dbraw/zinc/69/31/53/1415693153.db2.gz INLHFZZFIURGMD-UHFFFAOYSA-N 0 0 388.424 3.105 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCCCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000127227098 1415694092 /nfs/dbraw/zinc/69/40/92/1415694092.db2.gz VXAGZFJSRHHABX-NVXWUHKLSA-N 0 0 388.420 3.462 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccc3scnc3c2)cc1[N+](=O)[O-] ZINC000178064102 1428964388 /nfs/dbraw/zinc/96/43/88/1428964388.db2.gz FSOZIOWUZGOKJL-NSHDSACASA-N 0 0 384.417 3.329 20 5 GGBDRN COc1c(F)cc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000178065134 1428965159 /nfs/dbraw/zinc/96/51/59/1428965159.db2.gz OAWIORBNXCAWHW-SNVBAGLBSA-N 0 0 393.346 3.006 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178064575 1428965576 /nfs/dbraw/zinc/96/55/76/1428965576.db2.gz IZUHVTPPWUDRBP-NSHDSACASA-N 0 0 391.811 3.381 20 5 GGBDRN COc1cc(N2CCC(OC(=O)c3c(C)noc3C)CC2)ccc1[N+](=O)[O-] ZINC000127240897 1415700010 /nfs/dbraw/zinc/70/00/10/1415700010.db2.gz JMMHBEQQMCCODG-UHFFFAOYSA-N 0 0 375.381 3.034 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cccc3cnccc32)cc1[N+](=O)[O-] ZINC000178064492 1428965630 /nfs/dbraw/zinc/96/56/30/1428965630.db2.gz PFUOIWOXXFTVTO-CYBMUJFWSA-N 0 0 378.388 3.267 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCc2ccccc2[C@@H]1CO ZINC000127245228 1415702258 /nfs/dbraw/zinc/70/22/58/1415702258.db2.gz XKTNWBZDRTWZDR-QHCPKHFHSA-N 0 0 398.462 3.273 20 5 GGBDRN COc1cc(N2CCC(OC(=O)Cc3cccs3)CC2)ccc1[N+](=O)[O-] ZINC000127250477 1415704429 /nfs/dbraw/zinc/70/44/29/1415704429.db2.gz WOJVHBSQROKROI-UHFFFAOYSA-N 0 0 376.434 3.420 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1(C)C ZINC000127255131 1415705480 /nfs/dbraw/zinc/70/54/80/1415705480.db2.gz FYRSGFXTMLDJRF-OALUTQOASA-N 0 0 389.496 3.473 20 5 GGBDRN CC[C@@H](CNC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)Oc1cccc(C)c1 ZINC000178090248 1428977428 /nfs/dbraw/zinc/97/74/28/1428977428.db2.gz GMGBVTNSDCWCOI-INIZCTEOSA-N 0 0 385.420 3.124 20 5 GGBDRN CS(=O)(=O)c1cccc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000178094639 1428978831 /nfs/dbraw/zinc/97/88/31/1428978831.db2.gz MDLQJCIBVDKIIT-UHFFFAOYSA-N 0 0 389.433 3.195 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1c(F)cccc1N1CCCC1 ZINC000127281541 1415716410 /nfs/dbraw/zinc/71/64/10/1415716410.db2.gz RHWFAEFLPBZFBC-UHFFFAOYSA-N 0 0 395.412 3.144 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000127289298 1415720609 /nfs/dbraw/zinc/72/06/09/1415720609.db2.gz KBCDLUCVFAWCBI-GHMZBOCLSA-N 0 0 384.358 3.427 20 5 GGBDRN Cc1nc(CNC(=O)Cn2cc([N+](=O)[O-])nc2C)oc1-c1ccc(Cl)cc1 ZINC000127295727 1415724406 /nfs/dbraw/zinc/72/44/06/1415724406.db2.gz NFBLOYOJRDIZFH-UHFFFAOYSA-N 0 0 389.799 3.033 20 5 GGBDRN C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000127320715 1415735820 /nfs/dbraw/zinc/73/58/20/1415735820.db2.gz QLVJJHWLHHYZBU-CHWSQXEVSA-N 0 0 377.828 3.061 20 5 GGBDRN CC[S@@](=O)[C@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000178109174 1428985299 /nfs/dbraw/zinc/98/52/99/1428985299.db2.gz PNDKHMNMAFONAT-JOYGVZFFSA-N 0 0 393.509 3.005 20 5 GGBDRN CC[NH+](CC)CCOc1ccccc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000127348189 1415747416 /nfs/dbraw/zinc/74/74/16/1415747416.db2.gz WQLJBMCNNPNSDL-UHFFFAOYSA-N 0 0 393.465 3.116 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)c1noc(-c2ccccc2)n1 ZINC000178111033 1428986173 /nfs/dbraw/zinc/98/61/73/1428986173.db2.gz MDTAFNKYXKVOFP-LBPRGKRZSA-N 0 0 397.391 3.214 20 5 GGBDRN Cn1c(-c2ccc(Cl)cc2)nnc1S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000178111804 1428986430 /nfs/dbraw/zinc/98/64/30/1428986430.db2.gz LYHZRQUNKIMFAL-UHFFFAOYSA-N 0 0 392.824 3.018 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1(C)C ZINC000127361933 1415752977 /nfs/dbraw/zinc/75/29/77/1415752977.db2.gz DMIZMMPNWQYEPZ-QZTJIDSGSA-N 0 0 375.469 3.471 20 5 GGBDRN CC[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccccc1 ZINC000127364273 1415753490 /nfs/dbraw/zinc/75/34/90/1415753490.db2.gz WDGJGEZGIOAPME-INIZCTEOSA-N 0 0 383.448 3.355 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccccc21 ZINC000127363038 1415753805 /nfs/dbraw/zinc/75/38/05/1415753805.db2.gz OJKANFIXQKEXNS-OAHLLOKOSA-N 0 0 381.388 3.042 20 5 GGBDRN COc1ccc(C)cc1[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127366285 1415754926 /nfs/dbraw/zinc/75/49/26/1415754926.db2.gz ZXTDPUJYJHKWKV-HNNXBMFYSA-N 0 0 399.447 3.239 20 5 GGBDRN O=C(N[C@@H]1CCN(C(=O)c2ccccn2)C1)c1cc2ccccc2c2cccnc12 ZINC000178114674 1428988193 /nfs/dbraw/zinc/98/81/93/1428988193.db2.gz KXMZKALMMJRDAI-QGZVFWFLSA-N 0 0 396.450 3.428 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000127389980 1415762407 /nfs/dbraw/zinc/76/24/07/1415762407.db2.gz DIBUDBAPCNSYKK-XIKOKIGWSA-N 0 0 394.859 3.344 20 5 GGBDRN C[C@@H](Sc1n[nH]c(-c2cccnc2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000127394634 1415764344 /nfs/dbraw/zinc/76/43/44/1415764344.db2.gz BAXJRCOPWVEAKD-SECBINFHSA-N 0 0 388.384 3.033 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCn4c(nnc4C(F)(F)F)C3)o2)cc1 ZINC000127423099 1415773538 /nfs/dbraw/zinc/77/35/38/1415773538.db2.gz CSVYHCPHMLPLIY-UHFFFAOYSA-N 0 0 393.325 3.481 20 5 GGBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000127426779 1415774736 /nfs/dbraw/zinc/77/47/36/1415774736.db2.gz JJHKAPAKWANUOR-CYBMUJFWSA-N 0 0 396.378 3.311 20 5 GGBDRN O=C(N[C@H]1CCN(C(=O)C2CCCC2)C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178130498 1428993001 /nfs/dbraw/zinc/99/30/01/1428993001.db2.gz RGMAOFQVDRQLHE-AWEZNQCLSA-N 0 0 387.461 3.330 20 5 GGBDRN O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc(F)cc2)ccc1Br ZINC000127448406 1415782941 /nfs/dbraw/zinc/78/29/41/1415782941.db2.gz RVTPCIAHCOUNJB-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N2CSC[C@H]2C(=O)N2CCCC2)cc1[N+](=O)[O-] ZINC000127469312 1415792158 /nfs/dbraw/zinc/79/21/58/1415792158.db2.gz GKLMEPVCDIPFLE-INIZCTEOSA-N 0 0 391.493 3.030 20 5 GGBDRN O=C(Nc1ccc(N2CCCC2=O)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000127515161 1415803708 /nfs/dbraw/zinc/80/37/08/1415803708.db2.gz LNNPNTKXYRVPHR-UHFFFAOYSA-N 0 0 391.387 3.160 20 5 GGBDRN CCOc1ccccc1N(C)C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000127530931 1415805564 /nfs/dbraw/zinc/80/55/64/1415805564.db2.gz UCTDXLINOGZBCW-UHFFFAOYSA-N 0 0 391.811 3.040 20 5 GGBDRN CN(Cc1cn(C)nc1C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000127547470 1415808176 /nfs/dbraw/zinc/80/81/76/1415808176.db2.gz KOTBOTCBLXYIHD-UHFFFAOYSA-N 0 0 382.302 3.034 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(C)c(OCC(F)F)c1 ZINC000127569531 1415811655 /nfs/dbraw/zinc/81/16/55/1415811655.db2.gz OJKPFQBAOBAVQU-UHFFFAOYSA-N 0 0 393.346 3.433 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1OCC(F)F ZINC000127575057 1415812613 /nfs/dbraw/zinc/81/26/13/1415812613.db2.gz QBWUSQCWGSUEEU-UHFFFAOYSA-N 0 0 393.346 3.433 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC1(N2CCOCC2)CCCCC1 ZINC000127582044 1415813612 /nfs/dbraw/zinc/81/36/12/1415813612.db2.gz ZHQROTSLEGFWTA-UHFFFAOYSA-N 0 0 390.484 3.368 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1OS(=O)(=O)c1cnn(-c2ccccc2)c1 ZINC000127583321 1415813763 /nfs/dbraw/zinc/81/37/63/1415813763.db2.gz BOXXQKBNYCHRPY-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1 ZINC000127582606 1415813814 /nfs/dbraw/zinc/81/38/14/1415813814.db2.gz WIRREKUZMKLGOO-SFHVURJKSA-N 0 0 398.463 3.234 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12 ZINC000127621857 1415821344 /nfs/dbraw/zinc/82/13/44/1415821344.db2.gz KXAJACFWJHOSQP-OAHLLOKOSA-N 0 0 382.420 3.418 20 5 GGBDRN Cc1ccc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)s1 ZINC000127630269 1415823239 /nfs/dbraw/zinc/82/32/39/1415823239.db2.gz UFUSHRHJZATGDK-UHFFFAOYSA-N 0 0 375.450 3.074 20 5 GGBDRN CCN1CCc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N3CCOCC3)cc21 ZINC000127630543 1415823270 /nfs/dbraw/zinc/82/32/70/1415823270.db2.gz KFZSAVYMOAZRBN-UHFFFAOYSA-N 0 0 396.447 3.066 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@@H]3CCC[C@H]3O)cc2[N+](=O)[O-])CC1 ZINC000127641524 1415824946 /nfs/dbraw/zinc/82/49/46/1415824946.db2.gz AUQWVDJJIAPWMF-QFBILLFUSA-N 0 0 375.469 3.064 20 5 GGBDRN Nc1c(C(=O)N2CCCN(Cc3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000178158424 1429002598 /nfs/dbraw/zinc/00/25/98/1429002598.db2.gz UVUXKKVTOSQGJR-UHFFFAOYSA-N 0 0 388.855 3.179 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000127661321 1415828596 /nfs/dbraw/zinc/82/85/96/1415828596.db2.gz JPKYWAJQPZUYBE-UHFFFAOYSA-N 0 0 393.346 3.102 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c(N)c([N+](=O)[O-])c1 ZINC000178161565 1429003068 /nfs/dbraw/zinc/00/30/68/1429003068.db2.gz LVMDEDOGZHPSMN-UHFFFAOYSA-N 0 0 388.387 3.472 20 5 GGBDRN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000178168136 1429004922 /nfs/dbraw/zinc/00/49/22/1429004922.db2.gz LYPJOSHMHILRKJ-UHFFFAOYSA-N 0 0 396.325 3.030 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cc(F)c(F)c(F)c1 ZINC000127696151 1415835330 /nfs/dbraw/zinc/83/53/30/1415835330.db2.gz CMIWQBIZSMQXBE-UHFFFAOYSA-N 0 0 395.293 3.339 20 5 GGBDRN COC(=O)c1ccc(C(=O)OCc2ccc([N+](=O)[O-])cc2Br)o1 ZINC000127698323 1415835344 /nfs/dbraw/zinc/83/53/44/1415835344.db2.gz PBNXIHBDBXUXKT-UHFFFAOYSA-N 0 0 384.138 3.094 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127704011 1415836339 /nfs/dbraw/zinc/83/63/39/1415836339.db2.gz CRKDJVAUWUBLJY-HUUCEWRRSA-N 0 0 393.509 3.178 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](CC(C)C)N1CCOCC1 ZINC000127708977 1415836699 /nfs/dbraw/zinc/83/66/99/1415836699.db2.gz ZHOQCZHKWKDAEW-MRXNPFEDSA-N 0 0 378.473 3.080 20 5 GGBDRN CCCc1csc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)n1 ZINC000127714022 1415837871 /nfs/dbraw/zinc/83/78/71/1415837871.db2.gz JTDGGSPJYWHVBU-NSHDSACASA-N 0 0 394.478 3.309 20 5 GGBDRN CCS[C@@H]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127720751 1415838891 /nfs/dbraw/zinc/83/88/91/1415838891.db2.gz HNJYAOCZDHMXNK-LSDHHAIUSA-N 0 0 393.509 3.226 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@H](c2ccccc2F)C1 ZINC000127724950 1415839429 /nfs/dbraw/zinc/83/94/29/1415839429.db2.gz YUWYUALCYWMQEU-IBGZPJMESA-N 0 0 383.379 3.358 20 5 GGBDRN CSc1ccc(C(=O)N[C@](C)(C(N)=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000178169738 1429005650 /nfs/dbraw/zinc/00/56/50/1429005650.db2.gz RUCSBOKYYJSHNX-KRWDZBQOSA-N 0 0 393.852 3.101 20 5 GGBDRN O=C(Nc1ccc2c(c1)C(=O)CCC2)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127729671 1415840002 /nfs/dbraw/zinc/84/00/02/1415840002.db2.gz JKZGBBUGXYZYAJ-UHFFFAOYSA-N 0 0 395.415 3.203 20 5 GGBDRN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127732498 1415840710 /nfs/dbraw/zinc/84/07/10/1415840710.db2.gz JOFUARQWKPGMQP-FUHWJXTLSA-N 0 0 395.459 3.450 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)s1 ZINC000127734707 1415841144 /nfs/dbraw/zinc/84/11/44/1415841144.db2.gz YDTYVDKRSYRAAA-UHFFFAOYSA-N 0 0 386.437 3.391 20 5 GGBDRN Cc1ccccc1Cc1nnc(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000127750607 1415844044 /nfs/dbraw/zinc/84/40/44/1415844044.db2.gz ZMZDMIJKMWZCNX-UHFFFAOYSA-N 0 0 376.376 3.184 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000127755589 1415844491 /nfs/dbraw/zinc/84/44/91/1415844491.db2.gz MLTYQVVZDNXJNW-UHFFFAOYSA-N 0 0 380.326 3.277 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ncc(Cc3cccc(F)c3)s2)c1[N+](=O)[O-] ZINC000127755321 1415844808 /nfs/dbraw/zinc/84/48/08/1415844808.db2.gz DKRVUSGOUQUCSH-UHFFFAOYSA-N 0 0 375.385 3.075 20 5 GGBDRN COc1cc([C@@H](C)NC(=O)c2c([N+](=O)[O-])c(C)nn2C)ccc1OCC(C)C ZINC000127759509 1415845326 /nfs/dbraw/zinc/84/53/26/1415845326.db2.gz SVVQDVUBLJULHD-GFCCVEGCSA-N 0 0 390.440 3.171 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)nc(C)n1 ZINC000178174649 1429007291 /nfs/dbraw/zinc/00/72/91/1429007291.db2.gz DOFNDUHFMXWJNC-UHFFFAOYSA-N 0 0 389.843 3.054 20 5 GGBDRN COc1ccc2[nH]cc(C3=CCN(C(=O)c4cc([N+](=O)[O-])c[nH]c4=O)CC3)c2c1 ZINC000127787203 1415850458 /nfs/dbraw/zinc/85/04/58/1415850458.db2.gz MOKHPDDZNIAUGZ-UHFFFAOYSA-N 0 0 394.387 3.115 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)n1 ZINC000178174480 1429007714 /nfs/dbraw/zinc/00/77/14/1429007714.db2.gz SSIFLSQMAPNDKJ-UHFFFAOYSA-N 0 0 394.353 3.279 20 5 GGBDRN CCc1cc(N2CCC[C@@H](NC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)C2)ncn1 ZINC000127790145 1415851171 /nfs/dbraw/zinc/85/11/71/1415851171.db2.gz UNUAKVSXGHWSKA-MRXNPFEDSA-N 0 0 398.467 3.355 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCCN(C(=O)c2ccccc2F)CC1 ZINC000127795668 1415852182 /nfs/dbraw/zinc/85/21/82/1415852182.db2.gz BJMOPCHMNNIBFD-UHFFFAOYSA-N 0 0 386.383 3.114 20 5 GGBDRN O=C(NCc1ccccn1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000127797489 1415852472 /nfs/dbraw/zinc/85/24/72/1415852472.db2.gz MEJUUYNJOPAZJV-UHFFFAOYSA-N 0 0 392.202 3.412 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)cn1 ZINC000127819182 1415856726 /nfs/dbraw/zinc/85/67/26/1415856726.db2.gz BZXSCILCFUSKSD-QGZVFWFLSA-N 0 0 389.358 3.237 20 5 GGBDRN COc1cc(CNc2ccc(C(N)=O)cc2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000127821403 1415857014 /nfs/dbraw/zinc/85/70/14/1415857014.db2.gz FUEZFFNTODIPGP-UHFFFAOYSA-N 0 0 399.325 3.256 20 5 GGBDRN CC(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1C ZINC000127832825 1415859076 /nfs/dbraw/zinc/85/90/76/1415859076.db2.gz WROZLVPMFQFCFC-UHFFFAOYSA-N 0 0 383.404 3.195 20 5 GGBDRN C[C@H](O)[C@H]1CCCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000127848873 1415862463 /nfs/dbraw/zinc/86/24/63/1415862463.db2.gz HYMFRKLPOSPMMY-RYUDHWBXSA-N 0 0 389.374 3.035 20 5 GGBDRN Cc1c([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2N)cnn1-c1ccc(F)cc1 ZINC000178180052 1429009749 /nfs/dbraw/zinc/00/97/49/1429009749.db2.gz SSKJULJPKJWLPZ-NSHDSACASA-N 0 0 383.383 3.301 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1cccc(F)c1F ZINC000127853773 1415863628 /nfs/dbraw/zinc/86/36/28/1415863628.db2.gz RLRFDILWISAIPC-GFCCVEGCSA-N 0 0 391.374 3.201 20 5 GGBDRN Cc1csc(N2CCN(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2)n1 ZINC000127867268 1415866210 /nfs/dbraw/zinc/86/62/10/1415866210.db2.gz AELZXDHGSMTIMC-UHFFFAOYSA-N 0 0 375.454 3.331 20 5 GGBDRN O=C(N[C@@H]1CCCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127868370 1415866240 /nfs/dbraw/zinc/86/62/40/1415866240.db2.gz NQGPXCGYPCIXKR-GOSISDBHSA-N 0 0 399.422 3.378 20 5 GGBDRN O=C(N[C@H]1CCCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127868575 1415866867 /nfs/dbraw/zinc/86/68/67/1415866867.db2.gz NQGPXCGYPCIXKR-SFHVURJKSA-N 0 0 399.422 3.378 20 5 GGBDRN Cn1ccnc1Sc1ccc(F)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000178184397 1429011188 /nfs/dbraw/zinc/01/11/88/1429011188.db2.gz YZJZQJJLGKMREO-UHFFFAOYSA-N 0 0 387.396 3.453 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1 ZINC000178185515 1429011904 /nfs/dbraw/zinc/01/19/04/1429011904.db2.gz OAHSXPDWZDXGQH-GJZGRUSLSA-N 0 0 384.436 3.160 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC(OC[C@@H]2CCCO2)CC1 ZINC000127898561 1415872459 /nfs/dbraw/zinc/87/24/59/1415872459.db2.gz SQEGZMIQZREODX-INIZCTEOSA-N 0 0 377.441 3.404 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)NC1CC1 ZINC000127899056 1415872464 /nfs/dbraw/zinc/87/24/64/1415872464.db2.gz VACGHLDNZZRWQC-UHFFFAOYSA-N 0 0 382.420 3.127 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(-n3cnc4ccccc43)cc2)c1[N+](=O)[O-] ZINC000127918817 1415875265 /nfs/dbraw/zinc/87/52/65/1415875265.db2.gz CGBYPKIXHGQDDE-UHFFFAOYSA-N 0 0 376.376 3.228 20 5 GGBDRN Cc1cccc([C@H](O)CN(Cc2ccccc2)C(=O)c2c([N+](=O)[O-])cnn2C)c1 ZINC000127919375 1415875453 /nfs/dbraw/zinc/87/54/53/1415875453.db2.gz UOBAEKHKQCVDBW-LJQANCHMSA-N 0 0 394.431 3.013 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CC2)c1 ZINC000127929114 1415876980 /nfs/dbraw/zinc/87/69/80/1415876980.db2.gz WZMSHHSSVNKWAN-UHFFFAOYSA-N 0 0 395.419 3.196 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccccc1CS(C)(=O)=O ZINC000127935433 1415878075 /nfs/dbraw/zinc/87/80/75/1415878075.db2.gz PYANMEOWTFVYLM-UHFFFAOYSA-N 0 0 391.449 3.078 20 5 GGBDRN Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000178186985 1429012793 /nfs/dbraw/zinc/01/27/93/1429012793.db2.gz HDIOIDCVKRLINV-ZDUSSCGKSA-N 0 0 388.855 3.395 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Oc1ccc(N(C)C(=O)C(C)(C)C)cc1 ZINC000127940227 1415879342 /nfs/dbraw/zinc/87/93/42/1415879342.db2.gz ITXJBFBFNLEIIU-UHFFFAOYSA-N 0 0 388.424 3.104 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)C1(c2ccc(F)cc2F)CCCC1 ZINC000127940541 1415879383 /nfs/dbraw/zinc/87/93/83/1415879383.db2.gz ZGOUSSASSILHPP-UHFFFAOYSA-N 0 0 379.363 3.433 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])CC2)nc(C)n1 ZINC000178190547 1429014108 /nfs/dbraw/zinc/01/41/08/1429014108.db2.gz MVUHRDKSORZZCL-UHFFFAOYSA-N 0 0 389.843 3.054 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)cccc1[N+](=O)[O-] ZINC000178192943 1429014496 /nfs/dbraw/zinc/01/44/96/1429014496.db2.gz WLHLPOKQZRNNHJ-UHFFFAOYSA-N 0 0 388.277 3.104 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000128000944 1415890987 /nfs/dbraw/zinc/89/09/87/1415890987.db2.gz LHBQNHFVJQKKTQ-UHFFFAOYSA-N 0 0 386.389 3.394 20 5 GGBDRN CN1C(=O)CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000178193193 1429015010 /nfs/dbraw/zinc/01/50/10/1429015010.db2.gz PFEJVIJJUYQJMV-UHFFFAOYSA-N 0 0 389.795 3.027 20 5 GGBDRN Cc1c(CC(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)cccc1[N+](=O)[O-] ZINC000128011272 1415892798 /nfs/dbraw/zinc/89/27/98/1415892798.db2.gz HZRNSZDTKDEKOU-UHFFFAOYSA-N 0 0 385.811 3.378 20 5 GGBDRN CC(=O)c1ccc(Oc2ccc(C(=O)NCCn3cc([N+](=O)[O-])cn3)cc2)cc1 ZINC000128024043 1415895599 /nfs/dbraw/zinc/89/55/99/1415895599.db2.gz OQYIMHJMDKOGLC-UHFFFAOYSA-N 0 0 394.387 3.216 20 5 GGBDRN O=C(Cn1nccc1[N+](=O)[O-])N(Cc1ccccc1)c1nc2c(s1)CCCC2 ZINC000128036920 1415898225 /nfs/dbraw/zinc/89/82/25/1415898225.db2.gz HXBHQIJYHGEIIF-UHFFFAOYSA-N 0 0 397.460 3.360 20 5 GGBDRN CC(C)(C)[S@](=O)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2N)c1 ZINC000178201242 1429016613 /nfs/dbraw/zinc/01/66/13/1429016613.db2.gz LSLNLRVCZHIFBO-AREMUKBSSA-N 0 0 375.450 3.477 20 5 GGBDRN O=C(Cn1nccc1[N+](=O)[O-])Nc1ccccc1C(=O)Nc1ccc(Cl)cc1 ZINC000128060559 1415903272 /nfs/dbraw/zinc/90/32/72/1415903272.db2.gz ZOOKKJYBIWYDQM-UHFFFAOYSA-N 0 0 399.794 3.336 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N)cc2F)C[C@H](C)O1 ZINC000178168816 1429005101 /nfs/dbraw/zinc/00/51/01/1429005101.db2.gz DIHBWMZKZRWNBJ-RYUDHWBXSA-N 0 0 388.399 3.182 20 5 GGBDRN O=C(c1cncc(F)c1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000128082382 1415908095 /nfs/dbraw/zinc/90/80/95/1415908095.db2.gz XJIMNDROCJUJJK-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN CN(CC(=O)Nc1ccccc1)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128096054 1415911263 /nfs/dbraw/zinc/91/12/63/1415911263.db2.gz MMSITHNGIYCPGN-UHFFFAOYSA-N 0 0 381.310 3.324 20 5 GGBDRN COc1ccc([C@H]2CCCN2C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000128101321 1415912936 /nfs/dbraw/zinc/91/29/36/1415912936.db2.gz VWUWZRHEARPVFJ-GOSISDBHSA-N 0 0 383.404 3.214 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCN(CC(F)(F)F)[C@@H](C)C1 ZINC000128113569 1415915377 /nfs/dbraw/zinc/91/53/77/1415915377.db2.gz WAZCUQWTUMPWEA-RYUDHWBXSA-N 0 0 399.373 3.274 20 5 GGBDRN O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cn[nH]c1 ZINC000128115003 1415916112 /nfs/dbraw/zinc/91/61/12/1415916112.db2.gz LEDJLUQJWMIKFN-UHFFFAOYSA-N 0 0 388.387 3.352 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(C)c(OCC3CCOCC3)c2)c1[N+](=O)[O-] ZINC000128119763 1415917269 /nfs/dbraw/zinc/91/72/69/1415917269.db2.gz YLJXWDSVIHWVSM-UHFFFAOYSA-N 0 0 388.424 3.003 20 5 GGBDRN CC(C)CC[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000128122378 1415918210 /nfs/dbraw/zinc/91/82/10/1415918210.db2.gz DRYDQNGNHOCJAG-HNNXBMFYSA-N 0 0 382.482 3.429 20 5 GGBDRN O=C(CNc1cccc(OC(F)(F)F)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178242336 1429029516 /nfs/dbraw/zinc/02/95/16/1429029516.db2.gz GFIXJXHSUMSVML-UHFFFAOYSA-N 0 0 381.310 3.495 20 5 GGBDRN C[C@H]1Cc2cc(-c3ccc(CNC(=O)c4[nH]ncc4[N+](=O)[O-])cc3)ccc2O1 ZINC000128159586 1415928271 /nfs/dbraw/zinc/92/82/71/1415928271.db2.gz UOVJEHDNFIOTQM-LBPRGKRZSA-N 0 0 378.388 3.238 20 5 GGBDRN O=C(CNc1cc(F)ccc1OC(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000128167847 1415930097 /nfs/dbraw/zinc/93/00/97/1415930097.db2.gz VJWSUIUUVMJOMA-UHFFFAOYSA-N 0 0 381.310 3.337 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000178208331 1429018952 /nfs/dbraw/zinc/01/89/52/1429018952.db2.gz UZPLVKOPLMVQNW-AWEZNQCLSA-N 0 0 394.214 3.437 20 5 GGBDRN Cc1ccc2c(c1)O[C@H](C)CN2C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000178212170 1429019902 /nfs/dbraw/zinc/01/99/02/1429019902.db2.gz ASEYDLDIVHNWFS-GFCCVEGCSA-N 0 0 379.372 3.172 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)Oc3cc(C)ccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000178213556 1429020014 /nfs/dbraw/zinc/02/00/14/1429020014.db2.gz GUHSMDSPAOXSJI-CYBMUJFWSA-N 0 0 393.403 3.220 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H](C)[C@H](OC)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000128190402 1415935345 /nfs/dbraw/zinc/93/53/45/1415935345.db2.gz MGLNPULXAZZATD-HWPZZCPQSA-N 0 0 380.832 3.430 20 5 GGBDRN CC(C)(C(=O)OCc1nc2cc(C(F)(F)F)ccc2o1)n1cc([N+](=O)[O-])cn1 ZINC000128197272 1415936758 /nfs/dbraw/zinc/93/67/58/1415936758.db2.gz IQDBYGSTOBQDLM-UHFFFAOYSA-N 0 0 398.297 3.430 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@@H]2OCCC[C@@H]2C1 ZINC000128198858 1415937290 /nfs/dbraw/zinc/93/72/90/1415937290.db2.gz MAINTBHUTIBDHB-IERDGZPVSA-N 0 0 376.456 3.182 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@H]2OCCC[C@H]2C1 ZINC000128199091 1415937558 /nfs/dbraw/zinc/93/75/58/1415937558.db2.gz MAINTBHUTIBDHB-HRAATJIYSA-N 0 0 376.456 3.182 20 5 GGBDRN C[C@]1(c2cc(F)cc(F)c2)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000178218923 1429021178 /nfs/dbraw/zinc/02/11/78/1429021178.db2.gz QUKFEMPNPPACCH-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000178222406 1429021647 /nfs/dbraw/zinc/02/16/47/1429021647.db2.gz RJEFLIWQLWCDAK-UHFFFAOYSA-N 0 0 392.165 3.468 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NO[C@@H]3CCCCO3)cc2[N+](=O)[O-])C1 ZINC000128241574 1415946949 /nfs/dbraw/zinc/94/69/49/1415946949.db2.gz QPGYLIYPIFQDBJ-QWQRMKEZSA-N 0 0 377.441 3.265 20 5 GGBDRN O=C(NCc1ccco1)[C@H]1CCCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000128269436 1415951787 /nfs/dbraw/zinc/95/17/87/1415951787.db2.gz WIBTVZBNOKMMRD-OAHLLOKOSA-N 0 0 395.362 3.070 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(CCCO)Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000128269890 1415952015 /nfs/dbraw/zinc/95/20/15/1415952015.db2.gz VEBTYGWYLBTZDZ-UHFFFAOYSA-N 0 0 398.868 3.130 20 5 GGBDRN Cn1cnc(-c2cccc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000128281716 1415954125 /nfs/dbraw/zinc/95/41/25/1415954125.db2.gz FCCLUZSKDNTLTB-UHFFFAOYSA-N 0 0 380.408 3.221 20 5 GGBDRN Cc1ccc(NC(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)cc1[N+](=O)[O-] ZINC000128285438 1415954741 /nfs/dbraw/zinc/95/47/41/1415954741.db2.gz UENZIGWXUBGFMD-CQSZACIVSA-N 0 0 390.346 3.108 20 5 GGBDRN CC(C)(C)C(=O)N1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000128301389 1415957927 /nfs/dbraw/zinc/95/79/27/1415957927.db2.gz NCZZGGSYYPRFKN-UHFFFAOYSA-N 0 0 384.274 3.048 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)CNc1cc([N+](=O)[O-])c(C)cc1C)CC2 ZINC000178227420 1429023737 /nfs/dbraw/zinc/02/37/37/1429023737.db2.gz YNLWGGNWTFZRKI-UHFFFAOYSA-N 0 0 399.447 3.226 20 5 GGBDRN Cn1cc(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)cn1 ZINC000128311143 1415960214 /nfs/dbraw/zinc/96/02/14/1415960214.db2.gz MOYQZTMXEBDIRX-UHFFFAOYSA-N 0 0 378.388 3.131 20 5 GGBDRN O=C(CN1CC[C@H](Oc2ccccc2Cl)C1)Nc1ccccc1[N+](=O)[O-] ZINC000128318896 1415962127 /nfs/dbraw/zinc/96/21/27/1415962127.db2.gz SNHRQZSPMGMRMM-ZDUSSCGKSA-N 0 0 375.812 3.340 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)c2cccc(-c3ccoc3)c2)c([N+](=O)[O-])c1 ZINC000128344840 1415967048 /nfs/dbraw/zinc/96/70/48/1415967048.db2.gz PILGDECQQODOJT-UHFFFAOYSA-N 0 0 395.371 3.223 20 5 GGBDRN CCOc1ccc(OCC)c(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000178232748 1429025329 /nfs/dbraw/zinc/02/53/29/1429025329.db2.gz QUDOJOZJWNSTSV-UHFFFAOYSA-N 0 0 385.420 3.393 20 5 GGBDRN C[C@]1(c2cccnc2Cl)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000178232790 1429025374 /nfs/dbraw/zinc/02/53/74/1429025374.db2.gz NTTPYMWUXDQEKB-MRXNPFEDSA-N 0 0 395.202 3.264 20 5 GGBDRN O=[N+]([O-])c1cccc(CNCc2ccccc2S(=O)(=O)N2CCCCC2)c1 ZINC000128374618 1415974251 /nfs/dbraw/zinc/97/42/51/1415974251.db2.gz AMDKJUZMODKHNC-UHFFFAOYSA-N 0 0 389.477 3.059 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c(Br)n1 ZINC000128379399 1415974727 /nfs/dbraw/zinc/97/47/27/1415974727.db2.gz WSHLYWPTCUZZMD-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN O=C(Cn1c2ccccc2nc1C1CCCCC1)NCCn1cc([N+](=O)[O-])cn1 ZINC000128383601 1415976175 /nfs/dbraw/zinc/97/61/75/1415976175.db2.gz AAUAXUYADKNXQH-UHFFFAOYSA-N 0 0 396.451 3.005 20 5 GGBDRN Cc1c(NC(=O)CNc2ccccc2[N+](=O)[O-])cccc1C(=O)N1CCCC1 ZINC000128387108 1415976635 /nfs/dbraw/zinc/97/66/35/1415976635.db2.gz PANXTEVKLWSDRC-UHFFFAOYSA-N 0 0 382.420 3.190 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(N2CCCS2(=O)=O)cc1Cl ZINC000128395713 1415978011 /nfs/dbraw/zinc/97/80/11/1415978011.db2.gz SEPIYAUGENETPU-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000128396988 1415978357 /nfs/dbraw/zinc/97/83/57/1415978357.db2.gz INZMBWORIPTJMN-UHFFFAOYSA-N 0 0 381.385 3.138 20 5 GGBDRN CC[C@H](c1ccncc1)N(C)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000128397605 1415978730 /nfs/dbraw/zinc/97/87/30/1415978730.db2.gz XVUIESXOOUGDPA-MRXNPFEDSA-N 0 0 398.419 3.288 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000128418360 1415982723 /nfs/dbraw/zinc/98/27/23/1415982723.db2.gz XDCSWXYJBGZZJE-LBPRGKRZSA-N 0 0 391.859 3.323 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCCc2nnc3ccccn32)cc1[N+](=O)[O-] ZINC000128421386 1415983188 /nfs/dbraw/zinc/98/31/88/1415983188.db2.gz QWDPMRMKSXXUEF-UHFFFAOYSA-N 0 0 381.436 3.298 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000128433917 1415986444 /nfs/dbraw/zinc/98/64/44/1415986444.db2.gz RGKCCWUGSZDOQW-UHFFFAOYSA-N 0 0 392.415 3.493 20 5 GGBDRN COc1cc(OCC(=O)NCCc2c[nH]c3c2cccc3C)ccc1[N+](=O)[O-] ZINC000128444639 1415988599 /nfs/dbraw/zinc/98/85/99/1415988599.db2.gz BALBPFQVVKSXFR-UHFFFAOYSA-N 0 0 383.404 3.131 20 5 GGBDRN Cc1cc(=O)n(CC(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000128455415 1415991101 /nfs/dbraw/zinc/99/11/01/1415991101.db2.gz SEVBYUOORSJZGE-INIZCTEOSA-N 0 0 389.427 3.498 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCOC4(CCC4)C3)cc2[N+](=O)[O-])C1 ZINC000128463856 1415993644 /nfs/dbraw/zinc/99/36/44/1415993644.db2.gz OTCZZGYVZVLTMP-HOTGVXAUSA-N 0 0 387.480 3.472 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCOC4(CCC4)C3)cc2[N+](=O)[O-])C1 ZINC000128463681 1415993828 /nfs/dbraw/zinc/99/38/28/1415993828.db2.gz OTCZZGYVZVLTMP-IYBDPMFKSA-N 0 0 387.480 3.472 20 5 GGBDRN CCOc1ccc([C@@H]2CCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000128476672 1415996287 /nfs/dbraw/zinc/99/62/87/1415996287.db2.gz XZWYLHMRJQJWNJ-SFHVURJKSA-N 0 0 383.404 3.296 20 5 GGBDRN Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)c1cccc([N+](=O)[O-])c1[O-] ZINC000128487389 1415998185 /nfs/dbraw/zinc/99/81/85/1415998185.db2.gz NTVHIKBCICYHID-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN CCc1ccc([C@@H](C)NC(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000128494735 1415999673 /nfs/dbraw/zinc/99/96/73/1415999673.db2.gz PYFUDQSPCFAICJ-CQSZACIVSA-N 0 0 379.420 3.293 20 5 GGBDRN COc1ccc(C2=N/C(=C\c3cc(F)c(F)cc3F)C(=O)O2)cc1[N+](=O)[O-] ZINC000128498077 1416000282 /nfs/dbraw/zinc/00/02/82/1416000282.db2.gz GLMWUTZLTARWSY-ACAGNQJTSA-N 0 0 378.262 3.365 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000128508625 1416002397 /nfs/dbraw/zinc/00/23/97/1416002397.db2.gz KEECTZWYEKPIAP-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000128509647 1416002675 /nfs/dbraw/zinc/00/26/75/1416002675.db2.gz QDIDAFALCZQXCM-GDBMZVCRSA-N 0 0 381.432 3.290 20 5 GGBDRN C[C@@H](O)C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000128509156 1416002730 /nfs/dbraw/zinc/00/27/30/1416002730.db2.gz QDIDAFALCZQXCM-ZBFHGGJFSA-N 0 0 381.432 3.290 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000128517028 1416004596 /nfs/dbraw/zinc/00/45/96/1416004596.db2.gz DCDWKLXKJMTXBW-AWEZNQCLSA-N 0 0 398.868 3.210 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1 ZINC000128519882 1416005160 /nfs/dbraw/zinc/00/51/60/1416005160.db2.gz UEDKUMCHFBQFQZ-AWEZNQCLSA-N 0 0 383.763 3.251 20 5 GGBDRN Cc1c(CC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)cccc1[N+](=O)[O-] ZINC000128540461 1416008907 /nfs/dbraw/zinc/00/89/07/1416008907.db2.gz YXCHLVYRRSFNTB-INIZCTEOSA-N 0 0 387.823 3.021 20 5 GGBDRN CC(=O)N(CCc1ccccc1)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000128543450 1416009724 /nfs/dbraw/zinc/00/97/24/1416009724.db2.gz VFDGWRDSDIPAOW-UHFFFAOYSA-N 0 0 375.812 3.278 20 5 GGBDRN COc1ccc([C@H]2CCCN2S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000128559499 1416013001 /nfs/dbraw/zinc/01/30/01/1416013001.db2.gz QYALKHGRBOSPAK-OAHLLOKOSA-N 0 0 380.397 3.268 20 5 GGBDRN O=C(CCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NCc1ccccc1 ZINC000128558509 1416013045 /nfs/dbraw/zinc/01/30/45/1416013045.db2.gz AGPOZYXOSFZSIW-UHFFFAOYSA-N 0 0 395.337 3.050 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000128559792 1416013530 /nfs/dbraw/zinc/01/35/30/1416013530.db2.gz FECKUKGECKYMCY-HNNXBMFYSA-N 0 0 398.868 3.210 20 5 GGBDRN CN(Cc1ccccc1N1CCCC1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000128565905 1416014956 /nfs/dbraw/zinc/01/49/56/1416014956.db2.gz NZZVJZRBSRRVCZ-UHFFFAOYSA-N 0 0 393.440 3.155 20 5 GGBDRN C[C@H](NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1nnc2ccccn21 ZINC000178278881 1429040819 /nfs/dbraw/zinc/04/08/19/1429040819.db2.gz LWPAMRFHMJRPNN-ZDUSSCGKSA-N 0 0 380.408 3.073 20 5 GGBDRN Cc1ccc(NC(=O)C(C)C)cc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178280070 1429040936 /nfs/dbraw/zinc/04/09/36/1429040936.db2.gz VPWXEMBQWROBNL-UHFFFAOYSA-N 0 0 396.447 3.499 20 5 GGBDRN Cc1c(CC(=O)N2CCN(c3cc(F)ccc3F)CC2)cccc1[N+](=O)[O-] ZINC000128609851 1416024553 /nfs/dbraw/zinc/02/45/53/1416024553.db2.gz LFJLXTQFIPAXEC-UHFFFAOYSA-N 0 0 375.375 3.073 20 5 GGBDRN C[C@@H]1CN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCN1CC(F)(F)F ZINC000128619081 1416027023 /nfs/dbraw/zinc/02/70/23/1416027023.db2.gz YESIERNIYCIAKQ-SECBINFHSA-N 0 0 380.754 3.349 20 5 GGBDRN CCc1cc(N2CCC[C@H](Cn3ccnn3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000128623584 1416027474 /nfs/dbraw/zinc/02/74/74/1416027474.db2.gz CNNHSSPKOPQQCQ-HNNXBMFYSA-N 0 0 393.451 3.122 20 5 GGBDRN O=C(c1ccc(O)cc1)C1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000128637751 1416030956 /nfs/dbraw/zinc/03/09/56/1416030956.db2.gz UJQDVTIVICNPLG-UHFFFAOYSA-N 0 0 395.415 3.284 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)c1[N+](=O)[O-] ZINC000128640133 1416031918 /nfs/dbraw/zinc/03/19/18/1416031918.db2.gz FFOXJFYOODQPEA-UHFFFAOYSA-N 0 0 385.405 3.203 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)Cn3cc([N+](=O)[O-])c(C)cc3=O)c2)cs1 ZINC000128657246 1416034954 /nfs/dbraw/zinc/03/49/54/1416034954.db2.gz HYMQUZCLEKLISH-UHFFFAOYSA-N 0 0 384.417 3.136 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)c1C ZINC000178289485 1429043167 /nfs/dbraw/zinc/04/31/67/1429043167.db2.gz WEDPDIOFDATOBA-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCO[C@H](c3ccc(F)cc3)C2)c1C ZINC000178289473 1429043408 /nfs/dbraw/zinc/04/34/08/1429043408.db2.gz WEDPDIOFDATOBA-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN CN(C(=O)CN1CC[C@@H](Oc2ccccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000128665420 1416037016 /nfs/dbraw/zinc/03/70/16/1416037016.db2.gz VCSJNQSPTMXIQK-MRXNPFEDSA-N 0 0 389.839 3.364 20 5 GGBDRN CN(C(=O)CN1CC[C@H](Oc2ccccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000128665187 1416037165 /nfs/dbraw/zinc/03/71/65/1416037165.db2.gz VCSJNQSPTMXIQK-INIZCTEOSA-N 0 0 389.839 3.364 20 5 GGBDRN CC[C@H](c1ccncc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000128690926 1416043290 /nfs/dbraw/zinc/04/32/90/1416043290.db2.gz PIMKHDALHLXSQS-GOSISDBHSA-N 0 0 384.436 3.050 20 5 GGBDRN C[C@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CCCC[C@@H]1O ZINC000178313991 1429050131 /nfs/dbraw/zinc/05/01/31/1429050131.db2.gz DWXRDTYUEDHDQH-AZUAARDMSA-N 0 0 375.469 3.256 20 5 GGBDRN Cc1ccccc1OCCN(C)C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000128693940 1416044644 /nfs/dbraw/zinc/04/46/44/1416044644.db2.gz SJBYXRLBVXMDHT-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN CCSCc1cccc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1 ZINC000128700704 1416046560 /nfs/dbraw/zinc/04/65/60/1416046560.db2.gz BYOPNNIQJUDXDH-UHFFFAOYSA-N 0 0 387.417 3.395 20 5 GGBDRN COc1cccc(-c2nnc(SCc3cc(F)ccc3[N+](=O)[O-])n2N)c1 ZINC000178319393 1429050464 /nfs/dbraw/zinc/05/04/64/1429050464.db2.gz NGTYOMXNVJMTDX-UHFFFAOYSA-N 0 0 375.385 3.007 20 5 GGBDRN Cc1cc(S(C)(=O)=O)cc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)c1C ZINC000128725416 1416051591 /nfs/dbraw/zinc/05/15/91/1416051591.db2.gz IFQPXMQJQDBXSB-UHFFFAOYSA-N 0 0 388.445 3.208 20 5 GGBDRN CC[C@@H]1CCC[C@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000128725658 1416052078 /nfs/dbraw/zinc/05/20/78/1416052078.db2.gz CDSNEBXXZWECKT-WBVHZDCISA-N 0 0 388.468 3.031 20 5 GGBDRN COc1ccc2c(c1)N(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C[C@H](C)O2 ZINC000128726225 1416052566 /nfs/dbraw/zinc/05/25/66/1416052566.db2.gz XRTOVGRZWYZDTI-LBPRGKRZSA-N 0 0 389.383 3.359 20 5 GGBDRN CC[C@H]1CCC[C@@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000128726331 1416052625 /nfs/dbraw/zinc/05/26/25/1416052625.db2.gz CDSNEBXXZWECKT-DOTOQJQBSA-N 0 0 388.468 3.031 20 5 GGBDRN COc1ccc([C@H]2CCCCCN2C(=O)Cn2cc([N+](=O)[O-])c(C)cc2=O)cc1 ZINC000128727522 1416053020 /nfs/dbraw/zinc/05/30/20/1416053020.db2.gz NKQZAQALIZKNFZ-GOSISDBHSA-N 0 0 399.447 3.217 20 5 GGBDRN C[C@]1(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CCCC[C@@H]1O ZINC000178325179 1429051751 /nfs/dbraw/zinc/05/17/51/1429051751.db2.gz SFLBUUQIGQCWCD-MAUKXSAKSA-N 0 0 375.450 3.389 20 5 GGBDRN Cc1cc(C(=O)NC(C)C)ccc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178323149 1429051914 /nfs/dbraw/zinc/05/19/14/1429051914.db2.gz DMCNZZKICQUUGY-UHFFFAOYSA-N 0 0 396.447 3.043 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC[C@@H]1CCO ZINC000128747098 1416057461 /nfs/dbraw/zinc/05/74/61/1416057461.db2.gz QPRPBFINCVNCSL-CYBMUJFWSA-N 0 0 389.374 3.179 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCO[C@@H](c3cccc(F)c3)C2)c1C ZINC000178328261 1429053008 /nfs/dbraw/zinc/05/30/08/1429053008.db2.gz KYNVVCXKDONQLI-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC(OCc2ccccc2)CC1 ZINC000128756807 1416060207 /nfs/dbraw/zinc/06/02/07/1416060207.db2.gz HBEDZYCZZVHUCZ-UHFFFAOYSA-N 0 0 397.431 3.050 20 5 GGBDRN O=c1c(Br)nn(Cc2ccc([N+](=O)[O-])cc2F)c2ccccc12 ZINC000128765367 1416063198 /nfs/dbraw/zinc/06/31/98/1416063198.db2.gz JSLCRFZLFONKKF-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCOc3ccc(F)cc32)c1C ZINC000178336549 1429054961 /nfs/dbraw/zinc/05/49/61/1429054961.db2.gz GVFOIKLAAYHWEU-AWEZNQCLSA-N 0 0 380.397 3.153 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1ccncc1)C[C@H]1CCCO1 ZINC000128798312 1416071633 /nfs/dbraw/zinc/07/16/33/1416071633.db2.gz MOEVBLONMLQITN-QGZVFWFLSA-N 0 0 387.461 3.290 20 5 GGBDRN CCOc1ccc(C(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000128799444 1416071826 /nfs/dbraw/zinc/07/18/26/1416071826.db2.gz FXIHTGDBKRCBQD-KRWDZBQOSA-N 0 0 385.420 3.210 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCOC[C@@H]1C1CC1 ZINC000128822052 1416077928 /nfs/dbraw/zinc/07/79/28/1416077928.db2.gz TZWOHOMXNKKBNJ-OAHLLOKOSA-N 0 0 387.358 3.053 20 5 GGBDRN COc1cc(N2CCC(OC(=O)/C=C/c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000128832634 1416079839 /nfs/dbraw/zinc/07/98/39/1416079839.db2.gz ZWAJFWRGTLZIDY-QPJJXVBHSA-N 0 0 383.404 3.224 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(C(=O)Nc2ccccc2O)CC1 ZINC000178350052 1429058209 /nfs/dbraw/zinc/05/82/09/1429058209.db2.gz JXPULOLLNZRCQV-UHFFFAOYSA-N 0 0 397.431 3.110 20 5 GGBDRN O=C(Nc1cccnc1OCC(F)F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000128861191 1416087058 /nfs/dbraw/zinc/08/70/58/1416087058.db2.gz WUDKKRVELJMEMN-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN COC(=O)[C@H](OC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000178297756 1429046023 /nfs/dbraw/zinc/04/60/23/1429046023.db2.gz ZLMOZKVDMGGHHN-CQSZACIVSA-N 0 0 394.177 3.428 20 5 GGBDRN C[C@@H](O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000128886540 1416093467 /nfs/dbraw/zinc/09/34/67/1416093467.db2.gz KFCGPPXFIHAMIX-HZPDHXFCSA-N 0 0 375.469 3.064 20 5 GGBDRN C[C@H](O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000128886990 1416093502 /nfs/dbraw/zinc/09/35/02/1416093502.db2.gz KFCGPPXFIHAMIX-JKSUJKDBSA-N 0 0 375.469 3.064 20 5 GGBDRN C[C@H](O)C[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000128904082 1416097361 /nfs/dbraw/zinc/09/73/61/1416097361.db2.gz AXHKDXOGZIVSPS-JSGCOSHPSA-N 0 0 398.868 3.081 20 5 GGBDRN C[C@@H](O)C[C@H](CNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 ZINC000128909271 1416099635 /nfs/dbraw/zinc/09/96/35/1416099635.db2.gz FIKMMIMDFPYUNY-TZMCWYRMSA-N 0 0 398.868 3.081 20 5 GGBDRN C[C@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(c1ccccc1)c1ccccc1 ZINC000178307886 1429048091 /nfs/dbraw/zinc/04/80/91/1429048091.db2.gz KNGMUAATQLJQAT-INIZCTEOSA-N 0 0 393.447 3.311 20 5 GGBDRN COc1ccccc1OC[C@H](C)CNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000128932381 1416106250 /nfs/dbraw/zinc/10/62/50/1416106250.db2.gz DPEONXNUDAGSIM-GFCCVEGCSA-N 0 0 376.384 3.496 20 5 GGBDRN COc1cccc(C[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)c2ccccc2)c1 ZINC000178353559 1429059301 /nfs/dbraw/zinc/05/93/01/1429059301.db2.gz VLFTXSYIZSORAQ-LJQANCHMSA-N 0 0 381.388 3.327 20 5 GGBDRN O=C(CCN1CCc2c(F)cc(F)cc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000128947134 1416110718 /nfs/dbraw/zinc/11/07/18/1416110718.db2.gz CFFPREJJNGEARO-UHFFFAOYSA-N 0 0 379.338 3.399 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cccnc1OCC(F)F ZINC000128952658 1416112175 /nfs/dbraw/zinc/11/21/75/1416112175.db2.gz OAXXVFSSMSYEGH-UHFFFAOYSA-N 0 0 376.319 3.296 20 5 GGBDRN C[C@]1(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCCC[C@H]1O ZINC000178359816 1429060798 /nfs/dbraw/zinc/06/07/98/1429060798.db2.gz MEHUGYKUGAQSJF-NFBKMPQASA-N 0 0 378.472 3.212 20 5 GGBDRN C[C@]1(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCCC[C@@H]1O ZINC000178359788 1429060903 /nfs/dbraw/zinc/06/09/03/1429060903.db2.gz MEHUGYKUGAQSJF-NZQKXSOJSA-N 0 0 378.472 3.212 20 5 GGBDRN O=C(NC[C@@H](c1ccccc1)N1CCOCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128980485 1416118876 /nfs/dbraw/zinc/11/88/76/1416118876.db2.gz GWWDDAMEZJAODV-SFHVURJKSA-N 0 0 389.839 3.052 20 5 GGBDRN O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128989788 1416120951 /nfs/dbraw/zinc/12/09/51/1416120951.db2.gz PKVGFDDDQRHWSZ-UHFFFAOYSA-N 0 0 387.779 3.150 20 5 GGBDRN COc1ccccc1OC[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000129000518 1416122799 /nfs/dbraw/zinc/12/27/99/1416122799.db2.gz YEEZUYKKVNMEJS-AWEZNQCLSA-N 0 0 387.436 3.114 20 5 GGBDRN CS(=O)(=O)c1cccc(OC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000129002016 1416123373 /nfs/dbraw/zinc/12/33/73/1416123373.db2.gz OSBQSOUTUPIAGT-UHFFFAOYSA-N 0 0 389.307 3.236 20 5 GGBDRN CNC(=O)c1cc(Br)ccc1NC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000129042267 1416132383 /nfs/dbraw/zinc/13/23/83/1416132383.db2.gz VNIIBOCYDNODIR-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN Cc1c(CC(=O)N2CCOC[C@H]2CC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000129064204 1416136407 /nfs/dbraw/zinc/13/64/07/1416136407.db2.gz XOKXBLNRSXTHSY-OAHLLOKOSA-N 0 0 388.445 3.008 20 5 GGBDRN Cc1ccc(OC(F)F)c(CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 ZINC000129073373 1416138206 /nfs/dbraw/zinc/13/82/06/1416138206.db2.gz SITIHSBLOPMDHV-UHFFFAOYSA-N 0 0 381.291 3.343 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1[N+](=O)[O-] ZINC000178377548 1429064939 /nfs/dbraw/zinc/06/49/39/1429064939.db2.gz GIRUKANGHMCVJM-GFCCVEGCSA-N 0 0 389.433 3.116 20 5 GGBDRN O=C(NCc1ccn2ccnc2c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000178376948 1429065202 /nfs/dbraw/zinc/06/52/02/1429065202.db2.gz UXSHRBUZVBGFLR-UHFFFAOYSA-N 0 0 379.401 3.296 20 5 GGBDRN COc1cccc2c1CCCCN2C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000129082978 1416140854 /nfs/dbraw/zinc/14/08/54/1416140854.db2.gz JATIDLJNVFYDGF-UHFFFAOYSA-N 0 0 393.403 3.167 20 5 GGBDRN CCOc1cccc(COC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000129109580 1416147233 /nfs/dbraw/zinc/14/72/33/1416147233.db2.gz NKZJNDSHJATMJN-UHFFFAOYSA-N 0 0 385.420 3.348 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H](CN2CCCC2)c2ccccc2)s1 ZINC000129118480 1416149634 /nfs/dbraw/zinc/14/96/34/1416149634.db2.gz PRRHGLXYCPFFRT-AWEZNQCLSA-N 0 0 395.506 3.309 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000129135221 1416153674 /nfs/dbraw/zinc/15/36/74/1416153674.db2.gz MUXRUNPTWOFNJJ-UHFFFAOYSA-N 0 0 391.170 3.346 20 5 GGBDRN Cc1c(C(=O)Nc2c(C)cc(N(C)C)cc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000129135170 1416153821 /nfs/dbraw/zinc/15/38/21/1416153821.db2.gz XIVSLRHUCIZXOH-UHFFFAOYSA-N 0 0 394.435 3.419 20 5 GGBDRN Cc1ccc2nc(CSCC(=O)NCCNc3ccccc3[N+](=O)[O-])cn2c1 ZINC000129137343 1416154307 /nfs/dbraw/zinc/15/43/07/1416154307.db2.gz CYAIBWFIDJHLAM-UHFFFAOYSA-N 0 0 399.476 3.012 20 5 GGBDRN COc1cc(CN2CCN(Cc3cccc(F)c3)CC2)c([N+](=O)[O-])cc1OC ZINC000129149493 1416156734 /nfs/dbraw/zinc/15/67/34/1416156734.db2.gz VAOWAQABCWGXTD-UHFFFAOYSA-N 0 0 389.427 3.069 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 ZINC000129175417 1416163605 /nfs/dbraw/zinc/16/36/05/1416163605.db2.gz HHKLYAWFBCSATF-KBPBESRZSA-N 0 0 395.525 3.324 20 5 GGBDRN Cc1ccnc(-c2ccc(NCC(=O)N3CCc4cc([N+](=O)[O-])ccc43)cc2)n1 ZINC000178400420 1429070027 /nfs/dbraw/zinc/07/00/27/1429070027.db2.gz RXKKBDOKNWSOGZ-UHFFFAOYSA-N 0 0 389.415 3.361 20 5 GGBDRN CC1(C)C[C@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2ccccc21 ZINC000178402017 1429070634 /nfs/dbraw/zinc/07/06/34/1429070634.db2.gz OWIGQMHCNLZDER-HNNXBMFYSA-N 0 0 388.445 3.151 20 5 GGBDRN CC[S@@](=O)c1ccccc1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000129191128 1416167243 /nfs/dbraw/zinc/16/72/43/1416167243.db2.gz UDODDZUYSIOTNJ-MHZLTWQESA-N 0 0 389.477 3.263 20 5 GGBDRN Cc1ccc(NCCCNC(=O)C[C@@H](C)NC(=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000129204250 1416170039 /nfs/dbraw/zinc/17/00/39/1416170039.db2.gz PHVFHYOIWDFPAI-MRXNPFEDSA-N 0 0 398.463 3.030 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CC[C@H](COCc3ccccc3)C2)s1 ZINC000129206402 1416170310 /nfs/dbraw/zinc/17/03/10/1416170310.db2.gz FFSPYVAUJYSVFX-AWEZNQCLSA-N 0 0 396.490 3.103 20 5 GGBDRN Cc1noc(Cl)c1CCC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000129206889 1416170344 /nfs/dbraw/zinc/17/03/44/1416170344.db2.gz UBKBQKCLKMOBQH-UHFFFAOYSA-N 0 0 380.832 3.404 20 5 GGBDRN CC[C@@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000129210676 1416171371 /nfs/dbraw/zinc/17/13/71/1416171371.db2.gz PECQPBWKAILJLC-OAHLLOKOSA-N 0 0 378.331 3.332 20 5 GGBDRN CC[C@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000129210438 1416171503 /nfs/dbraw/zinc/17/15/03/1416171503.db2.gz PECQPBWKAILJLC-HNNXBMFYSA-N 0 0 378.331 3.332 20 5 GGBDRN Cc1ccc(NCCCNC(=O)CSc2nc(C)cc(C)n2)c([N+](=O)[O-])c1 ZINC000129214612 1416172125 /nfs/dbraw/zinc/17/21/25/1416172125.db2.gz TVZVZKZKVFOOAJ-UHFFFAOYSA-N 0 0 389.481 3.021 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2cccc(NC(=O)N(C)C)c2)c([N+](=O)[O-])c1 ZINC000129212169 1416172215 /nfs/dbraw/zinc/17/22/15/1416172215.db2.gz DQTVCHBGGOJMLU-UHFFFAOYSA-N 0 0 399.451 3.229 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCCCC[C@H]1/C=C/c1ccccc1 ZINC000129216851 1416172592 /nfs/dbraw/zinc/17/25/92/1416172592.db2.gz JQHOHGBQIBFNLW-ZGKFYVQTSA-N 0 0 381.432 3.241 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2cccc(C[S@@](C)=O)c2)c([N+](=O)[O-])c1 ZINC000129219073 1416173189 /nfs/dbraw/zinc/17/31/89/1416173189.db2.gz LUTFPQMXXZTVDS-MHZLTWQESA-N 0 0 389.477 3.014 20 5 GGBDRN CCc1ccc([C@H]2COCCN2S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)o1 ZINC000129225444 1416174519 /nfs/dbraw/zinc/17/45/19/1416174519.db2.gz UEKZVPGNVDWMSF-MRXNPFEDSA-N 0 0 394.449 3.129 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000129230994 1416175746 /nfs/dbraw/zinc/17/57/46/1416175746.db2.gz LGMPKJMADCANAS-LBPRGKRZSA-N 0 0 396.852 3.149 20 5 GGBDRN C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000129233581 1416176293 /nfs/dbraw/zinc/17/62/93/1416176293.db2.gz JENJAAGHEUNODK-ZDUSSCGKSA-N 0 0 389.839 3.068 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(Cl)c(N2CCNC2=O)c1 ZINC000178417819 1429073713 /nfs/dbraw/zinc/07/37/13/1429073713.db2.gz BHGQQIBCWTXJLF-UHFFFAOYSA-N 0 0 396.737 3.308 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(OCC3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000129243866 1416178119 /nfs/dbraw/zinc/17/81/19/1416178119.db2.gz NXZSDEPDJCUDAS-UHFFFAOYSA-N 0 0 388.424 3.328 20 5 GGBDRN CC[C@@H]1CCC[C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000129251297 1416180018 /nfs/dbraw/zinc/18/00/18/1416180018.db2.gz CWAWKUVYTBSPRQ-KGLIPLIRSA-N 0 0 375.425 3.368 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(N3C[C@@H](O)C[C@@H]3c3cc(F)ccc3F)n2)cc1 ZINC000129283754 1416185299 /nfs/dbraw/zinc/18/52/99/1416185299.db2.gz FNZWGIIGMZXYDD-XJKSGUPXSA-N 0 0 388.330 3.235 20 5 GGBDRN O=C(CO)Nc1cccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000129289674 1416186222 /nfs/dbraw/zinc/18/62/22/1416186222.db2.gz FRVAMAUSLYITNB-UHFFFAOYSA-N 0 0 384.417 3.261 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)Cc1csc(NC(=O)C(C)C)n1 ZINC000129349432 1416194886 /nfs/dbraw/zinc/19/48/86/1416194886.db2.gz HNSONHRTMDXSHJ-UHFFFAOYSA-N 0 0 376.438 3.444 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)n(-c2ccccc2)n1 ZINC000129355402 1416195831 /nfs/dbraw/zinc/19/58/31/1416195831.db2.gz IWJOAEKQPQQYQJ-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000129361793 1416196859 /nfs/dbraw/zinc/19/68/59/1416196859.db2.gz NJKZWLUQIRSQSM-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000129364545 1416197250 /nfs/dbraw/zinc/19/72/50/1416197250.db2.gz MBNHQMLEYGHQRN-HXUWFJFHSA-N 0 0 382.372 3.481 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000129372677 1416198518 /nfs/dbraw/zinc/19/85/18/1416198518.db2.gz FECHUKPIJLUEFS-NRFANRHFSA-N 0 0 377.400 3.447 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(NC[C@H]2CCCO2)c(F)c1 ZINC000129374137 1416198551 /nfs/dbraw/zinc/19/85/51/1416198551.db2.gz NRLFFIFYJSOAKC-MRXNPFEDSA-N 0 0 389.383 3.342 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c1 ZINC000129375169 1416199185 /nfs/dbraw/zinc/19/91/85/1416199185.db2.gz RSCFJFNFRARXOR-UHFFFAOYSA-N 0 0 397.431 3.160 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1cccc(-c2cn[nH]c2)c1 ZINC000129392732 1416202287 /nfs/dbraw/zinc/20/22/87/1416202287.db2.gz QOWIFHLWUJRHLV-UHFFFAOYSA-N 0 0 399.794 3.007 20 5 GGBDRN Cc1ccc(CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c(Oc2ccccc2)c1 ZINC000129398899 1416203212 /nfs/dbraw/zinc/20/32/12/1416203212.db2.gz MVOUOPOTOXBKCV-UHFFFAOYSA-N 0 0 393.399 3.174 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(NC[C@@H]2CCCO2)c(F)c1 ZINC000129415203 1416206075 /nfs/dbraw/zinc/20/60/75/1416206075.db2.gz PEFFNEVKUGIFFJ-AWEZNQCLSA-N 0 0 388.399 3.375 20 5 GGBDRN COc1ccc(CN2C[C@@H](C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2=O)cc1 ZINC000129422986 1416206955 /nfs/dbraw/zinc/20/69/55/1416206955.db2.gz SKHQYEKENRLXNE-INIZCTEOSA-N 0 0 397.431 3.207 20 5 GGBDRN COc1ccc(CN2C[C@H](C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2=O)cc1 ZINC000129422788 1416207040 /nfs/dbraw/zinc/20/70/40/1416207040.db2.gz SKHQYEKENRLXNE-MRXNPFEDSA-N 0 0 397.431 3.207 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000129434969 1416208827 /nfs/dbraw/zinc/20/88/27/1416208827.db2.gz YLJPQNHYOWUHBO-UHFFFAOYSA-N 0 0 386.376 3.158 20 5 GGBDRN Cc1cc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)ccc1C(=O)NC(C)C ZINC000129451503 1416211374 /nfs/dbraw/zinc/21/13/74/1416211374.db2.gz YJXMOMXRHALCBR-UHFFFAOYSA-N 0 0 384.436 3.406 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000129453334 1416212006 /nfs/dbraw/zinc/21/20/06/1416212006.db2.gz PHIGEMOUTZJZED-QMMMGPOBSA-N 0 0 389.380 3.412 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCN(Cc2cccc(F)c2)CC1 ZINC000178437801 1429077228 /nfs/dbraw/zinc/07/72/28/1429077228.db2.gz WJYRHFHJRLDHQQ-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN Cc1c(CC(=O)NC(C)(C)c2cn(-c3ccccc3)nn2)cccc1[N+](=O)[O-] ZINC000129496376 1416218959 /nfs/dbraw/zinc/21/89/59/1416218959.db2.gz KNCUYPPKBDROCQ-UHFFFAOYSA-N 0 0 379.420 3.078 20 5 GGBDRN O=C(c1cccc(N2CCOC2=O)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129498519 1416219387 /nfs/dbraw/zinc/21/93/87/1416219387.db2.gz VIWWWDAJDHLILE-UHFFFAOYSA-N 0 0 381.388 3.356 20 5 GGBDRN C[C@H](c1ccsc1)N1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC000129503596 1416219740 /nfs/dbraw/zinc/21/97/40/1416219740.db2.gz LSJQAKXMUCELAT-GFCCVEGCSA-N 0 0 390.421 3.084 20 5 GGBDRN CC(C)(C)OC(=O)N1CC(CC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000129506380 1416220251 /nfs/dbraw/zinc/22/02/51/1416220251.db2.gz ANDHRWBRMBLEFM-UHFFFAOYSA-N 0 0 389.452 3.343 20 5 GGBDRN O=C(c1cnc(-c2ncccn2)s1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129510740 1416220654 /nfs/dbraw/zinc/22/06/54/1416220654.db2.gz XSEYSFHVJCEDDH-UHFFFAOYSA-N 0 0 381.417 3.313 20 5 GGBDRN Cc1noc(C)c1[C@H](C)CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000129518994 1416222020 /nfs/dbraw/zinc/22/20/20/1416222020.db2.gz XDYVWAHEGHDYKW-LLVKDONJSA-N 0 0 383.408 3.380 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1 ZINC000129528296 1416223575 /nfs/dbraw/zinc/22/35/75/1416223575.db2.gz SVGARZQQBCCIEU-OAHLLOKOSA-N 0 0 376.457 3.228 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Oc2ccc(F)c(F)c2)ccc1Br ZINC000129545981 1416225289 /nfs/dbraw/zinc/22/52/89/1416225289.db2.gz GAGXHKVCPHVMSR-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@H](C)c3ccsc3)CC2)c1 ZINC000129546077 1416225568 /nfs/dbraw/zinc/22/55/68/1416225568.db2.gz MIOCJESFYVKLNP-CYBMUJFWSA-N 0 0 375.450 3.184 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(Cc3cccc(F)c3)CC2)c1 ZINC000178441803 1429078269 /nfs/dbraw/zinc/07/82/69/1429078269.db2.gz GRJRTRYOWSYJDL-UHFFFAOYSA-N 0 0 389.452 3.414 20 5 GGBDRN O=C(c1ccc(-c2ccco2)[nH]c1=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129563301 1416229459 /nfs/dbraw/zinc/22/94/59/1416229459.db2.gz NUWUQTMZFMTVLH-UHFFFAOYSA-N 0 0 379.372 3.348 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N[C@@H]2CCc3c2cccc3Cl)cc([N+](=O)[O-])c1 ZINC000129573636 1416230716 /nfs/dbraw/zinc/23/07/16/1416230716.db2.gz ODLCBUBJGWGZAQ-MRXNPFEDSA-N 0 0 394.836 3.069 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@]1(CO)CCc2ccccc21 ZINC000129582346 1416232087 /nfs/dbraw/zinc/23/20/87/1416232087.db2.gz JFVFDVGTSWDWOC-GOSISDBHSA-N 0 0 393.346 3.152 20 5 GGBDRN O=C(CC1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1)N1CCCC1 ZINC000129589312 1416233709 /nfs/dbraw/zinc/23/37/09/1416233709.db2.gz KRFMPVCREUSXTG-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN O=C([C@@H]1CC(=O)N(Cc2ccccc2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129596322 1416234514 /nfs/dbraw/zinc/23/45/14/1416234514.db2.gz VCSCUZLPKMYTKT-GOSISDBHSA-N 0 0 393.443 3.135 20 5 GGBDRN Cc1ccn(CC(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)c(=O)c1[N+](=O)[O-] ZINC000129594576 1416234625 /nfs/dbraw/zinc/23/46/25/1416234625.db2.gz GRFCDEKOJDFVKD-MRXNPFEDSA-N 0 0 389.427 3.498 20 5 GGBDRN O=C(c1cn(Cc2ccccc2)nn1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129604393 1416235847 /nfs/dbraw/zinc/23/58/47/1416235847.db2.gz KPLPJCGBHZLSPF-UHFFFAOYSA-N 0 0 377.404 3.039 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)Cc2c(C)noc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000129605196 1416235980 /nfs/dbraw/zinc/23/59/80/1416235980.db2.gz QGZFHIUPJONRIZ-QMMMGPOBSA-N 0 0 399.350 3.171 20 5 GGBDRN O=C(c1cccc(N2C(=O)CCC2=O)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129608314 1416236409 /nfs/dbraw/zinc/23/64/09/1416236409.db2.gz HYZHKJSTCFMMAD-UHFFFAOYSA-N 0 0 393.399 3.053 20 5 GGBDRN O=C(CN1C(=O)CCc2ccccc21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129614714 1416237306 /nfs/dbraw/zinc/23/73/06/1416237306.db2.gz TWUQGJQTQBLZFE-UHFFFAOYSA-N 0 0 379.416 3.065 20 5 GGBDRN CO[C@@H]1CCC[C@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000129618926 1416237796 /nfs/dbraw/zinc/23/77/96/1416237796.db2.gz SGFUZADNPRKMRP-TZMCWYRMSA-N 0 0 375.347 3.099 20 5 GGBDRN C[C@@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)n1nnc(-c2ccccc2)n1 ZINC000129622707 1416238726 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0 0 399.403 3.169 20 5 GGBDRN Cc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)c1C(=O)N1CCCC1 ZINC000131558424 1416576026 /nfs/dbraw/zinc/57/60/26/1416576026.db2.gz KCPVBJIQUVSSLA-UHFFFAOYSA-N 0 0 385.395 3.460 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NNc2c(Cl)cc(F)cc2Cl)cc1 ZINC000131592413 1416581345 /nfs/dbraw/zinc/58/13/45/1416581345.db2.gz ZDCVREPEEFMBIB-UHFFFAOYSA-N 0 0 380.184 3.346 20 5 GGBDRN CC(C)C[C@H](CO)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000131593742 1416581503 /nfs/dbraw/zinc/58/15/03/1416581503.db2.gz DNNMZISNEWTVJL-GOEBONIOSA-N 0 0 386.452 3.300 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)COc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000131616579 1416585163 /nfs/dbraw/zinc/58/51/63/1416585163.db2.gz NDPUEKXPLMJINZ-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000131659782 1416592063 /nfs/dbraw/zinc/59/20/63/1416592063.db2.gz IZBHATVIZFYMSJ-NEPJUHHUSA-N 0 0 385.873 3.319 20 5 GGBDRN COc1ccc(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000131669291 1416593802 /nfs/dbraw/zinc/59/38/02/1416593802.db2.gz ODVPJEJTLCGLDF-ZDUSSCGKSA-N 0 0 385.203 3.374 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000131683448 1416596785 /nfs/dbraw/zinc/59/67/85/1416596785.db2.gz QVZPQIHUUHVDSD-GUYCJALGSA-N 0 0 389.477 3.499 20 5 GGBDRN CC[S@@](=O)[C@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000131687184 1416597289 /nfs/dbraw/zinc/59/72/89/1416597289.db2.gz JPOBRPONTWSQJG-NVIBNEEGSA-N 0 0 392.399 3.423 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC[C@@H](c3nncn3C(C)C)C2)c1[N+](=O)[O-] ZINC000131718591 1416603976 /nfs/dbraw/zinc/60/39/76/1416603976.db2.gz OWYJFBPUBQMHKT-CYBMUJFWSA-N 0 0 375.404 3.235 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000131731875 1416606671 /nfs/dbraw/zinc/60/66/71/1416606671.db2.gz CWJBJJKJHMFLBN-AREMUKBSSA-N 0 0 386.351 3.281 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc1[N+](=O)[O-] ZINC000131756593 1416613584 /nfs/dbraw/zinc/61/35/84/1416613584.db2.gz FSCGLGGCJSBTAK-HKUYNNGSSA-N 0 0 397.431 3.096 20 5 GGBDRN O=c1[nH]cnc2cc(N3CC[C@@H](Oc4ccccc4Cl)C3)c([N+](=O)[O-])cc12 ZINC000131760367 1416614069 /nfs/dbraw/zinc/61/40/69/1416614069.db2.gz SZKFETVCJJJJQV-LLVKDONJSA-N 0 0 386.795 3.142 20 5 GGBDRN O=c1[nH]cnc2cc(N3CC[C@H](Oc4ccccc4Cl)C3)c([N+](=O)[O-])cc12 ZINC000131760537 1416614088 /nfs/dbraw/zinc/61/40/88/1416614088.db2.gz SZKFETVCJJJJQV-NSHDSACASA-N 0 0 386.795 3.142 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000131770147 1416616626 /nfs/dbraw/zinc/61/66/26/1416616626.db2.gz HMCWZRZMGRFNMA-UHFFFAOYSA-N 0 0 389.477 3.010 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN(Cc1c(F)cccc1F)C1CCCC1 ZINC000131778196 1416618272 /nfs/dbraw/zinc/61/82/72/1416618272.db2.gz XUAJVQRDIGPLJM-UHFFFAOYSA-N 0 0 377.391 3.480 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000131782867 1416619278 /nfs/dbraw/zinc/61/92/78/1416619278.db2.gz HTPDFHYBNSBOFR-CYBMUJFWSA-N 0 0 375.812 3.266 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000178580920 1429112947 /nfs/dbraw/zinc/11/29/47/1429112947.db2.gz WXLWDTMPMIEAHA-IERDGZPVSA-N 0 0 385.464 3.016 20 5 GGBDRN COC(=O)c1csc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000131799817 1416623414 /nfs/dbraw/zinc/62/34/14/1416623414.db2.gz CFFKBJYFZBOHMN-UHFFFAOYSA-N 0 0 389.433 3.298 20 5 GGBDRN COc1cc(C=Cc2nccc(=O)[nH]2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000131805928 1416625622 /nfs/dbraw/zinc/62/56/22/1416625622.db2.gz FEVDXQDKIXRGCW-WEVVVXLNSA-N 0 0 379.372 3.436 20 5 GGBDRN COc1ccccc1N1CC[C@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000131814039 1416627548 /nfs/dbraw/zinc/62/75/48/1416627548.db2.gz NQMAMRHFAJKQCT-QGZVFWFLSA-N 0 0 383.448 3.179 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2-n2cccn2)c([N+](=O)[O-])c1 ZINC000131821655 1416628943 /nfs/dbraw/zinc/62/89/43/1416628943.db2.gz CFXDJDIFUMYVDA-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN CCOC(=O)c1ccnc(N2CC[C@H](Oc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000131839000 1416632642 /nfs/dbraw/zinc/63/26/42/1416632642.db2.gz GERSRGFBWZTGTM-LBPRGKRZSA-N 0 0 391.811 3.478 20 5 GGBDRN CC(=O)c1ccc(N2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)c(F)c1 ZINC000131857022 1416636223 /nfs/dbraw/zinc/63/62/23/1416636223.db2.gz UAKGWBADYJZSFH-UHFFFAOYSA-N 0 0 389.358 3.038 20 5 GGBDRN Nc1c(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)cc(F)cc1[N+](=O)[O-] ZINC000131914258 1416650413 /nfs/dbraw/zinc/65/04/13/1416650413.db2.gz KOLSQPDPKPVPBQ-GFCCVEGCSA-N 0 0 388.182 3.086 20 5 GGBDRN CC[C@H]1CN([C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)CCO1 ZINC000178593382 1429116016 /nfs/dbraw/zinc/11/60/16/1429116016.db2.gz JMZLKEIMOHYIGQ-WFASDCNBSA-N 0 0 390.465 3.156 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)Cc1cc(-c2ccccc2)on1 ZINC000131962837 1416660878 /nfs/dbraw/zinc/66/08/78/1416660878.db2.gz URCSUXQUMREGAF-UHFFFAOYSA-N 0 0 388.401 3.373 20 5 GGBDRN O=C(NCc1ccc(CN2CCCC2=O)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000131970599 1416663297 /nfs/dbraw/zinc/66/32/97/1416663297.db2.gz DPNYSCHDVGOXCH-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN Cc1ccc(OC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000131986018 1416666855 /nfs/dbraw/zinc/66/68/55/1416666855.db2.gz XFQPDJKTNGQDTP-QGZVFWFLSA-N 0 0 382.416 3.290 20 5 GGBDRN O=C(O[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000132011975 1416672692 /nfs/dbraw/zinc/67/26/92/1416672692.db2.gz AOFZMTRBIOHMMH-JCGIZDLHSA-N 0 0 383.404 3.285 20 5 GGBDRN Cc1cccc([C@@H](O)CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000132018720 1416675119 /nfs/dbraw/zinc/67/51/19/1416675119.db2.gz JLIJTWWXOQWBSB-HNNXBMFYSA-N 0 0 379.210 3.129 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)NCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000132019158 1416675405 /nfs/dbraw/zinc/67/54/05/1416675405.db2.gz UTWCPPCFFKRZCV-UHFFFAOYSA-N 0 0 380.408 3.157 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000132033632 1416678870 /nfs/dbraw/zinc/67/88/70/1416678870.db2.gz PSMRVIFGOYOWKX-UHFFFAOYSA-N 0 0 382.420 3.243 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000132070979 1416688051 /nfs/dbraw/zinc/68/80/51/1416688051.db2.gz BREMGVUWUXGADB-UHFFFAOYSA-N 0 0 393.403 3.268 20 5 GGBDRN CC(C)(C(N)=O)c1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000132092411 1416694074 /nfs/dbraw/zinc/69/40/74/1416694074.db2.gz QNZIWKIZTVBNKB-UHFFFAOYSA-N 0 0 381.392 3.020 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O ZINC000132098940 1416695685 /nfs/dbraw/zinc/69/56/85/1416695685.db2.gz RWEBAXVKOCOVDB-UHFFFAOYSA-N 0 0 393.399 3.172 20 5 GGBDRN CC(C)(C)OC(=O)N1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000132116666 1416700582 /nfs/dbraw/zinc/70/05/82/1416700582.db2.gz DXXWRMZKPIMCOW-UHFFFAOYSA-N 0 0 383.832 3.331 20 5 GGBDRN CC[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000132154511 1416708340 /nfs/dbraw/zinc/70/83/40/1416708340.db2.gz AWNKETLOJDXNFF-JSGCOSHPSA-N 0 0 376.331 3.223 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)Nc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000132161790 1416709767 /nfs/dbraw/zinc/70/97/67/1416709767.db2.gz DAOZHTGYHGKDCQ-OAHLLOKOSA-N 0 0 376.434 3.462 20 5 GGBDRN O=C(CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)Nc1ccc(F)cc1 ZINC000132183887 1416713221 /nfs/dbraw/zinc/71/32/21/1416713221.db2.gz LSQWMCTWDQZZHW-UHFFFAOYSA-N 0 0 385.273 3.121 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCc1csc(-c2ccco2)n1 ZINC000132184596 1416713564 /nfs/dbraw/zinc/71/35/64/1416713564.db2.gz HKTSZXYZGBRHEM-UHFFFAOYSA-N 0 0 377.353 3.146 20 5 GGBDRN CN(C)C(=O)c1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000132203196 1416716411 /nfs/dbraw/zinc/71/64/11/1416716411.db2.gz FUSGAUPLPNLREW-UHFFFAOYSA-N 0 0 396.447 3.171 20 5 GGBDRN O=C(N[C@H](CCCO)c1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000132214123 1416718275 /nfs/dbraw/zinc/71/82/75/1416718275.db2.gz RMXXJMIJFOOPGF-LJQANCHMSA-N 0 0 397.475 3.441 20 5 GGBDRN CCNc1ccc(C(=O)NCc2ccc(C)cc2OCCOC)cc1[N+](=O)[O-] ZINC000132216466 1416718493 /nfs/dbraw/zinc/71/84/93/1416718493.db2.gz NDGQGZGZRJOKRN-UHFFFAOYSA-N 0 0 387.436 3.290 20 5 GGBDRN Cn1cc(CCC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000132223976 1416719728 /nfs/dbraw/zinc/71/97/28/1416719728.db2.gz YAXQDUIPFGUCFD-UHFFFAOYSA-N 0 0 381.388 3.201 20 5 GGBDRN CC[C@H](C)Oc1cc(C)ccc1CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000132227057 1416720169 /nfs/dbraw/zinc/72/01/69/1416720169.db2.gz IZWNWFSAIPEMQT-AWEZNQCLSA-N 0 0 385.420 3.335 20 5 GGBDRN CC[C@@H](NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCCO1 ZINC000132248628 1416723323 /nfs/dbraw/zinc/72/33/23/1416723323.db2.gz LCKJKRDMNQFBLE-MSOLQXFVSA-N 0 0 377.441 3.105 20 5 GGBDRN O=C(CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)Nc1cccc(F)c1 ZINC000132250762 1416723839 /nfs/dbraw/zinc/72/38/39/1416723839.db2.gz LWKKZYSMDWTZPV-UHFFFAOYSA-N 0 0 385.273 3.121 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000132252915 1416724361 /nfs/dbraw/zinc/72/43/61/1416724361.db2.gz VJRFPILCIDIYAQ-UHFFFAOYSA-N 0 0 397.435 3.193 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000132252746 1416724415 /nfs/dbraw/zinc/72/44/15/1416724415.db2.gz KSFDAPMBLFYKMO-APWZRJJASA-N 0 0 384.436 3.226 20 5 GGBDRN CCCNC(=O)CN1CCC(Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC1 ZINC000132255178 1416724974 /nfs/dbraw/zinc/72/49/74/1416724974.db2.gz WWOOWYIDGIUWQE-UHFFFAOYSA-N 0 0 392.500 3.175 20 5 GGBDRN CN(Cc1cccc(OC(F)(F)F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000132262446 1416725694 /nfs/dbraw/zinc/72/56/94/1416725694.db2.gz MYSOKMOYZDRZSA-UHFFFAOYSA-N 0 0 390.339 3.314 20 5 GGBDRN O=C(N[C@@H](CCCO)c1ccccc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000132261685 1416725880 /nfs/dbraw/zinc/72/58/80/1416725880.db2.gz ZNGYOWDVYTZJMR-IBGZPJMESA-N 0 0 380.404 3.024 20 5 GGBDRN CC(C)Oc1ccc(C(=O)Cn2c(=O)onc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000132273075 1416726994 /nfs/dbraw/zinc/72/69/94/1416726994.db2.gz FQBZDCQPKBSSFA-UHFFFAOYSA-N 0 0 383.360 3.082 20 5 GGBDRN CCC(=O)c1cccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c1 ZINC000132275887 1416727437 /nfs/dbraw/zinc/72/74/37/1416727437.db2.gz DCSCCOTUOJRPKO-ZDUSSCGKSA-N 0 0 399.378 3.318 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1coc(-c2cccc(F)c2)n1 ZINC000132295762 1416730810 /nfs/dbraw/zinc/73/08/10/1416730810.db2.gz ZYXZIMMTSYGNHY-UHFFFAOYSA-N 0 0 382.307 3.254 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1nc(C2CC2)no1 ZINC000132299113 1416731224 /nfs/dbraw/zinc/73/12/24/1416731224.db2.gz LTAJTWYWXULPNO-INIZCTEOSA-N 0 0 396.407 3.168 20 5 GGBDRN COc1ccc(-c2nc(Cn3c(=O)onc3-c3ccc([N+](=O)[O-])cc3)co2)cc1 ZINC000132300340 1416731642 /nfs/dbraw/zinc/73/16/42/1416731642.db2.gz QQLJDQPQECEPIJ-UHFFFAOYSA-N 0 0 394.343 3.123 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)c(C)c1[N+](=O)[O-] ZINC000132305180 1416732614 /nfs/dbraw/zinc/73/26/14/1416732614.db2.gz VECUGKDTGGOATB-UHFFFAOYSA-N 0 0 382.424 3.201 20 5 GGBDRN CC(C)CC(=O)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000132314961 1416733512 /nfs/dbraw/zinc/73/35/12/1416733512.db2.gz LIYRLARAYFDLTP-UHFFFAOYSA-N 0 0 397.431 3.317 20 5 GGBDRN CCc1ccc(-c2noc(Cn3c(=O)onc3-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000132316053 1416734338 /nfs/dbraw/zinc/73/43/38/1416734338.db2.gz KIMQPSQTJLJXNG-UHFFFAOYSA-N 0 0 393.359 3.072 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(OC(F)F)c1 ZINC000132324497 1416736391 /nfs/dbraw/zinc/73/63/91/1416736391.db2.gz CSWKDZMSGYCFRU-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN Cc1cc(C(=O)Cn2c(=O)onc2-c2ccc([N+](=O)[O-])cc2)c(C)n1C1CC1 ZINC000132328326 1416737466 /nfs/dbraw/zinc/73/74/66/1416737466.db2.gz GYMBPYSPOWGLQL-UHFFFAOYSA-N 0 0 382.376 3.048 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000132329489 1416737888 /nfs/dbraw/zinc/73/78/88/1416737888.db2.gz RNQSYGDFDZPSSK-GJZGRUSLSA-N 0 0 375.425 3.177 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(-c2cc[nH]n2)cc1 ZINC000132332413 1416738140 /nfs/dbraw/zinc/73/81/40/1416738140.db2.gz GKKHCRBBOPQQEV-UHFFFAOYSA-N 0 0 376.369 3.233 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C1 ZINC000132330664 1416738208 /nfs/dbraw/zinc/73/82/08/1416738208.db2.gz RYLJRPCQZHWOAR-MRXNPFEDSA-N 0 0 375.469 3.452 20 5 GGBDRN CC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000132333671 1416739190 /nfs/dbraw/zinc/73/91/90/1416739190.db2.gz GRQYIQGYESMTTL-ZDUSSCGKSA-N 0 0 383.404 3.230 20 5 GGBDRN Cc1c(Br)cc(C(=O)OCC(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000132337923 1416739767 /nfs/dbraw/zinc/73/97/67/1416739767.db2.gz SIUXVFTVFUGHHJ-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCCO[C@@H](C)C1 ZINC000178629661 1429124771 /nfs/dbraw/zinc/12/47/71/1429124771.db2.gz FJAKYAUYROHOIG-STQMWFEESA-N 0 0 390.465 3.156 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Oc1cc(F)cc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000132363600 1416745804 /nfs/dbraw/zinc/74/58/04/1416745804.db2.gz JLXXNCZCPAFJIQ-HNNXBMFYSA-N 0 0 382.294 3.185 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000132365682 1416746380 /nfs/dbraw/zinc/74/63/80/1416746380.db2.gz IBXJDLZFKZNMEF-UHFFFAOYSA-N 0 0 394.362 3.365 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCc3ccsc3C2)c(S(=O)(=O)N2CCCC2)c1 ZINC000132388349 1416750455 /nfs/dbraw/zinc/75/04/55/1416750455.db2.gz WRIAUWXGFYMNON-UHFFFAOYSA-N 0 0 393.490 3.004 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000132404671 1416753071 /nfs/dbraw/zinc/75/30/71/1416753071.db2.gz LALCEAJNBODJLK-UHFFFAOYSA-N 0 0 384.436 3.104 20 5 GGBDRN CCc1ccc([C@H]2COCCN2Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)o1 ZINC000132431458 1416758879 /nfs/dbraw/zinc/75/88/79/1416758879.db2.gz KACIEWCDNSPHKC-MRXNPFEDSA-N 0 0 384.392 3.374 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)o1 ZINC000132431249 1416758932 /nfs/dbraw/zinc/75/89/32/1416758932.db2.gz KACIEWCDNSPHKC-INIZCTEOSA-N 0 0 384.392 3.374 20 5 GGBDRN Cc1ccc2c(c1)N(S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1)C[C@H](C)O2 ZINC000132444844 1416761566 /nfs/dbraw/zinc/76/15/66/1416761566.db2.gz QEPFWCZQRFFJRZ-LBPRGKRZSA-N 0 0 380.397 3.327 20 5 GGBDRN Cc1ccc2c(c1)O[C@H](C)CN2S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000132446164 1416762430 /nfs/dbraw/zinc/76/24/30/1416762430.db2.gz BMRYMULTZZQFOV-GFCCVEGCSA-N 0 0 380.397 3.327 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc2noc(-c3ccc(F)cc3)c2c1 ZINC000132446264 1416762518 /nfs/dbraw/zinc/76/25/18/1416762518.db2.gz IOCDUODKZOHDTJ-UHFFFAOYSA-N 0 0 395.350 3.169 20 5 GGBDRN Cc1ccc2c(c1)O[C@@H](C)CN2S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000132446364 1416762703 /nfs/dbraw/zinc/76/27/03/1416762703.db2.gz BMRYMULTZZQFOV-LBPRGKRZSA-N 0 0 380.397 3.327 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C12CCC2 ZINC000132460270 1416765516 /nfs/dbraw/zinc/76/55/16/1416765516.db2.gz MOSYDFSOFBAYRC-MSOLQXFVSA-N 0 0 384.436 3.200 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000132484664 1416771033 /nfs/dbraw/zinc/77/10/33/1416771033.db2.gz USOQXIIVEDNBLH-DLBZAZTESA-N 0 0 397.822 3.423 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(=S)n(CN3CCC(O)(C(F)(F)F)CC3)c2c1 ZINC000132487154 1416772119 /nfs/dbraw/zinc/77/21/19/1416772119.db2.gz NGRKHUMGSTYBPC-UHFFFAOYSA-N 0 0 377.344 3.219 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000132502790 1416774210 /nfs/dbraw/zinc/77/42/10/1416774210.db2.gz OGXVPHQTPFIFFA-KRWDZBQOSA-N 0 0 391.468 3.385 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@](C)(O)c2cccs2)cc1[N+](=O)[O-] ZINC000132507497 1416775102 /nfs/dbraw/zinc/77/51/02/1416775102.db2.gz JVXYJEKPMQIRKC-HNNXBMFYSA-N 0 0 399.266 3.365 20 5 GGBDRN CC(C)Cn1nc(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)c2ccccc2c1=O ZINC000132508046 1416775323 /nfs/dbraw/zinc/77/53/23/1416775323.db2.gz XVJZYCLZKMIVMA-UHFFFAOYSA-N 0 0 385.351 3.319 20 5 GGBDRN O=C(Oc1cc(F)cc([N+](=O)[O-])c1)[C@H]1CCCCN1C(=O)c1cccs1 ZINC000132513436 1416776139 /nfs/dbraw/zinc/77/61/39/1416776139.db2.gz GQJZIVDMLPHMOI-CQSZACIVSA-N 0 0 378.381 3.396 20 5 GGBDRN O=C(Cc1csc(NC(=O)c2ccco2)n1)Oc1cc(F)cc([N+](=O)[O-])c1 ZINC000132527308 1416778979 /nfs/dbraw/zinc/77/89/79/1416778979.db2.gz JDFROHZKJFXKQA-UHFFFAOYSA-N 0 0 391.336 3.184 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@](C)(O)c2ccsc2)cc1[N+](=O)[O-] ZINC000132533022 1416779889 /nfs/dbraw/zinc/77/98/89/1416779889.db2.gz PDPIOBHIDCWZTK-HNNXBMFYSA-N 0 0 399.266 3.365 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000132546015 1416782778 /nfs/dbraw/zinc/78/27/78/1416782778.db2.gz ZCDWLJIICHLVHW-CRAIPNDOSA-N 0 0 385.376 3.462 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)Oc2cc(F)cc([N+](=O)[O-])c2)cs1 ZINC000132571998 1416786651 /nfs/dbraw/zinc/78/66/51/1416786651.db2.gz VCBYXCSEWHRCRY-UHFFFAOYSA-N 0 0 381.385 3.323 20 5 GGBDRN CS(=O)(=O)Cc1c2ccccc2oc1C(=O)Oc1cc(F)cc([N+](=O)[O-])c1 ZINC000132575881 1416787040 /nfs/dbraw/zinc/78/70/40/1416787040.db2.gz ZNOJRWLSNWGZOC-UHFFFAOYSA-N 0 0 393.348 3.244 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(C[C@@H](O)COCc1ccccc1Cl)CC2 ZINC000132590808 1416789561 /nfs/dbraw/zinc/78/95/61/1416789561.db2.gz UEKSCOAIELIUQK-GOSISDBHSA-N 0 0 376.840 3.184 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccccc1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000132625862 1416795812 /nfs/dbraw/zinc/79/58/12/1416795812.db2.gz PXFQONBJLNQPHC-IFXJQAMLSA-N 0 0 394.431 3.237 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000132625437 1416795957 /nfs/dbraw/zinc/79/59/57/1416795957.db2.gz PXFQONBJLNQPHC-LIRRHRJNSA-N 0 0 394.431 3.237 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000132625675 1416796021 /nfs/dbraw/zinc/79/60/21/1416796021.db2.gz PXFQONBJLNQPHC-KUHUBIRLSA-N 0 0 394.431 3.237 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000132668170 1416801828 /nfs/dbraw/zinc/80/18/28/1416801828.db2.gz IANVSEBYUBYWPZ-ZWKOTPCHSA-N 0 0 384.436 3.200 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000132668387 1416801851 /nfs/dbraw/zinc/80/18/51/1416801851.db2.gz IANVSEBYUBYWPZ-ROUUACIJSA-N 0 0 384.436 3.200 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Oc1cc(F)cc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000132685386 1416803744 /nfs/dbraw/zinc/80/37/44/1416803744.db2.gz KULRWRULSAETSF-INIZCTEOSA-N 0 0 382.294 3.185 20 5 GGBDRN CCC(CC)NC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2O1 ZINC000132697419 1416805044 /nfs/dbraw/zinc/80/50/44/1416805044.db2.gz DFQUOXOWCIRNFR-LJQANCHMSA-N 0 0 397.431 3.307 20 5 GGBDRN Cc1ccccc1NC(=O)[C@H]1CSCN1C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000132717603 1416807562 /nfs/dbraw/zinc/80/75/62/1416807562.db2.gz SDHYLRAGDMJIGW-GOSISDBHSA-N 0 0 399.472 3.376 20 5 GGBDRN CC(=O)N(CCc1ccccc1)CC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000132799875 1416816471 /nfs/dbraw/zinc/81/64/71/1416816471.db2.gz YCTLFJBDCABKSB-UHFFFAOYSA-N 0 0 375.812 3.278 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(C(F)(F)F)nc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000132803524 1416816710 /nfs/dbraw/zinc/81/67/10/1416816710.db2.gz PFQXECVUFOUPSI-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN O=C(NC[C@@H]1CSCCS1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000132807906 1416817410 /nfs/dbraw/zinc/81/74/10/1416817410.db2.gz VCCBSTQNZYXOMG-GFCCVEGCSA-N 0 0 381.504 3.297 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000132827801 1416820025 /nfs/dbraw/zinc/82/00/25/1416820025.db2.gz VOJXNUMCNFEOLJ-UHFFFAOYSA-N 0 0 381.310 3.291 20 5 GGBDRN O=[N+]([O-])c1cn(CNC2(c3cccc(F)c3)CCOCC2)nc1-c1ccncc1 ZINC000132829906 1416820372 /nfs/dbraw/zinc/82/03/72/1416820372.db2.gz AUNQEHNOMFQGJQ-UHFFFAOYSA-N 0 0 397.410 3.245 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)CS(=O)(=O)c1ccc(F)cc1 ZINC000132829095 1416820424 /nfs/dbraw/zinc/82/04/24/1416820424.db2.gz ABXXNDDTSQHKLS-LBPRGKRZSA-N 0 0 380.397 3.091 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(=O)c1ccccc1C(F)(F)F ZINC000132831966 1416820751 /nfs/dbraw/zinc/82/07/51/1416820751.db2.gz YASDBCPMLDTCIB-UHFFFAOYSA-N 0 0 381.310 3.291 20 5 GGBDRN Cc1cccc(N(CCC(N)=O)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000132838729 1416821470 /nfs/dbraw/zinc/82/14/70/1416821470.db2.gz ORWQUNIFXYDXOF-UHFFFAOYSA-N 0 0 395.337 3.444 20 5 GGBDRN Cc1c(C(=O)NCc2ccccc2-n2ccnc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000132894038 1416827911 /nfs/dbraw/zinc/82/79/11/1416827911.db2.gz IMAYWZYNIJBTRP-UHFFFAOYSA-N 0 0 395.375 3.236 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc(OCC(F)F)nc1 ZINC000132898893 1416828400 /nfs/dbraw/zinc/82/84/00/1416828400.db2.gz TYCHUFWIEKZZGR-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](CC(C)C)N1CCOCC1 ZINC000132924279 1416831846 /nfs/dbraw/zinc/83/18/46/1416831846.db2.gz 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Cc1cc(S(=O)(=O)N(Cc2cccc(O)c2)CC2CC2)ccc1[N+](=O)[O-] ZINC000178667706 1429133467 /nfs/dbraw/zinc/13/34/67/1429133467.db2.gz MQYODYQNHDXTBU-UHFFFAOYSA-N 0 0 376.434 3.210 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000133021333 1416842974 /nfs/dbraw/zinc/84/29/74/1416842974.db2.gz OCWADVXVWSJTTF-OAHLLOKOSA-N 0 0 394.431 3.398 20 5 GGBDRN COc1cc(C(=O)Nc2cccn(Cc3ccc(C)cc3)c2=O)ccc1[N+](=O)[O-] ZINC000133039571 1416844865 /nfs/dbraw/zinc/84/48/65/1416844865.db2.gz FLFINXYLOFNUMV-UHFFFAOYSA-N 0 0 393.399 3.374 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CC[C@H](CO)CC3)cc2[N+](=O)[O-])C1 ZINC000133050919 1416846051 /nfs/dbraw/zinc/84/60/51/1416846051.db2.gz JTDVLPWQDAVFMB-OMPZMXGASA-N 0 0 389.496 3.358 20 5 GGBDRN COc1cc2c(cc1OC)CN(Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)CC2 ZINC000133056753 1416846677 /nfs/dbraw/zinc/84/66/77/1416846677.db2.gz HYBVTXLUAHXORZ-UHFFFAOYSA-N 0 0 396.403 3.220 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Oc2cccnc2)nc1 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GGBDRN CC(C)COc1cccc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000133394004 1416885439 /nfs/dbraw/zinc/88/54/39/1416885439.db2.gz HSJFQKUDZXBKAX-AWEZNQCLSA-N 0 0 385.420 3.387 20 5 GGBDRN Cc1cc(C)cc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000133392717 1416885593 /nfs/dbraw/zinc/88/55/93/1416885593.db2.gz IGJHIANBMZHXOR-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN CN(C(=O)c1ccco1)c1ccccc1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000133395736 1416885827 /nfs/dbraw/zinc/88/58/27/1416885827.db2.gz IAEFCGIRYYNDJF-UHFFFAOYSA-N 0 0 393.399 3.437 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000133395591 1416885874 /nfs/dbraw/zinc/88/58/74/1416885874.db2.gz ZNQHTXFQPRJDTO-VXGBXAGGSA-N 0 0 383.470 3.422 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000133395983 1416885881 /nfs/dbraw/zinc/88/58/81/1416885881.db2.gz ZNQHTXFQPRJDTO-NEPJUHHUSA-N 0 0 383.470 3.422 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000133418691 1416888034 /nfs/dbraw/zinc/88/80/34/1416888034.db2.gz RFSWZWVSWOYLNE-UHFFFAOYSA-N 0 0 396.447 3.212 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000133418640 1416888056 /nfs/dbraw/zinc/88/80/56/1416888056.db2.gz LTCWQSYYYBCXGY-UHFFFAOYSA-N 0 0 398.419 3.466 20 5 GGBDRN CCC[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000133422212 1416888278 /nfs/dbraw/zinc/88/82/78/1416888278.db2.gz DTYYJNYEPDQKMB-HNNXBMFYSA-N 0 0 382.424 3.097 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2cccc(Cn3cccn3)c2)c1[N+](=O)[O-] ZINC000133428485 1416889317 /nfs/dbraw/zinc/88/93/17/1416889317.db2.gz FKSUJUMDIMPVOF-UHFFFAOYSA-N 0 0 381.392 3.023 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 ZINC000133445759 1416890518 /nfs/dbraw/zinc/89/05/18/1416890518.db2.gz ZMVTYHFLUPHNNZ-UHFFFAOYSA-N 0 0 394.431 3.325 20 5 GGBDRN O=C(CN(Cc1cccnc1)c1ccccc1)NCCc1cccc([N+](=O)[O-])c1 ZINC000133451558 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CFNNNSVYGUMBMK-CQSZACIVSA-N 0 0 397.497 3.139 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000133483478 1416894506 /nfs/dbraw/zinc/89/45/06/1416894506.db2.gz RSLIKIDHUUPOHF-UHFFFAOYSA-N 0 0 399.230 3.302 20 5 GGBDRN COCCN(Cc1ccccc1)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000133507566 1416896566 /nfs/dbraw/zinc/89/65/66/1416896566.db2.gz RKROESIQPZDYJH-UHFFFAOYSA-N 0 0 383.448 3.484 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OS(=O)(=O)c2ccccc2C(F)(F)F)c1 ZINC000133515084 1416897095 /nfs/dbraw/zinc/89/70/95/1416897095.db2.gz GUADGJRNMXFBGR-UHFFFAOYSA-N 0 0 375.280 3.194 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H]2CSCCS2)cc1[N+](=O)[O-] ZINC000133548423 1416900652 /nfs/dbraw/zinc/90/06/52/1416900652.db2.gz WYWGAHRNKOSPDC-JTQLQIEISA-N 0 0 391.312 3.244 20 5 GGBDRN Cc1nc(N(C)C[C@@H](O)COc2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000133551781 1416902114 /nfs/dbraw/zinc/90/21/14/1416902114.db2.gz WWBOXOYEVGDWNK-GFCCVEGCSA-N 0 0 385.342 3.193 20 5 GGBDRN 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CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1nc(-c2ccccc2)c[nH]1 ZINC000133571189 1416907370 /nfs/dbraw/zinc/90/73/70/1416907370.db2.gz LMUJQLNIAVESPE-UHFFFAOYSA-N 0 0 379.420 3.080 20 5 GGBDRN C[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccccc2)no1 ZINC000133571776 1416907608 /nfs/dbraw/zinc/90/76/08/1416907608.db2.gz LDAIBNKYKDTOPF-AWEZNQCLSA-N 0 0 395.419 3.290 20 5 GGBDRN CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1nc(-c2ccccc2)c[nH]1 ZINC000133588370 1416912676 /nfs/dbraw/zinc/91/26/76/1416912676.db2.gz HLHXZLVNCGWVGG-UHFFFAOYSA-N 0 0 379.420 3.446 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000133605199 1416916916 /nfs/dbraw/zinc/91/69/16/1416916916.db2.gz OHRZNKHHGBXFOR-UHFFFAOYSA-N 0 0 389.339 3.326 20 5 GGBDRN Cc1nc(NC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000133615402 1416921200 /nfs/dbraw/zinc/92/12/00/1416921200.db2.gz RAARVBHZRKWSPF-CXAGYDPISA-N 0 0 388.811 3.110 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000178695864 1429144066 /nfs/dbraw/zinc/14/40/66/1429144066.db2.gz QKBFDVMARFRJIT-IBGZPJMESA-N 0 0 384.432 3.079 20 5 GGBDRN CCc1ccc([C@@H](COC)NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000133671366 1416935988 /nfs/dbraw/zinc/93/59/88/1416935988.db2.gz LGFBXMPDAFLCGL-QGZVFWFLSA-N 0 0 384.392 3.053 20 5 GGBDRN O=C(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000133680626 1416938645 /nfs/dbraw/zinc/93/86/45/1416938645.db2.gz CAKOYRBCNBBVFQ-NSHDSACASA-N 0 0 379.338 3.268 20 5 GGBDRN COc1ccc(OC(F)F)c(CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)c1 ZINC000133712878 1416949172 /nfs/dbraw/zinc/94/91/72/1416949172.db2.gz ZJZOEKZQHDLLKC-UHFFFAOYSA-N 0 0 381.335 3.025 20 5 GGBDRN CCCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)c2cccc([N+](=O)[O-])c2)C1=O ZINC000133728559 1416952250 /nfs/dbraw/zinc/95/22/50/1416952250.db2.gz HOTOQKFBOOTBAA-NRFANRHFSA-N 0 0 395.415 3.415 20 5 GGBDRN CC(C)(NC(=O)c1cn(Cc2cccc(F)c2)nn1)c1ccc([N+](=O)[O-])cc1 ZINC000133743612 1416954707 /nfs/dbraw/zinc/95/47/07/1416954707.db2.gz DNOPKRPOQCFTKV-UHFFFAOYSA-N 0 0 383.383 3.039 20 5 GGBDRN C[C@@H](CO[C@H]1CCOC1)Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000133752709 1416956649 /nfs/dbraw/zinc/95/66/49/1416956649.db2.gz GFOPHQDNKAJNNT-WPRPVWTQSA-N 0 0 379.291 3.128 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OCCc1ccc2c(c1)OCCO2 ZINC000133759606 1416958284 /nfs/dbraw/zinc/95/82/84/1416958284.db2.gz MMSSNCCDIVJCTH-UHFFFAOYSA-N 0 0 382.372 3.176 20 5 GGBDRN COC(=O)c1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3C)[C@H](C)C2)cc1 ZINC000133772089 1416960573 /nfs/dbraw/zinc/96/05/73/1416960573.db2.gz VLDKIBOLWFAFAL-OAHLLOKOSA-N 0 0 397.431 3.041 20 5 GGBDRN Cc1cc(=O)oc2cc(OC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)ccc12 ZINC000133787468 1416963688 /nfs/dbraw/zinc/96/36/88/1416963688.db2.gz OGAJLYQPYHOJLX-UHFFFAOYSA-N 0 0 391.339 3.415 20 5 GGBDRN COC(=O)c1ccc(CN(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000133821985 1416970679 /nfs/dbraw/zinc/97/06/79/1416970679.db2.gz KHQOPQKFQSIUJW-UHFFFAOYSA-N 0 0 381.388 3.064 20 5 GGBDRN Cc1ccc2cccc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2n1 ZINC000133842889 1416975323 /nfs/dbraw/zinc/97/53/23/1416975323.db2.gz PGIBJTMJTLZOKI-HNNXBMFYSA-N 0 0 377.404 3.173 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H](C)CS(=O)(=O)c1ccc(F)cc1 ZINC000133851590 1416978166 /nfs/dbraw/zinc/97/81/66/1416978166.db2.gz YWOAEGMNBOUKDI-CYBMUJFWSA-N 0 0 394.424 3.399 20 5 GGBDRN COc1cc(C(=O)NCc2c(C)nn(Cc3ccccc3)c2C)ccc1[N+](=O)[O-] ZINC000133870584 1416983032 /nfs/dbraw/zinc/98/30/32/1416983032.db2.gz ZJCVKUAIJCZGRZ-UHFFFAOYSA-N 0 0 394.431 3.395 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCc2c(Cl)cccc2C1 ZINC000133899303 1416990675 /nfs/dbraw/zinc/99/06/75/1416990675.db2.gz KHXMOMAZCGONCP-UHFFFAOYSA-N 0 0 375.812 3.254 20 5 GGBDRN O=C(Nc1ccnn1Cc1cnn(-c2ccccc2)c1)c1ccccc1[N+](=O)[O-] ZINC000133908035 1416992575 /nfs/dbraw/zinc/99/25/75/1416992575.db2.gz MBJCHCDAJMPZHB-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN Cc1c(C(=O)OCc2ccn(-c3ccccc3)n2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000133932878 1416997245 /nfs/dbraw/zinc/99/72/45/1416997245.db2.gz AEYCEJSUBNMDCI-UHFFFAOYSA-N 0 0 382.332 3.354 20 5 GGBDRN COc1cccc(CNC(=O)COc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000133965050 1417002570 /nfs/dbraw/zinc/00/25/70/1417002570.db2.gz TUKFARVNUYENDQ-UHFFFAOYSA-N 0 0 384.310 3.317 20 5 GGBDRN O=C(Nc1ccnn1Cc1cnn(-c2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000133970559 1417003348 /nfs/dbraw/zinc/00/33/48/1417003348.db2.gz OROYALOBNLTKNY-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1N1CCCS1(=O)=O ZINC000133975358 1417004257 /nfs/dbraw/zinc/00/42/57/1417004257.db2.gz ALDMBXZXNZUUJJ-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN O=C(COc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC(=O)NCc1ccccc1 ZINC000133975353 1417004408 /nfs/dbraw/zinc/00/44/08/1417004408.db2.gz ACEMXTYTEKMMGN-UHFFFAOYSA-N 0 0 397.309 3.018 20 5 GGBDRN COc1ccccc1CNC(=O)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000133980818 1417005320 /nfs/dbraw/zinc/00/53/20/1417005320.db2.gz UZJAWYVZDCBLQJ-UHFFFAOYSA-N 0 0 384.310 3.317 20 5 GGBDRN CS(=O)(=O)CCc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000133994472 1417006797 /nfs/dbraw/zinc/00/67/97/1417006797.db2.gz HVCAYQPIQCVZSE-UHFFFAOYSA-N 0 0 382.825 3.088 20 5 GGBDRN NC(=O)c1ccc(COc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c([N+](=O)[O-])c1 ZINC000133995824 1417007529 /nfs/dbraw/zinc/00/75/29/1417007529.db2.gz VEGHCAVXMHBFBZ-UHFFFAOYSA-N 0 0 385.254 3.200 20 5 GGBDRN Cc1nc(NC(=O)c2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)ccc1[N+](=O)[O-] ZINC000133998796 1417007934 /nfs/dbraw/zinc/00/79/34/1417007934.db2.gz PDWMROGYHYHJCQ-KBPBESRZSA-N 0 0 384.436 3.160 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000133999950 1417008264 /nfs/dbraw/zinc/00/82/64/1417008264.db2.gz JHZLKRKYDUPLEV-WBMJQRKESA-N 0 0 386.433 3.084 20 5 GGBDRN Cc1nc(NC(=O)[C@]2(C)CCCN(C(=O)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000134005523 1417009020 /nfs/dbraw/zinc/00/90/20/1417009020.db2.gz GBYXWPUGIFDMHZ-HXUWFJFHSA-N 0 0 382.420 3.179 20 5 GGBDRN CN(C[C@@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000134020237 1417010732 /nfs/dbraw/zinc/01/07/32/1417010732.db2.gz MEJHTBPJMARPOI-ZDUSSCGKSA-N 0 0 395.431 3.453 20 5 GGBDRN COc1cc(C(=O)Nc2nc3ccccc3nc2N2CCCC2)ccc1[N+](=O)[O-] ZINC000134024692 1417011080 /nfs/dbraw/zinc/01/10/80/1417011080.db2.gz DGYQIRKHMUNKPG-UHFFFAOYSA-N 0 0 393.403 3.399 20 5 GGBDRN Cc1nc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])ccc1[N+](=O)[O-] ZINC000134048006 1417014581 /nfs/dbraw/zinc/01/45/81/1417014581.db2.gz VMOYTYIRFRQILN-UHFFFAOYSA-N 0 0 380.744 3.267 20 5 GGBDRN Cn1c(CC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)nnc1-c1ccccc1 ZINC000178715856 1429149790 /nfs/dbraw/zinc/14/97/90/1429149790.db2.gz SGUGOWJQPSGUQD-UHFFFAOYSA-N 0 0 391.431 3.124 20 5 GGBDRN O=C(Nc1ccc(Br)nc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134052880 1417015363 /nfs/dbraw/zinc/01/53/63/1417015363.db2.gz CMXHQBIUCKMEHP-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN C[C@@H]1CN(c2ccccc2NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H](C)O1 ZINC000134059834 1417016157 /nfs/dbraw/zinc/01/61/57/1417016157.db2.gz YNMRAQFXRWJRQE-CHWSQXEVSA-N 0 0 395.419 3.337 20 5 GGBDRN O=C(Nc1cccc(Cl)c1N1CCOCC1)c1cc(F)ccc1[N+](=O)[O-] ZINC000134069523 1417017541 /nfs/dbraw/zinc/01/75/41/1417017541.db2.gz HFQXXFXNOYESQF-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@@H]3CCCCO3)cc2[N+](=O)[O-])CC1 ZINC000134084965 1417019905 /nfs/dbraw/zinc/01/99/05/1417019905.db2.gz VGINUMBYGBRTIF-KRWDZBQOSA-N 0 0 375.469 3.472 20 5 GGBDRN O=C(Nc1ccnn1Cc1cnn(-c2ccccc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000134098580 1417022137 /nfs/dbraw/zinc/02/21/37/1417022137.db2.gz IKRBXHBSTWSKOU-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN O=C(OCCNc1cccnn1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000134103181 1417022494 /nfs/dbraw/zinc/02/24/94/1417022494.db2.gz AYLKKSXOLAOVSD-UHFFFAOYSA-N 0 0 393.403 3.266 20 5 GGBDRN CCOc1cc(C(=O)Nc2ccc(Br)nc2)c([N+](=O)[O-])cc1OC ZINC000134108236 1417023376 /nfs/dbraw/zinc/02/33/76/1417023376.db2.gz JGSPWIAHVAVMDY-UHFFFAOYSA-N 0 0 396.197 3.412 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N(C)C[C@@H]3CCCCO3)cc2)c(C)c1[N+](=O)[O-] ZINC000134129598 1417026695 /nfs/dbraw/zinc/02/66/95/1417026695.db2.gz NTNLMCBMTQSQNP-SFHVURJKSA-N 0 0 386.452 3.098 20 5 GGBDRN COC(=O)c1cc(-c2csc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])n2)c[nH]1 ZINC000134132713 1417027162 /nfs/dbraw/zinc/02/71/62/1417027162.db2.gz FSQBCHSAHILGSO-UHFFFAOYSA-N 0 0 390.352 3.224 20 5 GGBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000134158408 1417030806 /nfs/dbraw/zinc/03/08/06/1417030806.db2.gz NUYKQXKKIWHLDS-KRWDZBQOSA-N 0 0 380.408 3.098 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@H](C)CCC[C@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000134162414 1417031579 /nfs/dbraw/zinc/03/15/79/1417031579.db2.gz AHWXVRLLIOGIBE-ZIAGYGMSSA-N 0 0 384.436 3.100 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC[C@](C)(O)C3)cc2[N+](=O)[O-])n1 ZINC000134164295 1417032076 /nfs/dbraw/zinc/03/20/76/1417032076.db2.gz INLHFLDUBCZVHN-KRWDZBQOSA-N 0 0 393.490 3.498 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(CCC(F)(F)F)CC1CC1 ZINC000134185875 1417035280 /nfs/dbraw/zinc/03/52/80/1417035280.db2.gz IXLIYWUKVZLIOB-UHFFFAOYSA-N 0 0 387.358 3.341 20 5 GGBDRN Cc1cc(-c2nnn(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)n2)ccc1F ZINC000134204360 1417037387 /nfs/dbraw/zinc/03/73/87/1417037387.db2.gz LTVBLQJUQVFZKR-UHFFFAOYSA-N 0 0 380.339 3.399 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(Br)nc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000134218059 1417039291 /nfs/dbraw/zinc/03/92/91/1417039291.db2.gz YQIVIYCRFGAHNJ-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN CCCCn1ncc(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1C ZINC000134231594 1417041786 /nfs/dbraw/zinc/04/17/86/1417041786.db2.gz BZDQMRUXQMJFNK-UHFFFAOYSA-N 0 0 379.804 3.130 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134242060 1417043025 /nfs/dbraw/zinc/04/30/25/1417043025.db2.gz QLFGEIGVZLELJF-UHFFFAOYSA-N 0 0 380.404 3.498 20 5 GGBDRN CSCC[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000134253505 1417044528 /nfs/dbraw/zinc/04/45/28/1417044528.db2.gz JOJDOQCXDHIOBG-MRVPVSSYSA-N 0 0 394.234 3.071 20 5 GGBDRN C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)N(C)c1ccccc1 ZINC000134282590 1417049189 /nfs/dbraw/zinc/04/91/89/1417049189.db2.gz MRYIHTJNYQAZLP-HNNXBMFYSA-N 0 0 379.420 3.035 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000134291920 1417050657 /nfs/dbraw/zinc/05/06/57/1417050657.db2.gz KXSCPVWPKXYROB-ZDUSSCGKSA-N 0 0 393.403 3.230 20 5 GGBDRN O=[N+]([O-])c1cc(CN(CCCO)Cc2cccc(Cl)c2)c2c(c1)COCO2 ZINC000134294584 1417051462 /nfs/dbraw/zinc/05/14/62/1417051462.db2.gz VJBORGZYRODESX-UHFFFAOYSA-N 0 0 392.839 3.499 20 5 GGBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134303893 1417052979 /nfs/dbraw/zinc/05/29/79/1417052979.db2.gz SRAITEUQAFVPGQ-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN O=C(CCc1ccccc1)N1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000134315799 1417054512 /nfs/dbraw/zinc/05/45/12/1417054512.db2.gz MRWUADWRJNWAEM-UHFFFAOYSA-N 0 0 399.422 3.041 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134317228 1417054830 /nfs/dbraw/zinc/05/48/30/1417054830.db2.gz QBPYMWLRVHGRGE-UHFFFAOYSA-N 0 0 380.379 3.381 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC2(C[C@H]2C(=O)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000134319639 1417055122 /nfs/dbraw/zinc/05/51/22/1417055122.db2.gz KLMWWLQSFHYVMK-HNNXBMFYSA-N 0 0 389.452 3.248 20 5 GGBDRN COCCOc1cccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000134335497 1417057189 /nfs/dbraw/zinc/05/71/89/1417057189.db2.gz MYJMDGNPEQHCNF-UHFFFAOYSA-N 0 0 382.376 3.058 20 5 GGBDRN CCc1c(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cnn1CC(C)C ZINC000134350263 1417058717 /nfs/dbraw/zinc/05/87/17/1417058717.db2.gz KFUQUOLECFOHHC-UHFFFAOYSA-N 0 0 393.831 3.240 20 5 GGBDRN CCc1c(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cnn1CC(C)C ZINC000134354008 1417059667 /nfs/dbraw/zinc/05/96/67/1417059667.db2.gz DZSJHCASMYXOIQ-UHFFFAOYSA-N 0 0 393.831 3.240 20 5 GGBDRN C[C@@H](NC(=O)N[C@@H](C)CC(=O)OCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178733431 1429155499 /nfs/dbraw/zinc/15/54/99/1429155499.db2.gz QYPXPIKHFSNMPW-LSDHHAIUSA-N 0 0 385.420 3.477 20 5 GGBDRN C[C@@H](CC(=O)OCc1ccccc1)NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000178733409 1429155548 /nfs/dbraw/zinc/15/55/48/1429155548.db2.gz QYPXPIKHFSNMPW-GJZGRUSLSA-N 0 0 385.420 3.477 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)cc(F)cc1[N+](=O)[O-] ZINC000134411689 1417066376 /nfs/dbraw/zinc/06/63/76/1417066376.db2.gz WPIZMAHIKZIIQA-SNVBAGLBSA-N 0 0 396.781 3.117 20 5 GGBDRN Cc1sc2ncn(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)c(=O)c2c1C ZINC000134524821 1417081674 /nfs/dbraw/zinc/08/16/74/1417081674.db2.gz CEAVWADRHDLOPD-UHFFFAOYSA-N 0 0 378.797 3.020 20 5 GGBDRN CCOc1ccc2c(c1)CN(C(=O)c1ccn(-c3ccccc3[N+](=O)[O-])n1)CC2 ZINC000134536887 1417083354 /nfs/dbraw/zinc/08/33/54/1417083354.db2.gz KVEVADOVGGMBCX-UHFFFAOYSA-N 0 0 392.415 3.378 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000134547466 1417085400 /nfs/dbraw/zinc/08/54/00/1417085400.db2.gz QJBUOSNBBDSYRI-GFCCVEGCSA-N 0 0 385.811 3.311 20 5 GGBDRN COc1ccc([C@H]2CCN(C(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)C2)cc1 ZINC000134564298 1417088012 /nfs/dbraw/zinc/08/80/12/1417088012.db2.gz VLYLIDAHOBSCOS-INIZCTEOSA-N 0 0 392.415 3.419 20 5 GGBDRN CC(C)N(CC(F)F)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000134599921 1417094986 /nfs/dbraw/zinc/09/49/86/1417094986.db2.gz BHYJJDTYKLCMET-UHFFFAOYSA-N 0 0 387.202 3.022 20 5 GGBDRN CCC1(CO)CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)CC1 ZINC000134597894 1417094382 /nfs/dbraw/zinc/09/43/82/1417094382.db2.gz RHPORYISVFXADC-UHFFFAOYSA-N 0 0 389.496 3.456 20 5 GGBDRN CCC1(CO)CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000134599665 1417095089 /nfs/dbraw/zinc/09/50/89/1417095089.db2.gz WLBLUARYCVKTGG-INIZCTEOSA-N 0 0 389.496 3.456 20 5 GGBDRN COc1ccc(CN2CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000134645255 1417103640 /nfs/dbraw/zinc/10/36/40/1417103640.db2.gz IXSKMUBBXGNFLL-UKRRQHHQSA-N 0 0 379.457 3.481 20 5 GGBDRN COc1cc(Cl)ccc1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134654301 1417106921 /nfs/dbraw/zinc/10/69/21/1417106921.db2.gz RCSBOEVWKDYNKG-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN O=C(NC[C@H]1CCOc2ccccc21)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134657128 1417107600 /nfs/dbraw/zinc/10/76/00/1417107600.db2.gz XVUCNHIJSFHRPL-CQSZACIVSA-N 0 0 378.388 3.077 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCOC3(CCCCC3)C2)c1C ZINC000134662781 1417108339 /nfs/dbraw/zinc/10/83/39/1417108339.db2.gz QNMAVOPAZAKUJE-HNNXBMFYSA-N 0 0 382.482 3.372 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCOC3(CCCCC3)C2)cc1C ZINC000134664359 1417109366 /nfs/dbraw/zinc/10/93/66/1417109366.db2.gz PPYICXHXKNQWCG-HNNXBMFYSA-N 0 0 382.482 3.372 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H]2CCOC3(CCCCC3)C2)c1C ZINC000134669924 1417110304 /nfs/dbraw/zinc/11/03/04/1417110304.db2.gz FOCVSMZNEIXFTJ-OAHLLOKOSA-N 0 0 382.482 3.372 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134678710 1417111671 /nfs/dbraw/zinc/11/16/71/1417111671.db2.gz VKOHWMBRTMZYSD-QWHCGFSZSA-N 0 0 381.860 3.405 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134688861 1417112692 /nfs/dbraw/zinc/11/26/92/1417112692.db2.gz ZLFMBGVILCBISE-INIZCTEOSA-N 0 0 391.431 3.179 20 5 GGBDRN O=C(N[C@H]1C[C@H]1c1c(F)cccc1F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134699073 1417113863 /nfs/dbraw/zinc/11/38/63/1417113863.db2.gz PBAREACRCZEADB-ABAIWWIYSA-N 0 0 384.342 3.345 20 5 GGBDRN C[C@H](Oc1ccc(OCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1)C(N)=O ZINC000134705740 1417115038 /nfs/dbraw/zinc/11/50/38/1417115038.db2.gz XWPRGAFBSXDEMD-LBPRGKRZSA-N 0 0 383.360 3.081 20 5 GGBDRN CC[C@]1(c2ccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)CCC(=O)NC1=O ZINC000134712624 1417115895 /nfs/dbraw/zinc/11/58/95/1417115895.db2.gz XBEAOGYEJXSRIC-HXUWFJFHSA-N 0 0 399.378 3.071 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134714646 1417116375 /nfs/dbraw/zinc/11/63/75/1417116375.db2.gz XRNDVLPJTYWCKK-RDTXWAMCSA-N 0 0 386.452 3.352 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134724897 1417117388 /nfs/dbraw/zinc/11/73/88/1417117388.db2.gz WLISHSLYWUSLBK-CHWSQXEVSA-N 0 0 381.860 3.405 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134724936 1417117408 /nfs/dbraw/zinc/11/74/08/1417117408.db2.gz WLISHSLYWUSLBK-OLZOCXBDSA-N 0 0 381.860 3.405 20 5 GGBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134734338 1417118235 /nfs/dbraw/zinc/11/82/35/1417118235.db2.gz FOATUTQUFUSVOM-MRXNPFEDSA-N 0 0 394.387 3.201 20 5 GGBDRN CC(C)COC(=O)N1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000134747639 1417119916 /nfs/dbraw/zinc/11/99/16/1417119916.db2.gz GVVABHIHHJAHOB-UHFFFAOYSA-N 0 0 383.832 3.189 20 5 GGBDRN C[C@H](Oc1cccc(OCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1)C(N)=O ZINC000134750156 1417119932 /nfs/dbraw/zinc/11/99/32/1417119932.db2.gz FKKYCXOYDNESHO-LBPRGKRZSA-N 0 0 383.360 3.081 20 5 GGBDRN C[C@@H](Oc1cccc(OCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1)C(N)=O ZINC000134750172 1417120276 /nfs/dbraw/zinc/12/02/76/1417120276.db2.gz FKKYCXOYDNESHO-GFCCVEGCSA-N 0 0 383.360 3.081 20 5 GGBDRN C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)Oc1ccccc1F ZINC000134762890 1417121789 /nfs/dbraw/zinc/12/17/89/1417121789.db2.gz XRYGTTJRUCWKFT-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000134815348 1417131059 /nfs/dbraw/zinc/13/10/59/1417131059.db2.gz FGBAWKAQHRWEOJ-UHFFFAOYSA-N 0 0 377.601 3.436 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)CCNc3ccccc3[N+](=O)[O-])cc2)CCO1 ZINC000134830155 1417132241 /nfs/dbraw/zinc/13/22/41/1417132241.db2.gz ICFAPOGVMRUNJL-HNNXBMFYSA-N 0 0 384.436 3.261 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)CCNc3ccccc3[N+](=O)[O-])cc2)CCO1 ZINC000134830136 1417132301 /nfs/dbraw/zinc/13/23/01/1417132301.db2.gz ICFAPOGVMRUNJL-OAHLLOKOSA-N 0 0 384.436 3.261 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000134851478 1417134209 /nfs/dbraw/zinc/13/42/09/1417134209.db2.gz KOXGQMATLPSHDK-UHFFFAOYSA-N 0 0 396.369 3.098 20 5 GGBDRN Cn1c(CCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)nc2c1cccc2F ZINC000134887965 1417140237 /nfs/dbraw/zinc/14/02/37/1417140237.db2.gz GDMRWOJDULILDJ-UHFFFAOYSA-N 0 0 376.775 3.247 20 5 GGBDRN O=C(CCCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)N1Cc2ccccc2C1 ZINC000134911021 1417143088 /nfs/dbraw/zinc/14/30/88/1417143088.db2.gz LHDOLSZCTUBGSY-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN O=C(NCCc1cc2ccccc2[nH]1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134916152 1417144586 /nfs/dbraw/zinc/14/45/86/1417144586.db2.gz WYEHNKJPFDAYKQ-UHFFFAOYSA-N 0 0 375.388 3.234 20 5 GGBDRN O=C(NCC1(O)CCCC1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000134940842 1417148724 /nfs/dbraw/zinc/14/87/24/1417148724.db2.gz HARKRAAXBISVQD-UHFFFAOYSA-N 0 0 399.234 3.122 20 5 GGBDRN C[C@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[C@H]1COc2ccccc21 ZINC000134952888 1417150936 /nfs/dbraw/zinc/15/09/36/1417150936.db2.gz GSVJRQMOSJDCOI-DZGCQCFKSA-N 0 0 378.388 3.075 20 5 GGBDRN Cc1c(C(=O)N[C@H](Cc2ccccc2)C2CC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000134951985 1417151036 /nfs/dbraw/zinc/15/10/36/1417151036.db2.gz BOTVCKSWJOPXLX-LJQANCHMSA-N 0 0 391.431 3.235 20 5 GGBDRN COC(=O)c1cccc(NC2CCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000135011065 1417160665 /nfs/dbraw/zinc/16/06/65/1417160665.db2.gz KACWOOQWTFDRPM-UHFFFAOYSA-N 0 0 397.431 3.407 20 5 GGBDRN COC(=O)c1cccc(NC2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000135020456 1417163181 /nfs/dbraw/zinc/16/31/81/1417163181.db2.gz GFJLXHNGKSYQIY-UHFFFAOYSA-N 0 0 397.431 3.407 20 5 GGBDRN COc1cc(C(=O)NC(C)(C)c2nc(C)c(C)s2)c([N+](=O)[O-])cc1OC ZINC000135029520 1417164927 /nfs/dbraw/zinc/16/49/27/1417164927.db2.gz SCPNJUMWBNOSKK-UHFFFAOYSA-N 0 0 379.438 3.350 20 5 GGBDRN COC(=O)c1cc(C(=O)NC(C)(C)c2nc(C)c(C)s2)cc([N+](=O)[O-])c1 ZINC000135033403 1417165366 /nfs/dbraw/zinc/16/53/66/1417165366.db2.gz YSLJGCQYQFMXNI-UHFFFAOYSA-N 0 0 377.422 3.120 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1c[nH]nc1-c1c(F)cccc1F ZINC000135086692 1417171589 /nfs/dbraw/zinc/17/15/89/1417171589.db2.gz AZEKYYYCCKYHOE-UHFFFAOYSA-N 0 0 388.330 3.202 20 5 GGBDRN Cc1c(C(=O)NCCCc2nc3ccccc3n2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000135136433 1417176355 /nfs/dbraw/zinc/17/63/55/1417176355.db2.gz XFINZVMGQPXQNL-UHFFFAOYSA-N 0 0 397.391 3.061 20 5 GGBDRN COc1cc(OCC(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000135167616 1417180625 /nfs/dbraw/zinc/18/06/25/1417180625.db2.gz QDDCHFVRNIZDJX-OAHLLOKOSA-N 0 0 388.395 3.213 20 5 GGBDRN CCCCOc1ccccc1NC(=O)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000135170904 1417180661 /nfs/dbraw/zinc/18/06/61/1417180661.db2.gz HWOAMPJCZNRVOA-UHFFFAOYSA-N 0 0 385.420 3.071 20 5 GGBDRN O=c1c(Cl)c(N(Cc2ccccn2)C2CC2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000178767603 1429164370 /nfs/dbraw/zinc/16/43/70/1429164370.db2.gz MFQQKAMKZWEDEQ-UHFFFAOYSA-N 0 0 397.822 3.358 20 5 GGBDRN CC(C)(C)Oc1ccccc1NC(=O)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000135188722 1417183399 /nfs/dbraw/zinc/18/33/99/1417183399.db2.gz YBXSDWKTGQKWGN-UHFFFAOYSA-N 0 0 385.420 3.070 20 5 GGBDRN CC(C)(C)OC(=O)N1CC(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1 ZINC000135188016 1417183539 /nfs/dbraw/zinc/18/35/39/1417183539.db2.gz ATOMXELJUHUFKH-UHFFFAOYSA-N 0 0 389.452 3.343 20 5 GGBDRN CCCn1ccc2ccc(NC(=O)C(=O)NCCc3cccc([N+](=O)[O-])c3)cc21 ZINC000135191744 1417184862 /nfs/dbraw/zinc/18/48/62/1417184862.db2.gz GJQHULKWPQGRPA-UHFFFAOYSA-N 0 0 394.431 3.257 20 5 GGBDRN C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc2ccccc2n1C ZINC000135203271 1417187238 /nfs/dbraw/zinc/18/72/38/1417187238.db2.gz KGADPKKCNMQHBI-GFCCVEGCSA-N 0 0 377.404 3.383 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000135206790 1417187942 /nfs/dbraw/zinc/18/79/42/1417187942.db2.gz ARZAZLARQZJEKF-CQSZACIVSA-N 0 0 383.832 3.281 20 5 GGBDRN C[C@H](Cc1noc(CNc2ccccc2[N+](=O)[O-])n1)N(C)C(=O)OC(C)(C)C ZINC000135209950 1417188541 /nfs/dbraw/zinc/18/85/41/1417188541.db2.gz FWSVCUHTMYVHLX-GFCCVEGCSA-N 0 0 391.428 3.388 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(C)c1O ZINC000178786287 1429169835 /nfs/dbraw/zinc/16/98/35/1429169835.db2.gz IFGQRDWTHFGBHZ-ZDUSSCGKSA-N 0 0 389.433 3.222 20 5 GGBDRN CN(C)S(=O)(=O)c1cccc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135222394 1417190805 /nfs/dbraw/zinc/19/08/05/1417190805.db2.gz ZOVDCYUVTWUJJE-UHFFFAOYSA-N 0 0 389.477 3.010 20 5 GGBDRN COc1cccc(S(=O)(=O)CCN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135226819 1417191784 /nfs/dbraw/zinc/19/17/84/1417191784.db2.gz LFYOOYYVFTWOHY-UHFFFAOYSA-N 0 0 390.461 3.042 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000135227305 1417191999 /nfs/dbraw/zinc/19/19/99/1417191999.db2.gz VSFUWSSGZWLXFF-XJKSGUPXSA-N 0 0 395.394 3.333 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000135229702 1417192184 /nfs/dbraw/zinc/19/21/84/1417192184.db2.gz MGHJJEXWFXMZLP-UKRRQHHQSA-N 0 0 395.394 3.333 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135232808 1417192976 /nfs/dbraw/zinc/19/29/76/1417192976.db2.gz GQRWSDTZWXOKCS-UHFFFAOYSA-N 0 0 384.392 3.415 20 5 GGBDRN COC(=O)c1ccc(C)c(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135238751 1417193968 /nfs/dbraw/zinc/19/39/68/1417193968.db2.gz DZACZJVLIPORHR-UHFFFAOYSA-N 0 0 397.431 3.293 20 5 GGBDRN CS(=O)(=O)c1ccc(OCCN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000135241271 1417194404 /nfs/dbraw/zinc/19/44/04/1417194404.db2.gz KUAISIJZUCQSET-UHFFFAOYSA-N 0 0 390.461 3.042 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c(Br)n1 ZINC000135242568 1417194583 /nfs/dbraw/zinc/19/45/83/1417194583.db2.gz RVLBFDZJLYUNDX-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000135244925 1417195217 /nfs/dbraw/zinc/19/52/17/1417195217.db2.gz HJGUGGBOGZJRMH-RHSMWYFYSA-N 0 0 388.468 3.055 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000135257100 1417197643 /nfs/dbraw/zinc/19/76/43/1417197643.db2.gz MGJIFQVJFBIKMF-OCCSQVGLSA-N 0 0 399.378 3.046 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@](C)(c3ccc(C)cc3C)C2=O)cc1[N+](=O)[O-] ZINC000135323244 1417207734 /nfs/dbraw/zinc/20/77/34/1417207734.db2.gz OTPSKDNYNLFHDR-HXUWFJFHSA-N 0 0 383.404 3.187 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cccc(Oc2cnccn2)c1 ZINC000135345162 1417209907 /nfs/dbraw/zinc/20/99/07/1417209907.db2.gz RJXGZMQPVQHHCX-UHFFFAOYSA-N 0 0 379.376 3.019 20 5 GGBDRN O=C(COc1cc(F)cc([N+](=O)[O-])c1)N(Cc1ccco1)CC(F)(F)F ZINC000135344020 1417209987 /nfs/dbraw/zinc/20/99/87/1417209987.db2.gz RRTNKIWJAHIXAP-UHFFFAOYSA-N 0 0 376.262 3.297 20 5 GGBDRN COc1cc(CN(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccc1O ZINC000135372661 1417212249 /nfs/dbraw/zinc/21/22/49/1417212249.db2.gz YNMSXFNGINJDCZ-UHFFFAOYSA-N 0 0 385.420 3.181 20 5 GGBDRN COc1cc(CN(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1O ZINC000135373336 1417212300 /nfs/dbraw/zinc/21/23/00/1417212300.db2.gz OOVYXDHECIMZIW-UHFFFAOYSA-N 0 0 399.447 3.184 20 5 GGBDRN CCN(C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2COC)C1)CC(F)(F)F ZINC000135380015 1417213118 /nfs/dbraw/zinc/21/31/18/1417213118.db2.gz PFOQWESTOCRUTA-ZDUSSCGKSA-N 0 0 375.391 3.452 20 5 GGBDRN CCN(C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2COC)C1)CC(F)(F)F ZINC000135380036 1417213264 /nfs/dbraw/zinc/21/32/64/1417213264.db2.gz PFOQWESTOCRUTA-CYBMUJFWSA-N 0 0 375.391 3.452 20 5 GGBDRN COc1cc(OCC(=O)NCC2(c3ccccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000135442087 1417220195 /nfs/dbraw/zinc/22/01/95/1417220195.db2.gz OOZKRYOHZVPZIO-UHFFFAOYSA-N 0 0 390.823 3.484 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000135462627 1417223154 /nfs/dbraw/zinc/22/31/54/1417223154.db2.gz PWSBICVKYNTXGP-AWEZNQCLSA-N 0 0 395.749 3.062 20 5 GGBDRN CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000135477794 1417225402 /nfs/dbraw/zinc/22/54/02/1417225402.db2.gz NALAHYWTLPADOF-IAGOWNOFSA-N 0 0 377.441 3.023 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000135484421 1417226377 /nfs/dbraw/zinc/22/63/77/1417226377.db2.gz XXIGGACHMKJPER-KRWDZBQOSA-N 0 0 381.388 3.425 20 5 GGBDRN COCc1nc(C)c(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])s1 ZINC000135492325 1417227286 /nfs/dbraw/zinc/22/72/86/1417227286.db2.gz HLEYLDWGOFWXAQ-UHFFFAOYSA-N 0 0 378.454 3.047 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000135492000 1417227304 /nfs/dbraw/zinc/22/73/04/1417227304.db2.gz CEBVSMNTMKNEEU-LLVKDONJSA-N 0 0 393.444 3.215 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc3c(c2)CCC(=O)N3C)c([N+](=O)[O-])c1 ZINC000135492354 1417228334 /nfs/dbraw/zinc/22/83/34/1417228334.db2.gz YUKNEDZZPGWUHJ-UHFFFAOYSA-N 0 0 396.447 3.044 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)Cc1csc(N2CCCC2=O)n1 ZINC000135494661 1417228473 /nfs/dbraw/zinc/22/84/73/1417228473.db2.gz AAOGJHXHNKJYJA-UHFFFAOYSA-N 0 0 394.840 3.321 20 5 GGBDRN Cc1ccc(-c2nnn(CC(=O)Nc3cc([N+](=O)[O-])c(Cl)cc3C)n2)cc1 ZINC000135499402 1417229553 /nfs/dbraw/zinc/22/95/53/1417229553.db2.gz PQRHTRJZFFFFBF-UHFFFAOYSA-N 0 0 386.799 3.157 20 5 GGBDRN O=C(Cc1c[nH]c2cc(Cl)ccc12)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135526755 1417232924 /nfs/dbraw/zinc/23/29/24/1417232924.db2.gz KMYUQXDDWLPXTK-AWEZNQCLSA-N 0 0 399.838 3.380 20 5 GGBDRN O=C(Cc1ccccc1C(F)(F)F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135526816 1417233104 /nfs/dbraw/zinc/23/31/04/1417233104.db2.gz VNRLEJYFFOKQAP-CYBMUJFWSA-N 0 0 394.353 3.264 20 5 GGBDRN Cc1ccc(-c2cc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)on2)cc1 ZINC000135527526 1417233577 /nfs/dbraw/zinc/23/35/77/1417233577.db2.gz YRVJMQPTTBCHHA-HNNXBMFYSA-N 0 0 393.403 3.280 20 5 GGBDRN O=C(c1ccccc1OCC1CC1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135526905 1417233609 /nfs/dbraw/zinc/23/36/09/1417233609.db2.gz VFMRMFPMFIWRSL-OAHLLOKOSA-N 0 0 382.420 3.105 20 5 GGBDRN O=C(N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1(c2cccc(Cl)c2)CC1 ZINC000135530228 1417233861 /nfs/dbraw/zinc/23/38/61/1417233861.db2.gz SVANYQPMSPUUET-HNNXBMFYSA-N 0 0 386.839 3.388 20 5 GGBDRN COc1ccc(CN(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1O ZINC000135533206 1417233957 /nfs/dbraw/zinc/23/39/57/1417233957.db2.gz YIBPSLNDLDVWIL-UHFFFAOYSA-N 0 0 399.447 3.184 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(Oc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])c1 ZINC000135530378 1417234073 /nfs/dbraw/zinc/23/40/73/1417234073.db2.gz XDRSUBVJCFCLJS-UHFFFAOYSA-N 0 0 392.267 3.431 20 5 GGBDRN Cc1ccc2[nH]c(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1C ZINC000135536175 1417234906 /nfs/dbraw/zinc/23/49/06/1417234906.db2.gz PSXRYTLBCSVHNT-CQSZACIVSA-N 0 0 379.420 3.415 20 5 GGBDRN Cc1ccc2[nH]c(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1C ZINC000135536155 1417235000 /nfs/dbraw/zinc/23/50/00/1417235000.db2.gz PSXRYTLBCSVHNT-AWEZNQCLSA-N 0 0 379.420 3.415 20 5 GGBDRN COc1ccccc1/C(C)=C/C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135541724 1417235488 /nfs/dbraw/zinc/23/54/88/1417235488.db2.gz FJJMSUBFCDFODP-GOFCXVBSSA-N 0 0 382.420 3.115 20 5 GGBDRN CC(C)COc1ccc(CC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135538895 1417235519 /nfs/dbraw/zinc/23/55/19/1417235519.db2.gz VHANWDVIBQCNLL-KRWDZBQOSA-N 0 0 398.463 3.280 20 5 GGBDRN C[C@@H](CSc1ccccc1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135541508 1417235574 /nfs/dbraw/zinc/23/55/74/1417235574.db2.gz MOGNWMUTFCOJEE-LSDHHAIUSA-N 0 0 386.477 3.431 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)ccc1[N+](=O)[O-] ZINC000135577437 1417239436 /nfs/dbraw/zinc/23/94/36/1417239436.db2.gz BEVRVTFYJAFJJG-GFCCVEGCSA-N 0 0 393.802 3.405 20 5 GGBDRN Cc1cc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)ccc1C(=O)N(C)C ZINC000135584153 1417240328 /nfs/dbraw/zinc/24/03/28/1417240328.db2.gz GGEKYABGEMQPQU-UHFFFAOYSA-N 0 0 380.404 3.268 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(OS(=O)(=O)Cc2cc(-c3ccccc3)no2)c1 ZINC000135593917 1417242150 /nfs/dbraw/zinc/24/21/50/1417242150.db2.gz KHIDMSDIYHZJAT-UHFFFAOYSA-N 0 0 378.337 3.298 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(OS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000135595684 1417242951 /nfs/dbraw/zinc/24/29/51/1417242951.db2.gz PERPHJJVHUEPGW-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN O=C(N[C@@H](Cc1ccccc1)C1CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000135599250 1417243364 /nfs/dbraw/zinc/24/33/64/1417243364.db2.gz OXFHHZZGCRUWQA-IBGZPJMESA-N 0 0 377.400 3.187 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000135600909 1417244217 /nfs/dbraw/zinc/24/42/17/1417244217.db2.gz JIGKWRHQCCVWSS-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN Cc1ccc(C)c(N2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)c1 ZINC000178787769 1429169465 /nfs/dbraw/zinc/16/94/65/1429169465.db2.gz BQKKBRKFBHRRHQ-UHFFFAOYSA-N 0 0 383.448 3.400 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1c(C)noc1C ZINC000135674789 1417256901 /nfs/dbraw/zinc/25/69/01/1417256901.db2.gz LDYBHCRXPPJEFD-UHFFFAOYSA-N 0 0 379.438 3.210 20 5 GGBDRN CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c(-c3nnn[n-]3)c2)cc1[N+](=O)[O-] ZINC000825632268 1429170418 /nfs/dbraw/zinc/17/04/18/1429170418.db2.gz NOEGJNLRNXPBLD-GFCCVEGCSA-N 0 0 398.423 3.033 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC([C@H](O)c2ccc(F)cc2)CC1 ZINC000135697873 1417258996 /nfs/dbraw/zinc/25/89/96/1417258996.db2.gz PMUBVPMDBDZQFW-GOSISDBHSA-N 0 0 376.359 3.459 20 5 GGBDRN Cn1cc(-c2csc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)cn1 ZINC000135732755 1417262959 /nfs/dbraw/zinc/26/29/59/1417262959.db2.gz KIBBJLLSJOWCOJ-UHFFFAOYSA-N 0 0 382.405 3.114 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135743351 1417264479 /nfs/dbraw/zinc/26/44/79/1417264479.db2.gz PKPHSERRYIMTKG-HKUPYCBJSA-N 0 0 375.425 3.028 20 5 GGBDRN CN(CCCOc1ccccc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000135783301 1417268303 /nfs/dbraw/zinc/26/83/03/1417268303.db2.gz GMSVHZKZWPUUOL-UHFFFAOYSA-N 0 0 380.404 3.322 20 5 GGBDRN O=C(NC[C@@H](O)c1ccco1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000135798190 1417268531 /nfs/dbraw/zinc/26/85/31/1417268531.db2.gz IJKNOUBZRTWSSP-GOSISDBHSA-N 0 0 381.388 3.263 20 5 GGBDRN O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1)N1CCCCC1 ZINC000135965025 1417282642 /nfs/dbraw/zinc/28/26/42/1417282642.db2.gz XQSYHEMNBBUCKD-UHFFFAOYSA-N 0 0 391.493 3.372 20 5 GGBDRN CNC(=O)c1ccc(N(Cc2ccnc(OC(C)C)c2)C2CC2)c([N+](=O)[O-])c1 ZINC000135981059 1417283726 /nfs/dbraw/zinc/28/37/26/1417283726.db2.gz UQSMMBICHLYKEE-UHFFFAOYSA-N 0 0 384.436 3.306 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 ZINC000136037117 1417287685 /nfs/dbraw/zinc/28/76/85/1417287685.db2.gz NJFAKMRYSQWBRI-BXUZGUMPSA-N 0 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ZINC000136566483 1417326908 /nfs/dbraw/zinc/32/69/08/1417326908.db2.gz DIAPHPVIBPTKBB-AWEZNQCLSA-N 0 0 379.482 3.084 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCCNc1ccc(C(F)(F)F)cn1 ZINC000136583544 1417329357 /nfs/dbraw/zinc/32/93/57/1417329357.db2.gz LKDHOKWOXXLDIY-UHFFFAOYSA-N 0 0 385.298 3.286 20 5 GGBDRN C[C@@H](Cc1ccccc1F)NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136593443 1417330705 /nfs/dbraw/zinc/33/07/05/1417330705.db2.gz WCAKCWFWEPUKDZ-LBPRGKRZSA-N 0 0 378.425 3.179 20 5 GGBDRN CN(CCCCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000136610475 1417332287 /nfs/dbraw/zinc/33/22/87/1417332287.db2.gz JFXOLCSIRIVGRB-UHFFFAOYSA-N 0 0 382.424 3.193 20 5 GGBDRN Cc1nnnn1-c1cccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000136616337 1417332699 /nfs/dbraw/zinc/33/26/99/1417332699.db2.gz DJUCPVWYRRIASX-UHFFFAOYSA-N 0 0 393.407 3.075 20 5 GGBDRN O=C(N[C@@H]1CCc2cc(F)ccc21)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136625657 1417333164 /nfs/dbraw/zinc/33/31/64/1417333164.db2.gz 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ZINC000136908159 1417354375 /nfs/dbraw/zinc/35/43/75/1417354375.db2.gz UDEBPIDNWJCNOI-KRWDZBQOSA-N 0 0 399.447 3.189 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1 ZINC000136918600 1417354589 /nfs/dbraw/zinc/35/45/89/1417354589.db2.gz PSDREGPLJSVZAK-CYBMUJFWSA-N 0 0 380.832 3.161 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)Cn2cnc3c2ncnc3NCc2ccccc2)c1 ZINC000136939338 1417356684 /nfs/dbraw/zinc/35/66/84/1417356684.db2.gz HYOQAXCPVLLGNU-KRWDZBQOSA-N 0 0 390.403 3.080 20 5 GGBDRN COc1cc([C@H](C)NC(=O)c2[nH]ncc2[N+](=O)[O-])ccc1OCc1ccccc1 ZINC000136958524 1417357557 /nfs/dbraw/zinc/35/75/57/1417357557.db2.gz AHNJHJKTTQXEAD-ZDUSSCGKSA-N 0 0 396.403 3.397 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(c3ncc(Cl)cc3Cl)CC2)c1 ZINC000136957510 1417357606 /nfs/dbraw/zinc/35/76/06/1417357606.db2.gz USUQSDJEHSVQQY-INIZCTEOSA-N 0 0 397.262 3.152 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CN2CCN(c3ncc(Cl)cc3Cl)CC2)c1 ZINC000136957471 1417357913 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375.812 3.246 20 5 GGBDRN O=C1CC(c2ccc(Cl)cc2)CC(=O)N1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137068522 1417366125 /nfs/dbraw/zinc/36/61/25/1417366125.db2.gz JTGMZHIZEGJRAV-QGZVFWFLSA-N 0 0 388.807 3.214 20 5 GGBDRN CCc1ccc([C@@]2(CC)NC(=O)N(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000137078857 1417367058 /nfs/dbraw/zinc/36/70/58/1417367058.db2.gz WZONGIPSIGWCAC-WIYYLYMNSA-N 0 0 397.431 3.048 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1SCCO)N1CCC[C@H](c2nccs2)C1 ZINC000137092215 1417367599 /nfs/dbraw/zinc/36/75/99/1417367599.db2.gz KORXCIGGPSUHTD-LBPRGKRZSA-N 0 0 393.490 3.156 20 5 GGBDRN CC(C)Cc1ccc(CS(=O)(=O)C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000137146736 1417371080 /nfs/dbraw/zinc/37/10/80/1417371080.db2.gz GKDCLLCDPXDRRY-IBGZPJMESA-N 0 0 377.462 3.442 20 5 GGBDRN O=C(NCC1(c2cccc(F)c2)CC1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000137191233 1417374208 /nfs/dbraw/zinc/37/42/08/1417374208.db2.gz OLBGAZLXSLIGGT-UHFFFAOYSA-N 0 0 390.436 3.280 20 5 GGBDRN 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392.437 3.041 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(c3nc4ccccc4s3)CC2)c1 ZINC000178867782 1429202418 /nfs/dbraw/zinc/20/24/18/1429202418.db2.gz AEFBGEPHPIENOR-KRWDZBQOSA-N 0 0 384.461 3.060 20 5 GGBDRN O=C(Nc1ccccc1CN1CCSCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000145989785 1417705755 /nfs/dbraw/zinc/70/57/55/1417705755.db2.gz AJNFKNGZURPGPO-UHFFFAOYSA-N 0 0 397.460 3.272 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000146240741 1417713115 /nfs/dbraw/zinc/71/31/15/1417713115.db2.gz PBVXUQNDFRCLME-SJLPKXTDSA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000146252286 1417713269 /nfs/dbraw/zinc/71/32/69/1417713269.db2.gz MAPIIAIEKGELFV-KBXCAEBGSA-N 0 0 394.424 3.180 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000146262232 1417714625 /nfs/dbraw/zinc/71/46/25/1417714625.db2.gz OSYZDJHAGLAEKJ-QFBILLFUSA-N 0 0 390.461 3.349 20 5 GGBDRN 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ZINC000146545076 1417722880 /nfs/dbraw/zinc/72/28/80/1417722880.db2.gz SOJMBPPLNZUEOJ-UHFFFAOYSA-N 0 0 398.824 3.188 20 5 GGBDRN CN(Cc1ccc2ccccc2c1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000146537812 1417723108 /nfs/dbraw/zinc/72/31/08/1417723108.db2.gz PLTXSXGTUVDCIR-UHFFFAOYSA-N 0 0 398.440 3.424 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCCOCCc1ccccc1 ZINC000146914371 1417733688 /nfs/dbraw/zinc/73/36/88/1417733688.db2.gz OULCZPYKFSFVEN-UHFFFAOYSA-N 0 0 398.868 3.176 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1 ZINC000147008133 1417736105 /nfs/dbraw/zinc/73/61/05/1417736105.db2.gz SPYQSJAKVLGALC-GOSISDBHSA-N 0 0 390.461 3.168 20 5 GGBDRN CSc1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000147004381 1417736520 /nfs/dbraw/zinc/73/65/20/1417736520.db2.gz RZPWZYWOLITDFH-LLVKDONJSA-N 0 0 394.474 3.211 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000147106680 1417738061 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HGKTVRMRLCPZJN-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN COCCOc1ccc([C@@H](C)NC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1OC ZINC000148043384 1417758601 /nfs/dbraw/zinc/75/86/01/1417758601.db2.gz ZBIRAJXJSWLKCV-CQSZACIVSA-N 0 0 388.420 3.428 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000148145063 1417760272 /nfs/dbraw/zinc/76/02/72/1417760272.db2.gz ZHLVXCHBJKQGJI-GOSISDBHSA-N 0 0 386.404 3.336 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2ccc(OC(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000148243618 1417761632 /nfs/dbraw/zinc/76/16/32/1417761632.db2.gz XCPQAENYLNAWLO-UHFFFAOYSA-N 0 0 385.420 3.335 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC=C(c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000178877681 1429207658 /nfs/dbraw/zinc/20/76/58/1429207658.db2.gz PBGVOWIMQZHEAG-UHFFFAOYSA-N 0 0 397.406 3.088 20 5 GGBDRN Cc1nc(NC(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])oc1C ZINC000148788325 1417768102 /nfs/dbraw/zinc/76/81/02/1417768102.db2.gz XYMHXODETWVAOU-AWEZNQCLSA-N 0 0 390.396 3.404 20 5 GGBDRN COc1ccc(OC(F)F)c(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000148853551 1417768779 /nfs/dbraw/zinc/76/87/79/1417768779.db2.gz OEZKPLZSXUXWFT-UHFFFAOYSA-N 0 0 398.318 3.231 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)CCc1ccc(OC(C)C)cc1 ZINC000149722905 1417779289 /nfs/dbraw/zinc/77/92/89/1417779289.db2.gz LFPSAIICHCIVHP-HNNXBMFYSA-N 0 0 388.468 3.415 20 5 GGBDRN CC(C)[C@H]1CCCN1C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000149849511 1417781290 /nfs/dbraw/zinc/78/12/90/1417781290.db2.gz MDWOBGJHGXDXFN-CYBMUJFWSA-N 0 0 375.454 3.135 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000149922041 1417781758 /nfs/dbraw/zinc/78/17/58/1417781758.db2.gz HPANUCCGHRYZDE-APWZRJJASA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000149986992 1417782783 /nfs/dbraw/zinc/78/27/83/1417782783.db2.gz ZVWURVMYULBBRU-VQIMIIECSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000149986349 1417782856 /nfs/dbraw/zinc/78/28/56/1417782856.db2.gz BJCSIYMMNXRFPW-LPHOPBHVSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1cc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)on1 ZINC000150144050 1417785156 /nfs/dbraw/zinc/78/51/56/1417785156.db2.gz FCGCCIYTFGLRMP-ZDUSSCGKSA-N 0 0 381.392 3.389 20 5 GGBDRN COC(=O)N(C)Cc1ccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1 ZINC000150726606 1417792842 /nfs/dbraw/zinc/79/28/42/1417792842.db2.gz SBFNUTKECLZREK-UHFFFAOYSA-N 0 0 375.356 3.493 20 5 GGBDRN Cn1cc(-c2csc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000150730400 1417793454 /nfs/dbraw/zinc/79/34/54/1417793454.db2.gz JALQFEKXMDXVLS-UHFFFAOYSA-N 0 0 386.437 3.283 20 5 GGBDRN Cc1nc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCCCCC2)no1 ZINC000150756320 1417800591 /nfs/dbraw/zinc/80/05/91/1417800591.db2.gz CCSRIDUUBFNRNY-UHFFFAOYSA-N 0 0 376.388 3.334 20 5 GGBDRN COc1ccc([C@H](C)CCNC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000150765131 1417802542 /nfs/dbraw/zinc/80/25/42/1417802542.db2.gz VDHXUIZERNJCDS-HUUCEWRRSA-N 0 0 399.447 3.032 20 5 GGBDRN Cc1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)ccc1OC1CCOCC1 ZINC000150766450 1417803275 /nfs/dbraw/zinc/80/32/75/1417803275.db2.gz XOIUSQXZDSRYIK-UHFFFAOYSA-N 0 0 389.383 3.435 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000150765151 1417803336 /nfs/dbraw/zinc/80/33/36/1417803336.db2.gz VDHXUIZERNJCDS-GJZGRUSLSA-N 0 0 399.447 3.032 20 5 GGBDRN COc1cc(S(=O)(=O)N(Cc2ccco2)Cc2ccco2)ccc1[N+](=O)[O-] ZINC000150772344 1417804345 /nfs/dbraw/zinc/80/43/45/1417804345.db2.gz BBAYYOXWABUTBC-UHFFFAOYSA-N 0 0 392.389 3.181 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@H](C)c2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000150778397 1417805105 /nfs/dbraw/zinc/80/51/05/1417805105.db2.gz SWTCYPMPYPLGMY-LLVKDONJSA-N 0 0 376.390 3.389 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000150782371 1417805923 /nfs/dbraw/zinc/80/59/23/1417805923.db2.gz JUIZNTPWZSQGDM-OAHLLOKOSA-N 0 0 380.397 3.268 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000150782394 1417806165 /nfs/dbraw/zinc/80/61/65/1417806165.db2.gz JUIZNTPWZSQGDM-HNNXBMFYSA-N 0 0 380.397 3.268 20 5 GGBDRN COc1cc(S(=O)(=O)N(Cc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000150797009 1417808604 /nfs/dbraw/zinc/80/86/04/1417808604.db2.gz ADFVKAOFQJYLIU-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)[C@H](C)c2cc(F)ccc2F)ccc1[N+](=O)[O-] ZINC000150796702 1417808612 /nfs/dbraw/zinc/80/86/12/1417808612.db2.gz LCSFQNFNBJUZQZ-SNVBAGLBSA-N 0 0 386.376 3.263 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000150815564 1417812824 /nfs/dbraw/zinc/81/28/24/1417812824.db2.gz ZGGBMWLWTRDONZ-UKRRQHHQSA-N 0 0 376.434 3.170 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000150817206 1417813438 /nfs/dbraw/zinc/81/34/38/1417813438.db2.gz ZMZNIEIDEHGLKK-TZMCWYRMSA-N 0 0 394.424 3.309 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000150833202 1417816085 /nfs/dbraw/zinc/81/60/85/1417816085.db2.gz LBEPVTWBBCGYGX-XJKSGUPXSA-N 0 0 376.434 3.170 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000150833167 1417816260 /nfs/dbraw/zinc/81/62/60/1417816260.db2.gz LBEPVTWBBCGYGX-CZUORRHYSA-N 0 0 376.434 3.170 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000150835344 1417816587 /nfs/dbraw/zinc/81/65/87/1417816587.db2.gz DYHPAGLBRHZLPY-CHWSQXEVSA-N 0 0 395.431 3.499 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)[C@H]2CCCc3nc(C)sc32)c1[N+](=O)[O-] ZINC000150839785 1417817766 /nfs/dbraw/zinc/81/77/66/1417817766.db2.gz XXEMONLXCRIQGI-ZDUSSCGKSA-N 0 0 376.438 3.445 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N(C)C[C@H](O)C3CC3)cc2[N+](=O)[O-])n1 ZINC000150844010 1417818487 /nfs/dbraw/zinc/81/84/87/1417818487.db2.gz UIPUZJJVGABBCG-AWEZNQCLSA-N 0 0 393.490 3.354 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000150848744 1417820072 /nfs/dbraw/zinc/82/00/72/1417820072.db2.gz APFODBHWNACLHM-ZBFHGGJFSA-N 0 0 391.468 3.289 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1F ZINC000150849123 1417820275 /nfs/dbraw/zinc/82/02/75/1417820275.db2.gz SAMAQYQMJQKMKF-UHFFFAOYSA-N 0 0 386.358 3.226 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000150856035 1417821824 /nfs/dbraw/zinc/82/18/24/1417821824.db2.gz QKGOHJHQFVJRBA-HNNXBMFYSA-N 0 0 375.425 3.115 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2ccc(N[C@H](C)CCO)c([N+](=O)[O-])c2)c(C)c1 ZINC000150867325 1417824168 /nfs/dbraw/zinc/82/41/68/1417824168.db2.gz JBLYMUVZVGYQNR-CQSZACIVSA-N 0 0 393.465 3.195 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000150870358 1417824653 /nfs/dbraw/zinc/82/46/53/1417824653.db2.gz QVUHDIQVAMBSCP-UHFFFAOYSA-N 0 0 395.412 3.067 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000150871393 1417825013 /nfs/dbraw/zinc/82/50/13/1417825013.db2.gz JPASRJBUMBFQBR-GDBMZVCRSA-N 0 0 391.468 3.289 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000150872262 1417825101 /nfs/dbraw/zinc/82/51/01/1417825101.db2.gz HWBOIIAULDGUKQ-MGPLVRAMSA-N 0 0 391.405 3.475 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@@H](C)O[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000150872298 1417825126 /nfs/dbraw/zinc/82/51/26/1417825126.db2.gz HWBOIIAULDGUKQ-QLJPJBMISA-N 0 0 391.405 3.475 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000150873601 1417825368 /nfs/dbraw/zinc/82/53/68/1417825368.db2.gz LEZVWEOQZKXAKI-QWHCGFSZSA-N 0 0 395.431 3.499 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000150873689 1417825521 /nfs/dbraw/zinc/82/55/21/1417825521.db2.gz LEZVWEOQZKXAKI-OLZOCXBDSA-N 0 0 395.431 3.499 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N(C)C[C@H](O)C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000150887281 1417828135 /nfs/dbraw/zinc/82/81/35/1417828135.db2.gz YBHLJBLBFUAGCC-YJYMSZOUSA-N 0 0 384.436 3.006 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1C(=O)N1CCC2(CCCC2)CC1 ZINC000150892278 1417829282 /nfs/dbraw/zinc/82/92/82/1417829282.db2.gz PQAGJIHXGMSYOG-AWEZNQCLSA-N 0 0 391.493 3.444 20 5 GGBDRN CC(C)Sc1ccc([C@@H](C)NC(=O)NCCn2cc([N+](=O)[O-])cn2)cc1 ZINC000150902400 1417831249 /nfs/dbraw/zinc/83/12/49/1417831249.db2.gz SVQNXICNOXBKGJ-CYBMUJFWSA-N 0 0 377.470 3.352 20 5 GGBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)CCC(=O)OC(C)(C)C ZINC000150907135 1417832532 /nfs/dbraw/zinc/83/25/32/1417832532.db2.gz YONGZDGCNOBRDU-LLVKDONJSA-N 0 0 385.848 3.239 20 5 GGBDRN O=C(Nc1ccn(CCc2ccncc2)n1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000150913457 1417833952 /nfs/dbraw/zinc/83/39/52/1417833952.db2.gz ZLGMIIHJBSMCNS-UHFFFAOYSA-N 0 0 392.419 3.019 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCCc1ccccc1OC(F)(F)F ZINC000150942869 1417840583 /nfs/dbraw/zinc/84/05/83/1417840583.db2.gz AZFPZZCFFNTVQW-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CCC(=O)OC(C)(C)C ZINC000150942302 1417840729 /nfs/dbraw/zinc/84/07/29/1417840729.db2.gz ZJMIRILEDZLTCL-GFCCVEGCSA-N 0 0 376.413 3.369 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NCc1ccccc1Sc1ccccc1 ZINC000150943577 1417841063 /nfs/dbraw/zinc/84/10/63/1417841063.db2.gz GASHCPUDIMFNBS-UHFFFAOYSA-N 0 0 397.460 3.442 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1F ZINC000150948242 1417841875 /nfs/dbraw/zinc/84/18/75/1417841875.db2.gz CKWHVNRKIJUIMQ-SANMLTNESA-N 0 0 377.397 3.062 20 5 GGBDRN CC[C@@H](c1ccc(F)cc1F)S(=O)(=O)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000150956592 1417843410 /nfs/dbraw/zinc/84/34/10/1417843410.db2.gz WXDQMKQXHHUJGD-INIZCTEOSA-N 0 0 398.387 3.038 20 5 GGBDRN Cc1nn(CCC(=O)N(c2cccc(F)c2)C2CCOCC2)c(C)c1[N+](=O)[O-] ZINC000150971823 1417846279 /nfs/dbraw/zinc/84/62/79/1417846279.db2.gz LNFHOFOIRDNOPY-UHFFFAOYSA-N 0 0 390.415 3.150 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCc1nnc(-c2ccccc2)s1 ZINC000150976901 1417847362 /nfs/dbraw/zinc/84/73/62/1417847362.db2.gz CNJSMPMMPPUIGP-UHFFFAOYSA-N 0 0 383.433 3.232 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C1CC1 ZINC000150983900 1417849069 /nfs/dbraw/zinc/84/90/69/1417849069.db2.gz DOPVZOKZAMZPFQ-CQSZACIVSA-N 0 0 383.832 3.281 20 5 GGBDRN Cn1cc(C(=O)Nc2ccc3c(c2)NC(=O)CC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000151027144 1417858163 /nfs/dbraw/zinc/85/81/63/1417858163.db2.gz YMXSXHNVVZMTFE-UHFFFAOYSA-N 0 0 391.387 3.132 20 5 GGBDRN CCNc1ccc(C(=O)NCc2nnc(-c3ccccc3)s2)cc1[N+](=O)[O-] ZINC000151039899 1417860444 /nfs/dbraw/zinc/86/04/44/1417860444.db2.gz ITYICENPNDULOM-UHFFFAOYSA-N 0 0 383.433 3.475 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(COc3ccc([N+](=O)[O-])c(C)c3)nc2c1 ZINC000151042178 1417860985 /nfs/dbraw/zinc/86/09/85/1417860985.db2.gz GSKJUVJFSYNIJX-UHFFFAOYSA-N 0 0 376.390 3.417 20 5 GGBDRN COCCCOc1cc(C)ccc1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000151046084 1417861507 /nfs/dbraw/zinc/86/15/07/1417861507.db2.gz JCCOIVJYYLXFMX-UHFFFAOYSA-N 0 0 376.384 3.388 20 5 GGBDRN CC(C)CCC1CCN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1 ZINC000151072336 1417866845 /nfs/dbraw/zinc/86/68/45/1417866845.db2.gz JQQBMUMIKDEJAB-UHFFFAOYSA-N 0 0 375.425 3.178 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1C(=O)OCc1ccccc1 ZINC000151074900 1417867430 /nfs/dbraw/zinc/86/74/30/1417867430.db2.gz QEVFZAFIUZGIET-IBGZPJMESA-N 0 0 382.416 3.262 20 5 GGBDRN C[C@](O)(CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccsc1 ZINC000151078829 1417868148 /nfs/dbraw/zinc/86/81/48/1417868148.db2.gz HYOCDNIVYADDCI-HNNXBMFYSA-N 0 0 387.364 3.287 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NCC1(c2cccs2)CCCCC1 ZINC000151083089 1417868973 /nfs/dbraw/zinc/86/89/73/1417868973.db2.gz AKHRISTVSJRIKY-UHFFFAOYSA-N 0 0 377.470 3.054 20 5 GGBDRN CN(C)C(=O)c1cc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)ccc1F ZINC000151085593 1417869523 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389.456 3.061 20 5 GGBDRN O=C(C[C@@H]1COCCN1C(=O)CCc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000152012225 1418120231 /nfs/dbraw/zinc/12/02/31/1418120231.db2.gz DAWMSWRMXFMJGP-MRXNPFEDSA-N 0 0 388.445 3.089 20 5 GGBDRN C[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](O)Cc1ccccc1 ZINC000152019442 1418122007 /nfs/dbraw/zinc/12/20/07/1418122007.db2.gz VCALBOBTLKIYLN-UGSOOPFHSA-N 0 0 397.456 3.440 20 5 GGBDRN O=C(NCCc1csc(-c2ccccc2)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000152026707 1418124590 /nfs/dbraw/zinc/12/45/90/1418124590.db2.gz GXBSJUNGYMSSIK-UHFFFAOYSA-N 0 0 396.428 3.016 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCN(C2CCCCC2)C1=O ZINC000152029749 1418125437 /nfs/dbraw/zinc/12/54/37/1418125437.db2.gz CWCMZACUTMEMGD-HNNXBMFYSA-N 0 0 380.832 3.303 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCc2c3ccccc3[nH]c2C1 ZINC000178990107 1429235718 /nfs/dbraw/zinc/23/57/18/1429235718.db2.gz GRCCVEUHCQCWCM-UHFFFAOYSA-N 0 0 387.399 3.460 20 5 GGBDRN 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DRSNHNHFCIWTRV-UHFFFAOYSA-N 0 0 392.481 3.399 20 5 GGBDRN Cc1nsc(N2CCCN(C(=O)c3c(C)cc(C)c([N+](=O)[O-])c3C)CC2)n1 ZINC000179649389 1429489340 /nfs/dbraw/zinc/48/93/40/1429489340.db2.gz ZSCMAIKZJPBPMG-UHFFFAOYSA-N 0 0 389.481 3.032 20 5 GGBDRN Cc1nccc(-c2cccc(NS(=O)(=O)CCc3ccccc3[N+](=O)[O-])c2)n1 ZINC000179654740 1429492481 /nfs/dbraw/zinc/49/24/81/1429492481.db2.gz PZRZMKGCOLHCAV-UHFFFAOYSA-N 0 0 398.444 3.345 20 5 GGBDRN C[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(OCC(=O)NC2CC2)cc1 ZINC000179655711 1429492593 /nfs/dbraw/zinc/49/25/93/1429492593.db2.gz JXTDGXNZYYLVMW-ZDUSSCGKSA-N 0 0 387.411 3.242 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(NC(=O)CN(C)C)cc1 ZINC000179691342 1429509157 /nfs/dbraw/zinc/50/91/57/1429509157.db2.gz DBUPLMDBVRJZOF-UHFFFAOYSA-N 0 0 384.436 3.272 20 5 GGBDRN O=C(C[C@@H](O)c1ccc(Cl)cc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000179697972 1429511758 /nfs/dbraw/zinc/51/17/58/1429511758.db2.gz LWMCARYTMOPEFU-GOSISDBHSA-N 0 0 389.839 3.021 20 5 GGBDRN O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CC[C@@H](CO)C1 ZINC000179698839 1429512046 /nfs/dbraw/zinc/51/20/46/1429512046.db2.gz JEIJTGPOUBBVMK-CYBMUJFWSA-N 0 0 389.839 3.315 20 5 GGBDRN CC[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1)N1CCCC1=O ZINC000179725295 1429524066 /nfs/dbraw/zinc/52/40/66/1429524066.db2.gz PTLQIGKVPZRJOH-AWEZNQCLSA-N 0 0 388.449 3.366 20 5 GGBDRN Cc1ccn(C)c(=O)c1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000152315423 1422070529 /nfs/dbraw/zinc/07/05/29/1422070529.db2.gz BEZVFAWAYYQWEI-UHFFFAOYSA-N 0 0 392.415 3.466 20 5 GGBDRN CC(C)(CO)[C@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000152318987 1422070966 /nfs/dbraw/zinc/07/09/66/1422070966.db2.gz JMTAJZBGYBPAHE-QGZVFWFLSA-N 0 0 385.464 3.315 20 5 GGBDRN CN(CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1[N+](=O)[O-] ZINC000152328138 1422073584 /nfs/dbraw/zinc/07/35/84/1422073584.db2.gz JYKSQHVHZZFCRK-UHFFFAOYSA-N 0 0 384.392 3.130 20 5 GGBDRN O=C(CCNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)Nc1ccccc1 ZINC000152329312 1422074435 /nfs/dbraw/zinc/07/44/35/1422074435.db2.gz WRPDWCBTONIMIG-UHFFFAOYSA-N 0 0 382.420 3.298 20 5 GGBDRN O=C(c1cc2c([nH]c1=O)CCCCC2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152332996 1422074945 /nfs/dbraw/zinc/07/49/45/1422074945.db2.gz QRNKGZZTCDSJBV-UHFFFAOYSA-N 0 0 381.432 3.357 20 5 GGBDRN CCCN(C(=O)c1ccccc1NC(=O)CCn1cc([N+](=O)[O-])cn1)C(C)C ZINC000152337955 1422076556 /nfs/dbraw/zinc/07/65/56/1422076556.db2.gz AWOSTQUUNAXFJB-UHFFFAOYSA-N 0 0 387.440 3.081 20 5 GGBDRN Cc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1S(C)(=O)=O ZINC000152346217 1422079265 /nfs/dbraw/zinc/07/92/65/1422079265.db2.gz YWVAXNFWCSZZRY-UHFFFAOYSA-N 0 0 388.445 3.112 20 5 GGBDRN CCC(CC)(CCO)CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000152348779 1422079772 /nfs/dbraw/zinc/07/97/72/1422079772.db2.gz PXHWMDNJKNAGGK-UHFFFAOYSA-N 0 0 377.485 3.116 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NOCc2cccnc2)cc1[N+](=O)[O-])c1ccccn1 ZINC000152349854 1422080500 /nfs/dbraw/zinc/08/05/00/1422080500.db2.gz WJSNXSVBRXLRLD-CQSZACIVSA-N 0 0 393.403 3.420 20 5 GGBDRN Cn1c(COc2ccccc2)nnc1Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000152355000 1422081801 /nfs/dbraw/zinc/08/18/01/1422081801.db2.gz BIGSACYMFGACAG-UHFFFAOYSA-N 0 0 387.377 3.362 20 5 GGBDRN Cc1ccnc(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000152372771 1422085809 /nfs/dbraw/zinc/08/58/09/1422085809.db2.gz YTWPZQGUGXWDDC-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1ccccc1C(F)(F)F ZINC000152394464 1422091568 /nfs/dbraw/zinc/09/15/68/1422091568.db2.gz MXZKLOTUCCFTEG-NEPJUHHUSA-N 0 0 397.353 3.084 20 5 GGBDRN C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1ccccc1C(F)(F)F ZINC000152394308 1422091738 /nfs/dbraw/zinc/09/17/38/1422091738.db2.gz MXZKLOTUCCFTEG-VXGBXAGGSA-N 0 0 397.353 3.084 20 5 GGBDRN COc1cc(CCNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)ccc1O ZINC000152405289 1422094483 /nfs/dbraw/zinc/09/44/83/1422094483.db2.gz PQELRZYAQWNHHQ-UHFFFAOYSA-N 0 0 385.420 3.226 20 5 GGBDRN CC[C@@]1(c2ccc(C)cc2)CC(=O)N(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O ZINC000152410399 1422095432 /nfs/dbraw/zinc/09/54/32/1422095432.db2.gz SNNGRDVDLJFZPL-NQIIRXRSSA-N 0 0 382.416 3.044 20 5 GGBDRN Cc1cc(C)n(-c2ccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)cn2)n1 ZINC000152417343 1422097564 /nfs/dbraw/zinc/09/75/64/1422097564.db2.gz SWOCNBSQHXTLLV-UHFFFAOYSA-N 0 0 390.403 3.455 20 5 GGBDRN O=C(CN1C(=O)CCc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152422893 1422099275 /nfs/dbraw/zinc/09/92/75/1422099275.db2.gz NNRFZTJEYOCGJS-UHFFFAOYSA-N 0 0 379.416 3.065 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000152445413 1422105347 /nfs/dbraw/zinc/10/53/47/1422105347.db2.gz OXMZSRNENAJRBN-UHFFFAOYSA-N 0 0 398.463 3.432 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1 ZINC000152468001 1422111551 /nfs/dbraw/zinc/11/15/51/1422111551.db2.gz DBGPSVVKGCRBQQ-UHFFFAOYSA-N 0 0 391.449 3.184 20 5 GGBDRN COc1cc(C)c([C@@H](C)NC(=O)CNc2ccc(F)c([N+](=O)[O-])c2)cc1OC ZINC000152466409 1422111609 /nfs/dbraw/zinc/11/16/09/1422111609.db2.gz GKCMZZBNFWPRIS-GFCCVEGCSA-N 0 0 391.399 3.349 20 5 GGBDRN CC(C)c1nc(CCNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])cs1 ZINC000152473437 1422112793 /nfs/dbraw/zinc/11/27/93/1422112793.db2.gz FMYPSKBAYHNYGH-UHFFFAOYSA-N 0 0 398.510 3.080 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])nc2ccccc21 ZINC000152510381 1422125720 /nfs/dbraw/zinc/12/57/20/1422125720.db2.gz WPIFDTLWWIAPIJ-UHFFFAOYSA-N 0 0 378.388 3.453 20 5 GGBDRN Cc1c(NCC(=O)NCC2(c3ccccc3)CCOCC2)cccc1[N+](=O)[O-] ZINC000152535952 1422134778 /nfs/dbraw/zinc/13/47/78/1422134778.db2.gz GLDBNWVWRUEFHB-UHFFFAOYSA-N 0 0 383.448 3.180 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cccnc1-c1ccccc1 ZINC000152551387 1422140564 /nfs/dbraw/zinc/14/05/64/1422140564.db2.gz UTGQTCIKPWDOQE-UHFFFAOYSA-N 0 0 390.355 3.203 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2NC1=O ZINC000152573977 1422148690 /nfs/dbraw/zinc/14/86/90/1422148690.db2.gz JQCCDHUPDDIPJJ-ZDUSSCGKSA-N 0 0 391.387 3.016 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1c(C)nn(CC(F)(F)F)c1C ZINC000152572128 1422148818 /nfs/dbraw/zinc/14/88/18/1422148818.db2.gz WHYLZJXAGJYMBJ-UHFFFAOYSA-N 0 0 386.330 3.160 20 5 GGBDRN CCOc1cc(C(=O)NC[C@@H](C)c2c(C)noc2C)c([N+](=O)[O-])cc1OC ZINC000152573367 1422148860 /nfs/dbraw/zinc/14/88/60/1422148860.db2.gz DWRQTEMVKYESCR-SNVBAGLBSA-N 0 0 377.397 3.140 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCOC[C@H]1C[C@H](O)c1cccs1 ZINC000152581069 1422152157 /nfs/dbraw/zinc/15/21/57/1422152157.db2.gz IEBHHTJNCSRZBY-DOMZBBRYSA-N 0 0 396.852 3.274 20 5 GGBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c(=O)n(-c2ccccc2)n1C ZINC000152604840 1422160936 /nfs/dbraw/zinc/16/09/36/1422160936.db2.gz XBEHDPSNZPYAKC-UHFFFAOYSA-N 0 0 386.795 3.298 20 5 GGBDRN O=C(NC[C@H](c1cccs1)N1CCOCC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152610829 1422163871 /nfs/dbraw/zinc/16/38/71/1422163871.db2.gz CYBSTZDQTOAWRD-OAHLLOKOSA-N 0 0 395.868 3.113 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)c3c(C)cc(C)c([N+](=O)[O-])c3C)CC2)nc(C)n1 ZINC000179746101 1429534606 /nfs/dbraw/zinc/53/46/06/1429534606.db2.gz NEXLKRWWGDBZTO-UHFFFAOYSA-N 0 0 397.479 3.326 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@]2(CCN(C(=O)c3ccccc3[N+](=O)[O-])C2)C1 ZINC000152624669 1422174816 /nfs/dbraw/zinc/17/48/16/1422174816.db2.gz FXEUJOMUTOKCKR-IBGZPJMESA-N 0 0 375.425 3.068 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000152625359 1422175692 /nfs/dbraw/zinc/17/56/92/1422175692.db2.gz DCJKBEZNFBIBSR-UHFFFAOYSA-N 0 0 384.779 3.465 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2ccc(Br)nc2)c1C ZINC000152633926 1422179848 /nfs/dbraw/zinc/17/98/48/1422179848.db2.gz NEFSAUAZPSXAPO-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000152640741 1422183271 /nfs/dbraw/zinc/18/32/71/1422183271.db2.gz REQHAFKYWHSEDG-LJQANCHMSA-N 0 0 382.395 3.306 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCC(CCC(C)C)CC2)cc1[N+](=O)[O-] ZINC000152640643 1422183410 /nfs/dbraw/zinc/18/34/10/1422183410.db2.gz LBIFXDOVKPNDJP-UHFFFAOYSA-N 0 0 391.468 3.008 20 5 GGBDRN O=C(Nc1cc(-n2cnnn2)ccc1Cl)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152644725 1422185587 /nfs/dbraw/zinc/18/55/87/1422185587.db2.gz ICECIEUNKJNHBW-UHFFFAOYSA-N 0 0 379.163 3.130 20 5 GGBDRN O=C(N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1[nH]ncc1[N+](=O)[O-] ZINC000152647374 1422186585 /nfs/dbraw/zinc/18/65/85/1422186585.db2.gz SSXMRKVOTZJPPZ-LLVKDONJSA-N 0 0 387.396 3.388 20 5 GGBDRN COc1ccc2c(c1)CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H](c1ccccc1)C2 ZINC000179749619 1429536669 /nfs/dbraw/zinc/53/66/69/1429536669.db2.gz MMPMVAGOKTUQTM-SFHVURJKSA-N 0 0 392.415 3.277 20 5 GGBDRN COc1ccc2c(c1)CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H](c1ccccc1)C2 ZINC000179749601 1429536836 /nfs/dbraw/zinc/53/68/36/1429536836.db2.gz MMPMVAGOKTUQTM-GOSISDBHSA-N 0 0 392.415 3.277 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)CN2CCc3cc([N+](=O)[O-])ccc32)cc1OC ZINC000152667824 1422201119 /nfs/dbraw/zinc/20/11/19/1422201119.db2.gz RLSRGQVHCKRFQL-AWEZNQCLSA-N 0 0 399.447 3.242 20 5 GGBDRN CC1(C)CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)C[C@@H]1c1ccccc1 ZINC000152688809 1422211024 /nfs/dbraw/zinc/21/10/24/1422211024.db2.gz ALYUDZCXRDNYHX-MRXNPFEDSA-N 0 0 395.415 3.155 20 5 GGBDRN COc1ccccc1[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000152735319 1422230120 /nfs/dbraw/zinc/23/01/20/1422230120.db2.gz DDGAGQZBSMOCTO-SFHVURJKSA-N 0 0 388.401 3.264 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(C2CC2)S(=O)(=O)c2c(F)cc(F)cc2F)c1 ZINC000152741999 1422232740 /nfs/dbraw/zinc/23/27/40/1422232740.db2.gz DBSQGFPTMAJNIA-UHFFFAOYSA-N 0 0 386.351 3.365 20 5 GGBDRN COc1ccc(S(=O)(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1F ZINC000152751579 1422236659 /nfs/dbraw/zinc/23/66/59/1422236659.db2.gz BALANDINLZDBSH-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(C[C@@H](O)c3ccccc3Br)n2)cc1 ZINC000152766000 1422241058 /nfs/dbraw/zinc/24/10/58/1422241058.db2.gz JRBNGOUHACLYTQ-OAHLLOKOSA-N 0 0 389.209 3.349 20 5 GGBDRN Cc1cc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)ccc1OC(C)C ZINC000152793442 1422250231 /nfs/dbraw/zinc/25/02/31/1422250231.db2.gz MJBNYSLYOQHWBZ-UHFFFAOYSA-N 0 0 385.376 3.237 20 5 GGBDRN CC(C)[C@H](C(=O)OCc1ccc([N+](=O)[O-])cc1Br)N1CCCC1=O ZINC000152792751 1422250521 /nfs/dbraw/zinc/25/05/21/1422250521.db2.gz QBDQYJIPSBKDTD-OAHLLOKOSA-N 0 0 399.241 3.048 20 5 GGBDRN CCC(=O)N1CCC[C@@H](C(=O)OCc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000152794559 1422250696 /nfs/dbraw/zinc/25/06/96/1422250696.db2.gz HTJQSMORGINFKI-LLVKDONJSA-N 0 0 399.241 3.049 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)CC1(C)OCCO1 ZINC000152803222 1422254607 /nfs/dbraw/zinc/25/46/07/1422254607.db2.gz AZEUTBMJZGOAAJ-OAHLLOKOSA-N 0 0 379.457 3.304 20 5 GGBDRN CN(CCOCc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000152828040 1422262914 /nfs/dbraw/zinc/26/29/14/1422262914.db2.gz DQEVRXMLCHDPIR-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CN(C(N)=O)c1ccc(OC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000152833368 1422265444 /nfs/dbraw/zinc/26/54/44/1422265444.db2.gz QVRMXXZAVIYKRL-UHFFFAOYSA-N 0 0 394.181 3.091 20 5 GGBDRN C[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)OC(C)(C)C ZINC000152837804 1422266077 /nfs/dbraw/zinc/26/60/77/1422266077.db2.gz SBFFMSOAIZISMD-SNVBAGLBSA-N 0 0 377.422 3.178 20 5 GGBDRN CCOc1ccc([C@H](C)NCc2cccnc2N2CCOCC2)cc1[N+](=O)[O-] ZINC000152840280 1422266783 /nfs/dbraw/zinc/26/67/83/1422266783.db2.gz POIPFZCDDFYIMV-HNNXBMFYSA-N 0 0 386.452 3.076 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)COc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 ZINC000152865937 1422275834 /nfs/dbraw/zinc/27/58/34/1422275834.db2.gz XXDGYNDTPUJCJE-LLVKDONJSA-N 0 0 399.247 3.269 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCOC2(C1)CCCCCC2 ZINC000152887697 1422283958 /nfs/dbraw/zinc/28/39/58/1422283958.db2.gz HFARFNQAXRLKDR-HNNXBMFYSA-N 0 0 391.468 3.356 20 5 GGBDRN Cc1cc(F)ccc1-n1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)nn1 ZINC000179760062 1429544816 /nfs/dbraw/zinc/54/48/16/1429544816.db2.gz BDJZIPCCMHKLFZ-UHFFFAOYSA-N 0 0 395.394 3.428 20 5 GGBDRN O=C(N[C@@H](CCCO)c1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000152900031 1422288760 /nfs/dbraw/zinc/28/87/60/1422288760.db2.gz CXBYHHQFKAFELH-SFHVURJKSA-N 0 0 383.448 3.439 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cccc(N2CCCS2(=O)=O)c1 ZINC000152926756 1422298561 /nfs/dbraw/zinc/29/85/61/1422298561.db2.gz CWXICCOHAJRFPQ-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@@H](O)COc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000152925532 1422298698 /nfs/dbraw/zinc/29/86/98/1422298698.db2.gz YAYNNDVYYVQRSO-MRXNPFEDSA-N 0 0 377.368 3.074 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(CN2C(=O)CCC2=O)cc1 ZINC000152936570 1422301662 /nfs/dbraw/zinc/30/16/62/1422301662.db2.gz ZXTKMOXSCRJYDH-UHFFFAOYSA-N 0 0 381.388 3.113 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(N2CCCS2(=O)=O)cc1 ZINC000152943660 1422303494 /nfs/dbraw/zinc/30/34/94/1422303494.db2.gz UFORVRMQCVSRRX-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc1 ZINC000152947414 1422304368 /nfs/dbraw/zinc/30/43/68/1422304368.db2.gz XLKRORIPPDNQRN-OALUTQOASA-N 0 0 390.461 3.152 20 5 GGBDRN CCOc1ccc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1OC ZINC000152955684 1422307265 /nfs/dbraw/zinc/30/72/65/1422307265.db2.gz HGVPQKHKHFLCAP-UHFFFAOYSA-N 0 0 385.420 3.270 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CSc1nnnn1C1CCCC1 ZINC000152954739 1422307311 /nfs/dbraw/zinc/30/73/11/1422307311.db2.gz WDOWRKPSDWGWLF-UHFFFAOYSA-N 0 0 376.442 3.044 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2csc([C@H]3CCCO3)n2)c([N+](=O)[O-])c1 ZINC000152961112 1422308681 /nfs/dbraw/zinc/30/86/81/1422308681.db2.gz RHOHKIKNIUJIMO-MRXNPFEDSA-N 0 0 390.465 3.443 20 5 GGBDRN CCc1nc2c(s1)[C@H](N(C)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])CCC2 ZINC000152981920 1422315962 /nfs/dbraw/zinc/31/59/62/1422315962.db2.gz HCGAGWGCGHJKAA-GFCCVEGCSA-N 0 0 399.469 3.451 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1c1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] ZINC000152984662 1422317191 /nfs/dbraw/zinc/31/71/91/1422317191.db2.gz PSIPGNHZIXKYNN-ZBFHGGJFSA-N 0 0 389.477 3.228 20 5 GGBDRN CN1CCO[C@H]([C@H](NCc2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc2)C1 ZINC000179764682 1429547971 /nfs/dbraw/zinc/54/79/71/1429547971.db2.gz UPQXSZSXKCOZSH-RBUKOAKNSA-N 0 0 375.856 3.410 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000153010715 1422325696 /nfs/dbraw/zinc/32/56/96/1422325696.db2.gz DKKNZDPJIBSYCQ-HNNXBMFYSA-N 0 0 394.431 3.215 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000153013113 1422325936 /nfs/dbraw/zinc/32/59/36/1422325936.db2.gz ZLULAYZFUNMNJX-QMMMGPOBSA-N 0 0 376.369 3.258 20 5 GGBDRN O=C(N[C@H](CCCO)c1ccccc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153019520 1422328771 /nfs/dbraw/zinc/32/87/71/1422328771.db2.gz SZIVLHNGYBZNHK-GOSISDBHSA-N 0 0 380.404 3.024 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-])CCC2 ZINC000153020932 1422330024 /nfs/dbraw/zinc/33/00/24/1422330024.db2.gz NYWJGDDSQTVNHG-LBPRGKRZSA-N 0 0 399.469 3.451 20 5 GGBDRN O=C(N[C@H](CCCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000153035947 1422334916 /nfs/dbraw/zinc/33/49/16/1422334916.db2.gz GXCCCIYWIJJROX-LJQANCHMSA-N 0 0 383.448 3.439 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1 ZINC000153036727 1422335291 /nfs/dbraw/zinc/33/52/91/1422335291.db2.gz JLJMQBGYKQHQJA-BHIYHBOVSA-N 0 0 399.491 3.486 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(N2CCN(c3cc(C)ccn3)CC2)cc1Cl ZINC000153055006 1422341060 /nfs/dbraw/zinc/34/10/60/1422341060.db2.gz QSAZPLFJLXKTMD-UHFFFAOYSA-N 0 0 390.827 3.065 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C1 ZINC000153058870 1422342754 /nfs/dbraw/zinc/34/27/54/1422342754.db2.gz LVZFGEQRATXIPY-ZDUSSCGKSA-N 0 0 385.376 3.450 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nncn1C1CC1 ZINC000153073485 1422347011 /nfs/dbraw/zinc/34/70/11/1422347011.db2.gz DNEBKHCRKGPLEC-UHFFFAOYSA-N 0 0 375.454 3.199 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2CC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000153099890 1422356003 /nfs/dbraw/zinc/35/60/03/1422356003.db2.gz KASVJOWWWRLDHP-QVKFZJNVSA-N 0 0 396.447 3.416 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000153099752 1422356421 /nfs/dbraw/zinc/35/64/21/1422356421.db2.gz KASVJOWWWRLDHP-YCRPNKLZSA-N 0 0 396.447 3.416 20 5 GGBDRN CCS[C@@H]1CCCCN(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C1 ZINC000153107543 1422358782 /nfs/dbraw/zinc/35/87/82/1422358782.db2.gz GQXFQVGPWVLDQV-QGZVFWFLSA-N 0 0 388.493 3.384 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000153132249 1422367037 /nfs/dbraw/zinc/36/70/37/1422367037.db2.gz XMMPCBLSXRHIJE-HNNXBMFYSA-N 0 0 394.431 3.215 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000153141339 1422369963 /nfs/dbraw/zinc/36/99/63/1422369963.db2.gz WBKRWMOJAONDBN-OAHLLOKOSA-N 0 0 392.415 3.419 20 5 GGBDRN O=C(NOCc1ccc(C(F)(F)F)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000153162035 1422377158 /nfs/dbraw/zinc/37/71/58/1422377158.db2.gz HUPMDOWHHPOTGR-UHFFFAOYSA-N 0 0 385.254 3.383 20 5 GGBDRN CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1 ZINC000153185249 1422384920 /nfs/dbraw/zinc/38/49/20/1422384920.db2.gz VLEVNQPTVQGUAH-UHFFFAOYSA-N 0 0 379.804 3.212 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2cc(NS(=O)(=O)Cc3ccc(F)cc3)[nH]n2)c1 ZINC000153189032 1422386399 /nfs/dbraw/zinc/38/63/99/1422386399.db2.gz LAXZBANOFILCBH-UHFFFAOYSA-N 0 0 376.369 3.066 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000153194303 1422388083 /nfs/dbraw/zinc/38/80/83/1422388083.db2.gz NLCYGEJYWUXBMJ-OAHLLOKOSA-N 0 0 392.415 3.419 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2F)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000153197493 1422390155 /nfs/dbraw/zinc/39/01/55/1422390155.db2.gz OONUTEHSBFQJED-CYBMUJFWSA-N 0 0 391.786 3.313 20 5 GGBDRN Cc1nn(C)c2nc(C3CC3)cc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c12 ZINC000153205155 1422392163 /nfs/dbraw/zinc/39/21/63/1422392163.db2.gz WNEGAZCWWSEXKU-UHFFFAOYSA-N 0 0 391.391 3.191 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000153253149 1422420427 /nfs/dbraw/zinc/42/04/27/1422420427.db2.gz QVVXBDGYOWBTSI-QGZVFWFLSA-N 0 0 397.479 3.252 20 5 GGBDRN CNC(=O)c1cc(Cl)ccc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000153254869 1422422432 /nfs/dbraw/zinc/42/24/32/1422422432.db2.gz RSHOXQCPHCEEMG-UHFFFAOYSA-N 0 0 386.795 3.270 20 5 GGBDRN O=C(CN(Cc1cccc([N+](=O)[O-])c1)C1CC1)NCc1cc(F)cc(F)c1 ZINC000153258377 1422423097 /nfs/dbraw/zinc/42/30/97/1422423097.db2.gz GDXOFKHQPVQUJS-UHFFFAOYSA-N 0 0 375.375 3.154 20 5 GGBDRN Cc1cc(C(=O)N2CCN(Cc3ccc(Cl)cc3)C(=O)C2)cc([N+](=O)[O-])c1 ZINC000153266141 1422428445 /nfs/dbraw/zinc/42/84/45/1422428445.db2.gz JOIAILPXYBKUQY-UHFFFAOYSA-N 0 0 387.823 3.041 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 ZINC000153274512 1422432312 /nfs/dbraw/zinc/43/23/12/1422432312.db2.gz HZQUMQMCWURTSK-UHFFFAOYSA-N 0 0 387.823 3.041 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)Nc2cccc(CN3CCOCC3)n2)cc1[N+](=O)[O-] ZINC000179785395 1429562088 /nfs/dbraw/zinc/56/20/88/1429562088.db2.gz UNFSNVSCBRRETB-UHFFFAOYSA-N 0 0 398.463 3.372 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)c1[N+](=O)[O-] ZINC000153280638 1422436190 /nfs/dbraw/zinc/43/61/90/1422436190.db2.gz PCUYOURSGHHIDB-OAHLLOKOSA-N 0 0 389.358 3.107 20 5 GGBDRN O=C(C[C@@H]1COCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000153279340 1422436445 /nfs/dbraw/zinc/43/64/45/1422436445.db2.gz PFLHHTGSUIPJAE-QGZVFWFLSA-N 0 0 388.807 3.362 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000153284375 1422439145 /nfs/dbraw/zinc/43/91/45/1422439145.db2.gz MWPLSKWSGXAUJD-RTFZILSDSA-N 0 0 388.467 3.229 20 5 GGBDRN CCc1cc(=O)oc2cc(OC[C@@H](O)COc3cccc([N+](=O)[O-])c3)ccc12 ZINC000153284671 1422439802 /nfs/dbraw/zinc/43/98/02/1422439802.db2.gz KAZBKHLGKNSEMB-HNNXBMFYSA-N 0 0 385.372 3.082 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153289019 1422443907 /nfs/dbraw/zinc/44/39/07/1422443907.db2.gz SEIQGDUJHHFIPV-UHFFFAOYSA-N 0 0 382.420 3.156 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000153289010 1422444291 /nfs/dbraw/zinc/44/42/91/1422444291.db2.gz BDDTYYQGBDVZKH-UHFFFAOYSA-N 0 0 380.154 3.196 20 5 GGBDRN Cn1cnnc1Sc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000153290778 1422444949 /nfs/dbraw/zinc/44/49/49/1422444949.db2.gz UWFQLWGFRALPJY-UHFFFAOYSA-N 0 0 383.433 3.446 20 5 GGBDRN COC(=O)c1ccccc1N(C)C(=O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153295799 1422447175 /nfs/dbraw/zinc/44/71/75/1422447175.db2.gz NLEVSTBKNLDAAN-UHFFFAOYSA-N 0 0 397.431 3.009 20 5 GGBDRN CCC(=O)N1CC[C@H](NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000153295997 1422450076 /nfs/dbraw/zinc/45/00/76/1422450076.db2.gz UKMGNAZXXIJBJG-INIZCTEOSA-N 0 0 382.420 3.079 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000153301823 1422452325 /nfs/dbraw/zinc/45/23/25/1422452325.db2.gz GWLYCHNTPVDOEO-KRWDZBQOSA-N 0 0 392.358 3.339 20 5 GGBDRN CCOc1cccc(CNC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153328029 1422472560 /nfs/dbraw/zinc/47/25/60/1422472560.db2.gz YRWFPLFLBCTROJ-UHFFFAOYSA-N 0 0 383.448 3.274 20 5 GGBDRN CC(=O)c1cccc(OC[C@H](O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153331742 1422474910 /nfs/dbraw/zinc/47/49/10/1422474910.db2.gz RMUJPKQLHUYBJC-HXUWFJFHSA-N 0 0 384.432 3.202 20 5 GGBDRN CC(=O)N1CCCc2cc(S(=O)(=O)Nc3ccc([N+](=O)[O-])cc3C)ccc21 ZINC000153349161 1422484359 /nfs/dbraw/zinc/48/43/59/1422484359.db2.gz HVIQVTAHNAUSKU-UHFFFAOYSA-N 0 0 389.433 3.003 20 5 GGBDRN O=C(C[C@@H]1COCCN1C(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000153375083 1422503386 /nfs/dbraw/zinc/50/33/86/1422503386.db2.gz BKIDBXLSBRHORP-LJQANCHMSA-N 0 0 382.416 3.028 20 5 GGBDRN CCCCc1cc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)n[nH]1 ZINC000153391556 1422510752 /nfs/dbraw/zinc/51/07/52/1422510752.db2.gz JLQXIMUCZRTAPR-KRWDZBQOSA-N 0 0 399.451 3.212 20 5 GGBDRN COc1ccc(OC)c2c1CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]2O ZINC000153401655 1422515505 /nfs/dbraw/zinc/51/55/05/1422515505.db2.gz DSVLRMIXOLKCTQ-OAHLLOKOSA-N 0 0 378.812 3.315 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000153403617 1422517215 /nfs/dbraw/zinc/51/72/15/1422517215.db2.gz LNPZRKYWDRYYCN-INIZCTEOSA-N 0 0 378.331 3.410 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2cccc(OC(F)F)c2)C1 ZINC000153403703 1422517342 /nfs/dbraw/zinc/51/73/42/1422517342.db2.gz LNPZRKYWDRYYCN-MRXNPFEDSA-N 0 0 378.331 3.410 20 5 GGBDRN O=C(NC1CC1)c1ccc(NCc2cccnc2OCC(F)F)c([N+](=O)[O-])c1 ZINC000153410725 1422521427 /nfs/dbraw/zinc/52/14/27/1422521427.db2.gz GYWLGTJOGZKEAI-UHFFFAOYSA-N 0 0 392.362 3.138 20 5 GGBDRN CCCC(=O)Nc1ccc(Cl)c(NC(=O)Cn2cc([N+](=O)[O-])nc2C)c1 ZINC000153413369 1422522017 /nfs/dbraw/zinc/52/20/17/1422522017.db2.gz AACLOAQOQBEMEA-UHFFFAOYSA-N 0 0 379.804 3.130 20 5 GGBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@H]1CC(=O)c1ccccc1 ZINC000153424768 1422528719 /nfs/dbraw/zinc/52/87/19/1422528719.db2.gz NNTKXAGAGZNLRD-UFUQCMIWSA-N 0 0 380.400 3.108 20 5 GGBDRN COc1cc(C)c([C@H](C)NC(=O)CNc2cc([N+](=O)[O-])ccc2F)cc1OC ZINC000153434436 1422534290 /nfs/dbraw/zinc/53/42/90/1422534290.db2.gz DVMLCQPFIGWBKC-LBPRGKRZSA-N 0 0 391.399 3.349 20 5 GGBDRN C[C@@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1cn(-c2ccccc2)nn1 ZINC000153441363 1422538983 /nfs/dbraw/zinc/53/89/83/1422538983.db2.gz QIVFESLERJRTBJ-CQSZACIVSA-N 0 0 392.419 3.004 20 5 GGBDRN Cc1nc2ccccc2n1CCCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153445490 1422540233 /nfs/dbraw/zinc/54/02/33/1422540233.db2.gz QEBDWLJXWQTQDR-UHFFFAOYSA-N 0 0 393.447 3.411 20 5 GGBDRN C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000153447544 1422541668 /nfs/dbraw/zinc/54/16/68/1422541668.db2.gz GVRXIBUHFUWUIM-LLVKDONJSA-N 0 0 396.852 3.485 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000153451344 1422543933 /nfs/dbraw/zinc/54/39/33/1422543933.db2.gz PANXMXISQUTZHN-OAHLLOKOSA-N 0 0 386.452 3.234 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000153452036 1422544227 /nfs/dbraw/zinc/54/42/27/1422544227.db2.gz RDKGUCLWPJHUJL-HNNXBMFYSA-N 0 0 386.452 3.378 20 5 GGBDRN O=C(NC[C@H](c1ccccc1)N1CCOCC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000153455766 1422546355 /nfs/dbraw/zinc/54/63/55/1422546355.db2.gz GLFGFLCHYYRYEA-GOSISDBHSA-N 0 0 389.839 3.052 20 5 GGBDRN O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000153458916 1422548042 /nfs/dbraw/zinc/54/80/42/1422548042.db2.gz VABBKMQXJCMGBX-UHFFFAOYSA-N 0 0 387.779 3.150 20 5 GGBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1c1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] ZINC000153465721 1422553155 /nfs/dbraw/zinc/55/31/55/1422553155.db2.gz WFBYSLQHIVBYJL-PBHICJAKSA-N 0 0 389.477 3.228 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(c3ccc(F)cc3Cl)CC2)c1 ZINC000153469196 1422554124 /nfs/dbraw/zinc/55/41/24/1422554124.db2.gz LILWZEYXDUPNNB-SFHVURJKSA-N 0 0 379.819 3.243 20 5 GGBDRN Cc1ccc(N2CCC[C@@H](NC(=O)CCc3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000153476682 1422559244 /nfs/dbraw/zinc/55/92/44/1422559244.db2.gz VMKYXEJRFKJUBT-LJQANCHMSA-N 0 0 381.432 3.148 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(Cl)c(F)c1 ZINC000153481556 1422561946 /nfs/dbraw/zinc/56/19/46/1422561946.db2.gz XLIVRCZPCTYXLB-HNNXBMFYSA-N 0 0 380.759 3.340 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1 ZINC000153485223 1422563531 /nfs/dbraw/zinc/56/35/31/1422563531.db2.gz UUYBMZYBBJWAAB-UHFFFAOYSA-N 0 0 393.440 3.308 20 5 GGBDRN COC(=O)[C@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(F)c1 ZINC000153486237 1422564371 /nfs/dbraw/zinc/56/43/71/1422564371.db2.gz ZMVYBYGUXDJHTM-MDGVGCGJSA-N 0 0 392.770 3.431 20 5 GGBDRN COc1ccccc1N1CC[C@@H](NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C1=O ZINC000179792546 1429567946 /nfs/dbraw/zinc/56/79/46/1429567946.db2.gz VTQCLWWMJQZMEP-OAHLLOKOSA-N 0 0 397.431 3.064 20 5 GGBDRN Cc1ccsc1-c1nnc(NC(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)o1 ZINC000153500457 1422573361 /nfs/dbraw/zinc/57/33/61/1422573361.db2.gz NWOFAUMOHIRZSS-UHFFFAOYSA-N 0 0 399.432 3.012 20 5 GGBDRN Cc1c(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)cnn1C1CCOCC1 ZINC000153506394 1422576023 /nfs/dbraw/zinc/57/60/23/1422576023.db2.gz BRPYRDLPJOXVIN-UHFFFAOYSA-N 0 0 396.407 3.094 20 5 GGBDRN O=C(Nc1ccc(Cl)cc1O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000153513242 1422578936 /nfs/dbraw/zinc/57/89/36/1422578936.db2.gz HNXBCTDSRKUTQH-LLVKDONJSA-N 0 0 395.824 3.259 20 5 GGBDRN O=C(Nc1ccc(Cl)cc1O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000153513167 1422579033 /nfs/dbraw/zinc/57/90/33/1422579033.db2.gz HNXBCTDSRKUTQH-NSHDSACASA-N 0 0 395.824 3.259 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc2oc(C(F)(F)F)nc21 ZINC000153533215 1422590349 /nfs/dbraw/zinc/59/03/49/1422590349.db2.gz JICLUSDVHFXMRX-UHFFFAOYSA-N 0 0 383.286 3.289 20 5 GGBDRN Cc1cc(F)cc(C(=O)N(C)Cc2cc(Br)cn2C)c1[N+](=O)[O-] ZINC000153542200 1422598416 /nfs/dbraw/zinc/59/84/16/1422598416.db2.gz VKOUGBVUFGYKTJ-UHFFFAOYSA-N 0 0 384.205 3.416 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000153553106 1422609533 /nfs/dbraw/zinc/60/95/33/1422609533.db2.gz BIAQSLHNMXPQHK-ZDUSSCGKSA-N 0 0 391.449 3.196 20 5 GGBDRN COc1cccc(OC)c1CC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000153554617 1422609624 /nfs/dbraw/zinc/60/96/24/1422609624.db2.gz HJPXNWRURTVGBX-UHFFFAOYSA-N 0 0 382.376 3.183 20 5 GGBDRN COC(=O)c1ccc2[nH]c3c(c2c1)CN(c1ncc(Cl)cc1[N+](=O)[O-])CC3 ZINC000153569357 1422624120 /nfs/dbraw/zinc/62/41/20/1422624120.db2.gz MRRSJVNIXUTTBK-UHFFFAOYSA-N 0 0 386.795 3.474 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000153581683 1422632487 /nfs/dbraw/zinc/63/24/87/1422632487.db2.gz XPYUKLRIRDYGNG-UHFFFAOYSA-N 0 0 397.382 3.376 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccco1)Cc1cccnc1 ZINC000153597906 1422639264 /nfs/dbraw/zinc/63/92/64/1422639264.db2.gz XKJPADFKCOJCBM-UHFFFAOYSA-N 0 0 377.360 3.302 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])C2)nc1 ZINC000153601883 1422641942 /nfs/dbraw/zinc/64/19/42/1422641942.db2.gz HWBJDTWHURFPJT-LBPRGKRZSA-N 0 0 375.816 3.202 20 5 GGBDRN Cc1c2nnc(C(F)(F)F)n2nc(NCCc2ccc([N+](=O)[O-])cc2)c1C ZINC000153612568 1422648275 /nfs/dbraw/zinc/64/82/75/1422648275.db2.gz PHKVLXBPMZXESA-UHFFFAOYSA-N 0 0 380.330 3.323 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCC[C@@H](c4nnc5n4CCC5)C3)co2)cc1 ZINC000153613026 1422649290 /nfs/dbraw/zinc/64/92/90/1422649290.db2.gz QQBJTFRALHDWEC-OAHLLOKOSA-N 0 0 394.435 3.167 20 5 GGBDRN O=C(Nc1cccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c1)[C@H]1CCCO1 ZINC000153619354 1422653052 /nfs/dbraw/zinc/65/30/52/1422653052.db2.gz YTSUPXSOSAFFLM-OAHLLOKOSA-N 0 0 376.800 3.373 20 5 GGBDRN C[C@@H]1CN(Cc2cccc(CNc3ncc(Cl)cc3[N+](=O)[O-])c2)CCO1 ZINC000153619476 1422653192 /nfs/dbraw/zinc/65/31/92/1422653192.db2.gz DZCYPIHMXKYZOU-CYBMUJFWSA-N 0 0 376.844 3.476 20 5 GGBDRN O=C(Nc1cccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c1)[C@@H]1CCCO1 ZINC000153619270 1422653240 /nfs/dbraw/zinc/65/32/40/1422653240.db2.gz YTSUPXSOSAFFLM-HNNXBMFYSA-N 0 0 376.800 3.373 20 5 GGBDRN CCN(Cc1ccc2c(c1)OCO2)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000153620778 1422654352 /nfs/dbraw/zinc/65/43/52/1422654352.db2.gz GCQLMDJNXVGVQB-AWEZNQCLSA-N 0 0 385.420 3.481 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(c2ncccc2F)C1 ZINC000153623356 1422655820 /nfs/dbraw/zinc/65/58/20/1422655820.db2.gz KFASZPSJNFZYOV-OLZOCXBDSA-N 0 0 390.440 3.005 20 5 GGBDRN Cc1c(C)n(C[C@@H]2CCCO2)c2ncnc(NC(=O)c3cccc([N+](=O)[O-])c3)c12 ZINC000153626391 1422656805 /nfs/dbraw/zinc/65/68/05/1422656805.db2.gz BUXLXCKWHVUGIU-INIZCTEOSA-N 0 0 395.419 3.388 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)nc(C)n1 ZINC000153629167 1422659486 /nfs/dbraw/zinc/65/94/86/1422659486.db2.gz SDFBIBLQZPESQL-UHFFFAOYSA-N 0 0 384.440 3.101 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H](c1cccc(F)c1)N1CCOCC1 ZINC000153638726 1422665947 /nfs/dbraw/zinc/66/59/47/1422665947.db2.gz KBLGWFYFMWFWNS-INIZCTEOSA-N 0 0 380.807 3.268 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cnc1NC[C@H](c1cccc(F)c1)N1CCOCC1 ZINC000153638623 1422667091 /nfs/dbraw/zinc/66/70/91/1422667091.db2.gz KBLGWFYFMWFWNS-MRXNPFEDSA-N 0 0 380.807 3.268 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000153645612 1422674361 /nfs/dbraw/zinc/67/43/61/1422674361.db2.gz RULRYCMUZHSGBW-UHFFFAOYSA-N 0 0 391.792 3.310 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccc1S(C)(=O)=O ZINC000153654136 1422681131 /nfs/dbraw/zinc/68/11/31/1422681131.db2.gz CVTNIGDCJXJIOI-UHFFFAOYSA-N 0 0 389.433 3.133 20 5 GGBDRN CN(CC1(O)CCCC1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000153653915 1422682505 /nfs/dbraw/zinc/68/25/05/1422682505.db2.gz KZJQAHFXHCWSSH-UHFFFAOYSA-N 0 0 391.649 3.388 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCc1csc(-c2ccco2)n1 ZINC000153663346 1422690089 /nfs/dbraw/zinc/69/00/89/1422690089.db2.gz HSGXGTTVLYDTSD-UHFFFAOYSA-N 0 0 393.446 3.407 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)CC2(O)CCCC2)CC1 ZINC000153666084 1422690796 /nfs/dbraw/zinc/69/07/96/1422690796.db2.gz VDFVQSDXYOPNKX-UHFFFAOYSA-N 0 0 375.469 3.208 20 5 GGBDRN CC(C)Cn1ncc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1C1CC1 ZINC000153669669 1422693920 /nfs/dbraw/zinc/69/39/20/1422693920.db2.gz CYOXUYRUAHKEFK-UHFFFAOYSA-N 0 0 397.479 3.287 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000153674504 1422697586 /nfs/dbraw/zinc/69/75/86/1422697586.db2.gz HWUPCFDOCGKKHT-VUCTXSBTSA-N 0 0 380.828 3.091 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)c(C)o1 ZINC000153686337 1422702292 /nfs/dbraw/zinc/70/22/92/1422702292.db2.gz USSGLESUYKQMHW-UHFFFAOYSA-N 0 0 378.816 3.252 20 5 GGBDRN CC(C)[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C2CC2)no1 ZINC000179806220 1429579529 /nfs/dbraw/zinc/57/95/29/1429579529.db2.gz UBJNTURTCLZZJO-OAHLLOKOSA-N 0 0 393.831 3.434 20 5 GGBDRN Cc1c(NC(=O)CCN[C@H](c2nc(C3CC3)no2)C(C)C)cccc1[N+](=O)[O-] ZINC000179805537 1429579738 /nfs/dbraw/zinc/57/97/38/1429579738.db2.gz KADCOCSAPWGFKF-KRWDZBQOSA-N 0 0 387.440 3.479 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000153707997 1422713228 /nfs/dbraw/zinc/71/32/28/1422713228.db2.gz GKQRPGKEENFYML-UHFFFAOYSA-N 0 0 385.449 3.386 20 5 GGBDRN C[C@@H]1CN(C[C@H](O)COc2ccc([N+](=O)[O-])cc2-c2cccs2)C[C@@H](C)O1 ZINC000153706508 1422713257 /nfs/dbraw/zinc/71/32/57/1422713257.db2.gz QRQLPUIRGWQHIN-FMKPAKJESA-N 0 0 392.477 3.172 20 5 GGBDRN CC(C)=CCC[C@]1(C)NC(=O)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1=O ZINC000153716872 1422718489 /nfs/dbraw/zinc/71/84/89/1422718489.db2.gz FAUPXOICTGYIEH-IBGZPJMESA-N 0 0 399.407 3.202 20 5 GGBDRN O=C(NC[C@@H]1CCN(c2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153720185 1422720868 /nfs/dbraw/zinc/72/08/68/1422720868.db2.gz VNPQWRSWTXWQOR-INIZCTEOSA-N 0 0 380.448 3.189 20 5 GGBDRN CC(C)=CCC[C@@]1(C)NC(=O)N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1=O ZINC000153732746 1422727862 /nfs/dbraw/zinc/72/78/62/1422727862.db2.gz CMFPRKIWVVIPRS-LJQANCHMSA-N 0 0 399.407 3.202 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000153763104 1422743433 /nfs/dbraw/zinc/74/34/33/1422743433.db2.gz CWHJDPZDMAXXPB-UHFFFAOYSA-N 0 0 399.451 3.163 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCS(=O)(=O)c2ccc(F)cc2)cc1OC(F)F ZINC000153763605 1422743441 /nfs/dbraw/zinc/74/34/41/1422743441.db2.gz MINZOQRBUICPIB-UHFFFAOYSA-N 0 0 390.339 3.221 20 5 GGBDRN O=C(NC1CC1)c1cc(SCCn2cc([N+](=O)[O-])cn2)nc2ccccc21 ZINC000153765610 1422744201 /nfs/dbraw/zinc/74/42/01/1422744201.db2.gz ZYLHSVBYUWOVKG-UHFFFAOYSA-N 0 0 383.433 3.024 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)Cn1ccnc1 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385.157 3.312 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)COc2ccccc2I)c1 ZINC000153824038 1422782066 /nfs/dbraw/zinc/78/20/66/1422782066.db2.gz KHKOIDMDEOQDJO-CYBMUJFWSA-N 0 0 385.157 3.312 20 5 GGBDRN Cc1cc(NC(=O)N2CCOC[C@H]2C[C@H](O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000153827015 1422783817 /nfs/dbraw/zinc/78/38/17/1422783817.db2.gz DMZDLXVXULNIBX-MJGOQNOKSA-N 0 0 385.420 3.260 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N[C@@H](C)C[C@@H](O)c2ccco2)c([N+](=O)[O-])c1 ZINC000153833479 1422787675 /nfs/dbraw/zinc/78/76/75/1422787675.db2.gz KXQCPDMQJYTMBG-WMLDXEAASA-N 0 0 390.440 3.110 20 5 GGBDRN COc1cc(C(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)ccc1[N+](=O)[O-] ZINC000153838297 1422791481 /nfs/dbraw/zinc/79/14/81/1422791481.db2.gz SFNMFRQWCUKWLC-UHFFFAOYSA-N 0 0 385.420 3.239 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1cccc(C[NH+]2CCCCC2)c1 ZINC000153844569 1422794384 /nfs/dbraw/zinc/79/43/84/1422794384.db2.gz DBIRDVSZCSLXHF-UHFFFAOYSA-N 0 0 375.450 3.382 20 5 GGBDRN 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KKDZQZPWSKXLPL-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN CCC(CC)(CO)CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000154141602 1422846256 /nfs/dbraw/zinc/84/62/56/1422846256.db2.gz OCOZXVRMNJZJFJ-UHFFFAOYSA-N 0 0 378.347 3.064 20 5 GGBDRN COc1cccc([C@@H]2CN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)CCO2)c1 ZINC000154154654 1422847884 /nfs/dbraw/zinc/84/78/84/1422847884.db2.gz PEJUGYGSFPVLKC-KRWDZBQOSA-N 0 0 382.376 3.231 20 5 GGBDRN Cc1cccc(-n2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)nn2)c1 ZINC000154177271 1422850945 /nfs/dbraw/zinc/85/09/45/1422850945.db2.gz PGSICXMMGSRKBH-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2ccc(Br)cc2)cc1F ZINC000154183666 1422851805 /nfs/dbraw/zinc/85/18/05/1422851805.db2.gz BDEUQERAKQEGEL-LLVKDONJSA-N 0 0 386.173 3.315 20 5 GGBDRN CC(C)CO[C@H]1CCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000154197421 1422853537 /nfs/dbraw/zinc/85/35/37/1422853537.db2.gz FHMIGNLOYZPXLI-ZDUSSCGKSA-N 0 0 390.358 3.423 20 5 GGBDRN 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ZINC000154214734 1422856452 /nfs/dbraw/zinc/85/64/52/1422856452.db2.gz IKBIDYSIEGDCHZ-CABCVRRESA-N 0 0 383.832 3.032 20 5 GGBDRN C[C@@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000154221018 1422857526 /nfs/dbraw/zinc/85/75/26/1422857526.db2.gz PUNCKKFIMOXRTF-JTQLQIEISA-N 0 0 395.437 3.253 20 5 GGBDRN O=c1c2cnn(-c3ccccc3)c2ncn1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000154231863 1422859185 /nfs/dbraw/zinc/85/91/85/1422859185.db2.gz XVFJBGYUPOJSTN-UHFFFAOYSA-N 0 0 381.779 3.192 20 5 GGBDRN Cc1c(C(=O)N(C)Cc2cc(Cl)cn2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000154232187 1422859262 /nfs/dbraw/zinc/85/92/62/1422859262.db2.gz VDNZEEBGDLELOJ-UHFFFAOYSA-N 0 0 380.788 3.384 20 5 GGBDRN COc1cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccc1Cl ZINC000154251766 1422862039 /nfs/dbraw/zinc/86/20/39/1422862039.db2.gz YFXQQZVXJODSOC-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2cccc(-c3cnco3)c2)cc([N+](=O)[O-])c1F ZINC000154250707 1422862106 /nfs/dbraw/zinc/86/21/06/1422862106.db2.gz OJRUUPKUAGOJIN-UHFFFAOYSA-N 0 0 377.353 3.498 20 5 GGBDRN COc1ccc(C[C@H](C)C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000154256066 1422862835 /nfs/dbraw/zinc/86/28/35/1422862835.db2.gz KRMQSYXRCQEASE-INIZCTEOSA-N 0 0 383.448 3.131 20 5 GGBDRN O=C(c1cc(C2CCCCC2)n[nH]1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000154257192 1422862869 /nfs/dbraw/zinc/86/28/69/1422862869.db2.gz WYUHSLKWKLFNDH-UHFFFAOYSA-N 0 0 383.452 3.328 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccccc2OC(F)F)cc([N+](=O)[O-])c1F ZINC000154260594 1422863420 /nfs/dbraw/zinc/86/34/20/1422863420.db2.gz JPFFVZOYCOSRQS-UHFFFAOYSA-N 0 0 390.339 3.122 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)cc1 ZINC000154260873 1422863590 /nfs/dbraw/zinc/86/35/90/1422863590.db2.gz ACLHBAPNRKBTNZ-UHFFFAOYSA-N 0 0 394.424 3.404 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2cccc(OC(F)F)c2)cc([N+](=O)[O-])c1F ZINC000154269484 1422864497 /nfs/dbraw/zinc/86/44/97/1422864497.db2.gz XHSXTISNDRWZCZ-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)cn1 ZINC000154273054 1422865246 /nfs/dbraw/zinc/86/52/46/1422865246.db2.gz JZQAICMAZLLGGZ-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc([N+](=O)[O-])c1F ZINC000154273589 1422865288 /nfs/dbraw/zinc/86/52/88/1422865288.db2.gz XHMRZQZBOUPJIO-UHFFFAOYSA-N 0 0 376.369 3.233 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)c1 ZINC000154280040 1422866253 /nfs/dbraw/zinc/86/62/53/1422866253.db2.gz ZDVASSVJSSJSQD-LLVKDONJSA-N 0 0 395.412 3.040 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000154284989 1422867015 /nfs/dbraw/zinc/86/70/15/1422867015.db2.gz AZDLMXDHKLOOGV-UHFFFAOYSA-N 0 0 394.424 3.404 20 5 GGBDRN COC(=O)CCn1nc(C)c(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000154286099 1422867310 /nfs/dbraw/zinc/86/73/10/1422867310.db2.gz VSENBVAOGNSUQF-UHFFFAOYSA-N 0 0 386.452 3.136 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCN(C(=O)CCC2CCCC2)CC1 ZINC000154285714 1422867464 /nfs/dbraw/zinc/86/74/64/1422867464.db2.gz WMVLANNRJISSCJ-UHFFFAOYSA-N 0 0 387.480 3.169 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)NC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000154295024 1422868459 /nfs/dbraw/zinc/86/84/59/1422868459.db2.gz YSXNAZQPTACONM-GFCCVEGCSA-N 0 0 375.429 3.370 20 5 GGBDRN O=C(NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1[nH]ncc1[N+](=O)[O-] ZINC000154315251 1422871608 /nfs/dbraw/zinc/87/16/08/1422871608.db2.gz DHKALQRWJZFORY-UHFFFAOYSA-N 0 0 398.250 3.019 20 5 GGBDRN Cc1nc(-c2ccc(S(=O)(=O)NCCc3cccc([N+](=O)[O-])c3)cc2)co1 ZINC000154318823 1422872103 /nfs/dbraw/zinc/87/21/03/1422872103.db2.gz AENUGNIDKVEOFO-UHFFFAOYSA-N 0 0 387.417 3.079 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)c2)n1 ZINC000154322524 1422872552 /nfs/dbraw/zinc/87/25/52/1422872552.db2.gz CEVHRJRESGBXGU-UHFFFAOYSA-N 0 0 394.387 3.168 20 5 GGBDRN O=[N+]([O-])c1cccc(CCNS(=O)(=O)Cc2ccccc2C(F)(F)F)c1 ZINC000154327402 1422873413 /nfs/dbraw/zinc/87/34/13/1422873413.db2.gz ONIRVEGWDUQTFT-UHFFFAOYSA-N 0 0 388.367 3.276 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@](C)(CC)c2nccs2)cc([N+](=O)[O-])c1 ZINC000154330365 1422873598 /nfs/dbraw/zinc/87/35/98/1422873598.db2.gz LACODQDGHNSKJB-QGZVFWFLSA-N 0 0 377.422 3.283 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@](C)(CC)c2nccs2)cc([N+](=O)[O-])c1 ZINC000154330249 1422873600 /nfs/dbraw/zinc/87/36/00/1422873600.db2.gz LACODQDGHNSKJB-KRWDZBQOSA-N 0 0 377.422 3.283 20 5 GGBDRN C[C@@]1(c2cc(F)ccc2F)NC(=O)N(Cc2c(Cl)cccc2[N+](=O)[O-])C1=O ZINC000154332263 1422873963 /nfs/dbraw/zinc/87/39/63/1422873963.db2.gz NZJHCFPURDJUIL-KRWDZBQOSA-N 0 0 395.749 3.494 20 5 GGBDRN C[C@@]1(c2ccc(F)cc2)NC(=O)N(Cc2c(Cl)cccc2[N+](=O)[O-])C1=O ZINC000154347981 1422876300 /nfs/dbraw/zinc/87/63/00/1422876300.db2.gz PLNMQDDKEWNIHX-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)OCc1nc(Cc2ccc(F)cc2)no1 ZINC000154349057 1422876555 /nfs/dbraw/zinc/87/65/55/1422876555.db2.gz SJKMSPMLWVRVLR-UHFFFAOYSA-N 0 0 385.351 3.384 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000154356609 1422877568 /nfs/dbraw/zinc/87/75/68/1422877568.db2.gz QUIXXPZYDUKQSN-SNVBAGLBSA-N 0 0 396.325 3.133 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000154415571 1422886404 /nfs/dbraw/zinc/88/64/04/1422886404.db2.gz PVHYOSDUBZJJJI-UHFFFAOYSA-N 0 0 396.447 3.208 20 5 GGBDRN O=C(C[C@@H]1COCCN1CCOc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000154441316 1422888954 /nfs/dbraw/zinc/88/89/54/1422888954.db2.gz LCLDBDOIOYXMQF-OAHLLOKOSA-N 0 0 376.434 3.009 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)ccc1[N+](=O)[O-] ZINC000154446583 1422889694 /nfs/dbraw/zinc/88/96/94/1422889694.db2.gz RUKKINBGMWUJCB-UHFFFAOYSA-N 0 0 389.795 3.401 20 5 GGBDRN CC(C)Oc1cc(CN(C(=O)COc2cccc([N+](=O)[O-])c2)C2CC2)ccn1 ZINC000154446679 1422889747 /nfs/dbraw/zinc/88/97/47/1422889747.db2.gz IGHYHBUEPHYAGT-UHFFFAOYSA-N 0 0 385.420 3.347 20 5 GGBDRN CC(C)CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000154447776 1422889798 /nfs/dbraw/zinc/88/97/98/1422889798.db2.gz AQCJYUVZMTXFKY-QGZVFWFLSA-N 0 0 375.469 3.472 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)NC[C@@]3(C)CCCS3)cc2)c(C)c1[N+](=O)[O-] ZINC000154450006 1422890163 /nfs/dbraw/zinc/89/01/63/1422890163.db2.gz QVKWPJVXWQGNOP-LJQANCHMSA-N 0 0 388.493 3.472 20 5 GGBDRN O=C(Nc1ccccc1N1CCC(O)CC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000154460649 1422891567 /nfs/dbraw/zinc/89/15/67/1422891567.db2.gz NUNJXWUCBZPZPB-UHFFFAOYSA-N 0 0 375.812 3.462 20 5 GGBDRN CC(C)Oc1cc(CN(C(=O)CNc2ccccc2[N+](=O)[O-])C2CC2)ccn1 ZINC000154458845 1422891591 /nfs/dbraw/zinc/89/15/91/1422891591.db2.gz JWGQAHVKYGCELD-UHFFFAOYSA-N 0 0 384.436 3.380 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000154474218 1422893558 /nfs/dbraw/zinc/89/35/58/1422893558.db2.gz VBQKHIQAPXQSEW-OKILXGFUSA-N 0 0 385.420 3.469 20 5 GGBDRN C[C@H](O)C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1 ZINC000154494841 1422896803 /nfs/dbraw/zinc/89/68/03/1422896803.db2.gz JMVJMJKUWCCLCT-DOTOQJQBSA-N 0 0 394.431 3.065 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1 ZINC000154494666 1422896909 /nfs/dbraw/zinc/89/69/09/1422896909.db2.gz JMVJMJKUWCCLCT-RDJZCZTQSA-N 0 0 394.431 3.065 20 5 GGBDRN Cc1cc([C@]2(C)NC(=O)N(Cc3c(Cl)cccc3[N+](=O)[O-])C2=O)c(C)o1 ZINC000154518582 1422899759 /nfs/dbraw/zinc/89/97/59/1422899759.db2.gz NUICXTHRNIOFBF-KRWDZBQOSA-N 0 0 377.784 3.425 20 5 GGBDRN COc1ccc(O[C@@H](C)CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000154523374 1422900638 /nfs/dbraw/zinc/90/06/38/1422900638.db2.gz WZJPUVVUXDVCQS-ZDUSSCGKSA-N 0 0 381.388 3.349 20 5 GGBDRN CC(C)N(CC(=O)Nc1ccc(F)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154522199 1422900774 /nfs/dbraw/zinc/90/07/74/1422900774.db2.gz GKWVMVUMKRPNCI-GOSISDBHSA-N 0 0 375.400 3.116 20 5 GGBDRN CCc1nc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)co1 ZINC000154545903 1422918358 /nfs/dbraw/zinc/91/83/58/1422918358.db2.gz BKFOMUHNEKOSQR-UHFFFAOYSA-N 0 0 398.341 3.126 20 5 GGBDRN CC(C)[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1nc(C2CC2)no1 ZINC000179834666 1429602177 /nfs/dbraw/zinc/60/21/77/1429602177.db2.gz ZMWMYGUWTDOCRK-HNNXBMFYSA-N 0 0 384.396 3.392 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H](C)c2ncon2)cc1[N+](=O)[O-])c1ccccn1 ZINC000154561936 1422931279 /nfs/dbraw/zinc/93/12/79/1422931279.db2.gz ALPQCSVFIHEYQV-NEPJUHHUSA-N 0 0 382.380 3.037 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@H](c2ccsc2)O1 ZINC000154563552 1422932488 /nfs/dbraw/zinc/93/24/88/1422932488.db2.gz IQSOXIXFUXCAOX-FZKQIMNGSA-N 0 0 398.444 3.444 20 5 GGBDRN CCc1noc(CC)c1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000154565781 1422933986 /nfs/dbraw/zinc/93/39/86/1422933986.db2.gz GWHWPGWOTUBBPF-UHFFFAOYSA-N 0 0 375.381 3.050 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@H](c2ccsc2)O1 ZINC000154563663 1422934215 /nfs/dbraw/zinc/93/42/15/1422934215.db2.gz IQSOXIXFUXCAOX-SCLBCKFNSA-N 0 0 398.444 3.444 20 5 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O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000179902628 1429631941 /nfs/dbraw/zinc/63/19/41/1429631941.db2.gz BEXTWERIDHZFMW-CQSZACIVSA-N 0 0 375.812 3.022 20 5 GGBDRN Cc1cccc(Cl)c1NC(=O)CNc1cc([N+](=O)[O-])ccc1NCCO ZINC000155351298 1423327782 /nfs/dbraw/zinc/32/77/82/1423327782.db2.gz IIZDRBLVYCKRQU-UHFFFAOYSA-N 0 0 378.816 3.011 20 5 GGBDRN COc1cc(OCC(=O)NCCc2csc(C(C)(C)C)n2)ccc1[N+](=O)[O-] ZINC000155392303 1423345819 /nfs/dbraw/zinc/34/58/19/1423345819.db2.gz KLXZMCFIOKMSIJ-UHFFFAOYSA-N 0 0 393.465 3.095 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000155395512 1423346734 /nfs/dbraw/zinc/34/67/34/1423346734.db2.gz XLHWPXQGCNOZRA-NRFANRHFSA-N 0 0 381.432 3.097 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCO[C@]2(CCc3ccccc32)C1 ZINC000155395404 1423346860 /nfs/dbraw/zinc/34/68/60/1423346860.db2.gz XLHWPXQGCNOZRA-OAQYLSRUSA-N 0 0 381.432 3.097 20 5 GGBDRN COc1ccc([C@@H]2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)cc1 ZINC000155397369 1423347646 /nfs/dbraw/zinc/34/76/46/1423347646.db2.gz VCHRQVSKSCICLW-CYBMUJFWSA-N 0 0 396.852 3.435 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H](O)c1ccc(Cl)c(F)c1 ZINC000155395763 1423347819 /nfs/dbraw/zinc/34/78/19/1423347819.db2.gz OPVUMTMUKIJVHA-INIZCTEOSA-N 0 0 381.791 3.039 20 5 GGBDRN O=C(NCC1([C@@H](O)c2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000155404993 1423351263 /nfs/dbraw/zinc/35/12/63/1423351263.db2.gz SDVIEYUHUGEXPA-FQEVSTJZSA-N 0 0 395.459 3.439 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000155416205 1423355497 /nfs/dbraw/zinc/35/54/97/1423355497.db2.gz IQIUMJHVSZAMDK-UHFFFAOYSA-N 0 0 380.404 3.093 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000155420095 1423355995 /nfs/dbraw/zinc/35/59/95/1423355995.db2.gz FKSREEYNXUYZOF-MAUKXSAKSA-N 0 0 390.823 3.213 20 5 GGBDRN CN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Cl)nn1 ZINC000155422954 1423357133 /nfs/dbraw/zinc/35/71/33/1423357133.db2.gz NEERXOXYDFOLFF-UHFFFAOYSA-N 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COc1ccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000179922993 1429643097 /nfs/dbraw/zinc/64/30/97/1429643097.db2.gz VSQZDWVNJLPESE-CQSZACIVSA-N 0 0 375.812 3.266 20 5 GGBDRN O=C(c1cccc(NCc2c(Cl)cccc2[N+](=O)[O-])c1)N1CCOCC1 ZINC000155509204 1423393214 /nfs/dbraw/zinc/39/32/14/1423393214.db2.gz MRTNEFBXPPHRJI-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN CS(=O)(=O)c1cc(SCc2nc(-c3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000155514779 1423395601 /nfs/dbraw/zinc/39/56/01/1423395601.db2.gz BYMFAVZVWQWKMA-UHFFFAOYSA-N 0 0 391.430 3.341 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@H](CO)c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000155515502 1423395949 /nfs/dbraw/zinc/39/59/49/1423395949.db2.gz HQYYUPREENVVOG-GOSISDBHSA-N 0 0 383.448 3.295 20 5 GGBDRN O=[N+]([O-])c1cnn(CCN[C@@H](c2ccccc2OC(F)F)C(F)(F)F)c1 ZINC000179914670 1429638139 /nfs/dbraw/zinc/63/81/39/1429638139.db2.gz UFBWZOLJXFGIKS-LBPRGKRZSA-N 0 0 380.273 3.286 20 5 GGBDRN O=C(c1cccc(NCc2c(Cl)cccc2[N+](=O)[O-])c1)N1CCC[C@@H](O)C1 ZINC000155524776 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O=[N+]([O-])c1cccc(CS(=O)(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1 ZINC000156270822 1423752022 /nfs/dbraw/zinc/75/20/22/1423752022.db2.gz AZBXHLPTLNSUCU-OALUTQOASA-N 0 0 390.461 3.152 20 5 GGBDRN Cc1ccc(NCCCNC(=O)C[C@H](O)c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000156273210 1423753177 /nfs/dbraw/zinc/75/31/77/1423753177.db2.gz BZSBNQBDLXHBFG-SFHVURJKSA-N 0 0 375.400 3.084 20 5 GGBDRN COC(=O)C1(N(C)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCCC1 ZINC000156283603 1423756860 /nfs/dbraw/zinc/75/68/60/1423756860.db2.gz SPRNOANIWLGSIZ-UHFFFAOYSA-N 0 0 392.455 3.099 20 5 GGBDRN O=C(Nc1ccc(O[C@H]2CCOC2)cc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000156310519 1423771883 /nfs/dbraw/zinc/77/18/83/1423771883.db2.gz UYGLHUDGGQKPOU-IBGZPJMESA-N 0 0 394.387 3.201 20 5 GGBDRN Cc1c(C(=O)NCC2([C@H](O)c3ccccc3)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000156314935 1423773299 /nfs/dbraw/zinc/77/32/99/1423773299.db2.gz PPDSUXOXMNTOCS-GOSISDBHSA-N 0 0 399.403 3.363 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](Oc2ccncc2)C1 ZINC000156341469 1423789825 /nfs/dbraw/zinc/78/98/25/1423789825.db2.gz XFLKVKGQVCIRFA-WFASDCNBSA-N 0 0 390.827 3.124 20 5 GGBDRN CC(=O)N1CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)ccc21 ZINC000179976856 1429671653 /nfs/dbraw/zinc/67/16/53/1429671653.db2.gz VZGGPODWZVHWFQ-UHFFFAOYSA-N 0 0 391.330 3.358 20 5 GGBDRN CC[C@H]1CCC[C@H]1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000156364684 1423799757 /nfs/dbraw/zinc/79/97/57/1423799757.db2.gz IFNNYKFJYLOEOW-WCQYABFASA-N 0 0 375.454 3.183 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000156386089 1423803080 /nfs/dbraw/zinc/80/30/80/1423803080.db2.gz JAGZAFYJCXDUIT-MGPLVRAMSA-N 0 0 391.405 3.475 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)Oc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000156386677 1423803271 /nfs/dbraw/zinc/80/32/71/1423803271.db2.gz SISZXVWSJAUREN-UHFFFAOYSA-N 0 0 377.418 3.235 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)[C@H]1CC(c2ccccc2)=NO1 ZINC000156391639 1423804091 /nfs/dbraw/zinc/80/40/91/1423804091.db2.gz RAKYRNDDJGXJQC-QGZVFWFLSA-N 0 0 377.360 3.117 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)Oc2cccc([N+](=O)[O-])c2C)cc1 ZINC000156404530 1423806450 /nfs/dbraw/zinc/80/64/50/1423806450.db2.gz BJTGKGGFEWWQNL-UHFFFAOYSA-N 0 0 377.418 3.235 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)[C@H](CCO)c1ccccc1 ZINC000156422510 1423808908 /nfs/dbraw/zinc/80/89/08/1423808908.db2.gz RITOLNPXLMOYPR-LJQANCHMSA-N 0 0 383.448 3.391 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1CCCOc2c(F)cccc21 ZINC000179982054 1429673734 /nfs/dbraw/zinc/67/37/34/1429673734.db2.gz MPGACLPNGYFQQQ-MRXNPFEDSA-N 0 0 394.424 3.110 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1cnc(-c2ccccc2)nc1 ZINC000156456319 1423812737 /nfs/dbraw/zinc/81/27/37/1423812737.db2.gz MJWDZTNGWWFSMC-UHFFFAOYSA-N 0 0 384.417 3.036 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000156461103 1423813101 /nfs/dbraw/zinc/81/31/01/1423813101.db2.gz VDUSXKMUZHRALB-IGCXYCKISA-N 0 0 391.859 3.355 20 5 GGBDRN COc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1OC(F)F ZINC000156497708 1423818957 /nfs/dbraw/zinc/81/89/57/1423818957.db2.gz KJVBSCPMDCZQFA-UHFFFAOYSA-N 0 0 378.331 3.403 20 5 GGBDRN Cc1c[nH]c(=O)n1-c1ccc([C@@H](C)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000156514935 1423821611 /nfs/dbraw/zinc/82/16/11/1423821611.db2.gz RIFUGWZQWPRNDD-CQSZACIVSA-N 0 0 380.404 3.182 20 5 GGBDRN CCOc1cc(C(=O)N2CCN(c3cccs3)CC2)c([N+](=O)[O-])cc1OC ZINC000156515286 1423821865 /nfs/dbraw/zinc/82/18/65/1423821865.db2.gz VZZLZZMEIGSBCI-UHFFFAOYSA-N 0 0 391.449 3.026 20 5 GGBDRN Cc1c[nH]c(=O)n1-c1ccc([C@H](C)NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000156516712 1423822132 /nfs/dbraw/zinc/82/21/32/1423822132.db2.gz QUEPKPMYNGVETH-AWEZNQCLSA-N 0 0 380.404 3.182 20 5 GGBDRN CCO[C@@H](C)c1nc(CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cs1 ZINC000156526546 1423822879 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BBKIHGPPSAIQJV-UHFFFAOYSA-N 0 0 394.225 3.059 20 5 GGBDRN CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156540776 1423825204 /nfs/dbraw/zinc/82/52/04/1423825204.db2.gz XWXGAEYPBWFSHQ-YWZLYKJASA-N 0 0 395.459 3.324 20 5 GGBDRN O=C([C@H]1CC(=O)N(c2ccccc2Cl)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156568390 1423829825 /nfs/dbraw/zinc/82/98/25/1423829825.db2.gz SCABKNNRMDGPSC-HNNXBMFYSA-N 0 0 399.834 3.186 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCCOCCc1ccccc1 ZINC000156570341 1423829951 /nfs/dbraw/zinc/82/99/51/1423829951.db2.gz WCOLRNQUBRRDEJ-UHFFFAOYSA-N 0 0 381.432 3.384 20 5 GGBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])o1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000156570056 1423830005 /nfs/dbraw/zinc/83/00/05/1423830005.db2.gz KYBOJYJYTDFQHL-UHFFFAOYSA-N 0 0 381.429 3.440 20 5 GGBDRN O=C([C@@H]1CC(=O)N(c2ccccc2Cl)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156568259 1423830010 /nfs/dbraw/zinc/83/00/10/1423830010.db2.gz SCABKNNRMDGPSC-OAHLLOKOSA-N 0 0 399.834 3.186 20 5 GGBDRN O=C([C@H](c1ccccc1)N1CCCCC1=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156572901 1423830860 /nfs/dbraw/zinc/83/08/60/1423830860.db2.gz BHFXWHVLEDOACZ-NRFANRHFSA-N 0 0 393.443 3.233 20 5 GGBDRN C[C@](O)(CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccs1 ZINC000156577131 1423831115 /nfs/dbraw/zinc/83/11/15/1423831115.db2.gz KQUBFSZSVPGBHZ-QFIPXVFZSA-N 0 0 392.480 3.240 20 5 GGBDRN Cc1c(C(=O)NCC2(CCO)CCCCC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000156579966 1423831503 /nfs/dbraw/zinc/83/15/03/1423831503.db2.gz OSVOXALKDNIFDF-UHFFFAOYSA-N 0 0 379.413 3.183 20 5 GGBDRN O=C(Cc1cccc(OCc2cccnc2)c1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000179986107 1429675561 /nfs/dbraw/zinc/67/55/61/1429675561.db2.gz FJSRMSWAKBGXRY-UHFFFAOYSA-N 0 0 391.427 3.470 20 5 GGBDRN CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1S(=O)(=O)CC ZINC000156583399 1423832350 /nfs/dbraw/zinc/83/23/50/1423832350.db2.gz VMMXKRUTZYGEPF-UHFFFAOYSA-N 0 0 394.424 3.123 20 5 GGBDRN O=C(Cc1ccc(NC(=O)C2CC2)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156591327 1423833161 /nfs/dbraw/zinc/83/31/61/1423833161.db2.gz AMYQYCTXEVFNNC-UHFFFAOYSA-N 0 0 379.416 3.071 20 5 GGBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c(C(=O)NC2CC2)c1 ZINC000156590567 1423833207 /nfs/dbraw/zinc/83/32/07/1423833207.db2.gz YDWONLNOLSXPNI-UHFFFAOYSA-N 0 0 389.795 3.401 20 5 GGBDRN COCCOc1ccc(Cl)cc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156608207 1423835621 /nfs/dbraw/zinc/83/56/21/1423835621.db2.gz GWACJKGMKBFYIA-UHFFFAOYSA-N 0 0 390.823 3.472 20 5 GGBDRN O=C(c1cccnc1OCC(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156621268 1423837090 /nfs/dbraw/zinc/83/70/90/1423837090.db2.gz YCQCIHQUYXURFM-UHFFFAOYSA-N 0 0 381.310 3.129 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156623019 1423837554 /nfs/dbraw/zinc/83/75/54/1423837554.db2.gz BIKQEMFKKGXKHV-LJQANCHMSA-N 0 0 399.422 3.073 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000156638398 1423839323 /nfs/dbraw/zinc/83/93/23/1423839323.db2.gz KRBVEZFUJSSFEW-UHFFFAOYSA-N 0 0 380.154 3.447 20 5 GGBDRN O=C(N1CCc2ccc([N+](=O)[O-])cc2C1)C1(c2cccc(F)c2)CCOCC1 ZINC000156638929 1423839369 /nfs/dbraw/zinc/83/93/69/1423839369.db2.gz NUBDEAUPRSPPBE-UHFFFAOYSA-N 0 0 384.407 3.367 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1ccc(OC(F)F)c(F)c1 ZINC000156644711 1423840271 /nfs/dbraw/zinc/84/02/71/1423840271.db2.gz WKYLDPQMQDMAOW-UHFFFAOYSA-N 0 0 390.339 3.320 20 5 GGBDRN COC(=O)c1cccc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000156650106 1423840908 /nfs/dbraw/zinc/84/09/08/1423840908.db2.gz VONHXHXVUJRSQJ-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN Cc1nn(CC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c(C)c1Cl ZINC000156650233 1423841110 /nfs/dbraw/zinc/84/11/10/1423841110.db2.gz MHTBWIRCBQGIAX-UHFFFAOYSA-N 0 0 387.621 3.463 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNC1(c2ccc(F)cc2F)CCC1 ZINC000179986206 1429676917 /nfs/dbraw/zinc/67/69/17/1429676917.db2.gz NYDVBQJRLHZAGK-UHFFFAOYSA-N 0 0 391.374 3.489 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)c1C ZINC000156686891 1423848365 /nfs/dbraw/zinc/84/83/65/1423848365.db2.gz BORLOFUDPRJPPU-WMLDXEAASA-N 0 0 392.477 3.045 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H](C[C@H](C)O)c2ccccc2)c1C ZINC000156687027 1423848380 /nfs/dbraw/zinc/84/83/80/1423848380.db2.gz BORLOFUDPRJPPU-YOEHRIQHSA-N 0 0 392.477 3.045 20 5 GGBDRN CC(C)(C)Oc1ccc(CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cn1 ZINC000179988040 1429677359 /nfs/dbraw/zinc/67/73/59/1429677359.db2.gz OYYGNBBCOYPMSH-UHFFFAOYSA-N 0 0 395.419 3.283 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)cc1C ZINC000156715051 1423852888 /nfs/dbraw/zinc/85/28/88/1423852888.db2.gz ICYOJYOAYFSOAO-NVXWUHKLSA-N 0 0 392.477 3.045 20 5 GGBDRN CCc1ccccc1CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-] ZINC000156718782 1423853331 /nfs/dbraw/zinc/85/33/31/1423853331.db2.gz WAQSTOPGTMKEMS-ZDUSSCGKSA-N 0 0 385.420 3.061 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(NC(=O)c3cnoc3C)cc2)c1[N+](=O)[O-] ZINC000156725981 1423855069 /nfs/dbraw/zinc/85/50/69/1423855069.db2.gz UYAYDBPWVYVVOZ-UHFFFAOYSA-N 0 0 398.379 3.071 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1F ZINC000179989711 1429677745 /nfs/dbraw/zinc/67/77/45/1429677745.db2.gz CUSONHUUXIDYTA-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN CC(C)(C)OC(=O)NCC1(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000156743403 1423857717 /nfs/dbraw/zinc/85/77/17/1423857717.db2.gz VMFFHUYERUTJKH-UHFFFAOYSA-N 0 0 391.468 3.339 20 5 GGBDRN CC(=O)Nc1cc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000156750931 1423858698 /nfs/dbraw/zinc/85/86/98/1423858698.db2.gz AHBHIBTVIOMXMT-UHFFFAOYSA-N 0 0 397.840 3.191 20 5 GGBDRN O=C(c1cc(F)cc2cccnc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000156792244 1423865543 /nfs/dbraw/zinc/86/55/43/1423865543.db2.gz AGEGWZBTCZYSDE-UHFFFAOYSA-N 0 0 380.379 3.245 20 5 GGBDRN Cn1c(CCNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)nc2ccc(F)cc21 ZINC000156806304 1423867653 /nfs/dbraw/zinc/86/76/53/1423867653.db2.gz UFWBTDVJYHHZDT-UHFFFAOYSA-N 0 0 376.775 3.247 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000156824449 1423870977 /nfs/dbraw/zinc/87/09/77/1423870977.db2.gz OCZBUCAAZCWDMK-QGZVFWFLSA-N 0 0 378.812 3.499 20 5 GGBDRN CCOCCC1(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)CC1 ZINC000156845064 1423874027 /nfs/dbraw/zinc/87/40/27/1423874027.db2.gz MFHKDECWULCMDX-UHFFFAOYSA-N 0 0 376.862 3.042 20 5 GGBDRN Cc1ccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)c(O[C@H]2CCOC2)c1 ZINC000156871641 1423878121 /nfs/dbraw/zinc/87/81/21/1423878121.db2.gz ZAVGSIGEYOBJJF-IBGZPJMESA-N 0 0 384.432 3.320 20 5 GGBDRN C[C@]1(c2ccccc2)CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000156875859 1423879266 /nfs/dbraw/zinc/87/92/66/1423879266.db2.gz WHWHDHUUFGVOKK-OAQYLSRUSA-N 0 0 392.415 3.168 20 5 GGBDRN O=C(c1ccc(N2CCC(O)CC2)cc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000156880778 1423879551 /nfs/dbraw/zinc/87/95/51/1423879551.db2.gz 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379.363 3.224 20 5 GGBDRN O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000158565221 1424290910 /nfs/dbraw/zinc/29/09/10/1424290910.db2.gz AQVNJMKZPRSAPC-KUHUBIRLSA-N 0 0 393.399 3.086 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(C(=O)C2CC2)CC1 ZINC000158622503 1424303958 /nfs/dbraw/zinc/30/39/58/1424303958.db2.gz DEOIYUSTYOQSPO-UHFFFAOYSA-N 0 0 391.493 3.180 20 5 GGBDRN CC(C)(C)c1ccc(S(=O)(=O)CCn2cc(Cl)cc([N+](=O)[O-])c2=O)cc1 ZINC000158648472 1424309686 /nfs/dbraw/zinc/30/96/86/1424309686.db2.gz YXXBKHFTHVNYSQ-UHFFFAOYSA-N 0 0 398.868 3.181 20 5 GGBDRN Cc1ccc(NCCCNC(=O)Nc2nnc(C(F)F)s2)c([N+](=O)[O-])c1 ZINC000158666107 1424313694 /nfs/dbraw/zinc/31/36/94/1424313694.db2.gz SHQFMVKYGRZPOU-UHFFFAOYSA-N 0 0 386.384 3.316 20 5 GGBDRN C[C@H](c1cc2ccccc2o1)N(C)C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000158664583 1424313999 /nfs/dbraw/zinc/31/39/99/1424313999.db2.gz VQXFAPUILDWUGV-LLVKDONJSA-N 0 0 389.795 3.376 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C[C@H](C)C1 ZINC000158680846 1424317206 /nfs/dbraw/zinc/31/72/06/1424317206.db2.gz MVZDUJVEHYHDQJ-QWHCGFSZSA-N 0 0 389.481 3.383 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)cc([N+](=O)[O-])c1F ZINC000180063373 1429720582 /nfs/dbraw/zinc/72/05/82/1429720582.db2.gz SEPRBBYEBUOJCZ-FUHWJXTLSA-N 0 0 394.424 3.241 20 5 GGBDRN COc1ccccc1-c1nc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n[nH]1 ZINC000158711886 1424324630 /nfs/dbraw/zinc/32/46/30/1424324630.db2.gz IAWKOXNNSDJHBV-UHFFFAOYSA-N 0 0 392.375 3.051 20 5 GGBDRN CC(=O)c1ccccc1NC(=O)CCCn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000158723349 1424327842 /nfs/dbraw/zinc/32/78/42/1424327842.db2.gz NUWMBMOATKYLQX-UHFFFAOYSA-N 0 0 377.784 3.031 20 5 GGBDRN O=C(Cc1ccc(OCc2ccccn2)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000158747477 1424333074 /nfs/dbraw/zinc/33/30/74/1424333074.db2.gz VLYORTKNINOSLS-UHFFFAOYSA-N 0 0 377.400 3.428 20 5 GGBDRN CC(C)(C)N(Cc1ccccc1)C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O 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MJGWOPGAFUNFDC-AEFFLSMTSA-N 0 0 385.464 3.458 20 5 GGBDRN CCC(CC)c1cc(CNS(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)on1 ZINC000180086600 1429730876 /nfs/dbraw/zinc/73/08/76/1429730876.db2.gz CQKHNNQTQIIKHW-UHFFFAOYSA-N 0 0 385.417 3.412 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NCC1([C@@H](O)c2ccccc2)CC1 ZINC000159288735 1424474484 /nfs/dbraw/zinc/47/44/84/1424474484.db2.gz GCBCJNCJODPXEN-INIZCTEOSA-N 0 0 396.852 3.040 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCCN(C)c3ccc(F)cc32)cc([N+](=O)[O-])c1F ZINC000180083162 1429729087 /nfs/dbraw/zinc/72/90/87/1429729087.db2.gz UOWHEYMKMWFKIT-UHFFFAOYSA-N 0 0 397.403 3.217 20 5 GGBDRN C[C@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000159323811 1424484736 /nfs/dbraw/zinc/48/47/36/1424484736.db2.gz ZPRIMIRJQKCWFX-VIFPVBQESA-N 0 0 388.273 3.219 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCC2([C@@H](O)c3ccccc3)CC2)c1C ZINC000159328987 1424486821 /nfs/dbraw/zinc/48/68/21/1424486821.db2.gz LNLSKDVBHSFRBW-SFHVURJKSA-N 0 0 390.461 3.004 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2coc(-c3ccccc3)n2)cc([N+](=O)[O-])c1F ZINC000180084519 1429729795 /nfs/dbraw/zinc/72/97/95/1429729795.db2.gz GTWZQAZYUQJBOO-UHFFFAOYSA-N 0 0 391.380 3.176 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000159333577 1424488323 /nfs/dbraw/zinc/48/83/23/1424488323.db2.gz GBRJOKWORVKFDD-LIRRHRJNSA-N 0 0 380.404 3.023 20 5 GGBDRN C[C@@H](O)C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000159343490 1424490727 /nfs/dbraw/zinc/49/07/27/1424490727.db2.gz KOHYCMKMWWDYJV-CJNGLKHVSA-N 0 0 376.840 3.462 20 5 GGBDRN C[C@@H](COc1ccc(F)cc1F)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000159352664 1424493029 /nfs/dbraw/zinc/49/30/29/1424493029.db2.gz ILUHWAFJJMYANC-NSHDSACASA-N 0 0 389.358 3.481 20 5 GGBDRN Cc1ccc(NCCCNC(=O)Nc2cccc([S@](C)=O)c2)c([N+](=O)[O-])c1 ZINC000159351966 1424493059 /nfs/dbraw/zinc/49/30/59/1424493059.db2.gz JZXYAVBVTRXHNQ-HHHXNRCGSA-N 0 0 390.465 3.264 20 5 GGBDRN C[S@@](=O)c1cccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000159356053 1424494339 /nfs/dbraw/zinc/49/43/39/1424494339.db2.gz HMYYZWDYYYJOKT-SANMLTNESA-N 0 0 375.450 3.477 20 5 GGBDRN Cn1cc(CNc2ccc(Cn3cncn3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000159356750 1424494805 /nfs/dbraw/zinc/49/48/05/1424494805.db2.gz RFELMPFMOQZXEP-UHFFFAOYSA-N 0 0 389.419 3.247 20 5 GGBDRN COc1cccc(-c2nnn(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)n2)c1 ZINC000159362485 1424496237 /nfs/dbraw/zinc/49/62/37/1424496237.db2.gz JADADCNOVLMLGU-UHFFFAOYSA-N 0 0 379.298 3.324 20 5 GGBDRN CC(C)OC1CCC(NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000159387667 1424498844 /nfs/dbraw/zinc/49/88/44/1424498844.db2.gz HSMMUTTXUPGOFC-UHFFFAOYSA-N 0 0 376.862 3.263 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCC2(c3ccc(F)cc3)CCC2)cc1[N+](=O)[O-] ZINC000159403632 1424499661 /nfs/dbraw/zinc/49/96/61/1424499661.db2.gz JWFJVVKOFXPPOC-UHFFFAOYSA-N 0 0 385.395 3.219 20 5 GGBDRN CN1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2cc(F)ccc21 ZINC000159422248 1424501473 /nfs/dbraw/zinc/50/14/73/1424501473.db2.gz 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GGBDRN CO[C@]1(C)C[C@H](OC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000159507490 1424509187 /nfs/dbraw/zinc/50/91/87/1424509187.db2.gz VAAKATIFOCMVSG-HNAYVOBHSA-N 0 0 392.408 3.030 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H]1CCCOc2ccccc21 ZINC000159514345 1424509987 /nfs/dbraw/zinc/50/99/87/1424509987.db2.gz IFDPLPHKLAWARK-AWEZNQCLSA-N 0 0 389.795 3.217 20 5 GGBDRN CCC(CC)n1ncc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1C ZINC000159528166 1424511182 /nfs/dbraw/zinc/51/11/82/1424511182.db2.gz HLNOCHZWDZUXRQ-UHFFFAOYSA-N 0 0 385.468 3.423 20 5 GGBDRN O=Cc1cc(F)ccc1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000159542744 1424511630 /nfs/dbraw/zinc/51/16/30/1424511630.db2.gz CUZKQZSDFPRPNF-UHFFFAOYSA-N 0 0 393.270 3.333 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CCC[C@H](COC)C2)c1=S ZINC000159554033 1424512652 /nfs/dbraw/zinc/51/26/52/1424512652.db2.gz LSQRKKJTPNQDBG-AWEZNQCLSA-N 0 0 391.497 3.325 20 5 GGBDRN CCCNC(=O)Nc1ccc(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000159553238 1424512899 /nfs/dbraw/zinc/51/28/99/1424512899.db2.gz RUTIQIGMGCVFBC-UHFFFAOYSA-N 0 0 382.420 3.258 20 5 GGBDRN Cc1c(C(=O)NC[C@H](C[C@H](C)O)c2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000159565498 1424513795 /nfs/dbraw/zinc/51/37/95/1424513795.db2.gz WHSRTAKXPDHAHW-WFASDCNBSA-N 0 0 387.392 3.096 20 5 GGBDRN CC(C)[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000159592523 1424516797 /nfs/dbraw/zinc/51/67/97/1424516797.db2.gz KTFINJAJPXEEBK-MRXNPFEDSA-N 0 0 377.347 3.325 20 5 GGBDRN CN(Cc1ccc(O)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000159622261 1424519636 /nfs/dbraw/zinc/51/96/36/1424519636.db2.gz FSEKLACUGNAVBC-UHFFFAOYSA-N 0 0 390.339 3.140 20 5 GGBDRN O=C(NCCOC[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000159637758 1424520694 /nfs/dbraw/zinc/52/06/94/1424520694.db2.gz QGILUAUELWLTMT-GOSISDBHSA-N 0 0 399.447 3.132 20 5 GGBDRN CCOC(=O)CCc1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000159655429 1424521513 /nfs/dbraw/zinc/52/15/13/1424521513.db2.gz CZGCWTQFKFWGJE-UHFFFAOYSA-N 0 0 385.420 3.455 20 5 GGBDRN CCCOc1ccc(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000159693177 1424525195 /nfs/dbraw/zinc/52/51/95/1424525195.db2.gz WUSTXESVJYMCLR-UHFFFAOYSA-N 0 0 387.436 3.434 20 5 GGBDRN O=C(Nc1ccnn1C[C@H]1CCOC1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000159695331 1424525200 /nfs/dbraw/zinc/52/52/00/1424525200.db2.gz JPORGOGRYAVUCE-OAHLLOKOSA-N 0 0 385.424 3.024 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@]2(CCc3ccccc32)C1 ZINC000159697424 1424525255 /nfs/dbraw/zinc/52/52/55/1424525255.db2.gz PWYIFAITCVOBHP-HXUWFJFHSA-N 0 0 383.404 3.309 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000159702585 1424525602 /nfs/dbraw/zinc/52/56/02/1424525602.db2.gz WNXCNTIVUCXXHW-UHFFFAOYSA-N 0 0 384.779 3.408 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccccc2F)c(Br)c1 ZINC000159707544 1424526979 /nfs/dbraw/zinc/52/69/79/1424526979.db2.gz AVCYJARTWKPHAM-UHFFFAOYSA-N 0 0 376.159 3.264 20 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CCOCCC1(CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)CCC1 ZINC000159818791 1424539337 /nfs/dbraw/zinc/53/93/37/1424539337.db2.gz NYYYXYLDRCGQPC-UHFFFAOYSA-N 0 0 379.413 3.447 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159826954 1424540730 /nfs/dbraw/zinc/54/07/30/1424540730.db2.gz JQPFVZYRWLBWIR-DOTOQJQBSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000159831221 1424540905 /nfs/dbraw/zinc/54/09/05/1424540905.db2.gz AQLWAHABWVLDIL-NVXWUHKLSA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000159831889 1424541007 /nfs/dbraw/zinc/54/10/07/1424541007.db2.gz WKTNAKPMVZGMKX-QFBILLFUSA-N 0 0 390.461 3.182 20 5 GGBDRN CCCC(=O)Nc1ccc(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000159835609 1424542199 /nfs/dbraw/zinc/54/21/99/1424542199.db2.gz RPDCIPGWBCEHPQ-UHFFFAOYSA-N 0 0 384.436 3.375 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000159838125 1424542395 /nfs/dbraw/zinc/54/23/95/1424542395.db2.gz VPIQFKBEQCHFRO-RDTXWAMCSA-N 0 0 376.434 3.041 20 5 GGBDRN CCCn1nc(C)c(/C=C2/N=C(c3ccc(OC)c([N+](=O)[O-])c3)OC2=O)c1C ZINC000159855427 1424543136 /nfs/dbraw/zinc/54/31/36/1424543136.db2.gz UFNIKAQACMMILB-XNTDXEJSSA-N 0 0 384.392 3.171 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159851194 1424543169 /nfs/dbraw/zinc/54/31/69/1424543169.db2.gz DDWQQRCLTLOTCQ-MAUKXSAKSA-N 0 0 390.461 3.349 20 5 GGBDRN CN(C)CC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000159860755 1424544720 /nfs/dbraw/zinc/54/47/20/1424544720.db2.gz SLZUSSGTDCCDHB-UHFFFAOYSA-N 0 0 376.800 3.001 20 5 GGBDRN COc1ccc([C@H](CNC(=O)c2ccc([O-])c([N+](=O)[O-])c2)[NH+]2CCCCC2)cc1 ZINC000159888926 1424550011 /nfs/dbraw/zinc/55/00/11/1424550011.db2.gz UTBBHEREOIOVRS-IBGZPJMESA-N 0 0 399.447 3.266 20 5 GGBDRN 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CC(C)c1nc(N(C)C)nc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000160163940 1424582605 /nfs/dbraw/zinc/58/26/05/1424582605.db2.gz PLYNTSWEKVSFDV-UHFFFAOYSA-N 0 0 386.456 3.017 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 ZINC000160166214 1424582844 /nfs/dbraw/zinc/58/28/44/1424582844.db2.gz PFZSFEMNGSUZKK-NSHDSACASA-N 0 0 391.415 3.415 20 5 GGBDRN NC(=O)c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1 ZINC000160175388 1424584363 /nfs/dbraw/zinc/58/43/63/1424584363.db2.gz TULNRSOXLUNXSG-UHFFFAOYSA-N 0 0 382.298 3.034 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1F ZINC000180099257 1429737469 /nfs/dbraw/zinc/73/74/69/1429737469.db2.gz GPYGGCJVZIRXCX-SUMWQHHRSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000160188163 1424585190 /nfs/dbraw/zinc/58/51/90/1424585190.db2.gz SHYNHRVQLJOKHB-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN COCCOC[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 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GGBDRN COc1ccc(CS(=O)(=O)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000160478147 1424606721 /nfs/dbraw/zinc/60/67/21/1424606721.db2.gz ZHMFNLXTNUMRLW-UHFFFAOYSA-N 0 0 387.360 3.320 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(C)cc1OC[C@@H]1CCCO1 ZINC000160489552 1424608291 /nfs/dbraw/zinc/60/82/91/1424608291.db2.gz UNXOPNPYPPJKOD-KRWDZBQOSA-N 0 0 399.447 3.433 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(Cc2cccc(O)c2)CC2CC2)cc1[N+](=O)[O-] ZINC000160501421 1424609489 /nfs/dbraw/zinc/60/94/89/1424609489.db2.gz JVAAKPRHZHXVSA-UHFFFAOYSA-N 0 0 376.434 3.210 20 5 GGBDRN COc1ccc(OC)c(CCCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000160510710 1424609643 /nfs/dbraw/zinc/60/96/43/1424609643.db2.gz WCRYXSAKHYRFDT-UHFFFAOYSA-N 0 0 387.436 3.087 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1cccnc1 ZINC000160519907 1424610350 /nfs/dbraw/zinc/61/03/50/1424610350.db2.gz BSQMDEILVLIDCZ-MRXNPFEDSA-N 0 0 379.420 3.345 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000160535257 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CCOc1ccc([C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C(C)C)cc1OCC ZINC000160644915 1424622018 /nfs/dbraw/zinc/62/20/18/1424622018.db2.gz NGZALIPVEIOXLR-KRWDZBQOSA-N 0 0 390.440 3.253 20 5 GGBDRN CCOc1ccc([C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C(C)C)cc1OCC ZINC000160644799 1424622056 /nfs/dbraw/zinc/62/20/56/1424622056.db2.gz NGZALIPVEIOXLR-QGZVFWFLSA-N 0 0 390.440 3.253 20 5 GGBDRN CC1(C)C[C@H](Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)CCO1 ZINC000160672579 1424625243 /nfs/dbraw/zinc/62/52/43/1424625243.db2.gz VBFHXVIRVZWOKH-LLVKDONJSA-N 0 0 378.816 3.164 20 5 GGBDRN Cc1cc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc([N+](=O)[O-])c1F ZINC000180106335 1429740614 /nfs/dbraw/zinc/74/06/14/1429740614.db2.gz TUYTZCVMBODCKA-UHFFFAOYSA-N 0 0 397.384 3.164 20 5 GGBDRN CC1(C)C[C@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])CCO1 ZINC000160689386 1424627236 /nfs/dbraw/zinc/62/72/36/1424627236.db2.gz NLHSXXUVURSSMR-CQSZACIVSA-N 0 0 397.497 3.139 20 5 GGBDRN O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000160703828 1424627944 /nfs/dbraw/zinc/62/79/44/1424627944.db2.gz TYSGTQYQDJEIBX-HNNXBMFYSA-N 0 0 384.436 3.392 20 5 GGBDRN O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000160723847 1424629658 /nfs/dbraw/zinc/62/96/58/1424629658.db2.gz KYSAIYNFDOMXQJ-ZDUSSCGKSA-N 0 0 395.749 3.062 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)ONC(=O)CCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000160774226 1424634380 /nfs/dbraw/zinc/63/43/80/1424634380.db2.gz HMYUKYYVEKUDOL-OAHLLOKOSA-N 0 0 385.420 3.301 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000160778452 1424634541 /nfs/dbraw/zinc/63/45/41/1424634541.db2.gz SAHODCCFVCBJLP-OAHLLOKOSA-N 0 0 399.451 3.096 20 5 GGBDRN Cc1cccc(NC2CCN(C(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000160798311 1424635482 /nfs/dbraw/zinc/63/54/82/1424635482.db2.gz PGQMHZIUPSIXRE-UHFFFAOYSA-N 0 0 396.447 3.253 20 5 GGBDRN CC[C@H]1CCCC[C@@H]1N(C)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000160810722 1424636432 /nfs/dbraw/zinc/63/64/32/1424636432.db2.gz IUUQKFDXPPFKGN-JSGCOSHPSA-N 0 0 379.482 3.213 20 5 GGBDRN O=C(Cc1noc(-c2ccn(-c3ccccc3[N+](=O)[O-])n2)n1)Nc1ccccc1 ZINC000160825194 1424637265 /nfs/dbraw/zinc/63/72/65/1424637265.db2.gz CEPNERSSCYGPJU-UHFFFAOYSA-N 0 0 390.359 3.012 20 5 GGBDRN COc1ccccc1NC(=O)Cc1noc(Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000160839673 1424638075 /nfs/dbraw/zinc/63/80/75/1424638075.db2.gz BYILFFOWLXPEJQ-UHFFFAOYSA-N 0 0 382.376 3.067 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 ZINC000160844218 1424639018 /nfs/dbraw/zinc/63/90/18/1424639018.db2.gz LDBHOILFPMXZCV-UHFFFAOYSA-N 0 0 380.364 3.225 20 5 GGBDRN CC(C)COC[C@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000160863071 1424639572 /nfs/dbraw/zinc/63/95/72/1424639572.db2.gz VNVNVSYRDXPCMV-KRWDZBQOSA-N 0 0 375.425 3.443 20 5 GGBDRN CCOC(=O)C[C@H](C)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000160856670 1424640032 /nfs/dbraw/zinc/64/00/32/1424640032.db2.gz ZHZZCWXXCUHTGB-AWEZNQCLSA-N 0 0 385.420 3.278 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C12CCC2 ZINC000180110374 1429741754 /nfs/dbraw/zinc/74/17/54/1429741754.db2.gz DOTYMXIOPMHGIR-LSDHHAIUSA-N 0 0 386.445 3.011 20 5 GGBDRN CCc1cc(NC(=O)c2csc(NC(C)=O)n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000160874561 1424640814 /nfs/dbraw/zinc/64/08/14/1424640814.db2.gz GCZHCHXKNBZFPD-UHFFFAOYSA-N 0 0 385.405 3.373 20 5 GGBDRN CCS(=O)(=O)c1cccc(CC(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000160924588 1424644990 /nfs/dbraw/zinc/64/49/90/1424644990.db2.gz ZHRPEUXXYANVPT-UHFFFAOYSA-N 0 0 399.428 3.118 20 5 GGBDRN CC[C@@]1(c2ccc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)CCC(=O)NC1=O ZINC000160930451 1424645078 /nfs/dbraw/zinc/64/50/78/1424645078.db2.gz ONGZQJGHXZGAMT-FQEVSTJZSA-N 0 0 399.378 3.071 20 5 GGBDRN O=c1ccn(Cc2nc(-c3ccc(Oc4ccccc4)nc3)no2)cc1[N+](=O)[O-] ZINC000160940458 1424645921 /nfs/dbraw/zinc/64/59/21/1424645921.db2.gz DZZRMILSYVREAS-UHFFFAOYSA-N 0 0 391.343 3.042 20 5 GGBDRN Cc1nc(N2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)sc1C ZINC000160934291 1424645956 /nfs/dbraw/zinc/64/59/56/1424645956.db2.gz ZCYWEDMQMYODDX-UHFFFAOYSA-N 0 0 375.454 3.331 20 5 GGBDRN O=C(Nc1ccccc1O[C@@H]1CCOC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000160946830 1424646827 /nfs/dbraw/zinc/64/68/27/1424646827.db2.gz RDMGJHJQJYHVIY-CQSZACIVSA-N 0 0 394.387 3.201 20 5 GGBDRN O=C(NCCCc1nc2c(s1)CCCC2)NCCc1cccc([N+](=O)[O-])c1 ZINC000160942955 1424647079 /nfs/dbraw/zinc/64/70/79/1424647079.db2.gz SPFVBYUEKFKIBD-UHFFFAOYSA-N 0 0 388.493 3.405 20 5 GGBDRN CC[C@@H]1CCCC[C@@H]1N(C)C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000160961219 1424647612 /nfs/dbraw/zinc/64/76/12/1424647612.db2.gz PMAJZGBWXFKZNX-CVEARBPZSA-N 0 0 398.463 3.490 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccc(O)cc2)CC1 ZINC000160976674 1424649593 /nfs/dbraw/zinc/64/95/93/1424649593.db2.gz YTMDYFYLNGTNBK-UHFFFAOYSA-N 0 0 387.461 3.375 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)c2ccccc2)CC1 ZINC000161049759 1424654995 /nfs/dbraw/zinc/65/49/95/1424654995.db2.gz ZIQOEBQFCGJFJN-UHFFFAOYSA-N 0 0 399.472 3.305 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 ZINC000161058747 1424655038 /nfs/dbraw/zinc/65/50/38/1424655038.db2.gz RDBQWGXOPOANMT-CQSZACIVSA-N 0 0 391.493 3.228 20 5 GGBDRN CCC(=O)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000161054454 1424655221 /nfs/dbraw/zinc/65/52/21/1424655221.db2.gz DUIGYWAZYHUDKP-ZDUSSCGKSA-N 0 0 379.482 3.084 20 5 GGBDRN CCC(=O)N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)C1 ZINC000161056193 1424655231 /nfs/dbraw/zinc/65/52/31/1424655231.db2.gz VOYWHRQPWOTLLS-CYBMUJFWSA-N 0 0 391.493 3.370 20 5 GGBDRN CON(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCCc2sccc21 ZINC000161061163 1424655932 /nfs/dbraw/zinc/65/59/32/1424655932.db2.gz WOUGODHDJJYNCD-CYBMUJFWSA-N 0 0 397.478 3.328 20 5 GGBDRN CCCN(Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCS(=O)(=O)C1 ZINC000161074965 1424657212 /nfs/dbraw/zinc/65/72/12/1424657212.db2.gz HZQIBRJFXGTGQN-MRXNPFEDSA-N 0 0 395.506 3.117 20 5 GGBDRN Cn1cnc(-c2ccc(NC(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC000161082940 1424657285 /nfs/dbraw/zinc/65/72/85/1424657285.db2.gz JZWFKCRPBVTDBC-UHFFFAOYSA-N 0 0 380.408 3.447 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCOC2(C1)CCCCCC2 ZINC000161144189 1424661322 /nfs/dbraw/zinc/66/13/22/1424661322.db2.gz WDPPRBKZHDZYOU-UHFFFAOYSA-N 0 0 384.436 3.346 20 5 GGBDRN Cc1nc(N[C@@H]2CCOC(C)(C)C2)nc(N[C@@H]2CCOC(C)(C)C2)c1[N+](=O)[O-] ZINC000161143175 1424661821 /nfs/dbraw/zinc/66/18/21/1424661821.db2.gz JKWLBAOAJYHZFB-ZIAGYGMSSA-N 0 0 393.488 3.432 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C12CCC2 ZINC000161169531 1424664766 /nfs/dbraw/zinc/66/47/66/1424664766.db2.gz VEYSFROWVCMNIN-QZTJIDSGSA-N 0 0 384.436 3.200 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C12CCC2 ZINC000161169407 1424664961 /nfs/dbraw/zinc/66/49/61/1424664961.db2.gz VEYSFROWVCMNIN-ROUUACIJSA-N 0 0 384.436 3.200 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000161205275 1424666255 /nfs/dbraw/zinc/66/62/55/1424666255.db2.gz XEYVDCCDKPEPSY-HNNXBMFYSA-N 0 0 376.796 3.307 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)cccc1[N+](=O)[O-] ZINC000161207844 1424666393 /nfs/dbraw/zinc/66/63/93/1424666393.db2.gz UGMGGHQWIKBWEA-SFHVURJKSA-N 0 0 383.404 3.202 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2cc(C)ccn2)CC1 ZINC000161238926 1424668769 /nfs/dbraw/zinc/66/87/69/1424668769.db2.gz KHLBTKMYKVKKAS-UHFFFAOYSA-N 0 0 386.477 3.373 20 5 GGBDRN O=C(Nc1ccc(Br)nc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000161247904 1424669487 /nfs/dbraw/zinc/66/94/87/1424669487.db2.gz HNFCQFKQVLGXPQ-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN C[C@@H](C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1c(F)cccc1F ZINC000161245524 1424669500 /nfs/dbraw/zinc/66/95/00/1424669500.db2.gz OHOXAXWLNBTPIZ-NEPJUHHUSA-N 0 0 376.363 3.085 20 5 GGBDRN C[C@H](C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1c(F)cccc1F ZINC000161245622 1424670043 /nfs/dbraw/zinc/67/00/43/1424670043.db2.gz OHOXAXWLNBTPIZ-NWDGAFQWSA-N 0 0 376.363 3.085 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1Oc1ccc(F)nc1 ZINC000161260410 1424670681 /nfs/dbraw/zinc/67/06/81/1424670681.db2.gz AWQCPSYMFMMSDX-UHFFFAOYSA-N 0 0 395.412 3.486 20 5 GGBDRN COc1cc(C(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)ccc1[N+](=O)[O-] ZINC000161306101 1424675542 /nfs/dbraw/zinc/67/55/42/1424675542.db2.gz BZYYLIMTJOTWMT-GFCCVEGCSA-N 0 0 391.374 3.138 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000161314868 1424676359 /nfs/dbraw/zinc/67/63/59/1424676359.db2.gz MBWMFWZAZBKGNM-HNNXBMFYSA-N 0 0 376.796 3.307 20 5 GGBDRN O=C(Cc1noc(-c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1)NC1CCCC1 ZINC000161354991 1424681074 /nfs/dbraw/zinc/68/10/74/1424681074.db2.gz WDBFUGKYULSPDB-UHFFFAOYSA-N 0 0 384.314 3.265 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000161363360 1424682884 /nfs/dbraw/zinc/68/28/84/1424682884.db2.gz RNHWMSCFNMARJO-ZDUSSCGKSA-N 0 0 394.786 3.446 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000161425169 1424687327 /nfs/dbraw/zinc/68/73/27/1424687327.db2.gz NUYBSXRBOZEUKB-ZDUSSCGKSA-N 0 0 376.796 3.307 20 5 GGBDRN COc1ccccc1CN(Cc1cccs1)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000161452567 1424691589 /nfs/dbraw/zinc/69/15/89/1424691589.db2.gz MXFWLGFGRRJOQB-UHFFFAOYSA-N 0 0 386.433 3.241 20 5 GGBDRN COc1cc(OCC(=O)Nc2n[nH]c(-c3ccc(C)o3)c2C)ccc1[N+](=O)[O-] ZINC000161485765 1424694338 /nfs/dbraw/zinc/69/43/38/1424694338.db2.gz LOCZNUTYHKONRK-UHFFFAOYSA-N 0 0 386.364 3.221 20 5 GGBDRN CCO[C@@H](C)c1nc(CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cs1 ZINC000161499347 1424695608 /nfs/dbraw/zinc/69/56/08/1424695608.db2.gz GJRQTFRXFXDKSI-LBPRGKRZSA-N 0 0 375.450 3.276 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCc2cc3ccccc3[nH]2)cc([N+](=O)[O-])c1F ZINC000180112115 1429742567 /nfs/dbraw/zinc/74/25/67/1429742567.db2.gz LXFABGKZRAOOJA-UHFFFAOYSA-N 0 0 377.397 3.045 20 5 GGBDRN Cc1ccc(CCN(Cc2ccco2)C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1 ZINC000161534353 1424702802 /nfs/dbraw/zinc/70/28/02/1424702802.db2.gz AUCGEIXRMAZXHC-UHFFFAOYSA-N 0 0 397.435 3.147 20 5 GGBDRN COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000161549211 1424707619 /nfs/dbraw/zinc/70/76/19/1424707619.db2.gz ZVAWRKSZKIJJHD-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN CCn1nccc1CN1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000161557862 1424710430 /nfs/dbraw/zinc/71/04/30/1424710430.db2.gz RKKJMUYXYOZXCB-UHFFFAOYSA-N 0 0 383.374 3.152 20 5 GGBDRN C[C@@H]1CC(NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)O1 ZINC000161596420 1424720476 /nfs/dbraw/zinc/72/04/76/1424720476.db2.gz MCKKAMPKFTWTHH-ZIAGYGMSSA-N 0 0 377.441 3.104 20 5 GGBDRN COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000161598948 1424721240 /nfs/dbraw/zinc/72/12/40/1424721240.db2.gz CLXNEIYXVQXWLI-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NC1(c2cccc(Cl)c2)CCCC1 ZINC000161612291 1424724224 /nfs/dbraw/zinc/72/42/24/1424724224.db2.gz YPVGLSFRDMOTEN-UHFFFAOYSA-N 0 0 377.832 3.213 20 5 GGBDRN Cc1c(CC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)cccc1[N+](=O)[O-] ZINC000161633011 1424729857 /nfs/dbraw/zinc/72/98/57/1424729857.db2.gz GOSWLUXUECKFGU-UHFFFAOYSA-N 0 0 399.422 3.006 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccccc1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000161652240 1424733251 /nfs/dbraw/zinc/73/32/51/1424733251.db2.gz AGKFPGJCKARXRB-MGPUTAFESA-N 0 0 383.448 3.437 20 5 GGBDRN CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000161652099 1424733409 /nfs/dbraw/zinc/73/34/09/1424733409.db2.gz WFPYFQLSXDPULO-HNNXBMFYSA-N 0 0 389.477 3.060 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000161653158 1424733481 /nfs/dbraw/zinc/73/34/81/1424733481.db2.gz OLNFGVNLTHXWTL-INIZCTEOSA-N 0 0 396.321 3.307 20 5 GGBDRN CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000161679248 1424738987 /nfs/dbraw/zinc/73/89/87/1424738987.db2.gz PBPZNMVLGBOHTF-OAHLLOKOSA-N 0 0 376.482 3.404 20 5 GGBDRN Cc1ccc([C@H](NC(=O)Cn2cccc([N+](=O)[O-])c2=O)c2cccs2)cc1 ZINC000161703380 1424744873 /nfs/dbraw/zinc/74/48/73/1424744873.db2.gz BJQXIOJGHUTSRB-SFHVURJKSA-N 0 0 383.429 3.032 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC[C@@H]2c2ccc(COC)o2)c1[N+](=O)[O-] ZINC000161728787 1424752654 /nfs/dbraw/zinc/75/26/54/1424752654.db2.gz GHTSXALWFXQZAN-CQSZACIVSA-N 0 0 375.381 3.247 20 5 GGBDRN C[C@@]1(CO)CCC[C@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000161732686 1424754032 /nfs/dbraw/zinc/75/40/32/1424754032.db2.gz MCLDPZVRADVEME-CTNGQTDRSA-N 0 0 383.448 3.488 20 5 GGBDRN C[C@@]1(CO)CCC[C@@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000161732419 1424754073 /nfs/dbraw/zinc/75/40/73/1424754073.db2.gz MCLDPZVRADVEME-FPOVZHCZSA-N 0 0 383.448 3.488 20 5 GGBDRN C[C@]1(CO)CCC[C@@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 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1424905601 /nfs/dbraw/zinc/90/56/01/1424905601.db2.gz VGHCKXGXXRXWBB-GOSISDBHSA-N 0 0 392.502 3.257 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCOC[C@@H]1C[C@@H](O)c1cccs1 ZINC000162923559 1424906374 /nfs/dbraw/zinc/90/63/74/1424906374.db2.gz WMCJJGKUFRCIRO-GOEBONIOSA-N 0 0 391.449 3.321 20 5 GGBDRN C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000821581183 1424907031 /nfs/dbraw/zinc/90/70/31/1424907031.db2.gz FBPOVJGEDGADHV-INIZCTEOSA-N 0 0 387.831 3.143 20 5 GGBDRN CN(C)C(=O)c1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000162937461 1424908937 /nfs/dbraw/zinc/90/89/37/1424908937.db2.gz WRFZPZIYFFBDSP-UHFFFAOYSA-N 0 0 396.447 3.171 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(=O)Nc1cccc2cccnc21 ZINC000162993897 1424920630 /nfs/dbraw/zinc/92/06/30/1424920630.db2.gz LQSTYVFKWYFUKH-UHFFFAOYSA-N 0 0 379.376 3.212 20 5 GGBDRN CC[C@H](CSC)N(C)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000180152810 1429765221 /nfs/dbraw/zinc/76/52/21/1429765221.db2.gz 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ZINC000171756534 1425812619 /nfs/dbraw/zinc/81/26/19/1425812619.db2.gz ACIHROKMETUPAP-UHFFFAOYSA-N 0 0 382.376 3.363 20 5 GGBDRN CC(C)CCOC1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000171758424 1425813239 /nfs/dbraw/zinc/81/32/39/1425813239.db2.gz NMWFQXDVUPWHRS-IBGZPJMESA-N 0 0 375.469 3.227 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](c1ccccc1)c1cccnc1 ZINC000171768992 1425815591 /nfs/dbraw/zinc/81/55/91/1425815591.db2.gz LINSKPRVVOFOMT-IBGZPJMESA-N 0 0 383.429 3.366 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](c1ccccc1)c1cccnc1 ZINC000171768901 1425815594 /nfs/dbraw/zinc/81/55/94/1425815594.db2.gz LXDCDWFZAKGAJI-GOSISDBHSA-N 0 0 383.429 3.366 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](c1ccccc1)c1cccnc1 ZINC000171768782 1425815702 /nfs/dbraw/zinc/81/57/02/1425815702.db2.gz XPBRFQHYKRGWLR-IBGZPJMESA-N 0 0 383.429 3.366 20 5 GGBDRN O=C(OCCc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)N1CCCCC1=O ZINC000171770352 1425815903 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UJQXDDREMGKZAW-KRWDZBQOSA-N 0 0 390.823 3.495 20 5 GGBDRN COc1ccc(Cn2cc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cn2)cc1 ZINC000171790402 1425821339 /nfs/dbraw/zinc/82/13/39/1425821339.db2.gz WLDKXGBVJWMCIC-UHFFFAOYSA-N 0 0 380.404 3.120 20 5 GGBDRN COc1ccc(Cn2cc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)cn2)cc1 ZINC000171789877 1425821553 /nfs/dbraw/zinc/82/15/53/1425821553.db2.gz ZZTAGZOCIQNEID-UHFFFAOYSA-N 0 0 388.330 3.379 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC(c3c[nH]c4ccc(OC)cc43)CC2)c1[N+](=O)[O-] ZINC000171804294 1425824914 /nfs/dbraw/zinc/82/49/14/1425824914.db2.gz DDRCKJUILYAGGX-UHFFFAOYSA-N 0 0 397.435 3.390 20 5 GGBDRN COC(=O)c1ccc(-c2noc(-c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)n2)cc1 ZINC000171803746 1425824944 /nfs/dbraw/zinc/82/49/44/1425824944.db2.gz ZCYKXLYIACUVCE-UHFFFAOYSA-N 0 0 391.343 3.284 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)c1[N+](=O)[O-] ZINC000171804385 1425825022 /nfs/dbraw/zinc/82/50/22/1425825022.db2.gz VCYRLHGHJRXIGV-UHFFFAOYSA-N 0 0 385.355 3.137 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)c1[N+](=O)[O-] ZINC000171806761 1425825495 /nfs/dbraw/zinc/82/54/95/1425825495.db2.gz SHOWDSDWKZQIEC-UHFFFAOYSA-N 0 0 385.355 3.137 20 5 GGBDRN CCc1n[nH]c(C(=O)NC[C@H]2CCN(c3cc(Cl)ccc3C)C2)c1[N+](=O)[O-] ZINC000171807358 1425825780 /nfs/dbraw/zinc/82/57/80/1425825780.db2.gz WRBGAEIMLDWZOR-GFCCVEGCSA-N 0 0 391.859 3.098 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)c1[N+](=O)[O-] ZINC000171807862 1425825926 /nfs/dbraw/zinc/82/59/26/1425825926.db2.gz HAGJJKPRQKSENL-UHFFFAOYSA-N 0 0 382.342 3.361 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(OC)c(OC3CCCC3)c2)c1[N+](=O)[O-] ZINC000171809455 1425826329 /nfs/dbraw/zinc/82/63/29/1425826329.db2.gz LATOWMSAIPENPP-UHFFFAOYSA-N 0 0 388.424 3.140 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H](C)c2ccccc2F)c([N+](=O)[O-])cc1OC ZINC000171821654 1425828906 /nfs/dbraw/zinc/82/89/06/1425828906.db2.gz HIDSAQHOPIYGLQ-LBPRGKRZSA-N 0 0 376.384 3.214 20 5 GGBDRN COc1cc(CCNC(=O)[C@H](C)c2ccccc2F)c([N+](=O)[O-])cc1OC ZINC000171821656 1425829060 /nfs/dbraw/zinc/82/90/60/1425829060.db2.gz HIDSAQHOPIYGLQ-GFCCVEGCSA-N 0 0 376.384 3.214 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)n2)c1[N+](=O)[O-] ZINC000171825625 1425829939 /nfs/dbraw/zinc/82/99/39/1425829939.db2.gz GZWXQFKOJNENOC-UHFFFAOYSA-N 0 0 379.376 3.130 20 5 GGBDRN O=C(NCC[S@](=O)Cc1ccccc1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000171827644 1425830315 /nfs/dbraw/zinc/83/03/15/1425830315.db2.gz FFAROWQGQCQODL-SANMLTNESA-N 0 0 388.470 3.488 20 5 GGBDRN C[C@@H](NC(=O)NCCCC(=O)N1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000171838359 1425832369 /nfs/dbraw/zinc/83/23/69/1425832369.db2.gz IRCJGLOTDDJFPU-OAHLLOKOSA-N 0 0 396.447 3.278 20 5 GGBDRN C[C@@H](NC(=O)NCCCC(=O)N1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000171838400 1425832396 /nfs/dbraw/zinc/83/23/96/1425832396.db2.gz NFFLNOUJKZQSOX-OAHLLOKOSA-N 0 0 396.447 3.325 20 5 GGBDRN Cc1cc(C)c(CCNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000171864810 1425838029 /nfs/dbraw/zinc/83/80/29/1425838029.db2.gz IXSRPTKLPRRIRT-UHFFFAOYSA-N 0 0 379.416 3.334 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171869086 1425838990 /nfs/dbraw/zinc/83/89/90/1425838990.db2.gz GBQSSFRQHKIKNY-ICSRJNTNSA-N 0 0 393.399 3.086 20 5 GGBDRN CC(C)(C)CN(CC(F)(F)F)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000171868262 1425839020 /nfs/dbraw/zinc/83/90/20/1425839020.db2.gz DHDPPAAUPPSVQY-UHFFFAOYSA-N 0 0 396.387 3.049 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H](c1ccccc1)C(C)C ZINC000171873505 1425840393 /nfs/dbraw/zinc/84/03/93/1425840393.db2.gz KVLQREDPLDJWPH-GOSISDBHSA-N 0 0 385.420 3.398 20 5 GGBDRN CCOc1cc(C(=O)N2CCN(CC)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000171893148 1425845730 /nfs/dbraw/zinc/84/57/30/1425845730.db2.gz WLBFBILQWGLQBO-UHFFFAOYSA-N 0 0 385.420 3.489 20 5 GGBDRN CSc1nnnn1-c1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000171918471 1425851896 /nfs/dbraw/zinc/85/18/96/1425851896.db2.gz CIBLEVKINGSXJD-UHFFFAOYSA-N 0 0 390.812 3.198 20 5 GGBDRN CC(C)n1ncc2ccc(NC(=O)COc3ccc(C=O)cc3[N+](=O)[O-])cc21 ZINC000171924038 1425853890 /nfs/dbraw/zinc/85/38/90/1425853890.db2.gz PFOCYSDENMQFDR-UHFFFAOYSA-N 0 0 382.376 3.355 20 5 GGBDRN CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000171938056 1425856880 /nfs/dbraw/zinc/85/68/80/1425856880.db2.gz LRVNXFYRHABNJL-GOSISDBHSA-N 0 0 383.448 3.081 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1 ZINC000171938073 1425856957 /nfs/dbraw/zinc/85/69/57/1425856957.db2.gz QJAQAWUKTINWIP-KRWDZBQOSA-N 0 0 375.331 3.025 20 5 GGBDRN NC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000172012557 1425873439 /nfs/dbraw/zinc/87/34/39/1425873439.db2.gz REIZJDMUZIRSJM-ZDUSSCGKSA-N 0 0 385.445 3.084 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000172018701 1425875143 /nfs/dbraw/zinc/87/51/43/1425875143.db2.gz PNBZFHGTOHYPCT-UHFFFAOYSA-N 0 0 393.421 3.411 20 5 GGBDRN Cc1cc(NC(=O)C2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)no1 ZINC000172018364 1425875195 /nfs/dbraw/zinc/87/51/95/1425875195.db2.gz JNUMEQYWCLVXGE-UHFFFAOYSA-N 0 0 378.816 3.395 20 5 GGBDRN COc1ccc(C(=O)N2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 ZINC000172018595 1425875203 /nfs/dbraw/zinc/87/52/03/1425875203.db2.gz JYJAACSUFSFKNX-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000172018185 1425875306 /nfs/dbraw/zinc/87/53/06/1425875306.db2.gz KHNXVTQSFNZRMU-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN CS(=O)(=O)Nc1cccc2c1CCN(Cc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000172019862 1425875612 /nfs/dbraw/zinc/87/56/12/1425875612.db2.gz QOFZGKZWMSAUJS-UHFFFAOYSA-N 0 0 395.868 3.178 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](c2nccs2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000172020542 1425875647 /nfs/dbraw/zinc/87/56/47/1425875647.db2.gz CFVNBOLKFLMWGC-MRXNPFEDSA-N 0 0 389.458 3.428 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](c2ccccc2)c2cccnc2)ccc1[N+](=O)[O-] ZINC000172021151 1425876192 /nfs/dbraw/zinc/87/61/92/1425876192.db2.gz SDBAFJQLJXADRC-LJQANCHMSA-N 0 0 383.429 3.366 20 5 GGBDRN O=C1N[C@@]2(CCc3ccccc3C2)C(=O)N1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172022348 1425876277 /nfs/dbraw/zinc/87/62/77/1425876277.db2.gz CIXXISMLCDWBTL-LJQANCHMSA-N 0 0 385.807 3.228 20 5 GGBDRN Cc1cc([C@]2(C)NC(=O)N(Cc3cc([N+](=O)[O-])ccc3Cl)C2=O)c(C)o1 ZINC000172024539 1425876821 /nfs/dbraw/zinc/87/68/21/1425876821.db2.gz LQACBZYSUGHPHP-KRWDZBQOSA-N 0 0 377.784 3.425 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172024394 1425876849 /nfs/dbraw/zinc/87/68/49/1425876849.db2.gz DAXFHOQDEYDQQT-UHFFFAOYSA-N 0 0 386.751 3.428 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000172032212 1425878674 /nfs/dbraw/zinc/87/86/74/1425878674.db2.gz BXSVKRUVOOQORK-UHFFFAOYSA-N 0 0 390.823 3.393 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000172050257 1425882498 /nfs/dbraw/zinc/88/24/98/1425882498.db2.gz WKNAVDYZORGFCS-SANMLTNESA-N 0 0 377.422 3.134 20 5 GGBDRN O=[N+]([O-])c1cnn(Cc2nc(-c3ccc(OCc4ccccc4)cc3)no2)c1 ZINC000172050861 1425882807 /nfs/dbraw/zinc/88/28/07/1425882807.db2.gz JDICGRVZUWAOIK-UHFFFAOYSA-N 0 0 377.360 3.469 20 5 GGBDRN O=[N+]([O-])c1cnn(Cc2nc(-c3ccccc3OCc3ccccc3)no2)c1 ZINC000172051750 1425882996 /nfs/dbraw/zinc/88/29/96/1425882996.db2.gz RYINXCQRJBZUAO-UHFFFAOYSA-N 0 0 377.360 3.469 20 5 GGBDRN O=[N+]([O-])c1cnn(Cc2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c1 ZINC000172052617 1425883408 /nfs/dbraw/zinc/88/34/08/1425883408.db2.gz MKMVMXLBUFEGLN-UHFFFAOYSA-N 0 0 382.311 3.216 20 5 GGBDRN O=C(CC1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1)N1CCCC1 ZINC000172054482 1425883905 /nfs/dbraw/zinc/88/39/05/1425883905.db2.gz XPJDAGNDQJTXJK-UHFFFAOYSA-N 0 0 393.871 3.042 20 5 GGBDRN CCOC(=O)c1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000172061965 1425886582 /nfs/dbraw/zinc/88/65/82/1425886582.db2.gz AVZMAVDBOIEIHC-UHFFFAOYSA-N 0 0 376.796 3.284 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)NCc3ccc([N+](=O)[O-])cc3)cc2)no1 ZINC000172063793 1425887029 /nfs/dbraw/zinc/88/70/29/1425887029.db2.gz HAMLNXXOOZIBTG-UHFFFAOYSA-N 0 0 382.376 3.049 20 5 GGBDRN C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172075559 1425890199 /nfs/dbraw/zinc/89/01/99/1425890199.db2.gz GZUCDNRKTOQSJZ-NSHDSACASA-N 0 0 385.848 3.162 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2)C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172081958 1425892342 /nfs/dbraw/zinc/89/23/42/1425892342.db2.gz WJEMRFZEZZTZSI-QGZVFWFLSA-N 0 0 391.431 3.179 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 ZINC000172084814 1425893508 /nfs/dbraw/zinc/89/35/08/1425893508.db2.gz REQXUQLKMASAGG-UHFFFAOYSA-N 0 0 399.794 3.336 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000172093145 1425894574 /nfs/dbraw/zinc/89/45/74/1425894574.db2.gz YTQRTGTXHVLQTJ-XJKSGUPXSA-N 0 0 388.445 3.017 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cccc(C[S@](=O)c3ccccc3)c2)c1[N+](=O)[O-] ZINC000172094100 1425895095 /nfs/dbraw/zinc/89/50/95/1425895095.db2.gz JOZFGHKTMZFEFV-NDEPHWFRSA-N 0 0 398.444 3.440 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccccc1C(F)(F)F ZINC000172096777 1425895592 /nfs/dbraw/zinc/89/55/92/1425895592.db2.gz UDGLBXFAJBZQMD-AWEZNQCLSA-N 0 0 384.354 3.485 20 5 GGBDRN COc1c(C)cnc(CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000172113861 1425899872 /nfs/dbraw/zinc/89/98/72/1425899872.db2.gz OCCGLDCPAMQQSO-UHFFFAOYSA-N 0 0 377.828 3.470 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000172117100 1425901984 /nfs/dbraw/zinc/90/19/84/1425901984.db2.gz XJYJJQGOQOPPKY-LIRRHRJNSA-N 0 0 387.436 3.476 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172121031 1425903487 /nfs/dbraw/zinc/90/34/87/1425903487.db2.gz SYXQLHQUQPQGNG-AWEZNQCLSA-N 0 0 397.859 3.306 20 5 GGBDRN Cc1c(C(=O)NCCc2ccc3c(c2)CCO3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000172146510 1425919134 /nfs/dbraw/zinc/91/91/34/1425919134.db2.gz GLRHCZLDRGXQSP-UHFFFAOYSA-N 0 0 385.376 3.027 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC2(c3c(F)cccc3F)CCCC2)c1[N+](=O)[O-] ZINC000172159326 1425926850 /nfs/dbraw/zinc/92/68/50/1425926850.db2.gz VWGHSQZUQXRRKW-UHFFFAOYSA-N 0 0 378.379 3.400 20 5 GGBDRN O=C(Nc1ccc(OCC2CC2)cc1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000172163311 1425928156 /nfs/dbraw/zinc/92/81/56/1425928156.db2.gz WTHBDBZSVMQTGV-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN COc1cc(CCNC(=O)C2(c3cccc(F)c3)CC2)c([N+](=O)[O-])cc1OC ZINC000172189937 1425939447 /nfs/dbraw/zinc/93/94/47/1425939447.db2.gz ODJURLRFCMISKA-UHFFFAOYSA-N 0 0 388.395 3.142 20 5 GGBDRN Cc1csc(C2(NC(=O)c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)CCCC2)n1 ZINC000172212289 1425948956 /nfs/dbraw/zinc/94/89/56/1425948956.db2.gz TZXMRQOPYYUAPN-UHFFFAOYSA-N 0 0 398.444 3.401 20 5 GGBDRN CNC(=O)c1ccccc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000172225524 1425954543 /nfs/dbraw/zinc/95/45/43/1425954543.db2.gz NGUITMIMWVKGDL-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN COc1ccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000172228218 1425956256 /nfs/dbraw/zinc/95/62/56/1425956256.db2.gz OPSYLNSRHYDTSE-UHFFFAOYSA-N 0 0 382.775 3.481 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCc1ccc([N+](=O)[O-])cc1 ZINC000172231422 1425956903 /nfs/dbraw/zinc/95/69/03/1425956903.db2.gz PBXLDYUJBIEIAH-UHFFFAOYSA-N 0 0 379.756 3.242 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](OCc2ccncc2)C1 ZINC000172247102 1425965333 /nfs/dbraw/zinc/96/53/33/1425965333.db2.gz FOWIDLFDDLZOOX-YOEHRIQHSA-N 0 0 387.461 3.288 20 5 GGBDRN C[C@@H](c1ccc(NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1)N1CCOCC1 ZINC000172249966 1425966629 /nfs/dbraw/zinc/96/66/29/1425966629.db2.gz VJVMGMKRYLNSRO-HNNXBMFYSA-N 0 0 384.436 3.310 20 5 GGBDRN CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000172253630 1425969496 /nfs/dbraw/zinc/96/94/96/1425969496.db2.gz KXBASXYFEQSCJF-AWEZNQCLSA-N 0 0 382.482 3.287 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@@H](OCc2ccncc2)C1 ZINC000172255110 1425970107 /nfs/dbraw/zinc/97/01/07/1425970107.db2.gz WYEJXLXIYJIUFN-GOSISDBHSA-N 0 0 396.447 3.021 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(C(=O)N(C)C)CCCC1 ZINC000172272402 1425976801 /nfs/dbraw/zinc/97/68/01/1425976801.db2.gz XQSGGRRWDMMVSZ-UHFFFAOYSA-N 0 0 390.484 3.163 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1COc2ccccc2C1 ZINC000172275717 1425977959 /nfs/dbraw/zinc/97/79/59/1425977959.db2.gz KHCBILBIZYZUOB-CQSZACIVSA-N 0 0 376.796 3.137 20 5 GGBDRN COc1ccc(CN2CC[C@H](Nc3ccc(C(C)=O)cc3[N+](=O)[O-])C2=O)cc1 ZINC000172281131 1425978759 /nfs/dbraw/zinc/97/87/59/1425978759.db2.gz LQJUKWZDDZOJBL-SFHVURJKSA-N 0 0 383.404 3.019 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccc(C(F)(F)F)nc2C)cc([N+](=O)[O-])c1 ZINC000172313555 1425991974 /nfs/dbraw/zinc/99/19/74/1425991974.db2.gz LOMWVAMPRNSMRA-UHFFFAOYSA-N 0 0 383.282 3.356 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N[C@@H]2CS(=O)(=O)c3ccccc32)cc1[N+](=O)[O-] ZINC000172326738 1426000192 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HOSWIMLNYNKFGP-CQSZACIVSA-N 0 0 377.404 3.173 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000172348197 1426010697 /nfs/dbraw/zinc/01/06/97/1426010697.db2.gz LGHBSGNLNQAKDT-OAHLLOKOSA-N 0 0 387.392 3.279 20 5 GGBDRN C[C@H](NS(=O)(=O)c1cnc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000172356069 1426012814 /nfs/dbraw/zinc/01/28/14/1426012814.db2.gz HQEQZMORMFJXCW-QMMMGPOBSA-N 0 0 376.221 3.336 20 5 GGBDRN Cn1c(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2cc(Cl)ccc21 ZINC000172358461 1426013610 /nfs/dbraw/zinc/01/36/10/1426013610.db2.gz KKEWIIAMGZQULZ-CYBMUJFWSA-N 0 0 386.843 3.216 20 5 GGBDRN Cc1ccc(C2N=NC(=S)N2CC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000172361222 1426013658 /nfs/dbraw/zinc/01/36/58/1426013658.db2.gz MLDGRUZMAFTXII-UHFFFAOYSA-N 0 0 395.444 3.040 20 5 GGBDRN O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172360190 1426013928 /nfs/dbraw/zinc/01/39/28/1426013928.db2.gz MIKZRKOWJIXIIO-UHFFFAOYSA-N 0 0 394.214 3.221 20 5 GGBDRN O=C(c1ccc(CSc2nc[nH]n2)cc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172360043 1426014142 /nfs/dbraw/zinc/01/41/42/1426014142.db2.gz UPZGBKSVQYUVGY-UHFFFAOYSA-N 0 0 381.417 3.208 20 5 GGBDRN Cc1cccc(-c2n[nH]c(=S)n2CC(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000172361688 1426014612 /nfs/dbraw/zinc/01/46/12/1426014612.db2.gz FOTSKZUZOZOBBP-UHFFFAOYSA-N 0 0 395.444 3.414 20 5 GGBDRN COc1cc(CCNc2nc3ccccc3cc2CO)c([N+](=O)[O-])cc1OC ZINC000172362462 1426014648 /nfs/dbraw/zinc/01/46/48/1426014648.db2.gz ZNSPPUPSKAZNLZ-UHFFFAOYSA-N 0 0 383.404 3.307 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(OCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000172362629 1426014671 /nfs/dbraw/zinc/01/46/71/1426014671.db2.gz GWIWENIDNWTTFN-UHFFFAOYSA-N 0 0 385.420 3.352 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NCCc2nc3ccccc3[nH]2)c([N+](=O)[O-])c1 ZINC000172363259 1426014752 /nfs/dbraw/zinc/01/47/52/1426014752.db2.gz AFFQOFQFDKKWNP-UHFFFAOYSA-N 0 0 396.451 3.123 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(COc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000172365750 1426015753 /nfs/dbraw/zinc/01/57/53/1426015753.db2.gz QQUTZQRFDBECQT-UHFFFAOYSA-N 0 0 385.420 3.462 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(N(C)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000172371708 1426017662 /nfs/dbraw/zinc/01/76/62/1426017662.db2.gz WPVKAORMNWCRSC-UHFFFAOYSA-N 0 0 384.436 3.272 20 5 GGBDRN O=C(c1cc(-c2cccs2)on1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172397697 1426025655 /nfs/dbraw/zinc/02/56/55/1426025655.db2.gz BFLQBWBJDFVWGU-NSHDSACASA-N 0 0 385.405 3.033 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)nc1 ZINC000172400968 1426027064 /nfs/dbraw/zinc/02/70/64/1426027064.db2.gz RLWXFJIXTZNJSV-UHFFFAOYSA-N 0 0 383.452 3.130 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000172402697 1426027078 /nfs/dbraw/zinc/02/70/78/1426027078.db2.gz JEMPRIGBXDYYGA-NSHDSACASA-N 0 0 383.832 3.378 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc3[nH]c(-c4ccccn4)nc3c2)c1[N+](=O)[O-] ZINC000172409395 1426029773 /nfs/dbraw/zinc/02/97/73/1426029773.db2.gz UEGTZZMNXJCSKB-UHFFFAOYSA-N 0 0 377.364 3.071 20 5 GGBDRN Cc1c(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccn1 ZINC000172413931 1426031404 /nfs/dbraw/zinc/03/14/04/1426031404.db2.gz WACRGPICKCLWAM-UHFFFAOYSA-N 0 0 379.420 3.237 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172414843 1426031984 /nfs/dbraw/zinc/03/19/84/1426031984.db2.gz LBFIUEDTVGWMBW-WMZOPIPTSA-N 0 0 389.496 3.318 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cccc(N2C(=O)CCC2=O)c1 ZINC000172415063 1426032574 /nfs/dbraw/zinc/03/25/74/1426032574.db2.gz HWYVYBFECKNQGR-UHFFFAOYSA-N 0 0 395.415 3.001 20 5 GGBDRN COc1ccc2c(c1)OC[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C2 ZINC000172415460 1426032895 /nfs/dbraw/zinc/03/28/95/1426032895.db2.gz HKJHBTLWTPQWSD-QGZVFWFLSA-N 0 0 384.432 3.294 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1csc(-c2cnccn2)n1 ZINC000172415446 1426033005 /nfs/dbraw/zinc/03/30/05/1426033005.db2.gz GEIWATODZWQGQA-UHFFFAOYSA-N 0 0 383.433 3.261 20 5 GGBDRN Cc1cc(CNC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)on1 ZINC000172417132 1426034616 /nfs/dbraw/zinc/03/46/16/1426034616.db2.gz OPFFYIMNKFYOTM-UHFFFAOYSA-N 0 0 396.190 3.314 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])c1c(F)cccc1F ZINC000172420096 1426035347 /nfs/dbraw/zinc/03/53/47/1426035347.db2.gz YQCUYVBYCMVNPX-OAHLLOKOSA-N 0 0 389.358 3.030 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CCCO1 ZINC000172420349 1426035363 /nfs/dbraw/zinc/03/53/63/1426035363.db2.gz RREGBJHSLLDOOW-JTQLQIEISA-N 0 0 399.234 3.338 20 5 GGBDRN CC(C)S(=O)(=O)c1ccccc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000172419921 1426035613 /nfs/dbraw/zinc/03/56/13/1426035613.db2.gz CWXCYGVHWDRVIX-UHFFFAOYSA-N 0 0 391.449 3.441 20 5 GGBDRN Nc1cc(CCCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)nn1-c1ccccc1 ZINC000172420197 1426035651 /nfs/dbraw/zinc/03/56/51/1426035651.db2.gz YIWYNGWXZBZPGR-UHFFFAOYSA-N 0 0 399.838 3.379 20 5 GGBDRN C[C@H](c1ccccc1)N1C[C@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])CC1=O ZINC000172422931 1426036658 /nfs/dbraw/zinc/03/66/58/1426036658.db2.gz PSNLOHQVUOTFCM-GDBMZVCRSA-N 0 0 379.416 3.094 20 5 GGBDRN COc1ccc(C)cc1-n1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000172422393 1426036752 /nfs/dbraw/zinc/03/67/52/1426036752.db2.gz KTJRIAWSBMIWOG-UHFFFAOYSA-N 0 0 378.388 3.300 20 5 GGBDRN Cc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000172421545 1426037184 /nfs/dbraw/zinc/03/71/84/1426037184.db2.gz MMKLVPAEOQFVKI-UHFFFAOYSA-N 0 0 386.320 3.231 20 5 GGBDRN Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])c12 ZINC000172421717 1426037194 /nfs/dbraw/zinc/03/71/94/1426037194.db2.gz QCSHNYIZJAEGTQ-UHFFFAOYSA-N 0 0 377.404 3.265 20 5 GGBDRN C[C@@H](c1ccccc1)N1C[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])CC1=O ZINC000172422934 1426037263 /nfs/dbraw/zinc/03/72/63/1426037263.db2.gz PSNLOHQVUOTFCM-HOCLYGCPSA-N 0 0 379.416 3.094 20 5 GGBDRN CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172423056 1426037498 /nfs/dbraw/zinc/03/74/98/1426037498.db2.gz OIHFGGCIGBXPGL-KRWDZBQOSA-N 0 0 381.432 3.012 20 5 GGBDRN Cc1cc2nc(C)c(CCC(=O)N3CCc4c3cccc4[N+](=O)[O-])c(C)n2n1 ZINC000172423541 1426037919 /nfs/dbraw/zinc/03/79/19/1426037919.db2.gz OOAIXEBKFFBICA-UHFFFAOYSA-N 0 0 379.420 3.085 20 5 GGBDRN CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172423059 1426038055 /nfs/dbraw/zinc/03/80/55/1426038055.db2.gz OIHFGGCIGBXPGL-QGZVFWFLSA-N 0 0 381.432 3.012 20 5 GGBDRN O=C([C@@H]1CC(=O)N(c2ccccc2Cl)C1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424367 1426038371 /nfs/dbraw/zinc/03/83/71/1426038371.db2.gz FOKAYADJAXLROC-GFCCVEGCSA-N 0 0 385.807 3.190 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424406 1426038447 /nfs/dbraw/zinc/03/84/47/1426038447.db2.gz WLHVPRYBGVRCEJ-UHFFFAOYSA-N 0 0 392.165 3.468 20 5 GGBDRN CCOc1ccccc1C(=O)NCCCC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424359 1426038620 /nfs/dbraw/zinc/03/86/20/1426038620.db2.gz OAOQDUGTSYGHSS-UHFFFAOYSA-N 0 0 397.431 3.093 20 5 GGBDRN CCOc1ccccc1[C@@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])NC(C)=O ZINC000172424594 1426038691 /nfs/dbraw/zinc/03/86/91/1426038691.db2.gz NRRFBKNYVXZXDN-QGZVFWFLSA-N 0 0 397.431 3.150 20 5 GGBDRN O=C(NC1CCC(C(=O)N2CCc3c2cccc3[N+](=O)[O-])CC1)C1CCCC1 ZINC000172424690 1426038792 /nfs/dbraw/zinc/03/87/92/1426038792.db2.gz OAGUQHSXXDEKSJ-UHFFFAOYSA-N 0 0 385.464 3.349 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000172425668 1426039219 /nfs/dbraw/zinc/03/92/19/1426039219.db2.gz UATGUBCKUPGRAJ-IYBDPMFKSA-N 0 0 395.459 3.407 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172425102 1426039375 /nfs/dbraw/zinc/03/93/75/1426039375.db2.gz NSLYDBFAIHMQMU-UHFFFAOYSA-N 0 0 390.399 3.169 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCCN(C)c3ccccc32)cc1OC ZINC000172428164 1426040694 /nfs/dbraw/zinc/04/06/94/1426040694.db2.gz DAFYZXQNDJIYLP-UHFFFAOYSA-N 0 0 385.420 3.489 20 5 GGBDRN 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393.447 3.491 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(CC(F)(F)F)C1 ZINC000172573444 1426093705 /nfs/dbraw/zinc/09/37/05/1426093705.db2.gz KSZDSJUWVXZHGA-HNNXBMFYSA-N 0 0 387.402 3.308 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)[nH]c1=O ZINC000172573619 1426094185 /nfs/dbraw/zinc/09/41/85/1426094185.db2.gz MUAJPBVVLONHKK-UHFFFAOYSA-N 0 0 383.326 3.055 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCn2c(nnc2C(F)(F)F)C1 ZINC000172602628 1426108762 /nfs/dbraw/zinc/10/87/62/1426108762.db2.gz GDUODINTXUYJPA-UHFFFAOYSA-N 0 0 397.338 3.076 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1C[C@H](c2ccccc2C)C[C@H]1C ZINC000172636121 1426121820 /nfs/dbraw/zinc/12/18/20/1426121820.db2.gz MINVLYCMALPOCS-HUUCEWRRSA-N 0 0 397.431 3.255 20 5 GGBDRN CC(C)Oc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000172664673 1426134215 /nfs/dbraw/zinc/13/42/15/1426134215.db2.gz JNPPBLHDSIRPRR-UHFFFAOYSA-N 0 0 383.448 3.340 20 5 GGBDRN 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CC(C)OC(=O)[C@@H](C)CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000173003492 1426304832 /nfs/dbraw/zinc/30/48/32/1426304832.db2.gz XYEBTXTZRPDYNP-NSHDSACASA-N 0 0 377.422 3.036 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)Cc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000173005125 1426304917 /nfs/dbraw/zinc/30/49/17/1426304917.db2.gz SSBOTCRLCKZNOH-GOSISDBHSA-N 0 0 399.472 3.294 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000173005751 1426305121 /nfs/dbraw/zinc/30/51/21/1426305121.db2.gz LIDIQWIKHSPKGQ-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)Cc2cccc([N+](=O)[O-])c2)cc1C ZINC000173005971 1426305196 /nfs/dbraw/zinc/30/51/96/1426305196.db2.gz INPRASYZISCXTI-SFHVURJKSA-N 0 0 399.472 3.294 20 5 GGBDRN CC(=O)N1CC(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 ZINC000173035964 1426317660 /nfs/dbraw/zinc/31/76/60/1426317660.db2.gz QAFBJUDSSMXCEQ-UHFFFAOYSA-N 0 0 389.795 3.001 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])c1noc(C)n1 ZINC000173036312 1426318283 /nfs/dbraw/zinc/31/82/83/1426318283.db2.gz GTACKLWYXFTNDA-QGZVFWFLSA-N 0 0 382.376 3.123 20 5 GGBDRN CCc1cnc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)s1 ZINC000173045215 1426321476 /nfs/dbraw/zinc/32/14/76/1426321476.db2.gz RLSJPFDKHJQPNY-UHFFFAOYSA-N 0 0 377.469 3.490 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000173055419 1426324940 /nfs/dbraw/zinc/32/49/40/1426324940.db2.gz JXBXKIXWKZUISS-AWEZNQCLSA-N 0 0 391.374 3.134 20 5 GGBDRN O=C(NCCc1ccc2c(c1)OCCO2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173070918 1426330987 /nfs/dbraw/zinc/33/09/87/1426330987.db2.gz YNRMZTBAHZHESP-UHFFFAOYSA-N 0 0 396.321 3.357 20 5 GGBDRN C[C@H](c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1)N1CCOCC1 ZINC000173089576 1426337789 /nfs/dbraw/zinc/33/77/89/1426337789.db2.gz KMJDUXMHDICZHY-MRXNPFEDSA-N 0 0 398.463 3.063 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000173090756 1426338192 /nfs/dbraw/zinc/33/81/92/1426338192.db2.gz ONKRGJYZABQSCF-SNVBAGLBSA-N 0 0 384.348 3.046 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000173091257 1426338257 /nfs/dbraw/zinc/33/82/57/1426338257.db2.gz OOPWKTHDMCYSOF-JTQLQIEISA-N 0 0 398.375 3.355 20 5 GGBDRN Cc1nnc([C@H]2Cc3ccccc3CN2C(=O)Cc2cccc([N+](=O)[O-])c2)o1 ZINC000173101225 1426342059 /nfs/dbraw/zinc/34/20/59/1426342059.db2.gz BLSIVHLWNFXOOF-GOSISDBHSA-N 0 0 378.388 3.155 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)c(C)c1[N+](=O)[O-] ZINC000173103684 1426343297 /nfs/dbraw/zinc/34/32/97/1426343297.db2.gz AYNGIACIVQERCH-KRWDZBQOSA-N 0 0 376.432 3.321 20 5 GGBDRN CN(CC(=O)NCc1ccnc(N2CCCCCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000173122894 1426352307 /nfs/dbraw/zinc/35/23/07/1426352307.db2.gz KRMZUBRMDCZYHU-UHFFFAOYSA-N 0 0 397.479 3.123 20 5 GGBDRN CCn1nc(C)c(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1Cl ZINC000173140080 1426361374 /nfs/dbraw/zinc/36/13/74/1426361374.db2.gz IOXQVHOMQBKAMX-UHFFFAOYSA-N 0 0 379.848 3.313 20 5 GGBDRN Cc1noc(-c2ccccc2C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])n1 ZINC000173140000 1426361406 /nfs/dbraw/zinc/36/14/06/1426361406.db2.gz XGEHIXJFGPQCAO-UHFFFAOYSA-N 0 0 395.419 3.494 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000173142582 1426362651 /nfs/dbraw/zinc/36/26/51/1426362651.db2.gz CHLUAKAHIOOVKE-YVEFUNNKSA-N 0 0 387.823 3.479 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173144381 1426363774 /nfs/dbraw/zinc/36/37/74/1426363774.db2.gz ZUDMWQGRQMWRCA-KRWDZBQOSA-N 0 0 378.388 3.001 20 5 GGBDRN CN(CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccccc1[N+](=O)[O-] ZINC000173150963 1426366828 /nfs/dbraw/zinc/36/68/28/1426366828.db2.gz ZTULSWQFEKBCEK-INIZCTEOSA-N 0 0 397.431 3.166 20 5 GGBDRN CCCC[C@H](COC)NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173154285 1426367872 /nfs/dbraw/zinc/36/78/72/1426367872.db2.gz KJLKEVUBZJGMFA-OAHLLOKOSA-N 0 0 379.457 3.353 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)CCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000173155650 1426368895 /nfs/dbraw/zinc/36/88/95/1426368895.db2.gz OGCDFZGIRSZVHO-LBPRGKRZSA-N 0 0 376.331 3.436 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C2CC2)s1 ZINC000173173293 1426376816 /nfs/dbraw/zinc/37/68/16/1426376816.db2.gz RJIFTUNYSDQBHZ-ZDUSSCGKSA-N 0 0 394.840 3.219 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1(N2CCOCC2)CCCC1 ZINC000173181380 1426380513 /nfs/dbraw/zinc/38/05/13/1426380513.db2.gz WDFQGIZINCWYCU-CYBMUJFWSA-N 0 0 381.860 3.012 20 5 GGBDRN CN(CCC(=O)Nc1cc(N)ccc1F)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000173186934 1426382809 /nfs/dbraw/zinc/38/28/09/1426382809.db2.gz TZKMZRKZVURCEB-UHFFFAOYSA-N 0 0 380.807 3.430 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cl)c1C(N)=O ZINC000173189071 1426383394 /nfs/dbraw/zinc/38/33/94/1426383394.db2.gz WNGZDENPWYWNGL-SECBINFHSA-N 0 0 379.825 3.466 20 5 GGBDRN Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)CCn3cc([N+](=O)[O-])nc3C)cc2)n1 ZINC000173197707 1426387681 /nfs/dbraw/zinc/38/76/81/1426387681.db2.gz FWXOHXQSRVQTAT-OAHLLOKOSA-N 0 0 396.451 3.170 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)CCO2 ZINC000173210709 1426396025 /nfs/dbraw/zinc/39/60/25/1426396025.db2.gz MSYMLYQUOKRRRM-UHFFFAOYSA-N 0 0 383.404 3.243 20 5 GGBDRN CC(C)C[C@H]1CCN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000173218007 1426400942 /nfs/dbraw/zinc/40/09/42/1426400942.db2.gz OAMRZVFTDGRTLI-LLVKDONJSA-N 0 0 385.367 3.029 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000173221602 1426404515 /nfs/dbraw/zinc/40/45/15/1426404515.db2.gz IREAXGIWMULUIR-INIZCTEOSA-N 0 0 399.447 3.412 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](C)c2nc(C3CCCCC3)no2)c(C)c1[N+](=O)[O-] ZINC000173228135 1426412504 /nfs/dbraw/zinc/41/25/04/1426412504.db2.gz CWFBDWYKHFVGLF-GFCCVEGCSA-N 0 0 390.444 3.106 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)ccc1[N+](=O)[O-] ZINC000173230128 1426414844 /nfs/dbraw/zinc/41/48/44/1426414844.db2.gz WMGRNCUEZROQJC-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1 ZINC000173230635 1426415840 /nfs/dbraw/zinc/41/58/40/1426415840.db2.gz YESGXXHTAGARPI-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN CCC(O)(CC)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000173241694 1426425740 /nfs/dbraw/zinc/42/57/40/1426425740.db2.gz HSZFFDOPMFJNSM-AWEZNQCLSA-N 0 0 386.452 3.444 20 5 GGBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)c1nc(C2CCCCC2)no1 ZINC000173253292 1426432709 /nfs/dbraw/zinc/43/27/09/1426432709.db2.gz SVMMYWJYMXMNRD-VIFPVBQESA-N 0 0 377.376 3.238 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000173254450 1426433712 /nfs/dbraw/zinc/43/37/12/1426433712.db2.gz OCDJGECRLHIAJI-OCCSQVGLSA-N 0 0 380.422 3.358 20 5 GGBDRN Cc1nn(CCC(=O)Nc2c3nsnc3ccc2Cl)c(C)c1[N+](=O)[O-] ZINC000173264132 1426442857 /nfs/dbraw/zinc/44/28/57/1426442857.db2.gz GOWGGPJGMQUPPS-UHFFFAOYSA-N 0 0 380.817 3.095 20 5 GGBDRN CCc1ccc(C(=O)N(C)Cc2ccccc2N2CCOCC2)cc1[N+](=O)[O-] ZINC000173274827 1426453688 /nfs/dbraw/zinc/45/36/88/1426453688.db2.gz MIWQVGOIIOYXBY-UHFFFAOYSA-N 0 0 383.448 3.266 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(C)n3nc(C(F)(F)F)nc3n2)cc1[N+](=O)[O-] ZINC000173278793 1426456260 /nfs/dbraw/zinc/45/62/60/1426456260.db2.gz HFVNXIBSHPHURT-UHFFFAOYSA-N 0 0 394.313 3.174 20 5 GGBDRN CCSCC[C@@H](C)NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000173283048 1426458718 /nfs/dbraw/zinc/45/87/18/1426458718.db2.gz WHAQTSVSNSWJEO-PBHICJAKSA-N 0 0 393.509 3.156 20 5 GGBDRN CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000173286429 1426465449 /nfs/dbraw/zinc/46/54/49/1426465449.db2.gz IRAPCJXPUODGSO-QGZVFWFLSA-N 0 0 383.448 3.285 20 5 GGBDRN C[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)[C@@H]1C ZINC000173289603 1426468751 /nfs/dbraw/zinc/46/87/51/1426468751.db2.gz ISOKOKAXHCTMIB-NXEZZACHSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)cc1 ZINC000173293149 1426472966 /nfs/dbraw/zinc/47/29/66/1426472966.db2.gz QFHATOSLNCOTDZ-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CC2)cc1 ZINC000173294508 1426474573 /nfs/dbraw/zinc/47/45/73/1426474573.db2.gz PRGWNFTXTGERKP-UHFFFAOYSA-N 0 0 395.459 3.318 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000173295603 1426476011 /nfs/dbraw/zinc/47/60/11/1426476011.db2.gz KCKUAQYUJGWMSQ-AWEZNQCLSA-N 0 0 375.425 3.274 20 5 GGBDRN CCc1ccc(C(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)cc1[N+](=O)[O-] ZINC000173303584 1426486124 /nfs/dbraw/zinc/48/61/24/1426486124.db2.gz LUZTZWFLVSBFOS-UHFFFAOYSA-N 0 0 388.445 3.154 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000173305776 1426486953 /nfs/dbraw/zinc/48/69/53/1426486953.db2.gz LEYZPYCJHJLSQI-UHFFFAOYSA-N 0 0 381.388 3.453 20 5 GGBDRN CC(C)C1CCN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000173327393 1426509336 /nfs/dbraw/zinc/50/93/36/1426509336.db2.gz VQKWWQAAEMPRJF-UHFFFAOYSA-N 0 0 385.367 3.029 20 5 GGBDRN C[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC000173342613 1426522295 /nfs/dbraw/zinc/52/22/95/1426522295.db2.gz RWUWYALLDMFCLG-AWEZNQCLSA-N 0 0 396.447 3.257 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1[N+](=O)[O-] ZINC000173359190 1426534303 /nfs/dbraw/zinc/53/43/03/1426534303.db2.gz MPYLTYKZTSHPGF-UHFFFAOYSA-N 0 0 396.447 3.111 20 5 GGBDRN CC[NH+](CC)Cc1ccc(CNc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])cc1 ZINC000821197308 1426543054 /nfs/dbraw/zinc/54/30/54/1426543054.db2.gz ITBHMULWKORERY-UHFFFAOYSA-N 0 0 381.440 3.229 20 5 GGBDRN CC(C)CNC(=O)c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000173372277 1426544423 /nfs/dbraw/zinc/54/44/23/1426544423.db2.gz NKKABVJGQFZFFE-UHFFFAOYSA-N 0 0 384.436 3.056 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)c1[N+](=O)[O-] ZINC000173379736 1426552674 /nfs/dbraw/zinc/55/26/74/1426552674.db2.gz OHUZTVPSSMOYSK-UHFFFAOYSA-N 0 0 388.815 3.421 20 5 GGBDRN COc1ccc([C@@H](C)CCNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 ZINC000173380548 1426554959 /nfs/dbraw/zinc/55/49/59/1426554959.db2.gz LBNPQEQMXDFPLN-LBPRGKRZSA-N 0 0 382.413 3.215 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(OC)cc2C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000173393416 1426570817 /nfs/dbraw/zinc/57/08/17/1426570817.db2.gz TZSWFWRDTUOBJL-UHFFFAOYSA-N 0 0 383.404 3.310 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)CCNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173394059 1426572695 /nfs/dbraw/zinc/57/26/95/1426572695.db2.gz LQWTZDYPVJEREX-UHFFFAOYSA-N 0 0 375.812 3.244 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1csc(NC(=O)C(C)(C)C)n1 ZINC000173400624 1426582257 /nfs/dbraw/zinc/58/22/57/1426582257.db2.gz PMVDMVLYXHFCPY-UHFFFAOYSA-N 0 0 390.465 3.237 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[C@H]1CCCN1C(=O)OC(C)(C)C ZINC000173399987 1426582914 /nfs/dbraw/zinc/58/29/14/1426582914.db2.gz NJNURWUZQBFSNK-OAHLLOKOSA-N 0 0 377.441 3.343 20 5 GGBDRN C[C@H](NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 ZINC000173400315 1426582962 /nfs/dbraw/zinc/58/29/62/1426582962.db2.gz VMOFHINKOVSLDI-HNNXBMFYSA-N 0 0 388.468 3.031 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@@H](C)Oc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000173414199 1426597369 /nfs/dbraw/zinc/59/73/69/1426597369.db2.gz JPFLINXHIFPSTQ-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1nccc(-c2cccc(NC(=O)CN(C)c3ccccc3[N+](=O)[O-])c2)n1 ZINC000173415134 1426598404 /nfs/dbraw/zinc/59/84/04/1426598404.db2.gz BCNWDURVMRYRNJ-UHFFFAOYSA-N 0 0 377.404 3.435 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[N@H+](CCCOc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000826500422 1426598740 /nfs/dbraw/zinc/59/87/40/1426598740.db2.gz YCVFRZCIZFIIIZ-UHFFFAOYSA-N 0 0 394.435 3.208 20 5 GGBDRN Cc1ccc(O[C@@H](C)CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000173422704 1426604256 /nfs/dbraw/zinc/60/42/56/1426604256.db2.gz LRDDGNJPJJJYNB-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1 ZINC000173425147 1426606948 /nfs/dbraw/zinc/60/69/48/1426606948.db2.gz YRRJKFDJYCVWPM-GUYCJALGSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccc2oc(=O)n(CN3CCC(Oc4ccc([N+](=O)[O-])cc4)CC3)c2c1 ZINC000173435605 1426616089 /nfs/dbraw/zinc/61/60/89/1426616089.db2.gz CDTBZHBVTUSCPR-UHFFFAOYSA-N 0 0 383.404 3.312 20 5 GGBDRN CN(C)c1nn(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(=S)s1 ZINC000173435347 1426616605 /nfs/dbraw/zinc/61/66/05/1426616605.db2.gz FEQRJMJNVUAHNF-UHFFFAOYSA-N 0 0 395.510 3.149 20 5 GGBDRN O=C1C[C@H](c2ccccc2)N1CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173434769 1426616752 /nfs/dbraw/zinc/61/67/52/1426616752.db2.gz HVVJACDPGWCFFM-HXUWFJFHSA-N 0 0 381.432 3.369 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)cc1[N+](=O)[O-] ZINC000173446475 1426626275 /nfs/dbraw/zinc/62/62/75/1426626275.db2.gz IDCYMRUFRHSJCZ-UHFFFAOYSA-N 0 0 397.431 3.190 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000173457309 1426633130 /nfs/dbraw/zinc/63/31/30/1426633130.db2.gz YSBNQDMGUGUQTL-KXBFYZLASA-N 0 0 386.452 3.477 20 5 GGBDRN 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BOEFEVKIPBFXPU-UHFFFAOYSA-N 0 0 377.784 3.094 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000173617946 1426799407 /nfs/dbraw/zinc/79/94/07/1426799407.db2.gz BHKYLUDCIQHESY-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H](C)Oc1ccc(Cl)cc1 ZINC000173618076 1426799504 /nfs/dbraw/zinc/79/95/04/1426799504.db2.gz GCIQVDBCNNBQBR-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)s1 ZINC000173619385 1426800070 /nfs/dbraw/zinc/80/00/70/1426800070.db2.gz JBUKVXIXUKYNGW-INIZCTEOSA-N 0 0 383.433 3.427 20 5 GGBDRN O=C(Cc1ccc(NC(=O)C2CC2)cc1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000173618890 1426800188 /nfs/dbraw/zinc/80/01/88/1426800188.db2.gz RMZQXYSQSBRSKH-UHFFFAOYSA-N 0 0 379.416 3.465 20 5 GGBDRN CC(C)(C)OC(=O)N(CC(=O)N1CCc2c1cccc2[N+](=O)[O-])CC1CC1 ZINC000173619620 1426800519 /nfs/dbraw/zinc/80/05/19/1426800519.db2.gz BHJZSJUFWKZQPP-UHFFFAOYSA-N 0 0 375.425 3.131 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000173626018 1426802223 /nfs/dbraw/zinc/80/22/23/1426802223.db2.gz CTVVZAFLMVGJCC-LLVKDONJSA-N 0 0 388.811 3.269 20 5 GGBDRN COc1ccc2c(c1)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H](C)O2 ZINC000173632341 1426803413 /nfs/dbraw/zinc/80/34/13/1426803413.db2.gz MJYRKZJXVXZWIZ-NSHDSACASA-N 0 0 391.811 3.483 20 5 GGBDRN C[C@@H](CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)c1cccc(F)c1 ZINC000173633254 1426803634 /nfs/dbraw/zinc/80/36/34/1426803634.db2.gz TUSVAVXYQXKNES-HNNXBMFYSA-N 0 0 399.422 3.292 20 5 GGBDRN COc1ccc2c(c1)N(Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)C[C@@H](C)O2 ZINC000173633546 1426804216 /nfs/dbraw/zinc/80/42/16/1426804216.db2.gz KUEOHKUHCIPUQB-GFCCVEGCSA-N 0 0 382.376 3.441 20 5 GGBDRN Cc1cccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1[N+](=O)[O-] ZINC000173634433 1426804418 /nfs/dbraw/zinc/80/44/18/1426804418.db2.gz FHODUFUCYZALDL-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)cc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173634649 1426804478 /nfs/dbraw/zinc/80/44/78/1426804478.db2.gz HUYQPIUSDJLDPB-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN C[S@@](=O)c1ccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173636620 1426805058 /nfs/dbraw/zinc/80/50/58/1426805058.db2.gz QZRWLBFVBIKENM-HHHXNRCGSA-N 0 0 388.445 3.016 20 5 GGBDRN O=C(c1ccn(-c2ccccc2)n1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173636807 1426805091 /nfs/dbraw/zinc/80/50/91/1426805091.db2.gz IFHXHGSDMZVDDT-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN COc1cc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000173637459 1426805441 /nfs/dbraw/zinc/80/54/41/1426805441.db2.gz XWPWIRXHUAHVEY-KRWDZBQOSA-N 0 0 397.431 3.028 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000173638439 1426805735 /nfs/dbraw/zinc/80/57/35/1426805735.db2.gz DMRMKDZQAADDKW-NSHDSACASA-N 0 0 384.358 3.429 20 5 GGBDRN CC(C)c1noc(CCC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000173638688 1426805754 /nfs/dbraw/zinc/80/57/54/1426805754.db2.gz RGWBVMNTFNNQCR-UHFFFAOYSA-N 0 0 388.424 3.104 20 5 GGBDRN O=C(C[C@H]1C(=O)Nc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173639355 1426806057 /nfs/dbraw/zinc/80/60/57/1426806057.db2.gz OWKZSVCKVSCVOL-GOSISDBHSA-N 0 0 395.415 3.091 20 5 GGBDRN O=C(C[C@@H]1C(=O)Nc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173639342 1426806172 /nfs/dbraw/zinc/80/61/72/1426806172.db2.gz OWKZSVCKVSCVOL-SFHVURJKSA-N 0 0 395.415 3.091 20 5 GGBDRN O=C([C@@H]1COc2ccccc2C1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173640400 1426806489 /nfs/dbraw/zinc/80/64/89/1426806489.db2.gz VJWOBLYGDAXNOU-INIZCTEOSA-N 0 0 382.416 3.216 20 5 GGBDRN O=C([C@H]1COc2ccccc2C1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173640409 1426806907 /nfs/dbraw/zinc/80/69/07/1426806907.db2.gz VJWOBLYGDAXNOU-MRXNPFEDSA-N 0 0 382.416 3.216 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173642538 1426807702 /nfs/dbraw/zinc/80/77/02/1426807702.db2.gz APWJDLOEWQGLEV-UHFFFAOYSA-N 0 0 389.339 3.326 20 5 GGBDRN Cc1ccc(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000173643562 1426807853 /nfs/dbraw/zinc/80/78/53/1426807853.db2.gz XZYCAGVJQABFDX-GOSISDBHSA-N 0 0 381.432 3.328 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)c1 ZINC000173644728 1426808472 /nfs/dbraw/zinc/80/84/72/1426808472.db2.gz UQSCOBUUQVIEIE-MRXNPFEDSA-N 0 0 397.431 3.028 20 5 GGBDRN CC(=O)Nc1ccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173645209 1426808680 /nfs/dbraw/zinc/80/86/80/1426808680.db2.gz INMCONAGLQLRBL-UHFFFAOYSA-N 0 0 383.404 3.237 20 5 GGBDRN O=C(c1cc(-c2ccncc2)on1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173646388 1426809064 /nfs/dbraw/zinc/80/90/64/1426809064.db2.gz RNFBKUUUPLZOEQ-UHFFFAOYSA-N 0 0 394.387 3.328 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H](COCc2ccccc2)C1 ZINC000173649986 1426810128 /nfs/dbraw/zinc/81/01/28/1426810128.db2.gz KQKMUIZLVIKMLZ-WMZOPIPTSA-N 0 0 383.448 3.461 20 5 GGBDRN Cc1cc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000173649991 1426810259 /nfs/dbraw/zinc/81/02/59/1426810259.db2.gz XEWYLRSWDUOVQH-SFHVURJKSA-N 0 0 381.432 3.328 20 5 GGBDRN CCC[C@@]1(C)CCCN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000173649975 1426810263 /nfs/dbraw/zinc/81/02/63/1426810263.db2.gz FTTFDYWNMJDVEO-SFHVURJKSA-N 0 0 381.860 3.407 20 5 GGBDRN CCC[C@]1(C)CCCN(C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)C1 ZINC000173651218 1426810361 /nfs/dbraw/zinc/81/03/61/1426810361.db2.gz LVVUANIUJBKLPV-OAQYLSRUSA-N 0 0 398.463 3.492 20 5 GGBDRN Cc1ccoc1C(=O)NCCCNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173670198 1426815959 /nfs/dbraw/zinc/81/59/59/1426815959.db2.gz JTIIIGPCHDAJRJ-UHFFFAOYSA-N 0 0 399.325 3.065 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cn(Cc2cccs2)nn1 ZINC000173685323 1426820809 /nfs/dbraw/zinc/82/08/09/1426820809.db2.gz KERQPMWYZPKQSA-UHFFFAOYSA-N 0 0 385.449 3.049 20 5 GGBDRN O=C(c1ccc2ccccc2c1O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173685251 1426820929 /nfs/dbraw/zinc/82/09/29/1426820929.db2.gz FLCAALVUBXCIIR-AWEZNQCLSA-N 0 0 378.388 3.175 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@@](C)(O)c2ccco2)CC1 ZINC000173688176 1426821335 /nfs/dbraw/zinc/82/13/35/1426821335.db2.gz FOXWRPDVJUNBAO-HXUWFJFHSA-N 0 0 387.436 3.062 20 5 GGBDRN COC[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(C)o1 ZINC000173689252 1426821619 /nfs/dbraw/zinc/82/16/19/1426821619.db2.gz MDELDWQQLXALQK-MRXNPFEDSA-N 0 0 387.436 3.217 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2nc(CCc3ccccc3)no2)c1 ZINC000173689756 1426821669 /nfs/dbraw/zinc/82/16/69/1426821669.db2.gz DQRORMAGNFVRNQ-UHFFFAOYSA-N 0 0 383.360 3.129 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](c2ccccc2)CO1 ZINC000173693993 1426823247 /nfs/dbraw/zinc/82/32/47/1426823247.db2.gz ASIWKSXTFDLJLK-MGPUTAFESA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@H](c2ccccc2)CO1 ZINC000173703097 1426826393 /nfs/dbraw/zinc/82/63/93/1426826393.db2.gz ZJAOJLKJYFPAQS-YJYMSZOUSA-N 0 0 393.399 3.039 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])Oc1ccccc1Cl ZINC000173711198 1426828542 /nfs/dbraw/zinc/82/85/42/1426828542.db2.gz MJNUWDBPCLIPNX-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN CN(CC(=O)NCc1ccccc1OCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000173717746 1426830321 /nfs/dbraw/zinc/83/03/21/1426830321.db2.gz NFEDVPKPCVTLDL-UHFFFAOYSA-N 0 0 397.353 3.289 20 5 GGBDRN COC[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)c1ccc(C)o1 ZINC000173723168 1426831731 /nfs/dbraw/zinc/83/17/31/1426831731.db2.gz BRPRWBWNTKWBNI-CYBMUJFWSA-N 0 0 377.353 3.139 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1C(=O)N1CCC2(CCCC2)C1 ZINC000173726614 1426832530 /nfs/dbraw/zinc/83/25/30/1426832530.db2.gz BOGQZVJNAKPUDU-ZDUSSCGKSA-N 0 0 377.466 3.054 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2CCC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000173734016 1426834609 /nfs/dbraw/zinc/83/46/09/1426834609.db2.gz KZKFDTYAEJPVKV-UHFFFAOYSA-N 0 0 387.465 3.281 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C12CCCC2 ZINC000173740484 1426835857 /nfs/dbraw/zinc/83/58/57/1426835857.db2.gz ACUFNHPGIMTFDS-HUUCEWRRSA-N 0 0 395.843 3.041 20 5 GGBDRN CC(=O)Nc1ccc(Cl)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000173744687 1426837198 /nfs/dbraw/zinc/83/71/98/1426837198.db2.gz RUNPRAKEERGHIE-UHFFFAOYSA-N 0 0 376.800 3.282 20 5 GGBDRN COc1cc(OCC(=O)N2C[C@@H](C)CN(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000173753364 1426840509 /nfs/dbraw/zinc/84/05/09/1426840509.db2.gz JCEGNYLFWUWZSE-AWEZNQCLSA-N 0 0 385.420 3.101 20 5 GGBDRN COc1cc(OCC(=O)N2C[C@H](C)CN(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000173753351 1426840565 /nfs/dbraw/zinc/84/05/65/1426840565.db2.gz JCEGNYLFWUWZSE-CQSZACIVSA-N 0 0 385.420 3.101 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000173760525 1426842646 /nfs/dbraw/zinc/84/26/46/1426842646.db2.gz PGMLSHDRWPJMDR-SJORKVTESA-N 0 0 383.452 3.305 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CC1CN(C(=O)OC(C)(C)C)C1 ZINC000173761000 1426843083 /nfs/dbraw/zinc/84/30/83/1426843083.db2.gz NHKYEJKGDKGWNZ-UHFFFAOYSA-N 0 0 397.859 3.464 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC(C(F)(F)F)CC1 ZINC000173773740 1426846881 /nfs/dbraw/zinc/84/68/81/1426846881.db2.gz YHCABPNMJHYPMP-SNVBAGLBSA-N 0 0 375.347 3.205 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000173780837 1426849590 /nfs/dbraw/zinc/84/95/90/1426849590.db2.gz ZCVDBEKESHCYFE-KRWDZBQOSA-N 0 0 387.411 3.364 20 5 GGBDRN COC(C)(C)C[C@@H](C)NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173785061 1426850922 /nfs/dbraw/zinc/85/09/22/1426850922.db2.gz GHUUFHUDGIRPEK-CQSZACIVSA-N 0 0 379.457 3.351 20 5 GGBDRN Cc1ccccc1C1(CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])CCOCC1 ZINC000173793602 1426852886 /nfs/dbraw/zinc/85/28/86/1426852886.db2.gz IKFRQXYGUHPFTM-UHFFFAOYSA-N 0 0 397.475 3.204 20 5 GGBDRN COC(=O)[C@@H](c1ccccc1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173798370 1426853813 /nfs/dbraw/zinc/85/38/13/1426853813.db2.gz BXLBVWSULYFQGR-LJQANCHMSA-N 0 0 388.395 3.491 20 5 GGBDRN COC(=O)[C@H](c1ccccc1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173798384 1426853859 /nfs/dbraw/zinc/85/38/59/1426853859.db2.gz BXLBVWSULYFQGR-IBGZPJMESA-N 0 0 388.395 3.491 20 5 GGBDRN O=C(N[C@H]1CCCC[C@H]1n1cccn1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000173801306 1426855189 /nfs/dbraw/zinc/85/51/89/1426855189.db2.gz XAZMMGLPMBARMY-ZWKOTPCHSA-N 0 0 397.479 3.308 20 5 GGBDRN O=C(N[C@H]1CCCC[C@@H]1n1cccn1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000173801271 1426855238 /nfs/dbraw/zinc/85/52/38/1426855238.db2.gz XAZMMGLPMBARMY-ROUUACIJSA-N 0 0 397.479 3.308 20 5 GGBDRN Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000173808041 1426856926 /nfs/dbraw/zinc/85/69/26/1426856926.db2.gz OBFLQBSFQZEKCB-VQIMIIECSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000173808016 1426857021 /nfs/dbraw/zinc/85/70/21/1426857021.db2.gz OBFLQBSFQZEKCB-QFBILLFUSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1ccc(-c2ocnc2C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000173813146 1426858458 /nfs/dbraw/zinc/85/84/58/1426858458.db2.gz DMYHZOXKKULAPS-HNNXBMFYSA-N 0 0 393.403 3.280 20 5 GGBDRN CN(CC(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000173820809 1426860299 /nfs/dbraw/zinc/86/02/99/1426860299.db2.gz REEYDNHHSKYHFN-LAUBAEHRSA-N 0 0 383.448 3.315 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)cc([N+](=O)[O-])c1 ZINC000173828110 1426862293 /nfs/dbraw/zinc/86/22/93/1426862293.db2.gz KJYSNPZEMULZCO-HNNXBMFYSA-N 0 0 377.441 3.375 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)c1cccc(-n2cccn2)c1 ZINC000173827605 1426862433 /nfs/dbraw/zinc/86/24/33/1426862433.db2.gz BIKMGOBBRPQFPS-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)cc1[N+](=O)[O-] ZINC000173828933 1426862743 /nfs/dbraw/zinc/86/27/43/1426862743.db2.gz LVQXLPJTHIGIOG-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000173828607 1426862813 /nfs/dbraw/zinc/86/28/13/1426862813.db2.gz HAMZTZCYVDWTSM-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN CNC(=O)CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000173831876 1426863450 /nfs/dbraw/zinc/86/34/50/1426863450.db2.gz FNFAOGWGPHGQEN-UHFFFAOYSA-N 0 0 397.431 3.375 20 5 GGBDRN O=C(NC1(c2cccc(F)c2)CCOCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000173839898 1426866416 /nfs/dbraw/zinc/86/64/16/1426866416.db2.gz LZVLVPZRAQLKBE-UHFFFAOYSA-N 0 0 389.339 3.078 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)ccc1C ZINC000173845876 1426868379 /nfs/dbraw/zinc/86/83/79/1426868379.db2.gz LHXKDQDHNGURSQ-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)ccc1C ZINC000173847254 1426869456 /nfs/dbraw/zinc/86/94/56/1426869456.db2.gz UBWABSGDVPUJKQ-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173849905 1426870548 /nfs/dbraw/zinc/87/05/48/1426870548.db2.gz WOYHAAHEHRDKLO-QGZVFWFLSA-N 0 0 398.444 3.092 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173850179 1426870650 /nfs/dbraw/zinc/87/06/50/1426870650.db2.gz UNYQLPUDMYJFKD-MRXNPFEDSA-N 0 0 398.444 3.092 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CCN1C(=O)OC(C)(C)C ZINC000173877526 1426878824 /nfs/dbraw/zinc/87/88/24/1426878824.db2.gz KDPFCJZQMRQYRY-LLVKDONJSA-N 0 0 383.832 3.330 20 5 GGBDRN CN(CC(=O)Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1)c1ccccc1[N+](=O)[O-] ZINC000173883021 1426880699 /nfs/dbraw/zinc/88/06/99/1426880699.db2.gz MYCBGVQJWURYQQ-SFHVURJKSA-N 0 0 395.419 3.398 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@H](C)CC ZINC000173892472 1426883375 /nfs/dbraw/zinc/88/33/75/1426883375.db2.gz MPYHLACYIVYWFP-VFNWGFHPSA-N 0 0 394.471 3.249 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc21 ZINC000173901684 1426885487 /nfs/dbraw/zinc/88/54/87/1426885487.db2.gz ZMPYBKAZOGFJOT-CYBMUJFWSA-N 0 0 395.419 3.178 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccccc2)nc1 ZINC000173911438 1426889343 /nfs/dbraw/zinc/88/93/43/1426889343.db2.gz ANPNEXHKIDGWCA-UHFFFAOYSA-N 0 0 376.372 3.423 20 5 GGBDRN CN(Cc1cc2ccccc2o1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000173914836 1426890437 /nfs/dbraw/zinc/89/04/37/1426890437.db2.gz VGSAPWDSWFVBSO-UHFFFAOYSA-N 0 0 399.428 3.191 20 5 GGBDRN Cc1cc(N(C)C[C@H](O)COc2ccccc2C(F)(F)F)ncc1[N+](=O)[O-] ZINC000173914394 1426890523 /nfs/dbraw/zinc/89/05/23/1426890523.db2.gz VMESFPCMPIARJY-LBPRGKRZSA-N 0 0 385.342 3.193 20 5 GGBDRN Cc1cc(N(C)C[C@@H](O)COc2ccccc2C(F)(F)F)ncc1[N+](=O)[O-] ZINC000173914410 1426890604 /nfs/dbraw/zinc/89/06/04/1426890604.db2.gz VMESFPCMPIARJY-GFCCVEGCSA-N 0 0 385.342 3.193 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CCNc2cc(C)c([N+](=O)[O-])cn2)s1 ZINC000173915641 1426891158 /nfs/dbraw/zinc/89/11/58/1426891158.db2.gz KIDXBUVUZJEXLK-UHFFFAOYSA-N 0 0 398.510 3.045 20 5 GGBDRN CN(Cc1cc2ccccc2o1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000173923673 1426893756 /nfs/dbraw/zinc/89/37/56/1426893756.db2.gz CKRRFHAKWSUYGE-UHFFFAOYSA-N 0 0 388.401 3.017 20 5 GGBDRN Cc1c(C(=O)Nc2ccc([S@](C)=O)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000173926181 1426894770 /nfs/dbraw/zinc/89/47/70/1426894770.db2.gz MXJMEKAPBJRYGA-SANMLTNESA-N 0 0 377.378 3.110 20 5 GGBDRN Cc1ccc(F)c(S(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000173930317 1426896691 /nfs/dbraw/zinc/89/66/91/1426896691.db2.gz QRRGVRFWOIFQHF-UHFFFAOYSA-N 0 0 394.424 3.274 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)cc1 ZINC000173930534 1426896793 /nfs/dbraw/zinc/89/67/93/1426896793.db2.gz AUJFQJFAHMCKOR-UHFFFAOYSA-N 0 0 398.387 3.105 20 5 GGBDRN C[C@H]1CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC[C@H]1c1ccccc1 ZINC000173947918 1426904681 /nfs/dbraw/zinc/90/46/81/1426904681.db2.gz FZRRXZRSNFVJAX-WMLDXEAASA-N 0 0 395.415 3.155 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@@H](O)COc2ccc3ccccc3c2)nc1-c1ccncc1 ZINC000173959200 1426909918 /nfs/dbraw/zinc/90/99/18/1426909918.db2.gz NCPMTNKRHWQPEA-GOSISDBHSA-N 0 0 390.399 3.446 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@H](O)c2cccc(Br)c2)nc1-c1ccncc1 ZINC000173959648 1426910023 /nfs/dbraw/zinc/91/00/23/1426910023.db2.gz KTNGFCHTDLFIQL-HNNXBMFYSA-N 0 0 389.209 3.349 20 5 GGBDRN COc1ccc(NC(=O)CNC(C)(C)c2nc(C)c(C)s2)c([N+](=O)[O-])c1 ZINC000173961554 1426911581 /nfs/dbraw/zinc/91/15/81/1426911581.db2.gz ZTVHDHSGTKCYHJ-UHFFFAOYSA-N 0 0 378.454 3.140 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1OS(=O)(=O)Cc1ccc(Br)cc1 ZINC000173987291 1426927762 /nfs/dbraw/zinc/92/77/62/1426927762.db2.gz VPHBMPFFQSRPLD-UHFFFAOYSA-N 0 0 390.186 3.405 20 5 GGBDRN CCOc1ccc(NC(=O)CN2C[C@H](C)OC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000174006108 1426938570 /nfs/dbraw/zinc/93/85/70/1426938570.db2.gz UUXMBCKHZNNFAJ-MGPUTAFESA-N 0 0 399.447 3.394 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@H]2C(=O)OCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000174023390 1426949840 /nfs/dbraw/zinc/94/98/40/1426949840.db2.gz DSWUISRNKJEEIX-IBGZPJMESA-N 0 0 382.416 3.180 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc21 ZINC000174043263 1426966284 /nfs/dbraw/zinc/96/62/84/1426966284.db2.gz CKJCVSFAUBARHR-UHFFFAOYSA-N 0 0 386.795 3.201 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1[N+](=O)[O-] ZINC000174044433 1426967260 /nfs/dbraw/zinc/96/72/60/1426967260.db2.gz PAJHRZWAIUYJHI-QGZVFWFLSA-N 0 0 397.479 3.495 20 5 GGBDRN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)OCCn1c(C)ncc1[N+](=O)[O-] ZINC000174047850 1426970229 /nfs/dbraw/zinc/97/02/29/1426970229.db2.gz ZYJFRDBPBACJDT-UHFFFAOYSA-N 0 0 389.799 3.104 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc21 ZINC000174048944 1426970866 /nfs/dbraw/zinc/97/08/66/1426970866.db2.gz MOPYFAQJGKBQKQ-UHFFFAOYSA-N 0 0 386.795 3.201 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc21 ZINC000174048429 1426970878 /nfs/dbraw/zinc/97/08/78/1426970878.db2.gz LPYIHBGYZAXTHW-UHFFFAOYSA-N 0 0 386.795 3.201 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc(NC(=O)C(C)C)ccc1Cl ZINC000174048336 1426970942 /nfs/dbraw/zinc/97/09/42/1426970942.db2.gz SBMWBZNTZLGIQS-UHFFFAOYSA-N 0 0 394.815 3.205 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(NC(=O)CC(C)C)c(F)c1 ZINC000174048122 1426971209 /nfs/dbraw/zinc/97/12/09/1426971209.db2.gz UPJDDJNAWQZTOP-UHFFFAOYSA-N 0 0 392.387 3.080 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCC[C@H]2n2cccn2)cc1SC ZINC000174056420 1426977041 /nfs/dbraw/zinc/97/70/41/1426977041.db2.gz ORRVWGAUZYPWFY-UONOGXRCSA-N 0 0 390.465 3.436 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)cc1OC ZINC000174055907 1426977070 /nfs/dbraw/zinc/97/70/70/1426977070.db2.gz YQTDSAFLLFDAHS-CABCVRRESA-N 0 0 388.424 3.112 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCC[C@@H]2n2cccn2)cc1SC ZINC000174056391 1426977099 /nfs/dbraw/zinc/97/70/99/1426977099.db2.gz ORRVWGAUZYPWFY-KBPBESRZSA-N 0 0 390.465 3.436 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@H]2n2cccn2)cc1OC ZINC000174056096 1426977471 /nfs/dbraw/zinc/97/74/71/1426977471.db2.gz YQTDSAFLLFDAHS-HUUCEWRRSA-N 0 0 388.424 3.112 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N(c1ccccc1)C1Cc2ccccc2C1 ZINC000174058314 1426977652 /nfs/dbraw/zinc/97/76/52/1426977652.db2.gz GWRRMTXVOCIGBN-UHFFFAOYSA-N 0 0 376.416 3.382 20 5 GGBDRN O=C(N[C@@H]1COc2ccccc2C1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174058957 1426979338 /nfs/dbraw/zinc/97/93/38/1426979338.db2.gz VFTMRJKZXDZQGV-INIZCTEOSA-N 0 0 397.431 3.151 20 5 GGBDRN C[C@H](NC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000174062609 1426981803 /nfs/dbraw/zinc/98/18/03/1426981803.db2.gz UJZPAFSNXAPJKI-GOEBONIOSA-N 0 0 388.468 3.136 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](C)c1nc(C2CCCCC2)no1 ZINC000174066457 1426983462 /nfs/dbraw/zinc/98/34/62/1426983462.db2.gz WRVHMRCMLBMVNJ-GFCCVEGCSA-N 0 0 394.453 3.373 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C2CCCCC2)no1 ZINC000174065540 1426983635 /nfs/dbraw/zinc/98/36/35/1426983635.db2.gz WJNKTHSMXUOQBL-NSHDSACASA-N 0 0 380.426 3.065 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](C)c2nc(C3CCCCC3)no2)cc1[N+](=O)[O-] ZINC000174068751 1426984989 /nfs/dbraw/zinc/98/49/89/1426984989.db2.gz BPLKSJMXBIKYQS-GFCCVEGCSA-N 0 0 394.453 3.373 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(c3ncnc4sccc43)CC2)cc1[N+](=O)[O-] ZINC000174069861 1426985709 /nfs/dbraw/zinc/98/57/09/1426985709.db2.gz JDAHMAMXFOBFLH-UHFFFAOYSA-N 0 0 397.460 3.124 20 5 GGBDRN CN(C)C(=O)CN(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 ZINC000174077658 1426990159 /nfs/dbraw/zinc/99/01/59/1426990159.db2.gz MTYDNMHRCOTBJR-UHFFFAOYSA-N 0 0 395.337 3.349 20 5 GGBDRN Cc1ccc([C@@H]2OCCC[C@@H]2CNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000174078459 1426991155 /nfs/dbraw/zinc/99/11/55/1426991155.db2.gz KCVPINOZTWKDQV-APWZRJJASA-N 0 0 390.461 3.349 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000174088315 1426995485 /nfs/dbraw/zinc/99/54/85/1426995485.db2.gz FPDMOOPORAPYPF-OAHLLOKOSA-N 0 0 387.480 3.268 20 5 GGBDRN Cc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)ccc1Br ZINC000174090364 1426996562 /nfs/dbraw/zinc/99/65/62/1426996562.db2.gz VXIOARWWKIXQTH-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN CC[C@H](C)C[C@@H](C)NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000174104200 1427003862 /nfs/dbraw/zinc/00/38/62/1427003862.db2.gz FEASSRGLDMRUQL-NWDGAFQWSA-N 0 0 377.470 3.429 20 5 GGBDRN C[C@H](NC(=O)N1CCn2c(nnc2-c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000174104687 1427004272 /nfs/dbraw/zinc/00/42/72/1427004272.db2.gz MQSHWZAZAFBQSW-AWEZNQCLSA-N 0 0 392.419 3.140 20 5 GGBDRN O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCCN(C(=O)c2ccncc2)C1 ZINC000174119993 1427010645 /nfs/dbraw/zinc/01/06/45/1427010645.db2.gz WRBQYKVLWIISHF-ZDUSSCGKSA-N 0 0 389.795 3.101 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1ccn(-c2ccc(F)cc2)n1 ZINC000174123662 1427011348 /nfs/dbraw/zinc/01/13/48/1427011348.db2.gz ACLUBPPVEGHKJO-UHFFFAOYSA-N 0 0 399.382 3.292 20 5 GGBDRN O=C(OCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(N2CCNC2=O)c1 ZINC000174124884 1427012297 /nfs/dbraw/zinc/01/22/97/1427012297.db2.gz LWLJVGDXBPOHDN-UHFFFAOYSA-N 0 0 375.768 3.135 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000174126437 1427012735 /nfs/dbraw/zinc/01/27/35/1427012735.db2.gz HHRSRLFDERDYBI-UHFFFAOYSA-N 0 0 398.463 3.378 20 5 GGBDRN Cc1nn(C)c(C(=O)N(CCc2ccc(C)cc2)Cc2ccco2)c1[N+](=O)[O-] ZINC000174129831 1427015192 /nfs/dbraw/zinc/01/51/92/1427015192.db2.gz IUOOKINQEVGWGC-UHFFFAOYSA-N 0 0 382.420 3.423 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000174132859 1427016311 /nfs/dbraw/zinc/01/63/11/1427016311.db2.gz CMEUZKXQGSNTDF-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN CN(CC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1C=O ZINC000174140176 1427018484 /nfs/dbraw/zinc/01/84/84/1427018484.db2.gz DXSFDEUEUVEVFT-UHFFFAOYSA-N 0 0 395.337 3.179 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)OCC[C@@H]2CCCCN2C(=O)c2cccn2C)c1 ZINC000174156344 1427024764 /nfs/dbraw/zinc/02/47/64/1427024764.db2.gz VPDMJTKQDCISHF-INIZCTEOSA-N 0 0 399.447 3.484 20 5 GGBDRN COc1ccc(OC)c([C@@H](C)NC(=O)Cn2ccc3c2cccc3[N+](=O)[O-])c1 ZINC000174159784 1427026035 /nfs/dbraw/zinc/02/60/35/1427026035.db2.gz JXBSVWGODCIGCM-CYBMUJFWSA-N 0 0 383.404 3.444 20 5 GGBDRN O=C(Cn1ccc2c1cccc2[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000174160672 1427026735 /nfs/dbraw/zinc/02/67/35/1427026735.db2.gz GEDCWFIFHUBLKQ-LJQANCHMSA-N 0 0 383.379 3.289 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)cc(F)cc1[N+](=O)[O-] ZINC000174160488 1427026811 /nfs/dbraw/zinc/02/68/11/1427026811.db2.gz KVBMASFQLWLUPS-UHFFFAOYSA-N 0 0 395.350 3.216 20 5 GGBDRN C[C@@H]1CN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2NC1=O ZINC000174183187 1427036719 /nfs/dbraw/zinc/03/67/19/1427036719.db2.gz LPJPFPXNSFAUKX-LLVKDONJSA-N 0 0 388.811 3.282 20 5 GGBDRN C[C@@H](NC(=O)Nc1cccc(N2CCCNC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000174186039 1427038724 /nfs/dbraw/zinc/03/87/24/1427038724.db2.gz DCKFTUYUZRQMAF-CYBMUJFWSA-N 0 0 383.408 3.397 20 5 GGBDRN C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccc2NC1=O ZINC000174185943 1427038819 /nfs/dbraw/zinc/03/88/19/1427038819.db2.gz BKFWQUNJEFIUKM-GFCCVEGCSA-N 0 0 379.376 3.240 20 5 GGBDRN Cc1ccc(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)cc1[N+](=O)[O-] ZINC000174187300 1427039095 /nfs/dbraw/zinc/03/90/95/1427039095.db2.gz OBDCXVZNECOLJN-UHFFFAOYSA-N 0 0 382.464 3.368 20 5 GGBDRN CCc1ccc(C(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000174191342 1427041710 /nfs/dbraw/zinc/04/17/10/1427041710.db2.gz QCMXKJNGKBAWAX-CQSZACIVSA-N 0 0 391.468 3.486 20 5 GGBDRN COc1ccc(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)cc1[N+](=O)[O-] ZINC000174198286 1427046076 /nfs/dbraw/zinc/04/60/76/1427046076.db2.gz UDZXHJZGKYTXDM-UHFFFAOYSA-N 0 0 398.463 3.068 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)cc1 ZINC000174201266 1427047561 /nfs/dbraw/zinc/04/75/61/1427047561.db2.gz NOIKNCDUYXVHCB-UHFFFAOYSA-N 0 0 386.427 3.199 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)c1ccncc1Cl)c1ccccc1[N+](=O)[O-] ZINC000174205531 1427049911 /nfs/dbraw/zinc/04/99/11/1427049911.db2.gz NXCZGHNPVKRMIA-HNNXBMFYSA-N 0 0 391.811 3.456 20 5 GGBDRN CCO[C@@H](C)c1noc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000174240802 1427064818 /nfs/dbraw/zinc/06/48/18/1427064818.db2.gz CVZPMSNDDZRQMA-ZDUSSCGKSA-N 0 0 376.413 3.119 20 5 GGBDRN CCO[C@H](C)c1noc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000174240815 1427064883 /nfs/dbraw/zinc/06/48/83/1427064883.db2.gz CVZPMSNDDZRQMA-CYBMUJFWSA-N 0 0 376.413 3.119 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1C(=O)N1CCC[C@H]2CCC[C@@H]21 ZINC000174242639 1427066224 /nfs/dbraw/zinc/06/62/24/1427066224.db2.gz IXTYHMXFAFKIGW-HZSPNIEDSA-N 0 0 377.466 3.052 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1C(=O)N1CCC[C@@H]2CCC[C@@H]21 ZINC000174242664 1427066340 /nfs/dbraw/zinc/06/63/40/1427066340.db2.gz IXTYHMXFAFKIGW-MELADBBJSA-N 0 0 377.466 3.052 20 5 GGBDRN C[C@H](NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1cccs1 ZINC000174243680 1427066348 /nfs/dbraw/zinc/06/63/48/1427066348.db2.gz GKFPQGQWPISQJY-AWEZNQCLSA-N 0 0 389.477 3.377 20 5 GGBDRN COc1cccc(NC(=O)CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000174242912 1427066446 /nfs/dbraw/zinc/06/64/46/1427066446.db2.gz MFJVHTBVJMIEGY-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN C[C@@H](c1nnnn1-c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174246264 1427067779 /nfs/dbraw/zinc/06/77/79/1427067779.db2.gz TWOIBDJOUKGNOI-HNNXBMFYSA-N 0 0 394.435 3.175 20 5 GGBDRN C[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1cccc(-n2cccn2)c1 ZINC000174254752 1427071590 /nfs/dbraw/zinc/07/15/90/1427071590.db2.gz CJIWWGKZXXZXGO-HNNXBMFYSA-N 0 0 379.420 3.383 20 5 GGBDRN O=C(Nc1c(F)cc(F)cc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000174257380 1427072926 /nfs/dbraw/zinc/07/29/26/1427072926.db2.gz VBBLYSJGKDOASA-UHFFFAOYSA-N 0 0 380.326 3.366 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@H](n3ccnc3)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000174264385 1427075114 /nfs/dbraw/zinc/07/51/14/1427075114.db2.gz JWJWURGGSXEPIX-MRXNPFEDSA-N 0 0 398.444 3.092 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1c2nsnc2ccc1Cl ZINC000174266460 1427076125 /nfs/dbraw/zinc/07/61/25/1427076125.db2.gz XFGGVHFTWIKPKR-UHFFFAOYSA-N 0 0 384.826 3.362 20 5 GGBDRN COc1cc(CCNC(=O)Nc2c(F)cc(F)cc2F)c([N+](=O)[O-])cc1OC ZINC000174269265 1427077647 /nfs/dbraw/zinc/07/76/47/1427077647.db2.gz WCVLSYMDTXMENG-UHFFFAOYSA-N 0 0 399.325 3.394 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000174271272 1427078481 /nfs/dbraw/zinc/07/84/81/1427078481.db2.gz NMVFXXXOKAQJKS-UHFFFAOYSA-N 0 0 384.436 3.111 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(C)ccc2NS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000174287527 1427086563 /nfs/dbraw/zinc/08/65/63/1427086563.db2.gz RWBFRELYIHQUIP-UHFFFAOYSA-N 0 0 377.422 3.089 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000174300882 1427092322 /nfs/dbraw/zinc/09/23/22/1427092322.db2.gz VDWKLUHKRQQOTC-OCCSQVGLSA-N 0 0 387.465 3.279 20 5 GGBDRN Cc1c(C(=O)NC[C@H](C)Oc2ccccc2F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000174323225 1427101747 /nfs/dbraw/zinc/10/17/47/1427101747.db2.gz NRQNYPIHHQQJRR-JTQLQIEISA-N 0 0 377.328 3.148 20 5 GGBDRN C[C@@H](N[C@H](C)c1nc(-c2cccc(F)c2)no1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000174330982 1427105283 /nfs/dbraw/zinc/10/52/83/1427105283.db2.gz VMOXVMITFMVXST-VXGBXAGGSA-N 0 0 399.382 3.462 20 5 GGBDRN C[C@@H](N[C@@H](C)c1nc(-c2cccc(F)c2)no1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000174330918 1427105427 /nfs/dbraw/zinc/10/54/27/1427105427.db2.gz VMOXVMITFMVXST-NEPJUHHUSA-N 0 0 399.382 3.462 20 5 GGBDRN C[C@@H](N[C@@H](C)c1nc(-c2cccc(F)c2)no1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000174332148 1427105486 /nfs/dbraw/zinc/10/54/86/1427105486.db2.gz IKRDMOVFZVWBPA-NEPJUHHUSA-N 0 0 399.382 3.462 20 5 GGBDRN Cc1[nH]c2ccc(C(=O)OCCNc3ccc(C(N)=O)cc3[N+](=O)[O-])cc2c1C ZINC000174333571 1427106253 /nfs/dbraw/zinc/10/62/53/1427106253.db2.gz QHPCZSIRAOHUEN-UHFFFAOYSA-N 0 0 396.403 3.061 20 5 GGBDRN CCc1ccc(OC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000174337700 1427108745 /nfs/dbraw/zinc/10/87/45/1427108745.db2.gz JYPAHACTXKEVII-MRXNPFEDSA-N 0 0 383.404 3.010 20 5 GGBDRN COC(=O)[C@@H](CC(C)C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000174343690 1427111579 /nfs/dbraw/zinc/11/15/79/1427111579.db2.gz NJNZAGPJNPHDOA-LJQANCHMSA-N 0 0 381.428 3.286 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000174344330 1427112037 /nfs/dbraw/zinc/11/20/37/1427112037.db2.gz BOBRTKQHOBQSEC-VXGBXAGGSA-N 0 0 383.470 3.470 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000174347454 1427113321 /nfs/dbraw/zinc/11/33/21/1427113321.db2.gz VTQOEIDSCJDCDK-RDJZCZTQSA-N 0 0 391.468 3.337 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCCc1ccn(-c2ccc(F)cc2)n1 ZINC000174358398 1427118894 /nfs/dbraw/zinc/11/88/94/1427118894.db2.gz KMPACKLTPDYOGX-UHFFFAOYSA-N 0 0 397.410 3.081 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC1(C)OCCO1 ZINC000174382717 1427130848 /nfs/dbraw/zinc/13/08/48/1427130848.db2.gz UGNXMIYAIZKOJX-SNVBAGLBSA-N 0 0 376.331 3.133 20 5 GGBDRN O=C(OC[C@H]1CCN(c2ccccc2)C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000174383145 1427130974 /nfs/dbraw/zinc/13/09/74/1427130974.db2.gz NNIJOVHYNQEPOX-INIZCTEOSA-N 0 0 392.415 3.464 20 5 GGBDRN Cc1nnc(-c2cccc(NC(=O)c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)c2)o1 ZINC000174383026 1427130995 /nfs/dbraw/zinc/13/09/95/1427130995.db2.gz SWIFUBAGDPFGIW-UHFFFAOYSA-N 0 0 391.343 3.047 20 5 GGBDRN Cc1[nH]nc2ncc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)cc12 ZINC000174391301 1427135203 /nfs/dbraw/zinc/13/52/03/1427135203.db2.gz IRWFHDCBIJHLAV-UHFFFAOYSA-N 0 0 380.408 3.417 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)NCc2cccc([N+](=O)[O-])c2)n1 ZINC000174393505 1427136228 /nfs/dbraw/zinc/13/62/28/1427136228.db2.gz MWBCMQKVQBVCLB-ZDUSSCGKSA-N 0 0 391.428 3.053 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@H](C)CO1 ZINC000174397838 1427138562 /nfs/dbraw/zinc/13/85/62/1427138562.db2.gz GLPUGIOKFOPZER-ACJLOTCBSA-N 0 0 380.404 3.382 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)CO1 ZINC000174397856 1427138614 /nfs/dbraw/zinc/13/86/14/1427138614.db2.gz GLPUGIOKFOPZER-UGSOOPFHSA-N 0 0 380.404 3.382 20 5 GGBDRN COc1cc(N2CCC(OC(=O)c3scnc3C)CC2)ccc1[N+](=O)[O-] ZINC000174399795 1427139076 /nfs/dbraw/zinc/13/90/76/1427139076.db2.gz PXNDAJNVHSQYAM-UHFFFAOYSA-N 0 0 377.422 3.194 20 5 GGBDRN C[C@H]1CN=C(N2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)S1 ZINC000174407482 1427144574 /nfs/dbraw/zinc/14/45/74/1427144574.db2.gz XKHUYXYRAZGJBP-NSHDSACASA-N 0 0 390.490 3.059 20 5 GGBDRN Cc1nc(C)c(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)o1 ZINC000174413712 1427147578 /nfs/dbraw/zinc/14/75/78/1427147578.db2.gz LHWJLRIBPCOHRU-UHFFFAOYSA-N 0 0 398.341 3.181 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C1 ZINC000174419752 1427149635 /nfs/dbraw/zinc/14/96/35/1427149635.db2.gz LNIKIYIRDVUILQ-CZUORRHYSA-N 0 0 389.481 3.230 20 5 GGBDRN CN1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccc(F)cc21 ZINC000174459901 1427165975 /nfs/dbraw/zinc/16/59/75/1427165975.db2.gz UMTVQRVXLDKPFE-UHFFFAOYSA-N 0 0 398.438 3.433 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCOC2(CCCCC2)C1 ZINC000174462821 1427168006 /nfs/dbraw/zinc/16/80/06/1427168006.db2.gz NRKDTDRIOVTKEP-UHFFFAOYSA-N 0 0 387.480 3.373 20 5 GGBDRN CCc1nnc(NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000174470534 1427170876 /nfs/dbraw/zinc/17/08/76/1427170876.db2.gz HBYQXCFOACXZFA-UHFFFAOYSA-N 0 0 377.426 3.084 20 5 GGBDRN O=C(Nc1cnn(CC2CC2)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174474305 1427172483 /nfs/dbraw/zinc/17/24/83/1427172483.db2.gz ZOZFTPLQUUTGNU-UHFFFAOYSA-N 0 0 385.424 3.277 20 5 GGBDRN C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000174496727 1427182750 /nfs/dbraw/zinc/18/27/50/1427182750.db2.gz ZHRCKSIVJYYKTF-FZKQIMNGSA-N 0 0 385.395 3.073 20 5 GGBDRN CO[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(F)cc1 ZINC000174508260 1427191173 /nfs/dbraw/zinc/19/11/73/1427191173.db2.gz FEYZAIGJZXOKDE-GOSISDBHSA-N 0 0 384.367 3.037 20 5 GGBDRN O=C(NCCc1nc2cc(F)ccc2[nH]1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000174506684 1427191267 /nfs/dbraw/zinc/19/12/67/1427191267.db2.gz RPBSCACTFCDKDE-UHFFFAOYSA-N 0 0 383.383 3.157 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCN([C@H](C)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000174510264 1427192352 /nfs/dbraw/zinc/19/23/52/1427192352.db2.gz IBACORKYFWXYKU-GFCCVEGCSA-N 0 0 391.859 3.053 20 5 GGBDRN COc1ccccc1CCNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174513626 1427194701 /nfs/dbraw/zinc/19/47/01/1427194701.db2.gz FQJOBXFPQHBMQN-UHFFFAOYSA-N 0 0 399.447 3.399 20 5 GGBDRN COc1ccc(O[C@H](C)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000174561088 1427224867 /nfs/dbraw/zinc/22/48/67/1427224867.db2.gz OBYVQKJVQYNWDI-GFCCVEGCSA-N 0 0 378.812 3.383 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)CCc2cccn2C)cc1SC ZINC000174562869 1427225905 /nfs/dbraw/zinc/22/59/05/1427225905.db2.gz IYMPKVUHXJQIAI-LBPRGKRZSA-N 0 0 377.466 3.415 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)CCc2cccn2C)cc1OC ZINC000174566963 1427227392 /nfs/dbraw/zinc/22/73/92/1427227392.db2.gz ZBYJQKALMGWQFD-ZDUSSCGKSA-N 0 0 375.425 3.092 20 5 GGBDRN O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CC[C@@H](O)C1 ZINC000174580409 1427238386 /nfs/dbraw/zinc/23/83/86/1427238386.db2.gz OXYWTFMDGPPDAH-CQSZACIVSA-N 0 0 375.812 3.067 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CC[C@@H](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000174589310 1427244632 /nfs/dbraw/zinc/24/46/32/1427244632.db2.gz JHAGMGRYCMDMLW-QFBILLFUSA-N 0 0 387.480 3.402 20 5 GGBDRN Cn1c(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000174591151 1427245023 /nfs/dbraw/zinc/24/50/23/1427245023.db2.gz AGRCBSAQOMLKEX-UHFFFAOYSA-N 0 0 380.339 3.059 20 5 GGBDRN Cn1c(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)nc2cc(F)ccc21 ZINC000174595470 1427248057 /nfs/dbraw/zinc/24/80/57/1427248057.db2.gz UZFBOCLZUGRZGZ-UHFFFAOYSA-N 0 0 380.339 3.059 20 5 GGBDRN Cc1c(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000174598063 1427249555 /nfs/dbraw/zinc/24/95/55/1427249555.db2.gz WEENMVGTLFCDLC-UHFFFAOYSA-N 0 0 395.459 3.114 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)cc([N+](=O)[O-])c1 ZINC000174598420 1427249583 /nfs/dbraw/zinc/24/95/83/1427249583.db2.gz XFJORIRHBIOGJY-UHFFFAOYSA-N 0 0 395.459 3.114 20 5 GGBDRN CN(C(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1 ZINC000174608213 1427258849 /nfs/dbraw/zinc/25/88/49/1427258849.db2.gz PRHWDBCGGQHDHX-KRWDZBQOSA-N 0 0 393.399 3.192 20 5 GGBDRN COc1cc(OCC(=O)N(Cc2ccccc2)CC(F)F)ccc1[N+](=O)[O-] ZINC000174622793 1427269870 /nfs/dbraw/zinc/26/98/70/1427269870.db2.gz PDQBMYBSZMTHMM-UHFFFAOYSA-N 0 0 380.347 3.276 20 5 GGBDRN CC[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 ZINC000174627279 1427273306 /nfs/dbraw/zinc/27/33/06/1427273306.db2.gz ZEOUECCXYJJADD-HNNXBMFYSA-N 0 0 379.363 3.375 20 5 GGBDRN CC[C@H](c1ccc(F)cc1F)N1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 ZINC000174627293 1427273521 /nfs/dbraw/zinc/27/35/21/1427273521.db2.gz ZEOUECCXYJJADD-OAHLLOKOSA-N 0 0 379.363 3.375 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)OCc2ccsc2)cc1[N+](=O)[O-] ZINC000174635659 1427279583 /nfs/dbraw/zinc/27/95/83/1427279583.db2.gz XFBAQVJJLYYCOH-UHFFFAOYSA-N 0 0 376.419 3.293 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)Cc3ccccc3[N+](=O)[O-])n2)c1 ZINC000174637441 1427280205 /nfs/dbraw/zinc/28/02/05/1427280205.db2.gz TVYVLTHXHGNTBB-LBPRGKRZSA-N 0 0 382.376 3.073 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3ccc(C)c([N+](=O)[O-])c3)n2)c1 ZINC000174640275 1427280897 /nfs/dbraw/zinc/28/08/97/1427280897.db2.gz WVRYGZCHMNHQST-LBPRGKRZSA-N 0 0 382.376 3.453 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3C)n2)c1 ZINC000174642601 1427282690 /nfs/dbraw/zinc/28/26/90/1427282690.db2.gz FKHDLYRPKGVXTK-GFCCVEGCSA-N 0 0 382.376 3.453 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3cc(F)ccc3[N+](=O)[O-])n2)c1 ZINC000174645623 1427284632 /nfs/dbraw/zinc/28/46/32/1427284632.db2.gz FPFVKAHDLNTPIS-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000174648587 1427286445 /nfs/dbraw/zinc/28/64/45/1427286445.db2.gz RGTHOFQRKLDVFX-GFCCVEGCSA-N 0 0 382.376 3.453 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000174649996 1427287540 /nfs/dbraw/zinc/28/75/40/1427287540.db2.gz IDCOYTZNYNKZNG-HXUWFJFHSA-N 0 0 389.411 3.083 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3cc(C)cc([N+](=O)[O-])c3)n2)c1 ZINC000174651281 1427289056 /nfs/dbraw/zinc/28/90/56/1427289056.db2.gz HNIXFWHYKCRWJH-GFCCVEGCSA-N 0 0 382.376 3.453 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000174654565 1427290772 /nfs/dbraw/zinc/29/07/72/1427290772.db2.gz PCEDIMYWPBEAHZ-LBPRGKRZSA-N 0 0 382.376 3.073 20 5 GGBDRN Nc1ccc(C(=O)OCc2ccccc2NC(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000174663445 1427295216 /nfs/dbraw/zinc/29/52/16/1427295216.db2.gz BZIHYQOOYMPKPD-UHFFFAOYSA-N 0 0 381.344 3.379 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CSc2nc3ccccc3n2-c2ccccc2)c1 ZINC000174675607 1427303577 /nfs/dbraw/zinc/30/35/77/1427303577.db2.gz QZQDIEYNTKMDQU-INIZCTEOSA-N 0 0 395.444 3.283 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(CC(F)(F)F)c1 ZINC000174679338 1427306361 /nfs/dbraw/zinc/30/63/61/1427306361.db2.gz DKIUZIOSMHVFCQ-UHFFFAOYSA-N 0 0 381.310 3.068 20 5 GGBDRN CCN(c1ccccc1)c1ccc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000174685502 1427308956 /nfs/dbraw/zinc/30/89/56/1427308956.db2.gz YUVZUKBSVDAIGH-UHFFFAOYSA-N 0 0 379.420 3.266 20 5 GGBDRN CC(C)c1ccc(-n2ccnc2SC[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000174686070 1427309322 /nfs/dbraw/zinc/30/93/22/1427309322.db2.gz FHMMTXHRQJHSPI-QGZVFWFLSA-N 0 0 387.465 3.254 20 5 GGBDRN COc1ccc(-c2ccc(CNC(=O)CCn3cc([N+](=O)[O-])cn3)cc2)cc1 ZINC000174687678 1427310255 /nfs/dbraw/zinc/31/02/55/1427310255.db2.gz FOGHMSLENDUDIY-UHFFFAOYSA-N 0 0 380.404 3.173 20 5 GGBDRN COc1ccc(C(=O)NCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000174692571 1427312651 /nfs/dbraw/zinc/31/26/51/1427312651.db2.gz BXPURVRRAAQARV-UHFFFAOYSA-N 0 0 381.335 3.047 20 5 GGBDRN C[C@H](Nc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000174692085 1427312866 /nfs/dbraw/zinc/31/28/66/1427312866.db2.gz UYBNJEAQCRAHII-LBPRGKRZSA-N 0 0 376.376 3.190 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1cc2ccccc2o1 ZINC000174695107 1427314235 /nfs/dbraw/zinc/31/42/35/1427314235.db2.gz DKWDFPCCTVVCKQ-ZDUSSCGKSA-N 0 0 381.388 3.118 20 5 GGBDRN COc1cc(NC[C@H](O)COc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000174698702 1427317012 /nfs/dbraw/zinc/31/70/12/1427317012.db2.gz XBHLTCSNKXGYBU-ZDUSSCGKSA-N 0 0 386.326 3.474 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](c1ccccc1)N1CC[C@H](CO)C1 ZINC000174700342 1427317581 /nfs/dbraw/zinc/31/75/81/1427317581.db2.gz KXXITNXXKRWTFC-UGSOOPFHSA-N 0 0 389.839 3.242 20 5 GGBDRN NC(=O)C[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC000174713872 1427325996 /nfs/dbraw/zinc/32/59/96/1427325996.db2.gz YRDBOHOIEQIVAD-AWEZNQCLSA-N 0 0 383.404 3.115 20 5 GGBDRN CN1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2cc(F)ccc21 ZINC000174719492 1427329101 /nfs/dbraw/zinc/32/91/01/1427329101.db2.gz IPCIBASCAMILSF-UHFFFAOYSA-N 0 0 381.367 3.016 20 5 GGBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174723408 1427332215 /nfs/dbraw/zinc/33/22/15/1427332215.db2.gz CWKFPCPHULXILA-AWEZNQCLSA-N 0 0 397.859 3.259 20 5 GGBDRN CCC(CC)(CNC(=O)Cc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000174729142 1427334901 /nfs/dbraw/zinc/33/49/01/1427334901.db2.gz ZBTYZHZWNFQTMB-UHFFFAOYSA-N 0 0 379.457 3.337 20 5 GGBDRN CCC(CC)(CNC(=O)Cc1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000174731449 1427336098 /nfs/dbraw/zinc/33/60/98/1427336098.db2.gz CWDOFLPGECOJLH-UHFFFAOYSA-N 0 0 379.457 3.337 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCN(C)c3ccc(F)cc32)cc([N+](=O)[O-])c1 ZINC000174730487 1427336255 /nfs/dbraw/zinc/33/62/55/1427336255.db2.gz LTSRBKNLZMOVFI-UHFFFAOYSA-N 0 0 387.367 3.007 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)cc([N+](=O)[O-])c1 ZINC000174733162 1427337321 /nfs/dbraw/zinc/33/73/21/1427337321.db2.gz KOXOMCHBZWIDHX-ZDUSSCGKSA-N 0 0 394.387 3.058 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1nc(-c2cccc(F)c2)no1 ZINC000174740981 1427342484 /nfs/dbraw/zinc/34/24/84/1427342484.db2.gz MARCUTOEECMCLM-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CCC[C@@H](CC(N)=O)C2)cc1[N+](=O)[O-] ZINC000174742915 1427343692 /nfs/dbraw/zinc/34/36/92/1427343692.db2.gz LHMCNJFTIDGIBR-AWEZNQCLSA-N 0 0 393.509 3.461 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000174755135 1427350072 /nfs/dbraw/zinc/35/00/72/1427350072.db2.gz RJQSTHODWFJEBT-HNNXBMFYSA-N 0 0 380.404 3.427 20 5 GGBDRN C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1nc(-c2cccc(F)c2)no1 ZINC000174755246 1427350123 /nfs/dbraw/zinc/35/01/23/1427350123.db2.gz KOFBCCUDVVDRNT-SECBINFHSA-N 0 0 396.338 3.151 20 5 GGBDRN C[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174758032 1427351426 /nfs/dbraw/zinc/35/14/26/1427351426.db2.gz AUFIJOOXYQVRNR-LBPRGKRZSA-N 0 0 399.382 3.463 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2nc([C@H](C)OCC(C)C)no2)c1 ZINC000174794541 1427372339 /nfs/dbraw/zinc/37/23/39/1427372339.db2.gz MXOSPGPEKHTGQR-ZDUSSCGKSA-N 0 0 376.413 3.292 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@H](O)c3ccc(OC(F)(F)F)cc3)n2)c1 ZINC000174797709 1427374088 /nfs/dbraw/zinc/37/40/88/1427374088.db2.gz SRCPYLFUJDRQBF-HNNXBMFYSA-N 0 0 394.309 3.486 20 5 GGBDRN Cc1ccc(C)c(OC[C@@H](O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c1C ZINC000174797242 1427374241 /nfs/dbraw/zinc/37/42/41/1427374241.db2.gz WMSQUSZFLCRNGV-SFHVURJKSA-N 0 0 382.420 3.218 20 5 GGBDRN Cc1ccc(C)c(OC[C@H](O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c1C ZINC000174797231 1427374325 /nfs/dbraw/zinc/37/43/25/1427374325.db2.gz WMSQUSZFLCRNGV-GOSISDBHSA-N 0 0 382.420 3.218 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@@H](O)c3cccc(Br)c3)n2)c1 ZINC000174798032 1427374589 /nfs/dbraw/zinc/37/45/89/1427374589.db2.gz LJLSTGQZZWTFQB-OAHLLOKOSA-N 0 0 389.209 3.349 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@H](O)c3cccc(Br)c3)n2)c1 ZINC000174798022 1427374728 /nfs/dbraw/zinc/37/47/28/1427374728.db2.gz LJLSTGQZZWTFQB-HNNXBMFYSA-N 0 0 389.209 3.349 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)/C=C/c2ccccc2[N+](=O)[O-])n1 ZINC000174800157 1427376315 /nfs/dbraw/zinc/37/63/15/1427376315.db2.gz LWQXRERRSDSAIV-HBWSCVEGSA-N 0 0 388.424 3.383 20 5 GGBDRN Cc1cc(C(=O)N(C)Cc2nc([C@H](C)OCC(C)C)no2)ccc1[N+](=O)[O-] ZINC000174801242 1427376940 /nfs/dbraw/zinc/37/69/40/1427376940.db2.gz SWGBOOJPJBVZLP-ZDUSSCGKSA-N 0 0 376.413 3.292 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(C[C@H](O)c3ccc(F)cc3F)CC2)cc1 ZINC000174802677 1427377737 /nfs/dbraw/zinc/37/77/37/1427377737.db2.gz QMIJYKGUHRRNKI-IBGZPJMESA-N 0 0 378.375 3.450 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC[C@@](O)(c1ccccc1)C(F)(F)F ZINC000174818281 1427384860 /nfs/dbraw/zinc/38/48/60/1427384860.db2.gz IIJFCZGCWSWFJD-VGMNTSGFSA-N 0 0 380.322 3.174 20 5 GGBDRN CO[C@@]1(C)C[C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1(C)C ZINC000174826051 1427389210 /nfs/dbraw/zinc/38/92/10/1427389210.db2.gz FMDBUIXTDMUNSW-XXBNENTESA-N 0 0 378.472 3.475 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(-c2nc(-c3cccc(CN4CCOCC4)c3)no2)c1 ZINC000174838379 1427397320 /nfs/dbraw/zinc/39/73/20/1427397320.db2.gz QPLCTMRZTDRBIE-UHFFFAOYSA-N 0 0 380.404 3.452 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCN(C(=O)Nc2ccc(C)cc2)CC1 ZINC000174862060 1427414283 /nfs/dbraw/zinc/41/42/83/1427414283.db2.gz HICIJZXZVUAOJZ-UHFFFAOYSA-N 0 0 384.436 3.262 20 5 GGBDRN CC(=O)N1CCCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c2ccccc21 ZINC000174869599 1427419892 /nfs/dbraw/zinc/41/98/92/1427419892.db2.gz WEYMJKORHHMHSX-UHFFFAOYSA-N 0 0 382.420 3.105 20 5 GGBDRN Cc1cnn(-c2ccc(NCC(=O)N3CCc4cc([N+](=O)[O-])ccc43)cc2F)c1 ZINC000174878000 1427423316 /nfs/dbraw/zinc/42/33/16/1427423316.db2.gz GPUURBZAXQGYOY-UHFFFAOYSA-N 0 0 395.394 3.229 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000174896743 1427432844 /nfs/dbraw/zinc/43/28/44/1427432844.db2.gz KFTFISIDFJCUFW-UHFFFAOYSA-N 0 0 382.464 3.297 20 5 GGBDRN COCc1ccccc1CNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174907355 1427440255 /nfs/dbraw/zinc/44/02/55/1427440255.db2.gz UNAJQTLKRVJQKY-UHFFFAOYSA-N 0 0 399.447 3.494 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)NC(=O)c3cc(F)ccc3[N+](=O)[O-])ccc2NC1=O ZINC000174916801 1427444666 /nfs/dbraw/zinc/44/46/66/1427444666.db2.gz VQPIFZOBOCFZRG-MGPLVRAMSA-N 0 0 387.367 3.334 20 5 GGBDRN Cc1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1S(=O)(=O)N(C)C ZINC000174922967 1427447599 /nfs/dbraw/zinc/44/75/99/1427447599.db2.gz FSYVIQJIUBFBIC-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)Cc3ccc([N+](=O)[O-])cc3)ccc2NC1=O ZINC000174935066 1427453857 /nfs/dbraw/zinc/45/38/57/1427453857.db2.gz SDJRSMCHZYUPMP-SJKOYZFVSA-N 0 0 383.404 3.124 20 5 GGBDRN C[C@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000174951362 1427462400 /nfs/dbraw/zinc/46/24/00/1427462400.db2.gz FLYRQYPSIWRJLZ-JTQLQIEISA-N 0 0 389.774 3.459 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)c1cccc(Cl)c1[N+](=O)[O-])CC2 ZINC000174960316 1427467691 /nfs/dbraw/zinc/46/76/91/1427467691.db2.gz QCSDVSGIILODBA-UHFFFAOYSA-N 0 0 376.796 3.464 20 5 GGBDRN CC[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)Oc1ccccc1C ZINC000174960985 1427468195 /nfs/dbraw/zinc/46/81/95/1427468195.db2.gz ZFCBAUKWXMKYRZ-OAHLLOKOSA-N 0 0 395.415 3.332 20 5 GGBDRN CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1nc(C(F)(F)F)cs1 ZINC000174964430 1427470072 /nfs/dbraw/zinc/47/00/72/1427470072.db2.gz DCFBKDFJSFPDIO-UHFFFAOYSA-N 0 0 388.371 3.165 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)c1 ZINC000174970077 1427472383 /nfs/dbraw/zinc/47/23/83/1427472383.db2.gz RUHZHJZFJXACLE-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N[C@@H]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000174990522 1427483334 /nfs/dbraw/zinc/48/33/34/1427483334.db2.gz XNBYUNPQBUCMBY-CQSZACIVSA-N 0 0 375.454 3.183 20 5 GGBDRN Cc1cc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2cccnc2c1C ZINC000174998483 1427488060 /nfs/dbraw/zinc/48/80/60/1427488060.db2.gz QFQCHGVVPTWVFB-UHFFFAOYSA-N 0 0 392.371 3.306 20 5 GGBDRN Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)o1 ZINC000175004089 1427491640 /nfs/dbraw/zinc/49/16/40/1427491640.db2.gz RLAVLFGLHYSCJS-BLLLJJGKSA-N 0 0 399.403 3.404 20 5 GGBDRN Cc1c(F)cccc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000175009609 1427494960 /nfs/dbraw/zinc/49/49/60/1427494960.db2.gz SIGUIJJGFDGRHU-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN 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CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C(=O)N2CCC[C@H](C)C2)CC1 ZINC000175099674 1427545765 /nfs/dbraw/zinc/54/57/65/1427545765.db2.gz UBMRRLGQXVHAJI-INIZCTEOSA-N 0 0 389.496 3.464 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000175101559 1427547446 /nfs/dbraw/zinc/54/74/46/1427547446.db2.gz HRCKZJZFXXURIG-VIFPVBQESA-N 0 0 387.783 3.371 20 5 GGBDRN CC(C)CCOc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000175111299 1427552055 /nfs/dbraw/zinc/55/20/55/1427552055.db2.gz DXKBWMGNZIBSNC-UHFFFAOYSA-N 0 0 385.420 3.275 20 5 GGBDRN CN(C)CC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000175113667 1427552932 /nfs/dbraw/zinc/55/29/32/1427552932.db2.gz OBGKATCEFBDEOK-UHFFFAOYSA-N 0 0 376.800 3.001 20 5 GGBDRN COCc1nc2cc(NC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)ccc2o1 ZINC000175114601 1427553567 /nfs/dbraw/zinc/55/35/67/1427553567.db2.gz NCYLVHJRJHBKDL-UHFFFAOYSA-N 0 0 393.359 3.320 20 5 GGBDRN Cc1ccc([C@H](C)NS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1[N+](=O)[O-] ZINC000175115045 1427553614 /nfs/dbraw/zinc/55/36/14/1427553614.db2.gz QMJPOQFWZGDLBG-LBPRGKRZSA-N 0 0 388.401 3.049 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCCN(C(=O)c2ccsc2)CC1 ZINC000175114832 1427553652 /nfs/dbraw/zinc/55/36/52/1427553652.db2.gz NYRCUALDBXVKAL-UHFFFAOYSA-N 0 0 389.477 3.403 20 5 GGBDRN CN(C)CC(=O)Nc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000175114265 1427553959 /nfs/dbraw/zinc/55/39/59/1427553959.db2.gz PCCVBDZFMIBXPE-UHFFFAOYSA-N 0 0 376.800 3.001 20 5 GGBDRN CN(C)CC(=O)Nc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000175116411 1427554777 /nfs/dbraw/zinc/55/47/77/1427554777.db2.gz UMBGLIOZWPVBJX-UHFFFAOYSA-N 0 0 376.800 3.001 20 5 GGBDRN Cc1ccc([C@H](C)NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175118405 1427556149 /nfs/dbraw/zinc/55/61/49/1427556149.db2.gz XEZVNWXMOCSFMV-LBPRGKRZSA-N 0 0 379.394 3.159 20 5 GGBDRN CCc1ccc([C@H]2COCCN2S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)o1 ZINC000175121187 1427558667 /nfs/dbraw/zinc/55/86/67/1427558667.db2.gz 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Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@@H]1c1noc(C(C)C)n1 ZINC000175148824 1427568759 /nfs/dbraw/zinc/56/87/59/1427568759.db2.gz AFEVFCMOAGELDY-CQSZACIVSA-N 0 0 394.453 3.244 20 5 GGBDRN CC(C)(NC(=O)c1cccc(N2CCCNC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000175150467 1427569445 /nfs/dbraw/zinc/56/94/45/1427569445.db2.gz NBHKGYPDNHQMII-UHFFFAOYSA-N 0 0 382.420 3.180 20 5 GGBDRN CN1CCC(=O)Nc2cc(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000175150066 1427569560 /nfs/dbraw/zinc/56/95/60/1427569560.db2.gz MZNCFLXOFREKME-UHFFFAOYSA-N 0 0 382.420 3.038 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCSC2(CCCCC2)C1 ZINC000175152063 1427570852 /nfs/dbraw/zinc/57/08/52/1427570852.db2.gz RLZPXTJAGBOMPJ-UHFFFAOYSA-N 0 0 387.465 3.067 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@H](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000175169336 1427579000 /nfs/dbraw/zinc/57/90/00/1427579000.db2.gz OAGKWKMUQYXTND-ZIAGYGMSSA-N 0 0 385.420 3.102 20 5 GGBDRN C[C@@H]1CCC[C@H](C)N(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000175174894 1427582033 /nfs/dbraw/zinc/58/20/33/1427582033.db2.gz DXGZHQHEKYSJET-MNOVXSKESA-N 0 0 385.367 3.172 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000175188904 1427589627 /nfs/dbraw/zinc/58/96/27/1427589627.db2.gz CKNLZTQKQNQIQQ-GFCCVEGCSA-N 0 0 377.422 3.189 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(N3CCOCC3)nc2)cc1[N+](=O)[O-] ZINC000175189869 1427590957 /nfs/dbraw/zinc/59/09/57/1427590957.db2.gz RJWRGLNRQOEMEN-CQSZACIVSA-N 0 0 385.424 3.018 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000175194990 1427592526 /nfs/dbraw/zinc/59/25/26/1427592526.db2.gz CMYXLDHSFSZVPG-LLVKDONJSA-N 0 0 398.387 3.223 20 5 GGBDRN COc1ccc([C@H](C)CCNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000175199232 1427595388 /nfs/dbraw/zinc/59/53/88/1427595388.db2.gz CAVQPGGWDMAGPI-CYBMUJFWSA-N 0 0 385.420 3.160 20 5 GGBDRN 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396.447 3.267 20 5 GGBDRN O=C(NCc1nccn1CCCc1ccccc1)NCc1ccccc1[N+](=O)[O-] ZINC000175355068 1427701448 /nfs/dbraw/zinc/70/14/48/1427701448.db2.gz PCMFXCHNKNCUFX-UHFFFAOYSA-N 0 0 393.447 3.424 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1cc(-c2nnn[n-]2)ccc1F)C1CC1 ZINC000826500127 1427714609 /nfs/dbraw/zinc/71/46/09/1427714609.db2.gz MEUXANFNWZOWMV-QGZVFWFLSA-N 0 0 382.399 3.025 20 5 GGBDRN C[C@H](NC(=O)N1CCC(OC[C@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000175379522 1427719533 /nfs/dbraw/zinc/71/95/33/1427719533.db2.gz TZAWEWCIYIVARU-KBXCAEBGSA-N 0 0 377.441 3.025 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H](C)CC ZINC000175382942 1427721069 /nfs/dbraw/zinc/72/10/69/1427721069.db2.gz GLBDWQKVRBTVLS-ZANVPECISA-N 0 0 376.331 3.321 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 ZINC000175397294 1427730416 /nfs/dbraw/zinc/73/04/16/1427730416.db2.gz FSBQEQQYLDJJSL-UHFFFAOYSA-N 0 0 385.424 3.257 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(c2cc(F)ccc2F)CC1 ZINC000175398960 1427732174 /nfs/dbraw/zinc/73/21/74/1427732174.db2.gz PTHYMJUOPKQALW-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN CSCCCOC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000175399885 1427732675 /nfs/dbraw/zinc/73/26/75/1427732675.db2.gz STDNVAKUFRCTEF-UHFFFAOYSA-N 0 0 381.191 3.109 20 5 GGBDRN C[C@H](NC(=O)N[C@H](CC(N)=O)c1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000175415695 1427742868 /nfs/dbraw/zinc/74/28/68/1427742868.db2.gz OUBDJPJRRXQILE-MEDUHNTESA-N 0 0 390.827 3.225 20 5 GGBDRN COc1cccc([C@H](C)CC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000175425530 1427747402 /nfs/dbraw/zinc/74/74/02/1427747402.db2.gz OZXZXFRUVHUSGM-ZBFHGGJFSA-N 0 0 384.436 3.205 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000175426392 1427748491 /nfs/dbraw/zinc/74/84/91/1427748491.db2.gz QJXVUOFXWZLTCY-SHZVTRLKSA-N 0 0 396.490 3.022 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000175431293 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CC(C)CC(=O)N1CCC(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000175476890 1427775530 /nfs/dbraw/zinc/77/55/30/1427775530.db2.gz MJAMKKHLYJWUAH-UHFFFAOYSA-N 0 0 390.484 3.166 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)Cc2nc3c(s2)CCCC3)cc1C ZINC000175475766 1427775844 /nfs/dbraw/zinc/77/58/44/1427775844.db2.gz ZEJASLCBXBXRRI-UHFFFAOYSA-N 0 0 395.506 3.368 20 5 GGBDRN CC(=O)N[C@H](CC(=O)OCCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000175488904 1427783745 /nfs/dbraw/zinc/78/37/45/1427783745.db2.gz FRPDCJFFSJUVOJ-GOSISDBHSA-N 0 0 392.358 3.226 20 5 GGBDRN CC(=O)Nc1ccc(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175502392 1427792773 /nfs/dbraw/zinc/79/27/73/1427792773.db2.gz QBCYHJJLEQBOOD-UHFFFAOYSA-N 0 0 384.436 3.330 20 5 GGBDRN CC(C)n1cnnc1-c1ccccc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000175516770 1427800648 /nfs/dbraw/zinc/80/06/48/1427800648.db2.gz BZPWBTBOTUQIGL-UHFFFAOYSA-N 0 0 380.408 3.485 20 5 GGBDRN CCOC[C@H]1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000175535350 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O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@@H]3CCCC[C@@H]3C2)cc1Br ZINC000175667605 1427850586 /nfs/dbraw/zinc/85/05/86/1427850586.db2.gz AYUMTLWAINTPHF-PHIMTYICSA-N 0 0 389.271 3.168 20 5 GGBDRN CC(=O)N[C@H](CC(=O)Nc1ccc([N+](=O)[O-])c(C)n1)c1ccc(Cl)cc1 ZINC000175672402 1427851939 /nfs/dbraw/zinc/85/19/39/1427851939.db2.gz XXSKRKYNDAGKQH-CQSZACIVSA-N 0 0 376.800 3.158 20 5 GGBDRN Cc1nc(NC(=O)[C@H](NC(=O)c2ccccc2Cl)C(C)C)ccc1[N+](=O)[O-] ZINC000175673197 1427852433 /nfs/dbraw/zinc/85/24/33/1427852433.db2.gz NKWGAKKSUIGBIP-MRXNPFEDSA-N 0 0 390.827 3.345 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000175676494 1427853559 /nfs/dbraw/zinc/85/35/59/1427853559.db2.gz GEVJYCWTNCEFBT-SFHVURJKSA-N 0 0 398.394 3.210 20 5 GGBDRN Cc1nc(NC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000175677085 1427853563 /nfs/dbraw/zinc/85/35/63/1427853563.db2.gz XWZVXSAEXBXFSP-UHFFFAOYSA-N 0 0 384.436 3.354 20 5 GGBDRN Cc1nc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1[N+](=O)[O-] ZINC000175682753 1427855648 /nfs/dbraw/zinc/85/56/48/1427855648.db2.gz XTNJLLXWFXHHJH-UHFFFAOYSA-N 0 0 388.383 3.405 20 5 GGBDRN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175686343 1427857206 /nfs/dbraw/zinc/85/72/06/1427857206.db2.gz ICIOCAPPTDGBSF-CZUORRHYSA-N 0 0 399.472 3.190 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccc(C(=O)N(C)C)cc2)cc1[N+](=O)[O-] ZINC000175690145 1427858731 /nfs/dbraw/zinc/85/87/31/1427858731.db2.gz IUWCVGFAYGLFOR-CQSZACIVSA-N 0 0 384.436 3.165 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000175690821 1427859509 /nfs/dbraw/zinc/85/95/09/1427859509.db2.gz PUHQOBJZMQXMJN-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)COc2cccc(C(F)(F)F)c2)c1 ZINC000175692336 1427860260 /nfs/dbraw/zinc/86/02/60/1427860260.db2.gz HEUXRRQTJREWAN-ZDUSSCGKSA-N 0 0 398.337 3.092 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccnc(N3CCCC3)c2)cc1[N+](=O)[O-] ZINC000175694179 1427860839 /nfs/dbraw/zinc/86/08/39/1427860839.db2.gz KALLFKFIKFRGNI-OAHLLOKOSA-N 0 0 383.452 3.459 20 5 GGBDRN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000175699294 1427862841 /nfs/dbraw/zinc/86/28/41/1427862841.db2.gz LVJYROLXGJPNRT-XJKSGUPXSA-N 0 0 388.445 3.017 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1Cc2ccccc2N(C)C[C@H]1C ZINC000175702652 1427864203 /nfs/dbraw/zinc/86/42/03/1427864203.db2.gz XHGSLWQFPLWQNU-CQSZACIVSA-N 0 0 384.436 3.154 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000175707313 1427865893 /nfs/dbraw/zinc/86/58/93/1427865893.db2.gz NANBMPQZQWZHDH-CYBMUJFWSA-N 0 0 399.230 3.000 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000175713472 1427867424 /nfs/dbraw/zinc/86/74/24/1427867424.db2.gz KRBLGXNMECJBJX-YOEHRIQHSA-N 0 0 377.404 3.194 20 5 GGBDRN O=C(c1ccsc1)N1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000175721068 1427869547 /nfs/dbraw/zinc/86/95/47/1427869547.db2.gz BDQSRUXSIKAEPW-UHFFFAOYSA-N 0 0 393.852 3.298 20 5 GGBDRN C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175730028 1427871888 /nfs/dbraw/zinc/87/18/88/1427871888.db2.gz XXKQDEZTJQTQOZ-LLVKDONJSA-N 0 0 396.852 3.485 20 5 GGBDRN C[C@H](NC(=O)NCc1cccc(NC(=O)N(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000175734385 1427873275 /nfs/dbraw/zinc/87/32/75/1427873275.db2.gz RLSOJLXWKZDFMV-ZDUSSCGKSA-N 0 0 385.424 3.249 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccc(N3CCCC3)nc2)cc1[N+](=O)[O-] ZINC000175736258 1427874219 /nfs/dbraw/zinc/87/42/19/1427874219.db2.gz MCALFBFSDPOQKK-HNNXBMFYSA-N 0 0 383.452 3.459 20 5 GGBDRN CCOCCNC(=O)CSc1nc2ccccc2c2nc3ccccc3n21 ZINC000175737977 1427874580 /nfs/dbraw/zinc/87/45/80/1427874580.db2.gz AUGDUPQVMBBHGG-UHFFFAOYSA-N 0 0 380.473 3.281 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCc2ccc(C(N)=O)o2)cc1[N+](=O)[O-] ZINC000175741476 1427876084 /nfs/dbraw/zinc/87/60/84/1427876084.db2.gz PPAXKXVAMPYHOF-UHFFFAOYSA-N 0 0 391.449 3.355 20 5 GGBDRN Cc1ccccc1CCCn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O ZINC000175744237 1427877150 /nfs/dbraw/zinc/87/71/50/1427877150.db2.gz JMIPWTAXZSYUNY-UHFFFAOYSA-N 0 0 389.415 3.432 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2cccnc2-n2cccn2)cc1[N+](=O)[O-] ZINC000175758509 1427880929 /nfs/dbraw/zinc/88/09/29/1427880929.db2.gz JNCLBRWTGGVURD-CQSZACIVSA-N 0 0 380.408 3.044 20 5 GGBDRN COc1cc(CCNC(=O)N([C@H](C)C(C)C)C2CC2)c([N+](=O)[O-])cc1OC ZINC000175760120 1427881654 /nfs/dbraw/zinc/88/16/54/1427881654.db2.gz ZNVUIDYXVWIAGI-CYBMUJFWSA-N 0 0 379.457 3.373 20 5 GGBDRN CCc1n[nH]c(C(=O)NCCc2nc(-c3ccccc3)c(C)s2)c1[N+](=O)[O-] ZINC000175761176 1427881993 /nfs/dbraw/zinc/88/19/93/1427881993.db2.gz MCYBGRGBDGPPAY-UHFFFAOYSA-N 0 0 385.449 3.285 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000175769688 1427886782 /nfs/dbraw/zinc/88/67/82/1427886782.db2.gz CWCWKCMCYWKNAU-SANMLTNESA-N 0 0 375.450 3.477 20 5 GGBDRN Cc1nn(C)c(N2CCC(N(CC3CC3)C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000175779699 1427889890 /nfs/dbraw/zinc/88/98/90/1427889890.db2.gz FAJCDMLMUVVBEM-UHFFFAOYSA-N 0 0 393.488 3.253 20 5 GGBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N(CCN1CCOCC1)c1ccccc1 ZINC000175786033 1427892464 /nfs/dbraw/zinc/89/24/64/1427892464.db2.gz AXCUQUAXPFQDGL-UHFFFAOYSA-N 0 0 389.839 3.227 20 5 GGBDRN C[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cccn2)cc1 ZINC000175801861 1427898015 /nfs/dbraw/zinc/89/80/15/1427898015.db2.gz NGQYNSNECBCMGQ-HNNXBMFYSA-N 0 0 379.420 3.383 20 5 GGBDRN Cc1nn(C)c2sc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)n[nH]3)cc12 ZINC000175806836 1427900950 /nfs/dbraw/zinc/90/09/50/1427900950.db2.gz LYPCVIURSNHAEO-UHFFFAOYSA-N 0 0 382.405 3.494 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@H](C)C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000175807361 1427901431 /nfs/dbraw/zinc/90/14/31/1427901431.db2.gz CBDIECVTLQFEMN-NSHDSACASA-N 0 0 382.424 3.153 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C)nn2-c2ccc(C)nn2)c1 ZINC000175808896 1427902264 /nfs/dbraw/zinc/90/22/64/1427902264.db2.gz QPDFZLATGPFRLF-UHFFFAOYSA-N 0 0 384.421 3.162 20 5 GGBDRN C[C@@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@@H](C)C1CCCCC1 ZINC000175813790 1427905514 /nfs/dbraw/zinc/90/55/14/1427905514.db2.gz FIQNRQIKAYKCLW-CHWSQXEVSA-N 0 0 375.425 3.224 20 5 GGBDRN C[C@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@@H](C)C1CCCCC1 ZINC000175813828 1427905631 /nfs/dbraw/zinc/90/56/31/1427905631.db2.gz FIQNRQIKAYKCLW-OLZOCXBDSA-N 0 0 375.425 3.224 20 5 GGBDRN CCOc1ccc(NC(=O)CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 ZINC000175819659 1427910136 /nfs/dbraw/zinc/91/01/36/1427910136.db2.gz QQJUVRDKRBTKLH-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)c1 ZINC000175827515 1427914120 /nfs/dbraw/zinc/91/41/20/1427914120.db2.gz IBEZRGLEKIMPRZ-UHFFFAOYSA-N 0 0 387.783 3.149 20 5 GGBDRN Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000175832816 1427917521 /nfs/dbraw/zinc/91/75/21/1427917521.db2.gz ATGPCEKPPVIXGF-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN CN(C(=O)CN1CCC[C@H]1C[C@H](O)c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000175845175 1427926666 /nfs/dbraw/zinc/92/66/66/1427926666.db2.gz CWEDFMASNMFSEW-IRXDYDNUSA-N 0 0 389.477 3.207 20 5 GGBDRN C[C@@H]1c2ccccc2CCN1C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000175849425 1427930914 /nfs/dbraw/zinc/93/09/14/1427930914.db2.gz QBUYCUANDVVNQP-CZUORRHYSA-N 0 0 399.472 3.407 20 5 GGBDRN C[C@@H]1CCc2c(F)cccc2[C@@H]1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000175850600 1427931841 /nfs/dbraw/zinc/93/18/41/1427931841.db2.gz IWXNKPWPNFNECV-KZULUSFZSA-N 0 0 378.425 3.477 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](OCCCc3ccccc3)C2)cc1 ZINC000175864071 1427940075 /nfs/dbraw/zinc/94/00/75/1427940075.db2.gz XXKPRWUGWKRHOR-GOSISDBHSA-N 0 0 390.461 3.007 20 5 GGBDRN CC(C)(NS(=O)(=O)Cc1cccc2cccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000175891505 1427953792 /nfs/dbraw/zinc/95/37/92/1427953792.db2.gz GWYCWIJIHCKQER-UHFFFAOYSA-N 0 0 385.445 3.498 20 5 GGBDRN CCc1cnc(CN(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)s1 ZINC000175892215 1427954703 /nfs/dbraw/zinc/95/47/03/1427954703.db2.gz XQLKOPMXVNZUII-UHFFFAOYSA-N 0 0 378.410 3.411 20 5 GGBDRN CC(=O)Nc1cc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000175891597 1427954822 /nfs/dbraw/zinc/95/48/22/1427954822.db2.gz MHJFKLPYKWMMPP-UHFFFAOYSA-N 0 0 391.449 3.075 20 5 GGBDRN COCc1nc2cc(N[C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)ccc2o1 ZINC000175914156 1427968407 /nfs/dbraw/zinc/96/84/07/1427968407.db2.gz ZFWPUEKUEUQDFN-OAHLLOKOSA-N 0 0 382.376 3.100 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000175936533 1427983329 /nfs/dbraw/zinc/98/33/29/1427983329.db2.gz YPSHYPDURHXPFH-AWEZNQCLSA-N 0 0 394.435 3.353 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2nc(Cc3ccccc3C)no2)c1 ZINC000175937635 1427984040 /nfs/dbraw/zinc/98/40/40/1427984040.db2.gz IXPZUGYSITWSQU-UHFFFAOYSA-N 0 0 383.360 3.243 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175939974 1427985463 /nfs/dbraw/zinc/98/54/63/1427985463.db2.gz WSLSQBVMVKRROU-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2N)cc1OC(F)F ZINC000175947834 1427989587 /nfs/dbraw/zinc/98/95/87/1427989587.db2.gz AGEKMDYCJRMSQH-UHFFFAOYSA-N 0 0 381.335 3.059 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N(CCO)[C@@H]1CCCc2ccccc21 ZINC000175960892 1427999767 /nfs/dbraw/zinc/99/97/67/1427999767.db2.gz NKZUPVOEVWQYKN-HXUWFJFHSA-N 0 0 383.448 3.219 20 5 GGBDRN CCCC[C@@H](CCC)NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000175991950 1428017368 /nfs/dbraw/zinc/01/73/68/1428017368.db2.gz ZNOBVEPZSHUSKD-QGZVFWFLSA-N 0 0 390.484 3.421 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175991789 1428017466 /nfs/dbraw/zinc/01/74/66/1428017466.db2.gz ARMOKFQVYRMZMT-MRXNPFEDSA-N 0 0 398.463 3.312 20 5 GGBDRN CSC1(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)CCOCC1 ZINC000175993257 1428017505 /nfs/dbraw/zinc/01/75/05/1428017505.db2.gz HRZRPHGEGYNTTO-UHFFFAOYSA-N 0 0 381.498 3.427 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1C[C@H]1c1cccc(F)c1F ZINC000175993975 1428018018 /nfs/dbraw/zinc/01/80/18/1428018018.db2.gz SMCCMKOAPJKCTR-STQMWFEESA-N 0 0 385.330 3.400 20 5 GGBDRN CC(C)COC(=O)N1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000176008369 1428024676 /nfs/dbraw/zinc/02/46/76/1428024676.db2.gz MZQVLMHBQNNJKH-UHFFFAOYSA-N 0 0 383.832 3.189 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NC2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000176019828 1428030278 /nfs/dbraw/zinc/03/02/78/1428030278.db2.gz DXFAYLQMJVUUGB-GFCCVEGCSA-N 0 0 388.390 3.290 20 5 GGBDRN CC(C)[C@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccnc1 ZINC000176027441 1428034763 /nfs/dbraw/zinc/03/47/63/1428034763.db2.gz HYRCHBWYOJBQSS-AWEZNQCLSA-N 0 0 390.827 3.138 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ncccc2F)C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000176049339 1428049637 /nfs/dbraw/zinc/04/96/37/1428049637.db2.gz SQMOROSUSCUJAT-GFCCVEGCSA-N 0 0 386.408 3.352 20 5 GGBDRN O=C(N[C@H]1CCN(c2ncccc2F)C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000176049311 1428049845 /nfs/dbraw/zinc/04/98/45/1428049845.db2.gz SQMOROSUSCUJAT-LBPRGKRZSA-N 0 0 386.408 3.352 20 5 GGBDRN CCC(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)cc1 ZINC000176056746 1428055627 /nfs/dbraw/zinc/05/56/27/1428055627.db2.gz NLNPURANGHKOMT-UHFFFAOYSA-N 0 0 381.385 3.192 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000176073201 1428068479 /nfs/dbraw/zinc/06/84/79/1428068479.db2.gz DMSXUJHEXUKVMY-UHFFFAOYSA-N 0 0 383.448 3.275 20 5 GGBDRN O=C(C[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccs1 ZINC000176079338 1428071488 /nfs/dbraw/zinc/07/14/88/1428071488.db2.gz JHQCFDXVPYLISC-LBPRGKRZSA-N 0 0 394.836 3.424 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)CCc1ccc(Br)c(C)c1 ZINC000176105344 1428085862 /nfs/dbraw/zinc/08/58/62/1428085862.db2.gz HXEUIWHCUZSVKC-UHFFFAOYSA-N 0 0 396.241 3.347 20 5 GGBDRN Cc1[nH]ccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000176131861 1428105144 /nfs/dbraw/zinc/10/51/44/1428105144.db2.gz NUMXLYOYICURFT-UHFFFAOYSA-N 0 0 382.342 3.213 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)cccc1[N+](=O)[O-] ZINC000176146023 1428117092 /nfs/dbraw/zinc/11/70/92/1428117092.db2.gz OXDKNLZPUPKUND-UHFFFAOYSA-N 0 0 382.420 3.492 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN(CC1CCC1)CC(F)(F)F ZINC000176149769 1428119736 /nfs/dbraw/zinc/11/97/36/1428119736.db2.gz ZDPQOIOGCPBXIG-UHFFFAOYSA-N 0 0 396.369 3.440 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)[C@H](C)C1CCCCC1 ZINC000176163611 1428130392 /nfs/dbraw/zinc/13/03/92/1428130392.db2.gz CCEYTBDFRFZEPA-STQMWFEESA-N 0 0 377.441 3.263 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000176166248 1428132063 /nfs/dbraw/zinc/13/20/63/1428132063.db2.gz PEWWXFCCDSTBMP-IBGZPJMESA-N 0 0 396.399 3.329 20 5 GGBDRN CCc1ccc(C(=O)OC[C@H]2CC(=O)N(CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176165947 1428132566 /nfs/dbraw/zinc/13/25/66/1428132566.db2.gz XTJIIAIXUKZSCV-KRWDZBQOSA-N 0 0 396.443 3.405 20 5 GGBDRN Nc1ccc(C(=O)N(Cc2ccccc2)C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000176168516 1428134177 /nfs/dbraw/zinc/13/41/77/1428134177.db2.gz OTZMEJYYIDBXKD-GOSISDBHSA-N 0 0 381.388 3.146 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000176168141 1428134369 /nfs/dbraw/zinc/13/43/69/1428134369.db2.gz FWUNXRQKHXHFBS-IBGZPJMESA-N 0 0 380.400 3.493 20 5 GGBDRN COc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000176169476 1428136301 /nfs/dbraw/zinc/13/63/01/1428136301.db2.gz OEIDNQHKANGVCA-KRWDZBQOSA-N 0 0 385.420 3.446 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OC[C@H]1CC(=O)N(CCc2ccccc2)C1 ZINC000176178015 1428142495 /nfs/dbraw/zinc/14/24/95/1428142495.db2.gz DIIBYGFNYXADDL-BLRBJFNZSA-N 0 0 394.427 3.242 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)OC[C@H]1CC(=O)N(CCc2ccccc2)C1 ZINC000176182901 1428146916 /nfs/dbraw/zinc/14/69/16/1428146916.db2.gz XCVXIMTWQLICGL-KRWDZBQOSA-N 0 0 382.416 3.151 20 5 GGBDRN CCC[C@@H](CCO)CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000176185707 1428149583 /nfs/dbraw/zinc/14/95/83/1428149583.db2.gz YOUQEJCNRDGMEY-INIZCTEOSA-N 0 0 377.485 3.360 20 5 GGBDRN CCC[C@H](CCO)CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000176185721 1428149788 /nfs/dbraw/zinc/14/97/88/1428149788.db2.gz YOUQEJCNRDGMEY-MRXNPFEDSA-N 0 0 377.485 3.360 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCCN(C(=O)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000176199025 1428161505 /nfs/dbraw/zinc/16/15/05/1428161505.db2.gz NRBQNAGVUNZBLN-UHFFFAOYSA-N 0 0 391.424 3.092 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000176228385 1428180016 /nfs/dbraw/zinc/18/00/16/1428180016.db2.gz XOQJWUMQOIOXQS-CJNGLKHVSA-N 0 0 376.434 3.150 20 5 GGBDRN CC[C@@H](NC(=O)N[C@@H](C)c1nnnn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000176238836 1428185487 /nfs/dbraw/zinc/18/54/87/1428185487.db2.gz SMNOSKVPRKVVLM-SUMWQHHRSA-N 0 0 395.423 3.082 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)c3cc(F)cc(C)c3[N+](=O)[O-])cc21 ZINC000176245354 1428190900 /nfs/dbraw/zinc/19/09/00/1428190900.db2.gz LAMIRPFRKJJISP-UHFFFAOYSA-N 0 0 386.383 3.387 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000176245702 1428192431 /nfs/dbraw/zinc/19/24/31/1428192431.db2.gz GWIKGLCSEJBQCZ-QGZVFWFLSA-N 0 0 381.432 3.405 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000176248938 1428194745 /nfs/dbraw/zinc/19/47/45/1428194745.db2.gz XKDQOHTVGBUAQP-IAQYHMDHSA-N 0 0 386.433 3.261 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000176256636 1428200070 /nfs/dbraw/zinc/20/00/70/1428200070.db2.gz QBXZAWKJTOHNQA-SOUVJXGZSA-N 0 0 376.457 3.053 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc1[N+](=O)[O-] ZINC000176260740 1428203324 /nfs/dbraw/zinc/20/33/24/1428203324.db2.gz FPRKPAWJEXWTJV-CYBMUJFWSA-N 0 0 395.415 3.238 20 5 GGBDRN CC[N@@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000180192963 1429794274 /nfs/dbraw/zinc/79/42/74/1429794274.db2.gz SNRLKXMVAQPSGY-KRWDZBQOSA-N 0 0 399.447 3.133 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cnn1-c1ccccc1 ZINC000180197584 1429798365 /nfs/dbraw/zinc/79/83/65/1429798365.db2.gz ZNKKWRHMEYIQKU-UHFFFAOYSA-N 0 0 399.794 3.320 20 5 GGBDRN CCOc1cc(Cl)ccc1CNS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000180197775 1429798942 /nfs/dbraw/zinc/79/89/42/1429798942.db2.gz SFKZWNGAHJBMFG-UHFFFAOYSA-N 0 0 398.868 3.309 20 5 GGBDRN Cc1ccc([C@](O)(CC(=O)N2CCc3c2cccc3[N+](=O)[O-])C(F)(F)F)o1 ZINC000180208644 1429802390 /nfs/dbraw/zinc/80/23/90/1429802390.db2.gz BRSWUIGXZIPHDO-MRXNPFEDSA-N 0 0 384.310 3.226 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180229277 1429808654 /nfs/dbraw/zinc/80/86/54/1429808654.db2.gz KZVLUWSDCRMVCD-RDTXWAMCSA-N 0 0 394.786 3.413 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NCC2(c3ccc(F)cc3F)CC2)cc1 ZINC000180232075 1429809428 /nfs/dbraw/zinc/80/94/28/1429809428.db2.gz CVZZPGPHUVSIOE-UHFFFAOYSA-N 0 0 396.415 3.067 20 5 GGBDRN CC(C)(C)c1nc(CCNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000180239105 1429811842 /nfs/dbraw/zinc/81/18/42/1429811842.db2.gz WAPNXBLCDXGPED-UHFFFAOYSA-N 0 0 397.522 3.053 20 5 GGBDRN Cc1c(C(=O)NCC2(C)Cc3ccccc3C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000180251796 1429815118 /nfs/dbraw/zinc/81/51/18/1429815118.db2.gz QSLPPKCYXVCRJF-UHFFFAOYSA-N 0 0 391.431 3.019 20 5 GGBDRN Cn1cc(/C=C2\N=C(c3cccc([N+](=O)[O-])c3)OC2=O)c(-c2cccs2)n1 ZINC000180253759 1429815667 /nfs/dbraw/zinc/81/56/67/1429815667.db2.gz SFRIVHJYCMAGHA-ZROIWOOFSA-N 0 0 380.385 3.401 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000180256261 1429816338 /nfs/dbraw/zinc/81/63/38/1429816338.db2.gz UHQUQEVXKWLESP-AEFFLSMTSA-N 0 0 394.786 3.413 20 5 GGBDRN CCCc1cnc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)s1 ZINC000180256163 1429816442 /nfs/dbraw/zinc/81/64/42/1429816442.db2.gz DJBLVIJCDJMDBH-LLVKDONJSA-N 0 0 394.478 3.309 20 5 GGBDRN Cc1nc(-c2cc3c(s2)CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C3)cs1 ZINC000180269118 1429819521 /nfs/dbraw/zinc/81/95/21/1429819521.db2.gz OOHYBLUKEZRZFQ-UHFFFAOYSA-N 0 0 389.462 3.020 20 5 GGBDRN CCc1nn(C)c(OC)c1CNC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000180273966 1429821203 /nfs/dbraw/zinc/82/12/03/1429821203.db2.gz MIVAIHONURRKCB-UHFFFAOYSA-N 0 0 392.481 3.330 20 5 GGBDRN CN(C(=O)CN[C@H](C(=O)OC(C)(C)C)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000180280762 1429823369 /nfs/dbraw/zinc/82/33/69/1429823369.db2.gz LWRBYCQEAAOXCG-IBGZPJMESA-N 0 0 399.447 3.230 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000180280467 1429823482 /nfs/dbraw/zinc/82/34/82/1429823482.db2.gz OXHODRJTUJUYGS-UHFFFAOYSA-N 0 0 385.767 3.011 20 5 GGBDRN C[C@H]1CN(C(=O)c2c3ccccc3cc3ccccc32)CCN1S(C)(=O)=O ZINC000180281698 1429823844 /nfs/dbraw/zinc/82/38/44/1429823844.db2.gz HVJSRZJIQNQDRO-HNNXBMFYSA-N 0 0 382.485 3.099 20 5 GGBDRN CNC(=O)c1cccc(C(=O)N(C)c2nc(-c3ccccc3[N+](=O)[O-])cs2)c1 ZINC000180285254 1429824603 /nfs/dbraw/zinc/82/46/03/1429824603.db2.gz MYSGCGUISJJRSM-UHFFFAOYSA-N 0 0 396.428 3.355 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000180285228 1429824720 /nfs/dbraw/zinc/82/47/20/1429824720.db2.gz FPBHCMJCRVKSBM-UHFFFAOYSA-N 0 0 376.434 3.486 20 5 GGBDRN CCN(CC)C(=O)CCC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180285453 1429824741 /nfs/dbraw/zinc/82/47/41/1429824741.db2.gz USSSEEPIINGXEQ-UHFFFAOYSA-N 0 0 390.465 3.330 20 5 GGBDRN O=C1NCCN(Cc2c(F)cccc2[N+](=O)[O-])[C@H]1c1ccccc1C(F)(F)F ZINC000180286465 1429824901 /nfs/dbraw/zinc/82/49/01/1429824901.db2.gz HRKLUTHYZBMQHK-INIZCTEOSA-N 0 0 397.328 3.426 20 5 GGBDRN O=C1NCCN(Cc2c(F)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1C(F)(F)F ZINC000180286448 1429825007 /nfs/dbraw/zinc/82/50/07/1429825007.db2.gz HRKLUTHYZBMQHK-MRXNPFEDSA-N 0 0 397.328 3.426 20 5 GGBDRN CN(C(=O)c1ccc(C(N)=O)s1)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180288936 1429825915 /nfs/dbraw/zinc/82/59/15/1429825915.db2.gz HCMLMFSLFMWBKP-UHFFFAOYSA-N 0 0 388.430 3.155 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)CC1 ZINC000180290015 1429826392 /nfs/dbraw/zinc/82/63/92/1429826392.db2.gz XQPHFOLORVVHMC-UHFFFAOYSA-N 0 0 399.447 3.315 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1 ZINC000180290651 1429826406 /nfs/dbraw/zinc/82/64/06/1429826406.db2.gz IFFBHIKYEGVVOY-UHFFFAOYSA-N 0 0 399.447 3.223 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000180292710 1429827019 /nfs/dbraw/zinc/82/70/19/1429827019.db2.gz ONNWXLHXKWICAU-UHFFFAOYSA-N 0 0 384.432 3.354 20 5 GGBDRN CCOC(=O)C(C)(C)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180297362 1429828534 /nfs/dbraw/zinc/82/85/34/1429828534.db2.gz PLPFEDMXCVLWTK-UHFFFAOYSA-N 0 0 377.422 3.270 20 5 GGBDRN CN(C)C(=O)CC1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000180325129 1429836347 /nfs/dbraw/zinc/83/63/47/1429836347.db2.gz ROKZHPSBLZAMTF-UHFFFAOYSA-N 0 0 388.493 3.409 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12 ZINC000180326344 1429836605 /nfs/dbraw/zinc/83/66/05/1429836605.db2.gz NCYDTPPFFKQXMH-IAOVAPTHSA-N 0 0 385.807 3.031 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000180329571 1429837343 /nfs/dbraw/zinc/83/73/43/1429837343.db2.gz IGQXTOZUDNRYPB-UHFFFAOYSA-N 0 0 388.367 3.016 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1c(F)cc(Cl)cc1F ZINC000180331659 1429837856 /nfs/dbraw/zinc/83/78/56/1429837856.db2.gz CRXLNCGRKIEVHR-UHFFFAOYSA-N 0 0 383.694 3.073 20 5 GGBDRN COc1ccc(C[C@H](C)C(=O)NCCNc2ccccc2[N+](=O)[O-])cc1OC ZINC000180339144 1429839498 /nfs/dbraw/zinc/83/94/98/1429839498.db2.gz IYMXGQVWYHNLNZ-AWEZNQCLSA-N 0 0 387.436 3.019 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000180348188 1429842123 /nfs/dbraw/zinc/84/21/23/1429842123.db2.gz SCDLETGURQZVQV-QGZVFWFLSA-N 0 0 395.337 3.043 20 5 GGBDRN CC(C)C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1nccs1 ZINC000180354897 1429844408 /nfs/dbraw/zinc/84/44/08/1429844408.db2.gz DDOQGCOGXRCHKC-ZDUSSCGKSA-N 0 0 396.856 3.488 20 5 GGBDRN CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nccs1 ZINC000180355717 1429844593 /nfs/dbraw/zinc/84/45/93/1429844593.db2.gz AXPMKYFJEJDWBJ-LBPRGKRZSA-N 0 0 396.856 3.488 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1CCCOc2cc(F)ccc21 ZINC000180380544 1429851800 /nfs/dbraw/zinc/85/18/00/1429851800.db2.gz YRPAIHPLPUMJQP-INIZCTEOSA-N 0 0 389.383 3.456 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000180391023 1429854230 /nfs/dbraw/zinc/85/42/30/1429854230.db2.gz VLSPHLYABMIKSA-UHFFFAOYSA-N 0 0 399.794 3.320 20 5 GGBDRN O=C(NC[C@H]1CCN(c2ccccc2)C1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180391457 1429854602 /nfs/dbraw/zinc/85/46/02/1429854602.db2.gz IQJUICPCAKIDBR-CYBMUJFWSA-N 0 0 391.374 3.453 20 5 GGBDRN COc1ccc([C@@H](C)CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000180399829 1429857348 /nfs/dbraw/zinc/85/73/48/1429857348.db2.gz WMYSFHKEBXLNOQ-INIZCTEOSA-N 0 0 383.448 3.165 20 5 GGBDRN CC(=O)N1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC000180400464 1429857360 /nfs/dbraw/zinc/85/73/60/1429857360.db2.gz GBXCEXDWAFTSFB-UHFFFAOYSA-N 0 0 396.447 3.421 20 5 GGBDRN CCCCCc1nnc(NC(=O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000180399864 1429857561 /nfs/dbraw/zinc/85/75/61/1429857561.db2.gz TWYLIGUDPMJQCP-GFCCVEGCSA-N 0 0 377.470 3.468 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc3cccc(Cl)c3n2)ccc1[N+](=O)[O-] ZINC000180405806 1429859476 /nfs/dbraw/zinc/85/94/76/1429859476.db2.gz YRYLTQWMPYMZLL-UHFFFAOYSA-N 0 0 398.806 3.473 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(Cc1ccccc1)CC(C)(C)O ZINC000180432888 1429868328 /nfs/dbraw/zinc/86/83/28/1429868328.db2.gz RAOXWCPNYOYXNO-UHFFFAOYSA-N 0 0 387.436 3.086 20 5 GGBDRN CC(C)(C)N(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000180443088 1429870685 /nfs/dbraw/zinc/87/06/85/1429870685.db2.gz OXULHVNRRVXTTM-UHFFFAOYSA-N 0 0 390.461 3.439 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000180444839 1429871002 /nfs/dbraw/zinc/87/10/02/1429871002.db2.gz DKYXZTQGBOSXRO-UHFFFAOYSA-N 0 0 379.319 3.085 20 5 GGBDRN C[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000180447281 1429871523 /nfs/dbraw/zinc/87/15/23/1429871523.db2.gz IKBUSDZPTFVCER-JTQLQIEISA-N 0 0 378.772 3.446 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(Cn3cc(CCO)c(C(F)(F)F)n3)co2)cc1 ZINC000180458268 1429874023 /nfs/dbraw/zinc/87/40/23/1429874023.db2.gz BODDGRGDZLITGT-UHFFFAOYSA-N 0 0 382.298 3.048 20 5 GGBDRN Cc1cccc(C2=CCN(C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)CC2)c1 ZINC000180461028 1429874692 /nfs/dbraw/zinc/87/46/92/1429874692.db2.gz JSKURNZFNWYUPN-UHFFFAOYSA-N 0 0 389.415 3.413 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CC(=O)N(C2CCCC2)C1 ZINC000180467336 1429875890 /nfs/dbraw/zinc/87/58/90/1429875890.db2.gz UCPMRFODEWXBMM-JTQLQIEISA-N 0 0 385.342 3.343 20 5 GGBDRN Cc1oc2ncn(C)c(=O)c2c1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180467558 1429875994 /nfs/dbraw/zinc/87/59/94/1429875994.db2.gz LUWILCBDMRMKHK-UHFFFAOYSA-N 0 0 396.281 3.014 20 5 GGBDRN O=C(CCNC(=O)Cc1ccccc1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180468521 1429876133 /nfs/dbraw/zinc/87/61/33/1429876133.db2.gz XADVQYQSFJMTMU-UHFFFAOYSA-N 0 0 395.337 3.301 20 5 GGBDRN Cc1sc(=O)n(CCC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1C ZINC000180469046 1429876270 /nfs/dbraw/zinc/87/62/70/1429876270.db2.gz KVRROPPQWAMQEC-UHFFFAOYSA-N 0 0 389.355 3.482 20 5 GGBDRN CN(Cc1ncc(Cl)n1C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000180472084 1429877415 /nfs/dbraw/zinc/87/74/15/1429877415.db2.gz RGAHOXYIRQMNDO-UHFFFAOYSA-N 0 0 391.859 3.244 20 5 GGBDRN CC(C)n1nnnc1-c1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1F ZINC000180472442 1429877581 /nfs/dbraw/zinc/87/75/81/1429877581.db2.gz CKVDBBCDYICZJJ-UHFFFAOYSA-N 0 0 384.371 3.150 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)cccc1[N+](=O)[O-] ZINC000180478286 1429878909 /nfs/dbraw/zinc/87/89/09/1429878909.db2.gz QDIWMMVHQJIUOM-UHFFFAOYSA-N 0 0 398.398 3.458 20 5 GGBDRN Cc1ccc(Sc2ccc(CN3CCN4C(=O)NC[C@H]4C3)cc2[N+](=O)[O-])cc1 ZINC000180479637 1429879418 /nfs/dbraw/zinc/87/94/18/1429879418.db2.gz PDEIVOUQFYIXNZ-INIZCTEOSA-N 0 0 398.488 3.264 20 5 GGBDRN CC(C)n1nnnc1-c1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1F ZINC000180481198 1429879739 /nfs/dbraw/zinc/87/97/39/1429879739.db2.gz NDARCULIKDXYBF-UHFFFAOYSA-N 0 0 376.373 3.282 20 5 GGBDRN CC(C)(C)C[C@@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C(F)(F)F ZINC000180490910 1429881465 /nfs/dbraw/zinc/88/14/65/1429881465.db2.gz FEIIPUWWPAAUFP-GFCCVEGCSA-N 0 0 396.387 3.095 20 5 GGBDRN COc1ccc(C)cc1-c1csc(NC(=O)c2cc([N+](=O)[O-])cnc2N)n1 ZINC000180508334 1429885364 /nfs/dbraw/zinc/88/53/64/1429885364.db2.gz QHKBKRSRXQQRFW-UHFFFAOYSA-N 0 0 385.405 3.265 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000180509726 1429885789 /nfs/dbraw/zinc/88/57/89/1429885789.db2.gz CZDMCEHOMGHZEA-MRXNPFEDSA-N 0 0 379.338 3.249 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2cn3ccsc3n2)cc1 ZINC000180509734 1429885888 /nfs/dbraw/zinc/88/58/88/1429885888.db2.gz AEOGZYPULLIQNL-UHFFFAOYSA-N 0 0 380.389 3.201 20 5 GGBDRN CC(C)(C)C[C@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000180511939 1429886434 /nfs/dbraw/zinc/88/64/34/1429886434.db2.gz MKBBJZQLQRCVBT-ZDUSSCGKSA-N 0 0 385.346 3.272 20 5 GGBDRN CC(C)(C)C[C@@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000180511962 1429886462 /nfs/dbraw/zinc/88/64/62/1429886462.db2.gz MKBBJZQLQRCVBT-CYBMUJFWSA-N 0 0 385.346 3.272 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1 ZINC000180513151 1429886760 /nfs/dbraw/zinc/88/67/60/1429886760.db2.gz DEQLTOJRPHVMRM-UHFFFAOYSA-N 0 0 383.389 3.138 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@H](C)[C@@H]3CCCC[C@@H]32)nn1-c1ccccc1[N+](=O)[O-] ZINC000180517368 1429887597 /nfs/dbraw/zinc/88/75/97/1429887597.db2.gz KCSGODNEQIAXAR-BPUTZDHNSA-N 0 0 396.447 3.100 20 5 GGBDRN CC[C@@H](C)N(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)[C@@H](C)CC ZINC000180520332 1429888318 /nfs/dbraw/zinc/88/83/18/1429888318.db2.gz LJXFRQPVVRSUMN-OKILXGFUSA-N 0 0 386.452 3.488 20 5 GGBDRN COc1cc(CCNC(=O)N[C@H]2CC23CCCCC3)c([N+](=O)[O-])cc1OC ZINC000180544569 1429894281 /nfs/dbraw/zinc/89/42/81/1429894281.db2.gz RPZJWJVBWCLNSV-KRWDZBQOSA-N 0 0 377.441 3.177 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ncc(Cc2ccc(F)cc2F)s1 ZINC000180547056 1429895030 /nfs/dbraw/zinc/89/50/30/1429895030.db2.gz AMHIKXRHWJFILU-UHFFFAOYSA-N 0 0 391.359 3.150 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCO[C@H]([C@@H]4CCCO4)C3)cs2)c1 ZINC000180559847 1429897428 /nfs/dbraw/zinc/89/74/28/1429897428.db2.gz BFYOEYYEYMNTTH-IRXDYDNUSA-N 0 0 375.450 3.098 20 5 GGBDRN Cn1c2ccccc2nc1-c1ccc(NC(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000180560723 1429897966 /nfs/dbraw/zinc/89/79/66/1429897966.db2.gz SGWKYDDKWXLBRL-UHFFFAOYSA-N 0 0 388.387 3.378 20 5 GGBDRN Cc1c(C(=O)Nc2cc(C(F)(F)F)ccn2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000180566623 1429899710 /nfs/dbraw/zinc/89/97/10/1429899710.db2.gz NDDAQZANGGCPOH-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000180568913 1429899927 /nfs/dbraw/zinc/89/99/27/1429899927.db2.gz JXRDSWMYOGFHKS-UHFFFAOYSA-N 0 0 385.420 3.483 20 5 GGBDRN Cc1nc([C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc2)no1 ZINC000180596653 1429921712 /nfs/dbraw/zinc/92/17/12/1429921712.db2.gz ZPDISLBYDDPLNH-KRWDZBQOSA-N 0 0 386.795 3.388 20 5 GGBDRN Cc1nc([C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc2)no1 ZINC000180596639 1429921740 /nfs/dbraw/zinc/92/17/40/1429921740.db2.gz ZPDISLBYDDPLNH-QGZVFWFLSA-N 0 0 386.795 3.388 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000180616945 1429935441 /nfs/dbraw/zinc/93/54/41/1429935441.db2.gz XDHBGOWYYOQRIU-YJBOKZPZSA-N 0 0 379.457 3.386 20 5 GGBDRN CC(=O)Nc1nc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cs1 ZINC000180619114 1429936554 /nfs/dbraw/zinc/93/65/54/1429936554.db2.gz XNTZOLTURFCUGX-UHFFFAOYSA-N 0 0 385.199 3.025 20 5 GGBDRN CC(C)CCn1cc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)nn1 ZINC000180621879 1429938039 /nfs/dbraw/zinc/93/80/39/1429938039.db2.gz RMEFTOHCYAHHAR-UHFFFAOYSA-N 0 0 382.218 3.247 20 5 GGBDRN CCCC(=O)N1CCC[C@H]1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180623937 1429938417 /nfs/dbraw/zinc/93/84/17/1429938417.db2.gz HGGJATOTXLHONJ-LBPRGKRZSA-N 0 0 384.230 3.087 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1Cc2cc(F)ccc2O1 ZINC000180622903 1429938631 /nfs/dbraw/zinc/93/86/31/1429938631.db2.gz ZJBHJEHKODFVKY-AWEZNQCLSA-N 0 0 381.157 3.439 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])CC1 ZINC000180638331 1429947465 /nfs/dbraw/zinc/94/74/65/1429947465.db2.gz QFYWATYYUMYQHX-UHFFFAOYSA-N 0 0 391.468 3.104 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1 ZINC000180641435 1429949210 /nfs/dbraw/zinc/94/92/10/1429949210.db2.gz XGUZRTAFLFYJRJ-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN CCOc1cc(CN(C)C(=O)c2c(N)cccc2[N+](=O)[O-])ccc1OC(F)F ZINC000180642035 1429950017 /nfs/dbraw/zinc/95/00/17/1429950017.db2.gz QPDURQRADHHAJB-UHFFFAOYSA-N 0 0 395.362 3.449 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000180641731 1429950114 /nfs/dbraw/zinc/95/01/14/1429950114.db2.gz VPOSMHSLZOJWIS-UHFFFAOYSA-N 0 0 375.469 3.404 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N[C@@H]2CC23CCCCC3)ccc1[N+](=O)[O-] ZINC000180652729 1429957532 /nfs/dbraw/zinc/95/75/32/1429957532.db2.gz JLHBKFAQXSQGJR-ZWKOTPCHSA-N 0 0 385.464 3.347 20 5 GGBDRN O=C(Nc1c[nH]nc1-c1ccccc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180655903 1429959249 /nfs/dbraw/zinc/95/92/49/1429959249.db2.gz CWGZLDKRNSRYCN-UHFFFAOYSA-N 0 0 385.767 3.216 20 5 GGBDRN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180665234 1429963672 /nfs/dbraw/zinc/96/36/72/1429963672.db2.gz UIRUTVANKMXWAS-UHFFFAOYSA-N 0 0 396.325 3.030 20 5 GGBDRN C[C@@H]1CN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H]2CCCC[C@@H]21 ZINC000180674898 1429968898 /nfs/dbraw/zinc/96/88/98/1429968898.db2.gz CXTYYYGTNZNACE-MPKXVKKWSA-N 0 0 397.378 3.172 20 5 GGBDRN C[C@@H]1C[C@@H](C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC(C)(C)C1 ZINC000180694130 1429981319 /nfs/dbraw/zinc/98/13/19/1429981319.db2.gz WMYGOUXOBDNHHT-NVXWUHKLSA-N 0 0 387.480 3.342 20 5 GGBDRN Cc1nc(Br)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000180698151 1429983952 /nfs/dbraw/zinc/98/39/52/1429983952.db2.gz SGKYJWHBRRSHCE-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000180702499 1429986569 /nfs/dbraw/zinc/98/65/69/1429986569.db2.gz HEXFZNBXBAVUKR-LBPRGKRZSA-N 0 0 375.347 3.325 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc2c(c1)CC(=O)N2 ZINC000180701714 1429986826 /nfs/dbraw/zinc/98/68/26/1429986826.db2.gz XILTYFROLHRDDW-SECBINFHSA-N 0 0 391.330 3.182 20 5 GGBDRN Cc1nc(Br)ccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000180702192 1429986870 /nfs/dbraw/zinc/98/68/70/1429986870.db2.gz SOFLGBIFKBXNTD-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN O=C(N[C@H]1CC12CCCCC2)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000180712449 1429993675 /nfs/dbraw/zinc/99/36/75/1429993675.db2.gz VEMVOFJBGOCAMX-JSGCOSHPSA-N 0 0 377.466 3.100 20 5 GGBDRN CC[C@]1(C(=O)NCc2ccccc2[N+](=O)[O-])CCCN1C(=O)OC(C)(C)C ZINC000180713464 1429994430 /nfs/dbraw/zinc/99/44/30/1429994430.db2.gz OBUYQLJGKFZDPX-LJQANCHMSA-N 0 0 377.441 3.391 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(Oc2cccc(F)c2)nc1 ZINC000180729888 1430004401 /nfs/dbraw/zinc/00/44/01/1430004401.db2.gz VGTNOIBRXBISKQ-UHFFFAOYSA-N 0 0 382.351 3.433 20 5 GGBDRN Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000180739096 1430009978 /nfs/dbraw/zinc/00/99/78/1430009978.db2.gz SALSLANLBZYTSO-CYBMUJFWSA-N 0 0 388.855 3.395 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCCCc1nc(-c2ccncc2)cs1 ZINC000180744294 1430013022 /nfs/dbraw/zinc/01/30/22/1430013022.db2.gz TWGYTTPZSFPBLY-UHFFFAOYSA-N 0 0 383.433 3.058 20 5 GGBDRN COCCn1ccc2ccc(NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)cc21 ZINC000180744078 1430013262 /nfs/dbraw/zinc/01/32/62/1430013262.db2.gz GEZCZBHIQPGXNR-UHFFFAOYSA-N 0 0 385.424 3.038 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)C(C)(C)C)CC1 ZINC000180745869 1430014524 /nfs/dbraw/zinc/01/45/24/1430014524.db2.gz SCBRMLKCKAGWHK-UHFFFAOYSA-N 0 0 393.509 3.426 20 5 GGBDRN Cc1cc(N(C)Cc2ccc(-c3nnn[n-]3)cc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000826268963 1430015845 /nfs/dbraw/zinc/01/58/45/1430015845.db2.gz VIDJAVRYDDLYPF-UHFFFAOYSA-N 0 0 375.392 3.268 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c(N)c([N+](=O)[O-])c1 ZINC000180768105 1430028707 /nfs/dbraw/zinc/02/87/07/1430028707.db2.gz BKHQDYFXBGTKOR-NSHDSACASA-N 0 0 397.357 3.178 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(Cc2ccccc2)CC(C)(C)O)cc1C ZINC000180774771 1430032135 /nfs/dbraw/zinc/03/21/35/1430032135.db2.gz 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CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1Cl ZINC000180822150 1430057823 /nfs/dbraw/zinc/05/78/23/1430057823.db2.gz OJTRSIPVAMENPA-UHFFFAOYSA-N 0 0 399.737 3.462 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000180827301 1430060447 /nfs/dbraw/zinc/06/04/47/1430060447.db2.gz FXLSUGVMVLNAGP-UHFFFAOYSA-N 0 0 397.357 3.357 20 5 GGBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1noc(-c2ccc(Cl)cc2)n1 ZINC000180849090 1430068551 /nfs/dbraw/zinc/06/85/51/1430068551.db2.gz WUGKMXLTNAWDSM-VIFPVBQESA-N 0 0 387.783 3.371 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCO1 ZINC000180852532 1430070707 /nfs/dbraw/zinc/07/07/07/1430070707.db2.gz RMOGGNQRRRVLND-APWZRJJASA-N 0 0 386.452 3.494 20 5 GGBDRN CCCOc1cc(NC(=O)Cc2ccn(C)n2)c([N+](=O)[O-])cc1OCCC ZINC000180857872 1430073254 /nfs/dbraw/zinc/07/32/54/1430073254.db2.gz KDLCNCLNLKBVLM-UHFFFAOYSA-N 0 0 376.413 3.087 20 5 GGBDRN Cn1cnc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)c2)n1 ZINC000180868918 1430077830 /nfs/dbraw/zinc/07/78/30/1430077830.db2.gz NAYJEUWVGRUNNI-UHFFFAOYSA-N 0 0 392.419 3.243 20 5 GGBDRN CC(C)C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1nccs1 ZINC000180871423 1430079090 /nfs/dbraw/zinc/07/90/90/1430079090.db2.gz VEJKERCCNZNTJQ-CYBMUJFWSA-N 0 0 396.856 3.488 20 5 GGBDRN CC(C)C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1nccs1 ZINC000180871406 1430079203 /nfs/dbraw/zinc/07/92/03/1430079203.db2.gz VEJKERCCNZNTJQ-ZDUSSCGKSA-N 0 0 396.856 3.488 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCCOc2c(F)cccc21 ZINC000180871115 1430079399 /nfs/dbraw/zinc/07/93/99/1430079399.db2.gz IVSVDWUCVYCCIT-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN CNC(=O)c1ccc(C)c(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000180874766 1430081441 /nfs/dbraw/zinc/08/14/41/1430081441.db2.gz IECJRAPIJDISGI-UHFFFAOYSA-N 0 0 379.420 3.275 20 5 GGBDRN O=C(N[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000180882329 1430086505 /nfs/dbraw/zinc/08/65/05/1430086505.db2.gz XPEAYCHESBZEDJ-VIFPVBQESA-N 0 0 395.749 3.062 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2n[nH]c(Cc3cccc(F)c3)n2)c1 ZINC000180882083 1430086824 /nfs/dbraw/zinc/08/68/24/1430086824.db2.gz HPMMXOLRXMDEIC-UHFFFAOYSA-N 0 0 387.396 3.417 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2CCCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000180884014 1430088001 /nfs/dbraw/zinc/08/80/01/1430088001.db2.gz BDKXXDOATCMNNH-HNNXBMFYSA-N 0 0 387.367 3.011 20 5 GGBDRN CC[C@@H](C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(OC)cc1 ZINC000180885124 1430088408 /nfs/dbraw/zinc/08/84/08/1430088408.db2.gz ACRQJQOATLXANE-MAUKXSAKSA-N 0 0 384.436 3.205 20 5 GGBDRN CC[C@H](C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(OC)cc1 ZINC000180885109 1430088662 /nfs/dbraw/zinc/08/86/62/1430088662.db2.gz ACRQJQOATLXANE-YJBOKZPZSA-N 0 0 384.436 3.205 20 5 GGBDRN CCC(CC)n1nc(C)cc1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000180885189 1430088699 /nfs/dbraw/zinc/08/86/99/1430088699.db2.gz 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ZINC000180971982 1430143971 /nfs/dbraw/zinc/14/39/71/1430143971.db2.gz SPISISLAHHSPFH-ZFWWWQNUSA-N 0 0 399.472 3.277 20 5 GGBDRN C[C@H](CCO)N(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000180977546 1430148305 /nfs/dbraw/zinc/14/83/05/1430148305.db2.gz LYEOMJFFVCWIKE-OAHLLOKOSA-N 0 0 382.420 3.418 20 5 GGBDRN C[C@@H](CCO)N(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000180979462 1430148922 /nfs/dbraw/zinc/14/89/22/1430148922.db2.gz OLRYKQPASSANGI-AWEZNQCLSA-N 0 0 391.855 3.460 20 5 GGBDRN Cc1cc([C@]2(C)NC(=O)N(Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)c(C)o1 ZINC000180978957 1430149131 /nfs/dbraw/zinc/14/91/31/1430149131.db2.gz GWUWHRUMRYHQMU-KRWDZBQOSA-N 0 0 377.784 3.425 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1nc2ccccc2s1 ZINC000180982263 1430150503 /nfs/dbraw/zinc/15/05/03/1430150503.db2.gz SIHZGJMGXCTWTP-UHFFFAOYSA-N 0 0 384.417 3.076 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N(c1cccc(F)c1)C1CCOCC1 ZINC000180996892 1430158826 /nfs/dbraw/zinc/15/88/26/1430158826.db2.gz SFHAHNRUKUIUDB-UHFFFAOYSA-N 0 0 389.339 3.468 20 5 GGBDRN C[C@@H](O)[C@@H]1CCN(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000181004983 1430162875 /nfs/dbraw/zinc/16/28/75/1430162875.db2.gz NNYFJFIRDZERSM-IIAWOOMASA-N 0 0 384.436 3.006 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@H]([C@@H](C)O)C3)cc2[N+](=O)[O-])n1 ZINC000181012855 1430166332 /nfs/dbraw/zinc/16/63/32/1430166332.db2.gz RFXZGNSMLBVTCI-YPMHNXCESA-N 0 0 393.490 3.354 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@H]([C@H](C)O)C3)cc2[N+](=O)[O-])n1 ZINC000181012909 1430166853 /nfs/dbraw/zinc/16/68/53/1430166853.db2.gz RFXZGNSMLBVTCI-WCQYABFASA-N 0 0 393.490 3.354 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000181017023 1430168254 /nfs/dbraw/zinc/16/82/54/1430168254.db2.gz FOPJAIQQXPDMHI-JTQLQIEISA-N 0 0 384.358 3.390 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000181025601 1430173653 /nfs/dbraw/zinc/17/36/53/1430173653.db2.gz FAEMUILEUQGQRG-CJNGLKHVSA-N 0 0 379.775 3.230 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc(F)cc1[N+](=O)[O-] ZINC000181026812 1430174862 /nfs/dbraw/zinc/17/48/62/1430174862.db2.gz WBZARUIUXBQYCH-CJNGLKHVSA-N 0 0 397.765 3.369 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ccc(Sc2ccc(F)cc2)cc1 ZINC000181032601 1430176016 /nfs/dbraw/zinc/17/60/16/1430176016.db2.gz ZZQJWNDNJPDRTJ-UHFFFAOYSA-N 0 0 386.408 3.398 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000181031476 1430176360 /nfs/dbraw/zinc/17/63/60/1430176360.db2.gz IDXWXWPDWBXSFY-BBRMVZONSA-N 0 0 396.806 3.323 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000181031455 1430176559 /nfs/dbraw/zinc/17/65/59/1430176559.db2.gz IDXWXWPDWBXSFY-CJNGLKHVSA-N 0 0 396.806 3.323 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000181036169 1430179672 /nfs/dbraw/zinc/17/96/72/1430179672.db2.gz DGFRVIQYPOUYSE-YJBOKZPZSA-N 0 0 393.802 3.446 20 5 GGBDRN COc1ccccc1SC[C@@H](C)CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181043007 1430182732 /nfs/dbraw/zinc/18/27/32/1430182732.db2.gz LPOVFZHNFLOQDK-LBPRGKRZSA-N 0 0 375.450 3.344 20 5 GGBDRN Cn1cnc2cc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cnc21 ZINC000181057194 1430190056 /nfs/dbraw/zinc/19/00/56/1430190056.db2.gz JUQZUVJBVVBTFT-UHFFFAOYSA-N 0 0 380.389 3.252 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc4nncn4c3)cc2[N+](=O)[O-])C1 ZINC000181060059 1430192568 /nfs/dbraw/zinc/19/25/68/1430192568.db2.gz SNFKTRZTBMSVBV-ZIAGYGMSSA-N 0 0 394.435 3.372 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CCC(N)=O)C1 ZINC000181075164 1430199575 /nfs/dbraw/zinc/19/95/75/1430199575.db2.gz ZNMSIPDQYLQGKU-ZDUSSCGKSA-N 0 0 379.482 3.213 20 5 GGBDRN CC1CCC(Oc2cc(CNC(=O)c3c(N)cccc3[N+](=O)[O-])ccn2)CC1 ZINC000181083802 1430204141 /nfs/dbraw/zinc/20/41/41/1430204141.db2.gz ADFSJRSUOLTDMM-UHFFFAOYSA-N 0 0 384.436 3.460 20 5 GGBDRN CC(C)(C)[C@@H]1CCc2nc(NC(=O)Cn3cc([N+](=O)[O-])ccc3=O)sc2C1 ZINC000181092412 1430207275 /nfs/dbraw/zinc/20/72/75/1430207275.db2.gz JFYMPFBNJDEICX-LLVKDONJSA-N 0 0 390.465 3.003 20 5 GGBDRN O=C(Nc1nncn1-c1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000181106647 1430212465 /nfs/dbraw/zinc/21/24/65/1430212465.db2.gz LPITYHWPHZIIKN-UHFFFAOYSA-N 0 0 392.419 3.418 20 5 GGBDRN CCCN1C(=O)CCc2cc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)ccc21 ZINC000181107933 1430213155 /nfs/dbraw/zinc/21/31/55/1430213155.db2.gz FLADNKIDFJCVBW-UHFFFAOYSA-N 0 0 393.403 3.413 20 5 GGBDRN C[C@@H](Cc1nc2ccccc2s1)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181113924 1430214969 /nfs/dbraw/zinc/21/49/69/1430214969.db2.gz UBQGFYYCBVTHRA-JTQLQIEISA-N 0 0 385.401 3.294 20 5 GGBDRN O=C(NC1CC1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000181130938 1430220226 /nfs/dbraw/zinc/22/02/26/1430220226.db2.gz DIMFFOZRFNCRKU-UHFFFAOYSA-N 0 0 391.330 3.341 20 5 GGBDRN O=C(Nc1ccnn1Cc1ccccn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000181165563 1430234300 /nfs/dbraw/zinc/23/43/00/1430234300.db2.gz XIJLYRDKIRVGCF-UHFFFAOYSA-N 0 0 392.419 3.431 20 5 GGBDRN Cc1ccc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])c(OCC(F)(F)F)c1 ZINC000181179581 1430239734 /nfs/dbraw/zinc/23/97/34/1430239734.db2.gz WAJVAPBHNQUCDB-UHFFFAOYSA-N 0 0 383.326 3.357 20 5 GGBDRN Cc1nnc(-c2cccc(NC(=O)[C@@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)c2)o1 ZINC000181182731 1430240516 /nfs/dbraw/zinc/24/05/16/1430240516.db2.gz DLSHZBOTIFSAQD-KRWDZBQOSA-N 0 0 393.359 3.085 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])c(OC(F)F)c1 ZINC000181199804 1430246302 /nfs/dbraw/zinc/24/63/02/1430246302.db2.gz WQGURXKVHWSGPJ-UHFFFAOYSA-N 0 0 395.362 3.497 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(COCC(F)(F)F)c1 ZINC000181247197 1430256250 /nfs/dbraw/zinc/25/62/50/1430256250.db2.gz NXEYHORKRXIWLR-UHFFFAOYSA-N 0 0 383.326 3.186 20 5 GGBDRN Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)c4c(N)cccc4[N+](=O)[O-])C3)nc2c1 ZINC000181248346 1430256259 /nfs/dbraw/zinc/25/62/59/1430256259.db2.gz ZOCWXUYXLHTRAF-CYBMUJFWSA-N 0 0 379.420 3.382 20 5 GGBDRN CC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000181258225 1430257609 /nfs/dbraw/zinc/25/76/09/1430257609.db2.gz WBRUKHIZEAXANZ-ZDUSSCGKSA-N 0 0 377.828 3.361 20 5 GGBDRN C[C@@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccc(-n2cccn2)cc1 ZINC000181283269 1430262336 /nfs/dbraw/zinc/26/23/36/1430262336.db2.gz PJUARCUDBOOZED-GFCCVEGCSA-N 0 0 380.360 3.000 20 5 GGBDRN C[C@@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1cccc(-n2cccn2)c1 ZINC000181286192 1430263001 /nfs/dbraw/zinc/26/30/01/1430263001.db2.gz APQWOCWKUOOWOB-GFCCVEGCSA-N 0 0 380.360 3.000 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)S(=O)(=O)Cc1nnc(C2CC2)n1C1CC1 ZINC000181293833 1430265178 /nfs/dbraw/zinc/26/51/78/1430265178.db2.gz HQBUTOMQQFECTC-GFCCVEGCSA-N 0 0 390.465 3.383 20 5 GGBDRN Cc1cc(COC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000181298323 1430266241 /nfs/dbraw/zinc/26/62/41/1430266241.db2.gz QLVPOVIOXHFRFK-UHFFFAOYSA-N 0 0 391.445 3.371 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000181311107 1430270008 /nfs/dbraw/zinc/27/00/08/1430270008.db2.gz CWYRUBIMGXIELA-CJNGLKHVSA-N 0 0 379.775 3.230 20 5 GGBDRN O=C(OCCOc1ccnc(Cl)c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000181320567 1430272455 /nfs/dbraw/zinc/27/24/55/1430272455.db2.gz FAIKFJXLRANUGU-UHFFFAOYSA-N 0 0 388.767 3.065 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F ZINC000181325775 1430273068 /nfs/dbraw/zinc/27/30/68/1430273068.db2.gz AAVBKPLMCNODKA-LLVKDONJSA-N 0 0 396.247 3.381 20 5 GGBDRN O=C(OCCOc1ccnc(Cl)c1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000181324669 1430273161 /nfs/dbraw/zinc/27/31/61/1430273161.db2.gz GHRMYDGQBMGTKS-UHFFFAOYSA-N 0 0 388.767 3.065 20 5 GGBDRN O=C(CN1CCCCCCC1=O)O[C@H](c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000181332317 1430275187 /nfs/dbraw/zinc/27/51/87/1430275187.db2.gz AUSSJSCARKMEEZ-OAQYLSRUSA-N 0 0 397.431 3.415 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc2cccc(Cl)c2n1 ZINC000181338775 1430276681 /nfs/dbraw/zinc/27/66/81/1430276681.db2.gz VGAGZFFDEBNKFR-UHFFFAOYSA-N 0 0 384.779 3.165 20 5 GGBDRN O=C(OCCOc1ccnc(Cl)c1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181357215 1430280994 /nfs/dbraw/zinc/28/09/94/1430280994.db2.gz VCQPLYBDTLRGDX-UHFFFAOYSA-N 0 0 388.767 3.065 20 5 GGBDRN COc1ccc2ccccc2c1CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O ZINC000181362246 1430282094 /nfs/dbraw/zinc/28/20/94/1430282094.db2.gz UGTYWXBKDQRXCB-UHFFFAOYSA-N 0 0 387.417 3.016 20 5 GGBDRN O=C(Nc1ccc(-n2ccnn2)cc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181406336 1430290432 /nfs/dbraw/zinc/29/04/32/1430290432.db2.gz VVDOSUMUEXZNTB-UHFFFAOYSA-N 0 0 375.291 3.029 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)c1ccc(F)c(Cl)c1 ZINC000181409256 1430290785 /nfs/dbraw/zinc/29/07/85/1430290785.db2.gz LJVQPNDSFDLPBF-SNVBAGLBSA-N 0 0 379.775 3.169 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000181411614 1430291272 /nfs/dbraw/zinc/29/12/72/1430291272.db2.gz SDJRSPMQQYBHAS-UHFFFAOYSA-N 0 0 387.367 3.179 20 5 GGBDRN COC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)c(F)c1 ZINC000181412678 1430291561 /nfs/dbraw/zinc/29/15/61/1430291561.db2.gz OUVOGWKHPQCBJS-INIZCTEOSA-N 0 0 399.781 3.442 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000181413192 1430291965 /nfs/dbraw/zinc/29/19/65/1430291965.db2.gz KHLVEWQVWQRHGZ-UHFFFAOYSA-N 0 0 391.305 3.126 20 5 GGBDRN O=C(Nc1n[nH]c(-c2ccccc2F)n1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181415208 1430292592 /nfs/dbraw/zinc/29/25/92/1430292592.db2.gz OBWUKRYJSWSGIY-UHFFFAOYSA-N 0 0 393.281 3.373 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2ncccc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000181422013 1430294650 /nfs/dbraw/zinc/29/46/50/1430294650.db2.gz NSLYXXFGCDWOEM-UHFFFAOYSA-N 0 0 397.412 3.313 20 5 GGBDRN COC[C@@H](NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 ZINC000181427695 1430296321 /nfs/dbraw/zinc/29/63/21/1430296321.db2.gz VORJHEIIGGLAIR-QGZVFWFLSA-N 0 0 379.363 3.097 20 5 GGBDRN COC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(F)c(F)c1 ZINC000181427747 1430296456 /nfs/dbraw/zinc/29/64/56/1430296456.db2.gz BLQAEHONWFQXMR-QGZVFWFLSA-N 0 0 379.363 3.097 20 5 GGBDRN COC[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(F)c(F)c1 ZINC000181438006 1430298848 /nfs/dbraw/zinc/29/88/48/1430298848.db2.gz PDJATLKKURGVTH-INIZCTEOSA-N 0 0 390.346 3.400 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)[C@H](CO)C1CC1 ZINC000181443617 1430300499 /nfs/dbraw/zinc/30/04/99/1430300499.db2.gz GTOKUYGEKCDGIT-LJQANCHMSA-N 0 0 386.473 3.487 20 5 GGBDRN CCC1(CC)[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@H](C)[C@@H]1OC ZINC000181451331 1430302748 /nfs/dbraw/zinc/30/27/48/1430302748.db2.gz RCQPQBPHLKFLPS-PDSMFRHLSA-N 0 0 387.436 3.006 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000181488639 1430309100 /nfs/dbraw/zinc/30/91/00/1430309100.db2.gz MFJZOVVMGIGJTA-UHFFFAOYSA-N 0 0 386.305 3.427 20 5 GGBDRN CCn1c(S[C@@H](C)c2nc(COC)no2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000181503118 1430311626 /nfs/dbraw/zinc/31/16/26/1430311626.db2.gz GFQIPBZQHVQQJY-JTQLQIEISA-N 0 0 390.425 3.256 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cccc1[N+](=O)[O-] ZINC000181515618 1430313750 /nfs/dbraw/zinc/31/37/50/1430313750.db2.gz VGBMFVXYBVDSLD-LLVKDONJSA-N 0 0 390.346 3.108 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCO[C@@H](Cc2ccccc2)C1 ZINC000181526678 1430315380 /nfs/dbraw/zinc/31/53/80/1430315380.db2.gz RPFAYXUHZQDSDA-IBGZPJMESA-N 0 0 383.448 3.175 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCO[C@H](Cc2ccccc2)C1 ZINC000181526663 1430315475 /nfs/dbraw/zinc/31/54/75/1430315475.db2.gz RPFAYXUHZQDSDA-LJQANCHMSA-N 0 0 383.448 3.175 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC=C(c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000181533784 1430316857 /nfs/dbraw/zinc/31/68/57/1430316857.db2.gz LZNDBCTULSZEFO-UHFFFAOYSA-N 0 0 392.408 3.221 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCO[C@H](Cc4ccccc4)C3)o2)cc1 ZINC000181544243 1430317950 /nfs/dbraw/zinc/31/79/50/1430317950.db2.gz SHCAMWGHGVEUJP-GOSISDBHSA-N 0 0 380.404 3.088 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCO[C@@H](Cc4ccccc4)C3)o2)cc1 ZINC000181544261 1430317976 /nfs/dbraw/zinc/31/79/76/1430317976.db2.gz SHCAMWGHGVEUJP-SFHVURJKSA-N 0 0 380.404 3.088 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCO[C@@H](Cc2ccccc2)C1 ZINC000181559312 1430320494 /nfs/dbraw/zinc/32/04/94/1430320494.db2.gz OBDLHTNIBSINPM-IBGZPJMESA-N 0 0 383.448 3.175 20 5 GGBDRN CN1C(=O)CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)ccc21 ZINC000181573676 1430322140 /nfs/dbraw/zinc/32/21/40/1430322140.db2.gz TULRURZNVSQEAO-UHFFFAOYSA-N 0 0 391.330 3.358 20 5 GGBDRN CC(C)OCCCCNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000181575366 1430322261 /nfs/dbraw/zinc/32/22/61/1430322261.db2.gz GGLDFIHXFJEXBP-UHFFFAOYSA-N 0 0 399.513 3.387 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000181591066 1430324386 /nfs/dbraw/zinc/32/43/86/1430324386.db2.gz YPZSDWAXONZXDH-ZBFHGGJFSA-N 0 0 396.852 3.365 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c1 ZINC000181591690 1430324837 /nfs/dbraw/zinc/32/48/37/1430324837.db2.gz JFHWQUYXCSGEAX-SJORKVTESA-N 0 0 396.852 3.198 20 5 GGBDRN O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1csc([N+](=O)[O-])c1 ZINC000181612330 1430327757 /nfs/dbraw/zinc/32/77/57/1430327757.db2.gz RWKJXEIEGBFGAF-UHFFFAOYSA-N 0 0 376.369 3.208 20 5 GGBDRN CN1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](c2ccccc2)C1 ZINC000181627656 1430330239 /nfs/dbraw/zinc/33/02/39/1430330239.db2.gz GJHVNALGMIVUOM-SFHVURJKSA-N 0 0 379.420 3.134 20 5 GGBDRN O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1cc(F)ccc1[N+](=O)[O-] ZINC000181634644 1430332075 /nfs/dbraw/zinc/33/20/75/1430332075.db2.gz QKGJHYPSQWNCNN-UHFFFAOYSA-N 0 0 388.330 3.286 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181640454 1430332934 /nfs/dbraw/zinc/33/29/34/1430332934.db2.gz HCUUYPLXMBJDNV-LLVKDONJSA-N 0 0 382.376 3.184 20 5 GGBDRN CN(CCN(C)c1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181652384 1430335461 /nfs/dbraw/zinc/33/54/61/1430335461.db2.gz UGKDIAJTUKSBEO-UHFFFAOYSA-N 0 0 379.363 3.405 20 5 GGBDRN Cn1cc(C(=O)Nc2cccc(OCCOc3ccc([N+](=O)[O-])cc3)c2)cn1 ZINC000181660031 1430336981 /nfs/dbraw/zinc/33/69/81/1430336981.db2.gz SZJHISKOLFTVPJ-UHFFFAOYSA-N 0 0 382.376 3.038 20 5 GGBDRN O=C(NC[C@H]1CCOc2ccccc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181672557 1430339179 /nfs/dbraw/zinc/33/91/79/1430339179.db2.gz COXIFPBUDMIAKA-LLVKDONJSA-N 0 0 378.331 3.492 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)cn21 ZINC000181719119 1430346697 /nfs/dbraw/zinc/34/66/97/1430346697.db2.gz CCXPCBIQRIGUHD-UHFFFAOYSA-N 0 0 376.319 3.082 20 5 GGBDRN CC[C@@H](CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)Oc1ccccc1Cl ZINC000181726262 1430348068 /nfs/dbraw/zinc/34/80/68/1430348068.db2.gz ZAXQUNDAHRCBTH-LBPRGKRZSA-N 0 0 399.856 3.165 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000181727461 1430348570 /nfs/dbraw/zinc/34/85/70/1430348570.db2.gz XZXUXSYBCJGSCV-UHFFFAOYSA-N 0 0 390.321 3.470 20 5 GGBDRN Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000181737066 1430350259 /nfs/dbraw/zinc/35/02/59/1430350259.db2.gz MMBBMAVOKHUBJH-UHFFFAOYSA-N 0 0 392.481 3.206 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)cccc1[N+](=O)[O-] ZINC000181760934 1430354254 /nfs/dbraw/zinc/35/42/54/1430354254.db2.gz COHSPNIUCOUOTC-OAHLLOKOSA-N 0 0 397.431 3.000 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1 ZINC000181809378 1430364733 /nfs/dbraw/zinc/36/47/33/1430364733.db2.gz OLTCEJJBRNSPLR-UHFFFAOYSA-N 0 0 379.367 3.007 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2cn(C)nc2-c2ccccc2)c1[N+](=O)[O-] ZINC000181810360 1430365058 /nfs/dbraw/zinc/36/50/58/1430365058.db2.gz GUVNDYVDTVPDLJ-UHFFFAOYSA-N 0 0 381.392 3.179 20 5 GGBDRN Cc1nn(CC(=O)N(CCc2ccccc2)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000181813019 1430365787 /nfs/dbraw/zinc/36/57/87/1430365787.db2.gz FBXJOBSWWRBPGM-UHFFFAOYSA-N 0 0 378.432 3.371 20 5 GGBDRN Cc1c(CC(=O)N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000181826178 1430368445 /nfs/dbraw/zinc/36/84/45/1430368445.db2.gz LPFPNEMFSPJKMM-APWZRJJASA-N 0 0 376.359 3.370 20 5 GGBDRN CCCCc1nnc(NC(=O)CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000181834262 1430369640 /nfs/dbraw/zinc/36/96/40/1430369640.db2.gz SXPFFWOYIBHONP-LBPRGKRZSA-N 0 0 377.470 3.387 20 5 GGBDRN CC(C)OC(=O)C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000181839713 1430370619 /nfs/dbraw/zinc/37/06/19/1430370619.db2.gz XGNVELKQQSBMSZ-KRWDZBQOSA-N 0 0 385.420 3.206 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000181839735 1430370689 /nfs/dbraw/zinc/37/06/89/1430370689.db2.gz XGNVELKQQSBMSZ-QGZVFWFLSA-N 0 0 385.420 3.206 20 5 GGBDRN CC1(C)C[C@H](NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C(C)(C)O1 ZINC000181860762 1430373467 /nfs/dbraw/zinc/37/34/67/1430373467.db2.gz LAHKKKKMACAHSX-KRWDZBQOSA-N 0 0 391.468 3.494 20 5 GGBDRN CC[C@H](C)Oc1cc(C(=O)Nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)ccn1 ZINC000181888050 1430378018 /nfs/dbraw/zinc/37/80/18/1430378018.db2.gz MRDWOPNFJKPWPY-NSHDSACASA-N 0 0 382.380 3.205 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCSC[C@H]2c2ccccc2)cc1 ZINC000181888459 1430378388 /nfs/dbraw/zinc/37/83/88/1430378388.db2.gz VEMRMMVBOOCLDJ-SFHVURJKSA-N 0 0 392.502 3.159 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN(Cc2ccc(F)cc2)CC2CC2)cc1 ZINC000181888539 1430378473 /nfs/dbraw/zinc/37/84/73/1430378473.db2.gz AWSOUTAMGCHWLQ-UHFFFAOYSA-N 0 0 392.452 3.420 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181897777 1430379869 /nfs/dbraw/zinc/37/98/69/1430379869.db2.gz ZNNZSUUBCIEURQ-ZBFHGGJFSA-N 0 0 392.452 3.386 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181897817 1430380014 /nfs/dbraw/zinc/38/00/14/1430380014.db2.gz ZNNZSUUBCIEURQ-GDBMZVCRSA-N 0 0 392.452 3.386 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1[N+](=O)[O-] ZINC000181900459 1430380244 /nfs/dbraw/zinc/38/02/44/1430380244.db2.gz WSKQBVRWCTZCOC-CYBMUJFWSA-N 0 0 393.403 3.109 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000181908480 1430381539 /nfs/dbraw/zinc/38/15/39/1430381539.db2.gz RJRWZMHFQMAPOZ-CYBMUJFWSA-N 0 0 397.522 3.389 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000181908496 1430381728 /nfs/dbraw/zinc/38/17/28/1430381728.db2.gz RJRWZMHFQMAPOZ-ZDUSSCGKSA-N 0 0 397.522 3.389 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])CCO1 ZINC000181909395 1430381756 /nfs/dbraw/zinc/38/17/56/1430381756.db2.gz OPSWZJGHSCQLLZ-MAUKXSAKSA-N 0 0 378.473 3.290 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])CCO1 ZINC000181909361 1430381849 /nfs/dbraw/zinc/38/18/49/1430381849.db2.gz OPSWZJGHSCQLLZ-CRAIPNDOSA-N 0 0 378.473 3.290 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181913179 1430382445 /nfs/dbraw/zinc/38/24/45/1430382445.db2.gz OGIJAUNGVUGVJO-KRWDZBQOSA-N 0 0 376.478 3.322 20 5 GGBDRN Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1[O-] ZINC000181948173 1430387369 /nfs/dbraw/zinc/38/73/69/1430387369.db2.gz PAXHEHMEKYLLPC-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN CC(C)OCCCCNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000181952603 1430387559 /nfs/dbraw/zinc/38/75/59/1430387559.db2.gz PCANAZXQZXIRMV-UHFFFAOYSA-N 0 0 379.457 3.353 20 5 GGBDRN CC(C)(C)C(=O)Cn1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)nn1 ZINC000181953744 1430388004 /nfs/dbraw/zinc/38/80/04/1430388004.db2.gz FLBGDCPSYUQQJI-UHFFFAOYSA-N 0 0 399.329 3.073 20 5 GGBDRN C[S@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000181967942 1430389889 /nfs/dbraw/zinc/38/98/89/1430389889.db2.gz GBZCFUQHPIFART-SANMLTNESA-N 0 0 384.360 3.327 20 5 GGBDRN CN1CCc2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc21 ZINC000181977474 1430391294 /nfs/dbraw/zinc/39/12/94/1430391294.db2.gz IZGKAKSTWPBGEN-UHFFFAOYSA-N 0 0 380.448 3.442 20 5 GGBDRN CN(CC(=O)Nc1ccccc1)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000181984743 1430392138 /nfs/dbraw/zinc/39/21/38/1430392138.db2.gz DGUTZUDEEQSDPO-UHFFFAOYSA-N 0 0 393.852 3.437 20 5 GGBDRN COC(=O)c1ccc(Cl)c(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000182006525 1430395110 /nfs/dbraw/zinc/39/51/10/1430395110.db2.gz YNILKUQNZGAHHS-CQSZACIVSA-N 0 0 390.827 3.116 20 5 GGBDRN Cc1cc2cc(NC(=O)c3cccc([N+](=O)[O-])c3N3CCOCC3)ccc2[nH]1 ZINC000182014611 1430396674 /nfs/dbraw/zinc/39/66/74/1430396674.db2.gz BKRSTRAAIDLQSK-UHFFFAOYSA-N 0 0 380.404 3.473 20 5 GGBDRN CCc1nc2cc(NC(=O)c3cccc([N+](=O)[O-])c3N3CCOCC3)ccc2o1 ZINC000182018667 1430397389 /nfs/dbraw/zinc/39/73/89/1430397389.db2.gz XJVNJXCMDQTMHH-UHFFFAOYSA-N 0 0 396.403 3.387 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCN(Cc3cn4ccccc4n3)CC2)c(Cl)c1 ZINC000182026993 1430398736 /nfs/dbraw/zinc/39/87/36/1430398736.db2.gz IKKHQYIITGSWOY-UHFFFAOYSA-N 0 0 385.855 3.214 20 5 GGBDRN C[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@@H+]1Cc1ccccc1 ZINC000182036940 1430399734 /nfs/dbraw/zinc/39/97/34/1430399734.db2.gz XWMLSRFHWPMBIE-RDJZCZTQSA-N 0 0 383.448 3.426 20 5 GGBDRN C[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@@H+]1Cc1ccccc1 ZINC000182036907 1430399822 /nfs/dbraw/zinc/39/98/22/1430399822.db2.gz XWMLSRFHWPMBIE-DOTOQJQBSA-N 0 0 383.448 3.426 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCN(Cc4ccncc4)CC3)cs2)c1 ZINC000182042108 1430400925 /nfs/dbraw/zinc/40/09/25/1430400925.db2.gz PXXWOUUEQKKTFJ-UHFFFAOYSA-N 0 0 395.488 3.431 20 5 GGBDRN O=C(NCCCNc1cccc(F)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000182057532 1430403295 /nfs/dbraw/zinc/40/32/95/1430403295.db2.gz VMTMSYBIQHENKH-UHFFFAOYSA-N 0 0 383.383 3.152 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1ccco1)Cc1cccnc1 ZINC000182057935 1430403402 /nfs/dbraw/zinc/40/34/02/1430403402.db2.gz DSJGLQRMTHUMOZ-UHFFFAOYSA-N 0 0 396.403 3.232 20 5 GGBDRN COC(=O)C1(CNC(=O)c2cc3ccccc3c3cccnc23)CCOCC1 ZINC000182060835 1430404000 /nfs/dbraw/zinc/40/40/00/1430404000.db2.gz REFQZJAUJZVGHG-UHFFFAOYSA-N 0 0 378.428 3.088 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H](c1nccs1)c1ccccc1 ZINC000182082776 1430408300 /nfs/dbraw/zinc/40/83/00/1430408300.db2.gz UENJCEXVVPKNIS-MAUKXSAKSA-N 0 0 385.445 3.170 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H](c1nccs1)c1ccccc1 ZINC000182082790 1430408318 /nfs/dbraw/zinc/40/83/18/1430408318.db2.gz UENJCEXVVPKNIS-QAPCUYQASA-N 0 0 385.445 3.170 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H](c1nccs1)c1ccccc1 ZINC000182082808 1430408383 /nfs/dbraw/zinc/40/83/83/1430408383.db2.gz UENJCEXVVPKNIS-CRAIPNDOSA-N 0 0 385.445 3.170 20 5 GGBDRN Cc1cc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)c(C)o1 ZINC000182084949 1430408760 /nfs/dbraw/zinc/40/87/60/1430408760.db2.gz KHUQBTOBIQZGCB-UHFFFAOYSA-N 0 0 377.828 3.416 20 5 GGBDRN C[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ncc(-c2ccccc2)o1 ZINC000182091792 1430409969 /nfs/dbraw/zinc/40/99/69/1430409969.db2.gz OHVGQGTXAMHRGE-NSHDSACASA-N 0 0 381.344 3.470 20 5 GGBDRN C[C@@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ncc(-c2ccccc2)o1 ZINC000182091816 1430410098 /nfs/dbraw/zinc/41/00/98/1430410098.db2.gz OHVGQGTXAMHRGE-LLVKDONJSA-N 0 0 381.344 3.470 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)ccc1C(=O)N(C)C ZINC000182109670 1430413681 /nfs/dbraw/zinc/41/36/81/1430413681.db2.gz UVMGHSKSWJDLCZ-UHFFFAOYSA-N 0 0 393.346 3.459 20 5 GGBDRN O=C(c1c(F)cccc1F)N1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182121894 1430415787 /nfs/dbraw/zinc/41/57/87/1430415787.db2.gz PPSRJVYEZOGYKI-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c(=O)n(-c2ccccc2)n1C ZINC000182150996 1430420887 /nfs/dbraw/zinc/42/08/87/1430420887.db2.gz WEEZPDIQYQVVCD-LBPRGKRZSA-N 0 0 398.394 3.274 20 5 GGBDRN COc1ccccc1N1CCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000182156167 1430421476 /nfs/dbraw/zinc/42/14/76/1430421476.db2.gz KFKNJHWWEPWPHX-CQSZACIVSA-N 0 0 387.411 3.195 20 5 GGBDRN COc1ccc(OC)c(CN(CCO)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000182163561 1430422825 /nfs/dbraw/zinc/42/28/25/1430422825.db2.gz ADYJHSVTEHYOEE-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN COc1ccc(CN(CCO)Cc2ccc([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000182165755 1430423306 /nfs/dbraw/zinc/42/33/06/1430423306.db2.gz SHJSAHHEWHHNKN-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000182168767 1430423590 /nfs/dbraw/zinc/42/35/90/1430423590.db2.gz ZTTALZHRSMPBOS-INIZCTEOSA-N 0 0 395.506 3.143 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)Cc1ccccc1C(F)(F)F ZINC000182177127 1430424833 /nfs/dbraw/zinc/42/48/33/1430424833.db2.gz UBRWSFOIONZBSV-NSHDSACASA-N 0 0 384.358 3.256 20 5 GGBDRN C[C@H](c1ccc(F)c(F)c1)N(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182196685 1430427979 /nfs/dbraw/zinc/42/79/79/1430427979.db2.gz RXQNCMWSZUAJRN-GFCCVEGCSA-N 0 0 384.404 3.340 20 5 GGBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182196669 1430428100 /nfs/dbraw/zinc/42/81/00/1430428100.db2.gz RXQNCMWSZUAJRN-LBPRGKRZSA-N 0 0 384.404 3.340 20 5 GGBDRN C[C@@H](c1cc(F)ccc1F)N(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182215435 1430431112 /nfs/dbraw/zinc/43/11/12/1430431112.db2.gz NKSABRFLPHZBQK-LBPRGKRZSA-N 0 0 384.404 3.340 20 5 GGBDRN Cc1ccc2[nH]c(CNC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)nc2c1 ZINC000182259287 1430438552 /nfs/dbraw/zinc/43/85/52/1430438552.db2.gz XKNNIALFYHRVND-UHFFFAOYSA-N 0 0 376.319 3.311 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCN(CC2CC2)c2ccccc21 ZINC000182260193 1430438668 /nfs/dbraw/zinc/43/86/68/1430438668.db2.gz LLMHQTVKCLJNFQ-UHFFFAOYSA-N 0 0 381.388 3.200 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)CC2 ZINC000182268467 1430439977 /nfs/dbraw/zinc/43/99/77/1430439977.db2.gz VNSLMCDHZZZEDA-LBPRGKRZSA-N 0 0 388.395 3.440 20 5 GGBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000182271594 1430440797 /nfs/dbraw/zinc/44/07/97/1430440797.db2.gz CJSZUJPLKJKQKE-GFCCVEGCSA-N 0 0 398.394 3.123 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)nc1C ZINC000182274292 1430441239 /nfs/dbraw/zinc/44/12/39/1430441239.db2.gz TUJZBIVOECCKIQ-MRVPVSSYSA-N 0 0 381.385 3.418 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OC[C@H](O)COc1ccccc1C(F)(F)F ZINC000182279983 1430441860 /nfs/dbraw/zinc/44/18/60/1430441860.db2.gz YRFOPAYEDZNYLE-GFCCVEGCSA-N 0 0 387.310 3.441 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)COc1ccc(-c2noc(C3CC3)n2)cc1 ZINC000182291180 1430443680 /nfs/dbraw/zinc/44/36/80/1430443680.db2.gz IIDBLTGBIVXMMR-OAHLLOKOSA-N 0 0 397.387 3.341 20 5 GGBDRN Cn1cc(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)n1 ZINC000182296168 1430444422 /nfs/dbraw/zinc/44/44/22/1430444422.db2.gz HUROMXMYQGXTRK-UHFFFAOYSA-N 0 0 382.445 3.404 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCC3(CO)CCC3)cc2[N+](=O)[O-])n1 ZINC000182303105 1430445508 /nfs/dbraw/zinc/44/55/08/1430445508.db2.gz FOLSRIVIQKUUNT-UHFFFAOYSA-N 0 0 393.490 3.403 20 5 GGBDRN O=[N+]([O-])c1ccccc1-c1cnn(C[C@H](O)COc2cccc3[nH]ccc32)c1 ZINC000182310292 1430446453 /nfs/dbraw/zinc/44/64/53/1430446453.db2.gz ILTHFBBEPFBQNW-HNNXBMFYSA-N 0 0 378.388 3.380 20 5 GGBDRN COc1ccccc1COC[C@@H](O)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000182310532 1430446475 /nfs/dbraw/zinc/44/64/75/1430446475.db2.gz QXIYODXZBAZMLI-KRWDZBQOSA-N 0 0 383.404 3.045 20 5 GGBDRN COc1ccccc1COC[C@H](O)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000182310515 1430446544 /nfs/dbraw/zinc/44/65/44/1430446544.db2.gz QXIYODXZBAZMLI-QGZVFWFLSA-N 0 0 383.404 3.045 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182316256 1430447370 /nfs/dbraw/zinc/44/73/70/1430447370.db2.gz JZPWHRUSVTVBCW-NENXZPQJSA-N 0 0 390.408 3.006 20 5 GGBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C(=O)c2cccs2)CC1 ZINC000182330975 1430449672 /nfs/dbraw/zinc/44/96/72/1430449672.db2.gz DXYWTVYNZPDCIN-BUHFOSPRSA-N 0 0 385.445 3.044 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cc(C)n(-c2ccc(C)cc2)n1 ZINC000182332937 1430450021 /nfs/dbraw/zinc/45/00/21/1430450021.db2.gz UOGYGFLVOZFTJH-UHFFFAOYSA-N 0 0 395.419 3.457 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NCCCCCCO)cc1[N+](=O)[O-])c1ccccn1 ZINC000182334997 1430450227 /nfs/dbraw/zinc/45/02/27/1430450227.db2.gz APPLPCQUKYCNII-HNNXBMFYSA-N 0 0 386.452 3.445 20 5 GGBDRN Cn1nc(C2CCCC2)cc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000182340534 1430451141 /nfs/dbraw/zinc/45/11/41/1430451141.db2.gz GAIWOSTWRKQVCI-UHFFFAOYSA-N 0 0 380.408 3.424 20 5 GGBDRN Cn1nc(C2CCCC2)cc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182364120 1430453665 /nfs/dbraw/zinc/45/36/65/1430453665.db2.gz UQCJREQECGIEPK-UHFFFAOYSA-N 0 0 380.408 3.424 20 5 GGBDRN CN(CCOCc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182375708 1430455110 /nfs/dbraw/zinc/45/51/10/1430455110.db2.gz ISDQEXJBCKPFLQ-UHFFFAOYSA-N 0 0 380.347 3.485 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1 ZINC000182395498 1430459056 /nfs/dbraw/zinc/45/90/56/1430459056.db2.gz GAYKXOBILWEAJI-JSGCOSHPSA-N 0 0 394.374 3.481 20 5 GGBDRN C[C@@H](O)C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1 ZINC000182395522 1430459215 /nfs/dbraw/zinc/45/92/15/1430459215.db2.gz GAYKXOBILWEAJI-OCCSQVGLSA-N 0 0 394.374 3.481 20 5 GGBDRN COc1nn(C)c2nc(C)c(CCC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)c(C)c12 ZINC000182405226 1430461446 /nfs/dbraw/zinc/46/14/46/1430461446.db2.gz SIEQLIJZJIUFFW-UHFFFAOYSA-N 0 0 397.435 3.382 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000182408558 1430462021 /nfs/dbraw/zinc/46/20/21/1430462021.db2.gz BLZNWGQMAPOASX-SFHVURJKSA-N 0 0 380.404 3.070 20 5 GGBDRN O=C(NCCOc1ncccc1Cl)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182411849 1430463157 /nfs/dbraw/zinc/46/31/57/1430463157.db2.gz CMZBQLKKLYQZMS-UHFFFAOYSA-N 0 0 387.726 3.053 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182416588 1430464023 /nfs/dbraw/zinc/46/40/23/1430464023.db2.gz PZEVCLXMATVMIM-CYBMUJFWSA-N 0 0 397.357 3.357 20 5 GGBDRN CC(=O)N[C@H](CC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1c(F)cccc1F ZINC000182424267 1430465360 /nfs/dbraw/zinc/46/53/60/1430465360.db2.gz BUTIPSOSDOUFFP-OAHLLOKOSA-N 0 0 377.347 3.387 20 5 GGBDRN Cc1cc(NC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)ccc1[N+](=O)[O-] ZINC000182432836 1430467150 /nfs/dbraw/zinc/46/71/50/1430467150.db2.gz ICIXRIHMSXJKRZ-UHFFFAOYSA-N 0 0 391.449 3.184 20 5 GGBDRN Cc1cc(NC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)ccc1[N+](=O)[O-] ZINC000182435032 1430467408 /nfs/dbraw/zinc/46/74/08/1430467408.db2.gz RSISYWDPFLBIDM-UHFFFAOYSA-N 0 0 388.445 3.194 20 5 GGBDRN Cc1cc(NC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)ccc1[N+](=O)[O-] ZINC000182438922 1430468023 /nfs/dbraw/zinc/46/80/23/1430468023.db2.gz BZGHOCXLLGDXSK-UHFFFAOYSA-N 0 0 382.351 3.149 20 5 GGBDRN COc1ccc([C@@H]2[C@@H](C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CCC(=O)N2C)cc1 ZINC000182449087 1430469410 /nfs/dbraw/zinc/46/94/10/1430469410.db2.gz SQZQVXLZABQBBH-FXAWDEMLSA-N 0 0 397.431 3.460 20 5 GGBDRN COc1ccc([C@H]2[C@H](C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CCC(=O)N2C)cc1 ZINC000182449106 1430469516 /nfs/dbraw/zinc/46/95/16/1430469516.db2.gz SQZQVXLZABQBBH-XLIONFOSSA-N 0 0 397.431 3.460 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182450351 1430469861 /nfs/dbraw/zinc/46/98/61/1430469861.db2.gz UCONKXOZNJVRMK-KBXCAEBGSA-N 0 0 376.796 3.273 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCCOc2cc(Cl)ccc21 ZINC000182453099 1430470194 /nfs/dbraw/zinc/47/01/94/1430470194.db2.gz RFAGTJIJWVDALH-CQSZACIVSA-N 0 0 378.816 3.173 20 5 GGBDRN COc1cc(CNc2cccc3c2C(=O)NC3)c([N+](=O)[O-])cc1OCC(F)F ZINC000182459993 1430471268 /nfs/dbraw/zinc/47/12/68/1430471268.db2.gz ATRTWKBMSRHYBX-UHFFFAOYSA-N 0 0 393.346 3.103 20 5 GGBDRN CC[C@H](N[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000182463196 1430471802 /nfs/dbraw/zinc/47/18/02/1430471802.db2.gz WMXYNZFYQJYNKX-RISCZKNCSA-N 0 0 376.413 3.276 20 5 GGBDRN C[C@H](C(=O)NCc1ccccc1Cn1cccn1)c1ccc([N+](=O)[O-])cc1F ZINC000182463420 1430471909 /nfs/dbraw/zinc/47/19/09/1430471909.db2.gz NQDWULBBILHXGK-AWEZNQCLSA-N 0 0 382.395 3.399 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182466854 1430472493 /nfs/dbraw/zinc/47/24/93/1430472493.db2.gz CMGYPFUVPYLAFF-CQSZACIVSA-N 0 0 397.357 3.357 20 5 GGBDRN Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000182472701 1430473343 /nfs/dbraw/zinc/47/33/43/1430473343.db2.gz DLSCYNWLCCRBDR-LBPRGKRZSA-N 0 0 380.470 3.104 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(OCC(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000182472752 1430473679 /nfs/dbraw/zinc/47/36/79/1430473679.db2.gz STEWKXOKSMQATL-NSHDSACASA-N 0 0 386.376 3.278 20 5 GGBDRN Cn1ccnc1C[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182474757 1430473781 /nfs/dbraw/zinc/47/37/81/1430473781.db2.gz GNJHMTLMMCNKOF-LBPRGKRZSA-N 0 0 394.378 3.025 20 5 GGBDRN CCn1c2ccc(C)cc2nc1NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 ZINC000182477921 1430474429 /nfs/dbraw/zinc/47/44/29/1430474429.db2.gz WCCMDJBJOHZOII-UHFFFAOYSA-N 0 0 382.376 3.312 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccnn1C[C@@H]1CCOC1 ZINC000182486414 1430475896 /nfs/dbraw/zinc/47/58/96/1430475896.db2.gz QIIGNPDEAGXDGX-NSHDSACASA-N 0 0 396.856 3.212 20 5 GGBDRN CCn1c2ccc(C)cc2nc1NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000182492192 1430476850 /nfs/dbraw/zinc/47/68/50/1430476850.db2.gz XYMSLOPHVVTRCO-ZDUSSCGKSA-N 0 0 395.419 3.030 20 5 GGBDRN CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@H](c2ccccc2)C1 ZINC000182495572 1430477612 /nfs/dbraw/zinc/47/76/12/1430477612.db2.gz MONIZFKFFJCFHC-INIZCTEOSA-N 0 0 391.374 3.325 20 5 GGBDRN Cn1ccnc1-c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000182498434 1430478304 /nfs/dbraw/zinc/47/83/04/1430478304.db2.gz IYPOSVYZAOTNEM-UHFFFAOYSA-N 0 0 395.347 3.306 20 5 GGBDRN CCCNC(=O)[C@H]1CCCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000182502499 1430479319 /nfs/dbraw/zinc/47/93/19/1430479319.db2.gz NYCNUSKULGVSJK-LBPRGKRZSA-N 0 0 399.900 3.105 20 5 GGBDRN CC[C@@H](c1ccc(F)cc1)S(=O)(=O)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182507076 1430479890 /nfs/dbraw/zinc/47/98/90/1430479890.db2.gz WJFIZIZCUWEMFG-YJBOKZPZSA-N 0 0 397.424 3.040 20 5 GGBDRN C[C@H](c1cccc(Cl)c1)S(=O)(=O)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182509132 1430480348 /nfs/dbraw/zinc/48/03/48/1430480348.db2.gz WAKXBUQHDLIJBW-IUODEOHRSA-N 0 0 399.852 3.164 20 5 GGBDRN Cc1cc(C(=O)NCCNc2ccccc2[N+](=O)[O-])nn1-c1ccc(F)cc1 ZINC000182521865 1430483178 /nfs/dbraw/zinc/48/31/78/1430483178.db2.gz SHQMJIMDFCEZRN-UHFFFAOYSA-N 0 0 383.383 3.070 20 5 GGBDRN CCC(CC)n1nc(C)cc1C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182536019 1430485827 /nfs/dbraw/zinc/48/58/27/1430485827.db2.gz HEUKFIHFFSKXQR-UHFFFAOYSA-N 0 0 383.412 3.498 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182544741 1430487683 /nfs/dbraw/zinc/48/76/83/1430487683.db2.gz SHSKAPNZTHARAN-YJBOKZPZSA-N 0 0 375.812 3.307 20 5 GGBDRN COc1cc(CN(CCO)c2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182547443 1430488360 /nfs/dbraw/zinc/48/83/60/1430488360.db2.gz WMELBRVNHWBKAB-UHFFFAOYSA-N 0 0 382.363 3.246 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000182550984 1430489723 /nfs/dbraw/zinc/48/97/23/1430489723.db2.gz MHRBEZBPUYLIIN-NVXWUHKLSA-N 0 0 386.795 3.385 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cc(F)cc1[N+](=O)[O-] ZINC000182552643 1430490054 /nfs/dbraw/zinc/49/00/54/1430490054.db2.gz SSOFZUXBBRFZCE-BBRMVZONSA-N 0 0 379.775 3.230 20 5 GGBDRN COC(=O)CN(CCc1ccccc1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000182551858 1430490071 /nfs/dbraw/zinc/49/00/71/1430490071.db2.gz DZAXTVSBOXTYEQ-UHFFFAOYSA-N 0 0 376.796 3.106 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc(F)cc1[N+](=O)[O-] ZINC000182552579 1430490276 /nfs/dbraw/zinc/49/02/76/1430490276.db2.gz SSOFZUXBBRFZCE-CZUORRHYSA-N 0 0 379.775 3.230 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H](CO)c1ccccc1 ZINC000182567639 1430493941 /nfs/dbraw/zinc/49/39/41/1430493941.db2.gz FUCTVPNRIIJOJU-HNNXBMFYSA-N 0 0 397.353 3.265 20 5 GGBDRN Cc1cnn(-c2ccc(C)cc2NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c1 ZINC000182571754 1430495200 /nfs/dbraw/zinc/49/52/00/1430495200.db2.gz JKNNFRBJQXRWAU-UHFFFAOYSA-N 0 0 380.360 3.378 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000182575601 1430495956 /nfs/dbraw/zinc/49/59/56/1430495956.db2.gz OHSFBYODDMKYFJ-NSHDSACASA-N 0 0 398.385 3.433 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000182588668 1430498055 /nfs/dbraw/zinc/49/80/55/1430498055.db2.gz JLNFJRUUOBUJMM-UHFFFAOYSA-N 0 0 379.319 3.117 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cc1 ZINC000182599350 1430500058 /nfs/dbraw/zinc/50/00/58/1430500058.db2.gz OQEBEIWEGJVKNC-UHFFFAOYSA-N 0 0 390.461 3.244 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NC[C@@H](C)c2nc(C)cs2)cc([N+](=O)[O-])c1 ZINC000182599469 1430500079 /nfs/dbraw/zinc/50/00/79/1430500079.db2.gz IQUNWXBACOEGCX-SNVBAGLBSA-N 0 0 377.422 3.070 20 5 GGBDRN COc1ccc([C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000182609767 1430501854 /nfs/dbraw/zinc/50/18/54/1430501854.db2.gz BLYMASMZTANKFQ-MRXNPFEDSA-N 0 0 384.310 3.402 20 5 GGBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182632834 1430506349 /nfs/dbraw/zinc/50/63/49/1430506349.db2.gz NSOGSEGRXVQMFY-UHFFFAOYSA-N 0 0 393.346 3.459 20 5 GGBDRN COCC(=O)N1CCc2c1cccc2NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000182654516 1430511122 /nfs/dbraw/zinc/51/11/22/1430511122.db2.gz STYSIMADMCJPOG-UHFFFAOYSA-N 0 0 397.431 3.308 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCc2c(cccc2NS(C)(=O)=O)C1 ZINC000182696296 1430519843 /nfs/dbraw/zinc/51/98/43/1430519843.db2.gz AJQNZHYMISQTDP-CQSZACIVSA-N 0 0 389.477 3.394 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC3(CO)CCCC3)cc2[N+](=O)[O-])C1 ZINC000182700388 1430520951 /nfs/dbraw/zinc/52/09/51/1430520951.db2.gz REDDGKYLNJJYEH-HUUCEWRRSA-N 0 0 375.469 3.112 20 5 GGBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000182724076 1430527593 /nfs/dbraw/zinc/52/75/93/1430527593.db2.gz UKCKCQSLVRLYIX-WBVHZDCISA-N 0 0 388.330 3.009 20 5 GGBDRN Cn1nc(C2CCCCC2)cc1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000182728539 1430528080 /nfs/dbraw/zinc/52/80/80/1430528080.db2.gz AVFUYXBAQCEBTC-UHFFFAOYSA-N 0 0 392.481 3.360 20 5 GGBDRN COc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1NS(C)(=O)=O ZINC000182730263 1430528483 /nfs/dbraw/zinc/52/84/83/1430528483.db2.gz YKKMCSFMIQFKKI-GFCCVEGCSA-N 0 0 379.438 3.456 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC000182734005 1430529583 /nfs/dbraw/zinc/52/95/83/1430529583.db2.gz BFLRHBQDNZRVTG-UHFFFAOYSA-N 0 0 396.375 3.393 20 5 GGBDRN C[C@H](C(=O)NCc1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182734985 1430529937 /nfs/dbraw/zinc/52/99/37/1430529937.db2.gz SZICYMNOXCMHML-ZDUSSCGKSA-N 0 0 385.395 3.281 20 5 GGBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000182743672 1430531571 /nfs/dbraw/zinc/53/15/71/1430531571.db2.gz WRWNGUWHNZZLJJ-VIFPVBQESA-N 0 0 396.856 3.480 20 5 GGBDRN CC[C@@](C)(CCO)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000182743168 1430531592 /nfs/dbraw/zinc/53/15/92/1430531592.db2.gz LFAXUHWGAKLLTA-XOBRGWDASA-N 0 0 386.452 3.444 20 5 GGBDRN Cc1cc(NC(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000182764138 1430536170 /nfs/dbraw/zinc/53/61/70/1430536170.db2.gz ZQSOFVBMAXMHID-HLLBOEOZSA-N 0 0 376.457 3.009 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1cn(C)nc1-c1ccccc1 ZINC000182788487 1430540237 /nfs/dbraw/zinc/54/02/37/1430540237.db2.gz JLAFNYWPSXANNQ-UHFFFAOYSA-N 0 0 379.420 3.337 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCO[C@H](Cc2ccccc2)C1 ZINC000182801355 1430542651 /nfs/dbraw/zinc/54/26/51/1430542651.db2.gz LXKDSJXGIRWDKA-OAHLLOKOSA-N 0 0 392.358 3.280 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000182820900 1430546693 /nfs/dbraw/zinc/54/66/93/1430546693.db2.gz LCPZRFFWACIBJD-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000182824305 1430547585 /nfs/dbraw/zinc/54/75/85/1430547585.db2.gz UODWAIIKTCTTSZ-ZDUSSCGKSA-N 0 0 387.411 3.294 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000182825272 1430547753 /nfs/dbraw/zinc/54/77/53/1430547753.db2.gz RHJQTRWSJKUOGO-IFXJQAMLSA-N 0 0 377.404 3.399 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000182825993 1430548209 /nfs/dbraw/zinc/54/82/09/1430548209.db2.gz XSRVSPYBYWJQPV-KDOFPFPSSA-N 0 0 377.404 3.399 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000182825972 1430548264 /nfs/dbraw/zinc/54/82/64/1430548264.db2.gz XSRVSPYBYWJQPV-KBXCAEBGSA-N 0 0 377.404 3.399 20 5 GGBDRN Cn1c2ccc(NC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)cc2nc1C1CC1 ZINC000182833287 1430549850 /nfs/dbraw/zinc/54/98/50/1430549850.db2.gz HSJBUOLSLFBDHV-UHFFFAOYSA-N 0 0 380.360 3.340 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCC[C@H](C3(C)OCCO3)C2)cc1[N+](=O)[O-] ZINC000182835883 1430550222 /nfs/dbraw/zinc/55/02/22/1430550222.db2.gz WOSLNMCOZUOAOX-HOCLYGCPSA-N 0 0 377.441 3.149 20 5 GGBDRN CC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)nc1C ZINC000182842149 1430551918 /nfs/dbraw/zinc/55/19/18/1430551918.db2.gz RDHYHZRMYVFBEJ-UHFFFAOYSA-N 0 0 379.319 3.032 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000182842130 1430551957 /nfs/dbraw/zinc/55/19/57/1430551957.db2.gz BIZHHQQWOBGPHT-SECBINFHSA-N 0 0 379.775 3.489 20 5 GGBDRN O=C(NCc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182856018 1430554443 /nfs/dbraw/zinc/55/44/43/1430554443.db2.gz MKMBUTYFUOKSKM-UHFFFAOYSA-N 0 0 375.812 3.015 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000182868267 1430557157 /nfs/dbraw/zinc/55/71/57/1430557157.db2.gz BFUDYIMDSHGUNH-NSHDSACASA-N 0 0 398.341 3.296 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccccc1C(=O)c1ccc(C)cc1 ZINC000182881850 1430560704 /nfs/dbraw/zinc/56/07/04/1430560704.db2.gz NKRMNXNXNODYJG-UHFFFAOYSA-N 0 0 393.399 3.496 20 5 GGBDRN O=C(Nc1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182880920 1430560735 /nfs/dbraw/zinc/56/07/35/1430560735.db2.gz KTEYRBWVMBEFSG-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN O=C(NCc1ccccc1Cl)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182880733 1430561069 /nfs/dbraw/zinc/56/10/69/1430561069.db2.gz NSXNQQZFUOTTMS-UHFFFAOYSA-N 0 0 375.812 3.015 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182888539 1430562746 /nfs/dbraw/zinc/56/27/46/1430562746.db2.gz FXTSUWAUGHQYFP-CYBMUJFWSA-N 0 0 398.341 3.053 20 5 GGBDRN COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1Cl ZINC000182890259 1430563460 /nfs/dbraw/zinc/56/34/60/1430563460.db2.gz GGEUOGQWZZQXQY-UHFFFAOYSA-N 0 0 391.811 3.346 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000182899057 1430566111 /nfs/dbraw/zinc/56/61/11/1430566111.db2.gz GGBYJPIRNDQKAS-ZDUSSCGKSA-N 0 0 377.803 3.325 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182902374 1430566930 /nfs/dbraw/zinc/56/69/30/1430566930.db2.gz RKJBHIRQSUBESP-AWEZNQCLSA-N 0 0 382.342 3.216 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(CCc3ccccc3C)[nH]n2)c(C)c1[N+](=O)[O-] ZINC000182902491 1430567006 /nfs/dbraw/zinc/56/70/06/1430567006.db2.gz BTRJLNOILCZHHM-UHFFFAOYSA-N 0 0 396.451 3.254 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182901534 1430567059 /nfs/dbraw/zinc/56/70/59/1430567059.db2.gz XZWMCFAWCISWFG-LLVKDONJSA-N 0 0 386.305 3.427 20 5 GGBDRN O=C(Nc1nc2c(s1)CCCC2)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182903597 1430567415 /nfs/dbraw/zinc/56/74/15/1430567415.db2.gz CEPLLAFSYQLRTO-UHFFFAOYSA-N 0 0 388.449 3.019 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)ccc1[N+](=O)[O-] ZINC000182905198 1430567806 /nfs/dbraw/zinc/56/78/06/1430567806.db2.gz IJZVJPWGXXUINO-LBPRGKRZSA-N 0 0 398.341 3.296 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cc(C)n(-c3ccc(C)cc3)n2)cc([N+](=O)[O-])c1 ZINC000182912326 1430569529 /nfs/dbraw/zinc/56/95/29/1430569529.db2.gz XOBYINSVOZMVRX-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cn(-c2cccc(Cl)c2F)nn1 ZINC000182932181 1430574654 /nfs/dbraw/zinc/57/46/54/1430574654.db2.gz CPLTYZOFCJOYOF-UHFFFAOYSA-N 0 0 391.746 3.229 20 5 GGBDRN COc1cccc([C@@H]2[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC(=O)N2C2CC2)c1 ZINC000182932620 1430574928 /nfs/dbraw/zinc/57/49/28/1430574928.db2.gz XKCRTAKDIWAFTD-AZUAARDMSA-N 0 0 395.415 3.294 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccc(OC)cc1 ZINC000182936233 1430575583 /nfs/dbraw/zinc/57/55/83/1430575583.db2.gz GTKCLLRUMCTLDF-GOSISDBHSA-N 0 0 399.447 3.321 20 5 GGBDRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCCC[C@H]1C ZINC000182968225 1430582657 /nfs/dbraw/zinc/58/26/57/1430582657.db2.gz LEXMLAHHIMTWAV-VXGBXAGGSA-N 0 0 399.900 3.246 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000182970615 1430582901 /nfs/dbraw/zinc/58/29/01/1430582901.db2.gz ILGAAIGKVPPLNH-IAQYHMDHSA-N 0 0 388.811 3.191 20 5 GGBDRN Cc1ccc([C@H](C)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000182979645 1430584541 /nfs/dbraw/zinc/58/45/41/1430584541.db2.gz WJJVNFAIRUSQTA-INIZCTEOSA-N 0 0 383.448 3.478 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cn(-c2ccccc2)nc1C ZINC000182983444 1430585271 /nfs/dbraw/zinc/58/52/71/1430585271.db2.gz GPHJEHGHYJRCGQ-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182989392 1430586680 /nfs/dbraw/zinc/58/66/80/1430586680.db2.gz MHHKIIOAXZAIBN-BDJLRTHQSA-N 0 0 388.811 3.191 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182989432 1430586685 /nfs/dbraw/zinc/58/66/85/1430586685.db2.gz MHHKIIOAXZAIBN-BZNIZROVSA-N 0 0 388.811 3.191 20 5 GGBDRN NC(=O)C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000182990698 1430586857 /nfs/dbraw/zinc/58/68/57/1430586857.db2.gz DNISEJAWGLJRFB-CYBMUJFWSA-N 0 0 399.900 3.281 20 5 GGBDRN C[C@@H](C(=O)NCc1ccc(CN2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000183007814 1430591357 /nfs/dbraw/zinc/59/13/57/1430591357.db2.gz VXDIOIXTVZFZRA-CQSZACIVSA-N 0 0 399.422 3.276 20 5 GGBDRN CC(C)(C)C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)C(F)(F)F ZINC000183026890 1430595823 /nfs/dbraw/zinc/59/58/23/1430595823.db2.gz IMLHEXGHAVIACR-GFCCVEGCSA-N 0 0 396.387 3.095 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2cn(C)nc2-c2ccccc2)c1 ZINC000183034790 1430597766 /nfs/dbraw/zinc/59/77/66/1430597766.db2.gz GJJOMWDDYJQLPE-UHFFFAOYSA-N 0 0 394.431 3.389 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cccc(-n3cccc3)c2)ccc1[N+](=O)[O-] ZINC000183047168 1430599588 /nfs/dbraw/zinc/59/95/88/1430599588.db2.gz FYIYHBANLCYZHB-UHFFFAOYSA-N 0 0 378.388 3.062 20 5 GGBDRN CCN(Cc1ccccc1Cl)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183057540 1430601533 /nfs/dbraw/zinc/60/15/33/1430601533.db2.gz CCJOUWLPLAILPO-UHFFFAOYSA-N 0 0 389.839 3.335 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)[C@H](C)c2cc(F)ccc2F)ccc1[N+](=O)[O-] ZINC000183056943 1430601936 /nfs/dbraw/zinc/60/19/36/1430601936.db2.gz QLKUMFDLDLSBJJ-GFCCVEGCSA-N 0 0 391.374 3.131 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1cc(Cl)cc2c1OCC2 ZINC000183082007 1430608639 /nfs/dbraw/zinc/60/86/39/1430608639.db2.gz OAQJITVSFVHKMQ-UHFFFAOYSA-N 0 0 376.796 3.268 20 5 GGBDRN O=C(Nc1c(-c2ccco2)nc2ccccn21)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000183089279 1430609964 /nfs/dbraw/zinc/60/99/64/1430609964.db2.gz UFPWOTBTJXREQT-UHFFFAOYSA-N 0 0 392.327 3.484 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183099680 1430612409 /nfs/dbraw/zinc/61/24/09/1430612409.db2.gz JHUWBYJCLQVHRX-LBPRGKRZSA-N 0 0 395.366 3.176 20 5 GGBDRN CC1(C)C[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C(C)(C)O1 ZINC000183101983 1430612936 /nfs/dbraw/zinc/61/29/36/1430612936.db2.gz WGKRIHSWWIUEFI-KRWDZBQOSA-N 0 0 375.469 3.274 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCCCC[C@@H]2c2ccncc2)ccc1[N+](=O)[O-] ZINC000183117950 1430618787 /nfs/dbraw/zinc/61/87/87/1430618787.db2.gz VLDFZUCHYSUWRC-LJQANCHMSA-N 0 0 396.447 3.172 20 5 GGBDRN Cc1cc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)nn1-c1cccc(F)c1 ZINC000183127663 1430622171 /nfs/dbraw/zinc/62/21/71/1430622171.db2.gz JHNPOCNQNDBNGY-UHFFFAOYSA-N 0 0 384.323 3.209 20 5 GGBDRN CCOc1cccc(NC[C@@H](c2ccc(C)o2)N2CCOCC2)c1[N+](=O)[O-] ZINC000183138764 1430626023 /nfs/dbraw/zinc/62/60/23/1430626023.db2.gz RLCIGEFHKQOBGV-INIZCTEOSA-N 0 0 375.425 3.380 20 5 GGBDRN CCNc1ccc(Cl)cc1NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000183159997 1430633199 /nfs/dbraw/zinc/63/31/99/1430633199.db2.gz UJANUOWABNNVMH-LLVKDONJSA-N 0 0 390.827 3.437 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC[C@H]2CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000183165729 1430635914 /nfs/dbraw/zinc/63/59/14/1430635914.db2.gz KNYRBVGALKHUJK-IBGZPJMESA-N 0 0 395.459 3.257 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CCCc2c1cnn2C ZINC000183175820 1430639465 /nfs/dbraw/zinc/63/94/65/1430639465.db2.gz CGKFYMSSGIEIOR-CYBMUJFWSA-N 0 0 380.351 3.079 20 5 GGBDRN Cc1ccccc1[C@H]1CCCN1C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183179714 1430640708 /nfs/dbraw/zinc/64/07/08/1430640708.db2.gz KNXPATSRSRCGSW-LJQANCHMSA-N 0 0 381.432 3.305 20 5 GGBDRN CCOc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c(C)c1 ZINC000183189351 1430643342 /nfs/dbraw/zinc/64/33/42/1430643342.db2.gz RGGAYRKXAVJLOF-UHFFFAOYSA-N 0 0 385.420 3.391 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCN(c2ccccn2)C1 ZINC000183195489 1430645094 /nfs/dbraw/zinc/64/50/94/1430645094.db2.gz PUJQIMOXQOPOCT-CYBMUJFWSA-N 0 0 392.868 3.130 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1 ZINC000183211689 1430649645 /nfs/dbraw/zinc/64/96/45/1430649645.db2.gz HIXLVVZSMKSXOA-SYNHAJSKSA-N 0 0 383.448 3.286 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000183223684 1430651596 /nfs/dbraw/zinc/65/15/96/1430651596.db2.gz KTUFETJJMAHBQZ-ACJLOTCBSA-N 0 0 387.436 3.150 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1ccccc1 ZINC000183234274 1430655423 /nfs/dbraw/zinc/65/54/23/1430655423.db2.gz QVSOMMFWALWGLB-CQSZACIVSA-N 0 0 392.408 3.160 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000183236619 1430655706 /nfs/dbraw/zinc/65/57/06/1430655706.db2.gz CNNZJEGOOXQIJE-MRXNPFEDSA-N 0 0 388.445 3.329 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183236802 1430655708 /nfs/dbraw/zinc/65/57/08/1430655708.db2.gz NJIWTCANBQVKOW-SFHVURJKSA-N 0 0 388.445 3.162 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CSc1nnc2ccccn21 ZINC000183235611 1430656081 /nfs/dbraw/zinc/65/60/81/1430656081.db2.gz DHZXIAGNJDCGIM-UHFFFAOYSA-N 0 0 385.449 3.167 20 5 GGBDRN CC[C@H](C)Oc1ccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000183237059 1430656581 /nfs/dbraw/zinc/65/65/81/1430656581.db2.gz QSOAMDOWDALHQJ-AWEZNQCLSA-N 0 0 385.420 3.449 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000183239745 1430657143 /nfs/dbraw/zinc/65/71/43/1430657143.db2.gz MZEOPMJILWSOAR-CQSZACIVSA-N 0 0 392.408 3.160 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@H]1CC(=O)c1ccccc1 ZINC000183239704 1430657185 /nfs/dbraw/zinc/65/71/85/1430657185.db2.gz TYZAETMMBKDNJJ-INIZCTEOSA-N 0 0 388.445 3.329 20 5 GGBDRN COCCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)c(F)c1 ZINC000183240792 1430657757 /nfs/dbraw/zinc/65/77/57/1430657757.db2.gz KCTXVQBZGXFSKY-UHFFFAOYSA-N 0 0 386.376 3.105 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1cccs1 ZINC000183241917 1430658172 /nfs/dbraw/zinc/65/81/72/1430658172.db2.gz NIIDZOHYRZGZOX-CYBMUJFWSA-N 0 0 394.474 3.391 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@@H]2CC(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000183245574 1430658420 /nfs/dbraw/zinc/65/84/20/1430658420.db2.gz PKENITDAIADQKI-CYBMUJFWSA-N 0 0 394.474 3.391 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000183245668 1430658616 /nfs/dbraw/zinc/65/86/16/1430658616.db2.gz CQAZWRIHVKQHJM-HNNXBMFYSA-N 0 0 394.474 3.224 20 5 GGBDRN Cn1ccc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N3CCOCC3)cc21 ZINC000183247053 1430659014 /nfs/dbraw/zinc/65/90/14/1430659014.db2.gz YYGDKVQMHBADJB-UHFFFAOYSA-N 0 0 380.404 3.175 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(COC(C)C)cc2)ccc1[N+](=O)[O-] ZINC000183249382 1430659388 /nfs/dbraw/zinc/65/93/88/1430659388.db2.gz AWFHUDTURUNWJU-UHFFFAOYSA-N 0 0 385.420 3.197 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000183252894 1430660456 /nfs/dbraw/zinc/66/04/56/1430660456.db2.gz XHASMHGXIFDURI-RYUDHWBXSA-N 0 0 389.383 3.450 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000183252878 1430660751 /nfs/dbraw/zinc/66/07/51/1430660751.db2.gz XHASMHGXIFDURI-VXGBXAGGSA-N 0 0 389.383 3.450 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1 ZINC000183255807 1430661419 /nfs/dbraw/zinc/66/14/19/1430661419.db2.gz AFGOCKRSIDANIZ-UHFFFAOYSA-N 0 0 392.375 3.332 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1n[nH]c(Cc2cccc(F)c2)n1 ZINC000183255955 1430661593 /nfs/dbraw/zinc/66/15/93/1430661593.db2.gz QSQBBSNAAUVLCD-UHFFFAOYSA-N 0 0 394.366 3.105 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000183280239 1430668525 /nfs/dbraw/zinc/66/85/25/1430668525.db2.gz LMVOUXZMBPSANZ-SNVBAGLBSA-N 0 0 384.318 3.074 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000183300058 1430672896 /nfs/dbraw/zinc/67/28/96/1430672896.db2.gz BCLMGWZYFRVOFJ-MRVPVSSYSA-N 0 0 385.346 3.044 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C2CC2)[C@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000183302435 1430673816 /nfs/dbraw/zinc/67/38/16/1430673816.db2.gz QZODIUFHQTWZRB-FQEVSTJZSA-N 0 0 393.443 3.312 20 5 GGBDRN CC1(C)C[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C(C)(C)O1 ZINC000183305616 1430674200 /nfs/dbraw/zinc/67/42/00/1430674200.db2.gz SDSOCWCBRDCOAG-GFCCVEGCSA-N 0 0 396.387 3.238 20 5 GGBDRN O=C(N[C@@H]1CCCOc2c(F)cccc21)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000183317290 1430677593 /nfs/dbraw/zinc/67/75/93/1430677593.db2.gz RNXAJMPHYROLSG-MRXNPFEDSA-N 0 0 397.362 3.219 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCCCc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000183335256 1430681684 /nfs/dbraw/zinc/68/16/84/1430681684.db2.gz TWNSTZKUTKUBRX-UHFFFAOYSA-N 0 0 389.839 3.035 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1NC(=O)c1ccccc1 ZINC000183346189 1430684048 /nfs/dbraw/zinc/68/40/48/1430684048.db2.gz OEVOIBKWNPJQAK-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN COC(=O)CN(CCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000183351728 1430685199 /nfs/dbraw/zinc/68/51/99/1430685199.db2.gz VXHDDNPZDLBINO-UHFFFAOYSA-N 0 0 376.796 3.106 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCCOc3cc(F)ccc32)cccc1[N+](=O)[O-] ZINC000183356014 1430687424 /nfs/dbraw/zinc/68/74/24/1430687424.db2.gz GXXAUZYXSVVJJN-HNNXBMFYSA-N 0 0 387.367 3.011 20 5 GGBDRN COc1ccccc1C1(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000183363136 1430690100 /nfs/dbraw/zinc/69/01/00/1430690100.db2.gz WAFRCFCZNULGCE-UHFFFAOYSA-N 0 0 397.431 3.088 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CC[C@H](Oc4cccc(F)c4)C3)o2)cc1 ZINC000183366758 1430691252 /nfs/dbraw/zinc/69/12/52/1430691252.db2.gz ILRPQRFPDDLVNF-KRWDZBQOSA-N 0 0 384.367 3.437 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@@H]3CCCC[C@H]3O)cc2[N+](=O)[O-])CC1 ZINC000183378882 1430695180 /nfs/dbraw/zinc/69/51/80/1430695180.db2.gz BIIZVRZPOZOARR-FXAWDEMLSA-N 0 0 389.496 3.454 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@H](Oc4cccc(F)c4)C3)n2)cc1 ZINC000183380105 1430695557 /nfs/dbraw/zinc/69/55/57/1430695557.db2.gz KWMPDITZLPHPCQ-KRWDZBQOSA-N 0 0 384.367 3.437 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@@H](Oc4cccc(F)c4)C3)n2)cc1 ZINC000183380085 1430695602 /nfs/dbraw/zinc/69/56/02/1430695602.db2.gz KWMPDITZLPHPCQ-QGZVFWFLSA-N 0 0 384.367 3.437 20 5 GGBDRN COc1ccc([C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000183382194 1430696229 /nfs/dbraw/zinc/69/62/29/1430696229.db2.gz LTIARJHEOYBCLH-INIZCTEOSA-N 0 0 383.326 3.435 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCCOc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000183383624 1430696713 /nfs/dbraw/zinc/69/67/13/1430696713.db2.gz UYVJDRYIDCXCFG-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2CCCOc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000183383647 1430696735 /nfs/dbraw/zinc/69/67/35/1430696735.db2.gz UYVJDRYIDCXCFG-HNNXBMFYSA-N 0 0 387.367 3.011 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H](C)C(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000183394772 1430700552 /nfs/dbraw/zinc/70/05/52/1430700552.db2.gz VSXCXGYJLJZANK-OAHLLOKOSA-N 0 0 383.448 3.116 20 5 GGBDRN CCn1ncc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N3CCOCC3)cc21 ZINC000183398022 1430701373 /nfs/dbraw/zinc/70/13/73/1430701373.db2.gz MTMHGUHAXPKHSC-UHFFFAOYSA-N 0 0 395.419 3.053 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1CS(C)(=O)=O)c1ccc([N+](=O)[O-])cc1F ZINC000183412764 1430705152 /nfs/dbraw/zinc/70/51/52/1430705152.db2.gz LOQCSJXBJYFPOY-NSHDSACASA-N 0 0 380.397 3.021 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H](c2ccc(F)cc2)C2CCC2)ccc1[N+](=O)[O-] ZINC000183415480 1430706005 /nfs/dbraw/zinc/70/60/05/1430706005.db2.gz VNLZLXHVNLAHTE-HXUWFJFHSA-N 0 0 399.422 3.430 20 5 GGBDRN O=C(NCc1ccc(F)c(Cl)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183432672 1430710569 /nfs/dbraw/zinc/71/05/69/1430710569.db2.gz CQSDXKZRFYGRSP-UHFFFAOYSA-N 0 0 393.802 3.154 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2ccc(C(F)(F)F)cc2)cc1 ZINC000183437007 1430711879 /nfs/dbraw/zinc/71/18/79/1430711879.db2.gz WBLDTNFNWQCEMI-UHFFFAOYSA-N 0 0 388.367 3.276 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000183441344 1430712857 /nfs/dbraw/zinc/71/28/57/1430712857.db2.gz JXZCGEHVPBHEFW-LJQANCHMSA-N 0 0 390.461 3.217 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CCO1 ZINC000183443156 1430713405 /nfs/dbraw/zinc/71/34/05/1430713405.db2.gz PQIZENAPMJBSHD-HNAYVOBHSA-N 0 0 386.452 3.494 20 5 GGBDRN CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000183460426 1430717124 /nfs/dbraw/zinc/71/71/24/1430717124.db2.gz LTQDXXZIDOOUIN-BBRMVZONSA-N 0 0 375.450 3.341 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183461661 1430717606 /nfs/dbraw/zinc/71/76/06/1430717606.db2.gz PMYRMDXTTZEQFK-GFCCVEGCSA-N 0 0 397.435 3.005 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000183478347 1430722432 /nfs/dbraw/zinc/72/24/32/1430722432.db2.gz ZKTOQSBEOMKKAL-HNAYVOBHSA-N 0 0 386.452 3.494 20 5 GGBDRN COCCn1nc(C)c(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000183480998 1430722835 /nfs/dbraw/zinc/72/28/35/1430722835.db2.gz ZGAILMHIQZLGRQ-UHFFFAOYSA-N 0 0 398.872 3.439 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2CCSc3c(F)cccc32)cc1 ZINC000183491930 1430726485 /nfs/dbraw/zinc/72/64/85/1430726485.db2.gz AKJAEFXIXVBYCS-MRXNPFEDSA-N 0 0 396.465 3.433 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2ccccc2N2CCCCC2)cc1 ZINC000183501211 1430729132 /nfs/dbraw/zinc/72/91/32/1430729132.db2.gz PIQPDOOZMIQDIK-UHFFFAOYSA-N 0 0 389.477 3.205 20 5 GGBDRN O=C(Nc1cc(F)c(F)cc1F)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183506126 1430730490 /nfs/dbraw/zinc/73/04/90/1430730490.db2.gz RUPSKTNFAGEFBE-UHFFFAOYSA-N 0 0 381.310 3.101 20 5 GGBDRN CCCOc1ccc(CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000183510148 1430731577 /nfs/dbraw/zinc/73/15/77/1430731577.db2.gz ZFCRTJGVAKKCJQ-UHFFFAOYSA-N 0 0 378.450 3.046 20 5 GGBDRN C[C@H](c1cc(F)ccc1F)N(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183514858 1430732777 /nfs/dbraw/zinc/73/27/77/1430732777.db2.gz DDWCYKVXJBVQTM-GFCCVEGCSA-N 0 0 384.404 3.438 20 5 GGBDRN C[C@@H](c1cc(F)ccc1F)N(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183514845 1430732811 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WYIBJICOJORBKQ-BZNIZROVSA-N 0 0 390.465 3.436 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](CN1CCOCC1)c1ccccc1C ZINC000183554818 1430741357 /nfs/dbraw/zinc/74/13/57/1430741357.db2.gz MPXCHCOLIFWIOH-FQEVSTJZSA-N 0 0 385.464 3.075 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1NC(=O)Cc1cccs1 ZINC000183564412 1430743073 /nfs/dbraw/zinc/74/30/73/1430743073.db2.gz JTSSSPJHHTULEG-UHFFFAOYSA-N 0 0 397.416 3.067 20 5 GGBDRN COc1ccc(CC[C@@H](C)NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000183568691 1430743735 /nfs/dbraw/zinc/74/37/35/1430743735.db2.gz GLNRFFYFLRTFHW-OAHLLOKOSA-N 0 0 392.477 3.087 20 5 GGBDRN CCCNc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000183573431 1430744455 /nfs/dbraw/zinc/74/44/55/1430744455.db2.gz WXNFAIRZJVPMMH-UHFFFAOYSA-N 0 0 377.422 3.073 20 5 GGBDRN O=C(NCc1cccc(COCC(F)(F)F)c1)Nc1ccncc1[N+](=O)[O-] ZINC000183573818 1430744595 /nfs/dbraw/zinc/74/45/95/1430744595.db2.gz MNAHEBWUFNUGLD-UHFFFAOYSA-N 0 0 384.314 3.390 20 5 GGBDRN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183576753 1430745139 /nfs/dbraw/zinc/74/51/39/1430745139.db2.gz SQYAOHDPGPMDSE-UHFFFAOYSA-N 0 0 380.408 3.173 20 5 GGBDRN COCCN(Cc1ccc(F)cc1Cl)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183581289 1430746742 /nfs/dbraw/zinc/74/67/42/1430746742.db2.gz XTYUQPAEKAWMGW-UHFFFAOYSA-N 0 0 382.779 3.463 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)CCNC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183591602 1430749008 /nfs/dbraw/zinc/74/90/08/1430749008.db2.gz YYBZABBQGQIRNG-UHFFFAOYSA-N 0 0 377.788 3.102 20 5 GGBDRN COc1ccc(N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000183591473 1430749220 /nfs/dbraw/zinc/74/92/20/1430749220.db2.gz OEPYPAVIOQHKPG-UHFFFAOYSA-N 0 0 378.388 3.428 20 5 GGBDRN CC(=O)N[C@@H](CC(C)C)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000183598045 1430750722 /nfs/dbraw/zinc/75/07/22/1430750722.db2.gz WMZIUYWRGXRMQL-AWEZNQCLSA-N 0 0 390.465 3.232 20 5 GGBDRN C[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000183605656 1430752495 /nfs/dbraw/zinc/75/24/95/1430752495.db2.gz WFANGSACULLFOV-LBPRGKRZSA-N 0 0 391.378 3.179 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@H](NC(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000183604401 1430752815 /nfs/dbraw/zinc/75/28/15/1430752815.db2.gz WCVJMWDOLPOMBN-LBPRGKRZSA-N 0 0 391.815 3.052 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)cc1 ZINC000183616319 1430755028 /nfs/dbraw/zinc/75/50/28/1430755028.db2.gz AFOULPVNRFJHEN-UHFFFAOYSA-N 0 0 395.419 3.394 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000183615523 1430755143 /nfs/dbraw/zinc/75/51/43/1430755143.db2.gz IWRVTFIHOSVSFH-YJBOKZPZSA-N 0 0 381.432 3.038 20 5 GGBDRN O=C(CN1CCc2c1cccc2[N+](=O)[O-])N(Cc1ccco1)CC(F)(F)F ZINC000183630396 1430759111 /nfs/dbraw/zinc/75/91/11/1430759111.db2.gz JEGRXPARBDJAQQ-UHFFFAOYSA-N 0 0 383.326 3.141 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183641891 1430761379 /nfs/dbraw/zinc/76/13/79/1430761379.db2.gz GHYFTKDHSCTQRD-GOSISDBHSA-N 0 0 390.461 3.313 20 5 GGBDRN CCCNC(=O)C1(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CCCCC1 ZINC000183643182 1430761827 /nfs/dbraw/zinc/76/18/27/1430761827.db2.gz JUZBAIGHABSCAX-ZDUSSCGKSA-N 0 0 379.432 3.183 20 5 GGBDRN C[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1F ZINC000183644190 1430762270 /nfs/dbraw/zinc/76/22/70/1430762270.db2.gz KURLUGWOZWSGQW-GXTWGEPZSA-N 0 0 385.395 3.039 20 5 GGBDRN CC(C)(C)c1csc(CCNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)n1 ZINC000183649220 1430763498 /nfs/dbraw/zinc/76/34/98/1430763498.db2.gz IPYATCSPIHYDLC-UHFFFAOYSA-N 0 0 397.522 3.053 20 5 GGBDRN CCOC(=O)[C@@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(O)c1 ZINC000183650288 1430763877 /nfs/dbraw/zinc/76/38/77/1430763877.db2.gz CKFCHZCNDXOKOW-SFHVURJKSA-N 0 0 397.387 3.349 20 5 GGBDRN COc1cc(CN[C@H](CO)c2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000183658327 1430765242 /nfs/dbraw/zinc/76/52/42/1430765242.db2.gz OULKSHMKUPODCH-CQSZACIVSA-N 0 0 382.363 3.071 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183658980 1430765447 /nfs/dbraw/zinc/76/54/47/1430765447.db2.gz RQBMVLRKLRJBSF-QGZVFWFLSA-N 0 0 384.436 3.028 20 5 GGBDRN CC[C@H](NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1cc(F)ccc1F ZINC000183663204 1430766364 /nfs/dbraw/zinc/76/63/64/1430766364.db2.gz AUZGMZLROOTUNB-INIZCTEOSA-N 0 0 391.374 3.179 20 5 GGBDRN Cc1cccnc1[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000183664386 1430766588 /nfs/dbraw/zinc/76/65/88/1430766588.db2.gz GEKORAZGYBNPEJ-QGZVFWFLSA-N 0 0 377.466 3.157 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC[C@H](c3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000183684681 1430772061 /nfs/dbraw/zinc/77/20/61/1430772061.db2.gz HKMFPSINOKTPOD-LPHOPBHVSA-N 0 0 395.459 3.285 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(F)cc2OC(F)F)ccc1[N+](=O)[O-] ZINC000183691623 1430774235 /nfs/dbraw/zinc/77/42/35/1430774235.db2.gz JCAOQDVTOLQXLG-UHFFFAOYSA-N 0 0 397.309 3.012 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@@H](C)C[C@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000183691123 1430774381 /nfs/dbraw/zinc/77/43/81/1430774381.db2.gz MAPLVRHYFCYKND-DJJJIMSYSA-N 0 0 399.422 3.382 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@H](C)C[C@@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000183691059 1430774386 /nfs/dbraw/zinc/77/43/86/1430774386.db2.gz MAPLVRHYFCYKND-BFUOFWGJSA-N 0 0 399.422 3.382 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N3CCC(C)(CO)CC3)cc2[N+](=O)[O-])CC1 ZINC000183695167 1430775015 /nfs/dbraw/zinc/77/50/15/1430775015.db2.gz JFKOUGVDZWDJEE-UHFFFAOYSA-N 0 0 375.469 3.066 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)Nc3nc(C)nn3C)cc2[N+](=O)[O-])n1 ZINC000183694739 1430775103 /nfs/dbraw/zinc/77/51/03/1430775103.db2.gz IUTIRLHGUQZDLD-UHFFFAOYSA-N 0 0 390.450 3.200 20 5 GGBDRN CCCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1C[C@@H](OCC)C12CCCC2 ZINC000183704473 1430777362 /nfs/dbraw/zinc/77/73/62/1430777362.db2.gz HYTGEQOMTQDIRK-JKSUJKDBSA-N 0 0 376.457 3.162 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(C)(CO)CC3)cc2[N+](=O)[O-])C1 ZINC000183709304 1430778676 /nfs/dbraw/zinc/77/86/76/1430778676.db2.gz WQABJNQBVUZYIB-HZPDHXFCSA-N 0 0 389.496 3.312 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183714872 1430779464 /nfs/dbraw/zinc/77/94/64/1430779464.db2.gz VARWUZOYSINZEA-SFHVURJKSA-N 0 0 377.466 3.335 20 5 GGBDRN CC[C@@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000183719867 1430780203 /nfs/dbraw/zinc/78/02/03/1430780203.db2.gz RQDHIWGPODBDBF-QGZVFWFLSA-N 0 0 384.404 3.486 20 5 GGBDRN C[C@@H](C(=O)NCc1cccc(Cn2ccnc2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183719706 1430780214 /nfs/dbraw/zinc/78/02/14/1430780214.db2.gz OZJYRVCXKZRHEF-CQSZACIVSA-N 0 0 382.395 3.399 20 5 GGBDRN COc1ccc([C@H](C)CCNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000183735792 1430783903 /nfs/dbraw/zinc/78/39/03/1430783903.db2.gz CZAHFYYMJWHVIM-OAHLLOKOSA-N 0 0 392.477 3.259 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cc(N2CCCC2=O)ccc1F ZINC000183743636 1430785412 /nfs/dbraw/zinc/78/54/12/1430785412.db2.gz NCWAVQNLDBOIIA-UHFFFAOYSA-N 0 0 391.786 3.444 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1SCCC(N)=O)c1ccc([N+](=O)[O-])cc1F ZINC000183744251 1430785655 /nfs/dbraw/zinc/78/56/55/1430785655.db2.gz UMRJOYRFVYQLLM-NSHDSACASA-N 0 0 391.424 3.444 20 5 GGBDRN O=C(CCCc1ccc2[nH]c(=O)[nH]c2c1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000183752728 1430787363 /nfs/dbraw/zinc/78/73/63/1430787363.db2.gz GAKJQYCIZSLHDP-UHFFFAOYSA-N 0 0 388.811 3.057 20 5 GGBDRN Cc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)nnn1-c1ccc(C)cc1 ZINC000183768290 1430789851 /nfs/dbraw/zinc/78/98/51/1430789851.db2.gz XTLSPMCWHYKLCL-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN CCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000183768974 1430789868 /nfs/dbraw/zinc/78/98/68/1430789868.db2.gz QLKARMXTEFJOPT-OAQYLSRUSA-N 0 0 396.491 3.154 20 5 GGBDRN O=C(Cn1cccn1)Oc1ccc2c(c1)oc(=O)cc2-c1ccc([N+](=O)[O-])cc1 ZINC000183788701 1430794059 /nfs/dbraw/zinc/79/40/59/1430794059.db2.gz LJDLVIDSWRGHOY-UHFFFAOYSA-N 0 0 391.339 3.170 20 5 GGBDRN COc1cc(CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)c([N+](=O)[O-])cc1F ZINC000183817640 1430800641 /nfs/dbraw/zinc/80/06/41/1430800641.db2.gz ABHMFYDNZAGKON-LJQANCHMSA-N 0 0 387.367 3.018 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183825634 1430801709 /nfs/dbraw/zinc/80/17/09/1430801709.db2.gz KICAQQOIDGBCHH-CQSZACIVSA-N 0 0 375.400 3.298 20 5 GGBDRN COc1cc(CSc2nnnn2-c2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000183828138 1430801962 /nfs/dbraw/zinc/80/19/62/1430801962.db2.gz WNCVQZYZMIZKSU-UHFFFAOYSA-N 0 0 375.385 3.319 20 5 GGBDRN COc1cc(CSc2nnc(-c3cccnc3)n2C)c([N+](=O)[O-])cc1F ZINC000183830589 1430802285 /nfs/dbraw/zinc/80/22/85/1430802285.db2.gz QUPHDZBQPXNPTQ-UHFFFAOYSA-N 0 0 375.385 3.225 20 5 GGBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000183838742 1430803218 /nfs/dbraw/zinc/80/32/18/1430803218.db2.gz ACAMZIRUGVBFTP-UHFFFAOYSA-N 0 0 383.383 3.338 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCN([C@@H](C)c2ccsc2)CC1 ZINC000183840730 1430803579 /nfs/dbraw/zinc/80/35/79/1430803579.db2.gz JLWKQVQKAUIIJW-AWEZNQCLSA-N 0 0 395.506 3.032 20 5 GGBDRN NS(=O)(=O)c1cccc(Nc2ccc3nc(C4CC4)sc3c2)c1[N+](=O)[O-] ZINC000183847003 1430804291 /nfs/dbraw/zinc/80/42/91/1430804291.db2.gz LOEWNFKUGHWYBY-UHFFFAOYSA-N 0 0 390.446 3.473 20 5 GGBDRN C[C@H](CCn1cccn1)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000183851859 1430804886 /nfs/dbraw/zinc/80/48/86/1430804886.db2.gz RQMCTYSUQVUHTI-MRXNPFEDSA-N 0 0 375.428 3.373 20 5 GGBDRN COc1cc(CN2C(=O)N[C@](C)(c3ccccc3C)C2=O)c([N+](=O)[O-])cc1F ZINC000183855737 1430805448 /nfs/dbraw/zinc/80/54/48/1430805448.db2.gz JJBMRWVNGTYINQ-LJQANCHMSA-N 0 0 387.367 3.018 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000183854564 1430805532 /nfs/dbraw/zinc/80/55/32/1430805532.db2.gz VGADEDYHIJGPAS-UHFFFAOYSA-N 0 0 377.347 3.282 20 5 GGBDRN C[C@@H](C(=O)Nc1cc(C2CC2)nn1-c1ncccn1)c1ccc([N+](=O)[O-])cc1F ZINC000183864664 1430806179 /nfs/dbraw/zinc/80/61/79/1430806179.db2.gz HIUQJJQGPWFPQE-LLVKDONJSA-N 0 0 396.382 3.329 20 5 GGBDRN COc1cc(CSc2nnc(-c3ccccn3)n2C)c([N+](=O)[O-])cc1F ZINC000183865310 1430806485 /nfs/dbraw/zinc/80/64/85/1430806485.db2.gz HBXZFFJAILHVFR-UHFFFAOYSA-N 0 0 375.385 3.225 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCC(F)(F)CO)cc1 ZINC000183886963 1430809079 /nfs/dbraw/zinc/80/90/79/1430809079.db2.gz CUTQGNLOTAOTQL-UHFFFAOYSA-N 0 0 388.374 3.165 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccnn2-c2cccc(F)c2)cc([N+](=O)[O-])c1 ZINC000183906349 1430811384 /nfs/dbraw/zinc/81/13/84/1430811384.db2.gz NSHHHHLMWOJFDA-UHFFFAOYSA-N 0 0 398.350 3.349 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1C[C@H](O)c1ccccc1 ZINC000183939266 1430815501 /nfs/dbraw/zinc/81/55/01/1430815501.db2.gz RHKSRXNYXWKQPC-YJBOKZPZSA-N 0 0 384.436 3.081 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1C[C@@H](O)c1ccccc1 ZINC000183939245 1430815518 /nfs/dbraw/zinc/81/55/18/1430815518.db2.gz RHKSRXNYXWKQPC-MAUKXSAKSA-N 0 0 384.436 3.081 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCN(c2nccc(C(C)C)n2)CC1 ZINC000183946362 1430816785 /nfs/dbraw/zinc/81/67/85/1430816785.db2.gz XCPOGYWYSSSFTH-UHFFFAOYSA-N 0 0 397.479 3.396 20 5 GGBDRN CC[C@H](C)Oc1cc(C)ccc1CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000183947657 1430816993 /nfs/dbraw/zinc/81/69/93/1430816993.db2.gz WYHWOLMZUYYGNF-ZDUSSCGKSA-N 0 0 393.465 3.340 20 5 GGBDRN CC[C@@H](C)Oc1cc(C)ccc1CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000183947639 1430816996 /nfs/dbraw/zinc/81/69/96/1430816996.db2.gz WYHWOLMZUYYGNF-CYBMUJFWSA-N 0 0 393.465 3.340 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)NC(C)(C)c2ncc(C)s2)c([N+](=O)[O-])c1 ZINC000183959087 1430818769 /nfs/dbraw/zinc/81/87/69/1430818769.db2.gz VTCBIWGHYZWLRA-LLVKDONJSA-N 0 0 378.454 3.220 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(C)C[C@@H](C)c1nccs1 ZINC000183966057 1430819840 /nfs/dbraw/zinc/81/98/40/1430819840.db2.gz RYYAOFUSFSOQEG-NEPJUHHUSA-N 0 0 378.454 3.122 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccccc2CN2CCNC2=O)cc1[N+](=O)[O-] ZINC000184002319 1430826986 /nfs/dbraw/zinc/82/69/86/1430826986.db2.gz HLFONOFUSVYZRW-AWEZNQCLSA-N 0 0 397.435 3.311 20 5 GGBDRN Cc1ccc2c(c1)nc(CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)n2C ZINC000184015082 1430829332 /nfs/dbraw/zinc/82/93/32/1430829332.db2.gz CTXIECJZUXQMCF-UHFFFAOYSA-N 0 0 381.436 3.298 20 5 GGBDRN C[C@H](C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184016664 1430829450 /nfs/dbraw/zinc/82/94/50/1430829450.db2.gz MVBUSDDAERVLFF-LIRRHRJNSA-N 0 0 399.422 3.491 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC(O)(Cc2cccc(F)c2)CC1 ZINC000184043977 1430833605 /nfs/dbraw/zinc/83/36/05/1430833605.db2.gz AQBWPNJEIJVWAM-UHFFFAOYSA-N 0 0 376.359 3.083 20 5 GGBDRN COc1ccc([C@H](CO)N(C)C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000184046528 1430833853 /nfs/dbraw/zinc/83/38/53/1430833853.db2.gz MYXBBKDYXBBDEU-XIKOKIGWSA-N 0 0 376.384 3.038 20 5 GGBDRN COCCC(C)(C)CNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000184052556 1430834607 /nfs/dbraw/zinc/83/46/07/1430834607.db2.gz JQMWGBGJTPPLRT-UHFFFAOYSA-N 0 0 399.513 3.244 20 5 GGBDRN Cc1oc2ccccc2c1CNC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000184060444 1430836037 /nfs/dbraw/zinc/83/60/37/1430836037.db2.gz XTRYYZOVQHEDLZ-LBPRGKRZSA-N 0 0 381.388 3.084 20 5 GGBDRN CCOc1cccc(N2CCN(C(=O)c3ccc(C)c(OC)c3)CC2)c1[N+](=O)[O-] ZINC000184062806 1430836307 /nfs/dbraw/zinc/83/63/07/1430836307.db2.gz BXEWSCIITCPRNX-UHFFFAOYSA-N 0 0 399.447 3.273 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@@H]2CC[C@H](C)[C@H](C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000184065743 1430836685 /nfs/dbraw/zinc/83/66/85/1430836685.db2.gz KAHGZISQPSSEHR-GZBFAFLISA-N 0 0 384.436 3.004 20 5 GGBDRN CCn1c(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)nc2cc(F)ccc21 ZINC000184103505 1430841822 /nfs/dbraw/zinc/84/18/22/1430841822.db2.gz CITJLEYJQXQPBE-UHFFFAOYSA-N 0 0 395.350 3.197 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000184108528 1430842256 /nfs/dbraw/zinc/84/22/56/1430842256.db2.gz OFJXIZIHEVPXFH-LLVKDONJSA-N 0 0 384.371 3.150 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000184116889 1430843356 /nfs/dbraw/zinc/84/33/56/1430843356.db2.gz BLFQQTSAFRDHMU-CYBMUJFWSA-N 0 0 392.506 3.049 20 5 GGBDRN Cc1cc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)n(-c2ccccn2)n1 ZINC000184118983 1430843730 /nfs/dbraw/zinc/84/37/30/1430843730.db2.gz CTRUAESSCPEYLQ-UHFFFAOYSA-N 0 0 386.799 3.459 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NCCC1=CCCCCC1 ZINC000184140470 1430846527 /nfs/dbraw/zinc/84/65/27/1430846527.db2.gz CAALDKBHLXKLHI-UHFFFAOYSA-N 0 0 379.844 3.375 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC=C(c2ccc(F)cc2)CC1 ZINC000184143930 1430846858 /nfs/dbraw/zinc/84/68/58/1430846858.db2.gz QZEQNDTYSIZIGF-UHFFFAOYSA-N 0 0 376.409 3.353 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)Cc2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-] ZINC000184148112 1430847376 /nfs/dbraw/zinc/84/73/76/1430847376.db2.gz PMUGRCUQBYCBHA-UHFFFAOYSA-N 0 0 393.802 3.084 20 5 GGBDRN Cc1cc2cccnc2c(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000184162224 1430849014 /nfs/dbraw/zinc/84/90/14/1430849014.db2.gz SSEAJHOZDUPFNX-UHFFFAOYSA-N 0 0 378.388 3.128 20 5 GGBDRN COC(=O)c1ccc(Cl)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1C ZINC000184163891 1430849287 /nfs/dbraw/zinc/84/92/87/1430849287.db2.gz MWMCVWZQECCWBZ-UHFFFAOYSA-N 0 0 391.811 3.418 20 5 GGBDRN CC(C)Oc1ccc2ccccc2c1CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000184167294 1430849877 /nfs/dbraw/zinc/84/98/77/1430849877.db2.gz UGVFQDSWUSFDGL-UHFFFAOYSA-N 0 0 395.415 3.013 20 5 GGBDRN COc1ccc2ccccc2c1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184170923 1430850278 /nfs/dbraw/zinc/85/02/78/1430850278.db2.gz QQTCUEZOWOZAAC-UHFFFAOYSA-N 0 0 386.429 3.376 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](COCC(C)C)c1ccco1 ZINC000184173410 1430850896 /nfs/dbraw/zinc/85/08/96/1430850896.db2.gz GHACSEMZYHJLMK-INIZCTEOSA-N 0 0 391.424 3.138 20 5 GGBDRN CC(C)COC[C@@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000184187590 1430853415 /nfs/dbraw/zinc/85/34/15/1430853415.db2.gz LVLAYICAXCHCOP-QGZVFWFLSA-N 0 0 387.436 3.080 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184199037 1430855338 /nfs/dbraw/zinc/85/53/38/1430855338.db2.gz WXPHOCCWRFAAOZ-UHFFFAOYSA-N 0 0 389.427 3.466 20 5 GGBDRN C[C@@H](C(=O)NCc1cccc(NC(=O)N(C)C)c1)c1ccc([N+](=O)[O-])cc1F ZINC000184218728 1430858101 /nfs/dbraw/zinc/85/81/01/1430858101.db2.gz APZCZJXQALXIMG-GFCCVEGCSA-N 0 0 388.399 3.247 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000184223978 1430858497 /nfs/dbraw/zinc/85/84/97/1430858497.db2.gz XJYCZWGFUMAPPN-UHFFFAOYSA-N 0 0 388.855 3.179 20 5 GGBDRN COc1cc(CN2CCOC[C@@H]2C[C@H](O)c2cccs2)c([N+](=O)[O-])cc1F ZINC000184233902 1430860129 /nfs/dbraw/zinc/86/01/29/1430860129.db2.gz VARJWFWOGZLEHD-BBRMVZONSA-N 0 0 396.440 3.129 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000184237357 1430860555 /nfs/dbraw/zinc/86/05/55/1430860555.db2.gz DDQSUBRDFVEFNV-INIZCTEOSA-N 0 0 396.852 3.319 20 5 GGBDRN COc1cc(CN(C)CC(=O)Nc2cccc(C)c2C)c([N+](=O)[O-])cc1F ZINC000184239013 1430860777 /nfs/dbraw/zinc/86/07/77/1430860777.db2.gz QGDHNHSSNDXDLL-UHFFFAOYSA-N 0 0 375.400 3.430 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000184239812 1430860904 /nfs/dbraw/zinc/86/09/04/1430860904.db2.gz OCCQEUMPNWRFQV-INIZCTEOSA-N 0 0 396.852 3.319 20 5 GGBDRN CC(C)(C)c1cc(NC(=O)c2cc([N+](=O)[O-])cnc2N)n(Cc2ccccc2)n1 ZINC000184240646 1430861055 /nfs/dbraw/zinc/86/10/55/1430861055.db2.gz MXGCNNCDNDQMCX-UHFFFAOYSA-N 0 0 394.435 3.367 20 5 GGBDRN CCc1nc(CN2CCN(Cc3cc(OC)c(F)cc3[N+](=O)[O-])CC2)cs1 ZINC000184242275 1430861388 /nfs/dbraw/zinc/86/13/88/1430861388.db2.gz MZVVBBLEJJDSPN-UHFFFAOYSA-N 0 0 394.472 3.079 20 5 GGBDRN COc1cc(CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)c([N+](=O)[O-])cc1F ZINC000184246490 1430861820 /nfs/dbraw/zinc/86/18/20/1430861820.db2.gz LKARMVMMOCDLJF-CQSZACIVSA-N 0 0 393.459 3.213 20 5 GGBDRN COc1cc(CN2CCO[C@H](CCc3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000184246745 1430861823 /nfs/dbraw/zinc/86/18/23/1430861823.db2.gz ZAVOSOPASRBMHZ-GOSISDBHSA-N 0 0 386.448 3.446 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184247831 1430861996 /nfs/dbraw/zinc/86/19/96/1430861996.db2.gz RIVDDBDGWYDWDJ-UHFFFAOYSA-N 0 0 381.448 3.213 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184251763 1430862480 /nfs/dbraw/zinc/86/24/80/1430862480.db2.gz GJXLMQSTMBOAFL-KBPBESRZSA-N 0 0 381.448 3.259 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCCc2cc(OC(F)F)ccc21 ZINC000184260200 1430863820 /nfs/dbraw/zinc/86/38/20/1430863820.db2.gz JLLJTSNJLNRSKC-UHFFFAOYSA-N 0 0 398.387 3.479 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000184259364 1430863840 /nfs/dbraw/zinc/86/38/40/1430863840.db2.gz UHUCTDABEKIEHY-AWEZNQCLSA-N 0 0 397.218 3.093 20 5 GGBDRN CC(C)COc1cccc(CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000184264057 1430864523 /nfs/dbraw/zinc/86/45/23/1430864523.db2.gz DNYODOPIWYXACG-UHFFFAOYSA-N 0 0 378.450 3.249 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000184267731 1430864963 /nfs/dbraw/zinc/86/49/63/1430864963.db2.gz YQRJSYMKIMYMFZ-QFBILLFUSA-N 0 0 390.461 3.182 20 5 GGBDRN COc1cc(CN2CCN(c3nc(C)c(C)s3)CC2)c([N+](=O)[O-])cc1F ZINC000184270310 1430865426 /nfs/dbraw/zinc/86/54/26/1430865426.db2.gz DOOXEMFJEPZGCR-UHFFFAOYSA-N 0 0 380.445 3.138 20 5 GGBDRN C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)c2ccccc21 ZINC000184273819 1430865995 /nfs/dbraw/zinc/86/59/95/1430865995.db2.gz UDGWXDHBLJSTAI-GFCCVEGCSA-N 0 0 385.807 3.441 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000184280840 1430867191 /nfs/dbraw/zinc/86/71/91/1430867191.db2.gz VQPDSMKCBSMHMA-UHFFFAOYSA-N 0 0 380.326 3.052 20 5 GGBDRN COc1cc(CNC(C)(C)C(=O)NCC2CCCCC2)c([N+](=O)[O-])cc1F ZINC000184292207 1430869349 /nfs/dbraw/zinc/86/93/49/1430869349.db2.gz MIAWNHHSUKZFMS-UHFFFAOYSA-N 0 0 381.448 3.307 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NC[C@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000184297795 1430870276 /nfs/dbraw/zinc/87/02/76/1430870276.db2.gz PZULUYYKELTEJN-ZDUSSCGKSA-N 0 0 377.470 3.265 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2ccc(OCc3ccccc3F)cc2)c1[N+](=O)[O-] ZINC000184301779 1430870725 /nfs/dbraw/zinc/87/07/25/1430870725.db2.gz MEYCFHMAURSTNB-UHFFFAOYSA-N 0 0 398.394 3.285 20 5 GGBDRN CSc1c(F)cc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000184304984 1430871034 /nfs/dbraw/zinc/87/10/34/1430871034.db2.gz DXEQTIFHNVWABR-UHFFFAOYSA-N 0 0 395.387 3.192 20 5 GGBDRN COc1ccc(O[C@@H](C)CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000184312692 1430872010 /nfs/dbraw/zinc/87/20/10/1430872010.db2.gz FLDGARJXLQBTJR-QWHCGFSZSA-N 0 0 376.384 3.430 20 5 GGBDRN COc1ccc(CC[C@H](C)NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000184316925 1430872448 /nfs/dbraw/zinc/87/24/48/1430872448.db2.gz KDOQLXWYHJEFLU-AWEZNQCLSA-N 0 0 378.450 3.044 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000184331281 1430873860 /nfs/dbraw/zinc/87/38/60/1430873860.db2.gz NPILJNFTTYBEAD-CQSZACIVSA-N 0 0 385.420 3.337 20 5 GGBDRN COc1ccc(C(C)(C)CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000184367256 1430878964 /nfs/dbraw/zinc/87/89/64/1430878964.db2.gz SXWXKBSCNJKHFW-UHFFFAOYSA-N 0 0 378.450 3.001 20 5 GGBDRN COC(=O)c1ccc(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000184371096 1430879675 /nfs/dbraw/zinc/87/96/75/1430879675.db2.gz YFMRKUFANXIVKZ-UHFFFAOYSA-N 0 0 391.811 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c(F)c1 ZINC000184371845 1430879830 /nfs/dbraw/zinc/87/98/30/1430879830.db2.gz KUDSNBOTAICDIY-SNVBAGLBSA-N 0 0 386.351 3.190 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184371818 1430879863 /nfs/dbraw/zinc/87/98/63/1430879863.db2.gz BKNCWFNXSWBPGK-GFCCVEGCSA-N 0 0 382.388 3.360 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184377090 1430880483 /nfs/dbraw/zinc/88/04/83/1430880483.db2.gz SVXLXQDNABLGPS-LLVKDONJSA-N 0 0 398.387 3.060 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1 ZINC000184377394 1430880502 /nfs/dbraw/zinc/88/05/02/1430880502.db2.gz PHQQETRDVYRQAS-AWEZNQCLSA-N 0 0 396.415 3.235 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000184380072 1430880810 /nfs/dbraw/zinc/88/08/10/1430880810.db2.gz BJDHHCXNUKSTDB-UHFFFAOYSA-N 0 0 385.449 3.332 20 5 GGBDRN O=C(NCc1ccc(Cn2cccn2)cc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184381913 1430881107 /nfs/dbraw/zinc/88/11/07/1430881107.db2.gz HNXOUPYVLDRRED-UHFFFAOYSA-N 0 0 399.838 3.492 20 5 GGBDRN CC[C@@H](N[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000184395010 1430882602 /nfs/dbraw/zinc/88/26/02/1430882602.db2.gz NSNHNDNMAGBLBV-DGCLKSJQSA-N 0 0 378.454 3.436 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)CCc1ncc(-c2ccccc2Cl)o1 ZINC000184399474 1430883207 /nfs/dbraw/zinc/88/32/07/1430883207.db2.gz QZYCHJLLWPPROS-UHFFFAOYSA-N 0 0 375.772 3.208 20 5 GGBDRN CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N)c1 ZINC000184401484 1430883319 /nfs/dbraw/zinc/88/33/19/1430883319.db2.gz UXZGTERUGRQYFL-UHFFFAOYSA-N 0 0 391.449 3.143 20 5 GGBDRN COc1cc(CN2CCNC(=O)[C@@H]2c2ccccc2Cl)c([N+](=O)[O-])cc1F ZINC000184404140 1430884048 /nfs/dbraw/zinc/88/40/48/1430884048.db2.gz BVBUWQLOPODWIH-KRWDZBQOSA-N 0 0 393.802 3.069 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1 ZINC000184406120 1430884258 /nfs/dbraw/zinc/88/42/58/1430884258.db2.gz OYCYFMSYQKBMFP-UHFFFAOYSA-N 0 0 386.389 3.080 20 5 GGBDRN C[C@@H]([NH2+]C(C)(C)CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000184411571 1430884812 /nfs/dbraw/zinc/88/48/12/1430884812.db2.gz XEYYPZZOVYPDHS-OAHLLOKOSA-N 0 0 391.493 3.144 20 5 GGBDRN C[C@H]([NH2+]C(C)(C)CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000184411549 1430884819 /nfs/dbraw/zinc/88/48/19/1430884819.db2.gz XEYYPZZOVYPDHS-HNNXBMFYSA-N 0 0 391.493 3.144 20 5 GGBDRN CC(C)n1ncc2c1nc(-c1ccco1)cc2C(=O)Nc1c([N+](=O)[O-])cnn1C ZINC000184413200 1430884977 /nfs/dbraw/zinc/88/49/77/1430884977.db2.gz UHRBSOBCFOOLJZ-UHFFFAOYSA-N 0 0 395.379 3.166 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 ZINC000184423177 1430886218 /nfs/dbraw/zinc/88/62/18/1430886218.db2.gz SAHYRVRZOAZJHT-SFHVURJKSA-N 0 0 389.839 3.416 20 5 GGBDRN CC(C)(c1nnc(NC(=O)c2cc([N+](=O)[O-])cnc2N)s1)c1ccccc1 ZINC000184430465 1430887142 /nfs/dbraw/zinc/88/71/42/1430887142.db2.gz VMDJBGOHWKCMNB-UHFFFAOYSA-N 0 0 384.421 3.002 20 5 GGBDRN O=C(c1cccc(NCCc2ccc([N+](=O)[O-])cc2)c1)N1CCC[C@H](CO)C1 ZINC000184432824 1430887383 /nfs/dbraw/zinc/88/73/83/1430887383.db2.gz XIJPFZBQDQKBON-KRWDZBQOSA-N 0 0 383.448 3.094 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000184437045 1430887840 /nfs/dbraw/zinc/88/78/40/1430887840.db2.gz UIADDCGQXVQYCC-UHFFFAOYSA-N 0 0 376.800 3.206 20 5 GGBDRN CC(C)(C)c1csc(C2CCN(C(=O)c3cc([N+](=O)[O-])cnc3N)CC2)n1 ZINC000184463979 1430890640 /nfs/dbraw/zinc/89/06/40/1430890640.db2.gz QVPIKYBOTYOOED-UHFFFAOYSA-N 0 0 389.481 3.346 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000184464388 1430890770 /nfs/dbraw/zinc/89/07/70/1430890770.db2.gz KGZYEZPCCHFYNT-CYBMUJFWSA-N 0 0 397.859 3.240 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H](c1ccccc1)c1cccnc1 ZINC000184463906 1430890782 /nfs/dbraw/zinc/89/07/82/1430890782.db2.gz GCRIANUCKUKFKN-IBGZPJMESA-N 0 0 383.429 3.199 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000184469132 1430891194 /nfs/dbraw/zinc/89/11/94/1430891194.db2.gz HYBOVBZMZDHOCE-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN C[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C(C)(C)C)cs1 ZINC000184479543 1430892540 /nfs/dbraw/zinc/89/25/40/1430892540.db2.gz LSECTCICFHVLOE-LBPRGKRZSA-N 0 0 397.522 3.473 20 5 GGBDRN CN([C@@H]1CCCN(c2ccccc2)C1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184495652 1430895017 /nfs/dbraw/zinc/89/50/17/1430895017.db2.gz IXTFGXWQWUYMOM-GOSISDBHSA-N 0 0 389.477 3.025 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCc2[nH]c3ccccc3c2C1 ZINC000184506439 1430896045 /nfs/dbraw/zinc/89/60/45/1430896045.db2.gz OXTOOBPBAKSZBM-UHFFFAOYSA-N 0 0 392.415 3.216 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1nccc2ccccc21 ZINC000184504893 1430896061 /nfs/dbraw/zinc/89/60/61/1430896061.db2.gz BUVRNYCSESRFSU-UHFFFAOYSA-N 0 0 378.388 3.015 20 5 GGBDRN CN(C)c1cccc([C@H]2CCCN2S(=O)(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000184509363 1430896339 /nfs/dbraw/zinc/89/63/39/1430896339.db2.gz KAIIZFICPPAYBR-GOSISDBHSA-N 0 0 389.477 3.328 20 5 GGBDRN Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000184508670 1430896397 /nfs/dbraw/zinc/89/63/97/1430896397.db2.gz YJKLYDUJAHHFOC-CQSZACIVSA-N 0 0 384.436 3.094 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184517805 1430897483 /nfs/dbraw/zinc/89/74/83/1430897483.db2.gz PHEJMSUNHSRZNZ-CJNGLKHVSA-N 0 0 378.425 3.442 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)Nc1c[nH]nc1-c1ccccc1 ZINC000184528737 1430898929 /nfs/dbraw/zinc/89/89/29/1430898929.db2.gz SPEOYIJXNAIUKG-UHFFFAOYSA-N 0 0 379.376 3.179 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1C[C@H](C)C[C@H]1c1cccnc1 ZINC000184530391 1430899137 /nfs/dbraw/zinc/89/91/37/1430899137.db2.gz YKXILVJVIOESPF-PXAZEXFGSA-N 0 0 382.420 3.155 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000184530765 1430899193 /nfs/dbraw/zinc/89/91/93/1430899193.db2.gz OTWSDZRRJSYGQH-CQSZACIVSA-N 0 0 381.436 3.393 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000184530406 1430899236 /nfs/dbraw/zinc/89/92/36/1430899236.db2.gz YKXILVJVIOESPF-SJCJKPOMSA-N 0 0 382.420 3.155 20 5 GGBDRN C[C@H](C(=O)N(C)Cc1ccc([S@](C)=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000184559315 1430904678 /nfs/dbraw/zinc/90/46/78/1430904678.db2.gz DNSLCCPEJYTBDQ-QDXKXIGTSA-N 0 0 378.425 3.233 20 5 GGBDRN Cc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cc1-c1nnnn1C1CC1 ZINC000184592807 1430912700 /nfs/dbraw/zinc/91/27/00/1430912700.db2.gz ZPQOFOHGXWLMHI-UHFFFAOYSA-N 0 0 378.392 3.073 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)ccc1[N+](=O)[O-] ZINC000184594193 1430913086 /nfs/dbraw/zinc/91/30/86/1430913086.db2.gz ZENKHKUXJRVZMN-UHFFFAOYSA-N 0 0 394.391 3.153 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](CCSC)c1nnc2ccccn21 ZINC000184605282 1430916626 /nfs/dbraw/zinc/91/66/26/1430916626.db2.gz QRZQBFFTRCZJGJ-OAHLLOKOSA-N 0 0 387.465 3.230 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000184605157 1430916636 /nfs/dbraw/zinc/91/66/36/1430916636.db2.gz UFVBYPBDJUSOSG-FQEVSTJZSA-N 0 0 397.410 3.094 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)cc([N+](=O)[O-])c1 ZINC000184604405 1430916907 /nfs/dbraw/zinc/91/69/07/1430916907.db2.gz XUIVTOXCYLKFBA-UHFFFAOYSA-N 0 0 378.392 3.452 20 5 GGBDRN CC(C)[C@@H](Cc1ccc(F)cc1)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184606316 1430917540 /nfs/dbraw/zinc/91/75/40/1430917540.db2.gz BTSKKHWMHDSMKA-QGZVFWFLSA-N 0 0 380.441 3.421 20 5 GGBDRN CC(C)(CC(N)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000184608433 1430917813 /nfs/dbraw/zinc/91/78/13/1430917813.db2.gz KODHOMNEYRDTCJ-UHFFFAOYSA-N 0 0 391.811 3.424 20 5 GGBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC000184606993 1430917949 /nfs/dbraw/zinc/91/79/49/1430917949.db2.gz UGYQPAHLLOCLAL-LBPRGKRZSA-N 0 0 394.453 3.206 20 5 GGBDRN Cc1cc(NC(=O)N[C@H](CC(N)=O)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000184610381 1430918535 /nfs/dbraw/zinc/91/85/35/1430918535.db2.gz BTPNOOVSFOPRHD-CQSZACIVSA-N 0 0 376.800 3.295 20 5 GGBDRN C[C@@H](C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184609998 1430918646 /nfs/dbraw/zinc/91/86/46/1430918646.db2.gz BLPDZPAZJHDPGC-PBHICJAKSA-N 0 0 394.443 3.414 20 5 GGBDRN Cc1cc(NC(=O)N2CCN([C@H](C)c3nccs3)CC2)ccc1[N+](=O)[O-] ZINC000184611793 1430918882 /nfs/dbraw/zinc/91/88/82/1430918882.db2.gz GTVNLPRJGBJCMW-CYBMUJFWSA-N 0 0 375.454 3.270 20 5 GGBDRN COc1cc(CN[C@@H](c2cnn(C)c2)c2ccc(F)cc2)c([N+](=O)[O-])cc1F ZINC000184611678 1430919257 /nfs/dbraw/zinc/91/92/57/1430919257.db2.gz ZGGSFMWINVQFCL-LJQANCHMSA-N 0 0 388.374 3.494 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCN(CC2CC2)c2ccccc21 ZINC000184613773 1430919734 /nfs/dbraw/zinc/91/97/34/1430919734.db2.gz JTSUWDKDMUEHFP-UHFFFAOYSA-N 0 0 387.461 3.161 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCC[C@@H](C2OCCO2)C1 ZINC000184616005 1430919967 /nfs/dbraw/zinc/91/99/67/1430919967.db2.gz BVANUEKPDZYYOV-SNVBAGLBSA-N 0 0 389.330 3.230 20 5 GGBDRN C[C@@H](C(=O)N1CCN(c2cc(F)ccc2F)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184616799 1430920472 /nfs/dbraw/zinc/92/04/72/1430920472.db2.gz XGFPZOVOGCPEOK-GFCCVEGCSA-N 0 0 393.365 3.464 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)c1 ZINC000184620809 1430921696 /nfs/dbraw/zinc/92/16/96/1430921696.db2.gz OTXNKDCXSMVJDO-UHFFFAOYSA-N 0 0 394.391 3.153 20 5 GGBDRN COc1ccccc1C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000184626116 1430922907 /nfs/dbraw/zinc/92/29/07/1430922907.db2.gz UBPGXGMGISJRFK-KRWDZBQOSA-N 0 0 392.477 3.290 20 5 GGBDRN CC[C@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])Oc1cccc(C)c1 ZINC000184639576 1430926957 /nfs/dbraw/zinc/92/69/57/1430926957.db2.gz WNCJDKKQDJQIGA-MRXNPFEDSA-N 0 0 378.450 3.180 20 5 GGBDRN CC(C)n1nnnc1-c1ccccc1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000184651784 1430930470 /nfs/dbraw/zinc/93/04/70/1430930470.db2.gz LCLPQIMYYDWWCW-UHFFFAOYSA-N 0 0 381.396 3.151 20 5 GGBDRN CC[C@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])Oc1cccc(F)c1 ZINC000184655994 1430931591 /nfs/dbraw/zinc/93/15/91/1430931591.db2.gz RNSMMWMGVACCGT-OAHLLOKOSA-N 0 0 382.413 3.011 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NS(C)(=O)=O)cc1 ZINC000184660651 1430933309 /nfs/dbraw/zinc/93/33/09/1430933309.db2.gz HPCGGIYQUHMZTA-AWEZNQCLSA-N 0 0 391.449 3.174 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](CC(C)C)N1CCOCC1 ZINC000184661415 1430933588 /nfs/dbraw/zinc/93/35/88/1430933588.db2.gz DHQOIPBIOFMVLB-ICSRJNTNSA-N 0 0 391.512 3.027 20 5 GGBDRN Cc1cc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)n(-c2cc(C)nc(C)n2)n1 ZINC000184668014 1430936565 /nfs/dbraw/zinc/93/65/65/1430936565.db2.gz DUADUWHGAMMYGW-GFCCVEGCSA-N 0 0 398.398 3.377 20 5 GGBDRN Cc1ccc(OC(F)F)c(CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000184668877 1430936836 /nfs/dbraw/zinc/93/68/36/1430936836.db2.gz CYYWOWYBWUUPMR-UHFFFAOYSA-N 0 0 386.376 3.124 20 5 GGBDRN C[C@@H]1CCN(C)c2ccccc2N1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184674821 1430939329 /nfs/dbraw/zinc/93/93/29/1430939329.db2.gz ZSKWMWPVWADKQC-CQSZACIVSA-N 0 0 375.450 3.160 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184676557 1430939703 /nfs/dbraw/zinc/93/97/03/1430939703.db2.gz KIVBBELCRZNFII-SNVBAGLBSA-N 0 0 379.848 3.029 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccnc(-n2cccn2)c1 ZINC000184680751 1430941025 /nfs/dbraw/zinc/94/10/25/1430941025.db2.gz NDOHGHGREXEBAY-QGZVFWFLSA-N 0 0 379.420 3.061 20 5 GGBDRN CCCCNC(=O)C1CCN(C(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000184683338 1430942075 /nfs/dbraw/zinc/94/20/75/1430942075.db2.gz UGBGYHRHJSBIFV-QGZVFWFLSA-N 0 0 389.496 3.318 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2nc(C)cs2)CC1 ZINC000184685930 1430942581 /nfs/dbraw/zinc/94/25/81/1430942581.db2.gz AASJCVXFUUFMIF-MRXNPFEDSA-N 0 0 388.493 3.277 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCC[C@H](Nc2ccccc2)C1 ZINC000184692644 1430944156 /nfs/dbraw/zinc/94/41/56/1430944156.db2.gz LQYBRFYRINHJJQ-KRWDZBQOSA-N 0 0 375.450 3.001 20 5 GGBDRN CCc1nc2c(s1)[C@H](N(C)S(=O)(=O)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000184694460 1430944885 /nfs/dbraw/zinc/94/48/85/1430944885.db2.gz OHGTVJMXDRZPAZ-OAHLLOKOSA-N 0 0 395.506 3.453 20 5 GGBDRN CCc1nc([C@@H](C)NCCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cs1 ZINC000184698758 1430945205 /nfs/dbraw/zinc/94/52/05/1430945205.db2.gz AILLBVAPKAPDHZ-LLVKDONJSA-N 0 0 378.454 3.302 20 5 GGBDRN 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CCN(CC)C(=O)c1ccc(NC(=O)COc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000185030148 1431044962 /nfs/dbraw/zinc/04/49/62/1431044962.db2.gz VUQDGZGYYXKUNK-UHFFFAOYSA-N 0 0 389.383 3.233 20 5 GGBDRN COc1ccc(-c2noc(COc3c(F)cccc3[N+](=O)[O-])n2)c(OC)c1 ZINC000185033831 1431045604 /nfs/dbraw/zinc/04/56/04/1431045604.db2.gz NJHVTSNUXCJRNM-UHFFFAOYSA-N 0 0 375.312 3.380 20 5 GGBDRN O=C(NC1CC1)[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000185035808 1431046439 /nfs/dbraw/zinc/04/64/39/1431046439.db2.gz YKUBRLDYUSQASN-KRWDZBQOSA-N 0 0 377.803 3.497 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(COc3c(F)cccc3[N+](=O)[O-])nc2c1 ZINC000185037727 1431046883 /nfs/dbraw/zinc/04/68/83/1431046883.db2.gz SSTYISAGQVOOOR-UHFFFAOYSA-N 0 0 380.353 3.248 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(S(C)(=O)=O)ccc1F ZINC000185041728 1431047669 /nfs/dbraw/zinc/04/76/69/1431047669.db2.gz QYJTZBRWFLUFMW-CYBMUJFWSA-N 0 0 394.424 3.345 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OC ZINC000185046405 1431048692 /nfs/dbraw/zinc/04/86/92/1431048692.db2.gz ZNBKXHFTJPFGQI-JXFKEZNVSA-N 0 0 396.443 3.290 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(S(C)(=O)=O)c1 ZINC000185054141 1431050068 /nfs/dbraw/zinc/05/00/68/1431050068.db2.gz JUTZSRWWVCFQNS-CQSZACIVSA-N 0 0 376.434 3.206 20 5 GGBDRN Cc1c(=O)[nH]c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nc1-c1ccccc1 ZINC000185053730 1431050152 /nfs/dbraw/zinc/05/01/52/1431050152.db2.gz BNSYSQFTXMHCQR-UHFFFAOYSA-N 0 0 396.428 3.384 20 5 GGBDRN C[C@H](C(=O)NCCNC(=O)c1ccccc1Cl)c1ccc([N+](=O)[O-])cc1F ZINC000185055009 1431050690 /nfs/dbraw/zinc/05/06/90/1431050690.db2.gz WQEXTARHGWHDTI-NSHDSACASA-N 0 0 393.802 3.037 20 5 GGBDRN COc1cc2c(cc1CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)O[C@H](C)C2 ZINC000185076895 1431054795 /nfs/dbraw/zinc/05/47/95/1431054795.db2.gz PREIAHPWSNRPDQ-NEPJUHHUSA-N 0 0 388.395 3.486 20 5 GGBDRN C[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000185077088 1431055320 /nfs/dbraw/zinc/05/53/20/1431055320.db2.gz UOHFGGHSFHMEIU-LBPRGKRZSA-N 0 0 399.382 3.463 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](C)c1nc(-c2cccc(F)c2)no1 ZINC000185082722 1431056491 /nfs/dbraw/zinc/05/64/91/1431056491.db2.gz CRAMEXMUMBPYCU-LBPRGKRZSA-N 0 0 399.382 3.382 20 5 GGBDRN C[C@H]1CSc2ccc(Cl)cc2N(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000185101325 1431061628 /nfs/dbraw/zinc/06/16/28/1431061628.db2.gz IEIPAFGOJJGFJR-LLVKDONJSA-N 0 0 393.852 3.185 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N2CCOCC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000185120773 1431065227 /nfs/dbraw/zinc/06/52/27/1431065227.db2.gz YULYJYAYFKCICV-UHFFFAOYSA-N 0 0 376.453 3.162 20 5 GGBDRN C[C@H](C(=O)N1CCCN(c2nccs2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185121394 1431065462 /nfs/dbraw/zinc/06/54/62/1431065462.db2.gz PFDGGSXOTNXKMW-LBPRGKRZSA-N 0 0 378.429 3.033 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N(CCS(C)(=O)=O)C(C)(C)C)cc1[N+](=O)[O-] ZINC000185121818 1431065710 /nfs/dbraw/zinc/06/57/10/1431065710.db2.gz UXRMTINIBIXGPQ-UHFFFAOYSA-N 0 0 384.498 3.178 20 5 GGBDRN CCc1nc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)sc1C(=O)OC ZINC000185123066 1431066005 /nfs/dbraw/zinc/06/60/05/1431066005.db2.gz JYUZPIPWGXQFIO-QMMMGPOBSA-N 0 0 381.385 3.282 20 5 GGBDRN CCc1nc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)sc1C(=O)OC ZINC000185123085 1431066029 /nfs/dbraw/zinc/06/60/29/1431066029.db2.gz JYUZPIPWGXQFIO-MRVPVSSYSA-N 0 0 381.385 3.282 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC(C)(C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000185129142 1431067954 /nfs/dbraw/zinc/06/79/54/1431067954.db2.gz OTPPBJHZIHFFEX-UHFFFAOYSA-N 0 0 388.449 3.004 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC[C@H](O)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000185134936 1431069570 /nfs/dbraw/zinc/06/95/70/1431069570.db2.gz QKZFYHPEJOFQKH-PXAZEXFGSA-N 0 0 384.392 3.038 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000185137970 1431070576 /nfs/dbraw/zinc/07/05/76/1431070576.db2.gz LRBQWPSGIDEXOC-QGZVFWFLSA-N 0 0 394.836 3.068 20 5 GGBDRN C[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1nc(C(C)(C)C)no1 ZINC000185142025 1431071374 /nfs/dbraw/zinc/07/13/74/1431071374.db2.gz PDINWQFAPKBGMI-VIFPVBQESA-N 0 0 381.820 3.218 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000185144162 1431071493 /nfs/dbraw/zinc/07/14/93/1431071493.db2.gz KXNHXHPKJRKMQT-IBGZPJMESA-N 0 0 388.445 3.032 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000185143795 1431071732 /nfs/dbraw/zinc/07/17/32/1431071732.db2.gz NPPDOYLVQBTVOR-QGZVFWFLSA-N 0 0 394.836 3.068 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1F)C(=O)N1CC(=O)Nc2ccccc21 ZINC000185151982 1431073127 /nfs/dbraw/zinc/07/31/27/1431073127.db2.gz XGVQKCWVNYEZOS-JTQLQIEISA-N 0 0 375.381 3.200 20 5 GGBDRN Cc1c(NC(=O)CCN[C@@H](C)c2nc(C(C)(C)C)no2)cccc1[N+](=O)[O-] ZINC000185153069 1431073181 /nfs/dbraw/zinc/07/31/81/1431073181.db2.gz WVGGHIMWMYZPBH-LBPRGKRZSA-N 0 0 375.429 3.263 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1F)C(=O)NC(=O)NCc1ccccc1 ZINC000185159851 1431074214 /nfs/dbraw/zinc/07/42/14/1431074214.db2.gz QGFLEJAUSRKFTB-LLVKDONJSA-N 0 0 377.397 3.241 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000185161297 1431074585 /nfs/dbraw/zinc/07/45/85/1431074585.db2.gz FRXFPBMQTSNNIZ-QLFBSQMISA-N 0 0 393.459 3.381 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)N1N=C(c2ccco2)C[C@H]1c1ccco1 ZINC000185166346 1431076083 /nfs/dbraw/zinc/07/60/83/1431076083.db2.gz SQMCWJRNYGJDKX-AWEZNQCLSA-N 0 0 395.375 3.233 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)Nc1cc(C2CC2)nn1-c1ccccc1 ZINC000185173896 1431077730 /nfs/dbraw/zinc/07/77/30/1431077730.db2.gz IMUYHRCZAGWHJW-UHFFFAOYSA-N 0 0 392.419 3.371 20 5 GGBDRN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1 ZINC000185175978 1431078062 /nfs/dbraw/zinc/07/80/62/1431078062.db2.gz GCMNEVGQTMXCHS-UHFFFAOYSA-N 0 0 394.435 3.418 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000185185287 1431079759 /nfs/dbraw/zinc/07/97/59/1431079759.db2.gz SCQITXVGJMQZKF-LBPRGKRZSA-N 0 0 375.429 3.263 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1 ZINC000185194323 1431081793 /nfs/dbraw/zinc/08/17/93/1431081793.db2.gz QFVMIVARZMJDIR-INIZCTEOSA-N 0 0 399.447 3.269 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1C(=O)NCc1ccco1 ZINC000185194884 1431082134 /nfs/dbraw/zinc/08/21/34/1431082134.db2.gz WZNLJHRWROMGDY-LPHOPBHVSA-N 0 0 399.447 3.064 20 5 GGBDRN C[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C(C)(C)C)no1 ZINC000185203528 1431084076 /nfs/dbraw/zinc/08/40/76/1431084076.db2.gz PILCBPHBNPHEKM-VIFPVBQESA-N 0 0 381.820 3.218 20 5 GGBDRN C[C@H](C(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185206237 1431084374 /nfs/dbraw/zinc/08/43/74/1431084374.db2.gz FZKGAHXRZPZSLG-GOEBONIOSA-N 0 0 399.422 3.002 20 5 GGBDRN C[C@@H](C(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185206255 1431084594 /nfs/dbraw/zinc/08/45/94/1431084594.db2.gz FZKGAHXRZPZSLG-GDBMZVCRSA-N 0 0 399.422 3.002 20 5 GGBDRN C[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1nc(C2CCCCC2)no1 ZINC000185215022 1431086666 /nfs/dbraw/zinc/08/66/66/1431086666.db2.gz VYIIHIUQZBZFPM-CJNGLKHVSA-N 0 0 390.440 3.116 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCc2c(C(N)=O)cccc21 ZINC000185220964 1431088043 /nfs/dbraw/zinc/08/80/43/1431088043.db2.gz CVXAJMBEPXDTRG-HNNXBMFYSA-N 0 0 381.432 3.242 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000185222530 1431088464 /nfs/dbraw/zinc/08/84/64/1431088464.db2.gz IWFZEUJLQPMRLL-QWHCGFSZSA-N 0 0 380.322 3.441 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-n2cnnn2)ccc1C ZINC000185231880 1431090187 /nfs/dbraw/zinc/09/01/87/1431090187.db2.gz BODOKKFFLMOJEL-OAHLLOKOSA-N 0 0 380.408 3.086 20 5 GGBDRN C[C@H](C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000185233346 1431090582 /nfs/dbraw/zinc/09/05/82/1431090582.db2.gz RLXQGPKFGDWLJE-LIRRHRJNSA-N 0 0 399.422 3.145 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nnc(C2CC2)n1C1CC1 ZINC000185235519 1431090808 /nfs/dbraw/zinc/09/08/08/1431090808.db2.gz ZDOLLILQICZFJB-CQSZACIVSA-N 0 0 383.452 3.284 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(OCC(=O)N(C)C)c1 ZINC000185245049 1431092878 /nfs/dbraw/zinc/09/28/78/1431092878.db2.gz LGADGGJWRCYIKN-MRXNPFEDSA-N 0 0 399.447 3.269 20 5 GGBDRN C[C@H](c1cccnc1)N1CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000185245051 1431093023 /nfs/dbraw/zinc/09/30/23/1431093023.db2.gz SJMXDCZCSGGZNX-LSDHHAIUSA-N 0 0 386.427 3.138 20 5 GGBDRN CCC1(CC)CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@]1=O ZINC000185252167 1431094080 /nfs/dbraw/zinc/09/40/80/1431094080.db2.gz XTFFELQAVNEQGD-HHHXNRCGSA-N 0 0 391.493 3.415 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccc(S(C)(=O)=O)cc1 ZINC000185269984 1431097301 /nfs/dbraw/zinc/09/73/01/1431097301.db2.gz OZBZYPDRXUGFPI-HNNXBMFYSA-N 0 0 390.461 3.230 20 5 GGBDRN CCOc1ccc(NC(=O)CNC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000185273257 1431097519 /nfs/dbraw/zinc/09/75/19/1431097519.db2.gz IOGWYPDGFPBMDS-MRXNPFEDSA-N 0 0 399.447 3.317 20 5 GGBDRN CCOc1ccc(NC(=O)CNC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000185273242 1431097765 /nfs/dbraw/zinc/09/77/65/1431097765.db2.gz IOGWYPDGFPBMDS-INIZCTEOSA-N 0 0 399.447 3.317 20 5 GGBDRN C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC000185276232 1431098195 /nfs/dbraw/zinc/09/81/95/1431098195.db2.gz DJQUHIWRVVDDPS-UKRRQHHQSA-N 0 0 390.440 3.116 20 5 GGBDRN COc1ccc(NC(=O)CN[C@@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])c1 ZINC000185277889 1431098393 /nfs/dbraw/zinc/09/83/93/1431098393.db2.gz MMURYVQAGMCXPB-MRXNPFEDSA-N 0 0 376.438 3.048 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000185287922 1431100269 /nfs/dbraw/zinc/10/02/69/1431100269.db2.gz SZIMMVLDNQXBRE-QGZVFWFLSA-N 0 0 383.448 3.481 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCNC(=O)c1cccs1 ZINC000185288672 1431101069 /nfs/dbraw/zinc/10/10/69/1431101069.db2.gz VSFRJJPJFWLUPD-OAHLLOKOSA-N 0 0 389.477 3.161 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CC[C@@H](c3c(F)cccc3F)C2)cc1 ZINC000185300138 1431104879 /nfs/dbraw/zinc/10/48/79/1431104879.db2.gz MZQIGUUEGLRANF-CYBMUJFWSA-N 0 0 396.415 3.136 20 5 GGBDRN COc1cccc(N2CCC(NC(=O)c3ccc(C)s3)CC2)c1[N+](=O)[O-] ZINC000185300470 1431105793 /nfs/dbraw/zinc/10/57/93/1431105793.db2.gz BSWNKWCRTWCYRO-UHFFFAOYSA-N 0 0 375.450 3.372 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](c1ncc(C)s1)C1CC1 ZINC000185307224 1431107557 /nfs/dbraw/zinc/10/75/57/1431107557.db2.gz KYAMWPZXGGGEBB-MRXNPFEDSA-N 0 0 376.438 3.048 20 5 GGBDRN CN1C(=O)CCc2cc(NC(=O)NCc3ccc([N+](=O)[O-])cc3Cl)ccc21 ZINC000185316792 1431111324 /nfs/dbraw/zinc/11/13/24/1431111324.db2.gz NLIGYTMBIGYLHL-UHFFFAOYSA-N 0 0 388.811 3.479 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1COc2c(cccc2OC)C1 ZINC000185322376 1431113835 /nfs/dbraw/zinc/11/38/35/1431113835.db2.gz GQKKXQMNJZEPET-DOTOQJQBSA-N 0 0 384.432 3.292 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1ccc(NC(C)=O)cc1 ZINC000185331278 1431116368 /nfs/dbraw/zinc/11/63/68/1431116368.db2.gz WQIXFDMLLYJRNH-SFHVURJKSA-N 0 0 383.448 3.481 20 5 GGBDRN COc1ccc(NC(=O)CN2CC[C@@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000185335355 1431118489 /nfs/dbraw/zinc/11/84/89/1431118489.db2.gz GGVVHPVKAZBWAG-GFCCVEGCSA-N 0 0 391.374 3.310 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)c1[N+](=O)[O-] ZINC000185338868 1431119557 /nfs/dbraw/zinc/11/95/57/1431119557.db2.gz PVPITXMTFRPHBX-UHFFFAOYSA-N 0 0 393.802 3.358 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000185351098 1431123493 /nfs/dbraw/zinc/12/34/93/1431123493.db2.gz NQCBKQWNHJMOBK-NSHDSACASA-N 0 0 397.218 3.172 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1nnnn1-c1ccccc1 ZINC000185372163 1431128363 /nfs/dbraw/zinc/12/83/63/1431128363.db2.gz DYODLCSHFZJCIH-GOEBONIOSA-N 0 0 394.435 3.017 20 5 GGBDRN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc(Cc2ccccc2)no1 ZINC000185374355 1431129139 /nfs/dbraw/zinc/12/91/39/1431129139.db2.gz LBHUCDMXEDVAFX-UONOGXRCSA-N 0 0 395.419 3.246 20 5 GGBDRN C[C@@H](N[C@@H](C)c1nc(Cc2ccccc2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000185381548 1431130963 /nfs/dbraw/zinc/13/09/63/1431130963.db2.gz AHUKTEWPKLAVMP-KGLIPLIRSA-N 0 0 395.419 3.246 20 5 GGBDRN C[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc(Cc2ccccc2)no1 ZINC000185381533 1431131216 /nfs/dbraw/zinc/13/12/16/1431131216.db2.gz AHUKTEWPKLAVMP-UONOGXRCSA-N 0 0 395.419 3.246 20 5 GGBDRN CCOC(=O)[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(F)c1 ZINC000185393197 1431134888 /nfs/dbraw/zinc/13/48/88/1431134888.db2.gz AENURLGRKSJOSE-GOSISDBHSA-N 0 0 376.384 3.179 20 5 GGBDRN CCOC(=O)[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(F)c1 ZINC000185393219 1431134925 /nfs/dbraw/zinc/13/49/25/1431134925.db2.gz AENURLGRKSJOSE-SFHVURJKSA-N 0 0 376.384 3.179 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)c2ncccc12 ZINC000185394636 1431135411 /nfs/dbraw/zinc/13/54/11/1431135411.db2.gz VGTKHQJEZVGTDL-JTQLQIEISA-N 0 0 389.355 3.106 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)c2ncccc12 ZINC000185400153 1431136263 /nfs/dbraw/zinc/13/62/63/1431136263.db2.gz FEJTZOSQVQTXOW-ZFWWWQNUSA-N 0 0 375.450 3.486 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1ccc(F)cc1F ZINC000185399041 1431136403 /nfs/dbraw/zinc/13/64/03/1431136403.db2.gz VEWNYWGTEFQPLT-JTQLQIEISA-N 0 0 393.371 3.461 20 5 GGBDRN C[C@@H](N[C@H](C)c1nc(Cc2ccccc2)no1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000185404423 1431137299 /nfs/dbraw/zinc/13/72/99/1431137299.db2.gz RKJHULWUXVVXKV-ZIAGYGMSSA-N 0 0 395.419 3.246 20 5 GGBDRN C[C@H](N[C@@H](C)c1nc(Cc2ccccc2)no1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000185404368 1431137485 /nfs/dbraw/zinc/13/74/85/1431137485.db2.gz RKJHULWUXVVXKV-KBPBESRZSA-N 0 0 395.419 3.246 20 5 GGBDRN C[C@@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000185406178 1431137895 /nfs/dbraw/zinc/13/78/95/1431137895.db2.gz LXEWSNCSEFKSLK-BFUOFWGJSA-N 0 0 397.410 3.174 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cccc(C(=O)N(C)C)c1 ZINC000185408829 1431138440 /nfs/dbraw/zinc/13/84/40/1431138440.db2.gz RXLKFFPLXVFAMB-GOSISDBHSA-N 0 0 397.475 3.224 20 5 GGBDRN C[C@@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000185411918 1431138986 /nfs/dbraw/zinc/13/89/86/1431138986.db2.gz HRVCJFPLDNCODJ-BFUOFWGJSA-N 0 0 397.410 3.174 20 5 GGBDRN C[C@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000185411899 1431139229 /nfs/dbraw/zinc/13/92/29/1431139229.db2.gz HRVCJFPLDNCODJ-ORAYPTAESA-N 0 0 397.410 3.174 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)cc1F ZINC000185414364 1431140352 /nfs/dbraw/zinc/14/03/52/1431140352.db2.gz IQDOJJWGJNPLOF-UHFFFAOYSA-N 0 0 375.381 3.069 20 5 GGBDRN Cn1cccc1[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185421909 1431142464 /nfs/dbraw/zinc/14/24/64/1431142464.db2.gz VJTNPBKVMBKERF-MRXNPFEDSA-N 0 0 386.433 3.007 20 5 GGBDRN Cn1cccc1[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185421889 1431142479 /nfs/dbraw/zinc/14/24/79/1431142479.db2.gz VJTNPBKVMBKERF-INIZCTEOSA-N 0 0 386.433 3.007 20 5 GGBDRN CN([C@@H]1CCc2ccccc21)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185425153 1431142940 /nfs/dbraw/zinc/14/29/40/1431142940.db2.gz PEDMAVUFDMGXCP-MRXNPFEDSA-N 0 0 383.429 3.451 20 5 GGBDRN CN(Cc1ccc(F)c(F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185430598 1431143671 /nfs/dbraw/zinc/14/36/71/1431143671.db2.gz WUZKQDGPCIBPNH-UHFFFAOYSA-N 0 0 393.371 3.242 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)CN(C)C)cc1 ZINC000185429944 1431143696 /nfs/dbraw/zinc/14/36/96/1431143696.db2.gz FJQGTRUPDNTOGL-INIZCTEOSA-N 0 0 398.463 3.302 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CC(N)=O)C1CCCCC1 ZINC000185434642 1431144912 /nfs/dbraw/zinc/14/49/12/1431144912.db2.gz XICITBWPAGQDIF-QAPCUYQASA-N 0 0 375.469 3.104 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCN([C@H](C)c2ccsc2)CC1 ZINC000185439659 1431145715 /nfs/dbraw/zinc/14/57/15/1431145715.db2.gz YFKDHZDKIIJKIF-HUUCEWRRSA-N 0 0 388.493 3.362 20 5 GGBDRN C[C@H](c1ccsc1)N1CCN([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000185439626 1431145981 /nfs/dbraw/zinc/14/59/81/1431145981.db2.gz YFKDHZDKIIJKIF-CABCVRRESA-N 0 0 388.493 3.362 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCc3cc(F)ccc32)c2ncccc12 ZINC000185443850 1431147018 /nfs/dbraw/zinc/14/70/18/1431147018.db2.gz GFFORZXWEPNMOV-UHFFFAOYSA-N 0 0 387.392 3.424 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)[C@H]1CCCCN1C(=O)c1ccco1 ZINC000185457650 1431149455 /nfs/dbraw/zinc/14/94/55/1431149455.db2.gz QBQOQMPRXVZIPJ-MRXNPFEDSA-N 0 0 394.387 3.369 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cc3ccccc3o2)c2ncccc12 ZINC000185462515 1431150195 /nfs/dbraw/zinc/15/01/95/1431150195.db2.gz JZBLFXNOOLPSKG-UHFFFAOYSA-N 0 0 383.385 3.368 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(OC[C@H]2CCCO2)CC1 ZINC000185466545 1431151331 /nfs/dbraw/zinc/15/13/31/1431151331.db2.gz VJMIXZVNCRLAHI-FXAWDEMLSA-N 0 0 390.480 3.350 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCc3cc(F)ccc32)c2ncccc12 ZINC000185495388 1431157692 /nfs/dbraw/zinc/15/76/92/1431157692.db2.gz CEWIYQJPPGYGDX-HNNXBMFYSA-N 0 0 387.392 3.248 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000185510947 1431161272 /nfs/dbraw/zinc/16/12/72/1431161272.db2.gz QRVUYLABOXLFCU-UHFFFAOYSA-N 0 0 389.415 3.439 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCOc1ncccc1Cl ZINC000185511451 1431161719 /nfs/dbraw/zinc/16/17/19/1431161719.db2.gz LCDCEJDXZGUWCL-CQSZACIVSA-N 0 0 377.828 3.407 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(c3nccc(C(C)C)n3)CC2)cc1[N+](=O)[O-] ZINC000185521593 1431163862 /nfs/dbraw/zinc/16/38/62/1431163862.db2.gz LNOLFWWBNWSZSA-UHFFFAOYSA-N 0 0 384.440 3.171 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1-c1nc(C)cc(C)n1 ZINC000185525953 1431164375 /nfs/dbraw/zinc/16/43/75/1431164375.db2.gz NOJUOSYBKAIAQF-MRXNPFEDSA-N 0 0 394.435 3.395 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCOCC2)nc1C ZINC000185524569 1431164544 /nfs/dbraw/zinc/16/45/44/1431164544.db2.gz MNTJAPALEVHFNT-QGZVFWFLSA-N 0 0 398.463 3.342 20 5 GGBDRN COc1cccc(N2CCCN(C(=O)CCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000185536303 1431166293 /nfs/dbraw/zinc/16/62/93/1431166293.db2.gz OPCDFTXNKIBJTQ-UHFFFAOYSA-N 0 0 383.448 3.275 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2cccc(F)c2O1 ZINC000185537079 1431166718 /nfs/dbraw/zinc/16/67/18/1431166718.db2.gz HBZZMHNYRFYZHS-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN CCOC(=O)CC[C@@H]1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000185544236 1431168061 /nfs/dbraw/zinc/16/80/61/1431168061.db2.gz RATPRUYIKYQCFS-KGLIPLIRSA-N 0 0 380.416 3.419 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(CC(F)(F)F)[C@H](C)C1 ZINC000185549151 1431168891 /nfs/dbraw/zinc/16/88/91/1431168891.db2.gz LPLXCQIOILIDRI-UKRRQHHQSA-N 0 0 387.402 3.259 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(CN2CCOCC2)n1 ZINC000185553774 1431169665 /nfs/dbraw/zinc/16/96/65/1431169665.db2.gz UGKZYQCDHOCWFJ-KRWDZBQOSA-N 0 0 398.463 3.029 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cccc(C(=O)OC)c1 ZINC000185555447 1431170057 /nfs/dbraw/zinc/17/00/57/1431170057.db2.gz UZNDGSZCDACOMO-QGZVFWFLSA-N 0 0 384.432 3.309 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCCOc3ccccc32)c2ncccc12 ZINC000185569047 1431172591 /nfs/dbraw/zinc/17/25/91/1431172591.db2.gz GKEMBSZJGBELGG-HNNXBMFYSA-N 0 0 399.428 3.335 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](Nc3ccccc3)C2)c2ncccc12 ZINC000185578437 1431174564 /nfs/dbraw/zinc/17/45/64/1431174564.db2.gz ZOSZZIWKYJCICR-OAHLLOKOSA-N 0 0 398.444 3.018 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCC[C@@H](C(C)C)CC1 ZINC000185578852 1431175099 /nfs/dbraw/zinc/17/50/99/1431175099.db2.gz HOTVOFJRSNRRKQ-KGLIPLIRSA-N 0 0 377.441 3.263 20 5 GGBDRN C[C@H](NC(=O)NC1CCC(O)(c2cccnc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000185599646 1431180727 /nfs/dbraw/zinc/18/07/27/1431180727.db2.gz VFMHCVGRZISXKO-JTOQLSFASA-N 0 0 384.436 3.180 20 5 GGBDRN C[C@@H]1c2ccccc2CCN1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185602366 1431181179 /nfs/dbraw/zinc/18/11/79/1431181179.db2.gz QDQKRSBYOSLBKG-CYBMUJFWSA-N 0 0 383.429 3.451 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](COc2ccccc2Cl)C1 ZINC000185602836 1431181815 /nfs/dbraw/zinc/18/18/15/1431181815.db2.gz DCNDSKUQQMUREQ-LBPRGKRZSA-N 0 0 390.827 3.157 20 5 GGBDRN O=C(CN1CCO[C@@H](c2cccc(Cl)c2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000185608939 1431182977 /nfs/dbraw/zinc/18/29/77/1431182977.db2.gz SYZNKSHLTUTEJK-QGZVFWFLSA-N 0 0 375.812 3.260 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)Oc3c(F)cccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000185615956 1431184869 /nfs/dbraw/zinc/18/48/69/1431184869.db2.gz MFGKEZRURIUIDX-NSHDSACASA-N 0 0 397.366 3.051 20 5 GGBDRN O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)NCC1CC1 ZINC000185617616 1431185726 /nfs/dbraw/zinc/18/57/26/1431185726.db2.gz ZHNVMXJVOPPFSE-UHFFFAOYSA-N 0 0 391.493 3.133 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC000185620658 1431186618 /nfs/dbraw/zinc/18/66/18/1431186618.db2.gz IIBLVTYDARGJOD-HKUYNNGSSA-N 0 0 392.839 3.061 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2cccc(F)c2O1 ZINC000185628740 1431188644 /nfs/dbraw/zinc/18/86/44/1431188644.db2.gz YTPFEAUUAINRBS-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN CCOc1ccc2c(c1)[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])CCO2 ZINC000185644409 1431193401 /nfs/dbraw/zinc/19/34/01/1431193401.db2.gz XDSCWQKFJNCUCA-INIZCTEOSA-N 0 0 385.420 3.070 20 5 GGBDRN Cc1nn(CC(=O)OC(C)C)c(C)c1CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000185650304 1431195935 /nfs/dbraw/zinc/19/59/35/1431195935.db2.gz GEJUGRBCJJGJKM-UHFFFAOYSA-N 0 0 394.859 3.303 20 5 GGBDRN Cc1cc(OCC(=O)Nc2cccc(N3CCCC3=O)c2)c(F)cc1[N+](=O)[O-] ZINC000185656815 1431197677 /nfs/dbraw/zinc/19/76/77/1431197677.db2.gz MMOFSMUBNRIATR-UHFFFAOYSA-N 0 0 387.367 3.187 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@H](C)c3nccs3)CC2)c1 ZINC000185663788 1431199797 /nfs/dbraw/zinc/19/97/97/1431199797.db2.gz HKJUHOIBCAJQNZ-GFCCVEGCSA-N 0 0 392.506 3.292 20 5 GGBDRN Cc1ccc(C[C@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)c2ccccn2)cc1 ZINC000185666213 1431200265 /nfs/dbraw/zinc/20/02/65/1431200265.db2.gz VAIRCHHUJKBHHZ-KRWDZBQOSA-N 0 0 378.388 3.113 20 5 GGBDRN CC[C@@H](c1ccncc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185673603 1431202127 /nfs/dbraw/zinc/20/21/27/1431202127.db2.gz JOCSAFONIIUBFN-HNNXBMFYSA-N 0 0 386.433 3.310 20 5 GGBDRN CC[C@H](c1ccncc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185673618 1431202270 /nfs/dbraw/zinc/20/22/70/1431202270.db2.gz JOCSAFONIIUBFN-OAHLLOKOSA-N 0 0 386.433 3.310 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCc2ccccc2[C@@H]1CO ZINC000185678127 1431203290 /nfs/dbraw/zinc/20/32/90/1431203290.db2.gz SRIWZNZUOKPQGN-INIZCTEOSA-N 0 0 380.322 3.346 20 5 GGBDRN C[C@H](C(=O)N1CCN([C@@H](C)c2nccs2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185677826 1431203413 /nfs/dbraw/zinc/20/34/13/1431203413.db2.gz CZVCMXDAIHZINI-STQMWFEESA-N 0 0 392.456 3.199 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCc2ccccc2[C@H]1CO ZINC000185678108 1431203515 /nfs/dbraw/zinc/20/35/15/1431203515.db2.gz SRIWZNZUOKPQGN-MRXNPFEDSA-N 0 0 380.322 3.346 20 5 GGBDRN C[C@@H](C(=O)N1CCN(c2ncccc2Cl)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185678761 1431204004 /nfs/dbraw/zinc/20/40/04/1431204004.db2.gz BADDYJYUIHNJEW-GFCCVEGCSA-N 0 0 392.818 3.235 20 5 GGBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2ccccc2[C@H]1CO ZINC000185685539 1431205383 /nfs/dbraw/zinc/20/53/83/1431205383.db2.gz ZVUZHWIXLMWURW-GOSISDBHSA-N 0 0 395.440 3.450 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCN(c2nccc(C(C)C)n2)CC1 ZINC000185688860 1431206793 /nfs/dbraw/zinc/20/67/93/1431206793.db2.gz OHHORUSWDQNXSB-UHFFFAOYSA-N 0 0 398.467 3.479 20 5 GGBDRN Cc1cc(C)cc(NC(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)c1 ZINC000185742047 1431220482 /nfs/dbraw/zinc/22/04/82/1431220482.db2.gz VFGAFUDIZIIOFL-UHFFFAOYSA-N 0 0 398.444 3.189 20 5 GGBDRN COc1cccc(C2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000185742335 1431221078 /nfs/dbraw/zinc/22/10/78/1431221078.db2.gz HXQUKYZIGXHMMI-UHFFFAOYSA-N 0 0 376.434 3.172 20 5 GGBDRN CCc1ccc(C(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)cc1 ZINC000185742979 1431221118 /nfs/dbraw/zinc/22/11/18/1431221118.db2.gz AKQQPLJRCQAXIN-UHFFFAOYSA-N 0 0 383.429 3.379 20 5 GGBDRN CCCN([C@@H](C)C(=O)Nc1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185743038 1431221266 /nfs/dbraw/zinc/22/12/66/1431221266.db2.gz DXQCAGCWFRQRBQ-AWEZNQCLSA-N 0 0 391.449 3.023 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC(=O)c1ccc(F)cc1F ZINC000185750495 1431223823 /nfs/dbraw/zinc/22/38/23/1431223823.db2.gz WCCKKAOZXIONJU-UHFFFAOYSA-N 0 0 391.355 3.095 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCc1nc(-c2ccccc2)no1 ZINC000185751153 1431224073 /nfs/dbraw/zinc/22/40/73/1431224073.db2.gz SXIDBGLOLYZSBG-UHFFFAOYSA-N 0 0 395.400 3.184 20 5 GGBDRN COc1c(C)cnc(CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)c1C ZINC000185762816 1431228169 /nfs/dbraw/zinc/22/81/69/1431228169.db2.gz QOMRQUXOQAIZAQ-UHFFFAOYSA-N 0 0 386.433 3.154 20 5 GGBDRN C[C@@H](Sc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C)C(=O)c1ccc(F)cc1 ZINC000185765992 1431229302 /nfs/dbraw/zinc/22/93/02/1431229302.db2.gz UPPCTEWCWGACAB-SNVBAGLBSA-N 0 0 387.392 3.344 20 5 GGBDRN CC(C)CCc1noc(CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)n1 ZINC000185767043 1431229389 /nfs/dbraw/zinc/22/93/89/1431229389.db2.gz JRFDKPZNOAUTBV-UHFFFAOYSA-N 0 0 389.437 3.106 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCCOc1ccccc1F ZINC000185772942 1431231216 /nfs/dbraw/zinc/23/12/16/1431231216.db2.gz UOWQBLZOSLGBGW-UHFFFAOYSA-N 0 0 375.381 3.152 20 5 GGBDRN C[C@H]1CO[C@@H](c2ccccc2Cl)CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185781935 1431234562 /nfs/dbraw/zinc/23/45/62/1431234562.db2.gz SKTZEXJHZBNQFJ-YVEFUNNKSA-N 0 0 396.852 3.399 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCc1cnn(-c2ccccc2)c1 ZINC000185785049 1431235199 /nfs/dbraw/zinc/23/51/99/1431235199.db2.gz BDLYUJRAIWFECT-UHFFFAOYSA-N 0 0 393.428 3.320 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCc1nnc(-c2ccccc2)o1 ZINC000185787704 1431235976 /nfs/dbraw/zinc/23/59/76/1431235976.db2.gz DQEOSCPPHGRHID-UHFFFAOYSA-N 0 0 395.400 3.184 20 5 GGBDRN CCS[C@H]1CC[C@H](N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185801984 1431239541 /nfs/dbraw/zinc/23/95/41/1431239541.db2.gz NKCHSPHISJDCMM-STQMWFEESA-N 0 0 395.506 3.438 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000185849515 1431251464 /nfs/dbraw/zinc/25/14/64/1431251464.db2.gz JKRDUDLWHHTFNS-RDTXWAMCSA-N 0 0 376.434 3.054 20 5 GGBDRN COc1cccc2c1CC[C@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185851884 1431252225 /nfs/dbraw/zinc/25/22/25/1431252225.db2.gz WOMBIYRURHVTJO-OAHLLOKOSA-N 0 0 399.428 3.117 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c2ncccc12 ZINC000185860899 1431254755 /nfs/dbraw/zinc/25/47/55/1431254755.db2.gz BWSUSSYYQFIQJE-FCEWJHQRSA-N 0 0 395.440 3.007 20 5 GGBDRN C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1nc(C2CCCCC2)no1 ZINC000185866042 1431256625 /nfs/dbraw/zinc/25/66/25/1431256625.db2.gz FJVSBXPTSPEXIJ-NSHDSACASA-N 0 0 380.426 3.065 20 5 GGBDRN Cn1nc(CCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c2ccccc21 ZINC000185875536 1431259190 /nfs/dbraw/zinc/25/91/90/1431259190.db2.gz QGBHXODWILKZFK-UHFFFAOYSA-N 0 0 393.447 3.398 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](c2cnn(C)c2)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000185896409 1431268890 /nfs/dbraw/zinc/26/88/90/1431268890.db2.gz XCBAUNPLBWJLBS-INIZCTEOSA-N 0 0 399.382 3.241 20 5 GGBDRN COC1(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCCCC1 ZINC000185906450 1431273545 /nfs/dbraw/zinc/27/35/45/1431273545.db2.gz LRUNPMUZAABNQO-UHFFFAOYSA-N 0 0 391.468 3.497 20 5 GGBDRN CSc1cccc(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1[N+](=O)[O-] ZINC000185919226 1431279016 /nfs/dbraw/zinc/27/90/16/1431279016.db2.gz TZJGUKXBHSKGBW-UHFFFAOYSA-N 0 0 398.444 3.367 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCC(O)(c2ccccc2)CC1 ZINC000185920660 1431279873 /nfs/dbraw/zinc/27/98/73/1431279873.db2.gz KAUMWNZSXUACNB-UHFFFAOYSA-N 0 0 395.459 3.319 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000185959038 1431297656 /nfs/dbraw/zinc/29/76/56/1431297656.db2.gz HUUNMRWZGIAUCB-QGZVFWFLSA-N 0 0 376.796 3.227 20 5 GGBDRN CN(Cc1cccc(OC(F)(F)F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185960873 1431298096 /nfs/dbraw/zinc/29/80/96/1431298096.db2.gz HQUOURNBLIQTNQ-UHFFFAOYSA-N 0 0 390.339 3.314 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000185964227 1431299866 /nfs/dbraw/zinc/29/98/66/1431299866.db2.gz XTFCEYVIZCNQNE-MRXNPFEDSA-N 0 0 386.795 3.338 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000185972351 1431301622 /nfs/dbraw/zinc/30/16/22/1431301622.db2.gz ZSBZQTFIMAFHLX-KRWDZBQOSA-N 0 0 376.796 3.471 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000185972371 1431301757 /nfs/dbraw/zinc/30/17/57/1431301757.db2.gz ZSBZQTFIMAFHLX-QGZVFWFLSA-N 0 0 376.796 3.471 20 5 GGBDRN COc1ccccc1[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000185975029 1431302741 /nfs/dbraw/zinc/30/27/41/1431302741.db2.gz WHWVHHUKZDOJFS-GOSISDBHSA-N 0 0 388.401 3.264 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3cccc(SC)c3[N+](=O)[O-])CC2)c1 ZINC000185977286 1431303241 /nfs/dbraw/zinc/30/32/41/1431303241.db2.gz LVCJJNCJHQMBQD-UHFFFAOYSA-N 0 0 387.461 3.288 20 5 GGBDRN CSc1cccc(C(=O)NCC2(N3CCOCC3)CCCCC2)c1[N+](=O)[O-] ZINC000185979447 1431304132 /nfs/dbraw/zinc/30/41/32/1431304132.db2.gz SCZFLNJFYBIWGC-UHFFFAOYSA-N 0 0 393.509 3.082 20 5 GGBDRN CSc1cccc(C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)c1[N+](=O)[O-] ZINC000185980039 1431304160 /nfs/dbraw/zinc/30/41/60/1431304160.db2.gz RKWNZMPKLIXFSP-UHFFFAOYSA-N 0 0 399.350 3.103 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000185994277 1431306931 /nfs/dbraw/zinc/30/69/31/1431306931.db2.gz JSXMGHYDOWBMRY-KBXCAEBGSA-N 0 0 376.434 3.041 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC(Oc3ccccc3Cl)CC2)c1 ZINC000185995656 1431307422 /nfs/dbraw/zinc/30/74/22/1431307422.db2.gz ZXOIMCFVNLJVBO-UHFFFAOYSA-N 0 0 396.852 3.480 20 5 GGBDRN CN(C[C@@H]1COc2ccccc2O1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186009150 1431310305 /nfs/dbraw/zinc/31/03/05/1431310305.db2.gz RIDBAZFJNZJXQT-CQSZACIVSA-N 0 0 391.811 3.230 20 5 GGBDRN COc1ccccc1[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000186009830 1431310834 /nfs/dbraw/zinc/31/08/34/1431310834.db2.gz CNVLXASBZYCKBU-LJQANCHMSA-N 0 0 399.428 3.066 20 5 GGBDRN C[C@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCN1CC(F)(F)F ZINC000186012241 1431311352 /nfs/dbraw/zinc/31/13/52/1431311352.db2.gz YUOHSBOEUIBJEP-JTQLQIEISA-N 0 0 394.781 3.026 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000186015325 1431312035 /nfs/dbraw/zinc/31/20/35/1431312035.db2.gz OEECPCFMBZHNPQ-SFHVURJKSA-N 0 0 387.392 3.197 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cccc(N2CCCNC2=O)c1 ZINC000186018385 1431312294 /nfs/dbraw/zinc/31/22/94/1431312294.db2.gz JMPOCLRCXQODDB-UHFFFAOYSA-N 0 0 388.811 3.098 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@@H](Cc2ccccc2)C1 ZINC000186019504 1431312793 /nfs/dbraw/zinc/31/27/93/1431312793.db2.gz SGIKEBBWQFKASX-KRWDZBQOSA-N 0 0 389.839 3.401 20 5 GGBDRN O=C(Nc1cccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1)NC1CC1 ZINC000186022721 1431313294 /nfs/dbraw/zinc/31/32/94/1431313294.db2.gz LRNCZUQFBCVWOH-UHFFFAOYSA-N 0 0 388.811 3.462 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)c(C)c1 ZINC000186026186 1431313554 /nfs/dbraw/zinc/31/35/54/1431313554.db2.gz VOHGFQANHKGCSW-HNNXBMFYSA-N 0 0 380.759 3.340 20 5 GGBDRN CSc1cccc(C(=O)N2CCC(NC(=O)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000186028333 1431314129 /nfs/dbraw/zinc/31/41/29/1431314129.db2.gz WULYVWPCYCGGPN-UHFFFAOYSA-N 0 0 399.472 3.351 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCO[C@@H](CCc2ccccc2)C1 ZINC000186071027 1431324284 /nfs/dbraw/zinc/32/42/84/1431324284.db2.gz PWISBXFDMORDDK-IBGZPJMESA-N 0 0 383.448 3.175 20 5 GGBDRN CCOc1cc(C(=O)NC[C@H](C)c2nc(C)cs2)c([N+](=O)[O-])cc1OC ZINC000186074662 1431325277 /nfs/dbraw/zinc/32/52/77/1431325277.db2.gz XLGLRARIFZOHTA-JTQLQIEISA-N 0 0 379.438 3.301 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCO[C@@H](CCc4ccccc4)C3)o2)cc1 ZINC000186074472 1431325314 /nfs/dbraw/zinc/32/53/14/1431325314.db2.gz QQXVKGXTQZEJNF-IBGZPJMESA-N 0 0 394.431 3.478 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1csc([N+](=O)[O-])c1 ZINC000186087503 1431327476 /nfs/dbraw/zinc/32/74/76/1431327476.db2.gz LSONEUBPARHNHI-NSHDSACASA-N 0 0 399.350 3.210 20 5 GGBDRN O=C(CCN1CCO[C@@H](CCc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000186092740 1431328798 /nfs/dbraw/zinc/32/87/98/1431328798.db2.gz YAYHYCOITNGDRK-SFHVURJKSA-N 0 0 383.448 3.257 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@H](CCc4ccccc4)C3)n2)cc1 ZINC000186092949 1431328930 /nfs/dbraw/zinc/32/89/30/1431328930.db2.gz QRGXONOJHXYMFY-LJQANCHMSA-N 0 0 394.431 3.478 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccc([N+](=O)[O-])s1 ZINC000186099774 1431329944 /nfs/dbraw/zinc/32/99/44/1431329944.db2.gz MFORKHGNPCHLMI-JTQLQIEISA-N 0 0 399.350 3.210 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000186133415 1431338025 /nfs/dbraw/zinc/33/80/25/1431338025.db2.gz CATQPRAFFNXBDV-UHFFFAOYSA-N 0 0 394.313 3.094 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000186184023 1431348350 /nfs/dbraw/zinc/34/83/50/1431348350.db2.gz IAZAKZAWRGLTPG-UONOGXRCSA-N 0 0 389.431 3.416 20 5 GGBDRN C[C@H](C(=O)N1CCC(c2nncn2C2CC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000186197878 1431350636 /nfs/dbraw/zinc/35/06/36/1431350636.db2.gz LSGIWTCLVFBBGZ-LBPRGKRZSA-N 0 0 387.415 3.170 20 5 GGBDRN C[C@@H](C(=O)N1CCC(c2nncn2C2CC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000186197894 1431351084 /nfs/dbraw/zinc/35/10/84/1431351084.db2.gz LSGIWTCLVFBBGZ-GFCCVEGCSA-N 0 0 387.415 3.170 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000186244831 1431361113 /nfs/dbraw/zinc/36/11/13/1431361113.db2.gz HETONVCSOFEENT-KRWDZBQOSA-N 0 0 377.347 3.156 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1cnn(Cc2ccccc2)c1 ZINC000186248416 1431361997 /nfs/dbraw/zinc/36/19/97/1431361997.db2.gz HGFGUNLQSRVHAI-CQSZACIVSA-N 0 0 395.419 3.287 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1cnn(Cc2ccccc2)c1 ZINC000186248402 1431362028 /nfs/dbraw/zinc/36/20/28/1431362028.db2.gz HGFGUNLQSRVHAI-AWEZNQCLSA-N 0 0 395.419 3.287 20 5 GGBDRN CCc1noc2ncc(S(=O)(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc12 ZINC000186253112 1431363606 /nfs/dbraw/zinc/36/36/06/1431363606.db2.gz XJTGNYRLRJNZBC-LLVKDONJSA-N 0 0 390.421 3.041 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186271086 1431367301 /nfs/dbraw/zinc/36/73/01/1431367301.db2.gz OPEKQUNIPWXCLM-UHFFFAOYSA-N 0 0 387.461 3.095 20 5 GGBDRN O=C(CCCc1ccc2c(c1)CC(=O)N2)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186311940 1431378900 /nfs/dbraw/zinc/37/89/00/1431378900.db2.gz WZPSJQJCNLJAQW-UHFFFAOYSA-N 0 0 387.823 3.382 20 5 GGBDRN CCCN(CC(=O)OC(C)(C)C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000186310496 1431379114 /nfs/dbraw/zinc/37/91/14/1431379114.db2.gz LSCANTKCEZWBSF-UHFFFAOYSA-N 0 0 376.413 3.199 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](C)c3cccc(O)c32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000186315360 1431380067 /nfs/dbraw/zinc/38/00/67/1431380067.db2.gz WFYVJRRJAFIAEE-LBPRGKRZSA-N 0 0 393.403 3.344 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000186316835 1431380456 /nfs/dbraw/zinc/38/04/56/1431380456.db2.gz RGDXWJPFWVNQPL-QGZVFWFLSA-N 0 0 394.786 3.366 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC(=O)Nc2cc(F)ccc21 ZINC000186322851 1431382283 /nfs/dbraw/zinc/38/22/83/1431382283.db2.gz MOOUHTPOSNCOCW-CYBMUJFWSA-N 0 0 377.759 3.130 20 5 GGBDRN CCCN(CC(=O)OC(C)(C)C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000186328911 1431384258 /nfs/dbraw/zinc/38/42/58/1431384258.db2.gz INEAYYJMLPPPSP-UHFFFAOYSA-N 0 0 376.413 3.199 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCN1C(=O)c1ccccc1 ZINC000186330859 1431384594 /nfs/dbraw/zinc/38/45/94/1431384594.db2.gz DQWSIGHNJPRLLR-KRWDZBQOSA-N 0 0 387.823 3.169 20 5 GGBDRN CC(C)C(=O)Nc1nc(CC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000186333489 1431385424 /nfs/dbraw/zinc/38/54/24/1431385424.db2.gz GIKJCCSDDSKBFH-UHFFFAOYSA-N 0 0 396.856 3.158 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCCc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000186335965 1431386283 /nfs/dbraw/zinc/38/62/83/1431386283.db2.gz LWHGAVJAPCAHAP-UHFFFAOYSA-N 0 0 384.360 3.023 20 5 GGBDRN O=C(CN1C(=O)CSc2ccccc21)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186336194 1431386364 /nfs/dbraw/zinc/38/63/64/1431386364.db2.gz ORPBELLFWOXBBB-UHFFFAOYSA-N 0 0 391.836 3.003 20 5 GGBDRN CCc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1S(C)(=O)=O ZINC000186338339 1431386720 /nfs/dbraw/zinc/38/67/20/1431386720.db2.gz UKNNKKXJCWLIME-UHFFFAOYSA-N 0 0 396.852 3.144 20 5 GGBDRN CCN(C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@@H](C)Cc1ccsc1 ZINC000186343491 1431387749 /nfs/dbraw/zinc/38/77/49/1431387749.db2.gz XDUGWTMJGZHWRJ-LBPRGKRZSA-N 0 0 389.433 3.044 20 5 GGBDRN COCCC1(CNC(=O)NCc2cc([N+](=O)[O-])ccc2OC)CCCCC1 ZINC000186341277 1431387813 /nfs/dbraw/zinc/38/78/13/1431387813.db2.gz JVCYUVDFCHMBKT-UHFFFAOYSA-N 0 0 379.457 3.390 20 5 GGBDRN CC(C)C[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)N1CCCCC1=O ZINC000186345871 1431388431 /nfs/dbraw/zinc/38/84/31/1431388431.db2.gz FJEIZHQNQAFAFE-MRXNPFEDSA-N 0 0 381.860 3.292 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 ZINC000186348304 1431388959 /nfs/dbraw/zinc/38/89/59/1431388959.db2.gz HRTUVEAFISIGDJ-CABCVRRESA-N 0 0 388.807 3.439 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2 ZINC000186348335 1431389068 /nfs/dbraw/zinc/38/90/68/1431389068.db2.gz HRTUVEAFISIGDJ-HUUCEWRRSA-N 0 0 388.807 3.439 20 5 GGBDRN CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186348783 1431389259 /nfs/dbraw/zinc/38/92/59/1431389259.db2.gz RPPWVPJGFGOPCJ-UHFFFAOYSA-N 0 0 396.852 3.144 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCCN1C(=O)c1ccco1 ZINC000186349955 1431389329 /nfs/dbraw/zinc/38/93/29/1431389329.db2.gz MNPYKXQEWCCRKR-HNNXBMFYSA-N 0 0 391.811 3.152 20 5 GGBDRN Cc1cc(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)ccc1[N+](=O)[O-] ZINC000186394078 1431399804 /nfs/dbraw/zinc/39/98/04/1431399804.db2.gz NIEAEKZXMGTIGN-UHFFFAOYSA-N 0 0 376.359 3.305 20 5 GGBDRN CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000186398411 1431400751 /nfs/dbraw/zinc/40/07/51/1431400751.db2.gz KEDPTQUXEFCMSO-KBXCAEBGSA-N 0 0 381.432 3.077 20 5 GGBDRN Cc1c(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)cccc1[N+](=O)[O-] ZINC000186407801 1431406073 /nfs/dbraw/zinc/40/60/73/1431406073.db2.gz DCUNUSLMONCEJV-UHFFFAOYSA-N 0 0 376.359 3.305 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CCN1Cc1ccccc1 ZINC000186413016 1431407995 /nfs/dbraw/zinc/40/79/95/1431407995.db2.gz DELFBNDMKZNHIE-GOSISDBHSA-N 0 0 383.448 3.340 20 5 GGBDRN Cc1cc(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)cc([N+](=O)[O-])c1 ZINC000186418326 1431411214 /nfs/dbraw/zinc/41/12/14/1431411214.db2.gz LNPNZGLGEPCNRQ-UHFFFAOYSA-N 0 0 376.359 3.305 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000186417466 1431411486 /nfs/dbraw/zinc/41/14/86/1431411486.db2.gz OLBIWIJUAJONGN-NSHDSACASA-N 0 0 383.832 3.235 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1 ZINC000186426571 1431415359 /nfs/dbraw/zinc/41/53/59/1431415359.db2.gz GOHFAPJIKLGRLQ-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN CCCNC(=O)C1(NC(=O)c2cccc(SC)c2[N+](=O)[O-])CCCCC1 ZINC000186446183 1431422120 /nfs/dbraw/zinc/42/21/20/1431422120.db2.gz KOEOEWVCUQIRDY-UHFFFAOYSA-N 0 0 379.482 3.276 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC[C@@H](C)C1 ZINC000186455342 1431423465 /nfs/dbraw/zinc/42/34/65/1431423465.db2.gz XBBVENWHNNQLLP-RHSMWYFYSA-N 0 0 393.509 3.095 20 5 GGBDRN CC(C)(C)OCc1cc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])no1 ZINC000186473031 1431429119 /nfs/dbraw/zinc/42/91/19/1431429119.db2.gz KHHUUSODCYYBMY-UHFFFAOYSA-N 0 0 388.424 3.402 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc(C(C)C)n1C ZINC000186496767 1431436506 /nfs/dbraw/zinc/43/65/06/1431436506.db2.gz KXDDEKIMBUJKOL-UHFFFAOYSA-N 0 0 377.470 3.277 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)cc1C ZINC000186506990 1431441108 /nfs/dbraw/zinc/44/11/08/1431441108.db2.gz AKNXGNVQUSWDGN-MLGOLLRUSA-N 0 0 375.450 3.378 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)OC(C)C ZINC000186523641 1431445814 /nfs/dbraw/zinc/44/58/14/1431445814.db2.gz YDYOFWCCCKNCTB-QGZVFWFLSA-N 0 0 391.399 3.221 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)OC(C)C ZINC000186531398 1431447466 /nfs/dbraw/zinc/44/74/66/1431447466.db2.gz MBYHYVKCOBPOGQ-GOSISDBHSA-N 0 0 398.419 3.376 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2C[C@H](OCc3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000186539965 1431449237 /nfs/dbraw/zinc/44/92/37/1431449237.db2.gz KRJTYKDIQZVEGZ-HOTGVXAUSA-N 0 0 386.452 3.384 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])c1 ZINC000186537931 1431449283 /nfs/dbraw/zinc/44/92/83/1431449283.db2.gz OGZLPJUIQLLMAU-UHFFFAOYSA-N 0 0 384.421 3.242 20 5 GGBDRN CSc1cccc(C(=O)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)c1[N+](=O)[O-] ZINC000186592649 1431463026 /nfs/dbraw/zinc/46/30/26/1431463026.db2.gz LENSHJIQANDFKF-DOMZBBRYSA-N 0 0 385.445 3.241 20 5 GGBDRN Cn1cc(CCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)c2ccc(F)cc21 ZINC000186598448 1431464885 /nfs/dbraw/zinc/46/48/85/1431464885.db2.gz DKKONVPMIMRDCL-UHFFFAOYSA-N 0 0 381.367 3.074 20 5 GGBDRN O=C(NCCC[C@@H]1CCCCO1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000186640724 1431477724 /nfs/dbraw/zinc/47/77/24/1431477724.db2.gz NQGKRQIBOIXWBJ-KRWDZBQOSA-N 0 0 391.468 3.497 20 5 GGBDRN CCOC(=O)c1cc(NCC2CCN(CC(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000186642841 1431478481 /nfs/dbraw/zinc/47/84/81/1431478481.db2.gz SCAPMPAXCGYLBD-UHFFFAOYSA-N 0 0 389.374 3.458 20 5 GGBDRN C[C@H](C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1cn(C)c2ccccc12 ZINC000186649620 1431480211 /nfs/dbraw/zinc/48/02/11/1431480211.db2.gz SJOBWIVAAIDIMO-LSDHHAIUSA-N 0 0 393.447 3.298 20 5 GGBDRN C[C@@H](C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1cn(C)c2ccccc12 ZINC000186649598 1431480352 /nfs/dbraw/zinc/48/03/52/1431480352.db2.gz SJOBWIVAAIDIMO-CABCVRRESA-N 0 0 393.447 3.298 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1nc(COc2ccccc2)n[nH]1 ZINC000186672701 1431487650 /nfs/dbraw/zinc/48/76/50/1431487650.db2.gz JEOPMORZZOKVDM-UHFFFAOYSA-N 0 0 395.419 3.147 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCN(C2CC2)c2ccc(F)cc21 ZINC000186671388 1431487917 /nfs/dbraw/zinc/48/79/17/1431487917.db2.gz HNWXMVWNRCFNPI-UHFFFAOYSA-N 0 0 391.424 3.053 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186676799 1431489431 /nfs/dbraw/zinc/48/94/31/1431489431.db2.gz FXOXBGFJHPIRCR-SPLOXXLWSA-N 0 0 397.431 3.062 20 5 GGBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000186683782 1431491432 /nfs/dbraw/zinc/49/14/32/1431491432.db2.gz LBIMVJRVZWCFGR-HOCLYGCPSA-N 0 0 396.230 3.214 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@]4(C3)OCc3ccccc34)n2)cc1 ZINC000186697070 1431494609 /nfs/dbraw/zinc/49/46/09/1431494609.db2.gz XTVAKYBLBTXARL-HXUWFJFHSA-N 0 0 378.388 3.276 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000186724502 1431502294 /nfs/dbraw/zinc/50/22/94/1431502294.db2.gz DONHBIYVJNLNKL-UHFFFAOYSA-N 0 0 381.310 3.127 20 5 GGBDRN Cc1cc(OCC(=O)NC[C@@H]2CCN(c3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000186728554 1431503215 /nfs/dbraw/zinc/50/32/15/1431503215.db2.gz GRBNTUHYBJQGJS-HNNXBMFYSA-N 0 0 387.411 3.064 20 5 GGBDRN Cc1cccc(NC(=O)NC(=O)COc2cc(C)c([N+](=O)[O-])cc2F)c1C ZINC000186731286 1431504165 /nfs/dbraw/zinc/50/41/65/1431504165.db2.gz QHYSEZYKBMIXSB-UHFFFAOYSA-N 0 0 375.356 3.386 20 5 GGBDRN CC(C)(C)c1cnc(CCC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)o1 ZINC000186770491 1431512481 /nfs/dbraw/zinc/51/24/81/1431512481.db2.gz QMIOZTTYRUPNCU-UHFFFAOYSA-N 0 0 386.452 3.162 20 5 GGBDRN CSc1cccc(C(=O)N[C@@H]2CCCn3nc(C(C)C)nc32)c1[N+](=O)[O-] ZINC000186784201 1431515934 /nfs/dbraw/zinc/51/59/34/1431515934.db2.gz RPLZHRAFLNKUBL-GFCCVEGCSA-N 0 0 375.454 3.297 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000186784511 1431516152 /nfs/dbraw/zinc/51/61/52/1431516152.db2.gz RGWISMWOFQFRHM-BMIGLBTASA-N 0 0 391.346 3.209 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(Cn2cccn2)cc1 ZINC000186786808 1431516362 /nfs/dbraw/zinc/51/63/62/1431516362.db2.gz HCZKNXBWEWYQSH-UHFFFAOYSA-N 0 0 381.392 3.170 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000186791302 1431517578 /nfs/dbraw/zinc/51/75/78/1431517578.db2.gz NXQCAJXHSWKXDX-KRWDZBQOSA-N 0 0 393.346 3.487 20 5 GGBDRN COc1cc(C)c(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1F ZINC000186804670 1431521814 /nfs/dbraw/zinc/52/18/14/1431521814.db2.gz XOLAJZKXVFZGQR-UHFFFAOYSA-N 0 0 388.399 3.405 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCN(C2CC2)c2ccccc21 ZINC000186813937 1431525148 /nfs/dbraw/zinc/52/51/48/1431525148.db2.gz NOBCGWVWOJIPAF-UHFFFAOYSA-N 0 0 389.415 3.410 20 5 GGBDRN C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCc1cc(COC(C)(C)C)on1 ZINC000186822930 1431528626 /nfs/dbraw/zinc/52/86/26/1431528626.db2.gz AGAGSKVKZJOILJ-ZDUSSCGKSA-N 0 0 390.440 3.405 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCSC2(CCOCC2)C1 ZINC000186838612 1431534263 /nfs/dbraw/zinc/53/42/63/1431534263.db2.gz RMEGHEZGZYGUSX-UHFFFAOYSA-N 0 0 390.383 3.352 20 5 GGBDRN CCc1c(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cnn1-c1ccccc1OC ZINC000186842364 1431536225 /nfs/dbraw/zinc/53/62/25/1431536225.db2.gz FFFGDLHBXSUDTM-UHFFFAOYSA-N 0 0 381.392 3.307 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC2(CCOCC2)C1 ZINC000186847923 1431538619 /nfs/dbraw/zinc/53/86/19/1431538619.db2.gz KXESXPPXLUAKRY-INIZCTEOSA-N 0 0 378.494 3.288 20 5 GGBDRN Nc1ccc(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000186864622 1431545644 /nfs/dbraw/zinc/54/56/44/1431545644.db2.gz URGDPKYDIJXYDR-NSHDSACASA-N 0 0 391.811 3.498 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000186874250 1431550154 /nfs/dbraw/zinc/55/01/54/1431550154.db2.gz ZWEJLWKIFMXAJS-SFHVURJKSA-N 0 0 392.358 3.242 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C(=O)OC)c1ccsc1 ZINC000186916431 1431564628 /nfs/dbraw/zinc/56/46/28/1431564628.db2.gz GFVDRBYVTVKIBX-BBRMVZONSA-N 0 0 376.434 3.256 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)CCNc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000186953515 1431575476 /nfs/dbraw/zinc/57/54/76/1431575476.db2.gz NVUGMCYSXMZXFY-UHFFFAOYSA-N 0 0 395.419 3.289 20 5 GGBDRN Cc1c(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000186997814 1431585946 /nfs/dbraw/zinc/58/59/46/1431585946.db2.gz CBIKHAPWPUUOBI-HXUWFJFHSA-N 0 0 397.387 3.391 20 5 GGBDRN CSc1cccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000186999111 1431586358 /nfs/dbraw/zinc/58/63/58/1431586358.db2.gz GIFSVRQIMUSTOZ-UHFFFAOYSA-N 0 0 391.415 3.321 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@@H](C(N)=O)C1 ZINC000187006173 1431587449 /nfs/dbraw/zinc/58/74/49/1431587449.db2.gz LGULVAOQCNBFCM-FZKQIMNGSA-N 0 0 382.420 3.064 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@@H](C(N)=O)C1 ZINC000187006193 1431587615 /nfs/dbraw/zinc/58/76/15/1431587615.db2.gz LGULVAOQCNBFCM-SCLBCKFNSA-N 0 0 382.420 3.064 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCSC[C@H]3c3nccs3)o2)cc1 ZINC000187021686 1431592410 /nfs/dbraw/zinc/59/24/10/1431592410.db2.gz CADNZYQLYJFXBX-ZDUSSCGKSA-N 0 0 389.462 3.391 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1cc(C)cc(C)c1 ZINC000187026067 1431593944 /nfs/dbraw/zinc/59/39/44/1431593944.db2.gz XMWBRCVPXOWWCY-FZKQIMNGSA-N 0 0 388.395 3.485 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1cc(C)cc(C)c1 ZINC000187026017 1431593948 /nfs/dbraw/zinc/59/39/48/1431593948.db2.gz XMWBRCVPXOWWCY-UGSOOPFHSA-N 0 0 388.395 3.485 20 5 GGBDRN Cc1c(NC(=O)CCN2CCSC[C@@H]2c2nccs2)cccc1[N+](=O)[O-] ZINC000187027638 1431594540 /nfs/dbraw/zinc/59/45/40/1431594540.db2.gz ZXTINIINDFJBAY-OAHLLOKOSA-N 0 0 392.506 3.478 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCCC[C@H]3O)cc2[N+](=O)[O-])C1 ZINC000187036565 1431596583 /nfs/dbraw/zinc/59/65/83/1431596583.db2.gz NNCKTIDIKWJYQY-QRCPMIHRSA-N 0 0 375.469 3.110 20 5 GGBDRN CCOc1ccc2c(c1)[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])CCO2 ZINC000187036381 1431596716 /nfs/dbraw/zinc/59/67/16/1431596716.db2.gz QEBPEJDERHQMBQ-INIZCTEOSA-N 0 0 385.420 3.436 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCSC[C@@H]1c1nccs1 ZINC000187035350 1431596733 /nfs/dbraw/zinc/59/67/33/1431596733.db2.gz VIRUBBAWGXUCNL-OAHLLOKOSA-N 0 0 392.506 3.478 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2nc(-c3ccccc3F)no2)cccc1[N+](=O)[O-] ZINC000187036706 1431597071 /nfs/dbraw/zinc/59/70/71/1431597071.db2.gz DLFICVGNPBRKOE-UHFFFAOYSA-N 0 0 391.380 3.207 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000187038903 1431597578 /nfs/dbraw/zinc/59/75/78/1431597578.db2.gz YPQSRHIMFVWLLB-LJQANCHMSA-N 0 0 389.411 3.227 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000187055413 1431600750 /nfs/dbraw/zinc/60/07/50/1431600750.db2.gz GLUXRWZWGNDAAC-BLLLJJGKSA-N 0 0 392.843 3.132 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000187055449 1431601025 /nfs/dbraw/zinc/60/10/25/1431601025.db2.gz GLUXRWZWGNDAAC-MLGOLLRUSA-N 0 0 392.843 3.132 20 5 GGBDRN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187060740 1431602883 /nfs/dbraw/zinc/60/28/83/1431602883.db2.gz GGBISOLQGBYTTR-OAHLLOKOSA-N 0 0 381.392 3.042 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187060723 1431602940 /nfs/dbraw/zinc/60/29/40/1431602940.db2.gz GGBISOLQGBYTTR-HNNXBMFYSA-N 0 0 381.392 3.042 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCSC[C@H]1c1nccs1 ZINC000187063678 1431603543 /nfs/dbraw/zinc/60/35/43/1431603543.db2.gz ZXAZONDCUYNWBQ-HNNXBMFYSA-N 0 0 392.506 3.478 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-])c1ccccn1 ZINC000187065533 1431604039 /nfs/dbraw/zinc/60/40/39/1431604039.db2.gz KTOJEUGWRWZWKE-BOFPYLFWSA-N 0 0 384.436 3.196 20 5 GGBDRN CC[C@@]1(CO)CCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000187085481 1431609717 /nfs/dbraw/zinc/60/97/17/1431609717.db2.gz ZFTIXLIXMJWEGP-GOSISDBHSA-N 0 0 375.450 3.343 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1 ZINC000187163077 1431634897 /nfs/dbraw/zinc/63/48/97/1431634897.db2.gz IXKKSRDGFAEMBP-HNNXBMFYSA-N 0 0 397.428 3.299 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000187170614 1431636800 /nfs/dbraw/zinc/63/68/00/1431636800.db2.gz UXRMHQAGZJNYNY-UHFFFAOYSA-N 0 0 385.420 3.485 20 5 GGBDRN CCS(=O)(=O)c1c(Cl)cccc1CNCc1cc([N+](=O)[O-])ccc1OC ZINC000187206047 1431647515 /nfs/dbraw/zinc/64/75/15/1431647515.db2.gz NQLXIUDTAZFLMJ-UHFFFAOYSA-N 0 0 398.868 3.340 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCCc3cccc(F)c32)cc1[N+](=O)[O-] ZINC000187232507 1431658608 /nfs/dbraw/zinc/65/86/08/1431658608.db2.gz LTJRTJDKXFAJTC-UHFFFAOYSA-N 0 0 384.360 3.023 20 5 GGBDRN COc1ccc(OCCN2CCO[C@@H](c3ccc(F)cc3F)C2)c([N+](=O)[O-])c1 ZINC000187241459 1431661702 /nfs/dbraw/zinc/66/17/02/1431661702.db2.gz LVKFOJWQAFVGON-LJQANCHMSA-N 0 0 394.374 3.334 20 5 GGBDRN COc1ccc(OCCN2CCO[C@H](c3ccc(F)cc3F)C2)c([N+](=O)[O-])c1 ZINC000187241434 1431661842 /nfs/dbraw/zinc/66/18/42/1431661842.db2.gz LVKFOJWQAFVGON-IBGZPJMESA-N 0 0 394.374 3.334 20 5 GGBDRN CC(C)[C@@H]1CCC[C@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000187271917 1431676402 /nfs/dbraw/zinc/67/64/02/1431676402.db2.gz CBTKCTQZFXLPJV-HIFRSBDPSA-N 0 0 382.482 3.333 20 5 GGBDRN CC(C)[C@H]1CCC[C@@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000187271975 1431676677 /nfs/dbraw/zinc/67/66/77/1431676677.db2.gz CBTKCTQZFXLPJV-DZGCQCFKSA-N 0 0 382.482 3.333 20 5 GGBDRN CC(C)[C@@H]1CCC[C@@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000187271957 1431676797 /nfs/dbraw/zinc/67/67/97/1431676797.db2.gz CBTKCTQZFXLPJV-UKRRQHHQSA-N 0 0 382.482 3.333 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CC[C@@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000187278581 1431678824 /nfs/dbraw/zinc/67/88/24/1431678824.db2.gz DNYGNNMMKZHLOY-LLVKDONJSA-N 0 0 380.397 3.445 20 5 GGBDRN CC1(C)[C@H](OCc2ccccc2)C[C@@H]1NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000187305382 1431689056 /nfs/dbraw/zinc/68/90/56/1431689056.db2.gz QECUQLAYHIVFAS-ZWKOTPCHSA-N 0 0 397.431 3.033 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCCO1 ZINC000187310747 1431691282 /nfs/dbraw/zinc/69/12/82/1431691282.db2.gz DBWNUUZVDMOZQH-LBPRGKRZSA-N 0 0 394.815 3.182 20 5 GGBDRN Cc1ccc(SC[C@@H](C)NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000187315452 1431694104 /nfs/dbraw/zinc/69/41/04/1431694104.db2.gz HXVGYSLORIIPDQ-CQSZACIVSA-N 0 0 387.461 3.447 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000187314919 1431694142 /nfs/dbraw/zinc/69/41/42/1431694142.db2.gz HSKOGHRZOLTYPN-UHFFFAOYSA-N 0 0 375.812 3.203 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC1CCC(O)(c2cccnc2)CC1 ZINC000187326209 1431697740 /nfs/dbraw/zinc/69/77/40/1431697740.db2.gz DDFMRUAWZBGFAR-UHFFFAOYSA-N 0 0 389.839 3.132 20 5 GGBDRN CC(C)c1ccc(C(=O)NCc2cccc(OCC(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000187326241 1431697766 /nfs/dbraw/zinc/69/77/66/1431697766.db2.gz IQLCJHSZRCDBMC-UHFFFAOYSA-N 0 0 399.447 3.115 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@](C)(CC(=O)OC)c1ccncc1 ZINC000187340221 1431702228 /nfs/dbraw/zinc/70/22/28/1431702228.db2.gz PNQYLXJTWJPNDE-HRAATJIYSA-N 0 0 399.447 3.153 20 5 GGBDRN CC(C)(NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1F ZINC000187345129 1431704180 /nfs/dbraw/zinc/70/41/80/1431704180.db2.gz GCONVDYRIIYUEC-UHFFFAOYSA-N 0 0 393.802 3.169 20 5 GGBDRN CCN(C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)[C@H](C)Cc1ccsc1 ZINC000187363454 1431708719 /nfs/dbraw/zinc/70/87/19/1431708719.db2.gz FVZGKWKOYOIUJL-KGLIPLIRSA-N 0 0 389.477 3.254 20 5 GGBDRN Cn1cc([C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000187394432 1431718063 /nfs/dbraw/zinc/71/80/63/1431718063.db2.gz QXKRLLMUQVDKAI-SFHVURJKSA-N 0 0 383.383 3.056 20 5 GGBDRN Cn1cc([C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)cn1 ZINC000187451348 1431734088 /nfs/dbraw/zinc/73/40/88/1431734088.db2.gz GFDYVYSOOBYSLG-GOSISDBHSA-N 0 0 383.383 3.056 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000187468056 1431740112 /nfs/dbraw/zinc/74/01/12/1431740112.db2.gz OUDKJUAJDSBRBL-CYBMUJFWSA-N 0 0 399.357 3.083 20 5 GGBDRN COCCC1(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CCCCC1 ZINC000187469759 1431741030 /nfs/dbraw/zinc/74/10/30/1431741030.db2.gz QQHSDWHMEBDLNI-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN COCCC1(CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CCCCC1 ZINC000187475385 1431742919 /nfs/dbraw/zinc/74/29/19/1431742919.db2.gz PQWXBIIZRDGPHS-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN COc1ccc(Cn2ccc(N[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000187519086 1431754815 /nfs/dbraw/zinc/75/48/15/1431754815.db2.gz NHZRWUHFQSUIFP-AWEZNQCLSA-N 0 0 395.419 3.287 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C)CC1(c2ccccc2)CC1 ZINC000187533016 1431758976 /nfs/dbraw/zinc/75/89/76/1431758976.db2.gz YPSUSRWPODEARN-UHFFFAOYSA-N 0 0 381.432 3.340 20 5 GGBDRN O=C(NC1(Cc2cccc(F)c2)CCC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000187553770 1431764742 /nfs/dbraw/zinc/76/47/42/1431764742.db2.gz NWWMCGPZWIDWAI-UHFFFAOYSA-N 0 0 395.390 3.471 20 5 GGBDRN Cc1ccc2c(CCNC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)cn(C)c2c1 ZINC000187613906 1431779134 /nfs/dbraw/zinc/77/91/34/1431779134.db2.gz YSTMQWKOXMYELB-UHFFFAOYSA-N 0 0 394.431 3.001 20 5 GGBDRN Cc1oc2ccc(NC(=O)C(=O)NCCc3ccc([N+](=O)[O-])cc3)cc2c1C ZINC000187669987 1431795726 /nfs/dbraw/zinc/79/57/26/1431795726.db2.gz NVYLCVMUOXHPBV-UHFFFAOYSA-N 0 0 381.388 3.255 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000187676512 1431798070 /nfs/dbraw/zinc/79/80/70/1431798070.db2.gz KIVDJDVTJWFTHJ-NHYWBVRUSA-N 0 0 394.777 3.391 20 5 GGBDRN COC(=O)c1cc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000187681035 1431798195 /nfs/dbraw/zinc/79/81/95/1431798195.db2.gz UZASSQQBBDHKBF-HNNXBMFYSA-N 0 0 396.321 3.457 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000187686873 1431800117 /nfs/dbraw/zinc/80/01/17/1431800117.db2.gz IIBZVAZAOVCGKY-ABAIWWIYSA-N 0 0 392.399 3.287 20 5 GGBDRN O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000187686723 1431800145 /nfs/dbraw/zinc/80/01/45/1431800145.db2.gz WFQJRMLZAAGWRL-GFCCVEGCSA-N 0 0 382.294 3.399 20 5 GGBDRN COC(=O)COc1ccc(CN(C)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000187737785 1431806136 /nfs/dbraw/zinc/80/61/36/1431806136.db2.gz NAEAQURQGGAFGL-UHFFFAOYSA-N 0 0 378.812 3.432 20 5 GGBDRN Cc1cc(C(=O)Nc2ncc(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)s2)co1 ZINC000187756918 1431809023 /nfs/dbraw/zinc/80/90/23/1431809023.db2.gz ZDLZFCFYXIYXFT-UHFFFAOYSA-N 0 0 393.402 3.038 20 5 GGBDRN C[C@@H](Nc1ccc(OC2COC2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000187766433 1431809909 /nfs/dbraw/zinc/80/99/09/1431809909.db2.gz VPORDMCRZYQMFG-LLVKDONJSA-N 0 0 391.811 3.465 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)[C@@H]2CCCC[C@H]2S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000187770759 1431810376 /nfs/dbraw/zinc/81/03/76/1431810376.db2.gz OFFUZJMCOAQPLL-NVXWUHKLSA-N 0 0 382.482 3.146 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)NCc2c(C)oc3ccccc32)cc1[N+](=O)[O-] ZINC000187783140 1431811892 /nfs/dbraw/zinc/81/18/92/1431811892.db2.gz KSWOMMRSDXQXCM-UHFFFAOYSA-N 0 0 394.380 3.276 20 5 GGBDRN CC(C)c1ccc(C(=O)NCc2ccccc2CS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000187827742 1431817078 /nfs/dbraw/zinc/81/70/78/1431817078.db2.gz RCURQHJDHLCPPO-UHFFFAOYSA-N 0 0 390.461 3.193 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC(c2ccsc2)CC1 ZINC000187839043 1431818617 /nfs/dbraw/zinc/81/86/17/1431818617.db2.gz LTFFPKRIHATECY-ZDUSSCGKSA-N 0 0 387.461 3.181 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC(c2ccsc2)CC1 ZINC000187839073 1431818666 /nfs/dbraw/zinc/81/86/66/1431818666.db2.gz LTFFPKRIHATECY-CYBMUJFWSA-N 0 0 387.461 3.181 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3noc(-c4ccc(F)cc4F)n3)n2)c1 ZINC000187846952 1431819586 /nfs/dbraw/zinc/81/95/86/1431819586.db2.gz WWEJNIKENKSUGO-UHFFFAOYSA-N 0 0 384.302 3.230 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC1(c2ccc(F)cc2F)CCCC1 ZINC000187857794 1431820854 /nfs/dbraw/zinc/82/08/54/1431820854.db2.gz LXUVQHZTXAWEMD-UHFFFAOYSA-N 0 0 392.406 3.396 20 5 GGBDRN CCCN1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1=O ZINC000187888066 1431824329 /nfs/dbraw/zinc/82/43/29/1431824329.db2.gz KKDXVQXXEXKYOJ-UHFFFAOYSA-N 0 0 386.452 3.125 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@H](CCO)c3ccco3)cc2[N+](=O)[O-])CC1 ZINC000187907740 1431826175 /nfs/dbraw/zinc/82/61/75/1431826175.db2.gz CSYWTQNSBDJZRA-MRXNPFEDSA-N 0 0 387.436 3.278 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@]1(C)Cc1ccccc1 ZINC000187960732 1431831675 /nfs/dbraw/zinc/83/16/75/1431831675.db2.gz YPXSJDVWOYKTSG-OAQYLSRUSA-N 0 0 397.431 3.166 20 5 GGBDRN CCN(C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)Cc1ccsc1 ZINC000188037114 1431838548 /nfs/dbraw/zinc/83/85/48/1431838548.db2.gz QMVSJHOAGJYZTQ-ZDUSSCGKSA-N 0 0 375.450 3.383 20 5 GGBDRN CCN(C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)Cc1ccsc1 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COC[C@H](Cc1ccccc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000188371297 1431878328 /nfs/dbraw/zinc/87/83/28/1431878328.db2.gz SIIXAOJAQQNFHB-HNNXBMFYSA-N 0 0 398.868 3.126 20 5 GGBDRN COc1ccc(C(=O)NCCNc2ccccc2[N+](=O)[O-])c(OC(F)F)c1 ZINC000188375365 1431878560 /nfs/dbraw/zinc/87/85/60/1431878560.db2.gz KDBTYKQHBQFTMM-UHFFFAOYSA-N 0 0 381.335 3.047 20 5 GGBDRN COc1cc(C(=O)NC2(c3cccc(F)c3)CCOCC2)cc([N+](=O)[O-])c1C ZINC000188434763 1431883954 /nfs/dbraw/zinc/88/39/54/1431883954.db2.gz ANXCRZQYJVNCQO-UHFFFAOYSA-N 0 0 388.395 3.487 20 5 GGBDRN C[C@H](NC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000188442557 1431884300 /nfs/dbraw/zinc/88/43/00/1431884300.db2.gz UGGGROVWJVUJCH-MEDUHNTESA-N 0 0 382.338 3.394 20 5 GGBDRN O=C(NCCc1nc(C2CCCCC2)cs1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000188470087 1431886730 /nfs/dbraw/zinc/88/67/30/1431886730.db2.gz DSPUIPNJYHAJKP-UHFFFAOYSA-N 0 0 376.438 3.172 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 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ZINC000189436419 1432110394 /nfs/dbraw/zinc/11/03/94/1432110394.db2.gz PBTJMRDPQBYSNM-KRWDZBQOSA-N 0 0 375.469 3.306 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c(C)c1 ZINC000189436969 1432111185 /nfs/dbraw/zinc/11/11/85/1432111185.db2.gz MPSRFKHXUCWUKK-UHFFFAOYSA-N 0 0 395.419 3.203 20 5 GGBDRN COc1cc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)ccc1F ZINC000189439422 1432111467 /nfs/dbraw/zinc/11/14/67/1432111467.db2.gz GMAYPMBDPXVTCO-UHFFFAOYSA-N 0 0 389.339 3.069 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000189444956 1432113839 /nfs/dbraw/zinc/11/38/39/1432113839.db2.gz MQGVXLUPPUELJC-YOEHRIQHSA-N 0 0 387.440 3.470 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCSC[C@H]2c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000189465793 1432122180 /nfs/dbraw/zinc/12/21/80/1432122180.db2.gz WMNDXMVWOSLUTR-GUYCJALGSA-N 0 0 389.481 3.197 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1OC[C@H]1CCCCO1 ZINC000189469557 1432123654 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GGBDRN CCOC(=O)c1ccnc(NC[C@@](C)(Cc2ccccc2)[C@H](C)O)c1[N+](=O)[O-] ZINC000189652178 1432191697 /nfs/dbraw/zinc/19/16/97/1432191697.db2.gz MMRMUTDXCYENLS-VBKZILBWSA-N 0 0 387.436 3.208 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)CCc3cccs3)CC2)cc1 ZINC000189674772 1432199750 /nfs/dbraw/zinc/19/97/50/1432199750.db2.gz BHYUXPGXFOZJQF-UHFFFAOYSA-N 0 0 396.490 3.072 20 5 GGBDRN COC(=O)CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000189679167 1432201322 /nfs/dbraw/zinc/20/13/22/1432201322.db2.gz CHJOWNHDWWOTBX-UHFFFAOYSA-N 0 0 396.321 3.429 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000189680603 1432202082 /nfs/dbraw/zinc/20/20/82/1432202082.db2.gz HDORRCZLLNPDRK-SFHVURJKSA-N 0 0 394.435 3.325 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000189696162 1432206738 /nfs/dbraw/zinc/20/67/38/1432206738.db2.gz YTBQNCTZCIBGCV-OAHLLOKOSA-N 0 0 380.408 3.086 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000189696182 1432206843 /nfs/dbraw/zinc/20/68/43/1432206843.db2.gz YTBQNCTZCIBGCV-HNNXBMFYSA-N 0 0 380.408 3.086 20 5 GGBDRN CC(C)(Cc1ccc(C(F)(F)F)cc1)NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000189695362 1432206850 /nfs/dbraw/zinc/20/68/50/1432206850.db2.gz FTQKMWFEEFGNKC-UHFFFAOYSA-N 0 0 384.358 3.338 20 5 GGBDRN O=C([C@@H](O)Cc1cccc(C(F)(F)F)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000189718194 1432213475 /nfs/dbraw/zinc/21/34/75/1432213475.db2.gz REAREXLCIHLANR-INIZCTEOSA-N 0 0 380.322 3.106 20 5 GGBDRN CN(CCCCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1 ZINC000189721779 1432214934 /nfs/dbraw/zinc/21/49/34/1432214934.db2.gz CVSCPMYMCOLOSE-UHFFFAOYSA-N 0 0 377.466 3.327 20 5 GGBDRN C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)COCc1ccccc1 ZINC000189723873 1432215658 /nfs/dbraw/zinc/21/56/58/1432215658.db2.gz YJAAOGSSQGGPEQ-AWEZNQCLSA-N 0 0 378.450 3.263 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@]3(CCc4ccccc43)C2)cc([N+](=O)[O-])c1C ZINC000189738007 1432219530 /nfs/dbraw/zinc/21/95/30/1432219530.db2.gz AQADUQGKQUPGHB-OAQYLSRUSA-N 0 0 382.416 3.226 20 5 GGBDRN O=C(NCc1coc(-c2ccccc2)n1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000189764440 1432228454 /nfs/dbraw/zinc/22/84/54/1432228454.db2.gz SJUKAYCGOFINQT-UHFFFAOYSA-N 0 0 394.387 3.223 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCC2N=NC(=S)N2C(C)C)cc1[N+](=O)[O-] ZINC000189773533 1432231709 /nfs/dbraw/zinc/23/17/09/1432231709.db2.gz YKCPRKGQGAJYCV-UHFFFAOYSA-N 0 0 377.470 3.152 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)on1 ZINC000189780160 1432233122 /nfs/dbraw/zinc/23/31/22/1432233122.db2.gz HWGBKGBQTDSJEC-UHFFFAOYSA-N 0 0 388.424 3.459 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c1 ZINC000189830920 1432247192 /nfs/dbraw/zinc/24/71/92/1432247192.db2.gz XKDHZPLFNHSBCV-ZDUSSCGKSA-N 0 0 391.449 3.210 20 5 GGBDRN COc1cc(C(=O)NCc2cccc(Cn3cccn3)c2)cc([N+](=O)[O-])c1C ZINC000189830773 1432247219 /nfs/dbraw/zinc/24/72/19/1432247219.db2.gz KDZKPKJVEWEICT-UHFFFAOYSA-N 0 0 380.404 3.087 20 5 GGBDRN Cc1nn(CCC(=O)N2C[C@H](C)Oc3c(Cl)cccc32)c(C)c1[N+](=O)[O-] ZINC000189832108 1432247895 /nfs/dbraw/zinc/24/78/95/1432247895.db2.gz ILBVWSKCIZBMFI-JTQLQIEISA-N 0 0 378.816 3.266 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ccc(Cl)c(F)c2)C1=O ZINC000189835532 1432248945 /nfs/dbraw/zinc/24/89/45/1432248945.db2.gz LHJGAEBNPZMMMC-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2cccc(Cl)c2O1 ZINC000189839290 1432250052 /nfs/dbraw/zinc/25/00/52/1432250052.db2.gz HKDWCIQOTZVLQO-LLVKDONJSA-N 0 0 399.794 3.257 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)NCc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000189846436 1432251814 /nfs/dbraw/zinc/25/18/14/1432251814.db2.gz FHSCMQGNZQIIFV-UHFFFAOYSA-N 0 0 381.392 3.170 20 5 GGBDRN CC(C)[C@@H](CNC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)c1cccnc1 ZINC000189879411 1432260759 /nfs/dbraw/zinc/26/07/59/1432260759.db2.gz VQSHDLXAQHFNBH-LJQANCHMSA-N 0 0 384.436 3.202 20 5 GGBDRN COc1c(C)cnc(CN(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c1C ZINC000189920026 1432274226 /nfs/dbraw/zinc/27/42/26/1432274226.db2.gz JADKMNUBZXSXSK-UHFFFAOYSA-N 0 0 393.465 3.053 20 5 GGBDRN COc1ccc([C@@H]2CCN(S(=O)(=O)c3c(C)ccc(C)c3[N+](=O)[O-])C2)cc1 ZINC000189926788 1432277171 /nfs/dbraw/zinc/27/71/71/1432277171.db2.gz URWBRWMDVXIJQP-MRXNPFEDSA-N 0 0 390.461 3.398 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NCc2cc(-c3ccccc3)on2)c1[N+](=O)[O-] ZINC000189932414 1432278944 /nfs/dbraw/zinc/27/89/44/1432278944.db2.gz HROOAJIBAYOACZ-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCO[C@@H](c3cccc(F)c3)C2)c1[N+](=O)[O-] ZINC000189939183 1432282036 /nfs/dbraw/zinc/28/20/36/1432282036.db2.gz LUGRZXIQHDQWEG-MRXNPFEDSA-N 0 0 394.424 3.113 20 5 GGBDRN CC(C)(CNC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccc(C(F)(F)F)cc1 ZINC000189970559 1432293256 /nfs/dbraw/zinc/29/32/56/1432293256.db2.gz PCVJFQASXFKRES-UHFFFAOYSA-N 0 0 399.373 3.087 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000189976295 1432295503 /nfs/dbraw/zinc/29/55/03/1432295503.db2.gz QOEKESIKXXBSMA-LPHOPBHVSA-N 0 0 384.436 3.084 20 5 GGBDRN COC[C@H](NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000189982461 1432297522 /nfs/dbraw/zinc/29/75/22/1432297522.db2.gz KJZIOYDIUGCEDD-HNNXBMFYSA-N 0 0 380.347 3.308 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)C[C@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000189994196 1432301211 /nfs/dbraw/zinc/30/12/11/1432301211.db2.gz DSJJBSPBFOQVDU-SFHVURJKSA-N 0 0 386.448 3.368 20 5 GGBDRN CCC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000189995063 1432301301 /nfs/dbraw/zinc/30/13/01/1432301301.db2.gz PGYFWTGTBSGAMA-UHFFFAOYSA-N 0 0 376.194 3.365 20 5 GGBDRN COc1cc(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cc([N+](=O)[O-])c1C ZINC000190061436 1432313113 /nfs/dbraw/zinc/31/31/13/1432313113.db2.gz ZGLKBIXPPGJMCJ-QGZVFWFLSA-N 0 0 397.431 3.005 20 5 GGBDRN CO[C@@H]1C[C@H](c2nc(C)no2)N(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000190064116 1432313288 /nfs/dbraw/zinc/31/32/88/1432313288.db2.gz PJTCMWQNWFNZMG-CZUORRHYSA-N 0 0 388.424 3.186 20 5 GGBDRN O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCCO1 ZINC000190067989 1432313610 /nfs/dbraw/zinc/31/36/10/1432313610.db2.gz BZIFJTUWGVPZSF-UHFFFAOYSA-N 0 0 387.358 3.384 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3cccc(O)c3)CC2)cc1[N+](=O)[O-] ZINC000190067697 1432313638 /nfs/dbraw/zinc/31/36/38/1432313638.db2.gz YYHQZUCTVVNJSB-UHFFFAOYSA-N 0 0 397.431 3.022 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000190075780 1432314820 /nfs/dbraw/zinc/31/48/20/1432314820.db2.gz YVHUSSZXVVIVDC-ZFWWWQNUSA-N 0 0 391.468 3.069 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H](C)CC(=O)c2ccccc2)c1[N+](=O)[O-] ZINC000190079319 1432315617 /nfs/dbraw/zinc/31/56/17/1432315617.db2.gz MOHJHVAABYWZCN-AWEZNQCLSA-N 0 0 376.434 3.151 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000190080437 1432316027 /nfs/dbraw/zinc/31/60/27/1432316027.db2.gz IAZFDUKTHMCJNN-JQFCIGGWSA-N 0 0 387.440 3.092 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC[C@@H]2[C@@H]2CCCCC2=O)c1[N+](=O)[O-] ZINC000190114480 1432322366 /nfs/dbraw/zinc/32/23/66/1432322366.db2.gz LSJNBDSCZHFLDA-LSDHHAIUSA-N 0 0 380.466 3.124 20 5 GGBDRN O=C([C@H]1CCCc2c(O)cccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000190133718 1432325965 /nfs/dbraw/zinc/32/59/65/1432325965.db2.gz VDROGGAFSVDHLU-IBGZPJMESA-N 0 0 381.432 3.069 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)c1[N+](=O)[O-] ZINC000190146429 1432327778 /nfs/dbraw/zinc/32/77/78/1432327778.db2.gz JKILBHHERNYTRY-MLGOLLRUSA-N 0 0 375.450 3.378 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCN2CCc3ccccc3C2=O)cc1[N+](=O)[O-] ZINC000190154945 1432329589 /nfs/dbraw/zinc/32/95/89/1432329589.db2.gz WSKIPCJBCQLPMZ-UHFFFAOYSA-N 0 0 381.432 3.147 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])o1 ZINC000190159875 1432330134 /nfs/dbraw/zinc/33/01/34/1432330134.db2.gz YZIKPHAMKGCDCC-OAHLLOKOSA-N 0 0 394.449 3.477 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC000190161504 1432330371 /nfs/dbraw/zinc/33/03/71/1432330371.db2.gz YWIWZIZFFQZKNF-IBGZPJMESA-N 0 0 388.445 3.032 20 5 GGBDRN COC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(N(C)C)c1 ZINC000190171768 1432332780 /nfs/dbraw/zinc/33/27/80/1432332780.db2.gz BVCXAGWATQEZBT-UHFFFAOYSA-N 0 0 377.784 3.353 20 5 GGBDRN COC(=O)c1cnc(NCCc2coc(-c3ccc(C)cc3)n2)c([N+](=O)[O-])c1 ZINC000190171298 1432333007 /nfs/dbraw/zinc/33/30/07/1432333007.db2.gz WBNZDLDLNLLEIL-UHFFFAOYSA-N 0 0 382.376 3.394 20 5 GGBDRN CCCc1[nH]nc(-c2nc(-c3ccc(N4CCCCC4)nc3)no2)c1[N+](=O)[O-] ZINC000190180733 1432334836 /nfs/dbraw/zinc/33/48/36/1432334836.db2.gz VLMQHRCQAQLGEC-UHFFFAOYSA-N 0 0 383.412 3.373 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000190187293 1432336603 /nfs/dbraw/zinc/33/66/03/1432336603.db2.gz JUMUNQNUUNAWDD-QGZVFWFLSA-N 0 0 392.477 3.090 20 5 GGBDRN COc1ccc(OCC(=O)N(Cc2ccco2)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000190196238 1432338459 /nfs/dbraw/zinc/33/84/59/1432338459.db2.gz QZNGJJRXHOEKSN-UHFFFAOYSA-N 0 0 388.298 3.166 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc(-n3cccn3)cc2C)ccc1[N+](=O)[O-] ZINC000190211366 1432342102 /nfs/dbraw/zinc/34/21/02/1432342102.db2.gz UQYZSPBGVZFGMY-UHFFFAOYSA-N 0 0 382.376 3.115 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H]2CC(=O)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000190226189 1432344578 /nfs/dbraw/zinc/34/45/78/1432344578.db2.gz HJQXKBWPRDFMEP-MRXNPFEDSA-N 0 0 384.436 3.329 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000190231398 1432345474 /nfs/dbraw/zinc/34/54/74/1432345474.db2.gz PKRHRUYHFYXQHS-OAHLLOKOSA-N 0 0 389.433 3.134 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC([C@@H](O)c3nccn3C)CC2)cc1[N+](=O)[O-] ZINC000190231842 1432345545 /nfs/dbraw/zinc/34/55/45/1432345545.db2.gz IERQHXZMXKJHRR-GOSISDBHSA-N 0 0 386.452 3.038 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000190231379 1432345639 /nfs/dbraw/zinc/34/56/39/1432345639.db2.gz PKRHRUYHFYXQHS-HNNXBMFYSA-N 0 0 389.433 3.134 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])n1 ZINC000190242437 1432347403 /nfs/dbraw/zinc/34/74/03/1432347403.db2.gz MDSPNNAZWPNIQJ-OAHLLOKOSA-N 0 0 389.433 3.134 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2cc(F)ccc2[N+](=O)[O-])n1 ZINC000190255250 1432349389 /nfs/dbraw/zinc/34/93/89/1432349389.db2.gz KJGLQRALJUWLJK-CQSZACIVSA-N 0 0 393.396 3.344 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N(Cc2c(F)cccc2F)C2CC2)cc1 ZINC000190289779 1432354220 /nfs/dbraw/zinc/35/42/20/1432354220.db2.gz NNBTUPOPYOHJPB-UHFFFAOYSA-N 0 0 382.388 3.367 20 5 GGBDRN COc1cc(C(=O)N2CCN([C@H](C)c3ccsc3)CC2)cc([N+](=O)[O-])c1C ZINC000190293868 1432355219 /nfs/dbraw/zinc/35/52/19/1432355219.db2.gz NDPSHDJHRPLLGE-CQSZACIVSA-N 0 0 389.477 3.492 20 5 GGBDRN CCc1ccc([C@@H]2CN(CC(=O)Nc3ccc([N+](=O)[O-])cc3OC)CCO2)cc1 ZINC000190298331 1432355578 /nfs/dbraw/zinc/35/55/78/1432355578.db2.gz HXSYYSFISKZSFR-FQEVSTJZSA-N 0 0 399.447 3.178 20 5 GGBDRN O=C(NCCc1ccc(F)c(F)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000190303857 1432356667 /nfs/dbraw/zinc/35/66/67/1432356667.db2.gz ALMYYUZVBBZRLG-UHFFFAOYSA-N 0 0 375.375 3.446 20 5 GGBDRN Cc1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2C)c(-n2cc(Cl)cn2)n1 ZINC000190337967 1432363750 /nfs/dbraw/zinc/36/37/50/1432363750.db2.gz LSEBAEBGWDIWHF-UHFFFAOYSA-N 0 0 399.838 3.305 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000190337214 1432363804 /nfs/dbraw/zinc/36/38/04/1432363804.db2.gz BZASUPLHCQVPTA-UHFFFAOYSA-N 0 0 395.423 3.244 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2=O)cc1 ZINC000190358081 1432366823 /nfs/dbraw/zinc/36/68/23/1432366823.db2.gz BRVFTTTULYWYJV-GOSISDBHSA-N 0 0 382.420 3.134 20 5 GGBDRN O=C(NC1(c2nc[nH]n2)CCC1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000190365872 1432367879 /nfs/dbraw/zinc/36/78/79/1432367879.db2.gz QCSKQUJIMQKRDN-UHFFFAOYSA-N 0 0 378.392 3.266 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(C)(C)c1ccc(C(F)(F)F)cc1 ZINC000190381070 1432370379 /nfs/dbraw/zinc/37/03/79/1432370379.db2.gz BRALHXRRIYPVJZ-UHFFFAOYSA-N 0 0 384.358 3.213 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2cncc3ccccc32)CC1 ZINC000190382407 1432370814 /nfs/dbraw/zinc/37/08/14/1432370814.db2.gz WKIFWRSEEPHXKR-UHFFFAOYSA-N 0 0 376.416 3.034 20 5 GGBDRN COc1cc(C(=O)N(C)CCCc2nc3ccccc3[nH]2)cc([N+](=O)[O-])c1C ZINC000190384546 1432371073 /nfs/dbraw/zinc/37/10/73/1432371073.db2.gz PAYXTEDRWQQNQX-UHFFFAOYSA-N 0 0 382.420 3.493 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3cncc4ccccc43)CC2)ccc1[N+](=O)[O-] ZINC000190389618 1432372108 /nfs/dbraw/zinc/37/21/08/1432372108.db2.gz OIJGIDPHAPBDNI-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN COc1ccc(C(=O)N2CCN(c3cncc4ccccc43)CC2)cc1[N+](=O)[O-] ZINC000190392545 1432372554 /nfs/dbraw/zinc/37/25/54/1432372554.db2.gz MDOOOWOAPCXXOZ-UHFFFAOYSA-N 0 0 392.415 3.114 20 5 GGBDRN Cc1ccc([C@@H]2CSCCN2C(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000190397538 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386.408 3.117 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCNC(=O)c1ccccc1Cl ZINC000191320981 1432631259 /nfs/dbraw/zinc/63/12/59/1432631259.db2.gz ZOSYYRHWNXXRDF-UHFFFAOYSA-N 0 0 390.827 3.417 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C1 ZINC000191331384 1432634790 /nfs/dbraw/zinc/63/47/90/1432634790.db2.gz XKXFKXDTUWECRV-OAHLLOKOSA-N 0 0 376.457 3.372 20 5 GGBDRN Cc1cnc(COC(=O)c2ccc(CN3CCCC3=O)cc2)c(C)c1[N+](=O)[O-] ZINC000191342287 1432637210 /nfs/dbraw/zinc/63/72/10/1432637210.db2.gz QXURVDBDRSNQGF-UHFFFAOYSA-N 0 0 383.404 3.086 20 5 GGBDRN Cc1cnc(COC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000191347346 1432637554 /nfs/dbraw/zinc/63/75/54/1432637554.db2.gz RPRFTKPOOKJLME-KRWDZBQOSA-N 0 0 397.431 3.202 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)n2C ZINC000191349316 1432638346 /nfs/dbraw/zinc/63/83/46/1432638346.db2.gz HTTMXPCFFBMGDW-UHFFFAOYSA-N 0 0 383.408 3.429 20 5 GGBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191361474 1432641045 /nfs/dbraw/zinc/64/10/45/1432641045.db2.gz TWDCAZIBIVTZMA-GOSISDBHSA-N 0 0 383.404 3.151 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cn1 ZINC000191366065 1432642388 /nfs/dbraw/zinc/64/23/88/1432642388.db2.gz ZFDWOXRMNIHILQ-UHFFFAOYSA-N 0 0 380.408 3.422 20 5 GGBDRN CC(C)(C)c1cnc(CCC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)o1 ZINC000191364192 1432642431 /nfs/dbraw/zinc/64/24/31/1432642431.db2.gz QFQWEVPLVXKVAE-UHFFFAOYSA-N 0 0 386.452 3.162 20 5 GGBDRN CCOc1cccc(N2CCN(C(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)CC2)n1 ZINC000191380649 1432646317 /nfs/dbraw/zinc/64/63/17/1432646317.db2.gz KYVNCJCYTJCIJG-UHFFFAOYSA-N 0 0 399.451 3.359 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000191384952 1432647650 /nfs/dbraw/zinc/64/76/50/1432647650.db2.gz OQQNXUKWRGRWQL-UHFFFAOYSA-N 0 0 375.450 3.385 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000191391851 1432649649 /nfs/dbraw/zinc/64/96/49/1432649649.db2.gz WWHSTLQKWLWOEH-UHFFFAOYSA-N 0 0 391.449 3.085 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000191393757 1432651015 /nfs/dbraw/zinc/65/10/15/1432651015.db2.gz SHMIRKOYFYRDGL-UHFFFAOYSA-N 0 0 375.450 3.385 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C1 ZINC000191395714 1432651414 /nfs/dbraw/zinc/65/14/14/1432651414.db2.gz NAUNBWFUXSCBAE-OAHLLOKOSA-N 0 0 376.457 3.372 20 5 GGBDRN COc1ccc(Cl)c(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)c1 ZINC000191401114 1432653859 /nfs/dbraw/zinc/65/38/59/1432653859.db2.gz LTVRYGGAPMAXCF-SFHVURJKSA-N 0 0 389.795 3.224 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)OCc2ncc(C)c([N+](=O)[O-])c2C)cc1 ZINC000191404575 1432654880 /nfs/dbraw/zinc/65/48/80/1432654880.db2.gz WCTMFNFMZXNYDI-GOSISDBHSA-N 0 0 397.431 3.149 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C[S@](C)=O)c1ccccc1 ZINC000191410313 1432656301 /nfs/dbraw/zinc/65/63/01/1432656301.db2.gz BEDMDMGPOAOTRN-QMTYFTJSSA-N 0 0 375.450 3.453 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191434370 1432661137 /nfs/dbraw/zinc/66/11/37/1432661137.db2.gz SVSLZYOYOXRCBW-UHFFFAOYSA-N 0 0 379.376 3.076 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000191472066 1432667733 /nfs/dbraw/zinc/66/77/33/1432667733.db2.gz VDCABUPAOJDKIZ-GOSISDBHSA-N 0 0 382.420 3.334 20 5 GGBDRN C[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000191509367 1432675704 /nfs/dbraw/zinc/67/57/04/1432675704.db2.gz UARJQYYVMMTJPY-MNOVXSKESA-N 0 0 385.367 3.220 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000191510552 1432675706 /nfs/dbraw/zinc/67/57/06/1432675706.db2.gz DPDLHDSMGONNRE-GOSISDBHSA-N 0 0 382.420 3.334 20 5 GGBDRN O=C(Nc1ccc(Cl)cc1-n1cccn1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000191510502 1432675967 /nfs/dbraw/zinc/67/59/67/1432675967.db2.gz GYOPRNGOZDEKMN-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN C[C@H]1CCC[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000191509381 1432676116 /nfs/dbraw/zinc/67/61/16/1432676116.db2.gz UARJQYYVMMTJPY-QWRGUYRKSA-N 0 0 385.367 3.220 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C(=O)N(C)c3ccccc3)c2)n1 ZINC000191556073 1432682611 /nfs/dbraw/zinc/68/26/11/1432682611.db2.gz BKXCYCFPRZFMSD-UHFFFAOYSA-N 0 0 393.403 3.340 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@H](C(=O)Nc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000191578469 1432686579 /nfs/dbraw/zinc/68/65/79/1432686579.db2.gz ZCQARDRYZPPUHS-HNNXBMFYSA-N 0 0 397.431 3.403 20 5 GGBDRN COC(=O)Cc1cccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000191607826 1432691862 /nfs/dbraw/zinc/69/18/62/1432691862.db2.gz KXFJKKPCYNRXEZ-UHFFFAOYSA-N 0 0 384.417 3.441 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191623317 1432694800 /nfs/dbraw/zinc/69/48/00/1432694800.db2.gz XXGDAIGAERDOIM-UHFFFAOYSA-N 0 0 393.403 3.384 20 5 GGBDRN CCOCCOCCN(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000191624003 1432694838 /nfs/dbraw/zinc/69/48/38/1432694838.db2.gz LWOCUSJDTMOYLC-UHFFFAOYSA-N 0 0 379.335 3.130 20 5 GGBDRN COc1cc(C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)cc([N+](=O)[O-])c1C ZINC000191633766 1432696913 /nfs/dbraw/zinc/69/69/13/1432696913.db2.gz VSAYHYRLFOERCZ-UHFFFAOYSA-N 0 0 394.391 3.017 20 5 GGBDRN COc1cc(C(=O)N[C@@H](c2nccn2C)c2cccc(F)c2)cc([N+](=O)[O-])c1C ZINC000191643765 1432699230 /nfs/dbraw/zinc/69/92/30/1432699230.db2.gz WMEPYHJYEAMVOH-GOSISDBHSA-N 0 0 398.394 3.304 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000191652508 1432700346 /nfs/dbraw/zinc/70/03/46/1432700346.db2.gz XFMGQJMHZWEMOG-SFHVURJKSA-N 0 0 383.448 3.181 20 5 GGBDRN COc1ccc(CNc2ccc(Cc3nnc4n3CCC4)cc2)cc1[N+](=O)[O-] ZINC000191652455 1432700388 /nfs/dbraw/zinc/70/03/88/1432700388.db2.gz SWQSUZDHOHBVFE-UHFFFAOYSA-N 0 0 379.420 3.344 20 5 GGBDRN O=C1NCCN(Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(OC(F)(F)F)cc1 ZINC000191656550 1432700739 /nfs/dbraw/zinc/70/07/39/1432700739.db2.gz FIIPKGMZYYTJNU-MRXNPFEDSA-N 0 0 395.337 3.167 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)c1ccccc1 ZINC000191673200 1432703239 /nfs/dbraw/zinc/70/32/39/1432703239.db2.gz KYYTYMMGTKRARD-HXUWFJFHSA-N 0 0 385.420 3.464 20 5 GGBDRN COc1cc(CN2CCC(Oc3ccc(F)nc3)CC2)c([N+](=O)[O-])cc1OC ZINC000191677120 1432703705 /nfs/dbraw/zinc/70/37/05/1432703705.db2.gz YDECMSJMGPMMHJ-UHFFFAOYSA-N 0 0 391.399 3.190 20 5 GGBDRN O=C(Nc1cccc(-c2cc[nH]n2)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191675016 1432703897 /nfs/dbraw/zinc/70/38/97/1432703897.db2.gz MJIWQGPIDRHWCL-UHFFFAOYSA-N 0 0 379.376 3.280 20 5 GGBDRN O=C(NCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1[nH]ncc1[N+](=O)[O-] ZINC000191681744 1432704811 /nfs/dbraw/zinc/70/48/11/1432704811.db2.gz WTQCXVFZYJNUSZ-UHFFFAOYSA-N 0 0 388.733 3.452 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ncc(-c2ccc(F)cc2)s1 ZINC000191726476 1432713404 /nfs/dbraw/zinc/71/34/04/1432713404.db2.gz WDCIZWJWCGABIY-UHFFFAOYSA-N 0 0 375.385 3.391 20 5 GGBDRN CCO[C@H]1C[C@@](O)(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1(C)C ZINC000191738801 1432715580 /nfs/dbraw/zinc/71/55/80/1432715580.db2.gz XEYNZEONSPJREN-MAUKXSAKSA-N 0 0 378.450 3.105 20 5 GGBDRN CC(C)(CNC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(C(F)(F)F)cc1 ZINC000191739722 1432715609 /nfs/dbraw/zinc/71/56/09/1432715609.db2.gz VWMGBLVBMXMJRO-UHFFFAOYSA-N 0 0 384.358 3.294 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)cc1[N+](=O)[O-] ZINC000191786306 1432724990 /nfs/dbraw/zinc/72/49/90/1432724990.db2.gz UMOINPGOYRJWMR-UHFFFAOYSA-N 0 0 389.433 3.361 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1[N+](=O)[O-] ZINC000191787313 1432725305 /nfs/dbraw/zinc/72/53/05/1432725305.db2.gz SXLPVONMAOUDHU-UHFFFAOYSA-N 0 0 389.433 3.361 20 5 GGBDRN CCCNC(=O)c1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000191791119 1432725607 /nfs/dbraw/zinc/72/56/07/1432725607.db2.gz SXUMFGBXDOCNNW-UHFFFAOYSA-N 0 0 391.449 3.152 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(CC(F)(F)F)c2ccncc2)c1[N+](=O)[O-] ZINC000191790990 1432725619 /nfs/dbraw/zinc/72/56/19/1432725619.db2.gz RSUMREWSMNXCBP-UHFFFAOYSA-N 0 0 389.355 3.364 20 5 GGBDRN CCNC(=O)c1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(C)c1 ZINC000191790728 1432725962 /nfs/dbraw/zinc/72/59/62/1432725962.db2.gz YCLXCCROQRFICD-UHFFFAOYSA-N 0 0 391.449 3.071 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cccc(Cl)c2F)C1=O ZINC000191801345 1432728503 /nfs/dbraw/zinc/72/85/03/1432728503.db2.gz XFRNZWOHVWLJSS-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000191806606 1432729835 /nfs/dbraw/zinc/72/98/35/1432729835.db2.gz BPUUDJMDANEWBG-JTQLQIEISA-N 0 0 379.800 3.496 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(c2ccccc2)[C@H]2CCOC2)c1[N+](=O)[O-] ZINC000191826359 1432733336 /nfs/dbraw/zinc/73/33/36/1432733336.db2.gz YFQDUDNLLMUBSU-INIZCTEOSA-N 0 0 376.434 3.196 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(c1ccccc1)[C@@H]1CCOC1 ZINC000191831640 1432735027 /nfs/dbraw/zinc/73/50/27/1432735027.db2.gz XACWSBAMVQCFFU-MRXNPFEDSA-N 0 0 376.434 3.196 20 5 GGBDRN COc1cc(C(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)cc([N+](=O)[O-])c1C ZINC000191856467 1432741118 /nfs/dbraw/zinc/74/11/18/1432741118.db2.gz WDAZQIISQRWCHE-QGZVFWFLSA-N 0 0 397.431 3.179 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(C[S@](C)=O)c2C)cc([N+](=O)[O-])c1C ZINC000191880341 1432745756 /nfs/dbraw/zinc/74/57/56/1432745756.db2.gz IFQQZLSJDDPYMD-SANMLTNESA-N 0 0 376.434 3.351 20 5 GGBDRN COc1cccc(Cl)c1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000191879911 1432745782 /nfs/dbraw/zinc/74/57/82/1432745782.db2.gz BFHDBPXJBIOUGS-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCCN(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000191891864 1432748356 /nfs/dbraw/zinc/74/83/56/1432748356.db2.gz VBMFVGJBGJYBFQ-UHFFFAOYSA-N 0 0 389.477 3.113 20 5 GGBDRN COCc1nc2cc(NS(=O)(=O)c3cc([N+](=O)[O-])c(C)cc3C)ccc2o1 ZINC000191903484 1432751854 /nfs/dbraw/zinc/75/18/54/1432751854.db2.gz VBARBBIUUDIWKV-UHFFFAOYSA-N 0 0 391.405 3.300 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@H](c2nc(C3CC3)no2)C(C)C)cc1[N+](=O)[O-] ZINC000191921379 1432756349 /nfs/dbraw/zinc/75/63/49/1432756349.db2.gz BTMQAQVNYCLFEW-HNNXBMFYSA-N 0 0 394.453 3.148 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)c1cccc(S(C)(=O)=O)c1 ZINC000191938233 1432760944 /nfs/dbraw/zinc/76/09/44/1432760944.db2.gz RFFJRNZODUGEMK-UHFFFAOYSA-N 0 0 376.434 3.200 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2ccn(-c3ccc(F)cc3F)n2)cc1 ZINC000191976269 1432772969 /nfs/dbraw/zinc/77/29/69/1432772969.db2.gz UQTUCZRGXBZCMS-UHFFFAOYSA-N 0 0 379.344 3.033 20 5 GGBDRN CCc1cc(NC(=O)[C@@H](NC(C)=O)C2CCCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000191979819 1432773667 /nfs/dbraw/zinc/77/36/67/1432773667.db2.gz DYIZSKZWXVBZNW-IBGZPJMESA-N 0 0 384.436 3.339 20 5 GGBDRN CCC(=O)N1CCCC[C@@H]1C(=O)Nc1cc(CC)nc2ccc([N+](=O)[O-])cc21 ZINC000191980072 1432773719 /nfs/dbraw/zinc/77/37/19/1432773719.db2.gz MTRGBLARQPMEKP-GOSISDBHSA-N 0 0 384.436 3.435 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC[C@H]1c1cnn(C)c1 ZINC000191997341 1432776578 /nfs/dbraw/zinc/77/65/78/1432776578.db2.gz BYKXTQUJFQZZDX-YJBOKZPZSA-N 0 0 388.493 3.214 20 5 GGBDRN COc1cc(C(=O)NC[C@](C)(Cc2ccccc2)[C@@H](C)O)cc([N+](=O)[O-])c1C ZINC000192039470 1432784137 /nfs/dbraw/zinc/78/41/37/1432784137.db2.gz GFWOXCRMEMZALP-VFNWGFHPSA-N 0 0 386.448 3.271 20 5 GGBDRN O=C1Nc2ccccc2CC[C@@H]1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000192048220 1432786988 /nfs/dbraw/zinc/78/69/88/1432786988.db2.gz NGROROJKKVFAMY-FQEVSTJZSA-N 0 0 381.432 3.392 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NCc2csc(-c3ccco3)n2)cc1[N+](=O)[O-] ZINC000192052226 1432788038 /nfs/dbraw/zinc/78/80/38/1432788038.db2.gz XAHGJPZIUAQLIA-UHFFFAOYSA-N 0 0 393.446 3.407 20 5 GGBDRN C[C@@H](O)[C@@](C)(CNC(=O)CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000192052236 1432788126 /nfs/dbraw/zinc/78/81/26/1432788126.db2.gz SUESXWZORBLAID-IIBYNOLFSA-N 0 0 386.448 3.110 20 5 GGBDRN C[C@H](O)[C@@](C)(CNC(=O)CCNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000192056785 1432788938 /nfs/dbraw/zinc/78/89/38/1432788938.db2.gz XSHIWMGLDAGXCD-HRAATJIYSA-N 0 0 385.464 3.143 20 5 GGBDRN C[C@@H](O)[C@@](C)(CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Cc1ccccc1 ZINC000192060288 1432790159 /nfs/dbraw/zinc/79/01/59/1432790159.db2.gz SYCMXQMTOAWKGL-IVZQSRNASA-N 0 0 395.459 3.365 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(c1ccccc1)[C@@H]1CCOC1 ZINC000192081563 1432794833 /nfs/dbraw/zinc/79/48/33/1432794833.db2.gz CKAWTFRYJOVITQ-GOSISDBHSA-N 0 0 378.388 3.216 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CCO)cc1[N+](=O)[O-] ZINC000192114854 1432800259 /nfs/dbraw/zinc/80/02/59/1432800259.db2.gz MDLNJMCVGLYANX-INIZCTEOSA-N 0 0 392.477 3.173 20 5 GGBDRN COCCOc1ccc(CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000192124025 1432801805 /nfs/dbraw/zinc/80/18/05/1432801805.db2.gz JGCUVJFGNHIPAH-UHFFFAOYSA-N 0 0 392.839 3.475 20 5 GGBDRN CCc1c(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cnn1-c1ccccc1Cl ZINC000192124453 1432801864 /nfs/dbraw/zinc/80/18/64/1432801864.db2.gz XVCAQKFMGKQWNX-UHFFFAOYSA-N 0 0 387.783 3.349 20 5 GGBDRN CCc1c(NC(=O)c2n[nH]cc2[N+](=O)[O-])cnn1-c1cccc(C(F)(F)F)c1 ZINC000192128179 1432802748 /nfs/dbraw/zinc/80/27/48/1432802748.db2.gz QKLLRZXBYUDHAC-UHFFFAOYSA-N 0 0 394.313 3.337 20 5 GGBDRN Cc1ccc(COc2c([N+](=O)[O-])cc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1C ZINC000192134403 1432804448 /nfs/dbraw/zinc/80/44/48/1432804448.db2.gz GFKVGQLOEWBDLY-UHFFFAOYSA-N 0 0 380.378 3.102 20 5 GGBDRN CCc1c(NC(=O)CCn2cc([N+](=O)[O-])nc2C)cnn1-c1ccccc1C ZINC000192138567 1432805082 /nfs/dbraw/zinc/80/50/82/1432805082.db2.gz WCAINVKEIASFKA-UHFFFAOYSA-N 0 0 382.424 3.185 20 5 GGBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCC(Oc2ccc(F)nc2)CC1 ZINC000192142961 1432806233 /nfs/dbraw/zinc/80/62/33/1432806233.db2.gz AOVFZLNXUQVYIC-UHFFFAOYSA-N 0 0 381.310 3.091 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)o1 ZINC000192145708 1432806885 /nfs/dbraw/zinc/80/68/85/1432806885.db2.gz SHMHUVAOMTUCNT-HNNXBMFYSA-N 0 0 394.449 3.477 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)o1 ZINC000192145701 1432806943 /nfs/dbraw/zinc/80/69/43/1432806943.db2.gz SHMHUVAOMTUCNT-OAHLLOKOSA-N 0 0 394.449 3.477 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192145618 1432806975 /nfs/dbraw/zinc/80/69/75/1432806975.db2.gz RPTBHNSUEWHBQT-SJLPKXTDSA-N 0 0 390.461 3.410 20 5 GGBDRN CCc1c(NC(=O)CCn2cc([N+](=O)[O-])nc2C)cnn1-c1cccc(C)c1 ZINC000192148822 1432807947 /nfs/dbraw/zinc/80/79/47/1432807947.db2.gz UYPTVAYRTSAGND-UHFFFAOYSA-N 0 0 382.424 3.185 20 5 GGBDRN CCCn1ccnc1CCCN(C)c1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000192236044 1432820675 /nfs/dbraw/zinc/82/06/75/1432820675.db2.gz ADSVALWMLVHQGL-UHFFFAOYSA-N 0 0 387.484 3.409 20 5 GGBDRN CCCn1ccnc1CCCN(C)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000192242830 1432821516 /nfs/dbraw/zinc/82/15/16/1432821516.db2.gz BFXKLVGXCRSMBB-UHFFFAOYSA-N 0 0 394.497 3.071 20 5 GGBDRN CCCn1ccnc1CCCN(C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000192243990 1432821777 /nfs/dbraw/zinc/82/17/77/1432821777.db2.gz RCKHZCHKRPRMSQ-UHFFFAOYSA-N 0 0 394.497 3.071 20 5 GGBDRN CCCn1ccnc1CCCN(C)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000192245348 1432822003 /nfs/dbraw/zinc/82/20/03/1432822003.db2.gz KAJCTKZSUOLRJI-UHFFFAOYSA-N 0 0 394.497 3.071 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000192246798 1432822245 /nfs/dbraw/zinc/82/22/45/1432822245.db2.gz ZKPMFJBNOXRYMR-UHFFFAOYSA-N 0 0 396.451 3.092 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000192257260 1432823432 /nfs/dbraw/zinc/82/34/32/1432823432.db2.gz HAQCEEWPFXURRZ-UHFFFAOYSA-N 0 0 396.451 3.092 20 5 GGBDRN CN(CCc1ccccn1)c1ccc([N+](=O)[O-])c(N(C)CCc2ccccn2)n1 ZINC000192263366 1432824092 /nfs/dbraw/zinc/82/40/92/1432824092.db2.gz OPSPCWMQLCAMIL-UHFFFAOYSA-N 0 0 392.463 3.138 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000192261893 1432824156 /nfs/dbraw/zinc/82/41/56/1432824156.db2.gz WTGHLRSAPXCQAN-UHFFFAOYSA-N 0 0 388.445 3.372 20 5 GGBDRN CC(C)Oc1ccc(N(C)C(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000192264225 1432824324 /nfs/dbraw/zinc/82/43/24/1432824324.db2.gz KHSXFNZRVKVKSX-CQSZACIVSA-N 0 0 385.420 3.163 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)cc1C ZINC000192270174 1432825282 /nfs/dbraw/zinc/82/52/82/1432825282.db2.gz SCNBSZOFDVAWCR-LPHOPBHVSA-N 0 0 390.461 3.268 20 5 GGBDRN CCOc1cc(C(=O)N2CCC(c3ccncc3)CC2)c([N+](=O)[O-])cc1OC ZINC000192273746 1432825776 /nfs/dbraw/zinc/82/57/76/1432825776.db2.gz ASLLGSPIOXJHKJ-UHFFFAOYSA-N 0 0 385.420 3.417 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCC(c3ccncc3)CC2)cc([N+](=O)[O-])c1 ZINC000192281515 1432826961 /nfs/dbraw/zinc/82/69/61/1432826961.db2.gz GMSRMOKMRFPZRP-UHFFFAOYSA-N 0 0 383.404 3.186 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)c3c(C)cc(C)c([N+](=O)[O-])c3C)C2=O)cc1 ZINC000192284056 1432827201 /nfs/dbraw/zinc/82/72/01/1432827201.db2.gz ODLWEABOMLMFGY-SFHVURJKSA-N 0 0 395.459 3.359 20 5 GGBDRN CCOC1CCN(c2ccc([N+](=O)[O-])c(N3CCC(OCC)CC3)n2)CC1 ZINC000192284200 1432827216 /nfs/dbraw/zinc/82/72/16/1432827216.db2.gz SWWHSBRFDXFPCS-UHFFFAOYSA-N 0 0 378.473 3.000 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCC(c2ccncc2)CC1 ZINC000192288085 1432827723 /nfs/dbraw/zinc/82/77/23/1432827723.db2.gz BXQBFRVMPFVKKJ-UHFFFAOYSA-N 0 0 377.404 3.195 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC(c2ccncc2)CC1 ZINC000192292494 1432828134 /nfs/dbraw/zinc/82/81/34/1432828134.db2.gz GCAMAOMSHWIKNM-UHFFFAOYSA-N 0 0 377.404 3.195 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(Cc2c(F)cccc2F)C2CC2)cccc1[N+](=O)[O-] ZINC000192303447 1432829538 /nfs/dbraw/zinc/82/95/38/1432829538.db2.gz DAOUOMVUVGFFJU-UHFFFAOYSA-N 0 0 389.358 3.311 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)C2=O)cc1 ZINC000192318569 1432831234 /nfs/dbraw/zinc/83/12/34/1432831234.db2.gz BDKYBLVYWXNMTH-KRWDZBQOSA-N 0 0 396.447 3.443 20 5 GGBDRN CCC[C@@H]1CN(c2ccc([N+](=O)[O-])c(N3CCO[C@H](CCC)C3)n2)CCO1 ZINC000192348197 1432834924 /nfs/dbraw/zinc/83/49/24/1432834924.db2.gz RIKYWAFRWWLAKY-HZPDHXFCSA-N 0 0 378.473 3.000 20 5 GGBDRN COCCOc1ccc(CC(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000192380891 1432839696 /nfs/dbraw/zinc/83/96/96/1432839696.db2.gz MCAIWSNLNLDEAS-UHFFFAOYSA-N 0 0 381.388 3.349 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(F)cc1 ZINC000192408463 1432841687 /nfs/dbraw/zinc/84/16/87/1432841687.db2.gz YZZQYYMLIPDQQJ-HNNXBMFYSA-N 0 0 375.356 3.121 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000192409285 1432841697 /nfs/dbraw/zinc/84/16/97/1432841697.db2.gz DGNNHRUTEHYJLM-CYBMUJFWSA-N 0 0 395.774 3.466 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000192417458 1432842563 /nfs/dbraw/zinc/84/25/63/1432842563.db2.gz OPXSRVGQKVHAFU-HNNXBMFYSA-N 0 0 389.383 3.429 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1ccc(F)cc1 ZINC000192419193 1432842786 /nfs/dbraw/zinc/84/27/86/1432842786.db2.gz NPYWMLXZBCLSDO-OAHLLOKOSA-N 0 0 375.356 3.121 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(F)cc1 ZINC000192427551 1432843965 /nfs/dbraw/zinc/84/39/65/1432843965.db2.gz KKNHAKPSKSPNCC-HNNXBMFYSA-N 0 0 375.356 3.121 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)c1ccc(F)cc1 ZINC000192431757 1432844325 /nfs/dbraw/zinc/84/43/25/1432844325.db2.gz MGSTYLUVRSLGES-OAHLLOKOSA-N 0 0 389.383 3.429 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)c1ccc(F)cc1 ZINC000192431755 1432844360 /nfs/dbraw/zinc/84/43/60/1432844360.db2.gz MGSTYLUVRSLGES-HNNXBMFYSA-N 0 0 389.383 3.429 20 5 GGBDRN O=C(NC[C@@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1)Nc1cccc(F)c1 ZINC000192450327 1432846241 /nfs/dbraw/zinc/84/62/41/1432846241.db2.gz FCUYJEKZNLHOCU-NSHDSACASA-N 0 0 379.417 3.229 20 5 GGBDRN COC(=O)c1cc(C(=O)N(Cc2ccco2)c2ccccn2)cc([N+](=O)[O-])c1 ZINC000192466449 1432848257 /nfs/dbraw/zinc/84/82/57/1432848257.db2.gz YBXHBKITVXSUTN-UHFFFAOYSA-N 0 0 381.344 3.216 20 5 GGBDRN Cc1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1-c1nnnn1C1CC1 ZINC000192478902 1432849371 /nfs/dbraw/zinc/84/93/71/1432849371.db2.gz ZNNQGERYOVGLJW-UHFFFAOYSA-N 0 0 378.392 3.452 20 5 GGBDRN COCCN(C(=O)C[C@H]1CCCO1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000192477501 1432849415 /nfs/dbraw/zinc/84/94/15/1432849415.db2.gz AVLFSYLJVCDLKE-OAHLLOKOSA-N 0 0 391.449 3.267 20 5 GGBDRN CCc1n[nH]c(C(=O)N(CCc2ccccc2)Cc2ccncc2)c1[N+](=O)[O-] ZINC000192479228 1432849709 /nfs/dbraw/zinc/84/97/09/1432849709.db2.gz HNJZHQGVTVRPIO-UHFFFAOYSA-N 0 0 379.420 3.160 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000192503015 1432851956 /nfs/dbraw/zinc/85/19/56/1432851956.db2.gz SAUZVEMXJFQIEV-INIZCTEOSA-N 0 0 378.331 3.095 20 5 GGBDRN Cc1c(C(=O)NCc2cc3ccccc3o2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000192505778 1432852531 /nfs/dbraw/zinc/85/25/31/1432852531.db2.gz UBCLDXVUQVIOCY-UHFFFAOYSA-N 0 0 377.360 3.160 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000192507624 1432852644 /nfs/dbraw/zinc/85/26/44/1432852644.db2.gz QCYMMHJRFQAURC-OAHLLOKOSA-N 0 0 395.799 3.028 20 5 GGBDRN Cc1c(C(=O)N[C@H]2CCSc3ccccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000192521552 1432854395 /nfs/dbraw/zinc/85/43/95/1432854395.db2.gz VQDMWJJAOQTKMI-INIZCTEOSA-N 0 0 395.444 3.451 20 5 GGBDRN Cn1cccc(NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])c1=O ZINC000192530738 1432855663 /nfs/dbraw/zinc/85/56/63/1432855663.db2.gz BXSAIJYHWDZQJM-UHFFFAOYSA-N 0 0 379.372 3.125 20 5 GGBDRN Cc1ncc(-c2ccc(NC(=O)Cn3c(=O)oc4cc([N+](=O)[O-])ccc43)cc2)o1 ZINC000192539546 1432856854 /nfs/dbraw/zinc/85/68/54/1432856854.db2.gz AHJUBTHIZYVWOA-UHFFFAOYSA-N 0 0 394.343 3.105 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000192541323 1432856963 /nfs/dbraw/zinc/85/69/63/1432856963.db2.gz OBAXTBOVAZVYGW-INIZCTEOSA-N 0 0 393.875 3.258 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](c2ccccc2)c2ccccc2OC)c1[N+](=O)[O-] ZINC000192544198 1432857494 /nfs/dbraw/zinc/85/74/94/1432857494.db2.gz NMFVMCAYSWBECK-KRWDZBQOSA-N 0 0 380.404 3.408 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1 ZINC000192546323 1432857771 /nfs/dbraw/zinc/85/77/71/1432857771.db2.gz XJLVQBCWFDXJPV-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1ccc(NC(=O)c2cccnc2)cc1 ZINC000192548060 1432857931 /nfs/dbraw/zinc/85/79/31/1432857931.db2.gz XJICFJFIMSQLOF-UHFFFAOYSA-N 0 0 380.408 3.379 20 5 GGBDRN C[C@@H]1CN(c2ccc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)cn2)C[C@@H](C)O1 ZINC000192550991 1432858457 /nfs/dbraw/zinc/85/84/57/1432858457.db2.gz LCDINDJLGGAZTQ-GHMZBOCLSA-N 0 0 392.362 3.134 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)N3CCC[C@@H]3C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000192551233 1432858724 /nfs/dbraw/zinc/85/87/24/1432858724.db2.gz KXMGQBMJCJHXSP-OAHLLOKOSA-N 0 0 385.445 3.144 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCN(c2cc(Cl)ccc2OC)C1 ZINC000192558136 1432859755 /nfs/dbraw/zinc/85/97/55/1432859755.db2.gz CLQAHNFXMOJRRK-ZDUSSCGKSA-N 0 0 379.848 3.472 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCN(c2cc(Cl)ccc2OC)C1 ZINC000192558120 1432859787 /nfs/dbraw/zinc/85/97/87/1432859787.db2.gz CLQAHNFXMOJRRK-CYBMUJFWSA-N 0 0 379.848 3.472 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN([C@@H](C)c2ccc(F)cc2F)CC1 ZINC000192565625 1432861025 /nfs/dbraw/zinc/86/10/25/1432861025.db2.gz CAXZXMZLLNQMLO-ZDUSSCGKSA-N 0 0 379.411 3.281 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC(O)(c2ccccc2Cl)CC1 ZINC000192571527 1432861518 /nfs/dbraw/zinc/86/15/18/1432861518.db2.gz ZDNGNDJCMXUDQE-UHFFFAOYSA-N 0 0 390.823 3.137 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCC(=O)Nc1ccccc1C(=O)NC(C)C ZINC000192572427 1432861694 /nfs/dbraw/zinc/86/16/94/1432861694.db2.gz ZFXIFDAIJXCOHG-UHFFFAOYSA-N 0 0 384.436 3.400 20 5 GGBDRN CN(C)C(=O)c1ccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000192572171 1432861726 /nfs/dbraw/zinc/86/17/26/1432861726.db2.gz NCMCYZDXUIKARF-UHFFFAOYSA-N 0 0 383.429 3.441 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCC1=CCN(C(=O)OC(C)(C)C)CC1 ZINC000192577319 1432862227 /nfs/dbraw/zinc/86/22/27/1432862227.db2.gz YBWUONPISVXLSK-UHFFFAOYSA-N 0 0 375.425 3.200 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000192584205 1432862985 /nfs/dbraw/zinc/86/29/85/1432862985.db2.gz WKQLFQQGKOWBIU-UHFFFAOYSA-N 0 0 376.804 3.478 20 5 GGBDRN CC(=O)c1cccc(OC[C@H](O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000192586947 1432863156 /nfs/dbraw/zinc/86/31/56/1432863156.db2.gz AFXHCWKHGLSJQB-QGZVFWFLSA-N 0 0 392.839 3.323 20 5 GGBDRN CCc1nc(CN2CCC(CNc3c([N+](=O)[O-])c(C)nn3CC)CC2)cs1 ZINC000192587326 1432863197 /nfs/dbraw/zinc/86/31/97/1432863197.db2.gz OWHLBYFEPBBBKI-UHFFFAOYSA-N 0 0 392.529 3.463 20 5 GGBDRN CC(C)C(CNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)C(C)C ZINC000192604660 1432865199 /nfs/dbraw/zinc/86/51/99/1432865199.db2.gz IKECFZOMDOWNFA-CQSZACIVSA-N 0 0 381.498 3.305 20 5 GGBDRN O=C(Nc1nc2c(s1)CCCC2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000192605114 1432865250 /nfs/dbraw/zinc/86/52/50/1432865250.db2.gz AWTWEALXRZUPMN-UHFFFAOYSA-N 0 0 387.465 3.284 20 5 GGBDRN CC(C)C(CNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)C(C)C ZINC000192604647 1432865271 /nfs/dbraw/zinc/86/52/71/1432865271.db2.gz IKECFZOMDOWNFA-AWEZNQCLSA-N 0 0 381.498 3.305 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000192638644 1432869903 /nfs/dbraw/zinc/86/99/03/1432869903.db2.gz WLWSVIPZCPRIPV-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)Nc2c(C)cccc2C(C)C)cc1[N+](=O)[O-] ZINC000192661534 1432872555 /nfs/dbraw/zinc/87/25/55/1432872555.db2.gz LQJBMLDQKKNHHN-UHFFFAOYSA-N 0 0 385.420 3.404 20 5 GGBDRN CCc1ccccc1N1C[C@H](C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)CC1=O ZINC000192677059 1432874495 /nfs/dbraw/zinc/87/44/95/1432874495.db2.gz FLXVXZOTTBRISI-GFCCVEGCSA-N 0 0 389.358 3.427 20 5 GGBDRN Cc1cccc([C@H](CNC(=O)c2c(C)cccc2[N+](=O)[O-])N2CCOCC2)c1 ZINC000192688808 1432875641 /nfs/dbraw/zinc/87/56/41/1432875641.db2.gz IPQRKKUNNKWWJT-IBGZPJMESA-N 0 0 383.448 3.015 20 5 GGBDRN CCCCN(C(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000192692246 1432875870 /nfs/dbraw/zinc/87/58/70/1432875870.db2.gz PCCKGCJXRBYLIE-UHFFFAOYSA-N 0 0 385.420 3.167 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN(CCS(=O)(=O)c1ccc(F)cc1)C1CC1 ZINC000192695436 1432876427 /nfs/dbraw/zinc/87/64/27/1432876427.db2.gz QCDFYKOCIHOEJC-UHFFFAOYSA-N 0 0 378.425 3.172 20 5 GGBDRN Cc1c(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cnn1C1CCCC1 ZINC000192700738 1432876904 /nfs/dbraw/zinc/87/69/04/1432876904.db2.gz KUHSOKBULAMZID-UHFFFAOYSA-N 0 0 381.396 3.048 20 5 GGBDRN COC(=O)[C@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000192701437 1432877131 /nfs/dbraw/zinc/87/71/31/1432877131.db2.gz ZQXVBSOGWXNAIW-CQSZACIVSA-N 0 0 380.759 3.074 20 5 GGBDRN CCc1nn(C)c(NC2CCN(C(=O)[C@H](CC)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000192711820 1432878690 /nfs/dbraw/zinc/87/86/90/1432878690.db2.gz QYYLYFBSHJRMFB-QGZVFWFLSA-N 0 0 399.495 3.487 20 5 GGBDRN COc1ccc(NC(=O)COc2c(F)c(F)c(F)c(F)c2F)c([N+](=O)[O-])c1 ZINC000192722890 1432880111 /nfs/dbraw/zinc/88/01/11/1432880111.db2.gz CGODXNULCWMNBL-UHFFFAOYSA-N 0 0 392.236 3.316 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000192727345 1432880860 /nfs/dbraw/zinc/88/08/60/1432880860.db2.gz FPDJKAAIHLUQJK-AWEZNQCLSA-N 0 0 382.367 3.299 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(S(=O)(=O)NC(C)C)cc1 ZINC000192730424 1432881369 /nfs/dbraw/zinc/88/13/69/1432881369.db2.gz OYKHNBZXHUZEDP-UHFFFAOYSA-N 0 0 391.449 3.151 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000192733559 1432881942 /nfs/dbraw/zinc/88/19/42/1432881942.db2.gz YAMVGIFDDAXBOC-CVEARBPZSA-N 0 0 393.875 3.257 20 5 GGBDRN Cc1cnc(CNc2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])o1 ZINC000192736163 1432882399 /nfs/dbraw/zinc/88/23/99/1432882399.db2.gz DGVZJMXFOVUTQH-UHFFFAOYSA-N 0 0 388.405 3.304 20 5 GGBDRN COC(=O)[C@H](CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000192747903 1432884131 /nfs/dbraw/zinc/88/41/31/1432884131.db2.gz PVMUBJWVUZAEKG-MEDUHNTESA-N 0 0 392.358 3.050 20 5 GGBDRN COC(=O)[C@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000192768710 1432887619 /nfs/dbraw/zinc/88/76/19/1432887619.db2.gz MAVJOVBSODSERU-OAHLLOKOSA-N 0 0 380.759 3.074 20 5 GGBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CCOC[C@H]1C1CC1 ZINC000192805470 1432893112 /nfs/dbraw/zinc/89/31/12/1432893112.db2.gz ARRWDIKFIYOSFJ-FQEVSTJZSA-N 0 0 382.416 3.425 20 5 GGBDRN CC[C@](NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])(C(N)=O)C(C)C ZINC000192819197 1432894607 /nfs/dbraw/zinc/89/46/07/1432894607.db2.gz AWPNLRKFEPNZKA-OAQYLSRUSA-N 0 0 399.447 3.194 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NCc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000192827803 1432895732 /nfs/dbraw/zinc/89/57/32/1432895732.db2.gz UISLSGHAFPMGKV-UHFFFAOYSA-N 0 0 387.436 3.463 20 5 GGBDRN COc1cccc(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)c1[N+](=O)[O-] ZINC000192831268 1432896209 /nfs/dbraw/zinc/89/62/09/1432896209.db2.gz BARAOTAWJUKHBF-GFCCVEGCSA-N 0 0 382.376 3.187 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCOc2ccc3ccccc3c2)cc1 ZINC000192854661 1432899388 /nfs/dbraw/zinc/89/93/88/1432899388.db2.gz NUNKYDNHSCYVBS-UHFFFAOYSA-N 0 0 386.429 3.246 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)c1[N+](=O)[O-] ZINC000192858479 1432899831 /nfs/dbraw/zinc/89/98/31/1432899831.db2.gz BWMPHKQXOPJIQF-LBPRGKRZSA-N 0 0 378.257 3.192 20 5 GGBDRN O=C(N[C@@H]1C[C@@H]2OCCC[C@H]12)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192870795 1432901629 /nfs/dbraw/zinc/90/16/29/1432901629.db2.gz PFSVRGKHQZJTII-POAQFYNOSA-N 0 0 382.416 3.471 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CNC(=O)CC12CC3CC(CC(C3)C1)C2 ZINC000192892687 1432903803 /nfs/dbraw/zinc/90/38/03/1432903803.db2.gz FQCALBTYEQWKST-UHFFFAOYSA-N 0 0 399.491 3.276 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2cccc(OC)c2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000192897600 1432904320 /nfs/dbraw/zinc/90/43/20/1432904320.db2.gz IHMJXJOBUXDCOD-QGZVFWFLSA-N 0 0 383.448 3.340 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)nc2ccccc12 ZINC000192911924 1432906452 /nfs/dbraw/zinc/90/64/52/1432906452.db2.gz KTOVOSNMICWFMY-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)cc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000192916369 1432907250 /nfs/dbraw/zinc/90/72/50/1432907250.db2.gz HBLZUAJTJDNFFM-UHFFFAOYSA-N 0 0 392.419 3.135 20 5 GGBDRN Cc1cc(NC(=O)Cc2ccc3c(c2)OCCO3)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000192920292 1432907816 /nfs/dbraw/zinc/90/78/16/1432907816.db2.gz MJQLNBDCKNJICU-UHFFFAOYSA-N 0 0 394.387 3.041 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC=C(c3ccc(O)cc3)CC2)c1C ZINC000192939540 1432910450 /nfs/dbraw/zinc/91/04/50/1432910450.db2.gz LOLVZYKEQARNDQ-UHFFFAOYSA-N 0 0 388.445 3.395 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1C ZINC000192942902 1432911046 /nfs/dbraw/zinc/91/10/46/1432911046.db2.gz CWXDDCAGWVPETD-UHFFFAOYSA-N 0 0 397.435 3.216 20 5 GGBDRN COc1cccc2c1CCN(S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])CC2 ZINC000192944579 1432911115 /nfs/dbraw/zinc/91/11/15/1432911115.db2.gz FOXIVLGYJRLKFK-UHFFFAOYSA-N 0 0 396.852 3.046 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 ZINC000192960612 1432913368 /nfs/dbraw/zinc/91/33/68/1432913368.db2.gz LWTLIEXDQAOAHX-GJZGRUSLSA-N 0 0 384.436 3.473 20 5 GGBDRN COc1ccc(C2=N/C(=C/c3ccc(-n4cccn4)cc3)C(=O)O2)cc1[N+](=O)[O-] ZINC000192972141 1432915122 /nfs/dbraw/zinc/91/51/22/1432915122.db2.gz YUMVQXMXXSRTFD-LFIBNONCSA-N 0 0 390.355 3.134 20 5 GGBDRN CC(C)NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000192978548 1432916091 /nfs/dbraw/zinc/91/60/91/1432916091.db2.gz IMDPTDPNDZJCBS-UHFFFAOYSA-N 0 0 387.461 3.391 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)C(=O)NCc3ccccc3[N+](=O)[O-])c2)cs1 ZINC000192980934 1432916591 /nfs/dbraw/zinc/91/65/91/1432916591.db2.gz GNCUJKNHQXIOPD-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC=C(c2ccc(F)cc2)CC1 ZINC000192989429 1432918087 /nfs/dbraw/zinc/91/80/87/1432918087.db2.gz SPGRMQKVRGHWEQ-UHFFFAOYSA-N 0 0 385.395 3.470 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000192999206 1432919669 /nfs/dbraw/zinc/91/96/69/1432919669.db2.gz ANQXQLVSFYDPHA-HIFRSBDPSA-N 0 0 379.457 3.375 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N(C)Cc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000193023047 1432923455 /nfs/dbraw/zinc/92/34/55/1432923455.db2.gz CLVDDWRRQQTFBT-UHFFFAOYSA-N 0 0 399.447 3.115 20 5 GGBDRN O=C(CSCc1ccc([N+](=O)[O-])cc1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000193081059 1432933266 /nfs/dbraw/zinc/93/32/66/1432933266.db2.gz FIVQUSTXZOHQLZ-UHFFFAOYSA-N 0 0 385.445 3.359 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000193106358 1432937005 /nfs/dbraw/zinc/93/70/05/1432937005.db2.gz OPHLERBRNGFYFN-AWEZNQCLSA-N 0 0 384.440 3.324 20 5 GGBDRN CC1CCN(c2ccc(C(=O)Nc3cccc4c3C(=O)NC4)cc2[N+](=O)[O-])CC1 ZINC000193126790 1432940572 /nfs/dbraw/zinc/94/05/72/1432940572.db2.gz VGHCVIIFFCHBEH-UHFFFAOYSA-N 0 0 394.431 3.327 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC(O)(c3ccccc3Cl)CC2)c1 ZINC000193133143 1432941726 /nfs/dbraw/zinc/94/17/26/1432941726.db2.gz MEUVKPLCDBIQLG-SFHVURJKSA-N 0 0 376.840 3.265 20 5 GGBDRN Cc1ccc(Cl)cc1N1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000193143307 1432943545 /nfs/dbraw/zinc/94/35/45/1432943545.db2.gz ZIHUGVCZYOTJTQ-UHFFFAOYSA-N 0 0 399.838 3.395 20 5 GGBDRN Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000193144700 1432944267 /nfs/dbraw/zinc/94/42/67/1432944267.db2.gz KWVBVNOEGHCQIV-UHFFFAOYSA-N 0 0 382.424 3.222 20 5 GGBDRN COC(=O)C1(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CCCCCC1 ZINC000193168246 1432949342 /nfs/dbraw/zinc/94/93/42/1432949342.db2.gz KTDNZXMOWJYDJL-UHFFFAOYSA-N 0 0 375.425 3.165 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccncc3)no2)ccc1[N+](=O)[O-] ZINC000193200505 1432956770 /nfs/dbraw/zinc/95/67/70/1432956770.db2.gz CYULYSDNMBVHTQ-INIZCTEOSA-N 0 0 379.376 3.326 20 5 GGBDRN CCCCNC(=O)c1ccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000193201930 1432957416 /nfs/dbraw/zinc/95/74/16/1432957416.db2.gz BLPNJUYRAYODAT-UHFFFAOYSA-N 0 0 384.436 3.124 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000193224455 1432962111 /nfs/dbraw/zinc/96/21/11/1432962111.db2.gz SRXWJMKDZSJUSR-UHFFFAOYSA-N 0 0 384.392 3.375 20 5 GGBDRN O=C(c1sccc1-n1cccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000193226027 1432962505 /nfs/dbraw/zinc/96/25/05/1432962505.db2.gz RLPJRMAIQNLPLM-UHFFFAOYSA-N 0 0 382.445 3.409 20 5 GGBDRN COc1cc(CCNC(=O)c2cc(Cl)c(Cl)[nH]2)c([N+](=O)[O-])cc1OC ZINC000193227727 1432962782 /nfs/dbraw/zinc/96/27/82/1432962782.db2.gz QLHWRVOPLQBFLQ-UHFFFAOYSA-N 0 0 388.207 3.219 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cccs1)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193231223 1432963361 /nfs/dbraw/zinc/96/33/61/1432963361.db2.gz GUPKTHHARUVXCR-INIZCTEOSA-N 0 0 375.450 3.069 20 5 GGBDRN 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ZINC000193244583 1432966534 /nfs/dbraw/zinc/96/65/34/1432966534.db2.gz OYNQFSXPFJIVKC-GFCCVEGCSA-N 0 0 391.374 3.131 20 5 GGBDRN Cc1nc(Cl)ccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000193255345 1432968363 /nfs/dbraw/zinc/96/83/63/1432968363.db2.gz KMSHLZFXVIPEPI-SNVBAGLBSA-N 0 0 392.774 3.082 20 5 GGBDRN COc1c(C)ccc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1C ZINC000193261996 1432970104 /nfs/dbraw/zinc/97/01/04/1432970104.db2.gz GDCBEAXSIQJQFP-UHFFFAOYSA-N 0 0 381.392 3.362 20 5 GGBDRN C[C@@H]1CCC[C@@H](C)C1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000193263779 1432970484 /nfs/dbraw/zinc/97/04/84/1432970484.db2.gz HKPABYSGHNIHBR-CHWSQXEVSA-N 0 0 375.425 3.224 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)NC1CCN(C(=O)c2ccccc2F)CC1 ZINC000193264542 1432970876 /nfs/dbraw/zinc/97/08/76/1432970876.db2.gz WECPMHPAGDHJOE-UHFFFAOYSA-N 0 0 386.383 3.160 20 5 GGBDRN C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000193272340 1432972357 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0 0 395.245 3.424 20 5 GGBDRN Cc1cc(NC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)ccc1[N+](=O)[O-] ZINC000193604677 1433027533 /nfs/dbraw/zinc/02/75/33/1433027533.db2.gz BSZRXFKXTFQVDQ-UHFFFAOYSA-N 0 0 382.298 3.081 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)[C@H](C)c2cc(F)ccc2F)cccc1[N+](=O)[O-] ZINC000193608565 1433028357 /nfs/dbraw/zinc/02/83/57/1433028357.db2.gz CZPHXAOHOOBFMA-LLVKDONJSA-N 0 0 377.347 3.340 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)OCc2cnn(C)c2)cc1[N+](=O)[O-])c1ccccn1 ZINC000193631211 1433031333 /nfs/dbraw/zinc/03/13/33/1433031333.db2.gz PDEZVMTWLREJOT-CYBMUJFWSA-N 0 0 381.392 3.253 20 5 GGBDRN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000193635410 1433031820 /nfs/dbraw/zinc/03/18/20/1433031820.db2.gz IBCFXFOFILGCFE-UHFFFAOYSA-N 0 0 397.410 3.292 20 5 GGBDRN CCN(Cc1ccc2c(c1)OCCO2)C(=O)Cn1ccc2c1cccc2[N+](=O)[O-] ZINC000193637554 1433032090 /nfs/dbraw/zinc/03/20/90/1433032090.db2.gz OLYVJMVYAFYXSA-UHFFFAOYSA-N 0 0 395.415 3.369 20 5 GGBDRN 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1433062642 /nfs/dbraw/zinc/06/26/42/1433062642.db2.gz IXTVCQYLPLJKCM-UHFFFAOYSA-N 0 0 378.360 3.364 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000193811735 1433065052 /nfs/dbraw/zinc/06/50/52/1433065052.db2.gz ZEAFTVWNFHSQKB-UHFFFAOYSA-N 0 0 381.310 3.211 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000193812302 1433065082 /nfs/dbraw/zinc/06/50/82/1433065082.db2.gz OFQZSKUWWDVEHE-UHFFFAOYSA-N 0 0 397.309 3.091 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc2oc(C3CC3)nc2c1 ZINC000193814734 1433065724 /nfs/dbraw/zinc/06/57/24/1433065724.db2.gz RIYZJVJDKMIPIP-UHFFFAOYSA-N 0 0 394.387 3.211 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CC=C(c2ccc(O)cc2)CC1 ZINC000193817077 1433066254 /nfs/dbraw/zinc/06/62/54/1433066254.db2.gz OMFBZKDDMJKQGT-UHFFFAOYSA-N 0 0 390.399 3.416 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCCCN(C)c1ccccc1 ZINC000193818911 1433066660 /nfs/dbraw/zinc/06/66/60/1433066660.db2.gz 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COc1cccc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c1[N+](=O)[O-] ZINC000193899799 1433080713 /nfs/dbraw/zinc/08/07/13/1433080713.db2.gz HTQJOBACJNIETA-UHFFFAOYSA-N 0 0 397.431 3.160 20 5 GGBDRN CN(Cc1ccc(Br)o1)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000193907383 1433082600 /nfs/dbraw/zinc/08/26/00/1433082600.db2.gz IMUUCJOZPXUXGQ-UHFFFAOYSA-N 0 0 380.198 3.471 20 5 GGBDRN Cc1occc1CN(C)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000193908814 1433082632 /nfs/dbraw/zinc/08/26/32/1433082632.db2.gz CSWXQGFAGQOJKE-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000193911743 1433083202 /nfs/dbraw/zinc/08/32/02/1433083202.db2.gz SUGLSXJBECPFFU-UHFFFAOYSA-N 0 0 379.394 3.102 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCC3([NH+]4CCSCC4)CCCC3)cc2N1 ZINC000193912534 1433083311 /nfs/dbraw/zinc/08/33/11/1433083311.db2.gz XUMGTVNZXMUPNH-UHFFFAOYSA-N 0 0 390.509 3.253 20 5 GGBDRN CCN(C1CCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193911670 1433083347 /nfs/dbraw/zinc/08/33/47/1433083347.db2.gz HSXWMORTTCYLGU-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN Cc1cccc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)c1[N+](=O)[O-] ZINC000193913640 1433083522 /nfs/dbraw/zinc/08/35/22/1433083522.db2.gz PDZBUVBSKNHRRD-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)cc1[N+](=O)[O-] ZINC000193915274 1433083993 /nfs/dbraw/zinc/08/39/93/1433083993.db2.gz HMNUJLFWYWERGE-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN COc1cccc(C(=O)Nc2nc3ccccc3nc2N2CCCC2)c1[N+](=O)[O-] ZINC000193921848 1433084987 /nfs/dbraw/zinc/08/49/87/1433084987.db2.gz ACXABAZEDWSBOU-UHFFFAOYSA-N 0 0 393.403 3.399 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1cccc(Cl)c1-n1cncn1 ZINC000193925825 1433085948 /nfs/dbraw/zinc/08/59/48/1433085948.db2.gz HHJWQHHYTIORTO-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN CN(c1ccccc1)C1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000193929353 1433086893 /nfs/dbraw/zinc/08/68/93/1433086893.db2.gz DMGFLTFABMAYHO-UHFFFAOYSA-N 0 0 379.420 3.212 20 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C[C@@H](NC(=O)C(=O)Nc1ccccc1N1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000193942361 1433089657 /nfs/dbraw/zinc/08/96/57/1433089657.db2.gz JZPDIRAXTNCKTP-OAHLLOKOSA-N 0 0 396.447 3.401 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000193944640 1433089899 /nfs/dbraw/zinc/08/98/99/1433089899.db2.gz UERFJNWJZIVQGB-SNVBAGLBSA-N 0 0 377.784 3.073 20 5 GGBDRN C[C@H]1CCCC[C@H]1CNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000193946061 1433090106 /nfs/dbraw/zinc/09/01/06/1433090106.db2.gz ACBAWSKNGQAQJE-KBPBESRZSA-N 0 0 375.425 3.225 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000193945281 1433090125 /nfs/dbraw/zinc/09/01/25/1433090125.db2.gz OEJLPDDIQXQGFT-VIFPVBQESA-N 0 0 397.309 3.151 20 5 GGBDRN COc1cccc(C(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)c1[N+](=O)[O-] ZINC000193963887 1433093109 /nfs/dbraw/zinc/09/31/09/1433093109.db2.gz JNCPJUVLTPXTJN-UHFFFAOYSA-N 0 0 385.420 3.239 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(Cc2ccco2)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000193971118 1433093991 /nfs/dbraw/zinc/09/39/91/1433093991.db2.gz SRMSCQXKCOVKOS-UHFFFAOYSA-N 0 0 383.360 3.257 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)c1ccccc1C(F)(F)F ZINC000193985335 1433096470 /nfs/dbraw/zinc/09/64/70/1433096470.db2.gz ZBIABYMBNVZJPZ-UHFFFAOYSA-N 0 0 390.339 3.101 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCc3nnc(C4CC4)o3)cc2[N+](=O)[O-])C1 ZINC000193992512 1433097496 /nfs/dbraw/zinc/09/74/96/1433097496.db2.gz KNHJNWNCRZHJAB-STQMWFEESA-N 0 0 399.451 3.268 20 5 GGBDRN COc1cccc(C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)c1[N+](=O)[O-] ZINC000193998036 1433098259 /nfs/dbraw/zinc/09/82/59/1433098259.db2.gz IICOPAMQBMEDAS-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000194013664 1433101098 /nfs/dbraw/zinc/10/10/98/1433101098.db2.gz DFWQKCXYQAUORL-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cccc(-c3cnco3)c2)cc1[N+](=O)[O-] ZINC000194023551 1433102562 /nfs/dbraw/zinc/10/25/62/1433102562.db2.gz VZJLCVBNOIWCIN-UHFFFAOYSA-N 0 0 375.362 3.059 20 5 GGBDRN CC(C)NC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000194023149 1433102585 /nfs/dbraw/zinc/10/25/85/1433102585.db2.gz QNOJBEQVKFXIQL-UHFFFAOYSA-N 0 0 397.840 3.187 20 5 GGBDRN CNS(=O)(=O)c1ccc(Nc2ccc(COC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000194044019 1433106449 /nfs/dbraw/zinc/10/64/49/1433106449.db2.gz SKQBWJANOSORTB-UHFFFAOYSA-N 0 0 379.438 3.172 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCC(OC[C@@H]3CCCCO3)CC2)c([N+](=O)[O-])c1 ZINC000194047244 1433106957 /nfs/dbraw/zinc/10/69/57/1433106957.db2.gz AADVJOQEUXLEAU-KRWDZBQOSA-N 0 0 379.413 3.053 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000194051681 1433107960 /nfs/dbraw/zinc/10/79/60/1433107960.db2.gz BNOFXTPDVAXOMM-QGZVFWFLSA-N 0 0 392.419 3.330 20 5 GGBDRN Cc1nnc([C@H]2Cc3ccccc3CN2CCOc2ccccc2[N+](=O)[O-])o1 ZINC000194052976 1433108242 /nfs/dbraw/zinc/10/82/42/1433108242.db2.gz CJFFPGQBBVBFCX-GOSISDBHSA-N 0 0 380.404 3.465 20 5 GGBDRN COc1cccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c1[N+](=O)[O-] ZINC000194056626 1433109278 /nfs/dbraw/zinc/10/92/78/1433109278.db2.gz CCPVJPIHIGJORV-HUUCEWRRSA-N 0 0 399.447 3.465 20 5 GGBDRN COc1cccc(C(=O)NCCOc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000194060043 1433109597 /nfs/dbraw/zinc/10/95/97/1433109597.db2.gz RVQMQAGGKINBBR-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN COc1cccc(C)c1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000194061721 1433109839 /nfs/dbraw/zinc/10/98/39/1433109839.db2.gz XJGKWZLIZLZIBF-UHFFFAOYSA-N 0 0 385.420 3.288 20 5 GGBDRN COCCNC(=O)c1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1Cl ZINC000194061568 1433109851 /nfs/dbraw/zinc/10/98/51/1433109851.db2.gz DHEBDAUSXLJZOD-UHFFFAOYSA-N 0 0 391.811 3.185 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000194070575 1433111745 /nfs/dbraw/zinc/11/17/45/1433111745.db2.gz ZIEMSADAMHMMNB-PXNSSMCTSA-N 0 0 398.463 3.474 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)nnn1Cc1ccc(F)cc1 ZINC000194075056 1433112435 /nfs/dbraw/zinc/11/24/35/1433112435.db2.gz JKPQZFQPDRGRLR-GFCCVEGCSA-N 0 0 383.383 3.173 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c1[N+](=O)[O-] ZINC000194078620 1433113222 /nfs/dbraw/zinc/11/32/22/1433113222.db2.gz AKXXRMMOXSTYRD-UHFFFAOYSA-N 0 0 389.795 3.401 20 5 GGBDRN Cc1csc([C@H]2CN(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CCO2)n1 ZINC000194079238 1433113253 /nfs/dbraw/zinc/11/32/53/1433113253.db2.gz NKXCPHLRUBOGEL-IUODEOHRSA-N 0 0 376.438 3.204 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@@H]1C(=O)Nc2ccccc21 ZINC000194098531 1433117059 /nfs/dbraw/zinc/11/70/59/1433117059.db2.gz PJXIWOXCKIYFOL-LRDDRELGSA-N 0 0 385.445 3.318 20 5 GGBDRN CCC(CC)C(=O)N1CCC(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000194099952 1433117452 /nfs/dbraw/zinc/11/74/52/1433117452.db2.gz HFIPTBZWOVKBKU-UHFFFAOYSA-N 0 0 388.468 3.319 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CC=C(c3c[nH]c4cc(F)ccc43)CC2)c1[N+](=O)[O-] ZINC000194106686 1433118761 /nfs/dbraw/zinc/11/87/61/1433118761.db2.gz WBTMIRCTPDKTKF-UHFFFAOYSA-N 0 0 383.383 3.187 20 5 GGBDRN COc1cccc(C(=O)NCc2ccccc2OCC(F)(F)F)c1[N+](=O)[O-] ZINC000194111961 1433119605 /nfs/dbraw/zinc/11/96/05/1433119605.db2.gz JWFNFIUNENHCDE-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CCc2[nH]c3ccccc3c2C1 ZINC000194111946 1433119696 /nfs/dbraw/zinc/11/96/96/1433119696.db2.gz POFVGJAVTHEDSB-UHFFFAOYSA-N 0 0 398.806 3.253 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)Cc2ccccc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000194112753 1433119748 /nfs/dbraw/zinc/11/97/48/1433119748.db2.gz CBOJLWYYMOSKPQ-AWEZNQCLSA-N 0 0 379.420 3.153 20 5 GGBDRN CCCN(C[C@@H]1COc2ccccc2O1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000194118191 1433120653 /nfs/dbraw/zinc/12/06/53/1433120653.db2.gz UEYFXASRCODIIV-CQSZACIVSA-N 0 0 396.403 3.163 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@@H]2CCCC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000194117121 1433120713 /nfs/dbraw/zinc/12/07/13/1433120713.db2.gz MSMGOIMHCLVZNK-LSDHHAIUSA-N 0 0 391.468 3.054 20 5 GGBDRN CCCN(C(=O)Cn1nc(-c2ccccc2)ccc1=O)c1cccc([N+](=O)[O-])c1 ZINC000194120929 1433121039 /nfs/dbraw/zinc/12/10/39/1433121039.db2.gz NATIUKNSSZALDY-UHFFFAOYSA-N 0 0 392.415 3.262 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@H]1CCCN(CC(F)(F)F)C1 ZINC000194119073 1433121134 /nfs/dbraw/zinc/12/11/34/1433121134.db2.gz SWHLVRHKCIBXBR-LLVKDONJSA-N 0 0 393.793 3.481 20 5 GGBDRN CCC[C@]1(COC)CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000194126426 1433122050 /nfs/dbraw/zinc/12/20/50/1433122050.db2.gz SWBNBVWMDBSIAP-GOSISDBHSA-N 0 0 393.465 3.113 20 5 GGBDRN CCCN(C(=O)c1cccc(N2C(=O)CCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000194131481 1433122683 /nfs/dbraw/zinc/12/26/83/1433122683.db2.gz PNMGKQSSMKFWRU-UHFFFAOYSA-N 0 0 381.388 3.305 20 5 GGBDRN CCCN(C(=O)c1ccc(=O)n(-c2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000194132254 1433122950 /nfs/dbraw/zinc/12/29/50/1433122950.db2.gz LXVWKJJRTATEPG-UHFFFAOYSA-N 0 0 378.388 3.198 20 5 GGBDRN CCCN(C(=O)CCn1cnc2c(C)cccc2c1=O)c1cccc([N+](=O)[O-])c1 ZINC000194135353 1433123548 /nfs/dbraw/zinc/12/35/48/1433123548.db2.gz JELSTEXSUDBSCA-UHFFFAOYSA-N 0 0 394.431 3.446 20 5 GGBDRN CCCN(C(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000194140059 1433124218 /nfs/dbraw/zinc/12/42/18/1433124218.db2.gz IBBSDASOWLBYSL-INIZCTEOSA-N 0 0 390.484 3.415 20 5 GGBDRN COc1cccc(C(=O)NCc2ccc(-n3ccnc3C)c(F)c2)c1[N+](=O)[O-] ZINC000194144703 1433125787 /nfs/dbraw/zinc/12/57/87/1433125787.db2.gz CCMRWNWZZPBTFO-UHFFFAOYSA-N 0 0 384.367 3.167 20 5 GGBDRN COc1cccc(C(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)c1[N+](=O)[O-] ZINC000194154482 1433127709 /nfs/dbraw/zinc/12/77/09/1433127709.db2.gz NDJGWUAYGNTLGR-CYBMUJFWSA-N 0 0 383.404 3.221 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N[C@H]2CCN(C)C(=O)C2)cc1[N+](=O)[O-] ZINC000194189926 1433134723 /nfs/dbraw/zinc/13/47/23/1433134723.db2.gz KZVHUHXHNRLXFI-AWEZNQCLSA-N 0 0 379.482 3.084 20 5 GGBDRN COc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1O ZINC000194192132 1433135504 /nfs/dbraw/zinc/13/55/04/1433135504.db2.gz NYZPKYRVGLRJAJ-UHFFFAOYSA-N 0 0 385.420 3.229 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)N[C@@H]3CCN(C)C(=O)C3)cc2[N+](=O)[O-])cc1 ZINC000194195437 1433136009 /nfs/dbraw/zinc/13/60/09/1433136009.db2.gz VBWHRYBUUGOHPX-OAHLLOKOSA-N 0 0 399.472 3.405 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)N[C@H]3CCN(C)C(=O)C3)cc2[N+](=O)[O-])cc1 ZINC000194195455 1433136174 /nfs/dbraw/zinc/13/61/74/1433136174.db2.gz VBWHRYBUUGOHPX-HNNXBMFYSA-N 0 0 399.472 3.405 20 5 GGBDRN CCCN(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@@H](C)C(=O)Nc1ccccc1 ZINC000194198485 1433136986 /nfs/dbraw/zinc/13/69/86/1433136986.db2.gz JNVQFQDPISFYGF-AWEZNQCLSA-N 0 0 385.420 3.483 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ncnc2c1cnn2-c1ccccc1 ZINC000194220215 1433141441 /nfs/dbraw/zinc/14/14/41/1433141441.db2.gz NBFQFVDCNSXLPJ-UHFFFAOYSA-N 0 0 376.376 3.344 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NCc3nc4cccnc4[nH]3)cc2[N+](=O)[O-])CC1 ZINC000194243237 1433147299 /nfs/dbraw/zinc/14/72/99/1433147299.db2.gz RQLOHUJLJLHWQL-UHFFFAOYSA-N 0 0 394.435 3.032 20 5 GGBDRN COc1cccc(C(=O)N[C@H](c2nc(-c3cccnc3)no2)C(C)C)c1[N+](=O)[O-] ZINC000194246838 1433148280 /nfs/dbraw/zinc/14/82/80/1433148280.db2.gz ODMYCRRANWVYGS-HNNXBMFYSA-N 0 0 397.391 3.176 20 5 GGBDRN C[C@@H](CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])Cn1cccn1 ZINC000194273730 1433153733 /nfs/dbraw/zinc/15/37/33/1433153733.db2.gz AFSILELHPZEKLR-INIZCTEOSA-N 0 0 394.431 3.436 20 5 GGBDRN COC[C@@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccc(Cl)cc1 ZINC000194277267 1433154100 /nfs/dbraw/zinc/15/41/00/1433154100.db2.gz SJLOFKBVDCKLSL-MRXNPFEDSA-N 0 0 393.827 3.444 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)c3cccc(OC)c3[N+](=O)[O-])cc2)n1 ZINC000194277782 1433154281 /nfs/dbraw/zinc/15/42/81/1433154281.db2.gz UKEXNGBZIJMJDX-UHFFFAOYSA-N 0 0 396.403 3.188 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3cncc4ccccc43)CC2)c1 ZINC000194290410 1433156287 /nfs/dbraw/zinc/15/62/87/1433156287.db2.gz PHOBJBXWUXDTCO-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN CCC(=O)N1CCCC[C@H]1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000194291343 1433156524 /nfs/dbraw/zinc/15/65/24/1433156524.db2.gz ZCRNBBZFDKGDLL-HNNXBMFYSA-N 0 0 388.449 3.448 20 5 GGBDRN CCC(=O)N1CCCC[C@@H]1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000194291327 1433156538 /nfs/dbraw/zinc/15/65/38/1433156538.db2.gz ZCRNBBZFDKGDLL-OAHLLOKOSA-N 0 0 388.449 3.448 20 5 GGBDRN C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000194293646 1433156940 /nfs/dbraw/zinc/15/69/40/1433156940.db2.gz YUKPODFCAPAIAH-YVEFUNNKSA-N 0 0 391.493 3.132 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000194303019 1433158242 /nfs/dbraw/zinc/15/82/42/1433158242.db2.gz AFTOUAABRWBUEX-AWEZNQCLSA-N 0 0 385.420 3.249 20 5 GGBDRN CCOC(=O)[C@]1(C(C)C)CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000194308613 1433159074 /nfs/dbraw/zinc/15/90/74/1433159074.db2.gz SMNGOBMJGBLLMX-HXUWFJFHSA-N 0 0 387.436 3.056 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CC1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000194317246 1433160285 /nfs/dbraw/zinc/16/02/85/1433160285.db2.gz JQAYTIWDJYGSBJ-UHFFFAOYSA-N 0 0 398.438 3.297 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCC[C@@H]2c2ccccc2C)cc1[N+](=O)[O-] ZINC000194326524 1433162089 /nfs/dbraw/zinc/16/20/89/1433162089.db2.gz JXTZOHNYUZUXAT-QGZVFWFLSA-N 0 0 397.431 3.005 20 5 GGBDRN O=Cc1c(OS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])ccc2ccccc12 ZINC000194330267 1433162625 /nfs/dbraw/zinc/16/26/25/1433162625.db2.gz ZKZAHPXXKASECK-UHFFFAOYSA-N 0 0 375.333 3.467 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(-c2ncc3n2CCCC3)cc1 ZINC000194335290 1433163209 /nfs/dbraw/zinc/16/32/09/1433163209.db2.gz XTJUIMDIWQGOOP-UHFFFAOYSA-N 0 0 380.408 3.020 20 5 GGBDRN COc1ccc(NC(=O)CN2CCC(OCCC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000194334926 1433163262 /nfs/dbraw/zinc/16/32/62/1433163262.db2.gz RWWBOEUWCZHHQY-UHFFFAOYSA-N 0 0 379.457 3.069 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCC(OCCC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000194334907 1433163280 /nfs/dbraw/zinc/16/32/80/1433163280.db2.gz WSSVXXRGUPDLFJ-UHFFFAOYSA-N 0 0 393.484 3.459 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CC=C(c2ccc(F)cc2)CC1 ZINC000194337545 1433163553 /nfs/dbraw/zinc/16/35/53/1433163553.db2.gz BARFRYIFHMULIS-UHFFFAOYSA-N 0 0 380.372 3.351 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000194337655 1433163852 /nfs/dbraw/zinc/16/38/52/1433163852.db2.gz ODOGZUFHMNIYEZ-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN COc1cc(CCNC(=O)NCc2ccc(C)cc2C)c([N+](=O)[O-])cc1OC ZINC000194371122 1433168153 /nfs/dbraw/zinc/16/81/53/1433168153.db2.gz CHIKHRYESHIUJC-UHFFFAOYSA-N 0 0 387.436 3.271 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1cccc(C(F)(F)F)c1 ZINC000194379566 1433169120 /nfs/dbraw/zinc/16/91/20/1433169120.db2.gz FKGVKYPXUNQDTE-HNNXBMFYSA-N 0 0 384.354 3.485 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000194383591 1433169620 /nfs/dbraw/zinc/16/96/20/1433169620.db2.gz GGGPRSQVWNKAEV-HNNXBMFYSA-N 0 0 383.452 3.241 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 ZINC000194384605 1433170052 /nfs/dbraw/zinc/17/00/52/1433170052.db2.gz AKIKFSCLJBLOSL-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN COc1cccc(C(=O)N[C@H]2CCCN(c3ccc(F)cc3C)C2)c1[N+](=O)[O-] ZINC000194385673 1433170295 /nfs/dbraw/zinc/17/02/95/1433170295.db2.gz MJGYYAMUGOQWRQ-HNNXBMFYSA-N 0 0 387.411 3.450 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1 ZINC000194389697 1433170827 /nfs/dbraw/zinc/17/08/27/1433170827.db2.gz GBUNSVHKESNOLM-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)c1c(C)cccc1[N+](=O)[O-])CC3 ZINC000194393505 1433171518 /nfs/dbraw/zinc/17/15/18/1433171518.db2.gz JKPWKETXMOZSGM-UHFFFAOYSA-N 0 0 393.399 3.370 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(=O)n(C)c3)cc2[N+](=O)[O-])C1 ZINC000194397300 1433172086 /nfs/dbraw/zinc/17/20/86/1433172086.db2.gz DNHMKEGRDSXNIM-KBPBESRZSA-N 0 0 384.436 3.028 20 5 GGBDRN C[C@H](NC(=O)NCCc1ccc(-n2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000194399090 1433172263 /nfs/dbraw/zinc/17/22/63/1433172263.db2.gz KMULSPBMKLAICC-HNNXBMFYSA-N 0 0 379.420 3.383 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(c2nc3ccccc3s2)CC1 ZINC000194401103 1433172519 /nfs/dbraw/zinc/17/25/19/1433172519.db2.gz IMQFDIYJYRJXGA-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN COCCCCN(Cc1ccccc1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194414391 1433174432 /nfs/dbraw/zinc/17/44/32/1433174432.db2.gz ARXUFIXWLDYDPX-UHFFFAOYSA-N 0 0 396.440 3.351 20 5 GGBDRN CSc1ccc(C(=O)Nc2ccc(CN3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000194414134 1433174440 /nfs/dbraw/zinc/17/44/40/1433174440.db2.gz AVZKDBLSRRQSIK-UHFFFAOYSA-N 0 0 387.461 3.401 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cnn(Cc2ccccc2)c1C ZINC000194418749 1433174839 /nfs/dbraw/zinc/17/48/39/1433174839.db2.gz CARWBQCQAXVFMK-UHFFFAOYSA-N 0 0 380.404 3.087 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000194417690 1433174860 /nfs/dbraw/zinc/17/48/60/1433174860.db2.gz PFXQYWFHSROWKL-UHFFFAOYSA-N 0 0 382.416 3.371 20 5 GGBDRN COc1ccccc1CN(C)C(=O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000194428689 1433176661 /nfs/dbraw/zinc/17/66/61/1433176661.db2.gz KSRFWNXRUIMTOW-UHFFFAOYSA-N 0 0 391.855 3.347 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc(C(=O)NCC(F)(F)F)cc1 ZINC000194430241 1433176847 /nfs/dbraw/zinc/17/68/47/1433176847.db2.gz VJXNNSQSEMTDON-UHFFFAOYSA-N 0 0 396.325 3.209 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)c1 ZINC000194434684 1433177547 /nfs/dbraw/zinc/17/75/47/1433177547.db2.gz ZDROFZLIZUIERP-YJBOKZPZSA-N 0 0 376.434 3.041 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)c1 ZINC000194434709 1433177557 /nfs/dbraw/zinc/17/75/57/1433177557.db2.gz ZDROFZLIZUIERP-QAPCUYQASA-N 0 0 376.434 3.041 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(CN2C(=O)CCC2=O)cc1 ZINC000194467103 1433182821 /nfs/dbraw/zinc/18/28/21/1433182821.db2.gz WYZZMQSSOVGHKY-UHFFFAOYSA-N 0 0 381.388 3.113 20 5 GGBDRN O=C(NCc1cc[nH]n1)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000194467354 1433182860 /nfs/dbraw/zinc/18/28/60/1433182860.db2.gz AAHIBNSNBMJJEA-UHFFFAOYSA-N 0 0 399.794 3.154 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000194516276 1433191126 /nfs/dbraw/zinc/19/11/26/1433191126.db2.gz YFOAJKIMANJYJE-OAHLLOKOSA-N 0 0 396.447 3.260 20 5 GGBDRN CSc1ccc(C(=O)NCc2cccc(Cn3cccn3)c2)cc1[N+](=O)[O-] ZINC000194519922 1433191379 /nfs/dbraw/zinc/19/13/79/1433191379.db2.gz XQUGOWWOQQRMRR-UHFFFAOYSA-N 0 0 382.445 3.492 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(C(=O)Oc2ccccc2)CC1 ZINC000194544231 1433195349 /nfs/dbraw/zinc/19/53/49/1433195349.db2.gz SQZCKQMBRATUDF-UHFFFAOYSA-N 0 0 383.404 3.250 20 5 GGBDRN C[C@H](NC(=O)N1CCN(CCOc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194554568 1433196323 /nfs/dbraw/zinc/19/63/23/1433196323.db2.gz ZGNLDKUSAUFBJR-KRWDZBQOSA-N 0 0 398.463 3.062 20 5 GGBDRN C[C@@H](NC(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194556177 1433196859 /nfs/dbraw/zinc/19/68/59/1433196859.db2.gz WMQRMFHNRASFBN-OAHLLOKOSA-N 0 0 396.447 3.260 20 5 GGBDRN Cc1cccc(NC(=O)N2CCC[C@H](C(=O)NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC000194559797 1433197628 /nfs/dbraw/zinc/19/76/28/1433197628.db2.gz NGMHZXCXKZQDOO-KRWDZBQOSA-N 0 0 396.447 3.464 20 5 GGBDRN COc1cccc(C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)c1[N+](=O)[O-] ZINC000194575498 1433200234 /nfs/dbraw/zinc/20/02/34/1433200234.db2.gz CCLQXBOMRACWBZ-UHFFFAOYSA-N 0 0 387.783 3.149 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1cccc2c1OCO2 ZINC000194596759 1433203261 /nfs/dbraw/zinc/20/32/61/1433203261.db2.gz GNZVTKDSMUSEMY-UHFFFAOYSA-N 0 0 386.407 3.200 20 5 GGBDRN Cc1ccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 ZINC000194596091 1433203354 /nfs/dbraw/zinc/20/33/54/1433203354.db2.gz ZLSSXGGMHCECFD-FQEVSTJZSA-N 0 0 383.448 3.357 20 5 GGBDRN O=C1[C@@H](Sc2n[nH]c(Cc3ccccc3)n2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000194597525 1433203386 /nfs/dbraw/zinc/20/33/86/1433203386.db2.gz CVCOHLDMBYEUNH-INIZCTEOSA-N 0 0 395.444 3.201 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)nnn1Cc1ccc(F)cc1 ZINC000194606504 1433204747 /nfs/dbraw/zinc/20/47/47/1433204747.db2.gz NMJZHOPKSKRRCF-ZDUSSCGKSA-N 0 0 397.410 3.482 20 5 GGBDRN O=C(N[C@H]1CCc2n[nH]cc2C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194607863 1433204993 /nfs/dbraw/zinc/20/49/93/1433204993.db2.gz QARTZJQXCHQPKG-INIZCTEOSA-N 0 0 392.415 3.184 20 5 GGBDRN O=C(NCc1ccc2ncccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000194644991 1433210472 /nfs/dbraw/zinc/21/04/72/1433210472.db2.gz QYBXZFLOBVOTFA-UHFFFAOYSA-N 0 0 384.779 3.051 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccc2ncccc2c1 ZINC000194650181 1433211248 /nfs/dbraw/zinc/21/12/48/1433211248.db2.gz QNDOLHXMIQBMCY-UHFFFAOYSA-N 0 0 378.388 3.015 20 5 GGBDRN COc1cccc(C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c1[N+](=O)[O-] ZINC000194654784 1433211981 /nfs/dbraw/zinc/21/19/81/1433211981.db2.gz FARYSZQRFMYYBH-UHFFFAOYSA-N 0 0 397.362 3.205 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)ccc21 ZINC000194665741 1433212729 /nfs/dbraw/zinc/21/27/29/1433212729.db2.gz DRWFLKCESURPHK-UHFFFAOYSA-N 0 0 394.412 3.490 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cnc2onc(CC)c2c1 ZINC000194673387 1433213750 /nfs/dbraw/zinc/21/37/50/1433213750.db2.gz VBSKXPKPFXMIAE-UHFFFAOYSA-N 0 0 390.421 3.299 20 5 GGBDRN C[C@@H](CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])Cn1ccnc1 ZINC000194679193 1433214601 /nfs/dbraw/zinc/21/46/01/1433214601.db2.gz AFUXEWMABAUUTE-INIZCTEOSA-N 0 0 394.431 3.436 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000194681398 1433214902 /nfs/dbraw/zinc/21/49/02/1433214902.db2.gz BMRMIQQBPZOWIY-NWDGAFQWSA-N 0 0 375.812 3.244 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cc([N+](=O)[O-])ccc1Br ZINC000194683838 1433215253 /nfs/dbraw/zinc/21/52/53/1433215253.db2.gz NRBIXZWMZODUDF-UHFFFAOYSA-N 0 0 380.154 3.196 20 5 GGBDRN CN1c2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2CC1=O ZINC000194702445 1433217421 /nfs/dbraw/zinc/21/74/21/1433217421.db2.gz NIULWOTYIILCQA-UHFFFAOYSA-N 0 0 397.434 3.312 20 5 GGBDRN COc1ccccc1-n1ncc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1C ZINC000194707032 1433218012 /nfs/dbraw/zinc/21/80/12/1433218012.db2.gz NPZUPWNGWVOINZ-UHFFFAOYSA-N 0 0 380.404 3.370 20 5 GGBDRN COc1cc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1Cl ZINC000194737158 1433222374 /nfs/dbraw/zinc/22/23/74/1433222374.db2.gz BRESBQHXKYSOGJ-UHFFFAOYSA-N 0 0 398.202 3.279 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC2(Cc3cccc(F)c3)CCC2)cc1[N+](=O)[O-] ZINC000194753422 1433224942 /nfs/dbraw/zinc/22/49/42/1433224942.db2.gz MXGPPAIIMQCTBG-UHFFFAOYSA-N 0 0 385.395 3.262 20 5 GGBDRN COc1cccc(C(=O)Nc2cccn(Cc3ccc(C)cc3)c2=O)c1[N+](=O)[O-] ZINC000194763367 1433226465 /nfs/dbraw/zinc/22/64/65/1433226465.db2.gz WPNRPQDTAPHGGP-UHFFFAOYSA-N 0 0 393.399 3.374 20 5 GGBDRN COc1cccc(C(=O)N2CCN(c3ccc(F)cc3Cl)CC2)c1[N+](=O)[O-] ZINC000194776639 1433229640 /nfs/dbraw/zinc/22/96/40/1433229640.db2.gz UWANUWIAHZRZRH-UHFFFAOYSA-N 0 0 393.802 3.358 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000194777118 1433229770 /nfs/dbraw/zinc/22/97/70/1433229770.db2.gz QMPNXOKNUJCUTG-JKSUJKDBSA-N 0 0 399.378 3.094 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000194795422 1433234133 /nfs/dbraw/zinc/23/41/33/1433234133.db2.gz YCQQJUBEJNTFOQ-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN CN(C[C@H]1CCC[C@@H]1O)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194807037 1433236887 /nfs/dbraw/zinc/23/68/87/1433236887.db2.gz ONZCRWHCLCCZOO-UZLBHIALSA-N 0 0 384.432 3.407 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cc(F)cc(N2CCOCC2)c1 ZINC000194815741 1433239167 /nfs/dbraw/zinc/23/91/67/1433239167.db2.gz PAEXXUTXJVJKKV-UHFFFAOYSA-N 0 0 391.424 3.301 20 5 GGBDRN COc1cccc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000194830625 1433243089 /nfs/dbraw/zinc/24/30/89/1433243089.db2.gz XERNOJLVHDZUFU-ZDUSSCGKSA-N 0 0 375.812 3.266 20 5 GGBDRN CN(C[C@H](O)C(F)(F)F)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194835270 1433243999 /nfs/dbraw/zinc/24/39/99/1433243999.db2.gz WUPHENJWGBAGAL-INIZCTEOSA-N 0 0 398.337 3.169 20 5 GGBDRN COc1cccc(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000194836417 1433244504 /nfs/dbraw/zinc/24/45/04/1433244504.db2.gz DFLWXRFYNFTNMQ-LLVKDONJSA-N 0 0 393.802 3.405 20 5 GGBDRN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000194836073 1433244790 /nfs/dbraw/zinc/24/47/90/1433244790.db2.gz NUDUYXZHQMTRJT-UHFFFAOYSA-N 0 0 385.420 3.449 20 5 GGBDRN COC(=O)c1cc(Br)ccc1OC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000194847609 1433248125 /nfs/dbraw/zinc/24/81/25/1433248125.db2.gz LTGCMARJLAPGIA-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN COc1cccc(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1[N+](=O)[O-] ZINC000194848200 1433248130 /nfs/dbraw/zinc/24/81/30/1433248130.db2.gz JMYXSJYHXVKYDG-LLVKDONJSA-N 0 0 398.341 3.296 20 5 GGBDRN Cc1cc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)ccc1Oc1ccc(F)cc1 ZINC000194852114 1433248901 /nfs/dbraw/zinc/24/89/01/1433248901.db2.gz SNDYHVLNSZIKFG-UHFFFAOYSA-N 0 0 384.367 3.348 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000194860564 1433250563 /nfs/dbraw/zinc/25/05/63/1433250563.db2.gz MCMRPGIXIRUBNF-SFHVURJKSA-N 0 0 397.859 3.098 20 5 GGBDRN O=C(Oc1ccc(N2CCCC2=O)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194891916 1433258491 /nfs/dbraw/zinc/25/84/91/1433258491.db2.gz BVKLQTZWMSOFEX-UHFFFAOYSA-N 0 0 392.371 3.127 20 5 GGBDRN CCCN(CC(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000194896383 1433259510 /nfs/dbraw/zinc/25/95/10/1433259510.db2.gz MFQGQURQTKERRU-UHFFFAOYSA-N 0 0 387.202 3.023 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(N3CCOCC3)cn2)cc1[N+](=O)[O-] ZINC000194904482 1433261195 /nfs/dbraw/zinc/26/11/95/1433261195.db2.gz SLRALUYXZLWZOD-CQSZACIVSA-N 0 0 385.424 3.018 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000194905433 1433261677 /nfs/dbraw/zinc/26/16/77/1433261677.db2.gz MIMWPPBLKJQYIH-UHFFFAOYSA-N 0 0 386.379 3.234 20 5 GGBDRN Nc1c(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)cc(F)cc1[N+](=O)[O-] ZINC000194910480 1433262752 /nfs/dbraw/zinc/26/27/52/1433262752.db2.gz QWEFGLSQNBAWNT-UHFFFAOYSA-N 0 0 389.358 3.190 20 5 GGBDRN CCCCCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000194919935 1433264544 /nfs/dbraw/zinc/26/45/44/1433264544.db2.gz WCCRDGDMPYXRID-KRWDZBQOSA-N 0 0 390.484 3.213 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000194924277 1433265618 /nfs/dbraw/zinc/26/56/18/1433265618.db2.gz RXWLXTAKOAWIFC-QGZVFWFLSA-N 0 0 390.484 3.213 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCNc1cc(Cl)ccc1OC ZINC000194927042 1433266241 /nfs/dbraw/zinc/26/62/41/1433266241.db2.gz IGGPOSZAAFXTPP-UHFFFAOYSA-N 0 0 393.827 3.384 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000194932469 1433267098 /nfs/dbraw/zinc/26/70/98/1433267098.db2.gz PRVPHNQXZHQGQF-UHFFFAOYSA-N 0 0 385.395 3.267 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(=O)n(Cc2ccccc2Cl)c1 ZINC000194951011 1433271310 /nfs/dbraw/zinc/27/13/10/1433271310.db2.gz RPJFEIPGHWJLNF-UHFFFAOYSA-N 0 0 397.818 3.388 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2C(F)(F)F)nn1 ZINC000194954235 1433271953 /nfs/dbraw/zinc/27/19/53/1433271953.db2.gz IJTKGXZJBITQRK-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC(OCCc2ccccc2)CC1 ZINC000194955549 1433271976 /nfs/dbraw/zinc/27/19/76/1433271976.db2.gz ILBVCIDHGVFSLN-UHFFFAOYSA-N 0 0 383.448 3.257 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(F)cc(N2CCOCC2)c1 ZINC000194980843 1433276068 /nfs/dbraw/zinc/27/60/68/1433276068.db2.gz RBHIUUWKDDMQKE-UHFFFAOYSA-N 0 0 388.399 3.234 20 5 GGBDRN C[C@H](NC(=O)Nc1cc(F)cc(N2CCOCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000194981394 1433276152 /nfs/dbraw/zinc/27/61/52/1433276152.db2.gz YNAUFIXRKOKRDU-ZDUSSCGKSA-N 0 0 388.399 3.453 20 5 GGBDRN O=C(NCCOC(=O)c1csc(C2CC2)n1)c1ccc([N+](=O)[O-])cc1Cl ZINC000194991653 1433278003 /nfs/dbraw/zinc/27/80/03/1433278003.db2.gz ROCAETPQIQTNBE-UHFFFAOYSA-N 0 0 395.824 3.169 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCOC[C@@]34CCOC4)o2)c(Cl)c1 ZINC000195017454 1433281427 /nfs/dbraw/zinc/28/14/27/1433281427.db2.gz HGRIKLYISPNFOY-SFHVURJKSA-N 0 0 378.812 3.500 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1nccn1C(F)F ZINC000195019793 1433281707 /nfs/dbraw/zinc/28/17/07/1433281707.db2.gz OCZIYHXHUYJLNX-UHFFFAOYSA-N 0 0 382.370 3.063 20 5 GGBDRN C[C@H](c1ccco1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000195026362 1433282728 /nfs/dbraw/zinc/28/27/28/1433282728.db2.gz IJIPQJZGQJXVSB-SECBINFHSA-N 0 0 389.227 3.332 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NCc3nccn3C(F)F)cc2[N+](=O)[O-])CC1 ZINC000195036680 1433284104 /nfs/dbraw/zinc/28/41/04/1433284104.db2.gz XTSRYQKZXJTFGE-UHFFFAOYSA-N 0 0 393.394 3.353 20 5 GGBDRN CN(C(=O)CN[C@@H](c1nccs1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000195059152 1433286719 /nfs/dbraw/zinc/28/67/19/1433286719.db2.gz SSDSSZZYQSZTTR-GOSISDBHSA-N 0 0 382.445 3.393 20 5 GGBDRN C[C@@H]1CCc2ccccc2N1C(=O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000195066715 1433287962 /nfs/dbraw/zinc/28/79/62/1433287962.db2.gz UIUIJBQWYRSHIR-CQSZACIVSA-N 0 0 377.404 3.221 20 5 GGBDRN CC[C@@H](C)[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)OC ZINC000195094567 1433291736 /nfs/dbraw/zinc/29/17/36/1433291736.db2.gz CYXXMCDNRNQWSH-YGRLFVJLSA-N 0 0 377.422 3.036 20 5 GGBDRN COc1cc(CNc2ccc(C(=O)NCC(F)(F)F)cc2)c([N+](=O)[O-])cc1O ZINC000195110125 1433293583 /nfs/dbraw/zinc/29/35/83/1433293583.db2.gz DRBKPPFPKOFFNJ-UHFFFAOYSA-N 0 0 399.325 3.213 20 5 GGBDRN COc1cc(CCNC(=O)N2CCc3c2cccc3C)c([N+](=O)[O-])cc1OC ZINC000195129449 1433296620 /nfs/dbraw/zinc/29/66/20/1433296620.db2.gz JJHLVIARVZCIKX-UHFFFAOYSA-N 0 0 385.420 3.235 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1OS(=O)(=O)c1cnn(-c2ccccc2)c1 ZINC000195150778 1433299896 /nfs/dbraw/zinc/29/98/96/1433299896.db2.gz MACTUHQYCQZYHD-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000195169401 1433302267 /nfs/dbraw/zinc/30/22/67/1433302267.db2.gz RBTDXBJJXWAOEC-HOTGVXAUSA-N 0 0 398.463 3.490 20 5 GGBDRN COc1ccccc1N1CC[C@H](CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000195169335 1433302282 /nfs/dbraw/zinc/30/22/82/1433302282.db2.gz QTDACKHUUHDIMF-MRXNPFEDSA-N 0 0 398.463 3.271 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1cc([N+](=O)[O-])ccc1N ZINC000195174277 1433303007 /nfs/dbraw/zinc/30/30/07/1433303007.db2.gz SSPWHCOZLFCEAE-UHFFFAOYSA-N 0 0 379.420 3.034 20 5 GGBDRN CCOc1ccc(C(C)=O)cc1Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1 ZINC000195198350 1433306167 /nfs/dbraw/zinc/30/61/67/1433306167.db2.gz BHZWFMRMMCNKMC-UHFFFAOYSA-N 0 0 383.360 3.061 20 5 GGBDRN Cc1nnc([C@H]2Cc3ccccc3CN2CCOc2ccc([N+](=O)[O-])cc2)o1 ZINC000195198967 1433306263 /nfs/dbraw/zinc/30/62/63/1433306263.db2.gz XNZZVJXFNDYDKP-LJQANCHMSA-N 0 0 380.404 3.465 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000195198873 1433306265 /nfs/dbraw/zinc/30/62/65/1433306265.db2.gz LHDKPEJBINSAJD-ZFWWWQNUSA-N 0 0 393.509 3.474 20 5 GGBDRN O=C(NC[C@H](O)c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000195204181 1433306840 /nfs/dbraw/zinc/30/68/40/1433306840.db2.gz NHERBOFXWHKQFY-IBGZPJMESA-N 0 0 387.411 3.188 20 5 GGBDRN Cc1cccc(Oc2ccccc2NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000195212382 1433307681 /nfs/dbraw/zinc/30/76/81/1433307681.db2.gz WDDKDDVWKNIZFY-UHFFFAOYSA-N 0 0 379.372 3.496 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000195218436 1433308298 /nfs/dbraw/zinc/30/82/98/1433308298.db2.gz UECGKKIHLDRKRF-HIFRSBDPSA-N 0 0 388.468 3.001 20 5 GGBDRN Cc1c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195235929 1433310368 /nfs/dbraw/zinc/31/03/68/1433310368.db2.gz WSCNLXYZHCGOHC-UHFFFAOYSA-N 0 0 388.336 3.300 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC(OCCc2ccccc2)CC1 ZINC000195234028 1433310473 /nfs/dbraw/zinc/31/04/73/1433310473.db2.gz PQNBBCMIOAPCLK-UHFFFAOYSA-N 0 0 390.461 3.007 20 5 GGBDRN O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)N2CCCC2)C1 ZINC000195263085 1433313166 /nfs/dbraw/zinc/31/31/66/1433313166.db2.gz NSHNJHBLPJECMP-GFCCVEGCSA-N 0 0 381.816 3.081 20 5 GGBDRN CC(C)c1nnc2n1C[C@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CC2 ZINC000195266947 1433313431 /nfs/dbraw/zinc/31/34/31/1433313431.db2.gz PYVCIAWLGXTZAE-CQSZACIVSA-N 0 0 385.468 3.352 20 5 GGBDRN Cc1c(C(=O)NCc2ccc(-n3ccnc3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195268423 1433313685 /nfs/dbraw/zinc/31/36/85/1433313685.db2.gz JFYUHTROSDEQLF-UHFFFAOYSA-N 0 0 395.375 3.236 20 5 GGBDRN COc1ccc(CC[C@H](C)NC(=O)NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000195268136 1433313718 /nfs/dbraw/zinc/31/37/18/1433313718.db2.gz FZKKXIPZVCXXHG-AWEZNQCLSA-N 0 0 387.436 3.433 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(N2CCc3sccc3C2)cc1 ZINC000195299103 1433316644 /nfs/dbraw/zinc/31/66/44/1433316644.db2.gz KBCVZYYJGWXVBZ-UHFFFAOYSA-N 0 0 383.433 3.054 20 5 GGBDRN CCS(=O)(=O)C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000195299336 1433316678 /nfs/dbraw/zinc/31/66/78/1433316678.db2.gz FMVXPENUWGVENS-UHFFFAOYSA-N 0 0 382.485 3.427 20 5 GGBDRN Cc1cc(NCc2nc(-c3ccncc3)no2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000195302520 1433316806 /nfs/dbraw/zinc/31/68/06/1433316806.db2.gz NHNSBQMMTNPHKS-UHFFFAOYSA-N 0 0 389.375 3.417 20 5 GGBDRN O=C(CC1CCCC1)NC1CCC(C(=O)NCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000195307396 1433317662 /nfs/dbraw/zinc/31/76/62/1433317662.db2.gz MCCRZBIKSABFEJ-UHFFFAOYSA-N 0 0 387.480 3.466 20 5 GGBDRN COc1cccc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000195313440 1433318105 /nfs/dbraw/zinc/31/81/05/1433318105.db2.gz LJDLQPFZCVNYEN-RMKNXTFCSA-N 0 0 381.432 3.075 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccnn2[C@H]2CCCc3ccccc32)c1[N+](=O)[O-] ZINC000195326384 1433319473 /nfs/dbraw/zinc/31/94/73/1433319473.db2.gz SDDMXZJGDTZUQY-HNNXBMFYSA-N 0 0 380.408 3.011 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCCc1nnc(SC)n1CC(C)C ZINC000195338227 1433320558 /nfs/dbraw/zinc/32/05/58/1433320558.db2.gz ZVROLGMWHCJLPN-UHFFFAOYSA-N 0 0 381.506 3.134 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CCC[C@H](c3nccs3)C2)c([N+](=O)[O-])c1 ZINC000195347116 1433321387 /nfs/dbraw/zinc/32/13/87/1433321387.db2.gz PYQXOVHTZFUFLD-STQMWFEESA-N 0 0 390.465 3.267 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CNC(=O)CC1CCCCC1 ZINC000195354392 1433321871 /nfs/dbraw/zinc/32/18/71/1433321871.db2.gz KGWAVPSQVQUEKA-UHFFFAOYSA-N 0 0 375.469 3.418 20 5 GGBDRN CSc1ccc(C(=O)NCCNC(=O)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000195353534 1433322021 /nfs/dbraw/zinc/32/20/21/1433322021.db2.gz SYSBVJRKTKNCQP-UHFFFAOYSA-N 0 0 379.482 3.133 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](c2ccccc2)c2ccc3[nH]cnc3c2)c1[N+](=O)[O-] ZINC000195372633 1433323659 /nfs/dbraw/zinc/32/36/59/1433323659.db2.gz ZPGYTYSANPIYNO-QGZVFWFLSA-N 0 0 390.403 3.276 20 5 GGBDRN COc1cccc(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000195374901 1433323906 /nfs/dbraw/zinc/32/39/06/1433323906.db2.gz GZUQESDCOXEVAF-UHFFFAOYSA-N 0 0 387.411 3.091 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1 ZINC000195381731 1433324315 /nfs/dbraw/zinc/32/43/15/1433324315.db2.gz CDYDMEWQYFHGFA-UHFFFAOYSA-N 0 0 397.840 3.489 20 5 GGBDRN CC(C)CNC(=O)[C@@H]1CSCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000195381843 1433324323 /nfs/dbraw/zinc/32/43/23/1433324323.db2.gz FZSONPDKFOBGFR-ZDUSSCGKSA-N 0 0 393.490 3.097 20 5 GGBDRN Cc1nnc(Sc2ccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)c(C)c2)s1 ZINC000195389216 1433325032 /nfs/dbraw/zinc/32/50/32/1433325032.db2.gz ZUXLKZATTHUWOL-UHFFFAOYSA-N 0 0 390.450 3.050 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000195389781 1433325130 /nfs/dbraw/zinc/32/51/30/1433325130.db2.gz ZYPXTEQGYQMEIN-HUUCEWRRSA-N 0 0 399.447 3.207 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCN2C(=O)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000195402000 1433325727 /nfs/dbraw/zinc/32/57/27/1433325727.db2.gz CPHIBEFJUBZWTP-UHFFFAOYSA-N 0 0 381.432 3.211 20 5 GGBDRN O=C(CCCc1ccccc1)N1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000195413000 1433326905 /nfs/dbraw/zinc/32/69/05/1433326905.db2.gz WWOJSMUXQICCQR-UHFFFAOYSA-N 0 0 385.439 3.401 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3c(c2)CCCO3)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000195414608 1433327136 /nfs/dbraw/zinc/32/71/36/1433327136.db2.gz TZPHLFPTRJNJNB-UHFFFAOYSA-N 0 0 379.376 3.061 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(CNCCS(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000195422631 1433328093 /nfs/dbraw/zinc/32/80/93/1433328093.db2.gz BAXMUNMBKIHEJK-UHFFFAOYSA-N 0 0 389.260 3.465 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)c1[N+](=O)[O-] ZINC000195438123 1433329533 /nfs/dbraw/zinc/32/95/33/1433329533.db2.gz BWLWPTGPNDMKLG-UHFFFAOYSA-N 0 0 399.451 3.313 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)c1[N+](=O)[O-] ZINC000195453934 1433331502 /nfs/dbraw/zinc/33/15/02/1433331502.db2.gz BTQGUEHGZCVGAX-UHFFFAOYSA-N 0 0 385.424 3.113 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1cccc(CN2CCCCC2=O)c1 ZINC000195456847 1433331921 /nfs/dbraw/zinc/33/19/21/1433331921.db2.gz VCJNPQKPSMGSTE-UHFFFAOYSA-N 0 0 382.420 3.429 20 5 GGBDRN COc1cc(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)ccc1[N+](=O)[O-] ZINC000195456796 1433332046 /nfs/dbraw/zinc/33/20/46/1433332046.db2.gz QDESRWXJEXNCKU-MRXNPFEDSA-N 0 0 377.828 3.290 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2C)c1[N+](=O)[O-] ZINC000195458128 1433332272 /nfs/dbraw/zinc/33/22/72/1433332272.db2.gz FKBVMFKERXQEBK-LBPRGKRZSA-N 0 0 399.451 3.313 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)c1[N+](=O)[O-] ZINC000195458135 1433332281 /nfs/dbraw/zinc/33/22/81/1433332281.db2.gz FKBVMFKERXQEBK-GFCCVEGCSA-N 0 0 399.451 3.313 20 5 GGBDRN Cc1cccc(-n2cc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)nn2)c1 ZINC000195461030 1433332804 /nfs/dbraw/zinc/33/28/04/1433332804.db2.gz SHXJLZCPHAVDAV-UHFFFAOYSA-N 0 0 385.811 3.410 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000195467121 1433333511 /nfs/dbraw/zinc/33/35/11/1433333511.db2.gz LBXDOXWUOCSENQ-FQEVSTJZSA-N 0 0 398.463 3.390 20 5 GGBDRN CC(C)(C)C(=O)NCCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000195469489 1433334052 /nfs/dbraw/zinc/33/40/52/1433334052.db2.gz ZCMAIDAMWWWDHO-UHFFFAOYSA-N 0 0 384.436 3.231 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccc(Oc2ccccc2)nc1 ZINC000195481962 1433335136 /nfs/dbraw/zinc/33/51/36/1433335136.db2.gz FKANDVCNLAOEGY-UHFFFAOYSA-N 0 0 385.401 3.261 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCC(OC3CCCC3)CC2)cc1C ZINC000195480848 1433335245 /nfs/dbraw/zinc/33/52/45/1433335245.db2.gz METBAGLFHCNGCN-UHFFFAOYSA-N 0 0 382.482 3.324 20 5 GGBDRN CCCCOc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000195482093 1433335394 /nfs/dbraw/zinc/33/53/94/1433335394.db2.gz IASYGWCLVVSEIB-UHFFFAOYSA-N 0 0 385.420 3.337 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000195482410 1433335449 /nfs/dbraw/zinc/33/54/49/1433335449.db2.gz LKMRIOXETVBFCM-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN Cc1cc(=O)c(C(=O)NC[C@H]2CCCC[C@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000195657186 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FXFVHJXILKNESW-LLVKDONJSA-N 0 0 391.474 3.422 20 5 GGBDRN COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)c(OC)c1 ZINC000197504100 1433347044 /nfs/dbraw/zinc/34/70/44/1433347044.db2.gz FEQGRTKKVRZHGM-UHFFFAOYSA-N 0 0 383.360 3.178 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(F)ccc2F)cc1OC ZINC000198124034 1433347654 /nfs/dbraw/zinc/34/76/54/1433347654.db2.gz BHSUVXRCWIRSLP-UHFFFAOYSA-N 0 0 382.319 3.159 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2ccccc2F)cc1OC ZINC000198125989 1433347691 /nfs/dbraw/zinc/34/76/91/1433347691.db2.gz SCPSUPGUKOWWQF-UHFFFAOYSA-N 0 0 392.383 3.040 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccccc2C)cc1OC ZINC000198126258 1433347718 /nfs/dbraw/zinc/34/77/18/1433347718.db2.gz YDDIIAWLVQLLFG-CQSZACIVSA-N 0 0 388.420 3.428 20 5 GGBDRN O=C(NCC1(c2ccccc2)CCC1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000198463429 1433350142 /nfs/dbraw/zinc/35/01/42/1433350142.db2.gz MTFRFKRUPFDBKM-UHFFFAOYSA-N 0 0 395.459 3.283 20 5 GGBDRN O=C(NCC1(c2ccccc2)CCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000198591382 1433350520 /nfs/dbraw/zinc/35/05/20/1433350520.db2.gz ZYLSIMMZNHOAOA-UHFFFAOYSA-N 0 0 377.404 3.027 20 5 GGBDRN COc1cccc([C@H]2CCCN2S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000198861794 1433351582 /nfs/dbraw/zinc/35/15/82/1433351582.db2.gz LPRUVBPFSKQGHW-MRXNPFEDSA-N 0 0 392.433 3.138 20 5 GGBDRN COC(=O)c1ccc2c(c1)CCN2C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000198991903 1433352546 /nfs/dbraw/zinc/35/25/46/1433352546.db2.gz JJXGNRKWNFZJPU-UHFFFAOYSA-N 0 0 395.415 3.185 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCC(=O)N[C@H](c1ccccc1)C1CC1 ZINC000207281979 1433354419 /nfs/dbraw/zinc/35/44/19/1433354419.db2.gz OITIVXYKJWEJJH-YDTSGJJXSA-N 0 0 380.400 3.419 20 5 GGBDRN Cc1ccc(CCC(=O)NCCOC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000209642438 1433356011 /nfs/dbraw/zinc/35/60/11/1433356011.db2.gz KHBITCIHZCNFRP-LCYFTJDESA-N 0 0 382.416 3.209 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 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396.490 3.022 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000245422948 1433464929 /nfs/dbraw/zinc/46/49/29/1433464929.db2.gz QJXVUOFXWZLTCY-ZJWNCGCPSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000245422946 1433464938 /nfs/dbraw/zinc/46/49/38/1433464938.db2.gz QJXVUOFXWZLTCY-YMXBGEKHSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1ccccc1[C@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000245446741 1433469671 /nfs/dbraw/zinc/46/96/71/1433469671.db2.gz LKIULMLCSMWIDS-OXJNMPFZSA-N 0 0 383.448 3.328 20 5 GGBDRN COc1ccc(NC(=O)CN2C[C@H](C)OC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000245450426 1433469993 /nfs/dbraw/zinc/46/99/93/1433469993.db2.gz OOUWQHNKGPLJJJ-IFXJQAMLSA-N 0 0 385.420 3.004 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(C[C@@H](O)c3ccccc3C(F)(F)F)C2)nc1 ZINC000245450450 1433470012 /nfs/dbraw/zinc/47/00/12/1433470012.db2.gz OPSVBSRGHBIKPW-MLGOLLRUSA-N 0 0 396.369 3.228 20 5 GGBDRN Cc1ccccc1[C@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@@H](C)CO1 ZINC000245451891 1433470575 /nfs/dbraw/zinc/47/05/75/1433470575.db2.gz PWIRHFIVQGOWPC-HRAATJIYSA-N 0 0 395.459 3.254 20 5 GGBDRN CCc1ccccc1NC(=O)[C@@H](C)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245454503 1433471077 /nfs/dbraw/zinc/47/10/77/1433471077.db2.gz SBTZKOIOMHXQBN-GDBMZVCRSA-N 0 0 383.452 3.066 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CC[C@H](O)CC3)cc2[N+](=O)[O-])C1 ZINC000245513058 1433479490 /nfs/dbraw/zinc/47/94/90/1433479490.db2.gz OIYZUTRFISPNBY-OTRWWLKZSA-N 0 0 375.469 3.110 20 5 GGBDRN O=C(O[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000245518323 1433480419 /nfs/dbraw/zinc/48/04/19/1433480419.db2.gz AOFZMTRBIOHMMH-ZTFGCOKTSA-N 0 0 383.404 3.285 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)cc([N+](=O)[O-])c1F ZINC000245530698 1433481632 /nfs/dbraw/zinc/48/16/32/1433481632.db2.gz GPYGGCJVZIRXCX-GUYCJALGSA-N 0 0 394.424 3.193 20 5 GGBDRN O=C(O[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245552254 1433484080 /nfs/dbraw/zinc/48/40/80/1433484080.db2.gz POMYHFZMIMBMMZ-KBAYOESNSA-N 0 0 383.404 3.285 20 5 GGBDRN O=C(O[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000245566757 1433486295 /nfs/dbraw/zinc/48/62/95/1433486295.db2.gz XGRPRAGMSCLYJL-RCCFBDPRSA-N 0 0 383.404 3.285 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CCCC[C@H]3O)cc2[N+](=O)[O-])C1 ZINC000245662714 1433496837 /nfs/dbraw/zinc/49/68/37/1433496837.db2.gz NNCKTIDIKWJYQY-QMYADUOMSA-N 0 0 375.469 3.110 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC[C@H]3C(C)(C)O)cc2[N+](=O)[O-])C1 ZINC000245667890 1433497501 /nfs/dbraw/zinc/49/75/01/1433497501.db2.gz BTVKLXALUDBSBG-KHYOSLBOSA-N 0 0 389.496 3.453 20 5 GGBDRN CN1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](c2ccccc2)C1 ZINC000245696882 1433501914 /nfs/dbraw/zinc/50/19/14/1433501914.db2.gz MQRZWPMDZKDYIA-GOSISDBHSA-N 0 0 379.420 3.134 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1c2ccccc2CC[C@H]1C ZINC000245712310 1433504206 /nfs/dbraw/zinc/50/42/06/1433504206.db2.gz PIGULVGPMNTHGB-TYILLQQXSA-N 0 0 381.432 3.153 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1c2ccccc2CC[C@H]1C ZINC000245712306 1433504540 /nfs/dbraw/zinc/50/45/40/1433504540.db2.gz PIGULVGPMNTHGB-BIENJYKASA-N 0 0 381.432 3.153 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1[O-])N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000245718783 1433505500 /nfs/dbraw/zinc/50/55/00/1433505500.db2.gz OLIAVEPJBJUURC-YLJYHZDGSA-N 0 0 395.459 3.427 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000245728016 1433506752 /nfs/dbraw/zinc/50/67/52/1433506752.db2.gz RHFGWRRAAMSHAX-KFKAGJAMSA-N 0 0 385.464 3.273 20 5 GGBDRN CN1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](c2ccccc2)C1 ZINC000245756951 1433512506 /nfs/dbraw/zinc/51/25/06/1433512506.db2.gz YPFUHCPSVRPPNL-GOSISDBHSA-N 0 0 379.420 3.134 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)CC1 ZINC000245891035 1433534979 /nfs/dbraw/zinc/53/49/79/1433534979.db2.gz JLJMQBGYKQHQJA-NZSAHSFTSA-N 0 0 399.491 3.486 20 5 GGBDRN C[C@@H](O)CN(C)[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000245895419 1433536405 /nfs/dbraw/zinc/53/64/05/1433536405.db2.gz SJVHSIUMYZEJRY-SJKOYZFVSA-N 0 0 377.828 3.241 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000245922926 1433543648 /nfs/dbraw/zinc/54/36/48/1433543648.db2.gz ODFFQRYIBMQCHB-VHSXEESVSA-N 0 0 377.260 3.024 20 5 GGBDRN CN(CC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000245960086 1433550627 /nfs/dbraw/zinc/55/06/27/1433550627.db2.gz DDHANYSTMUBVRX-BEFAXECRSA-N 0 0 389.839 3.331 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000246057222 1433562424 /nfs/dbraw/zinc/56/24/24/1433562424.db2.gz FQOJBQQXRQFXJT-VLXJIEOASA-N 0 0 380.404 3.462 20 5 GGBDRN CC1(C)[C@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)[C@@H]2CCO[C@H]21 ZINC000246059602 1433562921 /nfs/dbraw/zinc/56/29/21/1433562921.db2.gz BGANTSZMBIYIGF-ZWKOPEQDSA-N 0 0 384.230 3.292 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000246063002 1433563280 /nfs/dbraw/zinc/56/32/80/1433563280.db2.gz DKCVVMOUGBSOEG-FZKQIMNGSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1cc(NC(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000246067411 1433564448 /nfs/dbraw/zinc/56/44/48/1433564448.db2.gz ZQSOFVBMAXMHID-YQQAZPJKSA-N 0 0 376.457 3.009 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000246073186 1433564534 /nfs/dbraw/zinc/56/45/34/1433564534.db2.gz DUFZBGBTKBEFLK-UKRRQHHQSA-N 0 0 396.490 3.242 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000246095614 1433567889 /nfs/dbraw/zinc/56/78/89/1433567889.db2.gz MHJMGVFQPFIZBA-FVQBIDKESA-N 0 0 385.445 3.406 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCS[C@@H]2CCCC[C@H]21 ZINC000246098450 1433568161 /nfs/dbraw/zinc/56/81/61/1433568161.db2.gz IBJWPJFWGZPWTQ-DGCLKSJQSA-N 0 0 376.887 3.297 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCS[C@H]2CCCC[C@H]21 ZINC000246098460 1433568240 /nfs/dbraw/zinc/56/82/40/1433568240.db2.gz IBJWPJFWGZPWTQ-YPMHNXCESA-N 0 0 376.887 3.297 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC[C@@H]2[C@H]2CCCCC2=O)c1C ZINC000246116701 1433570965 /nfs/dbraw/zinc/57/09/65/1433570965.db2.gz CPANTYUMOGGKIL-HZPDHXFCSA-N 0 0 380.466 3.124 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000246124774 1433571872 /nfs/dbraw/zinc/57/18/72/1433571872.db2.gz PPPBZIDNXQXCAW-ALQUZDBKSA-N 0 0 393.509 3.349 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000246163027 1433576817 /nfs/dbraw/zinc/57/68/17/1433576817.db2.gz LZSRXBNBOCTYKJ-YJBOKZPZSA-N 0 0 390.461 3.362 20 5 GGBDRN C[C@@H]1CCC[C@@H](CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000246189322 1433579696 /nfs/dbraw/zinc/57/96/96/1433579696.db2.gz RWQYIDKCYZLZLI-MGPQQGTHSA-N 0 0 379.482 3.203 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@H]2C[C@@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000246207121 1433581792 /nfs/dbraw/zinc/58/17/92/1433581792.db2.gz REUCXMTXWBDGTF-XJKSGUPXSA-N 0 0 396.490 3.242 20 5 GGBDRN CC[C@H](CCO)CNC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000246218419 1433583076 /nfs/dbraw/zinc/58/30/76/1433583076.db2.gz HFEXTBCZICVIMS-BZUAXINKSA-N 0 0 377.485 3.216 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C[C@@H](C)C1 ZINC000246224883 1433584135 /nfs/dbraw/zinc/58/41/35/1433584135.db2.gz REPHHKHOHFWLBN-ZOBORPQBSA-N 0 0 379.482 3.202 20 5 GGBDRN CN(CC(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000246225944 1433584166 /nfs/dbraw/zinc/58/41/66/1433584166.db2.gz REEYDNHHSKYHFN-UWJYYQICSA-N 0 0 383.448 3.315 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000246231709 1433584602 /nfs/dbraw/zinc/58/46/02/1433584602.db2.gz QZMGABUTNZCSLH-WMLDXEAASA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@H]2C[C@H](C)C[C@H](C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000246232398 1433584634 /nfs/dbraw/zinc/58/46/34/1433584634.db2.gz SOPXTQXTQIQVQJ-NHAGDIPZSA-N 0 0 384.436 3.004 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CN2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)c1 ZINC000246241110 1433585444 /nfs/dbraw/zinc/58/54/44/1433585444.db2.gz HWJDJVNFWVZKSG-QZTJIDSGSA-N 0 0 380.803 3.494 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]3CCC[C@H]32)cc1Br ZINC000246243457 1433585730 /nfs/dbraw/zinc/58/57/30/1433585730.db2.gz RYCAOBJVNOLNPD-ZWNOBZJWSA-N 0 0 389.271 3.311 20 5 GGBDRN O=C(CN1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000246278690 1433589131 /nfs/dbraw/zinc/58/91/31/1433589131.db2.gz ATBZNNAOWQYOIS-QFBILLFUSA-N 0 0 387.411 3.261 20 5 GGBDRN C[C@@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](c2ccsc2)O1 ZINC000246292932 1433590942 /nfs/dbraw/zinc/59/09/42/1433590942.db2.gz BNEWBIZGNVTSDM-JEBQAFNWSA-N 0 0 387.461 3.224 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCO[C@](C)(c2ccccc2)C1 ZINC000246296191 1433591210 /nfs/dbraw/zinc/59/12/10/1433591210.db2.gz BRMINOQTJNCUQR-BTYIYWSLSA-N 0 0 399.447 3.178 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@@H](c2ccco2)C1 ZINC000246312688 1433593060 /nfs/dbraw/zinc/59/30/60/1433593060.db2.gz CAODIWHKPOWGPB-MEDUHNTESA-N 0 0 379.800 3.242 20 5 GGBDRN C[C@H]1CN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](c2ccsc2)O1 ZINC000246356187 1433599846 /nfs/dbraw/zinc/59/98/46/1433599846.db2.gz FXHGKDYKRLTSPF-GUYCJALGSA-N 0 0 385.449 3.334 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000246497877 1433621586 /nfs/dbraw/zinc/62/15/86/1433621586.db2.gz XONPVONTBBNSOU-CXAGYDPISA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000246501828 1433622214 /nfs/dbraw/zinc/62/22/14/1433622214.db2.gz XUSSIJVFBAGCKD-KSSFIOAISA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000246529471 1433625738 /nfs/dbraw/zinc/62/57/38/1433625738.db2.gz POKREZWWTWGYFR-PBFPGSCMSA-N 0 0 375.450 3.445 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000246530825 1433626279 /nfs/dbraw/zinc/62/62/79/1433626279.db2.gz PGXBTDLRCNMSHC-UZPXWBGZSA-N 0 0 381.498 3.209 20 5 GGBDRN C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](c2ccsc2)O1 ZINC000246535588 1433626716 /nfs/dbraw/zinc/62/67/16/1433626716.db2.gz PVJQZRRMEOVSKR-GUYCJALGSA-N 0 0 375.450 3.447 20 5 GGBDRN O=C1N(CN2CCS[C@H]3CCCC[C@H]32)CCN1c1ccccc1[N+](=O)[O-] ZINC000246570778 1433632807 /nfs/dbraw/zinc/63/28/07/1433632807.db2.gz MISZVVJITOFMBH-SJORKVTESA-N 0 0 376.482 3.154 20 5 GGBDRN 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C[C@H]1CC[C@H](NS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000252959133 1433864949 /nfs/dbraw/zinc/86/49/49/1433864949.db2.gz LZRLCFQZUGSEMS-HOMQSWHASA-N 0 0 377.260 3.214 20 5 GGBDRN CCOc1ccc(C(=O)N2CCN(C/C=C\c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000253385752 1433866819 /nfs/dbraw/zinc/86/68/19/1433866819.db2.gz UKLVEHQKRNOAPL-TWGQIWQCSA-N 0 0 395.459 3.465 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCc2nnc(C(=O)NCc3ccccc3)s2)c1 ZINC000253477276 1433867855 /nfs/dbraw/zinc/86/78/55/1433867855.db2.gz DXRURARARLBBMG-UHFFFAOYSA-N 0 0 384.417 3.264 20 5 GGBDRN Cc1cc(NC(=O)COc2ccc(F)cc2F)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000253478549 1433867868 /nfs/dbraw/zinc/86/78/68/1433867868.db2.gz LREBAYXXGKKWNK-UHFFFAOYSA-N 0 0 388.330 3.385 20 5 GGBDRN COC(=O)c1ccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000253480098 1433868038 /nfs/dbraw/zinc/86/80/38/1433868038.db2.gz UXXCZDCCRYLIGQ-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000253600108 1433869978 /nfs/dbraw/zinc/86/99/78/1433869978.db2.gz DVCJIBXQPGLCBX-UHFFFAOYSA-N 0 0 382.424 3.239 20 5 GGBDRN C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000253605758 1433870316 /nfs/dbraw/zinc/87/03/16/1433870316.db2.gz PEHSMIFNMZJARZ-NSHDSACASA-N 0 0 396.852 3.485 20 5 GGBDRN O=c1[nH]cnc2cc(N3CCN(C/C=C/c4ccccc4)CC3)c([N+](=O)[O-])cc12 ZINC000253616820 1433870761 /nfs/dbraw/zinc/87/07/61/1433870761.db2.gz MVNFNXJJPFQKDR-QPJJXVBHSA-N 0 0 391.431 3.079 20 5 GGBDRN COc1ccc(C2=N/C(=C/c3cc(F)c(F)cc3F)C(=O)O2)cc1[N+](=O)[O-] ZINC000254974047 1433873315 /nfs/dbraw/zinc/87/33/15/1433873315.db2.gz GLMWUTZLTARWSY-WLRTZDKTSA-N 0 0 378.262 3.365 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NC[C@@](O)(c1ccccc1)C(F)(F)F ZINC000255017502 1433874342 /nfs/dbraw/zinc/87/43/42/1433874342.db2.gz IIJFCZGCWSWFJD-SDMNGIDPSA-N 0 0 380.322 3.174 20 5 GGBDRN COc1ccccc1C/C(C)=C\C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000255027600 1433874414 /nfs/dbraw/zinc/87/44/14/1433874414.db2.gz NKCSLUKNTZWJKN-MLRPBERTSA-N 0 0 396.447 3.200 20 5 GGBDRN Cc1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)n(-c2cc(C)nc(C)n2)n1 ZINC000255027340 1433874419 /nfs/dbraw/zinc/87/44/19/1433874419.db2.gz MQKJSJBBKNSLEL-TWGQIWQCSA-N 0 0 378.392 3.148 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000255036000 1433874739 /nfs/dbraw/zinc/87/47/39/1433874739.db2.gz WWZJNZDOBBGWEY-CXOKCQFOSA-N 0 0 380.322 3.477 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H]1CCCN(c2ccccc2F)C1=O ZINC000255080212 1433875851 /nfs/dbraw/zinc/87/58/51/1433875851.db2.gz YFLJLHLWMMZZNJ-GKUQOKNUSA-N 0 0 383.379 3.059 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)nc1C ZINC000255114331 1433876665 /nfs/dbraw/zinc/87/66/65/1433876665.db2.gz DDYBNUPUEAKLOI-YFHOEESVSA-N 0 0 375.406 3.213 20 5 GGBDRN O=C(/C=C\c1ccc(-c2ccc(F)cc2)s1)OCCn1cnc([N+](=O)[O-])n1 ZINC000255171894 1433878059 /nfs/dbraw/zinc/87/80/59/1433878059.db2.gz NWTVSTWWWGFIOD-VURMDHGXSA-N 0 0 388.380 3.311 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OC/C(Cl)=C\Cl)c([N+](=O)[O-])c1 ZINC000255188314 1433878204 /nfs/dbraw/zinc/87/82/04/1433878204.db2.gz MPZSFGHIJMNHFF-CSKARUKUSA-N 0 0 383.253 3.323 20 5 GGBDRN Cn1c2ccccc2sc1=NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000255196311 1433878330 /nfs/dbraw/zinc/87/83/30/1433878330.db2.gz IIXVKHRXYBGQKN-UHFFFAOYSA-N 0 0 380.385 3.143 20 5 GGBDRN CC1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000255228222 1433878723 /nfs/dbraw/zinc/87/87/23/1433878723.db2.gz UHDGIUNYCVEKHP-DAXSKMNVSA-N 0 0 385.464 3.105 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255266599 1433878827 /nfs/dbraw/zinc/87/88/27/1433878827.db2.gz YNBHCIXNNOIZMJ-BCTQVIJGSA-N 0 0 375.425 3.028 20 5 GGBDRN C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255282459 1433879096 /nfs/dbraw/zinc/87/90/96/1433879096.db2.gz VACNBVMAOUIYEH-YHAOYDPOSA-N 0 0 375.425 3.076 20 5 GGBDRN COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000255295345 1433879464 /nfs/dbraw/zinc/87/94/64/1433879464.db2.gz YUXJMEKMYVXRFA-PBHICJAKSA-N 0 0 397.431 3.228 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCc2c(cccc2N2CCOC2=O)C1 ZINC000255332552 1433880669 /nfs/dbraw/zinc/88/06/69/1433880669.db2.gz VDWCZBJDDFKGJJ-TWGQIWQCSA-N 0 0 393.399 3.150 20 5 GGBDRN CCN(C/C=C\c1ccccc1[N+](=O)[O-])CC(=O)Nc1ccc2c(c1)OCCO2 ZINC000255372174 1433881530 /nfs/dbraw/zinc/88/15/30/1433881530.db2.gz CFCGRDKLYCSCGO-ALCCZGGFSA-N 0 0 397.431 3.340 20 5 GGBDRN CC(C)c1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)n(-c2ncccn2)n1 ZINC000255377638 1433881761 /nfs/dbraw/zinc/88/17/61/1433881761.db2.gz LJQGIDOWXFLDFK-TWGQIWQCSA-N 0 0 378.392 3.346 20 5 GGBDRN COc1cc(OCC(=O)n2ccccc2=Nc2ccccc2)ccc1[N+](=O)[O-] ZINC000255507688 1433884009 /nfs/dbraw/zinc/88/40/09/1433884009.db2.gz BIXXTCCNWYKQMQ-UHFFFAOYSA-N 0 0 379.372 3.357 20 5 GGBDRN O=[N+]([O-])c1ccccc1/C=C\CN1CCN(c2ncnc3sccc32)CC1 ZINC000255539277 1433884445 /nfs/dbraw/zinc/88/44/45/1433884445.db2.gz YOGHVJPHFJIXBJ-HYXAFXHYSA-N 0 0 381.461 3.435 20 5 GGBDRN O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C/c1cc([N+](=O)[O-])c(F)cc1F ZINC000255581780 1433885883 /nfs/dbraw/zinc/88/58/83/1433885883.db2.gz PGEDQQKXCFICHP-WLRTZDKTSA-N 0 0 375.243 3.126 20 5 GGBDRN CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000255683441 1433887946 /nfs/dbraw/zinc/88/79/46/1433887946.db2.gz NAJLJIBBZJLWAP-SYEIYJTBSA-N 0 0 391.493 3.338 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000255692318 1433888029 /nfs/dbraw/zinc/88/80/29/1433888029.db2.gz DHXWRWKSIRUKAY-MEODZPNASA-N 0 0 375.425 3.124 20 5 GGBDRN NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255809994 1433889601 /nfs/dbraw/zinc/88/96/01/1433889601.db2.gz VDWRNKCIWQKDNV-WDZFZDKYSA-N 0 0 394.431 3.336 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCc1ccc(CN2CCCC2=O)cc1 ZINC000255780327 1433889658 /nfs/dbraw/zinc/88/96/58/1433889658.db2.gz ZZFQCRFULZJRRM-XFXZXTDPSA-N 0 0 379.416 3.047 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1noc(C)n1 ZINC000255829975 1433889759 /nfs/dbraw/zinc/88/97/59/1433889759.db2.gz GDCHYMHNCDDFSL-UZRURVBFSA-N 0 0 394.387 3.214 20 5 GGBDRN Nc1cc(CCCNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)nn1-c1ccccc1 ZINC000255898829 1433891273 /nfs/dbraw/zinc/89/12/73/1433891273.db2.gz PBMGEAWIHDULDJ-RAXLEYEMSA-N 0 0 391.431 3.125 20 5 GGBDRN O=C(/C=C\c1nc2ccccc2s1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000255904020 1433891395 /nfs/dbraw/zinc/89/13/95/1433891395.db2.gz IPPLELUZKWAQDQ-MEJMFZKBSA-N 0 0 395.444 3.326 20 5 GGBDRN CC[C@H](C)[C@@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(=O)OC ZINC000255945705 1433892338 /nfs/dbraw/zinc/89/23/38/1433892338.db2.gz BICUETHFOJXTEH-KBXCAEBGSA-N 0 0 391.468 3.149 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCCOCC3CC3)cc2[N+](=O)[O-])C1 ZINC000261440430 1433896205 /nfs/dbraw/zinc/89/62/05/1433896205.db2.gz MCDHOOANYSWROX-HUUCEWRRSA-N 0 0 375.469 3.234 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCNC[C@H]1c1cccc(F)c1 ZINC000261714202 1433899804 /nfs/dbraw/zinc/89/98/04/1433899804.db2.gz DSRALDHLQIEJNC-FQEVSTJZSA-N 0 0 398.438 3.121 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCNC[C@@H]1c1ccccc1Cl ZINC000261716181 1433899814 /nfs/dbraw/zinc/89/98/14/1433899814.db2.gz DVPKHRDDGRTOAF-QGZVFWFLSA-N 0 0 389.839 3.190 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCNC[C@H]1c1cccc(F)c1 ZINC000261895149 1433910629 /nfs/dbraw/zinc/91/06/29/1433910629.db2.gz GAXHEERTRVIEAC-IBGZPJMESA-N 0 0 384.411 3.095 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCNC[C@@H]1c1cccc(F)c1 ZINC000261976763 1433918814 /nfs/dbraw/zinc/91/88/14/1433918814.db2.gz NTQRIRKYTSYFTP-FZKQIMNGSA-N 0 0 389.452 3.388 20 5 GGBDRN COc1cc(C[NH2+][C@H](C(=O)[O-])C(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000262726408 1433952462 /nfs/dbraw/zinc/95/24/62/1433952462.db2.gz ZOGIROBBPFETJD-IBGZPJMESA-N 0 0 388.420 3.381 20 5 GGBDRN COc1cc(C[N@H+](C)C[C@@H](C)C(=O)[O-])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000263483547 1434008716 /nfs/dbraw/zinc/00/87/16/1434008716.db2.gz GTZJFORCMQTEME-CQSZACIVSA-N 0 0 388.420 3.335 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000263502156 1434009227 /nfs/dbraw/zinc/00/92/27/1434009227.db2.gz LAVXDXLNWQTNHI-UHFFFAOYSA-N 0 0 387.436 3.226 20 5 GGBDRN C[N@H+](CC(=O)[O-])[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000263521635 1434010929 /nfs/dbraw/zinc/01/09/29/1434010929.db2.gz RGEOSYPNPJKNFJ-HNNXBMFYSA-N 0 0 387.436 3.226 20 5 GGBDRN C[N@H+](CC(=O)[O-])[C@H]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000263560372 1434013289 /nfs/dbraw/zinc/01/32/89/1434013289.db2.gz RCHYBEGPTSMBSS-INIZCTEOSA-N 0 0 384.436 3.032 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000263568770 1434013914 /nfs/dbraw/zinc/01/39/14/1434013914.db2.gz YTNJCQAVOCTNGE-UHFFFAOYSA-N 0 0 384.436 3.032 20 5 GGBDRN Cc1nn(CCC(=O)N2CCn3cccc3[C@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000263640377 1434014163 /nfs/dbraw/zinc/01/41/63/1434014163.db2.gz AHYLOLWIVPKVCL-OAQYLSRUSA-N 0 0 393.447 3.232 20 5 GGBDRN Cc1nn(CCC(=O)NCc2ccc(F)cc2C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000263640307 1434014178 /nfs/dbraw/zinc/01/41/78/1434014178.db2.gz ADDJOBHRXMIAGT-UHFFFAOYSA-N 0 0 388.321 3.273 20 5 GGBDRN Cc1nn(CCC(=O)N2CCn3cccc3[C@@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000263640376 1434014287 /nfs/dbraw/zinc/01/42/87/1434014287.db2.gz AHYLOLWIVPKVCL-NRFANRHFSA-N 0 0 393.447 3.232 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc3c(cc2Cl)OCCCO3)c(C)c1[N+](=O)[O-] ZINC000263640808 1434014311 /nfs/dbraw/zinc/01/43/11/1434014311.db2.gz BBQNECYQZVBURA-UHFFFAOYSA-N 0 0 394.815 3.252 20 5 GGBDRN CCOc1cc2c(cc1NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)O[C@@H](C)C2 ZINC000263641092 1434014343 /nfs/dbraw/zinc/01/43/43/1434014343.db2.gz BLEJPQSCEBQIAZ-NSHDSACASA-N 0 0 388.424 3.159 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](C)c2ccc(OC(F)F)cc2)c(C)c1[N+](=O)[O-] ZINC000263642631 1434014547 /nfs/dbraw/zinc/01/45/47/1434014547.db2.gz DANZXSKLFDODPR-JTQLQIEISA-N 0 0 382.367 3.277 20 5 GGBDRN Cn1ccnc1[C@@](O)(CCNc1ccc2cc([N+](=O)[O-])ccc2n1)C(F)(F)F ZINC000263645313 1434014713 /nfs/dbraw/zinc/01/47/13/1434014713.db2.gz AMQQRAKQSALOII-INIZCTEOSA-N 0 0 395.341 3.129 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c(C)c1[N+](=O)[O-] ZINC000263649321 1434015519 /nfs/dbraw/zinc/01/55/19/1434015519.db2.gz GJOORJZVWZDSRV-GFCCVEGCSA-N 0 0 399.451 3.024 20 5 GGBDRN CCOc1ccc(OCC)c(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000263650747 1434015593 /nfs/dbraw/zinc/01/55/93/1434015593.db2.gz GSQGZQANUAWFLN-UHFFFAOYSA-N 0 0 376.413 3.234 20 5 GGBDRN CCC(=O)Nc1ccc(Cl)c(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000263669501 1434018202 /nfs/dbraw/zinc/01/82/02/1434018202.db2.gz LXHYBQWZOUWIOV-UHFFFAOYSA-N 0 0 393.831 3.439 20 5 GGBDRN CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H]1OCCc2ccccc21 ZINC000263702054 1434023027 /nfs/dbraw/zinc/02/30/27/1434023027.db2.gz LSBQTFZVMSQEGP-GOSISDBHSA-N 0 0 380.404 3.391 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCCN1C(=O)c1cccs1 ZINC000263713690 1434024368 /nfs/dbraw/zinc/02/43/68/1434024368.db2.gz BAOPHJDRBXFVRL-AWEZNQCLSA-N 0 0 377.397 3.429 20 5 GGBDRN O=C(CCC(=O)N1CCc2sccc2C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000263713986 1434024381 /nfs/dbraw/zinc/02/43/81/1434024381.db2.gz BHYMKXGAWWAZOE-UHFFFAOYSA-N 0 0 377.397 3.099 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)C[C@H]1OCCc2ccccc21 ZINC000263722416 1434025315 /nfs/dbraw/zinc/02/53/15/1434025315.db2.gz RZYXAURIWMUDQV-LJQANCHMSA-N 0 0 385.420 3.059 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)C[C@@H]1OCCc2ccccc21 ZINC000263722411 1434025345 /nfs/dbraw/zinc/02/53/45/1434025345.db2.gz RZYXAURIWMUDQV-IBGZPJMESA-N 0 0 385.420 3.059 20 5 GGBDRN C[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 ZINC000263742704 1434027778 /nfs/dbraw/zinc/02/77/78/1434027778.db2.gz OQGHUQOFFHASKA-AWEZNQCLSA-N 0 0 398.419 3.154 20 5 GGBDRN O=C(NC[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])o2)C1)Nc1cccc(F)c1 ZINC000263741106 1434027826 /nfs/dbraw/zinc/02/78/26/1434027826.db2.gz AGWIQHMEYGWOTG-LBPRGKRZSA-N 0 0 390.371 3.001 20 5 GGBDRN CC[C@@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1nnc2n1CCCCC2 ZINC000263743287 1434028161 /nfs/dbraw/zinc/02/81/61/1434028161.db2.gz AMJWZLOCFYOWSS-CYBMUJFWSA-N 0 0 382.424 3.275 20 5 GGBDRN CC(C)(C)OCc1cccc(CNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000263774522 1434032195 /nfs/dbraw/zinc/03/21/95/1434032195.db2.gz UBBOIVCPLGODKC-UHFFFAOYSA-N 0 0 393.465 3.169 20 5 GGBDRN COc1cc(C(=O)NCCc2c(C)[nH]c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000263800043 1434035467 /nfs/dbraw/zinc/03/54/67/1434035467.db2.gz KDYHEDIKKVKJDM-UHFFFAOYSA-N 0 0 383.404 3.374 20 5 GGBDRN CC(C)C(=O)NC[C@@H]1CCCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000263812711 1434036700 /nfs/dbraw/zinc/03/67/00/1434036700.db2.gz OKBPKUSWGPKTBF-CABCVRRESA-N 0 0 393.509 3.086 20 5 GGBDRN COc1cc(C(=O)N2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000263827709 1434038643 /nfs/dbraw/zinc/03/86/43/1434038643.db2.gz SRXKBXFAJXQFOE-LLVKDONJSA-N 0 0 377.422 3.121 20 5 GGBDRN CN(C(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000263850024 1434041309 /nfs/dbraw/zinc/04/13/09/1434041309.db2.gz NPRHOGFDPHFYME-UHFFFAOYSA-N 0 0 382.420 3.363 20 5 GGBDRN Cc1c(C(=O)N2CCC(C(=O)OC(C)(C)C)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000263890074 1434046133 /nfs/dbraw/zinc/04/61/33/1434046133.db2.gz ZKGVXHKZIBAORE-UHFFFAOYSA-N 0 0 393.396 3.005 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000263906896 1434047739 /nfs/dbraw/zinc/04/77/39/1434047739.db2.gz KWIUMCUYSUDXKT-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000263923334 1434049174 /nfs/dbraw/zinc/04/91/74/1434049174.db2.gz PVYBKQTXFVCFCG-ZDUSSCGKSA-N 0 0 377.832 3.447 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000263936366 1434050670 /nfs/dbraw/zinc/05/06/70/1434050670.db2.gz SVMPCULICNCFBX-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000263959677 1434053646 /nfs/dbraw/zinc/05/36/46/1434053646.db2.gz VYDGODYARJKUGY-HNNXBMFYSA-N 0 0 383.452 3.328 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NC1(c2ccccc2)CC1 ZINC000263959995 1434053671 /nfs/dbraw/zinc/05/36/71/1434053671.db2.gz DHTCMDMEPBNMBP-UHFFFAOYSA-N 0 0 381.388 3.088 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000263959679 1434053693 /nfs/dbraw/zinc/05/36/93/1434053693.db2.gz VYDGODYARJKUGY-OAHLLOKOSA-N 0 0 383.452 3.328 20 5 GGBDRN COc1cccc(N2CC[C@@H](NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])C2)c1 ZINC000263969812 1434055226 /nfs/dbraw/zinc/05/52/26/1434055226.db2.gz DNKPSHKRVMJANU-CYBMUJFWSA-N 0 0 375.812 3.266 20 5 GGBDRN COCc1ccc(CNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000263979218 1434056739 /nfs/dbraw/zinc/05/67/39/1434056739.db2.gz BIPXVXRLJARONU-UHFFFAOYSA-N 0 0 376.434 3.402 20 5 GGBDRN COC(=O)C1(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])CCCCCC1 ZINC000263983996 1434057514 /nfs/dbraw/zinc/05/75/14/1434057514.db2.gz DDQKEMYLSPDRFB-UHFFFAOYSA-N 0 0 396.465 3.321 20 5 GGBDRN COCCCCN(Cc1ccccc1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000263984577 1434057522 /nfs/dbraw/zinc/05/75/22/1434057522.db2.gz LQYPJIXDAPSURN-UHFFFAOYSA-N 0 0 388.468 3.254 20 5 GGBDRN COc1cccc(N2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC000263989165 1434058285 /nfs/dbraw/zinc/05/82/85/1434058285.db2.gz MXUZHKUVDFWRLT-LBPRGKRZSA-N 0 0 375.812 3.266 20 5 GGBDRN C[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccc2c(c1)CC(=O)N2C ZINC000263991312 1434058649 /nfs/dbraw/zinc/05/86/49/1434058649.db2.gz KAGKVNIWUSAXRU-NSHDSACASA-N 0 0 380.404 3.172 20 5 GGBDRN C[C@@H](NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000264002400 1434060321 /nfs/dbraw/zinc/06/03/21/1434060321.db2.gz GHNCEKCGSGCJDN-CHWSQXEVSA-N 0 0 382.420 3.235 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCOc2ccc(C)cc2)cc1SC ZINC000264004555 1434060747 /nfs/dbraw/zinc/06/07/47/1434060747.db2.gz MEQCUZUIKVTWIU-UHFFFAOYSA-N 0 0 376.434 3.443 20 5 GGBDRN O=C(c1cscn1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000264005597 1434060758 /nfs/dbraw/zinc/06/07/58/1434060758.db2.gz MSGSMIJLTLYLIS-UHFFFAOYSA-N 0 0 386.355 3.033 20 5 GGBDRN CC(C)NC(=O)c1ccc(N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)c([N+](=O)[O-])c1 ZINC000264007787 1434061282 /nfs/dbraw/zinc/06/12/82/1434061282.db2.gz QSLLERDNYXTGEX-ZDUSSCGKSA-N 0 0 396.447 3.425 20 5 GGBDRN Cc1nn(CCC(=O)NCc2nc3cc(Cl)ccc3s2)c(C)c1[N+](=O)[O-] ZINC000264009055 1434061369 /nfs/dbraw/zinc/06/13/69/1434061369.db2.gz UUOSHFVNVPHMOB-UHFFFAOYSA-N 0 0 393.856 3.378 20 5 GGBDRN COc1cccc(N2CC[C@@H](NC(=O)c3cc(SC)ccc3[N+](=O)[O-])C2)c1 ZINC000264012074 1434061712 /nfs/dbraw/zinc/06/17/12/1434061712.db2.gz XPRKEVIYJDCOOA-CYBMUJFWSA-N 0 0 387.461 3.334 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cc2c(s1)CCOC2 ZINC000264022489 1434063150 /nfs/dbraw/zinc/06/31/50/1434063150.db2.gz SASRZPKZVIPGNL-UHFFFAOYSA-N 0 0 376.390 3.143 20 5 GGBDRN CC(C)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1N(C)C ZINC000264032964 1434064438 /nfs/dbraw/zinc/06/44/38/1434064438.db2.gz FDTODFFREVYOID-UHFFFAOYSA-N 0 0 398.876 3.217 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)COCC(F)(F)F ZINC000264038030 1434064958 /nfs/dbraw/zinc/06/49/58/1434064958.db2.gz FHVSGLMWRNFGOE-GFCCVEGCSA-N 0 0 377.363 3.482 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000264043961 1434065583 /nfs/dbraw/zinc/06/55/83/1434065583.db2.gz OSMFACGJFNGYHS-GFCCVEGCSA-N 0 0 394.431 3.179 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc([C@@H](C)O)cc2)cc1SC ZINC000264046293 1434066061 /nfs/dbraw/zinc/06/60/61/1434066061.db2.gz RRJDAAKKIKAHPY-LLVKDONJSA-N 0 0 376.434 3.309 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc1[N+](=O)[O-] ZINC000264061080 1434067829 /nfs/dbraw/zinc/06/78/29/1434067829.db2.gz RZXRPTVDPZFRRL-NSHDSACASA-N 0 0 385.445 3.327 20 5 GGBDRN CON(C)C(=O)c1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000264078718 1434069997 /nfs/dbraw/zinc/06/99/97/1434069997.db2.gz CJHBENIJAHYLDH-UHFFFAOYSA-N 0 0 398.419 3.081 20 5 GGBDRN O=C(NCCCCNc1ccccn1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000264123101 1434073663 /nfs/dbraw/zinc/07/36/63/1434073663.db2.gz RPJKSIPCWASSJR-UHFFFAOYSA-N 0 0 397.479 3.215 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3C)CC2)c1 ZINC000264154230 1434076220 /nfs/dbraw/zinc/07/62/20/1434076220.db2.gz NBYQVCYXHOVDMW-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN CC[C@H](C)[C@H](C)N(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)C1CC1 ZINC000264175878 1434078524 /nfs/dbraw/zinc/07/85/24/1434078524.db2.gz LPZHUWZYWIUKFM-ZFWWWQNUSA-N 0 0 398.463 3.488 20 5 GGBDRN CSc1ccc(C(=O)N(C)Cc2nccn2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000264193493 1434080530 /nfs/dbraw/zinc/08/05/30/1434080530.db2.gz QPEMYQBEHOEXLZ-UHFFFAOYSA-N 0 0 388.371 3.348 20 5 GGBDRN C[C@@H](c1cccc(NC(=O)COc2cccc([N+](=O)[O-])c2)c1)N1CCOCC1 ZINC000264198461 1434080836 /nfs/dbraw/zinc/08/08/36/1434080836.db2.gz HGVHYAZALOREKO-HNNXBMFYSA-N 0 0 385.420 3.006 20 5 GGBDRN C[C@H](c1cccc(NC(=O)COc2cccc([N+](=O)[O-])c2)c1)N1CCOCC1 ZINC000264198463 1434081055 /nfs/dbraw/zinc/08/10/55/1434081055.db2.gz HGVHYAZALOREKO-OAHLLOKOSA-N 0 0 385.420 3.006 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(OCc3ccncc3)cc2)c(C)c1[N+](=O)[O-] ZINC000264198995 1434081276 /nfs/dbraw/zinc/08/12/76/1434081276.db2.gz PDCHPBWSZWDHKI-UHFFFAOYSA-N 0 0 395.419 3.411 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccc([N+](=O)[O-])s2)c1C ZINC000264207045 1434082421 /nfs/dbraw/zinc/08/24/21/1434082421.db2.gz TYCNZKINNKOHEA-ZDUSSCGKSA-N 0 0 391.474 3.427 20 5 GGBDRN CN(C[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C ZINC000264230511 1434084956 /nfs/dbraw/zinc/08/49/56/1434084956.db2.gz CJUVXJCGVMWCRZ-CYBMUJFWSA-N 0 0 378.429 3.316 20 5 GGBDRN 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CCCC[C@H](COC)NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000265466049 1434236890 /nfs/dbraw/zinc/23/68/90/1434236890.db2.gz VMSNNHSLCQJJJA-SNVBAGLBSA-N 0 0 376.356 3.140 20 5 GGBDRN CSCC[C@H](C)N(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000265469395 1434237170 /nfs/dbraw/zinc/23/71/70/1434237170.db2.gz WSNQSAHWMVQTMO-NSHDSACASA-N 0 0 395.510 3.088 20 5 GGBDRN CCO[C@H](C)c1nc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000265483630 1434238517 /nfs/dbraw/zinc/23/85/17/1434238517.db2.gz AKUMPPZLDBGACM-CQSZACIVSA-N 0 0 376.482 3.471 20 5 GGBDRN O=C(Cc1c[nH]c2ccccc12)N1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000265493489 1434239424 /nfs/dbraw/zinc/23/94/24/1434239424.db2.gz GRMXWQMCOHNODT-UHFFFAOYSA-N 0 0 399.838 3.016 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)o1 ZINC000265501974 1434239984 /nfs/dbraw/zinc/23/99/84/1434239984.db2.gz IKAFPKCQHQTHAC-KRWDZBQOSA-N 0 0 397.387 3.218 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)o1 ZINC000265501976 1434240006 /nfs/dbraw/zinc/24/00/06/1434240006.db2.gz IKAFPKCQHQTHAC-QGZVFWFLSA-N 0 0 397.387 3.218 20 5 GGBDRN O=C(c1cccc(Cn2cc([N+](=O)[O-])cc(Cl)c2=O)c1)N1CCCCC1 ZINC000265518706 1434241669 /nfs/dbraw/zinc/24/16/69/1434241669.db2.gz OKYOVGIRBUBHPS-UHFFFAOYSA-N 0 0 375.812 3.084 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H](c3nnc4n3CCCCC4)C2)c(Cl)c1 ZINC000265520745 1434241841 /nfs/dbraw/zinc/24/18/41/1434241841.db2.gz MAQMUKAJEZFDAS-GFCCVEGCSA-N 0 0 376.848 3.345 20 5 GGBDRN O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000265558867 1434245890 /nfs/dbraw/zinc/24/58/90/1434245890.db2.gz SIOYMQIJBOKKIZ-SIFUEBAJSA-N 0 0 377.404 3.057 20 5 GGBDRN Cc1cc(NC(=O)COc2ccccc2[N+](=O)[O-])ccc1OC1CCOCC1 ZINC000265593210 1434249049 /nfs/dbraw/zinc/24/90/49/1434249049.db2.gz BPUCCZYKSMDDMI-UHFFFAOYSA-N 0 0 386.404 3.479 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(C)nc3c2cnn3C(C)C)cc([N+](=O)[O-])c1 ZINC000265603429 1434249735 /nfs/dbraw/zinc/24/97/35/1434249735.db2.gz MUWVEVPUTCWXMN-UHFFFAOYSA-N 0 0 397.391 3.268 20 5 GGBDRN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000265605878 1434249855 /nfs/dbraw/zinc/24/98/55/1434249855.db2.gz JJXQEUUSYGUMLR-HNNXBMFYSA-N 0 0 382.416 3.473 20 5 GGBDRN CC[C@H](C)[C@H]1CCCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000265604274 1434249935 /nfs/dbraw/zinc/24/99/35/1434249935.db2.gz JBICFSZEKNUBSX-GOEBONIOSA-N 0 0 398.463 3.490 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCCNc2ccc(C)cn2)cc1SC ZINC000265606180 1434249944 /nfs/dbraw/zinc/24/99/44/1434249944.db2.gz MWVYMTVQNRMMPI-UHFFFAOYSA-N 0 0 390.465 3.261 20 5 GGBDRN CC(C)(C)OC(=O)NC1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000265612262 1434250313 /nfs/dbraw/zinc/25/03/13/1434250313.db2.gz XHHOCCJINZGYHH-UHFFFAOYSA-N 0 0 397.859 3.306 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CC[C@H](c3ccccc3OC)C2)cc([N+](=O)[O-])c1 ZINC000265615570 1434250766 /nfs/dbraw/zinc/25/07/66/1434250766.db2.gz IQACZOMJZQYBAE-ZDUSSCGKSA-N 0 0 384.388 3.020 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CC[C@@H](c3ccccc3OC)C2)cc([N+](=O)[O-])c1 ZINC000265615569 1434250769 /nfs/dbraw/zinc/25/07/69/1434250769.db2.gz IQACZOMJZQYBAE-CYBMUJFWSA-N 0 0 384.388 3.020 20 5 GGBDRN CC[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1nnc2n1CCCCC2 ZINC000265620238 1434250947 /nfs/dbraw/zinc/25/09/47/1434250947.db2.gz ZNTXHMJXQQDSNV-OAHLLOKOSA-N 0 0 391.859 3.376 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCCc2ccc(OC)c(OCC)c2)c1[N+](=O)[O-] ZINC000265643549 1434252822 /nfs/dbraw/zinc/25/28/22/1434252822.db2.gz VPKZEGVWQKDVFG-UHFFFAOYSA-N 0 0 390.440 3.040 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CC[C@H](c3ccccc3OC)C2)cc([N+](=O)[O-])c1 ZINC000265645005 1434253036 /nfs/dbraw/zinc/25/30/36/1434253036.db2.gz ROYGMCCPDMFYOE-AWEZNQCLSA-N 0 0 398.415 3.410 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000265659291 1434254165 /nfs/dbraw/zinc/25/41/65/1434254165.db2.gz XGBHSEDCBQYFFQ-AWEZNQCLSA-N 0 0 386.404 3.007 20 5 GGBDRN CN(C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1CCN(C)C1=O ZINC000265679391 1434255808 /nfs/dbraw/zinc/25/58/08/1434255808.db2.gz BJPQOYBDKUNURL-QGZVFWFLSA-N 0 0 384.392 3.082 20 5 GGBDRN CCOC(=O)Cc1cccc(NC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000265678591 1434255878 /nfs/dbraw/zinc/25/58/78/1434255878.db2.gz BFKJHRGOPHKAOD-UHFFFAOYSA-N 0 0 387.392 3.031 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc3c([nH]c2=O)CCCCC3)cc([N+](=O)[O-])c1 ZINC000265686136 1434256771 /nfs/dbraw/zinc/25/67/71/1434256771.db2.gz LJCMIQZWKZRPPD-UHFFFAOYSA-N 0 0 385.376 3.003 20 5 GGBDRN COc1cc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC ZINC000265701745 1434258179 /nfs/dbraw/zinc/25/81/79/1434258179.db2.gz KNJKSOMEFAJOPR-UHFFFAOYSA-N 0 0 388.420 3.215 20 5 GGBDRN COc1cc(OC)c(OC)cc1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265712209 1434259291 /nfs/dbraw/zinc/25/92/91/1434259291.db2.gz ODVUJIAJLJIHDU-UHFFFAOYSA-N 0 0 388.420 3.215 20 5 GGBDRN C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[C@H]1NC(=O)OC(C)(C)C ZINC000265764523 1434263428 /nfs/dbraw/zinc/26/34/28/1434263428.db2.gz IHNUAJMEMVYPJZ-IUODEOHRSA-N 0 0 378.429 3.362 20 5 GGBDRN COC(=O)COc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000265799218 1434266062 /nfs/dbraw/zinc/26/60/62/1434266062.db2.gz UYFAPNFWBLQLKZ-UHFFFAOYSA-N 0 0 386.404 3.371 20 5 GGBDRN C[C@@](O)(CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccsc1 ZINC000265810946 1434266956 /nfs/dbraw/zinc/26/69/56/1434266956.db2.gz FQVFDAIGSXNWFH-GOSISDBHSA-N 0 0 375.450 3.212 20 5 GGBDRN O=C(NCc1cc(F)ccc1N1CCOCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000265810869 1434266994 /nfs/dbraw/zinc/26/69/94/1434266994.db2.gz PUVRFRSHGDKFJA-UHFFFAOYSA-N 0 0 393.802 3.154 20 5 GGBDRN C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1NC(=O)OC(C)(C)C ZINC000265810394 1434267028 /nfs/dbraw/zinc/26/70/28/1434267028.db2.gz SHYADGLYKPOOTP-IUODEOHRSA-N 0 0 378.429 3.362 20 5 GGBDRN COC(=O)Nc1ccc(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000265811775 1434267205 /nfs/dbraw/zinc/26/72/05/1434267205.db2.gz YCZKGNOBMBCELH-UHFFFAOYSA-N 0 0 385.420 3.410 20 5 GGBDRN Cn1c(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)nc2c1cccc2F ZINC000265813340 1434267312 /nfs/dbraw/zinc/26/73/12/1434267312.db2.gz PRMUVRGKVITTKB-UHFFFAOYSA-N 0 0 384.411 3.257 20 5 GGBDRN Cc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c(OCC(=O)N(C)C)c1 ZINC000265814749 1434267460 /nfs/dbraw/zinc/26/74/60/1434267460.db2.gz ZDNRKKUJHXSMKR-UHFFFAOYSA-N 0 0 399.447 3.287 20 5 GGBDRN COc1ccc(SCCC(=O)NCc2ccccc2[N+](=O)[O-])cc1OC ZINC000265833102 1434270304 /nfs/dbraw/zinc/27/03/04/1434270304.db2.gz ZWRIIQDSXICEHM-UHFFFAOYSA-N 0 0 376.434 3.411 20 5 GGBDRN Cc1cccc(NC2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1 ZINC000265843443 1434271368 /nfs/dbraw/zinc/27/13/68/1434271368.db2.gz OHLYIBMKHPIZEY-UHFFFAOYSA-N 0 0 389.477 3.388 20 5 GGBDRN COc1ccc([C@H](C)NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)cc1OC ZINC000265849604 1434272617 /nfs/dbraw/zinc/27/26/17/1434272617.db2.gz AJAJYTNXPGJBGG-NSHDSACASA-N 0 0 390.392 3.120 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000265856893 1434273345 /nfs/dbraw/zinc/27/33/45/1434273345.db2.gz YJPSXGCFDBDCRQ-OAHLLOKOSA-N 0 0 385.468 3.451 20 5 GGBDRN COc1cc(C(=O)N(Cc2ccco2)C[C@H]2CCCO2)cc([N+](=O)[O-])c1OC ZINC000265861328 1434273957 /nfs/dbraw/zinc/27/39/57/1434273957.db2.gz DBHKFCBTLMBPKD-OAHLLOKOSA-N 0 0 390.392 3.026 20 5 GGBDRN C[C@H]1CN(c2nc3sccn3c2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC000265869040 1434275417 /nfs/dbraw/zinc/27/54/17/1434275417.db2.gz VBJYRDPLPKYPDU-QWRGUYRKSA-N 0 0 381.458 3.044 20 5 GGBDRN COc1cc(C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)cc([N+](=O)[O-])c1OC ZINC000265872962 1434276222 /nfs/dbraw/zinc/27/62/22/1434276222.db2.gz HMLPXCNKBCBCRZ-UHFFFAOYSA-N 0 0 399.403 3.065 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC[C@@H]1NC(=O)OC(C)(C)C ZINC000265876215 1434276555 /nfs/dbraw/zinc/27/65/55/1434276555.db2.gz KLGZSMBCSJWGTP-ABAIWWIYSA-N 0 0 381.404 3.109 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCOc3ccc(F)cc32)cc([N+](=O)[O-])c1OC ZINC000265900209 1434280019 /nfs/dbraw/zinc/28/00/19/1434280019.db2.gz PTZRQLMTPXYLCH-ZDUSSCGKSA-N 0 0 376.340 3.005 20 5 GGBDRN COCCN(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000265899284 1434280111 /nfs/dbraw/zinc/28/01/11/1434280111.db2.gz PMESBPIPBXXTLR-CQSZACIVSA-N 0 0 388.420 3.462 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000265909829 1434281547 /nfs/dbraw/zinc/28/15/47/1434281547.db2.gz IUJVEDNLRZODNR-GOSISDBHSA-N 0 0 384.436 3.395 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N[C@H]2CCCc3[nH]c(=O)ccc32)c([N+](=O)[O-])c1 ZINC000265911049 1434281662 /nfs/dbraw/zinc/28/16/62/1434281662.db2.gz IZDFHWBJCIWYPN-INIZCTEOSA-N 0 0 399.451 3.183 20 5 GGBDRN COc1cc(C(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1OC ZINC000265914527 1434282071 /nfs/dbraw/zinc/28/20/71/1434282071.db2.gz AGSOIJNBSKCEDO-SCLBCKFNSA-N 0 0 386.404 3.214 20 5 GGBDRN 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ZINC000271488003 1434829124 /nfs/dbraw/zinc/82/91/24/1434829124.db2.gz HNAYALKZKCSOMO-GFCCVEGCSA-N 0 0 395.510 3.088 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)[C@@H](OC)c2ccc(F)cc2)cc([N+](=O)[O-])c1OC ZINC000271507997 1434830499 /nfs/dbraw/zinc/83/04/99/1434830499.db2.gz LLZBOLKEBULKIA-APPDUMDISA-N 0 0 392.383 3.257 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000271520026 1434831568 /nfs/dbraw/zinc/83/15/68/1434831568.db2.gz ATSCRUQEVPMQIS-MFKMUULPSA-N 0 0 388.367 3.138 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000271520032 1434831600 /nfs/dbraw/zinc/83/16/00/1434831600.db2.gz ATSCRUQEVPMQIS-ZWNOBZJWSA-N 0 0 388.367 3.138 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000271520013 1434831611 /nfs/dbraw/zinc/83/16/11/1434831611.db2.gz ATSCRUQEVPMQIS-GWCFXTLKSA-N 0 0 388.367 3.138 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000271532991 1434832679 /nfs/dbraw/zinc/83/26/79/1434832679.db2.gz TYSJLITWMZGERA-BLLLJJGKSA-N 0 0 396.806 3.494 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H](C(C)C)C1 ZINC000271592015 1434837518 /nfs/dbraw/zinc/83/75/18/1434837518.db2.gz TYRMZGKOVXPKBN-CJNGLKHVSA-N 0 0 382.482 3.267 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H](C(C)C)C1 ZINC000271592046 1434837616 /nfs/dbraw/zinc/83/76/16/1434837616.db2.gz TYRMZGKOVXPKBN-XJKSGUPXSA-N 0 0 382.482 3.267 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000271623090 1434839799 /nfs/dbraw/zinc/83/97/99/1434839799.db2.gz MMLXZXZQLKMKHS-HNNXBMFYSA-N 0 0 398.467 3.043 20 5 GGBDRN COCCn1ccc2ccc(NC(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])cc21 ZINC000271635385 1434840669 /nfs/dbraw/zinc/84/06/69/1434840669.db2.gz XUNLKRYGLRQGCA-UHFFFAOYSA-N 0 0 399.403 3.465 20 5 GGBDRN COc1cc(N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(F)cc1[N+](=O)[O-] ZINC000271669134 1434843101 /nfs/dbraw/zinc/84/31/01/1434843101.db2.gz WMZQNYGMVHLPQE-NSHDSACASA-N 0 0 382.413 3.343 20 5 GGBDRN CC(=O)N1CCN(C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000271672145 1434843178 /nfs/dbraw/zinc/84/31/78/1434843178.db2.gz NERCTPAVIJOWIN-OAHLLOKOSA-N 0 0 388.468 3.232 20 5 GGBDRN COC[C@H](NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000271672703 1434843251 /nfs/dbraw/zinc/84/32/51/1434843251.db2.gz QMFVJXNVOKYRCW-AWEZNQCLSA-N 0 0 396.346 3.008 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)CCc3cnccn3)cc2[N+](=O)[O-])C1 ZINC000271685935 1434844196 /nfs/dbraw/zinc/84/41/96/1434844196.db2.gz RFUOFYSSGKTHSY-IYBDPMFKSA-N 0 0 397.479 3.182 20 5 GGBDRN C[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc2c(c1)CC(=O)N2C ZINC000271766969 1434848929 /nfs/dbraw/zinc/84/89/29/1434848929.db2.gz CFRUJTMZHCOMTI-GFCCVEGCSA-N 0 0 393.403 3.015 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](C)c1ccccc1OC(F)F ZINC000271795005 1434851167 /nfs/dbraw/zinc/85/11/67/1434851167.db2.gz REHYHXASIMRSGH-LLVKDONJSA-N 0 0 395.362 3.494 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000271827189 1434853084 /nfs/dbraw/zinc/85/30/84/1434853084.db2.gz OGSPKQBRJWFPRI-DOTOQJQBSA-N 0 0 398.387 3.219 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)[C@H](OC)c2ccccc2F)cc([N+](=O)[O-])c1OC ZINC000271881763 1434856872 /nfs/dbraw/zinc/85/68/72/1434856872.db2.gz GITOMEXRLWBMRL-GTNSWQLSSA-N 0 0 392.383 3.257 20 5 GGBDRN CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000271892658 1434857551 /nfs/dbraw/zinc/85/75/51/1434857551.db2.gz IFBNGRWURXHUPT-ZMZPIMSZSA-N 0 0 390.367 3.011 20 5 GGBDRN CSc1ccc(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000271926141 1434859763 /nfs/dbraw/zinc/85/97/63/1434859763.db2.gz JFYLYQNFMKQISE-UHFFFAOYSA-N 0 0 394.497 3.019 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCCOCC2)c([N+](=O)[O-])c1N[C@@H]1CCCOCC1 ZINC000271935502 1434860438 /nfs/dbraw/zinc/86/04/38/1434860438.db2.gz XUHSMXQQDKNEJG-UONOGXRCSA-N 0 0 394.428 3.465 20 5 GGBDRN Cc1ccccc1[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000272040535 1434868024 /nfs/dbraw/zinc/86/80/24/1434868024.db2.gz YCISIBLDMUMQQZ-QGZVFWFLSA-N 0 0 395.459 3.370 20 5 GGBDRN COCCOc1cc(NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000272070023 1434870252 /nfs/dbraw/zinc/87/02/52/1434870252.db2.gz CDNRHCHLPBHAHB-UHFFFAOYSA-N 0 0 396.346 3.359 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)CCO1 ZINC000272086298 1434871105 /nfs/dbraw/zinc/87/11/05/1434871105.db2.gz CCBUSVIHTJQJSB-HOCLYGCPSA-N 0 0 380.441 3.326 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000272090112 1434871505 /nfs/dbraw/zinc/87/15/05/1434871505.db2.gz DAQJNIVNMUCGBC-XJKSGUPXSA-N 0 0 378.425 3.080 20 5 GGBDRN C[C@@H](NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000272089491 1434871516 /nfs/dbraw/zinc/87/15/16/1434871516.db2.gz IBWYBXMPHJVQOU-LLVKDONJSA-N 0 0 389.358 3.449 20 5 GGBDRN C[C@H](NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000272089492 1434871539 /nfs/dbraw/zinc/87/15/39/1434871539.db2.gz IBWYBXMPHJVQOU-NSHDSACASA-N 0 0 389.358 3.449 20 5 GGBDRN O=C(CCCNC(=O)c1ccccc1)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272091513 1434871614 /nfs/dbraw/zinc/87/16/14/1434871614.db2.gz DJNVAFTUMFNKRZ-UHFFFAOYSA-N 0 0 389.839 3.117 20 5 GGBDRN COc1ccc(CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)c(OC)c1OC ZINC000272124780 1434873668 /nfs/dbraw/zinc/87/36/68/1434873668.db2.gz ULDDFILWCXLWMK-UHFFFAOYSA-N 0 0 396.346 3.029 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000272145127 1434874722 /nfs/dbraw/zinc/87/47/22/1434874722.db2.gz BWWSFEWVKWKWEQ-HIFRSBDPSA-N 0 0 395.887 3.192 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000272147059 1434874917 /nfs/dbraw/zinc/87/49/17/1434874917.db2.gz CONBXGGBSONBCW-UKRRQHHQSA-N 0 0 392.456 3.040 20 5 GGBDRN COc1cc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc(OC)c1OC ZINC000272165225 1434875732 /nfs/dbraw/zinc/87/57/32/1434875732.db2.gz OOQFRXXCYLENGH-UHFFFAOYSA-N 0 0 394.811 3.247 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000272192503 1434877078 /nfs/dbraw/zinc/87/70/78/1434877078.db2.gz BTUDYTSXFZWRNO-GDBMZVCRSA-N 0 0 391.468 3.289 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000272192506 1434877102 /nfs/dbraw/zinc/87/71/02/1434877102.db2.gz BTUDYTSXFZWRNO-GOEBONIOSA-N 0 0 391.468 3.289 20 5 GGBDRN O=C(N[C@@H]1CCCOc2cc(F)ccc21)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000272194517 1434877282 /nfs/dbraw/zinc/87/72/82/1434877282.db2.gz HYKVFDBZHDSRKV-CQSZACIVSA-N 0 0 388.351 3.149 20 5 GGBDRN Cc1cc(C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)CC2)[nH]n1 ZINC000272205824 1434878081 /nfs/dbraw/zinc/87/80/81/1434878081.db2.gz ICNKPHYHUMRLFM-UHFFFAOYSA-N 0 0 383.452 3.246 20 5 GGBDRN Cc1cccc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c1C(=O)N1CCCC1 ZINC000272207972 1434878138 /nfs/dbraw/zinc/87/81/38/1434878138.db2.gz PRGKBCMXGVWIRU-UHFFFAOYSA-N 0 0 397.387 3.120 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@H]1CCCC1=O ZINC000272212472 1434878556 /nfs/dbraw/zinc/87/85/56/1434878556.db2.gz RTNQMXJGHQSWDT-ZIAGYGMSSA-N 0 0 380.828 3.377 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H]1[C@H]1CCCC1=O ZINC000272212462 1434878585 /nfs/dbraw/zinc/87/85/85/1434878585.db2.gz RTNQMXJGHQSWDT-KGLIPLIRSA-N 0 0 380.828 3.377 20 5 GGBDRN COCCCOC1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000272223258 1434879291 /nfs/dbraw/zinc/87/92/91/1434879291.db2.gz GZAOQORZNFDATN-UHFFFAOYSA-N 0 0 399.875 3.018 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000272229631 1434879890 /nfs/dbraw/zinc/87/98/90/1434879890.db2.gz UHRJKIUEFCZFPV-HIFRSBDPSA-N 0 0 392.456 3.040 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC(c3cc(C)n[nH]3)CC2)cc1OC ZINC000272237919 1434880601 /nfs/dbraw/zinc/88/06/01/1434880601.db2.gz NDNRESLXBATSAT-UHFFFAOYSA-N 0 0 388.424 3.053 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](CCOC)c2ccc(C)o2)cc1OC ZINC000272236539 1434880618 /nfs/dbraw/zinc/88/06/18/1434880618.db2.gz GMFITRKPMVQZGD-AWEZNQCLSA-N 0 0 392.408 3.411 20 5 GGBDRN CCCOc1cc(NC(=O)N[C@@H](C)c2nc[nH]n2)c([N+](=O)[O-])cc1OCCC ZINC000272253500 1434881960 /nfs/dbraw/zinc/88/19/60/1434881960.db2.gz IRGBSFHDNBLUEN-NSHDSACASA-N 0 0 392.416 3.173 20 5 GGBDRN O=C(Nc1nc(CN2CCCCC2)cs1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272258738 1434882236 /nfs/dbraw/zinc/88/22/36/1434882236.db2.gz ZSLGAUBXWIZDQH-UHFFFAOYSA-N 0 0 390.421 3.018 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CC[C@@H](COCc2ccccc2)C1 ZINC000272262495 1434882393 /nfs/dbraw/zinc/88/23/93/1434882393.db2.gz BHORQMAAWKMEQY-OAHLLOKOSA-N 0 0 384.388 3.002 20 5 GGBDRN CO[C@H](C)c1nc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cs1 ZINC000272268922 1434882905 /nfs/dbraw/zinc/88/29/05/1434882905.db2.gz CUDWKRMGKCHRHK-MRVPVSSYSA-N 0 0 387.364 3.290 20 5 GGBDRN 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ZINC000272298044 1434885229 /nfs/dbraw/zinc/88/52/29/1434885229.db2.gz GKSCUDDSFGYZFB-UHFFFAOYSA-N 0 0 384.379 3.267 20 5 GGBDRN Nc1ccc(C(=O)N2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000272302418 1434885768 /nfs/dbraw/zinc/88/57/68/1434885768.db2.gz WYVGPILLYAJZGN-OAHLLOKOSA-N 0 0 398.467 3.363 20 5 GGBDRN O=C(Nc1cc(CSCCO)ccn1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272330037 1434887775 /nfs/dbraw/zinc/88/77/75/1434887775.db2.gz MXMHVVBFKYWTOV-UHFFFAOYSA-N 0 0 399.375 3.069 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000272331003 1434887801 /nfs/dbraw/zinc/88/78/01/1434887801.db2.gz VNPZLPVACOIPKP-UHFFFAOYSA-N 0 0 386.351 3.002 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000272332183 1434887803 /nfs/dbraw/zinc/88/78/03/1434887803.db2.gz LTMZJNNZNZRUGL-UKRRQHHQSA-N 0 0 378.375 3.358 20 5 GGBDRN Cn1cc(C(=O)C[C@H]2CCCN2c2ccc([N+](=O)[O-])c(OC(F)F)c2)cn1 ZINC000272333236 1434887972 /nfs/dbraw/zinc/88/79/72/1434887972.db2.gz VVPJIKDHTDJBKK-GFCCVEGCSA-N 0 0 380.351 3.172 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000272345300 1434889152 /nfs/dbraw/zinc/88/91/52/1434889152.db2.gz QBMYDRNYDXOEGA-HIFRSBDPSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000272345302 1434889177 /nfs/dbraw/zinc/88/91/77/1434889177.db2.gz QBMYDRNYDXOEGA-UKRRQHHQSA-N 0 0 377.441 3.279 20 5 GGBDRN COc1cc(CNc2cnn(CC(F)F)c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272348938 1434889442 /nfs/dbraw/zinc/88/94/42/1434889442.db2.gz CVOMNTLDPWPKGI-UHFFFAOYSA-N 0 0 392.309 3.321 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@H](OCc2ccccn2)C1 ZINC000272373747 1434891182 /nfs/dbraw/zinc/89/11/82/1434891182.db2.gz UZBBYLNIRGIEIP-AWEZNQCLSA-N 0 0 393.346 3.023 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000272393009 1434893419 /nfs/dbraw/zinc/89/34/19/1434893419.db2.gz WZBNDUFIRVWEIH-PPEJIECUSA-N 0 0 389.452 3.370 20 5 GGBDRN O=C(c1ccccc1)c1ccc(NC[C@H]2CC(=O)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000272400208 1434893953 /nfs/dbraw/zinc/89/39/53/1434893953.db2.gz AXCYJGHYOZKAEK-CQSZACIVSA-N 0 0 379.416 3.249 20 5 GGBDRN O=C(c1ccccc1)c1ccc(NC[C@@H]2CC(=O)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000272400205 1434893966 /nfs/dbraw/zinc/89/39/66/1434893966.db2.gz AXCYJGHYOZKAEK-AWEZNQCLSA-N 0 0 379.416 3.249 20 5 GGBDRN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272409632 1434894454 /nfs/dbraw/zinc/89/44/54/1434894454.db2.gz KXNGHXDVGRTVDD-KSSFIOAISA-N 0 0 384.388 3.221 20 5 GGBDRN CCN(CC)C(=O)c1ccccc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272418844 1434895104 /nfs/dbraw/zinc/89/51/04/1434895104.db2.gz MGCIYUITEOFHQL-UHFFFAOYSA-N 0 0 385.376 3.058 20 5 GGBDRN COc1cccc(C2=CCN(C(=O)c3cc(OC)c(OC)c([N+](=O)[O-])c3)C2)c1 ZINC000272439781 1434896330 /nfs/dbraw/zinc/89/63/30/1434896330.db2.gz UQFRDXYDGMEDKL-UHFFFAOYSA-N 0 0 384.388 3.160 20 5 GGBDRN Cc1cc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)ccc1C(=O)NC(C)C ZINC000272440386 1434896358 /nfs/dbraw/zinc/89/63/58/1434896358.db2.gz PDNUAECKFLEDIH-UHFFFAOYSA-N 0 0 385.376 3.022 20 5 GGBDRN COCC[C@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])c1ccco1 ZINC000272470455 1434898472 /nfs/dbraw/zinc/89/84/72/1434898472.db2.gz NAVZCTXIAHBMLS-LBPRGKRZSA-N 0 0 390.364 3.374 20 5 GGBDRN COc1ccc(C(=O)N2CCCc3c(NC(C)=O)ccc(C)c32)cc1[N+](=O)[O-] ZINC000272469245 1434898514 /nfs/dbraw/zinc/89/85/14/1434898514.db2.gz PKTSBDHBRNNUCC-UHFFFAOYSA-N 0 0 383.404 3.463 20 5 GGBDRN O=C(Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272501930 1434901226 /nfs/dbraw/zinc/90/12/26/1434901226.db2.gz XHVROXIOWXKPAZ-HNNXBMFYSA-N 0 0 396.359 3.304 20 5 GGBDRN Cn1ccnc1[C@H](N[C@H]1CCO[C@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272506289 1434901472 /nfs/dbraw/zinc/90/14/72/1434901472.db2.gz ICTJXWJXTPJJRN-KVSKMBFKSA-N 0 0 388.493 3.062 20 5 GGBDRN Cn1ccnc1[C@H](N[C@@H]1CCO[C@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272506293 1434901529 /nfs/dbraw/zinc/90/15/29/1434901529.db2.gz ICTJXWJXTPJJRN-SZVBFZGTSA-N 0 0 388.493 3.062 20 5 GGBDRN Cn1ccnc1[C@H](N[C@H]1CCO[C@@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272506296 1434901578 /nfs/dbraw/zinc/90/15/78/1434901578.db2.gz ICTJXWJXTPJJRN-WDYCEAGBSA-N 0 0 388.493 3.062 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000272517850 1434903114 /nfs/dbraw/zinc/90/31/14/1434903114.db2.gz PLPCTAHUBDMCGI-VXGBXAGGSA-N 0 0 381.404 3.109 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000272516801 1434903145 /nfs/dbraw/zinc/90/31/45/1434903145.db2.gz PLPCTAHUBDMCGI-NWDGAFQWSA-N 0 0 381.404 3.109 20 5 GGBDRN Cn1ccnc1[C@H](NCCc1ccc2c(c1)CCO2)c1ccc([N+](=O)[O-])cc1 ZINC000272522760 1434904055 /nfs/dbraw/zinc/90/40/55/1434904055.db2.gz LMKOXQKQHQFRPI-HXUWFJFHSA-N 0 0 378.432 3.185 20 5 GGBDRN Cn1ccnc1[C@@H](NCCc1ccc2c(c1)CCO2)c1ccc([N+](=O)[O-])cc1 ZINC000272522758 1434904086 /nfs/dbraw/zinc/90/40/86/1434904086.db2.gz LMKOXQKQHQFRPI-FQEVSTJZSA-N 0 0 378.432 3.185 20 5 GGBDRN COCCOc1ccccc1CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272530520 1434904525 /nfs/dbraw/zinc/90/45/25/1434904525.db2.gz MZWNFWOFOOFZJI-HXUWFJFHSA-N 0 0 396.447 3.233 20 5 GGBDRN Cn1ccnc1[C@H](NCc1ccc(N2CCCC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000272528926 1434904635 /nfs/dbraw/zinc/90/46/35/1434904635.db2.gz MOFQWCAROGKLGF-HXUWFJFHSA-N 0 0 392.463 3.203 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272539074 1434905791 /nfs/dbraw/zinc/90/57/91/1434905791.db2.gz OREZZXNUUDISON-AZUAARDMSA-N 0 0 395.463 3.437 20 5 GGBDRN CC(C)c1nnc([C@H](C)NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000272545498 1434906286 /nfs/dbraw/zinc/90/62/86/1434906286.db2.gz QKMUIGSBIJMIJQ-JTQLQIEISA-N 0 0 380.836 3.093 20 5 GGBDRN COc1ccc(OC)c(CCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272558464 1434907562 /nfs/dbraw/zinc/90/75/62/1434907562.db2.gz STMKWERYAKWIEI-FQEVSTJZSA-N 0 0 396.447 3.267 20 5 GGBDRN CCc1cc(NC[C@@H]2CC(=O)N(C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272561734 1434908175 /nfs/dbraw/zinc/90/81/75/1434908175.db2.gz VPURLWXLQOZEGM-ZDUSSCGKSA-N 0 0 381.436 3.037 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1-c1nc([C@H]2CN(Cc3ccccc3)CCO2)no1 ZINC000272568313 1434908794 /nfs/dbraw/zinc/90/87/94/1434908794.db2.gz CSZOALSLMJMFGE-QGZVFWFLSA-N 0 0 384.367 3.357 20 5 GGBDRN C[C@H]1C[C@@H](N(C)C(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000272571796 1434908999 /nfs/dbraw/zinc/90/89/99/1434908999.db2.gz SADUJQIRFVWJLL-YJBOKZPZSA-N 0 0 383.448 3.426 20 5 GGBDRN COc1ccc(CCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000272576404 1434909570 /nfs/dbraw/zinc/90/95/70/1434909570.db2.gz XFEWQSFVFICQAN-FQEVSTJZSA-N 0 0 396.447 3.267 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCC(n2ccnc2)CC1 ZINC000272578118 1434910085 /nfs/dbraw/zinc/91/00/85/1434910085.db2.gz USHPAYKBNGEFLH-UHFFFAOYSA-N 0 0 377.832 3.034 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@](C)(O)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000272585852 1434911018 /nfs/dbraw/zinc/91/10/18/1434911018.db2.gz ZCRRKQJXCYZQJR-ICSRJNTNSA-N 0 0 384.411 3.054 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272614572 1434915319 /nfs/dbraw/zinc/91/53/19/1434915319.db2.gz XIZLNSYYSZJASG-UHFFFAOYSA-N 0 0 399.394 3.202 20 5 GGBDRN O=[N+]([O-])c1cccc(CCc2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)c1 ZINC000272621371 1434916355 /nfs/dbraw/zinc/91/63/55/1434916355.db2.gz IWFAENGVZWDUFO-LJQANCHMSA-N 0 0 394.431 3.337 20 5 GGBDRN CC[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000272638239 1434918462 /nfs/dbraw/zinc/91/84/62/1434918462.db2.gz BVUATMFNGWSIPX-MAUKXSAKSA-N 0 0 395.423 3.079 20 5 GGBDRN C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(NC(=O)NC2CC2)cc1 ZINC000272648971 1434919596 /nfs/dbraw/zinc/91/95/96/1434919596.db2.gz DPROFEKRENFVLO-NSHDSACASA-N 0 0 384.396 3.156 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000272666681 1434920943 /nfs/dbraw/zinc/92/09/43/1434920943.db2.gz JJMXYPJJZHANCF-HNNXBMFYSA-N 0 0 394.334 3.197 20 5 GGBDRN O=C(Nc1cccc(F)c1)C1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000272666768 1434920944 /nfs/dbraw/zinc/92/09/44/1434920944.db2.gz JLQQFKNFWUWCDV-UHFFFAOYSA-N 0 0 387.371 3.012 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCc1nc([C@H]2CN(Cc3ccccc3)CCO2)no1 ZINC000272669904 1434921082 /nfs/dbraw/zinc/92/10/82/1434921082.db2.gz QCOLZLSZXYJIEG-GOSISDBHSA-N 0 0 396.403 3.130 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000272673543 1434921514 /nfs/dbraw/zinc/92/15/14/1434921514.db2.gz KQXUOKRGUSOENW-CQSZACIVSA-N 0 0 385.376 3.353 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)cc1 ZINC000272675951 1434921732 /nfs/dbraw/zinc/92/17/32/1434921732.db2.gz RDTZIRUSNVAZID-GOSISDBHSA-N 0 0 396.403 3.130 20 5 GGBDRN CC(C)[C@H]1C[C@@H](CC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)CCO1 ZINC000272690291 1434923021 /nfs/dbraw/zinc/92/30/21/1434923021.db2.gz DFKSNVSZDKWUND-QFBILLFUSA-N 0 0 375.469 3.085 20 5 GGBDRN CC(=O)NC1(c2noc([C@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)n2)CCCCC1 ZINC000272713589 1434925453 /nfs/dbraw/zinc/92/54/53/1434925453.db2.gz IQPQGTRJBPHLHY-MRXNPFEDSA-N 0 0 399.407 3.139 20 5 GGBDRN COc1cccc(CN(C[C@@H]2CCCO2)C(=O)Nc2ccncc2[N+](=O)[O-])c1 ZINC000272744665 1434927711 /nfs/dbraw/zinc/92/77/11/1434927711.db2.gz RLWYOXDHVPZVIN-INIZCTEOSA-N 0 0 386.408 3.212 20 5 GGBDRN Cc1ccnc(OC2CCN(C(=O)CCOc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000272793383 1434931467 /nfs/dbraw/zinc/93/14/67/1434931467.db2.gz JVBIZXORRBYTJW-UHFFFAOYSA-N 0 0 385.420 3.137 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000272795013 1434931695 /nfs/dbraw/zinc/93/16/95/1434931695.db2.gz UGUWRUSHYSNFAN-UHFFFAOYSA-N 0 0 388.424 3.178 20 5 GGBDRN COc1ccc(NC(=O)N2CCC(OC[C@H]3CCCCO3)CC2)cc1[N+](=O)[O-] ZINC000272801248 1434932074 /nfs/dbraw/zinc/93/20/74/1434932074.db2.gz HTHKTEQHTHFKDU-MRXNPFEDSA-N 0 0 393.440 3.185 20 5 GGBDRN COc1ccc(NC(=O)N2CCC(NC(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000272801064 1434932111 /nfs/dbraw/zinc/93/21/11/1434932111.db2.gz HPHMVZBSJVOLMZ-UHFFFAOYSA-N 0 0 398.419 3.030 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CCCN2c2ncnc3sccc32)cc1[N+](=O)[O-] ZINC000272805937 1434932274 /nfs/dbraw/zinc/93/22/74/1434932274.db2.gz MANPFQPHPMTFCU-ZDUSSCGKSA-N 0 0 399.432 3.216 20 5 GGBDRN COc1ccc(NC(=O)c2ccc(CN(C)C(=O)C(C)C)cc2)cc1[N+](=O)[O-] ZINC000272813117 1434932813 /nfs/dbraw/zinc/93/28/13/1434932813.db2.gz NRKIWDSBOWRAIZ-UHFFFAOYSA-N 0 0 385.420 3.470 20 5 GGBDRN O=C(Nc1cccc(NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)c1)C1CC1 ZINC000272815222 1434933102 /nfs/dbraw/zinc/93/31/02/1434933102.db2.gz VTUGAPWBWPFZFC-GOSISDBHSA-N 0 0 394.387 3.075 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272813119 1434933142 /nfs/dbraw/zinc/93/31/42/1434933142.db2.gz JRWWWJLODAZKLA-ZIAGYGMSSA-N 0 0 392.456 3.152 20 5 GGBDRN COc1ccc(NC(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000272827404 1434934266 /nfs/dbraw/zinc/93/42/66/1434934266.db2.gz MCHQZNSUVHUVFS-UHFFFAOYSA-N 0 0 398.419 3.048 20 5 GGBDRN COc1ccc(NC(=O)N(C)Cc2nccn2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000272831820 1434934502 /nfs/dbraw/zinc/93/45/02/1434934502.db2.gz MXCRGXRXENDJHG-UHFFFAOYSA-N 0 0 387.318 3.026 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)cc1[N+](=O)[O-] ZINC000272832856 1434934653 /nfs/dbraw/zinc/93/46/53/1434934653.db2.gz RKXMESOYAJIGHL-LJQANCHMSA-N 0 0 383.404 3.296 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000272837115 1434934974 /nfs/dbraw/zinc/93/49/74/1434934974.db2.gz SDQSNZBTZOEGRS-ZBFHGGJFSA-N 0 0 375.425 3.209 20 5 GGBDRN COC(=O)N(C)Cc1ccc(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000272843421 1434935462 /nfs/dbraw/zinc/93/54/62/1434935462.db2.gz NKGSJLMKCZXIIF-UHFFFAOYSA-N 0 0 399.450 3.002 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000272847800 1434935622 /nfs/dbraw/zinc/93/56/22/1434935622.db2.gz UWLLUWVSXAFMSD-HNNXBMFYSA-N 0 0 383.404 3.094 20 5 GGBDRN Cc1ccnc(OC2CCN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)CC2)c1 ZINC000272847896 1434935672 /nfs/dbraw/zinc/93/56/72/1434935672.db2.gz UXUMAXZCGRTLPV-UHFFFAOYSA-N 0 0 394.431 3.392 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])s1 ZINC000272852503 1434936013 /nfs/dbraw/zinc/93/60/13/1434936013.db2.gz VSUUFWVDPQLZIG-NEPJUHHUSA-N 0 0 381.454 3.270 20 5 GGBDRN COc1ccc(NC(=O)N2CCC(Oc3cc(C)ccn3)CC2)cc1[N+](=O)[O-] ZINC000272857334 1434936546 /nfs/dbraw/zinc/93/65/46/1434936546.db2.gz RMMJLANZVKPGJK-UHFFFAOYSA-N 0 0 386.408 3.382 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCCCC(=O)OCc2ccccc2)c1[N+](=O)[O-] ZINC000272860316 1434936643 /nfs/dbraw/zinc/93/66/43/1434936643.db2.gz LWOJDNWAFDATMK-UHFFFAOYSA-N 0 0 388.424 3.085 20 5 GGBDRN COc1ccc(NC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000272865590 1434937275 /nfs/dbraw/zinc/93/72/75/1434937275.db2.gz SUUAUQOQQBGHEE-KRWDZBQOSA-N 0 0 375.356 3.348 20 5 GGBDRN C[C@H]1COCCN1c1ccc(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000272874696 1434937943 /nfs/dbraw/zinc/93/79/43/1434937943.db2.gz UDIHXFHCQFVJOA-NSHDSACASA-N 0 0 397.478 3.029 20 5 GGBDRN CC(C)Oc1cccc([C@H](C)Nc2cc([N+](=O)[O-])ccc2S(N)(=O)=O)c1 ZINC000272887198 1434938587 /nfs/dbraw/zinc/93/85/87/1434938587.db2.gz ILNDCFVLYMCZGI-LBPRGKRZSA-N 0 0 379.438 3.203 20 5 GGBDRN Cc1nc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)ccc1[C@@H](C)O ZINC000272903673 1434940027 /nfs/dbraw/zinc/94/00/27/1434940027.db2.gz CGZGWTPBBGDSLP-SNVBAGLBSA-N 0 0 383.326 3.300 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N2CCCCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000272907615 1434940298 /nfs/dbraw/zinc/94/02/98/1434940298.db2.gz LDIZLXNDGIVIAY-MRXNPFEDSA-N 0 0 398.419 3.081 20 5 GGBDRN Cc1nc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])ccc1[C@H](C)O ZINC000272959172 1434944352 /nfs/dbraw/zinc/94/43/52/1434944352.db2.gz JJWXQRPVWBKPHV-LBPRGKRZSA-N 0 0 393.827 3.090 20 5 GGBDRN CC(C)C(=O)NC1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000272972742 1434945299 /nfs/dbraw/zinc/94/52/99/1434945299.db2.gz VTUFPUWAQPRYDC-UHFFFAOYSA-N 0 0 399.900 3.104 20 5 GGBDRN COc1cc(CCNC(=O)C[C@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000272983905 1434946831 /nfs/dbraw/zinc/94/68/31/1434946831.db2.gz RUUJCPHQILZTAG-YOEHRIQHSA-N 0 0 394.468 3.112 20 5 GGBDRN CC(C)N1CCc2nc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)sc2C1 ZINC000273003345 1434948856 /nfs/dbraw/zinc/94/88/56/1434948856.db2.gz HXEXLSLLMGACJT-UHFFFAOYSA-N 0 0 399.476 3.480 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccc(N3CCOC3=O)cc2)cc1[N+](=O)[O-] ZINC000273009389 1434949488 /nfs/dbraw/zinc/94/94/88/1434949488.db2.gz UWIDMFBPJPWIHE-AWEZNQCLSA-N 0 0 398.419 3.420 20 5 GGBDRN Cc1cc(C2CCN([C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)n[nH]1 ZINC000273018171 1434950585 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ZINC000273291310 1434978606 /nfs/dbraw/zinc/97/86/06/1434978606.db2.gz KHXUXLGCNUEYFW-AWEZNQCLSA-N 0 0 377.404 3.281 20 5 GGBDRN CN(CC(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000273320556 1434980524 /nfs/dbraw/zinc/98/05/24/1434980524.db2.gz RTYDZXAMHSMDSP-APWZRJJASA-N 0 0 387.411 3.207 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273330674 1434981356 /nfs/dbraw/zinc/98/13/56/1434981356.db2.gz UEIUGOSJPUWVKV-DLBZAZTESA-N 0 0 390.415 3.008 20 5 GGBDRN COC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273354257 1434982726 /nfs/dbraw/zinc/98/27/26/1434982726.db2.gz UNRPBMRNFZTEIP-CQSZACIVSA-N 0 0 382.482 3.004 20 5 GGBDRN COC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273354255 1434982769 /nfs/dbraw/zinc/98/27/69/1434982769.db2.gz UNRPBMRNFZTEIP-AWEZNQCLSA-N 0 0 382.482 3.004 20 5 GGBDRN CN(C[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1)C(=O)OC(C)(C)C ZINC000273365756 1434983617 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ZINC000276439599 1435211594 /nfs/dbraw/zinc/21/15/94/1435211594.db2.gz RBGRSBBDLJDJTK-AWEZNQCLSA-N 0 0 383.470 3.033 20 5 GGBDRN CC(=O)CCc1ccc(OCC(=O)OCc2ncc(C)c([N+](=O)[O-])c2C)cc1 ZINC000276458419 1435212553 /nfs/dbraw/zinc/21/25/53/1435212553.db2.gz VYNOLFMKXFNYAQ-UHFFFAOYSA-N 0 0 386.404 3.250 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000276464635 1435212647 /nfs/dbraw/zinc/21/26/47/1435212647.db2.gz PJCPXKLZAHRTDF-CHWSQXEVSA-N 0 0 377.441 3.275 20 5 GGBDRN COCCOc1cc(OC)ccc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000276491997 1435214235 /nfs/dbraw/zinc/21/42/35/1435214235.db2.gz VQPMDXFZDJOMIV-UHFFFAOYSA-N 0 0 386.404 3.222 20 5 GGBDRN CC(C)c1cc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)n(-c2ncccn2)n1 ZINC000276496836 1435214422 /nfs/dbraw/zinc/21/44/22/1435214422.db2.gz RQZWOXIEHJEVIG-UHFFFAOYSA-N 0 0 395.423 3.058 20 5 GGBDRN CCOc1cc(OCC(=O)Nc2ccc(OC)c(OC)c2)ccc1[N+](=O)[O-] ZINC000276567217 1435217929 /nfs/dbraw/zinc/21/79/29/1435217929.db2.gz 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ZINC000276724002 1435228030 /nfs/dbraw/zinc/22/80/30/1435228030.db2.gz BVDTVKBXBWJQRX-UHFFFAOYSA-N 0 0 391.380 3.245 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2csc([C@@H]3CCCO3)n2)c(C)c([N+](=O)[O-])c1 ZINC000276723985 1435228074 /nfs/dbraw/zinc/22/80/74/1435228074.db2.gz BUVNTJWNCUUWTM-AWEZNQCLSA-N 0 0 391.405 3.250 20 5 GGBDRN COC(=O)c1cnc(N2CCO[C@H](c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1 ZINC000276731231 1435228595 /nfs/dbraw/zinc/22/85/95/1435228595.db2.gz LNHCBHFDUZJJQY-HNNXBMFYSA-N 0 0 377.784 3.008 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc3c(s2)CCOC3)c(C)c([N+](=O)[O-])c1 ZINC000276736431 1435229032 /nfs/dbraw/zinc/22/90/32/1435229032.db2.gz DIIOSRVMYLHOBS-UHFFFAOYSA-N 0 0 376.390 3.076 20 5 GGBDRN COCCc1nc2cc(NC(=O)c3cc(OC)c(C)c([N+](=O)[O-])c3)ccc2o1 ZINC000276752077 1435230035 /nfs/dbraw/zinc/23/00/35/1435230035.db2.gz HWNXOVGLOCQOEI-UHFFFAOYSA-N 0 0 385.376 3.494 20 5 GGBDRN COc1ccc(NC(=O)N2CCC(Oc3ccc(F)nc3)CC2)cc1[N+](=O)[O-] ZINC000276761235 1435230636 /nfs/dbraw/zinc/23/06/36/1435230636.db2.gz GPVUAHZSSKITKR-UHFFFAOYSA-N 0 0 390.371 3.213 20 5 GGBDRN O=C(CCOCC(F)(F)C(F)F)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000276764895 1435230826 /nfs/dbraw/zinc/23/08/26/1435230826.db2.gz MYKURAHLFOCDFW-UHFFFAOYSA-N 0 0 396.293 3.002 20 5 GGBDRN Cc1cc(NC[C@@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)ccc1[N+](=O)[O-] ZINC000276779700 1435232015 /nfs/dbraw/zinc/23/20/15/1435232015.db2.gz DEYUPGFFMCCVQR-IFXJQAMLSA-N 0 0 385.468 3.437 20 5 GGBDRN COc1ccc(OC(=O)[C@H](C)Oc2ccc(CCC(C)=O)cc2)cc1[N+](=O)[O-] ZINC000276791601 1435232796 /nfs/dbraw/zinc/23/27/96/1435232796.db2.gz SZVUSSCVQBSHCV-AWEZNQCLSA-N 0 0 387.388 3.498 20 5 GGBDRN CC[C@]1(C)Oc2ccc(NC(=O)C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2O1 ZINC000276803210 1435233833 /nfs/dbraw/zinc/23/38/33/1435233833.db2.gz SWAAFJHFZYBSHR-MPBGBICISA-N 0 0 399.403 3.308 20 5 GGBDRN CCOc1cc(CNc2ccc(F)cc2CS(C)(=O)=O)ccc1[N+](=O)[O-] ZINC000276830472 1435235759 /nfs/dbraw/zinc/23/57/59/1435235759.db2.gz AZLMMFHGNAUXRE-UHFFFAOYSA-N 0 0 382.413 3.289 20 5 GGBDRN COC(=O)COc1ccc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000276856792 1435237762 /nfs/dbraw/zinc/23/77/62/1435237762.db2.gz JTMXKIQDYFMMET-UHFFFAOYSA-N 0 0 388.376 3.024 20 5 GGBDRN CCOc1cc(CNc2cc(C(=O)N3CCOCC3)ccc2C)ccc1[N+](=O)[O-] ZINC000276868206 1435238642 /nfs/dbraw/zinc/23/86/42/1435238642.db2.gz HHQPGIFZMPTKKY-UHFFFAOYSA-N 0 0 399.447 3.386 20 5 GGBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000276915326 1435242688 /nfs/dbraw/zinc/24/26/88/1435242688.db2.gz PAKNYRNMGSGWAG-UHFFFAOYSA-N 0 0 384.367 3.294 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(c2ccccc2)[C@H]2CCOC2)cc1OC ZINC000276925407 1435243512 /nfs/dbraw/zinc/24/35/12/1435243512.db2.gz SRZHKQOKOQRXQF-HNNXBMFYSA-N 0 0 386.404 3.438 20 5 GGBDRN COc1cc(C(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)cc([N+](=O)[O-])c1C ZINC000276939828 1435245174 /nfs/dbraw/zinc/24/51/74/1435245174.db2.gz TYZZMRNDPDYEFN-KRWDZBQOSA-N 0 0 392.452 3.102 20 5 GGBDRN CC[C@H](C)c1nnc([C@H](C)NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)[nH]1 ZINC000276941723 1435245388 /nfs/dbraw/zinc/24/53/88/1435245388.db2.gz UUQFXZHQDRPQFK-UWVGGRQHSA-N 0 0 380.836 3.440 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)c1 ZINC000276955874 1435246667 /nfs/dbraw/zinc/24/66/67/1435246667.db2.gz REPPYGLFYCSCIV-INIZCTEOSA-N 0 0 391.493 3.370 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(NC[C@H]2CC[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000276956370 1435246813 /nfs/dbraw/zinc/24/68/13/1435246813.db2.gz RXGZFVHEVAKFPW-ZFWWWQNUSA-N 0 0 398.415 3.185 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(NC[C@@H]2CC[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000276956359 1435246977 /nfs/dbraw/zinc/24/69/77/1435246977.db2.gz RXGZFVHEVAKFPW-HIFRSBDPSA-N 0 0 398.415 3.185 20 5 GGBDRN CCOc1cc(CNc2ccccc2C(=O)N2CCC[C@@H](O)C2)ccc1[N+](=O)[O-] ZINC000276974395 1435248661 /nfs/dbraw/zinc/24/86/61/1435248661.db2.gz XIGHSNKIKSNKKN-MRXNPFEDSA-N 0 0 399.447 3.203 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1c1nnc(C2CCOCC2)o1 ZINC000277006137 1435251396 /nfs/dbraw/zinc/25/13/96/1435251396.db2.gz UZRCSPDMVOWMEB-MRXNPFEDSA-N 0 0 386.408 3.239 20 5 GGBDRN CCc1c(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cnn1CCC(C)C ZINC000277011697 1435251997 /nfs/dbraw/zinc/25/19/97/1435251997.db2.gz DZUUJLXIQPZFGI-UHFFFAOYSA-N 0 0 388.424 3.423 20 5 GGBDRN Cc1noc(C[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)c2ccccc2)n1 ZINC000277017932 1435252320 /nfs/dbraw/zinc/25/23/20/1435252320.db2.gz ADTOXMLBMKWGOH-SFHVURJKSA-N 0 0 380.404 3.319 20 5 GGBDRN CCN(CC)C(=O)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000277034975 1435254509 /nfs/dbraw/zinc/25/45/09/1435254509.db2.gz GQJQCRYZFLKKOZ-UHFFFAOYSA-N 0 0 385.420 3.015 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000277041436 1435255279 /nfs/dbraw/zinc/25/52/79/1435255279.db2.gz HFSUZXNAUHBBDP-IUODEOHRSA-N 0 0 376.434 3.393 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(C)nc(C(F)(F)F)n2)c(C)c([N+](=O)[O-])c1 ZINC000277044822 1435255670 /nfs/dbraw/zinc/25/56/70/1435255670.db2.gz KQMSRIIMLNDCMI-UHFFFAOYSA-N 0 0 398.297 3.059 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1cccc(N2CCOC2=O)c1 ZINC000277068092 1435258625 /nfs/dbraw/zinc/25/86/25/1435258625.db2.gz KXOQYJIGIBQMBS-LBPRGKRZSA-N 0 0 385.376 3.051 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCOc3c(F)cccc32)c([N+](=O)[O-])cc1OC ZINC000277079342 1435259901 /nfs/dbraw/zinc/25/99/01/1435259901.db2.gz JPHKQIIVODCSKN-ZDUSSCGKSA-N 0 0 376.340 3.005 20 5 GGBDRN CCCc1c(NC(=O)CCn2cc([N+](=O)[O-])cn2)cnn1-c1ccccc1C ZINC000277083252 1435260341 /nfs/dbraw/zinc/26/03/41/1435260341.db2.gz MGBGYTLXLLFSAE-UHFFFAOYSA-N 0 0 382.424 3.267 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNCc1ccc(S(C)(=O)=O)c(Cl)c1 ZINC000277085166 1435260457 /nfs/dbraw/zinc/26/04/57/1435260457.db2.gz URJFXANCFRCRSK-UHFFFAOYSA-N 0 0 398.868 3.340 20 5 GGBDRN O=C(N[C@@H]1CCCN(C2CCCCC2)C1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000277120954 1435264269 /nfs/dbraw/zinc/26/42/69/1435264269.db2.gz ODDSBPDZLKQUHJ-OAHLLOKOSA-N 0 0 379.844 3.302 20 5 GGBDRN O=C(N[C@H]1CCCN(C2CCCCC2)C1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000277120949 1435264388 /nfs/dbraw/zinc/26/43/88/1435264388.db2.gz ODDSBPDZLKQUHJ-HNNXBMFYSA-N 0 0 379.844 3.302 20 5 GGBDRN CCOc1cc(CSCc2noc(CCCC(=O)OC)n2)ccc1[N+](=O)[O-] ZINC000277129930 1435265657 /nfs/dbraw/zinc/26/56/57/1435265657.db2.gz UHTJJAMBXQTFRW-UHFFFAOYSA-N 0 0 395.437 3.306 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2nnc([C@H](C)CC)[nH]2)cc1OC ZINC000277147689 1435268723 /nfs/dbraw/zinc/26/87/23/1435268723.db2.gz VZWQLVSJVGQGLR-GHMZBOCLSA-N 0 0 391.428 3.125 20 5 GGBDRN Cc1noc(C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000277171163 1435272726 /nfs/dbraw/zinc/27/27/26/1435272726.db2.gz KSEYTECQNAYHLJ-INIZCTEOSA-N 0 0 396.403 3.155 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@@H](C)Cc2c(C)noc2C)c(C)c([N+](=O)[O-])c1 ZINC000277184990 1435275596 /nfs/dbraw/zinc/27/55/96/1435275596.db2.gz KFZWFMMBZGTELH-VIFPVBQESA-N 0 0 390.396 3.047 20 5 GGBDRN Cc1nn(C)c(C(=O)NCC2(c3cccc(F)c3F)CCCC2)c1[N+](=O)[O-] ZINC000277235665 1435282875 /nfs/dbraw/zinc/28/28/75/1435282875.db2.gz XYWCUPZOXGLCCD-UHFFFAOYSA-N 0 0 378.379 3.157 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCc2sc(C)nc2C)c(C)c([N+](=O)[O-])c1 ZINC000277241202 1435283621 /nfs/dbraw/zinc/28/36/21/1435283621.db2.gz PAAXFVUNINSTOY-UHFFFAOYSA-N 0 0 378.410 3.085 20 5 GGBDRN CCc1nc(CCNC(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2C)cs1 ZINC000277258423 1435285827 /nfs/dbraw/zinc/28/58/27/1435285827.db2.gz QLLZCYBUHGIVBV-UHFFFAOYSA-N 0 0 392.437 3.073 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCc2ccc([C@@H](C)O)cc2)c(C)c([N+](=O)[O-])c1 ZINC000277263656 1435286470 /nfs/dbraw/zinc/28/64/70/1435286470.db2.gz QZGONRCJVWWXKQ-GFCCVEGCSA-N 0 0 387.392 3.065 20 5 GGBDRN COC(=O)c1cc(NC(=O)N2CCC[C@@H]2c2ccncc2)c(C)c([N+](=O)[O-])c1 ZINC000277265663 1435286964 /nfs/dbraw/zinc/28/69/64/1435286964.db2.gz RDULSZQEOYJZFZ-MRXNPFEDSA-N 0 0 384.392 3.454 20 5 GGBDRN COC(=O)c1cc(NC(=O)N2CCCC3(CCOCC3)C2)c(C)c([N+](=O)[O-])c1 ZINC000277279557 1435288570 /nfs/dbraw/zinc/28/85/70/1435288570.db2.gz SDVVRJNZHVBVBT-UHFFFAOYSA-N 0 0 391.424 3.114 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(C)c2F)c1 ZINC000277304107 1435291810 /nfs/dbraw/zinc/29/18/10/1435291810.db2.gz BCYUINHKFQDUFS-HHHXNRCGSA-N 0 0 394.424 3.190 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(C)C2CCC(OC)CC2)c(C)c([N+](=O)[O-])c1 ZINC000277314355 1435293154 /nfs/dbraw/zinc/29/31/54/1435293154.db2.gz VJFGJUXWHVOSIL-UHFFFAOYSA-N 0 0 379.413 3.111 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c1F ZINC000277325107 1435294077 /nfs/dbraw/zinc/29/40/77/1435294077.db2.gz GCIFNDWFLBORJP-GFCCVEGCSA-N 0 0 394.424 3.279 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(C)Cc2cccc(OC)c2)c(C)c([N+](=O)[O-])c1 ZINC000277343720 1435296136 /nfs/dbraw/zinc/29/61/36/1435296136.db2.gz XJIMDTSKAKNWIQ-UHFFFAOYSA-N 0 0 387.392 3.362 20 5 GGBDRN CCc1nn(C)c(N2CCC(O)(c3ccccc3C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000277355435 1435297895 /nfs/dbraw/zinc/29/78/95/1435297895.db2.gz GPRNEBHHWFXKQZ-UHFFFAOYSA-N 0 0 398.385 3.398 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC[S@](=O)C1 ZINC000277360756 1435298017 /nfs/dbraw/zinc/29/80/17/1435298017.db2.gz BURNYWDBYVHQEO-ASHKIFAZSA-N 0 0 388.445 3.228 20 5 GGBDRN COc1cccc(CSC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])c1 ZINC000277384472 1435300478 /nfs/dbraw/zinc/30/04/78/1435300478.db2.gz QZSQDUCAYSEYCD-KRWDZBQOSA-N 0 0 376.434 3.080 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC[S@]1=O ZINC000277420113 1435303587 /nfs/dbraw/zinc/30/35/87/1435303587.db2.gz DHKCQUFXRSLCCF-LOKFHWFJSA-N 0 0 387.461 3.322 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC[S@@]1=O ZINC000277420122 1435303632 /nfs/dbraw/zinc/30/36/32/1435303632.db2.gz DHKCQUFXRSLCCF-PWFNWSNSSA-N 0 0 387.461 3.322 20 5 GGBDRN COc1cccc(CSC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C(=O)[O-])c1 ZINC000277518835 1435309851 /nfs/dbraw/zinc/30/98/51/1435309851.db2.gz YOXVKKJYKCPLCF-QGZVFWFLSA-N 0 0 390.461 3.388 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1CN1CCSCC1 ZINC000277550174 1435312336 /nfs/dbraw/zinc/31/23/36/1435312336.db2.gz IVBGVUDOGQGFJR-UHFFFAOYSA-N 0 0 387.461 3.405 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCOCC(F)(F)C(F)F)cc1[N+](=O)[O-] ZINC000277600401 1435315474 /nfs/dbraw/zinc/31/54/74/1435315474.db2.gz VCSGXGKCALGWAJ-JTQLQIEISA-N 0 0 381.326 3.180 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1Cc2ccccc2C[C@@H]1c1nnc(C)o1 ZINC000277625003 1435317179 /nfs/dbraw/zinc/31/71/79/1435317179.db2.gz RHSTXRLJNNNZLJ-QGZVFWFLSA-N 0 0 394.387 3.235 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(C(C)(C)C)nn1-c1ncccn1 ZINC000277658563 1435319795 /nfs/dbraw/zinc/31/97/95/1435319795.db2.gz VYMQNBHQPXNQJL-UHFFFAOYSA-N 0 0 396.407 3.129 20 5 GGBDRN COc1ccc(CNC(=O)N2CCC(c3ncc(C)s3)CC2)cc1[N+](=O)[O-] ZINC000277708044 1435323463 /nfs/dbraw/zinc/32/34/63/1435323463.db2.gz RSWYTWPQIIUVKX-UHFFFAOYSA-N 0 0 390.465 3.458 20 5 GGBDRN CS(=O)(=O)[C@H]1CCCCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000277758012 1435327716 /nfs/dbraw/zinc/32/77/16/1435327716.db2.gz QBEOQQNIFHESPA-HNNXBMFYSA-N 0 0 398.484 3.133 20 5 GGBDRN COCCN(C(=O)c1cc([N+](=O)[O-])cc(C)c1F)c1ccc(OC)c(OC)c1 ZINC000277786496 1435330431 /nfs/dbraw/zinc/33/04/31/1435330431.db2.gz URPLGPUPHYNOKD-UHFFFAOYSA-N 0 0 392.383 3.353 20 5 GGBDRN CC[C@H](C)c1ccc(NC(=O)Cc2noc(-c3c([N+](=O)[O-])c(C)nn3C)n2)cc1 ZINC000277799383 1435331542 /nfs/dbraw/zinc/33/15/42/1435331542.db2.gz FTFMGNMFTFQIDF-NSHDSACASA-N 0 0 398.423 3.381 20 5 GGBDRN CCNC(=O)C1(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCC1 ZINC000277814927 1435332986 /nfs/dbraw/zinc/33/29/86/1435332986.db2.gz LINZSBFEKUGHTR-UHFFFAOYSA-N 0 0 377.444 3.130 20 5 GGBDRN CCCCCCNC(=O)Cc1noc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000277816434 1435333174 /nfs/dbraw/zinc/33/31/74/1435333174.db2.gz CWDMESCEDMEGEV-UHFFFAOYSA-N 0 0 385.424 3.289 20 5 GGBDRN CCCCCCNC(=O)Cc1noc(-c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1 ZINC000277826246 1435333964 /nfs/dbraw/zinc/33/39/64/1435333964.db2.gz DRGPOXYCLRETJX-UHFFFAOYSA-N 0 0 398.423 3.070 20 5 GGBDRN COc1ccc(C2(c3noc(Cn4cc([N+](=O)[O-])cn4)n3)CCCC2)cc1OC ZINC000277844032 1435335416 /nfs/dbraw/zinc/33/54/16/1435335416.db2.gz CWOLVZACRMONDM-UHFFFAOYSA-N 0 0 399.407 3.100 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(OC(F)(F)F)cc2)no1 ZINC000277861073 1435337108 /nfs/dbraw/zinc/33/71/08/1435337108.db2.gz JVIWUNPKSBOXOX-UHFFFAOYSA-N 0 0 383.286 3.291 20 5 GGBDRN COc1ccc(NC(=O)COc2ccc3c(c2)OC(=O)C[C@H]3C)c([N+](=O)[O-])c1 ZINC000277863456 1435337311 /nfs/dbraw/zinc/33/73/11/1435337311.db2.gz BBROXCZQHHGMEL-LLVKDONJSA-N 0 0 386.360 3.034 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccc2c(c1)OC(=O)C[C@@H]2C ZINC000277863601 1435337341 /nfs/dbraw/zinc/33/73/41/1435337341.db2.gz BDXAYTDFVKYYCF-NSHDSACASA-N 0 0 386.360 3.034 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CS(=O)(=O)CCCc3ccccc3)n2)s1 ZINC000277863903 1435337357 /nfs/dbraw/zinc/33/73/57/1435337357.db2.gz BHTDZLMDYSUAIJ-UHFFFAOYSA-N 0 0 393.446 3.254 20 5 GGBDRN CC[C@H](NC(=O)Cc1noc(-c2ccc(OC)c([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000277889899 1435339462 /nfs/dbraw/zinc/33/94/62/1435339462.db2.gz HDQVTWCDNBHDMG-HNNXBMFYSA-N 0 0 396.403 3.463 20 5 GGBDRN O=C(NCc1ccc2c(n1)CCCC2)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000277918857 1435342340 /nfs/dbraw/zinc/34/23/40/1435342340.db2.gz HHJIJRWYRMSJIL-UHFFFAOYSA-N 0 0 378.388 3.052 20 5 GGBDRN CN(C(=O)Cc1noc(C(F)(F)c2ccc([N+](=O)[O-])cc2)n1)C1CCCCC1 ZINC000277962793 1435346148 /nfs/dbraw/zinc/34/61/48/1435346148.db2.gz RXFVWNFHUXJEEQ-UHFFFAOYSA-N 0 0 394.378 3.452 20 5 GGBDRN Cc1cccc(C)c1NC(=O)Cc1noc(CCNc2ccccc2[N+](=O)[O-])n1 ZINC000277965839 1435346385 /nfs/dbraw/zinc/34/63/85/1435346385.db2.gz STKBHUXJLIHKQL-UHFFFAOYSA-N 0 0 395.419 3.430 20 5 GGBDRN Cc1cnc(COC(=O)c2ccc(OCC(F)(F)F)cn2)c(C)c1[N+](=O)[O-] ZINC000277979925 1435347645 /nfs/dbraw/zinc/34/76/45/1435347645.db2.gz ZONWMTASYJILTC-UHFFFAOYSA-N 0 0 385.298 3.300 20 5 GGBDRN CCCC(=O)N1CCC[C@@H](c2nc(Cc3cc(OC)ccc3[N+](=O)[O-])no2)C1 ZINC000277984969 1435348018 /nfs/dbraw/zinc/34/80/18/1435348018.db2.gz UVKIBXWWOFYSEW-CYBMUJFWSA-N 0 0 388.424 3.083 20 5 GGBDRN CC(C)[C@H](CNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccnc1 ZINC000277985847 1435348121 /nfs/dbraw/zinc/34/81/21/1435348121.db2.gz GHENFKXUAKRUPP-HNNXBMFYSA-N 0 0 382.424 3.105 20 5 GGBDRN CC[C@@H](NC(=O)Cc1noc(-c2ccc([N+](=O)[O-])c(OC)c2)n1)c1ccccc1 ZINC000277997120 1435348832 /nfs/dbraw/zinc/34/88/32/1435348832.db2.gz PLZBDVQYLGYPNM-OAHLLOKOSA-N 0 0 396.403 3.463 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1[N+](=O)[O-] ZINC000277996526 1435348842 /nfs/dbraw/zinc/34/88/42/1435348842.db2.gz NEZCQWYSOFCXKF-LBPRGKRZSA-N 0 0 394.712 3.463 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nc([C@H]3CN4CCCC[C@H]4CO3)no2)ccc1NC1CC1 ZINC000278000572 1435349175 /nfs/dbraw/zinc/34/91/75/1435349175.db2.gz INLAITCXIQMPTE-WMLDXEAASA-N 0 0 385.424 3.145 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(Cc3ccc(OC)c(OC)c3)n2)c1 ZINC000278005083 1435349595 /nfs/dbraw/zinc/34/95/95/1435349595.db2.gz WVMMLZDCCYWKLK-UHFFFAOYSA-N 0 0 385.376 3.185 20 5 GGBDRN Cc1nn(CCc2nc(-c3c(Cl)nc4sccn43)no2)c(C)c1[N+](=O)[O-] ZINC000278009909 1435350026 /nfs/dbraw/zinc/35/00/26/1435350026.db2.gz XGJGVLCHNRRSBY-UHFFFAOYSA-N 0 0 393.816 3.063 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(Cn2c3ccccc3nc2C(C)C)no1 ZINC000278017377 1435350339 /nfs/dbraw/zinc/35/03/39/1435350339.db2.gz YCAWHMIELWCDKL-UHFFFAOYSA-N 0 0 381.396 3.052 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])CCN1C(=O)OC(C)(C)C ZINC000278020215 1435350813 /nfs/dbraw/zinc/35/08/13/1435350813.db2.gz PXXYUJALFRGERB-DZGCQCFKSA-N 0 0 392.456 3.182 20 5 GGBDRN C[C@@H]1C[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])CCN1C(=O)OC(C)(C)C ZINC000278020224 1435350880 /nfs/dbraw/zinc/35/08/80/1435350880.db2.gz PXXYUJALFRGERB-UKRRQHHQSA-N 0 0 392.456 3.182 20 5 GGBDRN O=C(Cc1noc(/C=C/c2ccccc2[N+](=O)[O-])n1)N(CC(F)(F)F)C1CC1 ZINC000278022545 1435351027 /nfs/dbraw/zinc/35/10/27/1435351027.db2.gz 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C[C@H](NC(=O)N1CCC(Oc2ncccc2F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000278046388 1435353326 /nfs/dbraw/zinc/35/33/26/1435353326.db2.gz SOXQCCHCRFSWNX-ZDUSSCGKSA-N 0 0 388.399 3.443 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC(Oc2ncccc2F)CC1 ZINC000278047640 1435353588 /nfs/dbraw/zinc/35/35/88/1435353588.db2.gz IYFNNMDABMKASR-UHFFFAOYSA-N 0 0 388.399 3.001 20 5 GGBDRN CC[C@@H](NC(=O)Cc1noc(-c2n[nH]c(C(C)C)c2[N+](=O)[O-])n1)c1ccccc1 ZINC000278050345 1435353861 /nfs/dbraw/zinc/35/38/61/1435353861.db2.gz UVMSCLYBXJVBLR-CYBMUJFWSA-N 0 0 398.423 3.301 20 5 GGBDRN O=[N+]([O-])c1ccc(C(F)(F)c2nc([C@H]3CN4CCCC[C@@H]4CO3)no2)cc1 ZINC000278053714 1435354261 /nfs/dbraw/zinc/35/42/61/1435354261.db2.gz MBLSNHVVZULXKV-ZIAGYGMSSA-N 0 0 380.351 3.044 20 5 GGBDRN Cc1cnccc1OC1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1 ZINC000278070536 1435356029 /nfs/dbraw/zinc/35/60/29/1435356029.db2.gz LHAOLNPBLHMTFJ-UHFFFAOYSA-N 0 0 384.436 3.170 20 5 GGBDRN CC[C@@H](NC(=O)Cc1noc(COc2cccc([N+](=O)[O-])c2)n1)c1ccccc1 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389.355 3.049 20 5 GGBDRN COc1ccc2c(c1)[C@@H](C(=O)Nc1cc3c(cc1[N+](=O)[O-])OCCCO3)CC2 ZINC000278144537 1435364017 /nfs/dbraw/zinc/36/40/17/1435364017.db2.gz NJGYOHGUMJTHDS-AWEZNQCLSA-N 0 0 384.388 3.433 20 5 GGBDRN CCN(C(=O)Cc1noc(CN(C)c2ccccc2[N+](=O)[O-])n1)c1ccccc1 ZINC000278144192 1435364092 /nfs/dbraw/zinc/36/40/92/1435364092.db2.gz ILXGPOVGIYCWNR-UHFFFAOYSA-N 0 0 395.419 3.210 20 5 GGBDRN O=[N+]([O-])c1ccc2c(ccn2Cc2nc(COCC(F)(F)C(F)F)no2)c1 ZINC000278164488 1435365549 /nfs/dbraw/zinc/36/55/49/1435365549.db2.gz KJIZBYMAZWLCFS-UHFFFAOYSA-N 0 0 388.277 3.398 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)CCN1C(=O)OC(C)(C)C ZINC000278172573 1435366121 /nfs/dbraw/zinc/36/61/21/1435366121.db2.gz AYJAAGVMYHNUPG-GOEBONIOSA-N 0 0 391.468 3.432 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc([C@@H](c3ccccc3F)N3CCOCC3)n2)cc1 ZINC000278172715 1435366417 /nfs/dbraw/zinc/36/64/17/1435366417.db2.gz FDBHKYJFRRDXRH-QGZVFWFLSA-N 0 0 384.367 3.206 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H]1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278179538 1435366956 /nfs/dbraw/zinc/36/69/56/1435366956.db2.gz DBGGANWPLDDYTJ-VIFPVBQESA-N 0 0 376.335 3.112 20 5 GGBDRN O=C(Nc1ccccc1O)C1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000278189018 1435367743 /nfs/dbraw/zinc/36/77/43/1435367743.db2.gz DLBJLPAWUQONCX-UHFFFAOYSA-N 0 0 382.420 3.124 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2nc([C@H]3CN4CCCC[C@H]4CO3)no2)c(Cl)c1 ZINC000278196138 1435368525 /nfs/dbraw/zinc/36/85/25/1435368525.db2.gz WCMYZZWFWBDVJY-DZGCQCFKSA-N 0 0 378.816 3.148 20 5 GGBDRN CC[C@H](C)c1ccc(NC(=O)Cc2noc(Cn3cc([N+](=O)[O-])nc3C)n2)cc1 ZINC000278203838 1435369213 /nfs/dbraw/zinc/36/92/13/1435369213.db2.gz YQHKBKYIKSXSFE-LBPRGKRZSA-N 0 0 398.423 3.226 20 5 GGBDRN COCCC1(c2nc(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])no2)CCC1 ZINC000278210156 1435369596 /nfs/dbraw/zinc/36/95/96/1435369596.db2.gz XACODDSGPHIZOM-UHFFFAOYSA-N 0 0 377.397 3.044 20 5 GGBDRN O=C(NC1CCCCC1)C1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000278212275 1435369796 /nfs/dbraw/zinc/36/97/96/1435369796.db2.gz KHUDSCLZJKHINO-UHFFFAOYSA-N 0 0 390.440 3.164 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)C1CCN(C(=O)c2ccccc2)CC1 ZINC000278238705 1435372541 /nfs/dbraw/zinc/37/25/41/1435372541.db2.gz VTKZFBYGPBQXIV-UHFFFAOYSA-N 0 0 381.432 3.280 20 5 GGBDRN COc1cc(Cc2nc(-c3ccc([N+](=O)[O-])s3)no2)cc(OC)c1OC ZINC000278244529 1435373015 /nfs/dbraw/zinc/37/30/15/1435373015.db2.gz SRCJOTZUBQTIFW-UHFFFAOYSA-N 0 0 377.378 3.323 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1 ZINC000278274845 1435375720 /nfs/dbraw/zinc/37/57/20/1435375720.db2.gz SFDRZMRPGUHRBZ-LBPRGKRZSA-N 0 0 393.400 3.252 20 5 GGBDRN O=C(NC1(c2cccc(C(F)(F)F)c2)CCOCC1)c1ccc([N+](=O)[O-])[nH]1 ZINC000278283246 1435376285 /nfs/dbraw/zinc/37/62/85/1435376285.db2.gz IYMPCNFWTUWDAX-UHFFFAOYSA-N 0 0 383.326 3.377 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278288293 1435376611 /nfs/dbraw/zinc/37/66/11/1435376611.db2.gz GAXLKAYIRRVZJS-JTQLQIEISA-N 0 0 390.362 3.360 20 5 GGBDRN Cc1nn(C)c(C)c1CCC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278308980 1435378298 /nfs/dbraw/zinc/37/82/98/1435378298.db2.gz DIWAIORSMRKGTO-UHFFFAOYSA-N 0 0 384.358 3.213 20 5 GGBDRN COc1cc(C(=O)Nc2ncc3c(n2)CCC(C)(C)C3)cc([N+](=O)[O-])c1OC ZINC000278309326 1435378356 /nfs/dbraw/zinc/37/83/56/1435378356.db2.gz BAAUQMQZZAPFHP-UHFFFAOYSA-N 0 0 386.408 3.169 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC(Oc2ncccc2F)CC1 ZINC000278309450 1435378367 /nfs/dbraw/zinc/37/83/67/1435378367.db2.gz JVGXYQSREKENCP-UHFFFAOYSA-N 0 0 379.775 3.466 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCC(Oc3ncccc3F)CC2)c([N+](=O)[O-])c1 ZINC000278310212 1435378452 /nfs/dbraw/zinc/37/84/52/1435378452.db2.gz SLEJYRJLIYCNFR-UHFFFAOYSA-N 0 0 376.344 3.081 20 5 GGBDRN COc1ccc(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000278318989 1435379472 /nfs/dbraw/zinc/37/94/72/1435379472.db2.gz KILSWLBGCYBEJE-OCCSQVGLSA-N 0 0 393.440 3.121 20 5 GGBDRN CCC(=O)N1CC[C@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278374206 1435385014 /nfs/dbraw/zinc/38/50/14/1435385014.db2.gz DRBHKWYUKQSHHL-QMMMGPOBSA-N 0 0 382.289 3.067 20 5 GGBDRN C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000278374297 1435385078 /nfs/dbraw/zinc/38/50/78/1435385078.db2.gz AFZQJGNQOXASAT-UWVGGRQHSA-N 0 0 391.371 3.161 20 5 GGBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1cnn(Cc2nnc3n2CCCC3)c1 ZINC000278376411 1435385207 /nfs/dbraw/zinc/38/52/07/1435385207.db2.gz DVDJRWRPYGIDHL-OAHLLOKOSA-N 0 0 395.467 3.201 20 5 GGBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1cnn(Cc2nnc3n2CCCC3)c1 ZINC000278376408 1435385236 /nfs/dbraw/zinc/38/52/36/1435385236.db2.gz DVDJRWRPYGIDHL-HNNXBMFYSA-N 0 0 395.467 3.201 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000278387170 1435386278 /nfs/dbraw/zinc/38/62/78/1435386278.db2.gz LZCYOUUTZUPCFD-UHFFFAOYSA-N 0 0 389.355 3.414 20 5 GGBDRN CS[C@@H](CO)[C@@H](C)NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000278390027 1435386640 /nfs/dbraw/zinc/38/66/40/1435386640.db2.gz AFLDEBDAKGIBSZ-ACJLOTCBSA-N 0 0 390.461 3.016 20 5 GGBDRN CS[C@@H](CO)[C@H](C)NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000278390035 1435386729 /nfs/dbraw/zinc/38/67/29/1435386729.db2.gz AFLDEBDAKGIBSZ-UGSOOPFHSA-N 0 0 390.461 3.016 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1 ZINC000278392896 1435386790 /nfs/dbraw/zinc/38/67/90/1435386790.db2.gz QBYXMFPURQYMQU-QWHCGFSZSA-N 0 0 393.440 3.121 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000278394835 1435387097 /nfs/dbraw/zinc/38/70/97/1435387097.db2.gz QDBDKDSKCCFGBL-GXTWGEPZSA-N 0 0 393.440 3.121 20 5 GGBDRN CC[C@@H](Nc1cnn(Cc2nnc3n2CCCC3)c1)c1cccc([N+](=O)[O-])c1 ZINC000278395093 1435387124 /nfs/dbraw/zinc/38/71/24/1435387124.db2.gz GFMUVSKAVKIUHJ-QGZVFWFLSA-N 0 0 381.440 3.331 20 5 GGBDRN 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ZINC000278442304 1435391225 /nfs/dbraw/zinc/39/12/25/1435391225.db2.gz WJKHNCZIPLEVBH-HIFRSBDPSA-N 0 0 377.441 3.042 20 5 GGBDRN C[C@@H]1C[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])CCN1C(=O)OC(C)(C)C ZINC000278442309 1435391231 /nfs/dbraw/zinc/39/12/31/1435391231.db2.gz WJKHNCZIPLEVBH-UKRRQHHQSA-N 0 0 377.441 3.042 20 5 GGBDRN COCCN1C(=O)CCc2cc(NC(=O)c3c(C)cccc3[N+](=O)[O-])ccc21 ZINC000278452965 1435392204 /nfs/dbraw/zinc/39/22/04/1435392204.db2.gz GLCFRSGCMNTPFX-UHFFFAOYSA-N 0 0 383.404 3.081 20 5 GGBDRN Cc1nc(C(C)(C)NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)no1 ZINC000278455817 1435392286 /nfs/dbraw/zinc/39/22/86/1435392286.db2.gz OCINRRVUQIEZEC-UHFFFAOYSA-N 0 0 387.318 3.040 20 5 GGBDRN Cc1ccc([C@H](C)Nc2cnn(Cc3nnc4n3CCCC4)c2)cc1[N+](=O)[O-] ZINC000278462010 1435392782 /nfs/dbraw/zinc/39/27/82/1435392782.db2.gz MSFGAMFOUVVECD-AWEZNQCLSA-N 0 0 381.440 3.249 20 5 GGBDRN O=C(NCCCNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-])C1CCC1 ZINC000278463502 1435392787 /nfs/dbraw/zinc/39/27/87/1435392787.db2.gz 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C[C@@H]1CN(c2ccccc2NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@@H](C)O1 ZINC000279233696 1435474859 /nfs/dbraw/zinc/47/48/59/1435474859.db2.gz PICQAJUDDJHBGY-VXGBXAGGSA-N 0 0 388.399 3.182 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279237413 1435475403 /nfs/dbraw/zinc/47/54/03/1435475403.db2.gz RCCCZLCGAJAYTF-KZULUSFZSA-N 0 0 375.400 3.042 20 5 GGBDRN Cc1c(OC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000279247736 1435476839 /nfs/dbraw/zinc/47/68/39/1435476839.db2.gz HTDBTSITYKVKMD-HNNXBMFYSA-N 0 0 377.418 3.027 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)c1ccc(NC(=O)C2CC2)cc1 ZINC000279265210 1435479280 /nfs/dbraw/zinc/47/92/80/1435479280.db2.gz ULSABYMPXIVZTG-JTQLQIEISA-N 0 0 386.383 3.156 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC1 ZINC000279268784 1435479734 /nfs/dbraw/zinc/47/97/34/1435479734.db2.gz RNVKIKFTHJHMJK-UHFFFAOYSA-N 0 0 397.479 3.431 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000279271053 1435479938 /nfs/dbraw/zinc/47/99/38/1435479938.db2.gz JMGHPPBVVIZQOY-CQSZACIVSA-N 0 0 387.440 3.053 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@H]2CCCOC2)nn1C ZINC000279275010 1435480480 /nfs/dbraw/zinc/48/04/80/1435480480.db2.gz JTEIRBPNDOQDBR-OLZOCXBDSA-N 0 0 390.465 3.342 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)s1 ZINC000279277672 1435480890 /nfs/dbraw/zinc/48/08/90/1435480890.db2.gz AFVASHRHZBPQNL-UHFFFAOYSA-N 0 0 397.478 3.388 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])o1 ZINC000279297672 1435483190 /nfs/dbraw/zinc/48/31/90/1435483190.db2.gz MZNBFKKRTPXFLI-HNNXBMFYSA-N 0 0 382.775 3.431 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c(OC[C@H]2CCCO2)c1 ZINC000279297032 1435483231 /nfs/dbraw/zinc/48/32/31/1435483231.db2.gz YVGHZQYYEYXWCJ-GFCCVEGCSA-N 0 0 389.383 3.435 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC(c2ncc3n2CCCC3)CC1 ZINC000279305780 1435484316 /nfs/dbraw/zinc/48/43/16/1435484316.db2.gz WPRWVXDNCYXRFQ-UHFFFAOYSA-N 0 0 383.452 3.217 20 5 GGBDRN O=C(O[C@@H]([C@@H]1CCCOC1)C(F)(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000279307391 1435484359 /nfs/dbraw/zinc/48/43/59/1435484359.db2.gz YOAFCTTWDULWEO-ABAIWWIYSA-N 0 0 399.325 3.295 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCOCC2)c(F)c1 ZINC000279313507 1435485517 /nfs/dbraw/zinc/48/55/17/1435485517.db2.gz NJSBPTGQGZLCDC-UHFFFAOYSA-N 0 0 389.383 3.222 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1)CC1CCOCC1 ZINC000279318971 1435485831 /nfs/dbraw/zinc/48/58/31/1435485831.db2.gz BPYZDEWYVWBZDL-UHFFFAOYSA-N 0 0 387.411 3.385 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279322583 1435486395 /nfs/dbraw/zinc/48/63/95/1435486395.db2.gz NACAVEWSXLOUIF-JTQLQIEISA-N 0 0 398.341 3.493 20 5 GGBDRN Cc1c(NC(=O)CCNc2ccccc2[N+](=O)[O-])cccc1NC(=O)N(C)C ZINC000279343713 1435488921 /nfs/dbraw/zinc/48/89/21/1435488921.db2.gz CQCFBSNHOKUTKV-UHFFFAOYSA-N 0 0 385.424 3.437 20 5 GGBDRN C[C@H]1OCC[C@@]12CN(C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)CCO2 ZINC000279354473 1435490220 /nfs/dbraw/zinc/49/02/20/1435490220.db2.gz GKGQDMZHHIKDJY-QVKFZJNVSA-N 0 0 398.415 3.407 20 5 GGBDRN C[C@@H]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000279360069 1435491116 /nfs/dbraw/zinc/49/11/16/1435491116.db2.gz SPPOLRTYYVVPCD-BZNIZROVSA-N 0 0 380.807 3.236 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccnc(N2CCCCC2)c1 ZINC000279368617 1435491727 /nfs/dbraw/zinc/49/17/27/1435491727.db2.gz RQPUFSYFWYQQSG-UHFFFAOYSA-N 0 0 384.436 3.309 20 5 GGBDRN CCCCCC(=O)NC1CCN(C(=O)c2c(OCC)cccc2[N+](=O)[O-])CC1 ZINC000279372165 1435492344 /nfs/dbraw/zinc/49/23/44/1435492344.db2.gz RYWZEOWJGZLMIP-UHFFFAOYSA-N 0 0 391.468 3.295 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCC(C)(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000279381138 1435493215 /nfs/dbraw/zinc/49/32/15/1435493215.db2.gz KGRYXTCFUCPZSY-UHFFFAOYSA-N 0 0 376.844 3.484 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000279391796 1435494290 /nfs/dbraw/zinc/49/42/90/1435494290.db2.gz IXJKFNCKLWVMLA-BLLLJJGKSA-N 0 0 377.416 3.460 20 5 GGBDRN COCCOc1ccc(F)cc1NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279395294 1435494658 /nfs/dbraw/zinc/49/46/58/1435494658.db2.gz JDCJQBZGXDGROI-UHFFFAOYSA-N 0 0 395.362 3.217 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000279396872 1435494797 /nfs/dbraw/zinc/49/47/97/1435494797.db2.gz VUYFIAGMYZIXNW-QGZVFWFLSA-N 0 0 385.424 3.032 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(CN2CCOC2=O)cc1 ZINC000279418630 1435497111 /nfs/dbraw/zinc/49/71/11/1435497111.db2.gz WQNICNYQQXPCAQ-UHFFFAOYSA-N 0 0 385.376 3.198 20 5 GGBDRN C[C@@H]1OCC[C@@]12CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C[C@@H](C)O2 ZINC000279424492 1435497771 /nfs/dbraw/zinc/49/77/71/1435497771.db2.gz UAKVIQXPOWKJFJ-OHUAYANFSA-N 0 0 388.342 3.022 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N2CCC[C@H]2[C@H]2CCCCC2=O)cc1[N+](=O)[O-] ZINC000279446300 1435500349 /nfs/dbraw/zinc/50/03/49/1435500349.db2.gz NPHUCTGDQIYZOF-DOMZBBRYSA-N 0 0 377.416 3.164 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)CCc1ccccc1NC(=O)OC(C)(C)C ZINC000279463789 1435502365 /nfs/dbraw/zinc/50/23/65/1435502365.db2.gz DKVUKEBIQDQRJN-UHFFFAOYSA-N 0 0 389.412 3.247 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1 ZINC000279468975 1435502617 /nfs/dbraw/zinc/50/26/17/1435502617.db2.gz LPYZQLSHVOZAHZ-UHFFFAOYSA-N 0 0 397.479 3.431 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000279471873 1435503115 /nfs/dbraw/zinc/50/31/15/1435503115.db2.gz PWSIAKLCCGPPPF-LBPRGKRZSA-N 0 0 389.358 3.190 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CCCc2[nH]c(=O)ccc21 ZINC000279477799 1435503468 /nfs/dbraw/zinc/50/34/68/1435503468.db2.gz GRZDUKVFEXXTRQ-AWEZNQCLSA-N 0 0 379.775 3.224 20 5 GGBDRN C[C@@H](CC(=O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279493366 1435505631 /nfs/dbraw/zinc/50/56/31/1435505631.db2.gz PMIUVXWVFSLQPO-JTQLQIEISA-N 0 0 379.413 3.253 20 5 GGBDRN Cc1cccc(CC2(O)CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000279544289 1435511521 /nfs/dbraw/zinc/51/15/21/1435511521.db2.gz AQBGVEIZHABPAC-UHFFFAOYSA-N 0 0 397.475 3.225 20 5 GGBDRN Cc1ccnc(-c2n[nH]c([C@@H](C)NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000279544673 1435511574 /nfs/dbraw/zinc/51/15/74/1435511574.db2.gz QJPGLEUTBNYWKF-CHWSQXEVSA-N 0 0 395.423 3.205 20 5 GGBDRN Cc1ccnc(-c2n[nH]c([C@H](C)NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000279544681 1435511830 /nfs/dbraw/zinc/51/18/30/1435511830.db2.gz QJPGLEUTBNYWKF-STQMWFEESA-N 0 0 395.423 3.205 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000279632318 1435521255 /nfs/dbraw/zinc/52/12/55/1435521255.db2.gz ZHUNHGACMSRFRF-UHFFFAOYSA-N 0 0 399.407 3.056 20 5 GGBDRN COc1cc(C(=O)NCC(C)(C)CCCC(OC)OC)cc([N+](=O)[O-])c1OC ZINC000279633793 1435521325 /nfs/dbraw/zinc/52/13/25/1435521325.db2.gz BYDQWLILDCBEPK-UHFFFAOYSA-N 0 0 398.456 3.157 20 5 GGBDRN COc1ccc(CNC(=O)C(=O)Nc2ccc(C3CCC3)cc2)cc1[N+](=O)[O-] ZINC000279640273 1435522506 /nfs/dbraw/zinc/52/25/06/1435522506.db2.gz AKUPPROBBGLQJV-UHFFFAOYSA-N 0 0 383.404 3.126 20 5 GGBDRN C[C@H]1OCC[C@@]12CN(Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)CCO2 ZINC000279641485 1435522576 /nfs/dbraw/zinc/52/25/76/1435522576.db2.gz JGPBENVGZNAEHN-FZKQIMNGSA-N 0 0 375.450 3.098 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)sc1C ZINC000279675120 1435527950 /nfs/dbraw/zinc/52/79/50/1435527950.db2.gz MEUZIQASLYBUFM-CQSZACIVSA-N 0 0 389.433 3.432 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 ZINC000279691184 1435530302 /nfs/dbraw/zinc/53/03/02/1435530302.db2.gz HXELXGMXHRDVOJ-QGZVFWFLSA-N 0 0 399.403 3.363 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC2(CCOCC2)O1 ZINC000279728878 1435535985 /nfs/dbraw/zinc/53/59/85/1435535985.db2.gz JCGMKDBETNFIKE-CQSZACIVSA-N 0 0 376.453 3.302 20 5 GGBDRN Cn1nc(C(F)F)c2cc(C(=O)NCCNc3ccccc3[N+](=O)[O-])sc21 ZINC000279733375 1435536270 /nfs/dbraw/zinc/53/62/70/1435536270.db2.gz NZMJWZMKVAQLPK-UHFFFAOYSA-N 0 0 395.391 3.323 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN(CCC(F)(F)F)CC(F)(F)F ZINC000279737805 1435536674 /nfs/dbraw/zinc/53/66/74/1435536674.db2.gz KGTHNCSJLFAELF-SNVBAGLBSA-N 0 0 390.280 3.151 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(CCO)CC(F)F)cc1 ZINC000279781335 1435542142 /nfs/dbraw/zinc/54/21/42/1435542142.db2.gz ISOUNQROAYJIEN-UHFFFAOYSA-N 0 0 396.346 3.095 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@H](CO)CC2CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000279790282 1435543611 /nfs/dbraw/zinc/54/36/11/1435543611.db2.gz DGGXEFDYGLVCKC-YOEHRIQHSA-N 0 0 398.463 3.444 20 5 GGBDRN Cc1c(C(=O)O[C@H]([C@H]2CCCOC2)C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000279804051 1435545247 /nfs/dbraw/zinc/54/52/47/1435545247.db2.gz YHDDZHVJUTUTAD-TVQRCGJNSA-N 0 0 392.286 3.326 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)c3ccccc3COC)CC2)ccc1[N+](=O)[O-] ZINC000279806319 1435545557 /nfs/dbraw/zinc/54/55/57/1435545557.db2.gz NEGBXLXLHHRWDR-UHFFFAOYSA-N 0 0 399.447 3.102 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cc([C@H]2CCCOC2)[nH]n1 ZINC000279828215 1435548030 /nfs/dbraw/zinc/54/80/30/1435548030.db2.gz DXAKHBIGFMBUBL-NSHDSACASA-N 0 0 394.815 3.273 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000279833593 1435548481 /nfs/dbraw/zinc/54/84/81/1435548481.db2.gz ZEAWLVUVJSADMF-UHFFFAOYSA-N 0 0 383.404 3.482 20 5 GGBDRN CCc1cc2nncn2c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000279837921 1435549212 /nfs/dbraw/zinc/54/92/12/1435549212.db2.gz CRDQPZWVFKSECD-NSHDSACASA-N 0 0 386.437 3.023 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@@H]2CCCOC2)[nH]n1 ZINC000279839912 1435549768 /nfs/dbraw/zinc/54/97/68/1435549768.db2.gz FLPPDNNILXCCOT-VXGBXAGGSA-N 0 0 376.438 3.331 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1NC(=O)N(C)C ZINC000279851279 1435551623 /nfs/dbraw/zinc/55/16/23/1435551623.db2.gz FATVDKHAGOUFEI-UHFFFAOYSA-N 0 0 385.424 3.072 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)c3cccc(Cl)n3)CC2)ccc1[N+](=O)[O-] ZINC000279863489 1435554100 /nfs/dbraw/zinc/55/41/00/1435554100.db2.gz VHDFFMIGMWQGDP-UHFFFAOYSA-N 0 0 390.827 3.004 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CN(CCC(F)(F)F)CC(F)(F)F)c1 ZINC000279863959 1435554732 /nfs/dbraw/zinc/55/47/32/1435554732.db2.gz SURPBGKBENJHAS-NSHDSACASA-N 0 0 390.280 3.151 20 5 GGBDRN Cc1nc2ccccc2n1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000279874558 1435556035 /nfs/dbraw/zinc/55/60/35/1435556035.db2.gz WOWYUOHILRXVCJ-UHFFFAOYSA-N 0 0 397.410 3.452 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)CCCCSC)CC2)ccc1[N+](=O)[O-] ZINC000279901034 1435560104 /nfs/dbraw/zinc/56/01/04/1435560104.db2.gz ZPNGRESJYJTAPJ-UHFFFAOYSA-N 0 0 381.498 3.175 20 5 GGBDRN COC(CCCC(C)(C)CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)OC ZINC000279900336 1435560261 /nfs/dbraw/zinc/56/02/61/1435560261.db2.gz ZOKOCXMVDDGESF-UHFFFAOYSA-N 0 0 397.428 3.357 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N(CC1CC1)CC1CCC1 ZINC000279915476 1435562477 /nfs/dbraw/zinc/56/24/77/1435562477.db2.gz DJRNZNLQILHVPU-UHFFFAOYSA-N 0 0 379.844 3.017 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCCCC[C@@H]1c1ncon1 ZINC000279919472 1435563353 /nfs/dbraw/zinc/56/33/53/1435563353.db2.gz VWPVHSGTHXGZIK-CYBMUJFWSA-N 0 0 382.779 3.457 20 5 GGBDRN C[C@H](O)C[C@@H]1CCCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000279926705 1435564280 /nfs/dbraw/zinc/56/42/80/1435564280.db2.gz WJKIYFUERHIHIF-IRXDYDNUSA-N 0 0 378.472 3.307 20 5 GGBDRN O=C(CN(CCC(F)(F)F)CC(F)(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000279948218 1435567947 /nfs/dbraw/zinc/56/79/47/1435567947.db2.gz XPBPKCYIPZAQQG-UHFFFAOYSA-N 0 0 399.291 3.301 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC(=O)C1(c2ccccc2)CC1 ZINC000279978866 1435571628 /nfs/dbraw/zinc/57/16/28/1435571628.db2.gz PUSVCXQRDQLRIH-UHFFFAOYSA-N 0 0 395.440 3.235 20 5 GGBDRN CC[C@H](c1ccccc1)N1CC(=O)N(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1=O ZINC000280060402 1435584921 /nfs/dbraw/zinc/58/49/21/1435584921.db2.gz KHIVCTDGEHFOIJ-QGZVFWFLSA-N 0 0 393.403 3.387 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CCNC(=O)c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000280070278 1435586826 /nfs/dbraw/zinc/58/68/26/1435586826.db2.gz RLWZJHQMPVLZMT-UHFFFAOYSA-N 0 0 393.415 3.421 20 5 GGBDRN CCC(=O)c1ccc(NCc2ccc(N3CCO[C@H](C)C3)nc2)c([N+](=O)[O-])c1 ZINC000280155334 1435600544 /nfs/dbraw/zinc/60/05/44/1435600544.db2.gz BKTGMCLMRJBPEH-CQSZACIVSA-N 0 0 384.436 3.420 20 5 GGBDRN COc1cc(CNc2ccc(OC(C)C)c(C(N)=O)c2)c([N+](=O)[O-])cc1OC ZINC000280166492 1435602787 /nfs/dbraw/zinc/60/27/87/1435602787.db2.gz FQUZOIKLPIMIPJ-UHFFFAOYSA-N 0 0 389.408 3.110 20 5 GGBDRN C[C@]1(O)CCCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000280185289 1435605093 /nfs/dbraw/zinc/60/50/93/1435605093.db2.gz DCBYGMGAEKECQX-HNNXBMFYSA-N 0 0 375.347 3.060 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1 ZINC000280222217 1435612060 /nfs/dbraw/zinc/61/20/60/1435612060.db2.gz AOXDPHUOPXTYTO-CQSZACIVSA-N 0 0 385.420 3.471 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc([C@H]3CCCOC3)[nH]n2)cc1SC ZINC000280235384 1435615562 /nfs/dbraw/zinc/61/55/62/1435615562.db2.gz XTWRIUIKQUSCMR-JTQLQIEISA-N 0 0 392.437 3.195 20 5 GGBDRN COC(=O)c1cnc(N2CCC(n3c(C)nc4ccccc43)CC2)c([N+](=O)[O-])c1 ZINC000280238295 1435615812 /nfs/dbraw/zinc/61/58/12/1435615812.db2.gz MGNFYOSTDJVWIU-UHFFFAOYSA-N 0 0 395.419 3.276 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2Cc2cc([N+](=O)[O-])ccc2OC)sc1C ZINC000280260704 1435620474 /nfs/dbraw/zinc/62/04/74/1435620474.db2.gz CKVPWTBHVWXLFK-AWEZNQCLSA-N 0 0 391.449 3.492 20 5 GGBDRN Cc1cccc(CC2(O)CCN(C(=O)CCOc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000280280462 1435624544 /nfs/dbraw/zinc/62/45/44/1435624544.db2.gz QIYGYTPSCNBENI-UHFFFAOYSA-N 0 0 398.459 3.268 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(C2CC2)c(C(=O)OC)s1 ZINC000280283798 1435625431 /nfs/dbraw/zinc/62/54/31/1435625431.db2.gz ZCXBICBFUSIDFX-UHFFFAOYSA-N 0 0 391.405 3.366 20 5 GGBDRN Cc1cccc(CCNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000280286921 1435626774 /nfs/dbraw/zinc/62/67/74/1435626774.db2.gz GJVJZRMIBVHKSW-UHFFFAOYSA-N 0 0 382.342 3.359 20 5 GGBDRN CCOC(=O)C[C@H](Sc1ccc([N+](=O)[O-])c2cnccc12)C(=O)OCC ZINC000280301177 1435629665 /nfs/dbraw/zinc/62/96/65/1435629665.db2.gz RLQULHLJLBHXPW-HNNXBMFYSA-N 0 0 378.406 3.120 20 5 GGBDRN COCCOc1ccc(F)cc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000280309418 1435631725 /nfs/dbraw/zinc/63/17/25/1435631725.db2.gz BADMUPAVFRJDDW-UHFFFAOYSA-N 0 0 378.356 3.085 20 5 GGBDRN Cc1nc2ccccc2n1C1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000280332504 1435637478 /nfs/dbraw/zinc/63/74/78/1435637478.db2.gz UYCFMXVPMIBUFG-UHFFFAOYSA-N 0 0 379.420 3.193 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000280400036 1435653286 /nfs/dbraw/zinc/65/32/86/1435653286.db2.gz AJJIZZVWSYSKAS-HNNXBMFYSA-N 0 0 378.454 3.036 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000280400038 1435653535 /nfs/dbraw/zinc/65/35/35/1435653535.db2.gz AJJIZZVWSYSKAS-OAHLLOKOSA-N 0 0 378.454 3.036 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)Cc1ccc([S@@](C)=O)cc1 ZINC000280404279 1435654395 /nfs/dbraw/zinc/65/43/95/1435654395.db2.gz LCCVZYBLQLUMSX-AREMUKBSSA-N 0 0 376.434 3.003 20 5 GGBDRN CCOc1cc(NC(=O)[C@@H](NC(C)=O)C2CCCC2)c([N+](=O)[O-])cc1OCC ZINC000280415712 1435656743 /nfs/dbraw/zinc/65/67/43/1435656743.db2.gz HRFXPDDMSGEUCQ-SFHVURJKSA-N 0 0 393.440 3.026 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])sc1C ZINC000280422546 1435658240 /nfs/dbraw/zinc/65/82/40/1435658240.db2.gz LZRUATUCJXYYHG-AWEZNQCLSA-N 0 0 391.449 3.362 20 5 GGBDRN CCC[C@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](O)c1ccccc1 ZINC000280428443 1435659148 /nfs/dbraw/zinc/65/91/48/1435659148.db2.gz PXARSQJZPIOCQC-LPHOPBHVSA-N 0 0 397.435 3.173 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C[C@@H](O)c2cccc([N+](=O)[O-])c2)sc1C ZINC000280430745 1435659812 /nfs/dbraw/zinc/65/98/12/1435659812.db2.gz MLYHYAKIVRKBQN-LSDHHAIUSA-N 0 0 391.449 3.017 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C[C@H](O)c2cccc([N+](=O)[O-])c2)sc1C ZINC000280430739 1435659981 /nfs/dbraw/zinc/65/99/81/1435659981.db2.gz MLYHYAKIVRKBQN-GJZGRUSLSA-N 0 0 391.449 3.017 20 5 GGBDRN CN(C)C(=O)Nc1ccc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000280482890 1435668043 /nfs/dbraw/zinc/66/80/43/1435668043.db2.gz JKMAAUZPOJIIQK-UHFFFAOYSA-N 0 0 385.424 3.030 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(CN2CCOCC2)cc1 ZINC000280488849 1435668514 /nfs/dbraw/zinc/66/85/14/1435668514.db2.gz QECUGQLWLIXMMD-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN C[C@H]1OCC[C@]12CN(Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)C[C@@H](C)O2 ZINC000280519449 1435672582 /nfs/dbraw/zinc/67/25/82/1435672582.db2.gz QXVTYKKRCZAZHW-LPMFXHHGSA-N 0 0 389.477 3.487 20 5 GGBDRN Cc1c(NC(=O)N2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000280549779 1435677930 /nfs/dbraw/zinc/67/79/30/1435677930.db2.gz MTYJMZZINGPGII-OAHLLOKOSA-N 0 0 382.420 3.420 20 5 GGBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccc2cc[nH]c2c1 ZINC000280575261 1435682251 /nfs/dbraw/zinc/68/22/51/1435682251.db2.gz MRHHLFFWXBBEJT-UHFFFAOYSA-N 0 0 380.404 3.189 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1ccc(C(=O)N2CCC(O)CC2)cc1 ZINC000280596304 1435685411 /nfs/dbraw/zinc/68/54/11/1435685411.db2.gz BXTPNIRMELARQL-UHFFFAOYSA-N 0 0 399.447 3.203 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2c2nc3sccn3c2[N+](=O)[O-])sc1C ZINC000280597656 1435685532 /nfs/dbraw/zinc/68/55/32/1435685532.db2.gz XLICSNUEJOLAJY-SECBINFHSA-N 0 0 393.450 3.197 20 5 GGBDRN CC[C@@H]1C[C@H]1NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] ZINC000280611420 1435689014 /nfs/dbraw/zinc/68/90/14/1435689014.db2.gz AKGYIZYUKJDHNI-ZWNOBZJWSA-N 0 0 377.422 3.167 20 5 GGBDRN COC(=O)[C@H]1CC[C@H](C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000280613425 1435689681 /nfs/dbraw/zinc/68/96/81/1435689681.db2.gz KHWSNURFEKHKOF-HDJSIYSDSA-N 0 0 386.408 3.007 20 5 GGBDRN O=C(c1ccc(NCc2cc(Cl)ccc2[N+](=O)[O-])cc1)N1CCOCC1 ZINC000280618700 1435690463 /nfs/dbraw/zinc/69/04/63/1435690463.db2.gz FLCPFPZYRVORQB-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN CC[C@@H](CO)NC(=O)c1ccc(NCc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000280656149 1435698742 /nfs/dbraw/zinc/69/87/42/1435698742.db2.gz KPRKROSUKILOSC-HNNXBMFYSA-N 0 0 377.828 3.361 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000280679361 1435702753 /nfs/dbraw/zinc/70/27/53/1435702753.db2.gz YOJLTNDQMHCAES-HNNXBMFYSA-N 0 0 382.420 3.420 20 5 GGBDRN CCC(=O)c1ccc(N2CCS(=O)(=O)C3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000280727491 1435710291 /nfs/dbraw/zinc/71/02/91/1435710291.db2.gz MVONETWNQIGXPA-UHFFFAOYSA-N 0 0 380.466 3.125 20 5 GGBDRN Cc1ccc([C@H](NCc2ccc([N+](=O)[O-])cc2F)[C@H](C)S(C)(=O)=O)cc1 ZINC000280729824 1435710680 /nfs/dbraw/zinc/71/06/80/1435710680.db2.gz GQPKAWQZKDXKTP-SCLBCKFNSA-N 0 0 380.441 3.306 20 5 GGBDRN COC(=O)c1cc(NC(=O)N2CCC[C@@](C)(OC)CC2)c(C)c([N+](=O)[O-])c1 ZINC000280738473 1435712343 /nfs/dbraw/zinc/71/23/43/1435712343.db2.gz FAASABRMZYPJJU-GOSISDBHSA-N 0 0 379.413 3.113 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@@]2(CCOC2)O1 ZINC000280739654 1435712568 /nfs/dbraw/zinc/71/25/68/1435712568.db2.gz ZMZVZXBSRYPSSN-RCDICMHDSA-N 0 0 378.428 3.114 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](c1ccc(C)o1)N1CCCC1 ZINC000280768810 1435716676 /nfs/dbraw/zinc/71/66/76/1435716676.db2.gz BOGFWMNHCDJCKR-INIZCTEOSA-N 0 0 387.436 3.462 20 5 GGBDRN CCC(=O)c1ccc(N[C@H](C)c2cccc(S(=O)(=O)NC)c2)c([N+](=O)[O-])c1 ZINC000280818426 1435725526 /nfs/dbraw/zinc/72/55/26/1435725526.db2.gz XSZPUUOEKPRAAE-GFCCVEGCSA-N 0 0 391.449 3.269 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](c1ccc(C)cc1)[C@@H](C)S(C)(=O)=O ZINC000280820707 1435725993 /nfs/dbraw/zinc/72/59/93/1435725993.db2.gz NGPYSRIVXBRJLS-KUHUBIRLSA-N 0 0 392.477 3.176 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000280841309 1435729119 /nfs/dbraw/zinc/72/91/19/1435729119.db2.gz BYDDSSUASMIVEN-CQSZACIVSA-N 0 0 398.872 3.381 20 5 GGBDRN Cc1cc(OCC(=O)Nc2cccc(C[S@](C)=O)c2C)ccc1[N+](=O)[O-] ZINC000280852523 1435730997 /nfs/dbraw/zinc/73/09/97/1435730997.db2.gz CODDDAVRLDHAFH-SANMLTNESA-N 0 0 376.434 3.108 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000280872591 1435734249 /nfs/dbraw/zinc/73/42/49/1435734249.db2.gz RIOAJLRAKBHXHY-LLVKDONJSA-N 0 0 397.478 3.010 20 5 GGBDRN CSc1ccc(C(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000280889322 1435736696 /nfs/dbraw/zinc/73/66/96/1435736696.db2.gz DIUIWLWJICURMI-HNNXBMFYSA-N 0 0 399.472 3.442 20 5 GGBDRN COc1cc(C(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000280898045 1435738414 /nfs/dbraw/zinc/73/84/14/1435738414.db2.gz FCRDVRHJZUQUSH-HNNXBMFYSA-N 0 0 397.431 3.037 20 5 GGBDRN Cc1c(NC(=O)N(C)C)cccc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000280932947 1435744182 /nfs/dbraw/zinc/74/41/82/1435744182.db2.gz IFRUVYIQLMZRIC-ZDUSSCGKSA-N 0 0 385.424 3.436 20 5 GGBDRN Cc1ccc([C@H](NCc2cccc([N+](=O)[O-])c2C)[C@@H](C)S(C)(=O)=O)cc1 ZINC000280943244 1435745263 /nfs/dbraw/zinc/74/52/63/1435745263.db2.gz WHULVCJJBZUMDC-DNVCBOLYSA-N 0 0 376.478 3.476 20 5 GGBDRN O=c1[nH]c(NC[C@@H](c2ccco2)N2CCCCC2)nc2ccc([N+](=O)[O-])cc12 ZINC000280947464 1435745953 /nfs/dbraw/zinc/74/59/53/1435745953.db2.gz JGVVPNQGOXQIAS-INIZCTEOSA-N 0 0 383.408 3.476 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(N3CCCCCC3)nc2)n1 ZINC000280973245 1435749914 /nfs/dbraw/zinc/74/99/14/1435749914.db2.gz MJPRIHMICDSCAS-UHFFFAOYSA-N 0 0 385.424 3.164 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000281003074 1435754669 /nfs/dbraw/zinc/75/46/69/1435754669.db2.gz LAWVJQDQCUHNHS-HNNXBMFYSA-N 0 0 382.420 3.420 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)c(C)c1 ZINC000281004083 1435754744 /nfs/dbraw/zinc/75/47/44/1435754744.db2.gz PWVGCYGHZNDXHL-UHFFFAOYSA-N 0 0 395.419 3.244 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCn1c(C)nc2ccccc21 ZINC000281034032 1435760730 /nfs/dbraw/zinc/76/07/30/1435760730.db2.gz VPRTWTVIFWQEGS-UHFFFAOYSA-N 0 0 382.420 3.472 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@H](C)S(C)(=O)=O)cc1 ZINC000281043624 1435762136 /nfs/dbraw/zinc/76/21/36/1435762136.db2.gz RJFPCPVCSGPLFH-KBXCAEBGSA-N 0 0 390.461 3.116 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@H](C)S(C)(=O)=O)cc1 ZINC000281043631 1435762392 /nfs/dbraw/zinc/76/23/92/1435762392.db2.gz RJFPCPVCSGPLFH-KSSFIOAISA-N 0 0 390.461 3.116 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000281045349 1435762557 /nfs/dbraw/zinc/76/25/57/1435762557.db2.gz RPFPCPWZGPTTGR-RDTXWAMCSA-N 0 0 390.461 3.116 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCC(=O)N1CCc2ccccc21 ZINC000281057515 1435764733 /nfs/dbraw/zinc/76/47/33/1435764733.db2.gz YIHJQDPDCOIZRF-UHFFFAOYSA-N 0 0 397.431 3.093 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc3c(c2)N(C(N)=O)CCC3)c1 ZINC000281086317 1435771744 /nfs/dbraw/zinc/77/17/44/1435771744.db2.gz UXISQXQINGPRJS-UHFFFAOYSA-N 0 0 398.419 3.142 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H](C)c2ccc(NC(N)=O)cc2)c1 ZINC000281089423 1435772013 /nfs/dbraw/zinc/77/20/13/1435772013.db2.gz GUHIYKGGVFPCKP-ZDUSSCGKSA-N 0 0 386.408 3.040 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ncc(C)c(-c3ccccc3)n2)c(C)c1[N+](=O)[O-] ZINC000281143572 1435784018 /nfs/dbraw/zinc/78/40/18/1435784018.db2.gz KITVAHNUGVMXJC-UHFFFAOYSA-N 0 0 380.408 3.202 20 5 GGBDRN COC(=O)c1cc(NC(=O)C(C)(C)c2c(C)noc2C)c(C)c([N+](=O)[O-])c1 ZINC000281147924 1435784468 /nfs/dbraw/zinc/78/44/68/1435784468.db2.gz PERXPJLCMPGASG-UHFFFAOYSA-N 0 0 375.381 3.211 20 5 GGBDRN COCC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000281154019 1435785486 /nfs/dbraw/zinc/78/54/86/1435785486.db2.gz AURFIPVXHYFGNB-CQSZACIVSA-N 0 0 382.482 3.004 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000281165757 1435787192 /nfs/dbraw/zinc/78/71/92/1435787192.db2.gz KWNRNGBZPXZOJA-FCLVOEFKSA-N 0 0 375.469 3.108 20 5 GGBDRN Cc1c(NC(=O)N(C)C)cccc1N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000281168579 1435788235 /nfs/dbraw/zinc/78/82/35/1435788235.db2.gz PQMGOEGBNGULHP-ZDUSSCGKSA-N 0 0 385.424 3.436 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000281195731 1435793882 /nfs/dbraw/zinc/79/38/82/1435793882.db2.gz SKYQAKSYSBAYSQ-HNNXBMFYSA-N 0 0 397.431 3.119 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Cc1csc(NC(=O)C(C)C)n1 ZINC000281200746 1435795080 /nfs/dbraw/zinc/79/50/80/1435795080.db2.gz CBSQLLNQLGRWEM-UHFFFAOYSA-N 0 0 392.437 3.226 20 5 GGBDRN CN(C(=O)[C@H]1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000281205091 1435795634 /nfs/dbraw/zinc/79/56/34/1435795634.db2.gz TUXIWWPLGFGHAY-ZDUSSCGKSA-N 0 0 387.823 3.373 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)CCN(Cc1ccccc1)C(C)=O ZINC000281205127 1435795789 /nfs/dbraw/zinc/79/57/89/1435795789.db2.gz CJQMIUYJBSAEKT-UHFFFAOYSA-N 0 0 385.420 3.371 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccccc2CN2CCOCC2)c1 ZINC000281223955 1435798789 /nfs/dbraw/zinc/79/87/89/1435798789.db2.gz MJPJJDFBXYGIGJ-UHFFFAOYSA-N 0 0 399.447 3.143 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000281236437 1435800202 /nfs/dbraw/zinc/80/02/02/1435800202.db2.gz WBWVWCCZSQHEMP-UHFFFAOYSA-N 0 0 377.347 3.270 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(S(C)(=O)=O)cc(C)c1C ZINC000281238026 1435800249 /nfs/dbraw/zinc/80/02/49/1435800249.db2.gz FKCMXFZGHPMBPA-UHFFFAOYSA-N 0 0 392.433 3.266 20 5 GGBDRN Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000281256149 1435801086 /nfs/dbraw/zinc/80/10/86/1435801086.db2.gz HCISEHPBDCWGQU-QGZVFWFLSA-N 0 0 384.392 3.157 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(OC)c(OC)c(OC)c1 ZINC000281267895 1435801704 /nfs/dbraw/zinc/80/17/04/1435801704.db2.gz HDXNLLRCIUTTLV-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N1CCS[C@@H]2COCC[C@@H]21 ZINC000281283914 1435802358 /nfs/dbraw/zinc/80/23/58/1435802358.db2.gz XFKCUVVPPBTIIK-JKSUJKDBSA-N 0 0 385.445 3.003 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000281286992 1435802460 /nfs/dbraw/zinc/80/24/60/1435802460.db2.gz CFCIJDZLIVYAOR-UOJCXKCYSA-N 0 0 377.441 3.397 20 5 GGBDRN CCCCCn1nc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c2ccccc2c1=O ZINC000281302340 1435802976 /nfs/dbraw/zinc/80/29/76/1435802976.db2.gz YWJUNZJXTDVZMU-UHFFFAOYSA-N 0 0 395.419 3.167 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000281302526 1435803140 /nfs/dbraw/zinc/80/31/40/1435803140.db2.gz AUDJVBNFGSGRJS-KRWDZBQOSA-N 0 0 394.435 3.364 20 5 GGBDRN Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000281306253 1435803184 /nfs/dbraw/zinc/80/31/84/1435803184.db2.gz KGEXVZNREYJLSM-QGZVFWFLSA-N 0 0 384.392 3.157 20 5 GGBDRN COc1cc(C(=O)OCc2nnc(C(C)(C)C)s2)cc([N+](=O)[O-])c1OC ZINC000281310735 1435803362 /nfs/dbraw/zinc/80/33/62/1435803362.db2.gz VTJOLPDJVTVWJY-UHFFFAOYSA-N 0 0 381.410 3.118 20 5 GGBDRN Cc1c(NC(=O)N(C)C)cccc1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000281318041 1435803676 /nfs/dbraw/zinc/80/36/76/1435803676.db2.gz ZOQAHZFNWLYQFY-ZDUSSCGKSA-N 0 0 385.424 3.436 20 5 GGBDRN CCCS(=O)(=O)c1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1OCC ZINC000281321192 1435803780 /nfs/dbraw/zinc/80/37/80/1435803780.db2.gz KBUCUHCMDOGOMZ-UHFFFAOYSA-N 0 0 392.433 3.430 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCCc2sccc21 ZINC000281335881 1435804273 /nfs/dbraw/zinc/80/42/73/1435804273.db2.gz CILHQDKKOQZYLG-ZDUSSCGKSA-N 0 0 389.433 3.187 20 5 GGBDRN CCOc1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)c(C)c1 ZINC000281355478 1435805301 /nfs/dbraw/zinc/80/53/01/1435805301.db2.gz FEOPWJLYSIXWQG-UHFFFAOYSA-N 0 0 387.392 3.278 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)c1[N+](=O)[O-] ZINC000281356049 1435805334 /nfs/dbraw/zinc/80/53/34/1435805334.db2.gz KMXSIUFBASRCMV-AULYBMBSSA-N 0 0 382.342 3.332 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000281361785 1435805653 /nfs/dbraw/zinc/80/56/53/1435805653.db2.gz BVLJOCWZIQIMIV-MRXNPFEDSA-N 0 0 398.463 3.487 20 5 GGBDRN CCOC(=O)[C@@]1(COC)CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000281382039 1435806523 /nfs/dbraw/zinc/80/65/23/1435806523.db2.gz PELMFVAXJRWMRM-KRWDZBQOSA-N 0 0 399.831 3.072 20 5 GGBDRN C[C@@]1(C(N)=O)CCN(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000281389137 1435806833 /nfs/dbraw/zinc/80/68/33/1435806833.db2.gz NCPNKOHUOVEIHX-LJQANCHMSA-N 0 0 384.392 3.116 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC(C(=O)C(F)(F)F)CC2)c1 ZINC000281427241 1435808373 /nfs/dbraw/zinc/80/83/73/1435808373.db2.gz CWOJPPGNNVYTNN-UHFFFAOYSA-N 0 0 388.342 3.042 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000281424819 1435808406 /nfs/dbraw/zinc/80/84/06/1435808406.db2.gz IZESAVUHVMLTOK-INIZCTEOSA-N 0 0 378.454 3.036 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1 ZINC000281430371 1435808490 /nfs/dbraw/zinc/80/84/90/1435808490.db2.gz QQSAXLXJBRGYBF-ZDUSSCGKSA-N 0 0 377.441 3.217 20 5 GGBDRN CC(C)(C)Nc1ccccc1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000281450400 1435809420 /nfs/dbraw/zinc/80/94/20/1435809420.db2.gz SAXFKXQZPFYRPA-UHFFFAOYSA-N 0 0 391.449 3.461 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(OC)c(OC)cc1OC ZINC000281456922 1435809631 /nfs/dbraw/zinc/80/96/31/1435809631.db2.gz SLYKCANHQCSELA-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)[C@H](C)CC)C1 ZINC000281468119 1435810090 /nfs/dbraw/zinc/81/00/90/1435810090.db2.gz TYMYYFPXZBXKPW-KGLIPLIRSA-N 0 0 377.441 3.217 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)cc([N+](=O)[O-])c1 ZINC000281482811 1435810735 /nfs/dbraw/zinc/81/07/35/1435810735.db2.gz UTEIVYKCTRTGQO-GOSISDBHSA-N 0 0 383.404 3.073 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])n1 ZINC000281491784 1435811099 /nfs/dbraw/zinc/81/10/99/1435811099.db2.gz HLXBPEYDYWIUCK-HNNXBMFYSA-N 0 0 391.449 3.037 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)N2C ZINC000281496485 1435811152 /nfs/dbraw/zinc/81/11/52/1435811152.db2.gz VPKWIIYBEIIEGR-NSHDSACASA-N 0 0 384.392 3.023 20 5 GGBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000281493600 1435811176 /nfs/dbraw/zinc/81/11/76/1435811176.db2.gz QHGUSURFRBAJDO-GFCCVEGCSA-N 0 0 389.408 3.311 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(Cl)c(CN(C)C)c2)c(C)c1[N+](=O)[O-] ZINC000281499938 1435811371 /nfs/dbraw/zinc/81/13/71/1435811371.db2.gz HUGRPIRWZONFED-UHFFFAOYSA-N 0 0 379.848 3.152 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c1[N+](=O)[O-] ZINC000281501132 1435811459 /nfs/dbraw/zinc/81/14/59/1435811459.db2.gz VYKKERJSUCEUIG-KRWDZBQOSA-N 0 0 383.404 3.073 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](c2nc(C3CC3)no2)C(C)C)c1 ZINC000281521306 1435812159 /nfs/dbraw/zinc/81/21/59/1435812159.db2.gz JEYXGSSJFHKECC-KRWDZBQOSA-N 0 0 388.424 3.446 20 5 GGBDRN Cc1cccc(CCNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000281539258 1435812667 /nfs/dbraw/zinc/81/26/67/1435812667.db2.gz KJZQLVUETQPHNW-UHFFFAOYSA-N 0 0 384.436 3.094 20 5 GGBDRN CC[C@@H](C)c1nnc([C@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[nH]1 ZINC000281542936 1435812907 /nfs/dbraw/zinc/81/29/07/1435812907.db2.gz KLUHTOIEQYBLPV-OLZOCXBDSA-N 0 0 375.429 3.181 20 5 GGBDRN CC[C@@H](C)c1nnc([C@@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[nH]1 ZINC000281542932 1435812929 /nfs/dbraw/zinc/81/29/29/1435812929.db2.gz KLUHTOIEQYBLPV-CHWSQXEVSA-N 0 0 375.429 3.181 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1cccs1)C(C)C ZINC000281549279 1435813180 /nfs/dbraw/zinc/81/31/80/1435813180.db2.gz VLPJEWITBLTZBD-UHFFFAOYSA-N 0 0 391.449 3.431 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC(F)(c2ccccc2C(F)(F)F)CC1 ZINC000281585512 1435814611 /nfs/dbraw/zinc/81/46/11/1435814611.db2.gz BWACMEIGOHPRJO-UHFFFAOYSA-N 0 0 386.305 3.438 20 5 GGBDRN Cc1cc(OCC(=O)N(C)Cc2nc(C(F)(F)F)cs2)ccc1[N+](=O)[O-] ZINC000281614496 1435815657 /nfs/dbraw/zinc/81/56/57/1435815657.db2.gz KWNPHQMOYMHPGM-UHFFFAOYSA-N 0 0 389.355 3.416 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccccc2C[S@@](C)=O)c1 ZINC000281666253 1435817622 /nfs/dbraw/zinc/81/76/22/1435817622.db2.gz SVJSKTIZNULBQM-AREMUKBSSA-N 0 0 376.434 3.189 20 5 GGBDRN CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)[C@H](C)C1 ZINC000281669435 1435817792 /nfs/dbraw/zinc/81/77/92/1435817792.db2.gz DNLHNZDGLKXARA-NVXWUHKLSA-N 0 0 375.469 3.471 20 5 GGBDRN CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)[C@@H](C)C1 ZINC000281669439 1435817898 /nfs/dbraw/zinc/81/78/98/1435817898.db2.gz DNLHNZDGLKXARA-RDJZCZTQSA-N 0 0 375.469 3.471 20 5 GGBDRN COc1cc(C(=O)NCCCCCCSC(C)=O)cc([N+](=O)[O-])c1OC ZINC000281674772 1435818006 /nfs/dbraw/zinc/81/80/06/1435818006.db2.gz UAQXQSFUQJQFTC-UHFFFAOYSA-N 0 0 384.454 3.182 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000281695420 1435818607 /nfs/dbraw/zinc/81/86/07/1435818607.db2.gz VQPGZWGPFNKKQP-UHFFFAOYSA-N 0 0 387.436 3.132 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000281693477 1435818660 /nfs/dbraw/zinc/81/86/60/1435818660.db2.gz OPTFOZUSYYCVDB-SFHVURJKSA-N 0 0 383.404 3.200 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2cc(C)cc(Cl)n2)cc1OC ZINC000281714123 1435819240 /nfs/dbraw/zinc/81/92/40/1435819240.db2.gz DIDGWMNWVQXFLT-UHFFFAOYSA-N 0 0 379.800 3.289 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H]1CCc2ccccc21 ZINC000281718957 1435819468 /nfs/dbraw/zinc/81/94/68/1435819468.db2.gz RSSRRAZLAAGLEL-QGZVFWFLSA-N 0 0 383.404 3.078 20 5 GGBDRN COCCn1cc(CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])cn1 ZINC000281735525 1435820033 /nfs/dbraw/zinc/82/00/33/1435820033.db2.gz AYRCDBWDYPPWLM-UHFFFAOYSA-N 0 0 395.288 3.099 20 5 GGBDRN CC[C@@H]1CN(c2nc(N3CCCO[C@@H](CC)C3)ccc2[N+](=O)[O-])CCCO1 ZINC000281744463 1435820398 /nfs/dbraw/zinc/82/03/98/1435820398.db2.gz DQENVTWEPVUZCY-JKSUJKDBSA-N 0 0 378.473 3.000 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccccc1NC(C)(C)C ZINC000281758084 1435820970 /nfs/dbraw/zinc/82/09/70/1435820970.db2.gz WOSPXNYERQKUEU-UHFFFAOYSA-N 0 0 384.436 3.402 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H](C)C[C@@H](O)c2cccs2)c1 ZINC000281764567 1435821138 /nfs/dbraw/zinc/82/11/38/1435821138.db2.gz ZGLDMEQRQMMHBB-DZGCQCFKSA-N 0 0 378.450 3.362 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000281779816 1435821795 /nfs/dbraw/zinc/82/17/95/1435821795.db2.gz LJMKKDKLSBHJSI-UHFFFAOYSA-N 0 0 380.404 3.473 20 5 GGBDRN Cc1csc(NC(=O)CS[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000281794913 1435822290 /nfs/dbraw/zinc/82/22/90/1435822290.db2.gz FCUKCBXTMGJISI-NSHDSACASA-N 0 0 394.478 3.367 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000281838707 1435823812 /nfs/dbraw/zinc/82/38/12/1435823812.db2.gz PKNZKNRTNRNBAZ-QGZVFWFLSA-N 0 0 395.419 3.432 20 5 GGBDRN COc1ccccc1N1C[C@H](C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)CC1=O ZINC000281852438 1435824291 /nfs/dbraw/zinc/82/42/91/1435824291.db2.gz BGFJNVLSPXZQHA-GFCCVEGCSA-N 0 0 387.367 3.043 20 5 GGBDRN Cc1cc(NC(=O)[C@H](C)SCC(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)no1 ZINC000281872940 1435825008 /nfs/dbraw/zinc/82/50/08/1435825008.db2.gz CQUNNBFKIQFNEM-JTQLQIEISA-N 0 0 396.400 3.038 20 5 GGBDRN CC(=O)N1CCCc2cc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)ccc21 ZINC000281889567 1435825604 /nfs/dbraw/zinc/82/56/04/1435825604.db2.gz DLVAYWMENLDYQB-UHFFFAOYSA-N 0 0 383.404 3.220 20 5 GGBDRN O=C(Nc1ccc(Cl)c(CN2CCOCC2)c1)c1cc(F)ccc1[N+](=O)[O-] ZINC000281907075 1435826363 /nfs/dbraw/zinc/82/63/63/1435826363.db2.gz UPQAGZAYMTUMCR-UHFFFAOYSA-N 0 0 393.802 3.472 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000281916166 1435826670 /nfs/dbraw/zinc/82/66/70/1435826670.db2.gz GUCMGDMQCSLZIQ-RNHZPVLASA-N 0 0 399.447 3.250 20 5 GGBDRN C[C@H](NC(=O)N1CC[C@H](C(=O)N(C)c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000281916757 1435826783 /nfs/dbraw/zinc/82/67/83/1435826783.db2.gz GSKOYKUGTDEMGM-RDJZCZTQSA-N 0 0 396.447 3.350 20 5 GGBDRN CO[C@@H]1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000281922972 1435826990 /nfs/dbraw/zinc/82/69/90/1435826990.db2.gz STQATDACDJTDLI-WCQYABFASA-N 0 0 389.374 3.442 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000281932652 1435827338 /nfs/dbraw/zinc/82/73/38/1435827338.db2.gz HYVCEJPSVVWBHW-HNNXBMFYSA-N 0 0 384.436 3.179 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000281932405 1435827411 /nfs/dbraw/zinc/82/74/11/1435827411.db2.gz IDVLLNCJMHXJBB-HAQNSBGRSA-N 0 0 396.230 3.126 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000281949627 1435828181 /nfs/dbraw/zinc/82/81/81/1435828181.db2.gz NCJNYCLVVLXEPT-OAHLLOKOSA-N 0 0 391.468 3.291 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C[S@@](C)=O)c1ccccc1 ZINC000281967789 1435828889 /nfs/dbraw/zinc/82/88/89/1435828889.db2.gz NRHPAIABYPCFMA-RKOGDMNLSA-N 0 0 391.449 3.235 20 5 GGBDRN Cc1cc(OCC(=O)Nc2ccc(CN3CCCC3=O)cc2)ccc1[N+](=O)[O-] ZINC000281974434 1435829319 /nfs/dbraw/zinc/82/93/19/1435829319.db2.gz MAXZMDALJMDCTH-UHFFFAOYSA-N 0 0 383.404 3.043 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000281983185 1435829566 /nfs/dbraw/zinc/82/95/66/1435829566.db2.gz MRTOPQDUSVTJNT-HNNXBMFYSA-N 0 0 387.440 3.257 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000282002546 1435830542 /nfs/dbraw/zinc/83/05/42/1435830542.db2.gz BZXLIXHDOXUWMZ-HAQNSBGRSA-N 0 0 389.358 3.182 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCO)Cc1ccccc1OC ZINC000282021126 1435831358 /nfs/dbraw/zinc/83/13/58/1435831358.db2.gz SFHVRQHWJWDSOP-UHFFFAOYSA-N 0 0 389.408 3.029 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000282037013 1435831840 /nfs/dbraw/zinc/83/18/40/1435831840.db2.gz LSELJNMUDSJFER-OYRIPWCXSA-N 0 0 398.463 3.182 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2ccc(F)cc2OCCC(F)(F)F)c1[N+](=O)[O-] ZINC000282033229 1435831936 /nfs/dbraw/zinc/83/19/36/1435831936.db2.gz BFVVGBUHZMRDMP-UHFFFAOYSA-N 0 0 376.266 3.349 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000282037011 1435831939 /nfs/dbraw/zinc/83/19/39/1435831939.db2.gz LSELJNMUDSJFER-FKKBTLCVSA-N 0 0 398.463 3.182 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000282041598 1435832242 /nfs/dbraw/zinc/83/22/42/1435832242.db2.gz ZXNDXZGSMMYVPP-XIVBQZFQSA-N 0 0 375.469 3.108 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)C(=O)NCCF ZINC000282049252 1435832581 /nfs/dbraw/zinc/83/25/81/1435832581.db2.gz PHKCFQUSZYJZKT-LBPRGKRZSA-N 0 0 397.472 3.081 20 5 GGBDRN C[C@H](C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(C)CC(F)(F)F ZINC000282056462 1435832870 /nfs/dbraw/zinc/83/28/70/1435832870.db2.gz ZHDGLLOCGDHFGF-MRVPVSSYSA-N 0 0 387.280 3.112 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000282068774 1435833371 /nfs/dbraw/zinc/83/33/71/1435833371.db2.gz YEEKVNRJKUDXGN-HNNXBMFYSA-N 0 0 391.468 3.291 20 5 GGBDRN CCC[C@H](C)c1cc(NC(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)n[nH]1 ZINC000282095330 1435834392 /nfs/dbraw/zinc/83/43/92/1435834392.db2.gz JPXFQZNBPRSUIU-VIFPVBQESA-N 0 0 377.376 3.246 20 5 GGBDRN Cc1cc(OCC(=O)Oc2ccc(C(=O)N3CCCC3)cc2)ccc1[N+](=O)[O-] ZINC000282106640 1435834887 /nfs/dbraw/zinc/83/48/87/1435834887.db2.gz YMKIMQDWMJKEPY-UHFFFAOYSA-N 0 0 384.388 3.124 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](CNC(=O)C(C)C)C1 ZINC000282109404 1435834917 /nfs/dbraw/zinc/83/49/17/1435834917.db2.gz ZVRKAXRFLMNTPO-AWEZNQCLSA-N 0 0 392.456 3.010 20 5 GGBDRN Cc1csc(NC(=O)CS[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n1 ZINC000282159961 1435836875 /nfs/dbraw/zinc/83/68/75/1435836875.db2.gz MYXBZYPLFHCFGH-VIFPVBQESA-N 0 0 398.441 3.198 20 5 GGBDRN Cc1csc(NC(=O)CSCCC(=O)Nc2ccc([N+](=O)[O-])cc2C)n1 ZINC000282171101 1435837164 /nfs/dbraw/zinc/83/71/64/1435837164.db2.gz NVGZOKNSMHTZGI-UHFFFAOYSA-N 0 0 394.478 3.369 20 5 GGBDRN CN(CCOCCO)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000282183579 1435837693 /nfs/dbraw/zinc/83/76/93/1435837693.db2.gz OZOUPRWHKQDCJG-UHFFFAOYSA-N 0 0 394.811 3.121 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000282221205 1435838862 /nfs/dbraw/zinc/83/88/62/1435838862.db2.gz UMTUCHIFOJYVNF-MJEZEWASSA-N 0 0 398.463 3.182 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000282221207 1435838942 /nfs/dbraw/zinc/83/89/42/1435838942.db2.gz UMTUCHIFOJYVNF-RPWFAHAXSA-N 0 0 398.463 3.182 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC[C@@H]1CC(=O)N(C(C)(C)C)[C@H]1c1cnn(C)c1 ZINC000282235527 1435839528 /nfs/dbraw/zinc/83/95/28/1435839528.db2.gz LLKXOAZORVHHJZ-IFXJQAMLSA-N 0 0 385.468 3.437 20 5 GGBDRN Cc1cccc(NC[C@@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)c1[N+](=O)[O-] ZINC000282235539 1435839547 /nfs/dbraw/zinc/83/95/47/1435839547.db2.gz LLTMFVYPZJQLJY-IFXJQAMLSA-N 0 0 385.468 3.437 20 5 GGBDRN CCN(CCOCCO)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000282253863 1435840253 /nfs/dbraw/zinc/84/02/53/1435840253.db2.gz BKYGJYSKSHEAHM-UHFFFAOYSA-N 0 0 389.408 3.250 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)cnn1C1CCCC1 ZINC000282275645 1435841336 /nfs/dbraw/zinc/84/13/36/1435841336.db2.gz YPIGRLOTLRKCFM-UHFFFAOYSA-N 0 0 389.387 3.240 20 5 GGBDRN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000282311589 1435842703 /nfs/dbraw/zinc/84/27/03/1435842703.db2.gz LUMSNJDYQCWHDW-UHFFFAOYSA-N 0 0 392.419 3.233 20 5 GGBDRN C[C@H](NC(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000282331951 1435843330 /nfs/dbraw/zinc/84/33/30/1435843330.db2.gz FWCVOVHHOAYQAP-WMLDXEAASA-N 0 0 397.435 3.261 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)Nc2cc([N+](=O)[O-])c(C)cc2F)cc1 ZINC000282327794 1435843382 /nfs/dbraw/zinc/84/33/82/1435843382.db2.gz FOTKPZMADFCBON-UHFFFAOYSA-N 0 0 394.424 3.407 20 5 GGBDRN Cn1cc2c(n1)CCC[C@H]2NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000282370300 1435844791 /nfs/dbraw/zinc/84/47/91/1435844791.db2.gz CHDCJNSLJYXVSM-QGZVFWFLSA-N 0 0 383.452 3.126 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCCc1nc2ccccc2[nH]1 ZINC000282373331 1435844931 /nfs/dbraw/zinc/84/49/31/1435844931.db2.gz INBOZQKOYHHKNF-UHFFFAOYSA-N 0 0 381.436 3.288 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1 ZINC000282387961 1435845429 /nfs/dbraw/zinc/84/54/29/1435845429.db2.gz RHHVWEQTVAULRD-ZDUSSCGKSA-N 0 0 380.420 3.058 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000282392022 1435845541 /nfs/dbraw/zinc/84/55/41/1435845541.db2.gz DSNKSRPUIDRHBN-UHFFFAOYSA-N 0 0 376.438 3.135 20 5 GGBDRN Cc1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1C(=O)N(C)C ZINC000282390255 1435845580 /nfs/dbraw/zinc/84/55/80/1435845580.db2.gz BUGVNXVUKBPEKZ-UHFFFAOYSA-N 0 0 384.436 3.311 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282417307 1435846461 /nfs/dbraw/zinc/84/64/61/1435846461.db2.gz LMAWZXBDTHCYMO-AWEZNQCLSA-N 0 0 384.436 3.498 20 5 GGBDRN CON(CC1CCOCC1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000282422097 1435846645 /nfs/dbraw/zinc/84/66/45/1435846645.db2.gz JLRYUXVCXQDJTF-UHFFFAOYSA-N 0 0 377.422 3.149 20 5 GGBDRN COCCOC(=O)c1c(C)[nH]c(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2F)c1C ZINC000282436763 1435847197 /nfs/dbraw/zinc/84/71/97/1435847197.db2.gz MRAKDMFSWDOWMN-UHFFFAOYSA-N 0 0 393.371 3.043 20 5 GGBDRN Cc1cc(F)c(NC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000282448961 1435847642 /nfs/dbraw/zinc/84/76/42/1435847642.db2.gz NRINDBDEKJULKT-AWEZNQCLSA-N 0 0 375.356 3.269 20 5 GGBDRN COCCOc1ccc(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282456547 1435847860 /nfs/dbraw/zinc/84/78/60/1435847860.db2.gz ODTKRRYBSJTBCS-UHFFFAOYSA-N 0 0 387.436 3.004 20 5 GGBDRN O=[N+]([O-])c1cnn(CCc2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)c1 ZINC000282475493 1435848513 /nfs/dbraw/zinc/84/85/13/1435848513.db2.gz PRMGNTMDEDYQQX-ZDUSSCGKSA-N 0 0 385.277 3.495 20 5 GGBDRN COCCOc1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1F ZINC000282481642 1435848753 /nfs/dbraw/zinc/84/87/53/1435848753.db2.gz MIQXIGGUOXQLPT-UHFFFAOYSA-N 0 0 391.399 3.466 20 5 GGBDRN COC(=O)NCc1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282483435 1435848785 /nfs/dbraw/zinc/84/87/85/1435848785.db2.gz MOIBNPAHTNJRII-UHFFFAOYSA-N 0 0 386.408 3.157 20 5 GGBDRN COc1cc(C(=O)N2CCC(N3CCc4ccccc43)CC2)ccc1[N+](=O)[O-] ZINC000282489514 1435848998 /nfs/dbraw/zinc/84/89/98/1435848998.db2.gz YEGJHLBFAFYAIF-UHFFFAOYSA-N 0 0 381.432 3.271 20 5 GGBDRN COc1cc(F)c(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000282490693 1435849076 /nfs/dbraw/zinc/84/90/76/1435849076.db2.gz NGYHCJCORFGRBQ-UHFFFAOYSA-N 0 0 377.372 3.458 20 5 GGBDRN CCOc1cc(N2CCN([C@@H](C)c3nnc(C)s3)CC2)ccc1[N+](=O)[O-] ZINC000282505856 1435849546 /nfs/dbraw/zinc/84/95/46/1435849546.db2.gz NYXHCQRASWDPCK-LBPRGKRZSA-N 0 0 377.470 3.037 20 5 GGBDRN CON(CC1CCOCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000282519364 1435850027 /nfs/dbraw/zinc/85/00/27/1435850027.db2.gz QJXKGIIFFPGJAS-UHFFFAOYSA-N 0 0 375.328 3.018 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O ZINC000282525277 1435850112 /nfs/dbraw/zinc/85/01/12/1435850112.db2.gz QZAOAIYXJVPDNK-UHFFFAOYSA-N 0 0 384.314 3.421 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(CN2CCOC2=O)cc1 ZINC000282523467 1435850158 /nfs/dbraw/zinc/85/01/58/1435850158.db2.gz QWBDFASQWLKMKY-UHFFFAOYSA-N 0 0 398.419 3.253 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN[C@]3(CO)CCOc4ccccc43)cs2)c1 ZINC000282527143 1435850234 /nfs/dbraw/zinc/85/02/34/1435850234.db2.gz YRDMQNIXJWTFCM-FQEVSTJZSA-N 0 0 397.456 3.478 20 5 GGBDRN Cc1cc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)ccc1C(=O)N(C)C ZINC000282527338 1435850297 /nfs/dbraw/zinc/85/02/97/1435850297.db2.gz RGQRXBKUAPFEEG-UHFFFAOYSA-N 0 0 384.436 3.311 20 5 GGBDRN CCOc1ccc(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000282548782 1435851224 /nfs/dbraw/zinc/85/12/24/1435851224.db2.gz WXXRWTUQMHRRRY-UHFFFAOYSA-N 0 0 387.436 3.386 20 5 GGBDRN Cc1cc(F)c(NC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)cc1[N+](=O)[O-] ZINC000282575187 1435852166 /nfs/dbraw/zinc/85/21/66/1435852166.db2.gz ZDNYCDIABXRRNP-UHFFFAOYSA-N 0 0 394.424 3.406 20 5 GGBDRN Cc1ccc([C@@H](NCc2ccc([N+](=O)[O-])c(F)c2)[C@H](C)S(C)(=O)=O)cc1 ZINC000282578468 1435852407 /nfs/dbraw/zinc/85/24/07/1435852407.db2.gz VVCWYPBVWNFRNE-UGSOOPFHSA-N 0 0 380.441 3.306 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1O[C@@H]1CCOC1 ZINC000282585225 1435852625 /nfs/dbraw/zinc/85/26/25/1435852625.db2.gz DDWILBMTQMEPQY-QGZVFWFLSA-N 0 0 385.420 3.469 20 5 GGBDRN COC(=O)CCc1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282599020 1435853111 /nfs/dbraw/zinc/85/31/11/1435853111.db2.gz YVRPBNUNXRZRLA-UHFFFAOYSA-N 0 0 385.420 3.407 20 5 GGBDRN COC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)nc1 ZINC000282604144 1435853427 /nfs/dbraw/zinc/85/34/27/1435853427.db2.gz DDROLRAOZMKPJU-UHFFFAOYSA-N 0 0 384.392 3.019 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000282609990 1435853540 /nfs/dbraw/zinc/85/35/40/1435853540.db2.gz IPOLZUANIKPPRU-OAHLLOKOSA-N 0 0 383.408 3.331 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000282619899 1435853875 /nfs/dbraw/zinc/85/38/75/1435853875.db2.gz CRSHZSAVWOVJMC-MRXNPFEDSA-N 0 0 391.468 3.289 20 5 GGBDRN CCOc1cccc([C@@H](C)NC(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)c1 ZINC000282618465 1435853883 /nfs/dbraw/zinc/85/38/83/1435853883.db2.gz VSQVXIUZFDXBOV-GFCCVEGCSA-N 0 0 389.383 3.257 20 5 GGBDRN CCOc1cccc([C@H](C)NC(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)c1 ZINC000282618469 1435853926 /nfs/dbraw/zinc/85/39/26/1435853926.db2.gz VSQVXIUZFDXBOV-LBPRGKRZSA-N 0 0 389.383 3.257 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCCCNC(=O)OC(C)(C)C ZINC000282633258 1435854535 /nfs/dbraw/zinc/85/45/35/1435854535.db2.gz DKRNALSKUIVKRJ-UHFFFAOYSA-N 0 0 394.472 3.084 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2CN2CCOCC2)c1 ZINC000282637944 1435854751 /nfs/dbraw/zinc/85/47/51/1435854751.db2.gz KTYBNVMWOCDZKD-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1cccc2c1OCCCO2 ZINC000282657780 1435855349 /nfs/dbraw/zinc/85/53/49/1435855349.db2.gz GCMCHHWMFZYNDD-UHFFFAOYSA-N 0 0 385.420 3.140 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F ZINC000282656316 1435855362 /nfs/dbraw/zinc/85/53/62/1435855362.db2.gz YCYHEODCBCNIIZ-NSHDSACASA-N 0 0 393.337 3.464 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)N2CCCC2)c1 ZINC000282662263 1435855466 /nfs/dbraw/zinc/85/54/66/1435855466.db2.gz NVTXSJLTPXWJMM-UHFFFAOYSA-N 0 0 383.404 3.482 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1 ZINC000282659876 1435855509 /nfs/dbraw/zinc/85/55/09/1435855509.db2.gz NQJFQZRGWQKYOO-UHFFFAOYSA-N 0 0 385.376 3.198 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc(N2C(=O)CCNC2=O)c1C ZINC000282664360 1435855626 /nfs/dbraw/zinc/85/56/26/1435855626.db2.gz MEQOTFKATKNPAF-UHFFFAOYSA-N 0 0 398.419 3.360 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)CC(=O)Nc2c(C)cccc2C)c1 ZINC000282667831 1435855793 /nfs/dbraw/zinc/85/57/93/1435855793.db2.gz ONZAHZNTVAQLLL-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C(=O)Nc1ccccc1NC(C)(C)C ZINC000282730014 1435858145 /nfs/dbraw/zinc/85/81/45/1435858145.db2.gz CJDUEZOBQNACPN-UHFFFAOYSA-N 0 0 398.463 3.445 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)c1 ZINC000282736311 1435858358 /nfs/dbraw/zinc/85/83/58/1435858358.db2.gz IVCHTZVWIVRCFT-YRMAPFEESA-N 0 0 376.453 3.395 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)c1 ZINC000282739045 1435858483 /nfs/dbraw/zinc/85/84/83/1435858483.db2.gz YVCKYWAGQSTGCU-LBPRGKRZSA-N 0 0 383.404 3.369 20 5 GGBDRN Cc1c(C(=O)NC[C@H]2CCCC(F)(F)C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000282739213 1435858588 /nfs/dbraw/zinc/85/85/88/1435858588.db2.gz TYFWOCHEBLUGOX-LBPRGKRZSA-N 0 0 379.367 3.039 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(CN3CCCC3=O)c2)c1 ZINC000282740712 1435858642 /nfs/dbraw/zinc/85/86/42/1435858642.db2.gz YYXQWDVRKVGZQW-UHFFFAOYSA-N 0 0 397.431 3.046 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCn2c(C)nc3ccccc32)c1 ZINC000282750201 1435858948 /nfs/dbraw/zinc/85/89/48/1435858948.db2.gz BYOCYEOSONFWGS-UHFFFAOYSA-N 0 0 382.420 3.472 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(c3cccc(OC)c3)C2)c1 ZINC000282749898 1435858984 /nfs/dbraw/zinc/85/89/84/1435858984.db2.gz BGAOIWHIONYLJI-AWEZNQCLSA-N 0 0 385.420 3.011 20 5 GGBDRN Cn1cc2c(n1)CCC[C@@H]2NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000282782121 1435860095 /nfs/dbraw/zinc/86/00/95/1435860095.db2.gz LMVPBVFNROZITP-SFHVURJKSA-N 0 0 386.455 3.082 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C[S@@](C)=O)c2C)c1 ZINC000282783749 1435860268 /nfs/dbraw/zinc/86/02/68/1435860268.db2.gz GEUZCUGXUMTTJX-AREMUKBSSA-N 0 0 376.434 3.433 20 5 GGBDRN COCC[C@@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000282798249 1435860742 /nfs/dbraw/zinc/86/07/42/1435860742.db2.gz PZRUGZJXGPLPAT-QGZVFWFLSA-N 0 0 375.425 3.458 20 5 GGBDRN Cn1c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])cc3)cc2nc1C1CC1 ZINC000282832767 1435862178 /nfs/dbraw/zinc/86/21/78/1435862178.db2.gz DPGSFFPYUXTWQC-UHFFFAOYSA-N 0 0 380.404 3.054 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(c3ccccc3OC)CC2)c1 ZINC000282848029 1435862858 /nfs/dbraw/zinc/86/28/58/1435862858.db2.gz NMFPAOOXUZHNLU-UHFFFAOYSA-N 0 0 399.447 3.401 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)[C@@H](c1ccccc1F)N1CCOCC1 ZINC000282853436 1435863054 /nfs/dbraw/zinc/86/30/54/1435863054.db2.gz AVSJBVFFEKZWRK-QGZVFWFLSA-N 0 0 393.802 3.399 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(OC[C@H]3CCCCO3)CC2)c1 ZINC000282861088 1435863558 /nfs/dbraw/zinc/86/35/58/1435863558.db2.gz PBAKHUXQUVUAST-QGZVFWFLSA-N 0 0 392.452 3.184 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)[C@@H]1CCCN1C(=O)OCC(F)(F)F ZINC000282869311 1435863864 /nfs/dbraw/zinc/86/38/64/1435863864.db2.gz CBCUWUPVZKAFRB-JTQLQIEISA-N 0 0 395.721 3.350 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)c2cc(OCC)ccc2[N+](=O)[O-])nc1C ZINC000282879635 1435864304 /nfs/dbraw/zinc/86/43/04/1435864304.db2.gz QZUBQEGWJCNNIF-UHFFFAOYSA-N 0 0 393.421 3.212 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(CC)Cc2ccc(C(=O)N(C)C)cc2)c1 ZINC000282883997 1435864595 /nfs/dbraw/zinc/86/45/95/1435864595.db2.gz ROGUMPYZCHIHHI-UHFFFAOYSA-N 0 0 399.447 3.358 20 5 GGBDRN COCCO[C@@H](C)c1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CC(C)C ZINC000282937296 1435866822 /nfs/dbraw/zinc/86/68/22/1435866822.db2.gz GEHWMRPCXUFFSY-HNNXBMFYSA-N 0 0 391.472 3.203 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C(C)=O)C3(CCCCC3)C2)c1 ZINC000282954130 1435867484 /nfs/dbraw/zinc/86/74/84/1435867484.db2.gz 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CN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000283114413 1435875146 /nfs/dbraw/zinc/87/51/46/1435875146.db2.gz MQHBTJDUHCVLEJ-UGSOOPFHSA-N 0 0 391.374 3.448 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)[C@@H]1CCCN(C(=O)N2CCCC2)C1 ZINC000283153317 1435877051 /nfs/dbraw/zinc/87/70/51/1435877051.db2.gz VHNWMSFYBMBBEW-GFCCVEGCSA-N 0 0 380.832 3.115 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2Cl)C1 ZINC000283157668 1435877277 /nfs/dbraw/zinc/87/72/77/1435877277.db2.gz VMEMVSJFDMTJST-GFCCVEGCSA-N 0 0 382.848 3.264 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(Oc3ccc(F)nc3)CC2)c1 ZINC000283260995 1435881874 /nfs/dbraw/zinc/88/18/74/1435881874.db2.gz RYJJKWACARXYMS-UHFFFAOYSA-N 0 0 389.383 3.211 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000283272258 1435882380 /nfs/dbraw/zinc/88/23/80/1435882380.db2.gz VSDZNFVDLBZLRI-PXAZEXFGSA-N 0 0 377.347 3.105 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(Oc3ccncc3C)CC2)c1 ZINC000283303149 1435883581 /nfs/dbraw/zinc/88/35/81/1435883581.db2.gz VVZDWBGZYLENEE-UHFFFAOYSA-N 0 0 385.420 3.381 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc3c(cc2OC)CCC(=O)N3)c1 ZINC000283331675 1435884742 /nfs/dbraw/zinc/88/47/42/1435884742.db2.gz XWCVLWNXJYJRNX-UHFFFAOYSA-N 0 0 385.376 3.139 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](COC)c2ccc(F)c(F)c2)c1 ZINC000283333783 1435884829 /nfs/dbraw/zinc/88/48/29/1435884829.db2.gz XZVBUKDZVQULEZ-MRXNPFEDSA-N 0 0 380.347 3.389 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](COC)c2ccc(F)c(F)c2)c1 ZINC000283333777 1435884877 /nfs/dbraw/zinc/88/48/77/1435884877.db2.gz XZVBUKDZVQULEZ-INIZCTEOSA-N 0 0 380.347 3.389 20 5 GGBDRN C[C@@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccc([S@@](C)=O)cc1 ZINC000283369669 1435886397 /nfs/dbraw/zinc/88/63/97/1435886397.db2.gz CMQFWDBEFWNQLO-LOKFHWFJSA-N 0 0 389.477 3.277 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(N3C[C@@H]4CCC[C@H]4C3)n2C[C@H]2CCOC2)cc1 ZINC000283372320 1435886610 /nfs/dbraw/zinc/88/66/10/1435886610.db2.gz MERAZAYTCGJAEK-PVAVHDDUSA-N 0 0 383.452 3.126 20 5 GGBDRN COCCCCN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283379926 1435887006 /nfs/dbraw/zinc/88/70/06/1435887006.db2.gz FPMJRBBYDPZDPG-UHFFFAOYSA-N 0 0 375.400 3.385 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000283390338 1435887492 /nfs/dbraw/zinc/88/74/92/1435887492.db2.gz GMZZKFKALVLCOC-UHFFFAOYSA-N 0 0 383.383 3.212 20 5 GGBDRN CCCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H](C)C(=O)Nc1ccccc1 ZINC000283448846 1435890310 /nfs/dbraw/zinc/89/03/10/1435890310.db2.gz KOUVAUWAHHWAGN-LBPRGKRZSA-N 0 0 388.399 3.196 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3C[C@@H]4CCC[C@@H]4C3)n2C[C@@H]2CCCO2)c1 ZINC000283497054 1435892572 /nfs/dbraw/zinc/89/25/72/1435892572.db2.gz QPQYFQABJYJXOS-JZXOWHBKSA-N 0 0 383.452 3.269 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283500510 1435892806 /nfs/dbraw/zinc/89/28/06/1435892806.db2.gz FVCJNMNYOCWACU-UHFFFAOYSA-N 0 0 398.385 3.214 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C1(c2ccc(F)cc2)CCOCC1 ZINC000283504963 1435892924 /nfs/dbraw/zinc/89/29/24/1435892924.db2.gz GAOJURPLKXMCQG-UHFFFAOYSA-N 0 0 386.423 3.483 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(OCC(F)(F)F)cn1 ZINC000283520418 1435893586 /nfs/dbraw/zinc/89/35/86/1435893586.db2.gz HBHDPXVMRIMAAQ-UHFFFAOYSA-N 0 0 383.326 3.246 20 5 GGBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCO[C@H](c2cccc(F)c2)C1 ZINC000283521352 1435893758 /nfs/dbraw/zinc/89/37/58/1435893758.db2.gz NNVUSLBGMZTSIG-KRWDZBQOSA-N 0 0 383.383 3.107 20 5 GGBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCC(C(=O)C(F)(F)F)CC1 ZINC000283567681 1435895864 /nfs/dbraw/zinc/89/58/64/1435895864.db2.gz VJJKHTBSFREPJD-UHFFFAOYSA-N 0 0 397.357 3.221 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)c1 ZINC000283569474 1435895975 /nfs/dbraw/zinc/89/59/75/1435895975.db2.gz VNNGAAAFGVBLGD-CQSZACIVSA-N 0 0 387.411 3.389 20 5 GGBDRN C[C@H]1Sc2ccc(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)cc2NC1=O ZINC000283570718 1435896038 /nfs/dbraw/zinc/89/60/38/1435896038.db2.gz KKMYXLTYJZZDKY-GFCCVEGCSA-N 0 0 385.445 3.342 20 5 GGBDRN C[C@@H]1Sc2ccc(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)cc2NC1=O ZINC000283570721 1435896095 /nfs/dbraw/zinc/89/60/95/1435896095.db2.gz KKMYXLTYJZZDKY-LBPRGKRZSA-N 0 0 385.445 3.342 20 5 GGBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000283641955 1435899159 /nfs/dbraw/zinc/89/91/59/1435899159.db2.gz XLENTWIEBDQXMO-KRWDZBQOSA-N 0 0 383.383 3.107 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)c1 ZINC000283679582 1435902727 /nfs/dbraw/zinc/90/27/27/1435902727.db2.gz VYUAFUUZYNFTQL-MRXNPFEDSA-N 0 0 383.404 3.143 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)c1[N+](=O)[O-] ZINC000283689885 1435904560 /nfs/dbraw/zinc/90/45/60/1435904560.db2.gz OTZOYPMUBFNVMT-UHFFFAOYSA-N 0 0 384.396 3.230 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000283697114 1435905846 /nfs/dbraw/zinc/90/58/46/1435905846.db2.gz VALLECWOONXCCX-UHFFFAOYSA-N 0 0 390.461 3.092 20 5 GGBDRN O=C(N[C@H]1CCC(=O)NC12CCC2)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000283711295 1435908833 /nfs/dbraw/zinc/90/88/33/1435908833.db2.gz UEKVGRAZIWMROA-KRWDZBQOSA-N 0 0 375.428 3.025 20 5 GGBDRN CCc1nc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)nn1-c1ccccc1 ZINC000283729565 1435912377 /nfs/dbraw/zinc/91/23/77/1435912377.db2.gz ZCQAQKIWHUHZQM-UHFFFAOYSA-N 0 0 379.420 3.053 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000283739929 1435913652 /nfs/dbraw/zinc/91/36/52/1435913652.db2.gz XJMZLTRZYLULBO-VQIMIIECSA-N 0 0 385.464 3.333 20 5 GGBDRN COc1ccccc1[C@H](C)S(=O)(=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283770080 1435920482 /nfs/dbraw/zinc/92/04/82/1435920482.db2.gz JDDUKRBCFOMAKZ-ZDUSSCGKSA-N 0 0 392.433 3.108 20 5 GGBDRN CCOc1ccccc1C[S@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283793892 1435924525 /nfs/dbraw/zinc/92/45/25/1435924525.db2.gz MSMUNGDDCRUOBM-AREMUKBSSA-N 0 0 376.434 3.271 20 5 GGBDRN COc1ccc(C)cc1C[S@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283821448 1435930809 /nfs/dbraw/zinc/93/08/09/1435930809.db2.gz PZFHOEXBLVGVNR-AREMUKBSSA-N 0 0 376.434 3.189 20 5 GGBDRN CCOc1cc(NC(=O)c2scnc2COC)c([N+](=O)[O-])cc1OCC ZINC000283826926 1435931236 /nfs/dbraw/zinc/93/12/36/1435931236.db2.gz KXZQTVIBGZIURF-UHFFFAOYSA-N 0 0 381.410 3.247 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3nncn3C(C)C)C2)c1 ZINC000283874960 1435941576 /nfs/dbraw/zinc/94/15/76/1435941576.db2.gz HYSVXHYXORFCLT-CQSZACIVSA-N 0 0 387.440 3.186 20 5 GGBDRN CO[C@@H](C)c1nc(C[S@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 ZINC000283899306 1435948069 /nfs/dbraw/zinc/94/80/69/1435948069.db2.gz UPEZDHVZRORJRB-KPHLJTLVSA-N 0 0 397.478 3.036 20 5 GGBDRN CO[C@@H](C)c1nc(C[S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 ZINC000283899310 1435948547 /nfs/dbraw/zinc/94/85/47/1435948547.db2.gz UPEZDHVZRORJRB-LJZMDLFKSA-N 0 0 397.478 3.036 20 5 GGBDRN CC(C)(C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)S(=O)(=O)C1CC1 ZINC000283970296 1435964247 /nfs/dbraw/zinc/96/42/47/1435964247.db2.gz MDWZTLFRIWFELI-UHFFFAOYSA-N 0 0 395.462 3.013 20 5 GGBDRN COc1cc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2F)cc(OC)c1OC ZINC000283984631 1435967303 /nfs/dbraw/zinc/96/73/03/1435967303.db2.gz MMLUEMZAELYLNX-UHFFFAOYSA-N 0 0 393.371 3.390 20 5 GGBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284067721 1435984580 /nfs/dbraw/zinc/98/45/80/1435984580.db2.gz KMRKCVCFJVQQRD-MZHQLVBMSA-N 0 0 377.422 3.433 20 5 GGBDRN COc1cc(N(C)C(=O)c2cc([N+](=O)[O-])cc(C)c2F)cc(OC)c1OC ZINC000284074221 1435985842 /nfs/dbraw/zinc/98/58/42/1435985842.db2.gz UQTQOPAPHUHWND-UHFFFAOYSA-N 0 0 378.356 3.345 20 5 GGBDRN Cc1cc(F)c(NC(=O)N2CCO[C@H](c3nnc(C(C)C)o3)C2)cc1[N+](=O)[O-] ZINC000284074520 1435985843 /nfs/dbraw/zinc/98/58/43/1435985843.db2.gz RBQNEIBJFRFISG-AWEZNQCLSA-N 0 0 393.375 3.154 20 5 GGBDRN Cc1nn(CCc2nc(-c3cc(OC(F)F)ccc3F)no2)c(C)c1[N+](=O)[O-] ZINC000284075623 1435985845 /nfs/dbraw/zinc/98/58/45/1435985845.db2.gz NGYLXNSWCRHMQG-UHFFFAOYSA-N 0 0 397.313 3.441 20 5 GGBDRN CCCc1[nH]nc(-c2nc(C(C)(C)NC(=O)OC(C)(C)C)no2)c1[N+](=O)[O-] ZINC000284085358 1435988352 /nfs/dbraw/zinc/98/83/52/1435988352.db2.gz VIIMJCTVNHIYLD-UHFFFAOYSA-N 0 0 380.405 3.080 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(CCNC(=O)OC(C)(C)C)no2)c1 ZINC000284126229 1435995564 /nfs/dbraw/zinc/99/55/64/1435995564.db2.gz XOHYJKLRWQRUJH-UHFFFAOYSA-N 0 0 378.385 3.111 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)c1nc(C2CCCCC2)no1 ZINC000284191246 1436002859 /nfs/dbraw/zinc/00/28/59/1436002859.db2.gz YYVPSABPPWKOFU-SECBINFHSA-N 0 0 377.376 3.238 20 5 GGBDRN COC(=O)c1sc(NC(=O)c2cc([N+](=O)[O-])cc(C)c2F)nc1C1CC1 ZINC000284209548 1436004319 /nfs/dbraw/zinc/00/43/19/1436004319.db2.gz MYTPYLMFZJZBQM-UHFFFAOYSA-N 0 0 379.369 3.415 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[C@@H](O)c2ccc(F)cc2)c1 ZINC000284225775 1436005322 /nfs/dbraw/zinc/00/53/22/1436005322.db2.gz BFSXIHFHYHVPSR-KZULUSFZSA-N 0 0 376.384 3.375 20 5 GGBDRN CC(C)(C(=O)OCc1ccc(S(C)(=O)=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000284261963 1436007984 /nfs/dbraw/zinc/00/79/84/1436007984.db2.gz WXPQIWUMGHFWDZ-UHFFFAOYSA-N 0 0 395.408 3.158 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1F ZINC000284259721 1436008031 /nfs/dbraw/zinc/00/80/31/1436008031.db2.gz QMPDFCYMLOODGO-QWHCGFSZSA-N 0 0 395.431 3.418 20 5 GGBDRN CCOC(=O)[C@H](C)NC(=O)c1ccc(NCc2cccc([N+](=O)[O-])c2)cc1F ZINC000284265905 1436008399 /nfs/dbraw/zinc/00/83/99/1436008399.db2.gz PLEOFDOAFBJEIY-LBPRGKRZSA-N 0 0 389.383 3.027 20 5 GGBDRN C[C@]12CCN(C(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)C[C@H]1C2(Cl)Cl ZINC000284300404 1436011214 /nfs/dbraw/zinc/01/12/14/1436011214.db2.gz ZZEZBUSDQRSDHB-ZBFHGGJFSA-N 0 0 395.246 3.436 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000284325328 1436013509 /nfs/dbraw/zinc/01/35/09/1436013509.db2.gz IHAWWDNAUPRHOV-FZKQIMNGSA-N 0 0 391.374 3.184 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)c1 ZINC000284366809 1436016396 /nfs/dbraw/zinc/01/63/96/1436016396.db2.gz KZXXECUVCRLXRH-IBGZPJMESA-N 0 0 388.420 3.244 20 5 GGBDRN C[C@@]1(C2CC2)NC(=O)N(c2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2)C1=O ZINC000284389998 1436018062 /nfs/dbraw/zinc/01/80/62/1436018062.db2.gz GRIVELXMHLHFGY-FQEVSTJZSA-N 0 0 394.387 3.072 20 5 GGBDRN C[C@]1(C2CC2)NC(=O)N(c2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2)C1=O ZINC000284390002 1436018148 /nfs/dbraw/zinc/01/81/48/1436018148.db2.gz GRIVELXMHLHFGY-HXUWFJFHSA-N 0 0 394.387 3.072 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H]2CCC(=O)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000284414287 1436019978 /nfs/dbraw/zinc/01/99/78/1436019978.db2.gz DVJFUFNVRQQCOE-MRXNPFEDSA-N 0 0 398.415 3.031 20 5 GGBDRN CCC[C@@H](Nc1cccc(C(=O)N(C)CC(N)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000284437095 1436021854 /nfs/dbraw/zinc/02/18/54/1436021854.db2.gz SLRHRXSRKRSAOX-GOSISDBHSA-N 0 0 384.436 3.105 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000284463237 1436023453 /nfs/dbraw/zinc/02/34/53/1436023453.db2.gz SAEHPXYBNIFBQG-ZDUSSCGKSA-N 0 0 385.424 3.009 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC2(CCOCC2)CC1 ZINC000284467452 1436023894 /nfs/dbraw/zinc/02/38/94/1436023894.db2.gz LTHCCSCWRGTHGW-UHFFFAOYSA-N 0 0 382.844 3.436 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000284514246 1436027407 /nfs/dbraw/zinc/02/74/07/1436027407.db2.gz VWCKOVOIWXHYOJ-PXAZEXFGSA-N 0 0 391.399 3.418 20 5 GGBDRN C[C@]12CCN(C(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)C[C@H]1C2(Cl)Cl ZINC000284536253 1436028885 /nfs/dbraw/zinc/02/88/85/1436028885.db2.gz PGEGLUPKRGLPQL-ZBFHGGJFSA-N 0 0 395.246 3.436 20 5 GGBDRN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000284560979 1436030412 /nfs/dbraw/zinc/03/04/12/1436030412.db2.gz YHJKRADXCBIUME-ZDUSSCGKSA-N 0 0 397.410 3.279 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)c1F ZINC000284561415 1436030501 /nfs/dbraw/zinc/03/05/01/1436030501.db2.gz FBODONQHNHXZFY-AWEZNQCLSA-N 0 0 386.383 3.079 20 5 GGBDRN Cc1nc2ccccc2n1C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000284560976 1436030578 /nfs/dbraw/zinc/03/05/78/1436030578.db2.gz YHJKRADXCBIUME-CYBMUJFWSA-N 0 0 397.410 3.279 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC2(CCOCC2)CC1 ZINC000284647172 1436036960 /nfs/dbraw/zinc/03/69/60/1436036960.db2.gz DYRGVIQYKJNILD-ZDUSSCGKSA-N 0 0 381.860 3.468 20 5 GGBDRN COCC1(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)CCC1 ZINC000284724424 1436043527 /nfs/dbraw/zinc/04/35/27/1436043527.db2.gz BECBTZGEQXFOFS-CQSZACIVSA-N 0 0 384.436 3.462 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1N[C@@H](C[NH+]1CCCCC1)c1ccccc1 ZINC000823630063 1441938944 /nfs/dbraw/zinc/93/89/44/1441938944.db2.gz QLWDDCURTRDDAX-SFHVURJKSA-N 0 0 393.451 3.414 20 5 GGBDRN 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376.844 3.097 20 5 GGBDRN O=C(CSc1cccc(Cl)c1-c1nn[nH]n1)c1ccc([N+](=O)[O-])cc1 ZINC000826421198 948267651 /nfs/dbraw/zinc/26/76/51/948267651.db2.gz WCJVQTDGAPSIBE-UHFFFAOYSA-N 0 0 375.797 3.403 20 5 GGBDRN CC(C)c1cccc2c1CCN(Cc1ccc(-c3nn[nH]n3)cc1[N+](=O)[O-])C2 ZINC001574420215 948793438 /nfs/dbraw/zinc/79/34/38/948793438.db2.gz QKKILVOPPWXSOD-UHFFFAOYSA-N 0 0 378.436 3.457 20 5 GGBDRN C[C@@H](c1cccc(-c2nn[nH]n2)c1)N(C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC001575502641 949028015 /nfs/dbraw/zinc/02/80/15/949028015.db2.gz HXEDUZNJSREKEN-LBPRGKRZSA-N 0 0 398.448 3.087 20 5 GGBDRN C[C@H](c1cccc(-c2nn[nH]n2)c1)N(C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC001575502638 949029827 /nfs/dbraw/zinc/02/98/27/949029827.db2.gz HXEDUZNJSREKEN-GFCCVEGCSA-N 0 0 398.448 3.087 20 5 GGBDRN C[C@H](c1cccc(-c2nn[nH]n2)c1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC001575514748 949177039 /nfs/dbraw/zinc/17/70/39/949177039.db2.gz YNWOZQRNHNXYIP-SNVBAGLBSA-N 0 0 386.799 3.262 20 5 GGBDRN C[C@@H](c1ccccc1)n1ccc(Nc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])n1 ZINC001575516305 949201776 /nfs/dbraw/zinc/20/17/76/949201776.db2.gz OHURRIRULQJHKR-LBPRGKRZSA-N 0 0 376.380 3.324 20 5 GGBDRN CC(C)(C)n1cc(-c2nn[nH]n2)cc1NC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001573887978 950853596 /nfs/dbraw/zinc/85/35/96/950853596.db2.gz MDGPJNFQJADOLF-GJZGRUSLSA-N 0 0 395.423 3.074 20 5 GGBDRN C[C@H]1CC(=O)c2c1c(F)ccc2OCc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001575937523 950952240 /nfs/dbraw/zinc/95/22/40/950952240.db2.gz FOLADRNAYZLHDE-VIFPVBQESA-N 0 0 383.339 3.183 20 5 GGBDRN C[C@@H](CNc1cc(F)c(-c2nn[nH]n2)cc1[N+](=O)[O-])COCc1ccccc1 ZINC001575125055 952038505 /nfs/dbraw/zinc/03/85/05/952038505.db2.gz WZCCPUCBHSCTJE-LBPRGKRZSA-N 0 0 386.387 3.179 20 5 GGBDRN C[N@H+](CCC(=O)[O-])[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC001593736885 954341976 /nfs/dbraw/zinc/34/19/76/954341976.db2.gz AOWGITSKWHNRJI-QGZVFWFLSA-N 0 0 391.811 3.335 20 5 GGBDRN 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O=C([O-])c1cnc(N2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c([N+](=O)[O-])c1 ZINC000560056545 974499157 /nfs/dbraw/zinc/49/91/57/974499157.db2.gz RPWZGQIXKLIKQU-UHFFFAOYSA-N 0 0 396.447 3.181 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NCC2([NH+]3CCSCC3)CCCCC2)c1 ZINC000563206232 974520394 /nfs/dbraw/zinc/52/03/94/974520394.db2.gz GULUYLANCQLNKE-UHFFFAOYSA-N 0 0 379.482 3.457 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[N@H+](CCCc3ccccc3)CC2)n1 ZINC000565423908 974581988 /nfs/dbraw/zinc/58/19/88/974581988.db2.gz TXOZBBRIQCNXCY-UHFFFAOYSA-N 0 0 398.463 3.141 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)n1 ZINC000566072399 974593673 /nfs/dbraw/zinc/59/36/73/974593673.db2.gz YSUQQQNVHXVEQS-AWEZNQCLSA-N 0 0 398.463 3.262 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@H]2CSCC[N@@H+]2Cc2ccccc2)c1 ZINC000567113927 974627159 /nfs/dbraw/zinc/62/71/59/974627159.db2.gz YHXBRGOINNULCY-INIZCTEOSA-N 0 0 387.461 3.323 20 5 GGBDRN Cc1cc(N2C[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000567474878 974634998 /nfs/dbraw/zinc/63/49/98/974634998.db2.gz VEEWJKQGBHDNLU-CALCHBBNSA-N 0 0 381.432 3.170 20 5 GGBDRN CSc1ccc([C@H](CNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000568516930 974672396 /nfs/dbraw/zinc/67/23/96/974672396.db2.gz TXIIEJXSEDXRFR-HNNXBMFYSA-N 0 0 376.438 3.125 20 5 GGBDRN O=C([O-])c1ccnc(N2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1[N+](=O)[O-] ZINC000569248201 974687632 /nfs/dbraw/zinc/68/76/32/974687632.db2.gz IWMLTDQFHURLLK-UHFFFAOYSA-N 0 0 396.447 3.181 20 5 GGBDRN O=C([O-])Cc1ccc(NC2CC[NH+](CCc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000569608251 974695580 /nfs/dbraw/zinc/69/55/80/974695580.db2.gz HALCFSAJKBYLFG-UHFFFAOYSA-N 0 0 383.448 3.341 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC2CCC([NH+]3CCC(C)CC3)CC2)n1 ZINC000569929951 974701123 /nfs/dbraw/zinc/70/11/23/974701123.db2.gz AFQMZPLTCPYMCA-UHFFFAOYSA-N 0 0 376.457 3.451 20 5 GGBDRN C[C@@H]1CN(Cc2cccc(CNc3ccc(CC(=O)[O-])cc3[N+](=O)[O-])c2)CCO1 ZINC000570166581 974705935 /nfs/dbraw/zinc/70/59/35/974705935.db2.gz SFWXGJMCNDCWHR-OAHLLOKOSA-N 0 0 399.447 3.055 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1CCC1CCN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000570686078 974716464 /nfs/dbraw/zinc/71/64/64/974716464.db2.gz IMUBSASAOHPNSI-AWEZNQCLSA-N 0 0 376.457 3.169 20 5 GGBDRN Cc1cc(NCC2(C[NH+]3CCOCC3)CCCCC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000572003303 974739966 /nfs/dbraw/zinc/73/99/66/974739966.db2.gz MZQDRWMHRUUERU-UHFFFAOYSA-N 0 0 391.468 3.296 20 5 GGBDRN O=C([O-])c1ccnc(N2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000575062449 974794448 /nfs/dbraw/zinc/79/44/48/974794448.db2.gz MMXRGKBMGLPLIQ-AEFFLSMTSA-N 0 0 396.447 3.179 20 5 GGBDRN O=C([O-])c1ccnc(N2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000575062451 974794890 /nfs/dbraw/zinc/79/48/90/974794890.db2.gz MMXRGKBMGLPLIQ-SJLPKXTDSA-N 0 0 396.447 3.179 20 5 GGBDRN O=C([O-])c1cnc(N2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c([N+](=O)[O-])c1 ZINC000575319611 974798346 /nfs/dbraw/zinc/79/83/46/974798346.db2.gz YQHDEGFSLJILIJ-UHFFFAOYSA-N 0 0 396.447 3.181 20 5 GGBDRN C[C@H]1C[C@@H](CCNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000577183281 974830113 /nfs/dbraw/zinc/83/01/13/974830113.db2.gz WZWMWLLRJYZWOM-GOEBONIOSA-N 0 0 384.436 3.401 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccccc2C[NH+]2CCCCC2)n1 ZINC000579359907 974873722 /nfs/dbraw/zinc/87/37/22/974873722.db2.gz WUMFSQZBQHONJX-UHFFFAOYSA-N 0 0 384.436 3.016 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC2CC[NH+](CCc3ccccc3)CC2)n1 ZINC000579359245 974873825 /nfs/dbraw/zinc/87/38/25/974873825.db2.gz IXIDFXDBKPTJRO-UHFFFAOYSA-N 0 0 384.436 3.115 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(N2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)n1 ZINC000580515168 974894660 /nfs/dbraw/zinc/89/46/60/974894660.db2.gz MJIMIECNAZUBIB-UHFFFAOYSA-N 0 0 396.447 3.181 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[C@H](C[NH+]3CCCCCC3)C2)n1 ZINC000580569620 974896532 /nfs/dbraw/zinc/89/65/32/974896532.db2.gz YAYZCHFVRINXOR-OAHLLOKOSA-N 0 0 376.457 3.089 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)n1 ZINC000582788359 974931073 /nfs/dbraw/zinc/93/10/73/974931073.db2.gz HCWUJFWDKXISGZ-GOEBONIOSA-N 0 0 384.436 3.461 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)n1 ZINC000582788363 974931120 /nfs/dbraw/zinc/93/11/20/974931120.db2.gz HCWUJFWDKXISGZ-ZBFHGGJFSA-N 0 0 384.436 3.461 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)n1 ZINC000582788356 974931327 /nfs/dbraw/zinc/93/13/27/974931327.db2.gz HCWUJFWDKXISGZ-GDBMZVCRSA-N 0 0 384.436 3.461 20 5 GGBDRN O=C([O-])c1ccnc(N[C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1[N+](=O)[O-] ZINC000592976946 974978511 /nfs/dbraw/zinc/97/85/11/974978511.db2.gz IMXBGDWGWCBQMH-RYQLBKOJSA-N 0 0 396.447 3.401 20 5 GGBDRN O=C([O-])c1cnc(N[C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c([N+](=O)[O-])c1 ZINC000592976831 974978660 /nfs/dbraw/zinc/97/86/60/974978660.db2.gz AWBLNPIWUHULJS-CGTJXYLNSA-N 0 0 396.447 3.401 20 5 GGBDRN CCO[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC000592980252 974979625 /nfs/dbraw/zinc/97/96/25/974979625.db2.gz XNWVNUQJCWBVIV-YLJYHZDGSA-N 0 0 399.447 3.242 20 5 GGBDRN CC(C)OC(=O)c1ccc(C[NH2+][C@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1 ZINC001591686057 975490078 /nfs/dbraw/zinc/49/00/78/975490078.db2.gz WVXNREAZMFIUQJ-FQEVSTJZSA-N 0 0 386.404 3.250 20 5 GGBDRN CC(C)n1ncc2c1[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)CCC2 ZINC001592158488 977037802 /nfs/dbraw/zinc/03/78/02/977037802.db2.gz PVFPODLJIDAGEO-HNNXBMFYSA-N 0 0 388.424 3.003 20 5 GGBDRN C[C@@](CC(=O)[O-])([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1cccnc1 ZINC001592328623 977749118 /nfs/dbraw/zinc/74/91/18/977749118.db2.gz NJEZLFCWAAUAGM-INIZCTEOSA-N 0 0 394.225 3.232 20 5 GGBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2cc(C(=O)[O-])ccc2NC1=O ZINC001592546649 978433648 /nfs/dbraw/zinc/43/36/48/978433648.db2.gz VXYLABOOTQBUKU-SCLBCKFNSA-N 0 0 397.431 3.157 20 5 GGBDRN O=C([O-])c1ccccc1C(=O)c1ccc(NCC[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000740239773 978673146 /nfs/dbraw/zinc/67/31/46/978673146.db2.gz KYQUPYDYDREWHD-UHFFFAOYSA-N 0 0 397.431 3.422 20 5 GGBDRN O=C([O-])[C@@H]1CCC[N@@H+]1Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000833772435 979240444 /nfs/dbraw/zinc/24/04/44/979240444.db2.gz LWIQBGWDODFANK-IBGZPJMESA-N 0 0 392.415 3.497 20 5 GGBDRN CC1CC[NH+](C[C@H]2CCCN(c3ccc(CC(=O)[O-])cc3[N+](=O)[O-])C2)CC1 ZINC000844207323 979355718 /nfs/dbraw/zinc/35/57/18/979355718.db2.gz HKAIPPOVRYVJSY-QGZVFWFLSA-N 0 0 375.469 3.170 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2ccc(CC(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000844207198 979355981 /nfs/dbraw/zinc/35/59/81/979355981.db2.gz CBFRXJLHVMAJHE-DOTOQJQBSA-N 0 0 375.469 3.313 20 5 GGBDRN CN(CCC1CCN(c2cc[nH+]cc2)CC1)c1ccc(CC(=O)[O-])cc1[N+](=O)[O-] ZINC000844211726 979367183 /nfs/dbraw/zinc/36/71/83/979367183.db2.gz HGZPTWJDBBSBEQ-UHFFFAOYSA-N 0 0 398.463 3.360 20 5 GGBDRN C[C@H]1CCN(c2ccc(CC(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000844212076 979367885 /nfs/dbraw/zinc/36/78/85/979367885.db2.gz QIUJLJLUIMTZPG-INIZCTEOSA-N 0 0 383.448 3.323 20 5 GGBDRN O=C([O-])/C=C\c1ccc(NCC2CCN(c3cc[nH+]cc3)CC2)c([N+](=O)[O-])c1 ZINC000844212071 979368139 /nfs/dbraw/zinc/36/81/39/979368139.db2.gz QFPWCULFUHMKSA-RQOWECAXSA-N 0 0 382.420 3.416 20 5 GGBDRN C[C@@](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)(C(=O)[O-])c1ccccc1 ZINC000844938609 979403053 /nfs/dbraw/zinc/40/30/53/979403053.db2.gz JYLAUOJXIILFSJ-NRFANRHFSA-N 0 0 383.448 3.196 20 5 GGBDRN O=C([O-])CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCOCC1 ZINC000846273145 979438622 /nfs/dbraw/zinc/43/86/22/979438622.db2.gz CCSORAXMIYGHTE-UHFFFAOYSA-N 0 0 376.331 3.069 20 5 GGBDRN CCC(CC)[C@@H](CNc1ccc(/C=C\C(=O)[O-])cc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000859994126 979654322 /nfs/dbraw/zinc/65/43/22/979654322.db2.gz RURZNHDEHGJNGS-MONCILHSSA-N 0 0 391.468 3.242 20 5 GGBDRN CCC(CC)[C@H](CNc1ccc(/C=C\C(=O)[O-])cc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000859994127 979654496 /nfs/dbraw/zinc/65/44/96/979654496.db2.gz RURZNHDEHGJNGS-QJSCKGPTSA-N 0 0 391.468 3.242 20 5 GGBDRN O=C([O-])c1ccnc(N2CCC(c3ccccc3)([NH+]3CCCC3)CC2)c1[N+](=O)[O-] ZINC000910336860 981877635 /nfs/dbraw/zinc/87/76/35/981877635.db2.gz UZHZLJPTVDRDIP-UHFFFAOYSA-N 0 0 396.447 3.280 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[N@H+](CC3CCCCC3)CC2)n1 ZINC000910343772 981881438 /nfs/dbraw/zinc/88/14/38/981881438.db2.gz GPUQVXKDPPRBLG-UHFFFAOYSA-N 0 0 376.457 3.089 20 5 GGBDRN CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1nc(C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000910373796 981902541 /nfs/dbraw/zinc/90/25/41/981902541.db2.gz JLQRIDXAUGTUBJ-KRWDZBQOSA-N 0 0 398.463 3.345 20 5 GGBDRN Cc1ccc(C[N@H+]2CC[C@H](CN(C)c3nccc(C(=O)[O-])c3[N+](=O)[O-])C2)s1 ZINC000910378199 981903577 /nfs/dbraw/zinc/90/35/77/981903577.db2.gz JTAWWIZFIOZQCA-CYBMUJFWSA-N 0 0 390.465 3.016 20 5 GGBDRN CCC[N@H+](Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC001595899824 982949487 /nfs/dbraw/zinc/94/94/87/982949487.db2.gz NWOPZCDCDYBODP-GDIGMMSISA-N 0 0 392.452 3.084 20 5 GGBDRN CCC[N@H+](Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC001595899827 982949590 /nfs/dbraw/zinc/94/95/90/982949590.db2.gz NWOPZCDCDYBODP-ZMYBRWDISA-N 0 0 392.452 3.084 20 5 GGBDRN CC[NH+](CC)CCN(CC(C)C)C(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C ZINC001596266064 983685284 /nfs/dbraw/zinc/68/52/84/983685284.db2.gz YHTNWUDCAKJNSR-UHFFFAOYSA-N 0 0 394.472 3.433 20 5 GGBDRN CC[NH+](CC)Cc1ccc(C(=O)N[C@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1 ZINC001596275817 983694863 /nfs/dbraw/zinc/69/48/63/983694863.db2.gz OKCXUAGABOOSMR-NRFANRHFSA-N 0 0 399.447 3.166 20 5 GGBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCc2cc(C(=O)[O-])ccc2NC1=O ZINC001589002307 984947197 /nfs/dbraw/zinc/94/71/97/984947197.db2.gz PGAUHVFKNXIJBK-RKWFYDHTSA-N 0 0 395.415 3.239 20 5 GGBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCc2cc(C(=O)[O-])ccc2NC1=O ZINC001589002302 984947389 /nfs/dbraw/zinc/94/73/89/984947389.db2.gz PGAUHVFKNXIJBK-CWIMXHLESA-N 0 0 395.415 3.239 20 5 GGBDRN CCO[C@@H]1C[C@@]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)(C(=O)[O-])C1(C)C ZINC001596836951 985489104 /nfs/dbraw/zinc/48/91/04/985489104.db2.gz GSUPAWTXFZEVPB-VQIMIIECSA-N 0 0 380.441 3.130 20 5 GGBDRN C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594487692 985577343 /nfs/dbraw/zinc/57/73/43/985577343.db2.gz UTDLEQFVNDREQU-SWLSCSKDSA-N 0 0 393.440 3.028 20 5 GGBDRN C[C@H]1CN(c2ccc(C(=O)[O-])cc2)CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001594569331 986379698 /nfs/dbraw/zinc/37/96/98/986379698.db2.gz LUBCKEDVKQICNA-INIZCTEOSA-N 0 0 399.447 3.273 20 5 GGBDRN CSc1cc(C)ccc1C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001599808395 988293009 /nfs/dbraw/zinc/29/30/09/988293009.db2.gz GIMBBIBEYKXVRP-UHFFFAOYSA-N 0 0 376.434 3.378 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H]1C[N@H+](Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C[C@H]1C1CC1 ZINC001590339090 989775631 /nfs/dbraw/zinc/77/56/31/989775631.db2.gz BZSBJZSCMFXGLL-JKSUJKDBSA-N 0 0 390.436 3.093 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001598066352 990350096 /nfs/dbraw/zinc/35/00/96/990350096.db2.gz ISXYXNZQZFJFPZ-OAHLLOKOSA-N 0 0 393.440 3.124 20 5 GGBDRN CC(C)(CC[NH+]1CCCCCC1)NCc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001590670646 990373030 /nfs/dbraw/zinc/37/30/30/990373030.db2.gz DRAHVICFJBRECN-UHFFFAOYSA-N 0 0 393.484 3.193 20 5 GGBDRN CC(C)(CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1)C(=O)[O-] ZINC001590671113 990380139 /nfs/dbraw/zinc/38/01/39/990380139.db2.gz OSDMRFPIEQYOQC-UHFFFAOYSA-N 0 0 389.374 3.237 20 5 GGBDRN C[NH+](C)CC1CCN(c2ccc(Nc3nc(C(=O)[O-])ccc3[N+](=O)[O-])cc2)CC1 ZINC001598210452 990848453 /nfs/dbraw/zinc/84/84/53/990848453.db2.gz CLLRVWLWUONIPV-UHFFFAOYSA-N 0 0 399.451 3.210 20 5 GGBDRN CC(C)C1(c2ccccc2)C[NH+](Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)C1 ZINC001591067597 991513874 /nfs/dbraw/zinc/51/38/74/991513874.db2.gz FZQGVBBPBSPQJW-UHFFFAOYSA-N 0 0 384.432 3.468 20 5 GGBDRN C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H](COC1CCC1)C(=O)[O-] ZINC001598508357 992534156 /nfs/dbraw/zinc/53/41/56/992534156.db2.gz DAWMRTLNMVTSAK-CQSZACIVSA-N 0 0 376.331 3.068 20 5 GGBDRN CN(c1ccccc1)c1ccc(C[NH2+][C@@]2(CC(=O)[O-])CCOC2)cc1[N+](=O)[O-] ZINC001598545039 992936237 /nfs/dbraw/zinc/93/62/37/992936237.db2.gz LYTXUXDALSPXDX-HXUWFJFHSA-N 0 0 385.420 3.086 20 5 GGBDRN C[N@@H+]1CCC[C@H](CNc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])C1 ZINC001598591871 993445821 /nfs/dbraw/zinc/44/58/21/993445821.db2.gz DYQPDIKCPBKQTB-CQSZACIVSA-N 0 0 397.431 3.278 20 5 GGBDRN COc1ccc(SCC[NH2+][C@@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1 ZINC001599619375 994059792 /nfs/dbraw/zinc/05/97/92/994059792.db2.gz MMLHZDUQEGYLHX-GOSISDBHSA-N 0 0 376.434 3.285 20 5 GGBDRN COc1cccc([C@H](C(=O)[O-])[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001599649432 994473632 /nfs/dbraw/zinc/47/36/32/994473632.db2.gz FQJQQMHCVAXSKD-LJQANCHMSA-N 0 0 386.404 3.273 20 5 GGBDRN C[C@@]([NH2+]CCOc1ccc(F)cc1Cl)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593271708 994606592 /nfs/dbraw/zinc/60/65/92/994606592.db2.gz LRSAJYIXRYRKJG-KRWDZBQOSA-N 0 0 382.775 3.356 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccccc1-n1cccn1 ZINC001593298050 994709217 /nfs/dbraw/zinc/70/92/17/994709217.db2.gz CXTYCDQSZNYBTF-AWEZNQCLSA-N 0 0 396.403 3.095 20 5 GGBDRN C[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1cc(F)ccc1N(C)C ZINC001593298239 994710891 /nfs/dbraw/zinc/71/08/91/994710891.db2.gz GIMGOYZYRUYVEJ-GFCCVEGCSA-N 0 0 391.399 3.114 20 5 GGBDRN C[C@@]([NH2+]Cc1ccc(OCC(F)(F)F)nc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593298853 994718291 /nfs/dbraw/zinc/71/82/91/994718291.db2.gz NXWLQRPINNRNGD-INIZCTEOSA-N 0 0 399.325 3.021 20 5 GGBDRN C[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC001593299299 994721874 /nfs/dbraw/zinc/72/18/74/994721874.db2.gz RCIGNLSPXYKKIT-CYBMUJFWSA-N 0 0 386.404 3.234 20 5 GGBDRN C[C@@]([NH2+]Cc1ccc2c(c1)OC(F)(F)O2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593304713 994752202 /nfs/dbraw/zinc/75/22/02/994752202.db2.gz PYJIUTRHYXKRQH-INIZCTEOSA-N 0 0 380.303 3.006 20 5 GGBDRN C[C@]([NH2+]Cc1ccnn1CCc1ccccc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593311768 994786996 /nfs/dbraw/zinc/78/69/96/994786996.db2.gz UIIQGJVSISMJSA-OAQYLSRUSA-N 0 0 394.431 3.124 20 5 GGBDRN C[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](Cc1ccccc1)C(=O)[O-] ZINC001593312191 994795637 /nfs/dbraw/zinc/79/56/37/994795637.db2.gz PXOHRBMBAXJBOV-CXAGYDPISA-N 0 0 396.403 3.066 20 5 GGBDRN CC1(C)CCC[C@@]([NH2+]CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)(C(=O)[O-])C1 ZINC001593895075 996748848 /nfs/dbraw/zinc/74/88/48/996748848.db2.gz IUVNMWCLDFFTKL-KRWDZBQOSA-N 0 0 383.832 3.200 20 5 GGBDRN COc1ccc(C[N@@H+]2CC[C@@H]2CNc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC001599561048 998195534 /nfs/dbraw/zinc/19/55/34/998195534.db2.gz CCTIWQWTKHXNRV-HFTQHKIXSA-N 0 0 397.431 3.388 20 5 GGBDRN COc1ccc(-c2ccc(C[N@@H+]3CCSC[C@@H]3CC(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC001599468281 998402723 /nfs/dbraw/zinc/40/27/23/998402723.db2.gz JZEONGVTMGZTSW-LBPRGKRZSA-N 0 0 392.433 3.256 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@]2(C(=O)[O-])CC[C@@H](C)c3ccccc32)c1 ZINC001598989059 998719824 /nfs/dbraw/zinc/71/98/24/998719824.db2.gz ZEOCASFPWHQBDU-ASSNKEHSSA-N 0 0 398.415 3.348 20 5 GGBDRN CO[C@@H](C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC001599054544 999220210 /nfs/dbraw/zinc/22/02/10/999220210.db2.gz TYJFGFHAWILDOY-KRWDZBQOSA-N 0 0 394.811 3.189 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@@H+]2Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001594329262 999264676 /nfs/dbraw/zinc/26/46/76/999264676.db2.gz VKUNVWCLDDKJSL-AZFSHXRASA-N 0 0 376.453 3.445 20 5 GGBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001599064270 999288210 /nfs/dbraw/zinc/28/82/10/999288210.db2.gz VNWSCTZULKGNJO-HXPMCKFVSA-N 0 0 392.383 3.063 20 5 GGBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001599064268 999288358 /nfs/dbraw/zinc/28/83/58/999288358.db2.gz VNWSCTZULKGNJO-BUXKBTBVSA-N 0 0 392.383 3.063 20 5 GGBDRN COCc1cccc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])c1 ZINC000277400857 1126078764 /nfs/dbraw/zinc/07/87/64/1126078764.db2.gz RWNZXPWRXBEDQW-LJQANCHMSA-N 0 0 383.404 3.008 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cnc(C2CCCC2)s1 ZINC000417590610 1126080985 /nfs/dbraw/zinc/08/09/85/1126080985.db2.gz XEHCOPHPXNOJAQ-INIZCTEOSA-N 0 0 375.450 3.494 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000426722485 1126082416 /nfs/dbraw/zinc/08/24/16/1126082416.db2.gz HOYFTVWFUJSOHG-LJQANCHMSA-N 0 0 396.378 3.482 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(-c2cccnc2)c1 ZINC000426783766 1126090253 /nfs/dbraw/zinc/09/02/53/1126090253.db2.gz NOABECPSSPGIRW-FQEVSTJZSA-N 0 0 377.400 3.442 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(-c2ccncc2)c1 ZINC000426783683 1126090259 /nfs/dbraw/zinc/09/02/59/1126090259.db2.gz MZBFIVBBKPSSAO-FQEVSTJZSA-N 0 0 377.400 3.442 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(-c2ccccn2)c1 ZINC000426792135 1126090628 /nfs/dbraw/zinc/09/06/28/1126090628.db2.gz IEYDGUTVHYLTMD-FQEVSTJZSA-N 0 0 377.400 3.442 20 5 GGBDRN Cc1ccc(-c2ncc(C[NH2+][C@@H](Cc3ccc([N+](=O)[O-])cc3)C(=O)[O-])s2)o1 ZINC000426793009 1126090903 /nfs/dbraw/zinc/09/09/03/1126090903.db2.gz LRRKCRGDPAUQTJ-HNNXBMFYSA-N 0 0 387.417 3.405 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc2cc[nH]c21 ZINC000426740912 1126085638 /nfs/dbraw/zinc/08/56/38/1126085638.db2.gz JDRVZQHSGGNKRD-GOSISDBHSA-N 0 0 378.388 3.343 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc2cccnc21 ZINC000426742453 1126085862 /nfs/dbraw/zinc/08/58/62/1126085862.db2.gz JZGWRVANLHLHQH-LJQANCHMSA-N 0 0 390.399 3.410 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(OC(F)(F)F)cc1 ZINC000426797564 1126091010 /nfs/dbraw/zinc/09/10/10/1126091010.db2.gz GBURDOLVYYJDFQ-HNNXBMFYSA-N 0 0 384.310 3.279 20 5 GGBDRN COc1cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])cc(Cl)c1OC ZINC000426814302 1126092103 /nfs/dbraw/zinc/09/21/03/1126092103.db2.gz FAFJIFIGWWEMSP-AWEZNQCLSA-N 0 0 394.811 3.051 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC000426812803 1126092181 /nfs/dbraw/zinc/09/21/81/1126092181.db2.gz SALMAFPJQDPWBK-ZDUSSCGKSA-N 0 0 384.310 3.121 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(OCC(F)(F)F)cc1 ZINC000426817414 1126092406 /nfs/dbraw/zinc/09/24/06/1126092406.db2.gz SKRNHDOYEQOPQA-HNNXBMFYSA-N 0 0 398.337 3.321 20 5 GGBDRN COCc1csc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])c1 ZINC001330125107 1126175051 /nfs/dbraw/zinc/17/50/51/1126175051.db2.gz ZMUIFQOLZZDGQS-QGZVFWFLSA-N 0 0 389.433 3.070 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001339010181 1126180801 /nfs/dbraw/zinc/18/08/01/1126180801.db2.gz FRDCQMHHUKNXND-QGZVFWFLSA-N 0 0 399.428 3.209 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1Br ZINC001601659366 1126224158 /nfs/dbraw/zinc/22/41/58/1126224158.db2.gz HWXSNMUZCXPBNN-ZDUSSCGKSA-N 0 0 379.210 3.143 20 5 GGBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000007810735 209132545 /nfs/dbraw/zinc/13/25/45/209132545.db2.gz WMOCLDPNOBOMKM-UHFFFAOYSA-N 0 0 386.795 3.147 20 5 GGBDRN Cc1cc(C(C)(C)C)cc(C)c1CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000007020450 209130633 /nfs/dbraw/zinc/13/06/33/209130633.db2.gz SULQLYYSBQCYKG-UHFFFAOYSA-N 0 0 385.464 3.030 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000007651419 209130252 /nfs/dbraw/zinc/13/02/52/209130252.db2.gz CDPZYZMGBLTXRM-UHFFFAOYSA-N 0 0 391.449 3.184 20 5 GGBDRN CCN(CC)S(=O)(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000006286011 209126946 /nfs/dbraw/zinc/12/69/46/209126946.db2.gz FXKSTBASGRNXDL-UHFFFAOYSA-N 0 0 391.449 3.186 20 5 GGBDRN CCNC(=O)NC(=O)[C@@H](C)Sc1nc2ccccc2c2nc3ccccc3n21 ZINC000004246564 209120524 /nfs/dbraw/zinc/12/05/24/209120524.db2.gz FGONDUBKWSISFE-GFCCVEGCSA-N 0 0 393.472 3.362 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)cc1 ZINC000003481120 209119308 /nfs/dbraw/zinc/11/93/08/209119308.db2.gz CVHSVNRJLFLBFI-UHFFFAOYSA-N 0 0 392.209 3.116 20 5 GGBDRN O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1cc(Cl)cc(Cl)c1 ZINC000004434183 209121328 /nfs/dbraw/zinc/12/13/28/209121328.db2.gz OMUWWULVXYADKG-UHFFFAOYSA-N 0 0 394.170 3.136 20 5 GGBDRN Cc1cc(C)n2nc(SCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])nc2n1 ZINC000004523883 209121289 /nfs/dbraw/zinc/12/12/89/209121289.db2.gz PYVPQWXEWJBMPC-UHFFFAOYSA-N 0 0 392.828 3.034 20 5 GGBDRN O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1ccc(Cl)cc1Cl ZINC000003598676 209118012 /nfs/dbraw/zinc/11/80/12/209118012.db2.gz VFICYHFOPZZMKU-UHFFFAOYSA-N 0 0 394.170 3.136 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000003547608 209117444 /nfs/dbraw/zinc/11/74/44/209117444.db2.gz VAJIDTKBQVFOST-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000229512929 206260515 /nfs/dbraw/zinc/26/05/15/206260515.db2.gz IYKIKJKJAKNLOC-IEBWSBKVSA-N 0 0 392.839 3.061 20 5 GGBDRN CC(C)(C(=O)N1CCC[C@H](N2CCCCC2=O)C1)c1ccc([N+](=O)[O-])cc1F ZINC000359871134 206265437 /nfs/dbraw/zinc/26/54/37/206265437.db2.gz MODRUKDZFIVKBT-HNNXBMFYSA-N 0 0 391.443 3.015 20 5 GGBDRN COc1cc(CN2CCOC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000359865323 206265933 /nfs/dbraw/zinc/26/59/33/206265933.db2.gz DJWHOBXLGYEZMK-NSHDSACASA-N 0 0 378.347 3.013 20 5 GGBDRN Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000359879212 206266919 /nfs/dbraw/zinc/26/69/19/206266919.db2.gz ZWBZAHMNGOBKID-OLZOCXBDSA-N 0 0 382.342 3.413 20 5 GGBDRN Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000359879229 206266984 /nfs/dbraw/zinc/26/69/84/206266984.db2.gz ZWBZAHMNGOBKID-STQMWFEESA-N 0 0 382.342 3.413 20 5 GGBDRN Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000359879216 206268051 /nfs/dbraw/zinc/26/80/51/206268051.db2.gz ZWBZAHMNGOBKID-QWHCGFSZSA-N 0 0 382.342 3.413 20 5 GGBDRN Cc1ccc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000359928500 206269995 /nfs/dbraw/zinc/26/99/95/206269995.db2.gz UEEVQMVDGZQCSZ-GOSISDBHSA-N 0 0 388.445 3.284 20 5 GGBDRN 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WEAPNSFPBLYCRO-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN CN(CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(Br)cc1 ZINC000006637914 564226294 /nfs/dbraw/zinc/22/62/94/564226294.db2.gz HNKSWGFFZAKWQN-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN CC(=O)N(c1nc(Cn2cnc([N+](=O)[O-])n2)cs1)c1cccc(Cl)c1 ZINC000117463727 564227508 /nfs/dbraw/zinc/22/75/08/564227508.db2.gz RHIQSCLMPXFJED-UHFFFAOYSA-N 0 0 378.801 3.029 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCN(c2ccc(O)cc2)CC1 ZINC000007270090 564235387 /nfs/dbraw/zinc/23/53/87/564235387.db2.gz XYPINYZNUIKHPV-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN CC(=O)Nc1cccc(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1 ZINC000007417674 564237435 /nfs/dbraw/zinc/23/74/35/564237435.db2.gz DNEHEWYWSGBETA-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN COc1ccc(CCNS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cc1 ZINC000007667805 564239043 /nfs/dbraw/zinc/23/90/43/564239043.db2.gz MVWJEYQGDXTKKM-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccsc1 ZINC000118678651 564244084 /nfs/dbraw/zinc/24/40/84/564244084.db2.gz WESQHWUKHJQTTH-AWEZNQCLSA-N 0 0 379.463 3.147 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccsc1 ZINC000118678653 564244125 /nfs/dbraw/zinc/24/41/25/564244125.db2.gz WESQHWUKHJQTTH-CQSZACIVSA-N 0 0 379.463 3.147 20 5 GGBDRN Cc1cccc(N(C)C(=O)c2ccc([N+](=O)[O-])cc2I)n1 ZINC000118666566 564244391 /nfs/dbraw/zinc/24/43/91/564244391.db2.gz XGMJERGJJMLLFF-UHFFFAOYSA-N 0 0 397.172 3.179 20 5 GGBDRN CN(Cc1ccc(Cl)c(Cl)c1)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000008052528 564244707 /nfs/dbraw/zinc/24/47/07/564244707.db2.gz XYBPYGMFULGDEF-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2sccc2Br)cc([N+](=O)[O-])c1 ZINC000118723349 564245295 /nfs/dbraw/zinc/24/52/95/564245295.db2.gz ZNRSJGBHKVMGIJ-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccccc2Br)cc([N+](=O)[O-])c1 ZINC000118723582 564245305 /nfs/dbraw/zinc/24/53/05/564245305.db2.gz DBAYEGKLKBNQLR-UHFFFAOYSA-N 0 0 379.166 3.396 20 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Cc1cnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)nc1 ZINC000119330044 564265605 /nfs/dbraw/zinc/26/56/05/564265605.db2.gz NWJQYSVAWHEDTM-UHFFFAOYSA-N 0 0 383.227 3.187 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1Cl ZINC000119339948 564266016 /nfs/dbraw/zinc/26/60/16/564266016.db2.gz FJSGLQIWARVWQA-UHFFFAOYSA-N 0 0 376.843 3.452 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)c1ccccc1Br)CC2 ZINC000119418239 564269838 /nfs/dbraw/zinc/26/98/38/564269838.db2.gz HUFHWTKXRFEKEV-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119418350 564270027 /nfs/dbraw/zinc/27/00/27/564270027.db2.gz PJWDQVWIQDOUKC-LLVKDONJSA-N 0 0 383.857 3.089 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)c1cccc(Br)c1)CC2 ZINC000119434639 564271045 /nfs/dbraw/zinc/27/10/45/564271045.db2.gz YVUAWGKORVYEPQ-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN Cc1cccc(OCCN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000119519618 564275500 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O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1Br ZINC000015139289 564284502 /nfs/dbraw/zinc/28/45/02/564284502.db2.gz FOINYVAFODXXCC-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN O=C(Cn1nccc1[N+](=O)[O-])Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000119714671 564284859 /nfs/dbraw/zinc/28/48/59/564284859.db2.gz QMEWDGCQAFDADG-UHFFFAOYSA-N 0 0 393.119 3.211 20 5 GGBDRN Cn1nccc1NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000119710951 564284965 /nfs/dbraw/zinc/28/49/65/564284965.db2.gz YHHROAXDXSLYNL-UHFFFAOYSA-N 0 0 381.179 3.073 20 5 GGBDRN CCN(C(=O)c1ccc(OC)c([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000119714651 564285160 /nfs/dbraw/zinc/28/51/60/564285160.db2.gz AJSRMBTTZFZWBP-UHFFFAOYSA-N 0 0 380.198 3.428 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000119731660 564286142 /nfs/dbraw/zinc/28/61/42/564286142.db2.gz BTBSPYNLZYYEHE-AOOOYVTPSA-N 0 0 388.205 3.318 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)CCOc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000015362156 564286268 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CCCNc1nnc(SCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000017885963 564299018 /nfs/dbraw/zinc/29/90/18/564299018.db2.gz SAMABPNFOSOUNQ-UHFFFAOYSA-N 0 0 383.455 3.008 20 5 GGBDRN NC(=O)CSc1nnc(Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000018057502 564300145 /nfs/dbraw/zinc/30/01/45/564300145.db2.gz PCXQQXCUYCTGKH-UHFFFAOYSA-N 0 0 396.397 3.194 20 5 GGBDRN CCOC(=O)CN(CC(C)C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000120026445 564301247 /nfs/dbraw/zinc/30/12/47/564301247.db2.gz ISULIILJIFODQV-UHFFFAOYSA-N 0 0 387.230 3.019 20 5 GGBDRN Cc1nc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)ccc1I ZINC000019945154 564304519 /nfs/dbraw/zinc/30/45/19/564304519.db2.gz MGBGIWWAJTZAMZ-UHFFFAOYSA-N 0 0 397.172 3.084 20 5 GGBDRN O=C(c1ccc(Cl)c(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000019994424 564305491 /nfs/dbraw/zinc/30/54/91/564305491.db2.gz QWSJNJTWBUDBAK-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(F)cc2Br)cc1 ZINC000020430707 564306454 /nfs/dbraw/zinc/30/64/54/564306454.db2.gz 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ZINC000120463735 564320569 /nfs/dbraw/zinc/32/05/69/564320569.db2.gz OVKWPOYGIKCIMV-UHFFFAOYSA-N 0 0 383.813 3.466 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(Cc3cccs3)CC2)c1 ZINC000023737106 564326232 /nfs/dbraw/zinc/32/62/32/564326232.db2.gz WNBSTRRMVISANI-UHFFFAOYSA-N 0 0 377.491 3.336 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000120586221 564327604 /nfs/dbraw/zinc/32/76/04/564327604.db2.gz HWIQSVCMPPHCEH-UHFFFAOYSA-N 0 0 377.710 3.285 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000120604592 564329062 /nfs/dbraw/zinc/32/90/62/564329062.db2.gz FRFONWHBKHFJSV-STQMWFEESA-N 0 0 380.388 3.178 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000120605376 564329086 /nfs/dbraw/zinc/32/90/86/564329086.db2.gz BDDMIUCBPLMLGS-CHWSQXEVSA-N 0 0 380.388 3.178 20 5 GGBDRN CCOC(=O)CCN(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)C1CC1 ZINC000120617696 564329671 /nfs/dbraw/zinc/32/96/71/564329671.db2.gz GWFTZMONEDNALL-UHFFFAOYSA-N 0 0 399.241 3.224 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2c(F)cc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000120643911 564330443 /nfs/dbraw/zinc/33/04/43/564330443.db2.gz VVSXADAZTIDTCS-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C)CCc2ccncc2)cc1[N+](=O)[O-] ZINC000120707236 564333864 /nfs/dbraw/zinc/33/38/64/564333864.db2.gz KIFQCARTFXIMCY-UHFFFAOYSA-N 0 0 378.226 3.375 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1cccs1 ZINC000025197252 564336420 /nfs/dbraw/zinc/33/64/20/564336420.db2.gz RMVHRFJCCSVXHV-GFCCVEGCSA-N 0 0 380.447 3.412 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000025376489 564338507 /nfs/dbraw/zinc/33/85/07/564338507.db2.gz ZZDKAOWJVRKMMF-VHSXEESVSA-N 0 0 382.360 3.003 20 5 GGBDRN COCCN(CC(F)(F)F)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000120829660 564338852 /nfs/dbraw/zinc/33/88/52/564338852.db2.gz QZQZKSUDMJPYOM-UHFFFAOYSA-N 0 0 385.136 3.008 20 5 GGBDRN COCCN(C(=O)[C@H](C)SC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000120886353 564342314 /nfs/dbraw/zinc/34/23/14/564342314.db2.gz TVRBDYSGQZZBCU-NSHDSACASA-N 0 0 381.479 3.449 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000026358561 564345941 /nfs/dbraw/zinc/34/59/41/564345941.db2.gz WQLGSCAGJKXIAS-ZDUSSCGKSA-N 0 0 382.463 3.026 20 5 GGBDRN Cc1cnc([C@@H](NS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C2CC2)s1 ZINC000120970334 564346262 /nfs/dbraw/zinc/34/62/62/564346262.db2.gz QFVDCSFEWMRPGW-AWEZNQCLSA-N 0 0 381.479 3.406 20 5 GGBDRN O=c1[nH]cnc2cc(NCc3ccc(Br)s3)c([N+](=O)[O-])cc12 ZINC000026726543 564348378 /nfs/dbraw/zinc/34/83/78/564348378.db2.gz ZWFAAAUQOIPWIJ-UHFFFAOYSA-N 0 0 381.211 3.267 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1N1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000026728303 564349025 /nfs/dbraw/zinc/34/90/25/564349025.db2.gz SNVTXBGHCSJHLB-UHFFFAOYSA-N 0 0 376.214 3.135 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)Cc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000026979685 564351517 /nfs/dbraw/zinc/35/15/17/564351517.db2.gz GTIWBRQJBZNFAS-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN O=C(COc1cccc(I)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000027251987 564353577 /nfs/dbraw/zinc/35/35/77/564353577.db2.gz TZXCRDWDYCYGNF-UHFFFAOYSA-N 0 0 398.156 3.217 20 5 GGBDRN Cc1ccc(CSCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000027958423 564357656 /nfs/dbraw/zinc/35/76/56/564357656.db2.gz BGQSYRSCCYCRIZ-UHFFFAOYSA-N 0 0 380.491 3.423 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)CCOc1ccc(Cl)cc1 ZINC000027948552 564357753 /nfs/dbraw/zinc/35/77/53/564357753.db2.gz NSOMQEQKULKONW-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)Nc1cccc(Cl)c1Cl ZINC000028004284 564358698 /nfs/dbraw/zinc/35/86/98/564358698.db2.gz GVSNCFARYSULJU-UHFFFAOYSA-N 0 0 382.159 3.448 20 5 GGBDRN C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000121241922 564361210 /nfs/dbraw/zinc/36/12/10/564361210.db2.gz AKMWPXAVDFZKIP-SNVBAGLBSA-N 0 0 386.239 3.029 20 5 GGBDRN CC(C)c1nc([C@@H](C)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000121266702 564362002 /nfs/dbraw/zinc/36/20/02/564362002.db2.gz VXFOUNKCJHDPIV-GFCCVEGCSA-N 0 0 383.495 3.299 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@@H](Oc2ccncc2)C1 ZINC000121263704 564362196 /nfs/dbraw/zinc/36/21/96/564362196.db2.gz FCASDYAJLAULFG-CYBMUJFWSA-N 0 0 392.209 3.046 20 5 GGBDRN COC(=O)[C@H](C)CN(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)C1CC1 ZINC000121300080 564364049 /nfs/dbraw/zinc/36/40/49/564364049.db2.gz XBOPVEGHLOORIN-SECBINFHSA-N 0 0 399.241 3.079 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1Br ZINC000028874971 564364629 /nfs/dbraw/zinc/36/46/29/564364629.db2.gz LPDUCHQAYSCEJY-UHFFFAOYSA-N 0 0 392.209 3.116 20 5 GGBDRN O=C(c1ccccn1)N1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000121327172 564365206 /nfs/dbraw/zinc/36/52/06/564365206.db2.gz VOXFYTASOYLZSA-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN CN(Cc1ccccc1Br)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000029187097 564368224 /nfs/dbraw/zinc/36/82/24/564368224.db2.gz HOIWVQQKCUEOLT-UHFFFAOYSA-N 0 0 389.209 3.230 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1[N+](=O)[O-] ZINC000029314804 564368781 /nfs/dbraw/zinc/36/87/81/564368781.db2.gz HCRBIQIEGORMDR-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN COc1cccnc1N(C)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000121414622 564368748 /nfs/dbraw/zinc/36/87/48/564368748.db2.gz KCRMKDIQDPQSTD-UHFFFAOYSA-N 0 0 380.198 3.346 20 5 GGBDRN COc1ccc(S(=O)(=O)NC2CCC(C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000029396241 564369770 /nfs/dbraw/zinc/36/97/70/564369770.db2.gz SKOJDDTWLGOFTA-UHFFFAOYSA-N 0 0 382.360 3.003 20 5 GGBDRN CC(C)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000121442508 564369922 /nfs/dbraw/zinc/36/99/22/564369922.db2.gz KIFSSVHYNTYBAK-VIFPVBQESA-N 0 0 376.194 3.364 20 5 GGBDRN CC(C)Cn1nnnc1S[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000029593742 564372096 /nfs/dbraw/zinc/37/20/96/564372096.db2.gz QZOOYJAQELIGGT-VIFPVBQESA-N 0 0 384.849 3.010 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CSc1nnc(NC[C@@H]2CCCO2)s1 ZINC000029741491 564372691 /nfs/dbraw/zinc/37/26/91/564372691.db2.gz AFXUESODNRGMJT-LBPRGKRZSA-N 0 0 382.467 3.338 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121547284 564373878 /nfs/dbraw/zinc/37/38/78/564373878.db2.gz MYYIXBAXPAVORA-KFWWJZLASA-N 0 0 395.253 3.435 20 5 GGBDRN COc1ccc(NC(=O)CN(C)Cc2ccc(Br)o2)c([N+](=O)[O-])c1 ZINC000030213591 564376870 /nfs/dbraw/zinc/37/68/70/564376870.db2.gz DDZGHKKYTBLQTK-UHFFFAOYSA-N 0 0 398.213 3.029 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1ccc(Br)o1 ZINC000030213790 564376922 /nfs/dbraw/zinc/37/69/22/564376922.db2.gz XRZSQMLPLPYRIN-JTQLQIEISA-N 0 0 382.214 3.409 20 5 GGBDRN CCN(CC)[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000030435287 564380481 /nfs/dbraw/zinc/38/04/81/564380481.db2.gz ITNOOVGOOPQPJS-MRXNPFEDSA-N 0 0 383.495 3.018 20 5 GGBDRN CCN(CC)[C@@H](CNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000030435214 564380548 /nfs/dbraw/zinc/38/05/48/564380548.db2.gz ZRQHETLOAZYAFI-HNNXBMFYSA-N 0 0 383.495 3.018 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1ccc(Br)o1 ZINC000030420114 564380738 /nfs/dbraw/zinc/38/07/38/564380738.db2.gz NEHMNIUBLOLVCM-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCC2(c3ccccc3Cl)CC2)cc1 ZINC000121697027 564382571 /nfs/dbraw/zinc/38/25/71/564382571.db2.gz RCQXVARLOHJFTR-UHFFFAOYSA-N 0 0 380.853 3.399 20 5 GGBDRN Cc1nc(C)c(CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)s1 ZINC000121774701 564386450 /nfs/dbraw/zinc/38/64/50/564386450.db2.gz AXCPJKQFEKFKSM-UHFFFAOYSA-N 0 0 384.255 3.403 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC(n3ccnc3)CC2)cc1[N+](=O)[O-] ZINC000121924749 564393705 /nfs/dbraw/zinc/39/37/05/564393705.db2.gz DQIVRMWEECTROI-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN O=C(c1cc(Cl)ccc1Cl)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000032005516 564395471 /nfs/dbraw/zinc/39/54/71/564395471.db2.gz RMOHXFCLTWPIQH-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000122034577 564397298 /nfs/dbraw/zinc/39/72/98/564397298.db2.gz HOIBWUVIFSWFKV-OLZOCXBDSA-N 0 0 376.862 3.072 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCc3ccc(Cl)cc3C2)ccc1[N+](=O)[O-] ZINC000122022860 564397321 /nfs/dbraw/zinc/39/73/21/564397321.db2.gz AGDDFHBFZUXAPP-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(Br)cc2)cc([N+](=O)[O-])c1 ZINC000122091699 564400347 /nfs/dbraw/zinc/40/03/47/564400347.db2.gz JEFZZHAIYIWQJU-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN CN(Cc1ccc(Cl)s1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000032502344 564401238 /nfs/dbraw/zinc/40/12/38/564401238.db2.gz BWRJSLHKRKDULH-UHFFFAOYSA-N 0 0 399.881 3.159 20 5 GGBDRN COC(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000122164841 564403145 /nfs/dbraw/zinc/40/31/45/564403145.db2.gz PLLWTBLFGDMUIU-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN O=C(CCCOc1cccc(Cl)c1Cl)NCCn1cc([N+](=O)[O-])cn1 ZINC000122167408 564403605 /nfs/dbraw/zinc/40/36/05/564403605.db2.gz DHBUVXVDUUNUEL-UHFFFAOYSA-N 0 0 387.223 3.074 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2cc3c(cc2Cl)OCCO3)cc1[N+](=O)[O-] ZINC000032632572 564403641 /nfs/dbraw/zinc/40/36/41/564403641.db2.gz OXEULACSVNBXOL-UHFFFAOYSA-N 0 0 384.797 3.129 20 5 GGBDRN Cc1sc(Br)cc1S(=O)(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000122238704 564405743 /nfs/dbraw/zinc/40/57/43/564405743.db2.gz QNYCCJGEPSKLFW-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000122249167 564406184 /nfs/dbraw/zinc/40/61/84/564406184.db2.gz FDNXBLDDMPRLAS-VIFPVBQESA-N 0 0 389.264 3.395 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCOc2ccc(F)cc21 ZINC000122304266 564408137 /nfs/dbraw/zinc/40/81/37/564408137.db2.gz DXFCEIIBHBVLFB-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000122326435 564408545 /nfs/dbraw/zinc/40/85/45/564408545.db2.gz FWUZLPXTZOBVKT-UHFFFAOYSA-N 0 0 382.203 3.499 20 5 GGBDRN COc1ccc(CS(=O)(=O)Cc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000122349340 564409487 /nfs/dbraw/zinc/40/94/87/564409487.db2.gz RCEDTRWZZAFXKI-UHFFFAOYSA-N 0 0 391.232 3.420 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(-c2nc(-c3ccncc3)no2)c1 ZINC000122345303 564409822 /nfs/dbraw/zinc/40/98/22/564409822.db2.gz YUVXIPBLQTYIMV-UHFFFAOYSA-N 0 0 394.128 3.311 20 5 GGBDRN O=C(CSc1cc(Cl)ccc1Cl)NCCn1cc([N+](=O)[O-])cn1 ZINC000122437718 564413590 /nfs/dbraw/zinc/41/35/90/564413590.db2.gz HXYBQQKEFQOKKK-UHFFFAOYSA-N 0 0 375.237 3.007 20 5 GGBDRN O=C(N[C@H]1CCc2c1cccc2O)c1ccc([N+](=O)[O-])cc1Br ZINC000122615025 564421215 /nfs/dbraw/zinc/42/12/15/564421215.db2.gz SOWXTEICSVVVAF-AWEZNQCLSA-N 0 0 377.194 3.480 20 5 GGBDRN COc1ccc(Br)c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000122704467 564424269 /nfs/dbraw/zinc/42/42/69/564424269.db2.gz PMXMTJGGFFHKMH-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)COc2ccc(Br)cc2F)c1 ZINC000122707601 564425126 /nfs/dbraw/zinc/42/51/26/564425126.db2.gz CGYVTVYDFZIXSJ-GFCCVEGCSA-N 0 0 386.173 3.315 20 5 GGBDRN O=C(COc1cccc(Br)c1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122761302 564426648 /nfs/dbraw/zinc/42/66/48/564426648.db2.gz COFZMNVERKAGFN-UHFFFAOYSA-N 0 0 391.181 3.251 20 5 GGBDRN Cc1ccsc1CNC(=O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000122761630 564426840 /nfs/dbraw/zinc/42/68/40/564426840.db2.gz WWHYJHJDRFUPAW-UHFFFAOYSA-N 0 0 385.239 3.422 20 5 GGBDRN O=c1cc(COc2c(Br)cccc2[N+](=O)[O-])nc2sccn21 ZINC000122817617 564428654 /nfs/dbraw/zinc/42/86/54/564428654.db2.gz GNYRMKBIVRCARK-UHFFFAOYSA-N 0 0 382.195 3.006 20 5 GGBDRN COc1cccc(CNC(=O)COc2c(Br)cccc2[N+](=O)[O-])c1 ZINC000122817115 564428850 /nfs/dbraw/zinc/42/88/50/564428850.db2.gz XMOSKEWMSOPBGG-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN COc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000122837205 564429554 /nfs/dbraw/zinc/42/95/54/564429554.db2.gz BRPXNIRICTYLDO-AWEZNQCLSA-N 0 0 382.463 3.499 20 5 GGBDRN C[C@@H](Sc1ccc(Br)cc1[N+](=O)[O-])c1nc(-c2nc[nH]n2)no1 ZINC000122852590 564429651 /nfs/dbraw/zinc/42/96/51/564429651.db2.gz MTONJJDWNYAPOZ-ZCFIWIBFSA-N 0 0 397.214 3.379 20 5 GGBDRN Cc1ccccc1CCNC(=O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000122840610 564429905 /nfs/dbraw/zinc/42/99/05/564429905.db2.gz WHSHHGYYPIBHDN-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC000041173397 564430443 /nfs/dbraw/zinc/43/04/43/564430443.db2.gz XWFIMDKGTFXOJE-INIZCTEOSA-N 0 0 382.825 3.010 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@H]3CCOC3)cc2[N+](=O)[O-])n1 ZINC000041378610 564431928 /nfs/dbraw/zinc/43/19/28/564431928.db2.gz TWFFZVRYDIPTAS-LLVKDONJSA-N 0 0 379.463 3.277 20 5 GGBDRN O=c1[nH]c(CCNc2ccccc2[N+](=O)[O-])nc2ccc(Br)cc12 ZINC000122944628 564433131 /nfs/dbraw/zinc/43/31/31/564433131.db2.gz GCVURVUNPBNGAB-UHFFFAOYSA-N 0 0 389.209 3.248 20 5 GGBDRN O=[N+]([O-])c1cc(CS(=O)(=O)Cc2ccc(Cl)cc2)c2c(c1)COCO2 ZINC000122978384 564434343 /nfs/dbraw/zinc/43/43/43/564434343.db2.gz ZHPYRVYDLXUNPK-UHFFFAOYSA-N 0 0 383.809 3.230 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2sc3ccccc3c2Cl)c1 ZINC000041744035 564436671 /nfs/dbraw/zinc/43/66/71/564436671.db2.gz PQWXMMYSFNNORQ-UHFFFAOYSA-N 0 0 378.793 3.460 20 5 GGBDRN O=C(NCCO)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000123082265 564437554 /nfs/dbraw/zinc/43/75/54/564437554.db2.gz RHDSCNQMBUQSMC-UHFFFAOYSA-N 0 0 375.431 3.078 20 5 GGBDRN CC[C@@H](O)CCNC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000123109683 564438120 /nfs/dbraw/zinc/43/81/20/564438120.db2.gz IIDVHMPQRFRDKJ-GFCCVEGCSA-N 0 0 381.479 3.402 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCOc2c(Cl)cccc21 ZINC000123102171 564438212 /nfs/dbraw/zinc/43/82/12/564438212.db2.gz VFMVIBLSNXXXDM-UHFFFAOYSA-N 0 0 389.216 3.489 20 5 GGBDRN O=C(Nc1cnn(CC(F)F)c1)c1ccc([N+](=O)[O-])cc1Br ZINC000123120486 564439446 /nfs/dbraw/zinc/43/94/46/564439446.db2.gz ONNBQJLGKIWDJY-UHFFFAOYSA-N 0 0 375.129 3.071 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)Nc3ccnn3C)cc2[N+](=O)[O-])n1 ZINC000123190419 564441381 /nfs/dbraw/zinc/44/13/81/564441381.db2.gz HVGCVMPPFNCWTB-UHFFFAOYSA-N 0 0 375.435 3.497 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCc1ccc(Br)s1 ZINC000042080910 564441620 /nfs/dbraw/zinc/44/16/20/564441620.db2.gz JEMXTERBYHSBQA-UHFFFAOYSA-N 0 0 385.239 3.157 20 5 GGBDRN COc1ccc(CSc2nnc(NC[C@@H]3CCCO3)s2)cc1[N+](=O)[O-] ZINC000042154409 564442644 /nfs/dbraw/zinc/44/26/44/564442644.db2.gz LXSSMCHZDQHJNE-NSHDSACASA-N 0 0 382.467 3.338 20 5 GGBDRN O=[N+]([O-])c1cccc(OCCSc2nnc(NC[C@H]3CCCO3)s2)c1 ZINC000042154408 564442758 /nfs/dbraw/zinc/44/27/58/564442758.db2.gz AIRIDHOWEFHVHL-CYBMUJFWSA-N 0 0 382.467 3.208 20 5 GGBDRN CCc1nnc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])s1 ZINC000042212453 564443505 /nfs/dbraw/zinc/44/35/05/564443505.db2.gz BRGRDTIZENCVNH-UHFFFAOYSA-N 0 0 376.316 3.202 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000123291626 564443881 /nfs/dbraw/zinc/44/38/81/564443881.db2.gz YUCXHEZPHOGRHK-NSHDSACASA-N 0 0 388.854 3.420 20 5 GGBDRN O=C(c1sccc1Br)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000042230748 564444920 /nfs/dbraw/zinc/44/49/20/564444920.db2.gz RIYCIGGYMUUQBH-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN O=C(/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CCO[C@]2(CCSC2)C1 ZINC000123454910 564448647 /nfs/dbraw/zinc/44/86/47/564448647.db2.gz SECJZWZXXHOKMZ-PFNRETIQSA-N 0 0 382.869 3.432 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000123477354 564449909 /nfs/dbraw/zinc/44/99/09/564449909.db2.gz XKGQUEWCAZPZPU-UHFFFAOYSA-N 0 0 388.511 3.467 20 5 GGBDRN CC(=O)c1ccc(Sc2nnc(N(C(C)=O)C3CC3)s2)c([N+](=O)[O-])c1 ZINC000042848575 564450692 /nfs/dbraw/zinc/45/06/92/564450692.db2.gz IGCSYISGYXLMDK-UHFFFAOYSA-N 0 0 378.435 3.315 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@H](c2cc[nH]n2)C1 ZINC000123563606 564453180 /nfs/dbraw/zinc/45/31/80/564453180.db2.gz MZJWGZIBTFSCDN-JTQLQIEISA-N 0 0 379.214 3.100 20 5 GGBDRN O=C(Nc1cc(Br)ccn1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000123626175 564456624 /nfs/dbraw/zinc/45/66/24/564456624.db2.gz FXMALSNTLWISLD-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(Cc1cccc(I)c1)NCc1ccccc1[N+](=O)[O-] ZINC000123637412 564456764 /nfs/dbraw/zinc/45/67/64/564456764.db2.gz GOKLQKLKSGLIBM-UHFFFAOYSA-N 0 0 396.184 3.058 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1nc(C(F)(F)F)cs1 ZINC000043632115 564460314 /nfs/dbraw/zinc/46/03/14/564460314.db2.gz ZPYLCAFHWDCXFE-UHFFFAOYSA-N 0 0 375.332 3.304 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000043771607 564461864 /nfs/dbraw/zinc/46/18/64/564461864.db2.gz XKWAXAGYNHBSSC-LLVKDONJSA-N 0 0 379.869 3.486 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1cc(Br)cs1 ZINC000043893199 564462707 /nfs/dbraw/zinc/46/27/07/564462707.db2.gz SSJWFBFFPHENCV-UHFFFAOYSA-N 0 0 399.270 3.330 20 5 GGBDRN CCOC(=O)c1csc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000044516686 564469968 /nfs/dbraw/zinc/46/99/68/564469968.db2.gz AJHRIDNRSBCAEK-VIFPVBQESA-N 0 0 381.435 3.347 20 5 GGBDRN CN(Cc1cc(Br)cs1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000044631693 564470926 /nfs/dbraw/zinc/47/09/26/564470926.db2.gz LIAKJCWFQGIEND-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN C[C@@H](Cc1ccc(Br)cc1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000044574392 564470955 /nfs/dbraw/zinc/47/09/55/564470955.db2.gz KTNQFDUWUADGKF-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN CSc1ccc(-c2csc(NC(=O)Cn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000044670370 564471394 /nfs/dbraw/zinc/47/13/94/564471394.db2.gz LMNPIAFQJHWLLJ-UHFFFAOYSA-N 0 0 375.435 3.275 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000124122243 564472390 /nfs/dbraw/zinc/47/23/90/564472390.db2.gz MFDUOUMPNSVPGA-NHYWBVRUSA-N 0 0 393.241 3.277 20 5 GGBDRN Cc1cccc(OCCN(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000044771019 564472428 /nfs/dbraw/zinc/47/24/28/564472428.db2.gz JMRLRZFALPFBIZ-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000124122669 564472581 /nfs/dbraw/zinc/47/25/81/564472581.db2.gz MFDUOUMPNSVPGA-XHDPSFHLSA-N 0 0 393.241 3.277 20 5 GGBDRN O=C(NCCc1ccc(Cl)s1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000044810287 564473239 /nfs/dbraw/zinc/47/32/39/564473239.db2.gz NAZPNSYJTOHVJH-UHFFFAOYSA-N 0 0 376.825 3.468 20 5 GGBDRN O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)Nc1ccc(Cl)c(Cl)c1 ZINC000045021694 564477153 /nfs/dbraw/zinc/47/71/53/564477153.db2.gz FASKPCVVCCPAPS-UHFFFAOYSA-N 0 0 382.159 3.448 20 5 GGBDRN COC(=O)c1[nH]c(C)cc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000124321485 564478841 /nfs/dbraw/zinc/47/88/41/564478841.db2.gz SMVWASXPXGNNQL-UHFFFAOYSA-N 0 0 382.170 3.033 20 5 GGBDRN O=C(NCc1cccc(Br)c1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000045351560 564482333 /nfs/dbraw/zinc/48/23/33/564482333.db2.gz JQCRCOIIIGIWOO-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN Cc1ccccc1OCCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000124574422 564486568 /nfs/dbraw/zinc/48/65/68/564486568.db2.gz LVKUWRZFMFATOL-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2coc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000124589844 564486579 /nfs/dbraw/zinc/48/65/79/564486579.db2.gz UOGKSNJIMBSYQM-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCC[C@H]1c1ncc[nH]1 ZINC000124600895 564487871 /nfs/dbraw/zinc/48/78/71/564487871.db2.gz HPCGRTWLVBMNGG-ZDUSSCGKSA-N 0 0 379.214 3.448 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCSc3ccc(F)cc32)cc1 ZINC000045798747 564489405 /nfs/dbraw/zinc/48/94/05/564489405.db2.gz NQTQKQAOHCKPPA-HNNXBMFYSA-N 0 0 382.438 3.390 20 5 GGBDRN Cn1ccnc1[C@](O)(CCNc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000045802388 564489423 /nfs/dbraw/zinc/48/94/23/564489423.db2.gz DAQHTWYZIVSOOY-CYBMUJFWSA-N 0 0 378.738 3.234 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1coc(-c2cccs2)n1 ZINC000045799325 564489940 /nfs/dbraw/zinc/48/99/40/564489940.db2.gz QAVQRXMSOCHZAV-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(C(F)(F)F)cc1Cl ZINC000124771489 564492534 /nfs/dbraw/zinc/49/25/34/564492534.db2.gz KJJFMNGIPLVMJZ-UHFFFAOYSA-N 0 0 377.710 3.285 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000046023048 564493521 /nfs/dbraw/zinc/49/35/21/564493521.db2.gz SXZLCZNUZFCYHW-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN CCCc1nnc(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000046150734 564496248 /nfs/dbraw/zinc/49/62/48/564496248.db2.gz DOZLOELLYPYEAR-UHFFFAOYSA-N 0 0 382.467 3.279 20 5 GGBDRN C[C@@H](Oc1ccc(Br)cc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000046136771 564496627 /nfs/dbraw/zinc/49/66/27/564496627.db2.gz BYNUAJHKVAYAHW-LLVKDONJSA-N 0 0 379.210 3.441 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCSc2ccncc21 ZINC000125108923 564502491 /nfs/dbraw/zinc/50/24/91/564502491.db2.gz NGGTWVOVIHRCFI-UHFFFAOYSA-N 0 0 394.250 3.434 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000046646605 564505480 /nfs/dbraw/zinc/50/54/80/564505480.db2.gz UFMALUQIFPPGQN-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000046646626 564505487 /nfs/dbraw/zinc/50/54/87/564505487.db2.gz GUYRUQJRPJDBKT-UHFFFAOYSA-N 0 0 387.248 3.321 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1OCc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000046849803 564509212 /nfs/dbraw/zinc/50/92/12/564509212.db2.gz NVZIPLWEBRYAHB-UHFFFAOYSA-N 0 0 386.813 3.205 20 5 GGBDRN O=C(NCc1ccc(Cl)s1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000046996306 564510714 /nfs/dbraw/zinc/51/07/14/564510714.db2.gz CUFGABLVPSRVPN-UHFFFAOYSA-N 0 0 380.857 3.342 20 5 GGBDRN C[C@@H](Cc1ccc(Br)cc1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000047027038 564512169 /nfs/dbraw/zinc/51/21/69/564512169.db2.gz INYGYDLXUQRRJJ-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCN(C)CC(F)(F)F ZINC000047136542 564513248 /nfs/dbraw/zinc/51/32/48/564513248.db2.gz ADHYIBKNTUZDFC-LLVKDONJSA-N 0 0 379.404 3.076 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCN(C)CC(F)(F)F ZINC000047136539 564513911 /nfs/dbraw/zinc/51/39/11/564513911.db2.gz ADHYIBKNTUZDFC-NSHDSACASA-N 0 0 379.404 3.076 20 5 GGBDRN COc1ccc(C(=O)NCCNc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000047162567 564514711 /nfs/dbraw/zinc/51/47/11/564514711.db2.gz VFOLVGJAFKCENA-UHFFFAOYSA-N 0 0 385.207 3.147 20 5 GGBDRN Cc1cc([C@H]2CCCN2S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)on1 ZINC000047281249 564517273 /nfs/dbraw/zinc/51/72/73/564517273.db2.gz UYWGTXALQLLJGD-CYBMUJFWSA-N 0 0 385.829 3.379 20 5 GGBDRN O=c1c(Br)cc(Br)cn1Cc1ccccc1[N+](=O)[O-] ZINC000125560049 564518667 /nfs/dbraw/zinc/51/86/67/564518667.db2.gz JSSFZTHIDAREHV-UHFFFAOYSA-N 0 0 388.015 3.330 20 5 GGBDRN Cc1c(Br)c(=O)n(CC(=O)c2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000125574375 564518830 /nfs/dbraw/zinc/51/88/30/564518830.db2.gz GETNWAJUJIAWLI-UHFFFAOYSA-N 0 0 391.630 3.425 20 5 GGBDRN Cc1c(OCc2cc(=O)n3cc(Br)ccc3n2)cccc1[N+](=O)[O-] ZINC000047355630 564518915 /nfs/dbraw/zinc/51/89/15/564518915.db2.gz LKITUKOBPHJYAA-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN O=c1c2cc(Br)ccc2ncn1CCOc1ccc([N+](=O)[O-])cc1 ZINC000047368643 564519248 /nfs/dbraw/zinc/51/92/48/564519248.db2.gz BLRXXFVISCCCAH-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)c2ccc(Br)cc2)c1 ZINC000047354868 564519319 /nfs/dbraw/zinc/51/93/19/564519319.db2.gz QJXSJABAPACLTI-UHFFFAOYSA-N 0 0 394.177 3.406 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC[C@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000125602032 564519800 /nfs/dbraw/zinc/51/98/00/564519800.db2.gz YZWXJJWVDQXXMQ-AWEZNQCLSA-N 0 0 381.479 3.230 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1Cl ZINC000125647966 564521969 /nfs/dbraw/zinc/52/19/69/564521969.db2.gz UKBKWTKWYBWXOL-UHFFFAOYSA-N 0 0 376.843 3.105 20 5 GGBDRN Cc1ccccc1OCCN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000047543526 564522897 /nfs/dbraw/zinc/52/28/97/564522897.db2.gz USUJJHPJMLOPDL-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN O=C(Nc1cc(Br)ccc1N1CCOCC1)c1ccc([N+](=O)[O-])o1 ZINC000047740592 564526364 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O=C(Cc1cc(F)ccc1Br)NCCc1cccc([N+](=O)[O-])c1 ZINC000125930753 564531277 /nfs/dbraw/zinc/53/12/77/564531277.db2.gz ZPLFJNOLYVVQGD-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN O=C(Cc1ccc(Br)c(F)c1)NCCc1cccc([N+](=O)[O-])c1 ZINC000125989811 564533010 /nfs/dbraw/zinc/53/30/10/564533010.db2.gz GDWRLNGIBWKWGH-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN Cc1csc(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n1 ZINC000048191033 564533390 /nfs/dbraw/zinc/53/33/90/564533390.db2.gz MQSBSWNPSYMIJJ-UHFFFAOYSA-N 0 0 375.328 3.231 20 5 GGBDRN CN(Cc1ccc(Br)cc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000048244770 564534533 /nfs/dbraw/zinc/53/45/33/564534533.db2.gz YAWLLVSAGMWLRQ-UHFFFAOYSA-N 0 0 382.189 3.351 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(c2ncccc2Cl)CC1 ZINC000048293554 564535682 /nfs/dbraw/zinc/53/56/82/564535682.db2.gz WDHLJYJDCUQAGE-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN O=C(c1cccc(Br)c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048305852 564536376 /nfs/dbraw/zinc/53/63/76/564536376.db2.gz 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/nfs/dbraw/zinc/64/05/20/564640520.db2.gz QOOLSVAQPJEXDL-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=[N+]([O-])c1ccccc1CNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000056088542 564640625 /nfs/dbraw/zinc/64/06/25/564640625.db2.gz MMAVDNGBZUQFNO-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000056104067 564641282 /nfs/dbraw/zinc/64/12/82/564641282.db2.gz FZLOSKHFYUNCPY-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2cc(Br)cs2)cc1 ZINC000056094530 564641557 /nfs/dbraw/zinc/64/15/57/564641557.db2.gz PZHAOYIWAUBNNO-UHFFFAOYSA-N 0 0 391.268 3.038 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)cc1 ZINC000056124675 564642095 /nfs/dbraw/zinc/64/20/95/564642095.db2.gz SJJNGXXWFIAYLQ-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCCOC1CCCC1 ZINC000129366290 564646547 /nfs/dbraw/zinc/64/65/47/564646547.db2.gz YDGNRUPLCVZGNO-UHFFFAOYSA-N 0 0 385.258 3.365 20 5 GGBDRN CCC[C@H]1SCCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000129479139 564650510 /nfs/dbraw/zinc/65/05/10/564650510.db2.gz BSOPEVGHCZXVKA-GFCCVEGCSA-N 0 0 395.300 3.221 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000057010738 564656181 /nfs/dbraw/zinc/65/61/81/564656181.db2.gz CLISFVSZMGRYMJ-CYBMUJFWSA-N 0 0 382.825 3.359 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCSc1ccc(Cl)cc1 ZINC000129721597 564657998 /nfs/dbraw/zinc/65/79/98/564657998.db2.gz VEGFLWJDGVJAMM-UHFFFAOYSA-N 0 0 386.882 3.460 20 5 GGBDRN O=C(NCCNc1cccc(F)c1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000057139815 564661501 /nfs/dbraw/zinc/66/15/01/564661501.db2.gz HAWQUTQNWYUIMR-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@H]2CCc3c2cccc3Cl)c([N+](=O)[O-])c1 ZINC000057142603 564661707 /nfs/dbraw/zinc/66/17/07/564661707.db2.gz TTWLFOARVJIGQB-AWEZNQCLSA-N 0 0 381.841 3.256 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1N1CCc2[nH]c3c(cccc3Br)c2C1 ZINC000057147556 564661721 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COc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1[N+](=O)[O-] ZINC000057699503 564672545 /nfs/dbraw/zinc/67/25/45/564672545.db2.gz ZPIFWXURZZWFQT-UHFFFAOYSA-N 0 0 382.463 3.064 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(Br)cn2)cc([N+](=O)[O-])c1 ZINC000057807536 564674306 /nfs/dbraw/zinc/67/43/06/564674306.db2.gz FMLAJJBLAUYCOK-UHFFFAOYSA-N 0 0 394.181 3.181 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1OC ZINC000130240589 564674670 /nfs/dbraw/zinc/67/46/70/564674670.db2.gz OUYUSRBNKMWWAV-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN(CCO)Cc1cc(Br)ccc1F ZINC000057842213 564675027 /nfs/dbraw/zinc/67/50/27/564675027.db2.gz KNQOAKSDUKYQKP-UHFFFAOYSA-N 0 0 383.217 3.491 20 5 GGBDRN O=C(N[C@@H](CCO)C1CCCCC1)c1ccc([N+](=O)[O-])cc1Br ZINC000130252558 564675707 /nfs/dbraw/zinc/67/57/07/564675707.db2.gz VVGINDRCABPXQO-HNNXBMFYSA-N 0 0 385.258 3.418 20 5 GGBDRN CS(=O)(=O)c1ccc(NCCc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000057854387 564676450 /nfs/dbraw/zinc/67/64/50/564676450.db2.gz HFHPAQPISQOKKH-UHFFFAOYSA-N 0 0 399.266 3.415 20 5 GGBDRN Cc1noc(C)c1C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000130312641 564676931 /nfs/dbraw/zinc/67/69/31/564676931.db2.gz YIYIDHKTGLEJJK-MRVPVSSYSA-N 0 0 382.214 3.323 20 5 GGBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1cccc(O)c1 ZINC000130428124 564681204 /nfs/dbraw/zinc/68/12/04/564681204.db2.gz TZOPUIAPGIDUDW-JTQLQIEISA-N 0 0 379.210 3.483 20 5 GGBDRN Cc1csc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)n1 ZINC000058304045 564682143 /nfs/dbraw/zinc/68/21/43/564682143.db2.gz UFZFWGSXYMTNBX-UHFFFAOYSA-N 0 0 385.492 3.295 20 5 GGBDRN O=[N+]([O-])c1c(N2CCN(Cc3ccc(Cl)cc3)CC2)nc2sccn21 ZINC000058304092 564682551 /nfs/dbraw/zinc/68/25/51/564682551.db2.gz JPNAVBDBGQNIQC-UHFFFAOYSA-N 0 0 377.857 3.280 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc(F)ccc2Br)cc1 ZINC000130502215 564684017 /nfs/dbraw/zinc/68/40/17/564684017.db2.gz LIZSFTOWXQYPFC-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1sccc1Br ZINC000058510670 564685348 /nfs/dbraw/zinc/68/53/48/564685348.db2.gz MQDREIIDWKXWQP-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CSc1ccc(C(=O)N2CCC([C@H](O)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000130548872 564686079 /nfs/dbraw/zinc/68/60/79/564686079.db2.gz JXQHCOHGCISOBQ-ZDUSSCGKSA-N 0 0 378.372 3.092 20 5 GGBDRN NS(=O)(=O)c1ccc(OCc2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000058573722 564686180 /nfs/dbraw/zinc/68/61/80/564686180.db2.gz AMWWSVCZUZMTPI-UHFFFAOYSA-N 0 0 377.205 3.128 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCc1cc(Br)ccc1F ZINC000058700576 564688423 /nfs/dbraw/zinc/68/84/23/564688423.db2.gz XLWWHXVWSYXDES-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2CS(C)(=O)=O)c1 ZINC000058762568 564688639 /nfs/dbraw/zinc/68/86/39/564688639.db2.gz YUJUNJNXOSVCFH-UHFFFAOYSA-N 0 0 380.447 3.114 20 5 GGBDRN C[C@H]1COC[C@H](C)N1C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000130759452 564691949 /nfs/dbraw/zinc/69/19/49/564691949.db2.gz HNRMMAMHYWWIEQ-UWVGGRQHSA-N 0 0 378.372 3.342 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000130801134 564692728 /nfs/dbraw/zinc/69/27/28/564692728.db2.gz YBXIAKAJBQUCPI-DOMZBBRYSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1csc(N(CC(F)(F)F)C(=O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000059934914 564694268 /nfs/dbraw/zinc/69/42/68/564694268.db2.gz REFJOFBDTLEITR-UHFFFAOYSA-N 0 0 375.328 3.334 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(Br)cn2)c([N+](=O)[O-])cc1OC ZINC000060515904 564700452 /nfs/dbraw/zinc/70/04/52/564700452.db2.gz MWBQFHMSRRICST-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN O=c1ccn(Cc2cc(Br)ccc2OC(F)F)cc1[N+](=O)[O-] ZINC000131143799 564702205 /nfs/dbraw/zinc/70/22/05/564702205.db2.gz NWNQOCGGQMIXEJ-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)NCCCOC2CCCC2)cc1[N+](=O)[O-] ZINC000060921676 564703104 /nfs/dbraw/zinc/70/31/04/564703104.db2.gz CVKZOOZRGJCNTE-UHFFFAOYSA-N 0 0 376.862 3.184 20 5 GGBDRN O=C(NCCc1ccccc1Br)NCc1ccccc1[N+](=O)[O-] ZINC000061019121 564704203 /nfs/dbraw/zinc/70/42/03/564704203.db2.gz KNMWTCAILSLCJN-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN Cc1cc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)ccc1C(N)=O ZINC000131199033 564704465 /nfs/dbraw/zinc/70/44/65/564704465.db2.gz WBZQEJDSYJXMGQ-UHFFFAOYSA-N 0 0 392.209 3.325 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1(c2ccc(Br)cc2)CC1 ZINC000061167268 564704938 /nfs/dbraw/zinc/70/49/38/564704938.db2.gz IGRZRYLEIMCMLV-UHFFFAOYSA-N 0 0 393.241 3.058 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCc1ccccc1Br ZINC000061262776 564704959 /nfs/dbraw/zinc/70/49/59/564704959.db2.gz WLGGXWVSOZXDGP-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN O=c1c(Br)cc(Br)cn1Cc1cccc([N+](=O)[O-])c1 ZINC000131238507 564705376 /nfs/dbraw/zinc/70/53/76/564705376.db2.gz QACAJSHHXPTHQR-UHFFFAOYSA-N 0 0 388.015 3.330 20 5 GGBDRN O=C(NCCOc1ccc(Br)cc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000062507704 564710868 /nfs/dbraw/zinc/71/08/68/564710868.db2.gz YOZUNBPCUATBEV-UHFFFAOYSA-N 0 0 394.225 3.236 20 5 GGBDRN COC(=O)c1csc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000131440443 564711882 /nfs/dbraw/zinc/71/18/82/564711882.db2.gz ODYZPHZNAIRRMW-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NCc1cc(F)ccc1Br ZINC000063069466 564713088 /nfs/dbraw/zinc/71/30/88/564713088.db2.gz GEQTZLLXSBAPSM-UHFFFAOYSA-N 0 0 382.189 3.496 20 5 GGBDRN CS(=O)(=O)c1ccc(OCCCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000063283297 564716028 /nfs/dbraw/zinc/71/60/28/564716028.db2.gz AAHWGIJRYQZIOK-UHFFFAOYSA-N 0 0 385.825 3.500 20 5 GGBDRN O=C(NC[C@@H](O)COc1cccc(Cl)c1Cl)c1csc([N+](=O)[O-])c1 ZINC000063331679 564716815 /nfs/dbraw/zinc/71/68/15/564716815.db2.gz RZZXPVHIZHLYOI-SECBINFHSA-N 0 0 391.232 3.133 20 5 GGBDRN O=C(NC[C@H](O)COc1cccc(Cl)c1Cl)c1ccccc1[N+](=O)[O-] ZINC000063330954 564716934 /nfs/dbraw/zinc/71/69/34/564716934.db2.gz UYTJCXJICIFHHG-JTQLQIEISA-N 0 0 385.203 3.071 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000063628494 564719901 /nfs/dbraw/zinc/71/99/01/564719901.db2.gz CSPFARXSSINWOD-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000131701503 564721123 /nfs/dbraw/zinc/72/11/23/564721123.db2.gz SLJJCJVFXFXDTO-PWSUYJOCSA-N 0 0 385.873 3.319 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000131704651 564721272 /nfs/dbraw/zinc/72/12/72/564721272.db2.gz GNSUPSWMOPJDAV-VHSXEESVSA-N 0 0 388.205 3.318 20 5 GGBDRN CC(C)(CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1)c1cccc(Cl)c1 ZINC000063739427 564721650 /nfs/dbraw/zinc/72/16/50/564721650.db2.gz QLECPSNVTJCGRT-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCc2cccc(Cl)c21 ZINC000064374200 564728063 /nfs/dbraw/zinc/72/80/63/564728063.db2.gz KPLWGHJTCZKNCT-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN COc1cccc2c1CC[C@@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000131959457 564729755 /nfs/dbraw/zinc/72/97/55/564729755.db2.gz AVXOLRHPMZNXLQ-AWEZNQCLSA-N 0 0 382.825 3.223 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc(N(C)C)cn2)cc1[N+](=O)[O-] ZINC000132008174 564730596 /nfs/dbraw/zinc/73/05/96/564730596.db2.gz VASORPDEKWJJBK-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN Cc1c(CC(=O)NCCOc2ncc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000132229095 564737297 /nfs/dbraw/zinc/73/72/97/564737297.db2.gz ONKDJDSLSXVYIK-UHFFFAOYSA-N 0 0 384.219 3.343 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)c(Br)c1 ZINC000132251217 564737743 /nfs/dbraw/zinc/73/77/43/564737743.db2.gz NYOMIORRXMUOHR-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1sccc1Br ZINC000132279763 564738643 /nfs/dbraw/zinc/73/86/43/564738643.db2.gz VHRHDXNQEYMBAM-UHFFFAOYSA-N 0 0 377.241 3.244 20 5 GGBDRN COC(=O)c1ccccc1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000132298895 564739236 /nfs/dbraw/zinc/73/92/36/564739236.db2.gz DRUPWNPLSWPIQH-UHFFFAOYSA-N 0 0 393.193 3.421 20 5 GGBDRN Cc1nc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3Br)CCCC2)no1 ZINC000132511813 564746077 /nfs/dbraw/zinc/74/60/77/564746077.db2.gz UHMQTFDIRZINFZ-UHFFFAOYSA-N 0 0 395.213 3.248 20 5 GGBDRN O=c1c(Br)cn(Cc2csc(-c3ccco3)n2)cc1[N+](=O)[O-] ZINC000132579297 564748170 /nfs/dbraw/zinc/74/81/70/564748170.db2.gz VRMMSQDFPBJNDW-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(Br)cn1 ZINC000065719263 564748702 /nfs/dbraw/zinc/74/87/02/564748702.db2.gz CHXBGVLVKBTEKM-UHFFFAOYSA-N 0 0 375.182 3.346 20 5 GGBDRN Cc1ccc(C(=O)NCCOc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000065765325 564749019 /nfs/dbraw/zinc/74/90/19/564749019.db2.gz GIMOJNRTBBVBEG-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)CCO2 ZINC000132688733 564749687 /nfs/dbraw/zinc/74/96/87/564749687.db2.gz OWCPGPDXRJIERJ-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000065809670 564749893 /nfs/dbraw/zinc/74/98/93/564749893.db2.gz NINHGFKRFHNHGN-HNNXBMFYSA-N 0 0 393.241 3.308 20 5 GGBDRN Cc1ccc(Br)cc1S(=O)(=O)N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000065795559 564750471 /nfs/dbraw/zinc/75/04/71/564750471.db2.gz JYCZVPUAIHSITR-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Nc1c(C(=O)NCCOc2cccc(Cl)c2Cl)cc(F)cc1[N+](=O)[O-] ZINC000065878901 564751752 /nfs/dbraw/zinc/75/17/52/564751752.db2.gz WYFQPMFMDWPAFO-UHFFFAOYSA-N 0 0 388.182 3.432 20 5 GGBDRN O=c1c(Br)cn(Cc2ccccc2Br)cc1[N+](=O)[O-] ZINC000132740191 564752104 /nfs/dbraw/zinc/75/21/04/564752104.db2.gz SMLWBZYSYHLODZ-UHFFFAOYSA-N 0 0 388.015 3.330 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)nc1)c1ccc([N+](=O)[O-])cc1Br ZINC000132809956 564753801 /nfs/dbraw/zinc/75/38/01/564753801.db2.gz DZWJYKDPIKPWOU-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CCO[C@H](C)c1nc(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)cs1 ZINC000132829068 564753879 /nfs/dbraw/zinc/75/38/79/564753879.db2.gz HFBNHHMSCSOCRK-MRVPVSSYSA-N 0 0 388.243 3.121 20 5 GGBDRN O=c1c(Br)cn(Cc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000132858308 564755227 /nfs/dbraw/zinc/75/52/27/564755227.db2.gz WVTQXDAOWIADHR-UHFFFAOYSA-N 0 0 393.115 3.466 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000132909465 564757084 /nfs/dbraw/zinc/75/70/84/564757084.db2.gz IPZKJGKXFUKICK-UHFFFAOYSA-N 0 0 392.209 3.497 20 5 GGBDRN O=c1c(Br)cn(Cc2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-] ZINC000132926337 564757898 /nfs/dbraw/zinc/75/78/98/564757898.db2.gz HXDBQASCVCJZIJ-UHFFFAOYSA-N 0 0 399.151 3.312 20 5 GGBDRN O=C(NCc1cc(Br)ccc1OC(F)F)c1ccc([N+](=O)[O-])o1 ZINC000133062548 564761835 /nfs/dbraw/zinc/76/18/35/564761835.db2.gz KZVUNQZACLVBPO-UHFFFAOYSA-N 0 0 391.124 3.482 20 5 GGBDRN COc1ccc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000133110681 564762862 /nfs/dbraw/zinc/76/28/62/564762862.db2.gz CMVCQNYBNNNZGR-UHFFFAOYSA-N 0 0 393.237 3.267 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000133144656 564765053 /nfs/dbraw/zinc/76/50/53/564765053.db2.gz CZPAXRHTWVLLBP-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN CC(C)(Cc1ccc(Br)cc1)NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000066515288 564768403 /nfs/dbraw/zinc/76/84/03/564768403.db2.gz FDMJKBBPKBJHGJ-UHFFFAOYSA-N 0 0 395.257 3.081 20 5 GGBDRN CN(C)c1c(Cl)cccc1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000133478884 564775027 /nfs/dbraw/zinc/77/50/27/564775027.db2.gz NYHSUEUSVSDHHO-UHFFFAOYSA-N 0 0 383.857 3.299 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCC1(c2ccc(Cl)cc2)CC1 ZINC000066818442 564775314 /nfs/dbraw/zinc/77/53/14/564775314.db2.gz ROKYMHWDBUBDED-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN Cc1ccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000133665569 564781755 /nfs/dbraw/zinc/78/17/55/564781755.db2.gz SLSHEOUEBYEUOE-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN O=c1cc(COc2ccc([N+](=O)[O-])cc2Br)nc2sccn21 ZINC000133666014 564782089 /nfs/dbraw/zinc/78/20/89/564782089.db2.gz JEDFZKHUYSDVMU-UHFFFAOYSA-N 0 0 382.195 3.006 20 5 GGBDRN CN(Cc1cccs1)C(=O)COc1ccc([N+](=O)[O-])cc1Br ZINC000133676482 564782148 /nfs/dbraw/zinc/78/21/48/564782148.db2.gz DWVATLKYJYKJDT-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN O=C(COc1ccc(F)cc1Br)NCc1cccc([N+](=O)[O-])c1 ZINC000067072210 564783344 /nfs/dbraw/zinc/78/33/44/564783344.db2.gz ZDJSSPPQDKAHJY-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN C[C@@H](Oc1ccc(Br)cc1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067071784 564783450 /nfs/dbraw/zinc/78/34/50/564783450.db2.gz MAIHRXDIPJBJOW-LLVKDONJSA-N 0 0 379.210 3.441 20 5 GGBDRN O=C(Nc1cccc(Br)c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067134673 564785110 /nfs/dbraw/zinc/78/51/10/564785110.db2.gz TYDKBJSTNGXXFY-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1 ZINC000067159613 564785752 /nfs/dbraw/zinc/78/57/52/564785752.db2.gz NTTRMUPCZOFOHA-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN Cc1nc(Cc2nnc(SCC(=O)c3cccc([N+](=O)[O-])c3)o2)cs1 ZINC000133846404 564787136 /nfs/dbraw/zinc/78/71/36/564787136.db2.gz DAQMOXXZIFSOFE-UHFFFAOYSA-N 0 0 376.419 3.309 20 5 GGBDRN C[C@H](COCC(F)(F)F)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000067277071 564787953 /nfs/dbraw/zinc/78/79/53/564787953.db2.gz PZQVDKARRWPKGO-BDAKNGLRSA-N 0 0 384.738 3.099 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2I)c1 ZINC000067295099 564788616 /nfs/dbraw/zinc/78/86/16/564788616.db2.gz QWEHOCDECJBTBE-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN O=[N+]([O-])c1ncccc1OCc1nc(Cc2cccc(Br)c2)no1 ZINC000067428560 564792115 /nfs/dbraw/zinc/79/21/15/564792115.db2.gz XPIZRIJMTXKGGY-UHFFFAOYSA-N 0 0 391.181 3.305 20 5 GGBDRN CC(C)Oc1nnc(S[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000067429515 564792378 /nfs/dbraw/zinc/79/23/78/564792378.db2.gz GZANTLQDVQGXTO-LBPRGKRZSA-N 0 0 380.451 3.131 20 5 GGBDRN CCN(C(=O)c1cc(I)cc([N+](=O)[O-])c1)c1cccnc1 ZINC000134103469 564793732 /nfs/dbraw/zinc/79/37/32/564793732.db2.gz QDCMJDKESKHWEC-UHFFFAOYSA-N 0 0 397.172 3.261 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1Cl ZINC000067538717 564795040 /nfs/dbraw/zinc/79/50/40/564795040.db2.gz NHNBJZOHZGEAIF-JTQLQIEISA-N 0 0 382.825 3.143 20 5 GGBDRN C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000134151032 564795322 /nfs/dbraw/zinc/79/53/22/564795322.db2.gz GOMPAWXULVPJHB-SNVBAGLBSA-N 0 0 386.239 3.029 20 5 GGBDRN C[C@@H](CC(=O)c1ccccc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000134156414 564795418 /nfs/dbraw/zinc/79/54/18/564795418.db2.gz KGZPRFKLDUSYOO-NSHDSACASA-N 0 0 382.825 3.188 20 5 GGBDRN CC(=O)Nc1nnc(SCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000134228492 564797315 /nfs/dbraw/zinc/79/73/15/564797315.db2.gz QLILNWYZJWROGG-UHFFFAOYSA-N 0 0 377.407 3.352 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000067813638 564799705 /nfs/dbraw/zinc/79/97/05/564799705.db2.gz NVBZXFNLXCXMDR-SSDOTTSWSA-N 0 0 375.187 3.423 20 5 GGBDRN COc1ccc(CC(=O)Nc2nnc(-c3ccsc3)s2)cc1[N+](=O)[O-] ZINC000067818289 564799900 /nfs/dbraw/zinc/79/99/00/564799900.db2.gz LLRAQHFZULVKGI-UHFFFAOYSA-N 0 0 376.419 3.365 20 5 GGBDRN O=C(COc1ccccc1Br)NCCc1ccc([N+](=O)[O-])cc1 ZINC000134361015 564801288 /nfs/dbraw/zinc/80/12/88/564801288.db2.gz JDRVIDONXDXLEJ-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN CCc1nc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000067879761 564801686 /nfs/dbraw/zinc/80/16/86/564801686.db2.gz POOLDPGPAQFFLQ-UHFFFAOYSA-N 0 0 375.859 3.088 20 5 GGBDRN CCOCCCNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000134482552 564804340 /nfs/dbraw/zinc/80/43/40/564804340.db2.gz AXSUFPWWYVOXRV-UHFFFAOYSA-N 0 0 387.223 3.244 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCc2nnnn2-c2ccccc2Br)c1 ZINC000067952456 564804321 /nfs/dbraw/zinc/80/43/21/564804321.db2.gz PQOYEHCQWYZJOX-UHFFFAOYSA-N 0 0 390.197 3.220 20 5 GGBDRN CC(C)(C(=O)N[C@H]1CCc2c1cccc2Br)n1cc([N+](=O)[O-])cn1 ZINC000068031283 564806959 /nfs/dbraw/zinc/80/69/59/564806959.db2.gz LNINWHKAVSGBBG-AWEZNQCLSA-N 0 0 393.241 3.093 20 5 GGBDRN O=C(CSCCCNc1ncccn1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000068068037 564807517 /nfs/dbraw/zinc/80/75/17/564807517.db2.gz MUNRFUFBCWASMP-UHFFFAOYSA-N 0 0 381.845 3.212 20 5 GGBDRN CCC1(CO)CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CC1 ZINC000134589144 564808141 /nfs/dbraw/zinc/80/81/41/564808141.db2.gz PIFOLHNCPNLLKR-UHFFFAOYSA-N 0 0 385.258 3.290 20 5 GGBDRN O=C(NCc1nccs1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000134617174 564809212 /nfs/dbraw/zinc/80/92/12/564809212.db2.gz QPNBYHMHHNVAFE-UHFFFAOYSA-N 0 0 398.231 3.474 20 5 GGBDRN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)S(=O)(=O)c1cccs1 ZINC000134616031 564809370 /nfs/dbraw/zinc/80/93/70/564809370.db2.gz GXWGRKLPLRQYPZ-UHFFFAOYSA-N 0 0 379.419 3.132 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@H]1CCOC2(CCCCC2)C1 ZINC000134658894 564810515 /nfs/dbraw/zinc/81/05/15/564810515.db2.gz WBFGKBPRXVNISG-LBPRGKRZSA-N 0 0 388.873 3.408 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(c2ncccc2Cl)CC1 ZINC000134709772 564812939 /nfs/dbraw/zinc/81/29/39/564812939.db2.gz GDFUEPHIKUWIBE-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN C[C@@H](NC(=O)c1[nH]nc(C2CC2)c1Br)c1cccc([N+](=O)[O-])c1 ZINC000068437444 564818620 /nfs/dbraw/zinc/81/86/20/564818620.db2.gz KMDRZMTYPQULAS-MRVPVSSYSA-N 0 0 379.214 3.449 20 5 GGBDRN CCCc1n[nH]c(C(=O)N(C)Cc2ccc(Br)s2)c1[N+](=O)[O-] ZINC000068477084 564820469 /nfs/dbraw/zinc/82/04/69/564820469.db2.gz RSNLCKDXRZVESW-UHFFFAOYSA-N 0 0 387.259 3.367 20 5 GGBDRN O=C(COc1ccccc1Br)NCCc1cccc([N+](=O)[O-])c1 ZINC000134962968 564820485 /nfs/dbraw/zinc/82/04/85/564820485.db2.gz RURJGKKLIKPDAA-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN Cc1n[nH]c(C(=O)NC[C@@H](C)Sc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000068568184 564822876 /nfs/dbraw/zinc/82/28/76/564822876.db2.gz LMBYZKHBSATHNN-MRVPVSSYSA-N 0 0 399.270 3.299 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)c(F)c2)c([N+](=O)[O-])c1 ZINC000135059147 564823171 /nfs/dbraw/zinc/82/31/71/564823171.db2.gz NFXMBASRBOFORA-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000135055972 564823190 /nfs/dbraw/zinc/82/31/90/564823190.db2.gz ICBGOJXFOCGIKM-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ncccc1Br ZINC000135234653 564825923 /nfs/dbraw/zinc/82/59/23/564825923.db2.gz HTGVULRVRSQLCH-UHFFFAOYSA-N 0 0 386.227 3.116 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1cccc2cccnc21 ZINC000068838880 564827758 /nfs/dbraw/zinc/82/77/58/564827758.db2.gz MCVCPZASLPLJLV-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN Cc1ccnc(NC(=O)CN(C)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000068901667 564828748 /nfs/dbraw/zinc/82/87/48/564828748.db2.gz IARAUXBHGYVROO-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000068938502 564829728 /nfs/dbraw/zinc/82/97/28/564829728.db2.gz NPKGVTZRQJOPHE-GFCCVEGCSA-N 0 0 386.788 3.189 20 5 GGBDRN CC(C)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)CC(F)F ZINC000135381097 564829956 /nfs/dbraw/zinc/82/99/56/564829956.db2.gz GHXUDPSWQLESSM-UHFFFAOYSA-N 0 0 380.189 3.271 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000068950721 564830582 /nfs/dbraw/zinc/83/05/82/564830582.db2.gz HCTKDNQSWQQSDG-UHFFFAOYSA-N 0 0 387.820 3.250 20 5 GGBDRN COCCCN(Cc1ccncc1)c1ncc([N+](=O)[O-])cc1Br ZINC000135491277 564833088 /nfs/dbraw/zinc/83/30/88/564833088.db2.gz KPYRQGUQIYBMFE-UHFFFAOYSA-N 0 0 381.230 3.190 20 5 GGBDRN C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCN1CC(F)(F)F ZINC000135536356 564834253 /nfs/dbraw/zinc/83/42/53/564834253.db2.gz UPPXVXRJIZVDDR-VIFPVBQESA-N 0 0 380.754 3.349 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1cc2ccccc2[nH]1 ZINC000135534365 564834529 /nfs/dbraw/zinc/83/45/29/564834529.db2.gz YONXPWWKQGADPL-UHFFFAOYSA-N 0 0 379.825 3.251 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000135603692 564836430 /nfs/dbraw/zinc/83/64/30/564836430.db2.gz MCYYWJKNYJQOOF-UHFFFAOYSA-N 0 0 383.235 3.382 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccc(Br)cc1 ZINC000069513732 564840682 /nfs/dbraw/zinc/84/06/82/564840682.db2.gz SFSIPFYCNURZTI-GFCCVEGCSA-N 0 0 399.222 3.063 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCOc2ncc(Cl)cc2Cl)c1 ZINC000135863625 564841957 /nfs/dbraw/zinc/84/19/57/564841957.db2.gz ODIPAWYWVGRFNG-UHFFFAOYSA-N 0 0 386.191 3.114 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2sccc2Br)c(F)c1 ZINC000069650790 564843015 /nfs/dbraw/zinc/84/30/15/564843015.db2.gz ZSWSWMRJIGPAOQ-UHFFFAOYSA-N 0 0 395.231 3.036 20 5 GGBDRN O=C(NO[C@@H]1CCCCO1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000136012882 564844100 /nfs/dbraw/zinc/84/41/00/564844100.db2.gz UJXYIJKLRVPVCP-SNVBAGLBSA-N 0 0 379.594 3.199 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(Br)cs2)cc([N+](=O)[O-])c1 ZINC000136149441 564845510 /nfs/dbraw/zinc/84/55/10/564845510.db2.gz SSXJIBWBBWNTDT-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN O=C(NCCNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1Cl ZINC000136407097 564850151 /nfs/dbraw/zinc/85/01/51/564850151.db2.gz LOOUDAYNUGJAIL-UHFFFAOYSA-N 0 0 382.203 3.061 20 5 GGBDRN O=[N+]([O-])c1c(Sc2nnnn2-c2ccc(Cl)cc2)nc2sccn21 ZINC000070793996 564851445 /nfs/dbraw/zinc/85/14/45/564851445.db2.gz KDGDSYWEFLAPPJ-UHFFFAOYSA-N 0 0 379.814 3.084 20 5 GGBDRN CCCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCS(=O)(=O)C1 ZINC000136630536 564852873 /nfs/dbraw/zinc/85/28/73/564852873.db2.gz RNOLIDPTWCXEGU-GFCCVEGCSA-N 0 0 389.861 3.069 20 5 GGBDRN O=C(NCc1ccc(F)c(Cl)c1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136817161 564855300 /nfs/dbraw/zinc/85/53/00/564855300.db2.gz OJKZANWJCBQIOV-UHFFFAOYSA-N 0 0 384.816 3.402 20 5 GGBDRN COc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c1 ZINC000072068301 564861126 /nfs/dbraw/zinc/86/11/26/564861126.db2.gz GHNZHNUNSLQXLY-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(OC)c(Br)c2)c1 ZINC000072070923 564861197 /nfs/dbraw/zinc/86/11/97/564861197.db2.gz QMWKIVBJQAGSCW-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=C(Cc1cc(F)ccc1Br)NCCc1ccc([N+](=O)[O-])cc1 ZINC000137370779 564862450 /nfs/dbraw/zinc/86/24/50/564862450.db2.gz OKNZMELTFRADBB-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN CSCCN(C)[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000138213127 564864844 /nfs/dbraw/zinc/86/48/44/564864844.db2.gz UJWQBVZNSAMQQT-NSHDSACASA-N 0 0 380.495 3.340 20 5 GGBDRN CSCCN(C)[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000138213254 564864996 /nfs/dbraw/zinc/86/49/96/564864996.db2.gz UJWQBVZNSAMQQT-LLVKDONJSA-N 0 0 380.495 3.340 20 5 GGBDRN Cc1csc(C2(NS(=O)(=O)c3cccc([N+](=O)[O-])c3C)CCCC2)n1 ZINC000079035734 564865807 /nfs/dbraw/zinc/86/58/07/564865807.db2.gz LJTXKEUVDQKMSH-UHFFFAOYSA-N 0 0 381.479 3.416 20 5 GGBDRN O=C(Cc1cc2c(cc1Br)OCCO2)Nc1ccc([N+](=O)[O-])cc1 ZINC000079289601 564866835 /nfs/dbraw/zinc/86/68/35/564866835.db2.gz KVFFWLDRHCBLNI-UHFFFAOYSA-N 0 0 393.193 3.310 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCc1ccccc1Br ZINC000138451456 564866984 /nfs/dbraw/zinc/86/69/84/564866984.db2.gz YESGCNWZKBDDDS-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN Cc1nn(C)c(Sc2nnc(NCc3ccc(F)cc3)s2)c1[N+](=O)[O-] ZINC000079353664 564867795 /nfs/dbraw/zinc/86/77/95/564867795.db2.gz FZCHVHXIKDQVNV-UHFFFAOYSA-N 0 0 380.430 3.391 20 5 GGBDRN O=[N+]([O-])c1c(NCc2cc3c(c(Br)c2)OCO3)nc2sccn21 ZINC000140034661 564871241 /nfs/dbraw/zinc/87/12/41/564871241.db2.gz MIEPJJHHKYFYOC-UHFFFAOYSA-N 0 0 397.210 3.407 20 5 GGBDRN O=C(CSc1nnc(NCC(F)(F)F)s1)Nc1ccccc1[N+](=O)[O-] ZINC000140363249 564871380 /nfs/dbraw/zinc/87/13/80/564871380.db2.gz PREQYPKEJWFOKO-UHFFFAOYSA-N 0 0 393.372 3.151 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000092707595 564881430 /nfs/dbraw/zinc/88/14/30/564881430.db2.gz WLMGPWHYOICCOF-CQSZACIVSA-N 0 0 398.301 3.486 20 5 GGBDRN CCc1nn(C)c(N2CCO[C@H](c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000092829151 564882157 /nfs/dbraw/zinc/88/21/57/564882157.db2.gz SAOJLRTUGUDMON-AWEZNQCLSA-N 0 0 395.257 3.231 20 5 GGBDRN Cn1cnc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)n1 ZINC000092851525 564882781 /nfs/dbraw/zinc/88/27/81/564882781.db2.gz CXKGDKRMWDHPDV-UHFFFAOYSA-N 0 0 392.213 3.036 20 5 GGBDRN CCc1nn(C)c(NC[C@H](O)COc2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000092829174 564882839 /nfs/dbraw/zinc/88/28/39/564882839.db2.gz FSZCMLNXDPFFJR-VIFPVBQESA-N 0 0 389.239 3.049 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN(CCCO)CC(F)(F)F)cs2)c1 ZINC000093043102 564883357 /nfs/dbraw/zinc/88/33/57/564883357.db2.gz YNCVTGHKOUHXRE-UHFFFAOYSA-N 0 0 375.372 3.465 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)Nc1ccncc1Br ZINC000147725181 564883952 /nfs/dbraw/zinc/88/39/52/564883952.db2.gz AZJIIBXCNZBQLY-UHFFFAOYSA-N 0 0 392.618 3.207 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccc(Br)c([N+](=O)[O-])c1)CC2 ZINC000093613480 564887683 /nfs/dbraw/zinc/88/76/83/564887683.db2.gz BXCTXKAXBOGTDD-CVEARBPZSA-N 0 0 399.285 3.109 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3cc(O)ccc3Br)C2)nc1 ZINC000093534648 564887831 /nfs/dbraw/zinc/88/78/31/564887831.db2.gz XFJVJSXVEJEJAU-GFCCVEGCSA-N 0 0 393.241 3.144 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000150730249 564888129 /nfs/dbraw/zinc/88/81/29/564888129.db2.gz JGTVWIRGUNQIAC-UHFFFAOYSA-N 0 0 392.209 3.359 20 5 GGBDRN Cn1cc(-c2csc(NC(=O)CSc3ccccc3[N+](=O)[O-])n2)cn1 ZINC000150730775 564888466 /nfs/dbraw/zinc/88/84/66/564888466.db2.gz MIPPOXFXYXSJCL-UHFFFAOYSA-N 0 0 375.435 3.183 20 5 GGBDRN O=C(Nc1ccccc1-n1ccnn1)c1ccc([N+](=O)[O-])cc1Br ZINC000150713744 564888480 /nfs/dbraw/zinc/88/84/80/564888480.db2.gz NRMRUJNXDYHETG-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CN(Cc1cc([O-])ccc1[N+](=O)[O-])[C@@H](CO)c1cccc(Br)c1 ZINC000093815433 564890677 /nfs/dbraw/zinc/89/06/77/564890677.db2.gz UWJZMSNSYWBAGF-INIZCTEOSA-N 0 0 381.226 3.228 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)C2)n1 ZINC000150797749 564891078 /nfs/dbraw/zinc/89/10/78/564891078.db2.gz GZIHJKQDQJPMTQ-JTQLQIEISA-N 0 0 395.213 3.069 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000150789677 564891122 /nfs/dbraw/zinc/89/11/22/564891122.db2.gz YZGCJUCHENNUJL-CYBMUJFWSA-N 0 0 382.463 3.363 20 5 GGBDRN COc1cccc(Br)c1OC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000150821245 564891840 /nfs/dbraw/zinc/89/18/40/564891840.db2.gz UXNALPUCIJHGDC-UHFFFAOYSA-N 0 0 398.213 3.175 20 5 GGBDRN COc1cc(NC[C@H](O)COc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000150919052 564897320 /nfs/dbraw/zinc/89/73/20/564897320.db2.gz ZBFHDTKYWPZYJT-LBPRGKRZSA-N 0 0 397.225 3.218 20 5 GGBDRN CCc1nn(C)c(NCC(=O)Nc2ccc(Br)c(C)c2)c1[N+](=O)[O-] ZINC000094152318 564898004 /nfs/dbraw/zinc/89/80/04/564898004.db2.gz INGRBCLOQZXANT-UHFFFAOYSA-N 0 0 396.245 3.012 20 5 GGBDRN CC(C)CO[C@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000151014368 564901583 /nfs/dbraw/zinc/90/15/83/564901583.db2.gz FPAZJWOVJAHXGW-NSHDSACASA-N 0 0 397.280 3.337 20 5 GGBDRN Cn1cc(-c2csc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000151072523 564903826 /nfs/dbraw/zinc/90/38/26/564903826.db2.gz LIJDCCWNJATKKR-UHFFFAOYSA-N 0 0 375.435 3.183 20 5 GGBDRN COc1cccc(CNC(=O)COc2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000151145938 564907395 /nfs/dbraw/zinc/90/73/95/564907395.db2.gz OKEDGCYEEUGADO-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN COc1ccccc1CNC(=O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000151146670 564907550 /nfs/dbraw/zinc/90/75/50/564907550.db2.gz VAZXVLZWBANIRM-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN O=C(COc1ccc(Br)cc1[N+](=O)[O-])NCCCc1ccccc1 ZINC000151157628 564908401 /nfs/dbraw/zinc/90/84/01/564908401.db2.gz LGCGIXFXXQAHSA-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccc(Cl)c(F)c1 ZINC000151220701 564911106 /nfs/dbraw/zinc/91/11/06/564911106.db2.gz HRQMYWVWQXGNPB-LLVKDONJSA-N 0 0 386.788 3.483 20 5 GGBDRN Cc1nn(C)c(C(=O)NCC(C)(C)c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000098098728 564912171 /nfs/dbraw/zinc/91/21/71/564912171.db2.gz PBSVPPVNBIAQRG-UHFFFAOYSA-N 0 0 395.257 3.107 20 5 GGBDRN Cn1c(=O)oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)cc21 ZINC000151305792 564914311 /nfs/dbraw/zinc/91/43/11/564914311.db2.gz WFCBJXCINFFPPN-UHFFFAOYSA-N 0 0 392.165 3.055 20 5 GGBDRN Cc1nc(CCNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])sc1C ZINC000151361051 564916306 /nfs/dbraw/zinc/91/63/06/564916306.db2.gz ZRCGDYYEEOBIGM-JTQLQIEISA-N 0 0 383.857 3.448 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cc(Br)ccc3F)CC2)nc1 ZINC000101557069 564917589 /nfs/dbraw/zinc/91/75/89/564917589.db2.gz MBYOSDGAYAZBPP-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2coc(-c3cccs3)n2)c([N+](=O)[O-])c1 ZINC000101569873 564917864 /nfs/dbraw/zinc/91/78/64/564917864.db2.gz XRMBVBAKJHDXLN-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)Cc1ccc(Cl)nc1 ZINC000101574115 564918266 /nfs/dbraw/zinc/91/82/66/564918266.db2.gz BCKJSWOMPCUTFU-UHFFFAOYSA-N 0 0 383.857 3.384 20 5 GGBDRN O=C1[C@H](Nc2ncc([N+](=O)[O-])cc2Br)CCN1C1CCCCC1 ZINC000151458688 564921413 /nfs/dbraw/zinc/92/14/13/564921413.db2.gz ODOJFZYWCZLKHW-CYBMUJFWSA-N 0 0 383.246 3.098 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1cc(Br)cn1C ZINC000151494299 564922546 /nfs/dbraw/zinc/92/25/46/564922546.db2.gz KSSFNPCNCKVCNO-NSHDSACASA-N 0 0 395.257 3.155 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H](O)Cc1ccccc1 ZINC000151512991 564923123 /nfs/dbraw/zinc/92/31/23/564923123.db2.gz JIFCPVFHSPKGQR-ZBEGNZNMSA-N 0 0 393.237 3.079 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(O)c(Br)c2)c1 ZINC000151514660 564923968 /nfs/dbraw/zinc/92/39/68/564923968.db2.gz JSMOMXSGUNKJJG-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCC2(c3cccc(Cl)c3)CC2)cc1 ZINC000151524557 564924496 /nfs/dbraw/zinc/92/44/96/564924496.db2.gz LMVBBMROORYKDK-UHFFFAOYSA-N 0 0 380.853 3.399 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)Cc1cc(Br)cn1C ZINC000151537435 564925578 /nfs/dbraw/zinc/92/55/78/564925578.db2.gz AKDDAINFKDQWCT-UHFFFAOYSA-N 0 0 395.257 3.075 20 5 GGBDRN O=C(NCc1ccc(F)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000102106847 564925615 /nfs/dbraw/zinc/92/56/15/564925615.db2.gz ABKRIVPGWNZKNS-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1cc(Br)ccc1OC(F)F ZINC000102203397 564926626 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CCOc1ccc(Br)cc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000102742941 564934216 /nfs/dbraw/zinc/93/42/16/564934216.db2.gz VZMSHKJSMGTTKW-UHFFFAOYSA-N 0 0 397.229 3.326 20 5 GGBDRN CS(=O)(=O)Cc1nc(COc2ccc([N+](=O)[O-])c3ccccc23)cs1 ZINC000151739412 564935479 /nfs/dbraw/zinc/93/54/79/564935479.db2.gz YIUHEFMNVIJYND-UHFFFAOYSA-N 0 0 378.431 3.328 20 5 GGBDRN CN(C(=O)c1cc(Br)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000102832977 564937147 /nfs/dbraw/zinc/93/71/47/564937147.db2.gz PYDFTFCBKQVCKC-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Sc2nncs2)c(Cl)c1 ZINC000102861878 564938347 /nfs/dbraw/zinc/93/83/47/564938347.db2.gz ZYKNUXPKFGLYLZ-UHFFFAOYSA-N 0 0 396.841 3.086 20 5 GGBDRN O=C(Nc1nnc(-c2ccccc2Cl)s1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000102900719 564938944 /nfs/dbraw/zinc/93/89/44/564938944.db2.gz UYKFXOOMARHVBZ-UHFFFAOYSA-N 0 0 377.769 3.120 20 5 GGBDRN C[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@@H](O)Cc1ccccc1 ZINC000151884977 564940261 /nfs/dbraw/zinc/94/02/61/564940261.db2.gz KMEMUTDMRLUZEU-BZNIZROVSA-N 0 0 393.237 3.079 20 5 GGBDRN COC[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000151924756 564941189 /nfs/dbraw/zinc/94/11/89/564941189.db2.gz VZDBRJHXPAUTJQ-NSHDSACASA-N 0 0 378.372 3.247 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c(Cl)c1 ZINC000103059678 564941903 /nfs/dbraw/zinc/94/19/03/564941903.db2.gz OLPXUCKZMTVKEQ-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Br)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000103036976 564942028 /nfs/dbraw/zinc/94/20/28/564942028.db2.gz AFOKIXLDGZLPKL-ZDUSSCGKSA-N 0 0 390.237 3.366 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1ccccc1 ZINC000152052442 564945102 /nfs/dbraw/zinc/94/51/02/564945102.db2.gz NWDKWKDGPKYLOR-JTQLQIEISA-N 0 0 392.209 3.114 20 5 GGBDRN CCn1c(Sc2cc(Cl)nc(N)n2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000152075359 564945915 /nfs/dbraw/zinc/94/59/15/564945915.db2.gz DVTJIRLVWJVNDD-UHFFFAOYSA-N 0 0 377.817 3.050 20 5 GGBDRN C[S@](=O)c1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000152053534 564946065 /nfs/dbraw/zinc/94/60/65/564946065.db2.gz JKMMUMRCFZTITL-HSZRJFAPSA-N 0 0 397.250 3.276 20 5 GGBDRN O=c1c(Cl)c(NC[C@@H]2CSCCS2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000152265036 564952328 /nfs/dbraw/zinc/95/23/28/564952328.db2.gz SCWZCSYBLRDBNF-GFCCVEGCSA-N 0 0 398.897 3.055 20 5 GGBDRN C[C@@H](CC(=O)c1cccs1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000152308634 564954175 /nfs/dbraw/zinc/95/41/75/564954175.db2.gz CBZODKALMFXZHR-VIFPVBQESA-N 0 0 388.854 3.250 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)CC(=O)c2cccs2)c1C ZINC000152303321 564954592 /nfs/dbraw/zinc/95/45/92/564954592.db2.gz GPYXJMAHEYIKIE-LLVKDONJSA-N 0 0 382.463 3.213 20 5 GGBDRN Cc1ncsc1CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000104472287 564955726 /nfs/dbraw/zinc/95/57/26/564955726.db2.gz GILPHGLGLSZVSB-UHFFFAOYSA-N 0 0 375.328 3.231 20 5 GGBDRN C[S@@](=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000152339216 564956153 /nfs/dbraw/zinc/95/61/53/564956153.db2.gz LGZINRUURZMZPX-QHCPKHFHSA-N 0 0 397.250 3.488 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H](C)CC(=O)c2cccs2)c1C ZINC000152340082 564956267 /nfs/dbraw/zinc/95/62/67/564956267.db2.gz NUVWTVBGIHGXLU-NSHDSACASA-N 0 0 382.463 3.213 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C12CCC2 ZINC000152389680 564957806 /nfs/dbraw/zinc/95/78/06/564957806.db2.gz HYWUPASJWXWTID-KBPBESRZSA-N 0 0 383.242 3.435 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C12CCC2 ZINC000152389586 564958096 /nfs/dbraw/zinc/95/80/96/564958096.db2.gz HYWUPASJWXWTID-UONOGXRCSA-N 0 0 383.242 3.435 20 5 GGBDRN CN(CCC(=O)OC(C)(C)C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000152423514 564958783 /nfs/dbraw/zinc/95/87/83/564958783.db2.gz JMNGHRFCCRFCMS-UHFFFAOYSA-N 0 0 387.230 3.161 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000152442636 564958862 /nfs/dbraw/zinc/95/88/62/564958862.db2.gz IBJMQQYKRNXTAX-AWEZNQCLSA-N 0 0 395.209 3.472 20 5 GGBDRN C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1CCn1cc([N+](=O)[O-])cn1 ZINC000152452305 564959683 /nfs/dbraw/zinc/95/96/83/564959683.db2.gz WKHOJSVDACQDLR-WBMJQRKESA-N 0 0 395.257 3.016 20 5 GGBDRN Cc1noc(C)c1C[C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000152467147 564960605 /nfs/dbraw/zinc/96/06/05/564960605.db2.gz APKLQCVIZCCUQO-SECBINFHSA-N 0 0 396.241 3.252 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCCC[C@H]1c1ncon1 ZINC000152666482 564968145 /nfs/dbraw/zinc/96/81/45/564968145.db2.gz OYYUIQSBHHTBHI-LBPRGKRZSA-N 0 0 381.186 3.108 20 5 GGBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000152695839 564968604 /nfs/dbraw/zinc/96/86/04/564968604.db2.gz MIJCVFZRMDXFRT-SNVBAGLBSA-N 0 0 379.210 3.424 20 5 GGBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000152703951 564969030 /nfs/dbraw/zinc/96/90/30/564969030.db2.gz VUYIFHFDNHASFA-LLVKDONJSA-N 0 0 393.237 3.353 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Br)cc1C(F)(F)F ZINC000152718112 564969508 /nfs/dbraw/zinc/96/95/08/564969508.db2.gz YOKQQEBMJCJUOS-UHFFFAOYSA-N 0 0 393.119 3.211 20 5 GGBDRN NC(=O)c1ccc(CSCc2nc(-c3cccs3)no2)c([N+](=O)[O-])c1 ZINC000105626753 564970621 /nfs/dbraw/zinc/97/06/21/564970621.db2.gz NCUWUBOEAURSDE-UHFFFAOYSA-N 0 0 376.419 3.239 20 5 GGBDRN Nc1nc(Cl)cc(Oc2cc([N+](=O)[O-])ccc2I)n1 ZINC000152791910 564971323 /nfs/dbraw/zinc/97/13/23/564971323.db2.gz NJGIEJIMJGFXLN-UHFFFAOYSA-N 0 0 392.540 3.017 20 5 GGBDRN NC(=O)Nc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000152781776 564971331 /nfs/dbraw/zinc/97/13/31/564971331.db2.gz YGHNOKLXXZOFOU-UHFFFAOYSA-N 0 0 393.197 3.029 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc(C(N)=O)cc2F)cc1[N+](=O)[O-] ZINC000152852393 564974729 /nfs/dbraw/zinc/97/47/29/564974729.db2.gz GQLZVOCDBFGLOL-UHFFFAOYSA-N 0 0 396.172 3.156 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1cccc2c[nH]nc21 ZINC000152883563 564975610 /nfs/dbraw/zinc/97/56/10/564975610.db2.gz MULAMRYWZXBOCI-UHFFFAOYSA-N 0 0 375.182 3.415 20 5 GGBDRN O=C(NC[C@@H]1CCCC[C@H]1O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000152915702 564977207 /nfs/dbraw/zinc/97/72/07/564977207.db2.gz NJFNYLFTQDAFOK-QPUJVOFHSA-N 0 0 391.649 3.292 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)s1 ZINC000152942391 564977820 /nfs/dbraw/zinc/97/78/20/564977820.db2.gz IPRZNLAGFRBHGN-KBPBESRZSA-N 0 0 382.463 3.073 20 5 GGBDRN C[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl)[C@H]1CCOC1 ZINC000153003218 564981210 /nfs/dbraw/zinc/98/12/10/564981210.db2.gz KAPVISDVZOXUNU-YUMQZZPRSA-N 0 0 377.622 3.166 20 5 GGBDRN CCCc1nc(C[S@](=O)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cs1 ZINC000106300982 564981495 /nfs/dbraw/zinc/98/14/95/564981495.db2.gz YWERTYSRHFDUGT-VWLOTQADSA-N 0 0 382.463 3.319 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)cc1 ZINC000153040458 564982214 /nfs/dbraw/zinc/98/22/14/564982214.db2.gz UOCNYXIZDRKTJP-HNNXBMFYSA-N 0 0 382.825 3.090 20 5 GGBDRN COc1ccc(OC[C@@H](O)COc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000153151154 564985985 /nfs/dbraw/zinc/98/59/85/564985985.db2.gz VDADERSMXKCMEH-LBPRGKRZSA-N 0 0 398.209 3.185 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1nc(C(F)(F)F)cs1 ZINC000153177960 564986682 /nfs/dbraw/zinc/98/66/82/564986682.db2.gz RLEORRHAIMGGNP-UHFFFAOYSA-N 0 0 377.369 3.479 20 5 GGBDRN Cc1cnccc1NC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000153161152 564986800 /nfs/dbraw/zinc/98/68/00/564986800.db2.gz IELWRZYNSOXZGH-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C12CCC2 ZINC000153181198 564986807 /nfs/dbraw/zinc/98/68/07/564986807.db2.gz RUBCPBNRHWFVDY-HUUCEWRRSA-N 0 0 397.269 3.364 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCSc2ncccc21 ZINC000153210997 564988186 /nfs/dbraw/zinc/98/81/86/564988186.db2.gz DLDOHPLAEYEDHB-UHFFFAOYSA-N 0 0 394.250 3.434 20 5 GGBDRN COc1ccc(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(OC)c1 ZINC000153281428 564990402 /nfs/dbraw/zinc/99/04/02/564990402.db2.gz RNJADDRGGKBYMQ-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)[C@H](C)c1sc(C)nc1C ZINC000106896859 564990780 /nfs/dbraw/zinc/99/07/80/564990780.db2.gz NAOCOQQCIJIWOG-SNVBAGLBSA-N 0 0 385.467 3.058 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@H](C)c2sc(C)nc2C)c([N+](=O)[O-])c1 ZINC000106897028 564991055 /nfs/dbraw/zinc/99/10/55/564991055.db2.gz SXEPYGSMAJEQSI-SNVBAGLBSA-N 0 0 385.467 3.058 20 5 GGBDRN CCCn1c(C)cc(C(=O)Cn2cc(Br)cc([N+](=O)[O-])c2=O)c1C ZINC000153445801 564995258 /nfs/dbraw/zinc/99/52/58/564995258.db2.gz JOUJJHUWYXBMJM-UHFFFAOYSA-N 0 0 396.241 3.230 20 5 GGBDRN CCc1cccc(C)c1NC(=O)Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000153445091 564995292 /nfs/dbraw/zinc/99/52/92/564995292.db2.gz HLBJNZQXGDQARN-UHFFFAOYSA-N 0 0 394.225 3.029 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1coc(-c2cccs2)n1 ZINC000153449055 564995577 /nfs/dbraw/zinc/99/55/77/564995577.db2.gz YCDYQLHKLXQJGA-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1ccc(Br)cc1 ZINC000153448501 564995583 /nfs/dbraw/zinc/99/55/83/564995583.db2.gz JKIHCHMFICSZKG-UHFFFAOYSA-N 0 0 388.015 3.330 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1coc(-c2cccc(F)c2)n1 ZINC000153436295 564995596 /nfs/dbraw/zinc/99/55/96/564995596.db2.gz IVQOWMXCELUTHS-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN Cc1cc(C(=O)Cn2cc(Br)cc([N+](=O)[O-])c2=O)c(C)n1C1CC1 ZINC000153448672 564995718 /nfs/dbraw/zinc/99/57/18/564995718.db2.gz RYKYGLHFQNWIHU-UHFFFAOYSA-N 0 0 394.225 3.155 20 5 GGBDRN COCc1cc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000107702685 565001317 /nfs/dbraw/zinc/00/13/17/565001317.db2.gz JINUWIAYOQWBEW-UHFFFAOYSA-N 0 0 388.804 3.012 20 5 GGBDRN CN(C[C@@H]1CCCOC1)c1ccc(I)cc1[N+](=O)[O-] ZINC000107673950 565001481 /nfs/dbraw/zinc/00/14/81/565001481.db2.gz UJEKCMKEKLAGTA-JTQLQIEISA-N 0 0 376.194 3.062 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000107701417 565001515 /nfs/dbraw/zinc/00/15/15/565001515.db2.gz PVSVLYNSURWNPA-UONOGXRCSA-N 0 0 382.825 3.091 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000153604030 565002861 /nfs/dbraw/zinc/00/28/61/565002861.db2.gz IKFYBHUVPUBZIZ-UHFFFAOYSA-N 0 0 380.242 3.287 20 5 GGBDRN O=C(Cn1cc(Cl)cc([N+](=O)[O-])c1=O)Nc1ccccc1C(F)(F)F ZINC000153604845 565003217 /nfs/dbraw/zinc/00/32/17/565003217.db2.gz ITEBSSWHLVTEBZ-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN O=C(N[C@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1ccc([N+](=O)[O-])cc1Br ZINC000153619979 565003401 /nfs/dbraw/zinc/00/34/01/565003401.db2.gz HUEPKCHXFQZLMT-UBHSHLNASA-N 0 0 381.226 3.045 20 5 GGBDRN CN1C[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)CC1=O ZINC000153656072 565004577 /nfs/dbraw/zinc/00/45/77/565004577.db2.gz RWYQEGZGVMSSQS-SNVBAGLBSA-N 0 0 377.447 3.224 20 5 GGBDRN COc1cccc(Nc2nnc(SCCn3cc([N+](=O)[O-])cn3)s2)c1 ZINC000153647790 565004704 /nfs/dbraw/zinc/00/47/04/565004704.db2.gz FDNAHMSNSTZHNO-UHFFFAOYSA-N 0 0 378.439 3.187 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2csc(-c3ccco3)n2)cc1[N+](=O)[O-] ZINC000153665859 565005607 /nfs/dbraw/zinc/00/56/07/565005607.db2.gz QNBHFGLBVXNQOS-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1csc(-c2ccco2)n1 ZINC000153661934 565005667 /nfs/dbraw/zinc/00/56/67/565005667.db2.gz YQHOJZOTMSCVCK-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN C[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(=O)Nc1ccccc1 ZINC000153733821 565007875 /nfs/dbraw/zinc/00/78/75/565007875.db2.gz XFVNEPSOVXVSHK-SNVBAGLBSA-N 0 0 392.209 3.114 20 5 GGBDRN COCCn1c2ccc(Cl)cc2nc1SCCn1cc([N+](=O)[O-])cn1 ZINC000153724573 565007880 /nfs/dbraw/zinc/00/78/80/565007880.db2.gz BFWNFOXPVHWAPG-UHFFFAOYSA-N 0 0 381.845 3.233 20 5 GGBDRN O=[N+]([O-])c1nn(Cc2cc(Cl)c3c(c2)OCCCO3)cc1Br ZINC000108275860 565008679 /nfs/dbraw/zinc/00/86/79/565008679.db2.gz STSWSNVZLRPJLH-UHFFFAOYSA-N 0 0 388.605 3.417 20 5 GGBDRN Cc1nc(C)c(CCNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000108319476 565009643 /nfs/dbraw/zinc/00/96/43/565009643.db2.gz AIDHXANPXMJREA-JTQLQIEISA-N 0 0 383.857 3.448 20 5 GGBDRN 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Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC2(CC1)OCCCO2 ZINC000294318944 565207595 /nfs/dbraw/zinc/20/75/95/565207595.db2.gz VPZAICJSFKVZSB-UHFFFAOYSA-N 0 0 399.241 3.035 20 5 GGBDRN CS(=O)(=O)[C@H]1CCCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000294301422 565207816 /nfs/dbraw/zinc/20/78/16/565207816.db2.gz WYBVXCNTYQXLPU-ZDUSSCGKSA-N 0 0 380.388 3.013 20 5 GGBDRN CCOC(=O)[C@@H]1CCCc2sc(NC(=O)c3ccc([N+](=O)[O-])s3)nc21 ZINC000294315453 565207859 /nfs/dbraw/zinc/20/78/59/565207859.db2.gz VNVXJJCPAKATIY-MRVPVSSYSA-N 0 0 381.435 3.348 20 5 GGBDRN NS(=O)(=O)c1cccc(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)c1 ZINC000159515745 565209356 /nfs/dbraw/zinc/20/93/56/565209356.db2.gz ADLLMUJLUWPLME-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCOC[C@@H]1c1ccco1 ZINC000371773597 565209669 /nfs/dbraw/zinc/20/96/69/565209669.db2.gz SGRARQKVXWTKOO-CYBMUJFWSA-N 0 0 381.182 3.164 20 5 GGBDRN CS[C@H]1CCC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185654632 565213890 /nfs/dbraw/zinc/21/38/90/565213890.db2.gz BWLHNVNZXRYDGA-RYUDHWBXSA-N 0 0 381.479 3.096 20 5 GGBDRN CN(CCOc1ccc(Cl)cc1)C(=O)CSc1ccc([N+](=O)[O-])cn1 ZINC000159633116 565214108 /nfs/dbraw/zinc/21/41/08/565214108.db2.gz HHMSLIQKLSHEFR-UHFFFAOYSA-N 0 0 381.841 3.273 20 5 GGBDRN CC1(C)CCC[C@]1(O)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000294515008 565215342 /nfs/dbraw/zinc/21/53/42/565215342.db2.gz UCNLBBIGDWHNHV-HNNXBMFYSA-N 0 0 389.221 3.167 20 5 GGBDRN COc1cc(CNc2c(Br)cncc2[N+](=O)[O-])cc(OC)c1OC ZINC000270335647 565215866 /nfs/dbraw/zinc/21/58/66/565215866.db2.gz CUMSCCCICYQBQE-UHFFFAOYSA-N 0 0 398.213 3.390 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000185675418 565215973 /nfs/dbraw/zinc/21/59/73/565215973.db2.gz ADUPOFWMRUYBCL-CQSZACIVSA-N 0 0 379.825 3.279 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000185675398 565216214 /nfs/dbraw/zinc/21/62/14/565216214.db2.gz ADUPOFWMRUYBCL-AWEZNQCLSA-N 0 0 379.825 3.279 20 5 GGBDRN O=[N+]([O-])c1ccc(CSc2nnnn2CC(F)(F)F)c(C(F)(F)F)c1 ZINC000159723673 565216460 /nfs/dbraw/zinc/21/64/60/565216460.db2.gz QMIGQDDHAVQZEJ-UHFFFAOYSA-N 0 0 387.265 3.455 20 5 GGBDRN Cn1cnnc1Sc1ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])cc1Cl ZINC000294608098 565219733 /nfs/dbraw/zinc/21/97/33/565219733.db2.gz QOJWDZRBKALPIE-UHFFFAOYSA-N 0 0 383.861 3.394 20 5 GGBDRN CC(C)c1nnc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000270614438 565224080 /nfs/dbraw/zinc/22/40/80/565224080.db2.gz FWKMAXZRTZHMAY-MRVPVSSYSA-N 0 0 382.218 3.090 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCSC(F)(F)F ZINC000270688396 565225822 /nfs/dbraw/zinc/22/58/22/565225822.db2.gz GRBLIVUEGCDEBV-UHFFFAOYSA-N 0 0 384.401 3.316 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000294788863 565228297 /nfs/dbraw/zinc/22/82/97/565228297.db2.gz KKSFWAOUSYBTNM-ZBFHGGJFSA-N 0 0 381.226 3.141 20 5 GGBDRN COc1ccc(OCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000185912495 565229073 /nfs/dbraw/zinc/22/90/73/565229073.db2.gz JHDUYKYORIMGBJ-UHFFFAOYSA-N 0 0 395.209 3.408 20 5 GGBDRN CC(C)[C@]1(CO)CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000294859764 565231921 /nfs/dbraw/zinc/23/19/21/565231921.db2.gz SNCVWWAIRGXLTP-MRXNPFEDSA-N 0 0 385.258 3.228 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185970503 565232066 /nfs/dbraw/zinc/23/20/66/565232066.db2.gz PWLRHVVDUGVLJT-LLVKDONJSA-N 0 0 377.447 3.114 20 5 GGBDRN O=C(NCCOCC(F)(F)F)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160131214 565232621 /nfs/dbraw/zinc/23/26/21/565232621.db2.gz KYSOIGYQOMOMHW-UHFFFAOYSA-N 0 0 375.225 3.314 20 5 GGBDRN COc1ccc(NC(=O)c2cc(Br)c(C)nc2OC)c([N+](=O)[O-])c1 ZINC000185993229 565233216 /nfs/dbraw/zinc/23/32/16/565233216.db2.gz UFWYCLOGYZHCDC-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN Cc1cc(Cl)c(C(=O)N2CCCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000294880176 565233467 /nfs/dbraw/zinc/23/34/67/565233467.db2.gz QATJSXLPJCBWDO-UHFFFAOYSA-N 0 0 379.766 3.267 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000185980068 565234109 /nfs/dbraw/zinc/23/41/09/565234109.db2.gz GCFQHUIPHXMLRS-LLVKDONJSA-N 0 0 383.177 3.197 20 5 GGBDRN CCCCCC(=O)NC1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000270957279 565234118 /nfs/dbraw/zinc/23/41/18/565234118.db2.gz NJPDLLSWCPODET-UHFFFAOYSA-N 0 0 399.289 3.418 20 5 GGBDRN Cc1nc(N2CCO[C@H](c3ccc(F)c(Br)c3)C2)ncc1[N+](=O)[O-] ZINC000294901549 565234392 /nfs/dbraw/zinc/23/43/92/565234392.db2.gz HBPLKHIGVIVZID-AWEZNQCLSA-N 0 0 397.204 3.173 20 5 GGBDRN C[S@](=O)Cc1ccccc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000185995921 565234439 /nfs/dbraw/zinc/23/44/39/565234439.db2.gz QCCOPSLJQPOLSY-QHCPKHFHSA-N 0 0 397.250 3.488 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CSCC3CCS(=O)(=O)CC3)co2)cc1 ZINC000271005688 565235042 /nfs/dbraw/zinc/23/50/42/565235042.db2.gz IIZXPTVUQQGLFT-UHFFFAOYSA-N 0 0 382.463 3.308 20 5 GGBDRN C[S@@](=O)Cc1ccccc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000185995902 565235294 /nfs/dbraw/zinc/23/52/94/565235294.db2.gz QCCOPSLJQPOLSY-HSZRJFAPSA-N 0 0 397.250 3.488 20 5 GGBDRN CC(=O)c1sc2[nH]c(CSc3ccc([N+](=O)[O-])cn3)nc(=O)c2c1C ZINC000160205445 565235531 /nfs/dbraw/zinc/23/55/31/565235531.db2.gz ZWMNZFBBOBLIGO-UHFFFAOYSA-N 0 0 376.419 3.091 20 5 GGBDRN CC(C)[C@]1(CO)CCCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000294916536 565235588 /nfs/dbraw/zinc/23/55/88/565235588.db2.gz WGULCZSZEUPITI-MRXNPFEDSA-N 0 0 385.258 3.228 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000186046359 565236978 /nfs/dbraw/zinc/23/69/78/565236978.db2.gz QSUKOBCQWGVVND-LBPRGKRZSA-N 0 0 380.447 3.082 20 5 GGBDRN Nc1c(C(=O)NCc2cc3cc(Br)ccc3[nH]2)cccc1[N+](=O)[O-] ZINC000186053071 565237089 /nfs/dbraw/zinc/23/70/89/565237089.db2.gz BLFIPLLSFPANKK-UHFFFAOYSA-N 0 0 389.209 3.351 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1cc2cc(Br)ccc2[nH]1 ZINC000186056721 565237532 /nfs/dbraw/zinc/23/75/32/565237532.db2.gz OOQBOLGVGPOGCQ-UHFFFAOYSA-N 0 0 389.209 3.351 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000295012971 565239174 /nfs/dbraw/zinc/23/91/74/565239174.db2.gz VSOPXESVHNQECS-HOCLYGCPSA-N 0 0 381.226 3.141 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Sc1cccs1)C(=O)N1CCCC1 ZINC000160298444 565239866 /nfs/dbraw/zinc/23/98/66/565239866.db2.gz JYCRVYJDRHYIOH-UHFFFAOYSA-N 0 0 377.447 3.368 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000160350616 565241814 /nfs/dbraw/zinc/24/18/14/565241814.db2.gz XICAHWSFYAOFDG-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCCc2nc3c(s2)CCCC3)s1 ZINC000271213704 565242800 /nfs/dbraw/zinc/24/28/00/565242800.db2.gz ALRYCXRKXAYZTK-UHFFFAOYSA-N 0 0 387.508 3.050 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl)c1nccs1 ZINC000295077698 565243013 /nfs/dbraw/zinc/24/30/13/565243013.db2.gz DQYKOGCEIOIDSC-SSDOTTSWSA-N 0 0 396.277 3.440 20 5 GGBDRN CC(C)(C)c1csc(CCNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])n1 ZINC000271249946 565244811 /nfs/dbraw/zinc/24/48/11/565244811.db2.gz JBBUWYWRCSAPIH-UHFFFAOYSA-N 0 0 389.524 3.468 20 5 GGBDRN CC[C@]1(CO)CCCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)C1 ZINC000295113921 565245786 /nfs/dbraw/zinc/24/57/86/565245786.db2.gz IWXLXAHXQLXOFG-AWEZNQCLSA-N 0 0 397.280 3.075 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)Cc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000186221358 565247351 /nfs/dbraw/zinc/24/73/51/565247351.db2.gz NXRFORFOWGCBOZ-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271303581 565247747 /nfs/dbraw/zinc/24/77/47/565247747.db2.gz HEBDRBSHTWDVJU-LKFCYVNXSA-N 0 0 388.442 3.387 20 5 GGBDRN CO[C@H]1CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)[C@H](C)C1 ZINC000295157734 565248208 /nfs/dbraw/zinc/24/82/08/565248208.db2.gz ASTFAQXVCYWZNV-BDAKNGLRSA-N 0 0 383.253 3.090 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000186236491 565248897 /nfs/dbraw/zinc/24/88/97/565248897.db2.gz RYZBAEKRWONZCC-VIFPVBQESA-N 0 0 388.804 3.435 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000271351298 565249725 /nfs/dbraw/zinc/24/97/25/565249725.db2.gz XLLMPMUBBNTMRE-GXSJLCMTSA-N 0 0 378.372 3.389 20 5 GGBDRN C[C@@H]1C[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000271379918 565250515 /nfs/dbraw/zinc/25/05/15/565250515.db2.gz QTOXCWBTIAHJOX-RKDXNWHRSA-N 0 0 375.194 3.041 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271382354 565250908 /nfs/dbraw/zinc/25/09/08/565250908.db2.gz KGFBDGZJSUKENP-WCBMZHEXSA-N 0 0 376.481 3.045 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC[C@@H](Nc3ccccc3)C2)s1 ZINC000271401260 565252222 /nfs/dbraw/zinc/25/22/22/565252222.db2.gz NVSLKPORUSYRQU-CYBMUJFWSA-N 0 0 381.479 3.141 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000271414006 565253148 /nfs/dbraw/zinc/25/31/48/565253148.db2.gz QAXWTRLPVNISRE-LLVKDONJSA-N 0 0 382.463 3.062 20 5 GGBDRN CC1(C)C[C@H](O)CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2Cl)C1 ZINC000295245619 565254173 /nfs/dbraw/zinc/25/41/73/565254173.db2.gz FDTZPNZYPDLYNC-SECBINFHSA-N 0 0 397.280 3.073 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCCN(c3ccccc3)C2)s1 ZINC000271463596 565254392 /nfs/dbraw/zinc/25/43/92/565254392.db2.gz ZAPAFPAQLFKCFS-LBPRGKRZSA-N 0 0 381.479 3.141 20 5 GGBDRN Cc1nc(N2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)sc1C ZINC000160627768 565254526 /nfs/dbraw/zinc/25/45/26/565254526.db2.gz UYKQJEOZWBVOHK-UHFFFAOYSA-N 0 0 380.857 3.284 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCN(CC(F)(F)F)C1 ZINC000186344324 565255693 /nfs/dbraw/zinc/25/56/93/565255693.db2.gz IPGDOAXTFZYQNC-LLVKDONJSA-N 0 0 379.766 3.139 20 5 GGBDRN COC1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCCCC1 ZINC000186330887 565255982 /nfs/dbraw/zinc/25/59/82/565255982.db2.gz AFJLUAUCSOOCKN-UHFFFAOYSA-N 0 0 385.258 3.365 20 5 GGBDRN CSc1cccc(C(=O)NCc2nc(-c3cccs3)no2)c1[N+](=O)[O-] ZINC000186329688 565256221 /nfs/dbraw/zinc/25/62/21/565256221.db2.gz QAZCGBNKJNTCRM-UHFFFAOYSA-N 0 0 376.419 3.358 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC(c2ccsc2)CC1 ZINC000186337081 565256244 /nfs/dbraw/zinc/25/62/44/565256244.db2.gz IKRBIABRJAZIMH-UHFFFAOYSA-N 0 0 382.463 3.233 20 5 GGBDRN CC(C)[C@H]1C[C@@H](Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])CCO1 ZINC000271513120 565256449 /nfs/dbraw/zinc/25/64/49/565256449.db2.gz YYZUBNYBKWXWTM-IINYFYTJSA-N 0 0 378.397 3.207 20 5 GGBDRN Cc1cc(Cl)c(C(=O)N2CCC[C@@](O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000295308351 565258685 /nfs/dbraw/zinc/25/86/85/565258685.db2.gz ORHUDAGVQIQVAR-AWEZNQCLSA-N 0 0 380.750 3.476 20 5 GGBDRN Cc1csc([C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(F)(F)F)n1 ZINC000295316645 565258910 /nfs/dbraw/zinc/25/89/10/565258910.db2.gz IDMTZEOVBPPCCU-LBPRGKRZSA-N 0 0 375.328 3.158 20 5 GGBDRN CC(C)C[C@@H](CO)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000160796507 565259616 /nfs/dbraw/zinc/25/96/16/565259616.db2.gz SLUGXADPLOVPKD-VIFPVBQESA-N 0 0 379.638 3.148 20 5 GGBDRN C[C@H]1CCCCN(C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000186437066 565260928 /nfs/dbraw/zinc/26/09/28/565260928.db2.gz YHRHRSGTVLNEOQ-JTQLQIEISA-N 0 0 388.205 3.462 20 5 GGBDRN Cn1ccnc1[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000372950463 565261992 /nfs/dbraw/zinc/26/19/92/565261992.db2.gz UWASDIMGPROUCA-LLVKDONJSA-N 0 0 393.241 3.111 20 5 GGBDRN Cc1csc([C@H](C)CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000186475720 565262264 /nfs/dbraw/zinc/26/22/64/565262264.db2.gz XIKAJLHJQGEFGX-MRVPVSSYSA-N 0 0 375.859 3.095 20 5 GGBDRN Cc1csc([C@@H](C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000186482480 565262742 /nfs/dbraw/zinc/26/27/42/565262742.db2.gz JJHZPBFXYHNANQ-QMMMGPOBSA-N 0 0 375.859 3.095 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000271682437 565264617 /nfs/dbraw/zinc/26/46/17/565264617.db2.gz ZLEXSXMSCOPTDE-NSHDSACASA-N 0 0 395.261 3.309 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(Br)cc(C)c2N)c(C)c1[N+](=O)[O-] ZINC000186513884 565265064 /nfs/dbraw/zinc/26/50/64/565265064.db2.gz ZGUNZTPIMLMWHL-UHFFFAOYSA-N 0 0 396.245 3.090 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000186514674 565265516 /nfs/dbraw/zinc/26/55/16/565265516.db2.gz CQUKJXRQAMPRHJ-XHDPSFHLSA-N 0 0 381.841 3.415 20 5 GGBDRN Cc1csc([C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(F)(F)F)n1 ZINC000295425305 565266112 /nfs/dbraw/zinc/26/61/12/565266112.db2.gz PVDISOZHSNVALS-LBPRGKRZSA-N 0 0 375.328 3.158 20 5 GGBDRN CCn1cc([C@H](C)NS(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)cn1 ZINC000295473779 565268370 /nfs/dbraw/zinc/26/83/70/565268370.db2.gz ZDOQVCYTNCMDOU-QMMMGPOBSA-N 0 0 393.252 3.158 20 5 GGBDRN CC[C@@H](COCC(F)(F)F)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000295494237 565269127 /nfs/dbraw/zinc/26/91/27/565269127.db2.gz SLBUYUZUMRXPSR-QMMMGPOBSA-N 0 0 399.163 3.445 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])[C@@H]2CCCO[C@H]21 ZINC000373095634 565269200 /nfs/dbraw/zinc/26/92/00/565269200.db2.gz TVXPTLXLWPYLGD-UPZJHPNMSA-N 0 0 389.271 3.352 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(n2cc(Br)cn2)CC1 ZINC000373144814 565271597 /nfs/dbraw/zinc/27/15/97/565271597.db2.gz IORSKGFSDNMGFU-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN O=C(N[C@H](c1ccc(Br)cc1)C1CCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000161049836 565271722 /nfs/dbraw/zinc/27/17/22/565271722.db2.gz XEEHMOOUMISMHW-ZDUSSCGKSA-N 0 0 379.214 3.352 20 5 GGBDRN CC[C@H]1[C@H](C)CCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000186611623 565272115 /nfs/dbraw/zinc/27/21/15/565272115.db2.gz WOOLOYHLLXNPML-KOLCDFICSA-N 0 0 377.260 3.166 20 5 GGBDRN CC[C@@H]1[C@H](C)CCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000186611604 565272324 /nfs/dbraw/zinc/27/23/24/565272324.db2.gz WOOLOYHLLXNPML-MWLCHTKSSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CCC(CF)CC1 ZINC000295558287 565273801 /nfs/dbraw/zinc/27/38/01/565273801.db2.gz FILNKQXIUUAQNN-UHFFFAOYSA-N 0 0 392.168 3.021 20 5 GGBDRN C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[C@H]1CCCCO1 ZINC000272011833 565274872 /nfs/dbraw/zinc/27/48/72/565274872.db2.gz ATTMEFISRHTRRJ-PRHODGIISA-N 0 0 375.194 3.184 20 5 GGBDRN CN1Cc2ccccc2[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C1 ZINC000373213472 565275042 /nfs/dbraw/zinc/27/50/42/565275042.db2.gz AVRSTPVUVXHBMZ-LLVKDONJSA-N 0 0 396.266 3.335 20 5 GGBDRN O=C(c1ccc(Br)s1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373269144 565276813 /nfs/dbraw/zinc/27/68/13/565276813.db2.gz FOMVWCQITXTLKB-UHFFFAOYSA-N 0 0 385.243 3.093 20 5 GGBDRN O=C(c1cc(F)c(Cl)nc1Cl)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373265159 565276879 /nfs/dbraw/zinc/27/68/79/565276879.db2.gz TZMCPFCNJNDCAF-UHFFFAOYSA-N 0 0 388.186 3.110 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000295674732 565280701 /nfs/dbraw/zinc/28/07/01/565280701.db2.gz UVLARUFAESNYQH-HNNXBMFYSA-N 0 0 395.253 3.389 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1[C@H]1CCCC1=O ZINC000272189590 565280897 /nfs/dbraw/zinc/28/08/97/565280897.db2.gz NDSORVYFUHVXGH-OCCSQVGLSA-N 0 0 381.226 3.331 20 5 GGBDRN Cc1cnc([C@H](C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000186734554 565281482 /nfs/dbraw/zinc/28/14/82/565281482.db2.gz OXTPBUGBZJVTRT-MRVPVSSYSA-N 0 0 375.859 3.095 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[C@@H]1OCCc2sccc21 ZINC000295707249 565282942 /nfs/dbraw/zinc/28/29/42/565282942.db2.gz RABYNWXSVDFJJV-HWPZZCPQSA-N 0 0 382.463 3.174 20 5 GGBDRN CC(C)(C)Oc1ccc(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cn1 ZINC000272284418 565283724 /nfs/dbraw/zinc/28/37/24/565283724.db2.gz OVHDGLJSDIIMFO-UHFFFAOYSA-N 0 0 385.467 3.244 20 5 GGBDRN O=C1[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])CCCN1CC(F)(F)F ZINC000161517632 565286371 /nfs/dbraw/zinc/28/63/71/565286371.db2.gz KYAABVSQIYUQKH-SNVBAGLBSA-N 0 0 396.163 3.323 20 5 GGBDRN CCN(CC(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000161591255 565288818 /nfs/dbraw/zinc/28/88/18/565288818.db2.gz TXAMCXNFENHXER-UHFFFAOYSA-N 0 0 380.266 3.187 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccc(F)c2O1 ZINC000186860192 565291922 /nfs/dbraw/zinc/29/19/22/565291922.db2.gz IYRKZLSYNFKCPX-SECBINFHSA-N 0 0 386.788 3.364 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1cccc(Br)c1OC(F)F ZINC000161772376 565293191 /nfs/dbraw/zinc/29/31/91/565293191.db2.gz DJCMWZIKPPFGPZ-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN COCC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccco1 ZINC000272670270 565293399 /nfs/dbraw/zinc/29/33/99/565293399.db2.gz KAYFQBFHFQVHPB-ZDUSSCGKSA-N 0 0 383.198 3.458 20 5 GGBDRN C[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@@H]1CCCN(C2CCC2)C1 ZINC000272792395 565298179 /nfs/dbraw/zinc/29/81/79/565298179.db2.gz CLBQTURPBBRUMW-VXGBXAGGSA-N 0 0 387.527 3.125 20 5 GGBDRN Cc1ccc([C@H](C)Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000272797491 565298221 /nfs/dbraw/zinc/29/82/21/565298221.db2.gz DBYVKWWUYCWKGB-VIFPVBQESA-N 0 0 385.423 3.450 20 5 GGBDRN CCN(CCc1cccs1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000272820471 565298432 /nfs/dbraw/zinc/29/84/32/565298432.db2.gz ICEUFANRCHOYEW-UHFFFAOYSA-N 0 0 381.841 3.339 20 5 GGBDRN CC[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000272822497 565298647 /nfs/dbraw/zinc/29/86/47/565298647.db2.gz JCGCZVHJMGOCIJ-HNNXBMFYSA-N 0 0 383.857 3.137 20 5 GGBDRN COc1ccc(OCCSc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000272880045 565300934 /nfs/dbraw/zinc/30/09/34/565300934.db2.gz VGTZWCJJVSQYMR-UHFFFAOYSA-N 0 0 389.476 3.240 20 5 GGBDRN CN1Cc2ccccc2[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000373778755 565302716 /nfs/dbraw/zinc/30/27/16/565302716.db2.gz CUKXQFWEMJWZIN-AWEZNQCLSA-N 0 0 390.237 3.274 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[C@H](C2CCOCC2)C1 ZINC000373776223 565303259 /nfs/dbraw/zinc/30/32/59/565303259.db2.gz SPLIJHIBSHAVSC-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN Cc1nc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)ccc1[C@@H](C)O ZINC000272990194 565303321 /nfs/dbraw/zinc/30/33/21/565303321.db2.gz MWMVMRHDAMYDDF-SNVBAGLBSA-N 0 0 394.225 3.044 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N(Cc1csc(Br)c1)C1CC1 ZINC000162070383 565304398 /nfs/dbraw/zinc/30/43/98/565304398.db2.gz VESCHMAMBLSZHK-UHFFFAOYSA-N 0 0 399.270 3.197 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCS[C@@H]2COCC[C@H]21 ZINC000272998696 565304635 /nfs/dbraw/zinc/30/46/35/565304635.db2.gz MFOJZSINWZBIFA-BXUZGUMPSA-N 0 0 388.898 3.073 20 5 GGBDRN CO[C@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2Cl)CC1(C)C ZINC000296157764 565305558 /nfs/dbraw/zinc/30/55/58/565305558.db2.gz SRQDYQPUIFCVGR-ZDUSSCGKSA-N 0 0 397.280 3.337 20 5 GGBDRN Cn1ncnc1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000162140787 565305989 /nfs/dbraw/zinc/30/59/89/565305989.db2.gz UYAAKDAHTYMDJZ-UHFFFAOYSA-N 0 0 378.186 3.358 20 5 GGBDRN COc1ccc(OCCN2CCSC[C@H]2c2nccs2)c([N+](=O)[O-])c1 ZINC000187060054 565306230 /nfs/dbraw/zinc/30/62/30/565306230.db2.gz FSLWUIZHLCNLIL-AWEZNQCLSA-N 0 0 381.479 3.229 20 5 GGBDRN O=C(CN1CCSC[C@H]1c1nccs1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000187063279 565306261 /nfs/dbraw/zinc/30/62/61/565306261.db2.gz RFYWIZIROUKLEO-ZDUSSCGKSA-N 0 0 398.897 3.433 20 5 GGBDRN CN(C1CCC(CO)CC1)S(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC000296239879 565308900 /nfs/dbraw/zinc/30/89/00/565308900.db2.gz KYEIYFCFUBXHMM-UHFFFAOYSA-N 0 0 397.280 3.073 20 5 GGBDRN COC(=O)CCN(CC(C)C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000162239814 565309566 /nfs/dbraw/zinc/30/95/66/565309566.db2.gz DVDMHWDKORQJET-UHFFFAOYSA-N 0 0 387.230 3.019 20 5 GGBDRN CN(C)c1ccc(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000273154165 565310761 /nfs/dbraw/zinc/31/07/61/565310761.db2.gz XMGMYXFIOVXPNP-UHFFFAOYSA-N 0 0 380.857 3.118 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)c1ccc(Br)cc1 ZINC000273158478 565310787 /nfs/dbraw/zinc/31/07/87/565310787.db2.gz YUDYDGGCJSQSEN-HNNXBMFYSA-N 0 0 381.226 3.189 20 5 GGBDRN CSCC1CCC(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000296317363 565312145 /nfs/dbraw/zinc/31/21/45/565312145.db2.gz JQGDDKLMOASOBE-UHFFFAOYSA-N 0 0 385.873 3.225 20 5 GGBDRN Cc1nc(C)c([C@H](C)N(C)S(=O)(=O)CCc2ccccc2[N+](=O)[O-])s1 ZINC000162343369 565313849 /nfs/dbraw/zinc/31/38/49/565313849.db2.gz ZTEYVZUBHSZESS-LBPRGKRZSA-N 0 0 383.495 3.233 20 5 GGBDRN CCSc1nnc(SCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000273311514 565316238 /nfs/dbraw/zinc/31/62/38/565316238.db2.gz BZFCYETZFRBABY-UHFFFAOYSA-N 0 0 391.521 3.124 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@@]2(C)CCCO)cc1[N+](=O)[O-] ZINC000273306596 565316590 /nfs/dbraw/zinc/31/65/90/565316590.db2.gz GWKOCYRRHRZRBG-INIZCTEOSA-N 0 0 385.258 3.433 20 5 GGBDRN C[C@@]1(CCCO)CCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000273378207 565318624 /nfs/dbraw/zinc/31/86/24/565318624.db2.gz ZGYZUPUGDDEEOW-HNNXBMFYSA-N 0 0 389.221 3.264 20 5 GGBDRN Cc1nnc([C@@H](C)Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000273516035 565324189 /nfs/dbraw/zinc/32/41/89/565324189.db2.gz QWUQRYVODCXMDF-ZCFIWIBFSA-N 0 0 396.372 3.221 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1cccnc1 ZINC000162720351 565325997 /nfs/dbraw/zinc/32/59/97/565325997.db2.gz KZEAJORUCDPGCZ-SECBINFHSA-N 0 0 375.328 3.048 20 5 GGBDRN Cc1cc(C)n(CCCNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000162756353 565326518 /nfs/dbraw/zinc/32/65/18/565326518.db2.gz GAPBHBMIYIJTJK-UHFFFAOYSA-N 0 0 395.257 3.299 20 5 GGBDRN CC[C@H]1[C@@H](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000187408575 565330287 /nfs/dbraw/zinc/33/02/87/565330287.db2.gz BYTHIGMVBYAWIP-ZANVPECISA-N 0 0 388.205 3.460 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc(C(N)=O)cc2)cc1[N+](=O)[O-] ZINC000162927286 565332385 /nfs/dbraw/zinc/33/23/85/565332385.db2.gz IHXRBZYUHQHIJJ-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(CC[C@@H]3CCOC3)n2)c(Br)c1 ZINC000273797957 565336623 /nfs/dbraw/zinc/33/66/23/565336623.db2.gz IQRCHTHCKRIIMD-SNVBAGLBSA-N 0 0 382.214 3.300 20 5 GGBDRN C[C@@]1(c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)CCCOC1 ZINC000273820035 565338902 /nfs/dbraw/zinc/33/89/02/565338902.db2.gz KUXROTLENIAVTA-OAHLLOKOSA-N 0 0 382.214 3.399 20 5 GGBDRN CC(=O)N1CCC[C@H](c2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)C1 ZINC000273825286 565339253 /nfs/dbraw/zinc/33/92/53/565339253.db2.gz IJXYHGCMEXKEKJ-JTQLQIEISA-N 0 0 395.213 3.133 20 5 GGBDRN C[C@]1(c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)CCCOC1 ZINC000273820032 565339259 /nfs/dbraw/zinc/33/92/59/565339259.db2.gz KUXROTLENIAVTA-HNNXBMFYSA-N 0 0 382.214 3.399 20 5 GGBDRN C[C@](O)(Cc1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1)C1CC1 ZINC000273826273 565339362 /nfs/dbraw/zinc/33/93/62/565339362.db2.gz LILBREQOMCPBHA-HNNXBMFYSA-N 0 0 382.214 3.035 20 5 GGBDRN O=C(Nc1nnc(-c2ccccc2Cl)s1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187558854 565340632 /nfs/dbraw/zinc/34/06/32/565340632.db2.gz MFQAXMJBKLSNPA-UHFFFAOYSA-N 0 0 377.769 3.120 20 5 GGBDRN C[C@@H]1[C@H](C)SCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163369082 565344047 /nfs/dbraw/zinc/34/40/47/565344047.db2.gz ROWONIMIEJJVAI-BDAKNGLRSA-N 0 0 384.401 3.128 20 5 GGBDRN CC[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCS1 ZINC000163401268 565344940 /nfs/dbraw/zinc/34/49/40/565344940.db2.gz RXGRBSOUOVUHLQ-SNVBAGLBSA-N 0 0 384.401 3.130 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](C)S1 ZINC000163394910 565344949 /nfs/dbraw/zinc/34/49/49/565344949.db2.gz WCQQQLQKLIFLOY-DTORHVGOSA-N 0 0 384.401 3.128 20 5 GGBDRN CC[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCS1 ZINC000163401382 565345004 /nfs/dbraw/zinc/34/50/04/565345004.db2.gz RXGRBSOUOVUHLQ-JTQLQIEISA-N 0 0 384.401 3.130 20 5 GGBDRN CC1(C)C[C@@H](O)CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000296918178 565345272 /nfs/dbraw/zinc/34/52/72/565345272.db2.gz LNCSLOWUKVQYJC-JTQLQIEISA-N 0 0 389.221 3.120 20 5 GGBDRN Cn1ccnc1[C@H]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000374589772 565345824 /nfs/dbraw/zinc/34/58/24/565345824.db2.gz AKFPUGDPXQQDHW-NSHDSACASA-N 0 0 380.857 3.090 20 5 GGBDRN Cn1ccnc1[C@@H]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000374589770 565346451 /nfs/dbraw/zinc/34/64/51/565346451.db2.gz AKFPUGDPXQQDHW-LLVKDONJSA-N 0 0 380.857 3.090 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CC[C@](F)(c3ccccc3F)C2)s1 ZINC000374619164 565347609 /nfs/dbraw/zinc/34/76/09/565347609.db2.gz JAGLPXWRZBRHQQ-OAHLLOKOSA-N 0 0 388.417 3.274 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1cnc2c(c1)COCC2 ZINC000374632136 565348631 /nfs/dbraw/zinc/34/86/31/565348631.db2.gz SHEKEIZSVPDGHH-UHFFFAOYSA-N 0 0 379.825 3.447 20 5 GGBDRN Cc1nnc([C@H](C)NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)s1 ZINC000273958403 565348753 /nfs/dbraw/zinc/34/87/53/565348753.db2.gz LPKALARSWPICIZ-ZETCQYMHSA-N 0 0 385.243 3.317 20 5 GGBDRN CCC[C@]1(CO)CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)C1 ZINC000296999145 565349596 /nfs/dbraw/zinc/34/95/96/565349596.db2.gz JLBJWJXCDBBLAU-AWEZNQCLSA-N 0 0 397.280 3.075 20 5 GGBDRN CN(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1CCSC1 ZINC000163632877 565350271 /nfs/dbraw/zinc/35/02/71/565350271.db2.gz RJRVMMYQWRPUQD-LLVKDONJSA-N 0 0 377.388 3.380 20 5 GGBDRN CC(=O)N(CCc1noc(-c2cc(Br)cc([N+](=O)[O-])c2)n1)C(C)C ZINC000273989160 565350401 /nfs/dbraw/zinc/35/04/01/565350401.db2.gz QDVYRSHCXWFXSU-UHFFFAOYSA-N 0 0 397.229 3.207 20 5 GGBDRN CC(C)(NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Cl)c(Cl)c1 ZINC000163846565 565352260 /nfs/dbraw/zinc/35/22/60/565352260.db2.gz PYMIPZZQXKFJLU-UHFFFAOYSA-N 0 0 384.219 3.115 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](O)CC(C)(C)C1 ZINC000297045583 565352742 /nfs/dbraw/zinc/35/27/42/565352742.db2.gz TWVHNGUFHUMDJA-LBPRGKRZSA-N 0 0 385.258 3.289 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000187747167 565352798 /nfs/dbraw/zinc/35/27/98/565352798.db2.gz IUHRFYHTJGSFEV-IINYFYTJSA-N 0 0 380.750 3.462 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)c1ccc([N+](=O)[O-])cc1S(C)(=O)=O)CCC2 ZINC000297066063 565353877 /nfs/dbraw/zinc/35/38/77/565353877.db2.gz JFZOZUNYINGKHR-CQSZACIVSA-N 0 0 381.479 3.277 20 5 GGBDRN CS(=O)(=O)[C@H]1CCCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000274047884 565354368 /nfs/dbraw/zinc/35/43/68/565354368.db2.gz KLKVZQNIAFTOBZ-QMMMGPOBSA-N 0 0 386.779 3.280 20 5 GGBDRN CCN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)Cc1ccsc1 ZINC000187784503 565354598 /nfs/dbraw/zinc/35/45/98/565354598.db2.gz WRDPOLJCWIEPDT-AWEZNQCLSA-N 0 0 382.507 3.383 20 5 GGBDRN C[C@@H]1OCC[C@@H]1SCC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000164052744 565355031 /nfs/dbraw/zinc/35/50/31/565355031.db2.gz GLOITZCNUKZYHZ-UFBFGSQYSA-N 0 0 375.244 3.206 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H]2CCCc3sccc32)cc1[N+](=O)[O-] ZINC000187781321 565354992 /nfs/dbraw/zinc/35/49/92/565354992.db2.gz BCOFYHNFIKLQQQ-GFCCVEGCSA-N 0 0 386.426 3.160 20 5 GGBDRN CO[C@@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1(C)C ZINC000297078448 565354964 /nfs/dbraw/zinc/35/49/64/565354964.db2.gz QIPMBWOOJIJVKR-GFCCVEGCSA-N 0 0 389.221 3.384 20 5 GGBDRN COc1nc(C)c(Br)cc1-c1noc(CCC(C)(C)[N+](=O)[O-])n1 ZINC000297118347 565356951 /nfs/dbraw/zinc/35/69/51/565356951.db2.gz YKBQBELPQILPBP-UHFFFAOYSA-N 0 0 385.218 3.199 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC[C@@H](O)CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000297133071 565358111 /nfs/dbraw/zinc/35/81/11/565358111.db2.gz ZNGSPPLMVNDDJW-GFCCVEGCSA-N 0 0 385.258 3.289 20 5 GGBDRN O=C(N[C@H]1CCC[C@@H]1CCO)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000187913492 565363046 /nfs/dbraw/zinc/36/30/46/565363046.db2.gz OZANSJYKRJLAST-KCJUWKMLSA-N 0 0 391.649 3.292 20 5 GGBDRN Cc1nn(CCc2nc(-c3ccccc3Br)no2)c(C)c1[N+](=O)[O-] ZINC000274238954 565363366 /nfs/dbraw/zinc/36/33/66/565363366.db2.gz UATPXWCBFQINMH-UHFFFAOYSA-N 0 0 392.213 3.463 20 5 GGBDRN COc1cc(CN[C@H](CO)c2ccc(Br)cc2)c([N+](=O)[O-])cc1F ZINC000274292230 565364988 /nfs/dbraw/zinc/36/49/88/565364988.db2.gz HAPSBZXNUCCDQF-CQSZACIVSA-N 0 0 399.216 3.328 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000274345175 565367880 /nfs/dbraw/zinc/36/78/80/565367880.db2.gz PQGVTMLEFUKUCN-LLVKDONJSA-N 0 0 380.857 3.224 20 5 GGBDRN C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)CCO[C@@H]1C1CC1 ZINC000375132989 565370380 /nfs/dbraw/zinc/37/03/80/565370380.db2.gz BOKAWVNFKLMHJQ-ZBFHGGJFSA-N 0 0 383.242 3.292 20 5 GGBDRN CCO[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)C12CCOCC2 ZINC000274439909 565370938 /nfs/dbraw/zinc/37/09/38/565370938.db2.gz DPJRSKHEHBAMGN-OLZOCXBDSA-N 0 0 386.246 3.138 20 5 GGBDRN O=C(NCCOCC(F)F)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000188054496 565374822 /nfs/dbraw/zinc/37/48/22/565374822.db2.gz CKDZUJTUCGKMBR-UHFFFAOYSA-N 0 0 387.564 3.022 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCO[C@H](c2ccc(F)c(Br)c2)C1 ZINC000274679358 565377455 /nfs/dbraw/zinc/37/74/55/565377455.db2.gz NKTOQFZHWBAJHR-ZDUSSCGKSA-N 0 0 398.188 3.038 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1[C@H]1CCCO1 ZINC000375264826 565378442 /nfs/dbraw/zinc/37/84/42/565378442.db2.gz CSBSLLNKHJODOK-LSDHHAIUSA-N 0 0 383.242 3.070 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@H]1CCCO1 ZINC000375264825 565378451 /nfs/dbraw/zinc/37/84/51/565378451.db2.gz CSBSLLNKHJODOK-HUUCEWRRSA-N 0 0 383.242 3.070 20 5 GGBDRN Cc1nn(C)c(N2CCO[C@@H](c3ccc(F)c(Br)c3)C2)c1[N+](=O)[O-] ZINC000274754790 565379299 /nfs/dbraw/zinc/37/92/99/565379299.db2.gz QCQWUBJGEKOVLO-CYBMUJFWSA-N 0 0 399.220 3.116 20 5 GGBDRN Cc1nn(C)c(N2CCO[C@H](c3ccc(F)c(Br)c3)C2)c1[N+](=O)[O-] ZINC000274754796 565379900 /nfs/dbraw/zinc/37/99/00/565379900.db2.gz QCQWUBJGEKOVLO-ZDUSSCGKSA-N 0 0 399.220 3.116 20 5 GGBDRN COC(=O)c1cc(NC(=O)CCC(C)(C)[N+](=O)[O-])c(C)cc1Br ZINC000297689777 565382480 /nfs/dbraw/zinc/38/24/80/565382480.db2.gz HNPPNTHNTCQYGG-UHFFFAOYSA-N 0 0 387.230 3.318 20 5 GGBDRN O=C(c1ccc(I)c([N+](=O)[O-])c1)N1CCC(CF)CC1 ZINC000297702713 565382871 /nfs/dbraw/zinc/38/28/71/565382871.db2.gz JYVFYTTYYCEQOL-UHFFFAOYSA-N 0 0 392.168 3.021 20 5 GGBDRN CN(Cc1c([N+](=O)[O-])ncn1C)[C@H]1CCOc2ccc(Br)cc21 ZINC000375357728 565383160 /nfs/dbraw/zinc/38/31/60/565383160.db2.gz TVCKMYQEFUCZQL-LBPRGKRZSA-N 0 0 381.230 3.046 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000297729229 565383822 /nfs/dbraw/zinc/38/38/22/565383822.db2.gz JYIPHEQZKVYQOT-GDBMZVCRSA-N 0 0 381.226 3.141 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC2(CCOCC2)CC1 ZINC000375395666 565384152 /nfs/dbraw/zinc/38/41/52/565384152.db2.gz YDHDXTKSMIQCCA-UHFFFAOYSA-N 0 0 397.269 3.319 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000297729250 565384225 /nfs/dbraw/zinc/38/42/25/565384225.db2.gz JYIPHEQZKVYQOT-ZBFHGGJFSA-N 0 0 381.226 3.141 20 5 GGBDRN O=C(NCc1cnc2n1CCCC2)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000375409306 565385942 /nfs/dbraw/zinc/38/59/42/565385942.db2.gz RXPBZXYHASVRSJ-UHFFFAOYSA-N 0 0 394.229 3.212 20 5 GGBDRN CCn1cc([C@@H](C)NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cn1 ZINC000297793905 565387275 /nfs/dbraw/zinc/38/72/75/565387275.db2.gz OOIVYLJWXKXQQA-SECBINFHSA-N 0 0 382.218 3.456 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)C(=O)N(Cc1cccs1)C1CC1 ZINC000297846183 565389411 /nfs/dbraw/zinc/38/94/11/565389411.db2.gz KXMLKDSIQWGGEF-UHFFFAOYSA-N 0 0 379.825 3.439 20 5 GGBDRN COC(=O)[C@@H](C)S[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000275125434 565393985 /nfs/dbraw/zinc/39/39/85/565393985.db2.gz WRZUPKOBLVIDEZ-JGVFFNPUSA-N 0 0 380.344 3.235 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ZINC000375658392 565399802 /nfs/dbraw/zinc/39/98/02/565399802.db2.gz QQQQXTMIAHFOGJ-CQSZACIVSA-N 0 0 381.230 3.030 20 5 GGBDRN Cc1cc(N2CCC([C@@H](O)c3ncc[nH]3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000375658821 565399899 /nfs/dbraw/zinc/39/98/99/565399899.db2.gz TTWITAYYICPOKC-OAHLLOKOSA-N 0 0 395.257 3.339 20 5 GGBDRN CC(C)(CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1Cl)c1cccs1 ZINC000298132361 565400745 /nfs/dbraw/zinc/40/07/45/565400745.db2.gz NNWKDRAOWFWDMI-UHFFFAOYSA-N 0 0 381.841 3.342 20 5 GGBDRN O=c1c(Br)cn(C2CC(OCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000298183061 565402620 /nfs/dbraw/zinc/40/26/20/565402620.db2.gz DVBARUKUDURNLN-UHFFFAOYSA-N 0 0 379.210 3.439 20 5 GGBDRN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1Nc1ncc([N+](=O)[O-])cc1Br ZINC000275397372 565407782 /nfs/dbraw/zinc/40/77/82/565407782.db2.gz PUJRGYZYZIYZJB-JSGCOSHPSA-N 0 0 396.245 3.045 20 5 GGBDRN CCOC1CC2(C1)CCN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)C2 ZINC000375817064 565408146 /nfs/dbraw/zinc/40/81/46/565408146.db2.gz CGMYRVFQJVTICI-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)C(=O)N[C@@H]1CCCc2sccc21 ZINC000298345946 565409541 /nfs/dbraw/zinc/40/95/41/565409541.db2.gz FEKUBUCSSJHOOI-SNVBAGLBSA-N 0 0 379.825 3.442 20 5 GGBDRN COc1ccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)cc1Br ZINC000171121198 565411450 /nfs/dbraw/zinc/41/14/50/565411450.db2.gz KPKCLKAMAFQHNK-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000188657611 565415084 /nfs/dbraw/zinc/41/50/84/565415084.db2.gz MERLJXHPCCFDMK-AWEZNQCLSA-N 0 0 381.841 3.156 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC(c2ccncn2)CC1 ZINC000298467526 565415810 /nfs/dbraw/zinc/41/58/10/565415810.db2.gz TYZNWGUQNUJZRR-UHFFFAOYSA-N 0 0 391.225 3.167 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1sccc1Br ZINC000171167558 565415974 /nfs/dbraw/zinc/41/59/74/565415974.db2.gz WHOQQOMSWBOSNX-UHFFFAOYSA-N 0 0 384.255 3.461 20 5 GGBDRN CC(C)CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000171204251 565417768 /nfs/dbraw/zinc/41/77/68/565417768.db2.gz GNZCCEBCZRFMLT-AAEUAGOBSA-N 0 0 385.511 3.112 20 5 GGBDRN O=C(c1ccc(Br)cc1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376047684 565419376 /nfs/dbraw/zinc/41/93/76/565419376.db2.gz VVZLNDCMRIMWDX-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN CC(C)c1nnc2n1C[C@H](Nc1ccc(Br)cc1[N+](=O)[O-])CC2 ZINC000171232938 565420296 /nfs/dbraw/zinc/42/02/96/565420296.db2.gz QPFVDWFUWLTUGG-LLVKDONJSA-N 0 0 380.246 3.499 20 5 GGBDRN CCN([C@@H](C)Cc1ccsc1)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000188762012 565421507 /nfs/dbraw/zinc/42/15/07/565421507.db2.gz HRPFUUXSZBREOF-LBPRGKRZSA-N 0 0 384.479 3.307 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000298695103 565425137 /nfs/dbraw/zinc/42/51/37/565425137.db2.gz XTLOHONOJKEJSD-UHFFFAOYSA-N 0 0 387.248 3.321 20 5 GGBDRN CCc1n[nH]c(C(=O)NC2(c3ccc(Br)cc3)CC2)c1[N+](=O)[O-] ZINC000171372106 565428121 /nfs/dbraw/zinc/42/81/21/565428121.db2.gz XIUSWTMHLJUQNQ-UHFFFAOYSA-N 0 0 379.214 3.062 20 5 GGBDRN Cc1noc(C2(C)CCN(c3ncc([N+](=O)[O-])cc3Br)CC2)n1 ZINC000376270857 565429535 /nfs/dbraw/zinc/42/95/35/565429535.db2.gz RZJPEFCUCXUXSL-UHFFFAOYSA-N 0 0 382.218 3.002 20 5 GGBDRN Cc1nn(CCC(=O)NCCc2ccc(Cl)cc2Cl)c(C)c1[N+](=O)[O-] ZINC000171419807 565430093 /nfs/dbraw/zinc/43/00/93/565430093.db2.gz HVVNGOOJLGBDQY-UHFFFAOYSA-N 0 0 385.251 3.464 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCC(c3ccccc3Br)CC2)c1[N+](=O)[O-] ZINC000275898748 565430316 /nfs/dbraw/zinc/43/03/16/565430316.db2.gz JWJVRJWVRJEHNK-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN O=C(CSc1nncs1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000298863081 565432247 /nfs/dbraw/zinc/43/22/47/565432247.db2.gz QFDQKVAWJFKXDG-UHFFFAOYSA-N 0 0 392.384 3.130 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC([C@@H]2CCOC2)CC1 ZINC000376350377 565432422 /nfs/dbraw/zinc/43/24/22/565432422.db2.gz IHMQKOJRXHSXQP-GFCCVEGCSA-N 0 0 383.242 3.246 20 5 GGBDRN CC(C)n1ncc2c1[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])CCC2 ZINC000376365403 565433271 /nfs/dbraw/zinc/43/32/71/565433271.db2.gz FWKLUFXSZLNABG-NSHDSACASA-N 0 0 384.483 3.327 20 5 GGBDRN Cc1nn(C)c(C(=O)N(Cc2ccc(Br)cc2)C(C)C)c1[N+](=O)[O-] ZINC000299147412 565441591 /nfs/dbraw/zinc/44/15/91/565441591.db2.gz JWMNQVJDKPZTRA-UHFFFAOYSA-N 0 0 395.257 3.450 20 5 GGBDRN O=C(NC[C@@H]1CCCC(F)(F)C1)C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000299173987 565442245 /nfs/dbraw/zinc/44/22/45/565442245.db2.gz YJLFSFRPANJNSV-SECBINFHSA-N 0 0 375.759 3.128 20 5 GGBDRN Cc1csc(N(CC(F)(F)F)C(=O)COc2ccc([N+](=O)[O-])cc2)n1 ZINC000299167720 565442593 /nfs/dbraw/zinc/44/25/93/565442593.db2.gz SLBMXGRVYGCFNR-UHFFFAOYSA-N 0 0 375.328 3.334 20 5 GGBDRN O=C(NC[C@H]1CCCC(F)(F)C1)C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000299173990 565442848 /nfs/dbraw/zinc/44/28/48/565442848.db2.gz YJLFSFRPANJNSV-VIFPVBQESA-N 0 0 375.759 3.128 20 5 GGBDRN Cc1ccc(C[C@@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2Cl)s1 ZINC000299268891 565444453 /nfs/dbraw/zinc/44/44/53/565444453.db2.gz LYWQYIJQWXTXLX-SECBINFHSA-N 0 0 381.841 3.304 20 5 GGBDRN Cn1nccc1[C@H]1CCCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000376600137 565444683 /nfs/dbraw/zinc/44/46/83/565444683.db2.gz OQNMTEGSHPRKSB-LBPRGKRZSA-N 0 0 393.241 3.111 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000171713628 565446539 /nfs/dbraw/zinc/44/65/39/565446539.db2.gz HFHQBZBGMSNPCO-OAHLLOKOSA-N 0 0 375.431 3.119 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccnc(N3CCOCC3)c2)c(Br)c1 ZINC000299324505 565446724 /nfs/dbraw/zinc/44/67/24/565446724.db2.gz DHZPHGCWWDFFFY-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN COc1cc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)ccc1SC ZINC000299329015 565447121 /nfs/dbraw/zinc/44/71/21/565447121.db2.gz OIDFEOZKXWHEHM-UHFFFAOYSA-N 0 0 382.463 3.146 20 5 GGBDRN C[C@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1Cl)Cc1cccs1 ZINC000299355284 565448761 /nfs/dbraw/zinc/44/87/61/565448761.db2.gz RAFUQBBWPRDZEP-JTQLQIEISA-N 0 0 381.841 3.243 20 5 GGBDRN C[C@@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1Cl)Cc1cccs1 ZINC000299355289 565448878 /nfs/dbraw/zinc/44/88/78/565448878.db2.gz RAFUQBBWPRDZEP-SNVBAGLBSA-N 0 0 381.841 3.243 20 5 GGBDRN Cc1cc(Br)c2c(c1)CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])CC2 ZINC000189166462 565449531 /nfs/dbraw/zinc/44/95/31/565449531.db2.gz ZZAMYSUKGKHNST-UHFFFAOYSA-N 0 0 390.237 3.327 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000171795800 565450707 /nfs/dbraw/zinc/45/07/07/565450707.db2.gz YKZZCLRMWKMNKQ-CYBMUJFWSA-N 0 0 377.447 3.119 20 5 GGBDRN Cn1nccc1[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000376714620 565451504 /nfs/dbraw/zinc/45/15/04/565451504.db2.gz FPPRVPNYZLPJKW-LLVKDONJSA-N 0 0 393.241 3.111 20 5 GGBDRN CCOC(=O)[C@@H](CC)N(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CC1 ZINC000189203629 565451822 /nfs/dbraw/zinc/45/18/22/565451822.db2.gz XAMVBJNVEPERKK-CQSZACIVSA-N 0 0 399.241 3.304 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)C(C)C)CC2)c(Br)cc1[N+](=O)[O-] ZINC000276546977 565453240 /nfs/dbraw/zinc/45/32/40/565453240.db2.gz DWBIPNZKALSYEO-UHFFFAOYSA-N 0 0 384.274 3.407 20 5 GGBDRN O=C(NCc1ccc(Cl)s1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171839314 565453888 /nfs/dbraw/zinc/45/38/88/565453888.db2.gz FAKDGYSXDIHHTL-JTQLQIEISA-N 0 0 399.881 3.292 20 5 GGBDRN Cc1ccc(Br)nc1C(=O)OCc1ncc(C)c([N+](=O)[O-])c1C ZINC000189258509 565454617 /nfs/dbraw/zinc/45/46/17/565454617.db2.gz OYYFGCOJIPPYQK-UHFFFAOYSA-N 0 0 380.198 3.430 20 5 GGBDRN CC(C)[C@@H](C)C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000171881324 565455186 /nfs/dbraw/zinc/45/51/86/565455186.db2.gz LSUFGKZYQCROMN-SNVBAGLBSA-N 0 0 383.451 3.115 20 5 GGBDRN CC(C)[C@H](C)C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000171881326 565455237 /nfs/dbraw/zinc/45/52/37/565455237.db2.gz LSUFGKZYQCROMN-JTQLQIEISA-N 0 0 383.451 3.115 20 5 GGBDRN CCS(=O)(=O)CCCCCOc1ccc(Br)cc1[N+](=O)[O-] ZINC000276664762 565456302 /nfs/dbraw/zinc/45/63/02/565456302.db2.gz ZACJOHQQOLLHNX-UHFFFAOYSA-N 0 0 380.260 3.341 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)c1[N+](=O)[O-] ZINC000299635311 565457437 /nfs/dbraw/zinc/45/74/37/565457437.db2.gz ZKCLPDSSQCXUSQ-UHFFFAOYSA-N 0 0 381.845 3.085 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000189299933 565458310 /nfs/dbraw/zinc/45/83/10/565458310.db2.gz XWFNFHVVHCCSRL-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3ccc(Br)cn3)CC2)c1 ZINC000171959634 565458523 /nfs/dbraw/zinc/45/85/23/565458523.db2.gz IQFZKRYYQQZFDK-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN COc1cccc(OC)c1SCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000276725290 565459286 /nfs/dbraw/zinc/45/92/86/565459286.db2.gz ZZBDKCLWQCPACS-UHFFFAOYSA-N 0 0 383.447 3.178 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(Br)cnc1N(C)C ZINC000172001161 565461506 /nfs/dbraw/zinc/46/15/06/565461506.db2.gz YYWPXPHUXTYKSL-UHFFFAOYSA-N 0 0 395.213 3.079 20 5 GGBDRN C[C@H](Oc1ccccc1Br)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000171994856 565461755 /nfs/dbraw/zinc/46/17/55/565461755.db2.gz TWELQCQTNIKHLL-NSHDSACASA-N 0 0 379.210 3.441 20 5 GGBDRN C[C@]1(CNC(=O)c2cccc([N+](=O)[O-])c2Br)CCO[C@H]1C1CC1 ZINC000376983602 565461940 /nfs/dbraw/zinc/46/19/40/565461940.db2.gz VRPOWCGENFOPMR-GOEBONIOSA-N 0 0 383.242 3.292 20 5 GGBDRN NS(=O)(=O)c1cc(NCCc2csc3ccccc23)cc([N+](=O)[O-])c1 ZINC000301062487 565462278 /nfs/dbraw/zinc/46/22/78/565462278.db2.gz ABSOSMBOIVBLQX-UHFFFAOYSA-N 0 0 377.447 3.112 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCSC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000172026303 565462567 /nfs/dbraw/zinc/46/25/67/565462567.db2.gz ZAEASTJYKHZURC-QGZVFWFLSA-N 0 0 378.475 3.382 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCN(Cc2cccnc2)CC1 ZINC000301074632 565462929 /nfs/dbraw/zinc/46/29/29/565462929.db2.gz JCFXCHNLLWMEDP-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN Cc1n[nH]cc1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 ZINC000377004857 565462917 /nfs/dbraw/zinc/46/29/17/565462917.db2.gz ACQGCQMSROSIKO-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN CCCCNC(=O)C1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000301082949 565463444 /nfs/dbraw/zinc/46/34/44/565463444.db2.gz LFFGIVUNCARMJY-UHFFFAOYSA-N 0 0 384.274 3.490 20 5 GGBDRN NS(=O)(=O)c1ccc(NCCc2csc3ccccc23)c([N+](=O)[O-])c1 ZINC000301088053 565463797 /nfs/dbraw/zinc/46/37/97/565463797.db2.gz MEPGJSGMPQWMPG-UHFFFAOYSA-N 0 0 377.447 3.112 20 5 GGBDRN NS(=O)(=O)c1ccc(N[C@H]2CCSc3c(F)cccc32)c([N+](=O)[O-])c1 ZINC000301098268 565464014 /nfs/dbraw/zinc/46/40/14/565464014.db2.gz SALMMJIBKAFCRG-LBPRGKRZSA-N 0 0 383.426 3.030 20 5 GGBDRN C[C@@H]1CCSCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000276884213 565464369 /nfs/dbraw/zinc/46/43/69/565464369.db2.gz PSHXDNWEYYCJTQ-MRVPVSSYSA-N 0 0 377.235 3.464 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC(Oc2ccc(F)nc2)CC1 ZINC000276865910 565464535 /nfs/dbraw/zinc/46/45/35/565464535.db2.gz ZNNNPQLOUAGEFP-UHFFFAOYSA-N 0 0 397.204 3.334 20 5 GGBDRN CC(C)N(C)C(=O)C1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000301119662 565464945 /nfs/dbraw/zinc/46/49/45/565464945.db2.gz RXIDFBLBPCHGQP-UHFFFAOYSA-N 0 0 384.274 3.441 20 5 GGBDRN O=C(NCC1CC1)[C@@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301119392 565465010 /nfs/dbraw/zinc/46/50/10/565465010.db2.gz VXBMFAKKUKJLAF-GFCCVEGCSA-N 0 0 382.258 3.100 20 5 GGBDRN CCO[C@@H]1CCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000301111977 565465080 /nfs/dbraw/zinc/46/50/80/565465080.db2.gz KYBNEBOTYUAKTR-LLVKDONJSA-N 0 0 376.194 3.205 20 5 GGBDRN O=[N+]([O-])c1c(NCCc2cc(Cl)c3c(c2)OCCO3)nc2sccn21 ZINC000301117510 565465222 /nfs/dbraw/zinc/46/52/22/565465222.db2.gz ZXEITRVPHYXVFB-UHFFFAOYSA-N 0 0 380.813 3.383 20 5 GGBDRN CNC(=O)c1ccc(N2CCc3cc(Br)ccc32)c([N+](=O)[O-])c1 ZINC000301133837 565465809 /nfs/dbraw/zinc/46/58/09/565465809.db2.gz ZEDAQBXCCMORLO-UHFFFAOYSA-N 0 0 376.210 3.411 20 5 GGBDRN COc1cc(CNc2c([N+](=O)[O-])c(C)nn2C)cc(Br)c1OC ZINC000301134350 565466177 /nfs/dbraw/zinc/46/61/77/565466177.db2.gz XFEVZNNIWJXCSW-UHFFFAOYSA-N 0 0 385.218 3.029 20 5 GGBDRN CC(C)n1cc(Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000301138952 565466267 /nfs/dbraw/zinc/46/62/67/565466267.db2.gz BJRCTZBWCBAJAB-UHFFFAOYSA-N 0 0 378.332 3.409 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC1CCSCC1 ZINC000301132379 565466357 /nfs/dbraw/zinc/46/63/57/565466357.db2.gz TWTGOABLNCYFBM-UHFFFAOYSA-N 0 0 385.511 3.077 20 5 GGBDRN CC(C)(CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)c1ccccc1Cl ZINC000301148909 565466914 /nfs/dbraw/zinc/46/69/14/565466914.db2.gz IPJKGKPIOYLNPM-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN CNS(=O)(=O)c1ccc(Nc2ccc(CCSC)cc2)c([N+](=O)[O-])c1 ZINC000301141502 565466923 /nfs/dbraw/zinc/46/69/23/565466923.db2.gz BVHVKZBAIMUHLM-UHFFFAOYSA-N 0 0 381.479 3.152 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1N1CCN(Cc2ccc(Br)s2)CC1 ZINC000301148996 565467113 /nfs/dbraw/zinc/46/71/13/565467113.db2.gz IUUOIRKQHZYXJY-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN O=C(NCCc1nc(-c2cccc(Cl)c2)no1)c1csc([N+](=O)[O-])c1 ZINC000172114362 565467603 /nfs/dbraw/zinc/46/76/03/565467603.db2.gz FKJQTALZTUCUBI-UHFFFAOYSA-N 0 0 378.797 3.332 20 5 GGBDRN COc1ccc(Br)cc1[C@H]1CCCN1c1ncc([N+](=O)[O-])c(N)n1 ZINC000301159017 565468284 /nfs/dbraw/zinc/46/82/84/565468284.db2.gz OOAAFNONLHGHHP-LLVKDONJSA-N 0 0 394.229 3.080 20 5 GGBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCSC[C@@H]1c1cnn(C)c1 ZINC000276978641 565470281 /nfs/dbraw/zinc/47/02/81/565470281.db2.gz RBGCOSSVQJQFDV-CQSZACIVSA-N 0 0 380.857 3.220 20 5 GGBDRN COC(=O)CSCc1cccc(Nc2nc3sccn3c2[N+](=O)[O-])c1 ZINC000301192302 565470380 /nfs/dbraw/zinc/47/03/80/565470380.db2.gz MBQSVUXRKAULQZ-UHFFFAOYSA-N 0 0 378.435 3.454 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCc1ccc(Br)cc1 ZINC000172176300 565470489 /nfs/dbraw/zinc/47/04/89/565470489.db2.gz PFLDRBNBYKVYAK-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN O=C(Cc1cccc(F)c1)NCCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000301186491 565470662 /nfs/dbraw/zinc/47/06/62/565470662.db2.gz PLTLUNUXPGTOHQ-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN Cc1nn(C)c(NCCC(=O)Nc2ccc(Br)cc2C)c1[N+](=O)[O-] ZINC000301193460 565470700 /nfs/dbraw/zinc/47/07/00/565470700.db2.gz SPKAHFRPULRUFM-UHFFFAOYSA-N 0 0 396.245 3.148 20 5 GGBDRN COc1cc(C(=O)NCCc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000172175944 565470756 /nfs/dbraw/zinc/47/07/56/565470756.db2.gz IICVECUZDMRPSQ-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN Cc1ncsc1CNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000301193980 565470929 /nfs/dbraw/zinc/47/09/29/565470929.db2.gz MVPQBGHOTUTJRR-UHFFFAOYSA-N 0 0 381.357 3.265 20 5 GGBDRN CC(C)C(=O)NC[C@@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301207413 565471710 /nfs/dbraw/zinc/47/17/10/565471710.db2.gz ZWCACNIDTVOWFY-LBPRGKRZSA-N 0 0 384.274 3.346 20 5 GGBDRN O=C(CNc1ccc(Br)cc1[N+](=O)[O-])N1CCc2ccccc21 ZINC000301195778 565472038 /nfs/dbraw/zinc/47/20/38/565472038.db2.gz UFVYZDLCQKKEOY-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN C[C@@H](CNc1ccc(I)cc1[N+](=O)[O-])Cn1cccn1 ZINC000301230285 565473243 /nfs/dbraw/zinc/47/32/43/565473243.db2.gz FBKXUVUSTOXFEP-JTQLQIEISA-N 0 0 386.193 3.144 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(O)c(Br)c2)cc([N+](=O)[O-])c1C ZINC000189558765 565473896 /nfs/dbraw/zinc/47/38/96/565473896.db2.gz LGUAVGILRFPONR-UHFFFAOYSA-N 0 0 395.209 3.310 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000277059956 565474938 /nfs/dbraw/zinc/47/49/38/565474938.db2.gz JWPXKVDPTCHRFW-UHFFFAOYSA-N 0 0 375.328 3.051 20 5 GGBDRN O=C(NCCc1ccc(Br)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000172283038 565476228 /nfs/dbraw/zinc/47/62/28/565476228.db2.gz SRTQFTULNRRZMO-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN O=C(Nc1ccc(OC2COC2)cc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000189583643 565476357 /nfs/dbraw/zinc/47/63/57/565476357.db2.gz CEYXQBQPSJNNHT-UHFFFAOYSA-N 0 0 393.193 3.387 20 5 GGBDRN CN(CC(=O)Nc1ccccc1Br)c1ncc([N+](=O)[O-])cc1Cl ZINC000301274971 565476341 /nfs/dbraw/zinc/47/63/41/565476341.db2.gz LQMRZPWMGOPKHI-UHFFFAOYSA-N 0 0 399.632 3.481 20 5 GGBDRN CC[C@@H](C)c1nnc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2Br)[nH]1 ZINC000277114318 565476389 /nfs/dbraw/zinc/47/63/89/565476389.db2.gz DUABQHCSVFWMGU-BDAKNGLRSA-N 0 0 396.245 3.480 20 5 GGBDRN C[C@H]1CSCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000277110985 565476578 /nfs/dbraw/zinc/47/65/78/565476578.db2.gz RLLQHBLYBNOWNE-MRVPVSSYSA-N 0 0 377.235 3.322 20 5 GGBDRN Cc1nc(CNC(=O)c2cccc([N+](=O)[O-])c2Br)ccc1[C@H](C)O ZINC000277116140 565477311 /nfs/dbraw/zinc/47/73/11/565477311.db2.gz DZCALHLEMLTXKL-JTQLQIEISA-N 0 0 394.225 3.044 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCCC[C@H]1c1ncon1 ZINC000189610995 565477388 /nfs/dbraw/zinc/47/73/88/565477388.db2.gz LYTTVPZZPAFMMI-ZDUSSCGKSA-N 0 0 395.213 3.498 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)[C@@H]2CCCO[C@@H]21 ZINC000377391753 565478086 /nfs/dbraw/zinc/47/80/86/565478086.db2.gz NIWAJVWOMMHMMZ-GDLCADMTSA-N 0 0 383.242 3.291 20 5 GGBDRN CCn1cc(Br)cc1C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1 ZINC000172313646 565478364 /nfs/dbraw/zinc/47/83/64/565478364.db2.gz WAGWEINJSGFWQR-UHFFFAOYSA-N 0 0 396.197 3.218 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@@H]2CCO[C@H]2c2ccccc2)s1 ZINC000277149104 565478930 /nfs/dbraw/zinc/47/89/30/565478930.db2.gz 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ZINC000172376322 565482600 /nfs/dbraw/zinc/48/26/00/565482600.db2.gz ANUJYRQWZHCWPS-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(c1ccc([N+](=O)[O-])cc1Br)CC2 ZINC000301391749 565482719 /nfs/dbraw/zinc/48/27/19/565482719.db2.gz HOPRQNXODKOEPQ-GJZGRUSLSA-N 0 0 385.258 3.114 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301393833 565482816 /nfs/dbraw/zinc/48/28/16/565482816.db2.gz CTHIBMITVBNJNO-GFCCVEGCSA-N 0 0 384.274 3.490 20 5 GGBDRN O=[N+]([O-])c1ccc(NC2CCN(c3cccnn3)CC2)c(Br)c1 ZINC000277210391 565482825 /nfs/dbraw/zinc/48/28/25/565482825.db2.gz QPECJEMWZBQMBV-UHFFFAOYSA-N 0 0 378.230 3.228 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(c1ccc(Br)cc1[N+](=O)[O-])CC2 ZINC000301382509 565482931 /nfs/dbraw/zinc/48/29/31/565482931.db2.gz ZEVCYCDMFJMFPQ-HUUCEWRRSA-N 0 0 385.258 3.114 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301393834 565482940 /nfs/dbraw/zinc/48/29/40/565482940.db2.gz CTHIBMITVBNJNO-LBPRGKRZSA-N 0 0 384.274 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ZINC000302016693 565525540 /nfs/dbraw/zinc/52/55/40/565525540.db2.gz FVXQGXUCASVHEY-UHFFFAOYSA-N 0 0 386.637 3.444 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCNc1cccc(Br)c1 ZINC000302065865 565527642 /nfs/dbraw/zinc/52/76/42/565527642.db2.gz SKASPLNOHZXZHC-UHFFFAOYSA-N 0 0 393.241 3.241 20 5 GGBDRN O=C(Nc1cnc2c(c1)COCC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000378475371 565528576 /nfs/dbraw/zinc/52/85/76/565528576.db2.gz PLRXBRDXDOKMSI-UHFFFAOYSA-N 0 0 378.182 3.077 20 5 GGBDRN Cc1nc(CCNC(=O)c2cccc([N+](=O)[O-])c2Br)sc1C ZINC000190394559 565528694 /nfs/dbraw/zinc/52/86/94/565528694.db2.gz MCALQEOZWNFBRN-UHFFFAOYSA-N 0 0 384.255 3.403 20 5 GGBDRN O=C1OCCN1c1ccc(CNc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000302077345 565528816 /nfs/dbraw/zinc/52/88/16/565528816.db2.gz JWQAIEOSJFFCPU-UHFFFAOYSA-N 0 0 393.197 3.321 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCS[C@@H]2COCC[C@@H]21 ZINC000378458478 565529450 /nfs/dbraw/zinc/52/94/50/565529450.db2.gz FEWOAWQPOUTAMP-GOEBONIOSA-N 0 0 382.507 3.442 20 5 GGBDRN O=C(NCCC[C@@H]1CCCCO1)c1sc(Br)cc1[N+](=O)[O-] ZINC000277951266 565530242 /nfs/dbraw/zinc/53/02/42/565530242.db2.gz CQDADWDYAFWQDH-VIFPVBQESA-N 0 0 377.260 3.498 20 5 GGBDRN O=C(NCCC[C@H]1CCCCO1)c1sc(Br)cc1[N+](=O)[O-] ZINC000277951263 565530664 /nfs/dbraw/zinc/53/06/64/565530664.db2.gz CQDADWDYAFWQDH-SECBINFHSA-N 0 0 377.260 3.498 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2csc(-c3ccco3)n2)s1 ZINC000302097826 565530623 /nfs/dbraw/zinc/53/06/23/565530623.db2.gz SZDRIJGUTFRPPA-UHFFFAOYSA-N 0 0 385.448 3.388 20 5 GGBDRN NS(=O)(=O)c1cccc(Sc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000302121115 565531468 /nfs/dbraw/zinc/53/14/68/565531468.db2.gz GELUARAPGSPYLY-UHFFFAOYSA-N 0 0 389.252 3.156 20 5 GGBDRN CC(C)(CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)c1ccc(Cl)cc1 ZINC000302113892 565531642 /nfs/dbraw/zinc/53/16/42/565531642.db2.gz VKCHFROJXLEVGH-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN CC(C)(CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000302131857 565532350 /nfs/dbraw/zinc/53/23/50/565532350.db2.gz KPFDBLUKLVGXNQ-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN NS(=O)(=O)c1cccc(N[C@@H]2C[C@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000302146360 565532416 /nfs/dbraw/zinc/53/24/16/565532416.db2.gz RISOOIJPTZZKDD-PRHODGIISA-N 0 0 385.804 3.003 20 5 GGBDRN CCCn1c(=O)c2ccc(Cl)cc2nc1Sc1ncc([N+](=O)[O-])cn1 ZINC000302142889 565532643 /nfs/dbraw/zinc/53/26/43/565532643.db2.gz FYCBVNPMSGZAQP-UHFFFAOYSA-N 0 0 377.813 3.309 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Cc2cc[nH]c(=O)c2Br)cc1[N+](=O)[O-] ZINC000277988543 565532769 /nfs/dbraw/zinc/53/27/69/565532769.db2.gz MYLLGYSTVKUWFA-SNVBAGLBSA-N 0 0 394.225 3.186 20 5 GGBDRN O=[N+]([O-])c1cnc(Sc2nnc(-c3ccc(Br)cc3)o2)nc1 ZINC000302142451 565533166 /nfs/dbraw/zinc/53/31/66/565533166.db2.gz FPYMMBHYVRUGQG-UHFFFAOYSA-N 0 0 380.183 3.349 20 5 GGBDRN C[C@H](Nc1ncc([N+](=O)[O-])cn1)c1cc2c(cc1Br)OCCO2 ZINC000302160786 565533836 /nfs/dbraw/zinc/53/38/36/565533836.db2.gz PBOMHSIMQSQFBA-QMMMGPOBSA-N 0 0 381.186 3.092 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 ZINC000302153047 565533864 /nfs/dbraw/zinc/53/38/64/565533864.db2.gz UXIHNPYJSZZSBX-CQSZACIVSA-N 0 0 387.889 3.079 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000302175006 565534678 /nfs/dbraw/zinc/53/46/78/565534678.db2.gz MROFGKQBXPQTET-UHFFFAOYSA-N 0 0 378.771 3.414 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)C2CCCC2)cc1[N+](=O)[O-] ZINC000173192176 565534981 /nfs/dbraw/zinc/53/49/81/565534981.db2.gz MRTDTCIHPDKSTG-UHFFFAOYSA-N 0 0 377.260 3.229 20 5 GGBDRN C[C@H](c1ccc(Br)cc1)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1 ZINC000302171011 565535326 /nfs/dbraw/zinc/53/53/26/565535326.db2.gz URWSEKOKMDZXTB-GFCCVEGCSA-N 0 0 392.257 3.031 20 5 GGBDRN Nc1nc(N2CCC[C@@H]2c2cc(F)cc(Br)c2)ncc1[N+](=O)[O-] ZINC000302194500 565536349 /nfs/dbraw/zinc/53/63/49/565536349.db2.gz DBRCMLHKRHXPGW-LLVKDONJSA-N 0 0 382.193 3.210 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1cccc([N+](=O)[O-])c1Br ZINC000190499122 565536700 /nfs/dbraw/zinc/53/67/00/565536700.db2.gz HSMUMNQKOLRBTE-GDLCADMTSA-N 0 0 381.226 3.045 20 5 GGBDRN C[C@H](COc1ccc(F)cc1F)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000302214383 565536877 /nfs/dbraw/zinc/53/68/77/565536877.db2.gz ZOGXPBPZFHFJDU-MRVPVSSYSA-N 0 0 392.405 3.217 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CC[C@H](c3c(F)cccc3F)C2)s1 ZINC000302210662 565537530 /nfs/dbraw/zinc/53/75/30/565537530.db2.gz CVOSYGXQWARDLI-VIFPVBQESA-N 0 0 388.417 3.332 20 5 GGBDRN COc1ccc2c(c1)nc(CNc1ncc(Br)cc1[N+](=O)[O-])n2C ZINC000302229709 565538343 /nfs/dbraw/zinc/53/83/43/565538343.db2.gz BFKXERIRNOCMNT-UHFFFAOYSA-N 0 0 392.213 3.260 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1c[nH]c(=O)c(Br)c1 ZINC000173224497 565538600 /nfs/dbraw/zinc/53/86/00/565538600.db2.gz HJRUDXLLGNSDRG-UHFFFAOYSA-N 0 0 394.225 3.096 20 5 GGBDRN CC(C)[C@@H]1C[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCO1 ZINC000278079489 565538856 /nfs/dbraw/zinc/53/88/56/565538856.db2.gz OVILJAOODBONFJ-WPRPVWTQSA-N 0 0 377.260 3.352 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC([C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000190518378 565539093 /nfs/dbraw/zinc/53/90/93/565539093.db2.gz YANXYDUQKWFYKH-OAHLLOKOSA-N 0 0 388.873 3.136 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])s1 ZINC000173233800 565539807 /nfs/dbraw/zinc/53/98/07/565539807.db2.gz DGVJDXVTLAZPIU-SNVBAGLBSA-N 0 0 387.458 3.443 20 5 GGBDRN COCCC1(CNC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC1 ZINC000278134176 565541727 /nfs/dbraw/zinc/54/17/27/565541727.db2.gz NFDBFIXAJCEYSW-UHFFFAOYSA-N 0 0 377.260 3.355 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCS(=O)(=O)c3ccccc3C2)c(Br)c1 ZINC000302494136 565543970 /nfs/dbraw/zinc/54/39/70/565543970.db2.gz TZOSVUPOVWORAF-UHFFFAOYSA-N 0 0 397.250 3.151 20 5 GGBDRN C[C@@H]1[C@@H](C)CCCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000173294696 565544570 /nfs/dbraw/zinc/54/45/70/565544570.db2.gz JESJVAYJEHGDOK-VHSXEESVSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C(NC[C@H]1COC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1Br ZINC000190598043 565544688 /nfs/dbraw/zinc/54/46/88/565544688.db2.gz VHXFXCVDPQFVTQ-NSHDSACASA-N 0 0 399.241 3.163 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCC1CCN(CC(F)(F)F)CC1 ZINC000302516035 565544992 /nfs/dbraw/zinc/54/49/92/565544992.db2.gz HFWDJYXRFNNUGI-UHFFFAOYSA-N 0 0 397.195 3.439 20 5 GGBDRN C[C@@H]1CCSCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000190619346 565546023 /nfs/dbraw/zinc/54/60/23/565546023.db2.gz HEZSQGROHBJWBE-SECBINFHSA-N 0 0 384.401 3.130 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000385840970 565547014 /nfs/dbraw/zinc/54/70/14/565547014.db2.gz ZQKOVRFDFOHLNA-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1coc(-c2cccs2)n1 ZINC000302621732 565547379 /nfs/dbraw/zinc/54/73/79/565547379.db2.gz FNJYEJXHPJIWHP-UHFFFAOYSA-N 0 0 379.419 3.327 20 5 GGBDRN CCOC(=O)N[C@H]1CCCN(c2cc(C)c([N+](=O)[O-])cc2Br)C1 ZINC000302627689 565547410 /nfs/dbraw/zinc/54/74/10/565547410.db2.gz BJGKBKYPIHOIJO-NSHDSACASA-N 0 0 386.246 3.381 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(Br)cc1 ZINC000302618679 565547617 /nfs/dbraw/zinc/54/76/17/565547617.db2.gz GKJACXGRCICHEY-UHFFFAOYSA-N 0 0 385.239 3.373 20 5 GGBDRN Cc1cc(N2CCC(c3nncn3C)CC2)c(Br)cc1[N+](=O)[O-] ZINC000302627706 565547865 /nfs/dbraw/zinc/54/78/65/565547865.db2.gz BKCXZANEYOTYFA-UHFFFAOYSA-N 0 0 380.246 3.178 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1ccc(Br)cc1 ZINC000386750301 565548210 /nfs/dbraw/zinc/54/82/10/565548210.db2.gz BQJOHRCEADCXNA-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CC1(C)CN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC[C@@H]1C(F)(F)F ZINC000302646283 565548401 /nfs/dbraw/zinc/54/84/01/565548401.db2.gz ARVFIUDWIDALTK-LBPRGKRZSA-N 0 0 380.388 3.413 20 5 GGBDRN COC(=O)c1cnc(NCc2cccc(C)c2Br)c([N+](=O)[O-])c1 ZINC000302657247 565548773 /nfs/dbraw/zinc/54/87/73/565548773.db2.gz AGQPDTDLANXNSE-UHFFFAOYSA-N 0 0 380.198 3.459 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1sccc1Br ZINC000302633168 565548867 /nfs/dbraw/zinc/54/88/67/565548867.db2.gz JQCXNZDVDSOLSU-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN COC(=O)c1cnc(N(C)Cc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000302668593 565549026 /nfs/dbraw/zinc/54/90/26/565549026.db2.gz CTSXJSZKQXBIAJ-UHFFFAOYSA-N 0 0 380.198 3.175 20 5 GGBDRN Cc1cc(N2CCN(C(=O)C(C)(C)C)CC2)c(Br)cc1[N+](=O)[O-] ZINC000302639808 565549058 /nfs/dbraw/zinc/54/90/58/565549058.db2.gz DQSFILVASQADPA-UHFFFAOYSA-N 0 0 384.274 3.360 20 5 GGBDRN O=C(NCc1ccco1)[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1Br ZINC000302673765 565549479 /nfs/dbraw/zinc/54/94/79/565549479.db2.gz OZWDLGXQRUKCEX-OAHLLOKOSA-N 0 0 394.225 3.236 20 5 GGBDRN O=C(CCn1cc(Cl)cn1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278282758 565549625 /nfs/dbraw/zinc/54/96/25/565549625.db2.gz BDBXDHFYQFOZGE-UHFFFAOYSA-N 0 0 376.722 3.170 20 5 GGBDRN C[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000278292175 565549816 /nfs/dbraw/zinc/54/98/16/565549816.db2.gz BVSBQEIHYIVFBF-QMMMGPOBSA-N 0 0 395.384 3.251 20 5 GGBDRN CCCNC(=O)[C@H]1CCCN(c2cc(C)c([N+](=O)[O-])cc2Br)C1 ZINC000302671422 565550047 /nfs/dbraw/zinc/55/00/47/565550047.db2.gz KRIRWQCIFLKWEV-LBPRGKRZSA-N 0 0 384.274 3.408 20 5 GGBDRN C[C@@H]1CSCCN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000302683419 565550071 /nfs/dbraw/zinc/55/00/71/565550071.db2.gz ALSSGGHFWBMXOD-VIFPVBQESA-N 0 0 384.401 3.078 20 5 GGBDRN COc1ccc(OC[C@@H](O)COc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000190673259 565550494 /nfs/dbraw/zinc/55/04/94/565550494.db2.gz WBNPCURLYQZXGW-LBPRGKRZSA-N 0 0 398.209 3.185 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N(C)Cc2csc(Br)c2)n1 ZINC000388307805 565550759 /nfs/dbraw/zinc/55/07/59/565550759.db2.gz DIJYFEZPXOREOI-UHFFFAOYSA-N 0 0 386.227 3.237 20 5 GGBDRN COC(=O)c1cnc(N2CCc3cc(Br)ccc3C2)c([N+](=O)[O-])c1 ZINC000302708265 565550710 /nfs/dbraw/zinc/55/07/10/565550710.db2.gz JVQGHLUFZWWFBX-UHFFFAOYSA-N 0 0 392.209 3.102 20 5 GGBDRN COc1ccc(OC[C@H](O)COc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000190672897 565550881 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CS(=O)(=O)c1cc([N+](=O)[O-])ccc1Sc1nnc(-c2cccs2)o1 ZINC000302729624 565553211 /nfs/dbraw/zinc/55/32/11/565553211.db2.gz UUYXTAVBOMNLQH-UHFFFAOYSA-N 0 0 383.432 3.261 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@H]1CCOc2c(F)cccc21 ZINC000190722382 565554047 /nfs/dbraw/zinc/55/40/47/565554047.db2.gz XDYOCYUEQPPDJM-LBPRGKRZSA-N 0 0 386.788 3.189 20 5 GGBDRN C[C@H]1CSCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000302757335 565554816 /nfs/dbraw/zinc/55/48/16/565554816.db2.gz XBUCDJUXQMNZCD-SECBINFHSA-N 0 0 378.235 3.389 20 5 GGBDRN O=C(NCCCn1cc(Br)cn1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000389998217 565555244 /nfs/dbraw/zinc/55/52/44/565555244.db2.gz OXDQMJLQRAIDKV-UHFFFAOYSA-N 0 0 387.621 3.027 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1nc(C(F)(F)F)cs1 ZINC000278389405 565555799 /nfs/dbraw/zinc/55/57/99/565555799.db2.gz MLOKVBZWJUVYSO-LURJTMIESA-N 0 0 399.347 3.249 20 5 GGBDRN CC(C)(NCC(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1nccs1 ZINC000173423572 565556341 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COC(=O)[C@H](CNc1ncc([N+](=O)[O-])cc1Br)c1ccc(F)cc1 ZINC000302822376 565559323 /nfs/dbraw/zinc/55/93/23/565559323.db2.gz DYUVRVKNWDCAGE-GFCCVEGCSA-N 0 0 398.188 3.260 20 5 GGBDRN NS(=O)(=O)c1ccc(Sc2nc(-c3ccccc3)co2)c([N+](=O)[O-])c1 ZINC000302832924 565559331 /nfs/dbraw/zinc/55/93/31/565559331.db2.gz RWDBNVBJUXJBSB-UHFFFAOYSA-N 0 0 377.403 3.048 20 5 GGBDRN Cc1csc([C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C2CC2)n1 ZINC000173466730 565559472 /nfs/dbraw/zinc/55/94/72/565559472.db2.gz ZFHMBNVPGQEHHL-CYBMUJFWSA-N 0 0 387.870 3.443 20 5 GGBDRN CN(Cc1ccc(Br)o1)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173467017 565559556 /nfs/dbraw/zinc/55/95/56/565559556.db2.gz KURSNDXSEKGGQH-UHFFFAOYSA-N 0 0 382.214 3.045 20 5 GGBDRN COCc1nc(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cs1 ZINC000278463114 565559986 /nfs/dbraw/zinc/55/99/86/565559986.db2.gz YCFWIBDPGQIUHH-UHFFFAOYSA-N 0 0 375.328 3.147 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1Br ZINC000278460986 565560036 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COC(=O)c1ccc([N+](=O)[O-])c(NCCc2ccc(Br)cc2)n1 ZINC000391765673 565561135 /nfs/dbraw/zinc/56/11/35/565561135.db2.gz LSKSVVMGLVBADU-UHFFFAOYSA-N 0 0 380.198 3.194 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1cccc2cc(Br)cnc21 ZINC000391462410 565561640 /nfs/dbraw/zinc/56/16/40/565561640.db2.gz XRFXPOVFNKQHJN-UHFFFAOYSA-N 0 0 375.182 3.496 20 5 GGBDRN CNC(=O)c1ccc(NCCc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000391726085 565561659 /nfs/dbraw/zinc/56/16/59/565561659.db2.gz GYNJMWYVQOZYKS-UHFFFAOYSA-N 0 0 378.226 3.372 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1cc(Br)cc2c1OCC2 ZINC000392400624 565564147 /nfs/dbraw/zinc/56/41/47/565564147.db2.gz WKCFUFIPPQVFJN-UHFFFAOYSA-N 0 0 391.221 3.151 20 5 GGBDRN NC(=O)c1ccc(NCc2cc(Br)cc3c2OCC3)c([N+](=O)[O-])c1 ZINC000392333579 565564247 /nfs/dbraw/zinc/56/42/47/565564247.db2.gz TYBDFPRKFBJWGA-UHFFFAOYSA-N 0 0 392.209 3.003 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)Cc1cnoc1C1CC1 ZINC000278533847 565564239 /nfs/dbraw/zinc/56/42/39/565564239.db2.gz IXBMCAUGSSPXLR-UHFFFAOYSA-N 0 0 387.211 3.197 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000173533904 565564313 /nfs/dbraw/zinc/56/43/13/565564313.db2.gz JKRBUBOUAWDNDI-UHFFFAOYSA-N 0 0 399.347 3.030 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)Cc1nc(C(F)(F)F)cs1 ZINC000173533787 565564432 /nfs/dbraw/zinc/56/44/32/565564432.db2.gz FZQBQLPRCFUMSO-UHFFFAOYSA-N 0 0 395.384 3.199 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000173534600 565564598 /nfs/dbraw/zinc/56/45/98/565564598.db2.gz QGDBHDYTMIGTNR-UHFFFAOYSA-N 0 0 395.384 3.032 20 5 GGBDRN CS(=O)(=O)c1ccc2ncnc(Oc3cc(Cl)ccc3[N+](=O)[O-])c2c1 ZINC000302919642 565565094 /nfs/dbraw/zinc/56/50/94/565565094.db2.gz YPYYOPDBQPFVSD-UHFFFAOYSA-N 0 0 379.781 3.387 20 5 GGBDRN C[C@@H](CCc1ccc(Br)cc1)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000302991160 565566054 /nfs/dbraw/zinc/56/60/54/565566054.db2.gz LHWMITYWPKSWQA-JTQLQIEISA-N 0 0 394.225 3.209 20 5 GGBDRN CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000303127503 565566702 /nfs/dbraw/zinc/56/67/02/565566702.db2.gz AORRLAOHHFZQQV-SNVBAGLBSA-N 0 0 379.276 3.460 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])N(C)c1ccccc1 ZINC000303058183 565567483 /nfs/dbraw/zinc/56/74/83/565567483.db2.gz WSFXDJGWTHWUSZ-GFCCVEGCSA-N 0 0 383.857 3.051 20 5 GGBDRN CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000303127502 565567754 /nfs/dbraw/zinc/56/77/54/565567754.db2.gz AORRLAOHHFZQQV-JTQLQIEISA-N 0 0 379.276 3.460 20 5 GGBDRN C[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000278594591 565568660 /nfs/dbraw/zinc/56/86/60/565568660.db2.gz BQHQEQUIXXQPTL-QMMMGPOBSA-N 0 0 375.328 3.326 20 5 GGBDRN C[C@H]1CCC[C@H](NS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000303182496 565568962 /nfs/dbraw/zinc/56/89/62/565568962.db2.gz KOURQLNJKJLIIK-ONGXEEELSA-N 0 0 377.260 3.214 20 5 GGBDRN CS(=O)(=O)c1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000393198829 565568927 /nfs/dbraw/zinc/56/89/27/565568927.db2.gz IUQHTBKFSGXIOS-UHFFFAOYSA-N 0 0 375.328 3.024 20 5 GGBDRN CN(CCc1ccc(Br)cc1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000303332015 565569609 /nfs/dbraw/zinc/56/96/09/565569609.db2.gz ULQZAKWDAAJJKG-UHFFFAOYSA-N 0 0 393.237 3.437 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(Br)cc1C ZINC000303483124 565570864 /nfs/dbraw/zinc/57/08/64/565570864.db2.gz QGKRDODUZPPXGG-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000303670106 565572363 /nfs/dbraw/zinc/57/23/63/565572363.db2.gz DBDILXWNUAAYRV-BZNIZROVSA-N 0 0 384.841 3.303 20 5 GGBDRN C[C@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1 ZINC000173701831 565576945 /nfs/dbraw/zinc/57/69/45/565576945.db2.gz JGKUBMBRCAFEBZ-GFCCVEGCSA-N 0 0 384.841 3.135 20 5 GGBDRN COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccc(C)o1 ZINC000173709877 565577806 /nfs/dbraw/zinc/57/78/06/565577806.db2.gz WWTKWZOESFTGPV-CYBMUJFWSA-N 0 0 383.198 3.376 20 5 GGBDRN CS(=O)(=O)N(CCSCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000191037375 565579677 /nfs/dbraw/zinc/57/96/77/565579677.db2.gz NOFGIOSEZVZOBA-UHFFFAOYSA-N 0 0 380.491 3.290 20 5 GGBDRN C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000278827757 565579803 /nfs/dbraw/zinc/57/98/03/565579803.db2.gz UPOLPANSBFWWKU-QMMMGPOBSA-N 0 0 375.328 3.326 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)c1[N+](=O)[O-] ZINC000278914535 565585489 /nfs/dbraw/zinc/58/54/89/565585489.db2.gz JWZFNYMBVPKHQE-ZCFIWIBFSA-N 0 0 377.348 3.237 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000314594949 565587858 /nfs/dbraw/zinc/58/78/58/565587858.db2.gz BWRHLQUEERVABD-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1csc([C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)C2)n1 ZINC000173816444 565589500 /nfs/dbraw/zinc/58/95/00/565589500.db2.gz GYCXDIJFUKXNMU-ZDUSSCGKSA-N 0 0 381.479 3.236 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccccc2Br)cc1[N+](=O)[O-] ZINC000315306952 565589743 /nfs/dbraw/zinc/58/97/43/565589743.db2.gz JPNAHIOIEMOHAX-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1csc([C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)C2)n1 ZINC000173816463 565589850 /nfs/dbraw/zinc/58/98/50/565589850.db2.gz GYCXDIJFUKXNMU-CYBMUJFWSA-N 0 0 381.479 3.236 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cc2c(cc1Cl)CCC2=O ZINC000191228120 565589989 /nfs/dbraw/zinc/58/99/89/565589989.db2.gz QTHDOUHFEFXPAK-UHFFFAOYSA-N 0 0 380.809 3.486 20 5 GGBDRN Cc1csc([C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000173818047 565590141 /nfs/dbraw/zinc/59/01/41/565590141.db2.gz XWEACCXDIMPLCD-ZDUSSCGKSA-N 0 0 381.479 3.236 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CC[C@@H]1C ZINC000408050986 565591829 /nfs/dbraw/zinc/59/18/29/565591829.db2.gz HJQIDHQQPHSJSX-UWVGGRQHSA-N 0 0 377.260 3.024 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000173836009 565592216 /nfs/dbraw/zinc/59/22/16/565592216.db2.gz XZDBFCXOVVDBFW-MRVPVSSYSA-N 0 0 395.384 3.500 20 5 GGBDRN Cc1c(Br)c(=O)n(CC(=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000317535034 565593955 /nfs/dbraw/zinc/59/39/55/565593955.db2.gz VNNDGIZHSAFOSV-UHFFFAOYSA-N 0 0 385.601 3.364 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](CSc3ccccc3)C2)cc1 ZINC000173862077 565594901 /nfs/dbraw/zinc/59/49/01/565594901.db2.gz NAZDOZBOPZVVKW-AWEZNQCLSA-N 0 0 378.475 3.398 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1Br ZINC000191327930 565596617 /nfs/dbraw/zinc/59/66/17/565596617.db2.gz SJTKEZNPVQRVLK-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1Br ZINC000191329246 565597200 /nfs/dbraw/zinc/59/72/00/565597200.db2.gz PNKTZAPFQJOGLR-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN COC(=O)c1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1Br ZINC000191331814 565597220 /nfs/dbraw/zinc/59/72/20/565597220.db2.gz VTJBEAOZYPUBKI-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN O=C(NC[C@H]1CCSC1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000279175416 565599490 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20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2cccc(Br)c2)cc1C ZINC000321109092 565604305 /nfs/dbraw/zinc/60/43/05/565604305.db2.gz JJNNMMHTDVOCLT-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN CO[C@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000173987161 565604430 /nfs/dbraw/zinc/60/44/30/565604430.db2.gz AWHAUTULUQBUHK-MRXNPFEDSA-N 0 0 384.841 3.055 20 5 GGBDRN C[C@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC[S@]1=O ZINC000408372944 565606394 /nfs/dbraw/zinc/60/63/94/565606394.db2.gz CJLPSTUKSWCVCA-SDWAUSNYSA-N 0 0 398.282 3.253 20 5 GGBDRN C[C@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC[S@@](=O)C1 ZINC000408390933 565607141 /nfs/dbraw/zinc/60/71/41/565607141.db2.gz ABGHEYRKTLKCGZ-SDWAUSNYSA-N 0 0 398.282 3.110 20 5 GGBDRN CO[C@@H](C)c1nc(CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cs1 ZINC000279314574 565607322 /nfs/dbraw/zinc/60/73/22/565607322.db2.gz OTXCRIPQQKHDTB-QMMMGPOBSA-N 0 0 387.820 3.410 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000408446459 565609731 /nfs/dbraw/zinc/60/97/31/565609731.db2.gz LPMRQJRMYFLGAU-NXEZZACHSA-N 0 0 377.260 3.024 20 5 GGBDRN CC(C)C[C@]1(CO)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000191515889 565610215 /nfs/dbraw/zinc/61/02/15/565610215.db2.gz YYKSHPWRNNZZOY-KRWDZBQOSA-N 0 0 399.285 3.299 20 5 GGBDRN Cc1c(Br)cc(C(=O)OCc2ncnn2C(C)C)cc1[N+](=O)[O-] ZINC000279392072 565610282 /nfs/dbraw/zinc/61/02/82/565610282.db2.gz LKVJRPURKBJEPO-UHFFFAOYSA-N 0 0 383.202 3.195 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(Nc2ccc(OC)c(Br)c2)n1 ZINC000322580823 565610412 /nfs/dbraw/zinc/61/04/12/565610412.db2.gz IMVVWQRAFTZKHH-UHFFFAOYSA-N 0 0 382.170 3.291 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1c(Cl)cc(Cl)cc1Cl ZINC000174099758 565613740 /nfs/dbraw/zinc/61/37/40/565613740.db2.gz NLJVYPKTUIMRTA-UHFFFAOYSA-N 0 0 376.583 3.355 20 5 GGBDRN CN(Cc1nccn1C(F)F)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279548894 565619016 /nfs/dbraw/zinc/61/90/16/565619016.db2.gz MKSLESNAJKFXPT-UHFFFAOYSA-N 0 0 376.722 3.180 20 5 GGBDRN NC(=O)COc1ccc(Cl)cc1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000174211195 565621134 /nfs/dbraw/zinc/62/11/34/565621134.db2.gz KPNJAVLCMCIONU-UHFFFAOYSA-N 0 0 384.175 3.018 20 5 GGBDRN CCOc1ccc(C(=O)Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)cc1 ZINC000325652604 565622693 /nfs/dbraw/zinc/62/26/93/565622693.db2.gz HTKKXMSSDLNMNU-UHFFFAOYSA-N 0 0 395.209 3.109 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC(Nc2cccc(Br)c2)CC1 ZINC000279615961 565623620 /nfs/dbraw/zinc/62/36/20/565623620.db2.gz XLLYVQMOQFWJDH-UHFFFAOYSA-N 0 0 393.241 3.402 20 5 GGBDRN CO[C@@H]1[C@H](C)[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C1(C)C ZINC000409543695 565623893 /nfs/dbraw/zinc/62/38/93/565623893.db2.gz MNXWPGHSBDZLSK-DIMCTHFVSA-N 0 0 377.260 3.208 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)c2csc([N+](=O)[O-])c2)sc1C ZINC000279656394 565624235 /nfs/dbraw/zinc/62/42/35/565624235.db2.gz KEEQMLVIHJYPSY-JTQLQIEISA-N 0 0 381.435 3.185 20 5 GGBDRN C[C@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(Br)cn1 ZINC000279668995 565626140 /nfs/dbraw/zinc/62/61/40/565626140.db2.gz HJHQLZNWUFUIRH-JTQLQIEISA-N 0 0 394.225 3.470 20 5 GGBDRN C[S@](=O)C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000174302560 565628114 /nfs/dbraw/zinc/62/81/14/565628114.db2.gz OMWRYZJLCPEIFF-CPJLOUKISA-N 0 0 380.853 3.027 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2ccccc2[N+](=O)[O-])c1Br ZINC000191753517 565628628 /nfs/dbraw/zinc/62/86/28/565628628.db2.gz XDBMOUAZZJKELD-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN O=C(CSC[C@@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000191764477 565630284 /nfs/dbraw/zinc/63/02/84/565630284.db2.gz BBIXAYYHZVKHFD-JTQLQIEISA-N 0 0 375.244 3.208 20 5 GGBDRN CC(=O)NCCN(Cc1ccc(Cl)cc1Cl)c1ncccc1[N+](=O)[O-] ZINC000409663767 565631654 /nfs/dbraw/zinc/63/16/54/565631654.db2.gz CBVMNZBSOKYEKW-UHFFFAOYSA-N 0 0 383.235 3.439 20 5 GGBDRN CO[C@@]1(C)CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000279823261 565634927 /nfs/dbraw/zinc/63/49/27/565634927.db2.gz DQPKULWVOVNHFI-AWEZNQCLSA-N 0 0 375.194 3.138 20 5 GGBDRN CC[C@H](C)CC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000191832522 565636033 /nfs/dbraw/zinc/63/60/33/565636033.db2.gz BKLJVTXSAXUQBV-JTQLQIEISA-N 0 0 383.451 3.259 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@@H](C2CC2)O1 ZINC000279864484 565637456 /nfs/dbraw/zinc/63/74/56/565637456.db2.gz GNFKROOPIWYSPW-OQPBUACISA-N 0 0 387.205 3.136 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@H](C2CC2)O1 ZINC000279864477 565637739 /nfs/dbraw/zinc/63/77/39/565637739.db2.gz GNFKROOPIWYSPW-AMIZOPFISA-N 0 0 387.205 3.136 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000279928075 565640816 /nfs/dbraw/zinc/64/08/16/565640816.db2.gz GHRZKUWHPSXLIP-UHFFFAOYSA-N 0 0 383.451 3.080 20 5 GGBDRN CO[C@H]1Cc2ccccc2N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000409833062 565643558 /nfs/dbraw/zinc/64/35/58/565643558.db2.gz OEHYETPADOXQHI-LBPRGKRZSA-N 0 0 382.825 3.015 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1Oc1cc(C=O)c(Br)cc1OC ZINC000280001599 565646245 /nfs/dbraw/zinc/64/62/45/565646245.db2.gz HVUHLPZLQSDACI-UHFFFAOYSA-N 0 0 384.186 3.496 20 5 GGBDRN Cc1cc(F)cc2c1CN(S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000409932972 565650200 /nfs/dbraw/zinc/65/02/00/565650200.db2.gz WWMTYYUDOYEOKC-UHFFFAOYSA-N 0 0 384.816 3.443 20 5 GGBDRN O=C(Cc1ccc(I)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000192031014 565650477 /nfs/dbraw/zinc/65/04/77/565650477.db2.gz UTDVTPNNCWFLSY-UHFFFAOYSA-N 0 0 396.184 3.058 20 5 GGBDRN C[C@H]1CCS(=O)(=O)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000192059281 565653801 /nfs/dbraw/zinc/65/38/01/565653801.db2.gz ILTUKRDJOWIFOG-ZDUSSCGKSA-N 0 0 380.491 3.332 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCS(=O)(=O)C1 ZINC000192065861 565653816 /nfs/dbraw/zinc/65/38/16/565653816.db2.gz RYBZKSVDSCMFGU-CYBMUJFWSA-N 0 0 380.491 3.190 20 5 GGBDRN C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCS(=O)(=O)C1 ZINC000192069874 565655741 /nfs/dbraw/zinc/65/57/41/565655741.db2.gz BGIOWOIZFLURAZ-ZDUSSCGKSA-N 0 0 380.491 3.190 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1ccc([N+](=O)[O-])cc1Br ZINC000280186133 565657650 /nfs/dbraw/zinc/65/76/50/565657650.db2.gz VTBCNXFKRIUUSO-SECBINFHSA-N 0 0 395.213 3.227 20 5 GGBDRN C[C@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000280200523 565657656 /nfs/dbraw/zinc/65/76/56/565657656.db2.gz HRBWEZTVEACRET-NSHDSACASA-N 0 0 393.241 3.355 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@H](C)CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000192092410 565658153 /nfs/dbraw/zinc/65/81/53/565658153.db2.gz YOSMYGKNBDLFSM-GFCCVEGCSA-N 0 0 382.463 3.213 20 5 GGBDRN CC[C@@](C)(O)CNC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000174796787 565660253 /nfs/dbraw/zinc/66/02/53/565660253.db2.gz XSBCZPYHTKCODD-MRXNPFEDSA-N 0 0 381.479 3.402 20 5 GGBDRN Cc1sc(C(=O)Nc2ccc(Cl)c(N3CCNC3=O)c2)cc1[N+](=O)[O-] ZINC000410147617 565667425 /nfs/dbraw/zinc/66/74/25/565667425.db2.gz BUFWVQVOYQTHTC-UHFFFAOYSA-N 0 0 380.813 3.400 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCCC[C@H]2OC(F)F)c1[N+](=O)[O-] ZINC000410173512 565669360 /nfs/dbraw/zinc/66/93/60/565669360.db2.gz MDYXOSIXGPSWAD-VXGBXAGGSA-N 0 0 378.397 3.040 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCCc3cc(Cl)ccc32)ccc1[N+](=O)[O-] ZINC000410330606 565677715 /nfs/dbraw/zinc/67/77/15/565677715.db2.gz YJFJOSABBQNFSD-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000280528433 565677939 /nfs/dbraw/zinc/67/79/39/565677939.db2.gz GVXWZZRUKQWAET-ZDUSSCGKSA-N 0 0 397.204 3.057 20 5 GGBDRN Cc1cnc(OCc2cc3c(cc2Br)OCCO3)c([N+](=O)[O-])c1 ZINC000175142198 565681610 /nfs/dbraw/zinc/68/16/10/565681610.db2.gz JBUOEHRTAVJLFB-UHFFFAOYSA-N 0 0 381.182 3.411 20 5 GGBDRN C[C@@H](N[C@@H](C)c1ccc(Br)cn1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000280617488 565683742 /nfs/dbraw/zinc/68/37/42/565683742.db2.gz WHSOKISRWLYKBU-WDEREUQCSA-N 0 0 393.241 3.430 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCc2cc(Br)ccc2C1 ZINC000192386354 565684235 /nfs/dbraw/zinc/68/42/35/565684235.db2.gz FNYCTFKXTJEYKO-UHFFFAOYSA-N 0 0 377.198 3.343 20 5 GGBDRN COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000192386232 565684941 /nfs/dbraw/zinc/68/49/41/565684941.db2.gz UVJHEWHDXVRJHE-UHFFFAOYSA-N 0 0 384.175 3.487 20 5 GGBDRN CN1C(=O)N(c2cccc([N+](=O)[O-])c2)C(=O)[C@@H]1c1cccc(Br)c1 ZINC000192403046 565685465 /nfs/dbraw/zinc/68/54/65/565685465.db2.gz LUJBFXYSIZPHCG-AWEZNQCLSA-N 0 0 390.193 3.497 20 5 GGBDRN COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)c(I)c1 ZINC000192401156 565685560 /nfs/dbraw/zinc/68/55/60/565685560.db2.gz BRPPANTYYYKPMS-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)o1 ZINC000175250183 565688204 /nfs/dbraw/zinc/68/82/04/565688204.db2.gz IFGYRFZKXBDVEF-MRXNPFEDSA-N 0 0 397.225 3.205 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(CC(F)(F)F)C1CCCC1 ZINC000175305292 565692687 /nfs/dbraw/zinc/69/26/87/565692687.db2.gz NMXOTLZVSVYQER-UHFFFAOYSA-N 0 0 382.360 3.099 20 5 GGBDRN CCc1n[nH]c(C(=O)NC(C)(C)Cc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000192504991 565695878 /nfs/dbraw/zinc/69/58/78/565695878.db2.gz YRVYKCCXTMHQAV-UHFFFAOYSA-N 0 0 395.257 3.394 20 5 GGBDRN Cc1nc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(Br)s1 ZINC000410843310 565697974 /nfs/dbraw/zinc/69/79/74/565697974.db2.gz MQPOFGCNHHILIS-UHFFFAOYSA-N 0 0 384.255 3.437 20 5 GGBDRN Cc1cc(N2CC[C@H](Nc3ncc([N+](=O)[O-])s3)C2=O)ccc1Br ZINC000192532063 565698665 /nfs/dbraw/zinc/69/86/65/565698665.db2.gz BMMKJFHNFSUEBS-NSHDSACASA-N 0 0 397.254 3.340 20 5 GGBDRN Cc1cccc(C(=O)Nc2ncc(I)cc2C)c1[N+](=O)[O-] ZINC000175406766 565698792 /nfs/dbraw/zinc/69/87/92/565698792.db2.gz GYLVJTCBFBCOFE-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN C[C@H](NC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000280848741 565700185 /nfs/dbraw/zinc/70/01/85/565700185.db2.gz LEVXHEKQGZYJJB-NSHDSACASA-N 0 0 393.241 3.355 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1nc2c(s1)CCCC2 ZINC000175472034 565701760 /nfs/dbraw/zinc/70/17/60/565701760.db2.gz IRWWXODHRSCOID-UHFFFAOYSA-N 0 0 381.479 3.059 20 5 GGBDRN 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GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCOc1cccc(Br)c1 ZINC000176006439 565741343 /nfs/dbraw/zinc/74/13/43/565741343.db2.gz WMBQPNRSUHWBBO-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@@H](C)CC ZINC000176021927 565742334 /nfs/dbraw/zinc/74/23/34/565742334.db2.gz OYLRSWACXVUFQY-TVQRCGJNSA-N 0 0 387.230 3.065 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@H](C)CC ZINC000176021915 565742340 /nfs/dbraw/zinc/74/23/40/565742340.db2.gz OYLRSWACXVUFQY-NOZJJQNGSA-N 0 0 387.230 3.065 20 5 GGBDRN O=[N+]([O-])c1cnc(NC2CCN(c3nccs3)CC2)c(Br)c1 ZINC000281719100 565742981 /nfs/dbraw/zinc/74/29/81/565742981.db2.gz CASLBNIFPLCQIC-UHFFFAOYSA-N 0 0 384.259 3.290 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)c1[N+](=O)[O-] ZINC000281718309 565743249 /nfs/dbraw/zinc/74/32/49/565743249.db2.gz IBUQIVOHMKFCIW-MGCOHNPYSA-N 0 0 397.204 3.204 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)C2CC(C)(C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000411672365 565744518 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Cn1cc2c(n1)CCC[C@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000282536225 565784265 /nfs/dbraw/zinc/78/42/65/565784265.db2.gz QYMLECQRDGUENS-LLVKDONJSA-N 0 0 397.204 3.037 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000193939447 565784748 /nfs/dbraw/zinc/78/47/48/565784748.db2.gz HBFDZKFANYEHLP-JTQLQIEISA-N 0 0 392.209 3.173 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000331843288 565787761 /nfs/dbraw/zinc/78/77/61/565787761.db2.gz CUEGLPMFNJKFLZ-OAHLLOKOSA-N 0 0 381.841 3.477 20 5 GGBDRN Cn1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000331887293 565790563 /nfs/dbraw/zinc/79/05/63/565790563.db2.gz FYACUDHTCXOZDB-OAHLLOKOSA-N 0 0 393.241 3.458 20 5 GGBDRN CC(C)CN(C1CC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000331905003 565792087 /nfs/dbraw/zinc/79/20/87/565792087.db2.gz CGVHORLYAMMZLY-UHFFFAOYSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1C1CCOCC1 ZINC000331913385 565792948 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GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1nnc(C2CC2)s1 ZINC000412871558 565818143 /nfs/dbraw/zinc/81/81/43/565818143.db2.gz BNLBLNQPELWDKT-QMMMGPOBSA-N 0 0 382.829 3.061 20 5 GGBDRN O=C(NCc1ccc(Br)c(F)c1)NCc1ccccc1[N+](=O)[O-] ZINC000194496586 565818285 /nfs/dbraw/zinc/81/82/85/565818285.db2.gz BTNOPOIHTCURFG-UHFFFAOYSA-N 0 0 382.189 3.496 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1nnc(C2CC2)s1 ZINC000412871557 565818580 /nfs/dbraw/zinc/81/85/80/565818580.db2.gz BNLBLNQPELWDKT-MRVPVSSYSA-N 0 0 382.829 3.061 20 5 GGBDRN COc1ccc([C@H](CCO)Nc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000176959921 565818650 /nfs/dbraw/zinc/81/86/50/565818650.db2.gz JEZQOBAHNDDPQT-AWEZNQCLSA-N 0 0 382.214 3.297 20 5 GGBDRN CC(C)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1cccnc1 ZINC000412885442 565819384 /nfs/dbraw/zinc/81/93/84/565819384.db2.gz MMLDTNJEBNBENP-UHFFFAOYSA-N 0 0 392.253 3.389 20 5 GGBDRN O=C(NCc1nnc(C2CC2)s1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000412891375 565820158 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GGBDRN C[C@@H](O)C[C@H]1CCCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000332254151 565822404 /nfs/dbraw/zinc/82/24/04/565822404.db2.gz CUILLOMVIHUEOT-TZMCWYRMSA-N 0 0 399.285 3.442 20 5 GGBDRN C[C@H](O)C[C@H]1CCCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000332254145 565822667 /nfs/dbraw/zinc/82/26/67/565822667.db2.gz CUILLOMVIHUEOT-GXTWGEPZSA-N 0 0 399.285 3.442 20 5 GGBDRN CC(C)CCO[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000177008202 565822917 /nfs/dbraw/zinc/82/29/17/565822917.db2.gz MDPOCLMADHAFLT-CYBMUJFWSA-N 0 0 376.862 3.074 20 5 GGBDRN O=C(Nc1cc(Cl)cc([N+](=O)[O-])c1[O-])C1CC[NH+]([C@H]2CCSC2)CC1 ZINC000332263331 565823279 /nfs/dbraw/zinc/82/32/79/565823279.db2.gz CQRVXDULFXIVDU-LBPRGKRZSA-N 0 0 385.873 3.110 20 5 GGBDRN Cc1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(Br)n1 ZINC000283650395 565824882 /nfs/dbraw/zinc/82/48/82/565824882.db2.gz QFODYFHEEJEPBI-UHFFFAOYSA-N 0 0 378.226 3.375 20 5 GGBDRN NS(=O)(=O)c1ccc(OCCc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000194592279 565825198 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COCCn1cc2c(n1)[C@H](Nc1ncc(Br)cc1[N+](=O)[O-])CCC2 ZINC000364070465 566033520 /nfs/dbraw/zinc/03/35/20/566033520.db2.gz JGOJMWMXPJJHNC-GFCCVEGCSA-N 0 0 396.245 3.085 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000246685113 566037220 /nfs/dbraw/zinc/03/72/20/566037220.db2.gz HYDJNYZSBFIYBK-CJNGLKHVSA-N 0 0 385.251 3.296 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000180151794 566038005 /nfs/dbraw/zinc/03/80/05/566038005.db2.gz NRELQRAZNUYTCV-UHFFFAOYSA-N 0 0 394.758 3.486 20 5 GGBDRN CCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1ncc(C(=O)OC)s1 ZINC000416161947 566039038 /nfs/dbraw/zinc/03/90/38/566039038.db2.gz OEGAZPPYDKHQEF-UHFFFAOYSA-N 0 0 381.435 3.227 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC(OCC2CC2)CC1 ZINC000364276542 566041930 /nfs/dbraw/zinc/04/19/30/566041930.db2.gz WMJAVLANSJTGRB-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN CN(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1 ZINC000180229256 566046964 /nfs/dbraw/zinc/04/69/64/566046964.db2.gz ZFLDZOWTFJQXOS-UHFFFAOYSA-N 0 0 386.788 3.067 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000247014627 566049871 /nfs/dbraw/zinc/04/98/71/566049871.db2.gz LTGSVXVZXRBKMS-NWDGAFQWSA-N 0 0 384.274 3.208 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cncc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000180286730 566051488 /nfs/dbraw/zinc/05/14/88/566051488.db2.gz FHGNJQHVOOWKNV-UHFFFAOYSA-N 0 0 378.193 3.106 20 5 GGBDRN O=C(N[C@@H](CO)CC1CCCCC1)c1ccc([N+](=O)[O-])cc1Br ZINC000416331625 566053405 /nfs/dbraw/zinc/05/34/05/566053405.db2.gz JSOQMCFWLFYORM-GFCCVEGCSA-N 0 0 385.258 3.418 20 5 GGBDRN CCc1nn(C)c(Sc2nnc(-c3ccccc3Cl)n2C)c1[N+](=O)[O-] ZINC000288069124 566055447 /nfs/dbraw/zinc/05/54/47/566055447.db2.gz GQWQSERLPJTZQE-UHFFFAOYSA-N 0 0 378.845 3.491 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3Br)C2)n1 ZINC000180345325 566057041 /nfs/dbraw/zinc/05/70/41/566057041.db2.gz PRWJCZWVXCELPW-SNVBAGLBSA-N 0 0 395.213 3.069 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1CCc2sccc2C1 ZINC000416367808 566057116 /nfs/dbraw/zinc/05/71/16/566057116.db2.gz DISYWHJPXRTGTL-UHFFFAOYSA-N 0 0 392.380 3.422 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCNc1cccc(Br)c1 ZINC000180357826 566057979 /nfs/dbraw/zinc/05/79/79/566057979.db2.gz YPAVXKQAWUZGEA-UHFFFAOYSA-N 0 0 378.226 3.128 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H](CCO)c2ccc(Cl)cc2)s1 ZINC000288153221 566059001 /nfs/dbraw/zinc/05/90/01/566059001.db2.gz CEYJPWSUFPGBMU-LLVKDONJSA-N 0 0 390.870 3.249 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCOc2c(Cl)c(Cl)ccc21 ZINC000364589749 566058962 /nfs/dbraw/zinc/05/89/62/566058962.db2.gz OCBFBLZDDXERQD-LLVKDONJSA-N 0 0 385.207 3.047 20 5 GGBDRN Cc1occc1CN(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416383694 566060178 /nfs/dbraw/zinc/06/01/78/566060178.db2.gz FCRKMMRKWIAINB-UHFFFAOYSA-N 0 0 378.328 3.336 20 5 GGBDRN CCCCN(CCOC)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416384245 566060429 /nfs/dbraw/zinc/06/04/29/566060429.db2.gz HHOCMUXKJIDCLT-UHFFFAOYSA-N 0 0 384.376 3.051 20 5 GGBDRN CC1(C)CN(CC(F)(F)F)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000180413907 566061935 /nfs/dbraw/zinc/06/19/35/566061935.db2.gz DOVQWABLWOBFMB-UHFFFAOYSA-N 0 0 379.766 3.347 20 5 GGBDRN Cc1sc(Br)nc1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000288187543 566061987 /nfs/dbraw/zinc/06/19/87/566061987.db2.gz GEFNJCSISJWHQX-UHFFFAOYSA-N 0 0 384.255 3.437 20 5 GGBDRN C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000288228710 566063198 /nfs/dbraw/zinc/06/31/98/566063198.db2.gz FDGRPQCPPONJAI-YPMHNXCESA-N 0 0 382.258 3.056 20 5 GGBDRN Cc1nc(CNS(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])sc1C ZINC000416410464 566063264 /nfs/dbraw/zinc/06/32/64/566063264.db2.gz GCBCWWVYLNIJHC-UHFFFAOYSA-N 0 0 395.384 3.165 20 5 GGBDRN C[C@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000288228696 566063297 /nfs/dbraw/zinc/06/32/97/566063297.db2.gz FDGRPQCPPONJAI-AAEUAGOBSA-N 0 0 382.258 3.056 20 5 GGBDRN CC(C)[C@H]1CN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000416409473 566063321 /nfs/dbraw/zinc/06/33/21/566063321.db2.gz BGALLQXCOWIXEF-GFCCVEGCSA-N 0 0 398.428 3.376 20 5 GGBDRN CC[C@H]1CN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000416410590 566063547 /nfs/dbraw/zinc/06/35/47/566063547.db2.gz GGCGRSUTQIYTHN-JTQLQIEISA-N 0 0 384.401 3.130 20 5 GGBDRN Cc1nc(C)c(CNS(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000416407394 566063929 /nfs/dbraw/zinc/06/39/29/566063929.db2.gz KAKQULZGSZWRGH-UHFFFAOYSA-N 0 0 395.384 3.165 20 5 GGBDRN COC(C)(C)C[C@@H](C)NS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416408291 566063988 /nfs/dbraw/zinc/06/39/88/566063988.db2.gz PBLOESOSORSCAF-SECBINFHSA-N 0 0 384.376 3.096 20 5 GGBDRN CSCC[C@H](C)N(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416403126 566064048 /nfs/dbraw/zinc/06/40/48/566064048.db2.gz RAKQBGWAPBPOGC-VIFPVBQESA-N 0 0 386.417 3.376 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000288320370 566068530 /nfs/dbraw/zinc/06/85/30/566068530.db2.gz IXRHGQGNHHEFMD-GFCCVEGCSA-N 0 0 387.223 3.041 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000288320373 566068689 /nfs/dbraw/zinc/06/86/89/566068689.db2.gz IXRHGQGNHHEFMD-LBPRGKRZSA-N 0 0 387.223 3.041 20 5 GGBDRN CCc1cc(NC(=O)CSc2nncs2)c2cc([N+](=O)[O-])ccc2n1 ZINC000180503792 566068988 /nfs/dbraw/zinc/06/89/88/566068988.db2.gz ZIEZQFHKWYZPCL-UHFFFAOYSA-N 0 0 375.435 3.288 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000416454433 566069429 /nfs/dbraw/zinc/06/94/29/566069429.db2.gz IBQAVWAKUNTCNU-MRVPVSSYSA-N 0 0 395.384 3.152 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCCC[C@H]1c1cc[nH]n1 ZINC000288354982 566069519 /nfs/dbraw/zinc/06/95/19/566069519.db2.gz BFYPXFORNVTTIE-LBPRGKRZSA-N 0 0 379.214 3.448 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(F)c(Br)c(F)c1 ZINC000180532677 566070066 /nfs/dbraw/zinc/07/00/66/566070066.db2.gz VIUPVXCAZCISDQ-UHFFFAOYSA-N 0 0 389.156 3.169 20 5 GGBDRN CC(C)OCCCN(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416464037 566070536 /nfs/dbraw/zinc/07/05/36/566070536.db2.gz WMOXMQMVXITCOZ-UHFFFAOYSA-N 0 0 384.376 3.049 20 5 GGBDRN C[C@@H](CCc1ccc(Br)cc1)NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000180544155 566071381 /nfs/dbraw/zinc/07/13/81/566071381.db2.gz PVHBAEGXVAWSNA-JTQLQIEISA-N 0 0 393.241 3.086 20 5 GGBDRN C[C@@H]1CCSCCN1S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416467383 566071479 /nfs/dbraw/zinc/07/14/79/566071479.db2.gz BNYJGOCDFPBBGT-SECBINFHSA-N 0 0 384.401 3.130 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N(Cc1cccc(Br)c1)C1CC1 ZINC000180551205 566072566 /nfs/dbraw/zinc/07/25/66/566072566.db2.gz BOEXHQZLILUGOZ-UHFFFAOYSA-N 0 0 391.225 3.139 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000416474589 566073176 /nfs/dbraw/zinc/07/31/76/566073176.db2.gz YUEVLHMXQNVTNT-SECBINFHSA-N 0 0 384.401 3.130 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000248374664 566075916 /nfs/dbraw/zinc/07/59/16/566075916.db2.gz SGUKXKFEKAZJPN-HFBAOOFYSA-N 0 0 382.869 3.414 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180589861 566075965 /nfs/dbraw/zinc/07/59/65/566075965.db2.gz QZRUMFKXFVRWED-UHFFFAOYSA-N 0 0 381.230 3.025 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1Cc2sccc2CC1(C)C ZINC000416517143 566079989 /nfs/dbraw/zinc/07/99/89/566079989.db2.gz BYPXBQCSGSKNBT-UHFFFAOYSA-N 0 0 382.463 3.191 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)NC[C@@H]1CCC(F)(F)C1 ZINC000416524993 566081047 /nfs/dbraw/zinc/08/10/47/566081047.db2.gz NAMUXOSXFVBETH-MRVPVSSYSA-N 0 0 388.314 3.327 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCCc1ccc(F)c(Br)c1 ZINC000180684027 566081875 /nfs/dbraw/zinc/08/18/75/566081875.db2.gz SAHLVIJGDYOVRZ-UHFFFAOYSA-N 0 0 382.189 3.051 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3cccc(Cl)c3C2)cc1[N+](=O)[O-] ZINC000416534575 566082349 /nfs/dbraw/zinc/08/23/49/566082349.db2.gz XGGDUZHCAAHKNQ-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN O=C(NCc1cc(Br)cs1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180704467 566083236 /nfs/dbraw/zinc/08/32/36/566083236.db2.gz PONBLNFWDLDJGT-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN C[C@@H](CCCc1cccnc1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000416539587 566083438 /nfs/dbraw/zinc/08/34/38/566083438.db2.gz SNYZVSWIKIEXEY-LBPRGKRZSA-N 0 0 383.857 3.333 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)c2nc3c(s2)CCC3)c1C ZINC000416536278 566083467 /nfs/dbraw/zinc/08/34/67/566083467.db2.gz LMQQXOLORJDQPK-LLVKDONJSA-N 0 0 381.479 3.196 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000248618900 566084412 /nfs/dbraw/zinc/08/44/12/566084412.db2.gz LORFWRWEGHNYJY-GLAPUPDPSA-N 0 0 387.889 3.127 20 5 GGBDRN CN(Cc1cc(Br)ccc1F)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180729817 566084400 /nfs/dbraw/zinc/08/44/00/566084400.db2.gz AEKMNPHFBOAKDH-UHFFFAOYSA-N 0 0 382.189 3.351 20 5 GGBDRN CCOC[C@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000416542686 566084782 /nfs/dbraw/zinc/08/47/82/566084782.db2.gz FJRBHSIJYXLWFZ-LLVKDONJSA-N 0 0 397.280 3.481 20 5 GGBDRN O=C(NCc1noc2c1CCCC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000288681531 566086489 /nfs/dbraw/zinc/08/64/89/566086489.db2.gz VQQUHIQPHICFOE-UHFFFAOYSA-N 0 0 380.198 3.154 20 5 GGBDRN CN(C(=O)c1sc(Br)cc1[N+](=O)[O-])[C@@H]1CCCc2c1cnn2C ZINC000365199644 566089429 /nfs/dbraw/zinc/08/94/29/566089429.db2.gz FTEPGZZTHYWQQS-SECBINFHSA-N 0 0 399.270 3.302 20 5 GGBDRN C[C@@H](c1cccnc1)N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000180809726 566090324 /nfs/dbraw/zinc/09/03/24/566090324.db2.gz MKRUCFGUGCCUCT-NSHDSACASA-N 0 0 393.241 3.384 20 5 GGBDRN Cc1nn(C)cc1[C@@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000365249590 566091082 /nfs/dbraw/zinc/09/10/82/566091082.db2.gz QZVNNGLMGJXRSG-ZDUSSCGKSA-N 0 0 393.241 3.377 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)CC(F)(F)F ZINC000416589522 566091222 /nfs/dbraw/zinc/09/12/22/566091222.db2.gz BHEKMFOSGCDEDH-VIFPVBQESA-N 0 0 377.344 3.010 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)CC(F)(F)F ZINC000416589519 566091656 /nfs/dbraw/zinc/09/16/56/566091656.db2.gz BHEKMFOSGCDEDH-SECBINFHSA-N 0 0 377.344 3.010 20 5 GGBDRN Cc1nc([C@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)no1 ZINC000365232698 566092078 /nfs/dbraw/zinc/09/20/78/566092078.db2.gz ROWYESPNUHEEAI-GFCCVEGCSA-N 0 0 395.213 3.416 20 5 GGBDRN O=C(NCc1ccc(Br)cc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180837190 566093481 /nfs/dbraw/zinc/09/34/81/566093481.db2.gz XUCHXPYRFBDPQC-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCn1cc(Br)cn1 ZINC000288863588 566094631 /nfs/dbraw/zinc/09/46/31/566094631.db2.gz QAVUUUJNNKOQPB-UHFFFAOYSA-N 0 0 382.218 3.026 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(C)c(Br)cc1F ZINC000288888758 566095677 /nfs/dbraw/zinc/09/56/77/566095677.db2.gz DVMMAPQOFKXGBU-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN COc1ccc(CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000416618418 566096434 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GGBDRN CCN(CC(C)(C)C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000462294597 566277043 /nfs/dbraw/zinc/27/70/43/566277043.db2.gz WUUYSSOZONDHET-UHFFFAOYSA-N 0 0 379.276 3.414 20 5 GGBDRN COC(=O)c1ccccc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445249864 566277112 /nfs/dbraw/zinc/27/71/12/566277112.db2.gz OKSAHCZPQDUOKL-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN O=C(N[C@H](c1cc(F)cc(Br)c1)C1CC1)c1[nH]ncc1[N+](=O)[O-] ZINC000482035473 566278011 /nfs/dbraw/zinc/27/80/11/566278011.db2.gz TYSMOWBSQLXXHK-LBPRGKRZSA-N 0 0 383.177 3.101 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)nc1)c1sc(Br)cc1[N+](=O)[O-] ZINC000445266891 566278595 /nfs/dbraw/zinc/27/85/95/566278595.db2.gz VMQQFNDLCYIJJP-UHFFFAOYSA-N 0 0 394.210 3.252 20 5 GGBDRN C[C@@H]1CCCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H]1C ZINC000462300032 566278749 /nfs/dbraw/zinc/27/87/49/566278749.db2.gz RLNPDXYZQDBDLF-NXEZZACHSA-N 0 0 377.260 3.166 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CNc2nc3ccccc3[nH]2)c1 ZINC000575633247 566279035 /nfs/dbraw/zinc/27/90/35/566279035.db2.gz BCDZZSRYXYFHJY-UHFFFAOYSA-N 0 0 394.172 3.110 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCCC(C)(C)O)cc2[N+](=O)[O-])n1 ZINC000482044008 566279236 /nfs/dbraw/zinc/27/92/36/566279236.db2.gz ZPKYBYGQUNEHMT-UHFFFAOYSA-N 0 0 381.479 3.402 20 5 GGBDRN C[C@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H](C(F)(F)F)O1 ZINC000599616460 566280354 /nfs/dbraw/zinc/28/03/54/566280354.db2.gz CJFVUURHLOEHMO-OIBJUYFYSA-N 0 0 397.147 3.149 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3csc(I)c3)no2)[nH]1 ZINC000445300487 566281023 /nfs/dbraw/zinc/28/10/23/566281023.db2.gz LHPMSXCSJMZWOR-UHFFFAOYSA-N 0 0 388.146 3.306 20 5 GGBDRN CCn1[nH]c(=NC(=O)c2c(Br)cccc2[N+](=O)[O-])cc1C1CC1 ZINC000599637738 566281664 /nfs/dbraw/zinc/28/16/64/566281664.db2.gz WCRFUDGRNVYWQE-UHFFFAOYSA-N 0 0 379.214 3.125 20 5 GGBDRN O=C1C[C@H]2C[C@@H]1[C@H](c1nc(Cc3ccc([N+](=O)[O-])cc3Br)no1)C2 ZINC000420487438 566282620 /nfs/dbraw/zinc/28/26/20/566282620.db2.gz LHMKZLGGZZIZGH-XXILOJSOSA-N 0 0 392.209 3.414 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCO[C@H](c2ccco2)C1 ZINC000599651310 566282774 /nfs/dbraw/zinc/28/27/74/566282774.db2.gz FZYZNRQRDAYAPH-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN O=C1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)CN1C1CCCCC1 ZINC000482080540 566283646 /nfs/dbraw/zinc/28/36/46/566283646.db2.gz KREQEYTVNJZZRQ-SNVBAGLBSA-N 0 0 383.246 3.098 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000599661919 566285140 /nfs/dbraw/zinc/28/51/40/566285140.db2.gz HAPVVQCFHCHNHS-BXUZGUMPSA-N 0 0 393.241 3.277 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3ccccc3I)no2)[nH]1 ZINC000445384960 566286373 /nfs/dbraw/zinc/28/63/73/566286373.db2.gz OHIVBKGTRAZWQR-UHFFFAOYSA-N 0 0 382.117 3.245 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1c(Br)cccc1[N+](=O)[O-] ZINC000599715077 566289523 /nfs/dbraw/zinc/28/95/23/566289523.db2.gz VZMSODJDRUOEDS-VQISRLSMSA-N 0 0 395.253 3.435 20 5 GGBDRN Cc1nn(C)c(-c2nc(-c3ccc(Br)cc3F)no2)c1[N+](=O)[O-] ZINC000445446015 566289884 /nfs/dbraw/zinc/28/98/84/566289884.db2.gz KQWAXZZZPPCLKM-UHFFFAOYSA-N 0 0 382.149 3.255 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1c(Br)cccc1[N+](=O)[O-] ZINC000599709662 566289993 /nfs/dbraw/zinc/28/99/93/566289993.db2.gz XBYVMYDPJYZLGJ-OWYVNGRQSA-N 0 0 381.226 3.045 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1c(Br)cccc1[N+](=O)[O-] ZINC000599715075 566290171 /nfs/dbraw/zinc/29/01/71/566290171.db2.gz VZMSODJDRUOEDS-VCTAVGKDSA-N 0 0 395.253 3.435 20 5 GGBDRN Cc1noc(C)c1[C@H](C)CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599717148 566290223 /nfs/dbraw/zinc/29/02/23/566290223.db2.gz HJRHZTAIMNHQKL-MRVPVSSYSA-N 0 0 382.214 3.496 20 5 GGBDRN C[C@@H]1C[C@H](CO)CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C1 ZINC000420636644 566291274 /nfs/dbraw/zinc/29/12/74/566291274.db2.gz VLHLMWYRNKANQZ-MNOVXSKESA-N 0 0 380.242 3.360 20 5 GGBDRN C[C@H](CCO)C1(CNC(=O)c2c(Br)cccc2[N+](=O)[O-])CCC1 ZINC000599738496 566291427 /nfs/dbraw/zinc/29/14/27/566291427.db2.gz UEDRJFHPDVLTEN-LLVKDONJSA-N 0 0 385.258 3.276 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ccsc2Br)cc1[N+](=O)[O-] ZINC000509339880 566291510 /nfs/dbraw/zinc/29/15/10/566291510.db2.gz TUFZDQKKAHPEIC-UHFFFAOYSA-N 0 0 397.297 3.267 20 5 GGBDRN CN1Cc2ccccc2[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000535277085 566292601 /nfs/dbraw/zinc/29/26/01/566292601.db2.gz NKIOYSVZSVOMTL-OAHLLOKOSA-N 0 0 390.237 3.274 20 5 GGBDRN CCc1ccc(S(=O)(=O)N(CCOC)Cc2cccs2)cc1[N+](=O)[O-] ZINC000575864676 566292707 /nfs/dbraw/zinc/29/27/07/566292707.db2.gz TUZDESZWGGSFIT-UHFFFAOYSA-N 0 0 384.479 3.056 20 5 GGBDRN Cc1nn(C)c(-c2nc(-c3ccc(Br)cc3C)no2)c1[N+](=O)[O-] ZINC000445471004 566292766 /nfs/dbraw/zinc/29/27/66/566292766.db2.gz YZPXHMYSVQDRBF-UHFFFAOYSA-N 0 0 378.186 3.425 20 5 GGBDRN CCc1ccc(-c2nc(-c3ccc([N+](=O)[O-])s3)no2)cc1S(C)(=O)=O ZINC000445469833 566292889 /nfs/dbraw/zinc/29/28/89/566292889.db2.gz HXMVAJWMULGBJD-UHFFFAOYSA-N 0 0 379.419 3.339 20 5 GGBDRN O=C(NCC1(c2ccccn2)CC1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599751518 566292862 /nfs/dbraw/zinc/29/28/62/566292862.db2.gz PUTQCAMZVCNACJ-UHFFFAOYSA-N 0 0 376.210 3.214 20 5 GGBDRN Cc1sc2ncc(-c3nc(-c4ccc([N+](=O)[O-])s4)no3)c(=O)n2c1C ZINC000445477064 566293189 /nfs/dbraw/zinc/29/31/89/566293189.db2.gz AMNAYELPEQDZFL-UHFFFAOYSA-N 0 0 375.391 3.060 20 5 GGBDRN O=C(CN1CCc2c1cccc2[N+](=O)[O-])Nc1ccc(Br)cc1F ZINC000535292724 566293774 /nfs/dbraw/zinc/29/37/74/566293774.db2.gz HJEXUWVAJAYFDA-UHFFFAOYSA-N 0 0 394.200 3.498 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCOc1ccc(F)cc1 ZINC000445516281 566295153 /nfs/dbraw/zinc/29/51/53/566295153.db2.gz WZSOPFDWGDZKHP-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCOCC2(CCCC2)C1 ZINC000599779803 566295486 /nfs/dbraw/zinc/29/54/86/566295486.db2.gz KYGIZDPQRIQKGL-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC[C@H](OCC2CC2)C1 ZINC000599783599 566295490 /nfs/dbraw/zinc/29/54/90/566295490.db2.gz DSGHNUUSWUXIFH-LBPRGKRZSA-N 0 0 383.242 3.389 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(OC(F)F)cc2F)c([N+](=O)[O-])c1 ZINC000509376237 566295698 /nfs/dbraw/zinc/29/56/98/566295698.db2.gz OKDHCPDQPXNRQK-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000462399131 566295864 /nfs/dbraw/zinc/29/58/64/566295864.db2.gz ABUVQKHXIOYBCM-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN C[C@H](Oc1ccc(Br)cc1)c1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000445576678 566297545 /nfs/dbraw/zinc/29/75/45/566297545.db2.gz YGPZBAXYJPTLPG-QMMMGPOBSA-N 0 0 394.185 3.281 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1C)c1ccc(Cl)cc1 ZINC000462411961 566297863 /nfs/dbraw/zinc/29/78/63/566297863.db2.gz FZPYZWLJDLUKPV-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)Nc1ccc(OC(F)F)cc1F ZINC000509390368 566297898 /nfs/dbraw/zinc/29/78/98/566297898.db2.gz HTIKMJOLDHORIU-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(C2(c3cccc(Br)c3)CC2)n1 ZINC000445575129 566297815 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Cn1cnc([N+](=O)[O-])c1-c1noc(/C=C\c2ccc(Br)s2)n1 ZINC000445577112 566298640 /nfs/dbraw/zinc/29/86/40/566298640.db2.gz NGSSEZJDOANEGW-HYXAFXHYSA-N 0 0 382.199 3.373 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3ccc(C)cc3Br)n2)n1C ZINC000445607022 566299263 /nfs/dbraw/zinc/29/92/63/566299263.db2.gz HQXGSFGALWHCDH-UHFFFAOYSA-N 0 0 378.186 3.425 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(CCc3cc(Br)cs3)n2)n1C ZINC000445599060 566299610 /nfs/dbraw/zinc/29/96/10/566299610.db2.gz BVUNYNREALKKFX-UHFFFAOYSA-N 0 0 398.242 3.296 20 5 GGBDRN CC[C@H](C)c1nnc([C@@H](C)NC(=O)c2c(Br)cccc2[N+](=O)[O-])[nH]1 ZINC000599828197 566299913 /nfs/dbraw/zinc/29/99/13/566299913.db2.gz OWPHDIPHGJDECB-DTWKUNHWSA-N 0 0 396.245 3.480 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3ccc(Br)c(C)c3)n2)n1C ZINC000445623571 566300841 /nfs/dbraw/zinc/30/08/41/566300841.db2.gz KRRXTIRFHFCICS-UHFFFAOYSA-N 0 0 378.186 3.425 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3ccc(Br)c(F)c3)n2)n1C ZINC000445625364 566301006 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GGBDRN CO[C@]1(C)C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1(C)C ZINC000446106886 566330010 /nfs/dbraw/zinc/33/00/10/566330010.db2.gz DVINQDSTJANJHJ-XJKSGUPXSA-N 0 0 385.258 3.220 20 5 GGBDRN CCN(Cc1ccncc1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000446125211 566330122 /nfs/dbraw/zinc/33/01/22/566330122.db2.gz FYAZJBQKSXCJRC-UHFFFAOYSA-N 0 0 378.226 3.344 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)Cc1ccc(F)cc1Br ZINC000482756521 566330318 /nfs/dbraw/zinc/33/03/18/566330318.db2.gz FXWYUEQRYGBFFH-UHFFFAOYSA-N 0 0 399.220 3.050 20 5 GGBDRN Cc1c(Br)cc(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(=O)n1C ZINC000576263558 566330576 /nfs/dbraw/zinc/33/05/76/566330576.db2.gz MVHLRSWHCNENEE-UHFFFAOYSA-N 0 0 391.181 3.081 20 5 GGBDRN COc1ccc(S(=O)(=O)NC[C@H](C)Sc2ccccc2)cc1[N+](=O)[O-] ZINC000462592796 566330843 /nfs/dbraw/zinc/33/08/43/566330843.db2.gz LFXDEMLCYXMPOS-LBPRGKRZSA-N 0 0 382.463 3.063 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cn2cc(Br)ccc2n1 ZINC000446106402 566331036 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Cc1ccc([N+](=O)[O-])c(OC[C@@H](O)COc2cccc(Br)c2)c1 ZINC000535912444 566338999 /nfs/dbraw/zinc/33/89/99/566338999.db2.gz AGHDKSOJDKQBKU-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc([S@](C)=O)cc1 ZINC000535955702 566339600 /nfs/dbraw/zinc/33/96/00/566339600.db2.gz VVBRZKGSEPFPMR-VDBVYFBLSA-N 0 0 378.475 3.302 20 5 GGBDRN Cn1c(C(=O)Nc2cnn(-c3ccccc3Br)c2)ccc1[N+](=O)[O-] ZINC000535929256 566340235 /nfs/dbraw/zinc/34/02/35/566340235.db2.gz KCTJJCXYEZFEJU-UHFFFAOYSA-N 0 0 390.197 3.134 20 5 GGBDRN CCO[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C12CCCC2 ZINC000462673393 566340317 /nfs/dbraw/zinc/34/03/17/566340317.db2.gz FQSJCHOBIUPUEM-HUUCEWRRSA-N 0 0 388.873 3.264 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(Cl)c1 ZINC000462683042 566340561 /nfs/dbraw/zinc/34/05/61/566340561.db2.gz SRGRFYLMOROMJH-CQSZACIVSA-N 0 0 388.804 3.053 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C)c1cccc(Cl)c1 ZINC000462686037 566341756 /nfs/dbraw/zinc/34/17/56/566341756.db2.gz XNYPDDYRMOGIGD-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN Cc1cc(C(=O)N2CC(=O)Nc3ccc(Br)cc32)cc([N+](=O)[O-])c1 ZINC000535963922 566341987 /nfs/dbraw/zinc/34/19/87/566341987.db2.gz OSODWLCEMCBLHL-UHFFFAOYSA-N 0 0 390.193 3.265 20 5 GGBDRN Cc1cccc(O[C@@H](C)CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000462698391 566343097 /nfs/dbraw/zinc/34/30/97/566343097.db2.gz FJWNBXUSAJRIBT-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H](C)Oc2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000462702284 566343403 /nfs/dbraw/zinc/34/34/03/566343403.db2.gz JKJMXOKSYUDTKI-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H](C)Oc1cccc(Cl)c1 ZINC000462705566 566344016 /nfs/dbraw/zinc/34/40/16/566344016.db2.gz OMYDXEMDLFRGRJ-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)Oc1ccc(F)cc1 ZINC000462708845 566344254 /nfs/dbraw/zinc/34/42/54/566344254.db2.gz IEZQDJDKGKTBPP-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN CC(C)C1CCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000462704780 566344801 /nfs/dbraw/zinc/34/48/01/566344801.db2.gz UHCMENNMRZBCQE-UHFFFAOYSA-N 0 0 391.287 3.414 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCN(Cc2ccsc2)CC1 ZINC000536020662 566344893 /nfs/dbraw/zinc/34/48/93/566344893.db2.gz NHYCEUROEHVHNN-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN CC1CCC(N(C[C@@H]2CCCO2)S(=O)(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000462705040 566344837 /nfs/dbraw/zinc/34/48/37/566344837.db2.gz PZCUVYRPGCBVFJ-RUXDESIVSA-N 0 0 388.511 3.405 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H](C)Oc1cccc(Cl)c1 ZINC000462705325 566345117 /nfs/dbraw/zinc/34/51/17/566345117.db2.gz PHKWKZKSKVVLCO-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000462710471 566346542 /nfs/dbraw/zinc/34/65/42/566346542.db2.gz GPDZSVMJTZCBDF-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN Cc1cccc(O[C@@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000462714628 566346599 /nfs/dbraw/zinc/34/65/99/566346599.db2.gz IDNDJXZCJAXYDI-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H](C)Oc1ccccc1Cl ZINC000462711668 566346638 /nfs/dbraw/zinc/34/66/38/566346638.db2.gz KZVSAUMLHQFCLM-NSHDSACASA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1ccc(Br)cc1S(=O)(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000462709968 566346763 /nfs/dbraw/zinc/34/67/63/566346763.db2.gz VDWFHBDCIFHPJZ-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCc2c(Br)cccc2[C@@H]1C ZINC000509910826 566346850 /nfs/dbraw/zinc/34/68/50/566346850.db2.gz KGUNVASTCMXUDA-JTQLQIEISA-N 0 0 393.241 3.008 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)Nc1c[nH]nc1-c1nccs1 ZINC000446392113 566347569 /nfs/dbraw/zinc/34/75/69/566347569.db2.gz WLDYWQLRORJYGR-UHFFFAOYSA-N 0 0 378.801 3.417 20 5 GGBDRN Cc1ccc(O[C@@H](C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000462720556 566347784 /nfs/dbraw/zinc/34/77/84/566347784.db2.gz JXJDAAMWMYFPQY-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1nc(-c2cccs2)c[nH]1 ZINC000509934307 566348918 /nfs/dbraw/zinc/34/89/18/566348918.db2.gz JYQGKAPOHKKIFY-UHFFFAOYSA-N 0 0 378.435 3.062 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(CCO)Cc2ccc(Br)s2)c1 ZINC000482986953 566349065 /nfs/dbraw/zinc/34/90/65/566349065.db2.gz CCDBXNWNLLNGLO-UHFFFAOYSA-N 0 0 399.266 3.362 20 5 GGBDRN CC(C)(C)OC(=O)C(C)(C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000600603164 566349077 /nfs/dbraw/zinc/34/90/77/566349077.db2.gz QQSNEHHVSIMFGR-UHFFFAOYSA-N 0 0 387.230 3.207 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1ncon1 ZINC000576504788 566351356 /nfs/dbraw/zinc/35/13/56/566351356.db2.gz BOZXBEWNJRAQGR-GFCCVEGCSA-N 0 0 381.186 3.026 20 5 GGBDRN CNc1c(C(=O)NCc2ccc(O)c(Br)c2)cccc1[N+](=O)[O-] ZINC000462771300 566351474 /nfs/dbraw/zinc/35/14/74/566351474.db2.gz DJYTXVZYXASMAG-UHFFFAOYSA-N 0 0 380.198 3.035 20 5 GGBDRN CNc1c(C(=O)NCCNc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000462779740 566351664 /nfs/dbraw/zinc/35/16/64/566351664.db2.gz UJRKMIFVFNRZFB-UHFFFAOYSA-N 0 0 393.241 3.241 20 5 GGBDRN C[C@@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000576500632 566352288 /nfs/dbraw/zinc/35/22/88/566352288.db2.gz RJFAMRWLEIEWOI-SECBINFHSA-N 0 0 396.216 3.446 20 5 GGBDRN O=C(NCc1nc(CCC(F)(F)F)no1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000600673109 566357384 /nfs/dbraw/zinc/35/73/84/566357384.db2.gz XNUIOSJRLNIMJN-UHFFFAOYSA-N 0 0 378.694 3.056 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1nc2ccccc2n1C(F)F ZINC000446577000 566357714 /nfs/dbraw/zinc/35/77/14/566357714.db2.gz RURAAKZNDOWKIA-UHFFFAOYSA-N 0 0 399.151 3.312 20 5 GGBDRN CCCc1n[nH]c(C(=O)N(C)CCc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000462861362 566360687 /nfs/dbraw/zinc/36/06/87/566360687.db2.gz IUXYVFVKZUMXTR-UHFFFAOYSA-N 0 0 395.257 3.348 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1NC[C@H]1CCC[C@H](O)C1 ZINC000462864066 566360979 /nfs/dbraw/zinc/36/09/79/566360979.db2.gz TUGDLPPTUBYSDL-JQWIXIFHSA-N 0 0 380.242 3.290 20 5 GGBDRN CC[C@H](Cc1ccc(Cl)cc1)Nc1cccc([N+](=O)[O-])c1S(N)(=O)=O ZINC000576630127 566363717 /nfs/dbraw/zinc/36/37/17/566363717.db2.gz GRDRGKSBFVAHAF-CYBMUJFWSA-N 0 0 383.857 3.329 20 5 GGBDRN CCc1ccc(S(=O)(=O)N2CCSC[C@@H]2c2nccs2)cc1[N+](=O)[O-] ZINC000576633201 566364080 /nfs/dbraw/zinc/36/40/80/566364080.db2.gz DLLWQVMISDXYAG-CQSZACIVSA-N 0 0 399.519 3.093 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@H](COC(F)F)C1 ZINC000557125482 566364350 /nfs/dbraw/zinc/36/43/50/566364350.db2.gz KUULZIZPYCJGFM-QMMMGPOBSA-N 0 0 379.157 3.059 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H](COC(F)F)C1 ZINC000557125481 566364378 /nfs/dbraw/zinc/36/43/78/566364378.db2.gz KUULZIZPYCJGFM-MRVPVSSYSA-N 0 0 379.157 3.059 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC3(CCO)CC3)cc2[N+](=O)[O-])n1 ZINC000557120893 566364571 /nfs/dbraw/zinc/36/45/71/566364571.db2.gz IFDKVCUBSKKIHU-UHFFFAOYSA-N 0 0 379.463 3.156 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H](COC(F)F)C1 ZINC000557126814 566365651 /nfs/dbraw/zinc/36/56/51/566365651.db2.gz XVWVOIYHQXJAFC-ZJUUUORDSA-N 0 0 378.759 3.103 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H](COC(F)F)C1 ZINC000557126812 566365687 /nfs/dbraw/zinc/36/56/87/566365687.db2.gz XVWVOIYHQXJAFC-UWVGGRQHSA-N 0 0 378.759 3.103 20 5 GGBDRN C[C@]1(CO)CCC[C@@H]1Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000462901758 566367038 /nfs/dbraw/zinc/36/70/38/566367038.db2.gz XOZMDYDHYZLTPJ-GOEBONIOSA-N 0 0 380.242 3.290 20 5 GGBDRN C[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])Oc1cccc(Br)c1 ZINC000462923890 566368802 /nfs/dbraw/zinc/36/88/02/566368802.db2.gz FTBCEBCFGMILFO-SNVBAGLBSA-N 0 0 394.225 3.336 20 5 GGBDRN COC(=O)c1cccnc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000600828174 566369653 /nfs/dbraw/zinc/36/96/53/566369653.db2.gz NQZNVXMZTOMPRG-UHFFFAOYSA-N 0 0 381.797 3.161 20 5 GGBDRN C[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])Oc1ccc(Br)cc1 ZINC000462938538 566370483 /nfs/dbraw/zinc/37/04/83/566370483.db2.gz AAWOIOFUIUQKML-SNVBAGLBSA-N 0 0 394.225 3.336 20 5 GGBDRN CCC(CC)[C@@H](CCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])OC ZINC000446929835 566371138 /nfs/dbraw/zinc/37/11/38/566371138.db2.gz SIEBUKBLYWVERV-CQSZACIVSA-N 0 0 378.878 3.368 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(Br)cc1 ZINC000483279129 566371369 /nfs/dbraw/zinc/37/13/69/566371369.db2.gz KUJQUJWISZILEC-INIZCTEOSA-N 0 0 390.237 3.030 20 5 GGBDRN C[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000446940854 566371927 /nfs/dbraw/zinc/37/19/27/566371927.db2.gz HRKXINRKTOPGQZ-NXEZZACHSA-N 0 0 377.260 3.214 20 5 GGBDRN Cc1ccccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446939153 566371939 /nfs/dbraw/zinc/37/19/39/566371939.db2.gz ZPSPSFDULPVZNJ-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN C[C@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000510282474 566371979 /nfs/dbraw/zinc/37/19/79/566371979.db2.gz JOAXUVILUCYZMA-WPPNPWJKSA-N 0 0 397.254 3.293 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446946080 566372708 /nfs/dbraw/zinc/37/27/08/566372708.db2.gz NACTUPHAQWDHCI-SKDRFNHKSA-N 0 0 377.260 3.214 20 5 GGBDRN C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446951515 566373310 /nfs/dbraw/zinc/37/33/10/566373310.db2.gz VRJSBXWKLLGWQW-SNVBAGLBSA-N 0 0 397.250 3.497 20 5 GGBDRN C[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446946078 566373344 /nfs/dbraw/zinc/37/33/44/566373344.db2.gz NACTUPHAQWDHCI-CABZTGNLSA-N 0 0 377.260 3.214 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1cc2ccccc2s1 ZINC000557226391 566373665 /nfs/dbraw/zinc/37/36/65/566373665.db2.gz KZTXQMIMQZBYNV-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCc3ccccc32)c(Br)c1 ZINC000446961029 566374603 /nfs/dbraw/zinc/37/46/03/566374603.db2.gz TYZZVMQPQUVOQB-AWEZNQCLSA-N 0 0 397.250 3.323 20 5 GGBDRN Cc1ccccc1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446970271 566375311 /nfs/dbraw/zinc/37/53/11/566375311.db2.gz YCQIFETWIVNCRE-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CO[C@H](C)c1nc(C[S@@](=O)CCCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000600902410 566375530 /nfs/dbraw/zinc/37/55/30/566375530.db2.gz RXUKSCLSVCXZCE-YDBLSZJJSA-N 0 0 384.479 3.477 20 5 GGBDRN C[C@@H](O)[C@@H](C)Sc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000463027623 566376819 /nfs/dbraw/zinc/37/68/19/566376819.db2.gz GINXIYQRIUPEAW-CHWSQXEVSA-N 0 0 388.511 3.021 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CNc2ccc3[nH]nnc3c2)c1 ZINC000576791993 566378181 /nfs/dbraw/zinc/37/81/81/566378181.db2.gz HJYICNGGRIHNMS-UHFFFAOYSA-N 0 0 395.160 3.083 20 5 GGBDRN CC1(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CCCCC1 ZINC000447014294 566379235 /nfs/dbraw/zinc/37/92/35/566379235.db2.gz SWLIABXKPWYIFH-UHFFFAOYSA-N 0 0 377.260 3.358 20 5 GGBDRN COc1ccc(-c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)nc1 ZINC000463058941 566379449 /nfs/dbraw/zinc/37/94/49/566379449.db2.gz XBGUMWAJNWGRMJ-UHFFFAOYSA-N 0 0 391.181 3.402 20 5 GGBDRN CCC1(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CCC1 ZINC000447024435 566380046 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Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)c1ccc(Br)cc1 ZINC000538886047 566545036 /nfs/dbraw/zinc/54/50/36/566545036.db2.gz CWMNJXBGQPXSLU-OAHLLOKOSA-N 0 0 379.210 3.129 20 5 GGBDRN O=C(N[C@H](CO)c1ccc(Br)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000538888283 566545129 /nfs/dbraw/zinc/54/51/29/566545129.db2.gz BWFJCVUAEXKBOM-CYBMUJFWSA-N 0 0 399.628 3.474 20 5 GGBDRN NS(=O)(=O)c1c(N[C@@H]2CCSc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000603929985 566545758 /nfs/dbraw/zinc/54/57/58/566545758.db2.gz YCKCWJJKSPKWBP-LLVKDONJSA-N 0 0 383.426 3.030 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1cc(OC)ccc1Br ZINC000603932748 566545784 /nfs/dbraw/zinc/54/57/84/566545784.db2.gz ZSGCGDJXAKBFGS-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN COc1cc(C(=O)Nc2ncc(Br)s2)c([N+](=O)[O-])cc1OC ZINC000603925512 566546079 /nfs/dbraw/zinc/54/60/79/566546079.db2.gz YNOBOITYUFFYJT-UHFFFAOYSA-N 0 0 388.199 3.083 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCNc1ncnc2ccc(Br)cc21 ZINC000603929283 566546120 /nfs/dbraw/zinc/54/61/20/566546120.db2.gz INXFHUREMFFYEV-UHFFFAOYSA-N 0 0 388.225 3.246 20 5 GGBDRN CN(Cc1ccc(Cl)cc1Cl)c1cccc([N+](=O)[O-])c1S(N)(=O)=O ZINC000603929024 566546285 /nfs/dbraw/zinc/54/62/85/566546285.db2.gz PRXFVJUPIJJTBM-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN CSc1ccc(NC(=O)[C@@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000512634042 566546891 /nfs/dbraw/zinc/54/68/91/566546891.db2.gz QHNLASRGAAFBNM-LLVKDONJSA-N 0 0 380.447 3.118 20 5 GGBDRN CN(C(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000603962928 566547276 /nfs/dbraw/zinc/54/72/76/566547276.db2.gz MWEXVTBTWOKPOI-UHFFFAOYSA-N 0 0 379.214 3.217 20 5 GGBDRN O=C(Cn1cc(Br)c([N+](=O)[O-])n1)Nc1ccc(Cl)cc1Cl ZINC000603948424 566547364 /nfs/dbraw/zinc/54/73/64/566547364.db2.gz YUBKIGUFVWXTEM-UHFFFAOYSA-N 0 0 394.012 3.499 20 5 GGBDRN CN(CCOc1cccc(Cl)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000603956033 566547710 /nfs/dbraw/zinc/54/77/10/566547710.db2.gz WPHJTIUZSWVLIX-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN Cc1nn(C)c(N[C@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000486008182 566548381 /nfs/dbraw/zinc/54/83/81/566548381.db2.gz PHOKOIIALVIOEH-LBPRGKRZSA-N 0 0 380.246 3.090 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2cc(Br)ccc2F)n1 ZINC000578726928 566548541 /nfs/dbraw/zinc/54/85/41/566548541.db2.gz HKCCFMBMISCFIQ-UHFFFAOYSA-N 0 0 384.161 3.290 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H](Oc3ncccc3F)C2)c(Br)c1 ZINC000486016429 566548740 /nfs/dbraw/zinc/54/87/40/566548740.db2.gz LFMYHBYEQIWILC-LLVKDONJSA-N 0 0 397.204 3.334 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc(F)cc2Br)cc1[N+](=O)[O-] ZINC000604018376 566549944 /nfs/dbraw/zinc/54/99/44/566549944.db2.gz ALYPHECHFKBVMJ-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN CN(CCc1cnccn1)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000538925784 566550015 /nfs/dbraw/zinc/55/00/15/566550015.db2.gz BYBYAQGXIMUDIL-UHFFFAOYSA-N 0 0 388.225 3.374 20 5 GGBDRN COc1ccc(Br)c(C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000604017703 566550195 /nfs/dbraw/zinc/55/01/95/566550195.db2.gz VYHLBGCYAGGGAL-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cc(F)c(F)cc1Br ZINC000538940155 566550239 /nfs/dbraw/zinc/55/02/39/566550239.db2.gz HWODAXBRDPMOIM-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN Cn1c2cc(Br)ccc2nc1Cn1cc([N+](=O)[O-])cc(Cl)c1=O ZINC000486025464 566550599 /nfs/dbraw/zinc/55/05/99/566550599.db2.gz BVSZGPKQDZCNOX-UHFFFAOYSA-N 0 0 397.616 3.107 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cccc(C(F)(F)F)c2)c(F)c1 ZINC000604016973 566550680 /nfs/dbraw/zinc/55/06/80/566550680.db2.gz PDGYHDHJJYBUOK-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN CN(CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(Br)c1 ZINC000604016372 566550922 /nfs/dbraw/zinc/55/09/22/566550922.db2.gz WRDFNBVLVVRBRV-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN COc1ccc(COCCNc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000538978199 566551043 /nfs/dbraw/zinc/55/10/43/566551043.db2.gz OAKIMANNNKEFBR-UHFFFAOYSA-N 0 0 382.214 3.390 20 5 GGBDRN C[C@H](Cc1ccc(Br)cc1)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000604034089 566552394 /nfs/dbraw/zinc/55/23/94/566552394.db2.gz 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NC(=O)c1cccc(NCc2cc(F)c(F)cc2Br)c1[N+](=O)[O-] ZINC000578801719 566555241 /nfs/dbraw/zinc/55/52/41/566555241.db2.gz SBIUPPJIFVQZFE-UHFFFAOYSA-N 0 0 386.152 3.347 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000578837500 566556945 /nfs/dbraw/zinc/55/69/45/566556945.db2.gz TXXGQKJBHJUAOX-JOYOIKCWSA-N 0 0 388.232 3.131 20 5 GGBDRN COC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C)c1ccco1 ZINC000559549047 566557985 /nfs/dbraw/zinc/55/79/85/566557985.db2.gz RPBRLSLSCUNVEO-ZDUSSCGKSA-N 0 0 383.198 3.376 20 5 GGBDRN COc1cc(CNCc2nc(C)c(Br)s2)c([N+](=O)[O-])cc1O ZINC000449402792 566558168 /nfs/dbraw/zinc/55/81/68/566558168.db2.gz SORLTVPXXDLZNF-UHFFFAOYSA-N 0 0 388.243 3.126 20 5 GGBDRN Cc1cnccc1CCNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000559580676 566559399 /nfs/dbraw/zinc/55/93/99/566559399.db2.gz HGYMCFQGOJDYRA-UHFFFAOYSA-N 0 0 378.226 3.342 20 5 GGBDRN COc1ccc(Cl)c(S(=O)(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)c1 ZINC000539117302 566561924 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/nfs/dbraw/zinc/57/63/36/566576336.db2.gz RYYVQEOINSEHEJ-UHFFFAOYSA-N 0 0 396.197 3.043 20 5 GGBDRN Cc1ccccc1C[C@H](CO)Nc1ncc([N+](=O)[O-])c(C)c1Br ZINC000466440220 566576819 /nfs/dbraw/zinc/57/68/19/566576819.db2.gz DVSSSCSPGVYKAW-CYBMUJFWSA-N 0 0 380.242 3.385 20 5 GGBDRN CC1(C)CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[S@]1=O ZINC000449573981 566577365 /nfs/dbraw/zinc/57/73/65/566577365.db2.gz UZKSVNXNFYJMIY-RUZDIDTESA-N 0 0 379.507 3.451 20 5 GGBDRN COc1ccc(Cl)c(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000466511366 566581257 /nfs/dbraw/zinc/58/12/57/566581257.db2.gz ALCIGNLNQGNOBN-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Cc1cc[nH]c(=O)c1Br ZINC000466511915 566581624 /nfs/dbraw/zinc/58/16/24/566581624.db2.gz BXQXFJKIANFQRF-UHFFFAOYSA-N 0 0 396.197 3.038 20 5 GGBDRN Cn1c2ccc(Nc3ccc([N+](=O)[O-])cc3Br)cc2n(C)c1=O ZINC000486379634 566583211 /nfs/dbraw/zinc/58/32/11/566583211.db2.gz ULNWFIGONHJUTM-UHFFFAOYSA-N 0 0 377.198 3.291 20 5 GGBDRN CCN(Cc1ccccc1)S(=O)(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000466540979 566583158 /nfs/dbraw/zinc/58/31/58/566583158.db2.gz IGOGQJRKRFOBPB-UHFFFAOYSA-N 0 0 383.857 3.105 20 5 GGBDRN CCSCC[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc[nH]n1 ZINC000539488291 566583406 /nfs/dbraw/zinc/58/34/06/566583406.db2.gz BPPSGJBLJFXBJR-SNVBAGLBSA-N 0 0 381.483 3.126 20 5 GGBDRN C[C@H](COCC(F)(F)F)NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000486389449 566584365 /nfs/dbraw/zinc/58/43/65/566584365.db2.gz SCYWYJUMXSVMNA-SECBINFHSA-N 0 0 383.754 3.057 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N2CCc3cc(Cl)ccc32)c([N+](=O)[O-])c1 ZINC000579153242 566584565 /nfs/dbraw/zinc/58/45/65/566584565.db2.gz LCFMSTUSVKRABR-UHFFFAOYSA-N 0 0 381.841 3.193 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1N(C)C ZINC000466547439 566584933 /nfs/dbraw/zinc/58/49/33/566584933.db2.gz CVMZLHMFAIKEOK-UHFFFAOYSA-N 0 0 383.857 3.101 20 5 GGBDRN C[C@H]1CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Br)CCC1(F)F ZINC000579166275 566585502 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20 5 GGBDRN O=C(CNc1ccc(Br)cc1F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000486514589 566594471 /nfs/dbraw/zinc/59/44/71/566594471.db2.gz FENLHLGVUHGLRA-UHFFFAOYSA-N 0 0 394.200 3.498 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1CC[C@@](O)(C2CC2)C1 ZINC000486507589 566594904 /nfs/dbraw/zinc/59/49/04/566594904.db2.gz LASUSZSPQMLWBZ-INIZCTEOSA-N 0 0 378.226 3.257 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1Br ZINC000579280609 566595073 /nfs/dbraw/zinc/59/50/73/566595073.db2.gz HMLSEBGGJRIFOG-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN C[S@@](=O)Cc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000513325519 566595579 /nfs/dbraw/zinc/59/55/79/566595579.db2.gz RKKKJCPABDUYHE-RUZDIDTESA-N 0 0 381.841 3.448 20 5 GGBDRN C[C@]1(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])CCO[C@H]1C1CC1 ZINC000466852312 566602287 /nfs/dbraw/zinc/60/22/87/566602287.db2.gz NSBWTPUUZNBMFH-GOEBONIOSA-N 0 0 383.242 3.292 20 5 GGBDRN COC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)nc1 ZINC000560150485 566602839 /nfs/dbraw/zinc/60/28/39/566602839.db2.gz KSELLTWYADQOMP-UHFFFAOYSA-N 0 0 394.181 3.100 20 5 GGBDRN CC1CCC(N(C)C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000560166801 566604448 /nfs/dbraw/zinc/60/44/48/566604448.db2.gz IRGVQNUBAJTSCP-UHFFFAOYSA-N 0 0 398.257 3.333 20 5 GGBDRN C[C@@H]1CCCC[C@H]1CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560177198 566606283 /nfs/dbraw/zinc/60/62/83/566606283.db2.gz URPROGDHKCWNSB-MNOVXSKESA-N 0 0 398.257 3.238 20 5 GGBDRN CCC[C@@H]1CCCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560183307 566606751 /nfs/dbraw/zinc/60/67/51/566606751.db2.gz HHIOCPFWIGWEJX-CYBMUJFWSA-N 0 0 398.257 3.477 20 5 GGBDRN COCCN([C@@H]1CCC[C@H]1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000486637580 566606848 /nfs/dbraw/zinc/60/68/48/566606848.db2.gz PQESXBHKILIAHD-BXUZGUMPSA-N 0 0 376.862 3.074 20 5 GGBDRN COCCN([C@H]1CCC[C@@H]1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000486637582 566606949 /nfs/dbraw/zinc/60/69/49/566606949.db2.gz PQESXBHKILIAHD-FZMZJTMJSA-N 0 0 376.862 3.074 20 5 GGBDRN CC(C)C(C)(C)CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560226141 566607844 /nfs/dbraw/zinc/60/78/44/566607844.db2.gz ZKKONONWHKHMPI-UHFFFAOYSA-N 0 0 386.246 3.094 20 5 GGBDRN C[C@@H]1CC(NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000560226011 566608198 /nfs/dbraw/zinc/60/81/98/566608198.db2.gz VTSYSVBDJRCRLG-UWVGGRQHSA-N 0 0 398.257 3.237 20 5 GGBDRN C[C@H]1CCCCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560223981 566608416 /nfs/dbraw/zinc/60/84/16/566608416.db2.gz LLHGWWVBLLXWGE-JTQLQIEISA-N 0 0 384.230 3.087 20 5 GGBDRN CC[C@@H]1C[C@@H](C)CN1S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000466929612 566608888 /nfs/dbraw/zinc/60/88/88/566608888.db2.gz SBZZVHIGIPTXFM-MWLCHTKSSA-N 0 0 391.287 3.475 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cc(Cl)ccc2OC(F)F)cc1 ZINC000466927195 566609168 /nfs/dbraw/zinc/60/91/68/566609168.db2.gz XRHSHKXEHZBLMN-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2[C@@H]3c4ccccc4C[C@H]23)c(Cl)c1 ZINC000486669782 566611204 /nfs/dbraw/zinc/61/12/04/566611204.db2.gz GPXNBQLVDDTGKO-CKEIUWERSA-N 0 0 378.837 3.112 20 5 GGBDRN Cc1ccc(CNc2ccc(I)c(C)n2)cc1[N+](=O)[O-] ZINC000466970079 566611709 /nfs/dbraw/zinc/61/17/09/566611709.db2.gz AYOGLRIDZNFVRI-UHFFFAOYSA-N 0 0 383.189 3.245 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000486687724 566612019 /nfs/dbraw/zinc/61/20/19/566612019.db2.gz DQGANDNXFOOCBT-CKEIUWERSA-N 0 0 378.837 3.112 20 5 GGBDRN Cc1cc(I)cnc1NCc1ccc([N+](=O)[O-])cc1F ZINC000466968547 566611999 /nfs/dbraw/zinc/61/19/99/566611999.db2.gz ZFEOSYNEQKVXRK-UHFFFAOYSA-N 0 0 387.152 3.076 20 5 GGBDRN Cc1sc(S(=O)(=O)Nc2cc3c(cc2Cl)OCCO3)cc1[N+](=O)[O-] ZINC000466965017 566612179 /nfs/dbraw/zinc/61/21/79/566612179.db2.gz OBGLNANBCOEMBM-UHFFFAOYSA-N 0 0 390.826 3.190 20 5 GGBDRN CCOc1ccc(F)c(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1F ZINC000466971902 566612373 /nfs/dbraw/zinc/61/23/73/566612373.db2.gz AUEAPJROGKWCNA-UHFFFAOYSA-N 0 0 378.378 3.442 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)CCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000486703824 566615325 /nfs/dbraw/zinc/61/53/25/566615325.db2.gz ARHKCQBKKFVBJC-UHFFFAOYSA-N 0 0 384.841 3.120 20 5 GGBDRN Cc1sc(S(=O)(=O)N2c3ccccc3N(C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000467014886 566616273 /nfs/dbraw/zinc/61/62/73/566616273.db2.gz FNLJNUOIQKPYCH-LLVKDONJSA-N 0 0 381.479 3.388 20 5 GGBDRN Cc1cnc([C@@H](C)S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000539957457 566617198 /nfs/dbraw/zinc/61/71/98/566617198.db2.gz VITNZAKSBBAEHX-MRVPVSSYSA-N 0 0 375.200 3.189 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000467044472 566619449 /nfs/dbraw/zinc/61/94/49/566619449.db2.gz JDQNPRUYODGYEN-ZDUSSCGKSA-N 0 0 384.454 3.357 20 5 GGBDRN Cc1ccccc1[C@@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000539983083 566620010 /nfs/dbraw/zinc/62/00/10/566620010.db2.gz HLQMGMHMLWSPFS-MRXNPFEDSA-N 0 0 393.237 3.058 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000467044471 566620065 /nfs/dbraw/zinc/62/00/65/566620065.db2.gz JDQNPRUYODGYEN-CYBMUJFWSA-N 0 0 384.454 3.357 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1 ZINC000467053878 566620897 /nfs/dbraw/zinc/62/08/97/566620897.db2.gz NJXMCKGAGUDMJC-GFCCVEGCSA-N 0 0 382.463 3.152 20 5 GGBDRN COc1cccc(C(C)(C)CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000467047719 566621617 /nfs/dbraw/zinc/62/16/17/566621617.db2.gz QTIPCJXWRGPWRG-UHFFFAOYSA-N 0 0 384.479 3.229 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@@H]2SCCc3ccccc32)cc1[N+](=O)[O-] ZINC000467065193 566622055 /nfs/dbraw/zinc/62/20/55/566622055.db2.gz YAMNMBFTCQVKFI-AWEZNQCLSA-N 0 0 384.504 3.274 20 5 GGBDRN COc1cccc(C2=CCN(S(=O)(=O)c3cc([N+](=O)[O-])c(C)s3)C2)c1 ZINC000467069551 566622090 /nfs/dbraw/zinc/62/20/90/566622090.db2.gz LOYGMPLEEZXQIE-UHFFFAOYSA-N 0 0 380.447 3.061 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H]2SCCc3ccccc32)cc1[N+](=O)[O-] ZINC000467065194 566622589 /nfs/dbraw/zinc/62/25/89/566622589.db2.gz YAMNMBFTCQVKFI-CQSZACIVSA-N 0 0 384.504 3.274 20 5 GGBDRN Cc1ccc(S(=O)(=O)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000513780227 566623092 /nfs/dbraw/zinc/62/30/92/566623092.db2.gz SFVBRPWSDHFPHX-LLVKDONJSA-N 0 0 382.825 3.358 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC[C@@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000467069731 566623201 /nfs/dbraw/zinc/62/32/01/566623201.db2.gz RWBAEISAGOKEHP-CQSZACIVSA-N 0 0 384.454 3.500 20 5 GGBDRN Cc1cccc(Br)c1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000486800966 566623388 /nfs/dbraw/zinc/62/33/88/566623388.db2.gz LOZZKZARNFSXGP-UHFFFAOYSA-N 0 0 375.182 3.216 20 5 GGBDRN C[C@@H]1Cc2cc(S(=O)(=O)N(C)c3cccc([N+](=O)[O-])c3)cc(Cl)c2O1 ZINC000513814064 566627977 /nfs/dbraw/zinc/62/79/77/566627977.db2.gz QTGUGJSAFZDWIC-SNVBAGLBSA-N 0 0 382.825 3.397 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000486845158 566628336 /nfs/dbraw/zinc/62/83/36/566628336.db2.gz MHXLDEJBUZNQKI-QMMMGPOBSA-N 0 0 395.384 3.418 20 5 GGBDRN COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000540102681 566629714 /nfs/dbraw/zinc/62/97/14/566629714.db2.gz CSGQKKPIPAYZBT-MLGOLLRUSA-N 0 0 399.241 3.209 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000486848625 566629983 /nfs/dbraw/zinc/62/99/83/566629983.db2.gz XQDYBUGRNUKCNT-ZETCQYMHSA-N 0 0 381.357 3.110 20 5 GGBDRN CO[C@@H](C)c1nc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000467216110 566635285 /nfs/dbraw/zinc/63/52/85/566635285.db2.gz ITMAZHRRJNJHOE-VIFPVBQESA-N 0 0 384.845 3.412 20 5 GGBDRN COCCCOCCN(C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000540206684 566635826 /nfs/dbraw/zinc/63/58/26/566635826.db2.gz XSDVCOIWOBIDHH-UHFFFAOYSA-N 0 0 398.257 3.395 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCN(Cc2ccco2)CC1 ZINC000425387303 566637076 /nfs/dbraw/zinc/63/70/76/566637076.db2.gz UMGUKSZMASKOOH-UHFFFAOYSA-N 0 0 380.242 3.268 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCN(c2cccc(O)c2)CC1 ZINC000425387349 566637124 /nfs/dbraw/zinc/63/71/24/566637124.db2.gz URCWCBQRZAMLEH-UHFFFAOYSA-N 0 0 392.253 3.385 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC[C@H]1[C@H](O)C(F)(F)F ZINC000425399395 566637267 /nfs/dbraw/zinc/63/72/67/566637267.db2.gz DRFXBACUNZYKCA-JQWIXIFHSA-N 0 0 383.164 3.245 20 5 GGBDRN COc1ccccc1CN(CCO)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425397528 566637992 /nfs/dbraw/zinc/63/79/92/566637992.db2.gz RVWGDGSXNJNPHL-UHFFFAOYSA-N 0 0 395.253 3.360 20 5 GGBDRN O=C(NCc1nc2cc(Br)ccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000560568148 566639023 /nfs/dbraw/zinc/63/90/23/566639023.db2.gz RGSMGIMITDXYGS-UHFFFAOYSA-N 0 0 376.166 3.429 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000560576684 566639479 /nfs/dbraw/zinc/63/94/79/566639479.db2.gz SLWSLUBTRHNRCB-JTQLQIEISA-N 0 0 385.207 3.308 20 5 GGBDRN Cc1noc([C@@H]2CCCN(Cc3ccc(Br)cc3[N+](=O)[O-])C2)n1 ZINC000425401134 566639643 /nfs/dbraw/zinc/63/96/43/566639643.db2.gz DTIIMVLRDMISAA-GFCCVEGCSA-N 0 0 381.230 3.428 20 5 GGBDRN O=C(NCC1CC1)[C@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425411229 566640189 /nfs/dbraw/zinc/64/01/89/566640189.db2.gz YEEHKXYMEIHYCQ-AWEZNQCLSA-N 0 0 396.285 3.096 20 5 GGBDRN CC(C)N(C)C(=O)C1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425407805 566640271 /nfs/dbraw/zinc/64/02/71/566640271.db2.gz QJWSTDGGALRNKB-UHFFFAOYSA-N 0 0 398.301 3.436 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCCN(CC(F)(F)F)CC1 ZINC000425405655 566640393 /nfs/dbraw/zinc/64/03/93/566640393.db2.gz LQEKFARKMKFVHB-UHFFFAOYSA-N 0 0 396.207 3.427 20 5 GGBDRN CC(C)C(=O)NC1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425401201 566640461 /nfs/dbraw/zinc/64/04/61/566640461.db2.gz DYHZYAPJFASCLA-UHFFFAOYSA-N 0 0 384.274 3.094 20 5 GGBDRN O=C1CCCCN1C1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425415970 566641126 /nfs/dbraw/zinc/64/11/26/566641126.db2.gz FWWPFZLLNCMROC-UHFFFAOYSA-N 0 0 396.285 3.334 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCN(Cc2ccncc2)CC1 ZINC000425415382 566641201 /nfs/dbraw/zinc/64/12/01/566641201.db2.gz FIOFBIZFCVNXMI-UHFFFAOYSA-N 0 0 391.269 3.070 20 5 GGBDRN CC(=O)N[C@@H](C)C1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425429686 566641650 /nfs/dbraw/zinc/64/16/50/566641650.db2.gz AMALNDUOJCKUME-NSHDSACASA-N 0 0 384.274 3.094 20 5 GGBDRN CCC[C@@H]1CN(Cc2cc(I)cc([N+](=O)[O-])c2)CCO1 ZINC000579818320 566642151 /nfs/dbraw/zinc/64/21/51/566642151.db2.gz FLXPHCVWHLFRTG-CQSZACIVSA-N 0 0 390.221 3.200 20 5 GGBDRN Cc1cc(Br)cc(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000487013802 566643427 /nfs/dbraw/zinc/64/34/27/566643427.db2.gz SVBLWNMZPWYOGB-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN CCc1cccc2c1OCC[C@H]2NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467401622 566643666 /nfs/dbraw/zinc/64/36/66/566643666.db2.gz COEPJKFVHMWHFL-CYBMUJFWSA-N 0 0 382.463 3.329 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN(CCCO)Cc1ccccn1 ZINC000425438182 566643819 /nfs/dbraw/zinc/64/38/19/566643819.db2.gz ACXRVSDAJZKROL-UHFFFAOYSA-N 0 0 380.242 3.137 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000467400417 566643895 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ZINC000540986583 566685297 /nfs/dbraw/zinc/68/52/97/566685297.db2.gz VRRXKQQCNPWODH-MRXNPFEDSA-N 0 0 382.438 3.479 20 5 GGBDRN CN(CCc1ccc(Br)cc1)c1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000561210241 566685676 /nfs/dbraw/zinc/68/56/76/566685676.db2.gz YMDFMLAATOSDSK-UHFFFAOYSA-N 0 0 378.226 3.135 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OCC2CC(F)(F)C2)c([N+](=O)[O-])c1 ZINC000450581650 566687073 /nfs/dbraw/zinc/68/70/73/566687073.db2.gz PEDFHZNYFHJQML-UHFFFAOYSA-N 0 0 378.397 3.049 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCSCC1 ZINC000487675237 566687237 /nfs/dbraw/zinc/68/72/37/566687237.db2.gz QSDJJQXTVFOSLZ-UHFFFAOYSA-N 0 0 383.539 3.122 20 5 GGBDRN Nc1c(C(=O)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000561228320 566687277 /nfs/dbraw/zinc/68/72/77/566687277.db2.gz OWVRZHPCRNXLHZ-CYBMUJFWSA-N 0 0 384.219 3.337 20 5 GGBDRN C[C@@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)c1ccc(Br)s1 ZINC000468173152 566687806 /nfs/dbraw/zinc/68/78/06/566687806.db2.gz GNPRUIIZKTXPAQ-MRVPVSSYSA-N 0 0 387.259 3.228 20 5 GGBDRN Nc1c(C(=O)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000561228321 566688054 /nfs/dbraw/zinc/68/80/54/566688054.db2.gz OWVRZHPCRNXLHZ-ZDUSSCGKSA-N 0 0 384.219 3.337 20 5 GGBDRN CCC(=O)c1ccc(NCCn2cc(Br)ccc2=O)c([N+](=O)[O-])c1 ZINC000450597279 566689894 /nfs/dbraw/zinc/68/98/94/566689894.db2.gz NELWFRDVNUYDGL-UHFFFAOYSA-N 0 0 394.225 3.224 20 5 GGBDRN CCOc1cc(NCCn2cc(Br)ccc2=O)ccc1[N+](=O)[O-] ZINC000450603459 566689941 /nfs/dbraw/zinc/68/99/41/566689941.db2.gz YNRHXNRRHFVRBJ-UHFFFAOYSA-N 0 0 382.214 3.030 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCOc2ccc(Br)cc21 ZINC000468216535 566690186 /nfs/dbraw/zinc/69/01/86/566690186.db2.gz SDXHJSFGARQTEG-UHFFFAOYSA-N 0 0 393.193 3.162 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCOc2ccc(Br)cc21 ZINC000468216287 566690197 /nfs/dbraw/zinc/69/01/97/566690197.db2.gz RRYLMCKWYNIDQB-UHFFFAOYSA-N 0 0 393.193 3.162 20 5 GGBDRN CC[C@]1(C)CCN(C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000468227859 566691350 /nfs/dbraw/zinc/69/13/50/566691350.db2.gz DQTYJMNJNRGECW-CQSZACIVSA-N 0 0 388.205 3.462 20 5 GGBDRN CCOC(=O)c1sc(Sc2ccc(C(=O)NC)cc2[N+](=O)[O-])nc1C ZINC000450635946 566692227 /nfs/dbraw/zinc/69/22/27/566692227.db2.gz CLGWWZIVCXDHBR-UHFFFAOYSA-N 0 0 381.435 3.047 20 5 GGBDRN CCC1CCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000561308733 566693813 /nfs/dbraw/zinc/69/38/13/566693813.db2.gz BOAUQHOYNTVCEA-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN COc1ccc(Br)cc1CNc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000561332797 566695377 /nfs/dbraw/zinc/69/53/77/566695377.db2.gz GXUIMHUCLXKHGV-UHFFFAOYSA-N 0 0 380.198 3.077 20 5 GGBDRN O=C(NCCc1ccc(Cl)s1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000468348132 566696978 /nfs/dbraw/zinc/69/69/78/566696978.db2.gz KTCLDJNKOSBUPG-UHFFFAOYSA-N 0 0 381.841 3.325 20 5 GGBDRN O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1nccs1 ZINC000515235415 566699461 /nfs/dbraw/zinc/69/94/61/566699461.db2.gz SJVKBCVZHZKUGJ-UHFFFAOYSA-N 0 0 375.332 3.304 20 5 GGBDRN Cc1c(Br)c(NCc2ncc(C(F)(F)F)cn2)ncc1[N+](=O)[O-] ZINC000450719977 566700184 /nfs/dbraw/zinc/70/01/84/566700184.db2.gz RXKORKBFZYDQQV-UHFFFAOYSA-N 0 0 392.135 3.482 20 5 GGBDRN CCO[C@@H]1CCN(c2ccc(I)cc2[N+](=O)[O-])C[C@@H]1C ZINC000450743371 566700633 /nfs/dbraw/zinc/70/06/33/566700633.db2.gz HADOLDIVWFSRRU-IINYFYTJSA-N 0 0 390.221 3.451 20 5 GGBDRN O=C(NCCSCC(F)(F)F)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000488012230 566702451 /nfs/dbraw/zinc/70/24/51/566702451.db2.gz FZXQYTVALGROEI-UHFFFAOYSA-N 0 0 385.795 3.385 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000541211411 566703102 /nfs/dbraw/zinc/70/31/02/566703102.db2.gz IZVWRWXEZKVTPM-UHFFFAOYSA-N 0 0 384.223 3.087 20 5 GGBDRN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000468457463 566703316 /nfs/dbraw/zinc/70/33/16/566703316.db2.gz BLDCJSVOMCZLRH-JTQLQIEISA-N 0 0 390.303 3.269 20 5 GGBDRN CC[C@@H]1CN(c2cc(C)c([N+](=O)[O-])cc2Br)C[C@@H](C)S1(=O)=O ZINC000561432925 566704308 /nfs/dbraw/zinc/70/43/08/566704308.db2.gz VQMKVUXMROEQAG-GHMZBOCLSA-N 0 0 391.287 3.068 20 5 GGBDRN O=C(Nc1ccc(OCCCO)cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000561428748 566704963 /nfs/dbraw/zinc/70/49/63/566704963.db2.gz IVRYWEYXGHKXST-UHFFFAOYSA-N 0 0 395.209 3.371 20 5 GGBDRN CO[C@@H]1CCN(c2ccc(I)cc2[N+](=O)[O-])C[C@H]1C ZINC000450780370 566705462 /nfs/dbraw/zinc/70/54/62/566705462.db2.gz XZYQQLWFJOHGOR-NOZJJQNGSA-N 0 0 376.194 3.061 20 5 GGBDRN COc1cccc(C(F)(F)CNc2ncc(Br)cc2[N+](=O)[O-])n1 ZINC000561449342 566705877 /nfs/dbraw/zinc/70/58/77/566705877.db2.gz NHSWSNMZCBVQOX-UHFFFAOYSA-N 0 0 389.156 3.360 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N[C@H]1CCO[C@H](c2ccncc2)C1 ZINC000450785863 566705993 /nfs/dbraw/zinc/70/59/93/566705993.db2.gz BDYMMCLOEZOCNM-JSGCOSHPSA-N 0 0 379.214 3.480 20 5 GGBDRN O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1CCCCS1 ZINC000541232744 566706220 /nfs/dbraw/zinc/70/62/20/566706220.db2.gz IIHMHKHWQJFYCG-CYBMUJFWSA-N 0 0 377.388 3.427 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)COc1ccc(Br)c(F)c1 ZINC000580622360 566709235 /nfs/dbraw/zinc/70/92/35/566709235.db2.gz XMOBSXPHYHJIQE-SNVBAGLBSA-N 0 0 386.173 3.315 20 5 GGBDRN Cc1cc(OC[C@H](O)COc2ccccc2[N+](=O)[O-])ccc1Br ZINC000541261110 566709580 /nfs/dbraw/zinc/70/95/80/566709580.db2.gz JVCUYIZHJZZXLX-LBPRGKRZSA-N 0 0 382.210 3.484 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[C@@H](Nc2cccc(Br)c2)C1 ZINC000468568174 566710481 /nfs/dbraw/zinc/71/04/81/566710481.db2.gz BNRQQOURRBGGBI-CYBMUJFWSA-N 0 0 393.241 3.402 20 5 GGBDRN Cn1nccc1[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000450837626 566710802 /nfs/dbraw/zinc/71/08/02/566710802.db2.gz CQTNMDABGIXFLW-BONVTDFDSA-N 0 0 381.230 3.423 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc(F)cc(Br)c1 ZINC000515408385 566711775 /nfs/dbraw/zinc/71/17/75/566711775.db2.gz RTAPOTWFRRHLCH-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN COc1cc(COc2ccc(Br)cc2C(N)=O)ccc1[N+](=O)[O-] ZINC000561515700 566711938 /nfs/dbraw/zinc/71/19/38/566711938.db2.gz JLAYLBSSGYMTFY-UHFFFAOYSA-N 0 0 381.182 3.044 20 5 GGBDRN COc1ccc(C[C@H](CO)CNc2ncccc2[N+](=O)[O-])cc1Br ZINC000450844846 566712071 /nfs/dbraw/zinc/71/20/71/566712071.db2.gz LZOUEAVSPAJIEF-LBPRGKRZSA-N 0 0 396.241 3.024 20 5 GGBDRN COCCN(Cc1cncs1)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000468579986 566712125 /nfs/dbraw/zinc/71/21/25/566712125.db2.gz SKWXMQDATMWYMQ-LBPRGKRZSA-N 0 0 381.479 3.207 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2nc3ccc(F)cc3o2)cc1[N+](=O)[O-] ZINC000541290378 566712500 /nfs/dbraw/zinc/71/25/00/566712500.db2.gz JUNMXZRIQFMVTB-UHFFFAOYSA-N 0 0 382.145 3.156 20 5 GGBDRN O=C(NCC(F)F)[C@@H]1CCCCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000450850597 566712848 /nfs/dbraw/zinc/71/28/48/566712848.db2.gz VJZHVFVBRGCLQZ-NSHDSACASA-N 0 0 392.200 3.098 20 5 GGBDRN CS(=O)(=O)Cc1nc2ccccc2n1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000580669388 566713380 /nfs/dbraw/zinc/71/33/80/566713380.db2.gz DVZPCIBFUTUOHG-UHFFFAOYSA-N 0 0 379.825 3.191 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCCS2)c(C(F)(F)F)c1 ZINC000541309230 566713775 /nfs/dbraw/zinc/71/37/75/566713775.db2.gz VXKCSNUVGFSISL-SNVBAGLBSA-N 0 0 384.401 3.178 20 5 GGBDRN CC[C@H](C)[C@@](C)(O)CNc1ccc(I)cc1[N+](=O)[O-] ZINC000488209515 566713981 /nfs/dbraw/zinc/71/39/81/566713981.db2.gz MCNHTKYDHKNIFE-ZANVPECISA-N 0 0 378.210 3.408 20 5 GGBDRN COC[C@H](Cn1ccc(C)c([N+](=O)[O-])c1=O)c1ccc(Br)cc1 ZINC000450867031 566714302 /nfs/dbraw/zinc/71/43/02/566714302.db2.gz GUCLELYZZRDRBE-ZDUSSCGKSA-N 0 0 381.226 3.258 20 5 GGBDRN CS(=O)(=O)c1cccc(N[C@@H]2CCO[C@@H](c3cccs3)C2)c1[N+](=O)[O-] ZINC000450864017 566714436 /nfs/dbraw/zinc/71/44/36/566714436.db2.gz QUBUFYXSBVVEJS-DGCLKSJQSA-N 0 0 382.463 3.392 20 5 GGBDRN CC[C@@H](C)[C@@](C)(O)CNc1ccc(I)cc1[N+](=O)[O-] ZINC000488209513 566714580 /nfs/dbraw/zinc/71/45/80/566714580.db2.gz MCNHTKYDHKNIFE-RNCFNFMXSA-N 0 0 378.210 3.408 20 5 GGBDRN CNc1nccc(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000515498627 566715470 /nfs/dbraw/zinc/71/54/70/566715470.db2.gz IIUOOJMLKVUENM-GXFFZTMASA-N 0 0 381.219 3.046 20 5 GGBDRN COCc1ccccc1CS(=O)(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000561530695 566715622 /nfs/dbraw/zinc/71/56/22/566715622.db2.gz WXOZGLBKFMLJML-UHFFFAOYSA-N 0 0 384.841 3.014 20 5 GGBDRN O=[N+]([O-])c1cccnc1NC[C@@H](CO)Cc1ccc(F)c(Br)c1 ZINC000450890093 566717114 /nfs/dbraw/zinc/71/71/14/566717114.db2.gz UDJHVMYKPQNCSP-NSHDSACASA-N 0 0 384.205 3.155 20 5 GGBDRN Cc1ccc(OC(F)F)c(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)c1 ZINC000488249035 566717282 /nfs/dbraw/zinc/71/72/82/566717282.db2.gz IONYSQNVCREBCB-UHFFFAOYSA-N 0 0 389.152 3.477 20 5 GGBDRN COc1ccc(F)cc1[C@@H](C)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000515516594 566717974 /nfs/dbraw/zinc/71/79/74/566717974.db2.gz HEPKTVQYKUCUJI-SECBINFHSA-N 0 0 388.804 3.435 20 5 GGBDRN COc1ccc(C(=O)NCc2cc([N+](=O)[O-])ccc2OC)c(Br)c1 ZINC000541332997 566718113 /nfs/dbraw/zinc/71/81/13/566718113.db2.gz XRTQBMRJJJNJIE-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN Nc1c(C(=O)NCC2(c3cccc(Br)c3)CC2)cccc1[N+](=O)[O-] ZINC000468668633 566718323 /nfs/dbraw/zinc/71/83/23/566718323.db2.gz TVZXAZMBMDYZEU-UHFFFAOYSA-N 0 0 390.237 3.401 20 5 GGBDRN Cc1cnc(OCC(=O)NCCc2cccc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000426607001 566720781 /nfs/dbraw/zinc/72/07/81/566720781.db2.gz BYFIUGWAOYNWEO-UHFFFAOYSA-N 0 0 384.219 3.343 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2CCc3sc(Cl)cc32)cc1[N+](=O)[O-] ZINC000515562966 566720851 /nfs/dbraw/zinc/72/08/51/566720851.db2.gz TXNBFLKPVFVBSH-NSHDSACASA-N 0 0 379.825 3.360 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1csc(Br)c1 ZINC000468701675 566721022 /nfs/dbraw/zinc/72/10/22/566721022.db2.gz FNHFETLUEUHCFB-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN O=C(Nc1cccc(N2CCC2=O)c1)c1sc(Br)cc1[N+](=O)[O-] ZINC000468697571 566721628 /nfs/dbraw/zinc/72/16/28/566721628.db2.gz UKWGWTMJHVWDEA-UHFFFAOYSA-N 0 0 396.222 3.408 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H](COC(F)F)C1 ZINC000580766014 566721735 /nfs/dbraw/zinc/72/17/35/566721735.db2.gz OHKGYSKIWQTXEM-VIFPVBQESA-N 0 0 380.800 3.428 20 5 GGBDRN CCOc1cccc(CN(CCO)c2ncc([N+](=O)[O-])cc2Br)c1 ZINC000450935807 566722590 /nfs/dbraw/zinc/72/25/90/566722590.db2.gz FYYFKEKWQUSIQX-UHFFFAOYSA-N 0 0 396.241 3.150 20 5 GGBDRN NS(=O)(=O)c1c(NCCc2cccc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000515589393 566722696 /nfs/dbraw/zinc/72/26/96/566722696.db2.gz YRGBCZZISWCTTI-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN Cn1ccnc1[C@@H]1C[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])CCO1 ZINC000450952608 566723932 /nfs/dbraw/zinc/72/39/32/566723932.db2.gz UMJLOYPJGQQZQO-RISCZKNCSA-N 0 0 381.230 3.423 20 5 GGBDRN Cn1ccnc1[C@H]1C[C@@H](Nc2ccc(Br)cc2[N+](=O)[O-])CCO1 ZINC000450952609 566723988 /nfs/dbraw/zinc/72/39/88/566723988.db2.gz UMJLOYPJGQQZQO-SMDDNHRTSA-N 0 0 381.230 3.423 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1SCCc2ccccc21 ZINC000468730209 566724028 /nfs/dbraw/zinc/72/40/28/566724028.db2.gz VDZZOGPDHSJRAX-MRXNPFEDSA-N 0 0 378.475 3.441 20 5 GGBDRN Nc1c(C(=O)NCCc2nc3cc(Cl)ccc3s2)cccc1[N+](=O)[O-] ZINC000468747449 566725233 /nfs/dbraw/zinc/72/52/33/566725233.db2.gz WWTUAXGCIQOTQL-UHFFFAOYSA-N 0 0 376.825 3.413 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000580822208 566726583 /nfs/dbraw/zinc/72/65/83/566726583.db2.gz NXVHNJNVFBELKM-UHFFFAOYSA-N 0 0 393.755 3.070 20 5 GGBDRN COc1ccc(Br)cc1[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C(=O)[O-] ZINC000426750138 566726773 /nfs/dbraw/zinc/72/67/73/566726773.db2.gz LJFQLFPSGJUVSY-OAHLLOKOSA-N 0 0 395.209 3.281 20 5 GGBDRN C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)Oc1ccc(Br)cc1 ZINC000468747922 566727065 /nfs/dbraw/zinc/72/70/65/566727065.db2.gz ZQAMPOXBFBMNJM-SNVBAGLBSA-N 0 0 394.225 3.137 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(F)c(Br)c1 ZINC000426766018 566727475 /nfs/dbraw/zinc/72/74/75/566727475.db2.gz VNIVORFUZVUFHK-HNNXBMFYSA-N 0 0 397.200 3.282 20 5 GGBDRN CNS(=O)(=O)c1ccc(NC[C@@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC000488439464 566727569 /nfs/dbraw/zinc/72/75/69/566727569.db2.gz HXOISZMXPLRJFE-LLVKDONJSA-N 0 0 377.413 3.130 20 5 GGBDRN Cc1ccc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])c(Br)c1 ZINC000426766793 566727771 /nfs/dbraw/zinc/72/77/71/566727771.db2.gz GYWPPEMGFLWMRG-INIZCTEOSA-N 0 0 393.237 3.451 20 5 GGBDRN CN(C)c1n[nH]c(C2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000561692952 566728581 /nfs/dbraw/zinc/72/85/81/566728581.db2.gz PMSZCPPWXRNDKN-UHFFFAOYSA-N 0 0 385.255 3.470 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000515708768 566728859 /nfs/dbraw/zinc/72/88/59/566728859.db2.gz FPCCHMUPOKHWMG-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1csc(Br)c1 ZINC000426773637 566729124 /nfs/dbraw/zinc/72/91/24/566729124.db2.gz QJQJNXCBLMVKAK-LBPRGKRZSA-N 0 0 385.239 3.204 20 5 GGBDRN Cc1cc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])ccc1Br ZINC000426778356 566729715 /nfs/dbraw/zinc/72/97/15/566729715.db2.gz WXJAVNHLFWMDMB-INIZCTEOSA-N 0 0 393.237 3.451 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](CCO)c1ccccc1Br ZINC000561683646 566729853 /nfs/dbraw/zinc/72/98/53/566729853.db2.gz MGOQMGDBNJZUPZ-ZDUSSCGKSA-N 0 0 383.246 3.418 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000515754683 566730492 /nfs/dbraw/zinc/73/04/92/566730492.db2.gz GXWRMJZRRJEYNQ-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2cccc(Cl)c2Cl)cc1 ZINC000515749789 566731305 /nfs/dbraw/zinc/73/13/05/566731305.db2.gz BWEQRPQICOMWRK-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(Br)ccc1F ZINC000426800393 566731325 /nfs/dbraw/zinc/73/13/25/566731325.db2.gz NPBVYIKALCTWMH-HNNXBMFYSA-N 0 0 397.200 3.282 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(F)cc1Br ZINC000426803480 566731612 /nfs/dbraw/zinc/73/16/12/566731612.db2.gz MRKXGRJBAKKDIP-HNNXBMFYSA-N 0 0 397.200 3.282 20 5 GGBDRN O=C(COc1c2cc(Br)ccc2ncc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000468801451 566731713 /nfs/dbraw/zinc/73/17/13/566731713.db2.gz CPUUKTNEIVBGAT-SNVBAGLBSA-N 0 0 395.209 3.280 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000580907709 566732643 /nfs/dbraw/zinc/73/26/43/566732643.db2.gz TVRFADWJBRHAEN-SNVBAGLBSA-N 0 0 398.257 3.381 20 5 GGBDRN O=C(NCCc1c[nH]c2cccc(Br)c12)c1ccc([N+](=O)[O-])[nH]1 ZINC000426827960 566733156 /nfs/dbraw/zinc/73/31/56/566733156.db2.gz JRWJKNODKRRPPT-UHFFFAOYSA-N 0 0 377.198 3.139 20 5 GGBDRN C[C@H]1CCCC[C@@H]1OCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000515758844 566733145 /nfs/dbraw/zinc/73/31/45/566733145.db2.gz RKPHBCMMTIWMTG-FZMZJTMJSA-N 0 0 376.862 3.122 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(Br)c1 ZINC000426817171 566733547 /nfs/dbraw/zinc/73/35/47/566733547.db2.gz NQIDGNOVAZIDRW-AWEZNQCLSA-N 0 0 379.210 3.143 20 5 GGBDRN Cc1c(Br)c(N[C@H](C)[C@@H](O)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000541578853 566734919 /nfs/dbraw/zinc/73/49/19/566734919.db2.gz QUIMQAODRREUFT-RISCZKNCSA-N 0 0 380.242 3.465 20 5 GGBDRN Cc1c(Br)c(N2CCN(Cc3ccsc3)CC2)ncc1[N+](=O)[O-] ZINC000541576262 566735087 /nfs/dbraw/zinc/73/50/87/566735087.db2.gz DUJIWAFNGHVYQP-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCN(CC(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000541579283 566735192 /nfs/dbraw/zinc/73/51/92/566735192.db2.gz VMEAQOGUNIYVQG-MRVPVSSYSA-N 0 0 383.168 3.109 20 5 GGBDRN Cc1c(Br)c(NCCc2nc3cc(F)ccc3[nH]2)ncc1[N+](=O)[O-] ZINC000541577077 566735280 /nfs/dbraw/zinc/73/52/80/566735280.db2.gz FDSUMQBGKSGMMI-UHFFFAOYSA-N 0 0 394.204 3.153 20 5 GGBDRN CN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1Cl ZINC000561750088 566735401 /nfs/dbraw/zinc/73/54/01/566735401.db2.gz PZFXCGPNBWDHRJ-UHFFFAOYSA-N 0 0 386.832 3.293 20 5 GGBDRN Cc1c(Br)c(N2CCC([C@H](O)C(F)(F)F)CC2)ncc1[N+](=O)[O-] ZINC000541579990 566735910 /nfs/dbraw/zinc/73/59/10/566735910.db2.gz MAORBWGVBDVADW-NSHDSACASA-N 0 0 398.179 3.200 20 5 GGBDRN CCN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(Br)cn1 ZINC000608807995 566736671 /nfs/dbraw/zinc/73/66/71/566736671.db2.gz GLSSHHVTXCWGQF-UHFFFAOYSA-N 0 0 394.181 3.148 20 5 GGBDRN Cc1c(Br)c(N[C@H](C)C(=O)NCc2ccccc2)ncc1[N+](=O)[O-] ZINC000541590921 566736855 /nfs/dbraw/zinc/73/68/55/566736855.db2.gz AUFBLHNKHBIFFU-LLVKDONJSA-N 0 0 393.241 3.178 20 5 GGBDRN Cc1c(Br)c(N[C@@H](C)c2nnc3ccccn32)ncc1[N+](=O)[O-] ZINC000541589597 566737026 /nfs/dbraw/zinc/73/70/26/566737026.db2.gz GDWQUNQKAGAXRP-VIFPVBQESA-N 0 0 377.202 3.277 20 5 GGBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n(-c2cccc(Br)c2)n1 ZINC000608820576 566737799 /nfs/dbraw/zinc/73/77/99/566737799.db2.gz FAEFLKZTCJIFBT-UHFFFAOYSA-N 0 0 390.197 3.432 20 5 GGBDRN Nc1c(C(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)cc(F)cc1[N+](=O)[O-] ZINC000608826620 566737907 /nfs/dbraw/zinc/73/79/07/566737907.db2.gz JICSHDMQUUDWOU-AAEUAGOBSA-N 0 0 394.200 3.365 20 5 GGBDRN O=C(N[C@@H](CO)c1ccc(Br)c(F)c1)c1ccc([N+](=O)[O-])s1 ZINC000561774072 566738600 /nfs/dbraw/zinc/73/86/00/566738600.db2.gz MFGQHQQXAYZSSQ-JTQLQIEISA-N 0 0 389.202 3.021 20 5 GGBDRN Cn1c2ccc(Nc3ccc(Br)cc3[N+](=O)[O-])cc2n(C)c1=O ZINC000608856006 566739211 /nfs/dbraw/zinc/73/92/11/566739211.db2.gz JFHVVTAHMFVVPD-UHFFFAOYSA-N 0 0 377.198 3.291 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1Cl ZINC000468879453 566740117 /nfs/dbraw/zinc/74/01/17/566740117.db2.gz IDNDLIJGWOILSN-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN Cc1csc(CCCCNS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)n1 ZINC000608913772 566741995 /nfs/dbraw/zinc/74/19/95/566741995.db2.gz TULQVVFHKYIRNB-UHFFFAOYSA-N 0 0 383.495 3.278 20 5 GGBDRN COc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000608900148 566742437 /nfs/dbraw/zinc/74/24/37/566742437.db2.gz IYWPYVDDANMWKC-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN C[C@H](c1ncc(Br)cn1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000561849175 566743362 /nfs/dbraw/zinc/74/33/62/566743362.db2.gz FLGBIOLBEHCOBD-GFCCVEGCSA-N 0 0 392.257 3.031 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cscc1Br ZINC000581028422 566744745 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O=C(Nc1nc2c(s1)CSCC2)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000488802391 566749292 /nfs/dbraw/zinc/74/92/92/566749292.db2.gz XJGRHTFEVVWVHS-UHFFFAOYSA-N 0 0 376.463 3.431 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CCC[C@@H]1C1CC1 ZINC000609130357 566750154 /nfs/dbraw/zinc/75/01/54/566750154.db2.gz XZXWLBBLWWOOLK-CYBMUJFWSA-N 0 0 386.189 3.214 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCCOCC(F)(F)F)cc1SC ZINC000609128724 566750765 /nfs/dbraw/zinc/75/07/65/566750765.db2.gz DEWUVCDLHBFTTJ-UHFFFAOYSA-N 0 0 382.360 3.024 20 5 GGBDRN Cc1cnc([C@H](NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C2CC2)s1 ZINC000541815174 566751287 /nfs/dbraw/zinc/75/12/87/566751287.db2.gz MSUCUFOPQQBPOD-OAHLLOKOSA-N 0 0 381.479 3.406 20 5 GGBDRN CCN(Cc1ccoc1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000609134455 566751314 /nfs/dbraw/zinc/75/13/14/566751314.db2.gz DNXPJSTULOFSET-UHFFFAOYSA-N 0 0 389.227 3.161 20 5 GGBDRN C[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488850008 566752200 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O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1c(Cl)cccc1C(F)(F)F ZINC000469066690 566758840 /nfs/dbraw/zinc/75/88/40/566758840.db2.gz XDSZGWURTUFKPX-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@@H](C)Sc3ccccc32)c([N+](=O)[O-])c1 ZINC000469069286 566758963 /nfs/dbraw/zinc/75/89/63/566758963.db2.gz VYHLVTPSJAUQGV-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN NS(=O)(=O)c1ccc(OCc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000562038813 566759243 /nfs/dbraw/zinc/75/92/43/566759243.db2.gz HZJQATKXVGHNLB-UHFFFAOYSA-N 0 0 377.205 3.128 20 5 GGBDRN C[C@@H](CCc1ccc(Br)cc1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541906757 566759361 /nfs/dbraw/zinc/75/93/61/566759361.db2.gz VATKBTHWYIKCRR-NSHDSACASA-N 0 0 393.241 3.317 20 5 GGBDRN Cc1ccc(CS(=O)(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000469087126 566760459 /nfs/dbraw/zinc/76/04/59/566760459.db2.gz YFWJQPCOEVDJCI-UHFFFAOYSA-N 0 0 386.832 3.358 20 5 GGBDRN COc1cc(S(=O)(=O)NCCCc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000469081069 566760670 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ZINC000610259993 566818090 /nfs/dbraw/zinc/81/80/90/566818090.db2.gz FPYRNBIYVUQVHK-LLVKDONJSA-N 0 0 385.854 3.159 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCC3(O)CCC3)cc2[N+](=O)[O-])n1 ZINC000469850902 566820222 /nfs/dbraw/zinc/82/02/22/566820222.db2.gz GOWRTJHUPSDOQK-UHFFFAOYSA-N 0 0 379.463 3.156 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1CCC(CF)CC1 ZINC000562757165 566820487 /nfs/dbraw/zinc/82/04/87/566820487.db2.gz CIXUOAIAOOSIEV-UHFFFAOYSA-N 0 0 392.168 3.021 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCCO1 ZINC000610264297 566820772 /nfs/dbraw/zinc/82/07/72/566820772.db2.gz GGBJRZRPPFUYNZ-UHFFFAOYSA-N 0 0 383.253 3.091 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(Br)c1 ZINC000610293582 566822680 /nfs/dbraw/zinc/82/26/80/566822680.db2.gz KNCDYAUBLLILPI-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@@H](O)C3CC3)cc2[N+](=O)[O-])n1 ZINC000469896563 566825092 /nfs/dbraw/zinc/82/50/92/566825092.db2.gz JTEGDFNKYIMDTC-CYBMUJFWSA-N 0 0 379.463 3.012 20 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NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000542973913 566842855 /nfs/dbraw/zinc/84/28/55/566842855.db2.gz JFXGVYIIGDGJDU-ZJUUUORDSA-N 0 0 381.376 3.023 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000542973908 566842868 /nfs/dbraw/zinc/84/28/68/566842868.db2.gz JFXGVYIIGDGJDU-UWVGGRQHSA-N 0 0 381.376 3.023 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCOc2ccccc2C1 ZINC000610572040 566843113 /nfs/dbraw/zinc/84/31/13/566843113.db2.gz INDIFTBSAFFJOO-UHFFFAOYSA-N 0 0 377.194 3.392 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](c1cccs1)C(C)(C)CO ZINC000517726355 566843147 /nfs/dbraw/zinc/84/31/47/566843147.db2.gz JJSGYRBAYVVERM-HNNXBMFYSA-N 0 0 384.479 3.003 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](c1cccs1)C(C)(C)CO ZINC000517726356 566843209 /nfs/dbraw/zinc/84/32/09/566843209.db2.gz JJSGYRBAYVVERM-OAHLLOKOSA-N 0 0 384.479 3.003 20 5 GGBDRN O=C(Nc1ccccc1-n1cncn1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610570561 566843400 /nfs/dbraw/zinc/84/34/00/566843400.db2.gz WQIRDQOGAYDOHL-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CC(C)Oc1ncccc1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610570625 566843713 /nfs/dbraw/zinc/84/37/13/566843713.db2.gz YKBZYYLJJLESSR-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN Cc1nc([C@@H]2CCCCN2C(=O)c2ccc(Br)cc2[N+](=O)[O-])no1 ZINC000610571205 566843896 /nfs/dbraw/zinc/84/38/96/566843896.db2.gz ZBUHZMRGSJBMGQ-LBPRGKRZSA-N 0 0 395.213 3.416 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCOC[C@H]1c1ccco1 ZINC000610571103 566843974 /nfs/dbraw/zinc/84/39/74/566843974.db2.gz ZQLUYPLOCFFWAD-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2cc(Br)ccc2NC(C)C)c1[N+](=O)[O-] ZINC000470074090 566844268 /nfs/dbraw/zinc/84/42/68/566844268.db2.gz IMCXQYYBCOPXCB-UHFFFAOYSA-N 0 0 382.218 3.461 20 5 GGBDRN COc1ccc(Cl)cc1CS(=O)(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451587454 566844741 /nfs/dbraw/zinc/84/47/41/566844741.db2.gz LOTSLGIUZWLFFS-NSHDSACASA-N 0 0 384.841 3.437 20 5 GGBDRN COc1cc(Cl)ccc1S(=O)(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610590879 566844920 /nfs/dbraw/zinc/84/49/20/566844920.db2.gz CUIRBZRSVLOIEN-UHFFFAOYSA-N 0 0 384.841 3.470 20 5 GGBDRN CC(C)Nc1ccc(Br)cc1NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000470091560 566845231 /nfs/dbraw/zinc/84/52/31/566845231.db2.gz QLCVEWIPJCVKOG-UHFFFAOYSA-N 0 0 396.245 3.403 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC[C@@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000517736332 566845375 /nfs/dbraw/zinc/84/53/75/566845375.db2.gz QUSDNQFSENJAPN-CYBMUJFWSA-N 0 0 381.841 3.130 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(Br)ccc1NC(C)C ZINC000470092133 566846790 /nfs/dbraw/zinc/84/67/90/566846790.db2.gz SRTUXTSUNCQSBI-UHFFFAOYSA-N 0 0 396.245 3.321 20 5 GGBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N[C@@H](CO)c1cccc(Br)c1 ZINC000470132139 566847760 /nfs/dbraw/zinc/84/77/60/566847760.db2.gz KCFGHNXRKPRIBQ-AWEZNQCLSA-N 0 0 398.188 3.352 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000563054220 566848543 /nfs/dbraw/zinc/84/85/43/566848543.db2.gz UIVPRQSTQUAWHS-GFCCVEGCSA-N 0 0 382.825 3.203 20 5 GGBDRN O=[N+]([O-])c1ccccc1Nc1cnc(N2CCOCC2)c(Br)c1 ZINC000543068915 566848501 /nfs/dbraw/zinc/84/85/01/566848501.db2.gz ZNHWPEHYCUWLMR-UHFFFAOYSA-N 0 0 379.214 3.333 20 5 GGBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N[C@@H](CO)c1ccc(Br)cc1 ZINC000470137956 566849649 /nfs/dbraw/zinc/84/96/49/566849649.db2.gz MTTJVWWBVMMCDR-AWEZNQCLSA-N 0 0 398.188 3.352 20 5 GGBDRN CCN(C[C@@H](O)C(F)(F)F)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000428514112 566850658 /nfs/dbraw/zinc/85/06/58/566850658.db2.gz VLKPPRTWIMEQLZ-LLVKDONJSA-N 0 0 386.779 3.112 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CC[C@@H]2CCC[C@@H]21 ZINC000428513059 566850996 /nfs/dbraw/zinc/85/09/96/566850996.db2.gz CXWAIJJOJWWCHV-ZANVPECISA-N 0 0 386.189 3.214 20 5 GGBDRN CNc1nccc(C(=O)NC2(c3ccc(Cl)c(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000582309560 566851665 /nfs/dbraw/zinc/85/16/65/566851665.db2.gz IQNZGBLVVUYEPR-UHFFFAOYSA-N 0 0 381.219 3.179 20 5 GGBDRN C[C@H](Cc1ccccc1Br)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000470167250 566853167 /nfs/dbraw/zinc/85/31/67/566853167.db2.gz NYPGULXPMKILEZ-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN COCC[C@@H](Cc1ccco1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000543134213 566855434 /nfs/dbraw/zinc/85/54/34/566855434.db2.gz DCVUIWJJYZHLKF-ZDUSSCGKSA-N 0 0 397.225 3.328 20 5 GGBDRN CCc1ccc(NC(=O)Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)cc1 ZINC000543145627 566856005 /nfs/dbraw/zinc/85/60/05/566856005.db2.gz VVXRMMAESIGUBU-UHFFFAOYSA-N 0 0 394.225 3.029 20 5 GGBDRN CS(=O)(=O)C[C@H]1CCCCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000451648596 566856453 /nfs/dbraw/zinc/85/64/53/566856453.db2.gz FIJXOLGAXMXYGM-CYBMUJFWSA-N 0 0 380.388 3.013 20 5 GGBDRN CCOC(=O)[C@@H]1CCCCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000543154661 566857246 /nfs/dbraw/zinc/85/72/46/566857246.db2.gz BJBQVTHFKUKBCL-LBPRGKRZSA-N 0 0 386.857 3.285 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000543149445 566857403 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COc1ccc(CN(C)c2ncc(Br)cc2[N+](=O)[O-])cc1OC ZINC000610769465 566861025 /nfs/dbraw/zinc/86/10/25/566861025.db2.gz PPLXNYVRMFKRRQ-UHFFFAOYSA-N 0 0 382.214 3.406 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N[C@@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000610785442 566864109 /nfs/dbraw/zinc/86/41/09/566864109.db2.gz SUCCCKZCXSULIS-MRVPVSSYSA-N 0 0 399.213 3.132 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccccc1Cl ZINC000610786569 566864183 /nfs/dbraw/zinc/86/41/83/566864183.db2.gz KLYAQRAEWBDIAA-MRXNPFEDSA-N 0 0 384.841 3.223 20 5 GGBDRN Cc1ccc(NCCCNC(=O)C(=O)c2ccc(Cl)s2)c([N+](=O)[O-])c1 ZINC000428653358 566865028 /nfs/dbraw/zinc/86/50/28/566865028.db2.gz XOOUUWUWTUKKIQ-UHFFFAOYSA-N 0 0 381.841 3.419 20 5 GGBDRN NC(=O)c1ccc(N[C@H]2C[C@@H]2c2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000518066019 566865584 /nfs/dbraw/zinc/86/55/84/566865584.db2.gz ULJCKOINPIKEPS-OCCSQVGLSA-N 0 0 376.210 3.424 20 5 GGBDRN COCCS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000428661571 566866177 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CCS[C@@H]1CCC[C@H](NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491533804 566907917 /nfs/dbraw/zinc/90/79/17/566907917.db2.gz SQWRDRKPBNOLIY-WDEREUQCSA-N 0 0 392.474 3.085 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(Br)c[nH]c1=O ZINC000470828166 566908264 /nfs/dbraw/zinc/90/82/64/566908264.db2.gz ZEFGVULPZPTISC-UHFFFAOYSA-N 0 0 382.170 3.109 20 5 GGBDRN CCC1(O)CCC(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CC1 ZINC000611315486 566909230 /nfs/dbraw/zinc/90/92/30/566909230.db2.gz AJDIUJRQKJDWPN-UHFFFAOYSA-N 0 0 385.258 3.479 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCSc1nnc(C2CC2)s1 ZINC000470852679 566909217 /nfs/dbraw/zinc/90/92/17/566909217.db2.gz YTAKKPUMYSHPDS-UHFFFAOYSA-N 0 0 378.435 3.414 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N(C)[C@H](C)CCSC)c([N+](=O)[O-])c1 ZINC000470870486 566912028 /nfs/dbraw/zinc/91/20/28/566912028.db2.gz XWKTYSKTHZULEI-CYBMUJFWSA-N 0 0 389.543 3.203 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CCC[C@H](c2ncc[nH]2)C1 ZINC000611370602 566912364 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GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](C(F)(F)F)C1 ZINC000611402827 566915970 /nfs/dbraw/zinc/91/59/70/566915970.db2.gz DPOQRWSCKCASNL-ZDUSSCGKSA-N 0 0 378.372 3.499 20 5 GGBDRN C[C@H]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000429252889 566916419 /nfs/dbraw/zinc/91/64/19/566916419.db2.gz IQYZEBSYSXAVND-UWVGGRQHSA-N 0 0 388.205 3.460 20 5 GGBDRN O=C(NCc1cc(Br)c2c(c1)OCCO2)c1ccccc1[N+](=O)[O-] ZINC000519025774 566916928 /nfs/dbraw/zinc/91/69/28/566916928.db2.gz VVFCLJGNUYVSPV-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN COc1cccc([C@H]2C[C@H](NS(=O)(=O)c3cc([N+](=O)[O-])c(C)s3)C2)c1 ZINC000451970522 566917213 /nfs/dbraw/zinc/91/72/13/566917213.db2.gz YTAJTYHIKPTNQH-JOCQHMNTSA-N 0 0 382.463 3.198 20 5 GGBDRN O=[N+]([O-])c1ccc(Cn2nnc(-c3ccc(Br)o3)n2)c(Cl)c1 ZINC000543862615 566917628 /nfs/dbraw/zinc/91/76/28/566917628.db2.gz CMSWACFSPOKQEX-UHFFFAOYSA-N 0 0 384.577 3.306 20 5 GGBDRN CC1(C)C[C@@H](O)CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000451986418 566917696 /nfs/dbraw/zinc/91/76/96/566917696.db2.gz XNYKFQHWHXFGPI-JTQLQIEISA-N 0 0 397.280 3.073 20 5 GGBDRN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543859192 566918555 /nfs/dbraw/zinc/91/85/55/566918555.db2.gz NMNFBBWGBVQTPW-LLVKDONJSA-N 0 0 383.857 3.089 20 5 GGBDRN Nc1nccc(C(=O)N2CC[C@@H](Sc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000563819114 566919628 /nfs/dbraw/zinc/91/96/28/566919628.db2.gz AMGRTIYZAPOBSQ-GFCCVEGCSA-N 0 0 378.841 3.063 20 5 GGBDRN Nc1nccc(C(=O)N2CC[C@H](Sc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000563819115 566920019 /nfs/dbraw/zinc/92/00/19/566920019.db2.gz AMGRTIYZAPOBSQ-LBPRGKRZSA-N 0 0 378.841 3.063 20 5 GGBDRN Cc1cc(NC(=O)CS(=O)(=O)Cc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000611475530 566920834 /nfs/dbraw/zinc/92/08/34/566920834.db2.gz NXGIMLQKMRGYHR-UHFFFAOYSA-N 0 0 388.854 3.172 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC2(Cc3cccc(Cl)c3)CC2)cc1 ZINC000452009125 566921666 /nfs/dbraw/zinc/92/16/66/566921666.db2.gz ULQCBBBYDCAYIB-UHFFFAOYSA-N 0 0 380.853 3.443 20 5 GGBDRN CSc1ccc(S(=O)(=O)n2cc(-c3cccc([N+](=O)[O-])c3)cn2)cc1 ZINC000611496327 566922510 /nfs/dbraw/zinc/92/25/10/566922510.db2.gz MOBVIZLTPJJQOL-UHFFFAOYSA-N 0 0 375.431 3.417 20 5 GGBDRN C[C@@H](c1ccccc1)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000611508590 566924086 /nfs/dbraw/zinc/92/40/86/566924086.db2.gz LBIZDGLXHCOGCI-ZBEGNZNMSA-N 0 0 393.237 3.252 20 5 GGBDRN C[C@H]1CC[C@@H](C(F)(F)F)CN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000611542420 566925574 /nfs/dbraw/zinc/92/55/74/566925574.db2.gz KGKUFMPBTOUWNK-WCQYABFASA-N 0 0 380.388 3.130 20 5 GGBDRN CC(C)C[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000543978538 566926560 /nfs/dbraw/zinc/92/65/60/566926560.db2.gz SFTIPBMUGBGFED-SNVBAGLBSA-N 0 0 392.499 3.228 20 5 GGBDRN CN1CCOC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000611566301 566927145 /nfs/dbraw/zinc/92/71/45/566927145.db2.gz MWZJSDLTIGJYJX-ZDUSSCGKSA-N 0 0 379.463 3.077 20 5 GGBDRN C[C@H]1CC[C@@H](C(F)(F)F)CN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000611542573 566927242 /nfs/dbraw/zinc/92/72/42/566927242.db2.gz QQXWRMRLYHQEOB-WCQYABFASA-N 0 0 380.388 3.130 20 5 GGBDRN O=[N+]([O-])c1cccc(CNc2cnc(N3CCOCC3)c(Br)c2)c1 ZINC000544003347 566927892 /nfs/dbraw/zinc/92/78/92/566927892.db2.gz CPVZAJLKXPKGNF-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)CC ZINC000544049063 566933013 /nfs/dbraw/zinc/93/30/13/566933013.db2.gz KYCKRKWQBNPGIF-BMIGLBTASA-N 0 0 388.873 3.434 20 5 GGBDRN O=[N+]([O-])c1ccc2ncnc(NCCOc3ncc(Cl)cc3Cl)c2c1 ZINC000611712067 566933063 /nfs/dbraw/zinc/93/30/63/566933063.db2.gz VDSLIPLCSPAWFT-UHFFFAOYSA-N 0 0 380.191 3.153 20 5 GGBDRN COc1ccc(Br)cc1CNc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611708090 566933333 /nfs/dbraw/zinc/93/33/33/566933333.db2.gz IYGJSTKBUTZILP-UHFFFAOYSA-N 0 0 389.209 3.343 20 5 GGBDRN O=[N+]([O-])c1ccc2ncnc(NCc3ccc(Br)c(F)c3)c2c1 ZINC000611708081 566933762 /nfs/dbraw/zinc/93/37/62/566933762.db2.gz IOGYTUGCUUNKNN-UHFFFAOYSA-N 0 0 377.173 3.474 20 5 GGBDRN CCN(Cc1ccccc1Br)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000563961505 566933767 /nfs/dbraw/zinc/93/37/67/566933767.db2.gz ARQURXMQYZFCJY-UHFFFAOYSA-N 0 0 379.214 3.228 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2cc(-c3ccco3)on2)cc1[N+](=O)[O-] ZINC000544077822 566935917 /nfs/dbraw/zinc/93/59/17/566935917.db2.gz PPXIYIFHSLONRX-UHFFFAOYSA-N 0 0 380.154 3.124 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1ccn2ccnc2c1 ZINC000583279199 566935947 /nfs/dbraw/zinc/93/59/47/566935947.db2.gz MSLQIAGHQKYUJA-UHFFFAOYSA-N 0 0 375.182 3.186 20 5 GGBDRN CCC(CC)(CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OC ZINC000544087525 566936818 /nfs/dbraw/zinc/93/68/18/566936818.db2.gz HJMOXXAFRVSKNB-UHFFFAOYSA-N 0 0 388.873 3.436 20 5 GGBDRN CCOC(=O)[C@@H](CC)N(C(=O)c1ccc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000471260432 566938905 /nfs/dbraw/zinc/93/89/05/566938905.db2.gz PYALHBKMRAMXLL-CYBMUJFWSA-N 0 0 399.241 3.304 20 5 GGBDRN C[C@@H]1OCC[C@]1(C)NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000544122724 566940369 /nfs/dbraw/zinc/94/03/69/566940369.db2.gz CRCWBDOKOPKNKM-XPTSAGLGSA-N 0 0 378.372 3.389 20 5 GGBDRN Cc1cc(C(=O)NCCCCn2cc(Br)cn2)ccc1[N+](=O)[O-] ZINC000471279191 566942068 /nfs/dbraw/zinc/94/20/68/566942068.db2.gz XSZLZJHVXMIJPI-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN CCc1ccc(C(=O)NCCCCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000471279003 566942156 /nfs/dbraw/zinc/94/21/56/566942156.db2.gz WPFIAQIHLTXFQN-UHFFFAOYSA-N 0 0 395.257 3.326 20 5 GGBDRN Cc1cnc(Sc2nnnn2-c2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000544129588 566942507 /nfs/dbraw/zinc/94/25/07/566942507.db2.gz IOEILUYRIPPTAW-UHFFFAOYSA-N 0 0 393.226 3.188 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2ncccc2Br)cc1[N+](=O)[O-] ZINC000493136814 566944156 /nfs/dbraw/zinc/94/41/56/566944156.db2.gz ZOERPSXVTIUMEO-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN CCOc1ccc(Br)cc1-c1noc(Cn2ccc([N+](=O)[O-])n2)n1 ZINC000544157791 566944895 /nfs/dbraw/zinc/94/48/95/566944895.db2.gz JAXSYMIDJGGGLS-UHFFFAOYSA-N 0 0 394.185 3.051 20 5 GGBDRN CCOC(=O)C1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000544150544 566945246 /nfs/dbraw/zinc/94/52/46/566945246.db2.gz MQAUBRZTBLPHSC-UHFFFAOYSA-N 0 0 386.857 3.142 20 5 GGBDRN CC[C@H](C)N(C)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC ZINC000493237786 566945727 /nfs/dbraw/zinc/94/57/27/566945727.db2.gz NMXLULVMZURDQY-QMMMGPOBSA-N 0 0 395.275 3.093 20 5 GGBDRN NC(=O)c1cc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])ccc1F ZINC000612015437 566947798 /nfs/dbraw/zinc/94/77/98/566947798.db2.gz UJQSIJOFGFMYBK-UHFFFAOYSA-N 0 0 383.788 3.217 20 5 GGBDRN Cc1c(Br)c(NCCc2nc3ccccc3o2)ncc1[N+](=O)[O-] ZINC000564129772 566947980 /nfs/dbraw/zinc/94/79/80/566947980.db2.gz SQXKYLICSXLNPI-UHFFFAOYSA-N 0 0 377.198 3.278 20 5 GGBDRN CCS(=O)(=O)c1ccccc1NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000612015466 566948113 /nfs/dbraw/zinc/94/81/13/566948113.db2.gz ZLJXHVWGZAHHBW-UHFFFAOYSA-N 0 0 380.447 3.119 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@]2(C)CCO[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000544218252 566948032 /nfs/dbraw/zinc/94/80/32/566948032.db2.gz FENUZQQDHZWIAG-GDBMZVCRSA-N 0 0 383.242 3.353 20 5 GGBDRN COC(=O)C1(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CCCCC1 ZINC000544214981 566948733 /nfs/dbraw/zinc/94/87/33/566948733.db2.gz ZGROMVXWTORCLN-UHFFFAOYSA-N 0 0 399.241 3.211 20 5 GGBDRN CCC(CC)NS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC ZINC000493526969 566949097 /nfs/dbraw/zinc/94/90/97/566949097.db2.gz NSXTYXLUJMUSMX-UHFFFAOYSA-N 0 0 395.275 3.141 20 5 GGBDRN COc1ccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])c(OC)n1 ZINC000612041506 566949879 /nfs/dbraw/zinc/94/98/79/566949879.db2.gz RNNQSLQQSNXOOQ-UHFFFAOYSA-N 0 0 383.813 3.391 20 5 GGBDRN COC(=O)C1(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000612046579 566950095 /nfs/dbraw/zinc/95/00/95/566950095.db2.gz QVMCYEUZEKQUEU-UHFFFAOYSA-N 0 0 386.857 3.190 20 5 GGBDRN Cc1ccccc1[C@@H](CO)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544241734 566950235 /nfs/dbraw/zinc/95/02/35/566950235.db2.gz SJLFFZNKWPJXCO-CQSZACIVSA-N 0 0 380.853 3.499 20 5 GGBDRN COc1nc(C)cc(C)c1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429784577 566951146 /nfs/dbraw/zinc/95/11/46/566951146.db2.gz KLIOBJVUJOBNSF-UHFFFAOYSA-N 0 0 394.225 3.308 20 5 GGBDRN CCOC(=O)[C@H]1CCCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000544274292 566951109 /nfs/dbraw/zinc/95/11/09/566951109.db2.gz WTESAIXERPNJMR-NSHDSACASA-N 0 0 386.857 3.142 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1CN(c1ccc(Cl)cc1F)S(C)(=O)=O ZINC000429787896 566951291 /nfs/dbraw/zinc/95/12/91/566951291.db2.gz PJVRSNJWKQSHPH-UHFFFAOYSA-N 0 0 388.804 3.362 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(N)=O)cc1F ZINC000583454360 566953213 /nfs/dbraw/zinc/95/32/13/566953213.db2.gz GXBCXTRFZBZRTM-UHFFFAOYSA-N 0 0 396.172 3.156 20 5 GGBDRN CCC1(CC)CN(S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)CCS1 ZINC000493768341 566954057 /nfs/dbraw/zinc/95/40/57/566954057.db2.gz OLQXDPSTTNJZMJ-UHFFFAOYSA-N 0 0 392.474 3.039 20 5 GGBDRN O=C(Nc1ccc2nc[nH]c(=O)c2c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429831349 566954624 /nfs/dbraw/zinc/95/46/24/566954624.db2.gz RMTITLLPCGKDMT-UHFFFAOYSA-N 0 0 389.165 3.258 20 5 GGBDRN C[C@@H]1CC[C@@H](C(F)(F)F)CN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000612121817 566955216 /nfs/dbraw/zinc/95/52/16/566955216.db2.gz OVLLSDXIMNKHRA-VXGBXAGGSA-N 0 0 380.388 3.031 20 5 GGBDRN Cc1ccn(Cc2nnc(-c3c(Cl)cccc3Cl)o2)c(=O)c1[N+](=O)[O-] ZINC000471498698 566956424 /nfs/dbraw/zinc/95/64/24/566956424.db2.gz DVFZUGLBRDRKQS-UHFFFAOYSA-N 0 0 381.175 3.470 20 5 GGBDRN Cc1ccc(-c2noc(Cc3cc[nH]c(=O)c3Br)n2)cc1[N+](=O)[O-] ZINC000564233716 566957127 /nfs/dbraw/zinc/95/71/27/566957127.db2.gz DZUUIHMBQJPEMW-UHFFFAOYSA-N 0 0 391.181 3.407 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(I)c1C)C(F)F ZINC000452260877 566957136 /nfs/dbraw/zinc/95/71/36/566957136.db2.gz GXQPZMWRILCDQY-JTQLQIEISA-N 0 0 398.147 3.281 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H](C)S1(=O)=O ZINC000519674612 566957880 /nfs/dbraw/zinc/95/78/80/566957880.db2.gz PZVGTTAVNZAQEB-CHWSQXEVSA-N 0 0 380.491 3.331 20 5 GGBDRN CC[C@H](CO)N(C)C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000452281369 566958296 /nfs/dbraw/zinc/95/82/96/566958296.db2.gz FFXCIEPXKNZEPF-GFCCVEGCSA-N 0 0 381.479 3.354 20 5 GGBDRN CC(C)(C)[C@H]1CCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000612164906 566958819 /nfs/dbraw/zinc/95/88/19/566958819.db2.gz IPRHDZLOPTZNIC-JTQLQIEISA-N 0 0 391.287 3.414 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(=O)n1Cc1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000471560114 566959330 /nfs/dbraw/zinc/95/93/30/566959330.db2.gz ODQYUVQDIBSGIF-UHFFFAOYSA-N 0 0 381.175 3.470 20 5 GGBDRN COc1ccccc1[C@H](CO)Nc1ncc([N+](=O)[O-])c(C)c1Br ZINC000544392864 566959308 /nfs/dbraw/zinc/95/93/08/566959308.db2.gz DDFTXZJEOKFTCF-NSHDSACASA-N 0 0 382.214 3.215 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)ncc1[N+](=O)[O-] ZINC000544393167 566959419 /nfs/dbraw/zinc/95/94/19/566959419.db2.gz XCTMJJBGRMWTOU-WDEREUQCSA-N 0 0 385.262 3.120 20 5 GGBDRN Cc1c(Br)c(NCCc2nc3ccccc3[nH]2)ncc1[N+](=O)[O-] ZINC000544394854 566959468 /nfs/dbraw/zinc/95/94/68/566959468.db2.gz UGVXUKQZEXRGPG-UHFFFAOYSA-N 0 0 376.214 3.014 20 5 GGBDRN COc1ccc2c(c1)OC[C@@H](Nc1ncc([N+](=O)[O-])c(C)c1Br)C2 ZINC000544393410 566959531 /nfs/dbraw/zinc/95/95/31/566959531.db2.gz NIQIZEZXHCRXJW-NSHDSACASA-N 0 0 394.225 3.485 20 5 GGBDRN Cc1c(Br)c(NCc2cccc(-n3ccnc3)c2)ncc1[N+](=O)[O-] ZINC000544392975 566959758 /nfs/dbraw/zinc/95/97/58/566959758.db2.gz LOBMPDVRVMQMCI-UHFFFAOYSA-N 0 0 388.225 3.280 20 5 GGBDRN COc1cccc(CCNc2ncc([N+](=O)[O-])c(C)c2Br)c1OC ZINC000544394880 566959797 /nfs/dbraw/zinc/95/97/97/566959797.db2.gz VVLYSNQGBIVIDQ-UHFFFAOYSA-N 0 0 396.241 3.154 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CC(=O)N(C3CCCCC3)C2)ncc1[N+](=O)[O-] ZINC000544393861 566959824 /nfs/dbraw/zinc/95/98/24/566959824.db2.gz DRYWEQJUDAPYNM-NSHDSACASA-N 0 0 397.273 3.406 20 5 GGBDRN CC(=O)NCc1ccc(Nc2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000544393902 566959990 /nfs/dbraw/zinc/95/99/90/566959990.db2.gz AMNQPQYOQULBAC-UHFFFAOYSA-N 0 0 379.214 3.440 20 5 GGBDRN Cc1c(Br)c(NC[C@H](CCO)c2ccccc2)ncc1[N+](=O)[O-] ZINC000544394819 566960030 /nfs/dbraw/zinc/96/00/30/566960030.db2.gz QWAZJIGKWLGXFI-ZDUSSCGKSA-N 0 0 380.242 3.061 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(C(C)(C)c2ccccc2Br)n1 ZINC000564275002 566960373 /nfs/dbraw/zinc/96/03/73/566960373.db2.gz QXPGUHMPJDAKRD-UHFFFAOYSA-N 0 0 392.213 3.467 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@@H](C2CC2)C1 ZINC000583555722 566961347 /nfs/dbraw/zinc/96/13/47/566961347.db2.gz ZBWPXDMLMTYIHD-RFAUZJTJSA-N 0 0 383.242 3.305 20 5 GGBDRN O=C(CSc1nnc2ccc(Br)cn21)c1ccc([N+](=O)[O-])cc1 ZINC000519715137 566961657 /nfs/dbraw/zinc/96/16/57/566961657.db2.gz WTZUEXDVMWLQJP-UHFFFAOYSA-N 0 0 393.222 3.375 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CS(=O)(=O)c3ccccc3)no2)c(Cl)c1 ZINC000564286587 566962094 /nfs/dbraw/zinc/96/20/94/566962094.db2.gz MTOLVLAANABTNX-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN COC(=O)[C@H]1CCCCCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000612320860 566965347 /nfs/dbraw/zinc/96/53/47/566965347.db2.gz GFUKPDWKPANHHY-GFCCVEGCSA-N 0 0 386.857 3.285 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCCc1ccc(CO)cc1 ZINC000612318130 566965360 /nfs/dbraw/zinc/96/53/60/566965360.db2.gz MKNCWOAGFLXJAD-UHFFFAOYSA-N 0 0 380.853 3.192 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2c(F)cc(F)c(F)c2F)c(Cl)c1 ZINC000429913600 566965767 /nfs/dbraw/zinc/96/57/67/566965767.db2.gz IBBMKZXOQVTUQW-UHFFFAOYSA-N 0 0 398.721 3.283 20 5 GGBDRN CS(=O)(=O)c1ccccc1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429944889 566969580 /nfs/dbraw/zinc/96/95/80/566969580.db2.gz OZFZUEJMIYRJOK-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN O=C(NCc1nccc(C(F)F)n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000583620726 566969789 /nfs/dbraw/zinc/96/97/89/566969789.db2.gz STXICMAHCFOAKJ-UHFFFAOYSA-N 0 0 387.140 3.015 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000429957989 566971429 /nfs/dbraw/zinc/97/14/29/566971429.db2.gz KOJMCRZIDRRRGI-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN Cc1cc(Br)ccc1OC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000583657068 566971452 /nfs/dbraw/zinc/97/14/52/566971452.db2.gz YAPALCIBQBSVDR-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCC(=O)N2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429966126 566971604 /nfs/dbraw/zinc/97/16/04/566971604.db2.gz JEVPNCXFFFSXCT-UHFFFAOYSA-N 0 0 390.193 3.494 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCN(c3ccccn3)C2)ncc1[N+](=O)[O-] ZINC000612451781 566974203 /nfs/dbraw/zinc/97/42/03/566974203.db2.gz KAKZBVDZLAWUOY-NSHDSACASA-N 0 0 378.230 3.147 20 5 GGBDRN COC(=O)c1ccc2c(c1)CN(c1ncc([N+](=O)[O-])c(C)c1Br)C2 ZINC000612444413 566974422 /nfs/dbraw/zinc/97/44/22/566974422.db2.gz RKRXFILDHIEUHZ-UHFFFAOYSA-N 0 0 392.209 3.368 20 5 GGBDRN COc1cccc2c1OC[C@@H](Nc1ncc([N+](=O)[O-])c(C)c1Br)C2 ZINC000612444738 566974534 /nfs/dbraw/zinc/97/45/34/566974534.db2.gz LPGUPGNHCFSMOC-NSHDSACASA-N 0 0 394.225 3.485 20 5 GGBDRN Cc1c(Br)c(N[C@H](C(=O)N2CCCC2)C(C)C)ncc1[N+](=O)[O-] ZINC000612447644 566975129 /nfs/dbraw/zinc/97/51/29/566975129.db2.gz CFWJQMWWIXJQQM-ZDUSSCGKSA-N 0 0 385.262 3.120 20 5 GGBDRN Cc1cc(Cc2noc(-c3c([N+](=O)[O-])cnn3C)n2)ccc1Br ZINC000564451982 566976091 /nfs/dbraw/zinc/97/60/91/566976091.db2.gz QMEHORPHGXQBFY-UHFFFAOYSA-N 0 0 378.186 3.040 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000519891680 566976986 /nfs/dbraw/zinc/97/69/86/566976986.db2.gz NHEHCOTYQJPSOQ-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000519904054 566977292 /nfs/dbraw/zinc/97/72/92/566977292.db2.gz PVKHBDHBXGOCSW-GFCCVEGCSA-N 0 0 399.222 3.063 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCCc2csc(C(C)C)n2)c1 ZINC000544664460 566977980 /nfs/dbraw/zinc/97/79/80/566977980.db2.gz FJPOECCOZRFOPW-UHFFFAOYSA-N 0 0 383.495 3.313 20 5 GGBDRN NS(=O)(=O)c1cccc(NCCc2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000544678703 566979780 /nfs/dbraw/zinc/97/97/80/566979780.db2.gz DZOUBMDIKDWXQC-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN C[C@@H]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Br)CC1(F)F ZINC000494273668 566980830 /nfs/dbraw/zinc/98/08/30/566980830.db2.gz JYRDDEODVGQCTF-SECBINFHSA-N 0 0 392.200 3.273 20 5 GGBDRN CN(Cc1ccc(Br)c(F)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000494268030 566981205 /nfs/dbraw/zinc/98/12/05/566981205.db2.gz LJHKCRFSVATVJK-UHFFFAOYSA-N 0 0 396.216 3.227 20 5 GGBDRN CC[C@@H](CNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)OC ZINC000564521072 566981359 /nfs/dbraw/zinc/98/13/59/566981359.db2.gz OPZDHWQJPXRWNI-JTQLQIEISA-N 0 0 387.223 3.242 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000583767163 566982197 /nfs/dbraw/zinc/98/21/97/566982197.db2.gz RCAPNUFZCNGJMB-ZLKJLUDKSA-N 0 0 383.242 3.209 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1c[nH]c2ncc(Br)cc12 ZINC000471871929 566982246 /nfs/dbraw/zinc/98/22/46/566982246.db2.gz NMWILZFXHAVSED-UHFFFAOYSA-N 0 0 389.209 3.206 20 5 GGBDRN COc1ccc(Cl)cc1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000520031525 566982632 /nfs/dbraw/zinc/98/26/32/566982632.db2.gz VHLNSVRZRKPQKR-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN COc1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cn2C)cc1Br ZINC000612610319 566983679 /nfs/dbraw/zinc/98/36/79/566983679.db2.gz WKBVLDAYSHIALS-VIFPVBQESA-N 0 0 382.214 3.195 20 5 GGBDRN NS(=O)(=O)c1cccc(NCc2cc(Cl)sc2Cl)c1[N+](=O)[O-] ZINC000544701213 566983784 /nfs/dbraw/zinc/98/37/84/566983784.db2.gz KUJTUKNNLHIGJZ-UHFFFAOYSA-N 0 0 382.250 3.223 20 5 GGBDRN CCc1ccc(S(=O)(=O)N[C@@H](C)CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000583809723 566985586 /nfs/dbraw/zinc/98/55/86/566985586.db2.gz AIJBMJACYYGARA-NSHDSACASA-N 0 0 382.463 3.159 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)CNc2ccccc2[N+](=O)[O-])c1 ZINC000520113270 566986489 /nfs/dbraw/zinc/98/64/89/566986489.db2.gz PWHXNKOMEARNEK-UHFFFAOYSA-N 0 0 394.225 3.094 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CS(=O)(=O)C2CCCC2)c1 ZINC000564555278 566987076 /nfs/dbraw/zinc/98/70/76/566987076.db2.gz PROMDWLDRJVAFL-UHFFFAOYSA-N 0 0 395.218 3.057 20 5 GGBDRN O=c1ccccn1CCOc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612660811 566987400 /nfs/dbraw/zinc/98/74/00/566987400.db2.gz BPNHQCZHLQIDQF-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1OCCOC[C@H]1CCCO1 ZINC000612660799 566987617 /nfs/dbraw/zinc/98/76/17/566987617.db2.gz BJWCOCDVSVEYTB-GFCCVEGCSA-N 0 0 397.225 3.480 20 5 GGBDRN Cn1nc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c2ccccc21 ZINC000612711776 566990652 /nfs/dbraw/zinc/99/06/52/566990652.db2.gz OVVXHRDFEDXYFY-UHFFFAOYSA-N 0 0 389.209 3.174 20 5 GGBDRN O=C(Nc1ccncc1Br)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494345947 566991980 /nfs/dbraw/zinc/99/19/80/566991980.db2.gz ZBZBNEATYXPIRZ-UHFFFAOYSA-N 0 0 390.115 3.445 20 5 GGBDRN CC(C)[C@H](C)N(CC(F)(F)F)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000564624173 566992549 /nfs/dbraw/zinc/99/25/49/566992549.db2.gz PJLJVZUSSLHIMJ-LBPRGKRZSA-N 0 0 382.404 3.376 20 5 GGBDRN CSCc1cccc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c1 ZINC000520255865 566993992 /nfs/dbraw/zinc/99/39/92/566993992.db2.gz KDJJXJQVCUPRGJ-UHFFFAOYSA-N 0 0 380.447 3.114 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCOC[C@@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000564658772 566996101 /nfs/dbraw/zinc/99/61/01/566996101.db2.gz LTSJGZALPLRXNC-OAHLLOKOSA-N 0 0 383.242 3.307 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H]2c3cc(Br)ccc3CC2(C)C)c1[N+](=O)[O-] ZINC000583952706 566998037 /nfs/dbraw/zinc/99/80/37/566998037.db2.gz MNDRWQZQADIGJL-AWEZNQCLSA-N 0 0 393.241 3.442 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000520347673 566998925 /nfs/dbraw/zinc/99/89/25/566998925.db2.gz XRIMPFOEZNLSOM-JKSUJKDBSA-N 0 0 391.221 3.408 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cc(Br)cnc1N ZINC000583964569 566999407 /nfs/dbraw/zinc/99/94/07/566999407.db2.gz QZUDMHDENZSQDJ-UHFFFAOYSA-N 0 0 394.229 3.049 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC(n2cc(Br)cn2)CC1 ZINC000430231534 567000533 /nfs/dbraw/zinc/00/05/33/567000533.db2.gz YTOLBJMICKCHIQ-UHFFFAOYSA-N 0 0 395.257 3.400 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1Cc2cccc(O)c2C1 ZINC000430245210 567002117 /nfs/dbraw/zinc/00/21/17/567002117.db2.gz AKBFREQOGHRNHY-LBPRGKRZSA-N 0 0 378.837 3.330 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1CN(CCO)Cc1cccc(Br)c1 ZINC000430235435 567002362 /nfs/dbraw/zinc/00/23/62/567002362.db2.gz YLMDARYCIPUYDN-UHFFFAOYSA-N 0 0 395.253 3.360 20 5 GGBDRN O=[N+]([O-])c1c[nH]c(-c2nc(-c3cccc(I)c3)no2)c1 ZINC000612886162 567002835 /nfs/dbraw/zinc/00/28/35/567002835.db2.gz UUBIUQXGHIPMMT-UHFFFAOYSA-N 0 0 382.117 3.245 20 5 GGBDRN Cc1ccc(-c2noc(CCn3cc(Br)cn3)n2)cc1[N+](=O)[O-] ZINC000612895216 567002884 /nfs/dbraw/zinc/00/28/84/567002884.db2.gz KCRNHIUFHWLWAP-UHFFFAOYSA-N 0 0 378.186 3.155 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCCC(=O)OC)C(F)F ZINC000452662446 567003311 /nfs/dbraw/zinc/00/33/11/567003311.db2.gz AKNXYEQGAQOAHE-NSHDSACASA-N 0 0 376.381 3.024 20 5 GGBDRN CC1(c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)CCOCC1 ZINC000612956184 567004189 /nfs/dbraw/zinc/00/41/89/567004189.db2.gz ZHMXVSSCIOKZTO-UHFFFAOYSA-N 0 0 382.214 3.399 20 5 GGBDRN Cc1nccc(-c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)n1 ZINC000612956181 567004789 /nfs/dbraw/zinc/00/47/89/567004789.db2.gz VCOZSZVTQIXLKS-UHFFFAOYSA-N 0 0 376.170 3.097 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC(C)(C)CC2)cc(Br)cc1[N+](=O)[O-] ZINC000430307051 567006953 /nfs/dbraw/zinc/00/69/53/567006953.db2.gz UPPHCNHWGMIWGK-UHFFFAOYSA-N 0 0 398.257 3.253 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCC2CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430308362 567007212 /nfs/dbraw/zinc/00/72/12/567007212.db2.gz SUGIKSYPSSGDPY-UHFFFAOYSA-N 0 0 398.257 3.301 20 5 GGBDRN Cc1ncsc1CCNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000452700432 567007336 /nfs/dbraw/zinc/00/73/36/567007336.db2.gz AONHNSBSSHJVJJ-UHFFFAOYSA-N 0 0 384.255 3.403 20 5 GGBDRN CC[C@@H](C)[C@H](C)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430307765 567007278 /nfs/dbraw/zinc/00/72/78/567007278.db2.gz WFWMGKHEUSKCRG-SCZZXKLOSA-N 0 0 386.246 3.155 20 5 GGBDRN CC[C@@H]1CCC[C@@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430308587 567007290 /nfs/dbraw/zinc/00/72/90/567007290.db2.gz YDNXDVBFALAHKD-PWSUYJOCSA-N 0 0 398.257 3.299 20 5 GGBDRN CC[C@H]1CCC[C@@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430308584 567007352 /nfs/dbraw/zinc/00/73/52/567007352.db2.gz YDNXDVBFALAHKD-JQWIXIFHSA-N 0 0 398.257 3.299 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3ccc(Br)cc3)no2)c1[N+](=O)[O-] ZINC000544934227 567007706 /nfs/dbraw/zinc/00/77/06/567007706.db2.gz YFSMVPXHFBOSLW-UHFFFAOYSA-N 0 0 378.186 3.040 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC3(CCC3)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430318563 567008003 /nfs/dbraw/zinc/00/80/03/567008003.db2.gz KWRIKJHAZFICAP-UHFFFAOYSA-N 0 0 396.241 3.007 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2(C)CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430312721 567008086 /nfs/dbraw/zinc/00/80/86/567008086.db2.gz CQQFVUGHIPODPS-UHFFFAOYSA-N 0 0 398.257 3.301 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430316391 567008182 /nfs/dbraw/zinc/00/81/82/567008182.db2.gz DGZLFIOQUBPTFM-SECBINFHSA-N 0 0 384.230 3.005 20 5 GGBDRN CC[C@H]1CCCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)C1 ZINC000430316245 567008220 /nfs/dbraw/zinc/00/82/20/567008220.db2.gz PCVOVENPIJXOJZ-NSHDSACASA-N 0 0 398.257 3.253 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)[C@H](C)C2CCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430314286 567008510 /nfs/dbraw/zinc/00/85/10/567008510.db2.gz JHYLOLRQDMHYPA-SNVBAGLBSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](C)C2CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430317350 567008528 /nfs/dbraw/zinc/00/85/28/567008528.db2.gz IEIUCAVKPXWVLP-SNVBAGLBSA-N 0 0 398.257 3.299 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCCC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430319048 567008587 /nfs/dbraw/zinc/00/85/87/567008587.db2.gz UYHFCXLRSKQOKU-JTQLQIEISA-N 0 0 398.257 3.395 20 5 GGBDRN CC[C@H]1C[C@@H](C)CN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430320697 567008610 /nfs/dbraw/zinc/00/86/10/567008610.db2.gz KQQFMGCZTJSJFY-SKDRFNHKSA-N 0 0 398.257 3.251 20 5 GGBDRN CCC[C@@H](C)N(C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430314237 567008796 /nfs/dbraw/zinc/00/87/96/567008796.db2.gz JANMZTMWSBCMAQ-SECBINFHSA-N 0 0 386.246 3.251 20 5 GGBDRN COc1ccc(S(=O)(=O)NCCCc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000584071381 567008896 /nfs/dbraw/zinc/00/88/96/567008896.db2.gz BLYMRADNWDZISF-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN CC[C@@H]1C[C@@H](C)CN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430320694 567008907 /nfs/dbraw/zinc/00/89/07/567008907.db2.gz KQQFMGCZTJSJFY-BXKDBHETSA-N 0 0 398.257 3.251 20 5 GGBDRN O=C(Cc1ccccc1Br)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000520510087 567009014 /nfs/dbraw/zinc/00/90/14/567009014.db2.gz AUGHBROWPAWDBB-UHFFFAOYSA-N 0 0 378.226 3.128 20 5 GGBDRN O=C(NC[C@@H]1CCOC2(CCC2)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000452728027 567009398 /nfs/dbraw/zinc/00/93/98/567009398.db2.gz FBFZIJYVJIPSBE-LLVKDONJSA-N 0 0 383.242 3.436 20 5 GGBDRN CCN(CCC1CC1)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430324155 567009650 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567014968 /nfs/dbraw/zinc/01/49/68/567014968.db2.gz YCKZLDIWVUDEKR-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](c2ccncc2)C1 ZINC000584140514 567015639 /nfs/dbraw/zinc/01/56/39/567015639.db2.gz LYSYQIZKUKMBCA-AWEZNQCLSA-N 0 0 390.237 3.311 20 5 GGBDRN O=c1[nH]cc(Br)cc1Cc1noc(-c2ccccc2[N+](=O)[O-])n1 ZINC000545052690 567017437 /nfs/dbraw/zinc/01/74/37/567017437.db2.gz QSYAQFSSBKQFOJ-UHFFFAOYSA-N 0 0 377.154 3.099 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCNc2ccccc2[N+](=O)[O-])c1Br ZINC000520712437 567020247 /nfs/dbraw/zinc/02/02/47/567020247.db2.gz CWQBMTIBKUKPTN-UHFFFAOYSA-N 0 0 396.245 3.046 20 5 GGBDRN C[C@@H](c1noc(Cn2ccc([N+](=O)[O-])n2)n1)c1ccc(Br)cc1 ZINC000545127795 567020841 /nfs/dbraw/zinc/02/08/41/567020841.db2.gz RZOBVECCHQWBJW-SECBINFHSA-N 0 0 378.186 3.137 20 5 GGBDRN Cn1c(-c2nc(Cc3ccc(Br)c(F)c3)no2)ccc1[N+](=O)[O-] ZINC000545146445 567021761 /nfs/dbraw/zinc/02/17/61/567021761.db2.gz GCFUZCUJDYUJLP-UHFFFAOYSA-N 0 0 381.161 3.476 20 5 GGBDRN O=C(NCc1ccc(Br)cc1)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000520741654 567021904 /nfs/dbraw/zinc/02/19/04/567021904.db2.gz HSKLGHDLXLYDDM-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN Cn1c(C(=O)N2CC[C@@H](c3cccc(Br)c3)C2)ccc1[N+](=O)[O-] ZINC000452841236 567022192 /nfs/dbraw/zinc/02/21/92/567022192.db2.gz HMPRMOMNUQMAKD-GFCCVEGCSA-N 0 0 378.226 3.326 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2CC(C)(C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000584208993 567022519 /nfs/dbraw/zinc/02/25/19/567022519.db2.gz RLGQGKVXCWKSAS-UHFFFAOYSA-N 0 0 398.257 3.157 20 5 GGBDRN COC(=O)CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(C)(F)F ZINC000452845451 567023161 /nfs/dbraw/zinc/02/31/61/567023161.db2.gz GITPBYPMZKQFJY-SECBINFHSA-N 0 0 376.381 3.024 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)CC2Cc3ccccc3C2)c(Cl)c1 ZINC000584260012 567025112 /nfs/dbraw/zinc/02/51/12/567025112.db2.gz MRCULQZYWGPQEE-UHFFFAOYSA-N 0 0 380.853 3.083 20 5 GGBDRN O=C(N[C@H]1CCCC[C@@H]1n1cccn1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430593909 567025804 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GGBDRN O=C(c1cscc1Br)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000584342739 567034483 /nfs/dbraw/zinc/03/44/83/567034483.db2.gz ZUKXBIFBLDIOQC-UHFFFAOYSA-N 0 0 383.223 3.322 20 5 GGBDRN CC(C)(CNS(=O)(=O)c1cccnc1[N+](=O)[O-])c1cccc(Cl)c1F ZINC000545263646 567035015 /nfs/dbraw/zinc/03/50/15/567035015.db2.gz GKDCVRPHMRGBDF-UHFFFAOYSA-N 0 0 387.820 3.038 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1ccc(Br)cc1 ZINC000521014662 567035948 /nfs/dbraw/zinc/03/59/48/567035948.db2.gz ROOUUGYIKCVTEJ-UHFFFAOYSA-N 0 0 394.225 3.236 20 5 GGBDRN CCN(Cc1ccc(Cl)s1)C(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472558899 567035994 /nfs/dbraw/zinc/03/59/94/567035994.db2.gz GBZIWBVPVCGRHB-UHFFFAOYSA-N 0 0 385.804 3.436 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCCSC(C)C)c([N+](=O)[O-])c1 ZINC000584368321 567036333 /nfs/dbraw/zinc/03/63/33/567036333.db2.gz IQHJYUFYHXDSKP-UHFFFAOYSA-N 0 0 375.516 3.179 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000521038341 567036642 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COCc1cc(Cl)cc(S(=O)(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000521121059 567041653 /nfs/dbraw/zinc/04/16/53/567041653.db2.gz ZBAORIANXYJGST-LLVKDONJSA-N 0 0 384.841 3.434 20 5 GGBDRN COC(=O)c1cccc(Br)c1Cn1cc([N+](=O)[O-])c(C2CC2)n1 ZINC000430987706 567044118 /nfs/dbraw/zinc/04/41/18/567044118.db2.gz HPXQNMROAIEDPZ-UHFFFAOYSA-N 0 0 380.198 3.266 20 5 GGBDRN CCN(Cc1ccc(Cl)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000521157117 567045197 /nfs/dbraw/zinc/04/51/97/567045197.db2.gz KHVMGVYADBKALW-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN Cc1cc(Br)ccc1S(=O)(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000472679736 567045364 /nfs/dbraw/zinc/04/53/64/567045364.db2.gz UKQHJASUCXAGPY-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN O=C(NCc1cc(Cl)sc1Cl)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472721051 567047991 /nfs/dbraw/zinc/04/79/91/567047991.db2.gz HGEABJTYQKTFBO-UHFFFAOYSA-N 0 0 392.195 3.357 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@@H]2c2ncon2)cc1[N+](=O)[O-] ZINC000565202933 567048683 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C[C@@H](Cc1ccccc1Br)Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000565274882 567053203 /nfs/dbraw/zinc/05/32/03/567053203.db2.gz IOGZOEGKIDJRIG-JTQLQIEISA-N 0 0 378.226 3.499 20 5 GGBDRN CO[C@H](c1ccccc1Cl)[C@@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000545467180 567053960 /nfs/dbraw/zinc/05/39/60/567053960.db2.gz UAPHRPOUZZLWEF-BZNIZROVSA-N 0 0 384.841 3.303 20 5 GGBDRN C[C@H]1SCCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000545469307 567054527 /nfs/dbraw/zinc/05/45/27/567054527.db2.gz OXMLVNPYVIXQLH-DYVFJYSZSA-N 0 0 378.475 3.462 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(Cc3cc(Br)ccc3C)n2)n1C ZINC000453166777 567059804 /nfs/dbraw/zinc/05/98/04/567059804.db2.gz WHVJVMAUICAKEY-UHFFFAOYSA-N 0 0 392.213 3.348 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CS(=O)(=O)c3ccc(Cl)cc3)no2)s1 ZINC000545538548 567060234 /nfs/dbraw/zinc/06/02/34/567060234.db2.gz NAKZESKQHIBJLP-UHFFFAOYSA-N 0 0 385.810 3.334 20 5 GGBDRN Cc1n[nH]c(C(=O)NCC2(c3ccc(Br)cc3)CCC2)c1[N+](=O)[O-] ZINC000521476982 567061685 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GGBDRN Cc1cc(N2CC[S@@](=O)C(C)(C)CC2)c(Br)cc1[N+](=O)[O-] ZINC000565403466 567065584 /nfs/dbraw/zinc/06/55/84/567065584.db2.gz KNANAVWWKSPFNZ-OAQYLSRUSA-N 0 0 375.288 3.403 20 5 GGBDRN COc1ccc(CNC(=O)NCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000521595932 567066554 /nfs/dbraw/zinc/06/65/54/567066554.db2.gz SNRKCFMPLLRQPN-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN NS(=O)(=O)c1ccc(F)c(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)c1 ZINC000613878904 567067843 /nfs/dbraw/zinc/06/78/43/567067843.db2.gz GHKQPROWGUXLLQ-UHFFFAOYSA-N 0 0 394.211 3.300 20 5 GGBDRN COc1cc(Br)cc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000521614628 567068368 /nfs/dbraw/zinc/06/83/68/567068368.db2.gz ZWXPKPBWWLJGHX-ZDUSSCGKSA-N 0 0 397.225 3.218 20 5 GGBDRN CCC(C)(CC)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000584758638 567069128 /nfs/dbraw/zinc/06/91/28/567069128.db2.gz XPDCKRUPUKSYIF-UHFFFAOYSA-N 0 0 386.246 3.299 20 5 GGBDRN CN1C(=O)N[C@]2(CCC[C@H]2CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)C1=O ZINC000613883801 567069307 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C[C@@H](Cc1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1)n1ccnc1 ZINC000565719191 567093513 /nfs/dbraw/zinc/09/35/13/567093513.db2.gz CVFICQXMNVJQAW-JTQLQIEISA-N 0 0 392.213 3.331 20 5 GGBDRN CN(Cc1cccc(Br)c1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000497388945 567093774 /nfs/dbraw/zinc/09/37/74/567093774.db2.gz RDISKOXXXMTUSH-UHFFFAOYSA-N 0 0 379.210 3.395 20 5 GGBDRN COc1cc(Cl)ccc1S(=O)(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000586769764 567093955 /nfs/dbraw/zinc/09/39/55/567093955.db2.gz UEHFSRCTRGUQOI-UHFFFAOYSA-N 0 0 384.841 3.120 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(Cc2ccc(F)cc2Br)CC1 ZINC000453582706 567095019 /nfs/dbraw/zinc/09/50/19/567095019.db2.gz XATCJDOAUWUNAF-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCC3(CCC3)CC2)c1 ZINC000586774380 567095804 /nfs/dbraw/zinc/09/58/04/567095804.db2.gz ZQRWZVMTNAROOW-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN COc1ccc(OCCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000431635072 567097884 /nfs/dbraw/zinc/09/78/84/567097884.db2.gz 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Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1Cc2cccc(O)c2C1 ZINC000565824022 567102670 /nfs/dbraw/zinc/10/26/70/567102670.db2.gz BKSVMZVDGZUQOE-LLVKDONJSA-N 0 0 391.221 3.269 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2C[C@@H]21 ZINC000586893347 567103169 /nfs/dbraw/zinc/10/31/69/567103169.db2.gz ZREWNSQPVHRTKI-RNCFNFMXSA-N 0 0 386.189 3.132 20 5 GGBDRN COCCc1ccnc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000587535467 567104649 /nfs/dbraw/zinc/10/46/49/567104649.db2.gz QKTVIRMUOHXGEE-UHFFFAOYSA-N 0 0 386.227 3.255 20 5 GGBDRN Cn1c2cc(NCc3ccccc3Br)c([N+](=O)[O-])cc2n(C)c1=O ZINC000587560651 567104911 /nfs/dbraw/zinc/10/49/11/567104911.db2.gz RYLCZDSNMYMKJJ-UHFFFAOYSA-N 0 0 391.225 3.160 20 5 GGBDRN Cn1cc(CN2CCCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)cn1 ZINC000587923382 567105914 /nfs/dbraw/zinc/10/59/14/567105914.db2.gz NCIAQKUNYZPDLY-UHFFFAOYSA-N 0 0 384.267 3.347 20 5 GGBDRN C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431789626 567107498 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O=[N+]([O-])c1cc2c(ncnc2NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)s1 ZINC000588026896 567109302 /nfs/dbraw/zinc/10/93/02/567109302.db2.gz UTLWBERXJGXTEH-SDBXPKJASA-N 0 0 376.360 3.495 20 5 GGBDRN CN(Cc1cccc(Br)c1)c1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497557488 567109526 /nfs/dbraw/zinc/10/95/26/567109526.db2.gz BTIVDCBAZUZBSS-UHFFFAOYSA-N 0 0 399.266 3.397 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N(C)C3CC(O)C3)cc2[N+](=O)[O-])n1 ZINC000546151119 567109637 /nfs/dbraw/zinc/10/96/37/567109637.db2.gz YHARCCVLQVRDCZ-UHFFFAOYSA-N 0 0 379.463 3.106 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2cccc(Cl)c2Cl)s1 ZINC000588068198 567110347 /nfs/dbraw/zinc/11/03/47/567110347.db2.gz HTSRQIDPHYIOIU-UHFFFAOYSA-N 0 0 396.277 3.354 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCc2cc(Cl)ccc2OC(F)F)c1 ZINC000546171166 567111480 /nfs/dbraw/zinc/11/14/80/567111480.db2.gz DROBAJBEJYZWKZ-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN Cc1cc(Cl)ccc1S(=O)(=O)NCCNc1ccsc1[N+](=O)[O-] ZINC000588081544 567112277 /nfs/dbraw/zinc/11/22/77/567112277.db2.gz VFRABZOKJSMHMZ-UHFFFAOYSA-N 0 0 375.859 3.009 20 5 GGBDRN COc1cc(S(=O)(=O)NC2(C(F)(F)F)CCCCC2)ccc1[N+](=O)[O-] ZINC000546178204 567112559 /nfs/dbraw/zinc/11/25/59/567112559.db2.gz KWJRJZDWBLHHNB-UHFFFAOYSA-N 0 0 382.360 3.147 20 5 GGBDRN CN(CCc1ccc(Br)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000546176721 567112804 /nfs/dbraw/zinc/11/28/04/567112804.db2.gz NLIFICIHBNKWAG-UHFFFAOYSA-N 0 0 399.266 3.221 20 5 GGBDRN CCO[C@H]1C[C@@](O)(CNc2ncc([N+](=O)[O-])c(C)c2Br)C1(C)C ZINC000473913564 567114814 /nfs/dbraw/zinc/11/48/14/567114814.db2.gz OTLSWPOKSSJCJL-XHDPSFHLSA-N 0 0 388.262 3.039 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2=CCCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000453803038 567115047 /nfs/dbraw/zinc/11/50/47/567115047.db2.gz XCRUMCKHDSMGBK-UHFFFAOYSA-N 0 0 396.241 3.221 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(Br)ccc1F ZINC000497678547 567115819 /nfs/dbraw/zinc/11/58/19/567115819.db2.gz XTMCCBYLROGQFS-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C1CC1)C(F)(F)F ZINC000565976080 567115942 /nfs/dbraw/zinc/11/59/42/567115942.db2.gz PGBOJMLBEMASCN-CYBMUJFWSA-N 0 0 378.372 3.404 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(-c3cc(I)c[nH]3)n2)c1 ZINC000546226113 567116260 /nfs/dbraw/zinc/11/62/60/567116260.db2.gz CBZRHPOYTFWTPW-UHFFFAOYSA-N 0 0 382.117 3.245 20 5 GGBDRN C[C@H](c1ccccc1Br)N(C)c1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000565984269 567116452 /nfs/dbraw/zinc/11/64/52/567116452.db2.gz UDLHELYXMZBMPJ-SECBINFHSA-N 0 0 379.214 3.049 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC(C)(C)[C@@H]1c1cccs1 ZINC000588146285 567117865 /nfs/dbraw/zinc/11/78/65/567117865.db2.gz GRAJKOWRIKMDJJ-HNNXBMFYSA-N 0 0 382.463 3.437 20 5 GGBDRN CCc1[nH][nH]c(=NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1Br ZINC000473956026 567118661 /nfs/dbraw/zinc/11/86/61/567118661.db2.gz BDMZFQXUOMQHFO-MRVPVSSYSA-N 0 0 399.270 3.184 20 5 GGBDRN CCc1[nH]nc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1Br ZINC000473955865 567118951 /nfs/dbraw/zinc/11/89/51/567118951.db2.gz KBHAHBZFSNZGFD-UHFFFAOYSA-N 0 0 382.218 3.084 20 5 GGBDRN CCc1[nH][nH]c(=NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1Br ZINC000473956027 567119495 /nfs/dbraw/zinc/11/94/95/567119495.db2.gz BDMZFQXUOMQHFO-QMMMGPOBSA-N 0 0 399.270 3.184 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H]1C[C@H]1c1c(F)cccc1F ZINC000522555268 567119990 /nfs/dbraw/zinc/11/99/90/567119990.db2.gz UPZPUYMZAVIPSO-SKDRFNHKSA-N 0 0 388.779 3.361 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@@H](OCC3CC3)C2)cc1[N+](=O)[O-] ZINC000614558179 567120569 /nfs/dbraw/zinc/12/05/69/567120569.db2.gz COOUFRZEPCEUEQ-CYBMUJFWSA-N 0 0 388.873 3.136 20 5 GGBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)C1 ZINC000497741081 567121819 /nfs/dbraw/zinc/12/18/19/567121819.db2.gz YPRUSBHQLODNLD-OCCSQVGLSA-N 0 0 384.523 3.473 20 5 GGBDRN COc1cc(-c2nc(-c3cncc(Br)c3)no2)ccc1[N+](=O)[O-] ZINC000546317768 567121960 /nfs/dbraw/zinc/12/19/60/567121960.db2.gz BXOBSZHUAXZANN-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](CO)c1ccccc1 ZINC000566057385 567122868 /nfs/dbraw/zinc/12/28/68/567122868.db2.gz RAXOKLCXNSBDFR-OAHLLOKOSA-N 0 0 379.210 3.129 20 5 GGBDRN C[C@@H](COCC(F)(F)F)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522640042 567123452 /nfs/dbraw/zinc/12/34/52/567123452.db2.gz QKOMRFCDALYKQW-VIFPVBQESA-N 0 0 384.738 3.101 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2)c(C)cc1Br ZINC000522629359 567123501 /nfs/dbraw/zinc/12/35/01/567123501.db2.gz ITHRJSBAWQNJEB-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000474016922 567125717 /nfs/dbraw/zinc/12/57/17/567125717.db2.gz KFDLEDDFBMRWPR-ZDUSSCGKSA-N 0 0 384.219 3.434 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCc1ccc(Br)cc1 ZINC000522715313 567126546 /nfs/dbraw/zinc/12/65/46/567126546.db2.gz DBBDEFLBILDOBV-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN Cc1c(Br)cccc1S(=O)(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000474050688 567127451 /nfs/dbraw/zinc/12/74/51/567127451.db2.gz AWWVVLFXFCZQTM-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H](OCC2CC2)C1 ZINC000614638383 567128431 /nfs/dbraw/zinc/12/84/31/567128431.db2.gz GOEJQZMEUQRMPT-OAHLLOKOSA-N 0 0 383.242 3.389 20 5 GGBDRN C[C@H](c1cnn(C)c1)c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000546445349 567128536 /nfs/dbraw/zinc/12/85/36/567128536.db2.gz NEZXWEWKMPWPGR-SECBINFHSA-N 0 0 392.213 3.216 20 5 GGBDRN CCS[C@@H]1CCCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCO)C1 ZINC000497868170 567128931 /nfs/dbraw/zinc/12/89/31/567128931.db2.gz JZCXJNLGTFFOAV-CQSZACIVSA-N 0 0 384.523 3.427 20 5 GGBDRN CCS[C@H]1CCCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCO)C1 ZINC000497868166 567129376 /nfs/dbraw/zinc/12/93/76/567129376.db2.gz JZCXJNLGTFFOAV-AWEZNQCLSA-N 0 0 384.523 3.427 20 5 GGBDRN Cc1nn(C)c(-c2nc(CCc3ccccc3Br)no2)c1[N+](=O)[O-] ZINC000546456431 567129981 /nfs/dbraw/zinc/12/99/81/567129981.db2.gz FQFXBHIVQBXPAG-UHFFFAOYSA-N 0 0 392.213 3.234 20 5 GGBDRN O=c1[nH]cc(Br)cc1Cc1noc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000546466841 567130390 /nfs/dbraw/zinc/13/03/90/567130390.db2.gz GKAHYYNDKPXYKF-UHFFFAOYSA-N 0 0 377.154 3.099 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1CC[C@H]2CCC[C@H]21 ZINC000614644887 567130484 /nfs/dbraw/zinc/13/04/84/567130484.db2.gz XVFJANMXWKOEIX-NOZJJQNGSA-N 0 0 386.189 3.214 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000522800555 567131731 /nfs/dbraw/zinc/13/17/31/567131731.db2.gz CVJBTCQHINDIOI-ABAIWWIYSA-N 0 0 390.889 3.368 20 5 GGBDRN O=[N+]([O-])c1cnn(Cc2nc(CCCc3ccccc3Br)no2)c1 ZINC000546487263 567132051 /nfs/dbraw/zinc/13/20/51/567132051.db2.gz IZEYHIJLIIMLKG-UHFFFAOYSA-N 0 0 392.213 3.160 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)c2cccc(F)c2F)cc1 ZINC000497936442 567133366 /nfs/dbraw/zinc/13/33/66/567133366.db2.gz IJGOXVXUCOKJOE-OAHLLOKOSA-N 0 0 386.401 3.309 20 5 GGBDRN Cc1cccc(CS(=O)(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000497941239 567133541 /nfs/dbraw/zinc/13/35/41/567133541.db2.gz XLMVFWMGXJSZNU-QGZVFWFLSA-N 0 0 378.475 3.481 20 5 GGBDRN Cc1ccccc1CS(=O)(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497949738 567135155 /nfs/dbraw/zinc/13/51/55/567135155.db2.gz KREDUGFVQZLMLF-KRWDZBQOSA-N 0 0 378.475 3.481 20 5 GGBDRN COc1ccsc1S(=O)(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497952781 567135313 /nfs/dbraw/zinc/13/53/13/567135313.db2.gz UKEXNGFHHIVVAI-CYBMUJFWSA-N 0 0 386.476 3.101 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3cc(Br)ccn3)cc2N1 ZINC000432180372 567135499 /nfs/dbraw/zinc/13/54/99/567135499.db2.gz VVXGGBFUZRSJKZ-UHFFFAOYSA-N 0 0 377.198 3.249 20 5 GGBDRN CC(C)(C)S(=O)(=O)N1CCC(Nc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432160849 567135560 /nfs/dbraw/zinc/13/55/60/567135560.db2.gz BSJBJKXKYVOWQC-UHFFFAOYSA-N 0 0 375.878 3.253 20 5 GGBDRN Cc1nc(C)c(S(=O)(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)s1 ZINC000497970981 567137269 /nfs/dbraw/zinc/13/72/69/567137269.db2.gz IQIBNBLQCRZTDQ-ZDUSSCGKSA-N 0 0 385.492 3.104 20 5 GGBDRN CSCCCNc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000522935863 567137429 /nfs/dbraw/zinc/13/74/29/567137429.db2.gz QAFFMECBBOAWDH-UHFFFAOYSA-N 0 0 387.527 3.325 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H](CO)c1ccc(Cl)cc1 ZINC000588786793 567137516 /nfs/dbraw/zinc/13/75/16/567137516.db2.gz FEJIFDRDEBADQM-CYBMUJFWSA-N 0 0 380.853 3.233 20 5 GGBDRN O=C(Nc1ncc(-c2ccc(Br)cc2)s1)c1cc([N+](=O)[O-])n[nH]1 ZINC000588781502 567137673 /nfs/dbraw/zinc/13/76/73/567137673.db2.gz SPNNBRFAHKAUOW-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN CCN1C[C@H](C)N(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000497979448 567138764 /nfs/dbraw/zinc/13/87/64/567138764.db2.gz VAOQJUXKVSFQTQ-UWVGGRQHSA-N 0 0 396.296 3.005 20 5 GGBDRN CCN1C[C@@H](C)N(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000497979449 567139306 /nfs/dbraw/zinc/13/93/06/567139306.db2.gz VAOQJUXKVSFQTQ-VHSXEESVSA-N 0 0 396.296 3.005 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000474142272 567140381 /nfs/dbraw/zinc/14/03/81/567140381.db2.gz OCMHSECGOWARPA-JTQLQIEISA-N 0 0 379.214 3.313 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)c2cc(F)cc(F)c2)cc1 ZINC000497982724 567140891 /nfs/dbraw/zinc/14/08/91/567140891.db2.gz JUQQXZMEQHKDFG-OAHLLOKOSA-N 0 0 386.401 3.309 20 5 GGBDRN CCC[C@@H]1SCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000497983008 567141149 /nfs/dbraw/zinc/14/11/49/567141149.db2.gz MKMBLBLPVGZIEW-LBPRGKRZSA-N 0 0 395.300 3.221 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000497985205 567141229 /nfs/dbraw/zinc/14/12/29/567141229.db2.gz TYTLEMIAEIZLMU-MRXNPFEDSA-N 0 0 382.438 3.479 20 5 GGBDRN CC(C)(C)OC(=O)Cc1noc(-c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000546599890 567141848 /nfs/dbraw/zinc/14/18/48/567141848.db2.gz GEYGKNUSNAHYIG-UHFFFAOYSA-N 0 0 384.186 3.292 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1nc2cc(Br)ccc2o1 ZINC000588873541 567142765 /nfs/dbraw/zinc/14/27/65/567142765.db2.gz YWABQVHSVLSGCJ-UHFFFAOYSA-N 0 0 390.193 3.357 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(c2ncc(I)cn2)C2CC2)c1 ZINC000546621901 567143388 /nfs/dbraw/zinc/14/33/88/567143388.db2.gz ORAHSMJEKATMAP-UHFFFAOYSA-N 0 0 396.188 3.158 20 5 GGBDRN COC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C)c1cccc(Cl)c1 ZINC000588910206 567144257 /nfs/dbraw/zinc/14/42/57/567144257.db2.gz PYRONFMPWQVJIO-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2(C(F)F)CCCC2)c(Br)c1 ZINC000588906214 567144823 /nfs/dbraw/zinc/14/48/23/567144823.db2.gz NLXIJHNUUTZNOT-UHFFFAOYSA-N 0 0 399.213 3.214 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCC[C@H](C3CC3)C2)c1 ZINC000588904254 567144948 /nfs/dbraw/zinc/14/49/48/567144948.db2.gz ZRBXSEYUZWSIOQ-NSHDSACASA-N 0 0 389.271 3.168 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2ccc(F)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000432309731 567148086 /nfs/dbraw/zinc/14/80/86/567148086.db2.gz YSKANUZCTMTZTI-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN O=C(NCCSc1ccccc1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000498070250 567149032 /nfs/dbraw/zinc/14/90/32/567149032.db2.gz SUAWHTMUFAAMHY-UHFFFAOYSA-N 0 0 378.475 3.201 20 5 GGBDRN CN(Cc1ccc(F)c(Cl)c1)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000432312594 567150354 /nfs/dbraw/zinc/15/03/54/567150354.db2.gz OTGZINVAYDSPHP-UHFFFAOYSA-N 0 0 386.832 3.392 20 5 GGBDRN C[C@H](Oc1ccc([N+](=O)[O-])c(CO)c1)C(=O)Nc1cccc(Br)c1 ZINC000432325772 567150408 /nfs/dbraw/zinc/15/04/08/567150408.db2.gz MJPQSVZYJOXBAH-JTQLQIEISA-N 0 0 395.209 3.256 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCN(CCCOCC(F)(F)F)CC1 ZINC000432339316 567151397 /nfs/dbraw/zinc/15/13/97/567151397.db2.gz YPRUZUYVGZFBPO-UHFFFAOYSA-N 0 0 381.782 3.339 20 5 GGBDRN CS(=O)(=O)N[C@H]1CCC[C@H]1CNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000566345702 567151748 /nfs/dbraw/zinc/15/17/48/567151748.db2.gz WTIWWDNLUKBLMY-KWQFWETISA-N 0 0 382.269 3.031 20 5 GGBDRN CN(Cc1ccc(F)c(Cl)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000432332986 567151634 /nfs/dbraw/zinc/15/16/34/567151634.db2.gz DZZOWFKJZHPESF-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN CS(=O)(=O)N[C@H]1CCC[C@@H]1CNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000566345701 567152448 /nfs/dbraw/zinc/15/24/48/567152448.db2.gz WTIWWDNLUKBLMY-KCJUWKMLSA-N 0 0 382.269 3.031 20 5 GGBDRN Cc1nnc([C@@H](C)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000546763362 567154928 /nfs/dbraw/zinc/15/49/28/567154928.db2.gz JFIQPIDCQYEOAS-MRVPVSSYSA-N 0 0 375.435 3.369 20 5 GGBDRN O=C(CSC[C@H]1CCCCO1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000498152171 567155211 /nfs/dbraw/zinc/15/52/11/567155211.db2.gz HQBNQAOENIYYID-NVXWUHKLSA-N 0 0 382.507 3.471 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1COc2ccc(Cl)cc21 ZINC000474296441 567156129 /nfs/dbraw/zinc/15/61/29/567156129.db2.gz WNIWLIYXTQRBQU-LLVKDONJSA-N 0 0 389.216 3.314 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCCN(CC(F)(F)F)C1 ZINC000589101627 567157892 /nfs/dbraw/zinc/15/78/92/567157892.db2.gz DLHPQILOQQQOSW-SECBINFHSA-N 0 0 383.168 3.191 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2COc3ccc(Cl)cc32)c(Cl)c1 ZINC000474300671 567158016 /nfs/dbraw/zinc/15/80/16/567158016.db2.gz DVTKMJGJNGBAQH-LBPRGKRZSA-N 0 0 389.216 3.314 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc(Br)cn2)no1 ZINC000589143731 567159127 /nfs/dbraw/zinc/15/91/27/567159127.db2.gz DISHETIFHBKRJW-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1CCOc1ccc(OC(F)(F)F)cc1 ZINC000474330383 567159413 /nfs/dbraw/zinc/15/94/13/567159413.db2.gz KHJLXWDGFYFEEJ-UHFFFAOYSA-N 0 0 378.690 3.388 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(Cc2ccc(Br)c(Cl)c2)n1 ZINC000589147844 567160603 /nfs/dbraw/zinc/16/06/03/567160603.db2.gz ZFJBNAJUTSWYEA-UHFFFAOYSA-N 0 0 398.604 3.385 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cc(Br)ccn1 ZINC000432458223 567160885 /nfs/dbraw/zinc/16/08/85/567160885.db2.gz UFKPRVWAANVQPW-UHFFFAOYSA-N 0 0 381.186 3.083 20 5 GGBDRN CNc1ccc(C(=O)NCc2ccc(OC)c(Br)c2)cc1[N+](=O)[O-] ZINC000523512451 567161303 /nfs/dbraw/zinc/16/13/03/567161303.db2.gz RZMWJJHPLLFTOE-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H](C2CC2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000566464032 567161808 /nfs/dbraw/zinc/16/18/08/567161808.db2.gz MQFPDEUWYCJTKS-CQSZACIVSA-N 0 0 385.258 3.193 20 5 GGBDRN Cc1nc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)sc1Br ZINC000454365410 567167489 /nfs/dbraw/zinc/16/74/89/567167489.db2.gz VCITVGBJSXTDTA-UHFFFAOYSA-N 0 0 399.270 3.164 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)c1 ZINC000546879324 567168418 /nfs/dbraw/zinc/16/84/18/567168418.db2.gz YDXBTGJSOHUJOE-HUUCEWRRSA-N 0 0 397.250 3.192 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)c1 ZINC000546879322 567168585 /nfs/dbraw/zinc/16/85/85/567168585.db2.gz YDXBTGJSOHUJOE-CABCVRRESA-N 0 0 397.250 3.192 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@H](CO)c2ccccc21 ZINC000498336756 567168865 /nfs/dbraw/zinc/16/88/65/567168865.db2.gz OPYQGANPIFPKGU-LLVKDONJSA-N 0 0 378.837 3.463 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@@](=O)C[C@H](C)C1 ZINC000432570323 567169230 /nfs/dbraw/zinc/16/92/30/567169230.db2.gz BBQXEEBTUOQFAV-YMXBGEKHSA-N 0 0 384.523 3.184 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@@H](CO)c2ccccc21 ZINC000498336757 567169807 /nfs/dbraw/zinc/16/98/07/567169807.db2.gz OPYQGANPIFPKGU-NSHDSACASA-N 0 0 378.837 3.463 20 5 GGBDRN Cc1nnsc1-c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000566586893 567169998 /nfs/dbraw/zinc/16/99/98/567169998.db2.gz LKQSYHXTWJUCAI-UHFFFAOYSA-N 0 0 382.199 3.158 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCc3ncsc3C2)cc1[N+](=O)[O-] ZINC000474421662 567170147 /nfs/dbraw/zinc/17/01/47/567170147.db2.gz OHBAHOHRIRXLPR-UHFFFAOYSA-N 0 0 382.239 3.321 20 5 GGBDRN O=c1nc(-c2ccc(Br)cc2)on1Cc1c(F)cccc1[N+](=O)[O-] ZINC000589270355 567171743 /nfs/dbraw/zinc/17/17/43/567171743.db2.gz NKVMSKNQCWMCJR-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN O=c1ccn(Cc2nc(Cc3c(Cl)cccc3Cl)no2)cc1[N+](=O)[O-] ZINC000546950940 567173615 /nfs/dbraw/zinc/17/36/15/567173615.db2.gz QYAMHLHXJHJUFO-UHFFFAOYSA-N 0 0 381.175 3.085 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H]1C1CC1 ZINC000589297073 567173860 /nfs/dbraw/zinc/17/38/60/567173860.db2.gz KMBVDTCMMWPEQA-CYBMUJFWSA-N 0 0 389.271 3.166 20 5 GGBDRN O=c1ccn(Cc2nc(Cc3ccc(Cl)c(Cl)c3)no2)cc1[N+](=O)[O-] ZINC000546944239 567173903 /nfs/dbraw/zinc/17/39/03/567173903.db2.gz LBZDZTFOMZHTCP-UHFFFAOYSA-N 0 0 381.175 3.085 20 5 GGBDRN O=c1ccn(Cc2nc(Cc3ccc(Cl)cc3Cl)no2)cc1[N+](=O)[O-] ZINC000546961381 567174903 /nfs/dbraw/zinc/17/49/03/567174903.db2.gz IFAGICURUOBICM-UHFFFAOYSA-N 0 0 381.175 3.085 20 5 GGBDRN COc1ccc(C(=O)Nc2cc(C(N)=O)c(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000566632910 567175143 /nfs/dbraw/zinc/17/51/43/567175143.db2.gz LXZPUESFQOROHZ-UHFFFAOYSA-N 0 0 384.175 3.261 20 5 GGBDRN Cc1nc(CNCc2cc(I)cc([N+](=O)[O-])c2)cs1 ZINC000589309746 567175246 /nfs/dbraw/zinc/17/52/46/567175246.db2.gz KKEUSSQHFJVNAF-UHFFFAOYSA-N 0 0 389.218 3.254 20 5 GGBDRN CCS(=O)(=O)N1CCC(CNc2c(C)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000566658114 567176925 /nfs/dbraw/zinc/17/69/25/567176925.db2.gz VBGSEAGGTQJCQU-UHFFFAOYSA-N 0 0 375.878 3.030 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(Cc2cc(Br)ccc2F)no1 ZINC000546986414 567178179 /nfs/dbraw/zinc/17/81/79/567178179.db2.gz IYBPGYAHSVIOME-UHFFFAOYSA-N 0 0 396.176 3.023 20 5 GGBDRN O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000523949523 567178317 /nfs/dbraw/zinc/17/83/17/567178317.db2.gz FHMSKIKVEUFRPK-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3ccc(Br)s3)no2)c1[N+](=O)[O-] ZINC000546995942 567178892 /nfs/dbraw/zinc/17/88/92/567178892.db2.gz VSNITBMVOSVADZ-UHFFFAOYSA-N 0 0 384.215 3.102 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1cccs1 ZINC000432675471 567180854 /nfs/dbraw/zinc/18/08/54/567180854.db2.gz LFSIKICLCSMGFQ-GFCCVEGCSA-N 0 0 399.222 3.063 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1noc(-c2cncc(Br)c2)n1 ZINC000547082577 567182471 /nfs/dbraw/zinc/18/24/71/567182471.db2.gz IEJCAYNMXZYVKO-UHFFFAOYSA-N 0 0 390.197 3.457 20 5 GGBDRN CC(C)(C)NC(=O)CCNc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000524122891 567183073 /nfs/dbraw/zinc/18/30/73/567183073.db2.gz ZJCLBMSFBRRYPL-UHFFFAOYSA-N 0 0 395.257 3.044 20 5 GGBDRN Cc1sc(CNc2ncc([N+](=O)[O-])c(N)n2)nc1-c1ccc(Cl)cc1 ZINC000524123568 567183890 /nfs/dbraw/zinc/18/38/90/567183890.db2.gz OGMANLXDKPSSDG-UHFFFAOYSA-N 0 0 376.829 3.495 20 5 GGBDRN C[C@H](C[C@H]1CCOC1)Nc1ccc(I)cc1[N+](=O)[O-] ZINC000589585507 567184551 /nfs/dbraw/zinc/18/45/51/567184551.db2.gz ZKKLMVDACVPFHR-NXEZZACHSA-N 0 0 376.194 3.426 20 5 GGBDRN NC(=O)c1ccnc(N2CCC[C@@H]2c2ccccc2Br)c1[N+](=O)[O-] ZINC000589582595 567184847 /nfs/dbraw/zinc/18/48/47/567184847.db2.gz JRWCDNHCVPMAPV-CYBMUJFWSA-N 0 0 391.225 3.193 20 5 GGBDRN NC(=O)c1ccnc(N2CCc3cc(Br)c(Cl)cc32)c1[N+](=O)[O-] ZINC000589596772 567185630 /nfs/dbraw/zinc/18/56/30/567185630.db2.gz KRIVCVORFMVGCJ-UHFFFAOYSA-N 0 0 397.616 3.199 20 5 GGBDRN CC(C)c1cc(=NCc2cc(I)cc([N+](=O)[O-])c2)[nH]o1 ZINC000589596906 567185691 /nfs/dbraw/zinc/18/56/91/567185691.db2.gz LEZWFLMTRPKFHA-UHFFFAOYSA-N 0 0 387.177 3.345 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(COC3CCOCC3)n2)c(Br)c1 ZINC000547153940 567185981 /nfs/dbraw/zinc/18/59/81/567185981.db2.gz REBINSOTQXKTJT-UHFFFAOYSA-N 0 0 398.213 3.027 20 5 GGBDRN Cc1cc(-c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)n(C)n1 ZINC000547155976 567186026 /nfs/dbraw/zinc/18/60/26/567186026.db2.gz HNGNDMWMJUXFAJ-UHFFFAOYSA-N 0 0 378.186 3.040 20 5 GGBDRN Cc1nnc(CCNc2c3cc(Br)ccc3ncc2[N+](=O)[O-])s1 ZINC000589601274 567186134 /nfs/dbraw/zinc/18/61/34/567186134.db2.gz LHADGYMCKFPGTD-UHFFFAOYSA-N 0 0 394.254 3.142 20 5 GGBDRN COCc1cc(-c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)no1 ZINC000547154102 567186895 /nfs/dbraw/zinc/18/68/95/567186895.db2.gz BUQJNYITJWIFAQ-UHFFFAOYSA-N 0 0 395.169 3.133 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCCN2c3ccccc3C[C@H]2C1 ZINC000589604376 567187263 /nfs/dbraw/zinc/18/72/63/567187263.db2.gz YHZDRYGUWIHZGB-AWEZNQCLSA-N 0 0 389.253 3.394 20 5 GGBDRN CC[C@H](NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)[C@H](O)C(F)(F)F ZINC000498574247 567188052 /nfs/dbraw/zinc/18/80/52/567188052.db2.gz XNAQZDPOSGVUIL-ONGXEEELSA-N 0 0 399.163 3.097 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000474664593 567188381 /nfs/dbraw/zinc/18/83/81/567188381.db2.gz UOLYAKBYTYRAIO-JTQLQIEISA-N 0 0 393.610 3.157 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000474664594 567188415 /nfs/dbraw/zinc/18/84/15/567188415.db2.gz UOLYAKBYTYRAIO-SNVBAGLBSA-N 0 0 393.610 3.157 20 5 GGBDRN Cc1nc(CNC(=O)NCCc2ccccc2[N+](=O)[O-])sc1Br ZINC000454607386 567188761 /nfs/dbraw/zinc/18/87/61/567188761.db2.gz YKWNQZZIBGPWDS-UHFFFAOYSA-N 0 0 399.270 3.164 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](c1cccs1)C(C)(C)CO ZINC000566765438 567188981 /nfs/dbraw/zinc/18/89/81/567188981.db2.gz CENQGCNQJODQEY-HNNXBMFYSA-N 0 0 384.479 3.003 20 5 GGBDRN Cc1cc([C@@H](C)NC(=O)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c(C)s1 ZINC000454644561 567189483 /nfs/dbraw/zinc/18/94/83/567189483.db2.gz GSLCBMGVXJEXFG-SNVBAGLBSA-N 0 0 382.463 3.168 20 5 GGBDRN Cc1c(Cc2noc(-c3c[nH]c(=O)c(Br)c3)n2)cccc1[N+](=O)[O-] ZINC000547190708 567189977 /nfs/dbraw/zinc/18/99/77/567189977.db2.gz XNTPNULYXUZTTF-UHFFFAOYSA-N 0 0 391.181 3.407 20 5 GGBDRN Cc1ccn2cc(CNC(=O)c3ccc([N+](=O)[O-])cc3Br)nc2c1 ZINC000524255317 567190512 /nfs/dbraw/zinc/19/05/12/567190512.db2.gz SRWKOFKRCUDWEA-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCOc2cccc(Br)c2)cc1 ZINC000498594152 567191041 /nfs/dbraw/zinc/19/10/41/567191041.db2.gz WHLSUCWZXWGGNE-UHFFFAOYSA-N 0 0 386.223 3.210 20 5 GGBDRN CCOc1ccccc1CCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000524312930 567191612 /nfs/dbraw/zinc/19/16/12/567191612.db2.gz RNJIWVVTIRHNKO-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN Cn1ncc2ccc(CNC(=O)c3cc(Br)cc([N+](=O)[O-])c3)cc21 ZINC000589715959 567192303 /nfs/dbraw/zinc/19/23/03/567192303.db2.gz QFHXRDPXPIODBS-UHFFFAOYSA-N 0 0 389.209 3.174 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCOc2ccc(Br)cc2)cc1 ZINC000498639773 567193157 /nfs/dbraw/zinc/19/31/57/567193157.db2.gz UHSPAAYHUVZBSC-UHFFFAOYSA-N 0 0 386.223 3.210 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCc3c2cccc3Br)cc1 ZINC000524335010 567193498 /nfs/dbraw/zinc/19/34/98/567193498.db2.gz WSLHIADHWGSKKE-HNNXBMFYSA-N 0 0 397.250 3.323 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H](CO)c1ccc(Cl)cc1 ZINC000589920746 567197341 /nfs/dbraw/zinc/19/73/41/567197341.db2.gz ZUOLECJWWTWHNQ-ZDUSSCGKSA-N 0 0 383.231 3.336 20 5 GGBDRN COC(=O)[C@H](CNc1ncc(Br)cc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000474772156 567198719 /nfs/dbraw/zinc/19/87/19/567198719.db2.gz DJJNVMGIIVBUFD-CYBMUJFWSA-N 0 0 394.225 3.429 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccc(SC)cc1 ZINC000524459391 567200821 /nfs/dbraw/zinc/20/08/21/567200821.db2.gz BMDKHVKGIRHVJA-CYBMUJFWSA-N 0 0 380.447 3.412 20 5 GGBDRN COc1cc(Br)cc(NC(=O)CNc2ccccc2[N+](=O)[O-])c1 ZINC000498784452 567201075 /nfs/dbraw/zinc/20/10/75/567201075.db2.gz RYBDSPLLJUHHGN-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NCc1cc(F)cc2c1OCOC2 ZINC000474792539 567201169 /nfs/dbraw/zinc/20/11/69/567201169.db2.gz SXCGORWEQINZEK-UHFFFAOYSA-N 0 0 384.161 3.370 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccc(SC)cc1 ZINC000524458854 567201553 /nfs/dbraw/zinc/20/15/53/567201553.db2.gz JYOSCTGDKKEGLU-GFCCVEGCSA-N 0 0 380.447 3.412 20 5 GGBDRN COC(=O)[C@H]1CC[C@@H](Nc2c3cc(Br)ccc3ncc2[N+](=O)[O-])C1 ZINC000432928943 567204003 /nfs/dbraw/zinc/20/40/03/567204003.db2.gz ATTXPLXYZQIWPQ-GXSJLCMTSA-N 0 0 394.225 3.081 20 5 GGBDRN Cc1ccccc1OCCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000524591958 567205068 /nfs/dbraw/zinc/20/50/68/567205068.db2.gz WLSYITCTLSTAHF-UHFFFAOYSA-N 0 0 384.841 3.304 20 5 GGBDRN O=C(NCCc1nc(-c2ccc(Cl)cc2)no1)c1csc([N+](=O)[O-])c1 ZINC000524624094 567206649 /nfs/dbraw/zinc/20/66/49/567206649.db2.gz FYTCJAQNKVMZLF-UHFFFAOYSA-N 0 0 378.797 3.332 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC(Nc2cccc(Br)c2)CC1 ZINC000432950459 567207639 /nfs/dbraw/zinc/20/76/39/567207639.db2.gz PIYRNCDEATUQSS-UHFFFAOYSA-N 0 0 393.241 3.402 20 5 GGBDRN Cc1cc(N2CCC[C@H](S(C)(=O)=O)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590140209 567210930 /nfs/dbraw/zinc/21/09/30/567210930.db2.gz RWGIFXDIWFIZRM-NSHDSACASA-N 0 0 380.388 3.326 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2cccc([N+](=O)[O-])c2OC)c1 ZINC000474961214 567214442 /nfs/dbraw/zinc/21/44/42/567214442.db2.gz FXBGSYLEKNXILP-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(Br)c(C)n2)cc1[N+](=O)[O-] ZINC000524793858 567214376 /nfs/dbraw/zinc/21/43/76/567214376.db2.gz OPEUJSFJJWQVHA-UHFFFAOYSA-N 0 0 380.198 3.251 20 5 GGBDRN Cc1cccc(NS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1Cl ZINC000524794063 567215460 /nfs/dbraw/zinc/21/54/60/567215460.db2.gz RABNMLHNOSSCGB-UHFFFAOYSA-N 0 0 384.797 3.129 20 5 GGBDRN C[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])Oc1ccc(Br)cc1 ZINC000567070308 567215632 /nfs/dbraw/zinc/21/56/32/567215632.db2.gz PHPUYCBZYWUPLG-SNVBAGLBSA-N 0 0 394.225 3.336 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000590389452 567222640 /nfs/dbraw/zinc/22/26/40/567222640.db2.gz JBCTYKJARPYNHI-AWEZNQCLSA-N 0 0 392.209 3.046 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000590390581 567222798 /nfs/dbraw/zinc/22/27/98/567222798.db2.gz QCJHUIFWNVTUST-NSHDSACASA-N 0 0 398.238 3.107 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000590389610 567222955 /nfs/dbraw/zinc/22/29/55/567222955.db2.gz BHIYFTZWXYUELK-LBPRGKRZSA-N 0 0 392.209 3.046 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000590390682 567223030 /nfs/dbraw/zinc/22/30/30/567223030.db2.gz YMLLMIHFTUIRTJ-AWEZNQCLSA-N 0 0 392.209 3.046 20 5 GGBDRN O=C(NC[C@@H]1CCCN(CC(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000590401587 567224182 /nfs/dbraw/zinc/22/41/82/567224182.db2.gz HSHMNVMOXDEKLJ-JTQLQIEISA-N 0 0 379.766 3.252 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1C[C@@H](CO)Cc2ccccc21 ZINC000590406264 567224399 /nfs/dbraw/zinc/22/43/99/567224399.db2.gz KUWLXXRFTPOQNB-NSHDSACASA-N 0 0 391.221 3.169 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc([N+](=O)[O-])o1 ZINC000475078862 567224927 /nfs/dbraw/zinc/22/49/27/567224927.db2.gz NTEKMTGOPBEXDR-SNVBAGLBSA-N 0 0 384.175 3.030 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@@](O)(C(F)(F)F)C1 ZINC000590425009 567225332 /nfs/dbraw/zinc/22/53/32/567225332.db2.gz CTSZWDMRGIVEHD-XPTSAGLGSA-N 0 0 378.372 3.283 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@](O)(C(F)(F)F)C1 ZINC000590425006 567225819 /nfs/dbraw/zinc/22/58/19/567225819.db2.gz CTSZWDMRGIVEHD-OTYXRUKQSA-N 0 0 378.372 3.283 20 5 GGBDRN O=C(N=c1cc(C2CCCC2)[nH][nH]1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000433144214 567226773 /nfs/dbraw/zinc/22/67/73/567226773.db2.gz BJJWBWADMPHFSX-UHFFFAOYSA-N 0 0 379.214 3.412 20 5 GGBDRN Cc1ccc(CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Br)nc1 ZINC000616112045 567228317 /nfs/dbraw/zinc/22/83/17/567228317.db2.gz XWJNYEPUXOCXQQ-UHFFFAOYSA-N 0 0 378.226 3.262 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@]1(CO)C[C@@H]1c1ccccc1 ZINC000567215661 567228379 /nfs/dbraw/zinc/22/83/79/567228379.db2.gz ANLJKYGELNPZFS-CJNGLKHVSA-N 0 0 378.226 3.330 20 5 GGBDRN Cc1ccc2nc(COc3ccc(Br)cc3[N+](=O)[O-])cc(=O)n2c1 ZINC000525113113 567229143 /nfs/dbraw/zinc/22/91/43/567229143.db2.gz GKGAEUVTSPOLDK-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN NC(=O)Nc1ccc(C(=O)COc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000525112907 567229496 /nfs/dbraw/zinc/22/94/96/567229496.db2.gz XYTQSCGYQCGAIP-UHFFFAOYSA-N 0 0 394.181 3.110 20 5 GGBDRN COCCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433187507 567229752 /nfs/dbraw/zinc/22/97/52/567229752.db2.gz AKJPUUQUKXJDNQ-ZDUSSCGKSA-N 0 0 387.889 3.031 20 5 GGBDRN Cc1ccc(Cl)cc1N(C)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000590518608 567230582 /nfs/dbraw/zinc/23/05/82/567230582.db2.gz YJBGTZPVHWPVAQ-UHFFFAOYSA-N 0 0 382.825 3.237 20 5 GGBDRN COC(=O)c1ccnc(N(C)Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000590569062 567231731 /nfs/dbraw/zinc/23/17/31/567231731.db2.gz DCIBYENIIGHVAA-UHFFFAOYSA-N 0 0 380.198 3.175 20 5 GGBDRN O=[N+]([O-])c1cnc(NCC2CCN(CC(F)F)CC2)c(Br)c1 ZINC000590567897 567231746 /nfs/dbraw/zinc/23/17/46/567231746.db2.gz WAFRSLSILDUVTM-UHFFFAOYSA-N 0 0 379.205 3.141 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2)cc1Br ZINC000525175346 567231992 /nfs/dbraw/zinc/23/19/92/567231992.db2.gz ICBCNIJGFZGKAG-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=C(NC[C@H]1CCCN(CC(F)(F)F)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000590566564 567232518 /nfs/dbraw/zinc/23/25/18/567232518.db2.gz DFTAEGBDHDDQKW-SNVBAGLBSA-N 0 0 379.766 3.252 20 5 GGBDRN CN(Cc1ccc(Cl)c(Cl)c1)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000525184585 567232883 /nfs/dbraw/zinc/23/28/83/567232883.db2.gz CTEMBODQDAKSJO-UHFFFAOYSA-N 0 0 376.221 3.117 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1cccnc1[N+](=O)[O-])c1c(Cl)cccc1Cl ZINC000525176037 567232971 /nfs/dbraw/zinc/23/29/71/567232971.db2.gz GHMRTMSNHJKHFA-SECBINFHSA-N 0 0 390.248 3.379 20 5 GGBDRN Cn1cc(Br)c(CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)n1 ZINC000567278956 567233093 /nfs/dbraw/zinc/23/30/93/567233093.db2.gz POURYTAYCNONDG-LBPRGKRZSA-N 0 0 393.163 3.484 20 5 GGBDRN Cc1cc(S(=O)(=O)NC2(c3nccs3)CCCC2)c(F)cc1[N+](=O)[O-] ZINC000590591173 567234276 /nfs/dbraw/zinc/23/42/76/567234276.db2.gz PBGGUHLEEZDHJK-UHFFFAOYSA-N 0 0 385.442 3.247 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)NCC(C2CC2)C2CC2)c1 ZINC000525188065 567234859 /nfs/dbraw/zinc/23/48/59/567234859.db2.gz XWGNYKOUKHGJSE-UHFFFAOYSA-N 0 0 389.271 3.072 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)COc2c(Cl)cc(Cl)c3cccnc32)c1 ZINC000567291078 567234887 /nfs/dbraw/zinc/23/48/87/567234887.db2.gz VGGIDLHWIOUEHQ-JTQLQIEISA-N 0 0 383.191 3.086 20 5 GGBDRN Cc1ncc(Br)cc1NCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000590659980 567237552 /nfs/dbraw/zinc/23/75/52/567237552.db2.gz FAZRAWKWFZTERE-UHFFFAOYSA-N 0 0 380.198 3.444 20 5 GGBDRN CC[C@@H](C)CN(C)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000525242671 567237945 /nfs/dbraw/zinc/23/79/45/567237945.db2.gz NNYTWKKDNDLCMR-SECBINFHSA-N 0 0 379.276 3.332 20 5 GGBDRN Cc1nc(NC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)ccc1[N+](=O)[O-] ZINC000475304934 567239188 /nfs/dbraw/zinc/23/91/88/567239188.db2.gz TYFJESVSQSBTQP-UHFFFAOYSA-N 0 0 380.191 3.434 20 5 GGBDRN O=[N+]([O-])c1ncccc1NC[C@@H](CO)Cc1ccc(F)c(Br)c1 ZINC000590733183 567241930 /nfs/dbraw/zinc/24/19/30/567241930.db2.gz HXOVGZQLYPKVQB-NSHDSACASA-N 0 0 384.205 3.155 20 5 GGBDRN O=C(Nc1ccc(Br)c(C(F)(F)F)c1)c1c[nH]nc1[N+](=O)[O-] ZINC000547752226 567243282 /nfs/dbraw/zinc/24/32/82/567243282.db2.gz ZILWZLFFOOTHIE-UHFFFAOYSA-N 0 0 379.092 3.352 20 5 GGBDRN Cc1nc(CS(=O)(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000590762031 567244697 /nfs/dbraw/zinc/24/46/97/567244697.db2.gz QGEKYOOVCKRDGB-AWEZNQCLSA-N 0 0 381.479 3.069 20 5 GGBDRN Cc1nc(CS(=O)(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000590762032 567245006 /nfs/dbraw/zinc/24/50/06/567245006.db2.gz QGEKYOOVCKRDGB-CQSZACIVSA-N 0 0 381.479 3.069 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H]2COc3c2cccc3Cl)c1[N+](=O)[O-] ZINC000616424298 567244924 /nfs/dbraw/zinc/24/49/24/567244924.db2.gz KRSIJFGDHSKSAG-CYBMUJFWSA-N 0 0 382.825 3.277 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525386880 567246488 /nfs/dbraw/zinc/24/64/88/567246488.db2.gz NQENLAFPFLASCO-ZIAGYGMSSA-N 0 0 376.862 3.072 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525386877 567247185 /nfs/dbraw/zinc/24/71/85/567247185.db2.gz NQENLAFPFLASCO-KBPBESRZSA-N 0 0 376.862 3.072 20 5 GGBDRN NC(=O)[C@@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000475431860 567248692 /nfs/dbraw/zinc/24/86/92/567248692.db2.gz PNPSIVLYIAFYDD-RRGWEWPQSA-N 0 0 390.237 3.187 20 5 GGBDRN NC(=O)[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000475431858 567248775 /nfs/dbraw/zinc/24/87/75/567248775.db2.gz PNPSIVLYIAFYDD-IEXSPKMKSA-N 0 0 390.237 3.187 20 5 GGBDRN COc1cccc(N(C)CC(=O)Nc2ccccc2Br)c1[N+](=O)[O-] ZINC000475459106 567250064 /nfs/dbraw/zinc/25/00/64/567250064.db2.gz TZRWFWZVFOIZRM-UHFFFAOYSA-N 0 0 394.225 3.441 20 5 GGBDRN CN([C@H]1CC[C@@H](C(F)(F)F)CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000567512472 567252946 /nfs/dbraw/zinc/25/29/46/567252946.db2.gz VHXBVFGYHNXUKF-AOOOYVTPSA-N 0 0 384.351 3.476 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN(CCO)[C@@H]3CCCSC3)cs2)c1 ZINC000475514536 567254381 /nfs/dbraw/zinc/25/43/81/567254381.db2.gz QIQJCLNOKPRPEB-MRXNPFEDSA-N 0 0 379.507 3.408 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)NCC1(c2cccs2)CCCCC1 ZINC000525702370 567259879 /nfs/dbraw/zinc/25/98/79/567259879.db2.gz IKHWMTFJUDEPSE-UHFFFAOYSA-N 0 0 381.479 3.232 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)c1ccccc1SC ZINC000499641104 567263612 /nfs/dbraw/zinc/26/36/12/567263612.db2.gz KHRKEYCGAPIDBI-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(Br)cc1 ZINC000475675969 567267112 /nfs/dbraw/zinc/26/71/12/567267112.db2.gz VORSZMAOAAQSPU-MRXNPFEDSA-N 0 0 390.237 3.030 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNc1cc(N2CCSCC2)ncn1 ZINC000433757492 567270209 /nfs/dbraw/zinc/27/02/09/567270209.db2.gz JKMJUOIJFMCZIA-UHFFFAOYSA-N 0 0 379.873 3.246 20 5 GGBDRN CCSCCCNS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000499752131 567270615 /nfs/dbraw/zinc/27/06/15/567270615.db2.gz YENROOSJDABUEN-UHFFFAOYSA-N 0 0 397.316 3.087 20 5 GGBDRN C[C@@H](CNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)C(F)(F)F ZINC000475733082 567270781 /nfs/dbraw/zinc/27/07/81/567270781.db2.gz ZYRWPAXDQHYKCG-QMMMGPOBSA-N 0 0 376.722 3.404 20 5 GGBDRN CCn1ccnc1[C@@H](C)NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000455402769 567271445 /nfs/dbraw/zinc/27/14/45/567271445.db2.gz OSPDJIKFXKETNE-SECBINFHSA-N 0 0 382.218 3.456 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000433792790 567271727 /nfs/dbraw/zinc/27/17/27/567271727.db2.gz PFHBSFYMTHXZDN-UFBFGSQYSA-N 0 0 383.164 3.497 20 5 GGBDRN Cc1c(Br)c(N2CCC[C@H]([C@H](O)C(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000433790237 567272168 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/nfs/dbraw/zinc/29/10/72/567291072.db2.gz AQYREXHMSQDHKC-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1-c1nc(Cc2nc3cc(Cl)ccc3s2)no1 ZINC000567961744 567293057 /nfs/dbraw/zinc/29/30/57/567293057.db2.gz MWPXMXIKKNYVJG-UHFFFAOYSA-N 0 0 376.785 3.232 20 5 GGBDRN Cn1cc(Br)cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1=O ZINC000434147704 567296142 /nfs/dbraw/zinc/29/61/42/567296142.db2.gz IZRDVEWYGUPBGL-UHFFFAOYSA-N 0 0 392.165 3.055 20 5 GGBDRN Nc1c(F)c(NC[C@@H](O)COc2cccc(Cl)c2Cl)ccc1[N+](=O)[O-] ZINC000476099682 567297315 /nfs/dbraw/zinc/29/73/15/567297315.db2.gz PCSLXTHMTOEBKU-MRVPVSSYSA-N 0 0 390.198 3.475 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2nc3cc(Br)ccc3[nH]2)c1[N+](=O)[O-] ZINC000434237745 567300229 /nfs/dbraw/zinc/30/02/29/567300229.db2.gz ARBMFHTXIXLUEF-UHFFFAOYSA-N 0 0 393.201 3.332 20 5 GGBDRN C[C@@H]1CCCCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000476141390 567300306 /nfs/dbraw/zinc/30/03/06/567300306.db2.gz IXAWKKAABDVFEN-SNVBAGLBSA-N 0 0 377.260 3.168 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@]2(CCCOC2)O1 ZINC000591846121 567301817 /nfs/dbraw/zinc/30/18/17/567301817.db2.gz IMFDRKWSLSHYHT-MLGOLLRUSA-N 0 0 385.258 3.127 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1C[C@@H](CO)Oc2ccccc21 ZINC000591845326 567302064 /nfs/dbraw/zinc/30/20/64/567302064.db2.gz MANXEMZKACARLH-ZDUSSCGKSA-N 0 0 379.210 3.117 20 5 GGBDRN Cn1cc(C[C@@H]2CCN(Cc3ccc(Br)cc3[N+](=O)[O-])C2)cn1 ZINC000591845193 567302232 /nfs/dbraw/zinc/30/22/32/567302232.db2.gz KQINAPYVJMGSLC-LBPRGKRZSA-N 0 0 379.258 3.155 20 5 GGBDRN C[C@@H]1OCC[C@@]12CN(Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000568080414 567302884 /nfs/dbraw/zinc/30/28/84/567302884.db2.gz FPYBFTQKHQDUHB-BFQNTYOBSA-N 0 0 385.258 3.126 20 5 GGBDRN CC(C)(C)c1cnc(NC(=O)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])s1 ZINC000455765537 567304508 /nfs/dbraw/zinc/30/45/08/567304508.db2.gz HCDSFFLXAMTBHX-UHFFFAOYSA-N 0 0 383.451 3.005 20 5 GGBDRN COc1c(C(=O)NCCc2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000476215448 567306258 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CCCCCNC(=O)C1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000500274143 567310946 /nfs/dbraw/zinc/31/09/46/567310946.db2.gz JIDWHPVIHKRBHY-UHFFFAOYSA-N 0 0 399.289 3.275 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCCc1ccn(-c2ccccc2)n1 ZINC000500264033 567311203 /nfs/dbraw/zinc/31/12/03/567311203.db2.gz YAHLCWYJUIZAPH-UHFFFAOYSA-N 0 0 388.225 3.015 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NC2(c3ccccc3Cl)CC2)cc1 ZINC000592066913 567311281 /nfs/dbraw/zinc/31/12/81/567311281.db2.gz IGUMPWVTRWHBKZ-UHFFFAOYSA-N 0 0 380.853 3.399 20 5 GGBDRN CN(C)c1nc2sc(C(=O)NCCc3ccccc3[N+](=O)[O-])cc2s1 ZINC000548418318 567314728 /nfs/dbraw/zinc/31/47/28/567314728.db2.gz GXHKWYQQINSWLP-UHFFFAOYSA-N 0 0 376.463 3.305 20 5 GGBDRN COc1ccc(Cl)cc1CS(=O)(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000500366916 567316443 /nfs/dbraw/zinc/31/64/43/567316443.db2.gz XWWZZWAKBWYOLX-NSHDSACASA-N 0 0 384.841 3.437 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1cc(F)cc(F)c1 ZINC000500378986 567317255 /nfs/dbraw/zinc/31/72/55/567317255.db2.gz MHUHWQHCOVZQDI-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1CSCc1nnnn1CC1CCOCC1 ZINC000434634511 567317499 /nfs/dbraw/zinc/31/74/99/567317499.db2.gz SFBGPCJPWZOOLG-UHFFFAOYSA-N 0 0 383.861 3.095 20 5 GGBDRN CC(C)N(Cc1ccc(Br)cc1)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000476359809 567318913 /nfs/dbraw/zinc/31/89/13/567318913.db2.gz SNHWRTBRJYAFDH-UHFFFAOYSA-N 0 0 381.230 3.142 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1cccc(Br)c1 ZINC000476366596 567319225 /nfs/dbraw/zinc/31/92/25/567319225.db2.gz WXZUPWFRFCOVDA-LBPRGKRZSA-N 0 0 379.214 3.068 20 5 GGBDRN CC(C)N(Cc1cc(Br)ccc1F)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000476370657 567319342 /nfs/dbraw/zinc/31/93/42/567319342.db2.gz TURRYYLZXDLHAF-UHFFFAOYSA-N 0 0 399.220 3.281 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)NCCc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000500402963 567319605 /nfs/dbraw/zinc/31/96/05/567319605.db2.gz YQTHWYQXIILBIE-UHFFFAOYSA-N 0 0 390.795 3.356 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000500426071 567321419 /nfs/dbraw/zinc/32/14/19/567321419.db2.gz YNTRHHHABRBYTJ-SNVBAGLBSA-N 0 0 385.239 3.397 20 5 GGBDRN O=[N+]([O-])c1ccccc1CNS(=O)(=O)c1csc(-c2ccccc2)n1 ZINC000500432468 567321434 /nfs/dbraw/zinc/32/14/34/567321434.db2.gz ZRCFPOOOVKYVHH-UHFFFAOYSA-N 0 0 375.431 3.197 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000527261013 567324870 /nfs/dbraw/zinc/32/48/70/567324870.db2.gz BFYBFUMIDQMBGA-LLVKDONJSA-N 0 0 382.825 3.358 20 5 GGBDRN O=c1c2cccc(Br)c2ncn1Cc1ccc([N+](=O)[O-])cc1F ZINC000476468261 567325878 /nfs/dbraw/zinc/32/58/78/567325878.db2.gz ROVOURUOFUEXMS-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN O=C(NC[C@@H](CO)CC1CCCC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000500523827 567328742 /nfs/dbraw/zinc/32/87/42/567328742.db2.gz BLBPBORWGYRSFM-LBPRGKRZSA-N 0 0 385.258 3.276 20 5 GGBDRN COc1cc(NC(=O)c2cccc([N+](=O)[O-])c2OC)ncc1Br ZINC000476532680 567332352 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O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12 ZINC000435223751 567350964 /nfs/dbraw/zinc/35/09/64/567350964.db2.gz BPFCDZOIMIOPBG-IAOVAPTHSA-N 0 0 378.837 3.255 20 5 GGBDRN C[C@@H](CC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)n1cc(Br)cn1 ZINC000592630209 567351892 /nfs/dbraw/zinc/35/18/92/567351892.db2.gz IZWJCGBNLDQNIR-LBPRGKRZSA-N 0 0 395.257 3.206 20 5 GGBDRN CCc1noc(C)c1CNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000500911980 567352509 /nfs/dbraw/zinc/35/25/09/567352509.db2.gz CMVMZYWVPCTFEA-UHFFFAOYSA-N 0 0 382.214 3.455 20 5 GGBDRN CC(C)N(Cc1cccc(Br)c1)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000500900028 567352890 /nfs/dbraw/zinc/35/28/90/567352890.db2.gz QLGFWZJDMRQLON-UHFFFAOYSA-N 0 0 381.230 3.142 20 5 GGBDRN Cc1sc(CNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])nc1C(C)C ZINC000500915371 567353401 /nfs/dbraw/zinc/35/34/01/567353401.db2.gz RWWKJKQUOKIYQP-UHFFFAOYSA-N 0 0 383.495 3.145 20 5 GGBDRN CC[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C(=O)NCc1cccs1 ZINC000592693300 567355149 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Cc1c(NC(=O)N[C@H]2CCO[C@@H]2C2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435331358 567358237 /nfs/dbraw/zinc/35/82/37/567358237.db2.gz GGHQKTGUIVTURW-SMDDNHRTSA-N 0 0 384.230 3.355 20 5 GGBDRN C[C@H]1CC2(CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-])CCOCC2 ZINC000592722723 567358556 /nfs/dbraw/zinc/35/85/56/567358556.db2.gz WQVDMUDFVJBJMR-NSHDSACASA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(Nc1cc(N2CCOCC2)ccc1Br)c1ccc([N+](=O)[O-])o1 ZINC000456285288 567359226 /nfs/dbraw/zinc/35/92/26/567359226.db2.gz DSCGDLQRLBDHOK-UHFFFAOYSA-N 0 0 396.197 3.039 20 5 GGBDRN O=C(Nc1ccnn1Cc1cccc(Cl)c1Cl)c1c[nH]nc1[N+](=O)[O-] ZINC000548943357 567361228 /nfs/dbraw/zinc/36/12/28/567361228.db2.gz QLCGOGPAWGAEHQ-UHFFFAOYSA-N 0 0 381.179 3.122 20 5 GGBDRN Cc1cc(NC(=O)CNCc2ccccc2[N+](=O)[O-])ccc1Br ZINC000568899818 567364974 /nfs/dbraw/zinc/36/49/74/567364974.db2.gz WGFMFJSKWFIINC-UHFFFAOYSA-N 0 0 378.226 3.394 20 5 GGBDRN O=C(N[C@@H]1CCc2cc(O)ccc2C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000618250377 567365476 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Cc1cc(CNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)nc(C)n1 ZINC000501121918 567367738 /nfs/dbraw/zinc/36/77/38/567367738.db2.gz ZILNCFIRRXGZMP-UHFFFAOYSA-N 0 0 380.202 3.086 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000501154724 567369689 /nfs/dbraw/zinc/36/96/89/567369689.db2.gz LFABLZGHLOPZPW-VHSXEESVSA-N 0 0 377.260 3.024 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000501154725 567370022 /nfs/dbraw/zinc/37/00/22/567370022.db2.gz LFABLZGHLOPZPW-ZJUUUORDSA-N 0 0 377.260 3.024 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(Br)c2cccnc12 ZINC000549058004 567370713 /nfs/dbraw/zinc/37/07/13/567370713.db2.gz JPOALAHBGWRMCE-UHFFFAOYSA-N 0 0 375.182 3.496 20 5 GGBDRN Cc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)nnn1C ZINC000435448220 567371434 /nfs/dbraw/zinc/37/14/34/567371434.db2.gz UHETTZULHSYBLA-UHFFFAOYSA-N 0 0 375.435 3.497 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1c(F)ccc(Br)c1F ZINC000435494640 567372344 /nfs/dbraw/zinc/37/23/44/567372344.db2.gz BBIVWAIVZNZJLB-UHFFFAOYSA-N 0 0 396.147 3.394 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1ccc(I)c(Cl)c1 ZINC000435483496 567372460 /nfs/dbraw/zinc/37/24/60/567372460.db2.gz RUJLQQZCKZJNBI-UHFFFAOYSA-N 0 0 390.564 3.063 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCC(C)(C)c2cccs2)c([N+](=O)[O-])c1 ZINC000477128725 567372495 /nfs/dbraw/zinc/37/24/95/567372495.db2.gz QIXGNZFAXPUVKA-UHFFFAOYSA-N 0 0 383.495 3.296 20 5 GGBDRN COc1cc(OC)cc(OCCNc2ncc(Br)cc2[N+](=O)[O-])c1 ZINC000477135384 567373900 /nfs/dbraw/zinc/37/39/00/567373900.db2.gz JKFDHBZOCXCPFR-UHFFFAOYSA-N 0 0 398.213 3.260 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2cccc(OC)c2[N+](=O)[O-])c1 ZINC000435559831 567375808 /nfs/dbraw/zinc/37/58/08/567375808.db2.gz JVYZEJWVYKRIFI-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN Cc1nc(-c2ccc(CNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)o2)cs1 ZINC000477158066 567376177 /nfs/dbraw/zinc/37/61/77/567376177.db2.gz DSBFNSCDSJVKNB-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN Cc1nc(-c2ccc(CNS(=O)(=O)c3ccccc3[N+](=O)[O-])o2)cs1 ZINC000477165153 567376539 /nfs/dbraw/zinc/37/65/39/567376539.db2.gz PKGSLLGAUXLYTN-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN O=C(N[C@@H](c1ccc(Br)cc1)C1CCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000549176627 567377344 /nfs/dbraw/zinc/37/73/44/567377344.db2.gz OUHTXYXIROZZBW-CYBMUJFWSA-N 0 0 379.214 3.352 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CC(=O)Nc2ccccc21 ZINC000501291524 567377965 /nfs/dbraw/zinc/37/79/65/567377965.db2.gz JIMBCVNSYHEWAR-CYBMUJFWSA-N 0 0 390.193 3.422 20 5 GGBDRN CC1(c2cccc(Br)c2)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 ZINC000549197089 567378591 /nfs/dbraw/zinc/37/85/91/567378591.db2.gz NIMVBHODVWTPRL-UHFFFAOYSA-N 0 0 393.241 3.274 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000435603974 567378680 /nfs/dbraw/zinc/37/86/80/567378680.db2.gz MWIQCBKUXVDDBY-UONOGXRCSA-N 0 0 382.825 3.091 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000435604188 567378687 /nfs/dbraw/zinc/37/86/87/567378687.db2.gz CDSIUICAMCDZBD-GZMMTYOYSA-N 0 0 392.380 3.216 20 5 GGBDRN O=C(N[C@@H]1COc2cc(F)c(Br)cc21)c1ccccc1[N+](=O)[O-] ZINC000501296378 567378853 /nfs/dbraw/zinc/37/88/53/567378853.db2.gz SMPRXMQXQNLJQI-GFCCVEGCSA-N 0 0 381.157 3.360 20 5 GGBDRN Cc1cccc(CCCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000569097870 567379345 /nfs/dbraw/zinc/37/93/45/567379345.db2.gz DJDOKTPCJFSDNU-UHFFFAOYSA-N 0 0 378.226 3.423 20 5 GGBDRN CCC[C@]1(CO)CCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000549199445 567379760 /nfs/dbraw/zinc/37/97/60/567379760.db2.gz FLLMATYCMLVXQA-AWEZNQCLSA-N 0 0 390.221 3.188 20 5 GGBDRN CCC[C@@]1(CO)CCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000549199446 567379833 /nfs/dbraw/zinc/37/98/33/567379833.db2.gz FLLMATYCMLVXQA-CQSZACIVSA-N 0 0 390.221 3.188 20 5 GGBDRN O=C(N[C@H]1COc2cc(F)c(Br)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000501324086 567381647 /nfs/dbraw/zinc/38/16/47/567381647.db2.gz OQERPEBRZJLEQQ-ZDUSSCGKSA-N 0 0 381.157 3.360 20 5 GGBDRN O=C(N[C@H]1COc2cc(F)c(Br)cc21)c1csc([N+](=O)[O-])c1 ZINC000501362865 567383194 /nfs/dbraw/zinc/38/31/94/567383194.db2.gz QFAPAYVVXWOQNO-JTQLQIEISA-N 0 0 387.186 3.421 20 5 GGBDRN NS(=O)(=O)c1c(N[C@H]2C[C@H](c3ccccc3Cl)C2)cccc1[N+](=O)[O-] ZINC000549297260 567383845 /nfs/dbraw/zinc/38/38/45/567383845.db2.gz RAEQMBYJMUXQEM-XYPYZODXSA-N 0 0 381.841 3.254 20 5 GGBDRN COC(=O)c1ccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)nc1 ZINC000549306351 567385686 /nfs/dbraw/zinc/38/56/86/567385686.db2.gz JPPJUBFFANJTBF-UHFFFAOYSA-N 0 0 394.181 3.100 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccccc1Br ZINC000618382376 567386316 /nfs/dbraw/zinc/38/63/16/567386316.db2.gz WYCDNVYXVZISHB-ZDUSSCGKSA-N 0 0 392.209 3.435 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(CCCc2cccc(Br)c2)n1 ZINC000618418154 567387995 /nfs/dbraw/zinc/38/79/95/567387995.db2.gz YZDDELHCNHPZHF-UHFFFAOYSA-N 0 0 392.213 3.316 20 5 GGBDRN NC(=O)c1ccc(CNc2cc(F)c(F)cc2Br)c([N+](=O)[O-])c1 ZINC000435808286 567390688 /nfs/dbraw/zinc/39/06/88/567390688.db2.gz LIEDMAQYPQAVPB-UHFFFAOYSA-N 0 0 386.152 3.347 20 5 GGBDRN Cc1csc([C@@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C(F)(F)F)n1 ZINC000593167211 567392552 /nfs/dbraw/zinc/39/25/52/567392552.db2.gz HSYOKJOFIZOYSG-GFCCVEGCSA-N 0 0 377.319 3.461 20 5 GGBDRN O=c1c(Br)cn(Cc2cc(-c3ccccc3)no2)cc1[N+](=O)[O-] ZINC000477420885 567394072 /nfs/dbraw/zinc/39/40/72/567394072.db2.gz GHSMAGZBNNUMKU-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CC3(C2)CCCCC3)c1 ZINC000549478026 567394365 /nfs/dbraw/zinc/39/43/65/567394365.db2.gz ZRGVZJFMKIRWJA-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N(CCO)CC(F)F)cc1[N+](=O)[O-] ZINC000477446563 567394863 /nfs/dbraw/zinc/39/48/63/567394863.db2.gz VRQSAUONGPVIAD-UHFFFAOYSA-N 0 0 376.425 3.433 20 5 GGBDRN CCn1cc(S(=O)(=O)N[C@@H](C)c2cc3ccccc3s2)c([N+](=O)[O-])n1 ZINC000549520284 567395007 /nfs/dbraw/zinc/39/50/07/567395007.db2.gz NJHUXEQKRHTYIF-JTQLQIEISA-N 0 0 380.451 3.065 20 5 GGBDRN O=C(NCc1cc(Br)c2c(c1)OCCO2)c1csc([N+](=O)[O-])c1 ZINC000501549767 567396742 /nfs/dbraw/zinc/39/67/42/567396742.db2.gz NVSKQRXZTBDNRT-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H](O)Cc1ccccc1Cl ZINC000477471404 567396751 /nfs/dbraw/zinc/39/67/51/567396751.db2.gz QDLKBUZVACYCFT-MRXNPFEDSA-N 0 0 383.231 3.164 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1ccc2c(n1)CCC2 ZINC000456645322 567397939 /nfs/dbraw/zinc/39/79/39/567397939.db2.gz USFXLPIQWNJBCV-UHFFFAOYSA-N 0 0 376.210 3.422 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000435976272 567398047 /nfs/dbraw/zinc/39/80/47/567398047.db2.gz XNWFPAJBUIEJQR-NSHDSACASA-N 0 0 383.177 3.197 20 5 GGBDRN Cc1cc([C@H]2CCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])ccc1Br ZINC000435977109 567398512 /nfs/dbraw/zinc/39/85/12/567398512.db2.gz ZDNSXZDKXQOCSR-GFCCVEGCSA-N 0 0 379.214 3.366 20 5 GGBDRN CN(C)c1cccnc1CNc1ccc(I)cc1[N+](=O)[O-] ZINC000549577773 567399138 /nfs/dbraw/zinc/39/91/38/567399138.db2.gz 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O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1COc2cc(F)c(Br)cc21 ZINC000501688350 567401793 /nfs/dbraw/zinc/40/17/93/567401793.db2.gz KDFQWDNVLXZHFO-AWEZNQCLSA-N 0 0 395.184 3.289 20 5 GGBDRN CC[C@@H]1CO[C@@H](CC)CN1C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000593256371 567402128 /nfs/dbraw/zinc/40/21/28/567402128.db2.gz MEIGYCBFOHKIKB-BDAKNGLRSA-N 0 0 377.260 3.448 20 5 GGBDRN CCn1cc([C@H](C)NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cn1 ZINC000456685561 567402120 /nfs/dbraw/zinc/40/21/20/567402120.db2.gz AEZSGIXUACIPAZ-JTQLQIEISA-N 0 0 381.230 3.373 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cc(Cl)c1=O)Nc1ccc(Cl)cc1Cl ZINC000477573745 567402709 /nfs/dbraw/zinc/40/27/09/567402709.db2.gz JPAPYPNFQXUMSC-UHFFFAOYSA-N 0 0 376.583 3.355 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc(Br)c(F)c2)cc1[N+](=O)[O-] ZINC000501699858 567403753 /nfs/dbraw/zinc/40/37/53/567403753.db2.gz HCFRYBXNMAJPOS-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN COc1cc(CNC(=O)c2cccc([N+](=O)[O-])c2)cc(Br)c1OC ZINC000501744241 567404877 /nfs/dbraw/zinc/40/48/77/567404877.db2.gz TUAXFVSAQGFMST-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@H]2OC(F)F)cc1SC ZINC000501783029 567406029 /nfs/dbraw/zinc/40/60/29/567406029.db2.gz BCDMVLKOINORKJ-MWLCHTKSSA-N 0 0 376.381 3.215 20 5 GGBDRN O=C(N[C@@H]1CCC[C@H]1OC(F)F)c1sc(Br)cc1[N+](=O)[O-] ZINC000501786213 567406410 /nfs/dbraw/zinc/40/64/10/567406410.db2.gz TXICEQJZCRFZHB-IYSWYEEDSA-N 0 0 385.186 3.309 20 5 GGBDRN COc1cc(CS(=O)(=O)CCC(F)(F)F)c([N+](=O)[O-])cc1OC(F)F ZINC000436110112 567406745 /nfs/dbraw/zinc/40/67/45/567406745.db2.gz ZMUGBVBGDLDJOO-UHFFFAOYSA-N 0 0 393.286 3.072 20 5 GGBDRN Cc1ccc(OC[C@H](O)COc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000549782737 567410118 /nfs/dbraw/zinc/41/01/18/567410118.db2.gz SQEZMDDGWXHZBT-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN CCn1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cn1 ZINC000456726604 567410744 /nfs/dbraw/zinc/41/07/44/567410744.db2.gz JQTURMQBQZMJRP-JTQLQIEISA-N 0 0 381.230 3.373 20 5 GGBDRN COc1c(NC(=O)c2csc([N+](=O)[O-])c2)cc(Cl)cc1C(=O)N(C)C ZINC000501903927 567412546 /nfs/dbraw/zinc/41/25/46/567412546.db2.gz MFMCZHKBYHLEGF-UHFFFAOYSA-N 0 0 383.813 3.272 20 5 GGBDRN COC(=O)c1ccc(C(=O)COc2c(Br)cccc2[N+](=O)[O-])cc1 ZINC000436210608 567413401 /nfs/dbraw/zinc/41/34/01/567413401.db2.gz OJZGICNNALXDFK-UHFFFAOYSA-N 0 0 394.177 3.406 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)NCCc1cccc(Cl)c1Cl ZINC000436198444 567413440 /nfs/dbraw/zinc/41/34/40/567413440.db2.gz PARLLJVCRLEACZ-UHFFFAOYSA-N 0 0 383.235 3.334 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCCc2nnc3n2CCCC3)c(Br)c1 ZINC000501980023 567414887 /nfs/dbraw/zinc/41/48/87/567414887.db2.gz HUZOMFIRJMBARC-UHFFFAOYSA-N 0 0 380.246 3.330 20 5 GGBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000477783116 567417552 /nfs/dbraw/zinc/41/75/52/567417552.db2.gz SFAVISSOPBFTSJ-LLVKDONJSA-N 0 0 393.241 3.066 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1noc(-c2ncccc2Br)n1 ZINC000569621440 567418043 /nfs/dbraw/zinc/41/80/43/567418043.db2.gz 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ZINC000477808004 567420816 /nfs/dbraw/zinc/42/08/16/567420816.db2.gz YVJIEMYUEUNYBL-JTQLQIEISA-N 0 0 380.198 3.009 20 5 GGBDRN C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000477806305 567420860 /nfs/dbraw/zinc/42/08/60/567420860.db2.gz LRJXIRIZTRFURD-SNVBAGLBSA-N 0 0 379.214 3.042 20 5 GGBDRN CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)c1nc2cccc(Cl)c2s1 ZINC000436391275 567421205 /nfs/dbraw/zinc/42/12/05/567421205.db2.gz YJFZNJMSDHZXSH-UHFFFAOYSA-N 0 0 379.829 3.453 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)c1nc2cccc(Cl)c2s1 ZINC000436404791 567422782 /nfs/dbraw/zinc/42/27/82/567422782.db2.gz NPDJDFKAFQMLCX-UHFFFAOYSA-N 0 0 379.829 3.416 20 5 GGBDRN CCOC(=O)Cc1cnc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])s1 ZINC000456887161 567423591 /nfs/dbraw/zinc/42/35/91/567423591.db2.gz QFSCJPYYOQQKGD-UHFFFAOYSA-N 0 0 381.435 3.131 20 5 GGBDRN O=C(Cc1ccc(Br)c(F)c1)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000502219542 567424024 /nfs/dbraw/zinc/42/40/24/567424024.db2.gz DWRLAZCCJSWGHB-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC2(CCC2)O1 ZINC000569697251 567424072 /nfs/dbraw/zinc/42/40/72/567424072.db2.gz YMYHCGVMISRIHA-LLVKDONJSA-N 0 0 383.242 3.070 20 5 GGBDRN COc1ccc(Br)c(Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)c1 ZINC000550012836 567424414 /nfs/dbraw/zinc/42/44/14/567424414.db2.gz ZOGIOVMQGBAYRV-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000436447844 567424964 /nfs/dbraw/zinc/42/49/64/567424964.db2.gz CCGNJGXBZIDODK-LLVKDONJSA-N 0 0 380.685 3.154 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000436444908 567425715 /nfs/dbraw/zinc/42/57/15/567425715.db2.gz BTBGYZYWOSCLHC-GFCCVEGCSA-N 0 0 380.685 3.004 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000436474123 567426164 /nfs/dbraw/zinc/42/61/64/567426164.db2.gz OJDHMIHJPZPHRN-SECBINFHSA-N 0 0 384.219 3.249 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000436473351 567426929 /nfs/dbraw/zinc/42/69/29/567426929.db2.gz HIDLNKYDWSMONY-SECBINFHSA-N 0 0 384.219 3.249 20 5 GGBDRN CCn1cc(CN(C(C)C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000593644669 567431651 /nfs/dbraw/zinc/43/16/51/567431651.db2.gz DOILUQFMAJQQMS-UHFFFAOYSA-N 0 0 386.861 3.064 20 5 GGBDRN Cc1n[nH]c(C(=O)N(Cc2csc(Br)c2)C2CC2)c1[N+](=O)[O-] ZINC000502432278 567434203 /nfs/dbraw/zinc/43/42/03/567434203.db2.gz DBGURKRMCBOCCM-UHFFFAOYSA-N 0 0 385.243 3.255 20 5 GGBDRN O=C(N[C@@H](CO)c1ccccc1OC(F)(F)F)c1csc([N+](=O)[O-])c1 ZINC000478111157 567436628 /nfs/dbraw/zinc/43/66/28/567436628.db2.gz JSBZWVGUPJSLDY-JTQLQIEISA-N 0 0 376.312 3.018 20 5 GGBDRN CC(C)Oc1cc(Br)cc(NC(=O)c2cc([N+](=O)[O-])nn2C)c1 ZINC000478112452 567436669 /nfs/dbraw/zinc/43/66/69/567436669.db2.gz PNJALTWVKQZBPK-UHFFFAOYSA-N 0 0 383.202 3.130 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1ccccc1CO ZINC000550270676 567436858 /nfs/dbraw/zinc/43/68/58/567436858.db2.gz DEKZHPSKNKJNLS-UHFFFAOYSA-N 0 0 379.210 3.088 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1nc2ccccc2[nH]1 ZINC000550263564 567437258 /nfs/dbraw/zinc/43/72/58/567437258.db2.gz OKYDNSVYMDFSBG-UHFFFAOYSA-N 0 0 389.209 3.472 20 5 GGBDRN C[C@H]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000478155244 567439309 /nfs/dbraw/zinc/43/93/09/567439309.db2.gz WWHABPUKQKSBIB-VHSXEESVSA-N 0 0 388.205 3.365 20 5 GGBDRN CCOC(=O)Cc1cnc(N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)s1 ZINC000457108606 567439315 /nfs/dbraw/zinc/43/93/15/567439315.db2.gz LEMXCKQRAINNPB-UHFFFAOYSA-N 0 0 383.813 3.087 20 5 GGBDRN C[C@@H]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000478155241 567439501 /nfs/dbraw/zinc/43/95/01/567439501.db2.gz WWHABPUKQKSBIB-NXEZZACHSA-N 0 0 388.205 3.365 20 5 GGBDRN Cc1ccc(CCNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cn1 ZINC000550305484 567440128 /nfs/dbraw/zinc/44/01/28/567440128.db2.gz GNXIOHSVIYMRBL-UHFFFAOYSA-N 0 0 378.226 3.342 20 5 GGBDRN O=C(NC1(c2noc(C(F)(F)F)n2)CCCC1)c1csc([N+](=O)[O-])c1 ZINC000569882657 567440686 /nfs/dbraw/zinc/44/06/86/567440686.db2.gz VSOOGCUXCKDYLC-UHFFFAOYSA-N 0 0 376.316 3.257 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C(=O)OC(C)(C)C ZINC000550321799 567441463 /nfs/dbraw/zinc/44/14/63/567441463.db2.gz GQJTWVMJTDFPHT-VIFPVBQESA-N 0 0 387.230 3.126 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC([C@@H](C)CO)CC2)cc1[N+](=O)[O-] ZINC000593830603 567442336 /nfs/dbraw/zinc/44/23/36/567442336.db2.gz PMSQVXLBEHEMKV-JTQLQIEISA-N 0 0 385.258 3.146 20 5 GGBDRN CC1(CC(F)(F)F)CN(C(=O)c2cc([N+](=O)[O-])ccc2SCCO)C1 ZINC000457130314 567443874 /nfs/dbraw/zinc/44/38/74/567443874.db2.gz YNHHVQZDFPDFHX-UHFFFAOYSA-N 0 0 378.372 3.094 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCOCC1CCCC1 ZINC000457131325 567444257 /nfs/dbraw/zinc/44/42/57/567444257.db2.gz JPVONYAZUSIYEX-UHFFFAOYSA-N 0 0 385.258 3.223 20 5 GGBDRN O=C(NC1CC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1I ZINC000593883043 567444858 /nfs/dbraw/zinc/44/48/58/567444858.db2.gz CMFKTARZVNWHJQ-UHFFFAOYSA-N 0 0 386.189 3.262 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)Cc1cccc(Br)c1)CC2 ZINC000550430985 567446796 /nfs/dbraw/zinc/44/67/96/567446796.db2.gz CUOMWONHMIEWPT-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN Cc1ccc(CCNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)nc1 ZINC000457191414 567448525 /nfs/dbraw/zinc/44/85/25/567448525.db2.gz ZOEDMSCAHQJMMR-UHFFFAOYSA-N 0 0 378.226 3.342 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000550491443 567450107 /nfs/dbraw/zinc/45/01/07/567450107.db2.gz NNZPSCSHFSJAII-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN Cc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cn2ccnc12 ZINC000502769511 567450253 /nfs/dbraw/zinc/45/02/53/567450253.db2.gz YLQOQFOUHAWZMV-UHFFFAOYSA-N 0 0 389.209 3.495 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCOc2c(Br)cccc2C1 ZINC000619419092 567451107 /nfs/dbraw/zinc/45/11/07/567451107.db2.gz DXEFLTTXGLTOPX-UHFFFAOYSA-N 0 0 377.194 3.392 20 5 GGBDRN COc1ccc(CNC(=O)c2cc(Br)ccc2O)cc1[N+](=O)[O-] ZINC000436826761 567456445 /nfs/dbraw/zinc/45/64/45/567456445.db2.gz PWVYUSQDRPIBBB-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)Cc1ccncc1 ZINC000550679172 567457058 /nfs/dbraw/zinc/45/70/58/567457058.db2.gz AHPSXGRGACBOMU-SNVBAGLBSA-N 0 0 378.226 3.422 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1cc2ccccc2s1 ZINC000619478982 567457510 /nfs/dbraw/zinc/45/75/10/567457510.db2.gz UNIUFGAGXOBFND-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN COc1ccc(C(=O)N[C@H](CO)c2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000478459047 567458448 /nfs/dbraw/zinc/45/84/48/567458448.db2.gz MKWYSNGRUGEIQN-GFCCVEGCSA-N 0 0 385.203 3.374 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCSC2(CCCCC2)C1 ZINC000619489654 567458706 /nfs/dbraw/zinc/45/87/06/567458706.db2.gz AGFSKPAJXYQEJK-UHFFFAOYSA-N 0 0 386.495 3.044 20 5 GGBDRN COc1cccc(S(=O)(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000619494397 567458752 /nfs/dbraw/zinc/45/87/52/567458752.db2.gz VQUFPACDSTYWGM-MRXNPFEDSA-N 0 0 380.447 3.040 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000619483222 567458774 /nfs/dbraw/zinc/45/87/74/567458774.db2.gz DEBYCQXXEUODIA-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)CCc1ccc(Cl)cc1 ZINC000619483723 567459086 /nfs/dbraw/zinc/45/90/86/567459086.db2.gz GKJIQGIQFKBXBT-UHFFFAOYSA-N 0 0 384.841 3.120 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCCc1ccc(Cl)cc1 ZINC000619480355 567459446 /nfs/dbraw/zinc/45/94/46/567459446.db2.gz FTWRFOFWPVAPJR-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000594114447 567459964 /nfs/dbraw/zinc/45/99/64/567459964.db2.gz GJXMISCSXRLARF-VIFPVBQESA-N 0 0 387.230 3.065 20 5 GGBDRN O=C(N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1ccc([N+](=O)[O-])o1 ZINC000478460722 567459942 /nfs/dbraw/zinc/45/99/42/567459942.db2.gz JMFOKOLOAUOMKI-SNVBAGLBSA-N 0 0 378.690 3.323 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](CO)c1c(Cl)cccc1Cl ZINC000478459900 567459958 /nfs/dbraw/zinc/45/99/58/567459958.db2.gz ZJLAUDSLQVKVAH-CYBMUJFWSA-N 0 0 385.203 3.374 20 5 GGBDRN C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H](C)S1(=O)=O ZINC000570132692 567460082 /nfs/dbraw/zinc/46/00/82/567460082.db2.gz BTDNOWYRKJRQMT-STQMWFEESA-N 0 0 380.491 3.331 20 5 GGBDRN CCN([C@H](C)Cc1ccsc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1OC ZINC000619498237 567460330 /nfs/dbraw/zinc/46/03/30/567460330.db2.gz QFQJTUYVMDRHNF-GFCCVEGCSA-N 0 0 384.479 3.307 20 5 GGBDRN CCCN(CCc1cccs1)S(=O)(=O)c1cccc([N+](=O)[O-])c1OC ZINC000619496901 567460344 /nfs/dbraw/zinc/46/03/44/567460344.db2.gz CDIWMCUNVUFMOE-UHFFFAOYSA-N 0 0 384.479 3.308 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cncc(Cl)c1Cl ZINC000619507581 567461014 /nfs/dbraw/zinc/46/10/14/567461014.db2.gz PNFCAPACVKRAQN-UHFFFAOYSA-N 0 0 378.193 3.106 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000478479173 567461160 /nfs/dbraw/zinc/46/11/60/567461160.db2.gz IQGFZUSPICKTBU-ZDUSSCGKSA-N 0 0 384.219 3.163 20 5 GGBDRN C[C@@H](CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000594125626 567461276 /nfs/dbraw/zinc/46/12/76/567461276.db2.gz PZMNSTWSFHKIRI-JTQLQIEISA-N 0 0 388.873 3.434 20 5 GGBDRN C[C@H](Cc1ccccn1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000594143102 567461574 /nfs/dbraw/zinc/46/15/74/567461574.db2.gz RAKOLNJISKSQSI-LLVKDONJSA-N 0 0 378.226 3.042 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594139595 567461583 /nfs/dbraw/zinc/46/15/83/567461583.db2.gz HVDUKNVDQILYPQ-JTQLQIEISA-N 0 0 378.226 3.422 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](CO)c1ccc(F)cc1 ZINC000550792227 567461994 /nfs/dbraw/zinc/46/19/94/567461994.db2.gz MXWSKBWKUTZLQC-OAHLLOKOSA-N 0 0 397.200 3.268 20 5 GGBDRN CCOC(=O)CCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC000594191087 567464998 /nfs/dbraw/zinc/46/49/98/567464998.db2.gz IXLAVSUGWPZMSB-UHFFFAOYSA-N 0 0 387.230 3.161 20 5 GGBDRN NC(=O)Nc1cc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)ccc1F ZINC000478535559 567465602 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COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](C)c1ccccc1SC ZINC000619681868 567473007 /nfs/dbraw/zinc/47/30/07/567473007.db2.gz MKGJHFRTHWFQNE-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN CSc1nsc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000478638688 567473274 /nfs/dbraw/zinc/47/32/74/567473274.db2.gz ZFOVNISXTWBYKR-UHFFFAOYSA-N 0 0 389.256 3.491 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1OC[C@@H](O)Cc1ccccc1 ZINC000478674376 567473822 /nfs/dbraw/zinc/47/38/22/567473822.db2.gz KUASUIYKPQTSHP-ZDUSSCGKSA-N 0 0 399.184 3.182 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC(n2cc(Cl)cn2)CC1 ZINC000503213167 567473826 /nfs/dbraw/zinc/47/38/26/567473826.db2.gz ZWEYYTONGKRUAF-UHFFFAOYSA-N 0 0 380.857 3.401 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000594420077 567474462 /nfs/dbraw/zinc/47/44/62/567474462.db2.gz IBJYOQZWRHDKQK-OCCSQVGLSA-N 0 0 376.210 3.347 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](C)c1ccccc1SC ZINC000619714657 567474584 /nfs/dbraw/zinc/47/45/84/567474584.db2.gz MKGJHFRTHWFQNE-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN CC(C)(O)CCSCC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000594463174 567476905 /nfs/dbraw/zinc/47/69/05/567476905.db2.gz IHZGJBPUCLEAIW-UHFFFAOYSA-N 0 0 377.260 3.190 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1c2cccc(Br)c2CC1(C)C ZINC000570353129 567477507 /nfs/dbraw/zinc/47/75/07/567477507.db2.gz RRIZUOZLMHVGNG-AWEZNQCLSA-N 0 0 393.241 3.144 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1S[C@H]1CCCOC1 ZINC000503275431 567478554 /nfs/dbraw/zinc/47/85/54/567478554.db2.gz NDEVPGWCRYITJQ-ZDUSSCGKSA-N 0 0 386.495 3.041 20 5 GGBDRN CC[C@@H](C)CS(=O)(=O)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000570371377 567479002 /nfs/dbraw/zinc/47/90/02/567479002.db2.gz LYZWMUROROQNBE-SECBINFHSA-N 0 0 397.234 3.160 20 5 GGBDRN COc1ccc2c(c1)CN(S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1)C2 ZINC000594480962 567480693 /nfs/dbraw/zinc/48/06/93/567480693.db2.gz WUPKWBVNYSIMQC-UHFFFAOYSA-N 0 0 382.825 3.270 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCC(CC(F)(F)F)CC2)cc1 ZINC000551128984 567481724 /nfs/dbraw/zinc/48/17/24/567481724.db2.gz XSAUVORFOQWRCB-UHFFFAOYSA-N 0 0 380.388 3.132 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCOc2ccc(Br)cc2C1 ZINC000619793667 567481671 /nfs/dbraw/zinc/48/16/71/567481671.db2.gz PHCOMWZWZFDLHJ-UHFFFAOYSA-N 0 0 381.230 3.281 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1Br ZINC000478779863 567482769 /nfs/dbraw/zinc/48/27/69/567482769.db2.gz CZJQFKQYYLXUNV-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN CCn1nc(C)c(CNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)c1C ZINC000570415615 567483680 /nfs/dbraw/zinc/48/36/80/567483680.db2.gz CKXPWASXFDQUAT-UHFFFAOYSA-N 0 0 395.257 3.429 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3ccc(Br)cc3[N+](=O)[O-])[C@H]2C1 ZINC000570427507 567485267 /nfs/dbraw/zinc/48/52/67/567485267.db2.gz NEYOWEAZTJNONC-UBHSHLNASA-N 0 0 382.258 3.416 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2csc3ccccc23)cc1 ZINC000503452810 567486151 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O=[N+]([O-])c1ccc(S(=O)(=O)NC2CCC3(CCOCC3)CC2)c(Cl)c1 ZINC000437321422 567490977 /nfs/dbraw/zinc/49/09/77/567490977.db2.gz KFFIVKCICBOFMR-UHFFFAOYSA-N 0 0 388.873 3.266 20 5 GGBDRN CNS(=O)(=O)c1ccc(NCCCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000503541589 567492804 /nfs/dbraw/zinc/49/28/04/567492804.db2.gz KXVQMEOXQPQJDH-UHFFFAOYSA-N 0 0 383.857 3.201 20 5 GGBDRN CS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2Br)s1 ZINC000503552811 567493629 /nfs/dbraw/zinc/49/36/29/567493629.db2.gz VDUGOZAYVCQLBW-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN CC(C)(C)C(C)(C)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000570534730 567494200 /nfs/dbraw/zinc/49/42/00/567494200.db2.gz VJCACWRFUSPRGW-UHFFFAOYSA-N 0 0 386.246 3.237 20 5 GGBDRN COc1ccc(S(=O)(=O)N(CC(F)(F)F)[C@@H](C)C(C)C)c([N+](=O)[O-])c1 ZINC000570570020 567495878 /nfs/dbraw/zinc/49/58/78/567495878.db2.gz JGYXNBKXHVHJMC-JTQLQIEISA-N 0 0 384.376 3.201 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H](CO)c1ccc(Br)cc1 ZINC000503610920 567496580 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388.804 3.435 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCCC[C@@H]1Cc1ccccc1Br ZINC000570824416 567516595 /nfs/dbraw/zinc/51/65/95/567516595.db2.gz YNFYZNKQCHSESJ-GFCCVEGCSA-N 0 0 393.241 3.318 20 5 GGBDRN Nc1c(C(=O)NCc2cc(Br)ccc2F)cc(F)cc1[N+](=O)[O-] ZINC000551591071 567521554 /nfs/dbraw/zinc/52/15/54/567521554.db2.gz YXFXOFZTZMACFP-UHFFFAOYSA-N 0 0 386.152 3.148 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC([C@@H]2CCCCO2)CC1 ZINC000594867890 567522127 /nfs/dbraw/zinc/52/21/27/567522127.db2.gz SWSBSCXVIXLKEC-HNNXBMFYSA-N 0 0 388.873 3.218 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC([C@@H]2CCCCO2)CC1 ZINC000594868149 567522508 /nfs/dbraw/zinc/52/25/08/567522508.db2.gz ZLEQYEMNLWDEFB-HNNXBMFYSA-N 0 0 388.873 3.218 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000594872163 567523406 /nfs/dbraw/zinc/52/34/06/567523406.db2.gz VODBFFBVQHCJKO-WFASDCNBSA-N 0 0 388.873 3.218 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ncc(Br)cn1 ZINC000570939427 567523550 /nfs/dbraw/zinc/52/35/50/567523550.db2.gz HGHSGXLQRKFYLT-LBPRGKRZSA-N 0 0 393.241 3.379 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](CO)Cc1ccccc1Br ZINC000479307808 567523697 /nfs/dbraw/zinc/52/36/97/567523697.db2.gz AWGIWOIRUQUEQH-GFCCVEGCSA-N 0 0 397.273 3.145 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1cccc(N(C)C)n1 ZINC000551607676 567523765 /nfs/dbraw/zinc/52/37/65/567523765.db2.gz VLWJSWRIYZZCCB-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](CO)Cc1ccc(Br)cc1 ZINC000479327946 567525202 /nfs/dbraw/zinc/52/52/02/567525202.db2.gz ZXZCOKAFYXFJRX-ZDUSSCGKSA-N 0 0 397.273 3.145 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](CO)Cc1cccc(Br)c1 ZINC000479321734 567525344 /nfs/dbraw/zinc/52/53/44/567525344.db2.gz UOISMBCDBWTUQX-CYBMUJFWSA-N 0 0 397.273 3.145 20 5 GGBDRN CCc1sc(-c2nc(-c3c([N+](=O)[O-])ncn3C)no2)cc1Br ZINC000570948134 567525832 /nfs/dbraw/zinc/52/58/32/567525832.db2.gz LSISGMVWWAUQNV-UHFFFAOYSA-N 0 0 384.215 3.432 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000504258716 567527149 /nfs/dbraw/zinc/52/71/49/567527149.db2.gz BJQFREDOJYIQEE-UHFFFAOYSA-N 0 0 377.154 3.483 20 5 GGBDRN O=c1[nH]c(NCc2csc(Br)c2)nc2ccc([N+](=O)[O-])cc12 ZINC000570993422 567528549 /nfs/dbraw/zinc/52/85/49/567528549.db2.gz RRDGYZXJMPYUGI-UHFFFAOYSA-N 0 0 381.211 3.102 20 5 GGBDRN C[C@@H]1CCC[C@@H](CNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000551721070 567531383 /nfs/dbraw/zinc/53/13/83/567531383.db2.gz ZEJQTNBFFVUUCE-GHMZBOCLSA-N 0 0 398.257 3.238 20 5 GGBDRN CO[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C12CCC2 ZINC000458208241 567531929 /nfs/dbraw/zinc/53/19/29/567531929.db2.gz YWLFSDAYLBILKU-UONOGXRCSA-N 0 0 383.242 3.353 20 5 GGBDRN C[C@@H](Sc1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000504383532 567532467 /nfs/dbraw/zinc/53/24/67/567532467.db2.gz ZAGAFPCLFWIJKB-LLVKDONJSA-N 0 0 380.447 3.118 20 5 GGBDRN CC1(C)CCCC[C@@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000551731120 567532421 /nfs/dbraw/zinc/53/24/21/567532421.db2.gz MHYHKWVBIARITB-ZDUSSCGKSA-N 0 0 398.257 3.381 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1ccc(S(C)(=O)=O)cc1 ZINC000504381574 567533077 /nfs/dbraw/zinc/53/30/77/567533077.db2.gz JENDEOCDWFOOJA-UHFFFAOYSA-N 0 0 380.447 3.038 20 5 GGBDRN Cc1sc(C(=O)NCC(=O)Nc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000479413325 567533159 /nfs/dbraw/zinc/53/31/59/567533159.db2.gz BIIKTWUXKZJJMO-UHFFFAOYSA-N 0 0 398.238 3.096 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCC(=O)Nc2cccc(Br)c2)c1 ZINC000479439684 567536458 /nfs/dbraw/zinc/53/64/58/567536458.db2.gz LDRGVEOUKVCELB-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN Cc1c(CN[C@@H](C(N)=O)c2ccc(Br)cc2F)cccc1[N+](=O)[O-] ZINC000479481853 567538561 /nfs/dbraw/zinc/53/85/61/567538561.db2.gz ICUIFXACUPZTQP-OAHLLOKOSA-N 0 0 396.216 3.121 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000458322028 567540011 /nfs/dbraw/zinc/54/00/11/567540011.db2.gz YBTSYABNEKIIPM-GOEBONIOSA-N 0 0 397.269 3.371 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000458314098 567540237 /nfs/dbraw/zinc/54/02/37/567540237.db2.gz OTACZCRCZOIMGP-GOEBONIOSA-N 0 0 397.269 3.371 20 5 GGBDRN C[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cc2I)CC=CCC1 ZINC000458316834 567540724 /nfs/dbraw/zinc/54/07/24/567540724.db2.gz QHLPNTPFMJLQPL-CQSZACIVSA-N 0 0 386.189 3.428 20 5 GGBDRN O=C(Nc1ccc(Br)c(C(F)(F)F)c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000504618629 567541255 /nfs/dbraw/zinc/54/12/55/567541255.db2.gz DMMNZFQTTZMMOZ-UHFFFAOYSA-N 0 0 379.092 3.352 20 5 GGBDRN CC[C@@H](C)CCNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000595116982 567542718 /nfs/dbraw/zinc/54/27/18/567542718.db2.gz AVMUEULDWWGWQB-SECBINFHSA-N 0 0 386.246 3.157 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H](CO)c1ccc(Br)cc1 ZINC000504687800 567544315 /nfs/dbraw/zinc/54/43/15/567544315.db2.gz UHMACCVZSFNIHN-CQSZACIVSA-N 0 0 380.198 3.212 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H](CO)c1ccc(Br)cc1 ZINC000504687799 567544414 /nfs/dbraw/zinc/54/44/14/567544414.db2.gz UHMACCVZSFNIHN-AWEZNQCLSA-N 0 0 380.198 3.212 20 5 GGBDRN COc1cc(C(=O)Nc2cc(Br)ccn2)cc([N+](=O)[O-])c1OC ZINC000438808617 567548121 /nfs/dbraw/zinc/54/81/21/567548121.db2.gz JPFMDQCTSMZTLG-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N(Cc1cc(Br)ccc1F)C1CC1 ZINC000504857298 567550890 /nfs/dbraw/zinc/55/08/90/567550890.db2.gz LPVWMUAVDAENEJ-UHFFFAOYSA-N 0 0 383.177 3.024 20 5 GGBDRN Cc1ccc(Br)cc1CNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000438887224 567551614 /nfs/dbraw/zinc/55/16/14/567551614.db2.gz PABPXHMXKHSSPJ-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H]1C1CC1 ZINC000571366883 567558066 /nfs/dbraw/zinc/55/80/66/567558066.db2.gz TVPIILJFVWIFKG-CYBMUJFWSA-N 0 0 389.271 3.166 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](Oc3ccccc3)C2)c(Cl)c1 ZINC000595364285 567559040 /nfs/dbraw/zinc/55/90/40/567559040.db2.gz NCBPKBRCOUMWPH-CQSZACIVSA-N 0 0 382.825 3.090 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc1Cl ZINC000438990723 567560619 /nfs/dbraw/zinc/56/06/19/567560619.db2.gz KEDJHVFNOSDNCZ-UHFFFAOYSA-N 0 0 376.221 3.430 20 5 GGBDRN CC1C[C@H]2CC[C@@H](C1)N2S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000595383484 567560892 /nfs/dbraw/zinc/56/08/92/567560892.db2.gz VTOUFMXTVWLWKL-FGWVZKOKSA-N 0 0 389.271 3.309 20 5 GGBDRN CN(Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000595393804 567560914 /nfs/dbraw/zinc/56/09/14/567560914.db2.gz ANPLMTYIACAXSV-OAHLLOKOSA-N 0 0 384.816 3.348 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N(C)CCOc1ccc(Br)cc1 ZINC000479847506 567564168 /nfs/dbraw/zinc/56/41/68/567564168.db2.gz BKHLSCQXGSIMHW-UHFFFAOYSA-N 0 0 383.246 3.397 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C1CCN(CC(F)(F)F)CC1 ZINC000505171123 567564107 /nfs/dbraw/zinc/56/41/07/567564107.db2.gz LTNWYFDAHPZLSP-UHFFFAOYSA-N 0 0 379.766 3.139 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1cc(F)c(F)cc1Br ZINC000571471824 567565447 /nfs/dbraw/zinc/56/54/47/567565447.db2.gz ZNUXHEVXGDMPNZ-UHFFFAOYSA-N 0 0 386.152 3.148 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1)c1cc([N+](=O)[O-])n[nH]1 ZINC000552188323 567565844 /nfs/dbraw/zinc/56/58/44/567565844.db2.gz PFPQQBYFCCQKPL-JTQLQIEISA-N 0 0 384.223 3.024 20 5 GGBDRN COc1ccc(S(=O)(=O)N2c3ccccc3SC[C@H]2C)cc1[N+](=O)[O-] ZINC000439141513 567567253 /nfs/dbraw/zinc/56/72/53/567567253.db2.gz NLMSZEAGNSDJME-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1ccc(F)cc1F ZINC000479914676 567568432 /nfs/dbraw/zinc/56/84/32/567568432.db2.gz JJPALRMBNLGCJJ-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN COc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1C ZINC000479951114 567571607 /nfs/dbraw/zinc/57/16/07/567571607.db2.gz UCGPUAXVWPLIIR-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CCc1[nH]nc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1Br ZINC000479981598 567572833 /nfs/dbraw/zinc/57/28/33/567572833.db2.gz DOXUJCSNFJSMQA-UHFFFAOYSA-N 0 0 392.213 3.236 20 5 GGBDRN CO[C@H](c1ccccc1Cl)[C@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000479986193 567572921 /nfs/dbraw/zinc/57/29/21/567572921.db2.gz BTQRYINNFZQBNJ-ZBEGNZNMSA-N 0 0 384.841 3.303 20 5 GGBDRN CCC1CCN(S(=O)(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CC1 ZINC000439225141 567573863 /nfs/dbraw/zinc/57/38/63/567573863.db2.gz SNMJBBNDYQVFGD-UHFFFAOYSA-N 0 0 391.287 3.476 20 5 GGBDRN Cc1cccc2c1OC[C@H](NC(=O)c1sc(Br)cc1[N+](=O)[O-])C2 ZINC000571608056 567574332 /nfs/dbraw/zinc/57/43/32/567574332.db2.gz ZLYUKDIHZJRNNT-SNVBAGLBSA-N 0 0 397.250 3.461 20 5 GGBDRN Cc1noc(C)c1[C@H](C)CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000505419949 567574670 /nfs/dbraw/zinc/57/46/70/567574670.db2.gz KBHKRISPACGEQJ-MRVPVSSYSA-N 0 0 382.214 3.496 20 5 GGBDRN CO[C@H](c1ccccc1Cl)[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000479997509 567575080 /nfs/dbraw/zinc/57/50/80/567575080.db2.gz YXKHZSNSJOWPBM-ZBEGNZNMSA-N 0 0 384.841 3.303 20 5 GGBDRN CCN(C1CCC1)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000439235333 567575291 /nfs/dbraw/zinc/57/52/91/567575291.db2.gz PXLDGRWGSVOOAR-UHFFFAOYSA-N 0 0 377.260 3.229 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N[C@H]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000439241546 567575407 /nfs/dbraw/zinc/57/54/07/567575407.db2.gz XOFAODCURNTAKW-UFBFGSQYSA-N 0 0 377.260 3.133 20 5 GGBDRN Cc1ccc(N(C)C(=O)c2cc(I)cc([N+](=O)[O-])c2)nc1 ZINC000571600200 567575358 /nfs/dbraw/zinc/57/53/58/567575358.db2.gz PKDDIYVGYFTPLM-UHFFFAOYSA-N 0 0 397.172 3.179 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c1 ZINC000439252955 567576667 /nfs/dbraw/zinc/57/66/67/567576667.db2.gz ZKLYEAWLLMUVMR-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN O=C(Nc1nc(-c2ccc(Br)cc2)cs1)c1cc([N+](=O)[O-])n[nH]1 ZINC000552329457 567577705 /nfs/dbraw/zinc/57/77/05/567577705.db2.gz NYAGYBBFRMXDIV-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(-c3nncs3)cc2)cc1[N+](=O)[O-] ZINC000439259981 567577753 /nfs/dbraw/zinc/57/77/53/567577753.db2.gz OBXVOQKRNLPHCE-UHFFFAOYSA-N 0 0 376.419 3.223 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)NC[C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000439255669 567577786 /nfs/dbraw/zinc/57/77/86/567577786.db2.gz XJENPPGANWQRFW-NSHDSACASA-N 0 0 389.271 3.300 20 5 GGBDRN COc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1 ZINC000480077128 567578748 /nfs/dbraw/zinc/57/87/48/567578748.db2.gz ZMATYYMWOVUYNZ-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN C[C@@H](Oc1ccc(Br)cc1)C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000439282419 567579150 /nfs/dbraw/zinc/57/91/50/567579150.db2.gz IHOGUZCHALNELY-SNVBAGLBSA-N 0 0 380.198 3.183 20 5 GGBDRN Cc1noc(CN2CCOC[C@@H]2c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000595750555 567579887 /nfs/dbraw/zinc/57/98/87/567579887.db2.gz UNKGMPZCCLEOBV-CYBMUJFWSA-N 0 0 382.214 3.227 20 5 GGBDRN Nc1c(C(=O)N2CCc3ccc(Br)cc3C2)cc(F)cc1[N+](=O)[O-] ZINC000552344454 567580272 /nfs/dbraw/zinc/58/02/72/567580272.db2.gz FSFULWPBIBDQDO-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](COC(F)F)C2)cc1SC ZINC000552348145 567580863 /nfs/dbraw/zinc/58/08/63/567580863.db2.gz IBZJWKOUTIDZPF-SECBINFHSA-N 0 0 376.381 3.027 20 5 GGBDRN O=C(Nc1cc(-c2cc(F)cc(Br)c2)[nH]n1)c1cc([N+](=O)[O-])c[nH]1 ZINC000571715833 567583570 /nfs/dbraw/zinc/58/35/70/567583570.db2.gz PVDZUEDSIYJWLP-UHFFFAOYSA-N 0 0 394.160 3.467 20 5 GGBDRN COC(=O)C(C)(C)C(=O)CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000505582419 567585162 /nfs/dbraw/zinc/58/51/62/567585162.db2.gz RNKBTNOZBHQEJR-UHFFFAOYSA-N 0 0 376.228 3.218 20 5 GGBDRN NS(=O)(=O)c1ccc(NCc2cc(Cl)sc2Cl)c([N+](=O)[O-])c1 ZINC000552393072 567586047 /nfs/dbraw/zinc/58/60/47/567586047.db2.gz JWJUWJVWPXRKNE-UHFFFAOYSA-N 0 0 382.250 3.223 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](CO)c1ccc(Cl)cc1 ZINC000552430293 567589664 /nfs/dbraw/zinc/58/96/64/567589664.db2.gz YXFOGHYHMANXBQ-HNNXBMFYSA-N 0 0 383.231 3.336 20 5 GGBDRN CCc1ccc(S(=O)(=O)N[C@@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000571794000 567589679 /nfs/dbraw/zinc/58/96/79/567589679.db2.gz HCBBIAOTQCWTDE-JTQLQIEISA-N 0 0 381.479 3.142 20 5 GGBDRN CCc1[nH][nH]c(=NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1Br ZINC000439510226 567590748 /nfs/dbraw/zinc/59/07/48/567590748.db2.gz LJKQYFRPDAYUJT-UHFFFAOYSA-N 0 0 381.230 3.440 20 5 GGBDRN CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000552446814 567590953 /nfs/dbraw/zinc/59/09/53/567590953.db2.gz VYSBWZSNCMQJNN-LLVKDONJSA-N 0 0 399.163 3.051 20 5 GGBDRN NS(=O)(=O)c1cc(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000439601031 567595024 /nfs/dbraw/zinc/59/50/24/567595024.db2.gz ZOFVPHAPLPKBSZ-ZJUUUORDSA-N 0 0 381.376 3.023 20 5 GGBDRN C[C@H](Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-])C(=O)NC(C)(C)C ZINC000505764197 567595972 /nfs/dbraw/zinc/59/59/72/567595972.db2.gz VRCLWWZTKYRJOT-VIFPVBQESA-N 0 0 395.257 3.043 20 5 GGBDRN C[C@@H](Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-])C(=O)NC(C)(C)C ZINC000505764196 567596040 /nfs/dbraw/zinc/59/60/40/567596040.db2.gz VRCLWWZTKYRJOT-SECBINFHSA-N 0 0 395.257 3.043 20 5 GGBDRN Cc1noc(CS(=O)(=O)[C@@H](C)c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000596019419 567599121 /nfs/dbraw/zinc/59/91/21/567599121.db2.gz FYEHECHIPOAKQZ-VIFPVBQESA-N 0 0 389.227 3.330 20 5 GGBDRN C[C@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccc(Br)cc1F ZINC000571933615 567599655 /nfs/dbraw/zinc/59/96/55/567599655.db2.gz CNSHFGSGJACWHB-ZETCQYMHSA-N 0 0 384.161 3.088 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cc2c(c(Br)c1)OCO2 ZINC000552649810 567600544 /nfs/dbraw/zinc/60/05/44/567600544.db2.gz QQYLEDKTTPUEII-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc(CO)cs1 ZINC000505875527 567600667 /nfs/dbraw/zinc/60/06/67/567600667.db2.gz XOKQRNNRFSHFAA-UHFFFAOYSA-N 0 0 381.479 3.222 20 5 GGBDRN COc1ccc(I)c(NCc2onc(C)c2[N+](=O)[O-])c1 ZINC000596031214 567600640 /nfs/dbraw/zinc/60/06/40/567600640.db2.gz CEYNBDSOQDYJDB-UHFFFAOYSA-N 0 0 389.149 3.117 20 5 GGBDRN COC1CCC(C)(CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000480395699 567601674 /nfs/dbraw/zinc/60/16/74/567601674.db2.gz LAHCPVLRDJMGHV-UHFFFAOYSA-N 0 0 376.862 3.122 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCCC3(CCC3)C2)c1 ZINC000480394654 567601699 /nfs/dbraw/zinc/60/16/99/567601699.db2.gz JDARNNWRUSTDDX-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN Cc1noc(CS(=O)(=O)Cc2nc(-c3cccs3)oc2C)c1[N+](=O)[O-] ZINC000596039533 567601893 /nfs/dbraw/zinc/60/18/93/567601893.db2.gz YQUGXENHQTYTNM-UHFFFAOYSA-N 0 0 383.407 3.031 20 5 GGBDRN Cc1noc(CS(=O)(=O)Cc2cc(Br)ccc2C)c1[N+](=O)[O-] ZINC000596037356 567601929 /nfs/dbraw/zinc/60/19/29/567601929.db2.gz AOKWEZSRZODSIM-UHFFFAOYSA-N 0 0 389.227 3.077 20 5 GGBDRN CO[C@]1(C)CCCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000480413484 567602105 /nfs/dbraw/zinc/60/21/05/567602105.db2.gz RQCOGASUSQNUGX-CYBMUJFWSA-N 0 0 383.253 3.091 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000552676234 567602098 /nfs/dbraw/zinc/60/20/98/567602098.db2.gz HQDPIMNMUSSEMD-CQSZACIVSA-N 0 0 397.200 3.268 20 5 GGBDRN Cc1cc(N2CCC[C@H](N3CCCC3=O)C2)c(Br)cc1[N+](=O)[O-] ZINC000530437142 567602344 /nfs/dbraw/zinc/60/23/44/567602344.db2.gz FGMLSMKNSPICGR-LBPRGKRZSA-N 0 0 382.258 3.257 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H](COC(F)F)C1 ZINC000552694880 567602540 /nfs/dbraw/zinc/60/25/40/567602540.db2.gz KFFQOIGOIANRSM-SNVBAGLBSA-N 0 0 378.759 3.105 20 5 GGBDRN Cc1cn2c(n1)[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])CCC2 ZINC000505899475 567602776 /nfs/dbraw/zinc/60/27/76/567602776.db2.gz RFISYSBHCKCEDF-NSHDSACASA-N 0 0 393.241 3.170 20 5 GGBDRN COC(=O)c1cc(Br)cc(NCc2onc(C)c2[N+](=O)[O-])c1C ZINC000596040787 567602961 /nfs/dbraw/zinc/60/29/61/567602961.db2.gz ZPZMCPCZCCQHRX-UHFFFAOYSA-N 0 0 384.186 3.361 20 5 GGBDRN Cc1cc(NCc2ccccc2CS(=O)(=O)NC(C)C)c([N+](=O)[O-])s1 ZINC000596061638 567605537 /nfs/dbraw/zinc/60/55/37/567605537.db2.gz CKCJMNRLYRTOHH-UHFFFAOYSA-N 0 0 383.495 3.405 20 5 GGBDRN COC1CCC(C)(CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000480443883 567605835 /nfs/dbraw/zinc/60/58/35/567605835.db2.gz UAJXPRQNBSYPCF-UHFFFAOYSA-N 0 0 376.862 3.122 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@H](C2CC2)O1 ZINC000480442976 567606195 /nfs/dbraw/zinc/60/61/95/567606195.db2.gz RTEAQLMKFSCRFM-SDBXPKJASA-N 0 0 395.264 3.090 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])S(=O)(=O)c1c(F)c(F)ccc1Cl ZINC000572027283 567606325 /nfs/dbraw/zinc/60/63/25/567606325.db2.gz XUCLCBSQZZHTDW-UHFFFAOYSA-N 0 0 390.795 3.390 20 5 GGBDRN Cc1cc(CC(C)(C)NC(=O)c2c([N+](=O)[O-])cnn2C)ccc1Br ZINC000572027240 567606677 /nfs/dbraw/zinc/60/66/77/567606677.db2.gz WHAUFWYIIYUNFC-UHFFFAOYSA-N 0 0 395.257 3.150 20 5 GGBDRN Cc1nc(CN2CCN(c3c(Br)cccc3[N+](=O)[O-])CC2)cs1 ZINC000596066788 567606735 /nfs/dbraw/zinc/60/67/35/567606735.db2.gz QZVQGPGISGKTGG-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN Cc1ccc(C(=O)N[C@@H](CO)c2ccc(Br)c(F)c2)cc1[N+](=O)[O-] ZINC000572021425 567606905 /nfs/dbraw/zinc/60/69/05/567606905.db2.gz UGZRBJXGMWOGAH-AWEZNQCLSA-N 0 0 397.200 3.268 20 5 GGBDRN O=C(NCC1CC1)[C@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596080860 567606985 /nfs/dbraw/zinc/60/69/85/567606985.db2.gz NSGRZYWBPGPYBZ-LBPRGKRZSA-N 0 0 382.258 3.100 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1NCc1ccc(N2CCOCC2)nc1 ZINC000596065524 567607338 /nfs/dbraw/zinc/60/73/38/567607338.db2.gz QYSINAXNQFRXSM-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN Cc1ccc(Br)cc1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000439954445 567608153 /nfs/dbraw/zinc/60/81/53/567608153.db2.gz SZMRKQXAYWYTNW-UHFFFAOYSA-N 0 0 389.209 3.472 20 5 GGBDRN Cc1cc(NCc2ccc(CS(=O)(=O)NC(C)C)cc2)c([N+](=O)[O-])s1 ZINC000596090967 567608846 /nfs/dbraw/zinc/60/88/46/567608846.db2.gz TZOSNRNTRNZQAC-UHFFFAOYSA-N 0 0 383.495 3.405 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1NCCCCn1cc(Br)cn1)CCN2 ZINC000480511716 567608802 /nfs/dbraw/zinc/60/88/02/567608802.db2.gz CYGUUYIKFVSIST-UHFFFAOYSA-N 0 0 380.246 3.414 20 5 GGBDRN Nc1nc(N[C@H](c2cc(F)cc(Br)c2)C2CC2)ncc1[N+](=O)[O-] ZINC000480504585 567608918 /nfs/dbraw/zinc/60/89/18/567608918.db2.gz BCSOBLOVPNLOSN-LBPRGKRZSA-N 0 0 382.193 3.262 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNc2nc3ccccc3cc2[N+](=O)[O-])s1 ZINC000480516154 567609387 /nfs/dbraw/zinc/60/93/87/567609387.db2.gz RWDDGILEXMRUPD-UHFFFAOYSA-N 0 0 377.447 3.032 20 5 GGBDRN Cc1nc(CN2CCN(c3c(Br)cccc3[N+](=O)[O-])CC2)oc1C ZINC000596112319 567609965 /nfs/dbraw/zinc/60/99/65/567609965.db2.gz NMOFMJIHAMISIU-UHFFFAOYSA-N 0 0 395.257 3.284 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C)[C@H](O)C(F)(F)F ZINC000572064013 567609878 /nfs/dbraw/zinc/60/98/78/567609878.db2.gz XPLYDBZXDIONFE-QWRGUYRKSA-N 0 0 399.163 3.097 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](c1cccs1)C(C)(C)CO ZINC000572049491 567610242 /nfs/dbraw/zinc/61/02/42/567610242.db2.gz QHUBQGKJZUOUDE-HNNXBMFYSA-N 0 0 384.479 3.003 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(NCCCCn3cc(Br)cn3)ccc2c1 ZINC000480525237 567610229 /nfs/dbraw/zinc/61/02/29/567610229.db2.gz SZCAGBCLPOHYDZ-UHFFFAOYSA-N 0 0 390.241 3.416 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(c3cc(Br)cnn3)CC2)cc1 ZINC000596143926 567611933 /nfs/dbraw/zinc/61/19/33/567611933.db2.gz WRWVCMOKGXNWBV-UHFFFAOYSA-N 0 0 379.214 3.195 20 5 GGBDRN COc1cccc(C(=O)NCc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000506156036 567613195 /nfs/dbraw/zinc/61/31/95/567613195.db2.gz OAKLRRBUUSXPIF-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCC(OC[C@H]2CCOC2)CC1 ZINC000596191615 567614985 /nfs/dbraw/zinc/61/49/85/567614985.db2.gz ZIVWMLZQFFESIT-LBPRGKRZSA-N 0 0 385.258 3.379 20 5 GGBDRN Cc1cc(N2CCC(Nc3c(Br)cccc3[N+](=O)[O-])CC2)n[nH]1 ZINC000596202419 567615654 /nfs/dbraw/zinc/61/56/54/567615654.db2.gz DIPABLRVWWAIDJ-UHFFFAOYSA-N 0 0 380.246 3.470 20 5 GGBDRN CNC(=O)c1cccc(NCc2ccc([N+](=O)[O-])cc2OC)c1Br ZINC000506215404 567615524 /nfs/dbraw/zinc/61/55/24/567615524.db2.gz AAPPSMIJMYJBRO-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN CNc1nccc(C(=O)Nc2nc(-c3ccc(C)s3)cs2)c1[N+](=O)[O-] ZINC000552883043 567615750 /nfs/dbraw/zinc/61/57/50/567615750.db2.gz MPEIZWVXKMDMFP-UHFFFAOYSA-N 0 0 375.435 3.199 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 ZINC000572142367 567616039 /nfs/dbraw/zinc/61/60/39/567616039.db2.gz IGIJMBUMZXMIER-LLVKDONJSA-N 0 0 385.442 3.061 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000596210375 567616328 /nfs/dbraw/zinc/61/63/28/567616328.db2.gz HVKCXXKOYADPFU-UFBFGSQYSA-N 0 0 383.164 3.497 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1ccccc1SC ZINC000480613447 567616412 /nfs/dbraw/zinc/61/64/12/567616412.db2.gz RORHLJNAWVKRSP-UHFFFAOYSA-N 0 0 382.463 3.146 20 5 GGBDRN O=C(CCc1ccc(Br)cc1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000530653846 567616430 /nfs/dbraw/zinc/61/64/30/567616430.db2.gz VFTYSFWFFIQNGR-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H]2CCC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000440125633 567616659 /nfs/dbraw/zinc/61/66/59/567616659.db2.gz ZJUXTTPZCPMQBB-MWLCHTKSSA-N 0 0 398.257 3.157 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)Cc2ccccc2SC)ccc1[N+](=O)[O-] ZINC000480628610 567617119 /nfs/dbraw/zinc/61/71/19/567617119.db2.gz AKJARZGTVRMVJP-UHFFFAOYSA-N 0 0 382.463 3.146 20 5 GGBDRN CNS(=O)(=O)c1cccc(CNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])c1 ZINC000552933372 567617313 /nfs/dbraw/zinc/61/73/13/567617313.db2.gz MNXXCHAQJBFFQR-UHFFFAOYSA-N 0 0 390.248 3.422 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H]2CCC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000440125634 567617342 /nfs/dbraw/zinc/61/73/42/567617342.db2.gz ZJUXTTPZCPMQBB-ONGXEEELSA-N 0 0 398.257 3.157 20 5 GGBDRN NC(=O)c1cc(N[C@H](c2cncc(Br)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000596227331 567617617 /nfs/dbraw/zinc/61/76/17/567617617.db2.gz VJFIHHBUJBKLIU-HNNXBMFYSA-N 0 0 391.225 3.414 20 5 GGBDRN CS(=O)(=O)N[C@H]1CCCC[C@@H]1CNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000596230507 567617758 /nfs/dbraw/zinc/61/77/58/567617758.db2.gz BIIAHXUCRPHIMX-NEPJUHHUSA-N 0 0 377.413 3.052 20 5 GGBDRN Nc1c(C(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000530675654 567617988 /nfs/dbraw/zinc/61/79/88/567617988.db2.gz XALFFSUUKCUKQT-STQMWFEESA-N 0 0 376.210 3.225 20 5 GGBDRN CN(Cc1cccnc1)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000572169496 567618143 /nfs/dbraw/zinc/61/81/43/567618143.db2.gz VCWOSTMZXWXPHX-UHFFFAOYSA-N 0 0 383.189 3.226 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CC[C@](CO)(c2ccccc2)C1 ZINC000596242011 567618480 /nfs/dbraw/zinc/61/84/80/567618480.db2.gz NGPSZQNXAIYZOC-KRWDZBQOSA-N 0 0 377.238 3.498 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000480660713 567618482 /nfs/dbraw/zinc/61/84/82/567618482.db2.gz GXPCATUPGDDLIY-CZUORRHYSA-N 0 0 382.463 3.021 20 5 GGBDRN C[C@@H]1CCSCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000480647060 567618587 /nfs/dbraw/zinc/61/85/87/567618587.db2.gz NGERSUJCWWUCKT-MRVPVSSYSA-N 0 0 385.294 3.418 20 5 GGBDRN O=c1[nH]c(NCc2cc(Br)cs2)nc2ccc([N+](=O)[O-])cc12 ZINC000552964308 567619127 /nfs/dbraw/zinc/61/91/27/567619127.db2.gz YRCZYACZXGADPR-UHFFFAOYSA-N 0 0 381.211 3.102 20 5 GGBDRN O=C1CCCN1[C@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596273225 567620159 /nfs/dbraw/zinc/62/01/59/567620159.db2.gz GKIQQFULPMHOTM-LBPRGKRZSA-N 0 0 382.258 3.339 20 5 GGBDRN COc1cccc(Cl)c1CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000480691398 567621549 /nfs/dbraw/zinc/62/15/49/567621549.db2.gz CNUSEWMCHRPICW-UHFFFAOYSA-N 0 0 376.843 3.105 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)c2cc(Br)ccc2O1 ZINC000572199787 567621687 /nfs/dbraw/zinc/62/16/87/567621687.db2.gz SNENHKPWGGLECC-VIFPVBQESA-N 0 0 380.198 3.124 20 5 GGBDRN O=c1ccc(I)cn1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000596306041 567622669 /nfs/dbraw/zinc/62/26/69/567622669.db2.gz DEFJCYLKXPKYOL-UHFFFAOYSA-N 0 0 390.564 3.063 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])cc1Cl ZINC000480741260 567626215 /nfs/dbraw/zinc/62/62/15/567626215.db2.gz NGAAEYYQOHKYIG-UHFFFAOYSA-N 0 0 384.841 3.352 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2cccnc2N2CCCC2)c(Br)c1 ZINC000596357719 567626415 /nfs/dbraw/zinc/62/64/15/567626415.db2.gz RMNNWHIXRZNUNN-UHFFFAOYSA-N 0 0 378.230 3.360 20 5 GGBDRN Cc1cc(OCCOc2cccc(S(C)(=O)=O)c2)c(Cl)cc1[N+](=O)[O-] ZINC000506444597 567626520 /nfs/dbraw/zinc/62/65/20/567626520.db2.gz LJUYGBPQNTZRNJ-UHFFFAOYSA-N 0 0 385.825 3.418 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCC[C@H]([S@@](C)=O)C2)ncc1[N+](=O)[O-] ZINC000596370021 567627562 /nfs/dbraw/zinc/62/75/62/567627562.db2.gz CDHKRIUCKNAFGK-QONUSYMYSA-N 0 0 376.276 3.162 20 5 GGBDRN COCCN([C@@H]1CC[C@H](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000480760643 567628389 /nfs/dbraw/zinc/62/83/89/567628389.db2.gz RRALMWJFUDDGMN-NWDGAFQWSA-N 0 0 376.862 3.074 20 5 GGBDRN COCCN([C@@H]1CC[C@H](C)C1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000480770513 567630252 /nfs/dbraw/zinc/63/02/52/567630252.db2.gz LIFXWGIVRVWJNW-WCQYABFASA-N 0 0 376.862 3.074 20 5 GGBDRN C[C@@H](O)CCSc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000596407276 567630461 /nfs/dbraw/zinc/63/04/61/567630461.db2.gz JEHVRDBRHGSUAX-CYBMUJFWSA-N 0 0 388.511 3.023 20 5 GGBDRN COc1ccc(Cl)cc1CNC(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506548294 567631175 /nfs/dbraw/zinc/63/11/75/567631175.db2.gz UVTSSYLBVWJPLW-UHFFFAOYSA-N 0 0 386.191 3.000 20 5 GGBDRN Cc1ccc(SCCNC(=O)COc2c(Cl)cncc2[N+](=O)[O-])cc1 ZINC000506579467 567631342 /nfs/dbraw/zinc/63/13/42/567631342.db2.gz PESRMRNISNEXNC-UHFFFAOYSA-N 0 0 381.841 3.239 20 5 GGBDRN NC(=O)c1cccc(N2CCc3c(Br)ccc(F)c3C2)c1[N+](=O)[O-] ZINC000553159288 567632187 /nfs/dbraw/zinc/63/21/87/567632187.db2.gz NBLZRFCREGGALA-UHFFFAOYSA-N 0 0 394.200 3.158 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cccc2cc(Br)cnc21 ZINC000553155593 567632304 /nfs/dbraw/zinc/63/23/04/567632304.db2.gz RFASJYXDIZNLQW-UHFFFAOYSA-N 0 0 390.197 3.131 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC[C@@H](COC(F)F)C1 ZINC000553196828 567633362 /nfs/dbraw/zinc/63/33/62/567633362.db2.gz GATVKMKILTWTBU-MRVPVSSYSA-N 0 0 379.157 3.059 20 5 GGBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1Br)C(=O)N1Cc2ccccc2C1 ZINC000480826543 567633547 /nfs/dbraw/zinc/63/35/47/567633547.db2.gz KMFFBVAIZASYEC-SNVBAGLBSA-N 0 0 391.225 3.095 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000530967005 567633810 /nfs/dbraw/zinc/63/38/10/567633810.db2.gz IFLVDXMXFFVATL-UHFFFAOYSA-N 0 0 379.825 3.121 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000596458409 567634129 /nfs/dbraw/zinc/63/41/29/567634129.db2.gz FALGYBQHPLYACB-JTQLQIEISA-N 0 0 383.710 3.254 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCOC[C@H]1c1ccc(Br)cc1 ZINC000596467135 567634455 /nfs/dbraw/zinc/63/44/55/567634455.db2.gz MENMKWWPBMFDQR-AWEZNQCLSA-N 0 0 395.257 3.460 20 5 GGBDRN CS(=O)(=O)C1(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000596470492 567635573 /nfs/dbraw/zinc/63/55/73/567635573.db2.gz NFXSCRSUEUMSSK-UHFFFAOYSA-N 0 0 389.861 3.117 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000596468982 567635663 /nfs/dbraw/zinc/63/56/63/567635663.db2.gz NBVOITSKXYULDO-UONOGXRCSA-N 0 0 392.253 3.355 20 5 GGBDRN NS(=O)(=O)c1c(NC[C@H]2CCC[C@@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000530995033 567635722 /nfs/dbraw/zinc/63/57/22/567635722.db2.gz JJFOETXDPAJODF-VHSXEESVSA-N 0 0 381.376 3.023 20 5 GGBDRN CNC(=O)c1ccc(N2CCc3ccc(Br)cc3C2)c([N+](=O)[O-])c1 ZINC000553228313 567636554 /nfs/dbraw/zinc/63/65/54/567636554.db2.gz BYVHCRBYVZPEJU-UHFFFAOYSA-N 0 0 390.237 3.280 20 5 GGBDRN C[C@@H](CCc1ccc(I)cc1)Nc1ncc([N+](=O)[O-])cn1 ZINC000480855521 567636817 /nfs/dbraw/zinc/63/68/17/567636817.db2.gz WRJYVZIIUHSYMT-JTQLQIEISA-N 0 0 398.204 3.423 20 5 GGBDRN Cc1cc(N2CC[C@H](CN3CCCC3=O)C2)c(Br)cc1[N+](=O)[O-] ZINC000596525470 567637258 /nfs/dbraw/zinc/63/72/58/567637258.db2.gz PMQYIIJFGILILW-LBPRGKRZSA-N 0 0 382.258 3.114 20 5 GGBDRN Cc1cc(N2CC[C@@H](CN3CCCC3=O)C2)c(Br)cc1[N+](=O)[O-] ZINC000596525462 567637639 /nfs/dbraw/zinc/63/76/39/567637639.db2.gz PMQYIIJFGILILW-GFCCVEGCSA-N 0 0 382.258 3.114 20 5 GGBDRN O=[N+]([O-])c1cc2c(ncnc2Sc2nnnn2-c2ccc(Cl)cc2)s1 ZINC000553237013 567637904 /nfs/dbraw/zinc/63/79/04/567637904.db2.gz JNWXSIUDYRBDLV-UHFFFAOYSA-N 0 0 391.825 3.380 20 5 GGBDRN Cc1c(Br)cccc1S(=O)(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000480865842 567637970 /nfs/dbraw/zinc/63/79/70/567637970.db2.gz QDOOUVUQOLRONP-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cc1cc(Br)ccc1S(=O)(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000480870820 567638179 /nfs/dbraw/zinc/63/81/79/567638179.db2.gz RNVPXQONNQRULZ-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN CC[C@@H](Cc1ccc(Br)cc1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000596534766 567638470 /nfs/dbraw/zinc/63/84/70/567638470.db2.gz RFQFPCOXKPTDDZ-LBPRGKRZSA-N 0 0 393.241 3.284 20 5 GGBDRN C[C@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@@]1(C)CO ZINC000596544516 567638633 /nfs/dbraw/zinc/63/86/33/567638633.db2.gz SRHYWVWVMFIWJF-QFYYESIMSA-N 0 0 380.242 3.360 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000596563277 567640124 /nfs/dbraw/zinc/64/01/24/567640124.db2.gz SXBAJGYJEBROHC-JTQLQIEISA-N 0 0 398.257 3.109 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000553265956 567640283 /nfs/dbraw/zinc/64/02/83/567640283.db2.gz KEBPPXRLVJHNRH-HNNXBMFYSA-N 0 0 380.857 3.341 20 5 GGBDRN CC(C)(C)c1nnc2n1CCN(c1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000596559259 567640213 /nfs/dbraw/zinc/64/02/13/567640213.db2.gz MOLPFUMRDYEDHG-UHFFFAOYSA-N 0 0 380.246 3.267 20 5 GGBDRN CN(Cc1ccc(Br)o1)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000553278333 567640518 /nfs/dbraw/zinc/64/05/18/567640518.db2.gz PBRIGPCWJGBWOZ-UHFFFAOYSA-N 0 0 379.170 3.236 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2cnccc2C(F)(F)F)s1 ZINC000596572639 567641844 /nfs/dbraw/zinc/64/18/44/567641844.db2.gz QEDVHJGKHXDYSC-UHFFFAOYSA-N 0 0 381.357 3.086 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCCS(=O)(=O)c1ccc(Br)cc1 ZINC000553293860 567642140 /nfs/dbraw/zinc/64/21/40/567642140.db2.gz MWSQBLVHKURRLY-UHFFFAOYSA-N 0 0 386.223 3.210 20 5 GGBDRN COCCN(Cc1cccs1)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000480928287 567642480 /nfs/dbraw/zinc/64/24/80/567642480.db2.gz OHAULRBMMBFSDI-UHFFFAOYSA-N 0 0 384.479 3.110 20 5 GGBDRN CCc1nnc(NC(=O)[C@H](C)[C@@H](C)Nc2ncc([N+](=O)[O-])cc2Cl)s1 ZINC000553318922 567643453 /nfs/dbraw/zinc/64/34/53/567643453.db2.gz HLGQQVKCZPVFEL-HTQZYQBOSA-N 0 0 384.849 3.132 20 5 GGBDRN C[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459629840 567643896 /nfs/dbraw/zinc/64/38/96/567643896.db2.gz FMGKRWKBWCAXFY-VIFPVBQESA-N 0 0 380.857 3.483 20 5 GGBDRN C[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459629838 567643942 /nfs/dbraw/zinc/64/39/42/567643942.db2.gz FMGKRWKBWCAXFY-SECBINFHSA-N 0 0 380.857 3.483 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)ncc1Br ZINC000531176948 567644827 /nfs/dbraw/zinc/64/48/27/567644827.db2.gz JMLISBVHKLIHCG-UHFFFAOYSA-N 0 0 394.181 3.084 20 5 GGBDRN Nc1c(C(=O)N2CCc3cc(Br)ccc3C2)cc(F)cc1[N+](=O)[O-] ZINC000480958579 567645135 /nfs/dbraw/zinc/64/51/35/567645135.db2.gz VJPOZRBGZXFBHY-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN O=C(NCc1ccc2c(c1)CCO2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000531185113 567645691 /nfs/dbraw/zinc/64/56/91/567645691.db2.gz JYKHPPFRIYXAPW-UHFFFAOYSA-N 0 0 377.194 3.222 20 5 GGBDRN C[C@H]1c2cccc(Br)c2CCN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000480955379 567645700 /nfs/dbraw/zinc/64/57/00/567645700.db2.gz TWLDEBRUKVRKNR-JTQLQIEISA-N 0 0 391.225 3.325 20 5 GGBDRN CN(C[C@@H](O)Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000480966439 567646913 /nfs/dbraw/zinc/64/69/13/567646913.db2.gz QUACEOMZIAXJJK-AWEZNQCLSA-N 0 0 393.237 3.033 20 5 GGBDRN NC(=O)c1cccc(N[C@H]2C[C@@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000553375368 567647164 /nfs/dbraw/zinc/64/71/64/567647164.db2.gz PDZVQLQCMDGQFS-OCCSQVGLSA-N 0 0 376.210 3.424 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)c1ccc(Br)s1 ZINC000440866675 567647230 /nfs/dbraw/zinc/64/72/30/567647230.db2.gz KTAWNHIYZRFXBR-QMMMGPOBSA-N 0 0 387.259 3.191 20 5 GGBDRN CC(C)(C)Oc1cccc(Cn2cc([N+](=O)[O-])cc(Br)c2=O)n1 ZINC000506865250 567647624 /nfs/dbraw/zinc/64/76/24/567647624.db2.gz DXUUSHKCEUFISL-UHFFFAOYSA-N 0 0 382.214 3.140 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2c(F)cccc2OC(F)F)cc1[N+](=O)[O-] ZINC000480983970 567649216 /nfs/dbraw/zinc/64/92/16/567649216.db2.gz GUIABGKXCUKFRW-UHFFFAOYSA-N 0 0 396.368 3.184 20 5 GGBDRN CCc1nnc(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000572568141 567649391 /nfs/dbraw/zinc/64/93/91/567649391.db2.gz DLWMUTHXXRQRFU-UHFFFAOYSA-N 0 0 375.435 3.062 20 5 GGBDRN O=C(Nc1nc(C(F)(F)F)c[nH]1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000506922895 567650553 /nfs/dbraw/zinc/65/05/53/567650553.db2.gz MCNIZNLZISHKGJ-UHFFFAOYSA-N 0 0 379.092 3.352 20 5 GGBDRN CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)c2ccc(Br)cc21 ZINC000553403762 567650904 /nfs/dbraw/zinc/65/09/04/567650904.db2.gz ADAITHUMNIYEIH-UHFFFAOYSA-N 0 0 391.225 3.036 20 5 GGBDRN NS(=O)(=O)c1cccc(N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000481036811 567652772 /nfs/dbraw/zinc/65/27/72/567652772.db2.gz MGJOUDSGLCFLJD-AULYBMBSSA-N 0 0 381.841 3.254 20 5 GGBDRN COc1ccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000506999251 567652851 /nfs/dbraw/zinc/65/28/51/567652851.db2.gz BUTSSMGPLYTXJF-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN CS(=O)(=O)c1ccc(Sc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1 ZINC000507016507 567653887 /nfs/dbraw/zinc/65/38/87/567653887.db2.gz YKQYOULRVWPLMA-UHFFFAOYSA-N 0 0 378.431 3.034 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)Cc1ccccc1Br ZINC000553435850 567653956 /nfs/dbraw/zinc/65/39/56/567653956.db2.gz AWWRBOBCLDSEHA-UHFFFAOYSA-N 0 0 399.266 3.319 20 5 GGBDRN COc1ccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])cc1Br ZINC000507016978 567654214 /nfs/dbraw/zinc/65/42/14/567654214.db2.gz SGWGNGQBRKQTMV-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)NCc2ccsc2)cc1[N+](=O)[O-] ZINC000481077949 567657221 /nfs/dbraw/zinc/65/72/21/567657221.db2.gz VSZKAINROWZLBS-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)Nc1ccncc1Br ZINC000507160492 567662279 /nfs/dbraw/zinc/66/22/79/567662279.db2.gz NQJINHIQOALZTG-UHFFFAOYSA-N 0 0 393.241 3.319 20 5 GGBDRN CC(C)(NC(=O)Nc1ccncc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000507188072 567664411 /nfs/dbraw/zinc/66/44/11/567664411.db2.gz NFHUHVJDYWVTBE-UHFFFAOYSA-N 0 0 379.214 3.231 20 5 GGBDRN NC(=O)c1cccc(N[C@@H]2C[C@H]2c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000553544795 567664838 /nfs/dbraw/zinc/66/48/38/567664838.db2.gz QAVHOXFTWMXLCG-GXTWGEPZSA-N 0 0 376.210 3.424 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccncc1Br ZINC000507190937 567665511 /nfs/dbraw/zinc/66/55/11/567665511.db2.gz WUNVNSLAYOWMDZ-UHFFFAOYSA-N 0 0 399.632 3.192 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCOc2c(Br)cccc21 ZINC000441513236 567666264 /nfs/dbraw/zinc/66/62/64/567666264.db2.gz QFXXMUVOQILCFM-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCOc2c(Br)cccc21 ZINC000441507914 567666401 /nfs/dbraw/zinc/66/64/01/567666401.db2.gz FOVBRVKSMPMKGW-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN C[C@](O)(CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(F)(F)F ZINC000481262122 567666880 /nfs/dbraw/zinc/66/68/80/567666880.db2.gz UQPJNNGQRFMYMT-JTQLQIEISA-N 0 0 375.225 3.048 20 5 GGBDRN O=C(Nc1ccncc1Br)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000507206656 567667408 /nfs/dbraw/zinc/66/74/08/567667408.db2.gz CZZLVRYWNLBYEZ-UHFFFAOYSA-N 0 0 391.225 3.371 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCOc2c(Br)cccc21 ZINC000441527488 567667691 /nfs/dbraw/zinc/66/76/91/567667691.db2.gz YSJQVONMIGRWGB-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN CC(C)N(Cc1cccs1)C(=O)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000459972980 567668308 /nfs/dbraw/zinc/66/83/08/567668308.db2.gz HLDFMZDADPLTOT-UHFFFAOYSA-N 0 0 382.463 3.111 20 5 GGBDRN O=[N+]([O-])c1cnc(N(CCn2ccnc2)Cc2ccc(Br)o2)s1 ZINC000553580110 567668685 /nfs/dbraw/zinc/66/86/85/567668685.db2.gz IWPFZBGUFGQNIN-UHFFFAOYSA-N 0 0 398.242 3.310 20 5 GGBDRN Cc1cc(Br)ccc1CN(C)c1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000553583428 567669626 /nfs/dbraw/zinc/66/96/26/567669626.db2.gz WTCRAKVWJSXRAV-UHFFFAOYSA-N 0 0 378.226 3.401 20 5 GGBDRN Cc1nc(N2CCN(c3cccc(Br)c3)CC2)ccc1[N+](=O)[O-] ZINC000553592461 567669910 /nfs/dbraw/zinc/66/99/10/567669910.db2.gz KHXCPMYYQVQWGH-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@H](OCC(F)(F)F)C1 ZINC000531627688 567670346 /nfs/dbraw/zinc/67/03/46/567670346.db2.gz JHNOVUMXFAAYGV-VIFPVBQESA-N 0 0 384.152 3.300 20 5 GGBDRN COC(=O)[C@H](C)N(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CCC1 ZINC000481321570 567670760 /nfs/dbraw/zinc/67/07/60/567670760.db2.gz PTIVRNJYMJXQMH-JTQLQIEISA-N 0 0 386.857 3.283 20 5 GGBDRN COc1cc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])ccc1Br ZINC000572870851 567671072 /nfs/dbraw/zinc/67/10/72/567671072.db2.gz HKUVEFMIDYIITJ-GFCCVEGCSA-N 0 0 397.225 3.218 20 5 GGBDRN CCc1nc(CCNS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)sc1C ZINC000481343531 567672542 /nfs/dbraw/zinc/67/25/42/567672542.db2.gz GRIFYZPJOBJECA-UHFFFAOYSA-N 0 0 383.495 3.060 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2ccc(Br)o2)c([N+](=O)[O-])c1 ZINC000507388947 567677754 /nfs/dbraw/zinc/67/77/54/567677754.db2.gz HDYYXSZNSCNGAT-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC1(C)C ZINC000553726189 567678134 /nfs/dbraw/zinc/67/81/34/567678134.db2.gz DJOPKDZGDZBLAU-GFCCVEGCSA-N 0 0 388.205 3.426 20 5 GGBDRN Cc1c(CNC(=O)COc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000481469986 567679058 /nfs/dbraw/zinc/67/90/58/567679058.db2.gz XDAJWDLARILDRZ-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCC(F)(F)c1ccc(Cl)cc1 ZINC000553729066 567679567 /nfs/dbraw/zinc/67/95/67/567679567.db2.gz GVIPSNYDACIHRW-UHFFFAOYSA-N 0 0 391.783 3.100 20 5 GGBDRN CCOC(=O)CC(C)(C)CCn1cc([N+](=O)[O-])c(C)c(Br)c1=O ZINC000553767982 567681592 /nfs/dbraw/zinc/68/15/92/567681592.db2.gz MKUNKDIOPLGATL-UHFFFAOYSA-N 0 0 389.246 3.197 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507504515 567683084 /nfs/dbraw/zinc/68/30/84/567683084.db2.gz PGTONDHGYQNXAU-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN Cc1nc(NCCNc2ncc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-] ZINC000531858426 567683201 /nfs/dbraw/zinc/68/32/01/567683201.db2.gz FDGHNFMMEMAEDW-UHFFFAOYSA-N 0 0 375.738 3.311 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ncc(Cc2ccccc2Cl)s1 ZINC000481505559 567683760 /nfs/dbraw/zinc/68/37/60/567683760.db2.gz ARRRWXXWCRCWGW-UHFFFAOYSA-N 0 0 377.813 3.281 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)CCOc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000507535673 567684801 /nfs/dbraw/zinc/68/48/01/567684801.db2.gz VRTTZQXHZJDZPP-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cc(C(=O)OC)cs1 ZINC000442222282 567686046 /nfs/dbraw/zinc/68/60/46/567686046.db2.gz MVGLRHLKKKBSRJ-UHFFFAOYSA-N 0 0 384.435 3.048 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cc(Cl)cc(F)c2F)cc1[N+](=O)[O-] ZINC000442239581 567687429 /nfs/dbraw/zinc/68/74/29/567687429.db2.gz DHNFWXAXDUZMNJ-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1Br ZINC000442237633 567687439 /nfs/dbraw/zinc/68/74/39/567687439.db2.gz XXMBKCNHLSTJAC-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N(Cc1cc(Br)ccc1F)C1CC1 ZINC000481569584 567689856 /nfs/dbraw/zinc/68/98/56/567689856.db2.gz LDOPDZSKBVBLJS-UHFFFAOYSA-N 0 0 383.177 3.024 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1ccc(I)cc1 ZINC000460500511 567690429 /nfs/dbraw/zinc/69/04/29/567690429.db2.gz BPFRAFNMZKHDEW-UHFFFAOYSA-N 0 0 396.184 3.172 20 5 GGBDRN Cc1ccc2c(c1)CN(S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)C2 ZINC000481617544 567692083 /nfs/dbraw/zinc/69/20/83/567692083.db2.gz UKWWMGIHJPVHPY-UHFFFAOYSA-N 0 0 397.250 3.370 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N(C)CC(=O)Nc2ccccc2Br)n1 ZINC000481688309 567696328 /nfs/dbraw/zinc/69/63/28/567696328.db2.gz AJZWUYZDFOVENI-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN O=C(CC[S@](=O)Cc1csc(C2CC2)n1)Nc1ccccc1[N+](=O)[O-] ZINC000507691230 567697232 /nfs/dbraw/zinc/69/72/32/567697232.db2.gz FATGKBALWSHPLC-VWLOTQADSA-N 0 0 379.463 3.206 20 5 GGBDRN C[C@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)c1ccc(F)c(Br)c1 ZINC000507715496 567700610 /nfs/dbraw/zinc/70/06/10/567700610.db2.gz RDJGXUXENUWOFU-VIFPVBQESA-N 0 0 399.220 3.305 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1C(=O)Cn1cc([N+](=O)[O-])cc(Cl)c1=O ZINC000532164478 567701621 /nfs/dbraw/zinc/70/16/21/567701621.db2.gz QNINNBLPCWLDRZ-CYBMUJFWSA-N 0 0 381.841 3.007 20 5 GGBDRN O=C(CC[S@](=O)c1ccc(Br)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000507733155 567702179 /nfs/dbraw/zinc/70/21/79/567702179.db2.gz RSUQZEYEIMHANJ-QHCPKHFHSA-N 0 0 397.250 3.494 20 5 GGBDRN COc1ccccc1CSc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] ZINC000532167412 567702173 /nfs/dbraw/zinc/70/21/73/567702173.db2.gz QNCWHRVURKIBOV-UHFFFAOYSA-N 0 0 382.463 3.146 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000532165016 567702189 /nfs/dbraw/zinc/70/21/89/567702189.db2.gz HVTCXIWRRWSNRB-UHFFFAOYSA-N 0 0 383.857 3.153 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1c2cc(Br)ccc2CC1(C)C ZINC000553968609 567702526 /nfs/dbraw/zinc/70/25/26/567702526.db2.gz PIAHWDDGWKDMKD-CQSZACIVSA-N 0 0 393.241 3.144 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)c1ccc(F)c(Br)c1 ZINC000507735592 567702516 /nfs/dbraw/zinc/70/25/16/567702516.db2.gz ADDUOTHZRNACQO-VIFPVBQESA-N 0 0 399.220 3.269 20 5 GGBDRN CCN(CCOC)C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000553989666 567703876 /nfs/dbraw/zinc/70/38/76/567703876.db2.gz LAEUVLDFLDEGGM-UHFFFAOYSA-N 0 0 387.223 3.196 20 5 GGBDRN O=C(Cn1cc(Br)c([N+](=O)[O-])n1)c1ccc(C(F)(F)F)cc1 ZINC000460862660 567707289 /nfs/dbraw/zinc/70/72/89/567707289.db2.gz KGTJPEORPYCREJ-UHFFFAOYSA-N 0 0 378.104 3.456 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2nnc(-c3ccc(F)cc3)[nH]2)c(Br)c1 ZINC000532296825 567707517 /nfs/dbraw/zinc/70/75/17/567707517.db2.gz HEVSDRULWATJLL-UHFFFAOYSA-N 0 0 393.176 3.289 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H](O)C(F)(F)F ZINC000597621842 567709104 /nfs/dbraw/zinc/70/91/04/567709104.db2.gz NORYBNCRKQGXLU-QWRGUYRKSA-N 0 0 399.163 3.035 20 5 GGBDRN COc1cc(S(=O)(=O)NCc2cc3c(s2)CCCC3)ccc1[N+](=O)[O-] ZINC000532342560 567709964 /nfs/dbraw/zinc/70/99/64/567709964.db2.gz UJHIFIROOKBOPQ-UHFFFAOYSA-N 0 0 382.463 3.022 20 5 GGBDRN CCc1ncc(S(=O)(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)s1 ZINC000460939782 567711238 /nfs/dbraw/zinc/71/12/38/567711238.db2.gz XXFUXEJYSNFDSD-CQSZACIVSA-N 0 0 385.492 3.050 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]CCSc2ccc(Cl)cc2)c1 ZINC000554194814 567715126 /nfs/dbraw/zinc/71/51/26/567715126.db2.gz QMWZCPRQEDXYEB-HNNXBMFYSA-N 0 0 382.869 3.370 20 5 GGBDRN COCC1(COc2ccc(I)cc2[N+](=O)[O-])CCC1 ZINC000461042907 567718102 /nfs/dbraw/zinc/71/81/02/567718102.db2.gz KOAGUZAJAXCKAO-UHFFFAOYSA-N 0 0 377.178 3.395 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H](c2ccc(F)cc2)C(F)(F)F)c1 ZINC000442941181 567718509 /nfs/dbraw/zinc/71/85/09/567718509.db2.gz HGCYJLGHNDIRCC-ZDUSSCGKSA-N 0 0 378.303 3.316 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(-c2cc(Br)c[nH]2)n1C ZINC000507958249 567718947 /nfs/dbraw/zinc/71/89/47/567718947.db2.gz YXPIHDPEQHLYGA-UHFFFAOYSA-N 0 0 391.229 3.117 20 5 GGBDRN CC[C@H](C)N(CC)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000597856965 567719782 /nfs/dbraw/zinc/71/97/82/567719782.db2.gz SCKRQUDSUATBIO-VIFPVBQESA-N 0 0 376.194 3.460 20 5 GGBDRN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)Cc1cccc(O)c1 ZINC000532566697 567723451 /nfs/dbraw/zinc/72/34/51/567723451.db2.gz MMFMHDZDUVEYIQ-UHFFFAOYSA-N 0 0 394.225 3.133 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000461227143 567726538 /nfs/dbraw/zinc/72/65/38/567726538.db2.gz PPMCYGRXLRWKNY-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2SC)c([N+](=O)[O-])c1 ZINC000443082027 567729843 /nfs/dbraw/zinc/72/98/43/567729843.db2.gz RLLJSLOLHCGNRI-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)c1ccccc1SC ZINC000443087500 567729945 /nfs/dbraw/zinc/72/99/45/567729945.db2.gz KHRKEYCGAPIDBI-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1ccc2[nH]ccc2c1 ZINC000443093604 567731324 /nfs/dbraw/zinc/73/13/24/567731324.db2.gz NAGBRVMJFUVNJS-UHFFFAOYSA-N 0 0 379.825 3.251 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000532744995 567731969 /nfs/dbraw/zinc/73/19/69/567731969.db2.gz LQNUDMLKENTHJZ-AWEZNQCLSA-N 0 0 399.241 3.209 20 5 GGBDRN COc1ncc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c(C)c1Br ZINC000598020104 567732833 /nfs/dbraw/zinc/73/28/33/567732833.db2.gz DZSMIAMOBRECSG-UHFFFAOYSA-N 0 0 398.217 3.168 20 5 GGBDRN O=C(c1cscc1Br)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461397492 567733669 /nfs/dbraw/zinc/73/36/69/567733669.db2.gz GXNFWINJFIOQMS-UHFFFAOYSA-N 0 0 383.223 3.454 20 5 GGBDRN O=C(Nc1ccc2c(=O)cc[nH]c2c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000508208015 567736990 /nfs/dbraw/zinc/73/69/90/567736990.db2.gz WFAOMPVJVJJTFC-UHFFFAOYSA-N 0 0 388.177 3.451 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C)[C@H]1CCO ZINC000598066366 567737226 /nfs/dbraw/zinc/73/72/26/567737226.db2.gz DCEMFUKWBQFGEH-MEBBXXQBSA-N 0 0 385.258 3.289 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@H]3CO[C@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000573805556 567737306 /nfs/dbraw/zinc/73/73/06/567737306.db2.gz ZLSPQMYIVQOJBL-ZYHUDNBSSA-N 0 0 379.463 3.418 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC(C)(C)[C@@H]3COC[C@@H]32)cc1[N+](=O)[O-] ZINC000573802355 567737379 /nfs/dbraw/zinc/73/73/79/567737379.db2.gz MUQNVBDEAQHDMR-RISCZKNCSA-N 0 0 383.242 3.163 20 5 GGBDRN Cn1c(=O)[nH]c2ccc(NC(=O)c3cc(Br)cc([N+](=O)[O-])c3)cc21 ZINC000443177290 567737554 /nfs/dbraw/zinc/73/75/54/567737554.db2.gz RTSNDALOFAJJKW-UHFFFAOYSA-N 0 0 391.181 3.202 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@@H]3CO[C@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000573805555 567737789 /nfs/dbraw/zinc/73/77/89/567737789.db2.gz ZLSPQMYIVQOJBL-PWSUYJOCSA-N 0 0 379.463 3.418 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@H]3CO[C@@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000573805553 567737898 /nfs/dbraw/zinc/73/78/98/567737898.db2.gz ZLSPQMYIVQOJBL-CMPLNLGQSA-N 0 0 379.463 3.418 20 5 GGBDRN O=C(Nc1nc(C2CC2)c[nH]1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000554627751 567739377 /nfs/dbraw/zinc/73/93/77/567739377.db2.gz FYFKQNDVZBGRIO-UHFFFAOYSA-N 0 0 398.160 3.052 20 5 GGBDRN CCn1cc(S(=O)(=O)N(Cc2cccc(Cl)c2)C(C)C)c([N+](=O)[O-])n1 ZINC000532854695 567739931 /nfs/dbraw/zinc/73/99/31/567739931.db2.gz JFHXKBVSWVZEQA-UHFFFAOYSA-N 0 0 386.861 3.064 20 5 GGBDRN O=C(Cc1cc(F)ccc1Br)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000532904579 567742328 /nfs/dbraw/zinc/74/23/28/567742328.db2.gz OAOMNEODJQYODI-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN O=C(Nc1nc(C(F)(F)F)cs1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000508298483 567742539 /nfs/dbraw/zinc/74/25/39/567742539.db2.gz JGEBIVJSTUBSRG-UHFFFAOYSA-N 0 0 375.284 3.094 20 5 GGBDRN CC[C@]1(C)COCCN1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000573885408 567742688 /nfs/dbraw/zinc/74/26/88/567742688.db2.gz SARRGUHGMBBIHF-CQSZACIVSA-N 0 0 390.221 3.200 20 5 GGBDRN Cn1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c(C(F)(F)F)n1 ZINC000508329245 567743511 /nfs/dbraw/zinc/74/35/11/567743511.db2.gz GYCWUNSMSZQVLF-UHFFFAOYSA-N 0 0 393.119 3.362 20 5 GGBDRN COC(=O)c1ccc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)s1 ZINC000461689782 567743903 /nfs/dbraw/zinc/74/39/03/567743903.db2.gz ZGLLWMREXNUOGL-OAHLLOKOSA-N 0 0 378.431 3.331 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)c(C)cc1Br ZINC000554726673 567745267 /nfs/dbraw/zinc/74/52/67/567745267.db2.gz FTPOELUUPDEHJQ-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cc1cc(N[C@@H](C(N)=O)c2cccc(Br)c2)c(F)cc1[N+](=O)[O-] ZINC000461777733 567747163 /nfs/dbraw/zinc/74/71/63/567747163.db2.gz NTBQWIVTKJBQPK-CQSZACIVSA-N 0 0 382.189 3.443 20 5 GGBDRN Cc1ccc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)o1 ZINC000533006871 567747536 /nfs/dbraw/zinc/74/75/36/567747536.db2.gz CPZNHTBFFJCNAY-UHFFFAOYSA-N 0 0 378.328 3.036 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@@H](O)C(F)(F)F ZINC000554776539 567749123 /nfs/dbraw/zinc/74/91/23/567749123.db2.gz RATBONSONVEXGS-NOZJJQNGSA-N 0 0 398.790 3.255 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cncc(Br)c1 ZINC000554869728 567754266 /nfs/dbraw/zinc/75/42/66/567754266.db2.gz VLMWBXVGBKGUOW-UHFFFAOYSA-N 0 0 379.214 3.459 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC[C@](CO)(c2ccccc2)C1 ZINC000461923403 567754493 /nfs/dbraw/zinc/75/44/93/567754493.db2.gz ZQBBQRZIFNIECU-KRWDZBQOSA-N 0 0 377.238 3.498 20 5 GGBDRN O=C1C[C@H](Nc2ncc([N+](=O)[O-])cc2Br)CN1c1ccccc1F ZINC000461926507 567755250 /nfs/dbraw/zinc/75/52/50/567755250.db2.gz CZGPSAKEARUESR-VIFPVBQESA-N 0 0 395.188 3.109 20 5 GGBDRN O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)c1cccc(Cl)c1Cl ZINC000554896343 567755594 /nfs/dbraw/zinc/75/55/94/567755594.db2.gz IEWKYQGRHHDHRW-UHFFFAOYSA-N 0 0 378.171 3.494 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](c2cccs2)C(C)(C)CO)c([N+](=O)[O-])c1 ZINC000554907877 567755708 /nfs/dbraw/zinc/75/57/08/567755708.db2.gz JRAGOFIEFQIXKC-OAHLLOKOSA-N 0 0 384.479 3.003 20 5 GGBDRN COC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(Cl)c1 ZINC000574114465 567756706 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O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCOc1ccccc1Cl ZINC000443740653 567773842 /nfs/dbraw/zinc/77/38/42/567773842.db2.gz BJNCHCIHAJAQMF-UHFFFAOYSA-N 0 0 391.232 3.259 20 5 GGBDRN C[C@H]1COCC[C@H]1CNc1ccc(I)cc1[N+](=O)[O-] ZINC000555207352 567774032 /nfs/dbraw/zinc/77/40/32/567774032.db2.gz XLQAXEGXXNGKQB-UWVGGRQHSA-N 0 0 376.194 3.284 20 5 GGBDRN CC(C)[C@H]1CN(c2ccc(I)cc2[N+](=O)[O-])CCCO1 ZINC000555261854 567776334 /nfs/dbraw/zinc/77/63/34/567776334.db2.gz CPWQXHHEYLFJTD-CQSZACIVSA-N 0 0 390.221 3.451 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCC(C)(C)[C@@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000533583136 567777050 /nfs/dbraw/zinc/77/70/50/567777050.db2.gz CRHXETZNTYYVLE-AWEZNQCLSA-N 0 0 387.274 3.439 20 5 GGBDRN Cc1ccc(Oc2ncnc(N3CCOCC3)c2[N+](=O)[O-])c(Br)c1 ZINC000598587153 567777810 /nfs/dbraw/zinc/77/78/10/567777810.db2.gz NVEMGQBSCLGEKU-UHFFFAOYSA-N 0 0 395.213 3.085 20 5 GGBDRN O=C(N[C@H](Cc1cccc(Br)c1)CC1CC1)c1c[nH]nc1[N+](=O)[O-] ZINC000555288809 567778361 /nfs/dbraw/zinc/77/83/61/567778361.db2.gz 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COc1cc(CCNS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)ccc1Cl ZINC000555433202 567784496 /nfs/dbraw/zinc/78/44/96/567784496.db2.gz ZPCKCWMELHXVCY-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN COCCO[C@@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C1 ZINC000443989334 567784856 /nfs/dbraw/zinc/78/48/56/567784856.db2.gz OKNJIKGDAUPCKP-GFCCVEGCSA-N 0 0 396.241 3.147 20 5 GGBDRN COc1ccc(/C=C\c2nc(N(C)C)ncc2Br)cc1[N+](=O)[O-] ZINC000555467790 567784998 /nfs/dbraw/zinc/78/49/98/567784998.db2.gz PFCAGBSMLZTKRW-XQRVVYSFSA-N 0 0 379.214 3.392 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)Cc1cc(Cl)cc(Cl)c1 ZINC000555459150 567785142 /nfs/dbraw/zinc/78/51/42/567785142.db2.gz USNCBGPWWLYBSF-UHFFFAOYSA-N 0 0 376.221 3.263 20 5 GGBDRN CCS(=O)(=O)N(Cc1nnc(C(C)C)s1)c1ccc([N+](=O)[O-])cc1C ZINC000598727646 567785592 /nfs/dbraw/zinc/78/55/92/567785592.db2.gz AYMWMLHSXUWTTJ-UHFFFAOYSA-N 0 0 384.483 3.234 20 5 GGBDRN CN1C(=O)CN(C(=O)c2sc(Br)cc2[N+](=O)[O-])c2ccccc21 ZINC000555504477 567786042 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ZINC000737356032 598475454 /nfs/dbraw/zinc/47/54/54/598475454.db2.gz DAQNCBXJZHGNDG-UHFFFAOYSA-N 0 0 393.407 3.280 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCCOc2cccc3cccnc32)c(-c2nn[nH]n2)c1 ZINC000738368949 598628790 /nfs/dbraw/zinc/62/87/90/598628790.db2.gz GGFATIADKGGCON-UHFFFAOYSA-N 0 0 391.391 3.204 20 5 GGBDRN C[C@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1nc2cc(Cl)ccc2[nH]1 ZINC000736140351 598747452 /nfs/dbraw/zinc/74/74/52/598747452.db2.gz UIFPLPFNPSIUAU-QMMMGPOBSA-N 0 0 384.787 3.478 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccccc3Cl)C2)c(-c2nn[nH]n2)c1 ZINC000738368304 598756726 /nfs/dbraw/zinc/75/67/26/598756726.db2.gz BTHINXLEVLLALK-INIZCTEOSA-N 0 0 386.799 3.006 20 5 GGBDRN COc1ccc(Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])cc1Br ZINC000737104735 598773478 /nfs/dbraw/zinc/77/34/78/598773478.db2.gz ADCOSJDHSNQFDZ-UHFFFAOYSA-N 0 0 391.185 3.290 20 5 GGBDRN O=[N+]([O-])c1ccc(N(Cc2ccccc2)CC2CCOCC2)c(-c2nn[nH]n2)c1 ZINC000738369653 598816863 /nfs/dbraw/zinc/81/68/63/598816863.db2.gz LGVXPDKYKLEJCZ-UHFFFAOYSA-N 0 0 394.435 3.208 20 5 GGBDRN O=[N+]([O-])c1cnc(Sc2ccccc2Br)c(-c2nn[nH]n2)c1 ZINC000823651084 599321906 /nfs/dbraw/zinc/32/19/06/599321906.db2.gz FEGHWTFAKFEJTI-UHFFFAOYSA-N 0 0 379.199 3.084 20 5 GGBDRN CN(Cc1ccc(-c2nn[nH]n2)cc1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000736816309 599323719 /nfs/dbraw/zinc/32/37/19/599323719.db2.gz GADPPRHHHHYFGM-UHFFFAOYSA-N 0 0 376.323 3.013 20 5 GGBDRN CN(C)c1cc(CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])c2ccccc2n1 ZINC000821588350 599360275 /nfs/dbraw/zinc/36/02/75/599360275.db2.gz NYUQRSFWCVPMIM-UHFFFAOYSA-N 0 0 390.407 3.001 20 5 GGBDRN CC(C)(C)n1cc(-c2nn[nH]n2)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000735661596 599371535 /nfs/dbraw/zinc/37/15/35/599371535.db2.gz ODPDTYATFVFQPV-UHFFFAOYSA-N 0 0 389.803 3.237 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(NCCSCc2ccccc2-c2nn[nH]n2)c1 ZINC000821846571 599465442 /nfs/dbraw/zinc/46/54/42/599465442.db2.gz UQQHKOMHYGICCZ-UHFFFAOYSA-N 0 0 386.437 3.129 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(NCCc3cc(F)cc(F)c3)cc(-c3nn[nH]n3)c2c1 ZINC000823644062 599510378 /nfs/dbraw/zinc/51/03/78/599510378.db2.gz FCJXEQRVJUJVAR-UHFFFAOYSA-N 0 0 397.345 3.256 20 5 GGBDRN O=C(c1ccc(F)cc1)[C@@H]1CCCN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000738265915 599533158 /nfs/dbraw/zinc/53/31/58/599533158.db2.gz GNJMAAXAHCTFHH-CQSZACIVSA-N 0 0 396.382 3.013 20 5 GGBDRN Cc1nc(C)c(CCNc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)s1 ZINC000822432009 599545384 /nfs/dbraw/zinc/54/53/84/599545384.db2.gz SUMFPKFDVYALKR-UHFFFAOYSA-N 0 0 396.436 3.051 20 5 GGBDRN CS[C@@H]1CCC[C@@H](Nc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)C1 ZINC000821951302 599562343 /nfs/dbraw/zinc/56/23/43/599562343.db2.gz WBSPOKWBVQZGOZ-ZYHUDNBSSA-N 0 0 385.453 3.409 20 5 GGBDRN O=C([O-])[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000739500606 599788884 /nfs/dbraw/zinc/78/88/84/599788884.db2.gz QMPNLKVHKDMCFA-AWEZNQCLSA-N 0 0 383.173 3.412 20 5 GGBDRN O=C([O-])[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000739500608 599788923 /nfs/dbraw/zinc/78/89/23/599788923.db2.gz QMPNLKVHKDMCFA-CQSZACIVSA-N 0 0 383.173 3.412 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C(=O)[O-])c1ccc(Br)cc1 ZINC000738069127 599790699 /nfs/dbraw/zinc/79/06/99/599790699.db2.gz YDHRZTUPXHOIPM-OAHLLOKOSA-N 0 0 395.209 3.281 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(OC(C)C)c(-c3nn[nH]n3)c2)cccc1[N+](=O)[O-] ZINC000822020870 607399358 /nfs/dbraw/zinc/39/93/58/607399358.db2.gz LOXPNWZIHLZGGE-UHFFFAOYSA-N 0 0 382.380 3.123 20 5 GGBDRN CC[NH+](CC)Cc1ccc(CNC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)cc1 ZINC000737088050 599864672 /nfs/dbraw/zinc/86/46/72/599864672.db2.gz MBYWXQMOSIZMFQ-UHFFFAOYSA-N 0 0 385.420 3.065 20 5 GGBDRN O=C([O-])c1cc(C(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)cc([N+](=O)[O-])c1 ZINC000738670165 599937179 /nfs/dbraw/zinc/93/71/79/599937179.db2.gz UHLBLGYVDLDSIT-OAHLLOKOSA-N 0 0 389.452 3.021 20 5 GGBDRN C[C@]([NH2+]CCc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])c1cccc(Br)c1 ZINC000736665791 600079068 /nfs/dbraw/zinc/07/90/68/600079068.db2.gz ZECIGTCATKICCF-QGZVFWFLSA-N 0 0 393.237 3.489 20 5 GGBDRN C[C@@]([NH2+]Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])c1cccc(Br)c1 ZINC000736665800 600079217 /nfs/dbraw/zinc/07/92/17/600079217.db2.gz ZHCOMUMGMZJQET-INIZCTEOSA-N 0 0 379.210 3.447 20 5 GGBDRN O=C([O-])C[NH+]1CCN(c2ccc(Nc3ccc([N+](=O)[O-])cc3Cl)cc2)CC1 ZINC000739804081 600080324 /nfs/dbraw/zinc/08/03/24/600080324.db2.gz UXODNZAZYCZZQZ-UHFFFAOYSA-N 0 0 390.827 3.198 20 5 GGBDRN CC[C@]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)(C(=O)[O-])c1ccccc1 ZINC000736919049 600130531 /nfs/dbraw/zinc/13/05/31/600130531.db2.gz WOTBJBDCFSBHHO-HXUWFJFHSA-N 0 0 385.420 3.212 20 5 GGBDRN C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC000736724787 600208950 /nfs/dbraw/zinc/20/89/50/600208950.db2.gz PGDRSCQFZOZEER-CQSZACIVSA-N 0 0 397.431 3.248 20 5 GGBDRN CC[N@H+](C)Cc1cccc(CNc2c(C(=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC000737069497 600432064 /nfs/dbraw/zinc/43/20/64/600432064.db2.gz XJUFGWWALXERJB-UHFFFAOYSA-N 0 0 388.380 3.265 20 5 GGBDRN C[N@H+](CCNc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000737442779 600432601 /nfs/dbraw/zinc/43/26/01/600432601.db2.gz KDPFWOHTSUWDIP-UHFFFAOYSA-N 0 0 383.404 3.030 20 5 GGBDRN C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC000736815102 600692292 /nfs/dbraw/zinc/69/22/92/600692292.db2.gz NSINMEVQOKYNDF-OAHLLOKOSA-N 0 0 397.431 3.030 20 5 GGBDRN C[C@H]1C[C@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000828184379 600817299 /nfs/dbraw/zinc/81/72/99/600817299.db2.gz PSGYVAKVYMQSLO-DZGCQCFKSA-N 0 0 397.431 3.419 20 5 GGBDRN C[NH+](C)Cc1c2ccccc2oc1C(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC000830619970 600974761 /nfs/dbraw/zinc/97/47/61/600974761.db2.gz KXTPTCAPEYYCPJ-UHFFFAOYSA-N 0 0 383.360 3.353 20 5 GGBDRN C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC000828296005 601108564 /nfs/dbraw/zinc/10/85/64/601108564.db2.gz ROIRKPIJOLIETQ-OAHLLOKOSA-N 0 0 397.431 3.030 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000832905407 601206248 /nfs/dbraw/zinc/20/62/48/601206248.db2.gz IRALPGYRPNKIPH-AUUYWEPGSA-N 0 0 385.420 3.283 20 5 GGBDRN C[NH+]1CCC(N(Cc2ccccc2)C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC000830923605 601331815 /nfs/dbraw/zinc/33/18/15/601331815.db2.gz NPHSAJQNIZQYAU-UHFFFAOYSA-N 0 0 397.431 3.030 20 5 GGBDRN O=C([O-])[C@@H]1C[C@@H](C2CCCCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000833180397 601431505 /nfs/dbraw/zinc/43/15/05/601431505.db2.gz UROWGDDACCKZNM-KDOFPFPSSA-N 0 0 390.436 3.317 20 5 GGBDRN CC(C)[N@H+](C)CCNc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-] ZINC000826930574 601444769 /nfs/dbraw/zinc/44/47/69/601444769.db2.gz YOOPCQHVLQKSBV-UHFFFAOYSA-N 0 0 385.420 3.276 20 5 GGBDRN O=C([O-])[C@H]([NH2+]CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 ZINC000833167190 601458053 /nfs/dbraw/zinc/45/80/53/601458053.db2.gz ZMBMUPNOWQVASC-OAHLLOKOSA-N 0 0 383.326 3.441 20 5 GGBDRN CCC1CCC([NH2+]CCC(=O)Nc2cccc([N+](=O)[O-])c2C)(C(=O)[O-])CC1 ZINC000829107919 601495487 /nfs/dbraw/zinc/49/54/87/601495487.db2.gz SWIBNBNLPMFUFE-UHFFFAOYSA-N 0 0 377.441 3.245 20 5 GGBDRN CCC1CCC([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)(C(=O)[O-])CC1 ZINC000829107576 601496272 /nfs/dbraw/zinc/49/62/72/601496272.db2.gz OJKAEZLSEXLMTR-UHFFFAOYSA-N 0 0 377.441 3.245 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2C[C@H](C(=O)[O-])[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000832941972 601527342 /nfs/dbraw/zinc/52/73/42/601527342.db2.gz PYSQEBLBIWBMTC-ALKREAHSSA-N 0 0 397.431 3.236 20 5 GGBDRN Cc1cc(N2CCC[N@H+](Cc3ccc(F)cc3)CC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000567981728 601544411 /nfs/dbraw/zinc/54/44/11/601544411.db2.gz WPHLTYLVMYUVLL-UHFFFAOYSA-N 0 0 387.411 3.453 20 5 GGBDRN CN(c1ccccc1)c1ccc(C[NH2+]C2(CC(=O)[O-])CCOCC2)cc1[N+](=O)[O-] ZINC000830888085 601561080 /nfs/dbraw/zinc/56/10/80/601561080.db2.gz FMTBKITYYARRNR-UHFFFAOYSA-N 0 0 399.447 3.476 20 5 GGBDRN CC[N@@H+]1C[C@@H](C)[C@@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000829754792 601564958 /nfs/dbraw/zinc/56/49/58/601564958.db2.gz YEHMZCAGCSKKJO-ACJLOTCBSA-N 0 0 397.431 3.276 20 5 GGBDRN O=C(Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl)c1cc(Cl)ccc1F ZINC000826451172 607523296 /nfs/dbraw/zinc/52/32/96/607523296.db2.gz TUIZPVKEMXYOGJ-UHFFFAOYSA-N 0 0 397.153 3.473 20 5 GGBDRN C[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830794929 601901263 /nfs/dbraw/zinc/90/12/63/601901263.db2.gz BQJWTJPDQBJYCB-INIZCTEOSA-N 0 0 384.310 3.149 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CC[C@@](C)(C(=O)[O-])C2)c([N+](=O)[O-])c1 ZINC000263577299 601947098 /nfs/dbraw/zinc/94/70/98/601947098.db2.gz RJXKUCJVIQLCQD-WIYYLYMNSA-N 0 0 397.431 3.380 20 5 GGBDRN Cc1cc(NCc2ccc(C[NH+]3CCC(O)CC3)cc2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000580895560 602316511 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ZINC000054646981 1406795081 /nfs/dbraw/zinc/79/50/81/1406795081.db2.gz RPVPYQOUZQWUME-HNNXBMFYSA-N 0 0 398.463 3.165 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000054647526 1406795090 /nfs/dbraw/zinc/79/50/90/1406795090.db2.gz RAWSIFWXNSBVRC-CYBMUJFWSA-N 0 0 382.420 3.082 20 5 GGBDRN Cc1noc(C2CCN(C(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000054665387 1406799597 /nfs/dbraw/zinc/79/95/97/1406799597.db2.gz AYKFAORRQDKLLM-NSHDSACASA-N 0 0 376.438 3.173 20 5 GGBDRN COc1cccc([C@H]2CCCN2CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000054668639 1406800699 /nfs/dbraw/zinc/80/06/99/1406800699.db2.gz GLBMGQZJAUTOGF-MRXNPFEDSA-N 0 0 399.403 3.108 20 5 GGBDRN Cc1noc([C@H]2CCCN([C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)n1 ZINC000054676859 1406803199 /nfs/dbraw/zinc/80/31/99/1406803199.db2.gz OUYHWOUWPIEMRD-FZMZJTMJSA-N 0 0 384.396 3.277 20 5 GGBDRN O=C(CCn1cnc2sccc2c1=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000054677960 1406803575 /nfs/dbraw/zinc/80/35/75/1406803575.db2.gz LHZDSHXHKBBXLT-UHFFFAOYSA-N 0 0 378.797 3.048 20 5 GGBDRN CC[C@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(Cl)cc1 ZINC000054749029 1406817591 /nfs/dbraw/zinc/81/75/91/1406817591.db2.gz SKYWOYSMZPZYNW-AWEZNQCLSA-N 0 0 389.795 3.424 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@H]1CCCOc2ccc(F)cc21 ZINC000054784368 1406824899 /nfs/dbraw/zinc/82/48/99/1406824899.db2.gz QLGWNVYMROHXTB-HNNXBMFYSA-N 0 0 388.399 3.359 20 5 GGBDRN CCCCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1 ZINC000054817006 1406831024 /nfs/dbraw/zinc/83/10/24/1406831024.db2.gz VASWAXIRVAQLJH-HNNXBMFYSA-N 0 0 396.509 3.322 20 5 GGBDRN CN(CCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1F ZINC000054836625 1406834261 /nfs/dbraw/zinc/83/42/61/1406834261.db2.gz QPBQICWCCSGRLR-UHFFFAOYSA-N 0 0 381.429 3.076 20 5 GGBDRN CNS(=O)(=O)c1ccc(N2CCC[C@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000054837357 1406834288 /nfs/dbraw/zinc/83/42/88/1406834288.db2.gz KJPAQJWYMXJZNX-INIZCTEOSA-N 0 0 375.450 3.153 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC[C@H]2Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000054837269 1406834465 /nfs/dbraw/zinc/83/44/65/1406834465.db2.gz QTGGMDQHOBYLGA-HNNXBMFYSA-N 0 0 378.425 3.349 20 5 GGBDRN C[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1nnc2ccccn21 ZINC000054887734 1406843456 /nfs/dbraw/zinc/84/34/56/1406843456.db2.gz TWBMXJSKBPQMKW-OAHLLOKOSA-N 0 0 397.438 3.075 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCN(Cc2csc(-c3ccccc3)n2)CC1 ZINC000054888268 1406843626 /nfs/dbraw/zinc/84/36/26/1406843626.db2.gz LVVXSSMESHJRMT-UHFFFAOYSA-N 0 0 397.460 3.004 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000054901039 1406846626 /nfs/dbraw/zinc/84/66/26/1406846626.db2.gz UVBDPLSWEWVJMX-UHFFFAOYSA-N 0 0 389.411 3.144 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SC(F)F ZINC000054899546 1406846846 /nfs/dbraw/zinc/84/68/46/1406846846.db2.gz DAPZRAQDELSXOY-UHFFFAOYSA-N 0 0 395.387 3.207 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000054903207 1406847451 /nfs/dbraw/zinc/84/74/51/1406847451.db2.gz JBGPYPKTNUOUAD-SFHVURJKSA-N 0 0 397.431 3.050 20 5 GGBDRN O=C(Nc1cc(Cl)ccc1N1CCOCC1)c1ccc([N+](=O)[O-])cc1F ZINC000054914792 1406850033 /nfs/dbraw/zinc/85/00/33/1406850033.db2.gz RMPOQXPSXRIFFZ-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN O=C(c1cccc(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)c1)N1CCCCC1 ZINC000054916592 1406850544 /nfs/dbraw/zinc/85/05/44/1406850544.db2.gz OSCXXZVVBTYQJC-UHFFFAOYSA-N 0 0 381.388 3.177 20 5 GGBDRN O=C(Nc1ccccc1)NC1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000054981259 1406864207 /nfs/dbraw/zinc/86/42/07/1406864207.db2.gz CIBLYHWOYDVDGL-UHFFFAOYSA-N 0 0 386.437 3.095 20 5 GGBDRN Cc1cccc(C)c1OCCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000054981013 1406864299 /nfs/dbraw/zinc/86/42/99/1406864299.db2.gz QSUHVRLMDOVJTE-UHFFFAOYSA-N 0 0 378.450 3.496 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@H]1CCN(c2ccccc2)C1 ZINC000054980006 1406863789 /nfs/dbraw/zinc/86/37/89/1406863789.db2.gz KEHSYYRJRXYWTD-CYBMUJFWSA-N 0 0 395.868 3.053 20 5 GGBDRN CCOc1ccc([C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C(C)C)cc1OCC ZINC000055071698 1406881568 /nfs/dbraw/zinc/88/15/68/1406881568.db2.gz GGQJMVUPMNUORA-LJQANCHMSA-N 0 0 390.440 3.102 20 5 GGBDRN CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(C)c(C)c1 ZINC000055106020 1406886482 /nfs/dbraw/zinc/88/64/82/1406886482.db2.gz DTHHIWGRTGELOF-CQSZACIVSA-N 0 0 391.449 3.295 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCC(c3ccc(O)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000055124356 1406890965 /nfs/dbraw/zinc/89/09/65/1406890965.db2.gz RHRZXURSAMBJME-UHFFFAOYSA-N 0 0 398.415 3.497 20 5 GGBDRN O=C(NCCc1cnn(-c2ccccc2)c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000055145478 1406892677 /nfs/dbraw/zinc/89/26/77/1406892677.db2.gz GFXTWGHYVPLPIO-UHFFFAOYSA-N 0 0 375.388 3.234 20 5 GGBDRN COC(=O)c1cc(NC(=O)CCOc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000055173792 1406897671 /nfs/dbraw/zinc/89/76/71/1406897671.db2.gz OTOSBNRSUGGYNJ-UHFFFAOYSA-N 0 0 378.768 3.442 20 5 GGBDRN CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1cccc(Cl)c1 ZINC000055186531 1406899603 /nfs/dbraw/zinc/89/96/03/1406899603.db2.gz HPUGTTBXIZUNDX-GFCCVEGCSA-N 0 0 397.840 3.331 20 5 GGBDRN CCCCc1noc([C@H](C)S(=O)(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)n1 ZINC000055209012 1406902683 /nfs/dbraw/zinc/90/26/83/1406902683.db2.gz XMKSRUKLMMLQLE-NSHDSACASA-N 0 0 383.426 3.005 20 5 GGBDRN CCOc1ccc([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cc1OC ZINC000055219189 1406905601 /nfs/dbraw/zinc/90/56/01/1406905601.db2.gz YZJQPORDSKKBTJ-LLVKDONJSA-N 0 0 398.412 3.181 20 5 GGBDRN O=C(Oc1ccc2c(c1)CCC(=O)N2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000055253421 1406913900 /nfs/dbraw/zinc/91/39/00/1406913900.db2.gz GHHQHMGHBJZUNR-UHFFFAOYSA-N 0 0 381.388 3.299 20 5 GGBDRN COc1ccc(CCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(OC)c1OC ZINC000055283842 1406919465 /nfs/dbraw/zinc/91/94/65/1406919465.db2.gz KXMFOVNTFXXIPH-UHFFFAOYSA-N 0 0 388.420 3.212 20 5 GGBDRN CC[C@H](NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000055296780 1406923982 /nfs/dbraw/zinc/92/39/82/1406923982.db2.gz XEHVPGQSTVNZFK-AWEZNQCLSA-N 0 0 392.433 3.104 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(C(=O)CCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000176268818 1428210040 /nfs/dbraw/zinc/21/00/40/1428210040.db2.gz ANROQVMXAQKFOM-UHFFFAOYSA-N 0 0 395.459 3.211 20 5 GGBDRN C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)NCc1ccccc1 ZINC000055350324 1406936845 /nfs/dbraw/zinc/93/68/45/1406936845.db2.gz YDHGAAVIOBEZFV-GFCCVEGCSA-N 0 0 383.429 3.244 20 5 GGBDRN C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)NCc1ccccc1 ZINC000055350322 1406937025 /nfs/dbraw/zinc/93/70/25/1406937025.db2.gz YDHGAAVIOBEZFV-LBPRGKRZSA-N 0 0 383.429 3.244 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1nc2c(s1)CCCCCC2 ZINC000055374845 1406942767 /nfs/dbraw/zinc/94/27/67/1406942767.db2.gz YFSOIVQPIPDJJT-UHFFFAOYSA-N 0 0 388.449 3.079 20 5 GGBDRN COC(=O)COc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000055363180 1406940043 /nfs/dbraw/zinc/94/00/43/1406940043.db2.gz RTNIAUDGNSKANV-UHFFFAOYSA-N 0 0 396.302 3.000 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000001982777 1398303788 /nfs/dbraw/zinc/30/37/88/1398303788.db2.gz PAVCTBTXYRGZOH-JTQLQIEISA-N 0 0 378.768 3.441 20 5 GGBDRN COc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000001982779 1398303986 /nfs/dbraw/zinc/30/39/86/1398303986.db2.gz FWXGKJPGYHDBCF-JTQLQIEISA-N 0 0 378.768 3.441 20 5 GGBDRN O=C(COC(=O)Cc1ccccc1[N+](=O)[O-])Nc1ccccc1C(F)(F)F ZINC000002665105 1398317421 /nfs/dbraw/zinc/31/74/21/1398317421.db2.gz FEIYBAKFBZYYEP-UHFFFAOYSA-N 0 0 382.294 3.338 20 5 GGBDRN O=C(COC(=O)c1ccccc1[N+](=O)[O-])N1CCC(Cc2ccccc2)CC1 ZINC000003245260 1398329914 /nfs/dbraw/zinc/32/99/14/1398329914.db2.gz SZVPIIALGDSZHS-UHFFFAOYSA-N 0 0 382.416 3.233 20 5 GGBDRN O=C(COC(=O)CCc1nc2ccccc2s1)Nc1cccc([N+](=O)[O-])c1 ZINC000003245514 1398330004 /nfs/dbraw/zinc/33/00/04/1398330004.db2.gz UNYMPHGNRCPLEP-UHFFFAOYSA-N 0 0 385.401 3.319 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccc(F)cc1F ZINC000003270438 1398331435 /nfs/dbraw/zinc/33/14/35/1398331435.db2.gz KUBHBCHNIJWZKJ-SECBINFHSA-N 0 0 380.303 3.066 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cc(C)nn2-c2ccccc2)cc([N+](=O)[O-])c1 ZINC000003280054 1398332153 /nfs/dbraw/zinc/33/21/53/1398332153.db2.gz TWMYTYAHMKTEFQ-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN CCCC(=O)Nc1ccc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000055389748 1406946479 /nfs/dbraw/zinc/94/64/79/1406946479.db2.gz UURMCWLRMQWKPT-UHFFFAOYSA-N 0 0 385.420 3.419 20 5 GGBDRN C[C@H](OC(=O)c1ccc(C=O)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000003386147 1398339866 /nfs/dbraw/zinc/33/98/66/1398339866.db2.gz KCINYIXKSZELBY-JTQLQIEISA-N 0 0 376.752 3.245 20 5 GGBDRN C[C@H](OC(=O)COc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000003388655 1398340293 /nfs/dbraw/zinc/34/02/93/1398340293.db2.gz YSCHUYGSTUCITD-NSHDSACASA-N 0 0 378.768 3.197 20 5 GGBDRN COc1cc(NC(=O)COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc(OC)c1 ZINC000003386873 1398340523 /nfs/dbraw/zinc/34/05/23/1398340523.db2.gz SSQUOSBMQDWALI-UHFFFAOYSA-N 0 0 394.767 3.061 20 5 GGBDRN COc1cc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc(OC)c1C ZINC000003387625 1398340552 /nfs/dbraw/zinc/34/05/52/1398340552.db2.gz IJNZVBGCVIFDPA-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1c(F)cccc1F ZINC000003396614 1398341987 /nfs/dbraw/zinc/34/19/87/1398341987.db2.gz PPWRNOCPKGYXQI-VIFPVBQESA-N 0 0 380.303 3.066 20 5 GGBDRN C[C@H](OC(=O)c1ccc(N(C)C)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000003400660 1398342520 /nfs/dbraw/zinc/34/25/20/1398342520.db2.gz PJLXGOYXCGVRND-NSHDSACASA-N 0 0 391.811 3.498 20 5 GGBDRN COc1ccc(CCC(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000003404611 1398343317 /nfs/dbraw/zinc/34/33/17/1398343317.db2.gz ZXXAFUHGNMCZBS-UHFFFAOYSA-N 0 0 392.795 3.371 20 5 GGBDRN COc1ccc(CCC(=O)OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000003404621 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/nfs/dbraw/zinc/25/59/59/1399255959.db2.gz SIAQCZNMRNKODO-LLVKDONJSA-N 0 0 384.348 3.104 20 5 GGBDRN CCCn1c2ccccc2n(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1=O ZINC000016699655 1399256443 /nfs/dbraw/zinc/25/64/43/1399256443.db2.gz AUTFAGUWMNJNNW-UHFFFAOYSA-N 0 0 382.420 3.458 20 5 GGBDRN CC(=O)NCc1ccc(-c2csc(NC(=O)c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000016724024 1399258683 /nfs/dbraw/zinc/25/86/83/1399258683.db2.gz ZXYABZZCVXHKKE-UHFFFAOYSA-N 0 0 386.389 3.200 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC=C(c3ccc(C)cc3)CC2)cc1[N+](=O)[O-] ZINC000016736867 1399259338 /nfs/dbraw/zinc/25/93/38/1399259338.db2.gz HQBKDXJUPTWSQA-UHFFFAOYSA-N 0 0 388.445 3.390 20 5 GGBDRN O=C(Cc1cccc2ccccc21)OCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000016743057 1399259797 /nfs/dbraw/zinc/25/97/97/1399259797.db2.gz VGTWQDKZQAZRGP-UHFFFAOYSA-N 0 0 390.395 3.423 20 5 GGBDRN CSc1ccc(C(=O)COC(=O)c2ccccc2[N+](=O)[O-])cc1NC(C)=O ZINC000016742718 1399259913 /nfs/dbraw/zinc/25/99/13/1399259913.db2.gz UGMRBFDKDXBVTM-UHFFFAOYSA-N 0 0 388.401 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ZINC000021783530 1399409277 /nfs/dbraw/zinc/40/92/77/1399409277.db2.gz MEDCOYKMLWFVRZ-UHFFFAOYSA-N 0 0 382.328 3.393 20 5 GGBDRN COc1cc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc(OC)c1OC ZINC000021819111 1399410519 /nfs/dbraw/zinc/41/05/19/1399410519.db2.gz HXCYCKMNAGTJPA-LLVKDONJSA-N 0 0 375.381 3.060 20 5 GGBDRN COc1cc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC ZINC000021819252 1399410746 /nfs/dbraw/zinc/41/07/46/1399410746.db2.gz BWKPYJLQOVSIGJ-NSHDSACASA-N 0 0 375.381 3.060 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)c3ccccc3[N+](=O)[O-])ccc12 ZINC000021821606 1399411384 /nfs/dbraw/zinc/41/13/84/1399411384.db2.gz SLWZWUDOKZFJDW-UHFFFAOYSA-N 0 0 375.358 3.031 20 5 GGBDRN COc1ccc([C@@H](NC(=O)COC(=O)c2cccc(C)c2[N+](=O)[O-])C2CC2)cc1 ZINC000021835567 1399412963 /nfs/dbraw/zinc/41/29/63/1399412963.db2.gz LOXYBGAJKSLHHC-IBGZPJMESA-N 0 0 398.415 3.336 20 5 GGBDRN CCCCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000021874622 1399418381 /nfs/dbraw/zinc/41/83/81/1399418381.db2.gz HDDMNZHBQDFTOR-UHFFFAOYSA-N 0 0 391.449 3.234 20 5 GGBDRN Cc1cc(=O)c(C(=O)NCc2ccccc2Cl)nn1-c1ccccc1[N+](=O)[O-] ZINC000021889185 1399419510 /nfs/dbraw/zinc/41/95/10/1399419510.db2.gz FPDXUTCBOJOANQ-UHFFFAOYSA-N 0 0 398.806 3.033 20 5 GGBDRN Cc1cc(=O)c(C(=O)OCc2ccccc2Cl)nn1-c1ccccc1[N+](=O)[O-] ZINC000021888451 1399419564 /nfs/dbraw/zinc/41/95/64/1399419564.db2.gz NFKKVXMFXBPLAE-UHFFFAOYSA-N 0 0 399.790 3.460 20 5 GGBDRN CCCC[C@H](CC)CNC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000021887238 1399419615 /nfs/dbraw/zinc/41/96/15/1399419615.db2.gz CPHGUMJWKMLOFD-HNNXBMFYSA-N 0 0 386.452 3.395 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2c3ccccc3C[C@@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000021887196 1399419793 /nfs/dbraw/zinc/41/97/93/1399419793.db2.gz CANAZNSUPBIPDN-ZDUSSCGKSA-N 0 0 390.399 3.041 20 5 GGBDRN CCOC(=O)N1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000021894660 1399420536 /nfs/dbraw/zinc/42/05/36/1399420536.db2.gz BLACZMXIPSDZPH-UHFFFAOYSA-N 0 0 398.419 3.253 20 5 GGBDRN COc1ccc(C2=N/C(=C/c3c(C)nc4sc(C)cn34)C(=O)O2)cc1[N+](=O)[O-] ZINC000021956668 1399427144 /nfs/dbraw/zinc/42/71/44/1399427144.db2.gz MKKXLBMAKJWPEB-KPKJPENVSA-N 0 0 398.400 3.274 20 5 GGBDRN COc1c(Br)c([N+](=O)[O-])c(NCCc2ccccn2)cc1[N+](=O)[O-] ZINC000021964966 1399427377 /nfs/dbraw/zinc/42/73/77/1399427377.db2.gz RWKZQNUSNHYCQI-UHFFFAOYSA-N 0 0 397.185 3.324 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCCc3cc(OC)ccc32)cc([N+](=O)[O-])c1 ZINC000021975765 1399428375 /nfs/dbraw/zinc/42/83/75/1399428375.db2.gz UTWDCDAPEWMXCA-UHFFFAOYSA-N 0 0 384.388 3.373 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OCc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000021998491 1399430013 /nfs/dbraw/zinc/43/00/13/1399430013.db2.gz PMQRNRMXMKFAAS-UHFFFAOYSA-N 0 0 382.413 3.343 20 5 GGBDRN O=C(COC(=O)CSc1ccc(F)cc1)Nc1cc([N+](=O)[O-])ccc1F ZINC000022015112 1399431592 /nfs/dbraw/zinc/43/15/92/1399431592.db2.gz AWZLALKBNKCUAJ-UHFFFAOYSA-N 0 0 382.344 3.147 20 5 GGBDRN Cc1ccc(OCC(=O)Nc2cc(Cl)ccc2-n2cncn2)c([N+](=O)[O-])c1 ZINC000022051966 1399434133 /nfs/dbraw/zinc/43/41/33/1399434133.db2.gz NWJDTPRVBSCKCC-UHFFFAOYSA-N 0 0 387.783 3.155 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)C(=O)COc1ccc(C)cc1[N+](=O)[O-] ZINC000022051872 1399434200 /nfs/dbraw/zinc/43/42/00/1399434200.db2.gz CLEWXUBTCOSJDQ-UHFFFAOYSA-N 0 0 399.447 3.468 20 5 GGBDRN CC(=O)NCc1ccc(-c2csc(NC(=O)c3ccccc3[N+](=O)[O-])n2)o1 ZINC000022067554 1399434968 /nfs/dbraw/zinc/43/49/68/1399434968.db2.gz XTTLFPSHQMFVLU-UHFFFAOYSA-N 0 0 386.389 3.200 20 5 GGBDRN Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000022095399 1399436306 /nfs/dbraw/zinc/43/63/06/1399436306.db2.gz RCMXKOYXGDVWNT-CABCVRRESA-N 0 0 386.404 3.091 20 5 GGBDRN C[C@H](OC(=O)CSc1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000022097244 1399436938 /nfs/dbraw/zinc/43/69/38/1399436938.db2.gz INVHMYTYPOCYJJ-NSHDSACASA-N 0 0 378.381 3.396 20 5 GGBDRN COc1ccccc1NC(=O)Cc1noc(COc2ccc([N+](=O)[O-])c(C)c2)n1 ZINC000022187628 1399442516 /nfs/dbraw/zinc/44/25/16/1399442516.db2.gz FUICLAYJGFQDIM-UHFFFAOYSA-N 0 0 398.375 3.055 20 5 GGBDRN CCC(C)(C)NC(=O)[C@@H](C)OC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000022184159 1399442551 /nfs/dbraw/zinc/44/25/51/1399442551.db2.gz WGGJHJQTUPMBFV-SECBINFHSA-N 0 0 387.230 3.207 20 5 GGBDRN Cc1ccc(C(=O)C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cc1 ZINC000022189318 1399443034 /nfs/dbraw/zinc/44/30/34/1399443034.db2.gz TWLJZPFGFPVHNM-KRWDZBQOSA-N 0 0 398.415 3.285 20 5 GGBDRN CC(C)N(Cc1ccccc1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000022197304 1399444826 /nfs/dbraw/zinc/44/48/26/1399444826.db2.gz AQGPBCNOZWFHAY-UHFFFAOYSA-N 0 0 387.461 3.223 20 5 GGBDRN COc1cc(C(=O)Nc2cnc3c(cnn3C(C)C)c2)c([N+](=O)[O-])cc1OC ZINC000022258461 1399448074 /nfs/dbraw/zinc/44/80/74/1399448074.db2.gz KCOXONFZIOZDJA-UHFFFAOYSA-N 0 0 385.380 3.190 20 5 GGBDRN C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)NCC(F)(F)F ZINC000022254561 1399448202 /nfs/dbraw/zinc/44/82/02/1399448202.db2.gz HSNMMEKLKGXODF-SNVBAGLBSA-N 0 0 395.406 3.246 20 5 GGBDRN CNc1ccc(C(=O)OCC(=O)N[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000022272684 1399449615 /nfs/dbraw/zinc/44/96/15/1399449615.db2.gz GCBQRNSALJJHFJ-IBGZPJMESA-N 0 0 383.404 3.061 20 5 GGBDRN CNc1ccc(C(=O)O[C@H](C)C(=O)N(C)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000022273140 1399449639 /nfs/dbraw/zinc/44/96/39/1399449639.db2.gz JNNJQODLXQGQRX-CQSZACIVSA-N 0 0 385.420 3.149 20 5 GGBDRN CNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cc(F)ccc2C)cc1[N+](=O)[O-] ZINC000022272971 1399449671 /nfs/dbraw/zinc/44/96/71/1399449671.db2.gz LPHNUEUEUQCXCW-NSHDSACASA-N 0 0 375.356 3.268 20 5 GGBDRN CNc1ccc(C(=O)O[C@H](C)C(=O)N[C@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000022273039 1399449705 /nfs/dbraw/zinc/44/97/05/1399449705.db2.gz SQYZPOQPPINWSI-ZIAGYGMSSA-N 0 0 385.420 3.368 20 5 GGBDRN CNc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000022273034 1399449746 /nfs/dbraw/zinc/44/97/46/1399449746.db2.gz SQYZPOQPPINWSI-UONOGXRCSA-N 0 0 385.420 3.368 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccco3)n2C)cccc1[N+](=O)[O-] ZINC000022279278 1399450247 /nfs/dbraw/zinc/45/02/47/1399450247.db2.gz JAUAKYKXMPNZCC-LLVKDONJSA-N 0 0 387.421 3.411 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccco3)n2C)cccc1[N+](=O)[O-] ZINC000022279281 1399450463 /nfs/dbraw/zinc/45/04/63/1399450463.db2.gz JAUAKYKXMPNZCC-NSHDSACASA-N 0 0 387.421 3.411 20 5 GGBDRN COC(=O)c1ccc2c(=O)[nH]c(C(Cl)=Cc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000022347229 1399455605 /nfs/dbraw/zinc/45/56/05/1399455605.db2.gz SHCAHPMFELAWPW-ZSOIEALJSA-N 0 0 385.763 3.355 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccccc1C(=O)NCCc1ccccc1 ZINC000022380534 1399459136 /nfs/dbraw/zinc/45/91/36/1399459136.db2.gz FWOAWDBDKQQWPN-UHFFFAOYSA-N 0 0 392.415 3.158 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cccc(C(F)(F)F)c1 ZINC000022391419 1399460386 /nfs/dbraw/zinc/46/03/86/1399460386.db2.gz NDCOWQHIHCFGTK-UHFFFAOYSA-N 0 0 381.266 3.160 20 5 GGBDRN C[C@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccnc1Cl ZINC000022414671 1399462140 /nfs/dbraw/zinc/46/21/40/1399462140.db2.gz LQFBVOIASFGHEH-QMMMGPOBSA-N 0 0 384.175 3.481 20 5 GGBDRN COc1ccc([C@H](NC(=O)COc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000022435793 1399464257 /nfs/dbraw/zinc/46/42/57/1399464257.db2.gz MOJDYNWKSYXVQP-HXUWFJFHSA-N 0 0 386.404 3.258 20 5 GGBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccccc1Br ZINC000022445383 1399465053 /nfs/dbraw/zinc/46/50/53/1399465053.db2.gz YQXIZJFHROLCCY-QMMMGPOBSA-N 0 0 383.154 3.134 20 5 GGBDRN COc1cccc(CNC(=O)[C@@H](C)OC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000022468317 1399466341 /nfs/dbraw/zinc/46/63/41/1399466341.db2.gz NDOJDTHUHPVMKY-LLVKDONJSA-N 0 0 392.795 3.119 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@H](C)OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000022468382 1399466511 /nfs/dbraw/zinc/46/65/11/1399466511.db2.gz NOYCFSWJLMUMAA-ZDUSSCGKSA-N 0 0 390.823 3.461 20 5 GGBDRN C[C@@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000022471699 1399466819 /nfs/dbraw/zinc/46/68/19/1399466819.db2.gz IAICQESBHPKYHW-SECBINFHSA-N 0 0 394.286 3.100 20 5 GGBDRN COc1ccc(N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c(OC)c1 ZINC000022471439 1399467018 /nfs/dbraw/zinc/46/70/18/1399467018.db2.gz FQBIOZNHEOVSDO-NSHDSACASA-N 0 0 375.381 3.060 20 5 GGBDRN O=C(Cc1cccc2ccccc21)OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022476556 1399467599 /nfs/dbraw/zinc/46/75/99/1399467599.db2.gz MPDRRLMSSUQOEE-UHFFFAOYSA-N 0 0 390.395 3.423 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)CCC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000022486820 1399468615 /nfs/dbraw/zinc/46/86/15/1399468615.db2.gz YTLXRKRUILNQSA-LBPRGKRZSA-N 0 0 390.417 3.498 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(Cl)cc1 ZINC000022488416 1399468737 /nfs/dbraw/zinc/46/87/37/1399468737.db2.gz IRQIXGAKBJNYHC-WDEREUQCSA-N 0 0 391.811 3.253 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000022488886 1399468895 /nfs/dbraw/zinc/46/88/95/1399468895.db2.gz 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IBNVANXMBGHFEP-UHFFFAOYSA-N 0 0 388.855 3.315 20 5 GGBDRN COc1ccccc1NC(=O)C1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000044505132 1403940229 /nfs/dbraw/zinc/94/02/29/1403940229.db2.gz BBGMSJHJRHRJQN-UHFFFAOYSA-N 0 0 389.433 3.156 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000044507214 1403940854 /nfs/dbraw/zinc/94/08/54/1403940854.db2.gz GWVCTYDVAKLLLO-UHFFFAOYSA-N 0 0 377.422 3.156 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1)n1cccn1 ZINC000044506061 1403940960 /nfs/dbraw/zinc/94/09/60/1403940960.db2.gz GCABAXGZIHXIGE-NSHDSACASA-N 0 0 385.405 3.305 20 5 GGBDRN COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000044523574 1403943122 /nfs/dbraw/zinc/94/31/22/1403943122.db2.gz JBNALJMUYMCJDA-HNNXBMFYSA-N 0 0 376.434 3.486 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2COC)cc1OC ZINC000044550655 1403949297 /nfs/dbraw/zinc/94/92/97/1403949297.db2.gz CFZKJVWFXBNNLQ-UHFFFAOYSA-N 0 0 390.392 3.027 20 5 GGBDRN CC(C)Oc1cccc([C@@H](C)NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000044555687 1403950604 /nfs/dbraw/zinc/95/06/04/1403950604.db2.gz VMGLLAUSEXPWGN-CQSZACIVSA-N 0 0 395.419 3.454 20 5 GGBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000044571861 1403953329 /nfs/dbraw/zinc/95/33/29/1403953329.db2.gz JCSGFBBXGNETIM-UHFFFAOYSA-N 0 0 382.420 3.432 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nnco3)cc2)cc1OC ZINC000044575617 1403954921 /nfs/dbraw/zinc/95/49/21/1403954921.db2.gz AIVZMPULZFOUIE-UHFFFAOYSA-N 0 0 384.348 3.304 20 5 GGBDRN O=C(c1cc(-c2ccccc2)no1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000044614558 1403963583 /nfs/dbraw/zinc/96/35/83/1403963583.db2.gz NKIAZWLVYYJHDS-UHFFFAOYSA-N 0 0 378.388 3.212 20 5 GGBDRN C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(NC(=O)NC2CC2)cc1 ZINC000044628465 1403966852 /nfs/dbraw/zinc/96/68/52/1403966852.db2.gz HKUWZECLKBBCHT-ZDUSSCGKSA-N 0 0 382.420 3.299 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2CNC(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000044638109 1403970973 /nfs/dbraw/zinc/97/09/73/1403970973.db2.gz WTPFJUBXJOKHNP-IYBDPMFKSA-N 0 0 383.448 3.134 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000044638323 1403971413 /nfs/dbraw/zinc/97/14/13/1403971413.db2.gz ZKUVJECIGBWNDZ-IAGOWNOFSA-N 0 0 397.475 3.063 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2CNC(=O)c2csc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000044638367 1403971769 /nfs/dbraw/zinc/97/17/69/1403971769.db2.gz PRTJGDRWTIOEDB-OKILXGFUSA-N 0 0 389.477 3.196 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2CNC(=O)c2csc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000044638369 1403971913 /nfs/dbraw/zinc/97/19/13/1403971913.db2.gz PRTJGDRWTIOEDB-KBPBESRZSA-N 0 0 389.477 3.196 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)ccc1[N+](=O)[O-] ZINC000044656178 1403975958 /nfs/dbraw/zinc/97/59/58/1403975958.db2.gz RCOMIGGVIPAICW-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccc(C(=O)NCc2ccccn2)c1 ZINC000044656868 1403975965 /nfs/dbraw/zinc/97/59/65/1403975965.db2.gz RDAULLFHRORUMQ-UHFFFAOYSA-N 0 0 390.399 3.101 20 5 GGBDRN Cc1ccc(OCCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1C ZINC000044668455 1403980860 /nfs/dbraw/zinc/98/08/60/1403980860.db2.gz RODYUIFQNPALQN-UHFFFAOYSA-N 0 0 383.448 3.329 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1cccc(C(F)(F)F)c1 ZINC000044675515 1403982263 /nfs/dbraw/zinc/98/22/63/1403982263.db2.gz QJDYKOCEYVHKCE-NSHDSACASA-N 0 0 395.337 3.048 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(NC(=O)Nc2ccccc2)cc1 ZINC000044695318 1403985556 /nfs/dbraw/zinc/98/55/56/1403985556.db2.gz APQVLFQACOGTLK-UHFFFAOYSA-N 0 0 380.364 3.074 20 5 GGBDRN CCc1nc(NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)sc1C ZINC000044701833 1403987164 /nfs/dbraw/zinc/98/71/64/1403987164.db2.gz ISHOYOSJQVYDLS-UHFFFAOYSA-N 0 0 399.432 3.029 20 5 GGBDRN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000044735897 1403990988 /nfs/dbraw/zinc/99/09/88/1403990988.db2.gz YFJTXURRCKYXMG-UHFFFAOYSA-N 0 0 382.420 3.236 20 5 GGBDRN COc1ccc(Cl)cc1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000044737919 1403991727 /nfs/dbraw/zinc/99/17/27/1403991727.db2.gz WVPOEIFBHMMMKU-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN CC(C)c1ccc(OCCNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000044738651 1403992439 /nfs/dbraw/zinc/99/24/39/1403992439.db2.gz ZHBWLUGRRKRWLL-UHFFFAOYSA-N 0 0 395.419 3.108 20 5 GGBDRN Cc1ccccc1N1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000044761667 1403997242 /nfs/dbraw/zinc/99/72/42/1403997242.db2.gz JTEDUSJZQOZYHD-UHFFFAOYSA-N 0 0 395.868 3.068 20 5 GGBDRN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000044760436 1403997296 /nfs/dbraw/zinc/99/72/96/1403997296.db2.gz MALYJZNBAXEDNX-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN COc1ccc(CN(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000044769982 1403997928 /nfs/dbraw/zinc/99/79/28/1403997928.db2.gz KPPRSPHIYMBNTQ-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN COc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccc1NC(C)=O ZINC000044771327 1403998489 /nfs/dbraw/zinc/99/84/89/1403998489.db2.gz DKYFPLNHLKNQOS-UHFFFAOYSA-N 0 0 384.392 3.388 20 5 GGBDRN Cc1cccc(N2CCN(S(=O)(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000044771045 1403998637 /nfs/dbraw/zinc/99/86/37/1403998637.db2.gz LUJKIBUEGOWSBW-UHFFFAOYSA-N 0 0 395.868 3.068 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1[N+](=O)[O-] ZINC000044857836 1404013729 /nfs/dbraw/zinc/01/37/29/1404013729.db2.gz CHYPGACADGTANZ-INIZCTEOSA-N 0 0 392.433 3.262 20 5 GGBDRN CC(=O)N1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000044985282 1404029855 /nfs/dbraw/zinc/02/98/55/1404029855.db2.gz VVJWXOSOMSKZIB-UHFFFAOYSA-N 0 0 383.404 3.128 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)c1cc(C(C)C)n[nH]1)c1ccccc1[N+](=O)[O-] ZINC000045009119 1404036476 /nfs/dbraw/zinc/03/64/76/1404036476.db2.gz LQZNWUWZHNZVOO-HNNXBMFYSA-N 0 0 388.424 3.254 20 5 GGBDRN O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000045020394 1404038747 /nfs/dbraw/zinc/03/87/47/1404038747.db2.gz DXIUTXNJTMAKDP-KGLIPLIRSA-N 0 0 386.374 3.007 20 5 GGBDRN O=C([C@H]1CCCC[C@H]1C(F)(F)F)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000045020403 1404039038 /nfs/dbraw/zinc/03/90/38/1404039038.db2.gz DXIUTXNJTMAKDP-UONOGXRCSA-N 0 0 386.374 3.007 20 5 GGBDRN Cc1ccc([C@H](NC(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)C2CC2)cc1 ZINC000045022508 1404039412 /nfs/dbraw/zinc/03/94/12/1404039412.db2.gz ALTAPZDLGGOZHW-IBGZPJMESA-N 0 0 381.388 3.079 20 5 GGBDRN COc1cc(CCNC(=O)N[C@@H](C)CCc2ccco2)c([N+](=O)[O-])cc1OC ZINC000045035993 1404041529 /nfs/dbraw/zinc/04/15/29/1404041529.db2.gz WIDBWWBURWAGCQ-ZDUSSCGKSA-N 0 0 391.424 3.068 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCN(C2CCCC2)CC1 ZINC000045085824 1404051241 /nfs/dbraw/zinc/05/12/41/1404051241.db2.gz UKJBQKPICNCLHF-UHFFFAOYSA-N 0 0 389.499 3.242 20 5 GGBDRN Cc1c([C@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000045097420 1404052344 /nfs/dbraw/zinc/05/23/44/1404052344.db2.gz NDBVKTZSGMEGIR-ZDUSSCGKSA-N 0 0 398.394 3.484 20 5 GGBDRN O=C(NCc1cc(Cl)c2c(c1)OCCCO2)NCc1ccccc1[N+](=O)[O-] ZINC000045119996 1404056591 /nfs/dbraw/zinc/05/65/91/1404056591.db2.gz ZERBGOBDZGXEGD-UHFFFAOYSA-N 0 0 391.811 3.409 20 5 GGBDRN COc1cc(CCNC(=O)N(C)C2CCC(C)CC2)c([N+](=O)[O-])cc1OC ZINC000045212452 1404075912 /nfs/dbraw/zinc/07/59/12/1404075912.db2.gz LGOUINUNOGUDET-UHFFFAOYSA-N 0 0 379.457 3.375 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000045213306 1404075999 /nfs/dbraw/zinc/07/59/99/1404075999.db2.gz QXLUNLGCXMAWES-MRXNPFEDSA-N 0 0 385.420 3.311 20 5 GGBDRN CC(C)Oc1ccc([C@@H](C)NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000045237518 1404079758 /nfs/dbraw/zinc/07/97/58/1404079758.db2.gz CZCSPWIRJQBHCJ-OAHLLOKOSA-N 0 0 399.447 3.379 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCn2cccc2[C@@H]1c1ccccc1 ZINC000045248691 1404082982 /nfs/dbraw/zinc/08/29/82/1404082982.db2.gz PXSIEMURLXZGGN-NRFANRHFSA-N 0 0 377.400 3.407 20 5 GGBDRN C[C@@H](c1cc(F)ccc1F)N(C)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000045259676 1404086510 /nfs/dbraw/zinc/08/65/10/1404086510.db2.gz UEUDBGGAJZUVSC-LBPRGKRZSA-N 0 0 391.374 3.213 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000045268726 1404089285 /nfs/dbraw/zinc/08/92/85/1404089285.db2.gz FZPBGMNFSSCTRL-UHFFFAOYSA-N 0 0 395.419 3.107 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC(OCc2ccccc2)CC1 ZINC000045308589 1404095981 /nfs/dbraw/zinc/09/59/81/1404095981.db2.gz JLHMDFVHCOSYTD-UHFFFAOYSA-N 0 0 380.404 3.293 20 5 GGBDRN COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)Nc1ccc([N+](=O)[O-])cc1)CC3 ZINC000045312426 1404096983 /nfs/dbraw/zinc/09/69/83/1404096983.db2.gz PTDWTORGWWXLLX-UHFFFAOYSA-N 0 0 394.387 3.453 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000045313527 1404097495 /nfs/dbraw/zinc/09/74/95/1404097495.db2.gz MPCYKDFGYZRIEA-UHFFFAOYSA-N 0 0 388.387 3.277 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000045331273 1404099482 /nfs/dbraw/zinc/09/94/82/1404099482.db2.gz VNXNHBBJEDRBAD-UHFFFAOYSA-N 0 0 377.347 3.282 20 5 GGBDRN CCOc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 ZINC000045332503 1404100261 /nfs/dbraw/zinc/10/02/61/1404100261.db2.gz KWLGALDPKQVDGS-UHFFFAOYSA-N 0 0 399.447 3.102 20 5 GGBDRN O=C(Nc1cccc(OC[C@H]2CCCO2)c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000045347562 1404103709 /nfs/dbraw/zinc/10/37/09/1404103709.db2.gz LQKGKXPXHCSGAP-OAHLLOKOSA-N 0 0 382.376 3.281 20 5 GGBDRN CN(CCc1ccccc1)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000045366408 1404108023 /nfs/dbraw/zinc/10/80/23/1404108023.db2.gz KIGQOPCXPMRZJJ-UHFFFAOYSA-N 0 0 397.460 3.189 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(CC)Cc2ccc(OC)cc2)cc([N+](=O)[O-])c1 ZINC000045397960 1404113339 /nfs/dbraw/zinc/11/33/39/1404113339.db2.gz CFSXFDAQWBGDPR-UHFFFAOYSA-N 0 0 386.404 3.442 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCc1ccc(-n2cccn2)cc1 ZINC000045401211 1404114521 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ZINC000046067100 1404288192 /nfs/dbraw/zinc/28/81/92/1404288192.db2.gz QWZLVKWYOQJYEZ-UHFFFAOYSA-N 0 0 378.388 3.089 20 5 GGBDRN CC(C)NC(=O)CSc1ccccc1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000046135880 1404309122 /nfs/dbraw/zinc/30/91/22/1404309122.db2.gz SLUMBPWUIRXFMK-UHFFFAOYSA-N 0 0 387.461 3.142 20 5 GGBDRN CCCCCn1nc(C(=O)NCc2ccccc2[N+](=O)[O-])c2ccccc2c1=O ZINC000046136572 1404310053 /nfs/dbraw/zinc/31/00/53/1404310053.db2.gz ZUHPULUVYQWMQG-UHFFFAOYSA-N 0 0 394.431 3.425 20 5 GGBDRN O=C(CSc1ccccc1C(=O)NCc1ccccc1[N+](=O)[O-])N1CCCC1 ZINC000046136705 1404310245 /nfs/dbraw/zinc/31/02/45/1404310245.db2.gz JGCLXXHJTWZMTD-UHFFFAOYSA-N 0 0 399.472 3.239 20 5 GGBDRN COc1cc(C(C)=O)ccc1OCCCC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000046148556 1404311227 /nfs/dbraw/zinc/31/12/27/1404311227.db2.gz AZTOKTNJMRPIRG-UHFFFAOYSA-N 0 0 386.404 3.281 20 5 GGBDRN Cc1ccc(-n2cnnc2SCC(=O)NCc2ccccc2[N+](=O)[O-])cc1C ZINC000046147543 1404311293 /nfs/dbraw/zinc/31/12/93/1404311293.db2.gz CBPOCFIFLZENLE-UHFFFAOYSA-N 0 0 397.460 3.201 20 5 GGBDRN Cc1ccc(OC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000046165033 1404317262 /nfs/dbraw/zinc/31/72/62/1404317262.db2.gz MOUKHDHJEBUUMY-KRWDZBQOSA-N 0 0 382.416 3.290 20 5 GGBDRN Cc1ccc(OC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000046165032 1404317611 /nfs/dbraw/zinc/31/76/11/1404317611.db2.gz MOUKHDHJEBUUMY-QGZVFWFLSA-N 0 0 382.416 3.290 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1 ZINC000046178913 1404321734 /nfs/dbraw/zinc/32/17/34/1404321734.db2.gz RBQGECKLLQVYKS-UHFFFAOYSA-N 0 0 380.404 3.499 20 5 GGBDRN CCOCc1ccccc1CNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000046179607 1404322635 /nfs/dbraw/zinc/32/26/35/1404322635.db2.gz RUTFTDZJVZMPBM-UHFFFAOYSA-N 0 0 398.463 3.163 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCC[C@H]2c2cc(C)on2)cc1[N+](=O)[O-] ZINC000046198043 1404328398 /nfs/dbraw/zinc/32/83/98/1404328398.db2.gz DDXABUAVRWMKII-HNNXBMFYSA-N 0 0 391.449 3.497 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCNC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000046202134 1404330007 /nfs/dbraw/zinc/33/00/07/1404330007.db2.gz JDDNJXHAISTSLL-UHFFFAOYSA-N 0 0 375.450 3.114 20 5 GGBDRN CC(C)(C)c1nc(COC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cs1 ZINC000046209927 1404331845 /nfs/dbraw/zinc/33/18/45/1404331845.db2.gz LKYKEVMGDRJHGX-UHFFFAOYSA-N 0 0 398.462 3.109 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CCn1c(=O)oc2cc(Cl)ccc21 ZINC000046223536 1404336353 /nfs/dbraw/zinc/33/63/53/1404336353.db2.gz LTGPBMAKKUIZPG-UHFFFAOYSA-N 0 0 389.795 3.205 20 5 GGBDRN CCc1ccccc1N1C[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC1=O ZINC000046223388 1404336434 /nfs/dbraw/zinc/33/64/34/1404336434.db2.gz RHIKTTCEZYATKF-QGZVFWFLSA-N 0 0 381.432 3.169 20 5 GGBDRN CN(c1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1F)C1CCCCC1 ZINC000046226356 1404338091 /nfs/dbraw/zinc/33/80/91/1404338091.db2.gz BLIQCTZFMZKMER-UHFFFAOYSA-N 0 0 375.404 3.338 20 5 GGBDRN COCCCNc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000046231118 1404338931 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ZINC000047353952 1404814173 /nfs/dbraw/zinc/81/41/73/1404814173.db2.gz TWEZXFSMEAMDQR-NRFANRHFSA-N 0 0 395.415 3.059 20 5 GGBDRN C[C@H]1C(=O)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C(=O)N1c1ccccc1 ZINC000047354618 1404814239 /nfs/dbraw/zinc/81/42/39/1404814239.db2.gz WWDBVIZDSULSQM-LBPRGKRZSA-N 0 0 393.359 3.002 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@@](C)(c3cc4ccccc4o3)C2=O)cc1[N+](=O)[O-] ZINC000047354289 1404814250 /nfs/dbraw/zinc/81/42/50/1404814250.db2.gz OKIBGPGFBVMYFH-FQEVSTJZSA-N 0 0 395.371 3.317 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)N[C@H](c2ccc(C)cc2)C2CC2)c1 ZINC000047354651 1404814356 /nfs/dbraw/zinc/81/43/56/1404814356.db2.gz PKESNQWBOYLJGI-HXUWFJFHSA-N 0 0 398.415 3.336 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cc(-c3ccccc3)no2)C1=O ZINC000047357431 1404815042 /nfs/dbraw/zinc/81/50/42/1404815042.db2.gz VTOFMEXXXUMHSI-FQEVSTJZSA-N 0 0 392.371 3.217 20 5 GGBDRN Cc1c(CN2C(=O)N[C@](C)(c3ccc(F)cc3F)C2=O)cccc1[N+](=O)[O-] ZINC000047358019 1404815073 /nfs/dbraw/zinc/81/50/73/1404815073.db2.gz RGJLRHGIEXXLOC-GOSISDBHSA-N 0 0 375.331 3.149 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCc2ccc(F)cc21 ZINC000047370489 1404818244 /nfs/dbraw/zinc/81/82/44/1404818244.db2.gz ZBEBQXYGHKVSDS-UHFFFAOYSA-N 0 0 399.378 3.401 20 5 GGBDRN CC(C)(C)c1nc(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cs1 ZINC000047401942 1404827294 /nfs/dbraw/zinc/82/72/94/1404827294.db2.gz ROHWRMVKERRUBX-UHFFFAOYSA-N 0 0 388.493 3.307 20 5 GGBDRN CC(C)NC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000047417107 1404830916 /nfs/dbraw/zinc/83/09/16/1404830916.db2.gz JOSNLQKIFBPZHV-UHFFFAOYSA-N 0 0 397.840 3.187 20 5 GGBDRN CCOc1cc(C(=O)N(C)Cc2nc3ccccc3[nH]2)c([N+](=O)[O-])cc1OC ZINC000047436577 1404836104 /nfs/dbraw/zinc/83/61/04/1404836104.db2.gz VEOSVTWXSLPDEC-UHFFFAOYSA-N 0 0 384.392 3.151 20 5 GGBDRN COC(=O)CCN(CC(C)C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000047483118 1404848899 /nfs/dbraw/zinc/84/88/99/1404848899.db2.gz CIIYFRNZIJMPOF-UHFFFAOYSA-N 0 0 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ZINC000048361070 1405163954 /nfs/dbraw/zinc/16/39/54/1405163954.db2.gz UQCNMYBGMQDZIW-CALCHBBNSA-N 0 0 397.475 3.442 20 5 GGBDRN CCOc1ccc(C(=O)NCc2ccc(N3CCCCC3)nc2)cc1[N+](=O)[O-] ZINC000048371520 1405167739 /nfs/dbraw/zinc/16/77/39/1405167739.db2.gz RROVZUJHWORTNF-UHFFFAOYSA-N 0 0 384.436 3.309 20 5 GGBDRN Cc1nc2cc(F)cc(C(=O)NCCNc3ccccc3[N+](=O)[O-])c2nc1C ZINC000048398517 1405179420 /nfs/dbraw/zinc/17/94/20/1405179420.db2.gz WNUWPSNMDTWXEV-UHFFFAOYSA-N 0 0 383.383 3.136 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(OC(C)C)nc2)cc1OC ZINC000048516023 1405213848 /nfs/dbraw/zinc/21/38/48/1405213848.db2.gz SMZDDWGLRVGACL-UHFFFAOYSA-N 0 0 389.408 3.114 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Oc1ccccc1I ZINC000048527185 1405216339 /nfs/dbraw/zinc/21/63/39/1405216339.db2.gz NFVFHBHHLQKCLC-UHFFFAOYSA-N 0 0 383.141 3.348 20 5 GGBDRN Cc1cc(C(=O)N2CCCN(C(=O)CCc3ccccc3)CC2)cc([N+](=O)[O-])c1 ZINC000176274992 1428214889 /nfs/dbraw/zinc/21/48/89/1428214889.db2.gz GICFIZZLNFBMRP-UHFFFAOYSA-N 0 0 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ZINC000048996960 1405331876 /nfs/dbraw/zinc/33/18/76/1405331876.db2.gz OQVLJSVTKUWQJR-OAHLLOKOSA-N 0 0 399.447 3.208 20 5 GGBDRN O=C(NCCOc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000049023202 1405334302 /nfs/dbraw/zinc/33/43/02/1405334302.db2.gz BJCHOJYNRQSORA-UHFFFAOYSA-N 0 0 398.202 3.035 20 5 GGBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000049085676 1405340192 /nfs/dbraw/zinc/34/01/92/1405340192.db2.gz NWFALSHCBBGJNO-CQSZACIVSA-N 0 0 385.420 3.275 20 5 GGBDRN CCCOc1cc(NC(=O)C(=O)N[C@H](C)C2CC2)c([N+](=O)[O-])cc1OCCC ZINC000049113602 1405341516 /nfs/dbraw/zinc/34/15/16/1405341516.db2.gz UUWHVMJIZUADAK-GFCCVEGCSA-N 0 0 393.440 3.026 20 5 GGBDRN COCCOc1ccc([C@@H](C)NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000049164132 1405347664 /nfs/dbraw/zinc/34/76/64/1405347664.db2.gz KSUQRRGIUUJAMI-CQSZACIVSA-N 0 0 388.420 3.049 20 5 GGBDRN Cc1ccc(SCCNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000049163928 1405347987 /nfs/dbraw/zinc/34/79/87/1405347987.db2.gz 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CC[C@@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000049523046 1405382953 /nfs/dbraw/zinc/38/29/53/1405382953.db2.gz KRSZVAMJGNNKGA-LBPRGKRZSA-N 0 0 375.812 3.497 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OCCO2 ZINC000049581584 1405384457 /nfs/dbraw/zinc/38/44/57/1405384457.db2.gz RMKPRIVOAAJKHX-JTQLQIEISA-N 0 0 378.768 3.425 20 5 GGBDRN O=C(NCCc1cccc2cccnc21)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049636667 1405388804 /nfs/dbraw/zinc/38/88/04/1405388804.db2.gz JQZSYLMATLEUAD-UHFFFAOYSA-N 0 0 387.399 3.301 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000049652030 1405390492 /nfs/dbraw/zinc/39/04/92/1405390492.db2.gz GFEJHUFTPAZSEY-CYBMUJFWSA-N 0 0 393.403 3.230 20 5 GGBDRN O=C(Nc1ccc(-n2nccn2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000049760777 1405407914 /nfs/dbraw/zinc/40/79/14/1405407914.db2.gz CHRJJVVBRSTWQY-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(COc1ccc2c(c1)oc(=O)cc2-c1ccc([N+](=O)[O-])cc1)N1CCCC1 ZINC000049776075 1405414587 /nfs/dbraw/zinc/41/45/87/1405414587.db2.gz QGICPHRZOCMPFL-UHFFFAOYSA-N 0 0 394.383 3.369 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1ccc(Cl)cc1 ZINC000049930368 1405429381 /nfs/dbraw/zinc/42/93/81/1405429381.db2.gz VIPLFMHCDTZFNL-GFCCVEGCSA-N 0 0 375.812 3.025 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1OC)C(=O)c1cccc([N+](=O)[O-])c1C ZINC000049939647 1405432193 /nfs/dbraw/zinc/43/21/93/1405432193.db2.gz LNOHNNIDPOFPCI-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1OC)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000049939650 1405432251 /nfs/dbraw/zinc/43/22/51/1405432251.db2.gz LUOXLPOAPKGTDM-UHFFFAOYSA-N 0 0 385.420 3.023 20 5 GGBDRN CCOC(=O)c1csc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000049961250 1405437385 /nfs/dbraw/zinc/43/73/85/1405437385.db2.gz CRNGEBHTTGJLCS-UHFFFAOYSA-N 0 0 376.394 3.055 20 5 GGBDRN CN(C(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)c1ccc2ccccc2c1 ZINC000050034304 1405459142 /nfs/dbraw/zinc/45/91/42/1405459142.db2.gz 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ZINC000057829022 1407731778 /nfs/dbraw/zinc/73/17/78/1407731778.db2.gz ODGHQOHMLIERMH-ZDUSSCGKSA-N 0 0 381.392 3.070 20 5 GGBDRN Cc1cc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)ccc1N1CCCC1 ZINC000057831434 1407732695 /nfs/dbraw/zinc/73/26/95/1407732695.db2.gz DZVGLYIYLGFTMM-UHFFFAOYSA-N 0 0 396.403 3.050 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCN(c2cccc(Cl)c2)CC1 ZINC000057833744 1407732810 /nfs/dbraw/zinc/73/28/10/1407732810.db2.gz LQCTVXOVIANXTA-UHFFFAOYSA-N 0 0 388.855 3.317 20 5 GGBDRN CCNc1ccc(C(=O)N[C@H](c2nccn2C)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000057851866 1407737988 /nfs/dbraw/zinc/73/79/88/1407737988.db2.gz YJIIFQNKBMOJGR-SFHVURJKSA-N 0 0 397.410 3.419 20 5 GGBDRN CN(CCCOc1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000057856732 1407739707 /nfs/dbraw/zinc/73/97/07/1407739707.db2.gz MUNVTNINZPSIFS-UHFFFAOYSA-N 0 0 382.413 3.043 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1cn2cc(Cl)ccc2n1 ZINC000057858673 1407740960 /nfs/dbraw/zinc/74/09/60/1407740960.db2.gz 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MORHQAOYMHQUFN-UHFFFAOYSA-N 0 0 385.420 3.275 20 5 GGBDRN CCc1nc(CN(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000067771295 1409226681 /nfs/dbraw/zinc/22/66/81/1409226681.db2.gz KIARQHPSNDFUJB-UHFFFAOYSA-N 0 0 385.449 3.286 20 5 GGBDRN Cc1c(C(=O)Nc2ccccc2N2CCCC2=O)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000067772896 1409226923 /nfs/dbraw/zinc/22/69/23/1409226923.db2.gz JCJWYNLUMLNCGO-UHFFFAOYSA-N 0 0 384.348 3.191 20 5 GGBDRN CC[C@H](C)Oc1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000176629121 1428384762 /nfs/dbraw/zinc/38/47/62/1428384762.db2.gz KCJRFOZSKGDCAZ-HOCLYGCPSA-N 0 0 384.436 3.494 20 5 GGBDRN CC[C@@H](C)Oc1ccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000176629140 1428384908 /nfs/dbraw/zinc/38/49/08/1428384908.db2.gz KCJRFOZSKGDCAZ-GDBMZVCRSA-N 0 0 384.436 3.494 20 5 GGBDRN COc1ccc(CC(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000067788166 1409231375 /nfs/dbraw/zinc/23/13/75/1409231375.db2.gz VOYIZPZGYVSJJR-UHFFFAOYSA-N 0 0 389.839 3.148 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)c1 ZINC000067788661 1409231504 /nfs/dbraw/zinc/23/15/04/1409231504.db2.gz GTLFVKBNLHQGRS-UHFFFAOYSA-N 0 0 398.419 3.030 20 5 GGBDRN COC(=O)c1ccc(Cl)c(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000067793095 1409232409 /nfs/dbraw/zinc/23/24/09/1409232409.db2.gz HXHHRRHQNHJIGX-UHFFFAOYSA-N 0 0 378.768 3.225 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-] ZINC000067793860 1409232718 /nfs/dbraw/zinc/23/27/18/1409232718.db2.gz CUINMDNAAQNQRL-OAQYLSRUSA-N 0 0 377.400 3.447 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-] ZINC000067793858 1409232730 /nfs/dbraw/zinc/23/27/30/1409232730.db2.gz CUINMDNAAQNQRL-NRFANRHFSA-N 0 0 377.400 3.447 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067794346 1409232803 /nfs/dbraw/zinc/23/28/03/1409232803.db2.gz UAFJAWQALVEMSN-UHFFFAOYSA-N 0 0 388.420 3.212 20 5 GGBDRN COc1ccc(CC(=O)NCCSCc2ccccc2F)cc1[N+](=O)[O-] ZINC000067794301 1409232841 /nfs/dbraw/zinc/23/28/41/1409232841.db2.gz ZFWUMZWYFNHZGP-UHFFFAOYSA-N 0 0 378.425 3.335 20 5 GGBDRN COc1ccc(CC(=O)N2CCC[C@@H](C(=O)Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067796282 1409233170 /nfs/dbraw/zinc/23/31/70/1409233170.db2.gz YCYUQCGBFZODNG-MRXNPFEDSA-N 0 0 397.431 3.023 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(C)nn2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000067798732 1409233681 /nfs/dbraw/zinc/23/36/81/1409233681.db2.gz HJTQCNGQMUXLOS-UHFFFAOYSA-N 0 0 380.404 3.338 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1[N+](=O)[O-] ZINC000067799216 1409233690 /nfs/dbraw/zinc/23/36/90/1409233690.db2.gz DPIUJRXBEANRFD-QGZVFWFLSA-N 0 0 386.404 3.342 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(C(=O)N3CCCC3)c2)cc1[N+](=O)[O-] ZINC000067801938 1409234257 /nfs/dbraw/zinc/23/42/57/1409234257.db2.gz FUHBDJJLDSFOES-UHFFFAOYSA-N 0 0 383.404 3.021 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1 ZINC000067808425 1409235462 /nfs/dbraw/zinc/23/54/62/1409235462.db2.gz YAOOCWYABCAFSM-BLRBJFNZSA-N 0 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CCCC(=O)Nc1ccc(CNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000067814738 1409236878 /nfs/dbraw/zinc/23/68/78/1409236878.db2.gz ZRUAVGHIKYVMEP-UHFFFAOYSA-N 0 0 385.420 3.201 20 5 GGBDRN COc1cc(C)c([C@@H](C)NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000067813918 1409236916 /nfs/dbraw/zinc/23/69/16/1409236916.db2.gz GLBVNGQMMVVHDS-CYBMUJFWSA-N 0 0 388.420 3.349 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000067817632 1409237412 /nfs/dbraw/zinc/23/74/12/1409237412.db2.gz GAZBFSOFHYQVHI-QUCCMNQESA-N 0 0 388.395 3.322 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(-n3ccnc3C)c(F)c2)cc1[N+](=O)[O-] ZINC000067819632 1409237767 /nfs/dbraw/zinc/23/77/67/1409237767.db2.gz ASHFJYBIVPGBCA-UHFFFAOYSA-N 0 0 398.394 3.096 20 5 GGBDRN CCOC(=O)c1cccc(N(CC)C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000067818120 1409237777 /nfs/dbraw/zinc/23/77/77/1409237777.db2.gz XVYRHAOHRRSSHA-UHFFFAOYSA-N 0 0 386.404 3.376 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1[N+](=O)[O-] ZINC000067818281 1409237861 /nfs/dbraw/zinc/23/78/61/1409237861.db2.gz SXGFRBLWOJOQOE-OAQYLSRUSA-N 0 0 398.415 3.185 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc3c(cc2SC)OCCO3)cc1[N+](=O)[O-] ZINC000067823610 1409238733 /nfs/dbraw/zinc/23/87/33/1409238733.db2.gz RZGVYIQRBYRDBW-UHFFFAOYSA-N 0 0 390.417 3.278 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](c2ccccc2)O1 ZINC000067827251 1409239426 /nfs/dbraw/zinc/23/94/26/1409239426.db2.gz MUVMUXOMBZYQFY-FOIQADDNSA-N 0 0 392.415 3.383 20 5 GGBDRN COc1cc(C(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000067828213 1409239662 /nfs/dbraw/zinc/23/96/62/1409239662.db2.gz RZVDXXQDMMNGPB-BFUOFWGJSA-N 0 0 386.404 3.214 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1nccn1CCc1ccccc1 ZINC000176633453 1428385938 /nfs/dbraw/zinc/38/59/38/1428385938.db2.gz JRAKGKLAIXJEEO-UHFFFAOYSA-N 0 0 394.431 3.119 20 5 GGBDRN COCCOCCNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000067832717 1409240729 /nfs/dbraw/zinc/24/07/29/1409240729.db2.gz FPERGRAATQMHDF-UHFFFAOYSA-N 0 0 390.461 3.447 20 5 GGBDRN Cc1cc(C(=O)Oc2cccc(NC(=O)c3cnn(C)c3)c2)ccc1[N+](=O)[O-] ZINC000067841608 1409242297 /nfs/dbraw/zinc/24/22/97/1409242297.db2.gz JUVJAKXJPWJYKH-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN COc1ccc(C)c2c1N(C(=O)COc1ccc([N+](=O)[O-])c(OC)c1)CCC2 ZINC000067842127 1409242433 /nfs/dbraw/zinc/24/24/33/1409242433.db2.gz KTNCGKJYUXYZHY-UHFFFAOYSA-N 0 0 386.404 3.279 20 5 GGBDRN COc1ccc(C)c2c1N(C(=O)c1ccc(-n3cncn3)c([N+](=O)[O-])c1)CCC2 ZINC000067843686 1409242703 /nfs/dbraw/zinc/24/27/03/1409242703.db2.gz CFYXBAHKONVYSG-UHFFFAOYSA-N 0 0 393.403 3.086 20 5 GGBDRN CCOc1ccccc1CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000067844311 1409242852 /nfs/dbraw/zinc/24/28/52/1409242852.db2.gz UCDQCYVPURIQAO-UHFFFAOYSA-N 0 0 387.392 3.491 20 5 GGBDRN CSCCc1ccc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000067856517 1409245196 /nfs/dbraw/zinc/24/51/96/1409245196.db2.gz PWZJVVJCGMXEFD-UHFFFAOYSA-N 0 0 387.417 3.047 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000067879018 1409248197 /nfs/dbraw/zinc/24/81/97/1409248197.db2.gz CKXDRHKNOCFRIS-PBHICJAKSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067879420 1409248806 /nfs/dbraw/zinc/24/88/06/1409248806.db2.gz UGDJRUXXHJLSPT-KDOFPFPSSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1c(CO)cc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000067905062 1409253011 /nfs/dbraw/zinc/25/30/11/1409253011.db2.gz QCBOULYGGBYFGX-SJCJKPOMSA-N 0 0 387.392 3.270 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(N3CCCCCC3)nc2)cc1[N+](=O)[O-] ZINC000067907282 1409253646 /nfs/dbraw/zinc/25/36/46/1409253646.db2.gz FWRNBIPPHYEZMB-UHFFFAOYSA-N 0 0 398.463 3.238 20 5 GGBDRN COc1ccc(CC(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000067909362 1409253695 /nfs/dbraw/zinc/25/36/95/1409253695.db2.gz XZTIWNMSUUXCSK-GOSISDBHSA-N 0 0 390.823 3.399 20 5 GGBDRN CC(=O)c1ccc(NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c([N+](=O)[O-])c1 ZINC000067915709 1409255037 /nfs/dbraw/zinc/25/50/37/1409255037.db2.gz KLOXCJIGOJPXGP-GOSISDBHSA-N 0 0 397.431 3.318 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc(NC(C)=O)cc2Cl)cc([N+](=O)[O-])c1 ZINC000067942643 1409261101 /nfs/dbraw/zinc/26/11/01/1409261101.db2.gz ZAKNMAUQPJOVID-UHFFFAOYSA-N 0 0 391.767 3.246 20 5 GGBDRN C[C@@H]1CSc2ccccc2N1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000176644751 1428389634 /nfs/dbraw/zinc/38/96/34/1428389634.db2.gz FXZAARXAHTUVHL-GFCCVEGCSA-N 0 0 381.417 3.317 20 5 GGBDRN CN(Cc1cccc(Cl)c1)c1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000067949171 1409261853 /nfs/dbraw/zinc/26/18/53/1409261853.db2.gz RAGXLBRFZAYDFB-UHFFFAOYSA-N 0 0 389.839 3.357 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2nnnn2-c2ccccc2Br)cc1F ZINC000067952562 1409263048 /nfs/dbraw/zinc/26/30/48/1409263048.db2.gz IWXWRCMQYPRXCZ-UHFFFAOYSA-N 0 0 394.160 3.051 20 5 GGBDRN COCCOc1ccccc1N[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000067989588 1409271446 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385.367 3.076 20 5 GGBDRN CCOc1cc(C(=O)Nc2n[nH]c(-c3ccc(C)cc3)n2)c([N+](=O)[O-])cc1OC ZINC000070724892 1409758801 /nfs/dbraw/zinc/75/88/01/1409758801.db2.gz GLUYDNBWWRUHLZ-UHFFFAOYSA-N 0 0 397.391 3.348 20 5 GGBDRN O=C(NC[C@](O)(c1ccccc1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000070762416 1409770109 /nfs/dbraw/zinc/77/01/09/1409770109.db2.gz DBKYEZBNXHZCID-HNNXBMFYSA-N 0 0 388.729 3.428 20 5 GGBDRN Cc1nc(C[C@@H]2CCCN(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2)no1 ZINC000176714666 1428428848 /nfs/dbraw/zinc/42/88/48/1428428848.db2.gz JUKBHKMLPGTJOI-HIFRSBDPSA-N 0 0 387.440 3.320 20 5 GGBDRN C[C@@H](CC(C)(C)c1ccccc1)NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000070767439 1409770554 /nfs/dbraw/zinc/77/05/54/1409770554.db2.gz WQIWCRCEHHWFJF-AWEZNQCLSA-N 0 0 397.431 3.375 20 5 GGBDRN CCOc1ccc(C(=O)Nc2ccc3cnn(CCOC)c3c2)cc1[N+](=O)[O-] ZINC000070773409 1409772802 /nfs/dbraw/zinc/77/28/02/1409772802.db2.gz JETWOSYPQYGSNI-UHFFFAOYSA-N 0 0 384.392 3.242 20 5 GGBDRN Cc1nc(C[C@H]2CCCN(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2)no1 ZINC000176714630 1428428995 /nfs/dbraw/zinc/42/89/95/1428428995.db2.gz JUKBHKMLPGTJOI-UKRRQHHQSA-N 0 0 387.440 3.320 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC(C(=O)N3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000176716017 1428429610 /nfs/dbraw/zinc/42/96/10/1428429610.db2.gz HKZZNKSCYQKWPR-OAHLLOKOSA-N 0 0 388.468 3.008 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(F)cc1OCC(F)(F)F ZINC000070867931 1409792690 /nfs/dbraw/zinc/79/26/90/1409792690.db2.gz GGEKDDGGPPYIBL-UHFFFAOYSA-N 0 0 390.293 3.209 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000176718083 1428430794 /nfs/dbraw/zinc/43/07/94/1428430794.db2.gz AMRGYEZUNCJMOD-ZDUSSCGKSA-N 0 0 388.390 3.244 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000176718063 1428431058 /nfs/dbraw/zinc/43/10/58/1428431058.db2.gz AMRGYEZUNCJMOD-CYBMUJFWSA-N 0 0 388.390 3.244 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1SC(F)(F)F ZINC000070916026 1409802038 /nfs/dbraw/zinc/80/20/38/1409802038.db2.gz KBYGGLUBCHUKIO-UHFFFAOYSA-N 0 0 399.350 3.462 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000070935604 1409804514 /nfs/dbraw/zinc/80/45/14/1409804514.db2.gz RSPSPSSAQFYMOL-JTQLQIEISA-N 0 0 379.438 3.319 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)NC2(c3ccccc3)CCCC2)cc1[N+](=O)[O-] ZINC000070955526 1409806101 /nfs/dbraw/zinc/80/61/01/1409806101.db2.gz WUICBHJEIBGVFG-UHFFFAOYSA-N 0 0 388.445 3.198 20 5 GGBDRN Cc1nn(CCC(=O)NCCOc2cccc(C(C)(C)C)c2)c(C)c1[N+](=O)[O-] ZINC000070962332 1409806814 /nfs/dbraw/zinc/80/68/14/1409806814.db2.gz ZOFQEAZBKZPFLD-UHFFFAOYSA-N 0 0 388.468 3.291 20 5 GGBDRN CCOC(=O)[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCc2ccccc21 ZINC000070989693 1409811166 /nfs/dbraw/zinc/81/11/66/1409811166.db2.gz RUBNBNMBDKZYHF-LJQANCHMSA-N 0 0 388.807 3.383 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000071049160 1409815820 /nfs/dbraw/zinc/81/58/20/1409815820.db2.gz KVAZHWIBQZUAKC-OAHLLOKOSA-N 0 0 392.795 3.291 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccccc1[N+](=O)[O-] ZINC000071052424 1409816781 /nfs/dbraw/zinc/81/67/81/1409816781.db2.gz WUKFSTIEZIAXRE-AWEZNQCLSA-N 0 0 393.321 3.149 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccc([N+](=O)[O-])cc1 ZINC000071053146 1409817100 /nfs/dbraw/zinc/81/71/00/1409817100.db2.gz FGZKMJRIHUSWHO-HNNXBMFYSA-N 0 0 393.321 3.149 20 5 GGBDRN CCS[C@H]1CCC[C@@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000176719581 1428432535 /nfs/dbraw/zinc/43/25/35/1428432535.db2.gz ISYMTAMCDVFQCE-NEPJUHHUSA-N 0 0 399.900 3.159 20 5 GGBDRN C[C@@H]1CCc2c(sc3ncn(CC(=O)c4cccc([N+](=O)[O-])c4)c(=O)c32)C1 ZINC000071434054 1409823465 /nfs/dbraw/zinc/82/34/65/1409823465.db2.gz PLZBTJAMNFIAPX-LLVKDONJSA-N 0 0 383.429 3.374 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](NC(=O)NCc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000071834065 1409826698 /nfs/dbraw/zinc/82/66/98/1409826698.db2.gz DKRBREWPRYOHAK-GOSISDBHSA-N 0 0 384.436 3.366 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](NC(=O)NCc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000071834066 1409826781 /nfs/dbraw/zinc/82/67/81/1409826781.db2.gz DKRBREWPRYOHAK-SFHVURJKSA-N 0 0 384.436 3.366 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1nnc(-c2ccccc2Cl)o1 ZINC000071848238 1409827196 /nfs/dbraw/zinc/82/71/96/1409827196.db2.gz FQAIBMNRXDNRBY-UHFFFAOYSA-N 0 0 383.751 3.056 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC(Oc2cc(C)ccc2C)CC1 ZINC000071845416 1409827397 /nfs/dbraw/zinc/82/73/97/1409827397.db2.gz VWRSWYXXGYLTAD-UHFFFAOYSA-N 0 0 386.452 3.177 20 5 GGBDRN COC(=O)c1cc(C)ccc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000071931994 1409831120 /nfs/dbraw/zinc/83/11/20/1409831120.db2.gz YXMMPJZOKNQITD-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN CC(C)NC(=O)c1ccc(Cl)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000071935502 1409831178 /nfs/dbraw/zinc/83/11/78/1409831178.db2.gz CXVIQZAYMDQCOH-UHFFFAOYSA-N 0 0 391.811 3.404 20 5 GGBDRN O=C(NC[C@H](O)c1ccccc1F)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000071942908 1409832001 /nfs/dbraw/zinc/83/20/01/1409832001.db2.gz OXAKRNDYDHWTFI-ZDUSSCGKSA-N 0 0 385.298 3.190 20 5 GGBDRN O=C(NC[C@@H](O)c1ccccc1F)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000071942907 1409832074 /nfs/dbraw/zinc/83/20/74/1409832074.db2.gz OXAKRNDYDHWTFI-CYBMUJFWSA-N 0 0 385.298 3.190 20 5 GGBDRN CC(C)(C)OC(=O)N1CCN(CCCNc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000071955429 1409833279 /nfs/dbraw/zinc/83/32/79/1409833279.db2.gz DXOQIGGJXATTLJ-UHFFFAOYSA-N 0 0 382.436 3.089 20 5 GGBDRN O=c1[nH]cnc2cc(NCc3ccc(N4CCCCCC4)nc3)c([N+](=O)[O-])cc21 ZINC000071955254 1409833448 /nfs/dbraw/zinc/83/34/48/1409833448.db2.gz GUNPTUCGFVDESW-UHFFFAOYSA-N 0 0 394.435 3.219 20 5 GGBDRN COc1ccccc1CN(CCO)C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000176722078 1428433957 /nfs/dbraw/zinc/43/39/57/1428433957.db2.gz UAQYZMQQCDLWGV-OAHLLOKOSA-N 0 0 387.436 3.177 20 5 GGBDRN Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000072010498 1409837138 /nfs/dbraw/zinc/83/71/38/1409837138.db2.gz RQPYASSLKUDSRQ-CXAGYDPISA-N 0 0 399.447 3.444 20 5 GGBDRN CCN(CC)C(=O)C1(NC(=O)CSc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000072012291 1409837148 /nfs/dbraw/zinc/83/71/48/1409837148.db2.gz GUDLJDJRZXKTQC-UHFFFAOYSA-N 0 0 393.509 3.374 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(OC(F)F)cc2)C1=O ZINC000072013670 1409837650 /nfs/dbraw/zinc/83/76/50/1409837650.db2.gz WNBQFCMXGFURPG-SFHVURJKSA-N 0 0 391.330 3.163 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cccnc2N2CCOCC2)cc1[N+](=O)[O-] ZINC000176721685 1428434106 /nfs/dbraw/zinc/43/41/06/1428434106.db2.gz GRDYXCWCBDQFQY-CQSZACIVSA-N 0 0 385.424 3.018 20 5 GGBDRN O=C(NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000072044907 1409841010 /nfs/dbraw/zinc/84/10/10/1409841010.db2.gz DFCBLIUDWMEWOO-SFHVURJKSA-N 0 0 389.839 3.052 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCc1cccc([N+](=O)[O-])c1 ZINC000176721468 1428434226 /nfs/dbraw/zinc/43/42/26/1428434226.db2.gz KLTKSBZSZRMJAI-LJQANCHMSA-N 0 0 399.378 3.006 20 5 GGBDRN CC[C@@H](c1ccccc1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000072048647 1409841400 /nfs/dbraw/zinc/84/14/00/1409841400.db2.gz PYXGCVWTLYFCGN-IBGZPJMESA-N 0 0 389.477 3.052 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)C(=O)Nc1ccccc1 ZINC000072058771 1409842998 /nfs/dbraw/zinc/84/29/98/1409842998.db2.gz XFWCFWYSKTZGQD-HNNXBMFYSA-N 0 0 384.436 3.273 20 5 GGBDRN Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000072066640 1409844399 /nfs/dbraw/zinc/84/43/99/1409844399.db2.gz OKAXGLLWUSEOTJ-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN CC(C)N(Cc1ccccc1)C(=O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000072066332 1409844410 /nfs/dbraw/zinc/84/44/10/1409844410.db2.gz VUBGZPIRMJHSJJ-UHFFFAOYSA-N 0 0 379.420 3.291 20 5 GGBDRN Cc1ccc(N(C)C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)cc1 ZINC000072070160 1409844717 /nfs/dbraw/zinc/84/47/17/1409844717.db2.gz AATFYZLHMVKDGF-UHFFFAOYSA-N 0 0 378.388 3.034 20 5 GGBDRN Cc1ccc(CCC(=O)NCCOC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1 ZINC000072086159 1409847647 /nfs/dbraw/zinc/84/76/47/1409847647.db2.gz KHBITCIHZCNFRP-UKTHLTGXSA-N 0 0 382.416 3.209 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc1[N+](=O)[O-] ZINC000176722837 1428435008 /nfs/dbraw/zinc/43/50/08/1428435008.db2.gz JEOKYDQQQOSYLX-AWEZNQCLSA-N 0 0 384.436 3.417 20 5 GGBDRN CO[C@@]1(C)C[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1(C)C ZINC000073276020 1409860145 /nfs/dbraw/zinc/86/01/45/1409860145.db2.gz SFHXZCZLOSTCAC-XLIONFOSSA-N 0 0 375.469 3.131 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@@](C)(O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000176725655 1428437248 /nfs/dbraw/zinc/43/72/48/1428437248.db2.gz YUIQBMDXSYZCOX-CWTRNNRKSA-N 0 0 393.390 3.449 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2cccc(S(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000176729136 1428437999 /nfs/dbraw/zinc/43/79/99/1428437999.db2.gz XPDLILRTOVUVQY-LBPRGKRZSA-N 0 0 377.422 3.189 20 5 GGBDRN CO[C@H]1CCCN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000076248377 1409886808 /nfs/dbraw/zinc/88/68/08/1409886808.db2.gz AYMRIENSNWKOTO-UXLLHSPISA-N 0 0 375.469 3.328 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CCOC2CCCCCC2)CC1 ZINC000077359170 1409895925 /nfs/dbraw/zinc/89/59/25/1409895925.db2.gz RBRSWTDFXHFRGB-UHFFFAOYSA-N 0 0 375.469 3.092 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000176733954 1428441697 /nfs/dbraw/zinc/44/16/97/1428441697.db2.gz RRTIKOBHNSCNAM-NVXWUHKLSA-N 0 0 390.484 3.302 20 5 GGBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000176730724 1428439441 /nfs/dbraw/zinc/43/94/41/1428439441.db2.gz RZWMNDYLCZZUIW-HXPMCKFVSA-N 0 0 395.394 3.368 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000176731439 1428439484 /nfs/dbraw/zinc/43/94/84/1428439484.db2.gz DUVCWQAJSNVERA-STQMWFEESA-N 0 0 388.390 3.242 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000176730971 1428439798 /nfs/dbraw/zinc/43/97/98/1428439798.db2.gz HDRLSRJYLMVKEE-INIZCTEOSA-N 0 0 396.447 3.132 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000176731422 1428439857 /nfs/dbraw/zinc/43/98/57/1428439857.db2.gz DUVCWQAJSNVERA-OLZOCXBDSA-N 0 0 388.390 3.242 20 5 GGBDRN CNC(=O)c1ccc(CN(C)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000176730830 1428439933 /nfs/dbraw/zinc/43/99/33/1428439933.db2.gz VSBBLUHRKAVQPY-CQSZACIVSA-N 0 0 384.436 3.165 20 5 GGBDRN Cc1c(NC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)cccc1[N+](=O)[O-] ZINC000078072736 1409907675 /nfs/dbraw/zinc/90/76/75/1409907675.db2.gz IYCYVLQWDUJWOW-HNNXBMFYSA-N 0 0 376.457 3.309 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H]1CCCN(C(=O)NCC(C)C)C1 ZINC000078072665 1409907818 /nfs/dbraw/zinc/90/78/18/1409907818.db2.gz KRJWRBXVQRQYSY-OAHLLOKOSA-N 0 0 376.457 3.309 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000078075279 1409907965 /nfs/dbraw/zinc/90/79/65/1409907965.db2.gz KQXRPUMXFXUFKK-OAHLLOKOSA-N 0 0 376.457 3.025 20 5 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YUWXPDRIITXYIA-GOSISDBHSA-N 0 0 386.379 3.390 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2F)ccc1[N+](=O)[O-] ZINC000102213298 1410578902 /nfs/dbraw/zinc/57/89/02/1410578902.db2.gz YUWXPDRIITXYIA-SFHVURJKSA-N 0 0 386.379 3.390 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(F)cc2F)ccc1[N+](=O)[O-] ZINC000102213549 1410579232 /nfs/dbraw/zinc/57/92/32/1410579232.db2.gz OYTKGIBOMAICSP-QGZVFWFLSA-N 0 0 389.358 3.425 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000102213902 1410580386 /nfs/dbraw/zinc/58/03/86/1410580386.db2.gz RVRPVMKFSZPWQP-QGZVFWFLSA-N 0 0 389.358 3.425 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1COC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000102220806 1410581099 /nfs/dbraw/zinc/58/10/99/1410581099.db2.gz QSPLYIRBRHWZON-UHFFFAOYSA-N 0 0 383.408 3.072 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N(C)Cc2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000102218163 1410581179 /nfs/dbraw/zinc/58/11/79/1410581179.db2.gz WKFQWLAQJOZPLQ-IBGZPJMESA-N 0 0 399.422 3.306 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1oc2ccccc2c1CS(C)(=O)=O ZINC000102220429 1410581224 /nfs/dbraw/zinc/58/12/24/1410581224.db2.gz ZWFWOIRVOPRPKW-UHFFFAOYSA-N 0 0 388.401 3.446 20 5 GGBDRN Cc1c(NC(=O)c2oc3ccccc3c2CS(C)(=O)=O)cccc1[N+](=O)[O-] ZINC000102220524 1410581228 /nfs/dbraw/zinc/58/12/28/1410581228.db2.gz BYKSXJPKFXGIKF-UHFFFAOYSA-N 0 0 388.401 3.446 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(Cl)cn2)ccc1[N+](=O)[O-] ZINC000102220665 1410581312 /nfs/dbraw/zinc/58/13/12/1410581312.db2.gz BFLJDPQEWHWNKN-OAHLLOKOSA-N 0 0 388.811 3.195 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(Cl)cn2)ccc1[N+](=O)[O-] ZINC000102220666 1410581500 /nfs/dbraw/zinc/58/15/00/1410581500.db2.gz BFLJDPQEWHWNKN-HNNXBMFYSA-N 0 0 388.811 3.195 20 5 GGBDRN Cc1cc(CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)ccc1F ZINC000102223065 1410581872 /nfs/dbraw/zinc/58/18/72/1410581872.db2.gz WVYYBTIVSIJNBI-LJQANCHMSA-N 0 0 399.422 3.272 20 5 GGBDRN CC(C)(C(=O)Nc1nc(-c2cccc(F)c2)cs1)n1cc([N+](=O)[O-])cn1 ZINC000102222163 1410582401 /nfs/dbraw/zinc/58/24/01/1410582401.db2.gz LSCVSEFXUFZCBA-UHFFFAOYSA-N 0 0 375.385 3.428 20 5 GGBDRN Cc1nn(CCC(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c(C)c1[N+](=O)[O-] ZINC000102223000 1410582437 /nfs/dbraw/zinc/58/24/37/1410582437.db2.gz RYENRJVSUPDZBZ-UHFFFAOYSA-N 0 0 394.435 3.111 20 5 GGBDRN Cc1cc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)n(-c2ccccc2F)n1 ZINC000102228382 1410583784 /nfs/dbraw/zinc/58/37/84/1410583784.db2.gz QFIGJMJTZLFLBX-UHFFFAOYSA-N 0 0 386.387 3.070 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N(C)CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000102233096 1410584929 /nfs/dbraw/zinc/58/49/29/1410584929.db2.gz UHZGDFCYUYQYAW-FQEVSTJZSA-N 0 0 395.459 3.209 20 5 GGBDRN COc1cc(C)ccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000102235641 1410586175 /nfs/dbraw/zinc/58/61/75/1410586175.db2.gz JVKGQBFUWJIRKM-SFHVURJKSA-N 0 0 397.431 3.464 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N(C)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000102235122 1410586598 /nfs/dbraw/zinc/58/65/98/1410586598.db2.gz CDXQAMAMZHGKPQ-SFHVURJKSA-N 0 0 385.395 3.310 20 5 GGBDRN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1 ZINC000102235219 1410586628 /nfs/dbraw/zinc/58/66/28/1410586628.db2.gz KGXYZDRGBZYGGR-AWEZNQCLSA-N 0 0 399.451 3.180 20 5 GGBDRN CS(=O)(=O)Cc1c2ccccc2oc1C(=O)OCc1cccc([N+](=O)[O-])c1 ZINC000102244166 1410588751 /nfs/dbraw/zinc/58/87/51/1410588751.db2.gz ACMMGZZWORUQGT-UHFFFAOYSA-N 0 0 389.385 3.243 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)c(C)c1[N+](=O)[O-] ZINC000102248865 1410589406 /nfs/dbraw/zinc/58/94/06/1410589406.db2.gz QBXRCABCQMRPCR-UHFFFAOYSA-N 0 0 397.391 3.282 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N(C)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000102250939 1410589905 /nfs/dbraw/zinc/58/99/05/1410589905.db2.gz WVGMSPPJQGKQAM-GOSISDBHSA-N 0 0 385.395 3.310 20 5 GGBDRN Cc1ccc(N(C)C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000102259659 1410590399 /nfs/dbraw/zinc/59/03/99/1410590399.db2.gz 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O=C(CCC1CCCC1)NCC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000102470769 1410636560 /nfs/dbraw/zinc/63/65/60/1410636560.db2.gz SZEKHEMRFSWLME-UHFFFAOYSA-N 0 0 385.424 3.010 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000102510538 1410641289 /nfs/dbraw/zinc/64/12/89/1410641289.db2.gz DUQHTZLTCHKIFL-GOSISDBHSA-N 0 0 386.379 3.390 20 5 GGBDRN Cc1csc(-c2cccc(NC(=O)C(=O)NCc3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000102585231 1410658762 /nfs/dbraw/zinc/65/87/62/1410658762.db2.gz SWAPTNIRHBHSRN-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN CC(C)c1nc(CCNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000102588510 1410662152 /nfs/dbraw/zinc/66/21/52/1410662152.db2.gz FFMHGZANAJQCBN-UHFFFAOYSA-N 0 0 396.856 3.126 20 5 GGBDRN Cc1nn(CCC(=O)Oc2ccc(NC(=O)c3ccco3)cc2)c(C)c1[N+](=O)[O-] ZINC000102596023 1410667368 /nfs/dbraw/zinc/66/73/68/1410667368.db2.gz KZINSZGEFNYYFM-UHFFFAOYSA-N 0 0 398.375 3.249 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)OCCCc2ccncc2)ccc1[N+](=O)[O-] ZINC000102596471 1410667693 /nfs/dbraw/zinc/66/76/93/1410667693.db2.gz DZCJDLDREUIURY-LJQANCHMSA-N 0 0 397.431 3.079 20 5 GGBDRN O=C(NCCOC(=O)c1cccc(F)c1F)c1ccc([N+](=O)[O-])cc1Cl ZINC000102596914 1410667789 /nfs/dbraw/zinc/66/77/89/1410667789.db2.gz BGSLLQOKAUEHNI-UHFFFAOYSA-N 0 0 384.722 3.113 20 5 GGBDRN COC(=O)[C@H](C)CN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000102610172 1410672288 /nfs/dbraw/zinc/67/22/88/1410672288.db2.gz TWNCRMHVAINPNR-LLVKDONJSA-N 0 0 389.433 3.132 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCCCc3cnn(C)c3)cc2[N+](=O)[O-])C1 ZINC000102623704 1410676225 /nfs/dbraw/zinc/67/62/25/1410676225.db2.gz KVPJHKCTSHYSLC-HZPDHXFCSA-N 0 0 399.495 3.173 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCCCc3cnn(C)c3)cc2[N+](=O)[O-])C1 ZINC000102623702 1410676788 /nfs/dbraw/zinc/67/67/88/1410676788.db2.gz KVPJHKCTSHYSLC-HOTGVXAUSA-N 0 0 399.495 3.173 20 5 GGBDRN NC(=O)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1F ZINC000102627099 1410676879 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CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000112675441 1412190084 /nfs/dbraw/zinc/19/00/84/1412190084.db2.gz KDVACTCKRRQIDX-LBPRGKRZSA-N 0 0 381.860 3.263 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(OC2CCC2)c(F)c1 ZINC000177205871 1428631531 /nfs/dbraw/zinc/63/15/31/1428631531.db2.gz UWLHXTWYTJOJJV-UHFFFAOYSA-N 0 0 387.367 3.034 20 5 GGBDRN CC1(C)CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)C1 ZINC000112707104 1412200397 /nfs/dbraw/zinc/20/03/97/1412200397.db2.gz PMOVUAADUAFXOH-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN C[C@H](NC(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000112744631 1412208750 /nfs/dbraw/zinc/20/87/50/1412208750.db2.gz QUMLNJSLODZGEH-GJZGRUSLSA-N 0 0 390.484 3.240 20 5 GGBDRN C[C@@H](NC(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000112744632 1412209312 /nfs/dbraw/zinc/20/93/12/1412209312.db2.gz QUMLNJSLODZGEH-CABCVRRESA-N 0 0 390.484 3.240 20 5 GGBDRN C[C@H]1CCC[C@@H](OCC(=O)OCC2CCN(c3ncccc3[N+](=O)[O-])CC2)C1 ZINC000112759522 1412213054 /nfs/dbraw/zinc/21/30/54/1412213054.db2.gz PNABQFNMBHAYBZ-DOTOQJQBSA-N 0 0 391.468 3.345 20 5 GGBDRN Cc1nc2c(s1)[C@@H](OC(=O)c1ccc(-n3cncn3)c([N+](=O)[O-])c1)CCC2 ZINC000112768168 1412214135 /nfs/dbraw/zinc/21/41/35/1412214135.db2.gz OKJITDKOZUDKSV-HNNXBMFYSA-N 0 0 385.405 3.175 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)[C@H](C)c2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000177208337 1428632997 /nfs/dbraw/zinc/63/29/97/1428632997.db2.gz TYLLZDBZRZLJEG-KBPBESRZSA-N 0 0 379.420 3.406 20 5 GGBDRN O=C([C@H]1C[C@@H]1c1ccc(F)cc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000112777339 1412215895 /nfs/dbraw/zinc/21/58/95/1412215895.db2.gz ONRIIJIWXSQOPW-CVEARBPZSA-N 0 0 387.386 3.325 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)Nc3ccc(Cl)nn3)cc2)c(C)c1[N+](=O)[O-] ZINC000112808637 1412220353 /nfs/dbraw/zinc/22/03/53/1412220353.db2.gz OOYYQKNPOAIVAN-UHFFFAOYSA-N 0 0 386.799 3.152 20 5 GGBDRN 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Cc1c(NC(=O)[C@H](C)N(C)Cc2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000177200635 1428628598 /nfs/dbraw/zinc/62/85/98/1428628598.db2.gz LYFYUSVWKGEDAD-AWEZNQCLSA-N 0 0 381.436 3.249 20 5 GGBDRN O=C(Nc1ccc2[nH]ccc2c1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000112861270 1412226376 /nfs/dbraw/zinc/22/63/76/1412226376.db2.gz XTKZCZCBWSFVCQ-AWEZNQCLSA-N 0 0 384.417 3.381 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN3CCC(OC[C@H]4CCCCO4)CC3)nc2c1 ZINC000177212592 1428635214 /nfs/dbraw/zinc/63/52/14/1428635214.db2.gz VYHWZZNOXJLSBU-MRXNPFEDSA-N 0 0 375.425 3.286 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN3CCC(OC[C@@H]4CCCCO4)CC3)nc2c1 ZINC000177212573 1428635340 /nfs/dbraw/zinc/63/53/40/1428635340.db2.gz VYHWZZNOXJLSBU-INIZCTEOSA-N 0 0 375.425 3.286 20 5 GGBDRN COC[C@H]1CCCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000112942995 1412244912 /nfs/dbraw/zinc/24/49/12/1412244912.db2.gz LURNCHVNMMATHO-NSHDSACASA-N 0 0 376.331 3.035 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)Cc1ccc2ccccc2c1 ZINC000112949803 1412245333 /nfs/dbraw/zinc/24/53/33/1412245333.db2.gz LEXWYROCJBHQGG-MRXNPFEDSA-N 0 0 382.372 3.103 20 5 GGBDRN COC(=O)[C@H](CNC(=O)c1ccc([N+](=O)[O-])o1)Cc1ccc2ccccc2c1 ZINC000112949801 1412245608 /nfs/dbraw/zinc/24/56/08/1412245608.db2.gz LEXWYROCJBHQGG-INIZCTEOSA-N 0 0 382.372 3.103 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N(Cc1cccnc1)C1CC1 ZINC000112965171 1412247547 /nfs/dbraw/zinc/24/75/47/1412247547.db2.gz CXRHRKXTESNUHF-UHFFFAOYSA-N 0 0 383.376 3.155 20 5 GGBDRN CN(C)c1ncc(Br)cc1C(=O)OCc1ccc([N+](=O)[O-])cc1 ZINC000113012767 1412254920 /nfs/dbraw/zinc/25/49/20/1412254920.db2.gz DBFMKIKUBLRMMG-UHFFFAOYSA-N 0 0 380.198 3.175 20 5 GGBDRN Cc1sc(NC(=O)COC[C@@H]2CCCO2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000113033146 1412256782 /nfs/dbraw/zinc/25/67/82/1412256782.db2.gz BOJKXDUUMNWYMC-AWEZNQCLSA-N 0 0 377.422 3.161 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCC(=O)Nc1ccccc1 ZINC000113098260 1412262080 /nfs/dbraw/zinc/26/20/80/1412262080.db2.gz DNZZMZPDZJVNNW-GFCCVEGCSA-N 0 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Cc1ccc(C[C@H]2CCCN2C(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000113210243 1412275883 /nfs/dbraw/zinc/27/58/83/1412275883.db2.gz WOFIHRXDELRKGC-QFBILLFUSA-N 0 0 395.459 3.255 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@@](C)(c2ccccc2)C1 ZINC000113216077 1412277509 /nfs/dbraw/zinc/27/75/09/1412277509.db2.gz TYMVASPUCAPZAZ-OPAMFIHVSA-N 0 0 395.459 3.293 20 5 GGBDRN C[C@@]1(c2ccccc2)CCCN(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])C1 ZINC000113215735 1412277689 /nfs/dbraw/zinc/27/76/89/1412277689.db2.gz MRFAVNKOVFSXPD-OAQYLSRUSA-N 0 0 382.416 3.366 20 5 GGBDRN O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)OCc1ccccc1Cl ZINC000113221843 1412278677 /nfs/dbraw/zinc/27/86/77/1412278677.db2.gz HSHMVJVQPFYINA-UHFFFAOYSA-N 0 0 383.187 3.375 20 5 GGBDRN Cc1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1C(=O)N(C)C ZINC000177221038 1428638295 /nfs/dbraw/zinc/63/82/95/1428638295.db2.gz WCBOVDKAWXRERA-UHFFFAOYSA-N 0 0 381.392 3.267 20 5 GGBDRN NC(=O)Nc1ccc(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000113319475 1412292374 /nfs/dbraw/zinc/29/23/74/1412292374.db2.gz KDOIOSBBUOIKKV-UHFFFAOYSA-N 0 0 383.433 3.499 20 5 GGBDRN CCS(=O)(=O)C[C@H](C)NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000113350282 1412296306 /nfs/dbraw/zinc/29/63/06/1412296306.db2.gz GPCNSKNNQRBWOG-ZDUSSCGKSA-N 0 0 396.440 3.439 20 5 GGBDRN C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113429312 1412305844 /nfs/dbraw/zinc/30/58/44/1412305844.db2.gz VGYGMKIETVSMMI-SECBINFHSA-N 0 0 389.318 3.064 20 5 GGBDRN O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1Cl)OCc1ccccc1Cl ZINC000113444464 1412306508 /nfs/dbraw/zinc/30/65/08/1412306508.db2.gz KECWZAWSQROMEB-UHFFFAOYSA-N 0 0 383.187 3.375 20 5 GGBDRN O=C(OCc1ccc(Cl)nc1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000113491879 1412310126 /nfs/dbraw/zinc/31/01/26/1412310126.db2.gz BNXGLTNOYCACPZ-LLVKDONJSA-N 0 0 395.824 3.053 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)C[C@@H]3CCOC3)cc2[N+](=O)[O-])C1 ZINC000177226857 1428640951 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394.387 3.274 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000113775108 1412342266 /nfs/dbraw/zinc/34/22/66/1412342266.db2.gz YSFXVJODKWURED-UHFFFAOYSA-N 0 0 379.376 3.055 20 5 GGBDRN CN(C(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000113775467 1412342289 /nfs/dbraw/zinc/34/22/89/1412342289.db2.gz GIMBVIOJIAGUQW-UHFFFAOYSA-N 0 0 381.348 3.030 20 5 GGBDRN O=C1[C@@H](Oc2cccnc2[N+](=O)[O-])CCN1c1cccc(OC(F)(F)F)c1 ZINC000113772850 1412342294 /nfs/dbraw/zinc/34/22/94/1412342294.db2.gz KZVLTXGTYBPHJH-ZDUSSCGKSA-N 0 0 383.282 3.073 20 5 GGBDRN Cn1nc(C(C)(C)C)cc1NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000113775437 1412342456 /nfs/dbraw/zinc/34/24/56/1412342456.db2.gz ACUKYLBQNZWPSP-UHFFFAOYSA-N 0 0 382.424 3.128 20 5 GGBDRN C[C@H]1CCCC[C@@H]1OCCNC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000113775194 1412342502 /nfs/dbraw/zinc/34/25/02/1412342502.db2.gz FXKATUYRWYOUPB-KXBFYZLASA-N 0 0 386.452 3.170 20 5 GGBDRN CN(CCOc1ccccc1F)C(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000113775518 1412342936 /nfs/dbraw/zinc/34/29/36/1412342936.db2.gz HNMZKDFBYKGCDA-UHFFFAOYSA-N 0 0 398.394 3.135 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1)c1noc(C)n1 ZINC000113844710 1412344869 /nfs/dbraw/zinc/34/48/69/1412344869.db2.gz AYXSGTFZYRQDDT-KRWDZBQOSA-N 0 0 382.376 3.123 20 5 GGBDRN COC(=O)[C@H](C)CN(C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000114063833 1412379325 /nfs/dbraw/zinc/37/93/25/1412379325.db2.gz BAACLAODPQSQIO-DNVCBOLYSA-N 0 0 399.447 3.324 20 5 GGBDRN O=C(NCc1ncc[nH]1)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000114124223 1412381946 /nfs/dbraw/zinc/38/19/46/1412381946.db2.gz NCILNWRWDISTGJ-UHFFFAOYSA-N 0 0 399.794 3.154 20 5 GGBDRN COC(=O)[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])Cc1ccc(O)cc1 ZINC000114183039 1412388785 /nfs/dbraw/zinc/38/87/85/1412388785.db2.gz ISSIYPKVRAOWGS-AWEZNQCLSA-N 0 0 381.388 3.292 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000114188454 1412389875 /nfs/dbraw/zinc/38/98/75/1412389875.db2.gz KYEAGJIAZJNMOJ-OAHLLOKOSA-N 0 0 384.354 3.485 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN(CCO)[C@@H]3CCc4ccccc43)n2)cc1 ZINC000114191830 1412391614 /nfs/dbraw/zinc/39/16/14/1412391614.db2.gz KCQRBPLULLXGBB-GOSISDBHSA-N 0 0 380.404 3.127 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN(CCO)[C@@H]3CCc4ccccc43)n2)c1 ZINC000114192073 1412391872 /nfs/dbraw/zinc/39/18/72/1412391872.db2.gz ONNLXOWBAWNBMY-GOSISDBHSA-N 0 0 380.404 3.127 20 5 GGBDRN CN(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCc2ccccc2C1 ZINC000114281216 1412401462 /nfs/dbraw/zinc/40/14/62/1412401462.db2.gz CSGLCLKMRKQOKP-KRWDZBQOSA-N 0 0 376.416 3.410 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)O[C@H](Cc1ccc(Cl)cc1)C(F)(F)F ZINC000114307083 1412408740 /nfs/dbraw/zinc/40/87/40/1412408740.db2.gz HOCXCGJOYPSNPG-LLVKDONJSA-N 0 0 377.706 3.162 20 5 GGBDRN C[C@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000114317961 1412412857 /nfs/dbraw/zinc/41/28/57/1412412857.db2.gz ACKIUQJYIIAVDC-CYBMUJFWSA-N 0 0 379.482 3.157 20 5 GGBDRN CC(C)(C)c1csc(C2CCN(C(=O)CCn3cc([N+](=O)[O-])cn3)CC2)n1 ZINC000114334869 1412415417 /nfs/dbraw/zinc/41/54/17/1412415417.db2.gz UHQFNBLVLDAFQG-UHFFFAOYSA-N 0 0 391.497 3.342 20 5 GGBDRN CC(C)[C@](C)(CNC(=O)OC(C)(C)C)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000114416422 1412428780 /nfs/dbraw/zinc/42/87/80/1412428780.db2.gz OBUQXTYSHKGGRO-SFHVURJKSA-N 0 0 383.420 3.403 20 5 GGBDRN Cc1[nH]n(C)c2nnc(NC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)c1-2 ZINC000114431828 1412433743 /nfs/dbraw/zinc/43/37/43/1412433743.db2.gz KIXYUTYVJKKIOM-UHFFFAOYSA-N 0 0 397.439 3.002 20 5 GGBDRN Cc1noc(COc2ccc(Nc3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)cc2)n1 ZINC000114451013 1412435672 /nfs/dbraw/zinc/43/56/72/1412435672.db2.gz CODSWYQBQCRFTB-UHFFFAOYSA-N 0 0 395.375 3.494 20 5 GGBDRN COc1cc(F)c([C@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1OC ZINC000114501637 1412447287 /nfs/dbraw/zinc/44/72/87/1412447287.db2.gz NUFSDOLGFRJLOQ-NWDGAFQWSA-N 0 0 391.399 3.429 20 5 GGBDRN Cc1noc(COc2ccc(N[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)cc2)n1 ZINC000114502408 1412447329 /nfs/dbraw/zinc/44/73/29/1412447329.db2.gz YFWUQJMKQFUMLE-GFCCVEGCSA-N 0 0 397.391 3.304 20 5 GGBDRN COc1cc(F)c([C@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000114501504 1412447528 /nfs/dbraw/zinc/44/75/28/1412447528.db2.gz FLVWRQYAPADAGQ-RYUDHWBXSA-N 0 0 391.399 3.429 20 5 GGBDRN Cc1noc(COc2ccc(N[C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])cc2)n1 ZINC000114502582 1412448510 /nfs/dbraw/zinc/44/85/10/1412448510.db2.gz ZOSKVAYYEBILIE-LBPRGKRZSA-N 0 0 397.391 3.304 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000114522746 1412451150 /nfs/dbraw/zinc/45/11/50/1412451150.db2.gz IVODGZYJNKZEQO-LBPRGKRZSA-N 0 0 391.399 3.354 20 5 GGBDRN CN(C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCc2ccccc2C1 ZINC000114539507 1412455485 /nfs/dbraw/zinc/45/54/85/1412455485.db2.gz CXBNZPGPKUVVRR-HNNXBMFYSA-N 0 0 377.400 3.066 20 5 GGBDRN CC(C)(CNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1cccs1 ZINC000114551832 1412459026 /nfs/dbraw/zinc/45/90/26/1412459026.db2.gz ZGXJJLQRXQUNGB-UHFFFAOYSA-N 0 0 395.868 3.134 20 5 GGBDRN CSc1ccc(C(=O)NC[C@@](C)(O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000114555501 1412460799 /nfs/dbraw/zinc/46/07/99/1412460799.db2.gz QNWKPSYIQGQJCJ-QGZVFWFLSA-N 0 0 382.388 3.232 20 5 GGBDRN C[C@](O)(CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1 ZINC000114572302 1412463564 /nfs/dbraw/zinc/46/35/64/1412463564.db2.gz GQVQHSCVWZTLAC-KRWDZBQOSA-N 0 0 381.335 3.225 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCc1nc(-c2cccc(Cl)c2)no1 ZINC000114646538 1412486665 /nfs/dbraw/zinc/48/66/65/1412486665.db2.gz PQFFXBLZHZNVAM-UHFFFAOYSA-N 0 0 386.795 3.200 20 5 GGBDRN O=C(NCCc1nc(-c2cccc(Cl)c2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000114646603 1412486686 /nfs/dbraw/zinc/48/66/86/1412486686.db2.gz PROURMMICOSYRG-UHFFFAOYSA-N 0 0 390.758 3.410 20 5 GGBDRN Cc1nc([C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc2F)no1 ZINC000114647874 1412487084 /nfs/dbraw/zinc/48/70/84/1412487084.db2.gz JXOKUPYFDSKIKX-GOSISDBHSA-N 0 0 399.382 3.133 20 5 GGBDRN Cc1nc([C@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)c2ccccc2F)no1 ZINC000114648284 1412487315 /nfs/dbraw/zinc/48/73/15/1412487315.db2.gz WIBWVMJTDSXSPP-CQSZACIVSA-N 0 0 376.369 3.315 20 5 GGBDRN Cc1ccc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1OC(F)F ZINC000114667331 1412492076 /nfs/dbraw/zinc/49/20/76/1412492076.db2.gz RWXJDIMNAIMSLR-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN CC1CCC(=CC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CC1 ZINC000114679168 1412496180 /nfs/dbraw/zinc/49/61/80/1412496180.db2.gz QELODNQDEPCJLD-UHFFFAOYSA-N 0 0 377.466 3.077 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000114693465 1412500533 /nfs/dbraw/zinc/50/05/33/1412500533.db2.gz UYFUIHDDONMOLG-LBPRGKRZSA-N 0 0 383.832 3.378 20 5 GGBDRN Cc1nc([C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)c2ccccc2F)no1 ZINC000114695790 1412501434 /nfs/dbraw/zinc/50/14/34/1412501434.db2.gz OACSPECDPBGNFL-KRWDZBQOSA-N 0 0 395.350 3.426 20 5 GGBDRN Cc1oc(C(N)=O)cc1-c1csc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)n1 ZINC000114701842 1412504686 /nfs/dbraw/zinc/50/46/86/1412504686.db2.gz FPTDIKCGJQKPPZ-UHFFFAOYSA-N 0 0 386.389 3.279 20 5 GGBDRN CSc1ccc(C(=O)N2CCN([C@H](C)c3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000114706518 1412506695 /nfs/dbraw/zinc/50/66/95/1412506695.db2.gz RMHPUYBKOIRRTE-CQSZACIVSA-N 0 0 386.477 3.231 20 5 GGBDRN Cc1ccc([C@@H]2CCCN2C(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)s1 ZINC000114707862 1412507066 /nfs/dbraw/zinc/50/70/66/1412507066.db2.gz TZMDAKAGNQQRDK-CJNGLKHVSA-N 0 0 387.461 3.447 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)ccc1[N+](=O)[O-] ZINC000177262068 1428659065 /nfs/dbraw/zinc/65/90/65/1428659065.db2.gz ALVMREVBUKZXSG-UHFFFAOYSA-N 0 0 383.404 3.064 20 5 GGBDRN COc1ccc([C@@H]2CCCN2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1OC ZINC000114724561 1412512015 /nfs/dbraw/zinc/51/20/15/1412512015.db2.gz MTMJGAKEGRRPFR-INIZCTEOSA-N 0 0 385.420 3.388 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000177261591 1428659336 /nfs/dbraw/zinc/65/93/36/1428659336.db2.gz OOEYQTDXMZGFPD-UHFFFAOYSA-N 0 0 383.404 3.064 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1ccn(Cc2ccccc2)n1 ZINC000114753086 1412519307 /nfs/dbraw/zinc/51/93/07/1412519307.db2.gz VXCIVAOJQQDEOY-CQSZACIVSA-N 0 0 395.419 3.287 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000114763105 1412521076 /nfs/dbraw/zinc/52/10/76/1412521076.db2.gz FNCSHNJUPAVVGC-UHFFFAOYSA-N 0 0 393.447 3.238 20 5 GGBDRN COc1cc(CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1O ZINC000114797621 1412527216 /nfs/dbraw/zinc/52/72/16/1412527216.db2.gz WZSUWJHNANCVKP-UHFFFAOYSA-N 0 0 399.447 3.272 20 5 GGBDRN Cc1sc(=O)n(CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1C ZINC000115028288 1412571368 /nfs/dbraw/zinc/57/13/68/1412571368.db2.gz LRHPWBBKZCMFNU-UHFFFAOYSA-N 0 0 387.364 3.065 20 5 GGBDRN CCOC(=O)c1ccccc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000115085032 1412585978 /nfs/dbraw/zinc/58/59/78/1412585978.db2.gz SYILDZUDVWTEQX-UHFFFAOYSA-N 0 0 380.360 3.210 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000115103956 1412587870 /nfs/dbraw/zinc/58/78/70/1412587870.db2.gz JQTGEGOYFFDUFL-HNNXBMFYSA-N 0 0 384.392 3.210 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2)C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000115105647 1412588398 /nfs/dbraw/zinc/58/83/98/1412588398.db2.gz KRVIBBKEPCIRIM-INIZCTEOSA-N 0 0 391.431 3.179 20 5 GGBDRN Cc1cc(=O)c(C(=O)N(C)[C@@H](C)c2ccccc2)nn1-c1ccccc1[N+](=O)[O-] ZINC000115157942 1412600339 /nfs/dbraw/zinc/60/03/39/1412600339.db2.gz IPZVMWLPGORFKD-HNNXBMFYSA-N 0 0 392.415 3.282 20 5 GGBDRN CCC(CC)c1nnc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)s1 ZINC000115165372 1412601685 /nfs/dbraw/zinc/60/16/85/1412601685.db2.gz ITMJHRWQTUPWSX-UHFFFAOYSA-N 0 0 387.425 3.183 20 5 GGBDRN CCc1ccc(OCC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000115200815 1412605389 /nfs/dbraw/zinc/60/53/89/1412605389.db2.gz NIYVQCYEFKIVIF-IBGZPJMESA-N 0 0 388.395 3.275 20 5 GGBDRN CCc1ccc(OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c([N+](=O)[O-])c1 ZINC000115201192 1412605626 /nfs/dbraw/zinc/60/56/26/1412605626.db2.gz HHHAPKTVIZDRCT-UHFFFAOYSA-N 0 0 383.404 3.067 20 5 GGBDRN CCc1ccc(OCC(=O)NC[C@H]2CCN(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000115200937 1412605634 /nfs/dbraw/zinc/60/56/34/1412605634.db2.gz HDQTVNSIDSXWFS-QGZVFWFLSA-N 0 0 383.448 3.179 20 5 GGBDRN CCc1ccc(OCC(=O)Nc2cccc(N3CCCC3=O)c2)c([N+](=O)[O-])c1 ZINC000115201190 1412605830 /nfs/dbraw/zinc/60/58/30/1412605830.db2.gz IQLMZZJPQYTWOP-UHFFFAOYSA-N 0 0 383.404 3.302 20 5 GGBDRN CCc1ccc(OCc2nnc3n2c2ccccc2c(=O)n3CC)c([N+](=O)[O-])c1 ZINC000115201194 1412606095 /nfs/dbraw/zinc/60/60/95/1412606095.db2.gz RYSGRZQSLCRPPN-UHFFFAOYSA-N 0 0 393.403 3.114 20 5 GGBDRN CN1C(=O)C[C@@H](C(=O)NCc2ccccc2[N+](=O)[O-])[C@H]1c1cccc(Cl)c1 ZINC000115209769 1412609495 /nfs/dbraw/zinc/60/94/95/1412609495.db2.gz VBQLWCBUYOMKLK-CRAIPNDOSA-N 0 0 387.823 3.084 20 5 GGBDRN CN1C(=O)C[C@@H](C(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(Cl)c1 ZINC000115209772 1412609788 /nfs/dbraw/zinc/60/97/88/1412609788.db2.gz VBQLWCBUYOMKLK-QAPCUYQASA-N 0 0 387.823 3.084 20 5 GGBDRN CN1C(=O)C[C@@H](C(=O)NCc2cccc([N+](=O)[O-])c2)[C@H]1c1cccc(Cl)c1 ZINC000115212340 1412610678 /nfs/dbraw/zinc/61/06/78/1412610678.db2.gz KUWZYFMEXAYEOD-SJLPKXTDSA-N 0 0 387.823 3.084 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)C[C@@H]2CCOC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000177268004 1428663504 /nfs/dbraw/zinc/66/35/04/1428663504.db2.gz NLVSSSYABHXBKV-GJZGRUSLSA-N 0 0 384.436 3.271 20 5 GGBDRN Cc1cccc(Oc2ccc(NC(=O)Cn3cc([N+](=O)[O-])ccc3=O)cn2)c1C ZINC000115232599 1412616988 /nfs/dbraw/zinc/61/69/88/1412616988.db2.gz VOCCZGSSIUTZKX-UHFFFAOYSA-N 0 0 394.387 3.199 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115239022 1412619043 /nfs/dbraw/zinc/61/90/43/1412619043.db2.gz MUKMLOPJGLVSHK-UHFFFAOYSA-N 0 0 395.394 3.367 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)c1[N+](=O)[O-] ZINC000115252036 1412620142 /nfs/dbraw/zinc/62/01/42/1412620142.db2.gz VXCIIKZNXPWOTN-QGZVFWFLSA-N 0 0 379.420 3.054 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1 ZINC000115257204 1412623232 /nfs/dbraw/zinc/62/32/32/1412623232.db2.gz XZYRLPGDHAIXCH-MUUNZHRXSA-N 0 0 398.444 3.046 20 5 GGBDRN Cn1cc(C(=O)Nc2cccc(C[S@](C)=O)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000115261065 1412624894 /nfs/dbraw/zinc/62/48/94/1412624894.db2.gz KVYOEYSALRKSOO-MUUNZHRXSA-N 0 0 398.444 3.126 20 5 GGBDRN C[S@](=O)Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)ccc1Cl ZINC000115268103 1412626558 /nfs/dbraw/zinc/62/65/58/1412626558.db2.gz DOWNCONSJJXHJD-AREMUKBSSA-N 0 0 397.796 3.287 20 5 GGBDRN Cc1cccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1C ZINC000115286167 1412634530 /nfs/dbraw/zinc/63/45/30/1412634530.db2.gz BFPCCABVUDUNFF-CYBMUJFWSA-N 0 0 376.434 3.106 20 5 GGBDRN CC(C)(C)Oc1ccccc1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000115300702 1412641627 /nfs/dbraw/zinc/64/16/27/1412641627.db2.gz WRXHBEOFFMGDND-UHFFFAOYSA-N 0 0 385.376 3.319 20 5 GGBDRN CN(C)[C@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000115410842 1412669187 /nfs/dbraw/zinc/66/91/87/1412669187.db2.gz SEBJISUZKDFRRZ-MRXNPFEDSA-N 0 0 393.390 3.061 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1nc(-c2cccc(Cl)c2)no1 ZINC000115409768 1412669569 /nfs/dbraw/zinc/66/95/69/1412669569.db2.gz NKKXOMNDFIHLEB-UHFFFAOYSA-N 0 0 387.783 3.027 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115476696 1412686913 /nfs/dbraw/zinc/68/69/13/1412686913.db2.gz KRQSQTDSSJKDBC-CQSZACIVSA-N 0 0 399.422 3.291 20 5 GGBDRN CCOc1cc2c(cc1CNC(=O)CCNc1ccccc1[N+](=O)[O-])O[C@H](C)C2 ZINC000115486367 1412689741 /nfs/dbraw/zinc/68/97/41/1412689741.db2.gz DWHUTJRQSXPCJB-CQSZACIVSA-N 0 0 399.447 3.435 20 5 GGBDRN Cc1ccnc(N(C)C[C@H](O)COc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000115516207 1412700161 /nfs/dbraw/zinc/70/01/61/1412700161.db2.gz JJNUTOBGIOPVLH-LBPRGKRZSA-N 0 0 385.342 3.193 20 5 GGBDRN CN(C)[C@H](CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1c(F)cccc1F ZINC000115518798 1412700512 /nfs/dbraw/zinc/70/05/12/1412700512.db2.gz IXQYGPBMQIEVEZ-QGZVFWFLSA-N 0 0 390.390 3.473 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccc(-c3nccc(C)n3)cc2)c([N+](=O)[O-])c1 ZINC000115528906 1412701348 /nfs/dbraw/zinc/70/13/48/1412701348.db2.gz GKJYLRMNNRIWAV-UHFFFAOYSA-N 0 0 393.403 3.419 20 5 GGBDRN Cc1nn(C)c(C)c1C(=O)C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000115529574 1412702136 /nfs/dbraw/zinc/70/21/36/1412702136.db2.gz CPIMGZJHTZHBMT-UHFFFAOYSA-N 0 0 399.432 3.198 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2)CN1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000115554810 1412709174 /nfs/dbraw/zinc/70/91/74/1412709174.db2.gz LLFJPUHXZVRSTG-UKRRQHHQSA-N 0 0 383.404 3.140 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000115554806 1412709569 /nfs/dbraw/zinc/70/95/69/1412709569.db2.gz LLFJPUHXZVRSTG-HIFRSBDPSA-N 0 0 383.404 3.140 20 5 GGBDRN C[C@H]1C[C@H](c2ccccc2)CN1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000115554808 1412709690 /nfs/dbraw/zinc/70/96/90/1412709690.db2.gz LLFJPUHXZVRSTG-ZFWWWQNUSA-N 0 0 383.404 3.140 20 5 GGBDRN O=C(CN1CCSC[C@H]1c1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000115559426 1412710502 /nfs/dbraw/zinc/71/05/02/1412710502.db2.gz OBJXSRYEXDDWPD-IBGZPJMESA-N 0 0 383.473 3.274 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCSC[C@H]1c1ccccc1 ZINC000115559135 1412711505 /nfs/dbraw/zinc/71/15/05/1412711505.db2.gz UAFVJIVGTMXBGS-KRWDZBQOSA-N 0 0 387.461 3.332 20 5 GGBDRN COC(=O)c1cc(C(=O)N(Cc2ccco2)Cc2cccnc2)cc([N+](=O)[O-])c1 ZINC000115571222 1412716450 /nfs/dbraw/zinc/71/64/50/1412716450.db2.gz FDLJLGYLKSYBER-UHFFFAOYSA-N 0 0 395.371 3.212 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000115587471 1412721223 /nfs/dbraw/zinc/72/12/23/1412721223.db2.gz VTMVJOVMGQSIIX-DZGCQCFKSA-N 0 0 376.434 3.170 20 5 GGBDRN CCc1ccc(OS(=O)(=O)c2ccc3oc(=O)ccc3c2)c([N+](=O)[O-])c1 ZINC000115592977 1412723324 /nfs/dbraw/zinc/72/33/24/1412723324.db2.gz HGPFNULSIPKJHC-UHFFFAOYSA-N 0 0 375.358 3.031 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccc(I)cn1 ZINC000115630772 1412738536 /nfs/dbraw/zinc/73/85/36/1412738536.db2.gz JHCZFDIRAIJQIU-FPYGCLRLSA-N 0 0 395.156 3.246 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1nnnn1-c1ccccc1 ZINC000115640958 1412741508 /nfs/dbraw/zinc/74/15/08/1412741508.db2.gz NDBISAMADNOSFD-SNVBAGLBSA-N 0 0 387.787 3.107 20 5 GGBDRN Cc1cccc([C@@H](C)NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000115726199 1412773724 /nfs/dbraw/zinc/77/37/24/1412773724.db2.gz IQPZRLRMSAUFJN-CYBMUJFWSA-N 0 0 389.839 3.472 20 5 GGBDRN CN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000115807721 1412794872 /nfs/dbraw/zinc/79/48/72/1412794872.db2.gz WRPWBCLKPVTCSX-HXUWFJFHSA-N 0 0 382.464 3.448 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c1 ZINC000115859342 1412803070 /nfs/dbraw/zinc/80/30/70/1412803070.db2.gz WMDKBZBXDKBHGP-GFCCVEGCSA-N 0 0 383.404 3.443 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)c1 ZINC000115864208 1412803923 /nfs/dbraw/zinc/80/39/23/1412803923.db2.gz NJLJNWRBLCTYRV-UHFFFAOYSA-N 0 0 387.411 3.091 20 5 GGBDRN C[C@H]1CCC[C@H](CCNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000115893203 1412811644 /nfs/dbraw/zinc/81/16/44/1412811644.db2.gz DCVYZZKYIKPAAF-NWDGAFQWSA-N 0 0 399.394 3.467 20 5 GGBDRN CCc1ccc(OC(=O)/C(=C/c2cccc(F)c2)n2nnnc2C)c([N+](=O)[O-])c1 ZINC000115927319 1412816136 /nfs/dbraw/zinc/81/61/36/1412816136.db2.gz FPZOVACIRXWUBP-BOPFTXTBSA-N 0 0 397.366 3.195 20 5 GGBDRN CCc1ccc(OC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000115926056 1412816197 /nfs/dbraw/zinc/81/61/97/1412816197.db2.gz DYNBDWLYZRPZKX-QGZVFWFLSA-N 0 0 382.416 3.296 20 5 GGBDRN CCc1ccc(OC(=O)[C@@H](C)S(=O)(=O)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000115926075 1412816221 /nfs/dbraw/zinc/81/62/21/1412816221.db2.gz RQTCGTMEKRJZQW-LLVKDONJSA-N 0 0 381.381 3.064 20 5 GGBDRN CCc1ccc(OC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(C)=O)c([N+](=O)[O-])c1 ZINC000115926811 1412816341 /nfs/dbraw/zinc/81/63/41/1412816341.db2.gz TWDYPHJFXXZJOR-SFHVURJKSA-N 0 0 395.415 3.291 20 5 GGBDRN CCNC(=O)c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000115968128 1412818969 /nfs/dbraw/zinc/81/89/69/1412818969.db2.gz KKTPEMVCEGONGV-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1c2cccc(F)c2CC[C@H]1C ZINC000177301436 1428678261 /nfs/dbraw/zinc/67/82/61/1428678261.db2.gz NICSYHXZPHAHTA-XIKOKIGWSA-N 0 0 385.395 3.421 20 5 GGBDRN O=C(COC(=O)[C@H]1C[C@H]1c1c(F)cccc1F)Nc1cccc([N+](=O)[O-])c1 ZINC000116017312 1412822064 /nfs/dbraw/zinc/82/20/64/1412822064.db2.gz RISZACIGSPKZIM-OLZOCXBDSA-N 0 0 376.315 3.158 20 5 GGBDRN COc1cccc(CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])c1OC ZINC000116036567 1412823879 /nfs/dbraw/zinc/82/38/79/1412823879.db2.gz NZSFYPVQVHPTMP-UHFFFAOYSA-N 0 0 396.403 3.189 20 5 GGBDRN CCNC(=O)c1ccc(OC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000116037000 1412824336 /nfs/dbraw/zinc/82/43/36/1412824336.db2.gz JLSJNGIGMXKLFG-UHFFFAOYSA-N 0 0 393.193 3.326 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc2[nH]c(-c3cccc(F)c3)nc2c1 ZINC000116046505 1412824713 /nfs/dbraw/zinc/82/47/13/1412824713.db2.gz WEIQJAGDXLGWNF-UHFFFAOYSA-N 0 0 394.366 3.421 20 5 GGBDRN CSc1ccc(C(=O)N[C@H]2CCC[C@@H](C(=O)NC(C)C)C2)cc1[N+](=O)[O-] ZINC000116051991 1412825066 /nfs/dbraw/zinc/82/50/66/1412825066.db2.gz OANKMKMWACWLDF-OCCSQVGLSA-N 0 0 379.482 3.130 20 5 GGBDRN O=C(CCc1nc(-c2ccccn2)no1)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116063206 1412826995 /nfs/dbraw/zinc/82/69/95/1412826995.db2.gz AGIDHUCKVWDUPX-UHFFFAOYSA-N 0 0 388.767 3.369 20 5 GGBDRN COc1cc(C(=O)N2CCc3ccccc3CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000116069869 1412827636 /nfs/dbraw/zinc/82/76/36/1412827636.db2.gz GHNGKVMAURSJBB-UHFFFAOYSA-N 0 0 392.358 3.446 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000116087953 1412830050 /nfs/dbraw/zinc/83/00/50/1412830050.db2.gz WPZZCAMTXUCAJM-UHFFFAOYSA-N 0 0 395.246 3.255 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000116093639 1412830999 /nfs/dbraw/zinc/83/09/99/1412830999.db2.gz WPPNLBLHJYMHII-GXFFZTMASA-N 0 0 377.303 3.376 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)c([N+](=O)[O-])cc1OC ZINC000116097806 1412831556 /nfs/dbraw/zinc/83/15/56/1412831556.db2.gz WYEHSCUTTKKBOB-NOZJJQNGSA-N 0 0 378.331 3.176 20 5 GGBDRN Cc1c(C(=O)NC2(c3nccs3)CCCC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000116103532 1412832288 /nfs/dbraw/zinc/83/22/88/1412832288.db2.gz AHOWCHNRRVZBLO-UHFFFAOYSA-N 0 0 398.448 3.140 20 5 GGBDRN O=C(NC1(c2nccs2)CCCC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000116105581 1412832739 /nfs/dbraw/zinc/83/27/39/1412832739.db2.gz SYSGCPDKYKADAM-UHFFFAOYSA-N 0 0 383.433 3.436 20 5 GGBDRN O=C(N[C@H]1CCCN(c2cccc(F)c2)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000116108799 1412833156 /nfs/dbraw/zinc/83/31/56/1412833156.db2.gz VMBJWFSABMRJOJ-AWEZNQCLSA-N 0 0 388.355 3.041 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cccc(CSC3CCOCC3)c2)c1[N+](=O)[O-] ZINC000116131529 1412835045 /nfs/dbraw/zinc/83/50/45/1412835045.db2.gz QYSYLWSYMYVLGX-UHFFFAOYSA-N 0 0 390.465 3.301 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000177305006 1428679805 /nfs/dbraw/zinc/67/98/05/1428679805.db2.gz YJDAMYLGGZDHJZ-YBOJIHHZSA-N 0 0 391.405 3.074 20 5 GGBDRN COCCCn1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000116152606 1412837386 /nfs/dbraw/zinc/83/73/86/1412837386.db2.gz HSWLSFNSSXHWAP-UHFFFAOYSA-N 0 0 387.421 3.204 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)c2ccc3c(c2)OCCO3)c1 ZINC000116153268 1412837635 /nfs/dbraw/zinc/83/76/35/1412837635.db2.gz KKFYDMVARXRUKG-UHFFFAOYSA-N 0 0 386.404 3.082 20 5 GGBDRN CCNc1ccc(C(=O)Nc2ccc3cnn(CCOC)c3c2)cc1[N+](=O)[O-] ZINC000116176124 1412839932 /nfs/dbraw/zinc/83/99/32/1412839932.db2.gz BTVNBNINURCTMA-UHFFFAOYSA-N 0 0 383.408 3.275 20 5 GGBDRN COc1cc(C(=O)NCCc2ccc(C)cc2)c([N+](=O)[O-])cc1OC(F)F ZINC000116205636 1412842420 /nfs/dbraw/zinc/84/24/20/1412842420.db2.gz WBDMUIMBZZERAM-UHFFFAOYSA-N 0 0 380.347 3.486 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000116264493 1412846607 /nfs/dbraw/zinc/84/66/07/1412846607.db2.gz QTMOIRLVLUZHEJ-HXUWFJFHSA-N 0 0 399.447 3.420 20 5 GGBDRN CC(=O)c1ccc(N(Cc2ccc(Cl)cc2[N+](=O)[O-])S(C)(=O)=O)cc1 ZINC000116268050 1412847206 /nfs/dbraw/zinc/84/72/06/1412847206.db2.gz CGFSTKXUTQQGMW-UHFFFAOYSA-N 0 0 382.825 3.417 20 5 GGBDRN O=C(CN1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)Nc1ccccc1 ZINC000116271786 1412847217 /nfs/dbraw/zinc/84/72/17/1412847217.db2.gz PJNVJMANGDRJDQ-UHFFFAOYSA-N 0 0 388.855 3.005 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N(C)CCc3ccncc3)cc2)c(C)c1[N+](=O)[O-] ZINC000116351691 1412852109 /nfs/dbraw/zinc/85/21/09/1412852109.db2.gz ZUEROIOSWQGSRL-UHFFFAOYSA-N 0 0 393.447 3.166 20 5 GGBDRN COc1cc(C(=O)NCCc2cccc(C)c2)c([N+](=O)[O-])cc1OC(F)F ZINC000116384839 1412853641 /nfs/dbraw/zinc/85/36/41/1412853641.db2.gz WYXPLBXLNOFPJC-UHFFFAOYSA-N 0 0 380.347 3.486 20 5 GGBDRN C[C@H](OC(=O)c1csc(-c2ccccn2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000116419108 1412856827 /nfs/dbraw/zinc/85/68/27/1412856827.db2.gz RXJBALGRLZBDKV-NSHDSACASA-N 0 0 398.400 3.297 20 5 GGBDRN CCC[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000116458318 1412863197 /nfs/dbraw/zinc/86/31/97/1412863197.db2.gz SAYNBLHZMBEGTJ-OAHLLOKOSA-N 0 0 385.449 3.387 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCC[C@H](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000116459551 1412863406 /nfs/dbraw/zinc/86/34/06/1412863406.db2.gz IHFATXOWJDNBRA-HNNXBMFYSA-N 0 0 391.468 3.008 20 5 GGBDRN COc1ccccc1N1CC[C@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000116469884 1412864956 /nfs/dbraw/zinc/86/49/56/1412864956.db2.gz OXZFVRGGSYPEDF-VGMNTSGFSA-N 0 0 381.432 3.259 20 5 GGBDRN CN(C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)c1cc(F)ccc1F ZINC000116481317 1412866143 /nfs/dbraw/zinc/86/61/43/1412866143.db2.gz JEWDOWDZRDAESD-JTQLQIEISA-N 0 0 393.321 3.028 20 5 GGBDRN CN(C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)c1cc(F)ccc1F ZINC000116481314 1412866192 /nfs/dbraw/zinc/86/61/92/1412866192.db2.gz JEWDOWDZRDAESD-SNVBAGLBSA-N 0 0 393.321 3.028 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(n2c(C)ccc2C)CC1 ZINC000116500657 1412868977 /nfs/dbraw/zinc/86/89/77/1412868977.db2.gz SBSBSVSIRYJPKR-UHFFFAOYSA-N 0 0 393.465 3.048 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000116543979 1412874946 /nfs/dbraw/zinc/87/49/46/1412874946.db2.gz PZTOYLOVNGKPEQ-CYBMUJFWSA-N 0 0 389.412 3.001 20 5 GGBDRN O=C(Nc1ccc(CN2C(=O)CSC2=O)cc1)c1cc([N+](=O)[O-])ccc1F ZINC000116551452 1412876153 /nfs/dbraw/zinc/87/61/53/1412876153.db2.gz CKYNTEKHDYUXCY-UHFFFAOYSA-N 0 0 389.364 3.182 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H]1C[C@H]1c1c(F)cccc1F ZINC000116583300 1412882477 /nfs/dbraw/zinc/88/24/77/1412882477.db2.gz NCSIWMSBBJOQAX-OTYXRUKQSA-N 0 0 395.749 3.137 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(C(=O)Nc2ccccn2)c1 ZINC000116587236 1412884001 /nfs/dbraw/zinc/88/40/01/1412884001.db2.gz ZJLWDQXUPDEGCL-UHFFFAOYSA-N 0 0 392.371 3.260 20 5 GGBDRN Cc1ccc(CCC(=O)NCC(=O)OCc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000116599717 1412885656 /nfs/dbraw/zinc/88/56/56/1412885656.db2.gz NGCGHJTVPGFNIU-UHFFFAOYSA-N 0 0 390.823 3.349 20 5 GGBDRN COc1cc(-c2noc(CCOc3ccc(Cl)cc3[N+](=O)[O-])n2)ccn1 ZINC000116607464 1412886556 /nfs/dbraw/zinc/88/65/56/1412886556.db2.gz MZJXDQHLLZCIEG-UHFFFAOYSA-N 0 0 376.756 3.323 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116619516 1412887592 /nfs/dbraw/zinc/88/75/92/1412887592.db2.gz CMONCHOLDBCSIA-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCn2c3ccccc3nc21 ZINC000116624395 1412888275 /nfs/dbraw/zinc/88/82/75/1412888275.db2.gz XGPYPXJVKDBMJH-UHFFFAOYSA-N 0 0 386.795 3.414 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(-n2cccn2)nc1 ZINC000116624257 1412888278 /nfs/dbraw/zinc/88/82/78/1412888278.db2.gz NLLZHXUYNYPULE-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN COCc1ccccc1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116625778 1412888531 /nfs/dbraw/zinc/88/85/31/1412888531.db2.gz VQWMDXKCGUDZFD-UHFFFAOYSA-N 0 0 378.812 3.480 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H]1Cc2ccccc2O1 ZINC000116626915 1412888678 /nfs/dbraw/zinc/88/86/78/1412888678.db2.gz HKAVXOSPEFXBTK-CQSZACIVSA-N 0 0 376.796 3.137 20 5 GGBDRN Cc1noc(C2CCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000116632184 1412889165 /nfs/dbraw/zinc/88/91/65/1412889165.db2.gz CJDKOFMOIVJLLH-UHFFFAOYSA-N 0 0 394.815 3.115 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCC(=O)Nc1ccccc1 ZINC000116646049 1412891212 /nfs/dbraw/zinc/89/12/12/1412891212.db2.gz MBVIINKXGMRVMF-UHFFFAOYSA-N 0 0 391.811 3.162 20 5 GGBDRN Cc1nn(CCC(=O)NCCOc2ccc(C(C)(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000116651600 1412891733 /nfs/dbraw/zinc/89/17/33/1412891733.db2.gz YDTVBBDWEMVSAZ-UHFFFAOYSA-N 0 0 388.468 3.291 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)COc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 ZINC000116654033 1412892043 /nfs/dbraw/zinc/89/20/43/1412892043.db2.gz LZOYRPMTONOMFL-UHFFFAOYSA-N 0 0 388.395 3.491 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000116659751 1412893291 /nfs/dbraw/zinc/89/32/91/1412893291.db2.gz IJKOPONCIOPCLO-NSHDSACASA-N 0 0 395.337 3.344 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000116659558 1412893355 /nfs/dbraw/zinc/89/33/55/1412893355.db2.gz CESGBAJOVKKQHG-CYBMUJFWSA-N 0 0 377.347 3.205 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000116659753 1412893408 /nfs/dbraw/zinc/89/34/08/1412893408.db2.gz IJKOPONCIOPCLO-LLVKDONJSA-N 0 0 395.337 3.344 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000116677482 1412895400 /nfs/dbraw/zinc/89/54/00/1412895400.db2.gz ZFDAWAQIADHDMF-UHFFFAOYSA-N 0 0 382.825 3.354 20 5 GGBDRN Cn1cc(CCCNC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cn1 ZINC000116688562 1412897627 /nfs/dbraw/zinc/89/76/27/1412897627.db2.gz HJOAVSQLZLCJQF-UHFFFAOYSA-N 0 0 393.447 3.303 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000116688942 1412897898 /nfs/dbraw/zinc/89/78/98/1412897898.db2.gz JTLFKMHQKIZLAU-SANMLTNESA-N 0 0 375.450 3.222 20 5 GGBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000116693290 1412898117 /nfs/dbraw/zinc/89/81/17/1412898117.db2.gz RCCFILNXIDRADG-HHHXNRCGSA-N 0 0 391.405 3.251 20 5 GGBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000116692786 1412898122 /nfs/dbraw/zinc/89/81/22/1412898122.db2.gz GHEXWSQWLHSAKQ-AREMUKBSSA-N 0 0 376.434 3.189 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000116693291 1412898303 /nfs/dbraw/zinc/89/83/03/1412898303.db2.gz RCCFILNXIDRADG-MHZLTWQESA-N 0 0 391.405 3.251 20 5 GGBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116693761 1412898480 /nfs/dbraw/zinc/89/84/80/1412898480.db2.gz ZAULZNODFISJGZ-MUUNZHRXSA-N 0 0 398.444 3.220 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000116695885 1412898614 /nfs/dbraw/zinc/89/86/14/1412898614.db2.gz IJFLEAFDIIEUTN-NDEPHWFRSA-N 0 0 398.444 3.220 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000116736580 1412911551 /nfs/dbraw/zinc/91/15/51/1412911551.db2.gz ZXXSAGJXFAPKNG-GFCCVEGCSA-N 0 0 378.816 3.146 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC[C@H]1c1ncc[nH]1 ZINC000116740741 1412911909 /nfs/dbraw/zinc/91/19/09/1412911909.db2.gz RQZHVFHPYOKYFO-ZDUSSCGKSA-N 0 0 378.816 3.494 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)CC(C)(C)c1ccccc1 ZINC000177320114 1428686865 /nfs/dbraw/zinc/68/68/65/1428686865.db2.gz ANAMLYRBCVQNDP-AWEZNQCLSA-N 0 0 399.447 3.415 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)CC(C)(C)c1ccccc1 ZINC000177320131 1428687001 /nfs/dbraw/zinc/68/70/01/1428687001.db2.gz ANAMLYRBCVQNDP-CQSZACIVSA-N 0 0 399.447 3.415 20 5 GGBDRN Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000116770333 1412921258 /nfs/dbraw/zinc/92/12/58/1412921258.db2.gz DAZGYHQEVLIMSG-QGZVFWFLSA-N 0 0 394.435 3.169 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116847173 1412941412 /nfs/dbraw/zinc/94/14/12/1412941412.db2.gz KOIALBVCPKZPBL-SANMLTNESA-N 0 0 396.852 3.396 20 5 GGBDRN Cc1ccc(OC2CCN(CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)CC2)cc1 ZINC000116868378 1412945130 /nfs/dbraw/zinc/94/51/30/1412945130.db2.gz QSJLMORYRMCLKP-UHFFFAOYSA-N 0 0 395.415 3.000 20 5 GGBDRN CCc1cc(N2CCC(OCCOC)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116872676 1412946317 /nfs/dbraw/zinc/94/63/17/1412946317.db2.gz TWDDDNYPOPRRGD-UHFFFAOYSA-N 0 0 386.452 3.246 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000116895643 1412951420 /nfs/dbraw/zinc/95/14/20/1412951420.db2.gz QCMUHQNAWKDWDA-HNNXBMFYSA-N 0 0 379.800 3.162 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000116903308 1412952454 /nfs/dbraw/zinc/95/24/54/1412952454.db2.gz GDYHBPQGZZJONV-UHFFFAOYSA-N 0 0 376.434 3.135 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000116897294 1412952698 /nfs/dbraw/zinc/95/26/98/1412952698.db2.gz BPIVGOPEAZAXNS-HNNXBMFYSA-N 0 0 379.800 3.162 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCCNc2cnccn2)cc1[N+](=O)[O-] ZINC000116930381 1412957180 /nfs/dbraw/zinc/95/71/80/1412957180.db2.gz FYFUIPHLNMNYLY-UHFFFAOYSA-N 0 0 389.481 3.365 20 5 GGBDRN CC(C)COc1ccc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cn1 ZINC000116980870 1412970643 /nfs/dbraw/zinc/97/06/43/1412970643.db2.gz BFDLEGNRTBLHJJ-UHFFFAOYSA-N 0 0 382.376 3.118 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000116983634 1412971409 /nfs/dbraw/zinc/97/14/09/1412971409.db2.gz ANXFYFSOVKMTGA-QGZVFWFLSA-N 0 0 378.812 3.499 20 5 GGBDRN Cc1nn(C)c(Cl)c1COC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116992480 1412974421 /nfs/dbraw/zinc/97/44/21/1412974421.db2.gz CCFGJAKEFUUDCI-UHFFFAOYSA-N 0 0 388.207 3.456 20 5 GGBDRN CN(C[C@@H]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000177327539 1428691892 /nfs/dbraw/zinc/69/18/92/1428691892.db2.gz ZFXXOAMEBPZOHT-LBPRGKRZSA-N 0 0 381.404 3.063 20 5 GGBDRN COc1cc(C(C)=O)ccc1OCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117108725 1413000499 /nfs/dbraw/zinc/00/04/99/1413000499.db2.gz LLUNQBZSQDUJHD-UHFFFAOYSA-N 0 0 386.360 3.183 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1n[nH]c(-c2ccccn2)n1 ZINC000117114340 1413001334 /nfs/dbraw/zinc/00/13/34/1413001334.db2.gz ATUABRTZIAKGOR-UHFFFAOYSA-N 0 0 384.421 3.204 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CSc3n[nH]c(-c4ccccn4)n3)n2)cc1 ZINC000117116166 1413002530 /nfs/dbraw/zinc/00/25/30/1413002530.db2.gz FGWDFRZBFXMMHF-UHFFFAOYSA-N 0 0 381.377 3.117 20 5 GGBDRN O=C(CSc1n[nH]c(-c2ccccn2)n1)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000117116029 1413002565 /nfs/dbraw/zinc/00/25/65/1413002565.db2.gz MDXNVRXVUYWTBC-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN CC[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000117160444 1413007666 /nfs/dbraw/zinc/00/76/66/1413007666.db2.gz AVLMOTIBRZOKCG-UONOGXRCSA-N 0 0 379.482 3.300 20 5 GGBDRN CC(C)[C@H](NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000117234449 1413016786 /nfs/dbraw/zinc/01/67/86/1413016786.db2.gz OEHCWGGUYHDBPE-SFHVURJKSA-N 0 0 389.839 3.492 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000117231414 1413017317 /nfs/dbraw/zinc/01/73/17/1413017317.db2.gz LAKVRULTNKXOCQ-UHFFFAOYSA-N 0 0 382.332 3.214 20 5 GGBDRN CCN(C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1C ZINC000117250277 1413019172 /nfs/dbraw/zinc/01/91/72/1413019172.db2.gz SPNNJBWDOJQHAA-TZMCWYRMSA-N 0 0 381.860 3.405 20 5 GGBDRN C[C@H]1Cc2ccccc2N(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000117253571 1413019639 /nfs/dbraw/zinc/01/96/39/1413019639.db2.gz WLYXQVXQWIRLRA-LBPRGKRZSA-N 0 0 387.823 3.203 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCSC[C@H]1c1ccccc1 ZINC000117261323 1413020391 /nfs/dbraw/zinc/02/03/91/1413020391.db2.gz ZZZHVBISKWXIDO-SFHVURJKSA-N 0 0 395.440 3.367 20 5 GGBDRN O=C(NC[C@@H]1CCCO1)Nc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000117284311 1413022797 /nfs/dbraw/zinc/02/27/97/1413022797.db2.gz UEKZRBJWHAYACX-AWEZNQCLSA-N 0 0 390.421 3.209 20 5 GGBDRN CCN1CCc2nc3ccccc3c(C(=O)NCc3ccccc3[N+](=O)[O-])c2C1 ZINC000117301837 1413023262 /nfs/dbraw/zinc/02/32/62/1413023262.db2.gz MPVRXSQWOJIPBY-UHFFFAOYSA-N 0 0 390.443 3.451 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)Cc1ccccc1 ZINC000117297394 1413023863 /nfs/dbraw/zinc/02/38/63/1413023863.db2.gz KGTSGDWHTNQKGL-HNNXBMFYSA-N 0 0 383.448 3.098 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CCSC2(CCCCC2)C1 ZINC000177333353 1428695017 /nfs/dbraw/zinc/69/50/17/1428695017.db2.gz FZNVYNZIDQLBME-UHFFFAOYSA-N 0 0 397.884 3.465 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000177333211 1428695071 /nfs/dbraw/zinc/69/50/71/1428695071.db2.gz IIIUCYCNTDATDP-GFCCVEGCSA-N 0 0 381.404 3.111 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cc(C[S@](C)=O)ccc1Cl ZINC000117333143 1413026651 /nfs/dbraw/zinc/02/66/51/1413026651.db2.gz SHOPOHSSTMZIPA-AREMUKBSSA-N 0 0 395.868 3.486 20 5 GGBDRN Cc1nc(-c2ccc(S(=O)(=O)Oc3ccc([N+](=O)[O-])c(F)c3)cc2)co1 ZINC000117361916 1413030626 /nfs/dbraw/zinc/03/06/26/1413030626.db2.gz LQPMFEMDADITLL-UHFFFAOYSA-N 0 0 378.337 3.465 20 5 GGBDRN CC(C)Cc1noc(CSCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)n1 ZINC000117380429 1413032393 /nfs/dbraw/zinc/03/23/93/1413032393.db2.gz MAMLISSDSOYLKO-UHFFFAOYSA-N 0 0 392.437 3.408 20 5 GGBDRN COC(=O)NCc1ccc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000117389704 1413033153 /nfs/dbraw/zinc/03/31/53/1413033153.db2.gz CUWOZHCCDKIRCC-UHFFFAOYSA-N 0 0 395.419 3.463 20 5 GGBDRN CCCc1nc(CSCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)no1 ZINC000117380605 1413033171 /nfs/dbraw/zinc/03/31/71/1413033171.db2.gz KYLWXJNCCSEILA-UHFFFAOYSA-N 0 0 378.410 3.162 20 5 GGBDRN O=C(CSCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)Nc1ccccc1 ZINC000117380877 1413033310 /nfs/dbraw/zinc/03/33/10/1413033310.db2.gz MKIBBVXZLLMQLK-UHFFFAOYSA-N 0 0 387.417 3.265 20 5 GGBDRN Cc1ccc(CCOC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000117535091 1413050632 /nfs/dbraw/zinc/05/06/32/1413050632.db2.gz GLBBZYIKWOISPU-OAHLLOKOSA-N 0 0 388.445 3.355 20 5 GGBDRN Cc1ccc(CCOC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000117535088 1413050654 /nfs/dbraw/zinc/05/06/54/1413050654.db2.gz GLBBZYIKWOISPU-HNNXBMFYSA-N 0 0 388.445 3.355 20 5 GGBDRN COc1ccccc1N(C)C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000117550185 1413051791 /nfs/dbraw/zinc/05/17/91/1413051791.db2.gz GDRODGKRVLQWFC-UHFFFAOYSA-N 0 0 382.319 3.490 20 5 GGBDRN 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CC(C)(C)C(=O)NCCCC(=O)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117677878 1413065492 /nfs/dbraw/zinc/06/54/92/1413065492.db2.gz ZJPMRFANSZVORW-UHFFFAOYSA-N 0 0 389.408 3.236 20 5 GGBDRN Cc1nn(CC(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)c1Cl ZINC000117677992 1413065610 /nfs/dbraw/zinc/06/56/10/1413065610.db2.gz NRKRFSMVKZMRAX-UHFFFAOYSA-N 0 0 390.783 3.460 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000117708880 1413068903 /nfs/dbraw/zinc/06/89/03/1413068903.db2.gz LEKMLZLEUYQQQR-GOSISDBHSA-N 0 0 397.431 3.464 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000117708516 1413069164 /nfs/dbraw/zinc/06/91/64/1413069164.db2.gz LNMOSEHFDLACAW-KRWDZBQOSA-N 0 0 383.404 3.155 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@@H](C)Cn2ccnc2)cc1 ZINC000117720224 1413071952 /nfs/dbraw/zinc/07/19/52/1413071952.db2.gz MINAGZMOTDDZPF-AWEZNQCLSA-N 0 0 396.403 3.411 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nncn1Cc1ccccc1 ZINC000117735507 1413073080 /nfs/dbraw/zinc/07/30/80/1413073080.db2.gz NPJCOCAPQAXVBP-CYBMUJFWSA-N 0 0 383.433 3.354 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)N(C)C ZINC000117744476 1413074593 /nfs/dbraw/zinc/07/45/93/1413074593.db2.gz XGEJPGCIFPEJRM-QGZVFWFLSA-N 0 0 391.855 3.218 20 5 GGBDRN CCO[C@@H](CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000177342260 1428699141 /nfs/dbraw/zinc/69/91/41/1428699141.db2.gz IIUBDHVYWZIPCV-SFHVURJKSA-N 0 0 387.436 3.152 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000117774622 1413077598 /nfs/dbraw/zinc/07/75/98/1413077598.db2.gz SGYRIRMQXQXUQL-UKRRQHHQSA-N 0 0 395.887 3.334 20 5 GGBDRN CN(C)c1cccc([C@@H]2CCCN2C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])c1 ZINC000117827613 1413082372 /nfs/dbraw/zinc/08/23/72/1413082372.db2.gz FGGPFBIOKCPSIP-SFHVURJKSA-N 0 0 397.431 3.216 20 5 GGBDRN O=C(NCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1)c1cn[nH]n1 ZINC000117858072 1413083299 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HFKMOIOOOXNJRN-KRWDZBQOSA-N 0 0 393.440 3.326 20 5 GGBDRN CC(C)N1C(=S)N=NC1C1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000117951970 1413091966 /nfs/dbraw/zinc/09/19/66/1413091966.db2.gz VVBYRJJALMKDDM-UHFFFAOYSA-N 0 0 390.469 3.467 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C2N=NC(=S)N2C2CC2)C1 ZINC000117951888 1413092048 /nfs/dbraw/zinc/09/20/48/1413092048.db2.gz XMYIQJGBLXXQSE-LLVKDONJSA-N 0 0 388.453 3.221 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000117986556 1413095091 /nfs/dbraw/zinc/09/50/91/1413095091.db2.gz YRAKAHDYAJQLOM-IBGZPJMESA-N 0 0 385.395 3.121 20 5 GGBDRN C[C@H](CO)NC(=O)NCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1 ZINC000118090486 1413106166 /nfs/dbraw/zinc/10/61/66/1413106166.db2.gz HTKIWKIBUUFGDS-SNVBAGLBSA-N 0 0 397.790 3.360 20 5 GGBDRN C[C@](O)(CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1cccs1 ZINC000177352050 1428702105 /nfs/dbraw/zinc/70/21/05/1428702105.db2.gz OCMLDDNTYFIJFI-AWEZNQCLSA-N 0 0 385.239 3.056 20 5 GGBDRN 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O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118469910 1413163417 /nfs/dbraw/zinc/16/34/17/1413163417.db2.gz ZTINFNKJQWRUKV-OAHLLOKOSA-N 0 0 384.219 3.434 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118517942 1413170020 /nfs/dbraw/zinc/17/00/20/1413170020.db2.gz DMIAVTUPBTZITA-AWEZNQCLSA-N 0 0 385.203 3.130 20 5 GGBDRN O=C(NC[C@@H](O)c1cc(Cl)cc(Cl)c1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000118517731 1413170126 /nfs/dbraw/zinc/17/01/26/1413170126.db2.gz PVPVEQUTXNECOL-CQSZACIVSA-N 0 0 395.202 3.241 20 5 GGBDRN Nc1c(C(=O)NC[C@@H](O)c2cc(Cl)cc(Cl)c2)cc(F)cc1[N+](=O)[O-] ZINC000118520330 1413170614 /nfs/dbraw/zinc/17/06/14/1413170614.db2.gz UFHQNQSEICEBFR-CYBMUJFWSA-N 0 0 388.182 3.086 20 5 GGBDRN CC(C)(C)NC(=O)c1ccccc1NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000118547667 1413174448 /nfs/dbraw/zinc/17/44/48/1413174448.db2.gz LFXGKOJGTIMQMR-UHFFFAOYSA-N 0 0 384.436 3.487 20 5 GGBDRN COc1ccc(-c2ccc(CNC(=O)Cn3cc([N+](=O)[O-])nc3C)s2)cc1 ZINC000177372795 1428708410 /nfs/dbraw/zinc/70/84/10/1428708410.db2.gz OIBUZXBNGZTEKG-UHFFFAOYSA-N 0 0 386.433 3.153 20 5 GGBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000177373190 1428708525 /nfs/dbraw/zinc/70/85/25/1428708525.db2.gz LOLORNFAMMDWOH-ZBSNKRKSSA-N 0 0 375.450 3.235 20 5 GGBDRN Cc1c(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000177374580 1428709000 /nfs/dbraw/zinc/70/90/00/1428709000.db2.gz FSZGASMCPOSPIY-KRWDZBQOSA-N 0 0 381.354 3.412 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1cccc(-c2ncc[nH]2)c1 ZINC000118642859 1413201174 /nfs/dbraw/zinc/20/11/74/1413201174.db2.gz DGNLCJVFFSXBTL-UHFFFAOYSA-N 0 0 399.794 3.007 20 5 GGBDRN C[C@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000118664325 1413203218 /nfs/dbraw/zinc/20/32/18/1413203218.db2.gz KBOPVIFGZAPYBG-OBJOEFQTSA-N 0 0 379.844 3.158 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC(CN2CCCCC2=O)CC1 ZINC000118676766 1413203585 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LGEAKAAPDFEXRD-CQSZACIVSA-N 0 0 393.403 3.280 20 5 GGBDRN O=C(c1cccc(C(F)(F)F)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689463 1413205074 /nfs/dbraw/zinc/20/50/74/1413205074.db2.gz VMNXRTAGYUYUII-ZDUSSCGKSA-N 0 0 380.326 3.335 20 5 GGBDRN O=C(CCCOc1cccc(F)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118688965 1413205117 /nfs/dbraw/zinc/20/51/17/1413205117.db2.gz WGOIUHXAJLFZKS-OAHLLOKOSA-N 0 0 388.399 3.001 20 5 GGBDRN Cc1nc(-c2ccco2)ccc1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689288 1413205198 /nfs/dbraw/zinc/20/51/98/1413205198.db2.gz LGEAKAAPDFEXRD-AWEZNQCLSA-N 0 0 393.403 3.280 20 5 GGBDRN Cc1cccc2[nH]cc(CC(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c21 ZINC000118689876 1413205688 /nfs/dbraw/zinc/20/56/88/1413205688.db2.gz RABGWVGFLUHTPM-HNNXBMFYSA-N 0 0 379.420 3.035 20 5 GGBDRN CCCN(C)c1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118690683 1413206157 /nfs/dbraw/zinc/20/61/57/1413206157.db2.gz YIXKGMLKGKXKNR-INIZCTEOSA-N 0 0 383.452 3.163 20 5 GGBDRN CCCc1c(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)[nH]c(C)c1C(C)=O ZINC000118690908 1413206227 /nfs/dbraw/zinc/20/62/27/1413206227.db2.gz PMEJUXAMFZHAQR-CQSZACIVSA-N 0 0 399.451 3.108 20 5 GGBDRN C[C@H](Oc1cccc(Cl)c1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690780 1413206260 /nfs/dbraw/zinc/20/62/60/1413206260.db2.gz VPIIIUCVBHNSGZ-JSGCOSHPSA-N 0 0 390.827 3.124 20 5 GGBDRN O=C(COc1ccc2ccccc2c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691034 1413206318 /nfs/dbraw/zinc/20/63/18/1413206318.db2.gz JVSBWSYRXAFMES-KRWDZBQOSA-N 0 0 392.415 3.235 20 5 GGBDRN O=C(c1ccccc1C(F)(F)F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690592 1413206357 /nfs/dbraw/zinc/20/63/57/1413206357.db2.gz LDONTQSOKAFSCN-LLVKDONJSA-N 0 0 380.326 3.335 20 5 GGBDRN C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690785 1413206377 /nfs/dbraw/zinc/20/63/77/1413206377.db2.gz VPIIIUCVBHNSGZ-TZMCWYRMSA-N 0 0 390.827 3.124 20 5 GGBDRN O=C(CCc1nc2ccccc2s1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691041 1413206385 /nfs/dbraw/zinc/20/63/85/1413206385.db2.gz AHQLHWBLRJIGEH-ZDUSSCGKSA-N 0 0 397.460 3.245 20 5 GGBDRN O=C(COc1ccc2ccccc2c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691035 1413206495 /nfs/dbraw/zinc/20/64/95/1413206495.db2.gz JVSBWSYRXAFMES-QGZVFWFLSA-N 0 0 392.415 3.235 20 5 GGBDRN COc1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc12 ZINC000118690559 1413206519 /nfs/dbraw/zinc/20/65/19/1413206519.db2.gz MWIXDPJYZNBVLA-AWEZNQCLSA-N 0 0 392.415 3.478 20 5 GGBDRN O=C(Cc1cccc2ccccc21)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690733 1413206538 /nfs/dbraw/zinc/20/65/38/1413206538.db2.gz NOKAAKNBVPVHCM-KRWDZBQOSA-N 0 0 376.416 3.399 20 5 GGBDRN CC(C)(C)c1ncc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000118691231 1413206857 /nfs/dbraw/zinc/20/68/57/1413206857.db2.gz APZVLCIXLHDNBC-LLVKDONJSA-N 0 0 375.454 3.070 20 5 GGBDRN O=C(Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000118701096 1413208143 /nfs/dbraw/zinc/20/81/43/1413208143.db2.gz QITWCQDMZKMPCJ-QZTJIDSGSA-N 0 0 396.403 3.406 20 5 GGBDRN O=C(Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000118701094 1413208198 /nfs/dbraw/zinc/20/81/98/1413208198.db2.gz QITWCQDMZKMPCJ-ROUUACIJSA-N 0 0 396.403 3.406 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(O[C@H]3CCCC[C@H]3O)cc2)cc(F)cc1[N+](=O)[O-] ZINC000118700608 1413208294 /nfs/dbraw/zinc/20/82/94/1413208294.db2.gz ZBFJKEYGGPCGHS-SJORKVTESA-N 0 0 389.383 3.251 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[C@@H](OCCC(C)C)C1 ZINC000177376087 1428709802 /nfs/dbraw/zinc/70/98/02/1428709802.db2.gz UYSDDKDHUKABSX-GOEBONIOSA-N 0 0 379.457 3.067 20 5 GGBDRN NC(=O)c1csc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000118705142 1413208566 /nfs/dbraw/zinc/20/85/66/1413208566.db2.gz FICZJJDPQZSQPO-UHFFFAOYSA-N 0 0 383.389 3.146 20 5 GGBDRN COC(=O)c1cc(NC(=O)CCc2cnn(-c3ccccc3)c2)cc([N+](=O)[O-])c1 ZINC000118723902 1413209803 /nfs/dbraw/zinc/20/98/03/1413209803.db2.gz KBIAQBBKKNTWNC-UHFFFAOYSA-N 0 0 394.387 3.138 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2nc(-c3ccco3)oc2C)cc([N+](=O)[O-])c1 ZINC000118723524 1413209908 /nfs/dbraw/zinc/20/99/08/1413209908.db2.gz PBHXORIMDMVGTO-UHFFFAOYSA-N 0 0 385.332 3.119 20 5 GGBDRN C[C@H](O)CCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000118720889 1413209919 /nfs/dbraw/zinc/20/99/19/1413209919.db2.gz VAGXVAWSNVMKPK-NSHDSACASA-N 0 0 391.811 3.001 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(-c3ccccc3F)on2)cc([N+](=O)[O-])c1 ZINC000118723412 1413209949 /nfs/dbraw/zinc/20/99/49/1413209949.db2.gz NJZMSJGHKOTVCB-UHFFFAOYSA-N 0 0 385.307 3.428 20 5 GGBDRN O=C(NCC[S@](=O)Cc1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000118792212 1413221459 /nfs/dbraw/zinc/22/14/59/1413221459.db2.gz QPHYUOPDZLCYPI-RUZDIDTESA-N 0 0 381.841 3.319 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000118860159 1413249524 /nfs/dbraw/zinc/24/95/24/1413249524.db2.gz QDCACUZVKYSJRG-HNNXBMFYSA-N 0 0 397.439 3.197 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866869 1413253287 /nfs/dbraw/zinc/25/32/87/1413253287.db2.gz CJINUNPQNSJZBB-DOMZBBRYSA-N 0 0 389.843 3.157 20 5 GGBDRN CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000118971121 1413282729 /nfs/dbraw/zinc/28/27/29/1413282729.db2.gz GDPZWMLVHDGGGI-UHFFFAOYSA-N 0 0 390.787 3.072 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC1(c2ccc(Cl)cc2)CCCCC1 ZINC000118977057 1413286968 /nfs/dbraw/zinc/28/69/68/1413286968.db2.gz JHHMDZKMIYILJL-UHFFFAOYSA-N 0 0 389.839 3.386 20 5 GGBDRN Cc1cccc([C@H]2CCCN2C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000118994146 1413295694 /nfs/dbraw/zinc/29/56/94/1413295694.db2.gz PUWDDZCYCHNRHL-LJQANCHMSA-N 0 0 377.404 3.461 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@]2(CCc3ccccc32)C1 ZINC000119003607 1413301474 /nfs/dbraw/zinc/30/14/74/1413301474.db2.gz YDPAPWUPKNZUIL-OAQYLSRUSA-N 0 0 381.432 3.021 20 5 GGBDRN C[C@H]1C[C@H](N(C)C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000119022785 1413307701 /nfs/dbraw/zinc/30/77/01/1413307701.db2.gz NNNDTNDXFIEOQO-MAUKXSAKSA-N 0 0 383.448 3.426 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC(OC(C)(C)C)CC1 ZINC000119027510 1413309802 /nfs/dbraw/zinc/30/98/02/1413309802.db2.gz LAOUPXNWGINNHV-CYBMUJFWSA-N 0 0 379.457 3.210 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CCC(OC(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000119033766 1413311481 /nfs/dbraw/zinc/31/14/81/1413311481.db2.gz BZXYTMALKPLWOY-ZDUSSCGKSA-N 0 0 379.457 3.210 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CCC(OC(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000119033878 1413311552 /nfs/dbraw/zinc/31/15/52/1413311552.db2.gz BZXYTMALKPLWOY-CYBMUJFWSA-N 0 0 379.457 3.210 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 ZINC000119031872 1413311665 /nfs/dbraw/zinc/31/16/65/1413311665.db2.gz RBGDPVYAYFVBKR-WMZOPIPTSA-N 0 0 381.432 3.369 20 5 GGBDRN O=C(Nc1ccccc1O[C@@H]1CCOC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000119047650 1413315840 /nfs/dbraw/zinc/31/58/40/1413315840.db2.gz JBFUKRWOLNNTNI-MRXNPFEDSA-N 0 0 394.387 3.201 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1 ZINC000177384102 1428712944 /nfs/dbraw/zinc/71/29/44/1428712944.db2.gz VMOHPHYKJCOGKE-QGZVFWFLSA-N 0 0 397.353 3.113 20 5 GGBDRN C[C@H]1CN(C)c2ccccc2CN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177398942 1428718446 /nfs/dbraw/zinc/71/84/46/1428718446.db2.gz QNSUOFDKUQGIBJ-AWEZNQCLSA-N 0 0 379.420 3.485 20 5 GGBDRN O=C(NC[C@@H]1CCC[C@@H](O)C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000119083416 1413330561 /nfs/dbraw/zinc/33/05/61/1413330561.db2.gz ZMUKCHDSNIVWKE-SJLPKXTDSA-N 0 0 383.448 3.488 20 5 GGBDRN O=C(Nc1ccccc1N1CCC(O)CC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119093570 1413333800 /nfs/dbraw/zinc/33/38/00/1413333800.db2.gz JRQVNVBYNGMEDW-UHFFFAOYSA-N 0 0 375.812 3.462 20 5 GGBDRN COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000119094795 1413334366 /nfs/dbraw/zinc/33/43/66/1413334366.db2.gz XCYDEYOFFRMXNV-MRXNPFEDSA-N 0 0 386.452 3.043 20 5 GGBDRN CCOc1ccc(C(=O)N(C)C)cc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000119097725 1413335216 /nfs/dbraw/zinc/33/52/16/1413335216.db2.gz NVPAZSCHHJONGO-UHFFFAOYSA-N 0 0 385.420 3.267 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cnn(-c2ccccc2)c1 ZINC000119125472 1413346850 /nfs/dbraw/zinc/34/68/50/1413346850.db2.gz ICBNBWAUSRWBNI-UHFFFAOYSA-N 0 0 380.360 3.194 20 5 GGBDRN Nc1c(Cl)cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1Cl ZINC000119137086 1413352248 /nfs/dbraw/zinc/35/22/48/1413352248.db2.gz NDJDZBDIKVHQHR-UHFFFAOYSA-N 0 0 395.246 3.446 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C12CCC2 ZINC000119144258 1413353826 /nfs/dbraw/zinc/35/38/26/1413353826.db2.gz MXQZXOZXLJTCPM-IAGOWNOFSA-N 0 0 377.441 3.093 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C12CCC2 ZINC000119144343 1413354016 /nfs/dbraw/zinc/35/40/16/1413354016.db2.gz MXQZXOZXLJTCPM-SJORKVTESA-N 0 0 377.441 3.093 20 5 GGBDRN Cc1c(C(=O)N2CCc3c2cccc3Cl)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000119153802 1413357278 /nfs/dbraw/zinc/35/72/78/1413357278.db2.gz KXQHRBROSKVWLS-UHFFFAOYSA-N 0 0 383.795 3.340 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc2c(cc1Cl)NC(=O)CO2 ZINC000119158955 1413359613 /nfs/dbraw/zinc/35/96/13/1413359613.db2.gz PKRBVXFLRZFGPE-UHFFFAOYSA-N 0 0 375.768 3.150 20 5 GGBDRN O=C(NCCOc1ccc(F)cc1F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000119161209 1413360276 /nfs/dbraw/zinc/36/02/76/1413360276.db2.gz WLMSHIUEJOXBOL-UHFFFAOYSA-N 0 0 377.347 3.020 20 5 GGBDRN Cc1c(CC(=O)N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)cccc1[N+](=O)[O-] ZINC000119163894 1413361695 /nfs/dbraw/zinc/36/16/95/1413361695.db2.gz MCANBZUWZARZRF-GOSISDBHSA-N 0 0 395.419 3.404 20 5 GGBDRN Cc1ccccc1NC(=O)[C@H]1CSCN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000119170379 1413363678 /nfs/dbraw/zinc/36/36/78/1413363678.db2.gz FXFDJCJHKRTGMM-GOSISDBHSA-N 0 0 399.472 3.294 20 5 GGBDRN Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000119207212 1413375621 /nfs/dbraw/zinc/37/56/21/1413375621.db2.gz SLZGTJBLFVQKBH-OAHLLOKOSA-N 0 0 380.408 3.011 20 5 GGBDRN Cc1cc(=O)oc2cc(OCCn3cc(Br)c([N+](=O)[O-])n3)ccc12 ZINC000119220077 1413379035 /nfs/dbraw/zinc/37/90/35/1413379035.db2.gz AQMQSPPDECGDNW-UHFFFAOYSA-N 0 0 394.181 3.048 20 5 GGBDRN CN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CCCc2c1cnn2C ZINC000119219884 1413379051 /nfs/dbraw/zinc/37/90/51/1413379051.db2.gz HRNUIXKYPVXIOC-CYBMUJFWSA-N 0 0 395.366 3.471 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1 ZINC000119232572 1413383357 /nfs/dbraw/zinc/38/33/57/1413383357.db2.gz XGJDTEDSQCUTGJ-OAHLLOKOSA-N 0 0 375.469 3.417 20 5 GGBDRN O=C(Nc1ccc(OCC[NH+]2CCCCC2)cc1)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000119263165 1413393076 /nfs/dbraw/zinc/39/30/76/1413393076.db2.gz DBFBBUYTJKXLHT-UHFFFAOYSA-N 0 0 385.420 3.417 20 5 GGBDRN 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ZINC000119307850 1413406667 /nfs/dbraw/zinc/40/66/67/1413406667.db2.gz OULYOCJEJFZIGM-LLVKDONJSA-N 0 0 376.390 3.389 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC2CCN(c3cccs3)CC2)cc1C ZINC000119311840 1413407988 /nfs/dbraw/zinc/40/79/88/1413407988.db2.gz ODZXYEXTMOCPEV-UHFFFAOYSA-N 0 0 395.506 3.220 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)CCC2 ZINC000119313771 1413408656 /nfs/dbraw/zinc/40/86/56/1413408656.db2.gz NRPOVYWZAGFMQV-AWEZNQCLSA-N 0 0 391.497 3.353 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cccc(-n2ccnn2)c1 ZINC000119320781 1413410885 /nfs/dbraw/zinc/41/08/85/1413410885.db2.gz XKPWXLXQFCUGQU-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)c3csc([N+](=O)[O-])c3)ccc12 ZINC000119331586 1413414288 /nfs/dbraw/zinc/41/42/88/1413414288.db2.gz UIOLFYBSSKUJRN-UHFFFAOYSA-N 0 0 381.387 3.093 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Oc2ccc(Br)cc2F)cs1 ZINC000119330846 1413414351 /nfs/dbraw/zinc/41/43/51/1413414351.db2.gz TVPNICOUCOWXAD-UHFFFAOYSA-N 0 0 382.188 3.326 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(F)cc2NC2CC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000119344112 1413418503 /nfs/dbraw/zinc/41/85/03/1413418503.db2.gz SZKGCUHARPLBRQ-UHFFFAOYSA-N 0 0 396.382 3.450 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N[C@H](c2ccccc2)c2ccccn2)cs1 ZINC000119348861 1413419771 /nfs/dbraw/zinc/41/97/71/1413419771.db2.gz PLYNCQFHAKTHEI-MRXNPFEDSA-N 0 0 375.431 3.119 20 5 GGBDRN CC(C)C1CCC(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000119360258 1413423454 /nfs/dbraw/zinc/42/34/54/1413423454.db2.gz XGNAUXDGUJRIRU-UHFFFAOYSA-N 0 0 379.482 3.117 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2cccs2)C[C@H]2CCCO2)cs1 ZINC000119363181 1413424325 /nfs/dbraw/zinc/42/43/25/1413424325.db2.gz LXSLCZQVXHBTDM-LLVKDONJSA-N 0 0 388.492 3.088 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCSCC2)cc1 ZINC000119377733 1413428976 /nfs/dbraw/zinc/42/89/76/1413428976.db2.gz GTGMHEQJNCJWSJ-UHFFFAOYSA-N 0 0 386.477 3.466 20 5 GGBDRN 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ZINC000119426581 1413443560 /nfs/dbraw/zinc/44/35/60/1413443560.db2.gz DGGZZQSETIHVMO-UHFFFAOYSA-N 0 0 396.491 3.222 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2c(C)cnn2-c2ccccc2)cc([N+](=O)[O-])c1 ZINC000177419211 1428728428 /nfs/dbraw/zinc/72/84/28/1428728428.db2.gz ORSKUYUUOGDXQH-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN COc1ccc(OCCN(C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000119437204 1413446929 /nfs/dbraw/zinc/44/69/29/1413446929.db2.gz OZOCKYVGYPJJQH-OAHLLOKOSA-N 0 0 387.436 3.250 20 5 GGBDRN CN(CC(C)(C)CN1CCOCC1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000119440045 1413447389 /nfs/dbraw/zinc/44/73/89/1413447389.db2.gz QGFZDLDHMPXOPS-UHFFFAOYSA-N 0 0 384.864 3.070 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000119442642 1413448161 /nfs/dbraw/zinc/44/81/61/1413448161.db2.gz LAVUMKXAPDCQOO-CQSZACIVSA-N 0 0 388.424 3.349 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)c1cc2ccccc2s1 ZINC000119467395 1413457625 /nfs/dbraw/zinc/45/76/25/1413457625.db2.gz UGJNJVYLSAYNOS-INIZCTEOSA-N 0 0 385.445 3.339 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000119471387 1413458396 /nfs/dbraw/zinc/45/83/96/1413458396.db2.gz OYEUAYZPOIVHFL-UHFFFAOYSA-N 0 0 398.463 3.167 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1OS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119490513 1413464667 /nfs/dbraw/zinc/46/46/67/1413464667.db2.gz JLTJLALAWRBMRP-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN O=C(Nc1ccc(F)cc1NC1CC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000119491625 1413464698 /nfs/dbraw/zinc/46/46/98/1413464698.db2.gz NXKMWMQNBWNSJX-UHFFFAOYSA-N 0 0 382.355 3.141 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1nc2ccc(OC(F)(F)F)cc2s1 ZINC000119505546 1413468990 /nfs/dbraw/zinc/46/89/90/1413468990.db2.gz ZCDZVZSQGUGLTB-UHFFFAOYSA-N 0 0 387.299 3.089 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000119504684 1413469020 /nfs/dbraw/zinc/46/90/20/1413469020.db2.gz HVNPWQQANKTKFW-WMLDXEAASA-N 0 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Cc1c(CC(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)cccc1[N+](=O)[O-] ZINC000119546395 1413482253 /nfs/dbraw/zinc/48/22/53/1413482253.db2.gz XUIYUEJSMRUGFA-GOSISDBHSA-N 0 0 376.359 3.324 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ncc(-c2ccccc2)s1 ZINC000119546943 1413482272 /nfs/dbraw/zinc/48/22/72/1413482272.db2.gz XVPRPRKKSOOFHL-UHFFFAOYSA-N 0 0 396.384 3.265 20 5 GGBDRN CC(C)N(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCCC1 ZINC000119568523 1413488604 /nfs/dbraw/zinc/48/86/04/1413488604.db2.gz DFWGQGRTDDUBDQ-UHFFFAOYSA-N 0 0 379.482 3.356 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000119568573 1413488665 /nfs/dbraw/zinc/48/86/65/1413488665.db2.gz GZRUBDHWOQFBLO-OAHLLOKOSA-N 0 0 386.379 3.016 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc2ccccn21 ZINC000119575730 1413490610 /nfs/dbraw/zinc/49/06/10/1413490610.db2.gz RLLVIFPJGHRJHF-UHFFFAOYSA-N 0 0 385.449 3.316 20 5 GGBDRN Cc1c(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000119578073 1413491066 /nfs/dbraw/zinc/49/10/66/1413491066.db2.gz SGWFDLBLQSKMGM-UHFFFAOYSA-N 0 0 397.431 3.225 20 5 GGBDRN C[C@H](NS(=O)(=O)c1csc([N+](=O)[O-])c1)c1cccc(OC(F)F)c1 ZINC000119575902 1413491213 /nfs/dbraw/zinc/49/12/13/1413491213.db2.gz NIVCEOGMYXPSDY-QMMMGPOBSA-N 0 0 378.378 3.297 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)CNc3ccccc3[N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000119615685 1413504991 /nfs/dbraw/zinc/50/49/91/1413504991.db2.gz CAMOOVYCOBLILI-HUUCEWRRSA-N 0 0 384.436 3.259 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)cc2)C[C@@H](C)O1 ZINC000119626974 1413508095 /nfs/dbraw/zinc/50/80/95/1413508095.db2.gz OTYWTKQWUYNRBI-CHWSQXEVSA-N 0 0 395.419 3.337 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCC(c3c[nH]c4ncccc34)CC2)cs1 ZINC000119633138 1413510554 /nfs/dbraw/zinc/51/05/54/1413510554.db2.gz CNAVJAWYVMEIBA-UHFFFAOYSA-N 0 0 392.462 3.101 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1CN[C@H](CN1CCOCC1)c1ccccc1 ZINC000119642234 1413512895 /nfs/dbraw/zinc/51/28/95/1413512895.db2.gz 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ZINC000119711701 1413541624 /nfs/dbraw/zinc/54/16/24/1413541624.db2.gz TYSSNNHLQQWXLV-MRXNPFEDSA-N 0 0 379.800 3.454 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Oc2ccc(-c3noc(C4CC4)n3)cc2)cs1 ZINC000119717859 1413543327 /nfs/dbraw/zinc/54/33/27/1413543327.db2.gz CCBYMDZXDTUQLH-UHFFFAOYSA-N 0 0 393.402 3.351 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cccc1[N+](=O)[O-] ZINC000119722668 1413544747 /nfs/dbraw/zinc/54/47/47/1413544747.db2.gz BSEQSRALNMQAES-UHFFFAOYSA-N 0 0 393.399 3.090 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@H](C)c2cc(F)ccc2F)c([N+](=O)[O-])c1 ZINC000119750959 1413554860 /nfs/dbraw/zinc/55/48/60/1413554860.db2.gz XGDJSONWTKEXHF-SNVBAGLBSA-N 0 0 386.376 3.263 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 ZINC000119753694 1413556079 /nfs/dbraw/zinc/55/60/79/1413556079.db2.gz GFMBADAUPMCGLW-KGLIPLIRSA-N 0 0 377.441 3.469 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000119779086 1413566218 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WCGHJGNUDBCOJW-WHDAMIPWSA-N 0 0 375.450 3.235 20 5 GGBDRN C[C@H](CO[C@H]1CCOC1)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000177441044 1428738103 /nfs/dbraw/zinc/73/81/03/1428738103.db2.gz ZRJHXADMLOROQL-PBHICJAKSA-N 0 0 385.420 3.262 20 5 GGBDRN C[C@H](CO[C@@H]1CCOC1)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000177441015 1428738139 /nfs/dbraw/zinc/73/81/39/1428738139.db2.gz ZRJHXADMLOROQL-RHSMWYFYSA-N 0 0 385.420 3.262 20 5 GGBDRN Cc1cccc(C(=O)N[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000119803898 1413575325 /nfs/dbraw/zinc/57/53/25/1413575325.db2.gz RZIKXRYXQXPBMW-KBPBESRZSA-N 0 0 377.441 3.469 20 5 GGBDRN CC(C)Oc1ccccc1CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000119807651 1413576587 /nfs/dbraw/zinc/57/65/87/1413576587.db2.gz MTJXFDCUVCRDKB-UHFFFAOYSA-N 0 0 383.448 3.340 20 5 GGBDRN C[C@@H](CO[C@H]1CCOC1)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000177441028 1428738240 /nfs/dbraw/zinc/73/82/40/1428738240.db2.gz ZRJHXADMLOROQL-YOEHRIQHSA-N 0 0 385.420 3.262 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCOC[C@@H]1C[C@H](O)c1cccs1 ZINC000119812461 1413578608 /nfs/dbraw/zinc/57/86/08/1413578608.db2.gz FLMHRTMIMBBSDO-GJZGRUSLSA-N 0 0 377.422 3.013 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCOC[C@@H]1C[C@@H](O)c1cccs1 ZINC000119812765 1413578651 /nfs/dbraw/zinc/57/86/51/1413578651.db2.gz FLMHRTMIMBBSDO-LSDHHAIUSA-N 0 0 377.422 3.013 20 5 GGBDRN NC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000119815286 1413579157 /nfs/dbraw/zinc/57/91/57/1413579157.db2.gz VJCIJVKAOWHXTG-IBGZPJMESA-N 0 0 377.400 3.267 20 5 GGBDRN Cc1ccc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(O[C@@H]2CCOC2)c1 ZINC000119819331 1413581179 /nfs/dbraw/zinc/58/11/79/1413581179.db2.gz OUALQNYIOOCHQP-LJQANCHMSA-N 0 0 399.447 3.113 20 5 GGBDRN Cc1noc(C)c1[C@H](C)CNC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000119820892 1413581697 /nfs/dbraw/zinc/58/16/97/1413581697.db2.gz OAHNZZRIHWDEGP-CYBMUJFWSA-N 0 0 389.456 3.413 20 5 GGBDRN CCc1cc(N2CCC[C@@H](NC(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)C2)ncn1 ZINC000119828783 1413584566 /nfs/dbraw/zinc/58/45/66/1413584566.db2.gz ZSENVSPDAHOIGX-MRXNPFEDSA-N 0 0 398.467 3.355 20 5 GGBDRN O=C(Cc1ccccc1Cl)NCCCOC(=O)c1ccccc1[N+](=O)[O-] ZINC000119831284 1413585608 /nfs/dbraw/zinc/58/56/08/1413585608.db2.gz FDXSRDWJBIUYKU-UHFFFAOYSA-N 0 0 376.796 3.154 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCN(c2ccc(F)cc2)CC1 ZINC000119841855 1413589604 /nfs/dbraw/zinc/58/96/04/1413589604.db2.gz PPWNUBNFIDOYNH-UHFFFAOYSA-N 0 0 380.379 3.245 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1F ZINC000119853328 1413594258 /nfs/dbraw/zinc/59/42/58/1413594258.db2.gz HCPUEWFDAAUNSE-UHFFFAOYSA-N 0 0 388.399 3.211 20 5 GGBDRN COc1ccc(NC(=O)CN2CCCN(C)c3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000119854188 1413594514 /nfs/dbraw/zinc/59/45/14/1413594514.db2.gz ZTQPLUGFPYLSCJ-UHFFFAOYSA-N 0 0 388.399 3.028 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000119864669 1413597490 /nfs/dbraw/zinc/59/74/90/1413597490.db2.gz NQKYHFYPJFDNEH-IUODEOHRSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000119867599 1413598460 /nfs/dbraw/zinc/59/84/60/1413598460.db2.gz DDVNWLGYEWTEBX-AWEZNQCLSA-N 0 0 384.440 3.161 20 5 GGBDRN COc1cccc(COCCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000119879722 1413602624 /nfs/dbraw/zinc/60/26/24/1413602624.db2.gz QURYQXDUMVRHTC-UHFFFAOYSA-N 0 0 378.812 3.132 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NCCC(=O)N1CCCCCC1 ZINC000119881426 1413603082 /nfs/dbraw/zinc/60/30/82/1413603082.db2.gz JTBICOIGHBWXTN-UHFFFAOYSA-N 0 0 390.484 3.009 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1 ZINC000119882318 1413603799 /nfs/dbraw/zinc/60/37/99/1413603799.db2.gz OLOOIPAZLLHDPC-UHFFFAOYSA-N 0 0 386.314 3.090 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CC[C@@H](CSc3ccccc3)C2)cs1 ZINC000119882703 1413603842 /nfs/dbraw/zinc/60/38/42/1413603842.db2.gz NOBWMZWEELQSAZ-GFCCVEGCSA-N 0 0 384.504 3.459 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1 ZINC000119888233 1413605907 /nfs/dbraw/zinc/60/59/07/1413605907.db2.gz LAPFNCGWZCVATB-UONOGXRCSA-N 0 0 377.441 3.469 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1 ZINC000119888072 1413605911 /nfs/dbraw/zinc/60/59/11/1413605911.db2.gz LAPFNCGWZCVATB-ZIAGYGMSSA-N 0 0 377.441 3.469 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(F)cc1F ZINC000119889277 1413606625 /nfs/dbraw/zinc/60/66/25/1413606625.db2.gz OZGVXTUVNQGRMK-OAHLLOKOSA-N 0 0 377.347 3.387 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c(C)c1 ZINC000119902093 1413610521 /nfs/dbraw/zinc/61/05/21/1413610521.db2.gz ALWBYZLFKIPBOC-UHFFFAOYSA-N 0 0 377.347 3.167 20 5 GGBDRN CCC1(CNC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCCC1 ZINC000119911548 1413613909 /nfs/dbraw/zinc/61/39/09/1413613909.db2.gz BOJOWUWWQPLZNW-UHFFFAOYSA-N 0 0 394.497 3.094 20 5 GGBDRN 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ZINC000120042815 1413665258 /nfs/dbraw/zinc/66/52/58/1413665258.db2.gz BEKNBBRDDWSCCJ-JKSUJKDBSA-N 0 0 391.468 3.398 20 5 GGBDRN CN(c1ccccc1F)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000120047979 1413667269 /nfs/dbraw/zinc/66/72/69/1413667269.db2.gz NKCCZSRINBNTLP-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[S@](=O)Cc1ccccc1 ZINC000120048600 1413667299 /nfs/dbraw/zinc/66/72/99/1413667299.db2.gz ZVCPEJRXGPLMHP-AREMUKBSSA-N 0 0 375.450 3.282 20 5 GGBDRN CN(CC1CCCC1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000120050709 1413668355 /nfs/dbraw/zinc/66/83/55/1413668355.db2.gz DMWMYRZHSJZINZ-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000120052656 1413669071 /nfs/dbraw/zinc/66/90/71/1413669071.db2.gz QRFMGNXQSVMGTP-CABCVRRESA-N 0 0 377.441 3.089 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NCCc2cc3ccccc3[nH]2)cc([N+](=O)[O-])c1 ZINC000120058425 1413671058 /nfs/dbraw/zinc/67/10/58/1413671058.db2.gz 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Cc1c(C(=O)Nc2ccccc2C(=O)N(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122279993 1414410263 /nfs/dbraw/zinc/41/02/63/1414410263.db2.gz OUQAASDCUIUYQH-UHFFFAOYSA-N 0 0 386.364 3.074 20 5 GGBDRN CSC1(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCOCC1 ZINC000122282103 1414410876 /nfs/dbraw/zinc/41/08/76/1414410876.db2.gz MDONAQJXLXCHGV-UHFFFAOYSA-N 0 0 379.482 3.181 20 5 GGBDRN Cn1cc(C(=O)Nc2cnn(-c3ccccc3)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122295372 1414415253 /nfs/dbraw/zinc/41/52/53/1414415253.db2.gz MOZDRRJIJZZLFM-UHFFFAOYSA-N 0 0 388.387 3.433 20 5 GGBDRN C[C@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C(=O)N1CCCC[C@H]1C ZINC000122311265 1414420463 /nfs/dbraw/zinc/42/04/63/1414420463.db2.gz AKPUKJDJSOBALX-CABCVRRESA-N 0 0 388.468 3.058 20 5 GGBDRN CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)c1cc(F)ccc1F ZINC000122327370 1414425083 /nfs/dbraw/zinc/42/50/83/1414425083.db2.gz UYRQTUWUZFCJCO-AWEZNQCLSA-N 0 0 386.376 3.311 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cccc(F)c1 ZINC000122332060 1414425731 /nfs/dbraw/zinc/42/57/31/1414425731.db2.gz AVLVJPQFTCGOOP-UHFFFAOYSA-N 0 0 378.425 3.445 20 5 GGBDRN C[C@@H](CC(=O)OCc1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000122333298 1414426515 /nfs/dbraw/zinc/42/65/15/1414426515.db2.gz YGKZPXLDPJVVIC-ZDUSSCGKSA-N 0 0 390.823 3.429 20 5 GGBDRN Cc1c(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cnn1CCC(C)C ZINC000122378694 1414440185 /nfs/dbraw/zinc/44/01/85/1414440185.db2.gz DUEXOZIKSWFWTF-UHFFFAOYSA-N 0 0 383.408 3.240 20 5 GGBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000122408395 1414449935 /nfs/dbraw/zinc/44/99/35/1414449935.db2.gz YGZSGJNYCZYXIO-UHFFFAOYSA-N 0 0 381.392 3.194 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)cc1[N+](=O)[O-] ZINC000122410867 1414450718 /nfs/dbraw/zinc/45/07/18/1414450718.db2.gz HJVBALOFAHVICX-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)cc2)CCO1 ZINC000122428350 1414457534 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AVTVJBYSBGYTFQ-UHFFFAOYSA-N 0 0 394.431 3.038 20 5 GGBDRN COc1cccc(CNC(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000122464231 1414469562 /nfs/dbraw/zinc/46/95/62/1414469562.db2.gz SVEHXESAJOQQNY-UHFFFAOYSA-N 0 0 377.828 3.005 20 5 GGBDRN COc1ccccc1CNC(=O)[C@H](C)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000122467983 1414471021 /nfs/dbraw/zinc/47/10/21/1414471021.db2.gz ZNKNTTJYMBCGAY-ZDUSSCGKSA-N 0 0 391.855 3.394 20 5 GGBDRN C[C@@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H](O)Cc1ccccc1 ZINC000122479254 1414475365 /nfs/dbraw/zinc/47/53/65/1414475365.db2.gz CYSJBHLXQAGYBW-UZLBHIALSA-N 0 0 385.464 3.209 20 5 GGBDRN COCCCOC1CCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000122482522 1414477154 /nfs/dbraw/zinc/47/71/54/1414477154.db2.gz VIGXMTTZNYGUGR-CQSZACIVSA-N 0 0 390.440 3.223 20 5 GGBDRN Cc1cccc(Oc2ncccc2NC(=O)NCCn2cc([N+](=O)[O-])cn2)c1C ZINC000122492870 1414480196 /nfs/dbraw/zinc/48/01/96/1414480196.db2.gz GLBVUVKEOJVPCL-UHFFFAOYSA-N 0 0 396.407 3.417 20 5 GGBDRN O=C(CCOc1ccccc1-c1ccccc1)NCCn1cc([N+](=O)[O-])cn1 ZINC000122502834 1414484016 /nfs/dbraw/zinc/48/40/16/1414484016.db2.gz YBZFMBWDKHTSRK-UHFFFAOYSA-N 0 0 380.404 3.044 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000122507725 1414485481 /nfs/dbraw/zinc/48/54/81/1414485481.db2.gz VXYLGJMONZXWEC-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN O=C(NC[C@H]1CCC[C@@H](O)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000122512055 1414486180 /nfs/dbraw/zinc/48/61/80/1414486180.db2.gz RJJOVCLNHQIHPP-FUHWJXTLSA-N 0 0 383.448 3.488 20 5 GGBDRN O=C(NC[C@@H]1CCC[C@H](O)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000122511476 1414486196 /nfs/dbraw/zinc/48/61/96/1414486196.db2.gz RJJOVCLNHQIHPP-AEFFLSMTSA-N 0 0 383.448 3.488 20 5 GGBDRN Cc1ccccc1COc1cccc(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c1 ZINC000122517792 1414488528 /nfs/dbraw/zinc/48/85/28/1414488528.db2.gz NYOOSGXYRWEHTH-UHFFFAOYSA-N 0 0 393.399 3.283 20 5 GGBDRN O=C(NCCc1cc2ccccc2o1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122525804 1414489931 /nfs/dbraw/zinc/48/99/31/1414489931.db2.gz NAQBTNFZNFIVFM-UHFFFAOYSA-N 0 0 387.779 3.292 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(CC(C)C)c1 ZINC000122524776 1414489937 /nfs/dbraw/zinc/48/99/37/1414489937.db2.gz WSDFHKFYLFUGPY-UHFFFAOYSA-N 0 0 378.454 3.438 20 5 GGBDRN CCOC(=O)CN(C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C1CC1 ZINC000122529388 1414491337 /nfs/dbraw/zinc/49/13/37/1414491337.db2.gz OSEVWGCCDMOZLD-UHFFFAOYSA-N 0 0 397.431 3.375 20 5 GGBDRN CN(CC(=O)N1CCC[C@H]1CC(=O)c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000122530407 1414491670 /nfs/dbraw/zinc/49/16/70/1414491670.db2.gz OAQZBTHQNVWXOU-AWEZNQCLSA-N 0 0 387.461 3.357 20 5 GGBDRN CN(CC(=O)N1CCC[C@@H]1CC(=O)c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000122530220 1414491678 /nfs/dbraw/zinc/49/16/78/1414491678.db2.gz OAQZBTHQNVWXOU-CQSZACIVSA-N 0 0 387.461 3.357 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2C(=O)CNc2ccccc2[N+](=O)[O-])o1 ZINC000122535706 1414492823 /nfs/dbraw/zinc/49/28/23/1414492823.db2.gz OULMAZWUEHABPX-SFHVURJKSA-N 0 0 393.403 3.024 20 5 GGBDRN Cc1cc(C(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)cc([N+](=O)[O-])c1 ZINC000122535287 1414492961 /nfs/dbraw/zinc/49/29/61/1414492961.db2.gz BLWIRKCLZKQPNT-MRXNPFEDSA-N 0 0 383.448 3.054 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000122546679 1414496819 /nfs/dbraw/zinc/49/68/19/1414496819.db2.gz AFEVKAQAZPOVCW-IBGZPJMESA-N 0 0 380.404 3.070 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC000122551784 1414497836 /nfs/dbraw/zinc/49/78/36/1414497836.db2.gz YKZLPKGDAXJQPM-YJBOKZPZSA-N 0 0 387.411 3.353 20 5 GGBDRN COc1cc(OCC(=O)N[C@H](C2CCCC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000177623575 1428814092 /nfs/dbraw/zinc/81/40/92/1428814092.db2.gz PGGCQESFTCJBPC-OAHLLOKOSA-N 0 0 376.331 3.220 20 5 GGBDRN CCc1ccc(OC(=O)[C@@H]2CCCN(C(=O)NCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000122584979 1414508937 /nfs/dbraw/zinc/50/89/37/1414508937.db2.gz MXIIWZYGRAEJBO-OAHLLOKOSA-N 0 0 377.441 3.140 20 5 GGBDRN O=C(Nc1cccn(Cc2ccccc2)c1=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000122600737 1414512895 /nfs/dbraw/zinc/51/28/95/1414512895.db2.gz BYXANGPGTMUZND-UHFFFAOYSA-N 0 0 385.326 3.335 20 5 GGBDRN CC(C)C(=O)N(C)Cc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122608704 1414515478 /nfs/dbraw/zinc/51/54/78/1414515478.db2.gz KJKAYOGXUPPJMU-UHFFFAOYSA-N 0 0 395.419 3.338 20 5 GGBDRN Cc1cc2cc(NC(=O)C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)ccc2[nH]1 ZINC000122607424 1414515591 /nfs/dbraw/zinc/51/55/91/1414515591.db2.gz HNAYEYBCGLGLDF-UHFFFAOYSA-N 0 0 394.431 3.462 20 5 GGBDRN Cc1c(CC(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)cccc1[N+](=O)[O-] ZINC000122614725 1414518005 /nfs/dbraw/zinc/51/80/05/1414518005.db2.gz UKFCYJDUSLSGHC-UHFFFAOYSA-N 0 0 390.461 3.408 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cl)c1F ZINC000122615474 1414518032 /nfs/dbraw/zinc/51/80/32/1414518032.db2.gz VDGNHBWCKHLNAE-UHFFFAOYSA-N 0 0 393.802 3.465 20 5 GGBDRN C[C@H](c1ccccc1)N1C[C@@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC1=O ZINC000122618672 1414519427 /nfs/dbraw/zinc/51/94/27/1414519427.db2.gz DQMAWQOXIFHGKC-OCCSQVGLSA-N 0 0 393.403 3.019 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000122623437 1414520293 /nfs/dbraw/zinc/52/02/93/1414520293.db2.gz DLZGXOYAVCPMKU-MRXNPFEDSA-N 0 0 387.392 3.225 20 5 GGBDRN COc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl ZINC000122623460 1414520749 /nfs/dbraw/zinc/52/07/49/1414520749.db2.gz RDZFGURRLARDQI-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN CC(C)c1ccsc1C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122633772 1414524248 /nfs/dbraw/zinc/52/42/48/1414524248.db2.gz KVDAXFATQJQXCO-UHFFFAOYSA-N 0 0 387.461 3.378 20 5 GGBDRN Cc1cc([C@H]2CN(S(=O)(=O)c3c(C)cccc3[N+](=O)[O-])CCO2)ccc1F ZINC000122637284 1414524898 /nfs/dbraw/zinc/52/48/98/1414524898.db2.gz ZBWIWBLCIYPTBG-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN CC(C)=C[C@H]1[C@H](C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1(C)C ZINC000122635329 1414525061 /nfs/dbraw/zinc/52/50/61/1414525061.db2.gz FZZSXAPWSKPSQM-ZWKOTPCHSA-N 0 0 385.464 3.118 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122642488 1414526807 /nfs/dbraw/zinc/52/68/07/1414526807.db2.gz WRRYQYZAKNCQLA-UHFFFAOYSA-N 0 0 375.728 3.214 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](c2ccc(F)cc2)C[C@@H]1C ZINC000122641651 1414527027 /nfs/dbraw/zinc/52/70/27/1414527027.db2.gz XIGRRRDPIZTMAV-GXTWGEPZSA-N 0 0 394.424 3.309 20 5 GGBDRN COc1cc(CNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCC(F)(F)F ZINC000122643578 1414527563 /nfs/dbraw/zinc/52/75/63/1414527563.db2.gz GBKRANSETPZITM-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN COc1ccc(C(=O)CCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1F ZINC000122646234 1414528126 /nfs/dbraw/zinc/52/81/26/1414528126.db2.gz WUFJAHQNRIEJFO-UHFFFAOYSA-N 0 0 386.339 3.220 20 5 GGBDRN O=C(c1cc2c(s1)CCCC2)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122654455 1414530278 /nfs/dbraw/zinc/53/02/78/1414530278.db2.gz YFTOCMBXDGXQOH-UHFFFAOYSA-N 0 0 399.472 3.133 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N[C@H](C)C[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000122656596 1414530953 /nfs/dbraw/zinc/53/09/53/1414530953.db2.gz HYJNLMRHEVPJBD-WBMJQRKESA-N 0 0 398.868 3.347 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cccc(OC[C@@H]2CCCO2)c1 ZINC000122660587 1414531602 /nfs/dbraw/zinc/53/16/02/1414531602.db2.gz HPKVCXWVKRLCEJ-HNNXBMFYSA-N 0 0 382.376 3.281 20 5 GGBDRN Cc1c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cnn1-c1ccc(F)cc1 ZINC000122660062 1414531876 /nfs/dbraw/zinc/53/18/76/1414531876.db2.gz LFFMIQSNQVFVIR-UHFFFAOYSA-N 0 0 380.339 3.357 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000122664692 1414533144 /nfs/dbraw/zinc/53/31/44/1414533144.db2.gz SUSKNYRODVHGHY-YPMHNXCESA-N 0 0 382.388 3.440 20 5 GGBDRN NC(=O)c1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cn1 ZINC000122671347 1414534293 /nfs/dbraw/zinc/53/42/93/1414534293.db2.gz PKTAWSDFNJFBPW-UHFFFAOYSA-N 0 0 377.360 3.085 20 5 GGBDRN CC(=O)CCc1ccc(OCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122675902 1414535456 /nfs/dbraw/zinc/53/54/56/1414535456.db2.gz RHTDDWKXOIHCTC-UHFFFAOYSA-N 0 0 382.376 3.010 20 5 GGBDRN CN(CCC(=O)NCC(=O)c1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000122688126 1414538494 /nfs/dbraw/zinc/53/84/94/1414538494.db2.gz ZAYSHCRPRZJTHG-UHFFFAOYSA-N 0 0 389.839 3.069 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122686624 1414538523 /nfs/dbraw/zinc/53/85/23/1414538523.db2.gz NWEIPRAGFPNIRB-UHFFFAOYSA-N 0 0 380.320 3.042 20 5 GGBDRN C[C@@H](CC1CCCCC1)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122690127 1414539303 /nfs/dbraw/zinc/53/93/03/1414539303.db2.gz ZZOBMIGQHSYUPM-INIZCTEOSA-N 0 0 387.480 3.486 20 5 GGBDRN C[C@H](CC1CCCCC1)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122690338 1414539330 /nfs/dbraw/zinc/53/93/30/1414539330.db2.gz ZZOBMIGQHSYUPM-MRXNPFEDSA-N 0 0 387.480 3.486 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)Oc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000122694981 1414540407 /nfs/dbraw/zinc/54/04/07/1414540407.db2.gz PSZLQWKFTQOKMB-UHFFFAOYSA-N 0 0 392.343 3.372 20 5 GGBDRN C[C@@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1 ZINC000122693885 1414540415 /nfs/dbraw/zinc/54/04/15/1414540415.db2.gz MZLMKRCVJXMPTH-HNNXBMFYSA-N 0 0 399.422 3.212 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000122715167 1414546210 /nfs/dbraw/zinc/54/62/10/1414546210.db2.gz WHUSTHQWRNLMQF-NHYWBVRUSA-N 0 0 384.841 3.039 20 5 GGBDRN CCCC[C@H](CC)CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122719479 1414547736 /nfs/dbraw/zinc/54/77/36/1414547736.db2.gz JFEIEVCDOSGFGU-INIZCTEOSA-N 0 0 375.469 3.486 20 5 GGBDRN CSc1nc(C)c(CCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c(C)n1 ZINC000122730149 1414550986 /nfs/dbraw/zinc/55/09/86/1414550986.db2.gz QNTAFMUPAWAAGY-UHFFFAOYSA-N 0 0 386.437 3.171 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 ZINC000122738246 1414553340 /nfs/dbraw/zinc/55/33/40/1414553340.db2.gz ZTUXIVSFIFYPRT-UHFFFAOYSA-N 0 0 399.794 3.486 20 5 GGBDRN COC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc(F)c(F)c1 ZINC000122747009 1414555157 /nfs/dbraw/zinc/55/51/57/1414555157.db2.gz UPEVWOXMZUBOFL-OAHLLOKOSA-N 0 0 381.335 3.391 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1cc(N2CCNC2=O)ccc1F ZINC000122755700 1414557298 /nfs/dbraw/zinc/55/72/98/1414557298.db2.gz JAROJCYLOUHLRG-UHFFFAOYSA-N 0 0 393.758 3.445 20 5 GGBDRN CCn1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1cccnc1 ZINC000122761440 1414558321 /nfs/dbraw/zinc/55/83/21/1414558321.db2.gz PCWZDVNDSTXOQN-UHFFFAOYSA-N 0 0 398.448 3.389 20 5 GGBDRN O=C(Nc1cccnc1N1CCOCC1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000122767135 1414559344 /nfs/dbraw/zinc/55/93/44/1414559344.db2.gz JSXOHDYOMIYZPM-UHFFFAOYSA-N 0 0 397.435 3.023 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000122774240 1414561116 /nfs/dbraw/zinc/56/11/16/1414561116.db2.gz 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CCc1cc(=O)oc2cc(OS(=O)(=O)c3cc([N+](=O)[O-])c(C)s3)ccc12 ZINC000122782734 1414563874 /nfs/dbraw/zinc/56/38/74/1414563874.db2.gz YOMKPMHVFPRKMQ-UHFFFAOYSA-N 0 0 395.414 3.401 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000122784766 1414564546 /nfs/dbraw/zinc/56/45/46/1414564546.db2.gz VKWJSHCHDAKNSD-UHFFFAOYSA-N 0 0 392.415 3.462 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000122794466 1414566080 /nfs/dbraw/zinc/56/60/80/1414566080.db2.gz QHKNNUWODOUGFJ-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000122792423 1414566206 /nfs/dbraw/zinc/56/62/06/1414566206.db2.gz GHUWTJUBPCNGMI-HNNXBMFYSA-N 0 0 396.447 3.319 20 5 GGBDRN COc1ccc(C(=O)Nc2cccn(Cc3ccccc3)c2=O)cc1[N+](=O)[O-] ZINC000122792690 1414566305 /nfs/dbraw/zinc/56/63/05/1414566305.db2.gz ADQFTHJUWQIRKU-UHFFFAOYSA-N 0 0 379.372 3.066 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(C2CC2)S(=O)(=O)c2ccc(F)c(F)c2F)cc1 ZINC000122799747 1414567836 /nfs/dbraw/zinc/56/78/36/1414567836.db2.gz JXSCMRBLTVRSGO-UHFFFAOYSA-N 0 0 386.351 3.365 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCCOc1ccc2ccccc2c1 ZINC000122802955 1414568535 /nfs/dbraw/zinc/56/85/35/1414568535.db2.gz TUYXCVYMUIFYLJ-UHFFFAOYSA-N 0 0 382.420 3.228 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H](c2ccco2)N2CCCCC2)cc1[N+](=O)[O-] ZINC000122816683 1414572638 /nfs/dbraw/zinc/57/26/38/1414572638.db2.gz YJSJWBQGESONPM-CQSZACIVSA-N 0 0 399.494 3.063 20 5 GGBDRN O=C(c1cc(C2CCCCC2)n[nH]1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000122823464 1414574037 /nfs/dbraw/zinc/57/40/37/1414574037.db2.gz FAEGWMMLSNKHBJ-UHFFFAOYSA-N 0 0 383.452 3.328 20 5 GGBDRN COc1ccc(C(=O)CCCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122843907 1414578812 /nfs/dbraw/zinc/57/88/12/1414578812.db2.gz MUORISWDRMESHT-UHFFFAOYSA-N 0 0 382.376 3.471 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 ZINC000122854374 1414580723 /nfs/dbraw/zinc/58/07/23/1414580723.db2.gz MGGKYCGESOGLLF-SNVBAGLBSA-N 0 0 399.794 3.116 20 5 GGBDRN O=C(CCN1CCN(c2cc(F)ccc2F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000177640493 1428819991 /nfs/dbraw/zinc/81/99/91/1428819991.db2.gz AQFWXNUVWBZDBL-UHFFFAOYSA-N 0 0 390.390 3.024 20 5 GGBDRN C[C@@H](c1cccc(O)c1)N(C)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000177641797 1428820009 /nfs/dbraw/zinc/82/00/09/1428820009.db2.gz UNKWIJPZTLYPDT-ZDUSSCGKSA-N 0 0 399.403 3.208 20 5 GGBDRN CC(C)Cn1ccc2cc(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3)ccc21 ZINC000122861294 1414583124 /nfs/dbraw/zinc/58/31/24/1414583124.db2.gz PNDJHEFGOZCLOB-UHFFFAOYSA-N 0 0 394.431 3.460 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000122862635 1414583163 /nfs/dbraw/zinc/58/31/63/1414583163.db2.gz LNJDZSCZNZSCPK-CYBMUJFWSA-N 0 0 399.794 3.116 20 5 GGBDRN O=C(Nc1cc(CC2CCCCC2)[nH]n1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000122864577 1414583684 /nfs/dbraw/zinc/58/36/84/1414583684.db2.gz BMZJFNSQOTYXIX-UHFFFAOYSA-N 0 0 395.423 3.274 20 5 GGBDRN Cc1c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)nnn1-c1ccccc1Cl ZINC000122870794 1414585116 /nfs/dbraw/zinc/58/51/16/1414585116.db2.gz XJBHNBCSCPEMMT-UHFFFAOYSA-N 0 0 397.782 3.266 20 5 GGBDRN COc1cc(OCC(=O)N(C)Cc2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-] ZINC000122892470 1414590710 /nfs/dbraw/zinc/59/07/10/1414590710.db2.gz LMQHFWZDUCRCRK-UHFFFAOYSA-N 0 0 382.775 3.433 20 5 GGBDRN CNC(=O)c1cccc(OC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c1 ZINC000122897083 1414591123 /nfs/dbraw/zinc/59/11/23/1414591123.db2.gz GYAFZTKRGUWIOI-UHFFFAOYSA-N 0 0 393.193 3.245 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)Cc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000122899348 1414591896 /nfs/dbraw/zinc/59/18/96/1414591896.db2.gz RAKUMVJWDJZSTP-UHFFFAOYSA-N 0 0 395.506 3.386 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000122907550 1414593726 /nfs/dbraw/zinc/59/37/26/1414593726.db2.gz ZKHFQTPQRUEWMM-CQSZACIVSA-N 0 0 399.325 3.477 20 5 GGBDRN CCn1c(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccnc1 ZINC000122905446 1414593899 /nfs/dbraw/zinc/59/38/99/1414593899.db2.gz JBKPKQNCTXCVQK-LBPRGKRZSA-N 0 0 398.448 3.388 20 5 GGBDRN COc1ccc([C@@H](CO)N(C)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000122916284 1414596425 /nfs/dbraw/zinc/59/64/25/1414596425.db2.gz PDVJEJJCGIZKOG-AUUYWEPGSA-N 0 0 387.436 3.348 20 5 GGBDRN COc1ccc([C@H](CO)N(C)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000122916111 1414596460 /nfs/dbraw/zinc/59/64/60/1414596460.db2.gz PDVJEJJCGIZKOG-LIRRHRJNSA-N 0 0 387.436 3.348 20 5 GGBDRN Cn1cnnc1-c1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000122924483 1414598329 /nfs/dbraw/zinc/59/83/29/1414598329.db2.gz QLQHTVYMLNESRA-UHFFFAOYSA-N 0 0 376.376 3.053 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000122934474 1414600851 /nfs/dbraw/zinc/60/08/51/1414600851.db2.gz KSLWVZJDKIIQKM-CYBMUJFWSA-N 0 0 394.387 3.374 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2C[C@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000122954188 1414604453 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378.436 3.059 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(C)nc1N1CCCC1 ZINC000122993170 1414614678 /nfs/dbraw/zinc/61/46/78/1414614678.db2.gz AOVCCKUHODTYSU-UHFFFAOYSA-N 0 0 385.424 3.229 20 5 GGBDRN COC(=O)c1cc(C(=O)N(C)Cc2ccc(Cl)c(F)c2)cc([N+](=O)[O-])c1 ZINC000123002680 1414617439 /nfs/dbraw/zinc/61/74/39/1414617439.db2.gz BCXRKTRKURMDNV-UHFFFAOYSA-N 0 0 380.759 3.446 20 5 GGBDRN O=C(NCc1cc(Cl)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123010226 1414618744 /nfs/dbraw/zinc/61/87/44/1414618744.db2.gz HSZJTLNTFZXFED-UHFFFAOYSA-N 0 0 399.790 3.498 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000123011279 1414619326 /nfs/dbraw/zinc/61/93/26/1414619326.db2.gz CMZIHLHKOONUAY-QGZVFWFLSA-N 0 0 375.400 3.213 20 5 GGBDRN COc1cc(C(=O)N2Cc3ccccc3C[C@@H]2c2nnc(C)o2)ccc1[N+](=O)[O-] ZINC000123016180 1414620471 /nfs/dbraw/zinc/62/04/71/1414620471.db2.gz AYCSEBXVDZWLLK-QGZVFWFLSA-N 0 0 394.387 3.235 20 5 GGBDRN 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ZINC000123080415 1414635872 /nfs/dbraw/zinc/63/58/72/1414635872.db2.gz FCXPCOUDSUZJSP-UHFFFAOYSA-N 0 0 389.383 3.395 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)C[C@@H](O)c1ccc(F)cc1 ZINC000123111020 1414644612 /nfs/dbraw/zinc/64/46/12/1414644612.db2.gz UFTKHTGSAICJPQ-BDJLRTHQSA-N 0 0 377.372 3.376 20 5 GGBDRN CC(C)COc1cccc(NC(=O)C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000123115045 1414645437 /nfs/dbraw/zinc/64/54/37/1414645437.db2.gz HDBXAJOICKQQKP-UHFFFAOYSA-N 0 0 397.431 3.153 20 5 GGBDRN CC(C)(C)Oc1ccc(NC(=O)C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000123117855 1414646056 /nfs/dbraw/zinc/64/60/56/1414646056.db2.gz DKFRZQDOCNDLQN-UHFFFAOYSA-N 0 0 397.431 3.296 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@](C)(O)c1ccccc1Cl ZINC000123123891 1414647391 /nfs/dbraw/zinc/64/73/91/1414647391.db2.gz HLCUSIBGBGSURA-KRWDZBQOSA-N 0 0 379.800 3.286 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@@H](CCc2ccccc2)C1 ZINC000123123181 1414647400 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397.431 3.296 20 5 GGBDRN O=C(Nc1cccc(C(F)F)c1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000123141394 1414651819 /nfs/dbraw/zinc/65/18/19/1414651819.db2.gz UXFAPQRTQVQCKM-UHFFFAOYSA-N 0 0 375.331 3.056 20 5 GGBDRN CC[C@H](CSc1ccccc1)NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000123143848 1414653201 /nfs/dbraw/zinc/65/32/01/1414653201.db2.gz YSMQTTHVPZWXFB-OAHLLOKOSA-N 0 0 376.482 3.485 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000123147292 1414653877 /nfs/dbraw/zinc/65/38/77/1414653877.db2.gz VANIKOLQKMFLSO-LBPRGKRZSA-N 0 0 376.384 3.479 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000123152132 1414655059 /nfs/dbraw/zinc/65/50/59/1414655059.db2.gz ZFNDJYICLQMLSL-UHFFFAOYSA-N 0 0 396.447 3.108 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000123156513 1414655789 /nfs/dbraw/zinc/65/57/89/1414655789.db2.gz FUFJZUOGOBNHMV-QGZVFWFLSA-N 0 0 396.447 3.108 20 5 GGBDRN Cc1cc(F)cc(C(=O)N(C)CC(=O)Nc2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000123181972 1414662696 /nfs/dbraw/zinc/66/26/96/1414662696.db2.gz XJNTYZRBJWBBRC-UHFFFAOYSA-N 0 0 379.775 3.406 20 5 GGBDRN CCCC(=O)Nc1ccc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000123191173 1414664474 /nfs/dbraw/zinc/66/44/74/1414664474.db2.gz IVKNQVAEAULPSW-UHFFFAOYSA-N 0 0 397.478 3.182 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(-c1cccc([N+](=O)[O-])c1)n2C ZINC000123201914 1414666987 /nfs/dbraw/zinc/66/69/87/1414666987.db2.gz NGFJSXFQBBCERY-UHFFFAOYSA-N 0 0 388.449 3.179 20 5 GGBDRN CCc1nnc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)[nH]1 ZINC000123209879 1414669141 /nfs/dbraw/zinc/66/91/41/1414669141.db2.gz SLFAKGFDBSDRMB-LLVKDONJSA-N 0 0 381.396 3.096 20 5 GGBDRN Cc1nc([C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)c2ccccc2F)no1 ZINC000123217977 1414670847 /nfs/dbraw/zinc/67/08/47/1414670847.db2.gz NOHQPHPXGKNRJN-GOSISDBHSA-N 0 0 384.367 3.182 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)CCCOc1ccccc1C ZINC000123221795 1414671555 /nfs/dbraw/zinc/67/15/55/1414671555.db2.gz YGPCVPTVMQUBIG-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN CCN(CC)C(=O)c1ccc(CNC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1 ZINC000123219228 1414671600 /nfs/dbraw/zinc/67/16/00/1414671600.db2.gz XTBJYNOSPSNEKW-UHFFFAOYSA-N 0 0 387.411 3.454 20 5 GGBDRN O=C1[C@H](Nc2ccccc2OCC(F)F)CCN1c1cccc([N+](=O)[O-])c1 ZINC000123251596 1414678661 /nfs/dbraw/zinc/67/86/61/1414678661.db2.gz SLWBJLINAIMGLD-OAHLLOKOSA-N 0 0 377.347 3.456 20 5 GGBDRN Cc1cc(Br)c(NC(=O)C(=O)N[C@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000123255932 1414679693 /nfs/dbraw/zinc/67/96/93/1414679693.db2.gz YUNMRPWZJMIYSN-SECBINFHSA-N 0 0 386.246 3.155 20 5 GGBDRN O=C(NC[C@@](O)(c1ccccc1)C(F)(F)F)c1cccc(Cl)c1[N+](=O)[O-] ZINC000177665542 1428827565 /nfs/dbraw/zinc/82/75/65/1428827565.db2.gz WJDALQVKYLUQCV-OAHLLOKOSA-N 0 0 388.729 3.428 20 5 GGBDRN CN(CCO)c1ccc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000123261445 1414680851 /nfs/dbraw/zinc/68/08/51/1414680851.db2.gz 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3.349 20 5 GGBDRN Cc1c(CC(=O)NC[C@H](c2c(F)cccc2F)N(C)C)cccc1[N+](=O)[O-] ZINC000123314587 1414694714 /nfs/dbraw/zinc/69/47/14/1414694714.db2.gz AKICRNXWUTZFDL-QGZVFWFLSA-N 0 0 377.391 3.143 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000123317415 1414695221 /nfs/dbraw/zinc/69/52/21/1414695221.db2.gz VJSKSBQIYRXSJN-RHSMWYFYSA-N 0 0 396.490 3.411 20 5 GGBDRN Cc1cc(NC(=O)CSCc2cccnc2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000123324088 1414697372 /nfs/dbraw/zinc/69/73/72/1414697372.db2.gz YOEFJSDVLXCIKD-UHFFFAOYSA-N 0 0 383.433 3.356 20 5 GGBDRN Cc1ccccc1[C@H](OC[C@@H](O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000123343308 1414701218 /nfs/dbraw/zinc/70/12/18/1414701218.db2.gz ZGVRKFUYDOTNBP-SIKLNZKXSA-N 0 0 394.427 3.232 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000123345665 1414701892 /nfs/dbraw/zinc/70/18/92/1414701892.db2.gz CQVGZKNWODEFFD-UHFFFAOYSA-N 0 0 389.274 3.219 20 5 GGBDRN O=C(Nc1ccnn1CCc1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000123352939 1414703917 /nfs/dbraw/zinc/70/39/17/1414703917.db2.gz WQFYVGHDINLNKX-UHFFFAOYSA-N 0 0 381.348 3.195 20 5 GGBDRN Cc1cccc(Oc2ccc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)cn2)c1C ZINC000123362960 1414706812 /nfs/dbraw/zinc/70/68/12/1414706812.db2.gz DIEPQKFRWBDVNJ-UHFFFAOYSA-N 0 0 394.387 3.199 20 5 GGBDRN C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000123369055 1414708010 /nfs/dbraw/zinc/70/80/10/1414708010.db2.gz PAFLFJVAPNMFFN-STQMWFEESA-N 0 0 394.424 3.021 20 5 GGBDRN C[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)CC1(C)OCCO1 ZINC000123368200 1414708048 /nfs/dbraw/zinc/70/80/48/1414708048.db2.gz ZRDLVEXJIQGWQL-AWEZNQCLSA-N 0 0 377.441 3.058 20 5 GGBDRN C[S@@](=O)c1ccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000123371129 1414708904 /nfs/dbraw/zinc/70/89/04/1414708904.db2.gz MIGIZUBPJGWAJN-MHZLTWQESA-N 0 0 387.461 3.206 20 5 GGBDRN CC(=O)N(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1 ZINC000123393802 1414714975 /nfs/dbraw/zinc/71/49/75/1414714975.db2.gz JTMREGYGNMCEDS-UHFFFAOYSA-N 0 0 386.364 3.355 20 5 GGBDRN O=C(NCc1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123395032 1414715177 /nfs/dbraw/zinc/71/51/77/1414715177.db2.gz OVDFZNUEIJUMNC-UHFFFAOYSA-N 0 0 390.399 3.200 20 5 GGBDRN O=C(NCc1ccc(F)cc1C(F)(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000123402760 1414718211 /nfs/dbraw/zinc/71/82/11/1414718211.db2.gz YWPSWYGZOKGWIH-UHFFFAOYSA-N 0 0 385.273 3.008 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccco3)n2Cc2ccco2)c1 ZINC000123412016 1414721945 /nfs/dbraw/zinc/72/19/45/1414721945.db2.gz OBFIXJPLQMZDAB-UHFFFAOYSA-N 0 0 386.393 3.076 20 5 GGBDRN C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)Cn3cc([N+](=O)[O-])ccc3=O)c2)C1 ZINC000123429516 1414728598 /nfs/dbraw/zinc/72/85/98/1414728598.db2.gz QWSIJRCUIDGBAG-DNVCBOLYSA-N 0 0 399.447 3.491 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCc2ccc(OCC(F)(F)F)nc2)c1[N+](=O)[O-] ZINC000123433873 1414730868 /nfs/dbraw/zinc/73/08/68/1414730868.db2.gz CSHRNOOBYVZTBR-UHFFFAOYSA-N 0 0 387.289 3.308 20 5 GGBDRN CC(C)(CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCCC1 ZINC000123459495 1414738779 /nfs/dbraw/zinc/73/87/79/1414738779.db2.gz RXMKLMHZZWACLS-UHFFFAOYSA-N 0 0 399.394 3.467 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1cccc(COC2CCCCC2)c1 ZINC000123495420 1414752111 /nfs/dbraw/zinc/75/21/11/1414752111.db2.gz BNVLHEHTTNYZQF-UHFFFAOYSA-N 0 0 387.440 3.462 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1 ZINC000123502126 1414754398 /nfs/dbraw/zinc/75/43/98/1414754398.db2.gz VGZKSJABUJUAQG-FQEVSTJZSA-N 0 0 396.443 3.351 20 5 GGBDRN O=C([C@@H]1OCCc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000123514370 1414758557 /nfs/dbraw/zinc/75/85/57/1414758557.db2.gz FOCBYYGPVYCCRF-HXUWFJFHSA-N 0 0 382.416 3.279 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1(CC)CC ZINC000177692923 1428834705 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O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(OCc2ccccc2F)cc1 ZINC000123640088 1414801984 /nfs/dbraw/zinc/80/19/84/1414801984.db2.gz QOKIULXQCUQXHL-UHFFFAOYSA-N 0 0 399.382 3.331 20 5 GGBDRN CCn1c(SCCCS(=O)(=O)C(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123655883 1414804816 /nfs/dbraw/zinc/80/48/16/1414804816.db2.gz IBMWFOMEWZFJPI-UHFFFAOYSA-N 0 0 398.510 3.179 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)c3c(F)cccc3[N+](=O)[O-])ccc12 ZINC000123659027 1414805132 /nfs/dbraw/zinc/80/51/32/1414805132.db2.gz JBNCHXMKAPYMHP-UHFFFAOYSA-N 0 0 393.348 3.170 20 5 GGBDRN CCn1c(S[C@@H](C)C(=O)N2CCCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123660939 1414805633 /nfs/dbraw/zinc/80/56/33/1414805633.db2.gz ASBYUHZSGCQDNO-ZDUSSCGKSA-N 0 0 389.481 3.366 20 5 GGBDRN CC[C@@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(Cl)c1 ZINC000123665840 1414806148 /nfs/dbraw/zinc/80/61/48/1414806148.db2.gz UHFDPERLEAVMIK-CQSZACIVSA-N 0 0 389.795 3.424 20 5 GGBDRN CCn1c(S[C@H](C(N)=O)c2ccccc2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123669310 1414806893 /nfs/dbraw/zinc/80/68/93/1414806893.db2.gz SLTQLMHRNWCFPT-HNNXBMFYSA-N 0 0 383.433 3.192 20 5 GGBDRN Cc1c(NC(=O)N2CCN(c3ncnc4sccc43)CC2)cccc1[N+](=O)[O-] ZINC000123679217 1414808476 /nfs/dbraw/zinc/80/84/76/1414808476.db2.gz WAQTYKJFVWNGMW-UHFFFAOYSA-N 0 0 398.448 3.262 20 5 GGBDRN Cc1c(NC(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)cccc1[N+](=O)[O-] ZINC000123678743 1414808504 /nfs/dbraw/zinc/80/85/04/1414808504.db2.gz FDYGLMQXGFXNSM-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000123679859 1414808688 /nfs/dbraw/zinc/80/86/88/1414808688.db2.gz YJEZGKYYUNTRCX-UHFFFAOYSA-N 0 0 378.772 3.227 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)OCc1noc(-c2cccc(Cl)c2)n1 ZINC000123704241 1414812198 /nfs/dbraw/zinc/81/21/98/1414812198.db2.gz WRCXAWJVSLJALB-UHFFFAOYSA-N 0 0 389.751 3.420 20 5 GGBDRN CC(C)[N@H+](C)Cc1ccccc1C[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123716041 1414814523 /nfs/dbraw/zinc/81/45/23/1414814523.db2.gz IQFBHDFXZXTDML-UHFFFAOYSA-N 0 0 395.456 3.053 20 5 GGBDRN CC(C)n1ncc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1C1CC1 ZINC000123719876 1414814952 /nfs/dbraw/zinc/81/49/52/1414814952.db2.gz MMCFOCJNEFXVLL-UHFFFAOYSA-N 0 0 383.452 3.212 20 5 GGBDRN C[C@H](c1cccc(Cl)c1)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000123723432 1414815758 /nfs/dbraw/zinc/81/57/58/1414815758.db2.gz AKYHRRRXBPGCEF-LLVKDONJSA-N 0 0 389.795 3.376 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(N2CCCC2=O)cc1 ZINC000123765435 1414821312 /nfs/dbraw/zinc/82/13/12/1414821312.db2.gz LOVUPWCFRFGQGD-UHFFFAOYSA-N 0 0 378.388 3.384 20 5 GGBDRN Cc1c(C(=O)NCCc2cc3ccccc3o2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000123809080 1414827632 /nfs/dbraw/zinc/82/76/32/1414827632.db2.gz IEXWUPIGZBCUFS-UHFFFAOYSA-N 0 0 391.387 3.203 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000123811910 1414827998 /nfs/dbraw/zinc/82/79/98/1414827998.db2.gz MSAHMZGVFGIPBC-UHFFFAOYSA-N 0 0 378.388 3.453 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCCn1cnc2ccccc21 ZINC000123814183 1414828485 /nfs/dbraw/zinc/82/84/85/1414828485.db2.gz FWRXVBXANKONEX-UHFFFAOYSA-N 0 0 377.404 3.175 20 5 GGBDRN CC(C)Oc1cccc(CN(C)C(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000123819236 1414829214 /nfs/dbraw/zinc/82/92/14/1414829214.db2.gz NJBPQJRZKRPLJH-HNNXBMFYSA-N 0 0 399.447 3.159 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[C@H](O)c2ccc(F)cc2)c1C ZINC000123820089 1414829258 /nfs/dbraw/zinc/82/92/58/1414829258.db2.gz GPHWKVYQDNSUOC-PXAZEXFGSA-N 0 0 396.440 3.141 20 5 GGBDRN O=C(Nc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1)c1cccnc1 ZINC000123821659 1414829285 /nfs/dbraw/zinc/82/92/85/1414829285.db2.gz JGDDLEKHCAZMOS-UHFFFAOYSA-N 0 0 394.362 3.311 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OC[C@@H](O)c2ccccc2)c1 ZINC000123864039 1414837877 /nfs/dbraw/zinc/83/78/77/1414837877.db2.gz UFMZWQHRRGQZBH-CYBMUJFWSA-N 0 0 385.157 3.312 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccc(NC(=O)c2cccnc2)cc1 ZINC000123884563 1414842345 /nfs/dbraw/zinc/84/23/45/1414842345.db2.gz YPLOEUUFQWFTAA-UHFFFAOYSA-N 0 0 390.399 3.101 20 5 GGBDRN Cc1c(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)cccc1[N+](=O)[O-] ZINC000123883522 1414842396 /nfs/dbraw/zinc/84/23/96/1414842396.db2.gz JFGCZPXAKJBOOY-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN CCc1nc(CCNS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)cs1 ZINC000123898592 1414845837 /nfs/dbraw/zinc/84/58/37/1414845837.db2.gz PDVNONPXIPXZRY-UHFFFAOYSA-N 0 0 389.886 3.097 20 5 GGBDRN O=C(NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000123900142 1414846351 /nfs/dbraw/zinc/84/63/51/1414846351.db2.gz OYBDLJJLHBVROT-UHFFFAOYSA-N 0 0 376.372 3.172 20 5 GGBDRN Cc1noc(-c2ccccc2)c1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000123918916 1414849552 /nfs/dbraw/zinc/84/95/52/1414849552.db2.gz AUBVDHQFSACOQA-UHFFFAOYSA-N 0 0 394.387 3.235 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cccc(OCC(F)F)n1 ZINC000123924094 1414850600 /nfs/dbraw/zinc/85/06/00/1414850600.db2.gz LBAVWXAVFSZHSR-UHFFFAOYSA-N 0 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Cc1cccc(OCC(=O)NCc2ccc(OC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000123954564 1414857231 /nfs/dbraw/zinc/85/72/31/1414857231.db2.gz BTWWSRCOOLXBHF-UHFFFAOYSA-N 0 0 384.310 3.497 20 5 GGBDRN Cc1cccc(OCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000123962410 1414857597 /nfs/dbraw/zinc/85/75/97/1414857597.db2.gz AWMYBGMCDNGASW-UHFFFAOYSA-N 0 0 397.431 3.159 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC[C@H]2CC(=O)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000123982954 1414862249 /nfs/dbraw/zinc/86/22/49/1414862249.db2.gz JLGQQHKPTJLYPG-KRWDZBQOSA-N 0 0 384.436 3.062 20 5 GGBDRN O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000123999149 1414866218 /nfs/dbraw/zinc/86/62/18/1414866218.db2.gz HKFSCBOVQWMURO-KXBFYZLASA-N 0 0 391.493 3.324 20 5 GGBDRN CC(C)(CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000124006806 1414868126 /nfs/dbraw/zinc/86/81/26/1414868126.db2.gz LKYPBSNHJLISGV-UHFFFAOYSA-N 0 0 375.812 3.281 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000124011467 1414868399 /nfs/dbraw/zinc/86/83/99/1414868399.db2.gz UGDHHQVDYNAZMH-CYBMUJFWSA-N 0 0 383.383 3.077 20 5 GGBDRN COc1cc(C(=O)OCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)ccc1F ZINC000124017573 1414870256 /nfs/dbraw/zinc/87/02/56/1414870256.db2.gz IJIYDYYREIZJCC-UHFFFAOYSA-N 0 0 389.383 3.211 20 5 GGBDRN CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000124030676 1414872557 /nfs/dbraw/zinc/87/25/57/1414872557.db2.gz CWCOOOLCGFDEBH-KRWDZBQOSA-N 0 0 383.404 3.237 20 5 GGBDRN CC(=O)N[C@@H](C)CCc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000124046497 1414875319 /nfs/dbraw/zinc/87/53/19/1414875319.db2.gz ZCQSVSPOADLVFU-ZDUSSCGKSA-N 0 0 388.395 3.453 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)OCc1noc(-c2cccc(Cl)c2)n1 ZINC000124054001 1414877032 /nfs/dbraw/zinc/87/70/32/1414877032.db2.gz SNDMJFQRCDEHFG-UHFFFAOYSA-N 0 0 389.751 3.420 20 5 GGBDRN CCN1C[C@@H](COC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1=O ZINC000124069863 1414879696 /nfs/dbraw/zinc/87/96/96/1414879696.db2.gz 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Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000124147620 1414895689 /nfs/dbraw/zinc/89/56/89/1414895689.db2.gz CBMFANHEHIYQJX-MRXNPFEDSA-N 0 0 397.431 3.159 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000124153544 1414896695 /nfs/dbraw/zinc/89/66/95/1414896695.db2.gz NEGDTHAMVFGJPA-KRWDZBQOSA-N 0 0 375.812 3.088 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1 ZINC000124156514 1414897064 /nfs/dbraw/zinc/89/70/64/1414897064.db2.gz ARGZYIPSOSUXBK-HNNXBMFYSA-N 0 0 376.457 3.228 20 5 GGBDRN CC(C)(NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C(=O)NCC1CCCCC1 ZINC000124164272 1414898195 /nfs/dbraw/zinc/89/81/95/1414898195.db2.gz NQKKUAZLCBYDCS-UHFFFAOYSA-N 0 0 395.887 3.382 20 5 GGBDRN Cc1cc(C(=O)Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)c(Cl)cc1F ZINC000124177707 1414901000 /nfs/dbraw/zinc/90/10/00/1414901000.db2.gz AQAJMDLUADMSKG-UHFFFAOYSA-N 0 0 375.743 3.289 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000124180321 1414901538 /nfs/dbraw/zinc/90/15/38/1414901538.db2.gz XTCJHYPLJBZLHK-HNNXBMFYSA-N 0 0 386.379 3.377 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1cc(-c2ccco2)nc2ccccc21 ZINC000177739172 1428846635 /nfs/dbraw/zinc/84/66/35/1428846635.db2.gz UFJAABCBRGUTEU-UHFFFAOYSA-N 0 0 378.344 3.457 20 5 GGBDRN O=C(NCc1ccc(Cl)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000124223172 1414912684 /nfs/dbraw/zinc/91/26/84/1414912684.db2.gz BEPDMBKETJZWGJ-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(C)o1 ZINC000124251242 1414920437 /nfs/dbraw/zinc/92/04/37/1414920437.db2.gz YAWOXNYSHFAZMA-MRXNPFEDSA-N 0 0 386.326 3.461 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1COC(=O)CCc1nc(-c2ccoc2)no1 ZINC000124291047 1414930619 /nfs/dbraw/zinc/93/06/19/1414930619.db2.gz MXACHWSZUJZVDI-UHFFFAOYSA-N 0 0 387.348 3.313 20 5 GGBDRN CCOC(=O)/C=C/c1ccc(NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000124299889 1414933132 /nfs/dbraw/zinc/93/31/32/1414933132.db2.gz 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O=C(Nc1ccc(-n2cncn2)c(F)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000124922414 1415073625 /nfs/dbraw/zinc/07/36/25/1415073625.db2.gz CIZVTFOLHRQPLI-UHFFFAOYSA-N 0 0 378.323 3.115 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000124928312 1415075149 /nfs/dbraw/zinc/07/51/49/1415075149.db2.gz MJARXWDDPMQQFR-KRWDZBQOSA-N 0 0 386.379 3.411 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc(OCC(F)F)n1 ZINC000124934501 1415076094 /nfs/dbraw/zinc/07/60/94/1415076094.db2.gz DCVVVBMKPDAGAF-UHFFFAOYSA-N 0 0 389.318 3.276 20 5 GGBDRN COc1ccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000124939344 1415076747 /nfs/dbraw/zinc/07/67/47/1415076747.db2.gz IUKWWXLJGKGVIN-HNNXBMFYSA-N 0 0 384.310 3.086 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1noc(Cc2ccccc2)n1 ZINC000124941125 1415076977 /nfs/dbraw/zinc/07/69/77/1415076977.db2.gz MDSLLHOXQJYMHN-CYBMUJFWSA-N 0 0 395.419 3.126 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCOC2(C1)CCCCCC2 ZINC000177785682 1428857807 /nfs/dbraw/zinc/85/78/07/1428857807.db2.gz YSMDFBRXGQUZAV-UHFFFAOYSA-N 0 0 377.441 3.238 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000124952819 1415079981 /nfs/dbraw/zinc/07/99/81/1415079981.db2.gz GTKRYONGEKKUIL-ZDUSSCGKSA-N 0 0 392.818 3.465 20 5 GGBDRN CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1[O-] ZINC000124973725 1415084010 /nfs/dbraw/zinc/08/40/10/1415084010.db2.gz CDVXVNXEDQOIHB-FZKQIMNGSA-N 0 0 397.431 3.239 20 5 GGBDRN CN1C(=O)c2ccc(NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)cc2C1=O ZINC000124974352 1415084456 /nfs/dbraw/zinc/08/44/56/1415084456.db2.gz CSMBLMOWUURESB-UHFFFAOYSA-N 0 0 393.277 3.092 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H]1CCCc2occc21 ZINC000124979663 1415085572 /nfs/dbraw/zinc/08/55/72/1415085572.db2.gz IWHMVBBGBPBNFQ-AWEZNQCLSA-N 0 0 385.376 3.070 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)Oc1cccnc1Br ZINC000125000546 1415089039 /nfs/dbraw/zinc/08/90/39/1415089039.db2.gz AFYWMVYRFJVEJH-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)Oc1cccnc1Br ZINC000125022272 1415093426 /nfs/dbraw/zinc/09/34/26/1415093426.db2.gz PPBUNFHHYBCQEC-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN CCCCC(=O)N1CSC[C@@H]1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177836342 1428868906 /nfs/dbraw/zinc/86/89/06/1428868906.db2.gz FHEUSUXIOVXZTN-CZUORRHYSA-N 0 0 379.482 3.172 20 5 GGBDRN CCOc1cccc(-c2nnc(SCc3c(F)cccc3[N+](=O)[O-])n2N)c1 ZINC000125088742 1415106853 /nfs/dbraw/zinc/10/68/53/1415106853.db2.gz FHXGLQLGZZKQSD-UHFFFAOYSA-N 0 0 389.412 3.397 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000125100078 1415108695 /nfs/dbraw/zinc/10/86/95/1415108695.db2.gz PIFAFSCWWICAOM-UHFFFAOYSA-N 0 0 398.463 3.300 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)Oc1ccc(Cl)nc1 ZINC000125108296 1415110535 /nfs/dbraw/zinc/11/05/35/1415110535.db2.gz RRYKVHXKBPTBKU-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN CCN(CC)C(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000125116749 1415112171 /nfs/dbraw/zinc/11/21/71/1415112171.db2.gz WLSCRAGZPRIWKX-UHFFFAOYSA-N 0 0 398.463 3.147 20 5 GGBDRN CCCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1C[C@@H](OCC)C12CCCCC2 ZINC000125123534 1415114082 /nfs/dbraw/zinc/11/40/82/1415114082.db2.gz GHDWQRCNHPCWAM-JKSUJKDBSA-N 0 0 378.473 3.308 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@H](C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000177836121 1428868969 /nfs/dbraw/zinc/86/89/69/1428868969.db2.gz UYDSAHFQGLZISB-QRTARXTBSA-N 0 0 375.469 3.365 20 5 GGBDRN CCCCC(=O)N1CSC[C@H]1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177836331 1428868992 /nfs/dbraw/zinc/86/89/92/1428868992.db2.gz FHEUSUXIOVXZTN-BBRMVZONSA-N 0 0 379.482 3.172 20 5 GGBDRN CCCC[C@H](CC)CNC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125135779 1415116693 /nfs/dbraw/zinc/11/66/93/1415116693.db2.gz MJRYRSGZUQDEDZ-INIZCTEOSA-N 0 0 390.484 3.279 20 5 GGBDRN C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000125139924 1415117250 /nfs/dbraw/zinc/11/72/50/1415117250.db2.gz FJWDJCJIZQVGEK-LBPRGKRZSA-N 0 0 384.417 3.233 20 5 GGBDRN C[C@H](CC(=O)c1cccs1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000125140186 1415117726 /nfs/dbraw/zinc/11/77/26/1415117726.db2.gz FJWDJCJIZQVGEK-GFCCVEGCSA-N 0 0 384.417 3.233 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)C(=O)NCC(C)(C)C ZINC000125163739 1415122010 /nfs/dbraw/zinc/12/20/10/1415122010.db2.gz GYPVTHJIJCOADG-GFCCVEGCSA-N 0 0 381.498 3.133 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccncc3)o2)cccc1[N+](=O)[O-] ZINC000125182622 1415125440 /nfs/dbraw/zinc/12/54/40/1415125440.db2.gz GJPOGABKEXGKGO-LLVKDONJSA-N 0 0 385.405 3.468 20 5 GGBDRN O=c1c(Br)nn(CCOc2ccccc2[N+](=O)[O-])c2ccccc12 ZINC000125189785 1415126930 /nfs/dbraw/zinc/12/69/30/1415126930.db2.gz CEDGZMGXRIFTKR-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(Br)nc1 ZINC000125192767 1415127729 /nfs/dbraw/zinc/12/77/29/1415127729.db2.gz UNJLFKRPIOZKCT-UHFFFAOYSA-N 0 0 387.211 3.082 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCN2c3ccccc3O[C@H](C)C2=O)cc1[N+](=O)[O-] ZINC000177833318 1428868152 /nfs/dbraw/zinc/86/81/52/1428868152.db2.gz IMIBKPDUMTZZAU-HUUCEWRRSA-N 0 0 397.431 3.285 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCN2c3ccccc3O[C@@H](C)C2=O)cc1[N+](=O)[O-] ZINC000177833340 1428868179 /nfs/dbraw/zinc/86/81/79/1428868179.db2.gz IMIBKPDUMTZZAU-CABCVRRESA-N 0 0 397.431 3.285 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCCc2nc3ccccc3c(=O)[nH]2)cc1[N+](=O)[O-] ZINC000177834970 1428868650 /nfs/dbraw/zinc/86/86/50/1428868650.db2.gz SEKLVWKJNKURBE-AWEZNQCLSA-N 0 0 394.431 3.340 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)cc1[N+](=O)[O-] ZINC000177834186 1428868729 /nfs/dbraw/zinc/86/87/29/1428868729.db2.gz DVZDGQCVARLLBH-AWEZNQCLSA-N 0 0 395.415 3.043 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(N3CCSCC3)cc2)c1[N+](=O)[O-] ZINC000125248355 1415141023 /nfs/dbraw/zinc/14/10/23/1415141023.db2.gz ZIUZORSDCUKPFR-UHFFFAOYSA-N 0 0 375.454 3.076 20 5 GGBDRN Cc1cccc(C(C)(C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 ZINC000125282172 1415150947 /nfs/dbraw/zinc/15/09/47/1415150947.db2.gz XYJNDTZRMLWGNS-UHFFFAOYSA-N 0 0 383.448 3.405 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000177820855 1428864804 /nfs/dbraw/zinc/86/48/04/1428864804.db2.gz JGWBMZIAIZOJEH-UHFFFAOYSA-N 0 0 391.811 3.140 20 5 GGBDRN Cc1csc2nc(C)nc(N3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)c12 ZINC000125304464 1415158455 /nfs/dbraw/zinc/15/84/55/1415158455.db2.gz PCHVZNUWVLHRRO-UHFFFAOYSA-N 0 0 397.460 3.179 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(S(C)(=O)=O)c(C)c2)cc1[N+](=O)[O-] ZINC000125307257 1415158849 /nfs/dbraw/zinc/15/88/49/1415158849.db2.gz XYJFSBAZIFWWJO-ZDUSSCGKSA-N 0 0 391.449 3.498 20 5 GGBDRN COCCC1(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)CCC1 ZINC000125306657 1415159253 /nfs/dbraw/zinc/15/92/53/1415159253.db2.gz AFQACDRXHQIJMY-UHFFFAOYSA-N 0 0 376.862 3.042 20 5 GGBDRN CCC(=O)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000177821729 1428865186 /nfs/dbraw/zinc/86/51/86/1428865186.db2.gz SXXWSGKINGKDNG-AWEZNQCLSA-N 0 0 399.472 3.487 20 5 GGBDRN Cc1ccc(NC(=O)NCCn2cc([N+](=O)[O-])cn2)cc1OCCC(C)C ZINC000125329167 1415166707 /nfs/dbraw/zinc/16/67/07/1415166707.db2.gz CEKDDFGYRMTNAX-UHFFFAOYSA-N 0 0 375.429 3.346 20 5 GGBDRN CCS(=O)(=O)c1ccccc1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177845302 1428870850 /nfs/dbraw/zinc/87/08/50/1428870850.db2.gz NIHTZNYYGBYMPN-ZDUSSCGKSA-N 0 0 376.434 3.188 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1[N+](=O)[O-] ZINC000177845966 1428871228 /nfs/dbraw/zinc/87/12/28/1428871228.db2.gz CMYZMPKFPMUQRC-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000177846664 1428871255 /nfs/dbraw/zinc/87/12/55/1428871255.db2.gz BNKFHQJXZWWHDG-GDBMZVCRSA-N 0 0 375.469 3.365 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1[N+](=O)[O-] ZINC000177845960 1428871416 /nfs/dbraw/zinc/87/14/16/1428871416.db2.gz CMYZMPKFPMUQRC-CYBMUJFWSA-N 0 0 395.375 3.488 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000177847540 1428871690 /nfs/dbraw/zinc/87/16/90/1428871690.db2.gz CLRJCOGCXUAOPM-WBVHZDCISA-N 0 0 390.484 3.158 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCCN(C(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000177846681 1428871711 /nfs/dbraw/zinc/87/17/11/1428871711.db2.gz BNKFHQJXZWWHDG-ZBFHGGJFSA-N 0 0 375.469 3.365 20 5 GGBDRN COc1cccc(-c2nnc(SCc3ccc([N+](=O)[O-])cc3F)n2N)c1 ZINC000125366649 1415177346 /nfs/dbraw/zinc/17/73/46/1415177346.db2.gz OFPLKBGCRACICJ-UHFFFAOYSA-N 0 0 375.385 3.007 20 5 GGBDRN COc1ccc(CCCN(C)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000125369536 1415178932 /nfs/dbraw/zinc/17/89/32/1415178932.db2.gz PUVUDCWADCAQMZ-UHFFFAOYSA-N 0 0 378.450 3.076 20 5 GGBDRN Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2=O ZINC000177849565 1428872317 /nfs/dbraw/zinc/87/23/17/1428872317.db2.gz RCVNRQNRXMIIKJ-KGLIPLIRSA-N 0 0 395.415 3.074 20 5 GGBDRN C[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1 ZINC000125388796 1415184890 /nfs/dbraw/zinc/18/48/90/1415184890.db2.gz DZCKJYYECBMPOR-CQSZACIVSA-N 0 0 380.404 3.497 20 5 GGBDRN COc1ccccc1OCCN(C)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000125393755 1415186533 /nfs/dbraw/zinc/18/65/33/1415186533.db2.gz XRYPWTMPYRRRIB-UHFFFAOYSA-N 0 0 381.388 3.303 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000177849841 1428872701 /nfs/dbraw/zinc/87/27/01/1428872701.db2.gz LTMMKBXGWXFAEH-CRAIPNDOSA-N 0 0 381.432 3.385 20 5 GGBDRN Cn1cnnc1[C@H]1CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000125420531 1415192792 /nfs/dbraw/zinc/19/27/92/1415192792.db2.gz NFZPZDYUUAQYMN-QGZVFWFLSA-N 0 0 392.419 3.444 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)c2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000177852255 1428873193 /nfs/dbraw/zinc/87/31/93/1428873193.db2.gz QWDWTQTWTXZJEC-CQSZACIVSA-N 0 0 378.388 3.149 20 5 GGBDRN Cc1c(OC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)cccc1[N+](=O)[O-] ZINC000125427652 1415194995 /nfs/dbraw/zinc/19/49/95/1415194995.db2.gz VALJOHHZHRVQCF-OAHLLOKOSA-N 0 0 377.441 3.276 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCCN(c2ccccc2)CC1 ZINC000125431942 1415196607 /nfs/dbraw/zinc/19/66/07/1415196607.db2.gz LOHVRTCNNYKPOR-UHFFFAOYSA-N 0 0 376.416 3.496 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCCNC(=O)c2ccsc2)cc1[N+](=O)[O-] ZINC000177854874 1428873845 /nfs/dbraw/zinc/87/38/45/1428873845.db2.gz ZICVHUBPPWTQFG-CYBMUJFWSA-N 0 0 375.450 3.352 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000177855571 1428873981 /nfs/dbraw/zinc/87/39/81/1428873981.db2.gz NZNMSFKTCLSPRI-QGZVFWFLSA-N 0 0 384.436 3.390 20 5 GGBDRN Cc1ccc(C(=O)CCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000125443276 1415200355 /nfs/dbraw/zinc/20/03/55/1415200355.db2.gz MCFKKXIOHFBDOY-ZDUSSCGKSA-N 0 0 388.449 3.036 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CC2CN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000177870452 1428878713 /nfs/dbraw/zinc/87/87/13/1428878713.db2.gz ULSZXHGWZJBIPT-ZDUSSCGKSA-N 0 0 377.441 3.337 20 5 GGBDRN C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000125449442 1415202100 /nfs/dbraw/zinc/20/21/00/1415202100.db2.gz JVLBTSAZASMXNU-OCCSQVGLSA-N 0 0 379.482 3.346 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H](NC(=O)Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000177859248 1428875474 /nfs/dbraw/zinc/87/54/74/1428875474.db2.gz BKGXWZUSIHQJCZ-IIBYNOLFSA-N 0 0 397.475 3.464 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000177861305 1428875933 /nfs/dbraw/zinc/87/59/33/1428875933.db2.gz OHYHWBKZSBHTDP-WBVHZDCISA-N 0 0 388.468 3.008 20 5 GGBDRN Cc1c(Br)cccc1COC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000125473818 1415209480 /nfs/dbraw/zinc/20/94/80/1415209480.db2.gz ZKCUKSVAUXYNFS-UHFFFAOYSA-N 0 0 382.214 3.341 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000177862588 1428876491 /nfs/dbraw/zinc/87/64/91/1428876491.db2.gz ASEQJFTWBSHJFV-CZUORRHYSA-N 0 0 393.509 3.418 20 5 GGBDRN CN(c1ccccc1NC(=O)C(=O)NCc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000177862067 1428876570 /nfs/dbraw/zinc/87/65/70/1428876570.db2.gz ZIRUEQYUSUTUNF-UHFFFAOYSA-N 0 0 396.447 3.229 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000125483339 1415211884 /nfs/dbraw/zinc/21/18/84/1415211884.db2.gz YZUBFGWVSFKMKE-HNNXBMFYSA-N 0 0 394.431 3.398 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000125488818 1415212571 /nfs/dbraw/zinc/21/25/71/1415212571.db2.gz WDMKHEWREPFBEB-LLVKDONJSA-N 0 0 397.347 3.352 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC(C)(C)C(=O)NCC(C)(C)C ZINC000125489308 1415212795 /nfs/dbraw/zinc/21/27/95/1415212795.db2.gz BFIQJUWPERYVHH-NSHDSACASA-N 0 0 399.875 3.073 20 5 GGBDRN O=C(NC[C@H]1[C@@H]2c3ccccc3C[C@H]12)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000177865195 1428877320 /nfs/dbraw/zinc/87/73/20/1428877320.db2.gz BHVYGDMSTKNWEE-DBXWQHBBSA-N 0 0 392.459 3.012 20 5 GGBDRN COc1ccc(S(=O)(=O)Oc2c(Br)cccc2[N+](=O)[O-])cc1 ZINC000125511162 1415217485 /nfs/dbraw/zinc/21/74/85/1415217485.db2.gz ZQKFFEVBNUVUHP-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1ccc(Cl)nc1 ZINC000125518386 1415218796 /nfs/dbraw/zinc/21/87/96/1415218796.db2.gz ZYGVQYAZTZCPEK-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN O=C(NCc1ccc(CN2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000125518397 1415219152 /nfs/dbraw/zinc/21/91/52/1415219152.db2.gz FXYIZZKNNAZWSN-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(COCc2ccccc2)cc1 ZINC000125521154 1415219435 /nfs/dbraw/zinc/21/94/35/1415219435.db2.gz BHTUDPISJALRQN-UHFFFAOYSA-N 0 0 395.419 3.330 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cc(N3CCNC3=O)ccc2F)cc1[N+](=O)[O-] ZINC000177836986 1428869561 /nfs/dbraw/zinc/86/95/61/1428869561.db2.gz VUNBMVTZZGBVAH-LBPRGKRZSA-N 0 0 386.383 3.063 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)NC(=O)CCN3C)cc1[N+](=O)[O-] ZINC000177842324 1428870197 /nfs/dbraw/zinc/87/01/97/1428870197.db2.gz GISXUFZALXVLAB-CYBMUJFWSA-N 0 0 382.420 3.173 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCCNC(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000177841793 1428870213 /nfs/dbraw/zinc/87/02/13/1428870213.db2.gz JBZOMIYVZGFATP-AWEZNQCLSA-N 0 0 387.411 3.430 20 5 GGBDRN COc1cccc(OCCCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000125561653 1415226977 /nfs/dbraw/zinc/22/69/77/1415226977.db2.gz QVECLLROBRXQHZ-UHFFFAOYSA-N 0 0 399.447 3.403 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cc3c([nH]c2=O)CC(C)(C)CC3=O)cc1[N+](=O)[O-] ZINC000177841941 1428870387 /nfs/dbraw/zinc/87/03/87/1428870387.db2.gz WMLRSQYENDFDPS-LBPRGKRZSA-N 0 0 397.431 3.238 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cc3c([nH]c2=O)CC(C)(C)CC3=O)cc1[N+](=O)[O-] ZINC000177841931 1428870418 /nfs/dbraw/zinc/87/04/18/1428870418.db2.gz WMLRSQYENDFDPS-GFCCVEGCSA-N 0 0 397.431 3.238 20 5 GGBDRN COc1ccc(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)cc1[N+](=O)[O-] ZINC000125583663 1415231920 /nfs/dbraw/zinc/23/19/20/1415231920.db2.gz VBDZTWANPUZQMU-LBPRGKRZSA-N 0 0 382.376 3.187 20 5 GGBDRN O=[N+]([O-])c1ccc[nH]c1=NNS(=O)(=O)c1ccc(Cl)c2ccccc21 ZINC000125593864 1415234097 /nfs/dbraw/zinc/23/40/97/1415234097.db2.gz DDBVOHOLSIPCGK-UHFFFAOYSA-N 0 0 378.797 3.102 20 5 GGBDRN CCc1nnc([C@@H](C)SCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)o1 ZINC000125622849 1415239825 /nfs/dbraw/zinc/23/98/25/1415239825.db2.gz ZWQXVQNGGRGPOU-SNVBAGLBSA-N 0 0 378.410 3.333 20 5 GGBDRN C[C@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc(-c2ccccc2)no1 ZINC000125632981 1415242238 /nfs/dbraw/zinc/24/22/38/1415242238.db2.gz RWDQUBLTDSPZEP-CQSZACIVSA-N 0 0 395.419 3.367 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCc2ccc(CN3CCCC3=O)cc2)c1[N+](=O)[O-] ZINC000125640001 1415243719 /nfs/dbraw/zinc/24/37/19/1415243719.db2.gz NIQIRLBFEKVXLV-UHFFFAOYSA-N 0 0 385.395 3.095 20 5 GGBDRN O=C(c1cc(C(F)(F)F)ccc1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125646957 1415245525 /nfs/dbraw/zinc/24/55/25/1415245525.db2.gz XKZVPDUIXPIRSK-NSHDSACASA-N 0 0 398.316 3.474 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)Oc1ccccc1F ZINC000125672595 1415251551 /nfs/dbraw/zinc/25/15/51/1415251551.db2.gz OUPUCZAVVKVOBQ-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000125674900 1415251999 /nfs/dbraw/zinc/25/19/99/1415251999.db2.gz GYNONQUUBFPBPI-QAPCUYQASA-N 0 0 397.431 3.126 20 5 GGBDRN CCCCCc1nnc(NC(=O)CN(C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000177887904 1428883782 /nfs/dbraw/zinc/88/37/82/1428883782.db2.gz OJIBAWPWXHTUBS-UHFFFAOYSA-N 0 0 377.470 3.250 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Oc1ccc(N2CCCC2=O)cc1 ZINC000125689200 1415255156 /nfs/dbraw/zinc/25/51/56/1415255156.db2.gz ODTGFOITQSUIMA-UHFFFAOYSA-N 0 0 379.372 3.351 20 5 GGBDRN CNC(=O)c1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000125698530 1415256686 /nfs/dbraw/zinc/25/66/86/1415256686.db2.gz OWVQTNPZIZHXLC-UHFFFAOYSA-N 0 0 395.337 3.245 20 5 GGBDRN Cc1sc2[nH]c(CCC(=O)Nc3cccc([N+](=O)[O-])c3C)nc(=O)c2c1C ZINC000125711899 1415259700 /nfs/dbraw/zinc/25/97/00/1415259700.db2.gz GQKLFKIAUPMKAI-UHFFFAOYSA-N 0 0 386.433 3.389 20 5 GGBDRN COC(=O)[C@H]1C[C@@H](OC)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000125716509 1415260935 /nfs/dbraw/zinc/26/09/35/1415260935.db2.gz RVYOQUZYRCQBTD-CZUORRHYSA-N 0 0 394.811 3.271 20 5 GGBDRN COC(=O)[C@H]1C[C@H](OC)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000125740986 1415267772 /nfs/dbraw/zinc/26/77/72/1415267772.db2.gz OVSVSUCSAFJBDQ-GOEBONIOSA-N 0 0 376.434 3.086 20 5 GGBDRN COC(=O)[C@@H]1C[C@H](OC)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000125741431 1415267939 /nfs/dbraw/zinc/26/79/39/1415267939.db2.gz OVSVSUCSAFJBDQ-HOCLYGCPSA-N 0 0 376.434 3.086 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000125751322 1415270154 /nfs/dbraw/zinc/27/01/54/1415270154.db2.gz DNRKJAMFLXICSL-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN Cc1cccc(C(=O)N[C@H](C(=O)NCCc2cccc([N+](=O)[O-])c2)C(C)C)c1 ZINC000125754196 1415270740 /nfs/dbraw/zinc/27/07/40/1415270740.db2.gz FQIGFMFLDVYRRJ-IBGZPJMESA-N 0 0 383.448 3.017 20 5 GGBDRN COc1c(F)cc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1F ZINC000125756164 1415271456 /nfs/dbraw/zinc/27/14/56/1415271456.db2.gz RRBVVWBSUMRNIH-UHFFFAOYSA-N 0 0 389.318 3.023 20 5 GGBDRN O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000125755498 1415271587 /nfs/dbraw/zinc/27/15/87/1415271587.db2.gz HIOGYLXBLZJBSB-UHFFFAOYSA-N 0 0 386.383 3.160 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@H]1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000125761256 1415272978 /nfs/dbraw/zinc/27/29/78/1415272978.db2.gz FKEWVXBKYWZXKM-XHSDSOJGSA-N 0 0 399.472 3.242 20 5 GGBDRN COc1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCC(F)(F)F ZINC000125766096 1415274824 /nfs/dbraw/zinc/27/48/24/1415274824.db2.gz SJXJQPHFWQLRJJ-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN COc1cc(CNC(=O)c2ccccc2[N+](=O)[O-])ccc1OCC(F)(F)F ZINC000125768473 1415275555 /nfs/dbraw/zinc/27/55/55/1415275555.db2.gz WSSFHWHQMHUVED-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cc(C2CCCC2)[nH]n1 ZINC000125779812 1415278495 /nfs/dbraw/zinc/27/84/95/1415278495.db2.gz LGQYTGPTXQUBGW-UHFFFAOYSA-N 0 0 399.407 3.302 20 5 GGBDRN CO[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000125783585 1415279879 /nfs/dbraw/zinc/27/98/79/1415279879.db2.gz GSJUZCPLRWASNR-SFHVURJKSA-N 0 0 384.367 3.037 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000125786603 1415280303 /nfs/dbraw/zinc/28/03/03/1415280303.db2.gz VATOVZRQWNUZQH-BEFAXECRSA-N 0 0 397.431 3.126 20 5 GGBDRN CC(C)[C@H]1OCCC[C@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000177912507 1428890076 /nfs/dbraw/zinc/89/00/76/1428890076.db2.gz HNFJFVSDJRQPFB-QFBILLFUSA-N 0 0 375.469 3.376 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@]2(CCSC2)C1 ZINC000177917688 1428891055 /nfs/dbraw/zinc/89/10/55/1428891055.db2.gz HPTXYXWDICVIPR-LPHOPBHVSA-N 0 0 393.509 3.271 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000177917674 1428891173 /nfs/dbraw/zinc/89/11/73/1428891173.db2.gz HPTXYXWDICVIPR-APWZRJJASA-N 0 0 393.509 3.271 20 5 GGBDRN CN(Cc1nccn1C(F)F)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000125828582 1415292075 /nfs/dbraw/zinc/29/20/75/1415292075.db2.gz PUSGDCCBDSGVIX-UHFFFAOYSA-N 0 0 391.281 3.452 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000125831020 1415292678 /nfs/dbraw/zinc/29/26/78/1415292678.db2.gz XIPWSMLXXPNNFI-OAHLLOKOSA-N 0 0 386.427 3.192 20 5 GGBDRN Cc1ccc(CNc2cccc(C(=O)N3CCC(CO)CC3)c2)cc1[N+](=O)[O-] ZINC000125834041 1415293145 /nfs/dbraw/zinc/29/31/45/1415293145.db2.gz AUWPONGDKMPKDP-UHFFFAOYSA-N 0 0 383.448 3.360 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N1CCC(OC2CCCCC2)CC1 ZINC000125839167 1415294265 /nfs/dbraw/zinc/29/42/65/1415294265.db2.gz TULNMDDWNXEBFZ-UHFFFAOYSA-N 0 0 386.445 3.236 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000125853925 1415297674 /nfs/dbraw/zinc/29/76/74/1415297674.db2.gz QVJWFWPISPGFHN-UHFFFAOYSA-N 0 0 382.482 3.406 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1CCCN(C(=O)Nc2ccccc2)C1 ZINC000125855294 1415297998 /nfs/dbraw/zinc/29/79/98/1415297998.db2.gz QJMNBMRYFDBQQM-KRWDZBQOSA-N 0 0 396.447 3.198 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000125868772 1415301411 /nfs/dbraw/zinc/30/14/11/1415301411.db2.gz NFJXCOVIZPAHDF-BZNIZROVSA-N 0 0 392.843 3.255 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125879062 1415302986 /nfs/dbraw/zinc/30/29/86/1415302986.db2.gz SQSJAFIICRTHGH-LLVKDONJSA-N 0 0 393.783 3.283 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000125889044 1415305338 /nfs/dbraw/zinc/30/53/38/1415305338.db2.gz RQROCYKSGPKKNL-BEFAXECRSA-N 0 0 383.452 3.115 20 5 GGBDRN COC(=O)c1ccc(OC[C@@H](O)c2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000125897837 1415307853 /nfs/dbraw/zinc/30/78/53/1415307853.db2.gz MLDVSWFRDAPMCF-CQSZACIVSA-N 0 0 396.193 3.256 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)NCc2cccc([N+](=O)[O-])c2)n1 ZINC000177945163 1428897613 /nfs/dbraw/zinc/89/76/13/1428897613.db2.gz UGYZOHYOQQFHFJ-UHFFFAOYSA-N 0 0 379.420 3.397 20 5 GGBDRN Cc1ccnc(Oc2cc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)ccc2C)c1 ZINC000125902488 1415308894 /nfs/dbraw/zinc/30/88/94/1415308894.db2.gz WZQNFUHFNAEZJM-UHFFFAOYSA-N 0 0 394.387 3.199 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)n1nc(-c2cccs2)oc1=O ZINC000177947801 1428898315 /nfs/dbraw/zinc/89/83/15/1428898315.db2.gz YASJWPXSAGXIAV-QMMMGPOBSA-N 0 0 394.796 3.326 20 5 GGBDRN C[C@@H]1CC(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000125932888 1415316029 /nfs/dbraw/zinc/31/60/29/1415316029.db2.gz AMTPPEXDSFBJOJ-NXEZZACHSA-N 0 0 376.331 3.222 20 5 GGBDRN CN(Cc1cccc(C(F)(F)F)c1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000125933544 1415316617 /nfs/dbraw/zinc/31/66/17/1415316617.db2.gz OFSVUXOLSLBSNZ-UHFFFAOYSA-N 0 0 381.310 3.211 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc(CNC(=O)C2CCCC2)cc1 ZINC000125950530 1415320182 /nfs/dbraw/zinc/32/01/82/1415320182.db2.gz AGQNJUGXRQJWCG-UHFFFAOYSA-N 0 0 395.459 3.374 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(N3CCCC3)nc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000125950220 1415320599 /nfs/dbraw/zinc/32/05/99/1415320599.db2.gz RPOJTRJPWVAJRX-UHFFFAOYSA-N 0 0 385.380 3.367 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000177958441 1428900334 /nfs/dbraw/zinc/90/03/34/1428900334.db2.gz ROPZZQDHKJBAJN-UHFFFAOYSA-N 0 0 399.812 3.286 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCO[C@@H](c2ccccc2)C1 ZINC000177958230 1428900346 /nfs/dbraw/zinc/90/03/46/1428900346.db2.gz VTQQQRGCUVRGIJ-MRXNPFEDSA-N 0 0 396.852 3.319 20 5 GGBDRN O=C(CCCc1nc(-c2cccs2)no1)NCCc1cccc([N+](=O)[O-])c1 ZINC000125972733 1415326543 /nfs/dbraw/zinc/32/65/43/1415326543.db2.gz ILLKRRLLMMLLQU-UHFFFAOYSA-N 0 0 386.433 3.388 20 5 GGBDRN CSc1nccn1-c1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000125973623 1415326587 /nfs/dbraw/zinc/32/65/87/1415326587.db2.gz VHOBAEFTBYLMIW-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN Cc1c(C(=O)NCCc2cccc([N+](=O)[O-])c2)nnn1-c1ccccc1Cl ZINC000125982718 1415329336 /nfs/dbraw/zinc/32/93/36/1415329336.db2.gz BMXZOOZVCSPQPO-UHFFFAOYSA-N 0 0 385.811 3.110 20 5 GGBDRN CC[C@@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1F ZINC000125984839 1415329684 /nfs/dbraw/zinc/32/96/84/1415329684.db2.gz LRNLQXJCQDYPBH-CQSZACIVSA-N 0 0 391.330 3.048 20 5 GGBDRN O=C(OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccnc(-n2ccnc2)c1 ZINC000125993967 1415332143 /nfs/dbraw/zinc/33/21/43/1415332143.db2.gz HHJTZHYWAOTPAH-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN O=C(Nc1ccccc1Cn1cncn1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000125995313 1415332183 /nfs/dbraw/zinc/33/21/83/1415332183.db2.gz USPAHRSIOKEFKJ-UHFFFAOYSA-N 0 0 378.392 3.061 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C1CCN(c2nc3ccccc3o2)CC1 ZINC000125996097 1415332840 /nfs/dbraw/zinc/33/28/40/1415332840.db2.gz BRGCNENSZDNSKQ-UHFFFAOYSA-N 0 0 394.431 3.311 20 5 GGBDRN CC(=O)c1ccc(NCc2ccccc2OCCN2CCOCC2)c([N+](=O)[O-])c1 ZINC000126002010 1415333796 /nfs/dbraw/zinc/33/37/96/1415333796.db2.gz LXBIWPVNCHQGRN-UHFFFAOYSA-N 0 0 399.447 3.121 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3c(c2)C(=O)CCC3)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000177962593 1428903451 /nfs/dbraw/zinc/90/34/51/1428903451.db2.gz BUSSVOUCKNRPKE-UHFFFAOYSA-N 0 0 391.387 3.255 20 5 GGBDRN CCc1ccc2c(CNc3cc([N+](=O)[O-])ccc3NCCO)cc(=O)oc2c1 ZINC000126024453 1415339135 /nfs/dbraw/zinc/33/91/35/1415339135.db2.gz ARGBXDKHMPYEDN-UHFFFAOYSA-N 0 0 383.404 3.280 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000126046521 1415344311 /nfs/dbraw/zinc/34/43/11/1415344311.db2.gz NUUYTSBDMYUMBD-IBGZPJMESA-N 0 0 389.411 3.083 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCO[C@@H](c3ccccc3C)C2)c([N+](=O)[O-])c1 ZINC000126068170 1415349894 /nfs/dbraw/zinc/34/98/94/1415349894.db2.gz QNRLZHYSYATIJR-HXUWFJFHSA-N 0 0 399.447 3.314 20 5 GGBDRN Cc1nc(-c2ccc(C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)cc2)n[nH]1 ZINC000126071950 1415350625 /nfs/dbraw/zinc/35/06/25/1415350625.db2.gz RSBHTCBTRSHMQZ-UHFFFAOYSA-N 0 0 377.404 3.493 20 5 GGBDRN O=C(Nc1ccccc1)[C@H]1CCCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000126105234 1415359091 /nfs/dbraw/zinc/35/90/91/1415359091.db2.gz ZLYBGVBBEFPDPE-KRWDZBQOSA-N 0 0 396.447 3.198 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(CN2CCCC2=O)cc1 ZINC000126108331 1415360156 /nfs/dbraw/zinc/36/01/56/1415360156.db2.gz FEICJFYTVSTNCK-UHFFFAOYSA-N 0 0 385.445 3.448 20 5 GGBDRN Cc1ccc(CN2CCOCC2)cc1NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000126141645 1415368005 /nfs/dbraw/zinc/36/80/05/1415368005.db2.gz PLZQDTCNITVUQV-UHFFFAOYSA-N 0 0 391.374 3.266 20 5 GGBDRN CCc1ccc([C@H]2COCCN2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)o1 ZINC000126143801 1415368224 /nfs/dbraw/zinc/36/82/24/1415368224.db2.gz BEMNOLRKPSOHMN-GOSISDBHSA-N 0 0 387.436 3.461 20 5 GGBDRN Cc1c(CC(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000126149413 1415370525 /nfs/dbraw/zinc/37/05/25/1415370525.db2.gz ZIBSFFIRAVXQKG-SFHVURJKSA-N 0 0 376.416 3.473 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000177987252 1428917619 /nfs/dbraw/zinc/91/76/19/1428917619.db2.gz IKPGTFQELARIGJ-LLVKDONJSA-N 0 0 395.412 3.161 20 5 GGBDRN O=C(CNC(=O)NCCc1cccc([N+](=O)[O-])c1)Nc1cccc2ccccc21 ZINC000126161895 1415374071 /nfs/dbraw/zinc/37/40/71/1415374071.db2.gz SWDNSYFIIJDVCF-UHFFFAOYSA-N 0 0 392.415 3.228 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1F ZINC000126174781 1415377359 /nfs/dbraw/zinc/37/73/59/1415377359.db2.gz JMUYBLISSQMPTL-UHFFFAOYSA-N 0 0 392.387 3.223 20 5 GGBDRN O=C(COc1c(Cl)cccc1[N+](=O)[O-])N1CCN(Cc2cccs2)CC1 ZINC000177988764 1428918652 /nfs/dbraw/zinc/91/86/52/1428918652.db2.gz CXYOJUNVXZWJSN-UHFFFAOYSA-N 0 0 395.868 3.033 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2cccc(Cn3cccn3)c2)c1F ZINC000126187524 1415379729 /nfs/dbraw/zinc/37/97/29/1415379729.db2.gz AJNHSXDMDCVOGM-UHFFFAOYSA-N 0 0 390.396 3.088 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000126190333 1415380800 /nfs/dbraw/zinc/38/08/00/1415380800.db2.gz WXBPVJITYAXOJK-PKOBYXMFSA-N 0 0 381.432 3.026 20 5 GGBDRN CCOCCOc1cc(C)ccc1CNC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000126222054 1415387600 /nfs/dbraw/zinc/38/76/00/1415387600.db2.gz AZJSPLFWLXPUFO-UHFFFAOYSA-N 0 0 376.384 3.388 20 5 GGBDRN C[C@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000126227138 1415388913 /nfs/dbraw/zinc/38/89/13/1415388913.db2.gz NEYDGBSESQYCKG-ZDUSSCGKSA-N 0 0 395.371 3.319 20 5 GGBDRN Cc1cccc(C)c1OC[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1ccccc1 ZINC000126230331 1415389348 /nfs/dbraw/zinc/38/93/48/1415389348.db2.gz FXDZOBARDIDWTP-QGZVFWFLSA-N 0 0 394.431 3.495 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccc(F)cc1F)C1CC1 ZINC000126235587 1415390582 /nfs/dbraw/zinc/39/05/82/1415390582.db2.gz WBGUAOXPXZPZFQ-UHFFFAOYSA-N 0 0 389.358 3.311 20 5 GGBDRN COc1ccc(OCCN(C)c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 ZINC000126239334 1415391418 /nfs/dbraw/zinc/39/14/18/1415391418.db2.gz UUHGRPKMIVCCNK-UHFFFAOYSA-N 0 0 399.447 3.355 20 5 GGBDRN O=C(NCCc1ccn(-c2ccc(F)cc2)n1)NCCc1cccc([N+](=O)[O-])c1 ZINC000126246734 1415392973 /nfs/dbraw/zinc/39/29/73/1415392973.db2.gz CLTYIKMDJHKQMC-UHFFFAOYSA-N 0 0 397.410 3.004 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(Cc2ccc(F)cc2F)C2CC2)cc1[N+](=O)[O-] ZINC000126247700 1415393271 /nfs/dbraw/zinc/39/32/71/1415393271.db2.gz WDHVUCNWSMUOCJ-UHFFFAOYSA-N 0 0 389.358 3.311 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000126249435 1415393798 /nfs/dbraw/zinc/39/37/98/1415393798.db2.gz YKJNWTUTGVMXRE-MRXNPFEDSA-N 0 0 391.468 3.304 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000126255402 1415395738 /nfs/dbraw/zinc/39/57/38/1415395738.db2.gz FHMYAVXUBDSXMH-INIZCTEOSA-N 0 0 398.246 3.477 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(c3nc(C)c(C)s3)CC2)cc1[N+](=O)[O-] ZINC000126265350 1415398301 /nfs/dbraw/zinc/39/83/01/1415398301.db2.gz GHMQKZNNMAVRIK-UHFFFAOYSA-N 0 0 392.506 3.352 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCO[C@@H](c2ccccc2C)C1 ZINC000126291525 1415406265 /nfs/dbraw/zinc/40/62/65/1415406265.db2.gz BFHHLQSIKSVQBX-HXUWFJFHSA-N 0 0 399.447 3.314 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCO[C@H](c2ccccc2C)C1 ZINC000126291156 1415406491 /nfs/dbraw/zinc/40/64/91/1415406491.db2.gz BFHHLQSIKSVQBX-FQEVSTJZSA-N 0 0 399.447 3.314 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)c2ccc(N)c([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000126293054 1415407536 /nfs/dbraw/zinc/40/75/36/1415407536.db2.gz UBYMEIMSFVZDSY-CYBMUJFWSA-N 0 0 379.420 3.032 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1ccccc1OCC(F)(F)F ZINC000126296847 1415410061 /nfs/dbraw/zinc/41/00/61/1415410061.db2.gz KVUQQWQTWZMNLB-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](Cc3ccccc3)C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000126317636 1415416617 /nfs/dbraw/zinc/41/66/17/1415416617.db2.gz XATKCIPZFPNGBR-KRWDZBQOSA-N 0 0 391.431 3.189 20 5 GGBDRN COc1ccc(CCCN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)cc1 ZINC000126325074 1415417996 /nfs/dbraw/zinc/41/79/96/1415417996.db2.gz FOSXXJVMDBOBIX-UHFFFAOYSA-N 0 0 378.450 3.165 20 5 GGBDRN CCCOc1ccc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(C)c1 ZINC000126326024 1415418704 /nfs/dbraw/zinc/41/87/04/1415418704.db2.gz KINYDCNUTQWRDS-UHFFFAOYSA-N 0 0 385.376 3.239 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000126367329 1415428108 /nfs/dbraw/zinc/42/81/08/1415428108.db2.gz FDBFDLHCHHFVBD-FQEVSTJZSA-N 0 0 383.448 3.293 20 5 GGBDRN CCN(C[C@H]1COc2ccccc2O1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126372181 1415429221 /nfs/dbraw/zinc/42/92/21/1415429221.db2.gz JUNPRCKVWXJGLY-KRWDZBQOSA-N 0 0 385.420 3.009 20 5 GGBDRN COc1ccccc1-c1noc([C@H](C)NC(=O)Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000126375362 1415429811 /nfs/dbraw/zinc/42/98/11/1415429811.db2.gz JJJMYYCMGVEFCM-ZDUSSCGKSA-N 0 0 396.403 3.382 20 5 GGBDRN O=C(c1cccc(F)c1)N1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000178004665 1428928796 /nfs/dbraw/zinc/92/87/96/1428928796.db2.gz NQDPZLIGFQJCCQ-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000126378238 1415430297 /nfs/dbraw/zinc/43/02/97/1415430297.db2.gz QAMKAHNNZDBNAC-SFHVURJKSA-N 0 0 397.410 3.099 20 5 GGBDRN C[C@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@H](c2ccsc2)O1 ZINC000126385801 1415432780 /nfs/dbraw/zinc/43/27/80/1415432780.db2.gz XLUPVTKHWHJNIK-SUMWQHHRSA-N 0 0 375.450 3.370 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccccn1 ZINC000126390859 1415435459 /nfs/dbraw/zinc/43/54/59/1415435459.db2.gz VVGQRKOSFWSPTR-LJQANCHMSA-N 0 0 378.388 3.100 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H](O)c1cc2ccccc2s1 ZINC000126416283 1415445322 /nfs/dbraw/zinc/44/53/22/1415445322.db2.gz VEHRRORYJQGZAU-AWEZNQCLSA-N 0 0 392.458 3.130 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000126420442 1415447910 /nfs/dbraw/zinc/44/79/10/1415447910.db2.gz DSZJJXOCGPNGCI-GFCCVEGCSA-N 0 0 382.848 3.264 20 5 GGBDRN Cc1ccc([C@H](O)CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000126422822 1415448658 /nfs/dbraw/zinc/44/86/58/1415448658.db2.gz MTXXVERTZXXLME-OAHLLOKOSA-N 0 0 379.210 3.129 20 5 GGBDRN Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCCN1C(=O)c1c([N+](=O)[O-])cnn1C ZINC000126426740 1415449715 /nfs/dbraw/zinc/44/97/15/1415449715.db2.gz BURHHEZWTMMSNP-LBPRGKRZSA-N 0 0 394.863 3.120 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1cc2ccccc2s1 ZINC000126451134 1415456685 /nfs/dbraw/zinc/45/66/85/1415456685.db2.gz JAZPMOCRBDELRT-MRXNPFEDSA-N 0 0 385.445 3.385 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)c2)n[nH]1 ZINC000126469438 1415462204 /nfs/dbraw/zinc/46/22/04/1415462204.db2.gz OEHATNXVPGVQTG-UHFFFAOYSA-N 0 0 382.336 3.157 20 5 GGBDRN COc1cccc(CCCN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000126470013 1415462940 /nfs/dbraw/zinc/46/29/40/1415462940.db2.gz FZEAKTSZNHBJHH-FQEVSTJZSA-N 0 0 383.404 3.003 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000126471439 1415463003 /nfs/dbraw/zinc/46/30/03/1415463003.db2.gz NKOQMZGUWIUKGM-SFHVURJKSA-N 0 0 391.374 3.199 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000126476919 1415464893 /nfs/dbraw/zinc/46/48/93/1415464893.db2.gz KMLUCBQPQGMOAN-JKSUJKDBSA-N 0 0 376.457 3.020 20 5 GGBDRN Cc1[nH]nc2ncc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc12 ZINC000126516920 1415475473 /nfs/dbraw/zinc/47/54/73/1415475473.db2.gz KURHFOWQJQUMHP-UHFFFAOYSA-N 0 0 395.297 3.368 20 5 GGBDRN Cc1c(CC(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000126523633 1415477342 /nfs/dbraw/zinc/47/73/42/1415477342.db2.gz HHTXGTKNAKXKDZ-QGZVFWFLSA-N 0 0 382.338 3.012 20 5 GGBDRN Cc1c(CC(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000126523821 1415477515 /nfs/dbraw/zinc/47/75/15/1415477515.db2.gz HHTXGTKNAKXKDZ-KRWDZBQOSA-N 0 0 382.338 3.012 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1cc(Br)ccc1O ZINC000126528335 1415478452 /nfs/dbraw/zinc/47/84/52/1415478452.db2.gz DKRPSPPGQFJINL-UHFFFAOYSA-N 0 0 385.145 3.220 20 5 GGBDRN O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126528557 1415478498 /nfs/dbraw/zinc/47/84/98/1415478498.db2.gz NPNHVTFUTCCYFI-VIFPVBQESA-N 0 0 399.291 3.228 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000126534533 1415480385 /nfs/dbraw/zinc/48/03/85/1415480385.db2.gz ORIPTWYPDQOAFX-MRXNPFEDSA-N 0 0 397.353 3.189 20 5 GGBDRN C[C@@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000126539117 1415483563 /nfs/dbraw/zinc/48/35/63/1415483563.db2.gz ZTKRQLPGPXDEHJ-CJNGLKHVSA-N 0 0 392.843 3.323 20 5 GGBDRN C[S@](=O)C[C@@H](NC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000178000552 1428925921 /nfs/dbraw/zinc/92/59/21/1428925921.db2.gz IGXDUICUWRAEPK-PWECECGKSA-N 0 0 381.841 3.490 20 5 GGBDRN C[C@]1(O)CCN([C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)C1 ZINC000178001032 1428926582 /nfs/dbraw/zinc/92/65/82/1428926582.db2.gz AHEDBZVMZZSNBH-HKUYNNGSSA-N 0 0 389.839 3.385 20 5 GGBDRN O=C(c1ccc(F)cc1C(F)(F)F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000126560857 1415491233 /nfs/dbraw/zinc/49/12/33/1415491233.db2.gz OUFIORLTCNMCAR-LLVKDONJSA-N 0 0 398.316 3.474 20 5 GGBDRN CCCCn1ncc(N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1C ZINC000126603591 1415504714 /nfs/dbraw/zinc/50/47/14/1415504714.db2.gz CRVDUQZIIRJEAG-LBPRGKRZSA-N 0 0 375.429 3.348 20 5 GGBDRN O=C(NCC1CC1)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000126610055 1415506470 /nfs/dbraw/zinc/50/64/70/1415506470.db2.gz SQKXZKABGJGFAJ-LBPRGKRZSA-N 0 0 380.832 3.018 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1C(=O)NCC(C)C ZINC000126627708 1415510396 /nfs/dbraw/zinc/51/03/96/1415510396.db2.gz AYWPRSJDZOOSSD-UHFFFAOYSA-N 0 0 384.436 3.340 20 5 GGBDRN COc1ccc(CCNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1OC(F)F ZINC000126629235 1415510995 /nfs/dbraw/zinc/51/09/95/1415510995.db2.gz ZVTLJHZONQTAOG-UHFFFAOYSA-N 0 0 384.310 3.316 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCC1(C2CCCCC2)CCCCC1 ZINC000126684873 1415526014 /nfs/dbraw/zinc/52/60/14/1415526014.db2.gz QCCRUKMJTYXARY-UHFFFAOYSA-N 0 0 375.469 3.404 20 5 GGBDRN O=C(NCc1ccccc1N1CCOCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000126707601 1415533299 /nfs/dbraw/zinc/53/32/99/1415533299.db2.gz ZLCKMPFRYQBICO-UHFFFAOYSA-N 0 0 390.827 3.407 20 5 GGBDRN C[C@H](c1cn(-c2ccccc2)nn1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178025713 1428942840 /nfs/dbraw/zinc/94/28/40/1428942840.db2.gz LFKXZLHMNKPMKT-MRXNPFEDSA-N 0 0 378.436 3.059 20 5 GGBDRN O=C(NCc1ccccc1OCC1CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000126729094 1415540726 /nfs/dbraw/zinc/54/07/26/1415540726.db2.gz WIOUBYOLJYWWPE-UHFFFAOYSA-N 0 0 393.399 3.155 20 5 GGBDRN CC(C)[C@@H](O)C(C)(C)CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000126752028 1415548271 /nfs/dbraw/zinc/54/82/71/1415548271.db2.gz IBBGKOFERCPYHL-CQSZACIVSA-N 0 0 392.374 3.309 20 5 GGBDRN CC[S@@](=O)[C@H]1CCC[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000178031300 1428945874 /nfs/dbraw/zinc/94/58/74/1428945874.db2.gz HDJUECBAYNMYQI-IHULAWBXSA-N 0 0 393.509 3.005 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(-c3ncn(C)n3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126764713 1415552784 /nfs/dbraw/zinc/55/27/84/1415552784.db2.gz PZDYLIHPZAUPRN-UHFFFAOYSA-N 0 0 396.363 3.168 20 5 GGBDRN O=C(COC(=O)CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCc2ccccc21 ZINC000126798154 1415562705 /nfs/dbraw/zinc/56/27/05/1415562705.db2.gz WBOPPTUIVFYJJB-LJQANCHMSA-N 0 0 382.416 3.264 20 5 GGBDRN Cn1cc(CNc2ccc(-n3ccnn3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126809595 1415566489 /nfs/dbraw/zinc/56/64/89/1415566489.db2.gz ZACIZPDTOXZKDC-UHFFFAOYSA-N 0 0 375.392 3.188 20 5 GGBDRN O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ccccc1-c1nc2ccccc2s1 ZINC000126828654 1415575296 /nfs/dbraw/zinc/57/52/96/1415575296.db2.gz CLLKTRNUUQUWGS-UHFFFAOYSA-N 0 0 380.389 3.102 20 5 GGBDRN O=[N+]([O-])c1ccc(SCc2nnnn2-c2ccc(OC(F)F)cc2)cc1 ZINC000126836425 1415579895 /nfs/dbraw/zinc/57/98/95/1415579895.db2.gz YTKCPMRCYKIELX-UHFFFAOYSA-N 0 0 379.348 3.464 20 5 GGBDRN CCCC(=O)N1CCC[C@H]1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000126842851 1415582431 /nfs/dbraw/zinc/58/24/31/1415582431.db2.gz GOQABKMFSLASRC-HNNXBMFYSA-N 0 0 388.449 3.448 20 5 GGBDRN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000126844493 1415582555 /nfs/dbraw/zinc/58/25/55/1415582555.db2.gz AVXNLJFTKIURDF-HNNXBMFYSA-N 0 0 386.456 3.300 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@@H](C)c2cccc(N3CCOC3=O)c2)c1[N+](=O)[O-] ZINC000126879562 1415593847 /nfs/dbraw/zinc/59/38/47/1415593847.db2.gz ZPPQHEMZXFIPLS-LBPRGKRZSA-N 0 0 387.367 3.490 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CC[C@@H](c2ccccc2)C1 ZINC000126883179 1415594699 /nfs/dbraw/zinc/59/46/99/1415594699.db2.gz OFIAUUBRXWFMPS-GOSISDBHSA-N 0 0 376.416 3.266 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3C)ccc2NC1=O ZINC000126890069 1415596372 /nfs/dbraw/zinc/59/63/72/1415596372.db2.gz PJDULFVBTFMSDD-UGSOOPFHSA-N 0 0 397.431 3.433 20 5 GGBDRN CN(C(=O)c1c2ccccc2cc2ccccc21)C1CCN(S(C)(=O)=O)CC1 ZINC000126893840 1415597772 /nfs/dbraw/zinc/59/77/72/1415597772.db2.gz OSDUVTCPDOYCGN-UHFFFAOYSA-N 0 0 396.512 3.489 20 5 GGBDRN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000126902351 1415599886 /nfs/dbraw/zinc/59/98/86/1415599886.db2.gz XIWCJYXCFGWQFI-UHFFFAOYSA-N 0 0 387.289 3.487 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCC1CCN(CC(F)(F)F)CC1 ZINC000126934843 1415613333 /nfs/dbraw/zinc/61/33/33/1415613333.db2.gz IQMFMLDDVDLRLE-UHFFFAOYSA-N 0 0 387.402 3.308 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)C(=O)NCC1CCCC1 ZINC000126958704 1415618499 /nfs/dbraw/zinc/61/84/99/1415618499.db2.gz KSEFYWNEOYWOKR-CYBMUJFWSA-N 0 0 393.509 3.277 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@@H](c2ccccc2)C(C)C)c([N+](=O)[O-])c1 ZINC000126991455 1415629085 /nfs/dbraw/zinc/62/90/85/1415629085.db2.gz NXRXAZHCBWPWBN-LJQANCHMSA-N 0 0 385.420 3.307 20 5 GGBDRN Cn1cnnc1-c1ccc(NCc2ccc(Br)c([N+](=O)[O-])c2)nc1 ZINC000126991300 1415629619 /nfs/dbraw/zinc/62/96/19/1415629619.db2.gz LXUIIMLYTWEFSJ-UHFFFAOYSA-N 0 0 389.213 3.160 20 5 GGBDRN CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000126996097 1415630640 /nfs/dbraw/zinc/63/06/40/1415630640.db2.gz CIXZLYTYSHPGCW-ZDUSSCGKSA-N 0 0 396.852 3.231 20 5 GGBDRN Cc1nc(-c2ccncc2)nc(N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000127002310 1415632221 /nfs/dbraw/zinc/63/22/21/1415632221.db2.gz URJDVICHCYYYHY-MRXNPFEDSA-N 0 0 391.435 3.149 20 5 GGBDRN Cc1cc2cccnc2c(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000127011330 1415635340 /nfs/dbraw/zinc/63/53/40/1415635340.db2.gz VJWGHONNMXLXNJ-CYBMUJFWSA-N 0 0 378.388 3.267 20 5 GGBDRN COc1c(C)ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000178065328 1428966310 /nfs/dbraw/zinc/96/63/10/1428966310.db2.gz OCQUZRFAPCGXOM-AWEZNQCLSA-N 0 0 385.420 3.345 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(c3ccc4ncccc4c3[N+](=O)[O-])C2)nc1 ZINC000127012716 1415635865 /nfs/dbraw/zinc/63/58/65/1415635865.db2.gz XCSCTWIRCHRZTR-LBPRGKRZSA-N 0 0 380.364 3.137 20 5 GGBDRN CN1CCO[C@@H]([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(Cl)cc2)C1 ZINC000127040325 1415645865 /nfs/dbraw/zinc/64/58/65/1415645865.db2.gz ZDXFKBLFGMGAPP-QZTJIDSGSA-N 0 0 389.839 3.050 20 5 GGBDRN O=C(NCc1ccn2ccnc2c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000178070029 1428968517 /nfs/dbraw/zinc/96/85/17/1428968517.db2.gz HPRUWIXWRLDPFF-UHFFFAOYSA-N 0 0 379.420 3.163 20 5 GGBDRN CCOc1ccccc1[C@H](CC(C)C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000127064298 1415651723 /nfs/dbraw/zinc/65/17/23/1415651723.db2.gz VPBDZWAMUMCNHS-INIZCTEOSA-N 0 0 387.436 3.059 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])CCO2 ZINC000127066770 1415652286 /nfs/dbraw/zinc/65/22/86/1415652286.db2.gz MTKIINMSKLCAJW-NSHDSACASA-N 0 0 377.784 3.145 20 5 GGBDRN CC(=O)N(c1nc(Cn2cc([N+](=O)[O-])ccc2=O)cs1)c1ccc(F)cc1 ZINC000127071083 1415653203 /nfs/dbraw/zinc/65/32/03/1415653203.db2.gz QMYQZTMMDFGLTO-UHFFFAOYSA-N 0 0 388.380 3.085 20 5 GGBDRN C[C@@H]1CCCN(Cc2csc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)n2)C1 ZINC000127105281 1415661265 /nfs/dbraw/zinc/66/12/65/1415661265.db2.gz NPICBMUCHOSHPO-SNVBAGLBSA-N 0 0 393.444 3.257 20 5 GGBDRN Cc1c(COc2ccccc2)cccc1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000127102848 1415661428 /nfs/dbraw/zinc/66/14/28/1415661428.db2.gz CYQPHTFCQKTUCT-UHFFFAOYSA-N 0 0 393.399 3.283 20 5 GGBDRN Cc1c(CC(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000127132389 1415667425 /nfs/dbraw/zinc/66/74/25/1415667425.db2.gz ZWFXEXXSVSCQSS-IBGZPJMESA-N 0 0 395.459 3.257 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000127157542 1415674199 /nfs/dbraw/zinc/67/41/99/1415674199.db2.gz MGZJNGBQNQXILA-GOSISDBHSA-N 0 0 385.811 3.054 20 5 GGBDRN CN(C)c1cccc(-c2nnc(SCc3c(F)cccc3[N+](=O)[O-])n2N)c1 ZINC000127170064 1415677622 /nfs/dbraw/zinc/67/76/22/1415677622.db2.gz JYJZNNDHODQJOI-UHFFFAOYSA-N 0 0 388.428 3.065 20 5 GGBDRN Cn1cc(C(=O)NCc2nc(C3CC3)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000127172696 1415678220 /nfs/dbraw/zinc/67/82/20/1415678220.db2.gz XIVZVQJMCLRGPC-UHFFFAOYSA-N 0 0 383.433 3.259 20 5 GGBDRN CC(C)N(CC(=O)OC(C)(C)C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000127175361 1415678535 /nfs/dbraw/zinc/67/85/35/1415678535.db2.gz OXSMEZZOBJOBST-UHFFFAOYSA-N 0 0 375.425 3.197 20 5 GGBDRN COc1ccc(N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(OC)c1 ZINC000127182775 1415680620 /nfs/dbraw/zinc/68/06/20/1415680620.db2.gz CFZFNILVRFJGHW-UHFFFAOYSA-N 0 0 382.376 3.074 20 5 GGBDRN CC(=O)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)CC1 ZINC000127188797 1415682497 /nfs/dbraw/zinc/68/24/97/1415682497.db2.gz GKWIBHPUAROXLJ-UHFFFAOYSA-N 0 0 391.493 3.370 20 5 GGBDRN CN(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)Cc1ccccc1N1CCCC1 ZINC000127197780 1415684587 /nfs/dbraw/zinc/68/45/87/1415684587.db2.gz HOHNDZOZQWCEEF-UHFFFAOYSA-N 0 0 394.475 3.216 20 5 GGBDRN CSc1ccc(C(=O)NC(C)(C)C(=O)NCC2CCCC2)cc1[N+](=O)[O-] ZINC000127211776 1415688610 /nfs/dbraw/zinc/68/86/10/1415688610.db2.gz WHEVOPDWDCMOND-UHFFFAOYSA-N 0 0 379.482 3.132 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccc(F)c(F)c2F)cc1[N+](=O)[O-] ZINC000178061568 1428963548 /nfs/dbraw/zinc/96/35/48/1428963548.db2.gz VKMXZVQZINHOCK-VIFPVBQESA-N 0 0 381.310 3.136 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc3scnc3c2)cc1[N+](=O)[O-] ZINC000178064088 1428964318 /nfs/dbraw/zinc/96/43/18/1428964318.db2.gz FSOZIOWUZGOKJL-LLVKDONJSA-N 0 0 384.417 3.329 20 5 GGBDRN COc1cc(N2CCC(OC(=O)Cc3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000127229430 1415695045 /nfs/dbraw/zinc/69/50/45/1415695045.db2.gz GVNCHYHDGLGMBL-UHFFFAOYSA-N 0 0 376.434 3.420 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cnc3ccccc3c2)cc1[N+](=O)[O-] ZINC000178064223 1428964676 /nfs/dbraw/zinc/96/46/76/1428964676.db2.gz XMNRTFXTSLBFCZ-ZDUSSCGKSA-N 0 0 378.388 3.267 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cc(F)c(F)cc2F)cc1[N+](=O)[O-] ZINC000178063390 1428964812 /nfs/dbraw/zinc/96/48/12/1428964812.db2.gz XHFUDQGCZFENQV-VIFPVBQESA-N 0 0 381.310 3.136 20 5 GGBDRN CCOc1cc(F)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178064007 1428964855 /nfs/dbraw/zinc/96/48/55/1428964855.db2.gz BWOZZJBZGFVGCW-LBPRGKRZSA-N 0 0 389.383 3.257 20 5 GGBDRN Cc1nc(-c2ccc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)cc2)n[nH]1 ZINC000127237359 1415698980 /nfs/dbraw/zinc/69/89/80/1415698980.db2.gz VWIBIYPBBUADHO-UHFFFAOYSA-N 0 0 396.363 3.466 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)N2CCCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000178064990 1428965382 /nfs/dbraw/zinc/96/53/82/1428965382.db2.gz BKTHWCWFRNOTMU-CYBMUJFWSA-N 0 0 385.395 3.199 20 5 GGBDRN COc1cc(N2CCC(OC(=O)Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000127242526 1415701081 /nfs/dbraw/zinc/70/10/81/1415701081.db2.gz KIBUPYLYXHGNRY-UHFFFAOYSA-N 0 0 388.395 3.497 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)c1[N+](=O)[O-] ZINC000127243905 1415701192 /nfs/dbraw/zinc/70/11/92/1415701192.db2.gz IBTVMLYLOBTPJQ-HNNXBMFYSA-N 0 0 385.811 3.205 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)c1[N+](=O)[O-] ZINC000127244153 1415701226 /nfs/dbraw/zinc/70/12/26/1415701226.db2.gz IBTVMLYLOBTPJQ-OAHLLOKOSA-N 0 0 385.811 3.205 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000127251047 1415704457 /nfs/dbraw/zinc/70/44/57/1415704457.db2.gz BMIUNBQJBJZWRE-GTNSWQLSSA-N 0 0 380.832 3.036 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1(C)C ZINC000127255662 1415705030 /nfs/dbraw/zinc/70/50/30/1415705030.db2.gz FYRSGFXTMLDJRF-MOPGFXCFSA-N 0 0 389.496 3.473 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cnc(-c2ccccc2)nc1C ZINC000178091230 1428978229 /nfs/dbraw/zinc/97/82/29/1428978229.db2.gz YOFIJBUZAACGBJ-UHFFFAOYSA-N 0 0 378.388 3.299 20 5 GGBDRN CCOc1cc2c(cc1CNC(=O)NCc1cccc([N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000127281664 1415716215 /nfs/dbraw/zinc/71/62/15/1415716215.db2.gz IPWBXRBYFALCLL-ZDUSSCGKSA-N 0 0 385.420 3.316 20 5 GGBDRN Cc1noc(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)n1 ZINC000127315892 1415733216 /nfs/dbraw/zinc/73/32/16/1415733216.db2.gz ZOGMPFNQQYJUOE-UHFFFAOYSA-N 0 0 380.360 3.089 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000127321400 1415736499 /nfs/dbraw/zinc/73/64/99/1415736499.db2.gz QLVJJHWLHHYZBU-STQMWFEESA-N 0 0 377.828 3.061 20 5 GGBDRN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000127327502 1415739446 /nfs/dbraw/zinc/73/94/46/1415739446.db2.gz NQKWBIQLTKRGHP-UHFFFAOYSA-N 0 0 386.330 3.084 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000178109182 1428985096 /nfs/dbraw/zinc/98/50/96/1428985096.db2.gz PNDKHMNMAFONAT-CSUULGGQSA-N 0 0 393.509 3.005 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CCC[C@H](OC)C2)c1=S ZINC000178111998 1428986786 /nfs/dbraw/zinc/98/67/86/1428986786.db2.gz YYQVYRVVBFLVDJ-HNNXBMFYSA-N 0 0 377.470 3.077 20 5 GGBDRN CCN(Cc1cccc(F)c1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127364046 1415753791 /nfs/dbraw/zinc/75/37/91/1415753791.db2.gz DXPWWZRJKMVNEC-UHFFFAOYSA-N 0 0 387.411 3.233 20 5 GGBDRN C[C@H](c1ccsc1)N1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000127379800 1415759788 /nfs/dbraw/zinc/75/97/88/1415759788.db2.gz DGPBESCZSXCRDJ-OAHLLOKOSA-N 0 0 388.493 3.287 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C1(C)C ZINC000127392496 1415764131 /nfs/dbraw/zinc/76/41/31/1415764131.db2.gz QHTLZGRTZJLZJH-GJZGRUSLSA-N 0 0 379.413 3.395 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CC=C(c3ccc(F)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000178127344 1428992243 /nfs/dbraw/zinc/99/22/43/1428992243.db2.gz RQYLXDNSTRZVSY-UHFFFAOYSA-N 0 0 384.363 3.450 20 5 GGBDRN COCCCOc1cc(C)ccc1CNC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000127428935 1415775284 /nfs/dbraw/zinc/77/52/84/1415775284.db2.gz RODCQPZEGJRSEA-UHFFFAOYSA-N 0 0 376.384 3.388 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127445829 1415781891 /nfs/dbraw/zinc/78/18/91/1415781891.db2.gz LYACCMWINQOYIE-UHFFFAOYSA-N 0 0 399.447 3.102 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1nccn1CCc1ccccc1 ZINC000127451697 1415784119 /nfs/dbraw/zinc/78/41/19/1415784119.db2.gz ILAOFWWSWSARDG-UHFFFAOYSA-N 0 0 378.432 3.283 20 5 GGBDRN CN(CCCc1ccccc1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127457431 1415786302 /nfs/dbraw/zinc/78/63/02/1415786302.db2.gz AXINOSCCQYLWBG-UHFFFAOYSA-N 0 0 383.448 3.136 20 5 GGBDRN Cc1ccccc1C[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127462356 1415788495 /nfs/dbraw/zinc/78/84/95/1415788495.db2.gz FRPICAXGLZHSSE-INIZCTEOSA-N 0 0 383.448 3.101 20 5 GGBDRN CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000178139782 1428996111 /nfs/dbraw/zinc/99/61/11/1428996111.db2.gz IAWFKNYEAAAMBS-UHFFFAOYSA-N 0 0 375.356 3.087 20 5 GGBDRN Cc1ccc(CCNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c(C)c1 ZINC000127480545 1415796030 /nfs/dbraw/zinc/79/60/30/1415796030.db2.gz WKCYYZQKKGNLOB-UHFFFAOYSA-N 0 0 383.448 3.021 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000127504380 1415801982 /nfs/dbraw/zinc/80/19/82/1415801982.db2.gz DPUFUGLPCAPGQQ-UHFFFAOYSA-N 0 0 394.431 3.401 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000127504850 1415802075 /nfs/dbraw/zinc/80/20/75/1415802075.db2.gz JOJUWMCRIGQCGN-UHFFFAOYSA-N 0 0 395.459 3.207 20 5 GGBDRN Nc1c(C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)cccc1[N+](=O)[O-] ZINC000178147208 1428999410 /nfs/dbraw/zinc/99/94/10/1428999410.db2.gz OGVIYSRXVUNOPW-UHFFFAOYSA-N 0 0 394.353 3.158 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)s1 ZINC000127561704 1415810048 /nfs/dbraw/zinc/81/00/48/1415810048.db2.gz ZZRMYHNKYHLPKW-UHFFFAOYSA-N 0 0 397.478 3.214 20 5 GGBDRN COc1ccc(-c2nnc(CNC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)[nH]2)cc1 ZINC000127562425 1415810183 /nfs/dbraw/zinc/81/01/83/1415810183.db2.gz IUDRSHQXDYMDDR-UHFFFAOYSA-N 0 0 396.407 3.327 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)nc2ccccc21 ZINC000127571717 1415811866 /nfs/dbraw/zinc/81/18/66/1415811866.db2.gz BNJMGPZXAPLCRQ-UHFFFAOYSA-N 0 0 392.415 3.382 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1 ZINC000127587207 1415814965 /nfs/dbraw/zinc/81/49/65/1415814965.db2.gz GRQPQBSNWCTEBV-UHFFFAOYSA-N 0 0 384.360 3.081 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1cccc(CN2CCOCC2)c1 ZINC000127594740 1415815881 /nfs/dbraw/zinc/81/58/81/1415815881.db2.gz ICRSJFICMMISMM-UHFFFAOYSA-N 0 0 398.463 3.366 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2c(Cl)cccc2[N+](=O)[O-])c(F)c1 ZINC000127599838 1415816751 /nfs/dbraw/zinc/81/67/51/1415816751.db2.gz NRVCBFCQEUOWAR-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OCC(F)F ZINC000127599326 1415816758 /nfs/dbraw/zinc/81/67/58/1415816758.db2.gz KNJJHRKAJVOUAL-UHFFFAOYSA-N 0 0 379.319 3.124 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC(OC3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000127604189 1415817909 /nfs/dbraw/zinc/81/79/09/1415817909.db2.gz XXIVDMGIRRNWML-UHFFFAOYSA-N 0 0 389.452 3.182 20 5 GGBDRN O=C(NC1CC=CC1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000127604786 1415817977 /nfs/dbraw/zinc/81/79/77/1415817977.db2.gz FPEVBHLJENETCL-UHFFFAOYSA-N 0 0 384.358 3.164 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](O)COc1ccc(F)c(F)c1 ZINC000127610542 1415819725 /nfs/dbraw/zinc/81/97/25/1415819725.db2.gz YCVAQNRAFGZAPP-GFCCVEGCSA-N 0 0 395.362 3.051 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000127614087 1415820292 /nfs/dbraw/zinc/82/02/92/1415820292.db2.gz KSPPARGYKQMEDN-UHFFFAOYSA-N 0 0 389.452 3.182 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)n1 ZINC000178167237 1429004856 /nfs/dbraw/zinc/00/48/56/1429004856.db2.gz FSQOFAGXPLMNJZ-UHFFFAOYSA-N 0 0 394.353 3.279 20 5 GGBDRN O=C(N[C@H]1CCC[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127644369 1415825319 /nfs/dbraw/zinc/82/53/19/1415825319.db2.gz PJSRSETZSZQDJO-HKUYNNGSSA-N 0 0 395.459 3.498 20 5 GGBDRN O=C(Nc1ccn(Cc2ccncc2)n1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178167452 1429004890 /nfs/dbraw/zinc/00/48/90/1429004890.db2.gz FEXSUWYYTHJDTE-UHFFFAOYSA-N 0 0 392.419 3.431 20 5 GGBDRN C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127654604 1415827048 /nfs/dbraw/zinc/82/70/48/1415827048.db2.gz SDPRGLXPFVJHIV-WMZOPIPTSA-N 0 0 395.459 3.450 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)Cc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000127668426 1415829711 /nfs/dbraw/zinc/82/97/11/1415829711.db2.gz KGRMBJKQGSCXCL-UHFFFAOYSA-N 0 0 393.346 3.102 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](CN1CCOCC1)c1ccccc1 ZINC000127671029 1415830399 /nfs/dbraw/zinc/83/03/99/1415830399.db2.gz BYPDVTYRQGZZHK-GOSISDBHSA-N 0 0 398.463 3.407 20 5 GGBDRN Cc1cccc([C@H](C)CNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000127685112 1415832532 /nfs/dbraw/zinc/83/25/32/1415832532.db2.gz ADJNVXFDHGGVQJ-MRXNPFEDSA-N 0 0 383.448 3.273 20 5 GGBDRN COc1ccc(-c2csc(NC(=O)c3c([N+](=O)[O-])c(C)nn3C)n2)cc1F ZINC000127688236 1415833591 /nfs/dbraw/zinc/83/35/91/1415833591.db2.gz FRMFLMOLGYNSDY-UHFFFAOYSA-N 0 0 391.384 3.160 20 5 GGBDRN Cc1cc(C)c(OC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)c([N+](=O)[O-])c1 ZINC000127690237 1415834330 /nfs/dbraw/zinc/83/43/30/1415834330.db2.gz KAOOQDPRZCMZKM-UHFFFAOYSA-N 0 0 399.371 3.356 20 5 GGBDRN C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)Cc1cccs1 ZINC000127692436 1415834354 /nfs/dbraw/zinc/83/43/54/1415834354.db2.gz NJYVJWJIKXBSFC-AWEZNQCLSA-N 0 0 389.477 3.102 20 5 GGBDRN CC(C)c1cnc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)s1 ZINC000127697299 1415835301 /nfs/dbraw/zinc/83/53/01/1415835301.db2.gz CLEGQPLAWONRCS-UHFFFAOYSA-N 0 0 376.438 3.264 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000178164522 1429004414 /nfs/dbraw/zinc/00/44/14/1429004414.db2.gz JFSQHPNSVPFQBF-UHFFFAOYSA-N 0 0 379.420 3.034 20 5 GGBDRN COc1ccccc1N1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000127710637 1415837398 /nfs/dbraw/zinc/83/73/98/1415837398.db2.gz LLZWGCBJQFNGMS-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127721430 1415839048 /nfs/dbraw/zinc/83/90/48/1415839048.db2.gz HNJYAOCZDHMXNK-CABCVRRESA-N 0 0 393.509 3.226 20 5 GGBDRN CN(Cc1cccc(OC(F)(F)F)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000127742464 1415842280 /nfs/dbraw/zinc/84/22/80/1415842280.db2.gz YBFFUARCFXCWHE-UHFFFAOYSA-N 0 0 383.326 3.224 20 5 GGBDRN CCOc1cc(C)ccc1CNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127744638 1415842923 /nfs/dbraw/zinc/84/29/23/1415842923.db2.gz IXIDMQYJTRMJIF-UHFFFAOYSA-N 0 0 399.447 3.069 20 5 GGBDRN Cc1cc(C(=O)NCc2cccc(NC(=O)N3CCCC3)c2)c(N)c([N+](=O)[O-])c1 ZINC000178173718 1429006768 /nfs/dbraw/zinc/00/67/68/1429006768.db2.gz IBBMTSTZNICFCS-UHFFFAOYSA-N 0 0 397.435 3.043 20 5 GGBDRN Cc1cccc(C)c1CCNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127765402 1415846487 /nfs/dbraw/zinc/84/64/87/1415846487.db2.gz IRZNVTCZPDRVKT-UHFFFAOYSA-N 0 0 383.448 3.021 20 5 GGBDRN Cc1cccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1C(N)=O ZINC000127768967 1415847101 /nfs/dbraw/zinc/84/71/01/1415847101.db2.gz WDVRSXOZYXZGBT-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCNC(=O)c1ccc(F)cc1 ZINC000127788517 1415850491 /nfs/dbraw/zinc/85/04/91/1415850491.db2.gz WYWSSOOSUPGORH-UHFFFAOYSA-N 0 0 388.399 3.292 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000127788906 1415850503 /nfs/dbraw/zinc/85/05/03/1415850503.db2.gz LYHWWKUIMOYQHG-UHFFFAOYSA-N 0 0 382.420 3.283 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000127799562 1415852780 /nfs/dbraw/zinc/85/27/80/1415852780.db2.gz HCGBLJUSYNUSIQ-SFHVURJKSA-N 0 0 388.395 3.477 20 5 GGBDRN Cc1ccc(NCCCNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])nc1 ZINC000127799945 1415852786 /nfs/dbraw/zinc/85/27/86/1415852786.db2.gz KAWXXXWPODLXPG-ZDUSSCGKSA-N 0 0 392.843 3.337 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000127799786 1415852846 /nfs/dbraw/zinc/85/28/46/1415852846.db2.gz HCGBLJUSYNUSIQ-GOSISDBHSA-N 0 0 388.395 3.477 20 5 GGBDRN Cc1ccc(NCCCNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])nc1 ZINC000127799746 1415852984 /nfs/dbraw/zinc/85/29/84/1415852984.db2.gz KAWXXXWPODLXPG-CYBMUJFWSA-N 0 0 392.843 3.337 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1 ZINC000127820051 1415857205 /nfs/dbraw/zinc/85/72/05/1415857205.db2.gz FJZQIIRHJYWMGU-AWEZNQCLSA-N 0 0 399.451 3.153 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[C@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000127837043 1415860335 /nfs/dbraw/zinc/86/03/35/1415860335.db2.gz IHLRNZZKSZBXRD-UXLLHSPISA-N 0 0 390.484 3.317 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[C@H]1CN1C[C@@H](C)O[C@H](C)C1 ZINC000127837500 1415860483 /nfs/dbraw/zinc/86/04/83/1415860483.db2.gz IHLRNZZKSZBXRD-INMHGKMJSA-N 0 0 390.484 3.317 20 5 GGBDRN Cn1cc(CNc2ccc3c(c2)oc(=O)n3C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000127843524 1415861325 /nfs/dbraw/zinc/86/13/25/1415861325.db2.gz MQBCLHANPZREAV-UHFFFAOYSA-N 0 0 379.376 3.052 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCN(c2ccccc2F)C1=O ZINC000127842563 1415861462 /nfs/dbraw/zinc/86/14/62/1415861462.db2.gz VERXMAJNYVRLRS-CQSZACIVSA-N 0 0 386.383 3.278 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[S@@](=O)Cc1ccccc1 ZINC000127846797 1415862414 /nfs/dbraw/zinc/86/24/14/1415862414.db2.gz ODWKLGQURLUONA-SANMLTNESA-N 0 0 375.450 3.282 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0 0 381.335 3.306 20 5 GGBDRN Nc1c(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000178195720 1429015236 /nfs/dbraw/zinc/01/52/36/1429015236.db2.gz GLUGTOSPFCBNPS-LBPRGKRZSA-N 0 0 375.356 3.126 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1CCC(F)(F)F ZINC000128009076 1415892549 /nfs/dbraw/zinc/89/25/49/1415892549.db2.gz YFNOGIKXMUOUCX-UHFFFAOYSA-N 0 0 395.337 3.345 20 5 GGBDRN Cc1nn(C)c(C)c1CCOC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000128014961 1415893898 /nfs/dbraw/zinc/89/38/98/1415893898.db2.gz IFUMNISFCCZOAE-UHFFFAOYSA-N 0 0 396.241 3.416 20 5 GGBDRN CC[C@@H](C)n1ncc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C1CC1 ZINC000128044571 1415899862 /nfs/dbraw/zinc/89/98/62/1415899862.db2.gz WARHYSKBQOKGBD-HIFRSBDPSA-N 0 0 398.467 3.361 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1 ZINC000128046323 1415900638 /nfs/dbraw/zinc/90/06/38/1415900638.db2.gz ZUYDYQTXMMFVOB-AWEZNQCLSA-N 0 0 399.451 3.143 20 5 GGBDRN 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CNSBOUFDVOJNPA-QWRGUYRKSA-N 0 0 385.367 3.029 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(CCCO)Cc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000128282298 1415954311 /nfs/dbraw/zinc/95/43/11/1415954311.db2.gz UPIUVAZIOUHWCH-UHFFFAOYSA-N 0 0 398.868 3.130 20 5 GGBDRN CC(C)CN(C[C@H](O)c1ccc(F)cc1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000128294011 1415955911 /nfs/dbraw/zinc/95/59/11/1415955911.db2.gz WFUMUKDHCUQOOF-SFHVURJKSA-N 0 0 390.411 3.331 20 5 GGBDRN CC(C)CN(C[C@@H](O)c1ccc(F)cc1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000128294244 1415956606 /nfs/dbraw/zinc/95/66/06/1415956606.db2.gz WFUMUKDHCUQOOF-GOSISDBHSA-N 0 0 390.411 3.331 20 5 GGBDRN CC(C)CN(C[C@@H](O)c1ccc(F)cc1)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000128294688 1415956770 /nfs/dbraw/zinc/95/67/70/1415956770.db2.gz OIQIHAALRVGPEQ-GOSISDBHSA-N 0 0 375.400 3.148 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O ZINC000128295232 1415956789 /nfs/dbraw/zinc/95/67/89/1415956789.db2.gz SILNOEUVBOSZNV-AWEZNQCLSA-N 0 0 390.346 3.108 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O ZINC000128295007 1415956854 /nfs/dbraw/zinc/95/68/54/1415956854.db2.gz SILNOEUVBOSZNV-CQSZACIVSA-N 0 0 390.346 3.108 20 5 GGBDRN CC(C)CN(C[C@H](O)c1ccc(F)cc1)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000128294488 1415956885 /nfs/dbraw/zinc/95/68/85/1415956885.db2.gz OIQIHAALRVGPEQ-SFHVURJKSA-N 0 0 375.400 3.148 20 5 GGBDRN CCS(=O)(=O)c1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000128312122 1415959856 /nfs/dbraw/zinc/95/98/56/1415959856.db2.gz XZYZUNLTOHZXQI-UHFFFAOYSA-N 0 0 387.417 3.051 20 5 GGBDRN C[C@@H]1CN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCN1CC(F)(F)F ZINC000128336361 1415965832 /nfs/dbraw/zinc/96/58/32/1415965832.db2.gz JLSWMGXSNUEGQP-GFCCVEGCSA-N 0 0 384.358 3.318 20 5 GGBDRN C[C@@]1(c2cccnc2Cl)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000178232777 1429025273 /nfs/dbraw/zinc/02/52/73/1429025273.db2.gz NTTPYMWUXDQEKB-INIZCTEOSA-N 0 0 395.202 3.264 20 5 GGBDRN CCOC(=O)CC[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000128345532 1415967577 /nfs/dbraw/zinc/96/75/77/1415967577.db2.gz RAYZFNSECUAPCM-CYBMUJFWSA-N 0 0 375.425 3.039 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2C[C@@H]3CCCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000178292015 1429044050 /nfs/dbraw/zinc/04/40/50/1429044050.db2.gz MZBZWFIOHUSUJL-SCTDSRPQSA-N 0 0 385.464 3.156 20 5 GGBDRN CC(C)(C)Cc1csc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000128411928 1415981336 /nfs/dbraw/zinc/98/13/36/1415981336.db2.gz HISWCDAREYCEMV-UHFFFAOYSA-N 0 0 376.438 3.008 20 5 GGBDRN COc1cc(CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C2CC2)ccc1O ZINC000128416288 1415981979 /nfs/dbraw/zinc/98/19/79/1415981979.db2.gz HGKUOQUINXICTD-UHFFFAOYSA-N 0 0 385.420 3.221 20 5 GGBDRN CCCC[C@H](COC)NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000128417199 1415982452 /nfs/dbraw/zinc/98/24/52/1415982452.db2.gz JXUFCNPOCJOWBV-GOSISDBHSA-N 0 0 388.468 3.391 20 5 GGBDRN CCOc1ccc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1Cl ZINC000128418545 1415982548 /nfs/dbraw/zinc/98/25/48/1415982548.db2.gz STFWKKGIUXIBTI-UHFFFAOYSA-N 0 0 391.767 3.194 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000128423841 1415984035 /nfs/dbraw/zinc/98/40/35/1415984035.db2.gz LLPXRUIDRNORST-UHFFFAOYSA-N 0 0 384.417 3.110 20 5 GGBDRN COc1cccc(OCC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000128435449 1415986457 /nfs/dbraw/zinc/98/64/57/1415986457.db2.gz ACQAUBMXSHFLSW-UHFFFAOYSA-N 0 0 382.376 3.115 20 5 GGBDRN CCOc1cc(Cl)ccc1CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000128437887 1415987222 /nfs/dbraw/zinc/98/72/22/1415987222.db2.gz FSXLPDMKNOVPRG-UHFFFAOYSA-N 0 0 391.811 3.210 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OC[C@H]1CC(=O)N(c2ccccc2)C1 ZINC000128491630 1415999104 /nfs/dbraw/zinc/99/91/04/1415999104.db2.gz KDQPVHILHWWKRF-AWEZNQCLSA-N 0 0 393.399 3.215 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(N2CCOCC2)c(F)c1 ZINC000128499569 1416000465 /nfs/dbraw/zinc/00/04/65/1416000465.db2.gz ROIXKOBBJHXMHA-UHFFFAOYSA-N 0 0 398.394 3.233 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000128521951 1416005368 /nfs/dbraw/zinc/00/53/68/1416005368.db2.gz CLHHEKHUTOTHNG-QGZVFWFLSA-N 0 0 392.477 3.173 20 5 GGBDRN Cc1cc(=O)n(Cc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)cc1[N+](=O)[O-] ZINC000128523614 1416005846 /nfs/dbraw/zinc/00/58/46/1416005846.db2.gz JCRFMODJIVAWNL-UHFFFAOYSA-N 0 0 394.412 3.078 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000128530213 1416007182 /nfs/dbraw/zinc/00/71/82/1416007182.db2.gz FCRFQCKVNRIEHX-HNNXBMFYSA-N 0 0 398.868 3.210 20 5 GGBDRN Cc1nccc(-c2cccc(NCC(=O)N3CCc4cc([N+](=O)[O-])ccc43)c2)n1 ZINC000178265733 1429037878 /nfs/dbraw/zinc/03/78/78/1429037878.db2.gz SDEXPAAINBQUNH-UHFFFAOYSA-N 0 0 389.415 3.361 20 5 GGBDRN CCNC(=O)c1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000128548694 1416010849 /nfs/dbraw/zinc/01/08/49/1416010849.db2.gz AGFLDBBIPPQBSF-UHFFFAOYSA-N 0 0 377.784 3.259 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000128562883 1416014276 /nfs/dbraw/zinc/01/42/76/1416014276.db2.gz XHZZUMVNXGZKBC-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN Cn1c(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)nc2ccccc21 ZINC000178272296 1429039322 /nfs/dbraw/zinc/03/93/22/1429039322.db2.gz ZOVAZCOLZKRXEV-UHFFFAOYSA-N 0 0 379.420 3.356 20 5 GGBDRN Cc1c(CC(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)cccc1[N+](=O)[O-] ZINC000128570187 1416016095 /nfs/dbraw/zinc/01/60/95/1416016095.db2.gz JRPVGYQBDBAWKY-SFHVURJKSA-N 0 0 376.453 3.022 20 5 GGBDRN Cc1c(CC(=O)N2CCC(OC[C@H]3CCCCO3)CC2)cccc1[N+](=O)[O-] ZINC000128570397 1416016171 /nfs/dbraw/zinc/01/61/71/1416016171.db2.gz JRPVGYQBDBAWKY-GOSISDBHSA-N 0 0 376.453 3.022 20 5 GGBDRN O=C(NCCOc1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000128576253 1416016982 /nfs/dbraw/zinc/01/69/82/1416016982.db2.gz VXXMEBYXNAMEIT-UHFFFAOYSA-N 0 0 398.202 3.035 20 5 GGBDRN Cc1ccc(C(=O)N(C)[C@@H]2CS(=O)(=O)c3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000128598433 1416022173 /nfs/dbraw/zinc/02/21/73/1416022173.db2.gz IIJJTRNAYRFKNV-OAHLLOKOSA-N 0 0 394.836 3.157 20 5 GGBDRN COc1cc(OCC(=O)NCC2(c3ccc(F)cc3)CCC2)ccc1[N+](=O)[O-] ZINC000128600776 1416022714 /nfs/dbraw/zinc/02/27/14/1416022714.db2.gz AVYIARWPTLCEKX-UHFFFAOYSA-N 0 0 388.395 3.359 20 5 GGBDRN COC(=O)c1ccc(-c2nc(Cn3cc([N+](=O)[O-])c(C)cc3=O)cs2)cc1 ZINC000128603860 1416023205 /nfs/dbraw/zinc/02/32/05/1416023205.db2.gz YEFNUOQBGGJPNG-UHFFFAOYSA-N 0 0 385.401 3.023 20 5 GGBDRN CC[C@@H]1CCC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000128608892 1416024789 /nfs/dbraw/zinc/02/47/89/1416024789.db2.gz QWUDNTSKUUGUSX-MCIONIFRSA-N 0 0 379.482 3.346 20 5 GGBDRN COc1cc(CN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C2CC2)ccc1O ZINC000128610761 1416024796 /nfs/dbraw/zinc/02/47/96/1416024796.db2.gz SJMREXPYJSOWRN-UHFFFAOYSA-N 0 0 385.420 3.221 20 5 GGBDRN CCc1cc(N2CCC[C@@H](Cn3ccnn3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000128623837 1416027497 /nfs/dbraw/zinc/02/74/97/1416027497.db2.gz CNNHSSPKOPQQCQ-OAHLLOKOSA-N 0 0 393.451 3.122 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nnc(SCc3ccccc3)s2)c1[N+](=O)[O-] ZINC000128649716 1416034019 /nfs/dbraw/zinc/03/40/19/1416034019.db2.gz JUTMVFVKQRTJLM-UHFFFAOYSA-N 0 0 390.450 3.033 20 5 GGBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1ccc(Cn2cncn2)cc1 ZINC000178248395 1429031439 /nfs/dbraw/zinc/03/14/39/1429031439.db2.gz LKPVQXFROJEYEW-UHFFFAOYSA-N 0 0 399.382 3.163 20 5 GGBDRN C[C@@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CCCC[C@@H]1O ZINC000178314005 1429050175 /nfs/dbraw/zinc/05/01/75/1429050175.db2.gz DWXRDTYUEDHDQH-ICSRJNTNSA-N 0 0 375.469 3.256 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)C[C@H]2CCC[C@@H]2O)cc1[N+](=O)[O-])c1ccccn1 ZINC000128705917 1416047629 /nfs/dbraw/zinc/04/76/29/1416047629.db2.gz RSJCGQBDAIFLJM-NBQZKYEYSA-N 0 0 398.463 3.396 20 5 GGBDRN COc1c(C)cnc(CN(C)S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c1C ZINC000178320294 1429051274 /nfs/dbraw/zinc/05/12/74/1429051274.db2.gz XMJDYCUXUHFFJP-UHFFFAOYSA-N 0 0 393.465 3.053 20 5 GGBDRN CC[C@H]1CCC[C@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000128725909 1416051677 /nfs/dbraw/zinc/05/16/77/1416051677.db2.gz CDSNEBXXZWECKT-RDJZCZTQSA-N 0 0 388.468 3.031 20 5 GGBDRN C[C@@]1(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CCCC[C@@H]1O ZINC000178325190 1429051653 /nfs/dbraw/zinc/05/16/53/1429051653.db2.gz SFLBUUQIGQCWCD-YJBOKZPZSA-N 0 0 375.450 3.389 20 5 GGBDRN Cc1cc(=O)n(CC(=O)NCC2(c3ccccc3)CCCCC2)cc1[N+](=O)[O-] ZINC000128728289 1416052982 /nfs/dbraw/zinc/05/29/82/1416052982.db2.gz IXNQFEAVWSEYQF-UHFFFAOYSA-N 0 0 383.448 3.083 20 5 GGBDRN CCN(CC)C(=O)c1ccccc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178329189 1429052939 /nfs/dbraw/zinc/05/29/39/1429052939.db2.gz JYKIBIJXTSGDSB-UHFFFAOYSA-N 0 0 396.447 3.078 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CCC(F)(F)F ZINC000128758978 1416060956 /nfs/dbraw/zinc/06/09/56/1416060956.db2.gz NSZWENCNLFEVNK-UHFFFAOYSA-N 0 0 395.337 3.345 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCOC[C@@H]3C3CC3)cc2[N+](=O)[O-])C1 ZINC000128795380 1416070926 /nfs/dbraw/zinc/07/09/26/1416070926.db2.gz HPSANHAIORWPGL-STXHMFSFSA-N 0 0 387.480 3.328 20 5 GGBDRN CN(C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1cccc2ncccc21 ZINC000128813351 1416075914 /nfs/dbraw/zinc/07/59/14/1416075914.db2.gz KDQFBPHATNEZCE-UHFFFAOYSA-N 0 0 379.372 3.120 20 5 GGBDRN O=C(Nc1cccc(-c2cn[nH]c2)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000128820280 1416077500 /nfs/dbraw/zinc/07/75/00/1416077500.db2.gz DFGWRLSTAUMELE-UHFFFAOYSA-N 0 0 393.403 3.074 20 5 GGBDRN COc1ccc(CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1Cl ZINC000128833723 1416080898 /nfs/dbraw/zinc/08/08/98/1416080898.db2.gz AMOMZKOJNYQFNW-UHFFFAOYSA-N 0 0 379.756 3.403 20 5 GGBDRN COc1cc(N2CCC(OC(=O)CCc3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000128838828 1416082365 /nfs/dbraw/zinc/08/23/65/1416082365.db2.gz PXHVRFXGVNVWHI-UHFFFAOYSA-N 0 0 385.420 3.143 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@H]2CCC[C@@H]2O)CC1 ZINC000128845320 1416083709 /nfs/dbraw/zinc/08/37/09/1416083709.db2.gz DGRMOETXOGXCKE-BEFAXECRSA-N 0 0 375.469 3.064 20 5 GGBDRN C[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)[C@@H]1C ZINC000178349797 1429058193 /nfs/dbraw/zinc/05/81/93/1429058193.db2.gz YHTBDGSLTHJGLV-NXEZZACHSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000128862684 1416087473 /nfs/dbraw/zinc/08/74/73/1416087473.db2.gz VQRDMVSZVFFDKQ-UHFFFAOYSA-N 0 0 390.399 3.331 20 5 GGBDRN CC(C)Oc1ccc(CCNC(=O)COc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000128871206 1416089324 /nfs/dbraw/zinc/08/93/24/1416089324.db2.gz ABKUJPZYPJBGQR-UHFFFAOYSA-N 0 0 376.384 3.259 20 5 GGBDRN C[C@]1(n2cc(/C=C/c3ccc4c(cccc4[N+](=O)[O-])n3)cn2)CCS(=O)(=O)C1 ZINC000128876219 1416090636 /nfs/dbraw/zinc/09/06/36/1416090636.db2.gz FFUFRPHRFBLCEW-UEKDZROGSA-N 0 0 398.444 3.044 20 5 GGBDRN O=C(OCc1cn2ccccc2n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178297699 1429045921 /nfs/dbraw/zinc/04/59/21/1429045921.db2.gz RTNOIFBHIPXVGD-UHFFFAOYSA-N 0 0 376.166 3.362 20 5 GGBDRN COc1ccc(C(C)(C)CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000128894529 1416095496 /nfs/dbraw/zinc/09/54/96/1416095496.db2.gz XTNSJWBNYKRWGB-UHFFFAOYSA-N 0 0 376.384 3.459 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000128896729 1416095835 /nfs/dbraw/zinc/09/58/35/1416095835.db2.gz KHDQFIGVCGIETE-UHFFFAOYSA-N 0 0 391.431 3.435 20 5 GGBDRN C[C@H](O)C[C@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000128904540 1416097804 /nfs/dbraw/zinc/09/78/04/1416097804.db2.gz AXHKDXOGZIVSPS-GXTWGEPZSA-N 0 0 398.868 3.081 20 5 GGBDRN O=C(CNc1cc([N+](=O)[O-])ccc1F)N(Cc1ccco1)CC(F)(F)F ZINC000178306185 1429048084 /nfs/dbraw/zinc/04/80/84/1429048084.db2.gz RTKNFINMVWNFIT-UHFFFAOYSA-N 0 0 375.278 3.330 20 5 GGBDRN COc1ccc(CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1Cl ZINC000128928727 1416105550 /nfs/dbraw/zinc/10/55/50/1416105550.db2.gz SCCLHHVEATWRSP-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN COc1ccccc1OC[C@@H](C)CNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000128932599 1416106339 /nfs/dbraw/zinc/10/63/39/1416106339.db2.gz DPEONXNUDAGSIM-LBPRGKRZSA-N 0 0 376.384 3.496 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000128947838 1416110548 /nfs/dbraw/zinc/11/05/48/1416110548.db2.gz LCCNZQWBGMSWBW-ZBEGNZNMSA-N 0 0 375.450 3.473 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000128948232 1416110807 /nfs/dbraw/zinc/11/08/07/1416110807.db2.gz LCCNZQWBGMSWBW-MEDUHNTESA-N 0 0 375.450 3.473 20 5 GGBDRN CCOc1cc(N2CCC(C(=O)NCCCOC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000178355725 1429059839 /nfs/dbraw/zinc/05/98/39/1429059839.db2.gz CDMUJEBYEFZXDV-UHFFFAOYSA-N 0 0 393.484 3.141 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1nnc(-c2ccccc2)s1 ZINC000128982332 1416119034 /nfs/dbraw/zinc/11/90/34/1416119034.db2.gz OOGYCZZFBPUEKQ-UHFFFAOYSA-N 0 0 393.428 3.454 20 5 GGBDRN Cc1c(CO)cc([N+](=O)[O-])c(N[C@H](C)C[C@H](O)c2cccs2)c1[N+](=O)[O-] ZINC000128993365 1416121512 /nfs/dbraw/zinc/12/15/12/1416121512.db2.gz JMHOXTQXSPONLD-RNCFNFMXSA-N 0 0 381.410 3.289 20 5 GGBDRN Cc1c(NC(=O)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cnn1-c1ccccc1 ZINC000129018719 1416126699 /nfs/dbraw/zinc/12/66/99/1416126699.db2.gz ZQMFIXKWXLBMER-UHFFFAOYSA-N 0 0 394.387 3.041 20 5 GGBDRN COc1cc(C[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2)CC(C)C)ccc1[N+](=O)[O-] ZINC000826179603 1429063706 /nfs/dbraw/zinc/06/37/06/1429063706.db2.gz VZEFFLRYBAUPPC-UHFFFAOYSA-N 0 0 396.451 3.442 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCOC[C@@H]1C[C@H](O)c1ccccc1 ZINC000178372471 1429063854 /nfs/dbraw/zinc/06/38/54/1429063854.db2.gz RTVGZTBBIQVQGQ-PMACEKPBSA-N 0 0 386.448 3.318 20 5 GGBDRN CCc1cc(NCCn2cnnc2C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129080517 1416140329 /nfs/dbraw/zinc/14/03/29/1416140329.db2.gz RGIDDIVJGUBAPS-UHFFFAOYSA-N 0 0 379.424 3.195 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C(=O)N1CCCC[C@H]1C ZINC000129094446 1416143386 /nfs/dbraw/zinc/14/33/86/1416143386.db2.gz GFRDDTXTQDALKF-GHMZBOCLSA-N 0 0 387.358 3.133 20 5 GGBDRN O=C(Oc1ccc2c(c1)oc(=O)cc2-c1ccc([N+](=O)[O-])cc1)c1cnsn1 ZINC000129102829 1416145677 /nfs/dbraw/zinc/14/56/77/1416145677.db2.gz BWPXFRDYGRHMIP-UHFFFAOYSA-N 0 0 395.352 3.439 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccccc1O[C@H]1CCOC1 ZINC000129107878 1416146219 /nfs/dbraw/zinc/14/62/19/1416146219.db2.gz KESJNADXXAZJQW-HNNXBMFYSA-N 0 0 381.388 3.425 20 5 GGBDRN O=C(CCN1CCC(=O)Nc2cc(F)ccc21)Nc1cc([N+](=O)[O-])ccc1F ZINC000129111378 1416147746 /nfs/dbraw/zinc/14/77/46/1416147746.db2.gz NLKKUABJOROYGU-UHFFFAOYSA-N 0 0 390.346 3.050 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)cc1[N+](=O)[O-] ZINC000129120070 1416149873 /nfs/dbraw/zinc/14/98/73/1416149873.db2.gz NZWOXDPRIQVJBM-UHFFFAOYSA-N 0 0 397.431 3.190 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)[C@@H](C)CO1 ZINC000129139064 1416154404 /nfs/dbraw/zinc/15/44/04/1416154404.db2.gz ULPUXLHZENSZIN-UWVGGRQHSA-N 0 0 399.234 3.337 20 5 GGBDRN CC[C@@H](NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1c(C)noc1C ZINC000129180540 1416164110 /nfs/dbraw/zinc/16/41/10/1416164110.db2.gz WLRFTTSLXLWHQY-OAHLLOKOSA-N 0 0 387.440 3.183 20 5 GGBDRN O=C(NC[C@H](O)c1ccccc1Cl)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000129185127 1416165364 /nfs/dbraw/zinc/16/53/64/1416165364.db2.gz FCKWYCWWAQMNHO-AWEZNQCLSA-N 0 0 399.628 3.474 20 5 GGBDRN CN(C[C@H]1CCC[C@H]1O)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000129196174 1416168295 /nfs/dbraw/zinc/16/82/95/1416168295.db2.gz MDLQBYRTKTUERO-IAQYHMDHSA-N 0 0 389.374 3.035 20 5 GGBDRN CN(C)c1cccc([C@@H]2CCCN2c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000129197503 1416168384 /nfs/dbraw/zinc/16/83/84/1416168384.db2.gz ZPWBIZVFGDFENP-AWEZNQCLSA-N 0 0 395.506 3.467 20 5 GGBDRN COc1ccccc1OS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000129223232 1416173822 /nfs/dbraw/zinc/17/38/22/1416173822.db2.gz YAPGUSDMNCMRQZ-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1ccco1 ZINC000129221965 1416173980 /nfs/dbraw/zinc/17/39/80/1416173980.db2.gz JJXMLJOCQMUARG-LJQANCHMSA-N 0 0 398.419 3.306 20 5 GGBDRN Cc1cc(Br)ccc1S(=O)(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000129224746 1416174309 /nfs/dbraw/zinc/17/43/09/1416174309.db2.gz JPUQBJRODJARFD-UHFFFAOYSA-N 0 0 386.227 3.049 20 5 GGBDRN O=[N+]([O-])c1cccc(CCc2nc(-c3cccc(CN4CCOCC4)c3)no2)c1 ZINC000129228144 1416175186 /nfs/dbraw/zinc/17/51/86/1416175186.db2.gz NHGDIQGOBBHAEE-UHFFFAOYSA-N 0 0 394.431 3.262 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000129230737 1416175735 /nfs/dbraw/zinc/17/57/35/1416175735.db2.gz LGMPKJMADCANAS-GFCCVEGCSA-N 0 0 396.852 3.149 20 5 GGBDRN CCOC(=O)c1ccnc(N2CC[C@@H](Oc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000129242613 1416178115 /nfs/dbraw/zinc/17/81/15/1416178115.db2.gz SOZQIMAWRMUGHR-CQSZACIVSA-N 0 0 391.811 3.478 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCN(Cc2cccc(F)c2)CC1 ZINC000178445589 1429079470 /nfs/dbraw/zinc/07/94/70/1429079470.db2.gz IJSVJRDZXBRRMA-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(N3C[C@H](O)C[C@@H]3c3cc(F)ccc3F)n2)cc1 ZINC000129283515 1416185291 /nfs/dbraw/zinc/18/52/91/1416185291.db2.gz FNZWGIIGMZXYDD-CZUORRHYSA-N 0 0 388.330 3.235 20 5 GGBDRN CCOC(=O)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)c1ccccc1 ZINC000129283848 1416185295 /nfs/dbraw/zinc/18/52/95/1416185295.db2.gz VYQQBIVTBYVTPX-CQSZACIVSA-N 0 0 388.395 3.429 20 5 GGBDRN CCOC(=O)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)c1ccccc1 ZINC000129283633 1416185321 /nfs/dbraw/zinc/18/53/21/1416185321.db2.gz VYQQBIVTBYVTPX-AWEZNQCLSA-N 0 0 388.395 3.429 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1ccc(Cl)cc1 ZINC000129308071 1416188615 /nfs/dbraw/zinc/18/86/15/1416188615.db2.gz JUKDLYNJASUZJV-KRWDZBQOSA-N 0 0 377.828 3.290 20 5 GGBDRN CSCC[C@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000129310099 1416189183 /nfs/dbraw/zinc/18/91/83/1416189183.db2.gz LWGFGAYJCJWAOZ-VIFPVBQESA-N 0 0 397.316 3.119 20 5 GGBDRN COc1cccc(OS(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000129320631 1416191072 /nfs/dbraw/zinc/19/10/72/1416191072.db2.gz MLNGQBROCGYQNK-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN O=C(NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1)c1[nH]ncc1[N+](=O)[O-] ZINC000129356900 1416196326 /nfs/dbraw/zinc/19/63/26/1416196326.db2.gz FORJLANQKGWPKO-OAHLLOKOSA-N 0 0 375.388 3.361 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000129368376 1416197672 /nfs/dbraw/zinc/19/76/72/1416197672.db2.gz MZRKPVSFSCNDPV-FQEVSTJZSA-N 0 0 394.431 3.285 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)cc(F)cc1[N+](=O)[O-] ZINC000129368148 1416197802 /nfs/dbraw/zinc/19/78/02/1416197802.db2.gz SZZCJMOVVZHHFO-LBPRGKRZSA-N 0 0 392.362 3.298 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(NC[C@@H]2CCCO2)c(F)c1 ZINC000129373933 1416198646 /nfs/dbraw/zinc/19/86/46/1416198646.db2.gz NRLFFIFYJSOAKC-INIZCTEOSA-N 0 0 389.383 3.342 20 5 GGBDRN CCOCCOc1cc(C)ccc1CNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000129384507 1416200653 /nfs/dbraw/zinc/20/06/53/1416200653.db2.gz GFUZTWFLLWPGTI-UHFFFAOYSA-N 0 0 386.448 3.486 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000129389095 1416201524 /nfs/dbraw/zinc/20/15/24/1416201524.db2.gz GRQBGMUDFFUPIR-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000129395711 1416202822 /nfs/dbraw/zinc/20/28/22/1416202822.db2.gz XLVRXADDIAOVCL-OAQYLSRUSA-N 0 0 377.400 3.447 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000129395498 1416202847 /nfs/dbraw/zinc/20/28/47/1416202847.db2.gz XLVRXADDIAOVCL-NRFANRHFSA-N 0 0 377.400 3.447 20 5 GGBDRN Cc1cccc([C@H](C)CNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000129409545 1416205056 /nfs/dbraw/zinc/20/50/56/1416205056.db2.gz WXXAEDQGXFTAJA-CYBMUJFWSA-N 0 0 387.461 3.014 20 5 GGBDRN O=C(Nc1cccc(Cn2cccn2)c1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000129416057 1416206157 /nfs/dbraw/zinc/20/61/57/1416206157.db2.gz MFQXWNXNBOOWOJ-UHFFFAOYSA-N 0 0 399.794 3.070 20 5 GGBDRN C[C@@H](COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)COc1ccccc1 ZINC000129421629 1416206468 /nfs/dbraw/zinc/20/64/68/1416206468.db2.gz SFXQHOJNJWGHAN-CQSZACIVSA-N 0 0 382.376 3.047 20 5 GGBDRN CCOC(=O)CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H](C)c1ccccc1 ZINC000129423054 1416206900 /nfs/dbraw/zinc/20/69/00/1416206900.db2.gz POOATSFBXAFKKO-CYBMUJFWSA-N 0 0 396.403 3.238 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000129436951 1416209110 /nfs/dbraw/zinc/20/91/10/1416209110.db2.gz VGSYFLWXZWWZGA-UHFFFAOYSA-N 0 0 383.326 3.297 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1nn(-c2ccccc2)c(C)cc1=O ZINC000129436143 1416209235 /nfs/dbraw/zinc/20/92/35/1416209235.db2.gz FJNIQOKWCSOVPM-UHFFFAOYSA-N 0 0 378.388 3.318 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000129443838 1416210695 /nfs/dbraw/zinc/21/06/95/1416210695.db2.gz UQLNMBULQFEKLF-HXUWFJFHSA-N 0 0 382.372 3.481 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1 ZINC000129450931 1416211560 /nfs/dbraw/zinc/21/15/60/1416211560.db2.gz DHOKXWFMDHULOQ-INIZCTEOSA-N 0 0 382.420 3.098 20 5 GGBDRN CCC[C@H]1SCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000129490583 1416218119 /nfs/dbraw/zinc/21/81/19/1416218119.db2.gz NFZDUOGOTADMGA-GFCCVEGCSA-N 0 0 395.300 3.221 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(Cc2cccc(F)c2)CC1 ZINC000178439457 1429077781 /nfs/dbraw/zinc/07/77/81/1429077781.db2.gz FHRSYLIDMVKDOM-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000129514817 1416221699 /nfs/dbraw/zinc/22/16/99/1416221699.db2.gz JMPTYSFMGSNKHQ-JTQLQIEISA-N 0 0 381.816 3.369 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000129518810 1416222043 /nfs/dbraw/zinc/22/20/43/1416222043.db2.gz XDYVWAHEGHDYKW-NSHDSACASA-N 0 0 383.408 3.380 20 5 GGBDRN CCC[C@@H]1SCCN1S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000129530763 1416223449 /nfs/dbraw/zinc/22/34/49/1416223449.db2.gz QGTUYDXFNGQALY-LBPRGKRZSA-N 0 0 395.300 3.221 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@@H](C)c3ccsc3)CC2)c1 ZINC000129545858 1416225606 /nfs/dbraw/zinc/22/56/06/1416225606.db2.gz MIOCJESFYVKLNP-ZDUSSCGKSA-N 0 0 375.450 3.184 20 5 GGBDRN Cc1c(C(=O)NCCc2c(C)cccc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000129552107 1416226646 /nfs/dbraw/zinc/22/66/46/1416226646.db2.gz IMSJZLGKPIFVTI-UHFFFAOYSA-N 0 0 379.420 3.073 20 5 GGBDRN Cn1c2ccc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)cc2nc1C1CC1 ZINC000129553189 1416226721 /nfs/dbraw/zinc/22/67/21/1416226721.db2.gz JPLUEDNHTJUNHS-UHFFFAOYSA-N 0 0 376.376 3.488 20 5 GGBDRN Cc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnn1-c1ccccn1 ZINC000129571169 1416230430 /nfs/dbraw/zinc/23/04/30/1416230430.db2.gz VNJHHPKLRLAJOY-UHFFFAOYSA-N 0 0 377.404 3.289 20 5 GGBDRN Cc1cc(N(C)C)cc(C)c1NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000129575568 1416231269 /nfs/dbraw/zinc/23/12/69/1416231269.db2.gz JJWHWGZRKICUQD-CQSZACIVSA-N 0 0 384.436 3.035 20 5 GGBDRN COCCC1(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)CC1 ZINC000129575340 1416231307 /nfs/dbraw/zinc/23/13/07/1416231307.db2.gz LABFRZDTBRVKTM-UHFFFAOYSA-N 0 0 375.469 3.378 20 5 GGBDRN Cc1nn(C)c2nc(C)cc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)c12 ZINC000129586580 1416232956 /nfs/dbraw/zinc/23/29/56/1416232956.db2.gz BJQKSMIKVWGJBP-UHFFFAOYSA-N 0 0 379.420 3.298 20 5 GGBDRN COC(=O)CCCc1csc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000129589163 1416233382 /nfs/dbraw/zinc/23/33/82/1416233382.db2.gz JVHZCAZDCMVBOO-UHFFFAOYSA-N 0 0 377.422 3.037 20 5 GGBDRN Cn1c(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)nc2ccccc21 ZINC000178444022 1429078748 /nfs/dbraw/zinc/07/87/48/1429078748.db2.gz CUTPOPROBBOJPV-UHFFFAOYSA-N 0 0 378.310 3.430 20 5 GGBDRN O=C([C@H]1CC(=O)N(Cc2ccccc2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129596546 1416234357 /nfs/dbraw/zinc/23/43/57/1416234357.db2.gz 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GGBDRN O=C(Nc1nc2ccccc2s1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1 ZINC000130176609 1416332917 /nfs/dbraw/zinc/33/29/17/1416332917.db2.gz FKYYMMRQNSKWOG-LLVKDONJSA-N 0 0 386.389 3.041 20 5 GGBDRN O=C(NCCCn1ccnc1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000130176894 1416333091 /nfs/dbraw/zinc/33/30/91/1416333091.db2.gz YEGDUQRXDBQTSS-UHFFFAOYSA-N 0 0 387.621 3.027 20 5 GGBDRN O=C(Nc1n[nH]c(-c2ccccc2F)n1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000130212862 1416340740 /nfs/dbraw/zinc/34/07/40/1416340740.db2.gz XRXSMIUTTPYKSY-UHFFFAOYSA-N 0 0 378.323 3.320 20 5 GGBDRN CCOC(=O)CC1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000130257369 1416347616 /nfs/dbraw/zinc/34/76/16/1416347616.db2.gz HWQAQXDTHAYWGT-GFCCVEGCSA-N 0 0 397.859 3.240 20 5 GGBDRN CC(C)NC(=O)Nc1ccccc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000130268776 1416349525 /nfs/dbraw/zinc/34/95/25/1416349525.db2.gz XLBJVEDDRSOYND-UHFFFAOYSA-N 0 0 382.420 3.323 20 5 GGBDRN O=C(c1ccc(CSc2nc[nH]n2)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000130269892 1416349778 /nfs/dbraw/zinc/34/97/78/1416349778.db2.gz RHBRQLTWZWOQDE-UHFFFAOYSA-N 0 0 395.444 3.204 20 5 GGBDRN Cc1[nH]c(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(C)c1C(=O)OC(C)C ZINC000130300739 1416353914 /nfs/dbraw/zinc/35/39/14/1416353914.db2.gz DNNXHYPBYSCLRQ-UHFFFAOYSA-N 0 0 385.420 3.303 20 5 GGBDRN Cc1nccn1CCCCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130323751 1416357909 /nfs/dbraw/zinc/35/79/09/1416357909.db2.gz GYSHOOIQVCTIKQ-UHFFFAOYSA-N 0 0 385.449 3.433 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000130323850 1416358007 /nfs/dbraw/zinc/35/80/07/1416358007.db2.gz HCWNIDSDOBYFAU-UHFFFAOYSA-N 0 0 395.337 3.082 20 5 GGBDRN Cc1nccn1CCCCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000130330711 1416359385 /nfs/dbraw/zinc/35/93/85/1416359385.db2.gz ZHHBGYWHOOVSFE-LBPRGKRZSA-N 0 0 380.832 3.117 20 5 GGBDRN CC(=O)N1CCc2cc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)ccc21 ZINC000130331319 1416359421 /nfs/dbraw/zinc/35/94/21/1416359421.db2.gz 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CCOCc1ccc(CNC(=O)COc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000130405536 1416372570 /nfs/dbraw/zinc/37/25/70/1416372570.db2.gz RAZZWYLCYOUCGB-UHFFFAOYSA-N 0 0 378.812 3.480 20 5 GGBDRN O=C(COC(=O)c1ccc([N+](=O)[O-])c2cccnc12)Nc1ccc(F)cc1F ZINC000130422110 1416375452 /nfs/dbraw/zinc/37/54/52/1416375452.db2.gz WMKQBPWXIFFVGH-UHFFFAOYSA-N 0 0 387.298 3.217 20 5 GGBDRN CC(C)OC(=O)[C@@H](C)N(C)C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000130436708 1416378161 /nfs/dbraw/zinc/37/81/61/1416378161.db2.gz PCMPHYFSGZTFEF-OAHLLOKOSA-N 0 0 391.468 3.243 20 5 GGBDRN O=C(COC(=O)c1ccc([N+](=O)[O-])c2cccnc12)N1CCCc2ccccc21 ZINC000130444984 1416379605 /nfs/dbraw/zinc/37/96/05/1416379605.db2.gz FKCDJNSKIJJLIY-UHFFFAOYSA-N 0 0 391.383 3.279 20 5 GGBDRN COC(=O)c1cc(C(=O)NCC2(c3ccc(F)cc3F)CC2)cc([N+](=O)[O-])c1 ZINC000130453075 1416380981 /nfs/dbraw/zinc/38/09/81/1416380981.db2.gz PVWNDKVBPLGBAE-UHFFFAOYSA-N 0 0 390.342 3.121 20 5 GGBDRN CC(C)[C@H](NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(=O)OC(C)(C)C ZINC000130475269 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383.404 3.400 20 5 GGBDRN C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000130509845 1416391018 /nfs/dbraw/zinc/39/10/18/1416391018.db2.gz WWGPLYOFLVQFEH-GFCCVEGCSA-N 0 0 375.812 3.276 20 5 GGBDRN CC(C)(C)c1ccc(NC(=O)Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)cc1 ZINC000130523250 1416393534 /nfs/dbraw/zinc/39/35/34/1416393534.db2.gz KSPLEADBZGEBOM-UHFFFAOYSA-N 0 0 396.403 3.348 20 5 GGBDRN COc1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1OC ZINC000130530327 1416394578 /nfs/dbraw/zinc/39/45/78/1416394578.db2.gz YRGWHDXOVRCCSK-UHFFFAOYSA-N 0 0 385.420 3.486 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000130540012 1416395591 /nfs/dbraw/zinc/39/55/91/1416395591.db2.gz MQBCBCAJUSAZFG-UHFFFAOYSA-N 0 0 399.495 3.498 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1ccc(OC(F)(F)F)cc1 ZINC000130548447 1416396894 /nfs/dbraw/zinc/39/68/94/1416396894.db2.gz ICGOVPJNQKXNHA-UHFFFAOYSA-N 0 0 381.266 3.358 20 5 GGBDRN Cc1oc(-c2cnn(C)c2)nc1C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178506641 1429092962 /nfs/dbraw/zinc/09/29/62/1429092962.db2.gz KCMYJPRXDCTZIK-UHFFFAOYSA-N 0 0 381.392 3.097 20 5 GGBDRN COc1ccc(CN(C)C(=O)COc2c(Cl)cccc2[N+](=O)[O-])cc1F ZINC000130555885 1416398078 /nfs/dbraw/zinc/39/80/78/1416398078.db2.gz BJPPLZIRCUWFIZ-UHFFFAOYSA-N 0 0 382.775 3.433 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000130566077 1416399925 /nfs/dbraw/zinc/39/99/25/1416399925.db2.gz OQKRXHXVUBIRSL-UHFFFAOYSA-N 0 0 388.767 3.012 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1nnc(-c2ccccc2Cl)o1 ZINC000130568616 1416400931 /nfs/dbraw/zinc/40/09/31/1416400931.db2.gz IIRKNOWIKFLYPA-UHFFFAOYSA-N 0 0 399.750 3.163 20 5 GGBDRN Nc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)c1 ZINC000178510360 1429094524 /nfs/dbraw/zinc/09/45/24/1429094524.db2.gz GVWIULOFPCTDMR-UHFFFAOYSA-N 0 0 394.353 3.158 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(C[C@H]1CCOC1)C1CC1 ZINC000130635077 1416414913 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O=[N+]([O-])c1cc(S(=O)(=O)Nc2c(F)cc(F)cc2Br)cs1 ZINC000130735015 1416437691 /nfs/dbraw/zinc/43/76/91/1416437691.db2.gz YWSBDJGFCULAHI-UHFFFAOYSA-N 0 0 399.194 3.498 20 5 GGBDRN Cc1ccc(NC(=O)C[S@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000130733006 1416437795 /nfs/dbraw/zinc/43/77/95/1416437795.db2.gz NICPUFMSHVERRN-NDEPHWFRSA-N 0 0 399.428 3.446 20 5 GGBDRN Cc1ccc(NC(=O)C[S@@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000130732744 1416438165 /nfs/dbraw/zinc/43/81/65/1416438165.db2.gz NICPUFMSHVERRN-MUUNZHRXSA-N 0 0 399.428 3.446 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000130742706 1416440062 /nfs/dbraw/zinc/44/00/62/1416440062.db2.gz MLALAXYCNDXYTQ-BBRMVZONSA-N 0 0 396.490 3.424 20 5 GGBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000130749208 1416441750 /nfs/dbraw/zinc/44/17/50/1416441750.db2.gz BSYBNMPKLMJHCL-HNNXBMFYSA-N 0 0 377.832 3.364 20 5 GGBDRN Cc1ccccc1NC(=O)C[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 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CCS(=O)(=O)c1ccc2oc(COc3ccc(C)c([N+](=O)[O-])c3)nc2c1 ZINC000131641924 1416589175 /nfs/dbraw/zinc/58/91/75/1416589175.db2.gz OVVCZJNJVFYMAC-UHFFFAOYSA-N 0 0 376.390 3.417 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC(c3nncn3C(C)C)CC2)c1[N+](=O)[O-] ZINC000131660684 1416592211 /nfs/dbraw/zinc/59/22/11/1416592211.db2.gz UGWBYHCJGCRKOQ-UHFFFAOYSA-N 0 0 375.404 3.235 20 5 GGBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000131659181 1416592391 /nfs/dbraw/zinc/59/23/91/1416592391.db2.gz IZBHATVIZFYMSJ-NWDGAFQWSA-N 0 0 385.873 3.319 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000178572905 1429110541 /nfs/dbraw/zinc/11/05/41/1429110541.db2.gz FUBXMEIKFSVOAS-UHFFFAOYSA-N 0 0 391.374 3.211 20 5 GGBDRN Cc1cc(OC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)ccc1F ZINC000131673453 1416594667 /nfs/dbraw/zinc/59/46/67/1416594667.db2.gz LEGHCTWOGAXGIY-UHFFFAOYSA-N 0 0 383.335 3.116 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@@H](C)c2nc(-c3ccccc3)no2)c1[N+](=O)[O-] ZINC000131675615 1416595194 /nfs/dbraw/zinc/59/51/94/1416595194.db2.gz SFNLADCYEJDTSR-GFCCVEGCSA-N 0 0 397.391 3.432 20 5 GGBDRN O=C(Nc1ccc(CN2CCCC2=O)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000131683996 1416596665 /nfs/dbraw/zinc/59/66/65/1416596665.db2.gz MQVWVATYOUAMGY-UHFFFAOYSA-N 0 0 394.431 3.307 20 5 GGBDRN O=C(N[C@H](C(=O)NCc1ccccc1[N+](=O)[O-])c1ccccc1)c1ccccc1 ZINC000131687130 1416597144 /nfs/dbraw/zinc/59/71/44/1416597144.db2.gz DAPQTHQNTKSRIT-FQEVSTJZSA-N 0 0 389.411 3.382 20 5 GGBDRN COc1nn(C)c2nc(C)c(CCC(=O)Oc3ccc(C)c([N+](=O)[O-])c3)c(C)c12 ZINC000131699150 1416599316 /nfs/dbraw/zinc/59/93/16/1416599316.db2.gz CDSMLEBIYLCNTH-UHFFFAOYSA-N 0 0 398.419 3.349 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000131706818 1416601266 /nfs/dbraw/zinc/60/12/66/1416601266.db2.gz MLXFOPLVNDZWPW-MJGOQNOKSA-N 0 0 397.431 3.096 20 5 GGBDRN CCOC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000131716311 1416603533 /nfs/dbraw/zinc/60/35/33/1416603533.db2.gz LPSVTPLOQYBHOF-UHFFFAOYSA-N 0 0 386.282 3.313 20 5 GGBDRN COC(=O)c1csc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000131727745 1416605851 /nfs/dbraw/zinc/60/58/51/1416605851.db2.gz WPQLMWHDOGXHHM-UHFFFAOYSA-N 0 0 386.389 3.096 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc(F)cc2[N+](=O)[O-])c([N+](=O)[O-])c1 ZINC000131738938 1416608578 /nfs/dbraw/zinc/60/85/78/1416608578.db2.gz QBMCKHXOLCQURS-UHFFFAOYSA-N 0 0 376.344 3.183 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000131741218 1416608739 /nfs/dbraw/zinc/60/87/39/1416608739.db2.gz DUACXNBCXRDKQW-CQSZACIVSA-N 0 0 396.451 3.197 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCC[C@@H]1OCc1ccccc1 ZINC000131742294 1416609167 /nfs/dbraw/zinc/60/91/67/1416609167.db2.gz WBDJJUYQMBVVPA-HKUYNNGSSA-N 0 0 397.431 3.096 20 5 GGBDRN Cc1ccc(OC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC000131742937 1416609318 /nfs/dbraw/zinc/60/93/18/1416609318.db2.gz OLXOEKIWNJRWGO-UHFFFAOYSA-N 0 0 389.429 3.161 20 5 GGBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178578254 1429112239 /nfs/dbraw/zinc/11/22/39/1429112239.db2.gz SYGDHDWBFCGLNW-YJYMSZOUSA-N 0 0 398.394 3.162 20 5 GGBDRN COc1cc(CN2CCOC[C@@H]2c2cccn2C)c([N+](=O)[O-])cc1OC(F)F ZINC000131754365 1416612954 /nfs/dbraw/zinc/61/29/54/1416612954.db2.gz SERAORHRDYVZKG-OAHLLOKOSA-N 0 0 397.378 3.117 20 5 GGBDRN O=C(NCCc1ccc2c(c1)OCO2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000131755778 1416613134 /nfs/dbraw/zinc/61/31/34/1416613134.db2.gz KBUFSPIZHFNXOR-UHFFFAOYSA-N 0 0 383.404 3.240 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178578274 1429112489 /nfs/dbraw/zinc/11/24/89/1429112489.db2.gz SYGDHDWBFCGLNW-BFUOFWGJSA-N 0 0 398.394 3.162 20 5 GGBDRN O=C(c1ccc(F)cc1)[C@@H]1CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000131798455 1416623093 /nfs/dbraw/zinc/62/30/93/1416623093.db2.gz DZSPANQBLYMLLD-CYBMUJFWSA-N 0 0 396.378 3.345 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000131808123 1416626114 /nfs/dbraw/zinc/62/61/14/1416626114.db2.gz VYAQMHDQOONKGX-BZNIZROVSA-N 0 0 375.450 3.473 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000131807893 1416626119 /nfs/dbraw/zinc/62/61/19/1416626119.db2.gz VYAQMHDQOONKGX-ZBEGNZNMSA-N 0 0 375.450 3.473 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000131808352 1416626208 /nfs/dbraw/zinc/62/62/08/1416626208.db2.gz VYAQMHDQOONKGX-MEDUHNTESA-N 0 0 375.450 3.473 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)c1 ZINC000131824727 1416629944 /nfs/dbraw/zinc/62/99/44/1416629944.db2.gz WZQIQDRREINGOO-AWEZNQCLSA-N 0 0 385.203 3.374 20 5 GGBDRN CCOC(=O)c1ccnc(N2CC[C@@H](Oc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000131839218 1416632478 /nfs/dbraw/zinc/63/24/78/1416632478.db2.gz GERSRGFBWZTGTM-GFCCVEGCSA-N 0 0 391.811 3.478 20 5 GGBDRN Cc1ccc(OC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000131856121 1416635506 /nfs/dbraw/zinc/63/55/06/1416635506.db2.gz RMPIGYOTRCOHLR-UHFFFAOYSA-N 0 0 377.422 3.492 20 5 GGBDRN Cc1c(CC(=O)N(C)CC(=O)Nc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000178585742 1429114426 /nfs/dbraw/zinc/11/44/26/1429114426.db2.gz WZNGVMWIDVSSFM-UHFFFAOYSA-N 0 0 375.812 3.196 20 5 GGBDRN O=C(NC[C@H](O)c1c(Cl)cccc1Cl)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000131881692 1416640653 /nfs/dbraw/zinc/64/06/53/1416640653.db2.gz PZDKAQDDABBONE-ZDUSSCGKSA-N 0 0 395.202 3.241 20 5 GGBDRN O=C(N[C@H]1CCN(c2ncccc2F)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000131908174 1416648567 /nfs/dbraw/zinc/64/85/67/1416648567.db2.gz QDMUTVSOFYCVCF-LBPRGKRZSA-N 0 0 398.316 3.156 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ncccc2F)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000131908413 1416648973 /nfs/dbraw/zinc/64/89/73/1416648973.db2.gz QDMUTVSOFYCVCF-GFCCVEGCSA-N 0 0 398.316 3.156 20 5 GGBDRN CC(C)C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nccs1 ZINC000131953208 1416658172 /nfs/dbraw/zinc/65/81/72/1416658172.db2.gz DWGFJXKNVRFSLY-CYBMUJFWSA-N 0 0 377.426 3.226 20 5 GGBDRN CCCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@H]1C[C@@H](OCC)C12CCCC2 ZINC000132011544 1416672988 /nfs/dbraw/zinc/67/29/88/1416672988.db2.gz XGEJGSQOFSZPTP-JKSUJKDBSA-N 0 0 378.473 3.076 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)C[C@H](O)c2cccs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000132013666 1416673489 /nfs/dbraw/zinc/67/34/89/1416673489.db2.gz KLULDDHCGYAEPD-OTYXRUKQSA-N 0 0 379.394 3.115 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000132015515 1416674034 /nfs/dbraw/zinc/67/40/34/1416674034.db2.gz IHJBKDAKGRBWPO-GOSISDBHSA-N 0 0 387.392 3.197 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NCc1ccc(N2CCCCCC2)nc1 ZINC000132046809 1416682064 /nfs/dbraw/zinc/68/20/64/1416682064.db2.gz CQADDFOEJBYTCW-UHFFFAOYSA-N 0 0 386.427 3.368 20 5 GGBDRN CCOC(=O)CCc1ccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000132051862 1416682571 /nfs/dbraw/zinc/68/25/71/1416682571.db2.gz XSZFHSKAGVKZBC-UHFFFAOYSA-N 0 0 385.420 3.450 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000132096312 1416694977 /nfs/dbraw/zinc/69/49/77/1416694977.db2.gz YDEQTRHVQIVJCE-UHFFFAOYSA-N 0 0 399.451 3.197 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)C(=O)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000132110999 1416698264 /nfs/dbraw/zinc/69/82/64/1416698264.db2.gz CFRSCJXWPZMCMC-LBPRGKRZSA-N 0 0 378.454 3.383 20 5 GGBDRN Cn1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c1=O ZINC000132116937 1416700159 /nfs/dbraw/zinc/70/01/59/1416700159.db2.gz QZLLOXKOZCIQLI-UHFFFAOYSA-N 0 0 378.388 3.158 20 5 GGBDRN Cc1c(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cccc1C(F)(F)F ZINC000132118785 1416700360 /nfs/dbraw/zinc/70/03/60/1416700360.db2.gz PQQAERQJOAGEJK-UHFFFAOYSA-N 0 0 395.293 3.469 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)cc1 ZINC000132140163 1416706665 /nfs/dbraw/zinc/70/66/65/1416706665.db2.gz QHQRWKCOQODAIH-SFHVURJKSA-N 0 0 387.392 3.197 20 5 GGBDRN CC[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000132154928 1416708255 /nfs/dbraw/zinc/70/82/55/1416708255.db2.gz AWNKETLOJDXNFF-GXTWGEPZSA-N 0 0 376.331 3.223 20 5 GGBDRN CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Cl)nc1 ZINC000132155272 1416708483 /nfs/dbraw/zinc/70/84/83/1416708483.db2.gz HUFAALCEOUEWAC-UHFFFAOYSA-N 0 0 376.221 3.117 20 5 GGBDRN CC(C)(C)C(=O)NCc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000132179506 1416712600 /nfs/dbraw/zinc/71/26/00/1416712600.db2.gz QNJMVKZJGSNHKD-UHFFFAOYSA-N 0 0 381.432 3.460 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CNc3ccc(O[C@H]4CCOC4)cc3)n2)cc1 ZINC000132182735 1416713080 /nfs/dbraw/zinc/71/30/80/1416713080.db2.gz HYBAYUMWKVOPPB-KRWDZBQOSA-N 0 0 382.376 3.425 20 5 GGBDRN COC(=O)CCCc1csc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000132205938 1416717015 /nfs/dbraw/zinc/71/70/15/1416717015.db2.gz DBEFKUMILJKADO-UHFFFAOYSA-N 0 0 383.813 3.453 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000132208972 1416717234 /nfs/dbraw/zinc/71/72/34/1416717234.db2.gz DCGFPVQBOOFQAB-BLLLJJGKSA-N 0 0 386.433 3.084 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000132208771 1416717530 /nfs/dbraw/zinc/71/75/30/1416717530.db2.gz DCGFPVQBOOFQAB-WBMJQRKESA-N 0 0 386.433 3.084 20 5 GGBDRN O=C(N[C@@H](CCCO)c1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000132214351 1416718423 /nfs/dbraw/zinc/71/84/23/1416718423.db2.gz RMXXJMIJFOOPGF-IBGZPJMESA-N 0 0 397.475 3.441 20 5 GGBDRN Cc1ccc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)c(Br)n1 ZINC000132234102 1416721529 /nfs/dbraw/zinc/72/15/29/1416721529.db2.gz VXMVFYAXZLGZHD-UHFFFAOYSA-N 0 0 379.214 3.425 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CNc3ccc(O[C@@H]4CCOC4)cc3)n2)c1 ZINC000132236176 1416721610 /nfs/dbraw/zinc/72/16/10/1416721610.db2.gz OFNIOLILBDURGL-QGZVFWFLSA-N 0 0 382.376 3.425 20 5 GGBDRN O=C(NC1CCN(C(=O)Nc2ccccc2)CC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000132251622 1416724031 /nfs/dbraw/zinc/72/40/31/1416724031.db2.gz CRTZEFDJQNWYNN-UHFFFAOYSA-N 0 0 386.383 3.160 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc2c3c(cccc31)C(=O)N2C ZINC000132276245 1416727476 /nfs/dbraw/zinc/72/74/76/1416727476.db2.gz ZIAPHECIGIKYIK-UHFFFAOYSA-N 0 0 397.412 3.163 20 5 GGBDRN Cc1cnn(-c2ccc(S(=O)(=O)N(C)c3cccc([N+](=O)[O-])c3)cc2F)c1 ZINC000132275819 1416727513 /nfs/dbraw/zinc/72/75/13/1416727513.db2.gz YDRGOLJVKZQHRU-UHFFFAOYSA-N 0 0 390.396 3.053 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000132288738 1416729873 /nfs/dbraw/zinc/72/98/73/1416729873.db2.gz KYWSOAWTKFVHCI-LSDHHAIUSA-N 0 0 376.796 3.308 20 5 GGBDRN Cc1ccccc1OCCN(C)S(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC000132296069 1416730760 /nfs/dbraw/zinc/73/07/60/1416730760.db2.gz QUSNFWIQDLXODY-UHFFFAOYSA-N 0 0 382.413 3.050 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ccc(CC[NH+]3CCCC3)cc2)c(F)c1 ZINC000132317581 1416734960 /nfs/dbraw/zinc/73/49/60/1416734960.db2.gz NUPOXJKJCBVMIY-UHFFFAOYSA-N 0 0 393.440 3.173 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(Cn2cccn2)c1 ZINC000132318527 1416735173 /nfs/dbraw/zinc/73/51/73/1416735173.db2.gz ZZRWLVJFXVMJNC-UHFFFAOYSA-N 0 0 390.396 3.088 20 5 GGBDRN CCCCCCNC(=O)[C@H]1CCCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C1 ZINC000132330898 1416738162 /nfs/dbraw/zinc/73/81/62/1416738162.db2.gz RYLJRPCQZHWOAR-INIZCTEOSA-N 0 0 375.469 3.452 20 5 GGBDRN Cc1ccc2c(Cn3c(=O)onc3-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1C ZINC000132334029 1416738879 /nfs/dbraw/zinc/73/88/79/1416738879.db2.gz TUIOZFCSAZXIKR-UHFFFAOYSA-N 0 0 393.355 3.183 20 5 GGBDRN CCCCCCNC(=O)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000132335417 1416738980 /nfs/dbraw/zinc/73/89/80/1416738980.db2.gz OLFYMYGCJLDMIH-AWEZNQCLSA-N 0 0 379.432 3.283 20 5 GGBDRN CC(C)(C)c1ccccc1NC(=O)Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1 ZINC000132346754 1416742063 /nfs/dbraw/zinc/74/20/63/1416742063.db2.gz DMDBTDVSNXTSSA-UHFFFAOYSA-N 0 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Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000132379274 1416748877 /nfs/dbraw/zinc/74/88/77/1416748877.db2.gz WODVJKCEPPVXPE-GOSISDBHSA-N 0 0 399.472 3.376 20 5 GGBDRN COc1cc(Cn2c(=O)onc2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000132387929 1416750344 /nfs/dbraw/zinc/75/03/44/1416750344.db2.gz JEJXXHGWWYTXEY-UHFFFAOYSA-N 0 0 393.302 3.070 20 5 GGBDRN O=C(c1ccccc1COC1CCOCC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000132387332 1416750595 /nfs/dbraw/zinc/75/05/95/1416750595.db2.gz MACISVBXGDDQLD-UHFFFAOYSA-N 0 0 396.443 3.489 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1 ZINC000132398473 1416752652 /nfs/dbraw/zinc/75/26/52/1416752652.db2.gz FNMZVOHVDOIUQS-NSHDSACASA-N 0 0 395.412 3.063 20 5 GGBDRN CC[C@H]1CN(S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)c2ccccc2O1 ZINC000132409085 1416754559 /nfs/dbraw/zinc/75/45/59/1416754559.db2.gz RMFBPSDYVPEKML-LBPRGKRZSA-N 0 0 380.397 3.409 20 5 GGBDRN O=C(CCn1ccnc1)Nc1cccc(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000132427692 1416758122 /nfs/dbraw/zinc/75/81/22/1416758122.db2.gz XNCZTOQEURHCJO-UHFFFAOYSA-N 0 0 398.350 3.178 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000132428227 1416758171 /nfs/dbraw/zinc/75/81/71/1416758171.db2.gz JLDOUVMEXTVWLM-UHFFFAOYSA-N 0 0 376.800 3.272 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000132438297 1416760258 /nfs/dbraw/zinc/76/02/58/1416760258.db2.gz YZHJSHCDVWQETO-NSHDSACASA-N 0 0 395.412 3.063 20 5 GGBDRN O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000132453958 1416763613 /nfs/dbraw/zinc/76/36/13/1416763613.db2.gz CULCYRMMRGTFIR-WFASDCNBSA-N 0 0 390.383 3.398 20 5 GGBDRN COc1cc(CN[C@@]2(CO)CCc3ccccc32)c([N+](=O)[O-])cc1OC(F)F ZINC000132458900 1416764625 /nfs/dbraw/zinc/76/46/25/1416764625.db2.gz GPFPZCZIELSAIZ-LJQANCHMSA-N 0 0 394.374 3.128 20 5 GGBDRN COC(=O)CN(CCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000132469440 1416767817 /nfs/dbraw/zinc/76/78/17/1416767817.db2.gz DBZAFLNHLVAHTE-UHFFFAOYSA-N 0 0 376.796 3.106 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000132491138 1416772419 /nfs/dbraw/zinc/77/24/19/1416772419.db2.gz FSBMARUOSQOVPM-UHFFFAOYSA-N 0 0 381.348 3.260 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](CC(=O)Oc2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000132529126 1416779350 /nfs/dbraw/zinc/77/93/50/1416779350.db2.gz YRBLFYBCXMYULT-ZDUSSCGKSA-N 0 0 381.404 3.107 20 5 GGBDRN O=C(CCC(=O)N1CCc2sccc2C1)Oc1cc(F)cc([N+](=O)[O-])c1 ZINC000132546572 1416782473 /nfs/dbraw/zinc/78/24/73/1416782473.db2.gz AQVKNQUUYAPZPC-UHFFFAOYSA-N 0 0 378.381 3.066 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000132545648 1416782785 /nfs/dbraw/zinc/78/27/85/1416782785.db2.gz ZCDWLJIICHLVHW-QAPCUYQASA-N 0 0 385.376 3.462 20 5 GGBDRN Cc1cccc([C@@H](O)CNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])c1 ZINC000132554667 1416784583 /nfs/dbraw/zinc/78/45/83/1416784583.db2.gz UOZZFONTTHAFRY-HNNXBMFYSA-N 0 0 386.376 3.045 20 5 GGBDRN COc1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OCC(=O)NC1CC1 ZINC000178646264 1429128568 /nfs/dbraw/zinc/12/85/68/1429128568.db2.gz ODYJXKWUCGCDNM-ZDUSSCGKSA-N 0 0 385.420 3.434 20 5 GGBDRN CC(C)CCn1cc(C(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)nn1 ZINC000132569361 1416786427 /nfs/dbraw/zinc/78/64/27/1416786427.db2.gz WRZTWAUGMKDMEG-UHFFFAOYSA-N 0 0 385.380 3.244 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)CNc2ccccc2[N+](=O)[O-])n1 ZINC000132582916 1416788291 /nfs/dbraw/zinc/78/82/91/1416788291.db2.gz KIYGJNXBIYYXSQ-UHFFFAOYSA-N 0 0 379.420 3.126 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(C[C@H](O)CO[C@H]1CCCc3ccccc31)CC2 ZINC000132590327 1416789682 /nfs/dbraw/zinc/78/96/82/1416789682.db2.gz FQAQVUJAADGVLD-UNMCSNQZSA-N 0 0 382.460 3.408 20 5 GGBDRN O=[N+]([O-])c1nn(CNC2(c3ccc(F)cc3F)CCC2)cc1Br ZINC000132596566 1416790777 /nfs/dbraw/zinc/79/07/77/1416790777.db2.gz ZCBAVZHOYFSJHE-UHFFFAOYSA-N 0 0 387.184 3.459 20 5 GGBDRN O=C(Oc1cc(F)cc([N+](=O)[O-])c1)c1sccc1S(=O)(=O)C(F)F ZINC000132624428 1416795763 /nfs/dbraw/zinc/79/57/63/1416795763.db2.gz GBDLXUPAAIPEIZ-UHFFFAOYSA-N 0 0 381.309 3.011 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000132626009 1416796040 /nfs/dbraw/zinc/79/60/40/1416796040.db2.gz PXFQONBJLNQPHC-AUUYWEPGSA-N 0 0 394.431 3.237 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CNC1(c2ccc(F)cc2F)CCC1 ZINC000132630239 1416796433 /nfs/dbraw/zinc/79/64/33/1416796433.db2.gz WGDNFUSMIVDGOI-UHFFFAOYSA-N 0 0 375.331 3.407 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C12CCC2 ZINC000132648702 1416799637 /nfs/dbraw/zinc/79/96/37/1416799637.db2.gz ZACKMCBDPNVLTO-QZTJIDSGSA-N 0 0 384.436 3.200 20 5 GGBDRN O=C(Oc1cc(F)cc([N+](=O)[O-])c1)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1 ZINC000132648158 1416799650 /nfs/dbraw/zinc/79/96/50/1416799650.db2.gz YLRQUSTUHYLWJE-CYBMUJFWSA-N 0 0 390.342 3.331 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C12CCC2 ZINC000132648502 1416799743 /nfs/dbraw/zinc/79/97/43/1416799743.db2.gz ZACKMCBDPNVLTO-ROUUACIJSA-N 0 0 384.436 3.200 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C12CCC2 ZINC000132658969 1416801092 /nfs/dbraw/zinc/80/10/92/1416801092.db2.gz OKIJGHQZIYFZRJ-MSOLQXFVSA-N 0 0 384.436 3.200 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000132672877 1416802036 /nfs/dbraw/zinc/80/20/36/1416802036.db2.gz XVIAILBBMCJTNM-ZWKOTPCHSA-N 0 0 398.463 3.415 20 5 GGBDRN Cc1nc(NC(=O)c2ccc(NC(=O)N(C)C)cc2Cl)ccc1[N+](=O)[O-] ZINC000132680000 1416803197 /nfs/dbraw/zinc/80/31/97/1416803197.db2.gz WPYGCTRSJSVDCS-UHFFFAOYSA-N 0 0 377.788 3.297 20 5 GGBDRN CCC(CC)NC(=O)[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])c2ccccc2O1 ZINC000132691363 1416804480 /nfs/dbraw/zinc/80/44/80/1416804480.db2.gz ABXCAZCRFKTDJX-IBGZPJMESA-N 0 0 397.431 3.307 20 5 GGBDRN CN(C)C(=O)c1ccc(OC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000132703148 1416805752 /nfs/dbraw/zinc/80/57/52/1416805752.db2.gz SPOPQFDLMIFEMG-UHFFFAOYSA-N 0 0 393.193 3.278 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCc1cccc(COCC(F)(F)F)c1 ZINC000132711558 1416807005 /nfs/dbraw/zinc/80/70/05/1416807005.db2.gz VLJAKLOSKLUELR-UHFFFAOYSA-N 0 0 398.337 3.369 20 5 GGBDRN Cn1nnnc1-c1cccc(NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000132782437 1416814253 /nfs/dbraw/zinc/81/42/53/1416814253.db2.gz SFIXXXWWFHBMKU-UHFFFAOYSA-N 0 0 377.364 3.052 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C12CCC2 ZINC000132780161 1416814396 /nfs/dbraw/zinc/81/43/96/1416814396.db2.gz ZPHLOULFFDDELT-HZPDHXFCSA-N 0 0 377.397 3.231 20 5 GGBDRN O=C(Nc1ccc(F)cc1OCC1CC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000132804405 1416817257 /nfs/dbraw/zinc/81/72/57/1416817257.db2.gz PAPXLABEGKPKCH-UHFFFAOYSA-N 0 0 397.366 3.356 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(CNC3(c4cccc(F)c4)CCOCC3)n2)c1 ZINC000132812244 1416818169 /nfs/dbraw/zinc/81/81/69/1416818169.db2.gz FBDXHVOMLNRIQF-UHFFFAOYSA-N 0 0 397.410 3.245 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000132824692 1416819809 /nfs/dbraw/zinc/81/98/09/1416819809.db2.gz LHHRNPRWLZXDHG-LBPRGKRZSA-N 0 0 380.397 3.091 20 5 GGBDRN Cc1cc(Cl)ncc1NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000132829310 1416820564 /nfs/dbraw/zinc/82/05/64/1416820564.db2.gz UJTOCRDLTDVSJM-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000132837848 1416821555 /nfs/dbraw/zinc/82/15/55/1416821555.db2.gz HDLDRGZKAPZTQC-IEBWSBKVSA-N 0 0 384.436 3.226 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000132860419 1416824628 /nfs/dbraw/zinc/82/46/28/1416824628.db2.gz PJDWFRPQVDWPFV-CZUORRHYSA-N 0 0 377.466 3.477 20 5 GGBDRN CC1CCN(c2ccc(C(=O)Nc3nc4ccccn4n3)cc2[N+](=O)[O-])CC1 ZINC000132866372 1416824856 /nfs/dbraw/zinc/82/48/56/1416824856.db2.gz QKIMUAXAAGDGBA-UHFFFAOYSA-N 0 0 380.408 3.126 20 5 GGBDRN CC[C@@](C)(COc1ncccc1Cl)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000132887063 1416827066 /nfs/dbraw/zinc/82/70/66/1416827066.db2.gz YSSLPNRPVRMJQI-SFHVURJKSA-N 0 0 393.827 3.386 20 5 GGBDRN CC(C)N(Cc1nc2ccccc2c(=O)[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000132884541 1416827197 /nfs/dbraw/zinc/82/71/97/1416827197.db2.gz ZTWLMOJZIREEDQ-UHFFFAOYSA-N 0 0 381.392 3.274 20 5 GGBDRN COCCOc1ccccc1COC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000132884276 1416827277 /nfs/dbraw/zinc/82/72/77/1416827277.db2.gz ZFABUMBQBIKJSZ-UHFFFAOYSA-N 0 0 384.388 3.387 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cccc(N(C)C)c1 ZINC000132903411 1416829189 /nfs/dbraw/zinc/82/91/89/1416829189.db2.gz HPUKFGIURWRDJN-GFCCVEGCSA-N 0 0 377.828 3.398 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000132919574 1416831211 /nfs/dbraw/zinc/83/12/11/1416831211.db2.gz VCAUOJNUQNRXKM-MLGOLLRUSA-N 0 0 386.433 3.084 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000132919362 1416831278 /nfs/dbraw/zinc/83/12/78/1416831278.db2.gz VCAUOJNUQNRXKM-BLLLJJGKSA-N 0 0 386.433 3.084 20 5 GGBDRN O=C(Nc1ccc(-n2ccnn2)cc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000132941523 1416833847 /nfs/dbraw/zinc/83/38/47/1416833847.db2.gz GLCVTHURUOMBGZ-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN O=C(NCc1coc(-c2ccccc2)n1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000132982755 1416838597 /nfs/dbraw/zinc/83/85/97/1416838597.db2.gz RYSDBWUVPYFCPJ-UHFFFAOYSA-N 0 0 389.371 3.366 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133017249 1416842631 /nfs/dbraw/zinc/84/26/31/1416842631.db2.gz UAGLLUHTWWNGBU-QGZVFWFLSA-N 0 0 396.403 3.215 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000133021125 1416842878 /nfs/dbraw/zinc/84/28/78/1416842878.db2.gz OCWADVXVWSJTTF-HNNXBMFYSA-N 0 0 394.431 3.398 20 5 GGBDRN Cc1cccc(CN(CCn2cc([N+](=O)[O-])ccc2=O)Cc2ccccn2)c1 ZINC000133035362 1416844458 /nfs/dbraw/zinc/84/44/58/1416844458.db2.gz DEBWFRZUQMYSCE-UHFFFAOYSA-N 0 0 378.432 3.162 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CC[C@H](CO)CC3)cc2[N+](=O)[O-])C1 ZINC000133051190 1416846340 /nfs/dbraw/zinc/84/63/40/1416846340.db2.gz JTDVLPWQDAVFMB-NBOOPKSLSA-N 0 0 389.496 3.358 20 5 GGBDRN Cc1ccc(-c2nc(SCC(=O)NCCc3cccc([N+](=O)[O-])c3)n[nH]2)cc1 ZINC000133134523 1416855910 /nfs/dbraw/zinc/85/59/10/1416855910.db2.gz WWJOQCSKQZVTQD-UHFFFAOYSA-N 0 0 397.460 3.139 20 5 GGBDRN CC(C)(C)OC(=O)NC1(C(=O)NCCc2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000133155486 1416858488 /nfs/dbraw/zinc/85/84/88/1416858488.db2.gz VIRQUWFUARTZSJ-UHFFFAOYSA-N 0 0 391.468 3.481 20 5 GGBDRN CC(=O)CCc1ccc(O[C@H](C)C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000133170209 1416860255 /nfs/dbraw/zinc/86/02/55/1416860255.db2.gz LWSVTLOXORABDJ-MRXNPFEDSA-N 0 0 384.432 3.243 20 5 GGBDRN C[C@]1(C(=O)NCCc2cccc([N+](=O)[O-])c2)CCCN(C(=O)c2ccccc2)C1 ZINC000133173509 1416860460 /nfs/dbraw/zinc/86/04/60/1416860460.db2.gz IDBFLTKECNJZOS-QFIPXVFZSA-N 0 0 395.459 3.196 20 5 GGBDRN COc1cc(C(=O)Nc2sc3c(c2C(N)=O)CCCCC3)ccc1[N+](=O)[O-] ZINC000133183334 1416861966 /nfs/dbraw/zinc/86/19/66/1416861966.db2.gz WZTQNUJHZMSACY-UHFFFAOYSA-N 0 0 389.433 3.285 20 5 GGBDRN Cc1cc2c(cc1Br)N(C(=O)CCn1cc([N+](=O)[O-])cn1)CCC2 ZINC000133187044 1416862156 /nfs/dbraw/zinc/86/21/56/1416862156.db2.gz UNLNSQUTVGNFPI-UHFFFAOYSA-N 0 0 393.241 3.232 20 5 GGBDRN CCCc1nnc(Sc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])o1 ZINC000133188168 1416862233 /nfs/dbraw/zinc/86/22/33/1416862233.db2.gz HLXFZCNXOHNULC-UHFFFAOYSA-N 0 0 397.356 3.375 20 5 GGBDRN CC(C)(C)OC(=O)NCC1(C(=O)NCCc2cccc([N+](=O)[O-])c2)CCCC1 ZINC000133186058 1416862314 /nfs/dbraw/zinc/86/23/14/1416862314.db2.gz SXOVSJJFZFFSBV-UHFFFAOYSA-N 0 0 391.468 3.339 20 5 GGBDRN CC(C)c1c(C(=O)NCCc2cccc([N+](=O)[O-])c2)cnn1-c1ccccn1 ZINC000133207371 1416864322 /nfs/dbraw/zinc/86/43/22/1416864322.db2.gz SQKWTBRFVYELNQ-UHFFFAOYSA-N 0 0 379.420 3.271 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2ccccc2Cn2cccn2)c1[N+](=O)[O-] ZINC000133213422 1416865436 /nfs/dbraw/zinc/86/54/36/1416865436.db2.gz DXVPVEBPMRQKMK-UHFFFAOYSA-N 0 0 381.392 3.023 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cnn(-c3ccc(C(F)(F)F)cc3)c2)c1[N+](=O)[O-] ZINC000178678473 1429138160 /nfs/dbraw/zinc/13/81/60/1429138160.db2.gz VIIZVCZSZRNPCH-UHFFFAOYSA-N 0 0 394.313 3.337 20 5 GGBDRN CC(C)(C)NS(=O)(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000133238795 1416868832 /nfs/dbraw/zinc/86/88/32/1416868832.db2.gz GEBIWDIORCKHGR-UHFFFAOYSA-N 0 0 395.412 3.063 20 5 GGBDRN CCC1(CC)[C@@H](NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1OC ZINC000133246151 1416869643 /nfs/dbraw/zinc/86/96/43/1416869643.db2.gz WSIUSCNNFONNEC-IRXDYDNUSA-N 0 0 386.452 3.319 20 5 GGBDRN CCOC(=O)c1ccnc(NCCc2ccc(-n3cccn3)cc2)c1[N+](=O)[O-] ZINC000133256856 1416871010 /nfs/dbraw/zinc/87/10/10/1416871010.db2.gz KDGQDESWESWHEW-UHFFFAOYSA-N 0 0 381.392 3.007 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1CN1CCc2c(Cl)cccc2C1 ZINC000133255339 1416871075 /nfs/dbraw/zinc/87/10/75/1416871075.db2.gz OCIFFNILCZQOLH-UHFFFAOYSA-N 0 0 386.795 3.081 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133259547 1416871324 /nfs/dbraw/zinc/87/13/24/1416871324.db2.gz XKDPDBHWTWGUNM-QGZVFWFLSA-N 0 0 383.408 3.237 20 5 GGBDRN CCS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000133266201 1416871943 /nfs/dbraw/zinc/87/19/43/1416871943.db2.gz CFFBBHKXNPKRHP-UHFFFAOYSA-N 0 0 396.852 3.014 20 5 GGBDRN O=C(CN[C@H](c1ccccc1)C(F)(F)F)NCCc1cccc([N+](=O)[O-])c1 ZINC000133269354 1416872493 /nfs/dbraw/zinc/87/24/93/1416872493.db2.gz VUCWGINVBYFVNG-QGZVFWFLSA-N 0 0 381.354 3.147 20 5 GGBDRN C[C@@H]1CN(c2ccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1 ZINC000133278124 1416873475 /nfs/dbraw/zinc/87/34/75/1416873475.db2.gz HLXMTQYVUDZBPD-OKILXGFUSA-N 0 0 391.449 3.009 20 5 GGBDRN O=C(Nc1cccc(OCC(F)F)n1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000133276778 1416873537 /nfs/dbraw/zinc/87/35/37/1416873537.db2.gz WGIITTWJQORRDT-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN Cc1ccc(CNC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c(OC(C)(C)C)c1 ZINC000133285012 1416874423 /nfs/dbraw/zinc/87/44/23/1416874423.db2.gz BHUQPHNEUKKFII-UHFFFAOYSA-N 0 0 399.447 3.127 20 5 GGBDRN CC(C)[C@@H](C)N(C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000133299781 1416876108 /nfs/dbraw/zinc/87/61/08/1416876108.db2.gz IWSJYRUKDLHUIS-SNVBAGLBSA-N 0 0 385.367 3.170 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@@H]2c3ccccc3C[C@H]2O)CC1 ZINC000133305508 1416876523 /nfs/dbraw/zinc/87/65/23/1416876523.db2.gz NDMKIYDUYLSOAK-NHCUHLMSSA-N 0 0 395.459 3.219 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)CC1 ZINC000133305098 1416876612 /nfs/dbraw/zinc/87/66/12/1416876612.db2.gz NDMKIYDUYLSOAK-LEWJYISDSA-N 0 0 395.459 3.219 20 5 GGBDRN O=C([C@@H]1CCCN(CC(F)(F)F)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178679128 1429139404 /nfs/dbraw/zinc/13/94/04/1429139404.db2.gz AQPJPIVLRKWQOG-CQSZACIVSA-N 0 0 385.386 3.360 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1CN(CC1CCC1)CC(F)(F)F ZINC000133367615 1416882801 /nfs/dbraw/zinc/88/28/01/1416882801.db2.gz LKHNAKIXERICFD-UHFFFAOYSA-N 0 0 386.330 3.033 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(OCC(F)F)n2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000133375916 1416883708 /nfs/dbraw/zinc/88/37/08/1416883708.db2.gz DUJFWQMVTAZYGJ-UHFFFAOYSA-N 0 0 396.306 3.411 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000133378554 1416883887 /nfs/dbraw/zinc/88/38/87/1416883887.db2.gz SECGDIJRUQDNTI-ZFWWWQNUSA-N 0 0 377.441 3.360 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)N1CCCCC1=O ZINC000133392784 1416885586 /nfs/dbraw/zinc/88/55/86/1416885586.db2.gz RAJURYNZRJZHGQ-FQEVSTJZSA-N 0 0 381.432 3.007 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000178682985 1429139943 /nfs/dbraw/zinc/13/99/43/1429139943.db2.gz NQTFIVSCTZQGCX-QGZVFWFLSA-N 0 0 397.475 3.360 20 5 GGBDRN CC(C)Cc1nnc(NC(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000178684373 1429139960 /nfs/dbraw/zinc/13/99/60/1429139960.db2.gz SYNFBJVDXXLVLZ-UHFFFAOYSA-N 0 0 397.888 3.369 20 5 GGBDRN COc1ccc(OC(F)F)c(CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)c1 ZINC000133408559 1416887126 /nfs/dbraw/zinc/88/71/26/1416887126.db2.gz DUXNJOXOKRKXGF-UHFFFAOYSA-N 0 0 395.362 3.201 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000133419666 1416888036 /nfs/dbraw/zinc/88/80/36/1416888036.db2.gz DYHWEYRMSQWPLA-OAHLLOKOSA-N 0 0 397.475 3.370 20 5 GGBDRN C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000133419454 1416888080 /nfs/dbraw/zinc/88/80/80/1416888080.db2.gz DYHWEYRMSQWPLA-HNNXBMFYSA-N 0 0 397.475 3.370 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(CC(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000133425319 1416888622 /nfs/dbraw/zinc/88/86/22/1416888622.db2.gz NVDQFUDTPQYYMN-UHFFFAOYSA-N 0 0 391.468 3.291 20 5 GGBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1ccccc1Cl ZINC000133426459 1416888938 /nfs/dbraw/zinc/88/89/38/1416888938.db2.gz AQHKTGIEKQVSSQ-QGZVFWFLSA-N 0 0 377.828 3.432 20 5 GGBDRN CCC[C@@H](NC(=O)c1ccc(OCC)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000133490820 1416894965 /nfs/dbraw/zinc/89/49/65/1416894965.db2.gz QDWWZCQMRCRCHD-CQSZACIVSA-N 0 0 383.408 3.307 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1 ZINC000133507697 1416896618 /nfs/dbraw/zinc/89/66/18/1416896618.db2.gz UEXOQJXUUIBDBG-UHFFFAOYSA-N 0 0 376.173 3.482 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OS(=O)(=O)c2ccc(C(F)(F)F)cc2)c1 ZINC000133509295 1416896934 /nfs/dbraw/zinc/89/69/34/1416896934.db2.gz MTLJXWJEGAHKQB-UHFFFAOYSA-N 0 0 375.280 3.194 20 5 GGBDRN O=C(NC[C@H]1CCC[C@H](O)C1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000133513367 1416897058 /nfs/dbraw/zinc/89/70/58/1416897058.db2.gz NQIQIOVBIRTBRL-WPRPVWTQSA-N 0 0 391.649 3.292 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 ZINC000133514038 1416897100 /nfs/dbraw/zinc/89/71/00/1416897100.db2.gz FPSGQYSWZGRGIL-UHFFFAOYSA-N 0 0 376.173 3.482 20 5 GGBDRN O=C(NC[C@H]1CCC[C@@H](O)C1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000133513826 1416897116 /nfs/dbraw/zinc/89/71/16/1416897116.db2.gz NQIQIOVBIRTBRL-WCBMZHEXSA-N 0 0 391.649 3.292 20 5 GGBDRN CN(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)Cc1nc(-c2ccccc2)c[nH]1 ZINC000133513057 1416897185 /nfs/dbraw/zinc/89/71/85/1416897185.db2.gz RWPGAEOETDUWRB-UHFFFAOYSA-N 0 0 391.431 3.006 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cccc(OCC(F)F)n1 ZINC000133516628 1416897323 /nfs/dbraw/zinc/89/73/23/1416897323.db2.gz YVIOEPSKVIZVSD-UHFFFAOYSA-N 0 0 376.319 3.296 20 5 GGBDRN CCc1ccc([C@H](COC)NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)o1 ZINC000133540353 1416899766 /nfs/dbraw/zinc/89/97/66/1416899766.db2.gz UYDDHQSRSGPLKX-AWEZNQCLSA-N 0 0 377.353 3.084 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@@H]2CSCCS2)cc1[N+](=O)[O-] ZINC000133548230 1416901059 /nfs/dbraw/zinc/90/10/59/1416901059.db2.gz WYWGAHRNKOSPDC-SNVBAGLBSA-N 0 0 391.312 3.244 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000133557960 1416904000 /nfs/dbraw/zinc/90/40/00/1416904000.db2.gz ADTBKOXEWRRRFL-UKRRQHHQSA-N 0 0 377.441 3.360 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1Cn1nc(Br)nc1Br ZINC000178673389 1429135537 /nfs/dbraw/zinc/13/55/37/1429135537.db2.gz YGHDYPDEFPDILN-UHFFFAOYSA-N 0 0 396.426 3.413 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000133567806 1416905951 /nfs/dbraw/zinc/90/59/51/1416905951.db2.gz WJQHYSGCYQYJKF-GOEBONIOSA-N 0 0 391.468 3.289 20 5 GGBDRN CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000133612217 1416919206 /nfs/dbraw/zinc/91/92/06/1416919206.db2.gz QPJXIYYYXNKQGO-UGSOOPFHSA-N 0 0 396.447 3.236 20 5 GGBDRN CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000133612028 1416919404 /nfs/dbraw/zinc/91/94/04/1416919404.db2.gz QPJXIYYYXNKQGO-ACJLOTCBSA-N 0 0 396.447 3.236 20 5 GGBDRN Cc1nc(NC(=O)[C@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000133616006 1416920838 /nfs/dbraw/zinc/92/08/38/1416920838.db2.gz RAARVBHZRKWSPF-GUYCJALGSA-N 0 0 388.811 3.110 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2C[C@@H](C)O[C@@H](C)C2)c1=S ZINC000133660524 1416933344 /nfs/dbraw/zinc/93/33/44/1416933344.db2.gz GPVLTIOJJSAFST-BETUJISGSA-N 0 0 377.470 3.076 20 5 GGBDRN COc1ccccc1-c1noc([C@H](C)NC(=O)c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000133704414 1416946540 /nfs/dbraw/zinc/94/65/40/1416946540.db2.gz KXDXSPAYIQDHNM-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN O=C(Nc1ccccc1OCC1CC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000133708165 1416947878 /nfs/dbraw/zinc/94/78/78/1416947878.db2.gz XDHGYRRYHMMUHV-UHFFFAOYSA-N 0 0 379.376 3.217 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3ccc(F)cc3[N+](=O)[O-])n2)c1 ZINC000133708235 1416948411 /nfs/dbraw/zinc/94/84/11/1416948411.db2.gz ZYZUFYXRWHMJFB-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN O=C(Nc1ccccc1OCC1CC1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000133710233 1416949089 /nfs/dbraw/zinc/94/90/89/1416949089.db2.gz ITQVOULIJIOAGL-UHFFFAOYSA-N 0 0 397.431 3.473 20 5 GGBDRN 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ZINC000133766334 1416959557 /nfs/dbraw/zinc/95/95/57/1416959557.db2.gz DQOZVIBODHRWFX-HNNXBMFYSA-N 0 0 397.431 3.041 20 5 GGBDRN CCOCCC1(CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CCCC1 ZINC000133776223 1416961088 /nfs/dbraw/zinc/96/10/88/1416961088.db2.gz ZLBMSRXQAQYCEP-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN COc1cc(C(=O)N(Cc2cccs2)C[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000133778508 1416961878 /nfs/dbraw/zinc/96/18/78/1416961878.db2.gz YNJXSFNRLGBIKA-AWEZNQCLSA-N 0 0 376.434 3.486 20 5 GGBDRN C[C@@H]1CCC[C@@H](C)N(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000133787214 1416963621 /nfs/dbraw/zinc/96/36/21/1416963621.db2.gz QWEAVFCPYQRFCJ-MCIONIFRSA-N 0 0 379.482 3.298 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000133789478 1416963930 /nfs/dbraw/zinc/96/39/30/1416963930.db2.gz SQFWWUKZBXMIEB-GOSISDBHSA-N 0 0 396.403 3.150 20 5 GGBDRN Cc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)ccc1N1CCSCC1 ZINC000133815702 1416969570 /nfs/dbraw/zinc/96/95/70/1416969570.db2.gz RHBURKFNYBURHL-UHFFFAOYSA-N 0 0 393.490 3.257 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)o1 ZINC000133831190 1416972057 /nfs/dbraw/zinc/97/20/57/1416972057.db2.gz JBGHOLFJNTVAPU-INIZCTEOSA-N 0 0 389.364 3.181 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000133871142 1416983604 /nfs/dbraw/zinc/98/36/04/1416983604.db2.gz RBSHLAVXPOIDAN-IBGZPJMESA-N 0 0 389.839 3.458 20 5 GGBDRN C[C@@]1(c2cccs2)NC(=O)N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1=O ZINC000133876921 1416985539 /nfs/dbraw/zinc/98/55/39/1416985539.db2.gz LOLZMUMRHJVSJY-SFHVURJKSA-N 0 0 398.400 3.279 20 5 GGBDRN CN(CCO)C(=O)NCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1 ZINC000133908473 1416992261 /nfs/dbraw/zinc/99/22/61/1416992261.db2.gz SBIPOQHRRJAOSI-UHFFFAOYSA-N 0 0 397.790 3.313 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC000133959359 1417001837 /nfs/dbraw/zinc/00/18/37/1417001837.db2.gz GZAAGSXQPGTGNO-UHFFFAOYSA-N 0 0 392.249 3.018 20 5 GGBDRN Cc1nc(NC(=O)[C@H](C(C)C)S(=O)(=O)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000133971612 1417003293 /nfs/dbraw/zinc/00/32/93/1417003293.db2.gz WXNLXRQHXPMARV-INIZCTEOSA-N 0 0 383.470 3.009 20 5 GGBDRN O=C(COc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC(=O)Nc1ccccc1 ZINC000133974333 1417003811 /nfs/dbraw/zinc/00/38/11/1417003811.db2.gz BFQQEBBWCSEYNN-UHFFFAOYSA-N 0 0 383.282 3.341 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000133994720 1417006761 /nfs/dbraw/zinc/00/67/61/1417006761.db2.gz AXCJGBHAAJVFCI-CJNGLKHVSA-N 0 0 391.468 3.350 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)c3ccc(F)cc3[N+](=O)[O-])ccc2NC1=O ZINC000133992797 1417006930 /nfs/dbraw/zinc/00/69/30/1417006930.db2.gz CGJIOQBQAIDNMC-QLJPJBMISA-N 0 0 387.367 3.334 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000133994545 1417007023 /nfs/dbraw/zinc/00/70/23/1417007023.db2.gz AXCJGBHAAJVFCI-XJKSGUPXSA-N 0 0 391.468 3.350 20 5 GGBDRN Cc1nc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])ccc1[N+](=O)[O-] ZINC000133993996 1417007037 /nfs/dbraw/zinc/00/70/37/1417007037.db2.gz WQEUTOSCGXTBOM-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN O=C(COc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCO[C@@H]2CCCC[C@H]21 ZINC000133997601 1417007828 /nfs/dbraw/zinc/00/78/28/1417007828.db2.gz JFQBKXCOHOGXOX-TZMCWYRMSA-N 0 0 388.342 3.162 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000133997717 1417007877 /nfs/dbraw/zinc/00/78/77/1417007877.db2.gz NORYDRVTWUZNSB-SFHVURJKSA-N 0 0 396.403 3.150 20 5 GGBDRN Cc1nc(NC(=O)c2ccc(CN3C[C@@H](C)O[C@@H](C)C3)cc2)ccc1[N+](=O)[O-] ZINC000133998406 1417007911 /nfs/dbraw/zinc/00/79/11/1417007911.db2.gz PDWMROGYHYHJCQ-OKILXGFUSA-N 0 0 384.436 3.160 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1[N+](=O)[O-] ZINC000134005806 1417008971 /nfs/dbraw/zinc/00/89/71/1417008971.db2.gz JDKPYZLNNPYOBV-UHFFFAOYSA-N 0 0 392.818 3.049 20 5 GGBDRN 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O=C(Nc1ccc(Br)nc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134057237 1417015682 /nfs/dbraw/zinc/01/56/82/1417015682.db2.gz UNVCIPSDOOTHFQ-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@H]3CCCCO3)cc2[N+](=O)[O-])CC1 ZINC000134085190 1417020219 /nfs/dbraw/zinc/02/02/19/1417020219.db2.gz VGINUMBYGBRTIF-QGZVFWFLSA-N 0 0 375.469 3.472 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(NC(=O)c3ccco3)cc2)ccc1[N+](=O)[O-] ZINC000134092309 1417021101 /nfs/dbraw/zinc/02/11/01/1417021101.db2.gz ZQUGWTUBRHKHAE-UHFFFAOYSA-N 0 0 395.371 3.379 20 5 GGBDRN CN(c1ccccc1)c1ccc(CNc2ccn(CCC(N)=O)n2)cc1[N+](=O)[O-] ZINC000134098480 1417022111 /nfs/dbraw/zinc/02/21/11/1417022111.db2.gz MFCREARTIVKLJX-UHFFFAOYSA-N 0 0 394.435 3.047 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N(C)C[C@H]3CCCCO3)cc2)c(C)c1[N+](=O)[O-] ZINC000134129793 1417026412 /nfs/dbraw/zinc/02/64/12/1417026412.db2.gz NTNLMCBMTQSQNP-GOSISDBHSA-N 0 0 386.452 3.098 20 5 GGBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000134158598 1417031251 /nfs/dbraw/zinc/03/12/51/1417031251.db2.gz NUYKQXKKIWHLDS-QGZVFWFLSA-N 0 0 380.408 3.098 20 5 GGBDRN Cc1cc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)ccc1C(=O)N(C)C ZINC000134163737 1417031696 /nfs/dbraw/zinc/03/16/96/1417031696.db2.gz YEDVZYREPVRWIL-UHFFFAOYSA-N 0 0 382.420 3.195 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccnc(-n2cccn2)c1 ZINC000134173109 1417032872 /nfs/dbraw/zinc/03/28/72/1417032872.db2.gz HOZRZUDEUGWZSV-UHFFFAOYSA-N 0 0 375.291 3.029 20 5 GGBDRN Cc1cccc(OS(=O)(=O)c2ccc(Br)s2)c1[N+](=O)[O-] ZINC000134200278 1417036946 /nfs/dbraw/zinc/03/69/46/1417036946.db2.gz FNVRGRVTBKRNKO-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CCNc2ccc([N+](=O)[O-])c(C)n2)s1 ZINC000134201944 1417037545 /nfs/dbraw/zinc/03/75/45/1417037545.db2.gz TUDUCHGJGVIUSA-UHFFFAOYSA-N 0 0 398.510 3.045 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000134226892 1417040930 /nfs/dbraw/zinc/04/09/30/1417040930.db2.gz HWDBCTSRXZUKGL-ZDUSSCGKSA-N 0 0 381.404 3.205 20 5 GGBDRN O=c1c2cc(F)c(F)cc2ncn1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134245040 1417043421 /nfs/dbraw/zinc/04/34/21/1417043421.db2.gz SZIFVQAHAPCMOF-UHFFFAOYSA-N 0 0 384.298 3.286 20 5 GGBDRN CCOCc1ccccc1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134250615 1417044104 /nfs/dbraw/zinc/04/41/04/1417044104.db2.gz NJZFQLZIRSAWHS-UHFFFAOYSA-N 0 0 380.404 3.247 20 5 GGBDRN Cc1ccnc([C@@H](NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)n1 ZINC000134254698 1417044510 /nfs/dbraw/zinc/04/45/10/1417044510.db2.gz IRLSUKJTNGBVCF-ZBEGNZNMSA-N 0 0 390.827 3.381 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnc(-c2ccc(Cl)cc2)s1 ZINC000134257160 1417044788 /nfs/dbraw/zinc/04/47/88/1417044788.db2.gz GNPSONUSZLPIAF-UHFFFAOYSA-N 0 0 392.828 3.300 20 5 GGBDRN COc1ccc(C)cc1[C@@]1(C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2F)C1=O ZINC000134272695 1417047693 /nfs/dbraw/zinc/04/76/93/1417047693.db2.gz NIQLXHNDGBUPMM-LJQANCHMSA-N 0 0 387.367 3.018 20 5 GGBDRN 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O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCCN(c2ccccc2)CC1 ZINC000134345224 1417057943 /nfs/dbraw/zinc/05/79/43/1417057943.db2.gz UYMZCXYQKSNCCX-UHFFFAOYSA-N 0 0 391.431 3.133 20 5 GGBDRN C[C@H](CC(=O)OCc1ccccc1)NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000178733422 1429155585 /nfs/dbraw/zinc/15/55/85/1429155585.db2.gz QYPXPIKHFSNMPW-CABCVRRESA-N 0 0 385.420 3.477 20 5 GGBDRN C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1 ZINC000134452956 1417070088 /nfs/dbraw/zinc/07/00/88/1417070088.db2.gz VLDMKQMMJJCOKN-AWEZNQCLSA-N 0 0 395.419 3.290 20 5 GGBDRN C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1 ZINC000134452981 1417070296 /nfs/dbraw/zinc/07/02/96/1417070296.db2.gz VLDMKQMMJJCOKN-CQSZACIVSA-N 0 0 395.419 3.290 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(-n2cccn2)n1 ZINC000134466303 1417073007 /nfs/dbraw/zinc/07/30/07/1417073007.db2.gz TYOJWKKNFFIIAI-UHFFFAOYSA-N 0 0 375.291 3.029 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)C[C@H](C)O1 ZINC000134471830 1417073791 /nfs/dbraw/zinc/07/37/91/1417073791.db2.gz QRNZFLQGJSHRDP-AOOOYVTPSA-N 0 0 399.234 3.337 20 5 GGBDRN Cc1ocnc1CNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000134477924 1417074801 /nfs/dbraw/zinc/07/48/01/1417074801.db2.gz PVKQQVQXMBIGTM-UHFFFAOYSA-N 0 0 396.190 3.314 20 5 GGBDRN Nc1c(C(=O)Nc2nnc(/C=C/c3ccco3)s2)cc(F)cc1[N+](=O)[O-] ZINC000134483475 1417075158 /nfs/dbraw/zinc/07/51/58/1417075158.db2.gz ZKFWZEYBUDNTLL-ONEGZZNKSA-N 0 0 375.341 3.183 20 5 GGBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134499955 1417077373 /nfs/dbraw/zinc/07/73/73/1417077373.db2.gz RKAXJGCSVKNQAC-YJYMSZOUSA-N 0 0 398.394 3.162 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134499997 1417077455 /nfs/dbraw/zinc/07/74/55/1417077455.db2.gz RKAXJGCSVKNQAC-BFUOFWGJSA-N 0 0 398.394 3.162 20 5 GGBDRN CC[C@@H](O)CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000134505409 1417078157 /nfs/dbraw/zinc/07/81/57/1417078157.db2.gz BBJWSLYKTDUNIO-GOSISDBHSA-N 0 0 382.420 3.418 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)C[C@H](O)c2ccc(F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000134559336 1417087100 /nfs/dbraw/zinc/08/71/00/1417087100.db2.gz NSUALIVWIQMILI-BTDLBPIBSA-N 0 0 391.355 3.193 20 5 GGBDRN O=C(c1ccccc1)N1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000134565809 1417087895 /nfs/dbraw/zinc/08/78/95/1417087895.db2.gz UJSWCCXBPVIKEY-UHFFFAOYSA-N 0 0 387.823 3.237 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N(C)c1ccccn1 ZINC000134577878 1417090611 /nfs/dbraw/zinc/09/06/11/1417090611.db2.gz CEMQMONGWHUKAY-INIZCTEOSA-N 0 0 390.827 3.061 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000134592461 1417093662 /nfs/dbraw/zinc/09/36/62/1417093662.db2.gz LDKCPRDRFSALQF-BFUOFWGJSA-N 0 0 398.394 3.162 20 5 GGBDRN CCN1CCc2ccc(NC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)cc21 ZINC000134601479 1417094805 /nfs/dbraw/zinc/09/48/05/1417094805.db2.gz XXFMGJOSXOLOGR-UHFFFAOYSA-N 0 0 377.404 3.415 20 5 GGBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000134602771 1417094956 /nfs/dbraw/zinc/09/49/56/1417094956.db2.gz CCIWFCWESZUXTN-PXAZEXFGSA-N 0 0 378.425 3.454 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccc(F)cc1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000134602747 1417095085 /nfs/dbraw/zinc/09/50/85/1417095085.db2.gz CCIWFCWESZUXTN-SJCJKPOMSA-N 0 0 378.425 3.454 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCOC3(CCCCC3)C2)c1C ZINC000134662759 1417108069 /nfs/dbraw/zinc/10/80/69/1417108069.db2.gz QNMAVOPAZAKUJE-OAHLLOKOSA-N 0 0 382.482 3.372 20 5 GGBDRN Cc1nc(N2CCOCC2)ccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000134668079 1417110720 /nfs/dbraw/zinc/11/07/20/1417110720.db2.gz KMOMFWXMCLPJFB-UHFFFAOYSA-N 0 0 376.800 3.041 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 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375.816 3.194 20 5 GGBDRN Cn1c(CCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)nc2ccc(F)cc21 ZINC000134889729 1417140232 /nfs/dbraw/zinc/14/02/32/1417140232.db2.gz GTOXTGFSUPZGBI-UHFFFAOYSA-N 0 0 376.775 3.247 20 5 GGBDRN O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134907181 1417142252 /nfs/dbraw/zinc/14/22/52/1417142252.db2.gz UKRUYNAPJOOLBQ-HNNXBMFYSA-N 0 0 384.436 3.392 20 5 GGBDRN O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134907159 1417142349 /nfs/dbraw/zinc/14/23/49/1417142349.db2.gz UKRUYNAPJOOLBQ-OAHLLOKOSA-N 0 0 384.436 3.392 20 5 GGBDRN CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134923391 1417145922 /nfs/dbraw/zinc/14/59/22/1417145922.db2.gz QYCLXCHEXJNASS-LBPRGKRZSA-N 0 0 381.860 3.263 20 5 GGBDRN COc1ccccc1OC[C@@H](C)CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134977662 1417155961 /nfs/dbraw/zinc/15/59/61/1417155961.db2.gz TXWBSDZJKNOIEX-AWEZNQCLSA-N 0 0 397.431 3.459 20 5 GGBDRN 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ZINC000149986560 1417782919 /nfs/dbraw/zinc/78/29/19/1417782919.db2.gz BJCSIYMMNXRFPW-APWZRJJASA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1cccc(C(=O)NCC2(c3ccc4c(c3)OCO4)CCOCC2)c1[N+](=O)[O-] ZINC000150120809 1417785310 /nfs/dbraw/zinc/78/53/10/1417785310.db2.gz NEQDVSBRBMSZSI-UHFFFAOYSA-N 0 0 398.415 3.110 20 5 GGBDRN Cc1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)n(-c2cc(C)nc(C)n2)n1 ZINC000150693967 1417788850 /nfs/dbraw/zinc/78/88/50/1417788850.db2.gz XXPXYDJJLVJPFJ-UHFFFAOYSA-N 0 0 386.799 3.401 20 5 GGBDRN CC[C@](C)(NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1nc(C)cs1 ZINC000150735407 1417794177 /nfs/dbraw/zinc/79/41/77/1417794177.db2.gz HGFHOJQCNHRUBF-SFHVURJKSA-N 0 0 386.433 3.256 20 5 GGBDRN CC(C)CC1(CNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)CC1 ZINC000150744881 1417796424 /nfs/dbraw/zinc/79/64/24/1417796424.db2.gz KRGLMRSZMLGWMX-UHFFFAOYSA-N 0 0 389.481 3.431 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2NC1=O ZINC000150757506 1417801236 /nfs/dbraw/zinc/80/12/36/1417801236.db2.gz WKGRVDPSOHFUGO-CYBMUJFWSA-N 0 0 391.387 3.016 20 5 GGBDRN COc1cc(S(=O)(=O)Oc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000150769817 1417803742 /nfs/dbraw/zinc/80/37/42/1417803742.db2.gz ZGSPGKCZIZQYBX-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H](c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000150795343 1417808077 /nfs/dbraw/zinc/80/80/77/1417808077.db2.gz ODUDQIDHDPGAAE-AWEZNQCLSA-N 0 0 390.339 3.185 20 5 GGBDRN COc1cc(S(=O)(=O)N(C2CC2)[C@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000150798126 1417808744 /nfs/dbraw/zinc/80/87/44/1417808744.db2.gz VSDSZWBXFYCTNL-KRWDZBQOSA-N 0 0 388.445 3.444 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000150798409 1417809097 /nfs/dbraw/zinc/80/90/97/1417809097.db2.gz HVMWTEKUZUUVJP-AWEZNQCLSA-N 0 0 397.406 3.490 20 5 GGBDRN C[C@H]1CCC[C@H](C)N(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000150804542 1417810461 /nfs/dbraw/zinc/81/04/61/1417810461.db2.gz NOQJOLBWCQBBQT-KBPBESRZSA-N 0 0 375.425 3.320 20 5 GGBDRN CCN(Cc1c(F)cccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000150807406 1417810735 /nfs/dbraw/zinc/81/07/35/1417810735.db2.gz HLYHLBFCSVZQJQ-UHFFFAOYSA-N 0 0 386.376 3.092 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c1[N+](=O)[O-] ZINC000150809113 1417811297 /nfs/dbraw/zinc/81/12/97/1417811297.db2.gz FEKFEDBGOUEJQS-HNNXBMFYSA-N 0 0 391.786 3.231 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H](C)c2nc(C(C)(C)C)cs2)ccc1[N+](=O)[O-] ZINC000150811180 1417811526 /nfs/dbraw/zinc/81/15/26/1417811526.db2.gz HFXCXUBGPLPVHZ-JTQLQIEISA-N 0 0 399.494 3.397 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)[C@H]2CCCc3nc(C)sc32)ccc1[N+](=O)[O-] ZINC000150813444 1417812036 /nfs/dbraw/zinc/81/20/36/1417812036.db2.gz HEQHWJFRPULDHD-AWEZNQCLSA-N 0 0 397.478 3.066 20 5 GGBDRN COc1cc(S(=O)(=O)N(CCc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000150814735 1417812644 /nfs/dbraw/zinc/81/26/44/1417812644.db2.gz KQTKZMCDYSDZCF-UHFFFAOYSA-N 0 0 394.424 3.138 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000150815505 1417813047 /nfs/dbraw/zinc/81/30/47/1417813047.db2.gz ZGGBMWLWTRDONZ-HIFRSBDPSA-N 0 0 376.434 3.170 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)s1 ZINC000150819138 1417813418 /nfs/dbraw/zinc/81/34/18/1417813418.db2.gz JGYMDNWKAJXQFG-LLVKDONJSA-N 0 0 399.494 3.312 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCCC[C@@H]2c2ccc(C)o2)ccc1[N+](=O)[O-] ZINC000150820225 1417813746 /nfs/dbraw/zinc/81/37/46/1417813746.db2.gz VMOZFKJEMLAEDT-CQSZACIVSA-N 0 0 380.422 3.421 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000150824425 1417814562 /nfs/dbraw/zinc/81/45/62/1417814562.db2.gz TVUCQKRXSIXSAZ-WFASDCNBSA-N 0 0 380.422 3.358 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(CCC(=O)N2CCCC2)cc1 ZINC000150823753 1417814662 /nfs/dbraw/zinc/81/46/62/1417814662.db2.gz KACRKUBJHRXYFM-UHFFFAOYSA-N 0 0 399.422 3.470 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000150833231 1417816149 /nfs/dbraw/zinc/81/61/49/1417816149.db2.gz LBEPVTWBBCGYGX-CJNGLKHVSA-N 0 0 376.434 3.170 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000150835373 1417816630 /nfs/dbraw/zinc/81/66/30/1417816630.db2.gz DYHPAGLBRHZLPY-STQMWFEESA-N 0 0 395.431 3.499 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CC2)c1[N+](=O)[O-] ZINC000150836464 1417816843 /nfs/dbraw/zinc/81/68/43/1417816843.db2.gz OAABRMJDJPXHHP-CQSZACIVSA-N 0 0 381.404 3.075 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000150848694 1417820211 /nfs/dbraw/zinc/82/02/11/1417820211.db2.gz APFODBHWNACLHM-GDBMZVCRSA-N 0 0 391.468 3.289 20 5 GGBDRN Cc1cccc(-n2nc(-c3ccco3)cc2NC(=O)Cn2ccc([N+](=O)[O-])n2)c1 ZINC000150852913 1417821191 /nfs/dbraw/zinc/82/11/91/1417821191.db2.gz DCXNMPQYSBCKCV-UHFFFAOYSA-N 0 0 392.375 3.184 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(COCc2ccccc2)cc1 ZINC000150858897 1417822208 /nfs/dbraw/zinc/82/22/08/1417822208.db2.gz BEKSKKHPJOXJMK-UHFFFAOYSA-N 0 0 380.404 3.455 20 5 GGBDRN CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000150866754 1417823817 /nfs/dbraw/zinc/82/38/17/1417823817.db2.gz WELCDIMQJMWEPX-ZDUSSCGKSA-N 0 0 376.434 3.339 20 5 GGBDRN Cn1cc(C(=O)Nc2ccc(OC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)cn1 ZINC000150870503 1417824530 /nfs/dbraw/zinc/82/45/30/1417824530.db2.gz BRGXFMAOTMKQGI-UHFFFAOYSA-N 0 0 394.387 3.119 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000150871427 1417825053 /nfs/dbraw/zinc/82/50/53/1417825053.db2.gz JPASRJBUMBFQBR-HOCLYGCPSA-N 0 0 391.468 3.289 20 5 GGBDRN CN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000178893286 1429212971 /nfs/dbraw/zinc/21/29/71/1429212971.db2.gz UVIIPTSFLSRUNC-OAHLLOKOSA-N 0 0 384.816 3.348 20 5 GGBDRN CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000150878694 1417826572 /nfs/dbraw/zinc/82/65/72/1417826572.db2.gz HZUJSMLHNDITME-SFHVURJKSA-N 0 0 384.432 3.207 20 5 GGBDRN Cn1ccnc1-c1cccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000150878357 1417826612 /nfs/dbraw/zinc/82/66/12/1417826612.db2.gz HRMBSAZASSAHGY-UHFFFAOYSA-N 0 0 380.408 3.229 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)C[C@H](O)C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000150887250 1417828113 /nfs/dbraw/zinc/82/81/13/1417828113.db2.gz YBHLJBLBFUAGCC-DJJJIMSYSA-N 0 0 384.436 3.006 20 5 GGBDRN CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000150894243 1417829285 /nfs/dbraw/zinc/82/92/85/1417829285.db2.gz RYCZLBMWKKMKML-INIZCTEOSA-N 0 0 388.395 3.417 20 5 GGBDRN O=C(NCCCO[C@H]1CCOC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000150902079 1417831150 /nfs/dbraw/zinc/83/11/50/1417831150.db2.gz IQMHNEIEMFSFRB-SFHVURJKSA-N 0 0 399.447 3.132 20 5 GGBDRN CC(C)Sc1ccc([C@H](C)NC(=O)NCCn2cc([N+](=O)[O-])cn2)cc1 ZINC000150902437 1417831193 /nfs/dbraw/zinc/83/11/93/1417831193.db2.gz SVQNXICNOXBKGJ-ZDUSSCGKSA-N 0 0 377.470 3.352 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)CCC(=O)OC(C)(C)C ZINC000150907081 1417832386 /nfs/dbraw/zinc/83/23/86/1417832386.db2.gz YONGZDGCNOBRDU-NSHDSACASA-N 0 0 385.848 3.239 20 5 GGBDRN C[C@H]1COCCN1c1ccc(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1 ZINC000150922665 1417835827 /nfs/dbraw/zinc/83/58/27/1417835827.db2.gz ZMDAFLWHEOKCOI-ZDUSSCGKSA-N 0 0 382.420 3.448 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000150926403 1417836541 /nfs/dbraw/zinc/83/65/41/1417836541.db2.gz BKYKSQDEOVTJHJ-LLVKDONJSA-N 0 0 398.202 3.296 20 5 GGBDRN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C)n2)C1 ZINC000150935480 1417839022 /nfs/dbraw/zinc/83/90/22/1417839022.db2.gz QLMRZEKXPIGRQA-ZDUSSCGKSA-N 0 0 388.390 3.316 20 5 GGBDRN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C)n2)C1 ZINC000150935436 1417839029 /nfs/dbraw/zinc/83/90/29/1417839029.db2.gz QLMRZEKXPIGRQA-CYBMUJFWSA-N 0 0 388.390 3.316 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCC2(CCCC2)CC1 ZINC000150938619 1417839807 /nfs/dbraw/zinc/83/98/07/1417839807.db2.gz LHOPVUIHYPONPF-UHFFFAOYSA-N 0 0 387.436 3.466 20 5 GGBDRN CC(C)c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n(-c2ncccn2)n1 ZINC000150939609 1417840238 /nfs/dbraw/zinc/84/02/38/1417840238.db2.gz WZKPPYRYJFMUHE-UHFFFAOYSA-N 0 0 380.408 3.265 20 5 GGBDRN CC[C@H](c1ccc(F)cc1F)S(=O)(=O)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000150956639 1417843818 /nfs/dbraw/zinc/84/38/18/1417843818.db2.gz WXDQMKQXHHUJGD-MRXNPFEDSA-N 0 0 398.387 3.038 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1ncc(-c2ccccc2F)o1 ZINC000150959073 1417844126 /nfs/dbraw/zinc/84/41/26/1417844126.db2.gz YTUVEGIDZUENMS-UHFFFAOYSA-N 0 0 382.307 3.254 20 5 GGBDRN O=C(O[C@H]([C@H]1CCCO1)C(F)(F)F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178897438 1429214185 /nfs/dbraw/zinc/21/41/85/1429214185.db2.gz UTCWNUFPUCZOBS-ZIAGYGMSSA-N 0 0 385.298 3.047 20 5 GGBDRN COc1cccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000178897130 1429214289 /nfs/dbraw/zinc/21/42/89/1429214289.db2.gz WCDRTZPHKBGRSH-HNNXBMFYSA-N 0 0 384.310 3.086 20 5 GGBDRN O=C(O[C@@H]([C@H]1CCCO1)C(F)(F)F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178897428 1429214365 /nfs/dbraw/zinc/21/43/65/1429214365.db2.gz UTCWNUFPUCZOBS-KGLIPLIRSA-N 0 0 385.298 3.047 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN1C(=O)OCc1ccccc1 ZINC000150984864 1417849610 /nfs/dbraw/zinc/84/96/10/1417849610.db2.gz ULHCZCXFENQTGS-SFHVURJKSA-N 0 0 383.404 3.012 20 5 GGBDRN Cn1cc(CCC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc21 ZINC000150987834 1417850281 /nfs/dbraw/zinc/85/02/81/1417850281.db2.gz GORKOOSHDVJIMJ-UHFFFAOYSA-N 0 0 392.459 3.368 20 5 GGBDRN O=C(Nc1ccc2c(c1)NC(=O)CC2)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000150990058 1417850766 /nfs/dbraw/zinc/85/07/66/1417850766.db2.gz ZJBABMRXRYIPKW-UHFFFAOYSA-N 0 0 380.404 3.332 20 5 GGBDRN COc1ccc(OCCSc2nccn2Cc2ccccn2)c([N+](=O)[O-])c1 ZINC000151045806 1417861673 /nfs/dbraw/zinc/86/16/73/1417861673.db2.gz IOQXQTSAJMPXMX-UHFFFAOYSA-N 0 0 386.433 3.414 20 5 GGBDRN Cn1ccnc1[C@@H](CCc1ccccc1)OC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000151049368 1417861998 /nfs/dbraw/zinc/86/19/98/1417861998.db2.gz UDDYJJDMVSWMIJ-GOSISDBHSA-N 0 0 380.404 3.441 20 5 GGBDRN Cc1ccc(CNC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c(OC(C)C)c1 ZINC000151056236 1417863678 /nfs/dbraw/zinc/86/36/78/1417863678.db2.gz MFUDTEGGUQJEAZ-HNNXBMFYSA-N 0 0 399.447 3.125 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000151067140 1417866151 /nfs/dbraw/zinc/86/61/51/1417866151.db2.gz GLMQTPFYFXYWDC-GOSISDBHSA-N 0 0 399.472 3.376 20 5 GGBDRN COc1ccc(C(C)(C)C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1OC ZINC000151071526 1417867124 /nfs/dbraw/zinc/86/71/24/1417867124.db2.gz DDXPUCXGTFQMEV-UHFFFAOYSA-N 0 0 384.432 3.475 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1C(=O)OCc1ccccc1 ZINC000151074949 1417867507 /nfs/dbraw/zinc/86/75/07/1417867507.db2.gz QEVFZAFIUZGIET-LJQANCHMSA-N 0 0 382.416 3.262 20 5 GGBDRN CC[C@](C)(NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1)c1nc(C)cs1 ZINC000151082606 1417869042 /nfs/dbraw/zinc/86/90/42/1417869042.db2.gz YXXGLDCPYHMJCD-KRWDZBQOSA-N 0 0 379.438 3.189 20 5 GGBDRN CC(C)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)OCCO2 ZINC000151098272 1417871982 /nfs/dbraw/zinc/87/19/82/1417871982.db2.gz ZNXGHTUBBQEPKF-UHFFFAOYSA-N 0 0 388.395 3.142 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccccc1CN1CCSCC1 ZINC000151120548 1417876335 /nfs/dbraw/zinc/87/63/35/1417876335.db2.gz MYZIQVBODOLFNK-UHFFFAOYSA-N 0 0 389.452 3.464 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000151130843 1417878393 /nfs/dbraw/zinc/87/83/93/1417878393.db2.gz SADQMWAOUJZXET-MRXNPFEDSA-N 0 0 387.823 3.103 20 5 GGBDRN CCc1sc(=O)n(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1-c1ccccc1 ZINC000151137688 1417879938 /nfs/dbraw/zinc/87/99/38/1417879938.db2.gz YQRZWBMAXDGKFR-UHFFFAOYSA-N 0 0 383.429 3.195 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCc1ccc(Cl)nc1 ZINC000151181159 1417889166 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IHMQTXLZLYLNMQ-GFCCVEGCSA-N 0 0 385.445 3.342 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(F)c1 ZINC000151222994 1417896699 /nfs/dbraw/zinc/89/66/99/1417896699.db2.gz CHLOLOTZLKLDQT-OAHLLOKOSA-N 0 0 380.759 3.422 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(F)c1 ZINC000151224044 1417896781 /nfs/dbraw/zinc/89/67/81/1417896781.db2.gz QRNPDRDHYLVQNX-MRXNPFEDSA-N 0 0 394.786 3.350 20 5 GGBDRN CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000151248259 1417903045 /nfs/dbraw/zinc/90/30/45/1417903045.db2.gz UULOPAIWPSVHBK-OAHLLOKOSA-N 0 0 399.447 3.127 20 5 GGBDRN COC(=O)CN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCC1 ZINC000151250863 1417903727 /nfs/dbraw/zinc/90/37/27/1417903727.db2.gz VYWAHDFBDWBWMI-UHFFFAOYSA-N 0 0 389.433 3.276 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000151260379 1417907204 /nfs/dbraw/zinc/90/72/04/1417907204.db2.gz WWHQGWGWCUXYNM-HNNXBMFYSA-N 0 0 399.422 3.325 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCCC2CCN(CC(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000151264810 1417908618 /nfs/dbraw/zinc/90/86/18/1417908618.db2.gz BFMUJFRLJZYGTC-UHFFFAOYSA-N 0 0 391.365 3.437 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)OCCc2ccccc2[N+](=O)[O-])cc1 ZINC000151268253 1417909201 /nfs/dbraw/zinc/90/92/01/1417909201.db2.gz RRSHPXHPBXISNK-LJQANCHMSA-N 0 0 382.416 3.180 20 5 GGBDRN O=C(COC(=O)Cc1ccc([N+](=O)[O-])cc1Br)Nc1ccccc1 ZINC000151275858 1417911849 /nfs/dbraw/zinc/91/18/49/1417911849.db2.gz DBDYOTGIRUVHEF-UHFFFAOYSA-N 0 0 393.193 3.082 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCC([C@H](O)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000151278996 1417912543 /nfs/dbraw/zinc/91/25/43/1417912543.db2.gz ZOPNWDSUOJESOP-NHYWBVRUSA-N 0 0 389.374 3.309 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C3CCCCC3)C2=O)cc1[N+](=O)[O-] ZINC000151279406 1417912908 /nfs/dbraw/zinc/91/29/08/1417912908.db2.gz IROUUJLYVUMWBK-YOEHRIQHSA-N 0 0 388.468 3.197 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)cc1[N+](=O)[O-] ZINC000151279260 1417912987 /nfs/dbraw/zinc/91/29/87/1417912987.db2.gz IROUUJLYVUMWBK-WMLDXEAASA-N 0 0 388.468 3.197 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(C3CCCCC3)C2=O)cc1[N+](=O)[O-] ZINC000151279327 1417913042 /nfs/dbraw/zinc/91/30/42/1417913042.db2.gz IROUUJLYVUMWBK-PBHICJAKSA-N 0 0 388.468 3.197 20 5 GGBDRN C[C@@H](NC(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178906128 1429216692 /nfs/dbraw/zinc/21/66/92/1429216692.db2.gz ORJSBMLCZIIYFZ-XPGWFJOJSA-N 0 0 399.447 3.190 20 5 GGBDRN Cc1csc(CCCNC(=O)c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000151313492 1417923703 /nfs/dbraw/zinc/92/37/03/1417923703.db2.gz PKVXIQCTCPLJAC-UHFFFAOYSA-N 0 0 384.255 3.485 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)C[C@@H](O)c2cccs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000151314464 1417924033 /nfs/dbraw/zinc/92/40/33/1417924033.db2.gz CEMWHNZKKUDJAE-LKFCYVNXSA-N 0 0 393.421 3.423 20 5 GGBDRN CC(C)CC1(CNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CCC1 ZINC000151344924 1417931167 /nfs/dbraw/zinc/93/11/67/1417931167.db2.gz CKIMCOVKRWBQFF-UHFFFAOYSA-N 0 0 379.482 3.118 20 5 GGBDRN COC(=O)c1[nH]c(C)c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1C ZINC000151354343 1417934318 /nfs/dbraw/zinc/93/43/18/1417934318.db2.gz KWSPAHWBOJCCAR-UHFFFAOYSA-N 0 0 379.800 3.252 20 5 GGBDRN CCC(=O)N1CC[C@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2)C1 ZINC000151364302 1417937300 /nfs/dbraw/zinc/93/73/00/1417937300.db2.gz HVBCNHJUXAQWIQ-KRWDZBQOSA-N 0 0 381.432 3.387 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nc(-c3ccc4c(c3)CCO4)no2)ccc1-n1ccnc1 ZINC000178927469 1429222180 /nfs/dbraw/zinc/22/21/80/1429222180.db2.gz GIALBSALVSLGJJ-UHFFFAOYSA-N 0 0 375.344 3.432 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000178925932 1429222449 /nfs/dbraw/zinc/22/24/49/1429222449.db2.gz WRCBTLIQJRGWOP-UHFFFAOYSA-N 0 0 386.769 3.108 20 5 GGBDRN CC(=O)CCc1ccc(OS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000178929146 1429222893 /nfs/dbraw/zinc/22/28/93/1429222893.db2.gz KJUIOEHJSHHBLP-UHFFFAOYSA-N 0 0 377.418 3.068 20 5 GGBDRN COc1ccc([C@H]2CCCN2S(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000178932900 1429223846 /nfs/dbraw/zinc/22/38/46/1429223846.db2.gz YHLLGPHWMICYGG-GOSISDBHSA-N 0 0 390.461 3.313 20 5 GGBDRN CC(C)(COc1ccc(C(F)(F)F)cn1)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000151436764 1417968414 /nfs/dbraw/zinc/96/84/14/1417968414.db2.gz ZAJGEBGIAHDGFH-UHFFFAOYSA-N 0 0 398.341 3.178 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(Cc2ccc(F)cc2)C2CC2)cc1 ZINC000178935242 1429224059 /nfs/dbraw/zinc/22/40/59/1429224059.db2.gz FBUKWZJOHNBWCW-UHFFFAOYSA-N 0 0 378.425 3.271 20 5 GGBDRN O=C(NCCc1ccc(-c2ccccc2)cc1)NCCn1cc([N+](=O)[O-])cn1 ZINC000151443938 1417971176 /nfs/dbraw/zinc/97/11/76/1417971176.db2.gz OUNNKZJZNYKDKS-UHFFFAOYSA-N 0 0 379.420 3.000 20 5 GGBDRN Cc1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(Br)n1 ZINC000151442810 1417971797 /nfs/dbraw/zinc/97/17/97/1417971797.db2.gz LMXNIDCLONNUNY-UHFFFAOYSA-N 0 0 379.214 3.425 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000178936324 1429224877 /nfs/dbraw/zinc/22/48/77/1429224877.db2.gz WJOGDZPCARPPCY-MRXNPFEDSA-N 0 0 396.465 3.433 20 5 GGBDRN CCOC(=O)c1cc(N[C@H]2CCN(C3CCCCC3)C2=O)ccc1[N+](=O)[O-] ZINC000151459519 1417981590 /nfs/dbraw/zinc/98/15/90/1417981590.db2.gz QGSHLZWWWPJLQJ-INIZCTEOSA-N 0 0 375.425 3.117 20 5 GGBDRN C[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000151461938 1417983178 /nfs/dbraw/zinc/98/31/78/1417983178.db2.gz NJZHYMIEIGKKEO-MEDUHNTESA-N 0 0 382.342 3.420 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1F ZINC000151466006 1417984645 /nfs/dbraw/zinc/98/46/45/1417984645.db2.gz JCHUSEMPVIATFP-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c1[N+](=O)[O-] ZINC000151474397 1417989324 /nfs/dbraw/zinc/98/93/24/1417989324.db2.gz LRLVTZHOICCNQF-OAHLLOKOSA-N 0 0 391.786 3.231 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CC2 ZINC000151480441 1417993584 /nfs/dbraw/zinc/99/35/84/1417993584.db2.gz ZINQMMUHKGWUER-ROUUACIJSA-N 0 0 390.480 3.284 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CC2 ZINC000151480517 1417993847 /nfs/dbraw/zinc/99/38/47/1417993847.db2.gz ZINQMMUHKGWUER-QZTJIDSGSA-N 0 0 390.480 3.284 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000151488434 1417999428 /nfs/dbraw/zinc/99/94/28/1417999428.db2.gz YDMNAGCBIVLZDE-HNNXBMFYSA-N 0 0 379.210 3.129 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000151489618 1418000172 /nfs/dbraw/zinc/00/01/72/1418000172.db2.gz HVXYIUCMLKGKNQ-OAHLLOKOSA-N 0 0 379.420 3.328 20 5 GGBDRN Cc1ccc([C@H](O)CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cc1 ZINC000151505562 1418006666 /nfs/dbraw/zinc/00/66/66/1418006666.db2.gz NNOWCDSFAABFSY-MRXNPFEDSA-N 0 0 393.237 3.438 20 5 GGBDRN Cn1cc(C(=O)N2CCc3ccc(F)cc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000151519884 1418011475 /nfs/dbraw/zinc/01/14/75/1418011475.db2.gz LGOKYSXVWQIYPI-UHFFFAOYSA-N 0 0 380.379 3.333 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NCCc1coc(-c2ccc(F)cc2)n1 ZINC000151532183 1418015664 /nfs/dbraw/zinc/01/56/64/1418015664.db2.gz JXAJYXMXBPRIKF-UHFFFAOYSA-N 0 0 387.342 3.429 20 5 GGBDRN Cc1ccccc1[C@@H](O)CNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000151541864 1418019299 /nfs/dbraw/zinc/01/92/99/1418019299.db2.gz BMAGSIDWWUYUKM-INIZCTEOSA-N 0 0 393.237 3.438 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H](O)c2ccsc2)cc1[N+](=O)[O-] ZINC000151553868 1418022345 /nfs/dbraw/zinc/02/23/45/1418022345.db2.gz ULUIGSIRRGEYQH-ZDUSSCGKSA-N 0 0 385.239 3.191 20 5 GGBDRN Cc1nc(CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)sc1C ZINC000151555725 1418023535 /nfs/dbraw/zinc/02/35/35/1418023535.db2.gz ALFLVCNAXBTUFK-UHFFFAOYSA-N 0 0 388.493 3.243 20 5 GGBDRN O=C(Nc1ccc(-c2cc[nH]n2)cc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000151652058 1418050710 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MHJMGVFQPFIZBA-IMJJTQAJSA-N 0 0 385.445 3.406 20 5 GGBDRN CC(C)(C)C[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccc(F)cc1 ZINC000151730309 1418073522 /nfs/dbraw/zinc/07/35/22/1418073522.db2.gz HSMVCHOUKXMGFW-MRXNPFEDSA-N 0 0 377.420 3.407 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@H]3C[C@H](O)c3ccco3)n2)c1 ZINC000151740662 1418075626 /nfs/dbraw/zinc/07/56/26/1418075626.db2.gz UYFDGQVVCCRTQM-HOCLYGCPSA-N 0 0 384.392 3.326 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000151757859 1418079985 /nfs/dbraw/zinc/07/99/85/1418079985.db2.gz YKBHORWJGLMJDX-LJQANCHMSA-N 0 0 379.420 3.491 20 5 GGBDRN C[C@@H]1CCN(C)c2ccccc2N1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000151762401 1418081107 /nfs/dbraw/zinc/08/11/07/1418081107.db2.gz VENRDIVILLETFB-GFCCVEGCSA-N 0 0 379.413 3.158 20 5 GGBDRN COc1ccc(S(=O)(=O)N2c3ccccc3N(C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000151765175 1418081877 /nfs/dbraw/zinc/08/18/77/1418081877.db2.gz FVYRKRCWGNSHDM-ZDUSSCGKSA-N 0 0 391.449 3.027 20 5 GGBDRN C[C@H]1CCN(C)c2ccccc2N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000151764243 1418081954 /nfs/dbraw/zinc/08/19/54/1418081954.db2.gz DTQOKJSEWUKXHX-LBPRGKRZSA-N 0 0 379.413 3.158 20 5 GGBDRN COCCC1(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])CCC1 ZINC000151828631 1418096167 /nfs/dbraw/zinc/09/61/67/1418096167.db2.gz UPOHQNYBUSPZIC-UHFFFAOYSA-N 0 0 390.358 3.473 20 5 GGBDRN CCOC(=O)CC[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000178981795 1429233860 /nfs/dbraw/zinc/23/38/60/1429233860.db2.gz DWYVYLUAMYEZIE-CABCVRRESA-N 0 0 377.441 3.421 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000151949850 1418101954 /nfs/dbraw/zinc/10/19/54/1418101954.db2.gz CNTPZAATNDFCIG-AWEZNQCLSA-N 0 0 375.454 3.053 20 5 GGBDRN CCOC(=O)CC[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000178981774 1429233976 /nfs/dbraw/zinc/23/39/76/1429233976.db2.gz DWYVYLUAMYEZIE-GJZGRUSLSA-N 0 0 377.441 3.421 20 5 GGBDRN O=C(CN1CCC[C@@H]1C[C@H](O)c1ccco1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000151964222 1418107459 /nfs/dbraw/zinc/10/74/59/1418107459.db2.gz OCTPGZRRMBNAOR-CJNGLKHVSA-N 0 0 393.827 3.368 20 5 GGBDRN O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C\c1cc(O)ccc1Br ZINC000178984841 1429234350 /nfs/dbraw/zinc/23/43/50/1429234350.db2.gz PMTZVOJQCJTBDE-ZSOIEALJSA-N 0 0 389.161 3.407 20 5 GGBDRN COc1ccc(C(C)(C)C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000151994765 1418115789 /nfs/dbraw/zinc/11/57/89/1418115789.db2.gz LDNWCKSOEQAZFT-UHFFFAOYSA-N 0 0 383.448 3.230 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000151995499 1418116033 /nfs/dbraw/zinc/11/60/33/1418116033.db2.gz FCMGPBJSPYJAEM-UHFFFAOYSA-N 0 0 394.431 3.324 20 5 GGBDRN C[C@H]1COCCN1c1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000152001108 1418117023 /nfs/dbraw/zinc/11/70/23/1418117023.db2.gz LNSKEFAAEQLMNE-HNNXBMFYSA-N 0 0 384.436 3.261 20 5 GGBDRN CC(C)c1nncn1CCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000152017992 1418121771 /nfs/dbraw/zinc/12/17/71/1418121771.db2.gz PWWKZHSCMATRPE-UHFFFAOYSA-N 0 0 394.435 3.483 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N(C)CCCOc2cccc(S(C)(=O)=O)c2)c1 ZINC000152019109 1418122289 /nfs/dbraw/zinc/12/22/89/1418122289.db2.gz WMEUUSWYINLVQD-UHFFFAOYSA-N 0 0 378.450 3.212 20 5 GGBDRN COc1ccc(CSCC(=O)NC[C@@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000152026003 1418124313 /nfs/dbraw/zinc/12/43/13/1418124313.db2.gz VYQCKBVPMOBZMR-LLVKDONJSA-N 0 0 393.465 3.361 20 5 GGBDRN Cc1ccc(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OCC1CCOCC1 ZINC000152028017 1418124784 /nfs/dbraw/zinc/12/47/84/1418124784.db2.gz NOGDJYQRADLPHD-UHFFFAOYSA-N 0 0 399.447 3.420 20 5 GGBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000152044995 1418129206 /nfs/dbraw/zinc/12/92/06/1418129206.db2.gz PHVQCLWVEUAERK-VXGBXAGGSA-N 0 0 378.812 3.469 20 5 GGBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000152045181 1418129273 /nfs/dbraw/zinc/12/92/73/1418129273.db2.gz PHVQCLWVEUAERK-NEPJUHHUSA-N 0 0 378.812 3.469 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1ccc(C(=O)N2CCCCC2)cc1 ZINC000152055269 1418132172 /nfs/dbraw/zinc/13/21/72/1418132172.db2.gz FSUFUFDAIZQFLK-UHFFFAOYSA-N 0 0 395.459 3.470 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1cnn(-c2ccccc2F)c1 ZINC000152065324 1418134812 /nfs/dbraw/zinc/13/48/12/1418134812.db2.gz CYHMANOPXBAFLZ-UHFFFAOYSA-N 0 0 384.371 3.153 20 5 GGBDRN O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Br)Nc1ccccc1 ZINC000152066497 1418135919 /nfs/dbraw/zinc/13/59/19/1418135919.db2.gz YJSWYJPRCFFJFS-UHFFFAOYSA-N 0 0 379.166 3.153 20 5 GGBDRN CC(C)(C)CNC(=O)c1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000152080756 1418139396 /nfs/dbraw/zinc/13/93/96/1418139396.db2.gz LLSSYHVHJGZZSU-UHFFFAOYSA-N 0 0 383.448 3.343 20 5 GGBDRN CC(C)C(=O)N(C)Cc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000152084043 1418140534 /nfs/dbraw/zinc/14/05/34/1418140534.db2.gz FAKBUNVQEXKLML-UHFFFAOYSA-N 0 0 383.448 3.182 20 5 GGBDRN CCc1ccc(C(=O)N2CCOC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000152097028 1418144659 /nfs/dbraw/zinc/14/46/59/1418144659.db2.gz RSIUHCQEEMFUER-HNNXBMFYSA-N 0 0 388.445 3.333 20 5 GGBDRN Cc1ccn(C)c(=O)c1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000152099905 1418145483 /nfs/dbraw/zinc/14/54/83/1418145483.db2.gz QEGPVARODYSIGJ-ZIAGYGMSSA-N 0 0 398.463 3.337 20 5 GGBDRN CC(C)C[C@H]1CCCN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000152102284 1418145786 /nfs/dbraw/zinc/14/57/86/1418145786.db2.gz STVXLBHIUMUUHJ-CYBMUJFWSA-N 0 0 381.860 3.263 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCOCC34CCC4)cc2[N+](=O)[O-])C1 ZINC000152112608 1418148387 /nfs/dbraw/zinc/14/83/87/1418148387.db2.gz UUPWNAWTRNPBTF-HOTGVXAUSA-N 0 0 387.480 3.472 20 5 GGBDRN O=C(c1coc(-c2ccccc2)n1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000152113760 1418149043 /nfs/dbraw/zinc/14/90/43/1418149043.db2.gz DFFTZSLCERZTQT-UHFFFAOYSA-N 0 0 378.388 3.212 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C12CCC2 ZINC000152130053 1418152474 /nfs/dbraw/zinc/15/24/74/1418152474.db2.gz JSNVWGHOUCHLTN-RBUKOAKNSA-N 0 0 387.480 3.275 20 5 GGBDRN CC[C@H]1CN(C)c2ccccc2CN1C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000152136472 1418154632 /nfs/dbraw/zinc/15/46/32/1418154632.db2.gz PRRKKNRKGHVIGN-KRWDZBQOSA-N 0 0 385.468 3.055 20 5 GGBDRN Cc1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1 ZINC000152138755 1418155472 /nfs/dbraw/zinc/15/54/72/1418155472.db2.gz PUTHGYHIFFVREZ-LJQANCHMSA-N 0 0 384.432 3.320 20 5 GGBDRN CSCC[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000152147018 1418157261 /nfs/dbraw/zinc/15/72/61/1418157261.db2.gz KGRITTJSXRBRPX-INIZCTEOSA-N 0 0 399.476 3.181 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000178997995 1429238692 /nfs/dbraw/zinc/23/86/92/1429238692.db2.gz RVYDCIFGNZHKTO-ZDUSSCGKSA-N 0 0 384.360 3.471 20 5 GGBDRN Cn1cnnc1-c1cccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000152174904 1418165033 /nfs/dbraw/zinc/16/50/33/1418165033.db2.gz MTPZSIQTSLYODB-UHFFFAOYSA-N 0 0 376.376 3.053 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000152182664 1418167417 /nfs/dbraw/zinc/16/74/17/1418167417.db2.gz ONWMXYDBRVVQSH-DOTOQJQBSA-N 0 0 387.480 3.371 20 5 GGBDRN CC(C)c1ccc(C[C@H](C)NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000152204665 1418172670 /nfs/dbraw/zinc/17/26/70/1418172670.db2.gz JLNNQKJMVJMKRY-AWEZNQCLSA-N 0 0 397.431 3.374 20 5 GGBDRN COc1ccccc1COC[C@@H](O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000152208816 1418173622 /nfs/dbraw/zinc/17/36/22/1418173622.db2.gz CHDILXWKKVBHIO-IBGZPJMESA-N 0 0 383.404 3.045 20 5 GGBDRN Cc1cc(N2CCOCC2)ccc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000152211563 1418174032 /nfs/dbraw/zinc/17/40/32/1418174032.db2.gz WNRHCRZWUABUQK-UHFFFAOYSA-N 0 0 394.431 3.402 20 5 GGBDRN CC(=O)c1ccc(OC[C@@H](O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000152212700 1418174761 /nfs/dbraw/zinc/17/47/61/1418174761.db2.gz MTWMIBFTIRDJGU-IBGZPJMESA-N 0 0 381.388 3.101 20 5 GGBDRN 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COc1ccc2c(c1)OC[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000152267998 1418189792 /nfs/dbraw/zinc/18/97/92/1418189792.db2.gz IEMJDIHCGLPAAC-MRXNPFEDSA-N 0 0 382.416 3.346 20 5 GGBDRN Cc1ccc(-n2c(Sc3ncc([N+](=O)[O-])c(N)n3)nnc2-c2ccco2)cc1 ZINC000152270261 1418189987 /nfs/dbraw/zinc/18/99/87/1418189987.db2.gz GVNBBWAWRBYOMH-UHFFFAOYSA-N 0 0 395.404 3.267 20 5 GGBDRN CC(C)n1cnnc1SCC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152277405 1418192317 /nfs/dbraw/zinc/19/23/17/1418192317.db2.gz CIPZSNSOJLQMRY-UHFFFAOYSA-N 0 0 375.454 3.051 20 5 GGBDRN CCN(CC(=O)Nc1ccccc1OC)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152297835 1418198520 /nfs/dbraw/zinc/19/85/20/1418198520.db2.gz BXJLAJZOIYAWNF-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cc(F)cc(F)c2)c(C(F)(F)F)c1 ZINC000179025110 1429244906 /nfs/dbraw/zinc/24/49/06/1429244906.db2.gz MCMVORJWRWFUOT-UHFFFAOYSA-N 0 0 396.293 3.370 20 5 GGBDRN Cn1cc(OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cn1 ZINC000179024629 1429244934 /nfs/dbraw/zinc/24/49/34/1429244934.db2.gz KOFKVFUBSOPCBY-UHFFFAOYSA-N 0 0 398.341 3.169 20 5 GGBDRN C[C@@H]1c2cccn2CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000179023703 1429244995 /nfs/dbraw/zinc/24/49/95/1429244995.db2.gz GFIWZKKFVDMLLW-SNVBAGLBSA-N 0 0 389.355 3.181 20 5 GGBDRN COCc1cccc(S(=O)(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000179043386 1429248420 /nfs/dbraw/zinc/24/84/20/1429248420.db2.gz RETYTGZLCUIBMA-UHFFFAOYSA-N 0 0 376.434 3.095 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN(C1CC1)S(=O)(=O)c1cccc2cnccc21 ZINC000179042961 1429248520 /nfs/dbraw/zinc/24/85/20/1429248520.db2.gz YXFWAZLXCLJHGW-UHFFFAOYSA-N 0 0 383.429 3.496 20 5 GGBDRN C[C@@H](NC(=O)NCCOc1ncccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000179071935 1429255127 /nfs/dbraw/zinc/25/51/27/1429255127.db2.gz AMMPRPOITRKTNE-LLVKDONJSA-N 0 0 398.341 3.448 20 5 GGBDRN C[C@H]1CN(c2ccc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)cn2)C[C@H](C)O1 ZINC000179093001 1429260724 /nfs/dbraw/zinc/26/07/24/1429260724.db2.gz OHGMKUYZTGICCO-GJZGRUSLSA-N 0 0 396.447 3.196 20 5 GGBDRN COC(=O)c1cc(OC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000179113788 1429266215 /nfs/dbraw/zinc/26/62/15/1429266215.db2.gz ZUOCJLRHPWGLCE-ZDUSSCGKSA-N 0 0 399.321 3.383 20 5 GGBDRN COC(=O)c1cc(OC[C@@H](O)c2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000179113838 1429266368 /nfs/dbraw/zinc/26/63/68/1429266368.db2.gz OVTBCVQDNQCLKF-OAHLLOKOSA-N 0 0 396.193 3.256 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000179115811 1429267558 /nfs/dbraw/zinc/26/75/58/1429267558.db2.gz ILCZOVBFFUHDHI-CQSZACIVSA-N 0 0 387.436 3.290 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000179120616 1429268689 /nfs/dbraw/zinc/26/86/89/1429268689.db2.gz IIHRIFWKJVWCCO-SFHVURJKSA-N 0 0 394.431 3.194 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCO1 ZINC000179154429 1429279930 /nfs/dbraw/zinc/27/99/30/1429279930.db2.gz JPXJTYMOCUOLCF-SECBINFHSA-N 0 0 377.622 3.262 20 5 GGBDRN O=C(OCc1nc(C(F)(F)F)cs1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000179162671 1429282561 /nfs/dbraw/zinc/28/25/61/1429282561.db2.gz RMNDKXHHWQWNIY-UHFFFAOYSA-N 0 0 399.310 3.008 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000179166140 1429282909 /nfs/dbraw/zinc/28/29/09/1429282909.db2.gz GOVPPNKUVWDHIM-IBGZPJMESA-N 0 0 396.378 3.133 20 5 GGBDRN O=C(NCCc1cscn1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000179169910 1429283905 /nfs/dbraw/zinc/28/39/05/1429283905.db2.gz FRRJIYMYBGWWNH-UHFFFAOYSA-N 0 0 390.646 3.440 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000179174294 1429285929 /nfs/dbraw/zinc/28/59/29/1429285929.db2.gz NOTKMHNHERCAPV-IBGZPJMESA-N 0 0 377.441 3.248 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc(-c2ncco2)c1)c1cccc([N+](=O)[O-])c1 ZINC000179175983 1429285936 /nfs/dbraw/zinc/28/59/36/1429285936.db2.gz NQBPFUUJUJHDOC-LBPRGKRZSA-N 0 0 380.360 3.066 20 5 GGBDRN CCOC(=O)c1ccccc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179197651 1429292088 /nfs/dbraw/zinc/29/20/88/1429292088.db2.gz UWULSTYHDWQVRO-UHFFFAOYSA-N 0 0 380.360 3.210 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2cccc3cccnc32)cc([N+](=O)[O-])c1F ZINC000179190766 1429290019 /nfs/dbraw/zinc/29/00/19/1429290019.db2.gz VNKAAYTVCOGPKO-UHFFFAOYSA-N 0 0 375.381 3.069 20 5 GGBDRN O=C(OCc1nc(C(F)(F)F)cs1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000179197004 1429291861 /nfs/dbraw/zinc/29/18/61/1429291861.db2.gz PQGMDZWASJJXBS-UHFFFAOYSA-N 0 0 377.256 3.335 20 5 GGBDRN CC(C)[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)OC(C)(C)C ZINC000179201812 1429293255 /nfs/dbraw/zinc/29/32/55/1429293255.db2.gz YIGURBKMRZPHBC-QGZVFWFLSA-N 0 0 375.425 3.101 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000179207518 1429294762 /nfs/dbraw/zinc/29/47/62/1429294762.db2.gz KMPJMNZQSOBPDS-UHFFFAOYSA-N 0 0 390.403 3.455 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1 ZINC000179232119 1429300893 /nfs/dbraw/zinc/30/08/93/1429300893.db2.gz HQPUEXYZGNKPKK-BLLLJJGKSA-N 0 0 399.472 3.425 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(C[S@@](=O)Cc3nccn3C(F)F)co2)cc1 ZINC000179234448 1429301268 /nfs/dbraw/zinc/30/12/68/1429301268.db2.gz GZSRRMOLMIOGAN-AREMUKBSSA-N 0 0 382.348 3.290 20 5 GGBDRN CSc1nnnn1-c1cccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000179236370 1429301720 /nfs/dbraw/zinc/30/17/20/1429301720.db2.gz QYCJPABJLKPWDQ-UHFFFAOYSA-N 0 0 390.812 3.198 20 5 GGBDRN Cc1nc(CS(=O)(=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)sc1C ZINC000179236788 1429301841 /nfs/dbraw/zinc/30/18/41/1429301841.db2.gz KIJMEDMMZQJWRG-UHFFFAOYSA-N 0 0 393.446 3.438 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000179247979 1429304407 /nfs/dbraw/zinc/30/44/07/1429304407.db2.gz BPFBHDDXGYUDEG-SFHVURJKSA-N 0 0 394.431 3.221 20 5 GGBDRN Cc1c(C(=O)Nc2ccc([S@](C)=O)c(F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000179248150 1429304503 /nfs/dbraw/zinc/30/45/03/1429304503.db2.gz SYTTVQOEZCIETM-MHZLTWQESA-N 0 0 395.368 3.249 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@@H]1CCOC1)c1ccccc1 ZINC000179253091 1429305771 /nfs/dbraw/zinc/30/57/71/1429305771.db2.gz GLPHPKMBRVUFQE-CXAGYDPISA-N 0 0 375.812 3.307 20 5 GGBDRN CCOC(=O)N1CCCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000179258516 1429306315 /nfs/dbraw/zinc/30/63/15/1429306315.db2.gz BLOJZKARLDCMIR-UHFFFAOYSA-N 0 0 385.424 3.029 20 5 GGBDRN CNC(=O)c1cc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)ccc1Cl ZINC000179257170 1429306542 /nfs/dbraw/zinc/30/65/42/1429306542.db2.gz BDGREHVAEQLTFN-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN Cc1cc(N(CCC(N)=O)Cc2ccccc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179265064 1429308619 /nfs/dbraw/zinc/30/86/19/1429308619.db2.gz KMKOOLUIRPAFSE-UHFFFAOYSA-N 0 0 391.431 3.242 20 5 GGBDRN O=C(N[C@H]1CCOC1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000179265317 1429308732 /nfs/dbraw/zinc/30/87/32/1429308732.db2.gz VOHOUJZWRHUWJS-ZDUSSCGKSA-N 0 0 375.812 3.379 20 5 GGBDRN COc1cccc(COc2cccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)c2C)c1 ZINC000179273924 1429311074 /nfs/dbraw/zinc/31/10/74/1429311074.db2.gz BFOUKRCPRUKSJI-UHFFFAOYSA-N 0 0 396.403 3.326 20 5 GGBDRN Cc1cc([C@@H]2CN(S(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)CCO2)ccc1F ZINC000179278660 1429312646 /nfs/dbraw/zinc/31/26/46/1429312646.db2.gz MQPHYEAQLIVGFN-SFHVURJKSA-N 0 0 394.424 3.113 20 5 GGBDRN COc1ccccc1[C@H](OC(=O)CCn1cc([N+](=O)[O-])nc1C)c1ccccn1 ZINC000179313750 1429325526 /nfs/dbraw/zinc/32/55/26/1429325526.db2.gz QEBPHIGZUYYBHI-FQEVSTJZSA-N 0 0 396.403 3.226 20 5 GGBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179316936 1429326590 /nfs/dbraw/zinc/32/65/90/1429326590.db2.gz JTPUSSOATHAIRW-BLVKFPJESA-N 0 0 385.395 3.386 20 5 GGBDRN Cc1c(/C=C\C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cnn1C ZINC000179322970 1429328544 /nfs/dbraw/zinc/32/85/44/1429328544.db2.gz FZGCDWQYHYDFES-FPLPWBNLSA-N 0 0 382.342 3.241 20 5 GGBDRN Cn1ccnc1-c1csc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000179329862 1429330803 /nfs/dbraw/zinc/33/08/03/1429330803.db2.gz YOOREXBMEGTVTK-UHFFFAOYSA-N 0 0 382.405 3.114 20 5 GGBDRN COc1cc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1Cl ZINC000179331332 1429330820 /nfs/dbraw/zinc/33/08/20/1429330820.db2.gz PBIVLCVPQZDISA-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN C[C@@H](NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000179329763 1429331073 /nfs/dbraw/zinc/33/10/73/1429331073.db2.gz BNIZTHKZLPHDKO-HWPZZCPQSA-N 0 0 381.791 3.481 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)NCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000179337497 1429333891 /nfs/dbraw/zinc/33/38/91/1429333891.db2.gz ZIXUUSBQIMQXCW-AWEZNQCLSA-N 0 0 387.436 3.290 20 5 GGBDRN C[C@H](NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cccc(F)c1F ZINC000179353050 1429340703 /nfs/dbraw/zinc/34/07/03/1429340703.db2.gz RFVGAZFOPSRBFL-ZDUSSCGKSA-N 0 0 390.390 3.466 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(C(=O)NC2CC2)cc1 ZINC000179346524 1429337801 /nfs/dbraw/zinc/33/78/01/1429337801.db2.gz MMYZJKPYVSHLEX-UHFFFAOYSA-N 0 0 381.432 3.240 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000179347812 1429338245 /nfs/dbraw/zinc/33/82/45/1429338245.db2.gz XJQIJDIYPFLVIZ-HIFRSBDPSA-N 0 0 382.342 3.263 20 5 GGBDRN O=C(Nc1ccc(C(F)(F)F)nc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000179361445 1429344203 /nfs/dbraw/zinc/34/42/03/1429344203.db2.gz QORBYAIHEXTIPR-UHFFFAOYSA-N 0 0 395.341 3.363 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179367611 1429346628 /nfs/dbraw/zinc/34/66/28/1429346628.db2.gz FNMAEMDQRDFRNE-CQSZACIVSA-N 0 0 396.451 3.184 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000179391192 1429355927 /nfs/dbraw/zinc/35/59/27/1429355927.db2.gz XVCVYZWTYMHGJU-FQEVSTJZSA-N 0 0 376.416 3.160 20 5 GGBDRN C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)COCc1ccccc1 ZINC000179392441 1429355943 /nfs/dbraw/zinc/35/59/43/1429355943.db2.gz LIEVETOSAAHVAP-INIZCTEOSA-N 0 0 394.431 3.363 20 5 GGBDRN C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)COCc1ccccc1 ZINC000179392454 1429356343 /nfs/dbraw/zinc/35/63/43/1429356343.db2.gz LIEVETOSAAHVAP-MRXNPFEDSA-N 0 0 394.431 3.363 20 5 GGBDRN CC[NH+]1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3[O-])c(C)c2)CC1 ZINC000179393230 1429356896 /nfs/dbraw/zinc/35/68/96/1429356896.db2.gz LVNMILXYLOGAAE-UHFFFAOYSA-N 0 0 384.436 3.003 20 5 GGBDRN O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000179394394 1429357373 /nfs/dbraw/zinc/35/73/73/1429357373.db2.gz SIHXVGOBUYMXMW-CQSZACIVSA-N 0 0 387.823 3.027 20 5 GGBDRN COc1cc(CN2CCCO[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000179397630 1429358968 /nfs/dbraw/zinc/35/89/68/1429358968.db2.gz ZXVFEXYNQNLNOO-LLVKDONJSA-N 0 0 378.347 3.155 20 5 GGBDRN COC(=O)c1ccc(CCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000179400906 1429359584 /nfs/dbraw/zinc/35/95/84/1429359584.db2.gz DDFPEWVEBSZWEF-UHFFFAOYSA-N 0 0 397.431 3.298 20 5 GGBDRN O=C(OCc1ccn(-c2ccccc2)n1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000179408948 1429363283 /nfs/dbraw/zinc/36/32/83/1429363283.db2.gz HECYCMDQCSQNKP-UHFFFAOYSA-N 0 0 389.371 3.323 20 5 GGBDRN O=C(N[C@@H]1CCOc2ccc(F)cc21)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179412935 1429364640 /nfs/dbraw/zinc/36/46/40/1429364640.db2.gz LVIZVNCGIYQJKL-CQSZACIVSA-N 0 0 382.351 3.173 20 5 GGBDRN CC(=O)N1CCCC[C@H]1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000179413888 1429364997 /nfs/dbraw/zinc/36/49/97/1429364997.db2.gz LULGUBASIOJYES-HNNXBMFYSA-N 0 0 388.449 3.366 20 5 GGBDRN Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn1 ZINC000179441604 1429377315 /nfs/dbraw/zinc/37/73/15/1429377315.db2.gz RZHGIPRVOHXUBP-AWEZNQCLSA-N 0 0 398.444 3.421 20 5 GGBDRN CN1CCO[C@H]([C@H](NC(=O)c2csc([N+](=O)[O-])c2)c2ccc(Cl)cc2)C1 ZINC000179419556 1429367884 /nfs/dbraw/zinc/36/78/84/1429367884.db2.gz ZDKWLCCBADUYJV-GOEBONIOSA-N 0 0 395.868 3.111 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000179437483 1429375576 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COCc1ccc(CNC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000153284201 1422438417 /nfs/dbraw/zinc/43/84/17/1422438417.db2.gz PRZNNICJOMNNSB-UHFFFAOYSA-N 0 0 383.448 3.022 20 5 GGBDRN CN(C)S(=O)(=O)c1cccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153286680 1422443103 /nfs/dbraw/zinc/44/31/03/1422443103.db2.gz COBLSZCRPMZJEB-UHFFFAOYSA-N 0 0 389.477 3.010 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000153320711 1422467981 /nfs/dbraw/zinc/46/79/81/1422467981.db2.gz URXZNMQJTXFBED-UHFFFAOYSA-N 0 0 394.181 3.238 20 5 GGBDRN O=C(Cc1cccc(OCC(F)(F)F)c1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000153321435 1422468797 /nfs/dbraw/zinc/46/87/97/1422468797.db2.gz PGGUVOBGJGHVHU-UHFFFAOYSA-N 0 0 382.338 3.437 20 5 GGBDRN O=C(CCc1nnc(C2CCCC2)o1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000153325955 1422470064 /nfs/dbraw/zinc/47/00/64/1422470064.db2.gz FELPXNZAVZLZQU-UHFFFAOYSA-N 0 0 396.407 3.392 20 5 GGBDRN COc1cccc(CN(C)C(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153326551 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393.465 3.164 20 5 GGBDRN COc1ccc(CN2CCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)cc1F ZINC000153527546 1422586623 /nfs/dbraw/zinc/58/66/23/1422586623.db2.gz OEDPKVSKMBFKCJ-UHFFFAOYSA-N 0 0 380.807 3.113 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNc2ncc(Cl)cc2[N+](=O)[O-])cc1 ZINC000153528884 1422587987 /nfs/dbraw/zinc/58/79/87/1422587987.db2.gz VAQDFSBOSCLOGJ-UHFFFAOYSA-N 0 0 398.872 3.286 20 5 GGBDRN CC1(c2ccccc2)CCN(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])CC1 ZINC000153535796 1422593338 /nfs/dbraw/zinc/59/33/38/1422593338.db2.gz JSQLYXDNOVAOQE-UHFFFAOYSA-N 0 0 382.416 3.366 20 5 GGBDRN Cc1cc(N2CCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)nc(C(C)C)n1 ZINC000153537450 1422594986 /nfs/dbraw/zinc/59/49/86/1422594986.db2.gz JKPHWGCHJVEXGX-UHFFFAOYSA-N 0 0 376.848 3.192 20 5 GGBDRN O=C(CN1CCC(Nc2ncc(Cl)cc2[N+](=O)[O-])CC1)Nc1ccccc1 ZINC000153552946 1422608564 /nfs/dbraw/zinc/60/85/64/1422608564.db2.gz LJBCWNAYVMFJLP-UHFFFAOYSA-N 0 0 389.843 3.158 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1 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381.335 3.244 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000153610127 1422646701 /nfs/dbraw/zinc/64/67/01/1422646701.db2.gz REJMTSTXKVHUQE-UHFFFAOYSA-N 0 0 388.786 3.272 20 5 GGBDRN CC(C)CC(=O)Nc1ccc(C(=O)Cn2cc(Cl)cc([N+](=O)[O-])c2=O)cc1 ZINC000153611040 1422647776 /nfs/dbraw/zinc/64/77/76/1422647776.db2.gz FKJWFNCZHSSBQM-UHFFFAOYSA-N 0 0 391.811 3.277 20 5 GGBDRN Cc1cc(NC(=O)N2CCCN(C(=O)c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000153616694 1422650253 /nfs/dbraw/zinc/65/02/53/1422650253.db2.gz KWRZPRBCDPXHFE-UHFFFAOYSA-N 0 0 388.449 3.345 20 5 GGBDRN Cc1cc(NC(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)ccc1[N+](=O)[O-] ZINC000153617743 1422651958 /nfs/dbraw/zinc/65/19/58/1422651958.db2.gz ALHAIKVHJAYHTN-CQSZACIVSA-N 0 0 388.811 3.484 20 5 GGBDRN Cc1cc(NC(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)ccc1[N+](=O)[O-] ZINC000153617855 1422652011 /nfs/dbraw/zinc/65/20/11/1422652011.db2.gz ALHAIKVHJAYHTN-AWEZNQCLSA-N 0 0 388.811 3.484 20 5 GGBDRN CC(C)[C@@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1ccc(F)cc1 ZINC000153627668 1422658176 /nfs/dbraw/zinc/65/81/76/1422658176.db2.gz ILYHHHOBQKJZGP-MRXNPFEDSA-N 0 0 381.791 3.063 20 5 GGBDRN CCOC(=O)c1oc2ccccc2c1Cn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000153640180 1422668153 /nfs/dbraw/zinc/66/81/53/1422668153.db2.gz LUAVCKMESPWFHV-UHFFFAOYSA-N 0 0 376.752 3.381 20 5 GGBDRN CC(C)N(Cc1nc2ccccc2c(=O)[nH]1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000153654719 1422682259 /nfs/dbraw/zinc/68/22/59/1422682259.db2.gz YPDIDLUOKVOJPM-UHFFFAOYSA-N 0 0 394.431 3.201 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NCc1csc(-c2ccco2)n1 ZINC000153666574 1422693345 /nfs/dbraw/zinc/69/33/45/1422693345.db2.gz LTSWLIRJLPLING-UHFFFAOYSA-N 0 0 399.837 3.443 20 5 GGBDRN Cn1cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(-c2cccs2)n1 ZINC000153669301 1422693980 /nfs/dbraw/zinc/69/39/80/1422693980.db2.gz XKOHHDHGQICTDB-UHFFFAOYSA-N 0 0 397.460 3.019 20 5 GGBDRN O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000153674371 1422697502 /nfs/dbraw/zinc/69/75/02/1422697502.db2.gz ASGAFWWMJKMCPI-CYBMUJFWSA-N 0 0 379.779 3.183 20 5 GGBDRN Cc1c(NC(=O)CCN[C@@H](c2nc(C3CC3)no2)C(C)C)cccc1[N+](=O)[O-] ZINC000179805525 1429578761 /nfs/dbraw/zinc/57/87/61/1429578761.db2.gz KADCOCSAPWGFKF-QGZVFWFLSA-N 0 0 387.440 3.479 20 5 GGBDRN O=C(NCc1ccc(-n2cccn2)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153688552 1422702877 /nfs/dbraw/zinc/70/28/77/1422702877.db2.gz ILQRJVBSLVDSMX-UHFFFAOYSA-N 0 0 377.404 3.048 20 5 GGBDRN Cc1cc(NC(=O)N2CCC[C@@H](CNC(=O)C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000153686470 1422703623 /nfs/dbraw/zinc/70/36/23/1422703623.db2.gz XQMRKGDHPUMHIZ-AWEZNQCLSA-N 0 0 376.457 3.309 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(Cl)cc1O ZINC000153689233 1422704293 /nfs/dbraw/zinc/70/42/93/1422704293.db2.gz RIYALZBAVYAIDH-UHFFFAOYSA-N 0 0 391.767 3.281 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(c3ccc(Cl)cn3)CC2)ccc1[N+](=O)[O-] ZINC000153713644 1422715617 /nfs/dbraw/zinc/71/56/17/1422715617.db2.gz DQZSYOWANLHOBR-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000153716874 1422718892 /nfs/dbraw/zinc/71/88/92/1422718892.db2.gz UDCSXUHCOWNGRR-GJZGRUSLSA-N 0 0 376.457 3.452 20 5 GGBDRN Cc1cc(NC(=O)N2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000153735837 1422729856 /nfs/dbraw/zinc/72/98/56/1422729856.db2.gz DQTNUFZCYJJDIL-UXHICEINSA-N 0 0 396.447 3.020 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C12CCC2 ZINC000153736676 1422730308 /nfs/dbraw/zinc/73/03/08/1422730308.db2.gz MWOCBYPMLOPGMO-GJZGRUSLSA-N 0 0 388.873 3.216 20 5 GGBDRN CC(C)=CCC[C@]1(C)NC(=O)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1=O ZINC000153751091 1422737963 /nfs/dbraw/zinc/73/79/63/1422737963.db2.gz GSQOBPDRPUIEGX-IBGZPJMESA-N 0 0 399.407 3.202 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCS(=O)(=O)c2ccc(F)cc2)c2ccncc21 ZINC000153757959 1422740912 /nfs/dbraw/zinc/74/09/12/1422740912.db2.gz LVCPHAXPAIHJHK-UHFFFAOYSA-N 0 0 375.381 3.168 20 5 GGBDRN COc1cc(C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)ccc1[N+](=O)[O-] ZINC000153764859 1422744110 /nfs/dbraw/zinc/74/41/10/1422744110.db2.gz UYPROUTZGXHJPF-UHFFFAOYSA-N 0 0 380.404 3.500 20 5 GGBDRN Cc1ncc(CN2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)s1 ZINC000153787966 1422758635 /nfs/dbraw/zinc/75/86/35/1422758635.db2.gz GDORVAQCDKDVES-UHFFFAOYSA-N 0 0 375.454 3.018 20 5 GGBDRN CC(C)[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1nc(C2CC2)no1 ZINC000179810466 1429583616 /nfs/dbraw/zinc/58/36/16/1429583616.db2.gz AOBFIXNSGOOBAU-HNNXBMFYSA-N 0 0 384.396 3.392 20 5 GGBDRN Cc1cc(NC(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)ccc1[N+](=O)[O-] ZINC000153795711 1422762671 /nfs/dbraw/zinc/76/26/71/1422762671.db2.gz IMHZIGIXQMJZQG-GOSISDBHSA-N 0 0 396.447 3.258 20 5 GGBDRN C[C@@H](O)C[C@H](C)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000153802976 1422766401 /nfs/dbraw/zinc/76/64/01/1422766401.db2.gz VALUTWPEGWKOBB-ZNMIVQPWSA-N 0 0 386.452 3.300 20 5 GGBDRN 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FFRZJVHITZTFLQ-CYBMUJFWSA-N 0 0 394.387 3.374 20 5 GGBDRN O=C(c1cc(=O)[nH]c2cc(F)ccc21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000153927564 1422812497 /nfs/dbraw/zinc/81/24/97/1422812497.db2.gz ASQANEHKTUHLJX-UHFFFAOYSA-N 0 0 381.363 3.380 20 5 GGBDRN CN(C)c1cccc(COC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1 ZINC000153931680 1422813198 /nfs/dbraw/zinc/81/31/98/1422813198.db2.gz OKXOMWOQQPQSDU-UHFFFAOYSA-N 0 0 399.403 3.092 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000153934872 1422813410 /nfs/dbraw/zinc/81/34/10/1422813410.db2.gz LPVGHVKSZJUAGM-UHFFFAOYSA-N 0 0 384.392 3.496 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)nc1 ZINC000153966208 1422818275 /nfs/dbraw/zinc/81/82/75/1422818275.db2.gz LBFPPNOILDVBNS-GFCCVEGCSA-N 0 0 377.788 3.238 20 5 GGBDRN O=C(NCc1cccc(N2CC=CC2)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000153976681 1422820116 /nfs/dbraw/zinc/82/01/16/1422820116.db2.gz IENUPVVXFQYFQS-UHFFFAOYSA-N 0 0 389.415 3.087 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC000154002253 1422824017 /nfs/dbraw/zinc/82/40/17/1422824017.db2.gz NJIYXGCAMRJQSF-CVEARBPZSA-N 0 0 381.860 3.466 20 5 GGBDRN O=C(c1cccc(N2CCOC2=O)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154008073 1422824550 /nfs/dbraw/zinc/82/45/50/1422824550.db2.gz XSZNDPVOAVNPSR-UHFFFAOYSA-N 0 0 381.388 3.356 20 5 GGBDRN CCCCC(=O)N1CSC[C@@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154011878 1422825220 /nfs/dbraw/zinc/82/52/20/1422825220.db2.gz AVVBSJLBCOHRML-QGZVFWFLSA-N 0 0 391.493 3.178 20 5 GGBDRN O=C(Nc1ccc(O)cc1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000154020660 1422826776 /nfs/dbraw/zinc/82/67/76/1422826776.db2.gz HWGTXBHNYDETOE-UHFFFAOYSA-N 0 0 384.129 3.157 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000154023258 1422827131 /nfs/dbraw/zinc/82/71/31/1422827131.db2.gz VQJOIRCXWRPCTQ-CQSZACIVSA-N 0 0 391.449 3.277 20 5 GGBDRN CN(Cc1nc2ccccc2n1C)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000154024576 1422827592 /nfs/dbraw/zinc/82/75/92/1422827592.db2.gz VERDDHIODZXMNQ-UHFFFAOYSA-N 0 0 375.388 3.302 20 5 GGBDRN Cc1cc(O)ccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000154059611 1422833728 /nfs/dbraw/zinc/83/37/28/1422833728.db2.gz SCSCXOSIMASJIW-SFHVURJKSA-N 0 0 383.404 3.161 20 5 GGBDRN Cc1cc(C)cc(C(=O)NCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000154062369 1422834087 /nfs/dbraw/zinc/83/40/87/1422834087.db2.gz ACFUDOYKDDJOCZ-UHFFFAOYSA-N 0 0 383.448 3.379 20 5 GGBDRN C[C@@H]1CN(C[C@H](O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000154077007 1422836480 /nfs/dbraw/zinc/83/64/80/1422836480.db2.gz OXEXOOAKGPCNNX-FCEWJHQRSA-N 0 0 386.448 3.111 20 5 GGBDRN O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC[C@@H]1CO ZINC000154076595 1422836586 /nfs/dbraw/zinc/83/65/86/1422836586.db2.gz JVYWOTVLMSVBJP-OAHLLOKOSA-N 0 0 389.839 3.457 20 5 GGBDRN CN(CCOc1cccc(S(C)(=O)=O)c1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000154114957 1422842480 /nfs/dbraw/zinc/84/24/80/1422842480.db2.gz BCRDGWCTRMVHEX-UHFFFAOYSA-N 0 0 398.868 3.163 20 5 GGBDRN CN(Cc1cc(Cl)cn1C)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000154132871 1422844640 /nfs/dbraw/zinc/84/46/40/1422844640.db2.gz FDWZHIQCUTUVNJ-UHFFFAOYSA-N 0 0 387.827 3.259 20 5 GGBDRN Cc1ccc(OC(=O)[C@H](C)CS(=O)(=O)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000154144048 1422846398 /nfs/dbraw/zinc/84/63/98/1422846398.db2.gz VHQMOPIGHLYQRG-GFCCVEGCSA-N 0 0 381.381 3.058 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000154184192 1422851718 /nfs/dbraw/zinc/85/17/18/1422851718.db2.gz MMGRIVKHJNSRRH-AWEZNQCLSA-N 0 0 387.436 3.461 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@H](O)COc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000154187955 1422852587 /nfs/dbraw/zinc/85/25/87/1422852587.db2.gz WYBOOTJETPLMBR-HNNXBMFYSA-N 0 0 377.368 3.074 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000154192408 1422852741 /nfs/dbraw/zinc/85/27/41/1422852741.db2.gz BYMHXMOFEXHRRO-KUHUBIRLSA-N 0 0 380.404 3.023 20 5 GGBDRN Cc1c(C(=O)Nc2n[nH]c3c2cccc3Cl)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000154195258 1422853153 /nfs/dbraw/zinc/85/31/53/1422853153.db2.gz NCGLWCQUHBZWSW-UHFFFAOYSA-N 0 0 397.782 3.266 20 5 GGBDRN CC(C)CO[C@@H]1CCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000154197306 1422853568 /nfs/dbraw/zinc/85/35/68/1422853568.db2.gz FHMIGNLOYZPXLI-CYBMUJFWSA-N 0 0 390.358 3.423 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1ccc(Cl)c(F)c1 ZINC000154206629 1422854766 /nfs/dbraw/zinc/85/47/66/1422854766.db2.gz XROZLDPYBKZIPA-UHFFFAOYSA-N 0 0 379.775 3.293 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)ccc1[N+](=O)[O-] ZINC000154213006 1422856074 /nfs/dbraw/zinc/85/60/74/1422856074.db2.gz DBRNHJWIINDHGP-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000154214523 1422856480 /nfs/dbraw/zinc/85/64/80/1422856480.db2.gz IKBIDYSIEGDCHZ-GJZGRUSLSA-N 0 0 383.832 3.032 20 5 GGBDRN CN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000154219455 1422857125 /nfs/dbraw/zinc/85/71/25/1422857125.db2.gz GPDVMTYSOIDKTL-MSOLQXFVSA-N 0 0 389.839 3.019 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000154221098 1422857504 /nfs/dbraw/zinc/85/75/04/1422857504.db2.gz PUNCKKFIMOXRTF-SNVBAGLBSA-N 0 0 395.437 3.253 20 5 GGBDRN Cc1ccc(C(=O)N(C)C)cc1OC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000154223159 1422857828 /nfs/dbraw/zinc/85/78/28/1422857828.db2.gz OFGJQCPTHNWGQV-UHFFFAOYSA-N 0 0 394.387 3.010 20 5 GGBDRN CC(C)c1nc2c(n1C)CCN(C(=O)c1ccc([N+](=O)[O-])c3cccnc13)C2 ZINC000154228822 1422858729 /nfs/dbraw/zinc/85/87/29/1422858729.db2.gz MXYKERKLELMPTG-UHFFFAOYSA-N 0 0 379.420 3.198 20 5 GGBDRN O=C1N[C@@]2(CCc3ccccc3C2)C(=O)N1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000154235589 1422859845 /nfs/dbraw/zinc/85/98/45/1422859845.db2.gz DVKKGDWMSWCZGM-LJQANCHMSA-N 0 0 385.807 3.228 20 5 GGBDRN Cc1ccccc1OCCN(C)S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000154253093 1422862277 /nfs/dbraw/zinc/86/22/77/1422862277.db2.gz WRRMQHSNIFNCQZ-UHFFFAOYSA-N 0 0 382.413 3.050 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc([N+](=O)[O-])c1F ZINC000154261728 1422863415 /nfs/dbraw/zinc/86/34/15/1422863415.db2.gz HFJFUISBYFRBEQ-UHFFFAOYSA-N 0 0 377.397 3.045 20 5 GGBDRN CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)c1 ZINC000154266040 1422864302 /nfs/dbraw/zinc/86/43/02/1422864302.db2.gz CIZZGPYOXVLZKM-UHFFFAOYSA-N 0 0 381.385 3.110 20 5 GGBDRN C[C@@H](CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)CC1(C)OCCO1 ZINC000154274282 1422865667 /nfs/dbraw/zinc/86/56/67/1422865667.db2.gz IMUZJBBOBUMNRC-MRXNPFEDSA-N 0 0 394.471 3.060 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)CCCOc2ccccc2)cc([N+](=O)[O-])c1F ZINC000154283195 1422866571 /nfs/dbraw/zinc/86/65/71/1422866571.db2.gz YZIVKVMUPAAMOV-UHFFFAOYSA-N 0 0 382.413 3.132 20 5 GGBDRN Cc1noc(C)c1[C@H](C)NC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000154294919 1422868338 /nfs/dbraw/zinc/86/83/38/1422868338.db2.gz YSXNAZQPTACONM-LBPRGKRZSA-N 0 0 375.429 3.370 20 5 GGBDRN O=[N+]([O-])c1cccc(CCNS(=O)(=O)c2ccccc2OC(F)(F)F)c1 ZINC000154302451 1422869422 /nfs/dbraw/zinc/86/94/22/1422869422.db2.gz CKAWSYMYUBPKBG-UHFFFAOYSA-N 0 0 390.339 3.014 20 5 GGBDRN O=[N+]([O-])c1cccc(CCNS(=O)(=O)c2ccc(F)cc2C(F)(F)F)c1 ZINC000154303300 1422869580 /nfs/dbraw/zinc/86/95/80/1422869580.db2.gz YQMVQKAZGZCXOB-UHFFFAOYSA-N 0 0 392.330 3.274 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NCc2cc(C(C)C)no2)c([N+](=O)[O-])c1 ZINC000154305740 1422870064 /nfs/dbraw/zinc/87/00/64/1422870064.db2.gz NYWVFOQUHIYLAH-UHFFFAOYSA-N 0 0 375.429 3.316 20 5 GGBDRN COc1cc(OCC(=O)Nc2n[nH]c3c2cccc3Cl)ccc1[N+](=O)[O-] ZINC000154324266 1422872749 /nfs/dbraw/zinc/87/27/49/1422872749.db2.gz MZUMKWLJNXXSIB-UHFFFAOYSA-N 0 0 376.756 3.151 20 5 GGBDRN C[C@]1(c2cc(F)ccc2F)NC(=O)N(Cc2c(Cl)cccc2[N+](=O)[O-])C1=O ZINC000154332372 1422874022 /nfs/dbraw/zinc/87/40/22/1422874022.db2.gz NZJHCFPURDJUIL-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN O=C(NCCOc1ccc(C(F)(F)F)cn1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000154334584 1422874356 /nfs/dbraw/zinc/87/43/56/1422874356.db2.gz JUFXROVIHGWXFT-UHFFFAOYSA-N 0 0 389.717 3.471 20 5 GGBDRN CC(C)Cn1c(CCC(N)=O)nnc1SCc1c(Cl)cccc1[N+](=O)[O-] ZINC000154337451 1422875177 /nfs/dbraw/zinc/87/51/77/1422875177.db2.gz ZWUMMZHIUUEHNZ-UHFFFAOYSA-N 0 0 397.888 3.206 20 5 GGBDRN COc1ccc(N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C2CC2)cc1 ZINC000154351423 1422876985 /nfs/dbraw/zinc/87/69/85/1422876985.db2.gz ZUJAWKLQVCBVFR-CQSZACIVSA-N 0 0 397.431 3.165 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000154356655 1422877553 /nfs/dbraw/zinc/87/75/53/1422877553.db2.gz QUIXXPZYDUKQSN-JTQLQIEISA-N 0 0 396.325 3.133 20 5 GGBDRN CNC(=O)c1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000154355475 1422877599 /nfs/dbraw/zinc/87/75/99/1422877599.db2.gz BTCPQAHIUGTZBG-UHFFFAOYSA-N 0 0 392.755 3.077 20 5 GGBDRN COc1cc(C(=O)NCCOc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000154369847 1422879782 /nfs/dbraw/zinc/87/97/82/1422879782.db2.gz KUXSBCBJKFDNHU-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN COc1cccc(OCCCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000154386007 1422881999 /nfs/dbraw/zinc/88/19/99/1422881999.db2.gz BWMKSPDKSJEXMO-UHFFFAOYSA-N 0 0 381.388 3.351 20 5 GGBDRN Cc1nccn1-c1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cn1 ZINC000154386410 1422882352 /nfs/dbraw/zinc/88/23/52/1422882352.db2.gz JJUNUXQFXRMNMC-UHFFFAOYSA-N 0 0 376.376 3.146 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)N1CC[C@@H](O)C1 ZINC000154388486 1422882664 /nfs/dbraw/zinc/88/26/64/1422882664.db2.gz YSQWSADMKFQPSX-CQSZACIVSA-N 0 0 375.812 3.067 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cccc1[N+](=O)[O-] ZINC000154404493 1422884708 /nfs/dbraw/zinc/88/47/08/1422884708.db2.gz VHAOJWMVYMVYIT-UHFFFAOYSA-N 0 0 384.360 3.081 20 5 GGBDRN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000154406346 1422885026 /nfs/dbraw/zinc/88/50/26/1422885026.db2.gz XMLJXUXGANWTOM-UHFFFAOYSA-N 0 0 392.415 3.458 20 5 GGBDRN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000154413149 1422885608 /nfs/dbraw/zinc/88/56/08/1422885608.db2.gz MFZGQGTWEIVMBD-UHFFFAOYSA-N 0 0 385.395 3.460 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000154414302 1422886090 /nfs/dbraw/zinc/88/60/90/1422886090.db2.gz XXPGMOQGQHICPV-HXUWFJFHSA-N 0 0 393.443 3.393 20 5 GGBDRN CN(CCC1CCOCC1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000154423888 1422887326 /nfs/dbraw/zinc/88/73/26/1422887326.db2.gz CFNCUKYSOCJRQP-UHFFFAOYSA-N 0 0 375.469 3.086 20 5 GGBDRN CN(CCC1CCOCC1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000154433428 1422888130 /nfs/dbraw/zinc/88/81/30/1422888130.db2.gz UQNQDQGXEGOZKB-UHFFFAOYSA-N 0 0 375.469 3.474 20 5 GGBDRN O=C(CCc1ccc2[nH]ccc2c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000179820605 1429593014 /nfs/dbraw/zinc/59/30/14/1429593014.db2.gz XBUPISNJMJMFFC-UHFFFAOYSA-N 0 0 378.432 3.358 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000154441870 1422889145 /nfs/dbraw/zinc/88/91/45/1422889145.db2.gz OSXAODLUZLTHDO-UHFFFAOYSA-N 0 0 393.403 3.167 20 5 GGBDRN CCC(CC)n1nc(C)cc1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000179820516 1429593143 /nfs/dbraw/zinc/59/31/43/1429593143.db2.gz UWLCPWJBHONCES-UHFFFAOYSA-N 0 0 385.468 3.423 20 5 GGBDRN O=C(NCC1(c2cccc(F)c2)CC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154455734 1422891061 /nfs/dbraw/zinc/89/10/61/1422891061.db2.gz LKBAGMAPOUTMSG-UHFFFAOYSA-N 0 0 380.379 3.381 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(c1ccccn1)C1CCCC1 ZINC000154455381 1422891259 /nfs/dbraw/zinc/89/12/59/1422891259.db2.gz ANGCRWONLVBWOE-UHFFFAOYSA-N 0 0 378.392 3.160 20 5 GGBDRN C[C@H](c1ccccc1)N1C(=O)C(=O)N(Cc2c(Cl)cccc2[N+](=O)[O-])C1=O ZINC000154473378 1422893555 /nfs/dbraw/zinc/89/35/55/1422893555.db2.gz ZETYQFGISCAASB-LLVKDONJSA-N 0 0 387.779 3.300 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000154474450 1422893724 /nfs/dbraw/zinc/89/37/24/1422893724.db2.gz VBQKHIQAPXQSEW-ZIAGYGMSSA-N 0 0 385.420 3.469 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000154482939 1422894909 /nfs/dbraw/zinc/89/49/09/1422894909.db2.gz MAAMGKUWEFNAIT-APPDUMDISA-N 0 0 382.413 3.062 20 5 GGBDRN C[C@@]1(c2ccc(F)cc2F)NC(=O)N(Cc2c(Cl)cccc2[N+](=O)[O-])C1=O ZINC000154497832 1422897162 /nfs/dbraw/zinc/89/71/62/1422897162.db2.gz METPQHRMRJZLFS-KRWDZBQOSA-N 0 0 395.749 3.494 20 5 GGBDRN C[C@]1(c2ccc(F)cc2F)NC(=O)N(Cc2c(Cl)cccc2[N+](=O)[O-])C1=O ZINC000154497934 1422897253 /nfs/dbraw/zinc/89/72/53/1422897253.db2.gz METPQHRMRJZLFS-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN CCCOc1ccc2c(c1)CCN(c1cc3nc[nH]c(=O)c3cc1[N+](=O)[O-])C2 ZINC000154504941 1422897985 /nfs/dbraw/zinc/89/79/85/1422897985.db2.gz FGXWBQPWVMGBAD-UHFFFAOYSA-N 0 0 380.404 3.183 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cnc3ccccc32)nc1 ZINC000154509757 1422898549 /nfs/dbraw/zinc/89/85/49/1422898549.db2.gz FBDLXVVAIVNWTE-UHFFFAOYSA-N 0 0 387.399 3.301 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1CNC(=O)c1ccccc1 ZINC000154518300 1422899595 /nfs/dbraw/zinc/89/95/95/1422899595.db2.gz FVTHKINUUKSSPQ-HXUWFJFHSA-N 0 0 395.459 3.339 20 5 GGBDRN CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H]1CCCc2c1cnn2C ZINC000154519596 1422899805 /nfs/dbraw/zinc/89/98/05/1422899805.db2.gz PQJACLVNCWXKIC-KRWDZBQOSA-N 0 0 397.479 3.081 20 5 GGBDRN CC(C)N(CC(=O)Nc1ccc(F)cc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154522084 1422900540 /nfs/dbraw/zinc/90/05/40/1422900540.db2.gz GKWVMVUMKRPNCI-SFHVURJKSA-N 0 0 375.400 3.116 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(N2CCOC3(C2)CCCCCC3)c([N+](=O)[O-])c1 ZINC000154540418 1422913526 /nfs/dbraw/zinc/91/35/26/1422913526.db2.gz SDDSUMFSVQNVAX-UHFFFAOYSA-N 0 0 398.463 3.489 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N(CCCO)Cc1cccc(Cl)c1 ZINC000154547638 1422921271 /nfs/dbraw/zinc/92/12/71/1422921271.db2.gz LFLHVQIXCLRKAX-UHFFFAOYSA-N 0 0 378.812 3.038 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N(CCCO)Cc1cccc(Cl)c1 ZINC000154554376 1422923686 /nfs/dbraw/zinc/92/36/86/1422923686.db2.gz SYFMKBKFEDPTAW-UHFFFAOYSA-N 0 0 378.812 3.038 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(CCCO)Cc1cccc(Cl)c1 ZINC000154554128 1422924659 /nfs/dbraw/zinc/92/46/59/1422924659.db2.gz QSDDMKWIAJPVGH-UHFFFAOYSA-N 0 0 388.811 3.149 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ncon1 ZINC000154561832 1422931827 /nfs/dbraw/zinc/93/18/27/1422931827.db2.gz ALPQCSVFIHEYQV-RYUDHWBXSA-N 0 0 382.380 3.037 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@@H](c2ccsc2)O1 ZINC000154563773 1422934792 /nfs/dbraw/zinc/93/47/92/1422934792.db2.gz IQSOXIXFUXCAOX-ACJLOTCBSA-N 0 0 398.444 3.444 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCCOc1ccc(C(F)(F)F)cn1 ZINC000154571305 1422938203 /nfs/dbraw/zinc/93/82/03/1422938203.db2.gz BFXZRLJNKWMYMB-UHFFFAOYSA-N 0 0 398.341 3.006 20 5 GGBDRN COc1cc(CN2CCC[C@H](CO)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000154572217 1422938605 /nfs/dbraw/zinc/93/86/05/1422938605.db2.gz 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O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000179895013 1429628780 /nfs/dbraw/zinc/62/87/80/1429628780.db2.gz MJORMPYBUMIZGF-AWEZNQCLSA-N 0 0 375.812 3.022 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CC[C@@H](c3ccc(OC)cc3)C2)c([N+](=O)[O-])c1 ZINC000155297796 1423305799 /nfs/dbraw/zinc/30/57/99/1423305799.db2.gz XVJNURJBMHBTPI-MRXNPFEDSA-N 0 0 399.447 3.430 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1cccc2c1OCCCO2 ZINC000155305839 1423309723 /nfs/dbraw/zinc/30/97/23/1423309723.db2.gz HMSIGLACTGLLRK-UHFFFAOYSA-N 0 0 376.796 3.268 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@H]1[C@@H]1CCCCC1=O ZINC000155324930 1423317897 /nfs/dbraw/zinc/31/78/97/1423317897.db2.gz DGDZCMQIJWNCTJ-WMZOPIPTSA-N 0 0 382.420 3.144 20 5 GGBDRN CN(c1ccccc1NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000155329662 1423319864 /nfs/dbraw/zinc/31/98/64/1423319864.db2.gz XMJBOFIIQRHSTA-UHFFFAOYSA-N 0 0 396.447 3.342 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000179904543 1429632736 /nfs/dbraw/zinc/63/27/36/1429632736.db2.gz MAQDBDOMAKAWPP-UHFFFAOYSA-N 0 0 382.342 3.216 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[C@H]1CC(=O)c1cnn(C)c1 ZINC000179906326 1429633770 /nfs/dbraw/zinc/63/37/70/1429633770.db2.gz FKUQOGNQDNTHMR-INIZCTEOSA-N 0 0 384.436 3.131 20 5 GGBDRN Cc1nccn1-c1ncccc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000155392771 1423345990 /nfs/dbraw/zinc/34/59/90/1423345990.db2.gz SOIAJBDKPDPQBN-UHFFFAOYSA-N 0 0 376.376 3.146 20 5 GGBDRN COc1ccc([C@H]2CCN(S(=O)(=O)c3c(Cl)cccc3[N+](=O)[O-])C2)cc1 ZINC000155396778 1423347580 /nfs/dbraw/zinc/34/75/80/1423347580.db2.gz UMVXGBWMRIAZCW-ZDUSSCGKSA-N 0 0 396.852 3.435 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCOC[C@H]1C[C@@H](O)c1ccccc1 ZINC000155419892 1423356148 /nfs/dbraw/zinc/35/61/48/1423356148.db2.gz FKSREEYNXUYZOF-CRAIPNDOSA-N 0 0 390.823 3.213 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000179909220 1429635478 /nfs/dbraw/zinc/63/54/78/1429635478.db2.gz LLLVGVYRITZNIQ-UHFFFAOYSA-N 0 0 397.357 3.086 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)c3cc(F)c([N+](=O)[O-])cc3F)cc2)CCO1 ZINC000155449626 1423368815 /nfs/dbraw/zinc/36/88/15/1423368815.db2.gz CPLLWEVRMVNZGS-NSHDSACASA-N 0 0 377.347 3.350 20 5 GGBDRN CS(=O)(=O)c1cc(SCc2ccc(-n3cccn3)cc2)ccc1[N+](=O)[O-] ZINC000155467923 1423376856 /nfs/dbraw/zinc/37/68/56/1423376856.db2.gz KTGUSHIKFHAKLM-UHFFFAOYSA-N 0 0 389.458 3.476 20 5 GGBDRN Nc1c(C(=O)NCc2ccccc2OCC(F)(F)F)cc(F)cc1[N+](=O)[O-] ZINC000155500756 1423388216 /nfs/dbraw/zinc/38/82/16/1423388216.db2.gz QBRCIBYSZHOLFC-UHFFFAOYSA-N 0 0 387.289 3.187 20 5 GGBDRN O=C(c1ccccc1NCc1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@@H](O)C1 ZINC000155510652 1423393087 /nfs/dbraw/zinc/39/30/87/1423393087.db2.gz SAGWAZLCDCODJH-CYBMUJFWSA-N 0 0 389.839 3.457 20 5 GGBDRN O=C(c1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])cc1)N1CCOCC1 ZINC000155509488 1423393199 /nfs/dbraw/zinc/39/31/99/1423393199.db2.gz MJJRLULCEKQNFT-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000155528041 1423401763 /nfs/dbraw/zinc/40/17/63/1423401763.db2.gz TULPVTXTYHTJKU-FQEVSTJZSA-N 0 0 386.835 3.491 20 5 GGBDRN CCc1ccc(C(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000155530802 1423402911 /nfs/dbraw/zinc/40/29/11/1423402911.db2.gz LBDZZKLIJLLMFZ-AZUAARDMSA-N 0 0 384.432 3.122 20 5 GGBDRN O=C(c1ccccc1NCc1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@@H]1CO ZINC000155538334 1423406653 /nfs/dbraw/zinc/40/66/53/1423406653.db2.gz GRTPKEVRIDGUNY-CYBMUJFWSA-N 0 0 389.839 3.457 20 5 GGBDRN C[C@@H]1CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccccc2S1 ZINC000155540390 1423408381 /nfs/dbraw/zinc/40/83/81/1423408381.db2.gz YSOLPAJQISGXST-LLVKDONJSA-N 0 0 385.401 3.030 20 5 GGBDRN C[C@H]1CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccccc2S1 ZINC000155540502 1423408428 /nfs/dbraw/zinc/40/84/28/1423408428.db2.gz YSOLPAJQISGXST-NSHDSACASA-N 0 0 385.401 3.030 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCOC[C@H]1C[C@H](O)c1ccccc1 ZINC000155541736 1423409328 /nfs/dbraw/zinc/40/93/28/1423409328.db2.gz WPDVJLQURJHONS-QAPCUYQASA-N 0 0 390.823 3.213 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c2ccccc2S1 ZINC000155554532 1423415350 /nfs/dbraw/zinc/41/53/50/1423415350.db2.gz GZMCWIBFWZXBBW-GFCCVEGCSA-N 0 0 381.417 3.317 20 5 GGBDRN O=C(Nc1cccc(CN2CCOCC2)n1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179917018 1429640092 /nfs/dbraw/zinc/64/00/92/1429640092.db2.gz DNZHHPXFPYGTOK-UHFFFAOYSA-N 0 0 398.444 3.289 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@]2(CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000155602482 1423440458 /nfs/dbraw/zinc/44/04/58/1423440458.db2.gz ZBKIOMYNNUHJJS-IBGZPJMESA-N 0 0 393.415 3.207 20 5 GGBDRN O=C(OC[C@H]1CCN(c2ccccc2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000155614013 1423445872 /nfs/dbraw/zinc/44/58/72/1423445872.db2.gz FXVDJMQWRUWPHJ-INIZCTEOSA-N 0 0 392.415 3.464 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@@H](O)c1ccsc1 ZINC000155623758 1423452259 /nfs/dbraw/zinc/45/22/59/1423452259.db2.gz BRVAHAWOLCQNJK-LJQANCHMSA-N 0 0 378.453 3.066 20 5 GGBDRN Cc1c2nc(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)sc2ccc1F ZINC000155630261 1423455733 /nfs/dbraw/zinc/45/57/33/1423455733.db2.gz FOABBHQVAVSSHL-UHFFFAOYSA-N 0 0 388.380 3.021 20 5 GGBDRN C[C@H](O)C[C@H]1CCCN1C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000155636421 1423460439 /nfs/dbraw/zinc/46/04/39/1423460439.db2.gz OZVOWEQHUZZKKV-DOTOQJQBSA-N 0 0 375.469 3.207 20 5 GGBDRN O=C(NCCCOc1ncc(C(F)(F)F)cc1Cl)c1ccc([N+](=O)[O-])o1 ZINC000155685411 1423486237 /nfs/dbraw/zinc/48/62/37/1423486237.db2.gz QQMAQMMPMMYITF-UHFFFAOYSA-N 0 0 393.705 3.454 20 5 GGBDRN COc1ccc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1OC ZINC000155698487 1423492902 /nfs/dbraw/zinc/49/29/02/1423492902.db2.gz TWGHERRLTCVTIO-UHFFFAOYSA-N 0 0 385.420 3.215 20 5 GGBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC(n2ccnn2)CC1 ZINC000155707029 1423497805 /nfs/dbraw/zinc/49/78/05/1423497805.db2.gz YIQONZVVJIOQCQ-UHFFFAOYSA-N 0 0 392.419 3.407 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ncccc1C(F)(F)F ZINC000179933044 1429649531 /nfs/dbraw/zinc/64/95/31/1429649531.db2.gz RTMBPBCNBNTFQC-UHFFFAOYSA-N 0 0 383.282 3.422 20 5 GGBDRN CCc1ccc(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)cc1S(C)(=O)=O ZINC000155740776 1423512122 /nfs/dbraw/zinc/51/21/22/1423512122.db2.gz ZMVKBMKMFLFCQC-UHFFFAOYSA-N 0 0 388.445 3.154 20 5 GGBDRN COc1ccc(-n2nc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)cc2C)cc1 ZINC000179932245 1429648518 /nfs/dbraw/zinc/64/85/18/1429648518.db2.gz QKYYALXERJCZLQ-UHFFFAOYSA-N 0 0 378.388 3.300 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](c2ccsc2)O1 ZINC000155764381 1423523355 /nfs/dbraw/zinc/52/33/55/1423523355.db2.gz YUYFVILDXGMGQD-ACJLOTCBSA-N 0 0 398.444 3.444 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(O)c(-c2nc3ccccc3s2)c1 ZINC000179932897 1429649291 /nfs/dbraw/zinc/64/92/91/1429649291.db2.gz WJZRKWFBFGQQAG-UHFFFAOYSA-N 0 0 395.400 3.412 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)CS(=O)(=O)C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000155782669 1423532559 /nfs/dbraw/zinc/53/25/59/1423532559.db2.gz GJAZUCINMCSLBR-UHFFFAOYSA-N 0 0 397.478 3.179 20 5 GGBDRN O=C1CCc2cc(NCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)c(F)cc2N1 ZINC000155794590 1423536940 /nfs/dbraw/zinc/53/69/40/1423536940.db2.gz LQJDTBLGQHHRPX-UHFFFAOYSA-N 0 0 383.339 3.281 20 5 GGBDRN Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cnc1Cl ZINC000155820363 1423546970 /nfs/dbraw/zinc/54/69/70/1423546970.db2.gz KIOIOCPLVVLOCG-LLVKDONJSA-N 0 0 394.840 3.256 20 5 GGBDRN CCOc1ccc(NC(=O)COc2cccc(C(F)(F)F)n2)c([N+](=O)[O-])c1 ZINC000179938538 1429651979 /nfs/dbraw/zinc/65/19/79/1429651979.db2.gz YVVQYXJVOWOMLV-UHFFFAOYSA-N 0 0 385.298 3.425 20 5 GGBDRN O=C(NCCc1cccc(OCCCc2ccccc2)c1)c1[nH]ncc1[N+](=O)[O-] ZINC000155823531 1423548852 /nfs/dbraw/zinc/54/88/52/1423548852.db2.gz HXKDJXYKRBRVNU-UHFFFAOYSA-N 0 0 394.431 3.302 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(Cc2nc3ccccc3[nH]2)CC1 ZINC000155825423 1423550723 /nfs/dbraw/zinc/55/07/23/1423550723.db2.gz VTQZKEYDFBRPCN-UHFFFAOYSA-N 0 0 399.838 3.083 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@H]2CCCOCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000179939506 1429652823 /nfs/dbraw/zinc/65/28/23/1429652823.db2.gz CQVVRMIEIPSBOY-HOCLYGCPSA-N 0 0 384.436 3.462 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1OS(=O)(=O)c1cc(F)ccc1Br ZINC000155852829 1423561749 /nfs/dbraw/zinc/56/17/49/1423561749.db2.gz AXXHIMNNOPIBME-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCN(CC(F)(F)F)CC1 ZINC000155860404 1423565777 /nfs/dbraw/zinc/56/57/77/1423565777.db2.gz BVAZJFOYAGFEIA-LBPRGKRZSA-N 0 0 399.373 3.276 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCN(CC(F)(F)F)CC1 ZINC000155860540 1423566491 /nfs/dbraw/zinc/56/64/91/1423566491.db2.gz BVAZJFOYAGFEIA-GFCCVEGCSA-N 0 0 399.373 3.276 20 5 GGBDRN Cc1c(C(=O)Nc2cncc(Br)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000155870915 1423569913 /nfs/dbraw/zinc/56/99/13/1423569913.db2.gz 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CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000156029739 1423641000 /nfs/dbraw/zinc/64/10/00/1423641000.db2.gz IWIRGFVGNSEIFN-UHFFFAOYSA-N 0 0 381.404 3.111 20 5 GGBDRN CC(C)NC(=O)c1ccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000156034951 1423643773 /nfs/dbraw/zinc/64/37/73/1423643773.db2.gz ZQFQOHIWPYLBFN-UHFFFAOYSA-N 0 0 393.403 3.171 20 5 GGBDRN CCC[C@H](C)[C@H]1CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000156040198 1423646043 /nfs/dbraw/zinc/64/60/43/1423646043.db2.gz RHGZGANIECEPED-GXTWGEPZSA-N 0 0 381.860 3.405 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)c(C)o1 ZINC000156039926 1423646078 /nfs/dbraw/zinc/64/60/78/1423646078.db2.gz XIDSAJLFQQHPSK-UHFFFAOYSA-N 0 0 386.408 3.103 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000156055468 1423653363 /nfs/dbraw/zinc/65/33/63/1423653363.db2.gz ONWQCASZDPEOKE-GFCCVEGCSA-N 0 0 381.404 3.111 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000156056236 1423654404 /nfs/dbraw/zinc/65/44/04/1423654404.db2.gz CJTLQTGIZJQZAY-GFCCVEGCSA-N 0 0 381.404 3.111 20 5 GGBDRN CS(=O)(=O)CCc1ccc(NC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000156081221 1423663787 /nfs/dbraw/zinc/66/37/87/1423663787.db2.gz QYXQFQJZTHRYIL-UHFFFAOYSA-N 0 0 397.840 3.479 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000156082842 1423664996 /nfs/dbraw/zinc/66/49/96/1423664996.db2.gz NSLGJUJQAGPUJM-HLLBOEOZSA-N 0 0 376.457 3.009 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)c1[N+](=O)[O-] ZINC000156085797 1423665400 /nfs/dbraw/zinc/66/54/00/1423665400.db2.gz XOVKPQMAUJQSQM-UHFFFAOYSA-N 0 0 385.405 3.203 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(c2nc(C)c(C)s2)CC1 ZINC000156096830 1423671706 /nfs/dbraw/zinc/67/17/06/1423671706.db2.gz SBDUKHWWHKBMKT-UHFFFAOYSA-N 0 0 391.453 3.031 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(-n2nc(C)cc2C)nc1 ZINC000156099256 1423672390 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ZINC000157752848 1424080390 /nfs/dbraw/zinc/08/03/90/1424080390.db2.gz PWCZIFGYJZUMLI-UHFFFAOYSA-N 0 0 389.717 3.471 20 5 GGBDRN CCS(=O)(=O)c1cccc(CC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000157757398 1424081138 /nfs/dbraw/zinc/08/11/38/1424081138.db2.gz YCWDJMOPDVFXSA-UHFFFAOYSA-N 0 0 376.434 3.186 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccc(N2CCSCC2)cc1 ZINC000157838225 1424100366 /nfs/dbraw/zinc/10/03/66/1424100366.db2.gz AWGRSBAANADQCT-UHFFFAOYSA-N 0 0 393.490 3.257 20 5 GGBDRN Cc1ccccc1CC(=O)N1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000157851881 1424103939 /nfs/dbraw/zinc/10/39/39/1424103939.db2.gz OHBQHSKNGYLRGR-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN Cc1cnc(OCC(=O)N[C@H](c2nccs2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000157934960 1424123113 /nfs/dbraw/zinc/12/31/13/1424123113.db2.gz QZOICNIPOSQAFW-INIZCTEOSA-N 0 0 384.417 3.039 20 5 GGBDRN CC[C@H]1CCC[C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000157943091 1424125271 /nfs/dbraw/zinc/12/52/71/1424125271.db2.gz 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C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H](O)Cc1ccccc1 ZINC000157966537 1424130778 /nfs/dbraw/zinc/13/07/78/1424130778.db2.gz VXRSISMPCHAFGH-XHDPSFHLSA-N 0 0 395.362 3.310 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[C@H](c2ccccc2OC)C1 ZINC000158006514 1424138606 /nfs/dbraw/zinc/13/86/06/1424138606.db2.gz RLXZDMRYEPEWDI-CABCVRRESA-N 0 0 399.447 3.429 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[C@H](c2ccccc2OC)C1 ZINC000158006359 1424138718 /nfs/dbraw/zinc/13/87/18/1424138718.db2.gz RLXZDMRYEPEWDI-GJZGRUSLSA-N 0 0 399.447 3.429 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1cccnc1OCC(F)F ZINC000180026087 1429701599 /nfs/dbraw/zinc/70/15/99/1429701599.db2.gz QAXFUSSPHUVESP-UHFFFAOYSA-N 0 0 379.363 3.489 20 5 GGBDRN CC(=O)c1ccc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)nc1C ZINC000158019503 1424141006 /nfs/dbraw/zinc/14/10/06/1424141006.db2.gz KIWPXLMJFDMMFD-UHFFFAOYSA-N 0 0 382.420 3.031 20 5 GGBDRN CC(C)C(=O)Nc1ccc(C(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000158024159 1424141811 /nfs/dbraw/zinc/14/18/11/1424141811.db2.gz OWDLKZVIXGHVLH-UHFFFAOYSA-N 0 0 393.403 3.331 20 5 GGBDRN COCCn1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)n1 ZINC000158031816 1424143613 /nfs/dbraw/zinc/14/36/13/1424143613.db2.gz HPTABMKOKHFJLY-UHFFFAOYSA-N 0 0 395.419 3.302 20 5 GGBDRN CC(=O)c1ccc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)nc1C ZINC000158034172 1424144000 /nfs/dbraw/zinc/14/40/00/1424144000.db2.gz HBENFFOKJUTQCW-UHFFFAOYSA-N 0 0 399.450 3.377 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[C@H](O)c2cccs2)cc1C ZINC000158054971 1424151247 /nfs/dbraw/zinc/15/12/47/1424151247.db2.gz LABYKXIBBKWYFY-OCCSQVGLSA-N 0 0 384.479 3.064 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)C[C@@H](O)c1cccs1 ZINC000158058816 1424152307 /nfs/dbraw/zinc/15/23/07/1424152307.db2.gz LNADWDCAUNKDKN-BXUZGUMPSA-N 0 0 384.479 3.009 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1c(-c2cccs2)nc2ccccn21 ZINC000158059233 1424152813 /nfs/dbraw/zinc/15/28/13/1424152813.db2.gz LTYCFXSXENHTLD-UHFFFAOYSA-N 0 0 382.405 3.196 20 5 GGBDRN CC[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)c1cc(F)ccc1F ZINC000158086188 1424162319 /nfs/dbraw/zinc/16/23/19/1424162319.db2.gz NBUAROHAEWKASR-HNNXBMFYSA-N 0 0 377.347 3.387 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)c1cc(F)ccc1F ZINC000158086323 1424162478 /nfs/dbraw/zinc/16/24/78/1424162478.db2.gz NBUAROHAEWKASR-OAHLLOKOSA-N 0 0 377.347 3.387 20 5 GGBDRN CC(C)[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000180038993 1429708261 /nfs/dbraw/zinc/70/82/61/1429708261.db2.gz HFZZHVJSWYZLKA-OAHLLOKOSA-N 0 0 385.848 3.143 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H]1C=CCCC1 ZINC000158117447 1424171668 /nfs/dbraw/zinc/17/16/68/1424171668.db2.gz WLVPYOKPEOZIGP-BLLLJJGKSA-N 0 0 379.844 3.228 20 5 GGBDRN O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000180029762 1429703488 /nfs/dbraw/zinc/70/34/88/1429703488.db2.gz SINGNHKCTVTPFJ-CQSZACIVSA-N 0 0 387.823 3.027 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000158154803 1424180832 /nfs/dbraw/zinc/18/08/32/1424180832.db2.gz SUKZXKBDVCJBNO-JOYOIKCWSA-N 0 0 390.870 3.100 20 5 GGBDRN COc1ccc([C@@H]2[C@@H](C(=O)N(C)c3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1 ZINC000158158863 1424182281 /nfs/dbraw/zinc/18/22/81/1424182281.db2.gz DDCHQVLHIYAKDK-AZUAARDMSA-N 0 0 397.431 3.176 20 5 GGBDRN CCCn1cnnc1COC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000180030767 1429704228 /nfs/dbraw/zinc/70/42/28/1429704228.db2.gz KPWXNGRLMMNWEC-UHFFFAOYSA-N 0 0 387.440 3.190 20 5 GGBDRN CN(C(=O)c1ncoc1-c1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000158162928 1424183976 /nfs/dbraw/zinc/18/39/76/1424183976.db2.gz BLLUDCKPZOPWPY-UHFFFAOYSA-N 0 0 381.344 3.298 20 5 GGBDRN CN(C(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2)c1cccc([N+](=O)[O-])c1 ZINC000158185822 1424189128 /nfs/dbraw/zinc/18/91/28/1424189128.db2.gz NHRKYUGHPBQWLL-UHFFFAOYSA-N 0 0 385.464 3.280 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc(-c2ccccc2)s1 ZINC000158222146 1424199375 /nfs/dbraw/zinc/19/93/75/1424199375.db2.gz VNXUNXGMADZVJG-UHFFFAOYSA-N 0 0 383.433 3.109 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H](C)C[C@H](O)c2cccs2)c1C ZINC000158236618 1424203410 /nfs/dbraw/zinc/20/34/10/1424203410.db2.gz HKCJBPAFVYRZIQ-FZMZJTMJSA-N 0 0 384.479 3.064 20 5 GGBDRN CC[C@H](C)[C@@H](C(=O)N(C)c1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O ZINC000158243259 1424205653 /nfs/dbraw/zinc/20/56/53/1424205653.db2.gz IPSYWAVWNSDHSF-UGSOOPFHSA-N 0 0 395.415 3.269 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[C@@H](O)c2cccs2)c1C ZINC000158256734 1424210799 /nfs/dbraw/zinc/21/07/99/1424210799.db2.gz NYZIQARWXQJGQD-BXUZGUMPSA-N 0 0 384.479 3.064 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[C@@H](O)c2cccs2)c1C ZINC000158256596 1424210947 /nfs/dbraw/zinc/21/09/47/1424210947.db2.gz NYZIQARWXQJGQD-SMDDNHRTSA-N 0 0 384.479 3.064 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC([C@H](O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000158270066 1424214566 /nfs/dbraw/zinc/21/45/66/1424214566.db2.gz LIISWIREISWOMW-LJQANCHMSA-N 0 0 390.461 3.038 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC([C@@H](O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000158270223 1424214598 /nfs/dbraw/zinc/21/45/98/1424214598.db2.gz LIISWIREISWOMW-IBGZPJMESA-N 0 0 390.461 3.038 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000158276228 1424215300 /nfs/dbraw/zinc/21/53/00/1424215300.db2.gz BSWASIPXAVZZRM-IBGZPJMESA-N 0 0 390.461 3.038 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC([C@H](O)c2ccccc2)CC1 ZINC000158281200 1424216787 /nfs/dbraw/zinc/21/67/87/1424216787.db2.gz DJLGZCFTKWBUHL-LJQANCHMSA-N 0 0 390.461 3.038 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000158287317 1424217517 /nfs/dbraw/zinc/21/75/17/1424217517.db2.gz HGAZZFDVGWWIAT-UHFFFAOYSA-N 0 0 396.325 3.498 20 5 GGBDRN CN(C(=O)CCCNC(=O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000158291068 1424217978 /nfs/dbraw/zinc/21/79/78/1424217978.db2.gz JORUQJPZXBXGGH-UHFFFAOYSA-N 0 0 377.347 3.046 20 5 GGBDRN CN(C(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000158297918 1424220555 /nfs/dbraw/zinc/22/05/55/1424220555.db2.gz QJJOHVCRGTUCKE-INIZCTEOSA-N 0 0 399.422 3.178 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1-c1nc(-c2cccc(OCc3cccnc3)c2)no1 ZINC000158312196 1424223507 /nfs/dbraw/zinc/22/35/07/1424223507.db2.gz BNEUCTDQUGZHIQ-UHFFFAOYSA-N 0 0 378.348 3.019 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1-c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 ZINC000158313617 1424224121 /nfs/dbraw/zinc/22/41/21/1424224121.db2.gz UTSDSDLQDGIYCC-UHFFFAOYSA-N 0 0 382.311 3.372 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1c(F)cccc1F)C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158329009 1424227609 /nfs/dbraw/zinc/22/76/09/1424227609.db2.gz XKGGDWQGCOKWMQ-QGZVFWFLSA-N 0 0 391.374 3.290 20 5 GGBDRN COc1ccc(-c2nc(C)c([C@H](C)NC(=O)c3[nH]ncc3[N+](=O)[O-])s2)cc1 ZINC000158339341 1424230946 /nfs/dbraw/zinc/23/09/46/1424230946.db2.gz FXULBEUYKKLOLY-VIFPVBQESA-N 0 0 387.421 3.249 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N(C)c1cccc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000158355462 1424235435 /nfs/dbraw/zinc/23/54/35/1424235435.db2.gz VEXRXYSHINZBMD-MRXNPFEDSA-N 0 0 377.347 3.103 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@@H](C(=O)N(C)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000158377298 1424239911 /nfs/dbraw/zinc/23/99/11/1424239911.db2.gz LWNDRVQYMKRRQI-QGZVFWFLSA-N 0 0 381.432 3.418 20 5 GGBDRN CSc1ccc(N2C[C@H](C(=O)N(C)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 ZINC000158376027 1424240054 /nfs/dbraw/zinc/24/00/54/1424240054.db2.gz ZBOYNYWGAXDQRR-CYBMUJFWSA-N 0 0 385.445 3.333 20 5 GGBDRN CN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H](CCO)c1ccccc1 ZINC000158383893 1424241392 /nfs/dbraw/zinc/24/13/92/1424241392.db2.gz SIJIEIVXWOMGSS-GOSISDBHSA-N 0 0 383.448 3.391 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1nnc(-c2ccccn2)s1 ZINC000158386862 1424241851 /nfs/dbraw/zinc/24/18/51/1424241851.db2.gz PNHKASQMJLWMNF-UHFFFAOYSA-N 0 0 380.389 3.171 20 5 GGBDRN C[C@@H]1CCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1 ZINC000158419658 1424250090 /nfs/dbraw/zinc/25/00/90/1424250090.db2.gz CLKJYDZLRHYSKX-KGLIPLIRSA-N 0 0 375.425 3.178 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000158429583 1424252149 /nfs/dbraw/zinc/25/21/49/1424252149.db2.gz YYGFONSVUCUWLB-CQSZACIVSA-N 0 0 398.448 3.151 20 5 GGBDRN CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158437372 1424254545 /nfs/dbraw/zinc/25/45/45/1424254545.db2.gz XDNVOBCUOBFYLP-GOSISDBHSA-N 0 0 397.431 3.261 20 5 GGBDRN CC[C@]1(C)C[C@@H]1C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000158440023 1424254886 /nfs/dbraw/zinc/25/48/86/1424254886.db2.gz SSWAJQLHMWHXGU-MLGOLLRUSA-N 0 0 395.462 3.259 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N(C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000158449716 1424257438 /nfs/dbraw/zinc/25/74/38/1424257438.db2.gz JUGDWVWYQIBWBR-QGZVFWFLSA-N 0 0 377.347 3.103 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N(C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000158449569 1424257998 /nfs/dbraw/zinc/25/79/98/1424257998.db2.gz JUGDWVWYQIBWBR-KRWDZBQOSA-N 0 0 377.347 3.103 20 5 GGBDRN Cc1c(NC(=O)CCSCc2nc3ccccc3c(=O)[nH]2)cccc1[N+](=O)[O-] ZINC000158492701 1424271688 /nfs/dbraw/zinc/27/16/88/1424271688.db2.gz UWQVVHALOBMHEO-UHFFFAOYSA-N 0 0 398.444 3.402 20 5 GGBDRN O=C(Cn1cc(Cl)cc([N+](=O)[O-])c1=O)NCC1(c2ccccc2)CCCC1 ZINC000158550056 1424286875 /nfs/dbraw/zinc/28/68/75/1424286875.db2.gz VVTDWVQNLXVLSH-UHFFFAOYSA-N 0 0 389.839 3.038 20 5 GGBDRN NC(=O)NCc1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000180051667 1429714434 /nfs/dbraw/zinc/71/44/34/1429714434.db2.gz VXTNWBDSSVWOIP-UHFFFAOYSA-N 0 0 383.433 3.499 20 5 GGBDRN O=C(Cn1cc(Cl)cc([N+](=O)[O-])c1=O)N[C@@H](c1ccccc1)C1CCCC1 ZINC000158562189 1424289869 /nfs/dbraw/zinc/28/98/69/1424289869.db2.gz OPRBVYRUSOIOAV-SFHVURJKSA-N 0 0 389.839 3.458 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000158565351 1424290918 /nfs/dbraw/zinc/29/09/18/1424290918.db2.gz AQVNJMKZPRSAPC-AUUYWEPGSA-N 0 0 393.399 3.086 20 5 GGBDRN COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000158610675 1424301704 /nfs/dbraw/zinc/30/17/04/1424301704.db2.gz HBOMWPNMCBWUET-UHFFFAOYSA-N 0 0 385.420 3.471 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)Oc2ncccc21 ZINC000158616854 1424302389 /nfs/dbraw/zinc/30/23/89/1424302389.db2.gz XQCIAOBPSCOQHS-MNOVXSKESA-N 0 0 377.784 3.225 20 5 GGBDRN CC(C)C(=O)NCCCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000158617140 1424302419 /nfs/dbraw/zinc/30/24/19/1424302419.db2.gz GQZGDIAIMKYGMA-UHFFFAOYSA-N 0 0 385.420 3.279 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2cc(-c3ccccc3)on2)cc([N+](=O)[O-])c1F ZINC000180063246 1429720563 /nfs/dbraw/zinc/72/05/63/1429720563.db2.gz OWLZPOGGOOCLNE-UHFFFAOYSA-N 0 0 391.380 3.176 20 5 GGBDRN NC(=O)c1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1 ZINC000158675335 1424315473 /nfs/dbraw/zinc/31/54/73/1424315473.db2.gz CQAVYHHYMYYHSD-UHFFFAOYSA-N 0 0 382.298 3.034 20 5 GGBDRN COc1ccc([C@@H](C)N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)cc1 ZINC000180056822 1429717231 /nfs/dbraw/zinc/71/72/31/1429717231.db2.gz IENXDQRSJYRSJI-GFCCVEGCSA-N 0 0 382.413 3.433 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000158721035 1424327180 /nfs/dbraw/zinc/32/71/80/1424327180.db2.gz GBTXRYOQQAOANV-UHFFFAOYSA-N 0 0 376.800 3.272 20 5 GGBDRN CCOc1ccccc1[C@H](CC)NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000158735671 1424329987 /nfs/dbraw/zinc/32/99/87/1424329987.db2.gz AVTYJNHXHIOQHS-AWEZNQCLSA-N 0 0 393.827 3.076 20 5 GGBDRN CCc1ccc([C@@H](COC)NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)o1 ZINC000158738255 1424330861 /nfs/dbraw/zinc/33/08/61/1424330861.db2.gz BOAMXLCXRVUQHL-OAHLLOKOSA-N 0 0 384.392 3.053 20 5 GGBDRN CCc1ccc([C@H](COC)NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)o1 ZINC000158738379 1424330879 /nfs/dbraw/zinc/33/08/79/1424330879.db2.gz BOAMXLCXRVUQHL-HNNXBMFYSA-N 0 0 384.392 3.053 20 5 GGBDRN Cc1ccnc(N2CCN(C(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000158747942 1424333531 /nfs/dbraw/zinc/33/35/31/1424333531.db2.gz JYJWEYGIBXMQEJ-OAHLLOKOSA-N 0 0 386.477 3.128 20 5 GGBDRN CC(C)(C)N(Cc1cccc(F)c1)C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000158777560 1424339266 /nfs/dbraw/zinc/33/92/66/1424339266.db2.gz XDQHMYAKDVDFOR-UHFFFAOYSA-N 0 0 395.818 3.376 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@@H](O)c2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000158780233 1424339822 /nfs/dbraw/zinc/33/98/22/1424339822.db2.gz WTRCGEWIAVHTBZ-LJQANCHMSA-N 0 0 386.429 3.068 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H](O)c1ccc2ccccc2c1 ZINC000158784594 1424341565 /nfs/dbraw/zinc/34/15/65/1424341565.db2.gz GTKGQJXFSACFCC-GOSISDBHSA-N 0 0 386.429 3.068 20 5 GGBDRN CS(=O)(=O)N1CC[C@H](CNC(=O)c2c3ccccc3cc3ccccc32)C1 ZINC000158784393 1424341827 /nfs/dbraw/zinc/34/18/27/1424341827.db2.gz QYZOSOSLUPQBRA-OAHLLOKOSA-N 0 0 382.485 3.004 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)OCc1cn(-c2ccc(F)cc2Cl)nn1 ZINC000158794680 1424343928 /nfs/dbraw/zinc/34/39/28/1424343928.db2.gz DCIQAGFGGYUTLM-UHFFFAOYSA-N 0 0 390.758 3.254 20 5 GGBDRN O=C(CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(Cl)cc1 ZINC000158809590 1424347848 /nfs/dbraw/zinc/34/78/48/1424347848.db2.gz BFBRYKQUCRLZCP-UHFFFAOYSA-N 0 0 386.795 3.027 20 5 GGBDRN CN(C)C(=O)c1ccnc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000158827828 1424352073 /nfs/dbraw/zinc/35/20/73/1424352073.db2.gz ROQDFWSYSMNDOS-UHFFFAOYSA-N 0 0 383.433 3.427 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC(OC3CCCC3)CC2)cc([N+](=O)[O-])c1F ZINC000180062753 1429719807 /nfs/dbraw/zinc/71/98/07/1429719807.db2.gz CQWZUAHMUUCSAO-UHFFFAOYSA-N 0 0 386.445 3.155 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H]2CCCOc3ccccc32)cc([N+](=O)[O-])c1F ZINC000180062883 1429719896 /nfs/dbraw/zinc/71/98/96/1429719896.db2.gz YHLNPLGBNSSFQH-CQSZACIVSA-N 0 0 380.397 3.235 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])OCc1cn(-c2ccc(F)cc2Cl)nn1 ZINC000158844042 1424355665 /nfs/dbraw/zinc/35/56/65/1424355665.db2.gz GVLCCQXZDFESSS-UHFFFAOYSA-N 0 0 390.758 3.254 20 5 GGBDRN Cn1cc(Nc2cccc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)c2)cn1 ZINC000158851756 1424356889 /nfs/dbraw/zinc/35/68/89/1424356889.db2.gz WOWSHSJHXFNCJH-UHFFFAOYSA-N 0 0 377.404 3.270 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H]2CCCOc3ccccc32)cc([N+](=O)[O-])c1F ZINC000180062902 1429720352 /nfs/dbraw/zinc/72/03/52/1429720352.db2.gz YHLNPLGBNSSFQH-AWEZNQCLSA-N 0 0 380.397 3.235 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000158883185 1424363848 /nfs/dbraw/zinc/36/38/48/1424363848.db2.gz GVDRIMAMHSCUBI-YJBOKZPZSA-N 0 0 394.431 3.065 20 5 GGBDRN Cc1csc(CCCCNS(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)n1 ZINC000180064190 1429721029 /nfs/dbraw/zinc/72/10/29/1429721029.db2.gz JUWUNBCBQYFPKT-UHFFFAOYSA-N 0 0 387.458 3.108 20 5 GGBDRN Nc1c(Cl)cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1Cl ZINC000158895326 1424366222 /nfs/dbraw/zinc/36/62/22/1424366222.db2.gz WKLMACHTZHVNLC-UHFFFAOYSA-N 0 0 395.246 3.446 20 5 GGBDRN O=C1CCCN1c1ccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)nc1 ZINC000158910434 1424370262 /nfs/dbraw/zinc/37/02/62/1424370262.db2.gz MNJASZUFRNUNMN-UHFFFAOYSA-N 0 0 378.335 3.330 20 5 GGBDRN CCS[C@@H]1CCCCN(S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C1 ZINC000180073853 1429725703 /nfs/dbraw/zinc/72/57/03/1429725703.db2.gz WOLJRNDFOMENPH-GFCCVEGCSA-N 0 0 376.475 3.339 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000158947216 1424379624 /nfs/dbraw/zinc/37/96/24/1424379624.db2.gz RXLRBZXPEPHKGG-SJLPKXTDSA-N 0 0 386.452 3.082 20 5 GGBDRN CC(=O)N1CC[C@H](NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)C1 ZINC000158959302 1424381774 /nfs/dbraw/zinc/38/17/74/1424381774.db2.gz ZMWUKPRKGPGALF-HNNXBMFYSA-N 0 0 379.482 3.084 20 5 GGBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CNc2nncn2Cc2ccccc2)c1 ZINC000158962824 1424382403 /nfs/dbraw/zinc/38/24/03/1424382403.db2.gz FXRTUTGGOBNOJS-UHFFFAOYSA-N 0 0 375.335 3.448 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2ccc(F)cc2O1 ZINC000158977674 1424386104 /nfs/dbraw/zinc/38/61/04/1424386104.db2.gz JWJSXILAKPRXEI-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN(C)C[C@H]2CCCOC2)c1=S ZINC000159022442 1424398755 /nfs/dbraw/zinc/39/87/55/1424398755.db2.gz YXBVECDDZROVHP-CQSZACIVSA-N 0 0 391.497 3.325 20 5 GGBDRN O=C(C[C@@H](O)c1cccc(F)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000180069193 1429723390 /nfs/dbraw/zinc/72/33/90/1429723390.db2.gz UGUSJMHNRUVJSV-LJQANCHMSA-N 0 0 388.395 3.227 20 5 GGBDRN O=C(O[C@@H]([C@H]1CCCO1)C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000159067542 1424409583 /nfs/dbraw/zinc/40/95/83/1424409583.db2.gz BRUSBFUPAKEQGM-CABCVRRESA-N 0 0 388.342 3.462 20 5 GGBDRN COc1ccc(OCCN2CCO[C@]3(CCc4ccccc43)C2)c([N+](=O)[O-])c1 ZINC000159144191 1424427747 /nfs/dbraw/zinc/42/77/47/1424427747.db2.gz SCXGZCTVYAIOIA-OAQYLSRUSA-N 0 0 384.432 3.156 20 5 GGBDRN COc1ccc(OCCN2CCO[C@@]3(CCc4ccccc43)C2)c([N+](=O)[O-])c1 ZINC000159144316 1424427834 /nfs/dbraw/zinc/42/78/34/1424427834.db2.gz SCXGZCTVYAIOIA-NRFANRHFSA-N 0 0 384.432 3.156 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCOc2ccc(Cl)cc21 ZINC000159204554 1424442073 /nfs/dbraw/zinc/44/20/73/1424442073.db2.gz RGNNPMPOZRPTGV-UHFFFAOYSA-N 0 0 384.779 3.473 20 5 GGBDRN CCOc1ccc(Cl)cc1CCNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000159218859 1424446466 /nfs/dbraw/zinc/44/64/66/1424446466.db2.gz JJKVVWVWKFPHPJ-UHFFFAOYSA-N 0 0 394.859 3.209 20 5 GGBDRN O=C(NCCCCOc1ccc(F)cc1)NCCc1cccc([N+](=O)[O-])c1 ZINC000159218609 1424446476 /nfs/dbraw/zinc/44/64/76/1424446476.db2.gz OVECWMNLULVJSG-UHFFFAOYSA-N 0 0 375.400 3.435 20 5 GGBDRN O=C(Nc1cc(F)ccc1OC(F)F)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000159228115 1424450468 /nfs/dbraw/zinc/45/04/68/1424450468.db2.gz JFZIZDZXTLXKKS-UHFFFAOYSA-N 0 0 393.281 3.168 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)cc([N+](=O)[O-])c1F ZINC000180078098 1429727206 /nfs/dbraw/zinc/72/72/06/1429727206.db2.gz SDPJVFXRHLGJCB-BLLLJJGKSA-N 0 0 388.461 3.162 20 5 GGBDRN 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ZINC000159304537 1424478893 /nfs/dbraw/zinc/47/88/93/1424478893.db2.gz LGQBBQUTALMGBY-NVXWUHKLSA-N 0 0 394.431 3.065 20 5 GGBDRN O=C(Nc1cnn(C[C@H]2CCCO2)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000159325700 1424486222 /nfs/dbraw/zinc/48/62/22/1424486222.db2.gz SKZPJADQUFOYCX-QGZVFWFLSA-N 0 0 385.424 3.167 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CC[C@@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1F ZINC000180084414 1429729785 /nfs/dbraw/zinc/72/97/85/1429729785.db2.gz CSUXXMWRYJEWJA-HNNXBMFYSA-N 0 0 378.425 3.296 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000159333678 1424488507 /nfs/dbraw/zinc/48/85/07/1424488507.db2.gz GBRJOKWORVKFDD-KUHUBIRLSA-N 0 0 380.404 3.023 20 5 GGBDRN CC(C)N(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1cccc(C(F)(F)F)c1 ZINC000159340249 1424490073 /nfs/dbraw/zinc/49/00/73/1424490073.db2.gz DCHDLBZRYKZKGE-UHFFFAOYSA-N 0 0 383.326 3.217 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCCc1ccc(Cl)cc1 ZINC000159384389 1424497677 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379.482 3.228 20 5 GGBDRN C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@H](O)c1ccc(F)cc1 ZINC000162452823 1424854138 /nfs/dbraw/zinc/85/41/38/1424854138.db2.gz PXKDUSJWZIEXLL-YJYMSZOUSA-N 0 0 375.400 3.164 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)nc1 ZINC000162458807 1424854700 /nfs/dbraw/zinc/85/47/00/1424854700.db2.gz CCCXFSPUMVOYAP-OAHLLOKOSA-N 0 0 397.435 3.489 20 5 GGBDRN COc1ccc(CNc2nc(C)nn2C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000162467482 1424855849 /nfs/dbraw/zinc/85/58/49/1424855849.db2.gz KTGWNIVBJDNZNQ-UHFFFAOYSA-N 0 0 383.408 3.231 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(=O)Nc1ccc(F)c(F)c1F ZINC000162472393 1424856455 /nfs/dbraw/zinc/85/64/55/1424856455.db2.gz WUVKSWGUYCVPHQ-UHFFFAOYSA-N 0 0 382.298 3.081 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1c1ccc(COC)o1 ZINC000162516875 1424860692 /nfs/dbraw/zinc/86/06/92/1424860692.db2.gz DKMMFFDMIHMDAD-MRXNPFEDSA-N 0 0 394.449 3.422 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)Cc2ccccc2[N+](=O)[O-])o1 ZINC000162521160 1424861248 /nfs/dbraw/zinc/86/12/48/1424861248.db2.gz MXFNIIUTHBRPLX-INIZCTEOSA-N 0 0 380.422 3.001 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000162530884 1424863115 /nfs/dbraw/zinc/86/31/15/1424863115.db2.gz SJBXAYOVQBTSFE-GJZGRUSLSA-N 0 0 376.457 3.452 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(NC(=O)c2ccsc2)CC1 ZINC000162537365 1424863595 /nfs/dbraw/zinc/86/35/95/1424863595.db2.gz MTCZARGGGPIIDX-UHFFFAOYSA-N 0 0 388.449 3.391 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)Nc3ccc([N+](=O)[O-])cc3C)n2)cc1 ZINC000162537088 1424863616 /nfs/dbraw/zinc/86/36/16/1424863616.db2.gz ZNGPTUKUYQUXNR-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)o1 ZINC000162548766 1424865050 /nfs/dbraw/zinc/86/50/50/1424865050.db2.gz ZAXFUPKEMSAADB-AWEZNQCLSA-N 0 0 398.412 3.308 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000162559721 1424865922 /nfs/dbraw/zinc/86/59/22/1424865922.db2.gz HDLPENJFWOTBNQ-OAHLLOKOSA-N 0 0 380.422 3.168 20 5 GGBDRN O=C(O[C@H]([C@@H]1CCCO1)C(F)(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000162581983 1424868742 /nfs/dbraw/zinc/86/87/42/1424868742.db2.gz OSXFNDMAHDSMJP-UONOGXRCSA-N 0 0 385.298 3.047 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)[C@@H](O)c2ccc(F)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000162587344 1424869193 /nfs/dbraw/zinc/86/91/93/1424869193.db2.gz ZPEIYICFVZWBJH-APPDUMDISA-N 0 0 391.355 3.111 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)[C@H](O)c2ccc(F)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000162587093 1424869237 /nfs/dbraw/zinc/86/92/37/1424869237.db2.gz ZPEIYICFVZWBJH-GTNSWQLSSA-N 0 0 391.355 3.111 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000162595633 1424870433 /nfs/dbraw/zinc/87/04/33/1424870433.db2.gz UROZPRPEDSJKDR-CQSZACIVSA-N 0 0 376.457 3.309 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCCN(C(=O)c2ccsc2)CC1 ZINC000162612596 1424871781 /nfs/dbraw/zinc/87/17/81/1424871781.db2.gz FOCDMLBDSRUEPM-UHFFFAOYSA-N 0 0 388.449 3.345 20 5 GGBDRN C[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@@H](O)c1ccc(F)cc1 ZINC000162621312 1424872607 /nfs/dbraw/zinc/87/26/07/1424872607.db2.gz CVOAQHTXCYXUBT-BJOHPYRUSA-N 0 0 397.200 3.348 20 5 GGBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCS[C@H]2COCC[C@@H]21 ZINC000162649277 1424874938 /nfs/dbraw/zinc/87/49/38/1424874938.db2.gz RRCSHVOSVROZEC-GJZGRUSLSA-N 0 0 391.474 3.065 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000162675454 1424878603 /nfs/dbraw/zinc/87/86/03/1424878603.db2.gz LOMQGCZIUPZKFV-INIZCTEOSA-N 0 0 388.811 3.484 20 5 GGBDRN COc1ccccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000162689317 1424880442 /nfs/dbraw/zinc/88/04/42/1424880442.db2.gz JBCLHSMPQITIML-UHFFFAOYSA-N 0 0 390.339 3.101 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)cccc1C(F)(F)F ZINC000162708816 1424883459 /nfs/dbraw/zinc/88/34/59/1424883459.db2.gz PGNBPMDCBPGDQZ-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000162733819 1424886237 /nfs/dbraw/zinc/88/62/37/1424886237.db2.gz VOEISKUBTUPIGE-ZDUSSCGKSA-N 0 0 375.372 3.361 20 5 GGBDRN CC(C)[C@@H](O)C(C)(C)CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000162733922 1424886266 /nfs/dbraw/zinc/88/62/66/1424886266.db2.gz VOEISKUBTUPIGE-CYBMUJFWSA-N 0 0 375.372 3.361 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCC1(c2cccc(Cl)c2)CCCC1 ZINC000162796582 1424891087 /nfs/dbraw/zinc/89/10/87/1424891087.db2.gz UEONPXOEOZDTED-UHFFFAOYSA-N 0 0 389.839 3.038 20 5 GGBDRN Cc1c(CC(=O)NCC2(c3ccc(F)cc3)CCOCC2)cccc1[N+](=O)[O-] ZINC000162798972 1424891344 /nfs/dbraw/zinc/89/13/44/1424891344.db2.gz KJHHPGLJVBTVKG-UHFFFAOYSA-N 0 0 386.423 3.449 20 5 GGBDRN O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000162850051 1424896785 /nfs/dbraw/zinc/89/67/85/1424896785.db2.gz QZJDGDLTHXOBIH-KXBFYZLASA-N 0 0 391.493 3.324 20 5 GGBDRN Cc1ccc2cc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)ccc2n1 ZINC000162873781 1424898390 /nfs/dbraw/zinc/89/83/90/1424898390.db2.gz LMYUUKWDVATIFR-INIZCTEOSA-N 0 0 377.404 3.173 20 5 GGBDRN Cc1ccc(C)c([C@H]2CCCN2C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000162911095 1424904896 /nfs/dbraw/zinc/90/48/96/1424904896.db2.gz RLWIQXMSKDDQSR-LJQANCHMSA-N 0 0 381.432 3.305 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1 ZINC000826499944 1424905400 /nfs/dbraw/zinc/90/54/00/1424905400.db2.gz FPVRUOIUSYHCQJ-AEFFLSMTSA-N 0 0 378.436 3.276 20 5 GGBDRN O=C(NCCc1cn2ccccc2n1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000162922074 1424906254 /nfs/dbraw/zinc/90/62/54/1424906254.db2.gz GCDHBLFENLELQW-UHFFFAOYSA-N 0 0 379.420 3.159 20 5 GGBDRN Cc1c(C(=O)n2ccc(=NCC(F)(F)F)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000162920763 1424906579 /nfs/dbraw/zinc/90/65/79/1424906579.db2.gz SZYYPGCTSLYTMY-UHFFFAOYSA-N 0 0 398.297 3.073 20 5 GGBDRN O=C(NCCc1cc2ccccc2o1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000162959166 1424913532 /nfs/dbraw/zinc/91/35/32/1424913532.db2.gz QRXUSSZNJKSNTF-UHFFFAOYSA-N 0 0 376.372 3.499 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccccc1-c1nnc(-c2ccccc2)[nH]1 ZINC000162988445 1424918818 /nfs/dbraw/zinc/91/88/18/1424918818.db2.gz RFQWWKDKANQLKS-UHFFFAOYSA-N 0 0 389.375 3.033 20 5 GGBDRN CN(Cc1ccccc1)c1ccccc1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000162997507 1424920273 /nfs/dbraw/zinc/92/02/73/1424920273.db2.gz QWXIIDSRIRFPCR-UHFFFAOYSA-N 0 0 392.415 3.032 20 5 GGBDRN CNC(=O)Cc1noc(-c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)n1 ZINC000163046337 1424930424 /nfs/dbraw/zinc/93/04/24/1424930424.db2.gz CCQQTJVWWOBSNI-UHFFFAOYSA-N 0 0 384.417 3.393 20 5 GGBDRN COc1ccc(CNC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000163112208 1424942536 /nfs/dbraw/zinc/94/25/36/1424942536.db2.gz VWZGTLVFFLGQHF-UHFFFAOYSA-N 0 0 378.816 3.168 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCC[C@@H](Nc3ccccc3)C2)cc1 ZINC000180154206 1429766484 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0 0 399.428 3.066 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](c1ccccc1)c1cccnc1 ZINC000171768899 1425815688 /nfs/dbraw/zinc/81/56/88/1425815688.db2.gz LXDCDWFZAKGAJI-SFHVURJKSA-N 0 0 383.429 3.366 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H](c2ccccc2)c2cccnc2)c([N+](=O)[O-])c1 ZINC000171769338 1425815965 /nfs/dbraw/zinc/81/59/65/1425815965.db2.gz YJPBYIRDHJBUSR-LJQANCHMSA-N 0 0 399.428 3.066 20 5 GGBDRN O=C(NCCCn1ccc2ccccc21)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171771515 1425816312 /nfs/dbraw/zinc/81/63/12/1425816312.db2.gz YUZFFUJVXBLFIG-UHFFFAOYSA-N 0 0 390.399 3.211 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1[N+](=O)[O-] ZINC000171773801 1425816918 /nfs/dbraw/zinc/81/69/18/1425816918.db2.gz FKEOILFNLUPRGW-UHFFFAOYSA-N 0 0 393.375 3.458 20 5 GGBDRN O=C(NCc1nc(-c2cccc(Cl)c2)no1)NCc1ccc([N+](=O)[O-])cc1 ZINC000171783213 1425819558 /nfs/dbraw/zinc/81/95/58/1425819558.db2.gz FCKQIFDBHJJHLG-UHFFFAOYSA-N 0 0 387.783 3.298 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000171804132 1425824836 /nfs/dbraw/zinc/82/48/36/1425824836.db2.gz HOSYPBYPHYBQDV-UHFFFAOYSA-N 0 0 390.827 3.269 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)c2ccc(OCC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000171804411 1425824877 /nfs/dbraw/zinc/82/48/77/1425824877.db2.gz FFBIJJNNAGJNNV-SECBINFHSA-N 0 0 386.330 3.312 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)COc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000171804282 1425825026 /nfs/dbraw/zinc/82/50/26/1425825026.db2.gz DCXXLGKCFUZYSG-VIFPVBQESA-N 0 0 386.330 3.096 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(-n3cnc4ccccc43)cc2)c1[N+](=O)[O-] ZINC000171806398 1425825271 /nfs/dbraw/zinc/82/52/71/1425825271.db2.gz KBCQANPCIHAPGA-UHFFFAOYSA-N 0 0 390.403 3.149 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)c1[N+](=O)[O-] ZINC000171806330 1425825397 /nfs/dbraw/zinc/82/53/97/1425825397.db2.gz BODISGJEYSARNF-ZDUSSCGKSA-N 0 0 380.351 3.289 20 5 GGBDRN CCc1n[nH]c(C(=O)NC[C@@H]2CCN(c3cc(Cl)ccc3C)C2)c1[N+](=O)[O-] ZINC000171807354 1425825873 /nfs/dbraw/zinc/82/58/73/1425825873.db2.gz WRBGAEIMLDWZOR-LBPRGKRZSA-N 0 0 391.859 3.098 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000171807806 1425825939 /nfs/dbraw/zinc/82/59/39/1425825939.db2.gz QIKWBLKSHZHOSY-CYBMUJFWSA-N 0 0 399.234 3.401 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1c2ccccc2oc1C(=O)c1ccco1 ZINC000171822011 1425828984 /nfs/dbraw/zinc/82/89/84/1425828984.db2.gz WNYRYROQFIETHO-UHFFFAOYSA-N 0 0 380.316 3.000 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1C(=O)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000171824878 1425830015 /nfs/dbraw/zinc/83/00/15/1425830015.db2.gz MCQKEOQIZMZWII-SOUVJXGZSA-N 0 0 391.493 3.442 20 5 GGBDRN CCN(Cc1cccs1)C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171827629 1425830401 /nfs/dbraw/zinc/83/04/01/1425830401.db2.gz OLTNPYDHMVLZLQ-CYBMUJFWSA-N 0 0 393.490 3.371 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1ccc(Cl)cc1Cl ZINC000171832927 1425831646 /nfs/dbraw/zinc/83/16/46/1425831646.db2.gz SRVLGNNZWNOTDX-OAHLLOKOSA-N 0 0 384.219 3.434 20 5 GGBDRN C[C@@H](Cc1cccs1)NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171842119 1425833252 /nfs/dbraw/zinc/83/32/52/1425833252.db2.gz IGHMGJTVJWGGAB-AAEUAGOBSA-N 0 0 393.490 3.070 20 5 GGBDRN CCc1nc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)sc1C ZINC000171847872 1425834049 /nfs/dbraw/zinc/83/40/49/1425834049.db2.gz KDMKXZHXTCNWKK-LLVKDONJSA-N 0 0 394.478 3.227 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1NCCSC(F)(F)F ZINC000171846682 1425834234 /nfs/dbraw/zinc/83/42/34/1425834234.db2.gz CKNJVXVTAZPWTM-UHFFFAOYSA-N 0 0 380.316 3.256 20 5 GGBDRN CCc1nc([C@@H](C)NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cs1 ZINC000171857182 1425836281 /nfs/dbraw/zinc/83/62/81/1425836281.db2.gz OHOZJDARBLQYJF-CYBMUJFWSA-N 0 0 389.481 3.207 20 5 GGBDRN CNC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000171872557 1425840030 /nfs/dbraw/zinc/84/00/30/1425840030.db2.gz HQSQJZGFCCNPQN-CQSZACIVSA-N 0 0 399.472 3.344 20 5 GGBDRN COc1cccc([C@H](O)CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000171874850 1425840308 /nfs/dbraw/zinc/84/03/08/1425840308.db2.gz ZPAKIFSLQLYQDD-QGZVFWFLSA-N 0 0 399.428 3.190 20 5 GGBDRN COc1cccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c1 ZINC000171875923 1425840625 /nfs/dbraw/zinc/84/06/25/1425840625.db2.gz NFURNIMVVFDLLX-FQEVSTJZSA-N 0 0 399.447 3.057 20 5 GGBDRN CCc1nc(CN2CCC(CNC(=O)c3csc([N+](=O)[O-])c3)CC2)cs1 ZINC000171880633 1425841683 /nfs/dbraw/zinc/84/16/83/1425841683.db2.gz XSQFFXRHYFGUBE-UHFFFAOYSA-N 0 0 394.522 3.317 20 5 GGBDRN CSc1nc(C2CC2)nc(C)c1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000171890006 1425844393 /nfs/dbraw/zinc/84/43/93/1425844393.db2.gz UZCBIQQPEHRAHB-UHFFFAOYSA-N 0 0 387.465 3.134 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000171908897 1425848951 /nfs/dbraw/zinc/84/89/51/1425848951.db2.gz WHJDNXJVIIUHOW-UHFFFAOYSA-N 0 0 398.463 3.253 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)c1c(Cl)cccc1[N+](=O)[O-])CC2 ZINC000171917576 1425851817 /nfs/dbraw/zinc/85/18/17/1425851817.db2.gz XOJKTQRJXUTMLM-UHFFFAOYSA-N 0 0 376.796 3.464 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCCc2csc3ccccc23)c([N+](=O)[O-])c1 ZINC000171918651 1425852566 /nfs/dbraw/zinc/85/25/66/1425852566.db2.gz AGTFQQNLNPVKNZ-UHFFFAOYSA-N 0 0 384.413 3.360 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000171922604 1425853093 /nfs/dbraw/zinc/85/30/93/1425853093.db2.gz FTDZJXZTBUEFRH-GFCCVEGCSA-N 0 0 399.428 3.143 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCCCc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000171922700 1425853164 /nfs/dbraw/zinc/85/31/64/1425853164.db2.gz JGMZJHBTHMVHNM-UHFFFAOYSA-N 0 0 376.796 3.189 20 5 GGBDRN CC(C)S(=O)(=O)Cc1cccc(NC(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000171921073 1425853224 /nfs/dbraw/zinc/85/32/24/1425853224.db2.gz SRFHTNRHIXKKBO-UHFFFAOYSA-N 0 0 391.449 3.240 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)Oc1ccc(F)cc1Cl ZINC000171927615 1425854449 /nfs/dbraw/zinc/85/44/49/1425854449.db2.gz UUPGOQBIWZNRGO-JTQLQIEISA-N 0 0 382.775 3.480 20 5 GGBDRN CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000171938052 1425856908 /nfs/dbraw/zinc/85/69/08/1425856908.db2.gz LRVNXFYRHABNJL-SFHVURJKSA-N 0 0 383.448 3.081 20 5 GGBDRN O=C(Nc1ccc(OCC2CC2)cc1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000171947247 1425859271 /nfs/dbraw/zinc/85/92/71/1425859271.db2.gz BJZZIJPUDLXCPT-UHFFFAOYSA-N 0 0 379.376 3.217 20 5 GGBDRN Cc1c([C@H](C)Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])cnn1C ZINC000171972996 1425865533 /nfs/dbraw/zinc/86/55/33/1425865533.db2.gz GALRZJRRXQQPOM-QMMMGPOBSA-N 0 0 392.359 3.103 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccccc1C)C(C)C ZINC000171979694 1425866445 /nfs/dbraw/zinc/86/64/45/1425866445.db2.gz PNZQQLAQOUYYGW-SFHVURJKSA-N 0 0 385.420 3.364 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)N(C)C ZINC000171980890 1425867173 /nfs/dbraw/zinc/86/71/73/1425867173.db2.gz GWYXASSBIHYCIW-LLVKDONJSA-N 0 0 391.811 3.247 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N(Cc1ccccn1)C1CC1 ZINC000171986900 1425868211 /nfs/dbraw/zinc/86/82/11/1425868211.db2.gz IMYNWDWWNQNDNB-UHFFFAOYSA-N 0 0 383.376 3.155 20 5 GGBDRN COc1cc(OCC(=O)N(C)CCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000172007786 1425872578 /nfs/dbraw/zinc/87/25/78/1425872578.db2.gz VIHCKYMCJADMCI-UHFFFAOYSA-N 0 0 378.812 3.337 20 5 GGBDRN NC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000172012560 1425873675 /nfs/dbraw/zinc/87/36/75/1425873675.db2.gz REIZJDMUZIRSJM-CYBMUJFWSA-N 0 0 385.445 3.084 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2cccs2)C[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000172015759 1425874268 /nfs/dbraw/zinc/87/42/68/1425874268.db2.gz ZIYRTZKZCOMMCK-CQSZACIVSA-N 0 0 396.490 3.335 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000172015782 1425874319 /nfs/dbraw/zinc/87/43/19/1425874319.db2.gz QUUMMQFKMYBIII-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000172018872 1425875238 /nfs/dbraw/zinc/87/52/38/1425875238.db2.gz KXAQJAYBNRADGA-KSSFIOAISA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000172018876 1425875317 /nfs/dbraw/zinc/87/53/17/1425875317.db2.gz KXAQJAYBNRADGA-KDOFPFPSSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](COCC(C)C)c2ccco2)ccc1[N+](=O)[O-] ZINC000172019716 1425875778 /nfs/dbraw/zinc/87/57/78/1425875778.db2.gz ZQNBETMWGWWJIF-OAHLLOKOSA-N 0 0 382.438 3.188 20 5 GGBDRN Cc1cc([C@@]2(C)NC(=O)N(Cc3cc([N+](=O)[O-])ccc3Cl)C2=O)c(C)o1 ZINC000172024536 1425876614 /nfs/dbraw/zinc/87/66/14/1425876614.db2.gz LQACBZYSUGHPHP-QGZVFWFLSA-N 0 0 377.784 3.425 20 5 GGBDRN C[C@@]1(c2ccccc2F)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000172024365 1425876692 /nfs/dbraw/zinc/87/66/92/1425876692.db2.gz AXPJOOHRCLFNGI-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@]1(c2ccccc2F)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000172024368 1425876726 /nfs/dbraw/zinc/87/67/26/1425876726.db2.gz AXPJOOHRCLFNGI-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN COc1cc(CCNC(=O)c2c(F)cccc2Cl)c([N+](=O)[O-])cc1OC ZINC000172028677 1425877668 /nfs/dbraw/zinc/87/76/68/1425877668.db2.gz IZYDPKCOXSIWMM-UHFFFAOYSA-N 0 0 382.775 3.377 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000172029079 1425878362 /nfs/dbraw/zinc/87/83/62/1425878362.db2.gz DSNSEOCHYWJBQM-NSHDSACASA-N 0 0 377.372 3.312 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c(C)c1 ZINC000172034772 1425879357 /nfs/dbraw/zinc/87/93/57/1425879357.db2.gz ILHGXTVLHBGEDZ-UHFFFAOYSA-N 0 0 389.839 3.471 20 5 GGBDRN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)N1CCc2sccc2C1 ZINC000172050106 1425882383 /nfs/dbraw/zinc/88/23/83/1425882383.db2.gz FDCNSSFBVSLLNZ-GFCCVEGCSA-N 0 0 393.896 3.415 20 5 GGBDRN O=[N+]([O-])c1cnn(Cc2nc(-c3ccc(COc4ccccc4)cc3)no2)c1 ZINC000172051245 1425883073 /nfs/dbraw/zinc/88/30/73/1425883073.db2.gz ZRLUKFMCGDLDNP-UHFFFAOYSA-N 0 0 377.360 3.469 20 5 GGBDRN COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172053778 1425883547 /nfs/dbraw/zinc/88/35/47/1425883547.db2.gz UEMLEFLZJNYIND-RCBQFDQVSA-N 0 0 380.828 3.123 20 5 GGBDRN CC(C)c1nc(C(=O)NCc2ccc([N+](=O)[O-])cc2)nn1-c1cccc(F)c1 ZINC000172058658 1425885619 /nfs/dbraw/zinc/88/56/19/1425885619.db2.gz ZDYCCZZBZPYTIR-UHFFFAOYSA-N 0 0 383.383 3.368 20 5 GGBDRN Cc1cc(CC(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000172085592 1425893549 /nfs/dbraw/zinc/89/35/49/1425893549.db2.gz IZNYUCLYLZELNI-UHFFFAOYSA-N 0 0 381.344 3.292 20 5 GGBDRN C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000172093137 1425894492 /nfs/dbraw/zinc/89/44/92/1425894492.db2.gz YTQRTGTXHVLQTJ-BBRMVZONSA-N 0 0 388.445 3.017 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000172109077 1425898276 /nfs/dbraw/zinc/89/82/76/1425898276.db2.gz CEGCUCRUGNCMAQ-CYBMUJFWSA-N 0 0 391.449 3.331 20 5 GGBDRN C[C@@H](CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)NC(=O)OC(C)(C)C ZINC000172115454 1425900458 /nfs/dbraw/zinc/90/04/58/1425900458.db2.gz KPSFXYBCKTULEC-NSHDSACASA-N 0 0 385.848 3.210 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000172117095 1425901469 /nfs/dbraw/zinc/90/14/69/1425901469.db2.gz XJYJJQGOQOPPKY-IFXJQAMLSA-N 0 0 387.436 3.476 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1noc(C)n1 ZINC000172119159 1425902445 /nfs/dbraw/zinc/90/24/45/1425902445.db2.gz JGSSLHIQFCSRQC-INIZCTEOSA-N 0 0 383.364 3.206 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172121028 1425903394 /nfs/dbraw/zinc/90/33/94/1425903394.db2.gz SYXQLHQUQPQGNG-CQSZACIVSA-N 0 0 397.859 3.306 20 5 GGBDRN COc1ccc(CN(C)C(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000172157084 1425924224 /nfs/dbraw/zinc/92/42/24/1425924224.db2.gz UUKQJYWONHJVCJ-UHFFFAOYSA-N 0 0 385.464 3.472 20 5 GGBDRN CCOc1ccccc1CN(C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000172170112 1425930778 /nfs/dbraw/zinc/93/07/78/1425930778.db2.gz XBMSTLRYYPVNIU-AWEZNQCLSA-N 0 0 387.436 3.461 20 5 GGBDRN CCOc1ccccc1CN(C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000172170116 1425930821 /nfs/dbraw/zinc/93/08/21/1425930821.db2.gz XBMSTLRYYPVNIU-CQSZACIVSA-N 0 0 387.436 3.461 20 5 GGBDRN CCOCCCNC(=O)C1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172175567 1425934208 /nfs/dbraw/zinc/93/42/08/1425934208.db2.gz HEYHQNXYBIYWLH-UHFFFAOYSA-N 0 0 383.876 3.003 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)CCC1CCCCC1 ZINC000172178609 1425935653 /nfs/dbraw/zinc/93/56/53/1425935653.db2.gz DMUDAVYDBJEROD-CYBMUJFWSA-N 0 0 377.441 3.407 20 5 GGBDRN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000172179012 1425935881 /nfs/dbraw/zinc/93/58/81/1425935881.db2.gz UIKWLHBFNVWFGV-OAHLLOKOSA-N 0 0 396.451 3.128 20 5 GGBDRN C[C@H]1c2ccccc2CCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000172211313 1425948912 /nfs/dbraw/zinc/94/89/12/1425948912.db2.gz MVKUJOQEHTWFPJ-LBPRGKRZSA-N 0 0 387.823 3.124 20 5 GGBDRN C[C@@H]1c2ccccc2CCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000172211309 1425948963 /nfs/dbraw/zinc/94/89/63/1425948963.db2.gz MVKUJOQEHTWFPJ-GFCCVEGCSA-N 0 0 387.823 3.124 20 5 GGBDRN O=C(N[C@@H]1CCc2n[nH]cc2C1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000172216673 1425950822 /nfs/dbraw/zinc/95/08/22/1425950822.db2.gz AGTGVGIRFQUSBU-CQSZACIVSA-N 0 0 378.388 3.398 20 5 GGBDRN O=C(N[C@H]1CCc2n[nH]cc2C1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000172216678 1425951058 /nfs/dbraw/zinc/95/10/58/1425951058.db2.gz AGTGVGIRFQUSBU-AWEZNQCLSA-N 0 0 378.388 3.398 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000172231928 1425957522 /nfs/dbraw/zinc/95/75/22/1425957522.db2.gz MGRZAFQBYNHYRF-GFCCVEGCSA-N 0 0 394.815 3.115 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000172231933 1425957870 /nfs/dbraw/zinc/95/78/70/1425957870.db2.gz MGRZAFQBYNHYRF-LBPRGKRZSA-N 0 0 394.815 3.115 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC(F)F ZINC000172236420 1425959855 /nfs/dbraw/zinc/95/98/55/1425959855.db2.gz MKOSZRLMULDCQY-NSHDSACASA-N 0 0 393.346 3.321 20 5 GGBDRN CC(C)CCc1noc(CS(=O)(=O)Cc2cc([N+](=O)[O-])ccc2Cl)n1 ZINC000172237651 1425960647 /nfs/dbraw/zinc/96/06/47/1425960647.db2.gz OAIRBIOPCSZJHJ-UHFFFAOYSA-N 0 0 387.845 3.335 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCc1ccc2c(c1)CCO2 ZINC000172238596 1425960664 /nfs/dbraw/zinc/96/06/64/1425960664.db2.gz IOPMUDOVCLYTIR-UHFFFAOYSA-N 0 0 390.823 3.311 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(CS(=O)(=O)Cc2cccc3c2OCCO3)c1 ZINC000172237655 1425960740 /nfs/dbraw/zinc/96/07/40/1425960740.db2.gz JWIDXNCAEDSCSN-UHFFFAOYSA-N 0 0 383.809 3.134 20 5 GGBDRN C[C@H](c1ccc(NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1)N1CCOCC1 ZINC000172249970 1425966687 /nfs/dbraw/zinc/96/66/87/1425966687.db2.gz VJVMGMKRYLNSRO-OAHLLOKOSA-N 0 0 384.436 3.310 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccc(C[S@](=O)C2CCCCC2)c1 ZINC000172254821 1425970135 /nfs/dbraw/zinc/97/01/35/1425970135.db2.gz AXZBRWVLKJUIPH-MHZLTWQESA-N 0 0 390.465 3.011 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@H](OCc2ccncc2)C1 ZINC000172255103 1425970164 /nfs/dbraw/zinc/97/01/64/1425970164.db2.gz WYEJXLXIYJIUFN-SFHVURJKSA-N 0 0 396.447 3.021 20 5 GGBDRN Cc1nc(-c2ccc(S(=O)(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2)co1 ZINC000172257218 1425970899 /nfs/dbraw/zinc/97/08/99/1425970899.db2.gz ANXRVGUPCGSVQL-UHFFFAOYSA-N 0 0 387.417 3.379 20 5 GGBDRN COc1ccc(CN2CC[C@H](Nc3ccc(Cl)cc3[N+](=O)[O-])C2=O)cc1 ZINC000172281192 1425978515 /nfs/dbraw/zinc/97/85/15/1425978515.db2.gz JMLSUOOIGOMESY-INIZCTEOSA-N 0 0 375.812 3.470 20 5 GGBDRN COc1ccc(CN2CC[C@@H](Nc3ccc(Cl)cc3[N+](=O)[O-])C2=O)cc1 ZINC000172281200 1425978737 /nfs/dbraw/zinc/97/87/37/1425978737.db2.gz JMLSUOOIGOMESY-MRXNPFEDSA-N 0 0 375.812 3.470 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccc(OCC2CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000172285662 1425981609 /nfs/dbraw/zinc/98/16/09/1425981609.db2.gz HXQIYGXGWOPHBU-CYBMUJFWSA-N 0 0 383.404 3.200 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)NC1(c2ccccc2F)CC1 ZINC000172315337 1425992599 /nfs/dbraw/zinc/99/25/99/1425992599.db2.gz HGDPHAADCAXAAT-UHFFFAOYSA-N 0 0 377.759 3.131 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc2ccccc2c1 ZINC000172322785 1425997627 /nfs/dbraw/zinc/99/76/27/1425997627.db2.gz XAANFFUQMXQDAS-UHFFFAOYSA-N 0 0 379.372 3.012 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N[C@H]2CS(=O)(=O)c3ccccc32)cc1[N+](=O)[O-] ZINC000172326743 1425999964 /nfs/dbraw/zinc/99/99/64/1425999964.db2.gz ZAZAGTIRHDCKOX-HNNXBMFYSA-N 0 0 388.445 3.151 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(C(=O)NC(C)(C)CC)cc2)c1[N+](=O)[O-] ZINC000172338858 1426005981 /nfs/dbraw/zinc/00/59/81/1426005981.db2.gz GYMZBFWPPUKMFX-UHFFFAOYSA-N 0 0 387.440 3.441 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc3[nH]c([C@H]4CCCO4)nc3c2)c1[N+](=O)[O-] ZINC000172342984 1426008051 /nfs/dbraw/zinc/00/80/51/1426008051.db2.gz KFFQHBCZKMOYMZ-CQSZACIVSA-N 0 0 384.396 3.251 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc3[nH]c(-c4ccccn4)nc3c2)c1[N+](=O)[O-] ZINC000172351820 1426012413 /nfs/dbraw/zinc/01/24/13/1426012413.db2.gz PLIRFKHKKFZJTG-UHFFFAOYSA-N 0 0 391.391 3.461 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1cccnc1N1CCOCC1 ZINC000172361271 1426014813 /nfs/dbraw/zinc/01/48/13/1426014813.db2.gz RKNAIRWVHNQWTI-UHFFFAOYSA-N 0 0 377.784 3.007 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C ZINC000172376471 1426019188 /nfs/dbraw/zinc/01/91/88/1426019188.db2.gz WZONVCWJLPHSPX-CABCVRRESA-N 0 0 377.441 3.247 20 5 GGBDRN C[C@H](O)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000172402722 1426027865 /nfs/dbraw/zinc/02/78/65/1426027865.db2.gz GQMNKABTBLKEKZ-JTQLQIEISA-N 0 0 379.210 3.341 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000172406329 1426028392 /nfs/dbraw/zinc/02/83/92/1426028392.db2.gz HBXPDZUYFBSWOI-UHFFFAOYSA-N 0 0 390.783 3.119 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)CC2 ZINC000172406491 1426028583 /nfs/dbraw/zinc/02/85/83/1426028583.db2.gz YIDQFPSENKONOQ-UHFFFAOYSA-N 0 0 376.796 3.464 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCN(Cc2cccc(O)c2)CC1 ZINC000172407546 1426029183 /nfs/dbraw/zinc/02/91/83/1426029183.db2.gz PLFXNWUUBZEDAQ-UHFFFAOYSA-N 0 0 397.456 3.473 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CC(c3c(F)cccc3F)=NO2)c([N+](=O)[O-])c1 ZINC000172407706 1426029365 /nfs/dbraw/zinc/02/93/65/1426029365.db2.gz RXBVQCCYTJEVBX-OAHLLOKOSA-N 0 0 377.303 3.013 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@H]1CC(c2c(F)cccc2F)=NO1 ZINC000172409922 1426029875 /nfs/dbraw/zinc/02/98/75/1426029875.db2.gz JMTBBAHKTGUQTA-CQSZACIVSA-N 0 0 383.257 3.283 20 5 GGBDRN O=C(Nc1ccc(N2CCCS2(=O)=O)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000172409685 1426029916 /nfs/dbraw/zinc/02/99/16/1426029916.db2.gz YBJOAKYNQPKXKC-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN O=C(NCc1cccc(CN2CCCC2=O)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000172412570 1426030788 /nfs/dbraw/zinc/03/07/88/1426030788.db2.gz DDTWWILTUPPGSV-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN CCN(C)C(=O)c1cccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000172414123 1426031877 /nfs/dbraw/zinc/03/18/77/1426031877.db2.gz XNEQATBWNGDOHT-UHFFFAOYSA-N 0 0 383.448 3.439 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 ZINC000172414593 1426031913 /nfs/dbraw/zinc/03/19/13/1426031913.db2.gz YIFLXCQKXUEOAP-UHFFFAOYSA-N 0 0 383.404 3.304 20 5 GGBDRN O=C(Cc1cnn(-c2ccccc2)c1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000172414304 1426032073 /nfs/dbraw/zinc/03/20/73/1426032073.db2.gz DTGWBDNTPDPSHU-UHFFFAOYSA-N 0 0 378.432 3.462 20 5 GGBDRN CCS(=O)(=O)c1ccccc1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000172415306 1426032656 /nfs/dbraw/zinc/03/26/56/1426032656.db2.gz WLWUTPVZJRIIKT-UHFFFAOYSA-N 0 0 390.461 3.141 20 5 GGBDRN O=C(CCc1nc(-c2ccoc2)no1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000172415654 1426033258 /nfs/dbraw/zinc/03/32/58/1426033258.db2.gz ATEWXUDZWKHCTF-UHFFFAOYSA-N 0 0 384.392 3.310 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)c1cnn(-c2ccccc2)c1 ZINC000172415936 1426033350 /nfs/dbraw/zinc/03/33/50/1426033350.db2.gz AHAZPTIHQDCADC-UHFFFAOYSA-N 0 0 392.415 3.102 20 5 GGBDRN O=C(CCn1c(=O)oc2cc(Cl)ccc21)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172421102 1426036027 /nfs/dbraw/zinc/03/60/27/1426036027.db2.gz RQTITLTUBDKEEZ-UHFFFAOYSA-N 0 0 387.779 3.136 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172420603 1426036143 /nfs/dbraw/zinc/03/61/43/1426036143.db2.gz XNXBTZSCOVIGPY-GOSISDBHSA-N 0 0 385.395 3.078 20 5 GGBDRN O=C(CCS(=O)(=O)c1ccc(Cl)cc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172421253 1426036376 /nfs/dbraw/zinc/03/63/76/1426036376.db2.gz RPFIMYPZHGHBLL-UHFFFAOYSA-N 0 0 394.836 3.001 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000172421065 1426036393 /nfs/dbraw/zinc/03/63/93/1426036393.db2.gz XPKGIKYOFXLSMD-INIZCTEOSA-N 0 0 387.823 3.405 20 5 GGBDRN O=C(CCCOc1ccc2c(c1)CCC(=O)N2)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172422654 1426036722 /nfs/dbraw/zinc/03/67/22/1426036722.db2.gz INJOEDKAMNGTBM-UHFFFAOYSA-N 0 0 395.415 3.228 20 5 GGBDRN CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172422807 1426036809 /nfs/dbraw/zinc/03/68/09/1426036809.db2.gz UZKOTENHFQDPHZ-FQEVSTJZSA-N 0 0 379.416 3.020 20 5 GGBDRN CC(C)[C@@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])S(=O)(=O)C1CCCCC1 ZINC000172422316 1426037110 /nfs/dbraw/zinc/03/71/10/1426037110.db2.gz HIGRLAMUOISELA-SFHVURJKSA-N 0 0 394.493 3.256 20 5 GGBDRN Cc1cccc(NC(=O)CSCC(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000172423676 1426037552 /nfs/dbraw/zinc/03/75/52/1426037552.db2.gz BKGXHVMGLPSIDT-UHFFFAOYSA-N 0 0 385.445 3.164 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424534 1426038538 /nfs/dbraw/zinc/03/85/38/1426038538.db2.gz PGFKTWHUQQGCFP-UHFFFAOYSA-N 0 0 382.376 3.306 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424683 1426038751 /nfs/dbraw/zinc/03/87/51/1426038751.db2.gz CEWBDAOKWIAGIH-UHFFFAOYSA-N 0 0 392.165 3.468 20 5 GGBDRN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172425743 1426039159 /nfs/dbraw/zinc/03/91/59/1426039159.db2.gz WKOGBQORRKHHJF-FQEVSTJZSA-N 0 0 377.400 3.448 20 5 GGBDRN COc1ccc(-c2noc(CCC(=O)N3CCc4c3cccc4[N+](=O)[O-])n2)cc1 ZINC000172425701 1426039247 /nfs/dbraw/zinc/03/92/47/1426039247.db2.gz WVULNNFJRAHDMO-UHFFFAOYSA-N 0 0 394.387 3.175 20 5 GGBDRN C[C@H]1CN(Cc2ccc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000172425671 1426039257 /nfs/dbraw/zinc/03/92/57/1426039257.db2.gz UATGUBCKUPGRAJ-HOTGVXAUSA-N 0 0 395.459 3.407 20 5 GGBDRN C[C@@H]1CN(c2ccc(C(=O)N3CCCc4ccc([N+](=O)[O-])cc43)cn2)C[C@@H](C)O1 ZINC000172425578 1426039273 /nfs/dbraw/zinc/03/92/73/1426039273.db2.gz KRAWDMRZOKLTCJ-HUUCEWRRSA-N 0 0 396.447 3.196 20 5 GGBDRN CCc1cccc2c1N(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)CCC2 ZINC000172425120 1426039515 /nfs/dbraw/zinc/03/95/15/1426039515.db2.gz PHGXOYOAMJRRIB-UHFFFAOYSA-N 0 0 388.445 3.154 20 5 GGBDRN COc1ccc(-n2nnc(C(=O)N3CCCc4ccc([N+](=O)[O-])cc43)c2C)cc1 ZINC000172426126 1426040330 /nfs/dbraw/zinc/04/03/30/1426040330.db2.gz BOKUIAXSVZFGNJ-UHFFFAOYSA-N 0 0 393.403 3.086 20 5 GGBDRN CC(C)(NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000172434770 1426042879 /nfs/dbraw/zinc/04/28/79/1426042879.db2.gz ASWKTDKOOHBERO-UHFFFAOYSA-N 0 0 396.852 3.317 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CC=CCC2)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000172482635 1426055511 /nfs/dbraw/zinc/05/55/11/1426055511.db2.gz HXSVHELBZHIHIW-GFCCVEGCSA-N 0 0 389.433 3.477 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NCc2ccc([C@H](C)O)cc2)c([N+](=O)[O-])c1 ZINC000172483551 1426055586 /nfs/dbraw/zinc/05/55/86/1426055586.db2.gz ZBSFCIAVYSIECH-HNNXBMFYSA-N 0 0 386.452 3.258 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NCc2ccc([C@@H](C)O)cc2)c([N+](=O)[O-])c1 ZINC000172483548 1426055617 /nfs/dbraw/zinc/05/56/17/1426055617.db2.gz ZBSFCIAVYSIECH-OAHLLOKOSA-N 0 0 386.452 3.258 20 5 GGBDRN COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000172488921 1426057544 /nfs/dbraw/zinc/05/75/44/1426057544.db2.gz GOYNBKMPCREGNG-OAHLLOKOSA-N 0 0 380.832 3.357 20 5 GGBDRN CNC(=O)c1ccc(CN(C)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000172496079 1426059741 /nfs/dbraw/zinc/05/97/41/1426059741.db2.gz QACRPMUIWHZPEV-UHFFFAOYSA-N 0 0 398.463 3.119 20 5 GGBDRN C[C@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(NC(N)=O)cc1 ZINC000172496874 1426059873 /nfs/dbraw/zinc/05/98/73/1426059873.db2.gz DXYFDUJNLVMKHA-AWEZNQCLSA-N 0 0 399.451 3.469 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1ccc(F)cc1 ZINC000172496007 1426059920 /nfs/dbraw/zinc/05/99/20/1426059920.db2.gz XIJLGVARUMPKKN-SFHVURJKSA-N 0 0 375.400 3.089 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000172512087 1426065856 /nfs/dbraw/zinc/06/58/56/1426065856.db2.gz RGTIZXQTEGAIIQ-LLVKDONJSA-N 0 0 383.832 3.235 20 5 GGBDRN Cc1cc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)ccc1N(C)C ZINC000172522541 1426069901 /nfs/dbraw/zinc/06/99/01/1426069901.db2.gz OFEJGWUFQQDDQT-UHFFFAOYSA-N 0 0 398.463 3.047 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000172522676 1426069982 /nfs/dbraw/zinc/06/99/82/1426069982.db2.gz BXKRMCHTTSTXBA-UHFFFAOYSA-N 0 0 399.447 3.460 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2cccnc21 ZINC000172522393 1426070173 /nfs/dbraw/zinc/07/01/73/1426070173.db2.gz LWDJNOPLKPKQNB-UHFFFAOYSA-N 0 0 392.415 3.221 20 5 GGBDRN O=C(c1cccn1Cc1cccs1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172535092 1426075936 /nfs/dbraw/zinc/07/59/36/1426075936.db2.gz LEHNDKGMUKABPV-AWEZNQCLSA-N 0 0 397.460 3.228 20 5 GGBDRN CC(C)n1ncc2ccc(NC(=O)C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc21 ZINC000172540779 1426079244 /nfs/dbraw/zinc/07/92/44/1426079244.db2.gz ZIBJYEIOHKLIFO-ZDUSSCGKSA-N 0 0 395.419 3.341 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)N[C@@H]3CCN(C)C3=O)cc2[N+](=O)[O-])cc1 ZINC000172542965 1426080209 /nfs/dbraw/zinc/08/02/09/1426080209.db2.gz KIOADVLVEYFPBG-OAHLLOKOSA-N 0 0 385.445 3.015 20 5 GGBDRN CN1CC[C@H](NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1=O ZINC000172545620 1426081508 /nfs/dbraw/zinc/08/15/08/1426081508.db2.gz LXAIMUAGTABQJL-AWEZNQCLSA-N 0 0 389.795 3.001 20 5 GGBDRN C[C@@H](CC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)NC(=O)C1CCCC1 ZINC000172573083 1426093280 /nfs/dbraw/zinc/09/32/80/1426093280.db2.gz MPNJHRHHYSDXBU-HNNXBMFYSA-N 0 0 375.469 3.119 20 5 GGBDRN CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000172571810 1426093380 /nfs/dbraw/zinc/09/33/80/1426093380.db2.gz ZJDRCJWXJOESAS-OAHLLOKOSA-N 0 0 382.482 3.429 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000172573427 1426093625 /nfs/dbraw/zinc/09/36/25/1426093625.db2.gz ZWDKNJRFNHXNGH-CQSZACIVSA-N 0 0 398.387 3.158 20 5 GGBDRN C[C@H](CC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1 ZINC000172573387 1426093645 /nfs/dbraw/zinc/09/36/45/1426093645.db2.gz YKXAUDUTGZSBAW-MRXNPFEDSA-N 0 0 383.448 3.242 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(CC(F)(F)F)C1 ZINC000172573442 1426093964 /nfs/dbraw/zinc/09/39/64/1426093964.db2.gz KSZDSJUWVXZHGA-OAHLLOKOSA-N 0 0 387.402 3.308 20 5 GGBDRN O=C(CNC(=O)CC1CCCCC1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000172573404 1426094150 /nfs/dbraw/zinc/09/41/50/1426094150.db2.gz MJIMXZLYNNIYLS-UHFFFAOYSA-N 0 0 375.469 3.120 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)NC2(c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000172589149 1426101525 /nfs/dbraw/zinc/10/15/25/1426101525.db2.gz UXQYVEZTMKUTHD-UHFFFAOYSA-N 0 0 394.836 3.071 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000172595459 1426104680 /nfs/dbraw/zinc/10/46/80/1426104680.db2.gz CKRPXRPZRRRRLI-UHFFFAOYSA-N 0 0 389.477 3.477 20 5 GGBDRN CSc1ncc(Cl)c(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])n1 ZINC000172599813 1426107883 /nfs/dbraw/zinc/10/78/83/1426107883.db2.gz VVNNXICTAODRJR-UHFFFAOYSA-N 0 0 395.872 3.301 20 5 GGBDRN Cn1ccc2ccc(NC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc21 ZINC000172606442 1426110057 /nfs/dbraw/zinc/11/00/57/1426110057.db2.gz AKZNZZAHLJKGFS-UHFFFAOYSA-N 0 0 386.795 3.108 20 5 GGBDRN CN(Cc1nc[nH]n1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000172618878 1426115418 /nfs/dbraw/zinc/11/54/18/1426115418.db2.gz RKKMXNMMYBLKFN-UHFFFAOYSA-N 0 0 387.783 3.431 20 5 GGBDRN CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000172624684 1426117243 /nfs/dbraw/zinc/11/72/43/1426117243.db2.gz HBHWPLJMZYXJNG-BBRMVZONSA-N 0 0 396.490 3.237 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 ZINC000172635320 1426121284 /nfs/dbraw/zinc/12/12/84/1426121284.db2.gz TYXXGJIFCQYICK-DOTOQJQBSA-N 0 0 397.431 3.070 20 5 GGBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1ccc(NC(C)=O)cc1 ZINC000172640168 1426122661 /nfs/dbraw/zinc/12/26/61/1426122661.db2.gz PNVYVSWGSYDELV-UHFFFAOYSA-N 0 0 375.356 3.481 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1ccc(F)cc1F ZINC000172640640 1426122733 /nfs/dbraw/zinc/12/27/33/1426122733.db2.gz BILVAVGAYMKGRZ-CQSZACIVSA-N 0 0 393.346 3.088 20 5 GGBDRN C[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000172672012 1426136890 /nfs/dbraw/zinc/13/68/90/1426136890.db2.gz UONQKCFVLOFQSU-GFCCVEGCSA-N 0 0 397.884 3.349 20 5 GGBDRN COc1cc(N2CCC(OC(=O)c3cnc(C)s3)CC2)ccc1[N+](=O)[O-] ZINC000172674431 1426137732 /nfs/dbraw/zinc/13/77/32/1426137732.db2.gz JTEFDZILKIMWIH-UHFFFAOYSA-N 0 0 377.422 3.194 20 5 GGBDRN COc1ccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000172678426 1426139655 /nfs/dbraw/zinc/13/96/55/1426139655.db2.gz AUWVBBOWBVKXFW-UHFFFAOYSA-N 0 0 387.436 3.434 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCOc2ccc(Cl)cc21 ZINC000172685967 1426142964 /nfs/dbraw/zinc/14/29/64/1426142964.db2.gz YSSDHKHEXFMXHW-UHFFFAOYSA-N 0 0 384.779 3.473 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1 ZINC000172688589 1426143320 /nfs/dbraw/zinc/14/33/20/1426143320.db2.gz LTGPIHCJXHRKOC-LJQANCHMSA-N 0 0 387.411 3.363 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](c1ccccc1)N1CCCCC1=O ZINC000172687835 1426143478 /nfs/dbraw/zinc/14/34/78/1426143478.db2.gz WWKWFYZETFKHKI-IBGZPJMESA-N 0 0 383.404 3.296 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1 ZINC000172688615 1426143487 /nfs/dbraw/zinc/14/34/87/1426143487.db2.gz FXFXZTLGIHPBJQ-INIZCTEOSA-N 0 0 382.420 3.098 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c2ccccc2O1 ZINC000172689805 1426144141 /nfs/dbraw/zinc/14/41/41/1426144141.db2.gz OWBIKIBZRWZNMA-MRXNPFEDSA-N 0 0 393.403 3.302 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@H](O)c1c(Cl)cccc1Cl ZINC000172694368 1426146431 /nfs/dbraw/zinc/14/64/31/1426146431.db2.gz RYEQNZSARXXUGW-AWEZNQCLSA-N 0 0 384.219 3.434 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1c(Cl)cccc1Cl ZINC000172694853 1426147597 /nfs/dbraw/zinc/14/75/97/1426147597.db2.gz HDJCBQUWTTXUCP-CQSZACIVSA-N 0 0 384.219 3.434 20 5 GGBDRN COC(=O)c1cc2cc(Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)ccc2o1 ZINC000172695907 1426147814 /nfs/dbraw/zinc/14/78/14/1426147814.db2.gz YZZCXZAFVNYXQO-UHFFFAOYSA-N 0 0 378.344 3.434 20 5 GGBDRN CCc1ccc([C@H](COC)NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)o1 ZINC000172699964 1426150087 /nfs/dbraw/zinc/15/00/87/1426150087.db2.gz YBENMRPJYBLIGA-HNNXBMFYSA-N 0 0 384.392 3.053 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1ccc(C(=O)N2CCCCC2)cc1 ZINC000172705163 1426151396 /nfs/dbraw/zinc/15/13/96/1426151396.db2.gz AFZGVSZTWHXLED-UHFFFAOYSA-N 0 0 381.432 3.080 20 5 GGBDRN COc1cccc(Cn2nccc2NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1OC ZINC000172706877 1426152692 /nfs/dbraw/zinc/15/26/92/1426152692.db2.gz SUSCFHFZWQJHBW-UHFFFAOYSA-N 0 0 396.403 3.418 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1nc2ccccc2n1-c1ccccc1F ZINC000172710839 1426154989 /nfs/dbraw/zinc/15/49/89/1426154989.db2.gz VNJFNDJHSREDRS-UHFFFAOYSA-N 0 0 394.366 3.298 20 5 GGBDRN COC(=O)c1ccc(N2CCCC2)c(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000172721516 1426160293 /nfs/dbraw/zinc/16/02/93/1426160293.db2.gz IMMDEADBVZJTNT-UHFFFAOYSA-N 0 0 383.404 3.163 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CSc1nnnn1C1CCCC1 ZINC000172728227 1426163025 /nfs/dbraw/zinc/16/30/25/1426163025.db2.gz GAWIYLLJLSDAAT-UHFFFAOYSA-N 0 0 376.442 3.044 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)c1 ZINC000172732612 1426165153 /nfs/dbraw/zinc/16/51/53/1426165153.db2.gz FHMOLBBVSKWOHC-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172737977 1426167547 /nfs/dbraw/zinc/16/75/47/1426167547.db2.gz ZBVZJOSVXVWUBL-LLVKDONJSA-N 0 0 378.860 3.436 20 5 GGBDRN C[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)Oc1cccc(F)c1 ZINC000172746259 1426171332 /nfs/dbraw/zinc/17/13/32/1426171332.db2.gz ASPLFRHKPPRUSY-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN CCCNC(=O)c1cccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000172748033 1426172402 /nfs/dbraw/zinc/17/24/02/1426172402.db2.gz UJPQCRTUAWYVLX-UHFFFAOYSA-N 0 0 383.448 3.487 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)cc1 ZINC000172760518 1426176326 /nfs/dbraw/zinc/17/63/26/1426176326.db2.gz FFTAGDJNNASFPB-UHFFFAOYSA-N 0 0 381.432 3.064 20 5 GGBDRN O=C1CN(c2ccc([N+](=O)[O-])c3cccnc32)CCN1Cc1cccc(F)c1 ZINC000172770268 1426179940 /nfs/dbraw/zinc/17/99/40/1426179940.db2.gz QGYNQXDKLPYDKI-UHFFFAOYSA-N 0 0 380.379 3.131 20 5 GGBDRN O=C1CN(c2ccc3ncccc3c2[N+](=O)[O-])CCN1Cc1cccc(F)c1 ZINC000172770063 1426180095 /nfs/dbraw/zinc/18/00/95/1426180095.db2.gz LRBLUMREWTZSDW-UHFFFAOYSA-N 0 0 380.379 3.131 20 5 GGBDRN COc1ccc(CN(C)C(=O)Cc2cccc([N+](=O)[O-])c2)cc1OC(F)F ZINC000172772956 1426180890 /nfs/dbraw/zinc/18/08/90/1426180890.db2.gz CHXMAIPQCVKFJU-UHFFFAOYSA-N 0 0 380.347 3.406 20 5 GGBDRN C[C@@H]1C[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C(=O)N1c1ccccc1 ZINC000172775915 1426182737 /nfs/dbraw/zinc/18/27/37/1426182737.db2.gz AQGPYUYPLBVYHB-PXAZEXFGSA-N 0 0 380.404 3.085 20 5 GGBDRN CCOC(=O)c1ccnc(N2CC[C@H](COCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000172776239 1426183278 /nfs/dbraw/zinc/18/32/78/1426183278.db2.gz JRYVEFFCQPQMQR-INIZCTEOSA-N 0 0 385.420 3.210 20 5 GGBDRN CCc1cnc(CNc2ccc(S(=O)(=O)N(CC)CC)cc2[N+](=O)[O-])s1 ZINC000172782688 1426185367 /nfs/dbraw/zinc/18/53/67/1426185367.db2.gz CIIFBCAJJSZDHR-UHFFFAOYSA-N 0 0 398.510 3.256 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(Nc3cccc(N4CCCNC4=O)c3)cc2N1 ZINC000172782043 1426185467 /nfs/dbraw/zinc/18/54/67/1426185467.db2.gz ZMZMDVJKDHUYJP-UHFFFAOYSA-N 0 0 381.392 3.143 20 5 GGBDRN CCc1cc(N2CC[C@H](COCCOC)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000172783597 1426186126 /nfs/dbraw/zinc/18/61/26/1426186126.db2.gz XXJKPDKNRCMEGJ-HNNXBMFYSA-N 0 0 386.452 3.104 20 5 GGBDRN COCCOC[C@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000172783314 1426186174 /nfs/dbraw/zinc/18/61/74/1426186174.db2.gz YFEIKQQWJVJYAT-INIZCTEOSA-N 0 0 384.432 3.315 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000172786661 1426188192 /nfs/dbraw/zinc/18/81/92/1426188192.db2.gz UHCKATRCXMQYPF-UHFFFAOYSA-N 0 0 385.420 3.023 20 5 GGBDRN C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000172788410 1426188954 /nfs/dbraw/zinc/18/89/54/1426188954.db2.gz RFXCAHGLXHIBDB-CZUORRHYSA-N 0 0 397.406 3.060 20 5 GGBDRN Cc1nn(C)c(C(=O)NC2(c3cccc(C(F)(F)F)c3)CCC2)c1[N+](=O)[O-] ZINC000172800745 1426195313 /nfs/dbraw/zinc/19/53/13/1426195313.db2.gz DIYHUIAULKOJOT-UHFFFAOYSA-N 0 0 382.342 3.465 20 5 GGBDRN Cc1cnc(N(C)C[C@@H](O)COc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000172807690 1426198524 /nfs/dbraw/zinc/19/85/24/1426198524.db2.gz GJSDKKIHXMCZMQ-CYBMUJFWSA-N 0 0 385.342 3.193 20 5 GGBDRN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172813326 1426200814 /nfs/dbraw/zinc/20/08/14/1426200814.db2.gz BBLCLDXDZBZWQL-UHFFFAOYSA-N 0 0 395.337 3.377 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3cc(C)ccc3[N+](=O)[O-])c2)n1 ZINC000172818840 1426202875 /nfs/dbraw/zinc/20/28/75/1426202875.db2.gz NMVSGRBNCHIFDS-UHFFFAOYSA-N 0 0 378.388 3.468 20 5 GGBDRN COc1cccc(O[C@@H](C)CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000172822174 1426204242 /nfs/dbraw/zinc/20/42/42/1426204242.db2.gz BYUXDLWOLGYTRX-HNNXBMFYSA-N 0 0 399.447 3.401 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)nc1 ZINC000172834760 1426210742 /nfs/dbraw/zinc/21/07/42/1426210742.db2.gz WDRMNWHMZMIVGL-UHFFFAOYSA-N 0 0 382.420 3.098 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])C2)nc1 ZINC000172834841 1426210844 /nfs/dbraw/zinc/21/08/44/1426210844.db2.gz XLNHSMAOXCEWMG-OAHLLOKOSA-N 0 0 382.420 3.098 20 5 GGBDRN CC(C)c1nc(C(=O)NCc2ccc([N+](=O)[O-])cc2)nn1-c1ccccc1F ZINC000172846517 1426216879 /nfs/dbraw/zinc/21/68/79/1426216879.db2.gz SIZXXCFWDRQDCU-UHFFFAOYSA-N 0 0 383.383 3.368 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)CNc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000172846420 1426217306 /nfs/dbraw/zinc/21/73/06/1426217306.db2.gz OKZFDDOARXIPPJ-SFHVURJKSA-N 0 0 385.420 3.388 20 5 GGBDRN Cc1ccc(N2CCC[C@@H](NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])C2=O)cc1 ZINC000172845539 1426217333 /nfs/dbraw/zinc/21/73/33/1426217333.db2.gz ZIVKXMPHGGVLFP-MRXNPFEDSA-N 0 0 387.823 3.482 20 5 GGBDRN Cn1ccc(N2CCC[C@@H](NC(=O)c3cc4ccccc4c4cccnc34)C2=O)n1 ZINC000172847740 1426218126 /nfs/dbraw/zinc/21/81/26/1426218126.db2.gz SRURIFXAULDWCL-LJQANCHMSA-N 0 0 399.454 3.047 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1cc([N+](=O)[O-])ccc1NCCO ZINC000172852526 1426220367 /nfs/dbraw/zinc/22/03/67/1426220367.db2.gz BCJFDEIEGPKDFX-UHFFFAOYSA-N 0 0 390.396 3.307 20 5 GGBDRN Cc1ccc(N2CCC[C@@H](NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)C2)cc1 ZINC000172857682 1426223272 /nfs/dbraw/zinc/22/32/72/1426223272.db2.gz YEUYKUQJQFKIEU-OAHLLOKOSA-N 0 0 384.392 3.210 20 5 GGBDRN CC(C)(C)C(=O)NCc1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000172862517 1426226370 /nfs/dbraw/zinc/22/63/70/1426226370.db2.gz GJYUWAFOGKFWJI-UHFFFAOYSA-N 0 0 381.432 3.460 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)c1 ZINC000172862689 1426226684 /nfs/dbraw/zinc/22/66/84/1426226684.db2.gz BMNBZERLZXVHEW-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN CCCCN1C(=O)C2(CCCCC2)N[C@@H]1c1cc(OC)c(O)cc1[N+](=O)[O-] ZINC000172862180 1426226768 /nfs/dbraw/zinc/22/67/68/1426226768.db2.gz NNOAKLDPEQPYAL-KRWDZBQOSA-N 0 0 377.441 3.242 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1cccc(NC(=O)c2ccncc2)c1 ZINC000172862701 1426226902 /nfs/dbraw/zinc/22/69/02/1426226902.db2.gz DNDHGNKHCRZOKS-UHFFFAOYSA-N 0 0 390.399 3.101 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)C[C@H](C)O1 ZINC000172862779 1426227450 /nfs/dbraw/zinc/22/74/50/1426227450.db2.gz KAAAPMBSWOKCLN-GASCZTMLSA-N 0 0 397.431 3.025 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@@H](COCc2ccccc2)C1 ZINC000172869700 1426230740 /nfs/dbraw/zinc/23/07/40/1426230740.db2.gz KRROYTKTQMKJFR-OAHLLOKOSA-N 0 0 380.404 3.150 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H](COCc2ccccc2)C1 ZINC000172869705 1426230942 /nfs/dbraw/zinc/23/09/42/1426230942.db2.gz KRROYTKTQMKJFR-HNNXBMFYSA-N 0 0 380.404 3.150 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CC2 ZINC000172875472 1426234218 /nfs/dbraw/zinc/23/42/18/1426234218.db2.gz NUDSFOWDBCLYHA-SJORKVTESA-N 0 0 390.461 3.202 20 5 GGBDRN COc1ccc(CN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C2CC2)cc1 ZINC000172892578 1426242404 /nfs/dbraw/zinc/24/24/04/1426242404.db2.gz ITFOVHCNBMBHFY-UHFFFAOYSA-N 0 0 379.420 3.484 20 5 GGBDRN CN(Cc1ccc(Br)o1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172897854 1426245205 /nfs/dbraw/zinc/24/52/05/1426245205.db2.gz XUINLKVLIXTFMY-UHFFFAOYSA-N 0 0 392.213 3.298 20 5 GGBDRN COc1ccccc1CN(Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C1CC1 ZINC000172897837 1426245227 /nfs/dbraw/zinc/24/52/27/1426245227.db2.gz MKBBEHBVHKPEDD-UHFFFAOYSA-N 0 0 379.420 3.484 20 5 GGBDRN Cc1c(CNc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)cccc1[N+](=O)[O-] ZINC000172900813 1426247691 /nfs/dbraw/zinc/24/76/91/1426247691.db2.gz JERHZIQCOOQIOG-INIZCTEOSA-N 0 0 383.448 3.360 20 5 GGBDRN O=C(c1cccc(NCc2cc(F)ccc2[N+](=O)[O-])c1)N1CCC(CO)CC1 ZINC000172901358 1426247990 /nfs/dbraw/zinc/24/79/90/1426247990.db2.gz OKIGSAJITIYGET-UHFFFAOYSA-N 0 0 387.411 3.191 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000172903095 1426249434 /nfs/dbraw/zinc/24/94/34/1426249434.db2.gz IMZLZPAQSZDYIX-ZDUSSCGKSA-N 0 0 385.420 3.375 20 5 GGBDRN COCCNC(=O)c1ccc(Cl)c(NCc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000172908845 1426254084 /nfs/dbraw/zinc/25/40/84/1426254084.db2.gz IDONUTRNRPJCHR-UHFFFAOYSA-N 0 0 381.791 3.376 20 5 GGBDRN COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NCc1cccc([N+](=O)[O-])c1 ZINC000172914972 1426259236 /nfs/dbraw/zinc/25/92/36/1426259236.db2.gz DCZJCHABKJNBFK-UHFFFAOYSA-N 0 0 393.465 3.292 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC[C@H](C)Sc1ccccc1 ZINC000172916506 1426261089 /nfs/dbraw/zinc/26/10/89/1426261089.db2.gz WOFIRYJXRCXXFT-UONOGXRCSA-N 0 0 387.461 3.010 20 5 GGBDRN COc1cc(CN(C)C(=O)CN(C)c2ccccc2[N+](=O)[O-])ccc1SC ZINC000172916234 1426261412 /nfs/dbraw/zinc/26/14/12/1426261412.db2.gz CONGVEHXXAMIKM-UHFFFAOYSA-N 0 0 389.477 3.420 20 5 GGBDRN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000172926605 1426267527 /nfs/dbraw/zinc/26/75/27/1426267527.db2.gz XCDQBRUIWJKEMS-UHFFFAOYSA-N 0 0 398.463 3.364 20 5 GGBDRN C[C@@H]1Cc2ccccc2CN1Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000172928059 1426267594 /nfs/dbraw/zinc/26/75/94/1426267594.db2.gz KBCJUDMGEKRGGM-OAHLLOKOSA-N 0 0 376.416 3.223 20 5 GGBDRN COc1ccc(CCNC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1OC(F)F ZINC000172933511 1426271854 /nfs/dbraw/zinc/27/18/54/1426271854.db2.gz MDNRERYCRGTAPX-UHFFFAOYSA-N 0 0 380.347 3.486 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000172934284 1426273091 /nfs/dbraw/zinc/27/30/91/1426273091.db2.gz DPERRIXAIZTHEW-UHFFFAOYSA-N 0 0 396.447 3.214 20 5 GGBDRN CCCCc1nnc(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1N ZINC000172940319 1426275539 /nfs/dbraw/zinc/27/55/39/1426275539.db2.gz SKCIMHTUIFXTHI-SECBINFHSA-N 0 0 398.876 3.015 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000172945175 1426279096 /nfs/dbraw/zinc/27/90/96/1426279096.db2.gz JBMGABBVEVHNOC-OAHLLOKOSA-N 0 0 389.839 3.194 20 5 GGBDRN O=C1C[C@@H](Nc2ccc(CC(F)(F)F)cc2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000172949009 1426280905 /nfs/dbraw/zinc/28/09/05/1426280905.db2.gz BUVPQJHSLYPLBZ-OAHLLOKOSA-N 0 0 393.321 3.444 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1 ZINC000172956728 1426283080 /nfs/dbraw/zinc/28/30/80/1426283080.db2.gz QPDKTRZGUDXJRK-UHFFFAOYSA-N 0 0 383.404 3.296 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000172974661 1426290412 /nfs/dbraw/zinc/29/04/12/1426290412.db2.gz BBCHQRAJYGISFM-UHFFFAOYSA-N 0 0 387.411 3.009 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(OCC(F)(F)C(F)F)nc1 ZINC000172979221 1426291375 /nfs/dbraw/zinc/29/13/75/1426291375.db2.gz YNBZWRALBWQWEO-UHFFFAOYSA-N 0 0 387.289 3.450 20 5 GGBDRN CCCN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000172981290 1426291885 /nfs/dbraw/zinc/29/18/85/1426291885.db2.gz OMGUNXUERNRKCV-QGZVFWFLSA-N 0 0 391.468 3.385 20 5 GGBDRN Cc1cccc(C(=O)N2CCc3c(cccc3N3CCOC3=O)C2)c1[N+](=O)[O-] ZINC000172985161 1426295253 /nfs/dbraw/zinc/29/52/53/1426295253.db2.gz OURBMVFBTAHAQX-UHFFFAOYSA-N 0 0 381.388 3.058 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2c(cccc2N2CCOC2=O)C1 ZINC000172987117 1426296413 /nfs/dbraw/zinc/29/64/13/1426296413.db2.gz KGGPRNVPYXQVEU-UHFFFAOYSA-N 0 0 381.388 3.058 20 5 GGBDRN CC(=O)c1ccc(N2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)c(F)c1 ZINC000172994170 1426300212 /nfs/dbraw/zinc/30/02/12/1426300212.db2.gz AUXUIFLPDXANDW-UHFFFAOYSA-N 0 0 385.395 3.207 20 5 GGBDRN CCOC(=O)c1sc(N(C(=O)Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1C ZINC000172995690 1426300979 /nfs/dbraw/zinc/30/09/79/1426300979.db2.gz TYAZYAMANBKPNO-UHFFFAOYSA-N 0 0 389.433 3.275 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CSC[C@@H]2C(=O)Nc2cccc(F)c2)c1 ZINC000173005133 1426304616 /nfs/dbraw/zinc/30/46/16/1426304616.db2.gz LKGYRPQQIZNPML-MRXNPFEDSA-N 0 0 389.408 3.196 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CSC[C@H]2C(=O)Nc2cccc(F)c2)c1 ZINC000173005140 1426304817 /nfs/dbraw/zinc/30/48/17/1426304817.db2.gz LKGYRPQQIZNPML-INIZCTEOSA-N 0 0 389.408 3.196 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000173005710 1426305232 /nfs/dbraw/zinc/30/52/32/1426305232.db2.gz YKNTUYKRTDGANG-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1cncc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)c1 ZINC000173021326 1426310664 /nfs/dbraw/zinc/31/06/64/1426310664.db2.gz IHQCZHPGLLCJRR-UHFFFAOYSA-N 0 0 394.353 3.279 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)cc1 ZINC000173029782 1426315989 /nfs/dbraw/zinc/31/59/89/1426315989.db2.gz TXBOPUYEPAJXIU-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN Cn1c(=O)oc2cc(NC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc21 ZINC000173046673 1426322367 /nfs/dbraw/zinc/32/23/67/1426322367.db2.gz FMCZMYMTICBOTH-UHFFFAOYSA-N 0 0 381.266 3.311 20 5 GGBDRN Cc1sc(NC(=O)Cn2cc([N+](=O)[O-])cn2)nc1-c1ccc2c(c1)CCC2 ZINC000173062441 1426327341 /nfs/dbraw/zinc/32/73/41/1426327341.db2.gz BSZKTCFTKXFJGB-UHFFFAOYSA-N 0 0 383.433 3.351 20 5 GGBDRN COc1cc(OC)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1Cl ZINC000173065046 1426328704 /nfs/dbraw/zinc/32/87/04/1426328704.db2.gz SRQRQCWWOHRRNI-UHFFFAOYSA-N 0 0 379.800 3.340 20 5 GGBDRN CN(CC(=O)N[C@H](c1nccs1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000173068483 1426330067 /nfs/dbraw/zinc/33/00/67/1426330067.db2.gz VXQIAMVDSZXFKJ-SFHVURJKSA-N 0 0 382.445 3.393 20 5 GGBDRN O=C([C@@H]1SCCc2sccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000173072355 1426331325 /nfs/dbraw/zinc/33/13/25/1426331325.db2.gz CWDCBVBATFTVIX-QGZVFWFLSA-N 0 0 389.502 3.336 20 5 GGBDRN COc1cc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c(OC)cc1Cl ZINC000173077738 1426333214 /nfs/dbraw/zinc/33/32/14/1426333214.db2.gz MDWOLOBTQDPPDS-UHFFFAOYSA-N 0 0 379.800 3.340 20 5 GGBDRN CCN(CC)C(=O)c1cccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000173087437 1426337083 /nfs/dbraw/zinc/33/70/83/1426337083.db2.gz RBLKEWZFGISTOJ-UHFFFAOYSA-N 0 0 384.436 3.152 20 5 GGBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173100023 1426341359 /nfs/dbraw/zinc/34/13/59/1426341359.db2.gz JMMBMARVKIOLTF-UHFFFAOYSA-N 0 0 376.800 3.282 20 5 GGBDRN CCOC(=O)c1csc(N(C(=O)c2cc(C)ccc2[N+](=O)[O-])C2CC2)n1 ZINC000173107069 1426345395 /nfs/dbraw/zinc/34/53/95/1426345395.db2.gz PSFOZUMPKMYWIX-UHFFFAOYSA-N 0 0 375.406 3.346 20 5 GGBDRN CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173107814 1426345974 /nfs/dbraw/zinc/34/59/74/1426345974.db2.gz HRAGXYWEJSOQAX-QGZVFWFLSA-N 0 0 397.410 3.312 20 5 GGBDRN CN(C(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC000173115246 1426350201 /nfs/dbraw/zinc/35/02/01/1426350201.db2.gz LAVIYJLYNHLGGX-UHFFFAOYSA-N 0 0 379.214 3.217 20 5 GGBDRN C[C@@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000820669139 1426351614 /nfs/dbraw/zinc/35/16/14/1426351614.db2.gz YWQMNHCEGRZQAP-RHSMWYFYSA-N 0 0 393.451 3.240 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(CC(F)(F)F)c1 ZINC000173127295 1426353468 /nfs/dbraw/zinc/35/34/68/1426353468.db2.gz FAFZBWHJMBLLMI-NSHDSACASA-N 0 0 395.337 3.457 20 5 GGBDRN Cc1cccn2cc(CNC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])nc12 ZINC000173132104 1426356019 /nfs/dbraw/zinc/35/60/19/1426356019.db2.gz SZOQGGYMIVYHFZ-UHFFFAOYSA-N 0 0 378.310 3.500 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C[S@](C)=O)c1ccccc1 ZINC000173138007 1426360391 /nfs/dbraw/zinc/36/03/91/1426360391.db2.gz NBRONZHPMMCBFI-HEUVKUSISA-N 0 0 392.502 3.311 20 5 GGBDRN COc1ccc(C(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000173140035 1426361331 /nfs/dbraw/zinc/36/13/31/1426361331.db2.gz ZXBCATDDZZNGAW-INIZCTEOSA-N 0 0 378.388 3.244 20 5 GGBDRN O=C(NCCCNc1ccccn1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173140402 1426361412 /nfs/dbraw/zinc/36/14/12/1426361412.db2.gz WRZUGCBBIMOWCD-UHFFFAOYSA-N 0 0 399.451 3.045 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173144626 1426363658 /nfs/dbraw/zinc/36/36/58/1426363658.db2.gz GFPPXGSZSDMJMS-KRWDZBQOSA-N 0 0 391.431 3.424 20 5 GGBDRN CN(CC(=O)N1C[C@@H](n2cccn2)Cc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000173145625 1426364383 /nfs/dbraw/zinc/36/43/83/1426364383.db2.gz VOUQWPBTLGMYCF-KRWDZBQOSA-N 0 0 391.431 3.058 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NC1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000173152814 1426367439 /nfs/dbraw/zinc/36/74/39/1426367439.db2.gz KGHYCOAQFOLUEW-UHFFFAOYSA-N 0 0 389.402 3.196 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)CCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000173155660 1426368906 /nfs/dbraw/zinc/36/89/06/1426368906.db2.gz OGCDFZGIRSZVHO-GFCCVEGCSA-N 0 0 376.331 3.436 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2C)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000173159399 1426370923 /nfs/dbraw/zinc/37/09/23/1426370923.db2.gz CQTUIIAMWRYTJR-NSHDSACASA-N 0 0 377.422 3.263 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173163713 1426372387 /nfs/dbraw/zinc/37/23/87/1426372387.db2.gz HPPZTFDJNYCMAN-HZPDHXFCSA-N 0 0 377.441 3.089 20 5 GGBDRN CCOC(=O)c1csc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000173170752 1426375977 /nfs/dbraw/zinc/37/59/77/1426375977.db2.gz KMGPPSJJAHJKHM-UHFFFAOYSA-N 0 0 389.311 3.499 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C1(N2CCOCC2)CCCC1 ZINC000173178708 1426379623 /nfs/dbraw/zinc/37/96/23/1426379623.db2.gz NTSPNIACPNCSIW-ZDUSSCGKSA-N 0 0 381.860 3.012 20 5 GGBDRN NC(=O)c1c(Cl)cccc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000173179351 1426380294 /nfs/dbraw/zinc/38/02/94/1426380294.db2.gz WBYUXOWZFVSKGJ-UHFFFAOYSA-N 0 0 388.811 3.200 20 5 GGBDRN NC(=O)c1c(Cl)cccc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000173186114 1426382451 /nfs/dbraw/zinc/38/24/51/1426382451.db2.gz UQBGSQBKLUNFGG-UHFFFAOYSA-N 0 0 398.202 3.408 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 ZINC000173187619 1426382937 /nfs/dbraw/zinc/38/29/37/1426382937.db2.gz WIJIFIBPUDMQNK-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCN(c2nccs2)CC1 ZINC000173205589 1426393445 /nfs/dbraw/zinc/39/34/45/1426393445.db2.gz RVBWLJTZIWMZAJ-UHFFFAOYSA-N 0 0 386.355 3.033 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H](C)c2nc(C3CCCCC3)no2)c1[N+](=O)[O-] ZINC000173222670 1426405146 /nfs/dbraw/zinc/40/51/46/1426405146.db2.gz ANOMZCJBXFFVGS-SNVBAGLBSA-N 0 0 376.417 3.192 20 5 GGBDRN CC(=O)N1CC(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)C1 ZINC000173223368 1426406794 /nfs/dbraw/zinc/40/67/94/1426406794.db2.gz UIVSNJFPVBMAJD-UHFFFAOYSA-N 0 0 385.445 3.015 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000173232307 1426417886 /nfs/dbraw/zinc/41/78/86/1426417886.db2.gz QZQFVXOBVLLFTP-NSHDSACASA-N 0 0 399.494 3.312 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000173233269 1426419028 /nfs/dbraw/zinc/41/90/28/1426419028.db2.gz QYTRLXVAJUDDEF-PBHICJAKSA-N 0 0 397.431 3.194 20 5 GGBDRN Cc1nn(CCC(=O)N2CC[C@@H](CSc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000173234957 1426421206 /nfs/dbraw/zinc/42/12/06/1426421206.db2.gz DBQIAKQKRYTKGW-MRXNPFEDSA-N 0 0 388.493 3.439 20 5 GGBDRN CN(C[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1)C(=O)OC(C)(C)C ZINC000173236116 1426422021 /nfs/dbraw/zinc/42/20/21/1426422021.db2.gz NKHSFAGTZSAPMA-MRXNPFEDSA-N 0 0 391.468 3.243 20 5 GGBDRN O=C(Nc1nc2ccccc2s1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173238693 1426423944 /nfs/dbraw/zinc/42/39/44/1426423944.db2.gz KCCCTLCQUXMAKU-LLVKDONJSA-N 0 0 384.421 3.318 20 5 GGBDRN C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1nc(C2CCCCC2)no1 ZINC000173252436 1426432622 /nfs/dbraw/zinc/43/26/22/1426432622.db2.gz BJEHACOPFTYVQF-SNVBAGLBSA-N 0 0 384.396 3.393 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1nc(C2CCCCC2)no1 ZINC000173252426 1426432736 /nfs/dbraw/zinc/43/27/36/1426432736.db2.gz BJEHACOPFTYVQF-JTQLQIEISA-N 0 0 384.396 3.393 20 5 GGBDRN CCc1ccc(C(=O)N(CC)CC(=O)NCc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000173258435 1426436907 /nfs/dbraw/zinc/43/69/07/1426436907.db2.gz LPWSDMHNPHOHJC-UHFFFAOYSA-N 0 0 387.411 3.075 20 5 GGBDRN CCc1ccc(C(=O)NC[C@H](c2cccs2)N2CCOCC2)cc1[N+](=O)[O-] ZINC000173259034 1426437827 /nfs/dbraw/zinc/43/78/27/1426437827.db2.gz OLSYUNBYDNCVAD-QGZVFWFLSA-N 0 0 389.477 3.022 20 5 GGBDRN COc1cc(OCC(=O)N2c3ccccc3N(C)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000173259685 1426439013 /nfs/dbraw/zinc/43/90/13/1426439013.db2.gz ARJMJXMTZPYDBD-CQSZACIVSA-N 0 0 385.420 3.244 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCc1ccn(-c2ccc(F)cc2)n1 ZINC000173266371 1426443765 /nfs/dbraw/zinc/44/37/65/1426443765.db2.gz ZVPJRCUODBWOID-UHFFFAOYSA-N 0 0 397.410 3.304 20 5 GGBDRN Cc1nsc(N2CCN(C(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)CC2)n1 ZINC000173273249 1426451209 /nfs/dbraw/zinc/45/12/09/1426451209.db2.gz GUEJHQMXZDAYOT-UHFFFAOYSA-N 0 0 389.481 3.015 20 5 GGBDRN CCc1ccc(C(=O)N[C@@H](c2nccn2C)c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000173277933 1426455411 /nfs/dbraw/zinc/45/54/11/1426455411.db2.gz MEQDQCXHSREFAS-LJQANCHMSA-N 0 0 394.431 3.419 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)cc1[N+](=O)[O-] ZINC000173281170 1426458043 /nfs/dbraw/zinc/45/80/43/1426458043.db2.gz OKWPQDDSTPWNIL-UHFFFAOYSA-N 0 0 396.447 3.499 20 5 GGBDRN CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000173286442 1426464853 /nfs/dbraw/zinc/46/48/53/1426464853.db2.gz IRAPCJXPUODGSO-KRWDZBQOSA-N 0 0 383.448 3.285 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000173293629 1426473227 /nfs/dbraw/zinc/47/32/27/1426473227.db2.gz AABZJUYPYZMVMO-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN COc1ccc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173294312 1426473873 /nfs/dbraw/zinc/47/38/73/1426473873.db2.gz QGFLUFZQJMWVTI-UHFFFAOYSA-N 0 0 385.420 3.356 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173294955 1426475334 /nfs/dbraw/zinc/47/53/34/1426475334.db2.gz QKILFCCCEHSXRC-IZZDOVSWSA-N 0 0 394.431 3.293 20 5 GGBDRN CC(C)(C)OC(=O)N(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC1CC1 ZINC000173295633 1426475620 /nfs/dbraw/zinc/47/56/20/1426475620.db2.gz OIQRTJFJKDVSBP-UHFFFAOYSA-N 0 0 375.425 3.131 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000173295587 1426476108 /nfs/dbraw/zinc/47/61/08/1426476108.db2.gz KCKUAQYUJGWMSQ-CQSZACIVSA-N 0 0 375.425 3.274 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000173295961 1426476934 /nfs/dbraw/zinc/47/69/34/1426476934.db2.gz XJVZLMUUXSOJIU-UHFFFAOYSA-N 0 0 388.449 3.168 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCC[C@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000173301402 1426483024 /nfs/dbraw/zinc/48/30/24/1426483024.db2.gz IIKLTVLLVDXDRD-AWEZNQCLSA-N 0 0 380.422 3.421 20 5 GGBDRN CN(CCc1cccs1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000173320762 1426503529 /nfs/dbraw/zinc/50/35/29/1426503529.db2.gz JWZAPVVBSQIQLI-UHFFFAOYSA-N 0 0 389.433 3.046 20 5 GGBDRN CN(CCc1cccs1)C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000173322641 1426505070 /nfs/dbraw/zinc/50/50/70/1426505070.db2.gz XEHUDYNYERRPNX-CYBMUJFWSA-N 0 0 393.490 3.024 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)c(F)c3)CC2)cc1[N+](=O)[O-] ZINC000173323339 1426505165 /nfs/dbraw/zinc/50/51/65/1426505165.db2.gz NXGCFOPSQOPISY-UHFFFAOYSA-N 0 0 399.422 3.203 20 5 GGBDRN CCC[C@@H](C)c1cc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)n[nH]1 ZINC000173327252 1426509468 /nfs/dbraw/zinc/50/94/68/1426509468.db2.gz QHBYFTSCVDSNEE-LLVKDONJSA-N 0 0 383.412 3.363 20 5 GGBDRN Cc1cccc(O[C@H](C)CNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000173330541 1426511302 /nfs/dbraw/zinc/51/13/02/1426511302.db2.gz YBLRTHULQPMMLC-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000173329906 1426511719 /nfs/dbraw/zinc/51/17/19/1426511719.db2.gz OTNXNUDOIOBKPU-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000173333897 1426515321 /nfs/dbraw/zinc/51/53/21/1426515321.db2.gz FDQFXDZJLVHOAU-UHFFFAOYSA-N 0 0 383.448 3.284 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cn3cc[nH]c3=S)CC2)c(C(F)(F)F)c1 ZINC000173337619 1426517946 /nfs/dbraw/zinc/51/79/46/1426517946.db2.gz VTFDPRSWQAVTLU-UHFFFAOYSA-N 0 0 387.387 3.252 20 5 GGBDRN COc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OCC(=O)NC1CC1 ZINC000173338369 1426519074 /nfs/dbraw/zinc/51/90/74/1426519074.db2.gz YRBGSWVSTXWIQQ-ZDUSSCGKSA-N 0 0 385.420 3.434 20 5 GGBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC000173342625 1426522130 /nfs/dbraw/zinc/52/21/30/1426522130.db2.gz RWUWYALLDMFCLG-CQSZACIVSA-N 0 0 396.447 3.257 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000173348925 1426526739 /nfs/dbraw/zinc/52/67/39/1426526739.db2.gz QMUZDLCHLORDRW-SNVBAGLBSA-N 0 0 381.310 3.371 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NCc1coc(-c2ccccc2)n1 ZINC000173350110 1426527927 /nfs/dbraw/zinc/52/79/27/1426527927.db2.gz OMIUFDOXIMOGGZ-UHFFFAOYSA-N 0 0 393.808 3.382 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)cc1[N+](=O)[O-] ZINC000173359149 1426533645 /nfs/dbraw/zinc/53/36/45/1426533645.db2.gz SMSDHSBFTUNUKC-UHFFFAOYSA-N 0 0 396.447 3.111 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)CN(Cc2ccccc2F)c2ccc(F)cc2)c1 ZINC000173373165 1426546116 /nfs/dbraw/zinc/54/61/16/1426546116.db2.gz FRXSLTGLUWKQAG-SFHVURJKSA-N 0 0 388.374 3.137 20 5 GGBDRN Nc1c(C(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)cc(F)cc1[N+](=O)[O-] ZINC000173387646 1426565596 /nfs/dbraw/zinc/56/55/96/1426565596.db2.gz NRYCWRGQTHYIGI-UHFFFAOYSA-N 0 0 389.774 3.467 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C2CC2)n1 ZINC000173398492 1426579458 /nfs/dbraw/zinc/57/94/58/1426579458.db2.gz FQDFGTPRMOVBEA-MRXNPFEDSA-N 0 0 383.433 3.427 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)cc1[N+](=O)[O-] ZINC000173399066 1426581266 /nfs/dbraw/zinc/58/12/66/1426581266.db2.gz YHJIWZDLPKFLMT-UHFFFAOYSA-N 0 0 378.392 3.263 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(CNC(=O)OC(C)(C)C)o1 ZINC000173400187 1426582522 /nfs/dbraw/zinc/58/25/22/1426582522.db2.gz MWDZTJBFZOZNKI-UHFFFAOYSA-N 0 0 389.408 3.485 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000173400051 1426582733 /nfs/dbraw/zinc/58/27/33/1426582733.db2.gz PJDMESZWBLIECY-IBGZPJMESA-N 0 0 381.432 3.053 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H](C)Oc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000173402903 1426587175 /nfs/dbraw/zinc/58/71/75/1426587175.db2.gz PSKYAOYINNGLOQ-LLVKDONJSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H](C)Oc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000173402922 1426587298 /nfs/dbraw/zinc/58/72/98/1426587298.db2.gz PSKYAOYINNGLOQ-NSHDSACASA-N 0 0 391.811 3.079 20 5 GGBDRN O=C(NCc1ccnc(-n2cccn2)c1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173404861 1426589453 /nfs/dbraw/zinc/58/94/53/1426589453.db2.gz XNLIBOLXTKDLJM-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)N1CCCC[C@H]1C ZINC000173413818 1426596206 /nfs/dbraw/zinc/59/62/06/1426596206.db2.gz XXTVHBSAIBNZDK-GHMZBOCLSA-N 0 0 387.358 3.133 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H](C)Oc1ccccc1Cl ZINC000173414495 1426597016 /nfs/dbraw/zinc/59/70/16/1426597016.db2.gz BETDJLFVZXQMPP-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(N3C(=O)CCC3=O)c(C)c2)cc1[N+](=O)[O-] ZINC000173418078 1426600373 /nfs/dbraw/zinc/60/03/73/1426600373.db2.gz CXVURYLXIWTUKO-UHFFFAOYSA-N 0 0 381.388 3.371 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000173426432 1426608967 /nfs/dbraw/zinc/60/89/67/1426608967.db2.gz DRIUYBGZAXAALB-UGSOOPFHSA-N 0 0 394.424 3.193 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)cc1[N+](=O)[O-] ZINC000173433531 1426615542 /nfs/dbraw/zinc/61/55/42/1426615542.db2.gz QBJREBOUFJVCSN-UHFFFAOYSA-N 0 0 388.855 3.164 20 5 GGBDRN CCOc1nn(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(=S)s1 ZINC000173435510 1426616737 /nfs/dbraw/zinc/61/67/37/1426616737.db2.gz DIJLBVZKSRZBNB-UHFFFAOYSA-N 0 0 396.494 3.482 20 5 GGBDRN COCCOc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000173437486 1426618525 /nfs/dbraw/zinc/61/85/25/1426618525.db2.gz NNXWVHSOBPSWCJ-UHFFFAOYSA-N 0 0 385.298 3.286 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCCc1nc(-c2ccncc2)cs1 ZINC000173456386 1426632910 /nfs/dbraw/zinc/63/29/10/1426632910.db2.gz IDJQPHWQXJNINX-UHFFFAOYSA-N 0 0 382.445 3.405 20 5 GGBDRN CS(=O)(=O)CCn1ccc(NC(=O)c2c3ccccc3cc3ccccc32)n1 ZINC000173463532 1426637963 /nfs/dbraw/zinc/63/79/63/1426637963.db2.gz JBJJUXTVIWAOCG-UHFFFAOYSA-N 0 0 393.468 3.486 20 5 GGBDRN CC(C)c1cccc(NC(=O)CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000173465957 1426640894 /nfs/dbraw/zinc/64/08/94/1426640894.db2.gz VSKLVIWZOSLLCN-QGZVFWFLSA-N 0 0 383.452 3.238 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(C[C@@H](O)c3ccccc3C(F)(F)F)C2)nc1 ZINC000173469631 1426644027 /nfs/dbraw/zinc/64/40/27/1426644027.db2.gz OPSVBSRGHBIKPW-BLLLJJGKSA-N 0 0 396.369 3.228 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(C[C@H](O)c3ccccc3C(F)(F)F)C2)nc1 ZINC000173469646 1426644059 /nfs/dbraw/zinc/64/40/59/1426644059.db2.gz OPSVBSRGHBIKPW-LRDDRELGSA-N 0 0 396.369 3.228 20 5 GGBDRN Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173469119 1426644197 /nfs/dbraw/zinc/64/41/97/1426644197.db2.gz LHFXHUVYEAAYIN-BBWFWOEESA-N 0 0 397.479 3.050 20 5 GGBDRN CCO[C@@H](C)c1nc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000173470033 1426645120 /nfs/dbraw/zinc/64/51/20/1426645120.db2.gz YAMKJJDQSSGORO-STQMWFEESA-N 0 0 377.470 3.230 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000173483159 1426656006 /nfs/dbraw/zinc/65/60/06/1426656006.db2.gz YYKAECCTZPCVES-HNNXBMFYSA-N 0 0 378.450 3.245 20 5 GGBDRN CCS[C@H]1CC[C@H](N(C)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C1 ZINC000173486247 1426659474 /nfs/dbraw/zinc/65/94/74/1426659474.db2.gz FQZKYTANQBVOGM-RDJZCZTQSA-N 0 0 388.493 3.382 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C1 ZINC000173486259 1426659504 /nfs/dbraw/zinc/65/95/04/1426659504.db2.gz FQZKYTANQBVOGM-NVXWUHKLSA-N 0 0 388.493 3.382 20 5 GGBDRN COc1cc(C)c([C@H](C)NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000173499002 1426668241 /nfs/dbraw/zinc/66/82/41/1426668241.db2.gz GCTWVKANXWTHMH-AWEZNQCLSA-N 0 0 387.436 3.234 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)CN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000173506752 1426675269 /nfs/dbraw/zinc/67/52/69/1426675269.db2.gz JJLZORPJNDQYSL-ZDUSSCGKSA-N 0 0 375.450 3.184 20 5 GGBDRN C[C@H](CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Sc1ccccc1 ZINC000173507202 1426676998 /nfs/dbraw/zinc/67/69/98/1426676998.db2.gz VXXNRBWDNAWYHV-LLVKDONJSA-N 0 0 393.852 3.484 20 5 GGBDRN Cc1cccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1C(=O)N1CCCC1 ZINC000173512958 1426683214 /nfs/dbraw/zinc/68/32/14/1426683214.db2.gz ZGVUJIWLKOYAGZ-UHFFFAOYSA-N 0 0 396.447 3.214 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000173522045 1426696259 /nfs/dbraw/zinc/69/62/59/1426696259.db2.gz NRJVEKFYTGRVKP-HNNXBMFYSA-N 0 0 375.454 3.222 20 5 GGBDRN C[C@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000173522064 1426696268 /nfs/dbraw/zinc/69/62/68/1426696268.db2.gz XTAPSIBWSVBNQP-HNNXBMFYSA-N 0 0 394.435 3.253 20 5 GGBDRN C[C@H](c1ccc(F)cc1F)N1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000173534503 1426710534 /nfs/dbraw/zinc/71/05/34/1426710534.db2.gz UHRUZYBLDXAASQ-CQSZACIVSA-N 0 0 389.402 3.321 20 5 GGBDRN O=C(NCc1ccc(-n2cncn2)cc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173537896 1426713535 /nfs/dbraw/zinc/71/35/35/1426713535.db2.gz CHHZKOFCEZERGU-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1cccc(Cl)c1 ZINC000173540189 1426714532 /nfs/dbraw/zinc/71/45/32/1426714532.db2.gz GHAVOZAKRDIMOA-QGZVFWFLSA-N 0 0 377.828 3.432 20 5 GGBDRN C[C@H]1CN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](c2ccccc2)CO1 ZINC000173541940 1426715685 /nfs/dbraw/zinc/71/56/85/1426715685.db2.gz CCCWCMVQYKGTOO-KXBFYZLASA-N 0 0 379.420 3.273 20 5 GGBDRN Cc1ccccc1-c1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n(C)n1 ZINC000173545497 1426719284 /nfs/dbraw/zinc/71/92/84/1426719284.db2.gz RWPVKIBPVJEHDI-UHFFFAOYSA-N 0 0 381.348 3.464 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(C3N=NC(=S)N3C3CC3)CC2)c1 ZINC000173550343 1426722992 /nfs/dbraw/zinc/72/29/92/1426722992.db2.gz JZXQRTADZUDCRX-UHFFFAOYSA-N 0 0 387.465 3.138 20 5 GGBDRN O=C([C@H]1SCCc2sccc21)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560107 1426730032 /nfs/dbraw/zinc/73/00/32/1426730032.db2.gz QVIMNOPKRYBLJO-ZBEGNZNMSA-N 0 0 390.490 3.095 20 5 GGBDRN C[C@H](CCc1ccccc1F)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173559981 1426730468 /nfs/dbraw/zinc/73/04/68/1426730468.db2.gz PNZNMVRZLMREHA-ZBFHGGJFSA-N 0 0 386.427 3.411 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000173572655 1426739243 /nfs/dbraw/zinc/73/92/43/1426739243.db2.gz QKULVOGFQNFFCK-KGLIPLIRSA-N 0 0 379.457 3.375 20 5 GGBDRN COc1cc(C(=O)N[C@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000173581574 1426746892 /nfs/dbraw/zinc/74/68/92/1426746892.db2.gz XYEWXDSOUQCWKE-HNNXBMFYSA-N 0 0 377.422 3.258 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C2CC2)s1 ZINC000173590131 1426753864 /nfs/dbraw/zinc/75/38/64/1426753864.db2.gz APJBGOWZMGSOQL-AWEZNQCLSA-N 0 0 376.394 3.457 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000173595495 1426760614 /nfs/dbraw/zinc/76/06/14/1426760614.db2.gz VNJBJASHOBKOHF-AWEZNQCLSA-N 0 0 391.468 3.289 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000173595508 1426760832 /nfs/dbraw/zinc/76/08/32/1426760832.db2.gz VNJBJASHOBKOHF-CQSZACIVSA-N 0 0 391.468 3.289 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@H](c2ncc(C)s2)C2CC2)cc([N+](=O)[O-])c1 ZINC000173600728 1426770466 /nfs/dbraw/zinc/77/04/66/1426770466.db2.gz SHYDBCLTTSVYGG-OAHLLOKOSA-N 0 0 389.433 3.418 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@H](c2ncc(C)s2)C2CC2)cc([N+](=O)[O-])c1 ZINC000173601978 1426772343 /nfs/dbraw/zinc/77/23/43/1426772343.db2.gz WVMJLLBSHKXZQZ-AWEZNQCLSA-N 0 0 375.406 3.027 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C2CC2)s1 ZINC000173604801 1426777986 /nfs/dbraw/zinc/77/79/86/1426777986.db2.gz BOMWZQRCUPNALP-INIZCTEOSA-N 0 0 383.433 3.427 20 5 GGBDRN C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Oc2ccc(-c3nnn[n-]3)cc2)CC1 ZINC000820571091 1426780409 /nfs/dbraw/zinc/78/04/09/1426780409.db2.gz VMXVBHJNACJFCE-AWEZNQCLSA-N 0 0 394.435 3.379 20 5 GGBDRN CCc1cccc(NC(=O)C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000173614140 1426790870 /nfs/dbraw/zinc/79/08/70/1426790870.db2.gz ZZDSORNOWPYOSU-UHFFFAOYSA-N 0 0 397.431 3.166 20 5 GGBDRN Cc1cccc(C)c1NC(=O)C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173614193 1426791222 /nfs/dbraw/zinc/79/12/22/1426791222.db2.gz NJWVJONXKMMQOG-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000173616456 1426796390 /nfs/dbraw/zinc/79/63/90/1426796390.db2.gz UDWPDCJOAVHYSS-LLVKDONJSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H](C)Oc1ccc(Cl)cc1 ZINC000173618090 1426799079 /nfs/dbraw/zinc/79/90/79/1426799079.db2.gz GCIQVDBCNNBQBR-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN C[C@@H](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(=O)c1cccc(F)c1 ZINC000173620214 1426800556 /nfs/dbraw/zinc/80/05/56/1426800556.db2.gz IWHXWYSXNXWSAP-HNNXBMFYSA-N 0 0 399.422 3.292 20 5 GGBDRN CC(C)=CC(=O)NCc1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000173620003 1426800565 /nfs/dbraw/zinc/80/05/65/1426800565.db2.gz VNPTYBADTFZSEC-UHFFFAOYSA-N 0 0 379.416 3.380 20 5 GGBDRN C[C@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000173624570 1426801714 /nfs/dbraw/zinc/80/17/14/1426801714.db2.gz YZXGCVXYFOEXSX-AWEZNQCLSA-N 0 0 380.408 3.312 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000173624585 1426801883 /nfs/dbraw/zinc/80/18/83/1426801883.db2.gz YZXGCVXYFOEXSX-CQSZACIVSA-N 0 0 380.408 3.312 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000173626007 1426802057 /nfs/dbraw/zinc/80/20/57/1426802057.db2.gz CTVVZAFLMVGJCC-NSHDSACASA-N 0 0 388.811 3.269 20 5 GGBDRN C[C@@H](NC(=O)Cc1csc(NC(=O)C(C)(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000173626139 1426802206 /nfs/dbraw/zinc/80/22/06/1426802206.db2.gz QRWXNCGNNUMGSC-LLVKDONJSA-N 0 0 390.465 3.456 20 5 GGBDRN COc1ccc(OCCN2CCO[C@H](c3cccc(F)c3)C2)c([N+](=O)[O-])c1 ZINC000173630225 1426803172 /nfs/dbraw/zinc/80/31/72/1426803172.db2.gz YJLGSVAMPGANGY-IBGZPJMESA-N 0 0 376.384 3.195 20 5 GGBDRN COc1ccc(OCCN2CCO[C@@H](c3ccc(F)c(F)c3)C2)c([N+](=O)[O-])c1 ZINC000173631103 1426803228 /nfs/dbraw/zinc/80/32/28/1426803228.db2.gz PTRPAGWTGNWJGX-LJQANCHMSA-N 0 0 394.374 3.334 20 5 GGBDRN COc1ccc(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000173630691 1426803256 /nfs/dbraw/zinc/80/32/56/1426803256.db2.gz CNRBXQLQJJKINQ-QGZVFWFLSA-N 0 0 397.431 3.028 20 5 GGBDRN O=C(c1cc2ccccc2oc1=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173632195 1426803454 /nfs/dbraw/zinc/80/34/54/1426803454.db2.gz GCVDXMNPJCCFGW-UHFFFAOYSA-N 0 0 394.383 3.385 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])on1 ZINC000173633138 1426803753 /nfs/dbraw/zinc/80/37/53/1426803753.db2.gz AEZSDBJVEUDNEB-UHFFFAOYSA-N 0 0 377.397 3.434 20 5 GGBDRN O=C(c1cccc(-n2cccn2)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173633520 1426803995 /nfs/dbraw/zinc/80/39/95/1426803995.db2.gz ACNIKKFZFLETFT-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN COc1ccc2c(c1)N(Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)C[C@H](C)O2 ZINC000173633559 1426804081 /nfs/dbraw/zinc/80/40/81/1426804081.db2.gz KUEOHKUHCIPUQB-LBPRGKRZSA-N 0 0 382.376 3.441 20 5 GGBDRN O=C(c1cccnc1N1CCCC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173634987 1426804363 /nfs/dbraw/zinc/80/43/63/1426804363.db2.gz DXJRAQWFMNNMOZ-UHFFFAOYSA-N 0 0 396.447 3.274 20 5 GGBDRN C[S@](=O)c1ccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173636636 1426805238 /nfs/dbraw/zinc/80/52/38/1426805238.db2.gz QZRWLBFVBIKENM-MHZLTWQESA-N 0 0 388.445 3.016 20 5 GGBDRN Cc1c(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cccc1[N+](=O)[O-] ZINC000173637913 1426805423 /nfs/dbraw/zinc/80/54/23/1426805423.db2.gz ZHLBMYAFMMCPAF-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN O=C(c1cc2c(s1)CCOC2)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173637440 1426805431 /nfs/dbraw/zinc/80/54/31/1426805431.db2.gz JJZXBBWGYXPMAN-UHFFFAOYSA-N 0 0 388.445 3.413 20 5 GGBDRN O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173638890 1426805787 /nfs/dbraw/zinc/80/57/87/1426805787.db2.gz LCYMVHINIPIQGZ-FQEVSTJZSA-N 0 0 395.415 3.158 20 5 GGBDRN Cc1nc2ccccc2n1CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173638855 1426805795 /nfs/dbraw/zinc/80/57/95/1426805795.db2.gz SQUPARVIIBXAIQ-UHFFFAOYSA-N 0 0 394.431 3.323 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000173638425 1426805894 /nfs/dbraw/zinc/80/58/94/1426805894.db2.gz DMRMKDZQAADDKW-LLVKDONJSA-N 0 0 384.358 3.429 20 5 GGBDRN O=C(CSCc1cccnc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173640991 1426806923 /nfs/dbraw/zinc/80/69/23/1426806923.db2.gz YBAFQGAWFNUJIM-UHFFFAOYSA-N 0 0 387.461 3.293 20 5 GGBDRN O=C(c1cc(F)cc2nccnc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173640976 1426806946 /nfs/dbraw/zinc/80/69/46/1426806946.db2.gz TWFSQGHKXYPNFN-UHFFFAOYSA-N 0 0 396.378 3.361 20 5 GGBDRN O=C(CSCc1ccccn1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173642520 1426807613 /nfs/dbraw/zinc/80/76/13/1426807613.db2.gz FBMZFFMQFNWKFX-UHFFFAOYSA-N 0 0 387.461 3.293 20 5 GGBDRN C[C@@H](C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N1CCc2ccccc21 ZINC000173642784 1426807673 /nfs/dbraw/zinc/80/76/73/1426807673.db2.gz JZYQTBAYWGJCHV-INIZCTEOSA-N 0 0 395.459 3.416 20 5 GGBDRN CN(CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)Cc1ccccc1 ZINC000173644486 1426808335 /nfs/dbraw/zinc/80/83/35/1426808335.db2.gz HAYFFPSNHNCBEY-UHFFFAOYSA-N 0 0 383.448 3.097 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)on1 ZINC000173644443 1426808348 /nfs/dbraw/zinc/80/83/48/1426808348.db2.gz YSCMJEBJBWKNII-UHFFFAOYSA-N 0 0 375.381 3.203 20 5 GGBDRN Cc1nn(CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C)c1Cl ZINC000173644368 1426808456 /nfs/dbraw/zinc/80/84/56/1426808456.db2.gz UMHXCKZJNBGXCA-UHFFFAOYSA-N 0 0 392.843 3.132 20 5 GGBDRN CCC[C@]1(C)CCCN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000173649954 1426810252 /nfs/dbraw/zinc/81/02/52/1426810252.db2.gz FTTFDYWNMJDVEO-GOSISDBHSA-N 0 0 381.860 3.407 20 5 GGBDRN Cc1nn(CCC(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] ZINC000173657332 1426812222 /nfs/dbraw/zinc/81/22/22/1426812222.db2.gz BJFKKYCMUVXGHL-LLVKDONJSA-N 0 0 380.832 3.035 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@@H](c2ccccc2)CO1 ZINC000173673781 1426817168 /nfs/dbraw/zinc/81/71/68/1426817168.db2.gz DAIUGCHYXIWCCY-FOIQADDNSA-N 0 0 392.415 3.383 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](C3N=NC(=S)N3C(C)C)C2)c1 ZINC000173679647 1426819032 /nfs/dbraw/zinc/81/90/32/1426819032.db2.gz MASZUQTUJBHHLB-ZDUSSCGKSA-N 0 0 389.481 3.384 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](C3N=NC(=S)N3C3CC3)C2)c1 ZINC000173679922 1426819345 /nfs/dbraw/zinc/81/93/45/1426819345.db2.gz MWYOEOIHQLJFSN-LBPRGKRZSA-N 0 0 387.465 3.138 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)Cc1nccn1C(F)F ZINC000173681091 1426819702 /nfs/dbraw/zinc/81/97/02/1426819702.db2.gz ONLIYBXHJJYNSC-SECBINFHSA-N 0 0 387.774 3.299 20 5 GGBDRN Cc1nc(CN2CCC(CNC(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)oc1C ZINC000173681268 1426819717 /nfs/dbraw/zinc/81/97/17/1426819717.db2.gz YEXOUUDDOKRHGP-UHFFFAOYSA-N 0 0 386.452 3.150 20 5 GGBDRN CCN(CC)c1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000173682819 1426820179 /nfs/dbraw/zinc/82/01/79/1426820179.db2.gz QYVUECVFLDRRQW-INIZCTEOSA-N 0 0 383.452 3.163 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(CNC(=O)C=C(C)C)cc1 ZINC000173685669 1426820807 /nfs/dbraw/zinc/82/08/07/1426820807.db2.gz BFSKRHHKUDUOSY-UHFFFAOYSA-N 0 0 397.431 3.116 20 5 GGBDRN O=C([C@@H]1C[C@@]12CCCc1ccccc12)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173684716 1426820903 /nfs/dbraw/zinc/82/09/03/1426820903.db2.gz KXURHZHTJRSIBS-XWFZLUIHSA-N 0 0 392.459 3.297 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](n3ccnc3)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000173689464 1426821771 /nfs/dbraw/zinc/82/17/71/1426821771.db2.gz ZSQOTNSDHZHKCN-INIZCTEOSA-N 0 0 398.444 3.092 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CC[C@H](COCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000173692576 1426822784 /nfs/dbraw/zinc/82/27/84/1426822784.db2.gz UGMYGWUTGJTTJZ-KRWDZBQOSA-N 0 0 390.461 3.131 20 5 GGBDRN COc1ccc(NC(=O)CN(C)[C@H](C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC000173695351 1426823434 /nfs/dbraw/zinc/82/34/34/1426823434.db2.gz CTGHXOFIRXDGCA-CQSZACIVSA-N 0 0 387.436 3.114 20 5 GGBDRN O=C(CCNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC1CCCCC1 ZINC000173695246 1426823517 /nfs/dbraw/zinc/82/35/17/1426823517.db2.gz GKSRVDWAVMWMHN-UHFFFAOYSA-N 0 0 387.358 3.182 20 5 GGBDRN COc1ccccc1C[C@@H](C)N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000173694359 1426823603 /nfs/dbraw/zinc/82/36/03/1426823603.db2.gz FXILCVVVZXLVAC-CQSZACIVSA-N 0 0 387.436 3.114 20 5 GGBDRN CC[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000173701167 1426825430 /nfs/dbraw/zinc/82/54/30/1426825430.db2.gz REVUJCMEPIQQQA-OAHLLOKOSA-N 0 0 385.420 3.070 20 5 GGBDRN CC[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000173701157 1426825568 /nfs/dbraw/zinc/82/55/68/1426825568.db2.gz REVUJCMEPIQQQA-HNNXBMFYSA-N 0 0 385.420 3.070 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](c2ccccc2)CO1 ZINC000173703129 1426826309 /nfs/dbraw/zinc/82/63/09/1426826309.db2.gz ZJAOJLKJYFPAQS-BFUOFWGJSA-N 0 0 393.399 3.039 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1C(=O)N1CCC2(CCCC2)C1 ZINC000173726602 1426832430 /nfs/dbraw/zinc/83/24/30/1426832430.db2.gz BOGQZVJNAKPUDU-CYBMUJFWSA-N 0 0 377.466 3.054 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CCC3(CCCC3)C2)ccc1[N+](=O)[O-] ZINC000173738599 1426835634 /nfs/dbraw/zinc/83/56/34/1426835634.db2.gz RJBLDWTVOJHEBS-SFHVURJKSA-N 0 0 385.464 3.301 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000173742041 1426836704 /nfs/dbraw/zinc/83/67/04/1426836704.db2.gz AUCQPWSJFBFQOK-UHFFFAOYSA-N 0 0 389.355 3.498 20 5 GGBDRN CC(C)=CC(=O)NCc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000173756597 1426841095 /nfs/dbraw/zinc/84/10/95/1426841095.db2.gz ALRKSBFPBOQHFJ-UHFFFAOYSA-N 0 0 381.432 3.150 20 5 GGBDRN O=C(N[C@H]1CCCC[C@@H]1n1cccn1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000173760498 1426842781 /nfs/dbraw/zinc/84/27/81/1426842781.db2.gz PGMLSHDRWPJMDR-IRXDYDNUSA-N 0 0 383.452 3.305 20 5 GGBDRN COc1ccccc1C[C@@H](C)N(C)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000173760828 1426843131 /nfs/dbraw/zinc/84/31/31/1426843131.db2.gz BCAZQRIUAKWHDY-CQSZACIVSA-N 0 0 378.450 3.164 20 5 GGBDRN CCc1ccc([C@H]2COCCN2CCOc2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000173771637 1426845949 /nfs/dbraw/zinc/84/59/49/1426845949.db2.gz WEUUWGSATPIVQJ-QGZVFWFLSA-N 0 0 376.409 3.211 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2CCOc2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000173771623 1426845958 /nfs/dbraw/zinc/84/59/58/1426845958.db2.gz WEUUWGSATPIVQJ-KRWDZBQOSA-N 0 0 376.409 3.211 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173799164 1426854300 /nfs/dbraw/zinc/85/43/00/1426854300.db2.gz FVVKEXNUNLQDDY-HNNXBMFYSA-N 0 0 399.447 3.474 20 5 GGBDRN O=C(NC1CC1)[C@@H](c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173799689 1426854358 /nfs/dbraw/zinc/85/43/58/1426854358.db2.gz QSZUFZYWIAHURK-OAQYLSRUSA-N 0 0 395.459 3.458 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@H]1n1cccn1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000173801289 1426855040 /nfs/dbraw/zinc/85/50/40/1426855040.db2.gz XAZMMGLPMBARMY-QZTJIDSGSA-N 0 0 397.479 3.308 20 5 GGBDRN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000173808051 1426856871 /nfs/dbraw/zinc/85/68/71/1426856871.db2.gz OBFLQBSFQZEKCB-APWZRJJASA-N 0 0 397.431 3.126 20 5 GGBDRN Cn1ccc2ccc(NC(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)cc21 ZINC000173819699 1426859882 /nfs/dbraw/zinc/85/98/82/1426859882.db2.gz LNFHKCTZQJTJBV-UHFFFAOYSA-N 0 0 379.420 3.441 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000173823854 1426860989 /nfs/dbraw/zinc/86/09/89/1426860989.db2.gz PDKYVLRAAYMBIU-HNNXBMFYSA-N 0 0 377.441 3.375 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](C)c2cccc(-n3cccn3)c2)cc1[N+](=O)[O-] ZINC000173828948 1426862622 /nfs/dbraw/zinc/86/26/22/1426862622.db2.gz LVQXLPJTHIGIOG-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](C)c1cccc(-n2cccn2)c1 ZINC000173828622 1426862759 /nfs/dbraw/zinc/86/27/59/1426862759.db2.gz HAMZTZCYVDWTSM-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN CC(C)CC(=O)Nc1cccc(CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000173834750 1426864657 /nfs/dbraw/zinc/86/46/57/1426864657.db2.gz BIQHROXUKWOJAQ-UHFFFAOYSA-N 0 0 398.463 3.332 20 5 GGBDRN O=C([C@@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000173847095 1426869490 /nfs/dbraw/zinc/86/94/90/1426869490.db2.gz CQDLKYAYNPSMLK-OAHLLOKOSA-N 0 0 385.807 3.190 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173848728 1426869823 /nfs/dbraw/zinc/86/98/23/1426869823.db2.gz AEOGGZVAEHEVMT-MRXNPFEDSA-N 0 0 398.444 3.092 20 5 GGBDRN C[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000173848445 1426869833 /nfs/dbraw/zinc/86/98/33/1426869833.db2.gz PLCHSKAEWCZAKU-HNNXBMFYSA-N 0 0 396.447 3.035 20 5 GGBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000173848460 1426869902 /nfs/dbraw/zinc/86/99/02/1426869902.db2.gz PLCHSKAEWCZAKU-OAHLLOKOSA-N 0 0 396.447 3.035 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(CC3CC3)c3ccccc32)c(F)c1 ZINC000173851248 1426870803 /nfs/dbraw/zinc/87/08/03/1426870803.db2.gz SGAPIPIICZEORL-UHFFFAOYSA-N 0 0 391.424 3.159 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCN(CC3CC3)c3ccccc32)cc1 ZINC000173851206 1426870915 /nfs/dbraw/zinc/87/09/15/1426870915.db2.gz JYALCKYBNNVYCO-UHFFFAOYSA-N 0 0 387.461 3.161 20 5 GGBDRN CN(CC(=O)N1CCC(OCCc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000173871449 1426877691 /nfs/dbraw/zinc/87/76/91/1426877691.db2.gz LAYHTSVSGAKMAF-UHFFFAOYSA-N 0 0 397.475 3.281 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@@H](C)CC ZINC000173892509 1426883158 /nfs/dbraw/zinc/88/31/58/1426883158.db2.gz MPYHLACYIVYWFP-YCRPNKLZSA-N 0 0 394.471 3.249 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc21 ZINC000173901673 1426885499 /nfs/dbraw/zinc/88/54/99/1426885499.db2.gz ZMPYBKAZOGFJOT-ZDUSSCGKSA-N 0 0 395.419 3.178 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ncccc1OCc1cccc(Cl)c1 ZINC000173905552 1426886730 /nfs/dbraw/zinc/88/67/30/1426886730.db2.gz FQXASGOPMUYSGR-UHFFFAOYSA-N 0 0 387.783 3.057 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)Cc2nc(C(F)(F)F)cs2)c1[N+](=O)[O-] ZINC000173920474 1426892566 /nfs/dbraw/zinc/89/25/66/1426892566.db2.gz UBNPDPAYVZMCBL-UHFFFAOYSA-N 0 0 390.343 3.278 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)c3ccc(F)cc3F)CC2)cc1 ZINC000173930851 1426897090 /nfs/dbraw/zinc/89/70/90/1426897090.db2.gz DBIMLQWUVATRKD-UHFFFAOYSA-N 0 0 398.387 3.105 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)CC[C@@H]1c1ccccc1 ZINC000173933749 1426898028 /nfs/dbraw/zinc/89/80/28/1426898028.db2.gz VCQFJWLJEALRMJ-BEFAXECRSA-N 0 0 391.431 3.441 20 5 GGBDRN C[C@@H]1CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC[C@H]1c1ccccc1 ZINC000173947906 1426904574 /nfs/dbraw/zinc/90/45/74/1426904574.db2.gz FZRRXZRSNFVJAX-RHSMWYFYSA-N 0 0 395.415 3.155 20 5 GGBDRN C[C@H]1CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC[C@@H]1c1ccccc1 ZINC000173947895 1426904638 /nfs/dbraw/zinc/90/46/38/1426904638.db2.gz FZRRXZRSNFVJAX-YOEHRIQHSA-N 0 0 395.415 3.155 20 5 GGBDRN C[C@H]1CN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000173957353 1426909245 /nfs/dbraw/zinc/90/92/45/1426909245.db2.gz VRRNOWZMEDTKIP-SGTLLEGYSA-N 0 0 385.445 3.005 20 5 GGBDRN Cc1ccc(C)c(OC[C@H](O)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)c1C ZINC000173959462 1426909889 /nfs/dbraw/zinc/90/98/89/1426909889.db2.gz KXVCZOIMTYBSPH-QGZVFWFLSA-N 0 0 382.420 3.218 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(OCc2ccccn2)c(F)c1 ZINC000173973090 1426918077 /nfs/dbraw/zinc/91/80/77/1426918077.db2.gz TXNGTINFTVTDHS-UHFFFAOYSA-N 0 0 399.382 3.242 20 5 GGBDRN Cc1ccc(NS(C)(=O)=O)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000173973577 1426918766 /nfs/dbraw/zinc/91/87/66/1426918766.db2.gz XWDCZOZIGCEETK-UHFFFAOYSA-N 0 0 397.840 3.109 20 5 GGBDRN CC(=O)N1CCCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c2ccccc21 ZINC000173976853 1426921763 /nfs/dbraw/zinc/92/17/63/1426921763.db2.gz MDRYUHCOTAMBRU-UHFFFAOYSA-N 0 0 398.375 3.215 20 5 GGBDRN CC(=O)N1CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000173981519 1426924703 /nfs/dbraw/zinc/92/47/03/1426924703.db2.gz UQTCHLGSMYSPTE-UHFFFAOYSA-N 0 0 385.445 3.477 20 5 GGBDRN CC(=O)N1CCCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c2ccccc21 ZINC000173984351 1426927146 /nfs/dbraw/zinc/92/71/46/1426927146.db2.gz WKSWMSWSRNRHRH-UHFFFAOYSA-N 0 0 398.375 3.215 20 5 GGBDRN C[C@@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000173985524 1426927277 /nfs/dbraw/zinc/92/72/77/1426927277.db2.gz UOOXFTYRYDFAPU-XIKOKIGWSA-N 0 0 387.823 3.198 20 5 GGBDRN CC(C)C[C@H](CCO)CNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000173990346 1426929798 /nfs/dbraw/zinc/92/97/98/1426929798.db2.gz WVGHZHOEWCHKDA-ZDUSSCGKSA-N 0 0 394.859 3.251 20 5 GGBDRN CCN(CC1CCN(c2c([N+](=O)[O-])c(C)nn2C)CC1)C(=O)OC(C)(C)C ZINC000173993006 1426930479 /nfs/dbraw/zinc/93/04/79/1426930479.db2.gz LVHMCVNDPYYYTF-UHFFFAOYSA-N 0 0 381.477 3.110 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1C(=O)N1CCC2(C1)CCCCC2 ZINC000173992647 1426930930 /nfs/dbraw/zinc/93/09/30/1426930930.db2.gz WNXNOINRMWLFQL-CQSZACIVSA-N 0 0 391.493 3.444 20 5 GGBDRN CCC(CC)(CCO)CNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000173993870 1426931687 /nfs/dbraw/zinc/93/16/87/1426931687.db2.gz KJEDPOKPWMLFKW-UHFFFAOYSA-N 0 0 394.859 3.395 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](C)OC[C@H]1c1ccccc1 ZINC000174006645 1426938826 /nfs/dbraw/zinc/93/88/26/1426938826.db2.gz VAMZUUGFDOVMLK-KSSFIOAISA-N 0 0 385.420 3.004 20 5 GGBDRN O=C(NCCc1cccs1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174006841 1426939145 /nfs/dbraw/zinc/93/91/45/1426939145.db2.gz QYKMSTICKYSDAJ-UHFFFAOYSA-N 0 0 375.450 3.452 20 5 GGBDRN CN1CCN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccc(F)cc21 ZINC000174019094 1426946719 /nfs/dbraw/zinc/94/67/19/1426946719.db2.gz BHZVRSNFYXIFJH-UHFFFAOYSA-N 0 0 385.804 3.032 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)[C@@H]2c2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000174020791 1426948222 /nfs/dbraw/zinc/94/82/22/1426948222.db2.gz SQXDRTYVYWEGEH-BFUOFWGJSA-N 0 0 377.404 3.317 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)[C@H]2c2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000174020807 1426948318 /nfs/dbraw/zinc/94/83/18/1426948318.db2.gz SQXDRTYVYWEGEH-YJYMSZOUSA-N 0 0 377.404 3.317 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(C(N)=O)ccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000174035687 1426959379 /nfs/dbraw/zinc/95/93/79/1426959379.db2.gz JAYIQUYHLBQKAC-UHFFFAOYSA-N 0 0 382.420 3.109 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@H](c3nnc4ccccn43)C2)cc1[N+](=O)[O-] ZINC000174041510 1426964576 /nfs/dbraw/zinc/96/45/76/1426964576.db2.gz XYFQZCRLDQVVTK-INIZCTEOSA-N 0 0 379.420 3.220 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000174046427 1426969496 /nfs/dbraw/zinc/96/94/96/1426969496.db2.gz RDLLEEHIKPBPRX-JOCHJYFZSA-N 0 0 383.223 3.347 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)OCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000174047537 1426970076 /nfs/dbraw/zinc/97/00/76/1426970076.db2.gz OCZBSDJVYDYCCK-UHFFFAOYSA-N 0 0 377.422 3.322 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1N1CCOC1=O ZINC000174049198 1426970704 /nfs/dbraw/zinc/97/07/04/1426970704.db2.gz CDTURBHSPWDEJK-UHFFFAOYSA-N 0 0 377.303 3.390 20 5 GGBDRN COc1ccc(-c2ncc(C(=O)OCCn3c(C)ncc3[N+](=O)[O-])s2)cc1 ZINC000174048024 1426970825 /nfs/dbraw/zinc/97/08/25/1426970825.db2.gz DTHJRCZQIQGODS-UHFFFAOYSA-N 0 0 388.405 3.089 20 5 GGBDRN CC(C)[C@H](Cc1ccc(F)cc1)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000174049911 1426971883 /nfs/dbraw/zinc/97/18/83/1426971883.db2.gz NSLLKGWSUWKKEV-SFHVURJKSA-N 0 0 380.441 3.421 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCC[C@H]2n2cccn2)cc1OC ZINC000174056110 1426976954 /nfs/dbraw/zinc/97/69/54/1426976954.db2.gz YQTDSAFLLFDAHS-LSDHHAIUSA-N 0 0 388.424 3.112 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C2CCCCC2)no1 ZINC000174065557 1426983363 /nfs/dbraw/zinc/98/33/63/1426983363.db2.gz WJNKTHSMXUOQBL-LLVKDONJSA-N 0 0 380.426 3.065 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C)c1nc(C2CCCCC2)no1 ZINC000174067337 1426984169 /nfs/dbraw/zinc/98/41/69/1426984169.db2.gz MXSZZQCSJGFSFX-LBPRGKRZSA-N 0 0 394.453 3.373 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](C)c1nc(C2CCCCC2)no1 ZINC000174067432 1426984239 /nfs/dbraw/zinc/98/42/39/1426984239.db2.gz YXJWUAWZOPILSZ-LBPRGKRZSA-N 0 0 394.453 3.373 20 5 GGBDRN CCc1ccc(C(=O)N2CCCN(C(=O)c3cccc(C)c3)CC2)cc1[N+](=O)[O-] ZINC000174069938 1426985900 /nfs/dbraw/zinc/98/59/00/1426985900.db2.gz GXMXRHBFGPOLJK-UHFFFAOYSA-N 0 0 395.459 3.454 20 5 GGBDRN CCc1ccc(C(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000174070752 1426986408 /nfs/dbraw/zinc/98/64/08/1426986408.db2.gz TUKKPIYCEQWVLI-UHFFFAOYSA-N 0 0 399.422 3.285 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000174072652 1426987505 /nfs/dbraw/zinc/98/75/05/1426987505.db2.gz OMSLFSLVZVCUBO-UHFFFAOYSA-N 0 0 387.480 3.412 20 5 GGBDRN Cc1nn(C)c(C)c1CNC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000174075070 1426988858 /nfs/dbraw/zinc/98/88/58/1426988858.db2.gz VQWFCZSVGKMCQS-ZIAGYGMSSA-N 0 0 399.495 3.357 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(=O)N(C)C)c1ccccc1 ZINC000174075982 1426989709 /nfs/dbraw/zinc/98/97/09/1426989709.db2.gz YHLVBDLHSWNYSJ-AWEZNQCLSA-N 0 0 387.461 3.197 20 5 GGBDRN Cc1ccc([C@H]2OCCC[C@H]2CNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000174078417 1426990497 /nfs/dbraw/zinc/99/04/97/1426990497.db2.gz KCVPINOZTWKDQV-QFBILLFUSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1ccc([C@@H]2OCCC[C@H]2CNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000174078434 1426991029 /nfs/dbraw/zinc/99/10/29/1426991029.db2.gz KCVPINOZTWKDQV-LPHOPBHVSA-N 0 0 390.461 3.349 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Cl)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174083838 1426993230 /nfs/dbraw/zinc/99/32/30/1426993230.db2.gz WCJDSNLQCGCWGT-LBPRGKRZSA-N 0 0 383.832 3.330 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)CC1 ZINC000174089388 1426995913 /nfs/dbraw/zinc/99/59/13/1426995913.db2.gz CXMBUWSXQWFTST-UHFFFAOYSA-N 0 0 375.469 3.316 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)Cn2ncc3ccc([N+](=O)[O-])cc32)n1 ZINC000174092972 1426998354 /nfs/dbraw/zinc/99/83/54/1426998354.db2.gz LQHGDJGQOJRXBK-CYBMUJFWSA-N 0 0 388.428 3.151 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)Cn2ncc3cc([N+](=O)[O-])ccc32)n1 ZINC000174094174 1426999247 /nfs/dbraw/zinc/99/92/47/1426999247.db2.gz LQOGCCWEGPDDKQ-ZDUSSCGKSA-N 0 0 388.428 3.151 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000174094438 1427000056 /nfs/dbraw/zinc/00/00/56/1427000056.db2.gz PRKNACWUMYCJBQ-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000174094693 1427000066 /nfs/dbraw/zinc/00/00/66/1427000066.db2.gz BCMOWHBKOHBSDE-WMLDXEAASA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])[C@H](c2ccccc2)CO1 ZINC000174094727 1427000394 /nfs/dbraw/zinc/00/03/94/1427000394.db2.gz XXMWFARNPICIHS-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCCC(c1ccccc1)c1ccccc1 ZINC000174100582 1427002323 /nfs/dbraw/zinc/00/23/23/1427002323.db2.gz VYIXFKQNDBQRMW-UHFFFAOYSA-N 0 0 391.427 3.095 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cccc(CSc2ccccn2)c1 ZINC000174100992 1427002705 /nfs/dbraw/zinc/00/27/05/1427002705.db2.gz DUHQVWYDMUCCNX-UHFFFAOYSA-N 0 0 396.428 3.083 20 5 GGBDRN CN(CC(=O)NCc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1C=O ZINC000174103544 1427003299 /nfs/dbraw/zinc/00/32/99/1427003299.db2.gz YGZVEUVKUWZFHB-UHFFFAOYSA-N 0 0 395.337 3.179 20 5 GGBDRN Cc1cc(F)cc(C(=O)OCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000174105022 1427003908 /nfs/dbraw/zinc/00/39/08/1427003908.db2.gz NGVHTYZTZDDRNO-UHFFFAOYSA-N 0 0 380.759 3.283 20 5 GGBDRN O=C(Cc1cc(F)ccc1F)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000174105105 1427004138 /nfs/dbraw/zinc/00/41/38/1427004138.db2.gz XQEJQMBJWOPPSI-UHFFFAOYSA-N 0 0 398.749 3.042 20 5 GGBDRN COC(=O)c1ccc(OCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)c(Cl)c1 ZINC000174106699 1427004572 /nfs/dbraw/zinc/00/45/72/1427004572.db2.gz UYOJQMLZRLCUBK-UHFFFAOYSA-N 0 0 392.751 3.022 20 5 GGBDRN Cc1c(Cn2nc(Br)nc2Br)cccc1[N+](=O)[O-] ZINC000174105267 1427004896 /nfs/dbraw/zinc/00/48/96/1427004896.db2.gz QUOXJPCLUNABBQ-UHFFFAOYSA-N 0 0 376.008 3.068 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2ccc(F)c(Br)c2)c([N+](=O)[O-])c1 ZINC000174107125 1427004971 /nfs/dbraw/zinc/00/49/71/1427004971.db2.gz RZSPRCSKLPMUTI-UHFFFAOYSA-N 0 0 397.156 3.326 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)cc1[N+](=O)[O-] ZINC000174113087 1427007707 /nfs/dbraw/zinc/00/77/07/1427007707.db2.gz RKSJMIQBGXWDFU-UHFFFAOYSA-N 0 0 387.480 3.268 20 5 GGBDRN CCc1ccc(C(=O)NC2CCN(C(=O)C(CC)CC)CC2)cc1[N+](=O)[O-] ZINC000174113537 1427007763 /nfs/dbraw/zinc/00/77/63/1427007763.db2.gz CFJNNLIXIGDUEE-UHFFFAOYSA-N 0 0 375.469 3.314 20 5 GGBDRN O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)c2ccncc2)C1 ZINC000174119981 1427010373 /nfs/dbraw/zinc/01/03/73/1427010373.db2.gz WRBQYKVLWIISHF-CYBMUJFWSA-N 0 0 389.795 3.101 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)OCc2cccc([N+](=O)[O-])c2)cs1 ZINC000174125240 1427012154 /nfs/dbraw/zinc/01/21/54/1427012154.db2.gz HBVAPSCIXVXFFX-UHFFFAOYSA-N 0 0 377.422 3.322 20 5 GGBDRN C[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000174126566 1427012743 /nfs/dbraw/zinc/01/27/43/1427012743.db2.gz YORZLMQBJUBBGY-MAUKXSAKSA-N 0 0 383.448 3.426 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)C1 ZINC000174150996 1427022891 /nfs/dbraw/zinc/02/28/91/1427022891.db2.gz PHXRTYAERHIEBP-PBHICJAKSA-N 0 0 375.469 3.314 20 5 GGBDRN CCc1ccc(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)cc1[N+](=O)[O-] ZINC000174160148 1427025953 /nfs/dbraw/zinc/02/59/53/1427025953.db2.gz SYYBBVUKLDLJAP-OAHLLOKOSA-N 0 0 383.448 3.422 20 5 GGBDRN CCc1cnc(CNC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])s1 ZINC000174165592 1427028609 /nfs/dbraw/zinc/02/86/09/1427028609.db2.gz YVPMEKTUIUTZMB-UHFFFAOYSA-N 0 0 377.470 3.224 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000174169233 1427030868 /nfs/dbraw/zinc/03/08/68/1427030868.db2.gz TXYHLXBABXCVPO-GFCCVEGCSA-N 0 0 377.401 3.375 20 5 GGBDRN C[C@H]1CN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2NC1=O ZINC000174183200 1427036792 /nfs/dbraw/zinc/03/67/92/1427036792.db2.gz LPJPFPXNSFAUKX-NSHDSACASA-N 0 0 388.811 3.282 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H](C)c1cccc(-n2cccn2)c1 ZINC000174183824 1427037202 /nfs/dbraw/zinc/03/72/02/1427037202.db2.gz UEMRVDZLBLCSHJ-CQSZACIVSA-N 0 0 395.419 3.350 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)c1 ZINC000174186258 1427038441 /nfs/dbraw/zinc/03/84/41/1427038441.db2.gz KPWHYHJPRUEDJS-UHFFFAOYSA-N 0 0 398.463 3.068 20 5 GGBDRN C[C@H]1CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2NC1=O ZINC000174186663 1427039520 /nfs/dbraw/zinc/03/95/20/1427039520.db2.gz FFTUXJYKUWLMHN-LBPRGKRZSA-N 0 0 379.376 3.240 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)ccc1[N+](=O)[O-] ZINC000174190158 1427041252 /nfs/dbraw/zinc/04/12/52/1427041252.db2.gz DLTQGJATVYJPBE-UHFFFAOYSA-N 0 0 382.464 3.368 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000174191623 1427041763 /nfs/dbraw/zinc/04/17/63/1427041763.db2.gz KICUMZMHOWQNNT-UHFFFAOYSA-N 0 0 390.469 3.061 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(c2ccc(N(C)C)cc2)CC1 ZINC000174202140 1427047630 /nfs/dbraw/zinc/04/76/30/1427047630.db2.gz CZNNAKGRHPREFK-UHFFFAOYSA-N 0 0 398.463 3.068 20 5 GGBDRN O=C(c1cc2ccccc2c2cccnc12)N1CC[C@@H](CN2CCOCC2)C1 ZINC000174204505 1427048932 /nfs/dbraw/zinc/04/89/32/1427048932.db2.gz WEMQLJKMFUAQQB-KRWDZBQOSA-N 0 0 375.472 3.182 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000174226150 1427059246 /nfs/dbraw/zinc/05/92/46/1427059246.db2.gz HPDHSRFYCCLEPZ-AWEZNQCLSA-N 0 0 375.469 3.172 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000174226139 1427059337 /nfs/dbraw/zinc/05/93/37/1427059337.db2.gz HPDHSRFYCCLEPZ-CQSZACIVSA-N 0 0 375.469 3.172 20 5 GGBDRN C[C@@H]1CN(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000174231294 1427060959 /nfs/dbraw/zinc/06/09/59/1427060959.db2.gz YBKCSSMTHGEHIP-QAPCUYQASA-N 0 0 382.416 3.438 20 5 GGBDRN C[C@H]1CN(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000174231337 1427061297 /nfs/dbraw/zinc/06/12/97/1427061297.db2.gz YBKCSSMTHGEHIP-MAUKXSAKSA-N 0 0 382.416 3.438 20 5 GGBDRN Cc1ccc(CNC(=O)CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000174243968 1427066981 /nfs/dbraw/zinc/06/69/81/1427066981.db2.gz DJKICQKKYKJABV-UHFFFAOYSA-N 0 0 383.448 3.063 20 5 GGBDRN C[C@H](C(=O)NCc1cccs1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174247051 1427068456 /nfs/dbraw/zinc/06/84/56/1427068456.db2.gz FQXYDWBNKJNPDA-CQSZACIVSA-N 0 0 389.477 3.204 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cc3nccn3CC(F)(F)F)CC2)cc1 ZINC000174248469 1427068929 /nfs/dbraw/zinc/06/89/29/1427068929.db2.gz IUCWHEJIFRLNIT-UHFFFAOYSA-N 0 0 384.358 3.397 20 5 GGBDRN O=C1[C@@H](N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCN1c1ccccc1 ZINC000174247648 1427069049 /nfs/dbraw/zinc/06/90/49/1427069049.db2.gz IALVGXLZFPJIHC-FQEVSTJZSA-N 0 0 381.432 3.244 20 5 GGBDRN Cc1ccccc1CNC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174247954 1427069092 /nfs/dbraw/zinc/06/90/92/1427069092.db2.gz YHTZCPOETYGTFX-UHFFFAOYSA-N 0 0 383.448 3.063 20 5 GGBDRN Cc1ccc(OCCCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000174249771 1427069469 /nfs/dbraw/zinc/06/94/69/1427069469.db2.gz FWKVMQUULOQUMI-KRWDZBQOSA-N 0 0 398.463 3.479 20 5 GGBDRN CN(C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 ZINC000174249189 1427069633 /nfs/dbraw/zinc/06/96/33/1427069633.db2.gz XWXNJNPXNOJDSI-UHFFFAOYSA-N 0 0 375.469 3.229 20 5 GGBDRN C[C@H]1CCCC[C@@H]1NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174249359 1427069784 /nfs/dbraw/zinc/06/97/84/1427069784.db2.gz CZWRKPRWIIVOQE-KXBFYZLASA-N 0 0 375.469 3.133 20 5 GGBDRN Cc1nncn1CCNC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000174262151 1427074368 /nfs/dbraw/zinc/07/43/68/1427074368.db2.gz OVFMMKWATFGLDK-UHFFFAOYSA-N 0 0 377.470 3.063 20 5 GGBDRN O=C(Nc1c(F)cc(F)cc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174264097 1427074969 /nfs/dbraw/zinc/07/49/69/1427074969.db2.gz MHBGGMSMNMUBJE-UHFFFAOYSA-N 0 0 380.326 3.366 20 5 GGBDRN C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174278492 1427081450 /nfs/dbraw/zinc/08/14/50/1427081450.db2.gz YOHYGNOSZLVQBM-HNNXBMFYSA-N 0 0 399.447 3.484 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2nc([C@H](C)OCC(C)C)no2)cccc1[N+](=O)[O-] ZINC000174286499 1427085749 /nfs/dbraw/zinc/08/57/49/1427085749.db2.gz MGYVCWQMECNUBG-ZDUSSCGKSA-N 0 0 397.453 3.135 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2nc([C@@H](C)OCC(C)C)no2)cccc1[N+](=O)[O-] ZINC000174286487 1427085835 /nfs/dbraw/zinc/08/58/35/1427085835.db2.gz MGYVCWQMECNUBG-CYBMUJFWSA-N 0 0 397.453 3.135 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000174293042 1427088514 /nfs/dbraw/zinc/08/85/14/1427088514.db2.gz HCAULHQKECZBLG-ZYSHUDEJSA-N 0 0 385.464 3.299 20 5 GGBDRN C[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)Oc1ccccc1F ZINC000174333862 1427106146 /nfs/dbraw/zinc/10/61/46/1427106146.db2.gz XWTPPQYNYVGRJQ-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN CC(C)[C@H](C(=O)OCCNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000174334145 1427106309 /nfs/dbraw/zinc/10/63/09/1427106309.db2.gz SJNLPTZILXIRPT-SFHVURJKSA-N 0 0 385.420 3.089 20 5 GGBDRN C[S@](=O)C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000174334765 1427106614 /nfs/dbraw/zinc/10/66/14/1427106614.db2.gz GVWTYDCAMIEMJF-CRYYWNKWSA-N 0 0 387.461 3.019 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)Cc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000174334569 1427106934 /nfs/dbraw/zinc/10/69/34/1427106934.db2.gz DRZVXPSGEDTFJM-UHFFFAOYSA-N 0 0 393.399 3.045 20 5 GGBDRN C[C@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000174337453 1427109146 /nfs/dbraw/zinc/10/91/46/1427109146.db2.gz LOHWTXFVTHFOAW-HNNXBMFYSA-N 0 0 394.435 3.253 20 5 GGBDRN CCc1nc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)sc1C ZINC000174339397 1427109579 /nfs/dbraw/zinc/10/95/79/1427109579.db2.gz FIZCWACSNVUKAR-UHFFFAOYSA-N 0 0 375.454 3.276 20 5 GGBDRN C[C@@H](N[C@H](C)c1nc(-c2cccc(F)c2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000174338783 1427109662 /nfs/dbraw/zinc/10/96/62/1427109662.db2.gz MUUVVHFZKSJJEK-VXGBXAGGSA-N 0 0 399.382 3.462 20 5 GGBDRN C[C@@H](N[C@@H](C)c1nc(-c2cccc(F)c2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000174338769 1427109768 /nfs/dbraw/zinc/10/97/68/1427109768.db2.gz MUUVVHFZKSJJEK-NEPJUHHUSA-N 0 0 399.382 3.462 20 5 GGBDRN CCc1nc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)sc1C ZINC000174343561 1427111436 /nfs/dbraw/zinc/11/14/36/1427111436.db2.gz RAWJAPMMJOBBFD-UHFFFAOYSA-N 0 0 375.454 3.276 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000174348518 1427113797 /nfs/dbraw/zinc/11/37/97/1427113797.db2.gz CRQJYPVSAFEWHK-HIFRSBDPSA-N 0 0 377.441 3.408 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCc1ccn(-c2ccc(F)cc2)n1 ZINC000174356197 1427117099 /nfs/dbraw/zinc/11/70/99/1427117099.db2.gz ZCEIYNDUDLRNGS-UHFFFAOYSA-N 0 0 398.394 3.047 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2ccc(Br)c(F)c2)c([N+](=O)[O-])c1 ZINC000174359422 1427118836 /nfs/dbraw/zinc/11/88/36/1427118836.db2.gz CZEFVFLQWBKFRT-UHFFFAOYSA-N 0 0 397.156 3.326 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)Oc1ccc(F)cc1 ZINC000174361633 1427120265 /nfs/dbraw/zinc/12/02/65/1427120265.db2.gz CFXZXBJBPYLIGP-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN C[C@H](CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)CC1(C)OCCO1 ZINC000174364920 1427121683 /nfs/dbraw/zinc/12/16/83/1427121683.db2.gz ZPMCMPNYPAFRJE-LBPRGKRZSA-N 0 0 391.449 3.237 20 5 GGBDRN C[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)Oc1ccc(F)cc1 ZINC000174365665 1427122503 /nfs/dbraw/zinc/12/25/03/1427122503.db2.gz YZROPRDMBPLSJY-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN Cc1nnc(-c2cccc(NC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)c2)o1 ZINC000174368337 1427123249 /nfs/dbraw/zinc/12/32/49/1427123249.db2.gz DIPXGJCLRQSLLN-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN O=C(OC[C@@H]1CCN(c2ccccc2)C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000174374222 1427126506 /nfs/dbraw/zinc/12/65/06/1427126506.db2.gz BPRAKSWETSXOQF-MRXNPFEDSA-N 0 0 392.415 3.464 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](C)Oc2ccc(F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000174378220 1427128469 /nfs/dbraw/zinc/12/84/69/1427128469.db2.gz CJBJFJSWELWQIF-SNVBAGLBSA-N 0 0 377.328 3.148 20 5 GGBDRN CCS[C@H]1CC[C@H](N(C)C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000174383676 1427130972 /nfs/dbraw/zinc/13/09/72/1427130972.db2.gz DEINABBNAOAPGO-RYUDHWBXSA-N 0 0 399.900 3.111 20 5 GGBDRN C[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)Oc1ccc(F)cc1 ZINC000174388054 1427132826 /nfs/dbraw/zinc/13/28/26/1427132826.db2.gz PQZSXFLKVLXELO-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN C[C@H](CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1(C)OCCO1 ZINC000174389375 1427133760 /nfs/dbraw/zinc/13/37/60/1427133760.db2.gz LFULKPPITRVDLB-LBPRGKRZSA-N 0 0 391.449 3.237 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)NCc2cccc([N+](=O)[O-])c2)n1 ZINC000174393519 1427135974 /nfs/dbraw/zinc/13/59/74/1427135974.db2.gz MWBCMQKVQBVCLB-CYBMUJFWSA-N 0 0 391.428 3.053 20 5 GGBDRN CCCNC(=O)CCCC(=O)OCc1ccc([N+](=O)[O-])cc1Br ZINC000174400925 1427140146 /nfs/dbraw/zinc/14/01/46/1427140146.db2.gz JILWNJQOADDPRC-UHFFFAOYSA-N 0 0 387.230 3.097 20 5 GGBDRN CO[C@@H](CNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C(C)(C)C ZINC000174415587 1427148205 /nfs/dbraw/zinc/14/82/05/1427148205.db2.gz DJVISDCVGORJTP-KRWDZBQOSA-N 0 0 379.457 3.209 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)Nc2cccc(Cl)n2)cc1[N+](=O)[O-] ZINC000174441453 1427157843 /nfs/dbraw/zinc/15/78/43/1427157843.db2.gz LYHOYSPDJDFWIS-UHFFFAOYSA-N 0 0 390.812 3.175 20 5 GGBDRN CN1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000174444653 1427159464 /nfs/dbraw/zinc/15/94/64/1427159464.db2.gz GKKQATYZYXJTAE-UHFFFAOYSA-N 0 0 384.411 3.431 20 5 GGBDRN COc1ccccc1CNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174457210 1427164523 /nfs/dbraw/zinc/16/45/23/1427164523.db2.gz PBHHVLGHDYARSD-UHFFFAOYSA-N 0 0 385.420 3.356 20 5 GGBDRN CC1CCN(c2ccc(C(=O)Nc3nc4ccc(F)cn4n3)cc2[N+](=O)[O-])CC1 ZINC000174472254 1427171885 /nfs/dbraw/zinc/17/18/85/1427171885.db2.gz NPAXFDMOHGCRJH-UHFFFAOYSA-N 0 0 398.398 3.265 20 5 GGBDRN COC(=O)CCN(Cc1ccc(OC)c([N+](=O)[O-])c1)Cc1cccc(F)c1F ZINC000174489388 1427178719 /nfs/dbraw/zinc/17/87/19/1427178719.db2.gz AWIFABJORGKTBW-UHFFFAOYSA-N 0 0 394.374 3.447 20 5 GGBDRN C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000174496742 1427182491 /nfs/dbraw/zinc/18/24/91/1427182491.db2.gz ZHRCKSIVJYYKTF-SCLBCKFNSA-N 0 0 385.395 3.073 20 5 GGBDRN CC(C)C1CCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)CC1 ZINC000174500888 1427186025 /nfs/dbraw/zinc/18/60/25/1427186025.db2.gz DOPHTVIDRBAAMW-UHFFFAOYSA-N 0 0 389.481 3.383 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1NC1CC1 ZINC000174503853 1427188976 /nfs/dbraw/zinc/18/89/76/1427188976.db2.gz MEFSFABKHXTIBZ-NSHDSACASA-N 0 0 386.383 3.065 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1NC1CC1 ZINC000174503868 1427189579 /nfs/dbraw/zinc/18/95/79/1427189579.db2.gz MEFSFABKHXTIBZ-LLVKDONJSA-N 0 0 386.383 3.065 20 5 GGBDRN C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000174504103 1427189770 /nfs/dbraw/zinc/18/97/70/1427189770.db2.gz UTQBIEJCTOJCCR-HNNXBMFYSA-N 0 0 399.447 3.401 20 5 GGBDRN CO[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccc(F)cc1 ZINC000174507527 1427191094 /nfs/dbraw/zinc/19/10/94/1427191094.db2.gz MYPWDQKYCJFXHV-GOSISDBHSA-N 0 0 384.367 3.037 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCc1nc2cc(F)ccc2[nH]1 ZINC000174509396 1427191991 /nfs/dbraw/zinc/19/19/91/1427191991.db2.gz WSSDWFWTBAKEHL-UHFFFAOYSA-N 0 0 385.399 3.161 20 5 GGBDRN COC(=O)[C@H]1CCC[C@H](C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000174524024 1427202593 /nfs/dbraw/zinc/20/25/93/1427202593.db2.gz XNPKFOZFNZKFNJ-KBPBESRZSA-N 0 0 386.408 3.007 20 5 GGBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc(F)cc1 ZINC000174528315 1427205240 /nfs/dbraw/zinc/20/52/40/1427205240.db2.gz CCFUGXMPWIUHFH-IBGZPJMESA-N 0 0 387.411 3.452 20 5 GGBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc(F)cc1 ZINC000174528329 1427205357 /nfs/dbraw/zinc/20/53/57/1427205357.db2.gz CCFUGXMPWIUHFH-LJQANCHMSA-N 0 0 387.411 3.452 20 5 GGBDRN CO[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(F)cc1 ZINC000174534138 1427209148 /nfs/dbraw/zinc/20/91/48/1427209148.db2.gz UEZGIRYFELRRLF-SFHVURJKSA-N 0 0 384.367 3.037 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H](C)Oc2ccccc2F)cc1[N+](=O)[O-] ZINC000174542461 1427214026 /nfs/dbraw/zinc/21/40/26/1427214026.db2.gz ZVIMMPIMRQEZLT-SNVBAGLBSA-N 0 0 377.328 3.148 20 5 GGBDRN C[C@H](CCc1cccn1C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174550337 1427219517 /nfs/dbraw/zinc/21/95/17/1427219517.db2.gz SRAPESMJZWBBQJ-MRXNPFEDSA-N 0 0 384.480 3.287 20 5 GGBDRN COc1ccc(O[C@@H](C)CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000174551329 1427219527 /nfs/dbraw/zinc/21/95/27/1427219527.db2.gz OZWLVWSLPNKPCF-HNNXBMFYSA-N 0 0 399.447 3.401 20 5 GGBDRN CCOc1cc(N2CCC(OC(=O)c3cnn(CC)c3)CC2)ccc1[N+](=O)[O-] ZINC000174551381 1427219750 /nfs/dbraw/zinc/21/97/50/1427219750.db2.gz YARWVBBLJDGVEA-UHFFFAOYSA-N 0 0 388.424 3.036 20 5 GGBDRN COc1ccc(O[C@@H](C)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000174561074 1427225418 /nfs/dbraw/zinc/22/54/18/1427225418.db2.gz OBYVQKJVQYNWDI-LBPRGKRZSA-N 0 0 378.812 3.383 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)CCc2cccn2C)cc1SC ZINC000174562881 1427226175 /nfs/dbraw/zinc/22/61/75/1427226175.db2.gz IYMPKVUHXJQIAI-GFCCVEGCSA-N 0 0 377.466 3.415 20 5 GGBDRN CCOc1cc(C(=O)N[C@@H](C)CCc2cccn2C)c([N+](=O)[O-])cc1OC ZINC000174566866 1427227684 /nfs/dbraw/zinc/22/76/84/1427227684.db2.gz LCCDPMKLUUNBJT-ZDUSSCGKSA-N 0 0 375.425 3.092 20 5 GGBDRN CC(C)(C)c1nc2ccc(NC(=O)Cn3cc([N+](=O)[O-])ccc3=O)cc2s1 ZINC000174567895 1427228241 /nfs/dbraw/zinc/22/82/41/1427228241.db2.gz OWNISLRRKSYGEE-UHFFFAOYSA-N 0 0 386.433 3.302 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000174577966 1427236386 /nfs/dbraw/zinc/23/63/86/1427236386.db2.gz CLCFCYWHAFIFQF-HNNXBMFYSA-N 0 0 394.431 3.492 20 5 GGBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000174581397 1427238970 /nfs/dbraw/zinc/23/89/70/1427238970.db2.gz NAYURHOXUSYUNJ-CYBMUJFWSA-N 0 0 395.415 3.148 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000174581385 1427239409 /nfs/dbraw/zinc/23/94/09/1427239409.db2.gz NAYURHOXUSYUNJ-ZDUSSCGKSA-N 0 0 395.415 3.148 20 5 GGBDRN CC(C)C[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000174585231 1427242135 /nfs/dbraw/zinc/24/21/35/1427242135.db2.gz PDVKCWWUKBOYRU-KBPBESRZSA-N 0 0 379.482 3.156 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CC[C@H](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000174589282 1427244336 /nfs/dbraw/zinc/24/43/36/1427244336.db2.gz JHAGMGRYCMDMLW-VQIMIIECSA-N 0 0 387.480 3.402 20 5 GGBDRN O=C(Nn1cnc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174598394 1427249684 /nfs/dbraw/zinc/24/96/84/1427249684.db2.gz KLDOILHDPFYTEL-UHFFFAOYSA-N 0 0 381.392 3.151 20 5 GGBDRN O=C(OC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000174606967 1427257801 /nfs/dbraw/zinc/25/78/01/1427257801.db2.gz XKCHGMACZKJFSE-CQSZACIVSA-N 0 0 388.807 3.454 20 5 GGBDRN CCCn1ccc2ccc(NC(=O)C(=O)NCc3ccccc3[N+](=O)[O-])cc21 ZINC000174619674 1427267985 /nfs/dbraw/zinc/26/79/85/1427267985.db2.gz GXKSAEXAOAWIGS-UHFFFAOYSA-N 0 0 380.404 3.214 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(C)o1 ZINC000174623042 1427270297 /nfs/dbraw/zinc/27/02/97/1427270297.db2.gz TUBSUQPOMLMOHB-HXUWFJFHSA-N 0 0 387.436 3.042 20 5 GGBDRN COc1ccc(CN(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1O ZINC000174628001 1427273366 /nfs/dbraw/zinc/27/33/66/1427273366.db2.gz YBCLEUYZKIAJTE-UHFFFAOYSA-N 0 0 379.800 3.033 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3cc(C)cc([N+](=O)[O-])c3)n2)c1 ZINC000174651268 1427288992 /nfs/dbraw/zinc/28/89/92/1427288992.db2.gz HNIXFWHYKCRWJH-LBPRGKRZSA-N 0 0 382.376 3.453 20 5 GGBDRN O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc(F)c(Br)c2)ccc1F ZINC000174651493 1427289004 /nfs/dbraw/zinc/28/90/04/1427289004.db2.gz PKYGZIPUBZSSTD-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000174653054 1427289760 /nfs/dbraw/zinc/28/97/60/1427289760.db2.gz VSJWADPDBJUXOT-IBGZPJMESA-N 0 0 376.416 3.426 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CSc2nc(-c3ccc(F)cc3)cs2)c1 ZINC000174672249 1427300374 /nfs/dbraw/zinc/30/03/74/1427300374.db2.gz WXJKKUZMIVPTDJ-ZDUSSCGKSA-N 0 0 380.426 3.207 20 5 GGBDRN CC(C)c1ccccc1-n1ccnc1SC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174685996 1427308798 /nfs/dbraw/zinc/30/87/98/1427308798.db2.gz ULUAEWRJDLNPLN-OAHLLOKOSA-N 0 0 387.465 3.254 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)CSc2nc3c(n2-c2ccccc2)CCCC3)c1 ZINC000174684724 1427308865 /nfs/dbraw/zinc/30/88/65/1427308865.db2.gz SFRBDNXSQMQYNF-MRXNPFEDSA-N 0 0 399.476 3.009 20 5 GGBDRN Cc1nc(SC[C@H](O)Cn2cc([N+](=O)[O-])cn2)n(C2CCCCC2)c1C ZINC000174686825 1427309349 /nfs/dbraw/zinc/30/93/49/1427309349.db2.gz KOVUKKVXSPLTNG-MRXNPFEDSA-N 0 0 379.486 3.263 20 5 GGBDRN Cc1nc(SC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n(C2CCCCC2)c1C ZINC000174686839 1427309576 /nfs/dbraw/zinc/30/95/76/1427309576.db2.gz KOVUKKVXSPLTNG-INIZCTEOSA-N 0 0 379.486 3.263 20 5 GGBDRN Cc1c(Cl)cccc1-n1ccnc1SC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174687162 1427309904 /nfs/dbraw/zinc/30/99/04/1427309904.db2.gz KAFLYQVFKUQHMB-ZDUSSCGKSA-N 0 0 393.856 3.092 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](c1ccccc1)N1CC[C@H](CO)C1 ZINC000174700353 1427317710 /nfs/dbraw/zinc/31/77/10/1427317710.db2.gz KXXITNXXKRWTFC-SCLBCKFNSA-N 0 0 389.839 3.242 20 5 GGBDRN CS(=O)(=O)Cc1cccc(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)c1 ZINC000174712054 1427324394 /nfs/dbraw/zinc/32/43/94/1427324394.db2.gz NLUOSOGBKIGVPB-UHFFFAOYSA-N 0 0 386.376 3.353 20 5 GGBDRN COc1cc(N2CCN(C(=O)CCCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000174711333 1427324412 /nfs/dbraw/zinc/32/44/12/1427324412.db2.gz GWYRFQBMDDDKNN-UHFFFAOYSA-N 0 0 383.448 3.275 20 5 GGBDRN NC(=O)C[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC000174713857 1427325926 /nfs/dbraw/zinc/32/59/26/1427325926.db2.gz YRDBOHOIEQIVAD-CQSZACIVSA-N 0 0 383.404 3.115 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174722237 1427331372 /nfs/dbraw/zinc/33/13/72/1427331372.db2.gz BEFOVAVNCJMFMN-LBPRGKRZSA-N 0 0 383.832 3.330 20 5 GGBDRN CN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174727072 1427334240 /nfs/dbraw/zinc/33/42/40/1427334240.db2.gz KRVKMSOLKLIIFA-CYBMUJFWSA-N 0 0 383.832 3.330 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)cc([N+](=O)[O-])c1 ZINC000174733175 1427337350 /nfs/dbraw/zinc/33/73/50/1427337350.db2.gz KOXOMCHBZWIDHX-CYBMUJFWSA-N 0 0 394.387 3.058 20 5 GGBDRN COc1cc(OCC(=O)N[C@H](C)c2cccc(-n3cccn3)c2)ccc1[N+](=O)[O-] ZINC000174742552 1427343058 /nfs/dbraw/zinc/34/30/58/1427343058.db2.gz PYXSLFLWFKDEIP-CQSZACIVSA-N 0 0 396.403 3.045 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1nc(-c2cccc(F)c2)no1 ZINC000174747920 1427346257 /nfs/dbraw/zinc/34/62/57/1427346257.db2.gz BULLHUUTIJYUJU-LLVKDONJSA-N 0 0 399.382 3.341 20 5 GGBDRN C[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174756892 1427350878 /nfs/dbraw/zinc/35/08/78/1427350878.db2.gz IKFMZUPGVAHLJV-LLVKDONJSA-N 0 0 386.339 3.040 20 5 GGBDRN C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1nc(-c2cccc(F)c2)no1 ZINC000174758555 1427351820 /nfs/dbraw/zinc/35/18/20/1427351820.db2.gz AGDYHKPPKLUASW-LLVKDONJSA-N 0 0 386.339 3.040 20 5 GGBDRN C[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174760244 1427353010 /nfs/dbraw/zinc/35/30/10/1427353010.db2.gz WRUPGBIFDHKCRJ-LBPRGKRZSA-N 0 0 399.382 3.098 20 5 GGBDRN NC(=O)C[C@H]1CCCN(C(=O)/C=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000174765957 1427355126 /nfs/dbraw/zinc/35/51/26/1427355126.db2.gz XZSNQZKMVSXVEQ-QSYFUGGGSA-N 0 0 399.472 3.451 20 5 GGBDRN Cc1cccc(C(=O)N(C)Cc2nc([C@@H](C)OCC(C)C)no2)c1[N+](=O)[O-] ZINC000174794927 1427372873 /nfs/dbraw/zinc/37/28/73/1427372873.db2.gz QQSMMFDGTQGZSF-CYBMUJFWSA-N 0 0 376.413 3.292 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(C[C@H](O)c3c(F)cccc3F)CC2)cc1 ZINC000174802261 1427376887 /nfs/dbraw/zinc/37/68/87/1427376887.db2.gz MLCMOALEZPKTFP-SFHVURJKSA-N 0 0 378.375 3.450 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1CN1CCN(Cc2cn3ccccc3n2)CC1 ZINC000174812919 1427381772 /nfs/dbraw/zinc/38/17/72/1427381772.db2.gz ZECWPMWZDJCUOQ-UHFFFAOYSA-N 0 0 385.855 3.214 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000174835527 1427395141 /nfs/dbraw/zinc/39/51/41/1427395141.db2.gz RJRLYJVRGHPFST-UHFFFAOYSA-N 0 0 388.371 3.109 20 5 GGBDRN O=C(Nc1cnn(CC(F)F)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174844306 1427402263 /nfs/dbraw/zinc/40/22/63/1427402263.db2.gz NOKBRNAHVHRFGO-UHFFFAOYSA-N 0 0 395.366 3.132 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(CCOc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000174861763 1427413691 /nfs/dbraw/zinc/41/36/91/1427413691.db2.gz JFYSRLZYZXIVBX-UHFFFAOYSA-N 0 0 384.436 3.132 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)NCc3ccccc3[N+](=O)[O-])cc21 ZINC000174862210 1427415106 /nfs/dbraw/zinc/41/51/06/1427415106.db2.gz DRAZFOWWFORRQE-UHFFFAOYSA-N 0 0 383.408 3.009 20 5 GGBDRN COC(=O)c1cccc(-c2noc(-c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)n2)c1 ZINC000174873814 1427421181 /nfs/dbraw/zinc/42/11/81/1427421181.db2.gz MHHZYFYPQXSVIA-UHFFFAOYSA-N 0 0 391.343 3.284 20 5 GGBDRN COC(=O)c1cccc(-c2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000174877319 1427422402 /nfs/dbraw/zinc/42/24/02/1427422402.db2.gz CUXXLXJOLFSZHM-UHFFFAOYSA-N 0 0 382.376 3.476 20 5 GGBDRN Cn1c(C(=O)OCCn2cc([N+](=O)[O-])cn2)cc2cc(C(F)(F)F)ccc21 ZINC000174894415 1427431432 /nfs/dbraw/zinc/43/14/32/1427431432.db2.gz BPWFHABNASLNNW-UHFFFAOYSA-N 0 0 382.298 3.159 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000174900865 1427435101 /nfs/dbraw/zinc/43/51/01/1427435101.db2.gz GMGYTBKLQDQPRN-UHFFFAOYSA-N 0 0 398.463 3.377 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000174906050 1427438673 /nfs/dbraw/zinc/43/86/73/1427438673.db2.gz UIJUDIOAGNBKAX-UHFFFAOYSA-N 0 0 398.463 3.377 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)c3cc(F)ccc3[N+](=O)[O-])ccc2NC1=O ZINC000174916819 1427445048 /nfs/dbraw/zinc/44/50/48/1427445048.db2.gz VQPIFZOBOCFZRG-QFYYESIMSA-N 0 0 387.367 3.334 20 5 GGBDRN C[C@@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1c(F)cccc1Cl ZINC000174937038 1427454254 /nfs/dbraw/zinc/45/42/54/1427454254.db2.gz ZYPSAKXCBGLMJD-SECBINFHSA-N 0 0 393.758 3.173 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1O ZINC000174944402 1427458350 /nfs/dbraw/zinc/45/83/50/1427458350.db2.gz GQISKIWGZTVEOA-QGZVFWFLSA-N 0 0 383.404 3.161 20 5 GGBDRN O=C([C@@H]1C[C@]12CCc1ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000174946655 1427460981 /nfs/dbraw/zinc/46/09/81/1427460981.db2.gz FEYPJTBNEKQZHB-UNMCSNQZSA-N 0 0 377.444 3.148 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3F)ccc2NC1=O ZINC000174963866 1427469130 /nfs/dbraw/zinc/46/91/30/1427469130.db2.gz GHRCQJFXQHZVHB-MGPLVRAMSA-N 0 0 387.367 3.334 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3)ccc2NC1=O ZINC000174965735 1427470660 /nfs/dbraw/zinc/47/06/60/1427470660.db2.gz CXQUXBGKRWLZHJ-SJCJKPOMSA-N 0 0 383.404 3.124 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3)ccc2NC1=O ZINC000174965718 1427470818 /nfs/dbraw/zinc/47/08/18/1427470818.db2.gz CXQUXBGKRWLZHJ-YVEFUNNKSA-N 0 0 383.404 3.124 20 5 GGBDRN C[C@@H](CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1cccc(F)c1 ZINC000174967785 1427471512 /nfs/dbraw/zinc/47/15/12/1427471512.db2.gz LNXCUOZLJMICHN-RHSMWYFYSA-N 0 0 386.427 3.411 20 5 GGBDRN O=C(NCC1(N2CCOCC2)CCCCC1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000174989960 1427482410 /nfs/dbraw/zinc/48/24/10/1427482410.db2.gz HKWNZOWFIIWNBX-UHFFFAOYSA-N 0 0 381.860 3.013 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1ccccc1)CC(F)F ZINC000174991328 1427483156 /nfs/dbraw/zinc/48/31/56/1427483156.db2.gz UEFKNGXBYUYCIR-UHFFFAOYSA-N 0 0 379.363 3.309 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000174995573 1427486260 /nfs/dbraw/zinc/48/62/60/1427486260.db2.gz BEVNIUAHFPVMSH-UHFFFAOYSA-N 0 0 389.433 3.361 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cccc(CC(F)(F)F)c1 ZINC000174998645 1427488028 /nfs/dbraw/zinc/48/80/28/1427488028.db2.gz BOIWUKUOJASMQD-UHFFFAOYSA-N 0 0 395.293 3.246 20 5 GGBDRN CCC(=O)Nc1ccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)cc1 ZINC000175002967 1427490853 /nfs/dbraw/zinc/49/08/53/1427490853.db2.gz OBVWEBYBJMGOQL-UHFFFAOYSA-N 0 0 377.422 3.361 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000175003567 1427491840 /nfs/dbraw/zinc/49/18/40/1427491840.db2.gz WFEBXJZNSGKCEU-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN COc1ccc(NC(=O)CNC2(c3nccs3)CCCC2)c([N+](=O)[O-])c1 ZINC000175010174 1427494902 /nfs/dbraw/zinc/49/49/02/1427494902.db2.gz ZKAWOLLSQLKBME-UHFFFAOYSA-N 0 0 376.438 3.058 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000175012929 1427497692 /nfs/dbraw/zinc/49/76/92/1427497692.db2.gz SPONRUGAQKNMAA-OAHLLOKOSA-N 0 0 382.844 3.439 20 5 GGBDRN C[C@@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1nc(Cc2ccccc2)no1 ZINC000175021635 1427504289 /nfs/dbraw/zinc/50/42/89/1427504289.db2.gz LQOUWBLILFVHQI-CQSZACIVSA-N 0 0 395.419 3.471 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1cccc(C[S@](C)=O)c1C ZINC000175022030 1427504310 /nfs/dbraw/zinc/50/43/10/1427504310.db2.gz MQKTVFQTLSHWOV-VWLOTQADSA-N 0 0 396.490 3.199 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCN(C(=O)c2ccc(F)cc2)CC1 ZINC000175026002 1427506534 /nfs/dbraw/zinc/50/65/34/1427506534.db2.gz SXDJWNZPLMAVHY-UHFFFAOYSA-N 0 0 387.411 3.091 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1N(C)CCCOc1ccc(S(C)(=O)=O)cc1 ZINC000175046141 1427517635 /nfs/dbraw/zinc/51/76/35/1427517635.db2.gz PZRMIGZWSJXTRD-UHFFFAOYSA-N 0 0 378.450 3.212 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000175059913 1427524248 /nfs/dbraw/zinc/52/42/48/1427524248.db2.gz ICWGIWAXJXOTKL-HNNXBMFYSA-N 0 0 382.844 3.439 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCCN(C(=O)c2ccccc2)CC1 ZINC000175059048 1427524514 /nfs/dbraw/zinc/52/45/14/1427524514.db2.gz TZPPVPGTJYMHMU-UHFFFAOYSA-N 0 0 383.448 3.342 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CC[C@@H](Cc2ccccc2)C1 ZINC000175068375 1427528783 /nfs/dbraw/zinc/52/87/83/1427528783.db2.gz KASNXAYTTLWBSF-AWEZNQCLSA-N 0 0 387.823 3.278 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000175072040 1427530968 /nfs/dbraw/zinc/53/09/68/1427530968.db2.gz QDPHDDXIRCCRAO-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@H]1CN(Cc2ccccc2)CCO1 ZINC000175074127 1427532290 /nfs/dbraw/zinc/53/22/90/1427532290.db2.gz ANJOUXPPSKGRIK-SFHVURJKSA-N 0 0 383.448 3.441 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCN(CC3CC3)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000175077279 1427533835 /nfs/dbraw/zinc/53/38/35/1427533835.db2.gz FHKJLRNPEOSNJT-UHFFFAOYSA-N 0 0 395.415 3.258 20 5 GGBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175079016 1427535393 /nfs/dbraw/zinc/53/53/93/1427535393.db2.gz ORUISWSYZCSPAJ-UHFFFAOYSA-N 0 0 386.795 3.147 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC(OCCC(C)C)CC1 ZINC000175080670 1427536236 /nfs/dbraw/zinc/53/62/36/1427536236.db2.gz HBLXRYAGWOOKOE-UHFFFAOYSA-N 0 0 384.498 3.427 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cs1 ZINC000175084343 1427537474 /nfs/dbraw/zinc/53/74/74/1427537474.db2.gz YBFWKONAICAPOY-UHFFFAOYSA-N 0 0 388.449 3.168 20 5 GGBDRN Nc1c(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000175094342 1427542736 /nfs/dbraw/zinc/54/27/36/1427542736.db2.gz ZHPJHVXVWKLQHG-INIZCTEOSA-N 0 0 387.411 3.180 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000175094850 1427543467 /nfs/dbraw/zinc/54/34/67/1427543467.db2.gz IABCLRMPVNGHGE-MRXNPFEDSA-N 0 0 386.452 3.134 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H](c1ccccc1F)N1CCOCC1 ZINC000175099562 1427545625 /nfs/dbraw/zinc/54/56/25/1427545625.db2.gz UMYHSONXRPSQLJ-QGZVFWFLSA-N 0 0 395.337 3.024 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 ZINC000175099693 1427545863 /nfs/dbraw/zinc/54/58/63/1427545863.db2.gz UBMRRLGQXVHAJI-MRXNPFEDSA-N 0 0 389.496 3.464 20 5 GGBDRN CN1CCC(=O)Nc2cc(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000175111168 1427552461 /nfs/dbraw/zinc/55/24/61/1427552461.db2.gz SVXIXFOPLFIMQL-UHFFFAOYSA-N 0 0 396.447 3.126 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Oc1cccc([N+](=O)[O-])c1C ZINC000175120516 1427557624 /nfs/dbraw/zinc/55/76/24/1427557624.db2.gz BQHFZWBWTQFSEX-QGZVFWFLSA-N 0 0 399.378 3.176 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)o1 ZINC000175121174 1427557758 /nfs/dbraw/zinc/55/77/58/1427557758.db2.gz VKYRDOHKJSZWGO-INIZCTEOSA-N 0 0 394.449 3.129 20 5 GGBDRN Cc1nnc(-c2cccc(C(=O)NCCCNc3ccc(C)cc3[N+](=O)[O-])c2)o1 ZINC000175127820 1427560713 /nfs/dbraw/zinc/56/07/13/1427560713.db2.gz SGJMIADMTZFJTL-UHFFFAOYSA-N 0 0 395.419 3.494 20 5 GGBDRN Cc1ccc(-n2cnnn2)cc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000175132294 1427562850 /nfs/dbraw/zinc/56/28/50/1427562850.db2.gz WFSNETIGIPSSSW-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN Cc1cnc(OCC(=O)N2N=C(c3ccco3)C[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000175134192 1427563022 /nfs/dbraw/zinc/56/30/22/1427563022.db2.gz LBGUQQILGWLEJL-AWEZNQCLSA-N 0 0 396.359 3.241 20 5 GGBDRN CC(C)(NC(=O)CNC(=O)c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000175148606 1427568572 /nfs/dbraw/zinc/56/85/72/1427568572.db2.gz ZXJGMRUGZFBPAG-UHFFFAOYSA-N 0 0 375.812 3.030 20 5 GGBDRN O=C(N[C@H](CN1CCCC1=O)c1ccccc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000175148576 1427568696 /nfs/dbraw/zinc/56/86/96/1427568696.db2.gz DHXYGERKEFNHNO-QGZVFWFLSA-N 0 0 387.823 3.342 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@H]1c1noc(C(C)C)n1 ZINC000175148844 1427568797 /nfs/dbraw/zinc/56/87/97/1427568797.db2.gz AFEVFCMOAGELDY-AWEZNQCLSA-N 0 0 394.453 3.244 20 5 GGBDRN COc1cc(CCNC(=O)CCCc2csc(C)n2)c([N+](=O)[O-])cc1OC ZINC000175149574 1427569221 /nfs/dbraw/zinc/56/92/21/1427569221.db2.gz SGXMYMNWCVOLAW-UHFFFAOYSA-N 0 0 393.465 3.059 20 5 GGBDRN CC(C)(NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000175166877 1427578244 /nfs/dbraw/zinc/57/82/44/1427578244.db2.gz ZILJBNZYWBZXEH-UHFFFAOYSA-N 0 0 378.331 3.116 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000175170025 1427579747 /nfs/dbraw/zinc/57/97/47/1427579747.db2.gz NLHXMAUWJKHXKI-BIXPNRAVSA-N 0 0 387.461 3.414 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)NCc3ccccc3[N+](=O)[O-])n2)c1 ZINC000175170948 1427580744 /nfs/dbraw/zinc/58/07/44/1427580744.db2.gz YWYOKJDJEIYTIM-GFCCVEGCSA-N 0 0 397.391 3.214 20 5 GGBDRN COCCn1nc(C)c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1C ZINC000175173904 1427582140 /nfs/dbraw/zinc/58/21/40/1427582140.db2.gz OPLKHWZOMJVTKX-CYBMUJFWSA-N 0 0 378.454 3.174 20 5 GGBDRN C[C@H]1CCC[C@H](C)N(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000175174915 1427583003 /nfs/dbraw/zinc/58/30/03/1427583003.db2.gz DXGZHQHEKYSJET-QWRGUYRKSA-N 0 0 385.367 3.172 20 5 GGBDRN Cc1ccc(NC(=O)COC(=O)CN(C)c2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000175179872 1427585805 /nfs/dbraw/zinc/58/58/05/1427585805.db2.gz AWVGGXVVJBMIDQ-UHFFFAOYSA-N 0 0 391.811 3.175 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000175188922 1427589803 /nfs/dbraw/zinc/58/98/03/1427589803.db2.gz CKNLZTQKQNQIQQ-LBPRGKRZSA-N 0 0 377.422 3.189 20 5 GGBDRN Cc1cc2c(cc1C)O[C@@H](C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)C2 ZINC000175188976 1427590130 /nfs/dbraw/zinc/59/01/30/1427590130.db2.gz GKXFTGFSFIDAGS-GOSISDBHSA-N 0 0 378.388 3.340 20 5 GGBDRN Cc1ccc(-n2cnnn2)cc1NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175189276 1427590174 /nfs/dbraw/zinc/59/01/74/1427590174.db2.gz XDDHUJCPLBECJO-ZDUSSCGKSA-N 0 0 381.396 3.070 20 5 GGBDRN Cc1cccc(-c2nnc(COC(=O)CN(C)c3ccccc3[N+](=O)[O-])o2)c1 ZINC000175187647 1427590243 /nfs/dbraw/zinc/59/02/43/1427590243.db2.gz AISDIXSRSXHDTP-UHFFFAOYSA-N 0 0 382.376 3.133 20 5 GGBDRN O=C(NC[C@@H](O)c1ccc(Cl)cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175190134 1427591125 /nfs/dbraw/zinc/59/11/25/1427591125.db2.gz LLOJNXVPNMOFGK-CQSZACIVSA-N 0 0 399.628 3.474 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000175199244 1427595816 /nfs/dbraw/zinc/59/58/16/1427595816.db2.gz CAVQPGGWDMAGPI-ZDUSSCGKSA-N 0 0 385.420 3.160 20 5 GGBDRN COc1ccc([C@H](C)CCNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000175202202 1427597405 /nfs/dbraw/zinc/59/74/05/1427597405.db2.gz QQZIHNDEYLFDRT-CYBMUJFWSA-N 0 0 385.420 3.160 20 5 GGBDRN C[C@H]1CN(C)c2ccccc2CN1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175246012 1427624206 /nfs/dbraw/zinc/62/42/06/1427624206.db2.gz BIJHYDRCQIQVTM-HNNXBMFYSA-N 0 0 378.436 3.151 20 5 GGBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000175248815 1427624940 /nfs/dbraw/zinc/62/49/40/1427624940.db2.gz RLJHLCMESIZEHO-GXTWGEPZSA-N 0 0 399.900 3.159 20 5 GGBDRN CCC[C@@H]([NH2+]CCOc1ccc(-c2nnn[n-]2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000825242326 1427625006 /nfs/dbraw/zinc/62/50/06/1427625006.db2.gz OFIVYINNBYETSE-GOSISDBHSA-N 0 0 382.424 3.285 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)NCc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000175265886 1427634979 /nfs/dbraw/zinc/63/49/79/1427634979.db2.gz RRCRXKKWDYVILG-LBPRGKRZSA-N 0 0 397.391 3.214 20 5 GGBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000175269444 1427637377 /nfs/dbraw/zinc/63/73/77/1427637377.db2.gz ATBUFIVFMXKAAC-HOTGVXAUSA-N 0 0 375.450 3.230 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NC[C@H](c2cccnc2)C(C)C)cc([N+](=O)[O-])c1 ZINC000175270358 1427638693 /nfs/dbraw/zinc/63/86/93/1427638693.db2.gz FNEYHHVSQIAXES-SFHVURJKSA-N 0 0 385.420 3.336 20 5 GGBDRN CCOc1cc(C(=O)N2CCN(C)c3ccc(F)cc32)c([N+](=O)[O-])cc1OC ZINC000175283962 1427647291 /nfs/dbraw/zinc/64/72/91/1427647291.db2.gz MDMHIAITYKWINS-UHFFFAOYSA-N 0 0 389.383 3.238 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCCN(c2nc(CC)ns2)CC1 ZINC000175287763 1427648524 /nfs/dbraw/zinc/64/85/24/1427648524.db2.gz CPICVQDOSDXBPQ-UHFFFAOYSA-N 0 0 391.497 3.120 20 5 GGBDRN O=C(N[C@H]1c2ccccc2C[C@@H]1O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175297881 1427657086 /nfs/dbraw/zinc/65/70/86/1427657086.db2.gz WCZOYTXSFRNYNX-IRXDYDNUSA-N 0 0 381.413 3.106 20 5 GGBDRN Cc1c(C(=O)Nc2c(F)cc(F)cc2F)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000175302961 1427662269 /nfs/dbraw/zinc/66/22/69/1427662269.db2.gz MGFCGYZJRIQCPD-UHFFFAOYSA-N 0 0 377.282 3.154 20 5 GGBDRN Cc1nccn1CCCCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000175306274 1427665242 /nfs/dbraw/zinc/66/52/42/1427665242.db2.gz WNCGBDBOCLTLAN-UHFFFAOYSA-N 0 0 383.355 3.303 20 5 GGBDRN C[C@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1nc(Cc2ccccc2)no1 ZINC000175312654 1427669162 /nfs/dbraw/zinc/66/91/62/1427669162.db2.gz NKEFWVRRVVHTOX-TZIYXEQSSA-N 0 0 378.388 3.459 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@@H]3c4ccccc4C[C@@H]3O)cc2[N+](=O)[O-])CC1 ZINC000175317671 1427673840 /nfs/dbraw/zinc/67/38/40/1427673840.db2.gz KUXMGQKQFHURBW-LEWJYISDSA-N 0 0 395.459 3.219 20 5 GGBDRN C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)CC[N@@H+]1Cc1ccccc1 ZINC000820668576 1427675160 /nfs/dbraw/zinc/67/51/60/1427675160.db2.gz VANMCHRRSUWSHZ-GDBMZVCRSA-N 0 0 393.451 3.240 20 5 GGBDRN O=C(Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000175320676 1427675673 /nfs/dbraw/zinc/67/56/73/1427675673.db2.gz JTWQOOJHMCBICK-UHFFFAOYSA-N 0 0 384.783 3.354 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1 ZINC000175323959 1427679330 /nfs/dbraw/zinc/67/93/30/1427679330.db2.gz SWBGNQDRNKBILM-UHFFFAOYSA-N 0 0 398.810 3.283 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000175327838 1427680888 /nfs/dbraw/zinc/68/08/88/1427680888.db2.gz HTSKPNJCCUELJL-GFCCVEGCSA-N 0 0 382.376 3.068 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000175329669 1427683152 /nfs/dbraw/zinc/68/31/52/1427683152.db2.gz OSWKGWBUVVALNI-LBPRGKRZSA-N 0 0 382.376 3.068 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000175331118 1427683870 /nfs/dbraw/zinc/68/38/70/1427683870.db2.gz MZRWDHBYWZVQRI-MRXNPFEDSA-N 0 0 378.388 3.244 20 5 GGBDRN CN(C)C(=O)c1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175346758 1427695158 /nfs/dbraw/zinc/69/51/58/1427695158.db2.gz OCXIUUDLRZLBED-UHFFFAOYSA-N 0 0 384.436 3.031 20 5 GGBDRN COc1cc(C(=O)N(CCC(F)(F)F)CC2CC2)c([N+](=O)[O-])cc1OC ZINC000175349454 1427697198 /nfs/dbraw/zinc/69/71/98/1427697198.db2.gz RREKRSOFYNUKFW-UHFFFAOYSA-N 0 0 376.331 3.417 20 5 GGBDRN C[C@@H]1COc2ccccc2N1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000175353864 1427700592 /nfs/dbraw/zinc/70/05/92/1427700592.db2.gz OFLAAURFTVZAHS-CYBMUJFWSA-N 0 0 397.387 3.097 20 5 GGBDRN C[C@@](O)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1F ZINC000175376831 1427718126 /nfs/dbraw/zinc/71/81/26/1427718126.db2.gz APQAZYILZYPFNA-QGZVFWFLSA-N 0 0 384.766 3.093 20 5 GGBDRN C[C@](O)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1F ZINC000175376847 1427718933 /nfs/dbraw/zinc/71/89/33/1427718933.db2.gz APQAZYILZYPFNA-KRWDZBQOSA-N 0 0 384.766 3.093 20 5 GGBDRN CCc1ccc(N2CCN(C(=O)c3cc(F)c(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000175389610 1427726376 /nfs/dbraw/zinc/72/63/76/1427726376.db2.gz SWBYFDBDQHQOTE-UHFFFAOYSA-N 0 0 375.375 3.398 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N(CC1CCC1)c1ccccc1 ZINC000175392834 1427728754 /nfs/dbraw/zinc/72/87/54/1427728754.db2.gz UVYVYPWOBSCAFI-UHFFFAOYSA-N 0 0 381.388 3.336 20 5 GGBDRN CCOc1cc(C(=O)N2CCN(C)c3cc(F)ccc32)c([N+](=O)[O-])cc1OC ZINC000175397147 1427730695 /nfs/dbraw/zinc/73/06/95/1427730695.db2.gz IPYZGXMZGBSYDR-UHFFFAOYSA-N 0 0 389.383 3.238 20 5 GGBDRN O=C(OCc1nc(Cc2ccc(F)cc2)no1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000175397848 1427731485 /nfs/dbraw/zinc/73/14/85/1427731485.db2.gz VGUPYRCOEMDHNM-UHFFFAOYSA-N 0 0 393.277 3.343 20 5 GGBDRN O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)N(CC1CCC1)c1ccccc1 ZINC000175399055 1427732290 /nfs/dbraw/zinc/73/22/90/1427732290.db2.gz PHJWLJDPBLTXFY-UHFFFAOYSA-N 0 0 395.415 3.154 20 5 GGBDRN C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000175408122 1427737505 /nfs/dbraw/zinc/73/75/05/1427737505.db2.gz INJPACPLUYEFDG-OAHLLOKOSA-N 0 0 379.420 3.460 20 5 GGBDRN C[C@@H](NC(=O)N[C@H](CC(N)=O)c1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000175415714 1427742684 /nfs/dbraw/zinc/74/26/84/1427742684.db2.gz OUBDJPJRRXQILE-BDJLRTHQSA-N 0 0 390.827 3.225 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000175420193 1427745083 /nfs/dbraw/zinc/74/50/83/1427745083.db2.gz WCSJSEWOFQMIEH-CANCMXDXSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000175424261 1427747056 /nfs/dbraw/zinc/74/70/56/1427747056.db2.gz MHFYGIZARJEFLJ-CANCMXDXSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175433367 1427753072 /nfs/dbraw/zinc/75/30/72/1427753072.db2.gz IIZXCLMHGXRSRQ-KPZWWZAWSA-N 0 0 385.376 3.414 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175438244 1427754959 /nfs/dbraw/zinc/75/49/59/1427754959.db2.gz WZNGPABGDJXUOU-INIZCTEOSA-N 0 0 379.416 3.351 20 5 GGBDRN Cc1ccc(N2CCOC2=O)cc1NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000175456907 1427765100 /nfs/dbraw/zinc/76/51/00/1427765100.db2.gz HALBHJPUCLZTFC-UHFFFAOYSA-N 0 0 377.303 3.390 20 5 GGBDRN C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1noc(Cc2ccccc2)n1 ZINC000175456655 1427765239 /nfs/dbraw/zinc/76/52/39/1427765239.db2.gz NSIQNSOFACIIKI-ZDUSSCGKSA-N 0 0 381.392 3.129 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)cc1[N+](=O)[O-] ZINC000175459748 1427766844 /nfs/dbraw/zinc/76/68/44/1427766844.db2.gz HJXMIWCPUWMKSM-IERDGZPVSA-N 0 0 397.475 3.278 20 5 GGBDRN CCSCC[C@H](C)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000175462009 1427767522 /nfs/dbraw/zinc/76/75/22/1427767522.db2.gz KRDNRNJSMSKVQE-STQMWFEESA-N 0 0 397.472 3.077 20 5 GGBDRN CCSCC[C@H](C)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000175461971 1427767627 /nfs/dbraw/zinc/76/76/27/1427767627.db2.gz KRDNRNJSMSKVQE-QWHCGFSZSA-N 0 0 397.472 3.077 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)CC2)n1 ZINC000175467428 1427770145 /nfs/dbraw/zinc/77/01/45/1427770145.db2.gz ZQDHYABXRDRTST-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)n1 ZINC000175467623 1427771000 /nfs/dbraw/zinc/77/10/00/1427771000.db2.gz OHUXOVQEHIWUEZ-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000175488355 1427783009 /nfs/dbraw/zinc/78/30/09/1427783009.db2.gz XMYJEKLJWCDFRD-UHFFFAOYSA-N 0 0 387.392 3.465 20 5 GGBDRN CCOc1cc(C(=O)Nc2nc3cc(F)ccc3n2C)c([N+](=O)[O-])cc1OC ZINC000175489194 1427783731 /nfs/dbraw/zinc/78/37/31/1427783731.db2.gz SOBJCJCXWKYBGM-UHFFFAOYSA-N 0 0 388.355 3.280 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)OCCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000175488885 1427784150 /nfs/dbraw/zinc/78/41/50/1427784150.db2.gz FRPDCJFFSJUVOJ-SFHVURJKSA-N 0 0 392.358 3.226 20 5 GGBDRN Cc1c(C(=O)Nc2nc3cc(F)ccc3n2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000175493906 1427787754 /nfs/dbraw/zinc/78/77/54/1427787754.db2.gz SUJXBKNVLXISGE-UHFFFAOYSA-N 0 0 387.327 3.398 20 5 GGBDRN CC(C)[C@@H](CNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1cccnc1 ZINC000175499631 1427791070 /nfs/dbraw/zinc/79/10/70/1427791070.db2.gz RDTWLHAIVVIUFJ-HXUWFJFHSA-N 0 0 397.479 3.261 20 5 GGBDRN CCOC[C@H]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000175511985 1427799014 /nfs/dbraw/zinc/79/90/14/1427799014.db2.gz NMKYCRYNPTYLNQ-INIZCTEOSA-N 0 0 375.469 3.330 20 5 GGBDRN COC(=O)Cc1ccc(OC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000175519274 1427801555 /nfs/dbraw/zinc/80/15/55/1427801555.db2.gz ZRVJVEKQELDAMB-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCOC1CCOCC1 ZINC000175531917 1427805999 /nfs/dbraw/zinc/80/59/99/1427805999.db2.gz JHBXVRLQEUDPFY-UHFFFAOYSA-N 0 0 379.457 3.101 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175533063 1427806495 /nfs/dbraw/zinc/80/64/95/1427806495.db2.gz SCQIHNJJDQFTST-UHFFFAOYSA-N 0 0 397.137 3.493 20 5 GGBDRN CN(C)C(=O)c1cc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000175538514 1427808266 /nfs/dbraw/zinc/80/82/66/1427808266.db2.gz DBRYRULUIZECAD-UHFFFAOYSA-N 0 0 377.397 3.167 20 5 GGBDRN Cc1cc(C)c2c(c1)CCCN2C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000175539606 1427808615 /nfs/dbraw/zinc/80/86/15/1427808615.db2.gz JEVHPAXQGCLUEN-UHFFFAOYSA-N 0 0 377.404 3.385 20 5 GGBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000175547412 1427811202 /nfs/dbraw/zinc/81/12/02/1427811202.db2.gz DRNWNWRKYCOAQB-OFQRWUPVSA-N 0 0 399.422 3.395 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)c1 ZINC000175550868 1427811991 /nfs/dbraw/zinc/81/19/91/1427811991.db2.gz HWHUINKARXWWBW-MZHQLVBMSA-N 0 0 376.434 3.174 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCn2c(nnc2-c2ccccc2)C1 ZINC000175552153 1427812522 /nfs/dbraw/zinc/81/25/22/1427812522.db2.gz CEUSPJPQZMKJPI-UHFFFAOYSA-N 0 0 383.795 3.163 20 5 GGBDRN O=C(NC[C@H](O)c1ccccc1F)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000175559280 1427814469 /nfs/dbraw/zinc/81/44/69/1427814469.db2.gz NKPANYGFYVIYLD-IBGZPJMESA-N 0 0 387.411 3.188 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(CCC(F)(F)F)cc1 ZINC000175559053 1427814614 /nfs/dbraw/zinc/81/46/14/1427814614.db2.gz UFAGOEFYIMYUPV-UHFFFAOYSA-N 0 0 395.337 3.458 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCn3c(nnc3-c3ccccc3)C2)c1 ZINC000175562359 1427816136 /nfs/dbraw/zinc/81/61/36/1427816136.db2.gz CNDOOVITFPPEOW-UHFFFAOYSA-N 0 0 395.444 3.231 20 5 GGBDRN CSc1ccc(C(=O)N2CCn3c(nnc3-c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000175564762 1427816482 /nfs/dbraw/zinc/81/64/82/1427816482.db2.gz PZTQJQPRHZIWOA-UHFFFAOYSA-N 0 0 395.444 3.231 20 5 GGBDRN C[S@@](=O)c1ccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000175568346 1427817625 /nfs/dbraw/zinc/81/76/25/1427817625.db2.gz PQWQCBZSRWJFEB-HHHXNRCGSA-N 0 0 389.477 3.154 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1 ZINC000175567084 1427817705 /nfs/dbraw/zinc/81/77/05/1427817705.db2.gz COIINIGTPVTUMZ-UHFFFAOYSA-N 0 0 375.812 3.318 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000175568362 1427817712 /nfs/dbraw/zinc/81/77/12/1427817712.db2.gz PQWQCBZSRWJFEB-MHZLTWQESA-N 0 0 389.477 3.154 20 5 GGBDRN CNC(=O)[C@@H](C)CN(C)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000175583274 1427822129 /nfs/dbraw/zinc/82/21/29/1427822129.db2.gz NDHBDEBHTLUBOA-ZDUSSCGKSA-N 0 0 381.498 3.187 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@H](O)c1ccccc1F ZINC000175584681 1427822636 /nfs/dbraw/zinc/82/26/36/1427822636.db2.gz PXPGNWQJPWLVFH-NRFANRHFSA-N 0 0 390.414 3.144 20 5 GGBDRN COc1ccc(C(=O)NCc2cc(N(C)C)nc3ccccc23)cc1[N+](=O)[O-] ZINC000175606014 1427829285 /nfs/dbraw/zinc/82/92/85/1427829285.db2.gz XLIATRATMIBCFE-UHFFFAOYSA-N 0 0 380.404 3.148 20 5 GGBDRN O=Cc1cc(F)c(OS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(F)c1 ZINC000175610577 1427831036 /nfs/dbraw/zinc/83/10/36/1427831036.db2.gz WVGRZJYTPGEVDO-UHFFFAOYSA-N 0 0 377.708 3.107 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c(N)c([N+](=O)[O-])c1 ZINC000175610214 1427831224 /nfs/dbraw/zinc/83/12/24/1427831224.db2.gz POQYMHFSLHSQQM-UHFFFAOYSA-N 0 0 392.419 3.333 20 5 GGBDRN O=Cc1cc(F)c(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c(F)c1 ZINC000175613558 1427832254 /nfs/dbraw/zinc/83/22/54/1427832254.db2.gz UGZGQMDZDNAABG-UHFFFAOYSA-N 0 0 377.708 3.107 20 5 GGBDRN CN(C)c1cc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2n1 ZINC000175615647 1427832767 /nfs/dbraw/zinc/83/27/67/1427832767.db2.gz FJGVNDCEYNEZBN-UHFFFAOYSA-N 0 0 394.431 3.294 20 5 GGBDRN CC[C@H](C)NC(=O)c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000175623447 1427835853 /nfs/dbraw/zinc/83/58/53/1427835853.db2.gz WVOUFCCAEHVOEJ-AWEZNQCLSA-N 0 0 384.436 3.198 20 5 GGBDRN C[C@@H](N(C)C(=O)c1cc([N+](=O)[O-])ccc1I)C1(C)CC1 ZINC000175625019 1427836356 /nfs/dbraw/zinc/83/63/56/1427836356.db2.gz ICUPWNGSBSAGQT-SECBINFHSA-N 0 0 388.205 3.460 20 5 GGBDRN CNC(=O)[C@H](C)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000175632849 1427838922 /nfs/dbraw/zinc/83/89/22/1427838922.db2.gz QHEMMOOHBYZXBM-CYBMUJFWSA-N 0 0 387.461 3.200 20 5 GGBDRN O=C(Nc1nnc(C(F)F)s1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000175650989 1427845061 /nfs/dbraw/zinc/84/50/61/1427845061.db2.gz FGUZKOODZBDSSY-UHFFFAOYSA-N 0 0 399.379 3.459 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCC(C)(C)N2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000175669310 1427851280 /nfs/dbraw/zinc/85/12/80/1427851280.db2.gz CJYZVFBKDQKGHQ-OWCLPIDISA-N 0 0 392.500 3.151 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 ZINC000175677480 1427853810 /nfs/dbraw/zinc/85/38/10/1427853810.db2.gz ZPEYQODSYJXSDY-UHFFFAOYSA-N 0 0 383.813 3.262 20 5 GGBDRN CCOc1ccc(-c2noc(CCC(=O)Nc3ccc([N+](=O)[O-])c(C)n3)n2)cc1 ZINC000175682911 1427855720 /nfs/dbraw/zinc/85/57/20/1427855720.db2.gz DATDNVIMEFJGPK-UHFFFAOYSA-N 0 0 397.391 3.318 20 5 GGBDRN Cc1cccc(OC[C@@H](O)CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000175685868 1427856607 /nfs/dbraw/zinc/85/66/07/1427856607.db2.gz VLCSNYGQVQWQLY-ZDUSSCGKSA-N 0 0 398.337 3.092 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)CN1C(=O)C(=O)c2cccc(F)c21 ZINC000175685256 1427856802 /nfs/dbraw/zinc/85/68/02/1427856802.db2.gz YQRYWZARGPDIDV-UHFFFAOYSA-N 0 0 377.759 3.006 20 5 GGBDRN COC(=O)c1ccc(CCNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175687064 1427857387 /nfs/dbraw/zinc/85/73/87/1427857387.db2.gz VHHYWUBCJLUEAO-CQSZACIVSA-N 0 0 385.420 3.293 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)c1 ZINC000175689040 1427858713 /nfs/dbraw/zinc/85/87/13/1427858713.db2.gz CBNBWVBJDMALAD-CYBMUJFWSA-N 0 0 398.337 3.092 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccnc(N3CCCC3)c2)cc1[N+](=O)[O-] ZINC000175694196 1427860718 /nfs/dbraw/zinc/86/07/18/1427860718.db2.gz KALLFKFIKFRGNI-HNNXBMFYSA-N 0 0 383.452 3.459 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@H](CC(C)C)N2CCOCC2)cc1[N+](=O)[O-] ZINC000175695205 1427861210 /nfs/dbraw/zinc/86/12/10/1427861210.db2.gz QBTAOFCCBWSHKW-AEFFLSMTSA-N 0 0 392.500 3.010 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NC[C@@H](CC(C)C)N2CCOCC2)cc1[N+](=O)[O-] ZINC000175695189 1427861275 /nfs/dbraw/zinc/86/12/75/1427861275.db2.gz QBTAOFCCBWSHKW-FUHWJXTLSA-N 0 0 392.500 3.010 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000175701401 1427863718 /nfs/dbraw/zinc/86/37/18/1427863718.db2.gz KDHLBPPDURQMMG-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000175708707 1427865991 /nfs/dbraw/zinc/86/59/91/1427865991.db2.gz JTFODRCQWHTYEQ-STQMWFEESA-N 0 0 377.828 3.061 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000175707292 1427866025 /nfs/dbraw/zinc/86/60/25/1427866025.db2.gz NANBMPQZQWZHDH-ZDUSSCGKSA-N 0 0 399.230 3.000 20 5 GGBDRN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000175713435 1427867481 /nfs/dbraw/zinc/86/74/81/1427867481.db2.gz KRBLGXNMECJBJX-WMLDXEAASA-N 0 0 377.404 3.194 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000175731602 1427872435 /nfs/dbraw/zinc/87/24/35/1427872435.db2.gz ZVFMTDIXDAXNII-UHFFFAOYSA-N 0 0 395.774 3.155 20 5 GGBDRN C[C@H](NC(=O)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000175735738 1427873782 /nfs/dbraw/zinc/87/37/82/1427873782.db2.gz UQAARMDCIFZLDX-SUNYJGFJSA-N 0 0 382.420 3.149 20 5 GGBDRN Cc1ccc(N2CCC(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000175737004 1427874257 /nfs/dbraw/zinc/87/42/57/1427874257.db2.gz FZUATDROBMUBSC-OAHLLOKOSA-N 0 0 383.452 3.327 20 5 GGBDRN Cc1csc(CCCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000175738962 1427874988 /nfs/dbraw/zinc/87/49/88/1427874988.db2.gz BDYMQXZVZODCGH-UHFFFAOYSA-N 0 0 384.255 3.485 20 5 GGBDRN O=C(Nc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175742079 1427876094 /nfs/dbraw/zinc/87/60/94/1427876094.db2.gz HRORYQCSHRNJMQ-UHFFFAOYSA-N 0 0 389.839 3.375 20 5 GGBDRN O=C(Nc1cc(-n2cnnn2)ccc1Cl)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175742726 1427876514 /nfs/dbraw/zinc/87/65/14/1427876514.db2.gz BQDPBAUCWNIHPQ-UHFFFAOYSA-N 0 0 379.163 3.130 20 5 GGBDRN CN1C(=O)COc2ccc(NC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc21 ZINC000175755954 1427880115 /nfs/dbraw/zinc/88/01/15/1427880115.db2.gz SDMGNEODADMQFZ-UHFFFAOYSA-N 0 0 395.293 3.221 20 5 GGBDRN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000175761956 1427882739 /nfs/dbraw/zinc/88/27/39/1427882739.db2.gz LNVVBTSZJSJUAX-RDTXWAMCSA-N 0 0 377.404 3.194 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000175772254 1427887684 /nfs/dbraw/zinc/88/76/84/1427887684.db2.gz LGXYCOZTBXIEGQ-UHFFFAOYSA-N 0 0 395.337 3.345 20 5 GGBDRN CCc1ccc(C(C)(C)NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000175791885 1427894181 /nfs/dbraw/zinc/89/41/81/1427894181.db2.gz UHWKZJLVBMOCPK-UHFFFAOYSA-N 0 0 383.404 3.117 20 5 GGBDRN CCc1ccc(C(C)(C)NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1 ZINC000175792939 1427894755 /nfs/dbraw/zinc/89/47/55/1427894755.db2.gz NHMXTAMKEDVIMX-UHFFFAOYSA-N 0 0 390.461 3.226 20 5 GGBDRN CCc1ccc(C(C)(C)NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000175792462 1427894858 /nfs/dbraw/zinc/89/48/58/1427894858.db2.gz JYIWEGJMVFSXQY-UHFFFAOYSA-N 0 0 390.461 3.226 20 5 GGBDRN CCc1ccc(C(C)(C)NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000175794799 1427896042 /nfs/dbraw/zinc/89/60/42/1427896042.db2.gz JGYDQZUAAVOBLL-UHFFFAOYSA-N 0 0 379.420 3.403 20 5 GGBDRN O=C(NCCc1nc(C(F)(F)F)cs1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000175800217 1427897400 /nfs/dbraw/zinc/89/74/00/1427897400.db2.gz XTQWMIWQQOIOEZ-UHFFFAOYSA-N 0 0 388.371 3.155 20 5 GGBDRN CO[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000175800755 1427897599 /nfs/dbraw/zinc/89/75/99/1427897599.db2.gz XULMZCXOMCTGTM-QGZVFWFLSA-N 0 0 377.828 3.478 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000175803253 1427898763 /nfs/dbraw/zinc/89/87/63/1427898763.db2.gz VKFGPYNZECYRAQ-LJQANCHMSA-N 0 0 383.448 3.386 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000175807624 1427901495 /nfs/dbraw/zinc/90/14/95/1427901495.db2.gz WDMBZRZKDUZURG-UHFFFAOYSA-N 0 0 378.379 3.349 20 5 GGBDRN Cc1cc(-n2cncn2)ccc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000175807440 1427901521 /nfs/dbraw/zinc/90/15/21/1427901521.db2.gz SDWXOZVFTOUCEE-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN NC(=O)CCSc1ccccc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175809964 1427903039 /nfs/dbraw/zinc/90/30/39/1427903039.db2.gz QDYVZYIKPIIPMG-UHFFFAOYSA-N 0 0 379.825 3.468 20 5 GGBDRN COCCCOc1ccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175810624 1427903392 /nfs/dbraw/zinc/90/33/92/1427903392.db2.gz FXQMOAAFHIZAFP-UHFFFAOYSA-N 0 0 396.403 3.448 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000175812816 1427905006 /nfs/dbraw/zinc/90/50/06/1427905006.db2.gz YOKRFWHMMFNRNZ-UHFFFAOYSA-N 0 0 391.374 3.006 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@H](C)C1CCCCC1 ZINC000175813651 1427905292 /nfs/dbraw/zinc/90/52/92/1427905292.db2.gz AXTCWKOYDRRZNS-QWHCGFSZSA-N 0 0 382.482 3.333 20 5 GGBDRN C[C@@H]([C@H](C)NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000175813688 1427905743 /nfs/dbraw/zinc/90/57/43/1427905743.db2.gz AXTCWKOYDRRZNS-STQMWFEESA-N 0 0 382.482 3.333 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@@H](C)C1CCCCC1 ZINC000175813629 1427905765 /nfs/dbraw/zinc/90/57/65/1427905765.db2.gz AXTCWKOYDRRZNS-CHWSQXEVSA-N 0 0 382.482 3.333 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000175815096 1427907232 /nfs/dbraw/zinc/90/72/32/1427907232.db2.gz YJOQCVVLJBQDLD-YOEHRIQHSA-N 0 0 389.477 3.491 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccc1O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000175823605 1427912249 /nfs/dbraw/zinc/91/22/49/1427912249.db2.gz IJJWDRRWZPYXFV-UHFFFAOYSA-N 0 0 393.277 3.413 20 5 GGBDRN CC[C@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1cccc(F)c1 ZINC000175823638 1427912741 /nfs/dbraw/zinc/91/27/41/1427912741.db2.gz ZPGNYOMLOGWQGF-MRXNPFEDSA-N 0 0 382.413 3.011 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1 ZINC000175828440 1427915151 /nfs/dbraw/zinc/91/51/51/1427915151.db2.gz GORZDVUZVHMCMF-SNVBAGLBSA-N 0 0 377.784 3.474 20 5 GGBDRN Cc1ccc(NCCCNC(=O)Nc2ccc([S@@](C)=O)cc2)c([N+](=O)[O-])c1 ZINC000175834385 1427918662 /nfs/dbraw/zinc/91/86/62/1427918662.db2.gz CVGNWWUXRFFJQO-HHHXNRCGSA-N 0 0 390.465 3.264 20 5 GGBDRN CN1C(=O)CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c2ccccc21 ZINC000175833954 1427918697 /nfs/dbraw/zinc/91/86/97/1427918697.db2.gz QWGNDGDSJQJYCJ-UHFFFAOYSA-N 0 0 394.431 3.208 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000175844010 1427925859 /nfs/dbraw/zinc/92/58/59/1427925859.db2.gz NBNQSXCPISILAS-PBHICJAKSA-N 0 0 389.477 3.491 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(Cc2ccccc2)ccc1O ZINC000175844086 1427926090 /nfs/dbraw/zinc/92/60/90/1427926090.db2.gz MQYIWCTUDKUEDK-UHFFFAOYSA-N 0 0 380.404 3.425 20 5 GGBDRN C[C@@H]1CCc2c(F)cccc2[C@H]1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000175850638 1427931870 /nfs/dbraw/zinc/93/18/70/1427931870.db2.gz IWXNKPWPNFNECV-XIKOKIGWSA-N 0 0 378.425 3.477 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCCN(C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000175859144 1427936962 /nfs/dbraw/zinc/93/69/62/1427936962.db2.gz LPQCRMIKUJAUCV-LBPRGKRZSA-N 0 0 376.379 3.148 20 5 GGBDRN CC[C@H](NC(=O)NCc1cc(C(=O)OC)c(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000175873666 1427945226 /nfs/dbraw/zinc/94/52/26/1427945226.db2.gz HMDUSQSTFYWPAL-INIZCTEOSA-N 0 0 375.381 3.233 20 5 GGBDRN O=c1[nH]c2ccccc2n1CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175877764 1427947480 /nfs/dbraw/zinc/94/74/80/1427947480.db2.gz GBIPSGMPEQMMFK-UHFFFAOYSA-N 0 0 395.444 3.151 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc(C)n1 ZINC000175904087 1427961847 /nfs/dbraw/zinc/96/18/47/1427961847.db2.gz JVSJZCQYILLBPH-AWEZNQCLSA-N 0 0 398.467 3.031 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)CCNC(=O)c1ccccc1[N+](=O)[O-] ZINC000175905136 1427962615 /nfs/dbraw/zinc/96/26/15/1427962615.db2.gz WKWSBYLHJUSMSV-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000175912893 1427967880 /nfs/dbraw/zinc/96/78/80/1427967880.db2.gz MCRYZNOSZGNCBX-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(CCO)[C@@H]1CCCc2ccccc21 ZINC000175938315 1427984240 /nfs/dbraw/zinc/98/42/40/1427984240.db2.gz WVEOTVCVXNIVTH-LJQANCHMSA-N 0 0 399.447 3.185 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(CCO)[C@H]1CCCc2ccccc21 ZINC000175938340 1427984325 /nfs/dbraw/zinc/98/43/25/1427984325.db2.gz WVEOTVCVXNIVTH-IBGZPJMESA-N 0 0 399.447 3.185 20 5 GGBDRN C[C@H](Sc1nnc2n(C)c3ccccc3n12)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000175945168 1427987911 /nfs/dbraw/zinc/98/79/11/1427987911.db2.gz MVJXRQLABZCUKO-NSHDSACASA-N 0 0 396.432 3.249 20 5 GGBDRN COc1ccc(OCCSc2nnc3n(C)c4ccccc4n23)c([N+](=O)[O-])c1 ZINC000175945370 1427988200 /nfs/dbraw/zinc/98/82/00/1427988200.db2.gz JDNNABWEVTVOKU-UHFFFAOYSA-N 0 0 399.432 3.309 20 5 GGBDRN C[C@@H](Sc1nnc2n(C)c3ccccc3n12)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000175955622 1427995461 /nfs/dbraw/zinc/99/54/61/1427995461.db2.gz YPVUXLIJRQIOIP-LLVKDONJSA-N 0 0 396.432 3.249 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175957758 1427997362 /nfs/dbraw/zinc/99/73/62/1427997362.db2.gz RGPDIOOFBCZFST-OLZOCXBDSA-N 0 0 381.860 3.405 20 5 GGBDRN C[C@H](NC(=O)CNC(=O)c1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000175962103 1428000861 /nfs/dbraw/zinc/00/08/61/1428000861.db2.gz WWITUEAWCHDIFI-NSHDSACASA-N 0 0 395.337 3.221 20 5 GGBDRN CCOc1cc(C(=O)N(C)C)ccc1NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000175979205 1428009920 /nfs/dbraw/zinc/00/99/20/1428009920.db2.gz NCUCYGTUILPACG-UHFFFAOYSA-N 0 0 393.346 3.226 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCC(=O)N2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000175988989 1428015166 /nfs/dbraw/zinc/01/51/66/1428015166.db2.gz WNVOQTBMEUWZEC-OAHLLOKOSA-N 0 0 396.447 3.243 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2N)C[C@H](C)O1 ZINC000176034474 1428037998 /nfs/dbraw/zinc/03/79/98/1428037998.db2.gz ZTMLHALPUHPIPF-OKILXGFUSA-N 0 0 384.436 3.039 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176042812 1428045485 /nfs/dbraw/zinc/04/54/85/1428045485.db2.gz NJJVAZPAZUBQOJ-UHFFFAOYSA-N 0 0 379.420 3.272 20 5 GGBDRN CC(C)CNC(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)cc1Cl ZINC000176076483 1428069793 /nfs/dbraw/zinc/06/97/93/1428069793.db2.gz YTQBYRBIVFFHRD-UHFFFAOYSA-N 0 0 390.827 3.469 20 5 GGBDRN O=C(C[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccs1 ZINC000176079326 1428071519 /nfs/dbraw/zinc/07/15/19/1428071519.db2.gz JHQCFDXVPYLISC-GFCCVEGCSA-N 0 0 394.836 3.424 20 5 GGBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@H]1CC(=O)c1cccs1 ZINC000176081171 1428071804 /nfs/dbraw/zinc/07/18/04/1428071804.db2.gz UKNFDLQFPOWWRV-CDVVCGDMSA-N 0 0 386.429 3.170 20 5 GGBDRN Cc1ccc(N2CCC[C@H](NC(=O)N(C)Cc3ccccc3[N+](=O)[O-])C2=O)cc1 ZINC000176088716 1428075473 /nfs/dbraw/zinc/07/54/73/1428075473.db2.gz XGQPULCBIFMRGY-SFHVURJKSA-N 0 0 396.447 3.240 20 5 GGBDRN O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000176089183 1428076442 /nfs/dbraw/zinc/07/64/42/1428076442.db2.gz AOAZAMGYNZTSGK-OAHLLOKOSA-N 0 0 394.214 3.437 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCN(C/C=C/c2ccccc2)CC1 ZINC000176090875 1428077252 /nfs/dbraw/zinc/07/72/52/1428077252.db2.gz BFTLQOHDLQUBMV-WEVVVXLNSA-N 0 0 379.460 3.385 20 5 GGBDRN O=C(NCCCOC1CCCC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000176096938 1428081164 /nfs/dbraw/zinc/08/11/64/1428081164.db2.gz WXDIRJQOOYVVEM-UHFFFAOYSA-N 0 0 391.468 3.497 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000176109952 1428088310 /nfs/dbraw/zinc/08/83/10/1428088310.db2.gz WHEMQKZSNVZXSA-OAHLLOKOSA-N 0 0 382.844 3.439 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(-c2ccncc2)cc1 ZINC000176109788 1428088400 /nfs/dbraw/zinc/08/84/00/1428088400.db2.gz MOLLACWQCYPWDB-AWEZNQCLSA-N 0 0 390.399 3.473 20 5 GGBDRN COc1cccc2c1OC[C@H](NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000176122712 1428096320 /nfs/dbraw/zinc/09/63/20/1428096320.db2.gz OAQNRUDGLKSIBX-CZUORRHYSA-N 0 0 385.420 3.276 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@@H]1[C@@H]1CCCCC1=O ZINC000176128041 1428100777 /nfs/dbraw/zinc/10/07/77/1428100777.db2.gz XPJVVOZCJXPOCI-FUHWJXTLSA-N 0 0 382.420 3.144 20 5 GGBDRN CC(=O)Nc1ccc(CCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000176130920 1428104376 /nfs/dbraw/zinc/10/43/76/1428104376.db2.gz VYAIBKDGCPNJOO-AWEZNQCLSA-N 0 0 384.436 3.465 20 5 GGBDRN O=C(N[C@@H](C1CCCC1)C(F)(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000176138322 1428111448 /nfs/dbraw/zinc/11/14/48/1428111448.db2.gz CCUZSPZEJXUCQN-HNNXBMFYSA-N 0 0 383.326 3.287 20 5 GGBDRN O=C(c1c[nH]nc1-c1ccccc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000176145878 1428117013 /nfs/dbraw/zinc/11/70/13/1428117013.db2.gz FNVQISDIBQHLML-UHFFFAOYSA-N 0 0 395.394 3.086 20 5 GGBDRN Cc1nn(CN(C)CC[C@H](NC(=O)OC(C)(C)C)C(C)C)c(C)c1[N+](=O)[O-] ZINC000176151276 1428120892 /nfs/dbraw/zinc/12/08/92/1428120892.db2.gz DQQLWUKHGWZWPH-HNNXBMFYSA-N 0 0 383.493 3.237 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)[C@@H](C)C1CCCCC1 ZINC000176163569 1428130034 /nfs/dbraw/zinc/13/00/34/1428130034.db2.gz CCEYTBDFRFZEPA-CHWSQXEVSA-N 0 0 377.441 3.263 20 5 GGBDRN Nc1ccc(C(=O)N(Cc2ccccc2)C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000176168500 1428134021 /nfs/dbraw/zinc/13/40/21/1428134021.db2.gz OTZMEJYYIDBXKD-SFHVURJKSA-N 0 0 381.388 3.146 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000176168650 1428134876 /nfs/dbraw/zinc/13/48/76/1428134876.db2.gz KYQMWBOKQWLBGG-LJQANCHMSA-N 0 0 380.400 3.493 20 5 GGBDRN Cc1cc(=O)n(C)cc1NC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000176187062 1428150384 /nfs/dbraw/zinc/15/03/84/1428150384.db2.gz QBQJZCMYDNFKRV-OKILXGFUSA-N 0 0 398.463 3.337 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCCC[C@@H]1CC(=O)c1ccccc1 ZINC000176200348 1428162281 /nfs/dbraw/zinc/16/22/81/1428162281.db2.gz YQNGGTSDAPSZEO-QGZVFWFLSA-N 0 0 384.436 3.144 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCCC[C@H]1CC(=O)c1ccccc1 ZINC000176200365 1428162772 /nfs/dbraw/zinc/16/27/72/1428162772.db2.gz YQNGGTSDAPSZEO-KRWDZBQOSA-N 0 0 384.436 3.144 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N(CCC(F)(F)F)CC1CC1 ZINC000176202062 1428163360 /nfs/dbraw/zinc/16/33/60/1428163360.db2.gz CQDZNSXPSVIUQO-UHFFFAOYSA-N 0 0 383.326 3.241 20 5 GGBDRN O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCCN1CCn1ccc([N+](=O)[O-])n1 ZINC000176207100 1428167808 /nfs/dbraw/zinc/16/78/08/1428167808.db2.gz RDDKATVYOXMFQK-AWEZNQCLSA-N 0 0 398.250 3.201 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000176215096 1428172548 /nfs/dbraw/zinc/17/25/48/1428172548.db2.gz ANTVGCPLJPVQPR-NSHDSACASA-N 0 0 384.417 3.410 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1[N+](=O)[O-] ZINC000176221157 1428175224 /nfs/dbraw/zinc/17/52/24/1428175224.db2.gz MJNYRUURVNWMME-UHFFFAOYSA-N 0 0 377.347 3.270 20 5 GGBDRN CC[C@H](NC(=O)N[C@@H](C)c1nnnn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000176238819 1428185557 /nfs/dbraw/zinc/18/55/57/1428185557.db2.gz SMNOSKVPRKVVLM-GUYCJALGSA-N 0 0 395.423 3.082 20 5 GGBDRN CC[C@@H](NC(=O)N[C@H](C)c1nnnn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000176238873 1428186882 /nfs/dbraw/zinc/18/68/82/1428186882.db2.gz SMNOSKVPRKVVLM-CXAGYDPISA-N 0 0 395.423 3.082 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000176240912 1428187613 /nfs/dbraw/zinc/18/76/13/1428187613.db2.gz GLOTYBSIUZIVGV-HOCLYGCPSA-N 0 0 376.434 3.150 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2cccc(CS(C)(=O)=O)c2C)c1[N+](=O)[O-] ZINC000176240467 1428187841 /nfs/dbraw/zinc/18/78/41/1428187841.db2.gz PCKUTBZSADPGFO-UHFFFAOYSA-N 0 0 380.397 3.148 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000176248900 1428194724 /nfs/dbraw/zinc/19/47/24/1428194724.db2.gz XKDQOHTVGBUAQP-XHDPSFHLSA-N 0 0 386.433 3.261 20 5 GGBDRN Cc1ccc(CNC(=O)C2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000176248515 1428194761 /nfs/dbraw/zinc/19/47/61/1428194761.db2.gz QVEJEKVOZCHDRK-UHFFFAOYSA-N 0 0 396.447 3.464 20 5 GGBDRN CC(=O)Nc1cccc(OCCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1 ZINC000176249210 1428194848 /nfs/dbraw/zinc/19/48/48/1428194848.db2.gz LRQXUKAHSASSFK-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN C[C@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000180180922 1429785694 /nfs/dbraw/zinc/78/56/94/1429785694.db2.gz AGCMAZSJAMPWIU-CYBMUJFWSA-N 0 0 398.868 3.210 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CCO)c1C ZINC000180181572 1429786880 /nfs/dbraw/zinc/78/68/80/1429786880.db2.gz JIEZJHHTHFKAEO-OAHLLOKOSA-N 0 0 392.477 3.173 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCN1C(=O)Cc2ccccc21 ZINC000180187551 1429791237 /nfs/dbraw/zinc/79/12/37/1429791237.db2.gz GWWUTTZYKHCMOH-UHFFFAOYSA-N 0 0 399.472 3.414 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Oc2nncc3ccccc32)cc1 ZINC000180190002 1429792845 /nfs/dbraw/zinc/79/28/45/1429792845.db2.gz PVTUZOCZAMRQMV-UHFFFAOYSA-N 0 0 390.359 3.166 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cnn1-c1ccccc1 ZINC000180214776 1429804035 /nfs/dbraw/zinc/80/40/35/1429804035.db2.gz MSOHKNPNRVBCQJ-UHFFFAOYSA-N 0 0 399.794 3.320 20 5 GGBDRN CN(C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)c1ccc(F)c(Cl)c1 ZINC000180230523 1429809030 /nfs/dbraw/zinc/80/90/30/1429809030.db2.gz KWOQFLMZOZGXCF-UHFFFAOYSA-N 0 0 375.747 3.245 20 5 GGBDRN CNC(=O)CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC1 ZINC000180231892 1429809418 /nfs/dbraw/zinc/80/94/18/1429809418.db2.gz SAANSHMGILANMZ-UHFFFAOYSA-N 0 0 379.482 3.084 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccccc1-n1nc(C)nc1C ZINC000180231950 1429809441 /nfs/dbraw/zinc/80/94/41/1429809441.db2.gz HCXBFSUFQREFFU-UHFFFAOYSA-N 0 0 396.407 3.123 20 5 GGBDRN Cn1cnc(-c2ccc(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC000180236579 1429811123 /nfs/dbraw/zinc/81/11/23/1429811123.db2.gz OZUIJLYLVFBHPM-UHFFFAOYSA-N 0 0 379.420 3.143 20 5 GGBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180238546 1429811524 /nfs/dbraw/zinc/81/15/24/1429811524.db2.gz HVTVXJXLQYIZTF-JKSUJKDBSA-N 0 0 379.775 3.351 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000180246663 1429814326 /nfs/dbraw/zinc/81/43/26/1429814326.db2.gz BNLBFFJUAMILNK-MRXNPFEDSA-N 0 0 382.342 3.386 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180258129 1429817262 /nfs/dbraw/zinc/81/72/62/1429817262.db2.gz HWCJKDMDSCTDAF-FUHWJXTLSA-N 0 0 394.786 3.413 20 5 GGBDRN CN(Cc1ncc(Cl)n1C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180262568 1429818313 /nfs/dbraw/zinc/81/83/13/1429818313.db2.gz RXLPWQDKUKHSSD-UHFFFAOYSA-N 0 0 389.746 3.247 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(Cc1ccc(F)cc1F)C1CC1 ZINC000180269191 1429820051 /nfs/dbraw/zinc/82/00/51/1429820051.db2.gz ZBDIHNDCVBXNPL-UHFFFAOYSA-N 0 0 376.315 3.407 20 5 GGBDRN CCc1nn(C)c(OC)c1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000180270417 1429820476 /nfs/dbraw/zinc/82/04/76/1429820476.db2.gz IJPNOVMNAUWENP-UHFFFAOYSA-N 0 0 387.465 3.313 20 5 GGBDRN COc1cc(CN2CC[C@H](OCC(C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180273838 1429821282 /nfs/dbraw/zinc/82/12/82/1429821282.db2.gz VWCJFNYZLGAOTJ-AWEZNQCLSA-N 0 0 388.411 3.494 20 5 GGBDRN CCCN1C(=O)CCc2cc(NC(=O)COc3ccccc3[N+](=O)[O-])ccc21 ZINC000180274761 1429821332 /nfs/dbraw/zinc/82/13/32/1429821332.db2.gz GTHDHYNNCICKPF-UHFFFAOYSA-N 0 0 383.404 3.302 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000180287884 1429825751 /nfs/dbraw/zinc/82/57/51/1429825751.db2.gz PMZUYDKSDZYVRC-UHFFFAOYSA-N 0 0 384.432 3.354 20 5 GGBDRN CCOCCO[C@H](C)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180288839 1429826019 /nfs/dbraw/zinc/82/60/19/1429826019.db2.gz WRZZZNKVTJLQDJ-GFCCVEGCSA-N 0 0 379.438 3.123 20 5 GGBDRN CCCN1C(=O)CCc2cc(NC(=O)COc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000180291941 1429826936 /nfs/dbraw/zinc/82/69/36/1429826936.db2.gz GOUWUYWLINIAET-UHFFFAOYSA-N 0 0 383.404 3.302 20 5 GGBDRN CC(C)CN(C(=O)[C@@H]1COCCO1)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180300706 1429829415 /nfs/dbraw/zinc/82/94/15/1429829415.db2.gz XWUGIZWEADUHAB-INIZCTEOSA-N 0 0 391.449 3.123 20 5 GGBDRN CC(C)CN(C(=O)[C@H]1COCCO1)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180300725 1429829645 /nfs/dbraw/zinc/82/96/45/1429829645.db2.gz XWUGIZWEADUHAB-MRXNPFEDSA-N 0 0 391.449 3.123 20 5 GGBDRN O=C(Nc1cccc(-c2nnco2)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180321917 1429835849 /nfs/dbraw/zinc/83/58/49/1429835849.db2.gz SYZBUVJQMJSVCS-UHFFFAOYSA-N 0 0 376.275 3.499 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCCOc3cc(F)ccc32)cc1 ZINC000180329423 1429837420 /nfs/dbraw/zinc/83/74/20/1429837420.db2.gz JGUGZRFRTYLDNP-KRWDZBQOSA-N 0 0 394.424 3.110 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC[C@@H]2CC(=O)c2cccs2)c1[N+](=O)[O-] ZINC000180340189 1429839836 /nfs/dbraw/zinc/83/98/36/1429839836.db2.gz GBJGQFYNMGKHFI-GFCCVEGCSA-N 0 0 389.433 3.470 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3c(C4CC4)nc4sccn34)C2)nc1 ZINC000180344209 1429841035 /nfs/dbraw/zinc/84/10/35/1429841035.db2.gz AWADKZOERDVUJS-ZDUSSCGKSA-N 0 0 384.465 3.263 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000180347360 1429841638 /nfs/dbraw/zinc/84/16/38/1429841638.db2.gz XXUFGFMSRRIHOQ-MRXNPFEDSA-N 0 0 382.342 3.468 20 5 GGBDRN COc1ccc(COCCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000180356374 1429844991 /nfs/dbraw/zinc/84/49/91/1429844991.db2.gz OEAHFYAVDNFJTF-HNNXBMFYSA-N 0 0 387.436 3.489 20 5 GGBDRN COC[C@@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(F)c(F)c1 ZINC000180363617 1429846779 /nfs/dbraw/zinc/84/67/79/1429846779.db2.gz TXKDTSYGMRZERY-QGZVFWFLSA-N 0 0 380.347 3.217 20 5 GGBDRN COC[C@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(F)c(F)c1 ZINC000180363604 1429846792 /nfs/dbraw/zinc/84/67/92/1429846792.db2.gz TXKDTSYGMRZERY-KRWDZBQOSA-N 0 0 380.347 3.217 20 5 GGBDRN CC(C)C[C@@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1nccs1 ZINC000180368601 1429848193 /nfs/dbraw/zinc/84/81/93/1429848193.db2.gz VOFZMWHSGBUEQU-SBJJXXPASA-N 0 0 388.449 3.234 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)ccc1[N+](=O)[O-] ZINC000180375915 1429850045 /nfs/dbraw/zinc/85/00/45/1429850045.db2.gz CONDSKITLTWOKY-ZDUSSCGKSA-N 0 0 376.438 3.143 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000180383386 1429852361 /nfs/dbraw/zinc/85/23/61/1429852361.db2.gz UCKNQOIRUSOSRF-LBPRGKRZSA-N 0 0 395.371 3.485 20 5 GGBDRN COC(=O)CCN1CCN(C(=O)c2cc3ccccc3c3cccnc23)[C@@H](C)C1 ZINC000180383517 1429852472 /nfs/dbraw/zinc/85/24/72/1429852472.db2.gz HRHXWFFUKSKSBN-INIZCTEOSA-N 0 0 391.471 3.097 20 5 GGBDRN COc1cc(NCc2ccccc2CN2CCCC2=O)c([N+](=O)[O-])cc1OC ZINC000180392949 1429854987 /nfs/dbraw/zinc/85/49/87/1429854987.db2.gz IHCXFISGQUGIRB-UHFFFAOYSA-N 0 0 385.420 3.347 20 5 GGBDRN Cc1ccccc1CNc1ccccc1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000180393984 1429855338 /nfs/dbraw/zinc/85/53/38/1429855338.db2.gz LOFFMRGSXBLINB-UHFFFAOYSA-N 0 0 392.415 3.316 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180394291 1429855762 /nfs/dbraw/zinc/85/57/62/1429855762.db2.gz BBESMKLNTVHWDQ-JKSUJKDBSA-N 0 0 398.463 3.006 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180394331 1429855917 /nfs/dbraw/zinc/85/59/17/1429855917.db2.gz BBESMKLNTVHWDQ-HZPDHXFCSA-N 0 0 398.463 3.006 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H](CC(C)(C)C)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000180395393 1429856200 /nfs/dbraw/zinc/85/62/00/1429856200.db2.gz ICNXFKZGWZYJJR-CYBMUJFWSA-N 0 0 389.374 3.116 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)cc1O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000180404097 1429858658 /nfs/dbraw/zinc/85/86/58/1429858658.db2.gz ZWMFONFOCPBKCR-UHFFFAOYSA-N 0 0 395.337 3.282 20 5 GGBDRN CN(CCCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)CC(F)(F)F ZINC000180404197 1429858681 /nfs/dbraw/zinc/85/86/81/1429858681.db2.gz NVRAUGNLOSWCRJ-UHFFFAOYSA-N 0 0 388.390 3.127 20 5 GGBDRN COC(=O)c1c(C)c(C)sc1NC(=O)CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180408256 1429860088 /nfs/dbraw/zinc/86/00/88/1429860088.db2.gz XISYSCHLSCIVRP-LLVKDONJSA-N 0 0 391.449 3.349 20 5 GGBDRN CC1(C)CN(CC(F)(F)F)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000180411283 1429861558 /nfs/dbraw/zinc/86/15/58/1429861558.db2.gz WEFAKKYLEQUKMW-UHFFFAOYSA-N 0 0 391.415 3.172 20 5 GGBDRN O=C(NCc1ccc(-n2cccn2)cc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180417954 1429863362 /nfs/dbraw/zinc/86/33/62/1429863362.db2.gz CBGVEWJBOPLMSR-UHFFFAOYSA-N 0 0 388.330 3.312 20 5 GGBDRN COC[C@@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccc(F)c(F)c1 ZINC000180437266 1429869320 /nfs/dbraw/zinc/86/93/20/1429869320.db2.gz KJCVEJJTOYAJQZ-MRXNPFEDSA-N 0 0 395.362 3.069 20 5 GGBDRN COc1ccc(COCCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000180455784 1429873287 /nfs/dbraw/zinc/87/32/87/1429873287.db2.gz ZMXBAYBEJBCSCF-UHFFFAOYSA-N 0 0 399.447 3.150 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)c1ccc(S(C)(=O)=O)cc1 ZINC000180464689 1429875589 /nfs/dbraw/zinc/87/55/89/1429875589.db2.gz UYBAUQSUUCIPSQ-UHFFFAOYSA-N 0 0 376.434 3.200 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)Cc1cc(F)c(F)c(F)c1 ZINC000180494576 1429882352 /nfs/dbraw/zinc/88/23/52/1429882352.db2.gz QLCULHIMRPFBLA-UHFFFAOYSA-N 0 0 383.326 3.091 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(C)Cc1cc(F)c(F)c(F)c1 ZINC000180499926 1429883408 /nfs/dbraw/zinc/88/34/08/1429883408.db2.gz CHPVEIZTQFJGSL-SNVBAGLBSA-N 0 0 397.353 3.480 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000180502429 1429884040 /nfs/dbraw/zinc/88/40/40/1429884040.db2.gz AOUUJCFVWCOZEG-WBVHZDCISA-N 0 0 377.347 3.202 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cccc(Br)n1 ZINC000180503470 1429884502 /nfs/dbraw/zinc/88/45/02/1429884502.db2.gz GQTAOERXYHYDDY-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CCc1cc(NC(=O)c2cccc(S(C)(=O)=O)c2)c2cc([N+](=O)[O-])ccc2n1 ZINC000180505574 1429884755 /nfs/dbraw/zinc/88/47/55/1429884755.db2.gz WVLZPTJORORIEQ-UHFFFAOYSA-N 0 0 399.428 3.361 20 5 GGBDRN CCc1cc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000180506010 1429885138 /nfs/dbraw/zinc/88/51/38/1429885138.db2.gz NFLVZYQXBFLFAG-UHFFFAOYSA-N 0 0 398.379 3.147 20 5 GGBDRN CCOc1ccc(CCC2CCN(C(=O)c3cc([N+](=O)[O-])cnc3N)CC2)cc1 ZINC000180509197 1429885838 /nfs/dbraw/zinc/88/58/38/1429885838.db2.gz ZCOYTWFLVCCJLV-UHFFFAOYSA-N 0 0 398.463 3.456 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)nn1-c1ccccc1[N+](=O)[O-] ZINC000180517329 1429887621 /nfs/dbraw/zinc/88/76/21/1429887621.db2.gz KCSGODNEQIAXAR-IMJJTQAJSA-N 0 0 396.447 3.100 20 5 GGBDRN Cc1nc(NC(=O)c2cc([N+](=O)[O-])cnc2N)sc1Cc1ccccc1F ZINC000180538989 1429893249 /nfs/dbraw/zinc/89/32/49/1429893249.db2.gz HUYQGXFXUFIWEE-UHFFFAOYSA-N 0 0 387.396 3.319 20 5 GGBDRN Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1 ZINC000180541707 1429893871 /nfs/dbraw/zinc/89/38/71/1429893871.db2.gz PCDHVZFSSMBCCL-UHFFFAOYSA-N 0 0 379.420 3.382 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCCOc1ccccc1-c1ccccc1 ZINC000180549309 1429895293 /nfs/dbraw/zinc/89/52/93/1429895293.db2.gz QMOHHUDKBKRSCH-UHFFFAOYSA-N 0 0 378.388 3.048 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cc(C(F)(F)F)ccn2)cc([N+](=O)[O-])c1 ZINC000180559100 1429897573 /nfs/dbraw/zinc/89/75/73/1429897573.db2.gz FODGBYISOYUFIZ-UHFFFAOYSA-N 0 0 383.282 3.438 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)cc1O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000180560069 1429897899 /nfs/dbraw/zinc/89/78/99/1429897899.db2.gz OQQICSNCTSBLRZ-LLVKDONJSA-N 0 0 396.325 3.041 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000180587253 1429915436 /nfs/dbraw/zinc/91/54/36/1429915436.db2.gz MIPUYXSCRJHSAD-MRXNPFEDSA-N 0 0 383.795 3.140 20 5 GGBDRN CC(C)c1ccc(CN2CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC2)cc1 ZINC000180599409 1429923173 /nfs/dbraw/zinc/92/31/73/1429923173.db2.gz SBGKVLHMVSVRHR-UHFFFAOYSA-N 0 0 382.464 3.258 20 5 GGBDRN COc1cc(Cn2ncc3ccccc3c2=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180603029 1429926712 /nfs/dbraw/zinc/92/67/12/1429926712.db2.gz BIXZSEFAEPMMFS-UHFFFAOYSA-N 0 0 391.330 3.006 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CCCOc2c(F)cccc21 ZINC000180616781 1429935546 /nfs/dbraw/zinc/93/55/46/1429935546.db2.gz SYPKLRMIMQAFEA-MRXNPFEDSA-N 0 0 389.383 3.456 20 5 GGBDRN O=C(Cc1ccc2c(c1)OCCO2)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180618876 1429936089 /nfs/dbraw/zinc/93/60/89/1429936089.db2.gz MMBKNRAXCOGADM-UHFFFAOYSA-N 0 0 393.193 3.310 20 5 GGBDRN CN(C)C(=O)c1ccc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000180621766 1429937856 /nfs/dbraw/zinc/93/78/56/1429937856.db2.gz VDVHRLGSZHCQLT-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN C[C@H]1C[C@@H](C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC(C)(C)C1 ZINC000180694148 1429981467 /nfs/dbraw/zinc/98/14/67/1429981467.db2.gz WMYGOUXOBDNHHT-DOTOQJQBSA-N 0 0 387.480 3.342 20 5 GGBDRN Cc1nc(Br)ccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000180700993 1429986032 /nfs/dbraw/zinc/98/60/32/1429986032.db2.gz IUZMNBNYDPWCIU-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000180702519 1429986596 /nfs/dbraw/zinc/98/65/96/1429986596.db2.gz HEXFZNBXBAVUKR-GFCCVEGCSA-N 0 0 375.347 3.325 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(Oc2cccnc2)c(F)c1 ZINC000180706193 1429989310 /nfs/dbraw/zinc/98/93/10/1429989310.db2.gz MGRSVBUKUCZNKB-UHFFFAOYSA-N 0 0 382.351 3.433 20 5 GGBDRN O=C(N[C@@H]1CC12CCCCC2)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000180712409 1429993839 /nfs/dbraw/zinc/99/38/39/1429993839.db2.gz VEMVOFJBGOCAMX-GXTWGEPZSA-N 0 0 377.466 3.100 20 5 GGBDRN CC(C)N1Cc2cccc(NS(=O)(=O)CCc3ccccc3[N+](=O)[O-])c2C1 ZINC000180713927 1429995752 /nfs/dbraw/zinc/99/57/52/1429995752.db2.gz AHTRMMQTQYAXSA-UHFFFAOYSA-N 0 0 389.477 3.303 20 5 GGBDRN COCCn1ccc2ccc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)cc21 ZINC000180760253 1430023671 /nfs/dbraw/zinc/02/36/71/1430023671.db2.gz XTFHALDRJATPLV-UHFFFAOYSA-N 0 0 384.348 3.356 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c(N)c([N+](=O)[O-])c1 ZINC000180768126 1430028182 /nfs/dbraw/zinc/02/81/82/1430028182.db2.gz BKHQDYFXBGTKOR-LLVKDONJSA-N 0 0 397.357 3.178 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180774323 1430031751 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CBUCZZOEEBOCMQ-OAHLLOKOSA-N 0 0 397.431 3.000 20 5 GGBDRN C[C@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1cc2ccccc2o1 ZINC000181770145 1430356115 /nfs/dbraw/zinc/35/61/15/1430356115.db2.gz NSTYJWFVOLDFED-NSHDSACASA-N 0 0 383.360 3.359 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O ZINC000181791648 1430361039 /nfs/dbraw/zinc/36/10/39/1430361039.db2.gz SVFIFCUXSUSBDM-MRXNPFEDSA-N 0 0 391.786 3.231 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000181796915 1430362545 /nfs/dbraw/zinc/36/25/45/1430362545.db2.gz LRVCVYPVDURQHR-HNNXBMFYSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000181801117 1430363156 /nfs/dbraw/zinc/36/31/56/1430363156.db2.gz MHAWFITUVAHMAL-IEBWSBKVSA-N 0 0 376.359 3.452 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000181807483 1430364596 /nfs/dbraw/zinc/36/45/96/1430364596.db2.gz ORJGYAIVBZREPX-UHFFFAOYSA-N 0 0 379.486 3.169 20 5 GGBDRN Cc1nn([C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cc1[N+](=O)[O-] ZINC000181816243 1430366282 /nfs/dbraw/zinc/36/62/82/1430366282.db2.gz HFTFBMQSIZRQIB-CQSZACIVSA-N 0 0 382.342 3.482 20 5 GGBDRN COc1cc(CNc2nnc(CCCc3ccccc3)o2)c([N+](=O)[O-])cc1O ZINC000181839692 1430370504 /nfs/dbraw/zinc/37/05/04/1430370504.db2.gz LSWPSBGKJGHWBW-UHFFFAOYSA-N 0 0 384.392 3.479 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000181872363 1430375281 /nfs/dbraw/zinc/37/52/81/1430375281.db2.gz LOTFCULXHKODNI-YOEHRIQHSA-N 0 0 378.331 3.142 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000181874815 1430375619 /nfs/dbraw/zinc/37/56/19/1430375619.db2.gz MXNNADHGDRSQAY-LPHOPBHVSA-N 0 0 391.374 3.321 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000181876809 1430376090 /nfs/dbraw/zinc/37/60/90/1430376090.db2.gz SZCMGTAXXWMQRT-WBVHZDCISA-N 0 0 378.331 3.142 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181897839 1430379798 /nfs/dbraw/zinc/37/97/98/1430379798.db2.gz ZNNZSUUBCIEURQ-GOEBONIOSA-N 0 0 392.452 3.386 20 5 GGBDRN C[C@H]1C[C@H](c2ccc(F)cc2)CN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181897798 1430379989 /nfs/dbraw/zinc/37/99/89/1430379989.db2.gz ZNNZSUUBCIEURQ-HOCLYGCPSA-N 0 0 392.452 3.386 20 5 GGBDRN Cn1cc(CN2CCO[C@@H](Cc3ccccc3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181921121 1430383632 /nfs/dbraw/zinc/38/36/32/1430383632.db2.gz UUSAECHFWDBCGM-NRFANRHFSA-N 0 0 392.459 3.439 20 5 GGBDRN C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc([N+](=O)[O-])ccc1[O-] ZINC000181937314 1430386051 /nfs/dbraw/zinc/38/60/51/1430386051.db2.gz YJRNZUDMZXWAFQ-UHFFFAOYSA-N 0 0 377.828 3.158 20 5 GGBDRN O=C(CCNC(=O)c1cccs1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000181947282 1430386897 /nfs/dbraw/zinc/38/68/97/1430386897.db2.gz CKHYHZJSROPFKJ-UHFFFAOYSA-N 0 0 387.339 3.434 20 5 GGBDRN CCN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(O)c1 ZINC000181958067 1430388621 /nfs/dbraw/zinc/38/86/21/1430388621.db2.gz NFPCDIXIBVTNGC-AWEZNQCLSA-N 0 0 378.450 3.157 20 5 GGBDRN CC[C@](C)(COc1ncccc1Cl)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000181960944 1430388809 /nfs/dbraw/zinc/38/88/09/1430388809.db2.gz FFYODBDUAVJBPA-MRXNPFEDSA-N 0 0 379.804 3.407 20 5 GGBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCNC(=O)[C@@H]1c1ccccc1Cl ZINC000181998728 1430393923 /nfs/dbraw/zinc/39/39/23/1430393923.db2.gz IESZERRTRJEFSS-KRWDZBQOSA-N 0 0 398.806 3.043 20 5 GGBDRN O=C(CN1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1)Nc1ccccc1 ZINC000182002285 1430394525 /nfs/dbraw/zinc/39/45/25/1430394525.db2.gz NZTGHLKFDGFDJE-UHFFFAOYSA-N 0 0 388.855 3.005 20 5 GGBDRN O=C(c1ccc(F)cc1)N1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182004333 1430394795 /nfs/dbraw/zinc/39/47/95/1430394795.db2.gz JZBTYTWAQBHXOA-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN COCC(=O)N1CCc2c1cccc2NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000182005218 1430395081 /nfs/dbraw/zinc/39/50/81/1430395081.db2.gz AUPVTQYTTIYRCJ-UHFFFAOYSA-N 0 0 389.795 3.036 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000182008636 1430395467 /nfs/dbraw/zinc/39/54/67/1430395467.db2.gz PKLKKFSGTWBNGV-UHFFFAOYSA-N 0 0 377.422 3.019 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(-n2ncc3ccccc32)cc1 ZINC000182037925 1430400024 /nfs/dbraw/zinc/40/00/24/1430400024.db2.gz OJKAHEQTVINRAN-UHFFFAOYSA-N 0 0 376.376 3.077 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(-n2ncc3ccccc32)cc1 ZINC000182053096 1430402639 /nfs/dbraw/zinc/40/26/39/1430402639.db2.gz DFKQLOSBIPALEK-UHFFFAOYSA-N 0 0 376.376 3.159 20 5 GGBDRN O=C(CN(Cc1ccco1)Cc1cccnc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000182057841 1430403478 /nfs/dbraw/zinc/40/34/78/1430403478.db2.gz MHYYDUYVVQIARE-UHFFFAOYSA-N 0 0 392.415 3.174 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC1 ZINC000182120240 1430415610 /nfs/dbraw/zinc/41/56/10/1430415610.db2.gz PQENJWIZBXJEJY-HNNXBMFYSA-N 0 0 375.469 3.417 20 5 GGBDRN COc1ccccc1N1CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000182156144 1430421657 /nfs/dbraw/zinc/42/16/57/1430421657.db2.gz KFKNJHWWEPWPHX-AWEZNQCLSA-N 0 0 387.411 3.195 20 5 GGBDRN NC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)CC1 ZINC000182210500 1430430512 /nfs/dbraw/zinc/43/05/12/1430430512.db2.gz FEPWNVKEAQVOCW-UHFFFAOYSA-N 0 0 391.493 3.215 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN(Cc1ccc(F)cc1F)C1CC1 ZINC000182215570 1430431102 /nfs/dbraw/zinc/43/11/02/1430431102.db2.gz UHJHLZVJWZPPSK-MRXNPFEDSA-N 0 0 378.375 3.277 20 5 GGBDRN O=C(NCCCc1nc(-c2ccc(F)cc2)no1)NCc1ccc([N+](=O)[O-])cc1 ZINC000182220562 1430431853 /nfs/dbraw/zinc/43/18/53/1430431853.db2.gz PBEOGYLJPIHEIN-UHFFFAOYSA-N 0 0 399.382 3.216 20 5 GGBDRN CCN1CCc2nc(NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)sc2C1 ZINC000182233096 1430434314 /nfs/dbraw/zinc/43/43/14/1430434314.db2.gz UCDAVYQRPBQNMZ-SNVBAGLBSA-N 0 0 378.429 3.311 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)CC2 ZINC000182268481 1430440127 /nfs/dbraw/zinc/44/01/27/1430440127.db2.gz VNSLMCDHZZZEDA-GFCCVEGCSA-N 0 0 388.395 3.440 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OC[C@@H](O)COc1ccccc1C(F)(F)F ZINC000182280000 1430441781 /nfs/dbraw/zinc/44/17/81/1430441781.db2.gz YRFOPAYEDZNYLE-LBPRGKRZSA-N 0 0 387.310 3.441 20 5 GGBDRN CN(Cc1ccc([S@@](C)=O)cc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182309040 1430446208 /nfs/dbraw/zinc/44/62/08/1430446208.db2.gz XUZYIDTYWVRDRB-HHHXNRCGSA-N 0 0 398.387 3.206 20 5 GGBDRN CC(=O)c1ccc(OC[C@@H](O)Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)cc1 ZINC000182311206 1430446384 /nfs/dbraw/zinc/44/63/84/1430446384.db2.gz NJHIBEVCBXYTOD-KRWDZBQOSA-N 0 0 381.388 3.101 20 5 GGBDRN COc1ccc(C[C@@H](C)C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1OC ZINC000182313131 1430447089 /nfs/dbraw/zinc/44/70/89/1430447089.db2.gz AXOONNZKQQDTRR-LLVKDONJSA-N 0 0 384.392 3.306 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182316220 1430447430 /nfs/dbraw/zinc/44/74/30/1430447430.db2.gz JZPWHRUSVTVBCW-RCDFVIHFSA-N 0 0 390.408 3.006 20 5 GGBDRN O=C(NCCCc1nc(-c2ccc(F)cc2)no1)NCc1cccc([N+](=O)[O-])c1 ZINC000182348062 1430451965 /nfs/dbraw/zinc/45/19/65/1430451965.db2.gz KPCJLGJJTHWKLP-UHFFFAOYSA-N 0 0 399.382 3.216 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccnn1-c1ccccc1C ZINC000182348565 1430452206 /nfs/dbraw/zinc/45/22/06/1430452206.db2.gz YUGGEECIVPYKQL-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1SCC(N)=O)c1ccc([N+](=O)[O-])cc1F ZINC000182357098 1430452900 /nfs/dbraw/zinc/45/29/00/1430452900.db2.gz CSWLMYBRJSQEON-SNVBAGLBSA-N 0 0 377.397 3.054 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F ZINC000182388105 1430457719 /nfs/dbraw/zinc/45/77/19/1430457719.db2.gz ZYBHJVBUTIMHEJ-GFCCVEGCSA-N 0 0 396.247 3.230 20 5 GGBDRN Cc1cc(NC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)ccc1[N+](=O)[O-] ZINC000182403334 1430461036 /nfs/dbraw/zinc/46/10/36/1430461036.db2.gz CKBVOFQNKKNZPD-UHFFFAOYSA-N 0 0 380.404 3.259 20 5 GGBDRN COc1ccc([C@H](CCO)NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000182405434 1430461606 /nfs/dbraw/zinc/46/16/06/1430461606.db2.gz KCQVMBKAIICHEI-IBGZPJMESA-N 0 0 383.404 3.472 20 5 GGBDRN COc1ccc([C@@H](CCO)NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000182405415 1430461623 /nfs/dbraw/zinc/46/16/23/1430461623.db2.gz KCQVMBKAIICHEI-LJQANCHMSA-N 0 0 383.404 3.472 20 5 GGBDRN Cc1cc(NC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000182406991 1430462146 /nfs/dbraw/zinc/46/21/46/1430462146.db2.gz KOZLBKOAKCVJBK-LBPRGKRZSA-N 0 0 380.397 3.091 20 5 GGBDRN Cc1cc(NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000182423331 1430464905 /nfs/dbraw/zinc/46/49/05/1430464905.db2.gz GBOYTMWKFULPLL-QGZVFWFLSA-N 0 0 381.432 3.323 20 5 GGBDRN Cc1cc(NC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000182431623 1430466794 /nfs/dbraw/zinc/46/67/94/1430466794.db2.gz VAYLCIPUFPBLIE-INIZCTEOSA-N 0 0 397.431 3.159 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000182432356 1430467085 /nfs/dbraw/zinc/46/70/85/1430467085.db2.gz YSPZYWIWWVHZBH-UHFFFAOYSA-N 0 0 376.434 3.268 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000182445446 1430468876 /nfs/dbraw/zinc/46/88/76/1430468876.db2.gz POQNZRFXHVANGQ-CYBMUJFWSA-N 0 0 391.449 3.232 20 5 GGBDRN Cc1cc(NC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)ccc1[N+](=O)[O-] ZINC000182449743 1430469394 /nfs/dbraw/zinc/46/93/94/1430469394.db2.gz JBLDOVHHGQXZDN-HNNXBMFYSA-N 0 0 376.457 3.309 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CCCOc2cc(Cl)ccc21 ZINC000182453119 1430470179 /nfs/dbraw/zinc/47/01/79/1430470179.db2.gz RFAGTJIJWVDALH-AWEZNQCLSA-N 0 0 378.816 3.173 20 5 GGBDRN CC[C@@H](N[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000182463210 1430471946 /nfs/dbraw/zinc/47/19/46/1430471946.db2.gz WMXYNZFYQJYNKX-BXUZGUMPSA-N 0 0 376.413 3.276 20 5 GGBDRN Cn1ccnc1C[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182474773 1430473756 /nfs/dbraw/zinc/47/37/56/1430473756.db2.gz GNJHMTLMMCNKOF-GFCCVEGCSA-N 0 0 394.378 3.025 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccnn1C[C@H]1CCOC1 ZINC000182486432 1430475871 /nfs/dbraw/zinc/47/58/71/1430475871.db2.gz QIIGNPDEAGXDGX-LLVKDONJSA-N 0 0 396.856 3.212 20 5 GGBDRN CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H](c2ccccc2)C1 ZINC000182495595 1430477690 /nfs/dbraw/zinc/47/76/90/1430477690.db2.gz MONIZFKFFJCFHC-MRXNPFEDSA-N 0 0 391.374 3.325 20 5 GGBDRN C[C@@H](C(=O)NCCc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182499754 1430478711 /nfs/dbraw/zinc/47/87/11/1430478711.db2.gz KIHISSHZQYGLMT-CQSZACIVSA-N 0 0 382.395 3.382 20 5 GGBDRN C[C@H](C(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182501021 1430478957 /nfs/dbraw/zinc/47/89/57/1430478957.db2.gz VECFZKIWBGAQBB-AWEZNQCLSA-N 0 0 382.395 3.382 20 5 GGBDRN CCc1cc(=O)c2cc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)ccc2[nH]1 ZINC000182501394 1430479036 /nfs/dbraw/zinc/47/90/36/1430479036.db2.gz UVTAFHIZRFVWFC-UHFFFAOYSA-N 0 0 387.417 3.108 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182503489 1430479605 /nfs/dbraw/zinc/47/96/05/1430479605.db2.gz KGOOKJTZMRZMAC-FUHWJXTLSA-N 0 0 376.796 3.273 20 5 GGBDRN CC[C@H](c1ccc(F)cc1)S(=O)(=O)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182507058 1430480018 /nfs/dbraw/zinc/48/00/18/1430480018.db2.gz WJFIZIZCUWEMFG-CRAIPNDOSA-N 0 0 397.424 3.040 20 5 GGBDRN C[C@@H](C(=O)NCc1ccc(Cn2cccn2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182536366 1430485885 /nfs/dbraw/zinc/48/58/85/1430485885.db2.gz JOEAWTQELKFHRU-CQSZACIVSA-N 0 0 382.395 3.399 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000182543445 1430487412 /nfs/dbraw/zinc/48/74/12/1430487412.db2.gz PPEMRDSXUNAYGH-BBRMVZONSA-N 0 0 378.816 3.184 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182544706 1430487777 /nfs/dbraw/zinc/48/77/77/1430487777.db2.gz SHSKAPNZTHARAN-MAUKXSAKSA-N 0 0 375.812 3.307 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182544723 1430487806 /nfs/dbraw/zinc/48/78/06/1430487806.db2.gz SHSKAPNZTHARAN-QAPCUYQASA-N 0 0 375.812 3.307 20 5 GGBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000182551003 1430489807 /nfs/dbraw/zinc/48/98/07/1430489807.db2.gz MHRBEZBPUYLIIN-WBVHZDCISA-N 0 0 386.795 3.385 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1C(F)(F)F ZINC000182573440 1430495725 /nfs/dbraw/zinc/49/57/25/1430495725.db2.gz GFZLLURBXQCQDB-INIZCTEOSA-N 0 0 379.338 3.287 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(CC(=O)N(C)C)CC1 ZINC000182585124 1430497546 /nfs/dbraw/zinc/49/75/46/1430497546.db2.gz ZISVZRMMAKHSHE-UHFFFAOYSA-N 0 0 379.482 3.037 20 5 GGBDRN Cn1c(=O)oc2cc(NC(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000182598813 1430500018 /nfs/dbraw/zinc/50/00/18/1430500018.db2.gz CBGNAXLGCFZSMT-UHFFFAOYSA-N 0 0 393.808 3.424 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(CC(=O)N(C)C)CC1 ZINC000182604277 1430500767 /nfs/dbraw/zinc/50/07/67/1430500767.db2.gz FCGKFHKMRQJCGL-UHFFFAOYSA-N 0 0 393.509 3.426 20 5 GGBDRN COc1ccc([C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc1 ZINC000182604882 1430501029 /nfs/dbraw/zinc/50/10/29/1430501029.db2.gz YVIPGODDSWGBNW-INIZCTEOSA-N 0 0 384.310 3.402 20 5 GGBDRN Cc1nnc(COC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)n1C1CC1 ZINC000182612336 1430502448 /nfs/dbraw/zinc/50/24/48/1430502448.db2.gz TZEIHANMLBSIBS-UHFFFAOYSA-N 0 0 399.451 3.423 20 5 GGBDRN Cc1csc([C@H](C)CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)n1 ZINC000182615566 1430502888 /nfs/dbraw/zinc/50/28/88/1430502888.db2.gz GLOKUIBHMVJJRN-MRVPVSSYSA-N 0 0 378.410 3.418 20 5 GGBDRN C[C@H](CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)N1CCc2sccc2C1 ZINC000182631667 1430505845 /nfs/dbraw/zinc/50/58/45/1430505845.db2.gz IWCJHYQOLQFOAB-OLZOCXBDSA-N 0 0 391.468 3.462 20 5 GGBDRN C[C@H](C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2)c1ccc([N+](=O)[O-])cc1F ZINC000182638952 1430507498 /nfs/dbraw/zinc/50/74/98/1430507498.db2.gz XBRBEAUBQADHDQ-QMMMGPOBSA-N 0 0 393.758 3.460 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182642170 1430508241 /nfs/dbraw/zinc/50/82/41/1430508241.db2.gz BUTBOJXODXTRJZ-CABZTGNLSA-N 0 0 386.376 3.500 20 5 GGBDRN Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000182647066 1430509149 /nfs/dbraw/zinc/50/91/49/1430509149.db2.gz RFKBQRKDPORLPX-UHFFFAOYSA-N 0 0 392.481 3.206 20 5 GGBDRN O=C(NC1CC1)c1ccc(N2CCO[C@@H](CCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000182654468 1430511095 /nfs/dbraw/zinc/51/10/95/1430511095.db2.gz UQMRRVZIAREXGD-IBGZPJMESA-N 0 0 395.459 3.325 20 5 GGBDRN C[C@@H](C(=O)NCc1cccc(CN2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182667954 1430513515 /nfs/dbraw/zinc/51/35/15/1430513515.db2.gz FOMRDXRBXRDUIP-CQSZACIVSA-N 0 0 399.422 3.276 20 5 GGBDRN COCCOc1ccc(CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000182675970 1430515230 /nfs/dbraw/zinc/51/52/30/1430515230.db2.gz KMIGYRPYUKHXID-CYBMUJFWSA-N 0 0 376.384 3.179 20 5 GGBDRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000182676312 1430515336 /nfs/dbraw/zinc/51/53/36/1430515336.db2.gz UQTREZSLUQHWTN-LLVKDONJSA-N 0 0 393.852 3.484 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182676304 1430515613 /nfs/dbraw/zinc/51/56/13/1430515613.db2.gz WSDJCMYQXBBOFY-DFBGVHRSSA-N 0 0 382.363 3.274 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(Cc1ccco1)Cc1cccnc1 ZINC000182693176 1430518854 /nfs/dbraw/zinc/51/88/54/1430518854.db2.gz PBCWNJSIIBDZFP-UHFFFAOYSA-N 0 0 381.344 3.154 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC3(CO)CCCC3)cc2[N+](=O)[O-])C1 ZINC000182700348 1430520692 /nfs/dbraw/zinc/52/06/92/1430520692.db2.gz REDDGKYLNJJYEH-GASCZTMLSA-N 0 0 375.469 3.112 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NC3(CO)CCCC3)cc2[N+](=O)[O-])C1 ZINC000182700371 1430520860 /nfs/dbraw/zinc/52/08/60/1430520860.db2.gz REDDGKYLNJJYEH-GJZGRUSLSA-N 0 0 375.469 3.112 20 5 GGBDRN O=C(CCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccccc1 ZINC000182702406 1430521771 /nfs/dbraw/zinc/52/17/71/1430521771.db2.gz QJWXKFNXUQUJTJ-UHFFFAOYSA-N 0 0 393.852 3.485 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(NCc2ccc(Cl)c(C)c2)c([N+](=O)[O-])c1 ZINC000182713724 1430524600 /nfs/dbraw/zinc/52/46/00/1430524600.db2.gz YDLCLQMLLOGUFU-UHFFFAOYSA-N 0 0 391.811 3.072 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000182724059 1430527511 /nfs/dbraw/zinc/52/75/11/1430527511.db2.gz UKCKCQSLVRLYIX-NVXWUHKLSA-N 0 0 388.330 3.009 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N[C@H]1CCCOc2ccccc21 ZINC000182733832 1430529340 /nfs/dbraw/zinc/52/93/40/1430529340.db2.gz LNOLXIPMVCAAMH-AWEZNQCLSA-N 0 0 389.795 3.217 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)CN2CCc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000182785618 1430539672 /nfs/dbraw/zinc/53/96/72/1430539672.db2.gz BNCXDDIPMKVTLY-CQSZACIVSA-N 0 0 399.447 3.242 20 5 GGBDRN O=C(c1ccc(F)c(Cl)c1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000182789740 1430540150 /nfs/dbraw/zinc/54/01/50/1430540150.db2.gz YDPRDEHGAQKYKG-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN C[C@H](C(=O)Nc1cc(-n2cnnn2)ccc1Cl)c1ccc([N+](=O)[O-])cc1F ZINC000182789387 1430540158 /nfs/dbraw/zinc/54/01/58/1430540158.db2.gz DTIDJVBFHHHAPA-VIFPVBQESA-N 0 0 390.762 3.105 20 5 GGBDRN COc1cccc2c1CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000182789651 1430540373 /nfs/dbraw/zinc/54/03/73/1430540373.db2.gz TVRMYQHKCXJNBJ-UHFFFAOYSA-N 0 0 378.331 3.403 20 5 GGBDRN COc1cc(C)c([C@H](C)NC(=O)CN2CCc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000182791885 1430540651 /nfs/dbraw/zinc/54/06/51/1430540651.db2.gz FXXPHFFMOVXGDY-AWEZNQCLSA-N 0 0 399.447 3.160 20 5 GGBDRN COc1cc(C)c([C@@H](C)NC(=O)CN2CCc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000182791861 1430540658 /nfs/dbraw/zinc/54/06/58/1430540658.db2.gz FXXPHFFMOVXGDY-CQSZACIVSA-N 0 0 399.447 3.160 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000182792967 1430540896 /nfs/dbraw/zinc/54/08/96/1430540896.db2.gz DNROHPRIXBQFRX-UGSOOPFHSA-N 0 0 392.419 3.102 20 5 GGBDRN NC(=O)c1ccc(-c2nc(CN3CCc4ccc([N+](=O)[O-])cc43)cs2)cc1 ZINC000182793772 1430541066 /nfs/dbraw/zinc/54/10/66/1430541066.db2.gz ZXZGROJBSBXRNE-UHFFFAOYSA-N 0 0 380.429 3.380 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000182792929 1430541124 /nfs/dbraw/zinc/54/11/24/1430541124.db2.gz DNROHPRIXBQFRX-SCLBCKFNSA-N 0 0 392.419 3.102 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CCc2ccc([N+](=O)[O-])cc21 ZINC000182800546 1430542065 /nfs/dbraw/zinc/54/20/65/1430542065.db2.gz WWCKSHQLOVTHDY-UHFFFAOYSA-N 0 0 391.431 3.399 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)cc([N+](=O)[O-])c1 ZINC000182801086 1430542119 /nfs/dbraw/zinc/54/21/19/1430542119.db2.gz QLLSJJVNEIUQRD-ACJLOTCBSA-N 0 0 383.404 3.390 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182800630 1430542277 /nfs/dbraw/zinc/54/22/77/1430542277.db2.gz HZNIPZBEQCXVBS-UHFFFAOYSA-N 0 0 393.802 3.472 20 5 GGBDRN C[C@H](C(=O)N1CCC(CC(=O)N2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182802903 1430542635 /nfs/dbraw/zinc/54/26/35/1430542635.db2.gz RZQNMTDUDDCHDA-AWEZNQCLSA-N 0 0 391.443 3.089 20 5 GGBDRN COc1cc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)ccc1NC(C)=O ZINC000182823168 1430547184 /nfs/dbraw/zinc/54/71/84/1430547184.db2.gz FDDNARDERXFCBW-JTQLQIEISA-N 0 0 375.356 3.443 20 5 GGBDRN COc1cc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)ccc1NC(C)=O ZINC000182823186 1430547539 /nfs/dbraw/zinc/54/75/39/1430547539.db2.gz FDDNARDERXFCBW-SNVBAGLBSA-N 0 0 375.356 3.443 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000182825252 1430547875 /nfs/dbraw/zinc/54/78/75/1430547875.db2.gz RHJQTRWSJKUOGO-AUUYWEPGSA-N 0 0 377.404 3.399 20 5 GGBDRN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000182826010 1430548171 /nfs/dbraw/zinc/54/81/71/1430548171.db2.gz XSRVSPYBYWJQPV-KSSFIOAISA-N 0 0 377.404 3.399 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000182825954 1430548222 /nfs/dbraw/zinc/54/82/22/1430548222.db2.gz XSRVSPYBYWJQPV-RDTXWAMCSA-N 0 0 377.404 3.399 20 5 GGBDRN CC(C)(O)CN(Cc1ccccc1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000182830516 1430549009 /nfs/dbraw/zinc/54/90/09/1430549009.db2.gz UBODCYSJYKLSLE-UHFFFAOYSA-N 0 0 381.432 3.418 20 5 GGBDRN CC(C)(O)CN(Cc1ccccc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000182851551 1430553618 /nfs/dbraw/zinc/55/36/18/1430553618.db2.gz YDGRWEYJCVRTED-UHFFFAOYSA-N 0 0 394.431 3.194 20 5 GGBDRN Cc1ccc(NS(C)(=O)=O)c(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000182864505 1430556403 /nfs/dbraw/zinc/55/64/03/1430556403.db2.gz KFANKMXUYUKCGQ-NSHDSACASA-N 0 0 395.412 3.156 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000182868287 1430557154 /nfs/dbraw/zinc/55/71/54/1430557154.db2.gz BFUDYIMDSHGUNH-LLVKDONJSA-N 0 0 398.341 3.296 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182884070 1430561704 /nfs/dbraw/zinc/56/17/04/1430561704.db2.gz HOYFOFZUHGAWDP-LBPRGKRZSA-N 0 0 398.341 3.053 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc(F)cc1[N+](=O)[O-] ZINC000182886760 1430562309 /nfs/dbraw/zinc/56/23/09/1430562309.db2.gz RQAIJGMZVZIOOW-SNVBAGLBSA-N 0 0 396.781 3.117 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182901513 1430566622 /nfs/dbraw/zinc/56/66/22/1430566622.db2.gz XZWMCFAWCISWFG-NSHDSACASA-N 0 0 386.305 3.427 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182902393 1430567082 /nfs/dbraw/zinc/56/70/82/1430567082.db2.gz RKJBHIRQSUBESP-CQSZACIVSA-N 0 0 382.342 3.216 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000182905564 1430567716 /nfs/dbraw/zinc/56/77/16/1430567716.db2.gz GCGBBDKNJHXVBO-GFCCVEGCSA-N 0 0 393.802 3.161 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000182908553 1430568696 /nfs/dbraw/zinc/56/86/96/1430568696.db2.gz HPOCICLBPWMHCF-GFCCVEGCSA-N 0 0 393.802 3.405 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000182908572 1430568718 /nfs/dbraw/zinc/56/87/18/1430568718.db2.gz HPOCICLBPWMHCF-LBPRGKRZSA-N 0 0 393.802 3.405 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182912049 1430569142 /nfs/dbraw/zinc/56/91/42/1430569142.db2.gz UIRPQINLAIBSOR-LBPRGKRZSA-N 0 0 398.341 3.296 20 5 GGBDRN CN(Cc1cccc(Cl)c1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182918647 1430570902 /nfs/dbraw/zinc/57/09/02/1430570902.db2.gz UNMIHUIPEBRHIA-UHFFFAOYSA-N 0 0 389.839 3.357 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000182927900 1430573947 /nfs/dbraw/zinc/57/39/47/1430573947.db2.gz HGSPMEOITCQMJA-CYBMUJFWSA-N 0 0 377.803 3.325 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)c1nc[nH]n1 ZINC000182937492 1430576016 /nfs/dbraw/zinc/57/60/16/1430576016.db2.gz TVINYYXZZNXTKT-NSHDSACASA-N 0 0 375.454 3.486 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccccc1[N+](=O)[O-] ZINC000182954549 1430579998 /nfs/dbraw/zinc/57/99/98/1430579998.db2.gz AYZZGLCPWKIMLU-AWEZNQCLSA-N 0 0 394.214 3.437 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)o1 ZINC000182965924 1430582300 /nfs/dbraw/zinc/58/23/00/1430582300.db2.gz VRAHOPVQXRPUMJ-ZDUSSCGKSA-N 0 0 382.319 3.311 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NC1(Cc2ccccc2)CCCC1 ZINC000182969539 1430583111 /nfs/dbraw/zinc/58/31/11/1430583111.db2.gz QDCRMFITGIJNMD-UHFFFAOYSA-N 0 0 395.415 3.174 20 5 GGBDRN Cc1ccc(NC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000182981832 1430584930 /nfs/dbraw/zinc/58/49/30/1430584930.db2.gz GWTSNNOUUGIOQV-INIZCTEOSA-N 0 0 388.811 3.262 20 5 GGBDRN COc1ccc(C(=O)N(C)C)cc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000182990605 1430586954 /nfs/dbraw/zinc/58/69/54/1430586954.db2.gz UQNCLRATUBUNQQ-NSHDSACASA-N 0 0 389.383 3.187 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCO[C@H](CCc2ccccc2)C1 ZINC000182991990 1430587457 /nfs/dbraw/zinc/58/74/57/1430587457.db2.gz RPDGMYWZNRFIAR-LJQANCHMSA-N 0 0 399.447 3.147 20 5 GGBDRN CN1C(=O)CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000182999964 1430589145 /nfs/dbraw/zinc/58/91/45/1430589145.db2.gz ZBBYCHRNKGWDHP-UHFFFAOYSA-N 0 0 391.836 3.350 20 5 GGBDRN C[C@H](C(=O)NCc1ccc(CN2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000183007793 1430591679 /nfs/dbraw/zinc/59/16/79/1430591679.db2.gz VXDIOIXTVZFZRA-AWEZNQCLSA-N 0 0 399.422 3.276 20 5 GGBDRN Cc1c(NC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000183019986 1430594050 /nfs/dbraw/zinc/59/40/50/1430594050.db2.gz XNEXDEMBLSEEMU-INIZCTEOSA-N 0 0 388.811 3.262 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N(Cc1cccc(F)c1)C1CC1 ZINC000183032865 1430597079 /nfs/dbraw/zinc/59/70/79/1430597079.db2.gz NRTPQEUFTKTKEB-UHFFFAOYSA-N 0 0 399.422 3.375 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)Cc2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000183052987 1430600624 /nfs/dbraw/zinc/60/06/24/1430600624.db2.gz UVKMNHQWKOJOMN-UHFFFAOYSA-N 0 0 391.427 3.445 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000183054655 1430601153 /nfs/dbraw/zinc/60/11/53/1430601153.db2.gz HGOMPPMKRCMYRP-UHFFFAOYSA-N 0 0 377.400 3.103 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183057482 1430601564 /nfs/dbraw/zinc/60/15/64/1430601564.db2.gz DGVCCEVNXRATSW-UHFFFAOYSA-N 0 0 389.839 3.335 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)[C@@H](C)c2cc(F)ccc2F)ccc1[N+](=O)[O-] ZINC000183056930 1430601811 /nfs/dbraw/zinc/60/18/11/1430601811.db2.gz QLKUMFDLDLSBJJ-LBPRGKRZSA-N 0 0 391.374 3.131 20 5 GGBDRN CC(C)(NS(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000183073135 1430606423 /nfs/dbraw/zinc/60/64/23/1430606423.db2.gz YJBHEGVPWPVTEG-LIRRHRJNSA-N 0 0 394.493 3.145 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc3oc(C4CC4)nc3c2)ccc1[N+](=O)[O-] ZINC000183085270 1430609172 /nfs/dbraw/zinc/60/91/72/1430609172.db2.gz YFPPMRZALGSCAC-UHFFFAOYSA-N 0 0 394.387 3.290 20 5 GGBDRN COCc1nnc(-c2cccc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])c2)o1 ZINC000183093955 1430611358 /nfs/dbraw/zinc/61/13/58/1430611358.db2.gz BVIXTRWCOITIAS-UHFFFAOYSA-N 0 0 382.376 3.063 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183099701 1430612088 /nfs/dbraw/zinc/61/20/88/1430612088.db2.gz JHUWBYJCLQVHRX-GFCCVEGCSA-N 0 0 395.366 3.176 20 5 GGBDRN CC(C)(CNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccccc1 ZINC000183099945 1430612328 /nfs/dbraw/zinc/61/23/28/1430612328.db2.gz BUIYCLJWFMHZFA-UHFFFAOYSA-N 0 0 383.448 3.139 20 5 GGBDRN CCN(C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@H](C)c1cccc(OC)c1 ZINC000183110938 1430616776 /nfs/dbraw/zinc/61/67/76/1430616776.db2.gz GBLFZCQQHHOYOY-OAHLLOKOSA-N 0 0 399.447 3.251 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)cc1[N+](=O)[O-] ZINC000183116060 1430617896 /nfs/dbraw/zinc/61/78/96/1430617896.db2.gz YNCDRMRXKXXMHP-ZDUSSCGKSA-N 0 0 399.451 3.110 20 5 GGBDRN O=C(NCc1ccccc1-n1ccnc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183120823 1430619928 /nfs/dbraw/zinc/61/99/28/1430619928.db2.gz DTOGNTQRZYIZME-UHFFFAOYSA-N 0 0 388.330 3.312 20 5 GGBDRN CCCCOc1cccc(CNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000183133113 1430624231 /nfs/dbraw/zinc/62/42/31/1430624231.db2.gz AHGHMVKBYBORBM-UHFFFAOYSA-N 0 0 399.447 3.128 20 5 GGBDRN C[C@H](C(=O)NCC(=O)Nc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000183137065 1430625682 /nfs/dbraw/zinc/62/56/82/1430625682.db2.gz YADWUCVRXCDHJJ-JTQLQIEISA-N 0 0 379.775 3.246 20 5 GGBDRN Cc1ccnc(-n2nccc2NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000183137713 1430625699 /nfs/dbraw/zinc/62/56/99/1430625699.db2.gz SNMISTGWBZXAHS-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN C[S@](=O)C[C@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000183139862 1430626782 /nfs/dbraw/zinc/62/67/82/1430626782.db2.gz LWMQDZKUDWWXTG-MYUZEXMDSA-N 0 0 385.445 3.459 20 5 GGBDRN COc1ccc(NC(C)=O)c(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000183149192 1430629549 /nfs/dbraw/zinc/62/95/49/1430629549.db2.gz HJODGKBPVWSTLU-JTQLQIEISA-N 0 0 375.356 3.443 20 5 GGBDRN C[C@H](NC(=O)c1cn(-c2cccc(Cl)c2F)nn1)c1cccc([N+](=O)[O-])c1 ZINC000183175879 1430639269 /nfs/dbraw/zinc/63/92/69/1430639269.db2.gz AMROBVODKPKDNA-JTQLQIEISA-N 0 0 389.774 3.459 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccccc2OCC(C)C)ccc1[N+](=O)[O-] ZINC000183179071 1430640071 /nfs/dbraw/zinc/64/00/71/1430640071.db2.gz SCSGTWILSNRZKH-UHFFFAOYSA-N 0 0 385.420 3.307 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000183178519 1430640202 /nfs/dbraw/zinc/64/02/02/1430640202.db2.gz FCCJPLYFORLJFD-QMMMGPOBSA-N 0 0 385.346 3.416 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](CCc2ccccc2)C1 ZINC000183180764 1430640970 /nfs/dbraw/zinc/64/09/70/1430640970.db2.gz SRAZSYKNPIYLNW-HXUWFJFHSA-N 0 0 383.448 3.181 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](CCc2ccccc2)C1 ZINC000183180783 1430641053 /nfs/dbraw/zinc/64/10/53/1430641053.db2.gz SRAZSYKNPIYLNW-FQEVSTJZSA-N 0 0 383.448 3.181 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccnc(O[C@@H]2CCOC2)c1 ZINC000183196456 1430645067 /nfs/dbraw/zinc/64/50/67/1430645067.db2.gz OXLOCERTQGXSCA-GOSISDBHSA-N 0 0 385.420 3.208 20 5 GGBDRN CCCOc1ccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)c1 ZINC000183198522 1430645760 /nfs/dbraw/zinc/64/57/60/1430645760.db2.gz DFXDJQPLWMRGRW-UHFFFAOYSA-N 0 0 385.420 3.369 20 5 GGBDRN CCOc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1F ZINC000183199174 1430646110 /nfs/dbraw/zinc/64/61/10/1430646110.db2.gz BFMSQJYDYYPKCO-UHFFFAOYSA-N 0 0 389.383 3.222 20 5 GGBDRN Cc1nc(-c2ccc(CCNC(=O)c3cc([N+](=O)[O-])cnc3N)s2)cs1 ZINC000183211627 1430649777 /nfs/dbraw/zinc/64/97/77/1430649777.db2.gz JPDPWCTZWAQRMI-UHFFFAOYSA-N 0 0 389.462 3.038 20 5 GGBDRN COc1ccc([C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000183213696 1430649792 /nfs/dbraw/zinc/64/97/92/1430649792.db2.gz MUNSQZFQPWPFDH-INIZCTEOSA-N 0 0 383.326 3.435 20 5 GGBDRN Nc1c(C(=O)N[C@H](c2c(F)cccc2F)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000183217416 1430650557 /nfs/dbraw/zinc/65/05/57/1430650557.db2.gz OTPTYTITBOETIM-CYBMUJFWSA-N 0 0 375.253 3.489 20 5 GGBDRN Nc1c(C(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000183217398 1430650609 /nfs/dbraw/zinc/65/06/09/1430650609.db2.gz OTPTYTITBOETIM-ZDUSSCGKSA-N 0 0 375.253 3.489 20 5 GGBDRN COc1ccc(OCCCNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000183225359 1430652205 /nfs/dbraw/zinc/65/22/05/1430652205.db2.gz BGTQALGWJSIXKA-ZDUSSCGKSA-N 0 0 376.384 3.431 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1ccccc1 ZINC000183233591 1430654737 /nfs/dbraw/zinc/65/47/37/1430654737.db2.gz OIAWLHHHJQGBTA-MRXNPFEDSA-N 0 0 388.445 3.329 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@H]2CC(=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000183236641 1430655851 /nfs/dbraw/zinc/65/58/51/1430655851.db2.gz CNNZJEGOOXQIJE-INIZCTEOSA-N 0 0 388.445 3.329 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1ccccc1 ZINC000183236958 1430656539 /nfs/dbraw/zinc/65/65/39/1430656539.db2.gz SFMMKAMPGAQNIU-MRXNPFEDSA-N 0 0 388.445 3.329 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1cccs1 ZINC000183243742 1430657974 /nfs/dbraw/zinc/65/79/74/1430657974.db2.gz PVKMELAWHWBKKY-CYBMUJFWSA-N 0 0 394.474 3.391 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000183245685 1430658516 /nfs/dbraw/zinc/65/85/16/1430658516.db2.gz CQAZWRIHVKQHJM-OAHLLOKOSA-N 0 0 394.474 3.224 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@H]2CC(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000183245595 1430658540 /nfs/dbraw/zinc/65/85/40/1430658540.db2.gz PKENITDAIADQKI-ZDUSSCGKSA-N 0 0 394.474 3.391 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccs1 ZINC000183248410 1430659110 /nfs/dbraw/zinc/65/91/10/1430659110.db2.gz HNYDHEZOQPZVPF-LLVKDONJSA-N 0 0 398.437 3.222 20 5 GGBDRN COc1cc(CN(C)Cc2ncc(Cl)n2C)c([N+](=O)[O-])cc1OC(F)F ZINC000183251494 1430660005 /nfs/dbraw/zinc/66/00/05/1430660005.db2.gz FVTUPTKUWWWUHZ-UHFFFAOYSA-N 0 0 390.774 3.224 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000183252858 1430660570 /nfs/dbraw/zinc/66/05/70/1430660570.db2.gz XHASMHGXIFDURI-NWDGAFQWSA-N 0 0 389.383 3.450 20 5 GGBDRN O=C(Nc1n[nH]c(Cc2cccc(F)c2)n1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000183271026 1430666399 /nfs/dbraw/zinc/66/63/99/1430666399.db2.gz QQRYEKBFBQVKHH-UHFFFAOYSA-N 0 0 375.747 3.349 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@H](CCc2ccccc2)C1 ZINC000183285700 1430669829 /nfs/dbraw/zinc/66/98/29/1430669829.db2.gz XGJOGMCOKPKHHY-LJQANCHMSA-N 0 0 393.443 3.479 20 5 GGBDRN COc1ccc(Cl)c(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000183286424 1430670435 /nfs/dbraw/zinc/67/04/35/1430670435.db2.gz YAIRWWWVSURDJC-UHFFFAOYSA-N 0 0 391.811 3.346 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000183300074 1430672980 /nfs/dbraw/zinc/67/29/80/1430672980.db2.gz BCLMGWZYFRVOFJ-QMMMGPOBSA-N 0 0 385.346 3.044 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000183299936 1430673199 /nfs/dbraw/zinc/67/31/99/1430673199.db2.gz QKTCIJLZMBMMGE-SNVBAGLBSA-N 0 0 399.373 3.260 20 5 GGBDRN CC1(C)C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C(C)(C)O1 ZINC000183305597 1430674165 /nfs/dbraw/zinc/67/41/65/1430674165.db2.gz SDSOCWCBRDCOAG-LBPRGKRZSA-N 0 0 396.387 3.238 20 5 GGBDRN CC(=O)c1sc(NC(=O)c2cc([N+](=O)[O-])cnc2N)nc1-c1ccccc1 ZINC000183318187 1430677816 /nfs/dbraw/zinc/67/78/16/1430677816.db2.gz DNHNNHVUQIKHIP-UHFFFAOYSA-N 0 0 383.389 3.150 20 5 GGBDRN Cc1nc(CN(C)C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)no1 ZINC000183336478 1430682306 /nfs/dbraw/zinc/68/23/06/1430682306.db2.gz QZOJWVFXSSOBPI-BETUJISGSA-N 0 0 387.440 3.041 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(OC(C)C)cc2F)ccc1[N+](=O)[O-] ZINC000183352794 1430685806 /nfs/dbraw/zinc/68/58/06/1430685806.db2.gz HHYRZGLZRSGAJG-UHFFFAOYSA-N 0 0 389.383 3.198 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCCCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000183362805 1430689774 /nfs/dbraw/zinc/68/97/74/1430689774.db2.gz HPJFNWLZBGVOHI-UHFFFAOYSA-N 0 0 389.839 3.035 20 5 GGBDRN COc1ccc([C@@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000183382214 1430696171 /nfs/dbraw/zinc/69/61/71/1430696171.db2.gz LTIARJHEOYBCLH-MRXNPFEDSA-N 0 0 383.326 3.435 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCCOc2cc(F)ccc21 ZINC000183387142 1430697372 /nfs/dbraw/zinc/69/73/72/1430697372.db2.gz BMZPIYXRQXXDKT-HNNXBMFYSA-N 0 0 387.367 3.011 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC000183386455 1430697614 /nfs/dbraw/zinc/69/76/14/1430697614.db2.gz ZFHBDZVKHGBXGE-UHFFFAOYSA-N 0 0 382.348 3.351 20 5 GGBDRN Cc1ccc(C(C)(C)CNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000183404501 1430702847 /nfs/dbraw/zinc/70/28/47/1430702847.db2.gz MMQQWMZSJWHDTD-UHFFFAOYSA-N 0 0 383.448 3.035 20 5 GGBDRN O=C(Nc1ccc2scnc2c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183408423 1430703942 /nfs/dbraw/zinc/70/39/42/1430703942.db2.gz ILLUAMNZCYBIHR-UHFFFAOYSA-N 0 0 384.417 3.293 20 5 GGBDRN O=C(c1cc(OCC(F)F)ccn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000183410406 1430704339 /nfs/dbraw/zinc/70/43/39/1430704339.db2.gz QVJVFJNPYHVBEZ-UHFFFAOYSA-N 0 0 377.347 3.439 20 5 GGBDRN CCOCc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000183440342 1430712548 /nfs/dbraw/zinc/71/25/48/1430712548.db2.gz HXGALGDGZDMUEL-UHFFFAOYSA-N 0 0 385.420 3.220 20 5 GGBDRN CN(C[C@H]1CCCC[C@H]1O)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000183460481 1430717269 /nfs/dbraw/zinc/71/72/69/1430717269.db2.gz LTQDXXZIDOOUIN-CZUORRHYSA-N 0 0 375.450 3.341 20 5 GGBDRN Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183462629 1430717942 /nfs/dbraw/zinc/71/79/42/1430717942.db2.gz YIVNWMZFTOCBHA-CYBMUJFWSA-N 0 0 397.435 3.147 20 5 GGBDRN CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000183475108 1430720858 /nfs/dbraw/zinc/72/08/58/1430720858.db2.gz BYDABXTXDHYXMZ-CJNGLKHVSA-N 0 0 375.450 3.341 20 5 GGBDRN O=C(NCCC[C@@H]1CCCCO1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000183476134 1430721510 /nfs/dbraw/zinc/72/15/10/1430721510.db2.gz MKAKQUBAWHYBAK-KRWDZBQOSA-N 0 0 375.469 3.277 20 5 GGBDRN COc1cc(F)c([C@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1OC ZINC000183479241 1430722567 /nfs/dbraw/zinc/72/25/67/1430722567.db2.gz QHRORAOVXUUUFA-LBPRGKRZSA-N 0 0 391.399 3.349 20 5 GGBDRN CC(C)(C)[C@H]1CCc2nc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)sc2C1 ZINC000183481102 1430723316 /nfs/dbraw/zinc/72/33/16/1430723316.db2.gz RGFGOVBGJGGIMJ-NSHDSACASA-N 0 0 390.465 3.003 20 5 GGBDRN COc1cc(F)c([C@@H](C)NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000183490594 1430725994 /nfs/dbraw/zinc/72/59/94/1430725994.db2.gz SBEIQAZAMHJEEY-GFCCVEGCSA-N 0 0 391.399 3.065 20 5 GGBDRN Cc1noc(C)c1CSCC(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC000183494558 1430727419 /nfs/dbraw/zinc/72/74/19/1430727419.db2.gz DTEXTIHWHQAHRJ-UHFFFAOYSA-N 0 0 379.438 3.242 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2N2CCCCC2)cc1 ZINC000183504341 1430729992 /nfs/dbraw/zinc/72/99/92/1430729992.db2.gz BNLJSZHENONZRY-UHFFFAOYSA-N 0 0 375.450 3.064 20 5 GGBDRN O=C(CCc1ccc2[nH]ccc2c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000183505025 1430730138 /nfs/dbraw/zinc/73/01/38/1430730138.db2.gz AXGXUVLNHLPTDY-UHFFFAOYSA-N 0 0 378.432 3.358 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccccc1N1CCCCC1 ZINC000183507644 1430731161 /nfs/dbraw/zinc/73/11/61/1430731161.db2.gz PXRWDBBVXXVWIC-UHFFFAOYSA-N 0 0 375.450 3.064 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(Cc2cccc(F)c2)C2CC2)cc1 ZINC000183519449 1430734037 /nfs/dbraw/zinc/73/40/37/1430734037.db2.gz NABYGOLXIDRMIV-UHFFFAOYSA-N 0 0 378.425 3.271 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1CN1CCc2ccccc21 ZINC000183524995 1430734559 /nfs/dbraw/zinc/73/45/59/1430734559.db2.gz VZZSSGSQGKNJSS-UHFFFAOYSA-N 0 0 389.415 3.387 20 5 GGBDRN CC(C)Oc1ccccc1CNS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183525518 1430735044 /nfs/dbraw/zinc/73/50/44/1430735044.db2.gz UNHOAGLFKPQUFQ-UHFFFAOYSA-N 0 0 378.450 3.044 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1 ZINC000183534044 1430736831 /nfs/dbraw/zinc/73/68/31/1430736831.db2.gz UFSMRHNNOWFZDU-UHFFFAOYSA-N 0 0 392.297 3.029 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2CCOc3c(Cl)cccc32)cc1 ZINC000183535642 1430737145 /nfs/dbraw/zinc/73/71/45/1430737145.db2.gz YDROGIBEOXGYFN-MRXNPFEDSA-N 0 0 396.852 3.234 20 5 GGBDRN O=C(NCc1cccc(NC(=O)C2CCCC2)c1)Nc1ccncc1[N+](=O)[O-] ZINC000183549748 1430740615 /nfs/dbraw/zinc/74/06/15/1430740615.db2.gz OOOKZBBHGCREIP-UHFFFAOYSA-N 0 0 383.408 3.440 20 5 GGBDRN CCc1ccc([C@H](CN2CCOCC2)NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000183554861 1430741336 /nfs/dbraw/zinc/74/13/36/1430741336.db2.gz CPIGBMOZCZVGRY-NRFANRHFSA-N 0 0 399.491 3.329 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1c2ccccc2CC[C@H]1n1ccnc1 ZINC000183557431 1430741709 /nfs/dbraw/zinc/74/17/09/1430741709.db2.gz XRGYITMMBQCHJH-SJLPKXTDSA-N 0 0 378.392 3.237 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000183560033 1430742137 /nfs/dbraw/zinc/74/21/37/1430742137.db2.gz HTPRGIUKGHOZGI-ZFWWWQNUSA-N 0 0 380.763 3.434 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1 ZINC000183561352 1430742634 /nfs/dbraw/zinc/74/26/34/1430742634.db2.gz MECFOQGGEHKPSQ-UHFFFAOYSA-N 0 0 387.417 3.162 20 5 GGBDRN COCc1nnc(-c2cccc(C(=O)N3CCCc4ccc([N+](=O)[O-])cc43)c2)o1 ZINC000183563895 1430742792 /nfs/dbraw/zinc/74/27/92/1430742792.db2.gz JXYZEKVCPGLEFA-UHFFFAOYSA-N 0 0 394.387 3.384 20 5 GGBDRN COc1ccc([C@H](CCO)NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000183570636 1430743678 /nfs/dbraw/zinc/74/36/78/1430743678.db2.gz AXGOZACVUWZKJZ-XIKOKIGWSA-N 0 0 376.384 3.086 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)[C@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000183574422 1430744550 /nfs/dbraw/zinc/74/45/50/1430744550.db2.gz STSNLTPTANUWHT-FQEVSTJZSA-N 0 0 383.448 3.489 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)[C@@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000183574401 1430744708 /nfs/dbraw/zinc/74/47/08/1430744708.db2.gz STSNLTPTANUWHT-HXUWFJFHSA-N 0 0 383.448 3.489 20 5 GGBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)[C@@H]1CCc2ccccc2C1 ZINC000183583686 1430747047 /nfs/dbraw/zinc/74/70/47/1430747047.db2.gz RYURGENYXPQNHJ-GOSISDBHSA-N 0 0 395.459 3.061 20 5 GGBDRN C[C@@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1cccc(-n2cccn2)c1 ZINC000183584068 1430747560 /nfs/dbraw/zinc/74/75/60/1430747560.db2.gz VHBCBNIBAOPMCV-OAHLLOKOSA-N 0 0 391.431 3.020 20 5 GGBDRN CC(C)[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)CC1 ZINC000183588270 1430748756 /nfs/dbraw/zinc/74/87/56/1430748756.db2.gz NEQIGLMBYNZUHQ-MRXNPFEDSA-N 0 0 375.469 3.330 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183590570 1430749203 /nfs/dbraw/zinc/74/92/03/1430749203.db2.gz TUVYXCGQJFZCDD-UHFFFAOYSA-N 0 0 398.206 3.399 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000183600280 1430751113 /nfs/dbraw/zinc/75/11/13/1430751113.db2.gz SVQAAEBBUMJOOQ-SNVBAGLBSA-N 0 0 379.779 3.183 20 5 GGBDRN C[C@H](C(=O)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000183606974 1430753451 /nfs/dbraw/zinc/75/34/51/1430753451.db2.gz LVYHMCLQDIFCCE-WCQYABFASA-N 0 0 387.415 3.239 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)c(Cl)c2)C1 ZINC000183618496 1430755771 /nfs/dbraw/zinc/75/57/71/1430755771.db2.gz RTFHUDAHQIIRRC-HNNXBMFYSA-N 0 0 380.763 3.388 20 5 GGBDRN CC(C)(COc1ccc(C(F)(F)F)cn1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183626471 1430758051 /nfs/dbraw/zinc/75/80/51/1430758051.db2.gz IKIUDMODTZVJJV-UHFFFAOYSA-N 0 0 399.329 3.383 20 5 GGBDRN Cc1[nH]c2ccccc2c1CCNS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183635934 1430760026 /nfs/dbraw/zinc/76/00/26/1430760026.db2.gz WLOXAAFQPFVPBG-UHFFFAOYSA-N 0 0 387.461 3.089 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183641874 1430761619 /nfs/dbraw/zinc/76/16/19/1430761619.db2.gz GHYFTKDHSCTQRD-SFHVURJKSA-N 0 0 390.461 3.313 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000183643983 1430762042 /nfs/dbraw/zinc/76/20/42/1430762042.db2.gz QLDBPYUCVMILRL-PBHICJAKSA-N 0 0 399.422 3.177 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@H](C)[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000183644258 1430762457 /nfs/dbraw/zinc/76/24/57/1430762457.db2.gz DLLRGPJSKVHSBA-NUEKZKHPSA-N 0 0 391.468 3.375 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000183644224 1430762645 /nfs/dbraw/zinc/76/26/45/1430762645.db2.gz DLLRGPJSKVHSBA-IMJJTQAJSA-N 0 0 391.468 3.375 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@H](CO)C(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 ZINC000183651675 1430764020 /nfs/dbraw/zinc/76/40/20/1430764020.db2.gz LJICFZRNGKLGAP-FZKQIMNGSA-N 0 0 386.452 3.300 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183658959 1430765310 /nfs/dbraw/zinc/76/53/10/1430765310.db2.gz RQBMVLRKLRJBSF-KRWDZBQOSA-N 0 0 384.436 3.028 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C)(CO)CC2)CC1 ZINC000183660327 1430766005 /nfs/dbraw/zinc/76/60/05/1430766005.db2.gz MZJMYRNOMPDDOU-UHFFFAOYSA-N 0 0 375.469 3.066 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NC2(c3cccc(Cl)c3)CC2)ccc1[N+](=O)[O-] ZINC000183665708 1430767158 /nfs/dbraw/zinc/76/71/58/1430767158.db2.gz NLGXRUZPZOXZSV-UHFFFAOYSA-N 0 0 387.823 3.092 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cn(-c2ccccc2)nc1C ZINC000183689562 1430773549 /nfs/dbraw/zinc/77/35/49/1430773549.db2.gz SMNKWHWEOWSZPC-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN C[C@H](C(=O)N(C)CC(=O)Nc1cc(F)cc(F)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183689635 1430773807 /nfs/dbraw/zinc/77/38/07/1430773807.db2.gz YOGUCHGXPKNEKN-JTQLQIEISA-N 0 0 395.337 3.213 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000183693593 1430774585 /nfs/dbraw/zinc/77/45/85/1430774585.db2.gz QMBRBHGIGAOKAH-KRWDZBQOSA-N 0 0 383.379 3.438 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@H](C)C[C@H]2c2ccccc2F)ccc1[N+](=O)[O-] ZINC000183695570 1430774859 /nfs/dbraw/zinc/77/48/59/1430774859.db2.gz GVCPVIYIZNBAPL-YJYMSZOUSA-N 0 0 399.422 3.382 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000183706202 1430777890 /nfs/dbraw/zinc/77/78/90/1430777890.db2.gz IVMQLFXNEHROOL-QGZVFWFLSA-N 0 0 396.378 3.213 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000183706224 1430777944 /nfs/dbraw/zinc/77/79/44/1430777944.db2.gz IVMQLFXNEHROOL-KRWDZBQOSA-N 0 0 396.378 3.213 20 5 GGBDRN CC1(CO)CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000183714391 1430779495 /nfs/dbraw/zinc/77/94/95/1430779495.db2.gz YSMYGIDHTCCMNN-UHFFFAOYSA-N 0 0 389.374 3.037 20 5 GGBDRN CCOC(=O)c1c(C)[nH]c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000183746775 1430786026 /nfs/dbraw/zinc/78/60/26/1430786026.db2.gz NLHHTFHNBXSKPS-UHFFFAOYSA-N 0 0 379.800 3.300 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)c1ccc(OCC(F)(F)F)cc1 ZINC000183752375 1430786761 /nfs/dbraw/zinc/78/67/61/1430786761.db2.gz RBHDZJWGXMDUSB-VIFPVBQESA-N 0 0 384.314 3.004 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 ZINC000183754842 1430787049 /nfs/dbraw/zinc/78/70/49/1430787049.db2.gz IRXHXLGUEDOHOJ-YJBOKZPZSA-N 0 0 395.525 3.291 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 ZINC000183754824 1430787344 /nfs/dbraw/zinc/78/73/44/1430787344.db2.gz IRXHXLGUEDOHOJ-QAPCUYQASA-N 0 0 395.525 3.291 20 5 GGBDRN Cc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cccc1N1CCNC1=O ZINC000183755958 1430787487 /nfs/dbraw/zinc/78/74/87/1430787487.db2.gz QBRCTTWLWVKITG-UHFFFAOYSA-N 0 0 388.811 3.016 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H](C)c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000183760697 1430788451 /nfs/dbraw/zinc/78/84/51/1430788451.db2.gz DMHWDSFPZYMAIA-LLVKDONJSA-N 0 0 393.802 3.303 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000183765780 1430789447 /nfs/dbraw/zinc/78/94/47/1430789447.db2.gz DTFNNUSPUHYUIH-UHFFFAOYSA-N 0 0 396.852 3.360 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCc2c1cccc2F ZINC000183769474 1430790059 /nfs/dbraw/zinc/79/00/59/1430790059.db2.gz UDANCZLNTYTIFM-UHFFFAOYSA-N 0 0 385.351 3.011 20 5 GGBDRN COc1cc(CN(C)Cc2ncc(C)c(OC)c2C)c([N+](=O)[O-])cc1OC ZINC000183782839 1430792988 /nfs/dbraw/zinc/79/29/88/1430792988.db2.gz LEVSXKXECBBKGC-UHFFFAOYSA-N 0 0 375.425 3.264 20 5 GGBDRN COC(=O)[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)c(C)c1 ZINC000183804735 1430798345 /nfs/dbraw/zinc/79/83/45/1430798345.db2.gz FGVBXVDDQPCPQG-QGZVFWFLSA-N 0 0 394.786 3.269 20 5 GGBDRN COc1cc(CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)c([N+](=O)[O-])cc1F ZINC000183817658 1430800542 /nfs/dbraw/zinc/80/05/42/1430800542.db2.gz ABHMFYDNZAGKON-IBGZPJMESA-N 0 0 387.367 3.018 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCN([C@H](C)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000183835649 1430802921 /nfs/dbraw/zinc/80/29/21/1430802921.db2.gz CTHYVWQRNDOUNG-CQSZACIVSA-N 0 0 395.506 3.032 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCN([C@H](C)c2ccsc2)CC1 ZINC000183840706 1430803516 /nfs/dbraw/zinc/80/35/16/1430803516.db2.gz AXZPQXWKHQPHOK-CQSZACIVSA-N 0 0 395.506 3.032 20 5 GGBDRN C[C@@H](CCn1cccn1)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000183851842 1430804857 /nfs/dbraw/zinc/80/48/57/1430804857.db2.gz RQMCTYSUQVUHTI-INIZCTEOSA-N 0 0 375.428 3.373 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)nc1C ZINC000183856123 1430805547 /nfs/dbraw/zinc/80/55/47/1430805547.db2.gz NOPBLBCXTAREPK-SECBINFHSA-N 0 0 395.412 3.442 20 5 GGBDRN COc1cc(CN2C(=O)N[C@@](C)(CCC=C(C)C)C2=O)c([N+](=O)[O-])cc1F ZINC000183865923 1430806571 /nfs/dbraw/zinc/80/65/71/1430806571.db2.gz DGWXHRNSIHHNJG-SFHVURJKSA-N 0 0 379.388 3.299 20 5 GGBDRN CC(C)(C)OCc1cccc(CNc2cccc(S(N)(=O)=O)c2[N+](=O)[O-])c1 ZINC000183870982 1430806957 /nfs/dbraw/zinc/80/69/57/1430806957.db2.gz KGQOTAFJWRIKCB-UHFFFAOYSA-N 0 0 393.465 3.169 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1C[C@H](O)c1ccccc1 ZINC000183939300 1430815570 /nfs/dbraw/zinc/81/55/70/1430815570.db2.gz RHKSRXNYXWKQPC-QAPCUYQASA-N 0 0 384.436 3.081 20 5 GGBDRN CN(C)C(=O)CC1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000183963263 1430819689 /nfs/dbraw/zinc/81/96/89/1430819689.db2.gz CSNXQGQVVSBCJW-UHFFFAOYSA-N 0 0 399.900 3.057 20 5 GGBDRN COC(=O)COc1ccc([C@H](C)Nc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000183975572 1430821480 /nfs/dbraw/zinc/82/14/80/1430821480.db2.gz NSAMPEURMVDUHI-JTQLQIEISA-N 0 0 376.394 3.029 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@@]1(C)Cc1ccccc1 ZINC000184024112 1430830797 /nfs/dbraw/zinc/83/07/97/1430830797.db2.gz CVPMUQQYXZTQFL-AOMKIAJQSA-N 0 0 395.459 3.337 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@]1(C)Cc1ccccc1 ZINC000184024147 1430830816 /nfs/dbraw/zinc/83/08/16/1430830816.db2.gz CVPMUQQYXZTQFL-KSFYIVLOSA-N 0 0 395.459 3.337 20 5 GGBDRN CCc1nnnn1-c1ccccc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184032472 1430831824 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393.484 3.141 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@@H]2CC[C@@H](C)[C@H](C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000184065778 1430836701 /nfs/dbraw/zinc/83/67/01/1430836701.db2.gz KAHGZISQPSSEHR-UMVBOHGHSA-N 0 0 384.436 3.004 20 5 GGBDRN COCCn1c2ccccc2nc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000184073454 1430837580 /nfs/dbraw/zinc/83/75/80/1430837580.db2.gz HGVJMMGWVAFLNL-UHFFFAOYSA-N 0 0 395.419 3.418 20 5 GGBDRN Cc1cc(O)c(C(C)C)cc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000184093366 1430840124 /nfs/dbraw/zinc/84/01/24/1430840124.db2.gz ZVWOEWQSBBCJCE-UHFFFAOYSA-N 0 0 385.420 3.409 20 5 GGBDRN COCCn1c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)nc2ccccc21 ZINC000184097138 1430840684 /nfs/dbraw/zinc/84/06/84/1430840684.db2.gz IABOCRLWCQRPBZ-UHFFFAOYSA-N 0 0 388.811 3.426 20 5 GGBDRN CCOc1cc(C(=O)NC[C@H](C)c2ncc(C)s2)c([N+](=O)[O-])cc1OC ZINC000184102502 1430841375 /nfs/dbraw/zinc/84/13/75/1430841375.db2.gz KLXZCWMKYIFFCC-JTQLQIEISA-N 0 0 379.438 3.301 20 5 GGBDRN 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GGBDRN CN(C)C(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000185238854 1431091483 /nfs/dbraw/zinc/09/14/83/1431091483.db2.gz GSEJPXYWRGCYPW-UHFFFAOYSA-N 0 0 379.482 3.037 20 5 GGBDRN C[C@H](C(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185241482 1431091727 /nfs/dbraw/zinc/09/17/27/1431091727.db2.gz PYAXXUNMGCFYIA-UONOGXRCSA-N 0 0 393.459 3.238 20 5 GGBDRN COc1cccc(NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1[N+](=O)[O-] ZINC000185241926 1431092354 /nfs/dbraw/zinc/09/23/54/1431092354.db2.gz OYSLXDQQGVDZEM-UHFFFAOYSA-N 0 0 393.465 3.244 20 5 GGBDRN C[C@H](C(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185241512 1431092367 /nfs/dbraw/zinc/09/23/67/1431092367.db2.gz PYAXXUNMGCFYIA-KBPBESRZSA-N 0 0 393.459 3.238 20 5 GGBDRN CCc1c(C(=O)NCc2ccccc2[N+](=O)[O-])cnn1-c1ccc(OC)cc1 ZINC000185245203 1431092997 /nfs/dbraw/zinc/09/29/97/1431092997.db2.gz HRVMHUPNTBCZKB-UHFFFAOYSA-N 0 0 380.404 3.282 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 ZINC000185259844 1431095765 /nfs/dbraw/zinc/09/57/65/1431095765.db2.gz RJOQEBZFJMLROO-UHFFFAOYSA-N 0 0 383.408 3.343 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccnc1N1CCOCC1 ZINC000185264234 1431096594 /nfs/dbraw/zinc/09/65/94/1431096594.db2.gz IGHOYBKHGMKULU-INIZCTEOSA-N 0 0 384.436 3.034 20 5 GGBDRN C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC000185276182 1431097963 /nfs/dbraw/zinc/09/79/63/1431097963.db2.gz DJQUHIWRVVDDPS-ZFWWWQNUSA-N 0 0 390.440 3.116 20 5 GGBDRN C[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1nc(C2CCCCC2)no1 ZINC000185274979 1431098064 /nfs/dbraw/zinc/09/80/64/1431098064.db2.gz CJEJVSGWSULNMB-CYBMUJFWSA-N 0 0 387.440 3.339 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCNC(=O)CC1CCCCC1 ZINC000185294692 1431102672 /nfs/dbraw/zinc/10/26/72/1431102672.db2.gz YCBDXTKIXBBWJB-SFHVURJKSA-N 0 0 389.496 3.366 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)c1[N+](=O)[O-] ZINC000185300882 1431105517 /nfs/dbraw/zinc/10/55/17/1431105517.db2.gz AKSAJOCOEHBSBR-UHFFFAOYSA-N 0 0 393.802 3.358 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(-n2nnnc2C)c1 ZINC000185308685 1431108151 /nfs/dbraw/zinc/10/81/51/1431108151.db2.gz YBJKEPGNZFBACG-AWEZNQCLSA-N 0 0 398.398 3.225 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(-n2nnnc2C)c1 ZINC000185308700 1431108568 /nfs/dbraw/zinc/10/85/68/1431108568.db2.gz YBJKEPGNZFBACG-CQSZACIVSA-N 0 0 398.398 3.225 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1COc2c(cccc2OC)C1 ZINC000185322421 1431113899 /nfs/dbraw/zinc/11/38/99/1431113899.db2.gz GQKKXQMNJZEPET-WBVHZDCISA-N 0 0 384.432 3.292 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N[C@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])c1 ZINC000185336126 1431118630 /nfs/dbraw/zinc/11/86/30/1431118630.db2.gz YISDRWWAAIUAAZ-BZNIZROVSA-N 0 0 390.465 3.436 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCNC(=O)c1ccc(C)cc1 ZINC000185356420 1431124614 /nfs/dbraw/zinc/12/46/14/1431124614.db2.gz OVQUGXOONHEWEP-QGZVFWFLSA-N 0 0 383.448 3.018 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCNC(=O)c1ccc(C)cc1 ZINC000185356398 1431124872 /nfs/dbraw/zinc/12/48/72/1431124872.db2.gz OVQUGXOONHEWEP-KRWDZBQOSA-N 0 0 383.448 3.018 20 5 GGBDRN COc1ccc(COCCNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000185361677 1431126434 /nfs/dbraw/zinc/12/64/34/1431126434.db2.gz LNKFLBNOGKMJEA-ZDUSSCGKSA-N 0 0 376.384 3.179 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@@H](c1ncc(C)s1)C1CC1 ZINC000185371565 1431128459 /nfs/dbraw/zinc/12/84/59/1431128459.db2.gz NKIHNJNFHORUMO-MEDUHNTESA-N 0 0 390.465 3.436 20 5 GGBDRN Cn1nc(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c2ccccc21 ZINC000185374955 1431129084 /nfs/dbraw/zinc/12/90/84/1431129084.db2.gz OWXFVBSXRAYGGU-UHFFFAOYSA-N 0 0 387.827 3.177 20 5 GGBDRN C[C@H](N[C@@H](C)c1nc(Cc2ccccc2)no1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000185374335 1431129179 /nfs/dbraw/zinc/12/91/79/1431129179.db2.gz LBHUCDMXEDVAFX-KBPBESRZSA-N 0 0 395.419 3.246 20 5 GGBDRN Cc1oc2ccc(NC(=O)CN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)cc2c1C ZINC000185380172 1431130705 /nfs/dbraw/zinc/13/07/05/1431130705.db2.gz BAMXRHWCQOLKOC-UHFFFAOYSA-N 0 0 393.355 3.193 20 5 GGBDRN COc1ccc(OCCN[C@@H](C)c2nc(Cc3ccccc3)no2)c([N+](=O)[O-])c1 ZINC000185380631 1431130750 /nfs/dbraw/zinc/13/07/50/1431130750.db2.gz GPFSNIARQIQQBY-AWEZNQCLSA-N 0 0 398.419 3.307 20 5 GGBDRN CCOC(=O)[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(OC)c(F)c1 ZINC000185385624 1431132618 /nfs/dbraw/zinc/13/26/18/1431132618.db2.gz RDNFKPWJWNYVDT-KRWDZBQOSA-N 0 0 380.347 3.276 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000185387650 1431133566 /nfs/dbraw/zinc/13/35/66/1431133566.db2.gz GABXWYLUDLNJJZ-AWEZNQCLSA-N 0 0 395.419 3.166 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000185387667 1431133745 /nfs/dbraw/zinc/13/37/45/1431133745.db2.gz GABXWYLUDLNJJZ-CQSZACIVSA-N 0 0 395.419 3.166 20 5 GGBDRN CN1CCOc2ccc(NC(=O)NCc3ccc([N+](=O)[O-])cc3Cl)cc21 ZINC000185389058 1431133774 /nfs/dbraw/zinc/13/37/74/1431133774.db2.gz CBUMGKUDBFMWIP-UHFFFAOYSA-N 0 0 376.800 3.399 20 5 GGBDRN CCOC(=O)[C@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(OC)c(F)c1 ZINC000185390615 1431133980 /nfs/dbraw/zinc/13/39/80/1431133980.db2.gz KRMPBZREHSYTMY-GOSISDBHSA-N 0 0 376.384 3.445 20 5 GGBDRN CN(C)C(=O)c1cc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000185395217 1431135434 /nfs/dbraw/zinc/13/54/34/1431135434.db2.gz BDOXGHAXFMQOKN-UHFFFAOYSA-N 0 0 394.790 3.411 20 5 GGBDRN CN([C@H]1CCc2ccccc21)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185425176 1431142878 /nfs/dbraw/zinc/14/28/78/1431142878.db2.gz PEDMAVUFDMGXCP-INIZCTEOSA-N 0 0 383.429 3.451 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(=O)N(C)C)c1ccccc1 ZINC000185428413 1431143295 /nfs/dbraw/zinc/14/32/95/1431143295.db2.gz MSQLFTSLWDLPMI-QGZVFWFLSA-N 0 0 383.448 3.285 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(=O)N(C)C)c1ccccc1 ZINC000185428392 1431143338 /nfs/dbraw/zinc/14/33/38/1431143338.db2.gz MSQLFTSLWDLPMI-KRWDZBQOSA-N 0 0 383.448 3.285 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@@H](C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000185449626 1431147715 /nfs/dbraw/zinc/14/77/15/1431147715.db2.gz NVCNKZMKJBTFDT-CYBMUJFWSA-N 0 0 384.436 3.366 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)[C@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000185450101 1431148478 /nfs/dbraw/zinc/14/84/78/1431148478.db2.gz RZSUKHIJWLSUIU-HNNXBMFYSA-N 0 0 390.399 3.130 20 5 GGBDRN CC(=O)N1CCc2cc(C(=O)Nc3ccc([N+](=O)[O-])c4ncccc34)ccc21 ZINC000185454353 1431148965 /nfs/dbraw/zinc/14/89/65/1431148965.db2.gz DZPMPLVNGDXPJX-UHFFFAOYSA-N 0 0 376.372 3.304 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCC[C@H]([S@@](=O)CC)C1 ZINC000185451686 1431149147 /nfs/dbraw/zinc/14/91/47/1431149147.db2.gz DWJNOUZUIVJEGI-LGWGDHGKSA-N 0 0 380.510 3.360 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000185456735 1431149317 /nfs/dbraw/zinc/14/93/17/1431149317.db2.gz HXDCMZDYXIQWSY-AWEZNQCLSA-N 0 0 399.451 3.159 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cc1S(C)(=O)=O ZINC000185455885 1431149341 /nfs/dbraw/zinc/14/93/41/1431149341.db2.gz NSYOJRYGKLVFAN-UHFFFAOYSA-N 0 0 385.401 3.107 20 5 GGBDRN CCS(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cc1 ZINC000185457771 1431149510 /nfs/dbraw/zinc/14/95/10/1431149510.db2.gz FCVJAUGIYMYOGF-UHFFFAOYSA-N 0 0 385.401 3.189 20 5 GGBDRN O=C(CCCNC(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000185460972 1431150552 /nfs/dbraw/zinc/15/05/52/1431150552.db2.gz SGDIQYUZDAVFBY-UHFFFAOYSA-N 0 0 378.388 3.292 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCC[C@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000185484530 1431155130 /nfs/dbraw/zinc/15/51/30/1431155130.db2.gz KQFYZOVRCYWRTP-AWEZNQCLSA-N 0 0 397.431 3.264 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCN([C@H](C)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000185487304 1431155589 /nfs/dbraw/zinc/15/55/89/1431155589.db2.gz SMFWTBIRTYTVTF-CYBMUJFWSA-N 0 0 390.465 3.111 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000185499624 1431158662 /nfs/dbraw/zinc/15/86/62/1431158662.db2.gz ZIZMBZGFCYFUCX-SFHVURJKSA-N 0 0 399.382 3.387 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000185499608 1431158704 /nfs/dbraw/zinc/15/87/04/1431158704.db2.gz ZIZMBZGFCYFUCX-GOSISDBHSA-N 0 0 399.382 3.387 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(c2ncccc2F)C1 ZINC000185498819 1431158716 /nfs/dbraw/zinc/15/87/16/1431158716.db2.gz VWVPLWQADMGVIA-CVEARBPZSA-N 0 0 386.427 3.093 20 5 GGBDRN Cc1cc([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)c(C)o1 ZINC000185502833 1431159510 /nfs/dbraw/zinc/15/95/10/1431159510.db2.gz AYKFXWXDSJTGKW-LLVKDONJSA-N 0 0 375.406 3.392 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cccc3cccnc32)c2ncccc12 ZINC000185511008 1431161342 /nfs/dbraw/zinc/16/13/42/1431161342.db2.gz IUXLBTQTOQDMQK-UHFFFAOYSA-N 0 0 394.412 3.170 20 5 GGBDRN O=C(NCCc1ccc(OCC(F)(F)F)nc1)Nc1cccc([N+](=O)[O-])c1 ZINC000185519716 1431163244 /nfs/dbraw/zinc/16/32/44/1431163244.db2.gz ZTSXMIZYLKJNGU-UHFFFAOYSA-N 0 0 384.314 3.295 20 5 GGBDRN COc1cccc(N2CCCN(C(=O)Cc3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000185521957 1431163831 /nfs/dbraw/zinc/16/38/31/1431163831.db2.gz AFKDJKKQBVVKSK-UHFFFAOYSA-N 0 0 387.411 3.024 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)C(=O)NCC(C)(C)C ZINC000185529472 1431164904 /nfs/dbraw/zinc/16/49/04/1431164904.db2.gz XIPWXSGYPKDPKS-OAHLLOKOSA-N 0 0 377.485 3.221 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2cccc(F)c2O1 ZINC000185537104 1431166705 /nfs/dbraw/zinc/16/67/05/1431166705.db2.gz HBZZMHNYRFYZHS-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN C[C@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2cccc(F)c2O1 ZINC000185536482 1431166797 /nfs/dbraw/zinc/16/67/97/1431166797.db2.gz GJLULUZGBWTHJW-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)Nc1ccnn1Cc1ccccn1 ZINC000185539413 1431167219 /nfs/dbraw/zinc/16/72/19/1431167219.db2.gz PZDXPXOYKMHUAK-UHFFFAOYSA-N 0 0 386.799 3.210 20 5 GGBDRN CCOC(=O)CC[C@H]1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000185544254 1431168318 /nfs/dbraw/zinc/16/83/18/1431168318.db2.gz RATPRUYIKYQCFS-ZIAGYGMSSA-N 0 0 380.416 3.419 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(CN2CCOCC2)n1 ZINC000185553796 1431169800 /nfs/dbraw/zinc/16/98/00/1431169800.db2.gz UGKZYQCDHOCWFJ-QGZVFWFLSA-N 0 0 398.463 3.029 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCO[C@H](CCc2ccccc2)C1 ZINC000185570883 1431173072 /nfs/dbraw/zinc/17/30/72/1431173072.db2.gz BNIQPWAURFDDJP-GOSISDBHSA-N 0 0 384.432 3.224 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCC[C@@H](C(C)C)CC1 ZINC000185578888 1431175257 /nfs/dbraw/zinc/17/52/57/1431175257.db2.gz HOTVOFJRSNRRKQ-ZIAGYGMSSA-N 0 0 377.441 3.263 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cccc1[N+](=O)[O-] ZINC000185619801 1431186149 /nfs/dbraw/zinc/18/61/49/1431186149.db2.gz TWDSAHZUHJTRQD-GFCCVEGCSA-N 0 0 389.358 3.136 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cccc1[N+](=O)[O-] ZINC000185619784 1431186156 /nfs/dbraw/zinc/18/61/56/1431186156.db2.gz TWDSAHZUHJTRQD-LBPRGKRZSA-N 0 0 389.358 3.136 20 5 GGBDRN CCc1nc([C@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)cs1 ZINC000185625790 1431187742 /nfs/dbraw/zinc/18/77/42/1431187742.db2.gz KWDHXZNCRQLDFO-JTQLQIEISA-N 0 0 392.462 3.201 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000185632588 1431189589 /nfs/dbraw/zinc/18/95/89/1431189589.db2.gz MELNUZJBNFVYEO-APWZRJJASA-N 0 0 392.839 3.061 20 5 GGBDRN COc1ccc(Cl)cc1CNC(=O)COc1cc(C)c([N+](=O)[O-])cc1F ZINC000185646927 1431194588 /nfs/dbraw/zinc/19/45/88/1431194588.db2.gz WTHXGPXLEPMHKJ-UHFFFAOYSA-N 0 0 382.775 3.400 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2cccc(F)c2O1 ZINC000185647948 1431195199 /nfs/dbraw/zinc/19/51/99/1431195199.db2.gz SPZOTEMDNCXJPN-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN CCOCc1ccc(CNC(=O)COc2cc(C)c([N+](=O)[O-])cc2F)cc1 ZINC000185648624 1431195261 /nfs/dbraw/zinc/19/52/61/1431195261.db2.gz NKLBBEXUTPAQGW-UHFFFAOYSA-N 0 0 376.384 3.274 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@@H](C)c3nccs3)CC2)c1 ZINC000185663767 1431199560 /nfs/dbraw/zinc/19/95/60/1431199560.db2.gz HKJUHOIBCAJQNZ-LBPRGKRZSA-N 0 0 392.506 3.292 20 5 GGBDRN CN1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)c2ccccc21 ZINC000185667350 1431200568 /nfs/dbraw/zinc/20/05/68/1431200568.db2.gz MMOQOCFKVQCRDN-UHFFFAOYSA-N 0 0 398.444 3.178 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(CC(F)(F)F)c1ccncc1 ZINC000185681579 1431204521 /nfs/dbraw/zinc/20/45/21/1431204521.db2.gz HUAWFXDTRLWODQ-UHFFFAOYSA-N 0 0 389.355 3.364 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCS(=O)(=O)c2ccccc2C1 ZINC000185689686 1431206785 /nfs/dbraw/zinc/20/67/85/1431206785.db2.gz OOBFPSMUJUPDQS-UHFFFAOYSA-N 0 0 389.433 3.033 20 5 GGBDRN CC(C)(C)C(=O)N1CCC(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)CC1 ZINC000185689959 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381.417 3.021 20 5 GGBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185781897 1431234606 /nfs/dbraw/zinc/23/46/06/1431234606.db2.gz SKTZEXJHZBNQFJ-SJCJKPOMSA-N 0 0 396.852 3.399 20 5 GGBDRN CNC(=O)CCN(C)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000185791928 1431237184 /nfs/dbraw/zinc/23/71/84/1431237184.db2.gz YAZYAJSXTBCYJL-UHFFFAOYSA-N 0 0 379.482 3.085 20 5 GGBDRN CCCCOc1ccc(C(=O)NCC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000185797147 1431238381 /nfs/dbraw/zinc/23/83/81/1431238381.db2.gz OMNUEGFMDRHYBA-UHFFFAOYSA-N 0 0 397.431 3.093 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCSC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000185796472 1431238475 /nfs/dbraw/zinc/23/84/75/1431238475.db2.gz LYAAQYXPIMSLNK-AWEZNQCLSA-N 0 0 379.482 3.272 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(C(F)(F)F)CC2)c2ncccc12 ZINC000185798267 1431239043 /nfs/dbraw/zinc/23/90/43/1431239043.db2.gz GBZIVAXBEPSZCR-UHFFFAOYSA-N 0 0 389.355 3.106 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185802007 1431239624 /nfs/dbraw/zinc/23/96/24/1431239624.db2.gz NKCHSPHISJDCMM-CHWSQXEVSA-N 0 0 395.506 3.438 20 5 GGBDRN O=[N+]([O-])c1ccc(CCCCNS(=O)(=O)Cc2noc3ccccc23)cc1 ZINC000185834366 1431246806 /nfs/dbraw/zinc/24/68/06/1431246806.db2.gz RRTZTOIQRDTLBL-UHFFFAOYSA-N 0 0 389.433 3.178 20 5 GGBDRN CC(C)(C)c1cccc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1O ZINC000185842745 1431248974 /nfs/dbraw/zinc/24/89/74/1431248974.db2.gz DYONPKAVYBRWSP-UHFFFAOYSA-N 0 0 381.392 3.431 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(C)(C)C)c1O ZINC000185846363 1431250148 /nfs/dbraw/zinc/25/01/48/1431250148.db2.gz MBMREDLQIRWPNN-GFCCVEGCSA-N 0 0 385.420 3.355 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185850044 1431251335 /nfs/dbraw/zinc/25/13/35/1431251335.db2.gz ILBFAMWAOZTEKF-CQSZACIVSA-N 0 0 392.847 3.297 20 5 GGBDRN CC(C)c1csc(CNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)n1 ZINC000185857919 1431253446 /nfs/dbraw/zinc/25/34/46/1431253446.db2.gz KFWOPKRIGXQQQI-UHFFFAOYSA-N 0 0 392.462 3.201 20 5 GGBDRN CC(C)(C)c1cccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1O ZINC000185858697 1431254216 /nfs/dbraw/zinc/25/42/16/1431254216.db2.gz ICNOHLIYDSOIIN-UHFFFAOYSA-N 0 0 381.392 3.431 20 5 GGBDRN C[C@@H](CC(=O)c1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185862599 1431255530 /nfs/dbraw/zinc/25/55/30/1431255530.db2.gz YCAARVAUYDEVJU-ZDUSSCGKSA-N 0 0 399.428 3.083 20 5 GGBDRN Cn1nc(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000185868340 1431257356 /nfs/dbraw/zinc/25/73/56/1431257356.db2.gz ZHBHREFHBCHKAT-UHFFFAOYSA-N 0 0 381.436 3.259 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000185877648 1431260093 /nfs/dbraw/zinc/26/00/93/1431260093.db2.gz OGWVLFKNLGCFBL-CQSZACIVSA-N 0 0 380.326 3.472 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1c(C)noc1C ZINC000185878243 1431260215 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379.844 3.395 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000185891793 1431265938 /nfs/dbraw/zinc/26/59/38/1431265938.db2.gz KETXEAPPNZPIRB-IMJJTQAJSA-N 0 0 379.844 3.395 20 5 GGBDRN COc1ccc(COCCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000185898138 1431269476 /nfs/dbraw/zinc/26/94/76/1431269476.db2.gz FYUVIUXPCODBTK-UHFFFAOYSA-N 0 0 393.827 3.273 20 5 GGBDRN Cc1c(C(=O)N2CCC(O)(c3ccccc3)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000185903896 1431272325 /nfs/dbraw/zinc/27/23/25/1431272325.db2.gz OZVPMLLMSBDMPQ-UHFFFAOYSA-N 0 0 399.403 3.244 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC(O)(c2ccccc2)CC1 ZINC000185907447 1431274331 /nfs/dbraw/zinc/27/43/31/1431274331.db2.gz HJPBMEMOFNQASS-UHFFFAOYSA-N 0 0 379.416 3.129 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@@H](OCCCc3ccccc3)C2)c1 ZINC000185916656 1431278094 /nfs/dbraw/zinc/27/80/94/1431278094.db2.gz CPZJUHIUEGAAQU-GOSISDBHSA-N 0 0 390.461 3.007 20 5 GGBDRN CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000185937931 1431287022 /nfs/dbraw/zinc/28/70/22/1431287022.db2.gz SYNOIKMWNRIMFE-LBPRGKRZSA-N 0 0 394.371 3.136 20 5 GGBDRN CC[C@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000185951078 1431293435 /nfs/dbraw/zinc/29/34/35/1431293435.db2.gz JZOCYTWFKYRESA-JTQLQIEISA-N 0 0 388.371 3.410 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000185956347 1431295685 /nfs/dbraw/zinc/29/56/85/1431295685.db2.gz XPNXMVVVOSYXEA-MRXNPFEDSA-N 0 0 391.767 3.370 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2nn(-c3ccccc3)cc2C)cc([N+](=O)[O-])c1 ZINC000185955830 1431295695 /nfs/dbraw/zinc/29/56/95/1431295695.db2.gz SIJZBORKDLNRHM-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000185959381 1431297135 /nfs/dbraw/zinc/29/71/35/1431297135.db2.gz RDDFOVAIMBORBU-QGZVFWFLSA-N 0 0 376.796 3.227 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000185959021 1431297568 /nfs/dbraw/zinc/29/75/68/1431297568.db2.gz HUUNMRWZGIAUCB-KRWDZBQOSA-N 0 0 376.796 3.227 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000185964210 1431300034 /nfs/dbraw/zinc/30/00/34/1431300034.db2.gz XTFCEYVIZCNQNE-INIZCTEOSA-N 0 0 386.795 3.338 20 5 GGBDRN COCCOc1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c(Cl)c1 ZINC000185970973 1431301691 /nfs/dbraw/zinc/30/16/91/1431301691.db2.gz MJXNLQDBORSRQB-UHFFFAOYSA-N 0 0 376.796 3.476 20 5 GGBDRN COc1ccccc1[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000185975011 1431302730 /nfs/dbraw/zinc/30/27/30/1431302730.db2.gz WHWVHHUKZDOJFS-SFHVURJKSA-N 0 0 388.401 3.264 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN(C1CC1)S(=O)(=O)Cc1noc2ccccc21 ZINC000185980193 1431303995 /nfs/dbraw/zinc/30/39/95/1431303995.db2.gz OOFOFJWIQUUCCC-UHFFFAOYSA-N 0 0 387.417 3.230 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000185982949 1431304460 /nfs/dbraw/zinc/30/44/60/1431304460.db2.gz 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O=C(NCCCCNc1ccccn1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186007887 1431310357 /nfs/dbraw/zinc/31/03/57/1431310357.db2.gz IJNGNGNGJGPZFY-UHFFFAOYSA-N 0 0 377.832 3.335 20 5 GGBDRN CC(=O)Nc1ccc(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186011190 1431310993 /nfs/dbraw/zinc/31/09/93/1431310993.db2.gz WHNUNGSAFAGJJU-UHFFFAOYSA-N 0 0 390.827 3.249 20 5 GGBDRN O=C(CC1CCCCC1)NCCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186013182 1431311586 /nfs/dbraw/zinc/31/15/86/1431311586.db2.gz YDDJYRIHIQTELS-UHFFFAOYSA-N 0 0 396.875 3.134 20 5 GGBDRN CC(C)C[C@H]1OCCC[C@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000186014895 1431311978 /nfs/dbraw/zinc/31/19/78/1431311978.db2.gz SVAFUXYNUAXJPQ-GDBMZVCRSA-N 0 0 393.465 3.015 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000186015289 1431312061 /nfs/dbraw/zinc/31/20/61/1431312061.db2.gz DONYIQROEYHKDX-GFCCVEGCSA-N 0 0 379.804 3.029 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 ZINC000186018021 1431312457 /nfs/dbraw/zinc/31/24/57/1431312457.db2.gz SSOCULQFMXTRTE-HOTGVXAUSA-N 0 0 393.871 3.293 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@H](Cc2ccccc2)C1 ZINC000186019490 1431312798 /nfs/dbraw/zinc/31/27/98/1431312798.db2.gz SGIKEBBWQFKASX-QGZVFWFLSA-N 0 0 389.839 3.401 20 5 GGBDRN CC[C@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCN1CC(F)F ZINC000186019454 1431312923 /nfs/dbraw/zinc/31/29/23/1431312923.db2.gz HDJZFELMJYNWHS-LBPRGKRZSA-N 0 0 390.818 3.119 20 5 GGBDRN CC[C@@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCN1CC(F)F ZINC000186019440 1431312968 /nfs/dbraw/zinc/31/29/68/1431312968.db2.gz HDJZFELMJYNWHS-GFCCVEGCSA-N 0 0 390.818 3.119 20 5 GGBDRN NC(=O)C1(NC(=O)c2cccc(Sc3ccc(Cl)cc3)c2[N+](=O)[O-])CC1 ZINC000186027994 1431313633 /nfs/dbraw/zinc/31/36/33/1431313633.db2.gz MLOSYJCZZCQXKL-UHFFFAOYSA-N 0 0 391.836 3.147 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N2CCC(C(=O)C(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000186050274 1431319706 /nfs/dbraw/zinc/31/97/06/1431319706.db2.gz YVBCBHJZLIYCEY-LLVKDONJSA-N 0 0 387.358 3.074 20 5 GGBDRN CSc1cccc(C(=O)NCCc2cnn(-c3ccccc3)c2)c1[N+](=O)[O-] ZINC000186053879 1431320511 /nfs/dbraw/zinc/32/05/11/1431320511.db2.gz DFGFPSFGGXYHSR-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN COc1cc(C)c(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1F ZINC000186057853 1431321385 /nfs/dbraw/zinc/32/13/85/1431321385.db2.gz AUJFGCJJKFQCKZ-UHFFFAOYSA-N 0 0 385.355 3.192 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCO[C@H](CCc3ccccc3)C2)c2c(c1)COCO2 ZINC000186067914 1431323546 /nfs/dbraw/zinc/32/35/46/1431323546.db2.gz UFZHMRMBFLPNTC-HXUWFJFHSA-N 0 0 384.432 3.295 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1csc([N+](=O)[O-])c1 ZINC000186087523 1431327699 /nfs/dbraw/zinc/32/76/99/1431327699.db2.gz LSONEUBPARHNHI-LLVKDONJSA-N 0 0 399.350 3.210 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000186092364 1431328692 /nfs/dbraw/zinc/32/86/92/1431328692.db2.gz HBJQVMQIGKXXLY-CQSZACIVSA-N 0 0 393.321 3.149 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186102785 1431331260 /nfs/dbraw/zinc/33/12/60/1431331260.db2.gz NWRRDHNNKHDLGC-UHFFFAOYSA-N 0 0 394.313 3.094 20 5 GGBDRN CSc1cccc(-c2nc(-c3ccc(S(C)(=O)=O)cc3)no2)c1[N+](=O)[O-] ZINC000186106681 1431331517 /nfs/dbraw/zinc/33/15/17/1431331517.db2.gz USRQBTCBOQPOOR-UHFFFAOYSA-N 0 0 391.430 3.437 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(C(=O)c3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC000186144769 1431341122 /nfs/dbraw/zinc/34/11/22/1431341122.db2.gz NCWWYTUMACJVFL-UHFFFAOYSA-N 0 0 399.472 3.223 20 5 GGBDRN CSc1cccc(C(=O)NCc2cccc(N3CCCC3=O)c2)c1[N+](=O)[O-] ZINC000186144553 1431341318 /nfs/dbraw/zinc/34/13/18/1431341318.db2.gz TXLCMHYLMHBVNF-UHFFFAOYSA-N 0 0 385.445 3.374 20 5 GGBDRN CSc1cccc(C(=O)NCc2ccc(-n3nc(C)cc3C)nc2)c1[N+](=O)[O-] ZINC000186164563 1431345025 /nfs/dbraw/zinc/34/50/25/1431345025.db2.gz YXSBCWFBHQUEKP-UHFFFAOYSA-N 0 0 397.460 3.444 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@@H]1CCO[C@]2(CCOC2)C1 ZINC000186171794 1431346194 /nfs/dbraw/zinc/34/61/94/1431346194.db2.gz GIQRKNXCPJUGBM-WAIKUNEKSA-N 0 0 393.439 3.036 20 5 GGBDRN C[C@@H](C(=O)NCCc1nc2cc(F)ccc2n1C)c1ccc([N+](=O)[O-])cc1F ZINC000186184648 1431348270 /nfs/dbraw/zinc/34/82/70/1431348270.db2.gz NHTMCUMJTUENGS-LLVKDONJSA-N 0 0 388.374 3.222 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000186184059 1431348299 /nfs/dbraw/zinc/34/82/99/1431348299.db2.gz IAZAKZAWRGLTPG-ZIAGYGMSSA-N 0 0 389.431 3.416 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC(COc2ccccc2C(F)(F)F)CC1 ZINC000186190788 1431349369 /nfs/dbraw/zinc/34/93/69/1431349369.db2.gz TYPCECXDYJKCCG-UHFFFAOYSA-N 0 0 398.341 3.268 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC[C@]2(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000186213598 1431354098 /nfs/dbraw/zinc/35/40/98/1431354098.db2.gz CQDUZHBREYCSOA-JOCHJYFZSA-N 0 0 395.459 3.257 20 5 GGBDRN Cc1oc2ccccc2c1CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000186230061 1431357883 /nfs/dbraw/zinc/35/78/83/1431357883.db2.gz QSDTXMYEFGJMBW-UHFFFAOYSA-N 0 0 381.388 3.004 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000186242148 1431360503 /nfs/dbraw/zinc/36/05/03/1431360503.db2.gz NFMCDKACQXQLSR-QMMMGPOBSA-N 0 0 390.339 3.060 20 5 GGBDRN COC(=O)[C@H](C)Cc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000186243002 1431360645 /nfs/dbraw/zinc/36/06/45/1431360645.db2.gz VDONFHJDKBAKNO-CQSZACIVSA-N 0 0 385.420 3.387 20 5 GGBDRN C[C@@H](C(=O)NCCc1nc2c(cccc2F)n1C)c1ccc([N+](=O)[O-])cc1F ZINC000186254381 1431363985 /nfs/dbraw/zinc/36/39/85/1431363985.db2.gz YNXCNNSBZTZHIS-LLVKDONJSA-N 0 0 388.374 3.222 20 5 GGBDRN C[C@H](C(=O)NCCc1nc2c(cccc2F)n1C)c1ccc([N+](=O)[O-])cc1F ZINC000186254359 1431363991 /nfs/dbraw/zinc/36/39/91/1431363991.db2.gz YNXCNNSBZTZHIS-NSHDSACASA-N 0 0 388.374 3.222 20 5 GGBDRN C[C@@H](C(=O)Nc1n[nH]c(Cc2cccc(F)c2)n1)c1ccc([N+](=O)[O-])cc1F ZINC000186255842 1431364280 /nfs/dbraw/zinc/36/42/80/1431364280.db2.gz ZSRUJBNTJQWJRE-SNVBAGLBSA-N 0 0 387.346 3.324 20 5 GGBDRN CSc1cccc(C(=O)Nc2cccc(CN3CCOCC3)c2)c1[N+](=O)[O-] ZINC000186261937 1431365257 /nfs/dbraw/zinc/36/52/57/1431365257.db2.gz IUSHFJHPFHBDEE-UHFFFAOYSA-N 0 0 387.461 3.401 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)[C@@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000186293139 1431373525 /nfs/dbraw/zinc/37/35/25/1431373525.db2.gz LUSFWANQVUPBIQ-OAHLLOKOSA-N 0 0 380.397 3.051 20 5 GGBDRN COC(=O)c1ccc(CCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186307262 1431377901 /nfs/dbraw/zinc/37/79/01/1431377901.db2.gz PZAQTQYEZLTIBB-UHFFFAOYSA-N 0 0 376.796 3.284 20 5 GGBDRN Cc1cc(S(C)(=O)=O)cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000186313375 1431379387 /nfs/dbraw/zinc/37/93/87/1431379387.db2.gz XYZMOJQZQALRBE-UHFFFAOYSA-N 0 0 396.852 3.199 20 5 GGBDRN CCN(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)[C@H](C)Cc1ccsc1 ZINC000186313048 1431379560 /nfs/dbraw/zinc/37/95/60/1431379560.db2.gz ZVZFXTFIZQWJDG-CYBMUJFWSA-N 0 0 385.449 3.330 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(c3ccc(Cl)cn3)CC2)c1[N+](=O)[O-] ZINC000186315070 1431380041 /nfs/dbraw/zinc/38/00/41/1431380041.db2.gz YBUKFIASRPXFFE-UHFFFAOYSA-N 0 0 392.868 3.328 20 5 GGBDRN O=C(CC[C@@H]1Cc2ccccc2NC1=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186319231 1431380909 /nfs/dbraw/zinc/38/09/09/1431380909.db2.gz BAINWWOREYPMAV-CYBMUJFWSA-N 0 0 387.823 3.456 20 5 GGBDRN O=C(CCc1ccc2c(c1)OCCO2)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186322657 1431382337 /nfs/dbraw/zinc/38/23/37/1431382337.db2.gz GFIAYDXFHSHMBK-UHFFFAOYSA-N 0 0 376.796 3.268 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)c1[N+](=O)[O-] ZINC000186325573 1431383407 /nfs/dbraw/zinc/38/34/07/1431383407.db2.gz UAADDOMWDADDJT-CQSZACIVSA-N 0 0 396.806 3.277 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000186327983 1431383747 /nfs/dbraw/zinc/38/37/47/1431383747.db2.gz SXIWSUZQPGTARE-HNNXBMFYSA-N 0 0 379.775 3.183 20 5 GGBDRN CCN(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@H](C)Cc1ccsc1 ZINC000186327448 1431383874 /nfs/dbraw/zinc/38/38/74/1431383874.db2.gz KTCLKIKMQFEWGP-GFCCVEGCSA-N 0 0 396.490 3.153 20 5 GGBDRN Cc1nc(-c2cnn(C)c2)sc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186331799 1431385096 /nfs/dbraw/zinc/38/50/96/1431385096.db2.gz YFANNMOPHYMOSL-UHFFFAOYSA-N 0 0 391.840 3.344 20 5 GGBDRN COCC(=O)N1CCc2cc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000186331272 1431385108 /nfs/dbraw/zinc/38/51/08/1431385108.db2.gz UUFUPKBTSHEONT-UHFFFAOYSA-N 0 0 389.795 3.036 20 5 GGBDRN C[C@@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)NC(=O)c1ccccc1 ZINC000186340387 1431387210 /nfs/dbraw/zinc/38/72/10/1431387210.db2.gz CHNGPLRCNIWJHO-LBPRGKRZSA-N 0 0 375.812 3.073 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2 ZINC000186348287 1431389018 /nfs/dbraw/zinc/38/90/18/1431389018.db2.gz HRTUVEAFISIGDJ-GJZGRUSLSA-N 0 0 388.807 3.439 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186350353 1431389349 /nfs/dbraw/zinc/38/93/49/1431389349.db2.gz RCNKXDPZHXRWHC-TZMCWYRMSA-N 0 0 381.860 3.149 20 5 GGBDRN C[C@@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)NC(=O)C1CCCCC1 ZINC000186353116 1431390316 /nfs/dbraw/zinc/39/03/16/1431390316.db2.gz WFZIZODDGXQRLK-LBPRGKRZSA-N 0 0 381.860 3.340 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)[C@@H]1Oc1ccccc1 ZINC000186378427 1431396146 /nfs/dbraw/zinc/39/61/46/1431396146.db2.gz UEMBPMARUWJOPA-ZVDOUQERSA-N 0 0 384.432 3.269 20 5 GGBDRN Cc1c(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)cccc1[N+](=O)[O-] ZINC000186397683 1431400973 /nfs/dbraw/zinc/40/09/73/1431400973.db2.gz DHAGLJJQUNKCCG-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN NC(=O)c1ccc(N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000186401828 1431402508 /nfs/dbraw/zinc/40/25/08/1431402508.db2.gz ZDMNNHMJDNVOHD-LBPRGKRZSA-N 0 0 394.353 3.403 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(OC(F)F)c3cccnc23)c1[N+](=O)[O-] ZINC000186410976 1431407212 /nfs/dbraw/zinc/40/72/12/1431407212.db2.gz PRIDHQSPGIMWQP-UHFFFAOYSA-N 0 0 377.307 3.039 20 5 GGBDRN O=C(COc1ccccc1OC(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000186414632 1431409677 /nfs/dbraw/zinc/40/96/77/1431409677.db2.gz JPDGXSTUWBVQGA-UHFFFAOYSA-N 0 0 382.294 3.462 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000186424200 1431414045 /nfs/dbraw/zinc/41/40/45/1431414045.db2.gz KYOIWCFCXDMSOX-UHFFFAOYSA-N 0 0 376.359 3.305 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000186468142 1431427715 /nfs/dbraw/zinc/42/77/15/1431427715.db2.gz SKQHEOJYCIHNQZ-QGZVFWFLSA-N 0 0 377.347 3.156 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000186468127 1431427951 /nfs/dbraw/zinc/42/79/51/1431427951.db2.gz SKQHEOJYCIHNQZ-KRWDZBQOSA-N 0 0 377.347 3.156 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC1CCC(O)(c2cccnc2)CC1 ZINC000186498071 1431437175 /nfs/dbraw/zinc/43/71/75/1431437175.db2.gz FQSLWHGPKZRFTO-UHFFFAOYSA-N 0 0 398.463 3.129 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000186504053 1431439740 /nfs/dbraw/zinc/43/97/40/1431439740.db2.gz DHIGLWSIYQJFAW-SUMWQHHRSA-N 0 0 375.450 3.324 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2C[C@@H](OCc3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000186539985 1431449698 /nfs/dbraw/zinc/44/96/98/1431449698.db2.gz KRJTYKDIQZVEGZ-HZPDHXFCSA-N 0 0 386.452 3.384 20 5 GGBDRN COc1cc(C(=O)Nc2nc3cccc(Cl)c3n2C)c([N+](=O)[O-])cc1OC ZINC000186546443 1431450860 /nfs/dbraw/zinc/45/08/60/1431450860.db2.gz GSKIHXAFMCGRBZ-UHFFFAOYSA-N 0 0 390.783 3.404 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000186557505 1431453250 /nfs/dbraw/zinc/45/32/50/1431453250.db2.gz SGZJZYBWDHPLHF-UHFFFAOYSA-N 0 0 395.415 3.449 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2nc3cccc(Cl)c3n2C)cc([N+](=O)[O-])c1 ZINC000186557967 1431453264 /nfs/dbraw/zinc/45/32/64/1431453264.db2.gz OFVFEQVPVPBJCR-UHFFFAOYSA-N 0 0 388.767 3.174 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1 ZINC000186558845 1431454021 /nfs/dbraw/zinc/45/40/21/1431454021.db2.gz ONOJGFAHPVVKRI-UHFFFAOYSA-N 0 0 381.388 3.195 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000186570983 1431456791 /nfs/dbraw/zinc/45/67/91/1431456791.db2.gz CNUMBBICUMBPPA-HNNXBMFYSA-N 0 0 398.387 3.407 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])c1 ZINC000186600059 1431465200 /nfs/dbraw/zinc/46/52/00/1431465200.db2.gz GJGPSGYFGLSNKT-SPLOXXLWSA-N 0 0 397.431 3.062 20 5 GGBDRN CCc1c(C(=O)NCc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1OC ZINC000186646240 1431479351 /nfs/dbraw/zinc/47/93/51/1431479351.db2.gz VPJOWBLIJUIHOW-UHFFFAOYSA-N 0 0 380.404 3.282 20 5 GGBDRN CCOc1cc(C(=O)N[C@H]2CCCc3cc(N)ccc32)c([N+](=O)[O-])cc1OC ZINC000186653689 1431481961 /nfs/dbraw/zinc/48/19/61/1431481961.db2.gz JODGMYNVPZIKIG-INIZCTEOSA-N 0 0 385.420 3.392 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(C3CC3)c3ccc(F)cc32)c(F)c1 ZINC000186675726 1431489428 /nfs/dbraw/zinc/48/94/28/1431489428.db2.gz ZZGIZOPODJUVLS-UHFFFAOYSA-N 0 0 395.387 3.051 20 5 GGBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000186683799 1431491683 /nfs/dbraw/zinc/49/16/83/1431491683.db2.gz LBIMVJRVZWCFGR-GDBMZVCRSA-N 0 0 396.230 3.214 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@@]4(C3)OCc3ccccc34)n2)cc1 ZINC000186697092 1431494966 /nfs/dbraw/zinc/49/49/66/1431494966.db2.gz XTVAKYBLBTXARL-FQEVSTJZSA-N 0 0 378.388 3.276 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@H](O)[C@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000186709403 1431497601 /nfs/dbraw/zinc/49/76/01/1431497601.db2.gz STZXVLKKVGKWJI-TYILLQQXSA-N 0 0 384.436 3.006 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CC[C@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000186716957 1431500153 /nfs/dbraw/zinc/50/01/53/1431500153.db2.gz SPQBPBCFMKCQHH-YCRPNKLZSA-N 0 0 381.432 3.362 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000186724484 1431502418 /nfs/dbraw/zinc/50/24/18/1431502418.db2.gz LBWLEHYBKUCERW-BMIGLBTASA-N 0 0 391.346 3.062 20 5 GGBDRN Cc1ccc(NC(=O)NC(=O)COc2cc(C)c([N+](=O)[O-])cc2F)c(C)c1 ZINC000186730176 1431503798 /nfs/dbraw/zinc/50/37/98/1431503798.db2.gz ZCAVODXJNRDMED-UHFFFAOYSA-N 0 0 375.356 3.386 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000186731242 1431504372 /nfs/dbraw/zinc/50/43/72/1431504372.db2.gz PJKOCWXFSZBHQZ-UHFFFAOYSA-N 0 0 395.337 3.490 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)c1[N+](=O)[O-] ZINC000186737170 1431505693 /nfs/dbraw/zinc/50/56/93/1431505693.db2.gz TULXFIOOBUNVLF-UHFFFAOYSA-N 0 0 397.357 3.401 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)c1[N+](=O)[O-] ZINC000186743166 1431506678 /nfs/dbraw/zinc/50/66/78/1431506678.db2.gz OFOPRMZQXGPUSZ-UHFFFAOYSA-N 0 0 382.342 3.361 20 5 GGBDRN CN(CC1(c2ccccc2)CC1)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000186769978 1431512464 /nfs/dbraw/zinc/51/24/64/1431512464.db2.gz CVWBXYOFCJXWHW-UHFFFAOYSA-N 0 0 377.400 3.240 20 5 GGBDRN Cn1c2ccccc2nc1C(C)(C)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000186784915 1431515951 /nfs/dbraw/zinc/51/59/51/1431515951.db2.gz HKGHKEOZRLRGPV-UHFFFAOYSA-N 0 0 382.420 3.302 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000186791322 1431517392 /nfs/dbraw/zinc/51/73/92/1431517392.db2.gz NXQCAJXHSWKXDX-QGZVFWFLSA-N 0 0 393.346 3.487 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)Nc2ccc3oc(C)c(C)c3c2)cc1[N+](=O)[O-] ZINC000186794445 1431518242 /nfs/dbraw/zinc/51/82/42/1431518242.db2.gz PSNMYWMMWHMEIH-UHFFFAOYSA-N 0 0 397.387 3.335 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCSC2(CCOCC2)C1 ZINC000186815988 1431525971 /nfs/dbraw/zinc/52/59/71/1431525971.db2.gz CVQQFYGKKYCBGE-LBPRGKRZSA-N 0 0 399.900 3.173 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC(C)(C)c1cccc(Cl)c1F ZINC000186816992 1431526255 /nfs/dbraw/zinc/52/62/55/1431526255.db2.gz BUGXUWUNVKNLFY-UHFFFAOYSA-N 0 0 382.823 3.376 20 5 GGBDRN Cc1cc(CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)ccc1-c1ccccc1 ZINC000186820043 1431527686 /nfs/dbraw/zinc/52/76/86/1431527686.db2.gz OFJAYYHKUXRNOK-UHFFFAOYSA-N 0 0 377.400 3.048 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCN(C2CC2)c2ccccc21 ZINC000186828318 1431530399 /nfs/dbraw/zinc/53/03/99/1431530399.db2.gz ZEKMSWIZXRVBHG-UHFFFAOYSA-N 0 0 389.415 3.410 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000186829047 1431530821 /nfs/dbraw/zinc/53/08/21/1431530821.db2.gz BGDBIQDAAURTRZ-UHFFFAOYSA-N 0 0 379.388 3.031 20 5 GGBDRN COc1cc(C)c(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1F ZINC000186834509 1431532561 /nfs/dbraw/zinc/53/25/61/1431532561.db2.gz GQSDUJHLIVKDLG-UHFFFAOYSA-N 0 0 395.774 3.073 20 5 GGBDRN Cn1cc([C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000186848479 1431539023 /nfs/dbraw/zinc/53/90/23/1431539023.db2.gz PBCDJARDCWTTHH-HXUWFJFHSA-N 0 0 398.394 3.142 20 5 GGBDRN CSc1cccc(C(=O)N[C@](C)(C(N)=O)c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000186864157 1431545025 /nfs/dbraw/zinc/54/50/25/1431545025.db2.gz YAQQEYMYMSVIGM-KRWDZBQOSA-N 0 0 393.852 3.101 20 5 GGBDRN Nc1c(C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000186868699 1431547125 /nfs/dbraw/zinc/54/71/25/1431547125.db2.gz MDACBHLLNQGUCQ-LLVKDONJSA-N 0 0 391.811 3.498 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186897542 1431558422 /nfs/dbraw/zinc/55/84/22/1431558422.db2.gz KBRKRDPVDBRMBI-JOCHJYFZSA-N 0 0 393.443 3.467 20 5 GGBDRN Cc1ccc(Cc2cnc(NC(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)s2)cc1F ZINC000186902713 1431560274 /nfs/dbraw/zinc/56/02/74/1431560274.db2.gz ZJTUDPWHBSEZQH-UHFFFAOYSA-N 0 0 388.380 3.443 20 5 GGBDRN CSc1cccc(C(=O)NCc2cccnc2OCC(F)F)c1[N+](=O)[O-] ZINC000186908606 1431562278 /nfs/dbraw/zinc/56/22/78/1431562278.db2.gz MZBIFRUZEVWGEH-UHFFFAOYSA-N 0 0 383.376 3.286 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186916494 1431564603 /nfs/dbraw/zinc/56/46/03/1431564603.db2.gz STHWOMMNFCLHED-NRFANRHFSA-N 0 0 379.416 3.441 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C(=O)OC)c1ccsc1 ZINC000186916446 1431564621 /nfs/dbraw/zinc/56/46/21/1431564621.db2.gz GFVDRBYVTVKIBX-CJNGLKHVSA-N 0 0 376.434 3.256 20 5 GGBDRN COc1ccc(NC(=O)CN2CCC(c3ccsc3)CC2)c([N+](=O)[O-])c1 ZINC000186939518 1431571911 /nfs/dbraw/zinc/57/19/11/1431571911.db2.gz AOXSMJWHHVZAAZ-UHFFFAOYSA-N 0 0 375.450 3.483 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186947871 1431574247 /nfs/dbraw/zinc/57/42/47/1431574247.db2.gz CXUABEYJAWHBHR-NRFANRHFSA-N 0 0 390.399 3.052 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)n2)cc1 ZINC000186949184 1431574591 /nfs/dbraw/zinc/57/45/91/1431574591.db2.gz IYGDEOHLMJKOBV-UHFFFAOYSA-N 0 0 380.404 3.338 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000186950368 1431575013 /nfs/dbraw/zinc/57/50/13/1431575013.db2.gz CINDQZPJVSJYGY-HXUWFJFHSA-N 0 0 389.411 3.227 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3OC)n2)cc1 ZINC000186962019 1431577945 /nfs/dbraw/zinc/57/79/45/1431577945.db2.gz JINDBWKPJWIWOT-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(C)c(C)c1 ZINC000186984865 1431582925 /nfs/dbraw/zinc/58/29/25/1431582925.db2.gz NVMPKGHLADULIQ-SCLBCKFNSA-N 0 0 388.395 3.485 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](c2ncccc2C)C(C)C)cc1[N+](=O)[O-] ZINC000187006317 1431587592 /nfs/dbraw/zinc/58/75/92/1431587592.db2.gz YHECEWRHAAHZHB-OAHLLOKOSA-N 0 0 397.428 3.122 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000187005536 1431587650 /nfs/dbraw/zinc/58/76/50/1431587650.db2.gz LVSJNQTXJWCZDR-UHFFFAOYSA-N 0 0 395.415 3.302 20 5 GGBDRN Cc1nn(-c2ccccc2C)c(C)c1CN(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187009058 1431588429 /nfs/dbraw/zinc/58/84/29/1431588429.db2.gz BIEVIWWLOMVVIY-UHFFFAOYSA-N 0 0 395.419 3.079 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000187009515 1431588483 /nfs/dbraw/zinc/58/84/83/1431588483.db2.gz BRHYPXXEPUMDHV-OAQYLSRUSA-N 0 0 390.399 3.052 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1cc(C)cc(C)c1 ZINC000187026049 1431593659 /nfs/dbraw/zinc/59/36/59/1431593659.db2.gz XMWBRCVPXOWWCY-ACJLOTCBSA-N 0 0 388.395 3.485 20 5 GGBDRN COC(=O)[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cc(C)cc(C)c1 ZINC000187040656 1431598002 /nfs/dbraw/zinc/59/80/02/1431598002.db2.gz ZZRRYBDMVUVXSW-HXUWFJFHSA-N 0 0 395.415 3.266 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCSC[C@H]3c3nccs3)n2)c1 ZINC000187053750 1431600376 /nfs/dbraw/zinc/60/03/76/1431600376.db2.gz UJQWPFDQWHCNBB-ZDUSSCGKSA-N 0 0 389.462 3.391 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCSC[C@@H]1c1nccs1 ZINC000187063652 1431603314 /nfs/dbraw/zinc/60/33/14/1431603314.db2.gz ZXAZONDCUYNWBQ-OAHLLOKOSA-N 0 0 392.506 3.478 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-])c1ccccn1 ZINC000187065555 1431603874 /nfs/dbraw/zinc/60/38/74/1431603874.db2.gz KTOJEUGWRWZWKE-OMWUSAIZSA-N 0 0 384.436 3.196 20 5 GGBDRN CC[C@@]1(CO)CCCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000187068207 1431604483 /nfs/dbraw/zinc/60/44/83/1431604483.db2.gz ZWUBBDDRBGTXQY-HSZRJFAPSA-N 0 0 378.472 3.166 20 5 GGBDRN CSc1cccc(C(=O)N2CCN([C@@H](C)c3nccs3)CC2)c1[N+](=O)[O-] ZINC000187085648 1431609877 /nfs/dbraw/zinc/60/98/77/1431609877.db2.gz KPQQHGACTBFIDL-LBPRGKRZSA-N 0 0 392.506 3.292 20 5 GGBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000187099189 1431614926 /nfs/dbraw/zinc/61/49/26/1431614926.db2.gz XIMVIDADMXRQSC-MEDUHNTESA-N 0 0 375.812 3.433 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c1[N+](=O)[O-] ZINC000187144710 1431629736 /nfs/dbraw/zinc/62/97/36/1431629736.db2.gz VZISOSJNXXYKJE-UHFFFAOYSA-N 0 0 397.435 3.212 20 5 GGBDRN Cc1cccc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)c1[N+](=O)[O-] ZINC000187154099 1431632688 /nfs/dbraw/zinc/63/26/88/1431632688.db2.gz JFNZEWZUXLVCGI-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN O=C(c1c[nH]nc1-c1ccsc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000187161072 1431634230 /nfs/dbraw/zinc/63/42/30/1431634230.db2.gz HZXWBLYMHKNHSK-UHFFFAOYSA-N 0 0 383.433 3.009 20 5 GGBDRN CC[C@@]1(CO)CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000187194927 1431643544 /nfs/dbraw/zinc/64/35/44/1431643544.db2.gz YNAXMNHFRJMEBR-HXUWFJFHSA-N 0 0 375.469 3.210 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc2nnc(C3CCC3)n2c1 ZINC000187204167 1431647097 /nfs/dbraw/zinc/64/70/97/1431647097.db2.gz ARBRVNSMMYPDAH-UHFFFAOYSA-N 0 0 381.392 3.313 20 5 GGBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000187212282 1431650464 /nfs/dbraw/zinc/65/04/64/1431650464.db2.gz XNERTOZVYHNJDM-UHFFFAOYSA-N 0 0 384.367 3.305 20 5 GGBDRN COC(=O)C[C@@](C)(NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccn1 ZINC000187221751 1431654046 /nfs/dbraw/zinc/65/40/46/1431654046.db2.gz BVQLIISURWPJOF-LJQANCHMSA-N 0 0 399.428 3.413 20 5 GGBDRN COC(=O)C[C@](C)(NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccn1 ZINC000187221770 1431654160 /nfs/dbraw/zinc/65/41/60/1431654160.db2.gz BVQLIISURWPJOF-IBGZPJMESA-N 0 0 399.428 3.413 20 5 GGBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000187222217 1431654356 /nfs/dbraw/zinc/65/43/56/1431654356.db2.gz XQZHYUFIAPSSQW-UHFFFAOYSA-N 0 0 384.367 3.305 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000187226675 1431655592 /nfs/dbraw/zinc/65/55/92/1431655592.db2.gz MDYOJJVYVRKVTP-UHFFFAOYSA-N 0 0 395.459 3.245 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000187262055 1431671334 /nfs/dbraw/zinc/67/13/34/1431671334.db2.gz HQMQUVRQSQDVNQ-SFHVURJKSA-N 0 0 391.374 3.193 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000187269060 1431674988 /nfs/dbraw/zinc/67/49/88/1431674988.db2.gz HOOYUQIGCHOBLQ-UHFFFAOYSA-N 0 0 397.431 3.443 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCCCc3ccccc32)cc1[N+](=O)[O-] ZINC000187271382 1431676005 /nfs/dbraw/zinc/67/60/05/1431676005.db2.gz QFLAJTRHUUCGKN-UHFFFAOYSA-N 0 0 380.397 3.274 20 5 GGBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000187284172 1431681346 /nfs/dbraw/zinc/68/13/46/1431681346.db2.gz HPIYRXUYPCRYAC-XIKOKIGWSA-N 0 0 391.374 3.274 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000187288001 1431682553 /nfs/dbraw/zinc/68/25/53/1431682553.db2.gz VHBMCXDURIKDPG-SFHVURJKSA-N 0 0 391.374 3.193 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)Cc2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000187287069 1431682636 /nfs/dbraw/zinc/68/26/36/1431682636.db2.gz JYTGGUYNYGLLHB-UHFFFAOYSA-N 0 0 394.380 3.309 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](C)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000187290917 1431683912 /nfs/dbraw/zinc/68/39/12/1431683912.db2.gz DFCDIYFOGOHLMI-VXGBXAGGSA-N 0 0 382.413 3.213 20 5 GGBDRN Cc1ccc(SC[C@@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000187316597 1431694432 /nfs/dbraw/zinc/69/44/32/1431694432.db2.gz YNNJLOGHNIXWMC-CYBMUJFWSA-N 0 0 387.461 3.447 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCN(C2CC2)c2ccc(Cl)cc21 ZINC000187354022 1431706435 /nfs/dbraw/zinc/70/64/35/1431706435.db2.gz MTTGGGLGTYZTBT-UHFFFAOYSA-N 0 0 389.843 3.159 20 5 GGBDRN Cc1ccc2cc(CN3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)ccc2n1 ZINC000187355071 1431707174 /nfs/dbraw/zinc/70/71/74/1431707174.db2.gz YTVRRSIJGMOHQQ-UHFFFAOYSA-N 0 0 390.443 3.409 20 5 GGBDRN CCN(C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)[C@H](C)Cc1ccsc1 ZINC000187363422 1431708788 /nfs/dbraw/zinc/70/87/88/1431708788.db2.gz FVZGKWKOYOIUJL-ZIAGYGMSSA-N 0 0 389.477 3.254 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CCCC[C@@H]3O)cc2[N+](=O)[O-])C1 ZINC000187413036 1431722934 /nfs/dbraw/zinc/72/29/34/1431722934.db2.gz NNCKTIDIKWJYQY-PWDMQXDWSA-N 0 0 375.469 3.110 20 5 GGBDRN CC[C@@H]1[C@H](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1I ZINC000187426724 1431726448 /nfs/dbraw/zinc/72/64/48/1431726448.db2.gz JIQKINXJBSVCLY-NOZJJQNGSA-N 0 0 388.205 3.460 20 5 GGBDRN C[C@H](C(=O)Nc1cc2c(cc1F)NC(=O)CC2)c1ccc([N+](=O)[O-])cc1F ZINC000187431255 1431727562 /nfs/dbraw/zinc/72/75/62/1431727562.db2.gz FQLPBYJMSJCYJP-VIFPVBQESA-N 0 0 375.331 3.500 20 5 GGBDRN Cc1cnccc1CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000187449866 1431733692 /nfs/dbraw/zinc/73/36/92/1431733692.db2.gz VTARMFQRNSFIBL-UHFFFAOYSA-N 0 0 382.342 3.435 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000187462036 1431738057 /nfs/dbraw/zinc/73/80/57/1431738057.db2.gz NVMWFNUEPJKWHS-SNVBAGLBSA-N 0 0 377.303 3.411 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000187462056 1431738195 /nfs/dbraw/zinc/73/81/95/1431738195.db2.gz NVMWFNUEPJKWHS-JTQLQIEISA-N 0 0 377.303 3.411 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCCS(=O)(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000187465606 1431739769 /nfs/dbraw/zinc/73/97/69/1431739769.db2.gz CEIZHPSBKVWRIE-UHFFFAOYSA-N 0 0 390.461 3.312 20 5 GGBDRN C[C@@](O)(CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000187467992 1431739998 /nfs/dbraw/zinc/73/99/98/1431739998.db2.gz MXVUYUCGKHZKIC-JOCHJYFZSA-N 0 0 397.475 3.225 20 5 GGBDRN COCCC1(CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CCCCC1 ZINC000187469815 1431741185 /nfs/dbraw/zinc/74/11/85/1431741185.db2.gz QXGFELIBEZOXOR-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN COc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1-n1nnnc1C ZINC000187560169 1431767576 /nfs/dbraw/zinc/76/75/76/1431767576.db2.gz BZBOLZAYMAXEEP-UHFFFAOYSA-N 0 0 396.407 3.263 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC([C@@H]2CCCO2)CC1 ZINC000187582754 1431772748 /nfs/dbraw/zinc/77/27/48/1431772748.db2.gz SRDRLXFIRBHGIS-FQEVSTJZSA-N 0 0 387.480 3.229 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](C)CSc2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000187587783 1431773485 /nfs/dbraw/zinc/77/34/85/1431773485.db2.gz ISPVLJXFGZRRLY-ZDUSSCGKSA-N 0 0 376.482 3.404 20 5 GGBDRN CC(C)(C)OCc1cc(CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)no1 ZINC000187654204 1431789876 /nfs/dbraw/zinc/78/98/76/1431789876.db2.gz CBNOCMFULRNZET-UHFFFAOYSA-N 0 0 399.407 3.014 20 5 GGBDRN CC(C)(C)OCc1cc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)no1 ZINC000187659415 1431791545 /nfs/dbraw/zinc/79/15/45/1431791545.db2.gz QGLSTVGJGGTVST-UHFFFAOYSA-N 0 0 399.407 3.014 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2cc(COC(C)(C)C)on2)c1 ZINC000187667469 1431794547 /nfs/dbraw/zinc/79/45/47/1431794547.db2.gz XMXDZVWHRIPHHV-UHFFFAOYSA-N 0 0 391.424 3.292 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000187676188 1431797649 /nfs/dbraw/zinc/79/76/49/1431797649.db2.gz VUZHCNHGNISYCM-APPDUMDISA-N 0 0 397.353 3.356 20 5 GGBDRN CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187677970 1431798041 /nfs/dbraw/zinc/79/80/41/1431798041.db2.gz BUWJPLKCBQQLNK-LRDDRELGSA-N 0 0 379.482 3.148 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CSC[C@H]2C(=O)NC(C)(C)C)cc1[N+](=O)[O-] ZINC000187680432 1431798609 /nfs/dbraw/zinc/79/86/09/1431798609.db2.gz FDMKZEXQWVSTKL-HNNXBMFYSA-N 0 0 379.482 3.148 20 5 GGBDRN O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000187686744 1431800130 /nfs/dbraw/zinc/80/01/30/1431800130.db2.gz WFQJRMLZAAGWRL-LBPRGKRZSA-N 0 0 382.294 3.399 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000187686851 1431800177 /nfs/dbraw/zinc/80/01/77/1431800177.db2.gz IIBZVAZAOVCGKY-XHDPSFHLSA-N 0 0 392.399 3.287 20 5 GGBDRN COc1cc(OCC(=O)NC[C@H](c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000187694044 1431800920 /nfs/dbraw/zinc/80/09/20/1431800920.db2.gz STIHWDFXAURJBP-CQSZACIVSA-N 0 0 398.337 3.445 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(Cl)cc2F)C1=O ZINC000187716002 1431803148 /nfs/dbraw/zinc/80/31/48/1431803148.db2.gz BFZTUPXQUFKHBD-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN Cc1nn(CCC(=O)NC[C@H](c2ccccc2)C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000187721379 1431804013 /nfs/dbraw/zinc/80/40/13/1431804013.db2.gz DZLFVOLBOFDSBY-CQSZACIVSA-N 0 0 384.358 3.261 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(c3nccc(C(C)C)n3)CC2)ccc1[N+](=O)[O-] ZINC000187723248 1431804212 /nfs/dbraw/zinc/80/42/12/1431804212.db2.gz DPQFWSNKFYZMEB-UHFFFAOYSA-N 0 0 384.440 3.171 20 5 GGBDRN COC(=O)COc1ccc(CN(C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000187735271 1431805578 /nfs/dbraw/zinc/80/55/78/1431805578.db2.gz RFMNHQVLYQDONP-UHFFFAOYSA-N 0 0 378.812 3.432 20 5 GGBDRN CC(C)c1ccc(C(=O)N[C@@H](C)c2nnnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000187738927 1431806271 /nfs/dbraw/zinc/80/62/71/1431806271.db2.gz GAIJLSCGYCIYPH-ZDUSSCGKSA-N 0 0 380.408 3.185 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000187751373 1431808091 /nfs/dbraw/zinc/80/80/91/1431808091.db2.gz COVNKZWINFUDNX-SJCJKPOMSA-N 0 0 399.369 3.218 20 5 GGBDRN C[C@H](C(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000187753044 1431808371 /nfs/dbraw/zinc/80/83/71/1431808371.db2.gz JJWHPXCEPHEJJN-XMZIXOGTSA-N 0 0 392.349 3.437 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1ccc(Cl)cc1F ZINC000187816170 1431815921 /nfs/dbraw/zinc/81/59/21/1431815921.db2.gz XMSBAVQSRVPMKF-UHFFFAOYSA-N 0 0 399.769 3.331 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2CCC[C@@H]2CCO)cc1[N+](=O)[O-])c1ccccn1 ZINC000187847536 1431819684 /nfs/dbraw/zinc/81/96/84/1431819684.db2.gz DCYDGRWEPUKACV-HDMKZQKVSA-N 0 0 398.463 3.444 20 5 GGBDRN O=C(CN1CCO[C@@H](c2ccc(F)cc2Cl)C1)Nc1ccccc1[N+](=O)[O-] ZINC000187855607 1431820631 /nfs/dbraw/zinc/82/06/31/1431820631.db2.gz DGNIBOIHUHWLTL-QGZVFWFLSA-N 0 0 393.802 3.399 20 5 GGBDRN Cc1nn(C)c(C(=O)NCC2(c3ccc(F)cc3F)CCCC2)c1[N+](=O)[O-] ZINC000187857988 1431820833 /nfs/dbraw/zinc/82/08/33/1431820833.db2.gz YQPIGXLPPZNZSJ-UHFFFAOYSA-N 0 0 378.379 3.157 20 5 GGBDRN Cc1cc(-c2ncccc2NC(=O)C(=O)NCc2ccccc2[N+](=O)[O-])cs1 ZINC000187875374 1431822720 /nfs/dbraw/zinc/82/27/20/1431822720.db2.gz UMSAWDSFOPKCBB-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN COc1ccc(Cl)c(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000187885888 1431824017 /nfs/dbraw/zinc/82/40/17/1431824017.db2.gz TUYLNFHWDVJRIR-GOSISDBHSA-N 0 0 389.795 3.224 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])cnc1N)c1ccc(OCc2ccccc2)cc1 ZINC000187918598 1431827085 /nfs/dbraw/zinc/82/70/85/1431827085.db2.gz ZLZIGICMFQWURV-UHFFFAOYSA-N 0 0 378.388 3.428 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)c1ccc(OCc2ccccc2)cc1 ZINC000187924954 1431827866 /nfs/dbraw/zinc/82/78/66/1431827866.db2.gz QHUUDWIMHRYOCQ-UHFFFAOYSA-N 0 0 380.404 3.342 20 5 GGBDRN COCCO[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000187950168 1431830649 /nfs/dbraw/zinc/83/06/49/1431830649.db2.gz SYMHAZZSFBFEQV-KRWDZBQOSA-N 0 0 385.420 3.216 20 5 GGBDRN O=C(c1ccc(Cl)cc1)C1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC1 ZINC000188004301 1431835550 /nfs/dbraw/zinc/83/55/50/1431835550.db2.gz YRDMKQQLGNTZDP-UHFFFAOYSA-N 0 0 389.795 3.084 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(c3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000188018054 1431836857 /nfs/dbraw/zinc/83/68/57/1431836857.db2.gz XCHJYTRTAKNWCR-UHFFFAOYSA-N 0 0 375.425 3.418 20 5 GGBDRN CNS(=O)(=O)c1cccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1C ZINC000188031083 1431837843 /nfs/dbraw/zinc/83/78/43/1431837843.db2.gz ZFIVGEQQBHTIEC-UHFFFAOYSA-N 0 0 391.449 3.187 20 5 GGBDRN CCN(C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@H](C)Cc1ccsc1 ZINC000188053451 1431840130 /nfs/dbraw/zinc/84/01/30/1431840130.db2.gz HGYOVTYROUJQHP-GFCCVEGCSA-N 0 0 391.449 3.083 20 5 GGBDRN COc1ccc(NC(=O)CN2CCN(C3CC3)c3ccccc32)c([N+](=O)[O-])c1 ZINC000188053491 1431840214 /nfs/dbraw/zinc/84/02/14/1431840214.db2.gz ZSGHJAAIUAWDBL-UHFFFAOYSA-N 0 0 382.420 3.031 20 5 GGBDRN CCN(C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H](C)Cc1ccsc1 ZINC000188059492 1431840826 /nfs/dbraw/zinc/84/08/26/1431840826.db2.gz GFCHDPTZANIPFI-GFCCVEGCSA-N 0 0 375.450 3.383 20 5 GGBDRN CSc1cccc(C(=O)NCc2cnn(Cc3ccccc3)c2)c1[N+](=O)[O-] ZINC000188060015 1431840959 /nfs/dbraw/zinc/84/09/59/1431840959.db2.gz YASFPXUIPDTAPT-UHFFFAOYSA-N 0 0 382.445 3.492 20 5 GGBDRN CC(C)c1ccc(C(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000188081826 1431844057 /nfs/dbraw/zinc/84/40/57/1431844057.db2.gz KJEZJEGUAQTHCN-QGZVFWFLSA-N 0 0 395.459 3.497 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2cccc(NS(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000188097606 1431846210 /nfs/dbraw/zinc/84/62/10/1431846210.db2.gz WDHINUQNZCRCLR-UHFFFAOYSA-N 0 0 377.422 3.342 20 5 GGBDRN O=C(Nc1ccc(OC2COC2)cc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000188104150 1431847098 /nfs/dbraw/zinc/84/70/98/1431847098.db2.gz ZJCXXHJKWNWIIP-UHFFFAOYSA-N 0 0 383.404 3.225 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000188111772 1431847908 /nfs/dbraw/zinc/84/79/08/1431847908.db2.gz ZUENMLBXRNSROR-UHFFFAOYSA-N 0 0 390.461 3.442 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000188112472 1431848073 /nfs/dbraw/zinc/84/80/73/1431848073.db2.gz HWJWBVYWLSDTPU-ZDUSSCGKSA-N 0 0 379.482 3.085 20 5 GGBDRN CCc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1S(N)(=O)=O ZINC000188113913 1431848323 /nfs/dbraw/zinc/84/83/23/1431848323.db2.gz FMGWPYSTZOCWHF-UHFFFAOYSA-N 0 0 391.449 3.180 20 5 GGBDRN Cc1c(-c2nc(COc3cccc(F)c3)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000188114728 1431848477 /nfs/dbraw/zinc/84/84/77/1431848477.db2.gz HCCNBOFYHQNSEW-UHFFFAOYSA-N 0 0 396.338 3.252 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000188120232 1431849413 /nfs/dbraw/zinc/84/94/13/1431849413.db2.gz RHDFGTRCEISNEB-IAGOWNOFSA-N 0 0 381.432 3.369 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000188138313 1431851552 /nfs/dbraw/zinc/85/15/52/1431851552.db2.gz KAANTJJYJFWSBN-HZPDHXFCSA-N 0 0 397.431 3.070 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000188138382 1431851855 /nfs/dbraw/zinc/85/18/55/1431851855.db2.gz KAANTJJYJFWSBN-HOTGVXAUSA-N 0 0 397.431 3.070 20 5 GGBDRN COc1cc(OCc2nc(COc3cccc(F)c3)no2)ccc1[N+](=O)[O-] ZINC000188144455 1431852681 /nfs/dbraw/zinc/85/26/81/1431852681.db2.gz QKWABGKXXCCVNG-UHFFFAOYSA-N 0 0 375.312 3.284 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188152457 1431853608 /nfs/dbraw/zinc/85/36/08/1431853608.db2.gz XIQFHBZQRSPSDF-UHFFFAOYSA-N 0 0 380.326 3.052 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188153987 1431853803 /nfs/dbraw/zinc/85/38/03/1431853803.db2.gz IBXNOJUJBYWIEY-UHFFFAOYSA-N 0 0 396.369 3.357 20 5 GGBDRN COc1cc(C(=O)N2CCCN(C(C)=O)c3ccccc32)cc([N+](=O)[O-])c1C ZINC000188167321 1431855670 /nfs/dbraw/zinc/85/56/70/1431855670.db2.gz LBOLRKSTBYFATD-UHFFFAOYSA-N 0 0 383.404 3.315 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1cc(F)ccc1Cl ZINC000188186496 1431858140 /nfs/dbraw/zinc/85/81/40/1431858140.db2.gz GUMGYJNEFMKDAQ-UHFFFAOYSA-N 0 0 399.769 3.331 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cc(F)ccc2Cl)C1=O ZINC000188187762 1431858148 /nfs/dbraw/zinc/85/81/48/1431858148.db2.gz OUDXDYRWACPBPB-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN CSc1cccc(C(=O)N2CCC[C@H](c3nnc4ccccn43)C2)c1[N+](=O)[O-] ZINC000188188830 1431858574 /nfs/dbraw/zinc/85/85/74/1431858574.db2.gz SODWKKGQSPJQRO-ZDUSSCGKSA-N 0 0 397.460 3.379 20 5 GGBDRN COCCc1ccccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000188203411 1431860077 /nfs/dbraw/zinc/86/00/77/1431860077.db2.gz MVHNLKUPZLVTET-UHFFFAOYSA-N 0 0 399.403 3.111 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H](Cc1ccc(F)cc1)C(F)(F)F ZINC000188212331 1431861229 /nfs/dbraw/zinc/86/12/29/1431861229.db2.gz DWILJFMJIYMLRM-ZDUSSCGKSA-N 0 0 389.305 3.346 20 5 GGBDRN COc1cc(OC)cc(N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000188231379 1431863904 /nfs/dbraw/zinc/86/39/04/1431863904.db2.gz SGMNSGUTOJJDCL-UHFFFAOYSA-N 0 0 399.447 3.491 20 5 GGBDRN CSc1cccc(C(=O)N2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1[N+](=O)[O-] ZINC000188263322 1431866902 /nfs/dbraw/zinc/86/69/02/1431866902.db2.gz XXPWJPRPZRFOAE-LBPRGKRZSA-N 0 0 387.465 3.332 20 5 GGBDRN CN(CC1(c2ccccc2)CC1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000188262856 1431866956 /nfs/dbraw/zinc/86/69/56/1431866956.db2.gz QYVFAKCMYNFDEP-UHFFFAOYSA-N 0 0 397.456 3.495 20 5 GGBDRN COc1cc(OCC(=O)Nc2cnn(-c3ccc(C)cc3C)c2)ccc1[N+](=O)[O-] ZINC000188267287 1431867360 /nfs/dbraw/zinc/86/73/60/1431867360.db2.gz KLPCAOULOFSPIE-UHFFFAOYSA-N 0 0 396.403 3.423 20 5 GGBDRN CSC1(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)CC1 ZINC000188307667 1431871364 /nfs/dbraw/zinc/87/13/64/1431871364.db2.gz CGYDZJWFKPXDMA-UHFFFAOYSA-N 0 0 389.399 3.158 20 5 GGBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000188335626 1431874283 /nfs/dbraw/zinc/87/42/83/1431874283.db2.gz JUDVLZRKXIPWEI-SJKOYZFVSA-N 0 0 396.852 3.399 20 5 GGBDRN CCCCOc1ccc(CNC(=O)NCCn2cc([N+](=O)[O-])cn2)cc1Cl ZINC000188364412 1431877092 /nfs/dbraw/zinc/87/70/92/1431877092.db2.gz YQWYTDZEADZSQG-UHFFFAOYSA-N 0 0 395.847 3.123 20 5 GGBDRN CCc1n[nH]c(C(=O)N(CCc2ccccc2)Cc2cccnc2)c1[N+](=O)[O-] ZINC000188369452 1431877799 /nfs/dbraw/zinc/87/77/99/1431877799.db2.gz BDITXORIDYJDTB-UHFFFAOYSA-N 0 0 379.420 3.160 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000188370055 1431877829 /nfs/dbraw/zinc/87/78/29/1431877829.db2.gz BKTSEJCGUWKWBA-OAHLLOKOSA-N 0 0 398.868 3.126 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000188372942 1431878427 /nfs/dbraw/zinc/87/84/27/1431878427.db2.gz LKUQIBVYHZLISV-KRWDZBQOSA-N 0 0 392.477 3.090 20 5 GGBDRN COC[C@@H]1CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000188397474 1431880860 /nfs/dbraw/zinc/88/08/60/1431880860.db2.gz CPLUXRDVVAFRLF-YOEHRIQHSA-N 0 0 385.420 3.214 20 5 GGBDRN COC[C@@H]1CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000188397446 1431880866 /nfs/dbraw/zinc/88/08/66/1431880866.db2.gz CPLUXRDVVAFRLF-PBHICJAKSA-N 0 0 385.420 3.214 20 5 GGBDRN Cc1nc(-c2ccccc2)ncc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188449109 1431884882 /nfs/dbraw/zinc/88/48/82/1431884882.db2.gz NGVRKYDDLKHBFF-UHFFFAOYSA-N 0 0 390.399 3.264 20 5 GGBDRN CC(C)C(=O)Nc1ccc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000188454367 1431885345 /nfs/dbraw/zinc/88/53/45/1431885345.db2.gz QRNBNAAHSMNLSV-UHFFFAOYSA-N 0 0 383.404 3.093 20 5 GGBDRN O=C(CCC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)c1ccc(F)cc1F ZINC000188461646 1431885913 /nfs/dbraw/zinc/88/59/13/1431885913.db2.gz BLRGYEHFQZMDET-UHFFFAOYSA-N 0 0 390.342 3.126 20 5 GGBDRN COc1nc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cc2ccccc21 ZINC000188464366 1431886364 /nfs/dbraw/zinc/88/63/64/1431886364.db2.gz UTHBAQIMPBTSBZ-UHFFFAOYSA-N 0 0 379.372 3.055 20 5 GGBDRN Cc1cccc2[nH]c(CCC(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)nc21 ZINC000188469542 1431886721 /nfs/dbraw/zinc/88/67/21/1431886721.db2.gz MGQDYAANWQPTCU-UHFFFAOYSA-N 0 0 380.404 3.002 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000188488371 1431888623 /nfs/dbraw/zinc/88/86/23/1431888623.db2.gz GTPQYEJCCJUVBI-VBKZILBWSA-N 0 0 399.447 3.232 20 5 GGBDRN COc1cc(CCNC(=O)c2cc3sccc3[nH]2)c([N+](=O)[O-])cc1OC ZINC000188486900 1431888633 /nfs/dbraw/zinc/88/86/33/1431888633.db2.gz FAPCFEZBHAJGBT-UHFFFAOYSA-N 0 0 375.406 3.127 20 5 GGBDRN CCn1cnnc1-c1cccc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000188494952 1431889069 /nfs/dbraw/zinc/88/90/69/1431889069.db2.gz LSAVHHAOGLFPFK-UHFFFAOYSA-N 0 0 381.392 3.443 20 5 GGBDRN C[C@H](NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)c1nc2ccccc2[nH]1 ZINC000188507075 1431890166 /nfs/dbraw/zinc/89/01/66/1431890166.db2.gz JKRYCPAYGQWQPF-LBPRGKRZSA-N 0 0 381.392 3.005 20 5 GGBDRN Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)c4cc([N+](=O)[O-])ccc4N)C3)nc2c1 ZINC000188516561 1431890977 /nfs/dbraw/zinc/89/09/77/1431890977.db2.gz HPINSGUTVAHHBL-CYBMUJFWSA-N 0 0 379.420 3.382 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc(C(=O)c2cccc(O)c2)cc1 ZINC000188542063 1431893518 /nfs/dbraw/zinc/89/35/18/1431893518.db2.gz GJTARSZZRRBZER-UHFFFAOYSA-N 0 0 376.368 3.461 20 5 GGBDRN O=C(Nc1ccc2scnc2c1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000188548523 1431894080 /nfs/dbraw/zinc/89/40/80/1431894080.db2.gz YCVKOAMDNLXAPS-UHFFFAOYSA-N 0 0 396.428 3.334 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccccc1 ZINC000188556043 1431894804 /nfs/dbraw/zinc/89/48/04/1431894804.db2.gz YMRIVHIIHXHSAT-OAQYLSRUSA-N 0 0 393.399 3.004 20 5 GGBDRN CC(=O)Nc1ccc(Cl)c(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000188561480 1431895295 /nfs/dbraw/zinc/89/52/95/1431895295.db2.gz VEQQHQBNMLHOQO-UHFFFAOYSA-N 0 0 389.795 3.110 20 5 GGBDRN Cc1c(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cnn1-c1ccccc1F ZINC000188576083 1431896593 /nfs/dbraw/zinc/89/65/93/1431896593.db2.gz QEHWDMKOXSMARK-UHFFFAOYSA-N 0 0 396.378 3.131 20 5 GGBDRN CCN(CC)C(=O)c1ccc(CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1 ZINC000188577265 1431896815 /nfs/dbraw/zinc/89/68/15/1431896815.db2.gz LPNBUGYSCDLEJB-UHFFFAOYSA-N 0 0 399.447 3.324 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000188589086 1431897940 /nfs/dbraw/zinc/89/79/40/1431897940.db2.gz QMIWBELGGDIHBA-UHFFFAOYSA-N 0 0 383.404 3.061 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000188602031 1431899228 /nfs/dbraw/zinc/89/92/28/1431899228.db2.gz MLXPKKSKZKXUHL-UHFFFAOYSA-N 0 0 383.404 3.061 20 5 GGBDRN CCOc1cc(OCC(=O)NCCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000188615688 1431901652 /nfs/dbraw/zinc/90/16/52/1431901652.db2.gz WCTWQHIURWGZJG-UHFFFAOYSA-N 0 0 378.812 3.385 20 5 GGBDRN COc1ccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c(OCc2ccccc2)c1 ZINC000188613231 1431901832 /nfs/dbraw/zinc/90/18/32/1431901832.db2.gz WBHIITDGCUVJCI-UHFFFAOYSA-N 0 0 396.403 3.408 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000188622588 1431906268 /nfs/dbraw/zinc/90/62/68/1431906268.db2.gz BLHLHHSESKDORN-WFASDCNBSA-N 0 0 393.490 3.440 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000188664848 1431925155 /nfs/dbraw/zinc/92/51/55/1431925155.db2.gz KSFKCWXGTUIREJ-MRXNPFEDSA-N 0 0 388.449 3.148 20 5 GGBDRN C[C@H](NC(=O)c1cc(N2C[C@@H](C)O[C@H](C)C2)ccn1)c1cccc([N+](=O)[O-])c1 ZINC000188678850 1431930254 /nfs/dbraw/zinc/93/02/54/1431930254.db2.gz VKHFVTHKZILYAW-KFWWJZLASA-N 0 0 384.436 3.094 20 5 GGBDRN C[C@H](NC(=O)c1cc(N2C[C@@H](C)O[C@@H](C)C2)ccn1)c1cccc([N+](=O)[O-])c1 ZINC000188678811 1431930326 /nfs/dbraw/zinc/93/03/26/1431930326.db2.gz VKHFVTHKZILYAW-ZNMIVQPWSA-N 0 0 384.436 3.094 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC2(c3ccc(F)cc3F)CCCC2)c1[N+](=O)[O-] ZINC000188696529 1431936174 /nfs/dbraw/zinc/93/61/74/1431936174.db2.gz JKAGMSFTFLVGQE-UHFFFAOYSA-N 0 0 378.379 3.400 20 5 GGBDRN CCc1nn(C)c(CC)c1CC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000188705759 1431940532 /nfs/dbraw/zinc/94/05/32/1431940532.db2.gz XMSHYKPIPHXHRM-UHFFFAOYSA-N 0 0 382.367 3.236 20 5 GGBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1nncn1C ZINC000188736422 1431951008 /nfs/dbraw/zinc/95/10/08/1431951008.db2.gz FDHHYTSKTUWQFW-CYBMUJFWSA-N 0 0 381.392 3.049 20 5 GGBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1nncn1C ZINC000188736400 1431951323 /nfs/dbraw/zinc/95/13/23/1431951323.db2.gz FDHHYTSKTUWQFW-ZDUSSCGKSA-N 0 0 381.392 3.049 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000188741477 1431953614 /nfs/dbraw/zinc/95/36/14/1431953614.db2.gz WPGVMIGMXRTUCU-AWEZNQCLSA-N 0 0 395.525 3.013 20 5 GGBDRN COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000188777270 1431969471 /nfs/dbraw/zinc/96/94/71/1431969471.db2.gz MKRFQNLQSCHWHH-NVXWUHKLSA-N 0 0 394.811 3.007 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C(=O)NCC2CC2)ccc1C ZINC000188802600 1431981094 /nfs/dbraw/zinc/98/10/94/1431981094.db2.gz VEHSDZRINMHPEE-UHFFFAOYSA-N 0 0 383.404 3.304 20 5 GGBDRN CCO[C@@H]1C[C@@](CO)(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1(C)C ZINC000188808132 1431983876 /nfs/dbraw/zinc/98/38/76/1431983876.db2.gz OYKKEVAPDLBLDU-QAPCUYQASA-N 0 0 378.450 3.105 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000188830734 1431992304 /nfs/dbraw/zinc/99/23/04/1431992304.db2.gz RPSQCWTYCHIABE-INIZCTEOSA-N 0 0 382.420 3.073 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000188834377 1431993493 /nfs/dbraw/zinc/99/34/93/1431993493.db2.gz VRSKLYQXJQAQBM-UHFFFAOYSA-N 0 0 397.840 3.152 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc([N+](=O)[O-])c1C ZINC000188847867 1431996578 /nfs/dbraw/zinc/99/65/78/1431996578.db2.gz OZHQSURGBOITSR-GFCCVEGCSA-N 0 0 383.404 3.288 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN([C@H](C)c2nccs2)CC1 ZINC000188851279 1431997976 /nfs/dbraw/zinc/99/79/76/1431997976.db2.gz UBSUSLGIXVWVGB-CYBMUJFWSA-N 0 0 375.454 3.270 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN([C@@H](C)c2nccs2)CC1 ZINC000188851253 1431998059 /nfs/dbraw/zinc/99/80/59/1431998059.db2.gz UBSUSLGIXVWVGB-ZDUSSCGKSA-N 0 0 375.454 3.270 20 5 GGBDRN Cc1ccn(C)c1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000188909872 1432006893 /nfs/dbraw/zinc/00/68/93/1432006893.db2.gz TURYEQHSWQBUGE-UHFFFAOYSA-N 0 0 396.369 3.223 20 5 GGBDRN CCSCC[C@H](C)N(C)C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000188915152 1432008079 /nfs/dbraw/zinc/00/80/79/1432008079.db2.gz VQCCOVJRHQSYPY-QWHCGFSZSA-N 0 0 399.538 3.251 20 5 GGBDRN CCOC(=O)[C@@](C)(CNC(=O)Cc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000188920517 1432009005 /nfs/dbraw/zinc/00/90/05/1432009005.db2.gz FQJOAXDVELYDME-NRFANRHFSA-N 0 0 384.432 3.083 20 5 GGBDRN CCOC(=O)[C@](C)(CNC(=O)Cc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000188920538 1432009041 /nfs/dbraw/zinc/00/90/41/1432009041.db2.gz FQJOAXDVELYDME-OAQYLSRUSA-N 0 0 384.432 3.083 20 5 GGBDRN Cc1nn(CCC(=O)NCCCCCc2ccc(F)cc2)c(C)c1[N+](=O)[O-] ZINC000188947690 1432014619 /nfs/dbraw/zinc/01/46/19/1432014619.db2.gz OILQRANSJQNCDC-UHFFFAOYSA-N 0 0 376.432 3.467 20 5 GGBDRN CCC(=O)N1CC[C@H](C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])C1 ZINC000188955127 1432016271 /nfs/dbraw/zinc/01/62/71/1432016271.db2.gz QAHCQWCFODNMQS-INIZCTEOSA-N 0 0 397.431 3.371 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ccc(F)c(Cl)c2)C1=O ZINC000188958959 1432016433 /nfs/dbraw/zinc/01/64/33/1432016433.db2.gz QKJAFVIDOJUSDM-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c2cccnc2O1 ZINC000189061428 1432037604 /nfs/dbraw/zinc/03/76/04/1432037604.db2.gz IDWVVFPPQRARGF-AWEZNQCLSA-N 0 0 382.420 3.408 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000189108231 1432046333 /nfs/dbraw/zinc/04/63/33/1432046333.db2.gz SQBAJJHWZTXRSM-NUJGCVRESA-N 0 0 389.496 3.432 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC([C@H]2CCCO2)CC1 ZINC000189112815 1432047004 /nfs/dbraw/zinc/04/70/04/1432047004.db2.gz OXZKASJHOCAOSH-SJKOYZFVSA-N 0 0 381.860 3.466 20 5 GGBDRN CCOC(=O)c1c(C)oc2nc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)nc(N)c21 ZINC000189159334 1432054581 /nfs/dbraw/zinc/05/45/81/1432054581.db2.gz CUJDNRROQMQCCI-JTQLQIEISA-N 0 0 399.407 3.049 20 5 GGBDRN O=C(NCc1cccc(OC(F)F)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000189175706 1432057983 /nfs/dbraw/zinc/05/79/83/1432057983.db2.gz KLALBZVLXBHGRF-UHFFFAOYSA-N 0 0 393.346 3.169 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cc(F)ccc2Cl)CC1 ZINC000189196567 1432061743 /nfs/dbraw/zinc/06/17/43/1432061743.db2.gz GIIQCYQPFFATKS-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN CC(=O)Nc1cccnc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000189207831 1432063277 /nfs/dbraw/zinc/06/32/77/1432063277.db2.gz SEVGDTODCBLJAN-UHFFFAOYSA-N 0 0 383.389 3.324 20 5 GGBDRN CC(C)c1nnc2ccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)cn21 ZINC000189246257 1432070981 /nfs/dbraw/zinc/07/09/81/1432070981.db2.gz WNQNORSJJAXXHC-UHFFFAOYSA-N 0 0 378.392 3.423 20 5 GGBDRN Cc1cc(C)n(-c2ccc(C(=O)OCc3ncc(C)c([N+](=O)[O-])c3C)cn2)n1 ZINC000189255343 1432072580 /nfs/dbraw/zinc/07/25/80/1432072580.db2.gz LAXDGNLNGMLAPE-UHFFFAOYSA-N 0 0 381.392 3.161 20 5 GGBDRN Cc1cnc(COC(=O)[C@@H]2CCCN2C(=O)c2cccs2)c(C)c1[N+](=O)[O-] ZINC000189257506 1432072791 /nfs/dbraw/zinc/07/27/91/1432072791.db2.gz WPWRLLALIGOLEN-AWEZNQCLSA-N 0 0 389.433 3.016 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)O[C@@H]2CCc3cccnc32)ccc1[N+](=O)[O-] ZINC000189268227 1432074859 /nfs/dbraw/zinc/07/48/59/1432074859.db2.gz ZIQTUTNMPMXAEW-QZTJIDSGSA-N 0 0 395.415 3.134 20 5 GGBDRN CC(C)c1nc(CCNC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000189270620 1432075367 /nfs/dbraw/zinc/07/53/67/1432075367.db2.gz VMKJRAXVORYOEZ-UHFFFAOYSA-N 0 0 390.465 3.190 20 5 GGBDRN CC[C@]1(CO)CCCN1C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000189274457 1432075949 /nfs/dbraw/zinc/07/59/49/1432075949.db2.gz GHMQCYUYRUIRNU-CKJXQJPGSA-N 0 0 389.496 3.454 20 5 GGBDRN O=C(NCc1cc(-c2ccccc2)on1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000189275490 1432076387 /nfs/dbraw/zinc/07/63/87/1432076387.db2.gz PKLSWAYYJWXIAZ-UHFFFAOYSA-N 0 0 394.387 3.223 20 5 GGBDRN Cc1ccc(C)c(-n2cnc(=O)n2[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000189322582 1432085999 /nfs/dbraw/zinc/08/59/99/1432085999.db2.gz XIWRBZKLJSKMIG-HNNXBMFYSA-N 0 0 395.419 3.067 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)c1[N+](=O)[O-] ZINC000189328662 1432087216 /nfs/dbraw/zinc/08/72/16/1432087216.db2.gz JIJWWHJUDTZSDU-ZDUSSCGKSA-N 0 0 386.429 3.481 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)cccc1[N+](=O)[O-] ZINC000189340715 1432089966 /nfs/dbraw/zinc/08/99/66/1432089966.db2.gz RSHJSEPFGPLIAI-UHFFFAOYSA-N 0 0 386.383 3.220 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1cc(Cl)ccc1OC1CCCC1 ZINC000189344570 1432090472 /nfs/dbraw/zinc/09/04/72/1432090472.db2.gz KZNIUQCUEOIUDR-UHFFFAOYSA-N 0 0 391.811 3.370 20 5 GGBDRN COC(=O)c1cnc(NCc2nccn2CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC000189342375 1432090476 /nfs/dbraw/zinc/09/04/76/1432090476.db2.gz YDVGGXJVRKUICR-UHFFFAOYSA-N 0 0 395.419 3.218 20 5 GGBDRN Cc1c(C(=O)NCc2ccc(Cl)cc2F)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000189360032 1432093107 /nfs/dbraw/zinc/09/31/07/1432093107.db2.gz YVDDGVGAKSJBJQ-UHFFFAOYSA-N 0 0 389.774 3.206 20 5 GGBDRN COC(=O)c1cnc(NC[C@H](C)c2nc(-c3ccccc3)no2)c([N+](=O)[O-])c1 ZINC000189370499 1432094647 /nfs/dbraw/zinc/09/46/47/1432094647.db2.gz PICIPMKHCIXABD-NSHDSACASA-N 0 0 383.364 3.042 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)cc([N+](=O)[O-])c1C ZINC000189386299 1432097008 /nfs/dbraw/zinc/09/70/08/1432097008.db2.gz PLXMXLHKNLZTEZ-LBPRGKRZSA-N 0 0 382.376 3.453 20 5 GGBDRN CC(=O)N1CCN(Cc2ccccc2NC/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000189443555 1432113477 /nfs/dbraw/zinc/11/34/77/1432113477.db2.gz RKTIRWFBZDKBKG-RMKNXTFCSA-N 0 0 394.475 3.384 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000189464887 1432120952 /nfs/dbraw/zinc/12/09/52/1432120952.db2.gz BLSPKLQCPBDOOX-FQEVSTJZSA-N 0 0 382.420 3.275 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000189468052 1432122954 /nfs/dbraw/zinc/12/29/54/1432122954.db2.gz OIFPMVHNWKMWGC-YOEHRIQHSA-N 0 0 387.440 3.470 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000189472435 1432125224 /nfs/dbraw/zinc/12/52/24/1432125224.db2.gz BSIDJPXEUMARAZ-KRWDZBQOSA-N 0 0 394.431 3.110 20 5 GGBDRN CC(=O)N1CCN(c2cccc(NC/C=C/c3ccccc3[N+](=O)[O-])c2)CC1 ZINC000189480032 1432129219 /nfs/dbraw/zinc/12/92/19/1432129219.db2.gz PURNQZBJTRMYBY-FNORWQNLSA-N 0 0 380.448 3.389 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc(N2CCN(C(C)=O)CC2)c1 ZINC000189481364 1432130198 /nfs/dbraw/zinc/13/01/98/1432130198.db2.gz HKYZTRZDLHCMIW-UHFFFAOYSA-N 0 0 398.463 3.274 20 5 GGBDRN CCCCNC(=O)[C@H]1CCCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189498469 1432135950 /nfs/dbraw/zinc/13/59/50/1432135950.db2.gz WAEXBQFYFICPHS-INIZCTEOSA-N 0 0 375.469 3.487 20 5 GGBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189502136 1432137710 /nfs/dbraw/zinc/13/77/10/1432137710.db2.gz SJWCPUOLOANIHV-KZULUSFZSA-N 0 0 389.839 3.309 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@H](C)[C@@H]3CO)cc2[N+](=O)[O-])n1 ZINC000189506923 1432139978 /nfs/dbraw/zinc/13/99/78/1432139978.db2.gz SSJJUHFLLPNNON-HZMBPMFUSA-N 0 0 393.490 3.354 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000189508984 1432140610 /nfs/dbraw/zinc/14/06/10/1432140610.db2.gz ZIVOJDCUKCAQHW-SFHVURJKSA-N 0 0 383.448 3.499 20 5 GGBDRN O=C(N[C@H]1CCOc2ccc(F)cc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000189539189 1432153339 /nfs/dbraw/zinc/15/33/39/1432153339.db2.gz PIFZWKMJSCAJKW-KRWDZBQOSA-N 0 0 387.367 3.030 20 5 GGBDRN CCc1nc([C@@H](C)NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000189573351 1432163350 /nfs/dbraw/zinc/16/33/50/1432163350.db2.gz SOCJSJNIKZLAMC-LLVKDONJSA-N 0 0 376.438 3.148 20 5 GGBDRN CCc1nc([C@H](C)NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000189573368 1432163811 /nfs/dbraw/zinc/16/38/11/1432163811.db2.gz SOCJSJNIKZLAMC-NSHDSACASA-N 0 0 376.438 3.148 20 5 GGBDRN CCc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)N(C)C)cc1 ZINC000189574700 1432164637 /nfs/dbraw/zinc/16/46/37/1432164637.db2.gz PXLSUGQKWBFRLN-SFHVURJKSA-N 0 0 391.493 3.276 20 5 GGBDRN O=C(N[C@H]1CC[C@@H](Cc2ccccc2)C1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000189584324 1432167907 /nfs/dbraw/zinc/16/79/07/1432167907.db2.gz UXFXHNRTTTWARZ-WMZOPIPTSA-N 0 0 391.431 3.317 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000189594908 1432170182 /nfs/dbraw/zinc/17/01/82/1432170182.db2.gz SSLMUUBSPFEUCA-VLIAUNLRSA-N 0 0 385.420 3.086 20 5 GGBDRN CCOC(=O)[C@](C)(CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000189594994 1432171117 /nfs/dbraw/zinc/17/11/17/1432171117.db2.gz GLTATDCPFZJYKF-YCRPNKLZSA-N 0 0 399.447 3.476 20 5 GGBDRN O=C(c1cn(-c2cccc(Cl)c2)nn1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000189597689 1432171644 /nfs/dbraw/zinc/17/16/44/1432171644.db2.gz UCCDTTIDVKDWHC-UHFFFAOYSA-N 0 0 383.795 3.422 20 5 GGBDRN C[C@H](O)[C@](C)(CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000189647836 1432189556 /nfs/dbraw/zinc/18/95/56/1432189556.db2.gz QGTKMWZWJYXUOD-LIRRHRJNSA-N 0 0 392.477 3.040 20 5 GGBDRN C[C@@H](O)[C@](C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Cc1ccccc1 ZINC000189650090 1432190405 /nfs/dbraw/zinc/19/04/05/1432190405.db2.gz VGFQKFPXYMGXCK-KUHUBIRLSA-N 0 0 392.477 3.040 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@](C)(Cc2ccccc2)[C@@H](C)O)c1[N+](=O)[O-] ZINC000189652159 1432191746 /nfs/dbraw/zinc/19/17/46/1432191746.db2.gz MMRMUTDXCYENLS-VLIAUNLRSA-N 0 0 387.436 3.208 20 5 GGBDRN CCOC(C)(C)CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000189688560 1432204827 /nfs/dbraw/zinc/20/48/27/1432204827.db2.gz MUCIADZFWICUJX-UHFFFAOYSA-N 0 0 377.363 3.347 20 5 GGBDRN COC[C@H](C)Oc1ccc(Cl)cc1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189693134 1432205988 /nfs/dbraw/zinc/20/59/88/1432205988.db2.gz ZBPWCZMSIKVZFG-NSHDSACASA-N 0 0 393.827 3.373 20 5 GGBDRN Cc1ccc([C@@H](C)NS(=O)(=O)CCc2ccc3c(c2)CCO3)cc1[N+](=O)[O-] ZINC000189698140 1432207772 /nfs/dbraw/zinc/20/77/72/1432207772.db2.gz YEPYVTQVFFPMCR-CQSZACIVSA-N 0 0 390.461 3.061 20 5 GGBDRN C[C@@H](C1CC1)n1cc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000189722389 1432214452 /nfs/dbraw/zinc/21/44/52/1432214452.db2.gz HOTNJVDJTQXODE-AWEZNQCLSA-N 0 0 384.440 3.116 20 5 GGBDRN COC(=O)CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000189730325 1432217588 /nfs/dbraw/zinc/21/75/88/1432217588.db2.gz GHXGXRXYLRDUEA-UHFFFAOYSA-N 0 0 386.282 3.022 20 5 GGBDRN CCN(CC)[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccco1 ZINC000189750061 1432222910 /nfs/dbraw/zinc/22/29/10/1432222910.db2.gz CYNJUIBYZIDYEC-OAHLLOKOSA-N 0 0 381.454 3.086 20 5 GGBDRN Cc1csc([C@@H](NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C2CC2)n1 ZINC000189776912 1432232674 /nfs/dbraw/zinc/23/26/74/1432232674.db2.gz IYAJPEKXDZSSIJ-INIZCTEOSA-N 0 0 388.449 3.284 20 5 GGBDRN COCCN(Cc1ccccc1)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000189794833 1432237387 /nfs/dbraw/zinc/23/73/87/1432237387.db2.gz JYOVEGVLPNZZDD-UHFFFAOYSA-N 0 0 378.450 3.049 20 5 GGBDRN O=C(CCOCC(F)(F)C(F)(F)F)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000189817077 1432243830 /nfs/dbraw/zinc/24/38/30/1432243830.db2.gz FMUIAOZXJNIKRY-UHFFFAOYSA-N 0 0 382.245 3.014 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NCc2coc(-c3cccs3)n2)c1[N+](=O)[O-] ZINC000189818478 1432244268 /nfs/dbraw/zinc/24/42/68/1432244268.db2.gz ARCMXMBDNSIWRK-UHFFFAOYSA-N 0 0 393.446 3.407 20 5 GGBDRN CCOCc1ccccc1CNS(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000189833161 1432248257 /nfs/dbraw/zinc/24/82/57/1432248257.db2.gz RGGOGWCKJDNRAM-UHFFFAOYSA-N 0 0 378.450 3.227 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H](Cc1ccccc1)C(C)C ZINC000189862798 1432256626 /nfs/dbraw/zinc/25/66/26/1432256626.db2.gz YZBHANOWCYFAIN-KRWDZBQOSA-N 0 0 383.448 3.473 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H](Cc1ccccc1)C(C)C ZINC000189865755 1432257609 /nfs/dbraw/zinc/25/76/09/1432257609.db2.gz KLPWRPYRCQDJLS-INIZCTEOSA-N 0 0 399.447 3.173 20 5 GGBDRN COC(=O)[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H]1C ZINC000189867461 1432257825 /nfs/dbraw/zinc/25/78/25/1432257825.db2.gz AZUWCTTUXWJINB-MWLCHTKSSA-N 0 0 389.330 3.277 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)c2ccc(CC(F)(F)F)cc2)cc1 ZINC000189879209 1432260713 /nfs/dbraw/zinc/26/07/13/1432260713.db2.gz MVBGFUGDLSTYQL-UHFFFAOYSA-N 0 0 388.367 3.221 20 5 GGBDRN CC(C)[C@H](CNC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)c1cccnc1 ZINC000189879429 1432260765 /nfs/dbraw/zinc/26/07/65/1432260765.db2.gz VQSHDLXAQHFNBH-IBGZPJMESA-N 0 0 384.436 3.202 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000189888730 1432264035 /nfs/dbraw/zinc/26/40/35/1432264035.db2.gz LICQOROXTKOHHB-WBVHZDCISA-N 0 0 390.461 3.362 20 5 GGBDRN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000189894115 1432265522 /nfs/dbraw/zinc/26/55/22/1432265522.db2.gz QXLALKOSZQVYLY-SUNKGSAMSA-N 0 0 397.378 3.314 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)CC2 ZINC000189895324 1432266157 /nfs/dbraw/zinc/26/61/57/1432266157.db2.gz IXQIXFIZNJQJSN-ROUUACIJSA-N 0 0 376.453 3.110 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(S(=O)(=O)N(C)[C@@H](C)c2ccco2)c(C)c1[N+](=O)[O-] ZINC000189911073 1432271250 /nfs/dbraw/zinc/27/12/50/1432271250.db2.gz RMXGXVUBXPNXRV-NSHDSACASA-N 0 0 383.382 3.095 20 5 GGBDRN CC[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Oc1cccc(F)c1 ZINC000189920110 1432274043 /nfs/dbraw/zinc/27/40/43/1432274043.db2.gz DXZRWMQBJHYQIS-CQSZACIVSA-N 0 0 382.413 3.407 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1ccccc1N(C)C ZINC000189920123 1432274374 /nfs/dbraw/zinc/27/43/74/1432274374.db2.gz APYNRKBLYFOVCN-UHFFFAOYSA-N 0 0 384.436 3.037 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CC[C@H](Nc3ccccc3)C2)c1[N+](=O)[O-] ZINC000189935866 1432280391 /nfs/dbraw/zinc/28/03/91/1432280391.db2.gz AUENTIBCCWVFNP-INIZCTEOSA-N 0 0 375.450 3.087 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCO[C@H](c3ccccc3F)C2)c1[N+](=O)[O-] ZINC000189939112 1432281498 /nfs/dbraw/zinc/28/14/98/1432281498.db2.gz HNBLPEWOAYVFBM-INIZCTEOSA-N 0 0 394.424 3.113 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000189943994 1432284201 /nfs/dbraw/zinc/28/42/01/1432284201.db2.gz KJEUIANXEOVQLX-UHFFFAOYSA-N 0 0 380.404 3.119 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCOc3ccc(F)cc32)c1[N+](=O)[O-] ZINC000189960166 1432290204 /nfs/dbraw/zinc/29/02/04/1432290204.db2.gz IGQUUCJBVQOSIF-AWEZNQCLSA-N 0 0 380.397 3.153 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])o1 ZINC000189980950 1432296908 /nfs/dbraw/zinc/29/69/08/1432296908.db2.gz IAYRZNZPNDXWRD-HNNXBMFYSA-N 0 0 394.449 3.129 20 5 GGBDRN CCc1ccc([C@H]2COCCN2S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])o1 ZINC000189980967 1432297289 /nfs/dbraw/zinc/29/72/89/1432297289.db2.gz IAYRZNZPNDXWRD-OAHLLOKOSA-N 0 0 394.449 3.129 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NC[C@@H]2CCCC2=O)cc1[N+](=O)[O-])c1ccccn1 ZINC000190006313 1432303228 /nfs/dbraw/zinc/30/32/28/1432303228.db2.gz UCVKIGDJYSBULY-ZFWWWQNUSA-N 0 0 382.420 3.262 20 5 GGBDRN O=C([C@@H]1CCCc2c(O)cccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000190007487 1432303758 /nfs/dbraw/zinc/30/37/58/1432303758.db2.gz SCRZWYHDODRMDG-QGZVFWFLSA-N 0 0 381.432 3.069 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCc2ccc(C(C)C)cc21 ZINC000190008987 1432304181 /nfs/dbraw/zinc/30/41/81/1432304181.db2.gz BITJNZCFICJSKE-KRWDZBQOSA-N 0 0 397.431 3.469 20 5 GGBDRN CC(C)c1cc(NC(=O)NCc2cccc([N+](=O)[O-])c2)n(-c2ncccn2)n1 ZINC000190009533 1432304199 /nfs/dbraw/zinc/30/41/99/1432304199.db2.gz IOKYZYBUCCNGHQ-UHFFFAOYSA-N 0 0 381.396 3.016 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](C)OC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000190034213 1432308619 /nfs/dbraw/zinc/30/86/19/1432308619.db2.gz RBUITZXKCILOIB-NVXWUHKLSA-N 0 0 390.461 3.362 20 5 GGBDRN COc1cc(CCNC(=O)Nc2cccc3ccn(C)c32)c([N+](=O)[O-])cc1OC ZINC000190042726 1432309548 /nfs/dbraw/zinc/30/95/48/1432309548.db2.gz NLUONRJLUXWMCT-UHFFFAOYSA-N 0 0 398.419 3.468 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@H](c2cccnc2)C(C)C)c1[N+](=O)[O-] ZINC000190061700 1432313071 /nfs/dbraw/zinc/31/30/71/1432313071.db2.gz HBUANARTJCLBDT-INIZCTEOSA-N 0 0 377.466 3.325 20 5 GGBDRN CN(C)c1ccc(C(=O)c2ccccc2C(=O)N2CCCCO2)cc1[N+](=O)[O-] ZINC000190069965 1432314192 /nfs/dbraw/zinc/31/41/92/1432314192.db2.gz XIVFAOGIXZUQIW-UHFFFAOYSA-N 0 0 383.404 3.059 20 5 GGBDRN COc1cc(C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)cc([N+](=O)[O-])c1C ZINC000190070372 1432314463 /nfs/dbraw/zinc/31/44/63/1432314463.db2.gz KVZWQYDUIJZTBQ-AWEZNQCLSA-N 0 0 387.411 3.307 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000190072717 1432314726 /nfs/dbraw/zinc/31/47/26/1432314726.db2.gz GCEMGBYJUHBNDO-ZFWWWQNUSA-N 0 0 396.490 3.424 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000190075761 1432315004 /nfs/dbraw/zinc/31/50/04/1432315004.db2.gz YVHUSSZXVVIVDC-DZGCQCFKSA-N 0 0 391.468 3.069 20 5 GGBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000190087048 1432317565 /nfs/dbraw/zinc/31/75/65/1432317565.db2.gz HIKVZXFEWOXVSK-APPDUMDISA-N 0 0 375.812 3.433 20 5 GGBDRN CC(C)(O)CN(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000190093086 1432318613 /nfs/dbraw/zinc/31/86/13/1432318613.db2.gz QSQOJXTUMUXFDL-UHFFFAOYSA-N 0 0 389.374 3.178 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)cc([N+](=O)[O-])c1C ZINC000190098453 1432319150 /nfs/dbraw/zinc/31/91/50/1432319150.db2.gz RUZSIDGLXAYUOM-UHFFFAOYSA-N 0 0 384.367 3.167 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(-n3ccnc3C)c(F)c2)cc([N+](=O)[O-])c1C ZINC000190099201 1432319359 /nfs/dbraw/zinc/31/93/59/1432319359.db2.gz VGIKBUSRBKFNKC-UHFFFAOYSA-N 0 0 398.394 3.475 20 5 GGBDRN CCc1ccc([C@H]2CN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)CCO2)cc1 ZINC000190101820 1432319693 /nfs/dbraw/zinc/31/96/93/1432319693.db2.gz BDKMOVHOOBPLDL-LJQANCHMSA-N 0 0 397.431 3.004 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(-c3cc(C)ccc3F)[nH]n2)c(C)c1[N+](=O)[O-] ZINC000190108657 1432321104 /nfs/dbraw/zinc/32/11/04/1432321104.db2.gz PAFORBSWAKGULC-UHFFFAOYSA-N 0 0 386.387 3.275 20 5 GGBDRN CCc1ccc([C@@H]2CN(C(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCO2)cc1 ZINC000190109573 1432321462 /nfs/dbraw/zinc/32/14/62/1432321462.db2.gz HDWMJCQFBXYZDO-IBGZPJMESA-N 0 0 397.431 3.004 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(C)Cc2cc(F)c(F)c(F)c2)c1[N+](=O)[O-] ZINC000190112679 1432321786 /nfs/dbraw/zinc/32/17/86/1432321786.db2.gz PKQIMCYKTKDEBB-UHFFFAOYSA-N 0 0 388.367 3.450 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(C)c(OC(F)F)c1 ZINC000190111693 1432321829 /nfs/dbraw/zinc/32/18/29/1432321829.db2.gz LGAVBESUAPPNDH-UHFFFAOYSA-N 0 0 379.319 3.390 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(OC(F)(F)F)cc1 ZINC000190126920 1432324538 /nfs/dbraw/zinc/32/45/38/1432324538.db2.gz KOKKLQZTGBCELE-MRXNPFEDSA-N 0 0 395.337 3.167 20 5 GGBDRN CC(C)c1ccc(C(=O)NC[C@H](O)COc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000190131561 1432325099 /nfs/dbraw/zinc/32/50/99/1432325099.db2.gz CUZIYMOGYMNUOJ-HNNXBMFYSA-N 0 0 376.384 3.027 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)c1[N+](=O)[O-] ZINC000190146453 1432327758 /nfs/dbraw/zinc/32/77/58/1432327758.db2.gz JKILBHHERNYTRY-BLLLJJGKSA-N 0 0 375.450 3.378 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000190152495 1432329097 /nfs/dbraw/zinc/32/90/97/1432329097.db2.gz GALUCURVBCJKQB-HNNXBMFYSA-N 0 0 386.404 3.425 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000190152510 1432329168 /nfs/dbraw/zinc/32/91/68/1432329168.db2.gz GALUCURVBCJKQB-OAHLLOKOSA-N 0 0 386.404 3.425 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000190155430 1432329736 /nfs/dbraw/zinc/32/97/36/1432329736.db2.gz TYDZSISBNQDQTM-IRXDYDNUSA-N 0 0 390.461 3.410 20 5 GGBDRN COC(=O)c1cnc(NCc2c(C)nn(Cc3ccccc3)c2C)c([N+](=O)[O-])c1 ZINC000190165313 1432331533 /nfs/dbraw/zinc/33/15/33/1432331533.db2.gz LYRXFALTMWVMAJ-UHFFFAOYSA-N 0 0 395.419 3.250 20 5 GGBDRN COC(=O)c1cnc(NCc2ccc(OC)cc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000190171462 1432332873 /nfs/dbraw/zinc/33/28/73/1432332873.db2.gz IYIIWBVUJOUJAL-UHFFFAOYSA-N 0 0 385.298 3.416 20 5 GGBDRN COC(=O)c1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(N(C)C)c1 ZINC000190186516 1432336155 /nfs/dbraw/zinc/33/61/55/1432336155.db2.gz ADCQSYHGCVQCJN-UHFFFAOYSA-N 0 0 377.784 3.353 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000190205594 1432340782 /nfs/dbraw/zinc/34/07/82/1432340782.db2.gz QZNZONPODUGOLN-AWEZNQCLSA-N 0 0 375.406 3.205 20 5 GGBDRN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000190223603 1432344009 /nfs/dbraw/zinc/34/40/09/1432344009.db2.gz ZVMJDBHKRZPQPR-JXFKEZNVSA-N 0 0 392.415 3.288 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@H](CCc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000190223330 1432344071 /nfs/dbraw/zinc/34/40/71/1432344071.db2.gz LJEMVCFFPKCRNT-GOSISDBHSA-N 0 0 384.432 3.386 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC([C@H](O)c3nccn3C)CC2)cc1[N+](=O)[O-] ZINC000190231822 1432345644 /nfs/dbraw/zinc/34/56/44/1432345644.db2.gz IERQHXZMXKJHRR-SFHVURJKSA-N 0 0 386.452 3.038 20 5 GGBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000190239181 1432346743 /nfs/dbraw/zinc/34/67/43/1432346743.db2.gz IUKIXXFAYPJJBT-QGZVFWFLSA-N 0 0 378.388 3.294 20 5 GGBDRN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000190244064 1432347755 /nfs/dbraw/zinc/34/77/55/1432347755.db2.gz BEPRVUDOZFLSBG-JXFKEZNVSA-N 0 0 392.415 3.288 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)n1 ZINC000190247422 1432348481 /nfs/dbraw/zinc/34/84/81/1432348481.db2.gz JWTPDEDKWBOWCV-CQSZACIVSA-N 0 0 375.406 3.205 20 5 GGBDRN Cc1cn(-c2c(F)cccc2F)nc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000190248408 1432348493 /nfs/dbraw/zinc/34/84/93/1432348493.db2.gz CZEFNLWTZWLDID-UHFFFAOYSA-N 0 0 386.358 3.340 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)cc1[N+](=O)[O-] ZINC000190258949 1432350127 /nfs/dbraw/zinc/35/01/27/1432350127.db2.gz XCJOORAWJSJYIR-QAPCUYQASA-N 0 0 385.464 3.334 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)nnn1Cc1ccc(F)cc1F ZINC000190264709 1432350633 /nfs/dbraw/zinc/35/06/33/1432350633.db2.gz PZQAPQMRLLMVID-UHFFFAOYSA-N 0 0 387.346 3.382 20 5 GGBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000190281713 1432352845 /nfs/dbraw/zinc/35/28/45/1432352845.db2.gz GZFAGFWDISJQFB-MRXNPFEDSA-N 0 0 378.388 3.294 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(Cc2c(F)cccc2F)C2CC2)cc1 ZINC000190290044 1432354141 /nfs/dbraw/zinc/35/41/41/1432354141.db2.gz GTFKIHIASLIDCM-UHFFFAOYSA-N 0 0 396.415 3.410 20 5 GGBDRN CCc1ccc([C@H]2CN(CC(=O)Nc3cc([N+](=O)[O-])ccc3C)CCO2)cc1 ZINC000190298397 1432355885 /nfs/dbraw/zinc/35/58/85/1432355885.db2.gz HWTRPOBOZKFQOA-HXUWFJFHSA-N 0 0 383.448 3.478 20 5 GGBDRN Cc1ccc(NC(=O)NC[C@@H]2CCCN(c3ncc([N+](=O)[O-])s3)C2)cc1 ZINC000190323930 1432361308 /nfs/dbraw/zinc/36/13/08/1432361308.db2.gz KBLYNIXCOMSIQC-ZDUSSCGKSA-N 0 0 375.454 3.398 20 5 GGBDRN Cc1ccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])c(-n2cc(Cl)cn2)n1 ZINC000190327636 1432361959 /nfs/dbraw/zinc/36/19/59/1432361959.db2.gz ZVLVKIKWIPSLAJ-UHFFFAOYSA-N 0 0 389.774 3.206 20 5 GGBDRN COc1cc(C(=O)NC(C)(C)c2nc3ccccc3n2C)cc([N+](=O)[O-])c1C ZINC000190332347 1432363334 /nfs/dbraw/zinc/36/33/34/1432363334.db2.gz IVLXUTOSSRGTAP-UHFFFAOYSA-N 0 0 382.420 3.464 20 5 GGBDRN Cc1ccc(CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)c(-n2cc(Cl)cn2)n1 ZINC000190335320 1432363617 /nfs/dbraw/zinc/36/36/17/1432363617.db2.gz PCQFUMGPLLONQD-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(C)nc2-n2cc(Cl)cn2)cc([N+](=O)[O-])c1 ZINC000190336767 1432363922 /nfs/dbraw/zinc/36/39/22/1432363922.db2.gz JRBWDEKVKRWCOV-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN Cc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2C)c(-n2cc(Cl)cn2)n1 ZINC000190339491 1432364151 /nfs/dbraw/zinc/36/41/51/1432364151.db2.gz PERWCKFMZUBOAM-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2C)c(-n2cc(Cl)cn2)n1 ZINC000190341375 1432364480 /nfs/dbraw/zinc/36/44/80/1432364480.db2.gz IAZRUUWXYYOGAB-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN COC(=O)[C@@H](C)N(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCC1 ZINC000190354644 1432366436 /nfs/dbraw/zinc/36/64/36/1432366436.db2.gz MTNVYPNSQOPRLL-LLVKDONJSA-N 0 0 389.433 3.275 20 5 GGBDRN CC(C)C1(C)CCN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000190357293 1432366799 /nfs/dbraw/zinc/36/67/99/1432366799.db2.gz KYMJWZWTRRNPRH-UHFFFAOYSA-N 0 0 381.860 3.263 20 5 GGBDRN COC(=O)[C@@H](C)N(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CCC1 ZINC000190361167 1432367249 /nfs/dbraw/zinc/36/72/49/1432367249.db2.gz YYVXIUDOMIPBJR-OAHLLOKOSA-N 0 0 392.455 3.097 20 5 GGBDRN CC(C)c1ccc(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000190381442 1432370418 /nfs/dbraw/zinc/37/04/18/1432370418.db2.gz QXXVJFNEAOFPMZ-UHFFFAOYSA-N 0 0 390.484 3.421 20 5 GGBDRN CCOC(=O)c1ccnc(N(Cc2ccccc2)C[C@@](C)(O)CC)c1[N+](=O)[O-] ZINC000190396713 1432373559 /nfs/dbraw/zinc/37/35/59/1432373559.db2.gz DDHBKGCXNDOHMC-FQEVSTJZSA-N 0 0 387.436 3.334 20 5 GGBDRN Cc1ccc([C@H]2CSCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000190400628 1432374033 /nfs/dbraw/zinc/37/40/33/1432374033.db2.gz VXXYGWJJTZRQDN-GOSISDBHSA-N 0 0 399.472 3.467 20 5 GGBDRN Cc1ccc([C@H]2CSCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000190400579 1432374142 /nfs/dbraw/zinc/37/41/42/1432374142.db2.gz VFIQQHXXZLCFEE-QGZVFWFLSA-N 0 0 385.445 3.158 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccc(Cc2nnc3n2CCC3)cc1 ZINC000190415475 1432377465 /nfs/dbraw/zinc/37/74/65/1432377465.db2.gz FWNCYWUDAVMLJN-UHFFFAOYSA-N 0 0 379.420 3.344 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000190427057 1432379829 /nfs/dbraw/zinc/37/98/29/1432379829.db2.gz QJJGKCMNPPPZNW-AWEZNQCLSA-N 0 0 395.423 3.378 20 5 GGBDRN O=C1[C@H](NCc2csc([N+](=O)[O-])c2)CCCN1Cc1ccc(F)cc1F ZINC000190477316 1432388978 /nfs/dbraw/zinc/38/89/78/1432388978.db2.gz FQNKQXKFOIPSNS-OAHLLOKOSA-N 0 0 381.404 3.215 20 5 GGBDRN Cc1ccccc1C[C@H](CO)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000190500768 1432393662 /nfs/dbraw/zinc/39/36/62/1432393662.db2.gz SRZYIRJLJHWEHN-MRXNPFEDSA-N 0 0 397.456 3.360 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)c3cc(OC)c(C)c([N+](=O)[O-])c3)n2)cc1 ZINC000190515362 1432396146 /nfs/dbraw/zinc/39/61/46/1432396146.db2.gz FGBOUWMNEMUIFR-UHFFFAOYSA-N 0 0 396.403 3.418 20 5 GGBDRN C[C@@](O)(CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000190532331 1432399431 /nfs/dbraw/zinc/39/94/31/1432399431.db2.gz NFDIHBWGCHYXFC-HXUWFJFHSA-N 0 0 375.469 3.256 20 5 GGBDRN CCCc1cnc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)s1 ZINC000190536101 1432399832 /nfs/dbraw/zinc/39/98/32/1432399832.db2.gz BVJOCNLTDIUIGG-UHFFFAOYSA-N 0 0 390.465 3.081 20 5 GGBDRN Cc1ccccc1C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000190538803 1432400281 /nfs/dbraw/zinc/40/02/81/1432400281.db2.gz YCRZQWHXGDTWDK-HNNXBMFYSA-N 0 0 382.338 3.255 20 5 GGBDRN CC(C)c1ccc(C(=O)NCc2ccc(Cn3cncn3)cc2)cc1[N+](=O)[O-] ZINC000190564115 1432407908 /nfs/dbraw/zinc/40/79/08/1432407908.db2.gz VKVFJISODLQRLY-UHFFFAOYSA-N 0 0 379.420 3.288 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC(Oc4ccc(F)nc4)CC3)n2)c1 ZINC000190568139 1432409034 /nfs/dbraw/zinc/40/90/34/1432409034.db2.gz UDXVVWPUMFTRIB-UHFFFAOYSA-N 0 0 399.382 3.222 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000190570798 1432409608 /nfs/dbraw/zinc/40/96/08/1432409608.db2.gz UOWASMIBLOCNQQ-UHFFFAOYSA-N 0 0 396.447 3.407 20 5 GGBDRN COc1cc(C(=O)N(C)CC(=O)Nc2cccc(C)c2C)cc([N+](=O)[O-])c1C ZINC000190586641 1432413643 /nfs/dbraw/zinc/41/36/43/1432413643.db2.gz MHPSRFBIGMKFSC-UHFFFAOYSA-N 0 0 385.420 3.239 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H]2C[C@H](O)C2(C)C)cc1[N+](=O)[O-])c1ccccn1 ZINC000190605760 1432418397 /nfs/dbraw/zinc/41/83/97/1432418397.db2.gz KWNOBKUODAYKIE-PJSAGSTRSA-N 0 0 384.436 3.052 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000190656870 1432432802 /nfs/dbraw/zinc/43/28/02/1432432802.db2.gz TWTLTVBTNHMONA-LJQANCHMSA-N 0 0 392.477 3.255 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000190658731 1432433540 /nfs/dbraw/zinc/43/35/40/1432433540.db2.gz LDGJNLTYAJWTMN-IBGZPJMESA-N 0 0 392.477 3.088 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000190659515 1432434088 /nfs/dbraw/zinc/43/40/88/1432434088.db2.gz JLKSZDOFOLWXFY-IBGZPJMESA-N 0 0 392.477 3.255 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000190659981 1432434313 /nfs/dbraw/zinc/43/43/13/1432434313.db2.gz CGROHBWCXKBMLH-LJQANCHMSA-N 0 0 392.477 3.088 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1[N+](=O)[O-] ZINC000190663744 1432436129 /nfs/dbraw/zinc/43/61/29/1432436129.db2.gz WPDVHOUTYLJNJU-UHFFFAOYSA-N 0 0 385.420 3.438 20 5 GGBDRN CC1(C)CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)CC[C@@H]1C(F)(F)F ZINC000190670304 1432438800 /nfs/dbraw/zinc/43/88/00/1432438800.db2.gz OARICEJAVJBWNI-AWEZNQCLSA-N 0 0 397.357 3.226 20 5 GGBDRN COc1ccc(OC[C@H](O)COc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000190670533 1432439072 /nfs/dbraw/zinc/43/90/72/1432439072.db2.gz RBDIQQKSYQKEDD-NSHDSACASA-N 0 0 387.310 3.441 20 5 GGBDRN CCOc1cc(OC[C@H](O)Cn2cnc3cc(C)c(C)cc32)ccc1[N+](=O)[O-] ZINC000190691446 1432443640 /nfs/dbraw/zinc/44/36/40/1432443640.db2.gz IEFOWNDBXCROLL-OAHLLOKOSA-N 0 0 385.420 3.400 20 5 GGBDRN CC(C)c1cccc2c1CCN(C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)C2 ZINC000190706439 1432448990 /nfs/dbraw/zinc/44/89/90/1432448990.db2.gz XHUZRKXQTIXEJJ-OAHLLOKOSA-N 0 0 395.459 3.421 20 5 GGBDRN CC(C)c1cccc2c1CCN(C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)C2 ZINC000190706458 1432449548 /nfs/dbraw/zinc/44/95/48/1432449548.db2.gz XHUZRKXQTIXEJJ-HNNXBMFYSA-N 0 0 395.459 3.421 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCOc3c(F)cccc32)c1C ZINC000190723991 1432456496 /nfs/dbraw/zinc/45/64/96/1432456496.db2.gz QSKHEKCHAWIKJS-AWEZNQCLSA-N 0 0 380.397 3.153 20 5 GGBDRN COc1cc(C(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1C ZINC000190727208 1432458684 /nfs/dbraw/zinc/45/86/84/1432458684.db2.gz PASIJRLTACHNPO-WBMJQRKESA-N 0 0 390.358 3.125 20 5 GGBDRN Cc1cc(-n2cccn2)ccc1NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000190807658 1432489127 /nfs/dbraw/zinc/48/91/27/1432489127.db2.gz ZJBVTVOOFAKTMW-UHFFFAOYSA-N 0 0 393.403 3.384 20 5 GGBDRN COc1cc(C(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)cc([N+](=O)[O-])c1C ZINC000190862914 1432511476 /nfs/dbraw/zinc/51/14/76/1432511476.db2.gz YCTDKZOTPZVLCH-KRWDZBQOSA-N 0 0 385.420 3.128 20 5 GGBDRN Cc1cc(-n2cccn2)ccc1NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000190866777 1432512691 /nfs/dbraw/zinc/51/26/91/1432512691.db2.gz WNFFMQMZKGBITM-UHFFFAOYSA-N 0 0 377.404 3.090 20 5 GGBDRN CCc1ccc([C@H]2CN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CCO2)cc1 ZINC000190897626 1432523075 /nfs/dbraw/zinc/52/30/75/1432523075.db2.gz AZOJMSZMGUSWGO-GOSISDBHSA-N 0 0 380.404 3.247 20 5 GGBDRN Cc1ccc(C[C@@H](CO)NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000190943425 1432534656 /nfs/dbraw/zinc/53/46/56/1432534656.db2.gz YDWLFHSIKAJODP-HNNXBMFYSA-N 0 0 394.880 3.369 20 5 GGBDRN COc1cc(C(=O)NCC(=O)Nc2cccc3ccccc32)cc([N+](=O)[O-])c1C ZINC000190944989 1432535216 /nfs/dbraw/zinc/53/52/16/1432535216.db2.gz VOKUUQJRLRQTAC-UHFFFAOYSA-N 0 0 393.399 3.434 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2cc(CC3CCCCC3)[nH]n2)cccc1[N+](=O)[O-] ZINC000190945892 1432535425 /nfs/dbraw/zinc/53/54/25/1432535425.db2.gz CAWFWJSIZYOOPY-UHFFFAOYSA-N 0 0 385.424 3.326 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C[C@@H]2CCC3(CCCCC3)O2)CC1 ZINC000190995484 1432545843 /nfs/dbraw/zinc/54/58/43/1432545843.db2.gz RNLXRMKPIXZLTC-IBGZPJMESA-N 0 0 387.480 3.235 20 5 GGBDRN CCn1c(SC[C@@H]2CC3(CCC3)C(=O)O2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000191011419 1432549543 /nfs/dbraw/zinc/54/95/43/1432549543.db2.gz ISILRRAMLRCNDZ-AWEZNQCLSA-N 0 0 388.449 3.451 20 5 GGBDRN COc1ccc(OC(=O)Cc2c(C)nn(CC(F)(F)F)c2C)cc1[N+](=O)[O-] ZINC000191023770 1432551910 /nfs/dbraw/zinc/55/19/10/1432551910.db2.gz FYGHHXSYCPFIKN-UHFFFAOYSA-N 0 0 387.314 3.127 20 5 GGBDRN CS(=O)(=O)N(CCSCCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000191031545 1432553457 /nfs/dbraw/zinc/55/34/57/1432553457.db2.gz FFZYDIAWQFJIMN-UHFFFAOYSA-N 0 0 394.518 3.332 20 5 GGBDRN CCC[C@H](C)c1cc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n[nH]1 ZINC000191070971 1432561514 /nfs/dbraw/zinc/56/15/14/1432561514.db2.gz KZJSTDJWTRRSRN-VIFPVBQESA-N 0 0 379.804 3.452 20 5 GGBDRN COc1cc(OC)cc(N(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 ZINC000191092801 1432565940 /nfs/dbraw/zinc/56/59/40/1432565940.db2.gz ABIISOKQGAPYNM-UHFFFAOYSA-N 0 0 385.420 3.489 20 5 GGBDRN CCc1nn(C)c(CC)c1CC(=O)Nc1cc(C)nn1-c1ccc([N+](=O)[O-])cc1 ZINC000191094472 1432566353 /nfs/dbraw/zinc/56/63/53/1432566353.db2.gz OYMIYDSXDIXCST-UHFFFAOYSA-N 0 0 396.451 3.128 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191115630 1432570520 /nfs/dbraw/zinc/57/05/20/1432570520.db2.gz YWEKNYFHYUPLKV-UHFFFAOYSA-N 0 0 379.775 3.466 20 5 GGBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191119740 1432571422 /nfs/dbraw/zinc/57/14/22/1432571422.db2.gz CJHXXKYSIJDQHW-UHFFFAOYSA-N 0 0 379.775 3.466 20 5 GGBDRN Cc1cccc(C[C@H](CO)NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000191138503 1432574855 /nfs/dbraw/zinc/57/48/55/1432574855.db2.gz IZXYHYOXOBYKHH-OAHLLOKOSA-N 0 0 382.338 3.255 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191152291 1432577079 /nfs/dbraw/zinc/57/70/79/1432577079.db2.gz LXOMSUNSPIBDLH-UHFFFAOYSA-N 0 0 398.394 3.223 20 5 GGBDRN Cn1cc([C@H]2CSCCN2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000191201636 1432590409 /nfs/dbraw/zinc/59/04/09/1432590409.db2.gz IUZUJZOOHJWOHP-QGZVFWFLSA-N 0 0 385.449 3.273 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1nccn1-c1ccccc1 ZINC000191234558 1432599469 /nfs/dbraw/zinc/59/94/69/1432599469.db2.gz YVNVZHISLPKUKX-OWBHPGMISA-N 0 0 385.383 3.435 20 5 GGBDRN O=C(Nc1ccc(Cc2nnc3n2CCC3)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000191240745 1432601798 /nfs/dbraw/zinc/60/17/98/1432601798.db2.gz NGEHGKQZAOGJPS-UHFFFAOYSA-N 0 0 378.392 3.367 20 5 GGBDRN Cc1nc2ccccc2c(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1C(C)C ZINC000191319482 1432631676 /nfs/dbraw/zinc/63/16/76/1432631676.db2.gz VQVHJQLTXRGMNS-UHFFFAOYSA-N 0 0 380.404 3.375 20 5 GGBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000191323774 1432632764 /nfs/dbraw/zinc/63/27/64/1432632764.db2.gz LDZZJHIBUDXSCZ-LJQANCHMSA-N 0 0 396.447 3.210 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC1CCN(C(=O)c2ccco2)CC1 ZINC000191338839 1432636201 /nfs/dbraw/zinc/63/62/01/1432636201.db2.gz QHSDYLXMOHTBAG-UHFFFAOYSA-N 0 0 386.408 3.231 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCNc1nccc(C(F)(F)F)n1 ZINC000191338487 1432636242 /nfs/dbraw/zinc/63/62/42/1432636242.db2.gz FPYQWJMCJIXZRI-UHFFFAOYSA-N 0 0 398.345 3.254 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 ZINC000191338891 1432636305 /nfs/dbraw/zinc/63/63/05/1432636305.db2.gz CJUZMJBGGOLZNI-GJZGRUSLSA-N 0 0 378.473 3.221 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCN(CC(F)(F)C(F)F)CC1 ZINC000191343374 1432637147 /nfs/dbraw/zinc/63/71/47/1432637147.db2.gz LXTHLOOHUIRGJY-UHFFFAOYSA-N 0 0 392.353 3.262 20 5 GGBDRN Cc1nc(CN2CCN(C(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)CC2)oc1C ZINC000191342087 1432637171 /nfs/dbraw/zinc/63/71/71/1432637171.db2.gz LDFRQBJJYAOFQQ-UHFFFAOYSA-N 0 0 387.440 3.166 20 5 GGBDRN Cc1cnc(COC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000191347332 1432637729 /nfs/dbraw/zinc/63/77/29/1432637729.db2.gz RPRFTKPOOKJLME-QGZVFWFLSA-N 0 0 397.431 3.202 20 5 GGBDRN CCCCNC(=O)C1CCN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC1 ZINC000191352929 1432639015 /nfs/dbraw/zinc/63/90/15/1432639015.db2.gz GODWTTOVLVTSGY-UHFFFAOYSA-N 0 0 376.457 3.372 20 5 GGBDRN Cc1cnc(COC(=O)C[C@@H](C)NC(=O)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000191363815 1432642001 /nfs/dbraw/zinc/64/20/01/1432642001.db2.gz OSMRCATZOGZIBN-CYBMUJFWSA-N 0 0 377.441 3.125 20 5 GGBDRN Cc1cnc(COC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)c(C)c1[N+](=O)[O-] ZINC000191364044 1432642010 /nfs/dbraw/zinc/64/20/10/1432642010.db2.gz YFCQOQQXUQVZEN-OAHLLOKOSA-N 0 0 377.441 3.077 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC(OC[C@@H]2CCCO2)CC1 ZINC000191372554 1432644237 /nfs/dbraw/zinc/64/42/37/1432644237.db2.gz CYGSOYNHCNQHNR-INIZCTEOSA-N 0 0 377.441 3.404 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000191387529 1432648045 /nfs/dbraw/zinc/64/80/45/1432648045.db2.gz XGNVYOKVZPVYGV-UHFFFAOYSA-N 0 0 375.450 3.385 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCS(=O)(=O)c2ccccc2C1 ZINC000191389831 1432649036 /nfs/dbraw/zinc/64/90/36/1432649036.db2.gz WYKXCSMBXXLYED-UHFFFAOYSA-N 0 0 389.433 3.033 20 5 GGBDRN Cc1cnc(COC(=O)CCc2nc(-c3cccs3)no2)c(C)c1[N+](=O)[O-] ZINC000191391013 1432649505 /nfs/dbraw/zinc/64/95/05/1432649505.db2.gz MRPRFIKOCTUMNL-UHFFFAOYSA-N 0 0 388.405 3.394 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](O)COc1ccc(F)c(F)c1 ZINC000191395414 1432651570 /nfs/dbraw/zinc/65/15/70/1432651570.db2.gz FMMHPUMDJIIZQP-LBPRGKRZSA-N 0 0 395.362 3.051 20 5 GGBDRN CCc1c(NC(=O)c2n[nH]cc2[N+](=O)[O-])cnn1-c1ccc(C(F)(F)F)cc1 ZINC000191401581 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CCn1cc([N+](=O)[O-])c(C(=O)Nc2scc(CC(C)C)c2C(=O)OC)n1 ZINC000191529254 1432678884 /nfs/dbraw/zinc/67/88/84/1432678884.db2.gz RWSNVHOATJWBBR-UHFFFAOYSA-N 0 0 380.426 3.110 20 5 GGBDRN CN(C)c1nc2cc(NC(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)ccc2o1 ZINC000191550551 1432681538 /nfs/dbraw/zinc/68/15/38/1432681538.db2.gz UNEZGGFAJGKNJQ-UHFFFAOYSA-N 0 0 397.391 3.097 20 5 GGBDRN CCN(C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2)C1=O ZINC000191557103 1432682615 /nfs/dbraw/zinc/68/26/15/1432682615.db2.gz ZIBCQSIMYBOTCE-KRWDZBQOSA-N 0 0 397.431 3.179 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 ZINC000191566902 1432684658 /nfs/dbraw/zinc/68/46/58/1432684658.db2.gz DYRMXHMJCJZYKI-UHFFFAOYSA-N 0 0 389.433 3.287 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H](C(=O)Nc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000191578481 1432686456 /nfs/dbraw/zinc/68/64/56/1432686456.db2.gz ZCQARDRYZPPUHS-OAHLLOKOSA-N 0 0 397.431 3.403 20 5 GGBDRN CCN(C)C(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000191603062 1432690639 /nfs/dbraw/zinc/69/06/39/1432690639.db2.gz JDKXYMYBIGBTIS-ZDUSSCGKSA-N 0 0 387.461 3.343 20 5 GGBDRN Cn1ccc2cccc(NC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])c21 ZINC000191604300 1432690888 /nfs/dbraw/zinc/69/08/88/1432690888.db2.gz IZGUIZJVOPGSOT-UHFFFAOYSA-N 0 0 386.795 3.108 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3ccccc3Cl)OC[C@@H]2C)n1 ZINC000191612313 1432692547 /nfs/dbraw/zinc/69/25/47/1432692547.db2.gz KAUFJFKLOIVCAN-NHYWBVRUSA-N 0 0 378.816 3.067 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](c3ccccc3Cl)OC[C@H]2C)n1 ZINC000191612327 1432692611 /nfs/dbraw/zinc/69/26/11/1432692611.db2.gz KAUFJFKLOIVCAN-IAQYHMDHSA-N 0 0 378.816 3.067 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)C2=O)cc1 ZINC000191619482 1432693848 /nfs/dbraw/zinc/69/38/48/1432693848.db2.gz ALENMAHVYVJFGT-LIRRHRJNSA-N 0 0 399.422 3.063 20 5 GGBDRN C[C@@H]1CN(c2ccccc2F)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000191618382 1432694002 /nfs/dbraw/zinc/69/40/02/1432694002.db2.gz MHFIZMRFZNCONL-CQSZACIVSA-N 0 0 387.411 3.311 20 5 GGBDRN COc1cc(C(=O)NCCc2ccc(-n3cccn3)cc2)cc([N+](=O)[O-])c1C ZINC000191634457 1432696968 /nfs/dbraw/zinc/69/69/68/1432696968.db2.gz BCYQWPKRZOVJNF-UHFFFAOYSA-N 0 0 380.404 3.070 20 5 GGBDRN COc1cc(C(=O)NCCc2cnn(-c3ccccc3)c2)cc([N+](=O)[O-])c1C ZINC000191639294 1432698304 /nfs/dbraw/zinc/69/83/04/1432698304.db2.gz YNYCWRIGFBFZBX-UHFFFAOYSA-N 0 0 380.404 3.070 20 5 GGBDRN O=C1NCCN(Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(OC(F)(F)F)cc1 ZINC000191656532 1432700894 /nfs/dbraw/zinc/70/08/94/1432700894.db2.gz FIIPKGMZYYTJNU-INIZCTEOSA-N 0 0 395.337 3.167 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC(c2ccncc2)CC1 ZINC000191668427 1432702779 /nfs/dbraw/zinc/70/27/79/1432702779.db2.gz KEXNQKDVCCBSBC-AWEZNQCLSA-N 0 0 384.436 3.205 20 5 GGBDRN CCOC[C@H](Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)C(C)C ZINC000191670950 1432702802 /nfs/dbraw/zinc/70/28/02/1432702802.db2.gz KAMCHZYXUQBAIN-HNNXBMFYSA-N 0 0 380.832 3.267 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC(c2ccncc2)CC1 ZINC000191668443 1432702858 /nfs/dbraw/zinc/70/28/58/1432702858.db2.gz KEXNQKDVCCBSBC-CQSZACIVSA-N 0 0 384.436 3.205 20 5 GGBDRN CC1(C)CN(C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC2(CCCC2)O1 ZINC000191686558 1432705847 /nfs/dbraw/zinc/70/58/47/1432705847.db2.gz LUGAWMQWGCGREX-UHFFFAOYSA-N 0 0 395.843 3.137 20 5 GGBDRN CCOC1CC(CCNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000191686280 1432705989 /nfs/dbraw/zinc/70/59/89/1432705989.db2.gz OKYZYCZHCOBOJM-UHFFFAOYSA-N 0 0 391.468 3.353 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)n1 ZINC000191719011 1432712558 /nfs/dbraw/zinc/71/25/58/1432712558.db2.gz HBTQPBSKCATEMX-IAQYHMDHSA-N 0 0 378.816 3.067 20 5 GGBDRN Cn1cc([C@@H]2CSCCN2Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000191740882 1432716060 /nfs/dbraw/zinc/71/60/60/1432716060.db2.gz KYBJBBWKFWVHKT-SFHVURJKSA-N 0 0 398.492 3.019 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000191775041 1432722776 /nfs/dbraw/zinc/72/27/76/1432722776.db2.gz RMTYSJPQJMRAQU-UHFFFAOYSA-N 0 0 375.429 3.306 20 5 GGBDRN CC(=O)Nc1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1C ZINC000191787084 1432724929 /nfs/dbraw/zinc/72/49/29/1432724929.db2.gz UQYVZZJMMLBYLQ-UHFFFAOYSA-N 0 0 377.422 3.279 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCCN(C)c3ccccc32)c1[N+](=O)[O-] ZINC000191788481 1432725476 /nfs/dbraw/zinc/72/54/76/1432725476.db2.gz BNIGMVAGXLEXOA-UHFFFAOYSA-N 0 0 375.450 3.247 20 5 GGBDRN CCC(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000191789031 1432725510 /nfs/dbraw/zinc/72/55/10/1432725510.db2.gz DKAZRVNPKMFOJR-UHFFFAOYSA-N 0 0 377.422 3.361 20 5 GGBDRN Cc1nc(-c2ccc(NS(=O)(=O)c3cc([N+](=O)[O-])c(C)cc3C)cc2)n[nH]1 ZINC000191794389 1432726726 /nfs/dbraw/zinc/72/67/26/1432726726.db2.gz REIPEQSKZHMMMP-UHFFFAOYSA-N 0 0 387.421 3.106 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2cccc(C[S@@](C)=O)c2C)cc1[N+](=O)[O-] ZINC000191796907 1432727194 /nfs/dbraw/zinc/72/71/94/1432727194.db2.gz KZJSSAJFRHFWOK-RUZDIDTESA-N 0 0 396.490 3.199 20 5 GGBDRN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000191806620 1432729801 /nfs/dbraw/zinc/72/98/01/1432729801.db2.gz BPUUDJMDANEWBG-SNVBAGLBSA-N 0 0 379.800 3.496 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(c2ccccc2)[C@@H]2CCOC2)cc1C ZINC000191824514 1432733116 /nfs/dbraw/zinc/73/31/16/1432733116.db2.gz YBLDQGXBJRTGPA-MRXNPFEDSA-N 0 0 376.434 3.196 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(c1ccccc1)[C@@H]1CCOC1 ZINC000191831389 1432734758 /nfs/dbraw/zinc/73/47/58/1432734758.db2.gz VNVXCLYYZKOMRB-QGZVFWFLSA-N 0 0 376.434 3.141 20 5 GGBDRN COc1cc(C(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)cc([N+](=O)[O-])c1C ZINC000191856480 1432741004 /nfs/dbraw/zinc/74/10/04/1432741004.db2.gz WDAZQIISQRWCHE-KRWDZBQOSA-N 0 0 397.431 3.179 20 5 GGBDRN O=C(CCOCC(F)F)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000191858499 1432741222 /nfs/dbraw/zinc/74/12/22/1432741222.db2.gz HXIXPYKCCHFWNB-UHFFFAOYSA-N 0 0 378.331 3.436 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000191873275 1432744407 /nfs/dbraw/zinc/74/44/07/1432744407.db2.gz WQQYFUQJTDSVOI-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000191873263 1432744618 /nfs/dbraw/zinc/74/46/18/1432744618.db2.gz WQQYFUQJTDSVOI-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN COc1cccc(Cl)c1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000191880940 1432745947 /nfs/dbraw/zinc/74/59/47/1432745947.db2.gz ITLQBOCRARMMSB-UHFFFAOYSA-N 0 0 387.779 3.028 20 5 GGBDRN Cc1cccc(C[C@@H](CO)NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000191881456 1432746070 /nfs/dbraw/zinc/74/60/70/1432746070.db2.gz ZUTYBNZSBVPKCM-ZDUSSCGKSA-N 0 0 395.362 3.230 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N(Cc2ccco2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000191895449 1432749817 /nfs/dbraw/zinc/74/98/17/1432749817.db2.gz IKDMOIUOAMRGOA-INIZCTEOSA-N 0 0 394.449 3.175 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCO[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000191917600 1432755187 /nfs/dbraw/zinc/75/51/87/1432755187.db2.gz HHBGKMMLBVODHT-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2ccc(N3C[C@H]4CC[C@@H]3C4)cc2)c([N+](=O)[O-])c1 ZINC000191919494 1432755803 /nfs/dbraw/zinc/75/58/03/1432755803.db2.gz PWZAMAPNHYRACP-KBXCAEBGSA-N 0 0 395.415 3.414 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2-c2nnnn2C(C)C)cc([N+](=O)[O-])c1C ZINC000191949511 1432764480 /nfs/dbraw/zinc/76/44/80/1432764480.db2.gz TVTCVOFDTVYSEM-UHFFFAOYSA-N 0 0 396.407 3.399 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N(c2ccccc2)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000191963390 1432768298 /nfs/dbraw/zinc/76/82/98/1432768298.db2.gz GZACEMZIVSQFLN-INIZCTEOSA-N 0 0 376.434 3.196 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)Cc2ccn(-c3ccc(F)cc3F)n2)c1 ZINC000191973278 1432772295 /nfs/dbraw/zinc/77/22/95/1432772295.db2.gz NKDLIIUYWSNKSD-UHFFFAOYSA-N 0 0 393.371 3.174 20 5 GGBDRN COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000191978391 1432773442 /nfs/dbraw/zinc/77/34/42/1432773442.db2.gz FHOPAKKEVOABAQ-UHFFFAOYSA-N 0 0 398.202 3.165 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NCc2coc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000191988368 1432775552 /nfs/dbraw/zinc/77/55/52/1432775552.db2.gz OCSYSJWABFFHSC-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN Cn1cc([C@H]2CSCCN2C(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)cn1 ZINC000191994121 1432776386 /nfs/dbraw/zinc/77/63/86/1432776386.db2.gz UFAJPIPFQFVQRC-LLCTXKFZSA-N 0 0 392.868 3.312 20 5 GGBDRN C[C@@H](O)[C@](C)(CNC(=O)CSc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000192029248 1432781767 /nfs/dbraw/zinc/78/17/67/1432781767.db2.gz OBMVTPUYMQWEKJ-QRWLVFNGSA-N 0 0 388.489 3.433 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000192039114 1432784358 /nfs/dbraw/zinc/78/43/58/1432784358.db2.gz VSZKRSBKFNJMTN-NVXWUHKLSA-N 0 0 392.477 3.045 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)n1 ZINC000192054627 1432788625 /nfs/dbraw/zinc/78/86/25/1432788625.db2.gz MSMCBQQJDDVOHL-INIZCTEOSA-N 0 0 375.450 3.441 20 5 GGBDRN C[C@H](O)[C@@](C)(CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Cc1ccccc1 ZINC000192060282 1432790158 /nfs/dbraw/zinc/79/01/58/1432790158.db2.gz SYCMXQMTOAWKGL-OYHNWAKOSA-N 0 0 395.459 3.365 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N(c1ccccc1)[C@@H]1CCOC1 ZINC000192070330 1432792880 /nfs/dbraw/zinc/79/28/80/1432792880.db2.gz UBXVVDVYCGZIQC-QGZVFWFLSA-N 0 0 378.388 3.216 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N(c1ccccc1)[C@H]1CCOC1 ZINC000192076988 1432793944 /nfs/dbraw/zinc/79/39/44/1432793944.db2.gz NYHHOJWERGHLTL-INIZCTEOSA-N 0 0 378.388 3.216 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)CC(C)(C)O)cc1[N+](=O)[O-] ZINC000192125652 1432802136 /nfs/dbraw/zinc/80/21/36/1432802136.db2.gz SSPNFYBYKHXBIM-UHFFFAOYSA-N 0 0 392.477 3.173 20 5 GGBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OCc1nnnn1CC(F)(F)F ZINC000192136635 1432804680 /nfs/dbraw/zinc/80/46/80/1432804680.db2.gz RXKIDYUPIMKPRU-UHFFFAOYSA-N 0 0 393.325 3.313 20 5 GGBDRN CCc1c(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cnn1-c1ccccc1C ZINC000192138648 1432805036 /nfs/dbraw/zinc/80/50/36/1432805036.db2.gz VIJBSLQPVWJSGC-UHFFFAOYSA-N 0 0 396.451 3.493 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000192145770 1432807080 /nfs/dbraw/zinc/80/70/80/1432807080.db2.gz NSXLUCGOICIDPM-IBGZPJMESA-N 0 0 388.445 3.032 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000192156034 1432809339 /nfs/dbraw/zinc/80/93/39/1432809339.db2.gz KRMWCNALWNPRTD-LPHOPBHVSA-N 0 0 397.431 3.044 20 5 GGBDRN CCOC(=O)c1csc(C2CCN(c3nc(C)ccc3[N+](=O)[O-])CC2)n1 ZINC000192241356 1432821501 /nfs/dbraw/zinc/82/15/01/1432821501.db2.gz NALWEKTYKVTVSI-UHFFFAOYSA-N 0 0 376.438 3.315 20 5 GGBDRN COc1ccc(NC(=O)CN2CCc3cc(Cl)ccc3C2)c([N+](=O)[O-])c1 ZINC000192243352 1432821793 /nfs/dbraw/zinc/82/17/93/1432821793.db2.gz OMWSIFGAUABXEW-UHFFFAOYSA-N 0 0 375.812 3.254 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000192251038 1432822787 /nfs/dbraw/zinc/82/27/87/1432822787.db2.gz PLMVVAKKFCAJSC-UHFFFAOYSA-N 0 0 396.451 3.092 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC(c2ccncc2)CC1 ZINC000192259236 1432823627 /nfs/dbraw/zinc/82/36/27/1432823627.db2.gz MMMGVTKBLSBLKN-UHFFFAOYSA-N 0 0 375.450 3.175 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000192259563 1432823723 /nfs/dbraw/zinc/82/37/23/1432823723.db2.gz GBWAPRIEUXGRBW-UHFFFAOYSA-N 0 0 396.451 3.092 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCC(c3ccncc3)CC2)cc1[N+](=O)[O-] ZINC000192260778 1432823863 /nfs/dbraw/zinc/82/38/63/1432823863.db2.gz BFWHWVPSHCEVNR-UHFFFAOYSA-N 0 0 375.450 3.175 20 5 GGBDRN CC(C)Oc1ccc(N(C)C(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000192264231 1432824310 /nfs/dbraw/zinc/82/43/10/1432824310.db2.gz KHSXFNZRVKVKSX-AWEZNQCLSA-N 0 0 385.420 3.163 20 5 GGBDRN COc1cccc(Cl)c1CNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000192266113 1432824570 /nfs/dbraw/zinc/82/45/70/1432824570.db2.gz LGQRQGHRLKQSJD-UHFFFAOYSA-N 0 0 391.811 3.129 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000192266428 1432824842 /nfs/dbraw/zinc/82/48/42/1432824842.db2.gz DBAYMRAFRLMKNC-WMZOPIPTSA-N 0 0 390.461 3.268 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c1C ZINC000192268294 1432825143 /nfs/dbraw/zinc/82/51/43/1432825143.db2.gz XRHNMRAXTXCUJH-LPHOPBHVSA-N 0 0 390.461 3.268 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000192268251 1432825153 /nfs/dbraw/zinc/82/51/53/1432825153.db2.gz NTTKVIPJYRRTIF-LPHOPBHVSA-N 0 0 390.461 3.268 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)c3c(C)cc(C)c([N+](=O)[O-])c3C)C2=O)cc1 ZINC000192284062 1432827287 /nfs/dbraw/zinc/82/72/87/1432827287.db2.gz ODLWEABOMLMFGY-GOSISDBHSA-N 0 0 395.459 3.359 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000192286709 1432827447 /nfs/dbraw/zinc/82/74/47/1432827447.db2.gz AEAJPHACVNNWDZ-UHFFFAOYSA-N 0 0 376.434 3.099 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000192295040 1432828565 /nfs/dbraw/zinc/82/85/65/1432828565.db2.gz AHTPZHRCJXNEHO-UHFFFAOYSA-N 0 0 376.434 3.099 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)c3c(Cl)cccc3[N+](=O)[O-])C2=O)cc1 ZINC000192298416 1432829006 /nfs/dbraw/zinc/82/90/06/1432829006.db2.gz SYLOIQGXCRDOBK-OAHLLOKOSA-N 0 0 387.823 3.088 20 5 GGBDRN CSc1cccc(C(=O)N[C@@H]2CCN(Cc3ccc(C)cc3)C2=O)c1[N+](=O)[O-] ZINC000192298846 1432829009 /nfs/dbraw/zinc/82/90/09/1432829009.db2.gz HVDQSCIDFQEWGT-MRXNPFEDSA-N 0 0 399.472 3.156 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H]1CCCc2c(O)cccc21 ZINC000192327304 1432832360 /nfs/dbraw/zinc/83/23/60/1432832360.db2.gz DNFAUTIWLWQNHB-CQSZACIVSA-N 0 0 389.795 3.086 20 5 GGBDRN COCCOc1ccc(CC(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)cc1 ZINC000192341227 1432833819 /nfs/dbraw/zinc/83/38/19/1432833819.db2.gz JZEYRTBMMMKBON-UHFFFAOYSA-N 0 0 396.403 3.191 20 5 GGBDRN COc1cc(C(=O)Nc2nnn(Cc3ccccc3F)c2C)cc([N+](=O)[O-])c1C ZINC000192376550 1432838961 /nfs/dbraw/zinc/83/89/61/1432838961.db2.gz YEPKJJQIWNLHQP-UHFFFAOYSA-N 0 0 399.382 3.251 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccn1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192421532 1432842988 /nfs/dbraw/zinc/84/29/88/1432842988.db2.gz JADWJXLAIMSBCV-UHFFFAOYSA-N 0 0 395.341 3.363 20 5 GGBDRN NC(=O)CN(Cc1ccccc1)c1cccc(Nc2ncc([N+](=O)[O-])s2)c1 ZINC000192450688 1432846327 /nfs/dbraw/zinc/84/63/27/1432846327.db2.gz QPFOJQIIIKHMIT-UHFFFAOYSA-N 0 0 383.433 3.287 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000192463886 1432847742 /nfs/dbraw/zinc/84/77/42/1432847742.db2.gz MKFIZGPDTJJNCI-UHFFFAOYSA-N 0 0 379.376 3.385 20 5 GGBDRN C[C@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192463610 1432847758 /nfs/dbraw/zinc/84/77/58/1432847758.db2.gz WTDSPMIMUIURAN-HNNXBMFYSA-N 0 0 384.436 3.039 20 5 GGBDRN COc1cc(C(=O)Nc2n[nH]c(-c3ccc(C)o3)c2C)c([N+](=O)[O-])cc1OC ZINC000192473125 1432848960 /nfs/dbraw/zinc/84/89/60/1432848960.db2.gz IGCPWSMUUNEGCQ-UHFFFAOYSA-N 0 0 386.364 3.464 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCCN(Cc3cn4cc(Cl)ccc4n3)CC2)s1 ZINC000192476044 1432849190 /nfs/dbraw/zinc/84/91/90/1432849190.db2.gz UZYSMFABVIWIPC-UHFFFAOYSA-N 0 0 392.872 3.065 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1 ZINC000192484852 1432850188 /nfs/dbraw/zinc/85/01/88/1432850188.db2.gz YWZCWLAUIVPVSN-UHFFFAOYSA-N 0 0 381.388 3.195 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)no2)c1[N+](=O)[O-] ZINC000192493654 1432850795 /nfs/dbraw/zinc/85/07/95/1432850795.db2.gz PYOWLAVFILFPCT-AWEZNQCLSA-N 0 0 396.407 3.298 20 5 GGBDRN CCC[C@H](Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000192511828 1432853162 /nfs/dbraw/zinc/85/31/62/1432853162.db2.gz MOAXTZZMCKVJNV-INIZCTEOSA-N 0 0 385.420 3.451 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000192511552 1432853287 /nfs/dbraw/zinc/85/32/87/1432853287.db2.gz BUMGRBDCUGRSCX-GFCCVEGCSA-N 0 0 392.847 3.023 20 5 GGBDRN CCOCCOc1ccc(Cl)cc1NC(=O)c1n[nH]c(CC)c1[N+](=O)[O-] ZINC000192514452 1432853500 /nfs/dbraw/zinc/85/35/00/1432853500.db2.gz WYVGUVWEINLHOU-UHFFFAOYSA-N 0 0 382.804 3.201 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000192513555 1432853560 /nfs/dbraw/zinc/85/35/60/1432853560.db2.gz UAAWEZKFHQZUHO-UHFFFAOYSA-N 0 0 379.411 3.474 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000192521854 1432854368 /nfs/dbraw/zinc/85/43/68/1432854368.db2.gz OXWRFZOCAXFYOA-INIZCTEOSA-N 0 0 376.796 3.471 20 5 GGBDRN O=C(COc1cccc2ccccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192522480 1432854411 /nfs/dbraw/zinc/85/44/11/1432854411.db2.gz CLWYFRVSUNNDCB-UHFFFAOYSA-N 0 0 391.427 3.476 20 5 GGBDRN Cc1c(NC(=O)c2ccccc2S(=O)(=O)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000192523943 1432854573 /nfs/dbraw/zinc/85/45/73/1432854573.db2.gz XFQHIWBGLAQZIS-UHFFFAOYSA-N 0 0 388.323 3.449 20 5 GGBDRN Cc1nc2ccccc2cc1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192522705 1432854659 /nfs/dbraw/zinc/85/46/59/1432854659.db2.gz ISGBXTQOFALQFN-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3ccccc3)C(C)(C)C2)c1[N+](=O)[O-] ZINC000192528441 1432855134 /nfs/dbraw/zinc/85/51/34/1432855134.db2.gz ZZSMLPZOWPGURM-UHFFFAOYSA-N 0 0 383.448 3.340 20 5 GGBDRN Cc1cc(NC(=O)Cn2c(C)nc3ccccc32)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000192531796 1432855769 /nfs/dbraw/zinc/85/57/69/1432855769.db2.gz DZAKVONPSNKTFC-UHFFFAOYSA-N 0 0 390.403 3.386 20 5 GGBDRN O=C1C[C@@H](Nc2ncc([N+](=O)[O-])s2)CN1Cc1ccccc1C(F)(F)F ZINC000192533488 1432856049 /nfs/dbraw/zinc/85/60/49/1432856049.db2.gz WOGLLWPLFPSUSO-SNVBAGLBSA-N 0 0 386.355 3.283 20 5 GGBDRN O=C([C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CCC[C@H]1c1ccccc1 ZINC000192535869 1432856275 /nfs/dbraw/zinc/85/62/75/1432856275.db2.gz ZAASQYMVPQUGRT-YJBOKZPZSA-N 0 0 397.406 3.451 20 5 GGBDRN C[C@H]1CN(Cc2ccc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000192534359 1432856372 /nfs/dbraw/zinc/85/63/72/1432856372.db2.gz BBMIKSLSOYTKJI-IRXDYDNUSA-N 0 0 397.475 3.476 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC(O)(c3cccc(OC(F)(F)F)c3)CC2)s1 ZINC000192538891 1432856845 /nfs/dbraw/zinc/85/68/45/1432856845.db2.gz JNFYZGZRDBPSLN-UHFFFAOYSA-N 0 0 389.355 3.438 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](c2ccccc2)c2ccccc2OC)c1[N+](=O)[O-] ZINC000192544208 1432857496 /nfs/dbraw/zinc/85/74/96/1432857496.db2.gz NMFVMCAYSWBECK-QGZVFWFLSA-N 0 0 380.404 3.408 20 5 GGBDRN C[C@H]1CN(c2ccc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)cn2)C[C@H](C)O1 ZINC000192550971 1432858398 /nfs/dbraw/zinc/85/83/98/1432858398.db2.gz LCDINDJLGGAZTQ-QWRGUYRKSA-N 0 0 392.362 3.134 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000192556797 1432859449 /nfs/dbraw/zinc/85/94/49/1432859449.db2.gz QKRYEHWYJKFMHP-UHFFFAOYSA-N 0 0 375.404 3.114 20 5 GGBDRN CCc1n[nH]c(C(=O)N2C[C@H](c3ccccc3Cl)OC[C@H]2C)c1[N+](=O)[O-] ZINC000192559441 1432859783 /nfs/dbraw/zinc/85/97/83/1432859783.db2.gz HMTCBHBGILMFJF-QMTHXVAHSA-N 0 0 378.816 3.136 20 5 GGBDRN Cc1c(NC(=O)N2CCCN(C(=O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000192579569 1432862465 /nfs/dbraw/zinc/86/24/65/1432862465.db2.gz HMIKBMUQSRHZHW-UHFFFAOYSA-N 0 0 382.420 3.283 20 5 GGBDRN COc1cccc(COC[C@@H](O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000192586906 1432863130 /nfs/dbraw/zinc/86/31/30/1432863130.db2.gz GTUZJEQVMGBQIR-KRWDZBQOSA-N 0 0 394.855 3.266 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1Nc1ccc2c(c1)CCN2C(=O)c1cccnc1 ZINC000192595736 1432864137 /nfs/dbraw/zinc/86/41/37/1432864137.db2.gz GJEQXUQGGGOMAZ-UHFFFAOYSA-N 0 0 392.419 3.461 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 ZINC000192619504 1432866941 /nfs/dbraw/zinc/86/69/41/1432866941.db2.gz KODKDWYAGOHKPG-UHFFFAOYSA-N 0 0 381.432 3.064 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Oc1cccc2ncccc21 ZINC000192621306 1432867498 /nfs/dbraw/zinc/86/74/98/1432867498.db2.gz IXEHDWQJXMKSTD-UHFFFAOYSA-N 0 0 393.355 3.437 20 5 GGBDRN CC(C)C(CNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)C(C)C ZINC000192632361 1432868881 /nfs/dbraw/zinc/86/88/81/1432868881.db2.gz RAVFBEWIYUFDOH-UHFFFAOYSA-N 0 0 377.441 3.327 20 5 GGBDRN O=C([C@@H]1CSCCS1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000192634311 1432869224 /nfs/dbraw/zinc/86/92/24/1432869224.db2.gz UAKJWPSWQMBBBV-LBPRGKRZSA-N 0 0 380.413 3.334 20 5 GGBDRN CC(C)[C@H](CNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccccc1 ZINC000192659051 1432872377 /nfs/dbraw/zinc/87/23/77/1432872377.db2.gz SOXGNLFOWMBFKB-INIZCTEOSA-N 0 0 390.461 3.168 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Oc2ccc(Br)cc2F)c1 ZINC000192671452 1432873776 /nfs/dbraw/zinc/87/37/76/1432873776.db2.gz VCLCFLQEVZXIBV-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CCSCc2ccccc2)CC1 ZINC000192681167 1432874768 /nfs/dbraw/zinc/87/47/68/1432874768.db2.gz TZWACUIYUDGVCX-UHFFFAOYSA-N 0 0 385.489 3.286 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)NCCc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000192682979 1432875016 /nfs/dbraw/zinc/87/50/16/1432875016.db2.gz SXBOILUTQZLOJC-UHFFFAOYSA-N 0 0 398.440 3.124 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCCN1C(=O)c1cccs1 ZINC000192689311 1432875661 /nfs/dbraw/zinc/87/56/61/1432875661.db2.gz RXEZBOUWKJVWBF-CQSZACIVSA-N 0 0 389.433 3.298 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N3CCCC[C@@H]3CCO)cc2[N+](=O)[O-])CC1 ZINC000192698602 1432876718 /nfs/dbraw/zinc/87/67/18/1432876718.db2.gz OZLOYVOVXMLSDH-QGZVFWFLSA-N 0 0 375.469 3.208 20 5 GGBDRN O=C1CCCN1c1ccc(Cl)c(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000192719771 1432879469 /nfs/dbraw/zinc/87/94/69/1432879469.db2.gz SXCKYQQSADMSMN-UHFFFAOYSA-N 0 0 395.824 3.176 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@@H](c2cccc(OC(F)F)c2)C1 ZINC000192727359 1432880748 /nfs/dbraw/zinc/88/07/48/1432880748.db2.gz FPDJKAAIHLUQJK-CQSZACIVSA-N 0 0 382.367 3.299 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000192727077 1432880833 /nfs/dbraw/zinc/88/08/33/1432880833.db2.gz WYHHAFDCHKCORZ-OAHLLOKOSA-N 0 0 394.786 3.003 20 5 GGBDRN COC(=O)[C@H](CNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000192734062 1432882081 /nfs/dbraw/zinc/88/20/81/1432882081.db2.gz JKQJBKSJSMSDLJ-MRXNPFEDSA-N 0 0 388.395 3.346 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000192747887 1432884120 /nfs/dbraw/zinc/88/41/20/1432884120.db2.gz PVMUBJWVUZAEKG-BZNIZROVSA-N 0 0 392.358 3.050 20 5 GGBDRN COc1cc(CCNC(=O)c2cc3ccc(C)cc3[nH]2)c([N+](=O)[O-])cc1OC ZINC000192747107 1432884133 /nfs/dbraw/zinc/88/41/33/1432884133.db2.gz ORRQILVOQCIXAT-UHFFFAOYSA-N 0 0 383.404 3.374 20 5 GGBDRN COC(=O)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000192763018 1432886473 /nfs/dbraw/zinc/88/64/73/1432886473.db2.gz WBORIDJKIREWBI-CQSZACIVSA-N 0 0 380.759 3.074 20 5 GGBDRN CCO[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000192766287 1432887288 /nfs/dbraw/zinc/88/72/88/1432887288.db2.gz BZRDSBLAWAVCSX-IBGZPJMESA-N 0 0 380.404 3.288 20 5 GGBDRN CCO[C@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000192766306 1432887379 /nfs/dbraw/zinc/88/73/79/1432887379.db2.gz BZRDSBLAWAVCSX-LJQANCHMSA-N 0 0 380.404 3.288 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000192768689 1432887653 /nfs/dbraw/zinc/88/76/53/1432887653.db2.gz MAVJOVBSODSERU-HNNXBMFYSA-N 0 0 380.759 3.074 20 5 GGBDRN CCO[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1 ZINC000192781403 1432890169 /nfs/dbraw/zinc/89/01/69/1432890169.db2.gz FBNVJZSXNDBLOC-LJQANCHMSA-N 0 0 380.404 3.288 20 5 GGBDRN CCO[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1 ZINC000192788123 1432890998 /nfs/dbraw/zinc/89/09/98/1432890998.db2.gz HPPJTNFUIKHKLX-IBGZPJMESA-N 0 0 380.404 3.288 20 5 GGBDRN COc1cc(C)c(CN(C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cc1OC ZINC000192794072 1432892031 /nfs/dbraw/zinc/89/20/31/1432892031.db2.gz XEYMAZMPNYBKOF-UHFFFAOYSA-N 0 0 397.435 3.268 20 5 GGBDRN C[C@@]1(c2ccc(F)cc2F)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000192804893 1432893079 /nfs/dbraw/zinc/89/30/79/1432893079.db2.gz UDKNHCQRMDEXAG-KRWDZBQOSA-N 0 0 395.749 3.494 20 5 GGBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CCOC[C@@H]1C1CC1 ZINC000192805463 1432893115 /nfs/dbraw/zinc/89/31/15/1432893115.db2.gz ARRWDIKFIYOSFJ-HXUWFJFHSA-N 0 0 382.416 3.425 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2csc(-c3ccccc3)n2)cc1 ZINC000192856040 1432899702 /nfs/dbraw/zinc/89/97/02/1432899702.db2.gz GDTQCPXLNBVASJ-UHFFFAOYSA-N 0 0 389.458 3.338 20 5 GGBDRN O=C(Nc1nnc2n1CCCC2)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192865420 1432900683 /nfs/dbraw/zinc/90/06/83/1432900683.db2.gz WSVBYCSDDPFZDO-UHFFFAOYSA-N 0 0 393.403 3.354 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1 ZINC000192892557 1432903763 /nfs/dbraw/zinc/90/37/63/1432903763.db2.gz QMHHNLQETBWQGH-UHFFFAOYSA-N 0 0 396.230 3.290 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])CC1 ZINC000192891501 1432903782 /nfs/dbraw/zinc/90/37/82/1432903782.db2.gz WQGDKAWQBCSZHA-UHFFFAOYSA-N 0 0 391.468 3.104 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000192916449 1432907248 /nfs/dbraw/zinc/90/72/48/1432907248.db2.gz ZCZRRNRAKIEHPV-UHFFFAOYSA-N 0 0 392.419 3.135 20 5 GGBDRN CCOC(=O)[C@]1(C(C)C)CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000192947392 1432911658 /nfs/dbraw/zinc/91/16/58/1432911658.db2.gz WGZICQNYEMHVNZ-HXUWFJFHSA-N 0 0 389.452 3.221 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000192947403 1432911674 /nfs/dbraw/zinc/91/16/74/1432911674.db2.gz WGZICQNYEMHVNZ-FQEVSTJZSA-N 0 0 389.452 3.221 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(CN2C[C@@H](C)O[C@@H](C)C2)cs1 ZINC000192954600 1432912615 /nfs/dbraw/zinc/91/26/15/1432912615.db2.gz HSIRPBDPQYEQHX-BETUJISGSA-N 0 0 390.465 3.221 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(CN2C[C@@H](C)O[C@H](C)C2)cs1 ZINC000192954621 1432912666 /nfs/dbraw/zinc/91/26/66/1432912666.db2.gz HSIRPBDPQYEQHX-CHWSQXEVSA-N 0 0 390.465 3.221 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1N1CCN(Cc2nc(-c3cccs3)no2)CC1 ZINC000192964247 1432914279 /nfs/dbraw/zinc/91/42/79/1432914279.db2.gz RPIVLTGFNOMBKM-UHFFFAOYSA-N 0 0 389.412 3.168 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@H]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000192999281 1432919679 /nfs/dbraw/zinc/91/96/79/1432919679.db2.gz PNDQREWIZVWPCY-ZFWWWQNUSA-N 0 0 379.457 3.375 20 5 GGBDRN Cc1nc(Cl)ccc1NC(=O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000193007380 1432921418 /nfs/dbraw/zinc/92/14/18/1432921418.db2.gz SUTLVPJRFUXYBO-UHFFFAOYSA-N 0 0 390.827 3.029 20 5 GGBDRN CCCc1csc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000193007361 1432921602 /nfs/dbraw/zinc/92/16/02/1432921602.db2.gz CPKYWJLLNHGBRZ-UHFFFAOYSA-N 0 0 390.465 3.081 20 5 GGBDRN COc1cc(NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(OC)cc1Cl ZINC000193009630 1432921878 /nfs/dbraw/zinc/92/18/78/1432921878.db2.gz KQEKOEKFWSXDDR-UHFFFAOYSA-N 0 0 391.811 3.267 20 5 GGBDRN C[C@H](CC1CCCCC1)NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000193018627 1432922944 /nfs/dbraw/zinc/92/29/44/1432922944.db2.gz MAVWLUJLOHVDCQ-GFCCVEGCSA-N 0 0 379.482 3.261 20 5 GGBDRN COc1ccccc1N1CC[C@@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1=O ZINC000193019076 1432922998 /nfs/dbraw/zinc/92/29/98/1432922998.db2.gz BRWNMRAYHOUIMG-ZWKOTPCHSA-N 0 0 381.432 3.376 20 5 GGBDRN COc1cccc([C@@H]2CCCN2C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000193036516 1432925502 /nfs/dbraw/zinc/92/55/02/1432925502.db2.gz IHCAOTTZRBNJID-IBGZPJMESA-N 0 0 397.431 3.005 20 5 GGBDRN COc1ccc2c(c1)C(=O)N(C1CC1)[C@H](c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N2 ZINC000193043575 1432926618 /nfs/dbraw/zinc/92/66/18/1432926618.db2.gz NGRMYEUYWKYSFU-QGZVFWFLSA-N 0 0 384.348 3.241 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cccc(OC(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000193072703 1432932141 /nfs/dbraw/zinc/93/21/41/1432932141.db2.gz IPMCKEPIAAYOLS-UHFFFAOYSA-N 0 0 397.309 3.170 20 5 GGBDRN O=C(NCc1ccc(NC(=O)c2ccco2)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000193097437 1432935292 /nfs/dbraw/zinc/93/52/92/1432935292.db2.gz OWVVWKTVMWKHNA-UHFFFAOYSA-N 0 0 394.387 3.440 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 ZINC000193129684 1432941122 /nfs/dbraw/zinc/94/11/22/1432941122.db2.gz HLAOVKKWQPJKDK-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN COc1ccc(N2C[C@H](C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)CC2=O)cc1 ZINC000193137164 1432942597 /nfs/dbraw/zinc/94/25/97/1432942597.db2.gz XPHHNIKPBRMMDJ-CQSZACIVSA-N 0 0 383.404 3.212 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)OCO2)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000193152992 1432945949 /nfs/dbraw/zinc/94/59/49/1432945949.db2.gz MMOXTAZTQWGCAX-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccccn3)no2)ccc1[N+](=O)[O-] ZINC000193158514 1432947394 /nfs/dbraw/zinc/94/73/94/1432947394.db2.gz DAAPIFVOKDELCB-MRXNPFEDSA-N 0 0 379.376 3.326 20 5 GGBDRN Cc1ccc(Cc2cnc(NC(=O)Cn3cc([N+](=O)[O-])cn3)s2)cc1Cl ZINC000193160603 1432947652 /nfs/dbraw/zinc/94/76/52/1432947652.db2.gz DCBHRPZCYJFBSZ-UHFFFAOYSA-N 0 0 391.840 3.439 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Cl)CC2)cc1 ZINC000193161053 1432947658 /nfs/dbraw/zinc/94/76/58/1432947658.db2.gz MRCWMAKYXRNAEL-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(F)cc1F ZINC000193173158 1432950458 /nfs/dbraw/zinc/95/04/58/1432950458.db2.gz FQVLVMGWGSMAAL-UHFFFAOYSA-N 0 0 379.319 3.324 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2cccc(Cl)c2)CC1 ZINC000193183021 1432952512 /nfs/dbraw/zinc/95/25/12/1432952512.db2.gz DMMPAEDAXJAAAJ-UHFFFAOYSA-N 0 0 388.811 3.238 20 5 GGBDRN CSc1ccc(C(=O)NCCNC(=O)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000193198928 1432956449 /nfs/dbraw/zinc/95/64/49/1432956449.db2.gz ODFUMRAVQAMVQM-UHFFFAOYSA-N 0 0 393.852 3.130 20 5 GGBDRN O=[N+]([O-])c1ccc(F)c(NS(=O)(=O)c2ccccc2OC(F)(F)F)c1 ZINC000193203597 1432957411 /nfs/dbraw/zinc/95/74/11/1432957411.db2.gz QRZQVXUHSDFCDY-UHFFFAOYSA-N 0 0 380.275 3.433 20 5 GGBDRN C[C@H](C(=O)Nc1nc(-c2cccs2)nn1C)c1ccc([N+](=O)[O-])cc1F ZINC000193212351 1432958807 /nfs/dbraw/zinc/95/88/07/1432958807.db2.gz WAKDPRUCMPCEPN-VIFPVBQESA-N 0 0 375.385 3.333 20 5 GGBDRN C[C@@H](c1ccccc1)N1C[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC1=O ZINC000193230213 1432963215 /nfs/dbraw/zinc/96/32/15/1432963215.db2.gz PTQNMIISHZCSEA-YJBOKZPZSA-N 0 0 381.432 3.163 20 5 GGBDRN COc1cc(CCNC(=O)NCc2cc3ccccc3o2)c([N+](=O)[O-])cc1OC ZINC000193230723 1432963288 /nfs/dbraw/zinc/96/32/88/1432963288.db2.gz VVKRPUSBZAUYSA-UHFFFAOYSA-N 0 0 399.403 3.400 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cccs1)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193231234 1432963380 /nfs/dbraw/zinc/96/33/80/1432963380.db2.gz GUPKTHHARUVXCR-MRXNPFEDSA-N 0 0 375.450 3.069 20 5 GGBDRN CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193232217 1432963691 /nfs/dbraw/zinc/96/36/91/1432963691.db2.gz GSGHOJRDIBCUQW-FQEVSTJZSA-N 0 0 381.432 3.089 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CCCOc1ccc2c(c1)CCC(=O)N2 ZINC000193236271 1432964362 /nfs/dbraw/zinc/96/43/62/1432964362.db2.gz FJQLZEAUYAVNIL-UHFFFAOYSA-N 0 0 397.431 3.297 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N2CCO[C@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000193238126 1432965392 /nfs/dbraw/zinc/96/53/92/1432965392.db2.gz LRMJPJIUTRWZJV-KUHUBIRLSA-N 0 0 387.411 3.443 20 5 GGBDRN COc1cc(CCNC(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000193245343 1432966640 /nfs/dbraw/zinc/96/66/40/1432966640.db2.gz ANKBOHSAQYLLID-CYBMUJFWSA-N 0 0 385.420 3.315 20 5 GGBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000193245944 1432966715 /nfs/dbraw/zinc/96/67/15/1432966715.db2.gz OUIRNPMXXDTWOM-JTQLQIEISA-N 0 0 398.387 3.110 20 5 GGBDRN CCS(=O)(=O)C1CCN(Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000193251708 1432967836 /nfs/dbraw/zinc/96/78/36/1432967836.db2.gz LTAQYPVTLWLIOJ-UHFFFAOYSA-N 0 0 385.485 3.345 20 5 GGBDRN C[C@H]1CCC[C@H](C)C1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000193258504 1432969255 /nfs/dbraw/zinc/96/92/55/1432969255.db2.gz HCOGRKXREWTXPH-RYUDHWBXSA-N 0 0 389.481 3.429 20 5 GGBDRN Cc1cc(=O)c(C(=O)NC2[C@H](C)CCC[C@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000193262929 1432970476 /nfs/dbraw/zinc/97/04/76/1432970476.db2.gz LYKQCUDOXQBSHL-CHWSQXEVSA-N 0 0 384.436 3.004 20 5 GGBDRN Cc1cc(=O)c(C(=O)N(C)[C@H]2CCC[C@@H](C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000193286405 1432974360 /nfs/dbraw/zinc/97/43/60/1432974360.db2.gz KAWIFVOGCODISD-HIFRSBDPSA-N 0 0 384.436 3.100 20 5 GGBDRN O=C(NCCSc1ccccc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000193309759 1432977105 /nfs/dbraw/zinc/97/71/05/1432977105.db2.gz BGNHDILNSCLKLP-UHFFFAOYSA-N 0 0 386.477 3.219 20 5 GGBDRN CCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000193312757 1432977676 /nfs/dbraw/zinc/97/76/76/1432977676.db2.gz ZUBHPIHMCQHRAE-LBPRGKRZSA-N 0 0 397.353 3.385 20 5 GGBDRN CCCOc1ccc(CNC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000193317149 1432978448 /nfs/dbraw/zinc/97/84/48/1432978448.db2.gz GDGXGNXWVGCWJO-UHFFFAOYSA-N 0 0 398.463 3.415 20 5 GGBDRN COc1cc(C(=O)Oc2c(F)c(F)cc(F)c2F)c([N+](=O)[O-])cc1OC ZINC000193346015 1432983546 /nfs/dbraw/zinc/98/35/46/1432983546.db2.gz AEFSPYWUQXVEMC-UHFFFAOYSA-N 0 0 375.230 3.388 20 5 GGBDRN CCc1nc(NC(=O)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)sc1C ZINC000193353356 1432984464 /nfs/dbraw/zinc/98/44/64/1432984464.db2.gz GIKRIVBNTYQWRL-UHFFFAOYSA-N 0 0 388.449 3.052 20 5 GGBDRN CCCc1csc(NC(=O)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000193353369 1432984496 /nfs/dbraw/zinc/98/44/96/1432984496.db2.gz FBDYNNAMTDYIFQ-UHFFFAOYSA-N 0 0 388.449 3.134 20 5 GGBDRN COc1cc(C)c(CN(C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1OC ZINC000193369257 1432986502 /nfs/dbraw/zinc/98/65/02/1432986502.db2.gz YAVOMIIVPRYTIV-UHFFFAOYSA-N 0 0 397.435 3.268 20 5 GGBDRN CC(C)C(=O)Nc1nc(CC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cs1 ZINC000193387096 1432989070 /nfs/dbraw/zinc/98/90/70/1432989070.db2.gz HUMGSWIZSJULSF-UHFFFAOYSA-N 0 0 384.364 3.105 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@@H]2CCCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000193391142 1432989760 /nfs/dbraw/zinc/98/97/60/1432989760.db2.gz DVTONDRCCDWWNK-MRXNPFEDSA-N 0 0 375.450 3.150 20 5 GGBDRN Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1C(=O)N(C)C(C)C ZINC000193393455 1432989994 /nfs/dbraw/zinc/98/99/94/1432989994.db2.gz WQXXDXZZSFVAEB-UHFFFAOYSA-N 0 0 385.420 3.401 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2 ZINC000193409485 1432992850 /nfs/dbraw/zinc/99/28/50/1432992850.db2.gz YJGBJYFMYYQODC-LLVKDONJSA-N 0 0 380.404 3.155 20 5 GGBDRN C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2 ZINC000193409471 1432992892 /nfs/dbraw/zinc/99/28/92/1432992892.db2.gz YJGBJYFMYYQODC-NSHDSACASA-N 0 0 380.404 3.155 20 5 GGBDRN C[C@@H](CN1CCCC1=O)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000193409153 1432993012 /nfs/dbraw/zinc/99/30/12/1432993012.db2.gz XTCYIHSUNRBHSC-AWEZNQCLSA-N 0 0 399.472 3.487 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 ZINC000193413303 1432993751 /nfs/dbraw/zinc/99/37/51/1432993751.db2.gz NWLVIWOJRFHNHF-SNVBAGLBSA-N 0 0 393.346 3.040 20 5 GGBDRN CCn1c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1ccccn1 ZINC000193428323 1432996772 /nfs/dbraw/zinc/99/67/72/1432996772.db2.gz AMNANGDKIYBOQQ-LBPRGKRZSA-N 0 0 398.448 3.388 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000193437968 1432999203 /nfs/dbraw/zinc/99/92/03/1432999203.db2.gz MRBRDDOWCVJHOZ-DZGCQCFKSA-N 0 0 383.404 3.152 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000193449410 1433001199 /nfs/dbraw/zinc/00/11/99/1433001199.db2.gz LGFCFIMJJHFWGS-UHFFFAOYSA-N 0 0 380.744 3.487 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000193451280 1433001528 /nfs/dbraw/zinc/00/15/28/1433001528.db2.gz YMAHWZLJQSPMMQ-KUHUBIRLSA-N 0 0 377.441 3.277 20 5 GGBDRN O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000193457645 1433002500 /nfs/dbraw/zinc/00/25/00/1433002500.db2.gz SWVCOXZLFPHJIC-UHFFFAOYSA-N 0 0 386.383 3.160 20 5 GGBDRN C[C@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccc(OCC(F)(F)F)cc1 ZINC000193464008 1433003465 /nfs/dbraw/zinc/00/34/65/1433003465.db2.gz NEJGYERRGJXLLY-VIFPVBQESA-N 0 0 385.298 3.128 20 5 GGBDRN C[C@@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccc(OCC(F)(F)F)cc1 ZINC000193464020 1433003510 /nfs/dbraw/zinc/00/35/10/1433003510.db2.gz NEJGYERRGJXLLY-SECBINFHSA-N 0 0 385.298 3.128 20 5 GGBDRN COc1ccc([C@H](C)N(C)C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000193482816 1433006733 /nfs/dbraw/zinc/00/67/33/1433006733.db2.gz SKDYSJLGALRDJZ-NSHDSACASA-N 0 0 391.811 3.415 20 5 GGBDRN CCN(C(=O)Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)[C@@H](C)c1ccc(F)cc1 ZINC000193496861 1433009245 /nfs/dbraw/zinc/00/92/45/1433009245.db2.gz DNFNGETYRBQYDV-ZDUSSCGKSA-N 0 0 398.394 3.054 20 5 GGBDRN CCN(C(=O)Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)[C@H](C)c1ccc(F)cc1 ZINC000193496877 1433009420 /nfs/dbraw/zinc/00/94/20/1433009420.db2.gz DNFNGETYRBQYDV-CYBMUJFWSA-N 0 0 398.394 3.054 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000193502502 1433010316 /nfs/dbraw/zinc/01/03/16/1433010316.db2.gz YRKVVMAEORAQPF-UHFFFAOYSA-N 0 0 376.359 3.486 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2F)c1 ZINC000193507800 1433011214 /nfs/dbraw/zinc/01/12/14/1433011214.db2.gz MYFRCOZLNNYZBT-JTQLQIEISA-N 0 0 377.397 3.213 20 5 GGBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000193515012 1433012285 /nfs/dbraw/zinc/01/22/85/1433012285.db2.gz FBYZWBFRYHVXBS-LLVKDONJSA-N 0 0 399.382 3.123 20 5 GGBDRN C[C@H]1C[C@H]1c1ccc(CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000193530834 1433015400 /nfs/dbraw/zinc/01/54/00/1433015400.db2.gz ITEZJICQGRDQKX-YVEFUNNKSA-N 0 0 383.404 3.441 20 5 GGBDRN CC[C@H](c1nnc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)s1)c1ccccc1 ZINC000193560591 1433019946 /nfs/dbraw/zinc/01/99/46/1433019946.db2.gz BONHLKFWPPIDKD-LBPRGKRZSA-N 0 0 385.405 3.341 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C2CC2)[C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000193563705 1433020579 /nfs/dbraw/zinc/02/05/79/1433020579.db2.gz VRISODXZHDZHNA-KRWDZBQOSA-N 0 0 388.445 3.444 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000193573301 1433021868 /nfs/dbraw/zinc/02/18/68/1433021868.db2.gz JJRZFXVMJVPXNI-UHFFFAOYSA-N 0 0 384.367 3.336 20 5 GGBDRN CN(Cc1cscn1)Cc1cccc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)c1 ZINC000193575793 1433022196 /nfs/dbraw/zinc/02/21/96/1433022196.db2.gz WWSKPTXUIWVTGX-UHFFFAOYSA-N 0 0 399.432 3.036 20 5 GGBDRN Cc1cc(NC(=O)N[C@H](CN2CCOCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000193575716 1433022272 /nfs/dbraw/zinc/02/22/72/1433022272.db2.gz ALLXDYZPQMHDDL-GOSISDBHSA-N 0 0 384.436 3.098 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1nc(-c2cccs2)oc1C ZINC000193580859 1433022926 /nfs/dbraw/zinc/02/29/26/1433022926.db2.gz DKSSIIOUOSVMAJ-UHFFFAOYSA-N 0 0 387.417 3.487 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(C)nc2c1cnn2C(C)C ZINC000193589805 1433024857 /nfs/dbraw/zinc/02/48/57/1433024857.db2.gz XQJVQPOULKBFMK-UHFFFAOYSA-N 0 0 383.408 3.167 20 5 GGBDRN CCc1c(C(=O)NCc2cc([N+](=O)[O-])ccc2OC)cnn1-c1ccc(F)cc1 ZINC000193590850 1433025116 /nfs/dbraw/zinc/02/51/16/1433025116.db2.gz UNQHYGDAOZJMNK-UHFFFAOYSA-N 0 0 398.394 3.421 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(C2CC2)nc2onc(C)c21 ZINC000193591081 1433025141 /nfs/dbraw/zinc/02/51/41/1433025141.db2.gz SGWSASKUWWAEAA-UHFFFAOYSA-N 0 0 382.376 3.255 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N(CCc1ccc(Cl)cc1)CC1CC1 ZINC000193593368 1433025337 /nfs/dbraw/zinc/02/53/37/1433025337.db2.gz DENXGSXKHZNBIZ-UHFFFAOYSA-N 0 0 375.812 3.444 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(N2CCCCCC2)nc1 ZINC000193593838 1433025636 /nfs/dbraw/zinc/02/56/36/1433025636.db2.gz QVVHDHXORLUQQT-UHFFFAOYSA-N 0 0 384.436 3.309 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cnn(-c2ccccc2C)c1C ZINC000193594217 1433025663 /nfs/dbraw/zinc/02/56/63/1433025663.db2.gz AZSUYUKXQVNGNV-UHFFFAOYSA-N 0 0 380.404 3.336 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1csc(-c2ccc(C)o2)n1 ZINC000193594074 1433025696 /nfs/dbraw/zinc/02/56/96/1433025696.db2.gz LHGHZELTSZHZDM-UHFFFAOYSA-N 0 0 387.417 3.487 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)c1ccccc1Cl ZINC000193597314 1433026251 /nfs/dbraw/zinc/02/62/51/1433026251.db2.gz PMSXKNVAZNKLBZ-LLVKDONJSA-N 0 0 391.811 3.415 20 5 GGBDRN Cc1cc(NC(=O)NC[C@H](c2cccs2)N2CCOCC2)ccc1[N+](=O)[O-] ZINC000193600059 1433026534 /nfs/dbraw/zinc/02/65/34/1433026534.db2.gz AWVYGQRNPTWZRL-MRXNPFEDSA-N 0 0 390.465 3.160 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H](C)c1cc(F)ccc1F ZINC000193610042 1433028413 /nfs/dbraw/zinc/02/84/13/1433028413.db2.gz ANRZFPZZOOAQKN-NSHDSACASA-N 0 0 377.347 3.340 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)OCc2cnn(C)c2)cc1[N+](=O)[O-])c1ccccn1 ZINC000193631197 1433031213 /nfs/dbraw/zinc/03/12/13/1433031213.db2.gz PDEZVMTWLREJOT-ZDUSSCGKSA-N 0 0 381.392 3.253 20 5 GGBDRN CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000193630801 1433031231 /nfs/dbraw/zinc/03/12/31/1433031231.db2.gz BSWOGWYDKXYPGL-UHFFFAOYSA-N 0 0 388.399 3.153 20 5 GGBDRN O=C(c1cc(NCCc2ccc3c(c2)OCCO3)ccc1[N+](=O)[O-])N1CCCC1 ZINC000193633530 1433031569 /nfs/dbraw/zinc/03/15/69/1433031569.db2.gz RUWPHUWAUFSTFA-UHFFFAOYSA-N 0 0 397.431 3.257 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCc1csc2ccccc12 ZINC000193655417 1433034951 /nfs/dbraw/zinc/03/49/51/1433034951.db2.gz IMDHYPURPYOFMF-UHFFFAOYSA-N 0 0 383.429 3.415 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccccc1)C(C)(C)C ZINC000193674968 1433038644 /nfs/dbraw/zinc/03/86/44/1433038644.db2.gz VHRSTZYUQFMYKF-QGZVFWFLSA-N 0 0 385.420 3.446 20 5 GGBDRN COC[C@@H](NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000193687525 1433040710 /nfs/dbraw/zinc/04/07/10/1433040710.db2.gz PJRGCUDMXRCUOD-MRXNPFEDSA-N 0 0 393.827 3.173 20 5 GGBDRN COC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(Cl)cc1 ZINC000193691315 1433041800 /nfs/dbraw/zinc/04/18/00/1433041800.db2.gz RCAZCJLTZCUPPQ-QGZVFWFLSA-N 0 0 377.828 3.472 20 5 GGBDRN CN(CCCCc1ccccc1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000193701780 1433043201 /nfs/dbraw/zinc/04/32/01/1433043201.db2.gz KDZXXZRJOOLSPB-UHFFFAOYSA-N 0 0 390.461 3.093 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1cc(Cl)ccc1-n1cncn1 ZINC000193706657 1433044061 /nfs/dbraw/zinc/04/40/61/1433044061.db2.gz IHUGJAGQUSJSEQ-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193706820 1433044078 /nfs/dbraw/zinc/04/40/78/1433044078.db2.gz VMUZXCISJGVCQS-SNVBAGLBSA-N 0 0 397.250 3.497 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000193707873 1433044271 /nfs/dbraw/zinc/04/42/71/1433044271.db2.gz HPFAWRXOPDMMHO-NSHDSACASA-N 0 0 398.202 3.296 20 5 GGBDRN CN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193707522 1433044396 /nfs/dbraw/zinc/04/43/96/1433044396.db2.gz QBIUMUJJMJYECA-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN Cc1cc(NC(=O)N2CCCN(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000193708300 1433044649 /nfs/dbraw/zinc/04/46/49/1433044649.db2.gz YXODWLYWTQANJU-UHFFFAOYSA-N 0 0 382.420 3.283 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3ccc(Cn4cccn4)cc3)cc2N1 ZINC000193712318 1433045239 /nfs/dbraw/zinc/04/52/39/1433045239.db2.gz WUJAILDDQABHKM-UHFFFAOYSA-N 0 0 377.404 3.336 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1 ZINC000193715264 1433045896 /nfs/dbraw/zinc/04/58/96/1433045896.db2.gz RAHGNOYNODBYTE-UHFFFAOYSA-N 0 0 386.408 3.499 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cn1nc(-c2ccccc2)ccc1=O ZINC000193722454 1433047393 /nfs/dbraw/zinc/04/73/93/1433047393.db2.gz RZUYTLUSNIRJCK-UHFFFAOYSA-N 0 0 378.388 3.074 20 5 GGBDRN Cc1cc(NC(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000193728801 1433048295 /nfs/dbraw/zinc/04/82/95/1433048295.db2.gz WHRZRPPQNOWFGG-CQSZACIVSA-N 0 0 388.468 3.406 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccc1[N+](=O)[O-] ZINC000193731828 1433049019 /nfs/dbraw/zinc/04/90/19/1433049019.db2.gz PMBYMWCYHLTOJL-UHFFFAOYSA-N 0 0 385.380 3.166 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000193734467 1433049261 /nfs/dbraw/zinc/04/92/61/1433049261.db2.gz STJOSGVPZAAPHV-NSHDSACASA-N 0 0 388.449 3.051 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193737246 1433049853 /nfs/dbraw/zinc/04/98/53/1433049853.db2.gz BLNOXNCVYYWBJV-CQSZACIVSA-N 0 0 385.420 3.336 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000193745315 1433051221 /nfs/dbraw/zinc/05/12/21/1433051221.db2.gz FVWMUDJWGZWHIS-UHFFFAOYSA-N 0 0 387.411 3.091 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCCc3cnn(-c4ccccc4)c3)cc2N1 ZINC000193755498 1433053107 /nfs/dbraw/zinc/05/31/07/1433053107.db2.gz SSYBURUEGNXPDL-UHFFFAOYSA-N 0 0 377.404 3.320 20 5 GGBDRN C[C@@H]1CCCC[C@H]1N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000193758908 1433053662 /nfs/dbraw/zinc/05/36/62/1433053662.db2.gz SUUCASRNLNVIJU-ZWNOBZJWSA-N 0 0 385.367 3.172 20 5 GGBDRN COc1ccc(F)cc1[C@H](C)NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000193783232 1433058651 /nfs/dbraw/zinc/05/86/51/1433058651.db2.gz VGHCYVDSCYMZPP-VIFPVBQESA-N 0 0 395.774 3.212 20 5 GGBDRN CN(C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)[C@H]1CCc2ccccc21 ZINC000193786216 1433059291 /nfs/dbraw/zinc/05/92/91/1433059291.db2.gz DXYRKYNDTDHXRR-KDOFPFPSSA-N 0 0 397.406 3.233 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H]1CCc2cc(F)ccc21 ZINC000193790828 1433060153 /nfs/dbraw/zinc/06/01/53/1433060153.db2.gz ARHOCBAXWLORNO-CQSZACIVSA-N 0 0 377.759 3.130 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)COc1ccc(F)cc1F ZINC000193796381 1433061478 /nfs/dbraw/zinc/06/14/78/1433061478.db2.gz ONFVCGNPSAHQFZ-NSHDSACASA-N 0 0 395.362 3.148 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3c(C)cccc3[N+](=O)[O-])C2)nc1 ZINC000193809452 1433064362 /nfs/dbraw/zinc/06/43/62/1433064362.db2.gz AAKOVQHHSWYFCZ-HNNXBMFYSA-N 0 0 382.420 3.098 20 5 GGBDRN CCN(c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1)C(C)C ZINC000193813624 1433065421 /nfs/dbraw/zinc/06/54/21/1433065421.db2.gz BPUUQODSWSDDNC-UHFFFAOYSA-N 0 0 398.463 3.427 20 5 GGBDRN C[C@H]1CCCC[C@@H]1OCCNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000193814456 1433065538 /nfs/dbraw/zinc/06/55/38/1433065538.db2.gz IFFFUBSLXUIAMF-LPHOPBHVSA-N 0 0 390.484 3.022 20 5 GGBDRN O=C(N[C@@H]1CCCCNC1=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000193824012 1433067353 /nfs/dbraw/zinc/06/73/53/1433067353.db2.gz IBHPBKSFWCYXRX-MRXNPFEDSA-N 0 0 385.445 3.145 20 5 GGBDRN COC(=O)c1cc(C(=O)N(CC(F)F)c2ccc(F)cc2)cc([N+](=O)[O-])c1 ZINC000193845030 1433071949 /nfs/dbraw/zinc/07/19/49/1433071949.db2.gz BIGQMPNTGCNBDC-UHFFFAOYSA-N 0 0 382.294 3.432 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1C[C@@H](O)c1ccccc1C(F)(F)F ZINC000193847059 1433072378 /nfs/dbraw/zinc/07/23/78/1433072378.db2.gz UTASLYPBEKWFBQ-OAHLLOKOSA-N 0 0 379.294 3.057 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NCc1cc(Cl)c2c(c1)OCCO2 ZINC000193858676 1433074215 /nfs/dbraw/zinc/07/42/15/1433074215.db2.gz MZEQINQOVOKXKA-UHFFFAOYSA-N 0 0 377.784 3.019 20 5 GGBDRN CC[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)C1 ZINC000193859796 1433074570 /nfs/dbraw/zinc/07/45/70/1433074570.db2.gz JAAKKHPCKWBCAO-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN COc1cccc(C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)c1[N+](=O)[O-] ZINC000193880917 1433077487 /nfs/dbraw/zinc/07/74/87/1433077487.db2.gz AJMABXBVEXNZKC-ZDUSSCGKSA-N 0 0 381.392 3.017 20 5 GGBDRN CN(C[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000193880162 1433077562 /nfs/dbraw/zinc/07/75/62/1433077562.db2.gz IAWKAYPXNKOSLN-ZDUSSCGKSA-N 0 0 394.428 3.192 20 5 GGBDRN C[C@H](C1CC1)N(C1CC1)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000193883316 1433077905 /nfs/dbraw/zinc/07/79/05/1433077905.db2.gz ABFFDFRPKRATFH-SECBINFHSA-N 0 0 389.271 3.309 20 5 GGBDRN COc1cccc(C(=O)NCc2c(C)nn(-c3ccccc3)c2C)c1[N+](=O)[O-] ZINC000193885720 1433078341 /nfs/dbraw/zinc/07/83/41/1433078341.db2.gz FVHJMFCSENWSOO-UHFFFAOYSA-N 0 0 380.404 3.336 20 5 GGBDRN O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193895175 1433079674 /nfs/dbraw/zinc/07/96/74/1433079674.db2.gz NMTNPJLTMUDKQR-NSHDSACASA-N 0 0 377.225 3.007 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCCc3cc(OC(F)F)ccc32)c1 ZINC000193905790 1433082359 /nfs/dbraw/zinc/08/23/59/1433082359.db2.gz WSVKAMHPFXANHP-UHFFFAOYSA-N 0 0 384.360 3.338 20 5 GGBDRN O=C1CCCN1Cc1cccc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000193912770 1433083365 /nfs/dbraw/zinc/08/33/65/1433083365.db2.gz BGODTZUDWJACOF-UHFFFAOYSA-N 0 0 394.431 3.214 20 5 GGBDRN COc1ccc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)cc1[N+](=O)[O-] ZINC000193915788 1433083848 /nfs/dbraw/zinc/08/38/48/1433083848.db2.gz KJNOHCLYNFUGLL-UHFFFAOYSA-N 0 0 398.444 3.176 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCN(c2nc3ccccc3s2)CC1 ZINC000193916592 1433084482 /nfs/dbraw/zinc/08/44/82/1433084482.db2.gz PAEMHNCUUVWMQA-UHFFFAOYSA-N 0 0 386.408 3.306 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)N([C@@H](C)c2ccccc2)C1 ZINC000193925239 1433085705 /nfs/dbraw/zinc/08/57/05/1433085705.db2.gz MESGYOUMJUOHEE-DZGCQCFKSA-N 0 0 383.404 3.152 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)N([C@H](C)c2ccccc2)C1 ZINC000193925254 1433085844 /nfs/dbraw/zinc/08/58/44/1433085844.db2.gz MESGYOUMJUOHEE-UKRRQHHQSA-N 0 0 383.404 3.152 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2ccc(OCc3cccc(C)c3)cc2)c1[N+](=O)[O-] ZINC000193927709 1433086538 /nfs/dbraw/zinc/08/65/38/1433086538.db2.gz YPHKUWQWIVUKOO-UHFFFAOYSA-N 0 0 394.431 3.454 20 5 GGBDRN CCCCCNC(=O)C1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000193929386 1433086767 /nfs/dbraw/zinc/08/67/67/1433086767.db2.gz HYVOWZPFOACUBQ-UHFFFAOYSA-N 0 0 388.468 3.002 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000193932202 1433087528 /nfs/dbraw/zinc/08/75/28/1433087528.db2.gz ORKDVKCXLRCLDP-UHFFFAOYSA-N 0 0 398.387 3.105 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(Oc3ccc(F)cc3F)CC2)cc1 ZINC000193932094 1433087562 /nfs/dbraw/zinc/08/75/62/1433087562.db2.gz JSZRXOLXAWBFAB-UHFFFAOYSA-N 0 0 398.387 3.105 20 5 GGBDRN COc1cccc(C(=O)NCc2ccc(OCC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000193933170 1433087809 /nfs/dbraw/zinc/08/78/09/1433087809.db2.gz IHINXACARGCFKT-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1CNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000193935289 1433088070 /nfs/dbraw/zinc/08/80/70/1433088070.db2.gz DJVVCIGBCDQQPN-TZMCWYRMSA-N 0 0 389.481 3.431 20 5 GGBDRN CS(=O)(=O)c1ccc(-c2nc(CCCc3ccccc3)no2)cc1[N+](=O)[O-] ZINC000193936717 1433088458 /nfs/dbraw/zinc/08/84/58/1433088458.db2.gz JDHWPMCFODWZNX-UHFFFAOYSA-N 0 0 387.417 3.224 20 5 GGBDRN Cc1ccc(Cn2nccc2NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)o1 ZINC000193938651 1433089027 /nfs/dbraw/zinc/08/90/27/1433089027.db2.gz LPJYWFUWDBQFKX-UHFFFAOYSA-N 0 0 385.336 3.210 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000193940009 1433089353 /nfs/dbraw/zinc/08/93/53/1433089353.db2.gz INMFTMYHGWCOGF-SNVBAGLBSA-N 0 0 381.310 3.430 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193940900 1433089377 /nfs/dbraw/zinc/08/93/77/1433089377.db2.gz WTGLGKDIZJBZOX-JTQLQIEISA-N 0 0 381.310 3.430 20 5 GGBDRN COc1cccc(C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)c1[N+](=O)[O-] ZINC000193945378 1433090055 /nfs/dbraw/zinc/09/00/55/1433090055.db2.gz HEBGNSXTURMUNY-UHFFFAOYSA-N 0 0 380.404 3.500 20 5 GGBDRN Cc1ccccc1C[C@H](C)NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000193947920 1433090393 /nfs/dbraw/zinc/09/03/93/1433090393.db2.gz OARBZCSDSNSGGT-LBPRGKRZSA-N 0 0 375.812 3.243 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCCn1c(C)nc2ccccc21 ZINC000193950430 1433091067 /nfs/dbraw/zinc/09/10/67/1433091067.db2.gz NMYFXIAJTYRCGO-UHFFFAOYSA-N 0 0 397.435 3.151 20 5 GGBDRN C[C@H](OC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1 ZINC000193951144 1433091124 /nfs/dbraw/zinc/09/11/24/1433091124.db2.gz YKYZBXXAKPCONM-JTQLQIEISA-N 0 0 380.759 3.422 20 5 GGBDRN Cc1ccccc1C[C@H](C)NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000193952882 1433091392 /nfs/dbraw/zinc/09/13/92/1433091392.db2.gz RISXNYXTAAUKEY-LBPRGKRZSA-N 0 0 375.812 3.243 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193959000 1433092711 /nfs/dbraw/zinc/09/27/11/1433092711.db2.gz FAZGFRWADPPBHM-AWEZNQCLSA-N 0 0 385.420 3.277 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N(Cc1ccco1)Cc1ccccc1 ZINC000193961861 1433092941 /nfs/dbraw/zinc/09/29/41/1433092941.db2.gz SDDNIGCZTYWBHI-UHFFFAOYSA-N 0 0 379.372 3.355 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCC1(c2ccccc2)CCOCC1 ZINC000193968040 1433093756 /nfs/dbraw/zinc/09/37/56/1433093756.db2.gz RXUIMCVPKGKLMT-UHFFFAOYSA-N 0 0 384.432 3.228 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccccc2C)cc1[N+](=O)[O-] ZINC000193971370 1433094074 /nfs/dbraw/zinc/09/40/74/1433094074.db2.gz XAAAISRJOLQURK-INIZCTEOSA-N 0 0 376.434 3.438 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(CC1CCCCC1)C1CC1 ZINC000193987481 1433096469 /nfs/dbraw/zinc/09/64/69/1433096469.db2.gz NWCXZXRKCXZUJQ-UHFFFAOYSA-N 0 0 375.425 3.113 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccccc2OCC(F)(F)F)c1 ZINC000193993625 1433097809 /nfs/dbraw/zinc/09/78/09/1433097809.db2.gz VTFNDKNLMCZWFO-UHFFFAOYSA-N 0 0 390.339 3.014 20 5 GGBDRN CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)OCCc1ccc([N+](=O)[O-])cc1 ZINC000194003505 1433099297 /nfs/dbraw/zinc/09/92/97/1433099297.db2.gz JVEOIMKIWVZSQK-FQEVSTJZSA-N 0 0 382.416 3.217 20 5 GGBDRN Cc1nc(COc2ccccc2C(=O)OCCc2ccc([N+](=O)[O-])cc2)no1 ZINC000194005669 1433099485 /nfs/dbraw/zinc/09/94/85/1433099485.db2.gz IKKJZIHKTORXGV-UHFFFAOYSA-N 0 0 383.360 3.265 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@@H]1c1cccc(F)c1 ZINC000194007352 1433099786 /nfs/dbraw/zinc/09/97/86/1433099786.db2.gz IKGXYTXIAZKEPE-MRXNPFEDSA-N 0 0 387.367 3.045 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1ccnc(N2CCCCC2)c1 ZINC000194021459 1433102292 /nfs/dbraw/zinc/10/22/92/1433102292.db2.gz IAZAIAXXIUAPHR-UHFFFAOYSA-N 0 0 384.436 3.065 20 5 GGBDRN C[C@H](c1nc2ccccc2s1)N(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000194021869 1433102333 /nfs/dbraw/zinc/10/23/33/1433102333.db2.gz ZQEWICHXTKVEMB-LLVKDONJSA-N 0 0 384.417 3.363 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000194023062 1433102579 /nfs/dbraw/zinc/10/25/79/1433102579.db2.gz BPKYTSKUIPDIGM-LIRRHRJNSA-N 0 0 385.420 3.275 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000194023036 1433102615 /nfs/dbraw/zinc/10/26/15/1433102615.db2.gz BPKYTSKUIPDIGM-IFXJQAMLSA-N 0 0 385.420 3.275 20 5 GGBDRN COc1cccc(C(=O)NCc2cccc(OCC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000194025689 1433102988 /nfs/dbraw/zinc/10/29/88/1433102988.db2.gz ZGXWEPMNPCDHQP-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(=O)Nc1ccc2ccccc2c1 ZINC000194026906 1433103648 /nfs/dbraw/zinc/10/36/48/1433103648.db2.gz YWNKHRHQVRWDQE-UHFFFAOYSA-N 0 0 379.372 3.012 20 5 GGBDRN COc1cccc(C(=O)NCCc2ccc(OC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000194045432 1433106622 /nfs/dbraw/zinc/10/66/22/1433106622.db2.gz UOLBEFIPXPBKSJ-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000194051667 1433107913 /nfs/dbraw/zinc/10/79/13/1433107913.db2.gz BNOFXTPDVAXOMM-KRWDZBQOSA-N 0 0 392.419 3.330 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2CCOc2cccc([N+](=O)[O-])c2)o1 ZINC000194052045 1433107963 /nfs/dbraw/zinc/10/79/63/1433107963.db2.gz GPEHHZDKJVTIDE-IBGZPJMESA-N 0 0 380.404 3.465 20 5 GGBDRN Cc1nc2ccccc2n1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000194053431 1433108333 /nfs/dbraw/zinc/10/83/33/1433108333.db2.gz HZRMRCHWLDYWFK-UHFFFAOYSA-N 0 0 382.376 3.053 20 5 GGBDRN COc1cccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000194056599 1433109225 /nfs/dbraw/zinc/10/92/25/1433109225.db2.gz CCPVJPIHIGJORV-GASCZTMLSA-N 0 0 399.447 3.465 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)NCCCCc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000194066045 1433110817 /nfs/dbraw/zinc/11/08/17/1433110817.db2.gz KYZAAJXMVDPEQP-UHFFFAOYSA-N 0 0 382.420 3.258 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000194070605 1433111787 /nfs/dbraw/zinc/11/17/87/1433111787.db2.gz ZIEMSADAMHMMNB-XLIONFOSSA-N 0 0 398.463 3.474 20 5 GGBDRN O=c1[nH]cnc2cc(NCCCCOCCc3ccccc3)c([N+](=O)[O-])cc21 ZINC000194073999 1433112434 /nfs/dbraw/zinc/11/24/34/1433112434.db2.gz ZQSXBOOJXGXILK-UHFFFAOYSA-N 0 0 382.420 3.283 20 5 GGBDRN CC(C)Oc1ccccc1CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000194074267 1433112444 /nfs/dbraw/zinc/11/24/44/1433112444.db2.gz NOKWRJUKNZQOFI-UHFFFAOYSA-N 0 0 391.811 3.290 20 5 GGBDRN Cc1csc([C@@H]2CN(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CCO2)n1 ZINC000194079190 1433113257 /nfs/dbraw/zinc/11/32/57/1433113257.db2.gz NKXCPHLRUBOGEL-WFASDCNBSA-N 0 0 376.438 3.204 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@H]2CCCC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000194117078 1433120454 /nfs/dbraw/zinc/12/04/54/1433120454.db2.gz MSMGOIMHCLVZNK-CABCVRRESA-N 0 0 391.468 3.054 20 5 GGBDRN CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000194118207 1433120729 /nfs/dbraw/zinc/12/07/29/1433120729.db2.gz UEYFXASRCODIIV-AWEZNQCLSA-N 0 0 396.403 3.163 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1CCCN(CC(F)(F)F)C1 ZINC000194119091 1433121015 /nfs/dbraw/zinc/12/10/15/1433121015.db2.gz SWHLVRHKCIBXBR-NSHDSACASA-N 0 0 393.793 3.481 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cc2c(c(Br)c1)OCO2 ZINC000194120984 1433121151 /nfs/dbraw/zinc/12/11/51/1433121151.db2.gz JORXIOSVQSLOPG-UHFFFAOYSA-N 0 0 383.129 3.477 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](c1ccccc1)N1CCSCC1 ZINC000194122411 1433121319 /nfs/dbraw/zinc/12/13/19/1433121319.db2.gz ZQFQBRNQDYFZMF-SFHVURJKSA-N 0 0 387.461 3.332 20 5 GGBDRN CCCN(C(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000194121753 1433121384 /nfs/dbraw/zinc/12/13/84/1433121384.db2.gz NWLVBVZPCPGJIU-KRWDZBQOSA-N 0 0 396.447 3.285 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](c1ccccc1)N1CCSCC1 ZINC000194122396 1433121435 /nfs/dbraw/zinc/12/14/35/1433121435.db2.gz ZQFQBRNQDYFZMF-GOSISDBHSA-N 0 0 387.461 3.332 20 5 GGBDRN CCCN(C(=O)Cc1nnc(-c2ccccc2)n1C)c1cccc([N+](=O)[O-])c1 ZINC000194121442 1433121453 /nfs/dbraw/zinc/12/14/53/1433121453.db2.gz QPUGCJTUTLQIHZ-UHFFFAOYSA-N 0 0 379.420 3.376 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C1(c2ccc(F)cc2)CCOCC1 ZINC000194124026 1433121817 /nfs/dbraw/zinc/12/18/17/1433121817.db2.gz HITXXEOEYOZLMS-UHFFFAOYSA-N 0 0 388.395 3.107 20 5 GGBDRN CCC[C@@]1(COC)CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000194126442 1433122042 /nfs/dbraw/zinc/12/20/42/1433122042.db2.gz SWBNBVWMDBSIAP-SFHVURJKSA-N 0 0 393.465 3.113 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000194126979 1433122389 /nfs/dbraw/zinc/12/23/89/1433122389.db2.gz OQSCWSNOFFONEF-UHFFFAOYSA-N 0 0 387.461 3.095 20 5 GGBDRN CCCN(C(=O)CCn1c2ccccc2n(C)c1=O)c1cccc([N+](=O)[O-])c1 ZINC000194127533 1433122403 /nfs/dbraw/zinc/12/24/03/1433122403.db2.gz OUZXUVBCWZHGNI-UHFFFAOYSA-N 0 0 382.420 3.082 20 5 GGBDRN CCCN(C(=O)CCc1c(C)nc(SC)[nH]c1=O)c1cccc([N+](=O)[O-])c1 ZINC000194135408 1433123606 /nfs/dbraw/zinc/12/36/06/1433123606.db2.gz INLAWAYAISWFJA-UHFFFAOYSA-N 0 0 390.465 3.084 20 5 GGBDRN CCCN(C(=O)c1cn(Cc2cccc(F)c2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000194136870 1433123780 /nfs/dbraw/zinc/12/37/80/1433123780.db2.gz GIGOPHUPQZHPOG-UHFFFAOYSA-N 0 0 383.383 3.431 20 5 GGBDRN CCCN(C(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000194146034 1433126339 /nfs/dbraw/zinc/12/63/39/1433126339.db2.gz VMYQHCZLIKZMJN-MRXNPFEDSA-N 0 0 388.468 3.266 20 5 GGBDRN Cc1cccc2c1N(S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-])CC2 ZINC000194182756 1433133575 /nfs/dbraw/zinc/13/35/75/1433133575.db2.gz KKLICXKPGGXDIZ-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1=O ZINC000194184309 1433133890 /nfs/dbraw/zinc/13/38/90/1433133890.db2.gz YOSFIIBOJYOSJZ-ZDUSSCGKSA-N 0 0 385.445 3.097 20 5 GGBDRN COc1cccc(C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c1[N+](=O)[O-] ZINC000194195581 1433135960 /nfs/dbraw/zinc/13/59/60/1433135960.db2.gz GMUJOKDUSKFHJW-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN CN(Cc1cnn(C)c1)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194198474 1433136864 /nfs/dbraw/zinc/13/68/64/1433136864.db2.gz YRSNUGWEDCVKHF-UHFFFAOYSA-N 0 0 380.404 3.180 20 5 GGBDRN C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000194218050 1433141076 /nfs/dbraw/zinc/14/10/76/1433141076.db2.gz WTCMCUBNOWREPT-PXAZEXFGSA-N 0 0 385.445 3.000 20 5 GGBDRN Cc1c(CSc2nn3c(nnc(C(C)(C)C)c3=O)s2)cccc1[N+](=O)[O-] ZINC000194247386 1433148109 /nfs/dbraw/zinc/14/81/09/1433148109.db2.gz XIUYEQITFKEAOL-UHFFFAOYSA-N 0 0 391.478 3.352 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc(S(C)(=O)=O)ccc1F ZINC000194246620 1433148153 /nfs/dbraw/zinc/14/81/53/1433148153.db2.gz HBGXXOARYUTRJV-UHFFFAOYSA-N 0 0 394.424 3.188 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)c3ccc(SC)c([N+](=O)[O-])c3)n2)cc1 ZINC000194246786 1433148174 /nfs/dbraw/zinc/14/81/74/1433148174.db2.gz SHQQCCAEJXYJSR-UHFFFAOYSA-N 0 0 398.444 3.441 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)CC1 ZINC000194271865 1433153404 /nfs/dbraw/zinc/15/34/04/1433153404.db2.gz LDAGGTRVXMXHKQ-UHFFFAOYSA-N 0 0 393.509 3.427 20 5 GGBDRN COC[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000194281936 1433154676 /nfs/dbraw/zinc/15/46/76/1433154676.db2.gz RTQJMCWNTVEHMX-QGZVFWFLSA-N 0 0 377.828 3.478 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2cncc3ccccc32)CC1 ZINC000194288961 1433155986 /nfs/dbraw/zinc/15/59/86/1433155986.db2.gz NAXOBCRRDFGXHA-UHFFFAOYSA-N 0 0 392.415 3.114 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000194290854 1433156501 /nfs/dbraw/zinc/15/65/01/1433156501.db2.gz STLZTYDXMKABCT-LBPRGKRZSA-N 0 0 397.460 3.367 20 5 GGBDRN C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000194293672 1433156806 /nfs/dbraw/zinc/15/68/06/1433156806.db2.gz YUKPODFCAPAIAH-SJCJKPOMSA-N 0 0 391.493 3.132 20 5 GGBDRN C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000194293660 1433156902 /nfs/dbraw/zinc/15/69/02/1433156902.db2.gz YUKPODFCAPAIAH-PXAZEXFGSA-N 0 0 391.493 3.132 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC3(c4nc[nH]n4)CCC3)cc2[N+](=O)[O-])C1 ZINC000194292843 1433156904 /nfs/dbraw/zinc/15/69/04/1433156904.db2.gz ALEAKRCSDWYQSH-OKILXGFUSA-N 0 0 398.467 3.004 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000194295284 1433157197 /nfs/dbraw/zinc/15/71/97/1433157197.db2.gz BEKVBYCQNJMSNM-FQEVSTJZSA-N 0 0 385.420 3.194 20 5 GGBDRN COc1cccc(C(=O)NCc2ccnc(N3CCCCCC3)c2)c1[N+](=O)[O-] ZINC000194313266 1433159745 /nfs/dbraw/zinc/15/97/45/1433159745.db2.gz RARRJSWHXHIJRP-UHFFFAOYSA-N 0 0 384.436 3.309 20 5 GGBDRN Cc1cc(Cn2cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c2=O)c(C)s1 ZINC000194324296 1433161500 /nfs/dbraw/zinc/16/15/00/1433161500.db2.gz GQTSISOGJSRWNC-UHFFFAOYSA-N 0 0 381.417 3.217 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Oc1cccc(Br)c1 ZINC000194330457 1433162692 /nfs/dbraw/zinc/16/26/92/1433162692.db2.gz SRRUYARUTVIZNV-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCCCn1ccc2ccccc21 ZINC000194334744 1433163184 /nfs/dbraw/zinc/16/31/84/1433163184.db2.gz VQVXATCDWUUAAN-UHFFFAOYSA-N 0 0 377.397 3.057 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@@H]1CCSc2ccc(F)cc21 ZINC000194337484 1433163614 /nfs/dbraw/zinc/16/36/14/1433163614.db2.gz JTLLDNVLXDZGIK-GFCCVEGCSA-N 0 0 386.401 3.388 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CCC(OCCC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000194338033 1433163843 /nfs/dbraw/zinc/16/38/43/1433163843.db2.gz FURFUYKHXDFDHD-HNNXBMFYSA-N 0 0 393.484 3.458 20 5 GGBDRN O=C(c1ccccc1)C1CCN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000194339583 1433163847 /nfs/dbraw/zinc/16/38/47/1433163847.db2.gz DIBVVIAHKVFIKK-UHFFFAOYSA-N 0 0 392.408 3.018 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000194341177 1433164110 /nfs/dbraw/zinc/16/41/10/1433164110.db2.gz JHUMDZZMTMTLNY-SECBINFHSA-N 0 0 390.339 3.375 20 5 GGBDRN COc1ccc2ccccc2c1CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194341282 1433164175 /nfs/dbraw/zinc/16/41/75/1433164175.db2.gz YEYCRYCHEVIWJR-UHFFFAOYSA-N 0 0 390.392 3.374 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N(Cc1ccco1)Cc1cccnc1 ZINC000194340388 1433164200 /nfs/dbraw/zinc/16/42/00/1433164200.db2.gz ACWNTYOFJYEALW-UHFFFAOYSA-N 0 0 391.380 3.113 20 5 GGBDRN CC[NH+]1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c([O-])c3)c(C)c2)CC1 ZINC000194364385 1433167403 /nfs/dbraw/zinc/16/74/03/1433167403.db2.gz RNZCLWZZWNZSKC-UHFFFAOYSA-N 0 0 384.436 3.003 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000194379576 1433169086 /nfs/dbraw/zinc/16/90/86/1433169086.db2.gz FKGVKYPXUNQDTE-OAHLLOKOSA-N 0 0 384.354 3.485 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)cc([N+](=O)[O-])c1 ZINC000194391744 1433171183 /nfs/dbraw/zinc/17/11/83/1433171183.db2.gz WLRAWEJSPLLYMU-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cnc(-c3ccco3)s2)CC1 ZINC000194410424 1433173738 /nfs/dbraw/zinc/17/37/38/1433173738.db2.gz DUCPNWUUYSEJRH-UHFFFAOYSA-N 0 0 398.444 3.269 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)c1 ZINC000194434697 1433177555 /nfs/dbraw/zinc/17/75/55/1433177555.db2.gz ZDROFZLIZUIERP-CRAIPNDOSA-N 0 0 376.434 3.041 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000194439986 1433178396 /nfs/dbraw/zinc/17/83/96/1433178396.db2.gz CUCANUDLGBIEOS-HNNXBMFYSA-N 0 0 386.427 3.402 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@@H](CC(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000194446165 1433179229 /nfs/dbraw/zinc/17/92/29/1433179229.db2.gz JGVXRPCFNVUMFD-KRWDZBQOSA-N 0 0 399.447 3.237 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@H](CC(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000194446179 1433179577 /nfs/dbraw/zinc/17/95/77/1433179577.db2.gz JGVXRPCFNVUMFD-QGZVFWFLSA-N 0 0 399.447 3.237 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194463685 1433182367 /nfs/dbraw/zinc/18/23/67/1433182367.db2.gz IYMHVZJNWNATIR-GHMZBOCLSA-N 0 0 385.367 3.077 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(NC(=O)NC2CCCCC2)CC1 ZINC000194482066 1433185461 /nfs/dbraw/zinc/18/54/61/1433185461.db2.gz CYCONCPPVAKAQA-UHFFFAOYSA-N 0 0 388.468 3.140 20 5 GGBDRN Cc1ccc(C(=O)NC2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)s1 ZINC000194506572 1433189470 /nfs/dbraw/zinc/18/94/70/1433189470.db2.gz IFIMVVCZJIYXQZ-UHFFFAOYSA-N 0 0 387.461 3.308 20 5 GGBDRN COc1cccc(C(=O)NCc2cc(N(C)C)nc3ccccc23)c1[N+](=O)[O-] ZINC000194535211 1433193788 /nfs/dbraw/zinc/19/37/88/1433193788.db2.gz ZQAPIEYPFDHOIT-UHFFFAOYSA-N 0 0 380.404 3.148 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 ZINC000194539007 1433194426 /nfs/dbraw/zinc/19/44/26/1433194426.db2.gz YFUZMSGSKJPNMB-UHFFFAOYSA-N 0 0 399.300 3.350 20 5 GGBDRN COc1cccc(N2CCN(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000194552656 1433196158 /nfs/dbraw/zinc/19/61/58/1433196158.db2.gz HRSIMFNQUVTPNA-HNNXBMFYSA-N 0 0 384.436 3.196 20 5 GGBDRN COc1cccc(C(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)c1[N+](=O)[O-] ZINC000194554642 1433196468 /nfs/dbraw/zinc/19/64/68/1433196468.db2.gz ZEXJGMFITWCHFC-GWQKEKGPSA-N 0 0 376.434 3.174 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000194558437 1433197218 /nfs/dbraw/zinc/19/72/18/1433197218.db2.gz WWROXTTVHYVVRH-HNNXBMFYSA-N 0 0 390.484 3.384 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1CCCN(C(=O)Nc2ccccc2)C1 ZINC000194559240 1433197248 /nfs/dbraw/zinc/19/72/48/1433197248.db2.gz KIWYPCWGQGTWQW-INIZCTEOSA-N 0 0 382.420 3.155 20 5 GGBDRN O=C(Cc1ccc2c(c1)OCO2)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000194579724 1433200854 /nfs/dbraw/zinc/20/08/54/1433200854.db2.gz SIPCSZJPOBWDDV-UHFFFAOYSA-N 0 0 396.321 3.457 20 5 GGBDRN O=C(NCc1ccc2ncccc2c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000194582168 1433201399 /nfs/dbraw/zinc/20/13/99/1433201399.db2.gz KBUDZDMZURQFPI-UHFFFAOYSA-N 0 0 391.431 3.175 20 5 GGBDRN COc1ccc(CCCN(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1 ZINC000194583382 1433201413 /nfs/dbraw/zinc/20/14/13/1433201413.db2.gz DGCQFMACGOHQHP-UHFFFAOYSA-N 0 0 394.431 3.494 20 5 GGBDRN O=C1[C@H](Sc2n[nH]c(Cc3ccccc3)n2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000194597513 1433203340 /nfs/dbraw/zinc/20/33/40/1433203340.db2.gz CVCOHLDMBYEUNH-MRXNPFEDSA-N 0 0 395.444 3.201 20 5 GGBDRN COc1cccc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000194615405 1433205845 /nfs/dbraw/zinc/20/58/45/1433205845.db2.gz FGPDGAICVLARAX-KRWDZBQOSA-N 0 0 384.432 3.467 20 5 GGBDRN COc1ccccc1-n1ncc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1C ZINC000194639174 1433209458 /nfs/dbraw/zinc/20/94/58/1433209458.db2.gz JHPMBJHADPNGCH-UHFFFAOYSA-N 0 0 378.388 3.300 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(F)c1 ZINC000194655363 1433211932 /nfs/dbraw/zinc/21/19/32/1433211932.db2.gz AYTRCXGAQPQHOF-UHFFFAOYSA-N 0 0 389.383 3.118 20 5 GGBDRN CCn1ncc2ccc(NC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)cc21 ZINC000194671768 1433213829 /nfs/dbraw/zinc/21/38/29/1433213829.db2.gz YYDOWZIBSLCOHY-UHFFFAOYSA-N 0 0 376.376 3.402 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)c(NC(C)=O)c1 ZINC000194673297 1433213846 /nfs/dbraw/zinc/21/38/46/1433213846.db2.gz CBCYZHIRNHWLDU-UHFFFAOYSA-N 0 0 395.412 3.298 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000194681411 1433215009 /nfs/dbraw/zinc/21/50/09/1433215009.db2.gz BMRMIQQBPZOWIY-VXGBXAGGSA-N 0 0 375.812 3.244 20 5 GGBDRN O=C(NC[C@@H]1CCC[C@@H](O)C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194684445 1433215165 /nfs/dbraw/zinc/21/51/65/1433215165.db2.gz OACMTYPNKUWNAI-IAGOWNOFSA-N 0 0 384.432 3.455 20 5 GGBDRN CCOC(=O)[C@@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194683610 1433215174 /nfs/dbraw/zinc/21/51/74/1433215174.db2.gz JLLJPGJKQFFDAG-HNNXBMFYSA-N 0 0 389.433 3.276 20 5 GGBDRN O=C(NC[C@@H]1CCC[C@H](O)C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194684417 1433215183 /nfs/dbraw/zinc/21/51/83/1433215183.db2.gz OACMTYPNKUWNAI-SJORKVTESA-N 0 0 384.432 3.455 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)ccc21 ZINC000194684729 1433215221 /nfs/dbraw/zinc/21/52/21/1433215221.db2.gz APAHVZIMYSVUTI-UHFFFAOYSA-N 0 0 394.431 3.356 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCC3CCOCC3)cc2[N+](=O)[O-])C1 ZINC000194688830 1433215753 /nfs/dbraw/zinc/21/57/53/1433215753.db2.gz KFJLRKVSHUTFFM-GASCZTMLSA-N 0 0 375.469 3.234 20 5 GGBDRN O=C(c1nccn1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccnc1 ZINC000194701190 1433217458 /nfs/dbraw/zinc/21/74/58/1433217458.db2.gz BAKFIWRNCKWVFT-UHFFFAOYSA-N 0 0 375.344 3.121 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(COc3ccccc3)no2)c1N1CCOCC1 ZINC000194708961 1433218319 /nfs/dbraw/zinc/21/83/19/1433218319.db2.gz LEJYPIXEGHHJQW-UHFFFAOYSA-N 0 0 382.376 3.060 20 5 GGBDRN COc1cc(CCNC(=O)c2ccc3ncccc3c2)c([N+](=O)[O-])cc1OC ZINC000194714513 1433218723 /nfs/dbraw/zinc/21/87/23/1433218723.db2.gz ILXHFNHQJPTGAW-UHFFFAOYSA-N 0 0 381.388 3.133 20 5 GGBDRN COc1ccc(Cc2noc(-c3cccc([N+](=O)[O-])c3N3CCOCC3)n2)cc1 ZINC000194713949 1433218756 /nfs/dbraw/zinc/21/87/56/1433218756.db2.gz UBHKBVWBHCJJME-UHFFFAOYSA-N 0 0 396.403 3.081 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(-c3ccc(F)c(F)c3)no2)c1N1CCOCC1 ZINC000194713636 1433218776 /nfs/dbraw/zinc/21/87/76/1433218776.db2.gz YGGVXTKWVJLJEC-UHFFFAOYSA-N 0 0 388.330 3.427 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(-c3ccc4c(c3)CCO4)no2)c1N1CCOCC1 ZINC000194719092 1433219383 /nfs/dbraw/zinc/21/93/83/1433219383.db2.gz FTAUJDBGGBXJRX-UHFFFAOYSA-N 0 0 394.387 3.083 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000194722028 1433219931 /nfs/dbraw/zinc/21/99/31/1433219931.db2.gz ICFOXHCEMVJLDY-SANMLTNESA-N 0 0 376.434 3.051 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN1C[C@@H](C)O[C@@H](C)C1 ZINC000194724785 1433220353 /nfs/dbraw/zinc/22/03/53/1433220353.db2.gz QZQHZVZDIMTZBQ-GASCZTMLSA-N 0 0 395.525 3.277 20 5 GGBDRN Cc1sc2ncn(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c(=O)c2c1C ZINC000194734905 1433221686 /nfs/dbraw/zinc/22/16/86/1433221686.db2.gz AKQJCKMSNUJIKF-UHFFFAOYSA-N 0 0 383.389 3.081 20 5 GGBDRN COCCCCC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000194735083 1433222159 /nfs/dbraw/zinc/22/21/59/1433222159.db2.gz GIEMBFNHANDYTH-UHFFFAOYSA-N 0 0 389.374 3.079 20 5 GGBDRN C[C@@H]1CN(CCN(C)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000194745503 1433223460 /nfs/dbraw/zinc/22/34/60/1433223460.db2.gz RALFFGUVJBGESL-GASCZTMLSA-N 0 0 377.485 3.074 20 5 GGBDRN COc1ccc(CSCC(=O)N(C)[C@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000194771995 1433228617 /nfs/dbraw/zinc/22/86/17/1433228617.db2.gz AMHURBRPCYTIHY-CYBMUJFWSA-N 0 0 375.450 3.451 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3c(C)cccc3[N+](=O)[O-])n2)c1 ZINC000194774932 1433229214 /nfs/dbraw/zinc/22/92/14/1433229214.db2.gz BXUWLJKMPFSLIA-LBPRGKRZSA-N 0 0 382.376 3.453 20 5 GGBDRN CN(C)c1noc([C@@H]2CCCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000194776373 1433229635 /nfs/dbraw/zinc/22/96/35/1433229635.db2.gz BGTLLANMIKXCCV-SNVBAGLBSA-N 0 0 394.819 3.109 20 5 GGBDRN COc1cccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)c1[N+](=O)[O-] ZINC000194795220 1433233988 /nfs/dbraw/zinc/23/39/88/1433233988.db2.gz MJKOZAMEDJDEQU-LLVKDONJSA-N 0 0 393.802 3.405 20 5 GGBDRN CC(C)NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000194816690 1433239191 /nfs/dbraw/zinc/23/91/91/1433239191.db2.gz HKZFYXWGMFUDRI-UHFFFAOYSA-N 0 0 387.461 3.343 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(C)n(-c2cc(C)on2)c1C ZINC000194814828 1433239277 /nfs/dbraw/zinc/23/92/77/1433239277.db2.gz OBTGJVCHMBPHNX-UHFFFAOYSA-N 0 0 384.392 3.237 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 ZINC000194815363 1433239353 /nfs/dbraw/zinc/23/93/53/1433239353.db2.gz NXQVIYUYLIGTPJ-UHFFFAOYSA-N 0 0 395.459 3.211 20 5 GGBDRN COc1cccc(C(=O)N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000194827810 1433242149 /nfs/dbraw/zinc/24/21/49/1433242149.db2.gz GWNMHCPZBJZWJZ-PBHICJAKSA-N 0 0 378.331 3.142 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)NC2(C)CCCCC2)cc1[N+](=O)[O-] ZINC000194844660 1433246868 /nfs/dbraw/zinc/24/68/68/1433246868.db2.gz WTMRGMGHSXLUIT-UHFFFAOYSA-N 0 0 375.454 3.327 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000194849722 1433248590 /nfs/dbraw/zinc/24/85/90/1433248590.db2.gz OBWKEMFDBIZHFJ-LLVKDONJSA-N 0 0 399.230 3.380 20 5 GGBDRN CCOC(=O)[C@]1(C(C)C)CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000194860549 1433250654 /nfs/dbraw/zinc/25/06/54/1433250654.db2.gz MCMRPGIXIRUBNF-GOSISDBHSA-N 0 0 397.859 3.098 20 5 GGBDRN O=C(Nc1ccc(-c2ccccc2)cn1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000194869313 1433252573 /nfs/dbraw/zinc/25/25/73/1433252573.db2.gz GQXLMZLTSHXBIR-UHFFFAOYSA-N 0 0 386.371 3.490 20 5 GGBDRN COc1cccc(C2CCN(CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000194878473 1433255085 /nfs/dbraw/zinc/25/50/85/1433255085.db2.gz JWPDJNGLXDCWKQ-UHFFFAOYSA-N 0 0 383.448 3.446 20 5 GGBDRN O=C(N[C@@H]1CCC[C@@H]1CCO)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194882684 1433256295 /nfs/dbraw/zinc/25/62/95/1433256295.db2.gz JSMJVJPLYJGTRW-VQIMIIECSA-N 0 0 384.432 3.455 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)OCO2)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194894858 1433258980 /nfs/dbraw/zinc/25/89/80/1433258980.db2.gz ZQDMIMCJSMCNKB-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000194911068 1433262800 /nfs/dbraw/zinc/26/28/00/1433262800.db2.gz FRANCSUGTBVHPG-UHFFFAOYSA-N 0 0 386.379 3.234 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nc2cc(Cl)ccc2n1C ZINC000194921848 1433264789 /nfs/dbraw/zinc/26/47/89/1433264789.db2.gz ZSLRKARYRZYNDT-UHFFFAOYSA-N 0 0 384.621 3.451 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1nc2c(s1)C[C@H](c1ccccc1)CC2 ZINC000194934174 1433267698 /nfs/dbraw/zinc/26/76/98/1433267698.db2.gz KYGTYIHDFXURGR-CYBMUJFWSA-N 0 0 383.433 3.159 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H](c1ccccc1)N1CCSCC1 ZINC000194939030 1433268840 /nfs/dbraw/zinc/26/88/40/1433268840.db2.gz REDYLZGGESGFQF-IBGZPJMESA-N 0 0 385.489 3.343 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCCc1cccc(Cl)c1 ZINC000194943672 1433269768 /nfs/dbraw/zinc/26/97/68/1433269768.db2.gz ZSJAQAQNUUKGTO-CYBMUJFWSA-N 0 0 389.839 3.116 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCCc1cccc(Cl)c1 ZINC000194943660 1433269863 /nfs/dbraw/zinc/26/98/63/1433269863.db2.gz ZSJAQAQNUUKGTO-ZDUSSCGKSA-N 0 0 389.839 3.116 20 5 GGBDRN CC[C@@H](C)N(Cc1ccccc1)C(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000194968778 1433274563 /nfs/dbraw/zinc/27/45/63/1433274563.db2.gz XCQRURKMIZEJOS-OAHLLOKOSA-N 0 0 399.447 3.161 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Oc1c(F)cccc1F ZINC000195008642 1433280010 /nfs/dbraw/zinc/28/00/10/1433280010.db2.gz WLVHFDVJIJXWLE-UHFFFAOYSA-N 0 0 378.287 3.167 20 5 GGBDRN CCO[C@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000195008401 1433280121 /nfs/dbraw/zinc/28/01/21/1433280121.db2.gz WZXMJDBDRJWCCG-MRXNPFEDSA-N 0 0 391.811 3.081 20 5 GGBDRN CCO[C@H](CNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000195025104 1433282416 /nfs/dbraw/zinc/28/24/16/1433282416.db2.gz WBVOLWMBLVHSET-QGZVFWFLSA-N 0 0 385.420 3.044 20 5 GGBDRN CCO[C@@H](CNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000195025086 1433282546 /nfs/dbraw/zinc/28/25/46/1433282546.db2.gz WBVOLWMBLVHSET-KRWDZBQOSA-N 0 0 385.420 3.044 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)Nc1nc2c(cc(F)c(F)c2F)s1 ZINC000195039974 1433284333 /nfs/dbraw/zinc/28/43/33/1433284333.db2.gz ZRGYFDIXRXMDGI-UHFFFAOYSA-N 0 0 397.338 3.334 20 5 GGBDRN COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000195043101 1433284510 /nfs/dbraw/zinc/28/45/10/1433284510.db2.gz FFJPUKWRBMNBMD-IBGZPJMESA-N 0 0 398.394 3.039 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)Nc1ncc(C(F)(F)F)cc1Cl ZINC000195050964 1433285522 /nfs/dbraw/zinc/28/55/22/1433285522.db2.gz ODWROCHJVRFXKE-UHFFFAOYSA-N 0 0 389.721 3.375 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1 ZINC000195053729 1433286046 /nfs/dbraw/zinc/28/60/46/1433286046.db2.gz HIWIAKLFNZJUFD-UHFFFAOYSA-N 0 0 380.408 3.110 20 5 GGBDRN O=C(CN[C@H](c1nccs1)c1ccccc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000195057084 1433286265 /nfs/dbraw/zinc/28/62/65/1433286265.db2.gz RMAZWZZQTIPASM-IBGZPJMESA-N 0 0 394.456 3.320 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)NCc1ccc(F)cc1C(F)(F)F ZINC000195056418 1433286297 /nfs/dbraw/zinc/28/62/97/1433286297.db2.gz BIFKZLBTBXNCPH-UHFFFAOYSA-N 0 0 386.305 3.143 20 5 GGBDRN O=C(CN[C@H](c1nccs1)c1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000195064145 1433287567 /nfs/dbraw/zinc/28/75/67/1433287567.db2.gz JRLMXUKTBIFBGS-IBGZPJMESA-N 0 0 394.456 3.320 20 5 GGBDRN Cc1cc(=O)c(C(=O)N(CC2CCC2)C(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000195125283 1433295976 /nfs/dbraw/zinc/29/59/76/1433295976.db2.gz UFSATVKUYYSNKJ-UHFFFAOYSA-N 0 0 384.436 3.100 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@@H](C)c2ccco2)c([N+](=O)[O-])cc1OC ZINC000195129392 1433296756 /nfs/dbraw/zinc/29/67/56/1433296756.db2.gz GASXBEKYXDNRNC-LBPRGKRZSA-N 0 0 377.397 3.150 20 5 GGBDRN CCS(=O)(=O)C1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000195156922 1433300811 /nfs/dbraw/zinc/30/08/11/1433300811.db2.gz RQBZSHQSPURDDP-UHFFFAOYSA-N 0 0 395.506 3.117 20 5 GGBDRN CCS(=O)(=O)C1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000195160714 1433301128 /nfs/dbraw/zinc/30/11/28/1433301128.db2.gz UJRDITKEKWQYEF-UHFFFAOYSA-N 0 0 378.450 3.254 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CN1CCC(OCCc2ccccc2)CC1 ZINC000195186699 1433304512 /nfs/dbraw/zinc/30/45/12/1433304512.db2.gz LVGBMMZMMKMGME-UHFFFAOYSA-N 0 0 397.431 3.184 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000195198843 1433306192 /nfs/dbraw/zinc/30/61/92/1433306192.db2.gz LHDKPEJBINSAJD-UKRRQHHQSA-N 0 0 393.509 3.474 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000195198854 1433306214 /nfs/dbraw/zinc/30/62/14/1433306214.db2.gz LHDKPEJBINSAJD-DZGCQCFKSA-N 0 0 393.509 3.474 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000195201314 1433306491 /nfs/dbraw/zinc/30/64/91/1433306491.db2.gz NFLQUASKFZZQRQ-CQSZACIVSA-N 0 0 379.482 3.085 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2nc(C3CC3)sc2c1 ZINC000195226926 1433309539 /nfs/dbraw/zinc/30/95/39/1433309539.db2.gz BQCVOJYMDRFQJJ-UHFFFAOYSA-N 0 0 396.428 3.337 20 5 GGBDRN CC(C)NS(=O)(=O)CCNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000195248479 1433311694 /nfs/dbraw/zinc/31/16/94/1433311694.db2.gz PWEJLUWHNVTLHF-UHFFFAOYSA-N 0 0 389.783 3.007 20 5 GGBDRN CN(C(C1CC1)C1CC1)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000195257624 1433312376 /nfs/dbraw/zinc/31/23/76/1433312376.db2.gz UITPJLLEAQLMED-UHFFFAOYSA-N 0 0 389.271 3.166 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCCc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000195261066 1433312842 /nfs/dbraw/zinc/31/28/42/1433312842.db2.gz DIXJDBAXIDFRQP-UHFFFAOYSA-N 0 0 375.812 3.244 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCCc1cccc(Cl)c1 ZINC000195261161 1433312846 /nfs/dbraw/zinc/31/28/46/1433312846.db2.gz MAFOOZCGSLNHMV-UHFFFAOYSA-N 0 0 375.812 3.244 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000195261182 1433312890 /nfs/dbraw/zinc/31/28/90/1433312890.db2.gz QAJPUTSNINLGSV-UHFFFAOYSA-N 0 0 397.309 3.148 20 5 GGBDRN CC(C)c1nnc2n1C[C@@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CC2 ZINC000195266957 1433313405 /nfs/dbraw/zinc/31/34/05/1433313405.db2.gz PYVCIAWLGXTZAE-AWEZNQCLSA-N 0 0 385.468 3.352 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC(OC2CCCC2)CC1 ZINC000195273029 1433314119 /nfs/dbraw/zinc/31/41/19/1433314119.db2.gz YSFBRFJWLQNALU-UHFFFAOYSA-N 0 0 377.441 3.237 20 5 GGBDRN Cc1c(C(=O)Nc2ccn(Cc3ccncc3)n2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195311374 1433317883 /nfs/dbraw/zinc/31/78/83/1433317883.db2.gz AVMTWPWVYWMJEO-UHFFFAOYSA-N 0 0 396.363 3.012 20 5 GGBDRN COc1ccccc1[C@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])[NH+]1CCCC1 ZINC000195320903 1433318606 /nfs/dbraw/zinc/31/86/06/1433318606.db2.gz MRCNQFTUGWQLES-KRWDZBQOSA-N 0 0 399.447 3.179 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CCC(OC3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000195321545 1433318980 /nfs/dbraw/zinc/31/89/80/1433318980.db2.gz GYCADEVOSDXSRP-AWEZNQCLSA-N 0 0 391.468 3.354 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000195342191 1433320742 /nfs/dbraw/zinc/32/07/42/1433320742.db2.gz VOLZXSZUBUYALU-UHFFFAOYSA-N 0 0 377.876 3.485 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(Cc2cc(Cl)ccc2OC)CC1 ZINC000195346710 1433321397 /nfs/dbraw/zinc/32/13/97/1433321397.db2.gz CZRPBQWLRMEALQ-UHFFFAOYSA-N 0 0 393.875 3.104 20 5 GGBDRN CN(C)c1ccc2cc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)ccc2n1 ZINC000195356533 1433322185 /nfs/dbraw/zinc/32/21/85/1433322185.db2.gz PIHHBKBLERDJDN-UHFFFAOYSA-N 0 0 381.348 3.370 20 5 GGBDRN Cc1ccccc1C(C)(C)CNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000195357954 1433322379 /nfs/dbraw/zinc/32/23/79/1433322379.db2.gz XNQMGDPSTMWNMX-UHFFFAOYSA-N 0 0 390.461 3.014 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCC(=O)Nc1cccc2ccccc21 ZINC000195372535 1433323637 /nfs/dbraw/zinc/32/36/37/1433323637.db2.gz RWYVMHXTRWAQGG-UHFFFAOYSA-N 0 0 393.399 3.272 20 5 GGBDRN CC[C@H](C)NC(=O)[C@@H](C)NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000195389787 1433325040 /nfs/dbraw/zinc/32/50/40/1433325040.db2.gz ZYPXTEQGYQMEIN-LSDHHAIUSA-N 0 0 399.447 3.207 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@H](C)NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000195389792 1433325139 /nfs/dbraw/zinc/32/51/39/1433325139.db2.gz ZYPXTEQGYQMEIN-CABCVRRESA-N 0 0 399.447 3.207 20 5 GGBDRN Cc1cnc(COC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000195414897 1433327171 /nfs/dbraw/zinc/32/71/71/1433327171.db2.gz RYGRPLXVNSHAKX-UHFFFAOYSA-N 0 0 384.314 3.257 20 5 GGBDRN CCCCNC(=O)c1ccc(CNC(=O)c2cccc(OC)c2[N+](=O)[O-])cc1 ZINC000195425109 1433328291 /nfs/dbraw/zinc/32/82/91/1433328291.db2.gz ZMIKXRGPWDXYJS-UHFFFAOYSA-N 0 0 385.420 3.063 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(OC(F)F)c3ncccc23)c1[N+](=O)[O-] ZINC000195445292 1433330328 /nfs/dbraw/zinc/33/03/28/1433330328.db2.gz IWSTZAXAFIWWPH-UHFFFAOYSA-N 0 0 377.307 3.282 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)c1[N+](=O)[O-] ZINC000195449126 1433330981 /nfs/dbraw/zinc/33/09/81/1433330981.db2.gz HNMTWAJSVXZMMF-UHFFFAOYSA-N 0 0 385.424 3.195 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1cccc(CN2CCCCC2=O)c1 ZINC000195455707 1433331768 /nfs/dbraw/zinc/33/17/68/1433331768.db2.gz RJUPSYHWAWASLV-UHFFFAOYSA-N 0 0 396.447 3.472 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)ccc1[N+](=O)[O-] ZINC000195456793 1433331884 /nfs/dbraw/zinc/33/18/84/1433331884.db2.gz QDESRWXJEXNCKU-INIZCTEOSA-N 0 0 377.828 3.290 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N(Cc1ccncc1)C[C@H]1CCCO1 ZINC000195467088 1433333485 /nfs/dbraw/zinc/33/34/85/1433333485.db2.gz ZUZYODOKWHRCBS-OAHLLOKOSA-N 0 0 375.812 3.465 20 5 GGBDRN Cc1c(NC(=O)NCc2ccccc2[N+](=O)[O-])cccc1C(=O)N1CCCC1 ZINC000195471738 1433334210 /nfs/dbraw/zinc/33/42/10/1433334210.db2.gz BEKBIHRVJCAIGU-UHFFFAOYSA-N 0 0 382.420 3.461 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cnn(Cc2ccncc2)c1 ZINC000195473920 1433334497 /nfs/dbraw/zinc/33/44/97/1433334497.db2.gz MYRLWBKDQLUNSK-UHFFFAOYSA-N 0 0 380.408 3.065 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)N1CC2(CCCC2)c2c1cccc2F ZINC000195480283 1433335019 /nfs/dbraw/zinc/33/50/19/1433335019.db2.gz WXUXOYBSAZKOIZ-UHFFFAOYSA-N 0 0 397.406 3.209 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2ccc(Oc3ccccc3)nc2)cc1 ZINC000195481840 1433335095 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3.464 20 5 GGBDRN C[C@@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000195527041 1433338621 /nfs/dbraw/zinc/33/86/21/1433338621.db2.gz SPVRHHQOLAEEGT-JTQLQIEISA-N 0 0 381.404 3.111 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCCC[C@@H]1C ZINC000195594545 1433340710 /nfs/dbraw/zinc/34/07/10/1433340710.db2.gz LGLSHFDLNPRORR-XKQJLSEDSA-N 0 0 393.509 3.141 20 5 GGBDRN CCOc1ccc(CCNc2ccc([N+](=O)[O-])cc2C(=O)NC)cc1OCC ZINC000195684126 1433344626 /nfs/dbraw/zinc/34/46/26/1433344626.db2.gz LHXSDSKBPLDFJV-UHFFFAOYSA-N 0 0 387.436 3.406 20 5 GGBDRN Cc1cc(C(=O)NCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000195692230 1433344690 /nfs/dbraw/zinc/34/46/90/1433344690.db2.gz REXHBYRFFNSNOP-IAGOWNOFSA-N 0 0 397.475 3.442 20 5 GGBDRN Cc1cc(C(=O)NCCc2cc(Cl)c3c(c2)OCCO3)cc([N+](=O)[O-])c1 ZINC000195691238 1433344864 /nfs/dbraw/zinc/34/48/64/1433344864.db2.gz FZQQBKXDXSNQND-UHFFFAOYSA-N 0 0 376.796 3.300 20 5 GGBDRN O=C(Nc1nc(-c2ccc(OC(F)F)cc2)cs1)c1n[nH]cc1[N+](=O)[O-] ZINC000196749042 1433347134 /nfs/dbraw/zinc/34/71/34/1433347134.db2.gz ZNYSUCPQUFOERG-UHFFFAOYSA-N 0 0 381.320 3.295 20 5 GGBDRN Cc1cc(NC(=O)CN(C)c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])no1 ZINC000198107209 1433347365 /nfs/dbraw/zinc/34/73/65/1433347365.db2.gz JVZCPIXFMFGCKZ-UHFFFAOYSA-N 0 0 394.387 3.197 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1occc1CS(=O)(=O)c1ccccc1 ZINC000198126823 1433347660 /nfs/dbraw/zinc/34/76/60/1433347660.db2.gz BYSZVTXFPXKBIO-UHFFFAOYSA-N 0 0 386.385 3.414 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cc(Cl)c2c(c1)OCCO2 ZINC000198131997 1433347852 /nfs/dbraw/zinc/34/78/52/1433347852.db2.gz SUUHHAGTPUTOLF-UHFFFAOYSA-N 0 0 392.795 3.001 20 5 GGBDRN COc1ccc(Cc2nnc(Sc3nc4sccn4c3[N+](=O)[O-])o2)cc1 ZINC000198172096 1433348395 /nfs/dbraw/zinc/34/83/95/1433348395.db2.gz VLJGRNQVMYGXFH-UHFFFAOYSA-N 0 0 389.418 3.438 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000198861774 1433351555 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ZINC000265217852 1434201249 /nfs/dbraw/zinc/20/12/49/1434201249.db2.gz RSNDBNJJXRCFAA-UHFFFAOYSA-N 0 0 399.350 3.152 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(C[S@](C)=O)c2C)c([N+](=O)[O-])cc1OC ZINC000265242261 1434205733 /nfs/dbraw/zinc/20/57/33/1434205733.db2.gz GXZVYCZOKMOCLN-MHZLTWQESA-N 0 0 392.433 3.051 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000265243183 1434206117 /nfs/dbraw/zinc/20/61/17/1434206117.db2.gz GHFMUVKMHBZNIU-UHFFFAOYSA-N 0 0 393.827 3.087 20 5 GGBDRN COCCN(Cc1ccccn1)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000265256077 1434208362 /nfs/dbraw/zinc/20/83/62/1434208362.db2.gz KYEPQCGORFBWFI-UHFFFAOYSA-N 0 0 393.827 3.087 20 5 GGBDRN Cc1ccnc(NCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000265258783 1434208776 /nfs/dbraw/zinc/20/87/76/1434208776.db2.gz RYKCGVWPHOOIQF-GJZGRUSLSA-N 0 0 384.436 3.160 20 5 GGBDRN O=C(C[C@H]1CCS(=O)(=O)C1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000265294691 1434213426 /nfs/dbraw/zinc/21/34/26/1434213426.db2.gz NEISMKXKIBLTSI-CYBMUJFWSA-N 0 0 390.417 3.150 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C[S@@](C)=O)c2)cc1OC ZINC000265295021 1434213479 /nfs/dbraw/zinc/21/34/79/1434213479.db2.gz QPYOXEUBRBVXTF-HHHXNRCGSA-N 0 0 392.433 3.133 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C[S@](C)=O)c2)cc1OC ZINC000265295024 1434213583 /nfs/dbraw/zinc/21/35/83/1434213583.db2.gz QPYOXEUBRBVXTF-MHZLTWQESA-N 0 0 392.433 3.133 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000265300988 1434214743 /nfs/dbraw/zinc/21/47/43/1434214743.db2.gz XURKFEUNPQYOSL-UHFFFAOYSA-N 0 0 398.843 3.209 20 5 GGBDRN COC(=O)N(C)Cc1ccc(N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000265330946 1434219616 /nfs/dbraw/zinc/21/96/16/1434219616.db2.gz MSLFPLVFKUKSHM-CYBMUJFWSA-N 0 0 386.408 3.232 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCOc3cc(F)ccc32)cc1OC ZINC000265364016 1434225056 /nfs/dbraw/zinc/22/50/56/1434225056.db2.gz CJFAWYZWPRFCBC-UHFFFAOYSA-N 0 0 376.340 3.180 20 5 GGBDRN O=C(NCC1(O)CCOCC1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000265390076 1434228130 /nfs/dbraw/zinc/22/81/30/1434228130.db2.gz RQYUGBHHCZZHAG-UHFFFAOYSA-N 0 0 387.392 3.050 20 5 GGBDRN COC(=O)N(C)Cc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000265414455 1434231253 /nfs/dbraw/zinc/23/12/53/1434231253.db2.gz ZUMFAENKIKMQCG-UHFFFAOYSA-N 0 0 386.408 3.457 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)CSC)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000265433438 1434233990 /nfs/dbraw/zinc/23/39/90/1434233990.db2.gz HBOJXNBZVIIHIS-SNVBAGLBSA-N 0 0 397.478 3.120 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H]1[C@H](O)C(F)(F)F ZINC000265443621 1434235083 /nfs/dbraw/zinc/23/50/83/1434235083.db2.gz ADPYIDWCXQSTCS-ONGXEEELSA-N 0 0 399.272 3.116 20 5 GGBDRN CN(C)C(=O)[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000265451456 1434235640 /nfs/dbraw/zinc/23/56/40/1434235640.db2.gz CJMQFNGDVLFAEY-SFHVURJKSA-N 0 0 398.419 3.472 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)c1[N+](=O)[O-] ZINC000265454395 1434235804 /nfs/dbraw/zinc/23/58/04/1434235804.db2.gz TWYHKSRACNLBAP-UHFFFAOYSA-N 0 0 389.412 3.157 20 5 GGBDRN CSCC[C@@H](C)N(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000265469392 1434237135 /nfs/dbraw/zinc/23/71/35/1434237135.db2.gz WSNQSAHWMVQTMO-LLVKDONJSA-N 0 0 395.510 3.088 20 5 GGBDRN O=C(c1ccccc1F)N1CCC(Nc2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000265480821 1434238271 /nfs/dbraw/zinc/23/82/71/1434238271.db2.gz CWULGHMTETWXOF-UHFFFAOYSA-N 0 0 378.791 3.499 20 5 GGBDRN O=C(NCCCc1ccc(O)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000265484215 1434238408 /nfs/dbraw/zinc/23/84/08/1434238408.db2.gz UAKHVWPUDLKRLF-UHFFFAOYSA-N 0 0 383.448 3.266 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000265492038 1434239375 /nfs/dbraw/zinc/23/93/75/1434239375.db2.gz WCTRHASYXXTESN-MRXNPFEDSA-N 0 0 389.408 3.042 20 5 GGBDRN NC(=O)C1CCN(c2ccc(Nc3ncc([N+](=O)[O-])cc3Cl)cc2)CC1 ZINC000265496064 1434239595 /nfs/dbraw/zinc/23/95/95/1434239595.db2.gz HBVRINGSMBWPOP-UHFFFAOYSA-N 0 0 375.816 3.089 20 5 GGBDRN O=C(Nc1cccc(CNc2ncc([N+](=O)[O-])cc2Cl)c1)[C@H]1CCCO1 ZINC000265503286 1434240186 /nfs/dbraw/zinc/24/01/86/1434240186.db2.gz ISRJDORYTGMTEB-OAHLLOKOSA-N 0 0 376.800 3.373 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@H](c3nnc4n3CCCCC4)C2)c(Cl)c1 ZINC000265520748 1434241870 /nfs/dbraw/zinc/24/18/70/1434241870.db2.gz MAQMUKAJEZFDAS-LBPRGKRZSA-N 0 0 376.848 3.345 20 5 GGBDRN O=C(Nc1ccccc1)NC1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000265524119 1434242312 /nfs/dbraw/zinc/24/23/12/1434242312.db2.gz MMSYTIKHIUZAKY-UHFFFAOYSA-N 0 0 375.816 3.434 20 5 GGBDRN COc1ccc(C(=O)N2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1OC ZINC000265525440 1434242563 /nfs/dbraw/zinc/24/25/63/1434242563.db2.gz OUEGLOFVUGQIJI-UHFFFAOYSA-N 0 0 385.420 3.329 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cc(Cl)c1=O)Nc1ccc(N2CCCCC2)cc1 ZINC000265548066 1434244629 /nfs/dbraw/zinc/24/46/29/1434244629.db2.gz VSFYLHGFQGESJM-UHFFFAOYSA-N 0 0 390.827 3.039 20 5 GGBDRN CC(C)n1c(CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)nc2ccccc21 ZINC000265571130 1434246943 /nfs/dbraw/zinc/24/69/43/1434246943.db2.gz HHBQENTWHGKNOR-UHFFFAOYSA-N 0 0 386.383 3.360 20 5 GGBDRN CC[C@H](C)[C@@H]1CCCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000265604275 1434249884 /nfs/dbraw/zinc/24/98/84/1434249884.db2.gz JBICFSZEKNUBSX-HOCLYGCPSA-N 0 0 398.463 3.490 20 5 GGBDRN CC(=O)CCc1ccc(O[C@H](C)C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000265605879 1434249961 /nfs/dbraw/zinc/24/99/61/1434249961.db2.gz JJXQEUUSYGUMLR-OAHLLOKOSA-N 0 0 382.416 3.473 20 5 GGBDRN CS(=O)(=O)c1cccc(OCCSCCOc2ccccc2[N+](=O)[O-])c1 ZINC000265658355 1434254045 /nfs/dbraw/zinc/25/40/45/1434254045.db2.gz QREAIZDNKHXDBL-UHFFFAOYSA-N 0 0 397.474 3.189 20 5 GGBDRN Cc1cc(NC(=O)COc2cccc([N+](=O)[O-])c2)ccc1OC1CCOCC1 ZINC000265666266 1434254640 /nfs/dbraw/zinc/25/46/40/1434254640.db2.gz ZSOBSEYRZSMPBV-UHFFFAOYSA-N 0 0 386.404 3.479 20 5 GGBDRN COC(=O)Nc1ccc(CCNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000265677323 1434255579 /nfs/dbraw/zinc/25/55/79/1434255579.db2.gz IHPLBMVWFSWECH-ZDUSSCGKSA-N 0 0 386.408 3.376 20 5 GGBDRN CC(C)(C(=O)NCc1ccccc1CN1CCCC1=O)c1ccc([N+](=O)[O-])cc1 ZINC000265693306 1434257445 /nfs/dbraw/zinc/25/74/45/1434257445.db2.gz HGCOYKVRQDOGGF-UHFFFAOYSA-N 0 0 395.459 3.311 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2cccc(N3CCOC3=O)c2)c([N+](=O)[O-])c1 ZINC000265694171 1434257493 /nfs/dbraw/zinc/25/74/93/1434257493.db2.gz ASFWJLPNEICWLK-UHFFFAOYSA-N 0 0 398.419 3.092 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC(CN2CCCCC2=O)CC1 ZINC000265704321 1434258476 /nfs/dbraw/zinc/25/84/76/1434258476.db2.gz ZSYMUNGKUJJICB-UHFFFAOYSA-N 0 0 385.420 3.206 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000265702692 1434258480 /nfs/dbraw/zinc/25/84/80/1434258480.db2.gz FHIOFCPHTQXEEC-HNNXBMFYSA-N 0 0 387.348 3.231 20 5 GGBDRN O=C(Nc1ccccc1)N1CCC[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000265718056 1434259781 /nfs/dbraw/zinc/25/97/81/1434259781.db2.gz XWZWFXMGRFIMQS-OAHLLOKOSA-N 0 0 394.431 3.428 20 5 GGBDRN CC[C@@H](C)[C@H]1CCCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000265722309 1434260444 /nfs/dbraw/zinc/26/04/44/1434260444.db2.gz ZMHDZBGIRRSBFG-TZMCWYRMSA-N 0 0 381.860 3.405 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000265724870 1434260645 /nfs/dbraw/zinc/26/06/45/1434260645.db2.gz OQNGSELYZJJUFP-GOSISDBHSA-N 0 0 384.436 3.110 20 5 GGBDRN CC(C)(C(=O)N1CCC(CC(=O)N2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000265740136 1434261583 /nfs/dbraw/zinc/26/15/83/1434261583.db2.gz DDOPOQQNFAIYRG-UHFFFAOYSA-N 0 0 387.480 3.124 20 5 GGBDRN Cn1c(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)nc2ccc(F)cc21 ZINC000265742689 1434261836 /nfs/dbraw/zinc/26/18/36/1434261836.db2.gz DTRTTXMWBRQVHL-UHFFFAOYSA-N 0 0 384.411 3.257 20 5 GGBDRN CC(C)(C(=O)Nc1cccc(CS(C)(=O)=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000265750617 1434262425 /nfs/dbraw/zinc/26/24/25/1434262425.db2.gz HIOWEUFHOKISGF-UHFFFAOYSA-N 0 0 376.434 3.056 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000265759929 1434263042 /nfs/dbraw/zinc/26/30/42/1434263042.db2.gz GLSFJVAWYQJYMM-UHFFFAOYSA-N 0 0 389.496 3.416 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000265758979 1434263077 /nfs/dbraw/zinc/26/30/77/1434263077.db2.gz JOYZKWUKYJLIDY-ZDUSSCGKSA-N 0 0 385.420 3.485 20 5 GGBDRN C[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[C@@H]1NC(=O)OC(C)(C)C ZINC000265764527 1434263445 /nfs/dbraw/zinc/26/34/45/1434263445.db2.gz IHNUAJMEMVYPJZ-WFASDCNBSA-N 0 0 378.429 3.362 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)cc([N+](=O)[O-])c1 ZINC000265769161 1434263793 /nfs/dbraw/zinc/26/37/93/1434263793.db2.gz JGDQKUWJJRCGIX-GFCCVEGCSA-N 0 0 397.387 3.007 20 5 GGBDRN O=C(Cc1cc(F)cc2c1OCOC2)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000265790074 1434265340 /nfs/dbraw/zinc/26/53/40/1434265340.db2.gz RMTGPGZKDZLFOG-UHFFFAOYSA-N 0 0 388.395 3.282 20 5 GGBDRN 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ZINC000265822170 1434268333 /nfs/dbraw/zinc/26/83/33/1434268333.db2.gz KXPBOHKDPYYKST-CYBMUJFWSA-N 0 0 381.429 3.019 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000265825720 1434269112 /nfs/dbraw/zinc/26/91/12/1434269112.db2.gz RXWWNAYCJVZMEN-HNNXBMFYSA-N 0 0 375.469 3.027 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000265829312 1434269621 /nfs/dbraw/zinc/26/96/21/1434269621.db2.gz SJOVIRQWKUDJSA-CQSZACIVSA-N 0 0 391.468 3.246 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000265842238 1434271350 /nfs/dbraw/zinc/27/13/50/1434271350.db2.gz DPSRHONKIFISSE-DZGCQCFKSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000265842060 1434271362 /nfs/dbraw/zinc/27/13/62/1434271362.db2.gz VSIYORUNEFGTOA-UHFFFAOYSA-N 0 0 379.420 3.078 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c1[N+](=O)[O-] ZINC000265842244 1434271557 /nfs/dbraw/zinc/27/15/57/1434271557.db2.gz DPSRHONKIFISSE-UKRRQHHQSA-N 0 0 377.441 3.279 20 5 GGBDRN CCOc1cc(NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)ccc1OC ZINC000265849620 1434272558 /nfs/dbraw/zinc/27/25/58/1434272558.db2.gz AJBYCKMVYALBBT-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN CC(C)(C(=O)NCc1ccccc1CN1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000265855083 1434273185 /nfs/dbraw/zinc/27/31/85/1434273185.db2.gz XZBBHWRKLNJHGN-UHFFFAOYSA-N 0 0 397.475 3.021 20 5 GGBDRN COc1cc(C(=O)N(Cc2ccco2)C[C@@H]2CCCO2)cc([N+](=O)[O-])c1OC ZINC000265861323 1434274085 /nfs/dbraw/zinc/27/40/85/1434274085.db2.gz DBHKFCBTLMBPKD-HNNXBMFYSA-N 0 0 390.392 3.026 20 5 GGBDRN C[C@@H]1CN(c2nc3sccn3c2[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C ZINC000265869036 1434275520 /nfs/dbraw/zinc/27/55/20/1434275520.db2.gz VBJYRDPLPKYPDU-GHMZBOCLSA-N 0 0 381.458 3.044 20 5 GGBDRN Cc1ccc(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000265871664 1434276031 /nfs/dbraw/zinc/27/60/31/1434276031.db2.gz 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GGBDRN COc1cc(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)cc([N+](=O)[O-])c1OC ZINC000265890395 1434278789 /nfs/dbraw/zinc/27/87/89/1434278789.db2.gz MLSZOUHBTKJBHW-FUHWJXTLSA-N 0 0 386.404 3.262 20 5 GGBDRN COc1cc(C(=O)N(C)Cc2ccccc2N2CCCC2)cc([N+](=O)[O-])c1OC ZINC000265895124 1434279288 /nfs/dbraw/zinc/27/92/88/1434279288.db2.gz AXGOYXBIQYCQGU-UHFFFAOYSA-N 0 0 399.447 3.484 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000265899519 1434279922 /nfs/dbraw/zinc/27/99/22/1434279922.db2.gz BYVWVEKOLDBYTD-UHFFFAOYSA-N 0 0 384.436 3.282 20 5 GGBDRN O=C(NCc1cc(F)ccc1N1CCOCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000265910871 1434281697 /nfs/dbraw/zinc/28/16/97/1434281697.db2.gz YPXVUOANBKTLNY-UHFFFAOYSA-N 0 0 393.802 3.154 20 5 GGBDRN COc1cc(C(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)cc([N+](=O)[O-])c1OC ZINC000265914528 1434282162 /nfs/dbraw/zinc/28/21/62/1434282162.db2.gz AGSOIJNBSKCEDO-UGSOOPFHSA-N 0 0 386.404 3.214 20 5 GGBDRN COc1cc(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc([N+](=O)[O-])c1OC 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JMVUKABMIGHCCO-UHFFFAOYSA-N 0 0 375.450 3.202 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1ccc(C(=O)N[C@@H](CC)CO)cc1 ZINC000266997213 1434397383 /nfs/dbraw/zinc/39/73/83/1434397383.db2.gz YLGCFKPETZFZHR-INIZCTEOSA-N 0 0 387.436 3.106 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(OCC(C)(C)O)cc2)cc([N+](=O)[O-])c1OC ZINC000267011491 1434398743 /nfs/dbraw/zinc/39/87/43/1434398743.db2.gz HQPJFNXWKVHBQE-UHFFFAOYSA-N 0 0 390.392 3.014 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCn3c(nnc3C(F)(F)F)C2)cc1C(F)(F)F ZINC000267031934 1434401350 /nfs/dbraw/zinc/40/13/50/1434401350.db2.gz LKQQCIKOUWEEHE-UHFFFAOYSA-N 0 0 381.236 3.244 20 5 GGBDRN C[C@@H](CC[S@](C)=O)NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000267035194 1434401647 /nfs/dbraw/zinc/40/16/47/1434401647.db2.gz BSQBRJOOUMAFMH-NRRJATNASA-N 0 0 376.434 3.274 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(OCC(C)(C)O)cc2)cc1[N+](=O)[O-] ZINC000267052718 1434403293 /nfs/dbraw/zinc/40/32/93/1434403293.db2.gz RGZKXPUQRUPCSA-UHFFFAOYSA-N 0 0 389.364 3.213 20 5 GGBDRN 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GGBDRN CC[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000270121977 1434705505 /nfs/dbraw/zinc/70/55/05/1434705505.db2.gz MIZHOEPYUYEHCZ-FPOVZHCZSA-N 0 0 393.447 3.222 20 5 GGBDRN CC[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000270121979 1434705508 /nfs/dbraw/zinc/70/55/08/1434705508.db2.gz MIZHOEPYUYEHCZ-TZIWHRDSSA-N 0 0 393.447 3.222 20 5 GGBDRN CC[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000270141063 1434707177 /nfs/dbraw/zinc/70/71/77/1434707177.db2.gz PIJHWWLOVMFIDC-WIYYLYMNSA-N 0 0 393.447 3.222 20 5 GGBDRN C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc([S@@](C)=O)cc1 ZINC000270152693 1434707865 /nfs/dbraw/zinc/70/78/65/1434707865.db2.gz SJFCOQVSPRKTEX-LOKFHWFJSA-N 0 0 389.477 3.402 20 5 GGBDRN C[C@@H](NC(=O)N[C@@H](C)c1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000270153761 1434707944 /nfs/dbraw/zinc/70/79/44/1434707944.db2.gz SOWGUUOENORNFM-CXHCJZKCSA-N 0 0 375.450 3.454 20 5 GGBDRN Cc1nc2ccccc2n1C[C@H]1CCCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000270156650 1434708130 /nfs/dbraw/zinc/70/81/30/1434708130.db2.gz SVPNHDMIYWAQPI-CQSZACIVSA-N 0 0 396.451 3.404 20 5 GGBDRN COc1cc(CN[C@@H](C)c2ccc([S@](C)=O)cc2)c([N+](=O)[O-])cc1OC ZINC000270161833 1434708359 /nfs/dbraw/zinc/70/83/59/1434708359.db2.gz UEAKRTRSFLZPBY-QDXKXIGTSA-N 0 0 378.450 3.200 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc([S@@](C)=O)cc1 ZINC000270170241 1434709052 /nfs/dbraw/zinc/70/90/52/1434709052.db2.gz VIWQTCXXULQWPX-KHXSAUHESA-N 0 0 387.461 3.398 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc([S@](C)=O)cc1 ZINC000270170244 1434709061 /nfs/dbraw/zinc/70/90/61/1434709061.db2.gz VIWQTCXXULQWPX-MUDIAHQHSA-N 0 0 387.461 3.398 20 5 GGBDRN COc1cccc(OC)c1OC[C@@H](O)COc1c(Cl)cccc1[N+](=O)[O-] ZINC000270195508 1434711916 /nfs/dbraw/zinc/71/19/16/1434711916.db2.gz YTIMIZVEVZLVSI-NSHDSACASA-N 0 0 383.784 3.084 20 5 GGBDRN COc1ccccc1COC[C@@H](O)COc1ccc([N+](=O)[O-])c2cccnc12 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COYHPNXROXPFTM-KGLIPLIRSA-N 0 0 377.441 3.279 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000272229629 1434879917 /nfs/dbraw/zinc/87/99/17/1434879917.db2.gz UHRJKIUEFCZFPV-DZGCQCFKSA-N 0 0 392.456 3.040 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])C1CCN(CC(F)(F)F)CC1 ZINC000272240525 1434880736 /nfs/dbraw/zinc/88/07/36/1434880736.db2.gz GWEDOJCRJXZJCD-UHFFFAOYSA-N 0 0 393.793 3.181 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000272243011 1434880976 /nfs/dbraw/zinc/88/09/76/1434880976.db2.gz KZZHFBVJWDIFGQ-QWRGUYRKSA-N 0 0 381.458 3.044 20 5 GGBDRN Cc1noc(C)c1C[C@@H](C)NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272262519 1434882356 /nfs/dbraw/zinc/88/23/56/1434882356.db2.gz BHVWGGNOUVHBRQ-SNVBAGLBSA-N 0 0 380.832 3.326 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000272275872 1434883439 /nfs/dbraw/zinc/88/34/39/1434883439.db2.gz MCOUTSKNGPKPDH-UONOGXRCSA-N 0 0 377.441 3.279 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 ZINC000272282987 1434884087 /nfs/dbraw/zinc/88/40/87/1434884087.db2.gz NBUOXRRWKBPYSL-WDEREUQCSA-N 0 0 399.394 3.248 20 5 GGBDRN C[C@@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccc(NC(=O)C2CC2)cc1 ZINC000272304074 1434885723 /nfs/dbraw/zinc/88/57/23/1434885723.db2.gz QWPYCDPZGGLLBO-LLVKDONJSA-N 0 0 397.387 3.163 20 5 GGBDRN C[C@@H](O)c1ccc(CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000272304103 1434885729 /nfs/dbraw/zinc/88/57/29/1434885729.db2.gz DRURHXFMYVPNTH-GFCCVEGCSA-N 0 0 377.828 3.343 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000272316392 1434886841 /nfs/dbraw/zinc/88/68/41/1434886841.db2.gz SQYMGOGKUAYOMG-VXGBXAGGSA-N 0 0 381.404 3.109 20 5 GGBDRN COCC[C@@H](NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000272353654 1434889768 /nfs/dbraw/zinc/88/97/68/1434889768.db2.gz VHAVOIQQFPLACK-CYBMUJFWSA-N 0 0 378.381 3.021 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CCO[C@]2(CCSC2)C1 ZINC000272353334 1434889829 /nfs/dbraw/zinc/88/98/29/1434889829.db2.gz RBOYZMLRISIMQB-WMLDXEAASA-N 0 0 399.900 3.145 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000272356115 1434889962 /nfs/dbraw/zinc/88/99/62/1434889962.db2.gz RLRZZONMLPONKL-JSGCOSHPSA-N 0 0 390.417 3.113 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000272356158 1434889975 /nfs/dbraw/zinc/88/99/75/1434889975.db2.gz RMKKYDPNWPBBJG-MVHLYKQMSA-N 0 0 389.452 3.370 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000272356119 1434890010 /nfs/dbraw/zinc/89/00/10/1434890010.db2.gz RLRZZONMLPONKL-TZMCWYRMSA-N 0 0 390.417 3.113 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000272356113 1434890012 /nfs/dbraw/zinc/89/00/12/1434890012.db2.gz RLRZZONMLPONKL-GXTWGEPZSA-N 0 0 390.417 3.113 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272376789 1434891682 /nfs/dbraw/zinc/89/16/82/1434891682.db2.gz SVAMLGVKEMZYTE-UHFFFAOYSA-N 0 0 395.362 3.270 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000272393007 1434893401 /nfs/dbraw/zinc/89/34/01/1434893401.db2.gz WZBNDUFIRVWEIH-IZBMSUHZSA-N 0 0 389.452 3.370 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CC(C)(C)OC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000272394776 1434893608 /nfs/dbraw/zinc/89/36/08/1434893608.db2.gz ZTYSMFQOFRBFCD-CYBMUJFWSA-N 0 0 388.367 3.281 20 5 GGBDRN CC[C@H](NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000272404013 1434894158 /nfs/dbraw/zinc/89/41/58/1434894158.db2.gz AUUGDNLLWGZVOE-AWEZNQCLSA-N 0 0 393.394 3.272 20 5 GGBDRN CC[C@@H](NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000272404016 1434894181 /nfs/dbraw/zinc/89/41/81/1434894181.db2.gz AUUGDNLLWGZVOE-CQSZACIVSA-N 0 0 393.394 3.272 20 5 GGBDRN O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272409636 1434894484 /nfs/dbraw/zinc/89/44/84/1434894484.db2.gz KXNGHXDVGRTVDD-RDTXWAMCSA-N 0 0 384.388 3.221 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000272423218 1434895319 /nfs/dbraw/zinc/89/53/19/1434895319.db2.gz OKOCIHWGAKECET-WDEREUQCSA-N 0 0 399.394 3.248 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000272423215 1434895329 /nfs/dbraw/zinc/89/53/29/1434895329.db2.gz OKOCIHWGAKECET-GHMZBOCLSA-N 0 0 399.394 3.248 20 5 GGBDRN COc1cc(CNc2cccc(C)c2C(N)=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000272424355 1434895481 /nfs/dbraw/zinc/89/54/81/1434895481.db2.gz IJIYVUVBPXCYTR-UHFFFAOYSA-N 0 0 395.362 3.267 20 5 GGBDRN CCCc1noc(CCCC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000272439501 1434896409 /nfs/dbraw/zinc/89/64/09/1434896409.db2.gz IAYXZSCBUYZMHA-UHFFFAOYSA-N 0 0 380.832 3.265 20 5 GGBDRN COc1cc(CNCc2cccc3c2OCO3)c([N+](=O)[O-])cc1OCC(F)F ZINC000272456239 1434897602 /nfs/dbraw/zinc/89/76/02/1434897602.db2.gz QEBVKUUYZXTFOO-UHFFFAOYSA-N 0 0 396.346 3.266 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](COc3ccccc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000272463348 1434898027 /nfs/dbraw/zinc/89/80/27/1434898027.db2.gz CVIIHMFSHJEAKS-AWEZNQCLSA-N 0 0 385.376 3.353 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CCCc2[nH]c(=O)ccc21 ZINC000272463772 1434898029 /nfs/dbraw/zinc/89/80/29/1434898029.db2.gz OXMQMMYGCRCOAU-HNNXBMFYSA-N 0 0 390.827 3.268 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000272466510 1434898349 /nfs/dbraw/zinc/89/83/49/1434898349.db2.gz KWPDZTFJCMQEBF-KGLIPLIRSA-N 0 0 377.441 3.279 20 5 GGBDRN COCc1cc(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000272470303 1434898538 /nfs/dbraw/zinc/89/85/38/1434898538.db2.gz AEODYKMIYQISLL-IBGZPJMESA-N 0 0 384.411 3.493 20 5 GGBDRN COc1ccc(CCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000272474283 1434898858 /nfs/dbraw/zinc/89/88/58/1434898858.db2.gz AYDWDBALCLQJHD-IBGZPJMESA-N 0 0 384.411 3.398 20 5 GGBDRN COc1ccc(CCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000272474286 1434898895 /nfs/dbraw/zinc/89/88/95/1434898895.db2.gz AYDWDBALCLQJHD-LJQANCHMSA-N 0 0 384.411 3.398 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000272478454 1434899184 /nfs/dbraw/zinc/89/91/84/1434899184.db2.gz UPJUWEWUYPVLHT-STQMWFEESA-N 0 0 378.429 3.362 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000272478438 1434899259 /nfs/dbraw/zinc/89/92/59/1434899259.db2.gz UPJUWEWUYPVLHT-CHWSQXEVSA-N 0 0 378.429 3.362 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272486543 1434899730 /nfs/dbraw/zinc/89/97/30/1434899730.db2.gz DCHVMAMXIGMKID-ICSRJNTNSA-N 0 0 380.448 3.174 20 5 GGBDRN Cn1ccnc1[C@H](NC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000272487920 1434899848 /nfs/dbraw/zinc/89/98/48/1434899848.db2.gz DHCGPMLHVRRZAD-MRXNPFEDSA-N 0 0 397.401 3.034 20 5 GGBDRN CO[C@H](C)c1nc(CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000272510134 1434902085 /nfs/dbraw/zinc/90/20/85/1434902085.db2.gz YGIGWMDPJRZHII-SNVBAGLBSA-N 0 0 398.872 3.454 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1)C1CC1 ZINC000272515211 1434902690 /nfs/dbraw/zinc/90/26/90/1434902690.db2.gz YSSZWTIMQUOLOY-UHFFFAOYSA-N 0 0 397.387 3.087 20 5 GGBDRN COc1cc(CSc2ncnc3[nH]cnc32)c([N+](=O)[O-])cc1OCC(F)F ZINC000272513757 1434902850 /nfs/dbraw/zinc/90/28/50/1434902850.db2.gz WMDGWABLIZZNJP-UHFFFAOYSA-N 0 0 397.363 3.206 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000272516804 1434902998 /nfs/dbraw/zinc/90/29/98/1434902998.db2.gz PLPCTAHUBDMCGI-RYUDHWBXSA-N 0 0 381.404 3.109 20 5 GGBDRN COc1cc(CN2C(=O)CC3(CCCC3)C2=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000272518335 1434903364 /nfs/dbraw/zinc/90/33/64/1434903364.db2.gz XCVJPZTUNQLERN-UHFFFAOYSA-N 0 0 398.362 3.067 20 5 GGBDRN COc1cc(Cn2cnc3sccc3c2=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000272522540 1434903900 /nfs/dbraw/zinc/90/39/00/1434903900.db2.gz XVVPPVWTWUOIMX-UHFFFAOYSA-N 0 0 397.359 3.067 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272539081 1434905737 /nfs/dbraw/zinc/90/57/37/1434905737.db2.gz OREZZXNUUDISON-QUCCMNQESA-N 0 0 395.463 3.437 20 5 GGBDRN O=C(NC[C@H]1CCN(c2ccccc2)C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272539498 1434905778 /nfs/dbraw/zinc/90/57/78/1434905778.db2.gz NIGNCWUNHHSEGS-CQSZACIVSA-N 0 0 375.375 3.329 20 5 GGBDRN CC(C)c1nnc([C@@H](C)NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000272545500 1434906450 /nfs/dbraw/zinc/90/64/50/1434906450.db2.gz QKMUIGSBIJMIJQ-SNVBAGLBSA-N 0 0 380.836 3.093 20 5 GGBDRN Cn1ccnc1[C@H](NCc1cccc2c1OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000272549670 1434906660 /nfs/dbraw/zinc/90/66/60/1434906660.db2.gz RBRXRORKDVDHTP-LJQANCHMSA-N 0 0 394.431 3.369 20 5 GGBDRN COc1cccc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1OC ZINC000272552795 1434907066 /nfs/dbraw/zinc/90/70/66/1434907066.db2.gz RPIMOJOUANNKCX-GOSISDBHSA-N 0 0 382.420 3.225 20 5 GGBDRN C[C@@H]1C[C@H](N(C)C(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000272571785 1434908965 /nfs/dbraw/zinc/90/89/65/1434908965.db2.gz SADUJQIRFVWJLL-CRAIPNDOSA-N 0 0 383.448 3.426 20 5 GGBDRN C[C@@H]1C[C@@H](N(C)C(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000272571791 1434909013 /nfs/dbraw/zinc/90/90/13/1434909013.db2.gz SADUJQIRFVWJLL-QAPCUYQASA-N 0 0 383.448 3.426 20 5 GGBDRN C[C@H]1C[C@H](N(C)C(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000272571788 1434909025 /nfs/dbraw/zinc/90/90/25/1434909025.db2.gz SADUJQIRFVWJLL-MAUKXSAKSA-N 0 0 383.448 3.426 20 5 GGBDRN COc1ccc(OCCCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272578041 1434909882 /nfs/dbraw/zinc/90/98/82/1434909882.db2.gz XMWYQBWJZUGQFK-FQEVSTJZSA-N 0 0 396.447 3.485 20 5 GGBDRN O=[N+]([O-])c1cccc(OCc2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)c1 ZINC000272586257 1434911415 /nfs/dbraw/zinc/91/14/15/1434911415.db2.gz FNQIFPSSHVDFCH-GOSISDBHSA-N 0 0 396.403 3.130 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1cnn(CC(F)(F)F)c1 ZINC000272589328 1434911584 /nfs/dbraw/zinc/91/15/84/1434911584.db2.gz STTJELAPPSCOIM-UHFFFAOYSA-N 0 0 391.737 3.371 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(c1cccc(F)c1)C1CCOCC1 ZINC000272615678 1434915379 /nfs/dbraw/zinc/91/53/79/1434915379.db2.gz SSMCQUOYQJSTKG-UHFFFAOYSA-N 0 0 388.351 3.288 20 5 GGBDRN CC(C)N1CCO[C@H](c2noc(CCOc3ccc(Cl)cc3[N+](=O)[O-])n2)C1 ZINC000272618425 1434915871 /nfs/dbraw/zinc/91/58/71/1434915871.db2.gz IJBMJIXVQVFKEY-HNNXBMFYSA-N 0 0 396.831 3.034 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272628535 1434917109 /nfs/dbraw/zinc/91/71/09/1434917109.db2.gz ZKXNHMLGWORDJX-CYBMUJFWSA-N 0 0 393.394 3.265 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272628538 1434917146 /nfs/dbraw/zinc/91/71/46/1434917146.db2.gz ZKXNHMLGWORDJX-ZDUSSCGKSA-N 0 0 393.394 3.265 20 5 GGBDRN COc1cc(CN(C)C(=O)Nc2ccncc2[N+](=O)[O-])c(SC)cc1OC ZINC000272638250 1434918439 /nfs/dbraw/zinc/91/84/39/1434918439.db2.gz BWEFEOBOJTWYJH-UHFFFAOYSA-N 0 0 392.437 3.393 20 5 GGBDRN CC[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])[C@H](c1ccc(C)cc1)n1cncn1 ZINC000272638241 1434918706 /nfs/dbraw/zinc/91/87/06/1434918706.db2.gz BVUATMFNGWSIPX-QAPCUYQASA-N 0 0 395.423 3.079 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000272652997 1434919687 /nfs/dbraw/zinc/91/96/87/1434919687.db2.gz FOFIEJPMKWIQKN-GFCCVEGCSA-N 0 0 393.444 3.147 20 5 GGBDRN CN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000272665606 1434920940 /nfs/dbraw/zinc/92/09/40/1434920940.db2.gz JFJDIIXFCATFTA-UHFFFAOYSA-N 0 0 381.433 3.004 20 5 GGBDRN COCCOc1ccc(NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)c(C)c1 ZINC000272705033 1434924539 /nfs/dbraw/zinc/92/45/39/1434924539.db2.gz HBMQNMXAGNTEHH-LJQANCHMSA-N 0 0 399.403 3.060 20 5 GGBDRN COc1ccc(CN(C)C(=O)Nc2ccncc2[N+](=O)[O-])cc1OC(F)F ZINC000272708978 1434924928 /nfs/dbraw/zinc/92/49/28/1434924928.db2.gz KFIGQLPAIQCXAL-UHFFFAOYSA-N 0 0 382.323 3.264 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000272736678 1434926881 /nfs/dbraw/zinc/92/68/81/1434926881.db2.gz LQOORDNSYCNRMC-UHFFFAOYSA-N 0 0 376.413 3.111 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCCCNC(=O)OC(C)(C)C)c1 ZINC000272736457 1434926896 /nfs/dbraw/zinc/92/68/96/1434926896.db2.gz QEOFUGWMGRGWJU-UHFFFAOYSA-N 0 0 395.456 3.093 20 5 GGBDRN COc1ccc(NC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)cc1[N+](=O)[O-] ZINC000272766959 1434929440 /nfs/dbraw/zinc/92/94/40/1434929440.db2.gz BHYZPYBCNQPPEA-KRWDZBQOSA-N 0 0 389.408 3.246 20 5 GGBDRN COC[C@@H](CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)OC ZINC000272766642 1434929472 /nfs/dbraw/zinc/92/94/72/1434929472.db2.gz WNUIKFVMVWJLKR-QGZVFWFLSA-N 0 0 375.381 3.170 20 5 GGBDRN COCCOc1cc(C)ccc1NC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000272773928 1434930076 /nfs/dbraw/zinc/93/00/76/1434930076.db2.gz QWROUYNSRCSBLR-IBGZPJMESA-N 0 0 399.403 3.060 20 5 GGBDRN COc1ccc(NC(=O)C2(OCc3ccccc3)CCOCC2)cc1[N+](=O)[O-] ZINC000272782310 1434930698 /nfs/dbraw/zinc/93/06/98/1434930698.db2.gz HTTJNADULIVMNE-UHFFFAOYSA-N 0 0 386.404 3.308 20 5 GGBDRN CCN(CC)C(=O)c1ccc(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000272794299 1434931480 /nfs/dbraw/zinc/93/14/80/1434931480.db2.gz CSWXDAZDJIRSMP-UHFFFAOYSA-N 0 0 397.478 3.285 20 5 GGBDRN COc1ccc(NC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc1[N+](=O)[O-] ZINC000272794109 1434931484 /nfs/dbraw/zinc/93/14/84/1434931484.db2.gz GRHRUDQFZMALSB-NSHDSACASA-N 0 0 384.392 3.005 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000272813069 1434932799 /nfs/dbraw/zinc/93/27/99/1434932799.db2.gz JRBKQBGSAOBIOB-GFCCVEGCSA-N 0 0 386.412 3.010 20 5 GGBDRN Cc1cc(C2CCN(S(=O)(=O)c3cc([N+](=O)[O-])c(Cl)cc3C)CC2)[nH]n1 ZINC000272835565 1434934833 /nfs/dbraw/zinc/93/48/33/1434934833.db2.gz IRABFUBAJGITTL-UHFFFAOYSA-N 0 0 398.872 3.156 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272837868 1434935022 /nfs/dbraw/zinc/93/50/22/1434935022.db2.gz NXFVBDVYAXXWGW-KGLIPLIRSA-N 0 0 392.456 3.152 20 5 GGBDRN COc1ccc(NC(=O)CCc2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-] ZINC000272837061 1434935047 /nfs/dbraw/zinc/93/50/47/1434935047.db2.gz SAHRUTDKSRFPBC-UHFFFAOYSA-N 0 0 390.392 3.201 20 5 GGBDRN COc1ccc(NC(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000272853212 1434936053 /nfs/dbraw/zinc/93/60/53/1434936053.db2.gz QRTMOSHDHOEGRN-UHFFFAOYSA-N 0 0 394.428 3.078 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(Oc2cc(C)ccn2)CC1 ZINC000272854643 1434936275 /nfs/dbraw/zinc/93/62/75/1434936275.db2.gz RBNCIKZRRQBZHZ-UHFFFAOYSA-N 0 0 386.408 3.382 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H](c2ccccc2)C(C)(C)C)cc1[N+](=O)[O-] ZINC000272865955 1434937196 /nfs/dbraw/zinc/93/71/96/1434937196.db2.gz JOXPQNIDOCLTIH-KRWDZBQOSA-N 0 0 385.420 3.446 20 5 GGBDRN COc1ccc(NC(=O)C(=O)NC[C@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000272866055 1434937263 /nfs/dbraw/zinc/93/72/63/1434937263.db2.gz JQWRHVBHRIAMAX-INIZCTEOSA-N 0 0 385.420 3.098 20 5 GGBDRN COc1ccc(NC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000272868464 1434937434 /nfs/dbraw/zinc/93/74/34/1434937434.db2.gz UESSGMPMHGWNFX-MRXNPFEDSA-N 0 0 398.419 3.089 20 5 GGBDRN COc1ccc(NC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)cc1[N+](=O)[O-] ZINC000272870091 1434937522 /nfs/dbraw/zinc/93/75/22/1434937522.db2.gz ZMGDYRPCKLSLNA-UHFFFAOYSA-N 0 0 381.392 3.323 20 5 GGBDRN COc1ccc(NC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000272892785 1434939244 /nfs/dbraw/zinc/93/92/44/1434939244.db2.gz YYPIDZQMWZLXJC-UHFFFAOYSA-N 0 0 394.428 3.124 20 5 GGBDRN CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000272975160 1434945623 /nfs/dbraw/zinc/94/56/23/1434945623.db2.gz SJBKGLWLLBUWQW-AAEUAGOBSA-N 0 0 399.900 3.104 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000273010783 1434949878 /nfs/dbraw/zinc/94/98/78/1434949878.db2.gz ZAMZRZMVIXCWJB-LBPRGKRZSA-N 0 0 391.346 3.025 20 5 GGBDRN CCOc1cc(NC(=O)N[C@H](C)C2=CC[N@H+](C)CC2)c([N+](=O)[O-])cc1OCC ZINC000273060368 1434956140 /nfs/dbraw/zinc/95/61/40/1434956140.db2.gz YJLPYUFQGKPDRS-CYBMUJFWSA-N 0 0 392.456 3.164 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCCCC(=O)OCc2ccccc2)c1 ZINC000273092995 1434960061 /nfs/dbraw/zinc/96/00/61/1434960061.db2.gz JDJDSZNQUAHBMF-UHFFFAOYSA-N 0 0 386.404 3.247 20 5 GGBDRN COc1ccc(C(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)c(OC)c1OC ZINC000273096905 1434960428 /nfs/dbraw/zinc/96/04/28/1434960428.db2.gz UUOHPDWEFIMJLQ-UHFFFAOYSA-N 0 0 388.376 3.222 20 5 GGBDRN O=C1[C@H](Nc2ccc([N+](=O)[O-])c3cnccc23)CCCN1Cc1ccccn1 ZINC000273186449 1434970370 /nfs/dbraw/zinc/97/03/70/1434970370.db2.gz QTBDQJIRHQBSON-GOSISDBHSA-N 0 0 377.404 3.141 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccnc(O[C@@H]2CCOC2)c1 ZINC000273210303 1434972588 /nfs/dbraw/zinc/97/25/88/1434972588.db2.gz GMYLUCGAEHOVIH-GFCCVEGCSA-N 0 0 395.318 3.011 20 5 GGBDRN Cn1c2ccccc2nc1[C@@H]1CCCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000273248011 1434975430 /nfs/dbraw/zinc/97/54/30/1434975430.db2.gz YAIKPJKIENGPNP-BEFAXECRSA-N 0 0 396.447 3.058 20 5 GGBDRN O=C1[C@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CCCN1Cc1ccccn1 ZINC000273267317 1434976704 /nfs/dbraw/zinc/97/67/04/1434976704.db2.gz ZVKCSIGMBBSSFC-CQSZACIVSA-N 0 0 392.362 3.194 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273275654 1434977424 /nfs/dbraw/zinc/97/74/24/1434977424.db2.gz KJENZSQSPLTEFO-IEBWSBKVSA-N 0 0 387.411 3.496 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@H](O)CCc2ccccc2)cc1SC ZINC000273314576 1434980136 /nfs/dbraw/zinc/98/01/36/1434980136.db2.gz WEVCTWNPLYXPJY-CQSZACIVSA-N 0 0 390.461 3.049 20 5 GGBDRN CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273328040 1434981107 /nfs/dbraw/zinc/98/11/07/1434981107.db2.gz SOIJJNLUOYBCJC-APWZRJJASA-N 0 0 388.395 3.491 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273330682 1434981291 /nfs/dbraw/zinc/98/12/91/1434981291.db2.gz UEIUGOSJPUWVKV-SJORKVTESA-N 0 0 390.415 3.008 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273330677 1434981342 /nfs/dbraw/zinc/98/13/42/1434981342.db2.gz UEIUGOSJPUWVKV-IAGOWNOFSA-N 0 0 390.415 3.008 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@H](CN1CCCC1=O)c1ccccc1 ZINC000273343535 1434982044 /nfs/dbraw/zinc/98/20/44/1434982044.db2.gz BCQHQPUQFNGKEK-QGZVFWFLSA-N 0 0 386.383 3.219 20 5 GGBDRN CNC(=O)c1ccc(N(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000273351164 1434982572 /nfs/dbraw/zinc/98/25/72/1434982572.db2.gz VFSJGYVHRUIZNA-VQIMIIECSA-N 0 0 387.411 3.450 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000273356533 1434982857 /nfs/dbraw/zinc/98/28/57/1434982857.db2.gz DMTHWCLJLPMTNU-KRWDZBQOSA-N 0 0 377.372 3.376 20 5 GGBDRN O=C(CNc1ccccc1[C@@H](O)C(F)(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000273366368 1434983589 /nfs/dbraw/zinc/98/35/89/1434983589.db2.gz DMJFETSEFUQMKP-QGZVFWFLSA-N 0 0 395.337 3.192 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000273369479 1434983819 /nfs/dbraw/zinc/98/38/19/1434983819.db2.gz GQMALYRTPCOLLE-HNNXBMFYSA-N 0 0 381.404 3.316 20 5 GGBDRN O=C(NCc1ccccc1CN1CCCC1=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273371229 1434984056 /nfs/dbraw/zinc/98/40/56/1434984056.db2.gz GTKGHMJLZPAOHR-UHFFFAOYSA-N 0 0 386.383 3.178 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000273384087 1434985157 /nfs/dbraw/zinc/98/51/57/1434985157.db2.gz ZHDXCMDYSFRRGG-KBXCAEBGSA-N 0 0 394.424 3.470 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000273397109 1434985869 /nfs/dbraw/zinc/98/58/69/1434985869.db2.gz FSIMERVKYMBNFH-FUHWJXTLSA-N 0 0 394.424 3.074 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1SCC1CCCC1)N1CCn2cnnc2C1 ZINC000273393260 1434985886 /nfs/dbraw/zinc/98/58/86/1434985886.db2.gz OALZVWZDNFIXNQ-UHFFFAOYSA-N 0 0 387.465 3.125 20 5 GGBDRN CN([C@H]1CCO[C@@H](c2ccc(F)cc2)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273394799 1434985986 /nfs/dbraw/zinc/98/59/86/1434985986.db2.gz FITALLDPFYPXPK-FUHWJXTLSA-N 0 0 394.424 3.275 20 5 GGBDRN CN([C@H]1CCO[C@H](c2ccc(F)cc2)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273394805 1434985990 /nfs/dbraw/zinc/98/59/90/1434985990.db2.gz FITALLDPFYPXPK-WMZOPIPTSA-N 0 0 394.424 3.275 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000273411910 1434987230 /nfs/dbraw/zinc/98/72/30/1434987230.db2.gz PWHVTTPZBWHOFW-UKRRQHHQSA-N 0 0 376.388 3.060 20 5 GGBDRN CC1CCN(C(=O)C2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000273448218 1434989437 /nfs/dbraw/zinc/98/94/37/1434989437.db2.gz KPBMWZHICPEBFI-UHFFFAOYSA-N 0 0 392.431 3.236 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273457085 1434990035 /nfs/dbraw/zinc/99/00/35/1434990035.db2.gz MDJMOZOBHDEZJT-CHWSQXEVSA-N 0 0 380.420 3.283 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000273485433 1434991642 /nfs/dbraw/zinc/99/16/42/1434991642.db2.gz RIMKQWXUBDULGD-LBPRGKRZSA-N 0 0 384.371 3.188 20 5 GGBDRN C[C@H](Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc2n1CCC2 ZINC000273494761 1434992109 /nfs/dbraw/zinc/99/21/09/1434992109.db2.gz QDDDMOXWJZVLOP-ZETCQYMHSA-N 0 0 386.290 3.233 20 5 GGBDRN C[C@@H](Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc2n1CCC2 ZINC000273494759 1434992121 /nfs/dbraw/zinc/99/21/21/1434992121.db2.gz QDDDMOXWJZVLOP-SSDOTTSWSA-N 0 0 386.290 3.233 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000273513610 1434993795 /nfs/dbraw/zinc/99/37/95/1434993795.db2.gz XJKGWKYAYFRRDU-MAUKXSAKSA-N 0 0 389.383 3.090 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273516068 1434993920 /nfs/dbraw/zinc/99/39/20/1434993920.db2.gz MZAMZQGVJDHSIK-RDJZCZTQSA-N 0 0 394.424 3.241 20 5 GGBDRN COc1cc(C)c([C@H](C)NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000273524157 1434994498 /nfs/dbraw/zinc/99/44/98/1434994498.db2.gz SPXAMEAOHVWVEC-ZDUSSCGKSA-N 0 0 394.449 3.101 20 5 GGBDRN Cc1cc(C)c(NC(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000273536855 1434995158 /nfs/dbraw/zinc/99/51/58/1434995158.db2.gz SJCZXTSLVVOZMT-UHFFFAOYSA-N 0 0 391.449 3.115 20 5 GGBDRN C[C@@H]1C[C@H](CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000273572301 1434997616 /nfs/dbraw/zinc/99/76/16/1434997616.db2.gz OMBAJFNTONGAEW-HZPDHXFCSA-N 0 0 375.469 3.133 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000273584397 1434998326 /nfs/dbraw/zinc/99/83/26/1434998326.db2.gz PQWQGYAQUNOYGM-IBGZPJMESA-N 0 0 377.441 3.362 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@H]1CCO[C@@H](C)C1 ZINC000273614041 1434999853 /nfs/dbraw/zinc/99/98/53/1434999853.db2.gz 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Cc1nn(CCc2nc(Cc3c(F)cccc3Cl)no2)c(C)c1[N+](=O)[O-] ZINC000273713200 1435007149 /nfs/dbraw/zinc/00/71/49/1435007149.db2.gz PLNPYKHNRAXPQK-UHFFFAOYSA-N 0 0 379.779 3.417 20 5 GGBDRN Cc1ccc(-c2noc([C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1[N+](=O)[O-] ZINC000273736944 1435009452 /nfs/dbraw/zinc/00/94/52/1435009452.db2.gz LAMYWCKVOYLYEQ-MRXNPFEDSA-N 0 0 378.388 3.469 20 5 GGBDRN Cc1ccc(-c2noc([C@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1[N+](=O)[O-] ZINC000273736940 1435009553 /nfs/dbraw/zinc/00/95/53/1435009553.db2.gz LAMYWCKVOYLYEQ-INIZCTEOSA-N 0 0 378.388 3.469 20 5 GGBDRN Cc1nn(CCc2nc(Cc3cccc(Cl)c3F)no2)c(C)c1[N+](=O)[O-] ZINC000273739785 1435009778 /nfs/dbraw/zinc/00/97/78/1435009778.db2.gz LHFFIRLZABKZGT-UHFFFAOYSA-N 0 0 379.779 3.417 20 5 GGBDRN CC(C)c1[nH]nc(-c2nc(-c3ccc(CN4CCCC4=O)cc3)no2)c1[N+](=O)[O-] ZINC000273740887 1435009872 /nfs/dbraw/zinc/00/98/72/1435009872.db2.gz BEVUIHNSNXWAAO-UHFFFAOYSA-N 0 0 396.407 3.281 20 5 GGBDRN Nc1ccc(-c2noc([C@@H]3CCCN(C(=O)c4ccccc4)C3)n2)cc1[N+](=O)[O-] ZINC000273774866 1435012940 /nfs/dbraw/zinc/01/29/40/1435012940.db2.gz YBIIHNSOMYJSCL-OAHLLOKOSA-N 0 0 393.403 3.247 20 5 GGBDRN CSc1ccc(-c2nc(-c3ccc(N4CCOCC4)cn3)no2)cc1[N+](=O)[O-] ZINC000273784908 1435014054 /nfs/dbraw/zinc/01/40/54/1435014054.db2.gz DYTCNYRSCVQCFB-UHFFFAOYSA-N 0 0 399.432 3.265 20 5 GGBDRN CC(C)c1[nH]nc(-c2nc([C@@H]3CC(=O)N(c4ccccc4)C3)no2)c1[N+](=O)[O-] ZINC000273784871 1435014066 /nfs/dbraw/zinc/01/40/66/1435014066.db2.gz CXWFCDFESSDSOO-LLVKDONJSA-N 0 0 382.380 3.012 20 5 GGBDRN CC(C)c1[nH]nc(-c2nc(-c3cccc(CN4CCCC4=O)c3)no2)c1[N+](=O)[O-] ZINC000273794184 1435015218 /nfs/dbraw/zinc/01/52/18/1435015218.db2.gz GZVDGFVTNMEFDH-UHFFFAOYSA-N 0 0 396.407 3.281 20 5 GGBDRN Cc1cc(Cc2noc([C@H](C)Sc3nnnn3C3CC3)n2)ccc1[N+](=O)[O-] ZINC000273799732 1435015677 /nfs/dbraw/zinc/01/56/77/1435015677.db2.gz BMQWVZBLSNHHDB-JTQLQIEISA-N 0 0 387.425 3.052 20 5 GGBDRN Cc1cc(Cc2noc(CN3C(=O)CCc4ccccc43)n2)ccc1[N+](=O)[O-] ZINC000273804373 1435016314 /nfs/dbraw/zinc/01/63/14/1435016314.db2.gz BUUWLJJVYBNVQK-UHFFFAOYSA-N 0 0 378.388 3.356 20 5 GGBDRN O=C1CCCN1Cc1cccc(-c2noc(COc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000273807118 1435016393 /nfs/dbraw/zinc/01/63/93/1435016393.db2.gz ICDOUGDKFGJMEW-UHFFFAOYSA-N 0 0 394.387 3.346 20 5 GGBDRN CC(C)(C(=O)Nc1cccc(CS(C)(=O)=O)c1)c1ccc([N+](=O)[O-])cc1F ZINC000273810361 1435016788 /nfs/dbraw/zinc/01/67/88/1435016788.db2.gz BDQCJSVFECHBGV-UHFFFAOYSA-N 0 0 394.424 3.195 20 5 GGBDRN COc1cccc(OC)c1OCc1noc(-c2n[nH]c(C(C)C)c2[N+](=O)[O-])n1 ZINC000273829302 1435018960 /nfs/dbraw/zinc/01/89/60/1435018960.db2.gz DMYOQASTEFXYCW-UHFFFAOYSA-N 0 0 389.368 3.088 20 5 GGBDRN COc1cc(CN(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)ccc1O ZINC000273829052 1435018995 /nfs/dbraw/zinc/01/89/95/1435018995.db2.gz HAYXUADPKMZVOP-UHFFFAOYSA-N 0 0 376.384 3.384 20 5 GGBDRN Cc1nn(C)c2nc(C)c(-c3nc(CCNc4ccccc4[N+](=O)[O-])no3)cc12 ZINC000273832095 1435019341 /nfs/dbraw/zinc/01/93/41/1435019341.db2.gz JYPKFHMXCGIJJI-UHFFFAOYSA-N 0 0 393.407 3.198 20 5 GGBDRN CC(C)(C(=O)N1CCC(C2(C)OCCO2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000273833023 1435019474 /nfs/dbraw/zinc/01/94/74/1435019474.db2.gz HQRKFOHVJDCICL-UHFFFAOYSA-N 0 0 380.416 3.013 20 5 GGBDRN Cc1nc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)ccc1[C@H](C)O ZINC000273835680 1435019747 /nfs/dbraw/zinc/01/97/47/1435019747.db2.gz IFJALKSNNMWYFF-LBPRGKRZSA-N 0 0 375.400 3.085 20 5 GGBDRN CC(C)(C(=O)Nc1ccc(CS(C)(=O)=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000273846573 1435020887 /nfs/dbraw/zinc/02/08/87/1435020887.db2.gz GWQAGYRNVPYGDZ-UHFFFAOYSA-N 0 0 394.424 3.195 20 5 GGBDRN CO[C@@H](C)c1nc(Cc2noc(COc3cccc([N+](=O)[O-])c3)n2)cs1 ZINC000273864859 1435023020 /nfs/dbraw/zinc/02/30/20/1435023020.db2.gz CJKFYEVNLGIGCL-JTQLQIEISA-N 0 0 376.394 3.312 20 5 GGBDRN COc1cccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)c1OC ZINC000273865955 1435023256 /nfs/dbraw/zinc/02/32/56/1435023256.db2.gz JPESUAOTYIWENZ-UHFFFAOYSA-N 0 0 376.384 3.345 20 5 GGBDRN CN1CCc2nc(NC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)sc2C1 ZINC000273872010 1435023954 /nfs/dbraw/zinc/02/39/54/1435023954.db2.gz OTDVHJVFUGKWFE-UHFFFAOYSA-N 0 0 378.429 3.095 20 5 GGBDRN Cc1ccc(-c2noc([C@@H]3CCCN(C(=O)c4ccncc4)C3)n2)cc1[N+](=O)[O-] ZINC000273876128 1435024361 /nfs/dbraw/zinc/02/43/61/1435024361.db2.gz UGLQOFGGMZUWNF-MRXNPFEDSA-N 0 0 393.403 3.368 20 5 GGBDRN COc1ccccc1OCCc1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000273878873 1435024488 /nfs/dbraw/zinc/02/44/88/1435024488.db2.gz OEMAPJUEWUKOJP-UHFFFAOYSA-N 0 0 384.392 3.263 20 5 GGBDRN COc1ccc(-c2nc(Cc3csc([C@H](C)OC)n3)no2)cc1[N+](=O)[O-] ZINC000273880881 1435024725 /nfs/dbraw/zinc/02/47/25/1435024725.db2.gz DMIKKPQTBRPJDO-VIFPVBQESA-N 0 0 376.394 3.408 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000273881760 1435024841 /nfs/dbraw/zinc/02/48/41/1435024841.db2.gz LUHHTUKPZABQNJ-GOSISDBHSA-N 0 0 388.445 3.366 20 5 GGBDRN Cc1nn(CCc2nc(Cc3c[nH]c4c3cccc4C)no2)c(C)c1[N+](=O)[O-] ZINC000273893371 1435026121 /nfs/dbraw/zinc/02/61/21/1435026121.db2.gz LPTQLPPTCJCLCG-UHFFFAOYSA-N 0 0 380.408 3.414 20 5 GGBDRN COC(=O)COc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000273897611 1435026399 /nfs/dbraw/zinc/02/63/99/1435026399.db2.gz NUQUXTJNKJDCSB-UHFFFAOYSA-N 0 0 390.367 3.202 20 5 GGBDRN CC(=O)N1CCC[C@@H](c2noc(-c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)n2)C1 ZINC000273897214 1435026434 /nfs/dbraw/zinc/02/64/34/1435026434.db2.gz NXKXFVPJQLHCIC-SNVBAGLBSA-N 0 0 384.314 3.390 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C[S@@](C)=O)cc1OC ZINC000273896288 1435026457 /nfs/dbraw/zinc/02/64/57/1435026457.db2.gz NQKQKRKCIIGWJX-HHHXNRCGSA-N 0 0 392.433 3.133 20 5 GGBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccc(F)cc1 ZINC000273900969 1435026812 /nfs/dbraw/zinc/02/68/12/1435026812.db2.gz XEKCCDPCYKNIMN-GTNSWQLSSA-N 0 0 378.375 3.389 20 5 GGBDRN CC(=O)c1ccc(OCCCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1 ZINC000273927247 1435029296 /nfs/dbraw/zinc/02/92/96/1435029296.db2.gz LPKFVHHBZNHZKO-UHFFFAOYSA-N 0 0 382.376 3.178 20 5 GGBDRN COC(=O)COc1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000273930823 1435029613 /nfs/dbraw/zinc/02/96/13/1435029613.db2.gz RQUIRBKACVJKNY-UHFFFAOYSA-N 0 0 390.367 3.202 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273931306 1435029638 /nfs/dbraw/zinc/02/96/38/1435029638.db2.gz HZTAXKODTZIWQD-UHFFFAOYSA-N 0 0 380.416 3.203 20 5 GGBDRN O=C1C[C@H](c2noc(CSc3ccc([N+](=O)[O-])cc3)n2)CN1CC1CCC1 ZINC000273935495 1435030049 /nfs/dbraw/zinc/03/00/49/1435030049.db2.gz MFUVKLUAHSNENF-ZDUSSCGKSA-N 0 0 388.449 3.386 20 5 GGBDRN Cc1ccc(-c2noc([C@@H]3CN(C(=O)OC(C)(C)C)CCO3)n2)cc1[N+](=O)[O-] ZINC000273933578 1435030053 /nfs/dbraw/zinc/03/00/53/1435030053.db2.gz ZXPMKVRFLYQFOR-AWEZNQCLSA-N 0 0 390.396 3.262 20 5 GGBDRN Cc1cc(-c2nc([C@H]3CC(=O)N(Cc4ccccc4)C3)no2)ccc1[N+](=O)[O-] ZINC000273951403 1435031509 /nfs/dbraw/zinc/03/15/09/1435031509.db2.gz JXCRPVVVCYFKQM-INIZCTEOSA-N 0 0 378.388 3.469 20 5 GGBDRN Cc1cc(-c2nc([C@@H]3CC(=O)N(Cc4ccccc4)C3)no2)ccc1[N+](=O)[O-] ZINC000273951408 1435031552 /nfs/dbraw/zinc/03/15/52/1435031552.db2.gz JXCRPVVVCYFKQM-MRXNPFEDSA-N 0 0 378.388 3.469 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3cccc(OC[C@@H]4CCCO4)c3)n2)nc1 ZINC000273956359 1435031920 /nfs/dbraw/zinc/03/19/20/1435031920.db2.gz NPDJKXKQOKBMKG-KRWDZBQOSA-N 0 0 382.376 3.188 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273968315 1435033030 /nfs/dbraw/zinc/03/30/30/1435033030.db2.gz XCXUAHLFCGHWJI-UHFFFAOYSA-N 0 0 387.411 3.383 20 5 GGBDRN CC(C)(C(=O)N1CCCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000273969564 1435033261 /nfs/dbraw/zinc/03/32/61/1435033261.db2.gz RBSJZCYANGGOLQ-UHFFFAOYSA-N 0 0 391.365 3.108 20 5 GGBDRN CN(C)C(=O)c1ccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000273971430 1435033420 /nfs/dbraw/zinc/03/34/20/1435033420.db2.gz XKFZOKCGXWYSHU-UHFFFAOYSA-N 0 0 387.411 3.030 20 5 GGBDRN O=C1C[C@@H](c2noc(-c3c[nH]c4cc([N+](=O)[O-])ccc34)n2)CN1CC1CCC1 ZINC000273980704 1435034254 /nfs/dbraw/zinc/03/42/54/1435034254.db2.gz PMOVZCXIHZUNNQ-GFCCVEGCSA-N 0 0 381.392 3.242 20 5 GGBDRN COC(=O)c1cc(CN(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)oc1C ZINC000273979682 1435034256 /nfs/dbraw/zinc/03/42/56/1435034256.db2.gz UFIRINBJTNXMEM-UHFFFAOYSA-N 0 0 392.383 3.358 20 5 GGBDRN COc1cc(-c2nc(-c3ccc(N4CCCC4)cn3)no2)cc([N+](=O)[O-])c1OC ZINC000273986200 1435034815 /nfs/dbraw/zinc/03/48/15/1435034815.db2.gz WSCGJRQUIPVURL-UHFFFAOYSA-N 0 0 397.391 3.324 20 5 GGBDRN COc1c(-c2noc(CCn3nc(C)c([N+](=O)[O-])c3C)n2)cnc2ccccc21 ZINC000273996343 1435035686 /nfs/dbraw/zinc/03/56/86/1435035686.db2.gz XSJKBRLMDYVTNF-UHFFFAOYSA-N 0 0 394.391 3.258 20 5 GGBDRN CC(C)(C)OC(=O)NC1(c2nc(CCNc3ccccc3[N+](=O)[O-])no2)CC1 ZINC000274006931 1435036424 /nfs/dbraw/zinc/03/64/24/1435036424.db2.gz RBUXQRUTCVYMGP-UHFFFAOYSA-N 0 0 389.412 3.146 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(-c3cc4c(c([N+](=O)[O-])c3)OCO4)n2)cs1 ZINC000274007202 1435036595 /nfs/dbraw/zinc/03/65/95/1435036595.db2.gz MRRBZKZPDFYBSQ-MRVPVSSYSA-N 0 0 390.377 3.128 20 5 GGBDRN COc1ccc(C(C)(C)c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1OC ZINC000274011025 1435036766 /nfs/dbraw/zinc/03/67/66/1435036766.db2.gz RZPWUSYTWGJSTC-UHFFFAOYSA-N 0 0 384.392 3.307 20 5 GGBDRN Cc1nn(C)c2nc(C)c(-c3nc(Cc4ccc([N+](=O)[O-])c(C)c4)no3)cc12 ZINC000274021770 1435037703 /nfs/dbraw/zinc/03/77/03/1435037703.db2.gz SWMINIOJVCXOSB-UHFFFAOYSA-N 0 0 378.392 3.443 20 5 GGBDRN C[C@H](OC[C@H]1CCCCO1)c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000274029094 1435038306 /nfs/dbraw/zinc/03/83/06/1435038306.db2.gz SSXDOWHQZFLYCU-UONOGXRCSA-N 0 0 376.413 3.279 20 5 GGBDRN CCOc1ccccc1CN(CCCn1ccnc1)c1ncc([N+](=O)[O-])cn1 ZINC000274032281 1435038476 /nfs/dbraw/zinc/03/84/76/1435038476.db2.gz XCODLFXYTGSKRP-UHFFFAOYSA-N 0 0 382.424 3.077 20 5 GGBDRN O=C1C[C@H](c2noc(C(F)(F)c3ccc([N+](=O)[O-])cc3)n2)CN1CC1CCC1 ZINC000274030442 1435038487 /nfs/dbraw/zinc/03/84/87/1435038487.db2.gz UBIPHJRNBKGABY-LBPRGKRZSA-N 0 0 392.362 3.234 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1noc(C2CCN(CC(F)(F)F)CC2)n1 ZINC000274041382 1435039246 /nfs/dbraw/zinc/03/92/46/1435039246.db2.gz UKFMYAFNQDTQLI-UHFFFAOYSA-N 0 0 399.373 3.374 20 5 GGBDRN CCN(C)C(=O)c1cccc(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)c1 ZINC000274049072 1435039629 /nfs/dbraw/zinc/03/96/29/1435039629.db2.gz VBDQSCTUSUSBIV-UHFFFAOYSA-N 0 0 395.419 3.391 20 5 GGBDRN O=C1C[C@H](c2noc(Cc3cccc([N+](=O)[O-])c3)n2)CN1Cc1ccccc1 ZINC000274050034 1435039696 /nfs/dbraw/zinc/03/96/96/1435039696.db2.gz QUIWMGCSTBEZAA-INIZCTEOSA-N 0 0 378.388 3.085 20 5 GGBDRN O=C(c1cc(C(=O)N2C[C@H]3CCC[C@@H]3C2)cc([N+](=O)[O-])c1)N1C[C@@H]2CCC[C@@H]2C1 ZINC000274058613 1435040385 /nfs/dbraw/zinc/04/03/85/1435040385.db2.gz MRVPVHWEYPBVPV-VQHPVUNQSA-N 0 0 397.475 3.339 20 5 GGBDRN O=C(c1cc(C(=O)N2C[C@@H]3CCC[C@@H]3C2)cc([N+](=O)[O-])c1)N1C[C@@H]2CCC[C@H]2C1 ZINC000274058602 1435040403 /nfs/dbraw/zinc/04/04/03/1435040403.db2.gz MRVPVHWEYPBVPV-LUKYLMHMSA-N 0 0 397.475 3.339 20 5 GGBDRN O=C(c1cc(C(=O)N2C[C@@H]3CCC[C@H]3C2)cc([N+](=O)[O-])c1)N1C[C@@H]2CCC[C@H]2C1 ZINC000274058606 1435040418 /nfs/dbraw/zinc/04/04/18/1435040418.db2.gz MRVPVHWEYPBVPV-QAETUUGQSA-N 0 0 397.475 3.339 20 5 GGBDRN O=C1C[C@@H](c2noc(Cn3ccc4cc([N+](=O)[O-])ccc43)n2)CN1CC1CCC1 ZINC000274061592 1435040571 /nfs/dbraw/zinc/04/05/71/1435040571.db2.gz VWQDKXYIFXDIBJ-OAHLLOKOSA-N 0 0 395.419 3.097 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(-c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2)cs1 ZINC000274084457 1435042310 /nfs/dbraw/zinc/04/23/10/1435042310.db2.gz RPXNPFKNEUUVPG-MRVPVSSYSA-N 0 0 391.365 3.308 20 5 GGBDRN COc1cc(-c2nc(Cc3csc([C@@H](C)OC)n3)no2)ccc1[N+](=O)[O-] ZINC000274111894 1435044645 /nfs/dbraw/zinc/04/46/45/1435044645.db2.gz UGVMTEHIMVYQKV-SECBINFHSA-N 0 0 376.394 3.408 20 5 GGBDRN Cn1cnnc1Sc1ccc(-c2nc([C@@H]3CCCS3)no2)cc1[N+](=O)[O-] ZINC000274112515 1435044663 /nfs/dbraw/zinc/04/46/63/1435044663.db2.gz JATNBEXNDIWJON-LBPRGKRZSA-N 0 0 390.450 3.493 20 5 GGBDRN Cc1c(-c2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)cnn1C1CCOCC1 ZINC000274112945 1435044742 /nfs/dbraw/zinc/04/47/42/1435044742.db2.gz ZKMAQNPOVCXOPA-UHFFFAOYSA-N 0 0 383.408 3.400 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(COc3ccccc3[N+](=O)[O-])n2)cs1 ZINC000274113751 1435044801 /nfs/dbraw/zinc/04/48/01/1435044801.db2.gz ULQNCJBKZRIKHR-SNVBAGLBSA-N 0 0 376.394 3.312 20 5 GGBDRN CC(C)(c1nc(Cc2ccc([N+](=O)[O-])cn2)no1)c1ccc2c(c1)OCCO2 ZINC000274120333 1435045128 /nfs/dbraw/zinc/04/51/28/1435045128.db2.gz ZZEKTQFEMGUKII-UHFFFAOYSA-N 0 0 382.376 3.061 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(-c3n[nH]c4ccc([N+](=O)[O-])cc43)n2)cs1 ZINC000274169438 1435048351 /nfs/dbraw/zinc/04/83/51/1435048351.db2.gz YQOBHPOHTXEMQE-MRVPVSSYSA-N 0 0 386.393 3.276 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@]2(CCN(C(=O)c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000274174594 1435048817 /nfs/dbraw/zinc/04/88/17/1435048817.db2.gz HKFGHXWAFVEUBJ-LJQANCHMSA-N 0 0 375.425 3.068 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000274185367 1435049437 /nfs/dbraw/zinc/04/94/37/1435049437.db2.gz FBWYYVJFYAZEHA-XJKSGUPXSA-N 0 0 384.417 3.250 20 5 GGBDRN C[C@@H](c1ccsc1)N1CCN(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)CC1 ZINC000274196670 1435050586 /nfs/dbraw/zinc/05/05/86/1435050586.db2.gz PMNRZLRVJVZIJN-NSHDSACASA-N 0 0 381.404 3.454 20 5 GGBDRN COc1ccc(CNC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000274211719 1435051699 /nfs/dbraw/zinc/05/16/99/1435051699.db2.gz QPUAYNXRSIEWFU-LPHOPBHVSA-N 0 0 385.420 3.323 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@@H](CC(=O)OC(C)C)C2)cc1[N+](=O)[O-] ZINC000274240931 1435053886 /nfs/dbraw/zinc/05/38/86/1435053886.db2.gz GIIPLWLLJBBNDH-ZDUSSCGKSA-N 0 0 379.413 3.189 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000274243676 1435054159 /nfs/dbraw/zinc/05/41/59/1435054159.db2.gz SLKDXVYLJKQKKY-IEBWSBKVSA-N 0 0 398.415 3.422 20 5 GGBDRN CC(C)(C)OC(=O)Cc1noc(Cn2c3ccccc3c(=O)c3ccccc32)n1 ZINC000274247079 1435054574 /nfs/dbraw/zinc/05/45/74/1435054574.db2.gz VNBUSXPCIMLFQV-UHFFFAOYSA-N 0 0 391.427 3.470 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2 ZINC000274256211 1435055136 /nfs/dbraw/zinc/05/51/36/1435055136.db2.gz JCZJEMGFJOAYHT-UHFFFAOYSA-N 0 0 381.388 3.390 20 5 GGBDRN COc1ccccc1S(=O)(=O)CCCOc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000274257926 1435055408 /nfs/dbraw/zinc/05/54/08/1435055408.db2.gz AIRSYKVDPHLTRB-UHFFFAOYSA-N 0 0 393.417 3.049 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000274259952 1435055506 /nfs/dbraw/zinc/05/55/06/1435055506.db2.gz KSLYUTVIWLASGK-HNNXBMFYSA-N 0 0 389.408 3.390 20 5 GGBDRN COc1cc2c(cc1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)NC(=O)CC2 ZINC000274270548 1435056570 /nfs/dbraw/zinc/05/65/70/1435056570.db2.gz AQUSFSRQQKEAIT-UHFFFAOYSA-N 0 0 383.404 3.404 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000274273535 1435056733 /nfs/dbraw/zinc/05/67/33/1435056733.db2.gz BJSLMAGVGZKCOK-AWEZNQCLSA-N 0 0 378.425 3.015 20 5 GGBDRN C[C@H](NC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000274274790 1435056894 /nfs/dbraw/zinc/05/68/94/1435056894.db2.gz IOSZINIHANOBRY-ZDUSSCGKSA-N 0 0 395.415 3.320 20 5 GGBDRN COc1cc(CN(C)Cc2nc([C@@H](C)OCC(C)C)no2)c([N+](=O)[O-])cc1F ZINC000274277026 1435057079 /nfs/dbraw/zinc/05/70/79/1435057079.db2.gz CKWJQBXSTNJUKK-GFCCVEGCSA-N 0 0 396.419 3.491 20 5 GGBDRN COc1cc(C(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)c([N+](=O)[O-])cc1OC ZINC000274287306 1435058087 /nfs/dbraw/zinc/05/80/87/1435058087.db2.gz FQIWYSZWKLDLHJ-NSHDSACASA-N 0 0 382.372 3.333 20 5 GGBDRN COc1cc(OCC(=O)N2C[C@H]3CCC(=O)c4cccc2c43)ccc1[N+](=O)[O-] ZINC000274296867 1435058913 /nfs/dbraw/zinc/05/89/13/1435058913.db2.gz IKNPNBKRKJCBOL-GFCCVEGCSA-N 0 0 382.372 3.089 20 5 GGBDRN COc1cc2c(cc1NC(=O)CCOc1cc(C)ccc1[N+](=O)[O-])NC(=O)CC2 ZINC000274313711 1435060678 /nfs/dbraw/zinc/06/06/78/1435060678.db2.gz IWQJGHPCLSSTEU-UHFFFAOYSA-N 0 0 399.403 3.204 20 5 GGBDRN COc1cc(OC)cc([C@@H](O)CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000274317631 1435061094 /nfs/dbraw/zinc/06/10/94/1435061094.db2.gz XWXXGUIHNPEMSU-SFHVURJKSA-N 0 0 389.408 3.084 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2cn(C(C)(C)C)nc2C)cc([N+](=O)[O-])c1OC ZINC000274341454 1435063291 /nfs/dbraw/zinc/06/32/91/1435063291.db2.gz OTPDJJWWLZHQNA-LLVKDONJSA-N 0 0 390.440 3.363 20 5 GGBDRN COC(=O)COc1ccc([C@@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000274369126 1435065780 /nfs/dbraw/zinc/06/57/80/1435065780.db2.gz ZKMHVBCXBCWRMS-CYBMUJFWSA-N 0 0 387.392 3.338 20 5 GGBDRN COC(=O)COc1ccc([C@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000274369128 1435065806 /nfs/dbraw/zinc/06/58/06/1435065806.db2.gz ZKMHVBCXBCWRMS-ZDUSSCGKSA-N 0 0 387.392 3.338 20 5 GGBDRN CCOc1cc(NC(=O)N[C@@H](CCO)c2ccco2)c([N+](=O)[O-])cc1OCC ZINC000274382972 1435066714 /nfs/dbraw/zinc/06/67/14/1435066714.db2.gz FFLWZCMGHZFBQW-LBPRGKRZSA-N 0 0 393.396 3.230 20 5 GGBDRN COCCOc1ccc(C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000274386380 1435067045 /nfs/dbraw/zinc/06/70/45/1435067045.db2.gz BJHALOIZRYWIOM-UHFFFAOYSA-N 0 0 394.811 3.212 20 5 GGBDRN CC(C)(C)OC1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000274420328 1435069504 /nfs/dbraw/zinc/06/95/04/1435069504.db2.gz XZDGANXGXNLROR-UHFFFAOYSA-N 0 0 393.465 3.111 20 5 GGBDRN O=C(CCC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccccn1 ZINC000274425238 1435070156 /nfs/dbraw/zinc/07/01/56/1435070156.db2.gz CVKVINQMIFIEJZ-UHFFFAOYSA-N 0 0 383.404 3.023 20 5 GGBDRN CCOC(=O)c1cc(NC2CCC(O)(c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000274435218 1435070747 /nfs/dbraw/zinc/07/07/47/1435070747.db2.gz CFTQIYSWLUWJHR-UHFFFAOYSA-N 0 0 385.420 3.409 20 5 GGBDRN O=C1OCCN1c1cc([N+](=O)[O-])ccc1NC1CCC(O)(c2cccnc2)CC1 ZINC000274448161 1435071884 /nfs/dbraw/zinc/07/18/84/1435071884.db2.gz GPBDRPDRLWXJRD-UHFFFAOYSA-N 0 0 398.419 3.189 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCSC[C@@H]1c1nccs1 ZINC000274546469 1435077746 /nfs/dbraw/zinc/07/77/46/1435077746.db2.gz 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3.215 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CC(=O)Nc1cccc(C)c1C ZINC000275783592 1435168767 /nfs/dbraw/zinc/16/87/67/1435168767.db2.gz RSBHQJQWXHYRJJ-UHFFFAOYSA-N 0 0 386.408 3.323 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCCC(=O)N1Cc2ccccc2C1 ZINC000275788415 1435169541 /nfs/dbraw/zinc/16/95/41/1435169541.db2.gz SEPXCHDFCWYANX-UHFFFAOYSA-N 0 0 398.419 3.048 20 5 GGBDRN CC(=O)Nc1ccc(C)c2c1CCCN2C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000275794929 1435170196 /nfs/dbraw/zinc/17/01/96/1435170196.db2.gz KGJPYQLFKSIMMF-UHFFFAOYSA-N 0 0 399.451 3.044 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000275823740 1435172746 /nfs/dbraw/zinc/17/27/46/1435172746.db2.gz WVXXLLMYGSSMJP-ZDUSSCGKSA-N 0 0 378.429 3.282 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N(CC2CC2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000275829355 1435173161 /nfs/dbraw/zinc/17/31/61/1435173161.db2.gz RRSBMVIGNKMFLH-UHFFFAOYSA-N 0 0 375.425 3.113 20 5 GGBDRN CCCOC(=O)CCNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275840839 1435173945 /nfs/dbraw/zinc/17/39/45/1435173945.db2.gz PRNYBCXSPDZJKT-UHFFFAOYSA-N 0 0 388.370 3.445 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N(c2cccc(N)c2)C2CCCC2)cc1[N+](=O)[O-] ZINC000275840697 1435173952 /nfs/dbraw/zinc/17/39/52/1435173952.db2.gz CKMROQWWZHLNBY-UHFFFAOYSA-N 0 0 398.419 3.100 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@H](O)C(C)(C)C2)CC1 ZINC000275850940 1435174671 /nfs/dbraw/zinc/17/46/71/1435174671.db2.gz MZSMQNCDOHJMRC-SFHVURJKSA-N 0 0 375.469 3.064 20 5 GGBDRN CC(=O)Nc1ccc(C)c2c1CCCN2C(=O)COc1ccccc1[N+](=O)[O-] ZINC000275864841 1435175656 /nfs/dbraw/zinc/17/56/56/1435175656.db2.gz NUOLDNJDLKIPAZ-UHFFFAOYSA-N 0 0 383.404 3.220 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000275877160 1435176574 /nfs/dbraw/zinc/17/65/74/1435176574.db2.gz OPXWDCSKCHRNSU-UHFFFAOYSA-N 0 0 396.403 3.064 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000275899177 1435178268 /nfs/dbraw/zinc/17/82/68/1435178268.db2.gz 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CCCC(=O)Nc1ccc(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000276057591 1435188304 /nfs/dbraw/zinc/18/83/04/1435188304.db2.gz KAJBHZSKMUJIBA-UHFFFAOYSA-N 0 0 391.449 3.349 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(C)c2cc(OC)cc(OC)c2)cc([N+](=O)[O-])c1 ZINC000276073151 1435189460 /nfs/dbraw/zinc/18/94/60/1435189460.db2.gz GPBAKKCADLHDBI-UHFFFAOYSA-N 0 0 388.376 3.065 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1cccs1)C(C)C ZINC000276083646 1435189796 /nfs/dbraw/zinc/18/97/96/1435189796.db2.gz GSARQGYCVXJLBQ-UHFFFAOYSA-N 0 0 398.462 3.042 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000276083629 1435189903 /nfs/dbraw/zinc/18/99/03/1435189903.db2.gz GRERTPISPVZYOF-BLLLJJGKSA-N 0 0 392.456 3.085 20 5 GGBDRN CC(C)C[C@@H]1C(=O)NCCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276108678 1435191433 /nfs/dbraw/zinc/19/14/33/1435191433.db2.gz ZVYKZPOONKQRBJ-LJQANCHMSA-N 0 0 377.444 3.080 20 5 GGBDRN O=C(Nc1ccc(O[C@H]2CCOC2)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000276145197 1435193652 /nfs/dbraw/zinc/19/36/52/1435193652.db2.gz FLQGAZUBZFNVMR-SFHVURJKSA-N 0 0 399.403 3.058 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](C)c2ccccc21 ZINC000276146209 1435193921 /nfs/dbraw/zinc/19/39/21/1435193921.db2.gz PFVSPRYDDGUNBD-GFCCVEGCSA-N 0 0 390.417 3.084 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000276159402 1435194765 /nfs/dbraw/zinc/19/47/65/1435194765.db2.gz FZRIRKIXVLNQMP-PBHICJAKSA-N 0 0 394.424 3.470 20 5 GGBDRN COc1ccc([C@H]2CCN(c3ccc([N+](=O)[O-])cc3S(C)(=O)=O)C2)cc1 ZINC000276170781 1435195268 /nfs/dbraw/zinc/19/52/68/1435195268.db2.gz HCJIGBIQTMNAKC-AWEZNQCLSA-N 0 0 376.434 3.001 20 5 GGBDRN COc1ccc(CNC(=O)N2CC[C@H](C(F)(F)F)C2(C)C)cc1[N+](=O)[O-] ZINC000276185240 1435196212 /nfs/dbraw/zinc/19/62/12/1435196212.db2.gz YORJORLVELQVIZ-ZDUSSCGKSA-N 0 0 375.347 3.476 20 5 GGBDRN CCn1c2ccccc2nc1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276207189 1435197473 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CCOc1cc(NC(=O)C(=O)Nc2ccsc2)c([N+](=O)[O-])cc1OCC ZINC000276317093 1435204416 /nfs/dbraw/zinc/20/44/16/1435204416.db2.gz WRWLHXMKJHOBBU-UHFFFAOYSA-N 0 0 379.394 3.031 20 5 GGBDRN COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000276325669 1435204894 /nfs/dbraw/zinc/20/48/94/1435204894.db2.gz YYTDCUKYLYWZOF-ZBFHGGJFSA-N 0 0 386.404 3.041 20 5 GGBDRN O=C(CC1CCC2(CC1)OCCO2)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000276351101 1435206332 /nfs/dbraw/zinc/20/63/32/1435206332.db2.gz RMVBHDATNJKCFA-UHFFFAOYSA-N 0 0 392.408 3.018 20 5 GGBDRN COc1cc(OC)cc([C@H](O)CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000276362537 1435207024 /nfs/dbraw/zinc/20/70/24/1435207024.db2.gz AUYFMKSQZSPTKL-GOSISDBHSA-N 0 0 389.408 3.084 20 5 GGBDRN Cc1cnc(COC(=O)C2CCN(C(=O)OCC(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000276362348 1435207028 /nfs/dbraw/zinc/20/70/28/1435207028.db2.gz AQPSHVZXYBZZJH-UHFFFAOYSA-N 0 0 393.440 3.154 20 5 GGBDRN COc1ccc([C@@H](OC)[C@@H](C)Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000276373505 1435207771 /nfs/dbraw/zinc/20/77/71/1435207771.db2.gz XNEWYXAUYRZXIN-XIKOKIGWSA-N 0 0 394.449 3.195 20 5 GGBDRN COc1ccc([C@H](OC)[C@H](C)Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000276373500 1435207787 /nfs/dbraw/zinc/20/77/87/1435207787.db2.gz XNEWYXAUYRZXIN-KPZWWZAWSA-N 0 0 394.449 3.195 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000276384859 1435208397 /nfs/dbraw/zinc/20/83/97/1435208397.db2.gz OTVUHTKBZCKSMZ-GFCCVEGCSA-N 0 0 388.424 3.205 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276389553 1435208730 /nfs/dbraw/zinc/20/87/30/1435208730.db2.gz ZXMBRVMTDOFDSO-ZBEGNZNMSA-N 0 0 382.413 3.062 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)Nc1ccc(CCS(C)(=O)=O)cc1 ZINC000276416892 1435210414 /nfs/dbraw/zinc/21/04/14/1435210414.db2.gz NBUTXLOGDZTIAS-UHFFFAOYSA-N 0 0 391.449 3.443 20 5 GGBDRN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000276438050 1435211511 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COc1cc(C(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc([N+](=O)[O-])c1C ZINC000276709484 1435226857 /nfs/dbraw/zinc/22/68/57/1435226857.db2.gz YBPFKTARJWPKQD-UHFFFAOYSA-N 0 0 392.433 3.017 20 5 GGBDRN COC(=O)c1cnc(Nc2ccc(CN(C(C)=O)C3CC3)cc2)c([N+](=O)[O-])c1 ZINC000276712342 1435226934 /nfs/dbraw/zinc/22/69/34/1435226934.db2.gz JPGVFDZYEAZCBP-UHFFFAOYSA-N 0 0 384.392 3.031 20 5 GGBDRN CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1cccc(S(C)(=O)=O)c1 ZINC000276713473 1435227076 /nfs/dbraw/zinc/22/70/76/1435227076.db2.gz DXLANEJGKLKNPV-UHFFFAOYSA-N 0 0 394.424 3.078 20 5 GGBDRN CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000276723665 1435228108 /nfs/dbraw/zinc/22/81/08/1435228108.db2.gz QLXLRWVPGAZWGY-QRTARXTBSA-N 0 0 387.440 3.010 20 5 GGBDRN CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000276723662 1435228143 /nfs/dbraw/zinc/22/81/43/1435228143.db2.gz QLXLRWVPGAZWGY-KMFMINBZSA-N 0 0 387.440 3.010 20 5 GGBDRN CC(C)(C)OC(=O)Nc1ccc(OC(=O)Cn2cc([N+](=O)[O-])cn2)c(Cl)c1 ZINC000276759716 1435230391 /nfs/dbraw/zinc/23/03/91/1435230391.db2.gz MSBUEWUTKCHIPY-UHFFFAOYSA-N 0 0 396.787 3.397 20 5 GGBDRN COC(=O)[C@@H](N[C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(OC)c(O)c1 ZINC000276778415 1435231754 /nfs/dbraw/zinc/23/17/54/1435231754.db2.gz QBLLLOZGDQSVDX-YJYMSZOUSA-N 0 0 388.420 3.134 20 5 GGBDRN CCCOc1cc(NC(=O)N2C[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OCCC ZINC000276795110 1435233186 /nfs/dbraw/zinc/23/31/86/1435233186.db2.gz LLNRQEDTANCCKD-KGLIPLIRSA-N 0 0 395.456 3.265 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)cc([N+](=O)[O-])c1C ZINC000276800136 1435233509 /nfs/dbraw/zinc/23/35/09/1435233509.db2.gz KEGQKLVAPJQDDH-LBPRGKRZSA-N 0 0 387.392 3.138 20 5 GGBDRN COc1ccccc1-c1nc(C2CCN(c3c([N+](=O)[O-])c(C)nn3C)CC2)no1 ZINC000276848941 1435237410 /nfs/dbraw/zinc/23/74/10/1435237410.db2.gz XMSWATZTHNISOJ-UHFFFAOYSA-N 0 0 398.423 3.079 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2ccc([S@](C)=O)cc2)cc([N+](=O)[O-])c1C ZINC000276873630 1435239190 /nfs/dbraw/zinc/23/91/90/1435239190.db2.gz RKBSXNJEGGYPSQ-RYZVSIALSA-N 0 0 376.434 3.140 20 5 GGBDRN CCOc1cc(CNc2ccc(CS(C)(=O)=O)c(F)c2)ccc1[N+](=O)[O-] ZINC000276884986 1435240160 /nfs/dbraw/zinc/24/01/60/1435240160.db2.gz JJIYRAOTNIFEFT-UHFFFAOYSA-N 0 0 382.413 3.289 20 5 GGBDRN CCOc1cc(CN2CCC(NC(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000276898954 1435241265 /nfs/dbraw/zinc/24/12/65/1435241265.db2.gz LIRQQMDDLKQRDB-UHFFFAOYSA-N 0 0 383.448 3.388 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(c2ccccc2)[C@@H]2CCOC2)cc1OC ZINC000276925410 1435243435 /nfs/dbraw/zinc/24/34/35/1435243435.db2.gz SRZHKQOKOQRXQF-OAHLLOKOSA-N 0 0 386.404 3.438 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCc1nc(C)c(C(=O)[O-])s1 ZINC000276929505 1435244146 /nfs/dbraw/zinc/24/41/46/1435244146.db2.gz BHTNKBHTZCVMBQ-UHFFFAOYSA-N 0 0 379.438 3.179 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCCC[C@H]1c1nnc(C2CCOCC2)o1 ZINC000276939503 1435245251 /nfs/dbraw/zinc/24/52/51/1435245251.db2.gz NGYNTXYICBUTOY-LBPRGKRZSA-N 0 0 392.437 3.301 20 5 GGBDRN CCOc1cc(CNc2ccc(C(=O)N3CCOCC3)cc2C)ccc1[N+](=O)[O-] ZINC000276941031 1435245276 /nfs/dbraw/zinc/24/52/76/1435245276.db2.gz SHZSZNSIQYKDKD-UHFFFAOYSA-N 0 0 399.447 3.386 20 5 GGBDRN CC[C@@H](C)c1nnc([C@H](C)NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)[nH]1 ZINC000276941729 1435245386 /nfs/dbraw/zinc/24/53/86/1435245386.db2.gz UUQFXZHQDRPQFK-ZJUUUORDSA-N 0 0 380.836 3.440 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cccc([C@H]3CCOC3)c2)c(C)c([N+](=O)[O-])c1 ZINC000276942900 1435245403 /nfs/dbraw/zinc/24/54/03/1435245403.db2.gz WCYBRFXWWRINNY-HNNXBMFYSA-N 0 0 384.388 3.446 20 5 GGBDRN CC[C@@H](C)c1nnc([C@@H](C)NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)[nH]1 ZINC000276941719 1435245450 /nfs/dbraw/zinc/24/54/50/1435245450.db2.gz UUQFXZHQDRPQFK-NXEZZACHSA-N 0 0 380.836 3.440 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(NC[C@H]2CC[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000276956353 1435246979 /nfs/dbraw/zinc/24/69/79/1435246979.db2.gz RXGZFVHEVAKFPW-DZGCQCFKSA-N 0 0 398.415 3.185 20 5 GGBDRN COc1ccc(CCC(C)=O)cc1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000276959378 1435247111 /nfs/dbraw/zinc/24/71/11/1435247111.db2.gz PQHFKAVKZBHBBV-UHFFFAOYSA-N 0 0 393.417 3.201 20 5 GGBDRN CCCN(C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[C@H](CC)C(=O)OCC ZINC000276960106 1435247239 /nfs/dbraw/zinc/24/72/39/1435247239.db2.gz TVWKUBUIZWVWQH-MRXNPFEDSA-N 0 0 389.408 3.043 20 5 GGBDRN CCOc1cc(CSc2nnc(C(OCC)OCC)n2C)ccc1[N+](=O)[O-] ZINC000276967582 1435247944 /nfs/dbraw/zinc/24/79/44/1435247944.db2.gz WKRHWSACZIITEH-UHFFFAOYSA-N 0 0 396.469 3.486 20 5 GGBDRN CCc1c(NC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])cnn1CCC(C)C ZINC000276988048 1435249944 /nfs/dbraw/zinc/24/99/44/1435249944.db2.gz BVKYORUUSBIMIS-UHFFFAOYSA-N 0 0 388.424 3.230 20 5 GGBDRN CCc1c(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cnn1CCC(C)C ZINC000277026979 1435253511 /nfs/dbraw/zinc/25/35/11/1435253511.db2.gz PEGDETQQRGZIGS-UHFFFAOYSA-N 0 0 387.440 3.285 20 5 GGBDRN CCCc1c(NC(=O)Cn2cc([N+](=O)[O-])nc2C)cnn1-c1ccccc1C ZINC000277097272 1435261626 /nfs/dbraw/zinc/26/16/26/1435261626.db2.gz NWLIYLBOUAQJNB-UHFFFAOYSA-N 0 0 382.424 3.185 20 5 GGBDRN COC(=O)c1cc(NC(=O)NC[C@H](C)c2ncc(C)s2)c(C)c([N+](=O)[O-])c1 ZINC000277129651 1435265649 /nfs/dbraw/zinc/26/56/49/1435265649.db2.gz FXWNYWKUERGRHA-VIFPVBQESA-N 0 0 392.437 3.380 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCC[C@H]2CCO[C@@H](C)C2)c(C)c([N+](=O)[O-])c1 ZINC000277129547 1435265717 /nfs/dbraw/zinc/26/57/17/1435265717.db2.gz FXBPSNOGYKQNGH-AAEUAGOBSA-N 0 0 379.413 3.017 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Oc2ccc([C@H]3CCOC3)cc2)cc1[N+](=O)[O-] ZINC000277134877 1435266487 /nfs/dbraw/zinc/26/64/87/1435266487.db2.gz WXSIDZOLVFEYGQ-LBPRGKRZSA-N 0 0 397.380 3.014 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1ccc(N2CCOC2=O)cc1 ZINC000277137999 1435266888 /nfs/dbraw/zinc/26/68/88/1435266888.db2.gz UMDCGZKVWUBKBK-LBPRGKRZSA-N 0 0 385.376 3.051 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nnc([C@H](C)CC)[nH]2)cc1OC ZINC000277147691 1435268767 /nfs/dbraw/zinc/26/87/67/1435268767.db2.gz VZWQLVSJVGQGLR-MNOVXSKESA-N 0 0 391.428 3.125 20 5 GGBDRN O=C([O-])[C@@H](CN1CCCCC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000277154530 1435269878 /nfs/dbraw/zinc/26/98/78/1435269878.db2.gz CVFHJTWIYPELQE-MRXNPFEDSA-N 0 0 389.477 3.352 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000277182920 1435274962 /nfs/dbraw/zinc/27/49/62/1435274962.db2.gz BCKRLRZVHORRGQ-UHFFFAOYSA-N 0 0 383.452 3.247 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000277187784 1435276141 /nfs/dbraw/zinc/27/61/41/1435276141.db2.gz DCZZBRJYDNPMFR-GFCCVEGCSA-N 0 0 398.341 3.296 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277194388 1435276823 /nfs/dbraw/zinc/27/68/23/1435276823.db2.gz TZUPHQKUHYQFHZ-UHFFFAOYSA-N 0 0 388.395 3.321 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@@H](C)c2ncc(C)s2)c(C)c([N+](=O)[O-])c1 ZINC000277200109 1435277573 /nfs/dbraw/zinc/27/75/73/1435277573.db2.gz LJHQJCLSSVGEFT-JTQLQIEISA-N 0 0 378.410 3.337 20 5 GGBDRN CCc1cnc(CN(C)C(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2C)s1 ZINC000277210974 1435278730 /nfs/dbraw/zinc/27/87/30/1435278730.db2.gz MKUHCXSYRAUNFU-UHFFFAOYSA-N 0 0 392.437 3.373 20 5 GGBDRN O=C([O-])[C@@H](CN1CCCCC1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000277224260 1435280768 /nfs/dbraw/zinc/28/07/68/1435280768.db2.gz IAJQTEHNGVGMJA-QGZVFWFLSA-N 0 0 389.477 3.352 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(C)C[C@@H](C)c2nccs2)c(C)c([N+](=O)[O-])c1 ZINC000277230939 1435282139 /nfs/dbraw/zinc/28/21/39/1435282139.db2.gz ODCUDLAHXMNUHK-SNVBAGLBSA-N 0 0 392.437 3.414 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000277235151 1435282824 /nfs/dbraw/zinc/28/28/24/1435282824.db2.gz KSBCZOWEPVTTSD-UHFFFAOYSA-N 0 0 398.341 3.296 20 5 GGBDRN COC(=O)c1cc(NC(=O)N2CCO[C@@H](c3ccccc3)C2)c(C)c([N+](=O)[O-])c1 ZINC000277251592 1435284806 /nfs/dbraw/zinc/28/48/06/1435284806.db2.gz QBNWTUJXEIMJMQ-GOSISDBHSA-N 0 0 399.403 3.295 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCc2ncc(C(C)(C)C)o2)c(C)c([N+](=O)[O-])c1 ZINC000277269678 1435287294 /nfs/dbraw/zinc/28/72/94/1435287294.db2.gz RLXUCZCPNURICC-UHFFFAOYSA-N 0 0 390.396 3.297 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(N3C(=O)CCC3=O)c(C)c2)cc([N+](=O)[O-])c1C ZINC000277278663 1435288276 /nfs/dbraw/zinc/28/82/76/1435288276.db2.gz PMNNVAWILODCTH-UHFFFAOYSA-N 0 0 397.387 3.126 20 5 GGBDRN COc1ccc(CN2C(=O)[C@H](Cc3ccccc3)N(C3CC3)C2=O)cc1[N+](=O)[O-] ZINC000277276846 1435288301 /nfs/dbraw/zinc/28/83/01/1435288301.db2.gz JQCAMESAYZVYDB-SFHVURJKSA-N 0 0 395.415 3.141 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCCC[C@H]2CCCCO2)c(C)c([N+](=O)[O-])c1 ZINC000277309947 1435292361 /nfs/dbraw/zinc/29/23/61/1435292361.db2.gz VBIVCVHOAJPQDK-CQSZACIVSA-N 0 0 379.413 3.161 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(C)CCc2cccs2)c(C)c([N+](=O)[O-])c1 ZINC000277312205 1435292849 /nfs/dbraw/zinc/29/28/49/1435292849.db2.gz VGOOYIBYSHXBFZ-UHFFFAOYSA-N 0 0 377.422 3.458 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)Oc2ncccc21 ZINC000277317795 1435293484 /nfs/dbraw/zinc/29/34/84/1435293484.db2.gz XAVASYHHZWRHNK-GFCCVEGCSA-N 0 0 389.433 3.156 20 5 GGBDRN COC(=O)c1cc(NC(=O)N2CCc3ccc(OC)cc3C2)c(C)c([N+](=O)[O-])c1 ZINC000277316900 1435293585 /nfs/dbraw/zinc/29/35/85/1435293585.db2.gz VPCGQYJKGNTGEW-UHFFFAOYSA-N 0 0 399.403 3.289 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@H]2CCOC3(CCCC3)C2)c(C)c([N+](=O)[O-])c1 ZINC000277321870 1435293829 /nfs/dbraw/zinc/29/38/29/1435293829.db2.gz VZMASHQNHPVSAF-AWEZNQCLSA-N 0 0 391.424 3.303 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(C)Cc2ccc(OC)cc2)c(C)c([N+](=O)[O-])c1 ZINC000277324529 1435294135 /nfs/dbraw/zinc/29/41/35/1435294135.db2.gz WDUHJJNRADOPCK-UHFFFAOYSA-N 0 0 387.392 3.362 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC[S@@](=O)C1 ZINC000277360770 1435298032 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SGQXYXBAROPPNE-HNNXBMFYSA-N 0 0 399.382 3.222 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1CCC(NC(=O)C(C)(C)C)CC1 ZINC000278915371 1435439507 /nfs/dbraw/zinc/43/95/07/1435439507.db2.gz BWMOHLILEMSTJN-UHFFFAOYSA-N 0 0 375.469 3.274 20 5 GGBDRN COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000278917714 1435439663 /nfs/dbraw/zinc/43/96/63/1435439663.db2.gz LJMIMYHUKDPDOG-MRXNPFEDSA-N 0 0 394.859 3.298 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(N3CCC(c4ncc5n4CCCC5)CC3)cc2N1 ZINC000278962582 1435446073 /nfs/dbraw/zinc/44/60/73/1435446073.db2.gz YLDNMSLVVDRZBX-UHFFFAOYSA-N 0 0 395.463 3.396 20 5 GGBDRN COCCN(CC(F)F)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278964582 1435446272 /nfs/dbraw/zinc/44/62/72/1435446272.db2.gz GXSALTOWXFBBHA-UHFFFAOYSA-N 0 0 385.289 3.037 20 5 GGBDRN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ncnn1CC(F)F ZINC000278982347 1435448341 /nfs/dbraw/zinc/44/83/41/1435448341.db2.gz INPSKAIXABYLMO-UHFFFAOYSA-N 0 0 377.351 3.343 20 5 GGBDRN COc1cc(C(=O)O[C@@H]([C@H]2CCCOC2)C(F)(F)F)cc([N+](=O)[O-])c1OC ZINC000279003735 1435450997 /nfs/dbraw/zinc/45/09/97/1435450997.db2.gz CYXDSLYMQULJFN-XPTSAGLGSA-N 0 0 393.314 3.126 20 5 GGBDRN COc1cc(C(=O)O[C@H]([C@@H]2CCCOC2)C(F)(F)F)cc([N+](=O)[O-])c1OC ZINC000279003739 1435451080 /nfs/dbraw/zinc/45/10/80/1435451080.db2.gz CYXDSLYMQULJFN-YMTOWFKASA-N 0 0 393.314 3.126 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1nc(C2CCC2)cs1 ZINC000279009119 1435451692 /nfs/dbraw/zinc/45/16/92/1435451692.db2.gz DPAGDIGWVLCUSB-UHFFFAOYSA-N 0 0 394.840 3.227 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCO1 ZINC000279015481 1435452197 /nfs/dbraw/zinc/45/21/97/1435452197.db2.gz IIPQGEZPNUVQAH-GUYCJALGSA-N 0 0 389.456 3.254 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCO1 ZINC000279015480 1435452274 /nfs/dbraw/zinc/45/22/74/1435452274.db2.gz IIPQGEZPNUVQAH-DYVFJYSZSA-N 0 0 389.456 3.254 20 5 GGBDRN COc1ccc(OC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000279017947 1435452467 /nfs/dbraw/zinc/45/24/67/1435452467.db2.gz GCGWJDZWFGJFHB-UHFFFAOYSA-N 0 0 378.425 3.230 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000279029354 1435453628 /nfs/dbraw/zinc/45/36/28/1435453628.db2.gz ALRPALSWBCQBIK-CYBMUJFWSA-N 0 0 384.314 3.451 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@H]2CCCO2)nn1C ZINC000279034676 1435454247 /nfs/dbraw/zinc/45/42/47/1435454247.db2.gz BYECHALTWQRSMG-XHDPSFHLSA-N 0 0 376.438 3.299 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC(CCCO)CC1 ZINC000279035427 1435454489 /nfs/dbraw/zinc/45/44/89/1435454489.db2.gz NXYRUMYRCXWIMS-UHFFFAOYSA-N 0 0 389.374 3.308 20 5 GGBDRN C[C@@]1(CCCO)CCCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279039606 1435454673 /nfs/dbraw/zinc/45/46/73/1435454673.db2.gz OLBZDSVJUCIGLJ-INIZCTEOSA-N 0 0 389.374 3.450 20 5 GGBDRN CC(C)(O)CN(C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000279049797 1435455525 /nfs/dbraw/zinc/45/55/25/1435455525.db2.gz PFKURWUIPDNBPS-UHFFFAOYSA-N 0 0 375.347 3.059 20 5 GGBDRN CC(C)(C)Oc1ccc(CNC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cn1 ZINC000279051599 1435455659 /nfs/dbraw/zinc/45/56/59/1435455659.db2.gz MJAQOIIAUAIIIJ-UHFFFAOYSA-N 0 0 398.423 3.043 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N[C@H]1CCCOc2c(F)cccc21 ZINC000279074137 1435457806 /nfs/dbraw/zinc/45/78/06/1435457806.db2.gz OTJGEYBEUUDPLZ-AWEZNQCLSA-N 0 0 399.382 3.323 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279087837 1435459225 /nfs/dbraw/zinc/45/92/25/1435459225.db2.gz VADCHAPBFZNFOH-OAHLLOKOSA-N 0 0 393.831 3.197 20 5 GGBDRN O=C(NCc1ncnn1-c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000279092520 1435459544 /nfs/dbraw/zinc/45/95/44/1435459544.db2.gz UAOPLXXZPYZYNF-UHFFFAOYSA-N 0 0 392.419 3.050 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000279122626 1435462526 /nfs/dbraw/zinc/46/25/26/1435462526.db2.gz MECQVNFWKGSOST-KEDPEKRHSA-N 0 0 376.800 3.485 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000279122628 1435462549 /nfs/dbraw/zinc/46/25/49/1435462549.db2.gz MECQVNFWKGSOST-ZKKXHLJNSA-N 0 0 376.800 3.485 20 5 GGBDRN Cc1ccc([C@H](O)CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000279133203 1435463727 /nfs/dbraw/zinc/46/37/27/1435463727.db2.gz YIZNSZNYNXTMQO-CYBMUJFWSA-N 0 0 387.314 3.048 20 5 GGBDRN CCOC[C@@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000279134891 1435463952 /nfs/dbraw/zinc/46/39/52/1435463952.db2.gz YNKVOKOSFGKXIS-LLVKDONJSA-N 0 0 375.347 3.182 20 5 GGBDRN CN(C[C@@H]1CCCOC1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279135040 1435463968 /nfs/dbraw/zinc/46/39/68/1435463968.db2.gz YOKBNACIRIDCIR-NSHDSACASA-N 0 0 375.347 3.182 20 5 GGBDRN CCC[C@H](CCO)CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279140122 1435464438 /nfs/dbraw/zinc/46/44/38/1435464438.db2.gz ZCJMFJWOXLHWEG-LLVKDONJSA-N 0 0 377.363 3.212 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NC[C@H](O)c1ccsc1 ZINC000279141697 1435464732 /nfs/dbraw/zinc/46/47/32/1435464732.db2.gz ZHANQVORTFRUBA-ZDUSSCGKSA-N 0 0 389.355 3.208 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279140866 1435464748 /nfs/dbraw/zinc/46/47/48/1435464748.db2.gz GFTKBCCCQYTHSK-ADLMAVQZSA-N 0 0 393.390 3.181 20 5 GGBDRN Cc1ccccc1C1(CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CCOCC1 ZINC000279142296 1435464751 /nfs/dbraw/zinc/46/47/51/1435464751.db2.gz DFODGHIELZGAAJ-UHFFFAOYSA-N 0 0 387.411 3.103 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NC[C@@H](O)c1ccsc1 ZINC000279141694 1435464785 /nfs/dbraw/zinc/46/47/85/1435464785.db2.gz ZHANQVORTFRUBA-CYBMUJFWSA-N 0 0 389.355 3.208 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279144496 1435464911 /nfs/dbraw/zinc/46/49/11/1435464911.db2.gz ZPPFFYKMUOKMDF-UHFFFAOYSA-N 0 0 399.373 3.350 20 5 GGBDRN CCOC(CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)OCC ZINC000279147543 1435465210 /nfs/dbraw/zinc/46/52/10/1435465210.db2.gz ZXVSOUCPBXPPLB-UHFFFAOYSA-N 0 0 393.362 3.202 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)c1 ZINC000279154056 1435465628 /nfs/dbraw/zinc/46/56/28/1435465628.db2.gz HPXHFOYVXQDRAF-NSHDSACASA-N 0 0 388.399 3.249 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2C[C@@H](O)C(C)(C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000279175820 1435467886 /nfs/dbraw/zinc/46/78/86/1435467886.db2.gz BHQRSBAHWWTUDQ-SCLBCKFNSA-N 0 0 384.436 3.006 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2C[C@H](O)C(C)(C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000279175824 1435467889 /nfs/dbraw/zinc/46/78/89/1435467889.db2.gz BHQRSBAHWWTUDQ-UGSOOPFHSA-N 0 0 384.436 3.006 20 5 GGBDRN CSC[C@@](C)(O)CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000279184659 1435468497 /nfs/dbraw/zinc/46/84/97/1435468497.db2.gz MGVWRCMZEVQURH-IBGZPJMESA-N 0 0 390.461 3.018 20 5 GGBDRN COCCOc1cc(C)ccc1NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279187555 1435469013 /nfs/dbraw/zinc/46/90/13/1435469013.db2.gz KZQKMIVMDZJTNB-UHFFFAOYSA-N 0 0 391.399 3.386 20 5 GGBDRN COc1cc(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc(OC)c1O ZINC000279199935 1435470720 /nfs/dbraw/zinc/47/07/20/1435470720.db2.gz JYWVEFNOCXVCHD-UHFFFAOYSA-N 0 0 388.420 3.297 20 5 GGBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279203993 1435471247 /nfs/dbraw/zinc/47/12/47/1435471247.db2.gz NBEXGFDLTKWLMF-CQSZACIVSA-N 0 0 375.404 3.117 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc1[N+](=O)[O-] ZINC000279222045 1435473518 /nfs/dbraw/zinc/47/35/18/1435473518.db2.gz PEBCJLGMQTWJHU-UHFFFAOYSA-N 0 0 386.383 3.327 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC2(CCOCC2)O1 ZINC000279225301 1435473771 /nfs/dbraw/zinc/47/37/71/1435473771.db2.gz OHRWSEXODPWQEN-NSHDSACASA-N 0 0 388.342 3.024 20 5 GGBDRN COCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)cc1F ZINC000279231470 1435474591 /nfs/dbraw/zinc/47/45/91/1435474591.db2.gz QGUUZJBVPBDQJS-UHFFFAOYSA-N 0 0 395.362 3.217 20 5 GGBDRN Cc1ccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])cc1C(=O)N(C)C(C)C ZINC000279240488 1435475843 /nfs/dbraw/zinc/47/58/43/1435475843.db2.gz SYCBETBSKHHWLU-UHFFFAOYSA-N 0 0 387.440 3.482 20 5 GGBDRN C[C@H](O)C[C@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)c1ccccc1 ZINC000279243610 1435476224 /nfs/dbraw/zinc/47/62/24/1435476224.db2.gz RZWZLQRWRHLMSK-DZGCQCFKSA-N 0 0 389.427 3.084 20 5 GGBDRN Cc1c(OC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000279247738 1435476913 /nfs/dbraw/zinc/47/69/13/1435476913.db2.gz HTDBTSITYKVKMD-OAHLLOKOSA-N 0 0 377.418 3.027 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(OCCCOC)c1 ZINC000279250023 1435477118 /nfs/dbraw/zinc/47/71/18/1435477118.db2.gz ABHKHZCJNYHVEH-UHFFFAOYSA-N 0 0 388.420 3.339 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H](CCS(C)(=O)=O)c1ccccc1 ZINC000279262193 1435478755 /nfs/dbraw/zinc/47/87/55/1435478755.db2.gz JKCQKRWTKDRMGQ-INIZCTEOSA-N 0 0 390.461 3.369 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)c1ccc(NC(=O)C2CC2)cc1 ZINC000279265211 1435479352 /nfs/dbraw/zinc/47/93/52/1435479352.db2.gz ULSABYMPXIVZTG-SNVBAGLBSA-N 0 0 386.383 3.156 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N2CCC(OC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000279272699 1435480135 /nfs/dbraw/zinc/48/01/35/1435480135.db2.gz WLPFKVQKGBNBSN-UHFFFAOYSA-N 0 0 379.432 3.364 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C ZINC000279275011 1435480530 /nfs/dbraw/zinc/48/05/30/1435480530.db2.gz JTEIRBPNDOQDBR-QWHCGFSZSA-N 0 0 390.465 3.342 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(NC(=O)[C@H](C)OC)c1 ZINC000279284172 1435481751 /nfs/dbraw/zinc/48/17/51/1435481751.db2.gz KKCRUDBPYFVPMQ-LBPRGKRZSA-N 0 0 387.392 3.219 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)[C@@H](CCS(C)(=O)=O)c1ccccc1 ZINC000279290105 1435482510 /nfs/dbraw/zinc/48/25/10/1435482510.db2.gz MGHUCQVOMMVHEO-INIZCTEOSA-N 0 0 377.418 3.027 20 5 GGBDRN CCN(CC)C(=O)CCCC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279323264 1435486379 /nfs/dbraw/zinc/48/63/79/1435486379.db2.gz PFTJGKYCJUYMFU-UHFFFAOYSA-N 0 0 389.374 3.269 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(OCC(=O)OC)cc1C ZINC000279391132 1435494315 /nfs/dbraw/zinc/49/43/15/1435494315.db2.gz UHHMGJPZEVVJNB-UHFFFAOYSA-N 0 0 388.376 3.106 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000279396867 1435494738 /nfs/dbraw/zinc/49/47/38/1435494738.db2.gz VUYFIAGMYZIXNW-KRWDZBQOSA-N 0 0 385.424 3.032 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000279399349 1435495092 /nfs/dbraw/zinc/49/50/92/1435495092.db2.gz RPKVYDCKEFTBBH-HNNXBMFYSA-N 0 0 399.451 3.075 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(CC)Cc1ccc(C(=O)N(C)C)cc1 ZINC000279400776 1435495391 /nfs/dbraw/zinc/49/53/91/1435495391.db2.gz VBVKMRSKKLBJQL-UHFFFAOYSA-N 0 0 399.447 3.358 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000279403952 1435495535 /nfs/dbraw/zinc/49/55/35/1435495535.db2.gz JWPGWZHPJWDGFN-OAHLLOKOSA-N 0 0 387.367 3.065 20 5 GGBDRN C[C@@H]1OCC[C@]12CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C[C@@H](C)O2 ZINC000279424481 1435497787 /nfs/dbraw/zinc/49/77/87/1435497787.db2.gz UAKVIQXPOWKJFJ-GDLVEWKHSA-N 0 0 388.342 3.022 20 5 GGBDRN COCCCOC1CCN(c2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)CC1 ZINC000279426234 1435498226 /nfs/dbraw/zinc/49/82/26/1435498226.db2.gz KOYYAKIQSOAYOK-UHFFFAOYSA-N 0 0 386.832 3.057 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(CN2CCCC2=O)cc1 ZINC000279427545 1435498237 /nfs/dbraw/zinc/49/82/37/1435498237.db2.gz XLVGBEMJDITKNK-UHFFFAOYSA-N 0 0 383.404 3.368 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3C[C@@H](O)C(C)(C)C3)cc2[N+](=O)[O-])n1 ZINC000279433141 1435498612 /nfs/dbraw/zinc/49/86/12/1435498612.db2.gz UNRUEZXMFGQILR-CQSZACIVSA-N 0 0 393.490 3.354 20 5 GGBDRN Cc1cc(C(=O)N2CCC(c3ncc4n3CCCC4)CC2)c(N)c([N+](=O)[O-])c1 ZINC000279451863 1435500867 /nfs/dbraw/zinc/50/08/67/1435500867.db2.gz DLCQHNPFSLBJFF-UHFFFAOYSA-N 0 0 383.452 3.038 20 5 GGBDRN CC(C)CN(C[C@H](O)c1ccc(F)cc1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000279457307 1435501385 /nfs/dbraw/zinc/50/13/85/1435501385.db2.gz OPDVQIPYHZTMMB-SFHVURJKSA-N 0 0 393.390 3.287 20 5 GGBDRN Cc1c(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)nnn1CC1CCCC1 ZINC000279482236 1435504031 /nfs/dbraw/zinc/50/40/31/1435504031.db2.gz FVMDEFJLYFXVLM-UHFFFAOYSA-N 0 0 380.408 3.485 20 5 GGBDRN Cc1ccc2[nH]c([C@H]3CCCN3C(=O)c3cc([N+](=O)[O-])c(F)cc3N)nc2c1 ZINC000279481331 1435504045 /nfs/dbraw/zinc/50/40/45/1435504045.db2.gz QUWJDRYBFDDTQW-MRXNPFEDSA-N 0 0 383.383 3.478 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)Nc2ccccc2O[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000279494002 1435505627 /nfs/dbraw/zinc/50/56/27/1435505627.db2.gz RWLYHRVQZNQMTN-GFCCVEGCSA-N 0 0 389.383 3.220 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc1[N+](=O)[O-] ZINC000279504798 1435507154 /nfs/dbraw/zinc/50/71/54/1435507154.db2.gz YYIPBUPJRKDWPB-GFCCVEGCSA-N 0 0 376.438 3.197 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279544520 1435511472 /nfs/dbraw/zinc/51/14/72/1435511472.db2.gz VXFMRKKFMRAKPS-MEBBXXQBSA-N 0 0 381.429 3.103 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000279581114 1435515559 /nfs/dbraw/zinc/51/55/59/1435515559.db2.gz ULAOACKGPMMXHG-UHFFFAOYSA-N 0 0 376.844 3.413 20 5 GGBDRN C[C@@H]1OCC[C@]12CN(C(=O)c1ccc3[nH]c4ccccc4c(=O)c3c1)CCO2 ZINC000279602445 1435517862 /nfs/dbraw/zinc/51/78/62/1435517862.db2.gz BEQWZNFMDDHMOS-FPTDNZKUSA-N 0 0 378.428 3.114 20 5 GGBDRN Cc1cc(N2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279623119 1435520227 /nfs/dbraw/zinc/52/02/27/1435520227.db2.gz YQFFVQXUXLXWFU-AUSJPIAWSA-N 0 0 384.436 3.133 20 5 GGBDRN C[C@H]1OCC[C@]12CN(Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)CCO2 ZINC000279641481 1435522610 /nfs/dbraw/zinc/52/26/10/1435522610.db2.gz JGPBENVGZNAEHN-ACJLOTCBSA-N 0 0 375.450 3.098 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](c1ccc(C)cc1)c1ccccn1 ZINC000279667325 1435526065 /nfs/dbraw/zinc/52/60/65/1435526065.db2.gz LKSFHGWGQSTSIY-HXUWFJFHSA-N 0 0 379.420 3.099 20 5 GGBDRN Cc1c(NC(=O)NCCc2ccccc2[N+](=O)[O-])cccc1NC(=O)N(C)C ZINC000279686773 1435529701 /nfs/dbraw/zinc/52/97/01/1435529701.db2.gz NEHUKDXBSFZEOI-UHFFFAOYSA-N 0 0 385.424 3.361 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](c2ccc(C)cc2)c2ccccn2)c(C)c1[N+](=O)[O-] ZINC000279717881 1435534268 /nfs/dbraw/zinc/53/42/68/1435534268.db2.gz QQXLLJZXTQAFDO-HXUWFJFHSA-N 0 0 393.447 3.407 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)CC(=O)Nc1cccc(C)c1C ZINC000279736491 1435536624 /nfs/dbraw/zinc/53/66/24/1435536624.db2.gz OILBVRMMZVTFLG-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCC(=O)Nc1c(C)cc(C)cc1C ZINC000279739369 1435536878 /nfs/dbraw/zinc/53/68/78/1435536878.db2.gz OQYHRDYYICNREU-UHFFFAOYSA-N 0 0 385.420 3.287 20 5 GGBDRN COc1ccc(OC)c(C2=NO[C@H](C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)C2)c1 ZINC000279743646 1435537334 /nfs/dbraw/zinc/53/73/34/1435537334.db2.gz PFRBDYCPIMXWEJ-SFHVURJKSA-N 0 0 399.403 3.361 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2cc(C)ccc2[N+](=O)[O-])sc1C ZINC000279745781 1435537492 /nfs/dbraw/zinc/53/74/92/1435537492.db2.gz UHRPFFVCPUYDLD-CQSZACIVSA-N 0 0 389.433 3.432 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)c3cccc(COC)c3)CC2)ccc1[N+](=O)[O-] ZINC000279745804 1435537861 /nfs/dbraw/zinc/53/78/61/1435537861.db2.gz BRCXOFUCLAYVMU-UHFFFAOYSA-N 0 0 399.447 3.102 20 5 GGBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CCCC2(C1)OCCO2 ZINC000279753831 1435538879 /nfs/dbraw/zinc/53/88/79/1435538879.db2.gz DDQPTOXKWHGQGL-UHFFFAOYSA-N 0 0 398.415 3.153 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCOCC2)cc1C ZINC000279770406 1435540764 /nfs/dbraw/zinc/54/07/64/1435540764.db2.gz SNNCLWCTIGVLCK-UHFFFAOYSA-N 0 0 385.420 3.391 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)c3ccc(Cl)nc3)CC2)ccc1[N+](=O)[O-] ZINC000279772700 1435541039 /nfs/dbraw/zinc/54/10/39/1435541039.db2.gz HNKCBILNWXMCSC-UHFFFAOYSA-N 0 0 390.827 3.004 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2cc(F)ccc2[N+](=O)[O-])sc1C ZINC000279777009 1435541469 /nfs/dbraw/zinc/54/14/69/1435541469.db2.gz WZAAWDDJWCIYMG-CYBMUJFWSA-N 0 0 393.396 3.263 20 5 GGBDRN Cc1nc2ccccc2n1C1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000279786618 1435542859 /nfs/dbraw/zinc/54/28/59/1435542859.db2.gz JRTAQDATNLLDQI-UHFFFAOYSA-N 0 0 394.431 3.495 20 5 GGBDRN O=C(O[C@@H]([C@H]1CCCOC1)C(F)(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000279788204 1435543250 /nfs/dbraw/zinc/54/32/50/1435543250.db2.gz WTOUYHWQEMLFSZ-UFBFGSQYSA-N 0 0 378.259 3.017 20 5 GGBDRN O=C(O[C@H]([C@H]1CCCOC1)C(F)(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000279788200 1435543339 /nfs/dbraw/zinc/54/33/39/1435543339.db2.gz WTOUYHWQEMLFSZ-QPUJVOFHSA-N 0 0 378.259 3.017 20 5 GGBDRN Cc1nc2ccccc2n1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000279789659 1435543544 /nfs/dbraw/zinc/54/35/44/1435543544.db2.gz JZAQTEKWTMMVSF-UHFFFAOYSA-N 0 0 379.420 3.312 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)c3cc(C(C)C)on3)CC2)ccc1[N+](=O)[O-] ZINC000279811261 1435546205 /nfs/dbraw/zinc/54/62/05/1435546205.db2.gz OAGWYWKULMFLLK-UHFFFAOYSA-N 0 0 388.424 3.067 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC(n3c(C)nc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000279812878 1435546483 /nfs/dbraw/zinc/54/64/83/1435546483.db2.gz OISGJRHPUYMHCX-UHFFFAOYSA-N 0 0 382.424 3.016 20 5 GGBDRN Cc1nc2ccccc2n1C1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000279822061 1435547420 /nfs/dbraw/zinc/54/74/20/1435547420.db2.gz PLNZJKDOMAQEOR-UHFFFAOYSA-N 0 0 379.420 3.312 20 5 GGBDRN CNC(=O)COc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c(C)c1 ZINC000279846134 1435550953 /nfs/dbraw/zinc/55/09/53/1435550953.db2.gz DOWMFKNLSFHGLF-UHFFFAOYSA-N 0 0 385.420 3.404 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC(n3c(C)nc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000279876569 1435556468 /nfs/dbraw/zinc/55/64/68/1435556468.db2.gz WPZLJASQCXPNDF-UHFFFAOYSA-N 0 0 396.451 3.406 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279889107 1435558527 /nfs/dbraw/zinc/55/85/27/1435558527.db2.gz SPNOSQXZQWIZDG-UHFFFAOYSA-N 0 0 395.818 3.390 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(CN(C)C)c(Cl)c2)c(C)c1[N+](=O)[O-] ZINC000279889529 1435558530 /nfs/dbraw/zinc/55/85/30/1435558530.db2.gz DZKORIOUROPMSB-UHFFFAOYSA-N 0 0 379.848 3.152 20 5 GGBDRN CC(C)(C)[C@@H]1CCCN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000279901567 1435560133 /nfs/dbraw/zinc/56/01/33/1435560133.db2.gz AWCGVMFZXSTSRU-GFCCVEGCSA-N 0 0 381.860 3.263 20 5 GGBDRN C[C@@H](O)C[C@H]1CCCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000279926699 1435564502 /nfs/dbraw/zinc/56/45/02/1435564502.db2.gz WJKIYFUERHIHIF-IAGOWNOFSA-N 0 0 378.472 3.307 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(O)(Cc2cccc(C)c2)CC1 ZINC000279941610 1435566852 /nfs/dbraw/zinc/56/68/52/1435566852.db2.gz HRKUYLUKJWJGCR-UHFFFAOYSA-N 0 0 384.432 3.122 20 5 GGBDRN C[C@@H](O)C[C@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279951916 1435568461 /nfs/dbraw/zinc/56/84/61/1435568461.db2.gz XSPVQNHTZCSUMX-IUODEOHRSA-N 0 0 375.450 3.484 20 5 GGBDRN CCOc1cc(NC(=O)N2CCC[C@@](C)(O)CC2)c([N+](=O)[O-])cc1OCC ZINC000279989340 1435572938 /nfs/dbraw/zinc/57/29/38/1435572938.db2.gz KIOOCZXSNHWAGV-GOSISDBHSA-N 0 0 381.429 3.161 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@](C)(C(N)=O)C2)cc1[N+](=O)[O-] ZINC000280006447 1435575573 /nfs/dbraw/zinc/57/55/73/1435575573.db2.gz KTGIGWXVMNUAMJ-SFHVURJKSA-N 0 0 379.482 3.071 20 5 GGBDRN C[C@@](O)(CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C(F)(F)F ZINC000280007756 1435575754 /nfs/dbraw/zinc/57/57/54/1435575754.db2.gz XACXOMRRLNBWQR-QGZVFWFLSA-N 0 0 398.337 3.217 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N(CCCO)Cc1ccccn1 ZINC000280010674 1435576309 /nfs/dbraw/zinc/57/63/09/1435576309.db2.gz LANUAODVAUDDKW-UHFFFAOYSA-N 0 0 395.868 3.147 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccnn1CC(F)F ZINC000280087636 1435589699 /nfs/dbraw/zinc/58/96/99/1435589699.db2.gz LEEJNIFGFPYFKP-UHFFFAOYSA-N 0 0 378.257 3.005 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCc1nc2c(s1)CCCC2 ZINC000280105047 1435593276 /nfs/dbraw/zinc/59/32/76/1435593276.db2.gz PFLXHUUSINQSSB-UHFFFAOYSA-N 0 0 375.450 3.301 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c(N)c2F)sc1C ZINC000280119466 1435595041 /nfs/dbraw/zinc/59/50/41/1435595041.db2.gz ALUOGNXQDXHZOK-NSHDSACASA-N 0 0 380.401 3.209 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000280122649 1435596082 /nfs/dbraw/zinc/59/60/82/1435596082.db2.gz PQBGVOWHQPBPSI-LLVKDONJSA-N 0 0 382.367 3.436 20 5 GGBDRN CCC(=O)c1ccc(N[C@@H](CS(C)(=O)=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000280165769 1435602146 /nfs/dbraw/zinc/60/21/46/1435602146.db2.gz CICXWKWLCFLGGA-INIZCTEOSA-N 0 0 376.434 3.385 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1C(N)=O ZINC000280177264 1435604427 /nfs/dbraw/zinc/60/44/27/1435604427.db2.gz VJQMWBSPEJLQPS-UHFFFAOYSA-N 0 0 398.419 3.308 20 5 GGBDRN C[C@H](C(=O)OC(C)(C)C)c1noc([C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)n1 ZINC000280189930 1435606064 /nfs/dbraw/zinc/60/60/64/1435606064.db2.gz ASXWXDSRJHYGTH-IINYFYTJSA-N 0 0 388.380 3.289 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2c2nc(C3CCOCC3)no2)ccc1[N+](=O)[O-] ZINC000280192395 1435606299 /nfs/dbraw/zinc/60/62/99/1435606299.db2.gz DEDVTHWOEAGCNM-INIZCTEOSA-N 0 0 386.408 3.158 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCCN(c2nccs2)CC1 ZINC000280192047 1435606343 /nfs/dbraw/zinc/60/63/43/1435606343.db2.gz PDRAJFQBHVKVIO-UHFFFAOYSA-N 0 0 398.847 3.125 20 5 GGBDRN CO[C@]1(C)CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000280201857 1435607729 /nfs/dbraw/zinc/60/77/29/1435607729.db2.gz JMGJHHWQKJAMCG-CQSZACIVSA-N 0 0 396.387 3.193 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000280232906 1435614709 /nfs/dbraw/zinc/61/47/09/1435614709.db2.gz BELUBTJKZOGYQE-UHFFFAOYSA-N 0 0 389.355 3.441 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])Nc1cc([C@H]2CCCOC2)[nH]n1 ZINC000280240182 1435616568 /nfs/dbraw/zinc/61/65/68/1435616568.db2.gz XZXJZCSKXAMFKS-VIFPVBQESA-N 0 0 382.779 3.186 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H](CC(N)=O)c1ccccc1 ZINC000280244218 1435617120 /nfs/dbraw/zinc/61/71/20/1435617120.db2.gz PCQORCPXTBSSSB-DYVFJYSZSA-N 0 0 387.461 3.151 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2Cc2cc([N+](=O)[O-])ccc2OC)sc1C ZINC000280260706 1435620902 /nfs/dbraw/zinc/62/09/02/1435620902.db2.gz CKVPWTBHVWXLFK-CQSZACIVSA-N 0 0 391.449 3.492 20 5 GGBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000280273293 1435623600 /nfs/dbraw/zinc/62/36/00/1435623600.db2.gz ZRPHANWZSHPZDW-HNNXBMFYSA-N 0 0 399.451 3.067 20 5 GGBDRN C[C@@H]1CN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000280285502 1435626386 /nfs/dbraw/zinc/62/63/86/1435626386.db2.gz QCILNIQAWMLSQZ-RNCFNFMXSA-N 0 0 397.300 3.028 20 5 GGBDRN COc1ccc(C(=O)N2CCC(O)(Cc3cccc(C)c3)CC2)cc1[N+](=O)[O-] ZINC000280370934 1435646232 /nfs/dbraw/zinc/64/62/32/1435646232.db2.gz YYXBCIMXLAFKHC-UHFFFAOYSA-N 0 0 384.432 3.122 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N[C@@H]2CCO[C@H]2c2ccc(=O)[nH]c2)cc1[N+](=O)[O-] ZINC000280376407 1435647980 /nfs/dbraw/zinc/64/79/80/1435647980.db2.gz ZKRSNARRZLCZIA-QAPCUYQASA-N 0 0 385.420 3.253 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2nc(Cc3ccccn3)no2)ccc1[N+](=O)[O-] ZINC000280393274 1435651751 /nfs/dbraw/zinc/65/17/51/1435651751.db2.gz XCAUDQYUPFGUJE-QGZVFWFLSA-N 0 0 393.403 3.249 20 5 GGBDRN COc1ccc(CN2C(=O)[C@@H]3CC[C@@H](c4ccccc4)N3C2=O)cc1[N+](=O)[O-] ZINC000280400617 1435653563 /nfs/dbraw/zinc/65/35/63/1435653563.db2.gz OIKYGSWBNLUUSE-HOTGVXAUSA-N 0 0 381.388 3.271 20 5 GGBDRN Cc1cc(OCC(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)ccc1[N+](=O)[O-] ZINC000280427082 1435659120 /nfs/dbraw/zinc/65/91/20/1435659120.db2.gz RNABICIGJZRJPT-OAHLLOKOSA-N 0 0 395.419 3.082 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C[C@@H](O)c2cccc([N+](=O)[O-])c2)sc1C ZINC000280430742 1435659796 /nfs/dbraw/zinc/65/97/96/1435659796.db2.gz MLYHYAKIVRKBQN-HUUCEWRRSA-N 0 0 391.449 3.017 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H](CCS(C)(=O)=O)c1ccccc1 ZINC000280440426 1435661344 /nfs/dbraw/zinc/66/13/44/1435661344.db2.gz JZIVMVRHVFAUIO-MRXNPFEDSA-N 0 0 390.461 3.369 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CC1 ZINC000280463990 1435664786 /nfs/dbraw/zinc/66/47/86/1435664786.db2.gz OOLBDNIQYDLTNQ-ZDUSSCGKSA-N 0 0 393.440 3.027 20 5 GGBDRN Cc1ccc([C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)S(C)(=O)=O)cc1 ZINC000280508762 1435671344 /nfs/dbraw/zinc/67/13/44/1435671344.db2.gz ACAJSBIBBSWLEV-SUMWQHHRSA-N 0 0 391.449 3.199 20 5 GGBDRN C[C@@H]1OCC[C@@]12CN(Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)C[C@@H](C)O2 ZINC000280519444 1435672583 /nfs/dbraw/zinc/67/25/83/1435672583.db2.gz QXVTYKKRCZAZHW-BIENJYKASA-N 0 0 389.477 3.487 20 5 GGBDRN C[C@H]1OCC[C@@]12CN(Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)C[C@@H](C)O2 ZINC000280519455 1435672634 /nfs/dbraw/zinc/67/26/34/1435672634.db2.gz QXVTYKKRCZAZHW-PJIJBLCYSA-N 0 0 389.477 3.487 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1 ZINC000280524418 1435673167 /nfs/dbraw/zinc/67/31/67/1435673167.db2.gz RYLHZLBIFGIANR-CQSZACIVSA-N 0 0 385.420 3.471 20 5 GGBDRN CCc1cc(NC[C@H]2CCCN(C(C)=O)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000280526661 1435673470 /nfs/dbraw/zinc/67/34/70/1435673470.db2.gz RGTZMYAUGXPUFW-OAHLLOKOSA-N 0 0 383.452 3.285 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000280541962 1435676271 /nfs/dbraw/zinc/67/62/71/1435676271.db2.gz IDBAJMSMNIMSMB-INIZCTEOSA-N 0 0 399.451 3.120 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(CS(C)(=O)=O)c1C ZINC000280557027 1435679627 /nfs/dbraw/zinc/67/96/27/1435679627.db2.gz URQWGLKCBZDJHF-UHFFFAOYSA-N 0 0 392.433 3.099 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c([N+](=O)[O-])cc1OC ZINC000280587814 1435683975 /nfs/dbraw/zinc/68/39/75/1435683975.db2.gz CSUGOEFJXCZKRG-TVQRCGJNSA-N 0 0 396.321 3.315 20 5 GGBDRN O=C(N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000280595437 1435685301 /nfs/dbraw/zinc/68/53/01/1435685301.db2.gz DKKWIYZUWZWUIP-TVQRCGJNSA-N 0 0 394.305 3.069 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H]1C[C@H](c2ccccc2)C1 ZINC000280597676 1435685848 /nfs/dbraw/zinc/68/58/48/1435685848.db2.gz DRTDKQICYBIIMD-WKILWMFISA-N 0 0 395.415 3.345 20 5 GGBDRN CC[C@H](CO)NC(=O)c1ccc(NCc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000280656152 1435698940 /nfs/dbraw/zinc/69/89/40/1435698940.db2.gz KPRKROSUKILOSC-OAHLLOKOSA-N 0 0 377.828 3.361 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000280662528 1435699914 /nfs/dbraw/zinc/69/99/14/1435699914.db2.gz DJROPVXXQNGOGB-UHFFFAOYSA-N 0 0 384.436 3.104 20 5 GGBDRN Cc1ccc([C@H](NCc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000280682400 1435703050 /nfs/dbraw/zinc/70/30/50/1435703050.db2.gz NMWJZAHECCCOGQ-DNVCBOLYSA-N 0 0 376.478 3.476 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](CCS(C)(=O)=O)c1ccccc1 ZINC000280683445 1435703076 /nfs/dbraw/zinc/70/30/76/1435703076.db2.gz QPCPERTYXAYZEH-INIZCTEOSA-N 0 0 376.434 3.060 20 5 GGBDRN Cc1ccc([C@H](NCc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)S(C)(=O)=O)cc1 ZINC000280682402 1435703236 /nfs/dbraw/zinc/70/32/36/1435703236.db2.gz NMWJZAHECCCOGQ-HNAYVOBHSA-N 0 0 376.478 3.476 20 5 GGBDRN Cc1ccc([C@H](NCc2ccc([N+](=O)[O-])cc2F)[C@@H](C)S(C)(=O)=O)cc1 ZINC000280729818 1435710575 /nfs/dbraw/zinc/71/05/75/1435710575.db2.gz GQPKAWQZKDXKTP-FZKQIMNGSA-N 0 0 380.441 3.306 20 5 GGBDRN C[C@]1(O)CCCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000280728458 1435710704 /nfs/dbraw/zinc/71/07/04/1435710704.db2.gz YROBHIIFEJOHJI-INIZCTEOSA-N 0 0 389.374 3.179 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@]2(CCOC2)O1 ZINC000280739645 1435712380 /nfs/dbraw/zinc/71/23/80/1435712380.db2.gz ZMZVZXBSRYPSSN-FPTDNZKUSA-N 0 0 378.428 3.114 20 5 GGBDRN COC(=O)c1cc(NC(=O)N2CCC[C@](C)(OC)CC2)c(C)c([N+](=O)[O-])c1 ZINC000280738476 1435712491 /nfs/dbraw/zinc/71/24/91/1435712491.db2.gz FAASABRMZYPJJU-SFHVURJKSA-N 0 0 379.413 3.113 20 5 GGBDRN CCC(=O)c1ccc(NC2CCN(C(=O)c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000280746770 1435713774 /nfs/dbraw/zinc/71/37/74/1435713774.db2.gz PBMRBRXJPONPFU-UHFFFAOYSA-N 0 0 382.420 3.299 20 5 GGBDRN CCC(=O)c1ccc(NCCS(=O)(=O)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000280788829 1435720697 /nfs/dbraw/zinc/72/06/97/1435720697.db2.gz UHJMDIAKVJBISL-UHFFFAOYSA-N 0 0 376.434 3.214 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](c1ccc(C)cc1)[C@H](C)S(C)(=O)=O ZINC000280820709 1435726076 /nfs/dbraw/zinc/72/60/76/1435726076.db2.gz NGPYSRIVXBRJLS-LIRRHRJNSA-N 0 0 392.477 3.176 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NC[C@@H]2CCC(F)(F)C2)ccc1[N+](=O)[O-] ZINC000280828380 1435727527 /nfs/dbraw/zinc/72/75/27/1435727527.db2.gz XKXYMNILIFAJMS-CZUORRHYSA-N 0 0 395.406 3.059 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cc(N3CCOCC3)ccc2C)c1 ZINC000280848732 1435730517 /nfs/dbraw/zinc/73/05/17/1435730517.db2.gz WIVWBQKVOIRYDC-UHFFFAOYSA-N 0 0 399.447 3.456 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCC(=O)N1Cc2ccccc2C1 ZINC000280886350 1435736123 /nfs/dbraw/zinc/73/61/23/1435736123.db2.gz GKPLNYQRQBBHGM-UHFFFAOYSA-N 0 0 397.431 3.046 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCN(c2ccccc2OC)C1 ZINC000280933974 1435744241 /nfs/dbraw/zinc/74/42/41/1435744241.db2.gz KSWKNIICCKMIJG-OAHLLOKOSA-N 0 0 399.447 3.258 20 5 GGBDRN O=c1[nH]c(N2CCC[C@@H]2c2ccc3c(c2)OCCO3)nc2ccc([N+](=O)[O-])cc21 ZINC000280940510 1435744858 /nfs/dbraw/zinc/74/48/58/1435744858.db2.gz ILPVBKBKTJBFKX-MRXNPFEDSA-N 0 0 394.387 3.356 20 5 GGBDRN O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N1CCCC[C@@H]1c1ncon1 ZINC000280937797 1435744872 /nfs/dbraw/zinc/74/48/72/1435744872.db2.gz LBJFTPLNTVBMFW-OAHLLOKOSA-N 0 0 379.376 3.407 20 5 GGBDRN C[C@@H](C(=O)OC(C)(C)C)c1noc(-c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)n1 ZINC000280947200 1435746192 /nfs/dbraw/zinc/74/61/92/1435746192.db2.gz SYOZXFVUNXCBIF-SECBINFHSA-N 0 0 386.364 3.344 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(c3nc4ccccc4[nH]3)CC2)n1 ZINC000280971399 1435749366 /nfs/dbraw/zinc/74/93/66/1435749366.db2.gz MCMIKOJPYDOSJP-UHFFFAOYSA-N 0 0 381.392 3.037 20 5 GGBDRN CSC1(CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CCOCC1 ZINC000281012968 1435756039 /nfs/dbraw/zinc/75/60/39/1435756039.db2.gz SLIHANXBBJLGPQ-UHFFFAOYSA-N 0 0 387.461 3.299 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)c2cccc([N+](=O)[O-])c2C)[C@@H](C)S(C)(=O)=O)cc1 ZINC000281040610 1435761648 /nfs/dbraw/zinc/76/16/48/1435761648.db2.gz RDOJEUSPJAODPB-KDOFPFPSSA-N 0 0 390.461 3.116 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000281043636 1435762337 /nfs/dbraw/zinc/76/23/37/1435762337.db2.gz RJFPCPVCSGPLFH-RDTXWAMCSA-N 0 0 390.461 3.116 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1ccncc1OCC(F)(F)F ZINC000281043510 1435762586 /nfs/dbraw/zinc/76/25/86/1435762586.db2.gz 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CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)c1 ZINC000282674941 1435856135 /nfs/dbraw/zinc/85/61/35/1435856135.db2.gz PMDBFXHOAWBSJX-AWEZNQCLSA-N 0 0 395.419 3.407 20 5 GGBDRN CN(C)C(=O)Nc1ccc(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282683435 1435856324 /nfs/dbraw/zinc/85/63/24/1435856324.db2.gz AEOWVNYQAWZFBO-UHFFFAOYSA-N 0 0 399.451 3.072 20 5 GGBDRN CCOc1cc(NC(=O)N2CC[C@H](OC)C[C@H]2C)c([N+](=O)[O-])cc1OCC ZINC000282690775 1435856560 /nfs/dbraw/zinc/85/65/60/1435856560.db2.gz LTEVCECPGRPWPK-OLZOCXBDSA-N 0 0 381.429 3.423 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)C(=O)C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F ZINC000282701327 1435857018 /nfs/dbraw/zinc/85/70/18/1435857018.db2.gz FTHQLJYJERSOIH-UHFFFAOYSA-N 0 0 389.383 3.038 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000282701384 1435857024 /nfs/dbraw/zinc/85/70/24/1435857024.db2.gz AWSAHPSRWJZNPA-IBGZPJMESA-N 0 0 375.400 3.120 20 5 GGBDRN COc1ccc(NC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000282709647 1435857429 /nfs/dbraw/zinc/85/74/29/1435857429.db2.gz URWQFPCIGVERIZ-HNNXBMFYSA-N 0 0 399.407 3.031 20 5 GGBDRN Cc1nc2ccccc2n1C1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1 ZINC000282716068 1435857631 /nfs/dbraw/zinc/85/76/31/1435857631.db2.gz HCWFWBHPEDILRJ-UHFFFAOYSA-N 0 0 397.410 3.452 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000282718265 1435857728 /nfs/dbraw/zinc/85/77/28/1435857728.db2.gz UBPJBRWCQDCHHB-FCLVOEFKSA-N 0 0 375.469 3.108 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1 ZINC000282719088 1435857736 /nfs/dbraw/zinc/85/77/36/1435857736.db2.gz VVVRGGKGEKTDTL-SFHVURJKSA-N 0 0 399.403 3.363 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)c1 ZINC000282736306 1435858385 /nfs/dbraw/zinc/85/83/85/1435858385.db2.gz IVCHTZVWIVRCFT-PBYMTVQHSA-N 0 0 376.453 3.395 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)c1 ZINC000282736309 1435858403 /nfs/dbraw/zinc/85/84/03/1435858403.db2.gz IVCHTZVWIVRCFT-VGDUNAEUSA-N 0 0 376.453 3.395 20 5 GGBDRN Cc1c(C(=O)NC[C@@H]2CCCC(F)(F)C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000282739209 1435858614 /nfs/dbraw/zinc/85/86/14/1435858614.db2.gz TYFWOCHEBLUGOX-GFCCVEGCSA-N 0 0 379.367 3.039 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(CO)(Cc3ccccc3)CC2)c1 ZINC000282752204 1435859114 /nfs/dbraw/zinc/85/91/14/1435859114.db2.gz KFQXGSQWGAHKHN-UHFFFAOYSA-N 0 0 398.459 3.451 20 5 GGBDRN COCC[C@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000282798238 1435860803 /nfs/dbraw/zinc/86/08/03/1435860803.db2.gz PZRUGZJXGPLPAT-KRWDZBQOSA-N 0 0 375.425 3.458 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2(c3noc(C4CC4)n3)CCCC2)c1 ZINC000282809659 1435861267 /nfs/dbraw/zinc/86/12/67/1435861267.db2.gz JDZVZPLXHMKPLI-UHFFFAOYSA-N 0 0 386.408 3.453 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCc2ccc(OC)c(OC)c2)c1 ZINC000282817655 1435861488 /nfs/dbraw/zinc/86/14/88/1435861488.db2.gz KBLVXMOPNFJJOE-UHFFFAOYSA-N 0 0 388.420 3.373 20 5 GGBDRN CCCCCC(=O)NC1CCN(C(=O)c2cc(OCC)ccc2[N+](=O)[O-])CC1 ZINC000282825843 1435861849 /nfs/dbraw/zinc/86/18/49/1435861849.db2.gz KWWDLQWNENPIAD-UHFFFAOYSA-N 0 0 391.468 3.295 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc([S@@](C)=O)cc2)c1 ZINC000282848964 1435862792 /nfs/dbraw/zinc/86/27/92/1435862792.db2.gz NNXREOQXBUPRGI-GWQKEKGPSA-N 0 0 376.434 3.222 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2cn(C)nc2C(F)(F)F)c1 ZINC000282862433 1435863521 /nfs/dbraw/zinc/86/35/21/1435863521.db2.gz PGLDJYSCLXCOBT-UHFFFAOYSA-N 0 0 386.330 3.018 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000282873476 1435864079 /nfs/dbraw/zinc/86/40/79/1435864079.db2.gz RPOUDTPRUWTJMP-OAHLLOKOSA-N 0 0 398.419 3.030 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)c1 ZINC000282889655 1435864832 /nfs/dbraw/zinc/86/48/32/1435864832.db2.gz SEIIMNOJTBDLIF-GFCCVEGCSA-N 0 0 387.392 3.219 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)[C@H]3CCCC(F)(F)C3)CC2)ccc1[N+](=O)[O-] ZINC000282900643 1435865275 /nfs/dbraw/zinc/86/52/75/1435865275.db2.gz RFFUNJVJIDJVFN-AWEZNQCLSA-N 0 0 397.422 3.468 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)[C@@H]3CCCC(F)(F)C3)CC2)ccc1[N+](=O)[O-] ZINC000282900660 1435865285 /nfs/dbraw/zinc/86/52/85/1435865285.db2.gz RFFUNJVJIDJVFN-CQSZACIVSA-N 0 0 397.422 3.468 20 5 GGBDRN CSc1cccc(NC(=O)C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1C ZINC000282938532 1435866883 /nfs/dbraw/zinc/86/68/83/1435866883.db2.gz HBOSLTKMGUZLIQ-UHFFFAOYSA-N 0 0 387.461 3.265 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](C(=O)OC)c3ccccc32)c1 ZINC000282939398 1435866894 /nfs/dbraw/zinc/86/68/94/1435866894.db2.gz YDJUNRJQSUAYEC-HNNXBMFYSA-N 0 0 384.388 3.301 20 5 GGBDRN CN(C[C@@H]1CCOC1)c1nnc(-c2cccc([N+](=O)[O-])c2)n1Cc1cccs1 ZINC000282942942 1435867043 /nfs/dbraw/zinc/86/70/43/1435867043.db2.gz IZWHFLJVUZISNR-AWEZNQCLSA-N 0 0 399.476 3.436 20 5 GGBDRN Cc1nn(CCC(=O)NCc2ccc3c(c2)nc(C)n3C2CC2)c(C)c1[N+](=O)[O-] ZINC000282960121 1435867810 /nfs/dbraw/zinc/86/78/10/1435867810.db2.gz RHVFOYBSTPSFRB-UHFFFAOYSA-N 0 0 396.451 3.108 20 5 GGBDRN Cc1cc(C)cc([C@H](O)CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000283017808 1435870603 /nfs/dbraw/zinc/87/06/03/1435870603.db2.gz GSBSKGJOMGELLM-OAQYLSRUSA-N 0 0 397.475 3.278 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3ccccc3n2CCOC)c1 ZINC000283048228 1435871981 /nfs/dbraw/zinc/87/19/81/1435871981.db2.gz HGWXJULZFKYVOG-UHFFFAOYSA-N 0 0 384.392 3.242 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C1(c2cccc(F)c2)CCOCC1 ZINC000283058787 1435872543 /nfs/dbraw/zinc/87/25/43/1435872543.db2.gz CHNDWWSMBAYYGT-UHFFFAOYSA-N 0 0 386.423 3.483 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 ZINC000283074967 1435873249 /nfs/dbraw/zinc/87/32/49/1435873249.db2.gz DFKDJOVFCORAQA-LJQANCHMSA-N 0 0 395.459 3.148 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)[C@H]1CCCCN1C(=O)c1ccco1 ZINC000283085108 1435873698 /nfs/dbraw/zinc/87/36/98/1435873698.db2.gz QEBHQLGQIYSPEJ-CYBMUJFWSA-N 0 0 377.784 3.475 20 5 GGBDRN Cc1cc(O)c(C(C)C)cc1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000283123732 1435875636 /nfs/dbraw/zinc/87/56/36/1435875636.db2.gz HRVVGJMPCGZLLY-UHFFFAOYSA-N 0 0 392.433 3.388 20 5 GGBDRN COc1ccc(CNc2ccc(C(N)=O)c(N3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000283126749 1435875735 /nfs/dbraw/zinc/87/57/35/1435875735.db2.gz VTALDRWOXCERFU-UHFFFAOYSA-N 0 0 384.436 3.305 20 5 GGBDRN CCCN(CC1CCCCC1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000283135567 1435876227 /nfs/dbraw/zinc/87/62/27/1435876227.db2.gz IWXAPTSRVPFDBI-UHFFFAOYSA-N 0 0 382.482 3.431 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000283171364 1435877768 /nfs/dbraw/zinc/87/77/68/1435877768.db2.gz DGPANXFJDIMRBY-CVEARBPZSA-N 0 0 388.374 3.267 20 5 GGBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@@H](COCc2ccccc2)C1 ZINC000283170940 1435877843 /nfs/dbraw/zinc/87/78/43/1435877843.db2.gz NGPDMWNMNOHXSO-QGZVFWFLSA-N 0 0 393.447 3.433 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](Cc2nc(C)no2)c2ccccc2)c1 ZINC000283246340 1435881037 /nfs/dbraw/zinc/88/10/37/1435881037.db2.gz QPDPVMFRFMDOOI-KRWDZBQOSA-N 0 0 396.403 3.399 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(N3C[C@@H]4CCC[C@H]4C3)n2C[C@@H]2CCCO2)cc1 ZINC000283247997 1435881189 /nfs/dbraw/zinc/88/11/89/1435881189.db2.gz DOITYKMJMIJPSA-BQFCYCMXSA-N 0 0 383.452 3.269 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)OC)cc2N(C)C)c1 ZINC000283256776 1435881661 /nfs/dbraw/zinc/88/16/61/1435881661.db2.gz ROPHMJSELPZVTR-UHFFFAOYSA-N 0 0 387.392 3.098 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)CN(C(C)C)CC3)c1 ZINC000283303494 1435883598 /nfs/dbraw/zinc/88/35/98/1435883598.db2.gz VZBKTRGQBGJALY-UHFFFAOYSA-N 0 0 390.465 3.469 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(-c2ccccn2)n1C[C@@H]1CCCO1 ZINC000283369776 1435886526 /nfs/dbraw/zinc/88/65/26/1435886526.db2.gz KMLDPECBOGSIHI-INIZCTEOSA-N 0 0 394.435 3.064 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000283379680 1435886937 /nfs/dbraw/zinc/88/69/37/1435886937.db2.gz KBCHJMOMSKIBJK-LZQZEXGQSA-N 0 0 379.416 3.344 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000283379672 1435887021 /nfs/dbraw/zinc/88/70/21/1435887021.db2.gz KBCHJMOMSKIBJK-KFKAGJAMSA-N 0 0 379.416 3.344 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C(=O)C(CC)CC)CC2)c1 ZINC000283390123 1435887424 /nfs/dbraw/zinc/88/74/24/1435887424.db2.gz GKEXXTGEKXMXQN-UHFFFAOYSA-N 0 0 391.468 3.151 20 5 GGBDRN Cc1ccc2c(c1)nc(CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)n2C ZINC000283430644 1435889422 /nfs/dbraw/zinc/88/94/22/1435889422.db2.gz SIKALVKOAOXCOH-UHFFFAOYSA-N 0 0 381.436 3.174 20 5 GGBDRN Cc1ccc([C@@H](C)NCc2noc(CNC(=O)OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000283463616 1435891151 /nfs/dbraw/zinc/89/11/51/1435891151.db2.gz YYEDUMKXHATNGO-GFCCVEGCSA-N 0 0 391.428 3.162 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)c2cc(OCC)ccc2[N+](=O)[O-])CC1 ZINC000283480863 1435891777 /nfs/dbraw/zinc/89/17/77/1435891777.db2.gz NGSCSQWVSQYPJC-UHFFFAOYSA-N 0 0 391.468 3.104 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])c(F)cc3N)cc2)C[C@H](C)O1 ZINC000283499878 1435892708 /nfs/dbraw/zinc/89/27/08/1435892708.db2.gz OTTUGSDANGUENP-RYUDHWBXSA-N 0 0 388.399 3.182 20 5 GGBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000283521031 1435893751 /nfs/dbraw/zinc/89/37/51/1435893751.db2.gz KIXIINPUFZVHKR-OAHLLOKOSA-N 0 0 383.452 3.499 20 5 GGBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)Cc1ccc([S@@](C)=O)cc1 ZINC000283546454 1435894793 /nfs/dbraw/zinc/89/47/93/1435894793.db2.gz STVLRTDZJSQAGU-MUUNZHRXSA-N 0 0 399.476 3.247 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283559871 1435895404 /nfs/dbraw/zinc/89/54/04/1435895404.db2.gz USEVKQHEZGWYBJ-UHFFFAOYSA-N 0 0 386.383 3.113 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2cccc(OC)c2)[NH+](C)C)c1 ZINC000283585511 1435896683 /nfs/dbraw/zinc/89/66/83/1435896683.db2.gz WWXGBWFUXKBXEN-LJQANCHMSA-N 0 0 387.436 3.035 20 5 GGBDRN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000283588379 1435896773 /nfs/dbraw/zinc/89/67/73/1435896773.db2.gz LRAXRPXZCAZYEB-HKUYNNGSSA-N 0 0 384.432 3.417 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000283597815 1435897243 /nfs/dbraw/zinc/89/72/43/1435897243.db2.gz YAASCJQTFDLXKR-ZDUSSCGKSA-N 0 0 375.356 3.126 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000283600408 1435897327 /nfs/dbraw/zinc/89/73/27/1435897327.db2.gz MPZCYTQFVHKSPG-UHFFFAOYSA-N 0 0 390.465 3.443 20 5 GGBDRN Cc1cc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)n(-c2cc(C)ccn2)n1 ZINC000283601748 1435897453 /nfs/dbraw/zinc/89/74/53/1435897453.db2.gz MSSHXOGQGWUVCU-UHFFFAOYSA-N 0 0 394.435 3.499 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCc1nc(-c2cccs2)no1 ZINC000283615160 1435897918 /nfs/dbraw/zinc/89/79/18/1435897918.db2.gz NTEGFQPAFOEWDT-UHFFFAOYSA-N 0 0 386.433 3.340 20 5 GGBDRN CC(=O)c1cc(N2CCC[C@@H](c3nnc4n3CCCCC4)C2)ccc1[N+](=O)[O-] ZINC000283619149 1435898190 /nfs/dbraw/zinc/89/81/90/1435898190.db2.gz SLTHSAZFZLSEEV-OAHLLOKOSA-N 0 0 383.452 3.499 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(OC2CCOCC2)cc1 ZINC000283623960 1435898318 /nfs/dbraw/zinc/89/83/18/1435898318.db2.gz OKWQXKIQUHRTGM-UHFFFAOYSA-N 0 0 384.432 3.467 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CC[C@H]1Cc2ccccc2NC1=O ZINC000283635836 1435898876 /nfs/dbraw/zinc/89/88/76/1435898876.db2.gz PHJPMOWALKGLKE-KRWDZBQOSA-N 0 0 381.432 3.187 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCCc1nc2ccccc2c(=O)[nH]1 ZINC000283665213 1435900408 /nfs/dbraw/zinc/90/04/08/1435900408.db2.gz RCITWBXBGXSRRZ-UHFFFAOYSA-N 0 0 394.431 3.267 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000283682852 1435903031 /nfs/dbraw/zinc/90/30/31/1435903031.db2.gz UMTYMAGHBMCAPI-SJORKVTESA-N 0 0 393.447 3.363 20 5 GGBDRN O=C(N[C@@H]1CCC(=O)NC12CCC2)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000283711297 1435909226 /nfs/dbraw/zinc/90/92/26/1435909226.db2.gz UEKVGRAZIWMROA-QGZVFWFLSA-N 0 0 375.428 3.025 20 5 GGBDRN Cc1cc(C)n(-c2ccc(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)cn2)n1 ZINC000283716060 1435910256 /nfs/dbraw/zinc/91/02/56/1435910256.db2.gz XKQMUXUFVPYYAP-UHFFFAOYSA-N 0 0 379.420 3.107 20 5 GGBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(NC(=O)NC2CCCCC2)CC1 ZINC000283779428 1435922047 /nfs/dbraw/zinc/92/20/47/1435922047.db2.gz QAHAHHHVDQPTHZ-UHFFFAOYSA-N 0 0 388.468 3.398 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)NCc2ccccc2CN2CCCC2=O)c1F ZINC000283801794 1435926475 /nfs/dbraw/zinc/92/64/75/1435926475.db2.gz AQUDJEAYQLQGKN-UHFFFAOYSA-N 0 0 385.395 3.095 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000283803651 1435926565 /nfs/dbraw/zinc/92/65/65/1435926565.db2.gz WCDPTAGBHQJTDF-CVEARBPZSA-N 0 0 392.419 3.199 20 5 GGBDRN 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C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-c2nn[nH]n2)ccc1F ZINC001528505719 948542695 /nfs/dbraw/zinc/54/26/95/948542695.db2.gz GRVHXAIFTLZSQJ-VIFPVBQESA-N 0 0 388.384 3.033 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-c2nn[nH]n2)ccc1F ZINC001528505712 948543160 /nfs/dbraw/zinc/54/31/60/948543160.db2.gz GRVHXAIFTLZSQJ-SECBINFHSA-N 0 0 388.384 3.033 20 5 GGBDRN C[C@H](c1ccccc1)n1ccc(Nc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])n1 ZINC001575516289 949205008 /nfs/dbraw/zinc/20/50/08/949205008.db2.gz OHURRIRULQJHKR-GFCCVEGCSA-N 0 0 376.380 3.324 20 5 GGBDRN CC(C)(C)O[C@@H]1C[C@@H](Nc2cc(F)c(-c3nn[nH]n3)cc2[N+](=O)[O-])C12CCC2 ZINC001573863368 950477506 /nfs/dbraw/zinc/47/75/06/950477506.db2.gz FJHAISKXIZTJKU-HUUCEWRRSA-N 0 0 390.419 3.452 20 5 GGBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@](C)(C(=O)[O-])C2)cc1OC ZINC000568074574 953641932 /nfs/dbraw/zinc/64/19/32/953641932.db2.gz MQRHOYOSBFBUAL-BFUOFWGJSA-N 0 0 380.441 3.325 20 5 GGBDRN 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COc1ccc(OCC[N@@H+]2[C@H](C(=O)[O-])CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000518797725 974325041 /nfs/dbraw/zinc/32/50/41/974325041.db2.gz KFQAWNYNAHOAAC-IRXDYDNUSA-N 0 0 386.404 3.273 20 5 GGBDRN C[C@H]1C[C@@H](CCNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000520588585 974339240 /nfs/dbraw/zinc/33/92/40/974339240.db2.gz SQZAANPDAARFGE-GOEBONIOSA-N 0 0 384.436 3.401 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000566292234 974603156 /nfs/dbraw/zinc/60/31/56/974603156.db2.gz ZTMBKUHELKXCBN-ZBFHGGJFSA-N 0 0 384.436 3.319 20 5 GGBDRN O=C([O-])c1cnc(NCC2CC[NH+](Cc3cccs3)CC2)c([N+](=O)[O-])c1 ZINC000566293955 974604052 /nfs/dbraw/zinc/60/40/52/974604052.db2.gz LVBOHKMKTJIIGW-UHFFFAOYSA-N 0 0 376.438 3.074 20 5 GGBDRN CC[NH+](CC)CCCC1CCN(c2nc(C)cc(C(=O)[O-])c2[N+](=O)[O-])CC1 ZINC000567238280 974629312 /nfs/dbraw/zinc/62/93/12/974629312.db2.gz FHBPDWLNERJIJM-UHFFFAOYSA-N 0 0 378.473 3.335 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccccc2C[NH+]2CCCCCC2)n1 ZINC000570970187 974721069 /nfs/dbraw/zinc/72/10/69/974721069.db2.gz KFDMUHNIKILTDD-UHFFFAOYSA-N 0 0 398.463 3.406 20 5 GGBDRN C[C@@H](C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1)C(=O)[O-] ZINC000572532964 974750099 /nfs/dbraw/zinc/75/00/99/974750099.db2.gz LOMRVICZDCPCEU-AWEZNQCLSA-N 0 0 396.403 3.368 20 5 GGBDRN CC(C)Oc1ccc([C@H](CNc2nccc(C(=O)[O-])c2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000573003914 974757495 /nfs/dbraw/zinc/75/74/95/974757495.db2.gz GAPYEESESHPEAN-INIZCTEOSA-N 0 0 388.424 3.190 20 5 GGBDRN CC(C)Oc1ccc([C@@H](CNc2nccc(C(=O)[O-])c2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000573003915 974758439 /nfs/dbraw/zinc/75/84/39/974758439.db2.gz GAPYEESESHPEAN-MRXNPFEDSA-N 0 0 388.424 3.190 20 5 GGBDRN O=C([O-])C1CC[NH+](CCCNc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000575048928 974793928 /nfs/dbraw/zinc/79/39/28/974793928.db2.gz IAWKVFWANFVGLW-UHFFFAOYSA-N 0 0 375.347 3.212 20 5 GGBDRN O=C([O-])c1cnc(N2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)c([N+](=O)[O-])c1 ZINC000580716367 974898753 /nfs/dbraw/zinc/89/87/53/974898753.db2.gz DRRCLGGQGOUMAE-NRFANRHFSA-N 0 0 396.447 3.181 20 5 GGBDRN O=C([O-])c1cnc(N2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)c([N+](=O)[O-])c1 ZINC000580716370 974898787 /nfs/dbraw/zinc/89/87/87/974898787.db2.gz DRRCLGGQGOUMAE-OAQYLSRUSA-N 0 0 396.447 3.181 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccc(C[NH+]3CCCCCC3)cc2)n1 ZINC000580836362 974900829 /nfs/dbraw/zinc/90/08/29/974900829.db2.gz ABBXSYAFKAYHSK-UHFFFAOYSA-N 0 0 398.463 3.406 20 5 GGBDRN Cc1cc(NCc2ccc(C[NH+]3CCC(O)CC3)cc2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000581193858 974906457 /nfs/dbraw/zinc/90/64/57/974906457.db2.gz RNHAYAPEVRINRP-UHFFFAOYSA-N 0 0 399.447 3.170 20 5 GGBDRN C[N@@H+](Cc1ccccc1)CC1CCN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])CC1 ZINC000581827281 974915955 /nfs/dbraw/zinc/91/59/55/974915955.db2.gz LDVDDOXGQUSGRX-UHFFFAOYSA-N 0 0 384.436 3.036 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)n1 ZINC000582362301 974925118 /nfs/dbraw/zinc/92/51/18/974925118.db2.gz DDGSAOJHRUPAOW-NRFANRHFSA-N 0 0 396.447 3.099 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2cccc(C[NH+]3CCCCCC3)c2)n1 ZINC000583384361 974940497 /nfs/dbraw/zinc/94/04/97/974940497.db2.gz PYIHVNAPAUOBSV-UHFFFAOYSA-N 0 0 398.463 3.406 20 5 GGBDRN O=C([O-])CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCO1 ZINC000584356501 974954286 /nfs/dbraw/zinc/95/42/86/974954286.db2.gz PPPVZSWMCNRXRW-ZDUSSCGKSA-N 0 0 376.331 3.069 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCC2([NH+]3CCCCC3)CCCCC2)n1 ZINC000592966611 974976785 /nfs/dbraw/zinc/97/67/85/974976785.db2.gz AYKKEXTUIIFQPC-UHFFFAOYSA-N 0 0 376.457 3.019 20 5 GGBDRN CCC[C@@H]1CN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000592977227 974978525 /nfs/dbraw/zinc/97/85/25/974978525.db2.gz UPXCIWAJGXHSRD-QGZVFWFLSA-N 0 0 384.436 3.179 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c1 ZINC000593741918 974986190 /nfs/dbraw/zinc/98/61/90/974986190.db2.gz SUQMHZLMUAGKQR-GGPKGHCWSA-N 0 0 382.416 3.298 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCOc2ccccc2[C@H]1C(=O)[O-] ZINC001591791276 975982312 /nfs/dbraw/zinc/98/23/12/975982312.db2.gz PLQPXXYNSHECAX-IBGZPJMESA-N 0 0 386.404 3.402 20 5 GGBDRN C[C@](CC(=O)[O-])([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1cccnc1 ZINC001592327818 977742621 /nfs/dbraw/zinc/74/26/21/977742621.db2.gz FIPJCHSZWZOQTO-MRXNPFEDSA-N 0 0 383.326 3.488 20 5 GGBDRN C[C@@H](CCNc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-])[NH+](C)C ZINC001592519075 978360437 /nfs/dbraw/zinc/36/04/37/978360437.db2.gz APIFEFOIBZMXMK-ZDUSSCGKSA-N 0 0 385.420 3.276 20 5 GGBDRN C[C@@H](C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccccc1)C(=O)[O-] ZINC001592604501 978543141 /nfs/dbraw/zinc/54/31/41/978543141.db2.gz DPQACMNJNVSYBO-AWEZNQCLSA-N 0 0 396.403 3.368 20 5 GGBDRN COc1ccc([C@H](CNc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000844206946 979354566 /nfs/dbraw/zinc/35/45/66/979354566.db2.gz QFAAKVOXTMRVQQ-FQEVSTJZSA-N 0 0 399.447 3.480 20 5 GGBDRN COc1ccc([C@@H](CNc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000844206947 979354925 /nfs/dbraw/zinc/35/49/25/979354925.db2.gz QFAAKVOXTMRVQQ-HXUWFJFHSA-N 0 0 399.447 3.480 20 5 GGBDRN O=C([O-])c1ccccc1CC1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000851707272 979573792 /nfs/dbraw/zinc/57/37/92/979573792.db2.gz ZDFKWYVFQPHQAN-HXUWFJFHSA-N 0 0 384.432 3.281 20 5 GGBDRN CC[C@@]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)(C(=O)[O-])c1ccc(Cl)cc1 ZINC001595293856 980404435 /nfs/dbraw/zinc/40/44/35/980404435.db2.gz YVQATVIMCNAGIM-WMZOPIPTSA-N 0 0 378.812 3.261 20 5 GGBDRN O=C([O-])[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cc(F)ccc1F ZINC000901637660 980418393 /nfs/dbraw/zinc/41/83/93/980418393.db2.gz UVBZTTFCDZNAFF-GOSISDBHSA-N 0 0 391.374 3.257 20 5 GGBDRN CC[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1cc(F)ccc1OC ZINC001595300420 980434153 /nfs/dbraw/zinc/43/41/53/980434153.db2.gz PXQQQQQULQUEOE-OAHLLOKOSA-N 0 0 392.383 3.447 20 5 GGBDRN CO[C@@H]1CC[N@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[C@H](C(=O)[O-])C1 ZINC000902031714 980703175 /nfs/dbraw/zinc/70/31/75/980703175.db2.gz LFBQMHRQBZTIOE-XLIONFOSSA-N 0 0 399.447 3.427 20 5 GGBDRN CCC1([NH+]2CCCCC2)CCN(c2nc(C)cc(C(=O)[O-])c2[N+](=O)[O-])CC1 ZINC001595387170 980939039 /nfs/dbraw/zinc/93/90/39/980939039.db2.gz HPSOMZZJBCHPIL-UHFFFAOYSA-N 0 0 376.457 3.231 20 5 GGBDRN CC[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001595482339 981206822 /nfs/dbraw/zinc/20/68/22/981206822.db2.gz HITIETYPVTXSDV-KRWDZBQOSA-N 0 0 399.447 3.289 20 5 GGBDRN CC[C@@H]1Oc2cc([C@@H](C)[NH2+]Cc3cc(C(=O)[O-])ccc3[N+](=O)[O-])ccc2NC1=O ZINC001595499642 981265785 /nfs/dbraw/zinc/26/57/85/981265785.db2.gz NQTCWYKHTHPFIY-DIFFPNOSSA-N 0 0 399.403 3.253 20 5 GGBDRN C[NH+]1CCC(CNc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])(c2ccccc2)CC1 ZINC000910356003 981887728 /nfs/dbraw/zinc/88/77/28/981887728.db2.gz CSUSRDFOOWKBAS-UHFFFAOYSA-N 0 0 383.448 3.297 20 5 GGBDRN O=C([O-])/C=C/c1ccc(NCC2([NH+]3CCSCC3)CCCC2)c([N+](=O)[O-])c1 ZINC000915213373 982665242 /nfs/dbraw/zinc/66/52/42/982665242.db2.gz WPNGUVNFHSQPBS-GQCTYLIASA-N 0 0 391.493 3.466 20 5 GGBDRN CCCN(CC[NH+](CC)CC)C(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C ZINC001595879675 982882089 /nfs/dbraw/zinc/88/20/89/982882089.db2.gz OUFHEKAXWYLLQK-UHFFFAOYSA-N 0 0 380.445 3.187 20 5 GGBDRN C[C@H]1C[NH+](CCCCNc2c(Cl)cc([N+](=O)[O-])cc2C(=O)[O-])C[C@H](C)O1 ZINC001594527611 986083295 /nfs/dbraw/zinc/08/32/95/986083295.db2.gz HBGXCABUBINEAF-RYUDHWBXSA-N 0 0 385.848 3.248 20 5 GGBDRN C[C@H]1CN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC001594543845 986195288 /nfs/dbraw/zinc/19/52/88/986195288.db2.gz BSTBAKOLFKDDBB-MRXNPFEDSA-N 0 0 383.448 3.247 20 5 GGBDRN CCOc1cc(N2CC[NH+](Cc3ccc(C(=O)[O-])c(C)c3)CC2)ccc1[N+](=O)[O-] ZINC001597042097 986490630 /nfs/dbraw/zinc/49/06/30/986490630.db2.gz JQZMSNFJDYXQBN-UHFFFAOYSA-N 0 0 399.447 3.322 20 5 GGBDRN CCc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001597603504 988467753 /nfs/dbraw/zinc/46/77/53/988467753.db2.gz GJSGFFWOFWLQDL-MRXNPFEDSA-N 0 0 386.404 3.234 20 5 GGBDRN CSc1ccc(OCC[NH2+][C@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1 ZINC001599819924 988495097 /nfs/dbraw/zinc/49/50/97/988495097.db2.gz GDFRVWWCNMWFEW-SFHVURJKSA-N 0 0 376.434 3.285 20 5 GGBDRN C[NH+](C)C1(CNc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CCC1 ZINC001598184586 990757116 /nfs/dbraw/zinc/75/71/16/990757116.db2.gz YQYXZGHUOOALDZ-UHFFFAOYSA-N 0 0 397.431 3.420 20 5 GGBDRN CN(CC[N@H+](C)C1CC1)c1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-] ZINC001598485831 992203808 /nfs/dbraw/zinc/20/38/08/992203808.db2.gz ZUIQYDORCPREMS-UHFFFAOYSA-N 0 0 397.431 3.054 20 5 GGBDRN C[N@H+](CCc1ccccc1)[C@H]1CCN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001598502439 992452029 /nfs/dbraw/zinc/45/20/29/992452029.db2.gz VDMIRBAIBNSVJM-IBGZPJMESA-N 0 0 383.448 3.042 20 5 GGBDRN Cn1cc(C[N@H+](C)Cc2ccc(C(=O)[O-])cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001598513946 992597769 /nfs/dbraw/zinc/59/77/69/992597769.db2.gz LBHFNKARFFAAPB-UHFFFAOYSA-N 0 0 380.404 3.326 20 5 GGBDRN COc1cccc([C@@](C)(CC(=O)[O-])[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC001599655877 994578538 /nfs/dbraw/zinc/57/85/38/994578538.db2.gz PTXIZNHRTQRBGM-LJQANCHMSA-N 0 0 392.383 3.231 20 5 GGBDRN COc1cccc([C@H](CNc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])[NH+]2CCCC2)c1 ZINC001599657179 994600905 /nfs/dbraw/zinc/60/09/05/994600905.db2.gz IORYRKVGCCBCCJ-FQEVSTJZSA-N 0 0 399.447 3.480 20 5 GGBDRN C[C@]([NH2+]CCOc1ccc(F)cc1Cl)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593271709 994607054 /nfs/dbraw/zinc/60/70/54/994607054.db2.gz LRSAJYIXRYRKJG-QGZVFWFLSA-N 0 0 382.775 3.356 20 5 GGBDRN C[C@H]([NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-])c1ccc(N2CCCNC2=O)cc1 ZINC001593289359 994662650 /nfs/dbraw/zinc/66/26/50/994662650.db2.gz QZNVANLCRGTBAJ-ZDUSSCGKSA-N 0 0 398.419 3.064 20 5 GGBDRN C[C@]([NH2+]Cc1cccc(F)c1OC(F)F)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593303409 994734500 /nfs/dbraw/zinc/73/45/00/994734500.db2.gz CMPIFIFJMABXRC-QGZVFWFLSA-N 0 0 384.310 3.425 20 5 GGBDRN C[C@]([NH2+]Cc1cnc(-c2ccccc2)nc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593310292 994770875 /nfs/dbraw/zinc/77/08/75/994770875.db2.gz HDWYXQPZAKOAMR-HXUWFJFHSA-N 0 0 378.388 3.141 20 5 GGBDRN C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](Cc1ccccc1)C(=O)[O-] ZINC001593317313 994818120 /nfs/dbraw/zinc/81/81/20/994818120.db2.gz OZAIIRCIFBHGQQ-GUYCJALGSA-N 0 0 396.403 3.066 20 5 GGBDRN CC1(C)CCC[C@@]([NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)(C(=O)[O-])C1 ZINC001593896071 996750857 /nfs/dbraw/zinc/75/08/57/996750857.db2.gz PBJHHQGIKZLJMX-SFHVURJKSA-N 0 0 381.404 3.076 20 5 GGBDRN COc1ccc([C@H](C)[NH2+]Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)cc1F ZINC001599509813 997277159 /nfs/dbraw/zinc/27/71/59/997277159.db2.gz PTTOXAPTODBOHY-NSHDSACASA-N 0 0 378.356 3.057 20 5 GGBDRN CO[C@@H]1CCC[C@H]([C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C(=O)[O-])C1 ZINC001599108718 997527623 /nfs/dbraw/zinc/52/76/23/997527623.db2.gz LRPDPGMMRUWWDG-XCRHUMRWSA-N 0 0 380.441 3.130 20 5 GGBDRN COc1ccc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C(=O)[O-])c(OC)c1 ZINC001599533212 997696313 /nfs/dbraw/zinc/69/63/13/997696313.db2.gz WSVXAEXERYRCAB-MRXNPFEDSA-N 0 0 380.784 3.181 20 5 GGBDRN CC(C)(C)OC(=O)NC1(C)CC[NH+](Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1 ZINC001594058169 997819550 /nfs/dbraw/zinc/81/95/50/997819550.db2.gz ZQUBVDJUPHCWGF-UHFFFAOYSA-N 0 0 393.440 3.172 20 5 GGBDRN C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@@H+]1Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594297403 999147207 /nfs/dbraw/zinc/14/72/07/999147207.db2.gz WXJACUKWTNBMJM-OCCSQVGLSA-N 0 0 378.425 3.235 20 5 GGBDRN CO[C@H](C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccccc1Cl ZINC001599054060 999216482 /nfs/dbraw/zinc/21/64/82/999216482.db2.gz KAIJTRFSAKOWAD-QGZVFWFLSA-N 0 0 394.811 3.189 20 5 GGBDRN CO[C@H](C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC001599054545 999220325 /nfs/dbraw/zinc/22/03/25/999220325.db2.gz TYJFGFHAWILDOY-QGZVFWFLSA-N 0 0 394.811 3.189 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1CCCCNc1c(C(=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001594374868 999412504 /nfs/dbraw/zinc/41/25/04/999412504.db2.gz FVLIHIYMMPSJNJ-GFCCVEGCSA-N 0 0 380.401 3.268 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(OCC(F)F)cc1 ZINC000277412977 1126078818 /nfs/dbraw/zinc/07/88/18/1126078818.db2.gz SMISDQYWIMUMQZ-INIZCTEOSA-N 0 0 380.347 3.024 20 5 GGBDRN CC(C)c1ncc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])s1 ZINC000417563361 1126080516 /nfs/dbraw/zinc/08/05/16/1126080516.db2.gz NMCPQNYYPLUMNR-INIZCTEOSA-N 0 0 388.449 3.442 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426648626 1126081160 /nfs/dbraw/zinc/08/11/60/1126081160.db2.gz UAHHHBYESFQDMK-QGZVFWFLSA-N 0 0 382.372 3.346 20 5 GGBDRN COc1ccc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cc1F ZINC000426726371 1126083359 /nfs/dbraw/zinc/08/33/59/1126083359.db2.gz JCGNYXJICQBWJW-KRWDZBQOSA-N 0 0 387.367 3.009 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc2cc[nH]c21 ZINC000426740913 1126085698 /nfs/dbraw/zinc/08/56/98/1126085698.db2.gz JDRVZQHSGGNKRD-SFHVURJKSA-N 0 0 378.388 3.343 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000426744451 1126086051 /nfs/dbraw/zinc/08/60/51/1126086051.db2.gz QZQCQALHYCTKFK-MRXNPFEDSA-N 0 0 393.321 3.279 20 5 GGBDRN COc1cc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])ccc1SC ZINC000426797927 1126091018 /nfs/dbraw/zinc/09/10/18/1126091018.db2.gz CNQWNOFDYJCSTM-HNNXBMFYSA-N 0 0 376.434 3.111 20 5 GGBDRN COc1cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])ccc1OC(C)C ZINC000426809420 1126091723 /nfs/dbraw/zinc/09/17/23/1126091723.db2.gz VDFSHJZXMKBOFF-INIZCTEOSA-N 0 0 388.420 3.176 20 5 GGBDRN COc1cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])ccc1SC ZINC000426816207 1126092435 /nfs/dbraw/zinc/09/24/35/1126092435.db2.gz JGFWQEZCWBCLPH-AWEZNQCLSA-N 0 0 376.434 3.111 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)[O-] ZINC000756378916 1126107854 /nfs/dbraw/zinc/10/78/54/1126107854.db2.gz IHYQGCLDIYMXCC-GOSISDBHSA-N 0 0 398.375 3.078 20 5 GGBDRN Cc1cc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cnc1Cl ZINC000756378940 1126107871 /nfs/dbraw/zinc/10/78/71/1126107871.db2.gz INWSXZWNFDTUTI-MRXNPFEDSA-N 0 0 388.811 3.218 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccc(OC(F)(F)F)cc1)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC001608542070 1126237107 /nfs/dbraw/zinc/23/71/07/1126237107.db2.gz OYECOVISXZKCJB-CQSZACIVSA-N 0 0 384.310 3.279 20 5 GGBDRN CNC(=O)c1ccccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000019208251 210229709 /nfs/dbraw/zinc/22/97/09/210229709.db2.gz DZZQYEDCSZYFHR-UHFFFAOYSA-N 0 0 396.447 3.443 20 5 GGBDRN CCc1ccc(N2C[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3OC)CC2=O)cc1 ZINC000019159765 210229167 /nfs/dbraw/zinc/22/91/67/210229167.db2.gz LQWUXDCGSPBDCP-CQSZACIVSA-N 0 0 383.404 3.157 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000018769572 210220462 /nfs/dbraw/zinc/22/04/62/210220462.db2.gz VPIPHTOVNPRBKI-UHFFFAOYSA-N 0 0 385.420 3.159 20 5 GGBDRN CC(=O)N1CCc2cc(C(=O)[C@H](C)OC(=O)c3cccc([N+](=O)[O-])c3C)ccc21 ZINC000016750547 210196331 /nfs/dbraw/zinc/19/63/31/210196331.db2.gz XINDLSQSTDTKJB-ZDUSSCGKSA-N 0 0 396.399 3.240 20 5 GGBDRN CCCn1c2ccccc2n(CCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1=O ZINC000016199942 210187238 /nfs/dbraw/zinc/18/72/38/210187238.db2.gz AFFIMLYAEWYFET-UHFFFAOYSA-N 0 0 382.420 3.458 20 5 GGBDRN Cc1nnc(SCc2ccc(C(N)=O)cc2[N+](=O)[O-])n1-c1ccccc1C ZINC000016119905 210185078 /nfs/dbraw/zinc/18/50/78/210185078.db2.gz YRJFMWAFAIUMDZ-UHFFFAOYSA-N 0 0 383.433 3.184 20 5 GGBDRN COc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000016014449 210181813 /nfs/dbraw/zinc/18/18/13/210181813.db2.gz USPXVZHKUBCYFR-UHFFFAOYSA-N 0 0 383.404 3.482 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000015992088 210181844 /nfs/dbraw/zinc/18/18/44/210181844.db2.gz GZULNIIMLYPZPJ-UHFFFAOYSA-N 0 0 379.825 3.386 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000015977209 210180808 /nfs/dbraw/zinc/18/08/08/210180808.db2.gz UHOONMFMOJBXTN-UHFFFAOYSA-N 0 0 376.796 3.464 20 5 GGBDRN Cc1nnc(SC[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1-c1ccccc1 ZINC000015235678 210153599 /nfs/dbraw/zinc/15/35/99/210153599.db2.gz OKQSERKAMIPKBM-INIZCTEOSA-N 0 0 386.433 3.016 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc(N2CCCC2=O)c1 ZINC000014705412 210122576 /nfs/dbraw/zinc/12/25/76/210122576.db2.gz DXDFFXJCGLXVBR-UHFFFAOYSA-N 0 0 389.795 3.393 20 5 GGBDRN Cc1nn(CC(=O)Nc2nc(-c3ccc(F)cc3)cs2)c(C)c1[N+](=O)[O-] ZINC000014376948 210115660 /nfs/dbraw/zinc/11/56/60/210115660.db2.gz DGLHEXRKARQISO-UHFFFAOYSA-N 0 0 375.385 3.309 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1[N+](=O)[O-] ZINC000014425061 210117310 /nfs/dbraw/zinc/11/73/10/210117310.db2.gz KMYABWMXGFKCJV-UHFFFAOYSA-N 0 0 391.449 3.184 20 5 GGBDRN Cc1noc(C)c1C(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000014377810 210115310 /nfs/dbraw/zinc/11/53/10/210115310.db2.gz IQXZKSLYJHVBQP-CQSZACIVSA-N 0 0 375.381 3.012 20 5 GGBDRN O=C(N[C@@H]1CCSc2c(F)cccc21)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000014244958 210111757 /nfs/dbraw/zinc/11/17/57/210111757.db2.gz RXVZMZIZWWXEPL-CQSZACIVSA-N 0 0 399.407 3.282 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCc1c(C)nc2c(c(C)nn2C)c1C ZINC000014201876 210110926 /nfs/dbraw/zinc/11/09/26/210110926.db2.gz QVKKEQIFTXZDTB-UHFFFAOYSA-N 0 0 397.435 3.382 20 5 GGBDRN CC[C@H](C)NC(=O)c1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000014049073 210102446 /nfs/dbraw/zinc/10/24/46/210102446.db2.gz HSQINTGIMREQMB-ZDUSSCGKSA-N 0 0 391.449 3.232 20 5 GGBDRN COc1ccc(C(=O)N(Cc2cccs2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000013985993 210097876 /nfs/dbraw/zinc/09/78/76/210097876.db2.gz WRBZYLHZICCFLI-CQSZACIVSA-N 0 0 376.434 3.486 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)Nc3ccc4c(c3)OCO4)cc2)c(C)c1[N+](=O)[O-] ZINC000013985265 210097731 /nfs/dbraw/zinc/09/77/31/210097731.db2.gz GBAPHZCBXLLZTK-UHFFFAOYSA-N 0 0 394.387 3.437 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cnc3c(cnn3C(C)C)c2)cc([N+](=O)[O-])c1 ZINC000013001855 210043857 /nfs/dbraw/zinc/04/38/57/210043857.db2.gz FYKFQTBBETUYNF-UHFFFAOYSA-N 0 0 397.391 3.349 20 5 GGBDRN O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000013001621 210044172 /nfs/dbraw/zinc/04/41/72/210044172.db2.gz XESPUNKISVWDEY-UHFFFAOYSA-N 0 0 384.417 3.293 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccccc1OC(F)(F)F)CC2 ZINC000012985205 210040842 /nfs/dbraw/zinc/04/08/42/210040842.db2.gz VMVHVVCMOVLZMM-UHFFFAOYSA-N 0 0 388.323 3.245 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc(C(=O)NC2CC2)c1 ZINC000012854519 210018772 /nfs/dbraw/zinc/01/87/72/210018772.db2.gz MRFLTJBVBCPSGL-UHFFFAOYSA-N 0 0 389.795 3.158 20 5 GGBDRN CN(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)Cc1c(F)cccc1Cl ZINC000012850365 210017679 /nfs/dbraw/zinc/01/76/79/210017679.db2.gz CFQVCFUEVAPLIL-UHFFFAOYSA-N 0 0 377.803 3.408 20 5 GGBDRN CNc1ccc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000012632603 209990610 /nfs/dbraw/zinc/99/06/10/209990610.db2.gz RMOOJGYYCPCCSG-MRXNPFEDSA-N 0 0 383.404 3.385 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(Cn2cncn2)cc1 ZINC000011282730 209872057 /nfs/dbraw/zinc/87/20/57/209872057.db2.gz WINKNBBAMKUVCD-UHFFFAOYSA-N 0 0 385.811 3.160 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1c(Cl)cccc1C(F)(F)F ZINC000010452746 209860421 /nfs/dbraw/zinc/86/04/21/209860421.db2.gz YFYADZSWHKRPFO-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN CCCNC(=O)CSc1nnc(SCc2cccc([N+](=O)[O-])c2)s1 ZINC000009723564 209844802 /nfs/dbraw/zinc/84/48/02/209844802.db2.gz KZOMEDCZZQQSKP-UHFFFAOYSA-N 0 0 384.508 3.357 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(CC(F)(F)F)c1ccc(Cl)cc1 ZINC000009685753 209840962 /nfs/dbraw/zinc/84/09/62/209840962.db2.gz QOFPMYBOMOEIHM-UHFFFAOYSA-N 0 0 389.717 3.005 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1cc(Cl)c2c(c1)OCCCO2 ZINC000008277977 209771332 /nfs/dbraw/zinc/77/13/32/209771332.db2.gz KAPRIMLTDAYGTA-UHFFFAOYSA-N 0 0 376.796 3.268 20 5 GGBDRN CN(CC(=O)Nc1ccccc1Cl)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000007912178 209752827 /nfs/dbraw/zinc/75/28/27/209752827.db2.gz BJEMOJGNQYBEKB-UHFFFAOYSA-N 0 0 391.811 3.185 20 5 GGBDRN O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)Nc1ccc(Cl)c(Cl)c1 ZINC000007943984 209753057 /nfs/dbraw/zinc/75/30/57/209753057.db2.gz STTBPJUGMJXSHA-UHFFFAOYSA-N 0 0 396.186 3.266 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000005900046 209621893 /nfs/dbraw/zinc/62/18/93/209621893.db2.gz WFHINCDNOYCLKF-UHFFFAOYSA-N 0 0 375.450 3.320 20 5 GGBDRN CNC(=O)c1cccc(CCNc2ncc([N+](=O)[O-])c(C)c2Br)c1 ZINC000542507021 532774362 /nfs/dbraw/zinc/77/43/62/532774362.db2.gz GCGJZMQMCVCDES-UHFFFAOYSA-N 0 0 393.241 3.075 20 5 GGBDRN Cc1nn(CC(=O)N[C@@H](C)c2ccc(Br)cc2)c(C)c1[N+](=O)[O-] ZINC000004548765 209495046 /nfs/dbraw/zinc/49/50/46/209495046.db2.gz VBKMCWDUHTZNTG-VIFPVBQESA-N 0 0 381.230 3.048 20 5 GGBDRN CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1C ZINC000003480213 209439965 /nfs/dbraw/zinc/43/99/65/209439965.db2.gz HOCBRFHCTWEXHL-UHFFFAOYSA-N 0 0 393.783 3.191 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1 ZINC000003342877 209426180 /nfs/dbraw/zinc/42/61/80/209426180.db2.gz NSIPALWKVWPYOK-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN CCN(c1ccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])o2)cc1)C(C)C ZINC000003235709 209417041 /nfs/dbraw/zinc/41/70/41/209417041.db2.gz VSVHWFCLIKGPQB-UHFFFAOYSA-N 0 0 375.381 3.218 20 5 GGBDRN CCOc1ccccc1NC(=O)COC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000003239057 209416268 /nfs/dbraw/zinc/41/62/68/209416268.db2.gz RVKALMCQEZAJPU-UHFFFAOYSA-N 0 0 378.768 3.442 20 5 GGBDRN COc1ccccc1-n1cnnc1S[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000002726513 209379037 /nfs/dbraw/zinc/37/90/37/209379037.db2.gz MFKWPELNLVEHFB-LBPRGKRZSA-N 0 0 399.432 3.303 20 5 GGBDRN COc1ccc(-n2cnnc2S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000002625665 209373286 /nfs/dbraw/zinc/37/32/86/209373286.db2.gz RZFJZVMQKLLBHV-GFCCVEGCSA-N 0 0 399.432 3.303 20 5 GGBDRN O=[N+]([O-])c1cc(CS(=O)(=O)C/C=C\c2ccccc2)c2c(c1)COCO2 ZINC000097026473 209241804 /nfs/dbraw/zinc/24/18/04/209241804.db2.gz JXQWRDFVYNRBKP-DAXSKMNVSA-N 0 0 375.402 3.090 20 5 GGBDRN COc1cc(C2=N/C(=C/c3ccc(C)c([N+](=O)[O-])c3)C(=O)O2)cc(OC)c1OC ZINC000096635108 209242019 /nfs/dbraw/zinc/24/20/19/209242019.db2.gz CTCXEEOZFMDZGU-VGOFMYFVSA-N 0 0 398.371 3.274 20 5 GGBDRN COc1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)ccc1N1CCCC1=O ZINC000096936998 209241756 /nfs/dbraw/zinc/24/17/56/209241756.db2.gz MZEWQKSAUIMVSA-WDZFZDKYSA-N 0 0 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381.388 3.163 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3csc(-c4ccccc4)n3)CC2)nc1 ZINC000014305458 209171919 /nfs/dbraw/zinc/17/19/19/209171919.db2.gz CDTJDWANBHSUBN-UHFFFAOYSA-N 0 0 381.461 3.436 20 5 GGBDRN COc1ccc(-n2ccnc2SCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000016127829 209173069 /nfs/dbraw/zinc/17/30/69/209173069.db2.gz YMNVFCILSTVKAH-UHFFFAOYSA-N 0 0 384.417 3.180 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cccc(I)c1 ZINC000031929714 211939367 /nfs/dbraw/zinc/93/93/67/211939367.db2.gz HJBCNOJNESNMCH-UHFFFAOYSA-N 0 0 396.184 3.472 20 5 GGBDRN Cc1cn(-c2cccc([N+](=O)[O-])c2)c(=O)n1CC(=O)Nc1ccc(C)c(C)c1 ZINC000225824508 211930110 /nfs/dbraw/zinc/93/01/10/211930110.db2.gz POQQMMSYUPALKK-UHFFFAOYSA-N 0 0 380.404 3.111 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000328607771 209147398 /nfs/dbraw/zinc/14/73/98/209147398.db2.gz XAXIZCUKXKGYIW-IIBYNOLFSA-N 0 0 396.447 3.053 20 5 GGBDRN Cn1ccc2cccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)c21 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391.431 3.338 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(F)c1 ZINC000030778299 210557740 /nfs/dbraw/zinc/55/77/40/210557740.db2.gz BQSGZVJQVHYVJK-LLVKDONJSA-N 0 0 375.331 3.173 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(F)c1 ZINC000030778293 210557529 /nfs/dbraw/zinc/55/75/29/210557529.db2.gz BQSGZVJQVHYVJK-NSHDSACASA-N 0 0 375.331 3.173 20 5 GGBDRN CCOCc1ccccc1CNC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] ZINC000030508940 210553878 /nfs/dbraw/zinc/55/38/78/210553878.db2.gz PLLPJVNIKSRMCZ-UHFFFAOYSA-N 0 0 388.420 3.469 20 5 GGBDRN C[C@H](Sc1nc2ccsc2c(=O)n1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000026100703 210489986 /nfs/dbraw/zinc/48/99/86/210489986.db2.gz DNIHTHGECRZVQI-VIFPVBQESA-N 0 0 390.446 3.023 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1N1CCCCC1 ZINC000024004794 210457352 /nfs/dbraw/zinc/45/73/52/210457352.db2.gz RNRJOYWBVBHQGP-UHFFFAOYSA-N 0 0 396.447 3.344 20 5 GGBDRN 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221093492 /nfs/dbraw/zinc/09/34/92/221093492.db2.gz UQDACORGAOADNK-UHFFFAOYSA-N 0 0 379.210 3.395 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCC([C@H](O)c3ncc[nH]3)CC2)nc1-c1ccccc1 ZINC000170088704 136198734 /nfs/dbraw/zinc/19/87/34/136198734.db2.gz SHCZPZBIBUUHIL-IBGZPJMESA-N 0 0 379.420 3.330 20 5 GGBDRN COc1ccc(CN2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)CC2)cc1F ZINC000170601972 136198845 /nfs/dbraw/zinc/19/88/45/136198845.db2.gz DKETYUMDTPAWHD-UHFFFAOYSA-N 0 0 386.427 3.033 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OCc2noc(C3CC3)n2)c1 ZINC000121517236 564372290 /nfs/dbraw/zinc/37/22/90/564372290.db2.gz JVYZFZZBVDYDED-UHFFFAOYSA-N 0 0 387.133 3.039 20 5 GGBDRN COc1ccc(Br)c(Cn2cc(Br)c([N+](=O)[O-])n2)c1 ZINC000114992110 564185060 /nfs/dbraw/zinc/18/50/60/564185060.db2.gz RESDDJNPQXKLTB-UHFFFAOYSA-N 0 0 391.019 3.373 20 5 GGBDRN CC[C@@H]1COCCN1C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000115304701 564189688 /nfs/dbraw/zinc/18/96/88/564189688.db2.gz CSDXESRYMXNCOH-LLVKDONJSA-N 0 0 378.372 3.343 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)COc1cccc(Br)c1 ZINC000003171017 564193393 /nfs/dbraw/zinc/19/33/93/564193393.db2.gz YFZSNBPROPYLSM-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN Cc1c(C(=O)OCC(=O)Nc2ncc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000003259189 564194013 /nfs/dbraw/zinc/19/40/13/564194013.db2.gz RILNUYXLDNWVIM-UHFFFAOYSA-N 0 0 384.175 3.401 20 5 GGBDRN O=C(COC(=O)c1ccc([N+](=O)[O-])s1)Nc1ncc(Cl)cc1Cl ZINC000003259181 564194022 /nfs/dbraw/zinc/19/40/22/564194022.db2.gz PUYDAKFCGODVGP-UHFFFAOYSA-N 0 0 376.177 3.154 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCSC[C@@H]2c2ccccc2)c(F)c1 ZINC000115590462 564196227 /nfs/dbraw/zinc/19/62/27/564196227.db2.gz VZSBGDIONPXVOC-OAHLLOKOSA-N 0 0 382.438 3.213 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCSC[C@H]1c1ccccc1 ZINC000115590341 564196347 /nfs/dbraw/zinc/19/63/47/564196347.db2.gz VCJQBTTUEZSOOA-INIZCTEOSA-N 0 0 378.475 3.382 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCSC[C@H]1c1ccccc1 ZINC000115590454 564196523 /nfs/dbraw/zinc/19/65/23/564196523.db2.gz AKHVIAWUALXOGK-INIZCTEOSA-N 0 0 378.475 3.382 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCSC[C@H]1c1ccccc1 ZINC000115590224 564196787 /nfs/dbraw/zinc/19/67/87/564196787.db2.gz PAVOYYFVBQZGDM-INIZCTEOSA-N 0 0 378.475 3.382 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCSC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000115590529 564196849 /nfs/dbraw/zinc/19/68/49/564196849.db2.gz HEAQQYIUARZCIA-QGZVFWFLSA-N 0 0 378.475 3.382 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CCOc1ccc(Br)cc1 ZINC000003598316 564199145 /nfs/dbraw/zinc/19/91/45/564199145.db2.gz SZQYMZUHZLGYOK-UHFFFAOYSA-N 0 0 391.177 3.032 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CCOc1cccc(Br)c1 ZINC000003598261 564199247 /nfs/dbraw/zinc/19/92/47/564199247.db2.gz GDQDVZUUYVHFSM-UHFFFAOYSA-N 0 0 391.177 3.032 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccc(Br)cc1F ZINC000004433943 564203119 /nfs/dbraw/zinc/20/31/19/564203119.db2.gz SRCGLRVXMMNKJR-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116270514 564206433 /nfs/dbraw/zinc/20/64/33/564206433.db2.gz FHFHHLSMOCOOJE-NSHDSACASA-N 0 0 383.857 3.089 20 5 GGBDRN Cc1ccc([C@@H]2CSCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000116376260 564209787 /nfs/dbraw/zinc/20/97/87/564209787.db2.gz WCKQQYKBQUDRLZ-KRWDZBQOSA-N 0 0 378.475 3.382 20 5 GGBDRN COc1ccc(Br)c(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000116446727 564210549 /nfs/dbraw/zinc/21/05/49/564210549.db2.gz AEIXVVWWQXDSEG-UHFFFAOYSA-N 0 0 380.198 3.077 20 5 GGBDRN CCc1nc(CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000116744943 564216166 /nfs/dbraw/zinc/21/61/66/564216166.db2.gz JGLOXRUUWQWHNR-UHFFFAOYSA-N 0 0 383.857 3.395 20 5 GGBDRN CN(CCOc1ccc(Cl)cc1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000005688684 564218892 /nfs/dbraw/zinc/21/88/92/564218892.db2.gz JCKKAVUUFJBQAI-UHFFFAOYSA-N 0 0 384.841 3.167 20 5 GGBDRN CCOC(=O)c1nnsc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000116996784 564220922 /nfs/dbraw/zinc/22/09/22/564220922.db2.gz MVHAGNSWEGZTAC-UHFFFAOYSA-N 0 0 378.391 3.090 20 5 GGBDRN COc1ccc(NC(=O)COc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000006181692 564221547 /nfs/dbraw/zinc/22/15/47/564221547.db2.gz JICPOBQVJMGDNP-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1cc(Br)ccc1F ZINC000117154027 564222985 /nfs/dbraw/zinc/22/29/85/564222985.db2.gz MDRNSFOHKISHPA-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)cc1 ZINC000117373506 564226506 /nfs/dbraw/zinc/22/65/06/564226506.db2.gz CGRILJNXLQIORF-UHFFFAOYSA-N 0 0 392.277 3.100 20 5 GGBDRN CNC(=O)c1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)ccc1Cl ZINC000117620961 564229330 /nfs/dbraw/zinc/22/93/30/564229330.db2.gz AQSXEJKEEBAPDM-UHFFFAOYSA-N 0 0 382.203 3.442 20 5 GGBDRN CCN1CCc2nc(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)sc2C1 ZINC000117568232 564229465 /nfs/dbraw/zinc/22/94/65/564229465.db2.gz PWIIBFSCUSSHJJ-UHFFFAOYSA-N 0 0 380.857 3.264 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1cccs1 ZINC000117590415 564229479 /nfs/dbraw/zinc/22/94/79/564229479.db2.gz QGDWEBQQBONSPH-CYBMUJFWSA-N 0 0 382.825 3.273 20 5 GGBDRN COC(=O)c1ccc(OCC(=O)c2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000007128302 564233113 /nfs/dbraw/zinc/23/31/13/564233113.db2.gz OGDJCWYOCWKGTJ-UHFFFAOYSA-N 0 0 394.177 3.406 20 5 GGBDRN O=[N+]([O-])c1ccccc1Sc1ccc(S(=O)(=O)N2CCCCC2)cn1 ZINC000007187296 564233910 /nfs/dbraw/zinc/23/39/10/564233910.db2.gz JUKCBQADZHNGAD-UHFFFAOYSA-N 0 0 379.463 3.316 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)CCOc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000007249103 564234479 /nfs/dbraw/zinc/23/44/79/564234479.db2.gz FKIBWPORWBZESF-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000007362347 564236251 /nfs/dbraw/zinc/23/62/51/564236251.db2.gz XESYIAJVUOTJNE-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN CC(=O)Nc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1Cl ZINC000007362338 564236517 /nfs/dbraw/zinc/23/65/17/564236517.db2.gz MGTMFAWDRYINKJ-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000007473801 564236940 /nfs/dbraw/zinc/23/69/40/564236940.db2.gz CDUZPVZAUDJJNT-NSHDSACASA-N 0 0 382.825 3.358 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000007471270 564237407 /nfs/dbraw/zinc/23/74/07/564237407.db2.gz PJCSJJJFATWNPW-LLVKDONJSA-N 0 0 382.825 3.358 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)NCCOc2ccccc2F)cc1[N+](=O)[O-] ZINC000007684998 564240004 /nfs/dbraw/zinc/24/00/04/564240004.db2.gz MDRCNYKHSXXWQB-UHFFFAOYSA-N 0 0 388.804 3.053 20 5 GGBDRN C[C@@H]1SCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000118441781 564240804 /nfs/dbraw/zinc/24/08/04/564240804.db2.gz LKSQTKAVMRRQQM-SUMWQHHRSA-N 0 0 378.475 3.462 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCNS(=O)(=O)c1cccs1 ZINC000007907827 564242578 /nfs/dbraw/zinc/24/25/78/564242578.db2.gz ZPTZHIIASOYZLE-UHFFFAOYSA-N 0 0 395.384 3.066 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1cccc(Cl)c1Cl ZINC000007907884 564242731 /nfs/dbraw/zinc/24/27/31/564242731.db2.gz KXQVDUWNWXJQHH-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2c(Cl)cccc2Cl)cc1 ZINC000007908921 564243106 /nfs/dbraw/zinc/24/31/06/564243106.db2.gz FRBZDZPZTHLNEL-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NCc1cccs1 ZINC000007983323 564243404 /nfs/dbraw/zinc/24/34/04/564243404.db2.gz PHOWSUQGJLLSKE-UHFFFAOYSA-N 0 0 381.479 3.443 20 5 GGBDRN O=C(c1ccccc1Br)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690075 564244033 /nfs/dbraw/zinc/24/40/33/564244033.db2.gz LISBGMYKWPJKON-NSHDSACASA-N 0 0 391.225 3.079 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCSc3ccccc32)cc1[N+](=O)[O-] ZINC000008037326 564244641 /nfs/dbraw/zinc/24/46/41/564244641.db2.gz ILFPHKXUZIOOAK-UHFFFAOYSA-N 0 0 380.447 3.295 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccc(Br)cc2)cc([N+](=O)[O-])c1 ZINC000118723867 564245256 /nfs/dbraw/zinc/24/52/56/564245256.db2.gz HSDFFXUCXMGFHC-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN O=C(Nc1cccc(Br)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000008210036 564246883 /nfs/dbraw/zinc/24/68/83/564246883.db2.gz QMJUAVMGTBLBKT-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN CN(Cc1ccc(Br)s1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000008168766 564247372 /nfs/dbraw/zinc/24/73/72/564247372.db2.gz OWPCDEBVLXMYMN-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN CS(=O)(=O)c1ccc(Sc2nnc(-c3ccccc3)o2)c([N+](=O)[O-])c1 ZINC000008198646 564247408 /nfs/dbraw/zinc/24/74/08/564247408.db2.gz JGDZZODPTWFJKL-UHFFFAOYSA-N 0 0 377.403 3.200 20 5 GGBDRN CN(CC(=O)Nc1ccccc1Br)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000008315025 564247990 /nfs/dbraw/zinc/24/79/90/564247990.db2.gz SQRMGOVLBJLRBM-UHFFFAOYSA-N 0 0 398.238 3.130 20 5 GGBDRN CC(C)[C@@H]1OCCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000118978100 564249360 /nfs/dbraw/zinc/24/93/60/564249360.db2.gz YSPBXDDXHDTTMH-GUYCJALGSA-N 0 0 399.285 3.467 20 5 GGBDRN CCCCOCCNC(=O)CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000119107754 564254924 /nfs/dbraw/zinc/25/49/24/564254924.db2.gz FSKHIXYXSDJANT-UHFFFAOYSA-N 0 0 391.287 3.382 20 5 GGBDRN CC(=O)[C@@H](NC(=O)CSc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000119105160 564255052 /nfs/dbraw/zinc/25/50/52/564255052.db2.gz HVVDRAFWOJAWJK-AWEZNQCLSA-N 0 0 389.271 3.179 20 5 GGBDRN C[C@H](Sc1ccc(Br)cc1[N+](=O)[O-])c1nc(N)nc(N(C)C)n1 ZINC000119104621 564255059 /nfs/dbraw/zinc/25/50/59/564255059.db2.gz OQUCJDPOGYLMNG-ZETCQYMHSA-N 0 0 399.274 3.044 20 5 GGBDRN C[C@@H](Sc1ccc(Br)cc1[N+](=O)[O-])c1nc(N)nc(N(C)C)n1 ZINC000119104688 564255181 /nfs/dbraw/zinc/25/51/81/564255181.db2.gz OQUCJDPOGYLMNG-SSDOTTSWSA-N 0 0 399.274 3.044 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c(Cl)c1 ZINC000119124589 564255893 /nfs/dbraw/zinc/25/58/93/564255893.db2.gz BBODXRZRRXIVNK-UHFFFAOYSA-N 0 0 389.842 3.377 20 5 GGBDRN CS(=O)(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000010511307 564257814 /nfs/dbraw/zinc/25/78/14/564257814.db2.gz OMSUGHKHMKQTHN-UHFFFAOYSA-N 0 0 376.415 3.465 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCCCCOc1ccc(Cl)cc1 ZINC000010517870 564258219 /nfs/dbraw/zinc/25/82/19/564258219.db2.gz YXDVRATWFQTUHX-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN COc1ccc(Cl)cc1N(C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000119197533 564259044 /nfs/dbraw/zinc/25/90/44/564259044.db2.gz MBMKSBKQCGEJCZ-UHFFFAOYSA-N 0 0 376.843 3.452 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1coc(-c2cccs2)n1 ZINC000010683646 564259659 /nfs/dbraw/zinc/25/96/59/564259659.db2.gz XDHSCEGFCHYROP-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000011621182 564264561 /nfs/dbraw/zinc/26/45/61/564264561.db2.gz KHFGEZBXHUOQHC-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000119506651 564274310 /nfs/dbraw/zinc/27/43/10/564274310.db2.gz RFSKOWGYWLRAJU-UHFFFAOYSA-N 0 0 387.193 3.024 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1coc(-c2cccs2)n1 ZINC000119524392 564274873 /nfs/dbraw/zinc/27/48/73/564274873.db2.gz JMAAOKDSRMNYEC-UHFFFAOYSA-N 0 0 399.837 3.443 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(Br)c(=O)n(C)c2)cc1[N+](=O)[O-] ZINC000119633113 564279872 /nfs/dbraw/zinc/27/98/72/564279872.db2.gz UCMZYKCKEKJEJK-UHFFFAOYSA-N 0 0 398.238 3.030 20 5 GGBDRN CC[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000119726354 564284698 /nfs/dbraw/zinc/28/46/98/564284698.db2.gz AIJQCSRKDCETFM-OAHLLOKOSA-N 0 0 383.857 3.137 20 5 GGBDRN Cc1c(NCc2cc(=O)n3cc(Br)ccc3n2)cccc1[N+](=O)[O-] ZINC000015319728 564285166 /nfs/dbraw/zinc/28/51/66/564285166.db2.gz KXYKGXUJVPQQDI-UHFFFAOYSA-N 0 0 389.209 3.286 20 5 GGBDRN C[C@H]1C[C@H](C)CN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000119731804 564285726 /nfs/dbraw/zinc/28/57/26/564285726.db2.gz BTBSPYNLZYYEHE-UWVGGRQHSA-N 0 0 388.205 3.318 20 5 GGBDRN C[C@@H]1c2cccn2CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000015415679 564287211 /nfs/dbraw/zinc/28/72/11/564287211.db2.gz YIGXIZQTVBPBSI-LLVKDONJSA-N 0 0 393.241 3.174 20 5 GGBDRN COCC[C@@H](C)NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000119775299 564288014 /nfs/dbraw/zinc/28/80/14/564288014.db2.gz WUHXURNZKLGXKS-SECBINFHSA-N 0 0 387.223 3.242 20 5 GGBDRN O=c1c2cc(Br)cc(F)c2ncn1Cc1ccc([N+](=O)[O-])cc1 ZINC000119794935 564288756 /nfs/dbraw/zinc/28/87/56/564288756.db2.gz VUPNCIOFBQLDEF-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN CCCC(O)(CCC)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000119814769 564289649 /nfs/dbraw/zinc/28/96/49/564289649.db2.gz KRVWLTKXIPPIOY-UHFFFAOYSA-N 0 0 387.274 3.347 20 5 GGBDRN CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)Cc1ccccn1 ZINC000119823568 564290079 /nfs/dbraw/zinc/29/00/79/564290079.db2.gz OWRAACIOMZDUIY-UHFFFAOYSA-N 0 0 393.241 3.213 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000015816331 564290458 /nfs/dbraw/zinc/29/04/58/564290458.db2.gz BXURCGPXKGBSLJ-UHFFFAOYSA-N 0 0 380.447 3.038 20 5 GGBDRN CC(=O)NCCc1ccc(C(=O)COc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000016116053 564292047 /nfs/dbraw/zinc/29/20/47/564292047.db2.gz ICTRISKKMVINBI-UHFFFAOYSA-N 0 0 382.825 3.250 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000119880769 564293316 /nfs/dbraw/zinc/29/33/16/564293316.db2.gz VDFQRWLISWIENT-SNVBAGLBSA-N 0 0 379.214 3.100 20 5 GGBDRN O=C(CSc1nnnn1C1CCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000016371610 564294191 /nfs/dbraw/zinc/29/41/91/564294191.db2.gz NKLBGVWPWWABHD-UHFFFAOYSA-N 0 0 382.833 3.081 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](C)Oc2cccnc2[N+](=O)[O-])c(Br)c1 ZINC000016793397 564296292 /nfs/dbraw/zinc/29/62/92/564296292.db2.gz CGPURDGYPDEPMD-SNVBAGLBSA-N 0 0 380.198 3.467 20 5 GGBDRN CN(CCOc1ccc(Br)cc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000018047429 564300058 /nfs/dbraw/zinc/30/00/58/564300058.db2.gz WEFUPHSXCYMSKG-UHFFFAOYSA-N 0 0 393.237 3.437 20 5 GGBDRN CN(Cc1ccc(Br)s1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000018941012 564302016 /nfs/dbraw/zinc/30/20/16/564302016.db2.gz QMOKTONXAHGMBC-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(Cc2ccc(Br)s2)CC1 ZINC000018898896 564302322 /nfs/dbraw/zinc/30/23/22/564302322.db2.gz DCAGIGWZNZTQKA-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN CS(=O)(=O)Cc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000120068988 564303025 /nfs/dbraw/zinc/30/30/25/564303025.db2.gz QXQKGUTXWLAXFD-UHFFFAOYSA-N 0 0 383.813 3.437 20 5 GGBDRN COc1cc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)ccc1O ZINC000120122217 564305039 /nfs/dbraw/zinc/30/50/39/564305039.db2.gz NCGAPHRRPUGUPE-UHFFFAOYSA-N 0 0 395.209 3.344 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1coc(-c2cccc(F)c2)n1 ZINC000120183338 564307826 /nfs/dbraw/zinc/30/78/26/564307826.db2.gz XHBVVJBPGGKJIN-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN CCOC(=O)CS[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000021347384 564310124 /nfs/dbraw/zinc/31/01/24/564310124.db2.gz XRUWWHXURVBMBJ-QMMMGPOBSA-N 0 0 380.344 3.237 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@H]1COc2ccccc2C1 ZINC000120225060 564311088 /nfs/dbraw/zinc/31/10/88/564311088.db2.gz PCFPQHNRCYVHOS-CYBMUJFWSA-N 0 0 391.221 3.020 20 5 GGBDRN O=C(COc1ccc(Br)cc1F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000021572798 564311225 /nfs/dbraw/zinc/31/12/25/564311225.db2.gz IFTCFFVBVJJVQW-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1-n1cncn1 ZINC000120281576 564312768 /nfs/dbraw/zinc/31/27/68/564312768.db2.gz ZTKOZWFXIAIJQE-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2COc3ccc(Br)cc32)c([N+](=O)[O-])c1 ZINC000120262171 564313104 /nfs/dbraw/zinc/31/31/04/564313104.db2.gz GKEYDQCWLNSBFL-LBPRGKRZSA-N 0 0 393.193 3.481 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000022089966 564313966 /nfs/dbraw/zinc/31/39/66/564313966.db2.gz NCHJKQMZQTWGFK-UHFFFAOYSA-N 0 0 387.458 3.438 20 5 GGBDRN O=C(Nc1cccc(Br)c1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000022560592 564318510 /nfs/dbraw/zinc/31/85/10/564318510.db2.gz HTOICFJZXFBCOQ-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2CCSc3ccccc32)cc1 ZINC000120486392 564321931 /nfs/dbraw/zinc/32/19/31/564321931.db2.gz XIERLDJYMYFTSM-MRXNPFEDSA-N 0 0 378.475 3.294 20 5 GGBDRN O=c1ccn(Cc2ccnc(-c3ccc(Br)cc3)n2)cc1[N+](=O)[O-] ZINC000120492246 564323083 /nfs/dbraw/zinc/32/30/83/564323083.db2.gz ZSSSDLYHWQUFKU-UHFFFAOYSA-N 0 0 387.193 3.024 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1 ZINC000023227737 564323250 /nfs/dbraw/zinc/32/32/50/564323250.db2.gz FTIVDYHIXHPPRF-NSHDSACASA-N 0 0 380.447 3.118 20 5 GGBDRN CN(Cc1ccco1)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000120510382 564323633 /nfs/dbraw/zinc/32/36/33/564323633.db2.gz WQTDIPNUOGZOSZ-UHFFFAOYSA-N 0 0 386.145 3.065 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC[C@@H](O)C3)cc2[N+](=O)[O-])n1 ZINC000120537879 564325182 /nfs/dbraw/zinc/32/51/82/564325182.db2.gz ACFCRAFCZKEHCW-GFCCVEGCSA-N 0 0 379.463 3.108 20 5 GGBDRN COc1cc(=O)n(Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1Br ZINC000120577065 564326618 /nfs/dbraw/zinc/32/66/18/564326618.db2.gz MMDQXLCISYIWTF-UHFFFAOYSA-N 0 0 397.225 3.363 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC[C@H](Oc2ccncc2)C1 ZINC000120745612 564334899 /nfs/dbraw/zinc/33/48/99/564334899.db2.gz AZMNVUSETOLQOI-ZDUSSCGKSA-N 0 0 392.209 3.046 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000025375480 564338769 /nfs/dbraw/zinc/33/87/69/564338769.db2.gz UXQPWFZGYHRNDZ-VHSXEESVSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000025376251 564338941 /nfs/dbraw/zinc/33/89/41/564338941.db2.gz YYHFJVKLRCIRDZ-UWVGGRQHSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000025375478 564339027 /nfs/dbraw/zinc/33/90/27/564339027.db2.gz UXQPWFZGYHRNDZ-ZJUUUORDSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1cc(CSc2nnnn2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000025856208 564341642 /nfs/dbraw/zinc/34/16/42/564341642.db2.gz CPFKOYMHMDBRGE-UHFFFAOYSA-N 0 0 375.357 3.065 20 5 GGBDRN CCCN(CCO)C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000120906260 564342486 /nfs/dbraw/zinc/34/24/86/564342486.db2.gz DSAGSEDLXBJYHT-UHFFFAOYSA-N 0 0 381.479 3.355 20 5 GGBDRN O=C(CN1CCOc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Br ZINC000026199690 564344733 /nfs/dbraw/zinc/34/47/33/564344733.db2.gz WRRIENZTHCBAFR-UHFFFAOYSA-N 0 0 392.209 3.195 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000026358564 564345704 /nfs/dbraw/zinc/34/57/04/564345704.db2.gz WQLGSCAGJKXIAS-CYBMUJFWSA-N 0 0 382.463 3.026 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccc(Br)cc3)CC2)cn1 ZINC000026481241 564346672 /nfs/dbraw/zinc/34/66/72/564346672.db2.gz BQVSMWFKOUTCPK-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN O=C(NCCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000026408608 564347135 /nfs/dbraw/zinc/34/71/35/564347135.db2.gz FIVAMGNQWMLGDE-UHFFFAOYSA-N 0 0 382.203 3.061 20 5 GGBDRN CN(CCCOc1ccc(Cl)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000026400088 564347145 /nfs/dbraw/zinc/34/71/45/564347145.db2.gz IDKFNCLKTOESQH-UHFFFAOYSA-N 0 0 384.841 3.338 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Sc2nnc(NC3CC3)s2)cccc1[N+](=O)[O-] ZINC000026526461 564347980 /nfs/dbraw/zinc/34/79/80/564347980.db2.gz ZYCLIBIMIAATRJ-VIFPVBQESA-N 0 0 379.467 3.448 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2cccc(Cl)c2)c(Cl)c1 ZINC000026711980 564348368 /nfs/dbraw/zinc/34/83/68/564348368.db2.gz UIPYZYFAAMHMHK-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCCc1ccc(Cl)s1 ZINC000121020680 564349197 /nfs/dbraw/zinc/34/91/97/564349197.db2.gz JQLUMNMQTHYNPR-UHFFFAOYSA-N 0 0 381.841 3.224 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1Br ZINC000026830755 564349658 /nfs/dbraw/zinc/34/96/58/564349658.db2.gz XZQDDEMUQFVLFT-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cn2C)cc1I ZINC000026855971 564350593 /nfs/dbraw/zinc/35/05/93/564350593.db2.gz YAVUZLBVJDVXEO-UHFFFAOYSA-N 0 0 385.161 3.099 20 5 GGBDRN CCN(Cc1ccc(Cl)s1)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000026859729 564351049 /nfs/dbraw/zinc/35/10/49/564351049.db2.gz GMCZHZVRZIKFQU-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN O=C([C@@H]1COc2ccc(Br)cc21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000121064645 564351443 /nfs/dbraw/zinc/35/14/43/564351443.db2.gz YQXQPQUSKYIBAN-CQSZACIVSA-N 0 0 389.205 3.423 20 5 GGBDRN COCc1ccc(CNS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cc1 ZINC000026971526 564351796 /nfs/dbraw/zinc/35/17/96/564351796.db2.gz AQVDTOJQQUWEPI-UHFFFAOYSA-N 0 0 384.841 3.182 20 5 GGBDRN O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)Nc1c(Cl)cccc1Cl ZINC000028004318 564358869 /nfs/dbraw/zinc/35/88/69/564358869.db2.gz SKUSLSNXJYHJMH-UHFFFAOYSA-N 0 0 382.159 3.448 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(Br)s1 ZINC000028060142 564359581 /nfs/dbraw/zinc/35/95/81/564359581.db2.gz UWHGZJFMKQXPDA-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CC(C)Cn1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000121347350 564364891 /nfs/dbraw/zinc/36/48/91/564364891.db2.gz BQNWYIXDYHBMDH-UHFFFAOYSA-N 0 0 381.230 3.391 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H](CCCO)c1ccccc1 ZINC000121395972 564366681 /nfs/dbraw/zinc/36/66/81/564366681.db2.gz HYIMCBSPRCBDKQ-AWEZNQCLSA-N 0 0 384.841 3.040 20 5 GGBDRN O=C(C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(Br)cc1 ZINC000121446166 564369831 /nfs/dbraw/zinc/36/98/31/564369831.db2.gz YLXIEOBEUSOBKH-UHFFFAOYSA-N 0 0 389.205 3.125 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000029388748 564370064 /nfs/dbraw/zinc/37/00/64/564370064.db2.gz DFAHEPWCKJKMFT-WDEREUQCSA-N 0 0 382.360 3.003 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(OCCSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000029680208 564371894 /nfs/dbraw/zinc/37/18/94/564371894.db2.gz YJEQKQFMDFBIRF-UHFFFAOYSA-N 0 0 382.463 3.016 20 5 GGBDRN CC(C)Cn1nnnc1S[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000029593744 564371982 /nfs/dbraw/zinc/37/19/82/564371982.db2.gz QZOOYJAQELIGGT-SECBINFHSA-N 0 0 384.849 3.010 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)c2cc(Br)cc([N+](=O)[O-])c2)o1 ZINC000121554028 564373969 /nfs/dbraw/zinc/37/39/69/564373969.db2.gz IUYHGRZFKGBZHS-AWEZNQCLSA-N 0 0 395.209 3.472 20 5 GGBDRN O=C(COc1ccc(Br)cc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000029891435 564374205 /nfs/dbraw/zinc/37/42/05/564374205.db2.gz RUJOGBYKKWXRDR-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)c2cc(Br)cc([N+](=O)[O-])c2)o1 ZINC000121554165 564374856 /nfs/dbraw/zinc/37/48/56/564374856.db2.gz IUYHGRZFKGBZHS-CQSZACIVSA-N 0 0 395.209 3.472 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1ccc(OC(F)F)cc1 ZINC000029938729 564375822 /nfs/dbraw/zinc/37/58/22/564375822.db2.gz NDXNZVROOOAVFU-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN CN(CCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000029944324 564375917 /nfs/dbraw/zinc/37/59/17/564375917.db2.gz CBABYJNECUVTSI-UHFFFAOYSA-N 0 0 383.857 3.053 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)cc1 ZINC000121600458 564376653 /nfs/dbraw/zinc/37/66/53/564376653.db2.gz LNSCZQFIVWOPPC-DOMZBBRYSA-N 0 0 384.816 3.363 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)Cc1ccc(Br)o1 ZINC000030213664 564377134 /nfs/dbraw/zinc/37/71/34/564377134.db2.gz GAHUFIXCTFBQBH-UHFFFAOYSA-N 0 0 382.214 3.329 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NCc1cc(=O)n2cc(Br)ccc2n1 ZINC000030284941 564378098 /nfs/dbraw/zinc/37/80/98/564378098.db2.gz JSDOFCHENLNEHF-UHFFFAOYSA-N 0 0 389.209 3.286 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1nc2ccccc2s1 ZINC000030324937 564379048 /nfs/dbraw/zinc/37/90/48/564379048.db2.gz UGSMDNUXPSVQJJ-UHFFFAOYSA-N 0 0 377.447 3.334 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1ccc(Br)cc1 ZINC000030319970 564379118 /nfs/dbraw/zinc/37/91/18/564379118.db2.gz BRKSCVPJABHJKK-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccc(Br)s1 ZINC000030335083 564379135 /nfs/dbraw/zinc/37/91/35/564379135.db2.gz HZULGCKHBLAUOB-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CN(CCCOc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000030358459 564379904 /nfs/dbraw/zinc/37/99/04/564379904.db2.gz VEMAGOMOMINQGA-UHFFFAOYSA-N 0 0 384.841 3.338 20 5 GGBDRN CN(C(=O)CSc1nc2cc(Cl)cnc2[nH]1)c1ccc([N+](=O)[O-])cc1 ZINC000121666007 564380346 /nfs/dbraw/zinc/38/03/46/564380346.db2.gz GEYSPMMHZTURRK-UHFFFAOYSA-N 0 0 377.813 3.275 20 5 GGBDRN CCN(CC)[C@H](CNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000030435218 564380599 /nfs/dbraw/zinc/38/05/99/564380599.db2.gz ZRQHETLOAZYAFI-OAHLLOKOSA-N 0 0 383.495 3.018 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1ccc(Br)o1 ZINC000030420179 564380740 /nfs/dbraw/zinc/38/07/40/564380740.db2.gz AQSACKVWCUNXAB-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1csc(Br)c1 ZINC000030444732 564381222 /nfs/dbraw/zinc/38/12/22/564381222.db2.gz GEIPBBUCKOFRQY-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(Cc3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000030541390 564382716 /nfs/dbraw/zinc/38/27/16/564382716.db2.gz SIRWNJCYKKPYHY-UHFFFAOYSA-N 0 0 377.491 3.336 20 5 GGBDRN O=C(c1csc(Br)c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000030813108 564384530 /nfs/dbraw/zinc/38/45/30/564384530.db2.gz VWRODINELZPXHR-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN COC(=O)c1cc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])s3)n2)c[nH]1 ZINC000030986037 564386014 /nfs/dbraw/zinc/38/60/14/564386014.db2.gz ZIYMWCYNZDFTTI-UHFFFAOYSA-N 0 0 378.391 3.147 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCSc1nccn1-c1cccc(Cl)c1 ZINC000121868371 564390197 /nfs/dbraw/zinc/39/01/97/564390197.db2.gz MQDCEDDHRAPNLL-UHFFFAOYSA-N 0 0 376.825 3.388 20 5 GGBDRN O=C(NC(C1CC1)C1CC1)c1cc([N+](=O)[O-])ccc1I ZINC000031716881 564390983 /nfs/dbraw/zinc/39/09/83/564390983.db2.gz KGIZQSBNEXABJO-UHFFFAOYSA-N 0 0 386.189 3.118 20 5 GGBDRN COCCN(CC(F)(F)F)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000121933641 564393661 /nfs/dbraw/zinc/39/36/61/564393661.db2.gz MJQBDCHGAZTOKC-UHFFFAOYSA-N 0 0 399.163 3.317 20 5 GGBDRN C[S@@](=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000121995611 564396623 /nfs/dbraw/zinc/39/66/23/564396623.db2.gz AYULRZZOSPZWPC-QFIPXVFZSA-N 0 0 383.223 3.347 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000122034373 564397130 /nfs/dbraw/zinc/39/71/30/564397130.db2.gz HOIBWUVIFSWFKV-CHWSQXEVSA-N 0 0 376.862 3.072 20 5 GGBDRN O=C(NCc1nc2ccccc2[nH]1)c1ccc([N+](=O)[O-])cc1Br ZINC000122100927 564400151 /nfs/dbraw/zinc/40/01/51/564400151.db2.gz YDDWMFKZSXNRCT-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN CC[C@H]1c2ccsc2CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000032436136 564400805 /nfs/dbraw/zinc/40/08/05/564400805.db2.gz CRJGIQSESBNDPI-ZDUSSCGKSA-N 0 0 382.463 3.363 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1CCSc2ccccc21 ZINC000032444920 564400945 /nfs/dbraw/zinc/40/09/45/564400945.db2.gz RLXVLWWXICSKIT-CYBMUJFWSA-N 0 0 380.447 3.119 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cc2c(cc1Cl)OCCO2 ZINC000032632522 564403704 /nfs/dbraw/zinc/40/37/04/564403704.db2.gz UYPWYXFTRNPRCV-UHFFFAOYSA-N 0 0 384.797 3.129 20 5 GGBDRN C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000122249422 564406018 /nfs/dbraw/zinc/40/60/18/564406018.db2.gz FDNXBLDDMPRLAS-SECBINFHSA-N 0 0 389.264 3.395 20 5 GGBDRN COCCN(CCOC)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000032803831 564406727 /nfs/dbraw/zinc/40/67/27/564406727.db2.gz QWNCORUQPIDFIT-UHFFFAOYSA-N 0 0 384.230 3.005 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])sc1C ZINC000122414860 564412823 /nfs/dbraw/zinc/41/28/23/564412823.db2.gz YTDGDWRXQGXAIN-UHFFFAOYSA-N 0 0 383.495 3.499 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)cc1OCC(F)(F)F ZINC000122427943 564413927 /nfs/dbraw/zinc/41/39/27/564413927.db2.gz JYJKZJVXGDCSBX-UHFFFAOYSA-N 0 0 378.694 3.175 20 5 GGBDRN Cc1sc(Br)cc1S(=O)(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000122438533 564414111 /nfs/dbraw/zinc/41/41/11/564414111.db2.gz YPQJICYUQULDDW-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1csc(-c2ccc(Cl)s2)n1 ZINC000122481215 564415407 /nfs/dbraw/zinc/41/54/07/564415407.db2.gz VJOKUAXGBQFOSW-UHFFFAOYSA-N 0 0 383.842 3.060 20 5 GGBDRN COc1ccc(S(=O)(=O)NC2(c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000122542900 564417990 /nfs/dbraw/zinc/41/79/90/564417990.db2.gz QQXPFQYXLORFAA-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122546158 564418248 /nfs/dbraw/zinc/41/82/48/564418248.db2.gz BPEDOQYEEVPDQB-LLVKDONJSA-N 0 0 383.857 3.089 20 5 GGBDRN COc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1Br ZINC000122663041 564421842 /nfs/dbraw/zinc/42/18/42/564421842.db2.gz ONUZXTNYNPHZOT-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000122678531 564423525 /nfs/dbraw/zinc/42/35/25/564423525.db2.gz URVXPWDWZIYCSO-CQSZACIVSA-N 0 0 381.841 3.477 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000122703780 564423791 /nfs/dbraw/zinc/42/37/91/564423791.db2.gz FYXRWFMLBHXUNR-CQSZACIVSA-N 0 0 381.841 3.477 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)COc2ccc(Br)cc2F)c1 ZINC000122707433 564424093 /nfs/dbraw/zinc/42/40/93/564424093.db2.gz CGYVTVYDFZIXSJ-LBPRGKRZSA-N 0 0 386.173 3.315 20 5 GGBDRN CCc1noc(CC)c1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000122716747 564424892 /nfs/dbraw/zinc/42/48/92/564424892.db2.gz FTGIERYILYWAET-UHFFFAOYSA-N 0 0 382.214 3.400 20 5 GGBDRN O=C(CCCOc1ccc(Cl)cc1Cl)NCCn1cc([N+](=O)[O-])cn1 ZINC000122766826 564426836 /nfs/dbraw/zinc/42/68/36/564426836.db2.gz LYPMHVXYOGFSGQ-UHFFFAOYSA-N 0 0 387.223 3.074 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000122801179 564427441 /nfs/dbraw/zinc/42/74/41/564427441.db2.gz CBMKRAFNUNKHRM-UHFFFAOYSA-N 0 0 392.405 3.387 20 5 GGBDRN Cc1ccccc1CNC(=O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000122800861 564427729 /nfs/dbraw/zinc/42/77/29/564427729.db2.gz CAOCAIQFCKBUPO-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](c1cccs1)c1ccc(Cl)cc1 ZINC000041136537 564429201 /nfs/dbraw/zinc/42/92/01/564429201.db2.gz LSJCGSJWPIKGMU-MRXNPFEDSA-N 0 0 376.825 3.412 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC000041172927 564430271 /nfs/dbraw/zinc/43/02/71/564430271.db2.gz SFLARNPWGDQXPX-INIZCTEOSA-N 0 0 382.825 3.010 20 5 GGBDRN Cc1sc(S(=O)(=O)NCCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000122884133 564430670 /nfs/dbraw/zinc/43/06/70/564430670.db2.gz GDXFLKPTISAWGU-UHFFFAOYSA-N 0 0 383.476 3.095 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000122899060 564431014 /nfs/dbraw/zinc/43/10/14/564431014.db2.gz NBZONQGZBSJOSN-UHFFFAOYSA-N 0 0 390.870 3.447 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000122917620 564431030 /nfs/dbraw/zinc/43/10/30/564431030.db2.gz MCECIBFOKNZAMT-UHFFFAOYSA-N 0 0 380.447 3.148 20 5 GGBDRN COc1cc(C(=O)N(C)Cc2ccc(Br)o2)c([N+](=O)[O-])cc1OC ZINC000041396349 564432823 /nfs/dbraw/zinc/43/28/23/564432823.db2.gz FZZPMBKVJQMJJG-UHFFFAOYSA-N 0 0 399.197 3.240 20 5 GGBDRN COc1cccc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000122945364 564433474 /nfs/dbraw/zinc/43/34/74/564433474.db2.gz ZXLRYHUVNCBMRM-CQSZACIVSA-N 0 0 382.463 3.499 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc(-c3cccc(Cl)c3)no2)cc1 ZINC000123040112 564436266 /nfs/dbraw/zinc/43/62/66/564436266.db2.gz DDBBBPYZGGVSQY-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000123055702 564437656 /nfs/dbraw/zinc/43/76/56/564437656.db2.gz VLPMURNZKBZHJQ-UHFFFAOYSA-N 0 0 397.297 3.267 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCCCCSC)c([N+](=O)[O-])c1 ZINC000123100991 564438079 /nfs/dbraw/zinc/43/80/79/564438079.db2.gz CAMNPGYXMHDNQC-UHFFFAOYSA-N 0 0 375.516 3.180 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ncc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000123107562 564438591 /nfs/dbraw/zinc/43/85/91/564438591.db2.gz KNHZCBQCRGYEMQ-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2csc(Br)c2)cc([N+](=O)[O-])c1 ZINC000041988298 564439156 /nfs/dbraw/zinc/43/91/56/564439156.db2.gz FHDHBBMXOBSYKC-UHFFFAOYSA-N 0 0 399.222 3.135 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000123155271 564440076 /nfs/dbraw/zinc/44/00/76/564440076.db2.gz IVXCQTJWXJQFHB-UHFFFAOYSA-N 0 0 393.197 3.409 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(=O)c1ccc(Br)s1 ZINC000123175867 564441473 /nfs/dbraw/zinc/44/14/73/564441473.db2.gz HKKYPWRFXMUBEC-UHFFFAOYSA-N 0 0 398.238 3.096 20 5 GGBDRN O=C(NCCc1ccc(Cl)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000042078487 564441937 /nfs/dbraw/zinc/44/19/37/564441937.db2.gz RNUCZQNWRLJZRF-UHFFFAOYSA-N 0 0 388.232 3.261 20 5 GGBDRN O=[N+]([O-])c1cccc(OCCSc2nnc(NC[C@@H]3CCCO3)s2)c1 ZINC000042154407 564442694 /nfs/dbraw/zinc/44/26/94/564442694.db2.gz AIRIDHOWEFHVHL-ZDUSSCGKSA-N 0 0 382.467 3.208 20 5 GGBDRN CN(Cc1cc(Br)cs1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000042266989 564444986 /nfs/dbraw/zinc/44/49/86/564444986.db2.gz BAAUHQZJECIEBF-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN CN(Cc1csc(Br)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000042255939 564445087 /nfs/dbraw/zinc/44/50/87/564445087.db2.gz FUXIQMWYAKPPPB-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN C[C@]1(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000123368544 564445914 /nfs/dbraw/zinc/44/59/14/564445914.db2.gz BLSPPTZRKHWGTB-CQSZACIVSA-N 0 0 378.372 3.391 20 5 GGBDRN O=C(/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)N[C@@H]1CCO[C@]2(CCSC2)C1 ZINC000123454658 564448928 /nfs/dbraw/zinc/44/89/28/564448928.db2.gz SECJZWZXXHOKMZ-UBCGMYBRSA-N 0 0 382.869 3.432 20 5 GGBDRN Cc1csc(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000043342140 564457329 /nfs/dbraw/zinc/45/73/29/564457329.db2.gz KJYQPMWSXQQUCK-UHFFFAOYSA-N 0 0 381.845 3.367 20 5 GGBDRN CC[C@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)Cc1cccc(Br)c1 ZINC000123724138 564459082 /nfs/dbraw/zinc/45/90/82/564459082.db2.gz XPHYILJBSHLRDH-NSHDSACASA-N 0 0 395.257 3.090 20 5 GGBDRN 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CCOC(=O)c1cc(C(=O)NCCc2ccc(Cl)s2)cc([N+](=O)[O-])c1 ZINC000044810373 564473371 /nfs/dbraw/zinc/47/33/71/564473371.db2.gz CZEUHDWLWPVDGG-UHFFFAOYSA-N 0 0 382.825 3.459 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1ccc(Br)cc1 ZINC000044899226 564474670 /nfs/dbraw/zinc/47/46/70/564474670.db2.gz XLLJMYQZRUKNRI-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1nc2ccccc2s1 ZINC000044899283 564475461 /nfs/dbraw/zinc/47/54/61/564475461.db2.gz JZOYVZSPRFWZHY-UHFFFAOYSA-N 0 0 377.447 3.334 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(CC(F)(F)F)[C@@H](C)C2)c1 ZINC000124480022 564483614 /nfs/dbraw/zinc/48/36/14/564483614.db2.gz BGIDWFUGYNDMIM-JTQLQIEISA-N 0 0 377.388 3.025 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(CC(F)(F)F)[C@H](C)C2)c1 ZINC000124479816 564483771 /nfs/dbraw/zinc/48/37/71/564483771.db2.gz BGIDWFUGYNDMIM-SNVBAGLBSA-N 0 0 377.388 3.025 20 5 GGBDRN O=C(NCc1ccc(Br)s1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000045456803 564484130 /nfs/dbraw/zinc/48/41/30/564484130.db2.gz XRQQJDXALUWILZ-UHFFFAOYSA-N 0 0 381.211 3.225 20 5 GGBDRN O=C(NCc1cc(Br)ccc1F)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000045399714 564484315 /nfs/dbraw/zinc/48/43/15/564484315.db2.gz PGDWFTPPVYMLAP-UHFFFAOYSA-N 0 0 393.172 3.303 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)Cc1cc(Cl)ccc1F)CC2 ZINC000124598302 564487491 /nfs/dbraw/zinc/48/74/91/564487491.db2.gz NQKKVILZZHEBFU-UHFFFAOYSA-N 0 0 384.816 3.275 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCCSc2ccc(F)cc2)cc1 ZINC000045797387 564489649 /nfs/dbraw/zinc/48/96/49/564489649.db2.gz SKTDODUXPFPGJM-UHFFFAOYSA-N 0 0 384.454 3.336 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccc(Br)s3)CC2)cn1 ZINC000045910051 564491179 /nfs/dbraw/zinc/49/11/79/564491179.db2.gz XAWISYJTBGKONV-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)Cc2cc(Cl)c3c(c2)OCCO3)c1 ZINC000046110589 564495679 /nfs/dbraw/zinc/49/56/79/564495679.db2.gz MZRMMSSWIUDLHU-UHFFFAOYSA-N 0 0 383.809 3.134 20 5 GGBDRN CN(Cc1ccc(Br)s1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000046161547 564497066 /nfs/dbraw/zinc/49/70/66/564497066.db2.gz DWYYHNADGYAFII-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN COCCC1(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC000124982904 564499170 /nfs/dbraw/zinc/49/91/70/564499170.db2.gz ZTAPPLJRDNVMAQ-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN CCS(=O)(=O)c1ccccc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000046288626 564500624 /nfs/dbraw/zinc/50/06/24/564500624.db2.gz FRBFWYNPTPDISC-UHFFFAOYSA-N 0 0 380.447 3.119 20 5 GGBDRN Cc1c(I)cccc1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000125053467 564501970 /nfs/dbraw/zinc/50/19/70/564501970.db2.gz QWSOYIRPQDZGDG-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(Cl)s1 ZINC000046388580 564502922 /nfs/dbraw/zinc/50/29/22/564502922.db2.gz ZPPIMYGPDHJQGZ-VHSXEESVSA-N 0 0 381.841 3.305 20 5 GGBDRN Cc1nccn1CCCCNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000125138916 564504960 /nfs/dbraw/zinc/50/49/60/564504960.db2.gz WZEXFEUANNKLBX-UHFFFAOYSA-N 0 0 395.257 3.381 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000046646159 564505321 /nfs/dbraw/zinc/50/53/21/564505321.db2.gz GHWUYXAKLRHJID-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000046737331 564506263 /nfs/dbraw/zinc/50/62/63/564506263.db2.gz SUEIZCHLQDFZRE-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2cc([N+](=O)[O-])ccc2OC)c1 ZINC000046736949 564506272 /nfs/dbraw/zinc/50/62/72/564506272.db2.gz KGFSQFYYKWDKSX-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCO[C@@H](c2ccccc2)C1 ZINC000125221469 564507471 /nfs/dbraw/zinc/50/74/71/564507471.db2.gz COSYQDSCNSTHJI-OAHLLOKOSA-N 0 0 382.825 3.010 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc(Br)cc1 ZINC000046801104 564508027 /nfs/dbraw/zinc/50/80/27/564508027.db2.gz NEDNNUDHNKWRQS-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CNC(=O)c1csc([N+](=O)[O-])c1 ZINC000046891149 564509804 /nfs/dbraw/zinc/50/98/04/564509804.db2.gz NQIDUPMDXOZVEE-UHFFFAOYSA-N 0 0 398.238 3.096 20 5 GGBDRN O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000046954438 564510790 /nfs/dbraw/zinc/51/07/90/564510790.db2.gz PRCLHWAFZQWWIV-VIFPVBQESA-N 0 0 380.754 3.254 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc3oc(=O)[nH]c3c2)cc1[N+](=O)[O-] ZINC000125340023 564511332 /nfs/dbraw/zinc/51/13/32/564511332.db2.gz VSWOUVFBQYNWAK-UHFFFAOYSA-N 0 0 392.165 3.353 20 5 GGBDRN CN(C)c1cccc(CN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000125531134 564517564 /nfs/dbraw/zinc/51/75/64/564517564.db2.gz XOUOWGURMAVIDX-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN CN(C)c1cccc(CN(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000125554985 564518725 /nfs/dbraw/zinc/51/87/25/564518725.db2.gz WGDNTELINILOSD-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cccc(Cl)c1Cl ZINC000047340115 564519251 /nfs/dbraw/zinc/51/92/51/564519251.db2.gz RJTCFIMPJSMHLO-UHFFFAOYSA-N 0 0 382.159 3.448 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1ccc(F)c(Br)c1 ZINC000047368454 564519288 /nfs/dbraw/zinc/51/92/88/564519288.db2.gz QYWJICPIISACAP-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000125623773 564520949 /nfs/dbraw/zinc/52/09/49/564520949.db2.gz XWNPVVWPJPPEJY-VIFPVBQESA-N 0 0 397.503 3.484 20 5 GGBDRN O=C(Nc1ccccc1O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000125679358 564522293 /nfs/dbraw/zinc/52/22/93/564522293.db2.gz YIKFIPRJDOWGEL-UHFFFAOYSA-N 0 0 384.129 3.157 20 5 GGBDRN Cn1ccnc1-c1csc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000125751135 564525687 /nfs/dbraw/zinc/52/56/87/564525687.db2.gz IJDXBRZHNKPLDJ-UHFFFAOYSA-N 0 0 377.813 3.286 20 5 GGBDRN C[C@@H](Oc1cccc(Br)c1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125823460 564528154 /nfs/dbraw/zinc/52/81/54/564528154.db2.gz JVCHCFVHJQPVJP-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN O=C(Nc1ccc(-c2nc[nH]n2)cc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000125973275 564532961 /nfs/dbraw/zinc/53/29/61/564532961.db2.gz QYEQYLANPBVBNB-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN O=C(COc1ccc(Br)cc1F)NCCc1cccc([N+](=O)[O-])c1 ZINC000126026612 564533963 /nfs/dbraw/zinc/53/39/63/564533963.db2.gz CJUXTOODIPCLEZ-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN O=C(c1ccc(Br)cc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048306113 564536474 /nfs/dbraw/zinc/53/64/74/564536474.db2.gz XTUIIQFVQKCXGC-UHFFFAOYSA-N 0 0 390.237 3.320 20 5 GGBDRN CN(Cc1cc(Br)cs1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000048327663 564536618 /nfs/dbraw/zinc/53/66/18/564536618.db2.gz HRXQARBZUABIQU-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1sccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000048445467 564540141 /nfs/dbraw/zinc/54/01/41/564540141.db2.gz SIGZYYHNEMSXAQ-MRVPVSSYSA-N 0 0 391.268 3.458 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cccc(I)c1 ZINC000048442565 564540459 /nfs/dbraw/zinc/54/04/59/564540459.db2.gz MDLNKUOJOMGPPC-UHFFFAOYSA-N 0 0 382.157 3.129 20 5 GGBDRN Cc1noc(C)c1CN(C)c1ccc(I)cc1[N+](=O)[O-] ZINC000048558813 564542553 /nfs/dbraw/zinc/54/25/53/564542553.db2.gz RLTLEATUCWVSPE-UHFFFAOYSA-N 0 0 387.177 3.441 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000048652747 564543659 /nfs/dbraw/zinc/54/36/59/564543659.db2.gz XIUIYHFOAZJMKO-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1c(CS(=O)(=O)CC(=O)Nc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000048718203 564544439 /nfs/dbraw/zinc/54/44/39/564544439.db2.gz YWVWLECZOGRIHU-UHFFFAOYSA-N 0 0 382.825 3.110 20 5 GGBDRN Cc1c(CS(=O)(=O)CC(=O)Nc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000048717670 564544658 /nfs/dbraw/zinc/54/46/58/564544658.db2.gz HPMWOANWFNCARN-UHFFFAOYSA-N 0 0 382.825 3.110 20 5 GGBDRN CC[C@@H](C)Oc1cc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)ccn1 ZINC000126305740 564544716 /nfs/dbraw/zinc/54/47/16/564544716.db2.gz DCCIUYGZUTZFJF-SNVBAGLBSA-N 0 0 385.467 3.016 20 5 GGBDRN CN(CCOc1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000126339507 564546051 /nfs/dbraw/zinc/54/60/51/564546051.db2.gz CALXSUBDPRWIHY-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CCO1 ZINC000126411437 564548146 /nfs/dbraw/zinc/54/81/46/564548146.db2.gz HGJINZLSTVTHNT-GXTWGEPZSA-N 0 0 376.500 3.227 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2csc(N(C)C)n2)cc1[N+](=O)[O-] ZINC000126436739 564549207 /nfs/dbraw/zinc/54/92/07/564549207.db2.gz YVMXFNTUTOKRQH-UHFFFAOYSA-N 0 0 399.270 3.118 20 5 GGBDRN O=C(NCCSc1ccc(Cl)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000049132820 564549640 /nfs/dbraw/zinc/54/96/40/564549640.db2.gz QRAZXYXELPBTBL-UHFFFAOYSA-N 0 0 379.825 3.095 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC000126567690 564553242 /nfs/dbraw/zinc/55/32/42/564553242.db2.gz QJYMZZOHWJKKDV-OAHLLOKOSA-N 0 0 382.825 3.010 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NCc1cc(F)ccc1Br ZINC000050120834 564556610 /nfs/dbraw/zinc/55/66/10/564556610.db2.gz LAVDPXMXHGHEBR-UHFFFAOYSA-N 0 0 382.189 3.496 20 5 GGBDRN Cc1ccc(C(=O)NC2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)s1 ZINC000050475438 564557983 /nfs/dbraw/zinc/55/79/83/564557983.db2.gz WXJUFWSXADBILW-UHFFFAOYSA-N 0 0 379.463 3.061 20 5 GGBDRN COc1ccc(I)c(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000050491772 564558758 /nfs/dbraw/zinc/55/87/58/564558758.db2.gz HTGJTCPDKYHVND-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN COc1ccc(I)c(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000050492231 564559313 /nfs/dbraw/zinc/55/93/13/564559313.db2.gz OGSRMVYVXGRWEB-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CC[C@@H](Oc2ccncc2)C1 ZINC000126828290 564563852 /nfs/dbraw/zinc/56/38/52/564563852.db2.gz QTJCASSVRNCSGX-CYBMUJFWSA-N 0 0 392.209 3.046 20 5 GGBDRN COc1ccc(CNc2ccc(I)cc2[N+](=O)[O-])cn1 ZINC000051593561 564565726 /nfs/dbraw/zinc/56/57/26/564565726.db2.gz YXSMCBGDHDTEMN-UHFFFAOYSA-N 0 0 385.161 3.215 20 5 GGBDRN O=C(Nc1cncc(Br)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000126913329 564567649 /nfs/dbraw/zinc/56/76/49/564567649.db2.gz ULZRFKYHLLBBCE-UHFFFAOYSA-N 0 0 377.198 3.343 20 5 GGBDRN O=C(Nc1cc(Br)ccc1-n1cncn1)c1csc([N+](=O)[O-])c1 ZINC000051987011 564567999 /nfs/dbraw/zinc/56/79/99/564567999.db2.gz SHNKRPBNXVRNTF-UHFFFAOYSA-N 0 0 394.210 3.252 20 5 GGBDRN O=C(Nc1cc(Br)ccc1-n1cncn1)c1ccccc1[N+](=O)[O-] ZINC000051987356 564568388 /nfs/dbraw/zinc/56/83/88/564568388.db2.gz PDJDRLVUAUAAIO-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000126964373 564568595 /nfs/dbraw/zinc/56/85/95/564568595.db2.gz LZZVIUNIHLGVON-UHFFFAOYSA-N 0 0 395.213 3.227 20 5 GGBDRN CN(Cc1cc(Cl)cc(Cl)c1)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000052447063 564572299 /nfs/dbraw/zinc/57/22/99/564572299.db2.gz VMMYPIODSYWAQW-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN CN(Cc1cc(Cl)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1S(N)(=O)=O ZINC000052447065 564572505 /nfs/dbraw/zinc/57/25/05/564572505.db2.gz ZSLNNTUCVOBQED-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCO[C@H](c3ccco3)C2)cc1[N+](=O)[O-] ZINC000127100702 564573086 /nfs/dbraw/zinc/57/30/86/564573086.db2.gz GTACDMBPZPJZRQ-HNNXBMFYSA-N 0 0 395.209 3.472 20 5 GGBDRN CN(Cc1cc(Cl)cn1C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000127089738 564573443 /nfs/dbraw/zinc/57/34/43/564573443.db2.gz SOHCLYAYNWYJKS-UHFFFAOYSA-N 0 0 378.237 3.061 20 5 GGBDRN NC(=O)c1ccc(NCCc2ccc(F)c(Br)c2)c([N+](=O)[O-])c1 ZINC000052510697 564573580 /nfs/dbraw/zinc/57/35/80/564573580.db2.gz SVIDGNHLVBYLJW-UHFFFAOYSA-N 0 0 382.189 3.250 20 5 GGBDRN CSc1nsc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000127129082 564574323 /nfs/dbraw/zinc/57/43/23/564574323.db2.gz UZXBFRNFAUCSMG-UHFFFAOYSA-N 0 0 379.467 3.023 20 5 GGBDRN CN(CCNc1ncc([N+](=O)[O-])cc1Cl)c1ncc([N+](=O)[O-])cc1Cl ZINC000127156038 564575288 /nfs/dbraw/zinc/57/52/88/564575288.db2.gz FSDOJNDGHYUBMS-UHFFFAOYSA-N 0 0 387.183 3.148 20 5 GGBDRN O=[N+]([O-])c1c(N2CCN(Cc3cccc(Cl)c3)CC2)nc2sccn21 ZINC000052713081 564576129 /nfs/dbraw/zinc/57/61/29/564576129.db2.gz DLYUTRXTSXBIMH-UHFFFAOYSA-N 0 0 377.857 3.280 20 5 GGBDRN C[C@@H](Sc1nnc(N2CCCC2)s1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000052911648 564578452 /nfs/dbraw/zinc/57/84/52/564578452.db2.gz GEDJORVPQUYMHQ-SNVBAGLBSA-N 0 0 379.467 3.166 20 5 GGBDRN O=C(CCOc1ccccc1Br)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053218992 564583170 /nfs/dbraw/zinc/58/31/70/564583170.db2.gz GEGAAIXGKIUKLI-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN CC(C)c1ccccc1NC(=O)Cn1cc([N+](=O)[O-])cc(Br)c1=O ZINC000127575254 564588751 /nfs/dbraw/zinc/58/87/51/564588751.db2.gz JIPFQECHNJLXNP-UHFFFAOYSA-N 0 0 394.225 3.281 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1CCCOCCc1ccccc1 ZINC000127592114 564588912 /nfs/dbraw/zinc/58/89/12/564588912.db2.gz MDCYCVBHMOSWNO-UHFFFAOYSA-N 0 0 381.226 3.168 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ccccc1OC(F)F ZINC000127580560 564589099 /nfs/dbraw/zinc/58/90/99/564589099.db2.gz IBBZRAMBLOAEQL-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1coc(-c2cccs2)n1 ZINC000127597989 564589855 /nfs/dbraw/zinc/58/98/55/564589855.db2.gz MRKHMPCQMHSURO-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN CNC(=O)c1ccc(N(C)Cc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000053549357 564590399 /nfs/dbraw/zinc/59/03/99/564590399.db2.gz YDPWMZSKADNRDH-UHFFFAOYSA-N 0 0 378.226 3.353 20 5 GGBDRN CNC(=O)c1ccc(N(C)Cc2ccc(Br)s2)c([N+](=O)[O-])c1 ZINC000053551467 564590426 /nfs/dbraw/zinc/59/04/26/564590426.db2.gz PLTLGHOXYOGVHR-UHFFFAOYSA-N 0 0 384.255 3.415 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)cc1[N+](=O)[O-] ZINC000127643070 564590422 /nfs/dbraw/zinc/59/04/22/564590422.db2.gz WNDCGPRVDMBQGT-KYOSRNDESA-N 0 0 383.242 3.353 20 5 GGBDRN CNC(=O)c1ccc(N(C)Cc2cc(Br)cs2)c([N+](=O)[O-])c1 ZINC000053572309 564590997 /nfs/dbraw/zinc/59/09/97/564590997.db2.gz CLSSSUZXGUQDAG-UHFFFAOYSA-N 0 0 384.255 3.415 20 5 GGBDRN COc1cccc(C2(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000127702882 564592261 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Cc1nn(C)c(NC[C@@H]2CCN(c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000054125306 564599906 /nfs/dbraw/zinc/59/99/06/564599906.db2.gz NIPHIJKHYMBIAC-LBPRGKRZSA-N 0 0 394.273 3.338 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NCc1ccc(F)cc1Br ZINC000054754865 564607932 /nfs/dbraw/zinc/60/79/32/564607932.db2.gz XLNZKXSQDYQSCG-UHFFFAOYSA-N 0 0 382.189 3.496 20 5 GGBDRN CC(C)(CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)c1ccc(Cl)cc1 ZINC000054837797 564610843 /nfs/dbraw/zinc/61/08/43/564610843.db2.gz LVRNHOOAUNAAQG-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN O=c1c2cccc(Br)c2ncn1CCOc1cccc([N+](=O)[O-])c1 ZINC000128229276 564611774 /nfs/dbraw/zinc/61/17/74/564611774.db2.gz DPOFBMFMGPHGMF-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000054900232 564612099 /nfs/dbraw/zinc/61/20/99/564612099.db2.gz JCTSGVVFYKMTHS-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN Cc1ccc(CN(C(=O)Cn2cc(Br)c([N+](=O)[O-])n2)C2CC2)cc1 ZINC000054917587 564612390 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O=C(COc1ccc([N+](=O)[O-])cc1)N1CCc2c(Br)cccc2C1 ZINC000128694431 564626551 /nfs/dbraw/zinc/62/65/51/564626551.db2.gz WOQZUTZXBNFJAX-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OC(F)F)c(F)c1 ZINC000055638333 564627351 /nfs/dbraw/zinc/62/73/51/564627351.db2.gz YLCVWRKEMNDDOL-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN CC(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c1 ZINC000055676560 564629177 /nfs/dbraw/zinc/62/91/77/564629177.db2.gz FBLPPPIOQZHUKS-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN CC(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000055676895 564629470 /nfs/dbraw/zinc/62/94/70/564629470.db2.gz OIAYZDCCHGLZOM-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN O=C(CCOc1ccccc1Br)NCc1ccc([N+](=O)[O-])cc1 ZINC000055798894 564631778 /nfs/dbraw/zinc/63/17/78/564631778.db2.gz BHUQWPKDIQCDLF-UHFFFAOYSA-N 0 0 379.210 3.443 20 5 GGBDRN O=C(CCOc1cccc(Br)c1)NCc1ccc([N+](=O)[O-])cc1 ZINC000055796789 564631935 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COc1ccc([C@@H]2CCCN2c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000129087792 564637706 /nfs/dbraw/zinc/63/77/06/564637706.db2.gz CACLTDRRTLYQLA-ZDUSSCGKSA-N 0 0 382.463 3.410 20 5 GGBDRN COc1ccc(CN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000129093651 564637810 /nfs/dbraw/zinc/63/78/10/564637810.db2.gz DCLLFHBLTZKBCC-UHFFFAOYSA-N 0 0 382.463 3.237 20 5 GGBDRN CN(Cc1nc2ccccc2s1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000129094623 564638110 /nfs/dbraw/zinc/63/81/10/564638110.db2.gz JLQSMUZYOPKUAU-UHFFFAOYSA-N 0 0 383.476 3.306 20 5 GGBDRN COCc1cccc(CNS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1 ZINC000056067030 564639802 /nfs/dbraw/zinc/63/98/02/564639802.db2.gz FIAGRGUNDMPJME-UHFFFAOYSA-N 0 0 384.841 3.182 20 5 GGBDRN Cc1ccc(Br)cc1S(=O)(=O)NCc1ccccc1[N+](=O)[O-] ZINC000056088642 564640440 /nfs/dbraw/zinc/64/04/40/564640440.db2.gz JWVUMUNSHNERJM-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000056108768 564641054 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COc1ccc(Br)c(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000057004052 564656039 /nfs/dbraw/zinc/65/60/39/564656039.db2.gz UUHUBPDDLGRYNZ-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCOc3c(Cl)cccc32)c(F)c1 ZINC000057010761 564657420 /nfs/dbraw/zinc/65/74/20/564657420.db2.gz PFWQVKDRIOYSQD-ZDUSSCGKSA-N 0 0 386.788 3.189 20 5 GGBDRN O=C(NC[C@H]1CCN(c2cccc(Br)c2)C1)c1ccc([N+](=O)[O-])o1 ZINC000057055991 564658752 /nfs/dbraw/zinc/65/87/52/564658752.db2.gz NWWWUINKVHYIQN-LLVKDONJSA-N 0 0 394.225 3.207 20 5 GGBDRN O=C(NC[C@@H]1CCN(c2cccc(Br)c2)C1)c1ccc([N+](=O)[O-])o1 ZINC000057055994 564659009 /nfs/dbraw/zinc/65/90/09/564659009.db2.gz NWWWUINKVHYIQN-NSHDSACASA-N 0 0 394.225 3.207 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000057084636 564659945 /nfs/dbraw/zinc/65/99/45/564659945.db2.gz KQPSZCMLMSRPRJ-MRXNPFEDSA-N 0 0 376.825 3.412 20 5 GGBDRN CCOc1cc(Br)ccc1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000129803998 564661023 /nfs/dbraw/zinc/66/10/23/564661023.db2.gz UUMOZHRPDJRSNE-UHFFFAOYSA-N 0 0 394.225 3.467 20 5 GGBDRN Cc1nn(C)c(N2CCc3[nH]c4c(cccc4Br)c3C2)c1[N+](=O)[O-] ZINC000057147572 564661445 /nfs/dbraw/zinc/66/14/45/564661445.db2.gz JMFSHMIUUOUNMZ-UHFFFAOYSA-N 0 0 390.241 3.443 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2c(c(Br)c1)OCO2 ZINC000057228138 564663568 /nfs/dbraw/zinc/66/35/68/564663568.db2.gz DGRLNXFCPCLZAG-UHFFFAOYSA-N 0 0 395.165 3.347 20 5 GGBDRN Cc1ccn(CC(=O)N[C@H](C)c2ccc(Cl)c(Cl)c2)c(=O)c1[N+](=O)[O-] ZINC000129896986 564664034 /nfs/dbraw/zinc/66/40/34/564664034.db2.gz DKFADXPMJSYJNM-SNVBAGLBSA-N 0 0 384.219 3.249 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1nc(-c2ccc(F)c(Cl)c2)cs1 ZINC000057361520 564666080 /nfs/dbraw/zinc/66/60/80/564666080.db2.gz HHDPNTPDQWFEAQ-UHFFFAOYSA-N 0 0 381.776 3.346 20 5 GGBDRN CN(CC(=O)Nc1ccccc1Br)Cc1ccc([N+](=O)[O-])cc1 ZINC000057455960 564667944 /nfs/dbraw/zinc/66/79/44/564667944.db2.gz JQSKPYQAWJJUOW-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCc1csc(C(C)(C)C)n1 ZINC000130136052 564670590 /nfs/dbraw/zinc/67/05/90/564670590.db2.gz KMADJSDPOASROJ-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000130145847 564670877 /nfs/dbraw/zinc/67/08/77/564670877.db2.gz VWMHDZVJUYVMHD-UHFFFAOYSA-N 0 0 395.257 3.146 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000130245777 564674506 /nfs/dbraw/zinc/67/45/06/564674506.db2.gz ULPMTIMBOIYPDU-QMMMGPOBSA-N 0 0 382.214 3.323 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000057792620 564674473 /nfs/dbraw/zinc/67/44/73/564674473.db2.gz YRCGCOZWVYTRRL-UHFFFAOYSA-N 0 0 376.722 3.279 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c(Cl)c1 ZINC000057785522 564674711 /nfs/dbraw/zinc/67/47/11/564674711.db2.gz ACPCCNFPRVTVPD-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc(C(N)=O)c(F)c2)cc1[N+](=O)[O-] ZINC000130310242 564675990 /nfs/dbraw/zinc/67/59/90/564675990.db2.gz GIINWZHPVLNJIU-UHFFFAOYSA-N 0 0 396.172 3.156 20 5 GGBDRN O=[N+]([O-])c1ccc(NCC2CCN(S(=O)(=O)c3ccccc3)CC2)s1 ZINC000057856496 564676265 /nfs/dbraw/zinc/67/62/65/564676265.db2.gz RJNKKTPMRWBHBI-UHFFFAOYSA-N 0 0 381.479 3.169 20 5 GGBDRN COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000130324839 564677171 /nfs/dbraw/zinc/67/71/71/564677171.db2.gz YBDXGLYHQZKDFC-NSHDSACASA-N 0 0 395.213 3.066 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1CCCS1 ZINC000130388068 564679006 /nfs/dbraw/zinc/67/90/06/564679006.db2.gz MXEISCANVQHNRX-NSHDSACASA-N 0 0 377.388 3.427 20 5 GGBDRN C[C@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1cnn(C)c1C(F)(F)F ZINC000130439676 564681157 /nfs/dbraw/zinc/68/11/57/564681157.db2.gz DFJAYCKRRWKTBU-SECBINFHSA-N 0 0 377.344 3.023 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000058300388 564682277 /nfs/dbraw/zinc/68/22/77/564682277.db2.gz PVKHBDHBXGOCSW-LBPRGKRZSA-N 0 0 399.222 3.063 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2sccc2Br)cc1[N+](=O)[O-] ZINC000058510900 564685120 /nfs/dbraw/zinc/68/51/20/564685120.db2.gz GFTWACCZLVWFMF-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1sccc1Br ZINC000058510788 564685674 /nfs/dbraw/zinc/68/56/74/564685674.db2.gz PYNPQGIHTYEBBF-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1cc(F)ccc1Br ZINC000130606238 564686812 /nfs/dbraw/zinc/68/68/12/564686812.db2.gz ZIFUTXAAOBYJNF-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1cc(Br)ccc1F ZINC000130646622 564688402 /nfs/dbraw/zinc/68/84/02/564688402.db2.gz WMOYGMSUHOCYOM-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1cc(F)cc(Br)c1 ZINC000130688246 564688840 /nfs/dbraw/zinc/68/88/40/564688840.db2.gz HGPQTDMHRLHPMI-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN CC1(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCOCC1 ZINC000130694776 564689820 /nfs/dbraw/zinc/68/98/20/564689820.db2.gz SDJRCWQRRMMIIZ-UHFFFAOYSA-N 0 0 378.372 3.391 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1OCc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000130715759 564690029 /nfs/dbraw/zinc/69/00/29/564690029.db2.gz ANKBEKKLFABTLQ-UHFFFAOYSA-N 0 0 386.813 3.205 20 5 GGBDRN Cc1ccc(CSCCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000130726784 564690941 /nfs/dbraw/zinc/69/09/41/564690941.db2.gz OQZDHKLKDMEEDE-UHFFFAOYSA-N 0 0 380.491 3.256 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)c([N+](=O)[O-])c1 ZINC000130768875 564691899 /nfs/dbraw/zinc/69/18/99/564691899.db2.gz IKSIFSGSERERBD-DOMZBBRYSA-N 0 0 382.463 3.115 20 5 GGBDRN O=[N+]([O-])c1cccc(OCCn2nnc(-c3ccc(Br)cc3)n2)c1 ZINC000059017258 564692887 /nfs/dbraw/zinc/69/28/87/564692887.db2.gz HVWXAWIGEGIYLE-UHFFFAOYSA-N 0 0 390.197 3.090 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000130808882 564692858 /nfs/dbraw/zinc/69/28/58/564692858.db2.gz RBCYOCVCCBUTJX-WFASDCNBSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1c(C(=O)NCCOc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000059851660 564693913 /nfs/dbraw/zinc/69/39/13/564693913.db2.gz KHGOSTKYLKKNDP-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN O=C(CCNC(=O)c1ccccc1[N+](=O)[O-])Nc1ccc(Br)cc1 ZINC000059888042 564693958 /nfs/dbraw/zinc/69/39/58/564693958.db2.gz DIHCDMRIHMHAFM-UHFFFAOYSA-N 0 0 392.209 3.116 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(I)cc2)c1 ZINC000060063688 564694382 /nfs/dbraw/zinc/69/43/82/564694382.db2.gz BJYXMHJBCPHHBD-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN CNS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 ZINC000060031401 564694588 /nfs/dbraw/zinc/69/45/88/564694588.db2.gz WLBCKCXJIUXCKI-UHFFFAOYSA-N 0 0 395.384 3.195 20 5 GGBDRN O=c1ccn(Cc2ncc(-c3ccccc3Br)o2)cc1[N+](=O)[O-] ZINC000130918032 564695950 /nfs/dbraw/zinc/69/59/50/564695950.db2.gz CJTAMFBFEMXBQN-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(CCO)Cc2cc(Br)ccc2F)c1 ZINC000060381446 564697628 /nfs/dbraw/zinc/69/76/28/564697628.db2.gz NDPGTQCXEVMXLA-UHFFFAOYSA-N 0 0 383.217 3.491 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000131040836 564699343 /nfs/dbraw/zinc/69/93/43/564699343.db2.gz RLXUJIKNAPFRIZ-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2nc3ccccc3s2)cc1C ZINC000060497332 564699356 /nfs/dbraw/zinc/69/93/56/564699356.db2.gz BKOBAEIUIWOBHZ-UHFFFAOYSA-N 0 0 377.447 3.300 20 5 GGBDRN O=C(Nc1nccs1)c1ccc(C(=O)Nc2nccs2)c([N+](=O)[O-])c1 ZINC000060525919 564699922 /nfs/dbraw/zinc/69/99/22/564699922.db2.gz JXNGHSLHHTXQNP-UHFFFAOYSA-N 0 0 375.391 3.012 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(Cl)cc1Cl ZINC000060526223 564700221 /nfs/dbraw/zinc/70/02/21/564700221.db2.gz RYWJKTQKWXLXJO-UHFFFAOYSA-N 0 0 382.159 3.448 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccccc1Br ZINC000061264029 564704948 /nfs/dbraw/zinc/70/49/48/564704948.db2.gz SKTMJQYYDBEKJX-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN COc1ccccc1CCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000131280260 564707363 /nfs/dbraw/zinc/70/73/63/564707363.db2.gz MIHTXIYLHSWJPD-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NCc1cc(Br)ccc1F ZINC000063069538 564713236 /nfs/dbraw/zinc/71/32/36/564713236.db2.gz RMPKOIZQOYINEN-UHFFFAOYSA-N 0 0 382.189 3.496 20 5 GGBDRN CCc1nc(CN(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000063199497 564715172 /nfs/dbraw/zinc/71/51/72/564715172.db2.gz ZCFDGENQJSBOPA-UHFFFAOYSA-N 0 0 375.859 3.088 20 5 GGBDRN Cc1noc(C2CCN(C(=O)c3ccc(Br)c([N+](=O)[O-])c3)CC2)n1 ZINC000063306657 564715933 /nfs/dbraw/zinc/71/59/33/564715933.db2.gz XVAILJRUMDWSJZ-UHFFFAOYSA-N 0 0 395.213 3.069 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)Nc2cccc(O)c2F)c1 ZINC000131542591 564715975 /nfs/dbraw/zinc/71/59/75/564715975.db2.gz YHCKONIRTMGVJA-UHFFFAOYSA-N 0 0 391.174 3.003 20 5 GGBDRN CS(=O)(=O)c1ccc(OCCCOc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000063283082 564716023 /nfs/dbraw/zinc/71/60/23/564716023.db2.gz OKAKBHKNSFMQNO-UHFFFAOYSA-N 0 0 385.825 3.500 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1O ZINC000131582776 564716828 /nfs/dbraw/zinc/71/68/28/564716828.db2.gz BFUQWNJRVMDCLT-UHFFFAOYSA-N 0 0 398.156 3.466 20 5 GGBDRN Cc1cccc(OCCNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000131598069 564717730 /nfs/dbraw/zinc/71/77/30/564717730.db2.gz WFJUFECRUYBBLB-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1cc(Br)ccc1OC(F)F ZINC000063560466 564718722 /nfs/dbraw/zinc/71/87/22/564718722.db2.gz INDMSXSXNJRHIC-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC([C@H](O)C(F)(F)F)CC2)c1 ZINC000131671280 564719392 /nfs/dbraw/zinc/71/93/92/564719392.db2.gz VKARIHULJKIXCY-ZDUSSCGKSA-N 0 0 378.372 3.092 20 5 GGBDRN COC(=O)c1csc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000131757126 564723525 /nfs/dbraw/zinc/72/35/25/564723525.db2.gz WDSFUAGACZRLIQ-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1cccc(Br)c1 ZINC000063796802 564723558 /nfs/dbraw/zinc/72/35/58/564723558.db2.gz FHGGWXPRINOLGY-UHFFFAOYSA-N 0 0 393.241 3.269 20 5 GGBDRN O=C(CCn1cc(Br)c([N+](=O)[O-])n1)Nc1ccc(Cl)cc1F ZINC000064040028 564726600 /nfs/dbraw/zinc/72/66/00/564726600.db2.gz HWLNHKRDJZUBHL-UHFFFAOYSA-N 0 0 391.584 3.375 20 5 GGBDRN CCc1c[nH]c(Sc2ccc(S(=O)(=O)N(CC)CC)cc2[N+](=O)[O-])n1 ZINC000132030457 564731706 /nfs/dbraw/zinc/73/17/06/564731706.db2.gz YCVJXMPRFWPLAW-UHFFFAOYSA-N 0 0 384.483 3.062 20 5 GGBDRN Cc1ccc(CO)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000132031203 564731893 /nfs/dbraw/zinc/73/18/93/564731893.db2.gz PVINZIKNYGORAK-UHFFFAOYSA-N 0 0 379.210 3.339 20 5 GGBDRN CN(CCC(F)(F)F)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000064635461 564733336 /nfs/dbraw/zinc/73/33/36/564733336.db2.gz HRCVGTASDAWCDZ-UHFFFAOYSA-N 0 0 384.152 3.180 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000064642009 564733904 /nfs/dbraw/zinc/73/39/04/564733904.db2.gz IXJKULJSWADICQ-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nnc(C(F)F)s1 ZINC000064740195 564734220 /nfs/dbraw/zinc/73/42/20/564734220.db2.gz ZEPDNRYWLYPYCV-YFKPBYRVSA-N 0 0 378.744 3.443 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1 ZINC000064953438 564737200 /nfs/dbraw/zinc/73/72/00/564737200.db2.gz WJDMGXJOPMXBFR-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1 ZINC000064953406 564737505 /nfs/dbraw/zinc/73/75/05/564737505.db2.gz NACXSZUUMUTFAH-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2c(Cl)cccc2Cl)cc1 ZINC000064955402 564737643 /nfs/dbraw/zinc/73/76/43/564737643.db2.gz FCNQYNXVLWVDFF-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN CS(=O)(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000132282319 564738368 /nfs/dbraw/zinc/73/83/68/564738368.db2.gz OBOGQIFOJRLTMJ-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Br)c(F)c1 ZINC000132343776 564740271 /nfs/dbraw/zinc/74/02/71/564740271.db2.gz VWWQUJGDARNRLO-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN NC(=O)c1ccc(NCCc2cc(Br)ccc2F)c([N+](=O)[O-])c1 ZINC000065280583 564741840 /nfs/dbraw/zinc/74/18/40/564741840.db2.gz NTWIQTONIODEQX-UHFFFAOYSA-N 0 0 382.189 3.250 20 5 GGBDRN O=C(Cn1cc(Br)c(=O)c([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1 ZINC000132370820 564741849 /nfs/dbraw/zinc/74/18/49/564741849.db2.gz ZHMNZLOVRFEORT-UHFFFAOYSA-N 0 0 389.564 3.194 20 5 GGBDRN O=c1c(Br)cn(Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000132387959 564741921 /nfs/dbraw/zinc/74/19/21/564741921.db2.gz JUXFNZYQYXYOOC-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCc1cc(Br)ccc1F ZINC000065566835 564744388 /nfs/dbraw/zinc/74/43/88/564744388.db2.gz KDUMTCDONRTHQK-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2cc(Br)ccc2F)c1 ZINC000065569194 564744739 /nfs/dbraw/zinc/74/47/39/564744739.db2.gz MSZFBSMIIBZAOO-UHFFFAOYSA-N 0 0 397.200 3.478 20 5 GGBDRN O=c1c(Br)cn(Cc2coc(-c3cccc(F)c3)n2)cc1[N+](=O)[O-] ZINC000132486759 564745139 /nfs/dbraw/zinc/74/51/39/564745139.db2.gz SAPHQLJVEBPIRX-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN CN(CCOc1ccc(Cl)cc1)C(=O)CSc1ncccc1[N+](=O)[O-] ZINC000065693067 564747487 /nfs/dbraw/zinc/74/74/87/564747487.db2.gz BJTIVQVVPPHGMO-UHFFFAOYSA-N 0 0 381.841 3.273 20 5 GGBDRN COc1cc(OC)c(NC(=O)CSc2ncccc2[N+](=O)[O-])cc1Cl ZINC000065692960 564747582 /nfs/dbraw/zinc/74/75/82/564747582.db2.gz JXOXHYAGGZMMHH-UHFFFAOYSA-N 0 0 383.813 3.391 20 5 GGBDRN O=c1c(Br)cn(Cc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000132582466 564747603 /nfs/dbraw/zinc/74/76/03/564747603.db2.gz VQJNNCGEYGTLAK-UHFFFAOYSA-N 0 0 388.015 3.330 20 5 GGBDRN CCc1cccc(C)c1NC(=O)Cn1cc(Br)c(=O)c([N+](=O)[O-])c1 ZINC000132576280 564747657 /nfs/dbraw/zinc/74/76/57/564747657.db2.gz AOUYWXTYWYSGJI-UHFFFAOYSA-N 0 0 394.225 3.029 20 5 GGBDRN Cc1cc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])on1 ZINC000065725722 564748410 /nfs/dbraw/zinc/74/84/10/564748410.db2.gz AKQDOXCZUBLYGW-UHFFFAOYSA-N 0 0 375.328 3.319 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCCN2S(=O)(=O)c1ccccc1Br ZINC000132643667 564748825 /nfs/dbraw/zinc/74/88/25/564748825.db2.gz QVDROOBXBXZABH-UHFFFAOYSA-N 0 0 397.250 3.499 20 5 GGBDRN COc1ccc(C(=O)NCCOc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000065765432 564749044 /nfs/dbraw/zinc/74/90/44/564749044.db2.gz NSYGZYCCKKJRMA-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN O=C(Cn1cc(Br)c(=O)c([N+](=O)[O-])c1)c1ccc(Cl)s1 ZINC000132675464 564749777 /nfs/dbraw/zinc/74/97/77/564749777.db2.gz RBKBBERMZCGDIX-UHFFFAOYSA-N 0 0 377.603 3.117 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1c1cccc(Br)c1 ZINC000065796843 564749972 /nfs/dbraw/zinc/74/99/72/564749972.db2.gz ARXCJPGSKJCVHQ-HNNXBMFYSA-N 0 0 393.241 3.308 20 5 GGBDRN CN(Cc1ccc(Br)cc1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000065857766 564751119 /nfs/dbraw/zinc/75/11/19/564751119.db2.gz KMJCAHVDEAOWGF-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN COc1cc(OCC(=O)NCc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000066020316 564754135 /nfs/dbraw/zinc/75/41/35/564754135.db2.gz WUVNAFRHGCAXPJ-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NCc1nnc(C2CC2)n1C1CC1 ZINC000132867842 564754822 /nfs/dbraw/zinc/75/48/22/564754822.db2.gz CUPUTDTWHJZXMM-UHFFFAOYSA-N 0 0 379.218 3.168 20 5 GGBDRN O=c1c(Br)cn(Cc2ncc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000132860077 564755321 /nfs/dbraw/zinc/75/53/21/564755321.db2.gz GPVFMGMVNJVQET-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(I)cc2)ccc1[N+](=O)[O-] ZINC000132885782 564755805 /nfs/dbraw/zinc/75/58/05/564755805.db2.gz GXUXWWXGKSQTTQ-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN O=c1c(Br)cn(Cc2ncc(-c3ccccc3F)o2)cc1[N+](=O)[O-] ZINC000132888201 564756221 /nfs/dbraw/zinc/75/62/21/564756221.db2.gz IGLJAVROYFLFLA-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN COCCCn1ccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000132964421 564759178 /nfs/dbraw/zinc/75/91/78/564759178.db2.gz SFZGIVIEHABXDI-UHFFFAOYSA-N 0 0 397.229 3.151 20 5 GGBDRN O=C(Nc1cccc(Br)c1)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066265990 564759969 /nfs/dbraw/zinc/75/99/69/564759969.db2.gz VYMJUKLBZRHTHS-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN O=C(NCc1cc(Br)cs1)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066316115 564762264 /nfs/dbraw/zinc/76/22/64/564762264.db2.gz OULMXJPPVNQCBS-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN CCOc1ccc([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])s2)cc1OC ZINC000066327741 564762622 /nfs/dbraw/zinc/76/26/22/564762622.db2.gz HZMLMIHYCBSHJK-SNVBAGLBSA-N 0 0 386.451 3.103 20 5 GGBDRN O=C(NCc1sccc1Br)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066354122 564763910 /nfs/dbraw/zinc/76/39/10/564763910.db2.gz IXSFEHJROWPMOA-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccccc1I ZINC000133160765 564764882 /nfs/dbraw/zinc/76/48/82/564764882.db2.gz JAXLESJAUUDYMR-UHFFFAOYSA-N 0 0 396.184 3.172 20 5 GGBDRN CSCc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000066550584 564769021 /nfs/dbraw/zinc/76/90/21/564769021.db2.gz CIJVLVKOAVHUTB-UHFFFAOYSA-N 0 0 380.447 3.114 20 5 GGBDRN CCN(Cc1ccoc1)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000066577441 564769302 /nfs/dbraw/zinc/76/93/02/564769302.db2.gz NZEFFAXHVATCCM-UHFFFAOYSA-N 0 0 389.227 3.161 20 5 GGBDRN C[C@@H](c1ccco1)N(C)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000066576730 564769496 /nfs/dbraw/zinc/76/94/96/564769496.db2.gz DGWLDAGVNFKWOP-VIFPVBQESA-N 0 0 389.227 3.332 20 5 GGBDRN CCN(C1CCCC1)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000066575851 564769550 /nfs/dbraw/zinc/76/95/50/564769550.db2.gz JCRCNDLSBSISFF-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC[C@H]3CO)cc2[N+](=O)[O-])n1 ZINC000133328081 564770178 /nfs/dbraw/zinc/77/01/78/564770178.db2.gz LUCMXNUSOYVVPB-LBPRGKRZSA-N 0 0 379.463 3.108 20 5 GGBDRN CSC[C@@H]1CCCN1c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000133338545 564771065 /nfs/dbraw/zinc/77/10/65/564771065.db2.gz RXCOIKPDNVTZGE-VIFPVBQESA-N 0 0 384.401 3.220 20 5 GGBDRN CSC[C@H]1CCCN1c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000133338754 564771136 /nfs/dbraw/zinc/77/11/36/564771136.db2.gz RXCOIKPDNVTZGE-SECBINFHSA-N 0 0 384.401 3.220 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1ccc(Br)cc1 ZINC000133374249 564772107 /nfs/dbraw/zinc/77/21/07/564772107.db2.gz DRKBIDYWZQFJSJ-UHFFFAOYSA-N 0 0 385.239 3.342 20 5 GGBDRN CC(C)n1c(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n[nH]c1=S ZINC000066649981 564772233 /nfs/dbraw/zinc/77/22/33/564772233.db2.gz FXGBRYSDAJANOA-SNVBAGLBSA-N 0 0 381.483 3.227 20 5 GGBDRN Nc1c(C(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000133406983 564772979 /nfs/dbraw/zinc/77/29/79/564772979.db2.gz MKOCAQKGOUYNFQ-UHFFFAOYSA-N 0 0 384.219 3.119 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCC2(c3ccc(Cl)cc3)CC2)cc1 ZINC000066937279 564779382 /nfs/dbraw/zinc/77/93/82/564779382.db2.gz SLGKEUFAWJCNPG-UHFFFAOYSA-N 0 0 380.853 3.399 20 5 GGBDRN Cc1nc(NC(=O)[C@H](C)Oc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000133635913 564780851 /nfs/dbraw/zinc/78/08/51/564780851.db2.gz CAYWGNPQHAYEAF-JTQLQIEISA-N 0 0 380.198 3.467 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCSc2nnc(NC[C@@H]3CCCO3)s2)cc1 ZINC000067006855 564781068 /nfs/dbraw/zinc/78/10/68/564781068.db2.gz IUPPTFWNHFNDAA-ZDUSSCGKSA-N 0 0 382.467 3.208 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2ccccc2CO)cc1[N+](=O)[O-] ZINC000133633833 564781480 /nfs/dbraw/zinc/78/14/80/564781480.db2.gz NUJCOIWRPQXFHL-UHFFFAOYSA-N 0 0 379.210 3.088 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000133665707 564781920 /nfs/dbraw/zinc/78/19/20/564781920.db2.gz GVJREZRSFXRMDO-UHFFFAOYSA-N 0 0 383.231 3.465 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1Br)NC(=O)Nc1ccccc1 ZINC000133680141 564781971 /nfs/dbraw/zinc/78/19/71/564781971.db2.gz RFCDMRCSJJDUAR-UHFFFAOYSA-N 0 0 394.181 3.084 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2noc(C3CCOCC3)n2)c(Br)c1 ZINC000133689184 564782114 /nfs/dbraw/zinc/78/21/14/564782114.db2.gz HNBJVKXMNNBBOO-UHFFFAOYSA-N 0 0 384.186 3.213 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1Br)N1CCc2ccccc2C1 ZINC000133683067 564782176 /nfs/dbraw/zinc/78/21/76/564782176.db2.gz OQSMFEFXHVCZER-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000133695443 564782971 /nfs/dbraw/zinc/78/29/71/564782971.db2.gz MKNLNCCQUWPSEZ-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN O=C(COc1ccc(Br)cc1F)NCc1cccc([N+](=O)[O-])c1 ZINC000067072207 564783253 /nfs/dbraw/zinc/78/32/53/564783253.db2.gz GSCHTDFFQXMCOX-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN Cc1nc(NC(=O)c2cccc(I)c2C)ccc1[N+](=O)[O-] ZINC000133789243 564785250 /nfs/dbraw/zinc/78/52/50/564785250.db2.gz QAGHDPLYXVPXBJ-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN COCCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000133838416 564786827 /nfs/dbraw/zinc/78/68/27/564786827.db2.gz MRSVTLKEXUAZDC-UHFFFAOYSA-N 0 0 396.197 3.030 20 5 GGBDRN O=C(CCOc1cccc(Br)c1)NCc1cccc([N+](=O)[O-])c1 ZINC000067329655 564788710 /nfs/dbraw/zinc/78/87/10/564788710.db2.gz SNHUZRBZZSMBJI-UHFFFAOYSA-N 0 0 379.210 3.443 20 5 GGBDRN CCSc1nnc(S[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000067428199 564792400 /nfs/dbraw/zinc/79/24/00/564792400.db2.gz FZVRHCBRRMPZCF-NSHDSACASA-N 0 0 382.492 3.456 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000067432291 564792484 /nfs/dbraw/zinc/79/24/84/564792484.db2.gz XZBNXWQAJFXDML-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CCSc1nnc(S[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000067428198 564792664 /nfs/dbraw/zinc/79/26/64/564792664.db2.gz FZVRHCBRRMPZCF-LLVKDONJSA-N 0 0 382.492 3.456 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1Cl ZINC000067538719 564795070 /nfs/dbraw/zinc/79/50/70/564795070.db2.gz NHNBJZOHZGEAIF-SNVBAGLBSA-N 0 0 382.825 3.143 20 5 GGBDRN C[C@@H](CC(=O)c1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000134191144 564796473 /nfs/dbraw/zinc/79/64/73/564796473.db2.gz GXBQWISHKSROIC-NSHDSACASA-N 0 0 382.825 3.188 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nnc(-c3ccc(Cl)cc3)s2)c1[N+](=O)[O-] ZINC000134273732 564798319 /nfs/dbraw/zinc/79/83/19/564798319.db2.gz FLVDNYLBVMNLBJ-UHFFFAOYSA-N 0 0 378.801 3.061 20 5 GGBDRN Cc1ccnc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C2CC2)n1 ZINC000134304424 564799148 /nfs/dbraw/zinc/79/91/48/564799148.db2.gz NEUMHNCAWCFEKB-CQSZACIVSA-N 0 0 391.225 3.337 20 5 GGBDRN COc1ccc(CC(=O)NCc2sccc2Br)cc1[N+](=O)[O-] ZINC000067821948 564800014 /nfs/dbraw/zinc/80/00/14/564800014.db2.gz DPBCDFYHZCPUTJ-UHFFFAOYSA-N 0 0 385.239 3.286 20 5 GGBDRN O=C(NC[C@@H](O)COc1cccc(Cl)c1Cl)c1ccccc1[N+](=O)[O-] ZINC000067936106 564802090 /nfs/dbraw/zinc/80/20/90/564802090.db2.gz UYTJCXJICIFHHG-SNVBAGLBSA-N 0 0 385.203 3.071 20 5 GGBDRN COC(=O)c1ccc(Oc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c(Cl)c1 ZINC000067948648 564803926 /nfs/dbraw/zinc/80/39/26/564803926.db2.gz YIYPTMDFJXOGDO-UHFFFAOYSA-N 0 0 385.781 3.231 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000067985259 564804804 /nfs/dbraw/zinc/80/48/04/564804804.db2.gz IFSIGNVEQFXCMI-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN CC(=O)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)nc1C ZINC000134530022 564806443 /nfs/dbraw/zinc/80/64/43/564806443.db2.gz DZVDCCLJNJICCB-UHFFFAOYSA-N 0 0 392.209 3.193 20 5 GGBDRN CC(C)N(CC(F)F)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000134600114 564807974 /nfs/dbraw/zinc/80/79/74/564807974.db2.gz PPPKHZKJNXVJPY-UHFFFAOYSA-N 0 0 387.202 3.022 20 5 GGBDRN O=C(c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)N1CCSCC1 ZINC000134621753 564808802 /nfs/dbraw/zinc/80/88/02/564808802.db2.gz STKPRNZWZFPTKC-UHFFFAOYSA-N 0 0 387.248 3.276 20 5 GGBDRN O=C(NCCOc1ncc(Cl)cc1Cl)NCc1ccc([N+](=O)[O-])cc1 ZINC000134654241 564810569 /nfs/dbraw/zinc/81/05/69/564810569.db2.gz QFWUXBWVHMYQLL-UHFFFAOYSA-N 0 0 385.207 3.175 20 5 GGBDRN O=C(Cc1cccc(Br)c1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068184110 564810787 /nfs/dbraw/zinc/81/07/87/564810787.db2.gz HNQUDQPSLDFFTH-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN COc1ccc(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000068185279 564811083 /nfs/dbraw/zinc/81/10/83/564811083.db2.gz BLSOFTFURJUMFL-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccccc1I ZINC000134749545 564814442 /nfs/dbraw/zinc/81/44/42/564814442.db2.gz DKSXBFVXZXQNML-UHFFFAOYSA-N 0 0 382.157 3.381 20 5 GGBDRN CCCc1n[nH]c(C(=O)N(C)Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000068432604 564817918 /nfs/dbraw/zinc/81/79/18/564817918.db2.gz UOCSKJRGJLRBFW-UHFFFAOYSA-N 0 0 381.230 3.305 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N[C@H]1CCCc2sccc21 ZINC000135055375 564823166 /nfs/dbraw/zinc/82/31/66/564823166.db2.gz OHKOWJOHMKXUBR-LBPRGKRZSA-N 0 0 379.825 3.442 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1Cl ZINC000135188083 564824814 /nfs/dbraw/zinc/82/48/14/564824814.db2.gz AYNSJHWLYLRYJI-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(OCc2nnnn2-c2ccccc2Br)c1 ZINC000135354319 564828863 /nfs/dbraw/zinc/82/88/63/564828863.db2.gz UIIVIESTSNOESA-UHFFFAOYSA-N 0 0 394.160 3.051 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000069122475 564833686 /nfs/dbraw/zinc/83/36/86/564833686.db2.gz 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CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000070751828 564851092 /nfs/dbraw/zinc/85/10/92/564851092.db2.gz COQBERFONSWMFU-GFCCVEGCSA-N 0 0 380.447 3.037 20 5 GGBDRN CCSc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000071019789 564854398 /nfs/dbraw/zinc/85/43/98/564854398.db2.gz CNLULTICISJKRL-UHFFFAOYSA-N 0 0 380.447 3.363 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC(O)(C(F)(F)F)CC2)ccc1Br ZINC000136856784 564855687 /nfs/dbraw/zinc/85/56/87/564855687.db2.gz FNWQRBCVUUXMNM-UHFFFAOYSA-N 0 0 383.164 3.247 20 5 GGBDRN CCCCc1nc(CS(=O)(=O)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cs1 ZINC000137141671 564859740 /nfs/dbraw/zinc/85/97/40/564859740.db2.gz VLCOZHMYUOJWFV-OAHLLOKOSA-N 0 0 384.479 3.042 20 5 GGBDRN CCc1[nH]nc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1Br ZINC000137237292 564860298 /nfs/dbraw/zinc/86/02/98/564860298.db2.gz WNQZADHTVHXBOT-UHFFFAOYSA-N 0 0 392.213 3.305 20 5 GGBDRN Cc1n[nH]c(C(=O)NCC(C)(C)c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000072060270 564861016 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O=[N+]([O-])c1cccc(CN(C2CC2)S(=O)(=O)Cc2ccc(Cl)nc2)c1 ZINC000152748856 564970803 /nfs/dbraw/zinc/97/08/03/564970803.db2.gz ZDRRODDHWAMNDG-UHFFFAOYSA-N 0 0 381.841 3.138 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)c1ccc(Br)cc1 ZINC000105722943 564972995 /nfs/dbraw/zinc/97/29/95/564972995.db2.gz HIPZBDKZHDUMJN-UHFFFAOYSA-N 0 0 386.223 3.340 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)c1ccccc1Br ZINC000105723036 564973335 /nfs/dbraw/zinc/97/33/35/564973335.db2.gz BZEVFBANLHEZIX-UHFFFAOYSA-N 0 0 386.223 3.340 20 5 GGBDRN CC(C)c1cc(Br)ccc1NC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000152840405 564973682 /nfs/dbraw/zinc/97/36/82/564973682.db2.gz DQVGCGJHSFSUHC-UHFFFAOYSA-N 0 0 396.245 3.499 20 5 GGBDRN CN(CCOCc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000152834133 564973816 /nfs/dbraw/zinc/97/38/16/564973816.db2.gz YELIAXIAWDBDDA-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CC[C@H](NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000105742929 564974272 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GGBDRN COc1cc(CSc2nnnn2Cc2cccs2)c([N+](=O)[O-])cc1F ZINC000183845059 565098872 /nfs/dbraw/zinc/09/88/72/565098872.db2.gz CEIYJTMVPGJHDD-UHFFFAOYSA-N 0 0 381.414 3.131 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000292145157 565101271 /nfs/dbraw/zinc/10/12/71/565101271.db2.gz JPKWTWXYMDRPJX-AWEZNQCLSA-N 0 0 380.857 3.146 20 5 GGBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCC[C@@H](Cn2ccnn2)C1 ZINC000292142070 565101379 /nfs/dbraw/zinc/10/13/79/565101379.db2.gz MAOPECHLYHHZRG-SNVBAGLBSA-N 0 0 384.223 3.046 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1ccc(Cl)s1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000369645174 565103451 /nfs/dbraw/zinc/10/34/51/565103451.db2.gz AVGAXPCDRHFLKM-VXGBXAGGSA-N 0 0 380.857 3.473 20 5 GGBDRN O=C(Nc1nc(-c2ccccc2)c(Br)s1)c1n[nH]cc1[N+](=O)[O-] ZINC000156844134 565107426 /nfs/dbraw/zinc/10/74/26/565107426.db2.gz PSIURJMCJLVWNA-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)c1c(Cl)cccc1Cl ZINC000156856936 565108807 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COc1cc(CSCC2(CS(C)(=O)=O)CCC2)c([N+](=O)[O-])cc1F ZINC000184050159 565112039 /nfs/dbraw/zinc/11/20/39/565112039.db2.gz JBNZAQVGIDAQDV-UHFFFAOYSA-N 0 0 377.459 3.191 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)C[C@@H]1Cc2ccccc2O1 ZINC000156917508 565112218 /nfs/dbraw/zinc/11/22/18/565112218.db2.gz OAWZPHCEGKDTCS-LBPRGKRZSA-N 0 0 398.234 3.135 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)C[C@H]1Cc2ccccc2O1 ZINC000156917325 565112249 /nfs/dbraw/zinc/11/22/49/565112249.db2.gz OAWZPHCEGKDTCS-GFCCVEGCSA-N 0 0 398.234 3.135 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@@]3(C)CCOC3)cc2[N+](=O)[O-])n1 ZINC000156993841 565114186 /nfs/dbraw/zinc/11/41/86/565114186.db2.gz YITBRBHMHLZHQD-INIZCTEOSA-N 0 0 379.463 3.420 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1C[C@H]2CC[C@@H]1O2 ZINC000156980499 565114319 /nfs/dbraw/zinc/11/43/19/565114319.db2.gz HOKNEVCGZGNGEA-FOGDFJRCSA-N 0 0 376.356 3.142 20 5 GGBDRN C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@@H]1OCCc2sccc21 ZINC000292443625 565116436 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CC1(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCOCC1 ZINC000267914198 565135003 /nfs/dbraw/zinc/13/50/03/565135003.db2.gz GLJXEGNAOVJHBQ-UHFFFAOYSA-N 0 0 375.194 3.043 20 5 GGBDRN C[C@@]1(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCCC[C@@H]1O ZINC000267915754 565135285 /nfs/dbraw/zinc/13/52/85/565135285.db2.gz HCOOUQWLDVLSJE-WFASDCNBSA-N 0 0 389.221 3.167 20 5 GGBDRN Cc1c([C@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)cnn1C ZINC000267955939 565135578 /nfs/dbraw/zinc/13/55/78/565135578.db2.gz YDASOQBCLRVBKA-ZETCQYMHSA-N 0 0 385.193 3.029 20 5 GGBDRN Cc1cc(Br)ccc1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184465335 565135818 /nfs/dbraw/zinc/13/58/18/565135818.db2.gz PZWLCAMYUVVQFO-UHFFFAOYSA-N 0 0 399.266 3.285 20 5 GGBDRN Cc1cc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)no1 ZINC000370276315 565136827 /nfs/dbraw/zinc/13/68/27/565136827.db2.gz VRTLSLJPNHFBSS-ZDUSSCGKSA-N 0 0 385.829 3.379 20 5 GGBDRN Cn1nc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)cc1C1CC1 ZINC000292862472 565138468 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GGBDRN Cc1[nH]nc(C(=O)Nc2cc(Br)ccc2NC2CC2)c1[N+](=O)[O-] ZINC000268291250 565147438 /nfs/dbraw/zinc/14/74/38/565147438.db2.gz UOEIRQIYTBISCR-UHFFFAOYSA-N 0 0 380.202 3.215 20 5 GGBDRN COc1cccc(COCCNc2ncc([N+](=O)[O-])cc2Br)c1 ZINC000157922930 565148794 /nfs/dbraw/zinc/14/87/94/565148794.db2.gz SDTLYIPLWCLDPL-UHFFFAOYSA-N 0 0 382.214 3.390 20 5 GGBDRN CCc1nn(C)cc1CNc1ccc(I)cc1[N+](=O)[O-] ZINC000157925172 565149346 /nfs/dbraw/zinc/14/93/46/565149346.db2.gz YLSBPUIAPXRDPM-UHFFFAOYSA-N 0 0 386.193 3.107 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2cccc(N3CCOCC3)c2)c(Br)c1 ZINC000293137351 565152218 /nfs/dbraw/zinc/15/22/18/565152218.db2.gz QYFSOQCJXFQLRG-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN C[C@@](CO)(NC(=O)c1ccc([N+](=O)[O-])cc1Br)C1CCCCC1 ZINC000157998259 565153261 /nfs/dbraw/zinc/15/32/61/565153261.db2.gz GAZNUWIYQXUARU-INIZCTEOSA-N 0 0 385.258 3.418 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CN(C)c1ncc(Br)cc1[N+](=O)[O-] ZINC000268478132 565153585 /nfs/dbraw/zinc/15/35/85/565153585.db2.gz KAISSBRWVVRBRA-UHFFFAOYSA-N 0 0 393.241 3.444 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184716847 565153859 /nfs/dbraw/zinc/15/38/59/565153859.db2.gz LORFWRWEGHNYJY-YSDYUQAISA-N 0 0 387.889 3.127 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1OC[C@@H](O)COc1ccc(Br)cc1 ZINC000184776347 565156337 /nfs/dbraw/zinc/15/63/37/565156337.db2.gz UVCUALHBAKCJIV-NSHDSACASA-N 0 0 386.173 3.315 20 5 GGBDRN CSc1cccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000184830832 565158416 /nfs/dbraw/zinc/15/84/16/565158416.db2.gz YDBRPTGXOKZFEM-UHFFFAOYSA-N 0 0 379.825 3.225 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(Cl)c(F)c1 ZINC000184831588 565158443 /nfs/dbraw/zinc/15/84/43/565158443.db2.gz JRTVZUKEHRWRPA-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184827406 565159298 /nfs/dbraw/zinc/15/92/98/565159298.db2.gz IRYBZIJUZAETJA-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1cccc(OC(F)F)c1 ZINC000158241991 565161580 /nfs/dbraw/zinc/16/15/80/565161580.db2.gz PXSFHZCHPLGYJE-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Br)c2cccnc2O1 ZINC000158227982 565161892 /nfs/dbraw/zinc/16/18/92/565161892.db2.gz ICQWDNYFBRMJIG-VIFPVBQESA-N 0 0 378.182 3.180 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCC(n2cc(Br)cn2)CC1 ZINC000370803842 565162300 /nfs/dbraw/zinc/16/23/00/565162300.db2.gz SFBCQVSGYBGFDL-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN CC(C)OC(=O)c1ccc(Cn2cc(Br)cc([N+](=O)[O-])c2=O)cc1 ZINC000158245790 565162666 /nfs/dbraw/zinc/16/26/66/565162666.db2.gz QHYCWNNTSQUZKU-UHFFFAOYSA-N 0 0 395.209 3.133 20 5 GGBDRN O=C(N[C@@H]1CCC[C@@H]2OCC[C@@H]21)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268708795 565163326 /nfs/dbraw/zinc/16/33/26/565163326.db2.gz WSJLQFIMQHRUBP-XWIASGKRSA-N 0 0 387.205 3.184 20 5 GGBDRN Cc1noc(C)c1[C@H](C)CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000184889079 565163923 /nfs/dbraw/zinc/16/39/23/565163923.db2.gz CAHWRBHDROBWKI-MRVPVSSYSA-N 0 0 382.214 3.496 20 5 GGBDRN C[C@H](c1ccc(Cl)c(Cl)c1)S(=O)(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000158301226 565164756 /nfs/dbraw/zinc/16/47/56/565164756.db2.gz AOVFDYGHAIKYPR-SECBINFHSA-N 0 0 378.237 3.274 20 5 GGBDRN O=C(CSc1nnnn1-c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000158294038 565165215 /nfs/dbraw/zinc/16/52/15/565165215.db2.gz ZKYKASAWALJPGS-UHFFFAOYSA-N 0 0 375.797 3.199 20 5 GGBDRN CS(=O)(=O)C[C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000293434377 565167439 /nfs/dbraw/zinc/16/74/39/565167439.db2.gz UQLMVYNNONKEAK-JTQLQIEISA-N 0 0 381.281 3.158 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCOC[C@H]1c1ccco1 ZINC000370919771 565167987 /nfs/dbraw/zinc/16/79/87/565167987.db2.gz XWKFHYFBUMIVHX-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1nnc(CC(F)(F)F)s1 ZINC000269009606 565175109 /nfs/dbraw/zinc/17/51/09/565175109.db2.gz SHZCJKIAYZHAAC-UHFFFAOYSA-N 0 0 378.357 3.282 20 5 GGBDRN CC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1nccs1 ZINC000185056675 565175451 /nfs/dbraw/zinc/17/54/51/565175451.db2.gz ARHCWUBQHUNPJX-LLVKDONJSA-N 0 0 399.270 3.493 20 5 GGBDRN COCC1(CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCOCC1 ZINC000293591884 565176238 /nfs/dbraw/zinc/17/62/38/565176238.db2.gz GRQKCFAAOFASEJ-UHFFFAOYSA-N 0 0 377.224 3.075 20 5 GGBDRN O=C(N[C@H]1CCCc2c[nH]nc21)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000269041821 565176685 /nfs/dbraw/zinc/17/66/85/565176685.db2.gz YNACWUDSGGHICY-JTQLQIEISA-N 0 0 383.177 3.027 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCO[C@]2(CCSC2)C1 ZINC000269063135 565176731 /nfs/dbraw/zinc/17/67/31/565176731.db2.gz BZFOJHMPBNQETL-OGHNNQOOSA-N 0 0 382.507 3.246 20 5 GGBDRN O=C(Cn1cc(Cl)cc([N+](=O)[O-])c1=O)Nc1nc(-c2cccs2)cs1 ZINC000158641473 565176771 /nfs/dbraw/zinc/17/67/71/565176771.db2.gz PTYBZVWNLRUTPR-UHFFFAOYSA-N 0 0 396.837 3.234 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000158665642 565177414 /nfs/dbraw/zinc/17/74/14/565177414.db2.gz ISIXDACRZBGYII-SNVBAGLBSA-N 0 0 384.219 3.283 20 5 GGBDRN O=C(N[C@@H]1CCOC2(CCC2)C1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000269122748 565178192 /nfs/dbraw/zinc/17/81/92/565178192.db2.gz FMEUKAUEIHDSNW-SNVBAGLBSA-N 0 0 387.205 3.328 20 5 GGBDRN CC(C)(C)[C@@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1cccs1 ZINC000158703076 565178727 /nfs/dbraw/zinc/17/87/27/565178727.db2.gz XZUSMABEVSJGBG-AWEZNQCLSA-N 0 0 383.857 3.375 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1cccc(C2SCCS2)c1 ZINC000269194229 565180809 /nfs/dbraw/zinc/18/08/09/565180809.db2.gz MSFYZAMRVXRPCR-UHFFFAOYSA-N 0 0 379.467 3.092 20 5 GGBDRN COc1ccc(Cn2cc([N+](=O)[O-])c(C3CC3)n2)c(Br)c1OC ZINC000185161039 565181945 /nfs/dbraw/zinc/18/19/45/565181945.db2.gz SSVQULRYTVSDLU-UHFFFAOYSA-N 0 0 382.214 3.497 20 5 GGBDRN O=[N+]([O-])c1cn(Cc2cc3c(cc2Br)OCCO3)nc1C1CC1 ZINC000185166324 565183086 /nfs/dbraw/zinc/18/30/86/565183086.db2.gz NGUZZWAIQCBBFR-UHFFFAOYSA-N 0 0 380.198 3.251 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CC[C@@H](O)C12CCCC2 ZINC000293778339 565183390 /nfs/dbraw/zinc/18/33/90/565183390.db2.gz AEKANXZLELIQNO-GFCCVEGCSA-N 0 0 387.205 3.016 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1 ZINC000185170771 565183686 /nfs/dbraw/zinc/18/36/86/565183686.db2.gz WEGGOFWQVLTFMZ-UHFFFAOYSA-N 0 0 379.214 3.378 20 5 GGBDRN C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1)c1ccc(Br)cc1 ZINC000185175911 565184091 /nfs/dbraw/zinc/18/40/91/565184091.db2.gz LFGOOELXSNMZGJ-SNVBAGLBSA-N 0 0 393.241 3.309 20 5 GGBDRN COC(=O)[C@@H](NCc1cccc([N+](=O)[O-])c1)c1cccc(Br)c1 ZINC000158859808 565184384 /nfs/dbraw/zinc/18/43/84/565184384.db2.gz GHBDSKQHWXLHRZ-HNNXBMFYSA-N 0 0 379.210 3.361 20 5 GGBDRN CCOC(=O)c1ncc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000269286557 565184369 /nfs/dbraw/zinc/18/43/69/565184369.db2.gz RQFGCSVYIJWXLO-VIFPVBQESA-N 0 0 381.435 3.347 20 5 GGBDRN Cn1ccnc1[C@@H](O)[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000269364047 565186762 /nfs/dbraw/zinc/18/67/62/565186762.db2.gz NHZMBGPJFYEKET-NHYWBVRUSA-N 0 0 395.257 3.041 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c1[N+](=O)[O-] ZINC000269377331 565188047 /nfs/dbraw/zinc/18/80/47/565188047.db2.gz IJMQPKZMZWFJSW-RUZDIDTESA-N 0 0 384.845 3.226 20 5 GGBDRN Cn1ccnc1[C@@H](O)[C@@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000269377250 565188279 /nfs/dbraw/zinc/18/82/79/565188279.db2.gz QYPDRIMNZZEUIS-ABAIWWIYSA-N 0 0 395.257 3.041 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1C[C@@H](O)Cc1ccc(C(F)(F)F)cc1 ZINC000269407379 565189990 /nfs/dbraw/zinc/18/99/90/565189990.db2.gz FHDNTVLPZALHSI-LBPRGKRZSA-N 0 0 376.718 3.032 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](C2CCOCC2)C1 ZINC000371371167 565190011 /nfs/dbraw/zinc/19/00/11/565190011.db2.gz AQBQWNJWRKVWFB-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN CCc1nocc1CN(C)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000293958356 565191529 /nfs/dbraw/zinc/19/15/29/565191529.db2.gz IJGGYQZMTLYJHJ-UHFFFAOYSA-N 0 0 382.214 3.488 20 5 GGBDRN CC(C)OCCCN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000269477722 565191795 /nfs/dbraw/zinc/19/17/95/565191795.db2.gz NRSKUSDWBMJIGE-UHFFFAOYSA-N 0 0 384.376 3.049 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC2(CCOCC2)[C@H]1C1CC1 ZINC000294005310 565194018 /nfs/dbraw/zinc/19/40/18/565194018.db2.gz DHQMLUIYHBNOJG-OAHLLOKOSA-N 0 0 395.253 3.389 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000269577745 565195136 /nfs/dbraw/zinc/19/51/36/565195136.db2.gz JTXCLJNRXCBMLL-SNVBAGLBSA-N 0 0 387.223 3.212 20 5 GGBDRN COC[C@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)C1 ZINC000269645925 565196399 /nfs/dbraw/zinc/19/63/99/565196399.db2.gz AIRHJJJIGYSKSV-QMMMGPOBSA-N 0 0 377.622 3.119 20 5 GGBDRN O=[N+]([O-])c1ccc(SC[C@H](O)COc2ccc(Br)cc2)nc1 ZINC000159193313 565197897 /nfs/dbraw/zinc/19/78/97/565197897.db2.gz LMPNIGPWRAGXIH-GFCCVEGCSA-N 0 0 385.239 3.284 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1sccc1S(C)(=O)=O ZINC000185377504 565198355 /nfs/dbraw/zinc/19/83/55/565198355.db2.gz CBASTRNFSONZMG-LBPRGKRZSA-N 0 0 382.463 3.267 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCSC[C@H]2c2nccs2)cc1C ZINC000185414530 565200344 /nfs/dbraw/zinc/20/03/44/565200344.db2.gz VSVVHXQFBRYOEQ-ZDUSSCGKSA-N 0 0 399.519 3.147 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCSC[C@H]1c1nccs1 ZINC000185411546 565200376 /nfs/dbraw/zinc/20/03/76/565200376.db2.gz ATEFBTSNNVVTNX-ZDUSSCGKSA-N 0 0 399.519 3.093 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCSC[C@@H]2c2nccs2)cc1C ZINC000185414506 565200691 /nfs/dbraw/zinc/20/06/91/565200691.db2.gz VSVVHXQFBRYOEQ-CYBMUJFWSA-N 0 0 399.519 3.147 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000269916470 565202059 /nfs/dbraw/zinc/20/20/59/565202059.db2.gz FAXWFPQEXNOFEP-GFCCVEGCSA-N 0 0 383.242 3.497 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCSC[C@@H]2c2nccs2)c1C ZINC000185424823 565202093 /nfs/dbraw/zinc/20/20/93/565202093.db2.gz GFNVLFGPQWVEAK-CYBMUJFWSA-N 0 0 399.519 3.147 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000269916475 565202437 /nfs/dbraw/zinc/20/24/37/565202437.db2.gz FAXWFPQEXNOFEP-LBPRGKRZSA-N 0 0 383.242 3.497 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)N(C)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000185455336 565202602 /nfs/dbraw/zinc/20/26/02/565202602.db2.gz GRMPKAVCKPSLRX-GFCCVEGCSA-N 0 0 395.257 3.184 20 5 GGBDRN Cn1ncc2c1CCC[C@@H]2NC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000269960702 565204362 /nfs/dbraw/zinc/20/43/62/565204362.db2.gz IWOGFKATXIVKGP-LBPRGKRZSA-N 0 0 394.229 3.290 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000269975599 565204535 /nfs/dbraw/zinc/20/45/35/565204535.db2.gz MPXPOKMWLHTQIQ-SNVBAGLBSA-N 0 0 394.229 3.492 20 5 GGBDRN Cn1ncc2c1CCC[C@H]2NC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000269960701 565204865 /nfs/dbraw/zinc/20/48/65/565204865.db2.gz IWOGFKATXIVKGP-GFCCVEGCSA-N 0 0 394.229 3.290 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC3(CC2)OCCCO3)cc1[N+](=O)[O-] ZINC000294249546 565205329 /nfs/dbraw/zinc/20/53/29/565205329.db2.gz SLUJGJBFCNHHIC-UHFFFAOYSA-N 0 0 399.241 3.035 20 5 GGBDRN CO[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccccc1 ZINC000159395727 565205420 /nfs/dbraw/zinc/20/54/20/565205420.db2.gz AWIGZOFPCGFCOZ-HNNXBMFYSA-N 0 0 379.210 3.475 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000270002548 565205738 /nfs/dbraw/zinc/20/57/38/565205738.db2.gz NYHWLQOAWMXMMV-BNOWGMLFSA-N 0 0 381.226 3.045 20 5 GGBDRN Cn1nc(Br)c2c1ncnc2SCc1ccc([N+](=O)[O-])cc1 ZINC000159419721 565205968 /nfs/dbraw/zinc/20/59/68/565205968.db2.gz CNWHTCZSHYBHQU-UHFFFAOYSA-N 0 0 380.227 3.326 20 5 GGBDRN CO[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccccc1 ZINC000159395817 565205983 /nfs/dbraw/zinc/20/59/83/565205983.db2.gz AWIGZOFPCGFCOZ-OAHLLOKOSA-N 0 0 379.210 3.475 20 5 GGBDRN O=C(NC12CCC(CC1)C2)c1ccc([N+](=O)[O-])cc1I ZINC000371707950 565206073 /nfs/dbraw/zinc/20/60/73/565206073.db2.gz FFXXNDWJECUBFX-UHFFFAOYSA-N 0 0 386.189 3.262 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1[N+](=O)[O-] ZINC000294283469 565206272 /nfs/dbraw/zinc/20/62/72/565206272.db2.gz UWSAZLZCFQQRMU-QGZVFWFLSA-N 0 0 396.285 3.224 20 5 GGBDRN CCc1nocc1CN(C)C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000294287136 565206284 /nfs/dbraw/zinc/20/62/84/565206284.db2.gz YGUNLRSJWRODCS-UHFFFAOYSA-N 0 0 382.214 3.488 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000270040170 565207219 /nfs/dbraw/zinc/20/72/19/565207219.db2.gz JZLCMAOTXZUJFC-CFVMTHIKSA-N 0 0 395.253 3.435 20 5 GGBDRN CC1(C)C(=O)N[C@@H]1C1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000294299746 565207582 /nfs/dbraw/zinc/20/75/82/565207582.db2.gz YINSTSRWIBYICK-CQSZACIVSA-N 0 0 382.258 3.098 20 5 GGBDRN C[C@H]1[C@@H](c2ccc(Br)cc2)OCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000270150561 565209956 /nfs/dbraw/zinc/20/99/56/565209956.db2.gz ASXIOKGAFSSNAE-BONVTDFDSA-N 0 0 394.225 3.288 20 5 GGBDRN COc1cccnc1N(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000159544825 565210246 /nfs/dbraw/zinc/21/02/46/565210246.db2.gz SWDUHJIGGHIDIG-UHFFFAOYSA-N 0 0 392.220 3.130 20 5 GGBDRN C[C@H]1[C@H](c2ccc(Br)cc2)OCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000270150565 565210308 /nfs/dbraw/zinc/21/03/08/565210308.db2.gz ASXIOKGAFSSNAE-ZUZCIYMTSA-N 0 0 394.225 3.288 20 5 GGBDRN CN(c1ccc(Cl)cn1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185611990 565210965 /nfs/dbraw/zinc/21/09/65/565210965.db2.gz IVSJQVRJHFNIDP-UHFFFAOYSA-N 0 0 378.797 3.017 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000294436362 565211855 /nfs/dbraw/zinc/21/18/55/565211855.db2.gz ZDWSJCNZBFDFOQ-HNNXBMFYSA-N 0 0 395.253 3.389 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cn1)Nc1ccnn1Cc1cccs1 ZINC000159707807 565215681 /nfs/dbraw/zinc/21/56/81/565215681.db2.gz MRPYXLUOCRDCCI-UHFFFAOYSA-N 0 0 375.435 3.027 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H](c2nccs2)c2ccccc2)c1 ZINC000185764605 565220091 /nfs/dbraw/zinc/22/00/91/565220091.db2.gz BYMZMSGFMXHZIZ-OAHLLOKOSA-N 0 0 375.431 3.119 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H](c2nccs2)c2ccccc2)c1 ZINC000185764588 565220523 /nfs/dbraw/zinc/22/05/23/565220523.db2.gz BYMZMSGFMXHZIZ-HNNXBMFYSA-N 0 0 375.431 3.119 20 5 GGBDRN CC[C@@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000185779767 565221158 /nfs/dbraw/zinc/22/11/58/565221158.db2.gz TUENCRALMOTZEI-SSDOTTSWSA-N 0 0 376.316 3.052 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC(OCC2CC2)CC1 ZINC000372114987 565222447 /nfs/dbraw/zinc/22/24/47/565222447.db2.gz BTYKRDZZJPWIDD-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN COc1ccc(I)c(NC(=O)CCC(C)(C)[N+](=O)[O-])c1 ZINC000294689520 565223831 /nfs/dbraw/zinc/22/38/31/565223831.db2.gz KMVXYRNRQZUNPI-UHFFFAOYSA-N 0 0 392.193 3.074 20 5 GGBDRN CCC(CC)(CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)OC ZINC000294712969 565224761 /nfs/dbraw/zinc/22/47/61/565224761.db2.gz RVZCUNOJIKMBGE-UHFFFAOYSA-N 0 0 377.210 3.431 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000294751502 565225751 /nfs/dbraw/zinc/22/57/51/565225751.db2.gz ITOBFQPDDHZUPR-GDBMZVCRSA-N 0 0 399.216 3.280 20 5 GGBDRN Cc1cc(Cl)c(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000294766055 565226752 /nfs/dbraw/zinc/22/67/52/565226752.db2.gz FMXIWESIDZDIBC-JTQLQIEISA-N 0 0 379.766 3.171 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(C(C)=O)cs1 ZINC000270794821 565228650 /nfs/dbraw/zinc/22/86/50/565228650.db2.gz SFPHMWWAIGESNO-UHFFFAOYSA-N 0 0 381.435 3.245 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(CSc3ccc([N+](=O)[O-])cn3)nc2c1 ZINC000160094663 565229921 /nfs/dbraw/zinc/22/99/21/565229921.db2.gz PMELYXJWNLHGGD-UHFFFAOYSA-N 0 0 379.419 3.217 20 5 GGBDRN O=C1N[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N2CCSC[C@H]12 ZINC000270821414 565230283 /nfs/dbraw/zinc/23/02/83/565230283.db2.gz RWMWIHOLBZPXAV-IUODEOHRSA-N 0 0 379.825 3.054 20 5 GGBDRN CC(C)(C[C@@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1)C(N)=O ZINC000294837533 565230322 /nfs/dbraw/zinc/23/03/22/565230322.db2.gz QTIZNMJGRGIGTE-ZDUSSCGKSA-N 0 0 398.301 3.471 20 5 GGBDRN CCN1CCc2nc(NC(=O)c3cccc(SC)c3[N+](=O)[O-])sc2C1 ZINC000185965344 565232097 /nfs/dbraw/zinc/23/20/97/565232097.db2.gz QVLIYUSGHMWOMX-UHFFFAOYSA-N 0 0 378.479 3.404 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000185979398 565233744 /nfs/dbraw/zinc/23/37/44/565233744.db2.gz GCFQHUIPHXMLRS-NSHDSACASA-N 0 0 383.177 3.197 20 5 GGBDRN O=C(c1ccco1)N1CCC(Nc2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000270977214 565234066 /nfs/dbraw/zinc/23/40/66/565234066.db2.gz RHIXDNAMZGKKEF-UHFFFAOYSA-N 0 0 395.213 3.062 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCO[C@@]2(CCSC2)C1 ZINC000186014515 565234538 /nfs/dbraw/zinc/23/45/38/565234538.db2.gz RQOMVPGBIKQASO-LRDDRELGSA-N 0 0 385.873 3.102 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)c1 ZINC000186007077 565234771 /nfs/dbraw/zinc/23/47/71/565234771.db2.gz MZRAFSBBUOUOSK-HNNXBMFYSA-N 0 0 382.825 3.090 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1 ZINC000186031826 565235721 /nfs/dbraw/zinc/23/57/21/565235721.db2.gz IKYYVTPBULWAGF-HZPDHXFCSA-N 0 0 382.825 3.057 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c1 ZINC000186031887 565236156 /nfs/dbraw/zinc/23/61/56/565236156.db2.gz IKYYVTPBULWAGF-HOTGVXAUSA-N 0 0 382.825 3.057 20 5 GGBDRN CC(C)c1nnc([C@@H](C)NC(=O)c2ccc(Br)cc2[N+](=O)[O-])[nH]1 ZINC000271015990 565236360 /nfs/dbraw/zinc/23/63/60/565236360.db2.gz HHGLRBWOVSTDBJ-MRVPVSSYSA-N 0 0 382.218 3.090 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N(CCO)Cc1cc(Br)ccc1F ZINC000160277514 565238366 /nfs/dbraw/zinc/23/83/66/565238366.db2.gz DSZPROSVDIGUKZ-UHFFFAOYSA-N 0 0 397.200 3.131 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000295012972 565240711 /nfs/dbraw/zinc/24/07/11/565240711.db2.gz VSOPXESVHNQECS-ZBFHGGJFSA-N 0 0 381.226 3.141 20 5 GGBDRN CC(C)(CCC(=O)Nc1ccc(F)cc1I)[N+](=O)[O-] ZINC000295049723 565241692 /nfs/dbraw/zinc/24/16/92/565241692.db2.gz GNYWUJFHTRFXPX-UHFFFAOYSA-N 0 0 380.157 3.204 20 5 GGBDRN COC(=O)[C@H]1CC12CCN(Cc1ccc(Br)c([N+](=O)[O-])c1)CC2 ZINC000271207303 565242583 /nfs/dbraw/zinc/24/25/83/565242583.db2.gz WVKIOAVDPCMENR-GFCCVEGCSA-N 0 0 383.242 3.132 20 5 GGBDRN Cc1ncsc1CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000295094965 565244511 /nfs/dbraw/zinc/24/45/11/565244511.db2.gz ZVGWNXRHPURCCE-UHFFFAOYSA-N 0 0 377.394 3.011 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2ccc(N3CCCCC3)nc2)s1 ZINC000271253900 565244909 /nfs/dbraw/zinc/24/49/09/565244909.db2.gz JQCFHOMFSHPNBG-UHFFFAOYSA-N 0 0 382.467 3.189 20 5 GGBDRN COc1ccc([C@H]2CCN(c3sc(S(C)(=O)=O)cc3[N+](=O)[O-])C2)cc1 ZINC000271240949 565245052 /nfs/dbraw/zinc/24/50/52/565245052.db2.gz HOAROEZRVOWTRL-LBPRGKRZSA-N 0 0 382.463 3.062 20 5 GGBDRN COc1ccc([C@@H]2CCN(c3sc(S(C)(=O)=O)cc3[N+](=O)[O-])C2)cc1 ZINC000271240947 565245131 /nfs/dbraw/zinc/24/51/31/565245131.db2.gz HOAROEZRVOWTRL-GFCCVEGCSA-N 0 0 382.463 3.062 20 5 GGBDRN Nc1c(C(=O)N2CCc3c(Br)ccc(F)c3C2)cccc1[N+](=O)[O-] ZINC000186211285 565247437 /nfs/dbraw/zinc/24/74/37/565247437.db2.gz SDRZWOMWWLXHEN-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN CO[C@@H]1CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)[C@H](C)C1 ZINC000295157745 565248389 /nfs/dbraw/zinc/24/83/89/565248389.db2.gz ASTFAQXVCYWZNV-RKDXNWHRSA-N 0 0 383.253 3.090 20 5 GGBDRN CC1(C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)[C@H]2CCCO[C@@H]21 ZINC000372695574 565248894 /nfs/dbraw/zinc/24/88/94/565248894.db2.gz RQWRHGOOKBOSSH-WQVCFCJDSA-N 0 0 397.269 3.220 20 5 GGBDRN CC1(C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)[C@@H]2CCCO[C@H]21 ZINC000372695567 565249316 /nfs/dbraw/zinc/24/93/16/565249316.db2.gz RQWRHGOOKBOSSH-APHBMKBZSA-N 0 0 397.269 3.220 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N2CCC3(C2)CCOCC3)c1Cl ZINC000295172198 565249622 /nfs/dbraw/zinc/24/96/22/565249622.db2.gz GVMXHNXKSFFNJM-UHFFFAOYSA-N 0 0 395.264 3.093 20 5 GGBDRN CC(C)[C@@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000271351156 565249746 /nfs/dbraw/zinc/24/97/46/565249746.db2.gz DXWPKJPAVKYVHH-GWCFXTLKSA-N 0 0 389.221 3.430 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCO[C@H](c3ccccc3)C2)s1 ZINC000160549721 565250197 /nfs/dbraw/zinc/25/01/97/565250197.db2.gz FNAAZGHOAMNNIG-JSGCOSHPSA-N 0 0 382.463 3.392 20 5 GGBDRN C[S@](=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000186275685 565250668 /nfs/dbraw/zinc/25/06/68/565250668.db2.gz OYNDLOIJHRLERT-VWLOTQADSA-N 0 0 384.523 3.376 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000160580893 565251794 /nfs/dbraw/zinc/25/17/94/565251794.db2.gz JKTKUWQZNQLBQZ-LBPRGKRZSA-N 0 0 382.825 3.090 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccc(F)cc1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271456643 565254135 /nfs/dbraw/zinc/25/41/35/565254135.db2.gz YCCSVOPVARXWIO-TVQRCGJNSA-N 0 0 388.442 3.123 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271456637 565254710 /nfs/dbraw/zinc/25/47/10/565254710.db2.gz YCCSVOPVARXWIO-NOZJJQNGSA-N 0 0 388.442 3.123 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCC(c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000186341656 565255336 /nfs/dbraw/zinc/25/53/36/565255336.db2.gz IAWBNYGFNFZGJP-UHFFFAOYSA-N 0 0 382.463 3.233 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000186326634 565255877 /nfs/dbraw/zinc/25/58/77/565255877.db2.gz PGGJMTHKJCEFRE-UHFFFAOYSA-N 0 0 377.710 3.285 20 5 GGBDRN Cc1cc(Br)cc2cc(C(=O)NCCn3cc([N+](=O)[O-])cn3)oc21 ZINC000160705271 565257225 /nfs/dbraw/zinc/25/72/25/565257225.db2.gz NQCUUINWLMYWTK-UHFFFAOYSA-N 0 0 393.197 3.038 20 5 GGBDRN CSCCCCCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000186363738 565257250 /nfs/dbraw/zinc/25/72/50/565257250.db2.gz STMFTHMCIIMREG-UHFFFAOYSA-N 0 0 387.527 3.325 20 5 GGBDRN CO[C@H]1CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CC1(C)C ZINC000295281625 565257884 /nfs/dbraw/zinc/25/78/84/565257884.db2.gz BJSHGIRCEXKCAI-NSHDSACASA-N 0 0 397.280 3.337 20 5 GGBDRN Cc1cc(Cl)c(C(=O)N2CCC[C@](O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000295308358 565259159 /nfs/dbraw/zinc/25/91/59/565259159.db2.gz ORHUDAGVQIQVAR-CQSZACIVSA-N 0 0 380.750 3.476 20 5 GGBDRN CC(C)(C(=O)Nc1cc(F)c(Br)cc1F)n1cc([N+](=O)[O-])cn1 ZINC000160792875 565259329 /nfs/dbraw/zinc/25/93/29/565259329.db2.gz FRRWWTZBLVQWAL-UHFFFAOYSA-N 0 0 389.156 3.206 20 5 GGBDRN Cc1cc(Cl)c(C(=O)NCCCNC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000295337275 565259805 /nfs/dbraw/zinc/25/98/05/565259805.db2.gz ULUWAFBWFNEXFD-UHFFFAOYSA-N 0 0 381.841 3.168 20 5 GGBDRN CC[C@H](CSC)N(C)C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000271623835 565261225 /nfs/dbraw/zinc/26/12/25/565261225.db2.gz PUGMPHHLAAKUID-SECBINFHSA-N 0 0 378.397 3.418 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC([C@H]2CCOC2)CC1 ZINC000372940402 565262007 /nfs/dbraw/zinc/26/20/07/565262007.db2.gz MAGMQHAAHDZKCL-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2nnc(N3CCOCC3)s2)cc1C(F)(F)F ZINC000160840284 565262224 /nfs/dbraw/zinc/26/22/24/565262224.db2.gz UBULLRBTQHBFBE-UHFFFAOYSA-N 0 0 392.384 3.453 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC(c3nncn3C3CC3)CC2)c(Br)c1 ZINC000271630653 565262796 /nfs/dbraw/zinc/26/27/96/565262796.db2.gz NQVJOGWORDOVSW-UHFFFAOYSA-N 0 0 393.245 3.063 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)N(C)C(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000186480648 565263053 /nfs/dbraw/zinc/26/30/53/565263053.db2.gz PPSWPCOVPKUELX-CYBMUJFWSA-N 0 0 395.257 3.034 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000271682434 565264931 /nfs/dbraw/zinc/26/49/31/565264931.db2.gz ZLEXSXMSCOPTDE-LLVKDONJSA-N 0 0 395.261 3.309 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186525484 565266464 /nfs/dbraw/zinc/26/64/64/565266464.db2.gz LPUPCCYPDPEHAF-IAQYHMDHSA-N 0 0 381.841 3.415 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000186543497 565267669 /nfs/dbraw/zinc/26/76/69/565267669.db2.gz CFXZHDXNGDZDQM-JTQLQIEISA-N 0 0 384.845 3.383 20 5 GGBDRN CCn1cc([C@@H](C)NS(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)cn1 ZINC000295473775 565268443 /nfs/dbraw/zinc/26/84/43/565268443.db2.gz ZDOQVCYTNCMDOU-MRVPVSSYSA-N 0 0 393.252 3.158 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1c(F)c(F)cc(F)c1F ZINC000161009044 565269239 /nfs/dbraw/zinc/26/92/39/565269239.db2.gz CIFFDWMMIQUHEO-UHFFFAOYSA-N 0 0 378.303 3.136 20 5 GGBDRN COc1cc(C(=O)N[C@H](c2nc(C)cs2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000295493824 565269655 /nfs/dbraw/zinc/26/96/55/565269655.db2.gz UYKDSZAHGDRSMI-LLVKDONJSA-N 0 0 375.328 3.402 20 5 GGBDRN Cc1cc(N2CCC3(CCN(C)C3=O)CC2)c(Br)cc1[N+](=O)[O-] ZINC000373113984 565270419 /nfs/dbraw/zinc/27/04/19/565270419.db2.gz XAVREPUUBVTTIR-UHFFFAOYSA-N 0 0 382.258 3.114 20 5 GGBDRN CO[C@H](c1ccccc1F)[C@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271870892 565270970 /nfs/dbraw/zinc/27/09/70/565270970.db2.gz SAVGTNBVSNMWKY-XPTSAGLGSA-N 0 0 388.442 3.387 20 5 GGBDRN C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[C@@H]1CCCCO1 ZINC000272011830 565274426 /nfs/dbraw/zinc/27/44/26/565274426.db2.gz ATTMEFISRHTRRJ-PELKAZGASA-N 0 0 375.194 3.184 20 5 GGBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[C@H]1CCCCO1 ZINC000272011836 565274654 /nfs/dbraw/zinc/27/46/54/565274654.db2.gz ATTMEFISRHTRRJ-QPUJVOFHSA-N 0 0 375.194 3.184 20 5 GGBDRN COCCCn1cc(C)c(NC(=O)c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000295626363 565277176 /nfs/dbraw/zinc/27/71/76/565277176.db2.gz KDACTRROOAKSTG-UHFFFAOYSA-N 0 0 397.229 3.151 20 5 GGBDRN Cc1c(Br)scc1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373313630 565278877 /nfs/dbraw/zinc/27/88/77/565278877.db2.gz NMPPAZWOFNLGQF-UHFFFAOYSA-N 0 0 399.270 3.401 20 5 GGBDRN O=C(Nc1ccccc1Br)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373306286 565279257 /nfs/dbraw/zinc/27/92/57/565279257.db2.gz RMUBQVRVDZHFEZ-UHFFFAOYSA-N 0 0 394.229 3.423 20 5 GGBDRN CSc1cccc(C(=O)N(C)Cc2ccc([S@@](C)=O)cc2)c1[N+](=O)[O-] ZINC000186723071 565280879 /nfs/dbraw/zinc/28/08/79/565280879.db2.gz QPRWLPIXYKZPDC-RUZDIDTESA-N 0 0 378.475 3.326 20 5 GGBDRN CC(C)(CNC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccccn1 ZINC000295692605 565281516 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GGBDRN CNc1c(C(=O)Nc2ccc(I)cc2)cccc1[N+](=O)[O-] ZINC000161425165 565283497 /nfs/dbraw/zinc/28/34/97/565283497.db2.gz CTHRDJKLAVHGGX-UHFFFAOYSA-N 0 0 397.172 3.493 20 5 GGBDRN COCCCn1cc(C)c(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000295732217 565283946 /nfs/dbraw/zinc/28/39/46/565283946.db2.gz UXOXKDHUIZDBBP-UHFFFAOYSA-N 0 0 397.229 3.151 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)[C@@H](O)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000272310960 565283916 /nfs/dbraw/zinc/28/39/16/565283916.db2.gz YGJLALJZMZKXBB-NXSYQRQQSA-N 0 0 387.223 3.039 20 5 GGBDRN CSc1cccc(C(=O)Nc2cc(Br)c(=O)n(C)c2)c1[N+](=O)[O-] ZINC000186787030 565285892 /nfs/dbraw/zinc/28/58/92/565285892.db2.gz SHPTWVVRJSQJJH-UHFFFAOYSA-N 0 0 398.238 3.030 20 5 GGBDRN COCCCn1cc(C)c(NC(=O)c2cccc([N+](=O)[O-])c2Br)n1 ZINC000295767923 565286079 /nfs/dbraw/zinc/28/60/79/565286079.db2.gz YIUFLLDSBSOZAS-UHFFFAOYSA-N 0 0 397.229 3.151 20 5 GGBDRN COC1(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCCC1 ZINC000295761133 565286102 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COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](c1nc(C)cs1)C(F)(F)F ZINC000295961134 565294600 /nfs/dbraw/zinc/29/46/00/565294600.db2.gz NCAFKBAQKBFVEF-LLVKDONJSA-N 0 0 375.328 3.402 20 5 GGBDRN CN(Cc1nccn1C(F)F)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000161850897 565294921 /nfs/dbraw/zinc/29/49/21/565294921.db2.gz DAUWTRRINKRNDX-UHFFFAOYSA-N 0 0 389.156 3.221 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccsc1 ZINC000186958311 565297706 /nfs/dbraw/zinc/29/77/06/565297706.db2.gz NQONYXFEBFDROM-LBPRGKRZSA-N 0 0 399.222 3.063 20 5 GGBDRN Cc1ccc([C@@H](C)Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000272797489 565298058 /nfs/dbraw/zinc/29/80/58/565298058.db2.gz DBYVKWWUYCWKGB-SECBINFHSA-N 0 0 385.423 3.450 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)NCC(C)(C)c2cccs2)cc1[N+](=O)[O-] ZINC000186993427 565300415 /nfs/dbraw/zinc/30/04/15/565300415.db2.gz KGRAYAJWWUGHMU-UHFFFAOYSA-N 0 0 388.442 3.060 20 5 GGBDRN O=C(NCC[C@H]1CCCCO1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000272940331 565301957 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O=[N+]([O-])c1cnn(CCSCc2cc3c(cc2Br)OCO3)c1 ZINC000162117664 565305697 /nfs/dbraw/zinc/30/56/97/565305697.db2.gz YYQJJZMKAOVSQO-UHFFFAOYSA-N 0 0 386.227 3.216 20 5 GGBDRN Cc1nc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])ccc1[C@@H](C)O ZINC000273043848 565306247 /nfs/dbraw/zinc/30/62/47/565306247.db2.gz VSDTWKKWAMHMER-SNVBAGLBSA-N 0 0 394.225 3.044 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2C[C@H]3OCCC[C@H]23)cc(Br)cc1[N+](=O)[O-] ZINC000373851060 565306665 /nfs/dbraw/zinc/30/66/65/565306665.db2.gz VTFZWHJOUNCIRK-MPKXVKKWSA-N 0 0 384.230 3.355 20 5 GGBDRN C[C@@H]1C[C@@H](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000273112967 565307928 /nfs/dbraw/zinc/30/79/28/565307928.db2.gz CPKFLMKDXCQCBJ-ZJUUUORDSA-N 0 0 389.221 3.431 20 5 GGBDRN O=C(N[C@H]1COc2ccccc2C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000162232144 565310245 /nfs/dbraw/zinc/31/02/45/565310245.db2.gz SMTZVYZUBRZYIJ-CYBMUJFWSA-N 0 0 377.194 3.091 20 5 GGBDRN CC(C)c1nnc([C@H](C)NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000273166482 565310878 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GGBDRN Cc1n[nH]c(C)c1[C@@H]1COCCN1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000374258887 565328081 /nfs/dbraw/zinc/32/80/81/565328081.db2.gz NAYZUGXJRZTJEK-HNNXBMFYSA-N 0 0 395.257 3.271 20 5 GGBDRN Cc1cc(C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)CC2)[nH]n1 ZINC000273650893 565328321 /nfs/dbraw/zinc/32/83/21/565328321.db2.gz UKGKBHYCADAZNY-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2Cc3cccc(Br)c3C2)c1[N+](=O)[O-] ZINC000187387868 565328460 /nfs/dbraw/zinc/32/84/60/565328460.db2.gz TUUWECFPKHAFKJ-UHFFFAOYSA-N 0 0 379.214 3.189 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 ZINC000162858230 565329774 /nfs/dbraw/zinc/32/97/74/565329774.db2.gz QSCOQTJFMNJJMW-UHFFFAOYSA-N 0 0 380.369 3.462 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@@H]1CCCC1=O ZINC000374293266 565330458 /nfs/dbraw/zinc/33/04/58/565330458.db2.gz HCUCUVHXHILPNA-DZGCQCFKSA-N 0 0 395.253 3.260 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1[C@@H]1CCCC1=O ZINC000374293284 565330493 /nfs/dbraw/zinc/33/04/93/565330493.db2.gz HCUCUVHXHILPNA-ZFWWWQNUSA-N 0 0 395.253 3.260 20 5 GGBDRN Cc1ncsc1CCS(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000296701198 565331030 /nfs/dbraw/zinc/33/10/30/565331030.db2.gz KXQSTTXMZHUBGW-UHFFFAOYSA-N 0 0 383.495 3.143 20 5 GGBDRN CCN(C[C@H]1CCCO1)S(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC000296733330 565332569 /nfs/dbraw/zinc/33/25/69/565332569.db2.gz OEDLDEGGQFCILO-SECBINFHSA-N 0 0 383.253 3.091 20 5 GGBDRN CCN(Cc1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1)C1CC1 ZINC000273764123 565335020 /nfs/dbraw/zinc/33/50/20/565335020.db2.gz DTETVPDBJGEFBC-UHFFFAOYSA-N 0 0 381.230 3.315 20 5 GGBDRN CC(C)OC(=O)c1ccc(Cn2cc([N+](=O)[O-])cc(Br)c2=O)cc1 ZINC000163152706 565337806 /nfs/dbraw/zinc/33/78/06/565337806.db2.gz UGMWYBXJRUFWTC-UHFFFAOYSA-N 0 0 395.209 3.133 20 5 GGBDRN CCCN(CC(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163173351 565338565 /nfs/dbraw/zinc/33/85/65/565338565.db2.gz UQEKGZFNEKFYAD-UHFFFAOYSA-N 0 0 376.303 3.279 20 5 GGBDRN CCN(Cc1ccoc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163212822 565339854 /nfs/dbraw/zinc/33/98/54/565339854.db2.gz ZFHRITGYSRSKOL-UHFFFAOYSA-N 0 0 378.328 3.417 20 5 GGBDRN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000163294443 565342449 /nfs/dbraw/zinc/34/24/49/565342449.db2.gz CJASVZFMASYERQ-LLVKDONJSA-N 0 0 383.857 3.089 20 5 GGBDRN CCCC[C@@H](COC)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163370094 565344829 /nfs/dbraw/zinc/34/48/29/565344829.db2.gz HYNMUUZASSOFNO-JTQLQIEISA-N 0 0 384.376 3.097 20 5 GGBDRN CC(C)[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCS1 ZINC000163400028 565345506 /nfs/dbraw/zinc/34/55/06/565345506.db2.gz NZRDIIRDODCLKT-LBPRGKRZSA-N 0 0 398.428 3.376 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000187690512 565350056 /nfs/dbraw/zinc/35/00/56/565350056.db2.gz FJJAQIVKWDPKJK-YMTOWFKASA-N 0 0 380.750 3.462 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000187709269 565350128 /nfs/dbraw/zinc/35/01/28/565350128.db2.gz VDVRSGOHLMYXIJ-OTYXRUKQSA-N 0 0 380.750 3.462 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](O)CC(C)(C)C1 ZINC000297045580 565353110 /nfs/dbraw/zinc/35/31/10/565353110.db2.gz TWVHNGUFHUMDJA-GFCCVEGCSA-N 0 0 385.258 3.289 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1ccc(O)c(Br)c1 ZINC000163962412 565353798 /nfs/dbraw/zinc/35/37/98/565353798.db2.gz PMXAAUCRBUMELX-UHFFFAOYSA-N 0 0 394.225 3.105 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H]2CCCc3sccc32)cc1[N+](=O)[O-] ZINC000187781342 565354526 /nfs/dbraw/zinc/35/45/26/565354526.db2.gz BCOFYHNFIKLQQQ-LBPRGKRZSA-N 0 0 386.426 3.160 20 5 GGBDRN C[C@@H]1OCC[C@H]1SCC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000164052527 565354793 /nfs/dbraw/zinc/35/47/93/565354793.db2.gz GLOITZCNUKZYHZ-QPUJVOFHSA-N 0 0 375.244 3.206 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc([C@@H]3CCCO3)no2)c(I)c1 ZINC000274077705 565355465 /nfs/dbraw/zinc/35/54/65/565355465.db2.gz GAIIOXCYYSDNSG-JTQLQIEISA-N 0 0 387.133 3.101 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc([C@H]3CCCO3)no2)c(I)c1 ZINC000274077707 565355531 /nfs/dbraw/zinc/35/55/31/565355531.db2.gz GAIIOXCYYSDNSG-SNVBAGLBSA-N 0 0 387.133 3.101 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(F)c(Br)c2)c1 ZINC000164184734 565355859 /nfs/dbraw/zinc/35/58/59/565355859.db2.gz WHBLDYYKIBUSIO-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN CC[C@H](CSC)NC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000164124534 565356000 /nfs/dbraw/zinc/35/60/00/565356000.db2.gz LRYZUSZFJPECKJ-MRVPVSSYSA-N 0 0 394.234 3.071 20 5 GGBDRN CN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000374861326 565357812 /nfs/dbraw/zinc/35/78/12/565357812.db2.gz HPFANEAOURPEBJ-OAHLLOKOSA-N 0 0 384.816 3.348 20 5 GGBDRN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000164421323 565360216 /nfs/dbraw/zinc/36/02/16/565360216.db2.gz DBTQFRIBUOJKTJ-UHFFFAOYSA-N 0 0 397.869 3.368 20 5 GGBDRN CSc1cc(C)ccc1CNS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000164407671 565360236 /nfs/dbraw/zinc/36/02/36/565360236.db2.gz KHRAEGKBEGQNNQ-UHFFFAOYSA-N 0 0 380.491 3.287 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H](C2CC2)C1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000274188821 565361060 /nfs/dbraw/zinc/36/10/60/565361060.db2.gz FMTCLGLBLICDOY-GXFFZTMASA-N 0 0 387.205 3.184 20 5 GGBDRN C[C@](O)(CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000274205568 565362045 /nfs/dbraw/zinc/36/20/45/565362045.db2.gz VFVNLPVIKNAJCE-AWEZNQCLSA-N 0 0 390.870 3.033 20 5 GGBDRN COCCC(C)(C)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000274282076 565365527 /nfs/dbraw/zinc/36/55/27/565365527.db2.gz YYTGGLXZURPTAG-UHFFFAOYSA-N 0 0 377.210 3.289 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@H]2CCOC2)C1 ZINC000375041219 565365952 /nfs/dbraw/zinc/36/59/52/565365952.db2.gz HXCSCTQEMLYXTH-RYUDHWBXSA-N 0 0 383.242 3.164 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCOC3(CCOCC3)CC2)ccc1Br ZINC000375080368 565366985 /nfs/dbraw/zinc/36/69/85/565366985.db2.gz WOXSUZXIHCKASQ-UHFFFAOYSA-N 0 0 385.258 3.129 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000274377390 565368950 /nfs/dbraw/zinc/36/89/50/565368950.db2.gz XTYJWWIXRVQPIH-LLVKDONJSA-N 0 0 380.857 3.224 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)c2ccccc21 ZINC000375113901 565369369 /nfs/dbraw/zinc/36/93/69/565369369.db2.gz OVAWHOMQABSAIV-GFCCVEGCSA-N 0 0 380.809 3.148 20 5 GGBDRN O=C(N1CCSC[C@@H]1c1nccs1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000274445269 565370660 /nfs/dbraw/zinc/37/06/60/565370660.db2.gz FYOFVWRVFYUHKV-GFCCVEGCSA-N 0 0 385.417 3.460 20 5 GGBDRN O=C(N1CCSC[C@H]1c1nccs1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000274445270 565371023 /nfs/dbraw/zinc/37/10/23/565371023.db2.gz FYOFVWRVFYUHKV-LBPRGKRZSA-N 0 0 385.417 3.460 20 5 GGBDRN CCO[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Br)C12CCOCC2 ZINC000274439918 565371443 /nfs/dbraw/zinc/37/14/43/565371443.db2.gz DPJRSKHEHBAMGN-STQMWFEESA-N 0 0 386.246 3.138 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NC1CCC(O)(c2cccnc2)CC1 ZINC000274495584 565372365 /nfs/dbraw/zinc/37/23/65/565372365.db2.gz SIRZLIYNAPSKGU-UHFFFAOYSA-N 0 0 393.241 3.390 20 5 GGBDRN C[C@@H]1[C@H](C)OCCN1C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000166117788 565373203 /nfs/dbraw/zinc/37/32/03/565373203.db2.gz GNACUMHDFLXWCT-ZJUUUORDSA-N 0 0 378.372 3.342 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1)c1[nH]ncc1[N+](=O)[O-] ZINC000188056257 565374937 /nfs/dbraw/zinc/37/49/37/565374937.db2.gz KLRAQJDMARCBDE-SNVBAGLBSA-N 0 0 384.223 3.024 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCSC2(CCOCC2)C1 ZINC000375224732 565375660 /nfs/dbraw/zinc/37/56/60/565375660.db2.gz VVLANELAIHULPI-UHFFFAOYSA-N 0 0 382.507 3.445 20 5 GGBDRN CSc1cccc(C(=O)NC2CCN(CC(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000188090873 565377625 /nfs/dbraw/zinc/37/76/25/565377625.db2.gz XTDPTOSKLFTZLH-UHFFFAOYSA-N 0 0 377.388 3.073 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@H]1COc2ccccc21 ZINC000167531929 565377962 /nfs/dbraw/zinc/37/79/62/565377962.db2.gz DMTYOMQGTYYTMH-GXFFZTMASA-N 0 0 382.825 3.091 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000167556440 565378497 /nfs/dbraw/zinc/37/84/97/565378497.db2.gz YSSKXDUCSRUXLN-GWCFXTLKSA-N 0 0 382.825 3.091 20 5 GGBDRN Cn1ccnc1[C@H]1N(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1(C)C ZINC000297627790 565380165 /nfs/dbraw/zinc/38/01/65/565380165.db2.gz BZMZJWCOBNHRMF-CYBMUJFWSA-N 0 0 393.241 3.314 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2nccs2)C(F)(F)F)c1 ZINC000297633589 565380274 /nfs/dbraw/zinc/38/02/74/565380274.db2.gz CEAXOEVWCWICTK-LLVKDONJSA-N 0 0 375.328 3.483 20 5 GGBDRN COCCCn1cc(C)c(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)n1 ZINC000297661809 565380889 /nfs/dbraw/zinc/38/08/89/565380889.db2.gz GEBGBDMRVAKCOJ-UHFFFAOYSA-N 0 0 397.229 3.151 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000274793351 565381782 /nfs/dbraw/zinc/38/17/82/565381782.db2.gz ZBXFWGTUBFCNLM-UHFFFAOYSA-N 0 0 378.734 3.161 20 5 GGBDRN CN(Cc1c([N+](=O)[O-])ncn1C)[C@@H]1CCOc2ccc(Br)cc21 ZINC000375357727 565382852 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O=C1[C@@H](Nc2nc3sccn3c2[N+](=O)[O-])CCN1c1ccc(Cl)cc1 ZINC000301329319 565479608 /nfs/dbraw/zinc/47/96/08/565479608.db2.gz ABMAHYACDPCTOG-NSHDSACASA-N 0 0 377.813 3.175 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1NC[C@@H](O)COc1ccc(F)cc1 ZINC000301353394 565479942 /nfs/dbraw/zinc/47/99/42/565479942.db2.gz NNQBFPAIXWVCCM-GFCCVEGCSA-N 0 0 385.189 3.348 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1NCc1ccc(O)c(F)c1 ZINC000301345832 565480420 /nfs/dbraw/zinc/48/04/20/565480420.db2.gz GWAQAGQXFLBNHP-UHFFFAOYSA-N 0 0 376.312 3.048 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCC1(c2cccc(Cl)c2)CC1 ZINC000301352412 565480810 /nfs/dbraw/zinc/48/08/10/565480810.db2.gz KXDWNGYXVWRTKK-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN Cc1noc(C)c1CN1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000301366053 565481294 /nfs/dbraw/zinc/48/12/94/565481294.db2.gz NPCMZYTUPLPXSD-UHFFFAOYSA-N 0 0 395.257 3.284 20 5 GGBDRN O=C(c1ccccc1)N1CCN(c2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000301369451 565481487 /nfs/dbraw/zinc/48/14/87/565481487.db2.gz UMWCCFBULNPQEG-UHFFFAOYSA-N 0 0 390.237 3.320 20 5 GGBDRN CS(=O)(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000172357226 565481615 /nfs/dbraw/zinc/48/16/15/565481615.db2.gz QFIULXWQDDDESM-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN CNC(=O)c1ccc(NC[C@H](O)c2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000301370878 565481848 /nfs/dbraw/zinc/48/18/48/565481848.db2.gz STNWCTCAWPKZQU-AWEZNQCLSA-N 0 0 384.219 3.407 20 5 GGBDRN NS(=O)(=O)c1ccc(NCC2(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1 ZINC000301379016 565482971 /nfs/dbraw/zinc/48/29/71/565482971.db2.gz XYDCMRSQKIJJCV-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301396755 565483558 /nfs/dbraw/zinc/48/35/58/565483558.db2.gz NEXODNUELKRHHS-GXSJLCMTSA-N 0 0 377.260 3.125 20 5 GGBDRN CC(C)C(=O)NC[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301399672 565483684 /nfs/dbraw/zinc/48/36/84/565483684.db2.gz HZZUWAUDTGOEGO-LBPRGKRZSA-N 0 0 384.274 3.346 20 5 GGBDRN O=[N+]([O-])c1cnc(NCCS(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1 ZINC000172409034 565484110 /nfs/dbraw/zinc/48/41/10/565484110.db2.gz KNHDXLCSALLIGL-UHFFFAOYSA-N 0 0 376.221 3.182 20 5 GGBDRN O=C(COc1cccc(Br)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172425215 565484706 /nfs/dbraw/zinc/48/47/06/565484706.db2.gz RRCMTUTYOZEVJB-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000172423863 565484881 /nfs/dbraw/zinc/48/48/81/565484881.db2.gz OPKKGYGIRMKXBP-CYBMUJFWSA-N 0 0 377.447 3.119 20 5 GGBDRN CC(C)c1nnc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2Br)[nH]1 ZINC000277247848 565484890 /nfs/dbraw/zinc/48/48/90/565484890.db2.gz JYCGZMZESKWZNJ-QMMMGPOBSA-N 0 0 382.218 3.090 20 5 GGBDRN CC(C)c1nnc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2Br)[nH]1 ZINC000277247842 565484944 /nfs/dbraw/zinc/48/49/44/565484944.db2.gz JYCGZMZESKWZNJ-MRVPVSSYSA-N 0 0 382.218 3.090 20 5 GGBDRN O=C(c1cccc(I)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172421342 565485141 /nfs/dbraw/zinc/48/51/41/565485141.db2.gz NQTBAZSWUIVBEE-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN CC(C)[C@@H]1CN(c2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])CCS1 ZINC000301413979 565485299 /nfs/dbraw/zinc/48/52/99/565485299.db2.gz ACJHKDJKNDXOTG-ZDUSSCGKSA-N 0 0 380.438 3.169 20 5 GGBDRN Cc1cc(NCc2ccccc2S(=O)(=O)N(C)C)c(Cl)cc1[N+](=O)[O-] ZINC000301438291 565485973 /nfs/dbraw/zinc/48/59/73/565485973.db2.gz KZZMTDKTZRVHMW-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN Cc1nc(CN2CCN(c3ccc([N+](=O)[O-])cc3Br)CC2)oc1C ZINC000301435791 565486076 /nfs/dbraw/zinc/48/60/76/565486076.db2.gz WVVPBMHEHYDXAI-UHFFFAOYSA-N 0 0 395.257 3.284 20 5 GGBDRN Cc1cc(N(C)CC(=O)Nc2ccccc2Br)ncc1[N+](=O)[O-] ZINC000301441191 565486265 /nfs/dbraw/zinc/48/62/65/565486265.db2.gz VQTWQVLWUVYXMP-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN Cc1nc(CNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])sc1C ZINC000301432266 565486333 /nfs/dbraw/zinc/48/63/33/565486333.db2.gz JFVFZFSHHLUZMI-UHFFFAOYSA-N 0 0 377.394 3.277 20 5 GGBDRN Cc1cc(NCCCNC(=O)c2ccc(Br)cc2)ncc1[N+](=O)[O-] ZINC000301433869 565486433 /nfs/dbraw/zinc/48/64/33/565486433.db2.gz LHLUCIVYDJKGMI-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN O=C(NCCCNc1ccc([N+](=O)[O-])cc1Br)c1cccc(O)c1 ZINC000301430707 565486506 /nfs/dbraw/zinc/48/65/06/565486506.db2.gz VJNHAFJEGINCHM-UHFFFAOYSA-N 0 0 394.225 3.295 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N[C@@H]1c2ccccc2C[C@@H]1O ZINC000301442142 565486577 /nfs/dbraw/zinc/48/65/77/565486577.db2.gz NLWPCCFUAGZMTL-LSDHHAIUSA-N 0 0 396.184 3.270 20 5 GGBDRN Cc1nsc(N2CCCN(c3ccc([N+](=O)[O-])cc3Br)CC2)n1 ZINC000301450354 565486917 /nfs/dbraw/zinc/48/69/17/565486917.db2.gz FQQPFHBGGQNNDO-UHFFFAOYSA-N 0 0 398.286 3.234 20 5 GGBDRN C[C@@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)S1 ZINC000301461114 565486984 /nfs/dbraw/zinc/48/69/84/565486984.db2.gz IXZAUBGNSCDHMD-DTORHVGOSA-N 0 0 384.401 3.219 20 5 GGBDRN O=[N+]([O-])c1c(N2CCC(n3cc(Br)cn3)CC2)nc2sccn21 ZINC000377594560 565487079 /nfs/dbraw/zinc/48/70/79/565487079.db2.gz XRVSIZIYOJUVMX-UHFFFAOYSA-N 0 0 397.258 3.105 20 5 GGBDRN Cc1cc(NCCOc2ccc(S(C)(=O)=O)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000301450760 565487279 /nfs/dbraw/zinc/48/72/79/565487279.db2.gz SYPPWWSWIMNQQS-UHFFFAOYSA-N 0 0 384.841 3.451 20 5 GGBDRN Cc1cc(NCCCNC(=O)c2cccc(Br)c2)ncc1[N+](=O)[O-] ZINC000301451849 565487750 /nfs/dbraw/zinc/48/77/50/565487750.db2.gz UQDAPHDWRUIVKT-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN CSC(C)(C)CNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000301445701 565487762 /nfs/dbraw/zinc/48/77/62/565487762.db2.gz NUZFSUHJTWLHPB-UHFFFAOYSA-N 0 0 387.527 3.323 20 5 GGBDRN CS[C@H]1CC[C@H](Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)C1 ZINC000301471761 565488515 /nfs/dbraw/zinc/48/85/15/565488515.db2.gz PPMWAFMGNPFDCZ-GWCFXTLKSA-N 0 0 380.857 3.490 20 5 GGBDRN C[C@@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)S1 ZINC000301461116 565488552 /nfs/dbraw/zinc/48/85/52/565488552.db2.gz IXZAUBGNSCDHMD-RKDXNWHRSA-N 0 0 384.401 3.219 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NCc2nc3ccccc3s2)c1[N+](=O)[O-] ZINC000189802110 565489922 /nfs/dbraw/zinc/48/99/22/565489922.db2.gz DFLKIKKDUDBZGV-UHFFFAOYSA-N 0 0 377.447 3.300 20 5 GGBDRN C[C@@H]1CN(c2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)C[C@H](C)S1 ZINC000301484722 565489976 /nfs/dbraw/zinc/48/99/76/565489976.db2.gz YORYTBQBGTXMJX-PHIMTYICSA-N 0 0 380.857 3.124 20 5 GGBDRN CNC(=O)CCOc1ccc(Nc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000301509770 565490634 /nfs/dbraw/zinc/49/06/34/565490634.db2.gz CVBOCYILBSFQFR-UHFFFAOYSA-N 0 0 395.213 3.011 20 5 GGBDRN C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Br)C(=O)N1c1ccccc1 ZINC000301510565 565491118 /nfs/dbraw/zinc/49/11/18/565491118.db2.gz DAEPUNBXYZPCHB-HZMBPMFUSA-N 0 0 391.225 3.358 20 5 GGBDRN Cn1c(CCNc2ncc([N+](=O)[O-])cc2Br)nc2ccc(F)cc21 ZINC000301506824 565491297 /nfs/dbraw/zinc/49/12/97/565491297.db2.gz BPIPIPVLICBQBJ-UHFFFAOYSA-N 0 0 394.204 3.433 20 5 GGBDRN C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)C(=O)N1c1ccccc1 ZINC000301510566 565491451 /nfs/dbraw/zinc/49/14/51/565491451.db2.gz DAEPUNBXYZPCHB-IINYFYTJSA-N 0 0 391.225 3.358 20 5 GGBDRN C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Br)C(=O)N1c1ccccc1 ZINC000301510568 565491525 /nfs/dbraw/zinc/49/15/25/565491525.db2.gz DAEPUNBXYZPCHB-YGRLFVJLSA-N 0 0 391.225 3.358 20 5 GGBDRN O=[N+]([O-])c1cnc(NCC[S@](=O)Cc2ccccc2)c(Br)c1 ZINC000301522819 565492304 /nfs/dbraw/zinc/49/23/04/565492304.db2.gz HPPRXFANVNRVNA-QFIPXVFZSA-N 0 0 384.255 3.113 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccccn3)CC2)c(Br)c1 ZINC000301519535 565492721 /nfs/dbraw/zinc/49/27/21/565492721.db2.gz KVSVIXDAOYLCDC-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN COC(=O)NCc1ccc(Nc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000301520954 565492775 /nfs/dbraw/zinc/49/27/75/565492775.db2.gz GSYHRXPYIMDFGU-UHFFFAOYSA-N 0 0 381.186 3.352 20 5 GGBDRN O=[N+]([O-])c1cnc(Nc2ccc(N3CCOCC3)c(F)c2)c(Br)c1 ZINC000301531943 565493222 /nfs/dbraw/zinc/49/32/22/565493222.db2.gz LJPBIAHVSZIUKS-UHFFFAOYSA-N 0 0 397.204 3.472 20 5 GGBDRN O=C(CNc1ncc([N+](=O)[O-])cc1Br)N1CCCc2ccccc21 ZINC000301536610 565493424 /nfs/dbraw/zinc/49/34/24/565493424.db2.gz MSYUEMZFVHKYOT-UHFFFAOYSA-N 0 0 391.225 3.144 20 5 GGBDRN COc1ccc(Nc2ncc([N+](=O)[O-])cc2Br)cc1NC(C)=O ZINC000301529241 565493440 /nfs/dbraw/zinc/49/34/40/565493440.db2.gz KIWCKGVOURXTHL-UHFFFAOYSA-N 0 0 381.186 3.463 20 5 GGBDRN Cc1ccc(-n2nnnc2Sc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000301531320 565493623 /nfs/dbraw/zinc/49/36/23/565493623.db2.gz LGGHFDURWSHRFA-UHFFFAOYSA-N 0 0 393.226 3.188 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCN2S(=O)(=O)c1ccccc1Br ZINC000172601866 565493762 /nfs/dbraw/zinc/49/37/62/565493762.db2.gz JRXJYUDTLSUKOS-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN COC(=O)c1cc(CNc2ncc([N+](=O)[O-])cc2Br)ccc1OC ZINC000301535344 565493714 /nfs/dbraw/zinc/49/37/14/565493714.db2.gz MHQHDBUPRSHWBL-UHFFFAOYSA-N 0 0 396.197 3.160 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000301538212 565493819 /nfs/dbraw/zinc/49/38/19/565493819.db2.gz NEQKZSZWDUGDCR-UHFFFAOYSA-N 0 0 382.174 3.185 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1N[C@H]1CCCSC1 ZINC000301535413 565493977 /nfs/dbraw/zinc/49/39/77/565493977.db2.gz MIUOOXKNRZXQKU-ZDUSSCGKSA-N 0 0 385.511 3.077 20 5 GGBDRN CN1CCCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000172602978 565494220 /nfs/dbraw/zinc/49/42/20/565494220.db2.gz FLUNJTFTNLNLPG-UHFFFAOYSA-N 0 0 381.841 3.283 20 5 GGBDRN CCN(Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@H](O)C(F)(F)F ZINC000189876230 565494348 /nfs/dbraw/zinc/49/43/48/565494348.db2.gz RGYPVBFZTISUTB-CYBMUJFWSA-N 0 0 375.372 3.463 20 5 GGBDRN CCN1CC(=O)N[C@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000189881334 565494590 /nfs/dbraw/zinc/49/45/90/565494590.db2.gz BDLVQXTYBOLPKL-OAHLLOKOSA-N 0 0 380.198 3.068 20 5 GGBDRN COc1cc(OC)c(OC)cc1CNc1ncc([N+](=O)[O-])cc1Br ZINC000301548623 565495261 /nfs/dbraw/zinc/49/52/61/565495261.db2.gz QFOSUUCPLCXZFE-UHFFFAOYSA-N 0 0 398.213 3.390 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNc1ncc([N+](=O)[O-])cc1Br ZINC000301570005 565495745 /nfs/dbraw/zinc/49/57/45/565495745.db2.gz WNNWWNODQMFHAL-UHFFFAOYSA-N 0 0 379.214 3.420 20 5 GGBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)c1ccc2c(c1)NC(=O)CO2 ZINC000301560449 565496400 /nfs/dbraw/zinc/49/64/00/565496400.db2.gz UEDGSHDBRBSMEH-QMMMGPOBSA-N 0 0 393.197 3.256 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NCc2nc(C(C)(C)C)cs2)c1[N+](=O)[O-] ZINC000189949451 565498391 /nfs/dbraw/zinc/49/83/91/565498391.db2.gz RWFTXUGSALORSG-UHFFFAOYSA-N 0 0 383.495 3.444 20 5 GGBDRN CC(C)CO[C@H]1CCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000301622576 565499525 /nfs/dbraw/zinc/49/95/25/565499525.db2.gz DYKJFBWQLVBWJX-LBPRGKRZSA-N 0 0 390.221 3.451 20 5 GGBDRN C[C@H](Nc1cc(Br)ccc1[N+](=O)[O-])C(=O)NCc1ccccc1 ZINC000301636323 565500854 /nfs/dbraw/zinc/50/08/54/565500854.db2.gz ABDSZBLQZCDLTI-NSHDSACASA-N 0 0 378.226 3.474 20 5 GGBDRN CN(c1ncc([N+](=O)[O-])c(N)n1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000301630646 565500956 /nfs/dbraw/zinc/50/09/56/565500956.db2.gz SQUYTDBUDVIRMF-SNVBAGLBSA-N 0 0 396.270 3.403 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCc2nccs2)nc1NCCc1nccs1 ZINC000189977529 565501041 /nfs/dbraw/zinc/50/10/41/565501041.db2.gz ILKVLMULEYCMNK-UHFFFAOYSA-N 0 0 376.467 3.212 20 5 GGBDRN C[C@H]1Oc2ccc(Nc3ncc(Br)cc3[N+](=O)[O-])cc2NC1=O ZINC000301631456 565501145 /nfs/dbraw/zinc/50/11/45/565501145.db2.gz BQCKUMFLIIERNH-SSDOTTSWSA-N 0 0 379.170 3.215 20 5 GGBDRN CN(c1ncc([N+](=O)[O-])c(N)n1)[C@H]1CCSc2ccc(Br)cc21 ZINC000301630645 565501258 /nfs/dbraw/zinc/50/12/58/565501258.db2.gz SQUYTDBUDVIRMF-JTQLQIEISA-N 0 0 396.270 3.403 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CNc1ccc([N+](=O)[O-])c(C)n1 ZINC000301653160 565502183 /nfs/dbraw/zinc/50/21/83/565502183.db2.gz QXMHCRGMJOTHGX-UHFFFAOYSA-N 0 0 379.214 3.420 20 5 GGBDRN C[C@@]1(CNc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)CCCS1 ZINC000301658229 565502190 /nfs/dbraw/zinc/50/21/90/565502190.db2.gz WFLAOCPVPWTULY-INIZCTEOSA-N 0 0 380.857 3.492 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(NCc2ccc([S@](C)=O)cc2)cc1Cl ZINC000301654338 565502199 /nfs/dbraw/zinc/50/21/99/565502199.db2.gz HIPJEXAQJLCTSL-VWLOTQADSA-N 0 0 382.825 3.384 20 5 GGBDRN Cc1nc(NCCCNC(=O)c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000301642661 565502318 /nfs/dbraw/zinc/50/23/18/565502318.db2.gz MRODFZMWPVZBQU-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCC([C@H](O)C(F)(F)F)CC2)c(Br)c1 ZINC000301660304 565502456 /nfs/dbraw/zinc/50/24/56/565502456.db2.gz CKCUITRQIZKFDF-LBPRGKRZSA-N 0 0 383.164 3.497 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCNC(=O)[C@@H]1c1cccs1 ZINC000377875915 565502647 /nfs/dbraw/zinc/50/26/47/565502647.db2.gz UUIANDOZNRRYIE-ZDUSSCGKSA-N 0 0 380.813 3.015 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000301676416 565503146 /nfs/dbraw/zinc/50/31/46/565503146.db2.gz HQJCTOKHZPLLSO-CQSZACIVSA-N 0 0 382.189 3.469 20 5 GGBDRN Cc1cc([C@H]2CCCN2S(=O)(=O)c2cc(Cl)c([N+](=O)[O-])cc2F)no1 ZINC000377888838 565503620 /nfs/dbraw/zinc/50/36/20/565503620.db2.gz MEIMSJCXEMQASQ-GFCCVEGCSA-N 0 0 389.792 3.210 20 5 GGBDRN CO[C@@H]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2Cl)CC1 ZINC000377888653 565503791 /nfs/dbraw/zinc/50/37/91/565503791.db2.gz KWJUNMSOOPOGOO-SECBINFHSA-N 0 0 383.253 3.091 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@@]1(O)CCCc2ccccc21 ZINC000301686074 565504289 /nfs/dbraw/zinc/50/42/89/565504289.db2.gz LOJWHUGHYHRUDU-INIZCTEOSA-N 0 0 378.226 3.388 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCN(CC(F)(F)F)C2)cc1Cl ZINC000301688805 565504570 /nfs/dbraw/zinc/50/45/70/565504570.db2.gz VSAMRFJIACLIOF-MRVPVSSYSA-N 0 0 381.738 3.083 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@]1(O)CCCc2ccccc21 ZINC000301686076 565504573 /nfs/dbraw/zinc/50/45/73/565504573.db2.gz LOJWHUGHYHRUDU-MRXNPFEDSA-N 0 0 378.226 3.388 20 5 GGBDRN COC(=O)NCc1ccc(Nc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000301681151 565504607 /nfs/dbraw/zinc/50/46/07/565504607.db2.gz JRGHRGPMNVUNBH-UHFFFAOYSA-N 0 0 381.186 3.352 20 5 GGBDRN COc1ccc(C(=O)NCCNc2cc(Br)ccc2[N+](=O)[O-])cc1 ZINC000301690884 565504935 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Cc1ccc([N+](=O)[O-])c(C(=O)NCC(=O)Nc2ccc(Br)cc2)c1 ZINC000172837811 565506412 /nfs/dbraw/zinc/50/64/12/565506412.db2.gz WIYBCKHJNBUQAZ-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN C[C@@H](Oc1cccc(Br)c1)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000172846562 565507476 /nfs/dbraw/zinc/50/74/76/565507476.db2.gz PSRMSGXEIZOESU-LLVKDONJSA-N 0 0 379.210 3.441 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCOc1cccc(Br)c1 ZINC000172864042 565508215 /nfs/dbraw/zinc/50/82/15/565508215.db2.gz WMOTUKHQMJDENN-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN CN(CC(=O)Nc1ccc(Br)cn1)c1ccc([N+](=O)[O-])cc1Cl ZINC000301746743 565508272 /nfs/dbraw/zinc/50/82/72/565508272.db2.gz QDGROYOKKAOFFC-UHFFFAOYSA-N 0 0 399.632 3.481 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000301730534 565508314 /nfs/dbraw/zinc/50/83/14/565508314.db2.gz XHFDGAMZBGUMEM-GFCCVEGCSA-N 0 0 383.164 3.497 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N(C)CC(=O)Nc2ccc(Br)cn2)c1 ZINC000301738590 565508481 /nfs/dbraw/zinc/50/84/81/565508481.db2.gz 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ZINC000301827963 565511500 /nfs/dbraw/zinc/51/15/00/565511500.db2.gz PZSXYBCDAVLLGN-UHFFFAOYSA-N 0 0 398.286 3.152 20 5 GGBDRN Cc1cccc(CN2CCN(c3c(Br)cncc3[N+](=O)[O-])CC2)c1 ZINC000301826551 565511779 /nfs/dbraw/zinc/51/17/79/565511779.db2.gz FEZBYQYPQZHCEU-UHFFFAOYSA-N 0 0 391.269 3.383 20 5 GGBDRN Cc1cc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ncc1Br ZINC000301820220 565512413 /nfs/dbraw/zinc/51/24/13/565512413.db2.gz JJCLANCEHTWTSJ-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCOc2ccc(Cl)cc21 ZINC000172901996 565512455 /nfs/dbraw/zinc/51/24/55/565512455.db2.gz SRRSYMJJHCDFTA-UHFFFAOYSA-N 0 0 389.216 3.489 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCN(c2ccccc2F)CC1 ZINC000301845256 565512775 /nfs/dbraw/zinc/51/27/75/565512775.db2.gz STBQTXKGAOLXKD-UHFFFAOYSA-N 0 0 381.205 3.218 20 5 GGBDRN COc1cc2c(cc1OC)CN(c1c(Br)cncc1[N+](=O)[O-])CC2 ZINC000301843478 565512977 /nfs/dbraw/zinc/51/29/77/565512977.db2.gz RKJBXSTWKJJGFZ-UHFFFAOYSA-N 0 0 394.225 3.332 20 5 GGBDRN COc1ccccc1N1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000301838766 565513018 /nfs/dbraw/zinc/51/30/18/565513018.db2.gz NPLLDTXABHLGQE-UHFFFAOYSA-N 0 0 393.241 3.088 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCNc1c(Br)cncc1[N+](=O)[O-] ZINC000301839368 565513618 /nfs/dbraw/zinc/51/36/18/565513618.db2.gz OBBWGODXMWCGAR-UHFFFAOYSA-N 0 0 382.174 3.185 20 5 GGBDRN CC(=O)Nc1ccc(Br)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172937000 565513747 /nfs/dbraw/zinc/51/37/47/565513747.db2.gz UZRQANJKNHYZQT-UHFFFAOYSA-N 0 0 392.209 3.497 20 5 GGBDRN CCSc1cc(CNS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])ccn1 ZINC000190170347 565513782 /nfs/dbraw/zinc/51/37/82/565513782.db2.gz YUNODNKQPVUGMB-UHFFFAOYSA-N 0 0 381.479 3.197 20 5 GGBDRN C[C@@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])CCN1CC(F)(F)F ZINC000301854132 565514200 /nfs/dbraw/zinc/51/42/00/565514200.db2.gz CHGSUDOHZDVRRS-SECBINFHSA-N 0 0 382.180 3.430 20 5 GGBDRN CC(C)NC(=O)[C@@H]1CCC[C@H](Nc2c(Br)cncc2[N+](=O)[O-])C1 ZINC000301852000 565514450 /nfs/dbraw/zinc/51/44/50/565514450.db2.gz ATGJYXCAXXHDPN-MNOVXSKESA-N 0 0 385.262 3.248 20 5 GGBDRN CN(CCc1nccs1)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000277687305 565514646 /nfs/dbraw/zinc/51/46/46/565514646.db2.gz ALIZBNCNKUBYFM-UHFFFAOYSA-N 0 0 376.257 3.190 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000301847849 565514658 /nfs/dbraw/zinc/51/46/58/565514658.db2.gz VDFDFIJEWRVFKV-CQSZACIVSA-N 0 0 382.189 3.469 20 5 GGBDRN Cc1ncc(CN(C)C(=O)c2sc(Br)cc2[N+](=O)[O-])s1 ZINC000277709775 565514993 /nfs/dbraw/zinc/51/49/93/565514993.db2.gz IPAZNXPSDQZQNL-UHFFFAOYSA-N 0 0 376.257 3.456 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3cc(Cl)ccc3C2)cc1[N+](=O)[O-] ZINC000190203545 565515234 /nfs/dbraw/zinc/51/52/34/565515234.db2.gz LULDVAWGDBFKCQ-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN O=C(NCCCNc1c(Br)cncc1[N+](=O)[O-])c1cccs1 ZINC000301873905 565515440 /nfs/dbraw/zinc/51/54/40/565515440.db2.gz IAGHOGSFJZJAIS-UHFFFAOYSA-N 0 0 385.243 3.046 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3cc(Cl)ccc3C2)c([N+](=O)[O-])c1 ZINC000190203712 565515669 /nfs/dbraw/zinc/51/56/69/565515669.db2.gz XVQKEMZBASINSB-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN Cc1nn(C)cc1[C@@H]1CCCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000378193772 565515788 /nfs/dbraw/zinc/51/57/88/565515788.db2.gz ZODIBLMLVXNDOF-HNNXBMFYSA-N 0 0 393.241 3.377 20 5 GGBDRN Cc1nn(C)cc1[C@H]1CCCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000378193777 565515918 /nfs/dbraw/zinc/51/59/18/565515918.db2.gz ZODIBLMLVXNDOF-OAHLLOKOSA-N 0 0 393.241 3.377 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCc2cc(Cl)ccc2C1 ZINC000190209150 565516113 /nfs/dbraw/zinc/51/61/13/565516113.db2.gz HRZASLISUYXGKR-UHFFFAOYSA-N 0 0 380.853 3.179 20 5 GGBDRN COc1ccc(Br)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000172956893 565516158 /nfs/dbraw/zinc/51/61/58/565516158.db2.gz DFNIZEYOHMLVFK-UHFFFAOYSA-N 0 0 394.225 3.441 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCc3cc(Cl)ccc3C2)cc1 ZINC000190209480 565516452 /nfs/dbraw/zinc/51/64/52/565516452.db2.gz NZBMUVYHEZOABX-UHFFFAOYSA-N 0 0 380.853 3.179 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000301884910 565516517 /nfs/dbraw/zinc/51/65/17/565516517.db2.gz LTBVFOJAAGWBQX-RYUDHWBXSA-N 0 0 399.289 3.274 20 5 GGBDRN CN(Cc1nc2ccccc2n1C)c1c(Br)cncc1[N+](=O)[O-] ZINC000301889112 565516601 /nfs/dbraw/zinc/51/66/01/565516601.db2.gz NGFQXASACPCWMD-UHFFFAOYSA-N 0 0 376.214 3.275 20 5 GGBDRN CS(=O)(=O)c1cccc(NCc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000301895705 565516688 /nfs/dbraw/zinc/51/66/88/565516688.db2.gz YGRAXVQSFNCXNO-UHFFFAOYSA-N 0 0 385.239 3.373 20 5 GGBDRN COc1ccc(CN(C)c2c(Br)cncc2[N+](=O)[O-])c(OC)c1 ZINC000301890095 565516840 /nfs/dbraw/zinc/51/68/40/565516840.db2.gz NTBKUBLMUJSNTN-UHFFFAOYSA-N 0 0 382.214 3.406 20 5 GGBDRN O=C(CC1CCCCC1)NCCNc1c(Br)cncc1[N+](=O)[O-] ZINC000301892451 565516975 /nfs/dbraw/zinc/51/69/75/565516975.db2.gz OPOJMVMBAUEACL-UHFFFAOYSA-N 0 0 385.262 3.251 20 5 GGBDRN COc1cccc2c1OC[C@@H](Nc1c(Br)cncc1[N+](=O)[O-])C2 ZINC000301897601 565517060 /nfs/dbraw/zinc/51/70/60/565517060.db2.gz RILZYVXTDDOGTF-JTQLQIEISA-N 0 0 380.198 3.177 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)n1 ZINC000190236468 565517248 /nfs/dbraw/zinc/51/72/48/565517248.db2.gz LFIHFIKOBYIAID-JTQLQIEISA-N 0 0 381.435 3.267 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC[C@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000378256751 565517845 /nfs/dbraw/zinc/51/78/45/565517845.db2.gz YAOFFQPDVXCPPY-NWDGAFQWSA-N 0 0 383.242 3.164 20 5 GGBDRN C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Br)CCN1CC(F)(F)F ZINC000301899364 565518053 /nfs/dbraw/zinc/51/80/53/565518053.db2.gz XXNJXKUAIFHGCD-SECBINFHSA-N 0 0 382.180 3.430 20 5 GGBDRN CS(=O)(=O)CCOc1ccc(Cl)cc1NCc1cccc([N+](=O)[O-])c1 ZINC000172993189 565518328 /nfs/dbraw/zinc/51/83/28/565518328.db2.gz URPSAQPVOYHEQQ-UHFFFAOYSA-N 0 0 384.841 3.284 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301931458 565518492 /nfs/dbraw/zinc/51/84/92/565518492.db2.gz LOYKOVAQPJREKS-MFKMUULPSA-N 0 0 376.500 3.313 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCO[C@]2(CCc3ccccc32)C1 ZINC000301932625 565518922 /nfs/dbraw/zinc/51/89/22/565518922.db2.gz PLIMMMZLFXQVNY-QGZVFWFLSA-N 0 0 390.237 3.431 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCN(Cc2cccc(F)c2)CC1 ZINC000301925537 565519199 /nfs/dbraw/zinc/51/91/99/565519199.db2.gz MNHKWHCNTGXQNM-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2ccc(Br)cc2)s1 ZINC000301931228 565519235 /nfs/dbraw/zinc/51/92/35/565519235.db2.gz LMRYRNYOTRSZHH-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2c(F)cccc2OC(F)F)s1 ZINC000301943394 565519663 /nfs/dbraw/zinc/51/96/63/565519663.db2.gz YGZRZGCZHNRESI-UHFFFAOYSA-N 0 0 396.368 3.412 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](C2CCOCC2)C1 ZINC000378293242 565519797 /nfs/dbraw/zinc/51/97/97/565519797.db2.gz SVGPIJJLSBLTON-AWEZNQCLSA-N 0 0 397.269 3.175 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301934336 565520062 /nfs/dbraw/zinc/52/00/62/565520062.db2.gz OGUFJAYWMLSHOC-LBPRGKRZSA-N 0 0 382.463 3.410 20 5 GGBDRN CCOC[C@@H]1CCCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])C1 ZINC000277788538 565520210 /nfs/dbraw/zinc/52/02/10/565520210.db2.gz UYPYACJCWUKIDR-SECBINFHSA-N 0 0 377.260 3.308 20 5 GGBDRN CC[C@@H](C)c1nnc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000277789238 565520684 /nfs/dbraw/zinc/52/06/84/565520684.db2.gz JTODSUWZEAFQOE-BDAKNGLRSA-N 0 0 396.245 3.480 20 5 GGBDRN COc1ccc2c(c1)OC[C@H](Nc1ncc(Br)cc1[N+](=O)[O-])C2 ZINC000301959339 565520834 /nfs/dbraw/zinc/52/08/34/565520834.db2.gz LWGWGRHPEMDTCA-LLVKDONJSA-N 0 0 380.198 3.177 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)Nc2ncc([N+](=O)[O-])s2)cc1 ZINC000190303442 565520909 /nfs/dbraw/zinc/52/09/09/565520909.db2.gz LPSPOARPHBLEBT-LLVKDONJSA-N 0 0 384.483 3.255 20 5 GGBDRN CC[C@H](C)c1nnc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000277789241 565520971 /nfs/dbraw/zinc/52/09/71/565520971.db2.gz JTODSUWZEAFQOE-DTWKUNHWSA-N 0 0 396.245 3.480 20 5 GGBDRN CCS(=O)(=O)C1CCN(c2cc(C)c([N+](=O)[O-])cc2Br)CC1 ZINC000277804009 565521074 /nfs/dbraw/zinc/52/10/74/565521074.db2.gz HMCCLHQXXSLDIX-UHFFFAOYSA-N 0 0 391.287 3.069 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CN(C)c1ncc([N+](=O)[O-])s1 ZINC000190302432 565521429 /nfs/dbraw/zinc/52/14/29/565521429.db2.gz MPRDKSHARAZPGO-UHFFFAOYSA-N 0 0 385.243 3.197 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@H]1CCCc2c(O)cccc21 ZINC000190341192 565522879 /nfs/dbraw/zinc/52/28/79/565522879.db2.gz SOMJBIMKRLNUGB-ZDUSSCGKSA-N 0 0 382.825 3.310 20 5 GGBDRN CCC1(CC)[C@H](Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])[C@H](C)[C@@H]1OC ZINC000301979064 565523062 /nfs/dbraw/zinc/52/30/62/565523062.db2.gz OQCCDGKSNAFWNP-BIMULSAOSA-N 0 0 376.500 3.311 20 5 GGBDRN O=C(NCCNc1c(Br)cncc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000301990384 565523539 /nfs/dbraw/zinc/52/35/39/565523539.db2.gz PBZANYXBJOUJAG-UHFFFAOYSA-N 0 0 399.632 3.248 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCCc3c(O)cccc32)c(Cl)c1 ZINC000190341113 565523572 /nfs/dbraw/zinc/52/35/72/565523572.db2.gz LWKHREMCVZLZOR-AWEZNQCLSA-N 0 0 382.825 3.310 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(Br)cc2C)no1 ZINC000277852888 565523818 /nfs/dbraw/zinc/52/38/18/565523818.db2.gz ARVADXCDRBXDIJ-UHFFFAOYSA-N 0 0 392.213 3.463 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccc(F)cn3)CC2)c(Br)c1 ZINC000302013179 565525869 /nfs/dbraw/zinc/52/58/69/565525869.db2.gz ZWHOFKLGADZISD-UHFFFAOYSA-N 0 0 381.205 3.218 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(Br)c(C)c2)no1 ZINC000277867302 565526228 /nfs/dbraw/zinc/52/62/28/565526228.db2.gz KBYGEMVFQRLFHT-UHFFFAOYSA-N 0 0 392.213 3.463 20 5 GGBDRN CC1(C)C[C@@H](Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])C(C)(C)O1 ZINC000302042227 565526851 /nfs/dbraw/zinc/52/68/51/565526851.db2.gz LUALJHMXHSSRSX-GFCCVEGCSA-N 0 0 378.397 3.349 20 5 GGBDRN CC(C)(CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)c1ccccc1Cl ZINC000302055268 565528396 /nfs/dbraw/zinc/52/83/96/565528396.db2.gz AAFLGDVNOZQFPN-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN O=C(Nc1cnc2c(c1)COCC2)c1ccc([N+](=O)[O-])cc1Br ZINC000378476556 565528650 /nfs/dbraw/zinc/52/86/50/565528650.db2.gz USRVPLDYCQSPTA-UHFFFAOYSA-N 0 0 378.182 3.077 20 5 GGBDRN CC(C)(CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)c1cccc(Cl)c1 ZINC000302085010 565529180 /nfs/dbraw/zinc/52/91/80/565529180.db2.gz KKRKZABOWPHYHX-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCS[C@@H]2COCC[C@H]21 ZINC000378458477 565529223 /nfs/dbraw/zinc/52/92/23/565529223.db2.gz FEWOAWQPOUTAMP-GDBMZVCRSA-N 0 0 382.507 3.442 20 5 GGBDRN CN(Cc1cccc(Cl)c1Cl)c1cc([N+](=O)[O-])ccc1S(N)(=O)=O ZINC000302097038 565529920 /nfs/dbraw/zinc/52/99/20/565529920.db2.gz OOBGKQDYOFFLAC-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN CS(=O)(=O)c1ccc(NCc2cc(Cl)cc3c2OCC3)c([N+](=O)[O-])c1 ZINC000302127043 565531822 /nfs/dbraw/zinc/53/18/22/565531822.db2.gz IVTWCGZONZHABW-UHFFFAOYSA-N 0 0 382.825 3.199 20 5 GGBDRN C[C@H](CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000302113505 565531946 /nfs/dbraw/zinc/53/19/46/565531946.db2.gz BMKICJXYSTXCSE-MRVPVSSYSA-N 0 0 377.394 3.263 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCCSc1ccc(Cl)cc1 ZINC000302118503 565532018 /nfs/dbraw/zinc/53/20/18/565532018.db2.gz XCKYJAQQJILYBE-UHFFFAOYSA-N 0 0 387.870 3.100 20 5 GGBDRN C[C@@H](CNC(=O)c1sc(Br)cc1[N+](=O)[O-])c1nccs1 ZINC000277988658 565532324 /nfs/dbraw/zinc/53/23/24/565532324.db2.gz GQBPBONYIXNWLJ-LURJTMIESA-N 0 0 376.257 3.409 20 5 GGBDRN CC(C)[C@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])N1CCCCCC1 ZINC000302138667 565532595 /nfs/dbraw/zinc/53/25/95/565532595.db2.gz DTDFBOQIGQUUNT-AWEZNQCLSA-N 0 0 389.543 3.372 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@H]2c2ncc[nH]2)cc1[N+](=O)[O-] ZINC000378521792 565532687 /nfs/dbraw/zinc/53/26/87/565532687.db2.gz VTCJZYUZPLBTMC-LBPRGKRZSA-N 0 0 379.214 3.366 20 5 GGBDRN CC(C)(CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000302147039 565532676 /nfs/dbraw/zinc/53/26/76/565532676.db2.gz RPGZDBHNJFVKGF-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN NS(=O)(=O)c1cccc(N[C@H]2C[C@@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000302146362 565533012 /nfs/dbraw/zinc/53/30/12/565533012.db2.gz RISOOIJPTZZKDD-UFBFGSQYSA-N 0 0 385.804 3.003 20 5 GGBDRN Cc1occc1-c1nnc(Sc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])o1 ZINC000302143406 565533025 /nfs/dbraw/zinc/53/30/25/565533025.db2.gz GCOFZSVCSKBTOS-UHFFFAOYSA-N 0 0 387.420 3.162 20 5 GGBDRN NS(=O)(=O)c1cccc(N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000302146361 565533042 /nfs/dbraw/zinc/53/30/42/565533042.db2.gz RISOOIJPTZZKDD-QPUJVOFHSA-N 0 0 385.804 3.003 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2cc(Br)ccc2OC(F)F)nc1 ZINC000302169886 565533462 /nfs/dbraw/zinc/53/34/62/565533462.db2.gz UBCCHRSFKNNFTG-UHFFFAOYSA-N 0 0 375.129 3.361 20 5 GGBDRN NS(=O)(=O)c1cccc(Nc2ccc(CC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000302156488 565533611 /nfs/dbraw/zinc/53/36/11/565533611.db2.gz WINHBSVJCVAZBL-UHFFFAOYSA-N 0 0 375.328 3.091 20 5 GGBDRN NS(=O)(=O)c1cccc(Nc2cccc(CC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000302154764 565533787 /nfs/dbraw/zinc/53/37/87/565533787.db2.gz VPDKRVRABZQGMF-UHFFFAOYSA-N 0 0 375.328 3.091 20 5 GGBDRN NS(=O)(=O)c1cccc(NCC2(c3ccccc3Cl)CC2)c1[N+](=O)[O-] ZINC000302160384 565534222 /nfs/dbraw/zinc/53/42/22/565534222.db2.gz OXIXMXPKOHHRAE-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN NS(=O)(=O)c1cccc(Sc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000302163948 565534241 /nfs/dbraw/zinc/53/42/41/565534241.db2.gz ZGMPPKIJAUCIEN-UHFFFAOYSA-N 0 0 389.252 3.156 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1sc(Br)cc1[N+](=O)[O-] ZINC000278009439 565534350 /nfs/dbraw/zinc/53/43/50/565534350.db2.gz IHTBLMLEKHJQER-HFKOZYHYSA-N 0 0 387.255 3.106 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1sc(Br)cc1[N+](=O)[O-] ZINC000278009453 565534446 /nfs/dbraw/zinc/53/44/46/565534446.db2.gz IHTBLMLEKHJQER-UPZJHPNMSA-N 0 0 387.255 3.106 20 5 GGBDRN CCCCCNC(=O)Cc1noc(-c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000278013054 565534596 /nfs/dbraw/zinc/53/45/96/565534596.db2.gz VJLVCCXZFNTXOT-UHFFFAOYSA-N 0 0 397.229 3.256 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000302172669 565535020 /nfs/dbraw/zinc/53/50/20/565535020.db2.gz AXIMNVQWJKKYCQ-NSHDSACASA-N 0 0 386.246 3.310 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000173193837 565535227 /nfs/dbraw/zinc/53/52/27/565535227.db2.gz NEZCQCBTUUZTRD-VIFPVBQESA-N 0 0 377.260 3.085 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000302184726 565535308 /nfs/dbraw/zinc/53/53/08/565535308.db2.gz GYJPNTXTQPZMPP-NSHDSACASA-N 0 0 386.246 3.310 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000302184723 565535362 /nfs/dbraw/zinc/53/53/62/565535362.db2.gz GYJPNTXTQPZMPP-LLVKDONJSA-N 0 0 386.246 3.310 20 5 GGBDRN C[C@H](NC(=O)c1sc(Br)cc1[N+](=O)[O-])C(=O)OC1CCCC1 ZINC000278032468 565535471 /nfs/dbraw/zinc/53/54/71/565535471.db2.gz BJAZVXLRPUSEFU-ZETCQYMHSA-N 0 0 391.243 3.023 20 5 GGBDRN C[C@@H]1C[C@@H](CCNC(=O)c2sc(Br)cc2[N+](=O)[O-])CCO1 ZINC000278036477 565535550 /nfs/dbraw/zinc/53/55/50/565535550.db2.gz KPDFHHZSEJWYHP-BDAKNGLRSA-N 0 0 377.260 3.354 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1NCc1cccc(N2CCCS2(=O)=O)c1 ZINC000302191160 565535922 /nfs/dbraw/zinc/53/59/22/565535922.db2.gz YUXWUFFNJNKXEO-UHFFFAOYSA-N 0 0 381.841 3.400 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000302189490 565535996 /nfs/dbraw/zinc/53/59/96/565535996.db2.gz QNCDIYCSQMQNLS-JOYOIKCWSA-N 0 0 385.804 3.003 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cccc([N+](=O)[O-])c1Br ZINC000190501252 565537014 /nfs/dbraw/zinc/53/70/14/565537014.db2.gz RKRXZVZXAFFZHF-GLQYFDAESA-N 0 0 395.253 3.435 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2cccc(Cn3cccn3)c2)s1 ZINC000302202901 565537359 /nfs/dbraw/zinc/53/73/59/565537359.db2.gz VVYWZNXURGSVSB-UHFFFAOYSA-N 0 0 378.435 3.048 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCC1(c2ccccc2Cl)CC1 ZINC000302210534 565537406 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C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000408014112 565590739 /nfs/dbraw/zinc/59/07/39/565590739.db2.gz RVINEWRALOMECN-NXEZZACHSA-N 0 0 377.260 3.024 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCCC[C@@H](C)O)cc2[N+](=O)[O-])n1 ZINC000279036178 565591107 /nfs/dbraw/zinc/59/11/07/565591107.db2.gz CEZPDOXWNZWYJX-LLVKDONJSA-N 0 0 381.479 3.402 20 5 GGBDRN COc1ccc(Br)c(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000316023926 565591763 /nfs/dbraw/zinc/59/17/63/565591763.db2.gz UBIJNPKIEKKBRP-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN CC(=O)N1CCN(c2c(Br)cncc2[N+](=O)[O-])CC12CCCCC2 ZINC000408047071 565591914 /nfs/dbraw/zinc/59/19/14/565591914.db2.gz FQXWOYLFTPQMEK-UHFFFAOYSA-N 0 0 397.273 3.124 20 5 GGBDRN COc1ccc(NS(=O)(=O)c2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000316818452 565592992 /nfs/dbraw/zinc/59/29/92/565592992.db2.gz BZNCNEABYBVGHJ-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC[C@@H](CSc2ccccc2)C1 ZINC000173862101 565594749 /nfs/dbraw/zinc/59/47/49/565594749.db2.gz DCLOQOJJIFRKAU-CQSZACIVSA-N 0 0 378.475 3.398 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000173876450 565595255 /nfs/dbraw/zinc/59/52/55/565595255.db2.gz KPKVNAUKXKVIHB-VWLOTQADSA-N 0 0 382.825 3.393 20 5 GGBDRN O=C(NCc1cc(Br)cc2c1OCC2)c1ccc([N+](=O)[O-])s1 ZINC000318209528 565595441 /nfs/dbraw/zinc/59/54/41/565595441.db2.gz RNMCHTDQVOXCOS-UHFFFAOYSA-N 0 0 383.223 3.284 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1Br ZINC000191329644 565597213 /nfs/dbraw/zinc/59/72/13/565597213.db2.gz CAHKYRZKTNBIRC-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H](C)CC ZINC000173899293 565597396 /nfs/dbraw/zinc/59/73/96/565597396.db2.gz HKSKYVMCZZIYHD-ZANVPECISA-N 0 0 387.230 3.065 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC(C)(C)[C@@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000408206562 565599028 /nfs/dbraw/zinc/59/90/28/565599028.db2.gz OUCZPZUVUZXOTF-GJZGRUSLSA-N 0 0 388.873 3.135 20 5 GGBDRN C[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1ccc(Cl)cc1 ZINC000173933183 565601003 /nfs/dbraw/zinc/60/10/03/565601003.db2.gz SYKJNXZOXRXTMN-LBPRGKRZSA-N 0 0 384.841 3.135 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2ccccc2Br)cc1C ZINC000320481104 565601914 /nfs/dbraw/zinc/60/19/14/565601914.db2.gz FASBXLGVGHWGHT-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(F)c(Br)c(Cl)c1 ZINC000320669305 565602960 /nfs/dbraw/zinc/60/29/60/565602960.db2.gz JGJLXNHHDSICKY-UHFFFAOYSA-N 0 0 389.568 3.379 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1cccc(Br)c1 ZINC000321129218 565604011 /nfs/dbraw/zinc/60/40/11/565604011.db2.gz MCIDAHSPNLXXBY-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Cc1cc(N2C[C@@H](C)O[C@]3(CCCOC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000408336499 565604204 /nfs/dbraw/zinc/60/42/04/565604204.db2.gz AVMZVUZAQFJSGW-MLGOLLRUSA-N 0 0 385.258 3.440 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nc([C@@H](C)OCC(C)C)no1 ZINC000174015647 565606858 /nfs/dbraw/zinc/60/68/58/565606858.db2.gz IHEFFGBBYZNEGP-MRVPVSSYSA-N 0 0 388.222 3.027 20 5 GGBDRN CO[C@H](C)c1nc(CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cs1 ZINC000279314569 565607001 /nfs/dbraw/zinc/60/70/01/565607001.db2.gz OTXCRIPQQKHDTB-MRVPVSSYSA-N 0 0 387.820 3.410 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCSC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000408388519 565607048 /nfs/dbraw/zinc/60/70/48/565607048.db2.gz DJUHHYVSKZICIQ-UHFFFAOYSA-N 0 0 386.495 3.044 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCSC3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000408389803 565607535 /nfs/dbraw/zinc/60/75/35/565607535.db2.gz OHWAQRLFUORHRW-UHFFFAOYSA-N 0 0 386.495 3.044 20 5 GGBDRN Cc1cc(C)c(C(=O)Cn2cc([N+](=O)[O-])cc(Br)c2=O)cc1C ZINC000322303456 565609481 /nfs/dbraw/zinc/60/94/81/565609481.db2.gz VNJXXYFKEJQFIZ-UHFFFAOYSA-N 0 0 379.210 3.327 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]3CCC[C@@H]32)c(Br)c1 ZINC000408446646 565609931 /nfs/dbraw/zinc/60/99/31/565609931.db2.gz OHFQDKYQHKDJKX-MFKMUULPSA-N 0 0 389.271 3.311 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000279401330 565611223 /nfs/dbraw/zinc/61/12/23/565611223.db2.gz WEHGXOJONZRQBB-CYBMUJFWSA-N 0 0 395.213 3.195 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(Br)c(C)n2)c([N+](=O)[O-])cc1OC ZINC000174093000 565612147 /nfs/dbraw/zinc/61/21/47/565612147.db2.gz INOQUTCNLGSWMC-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000174099005 565613287 /nfs/dbraw/zinc/61/32/87/565613287.db2.gz KPYAWPSGZLFFBK-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2C)c(Br)c1 ZINC000323520815 565614335 /nfs/dbraw/zinc/61/43/35/565614335.db2.gz UBUTUYGQTQDUFC-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2C)ccc1Br ZINC000323533363 565614435 /nfs/dbraw/zinc/61/44/35/565614435.db2.gz XQHHKXKYFVRPDT-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCc2cc(Br)ccc2C1 ZINC000191590985 565616035 /nfs/dbraw/zinc/61/60/35/565616035.db2.gz CXKCEXMETGRWKS-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN CNc1c(C(=O)NCCc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000324082905 565616930 /nfs/dbraw/zinc/61/69/30/565616930.db2.gz FVUNUVDPBQXKGR-UHFFFAOYSA-N 0 0 378.226 3.372 20 5 GGBDRN COc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1Br ZINC000324528768 565617782 /nfs/dbraw/zinc/61/77/82/565617782.db2.gz SNDBIDGBFRPISD-UHFFFAOYSA-N 0 0 384.161 3.340 20 5 GGBDRN O=C1c2ccc(Br)cc2C(=O)N1Cc1ccc([N+](=O)[O-])cc1F ZINC000324309634 565618057 /nfs/dbraw/zinc/61/80/57/565618057.db2.gz WAHNJNLBSSWNIG-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1cc(Br)cc2c1OCC2 ZINC000325660343 565622653 /nfs/dbraw/zinc/62/26/53/565622653.db2.gz BOQCRWZHZALBDR-UHFFFAOYSA-N 0 0 391.221 3.151 20 5 GGBDRN CN(CCCCCO)C(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000279637075 565624538 /nfs/dbraw/zinc/62/45/38/565624538.db2.gz ZYYVTMFNGIDNCD-UHFFFAOYSA-N 0 0 379.638 3.245 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc2nccnc2c1Br ZINC000326642206 565624793 /nfs/dbraw/zinc/62/47/93/565624793.db2.gz UTSJVLJRUJYOKE-UHFFFAOYSA-N 0 0 387.193 3.482 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2cccc(C)c2Br)c1[N+](=O)[O-] ZINC000191734976 565626701 /nfs/dbraw/zinc/62/67/01/565626701.db2.gz OTVXMZZPINVQGS-UHFFFAOYSA-N 0 0 381.230 3.271 20 5 GGBDRN O=C1CCc2cc(Cl)c(NS(=O)(=O)Cc3ccccc3[N+](=O)[O-])cc21 ZINC000191759771 565629238 /nfs/dbraw/zinc/62/92/38/565629238.db2.gz ARJBKCOLIGHDHA-UHFFFAOYSA-N 0 0 380.809 3.319 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H](C[S@@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000174328649 565629362 /nfs/dbraw/zinc/62/93/62/565629362.db2.gz JFQLPKFTACSGPE-HWRSSNJWSA-N 0 0 378.475 3.166 20 5 GGBDRN C[S@](=O)C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000174368747 565632589 /nfs/dbraw/zinc/63/25/89/565632589.db2.gz LGQQIEHSPLZPPZ-BZQUYTCOSA-N 0 0 381.841 3.490 20 5 GGBDRN CC[C@@H](C)CC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000191832510 565635510 /nfs/dbraw/zinc/63/55/10/565635510.db2.gz BKLJVTXSAXUQBV-SNVBAGLBSA-N 0 0 383.451 3.259 20 5 GGBDRN C[C@@H](O)C[C@H]1CCCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000279862812 565637683 /nfs/dbraw/zinc/63/76/83/565637683.db2.gz SKTLUKKUYKUFLM-MWLCHTKSSA-N 0 0 389.221 3.262 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)s1 ZINC000279928731 565640662 /nfs/dbraw/zinc/64/06/62/565640662.db2.gz FTEHITSYDVZOPS-UHFFFAOYSA-N 0 0 383.451 3.080 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCSc3c(F)cccc32)c(F)c1 ZINC000409861783 565646092 /nfs/dbraw/zinc/64/60/92/565646092.db2.gz KWBDTIVZAPBALY-CYBMUJFWSA-N 0 0 386.401 3.388 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1cc(F)ccc1Br ZINC000191967138 565646538 /nfs/dbraw/zinc/64/65/38/565646538.db2.gz ODVYKRDGXQDXFL-UHFFFAOYSA-N 0 0 389.202 3.438 20 5 GGBDRN Cc1cc(F)cc2c1CN(S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])CC2 ZINC000409925471 565650124 /nfs/dbraw/zinc/65/01/24/565650124.db2.gz QFNIOYCNBTYVIZ-UHFFFAOYSA-N 0 0 384.816 3.443 20 5 GGBDRN CO[C@]1(C)CCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)CC1 ZINC000280095870 565651564 /nfs/dbraw/zinc/65/15/64/565651564.db2.gz AMIYQVOJFRPKSV-OAHLLOKOSA-N 0 0 376.862 3.136 20 5 GGBDRN CO[C@@]1(C)CCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)CC1 ZINC000280095866 565651744 /nfs/dbraw/zinc/65/17/44/565651744.db2.gz AMIYQVOJFRPKSV-HNNXBMFYSA-N 0 0 376.862 3.136 20 5 GGBDRN C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCS1(=O)=O ZINC000192051590 565652920 /nfs/dbraw/zinc/65/29/20/565652920.db2.gz XQFIQSZOUUHOCZ-CYBMUJFWSA-N 0 0 380.491 3.332 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCS(=O)(=O)C1 ZINC000192069869 565655750 /nfs/dbraw/zinc/65/57/50/565655750.db2.gz BGIOWOIZFLURAZ-CYBMUJFWSA-N 0 0 380.491 3.190 20 5 GGBDRN CO[C@@]1(C)CCCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])CC1 ZINC000280161771 565656247 /nfs/dbraw/zinc/65/62/47/565656247.db2.gz YOXSANZIKCIBPL-ZDUSSCGKSA-N 0 0 377.260 3.450 20 5 GGBDRN Cc1cc(CNC(=O)c2ccccc2[N+](=O)[O-])ccc1I ZINC000410032499 565658830 /nfs/dbraw/zinc/65/88/30/565658830.db2.gz IQRIBTCELNWANH-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN Cc1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1I ZINC000410028282 565659248 /nfs/dbraw/zinc/65/92/48/565659248.db2.gz DDRPHWDTCHILLE-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000280239307 565660357 /nfs/dbraw/zinc/66/03/57/565660357.db2.gz WNWNPXWHMPPOPB-UHFFFAOYSA-N 0 0 383.451 3.080 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@H](O)C(F)(F)F ZINC000410061097 565662037 /nfs/dbraw/zinc/66/20/37/565662037.db2.gz CJNAUAODVZMLMA-ZDUSSCGKSA-N 0 0 380.388 3.386 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2nc(C(F)(F)F)cs2)c1 ZINC000174836451 565662769 /nfs/dbraw/zinc/66/27/69/565662769.db2.gz BRTRFSCPRQQUJE-UHFFFAOYSA-N 0 0 375.328 3.051 20 5 GGBDRN C[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000280342343 565666870 /nfs/dbraw/zinc/66/68/70/565666870.db2.gz IKDJOILMAVHXBA-NSHDSACASA-N 0 0 393.241 3.066 20 5 GGBDRN O=c1oc2cc(F)c(Br)cc2n1CCOc1ccccc1[N+](=O)[O-] ZINC000192194278 565667925 /nfs/dbraw/zinc/66/79/25/565667925.db2.gz GAHPLXZPXIDVQM-UHFFFAOYSA-N 0 0 397.156 3.483 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000410166632 565668601 /nfs/dbraw/zinc/66/86/01/565668601.db2.gz WGRXPCRGQIVQEH-MWLCHTKSSA-N 0 0 384.788 3.077 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc(Br)nn1C ZINC000192226626 565671226 /nfs/dbraw/zinc/67/12/26/565671226.db2.gz JDDGOJFINVBFJW-UHFFFAOYSA-N 0 0 381.230 3.142 20 5 GGBDRN C[C@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC2(CCOCC2)O1 ZINC000280469961 565674173 /nfs/dbraw/zinc/67/41/73/565674173.db2.gz MYHGUIVVDRBSSC-LBPRGKRZSA-N 0 0 385.258 3.127 20 5 GGBDRN O=C(CN1CCc2cc(Br)ccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000192248414 565674330 /nfs/dbraw/zinc/67/43/30/565674330.db2.gz UDEWECHDQQYTPA-UHFFFAOYSA-N 0 0 390.237 3.354 20 5 GGBDRN NC(=O)c1ccc(CN2CCc3cc(Br)ccc3C2)c([N+](=O)[O-])c1 ZINC000192253486 565674442 /nfs/dbraw/zinc/67/44/42/565674442.db2.gz AZDIGZIPNKDOAN-UHFFFAOYSA-N 0 0 390.237 3.015 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNCc1ccc(S(=O)(=O)CC)s1 ZINC000280531197 565677892 /nfs/dbraw/zinc/67/78/92/565677892.db2.gz ILFFFCMSVDQVBR-UHFFFAOYSA-N 0 0 384.479 3.138 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](C)c1ccc(Br)cn1 ZINC000280526904 565677990 /nfs/dbraw/zinc/67/79/90/565677990.db2.gz OQPCTMPVHHKCSF-NSHDSACASA-N 0 0 393.241 3.350 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000192338012 565680737 /nfs/dbraw/zinc/68/07/37/565680737.db2.gz OERNYIOTAQGVJU-QMMMGPOBSA-N 0 0 382.214 3.323 20 5 GGBDRN Cc1cnc(OCC(=O)N[C@@H](C)c2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000175135852 565680820 /nfs/dbraw/zinc/68/08/20/565680820.db2.gz LKNRSVRHCBAHKT-NSHDSACASA-N 0 0 394.225 3.317 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCSC2(CCOCC2)C1 ZINC000280565616 565681526 /nfs/dbraw/zinc/68/15/26/565681526.db2.gz VHSSVZXIWCATOV-UHFFFAOYSA-N 0 0 388.848 3.054 20 5 GGBDRN Cc1cnc([C@@H](NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C2CC2)s1 ZINC000175133252 565681594 /nfs/dbraw/zinc/68/15/94/565681594.db2.gz ORPAXHSCLJEIIP-AWEZNQCLSA-N 0 0 381.479 3.406 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(OCC(F)(F)F)c(Cl)c1 ZINC000410396608 565681851 /nfs/dbraw/zinc/68/18/51/565681851.db2.gz CLEVKQUYRSALEH-UHFFFAOYSA-N 0 0 378.694 3.025 20 5 GGBDRN Cc1cccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1Cl ZINC000175152819 565682307 /nfs/dbraw/zinc/68/23/07/565682307.db2.gz WSDLCUQBKKESJU-UHFFFAOYSA-N 0 0 379.825 3.386 20 5 GGBDRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(Br)cn2)ccc1[N+](=O)[O-] ZINC000280622737 565684659 /nfs/dbraw/zinc/68/46/59/565684659.db2.gz ZAQMKYYWJOTHFH-LLVKDONJSA-N 0 0 394.225 3.317 20 5 GGBDRN COc1cc(CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])ccc1O ZINC000175235566 565686833 /nfs/dbraw/zinc/68/68/33/565686833.db2.gz HBQXTUAYSPXEOI-UHFFFAOYSA-N 0 0 395.209 3.044 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)o1 ZINC000175250203 565688383 /nfs/dbraw/zinc/68/83/83/565688383.db2.gz IFGYRFZKXBDVEF-INIZCTEOSA-N 0 0 397.225 3.205 20 5 GGBDRN C[C@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1cccs1 ZINC000175282936 565690224 /nfs/dbraw/zinc/69/02/24/565690224.db2.gz PUSMWELHTFQSFP-JTQLQIEISA-N 0 0 381.841 3.243 20 5 GGBDRN C[C@@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1cccs1 ZINC000175282958 565690304 /nfs/dbraw/zinc/69/03/04/565690304.db2.gz PUSMWELHTFQSFP-SNVBAGLBSA-N 0 0 381.841 3.243 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccoc1Br ZINC000192449800 565692565 /nfs/dbraw/zinc/69/25/65/565692565.db2.gz BLPZHKBLXNLYPD-UHFFFAOYSA-N 0 0 377.154 3.388 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC(C)(C)c2ccc(Br)cc21 ZINC000410824798 565697308 /nfs/dbraw/zinc/69/73/08/565697308.db2.gz MZTSUEVFXPMQDM-UHFFFAOYSA-N 0 0 393.241 3.419 20 5 GGBDRN Cc1nc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])c(Br)s1 ZINC000410856741 565698254 /nfs/dbraw/zinc/69/82/54/565698254.db2.gz ZEVOAWGOWKJLOI-UHFFFAOYSA-N 0 0 384.255 3.437 20 5 GGBDRN C[C@@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000175409607 565698847 /nfs/dbraw/zinc/69/88/47/565698847.db2.gz HGWHBNKNURUFIS-NSHDSACASA-N 0 0 379.869 3.486 20 5 GGBDRN CCc1cnc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000175468516 565701708 /nfs/dbraw/zinc/70/17/08/565701708.db2.gz VLRNNXQANWQFJE-UHFFFAOYSA-N 0 0 375.859 3.088 20 5 GGBDRN CCc1cnc(CN(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000175470695 565701804 /nfs/dbraw/zinc/70/18/04/565701804.db2.gz ZFPVFDJGGVCIBT-UHFFFAOYSA-N 0 0 375.859 3.088 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000175472998 565702011 /nfs/dbraw/zinc/70/20/11/565702011.db2.gz SMFZUUOGZXTQHT-UHFFFAOYSA-N 0 0 381.479 3.059 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(Br)c(C2CC2)n1 ZINC000410970726 565702411 /nfs/dbraw/zinc/70/24/11/565702411.db2.gz WVFYMMIMSWFZIA-UHFFFAOYSA-N 0 0 376.210 3.233 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCCO2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175530242 565705033 /nfs/dbraw/zinc/70/50/33/565705033.db2.gz UGCSFTLTFWUSGX-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000411026405 565705224 /nfs/dbraw/zinc/70/52/24/565705224.db2.gz UHOYAUXERFFIQF-GDBMZVCRSA-N 0 0 381.226 3.141 20 5 GGBDRN CN(Cc1ccccc1Br)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000192676380 565705279 /nfs/dbraw/zinc/70/52/79/565705279.db2.gz TZOKJFXGPUREOP-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN Cc1nn(CCC(=O)Nc2c(F)cccc2Br)c(C)c1[N+](=O)[O-] ZINC000175527210 565705558 /nfs/dbraw/zinc/70/55/58/565705558.db2.gz YQSSZKSJMYBLCC-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1c(F)cc(F)cc1Br ZINC000192706973 565706140 /nfs/dbraw/zinc/70/61/40/565706140.db2.gz HAZBFEJOTRQVAI-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCN(C)C[C@H]1C(C)C ZINC000330482307 565709089 /nfs/dbraw/zinc/70/90/89/565709089.db2.gz RDZMPVZQFFNNKU-HNNXBMFYSA-N 0 0 384.274 3.078 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCC[C@@H]1O ZINC000330480896 565709158 /nfs/dbraw/zinc/70/91/58/565709158.db2.gz OJBMXGLTDAROHD-ABAIWWIYSA-N 0 0 385.258 3.289 20 5 GGBDRN CCN(C1CCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000330505675 565709988 /nfs/dbraw/zinc/70/99/88/565709988.db2.gz GHMQJYIPBWIFHP-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cc(Br)c(F)cc1Cl ZINC000175580523 565710555 /nfs/dbraw/zinc/71/05/55/565710555.db2.gz CTOXTJRDXPELNK-UHFFFAOYSA-N 0 0 391.584 3.375 20 5 GGBDRN COc1cccc(C(=O)NCc2ccc(O)c(Br)c2)c1[N+](=O)[O-] ZINC000192791987 565711165 /nfs/dbraw/zinc/71/11/65/565711165.db2.gz JOKWPIPJSZPPQN-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N1CCCc2c(Cl)ccc(Br)c21 ZINC000411110392 565712328 /nfs/dbraw/zinc/71/23/28/565712328.db2.gz OGKDWEUPGBVPOQ-UHFFFAOYSA-N 0 0 399.632 3.187 20 5 GGBDRN O=C(Nc1ccc2oc(=O)[nH]c2c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175643708 565713895 /nfs/dbraw/zinc/71/38/95/565713895.db2.gz PAKLCIKDUSXQAP-UHFFFAOYSA-N 0 0 378.138 3.044 20 5 GGBDRN CCC[C@@]1(CO)CCCN1C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000330623653 565714266 /nfs/dbraw/zinc/71/42/66/565714266.db2.gz PXBAHMLGZGBOLL-INIZCTEOSA-N 0 0 385.258 3.433 20 5 GGBDRN CC(C)[C@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000330631072 565715409 /nfs/dbraw/zinc/71/54/09/565715409.db2.gz PBLDFTUGUABDMI-IUODEOHRSA-N 0 0 385.258 3.220 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@@H]2CCO[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000330630512 565715554 /nfs/dbraw/zinc/71/55/54/565715554.db2.gz OLKTYNXSIBYCLH-IAQYHMDHSA-N 0 0 376.862 3.039 20 5 GGBDRN O=[N+]([O-])c1cc(F)c(S(=O)(=O)N(Cc2cccnc2)C2CC2)cc1Cl ZINC000281210214 565717966 /nfs/dbraw/zinc/71/79/66/565717966.db2.gz QGAVTCZNGDMKTK-UHFFFAOYSA-N 0 0 385.804 3.136 20 5 GGBDRN COC[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000192929194 565719771 /nfs/dbraw/zinc/71/97/71/565719771.db2.gz OSZBXTBNVQLHAN-OAHLLOKOSA-N 0 0 384.841 3.055 20 5 GGBDRN COC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000192929268 565719878 /nfs/dbraw/zinc/71/98/78/565719878.db2.gz LZYCPTHXAMQZHT-AWEZNQCLSA-N 0 0 388.804 3.053 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000192981539 565722101 /nfs/dbraw/zinc/72/21/01/565722101.db2.gz PPGRBTJADRYCIY-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(c3nccs3)CC2)c1 ZINC000281284508 565722193 /nfs/dbraw/zinc/72/21/93/565722193.db2.gz NSKMMZFSQYOSIN-UHFFFAOYSA-N 0 0 378.479 3.172 20 5 GGBDRN COc1ccc(CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1F ZINC000175763464 565722629 /nfs/dbraw/zinc/72/26/29/565722629.db2.gz RVKXXSTYRJVRII-UHFFFAOYSA-N 0 0 397.200 3.478 20 5 GGBDRN CN(C[C@H]1CC=CCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000330809502 565724096 /nfs/dbraw/zinc/72/40/96/565724096.db2.gz BCHWGEREDPOBTB-NSHDSACASA-N 0 0 389.271 3.334 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000330810026 565724245 /nfs/dbraw/zinc/72/42/45/565724245.db2.gz JFAFZLQRPQPAFY-DGCLKSJQSA-N 0 0 380.388 3.383 20 5 GGBDRN CC(=O)N[C@H]1CC[C@H](C(F)(F)F)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000330847883 565725125 /nfs/dbraw/zinc/72/51/25/565725125.db2.gz MDNNHVISAZGCIA-GXTWGEPZSA-N 0 0 379.766 3.280 20 5 GGBDRN CC[C@@H]1C[C@@H](C)CN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000330946458 565731147 /nfs/dbraw/zinc/73/11/47/565731147.db2.gz LBCQEVCPTOLVDY-MWLCHTKSSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@H](O)C[C@H]1CCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000330949383 565731419 /nfs/dbraw/zinc/73/14/19/565731419.db2.gz HFYNGKLVFAIVHB-WCQYABFASA-N 0 0 385.258 3.052 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nc(Cc2ccccc2C)no1 ZINC000175938535 565734682 /nfs/dbraw/zinc/73/46/82/565734682.db2.gz KDVHUEUFHTZHIU-UHFFFAOYSA-N 0 0 392.213 3.193 20 5 GGBDRN CC[C@H]1[C@@H](C)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331073386 565737577 /nfs/dbraw/zinc/73/75/77/565737577.db2.gz TWZOVSMTKNDHTH-CABZTGNLSA-N 0 0 377.260 3.166 20 5 GGBDRN CSc1cccc(C(=O)Nc2nc(-c3cccs3)nn2C)c1[N+](=O)[O-] ZINC000193242067 565739620 /nfs/dbraw/zinc/73/96/20/565739620.db2.gz JYLRHAVLJAPCSE-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN CC1=C(C)CN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000331117563 565740002 /nfs/dbraw/zinc/74/00/02/565740002.db2.gz LKVKZQMVJWTHRC-UHFFFAOYSA-N 0 0 375.244 3.088 20 5 GGBDRN Cn1nc(-c2cccs2)nc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000193236988 565740429 /nfs/dbraw/zinc/74/04/29/565740429.db2.gz GODONCLDMOSTRO-UHFFFAOYSA-N 0 0 375.435 3.183 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@H](C)CC ZINC000176021887 565741016 /nfs/dbraw/zinc/74/10/16/565741016.db2.gz OYLRSWACXVUFQY-RNCFNFMXSA-N 0 0 387.230 3.065 20 5 GGBDRN C[C@H](CCc1cccn1C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176014759 565741399 /nfs/dbraw/zinc/74/13/99/565741399.db2.gz CTIMFQQEZFNLHA-LLVKDONJSA-N 0 0 380.242 3.447 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2C[C@H]2CC(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000411641041 565742024 /nfs/dbraw/zinc/74/20/24/565742024.db2.gz WQUNKLMXDXKCKV-ZWNOBZJWSA-N 0 0 398.257 3.155 20 5 GGBDRN COc1cc(C(=O)Nc2cc(C)c(Br)cn2)c([N+](=O)[O-])cc1OC ZINC000176078056 565746811 /nfs/dbraw/zinc/74/68/11/565746811.db2.gz HCRJPXTUUIPMEP-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC=C(C)C2)cc1[N+](=O)[O-] ZINC000331235816 565748144 /nfs/dbraw/zinc/74/81/44/565748144.db2.gz TXFNBFCXGSBJDS-UHFFFAOYSA-N 0 0 375.244 3.006 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(I)c(C)n2)c1[N+](=O)[O-] ZINC000176106366 565748683 /nfs/dbraw/zinc/74/86/83/565748683.db2.gz LWHWLSPBAGVJQS-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN Cc1nc(NC(=O)c2ccc([N+](=O)[O-])s2)ccc1I ZINC000176099965 565748708 /nfs/dbraw/zinc/74/87/08/565748708.db2.gz JLXRLKYYBALVFO-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN COc1cc(C(=O)N2CCC(C)=C(Br)C2)cc([N+](=O)[O-])c1OC ZINC000281810777 565749000 /nfs/dbraw/zinc/74/90/00/565749000.db2.gz NLBMBHFVARKPHM-UHFFFAOYSA-N 0 0 385.214 3.127 20 5 GGBDRN C[C@@H](c1ccccc1Br)N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193403915 565749427 /nfs/dbraw/zinc/74/94/27/565749427.db2.gz GOQNTNLGSOCFRA-VIFPVBQESA-N 0 0 380.198 3.291 20 5 GGBDRN C[C@H](c1ccccc1Br)N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193403930 565749468 /nfs/dbraw/zinc/74/94/68/565749468.db2.gz GOQNTNLGSOCFRA-SECBINFHSA-N 0 0 380.198 3.291 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C1(c2cncc(Br)c2)CC1 ZINC000281797790 565749572 /nfs/dbraw/zinc/74/95/72/565749572.db2.gz IIUABNCRYNPWIH-UHFFFAOYSA-N 0 0 390.237 3.143 20 5 GGBDRN COC1CCC(N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000331283663 565751467 /nfs/dbraw/zinc/75/14/67/565751467.db2.gz DYDSTDBIQZRPEZ-UHFFFAOYSA-N 0 0 385.258 3.316 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2Cc3cc(Br)ccc3O2)c([N+](=O)[O-])c1 ZINC000193461006 565753726 /nfs/dbraw/zinc/75/37/26/565753726.db2.gz DOEFNBIJJBJURD-HNNXBMFYSA-N 0 0 393.193 3.308 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000281903358 565754841 /nfs/dbraw/zinc/75/48/41/565754841.db2.gz FQLLWIQWLNFBMR-LLVKDONJSA-N 0 0 384.483 3.008 20 5 GGBDRN COC[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000176189167 565756043 /nfs/dbraw/zinc/75/60/43/565756043.db2.gz JZAVPLJQIUHTNR-LBPRGKRZSA-N 0 0 383.198 3.376 20 5 GGBDRN CCN(CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1c(Cl)cccc1Cl ZINC000176199977 565757336 /nfs/dbraw/zinc/75/73/36/565757336.db2.gz IXXKBQPGVUDGBD-UHFFFAOYSA-N 0 0 386.239 3.059 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1Cc2cc(Br)ccc2O1 ZINC000193522941 565758071 /nfs/dbraw/zinc/75/80/71/565758071.db2.gz HNNQBOVYUOWVLB-INIZCTEOSA-N 0 0 391.221 3.020 20 5 GGBDRN COc1ccc(Br)cc1[C@@H]1CCCN1CCn1ccc([N+](=O)[O-])n1 ZINC000176224715 565758189 /nfs/dbraw/zinc/75/81/89/565758189.db2.gz VDBFBQSMNARMBA-AWEZNQCLSA-N 0 0 395.257 3.400 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1Cc2cc(Br)ccc2O1 ZINC000193522956 565758159 /nfs/dbraw/zinc/75/81/59/565758159.db2.gz HNNQBOVYUOWVLB-MRXNPFEDSA-N 0 0 391.221 3.020 20 5 GGBDRN COc1ccc(Br)cc1[C@H]1CCCN1CCn1ccc([N+](=O)[O-])n1 ZINC000176224726 565758438 /nfs/dbraw/zinc/75/84/38/565758438.db2.gz VDBFBQSMNARMBA-CQSZACIVSA-N 0 0 395.257 3.400 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@H]1c1ccc(Br)s1 ZINC000331431970 565759644 /nfs/dbraw/zinc/75/96/44/565759644.db2.gz UGPDNLGXWPTQRG-QMMMGPOBSA-N 0 0 385.243 3.130 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)N2CCc3cc(Br)ccc32)c1[N+](=O)[O-] ZINC000331488195 565761434 /nfs/dbraw/zinc/76/14/34/565761434.db2.gz ARTUDMXZCXESSJ-UHFFFAOYSA-N 0 0 379.214 3.407 20 5 GGBDRN C[C@H](Sc1nccn2ccnc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000193572124 565762387 /nfs/dbraw/zinc/76/23/87/565762387.db2.gz FHTZWJBAMVFIQS-VIFPVBQESA-N 0 0 377.813 3.410 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(F)cc1Br ZINC000193586822 565763505 /nfs/dbraw/zinc/76/35/05/565763505.db2.gz OLLINFJSVGVXMJ-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)COc1ccc(Br)cc1 ZINC000193584885 565764159 /nfs/dbraw/zinc/76/41/59/565764159.db2.gz OEQAOFQQHIZFLE-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCC(c3cccc(Br)c3)CC2)c1[N+](=O)[O-] ZINC000282108720 565764648 /nfs/dbraw/zinc/76/46/48/565764648.db2.gz WSKJADHWIWUTNU-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN CO[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 ZINC000176318697 565764580 /nfs/dbraw/zinc/76/45/80/565764580.db2.gz FIFCAWFCPRFLMK-INIZCTEOSA-N 0 0 393.237 3.404 20 5 GGBDRN O=C(NC[C@H]1CCCC(F)(F)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000282122428 565766364 /nfs/dbraw/zinc/76/63/64/565766364.db2.gz LUJODNWROJCKMG-VIFPVBQESA-N 0 0 375.759 3.128 20 5 GGBDRN CC(=O)Nc1ccc(Br)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000176359388 565766998 /nfs/dbraw/zinc/76/69/98/565766998.db2.gz YVXNKBZZOMBPJE-UHFFFAOYSA-N 0 0 393.197 3.150 20 5 GGBDRN O=C(NC[C@H]1CCCC(F)(F)C1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000282159107 565767048 /nfs/dbraw/zinc/76/70/48/565767048.db2.gz OSUCURRSBITNAR-VIFPVBQESA-N 0 0 375.759 3.128 20 5 GGBDRN O=C(N[C@H]1CCCC12CCOCC2)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000282166018 565768275 /nfs/dbraw/zinc/76/82/75/565768275.db2.gz YENCNZNGXGCTPU-AWEZNQCLSA-N 0 0 383.242 3.436 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC=CCC1 ZINC000193670135 565768913 /nfs/dbraw/zinc/76/89/13/565768913.db2.gz ZUMRCMUBZHYGGT-JTQLQIEISA-N 0 0 386.189 3.346 20 5 GGBDRN CC(C)Oc1cc(Br)cc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)c1 ZINC000193674280 565769140 /nfs/dbraw/zinc/76/91/40/565769140.db2.gz KACBWTZUFUEACL-UHFFFAOYSA-N 0 0 396.197 3.497 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccc(F)cc1Br ZINC000193703541 565770825 /nfs/dbraw/zinc/77/08/25/565770825.db2.gz GDXYGSIDYWFSJD-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)N2CCc3ccc(Br)cc32)c1[N+](=O)[O-] ZINC000331613818 565771377 /nfs/dbraw/zinc/77/13/77/565771377.db2.gz PITSYMYDLGNXNR-UHFFFAOYSA-N 0 0 379.214 3.407 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[C@H]1C ZINC000193735104 565772334 /nfs/dbraw/zinc/77/23/34/565772334.db2.gz ZNERGBAKRZWFBF-PSASIEDQSA-N 0 0 388.205 3.378 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1C[C@H]1CCN(C(=O)c2ccccc2)C1 ZINC000282284765 565772932 /nfs/dbraw/zinc/77/29/32/565772932.db2.gz VHNQYFJYPQEBOM-LBPRGKRZSA-N 0 0 393.241 3.025 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1C[C@@H]1CCN(C(=O)c2ccccc2)C1 ZINC000282284761 565772982 /nfs/dbraw/zinc/77/29/82/565772982.db2.gz VHNQYFJYPQEBOM-GFCCVEGCSA-N 0 0 393.241 3.025 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1C=CCCC1 ZINC000193765642 565773731 /nfs/dbraw/zinc/77/37/31/565773731.db2.gz AKBXHUYQMMDHPZ-SNVBAGLBSA-N 0 0 386.189 3.346 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000282310011 565774135 /nfs/dbraw/zinc/77/41/35/565774135.db2.gz DJTXKCFOYPSOFK-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000331664257 565774408 /nfs/dbraw/zinc/77/44/08/565774408.db2.gz WZCPYECFZVXNAF-GUTXKFCHSA-N 0 0 384.885 3.492 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(I)cc2)c1[N+](=O)[O-] ZINC000193778309 565774441 /nfs/dbraw/zinc/77/44/41/565774441.db2.gz JOSWLYYIVABHLT-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN COCCN(Cc1cccnc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000282376547 565776552 /nfs/dbraw/zinc/77/65/52/565776552.db2.gz CNZLYPVJYDZHSE-UHFFFAOYSA-N 0 0 380.242 3.401 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1cc(Cl)ccc1Cl ZINC000193811574 565776815 /nfs/dbraw/zinc/77/68/15/565776815.db2.gz RKBNJQFKHHBMOZ-UHFFFAOYSA-N 0 0 382.203 3.499 20 5 GGBDRN Cc1cc([C@@H]2CCCN2C(=O)c2c([N+](=O)[O-])cnn2C)ccc1Br ZINC000331688791 565777017 /nfs/dbraw/zinc/77/70/17/565777017.db2.gz XOSYDFZAOJIURF-ZDUSSCGKSA-N 0 0 393.241 3.377 20 5 GGBDRN Cc1cc([C@H]2CCCN2C(=O)c2c([N+](=O)[O-])cnn2C)ccc1Br ZINC000331688788 565777084 /nfs/dbraw/zinc/77/70/84/565777084.db2.gz XOSYDFZAOJIURF-CYBMUJFWSA-N 0 0 393.241 3.377 20 5 GGBDRN CC(C)(NC(=O)c1cc(I)c[nH]1)c1ccc([N+](=O)[O-])cc1 ZINC000176505471 565777731 /nfs/dbraw/zinc/77/77/31/565777731.db2.gz NUCUZEIENQEDQQ-UHFFFAOYSA-N 0 0 399.188 3.193 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1ccccc1Br ZINC000193840446 565778383 /nfs/dbraw/zinc/77/83/83/565778383.db2.gz KZXCGQMBZLAQMZ-UHFFFAOYSA-N 0 0 379.210 3.443 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000282421573 565779299 /nfs/dbraw/zinc/77/92/99/565779299.db2.gz LWQNTCUMOAHJRG-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN O=C(NCCCO[C@@H]1CCCCO1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000412306339 565780164 /nfs/dbraw/zinc/78/01/64/565780164.db2.gz MUEHPEHYJKMMOG-CQSZACIVSA-N 0 0 387.230 3.020 20 5 GGBDRN O=C(NCCCO[C@H]1CCCCO1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000412306338 565780266 /nfs/dbraw/zinc/78/02/66/565780266.db2.gz MUEHPEHYJKMMOG-AWEZNQCLSA-N 0 0 387.230 3.020 20 5 GGBDRN CC(C)CCOC1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000193921066 565783915 /nfs/dbraw/zinc/78/39/15/565783915.db2.gz RFPAHUCVWZPXIQ-UHFFFAOYSA-N 0 0 390.889 3.464 20 5 GGBDRN Cc1cc(Br)ccc1N(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000193919292 565783924 /nfs/dbraw/zinc/78/39/24/565783924.db2.gz VOXRCCGWJLAXEO-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN CC(C)CCOC1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000193921176 565784069 /nfs/dbraw/zinc/78/40/69/565784069.db2.gz HBNGDXYNGKPQNZ-UHFFFAOYSA-N 0 0 390.889 3.464 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000331780813 565784053 /nfs/dbraw/zinc/78/40/53/565784053.db2.gz GBMSHXVGGHOEPS-DFBGVHRSSA-N 0 0 383.242 3.353 20 5 GGBDRN CS(=O)(=O)c1ccc(-c2nc(-c3ccccc3Cl)no2)cc1[N+](=O)[O-] ZINC000193937922 565784194 /nfs/dbraw/zinc/78/41/94/565784194.db2.gz UPQMEFSBDDQTBW-UHFFFAOYSA-N 0 0 379.781 3.369 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1C1CCOCC1 ZINC000331811988 565786561 /nfs/dbraw/zinc/78/65/61/565786561.db2.gz BHGCOIWPLHZOOM-MRXNPFEDSA-N 0 0 397.269 3.317 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1[nH]nc(C2CC2)c1Br ZINC000282629002 565789894 /nfs/dbraw/zinc/78/98/94/565789894.db2.gz BLRKNYYJLRQARH-UHFFFAOYSA-N 0 0 393.241 3.273 20 5 GGBDRN Cc1ncc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)s1 ZINC000176673741 565792336 /nfs/dbraw/zinc/79/23/36/565792336.db2.gz IULHLEHUNMIPHL-UHFFFAOYSA-N 0 0 375.859 3.142 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)CN3CCSC3=O)n2)cc1[N+](=O)[O-] ZINC000282696113 565792805 /nfs/dbraw/zinc/79/28/05/565792805.db2.gz FGJFDMKVZRBQEV-UHFFFAOYSA-N 0 0 378.435 3.134 20 5 GGBDRN CC(C)CN(C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331944275 565795366 /nfs/dbraw/zinc/79/53/66/565795366.db2.gz IZNSAGRJRUIZPV-UHFFFAOYSA-N 0 0 377.260 3.166 20 5 GGBDRN COc1cccc(C(=O)NCc2ccc(F)cc2Br)c1[N+](=O)[O-] ZINC000194126132 565796090 /nfs/dbraw/zinc/79/60/90/565796090.db2.gz CLGCEZIXZGKFLV-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cn1cc([C@@H]2CCCCN2C(=O)c2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000331962855 565796219 /nfs/dbraw/zinc/79/62/19/565796219.db2.gz PVWUXACANTYUMX-AWEZNQCLSA-N 0 0 393.241 3.458 20 5 GGBDRN C[C@@H]1C[C@@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CS1 ZINC000412572295 565796302 /nfs/dbraw/zinc/79/63/02/565796302.db2.gz LRIJZTGTDAUMQU-MWLCHTKSSA-N 0 0 377.388 3.426 20 5 GGBDRN CC1(C)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)c2cc(Br)ccc21 ZINC000331987145 565798020 /nfs/dbraw/zinc/79/80/20/565798020.db2.gz UFKJYCMPLWEAMY-UHFFFAOYSA-N 0 0 393.241 3.268 20 5 GGBDRN CO[C@@](C)([C@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000412608065 565799022 /nfs/dbraw/zinc/79/90/22/565799022.db2.gz XKRUWXQSJRBVSK-QFYYESIMSA-N 0 0 385.258 3.220 20 5 GGBDRN CC(C)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)OCC1CC1 ZINC000412624922 565800461 /nfs/dbraw/zinc/80/04/61/565800461.db2.gz ZUKKRVPAUYNHOB-UHFFFAOYSA-N 0 0 385.258 3.221 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)Oc3ccc(Br)cc32)n1 ZINC000332054906 565801923 /nfs/dbraw/zinc/80/19/23/565801923.db2.gz NSIJQRYHMIEPII-SECBINFHSA-N 0 0 395.213 3.001 20 5 GGBDRN O=C(NC[C@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1Br ZINC000176798930 565804145 /nfs/dbraw/zinc/80/41/45/565804145.db2.gz DKDIGPXOJQIEFJ-ZDUSSCGKSA-N 0 0 393.237 3.253 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000176811090 565805186 /nfs/dbraw/zinc/80/51/86/565805186.db2.gz ISZWRNPMMYJABM-QHCPKHFHSA-N 0 0 397.250 3.025 20 5 GGBDRN Cc1csc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1Cl ZINC000332088195 565805522 /nfs/dbraw/zinc/80/55/22/565805522.db2.gz JPZGQYLLRZFPIX-UHFFFAOYSA-N 0 0 399.881 3.278 20 5 GGBDRN CSc1ccc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000176825760 565806219 /nfs/dbraw/zinc/80/62/19/565806219.db2.gz ORKPBOWUZBAAON-UHFFFAOYSA-N 0 0 379.825 3.225 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c1[N+](=O)[O-] ZINC000194375286 565811354 /nfs/dbraw/zinc/81/13/54/565811354.db2.gz IAYOFQRROSXBLL-RUZDIDTESA-N 0 0 382.825 3.388 20 5 GGBDRN COc1cccc(C(=O)NCCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000194384536 565811378 /nfs/dbraw/zinc/81/13/78/565811378.db2.gz BXWLEWRUMZRGLM-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)COCC2 ZINC000283268691 565813991 /nfs/dbraw/zinc/81/39/91/565813991.db2.gz AMPLHBVXMAYXPF-UHFFFAOYSA-N 0 0 398.238 3.447 20 5 GGBDRN CC(C)CCOC1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000194440947 565815782 /nfs/dbraw/zinc/81/57/82/565815782.db2.gz IQNJQJRJDLWIRO-UHFFFAOYSA-N 0 0 390.889 3.464 20 5 GGBDRN COCC[C@H]1CCCCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000332212659 565816820 /nfs/dbraw/zinc/81/68/20/565816820.db2.gz HFIKJSFRTSMERS-GFCCVEGCSA-N 0 0 376.862 3.076 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@](=O)C(C)(C)CC1 ZINC000332239641 565820207 /nfs/dbraw/zinc/82/02/07/565820207.db2.gz UDTITFHUWYCVAI-VWLOTQADSA-N 0 0 384.523 3.469 20 5 GGBDRN CO[C@]1(C)CCCN(S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)CC1 ZINC000332245000 565821356 /nfs/dbraw/zinc/82/13/56/565821356.db2.gz WRSKRQXAPFVQPZ-OAHLLOKOSA-N 0 0 376.862 3.136 20 5 GGBDRN CO[C@@]1(C)CCCN(S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)CC1 ZINC000332244979 565821556 /nfs/dbraw/zinc/82/15/56/565821556.db2.gz WRSKRQXAPFVQPZ-HNNXBMFYSA-N 0 0 376.862 3.136 20 5 GGBDRN Cc1cc(-n2ccnc2)ccc1Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000194552461 565821976 /nfs/dbraw/zinc/82/19/76/565821976.db2.gz APHLXCPQUCYWGW-UHFFFAOYSA-N 0 0 389.209 3.061 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C)Cc2noc(C3CC3)n2)cc1[N+](=O)[O-] ZINC000412949921 565823230 /nfs/dbraw/zinc/82/32/30/565823230.db2.gz FQLAVBXEYYSEMX-UHFFFAOYSA-N 0 0 395.213 3.198 20 5 GGBDRN CC1(C)CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[S@@]1=O ZINC000332263541 565823518 /nfs/dbraw/zinc/82/35/18/565823518.db2.gz FAISSFVGCULEFD-DEOSSOPVSA-N 0 0 390.914 3.100 20 5 GGBDRN CC1(C)CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[S@]1=O ZINC000332263540 565823798 /nfs/dbraw/zinc/82/37/98/565823798.db2.gz FAISSFVGCULEFD-XMMPIXPASA-N 0 0 390.914 3.100 20 5 GGBDRN CC(C)[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccnc1 ZINC000177023018 565824085 /nfs/dbraw/zinc/82/40/85/565824085.db2.gz WHNZIJLFLBQSBK-CQSZACIVSA-N 0 0 383.857 3.361 20 5 GGBDRN C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)Oc1ccccc1Br ZINC000177066596 565826196 /nfs/dbraw/zinc/82/61/96/565826196.db2.gz FFNBWKWMUSVYOD-SNVBAGLBSA-N 0 0 394.225 3.137 20 5 GGBDRN C[C@H]1CCSCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000332301355 565826757 /nfs/dbraw/zinc/82/67/57/565826757.db2.gz HHMVCZLDEYGSGL-JTQLQIEISA-N 0 0 388.287 3.123 20 5 GGBDRN Cc1c(Br)c(=O)n(CC(=O)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000413002277 565829362 /nfs/dbraw/zinc/82/93/62/565829362.db2.gz RGQCYISVMBIVIS-UHFFFAOYSA-N 0 0 379.210 3.029 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1c(C)cc(Br)cc1Cl ZINC000194694613 565831042 /nfs/dbraw/zinc/83/10/42/565831042.db2.gz CWWPWFSTNKPCPK-UHFFFAOYSA-N 0 0 387.621 3.463 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1occc1Br ZINC000177150084 565831865 /nfs/dbraw/zinc/83/18/65/565831865.db2.gz REMFCEVLRWCGBN-UHFFFAOYSA-N 0 0 377.154 3.388 20 5 GGBDRN Cc1csc([C@H]2CCCN(S(=O)(=O)c3ccc(C)cc3[N+](=O)[O-])C2)n1 ZINC000332384165 565833634 /nfs/dbraw/zinc/83/36/34/565833634.db2.gz 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O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000195392868 565879363 /nfs/dbraw/zinc/87/93/63/565879363.db2.gz NMLHUCBSOYMUNR-CYBMUJFWSA-N 0 0 381.182 3.164 20 5 GGBDRN Cc1ncc(NC(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)cn1 ZINC000284957020 565880472 /nfs/dbraw/zinc/88/04/72/565880472.db2.gz WGPYSTZPBPMYNT-UHFFFAOYSA-N 0 0 392.213 3.046 20 5 GGBDRN Cc1ccc(-c2csc(C[S@@](=O)CCn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000284961525 565880493 /nfs/dbraw/zinc/88/04/93/565880493.db2.gz DVZJMEIIZPWBKR-VWLOTQADSA-N 0 0 376.463 3.172 20 5 GGBDRN COc1cccc(C(=O)NCCNc2ncc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000195429952 565882169 /nfs/dbraw/zinc/88/21/69/565882169.db2.gz NDQIZEWTAOKLLS-UHFFFAOYSA-N 0 0 385.207 3.147 20 5 GGBDRN Cc1ncc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)s1 ZINC000177958527 565883796 /nfs/dbraw/zinc/88/37/96/565883796.db2.gz RLCVPZNNVAEWMA-UHFFFAOYSA-N 0 0 375.859 3.142 20 5 GGBDRN Cc1ncsc1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C ZINC000177959040 565883859 /nfs/dbraw/zinc/88/38/59/565883859.db2.gz DFWGHIQZWFBNJG-UHFFFAOYSA-N 0 0 375.859 3.142 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1I)c1ccccn1 ZINC000195455237 565884448 /nfs/dbraw/zinc/88/44/48/565884448.db2.gz ROJSMDAXJRMDDP-VIFPVBQESA-N 0 0 397.172 3.085 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2c[nH]c3cccc(F)c32)c(Cl)c1 ZINC000195456540 565884742 /nfs/dbraw/zinc/88/47/42/565884742.db2.gz NLMGUTHVDRYNQJ-UHFFFAOYSA-N 0 0 383.788 3.347 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCc2nn(C)cc21 ZINC000285067505 565885758 /nfs/dbraw/zinc/88/57/58/565885758.db2.gz VAYGGXRGIUSAHH-CQSZACIVSA-N 0 0 393.241 3.207 20 5 GGBDRN Cc1c(I)cccc1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000177985489 565886924 /nfs/dbraw/zinc/88/69/24/565886924.db2.gz PDUZQSGZKSHWCO-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCc1nnc(C2CC2)s1 ZINC000414013572 565887790 /nfs/dbraw/zinc/88/77/90/565887790.db2.gz UWGFKTSDHRLXJB-UHFFFAOYSA-N 0 0 384.870 3.386 20 5 GGBDRN O=C(c1c(Cl)cccc1Cl)N1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000195510356 565889185 /nfs/dbraw/zinc/88/91/85/565889185.db2.gz OOYWYZRUCVGFJI-UHFFFAOYSA-N 0 0 387.248 3.321 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)Cc2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000178000022 565889347 /nfs/dbraw/zinc/88/93/47/565889347.db2.gz FESLVHYMVFBPNT-QMMMGPOBSA-N 0 0 399.220 3.143 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000195677544 565891715 /nfs/dbraw/zinc/89/17/15/565891715.db2.gz FVDLOTJCBGLTBD-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN COc1ccc(CS(C)(=O)=O)cc1NCc1ccc([N+](=O)[O-])cc1Cl ZINC000285156813 565891738 /nfs/dbraw/zinc/89/17/38/565891738.db2.gz PSNZZPICIVFEBM-UHFFFAOYSA-N 0 0 384.841 3.414 20 5 GGBDRN C[C@@H](Cc1cccc(Br)c1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000195677542 565891742 /nfs/dbraw/zinc/89/17/42/565891742.db2.gz FVDLOTJCBGLTBD-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN Cc1cccc(OC[C@H](C)NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000195669338 565891746 /nfs/dbraw/zinc/89/17/46/565891746.db2.gz NDSCYQUKADYTKP-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(F)cc(Br)c1 ZINC000195711691 565891754 /nfs/dbraw/zinc/89/17/54/565891754.db2.gz OVZRGTJWMAXSKQ-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)OCc1ncnn1C(C)C ZINC000285168608 565892885 /nfs/dbraw/zinc/89/28/85/565892885.db2.gz ZMIIIZLPXIXMMH-UHFFFAOYSA-N 0 0 383.202 3.195 20 5 GGBDRN CC[S@@](=O)[C@H]1CCC[C@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000178094414 565896250 /nfs/dbraw/zinc/89/62/50/565896250.db2.gz KSNOZELITGQAGZ-ZLLDOOPNSA-N 0 0 384.523 3.271 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCc2c[nH]nc21 ZINC000285275613 565897691 /nfs/dbraw/zinc/89/76/91/565897691.db2.gz NAUYSOZXTCRROK-CYBMUJFWSA-N 0 0 379.214 3.196 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCc2c[nH]nc21 ZINC000285275617 565898063 /nfs/dbraw/zinc/89/80/63/565898063.db2.gz NAUYSOZXTCRROK-ZDUSSCGKSA-N 0 0 379.214 3.196 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCCC[C@H]2c2cc[nH]n2)cc1[N+](=O)[O-] ZINC000285332499 565901298 /nfs/dbraw/zinc/90/12/98/565901298.db2.gz OMNAWHRONSGWML-ZDUSSCGKSA-N 0 0 384.845 3.196 20 5 GGBDRN C[C@@](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)(C(N)=O)c1cccc(Cl)c1 ZINC000178172910 565904411 /nfs/dbraw/zinc/90/44/11/565904411.db2.gz UXTSQPNVFJBYEK-INIZCTEOSA-N 0 0 382.203 3.032 20 5 GGBDRN O=C(CNc1ccccc1Br)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178233097 565906446 /nfs/dbraw/zinc/90/64/46/565906446.db2.gz CNCYUNCNPZYXAD-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@@]1(C)CCCC[C@H]1O ZINC000333984839 565907501 /nfs/dbraw/zinc/90/75/01/565907501.db2.gz JWODLOAXOIVCNW-GDBMZVCRSA-N 0 0 385.258 3.337 20 5 GGBDRN Cc1cnc(OCC(=O)Nc2ccc(Br)c(C)c2)c([N+](=O)[O-])c1 ZINC000178282459 565910769 /nfs/dbraw/zinc/91/07/69/565910769.db2.gz SLHGLZWIZSGKND-UHFFFAOYSA-N 0 0 380.198 3.387 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(CCCO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000414383503 565919945 /nfs/dbraw/zinc/91/99/45/565919945.db2.gz ACMNBCLAKPJCPF-UHFFFAOYSA-N 0 0 384.841 3.134 20 5 GGBDRN O=[N+]([O-])c1ccn(CCSc2nnc3c(Cl)cc(C(F)(F)F)cn23)n1 ZINC000178469540 565920518 /nfs/dbraw/zinc/92/05/18/565920518.db2.gz WIQMTZDVQMHIET-UHFFFAOYSA-N 0 0 392.750 3.299 20 5 GGBDRN COc1ccccc1Nc1nnc(SCCn2ccc([N+](=O)[O-])n2)s1 ZINC000178461027 565920999 /nfs/dbraw/zinc/92/09/99/565920999.db2.gz KXOIGAJDJRJALE-UHFFFAOYSA-N 0 0 378.439 3.187 20 5 GGBDRN Cc1sc(S(=O)(=O)N(CCCO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000414386179 565921103 /nfs/dbraw/zinc/92/11/03/565921103.db2.gz GRGWIUGXAVKBJX-UHFFFAOYSA-N 0 0 390.870 3.196 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CCCO)c1ccc(Cl)cc1 ZINC000414389070 565921741 /nfs/dbraw/zinc/92/17/41/565921741.db2.gz OVPPXMIQFDMPNI-UHFFFAOYSA-N 0 0 384.841 3.134 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(CCCO)c1ccc(Cl)cc1 ZINC000414388389 565922056 /nfs/dbraw/zinc/92/20/56/565922056.db2.gz LSRJTLWIVFXSTI-UHFFFAOYSA-N 0 0 384.841 3.134 20 5 GGBDRN O=[N+]([O-])c1ccn(CCSc2nnc(Cc3c(F)cccc3Cl)o2)n1 ZINC000178513468 565922822 /nfs/dbraw/zinc/92/28/22/565922822.db2.gz KFGBZJOHNMUQAF-UHFFFAOYSA-N 0 0 383.792 3.350 20 5 GGBDRN CC1(CNc2ccc(I)cc2[N+](=O)[O-])CCOCC1 ZINC000227825303 565924718 /nfs/dbraw/zinc/92/47/18/565924718.db2.gz PNIXAVACGNVWBG-UHFFFAOYSA-N 0 0 376.194 3.428 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](C(F)(F)F)[C@@H](CO)C1 ZINC000285775178 565925738 /nfs/dbraw/zinc/92/57/38/565925738.db2.gz SIHOHXLPEPIDHT-SCZZXKLOSA-N 0 0 381.738 3.273 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@H]1[C@H]1CCCO1 ZINC000285780934 565926527 /nfs/dbraw/zinc/92/65/27/565926527.db2.gz LKTAZOQUWLJZNC-WCQYABFASA-N 0 0 387.205 3.280 20 5 GGBDRN Nc1ccc(C(=O)N[C@@H](c2cncc(Br)c2)C2CC2)cc1[N+](=O)[O-] ZINC000285794167 565927190 /nfs/dbraw/zinc/92/71/90/565927190.db2.gz UXYPPJIFEVXUOC-OAHLLOKOSA-N 0 0 391.225 3.216 20 5 GGBDRN COc1ccc(Br)c(CC(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000178596239 565928379 /nfs/dbraw/zinc/92/83/79/565928379.db2.gz DYTFVZYIAPNMFW-UHFFFAOYSA-N 0 0 391.221 3.498 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NC[C@H]1CCC[C@@H](O)C1 ZINC000230909170 565931253 /nfs/dbraw/zinc/93/12/53/565931253.db2.gz KTBSMWNXICVFOK-GXSJLCMTSA-N 0 0 376.194 3.162 20 5 GGBDRN Cc1c(CNS(=O)(=O)c2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000231877080 565932224 /nfs/dbraw/zinc/93/22/24/565932224.db2.gz WITPUNXGGGTJHQ-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](CCO)c1ccco1 ZINC000285976079 565936184 /nfs/dbraw/zinc/93/61/84/565936184.db2.gz FFUSYGJMDCWUCZ-ZDUSSCGKSA-N 0 0 383.198 3.112 20 5 GGBDRN Cc1nn(C)cc1[C@@H](C)NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000178784557 565938173 /nfs/dbraw/zinc/93/81/73/565938173.db2.gz WTRFFIZBAJFCQH-SECBINFHSA-N 0 0 381.230 3.199 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCC(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000178828137 565940518 /nfs/dbraw/zinc/94/05/18/565940518.db2.gz CRVPBVRPDVJILR-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN Cc1cccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)c1Br ZINC000178869432 565943052 /nfs/dbraw/zinc/94/30/52/565943052.db2.gz GBGWXHBJKPEXBV-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CC(C)(C)NS(=O)(=O)c1ccccc1CNCc1csc([N+](=O)[O-])c1 ZINC000236671068 565942999 /nfs/dbraw/zinc/94/29/99/565942999.db2.gz AKLUWTCVWACNGC-UHFFFAOYSA-N 0 0 383.495 3.023 20 5 GGBDRN NC(=O)c1ccc(SCc2nc(-c3ccc(Cl)o3)no2)c([N+](=O)[O-])c1 ZINC000350917914 565943550 /nfs/dbraw/zinc/94/35/50/565943550.db2.gz FOYJQLMGAIQHOT-UHFFFAOYSA-N 0 0 380.769 3.282 20 5 GGBDRN O=C(Cc1ccccc1I)NCc1ccccc1[N+](=O)[O-] ZINC000178908253 565945408 /nfs/dbraw/zinc/94/54/08/565945408.db2.gz IDUQDQQFVJDEQS-UHFFFAOYSA-N 0 0 396.184 3.058 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)sc1C ZINC000178952395 565948539 /nfs/dbraw/zinc/94/85/39/565948539.db2.gz PQICBSIMRRCGPN-UHFFFAOYSA-N 0 0 383.495 3.065 20 5 GGBDRN Cc1nn(C)c(C(=O)NC(C)(C)c2ccccc2Br)c1[N+](=O)[O-] ZINC000179001115 565951119 /nfs/dbraw/zinc/95/11/19/565951119.db2.gz ALBNZXJVHCIXDT-UHFFFAOYSA-N 0 0 381.230 3.064 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@@](O)(C(F)(F)F)CC2)c(Br)c1 ZINC000286299574 565952691 /nfs/dbraw/zinc/95/26/91/565952691.db2.gz IFKGIFCEIIZVPQ-NSHDSACASA-N 0 0 384.152 3.036 20 5 GGBDRN COc1ccc(OC[C@H](O)COc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000179048082 565954062 /nfs/dbraw/zinc/95/40/62/565954062.db2.gz CETPAOSKCARIRZ-GFCCVEGCSA-N 0 0 398.209 3.185 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000286410313 565957794 /nfs/dbraw/zinc/95/77/94/565957794.db2.gz VYWKYQNBUJIXIX-HIFRSBDPSA-N 0 0 390.242 3.456 20 5 GGBDRN Cc1noc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000286409754 565957813 /nfs/dbraw/zinc/95/78/13/565957813.db2.gz CMRZWRVNWPDKCO-CYBMUJFWSA-N 0 0 395.213 3.334 20 5 GGBDRN Cc1noc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000286409756 565958158 /nfs/dbraw/zinc/95/81/58/565958158.db2.gz CMRZWRVNWPDKCO-ZDUSSCGKSA-N 0 0 395.213 3.334 20 5 GGBDRN O=C(Cc1ncccc1F)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000286416974 565959244 /nfs/dbraw/zinc/95/92/44/565959244.db2.gz WLPDDKAWVALJQY-UHFFFAOYSA-N 0 0 394.200 3.019 20 5 GGBDRN CC(C)n1cnc(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)c1 ZINC000286424276 565959376 /nfs/dbraw/zinc/95/93/76/565959376.db2.gz WVVKSXLNBFZCKQ-UHFFFAOYSA-N 0 0 393.241 3.333 20 5 GGBDRN C[C@@]12CCN(c3sc(S(C)(=O)=O)cc3[N+](=O)[O-])C[C@@H]1C2(Cl)Cl ZINC000286489356 565962313 /nfs/dbraw/zinc/96/23/13/565962313.db2.gz PNCVIKNMQDAZSS-GZMMTYOYSA-N 0 0 385.294 3.080 20 5 GGBDRN CO[C@H]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)C1 ZINC000179167225 565963129 /nfs/dbraw/zinc/96/31/29/565963129.db2.gz DYFMKWFKFYWMFO-VIFPVBQESA-N 0 0 377.622 3.262 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000286490252 565963185 /nfs/dbraw/zinc/96/31/85/565963185.db2.gz VQAFQFPYKBRJRI-NSHDSACASA-N 0 0 384.152 3.036 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@](O)(C(F)(F)F)CC1 ZINC000286490251 565963268 /nfs/dbraw/zinc/96/32/68/565963268.db2.gz VQAFQFPYKBRJRI-LLVKDONJSA-N 0 0 384.152 3.036 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCCO1 ZINC000179166527 565963397 /nfs/dbraw/zinc/96/33/97/565963397.db2.gz ZQMYFPPZVANSKA-QMMMGPOBSA-N 0 0 377.622 3.262 20 5 GGBDRN C[C@@H](N[C@H](C(N)=O)c1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000179218393 565967019 /nfs/dbraw/zinc/96/70/19/565967019.db2.gz IYYWLAKPQITKSO-BMIGLBTASA-N 0 0 378.226 3.235 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1Br ZINC000286564829 565968099 /nfs/dbraw/zinc/96/80/99/565968099.db2.gz PGDFZAXPESUERJ-MNOVXSKESA-N 0 0 397.191 3.350 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1Br ZINC000286564831 565968479 /nfs/dbraw/zinc/96/84/79/565968479.db2.gz PGDFZAXPESUERJ-QWRGUYRKSA-N 0 0 397.191 3.350 20 5 GGBDRN C[C@@]12CCN(c3ncc([N+](=O)[O-])s3)C[C@@H]1C2(Br)Br ZINC000286665245 565974039 /nfs/dbraw/zinc/97/40/39/565974039.db2.gz HNCQSWIWTKFLMV-IMTBSYHQSA-N 0 0 397.092 3.384 20 5 GGBDRN CN(Cc1ccc([N+](=O)[O-])cc1)[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000179382376 565977612 /nfs/dbraw/zinc/97/76/12/565977612.db2.gz IHPUMIIXQDTZFG-OAHLLOKOSA-N 0 0 378.226 3.016 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1CCOc1ccccc1Br ZINC000179414861 565979949 /nfs/dbraw/zinc/97/99/49/565979949.db2.gz RVCMIWGXGOOHCN-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN CCS(=O)(=O)c1ccc([C@H](C)Nc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000286845099 565982379 /nfs/dbraw/zinc/98/23/79/565982379.db2.gz ZWGNZAGOOOJINO-JTQLQIEISA-N 0 0 380.451 3.271 20 5 GGBDRN CC[C@]1(CO)CCCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C1 ZINC000286847034 565982393 /nfs/dbraw/zinc/98/23/93/565982393.db2.gz TXJPGJLRHQYDJB-INIZCTEOSA-N 0 0 385.258 3.290 20 5 GGBDRN CCS(=O)(=O)c1ccc([C@@H](C)Nc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000286845104 565982586 /nfs/dbraw/zinc/98/25/86/565982586.db2.gz ZWGNZAGOOOJINO-SNVBAGLBSA-N 0 0 380.451 3.271 20 5 GGBDRN CCOCCN(C)C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000179512769 565985268 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/nfs/dbraw/zinc/07/36/43/566073643.db2.gz MYYTXAKMHLIZOG-LLVKDONJSA-N 0 0 380.242 3.447 20 5 GGBDRN COc1ccc(Br)cc1Cn1cnc2cc([N+](=O)[O-])ccc2c1=O ZINC000248184631 566073757 /nfs/dbraw/zinc/07/37/57/566073757.db2.gz GTECITIDLBAWCQ-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000416482055 566074185 /nfs/dbraw/zinc/07/41/85/566074185.db2.gz DNNSLIBAPLJHQN-CYBMUJFWSA-N 0 0 378.372 3.423 20 5 GGBDRN CSC[C@@H]1CCCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000416487481 566075635 /nfs/dbraw/zinc/07/56/35/566075635.db2.gz JNVBLCLTYSHYJC-SNVBAGLBSA-N 0 0 398.428 3.377 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 ZINC000248374665 566075890 /nfs/dbraw/zinc/07/58/90/566075890.db2.gz SGUKXKFEKAZJPN-IUIKQTSFSA-N 0 0 382.869 3.414 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1CCSC[C@H]1C1CC1 ZINC000416492146 566076165 /nfs/dbraw/zinc/07/61/65/566076165.db2.gz BOIPSCLXMMQARJ-LBPRGKRZSA-N 0 0 396.412 3.130 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCO[C@@H](c2cccs2)C1 ZINC000416507187 566079033 /nfs/dbraw/zinc/07/90/33/566079033.db2.gz JIEIMLGZRZNQCM-TZMCWYRMSA-N 0 0 382.463 3.163 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1c(F)cc(Cl)cc1F ZINC000180663145 566080418 /nfs/dbraw/zinc/08/04/18/566080418.db2.gz ICWYDKRLKCDFIH-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H](C)c2nc3c(s2)CCC3)c1C ZINC000416538114 566083412 /nfs/dbraw/zinc/08/34/12/566083412.db2.gz QDQGLZKZGLONIM-LLVKDONJSA-N 0 0 381.479 3.196 20 5 GGBDRN C[C@H](CCCc1cccnc1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000416539585 566083432 /nfs/dbraw/zinc/08/34/32/566083432.db2.gz SNYZVSWIKIEXEY-GFCCVEGCSA-N 0 0 383.857 3.333 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C)c1nc2c(s1)CCC2 ZINC000416538869 566083435 /nfs/dbraw/zinc/08/34/35/566083435.db2.gz RHIKAAWIPWXMLF-JTQLQIEISA-N 0 0 381.479 3.142 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000248618897 566084094 /nfs/dbraw/zinc/08/40/94/566084094.db2.gz LORFWRWEGHNYJY-CIRKLDFFSA-N 0 0 387.889 3.127 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCn1cc(Br)cn1 ZINC000288702368 566086673 /nfs/dbraw/zinc/08/66/73/566086673.db2.gz FFIKHGBZFFYPHI-UHFFFAOYSA-N 0 0 396.245 3.382 20 5 GGBDRN O=C(NCc1noc2c1CCCC2)c1cccc([N+](=O)[O-])c1Br ZINC000288718719 566087415 /nfs/dbraw/zinc/08/74/15/566087415.db2.gz YANXJLNTKVMYNB-UHFFFAOYSA-N 0 0 380.198 3.154 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(CC(F)(F)F)c2ccncc2)cc1[N+](=O)[O-] ZINC000180796229 566089264 /nfs/dbraw/zinc/08/92/64/566089264.db2.gz GRANOAQXFVFCEQ-UHFFFAOYSA-N 0 0 375.328 3.056 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CC(F)(F)F)c2ccncc2)c(Cl)c1 ZINC000180795831 566089358 /nfs/dbraw/zinc/08/93/58/566089358.db2.gz VDIWSFCUOUMVAU-UHFFFAOYSA-N 0 0 395.746 3.401 20 5 GGBDRN CC(C)(C)c1ccncc1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000416584320 566090350 /nfs/dbraw/zinc/09/03/50/566090350.db2.gz HVYQEYNEVDMUDN-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCn1cc(Br)cn1 ZINC000288807007 566092203 /nfs/dbraw/zinc/09/22/03/566092203.db2.gz JSAYBGJEIIDPKC-UHFFFAOYSA-N 0 0 382.218 3.074 20 5 GGBDRN O=C(Nc1cc(Br)ccc1F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180837353 566093446 /nfs/dbraw/zinc/09/34/46/566093446.db2.gz IWDRLSRZGJOICA-UHFFFAOYSA-N 0 0 383.129 3.477 20 5 GGBDRN C[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])Oc1ccccc1Br ZINC000180844623 566093984 /nfs/dbraw/zinc/09/39/84/566093984.db2.gz SYUQZHWTULBPPK-JTQLQIEISA-N 0 0 394.225 3.137 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[C@@H](OCC2CC2)C1 ZINC000365296758 566094523 /nfs/dbraw/zinc/09/45/23/566094523.db2.gz PZHVXPDTTGJJIC-GFCCVEGCSA-N 0 0 383.242 3.389 20 5 GGBDRN COC1(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000180861798 566094450 /nfs/dbraw/zinc/09/44/50/566094450.db2.gz CESBXTJTEBPEAN-UHFFFAOYSA-N 0 0 378.372 3.391 20 5 GGBDRN Cc1cnc(C2CCN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])CC2)s1 ZINC000365315487 566095267 /nfs/dbraw/zinc/09/52/67/566095267.db2.gz DNFRSQKBXJVKAG-UHFFFAOYSA-N 0 0 381.479 3.069 20 5 GGBDRN COc1ccc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1Cl ZINC000416610305 566095241 /nfs/dbraw/zinc/09/52/41/566095241.db2.gz ARKSVWVUFZMANC-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)CC(F)(F)Br)cc1OC ZINC000288889013 566095818 /nfs/dbraw/zinc/09/58/18/566095818.db2.gz DXELAAWSIYHDQT-UHFFFAOYSA-N 0 0 397.172 3.062 20 5 GGBDRN O=C(c1cccc(Br)c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365369128 566097343 /nfs/dbraw/zinc/09/73/43/566097343.db2.gz YFFONKRHGXFCAO-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN COc1ccc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1Cl ZINC000416621042 566097495 /nfs/dbraw/zinc/09/74/95/566097495.db2.gz YLXFKYYZURAEDC-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN O=C(CSc1ccccc1Cl)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365361840 566097681 /nfs/dbraw/zinc/09/76/81/566097681.db2.gz JOCDKUAYIMVBFF-UHFFFAOYSA-N 0 0 380.857 3.401 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(c3ncccc3Cl)CC2)s1 ZINC000365429203 566100933 /nfs/dbraw/zinc/10/09/33/566100933.db2.gz RIALUJJGVGKKEV-UHFFFAOYSA-N 0 0 387.870 3.273 20 5 GGBDRN C[C@@H]1[C@H](C)CN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC000416658924 566101900 /nfs/dbraw/zinc/10/19/00/566101900.db2.gz KSMFSGSYLGHGQC-BBBLOLIVSA-N 0 0 377.260 3.022 20 5 GGBDRN CN(Cc1ncc(I)s1)Cc1ccccc1[N+](=O)[O-] ZINC000289029822 566101946 /nfs/dbraw/zinc/10/19/46/566101946.db2.gz GWTAMFHGNVWAMW-UHFFFAOYSA-N 0 0 389.218 3.288 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCSC[C@H]1C1CCC1 ZINC000416662274 566102127 /nfs/dbraw/zinc/10/21/27/566102127.db2.gz PWTQGOWNFXIERK-ZDUSSCGKSA-N 0 0 376.887 3.154 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180979430 566103843 /nfs/dbraw/zinc/10/38/43/566103843.db2.gz RJLDUXYWXZTPTF-SNVBAGLBSA-N 0 0 378.226 3.301 20 5 GGBDRN O=C(N[C@@H]1CCCOCC1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000180989535 566104914 /nfs/dbraw/zinc/10/49/14/566104914.db2.gz XVGHMZNYZQRNTL-SECBINFHSA-N 0 0 377.622 3.310 20 5 GGBDRN COC[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000289084250 566105315 /nfs/dbraw/zinc/10/53/15/566105315.db2.gz OGZVJXZRVAIFFB-HNNXBMFYSA-N 0 0 384.841 3.451 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2c(Br)cccc2C1 ZINC000181003081 566105791 /nfs/dbraw/zinc/10/57/91/566105791.db2.gz OXENMVJVJKOIQW-UHFFFAOYSA-N 0 0 376.210 3.138 20 5 GGBDRN CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000181027784 566107371 /nfs/dbraw/zinc/10/73/71/566107371.db2.gz POBHJRGFPNPVIS-LLVKDONJSA-N 0 0 383.857 3.007 20 5 GGBDRN CN(Cc1csc([N+](=O)[O-])c1)[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000181071997 566110757 /nfs/dbraw/zinc/11/07/57/566110757.db2.gz RYOWHIBVDABWHV-CYBMUJFWSA-N 0 0 384.255 3.077 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCOC[C@H]1c1ccco1 ZINC000365678578 566115287 /nfs/dbraw/zinc/11/52/87/566115287.db2.gz PRJOALHSKXMKMK-VIFPVBQESA-N 0 0 387.211 3.226 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[C@@H](Oc2ccncc2)C1 ZINC000365758698 566117355 /nfs/dbraw/zinc/11/73/55/566117355.db2.gz OYTGFDGVUBJKBE-GFCCVEGCSA-N 0 0 392.209 3.046 20 5 GGBDRN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN(C1CC1)[C@@H]1CCS(=O)(=O)C1 ZINC000289350163 566118625 /nfs/dbraw/zinc/11/86/25/566118625.db2.gz KUUAUWSJOUYFPE-GFCCVEGCSA-N 0 0 379.265 3.053 20 5 GGBDRN CN(Cc1ncnn1CC(F)F)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000289365916 566119703 /nfs/dbraw/zinc/11/97/03/566119703.db2.gz JNFRJKWAZIYZCN-UHFFFAOYSA-N 0 0 380.182 3.390 20 5 GGBDRN Cc1c(NC(=O)N2CCCO[C@@H](CF)C2)cc(Br)cc1[N+](=O)[O-] ZINC000417069179 566122956 /nfs/dbraw/zinc/12/29/56/566122956.db2.gz FKDSLBDMCYSTPI-NSHDSACASA-N 0 0 390.209 3.258 20 5 GGBDRN C[C@@H](Sc1nnc(C(F)F)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000181231274 566126307 /nfs/dbraw/zinc/12/63/07/566126307.db2.gz QKBLTZQISWEACT-ZCFIWIBFSA-N 0 0 391.787 3.434 20 5 GGBDRN Cc1nnc(CNc2ccc(I)cc2[N+](=O)[O-])n1C1CC1 ZINC000289522247 566127150 /nfs/dbraw/zinc/12/71/50/566127150.db2.gz DFNDTGLFSCVOHT-UHFFFAOYSA-N 0 0 399.192 3.046 20 5 GGBDRN Cc1cc(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)ccc1Br ZINC000365943328 566127525 /nfs/dbraw/zinc/12/75/25/566127525.db2.gz AUGNVSYUNCQZPF-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN O=C(c1cc(F)ccc1Br)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365952669 566127776 /nfs/dbraw/zinc/12/77/76/566127776.db2.gz CYDRAHPCJATBSR-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN O=[N+]([O-])c1ccn(C2CCN(c3ncc(Cl)cc3Br)CC2)n1 ZINC000365967993 566128325 /nfs/dbraw/zinc/12/83/25/566128325.db2.gz YEURSUUZHJYVSQ-UHFFFAOYSA-N 0 0 386.637 3.444 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CN[C@H]2CCCc3c[nH]nc32)c1 ZINC000289567542 566129020 /nfs/dbraw/zinc/12/90/20/566129020.db2.gz ROBZXHSSCXSDNI-ZDUSSCGKSA-N 0 0 398.204 3.090 20 5 GGBDRN Nc1c(Cl)cc(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1Cl ZINC000365986798 566130035 /nfs/dbraw/zinc/13/00/35/566130035.db2.gz HERYHPYLCKVURR-UHFFFAOYSA-N 0 0 384.223 3.158 20 5 GGBDRN CC[C@@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)[S@]1=O ZINC000289638308 566132472 /nfs/dbraw/zinc/13/24/72/566132472.db2.gz MHDMAUVTFYTDSK-ZBTPNEDBSA-N 0 0 379.507 3.450 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000366188940 566139184 /nfs/dbraw/zinc/13/91/84/566139184.db2.gz ILRONHIBOVRJSS-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN Cc1nnc([C@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2Cl)s1 ZINC000289801086 566141550 /nfs/dbraw/zinc/14/15/50/566141550.db2.gz JJCRFOGNYUQYAP-YFKPBYRVSA-N 0 0 397.265 3.101 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@H](C(F)(F)F)[C@H](CO)C1 ZINC000289830586 566142680 /nfs/dbraw/zinc/14/26/80/566142680.db2.gz WUBQWJHISDPJRT-IUCAKERBSA-N 0 0 381.738 3.273 20 5 GGBDRN CCc1nnc(CNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)s1 ZINC000289856078 566143840 /nfs/dbraw/zinc/14/38/40/566143840.db2.gz CNBWPTYCPIEQQP-UHFFFAOYSA-N 0 0 386.231 3.093 20 5 GGBDRN COc1ccc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)nc1Br ZINC000181488580 566144690 /nfs/dbraw/zinc/14/46/90/566144690.db2.gz IIQSVCLXQUSYJI-UHFFFAOYSA-N 0 0 392.209 3.354 20 5 GGBDRN C[C@H](O)C[C@@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000181529990 566147854 /nfs/dbraw/zinc/14/78/54/566147854.db2.gz YPCRQTONFXPORA-AAEUAGOBSA-N 0 0 384.479 3.026 20 5 GGBDRN CC(C)OCCOC[C@H](O)CN(C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000289924215 566148397 /nfs/dbraw/zinc/14/83/97/566148397.db2.gz OTWKFJYSSAFNIS-CQSZACIVSA-N 0 0 395.283 3.136 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000181617753 566152512 /nfs/dbraw/zinc/15/25/12/566152512.db2.gz CKKVWNDBZWLNHI-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN C[C@H](C[S@](C)=O)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000181615383 566152933 /nfs/dbraw/zinc/15/29/33/566152933.db2.gz XJAPKUQLGKJZGY-YDBLSZJJSA-N 0 0 378.475 3.243 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(CCOCC(F)F)n2)c(Br)c1 ZINC000290064706 566154688 /nfs/dbraw/zinc/15/46/88/566154688.db2.gz KRDFVRPDNSZOKI-UHFFFAOYSA-N 0 0 392.156 3.155 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCC1(F)F ZINC000290059778 566154963 /nfs/dbraw/zinc/15/49/63/566154963.db2.gz BVAFKDIOUUGSDW-MRVPVSSYSA-N 0 0 388.314 3.279 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CCC1(F)F ZINC000290047790 566155218 /nfs/dbraw/zinc/15/52/18/566155218.db2.gz BBYKIOLRCXZWAK-QMMMGPOBSA-N 0 0 399.213 3.023 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@@H](C)C[S@@](C)=O)cc2[N+](=O)[O-])n1 ZINC000181673122 566157304 /nfs/dbraw/zinc/15/73/04/566157304.db2.gz QBPTZRBOGDKAGC-UXMMLNGASA-N 0 0 399.519 3.008 20 5 GGBDRN C[C@@H]1C(=O)CC[C@@H]1Cc1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000290110711 566157549 /nfs/dbraw/zinc/15/75/49/566157549.db2.gz ODNAAJIPTNHRNZ-VHSXEESVSA-N 0 0 394.225 3.489 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000366621922 566162474 /nfs/dbraw/zinc/16/24/74/566162474.db2.gz ZYKYDBVBGVLSEV-SECBINFHSA-N 0 0 375.376 3.183 20 5 GGBDRN CCCCN(C(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000290271680 566164778 /nfs/dbraw/zinc/16/47/78/566164778.db2.gz PJYDNVYTCCLTIW-UHFFFAOYSA-N 0 0 384.230 3.087 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])CCC1(F)F ZINC000290288585 566165860 /nfs/dbraw/zinc/16/58/60/566165860.db2.gz WIEVUSHWFMGHPA-QMMMGPOBSA-N 0 0 399.213 3.023 20 5 GGBDRN CC(C)(C)[S@@](=O)CCNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000181791103 566166054 /nfs/dbraw/zinc/16/60/54/566166054.db2.gz HZEZNHFRLUFTLQ-VWLOTQADSA-N 0 0 381.376 3.282 20 5 GGBDRN CNc1nc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cs1 ZINC000181786735 566166386 /nfs/dbraw/zinc/16/63/86/566166386.db2.gz HBGGGSPIRUXGGT-UHFFFAOYSA-N 0 0 375.332 3.434 20 5 GGBDRN CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000181922914 566173373 /nfs/dbraw/zinc/17/33/73/566173373.db2.gz NHTNUULFGZMVPV-LLVKDONJSA-N 0 0 383.857 3.007 20 5 GGBDRN CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H]1[C@H]1CCCO1 ZINC000290498517 566175587 /nfs/dbraw/zinc/17/55/87/566175587.db2.gz FVWHUHVUSAUYOP-KGLIPLIRSA-N 0 0 383.242 3.387 20 5 GGBDRN Cc1cnn([C@@H]2CCN(C(=O)c3cc(Br)c(C)c([N+](=O)[O-])c3)C2)c1 ZINC000290759854 566187823 /nfs/dbraw/zinc/18/78/23/566187823.db2.gz QJTZFWXJQDCFHY-CYBMUJFWSA-N 0 0 393.241 3.258 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CC[C@H](n2cc(Cl)cn2)C1 ZINC000290767297 566187956 /nfs/dbraw/zinc/18/79/56/566187956.db2.gz RBWOUKIPRHRHFQ-NSHDSACASA-N 0 0 399.632 3.294 20 5 GGBDRN O=[N+]([O-])c1cc(F)c(S(=O)(=O)N2CCCC[C@H]2c2ncc[nH]2)cc1Cl ZINC000290752460 566188062 /nfs/dbraw/zinc/18/80/62/566188062.db2.gz MVZQWGREXXONHU-NSHDSACASA-N 0 0 388.808 3.026 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CSc1nc2cc(Cl)cnc2[nH]1 ZINC000182180871 566188184 /nfs/dbraw/zinc/18/81/84/566188184.db2.gz NXWJVUKSGSJGES-JTQLQIEISA-N 0 0 380.813 3.052 20 5 GGBDRN CC[C@](C)(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000182193665 566189316 /nfs/dbraw/zinc/18/93/16/566189316.db2.gz YQRWKCGJZBJOSA-INIZCTEOSA-N 0 0 383.495 3.048 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc2oc(=O)[nH]c2c1 ZINC000182218288 566190902 /nfs/dbraw/zinc/19/09/02/566190902.db2.gz XPYVDXRCTLHIFU-UHFFFAOYSA-N 0 0 379.781 3.414 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000290824090 566191214 /nfs/dbraw/zinc/19/12/14/566191214.db2.gz WLFIKVLBFYHKJG-GFCCVEGCSA-N 0 0 399.632 3.294 20 5 GGBDRN Cc1nn(CCC(=O)NCc2cc(Br)ccc2F)c(C)c1[N+](=O)[O-] ZINC000263655575 566191426 /nfs/dbraw/zinc/19/14/26/566191426.db2.gz IBJKMUFGZGOYSR-UHFFFAOYSA-N 0 0 399.220 3.016 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000263640325 566192054 /nfs/dbraw/zinc/19/20/54/566192054.db2.gz AEMLVWUMMPOEMD-AWEZNQCLSA-N 0 0 393.241 3.130 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000263688801 566192804 /nfs/dbraw/zinc/19/28/04/566192804.db2.gz CBPFTXBGEATKIL-LLVKDONJSA-N 0 0 392.257 3.279 20 5 GGBDRN O=C(NCCCCCCO)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000182264918 566192882 /nfs/dbraw/zinc/19/28/82/566192882.db2.gz AAXNVHGHUWCWKZ-UHFFFAOYSA-N 0 0 379.638 3.293 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)COc1ccc(F)cc1Br ZINC000182266586 566193792 /nfs/dbraw/zinc/19/37/92/566193792.db2.gz CTQLTPPVXRMKKS-NSHDSACASA-N 0 0 386.173 3.315 20 5 GGBDRN CC(C)OCc1nc([C@H](C)Nc2ncc(Br)cc2[N+](=O)[O-])no1 ZINC000290875318 566193921 /nfs/dbraw/zinc/19/39/21/566193921.db2.gz RVOYISSYJKRWCZ-QMMMGPOBSA-N 0 0 386.206 3.233 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)Cn1nnc2cc(Cl)c(Cl)cc21 ZINC000182296085 566195290 /nfs/dbraw/zinc/19/52/90/566195290.db2.gz AFIWUHCKUQSXGQ-SECBINFHSA-N 0 0 383.191 3.086 20 5 GGBDRN Cc1nccn1C[C@H](C)CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000182287385 566195313 /nfs/dbraw/zinc/19/53/13/566195313.db2.gz RKYPQRCMDDAZEY-LLVKDONJSA-N 0 0 382.873 3.298 20 5 GGBDRN COc1cccc(Br)c1OC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182290867 566195386 /nfs/dbraw/zinc/19/53/86/566195386.db2.gz JQIQRCQZGUTJNR-NSHDSACASA-N 0 0 398.209 3.185 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)COc1cc(Br)ccc1F ZINC000182299905 566195684 /nfs/dbraw/zinc/19/56/84/566195684.db2.gz WJNSYSSHOFKHDJ-LLVKDONJSA-N 0 0 386.173 3.315 20 5 GGBDRN Cc1nccn1C[C@@H](C)CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000182287367 566195745 /nfs/dbraw/zinc/19/57/45/566195745.db2.gz RKYPQRCMDDAZEY-NSHDSACASA-N 0 0 382.873 3.298 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@H]2C1 ZINC000367368280 566197881 /nfs/dbraw/zinc/19/78/81/566197881.db2.gz RXOCAYMVZKBKIN-XHDPSFHLSA-N 0 0 383.242 3.307 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000367413333 566200225 /nfs/dbraw/zinc/20/02/25/566200225.db2.gz RHHALOMSCJBGAG-STQMWFEESA-N 0 0 388.873 3.076 20 5 GGBDRN CC(C)(C)n1cnc(C(=O)OCc2ccc([N+](=O)[O-])cc2Br)n1 ZINC000291030956 566201937 /nfs/dbraw/zinc/20/19/37/566201937.db2.gz GVAMPCXTZPDRSW-UHFFFAOYSA-N 0 0 383.202 3.061 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000367504887 566204938 /nfs/dbraw/zinc/20/49/38/566204938.db2.gz ABMLHVATYXYBGL-OAHLLOKOSA-N 0 0 393.241 3.377 20 5 GGBDRN CC(C)(CCc1noc(-c2cn3ccc(Br)cc3n2)n1)[N+](=O)[O-] ZINC000291142035 566207062 /nfs/dbraw/zinc/20/70/62/566207062.db2.gz YCNFLKVZGNLCEF-UHFFFAOYSA-N 0 0 380.202 3.135 20 5 GGBDRN O=C(NCCNc1cccc(Br)c1)NCc1cccc([N+](=O)[O-])c1 ZINC000182500694 566208543 /nfs/dbraw/zinc/20/85/43/566208543.db2.gz QDRKMZYNRGTKJZ-UHFFFAOYSA-N 0 0 393.241 3.269 20 5 GGBDRN CC(C)(C)c1csc(CCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000264233568 566208605 /nfs/dbraw/zinc/20/86/05/566208605.db2.gz YYIJSAATXWBZAQ-UHFFFAOYSA-N 0 0 383.495 3.011 20 5 GGBDRN CC1(C)CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H]1[C@H]1CCCO1 ZINC000291193505 566208896 /nfs/dbraw/zinc/20/88/96/566208896.db2.gz KRFJKIRQQUKGSG-ZIAGYGMSSA-N 0 0 383.242 3.387 20 5 GGBDRN Cc1n[nH]c(C(=O)NC2(c3ccc(Br)cc3)CCC2)c1[N+](=O)[O-] ZINC000264281868 566209946 /nfs/dbraw/zinc/20/99/46/566209946.db2.gz VEZYICYKQVMJTI-UHFFFAOYSA-N 0 0 379.214 3.198 20 5 GGBDRN O=C(NCCSCc1ccc(Cl)cc1Cl)c1[nH]ncc1[N+](=O)[O-] ZINC000182530373 566210645 /nfs/dbraw/zinc/21/06/45/566210645.db2.gz OISJNURLKWKITP-UHFFFAOYSA-N 0 0 375.237 3.288 20 5 GGBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCS[C@H]2COCC[C@H]21 ZINC000291239770 566210911 /nfs/dbraw/zinc/21/09/11/566210911.db2.gz BDSNCVSUHJJHQS-NEPJUHHUSA-N 0 0 377.249 3.248 20 5 GGBDRN COCc1nc(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000291398078 566217649 /nfs/dbraw/zinc/21/76/49/566217649.db2.gz HKTZPEZIBVWYCZ-UHFFFAOYSA-N 0 0 387.870 3.260 20 5 GGBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2Br)[C@@H]1[C@@H]1CCCO1 ZINC000291411364 566218822 /nfs/dbraw/zinc/21/88/22/566218822.db2.gz FHYJRPJTEIDEQA-UONOGXRCSA-N 0 0 383.242 3.387 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC[C@@H]1c1ncon1 ZINC000182774714 566223963 /nfs/dbraw/zinc/22/39/63/566223963.db2.gz KSBGTFKLHNUHGP-LLVKDONJSA-N 0 0 382.829 3.477 20 5 GGBDRN CC(C)(C)[S@@](=O)CCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000182796959 566224846 /nfs/dbraw/zinc/22/48/46/566224846.db2.gz RMFKLBDWEZFNOH-QHCPKHFHSA-N 0 0 378.903 3.004 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000291567784 566225539 /nfs/dbraw/zinc/22/55/39/566225539.db2.gz ORRPVEHHFMZPSI-LLVKDONJSA-N 0 0 399.632 3.294 20 5 GGBDRN Cc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)s1 ZINC000182833002 566225815 /nfs/dbraw/zinc/22/58/15/566225815.db2.gz OMCOYSUSPILNLW-JTQLQIEISA-N 0 0 387.458 3.497 20 5 GGBDRN O=[N+]([O-])c1cncc(I)c1N1CC=C(C(F)(F)F)CC1 ZINC000418889363 566226556 /nfs/dbraw/zinc/22/65/56/566226556.db2.gz BHCKTQCYIKYPKB-UHFFFAOYSA-N 0 0 399.110 3.293 20 5 GGBDRN COc1cc(C(=O)NCC2CCSCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000264929040 566227911 /nfs/dbraw/zinc/22/79/11/566227911.db2.gz OZGHSBIEQXIBPC-UHFFFAOYSA-N 0 0 376.381 3.078 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000291626094 566228545 /nfs/dbraw/zinc/22/85/45/566228545.db2.gz UKIPRDLTKSMOEB-SNVBAGLBSA-N 0 0 399.632 3.294 20 5 GGBDRN CC1(C)CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H]1[C@@H]1CCCO1 ZINC000291668568 566229884 /nfs/dbraw/zinc/22/98/84/566229884.db2.gz RATJIQSBTIJSOH-KBPBESRZSA-N 0 0 383.242 3.387 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(C)cc(Br)c2O)c(C)c1[N+](=O)[O-] ZINC000182932922 566230916 /nfs/dbraw/zinc/23/09/16/566230916.db2.gz KCYBNCPCYYVTAB-UHFFFAOYSA-N 0 0 397.229 3.213 20 5 GGBDRN COCCOC1CCN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000291724096 566232357 /nfs/dbraw/zinc/23/23/57/566232357.db2.gz BOLFMJZNWMLRDD-UHFFFAOYSA-N 0 0 377.224 3.169 20 5 GGBDRN CC1(C)C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C(C)(C)O1 ZINC000183097953 566237823 /nfs/dbraw/zinc/23/78/23/566237823.db2.gz YKGWONXGKCLKQJ-ZDUSSCGKSA-N 0 0 385.258 3.362 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(c3ncc(C)s3)CC2)cc1[N+](=O)[O-] ZINC000265603807 566239760 /nfs/dbraw/zinc/23/97/60/566239760.db2.gz MAMNBTSQARSWMF-UHFFFAOYSA-N 0 0 378.479 3.044 20 5 GGBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000265598792 566239882 /nfs/dbraw/zinc/23/98/82/566239882.db2.gz ZDVDDRCCXGCUOO-JTQLQIEISA-N 0 0 384.845 3.067 20 5 GGBDRN COc1cc(Br)ccc1CCCNC(=O)c1ccc([N+](=O)[O-])o1 ZINC000183236151 566241338 /nfs/dbraw/zinc/24/13/38/566241338.db2.gz JLWSCLUDXSZNMJ-UHFFFAOYSA-N 0 0 383.198 3.322 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccs1 ZINC000183249025 566241843 /nfs/dbraw/zinc/24/18/43/566241843.db2.gz PYVZUWOUAKRZDL-LBPRGKRZSA-N 0 0 380.447 3.082 20 5 GGBDRN CC[C@H](NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CC1(C)C ZINC000419769064 566243992 /nfs/dbraw/zinc/24/39/92/566243992.db2.gz CONVRBDRBXRRAI-OLZOCXBDSA-N 0 0 398.257 3.237 20 5 GGBDRN CC[C@H](NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CC1(C)C ZINC000419769068 566244157 /nfs/dbraw/zinc/24/41/57/566244157.db2.gz CONVRBDRBXRRAI-STQMWFEESA-N 0 0 398.257 3.237 20 5 GGBDRN C[C@H](CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000183340605 566244614 /nfs/dbraw/zinc/24/46/14/566244614.db2.gz YDZHTWPTPWTMDK-SECBINFHSA-N 0 0 375.859 3.129 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCSc3ncccc32)cc1SC ZINC000266107879 566246049 /nfs/dbraw/zinc/24/60/49/566246049.db2.gz OXOXNGBYFFJMPY-UHFFFAOYSA-N 0 0 377.447 3.473 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000266119960 566246081 /nfs/dbraw/zinc/24/60/81/566246081.db2.gz QRJMFEUXNSLKEG-VHSXEESVSA-N 0 0 378.372 3.247 20 5 GGBDRN C[C@@H](c1ccccc1Br)N(C)C(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183421258 566246817 /nfs/dbraw/zinc/24/68/17/566246817.db2.gz BDFUMCALKQGVLB-VIFPVBQESA-N 0 0 379.214 3.168 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H]2CCOc3c(Cl)c(Cl)ccc32)c1[N+](=O)[O-] ZINC000368895461 566247079 /nfs/dbraw/zinc/24/70/79/566247079.db2.gz JCBQLPJMWJSXOG-SNVBAGLBSA-N 0 0 385.207 3.197 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])s1 ZINC000266208206 566247277 /nfs/dbraw/zinc/24/72/77/566247277.db2.gz PUGYIOFRTCRPCK-SNVBAGLBSA-N 0 0 387.458 3.443 20 5 GGBDRN COC(=O)c1cnc(N2CCO[C@@H](c3ccc(Cl)s3)C2)c([N+](=O)[O-])c1 ZINC000368983368 566248764 /nfs/dbraw/zinc/24/87/64/566248764.db2.gz PGKVLYFKVFEBOF-LLVKDONJSA-N 0 0 383.813 3.069 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC(n2cc(Br)cn2)CC1 ZINC000369157614 566250109 /nfs/dbraw/zinc/25/01/09/566250109.db2.gz TVVDHVHJVRBPPX-UHFFFAOYSA-N 0 0 394.229 3.423 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC(n2cc(Br)cn2)CC1 ZINC000369154332 566250129 /nfs/dbraw/zinc/25/01/29/566250129.db2.gz HOQCUKVCJFRNCY-UHFFFAOYSA-N 0 0 394.229 3.423 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H]1c1ccncc1)c1ccc([N+](=O)[O-])cc1Br ZINC000555776414 566251432 /nfs/dbraw/zinc/25/14/32/566251432.db2.gz UZPUUZGKBVFELW-LSDHHAIUSA-N 0 0 392.209 3.012 20 5 GGBDRN COC1CCC(N(C)S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000462126554 566251852 /nfs/dbraw/zinc/25/18/52/566251852.db2.gz FVNWSVSTBYHRAE-UHFFFAOYSA-N 0 0 397.280 3.480 20 5 GGBDRN C[C@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Br)s1 ZINC000444768232 566252229 /nfs/dbraw/zinc/25/22/29/566252229.db2.gz STZXXBNFWJMWFT-QMMMGPOBSA-N 0 0 384.255 3.369 20 5 GGBDRN CC[C@@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000462129497 566252387 /nfs/dbraw/zinc/25/23/87/566252387.db2.gz FTSWJXSNMCXWMF-PSASIEDQSA-N 0 0 383.253 3.090 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1COc2ccccc2C1 ZINC000555812590 566252655 /nfs/dbraw/zinc/25/26/55/566252655.db2.gz WJTJIWIVQOTVCT-LBPRGKRZSA-N 0 0 391.221 3.399 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Sc1cccs1)[C@H]1CCCS1(=O)=O ZINC000575134536 566253488 /nfs/dbraw/zinc/25/34/88/566253488.db2.gz AVUBVDQJHIDNLK-CYBMUJFWSA-N 0 0 398.487 3.323 20 5 GGBDRN COc1nc(C)cc(C)c1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599296257 566253725 /nfs/dbraw/zinc/25/37/25/566253725.db2.gz SVFMTQNQRDQHIH-UHFFFAOYSA-N 0 0 394.225 3.308 20 5 GGBDRN COc1ccc(CNC(=O)c2sc(Br)cc2[N+](=O)[O-])cc1F ZINC000444852994 566253985 /nfs/dbraw/zinc/25/39/85/566253985.db2.gz DQLIGMDNADBGEE-UHFFFAOYSA-N 0 0 389.202 3.497 20 5 GGBDRN O=C(NCCOc1ccccc1F)c1sc(Br)cc1[N+](=O)[O-] ZINC000444823411 566254435 /nfs/dbraw/zinc/25/44/35/566254435.db2.gz BZOMICMHCBQFKN-UHFFFAOYSA-N 0 0 389.202 3.367 20 5 GGBDRN O=[N+]([O-])c1cc(F)c(CN[C@H](CO)c2ccc(Br)cc2)c(F)c1 ZINC000508991245 566254621 /nfs/dbraw/zinc/25/46/21/566254621.db2.gz LNMIIVQAWIMBKZ-OAHLLOKOSA-N 0 0 387.180 3.459 20 5 GGBDRN CCC1(C)CN(S(=O)(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000462143550 566254700 /nfs/dbraw/zinc/25/47/00/566254700.db2.gz WXGXPQIVCLZNEI-UHFFFAOYSA-N 0 0 377.260 3.086 20 5 GGBDRN CCn1[nH]c(=NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cc1C1CC1 ZINC000555863313 566255322 /nfs/dbraw/zinc/25/53/22/566255322.db2.gz HJCPMGPUGOKQLY-UHFFFAOYSA-N 0 0 393.241 3.434 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3ccc(Br)c(C)c3)no2)c1[N+](=O)[O-] ZINC000575168200 566255746 /nfs/dbraw/zinc/25/57/46/566255746.db2.gz CCLKQDJUTIBONB-UHFFFAOYSA-N 0 0 392.213 3.348 20 5 GGBDRN CCC[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)OCC ZINC000599367269 566257164 /nfs/dbraw/zinc/25/71/64/566257164.db2.gz DQLGEPJJJUMEPX-NSHDSACASA-N 0 0 384.376 3.097 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1sccc1Br ZINC000509035629 566258237 /nfs/dbraw/zinc/25/82/37/566258237.db2.gz XPMKCCMJZLEOPT-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN Cc1cc(N[C@@H]2CCCN(c3ccnn3C)C2)c(Br)cc1[N+](=O)[O-] ZINC000444879256 566258220 /nfs/dbraw/zinc/25/82/20/566258220.db2.gz SSNCTUWIPDDPMM-GFCCVEGCSA-N 0 0 394.273 3.480 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1ccc(Br)cc1 ZINC000509071899 566259552 /nfs/dbraw/zinc/25/95/52/566259552.db2.gz SLIDZOGDMWOFJR-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(Br)cc2)CCCC1 ZINC000481873038 566259730 /nfs/dbraw/zinc/25/97/30/566259730.db2.gz KNYSXUBLDOSEFX-UHFFFAOYSA-N 0 0 393.241 3.290 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCCC(F)(F)CC2)c1 ZINC000599399446 566262599 /nfs/dbraw/zinc/26/25/99/566262599.db2.gz SURVLMTXTBYLJR-UHFFFAOYSA-N 0 0 399.213 3.167 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1CCCC(F)(F)CC1 ZINC000599400657 566262800 /nfs/dbraw/zinc/26/28/00/566262800.db2.gz BRNICLHCJOJNCA-UHFFFAOYSA-N 0 0 388.314 3.424 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cnc2ccsc2c1 ZINC000509114330 566264380 /nfs/dbraw/zinc/26/43/80/566264380.db2.gz WIRXRTDSTGLINN-UHFFFAOYSA-N 0 0 377.447 3.068 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cccc(Br)c1 ZINC000509111576 566264805 /nfs/dbraw/zinc/26/48/05/566264805.db2.gz PCIAYWOWIYOYLM-UHFFFAOYSA-N 0 0 399.266 3.221 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)[C@H](C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000509142224 566266239 /nfs/dbraw/zinc/26/62/39/566266239.db2.gz WXFZNOYWEQVTHQ-NSHDSACASA-N 0 0 382.825 3.358 20 5 GGBDRN O=C(CS(=O)(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(Cl)c(Cl)c1 ZINC000509133831 566266749 /nfs/dbraw/zinc/26/67/49/566266749.db2.gz AYJXETQWTXZSKJ-UHFFFAOYSA-N 0 0 389.216 3.314 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(F)cc1Cl)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000509134900 566266908 /nfs/dbraw/zinc/26/69/08/566266908.db2.gz DCNQGQLJBJUSPL-SECBINFHSA-N 0 0 386.788 3.188 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Cc2ccn(-c3ccc(Cl)cc3)n2)c1 ZINC000509147105 566267661 /nfs/dbraw/zinc/26/76/61/566267661.db2.gz RKRLZMJOFCCGDO-UHFFFAOYSA-N 0 0 377.809 3.408 20 5 GGBDRN C[C@H]1CC(F)(F)CCN1S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000599469941 566268085 /nfs/dbraw/zinc/26/80/85/566268085.db2.gz MVWJSPSCPYTNJQ-QMMMGPOBSA-N 0 0 388.314 3.422 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])S(=O)(=O)CCc1cccc(Cl)c1 ZINC000509154941 566268169 /nfs/dbraw/zinc/26/81/69/566268169.db2.gz PJZPWSMLHGGSBX-UHFFFAOYSA-N 0 0 382.869 3.295 20 5 GGBDRN Cc1cc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])ccc1C(N)=O ZINC000445176327 566271728 /nfs/dbraw/zinc/27/17/28/566271728.db2.gz FZSAKIAJSDKDPT-UHFFFAOYSA-N 0 0 384.211 3.078 20 5 GGBDRN O=C(NCc1cccc2c1OCO2)c1sc(Br)cc1[N+](=O)[O-] ZINC000445172060 566271994 /nfs/dbraw/zinc/27/19/94/566271994.db2.gz IZIFDYVHJGRMQQ-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN CN1CCN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc21 ZINC000599528914 566272512 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C[C@@H]1CCCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@H]1C ZINC000462300035 566278372 /nfs/dbraw/zinc/27/83/72/566278372.db2.gz RLNPDXYZQDBDLF-ZJUUUORDSA-N 0 0 377.260 3.166 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000482051805 566278974 /nfs/dbraw/zinc/27/89/74/566278974.db2.gz GJBMZSICQYLAGG-UHFFFAOYSA-N 0 0 382.207 3.089 20 5 GGBDRN Cc1ccc(OCc2cc(=O)n3cc(Br)ccc3n2)cc1[N+](=O)[O-] ZINC000535132766 566280222 /nfs/dbraw/zinc/28/02/22/566280222.db2.gz DRROIIDGRCFXKK-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN O=[N+]([O-])c1c[nH]c(-c2nc(-c3csc(I)c3)no2)c1 ZINC000445301528 566282700 /nfs/dbraw/zinc/28/27/00/566282700.db2.gz NAZIXRVGLOMVAS-UHFFFAOYSA-N 0 0 388.146 3.306 20 5 GGBDRN C[C@H](CO)N(CC1CCC1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000509256981 566282750 /nfs/dbraw/zinc/28/27/50/566282750.db2.gz VMIYGZPYTKFXAJ-SECBINFHSA-N 0 0 397.280 3.073 20 5 GGBDRN Cc1c(Cc2noc(-c3nn(C)cc3Br)n2)cccc1[N+](=O)[O-] ZINC000556308619 566283684 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CSc1cccc(C(=O)N2C[C@H](C(F)(F)F)OC(C)(C)C2)c1[N+](=O)[O-] ZINC000575824139 566288361 /nfs/dbraw/zinc/28/83/61/566288361.db2.gz GPEQBIHINUQLQX-LLVKDONJSA-N 0 0 378.372 3.499 20 5 GGBDRN CCCN(CC(C)C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000575821349 566288469 /nfs/dbraw/zinc/28/84/69/566288469.db2.gz XBMOOZDITVODDS-UHFFFAOYSA-N 0 0 386.246 3.190 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CC[C@H](C2CCOCC2)C1 ZINC000599713071 566289732 /nfs/dbraw/zinc/28/97/32/566289732.db2.gz GJXTVHNVHHVNJY-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN NC(=O)c1cccc([N+](=O)[O-])c1N1CCC[C@H]1c1ccc(Br)cn1 ZINC000420626102 566289677 /nfs/dbraw/zinc/28/96/77/566289677.db2.gz JLEGZJUCCJOUQR-ZDUSSCGKSA-N 0 0 391.225 3.193 20 5 GGBDRN CC(C)OCCCN(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462354142 566289728 /nfs/dbraw/zinc/28/97/28/566289728.db2.gz LXCAPSRUIQNNFR-UHFFFAOYSA-N 0 0 385.269 3.337 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(Br)cc2F)no1 ZINC000445443954 566289826 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CC1=C(C)CN(C(=O)c2ccc([N+](=O)[O-])cc2I)CC1 ZINC000482869205 566339335 /nfs/dbraw/zinc/33/93/35/566339335.db2.gz BWKVNMKUCIILBJ-UHFFFAOYSA-N 0 0 386.189 3.382 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@H]3C[C@@H](O)C3)cc2[N+](=O)[O-])n1 ZINC000600506624 566341995 /nfs/dbraw/zinc/34/19/95/566341995.db2.gz WWFJQZVPJKUVRZ-KLPPZKSPSA-N 0 0 379.463 3.012 20 5 GGBDRN Cc1c(C(=O)N2CC(=O)Nc3ccc(Br)cc32)cccc1[N+](=O)[O-] ZINC000535961885 566342110 /nfs/dbraw/zinc/34/21/10/566342110.db2.gz CBUCEYRISOALQG-UHFFFAOYSA-N 0 0 390.193 3.265 20 5 GGBDRN Cc1ccc(O[C@@H](C)CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000462699754 566343491 /nfs/dbraw/zinc/34/34/91/566343491.db2.gz UZENUNGCKJCYRY-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)Oc1ccccc1F ZINC000462702428 566343522 /nfs/dbraw/zinc/34/35/22/566343522.db2.gz QAIBYHQNXFPJCP-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N(C)CC(C)C ZINC000509872393 566343958 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O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)CCc1cccc(Cl)c1)CC2 ZINC000509894170 566346047 /nfs/dbraw/zinc/34/60/47/566346047.db2.gz NPUXFQAGKXVWNM-UHFFFAOYSA-N 0 0 380.853 3.179 20 5 GGBDRN CC[C@@H](C)C[C@@H](C)NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000462714383 566346392 /nfs/dbraw/zinc/34/63/92/566346392.db2.gz FNAOMONLGQAWHO-NXEZZACHSA-N 0 0 379.276 3.460 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCNS(=O)(=O)c1cccc(Cl)c1Cl ZINC000462712179 566346466 /nfs/dbraw/zinc/34/64/66/566346466.db2.gz VEHBZMQHBZJVCE-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H](C)Oc1cccc(Cl)c1 ZINC000462712250 566346694 /nfs/dbraw/zinc/34/66/94/566346694.db2.gz WDEXPUSCJXVVOF-NSHDSACASA-N 0 0 384.841 3.302 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N(CCO)Cc1ccc(Br)s1 ZINC000482972209 566347374 /nfs/dbraw/zinc/34/73/74/566347374.db2.gz AEUZSSCOBDHAOA-UHFFFAOYSA-N 0 0 391.268 3.115 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](C)Oc1ccccc1Cl ZINC000462721931 566347566 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GGBDRN COc1cc(S(=O)(=O)NCc2cc(Cl)sc2Cl)ccc1[N+](=O)[O-] ZINC000536137337 566353995 /nfs/dbraw/zinc/35/39/95/566353995.db2.gz SKIKURMYFKQQCO-UHFFFAOYSA-N 0 0 397.261 3.450 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1csc(-c2ccoc2)n1 ZINC000446573635 566355884 /nfs/dbraw/zinc/35/58/84/566355884.db2.gz BENWSMMPKHNQMD-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN COc1cnc(NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)s1 ZINC000483070175 566357268 /nfs/dbraw/zinc/35/72/68/566357268.db2.gz VXTWMKFUOYYRGR-UHFFFAOYSA-N 0 0 376.316 3.400 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)NCC1(c2ccc(Br)s2)CCC1 ZINC000557070174 566359428 /nfs/dbraw/zinc/35/94/28/566359428.db2.gz KCPHGICZNGAKLF-UHFFFAOYSA-N 0 0 399.270 3.004 20 5 GGBDRN O=C(Nc1nccn1Cc1ccc(Br)cc1)c1ccc([N+](=O)[O-])[nH]1 ZINC000446675051 566360449 /nfs/dbraw/zinc/36/04/49/566360449.db2.gz FJADKQAQIVLKCA-UHFFFAOYSA-N 0 0 390.197 3.183 20 5 GGBDRN C[C@H](Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-])c1cnn(C)c1 ZINC000462865403 566361679 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3.418 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1cc(F)c(F)cc1Br ZINC000557141850 566367603 /nfs/dbraw/zinc/36/76/03/566367603.db2.gz AXVMCSZVWKPHRT-UHFFFAOYSA-N 0 0 385.164 3.494 20 5 GGBDRN COc1ccc(Cl)cc1N(C)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000510160947 566367736 /nfs/dbraw/zinc/36/77/36/566367736.db2.gz CHQRODLQNOIPPH-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000483255920 566367952 /nfs/dbraw/zinc/36/79/52/566367952.db2.gz LMSCLVNGZYEPAJ-SECBINFHSA-N 0 0 396.216 3.440 20 5 GGBDRN CNc1c(C(=O)NCc2ccc(Br)c(F)c2)cccc1[N+](=O)[O-] ZINC000462932783 566368613 /nfs/dbraw/zinc/36/86/13/566368613.db2.gz NBPPPWOZPHUIBS-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN Cc1[nH]nc2ncc(NC(=O)c3ccc(Br)cc3[N+](=O)[O-])cc12 ZINC000536424858 566371541 /nfs/dbraw/zinc/37/15/41/566371541.db2.gz WZPISSNIJZDJQS-UHFFFAOYSA-N 0 0 376.170 3.189 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC1(C(F)(F)F)CCCCC1 ZINC000510224871 566371602 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GGBDRN CC(=O)N[C@@H]1CC[C@@H](C(F)(F)F)N(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000514825845 566671564 /nfs/dbraw/zinc/67/15/64/566671564.db2.gz OWSYOCQDKSGCDB-YGRLFVJLSA-N 0 0 379.766 3.280 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2cccc3cc(Br)cnc32)c1[N+](=O)[O-] ZINC000561048032 566671670 /nfs/dbraw/zinc/67/16/70/566671670.db2.gz GNOFCFXTOPJTTP-UHFFFAOYSA-N 0 0 376.170 3.189 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1 ZINC000450484346 566676423 /nfs/dbraw/zinc/67/64/23/566676423.db2.gz LCFXEYOOFZZEKK-CQSZACIVSA-N 0 0 381.479 3.122 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(OC)cc2Br)c1 ZINC000514886878 566676626 /nfs/dbraw/zinc/67/66/26/566676626.db2.gz HJMPFQFFOYUGJC-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCOc2ncc(Br)cc21 ZINC000514890081 566677185 /nfs/dbraw/zinc/67/71/85/566677185.db2.gz FFMBXTMXYJSAJW-UHFFFAOYSA-N 0 0 392.209 3.111 20 5 GGBDRN COC[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1C)c1cccc(Cl)c1 ZINC000580250430 566677632 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O=C(NCCCOCC(F)(F)F)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540908963 566681872 /nfs/dbraw/zinc/68/18/72/566681872.db2.gz LLRWHYWOSNUNAW-UHFFFAOYSA-N 0 0 383.754 3.059 20 5 GGBDRN O=C(NCCc1nc2cc(Cl)ccc2s1)Nc1ccncc1[N+](=O)[O-] ZINC000540978407 566685091 /nfs/dbraw/zinc/68/50/91/566685091.db2.gz XBHFSDIXGRYSMO-UHFFFAOYSA-N 0 0 377.813 3.039 20 5 GGBDRN Cc1cccc(S(=O)(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c1F ZINC000540986581 566685109 /nfs/dbraw/zinc/68/51/09/566685109.db2.gz VRRXKQQCNPWODH-INIZCTEOSA-N 0 0 382.438 3.479 20 5 GGBDRN CS(=O)(=O)CC1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000450576893 566686007 /nfs/dbraw/zinc/68/60/07/566686007.db2.gz BTZMDMJIUHDFQW-UHFFFAOYSA-N 0 0 378.397 3.212 20 5 GGBDRN COc1cc(C(=O)N2CCOc3ccc(Br)cc32)ccc1[N+](=O)[O-] ZINC000468205243 566688634 /nfs/dbraw/zinc/68/86/34/566688634.db2.gz GUGXTLAYHHORSI-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000468205739 566688650 /nfs/dbraw/zinc/68/86/50/566688650.db2.gz QXZOGJWFAPEJPO-UHFFFAOYSA-N 0 0 391.225 3.449 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](COC(F)F)C1 ZINC000561300912 566691981 /nfs/dbraw/zinc/69/19/81/566691981.db2.gz GTZHMGUSETZHNJ-QMMMGPOBSA-N 0 0 379.157 3.059 20 5 GGBDRN Cc1c(Br)c(N2CC(C)(C)[C@H]2c2nccn2C)ncc1[N+](=O)[O-] ZINC000450649025 566694595 /nfs/dbraw/zinc/69/45/95/566694595.db2.gz PNQFPEPHBFFZHQ-GFCCVEGCSA-N 0 0 380.246 3.382 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2ccnc(C(F)(F)F)c2)s1 ZINC000450664678 566695829 /nfs/dbraw/zinc/69/58/29/566695829.db2.gz VEXLOHYYTPODJL-UHFFFAOYSA-N 0 0 381.357 3.086 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC[C@@H]1CCN(S(=O)(=O)c2cccs2)C1 ZINC000561331945 566696064 /nfs/dbraw/zinc/69/60/64/566696064.db2.gz CKLUMELXQIZORE-ZDUSSCGKSA-N 0 0 381.479 3.087 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cc(C)ccc1Cl ZINC000468346144 566696763 /nfs/dbraw/zinc/69/67/63/566696763.db2.gz MZLKUFXRRGCTNN-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN C[C@H]1COc2ccccc2CN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000541123017 566697885 /nfs/dbraw/zinc/69/78/85/566697885.db2.gz NHINUVQLFKSCMM-NSHDSACASA-N 0 0 382.825 3.220 20 5 GGBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000515208908 566697986 /nfs/dbraw/zinc/69/79/86/566697986.db2.gz WAJPHOOGGHXWTM-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN C[C@@H]1COc2ccccc2CN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000541123015 566698101 /nfs/dbraw/zinc/69/81/01/566698101.db2.gz NHINUVQLFKSCMM-LLVKDONJSA-N 0 0 382.825 3.220 20 5 GGBDRN O=C(N1CCCC1)N1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000561359093 566698204 /nfs/dbraw/zinc/69/82/04/566698204.db2.gz SMTJKCOGKLWKBZ-LBPRGKRZSA-N 0 0 397.273 3.449 20 5 GGBDRN CCOC(=O)C1CCC(Sc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC1 ZINC000450694824 566698591 /nfs/dbraw/zinc/69/85/91/566698591.db2.gz HQWOHZHYMIZTTO-UHFFFAOYSA-N 0 0 387.479 3.212 20 5 GGBDRN Cc1ccoc1CNC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000561403824 566702491 /nfs/dbraw/zinc/70/24/91/566702491.db2.gz MSIZCWMFLWLYLR-UHFFFAOYSA-N 0 0 386.145 3.031 20 5 GGBDRN CC(C)C[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000541190502 566702986 /nfs/dbraw/zinc/70/29/86/566702986.db2.gz SFTIPBMUGBGFED-JTQLQIEISA-N 0 0 392.499 3.228 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2cc(Cl)ccc2F)cc1[N+](=O)[O-] ZINC000468475332 566704312 /nfs/dbraw/zinc/70/43/12/566704312.db2.gz NRZAFMMAGUZNSG-UHFFFAOYSA-N 0 0 387.820 3.250 20 5 GGBDRN C[N@@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000468476746 566704404 /nfs/dbraw/zinc/70/44/04/566704404.db2.gz XAKIPQFPJRUGNV-CQSZACIVSA-N 0 0 384.274 3.208 20 5 GGBDRN O=C(CCC(F)(F)F)N1CCC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000561436294 566704503 /nfs/dbraw/zinc/70/45/03/566704503.db2.gz ZDKSUNIGOPECBX-SNVBAGLBSA-N 0 0 380.754 3.389 20 5 GGBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@@H](c3ccncc3)C2)c(Br)c1 ZINC000450788782 566706128 /nfs/dbraw/zinc/70/61/28/566706128.db2.gz FMKYHPQKPYERCE-BXUZGUMPSA-N 0 0 379.214 3.480 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000450785865 566706302 /nfs/dbraw/zinc/70/63/02/566706302.db2.gz BDYMMCLOEZOCNM-TZMCWYRMSA-N 0 0 379.214 3.480 20 5 GGBDRN Cc1cc(Br)cnc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000561448557 566706466 /nfs/dbraw/zinc/70/64/66/566706466.db2.gz ASVWPWBATWSXCF-UHFFFAOYSA-N 0 0 380.154 3.042 20 5 GGBDRN Cc1cc(NCC2(S(C)(=O)=O)CCCC2)c(Br)cc1[N+](=O)[O-] ZINC000561443725 566706621 /nfs/dbraw/zinc/70/66/21/566706621.db2.gz GKZGKWNFDFENMM-UHFFFAOYSA-N 0 0 391.287 3.435 20 5 GGBDRN COC(=O)c1ccc(OCC(=O)c2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000515354452 566706633 /nfs/dbraw/zinc/70/66/33/566706633.db2.gz RYUJSGJUJVFQKX-UHFFFAOYSA-N 0 0 394.177 3.406 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)C[C@@H]2CCCCC2(F)F)cc1[N+](=O)[O-] ZINC000450806334 566707084 /nfs/dbraw/zinc/70/70/84/566707084.db2.gz QJBZPJGIBLPGAC-NSHDSACASA-N 0 0 377.413 3.083 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC[C@@]2(CCS(=O)(=O)C2)C1 ZINC000450814538 566708564 /nfs/dbraw/zinc/70/85/64/566708564.db2.gz VXYLLJZVBLDDRL-CQSZACIVSA-N 0 0 379.265 3.307 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[C@@H](Nc2cccc(Br)c2)C1 ZINC000468551736 566708803 /nfs/dbraw/zinc/70/88/03/566708803.db2.gz DVQAEDKBCBUZMQ-CYBMUJFWSA-N 0 0 393.241 3.402 20 5 GGBDRN Cc1cc(OC[C@@H](O)COc2ccccc2[N+](=O)[O-])ccc1Br ZINC000541261109 566709256 /nfs/dbraw/zinc/70/92/56/566709256.db2.gz JVCUYIZHJZZXLX-GFCCVEGCSA-N 0 0 382.210 3.484 20 5 GGBDRN Cn1nccc1[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000450837625 566710235 /nfs/dbraw/zinc/71/02/35/566710235.db2.gz CQTNMDABGIXFLW-BMIGLBTASA-N 0 0 381.230 3.423 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[C@H](Nc2cccc(Br)c2)C1 ZINC000468568175 566710230 /nfs/dbraw/zinc/71/02/30/566710230.db2.gz BNRQQOURRBGGBI-ZDUSSCGKSA-N 0 0 393.241 3.402 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2ccn(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000541285981 566711108 /nfs/dbraw/zinc/71/11/08/566711108.db2.gz MPFZSJUDDPFCKZ-UHFFFAOYSA-N 0 0 389.209 3.061 20 5 GGBDRN C[C@@H](Cc1cnn(C)c1)Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000450832942 566711144 /nfs/dbraw/zinc/71/11/44/566711144.db2.gz JJUDXBFQSBKINE-JTQLQIEISA-N 0 0 390.241 3.104 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCO[C@H](c3ccnn3C)C2)ncc1[N+](=O)[O-] ZINC000450847543 566712025 /nfs/dbraw/zinc/71/20/25/566712025.db2.gz VJIYJPVDOFJNIY-MFKMUULPSA-N 0 0 396.245 3.126 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCO[C@@H](c3ccnn3C)C2)ncc1[N+](=O)[O-] ZINC000450847542 566712587 /nfs/dbraw/zinc/71/25/87/566712587.db2.gz VJIYJPVDOFJNIY-GXFFZTMASA-N 0 0 396.245 3.126 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCO[C@@H](c3ccnn3C)C2)ncc1[N+](=O)[O-] ZINC000450847544 566712773 /nfs/dbraw/zinc/71/27/73/566712773.db2.gz VJIYJPVDOFJNIY-ZWNOBZJWSA-N 0 0 396.245 3.126 20 5 GGBDRN CCOc1ccc(C(=O)N(C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000515449907 566712921 /nfs/dbraw/zinc/71/29/21/566712921.db2.gz CORCJUZUQRUZFW-UHFFFAOYSA-N 0 0 380.198 3.428 20 5 GGBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@@H](c3ccccn3)C2)c(Br)c1 ZINC000450863031 566714282 /nfs/dbraw/zinc/71/42/82/566714282.db2.gz PQGJVWYCFRSHID-QMTHXVAHSA-N 0 0 379.214 3.480 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)c1cccc(Cl)c1Cl ZINC000541312857 566714955 /nfs/dbraw/zinc/71/49/55/566714955.db2.gz NUAYKYFSYLVBCG-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000541323952 566716676 /nfs/dbraw/zinc/71/66/76/566716676.db2.gz IRKUXSRPXZGOHI-SNVBAGLBSA-N 0 0 391.287 3.414 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2cc(Cl)ccc2Cl)cc1[N+](=O)[O-] ZINC000515516475 566717073 /nfs/dbraw/zinc/71/70/73/566717073.db2.gz BRAKZDKXWVLHEV-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000580736718 566718427 /nfs/dbraw/zinc/71/84/27/566718427.db2.gz NAOFMEUZKFZVGX-NVXWUHKLSA-N 0 0 395.253 3.449 20 5 GGBDRN CC(C)(COc1ncccc1Br)[NH2+]Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000561541993 566718477 /nfs/dbraw/zinc/71/84/77/566718477.db2.gz BIVDVSRTYJYLTI-UHFFFAOYSA-N 0 0 396.241 3.405 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2csc3ccccc23)cc1[N+](=O)[O-] ZINC000515525348 566719085 /nfs/dbraw/zinc/71/90/85/566719085.db2.gz PADYREDYRXFJCV-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN C[C@@H]1CCC(=O)[C@H](Oc2ccc(I)cc2[N+](=O)[O-])C1 ZINC000450916145 566720488 /nfs/dbraw/zinc/72/04/88/566720488.db2.gz UXBIXXYTPJIEQF-AMIZOPFISA-N 0 0 375.162 3.336 20 5 GGBDRN CC(C)OCCOC1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000450912516 566720865 /nfs/dbraw/zinc/72/08/65/566720865.db2.gz XODFORVLRSSZSR-UHFFFAOYSA-N 0 0 388.262 3.163 20 5 GGBDRN C[C@@H](Cc1cccc(Br)c1)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000468696739 566721143 /nfs/dbraw/zinc/72/11/43/566721143.db2.gz OBBCMHMNFPCYLB-JTQLQIEISA-N 0 0 378.226 3.301 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCc3c2cccc3Br)cccc1[N+](=O)[O-] ZINC000468693427 566721504 /nfs/dbraw/zinc/72/15/04/566721504.db2.gz JHAUPOQWOXFICG-CYBMUJFWSA-N 0 0 376.210 3.357 20 5 GGBDRN C[C@@H](COCC(F)(F)F)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000541395762 566722512 /nfs/dbraw/zinc/72/25/12/566722512.db2.gz CGQVANXDBDMEIT-QMMMGPOBSA-N 0 0 386.779 3.424 20 5 GGBDRN C[C@H](COCC(F)(F)F)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000541395761 566722540 /nfs/dbraw/zinc/72/25/40/566722540.db2.gz CGQVANXDBDMEIT-MRVPVSSYSA-N 0 0 386.779 3.424 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1nc2c(cccc2Br)[nH]1 ZINC000450946866 566723482 /nfs/dbraw/zinc/72/34/82/566723482.db2.gz MPHRQFFQIQZXCV-UHFFFAOYSA-N 0 0 379.218 3.371 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1nc2c(cccc2Br)[nH]1 ZINC000450951844 566723781 /nfs/dbraw/zinc/72/37/81/566723781.db2.gz YWWHVIFDUVPJQC-UHFFFAOYSA-N 0 0 379.218 3.371 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCO[C@H](c3nccn3C)C2)ncc1[N+](=O)[O-] ZINC000450953106 566724105 /nfs/dbraw/zinc/72/41/05/566724105.db2.gz WZFQHVBFVRJKGS-JQWIXIFHSA-N 0 0 396.245 3.126 20 5 GGBDRN O=C(Nc1cccc(N2CCC2=O)c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000468734870 566724187 /nfs/dbraw/zinc/72/41/87/566724187.db2.gz PQAOJRDKGYJMRX-UHFFFAOYSA-N 0 0 390.193 3.346 20 5 GGBDRN COC(=O)[C@@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])[C@H]1C ZINC000468739304 566724467 /nfs/dbraw/zinc/72/44/67/566724467.db2.gz LBBNAIVYTATLJB-GXSJLCMTSA-N 0 0 394.225 3.293 20 5 GGBDRN COC(=O)[C@@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])[C@@H]1C ZINC000468739308 566724504 /nfs/dbraw/zinc/72/45/04/566724504.db2.gz LBBNAIVYTATLJB-MWLCHTKSSA-N 0 0 394.225 3.293 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1SCCc2ccccc21 ZINC000468730208 566724558 /nfs/dbraw/zinc/72/45/58/566724558.db2.gz VDZZOGPDHSJRAX-INIZCTEOSA-N 0 0 378.475 3.441 20 5 GGBDRN COC(=O)[C@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])[C@H]1C ZINC000468739310 566724620 /nfs/dbraw/zinc/72/46/20/566724620.db2.gz LBBNAIVYTATLJB-ONGXEEELSA-N 0 0 394.225 3.293 20 5 GGBDRN CCOc1ccc(NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1Cl ZINC000515632149 566725041 /nfs/dbraw/zinc/72/50/41/566725041.db2.gz LLEATSRDJRXHMB-UHFFFAOYSA-N 0 0 386.813 3.456 20 5 GGBDRN O=C(N[C@@H]1CCC[C@@H](F)C1)c1ccc([N+](=O)[O-])cc1I ZINC000515652179 566725095 /nfs/dbraw/zinc/72/50/95/566725095.db2.gz JPLIFXXPDXYHBZ-RKDXNWHRSA-N 0 0 392.168 3.210 20 5 GGBDRN O=C(N[C@@H]1CCC[C@H](F)C1)c1ccc([N+](=O)[O-])cc1I ZINC000515652177 566725390 /nfs/dbraw/zinc/72/53/90/566725390.db2.gz JPLIFXXPDXYHBZ-DTWKUNHWSA-N 0 0 392.168 3.210 20 5 GGBDRN CSc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)n1 ZINC000561641436 566725957 /nfs/dbraw/zinc/72/59/57/566725957.db2.gz DERILOHAGRJJCD-UHFFFAOYSA-N 0 0 382.239 3.077 20 5 GGBDRN CC[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](O)C(F)(F)F ZINC000541466996 566726083 /nfs/dbraw/zinc/72/60/83/566726083.db2.gz XQHHMDQVFPRULK-QPUJVOFHSA-N 0 0 386.779 3.158 20 5 GGBDRN CC(C)SCCNC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000561661301 566728007 /nfs/dbraw/zinc/72/80/07/566728007.db2.gz MCFBJDVNURMHKC-UHFFFAOYSA-N 0 0 394.234 3.071 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(F)ccc1Br ZINC000426780873 566728442 /nfs/dbraw/zinc/72/84/42/566728442.db2.gz VXSNNYHAQCKFNE-HNNXBMFYSA-N 0 0 397.200 3.282 20 5 GGBDRN CC(C)(NC(=O)c1c[nH]c(=O)c(Br)c1)c1ccccc1[N+](=O)[O-] ZINC000561692091 566728912 /nfs/dbraw/zinc/72/89/12/566728912.db2.gz VFBUEDZINIVDEY-UHFFFAOYSA-N 0 0 380.198 3.123 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(Br)c1 ZINC000426776958 566729626 /nfs/dbraw/zinc/72/96/26/566729626.db2.gz JEWDAJOSYFEACL-HNNXBMFYSA-N 0 0 379.210 3.143 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cccc3c2CNC3=O)cc1[N+](=O)[O-] ZINC000561685567 566729846 /nfs/dbraw/zinc/72/98/46/566729846.db2.gz JFJGWMFXAUQZHP-UHFFFAOYSA-N 0 0 390.193 3.161 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000515750572 566730316 /nfs/dbraw/zinc/73/03/16/566730316.db2.gz SGRWKDBGZWDJPY-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000515750560 566730393 /nfs/dbraw/zinc/73/03/93/566730393.db2.gz RMCPEZFRSFISIB-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1Br ZINC000426806827 566731050 /nfs/dbraw/zinc/73/10/50/566731050.db2.gz LEXMKTSCFMCABI-AWEZNQCLSA-N 0 0 379.210 3.143 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cc(Br)ccc1F ZINC000426812498 566731225 /nfs/dbraw/zinc/73/12/25/566731225.db2.gz YQWSGYSSYKPVIJ-AWEZNQCLSA-N 0 0 397.200 3.282 20 5 GGBDRN CN(CCn1cc(Br)cn1)c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000561705098 566731433 /nfs/dbraw/zinc/73/14/33/566731433.db2.gz YDFXMRJAHORGRI-UHFFFAOYSA-N 0 0 376.214 3.238 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000580907708 566732698 /nfs/dbraw/zinc/73/26/98/566732698.db2.gz TVRFADWJBRHAEN-JTQLQIEISA-N 0 0 398.257 3.381 20 5 GGBDRN O=C(Nc1nc2ccsc2s1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000488528372 566733480 /nfs/dbraw/zinc/73/34/80/566733480.db2.gz AUBYNFZJZINEIZ-UHFFFAOYSA-N 0 0 378.439 3.332 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(c1ccc(Br)cn1)C(C)C ZINC000488581536 566734671 /nfs/dbraw/zinc/73/46/71/566734671.db2.gz MBCWWVGMWKGXQM-UHFFFAOYSA-N 0 0 396.245 3.089 20 5 GGBDRN COCCOc1ccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000541576357 566734571 /nfs/dbraw/zinc/73/45/71/566734571.db2.gz GWBYAEPMDQDKMM-UHFFFAOYSA-N 0 0 396.241 3.120 20 5 GGBDRN Cc1c(Br)c(NCCOc2ncccc2Cl)ncc1[N+](=O)[O-] ZINC000541578298 566734707 /nfs/dbraw/zinc/73/47/07/566734707.db2.gz LWYNMQVDFBBBQV-UHFFFAOYSA-N 0 0 387.621 3.022 20 5 GGBDRN Cc1c(Br)c(NC[C@H]2CCN(c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000541590735 566735878 /nfs/dbraw/zinc/73/58/78/566735878.db2.gz MGDJWZLRSNNRMD-CYBMUJFWSA-N 0 0 391.269 3.421 20 5 GGBDRN CN(Cc1cc(Br)ccc1F)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000608803448 566736123 /nfs/dbraw/zinc/73/61/23/566736123.db2.gz FQVPFWUDISIXGZ-UHFFFAOYSA-N 0 0 399.220 3.087 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCc1csc(C(C)C)n1 ZINC000608835345 566737243 /nfs/dbraw/zinc/73/72/43/566737243.db2.gz UQOKYAXXUGTUQT-UHFFFAOYSA-N 0 0 383.495 3.258 20 5 GGBDRN COc1ccccc1C(C)(C)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000488646918 566738271 /nfs/dbraw/zinc/73/82/71/566738271.db2.gz QRKDVTQQXGCOEQ-UHFFFAOYSA-N 0 0 384.841 3.470 20 5 GGBDRN COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000608900082 566741916 /nfs/dbraw/zinc/74/19/16/566741916.db2.gz ILJVRLNDOWKGCM-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN NS(=O)(=O)c1cc(NCc2cccc(Cl)c2Cl)cc([N+](=O)[O-])c1 ZINC000561808151 566741898 /nfs/dbraw/zinc/74/18/98/566741898.db2.gz OHGQUGWXTJBOAO-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](CO)c1ccc(Br)c(F)c1 ZINC000488718320 566742276 /nfs/dbraw/zinc/74/22/76/566742276.db2.gz VHUUINGKYUJCNU-LBPRGKRZSA-N 0 0 387.209 3.167 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@H](C)Sc3ccccc32)cc1[N+](=O)[O-] ZINC000468914621 566742296 /nfs/dbraw/zinc/74/22/96/566742296.db2.gz LCTAIFYNXHSZAL-NSHDSACASA-N 0 0 380.447 3.293 20 5 GGBDRN NS(=O)(=O)c1c(NCC2(c3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000608975072 566744430 /nfs/dbraw/zinc/74/44/30/566744430.db2.gz YGSCZBZQGCYOIH-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN Cn1c(C(=O)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000608966508 566744480 /nfs/dbraw/zinc/74/44/80/566744480.db2.gz OROGLJQJZOQSCR-CQSZACIVSA-N 0 0 384.219 3.454 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(OC)cc2Br)c1 ZINC000561866007 566744522 /nfs/dbraw/zinc/74/45/22/566744522.db2.gz JISJDOIWEHOJEP-UHFFFAOYSA-N 0 0 396.197 3.412 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H]2CCC[C@@H](CO)C2)cc1[N+](=O)[O-] ZINC000516108825 566745192 /nfs/dbraw/zinc/74/51/92/566745192.db2.gz OJLIAGLQKKGWPP-NWDGAFQWSA-N 0 0 385.258 3.194 20 5 GGBDRN O=C(NC[C@H]1CCCSC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000516103604 566745295 /nfs/dbraw/zinc/74/52/95/566745295.db2.gz WIONLULMZSACEP-SNVBAGLBSA-N 0 0 378.372 3.409 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(F)(F)F)[C@@H]1CCOC1 ZINC000468935102 566745954 /nfs/dbraw/zinc/74/59/54/566745954.db2.gz IMWSKYQEZLVSQE-ZYHUDNBSSA-N 0 0 378.372 3.255 20 5 GGBDRN CCOc1ccccc1CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000609019199 566746078 /nfs/dbraw/zinc/74/60/78/566746078.db2.gz LVLUBVASTHTTGO-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CC[C@@H](Sc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000561883505 566746175 /nfs/dbraw/zinc/74/61/75/566746175.db2.gz GLUUMBIAWWVIFD-CYBMUJFWSA-N 0 0 380.857 3.297 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000609030136 566746537 /nfs/dbraw/zinc/74/65/37/566746537.db2.gz IHRHVCRGZMVLGT-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN C[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000488797181 566747798 /nfs/dbraw/zinc/74/77/98/566747798.db2.gz RFIWZUWEIRGAMT-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H](CO)c1ccc(Br)cc1 ZINC000541783866 566747973 /nfs/dbraw/zinc/74/79/73/566747973.db2.gz SEHUUDQUTIVGLO-AWEZNQCLSA-N 0 0 398.188 3.352 20 5 GGBDRN CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000609030159 566748056 /nfs/dbraw/zinc/74/80/56/566748056.db2.gz JKPCMISDJHRTDC-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN C[C@H](N(C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])C(C)(C)C ZINC000609134058 566751278 /nfs/dbraw/zinc/75/12/78/566751278.db2.gz QWSBKHDNGWMSHJ-VIFPVBQESA-N 0 0 379.276 3.412 20 5 GGBDRN C[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488850005 566752668 /nfs/dbraw/zinc/75/26/68/566752668.db2.gz FDVYLGHPXRMIMF-GXSJLCMTSA-N 0 0 377.260 3.214 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(COc2ccc(CCO)cc2)c1 ZINC000581160899 566754345 /nfs/dbraw/zinc/75/43/45/566754345.db2.gz SDBCTHBRKQLJNW-UHFFFAOYSA-N 0 0 399.184 3.313 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)Sc2ccccc21 ZINC000469050715 566755761 /nfs/dbraw/zinc/75/57/61/566755761.db2.gz TVOJJQDFLGABNN-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN CC[C@@H]1CN(C)CCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000562002623 566755983 /nfs/dbraw/zinc/75/59/83/566755983.db2.gz IHYGRXCDHHHHKX-LLVKDONJSA-N 0 0 396.296 3.006 20 5 GGBDRN Cc1nnc(CNc2c3cc(Br)ccc3ncc2[N+](=O)[O-])s1 ZINC000541868950 566755837 /nfs/dbraw/zinc/75/58/37/566755837.db2.gz HWWFUBFXQBZRLZ-UHFFFAOYSA-N 0 0 380.227 3.099 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000541854792 566756128 /nfs/dbraw/zinc/75/61/28/566756128.db2.gz JWHUBNRMWREBDM-YPMHNXCESA-N 0 0 376.210 3.225 20 5 GGBDRN CNc1nccc(C(=O)NC2(c3c(Cl)cccc3Cl)CC2)c1[N+](=O)[O-] ZINC000516313113 566758221 /nfs/dbraw/zinc/75/82/21/566758221.db2.gz KHVDQNLKPOCHAF-UHFFFAOYSA-N 0 0 381.219 3.179 20 5 GGBDRN CC[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000488937852 566758413 /nfs/dbraw/zinc/75/84/13/566758413.db2.gz JOESBEASZQIHQF-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N[C@@H]1CCc2ccccc21 ZINC000488964903 566759972 /nfs/dbraw/zinc/75/99/72/566759972.db2.gz BEWHCIBIPZIKKP-CYBMUJFWSA-N 0 0 397.250 3.323 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCc3cocn3)cc2[N+](=O)[O-])n1 ZINC000609343904 566760493 /nfs/dbraw/zinc/76/04/93/566760493.db2.gz RPICOWOQUIKGDG-UHFFFAOYSA-N 0 0 376.419 3.429 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(Cl)cc1OC ZINC000609353527 566761065 /nfs/dbraw/zinc/76/10/65/566761065.db2.gz UHGIAAXENVOOGE-UHFFFAOYSA-N 0 0 384.841 3.298 20 5 GGBDRN NS(=O)(=O)c1cc(NCc2nc3cc(Cl)ccc3s2)cc([N+](=O)[O-])c1 ZINC000516398221 566761222 /nfs/dbraw/zinc/76/12/22/566761222.db2.gz NENPRUVNWVRUMM-UHFFFAOYSA-N 0 0 398.853 3.117 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(F)c(Cl)c1 ZINC000609391816 566763396 /nfs/dbraw/zinc/76/33/96/566763396.db2.gz ZKAGLIROKIEOJM-UHFFFAOYSA-N 0 0 386.166 3.409 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCCc2cccc(Br)c2)cc1 ZINC000609419734 566763676 /nfs/dbraw/zinc/76/36/76/566763676.db2.gz NWHNTWCJRSCRHA-UHFFFAOYSA-N 0 0 399.266 3.268 20 5 GGBDRN Cc1cccc(CN(C)S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000609418343 566763679 /nfs/dbraw/zinc/76/36/79/566763679.db2.gz AKCSXCVLFOUYPB-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)[C@@H]1C1CC1 ZINC000581280541 566763972 /nfs/dbraw/zinc/76/39/72/566763972.db2.gz DZUXHDPDTAEICS-CYBMUJFWSA-N 0 0 378.372 3.423 20 5 GGBDRN C[C@@H](Cc1ccc(Br)cc1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000516493926 566764607 /nfs/dbraw/zinc/76/46/07/566764607.db2.gz KKNMIEGTJGVNPA-VIFPVBQESA-N 0 0 396.216 3.440 20 5 GGBDRN O=C(N[C@H](CCO)c1ccccc1Br)c1cc(F)cc([N+](=O)[O-])c1 ZINC000541979242 566764507 /nfs/dbraw/zinc/76/45/07/566764507.db2.gz CZBSEHBPRDNOAL-OAHLLOKOSA-N 0 0 397.200 3.350 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC(n2cc(Br)cn2)CC1 ZINC000609464340 566764857 /nfs/dbraw/zinc/76/48/57/566764857.db2.gz WZZLPJPBCPZLKY-UHFFFAOYSA-N 0 0 395.257 3.400 20 5 GGBDRN CCc1n[nH]c(C(=O)NCCCc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000609478990 566765102 /nfs/dbraw/zinc/76/51/02/566765102.db2.gz CGTJKBXUPLSGLP-UHFFFAOYSA-N 0 0 381.230 3.005 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cc(F)cc(Br)c1 ZINC000609455009 566765191 /nfs/dbraw/zinc/76/51/91/566765191.db2.gz OPKUESXRESVBME-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN CS(=O)(=O)Nc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1Cl ZINC000609441382 566765462 /nfs/dbraw/zinc/76/54/62/566765462.db2.gz JYLVJFQXTPCECV-UHFFFAOYSA-N 0 0 387.776 3.011 20 5 GGBDRN Cn1nccc1N1CCC[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000581289496 566766053 /nfs/dbraw/zinc/76/60/53/566766053.db2.gz MOHVWXCBBYLYAO-LBPRGKRZSA-N 0 0 380.246 3.172 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2Br)C1)c1cccc([N+](=O)[O-])c1 ZINC000609508984 566768199 /nfs/dbraw/zinc/76/81/99/566768199.db2.gz CFIRLDJZOOWBBG-CYBMUJFWSA-N 0 0 390.237 3.366 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CCC(c2ncc[nH]2)CC1 ZINC000609560690 566769783 /nfs/dbraw/zinc/76/97/83/566769783.db2.gz QKYSUJFQRKSVAY-UHFFFAOYSA-N 0 0 398.204 3.307 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N(CCO)Cc1cccc(Br)c1 ZINC000489101647 566769825 /nfs/dbraw/zinc/76/98/25/566769825.db2.gz KYWTVLZZHDOCIC-UHFFFAOYSA-N 0 0 397.200 3.131 20 5 GGBDRN COc1ccc(NC(=O)NCc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000542029712 566770843 /nfs/dbraw/zinc/77/08/43/566770843.db2.gz AIBNYSKYVXKIAB-UHFFFAOYSA-N 0 0 376.316 3.400 20 5 GGBDRN O=C(Nc1cccc2[nH]c(=O)oc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000562226125 566771489 /nfs/dbraw/zinc/77/14/89/566771489.db2.gz ZTSDKIMCRHTHLN-UHFFFAOYSA-N 0 0 378.138 3.456 20 5 GGBDRN COc1ccc(CC(=O)N2CCc3ccc(Br)cc32)cc1[N+](=O)[O-] ZINC000609570093 566771603 /nfs/dbraw/zinc/77/16/03/566771603.db2.gz SVAYKZXDYIUDNO-UHFFFAOYSA-N 0 0 391.221 3.498 20 5 GGBDRN C[C@H](CCc1ccc(Br)cc1)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000516632475 566774364 /nfs/dbraw/zinc/77/43/64/566774364.db2.gz NBBUYBGTBDCWNG-LLVKDONJSA-N 0 0 380.242 3.447 20 5 GGBDRN CC(C)C(=O)Nc1ccc(Oc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000542117431 566775184 /nfs/dbraw/zinc/77/51/84/566775184.db2.gz BMFPXWPKCUFBHM-UHFFFAOYSA-N 0 0 384.435 3.447 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2ccc(OCC(F)F)cc2)s1 ZINC000542121094 566775706 /nfs/dbraw/zinc/77/57/06/566775706.db2.gz HAINHTJFJPIJGU-UHFFFAOYSA-N 0 0 378.378 3.447 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1Nc1cnc(N2CCOCC2)c(Br)c1 ZINC000542138026 566776306 /nfs/dbraw/zinc/77/63/06/566776306.db2.gz OXUIAGUWRARQAD-UHFFFAOYSA-N 0 0 394.229 3.036 20 5 GGBDRN Cc1ccnc(Nc2cnc(N3CCOCC3)c(Br)c2)c1[N+](=O)[O-] ZINC000542138959 566776984 /nfs/dbraw/zinc/77/69/84/566776984.db2.gz VLNFZEUJPCHQCP-UHFFFAOYSA-N 0 0 394.229 3.036 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N(CC(F)(F)F)[C@@H]1CCOC1 ZINC000469267085 566777812 /nfs/dbraw/zinc/77/78/12/566777812.db2.gz ODGDGEOAAHRINX-SECBINFHSA-N 0 0 397.147 3.151 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N(CC(F)(F)F)[C@H]1CCOC1 ZINC000469267142 566778034 /nfs/dbraw/zinc/77/80/34/566778034.db2.gz ODGDGEOAAHRINX-VIFPVBQESA-N 0 0 397.147 3.151 20 5 GGBDRN Cc1cnc(Nc2cnc(N3CCOCC3)c(Br)c2)c([N+](=O)[O-])c1 ZINC000542147271 566778214 /nfs/dbraw/zinc/77/82/14/566778214.db2.gz QFRFAEOGGWXRPJ-UHFFFAOYSA-N 0 0 394.229 3.036 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(-c3ccc(Cl)s3)nn2C)c1[N+](=O)[O-] ZINC000489300743 566779998 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C[C@@H](O)C[C@H](CNc1c(Br)cncc1[N+](=O)[O-])c1ccccc1 ZINC000516824147 566784801 /nfs/dbraw/zinc/78/48/01/566784801.db2.gz LICIGNLIGBTXMJ-DGCLKSJQSA-N 0 0 380.242 3.141 20 5 GGBDRN C[C@@H](Cc1cccc(O)c1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000427645748 566785360 /nfs/dbraw/zinc/78/53/60/566785360.db2.gz FROGWCLMIVLLDP-JTQLQIEISA-N 0 0 379.210 3.424 20 5 GGBDRN C[C@H](Cc1cccc(O)c1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000427645749 566785621 /nfs/dbraw/zinc/78/56/21/566785621.db2.gz FROGWCLMIVLLDP-SNVBAGLBSA-N 0 0 379.210 3.424 20 5 GGBDRN C[C@@H](CCC1CC1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000469389460 566787460 /nfs/dbraw/zinc/78/74/60/566787460.db2.gz WFBVXZQQKPFYJN-VIFPVBQESA-N 0 0 377.260 3.214 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCS[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609802097 566787191 /nfs/dbraw/zinc/78/71/91/566787191.db2.gz KKKFOUJXADNGQD-KRWDZBQOSA-N 0 0 378.475 3.382 20 5 GGBDRN CCNc1ccc(C(=O)N(C)c2ncccc2Br)cc1[N+](=O)[O-] ZINC000542244667 566787473 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Cc1sc(S(=O)(=O)N[C@@H](C)[C@H]2OCCc3sccc32)cc1[N+](=O)[O-] ZINC000490624824 566873035 /nfs/dbraw/zinc/87/30/35/566873035.db2.gz BFRPKTLIRCTWBL-RMLUDKJBSA-N 0 0 388.492 3.007 20 5 GGBDRN Cc1sc(C(N)=O)cc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610886991 566873114 /nfs/dbraw/zinc/87/31/14/566873114.db2.gz IJWBPRAPDMZXHW-UHFFFAOYSA-N 0 0 383.813 3.125 20 5 GGBDRN O=C(NC[C@@H]1OCCc2ccccc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000610900175 566873120 /nfs/dbraw/zinc/87/31/20/566873120.db2.gz ZTVTVYBTYGZYIL-INIZCTEOSA-N 0 0 391.221 3.401 20 5 GGBDRN COc1ccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c(Br)c1 ZINC000610921742 566873542 /nfs/dbraw/zinc/87/35/42/566873542.db2.gz PGGSKEDZBBPXSU-UHFFFAOYSA-N 0 0 383.202 3.465 20 5 GGBDRN Cc1cc(Br)ccc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000610922846 566873871 /nfs/dbraw/zinc/87/38/71/566873871.db2.gz IKZHDQXMSUXVBE-UHFFFAOYSA-N 0 0 381.230 3.442 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H](n2ccnc2)C1 ZINC000610913015 566874055 /nfs/dbraw/zinc/87/40/55/566874055.db2.gz QJQDQUXRRPBNQJ-CYBMUJFWSA-N 0 0 379.214 3.031 20 5 GGBDRN COc1cc(CCNc2nc(C(F)(F)F)cs2)c([N+](=O)[O-])cc1OC ZINC000610908582 566874213 /nfs/dbraw/zinc/87/42/13/566874213.db2.gz FZBJFUMIXGYOIO-UHFFFAOYSA-N 0 0 377.344 3.164 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)NCc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000490653629 566874064 /nfs/dbraw/zinc/87/40/64/566874064.db2.gz FFBNHNIKAORZHC-UHFFFAOYSA-N 0 0 392.767 3.014 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@H](n2ccnc2)C1 ZINC000610913016 566874693 /nfs/dbraw/zinc/87/46/93/566874693.db2.gz QJQDQUXRRPBNQJ-ZDUSSCGKSA-N 0 0 379.214 3.031 20 5 GGBDRN O=C(N[C@@H]1CCN(c2cccc(Br)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000470459813 566875305 /nfs/dbraw/zinc/87/53/05/566875305.db2.gz RWZMRIVMJJDXEW-CQSZACIVSA-N 0 0 390.237 3.366 20 5 GGBDRN CC[C@@H](Cc1ccc(Cl)cc1)Nc1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000582574427 566876236 /nfs/dbraw/zinc/87/62/36/566876236.db2.gz GEHFYLHROBVTGI-ZDUSSCGKSA-N 0 0 383.857 3.329 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@](F)(c3cc(F)cc(F)c3)C2)s1 ZINC000563321875 566876518 /nfs/dbraw/zinc/87/65/18/566876518.db2.gz QGRXEAIHQTUPEY-CQSZACIVSA-N 0 0 392.380 3.194 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]2C2CCC2)c(Br)c1 ZINC000610958805 566876918 /nfs/dbraw/zinc/87/69/18/566876918.db2.gz JMXCQARRBQPQAQ-ZDUSSCGKSA-N 0 0 389.271 3.311 20 5 GGBDRN O=C(CCn1cc(Br)cn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610961701 566877219 /nfs/dbraw/zinc/87/72/19/566877219.db2.gz QPPTYNMZMAYTQT-UHFFFAOYSA-N 0 0 393.241 3.135 20 5 GGBDRN O=c1c(Br)cn(Cc2cscc2Br)cc1[N+](=O)[O-] ZINC000582584445 566877558 /nfs/dbraw/zinc/87/75/58/566877558.db2.gz HWRAKHIEPNGREV-UHFFFAOYSA-N 0 0 394.044 3.391 20 5 GGBDRN CC1(C)CCC[C@H]1CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000490747114 566877654 /nfs/dbraw/zinc/87/76/54/566877654.db2.gz RBPAZDQLUVHZKH-JTQLQIEISA-N 0 0 398.257 3.238 20 5 GGBDRN COc1ccc(C2(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 ZINC000518317029 566877896 /nfs/dbraw/zinc/87/78/96/566877896.db2.gz BZLKDVJLNHBTFI-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN O=C(CN1CCc2sc(Br)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000610990196 566878507 /nfs/dbraw/zinc/87/85/07/566878507.db2.gz RAEZKVOYYDOKEE-UHFFFAOYSA-N 0 0 396.266 3.416 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000610976195 566879064 /nfs/dbraw/zinc/87/90/64/566879064.db2.gz WYRUXEDOZUKJMG-UHFFFAOYSA-N 0 0 380.198 3.033 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000610976129 566879107 /nfs/dbraw/zinc/87/91/07/566879107.db2.gz QCAUMUGDLYGKRN-UHFFFAOYSA-N 0 0 380.198 3.033 20 5 GGBDRN CN(Cc1ccccc1Br)C(=O)CCNc1ncccc1[N+](=O)[O-] ZINC000518386140 566881397 /nfs/dbraw/zinc/88/13/97/566881397.db2.gz ODZWPUIUJMQDOM-UHFFFAOYSA-N 0 0 393.241 3.213 20 5 GGBDRN CCCCNC(=O)[C@H]1CCCN(c2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000543436952 566881770 /nfs/dbraw/zinc/88/17/70/566881770.db2.gz DCYUAVIOISCLIV-LBPRGKRZSA-N 0 0 399.289 3.193 20 5 GGBDRN Cc1c(Br)c(N2CCN(c3cccc(O)c3)CC2)ncc1[N+](=O)[O-] ZINC000543450048 566882279 /nfs/dbraw/zinc/88/22/79/566882279.db2.gz VPAQOESXBAVTNU-UHFFFAOYSA-N 0 0 393.241 3.093 20 5 GGBDRN Cc1c(Br)c(N(CCCO)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000543437250 566882550 /nfs/dbraw/zinc/88/25/50/566882550.db2.gz XJNGDIHJRYYFIK-UHFFFAOYSA-N 0 0 380.242 3.450 20 5 GGBDRN C[C@@H](Cc1ccc(F)c(Br)c1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000582697913 566886436 /nfs/dbraw/zinc/88/64/36/566886436.db2.gz UXBAPAFTNCSZIV-QMMMGPOBSA-N 0 0 397.204 3.033 20 5 GGBDRN CCc1ccc(C(=O)N2CCOc3ncc(Br)cc32)cc1[N+](=O)[O-] ZINC000543502468 566887232 /nfs/dbraw/zinc/88/72/32/566887232.db2.gz XZLFSPCBWLTUHQ-UHFFFAOYSA-N 0 0 392.209 3.354 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000611076071 566888273 /nfs/dbraw/zinc/88/82/73/566888273.db2.gz JAYHYLYZJQKRNF-CYBMUJFWSA-N 0 0 393.241 3.340 20 5 GGBDRN CO[C@](C)(CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000451822912 566889071 /nfs/dbraw/zinc/88/90/71/566889071.db2.gz JEDRCBWWXXBBGW-MRXNPFEDSA-N 0 0 384.841 3.088 20 5 GGBDRN Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ncc([N+](=O)[O-])c(N)n2)c(Cl)c1 ZINC000582737096 566889126 /nfs/dbraw/zinc/88/91/26/566889126.db2.gz QUOIHCYCHSPQTC-SECBINFHSA-N 0 0 381.845 3.187 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)COc2cc(F)cc(Br)c2)c1 ZINC000611113110 566891695 /nfs/dbraw/zinc/89/16/95/566891695.db2.gz MEFYJXXHOASWST-CYBMUJFWSA-N 0 0 386.173 3.315 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(N)=O)c1 ZINC000518573374 566892139 /nfs/dbraw/zinc/89/21/39/566892139.db2.gz NYRTYHRAYKFSIS-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C3CC3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000470688494 566894141 /nfs/dbraw/zinc/89/41/41/566894141.db2.gz GKVUOFFXQPXPKM-VFZGTOFNSA-N 0 0 383.242 3.305 20 5 GGBDRN CCc1ncc(S(=O)(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451857298 566895362 /nfs/dbraw/zinc/89/53/62/566895362.db2.gz UIPCESBBVWGLAM-CYBMUJFWSA-N 0 0 381.479 3.182 20 5 GGBDRN Cc1nc(C)c(S(=O)(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451852158 566895416 /nfs/dbraw/zinc/89/54/16/566895416.db2.gz NQRHXJXYJIVILV-CQSZACIVSA-N 0 0 381.479 3.236 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CCOc3ccc(Cl)cc32)c1 ZINC000543650495 566896532 /nfs/dbraw/zinc/89/65/32/566896532.db2.gz AXZZAROPIISHNQ-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(I)c1 ZINC000518639980 566897248 /nfs/dbraw/zinc/89/72/48/566897248.db2.gz CDZZRXVIUOHWGL-UHFFFAOYSA-N 0 0 397.172 3.250 20 5 GGBDRN COc1c(-c2nc(-c3ccc(Br)cn3)no2)cccc1[N+](=O)[O-] ZINC000582811620 566897103 /nfs/dbraw/zinc/89/71/03/566897103.db2.gz RCMZVHNUTCRMEJ-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000470719336 566897665 /nfs/dbraw/zinc/89/76/65/566897665.db2.gz FHOJPSFWVVVEGB-SNVBAGLBSA-N 0 0 385.207 3.227 20 5 GGBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000611184517 566898025 /nfs/dbraw/zinc/89/80/25/566898025.db2.gz QUSZVOGGHVGYFV-LBPRGKRZSA-N 0 0 384.845 3.114 20 5 GGBDRN O=C(CCn1cc(Br)cn1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000611202680 566898607 /nfs/dbraw/zinc/89/86/07/566898607.db2.gz IQRIMNNUQCAKBH-UHFFFAOYSA-N 0 0 393.241 3.135 20 5 GGBDRN O=C(NC[C@]1(O)CCSC1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611211352 566900264 /nfs/dbraw/zinc/90/02/64/566900264.db2.gz KRYNATVQOYYKRL-QGZVFWFLSA-N 0 0 382.507 3.227 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2nc3cc(Cl)ccc3s2)cc1 ZINC000518734149 566900360 /nfs/dbraw/zinc/90/03/60/566900360.db2.gz JCAGETAZYBXWRV-UHFFFAOYSA-N 0 0 383.838 3.336 20 5 GGBDRN CSC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611209690 566900752 /nfs/dbraw/zinc/90/07/52/566900752.db2.gz CTRMRZOCUJXRQJ-KRWDZBQOSA-N 0 0 384.523 3.473 20 5 GGBDRN CCOC(=O)[C@@H](C)N(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000470749772 566900771 /nfs/dbraw/zinc/90/07/71/566900771.db2.gz ROLPZLFNKAAYGB-SNVBAGLBSA-N 0 0 386.857 3.283 20 5 GGBDRN CS[C@@H](CO)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611213517 566900902 /nfs/dbraw/zinc/90/09/02/566900902.db2.gz YHDISLGAGUELOF-ZBEGNZNMSA-N 0 0 384.523 3.472 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1CN[C@H](CO)c1ccc(Br)c(F)c1 ZINC000429022444 566901261 /nfs/dbraw/zinc/90/12/61/566901261.db2.gz SEOXFSBPEKIFFF-CQSZACIVSA-N 0 0 387.180 3.459 20 5 GGBDRN CCNC(=O)CN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000611262349 566905423 /nfs/dbraw/zinc/90/54/23/566905423.db2.gz IPHWUXJXKLLERX-UHFFFAOYSA-N 0 0 396.241 3.185 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(Br)c(F)c1 ZINC000518828502 566906815 /nfs/dbraw/zinc/90/68/15/566906815.db2.gz DOTVUEXYINZYLP-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccccc3Br)o2)c1 ZINC000470838719 566907970 /nfs/dbraw/zinc/90/79/70/566907970.db2.gz BGHBKAFGFIMILD-UHFFFAOYSA-N 0 0 396.226 3.396 20 5 GGBDRN O=C(NCCc1cc(Cl)ccc1Br)Nc1ccncc1[N+](=O)[O-] ZINC000543765779 566910079 /nfs/dbraw/zinc/91/00/79/566910079.db2.gz LQLPEMWMCQJFKZ-UHFFFAOYSA-N 0 0 399.632 3.192 20 5 GGBDRN CC[C@@H]1CN(CC)CCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000451927963 566910033 /nfs/dbraw/zinc/91/00/33/566910033.db2.gz CRGAAEKAXZVVQS-LLVKDONJSA-N 0 0 396.296 3.006 20 5 GGBDRN CCS[C@H]1CCCCN(S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491590801 566910843 /nfs/dbraw/zinc/91/08/43/566910843.db2.gz DVEIHVKLWVUUDP-NSHDSACASA-N 0 0 392.474 3.039 20 5 GGBDRN COCCN(CC(=O)OC(C)(C)C)c1ccc(Br)cc1[N+](=O)[O-] ZINC000611338344 566911024 /nfs/dbraw/zinc/91/10/24/566911024.db2.gz MCCSSVJFIMMQDN-UHFFFAOYSA-N 0 0 389.246 3.152 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCOC[C@H]1C1CCC1 ZINC000518983886 566913188 /nfs/dbraw/zinc/91/31/88/566913188.db2.gz WKKUIZQGEMEFCC-HNNXBMFYSA-N 0 0 383.242 3.307 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000611343417 566913130 /nfs/dbraw/zinc/91/31/30/566913130.db2.gz GNEIYHIJBSWGFI-OLZOCXBDSA-N 0 0 388.873 3.076 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CS(=O)(=O)c3ccc(Cl)s3)n2)cc1 ZINC000611383704 566914644 /nfs/dbraw/zinc/91/46/44/566914644.db2.gz NYAVLRUJLRXFHN-UHFFFAOYSA-N 0 0 385.810 3.334 20 5 GGBDRN O=C(N[C@H](CCO)c1ccccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000543837709 566914704 /nfs/dbraw/zinc/91/47/04/566914704.db2.gz IHWPQEKHZQELCY-OAHLLOKOSA-N 0 0 379.210 3.211 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H](CCO)c1ccccc1Br ZINC000543834982 566915085 /nfs/dbraw/zinc/91/50/85/566915085.db2.gz KEHXOJKFHNGKDP-INIZCTEOSA-N 0 0 393.237 3.140 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CS(=O)(=O)c3ccc(Cl)s3)n2)c1 ZINC000611383709 566915141 /nfs/dbraw/zinc/91/51/41/566915141.db2.gz OCHJIUSSGHITEW-UHFFFAOYSA-N 0 0 385.810 3.334 20 5 GGBDRN CC(C)(NCC(=O)Nc1ccc(Br)cn1)c1ccccc1[N+](=O)[O-] ZINC000429240297 566916139 /nfs/dbraw/zinc/91/61/39/566916139.db2.gz SSWZOYKXZICAHJ-UHFFFAOYSA-N 0 0 393.241 3.216 20 5 GGBDRN CCn1cc(S(=O)(=O)N[C@H](C)c2cc(Cl)ccc2Cl)c([N+](=O)[O-])n1 ZINC000491978359 566921531 /nfs/dbraw/zinc/92/15/31/566921531.db2.gz JOLSDVHELJUHBM-MRVPVSSYSA-N 0 0 393.252 3.158 20 5 GGBDRN CCc1nn(C)c(Sc2nnc(-c3ccc(Cl)cc3)n2C)c1[N+](=O)[O-] ZINC000563834776 566921576 /nfs/dbraw/zinc/92/15/76/566921576.db2.gz HZRHRZFGNOWXJR-UHFFFAOYSA-N 0 0 378.845 3.491 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1cccc2c1OCO2 ZINC000543894503 566921863 /nfs/dbraw/zinc/92/18/63/566921863.db2.gz CCMQWMFJRSKQGM-UHFFFAOYSA-N 0 0 379.166 3.267 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1Cc2cc(Br)ccc2O1 ZINC000471034971 566923066 /nfs/dbraw/zinc/92/30/66/566923066.db2.gz WUZQUBSUBNMJJB-MRXNPFEDSA-N 0 0 391.221 3.020 20 5 GGBDRN CCOc1cc(CSc2nnnn2Cc2cccs2)ccc1[N+](=O)[O-] ZINC000492078161 566923384 /nfs/dbraw/zinc/92/33/84/566923384.db2.gz DVLUNVXQKKSXDY-UHFFFAOYSA-N 0 0 377.451 3.382 20 5 GGBDRN C[C@H](c1ccccc1)[C@H](CO)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000611508958 566923710 /nfs/dbraw/zinc/92/37/10/566923710.db2.gz VOKMTGNGJAEFPS-BZNIZROVSA-N 0 0 393.237 3.252 20 5 GGBDRN C[C@H](c1ccccc1)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000611508587 566924095 /nfs/dbraw/zinc/92/40/95/566924095.db2.gz LBIZDGLXHCOGCI-BDJLRTHQSA-N 0 0 393.237 3.252 20 5 GGBDRN C[C@@H](c1ccccc1)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000611508589 566924209 /nfs/dbraw/zinc/92/42/09/566924209.db2.gz LBIZDGLXHCOGCI-MEDUHNTESA-N 0 0 393.237 3.252 20 5 GGBDRN C[C@H]1CC[C@H](N(CCO)S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000452019178 566924335 /nfs/dbraw/zinc/92/43/35/566924335.db2.gz YPLPXFCURZQCIE-ONGXEEELSA-N 0 0 397.280 3.073 20 5 GGBDRN C[C@H]1CC[C@H](C(F)(F)F)CN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000611542571 566925409 /nfs/dbraw/zinc/92/54/09/566925409.db2.gz QQXWRMRLYHQEOB-AAEUAGOBSA-N 0 0 380.388 3.130 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)C(=O)NC2 ZINC000583158310 566925512 /nfs/dbraw/zinc/92/55/12/566925512.db2.gz KMOUGJWEPHPDKP-UHFFFAOYSA-N 0 0 390.193 3.161 20 5 GGBDRN Cc1nc(Nc2cnc(N3CCOCC3)c(Br)c2)ccc1[N+](=O)[O-] ZINC000543995528 566925947 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Cc1c(Br)cc(S(=O)(=O)N2CC3(C2)CCCC3)cc1[N+](=O)[O-] ZINC000492228394 566929472 /nfs/dbraw/zinc/92/94/72/566929472.db2.gz VMITVXLLZKGKGB-UHFFFAOYSA-N 0 0 389.271 3.230 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(F)c(Br)c1 ZINC000611599174 566930519 /nfs/dbraw/zinc/93/05/19/566930519.db2.gz AJERYXODEBRQPH-MRVPVSSYSA-N 0 0 383.177 3.196 20 5 GGBDRN O=C(NC[C@H]1COc2ccccc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000583225524 566931875 /nfs/dbraw/zinc/93/18/75/566931875.db2.gz BRIZINRMNNJKOM-NSHDSACASA-N 0 0 377.194 3.263 20 5 GGBDRN COC(=O)c1cnc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000544049769 566932906 /nfs/dbraw/zinc/93/29/06/566932906.db2.gz DNCITVORCSNPFO-UHFFFAOYSA-N 0 0 387.826 3.222 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN[C@H](CO)c3ccc(Br)cc3)nc2c1 ZINC000611682539 566933937 /nfs/dbraw/zinc/93/39/37/566933937.db2.gz WXGZKBQZPJXBGV-CQSZACIVSA-N 0 0 392.209 3.322 20 5 GGBDRN CCN(CC)C(=O)CCCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544074404 566934750 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CSc1cccc(-c2nc(C3(S(C)(=O)=O)CCCC3)no2)c1[N+](=O)[O-] ZINC000453194643 567061745 /nfs/dbraw/zinc/06/17/45/567061745.db2.gz OJWZBGBVSGOBEB-UHFFFAOYSA-N 0 0 383.451 3.181 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c(Cl)cc1F ZINC000565442812 567066716 /nfs/dbraw/zinc/06/67/16/567066716.db2.gz CEQGIDZKQFMOPR-UHFFFAOYSA-N 0 0 386.788 3.352 20 5 GGBDRN Cc1ccc2nc(COc3c(Br)cccc3[N+](=O)[O-])cc(=O)n2c1 ZINC000431220774 567067587 /nfs/dbraw/zinc/06/75/87/567067587.db2.gz RPTZNZVQMOEUII-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN NS(=O)(=O)Cc1cccc(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)c1 ZINC000613877539 567068040 /nfs/dbraw/zinc/06/80/40/567068040.db2.gz VQOAZJWQSYMDSY-UHFFFAOYSA-N 0 0 390.248 3.302 20 5 GGBDRN O=C(NCC(F)(F)F)[C@@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000584772148 567068269 /nfs/dbraw/zinc/06/82/69/567068269.db2.gz WJAYUYLZLWVAKM-SSDOTTSWSA-N 0 0 386.157 3.406 20 5 GGBDRN Cn1c(=O)c(COc2c(Br)cccc2[N+](=O)[O-])nc2ccccc21 ZINC000431247308 567068609 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O=C1Cc2ccccc2N1CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000524220931 567188756 /nfs/dbraw/zinc/18/87/56/567188756.db2.gz KVBLYKCCVQLLRU-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN COc1cc(-c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)sc1Br ZINC000547194313 567189517 /nfs/dbraw/zinc/18/95/17/567189517.db2.gz AEBFOLFELCUBAR-UHFFFAOYSA-N 0 0 397.210 3.463 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(Cc3ccc(F)c(Br)c3)n2)nc1 ZINC000547196907 567190091 /nfs/dbraw/zinc/19/00/91/567190091.db2.gz VPKXOJIAZFNTQJ-UHFFFAOYSA-N 0 0 393.172 3.456 20 5 GGBDRN C[C@H]1Cc2cc(S(=O)(=O)NCc3ccc([N+](=O)[O-])cc3)cc(Cl)c2O1 ZINC000524243810 567190716 /nfs/dbraw/zinc/19/07/16/567190716.db2.gz PGPZZIUMHMJTCF-JTQLQIEISA-N 0 0 382.825 3.050 20 5 GGBDRN CC(C)(CS(C)(=O)=O)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000547284639 567196929 /nfs/dbraw/zinc/19/69/29/567196929.db2.gz HYGWKDVFVIFVAT-UHFFFAOYSA-N 0 0 386.857 3.421 20 5 GGBDRN Cc1nc(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)sc1Br ZINC000454732959 567197430 /nfs/dbraw/zinc/19/74/30/567197430.db2.gz VVYDUNMKFNUNLQ-UHFFFAOYSA-N 0 0 399.270 3.164 20 5 GGBDRN COC(=O)[C@@H](CNc1ncc(Br)cc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000474772157 567199267 /nfs/dbraw/zinc/19/92/67/567199267.db2.gz DJJNVMGIIVBUFD-ZDUSSCGKSA-N 0 0 394.225 3.429 20 5 GGBDRN COc1cc(C)c(S(=O)(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000432864728 567199447 /nfs/dbraw/zinc/19/94/47/567199447.db2.gz MRKJTSGHLJKJSX-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CO[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1Cl ZINC000615708172 567199795 /nfs/dbraw/zinc/19/97/95/567199795.db2.gz FXFVDCPDAQJZOB-HNNXBMFYSA-N 0 0 384.841 3.451 20 5 GGBDRN COC(=O)C[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccc(SC)cc1 ZINC000524459392 567201329 /nfs/dbraw/zinc/20/13/29/567201329.db2.gz BMDKHVKGIRHVJA-ZDUSSCGKSA-N 0 0 380.447 3.412 20 5 GGBDRN COc1cc(C)c(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1Cl ZINC000432926466 567204076 /nfs/dbraw/zinc/20/40/76/567204076.db2.gz XTUKWPFERAGWNQ-UHFFFAOYSA-N 0 0 382.825 3.317 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCOC[C@H](C2CCC2)C1 ZINC000590014492 567204530 /nfs/dbraw/zinc/20/45/30/567204530.db2.gz TXKOSNVMMRJAIX-CQSZACIVSA-N 0 0 397.269 3.175 20 5 GGBDRN C[C@@](O)(C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1)C(F)(F)F ZINC000547373620 567205138 /nfs/dbraw/zinc/20/51/38/567205138.db2.gz VYQDJEUVZXJXNN-CQSZACIVSA-N 0 0 380.750 3.414 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NC[C@@]2(O)CCSC2)cc1[N+](=O)[O-] ZINC000474883775 567206912 /nfs/dbraw/zinc/20/69/12/567206912.db2.gz XQVJZJYOHJMPDB-KRWDZBQOSA-N 0 0 384.523 3.331 20 5 GGBDRN Cc1nc(CNC(=O)NCc2cccc([N+](=O)[O-])c2C)sc1Br ZINC000454852112 567207751 /nfs/dbraw/zinc/20/77/51/567207751.db2.gz ISAKDUHGMSBIRD-UHFFFAOYSA-N 0 0 399.270 3.430 20 5 GGBDRN Cc1nc2ccc(Br)cn2c1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000474909037 567208647 /nfs/dbraw/zinc/20/86/47/567208647.db2.gz CZNSTBZWBWCRIQ-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1-c1nc(Cc2cc(Br)ccc2F)no1 ZINC000567005303 567209857 /nfs/dbraw/zinc/20/98/57/567209857.db2.gz WSWWOJFFNIBHSU-UHFFFAOYSA-N 0 0 381.161 3.476 20 5 GGBDRN O=C1NCCN(Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccc(Br)c1 ZINC000498906123 567210049 /nfs/dbraw/zinc/21/00/49/567210049.db2.gz UFYQLXWTHHNELI-INIZCTEOSA-N 0 0 390.237 3.030 20 5 GGBDRN COC(=O)c1ccc(Br)c(C)c1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000524769400 567213702 /nfs/dbraw/zinc/21/37/02/567213702.db2.gz XBILJPCDHGHQHL-UHFFFAOYSA-N 0 0 396.197 3.043 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(Br)c1 ZINC000498923627 567213987 /nfs/dbraw/zinc/21/39/87/567213987.db2.gz QKFHNWQSKCQONL-INIZCTEOSA-N 0 0 390.237 3.030 20 5 GGBDRN O=C(NCCn1cnc2ccccc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000433001575 567215787 /nfs/dbraw/zinc/21/57/87/567215787.db2.gz SQIMSDBAFDUYRS-UHFFFAOYSA-N 0 0 389.209 3.137 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccnn1C ZINC000615954961 567216258 /nfs/dbraw/zinc/21/62/58/567216258.db2.gz TWRPOZXEANTEGX-CQSZACIVSA-N 0 0 395.257 3.260 20 5 GGBDRN Cc1c(Br)c(NC[C@@H](c2ccnn2C)C(C)C)ncc1[N+](=O)[O-] ZINC000615944114 567216265 /nfs/dbraw/zinc/21/62/65/567216265.db2.gz PHSAXZDMRHPITB-LLVKDONJSA-N 0 0 382.262 3.068 20 5 GGBDRN C[C@@H](CCNS(=O)(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000567093790 567216375 /nfs/dbraw/zinc/21/63/75/567216375.db2.gz FHKPQLYFBGWEBV-LBPRGKRZSA-N 0 0 383.857 3.417 20 5 GGBDRN CN(Cc1ccc(S(C)(=O)=O)cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000524849897 567216596 /nfs/dbraw/zinc/21/65/96/567216596.db2.gz FMMRINHVHLLNPM-UHFFFAOYSA-N 0 0 399.266 3.397 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@H]1CC(=O)c2ccccc21 ZINC000499016437 567219958 /nfs/dbraw/zinc/21/99/58/567219958.db2.gz LDFUPVHNDSTJMM-HNNXBMFYSA-N 0 0 389.205 3.344 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@@H]1CC(=O)c2ccccc21 ZINC000499016445 567219980 /nfs/dbraw/zinc/21/99/80/567219980.db2.gz LDFUPVHNDSTJMM-OAHLLOKOSA-N 0 0 389.205 3.344 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccnn1C ZINC000616014423 567222325 /nfs/dbraw/zinc/22/23/25/567222325.db2.gz GPBOCUJCCLQGMK-CYBMUJFWSA-N 0 0 395.257 3.260 20 5 GGBDRN Cn1c(C(=O)NCC2(c3ccccc3Br)CC2)ccc1[N+](=O)[O-] ZINC000524950947 567222911 /nfs/dbraw/zinc/22/29/11/567222911.db2.gz GEKCXEGOKYTXLZ-UHFFFAOYSA-N 0 0 378.226 3.157 20 5 GGBDRN Cc1cc(NCc2nnnn2-c2ccccc2)c(Br)cc1[N+](=O)[O-] ZINC000616059381 567224213 /nfs/dbraw/zinc/22/42/13/567224213.db2.gz LTGMGVBDNVKGIH-UHFFFAOYSA-N 0 0 389.213 3.254 20 5 GGBDRN COc1cccc(OC(F)(F)F)c1CNC(=O)c1csc([N+](=O)[O-])c1 ZINC000567187115 567225003 /nfs/dbraw/zinc/22/50/03/567225003.db2.gz VYLTYZJISLDJSQ-UHFFFAOYSA-N 0 0 376.312 3.494 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@](O)(C(F)(F)F)C1 ZINC000590425004 567225152 /nfs/dbraw/zinc/22/51/52/567225152.db2.gz CTSZWDMRGIVEHD-LKFCYVNXSA-N 0 0 378.372 3.283 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[C@](O)(C(F)(F)F)C1 ZINC000590432518 567225503 /nfs/dbraw/zinc/22/55/03/567225503.db2.gz QUQDAQORUWMWRO-TVQRCGJNSA-N 0 0 398.790 3.302 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000455045920 567227177 /nfs/dbraw/zinc/22/71/77/567227177.db2.gz SIXFKAFFBBWOQH-ZDUSSCGKSA-N 0 0 378.841 3.464 20 5 GGBDRN O=C(NCCCc1ccc(O)cc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000433144488 567227893 /nfs/dbraw/zinc/22/78/93/567227893.db2.gz CNTTWYJRTGAIQQ-UHFFFAOYSA-N 0 0 379.210 3.426 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@@]1(CO)C[C@H]1c1ccccc1 ZINC000567215663 567228342 /nfs/dbraw/zinc/22/83/42/567228342.db2.gz ANLJKYGELNPZFS-XJKSGUPXSA-N 0 0 378.226 3.330 20 5 GGBDRN COC(=O)c1sc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)nc1C ZINC000499165348 567229200 /nfs/dbraw/zinc/22/92/00/567229200.db2.gz CSNIEGRNAHCYLQ-VIFPVBQESA-N 0 0 381.435 3.266 20 5 GGBDRN CC(C)(CNS(=O)(=O)c1cccnc1[N+](=O)[O-])c1ccc(F)cc1Cl ZINC000525174017 567230717 /nfs/dbraw/zinc/23/07/17/567230717.db2.gz KUFPJXIPOCUCEX-UHFFFAOYSA-N 0 0 387.820 3.038 20 5 GGBDRN COc1c(C(=O)NCCc2cc(Br)ccc2F)cccc1[N+](=O)[O-] ZINC000475182190 567231263 /nfs/dbraw/zinc/23/12/63/567231263.db2.gz DZUWUQQHHHNFLS-UHFFFAOYSA-N 0 0 397.200 3.478 20 5 GGBDRN O=c1[nH]c(CNc2ncc([N+](=O)[O-])cc2Br)nc2ccccc12 ZINC000590567866 567231633 /nfs/dbraw/zinc/23/16/33/567231633.db2.gz LCLBOBLROPRCAY-UHFFFAOYSA-N 0 0 376.170 3.013 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000499232519 567231823 /nfs/dbraw/zinc/23/18/23/567231823.db2.gz XZOARIMPCIZVKF-LLVKDONJSA-N 0 0 384.841 3.133 20 5 GGBDRN CN(Cc1cc(Cl)cc(Cl)c1)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000525186974 567232803 /nfs/dbraw/zinc/23/28/03/567232803.db2.gz AVRIWBVRNYZCCB-UHFFFAOYSA-N 0 0 376.221 3.117 20 5 GGBDRN Cn1cc(Br)c(CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)n1 ZINC000567278955 567233195 /nfs/dbraw/zinc/23/31/95/567233195.db2.gz POURYTAYCNONDG-GFCCVEGCSA-N 0 0 393.163 3.484 20 5 GGBDRN CC(C)c1scnc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000567280323 567233790 /nfs/dbraw/zinc/23/37/90/567233790.db2.gz DDHAPEPXBYCPLM-UHFFFAOYSA-N 0 0 382.829 3.197 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@H](C)S1 ZINC000525188081 567233904 /nfs/dbraw/zinc/23/39/04/567233904.db2.gz WVOFDXIPOYOKGA-HTQZYQBOSA-N 0 0 385.294 3.416 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCSCCOCC(F)(F)F ZINC000525212390 567235991 /nfs/dbraw/zinc/23/59/91/567235991.db2.gz KHCQVSNXRHJBPS-UHFFFAOYSA-N 0 0 380.344 3.205 20 5 GGBDRN CN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(F)c(Cl)c1 ZINC000433258804 567237180 /nfs/dbraw/zinc/23/71/80/567237180.db2.gz HSMWIKSACUOAFU-UHFFFAOYSA-N 0 0 386.832 3.293 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NCCc1ccc(Br)cc1Cl ZINC000567388529 567241090 /nfs/dbraw/zinc/24/10/90/567241090.db2.gz XQLRVLYSWDYEHP-UHFFFAOYSA-N 0 0 386.633 3.322 20 5 GGBDRN Nc1nccc(C(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)c1[N+](=O)[O-] ZINC000547727605 567241313 /nfs/dbraw/zinc/24/13/13/567241313.db2.gz GHXYTDFGTAGWGZ-UHFFFAOYSA-N 0 0 375.797 3.432 20 5 GGBDRN O=C(NCC1CCSCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000499373146 567242932 /nfs/dbraw/zinc/24/29/32/567242932.db2.gz ZITONUOESJRXKK-UHFFFAOYSA-N 0 0 378.372 3.409 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC(c2cccc(Cl)c2)C1 ZINC000590763289 567244689 /nfs/dbraw/zinc/24/46/89/567244689.db2.gz MREGDLWZRJAPPJ-UHFFFAOYSA-N 0 0 382.825 3.045 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(Nc2cnn(CCN3CCOCC3)c2)c(Cl)c1 ZINC000547788611 567246660 /nfs/dbraw/zinc/24/66/60/567246660.db2.gz WDBDEOCGHDFHOY-UHFFFAOYSA-N 0 0 386.239 3.174 20 5 GGBDRN CC[C@@](C)(NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)C(F)(F)F ZINC000547818265 567248188 /nfs/dbraw/zinc/24/81/88/567248188.db2.gz COODAJUICDFOJG-CYBMUJFWSA-N 0 0 377.344 3.152 20 5 GGBDRN NC(=O)[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000475431857 567248350 /nfs/dbraw/zinc/24/83/50/567248350.db2.gz PNPSIVLYIAFYDD-HQQUCIOCSA-N 0 0 390.237 3.187 20 5 GGBDRN CCn1ccc(CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000616482523 567249202 /nfs/dbraw/zinc/24/92/02/567249202.db2.gz BUJODMFITDFJRJ-UHFFFAOYSA-N 0 0 380.242 3.380 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1OCc1nnsc1Cl ZINC000547820959 567249184 /nfs/dbraw/zinc/24/91/84/567249184.db2.gz IBDHGBSBGDWWFZ-UHFFFAOYSA-N 0 0 397.581 3.283 20 5 GGBDRN CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)c1c([N+](=O)[O-])ncn1C ZINC000433429368 567249168 /nfs/dbraw/zinc/24/91/68/567249168.db2.gz DVVLLHXDMLLQST-UHFFFAOYSA-N 0 0 386.239 3.490 20 5 GGBDRN Cn1c(C(=O)Nc2cc(Cl)ccc2N2CCSCC2)ccc1[N+](=O)[O-] ZINC000499473453 567251512 /nfs/dbraw/zinc/25/15/12/567251512.db2.gz TYWRNEFADYOZGU-UHFFFAOYSA-N 0 0 380.857 3.392 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(F)c1Cl ZINC000499509586 567254287 /nfs/dbraw/zinc/25/42/87/567254287.db2.gz CYGBDZZUMSAERS-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN CN(CCn1cc(Br)cn1)c1nc2ccccc2cc1[N+](=O)[O-] ZINC000567540506 567255038 /nfs/dbraw/zinc/25/50/38/567255038.db2.gz SWMVDFHEXBAHIL-UHFFFAOYSA-N 0 0 376.214 3.238 20 5 GGBDRN Cc1cnc(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])s1 ZINC000525678109 567258358 /nfs/dbraw/zinc/25/83/58/567258358.db2.gz VGBNNDBDQAXIFY-UHFFFAOYSA-N 0 0 375.328 3.231 20 5 GGBDRN CCC[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)C(=O)OCC ZINC000567569190 567258578 /nfs/dbraw/zinc/25/85/78/567258578.db2.gz LYNTZZHVEIEVMJ-SNVBAGLBSA-N 0 0 387.230 3.067 20 5 GGBDRN NS(=O)(=O)c1c(NCC2(c3ccccc3Cl)CC2)cccc1[N+](=O)[O-] ZINC000567574211 567258741 /nfs/dbraw/zinc/25/87/41/567258741.db2.gz HRQUUDXKFLVXLH-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN COc1ccc(Br)cc1CN(C)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000499610885 567260025 /nfs/dbraw/zinc/26/00/25/567260025.db2.gz LFHZVUFEVQWZMD-UHFFFAOYSA-N 0 0 394.225 3.220 20 5 GGBDRN O=C(NCc1n[nH]cc1Br)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000525720578 567260863 /nfs/dbraw/zinc/26/08/63/567260863.db2.gz VPJJRXSUPBIJFY-UHFFFAOYSA-N 0 0 393.119 3.029 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@H](C)c2ccccc2SC)ccc1[N+](=O)[O-] ZINC000499645572 567263061 /nfs/dbraw/zinc/26/30/61/567263061.db2.gz XHKCHZWPVWDPKW-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN O=C1NCCN(Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(Br)cc1 ZINC000475673072 567267189 /nfs/dbraw/zinc/26/71/89/567267189.db2.gz PYAKTBDAOGTWIB-MRXNPFEDSA-N 0 0 390.237 3.030 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CCc2ncsc2C1 ZINC000525834536 567268723 /nfs/dbraw/zinc/26/87/23/567268723.db2.gz PYAZXCBFWZBPJG-UHFFFAOYSA-N 0 0 387.202 3.219 20 5 GGBDRN O=C(Cc1cc(F)ccc1Br)NCCNc1ccccc1[N+](=O)[O-] ZINC000433739697 567270303 /nfs/dbraw/zinc/27/03/03/567270303.db2.gz ZRRPEQGFCNNKON-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN O=C(Cc1cc(Br)ccc1F)NCCNc1ccccc1[N+](=O)[O-] ZINC000433738913 567270440 /nfs/dbraw/zinc/27/04/40/567270440.db2.gz UMLHHJHFIKPYPA-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000455408968 567270557 /nfs/dbraw/zinc/27/05/57/567270557.db2.gz ZPQUVLHBKXSGCG-ZETOZRRWSA-N 0 0 398.257 3.372 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC000455408967 567270625 /nfs/dbraw/zinc/27/06/25/567270625.db2.gz ZPQUVLHBKXSGCG-UEKVPHQBSA-N 0 0 398.257 3.372 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NC[C@H](C)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000475735583 567271064 /nfs/dbraw/zinc/27/10/64/567271064.db2.gz RRKZDYMQQWKGRS-JTQLQIEISA-N 0 0 383.392 3.236 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000433770011 567271681 /nfs/dbraw/zinc/27/16/81/567271681.db2.gz AEVYOTUMGOUDTD-UHFFFAOYSA-N 0 0 381.230 3.176 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000475755717 567272949 /nfs/dbraw/zinc/27/29/49/567272949.db2.gz MQYMDORGCCBMKB-UHFFFAOYSA-N 0 0 381.179 3.073 20 5 GGBDRN CCN(Cc1ccoc1)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000591324529 567274733 /nfs/dbraw/zinc/27/47/33/567274733.db2.gz FSZGJYNYDRRPGN-UHFFFAOYSA-N 0 0 378.328 3.417 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1 ZINC000525908286 567274777 /nfs/dbraw/zinc/27/47/77/567274777.db2.gz REPYWEKFMMBEJG-GXFFZTMASA-N 0 0 382.189 3.121 20 5 GGBDRN O=C(Cc1cc(F)ccc1Br)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000433829603 567275968 /nfs/dbraw/zinc/27/59/68/567275968.db2.gz SMYVDHFBFYHXMP-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN CC[NH+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)[C@@H](C)C1 ZINC000567787410 567277140 /nfs/dbraw/zinc/27/71/40/567277140.db2.gz XUHXXCIFQZIMEF-QWRGUYRKSA-N 0 0 384.274 3.220 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000567784724 567277167 /nfs/dbraw/zinc/27/71/67/567277167.db2.gz TYNKOIZZOMSJPF-WBVHZDCISA-N 0 0 395.253 3.449 20 5 GGBDRN CC(=O)Nc1cccnc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000567817261 567280556 /nfs/dbraw/zinc/28/05/56/567280556.db2.gz QWENNUCRDWYODW-UHFFFAOYSA-N 0 0 385.199 3.025 20 5 GGBDRN COc1cc(C)c(S(=O)(=O)NCCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000433886132 567281190 /nfs/dbraw/zinc/28/11/90/567281190.db2.gz AQWOTBHZTYOXPW-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN COc1cc(C)c(S(=O)(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1Cl ZINC000433889127 567282273 /nfs/dbraw/zinc/28/22/73/567282273.db2.gz VSLAXBYTOHMKPT-UHFFFAOYSA-N 0 0 382.825 3.317 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Cn1cc([N+](=O)[O-])cc(Cl)c1=O ZINC000475895785 567286357 /nfs/dbraw/zinc/28/63/57/567286357.db2.gz AEIPEPMHGYEYMB-JTQLQIEISA-N 0 0 384.219 3.283 20 5 GGBDRN Cc1c([N-]S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)n[nH]c1C(F)(F)F ZINC000617230575 567291820 /nfs/dbraw/zinc/29/18/20/567291820.db2.gz JYMWOJHRMLFXAO-UHFFFAOYSA-N 0 0 378.332 3.063 20 5 GGBDRN COc1ccc(S(=O)(=O)N2c3ccccc3SC[C@H]2C)c([N+](=O)[O-])c1 ZINC000434108202 567293762 /nfs/dbraw/zinc/29/37/62/567293762.db2.gz DRXJAHAPSQXKKY-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1noc(C(F)F)n1 ZINC000591783617 567296417 /nfs/dbraw/zinc/29/64/17/567296417.db2.gz IIVBZLNQOKOQMK-RXMQYKEDSA-N 0 0 391.128 3.169 20 5 GGBDRN C[C@H](C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)N(C)CC(F)(F)F ZINC000476116945 567298504 /nfs/dbraw/zinc/29/85/04/567298504.db2.gz GAEWUPNZKBXKIB-YGRLFVJLSA-N 0 0 377.388 3.051 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CNCc1ccccc1[N+](=O)[O-] ZINC000500098934 567299224 /nfs/dbraw/zinc/29/92/24/567299224.db2.gz YNCBYJZXEWPVRE-UHFFFAOYSA-N 0 0 378.226 3.394 20 5 GGBDRN CS(=O)(=O)c1ccc(CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)s1 ZINC000568043615 567299782 /nfs/dbraw/zinc/29/97/82/567299782.db2.gz ONPZKRREUOIVLA-CYBMUJFWSA-N 0 0 394.396 3.453 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cl)cc1OCC(F)(F)F ZINC000476131664 567300358 /nfs/dbraw/zinc/30/03/58/567300358.db2.gz DMMZRAPBKWOBPD-UHFFFAOYSA-N 0 0 378.694 3.175 20 5 GGBDRN C[C@H]1CN(Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@]2(CCCOC2)O1 ZINC000591846119 567301744 /nfs/dbraw/zinc/30/17/44/567301744.db2.gz IMFDRKWSLSHYHT-BLLLJJGKSA-N 0 0 385.258 3.127 20 5 GGBDRN C[C@H]1OCC[C@]12CN(Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000568080415 567302775 /nfs/dbraw/zinc/30/27/75/567302775.db2.gz FPYBFTQKHQDUHB-HSMVNMDESA-N 0 0 385.258 3.126 20 5 GGBDRN NS(=O)(=O)c1ccc(OCCSc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000591887680 567303575 /nfs/dbraw/zinc/30/35/75/567303575.db2.gz NQQWUMHCTOKDGK-UHFFFAOYSA-N 0 0 388.854 3.067 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)[C@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000527012653 567304792 /nfs/dbraw/zinc/30/47/92/567304792.db2.gz UHDLAFNSNCPZJL-NSHDSACASA-N 0 0 382.825 3.358 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)[C@@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000527012652 567304979 /nfs/dbraw/zinc/30/49/79/567304979.db2.gz UHDLAFNSNCPZJL-LLVKDONJSA-N 0 0 382.825 3.358 20 5 GGBDRN CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000476211530 567305014 /nfs/dbraw/zinc/30/50/14/567305014.db2.gz VHYWTXGPNZKQOJ-LLVKDONJSA-N 0 0 395.264 3.424 20 5 GGBDRN O=[N+]([O-])c1cnn(CCOc2c(Br)cccc2Br)c1 ZINC000526997299 567305017 /nfs/dbraw/zinc/30/50/17/567305017.db2.gz XXYLYBLVFKXPPC-UHFFFAOYSA-N 0 0 391.019 3.395 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(F)cc2Br)cc1[N+](=O)[O-] ZINC000548294520 567305548 /nfs/dbraw/zinc/30/55/48/567305548.db2.gz VVUNWPMIYARUGG-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN C[C@@H]1SCC[C@H]1Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000592002738 567308309 /nfs/dbraw/zinc/30/83/09/567308309.db2.gz VRCKVFOZTWXMAA-GXTWGEPZSA-N 0 0 385.511 3.075 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCc1ccc(Cn2cccn2)cc1 ZINC000500254476 567309073 /nfs/dbraw/zinc/30/90/73/567309073.db2.gz RPQXDDBIHPNIST-UHFFFAOYSA-N 0 0 388.225 3.031 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H]2[C@@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000592060389 567311330 /nfs/dbraw/zinc/31/13/30/567311330.db2.gz LVYLNKYEOOBTKB-DOMZBBRYSA-N 0 0 388.873 3.136 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@@H]2[C@@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000592060391 567311632 /nfs/dbraw/zinc/31/16/32/567311632.db2.gz LVYLNKYEOOBTKB-IUODEOHRSA-N 0 0 388.873 3.136 20 5 GGBDRN CSc1ccc(C(=O)Nc2ccc(S(C)(=O)=O)c(C)c2)cc1[N+](=O)[O-] ZINC000500310538 567312586 /nfs/dbraw/zinc/31/25/86/567312586.db2.gz AMUZFWZHZCJDAM-UHFFFAOYSA-N 0 0 380.447 3.281 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NC1(c2ccccc2Cl)CC1 ZINC000592067923 567312866 /nfs/dbraw/zinc/31/28/66/567312866.db2.gz ZQSQDQJNCDCMJS-UHFFFAOYSA-N 0 0 382.825 3.224 20 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CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCn2cc(Br)cn2)c1 ZINC000568496469 567333317 /nfs/dbraw/zinc/33/33/17/567333317.db2.gz VUSLYHULKMLCPC-UHFFFAOYSA-N 0 0 399.270 3.048 20 5 GGBDRN CC[C@@H]1CN(c2nnc(CSc3ccccc3[N+](=O)[O-])n2C)CCS1 ZINC000592401103 567336627 /nfs/dbraw/zinc/33/66/27/567336627.db2.gz AIUXOEPVXWULLF-GFCCVEGCSA-N 0 0 379.511 3.347 20 5 GGBDRN C[C@H]1CN(c2nnc(CSc3ccccc3[N+](=O)[O-])n2C)C[C@H](C)S1 ZINC000592402821 567336805 /nfs/dbraw/zinc/33/68/05/567336805.db2.gz KNWPLYKDFSLBJI-RYUDHWBXSA-N 0 0 379.511 3.346 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1csc2ccccc12 ZINC000500653533 567337170 /nfs/dbraw/zinc/33/71/70/567337170.db2.gz RYBLBVFTGZIZDE-UHFFFAOYSA-N 0 0 376.459 3.472 20 5 GGBDRN C[C@@H](CCc1ccc(Br)cc1)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000500672227 567338192 /nfs/dbraw/zinc/33/81/92/567338192.db2.gz YHGOWJPFHNSQEY-NSHDSACASA-N 0 0 380.242 3.447 20 5 GGBDRN CS(=O)(=O)Nc1cc(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)ccc1Cl ZINC000527473104 567338196 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O=C(Cc1ccccc1[N+](=O)[O-])N1CCOc2c(Br)cccc2C1 ZINC000619419299 567451346 /nfs/dbraw/zinc/45/13/46/567451346.db2.gz IWMLJMWETITCED-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN O=C(Cc1noc(-c2csc(Cl)c2)n1)NCc1ccc([N+](=O)[O-])cc1 ZINC000570008219 567451583 /nfs/dbraw/zinc/45/15/83/567451583.db2.gz QWOBQDJHDPBOCF-UHFFFAOYSA-N 0 0 378.797 3.219 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1cccc2c1OCO2 ZINC000550557270 567452514 /nfs/dbraw/zinc/45/25/14/567452514.db2.gz FAKORHPJCJSRMA-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN O=C(CN1CCCC[C@@H]1C(F)F)Nc1ccc([N+](=O)[O-])cc1Br ZINC000502804345 567453217 /nfs/dbraw/zinc/45/32/17/567453217.db2.gz SVRBCWZQPSZVSE-GFCCVEGCSA-N 0 0 392.200 3.415 20 5 GGBDRN COc1cc(Cl)c(C)cc1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000570038089 567453695 /nfs/dbraw/zinc/45/36/95/567453695.db2.gz SXRGHRJTVYKSBD-UHFFFAOYSA-N 0 0 384.841 3.451 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2csc(Nc3ccccc3)n2)cc1 ZINC000619460886 567454442 /nfs/dbraw/zinc/45/44/42/567454442.db2.gz XJQNZOUYZUQHQL-UHFFFAOYSA-N 0 0 375.431 3.191 20 5 GGBDRN CC(=O)c1sc2[nH]c(CSc3ncccc3[N+](=O)[O-])nc(=O)c2c1C ZINC000502819880 567454554 /nfs/dbraw/zinc/45/45/54/567454554.db2.gz OMWHRRRCIJZOGA-UHFFFAOYSA-N 0 0 376.419 3.091 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cc(C(C)=O)ccc1Cl ZINC000619468062 567455301 /nfs/dbraw/zinc/45/53/01/567455301.db2.gz VEYSNEZRRNOJHO-UHFFFAOYSA-N 0 0 384.797 3.260 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H](CO)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000478435659 567456302 /nfs/dbraw/zinc/45/63/02/567456302.db2.gz DFUXCPGGFWDFQM-SNVBAGLBSA-N 0 0 387.223 3.212 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H]1CCc2c1cccc2Cl ZINC000619478464 567457125 /nfs/dbraw/zinc/45/71/25/567457125.db2.gz OEHCSLIUUPWKBM-ZDUSSCGKSA-N 0 0 382.825 3.223 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC[C@H]2c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000457329204 567457607 /nfs/dbraw/zinc/45/76/07/567457607.db2.gz OALPOFMZXCGVGU-LBPRGKRZSA-N 0 0 394.229 3.015 20 5 GGBDRN Cc1ccc([C@H](C)NCc2cc(Cl)cc(S(N)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000550711537 567458627 /nfs/dbraw/zinc/45/86/27/567458627.db2.gz YOARTZFRGNIRRX-NSHDSACASA-N 0 0 383.857 3.055 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(CC(F)(F)F)C1CCCC1 ZINC000619489241 567459435 /nfs/dbraw/zinc/45/94/35/567459435.db2.gz NUSLBWFIZXUAIM-UHFFFAOYSA-N 0 0 382.360 3.099 20 5 GGBDRN CCOC(=O)c1cc(NCCCn2cc(Br)cn2)ccc1[N+](=O)[O-] ZINC000570122101 567459793 /nfs/dbraw/zinc/45/97/93/567459793.db2.gz WCOGAKYNRAIAPS-UHFFFAOYSA-N 0 0 397.229 3.233 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCc2cc(Cl)ccc2C1 ZINC000619499420 567460149 /nfs/dbraw/zinc/46/01/49/567460149.db2.gz PEMBCSYAKBPQBU-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)Cc1ccc(F)cc1F ZINC000570117292 567460097 /nfs/dbraw/zinc/46/00/97/567460097.db2.gz QTVIAVUHCHVMQR-UHFFFAOYSA-N 0 0 390.795 3.189 20 5 GGBDRN Cc1cnc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c(C)c1 ZINC000594103389 567460165 /nfs/dbraw/zinc/46/01/65/567460165.db2.gz LCGOKYUUCINYEX-UHFFFAOYSA-N 0 0 392.253 3.271 20 5 GGBDRN CS(=O)(=O)c1cccc(Br)c1NCCc1cccc([N+](=O)[O-])c1 ZINC000550787023 567461500 /nfs/dbraw/zinc/46/15/00/567461500.db2.gz HMVRZMGMPHCVIY-UHFFFAOYSA-N 0 0 399.266 3.415 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)C(=O)OC(C)(C)C ZINC000594120735 567461836 /nfs/dbraw/zinc/46/18/36/567461836.db2.gz AXGGIPSRNBYBPS-VIFPVBQESA-N 0 0 387.230 3.065 20 5 GGBDRN CN(C)c1cc(Br)cc(C(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000550767200 567461969 /nfs/dbraw/zinc/46/19/69/567461969.db2.gz NASPYNKODBRKPS-UHFFFAOYSA-N 0 0 378.226 3.353 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594139609 567462096 /nfs/dbraw/zinc/46/20/96/567462096.db2.gz HVDUKNVDQILYPQ-SNVBAGLBSA-N 0 0 378.226 3.422 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc3c(cc2Cl)OCCCO3)cc1 ZINC000619568113 567466293 /nfs/dbraw/zinc/46/62/93/567466293.db2.gz HVSPZLYKBWYMAE-UHFFFAOYSA-N 0 0 384.797 3.210 20 5 GGBDRN O=[N+]([O-])c1ccsc1NCCCNS(=O)(=O)c1ccccc1Cl ZINC000619588309 567467635 /nfs/dbraw/zinc/46/76/35/567467635.db2.gz NRHXZCRNZROBQI-UHFFFAOYSA-N 0 0 375.859 3.090 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](C)c1ccc(SC)cc1 ZINC000619598043 567467900 /nfs/dbraw/zinc/46/79/00/567467900.db2.gz JTFHNHCNHLFSNI-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN Nc1nccc(C(=O)N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000594355737 567469907 /nfs/dbraw/zinc/46/99/07/567469907.db2.gz OWHVAGKRZGWDMA-MGCOHNPYSA-N 0 0 381.219 3.385 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)c(Cl)cc1F ZINC000619644981 567471099 /nfs/dbraw/zinc/47/10/99/567471099.db2.gz YWKRXHMVVWDKHZ-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN C[S@@](=O)C1(CNC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)CC1 ZINC000619678122 567472362 /nfs/dbraw/zinc/47/23/62/567472362.db2.gz ZXCLEIQZRWXOBE-RUZDIDTESA-N 0 0 382.507 3.270 20 5 GGBDRN C[S@](=O)C1(CNC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)CC1 ZINC000619678123 567472431 /nfs/dbraw/zinc/47/24/31/567472431.db2.gz ZXCLEIQZRWXOBE-VWLOTQADSA-N 0 0 382.507 3.270 20 5 GGBDRN CCCN(C(=O)CCn1cc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000619663296 567472701 /nfs/dbraw/zinc/47/27/01/567472701.db2.gz CFXQGCBWWYOHQO-UHFFFAOYSA-N 0 0 381.230 3.387 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H](OC2CCC2)C1 ZINC000594388762 567473194 /nfs/dbraw/zinc/47/31/94/567473194.db2.gz LWINARKXHIHVEK-HNNXBMFYSA-N 0 0 397.269 3.460 20 5 GGBDRN CC(C)c1ncc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000478656388 567474587 /nfs/dbraw/zinc/47/45/87/567474587.db2.gz WJUJXFDKFOJYBC-UHFFFAOYSA-N 0 0 379.214 3.452 20 5 GGBDRN O=[N+]([O-])c1ccsc1N1CCN(Cc2nc(-c3cccs3)no2)CC1 ZINC000619744633 567477619 /nfs/dbraw/zinc/47/76/19/567477619.db2.gz ULBWYNPOFHGARO-UHFFFAOYSA-N 0 0 377.451 3.090 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)C1CC1 ZINC000619745047 567477697 /nfs/dbraw/zinc/47/76/97/567477697.db2.gz AAQINTILCPZSKS-MRVPVSSYSA-N 0 0 388.205 3.284 20 5 GGBDRN O=[N+]([O-])c1ncccc1NCCOc1ccc(I)cc1 ZINC000619745700 567478348 /nfs/dbraw/zinc/47/83/48/567478348.db2.gz VDVWSRYRFJRGKF-UHFFFAOYSA-N 0 0 385.161 3.085 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)C1CCC1 ZINC000619750961 567478650 /nfs/dbraw/zinc/47/86/50/567478650.db2.gz GMUOECYFCHHQSC-SECBINFHSA-N 0 0 388.205 3.426 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccsc1 ZINC000619752183 567478799 /nfs/dbraw/zinc/47/87/99/567478799.db2.gz LHLGEPVHVDBWOU-MRVPVSSYSA-N 0 0 391.268 3.458 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccsc1 ZINC000619752184 567479132 /nfs/dbraw/zinc/47/91/32/567479132.db2.gz LHLGEPVHVDBWOU-QMMMGPOBSA-N 0 0 391.268 3.458 20 5 GGBDRN CC[C@H](C)CS(=O)(=O)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000570371381 567479376 /nfs/dbraw/zinc/47/93/76/567479376.db2.gz LYZWMUROROQNBE-VIFPVBQESA-N 0 0 397.234 3.160 20 5 GGBDRN O=C(NCc1ccsc1Br)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000619757010 567480280 /nfs/dbraw/zinc/48/02/80/567480280.db2.gz UUVQEBGXUFFEPI-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccsc1 ZINC000619758341 567480631 /nfs/dbraw/zinc/48/06/31/567480631.db2.gz QZUQQVOEVXVPPS-ZYHUDNBSSA-N 0 0 379.463 3.200 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NC[C@@H]1CCC2(CCOCC2)[C@@H]1O ZINC000619793180 567482020 /nfs/dbraw/zinc/48/20/20/567482020.db2.gz GYKMJBPOPHHKRN-XHDPSFHLSA-N 0 0 385.258 3.337 20 5 GGBDRN CC(C)C[C@@H]1OCCC[C@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000478768041 567482081 /nfs/dbraw/zinc/48/20/81/567482081.db2.gz NTJJLOOSUPUDBB-KGLIPLIRSA-N 0 0 376.862 3.120 20 5 GGBDRN O=C(NCC1(c2ccccn2)CC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000619834614 567482850 /nfs/dbraw/zinc/48/28/50/567482850.db2.gz YRPWXZWAJGXNCI-UHFFFAOYSA-N 0 0 376.210 3.214 20 5 GGBDRN O=C(Cc1ccc(Br)c(F)c1)NCCNc1ccccc1[N+](=O)[O-] ZINC000503395553 567482826 /nfs/dbraw/zinc/48/28/26/567482826.db2.gz VMMUSFMSVNLIPL-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN CC(C)C[C@@H]1OCCC[C@@H]1NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000478781763 567483152 /nfs/dbraw/zinc/48/31/52/567483152.db2.gz FTMBRYJPDLTFDX-JSGCOSHPSA-N 0 0 376.862 3.120 20 5 GGBDRN CC(C)C[C@H]1OCCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000478768042 567483173 /nfs/dbraw/zinc/48/31/73/567483173.db2.gz NTJJLOOSUPUDBB-UONOGXRCSA-N 0 0 376.862 3.120 20 5 GGBDRN CC(C)[C@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H](O)C(F)(F)F ZINC000619872540 567483979 /nfs/dbraw/zinc/48/39/79/567483979.db2.gz VFPJZGRZEZQFQH-XDTLVQLUSA-N 0 0 380.388 3.139 20 5 GGBDRN CC(C)C[C@H]1OCCC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000478786041 567484667 /nfs/dbraw/zinc/48/46/67/567484667.db2.gz ZDRBYBVYYGDOSR-TZMCWYRMSA-N 0 0 376.862 3.120 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCc3c[nH]cn3)cc2[N+](=O)[O-])n1 ZINC000478839481 567486265 /nfs/dbraw/zinc/48/62/65/567486265.db2.gz VCDLXZHYJPNYPI-UHFFFAOYSA-N 0 0 375.435 3.164 20 5 GGBDRN CC(C)Oc1nc(N[C@H](CO)c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000594569031 567486369 /nfs/dbraw/zinc/48/63/69/567486369.db2.gz XFHBVMWCQNHJJK-CYBMUJFWSA-N 0 0 396.241 3.107 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2cc3ccccc3s2)cc1 ZINC000503477564 567487002 /nfs/dbraw/zinc/48/70/02/567487002.db2.gz RVKGBYGSBHKUSS-UHFFFAOYSA-N 0 0 376.459 3.472 20 5 GGBDRN CC(C)c1nc(COc2ccc(I)cc2[N+](=O)[O-])no1 ZINC000478902012 567489969 /nfs/dbraw/zinc/48/99/69/567489969.db2.gz QQDGXLQXYKJHNA-UHFFFAOYSA-N 0 0 389.149 3.285 20 5 GGBDRN Cc1ccc(SCCNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000503507764 567489978 /nfs/dbraw/zinc/48/99/78/567489978.db2.gz RBDDUMYSGBLJKW-UHFFFAOYSA-N 0 0 380.491 3.157 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000570503258 567490469 /nfs/dbraw/zinc/49/04/69/567490469.db2.gz ZUZSCFCACBCSCI-UHFFFAOYSA-N 0 0 394.225 3.431 20 5 GGBDRN NC(=O)c1ccc(N2CCc3c(Br)cccc3C2)c([N+](=O)[O-])c1 ZINC000503541827 567492892 /nfs/dbraw/zinc/49/28/92/567492892.db2.gz NSXDGYWNTFWNIS-UHFFFAOYSA-N 0 0 376.210 3.019 20 5 GGBDRN 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C[C@H]1c2ccccc2OCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000595411990 567562496 /nfs/dbraw/zinc/56/24/96/567562496.db2.gz JSXYYDGSIDVVEF-NSHDSACASA-N 0 0 382.825 3.393 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](F)C1 ZINC000571456364 567563081 /nfs/dbraw/zinc/56/30/81/567563081.db2.gz LHMFZBMHWMSBQH-SECBINFHSA-N 0 0 392.168 3.082 20 5 GGBDRN COCCN(Cc1cc(Br)cs1)Cc1onc(C)c1[N+](=O)[O-] ZINC000595453926 567564881 /nfs/dbraw/zinc/56/48/81/567564881.db2.gz GUEZYIBQGOMXQW-UHFFFAOYSA-N 0 0 390.259 3.364 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1ccc2c(c1)CCC2 ZINC000479912321 567567358 /nfs/dbraw/zinc/56/73/58/567567358.db2.gz GGMZJLFPHHBNAP-UHFFFAOYSA-N 0 0 380.853 3.258 20 5 GGBDRN O=C(Nc1ccc(OC(F)(F)F)c(Br)c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000552218176 567568699 /nfs/dbraw/zinc/56/86/99/567568699.db2.gz IYMIYEZTVWVPHN-UHFFFAOYSA-N 0 0 395.091 3.231 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1ccc(Cl)s1 ZINC000479924115 567568953 /nfs/dbraw/zinc/56/89/53/567568953.db2.gz NCOLLKCNPCKBKM-UHFFFAOYSA-N 0 0 381.262 3.484 20 5 GGBDRN CCC(=O)c1ccc(Sc2nnnn2Cc2cccs2)c([N+](=O)[O-])c1 ZINC000479930085 567569364 /nfs/dbraw/zinc/56/93/64/567569364.db2.gz MXXFSIJEXLGKJD-UHFFFAOYSA-N 0 0 375.435 3.435 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1ccc(Br)s1 ZINC000479984893 567572800 /nfs/dbraw/zinc/57/28/00/567572800.db2.gz CDSHPVBXYXVTLK-MRVPVSSYSA-N 0 0 385.243 3.130 20 5 GGBDRN CN(CC1=CCSC1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000595590535 567572818 /nfs/dbraw/zinc/57/28/18/567572818.db2.gz LVMVOPOWKUDNHF-UHFFFAOYSA-N 0 0 375.372 3.428 20 5 GGBDRN CO[C@@H](c1ccccc1Cl)[C@@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000479986187 567573615 /nfs/dbraw/zinc/57/36/15/567573615.db2.gz BTQRYINNFZQBNJ-BDJLRTHQSA-N 0 0 384.841 3.303 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2C[C@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000439222205 567573612 /nfs/dbraw/zinc/57/36/12/567573612.db2.gz DXVYSDRYZIPANE-RKDXNWHRSA-N 0 0 377.260 3.085 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000439224676 567573648 /nfs/dbraw/zinc/57/36/48/567573648.db2.gz QVWRFLDEDRPPJE-ONGXEEELSA-N 0 0 391.287 3.475 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N[C@H]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000439241540 567574542 /nfs/dbraw/zinc/57/45/42/567574542.db2.gz XOFAODCURNTAKW-PELKAZGASA-N 0 0 377.260 3.133 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1cc(F)c(F)cc1F ZINC000480001313 567574958 /nfs/dbraw/zinc/57/49/58/567574958.db2.gz XQMJKNMKSBZFBA-UHFFFAOYSA-N 0 0 394.758 3.187 20 5 GGBDRN CC(C)[C@@H](C)S(=O)(=O)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000571608808 567575998 /nfs/dbraw/zinc/57/59/98/567575998.db2.gz ZYZCWIBNOSIANJ-SECBINFHSA-N 0 0 397.234 3.159 20 5 GGBDRN CCCCN(CC)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000439249309 567576036 /nfs/dbraw/zinc/57/60/36/567576036.db2.gz ROBHLOHGIPFKBM-UHFFFAOYSA-N 0 0 379.276 3.476 20 5 GGBDRN CC(C)[C@H](C)S(=O)(=O)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000571608809 567576282 /nfs/dbraw/zinc/57/62/82/567576282.db2.gz ZYZCWIBNOSIANJ-VIFPVBQESA-N 0 0 397.234 3.159 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000439250714 567576520 /nfs/dbraw/zinc/57/65/20/567576520.db2.gz UUOASDLKEKCLJY-SECBINFHSA-N 0 0 377.260 3.229 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cc1 ZINC000439248075 567576559 /nfs/dbraw/zinc/57/65/59/567576559.db2.gz OJGWTIFVXAGYRL-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN CCC[C@H](C)N(C)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000439252359 567576849 /nfs/dbraw/zinc/57/68/49/567576849.db2.gz YPQAJQFQILFOAE-VIFPVBQESA-N 0 0 379.276 3.475 20 5 GGBDRN C[C@@H](c1noc(-c2cc([N+](=O)[O-])nn2C)n1)c1ccc(Br)cc1 ZINC000571629712 567577450 /nfs/dbraw/zinc/57/74/50/567577450.db2.gz MJVHWFKOHZRXKE-MRVPVSSYSA-N 0 0 378.186 3.293 20 5 GGBDRN C[C@H]1CSC[C@@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000552322877 567577631 /nfs/dbraw/zinc/57/76/31/567577631.db2.gz COENNWCHNZHYDC-CABZTGNLSA-N 0 0 377.388 3.283 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1ccc(F)c(F)c1 ZINC000480050752 567578391 /nfs/dbraw/zinc/57/83/91/567578391.db2.gz KSHCIDLIQMRSOT-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN Cc1c(CNC(=O)N2CCSC[C@@H]2c2nccs2)cccc1[N+](=O)[O-] ZINC000480062988 567579119 /nfs/dbraw/zinc/57/91/19/567579119.db2.gz SBERAEXZUXYEMW-CQSZACIVSA-N 0 0 378.479 3.359 20 5 GGBDRN C[C@H](Oc1ccc(Br)cc1)C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000439282418 567579128 /nfs/dbraw/zinc/57/91/28/567579128.db2.gz IHOGUZCHALNELY-JTQLQIEISA-N 0 0 380.198 3.183 20 5 GGBDRN Cc1c(CNC(=O)N2CCSC[C@H]2c2nccs2)cccc1[N+](=O)[O-] ZINC000480062987 567579147 /nfs/dbraw/zinc/57/91/47/567579147.db2.gz SBERAEXZUXYEMW-AWEZNQCLSA-N 0 0 378.479 3.359 20 5 GGBDRN O=C(NCCc1c[nH]c2ncccc12)c1ccc(Br)cc1[N+](=O)[O-] ZINC000505504174 567579861 /nfs/dbraw/zinc/57/98/61/567579861.db2.gz ASKLSLNZBDTGGL-UHFFFAOYSA-N 0 0 389.209 3.206 20 5 GGBDRN COc1cc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc(OC)c1Br ZINC000439296248 567580191 /nfs/dbraw/zinc/58/01/91/567580191.db2.gz JBMUAXYWYDTMTP-UHFFFAOYSA-N 0 0 396.197 3.046 20 5 GGBDRN CCOC1CC(COc2ccc(I)cc2[N+](=O)[O-])C1 ZINC000505540054 567582363 /nfs/dbraw/zinc/58/23/63/567582363.db2.gz KUKZFOQUDKPAEL-UHFFFAOYSA-N 0 0 377.178 3.393 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cn2ccc(Br)cc2n1 ZINC000505587394 567585187 /nfs/dbraw/zinc/58/51/87/567585187.db2.gz ZQYKCVZEVIEPRT-UHFFFAOYSA-N 0 0 389.209 3.277 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)Cc2ccccc2Br)cc1 ZINC000571787250 567588304 /nfs/dbraw/zinc/58/83/04/567588304.db2.gz PHGFZXYUGAFIEY-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(Br)cc2)no1 ZINC000571794772 567589797 /nfs/dbraw/zinc/58/97/97/567589797.db2.gz VSQFRTHEBQTXGF-UHFFFAOYSA-N 0 0 378.186 3.155 20 5 GGBDRN Cc1cc(C2CCN(C(=O)c3cc([N+](=O)[O-])n[nH]3)CC2)ccc1Br ZINC000552440762 567591118 /nfs/dbraw/zinc/59/11/18/567591118.db2.gz VNQYPGLHVZZXSH-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN CN(CC(=O)Nc1cncc(Cl)c1Br)c1ccccc1[N+](=O)[O-] ZINC000571837199 567592219 /nfs/dbraw/zinc/59/22/19/567592219.db2.gz CZWAUFWOJSEGBD-UHFFFAOYSA-N 0 0 399.632 3.481 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1Oc1ncc(Cl)cn1 ZINC000480287781 567594192 /nfs/dbraw/zinc/59/41/92/567594192.db2.gz CPNVSKUONCAOEE-UHFFFAOYSA-N 0 0 377.525 3.435 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCc2nc(C(C)(C)C)cs2)c([N+](=O)[O-])c1 ZINC000552528036 567594899 /nfs/dbraw/zinc/59/48/99/567594899.db2.gz LGSVTALFVCIAGR-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN COc1cc(C)nc(Oc2ccc(I)cc2[N+](=O)[O-])n1 ZINC000480313870 567595605 /nfs/dbraw/zinc/59/56/05/567595605.db2.gz JNNCDPAYHVUXHJ-UHFFFAOYSA-N 0 0 387.133 3.099 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000439609895 567595989 /nfs/dbraw/zinc/59/59/89/567595989.db2.gz CKGVIHQKDUDHOF-NXEZZACHSA-N 0 0 381.376 3.023 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCCC(F)(F)F)c(S(=O)(=O)N2CCCC2)c1 ZINC000439694963 567598124 /nfs/dbraw/zinc/59/81/24/567598124.db2.gz PGLXMLWNNMTZOU-UHFFFAOYSA-N 0 0 381.376 3.134 20 5 GGBDRN Cc1noc(CS(=O)(=O)[C@H](C)c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000596019417 567599009 /nfs/dbraw/zinc/59/90/09/567599009.db2.gz FYEHECHIPOAKQZ-SECBINFHSA-N 0 0 389.227 3.330 20 5 GGBDRN COC(=O)c1c(Br)ccc(NCc2onc(C)c2[N+](=O)[O-])c1C ZINC000596033016 567600333 /nfs/dbraw/zinc/60/03/33/567600333.db2.gz WGDHUZVYGUJKTK-UHFFFAOYSA-N 0 0 384.186 3.361 20 5 GGBDRN O=C(NCCc1c[nH]c2ncccc12)c1ccc([N+](=O)[O-])cc1Br ZINC000505887593 567600639 /nfs/dbraw/zinc/60/06/39/567600639.db2.gz CEKPCELWXUCCJS-UHFFFAOYSA-N 0 0 389.209 3.206 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](COC(F)F)C1 ZINC000552693223 567601919 /nfs/dbraw/zinc/60/19/19/567601919.db2.gz BUIWBKPURZGAIZ-VIFPVBQESA-N 0 0 393.184 3.367 20 5 GGBDRN COC1CCC(C)(CNS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)CC1 ZINC000480413080 567602446 /nfs/dbraw/zinc/60/24/46/567602446.db2.gz GLUUZJAXFUUKMF-UHFFFAOYSA-N 0 0 390.889 3.430 20 5 GGBDRN Cc1cc(N2CCN(Cc3cscn3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000530437159 567602570 /nfs/dbraw/zinc/60/25/70/567602570.db2.gz RMQKAXFVEHYTDP-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN Cc1cc(N2CC[C@@H](Cc3cnn(C)c3)C2)c(Br)cc1[N+](=O)[O-] ZINC000530489989 567605141 /nfs/dbraw/zinc/60/51/41/567605141.db2.gz IGWZXWQIWNLBSS-LBPRGKRZSA-N 0 0 379.258 3.468 20 5 GGBDRN COCCOc1ccc(CNc2c(Br)cccc2[N+](=O)[O-])cn1 ZINC000596077176 567606349 /nfs/dbraw/zinc/60/63/49/567606349.db2.gz LXTJGLSQURYPBC-UHFFFAOYSA-N 0 0 382.214 3.390 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCCN(C[C@@H]2CCCO2)CC1 ZINC000596074611 567606524 /nfs/dbraw/zinc/60/65/24/567606524.db2.gz IDMRJQJLKXCKPI-ZDUSSCGKSA-N 0 0 384.274 3.048 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000530501533 567607113 /nfs/dbraw/zinc/60/71/13/567607113.db2.gz NKEHWHYOYDISCU-NSHDSACASA-N 0 0 383.235 3.249 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCCN(C[C@H]2CCCO2)CC1 ZINC000596074610 567606994 /nfs/dbraw/zinc/60/69/94/567606994.db2.gz IDMRJQJLKXCKPI-CYBMUJFWSA-N 0 0 384.274 3.048 20 5 GGBDRN CN(Cc1nnc2n1CCCCC2)c1c(Br)cccc1[N+](=O)[O-] ZINC000596064061 567607194 /nfs/dbraw/zinc/60/71/94/567607194.db2.gz AZGDOMMJXGRLMK-UHFFFAOYSA-N 0 0 380.246 3.312 20 5 GGBDRN COCC[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1ccc(Cl)c(Cl)c1 ZINC000552741164 567607285 /nfs/dbraw/zinc/60/72/85/567607285.db2.gz ASYDWXUDUNUOCF-LBPRGKRZSA-N 0 0 387.223 3.143 20 5 GGBDRN COCC[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1ccc(Cl)c(Cl)c1 ZINC000552741163 567607375 /nfs/dbraw/zinc/60/73/75/567607375.db2.gz ASYDWXUDUNUOCF-GFCCVEGCSA-N 0 0 387.223 3.143 20 5 GGBDRN O=C(c1ccc(Cl)cc1)N1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1 ZINC000596071522 567607426 /nfs/dbraw/zinc/60/74/26/567607426.db2.gz PWLJEOIEWZRYFS-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN Nc1nc(N[C@@H](c2cc(F)cc(Br)c2)C2CC2)ncc1[N+](=O)[O-] ZINC000480504583 567608532 /nfs/dbraw/zinc/60/85/32/567608532.db2.gz BCSOBLOVPNLOSN-GFCCVEGCSA-N 0 0 382.193 3.262 20 5 GGBDRN O=c1[nH]ccc(N2CCO[C@@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000596096999 567608683 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CCO[C@H](C)c1noc(CN(C)c2c(Br)cccc2[N+](=O)[O-])n1 ZINC000596139853 567611630 /nfs/dbraw/zinc/61/16/30/567611630.db2.gz WBYVMLPQSJZHAC-SECBINFHSA-N 0 0 385.218 3.474 20 5 GGBDRN NS(=O)(=O)c1ccc(NCC2(c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000596134832 567611636 /nfs/dbraw/zinc/61/16/36/567611636.db2.gz OLMZSMUGYXMBRX-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(c1c(Br)cccc1[N+](=O)[O-])CC2 ZINC000596146153 567612041 /nfs/dbraw/zinc/61/20/41/567612041.db2.gz RBVQMXMXYSMXSV-KBPBESRZSA-N 0 0 385.258 3.114 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000596169199 567612614 /nfs/dbraw/zinc/61/26/14/567612614.db2.gz SJCOLZCPYJMXBM-GFCCVEGCSA-N 0 0 383.164 3.497 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCNc2ccc(C(F)F)cc2[N+](=O)[O-])s1 ZINC000596169563 567613334 /nfs/dbraw/zinc/61/33/34/567613334.db2.gz IPEPMUKCXQNUFD-UHFFFAOYSA-N 0 0 391.421 3.293 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(c2ccc(F)cn2)CC1 ZINC000596184900 567614114 /nfs/dbraw/zinc/61/41/14/567614114.db2.gz JRNUWGMWFXYPSS-UHFFFAOYSA-N 0 0 381.205 3.218 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCC(OC[C@@H]2CCOC2)CC1 ZINC000596191614 567614146 /nfs/dbraw/zinc/61/41/46/567614146.db2.gz ZIVWMLZQFFESIT-GFCCVEGCSA-N 0 0 385.258 3.379 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)NCCCc1ccc(Cl)cc1Cl ZINC000530617711 567614187 /nfs/dbraw/zinc/61/41/87/567614187.db2.gz NFANMRKSYSLXHO-UHFFFAOYSA-N 0 0 390.248 3.208 20 5 GGBDRN Cc1cc(C)nc(N2CCN(c3c(Br)cccc3[N+](=O)[O-])CC2)n1 ZINC000596188844 567614490 /nfs/dbraw/zinc/61/44/90/567614490.db2.gz CVDWKHYCCXLLLZ-UHFFFAOYSA-N 0 0 392.257 3.091 20 5 GGBDRN C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000530617763 567614519 /nfs/dbraw/zinc/61/45/19/567614519.db2.gz UWTCENHLMDANDR-VXGBXAGGSA-N 0 0 383.857 3.456 20 5 GGBDRN Cc1ccnc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1Br ZINC000552868405 567615101 /nfs/dbraw/zinc/61/51/01/567615101.db2.gz VXQHFKGHFSEKCJ-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1NCCCc1nnc2n1CCCC2 ZINC000596177898 567614996 /nfs/dbraw/zinc/61/49/96/567614996.db2.gz FZRKCHINZXVPTM-UHFFFAOYSA-N 0 0 380.246 3.330 20 5 GGBDRN Cc1ccc(SC[C@H](C)Nc2ccc(S(N)(=O)=O)c([N+](=O)[O-])c2)cc1 ZINC000596197829 567615049 /nfs/dbraw/zinc/61/50/49/567615049.db2.gz XIYZLUVIJJZCTM-LBPRGKRZSA-N 0 0 381.479 3.143 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2ccccc2SC)c([N+](=O)[O-])c1 ZINC000480603130 567615236 /nfs/dbraw/zinc/61/52/36/567615236.db2.gz BVBVWXAQNLJRSQ-UHFFFAOYSA-N 0 0 382.463 3.146 20 5 GGBDRN CSc1ccccc1CN(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000480611537 567616318 /nfs/dbraw/zinc/61/63/18/567616318.db2.gz PNRBQMKGQYSIPR-UHFFFAOYSA-N 0 0 380.491 3.321 20 5 GGBDRN CNC(=O)c1cccc(NCCc2ccc([N+](=O)[O-])cc2)c1Br ZINC000506231604 567616904 /nfs/dbraw/zinc/61/69/04/567616904.db2.gz HJIWKYBCSNUXGS-UHFFFAOYSA-N 0 0 378.226 3.372 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1NC[C@H]1CCC2(CCOCC2)[C@H]1O ZINC000596227951 567617503 /nfs/dbraw/zinc/61/75/03/567617503.db2.gz VAJSZXGIHPMPLK-ABAIWWIYSA-N 0 0 385.258 3.337 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2ccccc2SC)cc1[N+](=O)[O-] ZINC000480638690 567617533 /nfs/dbraw/zinc/61/75/33/567617533.db2.gz IVKMQLAILMNLQJ-UHFFFAOYSA-N 0 0 382.463 3.146 20 5 GGBDRN COCCN(C[C@@H]1CC=CCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000480632646 567617635 /nfs/dbraw/zinc/61/76/35/567617635.db2.gz BYTWZYYCSMLRQY-CYBMUJFWSA-N 0 0 388.873 3.242 20 5 GGBDRN COc1ccnc(N2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000552950835 567617703 /nfs/dbraw/zinc/61/77/03/567617703.db2.gz ISKLQNQVPUTKEU-UHFFFAOYSA-N 0 0 384.223 3.027 20 5 GGBDRN COCCN(C[C@H]1CC=CCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000480632648 567617816 /nfs/dbraw/zinc/61/78/16/567617816.db2.gz BYTWZYYCSMLRQY-ZDUSSCGKSA-N 0 0 388.873 3.242 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@H](OCC(F)(F)F)C2)c(Br)c1 ZINC000530668212 567617941 /nfs/dbraw/zinc/61/79/41/567617941.db2.gz KZSGMKOIIKVGMC-VIFPVBQESA-N 0 0 384.152 3.300 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](c1nccn1C)C1CC1 ZINC000552942178 567617985 /nfs/dbraw/zinc/61/79/85/567617985.db2.gz GAUQHKYGHKJSHB-CQSZACIVSA-N 0 0 393.241 3.280 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000530675645 567618094 /nfs/dbraw/zinc/61/80/94/567618094.db2.gz XALFFSUUKCUKQT-CHWSQXEVSA-N 0 0 376.210 3.225 20 5 GGBDRN O=C(c1ccccn1)N1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000552973384 567618737 /nfs/dbraw/zinc/61/87/37/567618737.db2.gz VGVKLINXJMRNCR-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN CC(C)(C[C@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])C1)C(N)=O ZINC000596248150 567618992 /nfs/dbraw/zinc/61/89/92/567618992.db2.gz FODSOQKXOFVTSB-LLVKDONJSA-N 0 0 384.274 3.475 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCCc2cc(Br)ccc2F)n1 ZINC000552985053 567619466 /nfs/dbraw/zinc/61/94/66/567619466.db2.gz VHLSOFFKVSUVCK-UHFFFAOYSA-N 0 0 398.188 3.333 20 5 GGBDRN C[C@H](C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccc(Cl)s1 ZINC000530687148 567619671 /nfs/dbraw/zinc/61/96/71/567619671.db2.gz FJZJOCWUNLTTQP-NSHDSACASA-N 0 0 380.857 3.157 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCc2c1cccc2Cl ZINC000506280833 567619967 /nfs/dbraw/zinc/61/99/67/567619967.db2.gz BYGWAZAKOZBANG-UHFFFAOYSA-N 0 0 380.187 3.429 20 5 GGBDRN O=c1[nH]c(NCc2ccc(F)cc2Br)nc2ccc([N+](=O)[O-])cc12 ZINC000553000743 567620173 /nfs/dbraw/zinc/62/01/73/567620173.db2.gz XZRWLUFVPYSTCU-UHFFFAOYSA-N 0 0 393.172 3.179 20 5 GGBDRN O=[N+]([O-])c1cc2c(ncnc2N2CC[NH+](CCc3cccs3)CC2)s1 ZINC000553000772 567620253 /nfs/dbraw/zinc/62/02/53/567620253.db2.gz ZHKLZVPOXDHEKX-UHFFFAOYSA-N 0 0 375.479 3.026 20 5 GGBDRN NS(=O)(=O)c1cccc(CNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])c1 ZINC000553000551 567620460 /nfs/dbraw/zinc/62/04/60/567620460.db2.gz LXVOJBFBSRSSOC-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN CS(=O)(=O)c1cccc(Br)c1NCCc1ccccc1[N+](=O)[O-] ZINC000553067925 567624256 /nfs/dbraw/zinc/62/42/56/567624256.db2.gz NFEZROAAPRNUKJ-UHFFFAOYSA-N 0 0 399.266 3.415 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(CSCc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000596344342 567625062 /nfs/dbraw/zinc/62/50/62/567625062.db2.gz FGBVXYIVBOOOSQ-UHFFFAOYSA-N 0 0 384.454 3.418 20 5 GGBDRN CS(=O)(=O)Cc1nc(CSCc2ccc(F)cc2[N+](=O)[O-])cs1 ZINC000596341428 567625280 /nfs/dbraw/zinc/62/52/80/567625280.db2.gz NYHLZXTWXIKBEO-UHFFFAOYSA-N 0 0 376.456 3.168 20 5 GGBDRN COc1ccc(C(=O)CCn2cc([N+](=O)[O-])c(C)c(Br)c2=O)cc1 ZINC000506406439 567625214 /nfs/dbraw/zinc/62/52/14/567625214.db2.gz WLPJZAWNWBVLDO-UHFFFAOYSA-N 0 0 395.209 3.109 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(I)cn1 ZINC000530794559 567625806 /nfs/dbraw/zinc/62/58/06/567625806.db2.gz OXEMZRSWWVSEAN-UHFFFAOYSA-N 0 0 397.172 3.166 20 5 GGBDRN COCCN([C@@H]1CC[C@@H](C)C1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000480756007 567627530 /nfs/dbraw/zinc/62/75/30/567627530.db2.gz IWQNSNHXKYVYJA-VXGBXAGGSA-N 0 0 376.862 3.074 20 5 GGBDRN COCCN([C@@H]1CC[C@H](C)C1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000480756003 567627692 /nfs/dbraw/zinc/62/76/92/567627692.db2.gz IWQNSNHXKYVYJA-NWDGAFQWSA-N 0 0 376.862 3.074 20 5 GGBDRN COCCN([C@@H]1CC[C@@H](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000480760645 567628909 /nfs/dbraw/zinc/62/89/09/567628909.db2.gz RRALMWJFUDDGMN-VXGBXAGGSA-N 0 0 376.862 3.074 20 5 GGBDRN COC(=O)c1sccc1NC(=O)COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000506544588 567629310 /nfs/dbraw/zinc/62/93/10/567629310.db2.gz CPGPEJOLNVUIEK-UHFFFAOYSA-N 0 0 384.797 3.422 20 5 GGBDRN COCCN([C@H]1CC[C@H](C)C1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000480770511 567630062 /nfs/dbraw/zinc/63/00/62/567630062.db2.gz LIFXWGIVRVWJNW-AAEUAGOBSA-N 0 0 376.862 3.074 20 5 GGBDRN COCCN([C@@H]1CC[C@@H](C)C1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000480770512 567630103 /nfs/dbraw/zinc/63/01/03/567630103.db2.gz LIFXWGIVRVWJNW-DGCLKSJQSA-N 0 0 376.862 3.074 20 5 GGBDRN CCOC(=O)[C@H](C)N(C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000553153079 567630431 /nfs/dbraw/zinc/63/04/31/567630431.db2.gz ZTLNMYQKMBGGAH-VIFPVBQESA-N 0 0 382.214 3.293 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)c2ncnc3sc([N+](=O)[O-])cc32)n1 ZINC000553148844 567631033 /nfs/dbraw/zinc/63/10/33/567631033.db2.gz GGIQWFQMURLCGA-QMMMGPOBSA-N 0 0 380.455 3.433 20 5 GGBDRN CN(C)c1ccccc1CN(C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000572318555 567631076 /nfs/dbraw/zinc/63/10/76/567631076.db2.gz NSNUKXJTKNLTBA-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN CN(Cc1c(F)cccc1Cl)C(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506570128 567631633 /nfs/dbraw/zinc/63/16/33/567631633.db2.gz IHIRDDTWWMWNLJ-UHFFFAOYSA-N 0 0 388.182 3.473 20 5 GGBDRN O=C1CCN1c1cccc(CNc2ncc([N+](=O)[O-])cc2Br)c1 ZINC000440537880 567632560 /nfs/dbraw/zinc/63/25/60/567632560.db2.gz HJDZKVMFTALHAY-UHFFFAOYSA-N 0 0 377.198 3.101 20 5 GGBDRN O=C(NCC1CCN(CC(F)F)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000596440470 567632715 /nfs/dbraw/zinc/63/27/15/567632715.db2.gz LLWVTCWNLYPIBK-UHFFFAOYSA-N 0 0 376.791 3.347 20 5 GGBDRN Nc1nc(Sc2nc3cccc(Br)c3s2)ncc1[N+](=O)[O-] ZINC000480824612 567633714 /nfs/dbraw/zinc/63/37/14/567633714.db2.gz PLFGUQCIKTYHLL-UHFFFAOYSA-N 0 0 384.240 3.321 20 5 GGBDRN NS(=O)(=O)c1c(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000530995034 567635532 /nfs/dbraw/zinc/63/55/32/567635532.db2.gz JJFOETXDPAJODF-ZJUUUORDSA-N 0 0 381.376 3.023 20 5 GGBDRN CS(=O)(=O)C1(CNc2ccc([N+](=O)[O-])cc2OC(F)F)CCCCC1 ZINC000596474340 567636072 /nfs/dbraw/zinc/63/60/72/567636072.db2.gz NPPAWAANXVCVHC-UHFFFAOYSA-N 0 0 378.397 3.356 20 5 GGBDRN Cc1ccc(Br)c(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000480858034 567636451 /nfs/dbraw/zinc/63/64/51/567636451.db2.gz PYPHTJRRXQQZLS-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cc1cc(S(N)(=O)=O)ccc1CNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000553229436 567636687 /nfs/dbraw/zinc/63/66/87/567636687.db2.gz SFGKFYNPOHMHML-UHFFFAOYSA-N 0 0 390.248 3.470 20 5 GGBDRN CN(c1ccccc1)[C@@H]1CCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000596517009 567636976 /nfs/dbraw/zinc/63/69/76/567636976.db2.gz BGORWJZAADTUPY-CYBMUJFWSA-N 0 0 377.242 3.467 20 5 GGBDRN COC(=O)C(C)(C)n1cc(Nc2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000596519556 567637040 /nfs/dbraw/zinc/63/70/40/567637040.db2.gz XTCZMLVXVRPGMI-UHFFFAOYSA-N 0 0 383.202 3.206 20 5 GGBDRN CN(c1ccccc1)[C@H]1CCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000596517011 567637267 /nfs/dbraw/zinc/63/72/67/567637267.db2.gz BGORWJZAADTUPY-ZDUSSCGKSA-N 0 0 377.242 3.467 20 5 GGBDRN Cc1c(Br)c(N2CCOC(C3CC3)(C3CC3)C2)ncc1[N+](=O)[O-] ZINC000596513662 567637709 /nfs/dbraw/zinc/63/77/09/567637709.db2.gz BNHOUQCLNFQUDZ-UHFFFAOYSA-N 0 0 382.258 3.456 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000553236665 567638159 /nfs/dbraw/zinc/63/81/59/567638159.db2.gz YWFBQZMIWFSQNU-UHFFFAOYSA-N 0 0 395.257 3.281 20 5 GGBDRN CCCC[C@H](C)N(C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000572415930 567638258 /nfs/dbraw/zinc/63/82/58/567638258.db2.gz IIHIBFQACUDUNH-JTQLQIEISA-N 0 0 386.246 3.333 20 5 GGBDRN COc1ccc(Cl)cc1CS(=O)(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000480875193 567638718 /nfs/dbraw/zinc/63/87/18/567638718.db2.gz HHKJVYNRQPGVRF-UHFFFAOYSA-N 0 0 384.841 3.185 20 5 GGBDRN Cc1c(Br)c(NCC(C)(C)[C@]2(O)CCCOC2)ncc1[N+](=O)[O-] ZINC000596535458 567639027 /nfs/dbraw/zinc/63/90/27/567639027.db2.gz RABDRJMHQKSOAX-HNNXBMFYSA-N 0 0 388.262 3.040 20 5 GGBDRN Cc1cc(N2CCN(c3cccc(Br)c3)CC2)ncc1[N+](=O)[O-] ZINC000553255146 567639040 /nfs/dbraw/zinc/63/90/40/567639040.db2.gz OPKMNWKEABYHSQ-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN COC(=O)C[C@@H](C)SCc1cc(I)cc([N+](=O)[O-])c1 ZINC000572446184 567639653 /nfs/dbraw/zinc/63/96/53/567639653.db2.gz KANSGTYIGNUXEX-MRVPVSSYSA-N 0 0 395.218 3.384 20 5 GGBDRN COC(=O)C[C@H](C)SCc1cc(I)cc([N+](=O)[O-])c1 ZINC000572446185 567639908 /nfs/dbraw/zinc/63/99/08/567639908.db2.gz KANSGTYIGNUXEX-QMMMGPOBSA-N 0 0 395.218 3.384 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NC[C@H]1CCC2(CCCCC2)O1 ZINC000480902842 567641574 /nfs/dbraw/zinc/64/15/74/567641574.db2.gz WGSHHBKYKPTFQK-GFCCVEGCSA-N 0 0 388.873 3.408 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2cc(F)ccc2Br)n1 ZINC000553289969 567641988 /nfs/dbraw/zinc/64/19/88/567641988.db2.gz VUNWBTZAKKAOOY-UHFFFAOYSA-N 0 0 384.161 3.290 20 5 GGBDRN Cc1n[nH]c(C(=O)NCC2(c3ccccc3Br)CCC2)c1[N+](=O)[O-] ZINC000553321451 567643113 /nfs/dbraw/zinc/64/31/13/567643113.db2.gz XERJQYBVFYSVSR-UHFFFAOYSA-N 0 0 393.241 3.241 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccc(Br)cc1 ZINC000506780650 567643225 /nfs/dbraw/zinc/64/32/25/567643225.db2.gz KLGAAUIBFJSWBQ-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1Br ZINC000531151931 567643683 /nfs/dbraw/zinc/64/36/83/567643683.db2.gz XMPZNTUAJNGDBK-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2noc3c2CCCC3)cc1[N+](=O)[O-] ZINC000572514415 567644999 /nfs/dbraw/zinc/64/49/99/567644999.db2.gz LXHUAHQZJNYUTI-UHFFFAOYSA-N 0 0 394.225 3.463 20 5 GGBDRN O=C(Nc1cnn(-c2ccccn2)c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000531187072 567645519 /nfs/dbraw/zinc/64/55/19/567645519.db2.gz CAUUBEYLIMYAFZ-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CN(C[C@H](O)Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000480966442 567646898 /nfs/dbraw/zinc/64/68/98/567646898.db2.gz QUACEOMZIAXJJK-CQSZACIVSA-N 0 0 393.237 3.033 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1Nc1cnn(CCN2CCOCC2)c1 ZINC000553371287 567646999 /nfs/dbraw/zinc/64/69/99/567646999.db2.gz FKWPAPOLRGHEOL-UHFFFAOYSA-N 0 0 386.239 3.174 20 5 GGBDRN NC(=O)c1cccc(N[C@H]2C[C@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000553375367 567647082 /nfs/dbraw/zinc/64/70/82/567647082.db2.gz PDZVQLQCMDGQFS-JSGCOSHPSA-N 0 0 376.210 3.424 20 5 GGBDRN C[C@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)c1ccc(Br)s1 ZINC000440872102 567647853 /nfs/dbraw/zinc/64/78/53/567647853.db2.gz GNPRUIIZKTXPAQ-QMMMGPOBSA-N 0 0 387.259 3.228 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCN2S(=O)(=O)Cc1ccc(Br)cc1 ZINC000480980603 567648082 /nfs/dbraw/zinc/64/80/82/567648082.db2.gz MYHOKPHNLBKWJC-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN NC(=O)c1ccc(NCc2cc(F)c(F)cc2Br)c([N+](=O)[O-])c1 ZINC000553389213 567648838 /nfs/dbraw/zinc/64/88/38/567648838.db2.gz YXWLCHABIIZSOK-UHFFFAOYSA-N 0 0 386.152 3.347 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cccc(F)c3Br)CC2)cn1 ZINC000572571503 567649581 /nfs/dbraw/zinc/64/95/81/567649581.db2.gz POXPGIHPFFLHAA-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN O=C(Nc1nc(C(F)(F)F)c[nH]1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000506923692 567650574 /nfs/dbraw/zinc/65/05/74/567650574.db2.gz SGGAUIZCCJGKSK-UHFFFAOYSA-N 0 0 379.092 3.352 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCOc3ccc(Cl)cc32)c1C ZINC000481010785 567652059 /nfs/dbraw/zinc/65/20/59/567652059.db2.gz RYKVKCIXOWEUGV-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN Cc1cc(NCCNc2ncc(C(F)(F)F)cc2Cl)ncc1[N+](=O)[O-] ZINC000531305146 567652476 /nfs/dbraw/zinc/65/24/76/567652476.db2.gz USMIBERXFVZBKY-UHFFFAOYSA-N 0 0 375.738 3.311 20 5 GGBDRN COc1cc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)ccc1Br ZINC000531306312 567652717 /nfs/dbraw/zinc/65/27/17/567652717.db2.gz WRKQAJBZBXPEKW-UHFFFAOYSA-N 0 0 395.165 3.347 20 5 GGBDRN NC(=O)C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)c1cccc(Cl)c1 ZINC000553447724 567655344 /nfs/dbraw/zinc/65/53/44/567655344.db2.gz BSWSBCPZPWKSSC-LLVKDONJSA-N 0 0 377.813 3.282 20 5 GGBDRN COc1ccc(Br)cc1[C@@H]1CCCN1c1c([N+](=O)[O-])ncn1C ZINC000507030252 567656205 /nfs/dbraw/zinc/65/62/05/567656205.db2.gz PRDJVXOIODJICZ-LBPRGKRZSA-N 0 0 381.230 3.441 20 5 GGBDRN CC(C)(CNC(=O)CCn1cc([N+](=O)[O-])cn1)c1cccc(Br)c1 ZINC000507057354 567657297 /nfs/dbraw/zinc/65/72/97/567657297.db2.gz TVEZZZIMIRQSHI-UHFFFAOYSA-N 0 0 395.257 3.038 20 5 GGBDRN CC(=O)Nc1ccccc1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000531425845 567658480 /nfs/dbraw/zinc/65/84/80/567658480.db2.gz UAFHWWTYZZTQKW-UHFFFAOYSA-N 0 0 392.209 3.246 20 5 GGBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCc1cc(=O)n2ccsc2n1 ZINC000531482219 567661262 /nfs/dbraw/zinc/66/12/62/567661262.db2.gz OMRMMGQOVBMNFV-UHFFFAOYSA-N 0 0 396.222 3.314 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000459882964 567663755 /nfs/dbraw/zinc/66/37/55/567663755.db2.gz MOVQPJVWTMTDJY-ZDUSSCGKSA-N 0 0 380.447 3.037 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCCc1nc2cc(Cl)ccc2s1 ZINC000531533554 567664715 /nfs/dbraw/zinc/66/47/15/567664715.db2.gz OQJUZIDMSPMNEZ-UHFFFAOYSA-N 0 0 397.865 3.379 20 5 GGBDRN CO[C@]1(C)CCCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000481245602 567665270 /nfs/dbraw/zinc/66/52/70/567665270.db2.gz HOBBSUGCTRCICR-CQSZACIVSA-N 0 0 397.280 3.481 20 5 GGBDRN O=c1nc(SCCn2ccc([N+](=O)[O-])n2)[nH]c2sc3c(c21)CCCC3 ZINC000481264545 567667289 /nfs/dbraw/zinc/66/72/89/567667289.db2.gz AYSKVOOGVSGSPP-UHFFFAOYSA-N 0 0 377.451 3.173 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNc2ncnc3sc([N+](=O)[O-])cc32)s1 ZINC000553565588 567667573 /nfs/dbraw/zinc/66/75/73/567667573.db2.gz JMOFDCPRNXPFIG-UHFFFAOYSA-N 0 0 384.464 3.067 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2Cc3cccc(Cl)c3C2)cc1[N+](=O)[O-] ZINC000553574372 567668769 /nfs/dbraw/zinc/66/87/69/567668769.db2.gz IIVDIHRIFNKISB-UHFFFAOYSA-N 0 0 386.788 3.100 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cc(Br)ccc3F)CC2)cn1 ZINC000507242085 567669823 /nfs/dbraw/zinc/66/98/23/567669823.db2.gz CRQOLKJFIQUYMW-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N(C)CCOc1ccc(Br)cc1 ZINC000572874498 567671773 /nfs/dbraw/zinc/67/17/73/567671773.db2.gz HHGOKKZQFKFWPX-UHFFFAOYSA-N 0 0 383.246 3.397 20 5 GGBDRN C[C@@H](Cc1cccc(Br)c1)Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000572907973 567673752 /nfs/dbraw/zinc/67/37/52/567673752.db2.gz KYCJPGMKRMQCBE-JTQLQIEISA-N 0 0 378.226 3.499 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCCc2c(Cl)cccc2Cl)c1 ZINC000507313989 567673928 /nfs/dbraw/zinc/67/39/28/567673928.db2.gz YZPTXCLXXCEWAR-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN CN1CCN(c2ncc([N+](=O)[O-])cc2Br)C[C@@H]1Cc1ccccc1 ZINC000553686286 567676120 /nfs/dbraw/zinc/67/61/20/567676120.db2.gz ABKQPJBQWDCWEH-HNNXBMFYSA-N 0 0 391.269 3.115 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC1(C)C ZINC000553726190 567677504 /nfs/dbraw/zinc/67/75/04/567677504.db2.gz DJOPKDZGDZBLAU-LBPRGKRZSA-N 0 0 388.205 3.426 20 5 GGBDRN CSc1ccc(C(=O)N2C[C@@H](C(F)(F)F)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000553711459 567678176 /nfs/dbraw/zinc/67/81/76/567678176.db2.gz JSFCMNXVLMZHJP-LBPRGKRZSA-N 0 0 378.372 3.499 20 5 GGBDRN Cc1c(CNC(=O)c2[nH]nc(C3CC3)c2Br)cccc1[N+](=O)[O-] ZINC000481464165 567679868 /nfs/dbraw/zinc/67/98/68/567679868.db2.gz HWFIGQUCNBNBOF-UHFFFAOYSA-N 0 0 379.214 3.196 20 5 GGBDRN Cc1c(CNC(=O)c2[nH]nc(C(C)C)c2Br)cccc1[N+](=O)[O-] ZINC000481477525 567680931 /nfs/dbraw/zinc/68/09/31/567680931.db2.gz XLOSCJFIVFABBN-UHFFFAOYSA-N 0 0 381.230 3.442 20 5 GGBDRN CNc1ccc(C(=O)N(C)Cc2cc(Br)cn2C)cc1[N+](=O)[O-] ZINC000531827388 567682241 /nfs/dbraw/zinc/68/22/41/567682241.db2.gz WJIZRNKRPWFHSP-UHFFFAOYSA-N 0 0 381.230 3.010 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000507536039 567684330 /nfs/dbraw/zinc/68/43/30/567684330.db2.gz VVKDSMXWHDHAIH-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN COC(=O)c1ccc(OCCNc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000531881979 567684568 /nfs/dbraw/zinc/68/45/68/567684568.db2.gz BJWXBROOPCTXTF-UHFFFAOYSA-N 0 0 396.197 3.030 20 5 GGBDRN Cc1c(Br)cncc1CN1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000597147543 567684624 /nfs/dbraw/zinc/68/46/24/567684624.db2.gz XGAXMRPDTIHXTA-UHFFFAOYSA-N 0 0 378.226 3.324 20 5 GGBDRN O=C(CSCc1cccnc1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000460359883 567686386 /nfs/dbraw/zinc/68/63/86/567686386.db2.gz CIAABWAUJFGHND-QGZVFWFLSA-N 0 0 375.475 3.497 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1csc(C(=O)OC)c1 ZINC000442235016 567686348 /nfs/dbraw/zinc/68/63/48/567686348.db2.gz IPFXQGYQIKFAOL-UHFFFAOYSA-N 0 0 384.435 3.048 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccsc1C(=O)OC ZINC000442241448 567687405 /nfs/dbraw/zinc/68/74/05/567687405.db2.gz QCSANQFHDFHIRW-UHFFFAOYSA-N 0 0 384.435 3.048 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cc(F)c(F)cc2Br)c1 ZINC000442245689 567688073 /nfs/dbraw/zinc/68/80/73/567688073.db2.gz WIVAYDCZQXERMA-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN COC(=O)c1ccc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)s1 ZINC000507600274 567689663 /nfs/dbraw/zinc/68/96/63/567689663.db2.gz NPSIOTLOJITWRB-UHFFFAOYSA-N 0 0 387.460 3.139 20 5 GGBDRN Cc1c(Br)c(N2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)ncc1[N+](=O)[O-] ZINC000573118367 567689849 /nfs/dbraw/zinc/68/98/49/567689849.db2.gz RUAPIJRRLVCRCV-RKDXNWHRSA-N 0 0 398.179 3.058 20 5 GGBDRN COc1ccc(Cl)c2c1N(S(=O)(=O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000442336779 567690551 /nfs/dbraw/zinc/69/05/51/567690551.db2.gz SOWKPDIKEGMMSI-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cc(Br)ccc2F)c1 ZINC000442324873 567690986 /nfs/dbraw/zinc/69/09/86/567690986.db2.gz AJLQEMSFXYMIGH-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN COc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000442348977 567691016 /nfs/dbraw/zinc/69/10/16/567691016.db2.gz KIKAJCJEBTZQTM-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](c1cccs1)C(C)(C)CO ZINC000573168871 567694050 /nfs/dbraw/zinc/69/40/50/567694050.db2.gz JNOTVLRVKYRGTN-HNNXBMFYSA-N 0 0 384.479 3.003 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NCCCNC(=O)c2ccc(Br)cc2)n1 ZINC000481679366 567695444 /nfs/dbraw/zinc/69/54/44/567695444.db2.gz YVXJWFVHQFLZLY-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN Cc1cccc(S(=O)(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1Br ZINC000460639616 567695461 /nfs/dbraw/zinc/69/54/61/567695461.db2.gz WPLRWQKNUZHPEP-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN Cc1ccc(Br)c(S(=O)(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000460632378 567695589 /nfs/dbraw/zinc/69/55/89/567695589.db2.gz BBAHQFZLXSJPDB-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN COC(=O)c1cnc(N(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C2CC2)s1 ZINC000460633651 567696155 /nfs/dbraw/zinc/69/61/55/567696155.db2.gz FQJYSLZARCUZSC-UHFFFAOYSA-N 0 0 381.797 3.301 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NCc1ccc2c(c1)CCS2(=O)=O ZINC000532068874 567696257 /nfs/dbraw/zinc/69/62/57/567696257.db2.gz ZJIOTPIOLOAKJX-UHFFFAOYSA-N 0 0 397.250 3.299 20 5 GGBDRN Cc1cc(N2CCCC[C@@H](S(C)(=O)=O)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000573215041 567696789 /nfs/dbraw/zinc/69/67/89/567696789.db2.gz VIEUEPKFIBCXTD-LLVKDONJSA-N 0 0 380.388 3.326 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000532110041 567697478 /nfs/dbraw/zinc/69/74/78/567697478.db2.gz WMRVMRDHMJMWFC-GFCCVEGCSA-N 0 0 380.242 3.447 20 5 GGBDRN Cc1cc(Br)cc([N+](=O)[O-])c1O[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000532106631 567697533 /nfs/dbraw/zinc/69/75/33/567697533.db2.gz HOJWVNYFZZVDJV-SNVBAGLBSA-N 0 0 397.147 3.208 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@H](C)c2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000507696935 567698067 /nfs/dbraw/zinc/69/80/67/567698067.db2.gz FGMDFQVLCLJPCB-SSDOTTSWSA-N 0 0 385.193 3.029 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC(C)(C)[C@@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000553911880 567698266 /nfs/dbraw/zinc/69/82/66/567698266.db2.gz QYVPTAAOOSIDDS-HNNXBMFYSA-N 0 0 382.463 3.437 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1-c1nc(C2(c3cccc(Br)c3)CC2)no1 ZINC000442674332 567699782 /nfs/dbraw/zinc/69/97/82/567699782.db2.gz WABMMVMOTHPWGL-UHFFFAOYSA-N 0 0 390.197 3.221 20 5 GGBDRN CC(C)c1nc(C[S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 ZINC000507709069 567699794 /nfs/dbraw/zinc/69/97/94/567699794.db2.gz LKNDYJFYHBWWPU-VWLOTQADSA-N 0 0 381.479 3.452 20 5 GGBDRN CC(C)CC[C@H](O)COc1ccc(I)cc1[N+](=O)[O-] ZINC000481730978 567700158 /nfs/dbraw/zinc/70/01/58/567700158.db2.gz BEVLFPFIPGIMQL-NSHDSACASA-N 0 0 379.194 3.375 20 5 GGBDRN Cc1c(CNC(=O)C(=O)Nc2cccc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000573271181 567701418 /nfs/dbraw/zinc/70/14/18/567701418.db2.gz RIDOVKKDNPXBFE-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000532165169 567701903 /nfs/dbraw/zinc/70/19/03/567701903.db2.gz TUKQOBXSOQSYSA-AWEZNQCLSA-N 0 0 381.479 3.248 20 5 GGBDRN C[C@@H](O)[C@@H]1C[C@H](C)CCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000442723311 567702699 /nfs/dbraw/zinc/70/26/99/567702699.db2.gz SAAAVHDJGUKBNO-LNLATYFQSA-N 0 0 397.280 3.072 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Br)s1 ZINC000442729945 567702794 /nfs/dbraw/zinc/70/27/94/567702794.db2.gz PJWMZLNQZVSCCN-MRVPVSSYSA-N 0 0 391.268 3.458 20 5 GGBDRN C[C@H](O)[C@@H]1C[C@H](C)CCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000442723313 567702800 /nfs/dbraw/zinc/70/28/00/567702800.db2.gz SAAAVHDJGUKBNO-PTRXPTGYSA-N 0 0 397.280 3.072 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(Br)s1 ZINC000442729900 567703056 /nfs/dbraw/zinc/70/30/56/567703056.db2.gz CLYOXNNBPJVHJH-MRVPVSSYSA-N 0 0 391.268 3.458 20 5 GGBDRN O=C(CC[S@](=O)c1cccc(Br)c1)Nc1ccccc1[N+](=O)[O-] ZINC000507753448 567703623 /nfs/dbraw/zinc/70/36/23/567703623.db2.gz VBIJEGJPCTZNHW-QHCPKHFHSA-N 0 0 397.250 3.494 20 5 GGBDRN C[S@@](=O)CCCNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000442742170 567703984 /nfs/dbraw/zinc/70/39/84/567703984.db2.gz YVFQTJYCDHCYOU-RUZDIDTESA-N 0 0 378.475 3.244 20 5 GGBDRN C[S@](=O)CCCNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000442742171 567704063 /nfs/dbraw/zinc/70/40/63/567704063.db2.gz YVFQTJYCDHCYOU-VWLOTQADSA-N 0 0 378.475 3.244 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000554008362 567704357 /nfs/dbraw/zinc/70/43/57/567704357.db2.gz JSZPTHKNJCZYKH-UHFFFAOYSA-N 0 0 385.193 3.102 20 5 GGBDRN O=C(Nc1cc(Cl)cc2c1OCC(=O)N2)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000554011612 567704396 /nfs/dbraw/zinc/70/43/96/567704396.db2.gz GLVFVHBGVNCBFE-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)nn1-c1ccc(Cl)cc1Cl ZINC000554009683 567704570 /nfs/dbraw/zinc/70/45/70/567704570.db2.gz DABTVMIINJEWBQ-UHFFFAOYSA-N 0 0 380.191 3.398 20 5 GGBDRN O=[N+]([O-])c1ccc2[nH]nc(-c3nc(-c4ccc(Br)cn4)no3)c2c1 ZINC000460830137 567704781 /nfs/dbraw/zinc/70/47/81/567704781.db2.gz OPSTZBSMNRHHME-UHFFFAOYSA-N 0 0 387.153 3.346 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCOc3ccc(Cl)cc32)cc1C ZINC000460826750 567704845 /nfs/dbraw/zinc/70/48/45/567704845.db2.gz CLXASJJEURNELR-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN O=C(Nc1cc(Cl)cc2c1OCC(=O)N2)c1ccc([N+](=O)[O-])cc1Cl ZINC000554044965 567706313 /nfs/dbraw/zinc/70/63/13/567706313.db2.gz PJNQKENKDOFUTF-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@H](O)C(F)(F)F ZINC000597620805 567709108 /nfs/dbraw/zinc/70/91/08/567709108.db2.gz BOHRKXUIQFPPGG-QWRGUYRKSA-N 0 0 399.163 3.035 20 5 GGBDRN CC1(C)CC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000507892925 567713317 /nfs/dbraw/zinc/71/33/17/567713317.db2.gz WPQPTTVDSDQZRX-VIFPVBQESA-N 0 0 377.260 3.214 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N(C)Cc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000532419194 567715252 /nfs/dbraw/zinc/71/52/52/567715252.db2.gz IZVWZYSASLKGCQ-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN Cc1ccc(I)cc1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000532422778 567715765 /nfs/dbraw/zinc/71/57/65/567715765.db2.gz GKWTXKFOBVCNGU-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1C[C@@H]2CCCC[C@@H]21 ZINC000597830710 567717781 /nfs/dbraw/zinc/71/77/81/567717781.db2.gz ZSAWAKLZGYIMDB-ZANVPECISA-N 0 0 386.189 3.214 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCCc1cccc(Cl)c1 ZINC000554266771 567718002 /nfs/dbraw/zinc/71/80/02/567718002.db2.gz ZZURGRXJXSRQOK-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H](c2ccc(F)cc2)C(F)(F)F)c1 ZINC000442941180 567718911 /nfs/dbraw/zinc/71/89/11/567718911.db2.gz HGCYJLGHNDIRCC-CYBMUJFWSA-N 0 0 378.303 3.316 20 5 GGBDRN CC[C@H](C)N(CC)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000597856911 567719149 /nfs/dbraw/zinc/71/91/49/567719149.db2.gz QLTVEABTBFDEBT-VIFPVBQESA-N 0 0 376.194 3.460 20 5 GGBDRN O=C(COc1ccsc1Cl)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000573510717 567719265 /nfs/dbraw/zinc/71/92/65/567719265.db2.gz UBBUEKLKPSXXFQ-UHFFFAOYSA-N 0 0 381.841 3.037 20 5 GGBDRN CC[C@@H](C)N(CC)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000597856964 567719600 /nfs/dbraw/zinc/71/96/00/567719600.db2.gz SCKRQUDSUATBIO-SECBINFHSA-N 0 0 376.194 3.460 20 5 GGBDRN CN(Cc1cc(Br)ccc1F)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000532523816 567719684 /nfs/dbraw/zinc/71/96/84/567719684.db2.gz OZRZMVKCDASTKQ-UHFFFAOYSA-N 0 0 396.216 3.227 20 5 GGBDRN Cc1sc(NC(=O)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])nc1C(C)C ZINC000597894209 567722563 /nfs/dbraw/zinc/72/25/63/567722563.db2.gz KKMFBVPYCSDWPK-UHFFFAOYSA-N 0 0 383.451 3.139 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@]12C[C@H]1CCC2 ZINC000597892045 567722647 /nfs/dbraw/zinc/72/26/47/567722647.db2.gz ZPJVTKABEQDCGB-YMTOWFKASA-N 0 0 386.189 3.180 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@@]12C[C@@H]1CCC2 ZINC000597892044 567722797 /nfs/dbraw/zinc/72/27/97/567722797.db2.gz ZPJVTKABEQDCGB-XPTSAGLGSA-N 0 0 386.189 3.180 20 5 GGBDRN Cc1cc(NC(=O)N(C)CCn2cc(Br)cn2)ccc1[N+](=O)[O-] ZINC000573599939 567724251 /nfs/dbraw/zinc/72/42/51/567724251.db2.gz UQTQVCCSUMQGCD-UHFFFAOYSA-N 0 0 382.218 3.026 20 5 GGBDRN COc1ccc(C)cc1S(=O)(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000443050422 567727356 /nfs/dbraw/zinc/72/73/56/567727356.db2.gz RFWDQXRLAAYMBC-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCOC[C@@H]1C1CCC1 ZINC000573686791 567730215 /nfs/dbraw/zinc/73/02/15/567730215.db2.gz UXHXCBBNFPZYCU-SNVBAGLBSA-N 0 0 375.244 3.060 20 5 GGBDRN CC[C@H](C)CCNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000597975975 567730523 /nfs/dbraw/zinc/73/05/23/567730523.db2.gz PRDHOYXXEBPQAX-VIFPVBQESA-N 0 0 376.194 3.365 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1csc(=O)[nH]1 ZINC000508122948 567731642 /nfs/dbraw/zinc/73/16/42/567731642.db2.gz YMFACNPLEOBZJL-UHFFFAOYSA-N 0 0 381.479 3.478 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000532744997 567732311 /nfs/dbraw/zinc/73/23/11/567732311.db2.gz LQNUDMLKENTHJZ-CQSZACIVSA-N 0 0 399.241 3.209 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1[C@@H](C)CO ZINC000598021084 567732649 /nfs/dbraw/zinc/73/26/49/567732649.db2.gz QLJXPRCNCKSBOX-ZUZCIYMTSA-N 0 0 385.258 3.289 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2SC)cc1[N+](=O)[O-] ZINC000443099976 567733115 /nfs/dbraw/zinc/73/31/15/567733115.db2.gz CSSMETPKHQUFLG-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN O=C(Cc1cccc(Br)c1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461397030 567733199 /nfs/dbraw/zinc/73/31/99/567733199.db2.gz RKCDDMNBCUCOGY-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000532763153 567733609 /nfs/dbraw/zinc/73/36/09/567733609.db2.gz ZVBKSKSTUHGVIM-VXGBXAGGSA-N 0 0 393.241 3.490 20 5 GGBDRN CS(=O)(=O)Nc1ccc(Oc2c(Cl)cc(Cl)cc2[N+](=O)[O-])cn1 ZINC000573756477 567733831 /nfs/dbraw/zinc/73/38/31/567733831.db2.gz UVUJUQOESZJVKG-UHFFFAOYSA-N 0 0 378.193 3.460 20 5 GGBDRN CC(C)CNC(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000508157768 567734257 /nfs/dbraw/zinc/73/42/57/567734257.db2.gz COHJODDDBZNLJV-UHFFFAOYSA-N 0 0 382.214 3.057 20 5 GGBDRN O=C(c1ccccc1Br)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461408132 567734298 /nfs/dbraw/zinc/73/42/98/567734298.db2.gz SAGJMSKMXQLEDD-UHFFFAOYSA-N 0 0 377.194 3.392 20 5 GGBDRN O=C(c1ccc(Br)c(O)c1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461407701 567734652 /nfs/dbraw/zinc/73/46/52/567734652.db2.gz QKWQEXPUWYRWCT-UHFFFAOYSA-N 0 0 393.193 3.098 20 5 GGBDRN O=C(c1sccc1Br)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461415060 567735782 /nfs/dbraw/zinc/73/57/82/567735782.db2.gz VSXIGKMMUQFWRG-UHFFFAOYSA-N 0 0 383.223 3.454 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1ccc(F)cc1F ZINC000554587483 567737297 /nfs/dbraw/zinc/73/72/97/567737297.db2.gz ZFBZVLLHYGRWLJ-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C)[C@@H]1CCO ZINC000598066364 567737560 /nfs/dbraw/zinc/73/75/60/567737560.db2.gz DCEMFUKWBQFGEH-BMIGLBTASA-N 0 0 385.258 3.289 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@@H]3CO[C@@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000573805554 567737721 /nfs/dbraw/zinc/73/77/21/567737721.db2.gz ZLSPQMYIVQOJBL-JQWIXIFHSA-N 0 0 379.463 3.418 20 5 GGBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)NC(=O)CS2 ZINC000508238914 567739605 /nfs/dbraw/zinc/73/96/05/567739605.db2.gz IIKDBORBDMMXPS-UHFFFAOYSA-N 0 0 375.431 3.370 20 5 GGBDRN O=C1N[C@@H](c2ccc(Br)cc2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000554663607 567740659 /nfs/dbraw/zinc/74/06/59/567740659.db2.gz HSUYWBGTZALSAJ-ZDUSSCGKSA-N 0 0 376.166 3.155 20 5 GGBDRN C[C@H](O)CN(Cc1ccccc1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000532898332 567742189 /nfs/dbraw/zinc/74/21/89/567742189.db2.gz JBNNQLVQEXDFAM-LBPRGKRZSA-N 0 0 393.237 3.381 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000573897719 567743463 /nfs/dbraw/zinc/74/34/63/567743463.db2.gz BKENVPPUSQYTOL-CYBMUJFWSA-N 0 0 399.881 3.199 20 5 GGBDRN COC(=O)c1ccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)s1 ZINC000461689781 567743552 /nfs/dbraw/zinc/74/35/52/567743552.db2.gz ZGLLWMREXNUOGL-HNNXBMFYSA-N 0 0 378.431 3.331 20 5 GGBDRN COC(=O)c1cccc(CCNc2ncc(Br)cc2[N+](=O)[O-])c1 ZINC000508354726 567744900 /nfs/dbraw/zinc/74/49/00/567744900.db2.gz MYXIYWAZDJQNDW-UHFFFAOYSA-N 0 0 380.198 3.194 20 5 GGBDRN C[C@@H]1CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Br)C[C@@H](C)S1 ZINC000532968621 567745946 /nfs/dbraw/zinc/74/59/46/567745946.db2.gz JYUMPWCSFBIBFL-NXEZZACHSA-N 0 0 388.287 3.122 20 5 GGBDRN CC1(c2cccc(Br)c2)CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 ZINC000508368929 567746433 /nfs/dbraw/zinc/74/64/33/567746433.db2.gz ICVJSBBQNIWAIE-UHFFFAOYSA-N 0 0 392.257 3.118 20 5 GGBDRN O=C(Cc1cscc1Br)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000573943194 567746533 /nfs/dbraw/zinc/74/65/33/567746533.db2.gz BDEGFYBONOCWAR-UHFFFAOYSA-N 0 0 397.250 3.383 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1c(C2CC2)cnn1C ZINC000598210513 567747010 /nfs/dbraw/zinc/74/70/10/567747010.db2.gz GKTHSSREQBSONE-UHFFFAOYSA-N 0 0 393.241 3.207 20 5 GGBDRN COC(=O)[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000533054765 567748817 /nfs/dbraw/zinc/74/88/17/567748817.db2.gz POEWNLVBIAZOEB-OAHLLOKOSA-N 0 0 379.210 3.361 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(I)c1C)C1CC1 ZINC000598232053 567749725 /nfs/dbraw/zinc/74/97/25/567749725.db2.gz DKZAJLLDJXXDCG-ZDUSSCGKSA-N 0 0 388.205 3.426 20 5 GGBDRN CC1(C)CN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)c2cc(Br)ccc21 ZINC000598232940 567749923 /nfs/dbraw/zinc/74/99/23/567749923.db2.gz IMPUTJFUFHEOHZ-UHFFFAOYSA-N 0 0 392.209 3.396 20 5 GGBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(I)c1C)C1CC1 ZINC000598232044 567750059 /nfs/dbraw/zinc/75/00/59/567750059.db2.gz DKZAJLLDJXXDCG-CYBMUJFWSA-N 0 0 388.205 3.426 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1ncccc1N(C)C ZINC000574008273 567750210 /nfs/dbraw/zinc/75/02/10/567750210.db2.gz QTGGCXISUWYZPH-UHFFFAOYSA-N 0 0 393.241 3.057 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CCN(c2ccccc2F)C1 ZINC000461882937 567750740 /nfs/dbraw/zinc/75/07/40/567750740.db2.gz IVUBGONWNDXQLB-LLVKDONJSA-N 0 0 395.232 3.252 20 5 GGBDRN C[C@H]1CCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000461859732 567750843 /nfs/dbraw/zinc/75/08/43/567750843.db2.gz UKCQCEZDWRMLIU-VHSXEESVSA-N 0 0 377.260 3.072 20 5 GGBDRN O=C(c1cccc(F)c1Br)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000508487816 567751125 /nfs/dbraw/zinc/75/11/25/567751125.db2.gz HOTYPWMGUGANOB-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)CCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000461874874 567751304 /nfs/dbraw/zinc/75/13/04/567751304.db2.gz CQPSBUSRNOOARB-UHFFFAOYSA-N 0 0 384.479 3.192 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1Br ZINC000554846836 567752833 /nfs/dbraw/zinc/75/28/33/567752833.db2.gz JWZCNGRLWMGEMX-UHFFFAOYSA-N 0 0 392.253 3.470 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(Cl)c1 ZINC000574072828 567753298 /nfs/dbraw/zinc/75/32/98/567753298.db2.gz MKZNCBUGJKTJSM-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN COC(=O)c1cc(Br)cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000461922848 567754483 /nfs/dbraw/zinc/75/44/83/567754483.db2.gz XDOMGHJUECPHHR-UHFFFAOYSA-N 0 0 393.193 3.074 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])c1 ZINC000574093529 567754641 /nfs/dbraw/zinc/75/46/41/567754641.db2.gz HSHXPCFJGGTKHI-SNVBAGLBSA-N 0 0 387.870 3.317 20 5 GGBDRN Cc1nc(CS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)s1 ZINC000443399163 567755288 /nfs/dbraw/zinc/75/52/88/567755288.db2.gz LIWOOOPIVAPXJP-UHFFFAOYSA-N 0 0 391.268 3.405 20 5 GGBDRN CCC1CCC(N(CCO)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000554911742 567755556 /nfs/dbraw/zinc/75/55/56/567755556.db2.gz IXVSSIHYHQSVLP-UHFFFAOYSA-N 0 0 390.889 3.200 20 5 GGBDRN C[C@H]1CC(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000554910941 567755573 /nfs/dbraw/zinc/75/55/73/567755573.db2.gz OWKLPFFMYNLIGV-QWRGUYRKSA-N 0 0 376.862 3.120 20 5 GGBDRN C[C@H]1COC(C)(C)CN1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000554935478 567757469 /nfs/dbraw/zinc/75/74/69/567757469.db2.gz PSAOCDGULWMYJY-JTQLQIEISA-N 0 0 390.221 3.199 20 5 GGBDRN CN(Cc1cccc(O)c1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000533184930 567757410 /nfs/dbraw/zinc/75/74/10/567757410.db2.gz WMOFJMRECOOHDB-UHFFFAOYSA-N 0 0 379.210 3.264 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3cc(F)cc(Br)c3)no2)c1[N+](=O)[O-] ZINC000508596607 567757541 /nfs/dbraw/zinc/75/75/41/567757541.db2.gz TZLGNUBPKOGVNL-UHFFFAOYSA-N 0 0 396.176 3.179 20 5 GGBDRN CN(Cc1cccc(Cl)c1Cl)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000533199979 567759437 /nfs/dbraw/zinc/75/94/37/567759437.db2.gz GMABSMFEDSJRCS-UHFFFAOYSA-N 0 0 376.221 3.117 20 5 GGBDRN CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1cccc(Br)c1 ZINC000533251361 567761381 /nfs/dbraw/zinc/76/13/81/567761381.db2.gz MGOHOXLFEWNQMS-UHFFFAOYSA-N 0 0 392.253 3.452 20 5 GGBDRN CO[C@H](CNC(=O)c1sc(Br)cc1[N+](=O)[O-])C1CCCC1 ZINC000598392461 567761441 /nfs/dbraw/zinc/76/14/41/567761441.db2.gz FDCHILPJDMCJOY-SNVBAGLBSA-N 0 0 377.260 3.354 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2cccc(F)c2Cl)cc1[N+](=O)[O-] ZINC000555014704 567762548 /nfs/dbraw/zinc/76/25/48/567762548.db2.gz KNRCNZHLPBDVNY-UHFFFAOYSA-N 0 0 387.820 3.250 20 5 GGBDRN COc1ccc(CNCc2cn3ccc(Br)cc3n2)cc1[N+](=O)[O-] ZINC000574202612 567762659 /nfs/dbraw/zinc/76/26/59/567762659.db2.gz GZQRCIKZCRDCLD-UHFFFAOYSA-N 0 0 391.225 3.303 20 5 GGBDRN CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1 ZINC000443511049 567764287 /nfs/dbraw/zinc/76/42/87/567764287.db2.gz RQZUAGUYTIGWIZ-JTQLQIEISA-N 0 0 380.392 3.069 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2ccccc2Cn2cncn2)c(Br)c1 ZINC000508790835 567766180 /nfs/dbraw/zinc/76/61/80/567766180.db2.gz LBKLYQZPFMUPJG-UHFFFAOYSA-N 0 0 389.213 3.004 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](CC)Cc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000598426424 567766280 /nfs/dbraw/zinc/76/62/80/567766280.db2.gz AIUQUIYTISBYTO-LBPRGKRZSA-N 0 0 395.257 3.394 20 5 GGBDRN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1cccc(O)c1 ZINC000533383363 567766574 /nfs/dbraw/zinc/76/65/74/567766574.db2.gz JYTUQMQNFGENSV-UHFFFAOYSA-N 0 0 380.198 3.138 20 5 GGBDRN COc1cncc(COc2ccc(I)cc2[N+](=O)[O-])c1 ZINC000574265137 567768507 /nfs/dbraw/zinc/76/85/07/567768507.db2.gz JINVXMFYVORYGH-UHFFFAOYSA-N 0 0 386.145 3.182 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCN2S(=O)(=O)c1ccc(C(F)(F)F)s1 ZINC000462082857 567768846 /nfs/dbraw/zinc/76/88/46/567768846.db2.gz FVBJAEOZHKXYTL-UHFFFAOYSA-N 0 0 378.353 3.427 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1ccc(C(F)(F)F)s1 ZINC000462088322 567770143 /nfs/dbraw/zinc/77/01/43/567770143.db2.gz HFENUAUNPCIHST-UHFFFAOYSA-N 0 0 395.384 3.066 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NCC(C)(C)c1ccccc1Br ZINC000533443239 567770248 /nfs/dbraw/zinc/77/02/48/567770248.db2.gz PDADAGHAVXMSQZ-UHFFFAOYSA-N 0 0 380.242 3.403 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1csc2ccccc21 ZINC000508859453 567770376 /nfs/dbraw/zinc/77/03/76/567770376.db2.gz YSBNDKZUIXTXCY-UHFFFAOYSA-N 0 0 377.447 3.200 20 5 GGBDRN CCOC(=O)[C@@]1(C)CCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000598484665 567771003 /nfs/dbraw/zinc/77/10/03/567771003.db2.gz NKWMJVDBZFHOTC-BBRMVZONSA-N 0 0 399.241 3.209 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccc(C(F)(F)F)s1)CC2 ZINC000462096919 567771012 /nfs/dbraw/zinc/77/10/12/567771012.db2.gz MHMBOJUYEZXUBQ-UHFFFAOYSA-N 0 0 378.353 3.427 20 5 GGBDRN CC[C@H](Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1 ZINC000555135603 567771570 /nfs/dbraw/zinc/77/15/70/567771570.db2.gz LPIXPCNXZOMAAA-CYBMUJFWSA-N 0 0 383.857 3.329 20 5 GGBDRN CCOC(=O)[C@@]1(C)CCC[C@H]1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000598479128 567771682 /nfs/dbraw/zinc/77/16/82/567771682.db2.gz CWACZSJTRSIMSG-CJNGLKHVSA-N 0 0 399.241 3.209 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3ncc([N+](=O)[O-])c(C)c3Br)[C@H]2C1 ZINC000574359882 567773415 /nfs/dbraw/zinc/77/34/15/567773415.db2.gz XOIAKKPRSXTORG-AVGNSLFASA-N 0 0 397.273 3.120 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@@H](Nc3ncc([N+](=O)[O-])c(C)c3Br)[C@@H]2C1 ZINC000574359885 567773507 /nfs/dbraw/zinc/77/35/07/567773507.db2.gz XOIAKKPRSXTORG-YNEHKIRRSA-N 0 0 397.273 3.120 20 5 GGBDRN Cc1cc(N2CCC[C@@H](CS(C)(=O)=O)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555210020 567773811 /nfs/dbraw/zinc/77/38/11/567773811.db2.gz RUEDFOBMLISNNP-LLVKDONJSA-N 0 0 380.388 3.183 20 5 GGBDRN Cc1cnn([C@H]2CCN(c3ccc(I)cc3[N+](=O)[O-])C2)c1 ZINC000555208957 567774057 /nfs/dbraw/zinc/77/40/57/567774057.db2.gz ZPWLKSJPQDYODO-LBPRGKRZSA-N 0 0 398.204 3.156 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CCN2S(=O)(=O)Cc1ccccc1Br ZINC000555193992 567774209 /nfs/dbraw/zinc/77/42/09/567774209.db2.gz KDVFDAWIWCCFDG-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN CN(CCc1cccc(Br)c1)c1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000462111973 567774582 /nfs/dbraw/zinc/77/45/82/567774582.db2.gz LIROYRDHXSKHCL-UHFFFAOYSA-N 0 0 378.226 3.135 20 5 GGBDRN CN(C[C@H]1CC1(C)C)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000598551458 567775809 /nfs/dbraw/zinc/77/58/09/567775809.db2.gz SMSYGPQQVNXYMA-SNVBAGLBSA-N 0 0 388.205 3.318 20 5 GGBDRN CCn1cc(CN(C)C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cn1 ZINC000533575168 567776465 /nfs/dbraw/zinc/77/64/65/567776465.db2.gz RLGCUWXLLCDDRQ-UHFFFAOYSA-N 0 0 381.230 3.154 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC2(c3nccs3)CCCC2)c(C)c1[N+](=O)[O-] ZINC000598603851 567778629 /nfs/dbraw/zinc/77/86/29/567778629.db2.gz KRPCLDLMILWNRE-UHFFFAOYSA-N 0 0 381.479 3.416 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](C)CC(=O)c2cccs2)c(C)c1[N+](=O)[O-] ZINC000598605552 567778683 /nfs/dbraw/zinc/77/86/83/567778683.db2.gz FSURKLHWPJFGLP-LLVKDONJSA-N 0 0 382.463 3.213 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](C)CC(=O)c2cccs2)c(C)c1[N+](=O)[O-] ZINC000598605555 567778818 /nfs/dbraw/zinc/77/88/18/567778818.db2.gz FSURKLHWPJFGLP-NSHDSACASA-N 0 0 382.463 3.213 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCSC[C@H]2c2nccs2)c(C)c1[N+](=O)[O-] ZINC000598605412 567779010 /nfs/dbraw/zinc/77/90/10/567779010.db2.gz ANERVUDQVPNLDX-LBPRGKRZSA-N 0 0 399.519 3.147 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCN2S(=O)(=O)Cc1ccccc1Br ZINC000574474211 567780086 /nfs/dbraw/zinc/78/00/86/567780086.db2.gz KICRAQXUDDSQHO-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000533716416 567783826 /nfs/dbraw/zinc/78/38/26/567783826.db2.gz IJKRMQUYZDLUAR-VIFPVBQESA-N 0 0 396.216 3.440 20 5 GGBDRN Cc1ccccc1OC[C@@H](O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000533708051 567783914 /nfs/dbraw/zinc/78/39/14/567783914.db2.gz MEZPXCYGIPVMFZ-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN COC(=O)c1cc(C)nc(Sc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000574541395 567783944 /nfs/dbraw/zinc/78/39/44/567783944.db2.gz KDQXCMMCKBDQNM-UHFFFAOYSA-N 0 0 384.211 3.394 20 5 GGBDRN CC[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H](C)S1(=O)=O ZINC000555527596 567786624 /nfs/dbraw/zinc/78/66/24/567786624.db2.gz IMQBKOQHHKJGMW-MFKMUULPSA-N 0 0 380.388 3.011 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N[C@@H](CO)CC(F)(F)F ZINC000533783635 567787409 /nfs/dbraw/zinc/78/74/09/567787409.db2.gz XGPNXPTYDLFAAK-MRVPVSSYSA-N 0 0 394.147 3.053 20 5 GGBDRN O=[N+]([O-])c1ccccc1CNS(=O)(=O)c1ccc(C(F)(F)F)cc1F ZINC000444062279 567787597 /nfs/dbraw/zinc/78/75/97/567787597.db2.gz KAIZLRXLIGLPMO-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN C[S@](=O)[C@@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000598754073 567787720 /nfs/dbraw/zinc/78/77/20/567787720.db2.gz NSHAOUAKHALPIC-CFUNISHFSA-N 0 0 378.372 3.033 20 5 GGBDRN Cc1cc(Br)cc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000444060353 567787961 /nfs/dbraw/zinc/78/79/61/567787961.db2.gz YIPCKYFUZPTPLS-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN C[S@](=O)[C@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000598754076 567788686 /nfs/dbraw/zinc/78/86/86/567788686.db2.gz NSHAOUAKHALPIC-ULCYMTDVSA-N 0 0 378.372 3.033 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)COc1cccc(Br)c1 ZINC000555565385 567789322 /nfs/dbraw/zinc/78/93/22/567789322.db2.gz YQWOREYIWCURSU-CQSZACIVSA-N 0 0 382.210 3.484 20 5 GGBDRN Cc1cccc(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1Br ZINC000533847790 567789800 /nfs/dbraw/zinc/78/98/00/567789800.db2.gz ARWLZHUTGHJBFC-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN C[C@H]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000533880890 567791887 /nfs/dbraw/zinc/79/18/87/567791887.db2.gz LZMXWLLSEBERJH-VHSXEESVSA-N 0 0 388.205 3.365 20 5 GGBDRN C[C@@H]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000533880891 567791964 /nfs/dbraw/zinc/79/19/64/567791964.db2.gz LZMXWLLSEBERJH-ZJUUUORDSA-N 0 0 388.205 3.365 20 5 GGBDRN Cc1nc(NC(=O)c2nn(C(C)(C)C)cc2Br)ccc1[N+](=O)[O-] ZINC000598822836 567792352 /nfs/dbraw/zinc/79/23/52/567792352.db2.gz IKGUIEPLHFORHF-UHFFFAOYSA-N 0 0 382.218 3.265 20 5 GGBDRN C[C@H](Cc1c(Cl)cccc1Cl)NS(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000533909335 567792661 /nfs/dbraw/zinc/79/26/61/567792661.db2.gz TUCXKEAKQNKEOL-SECBINFHSA-N 0 0 390.248 3.206 20 5 GGBDRN C[C@@H](Cc1c(Cl)cccc1Cl)NS(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000533909339 567792700 /nfs/dbraw/zinc/79/27/00/567792700.db2.gz TUCXKEAKQNKEOL-VIFPVBQESA-N 0 0 390.248 3.206 20 5 GGBDRN CN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(Br)cn1 ZINC000533999850 567796033 /nfs/dbraw/zinc/79/60/33/567796033.db2.gz JRDAZEQKEPJRFJ-UHFFFAOYSA-N 0 0 389.209 3.439 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)CC2 ZINC000598940144 567798660 /nfs/dbraw/zinc/79/86/60/567798660.db2.gz MWGMOUQZVMTIEY-UHFFFAOYSA-N 0 0 376.210 3.193 20 5 GGBDRN CC(C)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000444276067 567800090 /nfs/dbraw/zinc/80/00/90/567800090.db2.gz LJGSZSJHMIHOQS-LLVKDONJSA-N 0 0 391.287 3.414 20 5 GGBDRN C[C@](CO)(NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000444323097 567802119 /nfs/dbraw/zinc/80/21/19/567802119.db2.gz ZWUAEKVPIIOAHX-MRXNPFEDSA-N 0 0 385.258 3.418 20 5 GGBDRN COc1ccc(CNCc2cc(Br)cnc2OC)cc1[N+](=O)[O-] ZINC000599003768 567802664 /nfs/dbraw/zinc/80/26/64/567802664.db2.gz OBXLCTOTIVVKHR-UHFFFAOYSA-N 0 0 382.214 3.059 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000599019809 567803186 /nfs/dbraw/zinc/80/31/86/567803186.db2.gz HTOHMWHVHBNQNI-UHFFFAOYSA-N 0 0 399.241 3.163 20 5 GGBDRN COc1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cc1O ZINC000574905657 567803939 /nfs/dbraw/zinc/80/39/39/567803939.db2.gz TWXFTCJOBGFIGX-UHFFFAOYSA-N 0 0 395.209 3.310 20 5 GGBDRN CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CCSc2ccc(Br)cc21 ZINC000574905695 567804120 /nfs/dbraw/zinc/80/41/20/567804120.db2.gz XJZHZHSWUMYAEB-LLVKDONJSA-N 0 0 397.254 3.390 20 5 GGBDRN O=C(Nc1ccncc1Br)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000534237360 567804380 /nfs/dbraw/zinc/80/43/80/567804380.db2.gz RBMPRTWZXZISFE-UHFFFAOYSA-N 0 0 377.198 3.001 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CC[C@H](Oc3cncc(Br)c3)C2)c(Cl)c1 ZINC000599108046 567805625 /nfs/dbraw/zinc/80/56/25/567805625.db2.gz QFCXYBKBFWVMFA-NSHDSACASA-N 0 0 399.632 3.458 20 5 GGBDRN Cn1cc([C@H]2C[C@@H](Nc3c(Br)cccc3[N+](=O)[O-])CCO2)cn1 ZINC000599106330 567805717 /nfs/dbraw/zinc/80/57/17/567805717.db2.gz FLWZTWGKOAOCPQ-SMDDNHRTSA-N 0 0 381.230 3.423 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CC[C@@H](Oc3cncc(Br)c3)C2)c(Cl)c1 ZINC000599108045 567805784 /nfs/dbraw/zinc/80/57/84/567805784.db2.gz QFCXYBKBFWVMFA-LLVKDONJSA-N 0 0 399.632 3.458 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H](Oc2cncc(Br)c2)C1 ZINC000599108901 567805845 /nfs/dbraw/zinc/80/58/45/567805845.db2.gz ZXAZSWFNVPANCE-CYBMUJFWSA-N 0 0 379.214 3.113 20 5 GGBDRN C[C@@H]1CN(c2c(I)cncc2[N+](=O)[O-])C[C@@H](C)C1(F)F ZINC000599116939 567806533 /nfs/dbraw/zinc/80/65/33/567806533.db2.gz HABCQXVFUBCRLF-HTQZYQBOSA-N 0 0 397.163 3.322 20 5 GGBDRN O=C(Nc1ccc(OC2COC2)cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000444530824 567807490 /nfs/dbraw/zinc/80/74/90/567807490.db2.gz DXLXRSNUAYIRAX-UHFFFAOYSA-N 0 0 393.193 3.387 20 5 GGBDRN C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599152102 567807833 /nfs/dbraw/zinc/80/78/33/567807833.db2.gz FMOSJDLIPWIXGQ-FRRDWIJNSA-N 0 0 398.301 3.454 20 5 GGBDRN C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599152429 567807947 /nfs/dbraw/zinc/80/79/47/567807947.db2.gz FMOSJDLIPWIXGQ-XQQFMLRXSA-N 0 0 398.301 3.454 20 5 GGBDRN CCn1c2ccc(Br)cc2nc1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000534347890 567808472 /nfs/dbraw/zinc/80/84/72/567808472.db2.gz DMLGSWKGSJJXKA-UHFFFAOYSA-N 0 0 392.213 3.318 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Br)c(F)c1 ZINC000444631141 567809346 /nfs/dbraw/zinc/80/93/46/567809346.db2.gz KGOPTZQMABTNFJ-UHFFFAOYSA-N 0 0 393.172 3.303 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1Br ZINC000444643444 567809389 /nfs/dbraw/zinc/80/93/89/567809389.db2.gz VZCGCADHHWQVCJ-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN COCc1cc(Cl)cc(S(=O)(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000575030102 567809423 /nfs/dbraw/zinc/80/94/23/567809423.db2.gz XQYWDFHYIQPXOJ-UHFFFAOYSA-N 0 0 382.825 3.146 20 5 GGBDRN O=C(Cc1cccc(Br)c1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444635273 567809685 /nfs/dbraw/zinc/80/96/85/567809685.db2.gz KIVOKTSLMSCSIL-UHFFFAOYSA-N 0 0 389.209 3.093 20 5 GGBDRN CC(C)[C@@H]1CCCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000575030325 567809696 /nfs/dbraw/zinc/80/96/96/567809696.db2.gz UJWLYZYMPYJULD-LLVKDONJSA-N 0 0 398.257 3.190 20 5 GGBDRN COC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Br)Cc2ccccc21 ZINC000599188289 567809995 /nfs/dbraw/zinc/80/99/95/567809995.db2.gz PKUPPVSKJQIMFG-CYBMUJFWSA-N 0 0 392.209 3.029 20 5 GGBDRN Cc1nc(C(C)C)sc1[C@@H](C)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000534413146 567810712 /nfs/dbraw/zinc/81/07/12/567810712.db2.gz XHLPHENJUFVGAE-LLVKDONJSA-N 0 0 384.483 3.260 20 5 GGBDRN CC(C)CSCCCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] ZINC000534423432 567811411 /nfs/dbraw/zinc/81/14/11/567811411.db2.gz RHPMKNYGBNRBSK-UHFFFAOYSA-N 0 0 375.516 3.036 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC(=O)Nc2ccc(Br)cc21 ZINC000534468374 567812954 /nfs/dbraw/zinc/81/29/54/567812954.db2.gz BSTZCNCXTMALPD-UHFFFAOYSA-N 0 0 394.156 3.095 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCCOc2ncc(C(F)(F)F)cc2Cl)nc1 ZINC000534499888 567813297 /nfs/dbraw/zinc/81/32/97/567813297.db2.gz HJBWPTJTOLNSDP-UHFFFAOYSA-N 0 0 376.722 3.360 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCCCCC2)nc1 ZINC000048261596 570224706 /nfs/dbraw/zinc/22/47/06/570224706.db2.gz BZAZLIPARWJTFW-UHFFFAOYSA-N 0 0 384.436 3.309 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)NC1CCCCC1 ZINC000006064781 570232824 /nfs/dbraw/zinc/23/28/24/570232824.db2.gz ZQNZLPKNEQZUKO-CQSZACIVSA-N 0 0 389.452 3.189 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1ccc2[nH]cnc2c1)c1ccccc1[N+](=O)[O-] ZINC000010737633 570289049 /nfs/dbraw/zinc/28/90/49/570289049.db2.gz DCVIVFPOTHQXDK-MRXNPFEDSA-N 0 0 396.403 3.284 20 5 GGBDRN CC[C@@H](C)[C@H](C(=O)OCc1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O ZINC000024754690 570289989 /nfs/dbraw/zinc/28/99/89/570289989.db2.gz VBDIPNFYUAFAEU-FZKQIMNGSA-N 0 0 396.399 3.349 20 5 GGBDRN Cc1cc(C(=O)NCCCc2cc(N)n(-c3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000024797535 570297307 /nfs/dbraw/zinc/29/73/07/570297307.db2.gz DLWFSXNIYQFWIK-UHFFFAOYSA-N 0 0 379.420 3.034 20 5 GGBDRN COc1cc(C(=O)Nc2ccc3c(c2)OCO3)c([N+](=O)[O-])cc1OC(F)F ZINC000010808705 570302654 /nfs/dbraw/zinc/30/26/54/570302654.db2.gz QVZLGFMVSYTUAD-UHFFFAOYSA-N 0 0 382.275 3.186 20 5 GGBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@@H]1Cc2ccccc2C(=O)O1 ZINC000014227674 570302690 /nfs/dbraw/zinc/30/26/90/570302690.db2.gz IKASJVUNOGMNDH-INIZCTEOSA-N 0 0 395.396 3.439 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@@H](c3nc4ccccc4[nH]3)C2)cc1[N+](=O)[O-] ZINC000010544573 570318551 /nfs/dbraw/zinc/31/85/51/570318551.db2.gz LJDKAWHUTGXOLQ-CQSZACIVSA-N 0 0 380.404 3.500 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCc1cccnc1 ZINC000006214082 570342768 /nfs/dbraw/zinc/34/27/68/570342768.db2.gz ABDRWVXMRXKUCY-UHFFFAOYSA-N 0 0 384.417 3.403 20 5 GGBDRN O=C(CCc1c[nH]c2ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000004901056 570360252 /nfs/dbraw/zinc/36/02/52/570360252.db2.gz NKNBNOMQZTZVMW-UHFFFAOYSA-N 0 0 378.432 3.358 20 5 GGBDRN O=C(COC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 ZINC000005044005 570405296 /nfs/dbraw/zinc/40/52/96/570405296.db2.gz OOCOFAYXQGTXKW-UHFFFAOYSA-N 0 0 377.736 3.059 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)Nc2ncccc2[N+](=O)[O-])cc1 ZINC000024153447 570463416 /nfs/dbraw/zinc/46/34/16/570463416.db2.gz CDXUTXHMODGPSJ-CYBMUJFWSA-N 0 0 378.454 3.193 20 5 GGBDRN CN(CCOc1ccccc1F)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000024213989 570479036 /nfs/dbraw/zinc/47/90/36/570479036.db2.gz JTAAJDAWKXHLBP-UHFFFAOYSA-N 0 0 387.411 3.485 20 5 GGBDRN O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000006602261 570492267 /nfs/dbraw/zinc/49/22/67/570492267.db2.gz XDGCGGTUARSZLB-UHFFFAOYSA-N 0 0 393.421 3.005 20 5 GGBDRN COCCCn1c(C)cc(C(=O)COc2ccc(OC)cc2[N+](=O)[O-])c1C ZINC000006602868 570493877 /nfs/dbraw/zinc/49/38/77/570493877.db2.gz OXZRLQGCMPKOGK-UHFFFAOYSA-N 0 0 376.409 3.320 20 5 GGBDRN CCC(=O)c1ccc(OC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 ZINC000005199333 570500463 /nfs/dbraw/zinc/50/04/63/570500463.db2.gz HKHZBVBNCRHXBP-UHFFFAOYSA-N 0 0 384.388 3.243 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccc(N(C)C)cc2)no1 ZINC000036000493 570506468 /nfs/dbraw/zinc/50/64/68/570506468.db2.gz CMWTUCCDEUATCE-LBPRGKRZSA-N 0 0 381.392 3.202 20 5 GGBDRN CN(C[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC(C)(C)C ZINC000078935100 570510164 /nfs/dbraw/zinc/51/01/64/570510164.db2.gz NSHLTDBYWYDMOR-CYBMUJFWSA-N 0 0 381.404 3.205 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCCN1CCCC[C@@H]1c1nnc([C@H]2CCCO2)o1 ZINC000286057613 570552398 /nfs/dbraw/zinc/55/23/98/570552398.db2.gz CICRLJCAPQDGBL-NVXWUHKLSA-N 0 0 388.424 3.435 20 5 GGBDRN CNc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000005363649 570564220 /nfs/dbraw/zinc/56/42/20/570564220.db2.gz QNAGCIQGINTWDJ-KYEXWDHISA-N 0 0 377.441 3.123 20 5 GGBDRN Cc1sc2ncn(CC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c(=O)c2c1C ZINC000022985218 570614660 /nfs/dbraw/zinc/61/46/60/570614660.db2.gz HBHISLLKTXWMKJ-UHFFFAOYSA-N 0 0 392.824 3.275 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC[C@H](C(F)(F)F)C1 ZINC000036389911 570671423 /nfs/dbraw/zinc/67/14/23/570671423.db2.gz FXAMDOVJVBRSEN-MNOVXSKESA-N 0 0 375.347 3.205 20 5 GGBDRN C[C@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N(C)Cc1ccccc1 ZINC000005656288 570680048 /nfs/dbraw/zinc/68/00/48/570680048.db2.gz QGSRMUUWMIMAEZ-LBPRGKRZSA-N 0 0 376.796 3.452 20 5 GGBDRN CCN(c1ccccc1)S(=O)(=O)c1ccc(Nc2cn[nH]c2)c([N+](=O)[O-])c1 ZINC000036398130 570682812 /nfs/dbraw/zinc/68/28/12/570682812.db2.gz BADUNXDIJPVYQD-UHFFFAOYSA-N 0 0 387.421 3.277 20 5 GGBDRN O=C(COC(=O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000006889539 570683429 /nfs/dbraw/zinc/68/34/29/570683429.db2.gz ABEUODIXVVFUQL-UHFFFAOYSA-N 0 0 384.266 3.289 20 5 GGBDRN COc1ccc(OC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1 ZINC000007000314 570732110 /nfs/dbraw/zinc/73/21/10/570732110.db2.gz ZHZXULMDJXQNIJ-UHFFFAOYSA-N 0 0 386.389 3.102 20 5 GGBDRN COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2Cl)c([N+](=O)[O-])c1 ZINC000005670296 570776378 /nfs/dbraw/zinc/77/63/78/570776378.db2.gz IQHHPVRREVBZKS-UHFFFAOYSA-N 0 0 381.728 3.183 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C ZINC000007079435 570783073 /nfs/dbraw/zinc/78/30/73/570783073.db2.gz CVSPWNRICBWTNX-QWHCGFSZSA-N 0 0 384.388 3.127 20 5 GGBDRN COC(=O)CCSc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000007156802 570806005 /nfs/dbraw/zinc/80/60/05/570806005.db2.gz WYBDJCOWPDFAMI-UHFFFAOYSA-N 0 0 396.446 3.051 20 5 GGBDRN COc1cccc(OC)c1C(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000007184450 570812343 /nfs/dbraw/zinc/81/23/43/570812343.db2.gz GYCWQRHWPUIUPQ-UHFFFAOYSA-N 0 0 394.767 3.061 20 5 GGBDRN O=C(CCNC(=O)c1ccc2ccccc2c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000032796537 570818596 /nfs/dbraw/zinc/81/85/96/570818596.db2.gz IPDCSDDNFUDJBZ-UHFFFAOYSA-N 0 0 389.411 3.457 20 5 GGBDRN NC(=O)c1ccc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)c([N+](=O)[O-])c1 ZINC000007238994 570819990 /nfs/dbraw/zinc/81/99/90/570819990.db2.gz LIFKXBODIKEQDV-UHFFFAOYSA-N 0 0 394.353 3.039 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)OC(=O)c2cc3c(s2)CCC3)c([N+](=O)[O-])c1 ZINC000007257658 570821652 /nfs/dbraw/zinc/82/16/52/570821652.db2.gz UIDJLIAMGSUKPS-JTQLQIEISA-N 0 0 390.417 3.338 20 5 GGBDRN CCN1C[C@@H](CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)Oc2ccccc21 ZINC000007257343 570821723 /nfs/dbraw/zinc/82/17/23/570821723.db2.gz XBTFSSTYEVMCCS-MRXNPFEDSA-N 0 0 398.463 3.020 20 5 GGBDRN C[C@@H](OC(=O)c1cccc(N2CC=CC2)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000101440605 570823106 /nfs/dbraw/zinc/82/31/06/570823106.db2.gz XCTHTAASDBGCEY-CQSZACIVSA-N 0 0 381.388 3.155 20 5 GGBDRN COc1cccc([C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)c2nccn2C)c1 ZINC000012507640 570823236 /nfs/dbraw/zinc/82/32/36/570823236.db2.gz IREQHSQBGHWIAM-KRWDZBQOSA-N 0 0 381.392 3.248 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1nccn1C ZINC000012507623 570823244 /nfs/dbraw/zinc/82/32/44/570823244.db2.gz NKCRLAWUIJPSHM-KRWDZBQOSA-N 0 0 381.392 3.248 20 5 GGBDRN CC(C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1 ZINC000032829956 570844263 /nfs/dbraw/zinc/84/42/63/570844263.db2.gz 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COc1cc(C(=O)OCC(=O)Nc2cccc(C)c2C)c([N+](=O)[O-])cc1OC ZINC000003498346 570872924 /nfs/dbraw/zinc/87/29/24/570872924.db2.gz NTWOMFXSOPGWII-UHFFFAOYSA-N 0 0 388.376 3.024 20 5 GGBDRN CCOC(=O)C1=C(C)N(C2CC2)C(=O)N[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000007552481 570879358 /nfs/dbraw/zinc/87/93/58/570879358.db2.gz YJYWCNFVODWACK-HNNXBMFYSA-N 0 0 379.800 3.314 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H](O)[C@H](CO)Nc2ncc(C(F)(F)F)cc2Cl)cc1 ZINC000024527630 570887122 /nfs/dbraw/zinc/88/71/22/570887122.db2.gz UKEKRUWTNRFOOU-QWHCGFSZSA-N 0 0 391.733 3.168 20 5 GGBDRN COc1ccc(NC(=O)N2CCc3cc(OC)c(OC)cc3C2)c([N+](=O)[O-])c1 ZINC000032895413 570887152 /nfs/dbraw/zinc/88/71/52/570887152.db2.gz WJIKOKWDHCNLPE-UHFFFAOYSA-N 0 0 387.392 3.211 20 5 GGBDRN CNc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000104706769 570902559 /nfs/dbraw/zinc/90/25/59/570902559.db2.gz QNAGCIQGINTWDJ-RMRHIDDWSA-N 0 0 377.441 3.123 20 5 GGBDRN O=C(CCCc1cccs1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 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QJYLXWFZXRHUSF-UHFFFAOYSA-N 0 0 392.379 3.353 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N3CCC4(C3)CCCCC4)cc(-c3nn[nH]n3)c2c1 ZINC000823643829 599051257 /nfs/dbraw/zinc/05/12/57/599051257.db2.gz CJOAYOHWWIBYIR-UHFFFAOYSA-N 0 0 379.424 3.484 20 5 GGBDRN C[C@H](CCc1cccn1C)Nc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000820253293 599054281 /nfs/dbraw/zinc/05/42/81/599054281.db2.gz HSTZATWWDYMUQA-GFCCVEGCSA-N 0 0 392.423 3.095 20 5 GGBDRN Cc1ccc(N2CCC[C@H](Nc3ccc([N+](=O)[O-])cc3-c3nn[nH]n3)C2)cc1 ZINC000822242598 599065169 /nfs/dbraw/zinc/06/51/69/599065169.db2.gz QSJRYJNVZOPCEO-AWEZNQCLSA-N 0 0 379.424 3.164 20 5 GGBDRN O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])c1ccc(-c2nn[nH]n2)nc1 ZINC000738251047 599153091 /nfs/dbraw/zinc/15/30/91/599153091.db2.gz MDQHBVINICHMTD-UHFFFAOYSA-N 0 0 388.343 3.056 20 5 GGBDRN COc1ccc(OCCSc2ccc(-c3nn[nH]n3)cc2F)c([N+](=O)[O-])c1 ZINC000737111391 599169116 /nfs/dbraw/zinc/16/91/16/599169116.db2.gz LXYFRCUHVZLHPD-UHFFFAOYSA-N 0 0 391.384 3.094 20 5 GGBDRN Cc1c(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cccc1-c1nn[nH]n1 ZINC000822096991 607281094 /nfs/dbraw/zinc/28/10/94/607281094.db2.gz RWESAHZIIJQSKB-UHFFFAOYSA-N 0 0 395.423 3.228 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N[C@@H]3CCOc4ccccc43)cc(-c3nn[nH]n3)c2c1 ZINC000738367561 599260039 /nfs/dbraw/zinc/26/00/39/599260039.db2.gz VQUBOKBUMNFKGA-MRXNPFEDSA-N 0 0 389.375 3.259 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(NCCc3ccccc3F)cc(-c3nn[nH]n3)c2c1 ZINC000738366096 599260296 /nfs/dbraw/zinc/26/02/96/599260296.db2.gz CCVUWVPOLGUWOZ-UHFFFAOYSA-N 0 0 379.355 3.117 20 5 GGBDRN O=[N+]([O-])c1cc(NCCc2ccc(Br)s2)ccc1-c1nn[nH]n1 ZINC000826498312 607840958 /nfs/dbraw/zinc/84/09/58/607840958.db2.gz PGDTVQOSYFCTAI-UHFFFAOYSA-N 0 0 395.242 3.254 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(Oc3ccc(-c4nn[nH]n4)cc3Cl)cc2N1 ZINC000738302727 598236980 /nfs/dbraw/zinc/23/69/80/598236980.db2.gz NCZJXXFKXRNSML-UHFFFAOYSA-N 0 0 386.755 3.105 20 5 GGBDRN CC(C)CCOc1ccccc1CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000735820153 598246448 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RJQAPFJWNUQQKP-UHFFFAOYSA-N 0 0 397.729 3.037 20 5 GGBDRN O=C([O-])[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000739501272 599788846 /nfs/dbraw/zinc/78/88/46/599788846.db2.gz VNWLXYJDWYOZCJ-HNNXBMFYSA-N 0 0 379.210 3.315 20 5 GGBDRN O=C([O-])[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F ZINC000739499191 599792099 /nfs/dbraw/zinc/79/20/99/599792099.db2.gz GVSRDBBJPPCCEW-OAHLLOKOSA-N 0 0 384.310 3.408 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(OC(C)C)c(-c2nn[nH]n2)c1 ZINC000822270883 607401636 /nfs/dbraw/zinc/40/16/36/607401636.db2.gz BINAYGBCSORDCX-UHFFFAOYSA-N 0 0 382.380 3.123 20 5 GGBDRN Cc1cc(-c2nn[nH]n2)ccc1COC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000826252813 607404203 /nfs/dbraw/zinc/40/42/03/607404203.db2.gz SLOJQWBZEZENQT-UHFFFAOYSA-N 0 0 381.392 3.104 20 5 GGBDRN O=C([O-])c1cc(C(=O)NC[C@H]2CCC[N@@H+]2CC2CCCCC2)cc([N+](=O)[O-])c1 ZINC000740067124 599998135 /nfs/dbraw/zinc/99/81/35/599998135.db2.gz JREPVPXKMCCTPI-QGZVFWFLSA-N 0 0 389.452 3.068 20 5 GGBDRN C[NH+](C)C1CCN(c2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000737358950 600028822 /nfs/dbraw/zinc/02/88/22/600028822.db2.gz NUMUAJLOUAINJM-UHFFFAOYSA-N 0 0 397.431 3.054 20 5 GGBDRN C[NH+](C)[C@H](CNc1c(C(=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(F)c1 ZINC000737358054 600075152 /nfs/dbraw/zinc/07/51/52/600075152.db2.gz HLMNBRCKNQXDOO-OAHLLOKOSA-N 0 0 392.343 3.055 20 5 GGBDRN C[C@@]([NH2+]Cc1cccc([N+](=O)[O-])c1)(C(=O)[O-])c1cccc(Br)c1 ZINC000736663884 600078452 /nfs/dbraw/zinc/07/84/52/600078452.db2.gz GXWRHBFIQYFMCY-INIZCTEOSA-N 0 0 379.210 3.447 20 5 GGBDRN C[C@]([NH2+]Cc1cccc([N+](=O)[O-])c1)(C(=O)[O-])c1cccc(Br)c1 ZINC000736663885 600078614 /nfs/dbraw/zinc/07/86/14/600078614.db2.gz GXWRHBFIQYFMCY-MRXNPFEDSA-N 0 0 379.210 3.447 20 5 GGBDRN CC[C@]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)(C(=O)[O-])c1ccccc1 ZINC000736918687 600131692 /nfs/dbraw/zinc/13/16/92/600131692.db2.gz VWROZPVPDFLUKP-HXUWFJFHSA-N 0 0 385.420 3.212 20 5 GGBDRN CC[C@]([NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C)(C(=O)[O-])c1ccccc1 ZINC000736918636 600131704 /nfs/dbraw/zinc/13/17/04/600131704.db2.gz VNGYTYGLHMTYJK-HXUWFJFHSA-N 0 0 385.420 3.212 20 5 GGBDRN CC[C@@]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)(C(=O)[O-])c1ccccc1 ZINC000736918686 600131743 /nfs/dbraw/zinc/13/17/43/600131743.db2.gz VWROZPVPDFLUKP-FQEVSTJZSA-N 0 0 385.420 3.212 20 5 GGBDRN O=C([O-])c1cc(NC(=O)[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000740082066 600191845 /nfs/dbraw/zinc/19/18/45/600191845.db2.gz UKUFEMDUAOZMBA-HNNXBMFYSA-N 0 0 383.404 3.144 20 5 GGBDRN C[C@@H](CNc1c(C(=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000736606189 600239550 /nfs/dbraw/zinc/23/95/50/600239550.db2.gz ABZYSDIBCQNDMT-LBPRGKRZSA-N 0 0 388.380 3.134 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000736785355 600259769 /nfs/dbraw/zinc/25/97/69/600259769.db2.gz SDKLHGCOIHKKAM-HUUCEWRRSA-N 0 0 389.452 3.020 20 5 GGBDRN C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC000736815099 600692300 /nfs/dbraw/zinc/69/23/00/600692300.db2.gz NSINMEVQOKYNDF-HNNXBMFYSA-N 0 0 397.431 3.030 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000823629970 607467987 /nfs/dbraw/zinc/46/79/87/607467987.db2.gz OLRXCJQSQKDWJG-MAUKXSAKSA-N 0 0 398.398 3.007 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000823629969 607468251 /nfs/dbraw/zinc/46/82/51/607468251.db2.gz OLRXCJQSQKDWJG-CRAIPNDOSA-N 0 0 398.398 3.007 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)c(-c2nn[nH]n2)c1 ZINC000823640185 607468878 /nfs/dbraw/zinc/46/88/78/607468878.db2.gz WUSJQRYDHCWZMB-KBXCAEBGSA-N 0 0 398.398 3.007 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccccc1)C[C@@H](C)C(=O)[O-] ZINC000832905474 600993973 /nfs/dbraw/zinc/99/39/73/600993973.db2.gz NXXNCHQDPBVWAX-OAHLLOKOSA-N 0 0 385.420 3.065 20 5 GGBDRN C[C@H](C(=O)[O-])[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000826055033 601201676 /nfs/dbraw/zinc/20/16/76/601201676.db2.gz UTMYSOAKOKAAHV-GTNSWQLSSA-N 0 0 391.811 3.238 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000832958502 601203639 /nfs/dbraw/zinc/20/36/39/601203639.db2.gz IFNQHRSHPHCMEC-KUHUBIRLSA-N 0 0 385.420 3.283 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832905410 601206361 /nfs/dbraw/zinc/20/63/61/601206361.db2.gz IRALPGYRPNKIPH-LIRRHRJNSA-N 0 0 385.420 3.283 20 5 GGBDRN O=C([O-])c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NC1CC[NH+](C2CCCC2)CC1 ZINC000833307501 601210273 /nfs/dbraw/zinc/21/02/73/601210273.db2.gz OZWUNDVOVRRUBD-UHFFFAOYSA-N 0 0 378.385 3.020 20 5 GGBDRN Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(c3sccc3C(=O)[O-])C2=O)cc1[N+](=O)[O-] ZINC000832920808 601369000 /nfs/dbraw/zinc/36/90/00/601369000.db2.gz HXFNOXUGOHADGD-BXUZGUMPSA-N 0 0 389.433 3.119 20 5 GGBDRN CC[C@@H]([NH2+][C@@H]1CCN(c2sccc2C(=O)[O-])C1=O)c1cccc([N+](=O)[O-])c1 ZINC000828983022 601380306 /nfs/dbraw/zinc/38/03/06/601380306.db2.gz MSFQPSWRGBMGCB-HUUCEWRRSA-N 0 0 389.433 3.201 20 5 GGBDRN O=C([O-])[C@@H]1C[C@H](C2CCCCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000833180398 601431343 /nfs/dbraw/zinc/43/13/43/601431343.db2.gz UROWGDDACCKZNM-KSSFIOAISA-N 0 0 390.436 3.317 20 5 GGBDRN O=C([O-])[C@H]1C[C@@H](C2CCCCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000833180399 601431695 /nfs/dbraw/zinc/43/16/95/601431695.db2.gz UROWGDDACCKZNM-RDTXWAMCSA-N 0 0 390.436 3.317 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2C[C@@H](C)[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1 ZINC000263351757 601526715 /nfs/dbraw/zinc/52/67/15/601526715.db2.gz PYSQEBLBIWBMTC-OGWOLHLISA-N 0 0 397.431 3.236 20 5 GGBDRN O=C([O-])CC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCOCC1 ZINC000833205582 601561538 /nfs/dbraw/zinc/56/15/38/601561538.db2.gz CNIQXZTUMOCCKS-UHFFFAOYSA-N 0 0 376.434 3.437 20 5 GGBDRN CC[N@@H+]1C[C@H](C)[C@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000829754800 601565068 /nfs/dbraw/zinc/56/50/68/601565068.db2.gz YEHMZCAGCSKKJO-SCLBCKFNSA-N 0 0 397.431 3.276 20 5 GGBDRN Cc1ccc(C(=O)Nc2cc(-c3nn[nH]n3)cc([N+](=O)[O-])c2Cl)cc1F ZINC000826282246 607522674 /nfs/dbraw/zinc/52/26/74/607522674.db2.gz FRCBUYSWSVGCQR-UHFFFAOYSA-N 0 0 376.735 3.128 20 5 GGBDRN O=C(CSc1ccccc1)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000826420781 607523442 /nfs/dbraw/zinc/52/34/42/607523442.db2.gz BTUVEVJWQGBQPG-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN O=C(Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl)c1ccc(Cl)cc1 ZINC000826450715 607523592 /nfs/dbraw/zinc/52/35/92/607523592.db2.gz AAFTUSHYBHADGQ-UHFFFAOYSA-N 0 0 379.163 3.334 20 5 GGBDRN O=C(Cc1cccc(Cl)c1)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000826423215 607525123 /nfs/dbraw/zinc/52/51/23/607525123.db2.gz DGLWYSCFKPXSHQ-UHFFFAOYSA-N 0 0 393.190 3.263 20 5 GGBDRN C[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830794930 601901256 /nfs/dbraw/zinc/90/12/56/601901256.db2.gz BQJWTJPDQBJYCB-MRXNPFEDSA-N 0 0 384.310 3.149 20 5 GGBDRN C[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830795494 601906380 /nfs/dbraw/zinc/90/63/80/601906380.db2.gz VAXIXKURHMZZIM-INIZCTEOSA-N 0 0 384.310 3.149 20 5 GGBDRN COc1ccc(CSCCOc2ccccc2[N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000826208026 607534192 /nfs/dbraw/zinc/53/41/92/607534192.db2.gz PNNYTZIANDSMES-UHFFFAOYSA-N 0 0 387.421 3.096 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CC[C@](C)(C(=O)[O-])C2)c([N+](=O)[O-])c1 ZINC000263577297 601947083 /nfs/dbraw/zinc/94/70/83/601947083.db2.gz RJXKUCJVIQLCQD-NQIIRXRSSA-N 0 0 397.431 3.380 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN(c1cc(-c2nn[nH]n2)c2ccccc2n1)C1CC1 ZINC000826499858 607562274 /nfs/dbraw/zinc/56/22/74/607562274.db2.gz AZJZHEBJGCPAOW-UHFFFAOYSA-N 0 0 387.403 3.492 20 5 GGBDRN O=C(Oc1ccc(-c2nn[nH]n2)cc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000826468262 607572018 /nfs/dbraw/zinc/57/20/18/607572018.db2.gz JEQJAWYGUUCDFB-UHFFFAOYSA-N 0 0 379.254 3.013 20 5 GGBDRN O=C(OCc1ccc(-c2nn[nH]n2)cc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000826464695 607616170 /nfs/dbraw/zinc/61/61/70/607616170.db2.gz INNAUXWVKULYTA-UHFFFAOYSA-N 0 0 393.281 3.151 20 5 GGBDRN CCCN(Cc1ccc(-c2nn[nH]n2)cc1)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000825319081 607661343 /nfs/dbraw/zinc/66/13/43/607661343.db2.gz XCHRUODKSPIWPB-UHFFFAOYSA-N 0 0 394.435 3.065 20 5 GGBDRN CC(C)OCC[NH+]1CCC(Nc2cc(Cl)c(C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000827027849 604269831 /nfs/dbraw/zinc/26/98/31/604269831.db2.gz ZPZATAQOXKAMGP-UHFFFAOYSA-N 0 0 385.848 3.248 20 5 GGBDRN C[NH+]1CCC(Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000830928289 604629424 /nfs/dbraw/zinc/62/94/24/604629424.db2.gz JNDOCMKLXWUAJA-UHFFFAOYSA-N 0 0 383.404 3.030 20 5 GGBDRN O=C([O-])[C@@H](O)C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000833770312 604759959 /nfs/dbraw/zinc/75/99/59/604759959.db2.gz CTDQXEVJJCVBOS-KRWDZBQOSA-N 0 0 394.811 3.166 20 5 GGBDRN CC(C)(C(=O)[O-])[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000833412863 605182978 /nfs/dbraw/zinc/18/29/78/605182978.db2.gz DDOLVUSMGHVOSH-GOSISDBHSA-N 0 0 386.404 3.403 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1N1CCC(Oc2ccc(-c3nn[nH]n3)cc2)CC1 ZINC000822212938 606137716 /nfs/dbraw/zinc/13/77/16/606137716.db2.gz NMFOULBLQQHSPO-UHFFFAOYSA-N 0 0 380.408 3.131 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(NCCc3cc(F)ccc3F)cc(-c3nn[nH]n3)c2c1 ZINC000823643794 606142792 /nfs/dbraw/zinc/14/27/92/606142792.db2.gz BBKAQZDOSSTMNK-UHFFFAOYSA-N 0 0 397.345 3.256 20 5 GGBDRN COC[C@H](Nc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1)c1ccc(C)o1 ZINC000821683486 606222855 /nfs/dbraw/zinc/22/28/55/606222855.db2.gz BRKKORDFNLPRPF-HNNXBMFYSA-N 0 0 395.379 3.024 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NCc1c(F)cccc1OC(F)F ZINC000823629583 606420730 /nfs/dbraw/zinc/42/07/30/606420730.db2.gz AQMGFHAIURUUOX-UHFFFAOYSA-N 0 0 380.286 3.128 20 5 GGBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)c1cccc(-c2nn[nH]n2)c1 ZINC000820460759 606431720 /nfs/dbraw/zinc/43/17/20/606431720.db2.gz BNVKQMSIRPRPCJ-QMMMGPOBSA-N 0 0 390.201 3.106 20 5 GGBDRN Cc1ccc(CN(c2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)C2CC2)o1 ZINC000822237270 606457590 /nfs/dbraw/zinc/45/75/90/606457590.db2.gz NDOKWRWJVKOAEY-UHFFFAOYSA-N 0 0 391.391 3.394 20 5 GGBDRN Cc1c(NCc2ccc(-c3nn[nH]n3)cc2OC(F)F)cccc1[N+](=O)[O-] ZINC000822123290 606597155 /nfs/dbraw/zinc/59/71/55/606597155.db2.gz YPFPCLFTYXAUFG-UHFFFAOYSA-N 0 0 376.323 3.297 20 5 GGBDRN CC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2nn[nH]n2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000820921346 606601792 /nfs/dbraw/zinc/60/17/92/606601792.db2.gz YKTGHFHPPBGCOJ-SJCJKPOMSA-N 0 0 395.423 3.286 20 5 GGBDRN O=[N+]([O-])c1cnc(Nc2ccc(CCC(F)(F)F)cc2)c(-c2nn[nH]n2)c1 ZINC000823652170 606610243 /nfs/dbraw/zinc/61/02/43/606610243.db2.gz WGGIVZBOAXWMBY-UHFFFAOYSA-N 0 0 379.302 3.408 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000823620450 606698428 /nfs/dbraw/zinc/69/84/28/606698428.db2.gz LCBRIMADRMBXAH-GOSISDBHSA-N 0 0 399.414 3.322 20 5 GGBDRN CC[C@@H](CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-])Oc1ccccc1Cl ZINC000820908740 606714971 /nfs/dbraw/zinc/71/49/71/606714971.db2.gz PVBQQPJXULTARG-JTQLQIEISA-N 0 0 389.803 3.093 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CCC[C@@]2(CCCc3ccccc32)C1 ZINC000823620944 606718350 /nfs/dbraw/zinc/71/83/50/606718350.db2.gz UFXUSFIRBXZSBS-FQEVSTJZSA-N 0 0 391.435 3.044 20 5 GGBDRN C[C@H](Nc1ncc(Br)cc1[N+](=O)[O-])c1ccc(-c2nn[nH]n2)cc1 ZINC000820461540 606786598 /nfs/dbraw/zinc/78/65/98/606786598.db2.gz LTLHXKAWTLSILR-QMMMGPOBSA-N 0 0 390.201 3.106 20 5 GGBDRN CCc1ccc(C(=O)N(C)c2cc(Cl)ccc2-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000821477121 606958773 /nfs/dbraw/zinc/95/87/73/606958773.db2.gz ZCVWVIFURAFHMP-UHFFFAOYSA-N 0 0 386.799 3.267 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000823630305 607048255 /nfs/dbraw/zinc/04/82/55/607048255.db2.gz WMQCXFPGNMSUMU-PBHICJAKSA-N 0 0 398.423 3.241 20 5 GGBDRN C[C@H](c1ccccc1)n1ccc(Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])n1 ZINC000820570029 607118756 /nfs/dbraw/zinc/11/87/56/607118756.db2.gz BTYJKHURIHTNAV-GFCCVEGCSA-N 0 0 376.380 3.324 20 5 GGBDRN O=C(Nc1ccc(-c2nn[nH]n2)cc1Cl)c1c(Cl)cccc1[N+](=O)[O-] ZINC000823318631 607242783 /nfs/dbraw/zinc/24/27/83/607242783.db2.gz GCAOWLSKJPHDPP-UHFFFAOYSA-N 0 0 379.163 3.334 20 5 GGBDRN O=C(CCSCc1ccc([N+](=O)[O-])cc1)Nc1ccccc1-c1nn[nH]n1 ZINC000826408090 607817011 /nfs/dbraw/zinc/81/70/11/607817011.db2.gz PFDRTCJUALZEDO-UHFFFAOYSA-N 0 0 384.421 3.037 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000826497819 607849860 /nfs/dbraw/zinc/84/98/60/607849860.db2.gz VWUWPTLYRDLQSR-MRXNPFEDSA-N 0 0 398.398 3.100 20 5 GGBDRN O=[N+]([O-])c1cnc(Oc2cc(Br)ccc2Cl)c(-c2nn[nH]n2)c1 ZINC000826500947 607867303 /nfs/dbraw/zinc/86/73/03/607867303.db2.gz SMSKKTMDKBMDOL-UHFFFAOYSA-N 0 0 397.576 3.378 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CSCc1ccc(OC)c(-c2nn[nH]n2)c1 ZINC000826211993 607984829 /nfs/dbraw/zinc/98/48/29/607984829.db2.gz CPQMFHXSVSXARU-UHFFFAOYSA-N 0 0 387.421 3.226 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(COc3ccc(-c4nn[nH]n4)cc3F)co2)cc1 ZINC000826498335 608024058 /nfs/dbraw/zinc/02/40/58/608024058.db2.gz QBUZUZKTEWAFPZ-UHFFFAOYSA-N 0 0 382.311 3.148 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[nH]n2)cc1Br ZINC000825986128 608047969 /nfs/dbraw/zinc/04/79/69/608047969.db2.gz PMULVJOVSMWFHN-UHFFFAOYSA-N 0 0 389.213 3.174 20 5 GGBDRN Cc1ccc([C@@H](C)C(=O)Nc2cc(-c3nn[nH]n3)cc([N+](=O)[O-])c2Cl)o1 ZINC000826282873 608160701 /nfs/dbraw/zinc/16/07/01/608160701.db2.gz DUENUHONBMHZSS-MRVPVSSYSA-N 0 0 376.760 3.072 20 5 GGBDRN O=C(Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl)c1cccc2c1CCC2 ZINC000826451256 608162126 /nfs/dbraw/zinc/16/21/26/608162126.db2.gz XTODLGWDCGHXNT-UHFFFAOYSA-N 0 0 384.783 3.169 20 5 GGBDRN Cc1ccc(C(=O)Nc2cc(-c3nn[nH]n3)cc([N+](=O)[O-])c2Cl)c(F)c1 ZINC000826282597 608163463 /nfs/dbraw/zinc/16/34/63/608163463.db2.gz WMIGHFWWDJQWTQ-UHFFFAOYSA-N 0 0 376.735 3.128 20 5 GGBDRN CCOc1cc(N(Cc2ccc(-c3nn[nH]n3)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000825616084 608180438 /nfs/dbraw/zinc/18/04/38/608180438.db2.gz VZQSHXVJRXWNRB-UHFFFAOYSA-N 0 0 380.408 3.343 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)c2cccc(-c3nn[nH]n3)c2)c1 ZINC000826230962 608184431 /nfs/dbraw/zinc/18/44/31/608184431.db2.gz QQXVSTCCFAPNPF-JTQLQIEISA-N 0 0 385.405 3.415 20 5 GGBDRN CCCN1C(=O)CCc2cc(Nc3ccc([N+](=O)[O-])cc3-c3nn[nH]n3)ccc21 ZINC000825326886 608297590 /nfs/dbraw/zinc/29/75/90/608297590.db2.gz HKSPICQUTLPXDF-UHFFFAOYSA-N 0 0 393.407 3.208 20 5 GGBDRN O=C(Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl)c1ccc(Cl)c(F)c1 ZINC000826451190 608312019 /nfs/dbraw/zinc/31/20/19/608312019.db2.gz VCYMLDUQCXBREY-UHFFFAOYSA-N 0 0 397.153 3.473 20 5 GGBDRN CC(=O)c1ccc(N2CC=C(c3ccc(-c4nn[nH]n4)cc3)CC2)c([N+](=O)[O-])c1 ZINC000824025075 608441317 /nfs/dbraw/zinc/44/13/17/608441317.db2.gz UPDONFGRBVKIMH-UHFFFAOYSA-N 0 0 390.403 3.271 20 5 GGBDRN COc1cc(N2CC=C(c3ccc(-c4nn[nH]n4)cc3)CC2)ccc1[N+](=O)[O-] ZINC000826180663 608441806 /nfs/dbraw/zinc/44/18/06/608441806.db2.gz RMXCFMCPTRRQQW-UHFFFAOYSA-N 0 0 378.392 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CC=C(c3ccc(-c4nn[nH]n4)cc3)CC2)c(F)c1 ZINC000826498417 608464541 /nfs/dbraw/zinc/46/45/41/608464541.db2.gz TYLWUKSQQJFRBE-UHFFFAOYSA-N 0 0 380.383 3.203 20 5 GGBDRN C[C@H](NCc1ccc(-c2nn[nH]n2)cc1OC(F)F)c1ccccc1[N+](=O)[O-] ZINC000824611560 608563593 /nfs/dbraw/zinc/56/35/93/608563593.db2.gz BBFADKXTLITONA-JTQLQIEISA-N 0 0 390.350 3.227 20 5 GGBDRN C[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(-c2nn[nH]n2)c(F)c1 ZINC000824612304 609153607 /nfs/dbraw/zinc/15/36/07/609153607.db2.gz MQBBUXHIPJZYSJ-SECBINFHSA-N 0 0 376.779 3.418 20 5 GGBDRN O=[N+]([O-])c1cccc(OCc2ccc(-c3nn[nH]n3)cc2Br)c1 ZINC000826499257 609306707 /nfs/dbraw/zinc/30/67/07/609306707.db2.gz BJBUJTWTFSCECG-UHFFFAOYSA-N 0 0 376.170 3.116 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2ccc(-c3nn[nH]n3)cc2Br)cc1 ZINC000826498980 609306906 /nfs/dbraw/zinc/30/69/06/609306906.db2.gz QVQZQYQQARVAAB-UHFFFAOYSA-N 0 0 376.170 3.116 20 5 GGBDRN O=C(CCCCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])OCc1ccccc1 ZINC000826406374 609391279 /nfs/dbraw/zinc/39/12/79/609391279.db2.gz UBHRHHZJKPXGAN-UHFFFAOYSA-N 0 0 396.407 3.101 20 5 GGBDRN O=C(C[C@@H]1CCCN1c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1ccccc1 ZINC000826405092 609430340 /nfs/dbraw/zinc/43/03/40/609430340.db2.gz VSFIASWTDYDBRP-HNNXBMFYSA-N 0 0 378.392 3.017 20 5 GGBDRN CCCN(Cc1ccc(-c2nn[nH]n2)cc1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000825322836 609437157 /nfs/dbraw/zinc/43/71/57/609437157.db2.gz JWGPKKCDTSTBNJ-UHFFFAOYSA-N 0 0 390.407 3.135 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)OC(=O)C=Cc1ccccc1-c1nn[nH]n1 ZINC000826293346 609463083 /nfs/dbraw/zinc/46/30/83/609463083.db2.gz LSOBFPWLUSOCNM-FROQITRMSA-N 0 0 379.376 3.401 20 5 GGBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(-c2nn[nH]n2)cc1 ZINC000506330368 609520531 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Cc1c(Br)c(NCCNC(=O)c2ccccc2F)ncc1[N+](=O)[O-] ZINC000543436006 650911801 /nfs/dbraw/zinc/91/18/01/650911801.db2.gz IYUJKQNNYOQIBS-UHFFFAOYSA-N 0 0 397.204 3.042 20 5 GGBDRN COc1cccc(CN(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000052956038 1406240767 /nfs/dbraw/zinc/24/07/67/1406240767.db2.gz DRDAWJWAFUTNFY-UHFFFAOYSA-N 0 0 380.404 3.276 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1cn2ccccc2n1)c1ccccc1[N+](=O)[O-] ZINC000052977639 1406248118 /nfs/dbraw/zinc/24/81/18/1406248118.db2.gz QVEBMMUKTCEJBG-OAHLLOKOSA-N 0 0 396.403 3.055 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1cc(Cl)c[nH]1)c1ccccc1[N+](=O)[O-] ZINC000052986924 1406250039 /nfs/dbraw/zinc/25/00/39/1406250039.db2.gz IAGLNRZGCLEILD-CYBMUJFWSA-N 0 0 379.800 3.389 20 5 GGBDRN O=C(N[C@@H]1COc2ccccc2C1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000053047019 1406271907 /nfs/dbraw/zinc/27/19/07/1406271907.db2.gz QRHKXZYSKTWOTL-LBPRGKRZSA-N 0 0 396.321 3.269 20 5 GGBDRN CSCC[C@H](NC(=O)c1ccc(C)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000053054080 1406277326 /nfs/dbraw/zinc/27/73/26/1406277326.db2.gz QUVPQNDIPKTTCW-AWEZNQCLSA-N 0 0 385.449 3.170 20 5 GGBDRN O=C(NCc1nnc2ccc(C(F)(F)F)cn21)c1ccc([N+](=O)[O-])cc1Cl ZINC000053054610 1406277972 /nfs/dbraw/zinc/27/79/72/1406277972.db2.gz JRNWJFNZTXXKNZ-UHFFFAOYSA-N 0 0 399.716 3.240 20 5 GGBDRN CCN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@H](C)c1ccc(F)cc1 ZINC000053088291 1406287629 /nfs/dbraw/zinc/28/76/29/1406287629.db2.gz PTFJODVAFBIEBB-GFCCVEGCSA-N 0 0 389.383 3.484 20 5 GGBDRN C[C@H](c1cc(F)ccc1F)N(C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000053126813 1406302019 /nfs/dbraw/zinc/30/20/19/1406302019.db2.gz COGVHDPDVMSGPG-GFCCVEGCSA-N 0 0 375.375 3.455 20 5 GGBDRN C[C@H](c1cc(F)ccc1F)N(C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000053127022 1406302105 /nfs/dbraw/zinc/30/21/05/1406302105.db2.gz LSHYMHHCONRZRL-GFCCVEGCSA-N 0 0 375.375 3.455 20 5 GGBDRN C[C@@H](c1cc(F)ccc1F)N(C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000053126554 1406302222 /nfs/dbraw/zinc/30/22/22/1406302222.db2.gz 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ZINC000053484328 1406413360 /nfs/dbraw/zinc/41/33/60/1406413360.db2.gz LATUDRZSOUSUNB-CABCVRRESA-N 0 0 394.435 3.178 20 5 GGBDRN O=C(COc1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000053487771 1406414086 /nfs/dbraw/zinc/41/40/86/1406414086.db2.gz PNFTYMWCPIBSJO-KRWDZBQOSA-N 0 0 394.786 3.366 20 5 GGBDRN COCCOc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000053500942 1406415582 /nfs/dbraw/zinc/41/55/82/1406415582.db2.gz LBZNQGNTIQBVPR-UHFFFAOYSA-N 0 0 396.403 3.273 20 5 GGBDRN C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)CC2)C1 ZINC000053502404 1406416316 /nfs/dbraw/zinc/41/63/16/1406416316.db2.gz IBWOJLOESPTRPO-CQSZACIVSA-N 0 0 398.463 3.187 20 5 GGBDRN Cc1ccccc1-n1ccnc1SCC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000053532133 1406429910 /nfs/dbraw/zinc/42/99/10/1406429910.db2.gz DNGMDTRLPAWEOP-UHFFFAOYSA-N 0 0 382.445 3.497 20 5 GGBDRN COc1cc(C)c([C@@H](C)NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1OC ZINC000053541726 1406434697 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PSMFMPJXKNXNBL-GFCCVEGCSA-N 0 0 382.420 3.476 20 5 GGBDRN CNC(=O)c1ccc(N2CCC(C(=O)c3ccc(OC)cc3)CC2)c([N+](=O)[O-])c1 ZINC000053555771 1406442852 /nfs/dbraw/zinc/44/28/52/1406442852.db2.gz ZAXDZSCYKLASAT-UHFFFAOYSA-N 0 0 397.431 3.062 20 5 GGBDRN CNC(=O)c1ccc(NCc2ccc(C(=O)N3CCCCC3)cc2)c([N+](=O)[O-])c1 ZINC000053553835 1406441511 /nfs/dbraw/zinc/44/15/11/1406441511.db2.gz BKJOAVCZDAPILK-UHFFFAOYSA-N 0 0 396.447 3.193 20 5 GGBDRN CCn1c(Sc2ccc(C(=O)NC)cc2[N+](=O)[O-])nnc1-c1ccccc1 ZINC000053554614 1406441729 /nfs/dbraw/zinc/44/17/29/1406441729.db2.gz IIHMUZWTPAYDNH-UHFFFAOYSA-N 0 0 383.433 3.384 20 5 GGBDRN CNC(=O)c1ccc(Sc2nnc3sc4ccccc4n23)c([N+](=O)[O-])c1 ZINC000053556105 1406442413 /nfs/dbraw/zinc/44/24/13/1406442413.db2.gz YUFDKESIRPNFEJ-UHFFFAOYSA-N 0 0 385.430 3.363 20 5 GGBDRN CCc1cc(N2CCC[C@H](c3nncn3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053558754 1406443423 /nfs/dbraw/zinc/44/34/23/1406443423.db2.gz JLSWPXHEGMQJKW-HNNXBMFYSA-N 0 0 393.451 3.127 20 5 GGBDRN 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1398534004 /nfs/dbraw/zinc/53/40/04/1398534004.db2.gz FHUMCVOELMEFLO-UHFFFAOYSA-N 0 0 387.396 3.354 20 5 GGBDRN Cc1cc(F)c2c(c1)CCCN2C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000055430317 1406961255 /nfs/dbraw/zinc/96/12/55/1406961255.db2.gz LQMDKFPTLAXOQN-UHFFFAOYSA-N 0 0 392.408 3.039 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCCc3cc(F)cc(F)c32)cc([N+](=O)[O-])c1 ZINC000055431776 1406961297 /nfs/dbraw/zinc/96/12/97/1406961297.db2.gz LQUJILSEDKYDKH-UHFFFAOYSA-N 0 0 376.315 3.253 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)N1CCC(Cc2ccccc2)CC1 ZINC000006290723 1398540616 /nfs/dbraw/zinc/54/06/16/1398540616.db2.gz OLFVUQQSPYPSJO-UHFFFAOYSA-N 0 0 384.432 3.464 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2nnc(Cc3ccccc3)s2)cc([N+](=O)[O-])c1 ZINC000006334454 1398543177 /nfs/dbraw/zinc/54/31/77/1398543177.db2.gz VMFGJPLUSNNZLR-UHFFFAOYSA-N 0 0 398.400 3.076 20 5 GGBDRN COc1cc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)cc(OC)c1 ZINC000006337206 1398543907 /nfs/dbraw/zinc/54/39/07/1398543907.db2.gz 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0 0 393.783 3.025 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2N)c(Cl)c1 ZINC000021765251 1399408047 /nfs/dbraw/zinc/40/80/47/1399408047.db2.gz YXELZBRZTIMADX-SNVBAGLBSA-N 0 0 377.784 3.323 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCCc3ccccn3)cc2[N+](=O)[O-])C1 ZINC000021773810 1399408609 /nfs/dbraw/zinc/40/86/09/1399408609.db2.gz BQWBUOBLIFKKQF-IYBDPMFKSA-N 0 0 382.464 3.445 20 5 GGBDRN COC(=O)c1cc(C(=O)OCc2cn3cc(Cl)ccc3n2)cc([N+](=O)[O-])c1 ZINC000021783589 1399409079 /nfs/dbraw/zinc/40/90/79/1399409079.db2.gz RZXZCMQBPPHLST-UHFFFAOYSA-N 0 0 389.751 3.040 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c1 ZINC000055620466 1407027113 /nfs/dbraw/zinc/02/71/13/1407027113.db2.gz JBFVAKCMKIGPSF-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN CCCc1cc(=O)oc2cc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc12 ZINC000021820832 1399410659 /nfs/dbraw/zinc/41/06/59/1399410659.db2.gz KRUAINCGNUCPFG-UHFFFAOYSA-N 0 0 389.385 3.421 20 5 GGBDRN CCOc1ccccc1N1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000021822796 1399411291 /nfs/dbraw/zinc/41/12/91/1399411291.db2.gz QODMKNYWGDMUDE-MRXNPFEDSA-N 0 0 398.463 3.143 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OCc2ccc(Cl)nc2)c([N+](=O)[O-])c1 ZINC000021827186 1399412249 /nfs/dbraw/zinc/41/22/49/1399412249.db2.gz GZLNHRWGLKFSHH-UHFFFAOYSA-N 0 0 399.856 3.253 20 5 GGBDRN COc1ccc([C@H](NC(=O)COC(=O)c2cccc(C)c2[N+](=O)[O-])C2CC2)cc1 ZINC000021835571 1399412678 /nfs/dbraw/zinc/41/26/78/1399412678.db2.gz LOXYBGAJKSLHHC-LJQANCHMSA-N 0 0 398.415 3.336 20 5 GGBDRN Cc1cccc(C(=O)OCC(=O)N2CCc3[nH]c4ccccc4c3C2)c1[N+](=O)[O-] ZINC000021835830 1399413426 /nfs/dbraw/zinc/41/34/26/1399413426.db2.gz ZCHPXNDPSZOINO-UHFFFAOYSA-N 0 0 393.399 3.126 20 5 GGBDRN O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)NCC1CC1 ZINC000021846442 1399415008 /nfs/dbraw/zinc/41/50/08/1399415008.db2.gz SFHMVDWMIOWWNW-UHFFFAOYSA-N 0 0 386.429 3.429 20 5 GGBDRN Cc1c2ccccc2oc1C(=O)OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000021859377 1399415359 /nfs/dbraw/zinc/41/53/59/1399415359.db2.gz XWZGWLBZLWBGBD-UHFFFAOYSA-N 0 0 380.356 3.396 20 5 GGBDRN CCc1ccc(OC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)cc1 ZINC000021890518 1399419588 /nfs/dbraw/zinc/41/95/88/1399419588.db2.gz JNMJNONRTDXZDR-UHFFFAOYSA-N 0 0 379.372 3.231 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000021889394 1399419748 /nfs/dbraw/zinc/41/97/48/1399419748.db2.gz BAHYPSSEPOURSB-UHFFFAOYSA-N 0 0 392.415 3.111 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N=c2[nH]c3c(s2)CCCCC3)cc1OC ZINC000021902279 1399420969 /nfs/dbraw/zinc/42/09/69/1399420969.db2.gz ZNTZDGRNEJHACI-UHFFFAOYSA-N 0 0 391.449 3.402 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)CSc1ccc(F)cc1 ZINC000022015123 1399431663 /nfs/dbraw/zinc/43/16/63/1399431663.db2.gz DQTJNGCJRCMBOL-UHFFFAOYSA-N 0 0 394.380 3.017 20 5 GGBDRN CNc1ccc(C(=O)OCC(=O)N2c3ccccc3CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000022066207 1399434740 /nfs/dbraw/zinc/43/47/40/1399434740.db2.gz CNHGRJJIMJZYID-ZDUSSCGKSA-N 0 0 383.404 3.161 20 5 GGBDRN CSc1ccccc1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N ZINC000022088051 1399435683 /nfs/dbraw/zinc/43/56/83/1399435683.db2.gz OKTBPPATKGJBDT-JTQLQIEISA-N 0 0 375.406 3.083 20 5 GGBDRN CSc1cccc(NC(=O)[C@H](C)OC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000022094671 1399436233 /nfs/dbraw/zinc/43/62/33/1399436233.db2.gz BBAXMWIJKZQWRM-LBPRGKRZSA-N 0 0 390.417 3.266 20 5 GGBDRN C[C@@H](OC(=O)CSc1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000022097240 1399436734 /nfs/dbraw/zinc/43/67/34/1399436734.db2.gz INVHMYTYPOCYJJ-LLVKDONJSA-N 0 0 378.381 3.396 20 5 GGBDRN O=C(OC[C@H]1COc2ccccc2O1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022139712 1399439966 /nfs/dbraw/zinc/43/99/66/1399439966.db2.gz BIBCMIOQFCOUPZ-OAHLLOKOSA-N 0 0 384.388 3.192 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(NC2CC2)s1 ZINC000022172990 1399441766 /nfs/dbraw/zinc/44/17/66/1399441766.db2.gz IOIBRELTBKMEKX-MRVPVSSYSA-N 0 0 395.466 3.149 20 5 GGBDRN CCOc1ccc(NC(=O)CSc2nnc(NC3CC3)s2)c([N+](=O)[O-])c1 ZINC000022172850 1399441782 /nfs/dbraw/zinc/44/17/82/1399441782.db2.gz QSVIVKUDSFPJFC-UHFFFAOYSA-N 0 0 395.466 3.150 20 5 GGBDRN CC(C)CCNC(=O)[C@@H](C)OC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000022184140 1399442513 /nfs/dbraw/zinc/44/25/13/1399442513.db2.gz YQRFHJSYDBMEEG-SNVBAGLBSA-N 0 0 387.230 3.065 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)NC3CC3)cc2)cc1OC ZINC000022193249 1399443702 /nfs/dbraw/zinc/44/37/02/1399443702.db2.gz UWGKSJYJDQWJCP-UHFFFAOYSA-N 0 0 399.403 3.147 20 5 GGBDRN O=C(CSc1n[nH]c(-c2ccccc2F)n1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022203795 1399444462 /nfs/dbraw/zinc/44/44/62/1399444462.db2.gz PDVWWZDIHVBPHC-UHFFFAOYSA-N 0 0 399.407 3.200 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@H](C)OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000022243620 1399446422 /nfs/dbraw/zinc/44/64/22/1399446422.db2.gz CKXYLKWACDXZMC-AWEZNQCLSA-N 0 0 397.431 3.339 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000022250575 1399447466 /nfs/dbraw/zinc/44/74/66/1399447466.db2.gz KJORNSMVJOLLLT-UHFFFAOYSA-N 0 0 393.465 3.246 20 5 GGBDRN O=C(COc1ccc2ccccc2c1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000022262577 1399448994 /nfs/dbraw/zinc/44/89/94/1399448994.db2.gz DGLMWGWEXABGJB-UHFFFAOYSA-N 0 0 376.372 3.320 20 5 GGBDRN CNc1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc3ncccc32)cc1[N+](=O)[O-] ZINC000022273452 1399449744 /nfs/dbraw/zinc/44/97/44/1399449744.db2.gz QIQZLCFIKVLKCX-GFCCVEGCSA-N 0 0 394.387 3.369 20 5 GGBDRN Cc1ccc(C(=O)Nc2nc(CN3C[C@@H](C)O[C@@H](C)C3)cs2)cc1[N+](=O)[O-] ZINC000022297448 1399451855 /nfs/dbraw/zinc/45/18/55/1399451855.db2.gz SBBDFUHSGWBYRN-BETUJISGSA-N 0 0 390.465 3.221 20 5 GGBDRN Cc1c(C(=O)Nc2nc(CN3C[C@@H](C)O[C@@H](C)C3)cs2)cccc1[N+](=O)[O-] ZINC000022300571 1399452863 /nfs/dbraw/zinc/45/28/63/1399452863.db2.gz BFEIUVLXKAYKJS-TXEJJXNPSA-N 0 0 390.465 3.221 20 5 GGBDRN O=C(Cn1cnc2ccc(Cl)cc2c1=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000022321098 1399455096 /nfs/dbraw/zinc/45/50/96/1399455096.db2.gz OLKDCZVJAXSWRB-UHFFFAOYSA-N 0 0 393.186 3.250 20 5 GGBDRN Cc1ccccc1-n1cnnc1SCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022355741 1399456491 /nfs/dbraw/zinc/45/64/91/1399456491.db2.gz MTPIHRZMKODWDG-UHFFFAOYSA-N 0 0 395.444 3.165 20 5 GGBDRN O=[N+]([O-])c1c(N2CCC[C@H](c3nnc4n3CCCCC4)C2)nc2sccn21 ZINC000022374174 1399458402 /nfs/dbraw/zinc/45/84/02/1399458402.db2.gz UNGNXVDFLXCWEB-LBPRGKRZSA-N 0 0 387.469 3.006 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1[N+](=O)[O-] ZINC000055631642 1407030391 /nfs/dbraw/zinc/03/03/91/1407030391.db2.gz KDBULPVJOMGQCE-MRXNPFEDSA-N 0 0 392.433 3.262 20 5 GGBDRN COc1ccc([C@@H](NC(=O)COc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000022435789 1399464189 /nfs/dbraw/zinc/46/41/89/1399464189.db2.gz MOJDYNWKSYXVQP-FQEVSTJZSA-N 0 0 386.404 3.258 20 5 GGBDRN C[C@@H](OC(=O)c1ccccc1[N+](=O)[O-])C(=O)N(C)Cc1nc2ccccc2s1 ZINC000022445209 1399464405 /nfs/dbraw/zinc/46/44/05/1399464405.db2.gz AULPGDCKJKMFBL-GFCCVEGCSA-N 0 0 399.428 3.408 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccccc1Br ZINC000022445379 1399465134 /nfs/dbraw/zinc/46/51/34/1399465134.db2.gz YQXIZJFHROLCCY-MRVPVSSYSA-N 0 0 383.154 3.134 20 5 GGBDRN O=C(NC[C@H](c1cccs1)N1CCOCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000022465415 1399466423 /nfs/dbraw/zinc/46/64/23/1399466423.db2.gz OYWRFNYTPUCSIT-OAHLLOKOSA-N 0 0 395.868 3.113 20 5 GGBDRN COc1cccc(CNC(=O)[C@H](C)OC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000022468324 1399466496 /nfs/dbraw/zinc/46/64/96/1399466496.db2.gz NDOJDTHUHPVMKY-NSHDSACASA-N 0 0 392.795 3.119 20 5 GGBDRN COc1ccc(CN(C(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])C2CC2)cc1 ZINC000022473748 1399466781 /nfs/dbraw/zinc/46/67/81/1399466781.db2.gz RPZQILYZHCCMPT-UHFFFAOYSA-N 0 0 398.415 3.260 20 5 GGBDRN C[C@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000022471703 1399466914 /nfs/dbraw/zinc/46/69/14/1399466914.db2.gz IAICQESBHPKYHW-VIFPVBQESA-N 0 0 394.286 3.100 20 5 GGBDRN COc1ccc([C@H](NC(=O)COC(=O)c2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000022470299 1399467011 /nfs/dbraw/zinc/46/70/11/1399467011.db2.gz RNBAREYPESXSPE-LJQANCHMSA-N 0 0 384.388 3.028 20 5 GGBDRN Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)OC(=O)COc1ccccc1[N+](=O)[O-] ZINC000022478104 1399467523 /nfs/dbraw/zinc/46/75/23/1399467523.db2.gz NJYUQIBQQWOJOF-HUUCEWRRSA-N 0 0 386.404 3.091 20 5 GGBDRN CSc1ccc(NC(=O)[C@H](C)OC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000022478131 1399467583 /nfs/dbraw/zinc/46/75/83/1399467583.db2.gz XODAPZOZCABHAL-LBPRGKRZSA-N 0 0 390.417 3.266 20 5 GGBDRN CC[C@@H](NC(=O)COC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000022487886 1399468690 /nfs/dbraw/zinc/46/86/90/1399468690.db2.gz HBCIITOJDAGXTJ-OAHLLOKOSA-N 0 0 391.811 3.255 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000055631550 1407030977 /nfs/dbraw/zinc/03/09/77/1407030977.db2.gz JCPKVALBXOZTDU-MRXNPFEDSA-N 0 0 392.433 3.262 20 5 GGBDRN C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)N1CCc2sccc2C1 ZINC000022495096 1399470045 /nfs/dbraw/zinc/47/00/45/1399470045.db2.gz IXXPIJLBVJFWJO-SNVBAGLBSA-N 0 0 394.836 3.440 20 5 GGBDRN COc1cccc(CNC(=O)[C@@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000022495729 1399470193 /nfs/dbraw/zinc/47/01/93/1399470193.db2.gz JTWIYMJPTDRLEO-LLVKDONJSA-N 0 0 392.795 3.119 20 5 GGBDRN COc1ccc([C@@H](NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000022500457 1399470942 /nfs/dbraw/zinc/47/09/42/1399470942.db2.gz WCNNNQPNMLGNRG-IBGZPJMESA-N 0 0 384.388 3.028 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1[N+](=O)[O-] ZINC000055632421 1407031559 /nfs/dbraw/zinc/03/15/59/1407031559.db2.gz CMIUJZQUIFJFBQ-UHFFFAOYSA-N 0 0 391.449 3.232 20 5 GGBDRN O=C(COC(=O)CSCc1ccc(F)cc1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000022523918 1399472084 /nfs/dbraw/zinc/47/20/84/1399472084.db2.gz UEOQHTZKRVSCGO-UHFFFAOYSA-N 0 0 396.371 3.288 20 5 GGBDRN CCN(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)C1CCCCC1 ZINC000022534112 1399472608 /nfs/dbraw/zinc/47/26/08/1399472608.db2.gz SRWXAXZHJCEMDY-UHFFFAOYSA-N 0 0 384.436 3.244 20 5 GGBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000022542340 1399473818 /nfs/dbraw/zinc/47/38/18/1399473818.db2.gz PKXPEBJLNJEIBA-LBPRGKRZSA-N 0 0 399.428 3.408 20 5 GGBDRN Cc1nc(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)sc1C ZINC000022550810 1399475219 /nfs/dbraw/zinc/47/52/19/1399475219.db2.gz UBYOAKLOZRGEEJ-LAHYYIKRSA-N 0 0 375.406 3.252 20 5 GGBDRN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000022550873 1399475320 /nfs/dbraw/zinc/47/53/20/1399475320.db2.gz AMWOODKMAVHDOK-XEZFYOOLSA-N 0 0 398.415 3.426 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(N2CCCC2=O)c(Cl)c1 ZINC000022555869 1399476685 /nfs/dbraw/zinc/47/66/85/1399476685.db2.gz WZZXDQAUZLQKGL-UHFFFAOYSA-N 0 0 389.795 3.393 20 5 GGBDRN CCC(CC)NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559446 1399477207 /nfs/dbraw/zinc/47/72/07/1399477207.db2.gz NGTXFJPIKUDEQN-CYBMUJFWSA-N 0 0 377.441 3.045 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559459 1399477331 /nfs/dbraw/zinc/47/73/31/1399477331.db2.gz BSDPMUYQJHRLHQ-UONOGXRCSA-N 0 0 377.441 3.045 20 5 GGBDRN CCC(CC)NC(=O)[C@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559449 1399477398 /nfs/dbraw/zinc/47/73/98/1399477398.db2.gz NGTXFJPIKUDEQN-ZDUSSCGKSA-N 0 0 377.441 3.045 20 5 GGBDRN Cc1ccc(NC(=O)CCCNC(=O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000022590340 1399480667 /nfs/dbraw/zinc/48/06/67/1399480667.db2.gz GPHLPQUGLYUMKM-UHFFFAOYSA-N 0 0 377.347 3.330 20 5 GGBDRN COc1ccc(CCNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000022596189 1399481303 /nfs/dbraw/zinc/48/13/03/1399481303.db2.gz RQQAWJPSANVCSZ-CYBMUJFWSA-N 0 0 390.461 3.452 20 5 GGBDRN Cc1c(NC(=O)CCCNC(=O)c2ccc(F)cc2F)cccc1[N+](=O)[O-] ZINC000022596837 1399481501 /nfs/dbraw/zinc/48/15/01/1399481501.db2.gz YDRWKWHXHAQZQG-UHFFFAOYSA-N 0 0 377.347 3.330 20 5 GGBDRN COCCOCc1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c1 ZINC000055632657 1407032389 /nfs/dbraw/zinc/03/23/89/1407032389.db2.gz RRDGBPYCTZKQKW-UHFFFAOYSA-N 0 0 394.449 3.175 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)c2ccc(Br)o2)cccc1[N+](=O)[O-] ZINC000022654282 1399487121 /nfs/dbraw/zinc/48/71/21/1399487121.db2.gz HZHDLORGGRABNU-VIFPVBQESA-N 0 0 397.181 3.443 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCc2sccc2C1 ZINC000022667944 1399488439 /nfs/dbraw/zinc/48/84/39/1399488439.db2.gz XXMAFMVTVGXHII-SNVBAGLBSA-N 0 0 394.836 3.440 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1nc(-c2ccc(Cl)cc2)no1 ZINC000022707205 1399494167 /nfs/dbraw/zinc/49/41/67/1399494167.db2.gz NCLJNGOBHURMBM-UHFFFAOYSA-N 0 0 384.735 3.094 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000022736473 1399496971 /nfs/dbraw/zinc/49/69/71/1399496971.db2.gz HJKQOSMTHIIQCC-GFCCVEGCSA-N 0 0 385.376 3.046 20 5 GGBDRN Cc1cc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000022736534 1399497057 /nfs/dbraw/zinc/49/70/57/1399497057.db2.gz NPIKDNNOAINUNV-XJKSGUPXSA-N 0 0 384.388 3.089 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccc(Cl)c(N)c2)cccc1[N+](=O)[O-] ZINC000022752622 1399498096 /nfs/dbraw/zinc/49/80/96/1399498096.db2.gz CFZZGOXPYGFSFL-SNVBAGLBSA-N 0 0 377.784 3.323 20 5 GGBDRN Cc1cc(C)cc(-n2ncc3c2ncn(Cc2ccc([N+](=O)[O-])cc2)c3=O)c1 ZINC000022877787 1399512878 /nfs/dbraw/zinc/51/28/78/1399512878.db2.gz GTFACOUCKRTLFA-UHFFFAOYSA-N 0 0 375.388 3.156 20 5 GGBDRN Cc1cc(C)cc(-n2ncc3c2ncn(Cc2cccc([N+](=O)[O-])c2)c3=O)c1 ZINC000022877859 1399513733 /nfs/dbraw/zinc/51/37/33/1399513733.db2.gz FCCVHGMRZDGYSW-UHFFFAOYSA-N 0 0 375.388 3.156 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)c2cccc([N+](=O)[O-])c2C)cccc1[N+](=O)[O-] ZINC000022910636 1399516155 /nfs/dbraw/zinc/51/61/55/1399516155.db2.gz VPFPAYYPYUYWSN-LBPRGKRZSA-N 0 0 387.348 3.304 20 5 GGBDRN COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc(C)cc2F)cc1[N+](=O)[O-] ZINC000022907625 1399516157 /nfs/dbraw/zinc/51/61/57/1399516157.db2.gz JKZRMWXIBULTTK-NSHDSACASA-N 0 0 376.340 3.235 20 5 GGBDRN COc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000022907643 1399516167 /nfs/dbraw/zinc/51/61/67/1399516167.db2.gz YITBDVSLIYUDGP-KBPBESRZSA-N 0 0 386.404 3.335 20 5 GGBDRN COc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)c1cccc([N+](=O)[O-])c1C ZINC000022911228 1399516175 /nfs/dbraw/zinc/51/61/75/1399516175.db2.gz KJSDCIMBUPMNRN-KBPBESRZSA-N 0 0 386.404 3.335 20 5 GGBDRN COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc3ncccc32)cc1[N+](=O)[O-] ZINC000022908061 1399516199 /nfs/dbraw/zinc/51/61/99/1399516199.db2.gz WBPGSGPQAVLFMM-LBPRGKRZSA-N 0 0 395.371 3.336 20 5 GGBDRN COc1ccc(CCNC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000022920801 1399517455 /nfs/dbraw/zinc/51/74/55/1399517455.db2.gz RHSUTYYYICCPIV-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN CC(=O)c1cc2c(cc1NC(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)OCO2 ZINC000022923087 1399517562 /nfs/dbraw/zinc/51/75/62/1399517562.db2.gz JXMCLEKOKXMMSN-UHFFFAOYSA-N 0 0 383.360 3.353 20 5 GGBDRN CCCc1cc(=O)[nH]c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000022930361 1399518412 /nfs/dbraw/zinc/51/84/12/1399518412.db2.gz LRORAMYLGAYYSX-NSHDSACASA-N 0 0 376.438 3.058 20 5 GGBDRN CCCc1cc(=O)[nH]c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000022930364 1399518527 /nfs/dbraw/zinc/51/85/27/1399518527.db2.gz LRORAMYLGAYYSX-LLVKDONJSA-N 0 0 376.438 3.058 20 5 GGBDRN CC(=O)c1ccc(N2CCC[C@H](c3nnc4n3CCCCC4)C2)c([N+](=O)[O-])c1 ZINC000022977775 1399521205 /nfs/dbraw/zinc/52/12/05/1399521205.db2.gz XKRPMFQUSGHYGA-INIZCTEOSA-N 0 0 383.452 3.499 20 5 GGBDRN Cc1nn(Cc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)c(C)c1[N+](=O)[O-] ZINC000022986346 1399521876 /nfs/dbraw/zinc/52/18/76/1399521876.db2.gz VKKOXWVQQNHNKP-UHFFFAOYSA-N 0 0 381.417 3.421 20 5 GGBDRN CCCC(=O)Nc1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000055638768 1407035215 /nfs/dbraw/zinc/03/52/15/1407035215.db2.gz NKLZBFYRMDJTKL-UHFFFAOYSA-N 0 0 377.422 3.443 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)C1CC1)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000023073442 1399530631 /nfs/dbraw/zinc/53/06/31/1399530631.db2.gz XDNODRCAHWKIQP-QRWLVFNGSA-N 0 0 397.406 3.354 20 5 GGBDRN CNc1ccc(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)cc1[N+](=O)[O-] ZINC000023080321 1399531193 /nfs/dbraw/zinc/53/11/93/1399531193.db2.gz RXDQKRGLNFTCAD-QGZVFWFLSA-N 0 0 376.844 3.323 20 5 GGBDRN CNc1ccc(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)cc1[N+](=O)[O-] ZINC000023080323 1399531299 /nfs/dbraw/zinc/53/12/99/1399531299.db2.gz RXDQKRGLNFTCAD-KRWDZBQOSA-N 0 0 376.844 3.323 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1 ZINC000023103010 1399531688 /nfs/dbraw/zinc/53/16/88/1399531688.db2.gz BMXREXSKAPUXQE-GFCCVEGCSA-N 0 0 383.404 3.443 20 5 GGBDRN CNC(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 ZINC000023113673 1399533200 /nfs/dbraw/zinc/53/32/00/1399533200.db2.gz PYRURCQUAVYMBO-UHFFFAOYSA-N 0 0 396.447 3.126 20 5 GGBDRN CCCCNC(=O)[C@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000023204923 1399538957 /nfs/dbraw/zinc/53/89/57/1399538957.db2.gz RFUSJJMKGRFKHG-HNNXBMFYSA-N 0 0 391.468 3.293 20 5 GGBDRN CCCN(CCC)C(=O)COC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000023204646 1399539098 /nfs/dbraw/zinc/53/90/98/1399539098.db2.gz OJUYSKMCLMQUHG-UHFFFAOYSA-N 0 0 394.471 3.347 20 5 GGBDRN CCN(CC)C(=O)[C@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000023204939 1399539396 /nfs/dbraw/zinc/53/93/96/1399539396.db2.gz NHSFNSRWPLDCRF-HNNXBMFYSA-N 0 0 391.468 3.245 20 5 GGBDRN Cc1ccc(OCC(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C ZINC000023219931 1399540869 /nfs/dbraw/zinc/54/08/69/1399540869.db2.gz SMRLFXMVLIBTFY-HNNXBMFYSA-N 0 0 386.404 3.469 20 5 GGBDRN CCOc1ccc(C(=O)NC[C@H](c2ccccc2OC)N(C)C)cc1[N+](=O)[O-] ZINC000023230237 1399542124 /nfs/dbraw/zinc/54/21/24/1399542124.db2.gz XRHGIANAYMVESI-QGZVFWFLSA-N 0 0 387.436 3.035 20 5 GGBDRN CCOc1ccc(C(=O)NC[C@@H](c2ccccc2OC)N(C)C)cc1[N+](=O)[O-] ZINC000023230238 1399542253 /nfs/dbraw/zinc/54/22/53/1399542253.db2.gz XRHGIANAYMVESI-KRWDZBQOSA-N 0 0 387.436 3.035 20 5 GGBDRN CC[C@@H](C)N(Cc1ccccc1)C(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O ZINC000023229499 1399542310 /nfs/dbraw/zinc/54/23/10/1399542310.db2.gz JLDNJXBFCWVUAS-CQSZACIVSA-N 0 0 395.415 3.018 20 5 GGBDRN O=C(NC[C@H]1COc2ccccc2C1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000023240489 1399543321 /nfs/dbraw/zinc/54/33/21/1399543321.db2.gz MLYYMVXGOYSWSP-INIZCTEOSA-N 0 0 395.459 3.179 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCCNC(=O)C(C)C)cc1[N+](=O)[O-] ZINC000023326272 1399549865 /nfs/dbraw/zinc/54/98/65/1399549865.db2.gz SOMDMKBWIMVSKD-UHFFFAOYSA-N 0 0 381.498 3.235 20 5 GGBDRN COc1ccc([C@@H](NC(=O)COC(=O)c2ccc([N+](=O)[O-])s2)C2CC2)cc1 ZINC000023344059 1399550635 /nfs/dbraw/zinc/55/06/35/1399550635.db2.gz VCXDBHTWXBEBHR-KRWDZBQOSA-N 0 0 390.417 3.089 20 5 GGBDRN CC(C)N(Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000023382537 1399554437 /nfs/dbraw/zinc/55/44/37/1399554437.db2.gz RSRJOWBCUMQDSK-OAQYLSRUSA-N 0 0 396.447 3.230 20 5 GGBDRN CCCN(Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000023383961 1399555020 /nfs/dbraw/zinc/55/50/20/1399555020.db2.gz RZKPQPHYZPLXJB-OAQYLSRUSA-N 0 0 396.447 3.232 20 5 GGBDRN Cc1cc(C(=O)COC(=O)CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C)[nH]1 ZINC000023394031 1399556261 /nfs/dbraw/zinc/55/62/61/1399556261.db2.gz ZMOVXEVECNXCOV-UHFFFAOYSA-N 0 0 399.325 3.397 20 5 GGBDRN Nc1cc([N+](=O)[O-])ccc1C(=O)OCCOc1cccc(Br)c1 ZINC000023394622 1399556439 /nfs/dbraw/zinc/55/64/39/1399556439.db2.gz MMPPJRIYJITGEY-UHFFFAOYSA-N 0 0 381.182 3.175 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(C[C@@H](O)c2ccccc2)CC1 ZINC000023409762 1399557456 /nfs/dbraw/zinc/55/74/56/1399557456.db2.gz CIPSBAKWMOZVNW-GOSISDBHSA-N 0 0 395.381 3.469 20 5 GGBDRN COc1ccc(S(=O)(=O)NCCCc2ccc(C)cc2C)c([N+](=O)[O-])c1 ZINC000023402731 1399557487 /nfs/dbraw/zinc/55/74/87/1399557487.db2.gz OSTPNCXIKNWRAN-UHFFFAOYSA-N 0 0 378.450 3.131 20 5 GGBDRN COc1ccc([C@@H](NS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])C(C)C)cc1 ZINC000023403261 1399557536 /nfs/dbraw/zinc/55/75/36/1399557536.db2.gz PIPRZAKHNFQJCB-SFHVURJKSA-N 0 0 394.449 3.288 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccncc3)n2C)cccc1[N+](=O)[O-] ZINC000023413747 1399557949 /nfs/dbraw/zinc/55/79/49/1399557949.db2.gz TWVMUYIFRKLLPJ-LBPRGKRZSA-N 0 0 398.448 3.213 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2nnc3n2CCCCC3)cccc1[N+](=O)[O-] ZINC000023432368 1399560213 /nfs/dbraw/zinc/56/02/13/1399560213.db2.gz SQAAEOYWPUDGAZ-GFCCVEGCSA-N 0 0 375.454 3.340 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 ZINC000023457976 1399562913 /nfs/dbraw/zinc/56/29/13/1399562913.db2.gz ZTZSWSQWHJFHHL-CYBMUJFWSA-N 0 0 395.481 3.155 20 5 GGBDRN COC(=O)c1cc(C(=O)OCCOc2cccc(Cl)c2)cc([N+](=O)[O-])c1 ZINC000023514859 1399567574 /nfs/dbraw/zinc/56/75/74/1399567574.db2.gz HNJWEJCTFIKVQO-UHFFFAOYSA-N 0 0 379.752 3.271 20 5 GGBDRN Cc1ccc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cn1 ZINC000023518887 1399567952 /nfs/dbraw/zinc/56/79/52/1399567952.db2.gz 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ZINC000029890800 1400372554 /nfs/dbraw/zinc/37/25/54/1400372554.db2.gz APEHQMQCEXZGDU-UHFFFAOYSA-N 0 0 399.432 3.148 20 5 GGBDRN O=C(Nc1ccccc1)N1CCC(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000029890958 1400372665 /nfs/dbraw/zinc/37/26/65/1400372665.db2.gz JUIOYSZQFQXSJM-UHFFFAOYSA-N 0 0 394.431 3.428 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000029890029 1400372727 /nfs/dbraw/zinc/37/27/27/1400372727.db2.gz SNIMAYRIQPGCAT-UHFFFAOYSA-N 0 0 375.425 3.131 20 5 GGBDRN CCOc1ccccc1C(=O)NCCCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000029889681 1400372785 /nfs/dbraw/zinc/37/27/85/1400372785.db2.gz UUUWZLVGSYZPSU-UHFFFAOYSA-N 0 0 397.431 3.093 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-n3ccnc3)cc2)cc1OC ZINC000029913437 1400377621 /nfs/dbraw/zinc/37/76/21/1400377621.db2.gz JVGSFZHOVVHORI-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN O=c1cc(CNc2cc([N+](=O)[O-])ccc2OC(F)F)nc2ccc(Cl)cn12 ZINC000055843200 1407101541 /nfs/dbraw/zinc/10/15/41/1407101541.db2.gz NBABRLDMOIHURJ-UHFFFAOYSA-N 0 0 396.737 3.470 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)Oc1ccc(-n2ccnc2)cc1 ZINC000029938229 1400383267 /nfs/dbraw/zinc/38/32/67/1400383267.db2.gz ULYNMBQZRPOMGV-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN COc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cn1 ZINC000030009517 1400396842 /nfs/dbraw/zinc/39/68/42/1400396842.db2.gz JDMSUHSABOYEGK-VIFPVBQESA-N 0 0 384.314 3.456 20 5 GGBDRN CN(CCCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccccc1 ZINC000030014816 1400398273 /nfs/dbraw/zinc/39/82/73/1400398273.db2.gz USIGXXLUQYWWJI-UHFFFAOYSA-N 0 0 382.464 3.451 20 5 GGBDRN CCC(=O)Nc1ccc(C)c(NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000055848588 1407103102 /nfs/dbraw/zinc/10/31/02/1407103102.db2.gz FGKBXJFOLPQCLE-UHFFFAOYSA-N 0 0 386.408 3.311 20 5 GGBDRN COc1ccc(NC(=O)CNc2cc(NC(=O)C3CC3)ccc2C)c([N+](=O)[O-])c1 ZINC000055849578 1407103256 /nfs/dbraw/zinc/10/32/56/1407103256.db2.gz OBUMQMKVWVTTOU-UHFFFAOYSA-N 0 0 398.419 3.311 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N(C)Cc3ccncc3)cc2)c(C)c1[N+](=O)[O-] ZINC000042803974 1400418093 /nfs/dbraw/zinc/41/80/93/1400418093.db2.gz RJUIKBXGIOCFOT-UHFFFAOYSA-N 0 0 379.420 3.124 20 5 GGBDRN Cc1ccc(OC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)c([N+](=O)[O-])c1 ZINC000042848796 1400421238 /nfs/dbraw/zinc/42/12/38/1400421238.db2.gz JPKHVXQVXSGQNA-UHFFFAOYSA-N 0 0 389.429 3.161 20 5 GGBDRN CCN(CC)C(=O)c1cccc(NC(=O)CN2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000042854636 1400422958 /nfs/dbraw/zinc/42/29/58/1400422958.db2.gz USURZCAZLAGVIM-UHFFFAOYSA-N 0 0 396.447 3.078 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CC(=O)N(c2ccccc2)C1 ZINC000042918079 1400429816 /nfs/dbraw/zinc/42/98/16/1400429816.db2.gz XLLKUWCMUWKSBW-LLVKDONJSA-N 0 0 391.330 3.188 20 5 GGBDRN O=C(Cc1ccc2c(c1)OCCO2)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000042918539 1400429820 /nfs/dbraw/zinc/42/98/20/1400429820.db2.gz MIFDSHQFWOWFEE-UHFFFAOYSA-N 0 0 380.303 3.149 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CC(=O)Nc2cc(F)ccc21 ZINC000042918160 1400429831 /nfs/dbraw/zinc/42/98/31/1400429831.db2.gz NCLHCOBFYAKXBR-LLVKDONJSA-N 0 0 395.293 3.400 20 5 GGBDRN CCC(CC)CN(CC)C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000042919236 1400429859 /nfs/dbraw/zinc/42/98/59/1400429859.db2.gz KSBFYZNSGCGWSN-UHFFFAOYSA-N 0 0 386.452 3.347 20 5 GGBDRN O=C(CCNC(=O)c1cccs1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000042918392 1400429866 /nfs/dbraw/zinc/42/98/66/1400429866.db2.gz XRLYRWWPOLPJAT-UHFFFAOYSA-N 0 0 385.348 3.016 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CC(=O)Nc2cc(F)ccc21 ZINC000042918161 1400429874 /nfs/dbraw/zinc/42/98/74/1400429874.db2.gz NCLHCOBFYAKXBR-NSHDSACASA-N 0 0 395.293 3.400 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccs1 ZINC000042918185 1400429877 /nfs/dbraw/zinc/42/98/77/1400429877.db2.gz GYFLGJSCLCQVKY-LBPRGKRZSA-N 0 0 399.375 3.464 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CC(c2ccccc2)=NO1 ZINC000042918023 1400429894 /nfs/dbraw/zinc/42/98/94/1400429894.db2.gz RSGFCMCBYPQDLC-OAHLLOKOSA-N 0 0 377.303 3.328 20 5 GGBDRN O=C(CCNC(=O)c1ccsc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000042918375 1400429910 /nfs/dbraw/zinc/42/99/10/1400429910.db2.gz DXKQXKHRWIJJKB-UHFFFAOYSA-N 0 0 385.348 3.016 20 5 GGBDRN CC(=O)NCc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000042918347 1400429917 /nfs/dbraw/zinc/42/99/17/1400429917.db2.gz WTYPQJCKEZNLQQ-UHFFFAOYSA-N 0 0 379.319 3.085 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(Cn2cncn2)cc1 ZINC000042918192 1400429947 /nfs/dbraw/zinc/42/99/47/1400429947.db2.gz IMJZLPRCFAQBFA-UHFFFAOYSA-N 0 0 389.318 3.088 20 5 GGBDRN COc1cc(C(=O)N(C)CCCOc2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000055869861 1407109752 /nfs/dbraw/zinc/10/97/52/1407109752.db2.gz XJHXMBDPLCGIGS-UHFFFAOYSA-N 0 0 388.420 3.462 20 5 GGBDRN CCCC(=O)Nc1cccc(NCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000055876585 1407114285 /nfs/dbraw/zinc/11/42/85/1407114285.db2.gz VBFFOHLJKGDDLO-UHFFFAOYSA-N 0 0 386.408 3.393 20 5 GGBDRN CCCC(=O)Nc1cccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000055876587 1407114344 /nfs/dbraw/zinc/11/43/44/1407114344.db2.gz IRZGLQZNSNOTAX-UHFFFAOYSA-N 0 0 386.408 3.393 20 5 GGBDRN CCOc1ccc(NC(=O)CNc2ccc(-n3cccn3)c(F)c2)c([N+](=O)[O-])c1 ZINC000055880094 1407115690 /nfs/dbraw/zinc/11/56/90/1407115690.db2.gz GQBJCIJBILYQEI-UHFFFAOYSA-N 0 0 399.382 3.369 20 5 GGBDRN CCNC(=O)c1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C)c1 ZINC000055881543 1407116659 /nfs/dbraw/zinc/11/66/59/1407116659.db2.gz SOQUHHQCIWLHML-UHFFFAOYSA-N 0 0 381.392 3.315 20 5 GGBDRN CC(C)NC(=O)c1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000055880894 1407116666 /nfs/dbraw/zinc/11/66/66/1407116666.db2.gz YQLQBPMRJTZXGP-UHFFFAOYSA-N 0 0 381.392 3.395 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc(C)c(NC(C)=O)c2C)cc([N+](=O)[O-])c1 ZINC000055888657 1407118609 /nfs/dbraw/zinc/11/86/09/1407118609.db2.gz WGGVROIIAXXDCB-UHFFFAOYSA-N 0 0 385.376 3.209 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(C)c(NC(C)=O)c2C)c([N+](=O)[O-])cc1OC ZINC000055887532 1407118840 /nfs/dbraw/zinc/11/88/40/1407118840.db2.gz SEJWWYIULINQHJ-UHFFFAOYSA-N 0 0 387.392 3.440 20 5 GGBDRN CC(=O)Nc1c(C)ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1C ZINC000055888799 1407118985 /nfs/dbraw/zinc/11/89/85/1407118985.db2.gz JDAYCZPWIIBLKY-UHFFFAOYSA-N 0 0 394.391 3.003 20 5 GGBDRN Cc1cc(C(=O)N2CCN(CCCOc3ccc([N+](=O)[O-])cc3)CC2)c(C)o1 ZINC000055904908 1407127132 /nfs/dbraw/zinc/12/71/32/1407127132.db2.gz HNFIUFUREHJIGM-UHFFFAOYSA-N 0 0 387.436 3.032 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1Cl ZINC000055905699 1407128115 /nfs/dbraw/zinc/12/81/15/1407128115.db2.gz JASWKNBSNPEWKS-UHFFFAOYSA-N 0 0 376.800 3.049 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1Cl ZINC000055906052 1407128247 /nfs/dbraw/zinc/12/82/47/1407128247.db2.gz NCCGGTKCUBYRJI-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN CC1CCN(C(=O)c2ccccc2NC(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000055926318 1407135119 /nfs/dbraw/zinc/13/51/19/1407135119.db2.gz YQNWBGAVLWSOCV-UHFFFAOYSA-N 0 0 397.431 3.484 20 5 GGBDRN O=C(Nc1cccc2c1OCCO2)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000055950892 1407146252 /nfs/dbraw/zinc/14/62/52/1407146252.db2.gz HZNAWNKBYUZEJG-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN COc1ccc(CSCC(=O)Nc2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000055952380 1407146553 /nfs/dbraw/zinc/14/65/53/1407146553.db2.gz AMFCUSBOUIYYAD-UHFFFAOYSA-N 0 0 390.417 3.247 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccc(-n3ccnc3)cc2)c(Cl)c1 ZINC000055957149 1407149181 /nfs/dbraw/zinc/14/91/81/1407149181.db2.gz FWYXZTGOQAPUFM-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN CNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 ZINC000055958151 1407149236 /nfs/dbraw/zinc/14/92/36/1407149236.db2.gz HOLXDGRMWQZQEE-SNVBAGLBSA-N 0 0 393.852 3.264 20 5 GGBDRN CC(C)Oc1ccccc1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000055957689 1407149243 /nfs/dbraw/zinc/14/92/43/1407149243.db2.gz POWMUWRPONUWAJ-UHFFFAOYSA-N 0 0 380.404 3.498 20 5 GGBDRN CC[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000055965714 1407151644 /nfs/dbraw/zinc/15/16/44/1407151644.db2.gz BFOMGSZAWSTJAD-HNNXBMFYSA-N 0 0 386.404 3.402 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccco2)Cc2ccco2)c(F)c1 ZINC000055972936 1407154043 /nfs/dbraw/zinc/15/40/43/1407154043.db2.gz MFPGEQWPTVRUIU-UHFFFAOYSA-N 0 0 380.353 3.311 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2ccccc2)c2ccccn2)c(F)c1 ZINC000055972686 1407154130 /nfs/dbraw/zinc/15/41/30/1407154130.db2.gz UBJZBWBBUSOZTB-SFHVURJKSA-N 0 0 387.392 3.197 20 5 GGBDRN O=C(NCc1cccc(NC(=O)c2ccncc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000055986968 1407159726 /nfs/dbraw/zinc/15/97/26/1407159726.db2.gz LPOZGXGVQGIWCA-UHFFFAOYSA-N 0 0 376.372 3.172 20 5 GGBDRN O=C(NCc1cccc(NC(=O)c2ccncc2)c1)c1csc([N+](=O)[O-])c1 ZINC000055987361 1407159870 /nfs/dbraw/zinc/15/98/70/1407159870.db2.gz HARKGPVZPUXNDQ-UHFFFAOYSA-N 0 0 382.401 3.234 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(NC(=O)Cc3ccccc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000055988122 1407160577 /nfs/dbraw/zinc/16/05/77/1407160577.db2.gz BXTGJMSIDWEJGL-GJZGRUSLSA-N 0 0 397.431 3.025 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)C[C@@H](C)O1 ZINC000055988165 1407161855 /nfs/dbraw/zinc/16/18/55/1407161855.db2.gz FYQXZNZVLUKTGE-HUUCEWRRSA-N 0 0 397.431 3.025 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NC(=O)c3csc([N+](=O)[O-])c3)cc2)C[C@H](C)O1 ZINC000055989385 1407163053 /nfs/dbraw/zinc/16/30/53/1407163053.db2.gz GUJDHBNHAUXAHE-TXEJJXNPSA-N 0 0 389.433 3.158 20 5 GGBDRN C[C@H](Cn1ccnc1)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000055996506 1407165840 /nfs/dbraw/zinc/16/58/40/1407165840.db2.gz OJWFAVXONGJXQQ-CABCVRRESA-N 0 0 394.435 3.178 20 5 GGBDRN Cn1cc(C(=O)Nc2ccc(-c3nnco3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000055996126 1407165984 /nfs/dbraw/zinc/16/59/84/1407165984.db2.gz WWFMPRUZIDIPHA-UHFFFAOYSA-N 0 0 390.359 3.298 20 5 GGBDRN C[C@@H](Cn1ccnc1)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000055996505 1407166086 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1404164474 /nfs/dbraw/zinc/16/44/74/1404164474.db2.gz PEMRIYKMZWRHEM-UHFFFAOYSA-N 0 0 382.420 3.333 20 5 GGBDRN O=C(Nc1ccccc1)C1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000045622129 1404164697 /nfs/dbraw/zinc/16/46/97/1404164697.db2.gz WKHRGGTXDJGEAO-UHFFFAOYSA-N 0 0 382.420 3.155 20 5 GGBDRN CC[C@H](C)NC(=O)c1cccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000045623291 1404164763 /nfs/dbraw/zinc/16/47/63/1404164763.db2.gz RLIBUJNCWXADOC-AWEZNQCLSA-N 0 0 384.436 3.123 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCc2ccccc21 ZINC000045670661 1404173149 /nfs/dbraw/zinc/17/31/49/1404173149.db2.gz IDQHCNMXOYJRJN-QGZVFWFLSA-N 0 0 399.472 3.036 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCCSc1ccccc1 ZINC000045675641 1404174651 /nfs/dbraw/zinc/17/46/51/1404174651.db2.gz AOMPJUWLSVPBSI-AWEZNQCLSA-N 0 0 387.461 3.012 20 5 GGBDRN C[C@@H]1CCCN(Cc2csc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)n2)C1 ZINC000045678410 1404175535 /nfs/dbraw/zinc/17/55/35/1404175535.db2.gz VANXAWCRUHUCLH-LLVKDONJSA-N 0 0 375.454 3.118 20 5 GGBDRN Cc1c(C(=O)N2CCC([C@@H](O)c3ccccc3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000045685664 1404177923 /nfs/dbraw/zinc/17/79/23/1404177923.db2.gz BPFKNVDOQOZIRU-IBGZPJMESA-N 0 0 399.403 3.397 20 5 GGBDRN CC(C)c1cccc(O[C@@H](C)C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000045731705 1404188601 /nfs/dbraw/zinc/18/86/01/1404188601.db2.gz LDMNLALDQRTXHJ-INIZCTEOSA-N 0 0 398.463 3.229 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)c1ccc(C(F)(F)F)cc1 ZINC000045733695 1404189203 /nfs/dbraw/zinc/18/92/03/1404189203.db2.gz KBQHPEYMRPZSHW-SECBINFHSA-N 0 0 389.355 3.434 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)NC1CCN(C(=O)c2ccccc2F)CC1 ZINC000045737861 1404191214 /nfs/dbraw/zinc/19/12/14/1404191214.db2.gz JLQYONYVBHNSMR-UHFFFAOYSA-N 0 0 386.383 3.160 20 5 GGBDRN CN(C)c1c(Cl)cccc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000045760245 1404196786 /nfs/dbraw/zinc/19/67/86/1404196786.db2.gz AYLGKJYFCXSJTC-UHFFFAOYSA-N 0 0 390.827 3.073 20 5 GGBDRN CCOC(=O)c1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000045763382 1404197238 /nfs/dbraw/zinc/19/72/38/1404197238.db2.gz DULCZNCKKHEOBS-UHFFFAOYSA-N 0 0 380.360 3.210 20 5 GGBDRN CC(=O)Nc1ccc(F)c(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000045769182 1404199174 /nfs/dbraw/zinc/19/91/74/1404199174.db2.gz LTVQMNJIEYRXFM-UHFFFAOYSA-N 0 0 383.339 3.130 20 5 GGBDRN COc1ccc2cc(CNS(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)ccc2c1 ZINC000045799439 1404207862 /nfs/dbraw/zinc/20/78/62/1404207862.db2.gz XZRHXHSXQRFQMP-UHFFFAOYSA-N 0 0 386.429 3.376 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2cc(-c3ccccc3)no2)c1C ZINC000045812474 1404212803 /nfs/dbraw/zinc/21/28/03/1404212803.db2.gz NNYBWRRCIZGSQJ-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN CCN(CC)C(=O)c1ccc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000045819463 1404214594 /nfs/dbraw/zinc/21/45/94/1404214594.db2.gz HHONMHUGKJMLFR-UHFFFAOYSA-N 0 0 398.463 3.418 20 5 GGBDRN CC(C)c1ccc(CN(C)C(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000045825715 1404216755 /nfs/dbraw/zinc/21/67/55/1404216755.db2.gz IZBRYNRUXDDOKK-HNNXBMFYSA-N 0 0 383.448 3.495 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)Nc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000045829758 1404217460 /nfs/dbraw/zinc/21/74/60/1404217460.db2.gz LTHKTXOJOHSNHA-UHFFFAOYSA-N 0 0 391.359 3.405 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000045864294 1404227752 /nfs/dbraw/zinc/22/77/52/1404227752.db2.gz SHQUSQPTEBGMPJ-UHFFFAOYSA-N 0 0 383.404 3.332 20 5 GGBDRN CCOc1cccc(CNC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000045881786 1404234060 /nfs/dbraw/zinc/23/40/60/1404234060.db2.gz VGHHUDKMDULBAR-UHFFFAOYSA-N 0 0 384.436 3.025 20 5 GGBDRN CC(=O)c1ccc(NC[C@H](c2cccs2)N2CCOCC2)c([N+](=O)[O-])c1 ZINC000045910007 1404240429 /nfs/dbraw/zinc/24/04/29/1404240429.db2.gz DDOXSOKXQUAWAZ-QGZVFWFLSA-N 0 0 375.450 3.344 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000045918474 1404242742 /nfs/dbraw/zinc/24/27/42/1404242742.db2.gz GTUCXVFVZPNQNU-GFCCVEGCSA-N 0 0 396.852 3.242 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCCC(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000045924218 1404243964 /nfs/dbraw/zinc/24/39/64/1404243964.db2.gz OZOLUHKSXPLQNI-UHFFFAOYSA-N 0 0 381.498 3.378 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccnc(OCC(F)(F)F)c1 ZINC000045936249 1404246891 /nfs/dbraw/zinc/24/68/91/1404246891.db2.gz ALVQHXZICKCXKC-UHFFFAOYSA-N 0 0 398.341 3.273 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000045960014 1404252467 /nfs/dbraw/zinc/25/24/67/1404252467.db2.gz VLDKTBXKXFIZBQ-UHFFFAOYSA-N 0 0 376.800 3.320 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000045962018 1404253094 /nfs/dbraw/zinc/25/30/94/1404253094.db2.gz FSTSVQRRCDYFOX-UHFFFAOYSA-N 0 0 382.420 3.052 20 5 GGBDRN COCCOc1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)s2)cc1OC ZINC000045967933 1404255353 /nfs/dbraw/zinc/25/53/53/1404255353.db2.gz ZKIQQIPFDVDFFI-NSHDSACASA-N 0 0 394.449 3.490 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000045979504 1404259830 /nfs/dbraw/zinc/25/98/30/1404259830.db2.gz UVQZGASMOPUXIS-LBPRGKRZSA-N 0 0 385.445 3.449 20 5 GGBDRN C[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000045981746 1404261317 /nfs/dbraw/zinc/26/13/17/1404261317.db2.gz LFLDOQMSKPLEFI-ZDUSSCGKSA-N 0 0 382.420 3.159 20 5 GGBDRN C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000045981749 1404261477 /nfs/dbraw/zinc/26/14/77/1404261477.db2.gz LFLDOQMSKPLEFI-CYBMUJFWSA-N 0 0 382.420 3.159 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000045983548 1404261938 /nfs/dbraw/zinc/26/19/38/1404261938.db2.gz NVKWVQICMYHUIW-LLVKDONJSA-N 0 0 398.375 3.187 20 5 GGBDRN CCOc1ccc(C(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000045983948 1404262269 /nfs/dbraw/zinc/26/22/69/1404262269.db2.gz OIRIUKUULFZIJN-GFCCVEGCSA-N 0 0 383.404 3.369 20 5 GGBDRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000045983945 1404262322 /nfs/dbraw/zinc/26/23/22/1404262322.db2.gz OIRIUKUULFZIJN-LBPRGKRZSA-N 0 0 383.404 3.369 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000045993263 1404266503 /nfs/dbraw/zinc/26/65/03/1404266503.db2.gz DFOQPZLQPRFXHQ-UHFFFAOYSA-N 0 0 389.433 3.212 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000046023338 1404276903 /nfs/dbraw/zinc/27/69/03/1404276903.db2.gz IMESRWUZFARROB-UHFFFAOYSA-N 0 0 376.800 3.049 20 5 GGBDRN Cc1cc(N2CCN(CCOc3cccc([N+](=O)[O-])c3)CC2)nc(C(C)C)n1 ZINC000046056789 1404285063 /nfs/dbraw/zinc/28/50/63/1404285063.db2.gz HSIVDOAJRFMSPF-UHFFFAOYSA-N 0 0 385.468 3.018 20 5 GGBDRN O=C(Nc1ccc2oc(=O)[nH]c2c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000056655203 1407394853 /nfs/dbraw/zinc/39/48/53/1407394853.db2.gz AXVBZZJWHPJLOY-UHFFFAOYSA-N 0 0 397.265 3.223 20 5 GGBDRN O=C(c1cc[nH]n1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000046121334 1404306038 /nfs/dbraw/zinc/30/60/38/1404306038.db2.gz UKNUNDZGCRYXMQ-UHFFFAOYSA-N 0 0 397.460 3.004 20 5 GGBDRN C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000046136876 1404309894 /nfs/dbraw/zinc/30/98/94/1404309894.db2.gz QMMKIPPHNAIQGH-LBPRGKRZSA-N 0 0 391.424 3.111 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000046136643 1404310062 /nfs/dbraw/zinc/31/00/62/1404310062.db2.gz GSAVDAPTDIQDRU-UHFFFAOYSA-N 0 0 384.392 3.036 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(Cl)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000046147980 1404311281 /nfs/dbraw/zinc/31/12/81/1404311281.db2.gz PKENGAKWEXDWLO-UHFFFAOYSA-N 0 0 375.812 3.075 20 5 GGBDRN CCOc1ccccc1C(=O)N[C@H](C(=O)NCc1ccccc1[N+](=O)[O-])C(C)C ZINC000046147000 1404311465 /nfs/dbraw/zinc/31/14/65/1404311465.db2.gz GXAMPMCTJDKUJS-IBGZPJMESA-N 0 0 399.447 3.064 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)NCc3ccccc3[N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000046149150 1404312489 /nfs/dbraw/zinc/31/24/89/1404312489.db2.gz NAWAOQGZZCNVSF-HZPDHXFCSA-N 0 0 383.448 3.134 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cnc2c(cnn2Cc2ccccc2)c1 ZINC000046149210 1404312734 /nfs/dbraw/zinc/31/27/34/1404312734.db2.gz QCAQZQBFXZNQDZ-UHFFFAOYSA-N 0 0 387.399 3.318 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc(Cl)cc2C(=O)OC)cc([N+](=O)[O-])c1 ZINC000046157030 1404314751 /nfs/dbraw/zinc/31/47/51/1404314751.db2.gz IFUJGAGRFSTMMS-UHFFFAOYSA-N 0 0 392.751 3.074 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)CC[C@H]1CCCO1)c1ccccc1[N+](=O)[O-] ZINC000046189026 1404326390 /nfs/dbraw/zinc/32/63/90/1404326390.db2.gz MAWKYYYUXXLEGI-GDBMZVCRSA-N 0 0 378.425 3.053 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1cccc(Cl)c1-n1cncn1 ZINC000046221777 1404335225 /nfs/dbraw/zinc/33/52/25/1404335225.db2.gz QQKARXNQDMCGBG-UHFFFAOYSA-N 0 0 386.799 3.270 20 5 GGBDRN Cc1ccc(C(=O)N[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000046223371 1404336341 /nfs/dbraw/zinc/33/63/41/1404336341.db2.gz QIEPGVNSDCCCHY-IBGZPJMESA-N 0 0 383.448 3.316 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCCc2cc(F)c(F)cc21 ZINC000046222770 1404336486 /nfs/dbraw/zinc/33/64/86/1404336486.db2.gz LJOOJLFCWPFVIO-UHFFFAOYSA-N 0 0 385.330 3.047 20 5 GGBDRN CC[C@H](CO)Nc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000046231178 1404338874 /nfs/dbraw/zinc/33/88/74/1404338874.db2.gz AIBDCYDGULBYGA-CQSZACIVSA-N 0 0 393.465 3.195 20 5 GGBDRN CCN(CC)C(=O)COc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1Cl ZINC000046242352 1404342682 /nfs/dbraw/zinc/34/26/82/1404342682.db2.gz IXCQAKUVWMXPAX-UHFFFAOYSA-N 0 0 395.799 3.341 20 5 GGBDRN C[C@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000046243767 1404342835 /nfs/dbraw/zinc/34/28/35/1404342835.db2.gz KPACVCCUDPHHOD-CQSZACIVSA-N 0 0 388.493 3.021 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccc(NC(=O)c2ccncc2)c1 ZINC000046244441 1404343699 /nfs/dbraw/zinc/34/36/99/1404343699.db2.gz ZEZQQGOJAUEOBF-UHFFFAOYSA-N 0 0 376.372 3.423 20 5 GGBDRN O=C(Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000046265880 1404349932 /nfs/dbraw/zinc/34/99/32/1404349932.db2.gz FCNVDOCCMYEXLF-UHFFFAOYSA-N 0 0 390.348 3.412 20 5 GGBDRN COC(=O)c1cc(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)oc1C ZINC000046264417 1404349997 /nfs/dbraw/zinc/34/99/97/1404349997.db2.gz BMUQOHLDPGXFJV-LLVKDONJSA-N 0 0 378.406 3.080 20 5 GGBDRN CC(=O)Nc1c(C)ccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1C ZINC000056690572 1407399581 /nfs/dbraw/zinc/39/95/81/1407399581.db2.gz PMMUUJJYXRWVCE-UHFFFAOYSA-N 0 0 385.424 3.404 20 5 GGBDRN COCc1ccc(CNC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000046293701 1404354616 /nfs/dbraw/zinc/35/46/16/1404354616.db2.gz LLIBWIHJJDAJLB-UHFFFAOYSA-N 0 0 379.210 3.434 20 5 GGBDRN Cc1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)cccc1[N+](=O)[O-] ZINC000046306601 1404358848 /nfs/dbraw/zinc/35/88/48/1404358848.db2.gz TXNFTDRVTQOQRR-LLVKDONJSA-N 0 0 375.331 3.173 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)c3ccc([N+](=O)[O-])cc3Cl)cn2)n1 ZINC000046310342 1404359526 /nfs/dbraw/zinc/35/95/26/1404359526.db2.gz ZAKVAYJTMQFKKO-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN COc1ccc(C(=O)C2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000046326378 1404364337 /nfs/dbraw/zinc/36/43/37/1404364337.db2.gz XTALBERYMNCDQB-UHFFFAOYSA-N 0 0 398.415 3.104 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000046328248 1404366039 /nfs/dbraw/zinc/36/60/39/1404366039.db2.gz UVXYBCJWSQWOGM-UHFFFAOYSA-N 0 0 378.388 3.166 20 5 GGBDRN CC(C)(C)NC(=O)c1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000046331965 1404366553 /nfs/dbraw/zinc/36/65/53/1404366553.db2.gz WLSDTPGNXMGJLB-UHFFFAOYSA-N 0 0 381.392 3.252 20 5 GGBDRN Cc1ncc(-c2ccc(NC(=O)[C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)cc2)o1 ZINC000046333727 1404366923 /nfs/dbraw/zinc/36/69/23/1404366923.db2.gz ZRNPRFXHDJCZSV-LBPRGKRZSA-N 0 0 394.387 3.315 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1[N+](=O)[O-] ZINC000046336225 1404368414 /nfs/dbraw/zinc/36/84/14/1404368414.db2.gz ROOKHVGHOIXZPH-AWEZNQCLSA-N 0 0 397.431 3.052 20 5 GGBDRN COc1cc([C@@H](C)NC(=O)Cn2cc([N+](=O)[O-])cn2)ccc1OCCC(C)C ZINC000046338749 1404369743 /nfs/dbraw/zinc/36/97/43/1404369743.db2.gz CRCIVCVCBVEQPL-CQSZACIVSA-N 0 0 390.440 3.102 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000046343775 1404372768 /nfs/dbraw/zinc/37/27/68/1404372768.db2.gz JHOTUQDYICMURB-HZPDHXFCSA-N 0 0 383.448 3.385 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000046343921 1404372842 /nfs/dbraw/zinc/37/28/42/1404372842.db2.gz ZOBBDOLOTWEZJI-IYBDPMFKSA-N 0 0 383.448 3.385 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000046343771 1404373180 /nfs/dbraw/zinc/37/31/80/1404373180.db2.gz JHOTUQDYICMURB-IYBDPMFKSA-N 0 0 383.448 3.385 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2NC(=O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000046345055 1404374744 /nfs/dbraw/zinc/37/47/44/1404374744.db2.gz CAWAIKWRYZFHAQ-HOTGVXAUSA-N 0 0 399.447 3.222 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCn3cccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000046356823 1404380316 /nfs/dbraw/zinc/38/03/16/1404380316.db2.gz CXEDDNPYHOCMQM-CYBMUJFWSA-N 0 0 375.450 3.242 20 5 GGBDRN O=C(c1cc2ccc(Cl)cc2[nH]1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000046385304 1404390745 /nfs/dbraw/zinc/39/07/45/1404390745.db2.gz RADBIXHYCAURTI-UHFFFAOYSA-N 0 0 385.811 3.087 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1cc2c(cc1Cl)NC(=O)CO2 ZINC000046392160 1404394993 /nfs/dbraw/zinc/39/49/93/1404394993.db2.gz ZKBZBSRQIDOEGF-UHFFFAOYSA-N 0 0 390.783 3.020 20 5 GGBDRN COc1ccc(F)cc1[C@H](C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000046403530 1404400805 /nfs/dbraw/zinc/40/08/05/1404400805.db2.gz ITISLQMILRRMMK-LBPRGKRZSA-N 0 0 384.367 3.419 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1ccc(C(F)(F)F)cc1 ZINC000046481284 1404438517 /nfs/dbraw/zinc/43/85/17/1404438517.db2.gz FITPTQXWOVQFPX-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN Cc1cc(C(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)c(C)n1CC(F)(F)F ZINC000046487309 1404441268 /nfs/dbraw/zinc/44/12/68/1404441268.db2.gz AYMCXGLOPVTNGI-UHFFFAOYSA-N 0 0 397.309 3.366 20 5 GGBDRN COC(=O)Nc1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000046520675 1404459589 /nfs/dbraw/zinc/45/95/89/1404459589.db2.gz XLDIYYMCARRWFW-UHFFFAOYSA-N 0 0 375.337 3.043 20 5 GGBDRN CCOC(=O)COc1cccc(NC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)c1 ZINC000046588008 1404494002 /nfs/dbraw/zinc/49/40/02/1404494002.db2.gz UPKMNAYGTGOOBK-UHFFFAOYSA-N 0 0 388.376 3.188 20 5 GGBDRN C[C@@H](NC(=O)[C@@H](C)N(C)Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000046599709 1404500428 /nfs/dbraw/zinc/50/04/28/1404500428.db2.gz SWXVLEVQIYBWFQ-HUUCEWRRSA-N 0 0 399.447 3.064 20 5 GGBDRN COc1ccc(CN(C)C(=O)[C@@H](C)N(C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000046599741 1404500686 /nfs/dbraw/zinc/50/06/86/1404500686.db2.gz YPVYFAQLJKPKSO-CQSZACIVSA-N 0 0 389.427 3.221 20 5 GGBDRN C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599240 1404500724 /nfs/dbraw/zinc/50/07/24/1404500724.db2.gz AJWQYGIHVNAJJT-ZDUSSCGKSA-N 0 0 379.424 3.299 20 5 GGBDRN C[C@H](NC(=O)N1CCN(CCc2cccs2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000056726784 1407409865 /nfs/dbraw/zinc/40/98/65/1407409865.db2.gz QSRDIQFOYVLVIO-HNNXBMFYSA-N 0 0 388.493 3.287 20 5 GGBDRN COCCOCc1cccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000046616214 1404512571 /nfs/dbraw/zinc/51/25/71/1404512571.db2.gz IACFHMYXWVZPLJ-UHFFFAOYSA-N 0 0 390.392 3.027 20 5 GGBDRN CN(CCCCc1ccccc1)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000046632438 1404520111 /nfs/dbraw/zinc/52/01/11/1404520111.db2.gz KOPFLGFTIOGYHK-UHFFFAOYSA-N 0 0 383.448 3.196 20 5 GGBDRN CCN(C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@@H](C)c1ccc(F)cc1 ZINC000046645508 1404528774 /nfs/dbraw/zinc/52/87/74/1404528774.db2.gz MLCAVUPSXYOTDE-LBPRGKRZSA-N 0 0 387.367 3.252 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1cccc(Cl)c1 ZINC000046658668 1404538043 /nfs/dbraw/zinc/53/80/43/1404538043.db2.gz VOZNCIYVJASIRL-UHFFFAOYSA-N 0 0 381.779 3.192 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCOc1cccc(F)c1 ZINC000046685501 1404552392 /nfs/dbraw/zinc/55/23/92/1404552392.db2.gz JAXYGPPEYCQLJG-UHFFFAOYSA-N 0 0 390.414 3.489 20 5 GGBDRN O=C(NCc1ccc(-n2cccn2)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000046699820 1404556962 /nfs/dbraw/zinc/55/69/62/1404556962.db2.gz FHMHHGPVRLGBGX-UHFFFAOYSA-N 0 0 391.431 3.311 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000046706295 1404558821 /nfs/dbraw/zinc/55/88/21/1404558821.db2.gz USPMUDWKWQUNGH-UHFFFAOYSA-N 0 0 382.420 3.115 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000046710630 1404560693 /nfs/dbraw/zinc/56/06/93/1404560693.db2.gz ZDBLWTVOQZQBRJ-CQSZACIVSA-N 0 0 383.433 3.387 20 5 GGBDRN CCNC(=O)c1ccc(Cl)cc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000046718703 1404564984 /nfs/dbraw/zinc/56/49/84/1404564984.db2.gz WZMTZRMWZFGMON-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CS(=O)(=O)c1ccc(NCc2cccnc2OC2CCCC2)c([N+](=O)[O-])c1 ZINC000046720443 1404566816 /nfs/dbraw/zinc/56/68/16/1404566816.db2.gz IGJKSTQKDDCECG-UHFFFAOYSA-N 0 0 391.449 3.327 20 5 GGBDRN C[C@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000046747725 1404575922 /nfs/dbraw/zinc/57/59/22/1404575922.db2.gz NSHJFRVWJRCSGO-LBPRGKRZSA-N 0 0 376.376 3.148 20 5 GGBDRN Cc1ncc(CN(C)C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)s1 ZINC000046772713 1404584994 /nfs/dbraw/zinc/58/49/94/1404584994.db2.gz DLRIAOOYCYRXKL-UHFFFAOYSA-N 0 0 399.476 3.494 20 5 GGBDRN O=C(Nc1ccn(Cc2ccccc2)n1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000046786104 1404589434 /nfs/dbraw/zinc/58/94/34/1404589434.db2.gz RKMQYGPTGOEUSZ-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)C2)nc1 ZINC000046819460 1404602218 /nfs/dbraw/zinc/60/22/18/1404602218.db2.gz KDCKEIYKLAYHLW-INIZCTEOSA-N 0 0 382.420 3.098 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3C)C2)nc1 ZINC000046820428 1404603413 /nfs/dbraw/zinc/60/34/13/1404603413.db2.gz IBCZJDSODRVHMX-OAHLLOKOSA-N 0 0 382.420 3.098 20 5 GGBDRN COc1ccc(CNC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000046864510 1404616667 /nfs/dbraw/zinc/61/66/67/1404616667.db2.gz MTLCKIAUMAXYTG-UHFFFAOYSA-N 0 0 376.434 3.162 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1 ZINC000046901912 1404629405 /nfs/dbraw/zinc/62/94/05/1404629405.db2.gz PGSLRWXNDCHPFK-UHFFFAOYSA-N 0 0 392.456 3.136 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000046911348 1404631678 /nfs/dbraw/zinc/63/16/78/1404631678.db2.gz DZNIIWPBDIIESY-UHFFFAOYSA-N 0 0 375.450 3.013 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)N(C)c2ccccc2)cc1OC ZINC000046951122 1404649434 /nfs/dbraw/zinc/64/94/34/1404649434.db2.gz NAOKSPSMINYNLO-AWEZNQCLSA-N 0 0 387.436 3.257 20 5 GGBDRN CC(C)Oc1cccc([C@@H](C)NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000046999464 1404667571 /nfs/dbraw/zinc/66/75/71/1404667571.db2.gz APZOJRBAKTVVDU-CABCVRRESA-N 0 0 399.447 3.378 20 5 GGBDRN CCOc1cc(C(=O)NCCO[C@@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000047005702 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394.309 3.342 20 5 GGBDRN CCN(CCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1C ZINC000047188356 1404739104 /nfs/dbraw/zinc/73/91/04/1404739104.db2.gz QEZPYFNYMMJIAZ-UHFFFAOYSA-N 0 0 387.436 3.177 20 5 GGBDRN O=C(NCc1ccc(OCCOc2ccccc2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000047194311 1404742075 /nfs/dbraw/zinc/74/20/75/1404742075.db2.gz UYUYKEBXPBMKAJ-UHFFFAOYSA-N 0 0 393.399 3.378 20 5 GGBDRN Cc1ccc2c(c1)c(=O)n(C)c1nnc(COc3ccc([N+](=O)[O-])cc3Cl)n12 ZINC000047203798 1404746367 /nfs/dbraw/zinc/74/63/67/1404746367.db2.gz SNZWTOABHBZPBM-UHFFFAOYSA-N 0 0 399.794 3.030 20 5 GGBDRN O=C(Nc1cc(-n2cnnn2)ccc1F)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000047230183 1404758015 /nfs/dbraw/zinc/75/80/15/1404758015.db2.gz NRAXHEMFRRAPRN-UHFFFAOYSA-N 0 0 384.352 3.177 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cn2cncn2)c1 ZINC000047233388 1404761031 /nfs/dbraw/zinc/76/10/31/1404761031.db2.gz QBXAYQGTHZECQR-CYBMUJFWSA-N 0 0 383.433 3.354 20 5 GGBDRN NC(=O)CCOc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000047286061 1404787605 /nfs/dbraw/zinc/78/76/05/1404787605.db2.gz FMAMPVPJPSSIRF-UHFFFAOYSA-N 0 0 385.401 3.316 20 5 GGBDRN O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000047292829 1404791335 /nfs/dbraw/zinc/79/13/35/1404791335.db2.gz MYHAJTDTQNRMHO-UHFFFAOYSA-N 0 0 388.811 3.134 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000047323363 1404805626 /nfs/dbraw/zinc/80/56/26/1404805626.db2.gz FAFUPINZDJDDFF-HNNXBMFYSA-N 0 0 397.435 3.489 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)Nc3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000047322955 1404805761 /nfs/dbraw/zinc/80/57/61/1404805761.db2.gz ZJXKMAUTUGWRSR-CQSZACIVSA-N 0 0 383.408 3.181 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1F ZINC000047322981 1404805807 /nfs/dbraw/zinc/80/58/07/1404805807.db2.gz IHFMJOANPQCBTP-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cccc(CN2CCOCC2)c1 ZINC000047323340 1404805925 /nfs/dbraw/zinc/80/59/25/1404805925.db2.gz QTKLYHIIWLFEKP-UHFFFAOYSA-N 0 0 384.436 3.057 20 5 GGBDRN CC(C)(C)n1ncc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1C(F)(F)F ZINC000047330821 1404808842 /nfs/dbraw/zinc/80/88/42/1404808842.db2.gz WBWYKGRVXHKEMF-UHFFFAOYSA-N 0 0 399.373 3.407 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000047346128 1404812176 /nfs/dbraw/zinc/81/21/76/1404812176.db2.gz KPORHEZTPDXITH-UHFFFAOYSA-N 0 0 376.457 3.452 20 5 GGBDRN CCCCc1nc(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cs1 ZINC000047347294 1404812201 /nfs/dbraw/zinc/81/22/01/1404812201.db2.gz PCYRLAYDJGVQPL-SFHVURJKSA-N 0 0 388.449 3.361 20 5 GGBDRN C[C@]1(c2cc3ccccc3o2)NC(=O)N(CCOc2ccccc2[N+](=O)[O-])C1=O ZINC000047354300 1404814223 /nfs/dbraw/zinc/81/42/23/1404814223.db2.gz CVLJKUDFFUPKPF-HXUWFJFHSA-N 0 0 395.371 3.187 20 5 GGBDRN CC[C@]1(c2ccc(OC)cc2)NC(=O)N(Cc2cccc([N+](=O)[O-])c2C)C1=O ZINC000047354161 1404814329 /nfs/dbraw/zinc/81/43/29/1404814329.db2.gz RCTAYQZOZJBXFP-HXUWFJFHSA-N 0 0 383.404 3.269 20 5 GGBDRN 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1404827901 /nfs/dbraw/zinc/82/79/01/1404827901.db2.gz KMAPTYPZSQUKIM-UHFFFAOYSA-N 0 0 383.383 3.106 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@H](c4ccc(F)cc4)C3)n2)cc1 ZINC000047406811 1404828304 /nfs/dbraw/zinc/82/83/04/1404828304.db2.gz TZHVLEOHIDHYGV-KRWDZBQOSA-N 0 0 384.367 3.357 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCc1ccc(N2CCCCC2)nc1 ZINC000047418077 1404831097 /nfs/dbraw/zinc/83/10/97/1404831097.db2.gz CUWUMBQUUDRXHX-UHFFFAOYSA-N 0 0 383.452 3.099 20 5 GGBDRN CC(=O)Nc1ccc2nc(NC(=O)COc3cccc([N+](=O)[O-])c3)sc2c1 ZINC000047435295 1404835223 /nfs/dbraw/zinc/83/52/23/1404835223.db2.gz UTHPQELFVQVPNQ-UHFFFAOYSA-N 0 0 386.389 3.180 20 5 GGBDRN Cc1c([C@H](C)NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cnn1C ZINC000047491710 1404851186 /nfs/dbraw/zinc/85/11/86/1404851186.db2.gz KDKLVTKBCWLJDV-JTQLQIEISA-N 0 0 399.373 3.335 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000047500882 1404853052 /nfs/dbraw/zinc/85/30/52/1404853052.db2.gz 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COCCn1c(C)c(C)nc1S[C@@H](C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000047560784 1404867664 /nfs/dbraw/zinc/86/76/64/1404867664.db2.gz AMPFXGXREANFDY-LBPRGKRZSA-N 0 0 396.444 3.313 20 5 GGBDRN COCCn1c(C)c(C)nc1S[C@H](C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000047560786 1404867845 /nfs/dbraw/zinc/86/78/45/1404867845.db2.gz AMPFXGXREANFDY-GFCCVEGCSA-N 0 0 396.444 3.313 20 5 GGBDRN COCCn1c(C)c(C)nc1SCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000047562295 1404868444 /nfs/dbraw/zinc/86/84/44/1404868444.db2.gz CMYIACSOEQXWDS-UHFFFAOYSA-N 0 0 389.437 3.397 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1OC ZINC000047583714 1404872488 /nfs/dbraw/zinc/87/24/88/1404872488.db2.gz MRRXMVRISVLECC-NSHDSACASA-N 0 0 388.376 3.222 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CC(=O)Nc1ccccc1 ZINC000047592553 1404875725 /nfs/dbraw/zinc/87/57/25/1404875725.db2.gz WNGFYULVPVFXFJ-CYBMUJFWSA-N 0 0 381.392 3.276 20 5 GGBDRN CCOc1ccc([C@H](C)NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000047607867 1404878457 /nfs/dbraw/zinc/87/84/57/1404878457.db2.gz KRLQOTCSYQSELM-ZDUSSCGKSA-N 0 0 394.449 3.350 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000047624066 1404881176 /nfs/dbraw/zinc/88/11/76/1404881176.db2.gz IKTFZPOESVLTOK-LJQANCHMSA-N 0 0 398.394 3.142 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000047624067 1404881266 /nfs/dbraw/zinc/88/12/66/1404881266.db2.gz IKTFZPOESVLTOK-IBGZPJMESA-N 0 0 398.394 3.142 20 5 GGBDRN Cc1cc(N2CCOCC2)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000047625294 1404881789 /nfs/dbraw/zinc/88/17/89/1404881789.db2.gz ZZIXNMAIRMGJFZ-UHFFFAOYSA-N 0 0 385.420 3.147 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000047671067 1404890889 /nfs/dbraw/zinc/89/08/89/1404890889.db2.gz WOUJATXVPRTDPS-KRWDZBQOSA-N 0 0 387.392 3.197 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)c(F)c1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000047692464 1404894120 /nfs/dbraw/zinc/89/41/20/1404894120.db2.gz CDQIEQHQMALCEJ-UHFFFAOYSA-N 0 0 392.350 3.358 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cc(F)cc2c1OCOC2 ZINC000047697599 1404894678 /nfs/dbraw/zinc/89/46/78/1404894678.db2.gz SZQBKXREXLVJQM-UHFFFAOYSA-N 0 0 375.356 3.273 20 5 GGBDRN COC(=O)Nc1cccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000047710879 1404897848 /nfs/dbraw/zinc/89/78/48/1404897848.db2.gz SMSHOQMHXMLULS-UHFFFAOYSA-N 0 0 399.407 3.127 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)[C@H](C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047743411 1404915110 /nfs/dbraw/zinc/91/51/10/1404915110.db2.gz YCVAWPJJUDKOFO-SFHVURJKSA-N 0 0 396.491 3.154 20 5 GGBDRN CSc1cccc(NC(=O)CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000047743560 1404916586 /nfs/dbraw/zinc/91/65/86/1404916586.db2.gz UCWBFHPZZOMDAO-UHFFFAOYSA-N 0 0 386.477 3.077 20 5 GGBDRN COc1cccc(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 ZINC000047743456 1404916731 /nfs/dbraw/zinc/91/67/31/1404916731.db2.gz FKIAHZVJQGYJQT-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN CCc1ccc(NC(=O)[C@H](C)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000047744055 1404916782 /nfs/dbraw/zinc/91/67/82/1404916782.db2.gz LXYABVUOPLFLBA-INIZCTEOSA-N 0 0 382.464 3.306 20 5 GGBDRN CCC[C@@H](NC(=O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000047745406 1404916858 /nfs/dbraw/zinc/91/68/58/1404916858.db2.gz KTLILCBPTACPJT-OAQYLSRUSA-N 0 0 396.491 3.374 20 5 GGBDRN Cc1cc(C)cc(NC(=O)[C@H](C)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000047744644 1404916974 /nfs/dbraw/zinc/91/69/74/1404916974.db2.gz YFSGYTDQOAKELU-KRWDZBQOSA-N 0 0 382.464 3.361 20 5 GGBDRN CCc1cccc(C)c1NC(=O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745532 1404917714 /nfs/dbraw/zinc/91/77/14/1404917714.db2.gz TWJNQOMNFLBAFV-UHFFFAOYSA-N 0 0 382.464 3.226 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](C)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(C)c1 ZINC000047745483 1404918088 /nfs/dbraw/zinc/91/80/88/1404918088.db2.gz QZWUQPXEOSQSPB-KRWDZBQOSA-N 0 0 382.464 3.361 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(-n2cccn2)c(F)c1 ZINC000047767760 1404934775 /nfs/dbraw/zinc/93/47/75/1404934775.db2.gz RADVCBQZRVVRAD-UHFFFAOYSA-N 0 0 384.371 3.153 20 5 GGBDRN CN(CCc1ccccn1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000047798713 1404950748 /nfs/dbraw/zinc/95/07/48/1404950748.db2.gz VPHFMJXIVDCYTL-UHFFFAOYSA-N 0 0 383.326 3.246 20 5 GGBDRN O=C(c1ccc(-c2cnco2)cc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047828626 1404965690 /nfs/dbraw/zinc/96/56/90/1404965690.db2.gz UNJPSADKZHDDDA-UHFFFAOYSA-N 0 0 378.388 3.212 20 5 GGBDRN O=C(NC[C@@H]1Cc2ccccc2O1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047865687 1404977253 /nfs/dbraw/zinc/97/72/53/1404977253.db2.gz UTJHKWACVPCTHH-LBPRGKRZSA-N 0 0 379.319 3.321 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCO2)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864324 1404977286 /nfs/dbraw/zinc/97/72/86/1404977286.db2.gz HVYQZCNOTWYKCG-UHFFFAOYSA-N 0 0 381.291 3.247 20 5 GGBDRN CN(C)[C@H](CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccco1 ZINC000047864565 1404977403 /nfs/dbraw/zinc/97/74/03/1404977403.db2.gz QDGSEIRCJFVKMM-GFCCVEGCSA-N 0 0 384.339 3.214 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@H]1CCCc2[nH]c(=O)ccc21 ZINC000047865465 1404977437 /nfs/dbraw/zinc/97/74/37/1404977437.db2.gz ZAUUMECGCTXVHM-LBPRGKRZSA-N 0 0 394.334 3.084 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000047865461 1404977496 /nfs/dbraw/zinc/97/74/96/1404977496.db2.gz ZAUUMECGCTXVHM-GFCCVEGCSA-N 0 0 394.334 3.084 20 5 GGBDRN COc1cc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1O ZINC000047865430 1404977555 /nfs/dbraw/zinc/97/75/55/1404977555.db2.gz TWQPYZLNVYVPLK-UHFFFAOYSA-N 0 0 383.307 3.232 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)NC1CCC2(CC1)OCCO2 ZINC000047866171 1404978103 /nfs/dbraw/zinc/97/81/03/1404978103.db2.gz KYSXKOFJYQQIEG-UHFFFAOYSA-N 0 0 387.339 3.003 20 5 GGBDRN Cc1ccc([C@@H](O)CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000047865792 1404978303 /nfs/dbraw/zinc/97/83/03/1404978303.db2.gz WQSZHMNGSUEPND-AWEZNQCLSA-N 0 0 381.335 3.360 20 5 GGBDRN Cc1cc(C)cc(Cn2cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c2=O)c1 ZINC000047880834 1404981354 /nfs/dbraw/zinc/98/13/54/1404981354.db2.gz MBBHKKGACXHVLT-UHFFFAOYSA-N 0 0 375.388 3.156 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)Nc3c[nH]ccc3=O)cc2[N+](=O)[O-])n1 ZINC000047930128 1405001125 /nfs/dbraw/zinc/00/11/25/1405001125.db2.gz OXMHUBWOYYIHHJ-UHFFFAOYSA-N 0 0 388.430 3.452 20 5 GGBDRN CC(=O)Nc1ccc(/C=C/c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])cc1 ZINC000047971345 1405013719 /nfs/dbraw/zinc/01/37/19/1405013719.db2.gz NFMLPAGYUMVGKJ-JXMROGBWSA-N 0 0 376.372 3.419 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc(Cl)c(C(N)=O)c2)c1 ZINC000047991766 1405020151 /nfs/dbraw/zinc/02/01/51/1405020151.db2.gz IPBKHHJNLNXKPC-UHFFFAOYSA-N 0 0 377.784 3.063 20 5 GGBDRN Cc1noc(CN2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)n1 ZINC000048018100 1405026823 /nfs/dbraw/zinc/02/68/23/1405026823.db2.gz QLXQIEPVMPNKPL-UHFFFAOYSA-N 0 0 399.476 3.333 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1nc(-c2ccccc2)cs1 ZINC000048033569 1405029771 /nfs/dbraw/zinc/02/97/71/1405029771.db2.gz YXMWXPNZMUOGOK-UHFFFAOYSA-N 0 0 396.428 3.315 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000048129418 1405067263 /nfs/dbraw/zinc/06/72/63/1405067263.db2.gz TVFKWJLLIXEVDM-UHFFFAOYSA-N 0 0 392.799 3.268 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c([N+](=O)[O-])cc1OC ZINC000048166564 1405082988 /nfs/dbraw/zinc/08/29/88/1405082988.db2.gz BYDIFBVWCPCJIA-UHFFFAOYSA-N 0 0 397.391 3.062 20 5 GGBDRN O=C(NC[C@@H]1Cc2ccccc2O1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000048188212 1405092168 /nfs/dbraw/zinc/09/21/68/1405092168.db2.gz GEFUHEBESBQVJV-ZDUSSCGKSA-N 0 0 396.321 3.269 20 5 GGBDRN CC[C@@H](C)N(Cc1ccccc1)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000048213951 1405099519 /nfs/dbraw/zinc/09/95/19/1405099519.db2.gz WWPLVBFWLCAYLU-CQSZACIVSA-N 0 0 383.404 3.330 20 5 GGBDRN CCOC(=O)c1c(C)[nH]c(C(=O)CNc2cc([N+](=O)[O-])ccc2OC)c1C ZINC000048214606 1405100830 /nfs/dbraw/zinc/10/08/30/1405100830.db2.gz DENKTISLIDLHPK-UHFFFAOYSA-N 0 0 375.381 3.020 20 5 GGBDRN CC(C)(C)c1ccc(-c2csc(NC(=O)Cn3cnc([N+](=O)[O-])n3)n2)cc1 ZINC000048221887 1405103078 /nfs/dbraw/zinc/10/30/78/1405103078.db2.gz ZLDXNMCIOTWVST-UHFFFAOYSA-N 0 0 386.437 3.246 20 5 GGBDRN CCOc1ccc(Oc2ccccc2NC(=O)Cn2cnc([N+](=O)[O-])n2)cc1 ZINC000048222385 1405103361 /nfs/dbraw/zinc/10/33/61/1405103361.db2.gz VVUOTLDEPYPXNF-UHFFFAOYSA-N 0 0 383.364 3.016 20 5 GGBDRN CN(C)c1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1Cl ZINC000048243254 1405110877 /nfs/dbraw/zinc/11/08/77/1405110877.db2.gz DGPCCTWBMNCEMV-UHFFFAOYSA-N 0 0 386.799 3.147 20 5 GGBDRN Cc1nnc([C@@H](C)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)o1 ZINC000048274932 1405124523 /nfs/dbraw/zinc/12/45/23/1405124523.db2.gz IPTUDIILGXYMLU-SNVBAGLBSA-N 0 0 385.346 3.188 20 5 GGBDRN COc1cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccc1OC(C)C ZINC000048305855 1405135956 /nfs/dbraw/zinc/13/59/56/1405135956.db2.gz OSUGQKWGVVVYAL-UHFFFAOYSA-N 0 0 399.447 3.353 20 5 GGBDRN COCc1c2ccccc2oc1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048305804 1405136151 /nfs/dbraw/zinc/13/61/51/1405136151.db2.gz NZNGAFBVSARCHL-UHFFFAOYSA-N 0 0 395.415 3.450 20 5 GGBDRN O=C(c1ccc(OC(F)F)cc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048305996 1405137435 /nfs/dbraw/zinc/13/74/35/1405137435.db2.gz GZBVCCBTKYIWKC-UHFFFAOYSA-N 0 0 377.347 3.159 20 5 GGBDRN Cc1cc(C)cc(OCCC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000048306474 1405137446 /nfs/dbraw/zinc/13/74/46/1405137446.db2.gz JFZWWVVEEYFUEV-UHFFFAOYSA-N 0 0 383.448 3.329 20 5 GGBDRN Cc1nc(-c2c[nH]c(C(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)c2)cs1 ZINC000048306075 1405137681 /nfs/dbraw/zinc/13/76/81/1405137681.db2.gz XOSBTQJCKJGDQW-UHFFFAOYSA-N 0 0 397.460 3.317 20 5 GGBDRN Cc1cccc(C)c1OCCC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048306535 1405137703 /nfs/dbraw/zinc/13/77/03/1405137703.db2.gz FHZALYAEKVQDDX-UHFFFAOYSA-N 0 0 383.448 3.329 20 5 GGBDRN O=C(NC1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1)c1ccccc1 ZINC000048315887 1405140647 /nfs/dbraw/zinc/14/06/47/1405140647.db2.gz UFCVBXVSTVZCLS-UHFFFAOYSA-N 0 0 392.415 3.111 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccc(F)cc1 ZINC000048316119 1405142788 /nfs/dbraw/zinc/14/27/88/1405142788.db2.gz NXPDFSARVLXLSV-SFHVURJKSA-N 0 0 393.378 3.468 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)cc(F)cc1[N+](=O)[O-] ZINC000048321425 1405143953 /nfs/dbraw/zinc/14/39/53/1405143953.db2.gz NJSBCQDCKPOYIS-NSHDSACASA-N 0 0 384.367 3.477 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000048321895 1405144102 /nfs/dbraw/zinc/14/41/02/1405144102.db2.gz PJBGMALJMGIZFC-UHFFFAOYSA-N 0 0 397.410 3.173 20 5 GGBDRN Nc1c(C(=O)NCc2ccnc(OCc3ccccc3)c2)cc(F)cc1[N+](=O)[O-] ZINC000048323279 1405145031 /nfs/dbraw/zinc/14/50/31/1405145031.db2.gz YLBPYXZJOBZXSG-UHFFFAOYSA-N 0 0 396.378 3.220 20 5 GGBDRN Nc1c(C(=O)NCc2cccc(OCc3ccccn3)c2)cc(F)cc1[N+](=O)[O-] ZINC000048323435 1405145372 /nfs/dbraw/zinc/14/53/72/1405145372.db2.gz KJDMZCRKPDXWDI-UHFFFAOYSA-N 0 0 396.378 3.220 20 5 GGBDRN Nc1c(C(=O)NCc2cccc(OCC(F)(F)F)c2)cc(F)cc1[N+](=O)[O-] ZINC000048323521 1405145496 /nfs/dbraw/zinc/14/54/96/1405145496.db2.gz YJFIGMBLOHLGQO-UHFFFAOYSA-N 0 0 387.289 3.187 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1OC ZINC000048322112 1405145682 /nfs/dbraw/zinc/14/56/82/1405145682.db2.gz DLSLYOAQBCZGDV-JTQLQIEISA-N 0 0 377.372 3.214 20 5 GGBDRN O=C(OCCCS(=O)(=O)c1ccccc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000048344322 1405153672 /nfs/dbraw/zinc/15/36/72/1405153672.db2.gz WONVSECEBHIUBB-UHFFFAOYSA-N 0 0 383.809 3.269 20 5 GGBDRN CCOc1ccc(C(=O)OCCCS(=O)(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000048344007 1405153804 /nfs/dbraw/zinc/15/38/04/1405153804.db2.gz XJNQUNMQNAMLPG-UHFFFAOYSA-N 0 0 393.417 3.014 20 5 GGBDRN Cc1ncsc1C(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000048344484 1405154199 /nfs/dbraw/zinc/15/41/99/1405154199.db2.gz SFCFWQSNAIXBNE-ZDUSSCGKSA-N 0 0 377.422 3.173 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N=c1[nH]c2ccc(Oc3ccccc3)cc2s1 ZINC000048352092 1405156965 /nfs/dbraw/zinc/15/69/65/1405156965.db2.gz IDLPHPRFMAGQSW-UHFFFAOYSA-N 0 0 395.400 3.254 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2CNC(=O)Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000048361273 1405164127 /nfs/dbraw/zinc/16/41/27/1405164127.db2.gz QEFBCVXTUNTDRB-IRXDYDNUSA-N 0 0 397.475 3.063 20 5 GGBDRN CC(=O)Nc1cc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccc1C ZINC000048363265 1405164523 /nfs/dbraw/zinc/16/45/23/1405164523.db2.gz QJXIUTUCMAKFRU-UHFFFAOYSA-N 0 0 397.435 3.216 20 5 GGBDRN COCCOc1ccc(CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cn1 ZINC000048391704 1405176303 /nfs/dbraw/zinc/17/63/03/1405176303.db2.gz YGTQCLXJOKZDIZ-UHFFFAOYSA-N 0 0 387.436 3.243 20 5 GGBDRN CCN(C[C@@H]1CCOC1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000048432016 1405188190 /nfs/dbraw/zinc/18/81/90/1405188190.db2.gz OTVBVPOVLAVNMX-NSHDSACASA-N 0 0 376.331 3.035 20 5 GGBDRN CC(C)c1ccc(OCCNC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000048497483 1405208197 /nfs/dbraw/zinc/20/81/97/1405208197.db2.gz JVQVLDJAUKHXNB-HNNXBMFYSA-N 0 0 399.447 3.032 20 5 GGBDRN CC1(C)Oc2ccc(NC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2O1 ZINC000048539321 1405220694 /nfs/dbraw/zinc/22/06/94/1405220694.db2.gz QXDOKNZFVRZPAQ-UHFFFAOYSA-N 0 0 398.419 3.456 20 5 GGBDRN O=C(Nc1cccc(-n2cccn2)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000048551303 1405222831 /nfs/dbraw/zinc/22/28/31/1405222831.db2.gz RGWCDBSGFZQUMG-UHFFFAOYSA-N 0 0 392.419 3.135 20 5 GGBDRN CCOc1cc(NC(=O)C(=O)NC2CCCCCC2)c([N+](=O)[O-])cc1OCC ZINC000048652591 1405248872 /nfs/dbraw/zinc/24/88/72/1405248872.db2.gz HHBXRILUXQWQHW-UHFFFAOYSA-N 0 0 393.440 3.170 20 5 GGBDRN Cc1c(CS(=O)(=O)CC(=O)N(C)[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000048717005 1405266761 /nfs/dbraw/zinc/26/67/61/1405266761.db2.gz IGMIDKQUNTXBHV-OAHLLOKOSA-N 0 0 390.461 3.038 20 5 GGBDRN Cc1ccc(-c2noc(CS(=O)(=O)Cc3cccc([N+](=O)[O-])c3C)n2)cc1 ZINC000048717318 1405266903 /nfs/dbraw/zinc/26/69/03/1405266903.db2.gz HUVJTFJGWGWILK-UHFFFAOYSA-N 0 0 387.417 3.377 20 5 GGBDRN Cc1ccc(NC(=O)CS(=O)(=O)Cc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000048717497 1405266971 /nfs/dbraw/zinc/26/69/71/1405266971.db2.gz HMWBTTFGXOKCEK-UHFFFAOYSA-N 0 0 376.434 3.074 20 5 GGBDRN Cc1c(CS(=O)(=O)CC(=O)N[C@@H](C)CCCC(C)C)cccc1[N+](=O)[O-] ZINC000048717046 1405267169 /nfs/dbraw/zinc/26/71/69/1405267169.db2.gz PSEKEQPAUIZBKE-AWEZNQCLSA-N 0 0 384.498 3.149 20 5 GGBDRN Cc1cccc(C)c1NC(=O)[C@@H](C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000048718090 1405267734 /nfs/dbraw/zinc/26/77/34/1405267734.db2.gz LCDROUUOBSXVME-OAHLLOKOSA-N 0 0 390.461 3.462 20 5 GGBDRN CCN(C(=O)[C@H](C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1C)C1CCCCC1 ZINC000048718121 1405267897 /nfs/dbraw/zinc/26/78/97/1405267897.db2.gz YIILFLJDDZULRH-HNNXBMFYSA-N 0 0 396.509 3.388 20 5 GGBDRN Cc1c(CS(=O)(=O)[C@@H](C)C(=O)Nc2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000048718053 1405267996 /nfs/dbraw/zinc/26/79/96/1405267996.db2.gz DDNRDXBSDSWTTH-NSHDSACASA-N 0 0 398.387 3.123 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](C)S(=O)(=O)Cc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000048717919 1405268053 /nfs/dbraw/zinc/26/80/53/1405268053.db2.gz ISDDMUOCLRMMNT-OAHLLOKOSA-N 0 0 390.461 3.462 20 5 GGBDRN CCN(C(=O)[C@@H](C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1C)C1CCCCC1 ZINC000048718118 1405268128 /nfs/dbraw/zinc/26/81/28/1405268128.db2.gz YIILFLJDDZULRH-OAHLLOKOSA-N 0 0 396.509 3.388 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](C)S(=O)(=O)Cc2cccc([N+](=O)[O-])c2C)cc1F ZINC000048718062 1405268141 /nfs/dbraw/zinc/26/81/41/1405268141.db2.gz PRBSSSNQBUFFKS-ZDUSSCGKSA-N 0 0 394.424 3.293 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)cccc1[N+](=O)[O-] ZINC000048718834 1405269002 /nfs/dbraw/zinc/26/90/02/1405269002.db2.gz XSYJNZWPSXGLMI-QGZVFWFLSA-N 0 0 395.419 3.232 20 5 GGBDRN COc1ccc(CS(=O)(=O)Cc2cc(-c3cccs3)on2)cc1[N+](=O)[O-] ZINC000048720466 1405269787 /nfs/dbraw/zinc/26/97/87/1405269787.db2.gz FXPYKYZULOUDSZ-UHFFFAOYSA-N 0 0 394.430 3.435 20 5 GGBDRN COc1ccc(CS(=O)(=O)Cc2csc(-c3ccco3)n2)cc1[N+](=O)[O-] ZINC000048720742 1405270068 /nfs/dbraw/zinc/27/00/68/1405270068.db2.gz YRRBHXKBLACSDN-UHFFFAOYSA-N 0 0 394.430 3.435 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCc1ccc(C(C)C)cc1 ZINC000048825483 1405297506 /nfs/dbraw/zinc/29/75/06/1405297506.db2.gz UDRFBQIDSJJWAT-UHFFFAOYSA-N 0 0 385.420 3.024 20 5 GGBDRN CC[C@H](C)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000048866332 1405311827 /nfs/dbraw/zinc/31/18/27/1405311827.db2.gz LUSOGPPWJUMYIY-DTWKUNHWSA-N 0 0 376.194 3.364 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCCSCc2ccccc2F)cc1[N+](=O)[O-] ZINC000049055775 1405336614 /nfs/dbraw/zinc/33/66/14/1405336614.db2.gz QMDFQAYIMGMJFU-UHFFFAOYSA-N 0 0 391.424 3.030 20 5 GGBDRN CC(C)(C)c1ccccc1NC(=O)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000049208518 1405353584 /nfs/dbraw/zinc/35/35/84/1405353584.db2.gz NTBKTJCXAQPGNK-UHFFFAOYSA-N 0 0 384.436 3.059 20 5 GGBDRN CC(C)(C)c1ccccc1NC(=O)C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000049244598 1405356404 /nfs/dbraw/zinc/35/64/04/1405356404.db2.gz 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COc1ccc(-n2ccc(CNC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000056822247 1407444146 /nfs/dbraw/zinc/44/41/46/1407444146.db2.gz JEUQMKLLYUIXPB-CQSZACIVSA-N 0 0 395.419 3.350 20 5 GGBDRN O=C(N[C@H]1CCc2cc(F)ccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000056841009 1407451940 /nfs/dbraw/zinc/45/19/40/1407451940.db2.gz ODHUZRHFHZJYPW-IBGZPJMESA-N 0 0 384.411 3.253 20 5 GGBDRN C[C@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCc2sccc2C1 ZINC000056888015 1407465494 /nfs/dbraw/zinc/46/54/94/1407465494.db2.gz GILJCBOLJAFCBR-GFCCVEGCSA-N 0 0 384.461 3.314 20 5 GGBDRN C[C@@H](COc1ccc(F)cc1F)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000056897929 1407470949 /nfs/dbraw/zinc/47/09/49/1407470949.db2.gz POCLUVMVNMOKIZ-LBPRGKRZSA-N 0 0 379.363 3.482 20 5 GGBDRN Cc1cc(N2CCOCC2)ccc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000056903848 1407472310 /nfs/dbraw/zinc/47/23/10/1407472310.db2.gz UNTBMTXNFLFRBM-UHFFFAOYSA-N 0 0 380.404 3.473 20 5 GGBDRN O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000056951903 1407483373 /nfs/dbraw/zinc/48/33/73/1407483373.db2.gz OFSJSANPYMTYMB-QGZVFWFLSA-N 0 0 399.451 3.213 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CCCN(S(=O)(=O)c2ccccc2)CC1 ZINC000056968197 1407490254 /nfs/dbraw/zinc/49/02/54/1407490254.db2.gz LEBQNLAPCCPXNM-UHFFFAOYSA-N 0 0 395.868 3.149 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000057010768 1407499269 /nfs/dbraw/zinc/49/92/69/1407499269.db2.gz YLKFZFYNRRAZHO-LBPRGKRZSA-N 0 0 386.788 3.189 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000057010770 1407499442 /nfs/dbraw/zinc/49/94/42/1407499442.db2.gz YLKFZFYNRRAZHO-GFCCVEGCSA-N 0 0 386.788 3.189 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCc2cccc(OC(F)F)c21 ZINC000057014628 1407500609 /nfs/dbraw/zinc/50/06/09/1407500609.db2.gz NUMOUYJULCFQKY-UHFFFAOYSA-N 0 0 384.360 3.338 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(Cc2ccco2)C[C@@H]2CCCO2)c1C ZINC000057019225 1407502195 /nfs/dbraw/zinc/50/21/95/1407502195.db2.gz 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O=[N+]([O-])c1ccc(NCc2cccnc2N2CCOCC2)c(C(F)(F)F)c1 ZINC000057137696 1407533394 /nfs/dbraw/zinc/53/33/94/1407533394.db2.gz CAWBUSDSKRLQAS-UHFFFAOYSA-N 0 0 382.342 3.457 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1NCc1ccc(S(=O)(=O)N2CCCC2)cc1 ZINC000057139187 1407534162 /nfs/dbraw/zinc/53/41/62/1407534162.db2.gz FTROQLVHMJSTMB-UHFFFAOYSA-N 0 0 379.413 3.131 20 5 GGBDRN CN(C[C@H]1CCCN(c2nc3ccccn3c2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000057139951 1407534239 /nfs/dbraw/zinc/53/42/39/1407534239.db2.gz XGRROLIOQDMYEM-CQSZACIVSA-N 0 0 389.456 3.326 20 5 GGBDRN CNC(=O)c1ccc(NCC2(c3ccc(OC)cc3)CCOCC2)c([N+](=O)[O-])c1 ZINC000057150043 1407536480 /nfs/dbraw/zinc/53/64/80/1407536480.db2.gz APTGAZVQYHPLGV-UHFFFAOYSA-N 0 0 399.447 3.123 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCc2cccc(C(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000176326121 1428245803 /nfs/dbraw/zinc/24/58/03/1428245803.db2.gz WJUNDLAMDUOPPL-HNNXBMFYSA-N 0 0 398.463 3.208 20 5 GGBDRN Cc1c(C(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000057178127 1407547734 /nfs/dbraw/zinc/54/77/34/1407547734.db2.gz NTDPFDOJLCQLPN-UHFFFAOYSA-N 0 0 377.441 3.375 20 5 GGBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cc2c(c(Br)c1)OCO2 ZINC000057228382 1407562424 /nfs/dbraw/zinc/56/24/24/1407562424.db2.gz YRXPETMBICMVHV-UHFFFAOYSA-N 0 0 383.129 3.477 20 5 GGBDRN Cc1oncc1C(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cnc2C)cc1 ZINC000057236447 1407564809 /nfs/dbraw/zinc/56/48/09/1407564809.db2.gz IZDCZAWNXMMGHE-UHFFFAOYSA-N 0 0 381.348 3.099 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)c2cnoc2C)cc1 ZINC000057236370 1407564989 /nfs/dbraw/zinc/56/49/89/1407564989.db2.gz WMBQONXHBNGWAW-UHFFFAOYSA-N 0 0 396.359 3.404 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccc(Cn2cccn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000057257020 1407569672 /nfs/dbraw/zinc/56/96/72/1407569672.db2.gz VEXCYIMQQCTSHC-OAHLLOKOSA-N 0 0 379.420 3.400 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC(=O)N1CCCc2ccccc21 ZINC000057269200 1407575663 /nfs/dbraw/zinc/57/56/63/1407575663.db2.gz TXAWIGSWLSZJSX-AWEZNQCLSA-N 0 0 399.472 3.171 20 5 GGBDRN O=C(NC[C@@H]1CCN(c2ccc(F)cc2)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000057275612 1407577597 /nfs/dbraw/zinc/57/75/97/1407577597.db2.gz GFHPJDDISTZFAR-ZDUSSCGKSA-N 0 0 382.395 3.472 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000057275555 1407577779 /nfs/dbraw/zinc/57/77/79/1407577779.db2.gz UUCXFJNARFHUTA-AWEZNQCLSA-N 0 0 386.427 3.056 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000057275556 1407577888 /nfs/dbraw/zinc/57/78/88/1407577888.db2.gz UUCXFJNARFHUTA-CQSZACIVSA-N 0 0 386.427 3.056 20 5 GGBDRN CCCCOc1ccc(C(=O)NCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000057282013 1407579405 /nfs/dbraw/zinc/57/94/05/1407579405.db2.gz SCUVRLVVRKVBCF-OAHLLOKOSA-N 0 0 399.447 3.381 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000057281812 1407579728 /nfs/dbraw/zinc/57/97/28/1407579728.db2.gz NHPDETNWHSUFDC-ZUOKHONESA-N 0 0 394.431 3.001 20 5 GGBDRN CC[C@@H](C)Oc1cccc(NC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 ZINC000057299669 1407582841 /nfs/dbraw/zinc/58/28/41/1407582841.db2.gz APPHEDXWJGMNHF-GFCCVEGCSA-N 0 0 397.387 3.007 20 5 GGBDRN CC[C@H](C)Oc1cccc(NC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1 ZINC000057299891 1407583441 /nfs/dbraw/zinc/58/34/41/1407583441.db2.gz VOGSWLKMGZQGPL-ZDUSSCGKSA-N 0 0 399.403 3.136 20 5 GGBDRN CC(C)(C)c1ccccc1NC(=O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O ZINC000057322368 1407587643 /nfs/dbraw/zinc/58/76/43/1407587643.db2.gz SDTNDUDYGWVSED-UHFFFAOYSA-N 0 0 380.404 3.241 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2ccc(OCC)c([N+](=O)[O-])c2)C1 ZINC000057330249 1407588655 /nfs/dbraw/zinc/58/86/55/1407588655.db2.gz YBERZALYZBUDTF-HOCLYGCPSA-N 0 0 391.468 3.151 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000057338245 1407591904 /nfs/dbraw/zinc/59/19/04/1407591904.db2.gz WHJZDYXEIIIGOT-HIFRSBDPSA-N 0 0 386.452 3.233 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000057338238 1407591912 /nfs/dbraw/zinc/59/19/12/1407591912.db2.gz WHJZDYXEIIIGOT-DZGCQCFKSA-N 0 0 386.452 3.233 20 5 GGBDRN CN(C)c1ccc(C(=O)c2ccccc2C(=O)N(C)CC2CC2)cc1[N+](=O)[O-] ZINC000057365571 1407596565 /nfs/dbraw/zinc/59/65/65/1407596565.db2.gz IABMQWYOPLMHJX-UHFFFAOYSA-N 0 0 381.432 3.374 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccc(F)cc2)c(S(=O)(=O)N2CCCC2)c1 ZINC000057366994 1407597401 /nfs/dbraw/zinc/59/74/01/1407597401.db2.gz FEWDDXJSGFTJIF-UHFFFAOYSA-N 0 0 379.413 3.131 20 5 GGBDRN CCN(CC)C(=O)c1ccccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000057370152 1407597936 /nfs/dbraw/zinc/59/79/36/1407597936.db2.gz KMILSUZTEWJDIX-UHFFFAOYSA-N 0 0 385.420 3.484 20 5 GGBDRN C[C@@H](COc1ccc(F)cc1F)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000057370030 1407598186 /nfs/dbraw/zinc/59/81/86/1407598186.db2.gz PQNMKEXJXDHHCD-LBPRGKRZSA-N 0 0 380.347 3.226 20 5 GGBDRN O=C(NCc1ccc(-n2cccn2)cc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000057371905 1407598688 /nfs/dbraw/zinc/59/86/88/1407598688.db2.gz HKYXWVKQHBVNCF-UHFFFAOYSA-N 0 0 391.431 3.311 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCN(c2ccccc2Cl)CC1 ZINC000057406243 1407608437 /nfs/dbraw/zinc/60/84/37/1407608437.db2.gz FFVNBPFLLWYJFN-AWEZNQCLSA-N 0 0 388.855 3.397 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCc3ccc(OC)cc3C2)cc1OC ZINC000057408377 1407610279 /nfs/dbraw/zinc/61/02/79/1407610279.db2.gz BXUJMCODESNZMO-UHFFFAOYSA-N 0 0 386.404 3.209 20 5 GGBDRN CC(C)[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1cccnc1 ZINC000176334321 1428251454 /nfs/dbraw/zinc/25/14/54/1428251454.db2.gz XJNLJKSJULNAGO-KRWDZBQOSA-N 0 0 380.404 3.001 20 5 GGBDRN COCCn1cc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000057428467 1407614453 /nfs/dbraw/zinc/61/44/53/1407614453.db2.gz ROYLKVCSNHCBBD-UHFFFAOYSA-N 0 0 382.420 3.038 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCN(c2cccc(Cl)c2)CC1 ZINC000057440630 1407619340 /nfs/dbraw/zinc/61/93/40/1407619340.db2.gz 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O=[N+]([O-])c1ccc(N2CCN(c3cncc(Cl)n3)CC2)c(C(F)(F)F)c1 ZINC000066816023 1408920650 /nfs/dbraw/zinc/92/06/50/1408920650.db2.gz VZDACKAZNYLXGL-UHFFFAOYSA-N 0 0 387.749 3.384 20 5 GGBDRN NS(=O)(=O)c1ccc(N2CCC[C@@H](c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000066818536 1408921028 /nfs/dbraw/zinc/92/10/28/1408921028.db2.gz DHZUYRZZTXLGAR-OAHLLOKOSA-N 0 0 375.450 3.016 20 5 GGBDRN COc1nc(C)cc(C)c1CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000066818969 1408921118 /nfs/dbraw/zinc/92/11/18/1408921118.db2.gz DEXOKCHZWJGOHS-UHFFFAOYSA-N 0 0 384.436 3.463 20 5 GGBDRN O=C(CNc1ccc(-n2cccn2)c(Cl)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000066825604 1408922088 /nfs/dbraw/zinc/92/20/88/1408922088.db2.gz GPJAYGBUBYSQDE-UHFFFAOYSA-N 0 0 397.822 3.435 20 5 GGBDRN COCCOc1ccc(F)cc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000066826387 1408922249 /nfs/dbraw/zinc/92/22/49/1408922249.db2.gz OGBBIEWVYMTRNW-UHFFFAOYSA-N 0 0 388.355 3.421 20 5 GGBDRN Cc1c(NC(=O)CCN2CCO[C@@H](c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000066847418 1408929259 /nfs/dbraw/zinc/92/92/59/1408929259.db2.gz VBLQGPMRPVHXEU-LJQANCHMSA-N 0 0 387.411 3.444 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@H](c4cccc(F)c4)C3)n2)cc1 ZINC000066847864 1408929911 /nfs/dbraw/zinc/92/99/11/1408929911.db2.gz UGVSULHWGLTXQR-KRWDZBQOSA-N 0 0 384.367 3.357 20 5 GGBDRN O=C(CN1CCO[C@H](c2cccc(F)c2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000066848916 1408930117 /nfs/dbraw/zinc/93/01/17/1408930117.db2.gz DUMLXEQGWVIXAM-KRWDZBQOSA-N 0 0 393.802 3.399 20 5 GGBDRN O=C(CN1CCO[C@@H](c2cccc(F)c2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000066848917 1408930328 /nfs/dbraw/zinc/93/03/28/1408930328.db2.gz DUMLXEQGWVIXAM-QGZVFWFLSA-N 0 0 393.802 3.399 20 5 GGBDRN O=C(CN1CCO[C@H](c2cccc(F)c2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000066849386 1408930648 /nfs/dbraw/zinc/93/06/48/1408930648.db2.gz OFKSZAZRANMTOJ-KRWDZBQOSA-N 0 0 393.802 3.399 20 5 GGBDRN O=C(CN1CCO[C@@H](c2cccc(F)c2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000066849415 1408930789 /nfs/dbraw/zinc/93/07/89/1408930789.db2.gz ZHMROTRZKRFICM-QGZVFWFLSA-N 0 0 393.802 3.399 20 5 GGBDRN Cc1c(NC(=O)CCN2CCO[C@@H](c3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000066849367 1408930953 /nfs/dbraw/zinc/93/09/53/1408930953.db2.gz ZESZTADKJDZEKT-LJQANCHMSA-N 0 0 387.411 3.444 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCO[C@H](c3ccc(F)c(F)c3)C2)c2c(c1)COCO2 ZINC000066850733 1408931882 /nfs/dbraw/zinc/93/18/82/1408931882.db2.gz GAYBRAKQBQHPLF-SFHVURJKSA-N 0 0 392.358 3.313 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000066850888 1408932122 /nfs/dbraw/zinc/93/21/22/1408932122.db2.gz ILYTXLBSKNZJNL-SGTLLEGYSA-N 0 0 391.374 3.274 20 5 GGBDRN Cc1cnc(-c2cccc(NC(=O)[C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)c2)o1 ZINC000066857544 1408933932 /nfs/dbraw/zinc/93/39/32/1408933932.db2.gz KDYDXTJJZXDWMD-CYBMUJFWSA-N 0 0 394.387 3.315 20 5 GGBDRN O=C(c1cc(NC[C@@]2(O)CCCc3ccccc32)ccc1[N+](=O)[O-])N1CCCC1 ZINC000066859931 1408934136 /nfs/dbraw/zinc/93/41/36/1408934136.db2.gz VOKYKBOPMLBZDF-QFIPXVFZSA-N 0 0 395.459 3.467 20 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ZINC000066937438 1408957597 /nfs/dbraw/zinc/95/75/97/1408957597.db2.gz SXICXJUZRQXJDD-INIZCTEOSA-N 0 0 376.434 3.136 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)OCC2(C)C)c([N+](=O)[O-])c1 ZINC000066937373 1408957771 /nfs/dbraw/zinc/95/77/71/1408957771.db2.gz NMEJJSVTEJRURA-KRWDZBQOSA-N 0 0 390.461 3.444 20 5 GGBDRN COC(=O)c1cc(-c2csc(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)n2)c[nH]1 ZINC000066961377 1408964223 /nfs/dbraw/zinc/96/42/23/1408964223.db2.gz MTVGAKZRFSOQKB-QPJJXVBHSA-N 0 0 398.400 3.485 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(c3ccc(Cl)cn3)CC2)cc1[N+](=O)[O-] ZINC000066962243 1408964414 /nfs/dbraw/zinc/96/44/14/1408964414.db2.gz PEASKFXXNKEYPJ-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000066961567 1408964499 /nfs/dbraw/zinc/96/44/99/1408964499.db2.gz PTFKBYVDWCFZSF-UHFFFAOYSA-N 0 0 378.388 3.166 20 5 GGBDRN COCCOc1ccc(F)cc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000066966437 1408967781 /nfs/dbraw/zinc/96/77/81/1408967781.db2.gz SMFDLRRMNYQIIA-LBPRGKRZSA-N 0 0 377.372 3.198 20 5 GGBDRN C[C@H](NC(=O)N1CCN(C(=O)C2CCCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000066985424 1408971837 /nfs/dbraw/zinc/97/18/37/1408971837.db2.gz OBWZESCLXXXYHX-HNNXBMFYSA-N 0 0 388.468 3.090 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2nnnn2-c2ccc(C(F)(F)F)cc2)cc1F ZINC000067009900 1408979150 /nfs/dbraw/zinc/97/91/50/1408979150.db2.gz DHKDEOYQEFVPHD-UHFFFAOYSA-N 0 0 383.261 3.307 20 5 GGBDRN O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C\c1cc([N+](=O)[O-])c(F)cc1F ZINC000067018708 1408982325 /nfs/dbraw/zinc/98/23/25/1408982325.db2.gz PGEDQQKXCFICHP-ACAGNQJTSA-N 0 0 375.243 3.126 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccccc2SC(=O)N(C)C)c(C)c1[N+](=O)[O-] ZINC000067020858 1408982831 /nfs/dbraw/zinc/98/28/31/1408982831.db2.gz ZGKWAARCWUXAIF-UHFFFAOYSA-N 0 0 391.453 3.211 20 5 GGBDRN O=C(Oc1ccc2ccc(=O)oc2c1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067022356 1408983623 /nfs/dbraw/zinc/98/36/23/1408983623.db2.gz RWQBXOQRUZVRBR-UHFFFAOYSA-N 0 0 377.312 3.106 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1OC)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000067024387 1408984140 /nfs/dbraw/zinc/98/41/40/1408984140.db2.gz BWRMCOZUJFBOLT-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN CCN(Cc1ccc2c(c1)OCO2)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067030719 1408987234 /nfs/dbraw/zinc/98/72/34/1408987234.db2.gz GZUMDRVCYXYXKA-UHFFFAOYSA-N 0 0 394.387 3.172 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(CN2C[C@@H](C)O[C@@H](C)C2)cs1 ZINC000067032630 1408987549 /nfs/dbraw/zinc/98/75/49/1408987549.db2.gz FSDUESDZCUOBFF-BETUJISGSA-N 0 0 390.465 3.221 20 5 GGBDRN COc1cccc(Cn2nccc2NC(=O)c2cc([N+](=O)[O-])ccc2C)c1OC ZINC000067031768 1408987642 /nfs/dbraw/zinc/98/76/42/1408987642.db2.gz WJXWEBILLKFYKF-UHFFFAOYSA-N 0 0 396.403 3.418 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1C)c1nccn1C ZINC000067031837 1408987908 /nfs/dbraw/zinc/98/79/08/1408987908.db2.gz SATMXWFDEOXLON-GOSISDBHSA-N 0 0 380.404 3.165 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000067034851 1408988379 /nfs/dbraw/zinc/98/83/79/1408988379.db2.gz CUMNRYDUUKGOLV-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN CNC(=O)c1cc(Cl)ccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067052693 1408993422 /nfs/dbraw/zinc/99/34/22/1408993422.db2.gz CFSDNGMCYXPGMM-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1 ZINC000067053820 1408993788 /nfs/dbraw/zinc/99/37/88/1408993788.db2.gz OEEFRIUGFLVZDZ-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000067053881 1408993801 /nfs/dbraw/zinc/99/38/01/1408993801.db2.gz IOTCSKGNPXHCKC-UHFFFAOYSA-N 0 0 393.403 3.091 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000067054668 1408993960 /nfs/dbraw/zinc/99/39/60/1408993960.db2.gz SIZVQQOWKCUPCV-AWEZNQCLSA-N 0 0 397.431 3.052 20 5 GGBDRN O=C(Nc1ccn(Cc2ccccc2)n1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067055486 1408993982 /nfs/dbraw/zinc/99/39/82/1408993982.db2.gz AMPNRNRTPXWDLA-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN Cc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2C)N2CCOCC2)cc1 ZINC000067056429 1408994268 /nfs/dbraw/zinc/99/42/68/1408994268.db2.gz NEFLVGDSCIZJSM-FQEVSTJZSA-N 0 0 383.448 3.015 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(C)c1 ZINC000067056284 1408994282 /nfs/dbraw/zinc/99/42/82/1408994282.db2.gz XIFNYAGIBPVWRN-UHFFFAOYSA-N 0 0 393.403 3.091 20 5 GGBDRN CC(C)NC(=O)c1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000067056259 1408994493 /nfs/dbraw/zinc/99/44/93/1408994493.db2.gz QGTJXKBLHFIMMA-UHFFFAOYSA-N 0 0 393.403 3.171 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCC1(c2ccc3c(c2)OCO3)CCOCC1 ZINC000067059337 1408995041 /nfs/dbraw/zinc/99/50/41/1408995041.db2.gz PUTHOVDBOIBGLZ-UHFFFAOYSA-N 0 0 398.415 3.110 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1nc2c(s1)C[C@@H](c1ccccc1)CC2 ZINC000067067880 1408999292 /nfs/dbraw/zinc/99/92/92/1408999292.db2.gz ITHOADAKYBDXCV-ZDUSSCGKSA-N 0 0 383.433 3.159 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000067071904 1409000940 /nfs/dbraw/zinc/00/09/40/1409000940.db2.gz SNRYDSQPNBMTOQ-UHFFFAOYSA-N 0 0 384.392 3.423 20 5 GGBDRN CCOc1ccc(C(=O)N[C@@H](C(=O)NCc2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000067071341 1409001005 /nfs/dbraw/zinc/00/10/05/1409001005.db2.gz MPZDTUDTWFRJHO-LJQANCHMSA-N 0 0 399.447 3.064 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(Cl)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000067070942 1409001047 /nfs/dbraw/zinc/00/10/47/1409001047.db2.gz NSXDOQQZNYPUEA-UHFFFAOYSA-N 0 0 375.812 3.075 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067071229 1409001090 /nfs/dbraw/zinc/00/10/90/1409001090.db2.gz ORHQIUNPWJGNAV-KRWDZBQOSA-N 0 0 389.839 3.319 20 5 GGBDRN O=C(COc1cccc(NC(=O)c2ccco2)c1)NCc1cccc([N+](=O)[O-])c1 ZINC000067072694 1409001412 /nfs/dbraw/zinc/00/14/12/1409001412.db2.gz 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ZINC000067135225 1409017807 /nfs/dbraw/zinc/01/78/07/1409017807.db2.gz YWXHMEVIIKAQBY-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN COc1ccc([C@@H](C)N(C)C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000067135609 1409017874 /nfs/dbraw/zinc/01/78/74/1409017874.db2.gz PABOFNKMSZSWRY-CYBMUJFWSA-N 0 0 381.392 3.017 20 5 GGBDRN COc1ccc([C@@H](NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)C2CC2)cc1 ZINC000067135801 1409017890 /nfs/dbraw/zinc/01/78/90/1409017890.db2.gz GPPYBTQYPDIOEJ-IBGZPJMESA-N 0 0 393.403 3.065 20 5 GGBDRN CC(C)C(=O)Nc1cccc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1 ZINC000067136374 1409018466 /nfs/dbraw/zinc/01/84/66/1409018466.db2.gz RCJUVRMAPNVWJZ-UHFFFAOYSA-N 0 0 394.391 3.022 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067137939 1409018755 /nfs/dbraw/zinc/01/87/55/1409018755.db2.gz QOKRRTNIQXZWRV-UHFFFAOYSA-N 0 0 395.419 3.032 20 5 GGBDRN CCOc1ccc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1Cl ZINC000067138004 1409018795 /nfs/dbraw/zinc/01/87/95/1409018795.db2.gz QRVOQEGFQQWJIH-UHFFFAOYSA-N 0 0 387.783 3.480 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCC[C@H]1CCc1ccccc1 ZINC000067138091 1409018991 /nfs/dbraw/zinc/01/89/91/1409018991.db2.gz LCFOEFHVWOVQQB-KRWDZBQOSA-N 0 0 391.431 3.413 20 5 GGBDRN O=C(Nc1ccc(OC(F)F)c(F)c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067138120 1409019301 /nfs/dbraw/zinc/01/93/01/1409019301.db2.gz DGPNHIOYPRIOGO-UHFFFAOYSA-N 0 0 393.281 3.168 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC2)cc1 ZINC000067141586 1409020382 /nfs/dbraw/zinc/02/03/82/1409020382.db2.gz OJVJVBAQYAIDNV-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN O=C(Nc1cccc(COCC2CC2)c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067148181 1409022271 /nfs/dbraw/zinc/02/22/71/1409022271.db2.gz CWVYVXAFXLFNBZ-UHFFFAOYSA-N 0 0 393.403 3.354 20 5 GGBDRN Cc1ccccc1[C@@H]1CCN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)C1 ZINC000067150820 1409022977 /nfs/dbraw/zinc/02/29/77/1409022977.db2.gz 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Cc1nn(CCC(=O)Nc2c(F)cccc2N2CCCC2)c(C)c1[N+](=O)[O-] ZINC000067167694 1409031062 /nfs/dbraw/zinc/03/10/62/1409031062.db2.gz ZSVJIQHUDZSBRR-UHFFFAOYSA-N 0 0 375.404 3.176 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c(Cl)c1 ZINC000067168305 1409031504 /nfs/dbraw/zinc/03/15/04/1409031504.db2.gz HJLXOTGDYWPJKS-UHFFFAOYSA-N 0 0 391.767 3.230 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(NC(C)=O)cc2Cl)c([N+](=O)[O-])cc1OC ZINC000067168456 1409031539 /nfs/dbraw/zinc/03/15/39/1409031539.db2.gz RCIPUCZTQXRHEK-UHFFFAOYSA-N 0 0 393.783 3.476 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCO[C@@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000067177438 1409033656 /nfs/dbraw/zinc/03/36/56/1409033656.db2.gz NLIZVFKTIARMCE-QGZVFWFLSA-N 0 0 389.339 3.164 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000067232055 1409049088 /nfs/dbraw/zinc/04/90/88/1409049088.db2.gz URTJAXJXFBAIDP-QGZVFWFLSA-N 0 0 375.356 3.348 20 5 GGBDRN COc1cc(CN(C)C(=O)CNc2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000067284771 1409064204 /nfs/dbraw/zinc/06/42/04/1409064204.db2.gz YBGQXXYHRURRPR-UHFFFAOYSA-N 0 0 395.362 3.275 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCCCNc1ccc(C(F)(F)F)cn1 ZINC000067291774 1409065913 /nfs/dbraw/zinc/06/59/13/1409065913.db2.gz WBDDLURWWCFISX-UHFFFAOYSA-N 0 0 397.357 3.039 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1cccc(OCc2ccccn2)c1 ZINC000067293773 1409066078 /nfs/dbraw/zinc/06/60/78/1409066078.db2.gz JCTSPJKMMRGVPQ-UHFFFAOYSA-N 0 0 392.415 3.297 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000067297276 1409066645 /nfs/dbraw/zinc/06/66/45/1409066645.db2.gz HWIFOODSJZHIAD-UHFFFAOYSA-N 0 0 398.824 3.221 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(CN3CCCCC3)cs2)c1 ZINC000067299210 1409067319 /nfs/dbraw/zinc/06/73/19/1409067319.db2.gz UNBMVHPUJSZNBO-UHFFFAOYSA-N 0 0 376.438 3.298 20 5 GGBDRN CCNC(=O)Nc1cccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000067301485 1409067792 /nfs/dbraw/zinc/06/77/92/1409067792.db2.gz QRWZUNMERITVGY-UHFFFAOYSA-N 0 0 388.380 3.006 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1 ZINC000067299714 1409067832 /nfs/dbraw/zinc/06/78/32/1409067832.db2.gz ZFASGUHUEMANIO-UHFFFAOYSA-N 0 0 383.404 3.482 20 5 GGBDRN O=C(NCCCc1c[nH]c2ccccc12)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067305959 1409068243 /nfs/dbraw/zinc/06/82/43/1409068243.db2.gz CTTBFPNSQSJGRV-UHFFFAOYSA-N 0 0 390.403 3.019 20 5 GGBDRN O=C(NCc1ccccc1)NC1(C(=O)NCc2cccc([N+](=O)[O-])c2)CCCC1 ZINC000067329534 1409076839 /nfs/dbraw/zinc/07/68/39/1409076839.db2.gz HMBCOPZHOFTUNW-UHFFFAOYSA-N 0 0 396.447 3.023 20 5 GGBDRN O=C(N[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1)c1ccccc1 ZINC000067329559 1409076927 /nfs/dbraw/zinc/07/69/27/1409076927.db2.gz PTROFFYFLXUYPW-FQEVSTJZSA-N 0 0 389.411 3.382 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1 ZINC000067329587 1409076993 /nfs/dbraw/zinc/07/69/93/1409076993.db2.gz WKJTXMXHRBPUKD-MRXNPFEDSA-N 0 0 382.420 3.155 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1sccc1NC(=O)c1ccncc1 ZINC000067329421 1409077019 /nfs/dbraw/zinc/07/70/19/1409077019.db2.gz AHFWIQNZOYBNGK-UHFFFAOYSA-N 0 0 382.401 3.234 20 5 GGBDRN COc1cc(OC)c(OC)c2[nH]c(C(=O)NCc3cccc([N+](=O)[O-])c3)cc21 ZINC000067329441 1409077040 /nfs/dbraw/zinc/07/70/40/1409077040.db2.gz XCERHQHZQYNEMN-UHFFFAOYSA-N 0 0 385.376 3.032 20 5 GGBDRN Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NCc3cccc([N+](=O)[O-])c3)n2)n1 ZINC000067329988 1409077077 /nfs/dbraw/zinc/07/70/77/1409077077.db2.gz IASGTWIOQLUENT-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000176590849 1428372946 /nfs/dbraw/zinc/37/29/46/1428372946.db2.gz JYRRPNKSXRCGOO-CQSZACIVSA-N 0 0 375.812 3.266 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2cccc(Cl)c2)C1 ZINC000176591842 1428373124 /nfs/dbraw/zinc/37/31/24/1428373124.db2.gz GCSRFSBJFAPAEL-HNNXBMFYSA-N 0 0 389.839 3.412 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 ZINC000176592258 1428373165 /nfs/dbraw/zinc/37/31/65/1428373165.db2.gz SKDHBTPCJXJCFY-CQSZACIVSA-N 0 0 375.812 3.022 20 5 GGBDRN COc1cc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000176594315 1428373648 /nfs/dbraw/zinc/37/36/48/1428373648.db2.gz LPQMUXGUYRQEFU-GOSISDBHSA-N 0 0 384.432 3.467 20 5 GGBDRN COc1cc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000176594298 1428373703 /nfs/dbraw/zinc/37/37/03/1428373703.db2.gz LPQMUXGUYRQEFU-SFHVURJKSA-N 0 0 384.432 3.467 20 5 GGBDRN O=c1[nH]cnc2cc(NC[C@H](O)c3ccc4ccccc4c3)c([N+](=O)[O-])cc12 ZINC000067372910 1409090293 /nfs/dbraw/zinc/09/02/93/1409090293.db2.gz WLSAVBPIAZAPLE-IBGZPJMESA-N 0 0 376.372 3.130 20 5 GGBDRN COc1c(Cl)cccc1NC(=O)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000067374971 1409090883 /nfs/dbraw/zinc/09/08/83/1409090883.db2.gz BXIGPLBVZVDVQN-SNVBAGLBSA-N 0 0 377.784 3.073 20 5 GGBDRN O=C1[C@@H](N2CCC(OCc3ccccc3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067376105 1409091306 /nfs/dbraw/zinc/09/13/06/1409091306.db2.gz HXJQSRYZBUQQFW-NRFANRHFSA-N 0 0 395.459 3.381 20 5 GGBDRN COc1ccc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176595774 1428374217 /nfs/dbraw/zinc/37/42/17/1428374217.db2.gz IAKULOANZFGQNI-SFHVURJKSA-N 0 0 384.432 3.467 20 5 GGBDRN C[C@H](COCC(F)(F)F)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000067383323 1409095425 /nfs/dbraw/zinc/09/54/25/1409095425.db2.gz GXQUUANNQGDTMY-LLVKDONJSA-N 0 0 375.347 3.210 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(NCc2cccc([N+](=O)[O-])c2)c([N+](=O)[O-])c1 ZINC000067383772 1409096069 /nfs/dbraw/zinc/09/60/69/1409096069.db2.gz UXAZUTGNGKAUNF-UHFFFAOYSA-N 0 0 381.348 3.080 20 5 GGBDRN CC(=O)NC[C@@H]1CCCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000067385357 1409096357 /nfs/dbraw/zinc/09/63/57/1409096357.db2.gz AIFBPMDSRGFEQI-INIZCTEOSA-N 0 0 381.432 3.178 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCCCOc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000067397530 1409101310 /nfs/dbraw/zinc/10/13/10/1409101310.db2.gz BEVJSZADTQPAMG-UHFFFAOYSA-N 0 0 385.420 3.044 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCC(COc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000067398475 1409101829 /nfs/dbraw/zinc/10/18/29/1409101829.db2.gz ZPMRZNRNJSZBSC-UHFFFAOYSA-N 0 0 397.431 3.159 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCOc3c(Cl)cccc32)cccc1[N+](=O)[O-] ZINC000067414437 1409108819 /nfs/dbraw/zinc/10/88/19/1409108819.db2.gz CIJIYWPERRCUBI-CQSZACIVSA-N 0 0 389.795 3.135 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCOc3c(Cl)cccc32)cccc1[N+](=O)[O-] ZINC000067414439 1409108954 /nfs/dbraw/zinc/10/89/54/1409108954.db2.gz CIJIYWPERRCUBI-AWEZNQCLSA-N 0 0 389.795 3.135 20 5 GGBDRN CC1CCC(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000067415623 1409109767 /nfs/dbraw/zinc/10/97/67/1409109767.db2.gz IYWDQXWVJPVFLZ-UHFFFAOYSA-N 0 0 385.367 3.077 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F ZINC000067424633 1409114252 /nfs/dbraw/zinc/11/42/52/1409114252.db2.gz WBOQQFQHDHSEHX-JTQLQIEISA-N 0 0 381.310 3.430 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ncc(-c3cccs3)o2)C1=O ZINC000067428094 1409115622 /nfs/dbraw/zinc/11/56/22/1409115622.db2.gz XUVVFZQQPROSRX-GOSISDBHSA-N 0 0 398.400 3.279 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ncc(-c3cccs3)o2)C1=O ZINC000067428093 1409115679 /nfs/dbraw/zinc/11/56/79/1409115679.db2.gz XUVVFZQQPROSRX-SFHVURJKSA-N 0 0 398.400 3.279 20 5 GGBDRN O=C1[C@@H](Sc2nccc(C(F)(F)F)n2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067429219 1409115900 /nfs/dbraw/zinc/11/59/00/1409115900.db2.gz ALYFJPUHIYURIV-NSHDSACASA-N 0 0 384.339 3.301 20 5 GGBDRN Cc1occc1-c1nnc(S[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1 ZINC000067428554 1409115971 /nfs/dbraw/zinc/11/59/71/1409115971.db2.gz CIYNBUKLMFRYME-AWEZNQCLSA-N 0 0 386.389 3.444 20 5 GGBDRN O=C1[C@@H](Sc2ncn(-c3ccccc3)n2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067429098 1409116203 /nfs/dbraw/zinc/11/62/03/1409116203.db2.gz MOYGLVOWWXPBSD-INIZCTEOSA-N 0 0 381.417 3.073 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ncc(-c3cccs3)o2)C1=O ZINC000067429388 1409116238 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ZINC000067558140 1409161638 /nfs/dbraw/zinc/16/16/38/1409161638.db2.gz FFBPQDSCUOWBKZ-GOSISDBHSA-N 0 0 398.419 3.342 20 5 GGBDRN Cc1cccc(C)c1OC[C@H](O)CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000067604198 1409184284 /nfs/dbraw/zinc/18/42/84/1409184284.db2.gz GULHQNRWUOFMTG-CRAIPNDOSA-N 0 0 387.436 3.012 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccc(-n2ccnc2)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000067645971 1409195123 /nfs/dbraw/zinc/19/51/23/1409195123.db2.gz LCPHNJXAGLOFOP-CYBMUJFWSA-N 0 0 383.383 3.480 20 5 GGBDRN O=C(CSc1ncccc1[N+](=O)[O-])NCCc1ccc(OC(F)F)cc1 ZINC000067649028 1409197939 /nfs/dbraw/zinc/19/79/39/1409197939.db2.gz PVYYGJHMXGIHNJ-UHFFFAOYSA-N 0 0 383.376 3.042 20 5 GGBDRN CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCCOC(C)(C)C ZINC000067653892 1409198139 /nfs/dbraw/zinc/19/81/39/1409198139.db2.gz YWYSJPRNOXIBKY-UHFFFAOYSA-N 0 0 377.397 3.151 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccc(S(C)(=O)=O)cc1 ZINC000067656392 1409198728 /nfs/dbraw/zinc/19/87/28/1409198728.db2.gz RNFFDSCNAXLQPE-GFCCVEGCSA-N 0 0 394.474 3.142 20 5 GGBDRN C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)c1nc2ccccc2n1C(F)F ZINC000067658611 1409199450 /nfs/dbraw/zinc/19/94/50/1409199450.db2.gz RBVHNKFAMCDFJV-JTQLQIEISA-N 0 0 379.323 3.231 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1nc(-c2c(F)cccc2F)cs1 ZINC000067659486 1409200093 /nfs/dbraw/zinc/20/00/93/1409200093.db2.gz QETNCXSCQZIMMK-UHFFFAOYSA-N 0 0 379.348 3.222 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 ZINC000067663987 1409201242 /nfs/dbraw/zinc/20/12/42/1409201242.db2.gz XADSXLIDXFYYOR-KRWDZBQOSA-N 0 0 384.392 3.034 20 5 GGBDRN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067664023 1409201464 /nfs/dbraw/zinc/20/14/64/1409201464.db2.gz YJYNWQWMMGDCHO-UHFFFAOYSA-N 0 0 382.420 3.461 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 ZINC000067663988 1409201479 /nfs/dbraw/zinc/20/14/79/1409201479.db2.gz XADSXLIDXFYYOR-QGZVFWFLSA-N 0 0 384.392 3.034 20 5 GGBDRN Cc1cccc(NC(=O)NCc2cccc([N+](=O)[O-])c2)c1C(=O)N1CCCC1 ZINC000067664772 1409201768 /nfs/dbraw/zinc/20/17/68/1409201768.db2.gz JDGOJEQMPBZCRA-UHFFFAOYSA-N 0 0 382.420 3.461 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1nnc2n1CCC2 ZINC000067677367 1409204710 /nfs/dbraw/zinc/20/47/10/1409204710.db2.gz JFSPQWVISXGRPP-CYBMUJFWSA-N 0 0 392.419 3.367 20 5 GGBDRN CN(C[C@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000067687429 1409207508 /nfs/dbraw/zinc/20/75/08/1409207508.db2.gz MYOBPDBWLIONAB-OAHLLOKOSA-N 0 0 391.468 3.243 20 5 GGBDRN CN(C[C@@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000067687427 1409207578 /nfs/dbraw/zinc/20/75/78/1409207578.db2.gz MYOBPDBWLIONAB-HNNXBMFYSA-N 0 0 391.468 3.243 20 5 GGBDRN Cn1ccnc1Sc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000067699780 1409208222 /nfs/dbraw/zinc/20/82/22/1409208222.db2.gz OOXHSCLGZXLFHH-UHFFFAOYSA-N 0 0 387.396 3.453 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1ccc2c(c1)OCCO2 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/nfs/dbraw/zinc/22/23/54/1409222354.db2.gz YEFDFLOVMLSYEL-UHFFFAOYSA-N 0 0 388.395 3.221 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000067753395 1409222549 /nfs/dbraw/zinc/22/25/49/1409222549.db2.gz YSXXYAZOOUYSQN-LJQANCHMSA-N 0 0 384.388 3.256 20 5 GGBDRN CC[C@H](C)Oc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000067753927 1409222558 /nfs/dbraw/zinc/22/25/58/1409222558.db2.gz GBKAGEJQHIWOSW-LBPRGKRZSA-N 0 0 392.433 3.428 20 5 GGBDRN CN(C)[C@@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000067785759 1409231415 /nfs/dbraw/zinc/23/14/15/1409231415.db2.gz PQNSYQNQLOVACV-KRWDZBQOSA-N 0 0 391.855 3.436 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(OC)c(Cl)cc2OC)cc1[N+](=O)[O-] ZINC000067791934 1409231764 /nfs/dbraw/zinc/23/17/64/1409231764.db2.gz IWSYQWKQCXVKFJ-UHFFFAOYSA-N 0 0 380.784 3.455 20 5 GGBDRN COc1ccc(CC(=O)Nc2nnc(Cc3ccccc3)s2)cc1[N+](=O)[O-] ZINC000067789629 1409231805 /nfs/dbraw/zinc/23/18/05/1409231805.db2.gz CXLNKAZZAIXDQA-UHFFFAOYSA-N 0 0 384.417 3.227 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccccc2C(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000067792493 1409232247 /nfs/dbraw/zinc/23/22/47/1409232247.db2.gz KYBKQDGHXSDLQW-UHFFFAOYSA-N 0 0 397.431 3.411 20 5 GGBDRN COc1ccc(CC(=O)NCCc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000067794335 1409232676 /nfs/dbraw/zinc/23/26/76/1409232676.db2.gz NXMFNMNZFIRYLD-UHFFFAOYSA-N 0 0 380.347 3.106 20 5 GGBDRN COc1ccc(CC(=O)N(C)CCOc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000067795786 1409232766 /nfs/dbraw/zinc/23/27/66/1409232766.db2.gz QQDVWYJQVWTLBZ-UHFFFAOYSA-N 0 0 378.812 3.337 20 5 GGBDRN COc1ccc(CC(=O)N2CCC(OCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000067795746 1409232830 /nfs/dbraw/zinc/23/28/30/1409232830.db2.gz CEKNIYHGDCHKOB-UHFFFAOYSA-N 0 0 384.432 3.354 20 5 GGBDRN COc1ccc(CC(=O)N2CCC[C@H](C(=O)Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067796279 1409233391 /nfs/dbraw/zinc/23/33/91/1409233391.db2.gz YCYUQCGBFZODNG-INIZCTEOSA-N 0 0 397.431 3.023 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1[N+](=O)[O-] ZINC000067799212 1409233641 /nfs/dbraw/zinc/23/36/41/1409233641.db2.gz DPIUJRXBEANRFD-KRWDZBQOSA-N 0 0 386.404 3.342 20 5 GGBDRN COc1ccc(CC(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1[N+](=O)[O-] ZINC000067800055 1409233843 /nfs/dbraw/zinc/23/38/43/1409233843.db2.gz SLTVCKDKSVLORN-UHFFFAOYSA-N 0 0 399.447 3.168 20 5 GGBDRN CCN(Cc1ccccc1NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)C(C)=O ZINC000067812025 1409236786 /nfs/dbraw/zinc/23/67/86/1409236786.db2.gz KYXXVOBVUBWBMC-UHFFFAOYSA-N 0 0 385.420 3.153 20 5 GGBDRN COc1ccc(CC(=O)N2CCN(c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] ZINC000067814188 1409236809 /nfs/dbraw/zinc/23/68/09/1409236809.db2.gz MQMBCRRMIUWNSR-UHFFFAOYSA-N 0 0 389.839 3.148 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1[N+](=O)[O-] ZINC000067816244 1409237309 /nfs/dbraw/zinc/23/73/09/1409237309.db2.gz YPUUFVYANIKZPW-UHFFFAOYSA-N 0 0 385.420 3.313 20 5 GGBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000067815464 1409237323 /nfs/dbraw/zinc/23/73/23/1409237323.db2.gz CKWCEPCCIGZMCS-CQSZACIVSA-N 0 0 399.447 3.447 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccccc2OCCn2ccnc2)cc1[N+](=O)[O-] ZINC000067818795 1409237631 /nfs/dbraw/zinc/23/76/31/1409237631.db2.gz XIMARNDDCLMBKN-UHFFFAOYSA-N 0 0 396.403 3.060 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000067818043 1409237783 /nfs/dbraw/zinc/23/77/83/1409237783.db2.gz OUSABQBZUBEQMI-UHFFFAOYSA-N 0 0 398.337 3.403 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](C)COc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000067819298 1409237878 /nfs/dbraw/zinc/23/78/78/1409237878.db2.gz VYSZARGYHKWQGZ-LLVKDONJSA-N 0 0 380.347 3.008 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(Cl)ccc2NC(C)=O)cc1[N+](=O)[O-] ZINC000067821801 1409238197 /nfs/dbraw/zinc/23/81/97/1409238197.db2.gz PQMAOTASTSTJLK-UHFFFAOYSA-N 0 0 377.784 3.396 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccnn1Cc1ccccc1 ZINC000067823669 1409238627 /nfs/dbraw/zinc/23/86/27/1409238627.db2.gz PQODKRPAHNMUQN-UHFFFAOYSA-N 0 0 375.388 3.433 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@@H](c2ccccc2)O1 ZINC000067827133 1409239137 /nfs/dbraw/zinc/23/91/37/1409239137.db2.gz CMGNBIZPABLOPC-QRWLVFNGSA-N 0 0 392.415 3.383 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)Oc2ccc3ccc(=O)oc3c2)cc1[N+](=O)[O-] ZINC000176633718 1428385808 /nfs/dbraw/zinc/38/58/08/1428385808.db2.gz RZMURYYNJVFIAK-UHFFFAOYSA-N 0 0 395.776 3.431 20 5 GGBDRN COc1cc(C(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000067828214 1409239708 /nfs/dbraw/zinc/23/97/08/1409239708.db2.gz RZVDXXQDMMNGPB-ORAYPTAESA-N 0 0 386.404 3.214 20 5 GGBDRN COc1cc(C(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000067828215 1409239859 /nfs/dbraw/zinc/23/98/59/1409239859.db2.gz RZVDXXQDMMNGPB-DJJJIMSYSA-N 0 0 386.404 3.214 20 5 GGBDRN Cc1ccc(C(=O)Oc2cccc(NC(=O)c3cnn(C)c3)c2)cc1[N+](=O)[O-] ZINC000067841152 1409242013 /nfs/dbraw/zinc/24/20/13/1409242013.db2.gz ICEZBUPJNVLQBK-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN COc1ccc(C)c2c1N(C(=O)c1cc([N+](=O)[O-])cc3c1OCCO3)CCC2 ZINC000067841876 1409242403 /nfs/dbraw/zinc/24/24/03/1409242403.db2.gz IDLYUQKRXWZYKS-UHFFFAOYSA-N 0 0 384.388 3.276 20 5 GGBDRN CCOc1ccccc1CCNC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] ZINC000067849748 1409244185 /nfs/dbraw/zinc/24/41/85/1409244185.db2.gz XDONTVPPNPIKAS-UHFFFAOYSA-N 0 0 388.420 3.373 20 5 GGBDRN CSCCc1ccc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1 ZINC000067856856 1409244978 /nfs/dbraw/zinc/24/49/78/1409244978.db2.gz PFRJUQDFNNFTAZ-UHFFFAOYSA-N 0 0 394.474 3.156 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067860219 1409245631 /nfs/dbraw/zinc/24/56/31/1409245631.db2.gz XSGFGPLZLMMPPP-KZULUSFZSA-N 0 0 385.376 3.414 20 5 GGBDRN Cc1cccc(C(=O)NC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000067859622 1409245786 /nfs/dbraw/zinc/24/57/86/1409245786.db2.gz WNZIHHPAICQEOW-CYBMUJFWSA-N 0 0 398.337 3.092 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1 ZINC000067869476 1409246564 /nfs/dbraw/zinc/24/65/64/1409246564.db2.gz LZGFORVODGYRAM-ZDUSSCGKSA-N 0 0 396.403 3.162 20 5 GGBDRN COC(=O)C[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000067868989 1409246658 /nfs/dbraw/zinc/24/66/58/1409246658.db2.gz MOJDSSOPKAWYAV-KRWDZBQOSA-N 0 0 399.378 3.109 20 5 GGBDRN COc1ccc([C@H](NC(=O)Cn2cc([N+](=O)[O-])nc2C)c2ccc(F)cc2)cc1 ZINC000067869322 1409246663 /nfs/dbraw/zinc/24/66/63/1409246663.db2.gz LWXOZEDTXAKPEY-HXUWFJFHSA-N 0 0 398.394 3.153 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000067879438 1409248644 /nfs/dbraw/zinc/24/86/44/1409248644.db2.gz WCEMWOIMDCIVFG-MLGOLLRUSA-N 0 0 396.852 3.399 20 5 GGBDRN COc1ccc(CC(=O)NC[C@H](c2ccccc2Cl)N(C)C)cc1[N+](=O)[O-] ZINC000067900554 1409252131 /nfs/dbraw/zinc/25/21/31/1409252131.db2.gz AQUZXYXBXPWRQB-QGZVFWFLSA-N 0 0 391.855 3.218 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C12CCCCC2 ZINC000176642675 1428388861 /nfs/dbraw/zinc/38/88/61/1428388861.db2.gz KVBNEJOTOXZLFO-ROUUACIJSA-N 0 0 399.447 3.294 20 5 GGBDRN COc1ccc(C)c2c1N(S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)CCC2 ZINC000067899468 1409252386 /nfs/dbraw/zinc/25/23/86/1409252386.db2.gz IGRAIAAPUJWTKZ-UHFFFAOYSA-N 0 0 392.433 3.062 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccccc2NC(=O)N2CCCC2)cc1[N+](=O)[O-] ZINC000067907577 1409253567 /nfs/dbraw/zinc/25/35/67/1409253567.db2.gz OGGZBYUTWVRYHV-UHFFFAOYSA-N 0 0 398.419 3.412 20 5 GGBDRN COc1ccc(CC(=O)NCCNc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000067907267 1409253805 /nfs/dbraw/zinc/25/38/05/1409253805.db2.gz DOIQFWGOPRPFMW-UHFFFAOYSA-N 0 0 399.234 3.076 20 5 GGBDRN COc1ccc(CC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-] ZINC000067910541 1409254064 /nfs/dbraw/zinc/25/40/64/1409254064.db2.gz WTUBCRLOWDKXQB-UHFFFAOYSA-N 0 0 394.431 3.428 20 5 GGBDRN COc1ccc(CC(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1[N+](=O)[O-] ZINC000067924442 1409256452 /nfs/dbraw/zinc/25/64/52/1409256452.db2.gz MIPYFPVOMADKQU-SFHVURJKSA-N 0 0 392.358 3.024 20 5 GGBDRN O=[N+]([O-])c1ncccc1OS(=O)(=O)c1cc(Br)ccc1Cl ZINC000067946555 1409262059 /nfs/dbraw/zinc/26/20/59/1409262059.db2.gz OKBSUTPPSCINIK-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN CS(=O)(=O)c1ccc(NC[C@@H](c2cccs2)N2CCCC2)c([N+](=O)[O-])c1 ZINC000067948655 1409262021 /nfs/dbraw/zinc/26/20/21/1409262021.db2.gz GZIQQPVCRCDGTL-INIZCTEOSA-N 0 0 395.506 3.309 20 5 GGBDRN CCOc1ccc(CN(C)c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])cc1 ZINC000067948989 1409262134 /nfs/dbraw/zinc/26/21/34/1409262134.db2.gz FAAJARCKOQURDH-UHFFFAOYSA-N 0 0 399.447 3.102 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@H]2CN(Cc3ccccc3)CCO2)c2ccncc21 ZINC000067949273 1409262146 /nfs/dbraw/zinc/26/21/46/1409262146.db2.gz RQOFXTHPMGWWGU-KRWDZBQOSA-N 0 0 378.432 3.456 20 5 GGBDRN COc1ccc(CCNC(=O)CNc2ccc(Cl)c([N+](=O)[O-])c2)cc1OC ZINC000067948160 1409262234 /nfs/dbraw/zinc/26/22/34/1409262234.db2.gz KJTRZOKWMNDTRC-UHFFFAOYSA-N 0 0 393.827 3.036 20 5 GGBDRN O=C(c1ccc(NCCc2c[nH]c3ccccc23)c([N+](=O)[O-])c1)N1CCOCC1 ZINC000067949714 1409262473 /nfs/dbraw/zinc/26/24/73/1409262473.db2.gz QCOXUCBCIASGNF-UHFFFAOYSA-N 0 0 394.431 3.203 20 5 GGBDRN O=C(c1ccc(NCc2cccc(Cl)c2)c([N+](=O)[O-])c1)N1CCOCC1 ZINC000067949639 1409262668 /nfs/dbraw/zinc/26/26/68/1409262668.db2.gz SFSKOGCXKAAKBL-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN O=C(c1ccc(NCCc2ccc(Cl)cc2)c([N+](=O)[O-])c1)N1CCOCC1 ZINC000067949729 1409262789 /nfs/dbraw/zinc/26/27/89/1409262789.db2.gz ONITWBFMVIKJAZ-UHFFFAOYSA-N 0 0 389.839 3.375 20 5 GGBDRN C[C@H]1CSc2ccccc2N1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000176644766 1428389966 /nfs/dbraw/zinc/38/99/66/1428389966.db2.gz FXZAARXAHTUVHL-LBPRGKRZSA-N 0 0 381.417 3.317 20 5 GGBDRN COc1ccc(NC(=O)C[C@H]2c3ccccc3CCN2C(C)=O)c([N+](=O)[O-])c1 ZINC000067976618 1409268148 /nfs/dbraw/zinc/26/81/48/1409268148.db2.gz BAUUFVXHXJHAKL-SFHVURJKSA-N 0 0 383.404 3.078 20 5 GGBDRN COc1ccc(NC(=O)C[C@@H]2c3ccccc3CCN2C(C)=O)c([N+](=O)[O-])c1 ZINC000067976619 1409268423 /nfs/dbraw/zinc/26/84/23/1409268423.db2.gz BAUUFVXHXJHAKL-GOSISDBHSA-N 0 0 383.404 3.078 20 5 GGBDRN C[C@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000067990774 1409271258 /nfs/dbraw/zinc/27/12/58/1409271258.db2.gz RTOCAUUCEQUWKL-NSHDSACASA-N 0 0 389.358 3.491 20 5 GGBDRN C[C@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000067990792 1409271531 /nfs/dbraw/zinc/27/15/31/1409271531.db2.gz PAAOJFUNFYOFMS-JTQLQIEISA-N 0 0 391.330 3.321 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])CC1 ZINC000067993433 1409272371 /nfs/dbraw/zinc/27/23/71/1409272371.db2.gz SNBCIWBWAYDLAO-UHFFFAOYSA-N 0 0 399.394 3.250 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1nc(-c2ccncc2)no1 ZINC000067995200 1409272876 /nfs/dbraw/zinc/27/28/76/1409272876.db2.gz WGTUWLIEXQGZKT-OAHLLOKOSA-N 0 0 385.355 3.306 20 5 GGBDRN C[C@H](c1ccccn1)N(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000067999637 1409273322 /nfs/dbraw/zinc/27/33/22/1409273322.db2.gz XWOHOGOYYSICBH-GFCCVEGCSA-N 0 0 398.448 3.103 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1nc(-c2ccncc2)no1)C(C)C ZINC000068002042 1409273641 /nfs/dbraw/zinc/27/36/41/1409273641.db2.gz CEZHWBKAIZRGPE-MRXNPFEDSA-N 0 0 397.391 3.176 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc3c(s2)C(=O)CCC3)cc1[N+](=O)[O-] ZINC000068003687 1409274067 /nfs/dbraw/zinc/27/40/67/1409274067.db2.gz SZVKCABEWNRGND-UHFFFAOYSA-N 0 0 376.350 3.039 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnc(-c2cccc(Cl)c2)s1 ZINC000068010516 1409275547 /nfs/dbraw/zinc/27/55/47/1409275547.db2.gz FVYXGOSPUPXHRF-UHFFFAOYSA-N 0 0 392.828 3.300 20 5 GGBDRN COc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(OC)c1OC ZINC000068013082 1409277202 /nfs/dbraw/zinc/27/72/02/1409277202.db2.gz JJZZYAKAFHNWJC-UHFFFAOYSA-N 0 0 394.811 3.247 20 5 GGBDRN CC(=O)Nc1ccc(C)cc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000068025641 1409282402 /nfs/dbraw/zinc/28/24/02/1409282402.db2.gz LUIMVNUXUUJMHR-UHFFFAOYSA-N 0 0 379.376 3.300 20 5 GGBDRN COc1ccc(C)cc1-n1nnnc1Sc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000068045604 1409285257 /nfs/dbraw/zinc/28/52/57/1409285257.db2.gz FCJDLLRWAIWECO-UHFFFAOYSA-N 0 0 385.405 3.241 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1nc(C2CC2)no1 ZINC000068046960 1409285711 /nfs/dbraw/zinc/28/57/11/1409285711.db2.gz AZPWDRHTWZVPLH-INIZCTEOSA-N 0 0 396.407 3.168 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1nc(C2CC2)no1 ZINC000068051404 1409287380 /nfs/dbraw/zinc/28/73/80/1409287380.db2.gz NENRMWUNLHAOLS-INIZCTEOSA-N 0 0 396.407 3.168 20 5 GGBDRN Cc1c(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cccc1OCC(F)(F)F ZINC000068054738 1409287932 /nfs/dbraw/zinc/28/79/32/1409287932.db2.gz ZAHAGWXTKOAYJN-UHFFFAOYSA-N 0 0 386.330 3.415 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)SCCCNc2ncccn2)cccc1[N+](=O)[O-] ZINC000068061870 1409288467 /nfs/dbraw/zinc/28/84/67/1409288467.db2.gz WNSIVLXCLNRTFC-ZDUSSCGKSA-N 0 0 375.454 3.256 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)c3cc([N+](=O)[O-])ccc3OC)cc2)n1 ZINC000068066624 1409290036 /nfs/dbraw/zinc/29/00/36/1409290036.db2.gz AYDJCLSGFPOBOK-UHFFFAOYSA-N 0 0 396.403 3.188 20 5 GGBDRN CCOc1cc(C(=O)Nc2nc(C(C)(C)C)ns2)c([N+](=O)[O-])cc1OC ZINC000068073503 1409291022 /nfs/dbraw/zinc/29/10/22/1409291022.db2.gz FREHJVBXGZNIJK-UHFFFAOYSA-N 0 0 380.426 3.403 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)Cn1cccn1 ZINC000068086349 1409296339 /nfs/dbraw/zinc/29/63/39/1409296339.db2.gz QJDRJVGOBIKYIN-MRXNPFEDSA-N 0 0 385.468 3.094 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)Cn1cccn1 ZINC000068086367 1409296448 /nfs/dbraw/zinc/29/64/48/1409296448.db2.gz QKHFQXKGDHZTON-MRXNPFEDSA-N 0 0 393.447 3.470 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)Nc2ccc3c[nH]nc3c2)cc1[N+](=O)[O-] ZINC000068101926 1409301987 /nfs/dbraw/zinc/30/19/87/1409301987.db2.gz YKMGSJWTCAFVDM-UHFFFAOYSA-N 0 0 395.404 3.003 20 5 GGBDRN Cn1cc(CC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000068103092 1409301994 /nfs/dbraw/zinc/30/19/94/1409301994.db2.gz QGAPBQVOIZWQBC-UHFFFAOYSA-N 0 0 375.388 3.453 20 5 GGBDRN C[C@@H](NC(=O)c1cccn(Cc2ccccc2)c1=O)c1cccc([N+](=O)[O-])c1 ZINC000068102693 1409302065 /nfs/dbraw/zinc/30/20/65/1409302065.db2.gz POSLCROYPFLUSY-OAHLLOKOSA-N 0 0 377.400 3.296 20 5 GGBDRN COc1cccc2c1OCC(C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)=C2 ZINC000068104416 1409302589 /nfs/dbraw/zinc/30/25/89/1409302589.db2.gz WVWDVCJSWXZUDL-UHFFFAOYSA-N 0 0 392.371 3.204 20 5 GGBDRN CC(C)n1ncc2cc(C(=O)Nc3ccnn3-c3ccc([N+](=O)[O-])cc3)cnc21 ZINC000068103682 1409302615 /nfs/dbraw/zinc/30/26/15/1409302615.db2.gz OLQDYAHMEHTHHO-UHFFFAOYSA-N 0 0 391.391 3.358 20 5 GGBDRN CCN(C)C(=O)c1cccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000068103603 1409302812 /nfs/dbraw/zinc/30/28/12/1409302812.db2.gz AMKKWENSWCNCKT-UHFFFAOYSA-N 0 0 393.403 3.125 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000068104474 1409302848 /nfs/dbraw/zinc/30/28/48/1409302848.db2.gz WUXVIZPJRFMIGE-UHFFFAOYSA-N 0 0 391.387 3.381 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2oc1=O 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/nfs/dbraw/zinc/30/64/88/1409306488.db2.gz QZGXNKQHARMJMM-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1cc(NC(=O)Cc2noc3ccccc23)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068120908 1409308123 /nfs/dbraw/zinc/30/81/23/1409308123.db2.gz UGBKKCNAANEUGJ-UHFFFAOYSA-N 0 0 377.360 3.411 20 5 GGBDRN Cc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068120746 1409308209 /nfs/dbraw/zinc/30/82/09/1409308209.db2.gz AJGZQFQUYOASCC-UHFFFAOYSA-N 0 0 381.348 3.178 20 5 GGBDRN Cc1cc(NC(=O)c2cc3ccccc3oc2=O)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068120722 1409308246 /nfs/dbraw/zinc/30/82/46/1409308246.db2.gz IRZUSTXOZCHEDL-UHFFFAOYSA-N 0 0 390.355 3.448 20 5 GGBDRN C[C@H]1CC(C)(C)CC[C@H]1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000176659771 1428394420 /nfs/dbraw/zinc/39/44/20/1428394420.db2.gz GLJWRLQWUBEYDW-WCQYABFASA-N 0 0 381.860 3.309 20 5 GGBDRN Cc1cc(NC(=O)CCc2c(C)nn(C)c2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068121014 1409308321 /nfs/dbraw/zinc/30/83/21/1409308321.db2.gz SGDYPQKBSOJPCH-UHFFFAOYSA-N 0 0 382.424 3.011 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000176657796 1428393800 /nfs/dbraw/zinc/39/38/00/1428393800.db2.gz SAYDBZNYLNEUSU-LBPRGKRZSA-N 0 0 384.841 3.133 20 5 GGBDRN COc1ccc(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c(OC)c1OC ZINC000068131809 1409310459 /nfs/dbraw/zinc/31/04/59/1409310459.db2.gz BDODCBUZOSUFLU-UHFFFAOYSA-N 0 0 399.403 3.074 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000068140355 1409312578 /nfs/dbraw/zinc/31/25/78/1409312578.db2.gz SSCFLFHVVGIWFZ-UHFFFAOYSA-N 0 0 386.795 3.200 20 5 GGBDRN Cc1nn(C)cc1[C@H](C)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000068154521 1409316599 /nfs/dbraw/zinc/31/65/99/1409316599.db2.gz LBJATBBJZITSIZ-VIFPVBQESA-N 0 0 386.330 3.069 20 5 GGBDRN C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000176659738 1428394605 /nfs/dbraw/zinc/39/46/05/1428394605.db2.gz GLJWRLQWUBEYDW-AAEUAGOBSA-N 0 0 381.860 3.309 20 5 GGBDRN CC(C)N(C)c1cccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000068163902 1409320302 /nfs/dbraw/zinc/32/03/02/1409320302.db2.gz YRHDBBKIBXWCIM-UHFFFAOYSA-N 0 0 380.408 3.272 20 5 GGBDRN O=C(N[C@@H]1CCOc2ccc(F)cc21)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000068165590 1409320654 /nfs/dbraw/zinc/32/06/54/1409320654.db2.gz ICSAOQIPQZVQOG-QGZVFWFLSA-N 0 0 382.351 3.173 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@@H]1CSCCS1 ZINC000176661279 1428395013 /nfs/dbraw/zinc/39/50/13/1428395013.db2.gz QBDNTHCWFWPHLD-CQSZACIVSA-N 0 0 384.526 3.120 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000068174570 1409323769 /nfs/dbraw/zinc/32/37/69/1409323769.db2.gz QVKHMZDRZQTAIM-CYBMUJFWSA-N 0 0 398.419 3.229 20 5 GGBDRN Cc1nc2c(cnn2C(C)C)cc1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068184491 1409325374 /nfs/dbraw/zinc/32/53/74/1409325374.db2.gz MCXQFCZRVQIABP-UHFFFAOYSA-N 0 0 383.408 3.038 20 5 GGBDRN O=C(Cc1csc(-c2ccccc2)n1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068184080 1409325398 /nfs/dbraw/zinc/32/53/98/1409325398.db2.gz QZHFNYUQQFXFOW-UHFFFAOYSA-N 0 0 383.429 3.456 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068183973 1409325534 /nfs/dbraw/zinc/32/55/34/1409325534.db2.gz GXUYJIMACMFQGQ-UHFFFAOYSA-N 0 0 394.431 3.135 20 5 GGBDRN Cc1c(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cnn1-c1cccc(C)c1 ZINC000068186218 1409326053 /nfs/dbraw/zinc/32/60/53/1409326053.db2.gz NUZFXCNYBDUZMU-UHFFFAOYSA-N 0 0 380.404 3.206 20 5 GGBDRN CCc1c(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cnn1-c1ccc(F)cc1 ZINC000068186231 1409326084 /nfs/dbraw/zinc/32/60/84/1409326084.db2.gz RBVZSBUVNCCNHL-UHFFFAOYSA-N 0 0 398.394 3.291 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1[N+](=O)[O-] ZINC000176661566 1428395705 /nfs/dbraw/zinc/39/57/05/1428395705.db2.gz BZOYROQPWQJGMM-UHFFFAOYSA-N 0 0 397.796 3.216 20 5 GGBDRN COc1cc(CCNc2c(F)c(F)nc(F)c2F)c([N+](=O)[O-])cc1OC ZINC000176662686 1428395720 /nfs/dbraw/zinc/39/57/20/1428395720.db2.gz JGRVIQBREMVSKW-UHFFFAOYSA-N 0 0 375.278 3.218 20 5 GGBDRN O=C(NCC1(Sc2ccccc2)CC1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000068214422 1409331520 /nfs/dbraw/zinc/33/15/20/1409331520.db2.gz VOPOCZWNBPCUEF-UHFFFAOYSA-N 0 0 386.429 3.421 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2NC(=O)CNc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000068217265 1409332322 /nfs/dbraw/zinc/33/23/22/1409332322.db2.gz JAVMSQMLAUVFCC-HOTGVXAUSA-N 0 0 398.463 3.255 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCn2cccc2[C@H]1c1ccccc1 ZINC000068218273 1409332744 /nfs/dbraw/zinc/33/27/44/1409332744.db2.gz FQZPQRDAIZTTGE-OAQYLSRUSA-N 0 0 376.416 3.440 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1 ZINC000068224708 1409334315 /nfs/dbraw/zinc/33/43/15/1409334315.db2.gz DUSSNDFJSLPWSK-CYBMUJFWSA-N 0 0 385.405 3.132 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1N1CCCCC1 ZINC000068233156 1409336304 /nfs/dbraw/zinc/33/63/04/1409336304.db2.gz PUAIZTAYGPRUAX-HNNXBMFYSA-N 0 0 396.447 3.342 20 5 GGBDRN COc1cccc(CN(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]2CCCO2)c1 ZINC000068254359 1409340453 /nfs/dbraw/zinc/34/04/53/1409340453.db2.gz ZIGLQDWJPNQUEI-GOSISDBHSA-N 0 0 399.447 3.223 20 5 GGBDRN COCc1ccccc1CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000176664617 1428396605 /nfs/dbraw/zinc/39/66/05/1428396605.db2.gz UVFYVODPEMYFES-UHFFFAOYSA-N 0 0 384.841 3.182 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1nc2ccccc2n1C ZINC000068265421 1409345426 /nfs/dbraw/zinc/34/54/26/1409345426.db2.gz BKDXSSHTVBXEMP-NSHDSACASA-N 0 0 388.811 3.219 20 5 GGBDRN CCOc1ncccc1CNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000068265856 1409345710 /nfs/dbraw/zinc/34/57/10/1409345710.db2.gz QMOJBMJWYRZDDD-NSHDSACASA-N 0 0 379.800 3.126 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H](c1ccco1)N(C)C ZINC000068265596 1409345821 /nfs/dbraw/zinc/34/58/21/1409345821.db2.gz QABILFYMVYUOFV-BXUZGUMPSA-N 0 0 381.816 3.028 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1Cc2ccccc2O1 ZINC000068265635 1409345900 /nfs/dbraw/zinc/34/59/00/1409345900.db2.gz ZRYGVEKBTGENMT-RISCZKNCSA-N 0 0 376.796 3.135 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(S(C)(=O)=O)cc1 ZINC000068265621 1409345934 /nfs/dbraw/zinc/34/59/34/1409345934.db2.gz XFOQFVATRGKSRP-SNVBAGLBSA-N 0 0 398.824 3.058 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000068266061 1409346181 /nfs/dbraw/zinc/34/61/81/1409346181.db2.gz UYZSSGGHHMFUJA-LLVKDONJSA-N 0 0 391.811 3.404 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000068266018 1409346278 /nfs/dbraw/zinc/34/62/78/1409346278.db2.gz PQASAOZEADGRRK-NSHDSACASA-N 0 0 391.811 3.290 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)CC(=O)Nc1ccccc1 ZINC000068265982 1409346289 /nfs/dbraw/zinc/34/62/89/1409346289.db2.gz VVCZWCHTAQHSAK-LBPRGKRZSA-N 0 0 391.811 3.113 20 5 GGBDRN CCN(Cc1cnn(C)c1)C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000068268464 1409346432 /nfs/dbraw/zinc/34/64/32/1409346432.db2.gz NICRIINTHJKWIL-HZPDHXFCSA-N 0 0 399.495 3.473 20 5 GGBDRN Cn1c2ccccc2nc1[C@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000068269409 1409346743 /nfs/dbraw/zinc/34/67/43/1409346743.db2.gz TULLASPRNCVIRL-GOSISDBHSA-N 0 0 379.420 3.257 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@H](C)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000068278787 1409350455 /nfs/dbraw/zinc/35/04/55/1409350455.db2.gz SPJZBXVHZVHEOA-CABCVRRESA-N 0 0 398.463 3.240 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CCCCC[C@@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC000068279121 1409350817 /nfs/dbraw/zinc/35/08/17/1409350817.db2.gz HFHOYMHMTUQHOP-QGZVFWFLSA-N 0 0 383.404 3.325 20 5 GGBDRN CC[C@H](C)NC(=O)[C@H](C)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000068278788 1409350852 /nfs/dbraw/zinc/35/08/52/1409350852.db2.gz SPJZBXVHZVHEOA-GJZGRUSLSA-N 0 0 398.463 3.240 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCN2c3ccccc3C[C@@H]2C)cc1OC ZINC000068293977 1409355102 /nfs/dbraw/zinc/35/51/02/1409355102.db2.gz XXBALXLHHQZXGM-AWEZNQCLSA-N 0 0 399.447 3.183 20 5 GGBDRN CCOc1cc(C(=O)NCCN2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000068293953 1409355228 /nfs/dbraw/zinc/35/52/28/1409355228.db2.gz PKXHBKAVPUETPN-AWEZNQCLSA-N 0 0 399.447 3.183 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000068295419 1409355767 /nfs/dbraw/zinc/35/57/67/1409355767.db2.gz ANMIWLIQIZNIHK-LLVKDONJSA-N 0 0 378.392 3.332 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000068310386 1409360737 /nfs/dbraw/zinc/36/07/37/1409360737.db2.gz RMSNPRSTTIALDU-CYBMUJFWSA-N 0 0 396.403 3.033 20 5 GGBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000068310389 1409360804 /nfs/dbraw/zinc/36/08/04/1409360804.db2.gz RMSNPRSTTIALDU-ZDUSSCGKSA-N 0 0 396.403 3.033 20 5 GGBDRN COCc1ccc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)cc1 ZINC000176667808 1428397889 /nfs/dbraw/zinc/39/78/89/1428397889.db2.gz HUVXGLDUPKSMRU-UHFFFAOYSA-N 0 0 384.841 3.182 20 5 GGBDRN Cc1c(C(=O)Nc2cc(C(C)(C)C)nn2-c2ncccn2)cccc1[N+](=O)[O-] ZINC000068315397 1409364138 /nfs/dbraw/zinc/36/41/38/1409364138.db2.gz KGZTXJMOTPZVRR-UHFFFAOYSA-N 0 0 380.408 3.429 20 5 GGBDRN COc1ccccc1NC(=O)c1ccc(I)c([N+](=O)[O-])c1 ZINC000068315754 1409364286 /nfs/dbraw/zinc/36/42/86/1409364286.db2.gz ASRYEWZVYUBJRU-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN CN(C(=O)c1ccc(I)c([N+](=O)[O-])c1)c1ccccc1 ZINC000068317441 1409364719 /nfs/dbraw/zinc/36/47/19/1409364719.db2.gz LJXQYFDESIOCDV-UHFFFAOYSA-N 0 0 382.157 3.476 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCCCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000068325741 1409367104 /nfs/dbraw/zinc/36/71/04/1409367104.db2.gz DHKGCRJQAFINDV-UHFFFAOYSA-N 0 0 376.796 3.189 20 5 GGBDRN CC(C)OCc1cccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000068331072 1409369291 /nfs/dbraw/zinc/36/92/91/1409369291.db2.gz IEIQRHKXZQNHOT-CQSZACIVSA-N 0 0 385.420 3.336 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC000068343017 1409373589 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KQXRPUMXFXUFKK-HNNXBMFYSA-N 0 0 376.457 3.025 20 5 GGBDRN Cc1cc(NC(=O)CCc2nnc(C(C)C)o2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000176732644 1428440394 /nfs/dbraw/zinc/44/03/94/1428440394.db2.gz DLVZQRHUPZZEJV-UHFFFAOYSA-N 0 0 384.396 3.167 20 5 GGBDRN C[C@@]1(c2ccc(F)cc2Cl)NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C1=O ZINC000078412362 1409915906 /nfs/dbraw/zinc/91/59/06/1409915906.db2.gz XJLCGRFLMAHMJD-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@]1(c2ccc(F)cc2Cl)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O ZINC000078412439 1409916229 /nfs/dbraw/zinc/91/62/29/1409916229.db2.gz ZBGCGOLDPXIXJA-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN COCCSc1ccc([C@@H](C)NC(=O)CCn2cc([N+](=O)[O-])nc2C)cc1 ZINC000078415477 1409917251 /nfs/dbraw/zinc/91/72/51/1409917251.db2.gz YZTXMQWSNUUQNX-CYBMUJFWSA-N 0 0 392.481 3.106 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2nc(C(C)(C)C)cs2)cc([N+](=O)[O-])c1 ZINC000078513762 1409922296 /nfs/dbraw/zinc/92/22/96/1409922296.db2.gz DWTDEOCWNBQTCQ-UHFFFAOYSA-N 0 0 377.422 3.065 20 5 GGBDRN O=C(NCCOc1ccc(F)c(F)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000078606953 1409929354 /nfs/dbraw/zinc/92/93/54/1409929354.db2.gz IYAVDPKPHJMRBZ-UHFFFAOYSA-N 0 0 377.347 3.256 20 5 GGBDRN COCCCOc1cccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000176736761 1428442249 /nfs/dbraw/zinc/44/22/49/1428442249.db2.gz NCTWXTDYJWQBQX-UHFFFAOYSA-N 0 0 396.403 3.448 20 5 GGBDRN CC(C)c1ccc(OCCNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000078777504 1409935905 /nfs/dbraw/zinc/93/59/05/1409935905.db2.gz DSSMPUOQBSIWQP-UHFFFAOYSA-N 0 0 395.415 3.369 20 5 GGBDRN Cn1c(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)nc2cc(F)ccc21 ZINC000078777849 1409936174 /nfs/dbraw/zinc/93/61/74/1409936174.db2.gz KTULHZQWUPNWAK-UHFFFAOYSA-N 0 0 399.426 3.172 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1[N+](=O)[O-] ZINC000176737218 1428442648 /nfs/dbraw/zinc/44/26/48/1428442648.db2.gz UQLIGEZUVOPCET-MRXNPFEDSA-N 0 0 387.367 3.412 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N(C)C[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-] ZINC000176746619 1428446660 /nfs/dbraw/zinc/44/66/60/1428446660.db2.gz APUOOJDDEHHCNW-GDBMZVCRSA-N 0 0 385.420 3.446 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)c1[N+](=O)[O-] ZINC000079055850 1409953139 /nfs/dbraw/zinc/95/31/39/1409953139.db2.gz SIIXCUCXTBFBCP-AWEZNQCLSA-N 0 0 391.786 3.231 20 5 GGBDRN CC(C)[C@@](C)(CNC(=O)OC(C)(C)C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000079308615 1409967480 /nfs/dbraw/zinc/96/74/80/1409967480.db2.gz YUMQUSSGJRDEFL-LJQANCHMSA-N 0 0 379.457 3.193 20 5 GGBDRN CC(C)[C@](C)(CNC(=O)OC(C)(C)C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000079308616 1409967859 /nfs/dbraw/zinc/96/78/59/1409967859.db2.gz YUMQUSSGJRDEFL-IBGZPJMESA-N 0 0 379.457 3.193 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000079630627 1409984242 /nfs/dbraw/zinc/98/42/42/1409984242.db2.gz VYQXDFPODRQDFL-AWEZNQCLSA-N 0 0 375.469 3.231 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000079630630 1409984781 /nfs/dbraw/zinc/98/47/81/1409984781.db2.gz VYQXDFPODRQDFL-CQSZACIVSA-N 0 0 375.469 3.231 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@H](C)c3nc[nH]n3)cc2[N+](=O)[O-])n1 ZINC000176744685 1428445849 /nfs/dbraw/zinc/44/58/49/1428445849.db2.gz ATSMNGITDUGJDL-SECBINFHSA-N 0 0 390.450 3.120 20 5 GGBDRN CCCCC[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)OC ZINC000176746736 1428446583 /nfs/dbraw/zinc/44/65/83/1428446583.db2.gz FWUHVCVFGFJNAX-GFCCVEGCSA-N 0 0 387.230 3.209 20 5 GGBDRN CC[C@H](C)C[C@@H](C)NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000080685626 1410010497 /nfs/dbraw/zinc/01/04/97/1410010497.db2.gz INZYHDVSPABORH-JOQOYGCGSA-N 0 0 375.469 3.449 20 5 GGBDRN CCC[C@@H](CCO)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000081801034 1410024833 /nfs/dbraw/zinc/02/48/33/1410024833.db2.gz RZMRXPWIQXVNGE-INIZCTEOSA-N 0 0 377.485 3.360 20 5 GGBDRN CCN(CC(C)(C)O)C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000081972627 1410025328 /nfs/dbraw/zinc/02/53/28/1410025328.db2.gz JSBHYRXHRQDGRL-GJZGRUSLSA-N 0 0 377.485 3.310 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000087222688 1410046993 /nfs/dbraw/zinc/04/69/93/1410046993.db2.gz WAJQEFHGGFERGL-DOTOQJQBSA-N 0 0 375.469 3.071 20 5 GGBDRN CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)CCO1 ZINC000089468784 1410054715 /nfs/dbraw/zinc/05/47/15/1410054715.db2.gz ABTALJVYLDANNK-KRWDZBQOSA-N 0 0 375.469 3.472 20 5 GGBDRN CC[C@H](Oc1ccccc1C)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000176761460 1428451953 /nfs/dbraw/zinc/45/19/53/1428451953.db2.gz ITNVBUYZSGELPV-WBVHZDCISA-N 0 0 384.436 3.169 20 5 GGBDRN COc1cc(CN2CCC[C@@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000091772527 1410079997 /nfs/dbraw/zinc/07/99/97/1410079997.db2.gz MPVCYWPGEXEPKH-GFCCVEGCSA-N 0 0 378.347 3.155 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000176766089 1428454079 /nfs/dbraw/zinc/45/40/79/1428454079.db2.gz LSZJCCNYEGBXGU-HNNXBMFYSA-N 0 0 388.811 3.484 20 5 GGBDRN Cn1cc(C(=O)NCC(C)(C)c2ccncc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091859071 1410086766 /nfs/dbraw/zinc/08/67/66/1410086766.db2.gz DIACARKPUFZYPQ-UHFFFAOYSA-N 0 0 379.420 3.098 20 5 GGBDRN NC(=O)c1ccc(CN2CCC(OCc3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC000091868969 1410087978 /nfs/dbraw/zinc/08/79/78/1410087978.db2.gz KKRRUKLPRZRYEB-UHFFFAOYSA-N 0 0 387.411 3.014 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000176768894 1428454872 /nfs/dbraw/zinc/45/48/72/1428454872.db2.gz BSPNUUHUPKZSHV-UHFFFAOYSA-N 0 0 381.404 3.172 20 5 GGBDRN C[C@H]1C[C@@H]1c1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)o1 ZINC000091978340 1410095736 /nfs/dbraw/zinc/09/57/36/1410095736.db2.gz CMGACOPVEJNDMW-JSGCOSHPSA-N 0 0 375.450 3.331 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)c1[N+](=O)[O-] ZINC000176780935 1428458044 /nfs/dbraw/zinc/45/80/44/1428458044.db2.gz BBDOFNZLZYJDJS-UHFFFAOYSA-N 0 0 391.443 3.153 20 5 GGBDRN Cc1cc(C(=O)N2CCC(OCc3ccccc3F)CC2)c(N)c([N+](=O)[O-])c1 ZINC000092053299 1410102161 /nfs/dbraw/zinc/10/21/61/1410102161.db2.gz IOIUBXKTEMRLSM-UHFFFAOYSA-N 0 0 387.411 3.446 20 5 GGBDRN O=C(CC1CCN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1)N1CCCC1 ZINC000092057202 1410103094 /nfs/dbraw/zinc/10/30/94/1410103094.db2.gz OXTUNVQKGJZNOV-UHFFFAOYSA-N 0 0 397.422 3.421 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC(OCc3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000092054626 1410103122 /nfs/dbraw/zinc/10/31/22/1410103122.db2.gz VUQVXMIFJYEUED-UHFFFAOYSA-N 0 0 390.415 3.231 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC(OCc2ccccc2F)CC1 ZINC000092058371 1410103740 /nfs/dbraw/zinc/10/37/40/1410103740.db2.gz QINFACCAOTWTHA-UHFFFAOYSA-N 0 0 388.395 3.321 20 5 GGBDRN Cn1cc(C(=O)N2CCc3cc(F)ccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092096714 1410108053 /nfs/dbraw/zinc/10/80/53/1410108053.db2.gz VBPPJIRDYZVVKM-UHFFFAOYSA-N 0 0 380.379 3.333 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCO[C@@H](c2ccco2)C1 ZINC000176782801 1428458811 /nfs/dbraw/zinc/45/88/11/1428458811.db2.gz UHNQGTJCOPCMAT-LJQANCHMSA-N 0 0 385.420 3.392 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cn(C)nc2-c2cccs2)cc([N+](=O)[O-])c1 ZINC000092353873 1410141544 /nfs/dbraw/zinc/14/15/44/1410141544.db2.gz OFSZGERSIBGATB-UHFFFAOYSA-N 0 0 386.389 3.096 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cnn(CC(C)C)c2C2CC2)cc([N+](=O)[O-])c1 ZINC000092353870 1410141790 /nfs/dbraw/zinc/14/17/90/1410141790.db2.gz TWVIIPKJJYWJRX-UHFFFAOYSA-N 0 0 386.408 3.364 20 5 GGBDRN C[C@@H](N(C)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-])C1(C)CC1 ZINC000176782219 1428458949 /nfs/dbraw/zinc/45/89/49/1428458949.db2.gz BXYGHGHAXPWHLK-SECBINFHSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000176782695 1428459147 /nfs/dbraw/zinc/45/91/47/1428459147.db2.gz FZNRASQUYCBBIX-UHFFFAOYSA-N 0 0 381.404 3.125 20 5 GGBDRN Nc1c(C(=O)N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000176783691 1428459758 /nfs/dbraw/zinc/45/97/58/1428459758.db2.gz NPEICPASGLQMRD-GOSISDBHSA-N 0 0 389.839 3.416 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000176783791 1428459768 /nfs/dbraw/zinc/45/97/68/1428459768.db2.gz CPODCUNYNYYATJ-UHFFFAOYSA-N 0 0 387.411 3.169 20 5 GGBDRN COc1ccccc1N1CC[C@H](CNC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])C1 ZINC000176794510 1428463280 /nfs/dbraw/zinc/46/32/80/1428463280.db2.gz OLCVZCNHHJUMEC-CQSZACIVSA-N 0 0 387.411 3.307 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cnc(-c2ccccc2)s1 ZINC000092505288 1410162823 /nfs/dbraw/zinc/16/28/23/1410162823.db2.gz BAOFHSOUPUXALQ-LBPRGKRZSA-N 0 0 396.428 3.475 20 5 GGBDRN CCc1nc(CN2CCN(C(=O)c3cc(F)cc(C)c3[N+](=O)[O-])CC2)cs1 ZINC000176787101 1428461135 /nfs/dbraw/zinc/46/11/35/1428461135.db2.gz SQUKRAOCNHGRAH-UHFFFAOYSA-N 0 0 392.456 3.019 20 5 GGBDRN O=C(C1CCCCC1)N1CCN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000092539845 1410171958 /nfs/dbraw/zinc/17/19/58/1410171958.db2.gz OJGATFCXMNZZKL-UHFFFAOYSA-N 0 0 397.422 3.421 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1 ZINC000176788609 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Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000097576194 1410380082 /nfs/dbraw/zinc/38/00/82/1410380082.db2.gz UWMCIWOWCWZUOT-SFHVURJKSA-N 0 0 389.477 3.495 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000097575299 1410380150 /nfs/dbraw/zinc/38/01/50/1410380150.db2.gz VFFOUBPTOCZBDT-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@H](CO)Cc1c[nH]c2ccccc12 ZINC000097577407 1410380733 /nfs/dbraw/zinc/38/07/33/1410380733.db2.gz YEFVLHNQZMWTNV-ZDUSSCGKSA-N 0 0 388.811 3.455 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000097657437 1410386440 /nfs/dbraw/zinc/38/64/40/1410386440.db2.gz AKVJEDUAOOHEON-KUHUBIRLSA-N 0 0 397.431 3.085 20 5 GGBDRN CCN(CCC(=O)OC)C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000097694687 1410388633 /nfs/dbraw/zinc/38/86/33/1410388633.db2.gz DMXFOPBPOFNRAQ-GJZGRUSLSA-N 0 0 391.468 3.102 20 5 GGBDRN CC(C)C(=O)N1CCC(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)CC1 ZINC000097712484 1410390778 /nfs/dbraw/zinc/39/07/78/1410390778.db2.gz KLHOMMCGFVCXGN-UHFFFAOYSA-N 0 0 375.469 3.226 20 5 GGBDRN CNC(=O)c1cc(Cl)ccc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000098040980 1410400705 /nfs/dbraw/zinc/40/07/05/1410400705.db2.gz OPBUHFTVGSOXPE-UHFFFAOYSA-N 0 0 387.783 3.270 20 5 GGBDRN Cc1ccc(CNC(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000098041112 1410400812 /nfs/dbraw/zinc/40/08/12/1410400812.db2.gz ITZUIILHOUXWHA-UHFFFAOYSA-N 0 0 383.326 3.372 20 5 GGBDRN COC(=O)c1cc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(F)cc1F ZINC000098040680 1410400831 /nfs/dbraw/zinc/40/08/31/1410400831.db2.gz BOLCUAXNULLHSB-UHFFFAOYSA-N 0 0 390.302 3.322 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(CCO)Cc2ccccc2)CC1 ZINC000098077101 1410407659 /nfs/dbraw/zinc/40/76/59/1410407659.db2.gz WCUAFQGMNHHVGM-UHFFFAOYSA-N 0 0 397.475 3.466 20 5 GGBDRN Cc1nn(C)c(C(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000098097596 1410413843 /nfs/dbraw/zinc/41/38/43/1410413843.db2.gz BFRPSINLYLHLNV-SFHVURJKSA-N 0 0 376.416 3.425 20 5 GGBDRN Cc1sc(=O)n(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1C ZINC000098097336 1410414019 /nfs/dbraw/zinc/41/40/19/1410414019.db2.gz SXQXMUQEOVMQCG-UHFFFAOYSA-N 0 0 390.446 3.197 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H](COc2ccccc2F)c2ccccc2)c1[N+](=O)[O-] ZINC000098099091 1410414565 /nfs/dbraw/zinc/41/45/65/1410414565.db2.gz NDYVALVQPVVSBT-INIZCTEOSA-N 0 0 398.394 3.326 20 5 GGBDRN Cc1nccn1-c1ncccc1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000098099272 1410414780 /nfs/dbraw/zinc/41/47/80/1410414780.db2.gz JFIAFHCZPDXJMR-UHFFFAOYSA-N 0 0 380.408 3.315 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2cccc(OCc3ccccc3)c2)c1[N+](=O)[O-] ZINC000098098819 1410414921 /nfs/dbraw/zinc/41/49/21/1410414921.db2.gz MJLROGDHRIQYHU-UHFFFAOYSA-N 0 0 380.404 3.146 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ncc(Cc3ccccc3F)s2)c1[N+](=O)[O-] ZINC000098100195 1410415182 /nfs/dbraw/zinc/41/51/82/1410415182.db2.gz UVIJMXUIOHVNBI-UHFFFAOYSA-N 0 0 375.385 3.075 20 5 GGBDRN Cc1nn(C)c(C(=O)NCCSCc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000098102380 1410416784 /nfs/dbraw/zinc/41/67/84/1410416784.db2.gz PXDFGZFNVVFDDH-UHFFFAOYSA-N 0 0 384.461 3.453 20 5 GGBDRN Cc1nn(C)c(C(=O)NC2CCN(c3ccc(C(C)(C)C)cc3)CC2)c1[N+](=O)[O-] ZINC000098102377 1410416823 /nfs/dbraw/zinc/41/68/23/1410416823.db2.gz VRDKWGWJEQGBPY-UHFFFAOYSA-N 0 0 399.495 3.333 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(C(C)(C)C)nn2Cc2ccccc2)c1[N+](=O)[O-] ZINC000098102629 1410416959 /nfs/dbraw/zinc/41/69/59/1410416959.db2.gz BZMJSWOUOXZIHS-UHFFFAOYSA-N 0 0 396.451 3.431 20 5 GGBDRN COc1ccc([C@@H](NC(=O)c2c([N+](=O)[O-])c(C)nn2C)c2ccc(F)cc2)cc1 ZINC000098102875 1410418373 /nfs/dbraw/zinc/41/83/73/1410418373.db2.gz KQLBDFFGTBWTME-KRWDZBQOSA-N 0 0 398.394 3.304 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176820244 1428482447 /nfs/dbraw/zinc/48/24/47/1428482447.db2.gz WNQTVXSGYFMOQL-INIZCTEOSA-N 0 0 381.432 3.185 20 5 GGBDRN COc1ccc(F)cc1-c1csc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)n1 ZINC000098104772 1410419126 /nfs/dbraw/zinc/41/91/26/1410419126.db2.gz VXCPDJDXUKPKIV-UHFFFAOYSA-N 0 0 391.384 3.160 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N(Cc2ccco2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000098107114 1410421008 /nfs/dbraw/zinc/42/10/08/1410421008.db2.gz MTUHNSHVACQYPL-HNNXBMFYSA-N 0 0 389.364 3.226 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000098108259 1410421939 /nfs/dbraw/zinc/42/19/39/1410421939.db2.gz NPAOOTARXWTRFO-SFHVURJKSA-N 0 0 396.403 3.195 20 5 GGBDRN CN(c1ccccc1)C1CCN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000176819769 1428482636 /nfs/dbraw/zinc/48/26/36/1428482636.db2.gz VWBMWFARLUDGDV-UHFFFAOYSA-N 0 0 392.463 3.412 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176820229 1428482641 /nfs/dbraw/zinc/48/26/41/1428482641.db2.gz WNQTVXSGYFMOQL-MRXNPFEDSA-N 0 0 381.432 3.185 20 5 GGBDRN CC(=O)N1CCN(c2ccc(C(=O)Oc3cc(C)ccc3C)cc2[N+](=O)[O-])CC1 ZINC000098142704 1410431758 /nfs/dbraw/zinc/43/17/58/1410431758.db2.gz QWWYBCJQAIIYFB-UHFFFAOYSA-N 0 0 397.431 3.099 20 5 GGBDRN CC(=O)N1CCN(c2ccc(C(=O)Oc3cc(C)cc(C)c3)cc2[N+](=O)[O-])CC1 ZINC000098142734 1410432227 /nfs/dbraw/zinc/43/22/27/1410432227.db2.gz FXXHBUARCLQSTA-UHFFFAOYSA-N 0 0 397.431 3.099 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1 ZINC000176820995 1428483709 /nfs/dbraw/zinc/48/37/09/1428483709.db2.gz MFACEYNTINGOKN-LBPRGKRZSA-N 0 0 382.376 3.068 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(C(=O)Oc2ccccc2)CC1 ZINC000101532341 1410450653 /nfs/dbraw/zinc/45/06/53/1410450653.db2.gz HEAWVQSYLMWTQT-UHFFFAOYSA-N 0 0 383.404 3.250 20 5 GGBDRN Cc1c(C(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000101532807 1410451492 /nfs/dbraw/zinc/45/14/92/1410451492.db2.gz KHPBWWQGHCPVOP-UHFFFAOYSA-N 0 0 383.404 3.250 20 5 GGBDRN CC(C)COC[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000101539881 1410455481 /nfs/dbraw/zinc/45/54/81/1410455481.db2.gz IQFPUOBZJFTPDN-OAHLLOKOSA-N 0 0 382.438 3.417 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1noc(Cc2ccccc2)n1 ZINC000176822785 1428485744 /nfs/dbraw/zinc/48/57/44/1428485744.db2.gz QZILOOMZBHXZSU-AWEZNQCLSA-N 0 0 396.403 3.215 20 5 GGBDRN CN(CCOc1ccc(F)cc1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000101569658 1410469379 /nfs/dbraw/zinc/46/93/79/1410469379.db2.gz DJIMMELSCPOTJJ-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC(OC3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000101575912 1410470559 /nfs/dbraw/zinc/47/05/59/1410470559.db2.gz XHBXIGBRFXMEHB-UHFFFAOYSA-N 0 0 382.482 3.406 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](COCC(C)C)c1ccco1 ZINC000101576925 1410471002 /nfs/dbraw/zinc/47/10/02/1410471002.db2.gz KGQQMFYYPXZMAY-OAHLLOKOSA-N 0 0 382.438 3.188 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](COCC(C)C)c2ccco2)c([N+](=O)[O-])c1 ZINC000101576853 1410471088 /nfs/dbraw/zinc/47/10/88/1410471088.db2.gz ULHJERXNNIFPNQ-AWEZNQCLSA-N 0 0 382.438 3.188 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OS(=O)(=O)c1ccccc1C(F)(F)F ZINC000101579178 1410471686 /nfs/dbraw/zinc/47/16/86/1410471686.db2.gz RIUQOAGTNFMHEN-UHFFFAOYSA-N 0 0 377.296 3.390 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OS(=O)(=O)c1ccc(C(F)(F)F)cc1 ZINC000101579166 1410471731 /nfs/dbraw/zinc/47/17/31/1410471731.db2.gz SMSQVWHMEAOBCZ-UHFFFAOYSA-N 0 0 377.296 3.390 20 5 GGBDRN C[C@@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1noc(Cc2ccccc2)n1 ZINC000176825823 1428487188 /nfs/dbraw/zinc/48/71/88/1428487188.db2.gz ZNWJCFKFRGKNTH-SNVBAGLBSA-N 0 0 388.330 3.338 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000101602343 1410475215 /nfs/dbraw/zinc/47/52/15/1410475215.db2.gz LZEMSASXOZMSMW-AWEZNQCLSA-N 0 0 397.435 3.344 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)CCNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000101607254 1410477597 /nfs/dbraw/zinc/47/75/97/1410477597.db2.gz SMCHZLFQPGWFKP-UHFFFAOYSA-N 0 0 390.827 3.385 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](CCO)c2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000176825852 1428487560 /nfs/dbraw/zinc/48/75/60/1428487560.db2.gz GKTUDBGQXLCCDJ-OAHLLOKOSA-N 0 0 387.392 3.016 20 5 GGBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(n2ccnc2)CC1 ZINC000101861693 1410510213 /nfs/dbraw/zinc/51/02/13/1410510213.db2.gz IEMZPCAPKURBCH-UHFFFAOYSA-N 0 0 383.433 3.392 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC(n2ccnc2)CC1 ZINC000101866399 1410511532 /nfs/dbraw/zinc/51/15/32/1410511532.db2.gz QZZLAFZSAOHMGO-GFCCVEGCSA-N 0 0 378.816 3.076 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000101898342 1410514535 /nfs/dbraw/zinc/51/45/35/1410514535.db2.gz NTEKVWZSEGMMAH-OAHLLOKOSA-N 0 0 386.383 3.079 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000101904549 1410516577 /nfs/dbraw/zinc/51/65/77/1410516577.db2.gz IQKVRYXOWAKHMZ-CYBMUJFWSA-N 0 0 392.481 3.314 20 5 GGBDRN CC(C)C(=O)NC[C@@H]1CCCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000101904545 1410516907 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Cc1ccccc1[C@@H](O)CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000112397075 1412140197 /nfs/dbraw/zinc/14/01/97/1412140197.db2.gz RMJKRXOZNBLXBG-INIZCTEOSA-N 0 0 398.337 3.308 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)Cc1nc2ccccc2n1C ZINC000177199072 1428627248 /nfs/dbraw/zinc/62/72/48/1428627248.db2.gz FXDPFOAWBNVFMG-UHFFFAOYSA-N 0 0 381.436 3.251 20 5 GGBDRN CCc1cc(N2CCC[C@@H](NC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)ncn1 ZINC000112507953 1412159486 /nfs/dbraw/zinc/15/94/86/1412159486.db2.gz OKRKZGIWSHRDKJ-OAHLLOKOSA-N 0 0 384.440 3.046 20 5 GGBDRN CCCC(=O)Nc1ccc(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000112521925 1412161904 /nfs/dbraw/zinc/16/19/04/1412161904.db2.gz XFZBGNKXPLGTBQ-UHFFFAOYSA-N 0 0 393.403 3.475 20 5 GGBDRN CC(C)[C@H](c1ccccc1)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000112586410 1412172590 /nfs/dbraw/zinc/17/25/90/1412172590.db2.gz XGSQRESUHXDNHC-LJQANCHMSA-N 0 0 383.404 3.358 20 5 GGBDRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000112587810 1412173727 /nfs/dbraw/zinc/17/37/27/1412173727.db2.gz ZYUPMQQXYKLSLL-SFHVURJKSA-N 0 0 390.461 3.468 20 5 GGBDRN Cc1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)ccc1N1C(=O)CCC1=O ZINC000112591317 1412174098 /nfs/dbraw/zinc/17/40/98/1412174098.db2.gz XLMTXCKDLFRPHA-RUDMXATFSA-N 0 0 379.372 3.209 20 5 GGBDRN CCN1C(=S)N=NC1[C@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000112596414 1412176403 /nfs/dbraw/zinc/17/64/03/1412176403.db2.gz QMOWXESDORDMRZ-JTQLQIEISA-N 0 0 395.872 3.168 20 5 GGBDRN CCOc1ccc(OCCNC(=O)Cn2ccc3c2cccc3[N+](=O)[O-])cc1 ZINC000112653470 1412186887 /nfs/dbraw/zinc/18/68/87/1412186887.db2.gz RHYSWTDOTAGFSO-UHFFFAOYSA-N 0 0 383.404 3.143 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(CCO)CCc1ccccc1 ZINC000112726138 1412203906 /nfs/dbraw/zinc/20/39/06/1412203906.db2.gz IORAUCRPBKBIII-CQSZACIVSA-N 0 0 392.839 3.079 20 5 GGBDRN Cc1ccc(NC(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000112732677 1412205322 /nfs/dbraw/zinc/20/53/22/1412205322.db2.gz UXDIHDLDRIOJIK-CQSZACIVSA-N 0 0 376.457 3.309 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nccn1Cc1ccccn1 ZINC000112771822 1412214770 /nfs/dbraw/zinc/21/47/70/1412214770.db2.gz QDYOBNLRIBHXEL-UHFFFAOYSA-N 0 0 383.433 3.274 20 5 GGBDRN C[C@@H](Sc1nccn1Cc1ccccn1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000112771641 1412214866 /nfs/dbraw/zinc/21/48/66/1412214866.db2.gz NLGAJWYVLLTWLA-CYBMUJFWSA-N 0 0 383.433 3.354 20 5 GGBDRN O=C([C@H]1C[C@H]1c1ccc(F)cc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000112777341 1412216043 /nfs/dbraw/zinc/21/60/43/1412216043.db2.gz ONRIIJIWXSQOPW-HOTGVXAUSA-N 0 0 387.386 3.325 20 5 GGBDRN O=C(NC[C@@H]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)c1ccccc1 ZINC000177210287 1428633527 /nfs/dbraw/zinc/63/35/27/1428633527.db2.gz MEJANVUOFAWZLI-HNNXBMFYSA-N 0 0 394.431 3.378 20 5 GGBDRN COC(=O)CCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000112825738 1412222297 /nfs/dbraw/zinc/22/22/97/1412222297.db2.gz IKLZRPPTCBYBLM-UHFFFAOYSA-N 0 0 377.422 3.132 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@@H]2CC[C@H](C)C[C@@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000112838952 1412223217 /nfs/dbraw/zinc/22/32/17/1412223217.db2.gz WDVWNNCYXIJZDW-KCQAQPDRSA-N 0 0 384.436 3.004 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@H](C)N1C(=O)OC(C)(C)C ZINC000112842914 1412224291 /nfs/dbraw/zinc/22/42/91/1412224291.db2.gz CRXNVORRTCVYAJ-TXEJJXNPSA-N 0 0 381.404 3.204 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)NCCCc1ccccc1 ZINC000112879454 1412229922 /nfs/dbraw/zinc/22/99/22/1412229922.db2.gz XWQBVRODMXMXIH-UHFFFAOYSA-N 0 0 383.448 3.081 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N(Cc1ccncc1)Cc1cccnc1 ZINC000112902764 1412234171 /nfs/dbraw/zinc/23/41/71/1412234171.db2.gz MMMTWHIJOHCGIF-UHFFFAOYSA-N 0 0 392.415 3.383 20 5 GGBDRN COC[C@@H]1CCCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000112942993 1412245110 /nfs/dbraw/zinc/24/51/10/1412245110.db2.gz LURNCHVNMMATHO-LLVKDONJSA-N 0 0 376.331 3.035 20 5 GGBDRN COC[C@H]1CCCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000112939924 1412245145 /nfs/dbraw/zinc/24/51/45/1412245145.db2.gz QJWPGNGMVRDOFB-CVEARBPZSA-N 0 0 375.469 3.330 20 5 GGBDRN COC[C@@H]1CCCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000112943364 1412245158 /nfs/dbraw/zinc/24/51/58/1412245158.db2.gz QEMOFJDKCXLRMJ-MRXNPFEDSA-N 0 0 375.469 3.330 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCCOc1cccc2cccnc21 ZINC000112967176 1412247556 /nfs/dbraw/zinc/24/75/56/1412247556.db2.gz XWAGKCJPVZFRQP-UHFFFAOYSA-N 0 0 380.404 3.384 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(Sc3nccn3Cc3ccccn3)cc2N1 ZINC000112967586 1412248077 /nfs/dbraw/zinc/24/80/77/1412248077.db2.gz NHDQNYCIOUFRDY-UHFFFAOYSA-N 0 0 381.417 3.271 20 5 GGBDRN O=C(Cn1c(=O)sc2c1CCCCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000112973372 1412248676 /nfs/dbraw/zinc/24/86/76/1412248676.db2.gz TYCMHHWFVLRXMG-UHFFFAOYSA-N 0 0 381.841 3.379 20 5 GGBDRN COc1ccc(NC(=O)CN2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1 ZINC000112985017 1412250606 /nfs/dbraw/zinc/25/06/06/1412250606.db2.gz YPHVHSRPYNYHQM-HNNXBMFYSA-N 0 0 385.420 3.085 20 5 GGBDRN CN(C)c1ncc(Br)cc1C(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000113015954 1412255591 /nfs/dbraw/zinc/25/55/91/1412255591.db2.gz AOHNNGLUDBBLLA-UHFFFAOYSA-N 0 0 383.177 3.210 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(Oc3ccc(Cl)nn3)cc2)c1[N+](=O)[O-] ZINC000113125358 1412266330 /nfs/dbraw/zinc/26/63/30/1412266330.db2.gz WMUBGCDWRHPKBB-UHFFFAOYSA-N 0 0 388.771 3.125 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000113191056 1412272322 /nfs/dbraw/zinc/27/23/22/1412272322.db2.gz DDHQDQOTQNCVSK-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN NC(=O)c1ccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1N1CCCCC1 ZINC000113191265 1412273054 /nfs/dbraw/zinc/27/30/54/1412273054.db2.gz FVAGVYBJKCAGPE-UHFFFAOYSA-N 0 0 386.383 3.075 20 5 GGBDRN Cc1ccc(C[C@@H]2CCCN2C(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000113210237 1412275777 /nfs/dbraw/zinc/27/57/77/1412275777.db2.gz WOFIHRXDELRKGC-APWZRJJASA-N 0 0 395.459 3.255 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@@](C)(c2ccccc2)C1 ZINC000113216076 1412277737 /nfs/dbraw/zinc/27/77/37/1412277737.db2.gz TYMVASPUCAPZAZ-KSFYIVLOSA-N 0 0 395.459 3.293 20 5 GGBDRN O=C(CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])OCc1ccccc1Cl ZINC000113221865 1412278728 /nfs/dbraw/zinc/27/87/28/1412278728.db2.gz WDALRYCXDYWUCD-UHFFFAOYSA-N 0 0 383.187 3.375 20 5 GGBDRN O=C(CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])OCc1ccccc1Cl ZINC000113220973 1412278860 /nfs/dbraw/zinc/27/88/60/1412278860.db2.gz SITVEWMNLZMWLP-UHFFFAOYSA-N 0 0 383.187 3.375 20 5 GGBDRN O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC(O)CC1 ZINC000113263787 1412285281 /nfs/dbraw/zinc/28/52/81/1412285281.db2.gz QSFOLIFMQLRPSC-UHFFFAOYSA-N 0 0 389.839 3.457 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)Cc2ccccc2C(F)(F)F)cc1 ZINC000113281918 1412287892 /nfs/dbraw/zinc/28/78/92/1412287892.db2.gz YJMBSUYAGVVIMQ-UHFFFAOYSA-N 0 0 388.367 3.276 20 5 GGBDRN COc1cc2[nH]c(CCCNC(=O)c3cccc([N+](=O)[O-])c3N)cc2c(OC)c1 ZINC000177229410 1428642406 /nfs/dbraw/zinc/64/24/06/1428642406.db2.gz BQNJTRFPRWCFKP-UHFFFAOYSA-N 0 0 398.419 3.038 20 5 GGBDRN COc1cc2[nH]c(CCCNC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2c(OC)c1 ZINC000177230080 1428642414 /nfs/dbraw/zinc/64/24/14/1428642414.db2.gz CMPUFOBUDJBLOA-UHFFFAOYSA-N 0 0 397.431 3.385 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)CCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000113649115 1412329924 /nfs/dbraw/zinc/32/99/24/1412329924.db2.gz DDGJJXKSNVDDIB-UHFFFAOYSA-N 0 0 375.812 3.196 20 5 GGBDRN C[C@@H]1CCCC[C@H]1OCC(=O)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000113657792 1412331364 /nfs/dbraw/zinc/33/13/64/1412331364.db2.gz ITZNGGORZLWQEL-CRAIPNDOSA-N 0 0 391.468 3.345 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1OCC(=O)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000113659630 1412332022 /nfs/dbraw/zinc/33/20/22/1412332022.db2.gz HWQVOUNYQQLFLK-QAPCUYQASA-N 0 0 391.468 3.345 20 5 GGBDRN Cc1c(-c2nc(CCc3ccccc3)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000113745642 1412339757 /nfs/dbraw/zinc/33/97/57/1412339757.db2.gz KMGSDMKJPPYSHH-UHFFFAOYSA-N 0 0 376.376 3.319 20 5 GGBDRN O=C(Cc1noc(-c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1)NC1CCCC1 ZINC000113763385 1412341303 /nfs/dbraw/zinc/34/13/03/1412341303.db2.gz NPEYCFUZEUAUCC-UHFFFAOYSA-N 0 0 399.432 3.370 20 5 GGBDRN CCOc1cccc(CNC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000113775276 1412342274 /nfs/dbraw/zinc/34/22/74/1412342274.db2.gz XNSBDVFJBDVXDS-UHFFFAOYSA-N 0 0 380.404 3.173 20 5 GGBDRN O=C(Nc1ccc2c(c1)CC(=O)N2)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000113904558 1412349229 /nfs/dbraw/zinc/34/92/29/1412349229.db2.gz SZOWVPZAGCXAGD-UHFFFAOYSA-N 0 0 380.385 3.465 20 5 GGBDRN O=C(Nc1ccc2c(c1)CC(=O)N2)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000113903860 1412349269 /nfs/dbraw/zinc/34/92/69/1412349269.db2.gz JUNXGVYFNLJBPZ-UHFFFAOYSA-N 0 0 380.404 3.332 20 5 GGBDRN O=C(Nc1ccc2c(c1)CC(=O)N2)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113904817 1412349396 /nfs/dbraw/zinc/34/93/96/1412349396.db2.gz IKLMVLIYEKAJNP-UHFFFAOYSA-N 0 0 380.385 3.465 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC1(c2ccccc2)CCCC1 ZINC000113914791 1412351322 /nfs/dbraw/zinc/35/13/22/1412351322.db2.gz IYCVVYKELHTECZ-OAHLLOKOSA-N 0 0 381.432 3.299 20 5 GGBDRN NC(=O)c1ccc(CNc2ccc(F)cc2OCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000113927753 1412353588 /nfs/dbraw/zinc/35/35/88/1412353588.db2.gz ULAGLMDCUHKANW-UHFFFAOYSA-N 0 0 387.289 3.386 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N(CCc1cccc(F)c1)C1CC1 ZINC000113947550 1412358070 /nfs/dbraw/zinc/35/80/70/1412358070.db2.gz UCPXXVZPDOJJMG-UHFFFAOYSA-N 0 0 382.388 3.269 20 5 GGBDRN COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NCc1ccccc1[N+](=O)[O-] ZINC000177246635 1428649170 /nfs/dbraw/zinc/64/91/70/1428649170.db2.gz GTIJPTULKMKIFU-UHFFFAOYSA-N 0 0 393.465 3.292 20 5 GGBDRN O=C(NCCCO[C@H]1CCCc2ccccc21)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000114044257 1412375213 /nfs/dbraw/zinc/37/52/13/1412375213.db2.gz MWLSGYPWDXMSBA-IBGZPJMESA-N 0 0 397.431 3.134 20 5 GGBDRN COc1cc(C)sc1C(=O)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000114050400 1412377406 /nfs/dbraw/zinc/37/74/06/1412377406.db2.gz QGSFFNLNPHTITC-UHFFFAOYSA-N 0 0 391.449 3.442 20 5 GGBDRN Cc1ccc([N-]S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])c(C[NH+](C)C)c1 ZINC000114054140 1412377826 /nfs/dbraw/zinc/37/78/26/1412377826.db2.gz ZXIYYQBMZQWPGI-UHFFFAOYSA-N 0 0 377.466 3.382 20 5 GGBDRN O=C(c1nc(N2CCCC2)ncc1Cl)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000114101094 1412379625 /nfs/dbraw/zinc/37/96/25/1412379625.db2.gz RXRIFMAZHPLDJM-UHFFFAOYSA-N 0 0 387.827 3.231 20 5 GGBDRN O=C(COc1cccc(NC(=O)C2CC2)c1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000114101782 1412379819 /nfs/dbraw/zinc/37/98/19/1412379819.db2.gz PKTOUHKCVAHCBB-UHFFFAOYSA-N 0 0 395.415 3.302 20 5 GGBDRN O=C(CN(CCO)[C@H]1CCc2ccccc21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114192619 1412391712 /nfs/dbraw/zinc/39/17/12/1412391712.db2.gz KDOJDGZBMMRUOA-KRWDZBQOSA-N 0 0 389.839 3.169 20 5 GGBDRN O=[N+]([O-])c1ccccc1N1CCN(CCc2nc(-c3ccccc3)no2)CC1 ZINC000114205448 1412394215 /nfs/dbraw/zinc/39/42/15/1412394215.db2.gz CHLKRYBWKMTRGF-UHFFFAOYSA-N 0 0 379.420 3.010 20 5 GGBDRN CC(C)[C@@H](C)N(CC(F)(F)F)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000114267954 1412398671 /nfs/dbraw/zinc/39/86/71/1412398671.db2.gz HJEIIMCXINDZTL-LLVKDONJSA-N 0 0 385.346 3.225 20 5 GGBDRN COc1cc(OCC(=O)N(CC(F)(F)F)[C@@H](C)C(C)C)ccc1[N+](=O)[O-] ZINC000114267837 1412398677 /nfs/dbraw/zinc/39/86/77/1412398677.db2.gz NQVBKNQPVNHKHX-NSHDSACASA-N 0 0 378.347 3.418 20 5 GGBDRN CN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCc2ccccc2C1 ZINC000114281683 1412401341 /nfs/dbraw/zinc/40/13/41/1412401341.db2.gz HHYGTJMEOHFTGG-FQEVSTJZSA-N 0 0 376.416 3.410 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(C)[C@@H]2CCc3ccccc3C2)cc([N+](=O)[O-])c1 ZINC000114281435 1412401378 /nfs/dbraw/zinc/40/13/78/1412401378.db2.gz FAJJQSLHNBSKHN-GOSISDBHSA-N 0 0 382.416 3.401 20 5 GGBDRN CN(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCc2ccccc2C1 ZINC000114281214 1412401634 /nfs/dbraw/zinc/40/16/34/1412401634.db2.gz CSGLCLKMRKQOKP-QGZVFWFLSA-N 0 0 376.416 3.410 20 5 GGBDRN CN(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCc2ccccc2C1 ZINC000114281620 1412401691 /nfs/dbraw/zinc/40/16/91/1412401691.db2.gz YXVQASQKOGZQOA-LJQANCHMSA-N 0 0 376.416 3.410 20 5 GGBDRN COc1ccc(Cl)cc1N(C)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000114283850 1412402658 /nfs/dbraw/zinc/40/26/58/1412402658.db2.gz LPSCILIYBCBDNR-UHFFFAOYSA-N 0 0 387.783 3.114 20 5 GGBDRN CC[C@H]1c2ccccc2CCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000114304689 1412408165 /nfs/dbraw/zinc/40/81/65/1412408165.db2.gz XCZHWXKDVMZEBH-INIZCTEOSA-N 0 0 399.472 3.322 20 5 GGBDRN CCOC(=O)c1csc(CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000114358155 1412418897 /nfs/dbraw/zinc/41/88/97/1412418897.db2.gz FVVQITLISXIQIF-UHFFFAOYSA-N 0 0 391.449 3.456 20 5 GGBDRN Cc1ccc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(O[C@@H]2CCOC2)c1 ZINC000177245389 1428648329 /nfs/dbraw/zinc/64/83/29/1428648329.db2.gz MYELHUYULJHEFZ-GOSISDBHSA-N 0 0 399.447 3.413 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)CNc2ccccc2[N+](=O)[O-])cc1OC ZINC000114417883 1412429765 /nfs/dbraw/zinc/42/97/65/1412429765.db2.gz CNTRRVMGFZWRLK-NSHDSACASA-N 0 0 377.372 3.040 20 5 GGBDRN Cc1noc(COc2ccc(NCC(=O)Nc3ccc([N+](=O)[O-])cc3C)cc2)n1 ZINC000114453624 1412435655 /nfs/dbraw/zinc/43/56/55/1412435655.db2.gz WSGYPSHOKGVZKZ-UHFFFAOYSA-N 0 0 397.391 3.224 20 5 GGBDRN COc1cc(F)c([C@@H](C)N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1OC ZINC000114501639 1412447336 /nfs/dbraw/zinc/44/73/36/1412447336.db2.gz NUFSDOLGFRJLOQ-VXGBXAGGSA-N 0 0 391.399 3.429 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cccc(CN3CCCCC3=O)c2)c1[N+](=O)[O-] ZINC000114538564 1412455543 /nfs/dbraw/zinc/45/55/43/1412455543.db2.gz JHNYSGXJFOYOGC-UHFFFAOYSA-N 0 0 385.424 3.035 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@](C)(O)c1ccccc1 ZINC000114549606 1412458261 /nfs/dbraw/zinc/45/82/61/1412458261.db2.gz VWDQLOCKNHGXMJ-XIKOKIGWSA-N 0 0 378.812 3.039 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@](C)(O)c1ccc(F)cc1F ZINC000114553288 1412459439 /nfs/dbraw/zinc/45/94/39/1412459439.db2.gz OSOHMDOVXJXJFN-ADLMAVQZSA-N 0 0 396.415 3.378 20 5 GGBDRN C[C@@](O)(CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1 ZINC000114572300 1412463410 /nfs/dbraw/zinc/46/34/10/1412463410.db2.gz GQVQHSCVWZTLAC-QGZVFWFLSA-N 0 0 381.335 3.225 20 5 GGBDRN CN(C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000114609816 1412474589 /nfs/dbraw/zinc/47/45/89/1412474589.db2.gz UUWOJHHLOJGDEX-OAHLLOKOSA-N 0 0 387.823 3.203 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCc1nc(-c2cccc(Cl)c2)no1 ZINC000114646709 1412486704 /nfs/dbraw/zinc/48/67/04/1412486704.db2.gz CJEOGIVFHWAKPE-UHFFFAOYSA-N 0 0 386.795 3.200 20 5 GGBDRN Cc1nc([C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)c2ccccc2F)no1 ZINC000114648282 1412487072 /nfs/dbraw/zinc/48/70/72/1412487072.db2.gz WIBWVMJTDSXSPP-AWEZNQCLSA-N 0 0 376.369 3.315 20 5 GGBDRN Cc1nc([C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc2F)no1 ZINC000114647876 1412487372 /nfs/dbraw/zinc/48/73/72/1412487372.db2.gz JXOKUPYFDSKIKX-SFHVURJKSA-N 0 0 399.382 3.133 20 5 GGBDRN Cc1oc(C(N)=O)cc1-c1csc(NC(=O)c2cccc([N+](=O)[O-])c2C)n1 ZINC000114700483 1412502874 /nfs/dbraw/zinc/50/28/74/1412502874.db2.gz RSOJGNZJXVMHJX-UHFFFAOYSA-N 0 0 386.389 3.279 20 5 GGBDRN COc1ccc([C@H]2CCCN2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1OC ZINC000114724562 1412511886 /nfs/dbraw/zinc/51/18/86/1412511886.db2.gz MTMJGAKEGRRPFR-MRXNPFEDSA-N 0 0 385.420 3.388 20 5 GGBDRN COc1ccccc1CN(CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000114725893 1412511963 /nfs/dbraw/zinc/51/19/63/1412511963.db2.gz LWOLZORHDRAXLU-KRWDZBQOSA-N 0 0 399.447 3.223 20 5 GGBDRN O=C1[C@H](Nc2ccn(Cc3ccccc3)n2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000114753611 1412520050 /nfs/dbraw/zinc/52/00/50/1412520050.db2.gz QWURCECVIIFACZ-GOSISDBHSA-N 0 0 377.404 3.057 20 5 GGBDRN COc1cc(CCNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1O ZINC000114797005 1412527351 /nfs/dbraw/zinc/52/73/51/1412527351.db2.gz WKMGCTQJSHBKIM-UHFFFAOYSA-N 0 0 399.428 3.405 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000177258532 1428657239 /nfs/dbraw/zinc/65/72/39/1428657239.db2.gz DQKOMNQLPTXDFR-UHFFFAOYSA-N 0 0 383.404 3.064 20 5 GGBDRN COc1ccc([C@H]2[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CCC(=O)N2C)cc1 ZINC000115008279 1412565808 /nfs/dbraw/zinc/56/58/08/1412565808.db2.gz APBVTTBBPAACDD-UZLBHIALSA-N 0 0 397.431 3.460 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)cc2)no1 ZINC000115013735 1412567320 /nfs/dbraw/zinc/56/73/20/1412567320.db2.gz OAIYJMHUHCHACH-UHFFFAOYSA-N 0 0 394.387 3.322 20 5 GGBDRN CCC(CC)c1nnc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)s1 ZINC000115078539 1412585705 /nfs/dbraw/zinc/58/57/05/1412585705.db2.gz QYKQKUJMXGPEEK-SNVBAGLBSA-N 0 0 391.453 3.107 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)C(C)C ZINC000115108663 1412590663 /nfs/dbraw/zinc/59/06/63/1412590663.db2.gz FDWXCBRQJAPROA-IBGZPJMESA-N 0 0 398.463 3.262 20 5 GGBDRN C[C@@H](CCC1CCCCC1)NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000115118812 1412591556 /nfs/dbraw/zinc/59/15/56/1412591556.db2.gz CJLDPKZPOWBXJM-ZDUSSCGKSA-N 0 0 382.482 3.477 20 5 GGBDRN O=C(NCCCN1CCCCCC1=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000115124010 1412592341 /nfs/dbraw/zinc/59/23/41/1412592341.db2.gz JLBUCYXYSFCFIF-UHFFFAOYSA-N 0 0 375.450 3.332 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000115133619 1412593031 /nfs/dbraw/zinc/59/30/31/1412593031.db2.gz MSXNHZVEYJEYGI-FUHWJXTLSA-N 0 0 395.459 3.450 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000115133609 1412593280 /nfs/dbraw/zinc/59/32/80/1412593280.db2.gz MSXNHZVEYJEYGI-AEFFLSMTSA-N 0 0 395.459 3.450 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000115137005 1412594622 /nfs/dbraw/zinc/59/46/22/1412594622.db2.gz FWZZOCRUXUFMIK-ZBFHGGJFSA-N 0 0 377.404 3.194 20 5 GGBDRN COC(=O)c1cc(C(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000115146550 1412596362 /nfs/dbraw/zinc/59/63/62/1412596362.db2.gz WIQREYPWWQGFET-GOSISDBHSA-N 0 0 397.431 3.122 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000115144534 1412596418 /nfs/dbraw/zinc/59/64/18/1412596418.db2.gz GWIDRDIMGQOHDH-XJKSGUPXSA-N 0 0 399.472 3.190 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N(C)C[C@H]2CCOC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000177268053 1428663021 /nfs/dbraw/zinc/66/30/21/1428663021.db2.gz NLVSSSYABHXBKV-HUUCEWRRSA-N 0 0 384.436 3.271 20 5 GGBDRN CCc1ccc(OCC(=O)N(C)Cc2ccc(OC)c(F)c2)c([N+](=O)[O-])c1 ZINC000115200479 1412605711 /nfs/dbraw/zinc/60/57/11/1412605711.db2.gz PHWNMZANWICGEK-UHFFFAOYSA-N 0 0 376.384 3.342 20 5 GGBDRN CCc1ccc(OCC(=O)Nc2ccnn2Cc2cccs2)c([N+](=O)[O-])c1 ZINC000115200743 1412605967 /nfs/dbraw/zinc/60/59/67/1412605967.db2.gz IDNRNQUITNTZMZ-UHFFFAOYSA-N 0 0 386.433 3.481 20 5 GGBDRN CCc1ccc(OCC(=O)NCCc2cnn(-c3ccccc3)c2)c([N+](=O)[O-])c1 ZINC000115200841 1412606074 /nfs/dbraw/zinc/60/60/74/1412606074.db2.gz ZKOVLQOBIBIIAK-UHFFFAOYSA-N 0 0 394.431 3.081 20 5 GGBDRN CCc1ccc(OCC(=O)NCc2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1 ZINC000115200466 1412606082 /nfs/dbraw/zinc/60/60/82/1412606082.db2.gz UAOFXAVVKOMPEX-UHFFFAOYSA-N 0 0 380.347 3.454 20 5 GGBDRN CC(C)[C@@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000115210817 1412609405 /nfs/dbraw/zinc/60/94/05/1412609405.db2.gz BHJCWOMGCZNZCD-GOSISDBHSA-N 0 0 387.367 3.155 20 5 GGBDRN CN1C(=O)C[C@H](C(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(Cl)c1 ZINC000115209776 1412609690 /nfs/dbraw/zinc/60/96/90/1412609690.db2.gz VBQLWCBUYOMKLK-YJBOKZPZSA-N 0 0 387.823 3.084 20 5 GGBDRN O=C(CCCCCNC(=O)NC1CCCCC1)NCc1cccc([N+](=O)[O-])c1 ZINC000115212339 1412610560 /nfs/dbraw/zinc/61/05/60/1412610560.db2.gz GEITYHKBRFOIRR-UHFFFAOYSA-N 0 0 390.484 3.403 20 5 GGBDRN CN1C(=O)C[C@@H](C(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccc(Cl)c1 ZINC000115212342 1412610737 /nfs/dbraw/zinc/61/07/37/1412610737.db2.gz KUWZYFMEXAYEOD-AEFFLSMTSA-N 0 0 387.823 3.084 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCSC[C@@H]1c1ccccc1 ZINC000115235911 1412617567 /nfs/dbraw/zinc/61/75/67/1412617567.db2.gz LUPLQWRAEKLXQY-QGZVFWFLSA-N 0 0 376.409 3.429 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cccc1[N+](=O)[O-] ZINC000177269844 1428664061 /nfs/dbraw/zinc/66/40/61/1428664061.db2.gz BLPMQZJPEHPORI-UHFFFAOYSA-N 0 0 383.404 3.064 20 5 GGBDRN CN(C[C@H]1CCOC1)C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000177269847 1428664083 /nfs/dbraw/zinc/66/40/83/1428664083.db2.gz HONQOBYOXIRNCB-SNVBAGLBSA-N 0 0 399.234 3.196 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cccc(C[S@](=O)c3ccccc3)c2)c1[N+](=O)[O-] ZINC000115255864 1412622570 /nfs/dbraw/zinc/62/25/70/1412622570.db2.gz NNVHSKDPHRMTDP-MUUNZHRXSA-N 0 0 398.444 3.197 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cccc(C[S@@](=O)c2ccccc2)c1 ZINC000115256832 1412623424 /nfs/dbraw/zinc/62/34/24/1412623424.db2.gz YTXJTFDYMJCUOV-NDEPHWFRSA-N 0 0 398.444 3.128 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cccc(C[S@](=O)c2ccccc2)c1 ZINC000115256829 1412623473 /nfs/dbraw/zinc/62/34/73/1412623473.db2.gz YTXJTFDYMJCUOV-MUUNZHRXSA-N 0 0 398.444 3.128 20 5 GGBDRN Cn1cc(C(=O)Nc2cccc(C[S@@](C)=O)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000115261068 1412624831 /nfs/dbraw/zinc/62/48/31/1412624831.db2.gz KVYOEYSALRKSOO-NDEPHWFRSA-N 0 0 398.444 3.126 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(C[S@@](C)=O)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000115259694 1412624923 /nfs/dbraw/zinc/62/49/23/1412624923.db2.gz CRYGZGAFKJOIGR-MHZLTWQESA-N 0 0 391.405 3.251 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1 ZINC000115268861 1412626363 /nfs/dbraw/zinc/62/63/63/1412626363.db2.gz NLGZBIHMMHODLF-SANMLTNESA-N 0 0 395.868 3.445 20 5 GGBDRN O=C(Nc1cccc(C[S@](=O)C2CCOCC2)c1)c1ccc([N+](=O)[O-])s1 ZINC000115289603 1412635442 /nfs/dbraw/zinc/63/54/42/1412635442.db2.gz QOZLCQYJQIGNGW-AREMUKBSSA-N 0 0 394.474 3.336 20 5 GGBDRN COc1ccc(NC(=O)Cn2c(CSC)nc3ccccc32)c([N+](=O)[O-])c1 ZINC000115305268 1412643079 /nfs/dbraw/zinc/64/30/79/1412643079.db2.gz XWVPRCAOEJMYRB-UHFFFAOYSA-N 0 0 386.433 3.455 20 5 GGBDRN O=C(C[C@H]1CCc2ccccc21)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000115333033 1412651200 /nfs/dbraw/zinc/65/12/00/1412651200.db2.gz HJDMIIWTXKBDQP-OAHLLOKOSA-N 0 0 399.472 3.061 20 5 GGBDRN CCCOc1cc(NC(=O)CN2CCSC2=O)c([N+](=O)[O-])cc1OCCC ZINC000115347253 1412655136 /nfs/dbraw/zinc/65/51/36/1412655136.db2.gz CCXSJVROHOWLEJ-UHFFFAOYSA-N 0 0 397.453 3.280 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC(OCc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000115358094 1412657592 /nfs/dbraw/zinc/65/75/92/1412657592.db2.gz CQMSYAMQRRHBEE-UHFFFAOYSA-N 0 0 390.461 3.184 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)c2ccccc2)cc1OC ZINC000115360240 1412658869 /nfs/dbraw/zinc/65/88/69/1412658869.db2.gz KKAJKDQSSOMECO-AWEZNQCLSA-N 0 0 388.420 3.462 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2Cn2ccnc2)c1 ZINC000115380671 1412662827 /nfs/dbraw/zinc/66/28/27/1412662827.db2.gz WXWCLTWMDXMXCP-UHFFFAOYSA-N 0 0 382.445 3.492 20 5 GGBDRN C[C@H]1Oc2ccccc2N(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1=O ZINC000115403269 1412667456 /nfs/dbraw/zinc/66/74/56/1412667456.db2.gz LFRYBHHRTBDACB-SNVBAGLBSA-N 0 0 375.768 3.001 20 5 GGBDRN CN(C)[C@@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000115410839 1412669560 /nfs/dbraw/zinc/66/95/60/1412669560.db2.gz SEBJISUZKDFRRZ-INIZCTEOSA-N 0 0 393.390 3.061 20 5 GGBDRN CN(C)[C@H](CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000115411488 1412670195 /nfs/dbraw/zinc/67/01/95/1412670195.db2.gz BYKULADNEGTVCV-VGMNTSGFSA-N 0 0 375.375 3.305 20 5 GGBDRN O=C(CCn1c(=O)oc2cc(Cl)ccc21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000115415679 1412671475 /nfs/dbraw/zinc/67/14/75/1412671475.db2.gz FGNPNMKKOSNMNZ-UHFFFAOYSA-N 0 0 387.779 3.136 20 5 GGBDRN O=C(NCCOC[C@@H]1CCCO1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000115426426 1412673366 /nfs/dbraw/zinc/67/33/66/1412673366.db2.gz FXQKXXKJJZIWDI-KRWDZBQOSA-N 0 0 385.420 3.264 20 5 GGBDRN COc1cc(CCNC(=O)c2cc(F)c(C)cc2F)c([N+](=O)[O-])cc1OC ZINC000177277264 1428668043 /nfs/dbraw/zinc/66/80/43/1428668043.db2.gz VLOQWXGJGROVGK-UHFFFAOYSA-N 0 0 380.347 3.171 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2)CN1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000115554812 1412709497 /nfs/dbraw/zinc/70/94/97/1412709497.db2.gz LLFJPUHXZVRSTG-DZGCQCFKSA-N 0 0 383.404 3.140 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000115571667 1412716540 /nfs/dbraw/zinc/71/65/40/1412716540.db2.gz JVUSLVPPNRNNCG-LJQANCHMSA-N 0 0 397.431 3.089 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](c2ccccc2)C[C@H]1C ZINC000115587764 1412720762 /nfs/dbraw/zinc/72/07/62/1412720762.db2.gz NWGIGULEILONLU-UKRRQHHQSA-N 0 0 376.434 3.170 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000115587287 1412721421 /nfs/dbraw/zinc/72/14/21/1412721421.db2.gz HJVKXLDVCWSSBG-DZGCQCFKSA-N 0 0 376.434 3.170 20 5 GGBDRN CN([C@H]1CCCN(c2ccccc2)C1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000115587993 1412722229 /nfs/dbraw/zinc/72/22/29/1412722229.db2.gz INZSLRVRKAVIDH-IBGZPJMESA-N 0 0 389.477 3.025 20 5 GGBDRN CN([C@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000115588102 1412722383 /nfs/dbraw/zinc/72/23/83/1412722383.db2.gz DOLPGXSYVABMMV-INIZCTEOSA-N 0 0 393.440 3.023 20 5 GGBDRN O=C(NCc1nc(-c2cccc(Cl)c2)no1)NCc1cccc([N+](=O)[O-])c1 ZINC000115668630 1412754387 /nfs/dbraw/zinc/75/43/87/1412754387.db2.gz CECZCWOSCMSESC-UHFFFAOYSA-N 0 0 387.783 3.298 20 5 GGBDRN COc1cc(C(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000177292304 1428674817 /nfs/dbraw/zinc/67/48/17/1428674817.db2.gz JTKGLDJHJLFOLA-QDXKXIGTSA-N 0 0 376.434 3.174 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c(N)c([N+](=O)[O-])c1 ZINC000115724677 1412774085 /nfs/dbraw/zinc/77/40/85/1412774085.db2.gz KWFWUTZHQFVFLO-VWLOTQADSA-N 0 0 381.841 3.270 20 5 GGBDRN Cc1cccc([C@H](C)NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000115726201 1412774404 /nfs/dbraw/zinc/77/44/04/1412774404.db2.gz IQPZRLRMSAUFJN-ZDUSSCGKSA-N 0 0 389.839 3.472 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000177292590 1428675207 /nfs/dbraw/zinc/67/52/07/1428675207.db2.gz VGVYPHNWNQRWIV-PWFNWSNSSA-N 0 0 390.461 3.321 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000177292606 1428675412 /nfs/dbraw/zinc/67/54/12/1428675412.db2.gz VGVYPHNWNQRWIV-ASHKIFAZSA-N 0 0 390.461 3.321 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccc(N3CCOCC3)nc2)c(C(F)(F)F)c1 ZINC000115780928 1412787064 /nfs/dbraw/zinc/78/70/64/1412787064.db2.gz SHZYYHUWPGGYHE-UHFFFAOYSA-N 0 0 382.342 3.457 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2c3cccc(F)c3CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000177295812 1428676325 /nfs/dbraw/zinc/67/63/25/1428676325.db2.gz NDEXCTOSAMNEEW-SGTLLEGYSA-N 0 0 385.395 3.421 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2c3cccc(F)c3CC[C@H]2C)cc1[N+](=O)[O-] ZINC000177295861 1428676350 /nfs/dbraw/zinc/67/63/50/1428676350.db2.gz NDEXCTOSAMNEEW-KZULUSFZSA-N 0 0 385.395 3.421 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c1 ZINC000115859339 1412803237 /nfs/dbraw/zinc/80/32/37/1412803237.db2.gz WMDKBZBXDKBHGP-LBPRGKRZSA-N 0 0 383.404 3.443 20 5 GGBDRN CCOc1cc2c(cc1CNC(=O)c1cc(OC)ccc1[N+](=O)[O-])O[C@H](C)C2 ZINC000115858645 1412803244 /nfs/dbraw/zinc/80/32/44/1412803244.db2.gz UKGCBSBQSLSVMW-GFCCVEGCSA-N 0 0 386.404 3.256 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2nn(-c3ccccc3)c3c2CCC3)c1 ZINC000115860381 1412803577 /nfs/dbraw/zinc/80/35/77/1412803577.db2.gz JOWUTOHQSIVWJB-UHFFFAOYSA-N 0 0 392.415 3.208 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115887239 1412810173 /nfs/dbraw/zinc/81/01/73/1412810173.db2.gz KRXNHLDAHBHRFO-UHFFFAOYSA-N 0 0 385.395 3.420 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(Cc2ccc(F)cc2)CC2CC2)cccc1[N+](=O)[O-] ZINC000115887317 1412810588 /nfs/dbraw/zinc/81/05/88/1412810588.db2.gz QSFHUQMRRKJOGA-UHFFFAOYSA-N 0 0 385.395 3.420 20 5 GGBDRN CCc1ccc(OC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(C)=O)c([N+](=O)[O-])c1 ZINC000115926809 1412816173 /nfs/dbraw/zinc/81/61/73/1412816173.db2.gz TWDYPHJFXXZJOR-GOSISDBHSA-N 0 0 395.415 3.291 20 5 GGBDRN CCc1ccc(OC(=O)c2sccc2S(=O)(=O)C(F)F)c([N+](=O)[O-])c1 ZINC000115927220 1412816231 /nfs/dbraw/zinc/81/62/31/1412816231.db2.gz UPVCNWMAZFURTC-UHFFFAOYSA-N 0 0 391.373 3.434 20 5 GGBDRN CCc1ccc(OC(=O)c2nc(N3CCCC3)ncc2Cl)c([N+](=O)[O-])c1 ZINC000115926950 1412816255 /nfs/dbraw/zinc/81/62/55/1412816255.db2.gz MDCFZECZCUCJKK-UHFFFAOYSA-N 0 0 376.800 3.420 20 5 GGBDRN CCc1ccc(OC(=O)C2CCN(C(=O)N(CC)CC)CC2)c([N+](=O)[O-])c1 ZINC000115927272 1412816305 /nfs/dbraw/zinc/81/63/05/1412816305.db2.gz YAALPQJKEYZRHQ-UHFFFAOYSA-N 0 0 377.441 3.236 20 5 GGBDRN CC[C@@H](C)C[C@H](C)NS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000115928532 1412816530 /nfs/dbraw/zinc/81/65/30/1412816530.db2.gz IAPPGQZNMFUSEV-ZJUUUORDSA-N 0 0 379.276 3.460 20 5 GGBDRN COc1cccc(CN(C[C@H]2CCCO2)C(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000115931575 1412816619 /nfs/dbraw/zinc/81/66/19/1412816619.db2.gz YDTPOVSHKISXMA-MRXNPFEDSA-N 0 0 376.434 3.486 20 5 GGBDRN COc1cccc(CN(C[C@@H]2CCCO2)C(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000115931574 1412816794 /nfs/dbraw/zinc/81/67/94/1412816794.db2.gz YDTPOVSHKISXMA-INIZCTEOSA-N 0 0 376.434 3.486 20 5 GGBDRN O=C1N[C@]2(CCc3ccccc3C2)C(=O)N1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000115963039 1412818237 /nfs/dbraw/zinc/81/82/37/1412818237.db2.gz ICQGNJRXRYRAAY-IBGZPJMESA-N 0 0 385.807 3.228 20 5 GGBDRN COCCn1ncc2ccc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)cc21 ZINC000115981938 1412819364 /nfs/dbraw/zinc/81/93/64/1412819364.db2.gz GUARMUWGZJULFZ-UHFFFAOYSA-N 0 0 395.419 3.418 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2c3cccc(F)c3CC[C@H]2C)cccc1[N+](=O)[O-] ZINC000177301638 1428678263 /nfs/dbraw/zinc/67/82/63/1428678263.db2.gz KKSGJTKRUDDMFS-ZMZPIMSZSA-N 0 0 385.395 3.421 20 5 GGBDRN Cc1cc(=O)c(C(=O)NC(C)(C)c2ccccc2)nn1-c1ccccc1[N+](=O)[O-] ZINC000115997808 1412820957 /nfs/dbraw/zinc/82/09/57/1412820957.db2.gz UQFXJZLWMDABML-UHFFFAOYSA-N 0 0 392.415 3.114 20 5 GGBDRN COCCN(Cc1cccs1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116012351 1412821571 /nfs/dbraw/zinc/82/15/71/1412821571.db2.gz ZYRROTFXFXGSKF-UHFFFAOYSA-N 0 0 386.433 3.131 20 5 GGBDRN CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1 ZINC000116033293 1412823642 /nfs/dbraw/zinc/82/36/42/1412823642.db2.gz JKDPILLZIBVYKR-HHHXNRCGSA-N 0 0 392.481 3.212 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(C(C)(C)C)nn1Cc1ccccc1 ZINC000116044697 1412824248 /nfs/dbraw/zinc/82/42/48/1412824248.db2.gz NIKNYHJJDSSTJF-UHFFFAOYSA-N 0 0 396.451 3.281 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCc2sccc2[C@H]1c1cccs1 ZINC000116044091 1412824255 /nfs/dbraw/zinc/82/42/55/1412824255.db2.gz ORXHKCFOVKUOFL-KRWDZBQOSA-N 0 0 388.474 3.397 20 5 GGBDRN Cc1nn(CCC(=O)OCc2cc([N+](=O)[O-])ccc2Cl)c(C)c1[N+](=O)[O-] ZINC000116062065 1412826455 /nfs/dbraw/zinc/82/64/55/1412826455.db2.gz LHZCIOOZDZCKAP-UHFFFAOYSA-N 0 0 382.760 3.103 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1C(=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116061788 1412826604 /nfs/dbraw/zinc/82/66/04/1412826604.db2.gz MQNBPFVVAMKERB-UHFFFAOYSA-N 0 0 383.809 3.317 20 5 GGBDRN COc1ccccc1C(C)(C)CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000116091956 1412830610 /nfs/dbraw/zinc/83/06/10/1412830610.db2.gz CDQMIUKKAMMZNB-UHFFFAOYSA-N 0 0 378.450 3.168 20 5 GGBDRN CC(C)(C)[C@H]1CCCN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000116091482 1412830684 /nfs/dbraw/zinc/83/06/84/1412830684.db2.gz QFYWRCSNPQOZTM-AWEZNQCLSA-N 0 0 393.509 3.461 20 5 GGBDRN Cc1c(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000116095073 1412831323 /nfs/dbraw/zinc/83/13/23/1412831323.db2.gz BZRDZMHPYLCPGP-BBRMVZONSA-N 0 0 399.357 3.048 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000116095071 1412831330 /nfs/dbraw/zinc/83/13/30/1412831330.db2.gz BZRDZMHPYLCPGP-XJKSGUPXSA-N 0 0 399.357 3.048 20 5 GGBDRN Cc1c(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000116095078 1412831383 /nfs/dbraw/zinc/83/13/83/1412831383.db2.gz BZRDZMHPYLCPGP-CJNGLKHVSA-N 0 0 399.357 3.048 20 5 GGBDRN O=C(N[C@@H]1C[C@@H]1c1c(F)cccc1F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116097123 1412831580 /nfs/dbraw/zinc/83/15/80/1412831580.db2.gz LGORJCRDZXXXLK-SUMWQHHRSA-N 0 0 384.342 3.345 20 5 GGBDRN COC(=O)c1cc(C(=O)NC2(c3nccs3)CCCC2)cc([N+](=O)[O-])c1 ZINC000116102150 1412832376 /nfs/dbraw/zinc/83/23/76/1412832376.db2.gz GWIDLBULHINWPM-UHFFFAOYSA-N 0 0 375.406 3.037 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2cccc(F)c2)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000116108803 1412833007 /nfs/dbraw/zinc/83/30/07/1412833007.db2.gz VMBJWFSABMRJOJ-CQSZACIVSA-N 0 0 388.355 3.041 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000116136501 1412835717 /nfs/dbraw/zinc/83/57/17/1412835717.db2.gz LCLBAZYYCLJAKU-OAHLLOKOSA-N 0 0 394.884 3.460 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC(C)(C)c2nc(C)cs2)cc1OC ZINC000116144249 1412836405 /nfs/dbraw/zinc/83/64/05/1412836405.db2.gz UFMCHTMRDAWXCK-UHFFFAOYSA-N 0 0 379.438 3.432 20 5 GGBDRN CCC(C)(C)NC(=O)c1ccc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)cc1 ZINC000116174783 1412839906 /nfs/dbraw/zinc/83/99/06/1412839906.db2.gz VKNYBMVIMPYKCE-UHFFFAOYSA-N 0 0 387.440 3.047 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@@H](C)c2ccc(OCc3cccnc3)cc2)c1[N+](=O)[O-] ZINC000116206754 1412842275 /nfs/dbraw/zinc/84/22/75/1412842275.db2.gz SZTKCUQXLRRVPR-LBPRGKRZSA-N 0 0 381.392 3.091 20 5 GGBDRN CCNC(=O)c1ccc(OC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 ZINC000116204548 1412842409 /nfs/dbraw/zinc/84/24/09/1412842409.db2.gz PFIKWUVOJYVUOI-UHFFFAOYSA-N 0 0 383.404 3.164 20 5 GGBDRN Cc1ccc(CCNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1 ZINC000116205773 1412842426 /nfs/dbraw/zinc/84/24/26/1412842426.db2.gz XEHQOYNNXUJERP-UHFFFAOYSA-N 0 0 397.460 3.155 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H](C)c2ccc(OCc3cccnc3)cc2)c1[N+](=O)[O-] ZINC000116206757 1412842630 /nfs/dbraw/zinc/84/26/30/1412842630.db2.gz SZTKCUQXLRRVPR-GFCCVEGCSA-N 0 0 381.392 3.091 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000116220496 1412844379 /nfs/dbraw/zinc/84/43/79/1412844379.db2.gz SUACXLBKSTXVDS-UHFFFAOYSA-N 0 0 395.246 3.255 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2cccc(F)c2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000116227442 1412845432 /nfs/dbraw/zinc/84/54/32/1412845432.db2.gz CWIVQHBPHZGBSO-CYBMUJFWSA-N 0 0 383.383 3.009 20 5 GGBDRN O=C1N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116266730 1412846758 /nfs/dbraw/zinc/84/67/58/1412846758.db2.gz SQCFKKHCHUOQMZ-MRXNPFEDSA-N 0 0 398.806 3.393 20 5 GGBDRN COc1cc(C(=O)NCc2cccc(N(C)C)c2)c([N+](=O)[O-])cc1OC(F)F ZINC000116285558 1412847500 /nfs/dbraw/zinc/84/75/00/1412847500.db2.gz AUPLECAYBZMLBE-UHFFFAOYSA-N 0 0 395.362 3.201 20 5 GGBDRN COc1ccccc1C1(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CC1 ZINC000116429262 1412858899 /nfs/dbraw/zinc/85/88/99/1412858899.db2.gz GHCNHVWEYMAEHF-UHFFFAOYSA-N 0 0 392.415 3.251 20 5 GGBDRN CC(C)(C)c1ccc([C@H](O)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000116458499 1412863205 /nfs/dbraw/zinc/86/32/05/1412863205.db2.gz KHMUEWSQLXYFIC-MRXNPFEDSA-N 0 0 375.400 3.077 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCC[C@@H](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000116459549 1412863514 /nfs/dbraw/zinc/86/35/14/1412863514.db2.gz IHFATXOWJDNBRA-OAHLLOKOSA-N 0 0 391.468 3.008 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116464590 1412864529 /nfs/dbraw/zinc/86/45/29/1412864529.db2.gz IJUUJUSBINASGW-QGZVFWFLSA-N 0 0 378.812 3.499 20 5 GGBDRN COc1ccccc1N1CC[C@@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000116469887 1412865005 /nfs/dbraw/zinc/86/50/05/1412865005.db2.gz OXZFVRGGSYPEDF-YRYLYKBFSA-N 0 0 381.432 3.259 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)cc1[N+](=O)[O-] ZINC000116474202 1412865493 /nfs/dbraw/zinc/86/54/93/1412865493.db2.gz MJGNKSTVSWATHH-UHFFFAOYSA-N 0 0 389.843 3.301 20 5 GGBDRN COC(=O)c1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000116481202 1412866253 /nfs/dbraw/zinc/86/62/53/1412866253.db2.gz SSMDRVRCTQRITF-UHFFFAOYSA-N 0 0 394.424 3.407 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000177310045 1428682668 /nfs/dbraw/zinc/68/26/68/1428682668.db2.gz HFGKALZDBFVLSD-PGGUUEOZSA-N 0 0 389.477 3.354 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(CCc1ccccc1)Cc1ccncc1 ZINC000116507855 1412870241 /nfs/dbraw/zinc/87/02/41/1412870241.db2.gz ZWIKAZZZWVFAMO-UHFFFAOYSA-N 0 0 393.447 3.156 20 5 GGBDRN Cc1noc([C@@H](C)NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000116579612 1412880873 /nfs/dbraw/zinc/88/08/73/1412880873.db2.gz JLRCJECRJZKHBI-GFCCVEGCSA-N 0 0 381.392 3.389 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCc1ccn(-c2ccccc2)n1 ZINC000116586538 1412883956 /nfs/dbraw/zinc/88/39/56/1412883956.db2.gz LMBQJBBZFLRKGG-UHFFFAOYSA-N 0 0 393.447 3.332 20 5 GGBDRN Cc1nn(C)c(C)c1-c1cc(C(=O)OCc2cc([N+](=O)[O-])ccc2Cl)n[nH]1 ZINC000116599747 1412885826 /nfs/dbraw/zinc/88/58/26/1412885826.db2.gz QNBGSVXGGGGFKN-UHFFFAOYSA-N 0 0 389.799 3.346 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cccnc1-n1cccn1 ZINC000116626606 1412888585 /nfs/dbraw/zinc/88/85/85/1412888585.db2.gz CWMLVZNSUOCAOQ-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN COCc1cccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116629078 1412888914 /nfs/dbraw/zinc/88/89/14/1412888914.db2.gz MBDOJGNBTMOOGS-UHFFFAOYSA-N 0 0 378.812 3.480 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116629876 1412888927 /nfs/dbraw/zinc/88/89/27/1412888927.db2.gz FMROKDXLNBAFAQ-UHFFFAOYSA-N 0 0 391.811 3.406 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc2oc(=O)[nH]c2c1 ZINC000116630691 1412888930 /nfs/dbraw/zinc/88/89/30/1412888930.db2.gz UIXQQTGLEBFSDP-UHFFFAOYSA-N 0 0 377.740 3.090 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC(OCc3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000116654646 1412892088 /nfs/dbraw/zinc/89/20/88/1412892088.db2.gz JOCOIOISXGIHHP-UHFFFAOYSA-N 0 0 386.452 3.006 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1[N+](=O)[O-] ZINC000116660440 1412893578 /nfs/dbraw/zinc/89/35/78/1412893578.db2.gz FYGNEKCLOALCPA-GFCCVEGCSA-N 0 0 395.337 3.344 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000116661190 1412893908 /nfs/dbraw/zinc/89/39/08/1412893908.db2.gz ANHQEJALLWULIF-CYBMUJFWSA-N 0 0 377.347 3.205 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000116661188 1412894025 /nfs/dbraw/zinc/89/40/25/1412894025.db2.gz ANHQEJALLWULIF-ZDUSSCGKSA-N 0 0 377.347 3.205 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1)C(C)C ZINC000116663045 1412894325 /nfs/dbraw/zinc/89/43/25/1412894325.db2.gz PPNUVDWMFXKBNA-UHFFFAOYSA-N 0 0 385.420 3.369 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000116684327 1412896910 /nfs/dbraw/zinc/89/69/10/1412896910.db2.gz DPFPAWYJVWTDCT-AREMUKBSSA-N 0 0 396.852 3.396 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000116684092 1412897001 /nfs/dbraw/zinc/89/70/01/1412897001.db2.gz FDIDBLDXFJMNMU-AREMUKBSSA-N 0 0 396.852 3.396 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116693763 1412898527 /nfs/dbraw/zinc/89/85/27/1412898527.db2.gz ZAULZNODFISJGZ-NDEPHWFRSA-N 0 0 398.444 3.220 20 5 GGBDRN CN(Cc1ccc(Cl)s1)C(=O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000116705388 1412899500 /nfs/dbraw/zinc/89/95/00/1412899500.db2.gz SQRMCRFYPUXINW-UHFFFAOYSA-N 0 0 391.840 3.227 20 5 GGBDRN CCOC(=O)c1oc2ccccc2c1CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000116707439 1412899560 /nfs/dbraw/zinc/89/95/60/1412899560.db2.gz WTLCBNGABZTWLM-UHFFFAOYSA-N 0 0 382.372 3.377 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)c2cc([N+](=O)[O-])ccc2Br)o1 ZINC000116704855 1412899605 /nfs/dbraw/zinc/89/96/05/1412899605.db2.gz VPFDMRKPOUMKAS-AWEZNQCLSA-N 0 0 395.209 3.472 20 5 GGBDRN COc1ccc(C)cc1N1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1=O ZINC000116710249 1412901748 /nfs/dbraw/zinc/90/17/48/1412901748.db2.gz FUAQKLABSOEBOB-GFCCVEGCSA-N 0 0 387.367 3.043 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1nc(-c2ccncc2)no1 ZINC000116748337 1412914992 /nfs/dbraw/zinc/91/49/92/1412914992.db2.gz VRVDEYLNFLPYID-HNNXBMFYSA-N 0 0 385.355 3.306 20 5 GGBDRN NC(=O)c1ccc(Cl)c(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116759099 1412917377 /nfs/dbraw/zinc/91/73/77/1412917377.db2.gz GXEMIINPUMJNRZ-UHFFFAOYSA-N 0 0 398.202 3.408 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1nc(-c2cccnc2)no1 ZINC000116770582 1412919955 /nfs/dbraw/zinc/91/99/55/1412919955.db2.gz CDQIBLGOFXQBSI-HNNXBMFYSA-N 0 0 385.355 3.306 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1nc(-c2cccnc2)no1 ZINC000116770584 1412920711 /nfs/dbraw/zinc/92/07/11/1412920711.db2.gz CDQIBLGOFXQBSI-OAHLLOKOSA-N 0 0 385.355 3.306 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cnn(CC(F)F)c1 ZINC000116842746 1412937738 /nfs/dbraw/zinc/93/77/38/1412937738.db2.gz KGALCMLVMXUGLO-UHFFFAOYSA-N 0 0 382.370 3.255 20 5 GGBDRN Cc1ccc(OC2CCN(Cn3cc(Br)c([N+](=O)[O-])n3)CC2)cc1 ZINC000116868317 1412945405 /nfs/dbraw/zinc/94/54/05/1412945405.db2.gz JRMLAAIKLQIBHS-UHFFFAOYSA-N 0 0 395.257 3.363 20 5 GGBDRN CCNc1ccc(C(=O)Nc2ccccc2S(=O)(=O)CC)cc1[N+](=O)[O-] ZINC000116888490 1412951000 /nfs/dbraw/zinc/95/10/00/1412951000.db2.gz CXKANWAGTFFRLQ-UHFFFAOYSA-N 0 0 377.422 3.073 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCCNc1ccc(C(F)(F)F)cn1 ZINC000116946115 1412962035 /nfs/dbraw/zinc/96/20/35/1412962035.db2.gz OLFDZJQPEWTOMM-UHFFFAOYSA-N 0 0 398.341 3.249 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cccc(C[S@](C)=O)c2C)c1 ZINC000116989406 1412974398 /nfs/dbraw/zinc/97/43/98/1412974398.db2.gz OMYRNSIVAJAGIT-HHHXNRCGSA-N 0 0 390.461 3.498 20 5 GGBDRN Cc1ccc(NC(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc1[N+](=O)[O-] ZINC000116996040 1412975389 /nfs/dbraw/zinc/97/53/89/1412975389.db2.gz SWABGOJMOIGLAH-UHFFFAOYSA-N 0 0 377.422 3.400 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000177329100 1428692619 /nfs/dbraw/zinc/69/26/19/1428692619.db2.gz PACQNYMXZNGOAX-MUDIAHQHSA-N 0 0 394.424 3.070 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3C)CC2)cc1 ZINC000117071407 1412992710 /nfs/dbraw/zinc/99/27/10/1412992710.db2.gz AHOXJVWANNIUKN-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000117071573 1412992855 /nfs/dbraw/zinc/99/28/55/1412992855.db2.gz PDIZFCQYOAULBM-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN Nc1ccc(C(=O)OC2CCN(c3ccc(Cl)cn3)CC2)cc1[N+](=O)[O-] ZINC000117098604 1412999107 /nfs/dbraw/zinc/99/91/07/1412999107.db2.gz JTQLLRYVMRLMMO-UHFFFAOYSA-N 0 0 376.800 3.051 20 5 GGBDRN O=c1oc2cc(Cl)ccc2n1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117108985 1413000340 /nfs/dbraw/zinc/00/03/40/1413000340.db2.gz XHQFGBVISROWHV-UHFFFAOYSA-N 0 0 389.751 3.154 20 5 GGBDRN CC(C)(C)c1nnc(SCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)o1 ZINC000117111203 1413000367 /nfs/dbraw/zinc/00/03/67/1413000367.db2.gz GIASMFCRPKTWLF-UHFFFAOYSA-N 0 0 378.410 3.366 20 5 GGBDRN CCn1c(SCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)nnc1C1CC1 ZINC000117108956 1413000688 /nfs/dbraw/zinc/00/06/88/1413000688.db2.gz BJPDSGSPFGOIJM-UHFFFAOYSA-N 0 0 389.437 3.174 20 5 GGBDRN C[C@H](Sc1n[nH]c(-c2ccccn2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000117115381 1413001002 /nfs/dbraw/zinc/00/10/02/1413001002.db2.gz DWOCHPAIUOKVPI-VIFPVBQESA-N 0 0 388.384 3.033 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Sc2n[nH]c(-c3ccccn3)n2)cccc1[N+](=O)[O-] ZINC000117113518 1413001589 /nfs/dbraw/zinc/00/15/89/1413001589.db2.gz SZCSFDCTLDTQHW-NSHDSACASA-N 0 0 384.421 3.203 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CSc3n[nH]c(-c4ccccn4)n3)n2)c1 ZINC000117115711 1413002158 /nfs/dbraw/zinc/00/21/58/1413002158.db2.gz WYBWQENTNOLJRC-UHFFFAOYSA-N 0 0 381.377 3.117 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000177331367 1428693698 /nfs/dbraw/zinc/69/36/98/1428693698.db2.gz JOJPBUBKJHWIIM-QGZVFWFLSA-N 0 0 394.786 3.366 20 5 GGBDRN CC[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000117160436 1413007272 /nfs/dbraw/zinc/00/72/72/1413007272.db2.gz AVLMOTIBRZOKCG-KGLIPLIRSA-N 0 0 379.482 3.300 20 5 GGBDRN CC[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000117160442 1413007391 /nfs/dbraw/zinc/00/73/91/1413007391.db2.gz AVLMOTIBRZOKCG-ZIAGYGMSSA-N 0 0 379.482 3.300 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000177331351 1428693900 /nfs/dbraw/zinc/69/39/00/1428693900.db2.gz JOJPBUBKJHWIIM-KRWDZBQOSA-N 0 0 394.786 3.366 20 5 GGBDRN CC(C)(CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Cc1ccccc1 ZINC000117193782 1413010559 /nfs/dbraw/zinc/01/05/59/1413010559.db2.gz HWCMSELPFYOGKK-UHFFFAOYSA-N 0 0 379.420 3.174 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCCC[C@@H]2C(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000117200320 1413011366 /nfs/dbraw/zinc/01/13/66/1413011366.db2.gz SRTDSMGCBIVOMC-OAHLLOKOSA-N 0 0 384.436 3.100 20 5 GGBDRN CC(C)[C@@H]1CCCCN1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000117200354 1413011541 /nfs/dbraw/zinc/01/15/41/1413011541.db2.gz CJSAESPGEUYDFQ-HNNXBMFYSA-N 0 0 375.425 3.320 20 5 GGBDRN CS[C@H]1CCC[C@@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000117224012 1413014303 /nfs/dbraw/zinc/01/43/03/1413014303.db2.gz AQNWUVJWZBWHGK-OCCSQVGLSA-N 0 0 393.465 3.073 20 5 GGBDRN COc1ccccc1C(C)(C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000117252257 1413019410 /nfs/dbraw/zinc/01/94/10/1413019410.db2.gz WBTYZWZXTAVXBR-UHFFFAOYSA-N 0 0 381.388 3.110 20 5 GGBDRN COc1ccccc1CC(C)(C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000117253557 1413019520 /nfs/dbraw/zinc/01/95/20/1413019520.db2.gz TZQOBPGKLQJIHU-UHFFFAOYSA-N 0 0 395.415 3.196 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)Cc1ccccc1 ZINC000117297396 1413023249 /nfs/dbraw/zinc/02/32/49/1413023249.db2.gz KGTSGDWHTNQKGL-OAHLLOKOSA-N 0 0 383.448 3.098 20 5 GGBDRN COC(=O)NCc1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 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ZINC000117978730 1413093897 /nfs/dbraw/zinc/09/38/97/1413093897.db2.gz ULJHXGBHJSRMIY-UHFFFAOYSA-N 0 0 375.450 3.305 20 5 GGBDRN C[C@@H](CO)NC(=O)NCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1 ZINC000118090484 1413106419 /nfs/dbraw/zinc/10/64/19/1413106419.db2.gz HTKIWKIBUUFGDS-JTQLQIEISA-N 0 0 397.790 3.360 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@@H]2c2cccc(N(C)C)c2)cccc1[N+](=O)[O-] ZINC000118135543 1413115539 /nfs/dbraw/zinc/11/55/39/1413115539.db2.gz YEBLKVYKPVSQHK-LJQANCHMSA-N 0 0 396.447 3.271 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cnn(CC(F)(F)F)c1 ZINC000118235069 1413131433 /nfs/dbraw/zinc/13/14/33/1413131433.db2.gz JNFDSGUOADWWDL-QMMMGPOBSA-N 0 0 392.721 3.413 20 5 GGBDRN O=C(Nc1cc(-c2ccco2)nn1-c1cccc([N+](=O)[O-])c1)c1cnsn1 ZINC000118249874 1413136219 /nfs/dbraw/zinc/13/62/19/1413136219.db2.gz LGQZIULNGXPDMN-UHFFFAOYSA-N 0 0 382.361 3.144 20 5 GGBDRN O=C(Nc1cc(-c2ccco2)nn1-c1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000118249845 1413136389 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/nfs/dbraw/zinc/14/43/30/1413144330.db2.gz AYLMMFCEKGQTAJ-UHFFFAOYSA-N 0 0 382.760 3.274 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)CCNC(=O)Cc1ccccc1 ZINC000118295795 1413144686 /nfs/dbraw/zinc/14/46/86/1413144686.db2.gz FOVGXJNAHLYHOH-UHFFFAOYSA-N 0 0 376.796 3.211 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCNC(=O)N1CCc2ccccc2C1 ZINC000118303889 1413146204 /nfs/dbraw/zinc/14/62/04/1413146204.db2.gz VKWCSWIQOMJCOW-UHFFFAOYSA-N 0 0 396.447 3.308 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000118366354 1413156307 /nfs/dbraw/zinc/15/63/07/1413156307.db2.gz TVPLTQZKOPTNAK-KZULUSFZSA-N 0 0 387.436 3.007 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(Nc2cnn(CC(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000118384297 1413157569 /nfs/dbraw/zinc/15/75/69/1413157569.db2.gz LAASAIDSCQFXLJ-UHFFFAOYSA-N 0 0 394.313 3.062 20 5 GGBDRN COc1ccc2[nH]cc(CCNc3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])c2c1 ZINC000118412281 1413159706 /nfs/dbraw/zinc/15/97/06/1413159706.db2.gz 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ZINC000118634662 1413199936 /nfs/dbraw/zinc/19/99/36/1413199936.db2.gz CWCXOQKBVGQUNS-UHFFFAOYSA-N 0 0 396.860 3.389 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 ZINC000118634692 1413199948 /nfs/dbraw/zinc/19/99/48/1413199948.db2.gz XJPKTGSNZPZUKV-NSHDSACASA-N 0 0 377.784 3.137 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)Cn1nc(-c2ccccc2)ccc1=O ZINC000118634736 1413199968 /nfs/dbraw/zinc/19/99/68/1413199968.db2.gz LQWSIIZAYFGLDY-UHFFFAOYSA-N 0 0 398.806 3.419 20 5 GGBDRN Cn1c(CCCNC(=O)CSc2ccc([N+](=O)[O-])cc2)nc2ccccc21 ZINC000118659459 1413201859 /nfs/dbraw/zinc/20/18/59/1413201859.db2.gz VLXJGWXTRQCJCT-UHFFFAOYSA-N 0 0 384.461 3.323 20 5 GGBDRN Cc1ccc(C)c(SCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689167 1413204880 /nfs/dbraw/zinc/20/48/80/1413204880.db2.gz UARUJRJPCQZPKH-OAHLLOKOSA-N 0 0 386.477 3.412 20 5 GGBDRN O=C(c1cc(-c2ccccc2F)on1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689335 1413204897 /nfs/dbraw/zinc/20/48/97/1413204897.db2.gz 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O=C(Cc1c(F)cccc1Cl)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690740 1413206365 /nfs/dbraw/zinc/20/63/65/1413206365.db2.gz XWASUFCPSRLOPS-LLVKDONJSA-N 0 0 378.791 3.038 20 5 GGBDRN O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690900 1413206415 /nfs/dbraw/zinc/20/64/15/1413206415.db2.gz NRJTWJISGAHMDO-BNOWGMLFSA-N 0 0 386.374 3.371 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690754 1413206423 /nfs/dbraw/zinc/20/64/23/1413206423.db2.gz FTBCIYPKKJOOEL-GXTWGEPZSA-N 0 0 390.827 3.124 20 5 GGBDRN Cc1ccccc1OCCCC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690846 1413206476 /nfs/dbraw/zinc/20/64/76/1413206476.db2.gz IAYFVLVDUWXMKV-MRXNPFEDSA-N 0 0 384.436 3.170 20 5 GGBDRN Cc1ccc(-c2nc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cs2)o1 ZINC000118691169 1413206944 /nfs/dbraw/zinc/20/69/44/1413206944.db2.gz TZTGHGKZFKOUMK-LBPRGKRZSA-N 0 0 399.432 3.341 20 5 GGBDRN 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/nfs/dbraw/zinc/25/37/90/1413253790.db2.gz NANOSTXASNISCI-OAHLLOKOSA-N 0 0 395.419 3.340 20 5 GGBDRN COc1ccc(NC(=O)CN2CCC[C@@H]2c2cccc(N(C)C)c2)c([N+](=O)[O-])c1 ZINC000118867276 1413254072 /nfs/dbraw/zinc/25/40/72/1413254072.db2.gz KBKAFQZOAHRKQF-LJQANCHMSA-N 0 0 398.463 3.445 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000118867524 1413255378 /nfs/dbraw/zinc/25/53/78/1413255378.db2.gz BGVAORNXAPRQRL-IBGZPJMESA-N 0 0 398.463 3.445 20 5 GGBDRN CC[C@H](CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)Oc1ccccc1Cl ZINC000177383170 1428713124 /nfs/dbraw/zinc/71/31/24/1428713124.db2.gz QQIPPZXURDHPQH-CQSZACIVSA-N 0 0 394.859 3.425 20 5 GGBDRN Cc1cc(COC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2ccccc2n1 ZINC000118900363 1413264579 /nfs/dbraw/zinc/26/45/79/1413264579.db2.gz BXYHVHGLRSFWJG-UHFFFAOYSA-N 0 0 389.371 3.389 20 5 GGBDRN CC(C)(CC(=O)OCCNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000118907425 1413265704 /nfs/dbraw/zinc/26/57/04/1413265704.db2.gz JXAJNBBQIIUIBW-UHFFFAOYSA-N 0 0 385.420 3.017 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)c2csc3ccccc23)c([N+](=O)[O-])c1 ZINC000118907516 1413266015 /nfs/dbraw/zinc/26/60/15/1413266015.db2.gz UCHBYHKVIITJJU-UHFFFAOYSA-N 0 0 385.401 3.177 20 5 GGBDRN Cc1c(CC(=O)N2CCN(C(=O)CC3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000118968633 1413280683 /nfs/dbraw/zinc/28/06/83/1413280683.db2.gz CATFFUWWMUCDEE-UHFFFAOYSA-N 0 0 387.480 3.087 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2)c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000118989414 1413292886 /nfs/dbraw/zinc/29/28/86/1413292886.db2.gz SDFOVENWZALZEW-UHFFFAOYSA-N 0 0 392.419 3.135 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCc2c(F)cc(F)cc2C1 ZINC000119002496 1413300504 /nfs/dbraw/zinc/30/05/04/1413300504.db2.gz KPQMEYSNVOWIFW-UHFFFAOYSA-N 0 0 398.369 3.113 20 5 GGBDRN C[C@@H]1C[C@@H](N(C)C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000119022873 1413307891 /nfs/dbraw/zinc/30/78/91/1413307891.db2.gz NNNDTNDXFIEOQO-QAPCUYQASA-N 0 0 383.448 3.426 20 5 GGBDRN 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ZINC000119088639 1413331945 /nfs/dbraw/zinc/33/19/45/1413331945.db2.gz FWFLSCSFIDBCCM-SFHVURJKSA-N 0 0 399.472 3.294 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000119102814 1413337518 /nfs/dbraw/zinc/33/75/18/1413337518.db2.gz PCJZTCXUYTZWJH-QGZVFWFLSA-N 0 0 387.823 3.103 20 5 GGBDRN Cc1nc(N2CCOCC2)ccc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000119107946 1413339440 /nfs/dbraw/zinc/33/94/40/1413339440.db2.gz GFQRZBUYTMNHIV-ZDUSSCGKSA-N 0 0 385.424 3.018 20 5 GGBDRN Cc1nc(CC(C)C)c(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000119138246 1413352179 /nfs/dbraw/zinc/35/21/79/1413352179.db2.gz BWLJAJXZLXJZSV-CYBMUJFWSA-N 0 0 389.481 3.280 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(N)=O)[C@H](C)c1ccccc1 ZINC000119141207 1413353563 /nfs/dbraw/zinc/35/35/63/1413353563.db2.gz XJIIJOCFYQVPCA-ZIAGYGMSSA-N 0 0 387.461 3.151 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(N2CCCC2)c1 ZINC000119150488 1413355906 /nfs/dbraw/zinc/35/59/06/1413355906.db2.gz IIORSGWTQZDZRH-ZDUSSCGKSA-N 0 0 393.440 3.374 20 5 GGBDRN Cc1c(CC(=O)N[C@H](c2nc(-c3cccnc3)no2)C(C)C)cccc1[N+](=O)[O-] ZINC000119162110 1413360691 /nfs/dbraw/zinc/36/06/91/1413360691.db2.gz MAUMVABDVWKMGZ-SFHVURJKSA-N 0 0 395.419 3.404 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCN(c2cc(F)ccc2F)CC1 ZINC000119162469 1413361116 /nfs/dbraw/zinc/36/11/16/1413361116.db2.gz HXNIUBPBZJGEQW-UHFFFAOYSA-N 0 0 375.375 3.154 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000119178998 1413367220 /nfs/dbraw/zinc/36/72/20/1413367220.db2.gz KOFNPZXPZWDTBJ-UHFFFAOYSA-N 0 0 384.436 3.375 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2ccccc21 ZINC000119186467 1413369441 /nfs/dbraw/zinc/36/94/41/1413369441.db2.gz DXJFIKGMIJSUKE-MRXNPFEDSA-N 0 0 377.404 3.328 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1nc(C(F)(F)F)cs1 ZINC000119210253 1413376310 /nfs/dbraw/zinc/37/63/10/1413376310.db2.gz CBIYSAZMDFURBA-UHFFFAOYSA-N 0 0 382.323 3.342 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1[N+](=O)[O-] ZINC000119226226 1413381767 /nfs/dbraw/zinc/38/17/67/1413381767.db2.gz XPHYTHIOVKIESD-HZPDHXFCSA-N 0 0 388.424 3.205 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000119228292 1413382290 /nfs/dbraw/zinc/38/22/90/1413382290.db2.gz JJTAMQFYEFQIMN-KBPBESRZSA-N 0 0 394.435 3.387 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCCc2c(F)ccc(F)c21 ZINC000119264811 1413393989 /nfs/dbraw/zinc/39/39/89/1413393989.db2.gz VPHCNYBSQPTIGI-UHFFFAOYSA-N 0 0 385.330 3.047 20 5 GGBDRN CCC(=O)c1cccc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000119272101 1413395687 /nfs/dbraw/zinc/39/56/87/1413395687.db2.gz UUKLQQSCDZYDOY-UHFFFAOYSA-N 0 0 376.434 3.401 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)Oc2ccc3c(C)cc(=O)oc3c2)c1C ZINC000119270870 1413395907 /nfs/dbraw/zinc/39/59/07/1413395907.db2.gz SKCQVEONHSEEBH-UHFFFAOYSA-N 0 0 389.385 3.394 20 5 GGBDRN O=C(Nc1cccc(CN2CCOCC2)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119288748 1413399931 /nfs/dbraw/zinc/39/99/31/1413399931.db2.gz LOAKKFPWGCIKFU-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2c[nH]nc2-c2ccccc2F)cc([N+](=O)[O-])c1 ZINC000119288530 1413400105 /nfs/dbraw/zinc/40/01/05/1413400105.db2.gz FEQNXIANRAQSOQ-UHFFFAOYSA-N 0 0 384.323 3.163 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3ccn(-c4c(F)cccc4F)n3)n2)c1 ZINC000119288894 1413400123 /nfs/dbraw/zinc/40/01/23/1413400123.db2.gz FBFVGDXGBKLVFS-UHFFFAOYSA-N 0 0 382.330 3.366 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)s1 ZINC000119288967 1413400574 /nfs/dbraw/zinc/40/05/74/1413400574.db2.gz QFGBWWLJLSRWBB-LLVKDONJSA-N 0 0 390.465 3.315 20 5 GGBDRN COC(=O)[C@@H](C)[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000177413037 1428725529 /nfs/dbraw/zinc/72/55/29/1428725529.db2.gz RKDFAEBAERJVKH-UGSOOPFHSA-N 0 0 396.403 3.285 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC1CCN(c2cccs2)CC1 ZINC000119316689 1413409691 /nfs/dbraw/zinc/40/96/91/1413409691.db2.gz JJPMYLHDMKMCTI-UHFFFAOYSA-N 0 0 395.506 3.220 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1CCN(c2cccs2)CC1 ZINC000119320488 1413410895 /nfs/dbraw/zinc/41/08/95/1413410895.db2.gz DUYWTHMXZVKAKB-UHFFFAOYSA-N 0 0 395.506 3.166 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccccc2C(N)=O)cc1[N+](=O)[O-] ZINC000119327568 1413413067 /nfs/dbraw/zinc/41/30/67/1413413067.db2.gz BYLUXZTUZQQRLC-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCN(c2ccccc2O)CC1 ZINC000119328723 1413413628 /nfs/dbraw/zinc/41/36/28/1413413628.db2.gz MAKJCXUZWUVXAD-UHFFFAOYSA-N 0 0 395.337 3.282 20 5 GGBDRN C[C@H](N1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1)C(F)(F)F ZINC000119331287 1413414269 /nfs/dbraw/zinc/41/42/69/1413414269.db2.gz HGCOTMFQKDVZJO-LBPRGKRZSA-N 0 0 384.358 3.318 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119336183 1413415734 /nfs/dbraw/zinc/41/57/34/1413415734.db2.gz CBCVYOCGZAHEPB-UHFFFAOYSA-N 0 0 397.478 3.004 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)cccc1[N+](=O)[O-] ZINC000119360284 1413423477 /nfs/dbraw/zinc/42/34/77/1413423477.db2.gz QRMXOOZRFKPKSM-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN CN(Cc1ccccc1N1CCCC1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119371179 1413427503 /nfs/dbraw/zinc/42/75/03/1413427503.db2.gz XVOLDBHFZVHJGU-UHFFFAOYSA-N 0 0 381.479 3.077 20 5 GGBDRN COc1ccc2cc(CNS(=O)(=O)c3csc([N+](=O)[O-])c3)ccc2c1 ZINC000119382161 1413430344 /nfs/dbraw/zinc/43/03/44/1413430344.db2.gz GTMQLCIPNVILDE-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN CCc1cc2c(C)cc(=O)oc2cc1OS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119385932 1413431412 /nfs/dbraw/zinc/43/14/12/1413431412.db2.gz KPDJGWHXADGTDN-UHFFFAOYSA-N 0 0 395.414 3.401 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCC(OC[C@@H]4CCCO4)CC3)co2)cc1 ZINC000119394706 1413433314 /nfs/dbraw/zinc/43/33/14/1413433314.db2.gz UEXLYUBYJDBMDU-IBGZPJMESA-N 0 0 387.436 3.410 20 5 GGBDRN Cc1ccnc(N2CCN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)c1 ZINC000119455673 1413453165 /nfs/dbraw/zinc/45/31/65/1413453165.db2.gz UPECDCOZWDOYNN-UHFFFAOYSA-N 0 0 379.420 3.275 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1 ZINC000119469706 1413457742 /nfs/dbraw/zinc/45/77/42/1413457742.db2.gz UPKUVLCOEYXMQC-UHFFFAOYSA-N 0 0 388.330 3.438 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc2c1C(=O)NC2 ZINC000119490948 1413464589 /nfs/dbraw/zinc/46/45/89/1413464589.db2.gz INCDVAUIJCJTRO-UHFFFAOYSA-N 0 0 383.407 3.037 20 5 GGBDRN Cc1nn(C)c(Oc2cccnc2)c1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000119498454 1413466511 /nfs/dbraw/zinc/46/65/11/1413466511.db2.gz MTQCSFXGHZWENZ-UHFFFAOYSA-N 0 0 381.392 3.314 20 5 GGBDRN COc1cccc(COCCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000119508757 1413470519 /nfs/dbraw/zinc/47/05/19/1413470519.db2.gz PDZDPJNPIMAROG-UHFFFAOYSA-N 0 0 385.420 3.124 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000119516224 1413472718 /nfs/dbraw/zinc/47/27/18/1413472718.db2.gz XUFJWEGOEIHQPQ-CQSZACIVSA-N 0 0 395.390 3.280 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000119520251 1413474066 /nfs/dbraw/zinc/47/40/66/1413474066.db2.gz GONBLZCUCXWTPO-IBGZPJMESA-N 0 0 398.394 3.210 20 5 GGBDRN CN(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 ZINC000119527305 1413476167 /nfs/dbraw/zinc/47/61/67/1413476167.db2.gz ROSJIEFBKKQNCN-UHFFFAOYSA-N 0 0 380.389 3.062 20 5 GGBDRN O=C(C[C@H]1COCCN1CCCOc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000119528628 1413476543 /nfs/dbraw/zinc/47/65/43/1413476543.db2.gz DRVNBRRJDQTDKM-INIZCTEOSA-N 0 0 390.461 3.399 20 5 GGBDRN COc1ccc(CN2CCOC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000119529643 1413476668 /nfs/dbraw/zinc/47/66/68/1413476668.db2.gz NFACTCUNDVLRFO-AWEZNQCLSA-N 0 0 376.434 3.139 20 5 GGBDRN Cc1c(CC(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)cccc1[N+](=O)[O-] ZINC000119546250 1413481638 /nfs/dbraw/zinc/48/16/38/1413481638.db2.gz XUIYUEJSMRUGFA-SFHVURJKSA-N 0 0 376.359 3.324 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)NCc2cccc(OCC(F)(F)F)c2)cs1 ZINC000119578501 1413492017 /nfs/dbraw/zinc/49/20/17/1413492017.db2.gz KSRGERRIPMKGSI-UHFFFAOYSA-N 0 0 396.368 3.076 20 5 GGBDRN CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H](c1cccnc1)c1ccc(F)c(C)c1 ZINC000119593354 1413497387 /nfs/dbraw/zinc/49/73/87/1413497387.db2.gz ZOJQANIPHDWYKG-SFHVURJKSA-N 0 0 397.410 3.423 20 5 GGBDRN CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 ZINC000119593479 1413497472 /nfs/dbraw/zinc/49/74/72/1413497472.db2.gz ZOJQANIPHDWYKG-GOSISDBHSA-N 0 0 397.410 3.423 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)cs1 ZINC000119635034 1413510327 /nfs/dbraw/zinc/51/03/27/1413510327.db2.gz MMJDNBCADLUVKF-AWEZNQCLSA-N 0 0 382.463 3.026 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000119633388 1413510428 /nfs/dbraw/zinc/51/04/28/1413510428.db2.gz CZDBKJHSEKSVAR-BLLLJJGKSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000119633269 1413510467 /nfs/dbraw/zinc/51/04/67/1413510467.db2.gz CZDBKJHSEKSVAR-MLGOLLRUSA-N 0 0 396.852 3.399 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCc2ncc(-c3ccccc3)o2)c1C ZINC000119644446 1413513720 /nfs/dbraw/zinc/51/37/20/1413513720.db2.gz MMDDRGCKCYRJOS-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000119682153 1413529910 /nfs/dbraw/zinc/52/99/10/1413529910.db2.gz VIBZCYSCXNKYFX-CJNGLKHVSA-N 0 0 386.379 3.330 20 5 GGBDRN Cc1ccc(-c2nc(CCNS(=O)(=O)c3csc([N+](=O)[O-])c3)co2)cc1 ZINC000119690527 1413532257 /nfs/dbraw/zinc/53/22/57/1413532257.db2.gz JMAWMEUAZRUWJD-UHFFFAOYSA-N 0 0 393.446 3.141 20 5 GGBDRN O=C(CN[C@H](c1ccccc1)c1ccccn1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000119692765 1413533824 /nfs/dbraw/zinc/53/38/24/1413533824.db2.gz ODCJPGFGTQFLFF-JOCHJYFZSA-N 0 0 388.427 3.258 20 5 GGBDRN CN(CC(=O)NC[C@H](O)c1cc2ccccc2s1)c1ccccc1[N+](=O)[O-] ZINC000119709427 1413540963 /nfs/dbraw/zinc/54/09/63/1413540963.db2.gz JSQQVQNFKKILRF-INIZCTEOSA-N 0 0 385.445 3.096 20 5 GGBDRN CN(CC(=O)NC[C@@H](O)c1cc2ccccc2s1)c1ccccc1[N+](=O)[O-] ZINC000119709589 1413541172 /nfs/dbraw/zinc/54/11/72/1413541172.db2.gz JSQQVQNFKKILRF-MRXNPFEDSA-N 0 0 385.445 3.096 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(S(=O)(=O)C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000119709843 1413541196 /nfs/dbraw/zinc/54/11/96/1413541196.db2.gz FGVZEAILGLCIKI-UHFFFAOYSA-N 0 0 388.323 3.449 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000119715654 1413542299 /nfs/dbraw/zinc/54/22/99/1413542299.db2.gz YOSNLQJVIFPCHC-ZDUSSCGKSA-N 0 0 386.799 3.339 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000119715800 1413542327 /nfs/dbraw/zinc/54/23/27/1413542327.db2.gz YOSNLQJVIFPCHC-CYBMUJFWSA-N 0 0 386.799 3.339 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000119751163 1413554708 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384.504 3.444 20 5 GGBDRN CC[C@@H](OC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000119778208 1413565462 /nfs/dbraw/zinc/56/54/62/1413565462.db2.gz IJWFQYGMEOPQQF-GOSISDBHSA-N 0 0 382.376 3.492 20 5 GGBDRN O=C(Cc1nc2cc3ccccc3cc2c(=O)[nH]1)Nc1ccc2c(c1)OCCO2 ZINC000119779844 1413566036 /nfs/dbraw/zinc/56/60/36/1413566036.db2.gz GHNLWQYEZWAFTM-UHFFFAOYSA-N 0 0 387.395 3.029 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119785221 1413568359 /nfs/dbraw/zinc/56/83/59/1413568359.db2.gz DZCAFGLWTRMRPV-UHFFFAOYSA-N 0 0 378.771 3.294 20 5 GGBDRN C[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 ZINC000119788235 1413569476 /nfs/dbraw/zinc/56/94/76/1413569476.db2.gz URIIZQZHODHAKL-MRXNPFEDSA-N 0 0 397.475 3.165 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCCc2cc(F)ccc21 ZINC000119790388 1413570006 /nfs/dbraw/zinc/57/00/06/1413570006.db2.gz LRJSVZJMGMCUPJ-XIKOKIGWSA-N 0 0 385.395 3.046 20 5 GGBDRN 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CCC[C@H]1CN(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)CCO1 ZINC000119944969 1413627205 /nfs/dbraw/zinc/62/72/05/1413627205.db2.gz AGSICFSGUGMTPH-SFHVURJKSA-N 0 0 386.452 3.098 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(=O)n(-c2ccccc2F)n1 ZINC000119954444 1413630795 /nfs/dbraw/zinc/63/07/95/1413630795.db2.gz XITUNCNWHZUDQD-UHFFFAOYSA-N 0 0 382.351 3.149 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1S(C)(=O)=O ZINC000119956215 1413631759 /nfs/dbraw/zinc/63/17/59/1413631759.db2.gz CTGIIFQTSLVVQR-UHFFFAOYSA-N 0 0 376.434 3.430 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCC[C@H]1Cc1ccccc1 ZINC000119960470 1413632903 /nfs/dbraw/zinc/63/29/03/1413632903.db2.gz PFDRRHWIUWVEQF-AWEZNQCLSA-N 0 0 387.823 3.420 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1cc(Cl)ncc1Cl ZINC000119963841 1413634546 /nfs/dbraw/zinc/63/45/46/1413634546.db2.gz GUYYMLWIHNCUMJ-UHFFFAOYSA-N 0 0 379.163 3.334 20 5 GGBDRN CN(CC(=O)Nc1cc(F)cc(F)c1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119983831 1413641742 /nfs/dbraw/zinc/64/17/42/1413641742.db2.gz OJWQFFYJKQFKKG-UHFFFAOYSA-N 0 0 383.738 3.237 20 5 GGBDRN CCOC(=O)c1ccnc(N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1[N+](=O)[O-] ZINC000119992272 1413645103 /nfs/dbraw/zinc/64/51/03/1413645103.db2.gz AXLYDUHULLTXFS-UHFFFAOYSA-N 0 0 386.364 3.244 20 5 GGBDRN CCOc1cc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)ccc1OC ZINC000120007390 1413650865 /nfs/dbraw/zinc/65/08/65/1413650865.db2.gz RAYKMICCVXUIJF-UHFFFAOYSA-N 0 0 385.420 3.270 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H](Nc1ccccc1)C(C)C ZINC000120012775 1413652993 /nfs/dbraw/zinc/65/29/93/1413652993.db2.gz WDMPPDYUGFBQLS-GOSISDBHSA-N 0 0 384.436 3.095 20 5 GGBDRN COc1cccc(Br)c1OS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000120015934 1413654170 /nfs/dbraw/zinc/65/41/70/1413654170.db2.gz APWCJRXWTPPAPT-UHFFFAOYSA-N 0 0 394.224 3.195 20 5 GGBDRN Cc1ccccc1OCCN(C)c1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000120022556 1413656882 /nfs/dbraw/zinc/65/68/82/1413656882.db2.gz AZIUJVURNLFPQC-UHFFFAOYSA-N 0 0 375.381 3.127 20 5 GGBDRN Cc1cccc(OCCN(C)c2c([N+](=O)[O-])cc(CO)c(C)c2[N+](=O)[O-])c1 ZINC000120022680 1413656982 /nfs/dbraw/zinc/65/69/82/1413656982.db2.gz JDUBTZAVORBOGU-UHFFFAOYSA-N 0 0 375.381 3.127 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C[S@@](C)=O)c1ccccc1 ZINC000120031449 1413661214 /nfs/dbraw/zinc/66/12/14/1413661214.db2.gz SBBHGETURFLOCN-DXPJPUQTSA-N 0 0 375.450 3.453 20 5 GGBDRN Cc1c(CC(=O)N[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000120042340 1413665241 /nfs/dbraw/zinc/66/52/41/1413665241.db2.gz BEKNBBRDDWSCCJ-CVEARBPZSA-N 0 0 391.468 3.398 20 5 GGBDRN Cc1c(CC(=O)N[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000120042500 1413665266 /nfs/dbraw/zinc/66/52/66/1413665266.db2.gz BEKNBBRDDWSCCJ-HOTGVXAUSA-N 0 0 391.468 3.398 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](Cc2nccn2C)C1 ZINC000120046056 1413666598 /nfs/dbraw/zinc/66/65/98/1413666598.db2.gz HASVRFDGKUAFMR-LSDHHAIUSA-N 0 0 388.493 3.290 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)c3cccc(C)c3)CC2)cc1[N+](=O)[O-] ZINC000120064168 1413672925 /nfs/dbraw/zinc/67/29/25/1413672925.db2.gz OLWDPRKIQKYKGK-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000120076741 1413677802 /nfs/dbraw/zinc/67/78/02/1413677802.db2.gz PWLPTTCHNDXDBT-GOSISDBHSA-N 0 0 399.447 3.041 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000120077954 1413678395 /nfs/dbraw/zinc/67/83/95/1413678395.db2.gz UFYHDFHONWLCRI-LSDHHAIUSA-N 0 0 377.441 3.089 20 5 GGBDRN Cc1cc(C(=O)Nc2cc(-n3nnnc3C3CC3)ccc2F)ccc1[N+](=O)[O-] ZINC000120083294 1413680922 /nfs/dbraw/zinc/68/09/22/1413680922.db2.gz MBWXPEOGFDVUEP-UHFFFAOYSA-N 0 0 382.355 3.148 20 5 GGBDRN C[C@](O)(CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000120094201 1413685151 /nfs/dbraw/zinc/68/51/51/1413685151.db2.gz MTQYLHYDXXLSLO-FQEVSTJZSA-N 0 0 389.427 3.264 20 5 GGBDRN Cc1cccc(O[C@@H]2CCCC[C@@H]2NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000120100050 1413687505 /nfs/dbraw/zinc/68/75/05/1413687505.db2.gz RVPSOSLHALIGTE-RBUKOAKNSA-N 0 0 397.431 3.348 20 5 GGBDRN Cc1cccc(O[C@H]2CCCC[C@H]2NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000120100551 1413687962 /nfs/dbraw/zinc/68/79/62/1413687962.db2.gz RVPSOSLHALIGTE-MOPGFXCFSA-N 0 0 397.431 3.348 20 5 GGBDRN CCOC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1 ZINC000120109750 1413691198 /nfs/dbraw/zinc/69/11/98/1413691198.db2.gz WRKKNCVVHUNCGU-UHFFFAOYSA-N 0 0 389.452 3.000 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000120119061 1413694881 /nfs/dbraw/zinc/69/48/81/1413694881.db2.gz LIYQRCFQMNHGBU-BBWFWOEESA-N 0 0 390.484 3.317 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1 ZINC000120136877 1413702888 /nfs/dbraw/zinc/70/28/88/1413702888.db2.gz PNIUDTGQBBREIU-OAHLLOKOSA-N 0 0 399.451 3.153 20 5 GGBDRN 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NFVBOMPHLVKRBC-KRWDZBQOSA-N 0 0 382.338 3.094 20 5 GGBDRN O=C([C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CC[C@@H](c2ccccc2)C1 ZINC000121599218 1414193779 /nfs/dbraw/zinc/19/37/79/1414193779.db2.gz DVNIHGQAEWWWOY-HZPDHXFCSA-N 0 0 397.406 3.103 20 5 GGBDRN O=C([C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CC[C@H](c2ccccc2)C1 ZINC000121599624 1414194532 /nfs/dbraw/zinc/19/45/32/1414194532.db2.gz DVNIHGQAEWWWOY-HOTGVXAUSA-N 0 0 397.406 3.103 20 5 GGBDRN Cc1cccc2c(CCNC(=O)C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)c[nH]c21 ZINC000121599576 1414194635 /nfs/dbraw/zinc/19/46/35/1414194635.db2.gz NKGKRRBJTBBTOZ-UHFFFAOYSA-N 0 0 394.431 3.299 20 5 GGBDRN CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)ccc1F ZINC000121604828 1414196519 /nfs/dbraw/zinc/19/65/19/1414196519.db2.gz IYPBSWNCCIFDQA-UHFFFAOYSA-N 0 0 376.300 3.161 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc(Nc2cnn(C)c2)c1 ZINC000121609628 1414198957 /nfs/dbraw/zinc/19/89/57/1414198957.db2.gz QDTOJDQGCJPHED-UHFFFAOYSA-N 0 0 381.392 3.011 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CCO1 ZINC000121611669 1414200198 /nfs/dbraw/zinc/20/01/98/1414200198.db2.gz GQZHIKQFCBFZKY-SFHVURJKSA-N 0 0 397.431 3.059 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)OC[C@@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000121616445 1414201599 /nfs/dbraw/zinc/20/15/99/1414201599.db2.gz DJBSCAJNXXMGDX-GOSISDBHSA-N 0 0 382.416 3.119 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C2CC2)s1 ZINC000121627238 1414205461 /nfs/dbraw/zinc/20/54/61/1414205461.db2.gz XFSUZNFGIXSTLV-HNNXBMFYSA-N 0 0 388.449 3.183 20 5 GGBDRN CC(=O)Nc1ccc(CCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000121637455 1414208540 /nfs/dbraw/zinc/20/85/40/1414208540.db2.gz FOPLQPRGSMOSRX-UHFFFAOYSA-N 0 0 396.447 3.470 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2cccc(O)c2)CC1 ZINC000121648317 1414211649 /nfs/dbraw/zinc/21/16/49/1414211649.db2.gz VRWDDHKRVYRGRB-CQSZACIVSA-N 0 0 387.461 3.130 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000121662161 1414216091 /nfs/dbraw/zinc/21/60/91/1414216091.db2.gz QBYGUPZBAIFNBJ-GFCCVEGCSA-N 0 0 393.469 3.253 20 5 GGBDRN O=C(NCc1ccccc1)c1nnc(COc2ccc([N+](=O)[O-])cc2F)s1 ZINC000121666027 1414216633 /nfs/dbraw/zinc/21/66/33/1414216633.db2.gz AFOAVJLFOKASKD-UHFFFAOYSA-N 0 0 388.380 3.094 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OCc1nnc(C(=O)NCc2ccccc2)s1 ZINC000121676265 1414219764 /nfs/dbraw/zinc/21/97/64/1414219764.db2.gz UUDYUWDGYJXMRY-UHFFFAOYSA-N 0 0 384.417 3.264 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C12CCCC2 ZINC000121685582 1414223153 /nfs/dbraw/zinc/22/31/53/1414223153.db2.gz QPZAHALHXFRFLA-CVEARBPZSA-N 0 0 389.452 3.004 20 5 GGBDRN CCNC(=O)COc1ccc(CNc2c(F)cc([N+](=O)[O-])cc2F)cc1OC ZINC000121686658 1414223753 /nfs/dbraw/zinc/22/37/53/1414223753.db2.gz BKXGXLQPNZJCKK-UHFFFAOYSA-N 0 0 395.362 3.009 20 5 GGBDRN CC(=O)c1ccc(OC[C@@H](O)Cn2cnc3cc4ccccc4cc3c2=O)cc1 ZINC000121688029 1414224446 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FGZPIAGJBCGGKF-OAHLLOKOSA-N 0 0 387.461 3.194 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCc2ccc(F)cc2C1 ZINC000121705432 1414230360 /nfs/dbraw/zinc/23/03/60/1414230360.db2.gz QSFSRWDHNXPRGN-UHFFFAOYSA-N 0 0 399.378 3.007 20 5 GGBDRN CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000177554533 1428791464 /nfs/dbraw/zinc/79/14/64/1428791464.db2.gz QTMQMMKKXWKBTO-HNNXBMFYSA-N 0 0 385.420 3.070 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCCN(C)c2ccc(F)cc21 ZINC000121724350 1414237115 /nfs/dbraw/zinc/23/71/15/1414237115.db2.gz VIEYTLFQZIBAPR-UHFFFAOYSA-N 0 0 379.413 3.078 20 5 GGBDRN COc1ccc(-c2n[nH]c(=S)n2CC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000121725292 1414237123 /nfs/dbraw/zinc/23/71/23/1414237123.db2.gz KJTXRZQATAOHEB-UHFFFAOYSA-N 0 0 399.432 3.472 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCCN(C)c3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000121728698 1414238677 /nfs/dbraw/zinc/23/86/77/1414238677.db2.gz OPKDZWXMPJOOQW-UHFFFAOYSA-N 0 0 379.413 3.078 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)c2)n1 ZINC000121732319 1414239907 /nfs/dbraw/zinc/23/99/07/1414239907.db2.gz GLMCXGUBZUSJHN-UHFFFAOYSA-N 0 0 392.415 3.479 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000121737128 1414241342 /nfs/dbraw/zinc/24/13/42/1414241342.db2.gz PRSUYXIKGPDQSZ-RYUDHWBXSA-N 0 0 393.469 3.251 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCCN(C)c2ccc(F)cc21 ZINC000121737169 1414241403 /nfs/dbraw/zinc/24/14/03/1414241403.db2.gz CLBRGULFZGIJLP-UHFFFAOYSA-N 0 0 379.413 3.078 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(OCc2ccccc2F)CC1 ZINC000121740876 1414242966 /nfs/dbraw/zinc/24/29/66/1414242966.db2.gz YWBIMTFFAYJKOR-UHFFFAOYSA-N 0 0 387.411 3.279 20 5 GGBDRN CN(Cc1nccn1C(F)F)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000121748666 1414244802 /nfs/dbraw/zinc/24/48/02/1414244802.db2.gz JBGTUJADHRNHSB-UHFFFAOYSA-N 0 0 393.394 3.449 20 5 GGBDRN CCS[C@H]1CCC[C@@H](NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000121748099 1414244838 /nfs/dbraw/zinc/24/48/38/1414244838.db2.gz XDBLOBDKPDTTIA-KGLIPLIRSA-N 0 0 379.482 3.331 20 5 GGBDRN COC(=O)C1CCC(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000121751121 1414246309 /nfs/dbraw/zinc/24/63/09/1414246309.db2.gz SFROECZWSDUGDM-UHFFFAOYSA-N 0 0 375.425 3.001 20 5 GGBDRN CO[C@@H](CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1Cl ZINC000121755663 1414247416 /nfs/dbraw/zinc/24/74/16/1414247416.db2.gz KUSRTVKBAWMOCM-INIZCTEOSA-N 0 0 382.775 3.270 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])c2)n1 ZINC000121772542 1414252413 /nfs/dbraw/zinc/25/24/13/1414252413.db2.gz GLMGDLPIUFGMES-UHFFFAOYSA-N 0 0 382.351 3.299 20 5 GGBDRN O=C(Nc1ccc2[nH]c(=S)[nH]c2c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000121774623 1414252802 /nfs/dbraw/zinc/25/28/02/1414252802.db2.gz PGLCNZSBADWCBT-UHFFFAOYSA-N 0 0 380.389 3.198 20 5 GGBDRN COC1CCC(CC(=O)OCC2CCN(c3ncccc3[N+](=O)[O-])CC2)CC1 ZINC000121784102 1414255349 /nfs/dbraw/zinc/25/53/49/1414255349.db2.gz JAIZVXSYZBCCNZ-UHFFFAOYSA-N 0 0 391.468 3.345 20 5 GGBDRN O=C(C[C@@H]1CCCN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000121783064 1414255674 /nfs/dbraw/zinc/25/56/74/1414255674.db2.gz WNPZLTXJLJXDJJ-HNNXBMFYSA-N 0 0 399.472 3.283 20 5 GGBDRN C[C@@]1(c2ccccc2)CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCO1 ZINC000121790661 1414258098 /nfs/dbraw/zinc/25/80/98/1414258098.db2.gz LQFLASNLCAMFHL-FQEVSTJZSA-N 0 0 380.404 3.392 20 5 GGBDRN CC[NH+](CC)Cc1ccccc1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000121795403 1414259955 /nfs/dbraw/zinc/25/99/55/1414259955.db2.gz UDRSPICOKPYNQW-UHFFFAOYSA-N 0 0 391.493 3.452 20 5 GGBDRN C[C@H](C(=O)N(C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1cccs1 ZINC000121799410 1414261234 /nfs/dbraw/zinc/26/12/34/1414261234.db2.gz DTDGNSGZBYGTBO-VIFPVBQESA-N 0 0 388.854 3.261 20 5 GGBDRN CN(Cc1nccn1C)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000121809347 1414264341 /nfs/dbraw/zinc/26/43/41/1414264341.db2.gz PCALVGDPPUAFLE-UHFFFAOYSA-N 0 0 379.420 3.213 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000121815259 1414266517 /nfs/dbraw/zinc/26/65/17/1414266517.db2.gz CVBHXEYDNWCKSB-UHFFFAOYSA-N 0 0 388.561 3.129 20 5 GGBDRN Cc1cc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cc([N+](=O)[O-])c1 ZINC000121819171 1414268141 /nfs/dbraw/zinc/26/81/41/1414268141.db2.gz OHUOSVYUAGEKDG-UHFFFAOYSA-N 0 0 391.430 3.169 20 5 GGBDRN COc1ccc(NC(=O)NC[C@@](C)(O)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000121820729 1414268720 /nfs/dbraw/zinc/26/87/20/1414268720.db2.gz UQYFMVBPKZBGQS-QGZVFWFLSA-N 0 0 379.800 3.286 20 5 GGBDRN C[C@@H](c1ccccc1Cl)N(C)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000121827748 1414270724 /nfs/dbraw/zinc/27/07/24/1414270724.db2.gz DWFNWRNEMXSCSN-LBPRGKRZSA-N 0 0 375.812 3.198 20 5 GGBDRN C[C@H](c1ccccc1Cl)N(C)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000121827900 1414270873 /nfs/dbraw/zinc/27/08/73/1414270873.db2.gz DWFNWRNEMXSCSN-GFCCVEGCSA-N 0 0 375.812 3.198 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN3CCOC[C@H]3C[C@@H](O)c3cccs3)nc2c1 ZINC000121831602 1414271686 /nfs/dbraw/zinc/27/16/86/1414271686.db2.gz OVJLYRMBADMQAE-UKRRQHHQSA-N 0 0 389.433 3.122 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN3CCOC[C@H]3C[C@H](O)c3cccs3)nc2c1 ZINC000121831776 1414271786 /nfs/dbraw/zinc/27/17/86/1414271786.db2.gz OVJLYRMBADMQAE-HIFRSBDPSA-N 0 0 389.433 3.122 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCSc1nnc(-c2c[nH]c3ccccc32)o1 ZINC000121832104 1414272237 /nfs/dbraw/zinc/27/22/37/1414272237.db2.gz XJCZXJMAAIRXTQ-UHFFFAOYSA-N 0 0 383.389 3.080 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN3CCOC[C@@H]3C[C@@H](O)c3cccs3)nc2c1 ZINC000121831934 1414272417 /nfs/dbraw/zinc/27/24/17/1414272417.db2.gz OVJLYRMBADMQAE-DZGCQCFKSA-N 0 0 389.433 3.122 20 5 GGBDRN Cc1cccc(Nc2nnc(SCCn3cc([N+](=O)[O-])ccc3=O)s2)c1 ZINC000121836620 1414274453 /nfs/dbraw/zinc/27/44/53/1414274453.db2.gz NMXLKAZLMDMJLU-UHFFFAOYSA-N 0 0 389.462 3.452 20 5 GGBDRN CN(C(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000121846676 1414277153 /nfs/dbraw/zinc/27/71/53/1414277153.db2.gz 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COc1cccc2c1CC[C@@H]2NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000121882582 1414289513 /nfs/dbraw/zinc/28/95/13/1414289513.db2.gz FRFYBCRFQRGMQC-INIZCTEOSA-N 0 0 378.388 3.206 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCN(c2ccc(F)cc2)CC1 ZINC000121887118 1414291592 /nfs/dbraw/zinc/29/15/92/1414291592.db2.gz MFZYUZZQJTWWDQ-UHFFFAOYSA-N 0 0 382.395 3.107 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCc2csc(-c3ccccc3)n2)c1[N+](=O)[O-] ZINC000177564558 1428796117 /nfs/dbraw/zinc/79/61/17/1428796117.db2.gz PDFOBOUIYPFUTQ-UHFFFAOYSA-N 0 0 385.449 3.366 20 5 GGBDRN CC(C)(C)C(=O)CNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000121906994 1414302091 /nfs/dbraw/zinc/30/20/91/1414302091.db2.gz LWBUUECFRDUDCW-UHFFFAOYSA-N 0 0 399.234 3.432 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(C(=O)NC3CC3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000121913359 1414305108 /nfs/dbraw/zinc/30/51/08/1414305108.db2.gz NIEFVUSUURLVEO-UHFFFAOYSA-N 0 0 398.375 3.264 20 5 GGBDRN CCOCCC1(CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CCCC1 ZINC000121928184 1414310587 /nfs/dbraw/zinc/31/05/87/1414310587.db2.gz FGWUDPXZDHAWHG-UHFFFAOYSA-N 0 0 391.468 3.253 20 5 GGBDRN CN(CC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000121932819 1414312041 /nfs/dbraw/zinc/31/20/41/1414312041.db2.gz XNRJAQSUHLOBLP-NRFANRHFSA-N 0 0 394.406 3.471 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC[C@H](c3nnc4ccccn43)C2)c1[N+](=O)[O-] ZINC000121932271 1414312314 /nfs/dbraw/zinc/31/23/14/1414312314.db2.gz WIACQMSWVVFERR-ZDUSSCGKSA-N 0 0 383.383 3.105 20 5 GGBDRN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000121940409 1414315413 /nfs/dbraw/zinc/31/54/13/1414315413.db2.gz KQAAOPUEGDMPJZ-HXUWFJFHSA-N 0 0 377.400 3.448 20 5 GGBDRN Cc1ccc(Oc2ccc(NC(=O)NCCn3cc([N+](=O)[O-])cn3)cn2)cc1 ZINC000121952195 1414321305 /nfs/dbraw/zinc/32/13/05/1414321305.db2.gz PRKYOOWPDHUPEP-UHFFFAOYSA-N 0 0 382.380 3.109 20 5 GGBDRN Cc1sc(Br)cc1S(=O)(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000121969478 1414326822 /nfs/dbraw/zinc/32/68/22/1414326822.db2.gz FJIBPZAOQDEZGN-UHFFFAOYSA-N 0 0 392.256 3.110 20 5 GGBDRN Cc1cccc([C@H]2CCCN2C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)n1 ZINC000121973074 1414328323 /nfs/dbraw/zinc/32/83/23/1414328323.db2.gz TVJUBKFYBYMJTP-QGZVFWFLSA-N 0 0 382.420 3.217 20 5 GGBDRN Cc1c(CC(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000121974801 1414329284 /nfs/dbraw/zinc/32/92/84/1414329284.db2.gz DWBQXUKHFAQNPT-FQEVSTJZSA-N 0 0 391.468 3.255 20 5 GGBDRN C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])COCc1ccccc1 ZINC000121991559 1414333959 /nfs/dbraw/zinc/33/39/59/1414333959.db2.gz XXZVDVHETMOMIN-AWEZNQCLSA-N 0 0 378.450 3.263 20 5 GGBDRN C[C@@]1(c2ccccc2)CN(CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000122002643 1414336681 /nfs/dbraw/zinc/33/66/81/1414336681.db2.gz NSWLGFVGOVFVNI-NRFANRHFSA-N 0 0 397.431 3.140 20 5 GGBDRN CCN(C(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1ccccc1S(=O)(=O)CC ZINC000177573367 1428799705 /nfs/dbraw/zinc/79/97/05/1428799705.db2.gz RFLWMXVVVLWZTL-KAMYIIQDSA-N 0 0 388.445 3.455 20 5 GGBDRN CSC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000122005686 1414338382 /nfs/dbraw/zinc/33/83/82/1414338382.db2.gz WDKKKEAVRTVKOT-OAHLLOKOSA-N 0 0 389.477 3.051 20 5 GGBDRN Cc1cccn2cc(CNC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)nc12 ZINC000122005550 1414338453 /nfs/dbraw/zinc/33/84/53/1414338453.db2.gz COYZDTJAQYTFDA-UHFFFAOYSA-N 0 0 378.310 3.500 20 5 GGBDRN CCOC(=O)C[C@H](C)CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122008478 1414339370 /nfs/dbraw/zinc/33/93/70/1414339370.db2.gz QRXLZFINDCOQPP-NSHDSACASA-N 0 0 377.422 3.037 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)cc([N+](=O)[O-])c1 ZINC000122015848 1414340516 /nfs/dbraw/zinc/34/05/16/1414340516.db2.gz WANUSAGUTAIOCM-UHFFFAOYSA-N 0 0 383.404 3.157 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](c2ccccc2)C(C)(C)C1 ZINC000122025099 1414342532 /nfs/dbraw/zinc/34/25/32/1414342532.db2.gz ZXJQISMABKLABT-HNAYVOBHSA-N 0 0 395.459 3.365 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1[N+](=O)[O-] ZINC000122027148 1414343340 /nfs/dbraw/zinc/34/33/40/1414343340.db2.gz QBVBMADWTUQZGQ-UHFFFAOYSA-N 0 0 388.311 3.088 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000122038388 1414345449 /nfs/dbraw/zinc/34/54/49/1414345449.db2.gz FIELLDKRVUHBOU-IBGZPJMESA-N 0 0 382.416 3.180 20 5 GGBDRN CCOC(=O)C[C@@H](C)CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000122059188 1414351478 /nfs/dbraw/zinc/35/14/78/1414351478.db2.gz BXGACUWPRYBAMA-LLVKDONJSA-N 0 0 377.422 3.037 20 5 GGBDRN Cc1cccc([C@@H](C)CNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000122062278 1414352796 /nfs/dbraw/zinc/35/27/96/1414352796.db2.gz ZGNDJFFOTQOGTO-LBPRGKRZSA-N 0 0 375.812 3.415 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cnn(-c2cc(C)ccc2C)c1C ZINC000122063741 1414353077 /nfs/dbraw/zinc/35/30/77/1414353077.db2.gz JIULJZFEMPLQCU-UHFFFAOYSA-N 0 0 383.408 3.068 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000122079623 1414357799 /nfs/dbraw/zinc/35/77/99/1414357799.db2.gz XXOVDINOSVBWSN-CQSZACIVSA-N 0 0 376.434 3.486 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)C2)nc1 ZINC000122087120 1414359397 /nfs/dbraw/zinc/35/93/97/1414359397.db2.gz IKZHAZXHCFKYLW-HNNXBMFYSA-N 0 0 382.420 3.098 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000122123149 1414367780 /nfs/dbraw/zinc/36/77/80/1414367780.db2.gz NNWLWGGHTWWMCK-UHFFFAOYSA-N 0 0 390.421 3.457 20 5 GGBDRN CC(C)c1ccc(C(=O)OCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000122124629 1414368997 /nfs/dbraw/zinc/36/89/97/1414368997.db2.gz BNVNCOKIRFGFDE-UHFFFAOYSA-N 0 0 391.811 3.353 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000122174395 1414379760 /nfs/dbraw/zinc/37/97/60/1414379760.db2.gz ABJLKVIBZJRQFQ-CQSZACIVSA-N 0 0 392.843 3.071 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@H](COc2ccccc2Cl)C1 ZINC000122174203 1414380221 /nfs/dbraw/zinc/38/02/21/1414380221.db2.gz ABJLKVIBZJRQFQ-AWEZNQCLSA-N 0 0 392.843 3.071 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000122178620 1414381393 /nfs/dbraw/zinc/38/13/93/1414381393.db2.gz RVINALMDDZQYLC-UHFFFAOYSA-N 0 0 399.209 3.398 20 5 GGBDRN CC1(C)CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)C[C@H]1c1ccccc1 ZINC000122193345 1414384894 /nfs/dbraw/zinc/38/48/94/1414384894.db2.gz CCAPRSCTRYETRO-SFHVURJKSA-N 0 0 391.431 3.441 20 5 GGBDRN Cc1ccccc1COc1cccc(CC(=O)NCCn2cc([N+](=O)[O-])cn2)c1 ZINC000122226231 1414394152 /nfs/dbraw/zinc/39/41/52/1414394152.db2.gz NUVMDRCJRSUSBA-UHFFFAOYSA-N 0 0 394.431 3.038 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000122242259 1414399043 /nfs/dbraw/zinc/39/90/43/1414399043.db2.gz NGIKQPKGFMRKES-UHFFFAOYSA-N 0 0 388.336 3.462 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000122266513 1414406183 /nfs/dbraw/zinc/40/61/83/1414406183.db2.gz VDXMMXSPQXHXNF-UHFFFAOYSA-N 0 0 396.247 3.259 20 5 GGBDRN COc1cc(C(=O)Nc2cnn(CCC(C)C)c2C)c([N+](=O)[O-])cc1OC ZINC000122281303 1414410814 /nfs/dbraw/zinc/41/08/14/1414410814.db2.gz STNXVLNDZZYXDS-UHFFFAOYSA-N 0 0 376.413 3.415 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1nnc(-c2ccccc2)s1 ZINC000177593401 1428805914 /nfs/dbraw/zinc/80/59/14/1428805914.db2.gz UHLUMERBAYVEAD-UHFFFAOYSA-N 0 0 383.433 3.455 20 5 GGBDRN COc1ccccc1C[C@@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000177593147 1428806038 /nfs/dbraw/zinc/80/60/38/1428806038.db2.gz ZEVCOOLBYZMVRE-GOSISDBHSA-N 0 0 392.477 3.290 20 5 GGBDRN CCc1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000122325973 1414424522 /nfs/dbraw/zinc/42/45/22/1414424522.db2.gz HGWPPIZFDAKDEQ-OAHLLOKOSA-N 0 0 387.461 3.140 20 5 GGBDRN Cc1ccc(NC(=O)N2CCOC[C@@H]2C[C@@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000122331154 1414425920 /nfs/dbraw/zinc/42/59/20/1414425920.db2.gz WRVJDMBJEONXIB-GOEBONIOSA-N 0 0 391.449 3.321 20 5 GGBDRN C[C@H](CC(=O)OCc1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000122333528 1414426478 /nfs/dbraw/zinc/42/64/78/1414426478.db2.gz YGKZPXLDPJVVIC-CYBMUJFWSA-N 0 0 390.823 3.429 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCCOCCc2ccccc2)C1=O ZINC000122346192 1414429637 /nfs/dbraw/zinc/42/96/37/1414429637.db2.gz CQFFCPWOOWHBMH-NRFANRHFSA-N 0 0 397.431 3.011 20 5 GGBDRN COCCOc1ccc(Cl)cc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000177605432 1428808309 /nfs/dbraw/zinc/80/83/09/1428808309.db2.gz VVBHVBYVSUOZCF-UHFFFAOYSA-N 0 0 376.796 3.476 20 5 GGBDRN Cc1nc(-c2ccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)cc2)n[nH]1 ZINC000122390515 1414444171 /nfs/dbraw/zinc/44/41/71/1414444171.db2.gz BEYISDCYIZUMLW-UHFFFAOYSA-N 0 0 376.376 3.351 20 5 GGBDRN Cc1nn(C)c(C(=O)NC[C@H](Cc2ccccc2)c2ccccc2)c1[N+](=O)[O-] ZINC000177617399 1428812226 /nfs/dbraw/zinc/81/22/26/1428812226.db2.gz UZJMQCQUEAAUPC-SFHVURJKSA-N 0 0 378.432 3.393 20 5 GGBDRN CCNC(=O)c1cccc(OC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000122408147 1414449924 /nfs/dbraw/zinc/44/99/24/1414449924.db2.gz ZPEZQJUDNUDDPZ-UHFFFAOYSA-N 0 0 397.431 3.167 20 5 GGBDRN Cc1ccc(NC(=O)NCCNC(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000122411811 1414451386 /nfs/dbraw/zinc/45/13/86/1414451386.db2.gz GFRPWEANEIQZNA-UHFFFAOYSA-N 0 0 376.800 3.108 20 5 GGBDRN Cc1cc(C(=O)N2CCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)c(C)o1 ZINC000122434819 1414459106 /nfs/dbraw/zinc/45/91/06/1414459106.db2.gz CWWANZCCGWIDRK-UHFFFAOYSA-N 0 0 377.828 3.416 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)cc1 ZINC000122438621 1414459688 /nfs/dbraw/zinc/45/96/88/1414459688.db2.gz ZGFPVHILEPWILS-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN CCOC(=O)c1ccc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)o1 ZINC000177612046 1428810694 /nfs/dbraw/zinc/81/06/94/1428810694.db2.gz HGKFBRPUGZDDNA-LUAWRHEFSA-N 0 0 381.344 3.019 20 5 GGBDRN COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000122460627 1414467904 /nfs/dbraw/zinc/46/79/04/1414467904.db2.gz JRQPFEFTIYGDDS-OAHLLOKOSA-N 0 0 397.431 3.087 20 5 GGBDRN COc1ccccc1CCNC(=O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000122462548 1414468762 /nfs/dbraw/zinc/46/87/62/1414468762.db2.gz NBLPEHUNSBIHFX-UHFFFAOYSA-N 0 0 391.855 3.048 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(CC)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000122466349 1414470098 /nfs/dbraw/zinc/47/00/98/1414470098.db2.gz LJDLBYIGFZHNMR-INIZCTEOSA-N 0 0 399.447 3.412 20 5 GGBDRN CCc1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000122484643 1414476731 /nfs/dbraw/zinc/47/67/31/1414476731.db2.gz WNNCZYGKBCQGSM-HXUWFJFHSA-N 0 0 395.459 3.387 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2ccc(N3CCCC3)cc2C)ccc1[N+](=O)[O-] ZINC000177616612 1428811745 /nfs/dbraw/zinc/81/17/45/1428811745.db2.gz GZRSPZFMPIZRNM-UHFFFAOYSA-N 0 0 391.449 3.313 20 5 GGBDRN O=C(N[C@@H](C[C@H]1CCOC1)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000122506671 1414484620 /nfs/dbraw/zinc/48/46/20/1414484620.db2.gz NHFZEWKJVJGMBD-ACJLOTCBSA-N 0 0 385.376 3.401 20 5 GGBDRN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000122505966 1414484737 /nfs/dbraw/zinc/48/47/37/1414484737.db2.gz NHFZEWKJVJGMBD-SCLBCKFNSA-N 0 0 385.376 3.401 20 5 GGBDRN O=C(NC[C@@H]1CCC[C@@H](O)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000122511874 1414486249 /nfs/dbraw/zinc/48/62/49/1414486249.db2.gz RJJOVCLNHQIHPP-SJLPKXTDSA-N 0 0 383.448 3.488 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC000122512787 1414487084 /nfs/dbraw/zinc/48/70/84/1414487084.db2.gz MDFUGRVORYFRKY-UHFFFAOYSA-N 0 0 390.321 3.306 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC[C@@H]2[C@@H]2CCCCC2=O)c1C ZINC000177619062 1428812621 /nfs/dbraw/zinc/81/26/21/1428812621.db2.gz CPANTYUMOGGKIL-JKSUJKDBSA-N 0 0 380.466 3.124 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000122521844 1414489247 /nfs/dbraw/zinc/48/92/47/1414489247.db2.gz CEJIAMMDOCXFER-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)N1CCC[C@H](O)C1 ZINC000122527545 1414490649 /nfs/dbraw/zinc/49/06/49/1414490649.db2.gz OLSWHHZIYXXEOH-HNNXBMFYSA-N 0 0 389.839 3.457 20 5 GGBDRN COC(=O)c1sccc1CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000122529900 1414491659 /nfs/dbraw/zinc/49/16/59/1414491659.db2.gz HDHFNGNCMZMUII-UHFFFAOYSA-N 0 0 376.434 3.486 20 5 GGBDRN Cc1c2ccccc2oc1[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(C)C ZINC000122533921 1414492277 /nfs/dbraw/zinc/49/22/77/1414492277.db2.gz ADAGWYWGJMEKLN-LJQANCHMSA-N 0 0 383.404 3.325 20 5 GGBDRN O=C(NCc1ccc(C(=O)Nc2ccncc2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000122545117 1414496535 /nfs/dbraw/zinc/49/65/35/1414496535.db2.gz ZOVFBAVTNOAPTH-UHFFFAOYSA-N 0 0 376.372 3.172 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000122546436 1414496700 /nfs/dbraw/zinc/49/67/00/1414496700.db2.gz AFEVKAQAZPOVCW-LJQANCHMSA-N 0 0 380.404 3.070 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC000122551971 1414497857 /nfs/dbraw/zinc/49/78/57/1414497857.db2.gz YKZLPKGDAXJQPM-CRAIPNDOSA-N 0 0 387.411 3.353 20 5 GGBDRN CCCN(CC(=O)OCC)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122559380 1414500518 /nfs/dbraw/zinc/50/05/18/1414500518.db2.gz LYXFFEQZWSQSTP-UHFFFAOYSA-N 0 0 377.422 3.134 20 5 GGBDRN CCOc1ccc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1OCC ZINC000122568815 1414503344 /nfs/dbraw/zinc/50/33/44/1414503344.db2.gz UUVUCKAXKPDCOG-UHFFFAOYSA-N 0 0 390.411 3.433 20 5 GGBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000122568303 1414503769 /nfs/dbraw/zinc/50/37/69/1414503769.db2.gz AAIRAYWWJJDDDG-AWEZNQCLSA-N 0 0 380.404 3.237 20 5 GGBDRN COCCN(C(=O)c1ccccc1[N+](=O)[O-])c1cccc(Br)n1 ZINC000122572661 1414504515 /nfs/dbraw/zinc/50/45/15/1414504515.db2.gz PHPQBUJLJODSHS-UHFFFAOYSA-N 0 0 380.198 3.046 20 5 GGBDRN O=C(NCc1ccc(C(=O)Nc2ccncc2)cc1)c1ccccc1[N+](=O)[O-] ZINC000122580466 1414507165 /nfs/dbraw/zinc/50/71/65/1414507165.db2.gz CRGVJGBUQLGLRU-UHFFFAOYSA-N 0 0 376.372 3.172 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](C2CCCC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000177623565 1428814126 /nfs/dbraw/zinc/81/41/26/1428814126.db2.gz PGGCQESFTCJBPC-HNNXBMFYSA-N 0 0 376.331 3.220 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)c(F)cc1F ZINC000122608094 1414515808 /nfs/dbraw/zinc/51/58/08/1414515808.db2.gz ABGHOBZZRNTQPU-UHFFFAOYSA-N 0 0 395.337 3.090 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(F)c1 ZINC000122614868 1414517930 /nfs/dbraw/zinc/51/79/30/1414517930.db2.gz PKUWUVMORSGYMX-UHFFFAOYSA-N 0 0 393.802 3.465 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC000122615307 1414518118 /nfs/dbraw/zinc/51/81/18/1414518118.db2.gz MDXUQJDYVFTAAV-INIZCTEOSA-N 0 0 378.425 3.128 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cl)c1 ZINC000122616991 1414518950 /nfs/dbraw/zinc/51/89/50/1414518950.db2.gz ICBAZOGJWLRKKK-UHFFFAOYSA-N 0 0 375.812 3.326 20 5 GGBDRN CCOc1ccc(C(=O)CCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122620576 1414519416 /nfs/dbraw/zinc/51/94/16/1414519416.db2.gz BNONHVYBXUXGBU-UHFFFAOYSA-N 0 0 382.376 3.471 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000122620882 1414519937 /nfs/dbraw/zinc/51/99/37/1414519937.db2.gz YAYPOLQBMSBPJU-ZDUSSCGKSA-N 0 0 382.388 3.126 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 ZINC000122625490 1414522210 /nfs/dbraw/zinc/52/22/10/1414522210.db2.gz KFIOTOUAYJRRIX-UHFFFAOYSA-N 0 0 393.403 3.066 20 5 GGBDRN O=C(Cc1csc(-c2ccccn2)n1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122632080 1414523895 /nfs/dbraw/zinc/52/38/95/1414523895.db2.gz TYXRHACMGNNTNZ-UHFFFAOYSA-N 0 0 380.389 3.171 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccn(CCC(C)C)n2)cc1OC ZINC000122632417 1414524452 /nfs/dbraw/zinc/52/44/52/1414524452.db2.gz XTHZOSHNXFQROD-UHFFFAOYSA-N 0 0 376.413 3.497 20 5 GGBDRN CC(C)=C[C@@H]1[C@@H](C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1(C)C ZINC000122635502 1414524919 /nfs/dbraw/zinc/52/49/19/1414524919.db2.gz FZZSXAPWSKPSQM-MSOLQXFVSA-N 0 0 385.464 3.118 20 5 GGBDRN CC(=O)CCc1ccc(O[C@@H](C)C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122638091 1414525781 /nfs/dbraw/zinc/52/57/81/1414525781.db2.gz LPQXBOMWPVEHCH-ZDUSSCGKSA-N 0 0 396.403 3.399 20 5 GGBDRN O=C(C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1cccs1 ZINC000122640447 1414526314 /nfs/dbraw/zinc/52/63/14/1414526314.db2.gz HVWPFSWWHVHMKH-GFCCVEGCSA-N 0 0 389.389 3.442 20 5 GGBDRN CCO[C@H](C)c1nc(CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cs1 ZINC000122642997 1414526723 /nfs/dbraw/zinc/52/67/23/1414526723.db2.gz OBNWJWZOTFKPHR-SECBINFHSA-N 0 0 375.410 3.206 20 5 GGBDRN Cc1cc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)nn1-c1ccc(F)cc1F ZINC000122649887 1414528818 /nfs/dbraw/zinc/52/88/18/1414528818.db2.gz ISGBVZDNTOCLOU-UHFFFAOYSA-N 0 0 398.329 3.496 20 5 GGBDRN COc1cc(CNC(=O)Cc2ccccc2[N+](=O)[O-])ccc1OCC(F)(F)F ZINC000122648980 1414528840 /nfs/dbraw/zinc/52/88/40/1414528840.db2.gz BYZHNCSSYGCAPP-UHFFFAOYSA-N 0 0 398.337 3.403 20 5 GGBDRN C[C@H](c1cc(F)ccc1F)N(C)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000122652536 1414529493 /nfs/dbraw/zinc/52/94/93/1414529493.db2.gz NAOUKKSZUUBPRU-LLVKDONJSA-N 0 0 378.331 3.284 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N[C@H](C)C[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000122656987 1414530651 /nfs/dbraw/zinc/53/06/51/1414530651.db2.gz HYJNLMRHEVPJBD-MLGOLLRUSA-N 0 0 398.868 3.347 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000122657509 1414531166 /nfs/dbraw/zinc/53/11/66/1414531166.db2.gz NKDUXKUKQVXFOL-CZUORRHYSA-N 0 0 378.425 3.442 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000122667138 1414533666 /nfs/dbraw/zinc/53/36/66/1414533666.db2.gz YLGDIJKGNQITDQ-YPMHNXCESA-N 0 0 382.388 3.440 20 5 GGBDRN Cc1ccccc1[C@H](C)CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122671516 1414534100 /nfs/dbraw/zinc/53/41/00/1414534100.db2.gz NLHGIKPKSMBYDI-QGZVFWFLSA-N 0 0 395.459 3.381 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc(C(=O)NC)cc1 ZINC000122675860 1414535699 /nfs/dbraw/zinc/53/56/99/1414535699.db2.gz XEVRIEVOARCXSK-UHFFFAOYSA-N 0 0 387.461 3.339 20 5 GGBDRN Cc1c(C(=O)NCCC2Cc3ccccc3C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000122689056 1414539273 /nfs/dbraw/zinc/53/92/73/1414539273.db2.gz DHOCPGLOZYDXSN-UHFFFAOYSA-N 0 0 391.431 3.019 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(C(F)(F)F)nc1 ZINC000122689118 1414539400 /nfs/dbraw/zinc/53/94/00/1414539400.db2.gz LXABTMWCYUURGM-UHFFFAOYSA-N 0 0 383.282 3.422 20 5 GGBDRN COc1ccc(NC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000122711136 1414544935 /nfs/dbraw/zinc/54/49/35/1414544935.db2.gz DCYNNPWDLYAYMM-UHFFFAOYSA-N 0 0 385.420 3.269 20 5 GGBDRN Cc1cc2c(ncnc2Sc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)s1 ZINC000122709859 1414545023 /nfs/dbraw/zinc/54/50/23/1414545023.db2.gz STKLGMOPRUWKIF-UHFFFAOYSA-N 0 0 381.460 3.463 20 5 GGBDRN O=C(CN[C@@H](c1ccccc1)C(F)(F)F)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122712961 1414545609 /nfs/dbraw/zinc/54/56/09/1414545609.db2.gz YITRNFLILIVWPR-HNNXBMFYSA-N 0 0 393.325 3.303 20 5 GGBDRN Cc1ccc(CCC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 ZINC000122713404 1414545620 /nfs/dbraw/zinc/54/56/20/1414545620.db2.gz UGAATTDDFVZRRS-UHFFFAOYSA-N 0 0 395.459 3.129 20 5 GGBDRN CS(=O)(=O)c1cccc(N2CC[C@H](Cc3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000122714303 1414546177 /nfs/dbraw/zinc/54/61/77/1414546177.db2.gz QYOAYCQTRMCCJE-CQSZACIVSA-N 0 0 378.425 3.206 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1CCC[C@H](O)C1 ZINC000122715122 1414546223 /nfs/dbraw/zinc/54/62/23/1414546223.db2.gz LUTPTAUDDPUNSV-YPMHNXCESA-N 0 0 389.374 3.083 20 5 GGBDRN COc1c(Cl)cccc1NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122717340 1414546904 /nfs/dbraw/zinc/54/69/04/1414546904.db2.gz GJICLPHLGVFZIW-UHFFFAOYSA-N 0 0 384.175 3.487 20 5 GGBDRN COCCCOC1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000122727105 1414550357 /nfs/dbraw/zinc/55/03/57/1414550357.db2.gz WUDMSMCHNXFYSR-CYBMUJFWSA-N 0 0 399.875 3.093 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000122733307 1414552315 /nfs/dbraw/zinc/55/23/15/1414552315.db2.gz AIWBKRAUHBKLJC-WMZOPIPTSA-N 0 0 388.395 3.471 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN(CC)Cc1nc2ccccc2c(=O)[nH]1 ZINC000177633352 1428817616 /nfs/dbraw/zinc/81/76/16/1428817616.db2.gz GJBKQMAPSBTBLS-UHFFFAOYSA-N 0 0 382.420 3.252 20 5 GGBDRN COCCN(CC(F)(F)F)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000122746132 1414555295 /nfs/dbraw/zinc/55/52/95/1414555295.db2.gz LAZHEKSXYCAIPA-UHFFFAOYSA-N 0 0 389.355 3.369 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1nnc(-c2ccccc2)s1 ZINC000122760125 1414558433 /nfs/dbraw/zinc/55/84/33/1414558433.db2.gz AHMQOEIMBDRMOZ-UHFFFAOYSA-N 0 0 385.405 3.444 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000122775220 1414561287 /nfs/dbraw/zinc/56/12/87/1414561287.db2.gz LHVKROSHUZMUKU-UHFFFAOYSA-N 0 0 382.336 3.206 20 5 GGBDRN CCOc1cc(Cl)ccc1NC(=O)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000177635446 1428818204 /nfs/dbraw/zinc/81/82/04/1428818204.db2.gz WKWSDEBDDBBXNH-LLVKDONJSA-N 0 0 391.811 3.463 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2C(=O)Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000122780269 1414562974 /nfs/dbraw/zinc/56/29/74/1414562974.db2.gz OLDHBIOVBABFSB-SFHVURJKSA-N 0 0 378.388 3.155 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000122781902 1414563229 /nfs/dbraw/zinc/56/32/29/1414563229.db2.gz HMPMZXKOFJOKBA-UKRRQHHQSA-N 0 0 376.434 3.150 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1[N+](=O)[O-] ZINC000122788580 1414565222 /nfs/dbraw/zinc/56/52/22/1414565222.db2.gz LYRPAOWWEZXJJT-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN CC(C)(C)CNC(=O)c1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122791284 1414565488 /nfs/dbraw/zinc/56/54/88/1414565488.db2.gz RRGJPBZESVQLIW-UHFFFAOYSA-N 0 0 395.419 3.499 20 5 GGBDRN CC[C@H](C)OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000122791919 1414565584 /nfs/dbraw/zinc/56/55/84/1414565584.db2.gz MNQGESYXPPNALP-LBPRGKRZSA-N 0 0 389.374 3.077 20 5 GGBDRN Cc1ccc(CC(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cn1 ZINC000122792323 1414566352 /nfs/dbraw/zinc/56/63/52/1414566352.db2.gz VHYBRJUWTHRZHG-KRWDZBQOSA-N 0 0 385.420 3.040 20 5 GGBDRN Cc1sc(S(=O)(=O)Oc2ccccc2Br)cc1[N+](=O)[O-] ZINC000122827883 1414575003 /nfs/dbraw/zinc/57/50/03/1414575003.db2.gz GUCXSNQHQJEBIV-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccn(Cc2ccccc2)c1=O ZINC000122805095 1414569279 /nfs/dbraw/zinc/56/92/79/1414569279.db2.gz NRYKDAQMNMRJOB-UHFFFAOYSA-N 0 0 379.372 3.066 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2Cc3ccccc3C[C@H]2c2nnc(C)o2)c1 ZINC000122804394 1414569320 /nfs/dbraw/zinc/56/93/20/1414569320.db2.gz NXOGWOMWDJBPCG-SFHVURJKSA-N 0 0 394.387 3.235 20 5 GGBDRN Cc1c(NC(=O)NCC(=O)Nc2cccc3cccnc32)cccc1[N+](=O)[O-] ZINC000122823242 1414573825 /nfs/dbraw/zinc/57/38/25/1414573825.db2.gz GUQGSYQSQPOXRQ-UHFFFAOYSA-N 0 0 379.376 3.212 20 5 GGBDRN CN(CC(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000122842296 1414578741 /nfs/dbraw/zinc/57/87/41/1414578741.db2.gz SPUNJTPNPXJPJY-PBHICJAKSA-N 0 0 389.477 3.207 20 5 GGBDRN CN(CC(=O)N1CCC[C@H]1C[C@H](O)c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000122842505 1414578818 /nfs/dbraw/zinc/57/88/18/1414578818.db2.gz SPUNJTPNPXJPJY-YOEHRIQHSA-N 0 0 389.477 3.207 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cccnc1OCC(F)(F)F ZINC000122855877 1414581536 /nfs/dbraw/zinc/58/15/36/1414581536.db2.gz CEFWHUXXJCXMHH-UHFFFAOYSA-N 0 0 377.225 3.461 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(Cc2cccc(F)c2)CC1 ZINC000122863110 1414583112 /nfs/dbraw/zinc/58/31/12/1414583112.db2.gz UTCOXFMPQGLNLE-UHFFFAOYSA-N 0 0 388.399 3.092 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCOc3ccc(C(F)(F)F)cc32)cc1 ZINC000122861391 1414583180 /nfs/dbraw/zinc/58/31/80/1414583180.db2.gz YTPUKESTANJCFR-UHFFFAOYSA-N 0 0 388.323 3.201 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2C(=O)c2cc(F)ccc2[N+](=O)[O-])o1 ZINC000122864075 1414583777 /nfs/dbraw/zinc/58/37/77/1414583777.db2.gz PXEUDOJTMBYVLG-KRWDZBQOSA-N 0 0 382.351 3.365 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1 ZINC000122874570 1414586290 /nfs/dbraw/zinc/58/62/90/1414586290.db2.gz VKCUHXKTZZPITJ-AWEZNQCLSA-N 0 0 383.763 3.251 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2)CC(F)F)cc1[N+](=O)[O-] ZINC000122876578 1414587130 /nfs/dbraw/zinc/58/71/30/1414587130.db2.gz LAOQKXAFUWLMBH-UHFFFAOYSA-N 0 0 377.347 3.136 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000122881673 1414587781 /nfs/dbraw/zinc/58/77/81/1414587781.db2.gz NUZSBFXHTZRIMM-SFHVURJKSA-N 0 0 385.420 3.408 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H]1C[C@@H](O)c1ccco1 ZINC000122887734 1414589325 /nfs/dbraw/zinc/58/93/25/1414589325.db2.gz BQJXZPQOJQXOCM-SWLSCSKDSA-N 0 0 375.381 3.316 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000122887047 1414589381 /nfs/dbraw/zinc/58/93/81/1414589381.db2.gz BQJXZPQOJQXOCM-DOMZBBRYSA-N 0 0 375.381 3.316 20 5 GGBDRN COc1ccc(CCCNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1 ZINC000122890921 1414589901 /nfs/dbraw/zinc/58/99/01/1414589901.db2.gz GWTMMONXYCARCH-UHFFFAOYSA-N 0 0 387.392 3.491 20 5 GGBDRN CC[C@H]1CCCC[C@@H]1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000122891124 1414590014 /nfs/dbraw/zinc/59/00/14/1414590014.db2.gz UKLVCQGGBDPUPY-KBPBESRZSA-N 0 0 394.497 3.093 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1 ZINC000122899057 1414592113 /nfs/dbraw/zinc/59/21/13/1414592113.db2.gz IDIBUPHUWQALAU-HNNXBMFYSA-N 0 0 388.811 3.254 20 5 GGBDRN Cc1cccc([C@H]2CCCN2C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1 ZINC000122899240 1414592120 /nfs/dbraw/zinc/59/21/20/1414592120.db2.gz IDIBUPHUWQALAU-OAHLLOKOSA-N 0 0 388.811 3.254 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000122907367 1414593791 /nfs/dbraw/zinc/59/37/91/1414593791.db2.gz ZKHFQTPQRUEWMM-AWEZNQCLSA-N 0 0 399.325 3.477 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cnn(Cc2ccccc2)c1 ZINC000122917637 1414597111 /nfs/dbraw/zinc/59/71/11/1414597111.db2.gz SHQZNBYWEWWRCU-UHFFFAOYSA-N 0 0 381.392 3.170 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c1 ZINC000122932910 1414600254 /nfs/dbraw/zinc/60/02/54/1414600254.db2.gz OMKAHIWQLYPIMZ-DNVCBOLYSA-N 0 0 388.395 3.471 20 5 GGBDRN COc1cc(C)nc(COC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000122939725 1414601440 /nfs/dbraw/zinc/60/14/40/1414601440.db2.gz WUCVTZRHYVIVHW-UHFFFAOYSA-N 0 0 381.182 3.426 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ncc(-c2ccccc2)o1 ZINC000122941728 1414602079 /nfs/dbraw/zinc/60/20/79/1414602079.db2.gz UIJZAVCDCHPJOZ-LBPRGKRZSA-N 0 0 380.360 3.066 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000122949913 1414604029 /nfs/dbraw/zinc/60/40/29/1414604029.db2.gz RFMBTOUMRDPRRU-UHFFFAOYSA-N 0 0 390.343 3.443 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CN(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000122953822 1414604575 /nfs/dbraw/zinc/60/45/75/1414604575.db2.gz BYZMAVYRSHGOTM-UHFFFAOYSA-N 0 0 394.431 3.333 20 5 GGBDRN CN1C(=O)CCc2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)ccc21 ZINC000122963752 1414607466 /nfs/dbraw/zinc/60/74/66/1414607466.db2.gz YHXHKEGCRJHPKJ-UHFFFAOYSA-N 0 0 391.330 3.358 20 5 GGBDRN CN1CCCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2cc(F)ccc21 ZINC000122966883 1414608688 /nfs/dbraw/zinc/60/86/88/1414608688.db2.gz DLMULOAJEFZCHI-UHFFFAOYSA-N 0 0 395.394 3.406 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2ccco2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000122974386 1414610354 /nfs/dbraw/zinc/61/03/54/1414610354.db2.gz WWAACADUXCTTJK-UHFFFAOYSA-N 0 0 393.446 3.344 20 5 GGBDRN Cc1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1C(=O)N(C)C ZINC000122981655 1414612350 /nfs/dbraw/zinc/61/23/50/1414612350.db2.gz VTOTUEPCHDXGKP-UHFFFAOYSA-N 0 0 380.404 3.268 20 5 GGBDRN CC[C@@H]1CCc2ccccc2N1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000177653144 1428823054 /nfs/dbraw/zinc/82/30/54/1428823054.db2.gz GOMYLHKKQPZIOV-OAHLLOKOSA-N 0 0 388.445 3.370 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cccc(-c2cnn(C)c2)c1 ZINC000123013707 1414619860 /nfs/dbraw/zinc/61/98/60/1414619860.db2.gz YAWKLTSHPOZQLQ-UHFFFAOYSA-N 0 0 381.392 3.326 20 5 GGBDRN CC(=O)NC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000123021887 1414621651 /nfs/dbraw/zinc/62/16/51/1414621651.db2.gz QGAXFUGPCYDICD-OAHLLOKOSA-N 0 0 393.509 3.331 20 5 GGBDRN CC(=O)NC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000123022067 1414621666 /nfs/dbraw/zinc/62/16/66/1414621666.db2.gz QGAXFUGPCYDICD-HNNXBMFYSA-N 0 0 393.509 3.331 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cccc(Cn2cccn2)c1 ZINC000123029023 1414622967 /nfs/dbraw/zinc/62/29/67/1414622967.db2.gz SCCIIZTURTVWST-UHFFFAOYSA-N 0 0 381.392 3.170 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2cnccn2)n1C ZINC000123042035 1414625776 /nfs/dbraw/zinc/62/57/76/1414625776.db2.gz CKGXTEIWNYHVOD-UHFFFAOYSA-N 0 0 386.437 3.260 20 5 GGBDRN COc1ccc(C[C@H](C)CN(C)c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])cc1 ZINC000123048301 1414627824 /nfs/dbraw/zinc/62/78/24/1414627824.db2.gz BHYWJKNKDNVQLZ-AWEZNQCLSA-N 0 0 392.477 3.322 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000123051787 1414628407 /nfs/dbraw/zinc/62/84/07/1414628407.db2.gz IQSWAZLZLBKNQH-GFCCVEGCSA-N 0 0 397.391 3.460 20 5 GGBDRN COc1ccc(Cn2ncc(C)c2NC(=O)c2ccc([N+](=O)[O-])o2)cc1OC ZINC000123057933 1414629580 /nfs/dbraw/zinc/62/95/80/1414629580.db2.gz JYFNFCRVHOQTSB-UHFFFAOYSA-N 0 0 386.364 3.011 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](c1nccn1C)c1ccc(F)cc1 ZINC000123070842 1414633239 /nfs/dbraw/zinc/63/32/39/1414633239.db2.gz AFEARIGTSGNHKV-QGZVFWFLSA-N 0 0 399.382 3.387 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2C(=O)c2ccc([N+](=O)[O-])cc2F)o1 ZINC000123085843 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395.749 3.062 20 5 GGBDRN O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000123355644 1414705433 /nfs/dbraw/zinc/70/54/33/1414705433.db2.gz MXTUNICZIAYWRZ-CYBMUJFWSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(C(=O)[C@@H](c2ccccc2)C2CC2)CC1 ZINC000123359646 1414706213 /nfs/dbraw/zinc/70/62/13/1414706213.db2.gz SOTBVJITAJLMTE-SFHVURJKSA-N 0 0 399.472 3.135 20 5 GGBDRN Cc1cnc(OCc2nnc(C(=O)Nc3ccc(F)cc3)s2)c([N+](=O)[O-])c1 ZINC000123363386 1414707280 /nfs/dbraw/zinc/70/72/80/1414707280.db2.gz VUWPWTLWVFMDRQ-UHFFFAOYSA-N 0 0 389.368 3.120 20 5 GGBDRN C[C@@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)CC1(C)OCCO1 ZINC000123368435 1414708248 /nfs/dbraw/zinc/70/82/48/1414708248.db2.gz ZRDLVEXJIQGWQL-CQSZACIVSA-N 0 0 377.441 3.058 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000123371370 1414708530 /nfs/dbraw/zinc/70/85/30/1414708530.db2.gz MIGIZUBPJGWAJN-HHHXNRCGSA-N 0 0 387.461 3.206 20 5 GGBDRN 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O=Cc1c(OS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])ccc2ccccc12 ZINC000123645684 1414803026 /nfs/dbraw/zinc/80/30/26/1414803026.db2.gz AYDQPZAFHVOIKP-UHFFFAOYSA-N 0 0 375.333 3.467 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccc(-n3cc(C)cn3)c(F)c2)c([N+](=O)[O-])c1 ZINC000123644598 1414803192 /nfs/dbraw/zinc/80/31/92/1414803192.db2.gz MQSLWAAZUJQFFV-UHFFFAOYSA-N 0 0 399.382 3.287 20 5 GGBDRN COC(=O)CCCc1csc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])n1 ZINC000123648860 1414803468 /nfs/dbraw/zinc/80/34/68/1414803468.db2.gz AOVIWNLNXJSGOI-UHFFFAOYSA-N 0 0 383.813 3.453 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc([N+](=O)[O-])cc1F ZINC000123648667 1414803512 /nfs/dbraw/zinc/80/35/12/1414803512.db2.gz DXVDXWUHTMYRCC-UHFFFAOYSA-N 0 0 390.732 3.372 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000123652692 1414804268 /nfs/dbraw/zinc/80/42/68/1414804268.db2.gz NPFXNFIJFZZSID-GFCCVEGCSA-N 0 0 396.852 3.149 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@H]2CCC[C@@H](O)C2)CC1 ZINC000123653048 1414804283 /nfs/dbraw/zinc/80/42/83/1414804283.db2.gz GXVGXYIUOIUKQC-DOTOQJQBSA-N 0 0 375.469 3.112 20 5 GGBDRN Cc1ccc(-n2nccc2NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)nn1 ZINC000123657494 1414805216 /nfs/dbraw/zinc/80/52/16/1414805216.db2.gz XQJBYEISESEEPV-UHFFFAOYSA-N 0 0 380.408 3.429 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)Oc1ccc(Br)cc1F ZINC000123658069 1414805318 /nfs/dbraw/zinc/80/53/18/1414805318.db2.gz SZLXNDJEXLXDFY-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN Cc1c(Br)cc(C(=O)OCCOCC(F)(F)F)cc1[N+](=O)[O-] ZINC000123662595 1414805518 /nfs/dbraw/zinc/80/55/18/1414805518.db2.gz NJENIPFNWDUPRJ-UHFFFAOYSA-N 0 0 386.120 3.401 20 5 GGBDRN O=C(NCCOc1ccc(Cl)cn1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000123659959 1414805680 /nfs/dbraw/zinc/80/56/80/1414805680.db2.gz UZMHEAPXDJGUAY-UHFFFAOYSA-N 0 0 390.827 3.396 20 5 GGBDRN CCn1c(SCC(=O)Nc2nccs2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123660076 1414805723 /nfs/dbraw/zinc/80/57/23/1414805723.db2.gz YHGUPQBCCIEIBS-UHFFFAOYSA-N 0 0 390.450 3.061 20 5 GGBDRN CCn1c(SCCOC[C@H]2CCCO2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123665651 1414806157 /nfs/dbraw/zinc/80/61/57/1414806157.db2.gz PJHLGCQNBQEGGM-OAHLLOKOSA-N 0 0 378.454 3.161 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)Oc1ccccc1Br ZINC000123667494 1414806413 /nfs/dbraw/zinc/80/64/13/1414806413.db2.gz GMZJOLZBLKIOQA-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N(Cc1ccco1)Cc1ccco1 ZINC000123672618 1414807182 /nfs/dbraw/zinc/80/71/82/1414807182.db2.gz FVLYWCTWTKBTPF-UHFFFAOYSA-N 0 0 380.353 3.311 20 5 GGBDRN Cc1c(C(=O)Nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)cnn1CCC(C)C ZINC000123679096 1414808577 /nfs/dbraw/zinc/80/85/77/1414808577.db2.gz AFIHPWNGEMFWJN-UHFFFAOYSA-N 0 0 383.412 3.183 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCN(Cc2cccs2)CC1 ZINC000123703416 1414812324 /nfs/dbraw/zinc/81/23/24/1414812324.db2.gz BEWOWDMDYLKIQD-UHFFFAOYSA-N 0 0 384.461 3.025 20 5 GGBDRN Cc1c(Br)cc(C(=O)OCc2nnc(C3CC3)n2C)cc1[N+](=O)[O-] ZINC000123707143 1414812731 /nfs/dbraw/zinc/81/27/31/1414812731.db2.gz FVKWHCJCFYATNG-UHFFFAOYSA-N 0 0 395.213 3.029 20 5 GGBDRN CCOC(=O)c1cc(NCCCNC(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000123733862 1414817693 /nfs/dbraw/zinc/81/76/93/1414817693.db2.gz INIBMKPZBCKEAL-UHFFFAOYSA-N 0 0 377.422 3.065 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123741210 1414818407 /nfs/dbraw/zinc/81/84/07/1414818407.db2.gz OUKJMZXIWPZUOZ-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN CCC[C@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1nnc2ccccn21 ZINC000123747814 1414819737 /nfs/dbraw/zinc/81/97/37/1414819737.db2.gz WSCNBFHBDGUTOR-KRWDZBQOSA-N 0 0 394.435 3.247 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000123749470 1414819757 /nfs/dbraw/zinc/81/97/57/1414819757.db2.gz ZYHHPAGWQPUMKT-HKUYNNGSSA-N 0 0 388.395 3.227 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1Cl ZINC000123766976 1414821948 /nfs/dbraw/zinc/82/19/48/1414821948.db2.gz MKCHIFPDOQKWDG-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN Cc1ccc(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c(OC(C)C)c1 ZINC000123782179 1414824027 /nfs/dbraw/zinc/82/40/27/1414824027.db2.gz PFOZQSSTDQJBJG-UHFFFAOYSA-N 0 0 395.415 3.462 20 5 GGBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCC[C@H]1c1ncon1 ZINC000123800582 1414826142 /nfs/dbraw/zinc/82/61/42/1414826142.db2.gz VEQLIFMWPQPYJP-AWEZNQCLSA-N 0 0 385.405 3.469 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[C@@H](O)c2ccc(F)cc2)c1C ZINC000123820481 1414829263 /nfs/dbraw/zinc/82/92/63/1414829263.db2.gz GPHWKVYQDNSUOC-SJKOYZFVSA-N 0 0 396.440 3.141 20 5 GGBDRN COc1cc(C(=O)N2CCc3ccsc3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000123824950 1414829680 /nfs/dbraw/zinc/82/96/80/1414829680.db2.gz BWKVKLRNUOFFEZ-UHFFFAOYSA-N 0 0 384.360 3.465 20 5 GGBDRN CCN(CC)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cn1 ZINC000123859813 1414836856 /nfs/dbraw/zinc/83/68/56/1414836856.db2.gz BKFYSAGJEQMIPN-UHFFFAOYSA-N 0 0 379.420 3.314 20 5 GGBDRN O=C(NCCc1cc2ccccc2o1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000123869218 1414839534 /nfs/dbraw/zinc/83/95/34/1414839534.db2.gz CRLXITFFWFUZHJ-UHFFFAOYSA-N 0 0 376.372 3.499 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cnc([C@@H]2CCCO2)s1 ZINC000123924914 1414851021 /nfs/dbraw/zinc/85/10/21/1414851021.db2.gz OCVKAEVSPVCJHT-ZDUSSCGKSA-N 0 0 385.405 3.341 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cnc([C@H]2CCCO2)s1 ZINC000123925160 1414851073 /nfs/dbraw/zinc/85/10/73/1414851073.db2.gz OCVKAEVSPVCJHT-CYBMUJFWSA-N 0 0 385.405 3.341 20 5 GGBDRN CN(C)C(=O)c1ccc(OC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000123941566 1414854327 /nfs/dbraw/zinc/85/43/27/1414854327.db2.gz MGRLHGTVZZLBIG-UHFFFAOYSA-N 0 0 393.193 3.278 20 5 GGBDRN CC(C)(NC(=O)N[C@H]1CCN(C2CCCCC2)C1=O)c1ccc([N+](=O)[O-])cc1 ZINC000123942639 1414854355 /nfs/dbraw/zinc/85/43/55/1414854355.db2.gz LNNIOAMKAWBNFG-KRWDZBQOSA-N 0 0 388.468 3.063 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC(n2cccn2)CC1 ZINC000123961738 1414857610 /nfs/dbraw/zinc/85/76/10/1414857610.db2.gz SZSUGFSZBIJTTG-UHFFFAOYSA-N 0 0 383.433 3.392 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000123982717 1414862276 /nfs/dbraw/zinc/86/22/76/1414862276.db2.gz JLGQQHKPTJLYPG-QGZVFWFLSA-N 0 0 384.436 3.062 20 5 GGBDRN O=C(Nc1ccn(CC(F)(F)F)n1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000123982881 1414862346 /nfs/dbraw/zinc/86/23/46/1414862346.db2.gz VLGDDQNRCMUDBQ-UHFFFAOYSA-N 0 0 383.330 3.206 20 5 GGBDRN O=[N+]([O-])c1cnn(CC[S@](=O)Cc2nc(-c3c(F)cccc3F)cs2)c1 ZINC000124004627 1414867521 /nfs/dbraw/zinc/86/75/21/1414867521.db2.gz RTBLDJFAABXGMP-AREMUKBSSA-N 0 0 398.416 3.142 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCCC[C@H]1C[C@H](O)c1ccccc1 ZINC000124004671 1414867545 /nfs/dbraw/zinc/86/75/45/1414867545.db2.gz HBTRGIIGXRYHTL-HKUYNNGSSA-N 0 0 386.452 3.076 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(C)cc3)C2)c([N+](=O)[O-])c1 ZINC000124025965 1414871960 /nfs/dbraw/zinc/87/19/60/1414871960.db2.gz SVKDFEWMFFVALH-MRXNPFEDSA-N 0 0 397.431 3.403 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1F)NCc1ccc(OC(F)(F)F)cc1 ZINC000124045121 1414875419 /nfs/dbraw/zinc/87/54/19/1414875419.db2.gz UARNHMDIVIMCPE-UHFFFAOYSA-N 0 0 388.273 3.328 20 5 GGBDRN Cc1cccc(-c2ccc(CNC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)cc2)c1 ZINC000124055131 1414877585 /nfs/dbraw/zinc/87/75/85/1414877585.db2.gz AFEGYKXTOOCWJO-UHFFFAOYSA-N 0 0 377.400 3.048 20 5 GGBDRN CCN(Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1)C(=O)C(F)(F)F ZINC000124065829 1414879285 /nfs/dbraw/zinc/87/92/85/1414879285.db2.gz REGYHVPWISZSKI-UHFFFAOYSA-N 0 0 385.298 3.351 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000124090453 1414883791 /nfs/dbraw/zinc/88/37/91/1414883791.db2.gz FVFACQHGLLVVJE-UHFFFAOYSA-N 0 0 382.395 3.395 20 5 GGBDRN Cc1cc(S(C)(=O)=O)cc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1C ZINC000124094512 1414884369 /nfs/dbraw/zinc/88/43/69/1414884369.db2.gz IPRRLNBODDBSEO-UHFFFAOYSA-N 0 0 399.428 3.416 20 5 GGBDRN CC(C)(C)OC(=O)NC(C)(C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000124117240 1414888543 /nfs/dbraw/zinc/88/85/43/1414888543.db2.gz PAFKFHHWTXWMJM-UHFFFAOYSA-N 0 0 379.457 3.337 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000124119455 1414888718 /nfs/dbraw/zinc/88/87/18/1414888718.db2.gz HGTYFEUWOSGJAR-LBPRGKRZSA-N 0 0 383.832 3.378 20 5 GGBDRN Cc1ccc(-c2ncco2)cc1NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000124127373 1414890598 /nfs/dbraw/zinc/89/05/98/1414890598.db2.gz ODQMKIFRHIUIHW-CYBMUJFWSA-N 0 0 394.387 3.315 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccc(N2CCCCC2)cc1C(N)=O ZINC000124128317 1414890800 /nfs/dbraw/zinc/89/08/00/1414890800.db2.gz DKIFNJCMQXCZMB-UHFFFAOYSA-N 0 0 384.436 3.305 20 5 GGBDRN O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000124137822 1414893084 /nfs/dbraw/zinc/89/30/84/1414893084.db2.gz RJRMPIDZBKAQGU-UHFFFAOYSA-N 0 0 384.314 3.483 20 5 GGBDRN Cc1ccc(-c2ncco2)cc1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000124163470 1414898151 /nfs/dbraw/zinc/89/81/51/1414898151.db2.gz UJHLCUKNKXLFBF-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000124169255 1414899181 /nfs/dbraw/zinc/89/91/81/1414899181.db2.gz IJMQYKXLGPPPEY-CHWSQXEVSA-N 0 0 381.860 3.405 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(C(=O)NC2CC2)cc1 ZINC000124168504 1414899366 /nfs/dbraw/zinc/89/93/66/1414899366.db2.gz BTBUIWJHPRTBCW-UHFFFAOYSA-N 0 0 391.387 3.129 20 5 GGBDRN CC(C)(NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC1CCCCC1 ZINC000124181418 1414901565 /nfs/dbraw/zinc/90/15/65/1414901565.db2.gz ASGXNEUOAXCMPW-UHFFFAOYSA-N 0 0 381.860 3.453 20 5 GGBDRN C[C@H](Sc1nnc(-c2ccncc2)o1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000124186847 1414903651 /nfs/dbraw/zinc/90/36/51/1414903651.db2.gz DATNHTGZOBCICG-VIFPVBQESA-N 0 0 389.368 3.298 20 5 GGBDRN Cc1onc(-c2c(F)cccc2Cl)c1C(=O)OCCn1cc([N+](=O)[O-])cn1 ZINC000177739515 1428846444 /nfs/dbraw/zinc/84/64/44/1428846444.db2.gz BSYDPONOOITBDE-UHFFFAOYSA-N 0 0 394.746 3.404 20 5 GGBDRN Cc1ccc(OC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000124202918 1414907909 /nfs/dbraw/zinc/90/79/09/1414907909.db2.gz KWXWZWCSVVQTNB-OAHLLOKOSA-N 0 0 377.441 3.276 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccccc1N1CCC(CO)CC1 ZINC000124223802 1414913447 /nfs/dbraw/zinc/91/34/47/1414913447.db2.gz TWRXOZGAVDXFJU-UHFFFAOYSA-N 0 0 398.463 3.163 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@@H](O)c2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000124247000 1414919009 /nfs/dbraw/zinc/91/90/09/1414919009.db2.gz NVDSJAPGYJASMM-MRXNPFEDSA-N 0 0 392.458 3.130 20 5 GGBDRN COc1ccc(C[N@@H+]2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)cc1[N+](=O)[O-] ZINC000177742498 1428847675 /nfs/dbraw/zinc/84/76/75/1428847675.db2.gz HSPDSUHRXGPQSF-INIZCTEOSA-N 0 0 384.436 3.158 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(C)o1 ZINC000124251455 1414920857 /nfs/dbraw/zinc/92/08/57/1414920857.db2.gz YAWOXNYSHFAZMA-INIZCTEOSA-N 0 0 386.326 3.461 20 5 GGBDRN COc1ccc(C[N@@H+]2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)cc1[N+](=O)[O-] ZINC000177742484 1428847875 /nfs/dbraw/zinc/84/78/75/1428847875.db2.gz HSPDSUHRXGPQSF-MRXNPFEDSA-N 0 0 384.436 3.158 20 5 GGBDRN O=C(CCSc1nc2ccccc2s1)OCCn1cc([N+](=O)[O-])cn1 ZINC000177747108 1428848848 /nfs/dbraw/zinc/84/88/48/1428848848.db2.gz IEGXBSAPSOLRLH-UHFFFAOYSA-N 0 0 378.435 3.127 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000124341576 1414944256 /nfs/dbraw/zinc/94/42/56/1414944256.db2.gz SGOYZLZAGYKDDX-INIZCTEOSA-N 0 0 386.301 3.497 20 5 GGBDRN CCc1cnc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)s1 ZINC000124353611 1414947346 /nfs/dbraw/zinc/94/73/46/1414947346.db2.gz HAJBHAVUUMDYKO-UHFFFAOYSA-N 0 0 375.859 3.054 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1OCC(F)F ZINC000124361050 1414949254 /nfs/dbraw/zinc/94/92/54/1414949254.db2.gz PVGGKXPOCOBQJY-UHFFFAOYSA-N 0 0 381.335 3.298 20 5 GGBDRN Cc1sc(S(=O)(=O)N(CCO)[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000124400450 1414958511 /nfs/dbraw/zinc/95/85/11/1414958511.db2.gz LWWAPDIRARLODN-HNNXBMFYSA-N 0 0 396.490 3.025 20 5 GGBDRN CN(C[C@@H]1CCC[C@H]1O)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000124414598 1414962586 /nfs/dbraw/zinc/96/25/86/1414962586.db2.gz WLBZLWXHDMTLGG-OXJNMPFZSA-N 0 0 383.448 3.440 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c2ccccc12)NC(=O)NCc1cccs1 ZINC000124439741 1414968626 /nfs/dbraw/zinc/96/86/26/1414968626.db2.gz DOKQLXHVTCFBOU-UHFFFAOYSA-N 0 0 385.401 3.214 20 5 GGBDRN COc1ccc2c(c1)C[C@@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)CO2 ZINC000124438565 1414968995 /nfs/dbraw/zinc/96/89/95/1414968995.db2.gz ZTSFTYZZOINUAE-CQSZACIVSA-N 0 0 390.823 3.467 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000124486816 1414979550 /nfs/dbraw/zinc/97/95/50/1414979550.db2.gz SBIGZNHNGPMTPT-MRXNPFEDSA-N 0 0 379.338 3.287 20 5 GGBDRN Cc1ccc(C(=O)OCCn2cc([N+](=O)[O-])cn2)cc1NC(=O)c1ccccc1 ZINC000177763224 1428852839 /nfs/dbraw/zinc/85/28/39/1428852839.db2.gz VTVNFASZHHZJMU-UHFFFAOYSA-N 0 0 394.387 3.209 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000124496506 1414982162 /nfs/dbraw/zinc/98/21/62/1414982162.db2.gz RMDLXSKBPKFNCM-UHFFFAOYSA-N 0 0 382.420 3.318 20 5 GGBDRN CNC(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000124503881 1414983184 /nfs/dbraw/zinc/98/31/84/1414983184.db2.gz FJGYSWGFCYUABE-UHFFFAOYSA-N 0 0 381.310 3.154 20 5 GGBDRN CC(C)(C)C(=O)N1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000124511939 1414984709 /nfs/dbraw/zinc/98/47/09/1414984709.db2.gz BLWIYTQWTYRBAB-UHFFFAOYSA-N 0 0 375.469 3.223 20 5 GGBDRN CCc1cnc(CN(C)[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000177765648 1428853260 /nfs/dbraw/zinc/85/32/60/1428853260.db2.gz WRTQLWPUGVDIFE-NSHDSACASA-N 0 0 378.454 3.081 20 5 GGBDRN CCNC(=O)C(C)(C)CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000124522981 1414987229 /nfs/dbraw/zinc/98/72/29/1414987229.db2.gz WWVSGSTWIITKKH-UHFFFAOYSA-N 0 0 398.463 3.099 20 5 GGBDRN O=C(NCc1nccn1CCCc1ccccc1)Nc1ccncc1[N+](=O)[O-] ZINC000124532849 1414988768 /nfs/dbraw/zinc/98/87/68/1414988768.db2.gz PJRZQBLAXSVMFH-UHFFFAOYSA-N 0 0 380.408 3.141 20 5 GGBDRN CN1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](c2ccccc2)C1 ZINC000124560764 1414994113 /nfs/dbraw/zinc/99/41/13/1414994113.db2.gz MQRZWPMDZKDYIA-SFHVURJKSA-N 0 0 379.420 3.134 20 5 GGBDRN Cn1cc(CNc2cnn(-c3ccccn3)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000124567404 1414995583 /nfs/dbraw/zinc/99/55/83/1414995583.db2.gz SHUKABONKGRYGK-UHFFFAOYSA-N 0 0 375.392 3.188 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000124569994 1414996929 /nfs/dbraw/zinc/99/69/29/1414996929.db2.gz RCPOCSMMRGCFRN-UHFFFAOYSA-N 0 0 391.449 3.236 20 5 GGBDRN C[C@]1(CNC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000124609645 1415005173 /nfs/dbraw/zinc/00/51/73/1415005173.db2.gz ADFKBBMCBYCGLZ-OAHLLOKOSA-N 0 0 375.347 3.101 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000124619705 1415007102 /nfs/dbraw/zinc/00/71/02/1415007102.db2.gz FQAKFGNRJYRPHN-FQEVSTJZSA-N 0 0 388.395 3.085 20 5 GGBDRN CCc1cnc(CN(C)[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)s1 ZINC000177772688 1428855272 /nfs/dbraw/zinc/85/52/72/1428855272.db2.gz MCZNTCRWCZLGSS-LLVKDONJSA-N 0 0 378.454 3.081 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC[C@]2(C)CCCO2)cc1[N+](=O)[O-])c1ccccn1 ZINC000124645187 1415012511 /nfs/dbraw/zinc/01/25/11/1415012511.db2.gz HOSSMSXNKMJZQP-VLIAUNLRSA-N 0 0 384.436 3.462 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)cc1-c1nnn[n-]1 ZINC000826498636 1428855832 /nfs/dbraw/zinc/85/58/32/1428855832.db2.gz DDBXAASINULDAB-KRWDZBQOSA-N 0 0 379.424 3.024 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000124681135 1415020248 /nfs/dbraw/zinc/02/02/48/1415020248.db2.gz QBTPABCJGJDACL-INIZCTEOSA-N 0 0 398.868 3.301 20 5 GGBDRN CN(C(=O)c1ccncc1)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000124684394 1415020743 /nfs/dbraw/zinc/02/07/43/1415020743.db2.gz CDEOTMDYKHOSMA-UHFFFAOYSA-N 0 0 390.399 3.196 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000177776601 1428856126 /nfs/dbraw/zinc/85/61/26/1428856126.db2.gz LPLBRVZZFYHVLU-INIZCTEOSA-N 0 0 375.450 3.168 20 5 GGBDRN CCN(C[C@@H](O)c1ccc(C)cc1)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000124688791 1415021928 /nfs/dbraw/zinc/02/19/28/1415021928.db2.gz COMBDWOMXSIIKC-GOSISDBHSA-N 0 0 392.477 3.264 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1csc(-c2c(F)cccc2F)n1 ZINC000177779584 1428856455 /nfs/dbraw/zinc/85/64/55/1428856455.db2.gz ATZHTYHMIXTYDT-UHFFFAOYSA-N 0 0 380.332 3.050 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)c1[N+](=O)[O-] ZINC000124706219 1415026224 /nfs/dbraw/zinc/02/62/24/1415026224.db2.gz TUHBNSKRBUUICR-UHFFFAOYSA-N 0 0 395.872 3.096 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)Nc2ccc3n[nH]cc3c2)cc1[N+](=O)[O-] ZINC000124710703 1415027305 /nfs/dbraw/zinc/02/73/05/1415027305.db2.gz VZYBPAOXBRERMJ-UHFFFAOYSA-N 0 0 395.404 3.003 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])OCc1noc(-c2ccc(F)cc2)n1 ZINC000124725315 1415030097 /nfs/dbraw/zinc/03/00/97/1415030097.db2.gz VEYFGKKFHDPGER-UHFFFAOYSA-N 0 0 386.339 3.329 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CN1CCC(OC2CCCCC2)CC1 ZINC000124732871 1415031629 /nfs/dbraw/zinc/03/16/29/1415031629.db2.gz LQAYMMKCMZKYIN-UHFFFAOYSA-N 0 0 375.425 3.274 20 5 GGBDRN CC[C@@H](NC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000177792445 1428859722 /nfs/dbraw/zinc/85/97/22/1428859722.db2.gz IOXHZNDRMRXOEP-DOTOQJQBSA-N 0 0 375.469 3.447 20 5 GGBDRN CC[C@@H](NC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000177792417 1428859847 /nfs/dbraw/zinc/85/98/47/1428859847.db2.gz IOXHZNDRMRXOEP-NVXWUHKLSA-N 0 0 375.469 3.447 20 5 GGBDRN Cc1cc(C(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c(Cl)cc1F ZINC000124746206 1415034992 /nfs/dbraw/zinc/03/49/92/1415034992.db2.gz YIUVVVQRJXRHHO-UHFFFAOYSA-N 0 0 376.727 3.175 20 5 GGBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(C)cc2=O)c(C)n1Cc1cccs1 ZINC000177795835 1428860149 /nfs/dbraw/zinc/86/01/49/1428860149.db2.gz JLYCBGWMWAYTPM-UHFFFAOYSA-N 0 0 385.445 3.476 20 5 GGBDRN C[C@H](CC(=O)OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000124753283 1415036467 /nfs/dbraw/zinc/03/64/67/1415036467.db2.gz VBSZJWUGARMPOG-WBVHZDCISA-N 0 0 397.431 3.331 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CC[C@@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000124752219 1415036539 /nfs/dbraw/zinc/03/65/39/1415036539.db2.gz XPGYLFXEWADNLK-OAHLLOKOSA-N 0 0 396.490 3.192 20 5 GGBDRN Cc1cc(=O)n(CC(=O)Nc2c(Cl)cccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000177795801 1428860298 /nfs/dbraw/zinc/86/02/98/1428860298.db2.gz QXRICKSPQLILDN-UHFFFAOYSA-N 0 0 389.717 3.376 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H](Oc2cccc(Cl)c2)C1 ZINC000124777413 1415041961 /nfs/dbraw/zinc/04/19/61/1415041961.db2.gz AKRNMTLMKPTFTE-AWEZNQCLSA-N 0 0 386.795 3.418 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000124781844 1415042748 /nfs/dbraw/zinc/04/27/48/1415042748.db2.gz GJDXNZSTOCKQBU-INIZCTEOSA-N 0 0 379.338 3.287 20 5 GGBDRN Cc1cccc(OC[C@@H](O)CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000124786061 1415043591 /nfs/dbraw/zinc/04/35/91/1415043591.db2.gz ZCEWAQDXNUKZAA-HNNXBMFYSA-N 0 0 398.337 3.092 20 5 GGBDRN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000124807498 1415049042 /nfs/dbraw/zinc/04/90/42/1415049042.db2.gz LHSQUXQZVBFWJF-UHFFFAOYSA-N 0 0 396.422 3.454 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1)C1CC1 ZINC000124823688 1415052685 /nfs/dbraw/zinc/05/26/85/1415052685.db2.gz WHCCILXMGLROOV-UHFFFAOYSA-N 0 0 383.404 3.123 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc(N2CCNC2=O)c1C)c1cccc([N+](=O)[O-])c1 ZINC000177805486 1428861793 /nfs/dbraw/zinc/86/17/93/1428861793.db2.gz YVJWERPXBKAHJO-QGZVFWFLSA-N 0 0 382.420 3.314 20 5 GGBDRN CC[C@H](NC(=O)CCNC(=O)N(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000177805096 1428861922 /nfs/dbraw/zinc/86/19/22/1428861922.db2.gz GJXFCPXWPLQGAN-IBGZPJMESA-N 0 0 398.463 3.394 20 5 GGBDRN C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])CC2)C1 ZINC000124854137 1415059598 /nfs/dbraw/zinc/05/95/98/1415059598.db2.gz NEIZFXVMUMSJTD-CYBMUJFWSA-N 0 0 393.871 3.359 20 5 GGBDRN C[C@H]1CCC[C@@H](CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000124870030 1415063390 /nfs/dbraw/zinc/06/33/90/1415063390.db2.gz DFZXMYYSQDXHNW-WDEREUQCSA-N 0 0 385.367 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)N1CCC[C@H]2CCC[C@@H]21 ZINC000124878684 1415065093 /nfs/dbraw/zinc/06/50/93/1415065093.db2.gz WIEDTQKSGPMUTH-PWSUYJOCSA-N 0 0 389.271 3.311 20 5 GGBDRN CC(C)(C(=O)NCC1(c2ccc(F)cc2Cl)CC1)n1cc([N+](=O)[O-])cn1 ZINC000124881414 1415066303 /nfs/dbraw/zinc/06/63/03/1415066303.db2.gz VQIXRHZGFWOKMF-UHFFFAOYSA-N 0 0 380.807 3.167 20 5 GGBDRN O=C(NC1CCCCCCC1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000124890818 1415067792 /nfs/dbraw/zinc/06/77/92/1415067792.db2.gz YDLIBHZQMFCIHG-UHFFFAOYSA-N 0 0 388.468 3.175 20 5 GGBDRN Cc1c(CS(=O)(=O)CCCOCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000124921922 1415073370 /nfs/dbraw/zinc/07/33/70/1415073370.db2.gz LLXGJASYCTZQSK-UHFFFAOYSA-N 0 0 377.462 3.467 20 5 GGBDRN CC[C@H](NC(=O)c1cccc(N2CCCNC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000177784705 1428857789 /nfs/dbraw/zinc/85/77/89/1428857789.db2.gz RLGPEDWHESWRLV-SFHVURJKSA-N 0 0 382.420 3.396 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000177785549 1428857840 /nfs/dbraw/zinc/85/78/40/1428857840.db2.gz HSXAJFVNLUJPEY-UHFFFAOYSA-N 0 0 396.190 3.141 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(C)(O)CC3)cc2[N+](=O)[O-])C1 ZINC000177784953 1428858015 /nfs/dbraw/zinc/85/80/15/1428858015.db2.gz SWFXGIXDUAHEIR-HUUCEWRRSA-N 0 0 375.469 3.064 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(Cl)c1)Nc1cccc(N2CCCC2=O)c1 ZINC000124947404 1415078866 /nfs/dbraw/zinc/07/88/66/1415078866.db2.gz SEFSTGOFXIVTBE-UHFFFAOYSA-N 0 0 389.795 3.393 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000124958694 1415081296 /nfs/dbraw/zinc/08/12/96/1415081296.db2.gz MVXWGOGBPLNMSW-CQSZACIVSA-N 0 0 394.214 3.437 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000124958466 1415081568 /nfs/dbraw/zinc/08/15/68/1415081568.db2.gz MVXWGOGBPLNMSW-AWEZNQCLSA-N 0 0 394.214 3.437 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(F)cc1F)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000124961806 1415082130 /nfs/dbraw/zinc/08/21/30/1415082130.db2.gz WXHPSVRXFIVUQW-UHFFFAOYSA-N 0 0 399.300 3.300 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cc(-c2ccccc2)ns1 ZINC000124975215 1415084511 /nfs/dbraw/zinc/08/45/11/1415084511.db2.gz FNUUSXFRZILIQK-UHFFFAOYSA-N 0 0 382.401 3.087 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)Oc1cccnc1Cl ZINC000124992728 1415088339 /nfs/dbraw/zinc/08/83/39/1415088339.db2.gz WXMVAHCXUGIUKM-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN Cn1nnnc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000124996984 1415088757 /nfs/dbraw/zinc/08/87/57/1415088757.db2.gz YCGRLHJHDYFOFT-UHFFFAOYSA-N 0 0 392.297 3.056 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1cccnc1Br ZINC000124999105 1415089191 /nfs/dbraw/zinc/08/91/91/1415089191.db2.gz HDDOMKZTLLBNQC-UHFFFAOYSA-N 0 0 387.211 3.082 20 5 GGBDRN COCCC1(CNS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CCCC1 ZINC000125011103 1415091234 /nfs/dbraw/zinc/09/12/34/1415091234.db2.gz QEYVUEOACMHWMC-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)Oc1cccnc1Br ZINC000125017285 1415092412 /nfs/dbraw/zinc/09/24/12/1415092412.db2.gz MOMPXMRLUGTGOQ-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN Cc1ccc(C(=O)NCc2ccc(NC(=O)C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000125017970 1415092494 /nfs/dbraw/zinc/09/24/94/1415092494.db2.gz KBUFCRTXPFPPIQ-UHFFFAOYSA-N 0 0 381.310 3.334 20 5 GGBDRN CCOc1ccc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1F ZINC000125029334 1415094721 /nfs/dbraw/zinc/09/47/21/1415094721.db2.gz FJHAKCGFNNGVKY-UHFFFAOYSA-N 0 0 385.355 3.274 20 5 GGBDRN COCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000125047590 1415099195 /nfs/dbraw/zinc/09/91/95/1415099195.db2.gz FXGLXDHVNPZQJR-UHFFFAOYSA-N 0 0 385.298 3.286 20 5 GGBDRN Cc1c(NC(=O)CCN2CCC[C@H]2C(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000177824401 1428865631 /nfs/dbraw/zinc/86/56/31/1428865631.db2.gz GRXZVEKNLIZVBD-INIZCTEOSA-N 0 0 377.441 3.038 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccco1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000125074569 1415104072 /nfs/dbraw/zinc/10/40/72/1415104072.db2.gz LOZLQPIVRATOKV-TVQRCGJNSA-N 0 0 383.198 3.192 20 5 GGBDRN CC(C)CO[C@@H]1C[C@@H](OC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C1(C)C ZINC000125087986 1415106572 /nfs/dbraw/zinc/10/65/72/1415106572.db2.gz HDKQOXPONGISOE-IAGOWNOFSA-N 0 0 388.424 3.172 20 5 GGBDRN CC(C)CO[C@H]1C[C@@H](OC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C1(C)C ZINC000125088212 1415106648 /nfs/dbraw/zinc/10/66/48/1415106648.db2.gz HDKQOXPONGISOE-DLBZAZTESA-N 0 0 388.424 3.172 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC(CN3CCCCC3=O)CC2)c1 ZINC000125126136 1415114793 /nfs/dbraw/zinc/11/47/93/1415114793.db2.gz RSIAZVQRJGISDZ-UHFFFAOYSA-N 0 0 391.493 3.181 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000177832118 1428867711 /nfs/dbraw/zinc/86/77/11/1428867711.db2.gz QDGNIKWHBUZVQU-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN O=C(NCCc1cn2ccccc2n1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125174205 1415123926 /nfs/dbraw/zinc/12/39/26/1415123926.db2.gz WCKNPJIBFFKZPW-UHFFFAOYSA-N 0 0 378.310 3.234 20 5 GGBDRN COC(=O)c1ccc(CN(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000125182731 1415125490 /nfs/dbraw/zinc/12/54/90/1415125490.db2.gz JRQOELOXTNFNAC-UHFFFAOYSA-N 0 0 382.376 3.063 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000177833625 1428868146 /nfs/dbraw/zinc/86/81/46/1428868146.db2.gz CVPXISUESATOSO-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)Oc2ccc(Br)nc2)cc1C ZINC000125211495 1415131622 /nfs/dbraw/zinc/13/16/22/1415131622.db2.gz XJJCPJNDCFSVGP-UHFFFAOYSA-N 0 0 387.211 3.137 20 5 GGBDRN CCOc1ccc(N(C)C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000125226542 1415133980 /nfs/dbraw/zinc/13/39/80/1415133980.db2.gz XEUKOZYVHKLGGK-UHFFFAOYSA-N 0 0 391.811 3.040 20 5 GGBDRN O=C(Nc1ccc2c(c1)NC(=O)CO2)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125236211 1415136225 /nfs/dbraw/zinc/13/62/25/1415136225.db2.gz OFERJCHJWZRVTF-UHFFFAOYSA-N 0 0 381.266 3.197 20 5 GGBDRN CC(C)(C(N)=O)c1ccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000125301368 1415157529 /nfs/dbraw/zinc/15/75/29/1415157529.db2.gz KIKRIURFBVYNHH-UHFFFAOYSA-N 0 0 384.436 3.189 20 5 GGBDRN CCC(=O)N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000177821740 1428865148 /nfs/dbraw/zinc/86/51/48/1428865148.db2.gz SXXWSGKINGKDNG-CQSZACIVSA-N 0 0 399.472 3.487 20 5 GGBDRN Cc1c(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cnn1CC(C)C ZINC000125320098 1415163568 /nfs/dbraw/zinc/16/35/68/1415163568.db2.gz BYAUOKWJNGBZBQ-UHFFFAOYSA-N 0 0 386.452 3.439 20 5 GGBDRN C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 ZINC000125328995 1415166544 /nfs/dbraw/zinc/16/65/44/1415166544.db2.gz XSYSZIZNHQCRJN-INIZCTEOSA-N 0 0 397.475 3.165 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)[C@@H](C)CS(=O)(=O)c1ccc(F)cc1 ZINC000125337482 1415167806 /nfs/dbraw/zinc/16/78/06/1415167806.db2.gz XWYVMWMDQKQOQP-LBPRGKRZSA-N 0 0 381.381 3.058 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c1 ZINC000125339796 1415168720 /nfs/dbraw/zinc/16/87/20/1415168720.db2.gz SGBXQGWLPDINND-UHFFFAOYSA-N 0 0 392.755 3.077 20 5 GGBDRN CCN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])S(=O)(=O)c1ccc(C)cc1 ZINC000125357021 1415174192 /nfs/dbraw/zinc/17/41/92/1415174192.db2.gz XLGRKODJXFVVLD-UHFFFAOYSA-N 0 0 382.825 3.408 20 5 GGBDRN COc1cccc(-c2nnc(SCc3nc4cc([N+](=O)[O-])ccc4o3)n2N)c1 ZINC000125373505 1415179564 /nfs/dbraw/zinc/17/95/64/1415179564.db2.gz IEAYEDIEFHBPLO-UHFFFAOYSA-N 0 0 398.404 3.009 20 5 GGBDRN COc1ccc(OCc2nc(COc3ccc(F)cc3)no2)c([N+](=O)[O-])c1 ZINC000125382806 1415181671 /nfs/dbraw/zinc/18/16/71/1415181671.db2.gz MZOFUPYRDRDPMC-UHFFFAOYSA-N 0 0 375.312 3.284 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](CC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000125381053 1415181689 /nfs/dbraw/zinc/18/16/89/1415181689.db2.gz YQWSNOAARIBUJW-JKSUJKDBSA-N 0 0 390.484 3.240 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 ZINC000125405565 1415189613 /nfs/dbraw/zinc/18/96/13/1415189613.db2.gz GXATVESQYHRJNK-NSHDSACASA-N 0 0 395.412 3.063 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCCNC(=O)c2ccsc2)cc1[N+](=O)[O-] ZINC000177854882 1428874045 /nfs/dbraw/zinc/87/40/45/1428874045.db2.gz ZICVHUBPPWTQFG-ZDUSSCGKSA-N 0 0 375.450 3.352 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c(F)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125444604 1415200545 /nfs/dbraw/zinc/20/05/45/1415200545.db2.gz NKJBAUUFFYLRKB-HNNXBMFYSA-N 0 0 399.426 3.056 20 5 GGBDRN CCS(=O)(=O)c1ccc(F)c(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177857505 1428874419 /nfs/dbraw/zinc/87/44/19/1428874419.db2.gz FSQGFALUXDTTDZ-GFCCVEGCSA-N 0 0 394.424 3.327 20 5 GGBDRN CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177859397 1428875418 /nfs/dbraw/zinc/87/54/18/1428875418.db2.gz COIZDGSHSZUTMP-VLIAUNLRSA-N 0 0 381.432 3.054 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])s1 ZINC000125462524 1415206491 /nfs/dbraw/zinc/20/64/91/1415206491.db2.gz GNPOEPWRUTYBQE-GFCCVEGCSA-N 0 0 391.449 3.333 20 5 GGBDRN C[C@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc(-c2ccccc2)no1 ZINC000125468420 1415208084 /nfs/dbraw/zinc/20/80/84/1415208084.db2.gz CRFVIYIBVJQQJL-CQSZACIVSA-N 0 0 395.419 3.001 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(C(=O)N3CCCC3)n2)cc1[N+](=O)[O-] ZINC000177870297 1428878789 /nfs/dbraw/zinc/87/87/89/1428878789.db2.gz IRLFGCAEOCLEIJ-AWEZNQCLSA-N 0 0 382.420 3.025 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)cc1[N+](=O)[O-] ZINC000177862689 1428876437 /nfs/dbraw/zinc/87/64/37/1428876437.db2.gz HZMFKAKCYWAADD-SWLSCSKDSA-N 0 0 379.482 3.028 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1noc(-c2ccccc2)n1 ZINC000125482369 1415211753 /nfs/dbraw/zinc/21/17/53/1415211753.db2.gz RIUZIBSNVVUMFK-JTQLQIEISA-N 0 0 383.320 3.044 20 5 GGBDRN COc1ccc(N2C[C@H](C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)CC2=O)cc1 ZINC000177872880 1428878838 /nfs/dbraw/zinc/87/88/38/1428878838.db2.gz IENAOOXXIVFBLH-GOEBONIOSA-N 0 0 397.431 3.142 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCNC(=O)N(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000177862815 1428876929 /nfs/dbraw/zinc/87/69/29/1428876929.db2.gz DPDIHYHSHZLSMH-INIZCTEOSA-N 0 0 398.463 3.312 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1[N+](=O)[O-] ZINC000177864040 1428877024 /nfs/dbraw/zinc/87/70/24/1428877024.db2.gz AOUPWTGFYWPUAE-HNNXBMFYSA-N 0 0 392.415 3.004 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCN(C)c2ccccc21 ZINC000125487452 1415212950 /nfs/dbraw/zinc/21/29/50/1415212950.db2.gz RGGRBTCINYDJPW-UHFFFAOYSA-N 0 0 381.841 3.202 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1csc([N+](=O)[O-])c1 ZINC000177867795 1428877667 /nfs/dbraw/zinc/87/76/67/1428877667.db2.gz KRBYWKUICTWHOL-CYBMUJFWSA-N 0 0 388.323 3.060 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)COc2ccc(N3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000177865745 1428877766 /nfs/dbraw/zinc/87/77/66/1428877766.db2.gz QBHDYVABRYMLPF-OAHLLOKOSA-N 0 0 397.431 3.286 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1ccc(CN2CCCC2=O)cc1 ZINC000125509820 1415216818 /nfs/dbraw/zinc/21/68/18/1415216818.db2.gz ZZFQCRFULZJRRM-FMIVXFBMSA-N 0 0 379.416 3.047 20 5 GGBDRN COc1cc(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000125517917 1415218971 /nfs/dbraw/zinc/21/89/71/1415218971.db2.gz ZSXRJPDIGOIZHK-LBPRGKRZSA-N 0 0 382.376 3.187 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000177835891 1428869088 /nfs/dbraw/zinc/86/90/88/1428869088.db2.gz GMBWYQVKRVQTEP-APWZRJJASA-N 0 0 395.459 3.314 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000177836086 1428869123 /nfs/dbraw/zinc/86/91/23/1428869123.db2.gz MCBANKLHSKYOHS-QAPCUYQASA-N 0 0 396.447 3.028 20 5 GGBDRN O=C(Nc1cnn(C[C@@H]2CCCO2)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000125533094 1415221856 /nfs/dbraw/zinc/22/18/56/1415221856.db2.gz NJLCKQKHNYGVRC-SFHVURJKSA-N 0 0 385.424 3.167 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(N3CCCNC3=O)c2)cc1[N+](=O)[O-] ZINC000177837274 1428869330 /nfs/dbraw/zinc/86/93/30/1428869330.db2.gz MUSVVZPYNICWBG-CQSZACIVSA-N 0 0 382.420 3.314 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(N3CCCNC3=O)c2)cc1[N+](=O)[O-] ZINC000177837280 1428869399 /nfs/dbraw/zinc/86/93/99/1428869399.db2.gz MUSVVZPYNICWBG-AWEZNQCLSA-N 0 0 382.420 3.314 20 5 GGBDRN CC(C)N(CC(=O)OC(C)(C)C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000125540826 1415222831 /nfs/dbraw/zinc/22/28/31/1415222831.db2.gz AWSYJBUCWGPBFU-UHFFFAOYSA-N 0 0 376.413 3.197 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(N3CCNC3=O)ccc2F)cc1[N+](=O)[O-] ZINC000177836976 1428869521 /nfs/dbraw/zinc/86/95/21/1428869521.db2.gz VUNBMVTZZGBVAH-GFCCVEGCSA-N 0 0 386.383 3.063 20 5 GGBDRN O=[N+]([O-])c1ccc[nH]c1=NNS(=O)(=O)c1ccc(C2CCCCC2)cc1 ZINC000125545918 1415223949 /nfs/dbraw/zinc/22/39/49/1415223949.db2.gz DNPWQCDYUQANET-UHFFFAOYSA-N 0 0 376.438 3.343 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cc(Cl)ccc2-n2cnnn2)cc1[N+](=O)[O-] ZINC000177840483 1428869791 /nfs/dbraw/zinc/86/97/91/1428869791.db2.gz CPNBCIIOKMVPIB-NSHDSACASA-N 0 0 386.799 3.023 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(Cl)ccc2-n2cnnn2)cc1[N+](=O)[O-] ZINC000177840474 1428869799 /nfs/dbraw/zinc/86/97/99/1428869799.db2.gz CPNBCIIOKMVPIB-LLVKDONJSA-N 0 0 386.799 3.023 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)Cc2cccc(N(C)C)c2)c1C ZINC000125552744 1415224815 /nfs/dbraw/zinc/22/48/15/1415224815.db2.gz NSWJMXRTQSWKNA-UHFFFAOYSA-N 0 0 377.466 3.098 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccc3c(c2)CCO3)ccc1Br ZINC000177840606 1428869874 /nfs/dbraw/zinc/86/98/74/1428869874.db2.gz UJFXMRHEKOZIKJ-UHFFFAOYSA-N 0 0 399.222 3.093 20 5 GGBDRN CC[C@@H]1CN(Cc2cc(OC)c(OCC(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000125558556 1415226469 /nfs/dbraw/zinc/22/64/69/1415226469.db2.gz NWTZAJUYGJTQPR-GFCCVEGCSA-N 0 0 378.347 3.155 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(CN3CCCC3=O)cc2)c1 ZINC000125563682 1415227521 /nfs/dbraw/zinc/22/75/21/1415227521.db2.gz UNNCWEGCHLRAFO-UHFFFAOYSA-N 0 0 399.472 3.369 20 5 GGBDRN COc1ccc(N2C[C@@H](C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)CC2=O)cc1 ZINC000177872903 1428879187 /nfs/dbraw/zinc/87/91/87/1428879187.db2.gz IENAOOXXIVFBLH-HOCLYGCPSA-N 0 0 397.431 3.142 20 5 GGBDRN COc1ccc(N2C[C@@H](C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)CC2=O)cc1 ZINC000177872890 1428879257 /nfs/dbraw/zinc/87/92/57/1428879257.db2.gz IENAOOXXIVFBLH-ZBFHGGJFSA-N 0 0 397.431 3.142 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](C)c2noc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000125578487 1415230421 /nfs/dbraw/zinc/23/04/21/1415230421.db2.gz RRONSYZEHCRTFK-SECBINFHSA-N 0 0 394.434 3.054 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CCCCN2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000177875057 1428879756 /nfs/dbraw/zinc/87/97/56/1428879756.db2.gz JBKJZCPTRBCSIJ-GOEBONIOSA-N 0 0 385.420 3.368 20 5 GGBDRN Nc1cc(CCCNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)nn1-c1ccccc1 ZINC000125612571 1415238307 /nfs/dbraw/zinc/23/83/07/1415238307.db2.gz PBMGEAWIHDULDJ-JLHYYAGUSA-N 0 0 391.431 3.125 20 5 GGBDRN CC(C)c1nnc(CSCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)o1 ZINC000125621655 1415239888 /nfs/dbraw/zinc/23/98/88/1415239888.db2.gz LXPPFIAUOWXNCA-UHFFFAOYSA-N 0 0 378.410 3.333 20 5 GGBDRN C[C@@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc(-c2ccccc2)no1 ZINC000125632768 1415242146 /nfs/dbraw/zinc/24/21/46/1415242146.db2.gz RWDQUBLTDSPZEP-AWEZNQCLSA-N 0 0 395.419 3.367 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(OC2CCCCC2)CC1 ZINC000125635126 1415242715 /nfs/dbraw/zinc/24/27/15/1415242715.db2.gz PVSMTFMCKWEGNI-UHFFFAOYSA-N 0 0 391.468 3.356 20 5 GGBDRN Cc1ccc([C@@H](O)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000125638505 1415243579 /nfs/dbraw/zinc/24/35/79/1415243579.db2.gz DBMVYCMXAKVDAL-INIZCTEOSA-N 0 0 393.237 3.058 20 5 GGBDRN Cc1ccc([C@H](O)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000125638297 1415243621 /nfs/dbraw/zinc/24/36/21/1415243621.db2.gz DBMVYCMXAKVDAL-MRXNPFEDSA-N 0 0 393.237 3.058 20 5 GGBDRN Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000125649120 1415246079 /nfs/dbraw/zinc/24/60/79/1415246079.db2.gz DLOCEVOLZHOXTP-KBXCAEBGSA-N 0 0 399.472 3.084 20 5 GGBDRN C[C@@H](OC1CCCCCC1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125649900 1415246475 /nfs/dbraw/zinc/24/64/75/1415246475.db2.gz ZBICGGPPLGQDTM-CABCVRRESA-N 0 0 376.457 3.131 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000125651327 1415246528 /nfs/dbraw/zinc/24/65/28/1415246528.db2.gz ZIRPGJISLYMLFG-AWEZNQCLSA-N 0 0 377.466 3.425 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000125675068 1415252117 /nfs/dbraw/zinc/25/21/17/1415252117.db2.gz GYNONQUUBFPBPI-CRAIPNDOSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1nc(COc2cccc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)c2)no1 ZINC000125687804 1415254669 /nfs/dbraw/zinc/25/46/69/1415254669.db2.gz WTKOYQBCDAIKKN-UHFFFAOYSA-N 0 0 394.387 3.064 20 5 GGBDRN CC1(C)C[C@H](NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000125691564 1415255167 /nfs/dbraw/zinc/25/51/67/1415255167.db2.gz GDDIGEWJTMAFJS-CQSZACIVSA-N 0 0 377.441 3.105 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1[N+](=O)[O-] ZINC000125695151 1415256448 /nfs/dbraw/zinc/25/64/48/1415256448.db2.gz FAIPHGCOSLOEJX-UHFFFAOYSA-N 0 0 397.434 3.226 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H](c2ccccc2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000125698226 1415256728 /nfs/dbraw/zinc/25/67/28/1415256728.db2.gz WLCDBZIVJFUGMH-CQSZACIVSA-N 0 0 398.506 3.045 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)[C@@H]1CC1(Cl)Cl)c1ccccc1[N+](=O)[O-] ZINC000125712117 1415259745 /nfs/dbraw/zinc/25/97/45/1415259745.db2.gz VKYJNVAJSGUTQZ-NWDGAFQWSA-N 0 0 389.235 3.288 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000125712529 1415260253 /nfs/dbraw/zinc/26/02/53/1415260253.db2.gz KGHRIPFVDGZOCW-CRAIPNDOSA-N 0 0 397.431 3.126 20 5 GGBDRN COc1ccc(COc2cccc(F)c2)cc1NC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000125719078 1415261797 /nfs/dbraw/zinc/26/17/97/1415261797.db2.gz BGKOBHWNJQOYEP-UHFFFAOYSA-N 0 0 386.339 3.297 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1 ZINC000177892208 1428885443 /nfs/dbraw/zinc/88/54/43/1428885443.db2.gz NCHMCEFKPAWZPQ-KRWDZBQOSA-N 0 0 377.404 3.461 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000125765718 1415274051 /nfs/dbraw/zinc/27/40/51/1415274051.db2.gz WJOCHQCJKIEQKQ-ZFWWWQNUSA-N 0 0 396.490 3.242 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1nn(-c2ccccc2)c2c1CCC2 ZINC000125781617 1415279378 /nfs/dbraw/zinc/27/93/78/1415279378.db2.gz PXAOCJTUJZMXAB-UHFFFAOYSA-N 0 0 376.416 3.242 20 5 GGBDRN CC[C@H](NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)c1ccc(F)cc1F ZINC000125786117 1415280450 /nfs/dbraw/zinc/28/04/50/1415280450.db2.gz CCSWATVRTXPVKD-INIZCTEOSA-N 0 0 387.346 3.335 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000125792936 1415282228 /nfs/dbraw/zinc/28/22/28/1415282228.db2.gz DUFZBGBTKBEFLK-HIFRSBDPSA-N 0 0 396.490 3.242 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)CCNC(=O)COc1ccccc1[N+](=O)[O-] ZINC000125804553 1415285382 /nfs/dbraw/zinc/28/53/82/1415285382.db2.gz QEBWGOYNQUJUID-UHFFFAOYSA-N 0 0 391.811 3.080 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@H]2C[C@@H](O)c2cccs2)cc1 ZINC000125813706 1415288415 /nfs/dbraw/zinc/28/84/15/1415288415.db2.gz PNBNUWYWJVTRGW-JKSUJKDBSA-N 0 0 396.490 3.074 20 5 GGBDRN CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000125816642 1415288763 /nfs/dbraw/zinc/28/87/63/1415288763.db2.gz QAFUHSOXVNDOET-PWSUYJOCSA-N 0 0 385.367 3.220 20 5 GGBDRN O=C(Nc1cccc(C(=O)N2CCSCC2)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000125837911 1415294303 /nfs/dbraw/zinc/29/43/03/1415294303.db2.gz HERWHBIZCNOLAH-UHFFFAOYSA-N 0 0 389.408 3.175 20 5 GGBDRN NC(=O)CCN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000125863965 1415300460 /nfs/dbraw/zinc/30/04/60/1415300460.db2.gz FFNVBYMSWHZSAX-UHFFFAOYSA-N 0 0 381.310 3.136 20 5 GGBDRN Cc1ccc(CNc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)cc1[N+](=O)[O-] ZINC000125884605 1415304295 /nfs/dbraw/zinc/30/42/95/1415304295.db2.gz UGYNZVBQTWKAOH-KRWDZBQOSA-N 0 0 383.448 3.360 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000125889317 1415305460 /nfs/dbraw/zinc/30/54/60/1415305460.db2.gz RQROCYKSGPKKNL-KXBFYZLASA-N 0 0 383.452 3.115 20 5 GGBDRN CN(C)C(=O)Nc1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000125958431 1415322396 /nfs/dbraw/zinc/32/23/96/1415322396.db2.gz NENALWZWLXPPGN-UHFFFAOYSA-N 0 0 390.827 3.314 20 5 GGBDRN COc1cc(CCNC(=O)c2cccc(Cl)c2F)c([N+](=O)[O-])cc1OC ZINC000177959245 1428901721 /nfs/dbraw/zinc/90/17/21/1428901721.db2.gz QPVKBPRJJPBXEO-UHFFFAOYSA-N 0 0 382.775 3.377 20 5 GGBDRN CC[C@H]1CCCC[C@H]1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125979893 1415328758 /nfs/dbraw/zinc/32/87/58/1415328758.db2.gz WANKAEGLFWXXGG-MAUKXSAKSA-N 0 0 388.468 3.031 20 5 GGBDRN CC[C@H]1CCCC[C@@H]1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125979618 1415328957 /nfs/dbraw/zinc/32/89/57/1415328957.db2.gz WANKAEGLFWXXGG-YJBOKZPZSA-N 0 0 388.468 3.031 20 5 GGBDRN CC[C@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1F ZINC000125984650 1415329214 /nfs/dbraw/zinc/32/92/14/1415329214.db2.gz LRNLQXJCQDYPBH-AWEZNQCLSA-N 0 0 391.330 3.048 20 5 GGBDRN COc1cc(C(=O)NC2CC=CC2)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000125987996 1415330160 /nfs/dbraw/zinc/33/01/60/1415330160.db2.gz JWOJZUPXEHMICA-UHFFFAOYSA-N 0 0 375.406 3.087 20 5 GGBDRN CC(C)[C@H]1OCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000177961753 1428902592 /nfs/dbraw/zinc/90/25/92/1428902592.db2.gz WBAYAHNKKLDYBI-HNAYVOBHSA-N 0 0 375.469 3.376 20 5 GGBDRN CC(C)[C@H]1OCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000177961778 1428902602 /nfs/dbraw/zinc/90/26/02/1428902602.db2.gz WBAYAHNKKLDYBI-DNVCBOLYSA-N 0 0 375.469 3.376 20 5 GGBDRN CS[C@H](CO)[C@H](C)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000126000513 1415333141 /nfs/dbraw/zinc/33/31/41/1415333141.db2.gz ROWLENBBWOAWGM-SCLBCKFNSA-N 0 0 389.477 3.049 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1c(Cl)cccc1Cl ZINC000126001383 1415333685 /nfs/dbraw/zinc/33/36/85/1415333685.db2.gz XAYVELFPLPCLTH-OAHLLOKOSA-N 0 0 398.246 3.477 20 5 GGBDRN Cc1c(C(=O)N2CCO[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126008752 1415335560 /nfs/dbraw/zinc/33/55/60/1415335560.db2.gz KTEDRGGIRCTFIN-QGZVFWFLSA-N 0 0 385.376 3.334 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1 ZINC000126018135 1415337744 /nfs/dbraw/zinc/33/77/44/1415337744.db2.gz ZPVVVOCRTHNSGQ-UHFFFAOYSA-N 0 0 395.419 3.203 20 5 GGBDRN Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126027339 1415339558 /nfs/dbraw/zinc/33/95/58/1415339558.db2.gz DIDVQBWQTZVGHP-FQEVSTJZSA-N 0 0 397.475 3.407 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCC(Cc2cccc(F)c2)CC1 ZINC000126038779 1415341765 /nfs/dbraw/zinc/34/17/65/1415341765.db2.gz CLLKWZAONMAMHO-UHFFFAOYSA-N 0 0 385.395 3.154 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000126041649 1415342851 /nfs/dbraw/zinc/34/28/51/1415342851.db2.gz OSURLIFIROHMPP-UHFFFAOYSA-N 0 0 398.463 3.343 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NCCc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000126056267 1415346808 /nfs/dbraw/zinc/34/68/08/1415346808.db2.gz WQEZNESPTWADAR-LJQANCHMSA-N 0 0 395.459 3.114 20 5 GGBDRN O=C(c1ccc(N2CCC(O)CC2)cc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126068474 1415350146 /nfs/dbraw/zinc/35/01/46/1415350146.db2.gz WTFLRJVLJUGOIV-UHFFFAOYSA-N 0 0 395.459 3.361 20 5 GGBDRN Cc1nc(-c2cccc(C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)c2)n[nH]1 ZINC000126071169 1415350701 /nfs/dbraw/zinc/35/07/01/1415350701.db2.gz NMOMRALKHYVQAH-UHFFFAOYSA-N 0 0 377.404 3.493 20 5 GGBDRN CC(C)(C)OC(=O)N1CC(CC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000126086757 1415354729 /nfs/dbraw/zinc/35/47/29/1415354729.db2.gz NBBHMTCZWHFLJN-UHFFFAOYSA-N 0 0 389.452 3.343 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCCN(C(=O)c2ccccc2F)CC1 ZINC000126100845 1415358142 /nfs/dbraw/zinc/35/81/42/1415358142.db2.gz OECHKYZMVIAGBD-UHFFFAOYSA-N 0 0 387.411 3.091 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000126109176 1415359822 /nfs/dbraw/zinc/35/98/22/1415359822.db2.gz GMUMFNLBDMHCJV-LLVKDONJSA-N 0 0 399.234 3.319 20 5 GGBDRN CC(C)(C)c1nc(CCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000126130799 1415365969 /nfs/dbraw/zinc/36/59/69/1415365969.db2.gz 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GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCO[C@@H](c2ccccc2C)C1 ZINC000126217352 1415386665 /nfs/dbraw/zinc/38/66/65/1415386665.db2.gz TYZOCDNAQPQYOD-MGPUTAFESA-N 0 0 399.447 3.312 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)nc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126221598 1415387381 /nfs/dbraw/zinc/38/73/81/1415387381.db2.gz VSGUDWLDNJITCU-UHFFFAOYSA-N 0 0 396.325 3.098 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CC[C@H](Cc2ccccc2)C1 ZINC000126224344 1415388253 /nfs/dbraw/zinc/38/82/53/1415388253.db2.gz BPIZUHBVJWMGLX-QGZVFWFLSA-N 0 0 376.416 3.485 20 5 GGBDRN Cc1ccc(CN2CCOCC2)cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000126247400 1415393393 /nfs/dbraw/zinc/39/33/93/1415393393.db2.gz ZTSRWVBFFASEFX-RMKNXTFCSA-N 0 0 381.432 3.387 20 5 GGBDRN COc1ccc(C(=O)NCc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000126254688 1415395209 /nfs/dbraw/zinc/39/52/09/1415395209.db2.gz ZWDGPVJVGNSSIP-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN CCCOc1cccc(CC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 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Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cccc(-c3cnco3)c2)cc1[N+](=O)[O-] ZINC000178060958 1428963163 /nfs/dbraw/zinc/96/31/63/1428963163.db2.gz VWMAWMPGUMNXCP-CYBMUJFWSA-N 0 0 394.387 3.374 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000178060747 1428963203 /nfs/dbraw/zinc/96/32/03/1428963203.db2.gz MSNRMLMSBICCIP-OAHLLOKOSA-N 0 0 396.447 3.319 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1ccc2[nH]c(C3CCCCC3)nc2c1 ZINC000127216854 1415689848 /nfs/dbraw/zinc/68/98/48/1415689848.db2.gz OLPXLQIGHQEMPX-UHFFFAOYSA-N 0 0 395.419 3.319 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2c(F)cc(F)cc2F)cc1[N+](=O)[O-] ZINC000178062633 1428963654 /nfs/dbraw/zinc/96/36/54/1428963654.db2.gz ABJPAOVRBMIBLN-VIFPVBQESA-N 0 0 381.310 3.136 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2c(F)cc(F)cc2F)cc1[N+](=O)[O-] ZINC000178062619 1428964080 /nfs/dbraw/zinc/96/40/80/1428964080.db2.gz ABJPAOVRBMIBLN-SECBINFHSA-N 0 0 381.310 3.136 20 5 GGBDRN 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ZINC000127239881 1415699799 /nfs/dbraw/zinc/69/97/99/1415699799.db2.gz GDWRHAIBCYCSSN-UHFFFAOYSA-N 0 0 391.811 3.478 20 5 GGBDRN C[C@@H](CCC(C)(C)C)NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000127268623 1415709967 /nfs/dbraw/zinc/70/99/67/1415709967.db2.gz BOYAGZOGUBHZHR-JTQLQIEISA-N 0 0 387.383 3.466 20 5 GGBDRN CC(=O)c1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1C ZINC000127270712 1415710999 /nfs/dbraw/zinc/71/09/99/1415710999.db2.gz LCMLEWWXZOYEMP-UHFFFAOYSA-N 0 0 397.387 3.433 20 5 GGBDRN Cc1cc(C)c(OC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)c([N+](=O)[O-])c1 ZINC000127282863 1415717536 /nfs/dbraw/zinc/71/75/36/1415717536.db2.gz DRDMWEXNDBJKJD-UHFFFAOYSA-N 0 0 383.335 3.116 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000127289076 1415720862 /nfs/dbraw/zinc/72/08/62/1415720862.db2.gz KBCDLUCVFAWCBI-MNOVXSKESA-N 0 0 384.358 3.427 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000127291238 1415722736 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O=C(N[C@@H]1CCSc2ccccc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127362368 1415753057 /nfs/dbraw/zinc/75/30/57/1415753057.db2.gz RQTFULHNZBJXOA-MRXNPFEDSA-N 0 0 399.472 3.398 20 5 GGBDRN O=C(N[C@H]1CCN(C(=O)c2ccccn2)C1)c1cc2ccccc2c2cccnc12 ZINC000178114685 1428988475 /nfs/dbraw/zinc/98/84/75/1428988475.db2.gz KXMZKALMMJRDAI-KRWDZBQOSA-N 0 0 396.450 3.428 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)ccc1-n1cnnn1 ZINC000127378956 1415759826 /nfs/dbraw/zinc/75/98/26/1415759826.db2.gz JHJTYUQQJBRFHC-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN COc1ccc(N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c(OC)c1 ZINC000127402023 1415767104 /nfs/dbraw/zinc/76/71/04/1415767104.db2.gz LQNLLIQAJSKAHI-UHFFFAOYSA-N 0 0 399.447 3.491 20 5 GGBDRN CCOc1ccc2c(c1)CN(S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])CC2 ZINC000127432764 1415777005 /nfs/dbraw/zinc/77/70/05/1415777005.db2.gz XKTCJQYPTPYOBK-UHFFFAOYSA-N 0 0 396.852 3.394 20 5 GGBDRN CCN(Cc1ccccc1C)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127445602 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399.394 3.463 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CCSC[C@@H]2C)c1=S ZINC000178143926 1428998208 /nfs/dbraw/zinc/99/82/08/1428998208.db2.gz BDAJUQCYJRNXBF-LBPRGKRZSA-N 0 0 379.511 3.404 20 5 GGBDRN Cn1cc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C(C)(C)C)n1 ZINC000127514938 1415803579 /nfs/dbraw/zinc/80/35/79/1415803579.db2.gz KQJGAMCXKHXNPS-UHFFFAOYSA-N 0 0 386.452 3.309 20 5 GGBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000127532177 1415805607 /nfs/dbraw/zinc/80/56/07/1415805607.db2.gz NZSKOYYJYCRYRL-ZDUSSCGKSA-N 0 0 396.378 3.311 20 5 GGBDRN COc1ccnc(CSCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)c1 ZINC000127554296 1415809010 /nfs/dbraw/zinc/80/90/10/1415809010.db2.gz URAYMOKLLYXEHL-UHFFFAOYSA-N 0 0 375.406 3.230 20 5 GGBDRN O=c1ccc2cc(S(=O)(=O)Oc3c(Cl)cccc3[N+](=O)[O-])ccc2o1 ZINC000127562590 1415810199 /nfs/dbraw/zinc/81/01/99/1415810199.db2.gz JPTJLYZJCVEYKY-UHFFFAOYSA-N 0 0 381.749 3.122 20 5 GGBDRN CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000178150264 1428999959 /nfs/dbraw/zinc/99/99/59/1428999959.db2.gz YKACVBPTBGWKGZ-UHFFFAOYSA-N 0 0 375.356 3.087 20 5 GGBDRN Cc1ccc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cc1[N+](=O)[O-] ZINC000127585013 1415814294 /nfs/dbraw/zinc/81/42/94/1415814294.db2.gz GMRYOUAQVKFSDM-UHFFFAOYSA-N 0 0 384.360 3.081 20 5 GGBDRN Cc1nc(C)c(S(=O)(=O)Oc2c(Br)cccc2[N+](=O)[O-])s1 ZINC000178151121 1429000518 /nfs/dbraw/zinc/00/05/18/1429000518.db2.gz CJIXMHKAYSXSLN-UHFFFAOYSA-N 0 0 393.240 3.198 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](c1ccccc1)N1CCOCC1 ZINC000127589393 1415815451 /nfs/dbraw/zinc/81/54/51/1415815451.db2.gz NPAKFCPUDDEKQH-IBGZPJMESA-N 0 0 398.463 3.407 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000127596548 1415816269 /nfs/dbraw/zinc/81/62/69/1415816269.db2.gz UOVKXFAWTDEKLF-UHFFFAOYSA-N 0 0 388.561 3.129 20 5 GGBDRN Cc1nn(C)c(C)c1CCOC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000127617258 1415820877 /nfs/dbraw/zinc/82/08/77/1415820877.db2.gz CQDWVCFEQHIAEM-UHFFFAOYSA-N 0 0 386.452 3.335 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CCCc2ccccc2C1 ZINC000127635341 1415824275 /nfs/dbraw/zinc/82/42/75/1415824275.db2.gz PQSJFWJGVOTKQN-UHFFFAOYSA-N 0 0 381.432 3.020 20 5 GGBDRN O=C(N[C@@H]1CCC[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127644802 1415825257 /nfs/dbraw/zinc/82/52/57/1415825257.db2.gz PJSRSETZSZQDJO-PKOBYXMFSA-N 0 0 395.459 3.498 20 5 GGBDRN O=C(N[C@H]1CCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127644595 1415825369 /nfs/dbraw/zinc/82/53/69/1415825369.db2.gz PJSRSETZSZQDJO-MJGOQNOKSA-N 0 0 395.459 3.498 20 5 GGBDRN O=C(N[C@@H]1CCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127645032 1415825449 /nfs/dbraw/zinc/82/54/49/1415825449.db2.gz PJSRSETZSZQDJO-IEBWSBKVSA-N 0 0 395.459 3.498 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)c1[N+](=O)[O-] ZINC000127655639 1415826850 /nfs/dbraw/zinc/82/68/50/1415826850.db2.gz 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Cc1cc(C)cc(CCNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000127681387 1415832128 /nfs/dbraw/zinc/83/21/28/1415832128.db2.gz SQHNVUWBALJUSS-UHFFFAOYSA-N 0 0 383.448 3.021 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CC[C@H](Cc2ccccc2)C1 ZINC000127689742 1415833682 /nfs/dbraw/zinc/83/36/82/1415833682.db2.gz SCHDPQDHRSJMHT-GOSISDBHSA-N 0 0 395.459 3.136 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N)cc2F)C[C@@H](C)O1 ZINC000178168832 1429004951 /nfs/dbraw/zinc/00/49/51/1429004951.db2.gz DIHBWMZKZRWNBJ-VXGBXAGGSA-N 0 0 388.399 3.182 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ncc(-c3ccccc3)o2)c(Cl)c1 ZINC000127692444 1415834188 /nfs/dbraw/zinc/83/41/88/1415834188.db2.gz FXASBKNLMFLJCJ-UHFFFAOYSA-N 0 0 393.808 3.382 20 5 GGBDRN Cc1ccc(N2CC[C@@H](NC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)C2=O)cc1 ZINC000127690539 1415834203 /nfs/dbraw/zinc/83/42/03/1415834203.db2.gz UDORUCJTAREDIC-MRXNPFEDSA-N 0 0 382.420 3.447 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000127698105 1415835250 /nfs/dbraw/zinc/83/52/50/1415835250.db2.gz SKSACTOLMBPIMK-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127704219 1415836137 /nfs/dbraw/zinc/83/61/37/1415836137.db2.gz CRKDJVAUWUBLJY-CABCVRRESA-N 0 0 393.509 3.178 20 5 GGBDRN CCC(CC)[C@@H](CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)N1CCOCC1 ZINC000127709461 1415837281 /nfs/dbraw/zinc/83/72/81/1415837281.db2.gz NGSJFOMJCCIUNC-GOSISDBHSA-N 0 0 392.500 3.470 20 5 GGBDRN CN(Cc1cc2ccccc2o1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127714856 1415837855 /nfs/dbraw/zinc/83/78/55/1415837855.db2.gz XLEVLAUAVXWLFS-UHFFFAOYSA-N 0 0 395.415 3.450 20 5 GGBDRN CCCc1csc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)n1 ZINC000127714239 1415837997 /nfs/dbraw/zinc/83/79/97/1415837997.db2.gz JTDGGSPJYWHVBU-LLVKDONJSA-N 0 0 394.478 3.309 20 5 GGBDRN CCS[C@H]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127720991 1415838856 /nfs/dbraw/zinc/83/88/56/1415838856.db2.gz HNJYAOCZDHMXNK-GJZGRUSLSA-N 0 0 393.509 3.226 20 5 GGBDRN CCOCCC1(CNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])CC1 ZINC000127729783 1415840195 /nfs/dbraw/zinc/84/01/95/1415840195.db2.gz COHMLVJOKSNXPM-UHFFFAOYSA-N 0 0 378.397 3.210 20 5 GGBDRN CCCNC(=O)c1ccc(Cl)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000178171693 1429006295 /nfs/dbraw/zinc/00/62/95/1429006295.db2.gz BSXQXBOTTZZJGL-UHFFFAOYSA-N 0 0 376.800 3.223 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000127761768 1415845935 /nfs/dbraw/zinc/84/59/35/1415845935.db2.gz NOTSPIQEYGHOMI-UHFFFAOYSA-N 0 0 379.420 3.397 20 5 GGBDRN O=C(Nc1cnn(Cc2ccccn2)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178172555 1429006925 /nfs/dbraw/zinc/00/69/25/1429006925.db2.gz GGDCJHVBPRHCEU-UHFFFAOYSA-N 0 0 392.419 3.431 20 5 GGBDRN CCOC(=O)c1cc(N(C)Cc2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000127765554 1415846543 /nfs/dbraw/zinc/84/65/43/1415846543.db2.gz HIWSWABICSZUKQ-SANMLTNESA-N 0 0 376.434 3.145 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nc(-c3c(F)cccc3F)cs2)c1[N+](=O)[O-] ZINC000127763517 1415846577 /nfs/dbraw/zinc/84/65/77/1415846577.db2.gz GOZPSBSZQNZRFR-UHFFFAOYSA-N 0 0 379.348 3.291 20 5 GGBDRN CCOC(=O)c1cc(N(C)Cc2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000127765305 1415846622 /nfs/dbraw/zinc/84/66/22/1415846622.db2.gz HIWSWABICSZUKQ-AREMUKBSSA-N 0 0 376.434 3.145 20 5 GGBDRN O=C(NCCOc1ccc(Cl)cn1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000127779054 1415848777 /nfs/dbraw/zinc/84/87/77/1415848777.db2.gz KAJSIASWEAPJQN-UHFFFAOYSA-N 0 0 390.827 3.052 20 5 GGBDRN O=C(NCC1(Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127779294 1415848963 /nfs/dbraw/zinc/84/89/63/1415848963.db2.gz TZYNATJVXYLFST-UHFFFAOYSA-N 0 0 395.459 3.184 20 5 GGBDRN CCOCCC1(CNc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)CC1 ZINC000127789742 1415851180 /nfs/dbraw/zinc/85/11/80/1415851180.db2.gz IVFPYXFVPBYUAG-UHFFFAOYSA-N 0 0 392.843 3.413 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)n1 ZINC000127798508 1415852819 /nfs/dbraw/zinc/85/28/19/1415852819.db2.gz CTKMXIXEXFCDGO-UHFFFAOYSA-N 0 0 384.367 3.319 20 5 GGBDRN CC(C)OC1CCC(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000127799038 1415852891 /nfs/dbraw/zinc/85/28/91/1415852891.db2.gz QGENYNDBRIZQLN-UHFFFAOYSA-N 0 0 383.832 3.039 20 5 GGBDRN O=C(CSc1nncn1CC(F)(F)F)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000127806235 1415854169 /nfs/dbraw/zinc/85/41/69/1415854169.db2.gz JCUHJTUNFYPJKL-UHFFFAOYSA-N 0 0 395.750 3.133 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)n1 ZINC000178178198 1429008548 /nfs/dbraw/zinc/00/85/48/1429008548.db2.gz BPRHBXCHRJJIMU-GFCCVEGCSA-N 0 0 375.816 3.202 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccccc1CN1CCOCC1 ZINC000127813880 1415855566 /nfs/dbraw/zinc/85/55/66/1415855566.db2.gz RNXNLJAGVGIRTF-UHFFFAOYSA-N 0 0 398.463 3.366 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CCN(C(=O)c2ccoc2)CC1 ZINC000127815415 1415855814 /nfs/dbraw/zinc/85/58/14/1415855814.db2.gz ZTIJWIPCRRIWKB-UHFFFAOYSA-N 0 0 386.408 3.231 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCc1cnn(-c2ccccc2)c1 ZINC000127824589 1415857762 /nfs/dbraw/zinc/85/77/62/1415857762.db2.gz AMIQZQISJJVMIB-UHFFFAOYSA-N 0 0 389.415 3.163 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cn1 ZINC000127825371 1415858097 /nfs/dbraw/zinc/85/80/97/1415858097.db2.gz MHHMNYYVPRZFJX-UHFFFAOYSA-N 0 0 380.408 3.422 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2N)cnn1-c1ccc(F)cc1 ZINC000178180041 1429009660 /nfs/dbraw/zinc/00/96/60/1429009660.db2.gz SSKJULJPKJWLPZ-LLVKDONJSA-N 0 0 383.383 3.301 20 5 GGBDRN C[C@@H](O)[C@H]1CCCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000127849067 1415862423 /nfs/dbraw/zinc/86/24/23/1415862423.db2.gz HYMFRKLPOSPMMY-NEPJUHHUSA-N 0 0 389.374 3.035 20 5 GGBDRN C[C@H](O)[C@@H]1CCCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000127848372 1415862584 /nfs/dbraw/zinc/86/25/84/1415862584.db2.gz HYMFRKLPOSPMMY-NWDGAFQWSA-N 0 0 389.374 3.035 20 5 GGBDRN COC(=O)Cc1ccccc1OC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000127876208 1415867881 /nfs/dbraw/zinc/86/78/81/1415867881.db2.gz PSJQEETWAUQVKB-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N(C)C[C@@H](O)COc2ccccc2C(F)(F)F)n1 ZINC000178183434 1429011064 /nfs/dbraw/zinc/01/10/64/1429011064.db2.gz CJGCCDUZTFQDAW-GFCCVEGCSA-N 0 0 385.342 3.193 20 5 GGBDRN CC[C@H](CCO)CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000127879739 1415869120 /nfs/dbraw/zinc/86/91/20/1415869120.db2.gz AJQCETQKBHLEDY-HUUCEWRRSA-N 0 0 386.452 3.301 20 5 GGBDRN O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@@H]12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000127881231 1415869293 /nfs/dbraw/zinc/86/92/93/1415869293.db2.gz KAOIMIKCCFMLTB-IOMROCGXSA-N 0 0 377.444 3.266 20 5 GGBDRN O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000127889880 1415870982 /nfs/dbraw/zinc/87/09/82/1415870982.db2.gz JIBFFYQBLOPUES-CQSZACIVSA-N 0 0 384.314 3.241 20 5 GGBDRN Nc1c(C(=O)Nc2cccc(C(=O)Nc3ccncc3)c2)cccc1[N+](=O)[O-] ZINC000178185372 1429012013 /nfs/dbraw/zinc/01/20/13/1429012013.db2.gz SRVHHMLWMWGVBN-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN Cc1nn(C)c(C(=O)Oc2ccc(NC(=O)c3ccccc3)cc2)c1[N+](=O)[O-] ZINC000127917298 1415875389 /nfs/dbraw/zinc/87/53/89/1415875389.db2.gz AIUKPHWMYDJXIM-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)c3cc(OC)ccc3[N+](=O)[O-])CC2)c1 ZINC000127923273 1415876003 /nfs/dbraw/zinc/87/60/03/1415876003.db2.gz DCMMHODNMJUAHM-UHFFFAOYSA-N 0 0 385.420 3.329 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1S(=O)(=O)N(C)C ZINC000127926363 1415876496 /nfs/dbraw/zinc/87/64/96/1415876496.db2.gz KHCDKOSIKBBRAF-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCNc1nccc(C(F)(F)F)n1 ZINC000127926579 1415876959 /nfs/dbraw/zinc/87/69/59/1415876959.db2.gz YWRLYEXQXPWHNY-UHFFFAOYSA-N 0 0 398.345 3.254 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCC(c2nc3ccccc3o2)CC1 ZINC000127940068 1415879353 /nfs/dbraw/zinc/87/93/53/1415879353.db2.gz QJYMMMSQVBQFCE-UHFFFAOYSA-N 0 0 394.387 3.081 20 5 GGBDRN CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000127950984 1415881860 /nfs/dbraw/zinc/88/18/60/1415881860.db2.gz JGXQAPQZBAFCEZ-OAQYLSRUSA-N 0 0 398.462 3.471 20 5 GGBDRN Cc1cnn(-c2ccc(S(=O)(=O)Nc3cccc([N+](=O)[O-])c3)cc2F)c1 ZINC000127954232 1415882250 /nfs/dbraw/zinc/88/22/50/1415882250.db2.gz IZMGTZJEUJFASA-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN Nc1c(C(=O)N(CCc2ccccc2)Cc2cccnc2)cccc1[N+](=O)[O-] ZINC000178187963 1429013500 /nfs/dbraw/zinc/01/35/00/1429013500.db2.gz NQBDNGYSOFLRMN-UHFFFAOYSA-N 0 0 376.416 3.457 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1ccc2c(c1)OCCCO2 ZINC000127963081 1415884322 /nfs/dbraw/zinc/88/43/22/1415884322.db2.gz NKPZAWSPTSARKJ-UHFFFAOYSA-N 0 0 381.388 3.096 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC2)c1 ZINC000127988391 1415888755 /nfs/dbraw/zinc/88/87/55/1415888755.db2.gz CBSWUUXRRNIKNG-UHFFFAOYSA-N 0 0 385.420 3.329 20 5 GGBDRN Cc1c(C(=O)NCCc2nc3ccccc3s2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000128000338 1415890852 /nfs/dbraw/zinc/89/08/52/1415890852.db2.gz CJEDSIIPIXOQQA-UHFFFAOYSA-N 0 0 386.389 3.394 20 5 GGBDRN COc1cc(C(=O)NCCc2nc3ccccc3s2)c([N+](=O)[O-])cc1OC ZINC000128016331 1415893720 /nfs/dbraw/zinc/89/37/20/1415893720.db2.gz PVVDLVFGQGHQPE-UHFFFAOYSA-N 0 0 387.417 3.194 20 5 GGBDRN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000178199930 1429016241 /nfs/dbraw/zinc/01/62/41/1429016241.db2.gz XVZBMTDSCCZBBW-UHFFFAOYSA-N 0 0 391.840 3.307 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)CCOc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000128036468 1415897994 /nfs/dbraw/zinc/89/79/94/1415897994.db2.gz AFOCLCFLUDVXTR-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN COC(=O)c1ccccc1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000128042509 1415899195 /nfs/dbraw/zinc/89/91/95/1415899195.db2.gz WHGBQOUAWQVBFG-UHFFFAOYSA-N 0 0 393.193 3.421 20 5 GGBDRN O=C(NC1CC1)c1cccc(OC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000128052723 1415902002 /nfs/dbraw/zinc/90/20/02/1415902002.db2.gz IRDYSVSTFJZUBF-UHFFFAOYSA-N 0 0 381.388 3.281 20 5 GGBDRN COc1ccc([C@H]2CCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000128109069 1415914864 /nfs/dbraw/zinc/91/48/64/1415914864.db2.gz JOIPMIKHZHQWGY-GOSISDBHSA-N 0 0 383.404 3.214 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCN(CC(F)(F)F)[C@H](C)C1 ZINC000128113361 1415915342 /nfs/dbraw/zinc/91/53/42/1415915342.db2.gz WAZCUQWTUMPWEA-NEPJUHHUSA-N 0 0 399.373 3.274 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000128133155 1415921437 /nfs/dbraw/zinc/92/14/37/1415921437.db2.gz CDQYDHZJSISOBH-KRWDZBQOSA-N 0 0 395.459 3.114 20 5 GGBDRN COC(=O)c1cc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)oc1C ZINC000128137805 1415922255 /nfs/dbraw/zinc/92/22/55/1415922255.db2.gz JKTSIXNCOHYDHS-UHFFFAOYSA-N 0 0 386.282 3.232 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCN(C(=O)C2CCCC2)C1 ZINC000128145514 1415923970 /nfs/dbraw/zinc/92/39/70/1415923970.db2.gz 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ZINC000128489193 1415998707 /nfs/dbraw/zinc/99/87/07/1415998707.db2.gz QUQJKBBRGSNQOB-UHFFFAOYSA-N 0 0 398.440 3.254 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000128492539 1415999068 /nfs/dbraw/zinc/99/90/68/1415999068.db2.gz WCLAVMDTJASEOJ-KRWDZBQOSA-N 0 0 392.477 3.173 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)Cn3cc([N+](=O)[O-])c(C)cc3=O)n2)cc1 ZINC000128523176 1416005863 /nfs/dbraw/zinc/00/58/63/1416005863.db2.gz LQBVYIDSNDWHDK-UHFFFAOYSA-N 0 0 384.417 3.136 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1ccccc1N1CCCC1 ZINC000128536834 1416008313 /nfs/dbraw/zinc/00/83/13/1416008313.db2.gz KETYNGGLEYQTIO-UHFFFAOYSA-N 0 0 396.447 3.101 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(CN(C)Cc3ccccc3[N+](=O)[O-])nc2c1 ZINC000178265475 1429037888 /nfs/dbraw/zinc/03/78/88/1429037888.db2.gz JMYCXATXBFGAMA-UHFFFAOYSA-N 0 0 389.433 3.162 20 5 GGBDRN Cc1cccc2c(CCNC(=O)c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)c[nH]c21 ZINC000128540485 1416008919 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ZINC000128690754 1416043383 /nfs/dbraw/zinc/04/33/83/1416043383.db2.gz PIMKHDALHLXSQS-SFHVURJKSA-N 0 0 384.436 3.050 20 5 GGBDRN Cc1cc(=O)n(CC(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)cc1[N+](=O)[O-] ZINC000128688329 1416043584 /nfs/dbraw/zinc/04/35/84/1416043584.db2.gz NQSAECRZYOPPHM-HXUWFJFHSA-N 0 0 387.411 3.252 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)cc1 ZINC000128697529 1416045437 /nfs/dbraw/zinc/04/54/37/1416045437.db2.gz UQFLCYQDUPVJRU-SJLPKXTDSA-N 0 0 394.424 3.011 20 5 GGBDRN Cc1cc(=O)n(CC(=O)Nc2ccccc2Oc2ccccc2)cc1[N+](=O)[O-] ZINC000128706724 1416047404 /nfs/dbraw/zinc/04/74/04/1416047404.db2.gz JGWSQGHXFKCYGD-UHFFFAOYSA-N 0 0 379.372 3.496 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2cccc(COCc3ccccc3)c2)c1[N+](=O)[O-] ZINC000128710042 1416048107 /nfs/dbraw/zinc/04/81/07/1416048107.db2.gz UFFCPXKVWGZVCS-UHFFFAOYSA-N 0 0 394.431 3.284 20 5 GGBDRN O=C(Nc1ccccc1-n1ccnn1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128710098 1416048402 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397.431 3.050 20 5 GGBDRN Cc1cc(=O)n(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)cc1[N+](=O)[O-] ZINC000128758755 1416060834 /nfs/dbraw/zinc/06/08/34/1416060834.db2.gz NTELPFGNMRUHFA-UHFFFAOYSA-N 0 0 380.282 3.182 20 5 GGBDRN O=C(Nc1cc(C2CCCC2)[nH]n1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000128768832 1416063832 /nfs/dbraw/zinc/06/38/32/1416063832.db2.gz KIIODUHWPCHLBI-UHFFFAOYSA-N 0 0 385.424 3.064 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000128781977 1416067881 /nfs/dbraw/zinc/06/78/81/1416067881.db2.gz OLSQETAIQMRCCF-OAHLLOKOSA-N 0 0 394.836 3.157 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000128787338 1416068882 /nfs/dbraw/zinc/06/88/82/1416068882.db2.gz UQPOIEIRNBYVTP-BXKDBHETSA-N 0 0 385.323 3.423 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C(=O)NCc1ccccc1 ZINC000128807118 1416073939 /nfs/dbraw/zinc/07/39/39/1416073939.db2.gz FYMYCDXSWFAWFD-NSHDSACASA-N 0 0 395.337 3.048 20 5 GGBDRN NC(=O)c1cc(-c2csc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)n2)c[nH]1 ZINC000128812178 1416075415 /nfs/dbraw/zinc/07/54/15/1416075415.db2.gz STQJCLHMKSYXOC-UHFFFAOYSA-N 0 0 391.796 3.051 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)NCCc1ccc(OC(C)C)cc1 ZINC000178343729 1429056594 /nfs/dbraw/zinc/05/65/94/1429056594.db2.gz XYSDUAUHGWBUBT-UHFFFAOYSA-N 0 0 387.436 3.161 20 5 GGBDRN NC(=O)CCSc1ccccc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000128825746 1416078598 /nfs/dbraw/zinc/07/85/98/1416078598.db2.gz IZHQNUJCPIUSRX-UHFFFAOYSA-N 0 0 398.444 3.225 20 5 GGBDRN COc1cc(N2CCC(OC(=O)[C@@H]3C[C@H]3c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000128836412 1416081235 /nfs/dbraw/zinc/08/12/35/1416081235.db2.gz WGKQSXYNAAGUGB-ZWKOTPCHSA-N 0 0 397.431 3.314 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@@H]2CCC[C@H]2O)CC1 ZINC000128845515 1416083246 /nfs/dbraw/zinc/08/32/46/1416083246.db2.gz DGRMOETXOGXCKE-HNAYVOBHSA-N 0 0 375.469 3.064 20 5 GGBDRN CC(C)C(=O)NCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000128846807 1416083381 /nfs/dbraw/zinc/08/33/81/1416083381.db2.gz YOLBKDFZGJYEAQ-UHFFFAOYSA-N 0 0 393.509 3.474 20 5 GGBDRN C[C@@H]1[C@@H](C)CCCN1S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000178349805 1429058011 /nfs/dbraw/zinc/05/80/11/1429058011.db2.gz YHTBDGSLTHJGLV-VHSXEESVSA-N 0 0 377.260 3.166 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1cccc(OCC(F)(F)F)c1 ZINC000178296772 1429045171 /nfs/dbraw/zinc/04/51/71/1429045171.db2.gz UCGPFNRVDSQUTD-UHFFFAOYSA-N 0 0 398.337 3.403 20 5 GGBDRN CC(C)(C)NC(=O)c1cccc(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000178299614 1429045613 /nfs/dbraw/zinc/04/56/13/1429045613.db2.gz WQDZDPSHBDVEGP-UHFFFAOYSA-N 0 0 396.447 3.124 20 5 GGBDRN C[C@@H](O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000128886277 1416092506 /nfs/dbraw/zinc/09/25/06/1416092506.db2.gz KFCGPPXFIHAMIX-CVEARBPZSA-N 0 0 375.469 3.064 20 5 GGBDRN C[C@]1(c2ccccc2)CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000128906540 1416097930 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ZINC000129288448 1416185513 /nfs/dbraw/zinc/18/55/13/1416185513.db2.gz WBFRCXFTGLYSMZ-OAQYLSRUSA-N 0 0 377.400 3.447 20 5 GGBDRN CSCC[C@@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000129310333 1416189069 /nfs/dbraw/zinc/18/90/69/1416189069.db2.gz LWGFGAYJCJWAOZ-SECBINFHSA-N 0 0 397.316 3.119 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000129314119 1416189643 /nfs/dbraw/zinc/18/96/43/1416189643.db2.gz WEXQCVJVZRZGDK-GFCCVEGCSA-N 0 0 396.852 3.149 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000129331739 1416192770 /nfs/dbraw/zinc/19/27/70/1416192770.db2.gz KRJXYLQBGWYHSE-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN CCCN(CC1CC1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000129335357 1416193106 /nfs/dbraw/zinc/19/31/06/1416193106.db2.gz ZPEKZWSJVDENAZ-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN O=C(CCOc1ccccc1)N1CCC[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000129337461 1416193528 /nfs/dbraw/zinc/19/35/28/1416193528.db2.gz 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389.717 3.471 20 5 GGBDRN CCc1ccc(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000130175907 1416333118 /nfs/dbraw/zinc/33/31/18/1416333118.db2.gz NRGNXTUFQDBWFP-GOSISDBHSA-N 0 0 381.432 3.078 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)NCCc3cccc([N+](=O)[O-])c3)cc2)CCO1 ZINC000130177585 1416333598 /nfs/dbraw/zinc/33/35/98/1416333598.db2.gz CACOGEMJQWGCCN-HNNXBMFYSA-N 0 0 384.436 3.184 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(Cc1ccco1)Cc1cccnc1 ZINC000130179899 1416334058 /nfs/dbraw/zinc/33/40/58/1416334058.db2.gz LOYDKEBDMQWDIS-UHFFFAOYSA-N 0 0 387.417 3.115 20 5 GGBDRN Cc1cc(F)cc(C(=O)N(C)CC(=O)Nc2cc(F)cc(F)c2)c1[N+](=O)[O-] ZINC000130183546 1416334345 /nfs/dbraw/zinc/33/43/45/1416334345.db2.gz CQVDROAMIFIWDY-UHFFFAOYSA-N 0 0 381.310 3.031 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1(c2ccc(F)cc2F)CCCC1 ZINC000130188656 1416335375 /nfs/dbraw/zinc/33/53/75/1416335375.db2.gz FGVQSUWQNGRVAQ-UHFFFAOYSA-N 0 0 378.379 3.354 20 5 GGBDRN Cc1ccc(-n2c(SCCn3ccc([N+](=O)[O-])n3)nnc2N2CCCC2)cc1 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MPASFNDFCOLRTB-UHFFFAOYSA-N 0 0 394.378 3.368 20 5 GGBDRN COc1ccc(C(=O)C2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000132446312 1416762306 /nfs/dbraw/zinc/76/23/06/1416762306.db2.gz HMFZZUWUESAWRX-UHFFFAOYSA-N 0 0 386.379 3.478 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@H](C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000132451717 1416762854 /nfs/dbraw/zinc/76/28/54/1416762854.db2.gz SRIORWMLNCNDEA-HNNXBMFYSA-N 0 0 386.379 3.121 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc3c(c2)C(=O)CCC3)cc([N+](=O)[O-])c1F ZINC000132456852 1416764613 /nfs/dbraw/zinc/76/46/13/1416764613.db2.gz GWSKLHIAPINZJD-UHFFFAOYSA-N 0 0 378.381 3.362 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000132460879 1416765422 /nfs/dbraw/zinc/76/54/22/1416765422.db2.gz UCQRNINXWYRRCJ-UHFFFAOYSA-N 0 0 384.440 3.313 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000132466618 1416767406 /nfs/dbraw/zinc/76/74/06/1416767406.db2.gz OHAFGASLPNMWMX-UHFFFAOYSA-N 0 0 383.448 3.278 20 5 GGBDRN 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ZINC000132993904 1416839575 /nfs/dbraw/zinc/83/95/75/1416839575.db2.gz IHPLTWHVVDCAQW-CQSZACIVSA-N 0 0 385.376 3.450 20 5 GGBDRN COc1ccc([C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)C2)cc1 ZINC000132995556 1416840025 /nfs/dbraw/zinc/84/00/25/1416840025.db2.gz KZZWFYASOGSQNH-CQSZACIVSA-N 0 0 385.376 3.450 20 5 GGBDRN Cc1c(C(=O)NCc2coc(-c3ccccc3)n2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000133002820 1416840798 /nfs/dbraw/zinc/84/07/98/1416840798.db2.gz JPCGIPLUJOXGNT-UHFFFAOYSA-N 0 0 382.332 3.396 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000133060468 1416847199 /nfs/dbraw/zinc/84/71/99/1416847199.db2.gz PKLYUGXEPRNZMV-KRWDZBQOSA-N 0 0 385.420 3.477 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000133060644 1416847500 /nfs/dbraw/zinc/84/75/00/1416847500.db2.gz PKLYUGXEPRNZMV-QGZVFWFLSA-N 0 0 385.420 3.477 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N(C)CCc2nccs2)c([N+](=O)[O-])c1 ZINC000133072594 1416848568 /nfs/dbraw/zinc/84/85/68/1416848568.db2.gz AWWIPRXEEGFTGV-UHFFFAOYSA-N 0 0 377.470 3.046 20 5 GGBDRN O=C(Nc1cccc(OCC(F)F)n1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000133071243 1416848582 /nfs/dbraw/zinc/84/85/82/1416848582.db2.gz AWFXTNVFOQVIDK-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN C[C@@H](CO[C@@H]1CCOC1)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000133088713 1416850543 /nfs/dbraw/zinc/85/05/43/1416850543.db2.gz SLPJSHAYPIVULT-MAUKXSAKSA-N 0 0 399.447 3.131 20 5 GGBDRN CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000133118657 1416853662 /nfs/dbraw/zinc/85/36/62/1416853662.db2.gz XQEOQFRKONCJLP-INIZCTEOSA-N 0 0 379.457 3.193 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)Cc2ccc(OC(F)F)cc2)c1[N+](=O)[O-] ZINC000133132327 1416855362 /nfs/dbraw/zinc/85/53/62/1416855362.db2.gz LPJOQLLGQITWMG-UHFFFAOYSA-N 0 0 381.335 3.404 20 5 GGBDRN CCC[C@H](C)[C@@H]1CCCN1c1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000133145190 1416857055 /nfs/dbraw/zinc/85/70/55/1416857055.db2.gz UUURPFRIWZDYRG-RDJZCZTQSA-N 0 0 375.469 3.472 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCCN1C(=O)c1cccs1 ZINC000133147005 1416857139 /nfs/dbraw/zinc/85/71/39/1416857139.db2.gz OZHAFBHWERKODT-INIZCTEOSA-N 0 0 387.461 3.010 20 5 GGBDRN Cc1ccc2nc(CSCC(=O)NCCc3cccc([N+](=O)[O-])c3)cn2c1 ZINC000133148824 1416857528 /nfs/dbraw/zinc/85/75/28/1416857528.db2.gz JRZXIXWUEIPBTR-UHFFFAOYSA-N 0 0 384.461 3.143 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3nc4ccccn4n3)cc2[N+](=O)[O-])C1 ZINC000133180282 1416861416 /nfs/dbraw/zinc/86/14/16/1416861416.db2.gz FMUKJRJEYBSUAN-OKILXGFUSA-N 0 0 394.435 3.372 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1nc2ccccn2n1 ZINC000133186564 1416862207 /nfs/dbraw/zinc/86/22/07/1416862207.db2.gz VICYDPAVSZQLCS-UHFFFAOYSA-N 0 0 394.313 3.097 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@H]3CC[C@H](CO)CC3)cc2[N+](=O)[O-])CC1 ZINC000133234414 1416868316 /nfs/dbraw/zinc/86/83/16/1416868316.db2.gz CODCUFCAAZGWLF-WOVMCDHWSA-N 0 0 375.469 3.112 20 5 GGBDRN O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000133250007 1416870312 /nfs/dbraw/zinc/87/03/12/1416870312.db2.gz BIYXLWGOCKAFPV-UHFFFAOYSA-N 0 0 393.365 3.407 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000133251277 1416870344 /nfs/dbraw/zinc/87/03/44/1416870344.db2.gz YJHYRDDNBQNHMA-DYVFJYSZSA-N 0 0 389.477 3.499 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(c3nc4ccccc4[nH]3)CC2)c1[N+](=O)[O-] ZINC000133252470 1416870728 /nfs/dbraw/zinc/87/07/28/1416870728.db2.gz ISUSSYUYFHPLTN-UHFFFAOYSA-N 0 0 395.419 3.427 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(C(=O)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000133256638 1416871065 /nfs/dbraw/zinc/87/10/65/1416871065.db2.gz DQZVJPPMNVGFHH-UHFFFAOYSA-N 0 0 383.404 3.266 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)c2)n[nH]1 ZINC000133263178 1416871812 /nfs/dbraw/zinc/87/18/12/1416871812.db2.gz VEKUQIQLLNLNMZ-UHFFFAOYSA-N 0 0 378.392 3.279 20 5 GGBDRN COc1cc(OC)c(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1F ZINC000133264892 1416871972 /nfs/dbraw/zinc/87/19/72/1416871972.db2.gz BISKCIYNDHNCPD-LLVKDONJSA-N 0 0 377.372 3.499 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(Cl)c(C(=O)NC2CC2)c1 ZINC000133266653 1416872038 /nfs/dbraw/zinc/87/20/38/1416872038.db2.gz IJLNNNICEGOADM-UHFFFAOYSA-N 0 0 391.786 3.461 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000133264757 1416872132 /nfs/dbraw/zinc/87/21/32/1416872132.db2.gz MPONGXUFADXJTH-FQEVSTJZSA-N 0 0 391.468 3.291 20 5 GGBDRN CCc1ccc([C@H](COC)NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)o1 ZINC000133317335 1416878131 /nfs/dbraw/zinc/87/81/31/1416878131.db2.gz RFCWKITYEWPNMU-ZDUSSCGKSA-N 0 0 377.353 3.084 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@H](C)N2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000133333648 1416879830 /nfs/dbraw/zinc/87/98/30/1416879830.db2.gz FXWMSNDITLBXEY-LBPRGKRZSA-N 0 0 390.465 3.087 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCCC(=O)N2)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000133353706 1416881821 /nfs/dbraw/zinc/88/18/21/1416881821.db2.gz QFRUXUGVQIYFHJ-UHFFFAOYSA-N 0 0 380.404 3.460 20 5 GGBDRN COc1ccc(OC(F)F)c(CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)c1 ZINC000133361305 1416882380 /nfs/dbraw/zinc/88/23/80/1416882380.db2.gz VHDSTWHAQBDYGU-UHFFFAOYSA-N 0 0 392.318 3.011 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1F ZINC000133404919 1416886734 /nfs/dbraw/zinc/88/67/34/1416886734.db2.gz YDRDXSYRXJOBIP-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(OCC(F)F)n2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000133413090 1416887335 /nfs/dbraw/zinc/88/73/35/1416887335.db2.gz XKUDSIUKHOVYKV-UHFFFAOYSA-N 0 0 382.279 3.103 20 5 GGBDRN O=c1nc(Cn2cc([N+](=O)[O-])cn2)[nH]c2scc(-c3ccccc3Cl)c21 ZINC000133419033 1416887993 /nfs/dbraw/zinc/88/79/93/1416887993.db2.gz KYTJIUYRYHWLIB-UHFFFAOYSA-N 0 0 387.808 3.458 20 5 GGBDRN Nc1c(Cl)cc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000133436236 1416889683 /nfs/dbraw/zinc/88/96/83/1416889683.db2.gz VMOFOCDMIBKOHS-UHFFFAOYSA-N 0 0 390.248 3.468 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)C[C@@H](O)c2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000133442696 1416890222 /nfs/dbraw/zinc/89/02/22/1416890222.db2.gz GQDAGFXVZNNPIQ-PIGZYNQJSA-N 0 0 387.392 3.362 20 5 GGBDRN CC(C)CC(=O)N[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000133444362 1416890266 /nfs/dbraw/zinc/89/02/66/1416890266.db2.gz PVFDVNTXHDPABS-HXUWFJFHSA-N 0 0 383.448 3.157 20 5 GGBDRN Cc1c(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000133445333 1416890633 /nfs/dbraw/zinc/89/06/33/1416890633.db2.gz HFCFGKJGCWMFHP-UHFFFAOYSA-N 0 0 388.336 3.001 20 5 GGBDRN Cc1ccc(F)c(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000133472344 1416893087 /nfs/dbraw/zinc/89/30/87/1416893087.db2.gz NZCCDPQXFQBRLS-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1cccc(C)c1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000133480598 1416894239 /nfs/dbraw/zinc/89/42/39/1416894239.db2.gz HROMNUZCMUTOHX-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN COc1cc(F)c(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)cc1OC ZINC000133490040 1416894971 /nfs/dbraw/zinc/89/49/71/1416894971.db2.gz KPUNPXKHHNXBGK-UHFFFAOYSA-N 0 0 386.339 3.394 20 5 GGBDRN COc1ccc(OCCCn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)cc1 ZINC000133490589 1416895029 /nfs/dbraw/zinc/89/50/29/1416895029.db2.gz UZTUNIHGSMZKDQ-UHFFFAOYSA-N 0 0 381.388 3.296 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCC2)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000133503765 1416896369 /nfs/dbraw/zinc/89/63/69/1416896369.db2.gz RJTDKGBPUGCTKO-UHFFFAOYSA-N 0 0 394.431 3.073 20 5 GGBDRN O=C(NC[C@@H]1CCC[C@H](O)C1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000133513135 1416897069 /nfs/dbraw/zinc/89/70/69/1416897069.db2.gz NQIQIOVBIRTBRL-SCZZXKLOSA-N 0 0 391.649 3.292 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OS(=O)(=O)c2cc(Cl)ccc2Cl)c1 ZINC000133514411 1416897114 /nfs/dbraw/zinc/89/71/14/1416897114.db2.gz FIKCRAZFCBTRBY-UHFFFAOYSA-N 0 0 376.173 3.482 20 5 GGBDRN Cc1cccc(Cl)c1NC(=O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000133534678 1416899067 /nfs/dbraw/zinc/89/90/67/1416899067.db2.gz GDNRYQIBURQBGA-ZDUSSCGKSA-N 0 0 389.843 3.077 20 5 GGBDRN CCc1ccc([C@@H](COC)NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)o1 ZINC000133540158 1416899718 /nfs/dbraw/zinc/89/97/18/1416899718.db2.gz UYDDHQSRSGPLKX-CQSZACIVSA-N 0 0 377.353 3.084 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(Cc1ccccc1F)C1CCCCC1 ZINC000178687138 1429140596 /nfs/dbraw/zinc/14/05/96/1429140596.db2.gz DKYGCWRDKZHHPM-UHFFFAOYSA-N 0 0 387.411 3.257 20 5 GGBDRN CCC[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000133563866 1416905373 /nfs/dbraw/zinc/90/53/73/1416905373.db2.gz CQGSZVZUCTVBDQ-INIZCTEOSA-N 0 0 394.435 3.483 20 5 GGBDRN COc1ccccc1OC[C@@H](C)CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000133567848 1416905858 /nfs/dbraw/zinc/90/58/58/1416905858.db2.gz DHTQFVBFRKMPCQ-HNNXBMFYSA-N 0 0 387.436 3.160 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000133568408 1416906900 /nfs/dbraw/zinc/90/69/00/1416906900.db2.gz WJQHYSGCYQYJKF-ZBFHGGJFSA-N 0 0 391.468 3.289 20 5 GGBDRN CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000133611613 1416919036 /nfs/dbraw/zinc/91/90/36/1416919036.db2.gz QPJXIYYYXNKQGO-FZKQIMNGSA-N 0 0 396.447 3.236 20 5 GGBDRN COCCn1nc(C)c(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1C ZINC000133622606 1416923093 /nfs/dbraw/zinc/92/30/93/1416923093.db2.gz SEEMMKMBWYDEPI-UHFFFAOYSA-N 0 0 386.330 3.326 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)o1 ZINC000133643227 1416929950 /nfs/dbraw/zinc/92/99/50/1416929950.db2.gz IBEYDKDFXWAKDC-INIZCTEOSA-N 0 0 389.364 3.181 20 5 GGBDRN CCc1ccc([C@H](COC)NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000133671586 1416936377 /nfs/dbraw/zinc/93/63/77/1416936377.db2.gz LGFBXMPDAFLCGL-KRWDZBQOSA-N 0 0 384.392 3.053 20 5 GGBDRN Cc1cc(S(C)(=O)=O)cc(C(=O)OCCc2ccccc2[N+](=O)[O-])c1C ZINC000133688031 1416940688 /nfs/dbraw/zinc/94/06/88/1416940688.db2.gz YWHFTMBGGNTFOT-UHFFFAOYSA-N 0 0 377.418 3.015 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccccc1OCC(=O)N(C)C ZINC000133686861 1416940861 /nfs/dbraw/zinc/94/08/61/1416940861.db2.gz DYKLIUHBAQOZJN-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(OC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000133687602 1416941084 /nfs/dbraw/zinc/94/10/84/1416941084.db2.gz IDBRCYXTWZAKCX-UHFFFAOYSA-N 0 0 377.441 3.485 20 5 GGBDRN CCc1ccc([C@@H](COC)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000133739360 1416954133 /nfs/dbraw/zinc/95/41/33/1416954133.db2.gz XEDXUCPCYJHVCZ-QGZVFWFLSA-N 0 0 384.392 3.053 20 5 GGBDRN CCc1ccc([C@H](COC)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000133739557 1416954459 /nfs/dbraw/zinc/95/44/59/1416954459.db2.gz XEDXUCPCYJHVCZ-KRWDZBQOSA-N 0 0 384.392 3.053 20 5 GGBDRN C[C@H](CO[C@@H]1CCOC1)Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000133752492 1416956799 /nfs/dbraw/zinc/95/67/99/1416956799.db2.gz GFOPHQDNKAJNNT-PSASIEDQSA-N 0 0 379.291 3.128 20 5 GGBDRN CCc1nc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)nn1-c1ccccc1Cl ZINC000133783235 1416962330 /nfs/dbraw/zinc/96/23/30/1416962330.db2.gz XZDARRPZVZFQAB-UHFFFAOYSA-N 0 0 386.799 3.347 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000178685497 1429140991 /nfs/dbraw/zinc/14/09/91/1429140991.db2.gz FVEKFYZPHKAFAC-HNNXBMFYSA-N 0 0 391.468 3.161 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)CCNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000133787120 1416963318 /nfs/dbraw/zinc/96/33/18/1416963318.db2.gz BUKZELPKCOANIQ-UHFFFAOYSA-N 0 0 379.775 3.454 20 5 GGBDRN CCC(CC)(CC)CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000133800063 1416965885 /nfs/dbraw/zinc/96/58/85/1416965885.db2.gz AXHQMKSIFROEEK-UHFFFAOYSA-N 0 0 387.383 3.467 20 5 GGBDRN Cc1nc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)ccc1[N+](=O)[O-] ZINC000133811424 1416967936 /nfs/dbraw/zinc/96/79/36/1416967936.db2.gz VOUBEEBVPFJCBT-UHFFFAOYSA-N 0 0 395.169 3.150 20 5 GGBDRN COc1cc(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000133809192 1416967983 /nfs/dbraw/zinc/96/79/83/1416967983.db2.gz RBTRIKJUJVJJGO-UHFFFAOYSA-N 0 0 383.404 3.094 20 5 GGBDRN Cc1ccc([C@@H](O)CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000133812458 1416968746 /nfs/dbraw/zinc/96/87/46/1416968746.db2.gz QUAWTHSELZZIGO-INIZCTEOSA-N 0 0 378.812 3.175 20 5 GGBDRN Cc1nc(NC(=O)c2nc(C(C)C)n(-c3cccc(F)c3)n2)ccc1[N+](=O)[O-] ZINC000133829616 1416971167 /nfs/dbraw/zinc/97/11/67/1416971167.db2.gz FWVLSNCTVYCISO-UHFFFAOYSA-N 0 0 384.371 3.394 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1cccc(F)c1F ZINC000133869755 1416983363 /nfs/dbraw/zinc/98/33/63/1416983363.db2.gz VLUQRXUDKKZTMB-CYBMUJFWSA-N 0 0 390.390 3.466 20 5 GGBDRN CN(C)C(=O)c1ccc(Cl)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000133883304 1416988019 /nfs/dbraw/zinc/98/80/19/1416988019.db2.gz HHORJMXSWOBRMG-UHFFFAOYSA-N 0 0 379.775 3.270 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000133918315 1416994627 /nfs/dbraw/zinc/99/46/27/1416994627.db2.gz ZBVPIJHKIQJPHT-QGZVFWFLSA-N 0 0 390.484 3.213 20 5 GGBDRN 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C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)Oc1cccc(F)c1 ZINC000134759069 1417121596 /nfs/dbraw/zinc/12/15/96/1417121596.db2.gz OVIVDVCZYSPFFY-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)Oc1ccccc1F ZINC000134762915 1417122009 /nfs/dbraw/zinc/12/20/09/1417122009.db2.gz XRYGTTJRUCWKFT-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN Cc1cc([C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)ccc1F ZINC000134775111 1417123620 /nfs/dbraw/zinc/12/36/20/1417123620.db2.gz DIMATMSEQCGPIG-SFHVURJKSA-N 0 0 376.359 3.324 20 5 GGBDRN O=C(CN1CCC[C@H]1C[C@H](O)c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000134776788 1417124159 /nfs/dbraw/zinc/12/41/59/1417124159.db2.gz ATBZNNAOWQYOIS-LPHOPBHVSA-N 0 0 387.411 3.261 20 5 GGBDRN O=C(OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(-n2cccn2)n1 ZINC000134787608 1417125586 /nfs/dbraw/zinc/12/55/86/1417125586.db2.gz VJBSNPVUWYOBLH-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN CCOc1cc(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)ccc1OC 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ZINC000135240374 1417193938 /nfs/dbraw/zinc/19/39/38/1417193938.db2.gz QLPPVTDXMUGRLC-UHFFFAOYSA-N 0 0 383.448 3.226 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c(Br)n1 ZINC000135241205 1417194218 /nfs/dbraw/zinc/19/42/18/1417194218.db2.gz QLYYXGDMJCMAJV-UHFFFAOYSA-N 0 0 390.190 3.001 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c(Br)n1 ZINC000135242057 1417194251 /nfs/dbraw/zinc/19/42/51/1417194251.db2.gz LWZGYXLCLRECAN-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN COC(=O)c1cccc(NC2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)c1 ZINC000178772645 1429165588 /nfs/dbraw/zinc/16/55/88/1429165588.db2.gz XQQOFOIEFPVDCR-UHFFFAOYSA-N 0 0 389.433 3.160 20 5 GGBDRN O=C(OCc1ccccc1)N1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000135243944 1417195023 /nfs/dbraw/zinc/19/50/23/1417195023.db2.gz WVEIQHFTJOBHGF-UHFFFAOYSA-N 0 0 396.403 3.190 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC(CN2CCCCC2=O)CC1 ZINC000135325302 1417207722 /nfs/dbraw/zinc/20/77/22/1417207722.db2.gz 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CC(=O)N[C@H](C)CCc1ccc(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000135360630 1417211302 /nfs/dbraw/zinc/21/13/02/1417211302.db2.gz WSYLUEVCKVWCHL-CYBMUJFWSA-N 0 0 388.395 3.453 20 5 GGBDRN CC1(C)CCC(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000135360207 1417211352 /nfs/dbraw/zinc/21/13/52/1417211352.db2.gz CTSGTVVKFXSVMM-UHFFFAOYSA-N 0 0 399.394 3.467 20 5 GGBDRN CNC(=O)c1ccc(NC[C@H](C)Cc2ccc(OC)c(OC)c2)c([N+](=O)[O-])c1 ZINC000135365184 1417211443 /nfs/dbraw/zinc/21/14/43/1417211443.db2.gz TZRLDZOICZBBAP-CYBMUJFWSA-N 0 0 387.436 3.262 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](C)Cc1ccc(OC)c(OC)c1 ZINC000135362601 1417211453 /nfs/dbraw/zinc/21/14/53/1417211453.db2.gz AEKHZOOCSRRBHT-ZDUSSCGKSA-N 0 0 387.436 3.262 20 5 GGBDRN CC(C)OCc1cccc(CNC(=O)COc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000135367360 1417211790 /nfs/dbraw/zinc/21/17/90/1417211790.db2.gz RNMMOMAVXTVLPI-UHFFFAOYSA-N 0 0 376.384 3.354 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)COc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000135365491 1417211799 /nfs/dbraw/zinc/21/17/99/1417211799.db2.gz IYSWABVBBIHUSS-UHFFFAOYSA-N 0 0 389.383 3.233 20 5 GGBDRN COc1cccc(OCCCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000135373623 1417212257 /nfs/dbraw/zinc/21/22/57/1417212257.db2.gz PPIJTHOYXRTNIS-UHFFFAOYSA-N 0 0 383.404 3.213 20 5 GGBDRN CCN(C[C@@H]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1)CC(F)(F)F ZINC000135371881 1417212348 /nfs/dbraw/zinc/21/23/48/1417212348.db2.gz RKWAYNFKBPNSTN-LBPRGKRZSA-N 0 0 399.373 3.355 20 5 GGBDRN CCNc1ccc(C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)cc1[N+](=O)[O-] ZINC000135452275 1417221702 /nfs/dbraw/zinc/22/17/02/1417221702.db2.gz AHOXOSPWOUGWGS-UHFFFAOYSA-N 0 0 396.407 3.395 20 5 GGBDRN CCCn1c(C)nnc1COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000135474116 1417224893 /nfs/dbraw/zinc/22/48/93/1417224893.db2.gz NDXWTNUAOHIZNW-UHFFFAOYSA-N 0 0 387.421 3.385 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N(C)CCO)cc1 ZINC000135474358 1417225165 /nfs/dbraw/zinc/22/51/65/1417225165.db2.gz KZOGMQULFYMTRF-ZDUSSCGKSA-N 0 0 375.450 3.143 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCCC[C@H]2OCCC(C)C)cccc1[N+](=O)[O-] ZINC000135489125 1417226877 /nfs/dbraw/zinc/22/68/77/1417226877.db2.gz WRMSYSBXAFHDAI-SJLPKXTDSA-N 0 0 391.468 3.332 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000178780857 1429168128 /nfs/dbraw/zinc/16/81/28/1429168128.db2.gz BCWMWOYUOAPEOF-QFBILLFUSA-N 0 0 398.463 3.474 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000178780866 1429168225 /nfs/dbraw/zinc/16/82/25/1429168225.db2.gz BCWMWOYUOAPEOF-LPHOPBHVSA-N 0 0 398.463 3.474 20 5 GGBDRN Cc1ccc2c(c1)C(=O)N(CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C)C2=O ZINC000135495683 1417228724 /nfs/dbraw/zinc/22/87/24/1417228724.db2.gz BAQLHXOJXZZQBG-UHFFFAOYSA-N 0 0 387.779 3.100 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCn1c2ccccc2n(C)c1=O ZINC000135496573 1417229218 /nfs/dbraw/zinc/22/92/18/1417229218.db2.gz JWZQILDJYBCSGA-UHFFFAOYSA-N 0 0 388.811 3.239 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccnc1OCC(F)F ZINC000135512304 1417231387 /nfs/dbraw/zinc/23/13/87/1417231387.db2.gz DUECGLQDHMIHHT-LLVKDONJSA-N 0 0 397.403 3.431 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc12 ZINC000135525131 1417232770 /nfs/dbraw/zinc/23/27/70/1417232770.db2.gz JUAOBYFXFHDKMI-AWEZNQCLSA-N 0 0 377.404 3.173 20 5 GGBDRN O=C(Cc1ccccc1C(F)(F)F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135526801 1417232906 /nfs/dbraw/zinc/23/29/06/1417232906.db2.gz VNRLEJYFFOKQAP-ZDUSSCGKSA-N 0 0 394.353 3.264 20 5 GGBDRN Cc1c(Cl)cccc1OCC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135528687 1417233402 /nfs/dbraw/zinc/23/34/02/1417233402.db2.gz HXMNIQOTXXSTFD-ZDUSSCGKSA-N 0 0 390.827 3.043 20 5 GGBDRN O=C(c1ccccc1OCC1CC1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135526888 1417233593 /nfs/dbraw/zinc/23/35/93/1417233593.db2.gz VFMRMFPMFIWRSL-HNNXBMFYSA-N 0 0 382.420 3.105 20 5 GGBDRN O=C(c1ccccc1OC1CCC1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135534099 1417234262 /nfs/dbraw/zinc/23/42/62/1417234262.db2.gz UJKIXVFZAYYNCN-CQSZACIVSA-N 0 0 382.420 3.248 20 5 GGBDRN Cc1nc2ccccc2cc1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135535511 1417234289 /nfs/dbraw/zinc/23/42/89/1417234289.db2.gz NWCOBTCMIYPZMF-OAHLLOKOSA-N 0 0 377.404 3.173 20 5 GGBDRN COc1ccc(CCCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135537041 1417235032 /nfs/dbraw/zinc/23/50/32/1417235032.db2.gz HYZDSNXWZKPNIP-MRXNPFEDSA-N 0 0 384.436 3.034 20 5 GGBDRN C[C@@H](CSc1ccccc1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135541471 1417235456 /nfs/dbraw/zinc/23/54/56/1417235456.db2.gz MOGNWMUTFCOJEE-GJZGRUSLSA-N 0 0 386.477 3.431 20 5 GGBDRN O=C(c1csc(-c2ccoc2)n1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135539116 1417235565 /nfs/dbraw/zinc/23/55/65/1417235565.db2.gz FMNFKIPWEMNOAG-GFCCVEGCSA-N 0 0 385.405 3.033 20 5 GGBDRN O=C(c1sccc1-n1cccc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135542777 1417235799 /nfs/dbraw/zinc/23/57/99/1417235799.db2.gz NATPPJONNPIXDK-CYBMUJFWSA-N 0 0 383.433 3.169 20 5 GGBDRN CC(C)CN(C)c1ccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135542275 1417235815 /nfs/dbraw/zinc/23/58/15/1417235815.db2.gz APOZDJADCRPROZ-QGZVFWFLSA-N 0 0 397.479 3.409 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CCc2c3ccccc3[nH]c2C1 ZINC000135548416 1417236557 /nfs/dbraw/zinc/23/65/57/1417236557.db2.gz PMGBWPNAURTMHN-UHFFFAOYSA-N 0 0 398.806 3.253 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N1CCc2ccc(F)cc2C1 ZINC000135552429 1417236859 /nfs/dbraw/zinc/23/68/59/1417236859.db2.gz FMPXPUCKTXQIMI-UHFFFAOYSA-N 0 0 386.351 3.293 20 5 GGBDRN NC(=O)c1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1N1CCCCC1 ZINC000135557057 1417237259 /nfs/dbraw/zinc/23/72/59/1417237259.db2.gz HZBYCVOVOVPLPQ-UHFFFAOYSA-N 0 0 386.383 3.075 20 5 GGBDRN CC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)nc1C ZINC000135568362 1417238586 /nfs/dbraw/zinc/23/85/86/1417238586.db2.gz DFWAKBPKUAKCCS-UHFFFAOYSA-N 0 0 382.420 3.031 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000135591750 1417241436 /nfs/dbraw/zinc/24/14/36/1417241436.db2.gz ZOSYPQMSWQZMNQ-CYBMUJFWSA-N 0 0 377.803 3.325 20 5 GGBDRN Cc1nc(-c2ccc(S(=O)(=O)Oc3cc(F)cc([N+](=O)[O-])c3)cc2)co1 ZINC000135593965 1417241996 /nfs/dbraw/zinc/24/19/96/1417241996.db2.gz QQVLJIMIBIKNKL-UHFFFAOYSA-N 0 0 378.337 3.465 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c(Cl)c1 ZINC000135653561 1417254151 /nfs/dbraw/zinc/25/41/51/1417254151.db2.gz TUYDHDAKFPMGNV-UHFFFAOYSA-N 0 0 386.795 3.270 20 5 GGBDRN Cc1ccnc(-n2nccc2NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000135678723 1417256975 /nfs/dbraw/zinc/25/69/75/1417256975.db2.gz PXIRFYKPUQJEMA-UHFFFAOYSA-N 0 0 392.419 3.336 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C1CC1 ZINC000135688424 1417257904 /nfs/dbraw/zinc/25/79/04/1417257904.db2.gz SRABTOGLWTZLRL-AWEZNQCLSA-N 0 0 383.832 3.281 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c(Cl)c1 ZINC000135697679 1417259044 /nfs/dbraw/zinc/25/90/44/1417259044.db2.gz LEDJVHFNDMQTDR-UHFFFAOYSA-N 0 0 392.755 3.077 20 5 GGBDRN O=C(Nc1cnn(Cc2ccccn2)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178789005 1429170666 /nfs/dbraw/zinc/17/06/66/1429170666.db2.gz XCWPYVJBGYXMGI-UHFFFAOYSA-N 0 0 392.419 3.431 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H](CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000135721384 1417261595 /nfs/dbraw/zinc/26/15/95/1417261595.db2.gz UDSQDHHHTVEBCQ-ZDUSSCGKSA-N 0 0 383.832 3.281 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000135721417 1417262010 /nfs/dbraw/zinc/26/20/10/1417262010.db2.gz UDSQDHHHTVEBCQ-CYBMUJFWSA-N 0 0 383.832 3.281 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1ccc([S@](C)=O)cc1 ZINC000178792656 1429170995 /nfs/dbraw/zinc/17/09/95/1429170995.db2.gz RUBHXGPAECNINJ-SANMLTNESA-N 0 0 395.868 3.056 20 5 GGBDRN C[C@H](C[S@](C)=O)N(C)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000135765624 1417265447 /nfs/dbraw/zinc/26/54/47/1417265447.db2.gz JUMNZGNFNUIJOQ-LOKFHWFJSA-N 0 0 389.477 3.046 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(CC(F)(F)F)CC1 ZINC000135817280 1417270619 /nfs/dbraw/zinc/27/06/19/1417270619.db2.gz XVJCKSKMBMBAFG-UHFFFAOYSA-N 0 0 391.415 3.417 20 5 GGBDRN Cc1cc(Cl)ncc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000135879747 1417275307 /nfs/dbraw/zinc/27/53/07/1417275307.db2.gz SLBVXGUNVCHNTN-NSHDSACASA-N 0 0 394.840 3.256 20 5 GGBDRN O=C(NC[C@@H](O)c1ccco1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000135951298 1417280711 /nfs/dbraw/zinc/28/07/11/1417280711.db2.gz GJNZCGHVAKXURD-SNVBAGLBSA-N 0 0 389.589 3.067 20 5 GGBDRN CNC(=O)c1ccc(NS(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])c(Cl)c1 ZINC000135975591 1417283320 /nfs/dbraw/zinc/28/33/20/1417283320.db2.gz HZZRROZCCNVRPH-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN C[C@H](CN1CCOCC1)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000136034166 1417287080 /nfs/dbraw/zinc/28/70/80/1417287080.db2.gz WSUGRKOBNUDBFP-CQSZACIVSA-N 0 0 393.509 3.080 20 5 GGBDRN O=C(OCc1nc(-c2ccccc2)no1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000136070083 1417289567 /nfs/dbraw/zinc/28/95/67/1417289567.db2.gz LUILLGJYPNOPCA-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCCNc1ccccn1 ZINC000136200811 1417300649 /nfs/dbraw/zinc/30/06/49/1417300649.db2.gz USZAZZRMJJUWTN-LBPRGKRZSA-N 0 0 378.816 3.029 20 5 GGBDRN CCOc1ccccc1NC(=O)CCN1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000136205002 1417300710 /nfs/dbraw/zinc/30/07/10/1417300710.db2.gz YCIKCKHLGCVGET-UHFFFAOYSA-N 0 0 398.463 3.144 20 5 GGBDRN O=C(Cc1noc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1)NC1CCCCC1 ZINC000136216160 1417302415 /nfs/dbraw/zinc/30/24/15/1417302415.db2.gz MJDFEDNNHSGROQ-UHFFFAOYSA-N 0 0 383.408 3.041 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N(C)Cc2ccc([S@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000178798473 1429173832 /nfs/dbraw/zinc/17/38/32/1429173832.db2.gz ONUQHTLEFLHKEJ-ASHKIFAZSA-N 0 0 389.477 3.100 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cccc3[nH]cnc32)ccc1[N+](=O)[O-] ZINC000136256068 1417305113 /nfs/dbraw/zinc/30/51/13/1417305113.db2.gz XQGMIAJOJSWHMA-KRWDZBQOSA-N 0 0 393.403 3.023 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1ccc([S@](C)=O)cc1 ZINC000178800475 1429173969 /nfs/dbraw/zinc/17/39/69/1429173969.db2.gz GGQXRWPNMONNQA-SANMLTNESA-N 0 0 395.868 3.056 20 5 GGBDRN O=C(NC1CCCCC1)N1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000136314967 1417308706 /nfs/dbraw/zinc/30/87/06/1417308706.db2.gz WTEIHSOGOSWAMB-UHFFFAOYSA-N 0 0 394.859 3.048 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Oc1cccc(N2CCCC2=O)c1 ZINC000136331018 1417309748 /nfs/dbraw/zinc/30/97/48/1417309748.db2.gz SHSQLFFCIVKVLQ-UHFFFAOYSA-N 0 0 379.372 3.351 20 5 GGBDRN COc1ccc(-c2nnc(NC(=O)CN(C)c3ccccc3[N+](=O)[O-])s2)cc1 ZINC000136348234 1417311021 /nfs/dbraw/zinc/31/10/21/1417311021.db2.gz LAFOSHFFONIYRY-UHFFFAOYSA-N 0 0 399.432 3.197 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)cc1[N+](=O)[O-] ZINC000136430224 1417315995 /nfs/dbraw/zinc/31/59/95/1417315995.db2.gz POXAIYFZKVMJSU-CYBMUJFWSA-N 0 0 382.420 3.414 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)cc1[N+](=O)[O-] ZINC000136430265 1417316139 /nfs/dbraw/zinc/31/61/39/1417316139.db2.gz POXAIYFZKVMJSU-ZDUSSCGKSA-N 0 0 382.420 3.414 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)[C@H]1COc2ccc(Br)cc21 ZINC000136444424 1417316921 /nfs/dbraw/zinc/31/69/21/1417316921.db2.gz OMUFNSQCUDUFHM-LBPRGKRZSA-N 0 0 394.177 3.448 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC([C@H](O)c2ccc(F)cc2)CC1 ZINC000136456635 1417318404 /nfs/dbraw/zinc/31/84/04/1417318404.db2.gz CCHXZXYITAERNV-GOSISDBHSA-N 0 0 376.359 3.459 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000136456589 1417318415 /nfs/dbraw/zinc/31/84/15/1417318415.db2.gz CCHXZXYITAERNV-SFHVURJKSA-N 0 0 376.359 3.459 20 5 GGBDRN O=C(NC[C@H](O)c1ccc(OC(F)(F)F)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000136517362 1417323081 /nfs/dbraw/zinc/32/30/81/1417323081.db2.gz OMFFYONCYBTKLZ-AWEZNQCLSA-N 0 0 388.273 3.096 20 5 GGBDRN COc1cc([C@H](C)NC(=O)c2[nH]ncc2[N+](=O)[O-])ccc1OCCC(C)C ZINC000136531718 1417323983 /nfs/dbraw/zinc/32/39/83/1417323983.db2.gz VLVHDYMGTPIHMB-LBPRGKRZSA-N 0 0 376.413 3.242 20 5 GGBDRN O=C(Nc1ccccc1-c1nnc(-c2ccccc2)[nH]1)c1n[nH]cc1[N+](=O)[O-] ZINC000136533989 1417324736 /nfs/dbraw/zinc/32/47/36/1417324736.db2.gz WPHSTCFOLAGSIG-UHFFFAOYSA-N 0 0 375.348 3.022 20 5 GGBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000136547488 1417325282 /nfs/dbraw/zinc/32/52/82/1417325282.db2.gz YRURRCAWBKHQKE-GFCCVEGCSA-N 0 0 384.367 3.419 20 5 GGBDRN O=C(c1ccsc1)N1CCCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000136556995 1417326081 /nfs/dbraw/zinc/32/60/81/1417326081.db2.gz OWFJMTKLBIHIJD-UHFFFAOYSA-N 0 0 393.852 3.298 20 5 GGBDRN Cc1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1-n1cnnn1 ZINC000136563409 1417326930 /nfs/dbraw/zinc/32/69/30/1417326930.db2.gz FFECDQCNDLLDHV-UHFFFAOYSA-N 0 0 393.407 3.075 20 5 GGBDRN O=C(N[C@H]1CCc2cc(F)ccc21)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136625702 1417333070 /nfs/dbraw/zinc/33/30/70/1417333070.db2.gz NRRLDIAGNXSYEH-INIZCTEOSA-N 0 0 376.409 3.236 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000136643522 1417334735 /nfs/dbraw/zinc/33/47/35/1417334735.db2.gz KPQCJUJKIHFUFA-JSGCOSHPSA-N 0 0 381.860 3.405 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)nc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000136665821 1417336546 /nfs/dbraw/zinc/33/65/46/1417336546.db2.gz QSGOFXBIZNMILR-UHFFFAOYSA-N 0 0 378.392 3.372 20 5 GGBDRN O=C(NCCc1cc2ccccc2[nH]1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000136702331 1417340248 /nfs/dbraw/zinc/34/02/48/1417340248.db2.gz QYFYHHZCQVXDFL-UHFFFAOYSA-N 0 0 386.795 3.027 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CSc2nnc(N3CCCCC3)n2C2CC2)c1 ZINC000136886440 1417352815 /nfs/dbraw/zinc/35/28/15/1417352815.db2.gz KGRFQFIZZIJRDS-INIZCTEOSA-N 0 0 389.481 3.337 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CCN(C(=O)C2CCCC2)C1 ZINC000136918643 1417354907 /nfs/dbraw/zinc/35/49/07/1417354907.db2.gz PSDREGPLJSVZAK-ZDUSSCGKSA-N 0 0 380.832 3.161 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Oc1cccc(C(=O)NC2CC2)c1 ZINC000136925777 1417355222 /nfs/dbraw/zinc/35/52/22/1417355222.db2.gz GXKSXFDHFGFOGB-UHFFFAOYSA-N 0 0 379.372 3.116 20 5 GGBDRN Cn1c(CCNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)nc2cc(F)ccc21 ZINC000136980631 1417359525 /nfs/dbraw/zinc/35/95/25/1417359525.db2.gz VVMHFDHQIHUGGY-UHFFFAOYSA-N 0 0 376.775 3.247 20 5 GGBDRN Cn1c(CCNC(=O)c2c(Cl)cccc2[N+](=O)[O-])nc2cc(F)ccc21 ZINC000136980287 1417359701 /nfs/dbraw/zinc/35/97/01/1417359701.db2.gz NTBOKGKZUMDKKD-UHFFFAOYSA-N 0 0 376.775 3.247 20 5 GGBDRN CN(Cc1ccccc1Cl)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000136993673 1417360523 /nfs/dbraw/zinc/36/05/23/1417360523.db2.gz RTXCGRGDJOJKPA-UHFFFAOYSA-N 0 0 375.812 3.027 20 5 GGBDRN CCN1C(=S)N=NC1C1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000137016217 1417362782 /nfs/dbraw/zinc/36/27/82/1417362782.db2.gz OSDZNGYNDDAUMB-UHFFFAOYSA-N 0 0 395.872 3.168 20 5 GGBDRN C[C@H](c1ccc(F)cc1F)N1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000137036765 1417363826 /nfs/dbraw/zinc/36/38/26/1417363826.db2.gz DIJOSAQMAMAEIO-JLTOFOAXSA-N 0 0 391.418 3.285 20 5 GGBDRN C[C@@H](NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000137056085 1417365347 /nfs/dbraw/zinc/36/53/47/1417365347.db2.gz BFIUGXGEPYIPPI-GFCCVEGCSA-N 0 0 375.812 3.246 20 5 GGBDRN CCc1ncsc1C(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000137056183 1417365617 /nfs/dbraw/zinc/36/56/17/1417365617.db2.gz QWZQACOJEKDCPK-CQSZACIVSA-N 0 0 391.449 3.427 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CN2CCc3c(Br)cccc3C2)c1 ZINC000137063722 1417365904 /nfs/dbraw/zinc/36/59/04/1417365904.db2.gz CXBYJOCDZNKLEY-QGZVFWFLSA-N 0 0 377.238 3.449 20 5 GGBDRN CC[C@H](c1ccc(F)cc1F)S(=O)(=O)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137150215 1417371441 /nfs/dbraw/zinc/37/14/41/1417371441.db2.gz PMBXVVAOXAZTEF-IAGOWNOFSA-N 0 0 385.388 3.473 20 5 GGBDRN CC[C@H](c1ccc(F)cc1F)S(=O)(=O)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137150129 1417371476 /nfs/dbraw/zinc/37/14/76/1417371476.db2.gz PMBXVVAOXAZTEF-DLBZAZTESA-N 0 0 385.388 3.473 20 5 GGBDRN Cc1cccc2c(CCNC(=O)c3cc([N+](=O)[O-])ccc3SCCO)c[nH]c21 ZINC000137226831 1417376629 /nfs/dbraw/zinc/37/66/29/1417376629.db2.gz AXIUMGBJEPZBBK-UHFFFAOYSA-N 0 0 399.472 3.441 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CCN1C(=O)OC(C)(C)C ZINC000137250645 1417377168 /nfs/dbraw/zinc/37/71/68/1417377168.db2.gz CCBHCAJUSXDBIO-LLVKDONJSA-N 0 0 383.832 3.330 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CCN1C(=O)OC(C)(C)C ZINC000137250692 1417377442 /nfs/dbraw/zinc/37/74/42/1417377442.db2.gz CCBHCAJUSXDBIO-NSHDSACASA-N 0 0 383.832 3.330 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)C1(N2CCOCC2)CCCC1 ZINC000137268275 1417378658 /nfs/dbraw/zinc/37/86/58/1417378658.db2.gz RBWOIPYPISBGKL-CYBMUJFWSA-N 0 0 381.860 3.012 20 5 GGBDRN O=C(Nc1cnn(-c2ccccn2)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000137448819 1417386645 /nfs/dbraw/zinc/38/66/45/1417386645.db2.gz JLFJOYSXZTUXSY-UHFFFAOYSA-N 0 0 378.392 3.372 20 5 GGBDRN Cc1cc(-c2noc(CN3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)n2)ccc1F ZINC000137511937 1417389194 /nfs/dbraw/zinc/38/91/94/1417389194.db2.gz HIWDDYSPFMZDKP-AWEZNQCLSA-N 0 0 398.398 3.174 20 5 GGBDRN O=C(Nc1cccc(-n2ccnn2)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000137999811 1417400673 /nfs/dbraw/zinc/40/06/73/1417400673.db2.gz QCMUUWFFUAICSO-UHFFFAOYSA-N 0 0 378.392 3.372 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)NC[C@H](O)c1cc2ccccc2s1 ZINC000138075613 1417404127 /nfs/dbraw/zinc/40/41/27/1417404127.db2.gz BWIUDJFYXUIBAP-HNNXBMFYSA-N 0 0 390.392 3.177 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCN(Cc2cccc(F)c2)CC1 ZINC000138114870 1417405362 /nfs/dbraw/zinc/40/53/62/1417405362.db2.gz DPAOFOMMEGLIMJ-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN Cc1cc(C(=O)COC(=O)c2cc([N+](=O)[O-])cn2C)c(C)n1Cc1ccccc1 ZINC000138158915 1417406825 /nfs/dbraw/zinc/40/68/25/1417406825.db2.gz WVJMIYIUFKEMRN-UHFFFAOYSA-N 0 0 395.415 3.440 20 5 GGBDRN COc1ccc(C(=O)N2CCN(Cc3ccccc3Cl)CC2)cc1[N+](=O)[O-] ZINC000138347764 1417411190 /nfs/dbraw/zinc/41/11/90/1417411190.db2.gz BJRKLQVJDDMLQL-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN COC(=O)Cc1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000138396267 1417413010 /nfs/dbraw/zinc/41/30/10/1417413010.db2.gz UJLPTKCNLOBWJX-LLVKDONJSA-N 0 0 392.795 3.370 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCOc1ccc(F)cc1 ZINC000138413120 1417413813 /nfs/dbraw/zinc/41/38/13/1417413813.db2.gz NEULJMNBSFUXQJ-NSHDSACASA-N 0 0 382.775 3.350 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCOc1cccc(F)c1 ZINC000138485333 1417420381 /nfs/dbraw/zinc/42/03/81/1417420381.db2.gz ZWTNQDZBWJGMBV-NSHDSACASA-N 0 0 382.775 3.350 20 5 GGBDRN Cc1nc(C2(NCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CCCCC2)no1 ZINC000138839372 1417439070 /nfs/dbraw/zinc/43/90/70/1417439070.db2.gz VJYVXEWLWLCONL-UHFFFAOYSA-N 0 0 393.831 3.327 20 5 GGBDRN Cc1nc(C2(NCCC(=O)Nc3cccc([N+](=O)[O-])c3C)CCCCC2)no1 ZINC000138848899 1417439341 /nfs/dbraw/zinc/43/93/41/1417439341.db2.gz RSMQIRDQYWLGIJ-UHFFFAOYSA-N 0 0 387.440 3.372 20 5 GGBDRN COc1ccc(CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])cc1OC ZINC000138946421 1417443725 /nfs/dbraw/zinc/44/37/25/1417443725.db2.gz UHLPZUNQLSUQDM-UHFFFAOYSA-N 0 0 396.403 3.189 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000139275454 1417454696 /nfs/dbraw/zinc/45/46/96/1417454696.db2.gz URHAWYPSSNMYSG-GOSISDBHSA-N 0 0 386.358 3.170 20 5 GGBDRN CCN1C(=S)N=NC1[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000139294672 1417455513 /nfs/dbraw/zinc/45/55/13/1417455513.db2.gz SYKUWNBHGCJTGC-LLVKDONJSA-N 0 0 395.872 3.168 20 5 GGBDRN COc1ccc(CN(C(=O)COC(=O)c2ccc([N+](=O)[O-])s2)C2CC2)cc1 ZINC000139517615 1417461879 /nfs/dbraw/zinc/46/18/79/1417461879.db2.gz PESMAMXAOCAFQB-UHFFFAOYSA-N 0 0 390.417 3.013 20 5 GGBDRN C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000139665070 1417468273 /nfs/dbraw/zinc/46/82/73/1417468273.db2.gz HOPOMEWFOSTSKT-LLVKDONJSA-N 0 0 383.832 3.330 20 5 GGBDRN Cc1cccc(OC[C@@H](O)CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000139826642 1417476269 /nfs/dbraw/zinc/47/62/69/1417476269.db2.gz DDLGJVPEDXGTJR-ZDUSSCGKSA-N 0 0 379.800 3.118 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@@H]3CCCCO3)cc2[N+](=O)[O-])C1 ZINC000139870303 1417478476 /nfs/dbraw/zinc/47/84/76/1417478476.db2.gz VUWKCHCAFWPYAN-UXLLHSPISA-N 0 0 375.469 3.376 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000140009233 1417485051 /nfs/dbraw/zinc/48/50/51/1417485051.db2.gz CIDXGKBSDZZRLM-LLVKDONJSA-N 0 0 381.458 3.045 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@H]1CCCCO1 ZINC000140097348 1417488331 /nfs/dbraw/zinc/48/83/31/1417488331.db2.gz WQZCYYDQHDWGEC-GFCCVEGCSA-N 0 0 375.347 3.101 20 5 GGBDRN Cn1c(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)nc2ccccc21 ZINC000178842075 1429190584 /nfs/dbraw/zinc/19/05/84/1429190584.db2.gz UWGZAPSPCLZDCU-UHFFFAOYSA-N 0 0 379.420 3.356 20 5 GGBDRN O=C(Nc1nc(-c2ccc(OC(F)F)cc2)cs1)c1cc([N+](=O)[O-])n[nH]1 ZINC000140279880 1417496614 /nfs/dbraw/zinc/49/66/14/1417496614.db2.gz MUDAFUJCWUFMGC-UHFFFAOYSA-N 0 0 381.320 3.295 20 5 GGBDRN CCOC(=O)N[C@H]1CCCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000140965895 1417522721 /nfs/dbraw/zinc/52/27/21/1417522721.db2.gz DGTMWMKKZAWIEP-HNNXBMFYSA-N 0 0 385.424 3.075 20 5 GGBDRN C[C@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@H]1COc2ccccc21 ZINC000178838489 1429190220 /nfs/dbraw/zinc/19/02/20/1429190220.db2.gz TZIZVERCLJZESA-XJKSGUPXSA-N 0 0 378.388 3.075 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccc(OC(C)(C)C)cc1 ZINC000141188466 1417528894 /nfs/dbraw/zinc/52/88/94/1417528894.db2.gz QZNKDPUSFLRYFO-UHFFFAOYSA-N 0 0 394.449 3.259 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1cccc(COCC2CC2)c1 ZINC000141219666 1417529987 /nfs/dbraw/zinc/52/99/87/1417529987.db2.gz NPCWEUOWFJTWBZ-UHFFFAOYSA-N 0 0 397.431 3.119 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1 ZINC000141405843 1417537148 /nfs/dbraw/zinc/53/71/48/1417537148.db2.gz VLICZMCJDPOAKQ-KRWDZBQOSA-N 0 0 382.376 3.340 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NC1(c2ccc(F)cc2)CCCC1 ZINC000141562993 1417545660 /nfs/dbraw/zinc/54/56/60/1417545660.db2.gz PFTPRMCZWZRUQT-UHFFFAOYSA-N 0 0 399.422 3.440 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN(Cc3ccco3)C[C@@H]3CCCO3)n2)c1 ZINC000141716875 1417552985 /nfs/dbraw/zinc/55/29/85/1417552985.db2.gz UDNCJEFOKBAVRR-KRWDZBQOSA-N 0 0 384.392 3.419 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@@H]2C[C@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000178846243 1429192903 /nfs/dbraw/zinc/19/29/03/1429192903.db2.gz REUCXMTXWBDGTF-CJNGLKHVSA-N 0 0 396.490 3.242 20 5 GGBDRN O=C(CN(Cc1ccco1)C[C@@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000141801090 1417556739 /nfs/dbraw/zinc/55/67/39/1417556739.db2.gz LFCZYFHXOKMQBI-HNNXBMFYSA-N 0 0 393.827 3.461 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1nc(-c2ccc(OC(F)F)cc2)cs1 ZINC000141822260 1417558290 /nfs/dbraw/zinc/55/82/90/1417558290.db2.gz VBJAESFSXDVOIM-UHFFFAOYSA-N 0 0 395.347 3.155 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN(Cc3ccco3)C[C@H]3CCCO3)n2)cc1 ZINC000141871555 1417561440 /nfs/dbraw/zinc/56/14/40/1417561440.db2.gz GUIFIPBZXFYMTK-QGZVFWFLSA-N 0 0 384.392 3.419 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)COc2ccccc2[N+](=O)[O-])cc1OC ZINC000141988078 1417568735 /nfs/dbraw/zinc/56/87/35/1417568735.db2.gz XMPGTXIMQVQZFJ-HNNXBMFYSA-N 0 0 386.404 3.355 20 5 GGBDRN Cc1cc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)no1 ZINC000142830892 1417599857 /nfs/dbraw/zinc/59/98/57/1417599857.db2.gz ZYGFUDIXELSPGP-CYBMUJFWSA-N 0 0 381.392 3.389 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nc(-c2cccc(F)c2)cs1 ZINC000142995664 1417606801 /nfs/dbraw/zinc/60/68/01/1417606801.db2.gz WQPYSTYLRSSLJF-UHFFFAOYSA-N 0 0 375.385 3.391 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ncc(Cc2cccc(F)c2)s1 ZINC000143018795 1417607888 /nfs/dbraw/zinc/60/78/88/1417607888.db2.gz JIKIZKOWLBNEQN-UHFFFAOYSA-N 0 0 389.412 3.315 20 5 GGBDRN Cn1nc2c(c1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CCC2 ZINC000143027730 1417608127 /nfs/dbraw/zinc/60/81/27/1417608127.db2.gz ZJVBBZKKSGZWDF-UHFFFAOYSA-N 0 0 397.357 3.277 20 5 GGBDRN COc1ccccc1-c1csc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)n1 ZINC000143025468 1417608190 /nfs/dbraw/zinc/60/81/90/1417608190.db2.gz SBRXYOHVWLDMII-UHFFFAOYSA-N 0 0 387.421 3.261 20 5 GGBDRN CC[C@@H](NC(=O)CCn1cc([N+](=O)[O-])nc1C)c1ccccc1OC(F)F ZINC000143023494 1417608417 /nfs/dbraw/zinc/60/84/17/1417608417.db2.gz YIVALKMYAYZVJW-CYBMUJFWSA-N 0 0 382.367 3.359 20 5 GGBDRN Cc1cc(C(=O)NC[C@H](O)COc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000143314976 1417625741 /nfs/dbraw/zinc/62/57/41/1417625741.db2.gz LEOZYIFBBUMLQO-AWEZNQCLSA-N 0 0 398.337 3.092 20 5 GGBDRN O=C(NCc1ccc(Cn2cnc3ccccc32)cc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000143334678 1417625897 /nfs/dbraw/zinc/62/58/97/1417625897.db2.gz MHESKTDTGOOAOC-UHFFFAOYSA-N 0 0 375.388 3.251 20 5 GGBDRN Cc1cc(C(=O)NC[C@@H](O)COc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000143315187 1417626541 /nfs/dbraw/zinc/62/65/41/1417626541.db2.gz LEOZYIFBBUMLQO-CQSZACIVSA-N 0 0 398.337 3.092 20 5 GGBDRN CNc1ccc(C(=O)NCc2ccc(-n3ccnc3C)c(F)c2)cc1[N+](=O)[O-] ZINC000143400939 1417631306 /nfs/dbraw/zinc/63/13/06/1417631306.db2.gz CYINNPOUIOVNSO-UHFFFAOYSA-N 0 0 383.383 3.200 20 5 GGBDRN Cc1nn(C)c(NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c1[N+](=O)[O-] ZINC000145178910 1417682787 /nfs/dbraw/zinc/68/27/87/1417682787.db2.gz MJKOFEHITAZFCC-UHFFFAOYSA-N 0 0 380.330 3.453 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(Cc3nc4ccccc4s3)CC2)c1 ZINC000178867453 1429202560 /nfs/dbraw/zinc/20/25/60/1429202560.db2.gz VJYCKHBAGVSGTJ-SFHVURJKSA-N 0 0 398.488 3.056 20 5 GGBDRN CCC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1 ZINC000145801918 1417700586 /nfs/dbraw/zinc/70/05/86/1417700586.db2.gz CMJDNXGDOZMDGQ-KRWDZBQOSA-N 0 0 376.434 3.270 20 5 GGBDRN CC(C)OCc1cccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000145927498 1417704814 /nfs/dbraw/zinc/70/48/14/1417704814.db2.gz KRICAGVKWBIZSW-UHFFFAOYSA-N 0 0 385.420 3.278 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1cc2ccccc2o1 ZINC000145968737 1417705732 /nfs/dbraw/zinc/70/57/32/1417705732.db2.gz GZAREJXTXVWYDV-LLVKDONJSA-N 0 0 388.401 3.236 20 5 GGBDRN Cc1cccc(C)c1OC[C@@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000146108534 1417710791 /nfs/dbraw/zinc/71/07/91/1417710791.db2.gz TYIHNBPBKUGTQA-AWEZNQCLSA-N 0 0 393.827 3.426 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)c(F)c1 ZINC000146246233 1417713327 /nfs/dbraw/zinc/71/33/27/1417713327.db2.gz WWRPOSQPVFDKCF-KSSFIOAISA-N 0 0 394.424 3.180 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)c(F)c1 ZINC000146246620 1417713393 /nfs/dbraw/zinc/71/33/93/1417713393.db2.gz WWRPOSQPVFDKCF-KDOFPFPSSA-N 0 0 394.424 3.180 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000146262669 1417714027 /nfs/dbraw/zinc/71/40/27/1417714027.db2.gz OSYZDJHAGLAEKJ-LPHOPBHVSA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1 ZINC000146337946 1417716445 /nfs/dbraw/zinc/71/64/45/1417716445.db2.gz HIQRUMIGBVAWRM-QAPCUYQASA-N 0 0 376.434 3.041 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(OCC(F)(F)F)cc2)c1 ZINC000146409264 1417719442 /nfs/dbraw/zinc/71/94/42/1417719442.db2.gz MAPFDIJKWUJDOJ-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCCOc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000146407854 1417719552 /nfs/dbraw/zinc/71/95/52/1417719552.db2.gz JKFNAIIXGNCVGY-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2CCCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000146438529 1417720243 /nfs/dbraw/zinc/72/02/43/1417720243.db2.gz UTQCVBBUBIEISK-HNNXBMFYSA-N 0 0 387.367 3.011 20 5 GGBDRN CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000146669301 1417727831 /nfs/dbraw/zinc/72/78/31/1417727831.db2.gz VFZQFYXQQNLFGT-JKSUJKDBSA-N 0 0 382.482 3.333 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000146695609 1417728981 /nfs/dbraw/zinc/72/89/81/1417728981.db2.gz YJQMSBJOQDPKIB-JTQLQIEISA-N 0 0 397.840 3.246 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)[C@@H]2CCCC[C@H]12 ZINC000146972571 1417735250 /nfs/dbraw/zinc/73/52/50/1417735250.db2.gz LTLYVWLFMFNJMA-CSMYWGQOSA-N 0 0 380.466 3.039 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCCc3cc(Cl)ccc32)cc([N+](=O)[O-])c1 ZINC000146954090 1417735345 /nfs/dbraw/zinc/73/53/45/1417735345.db2.gz KFVUMSUEULSQNS-UHFFFAOYSA-N 0 0 394.836 3.245 20 5 GGBDRN CC(C)[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1 ZINC000147008327 1417736220 /nfs/dbraw/zinc/73/62/20/1417736220.db2.gz SPYQSJAKVLGALC-SFHVURJKSA-N 0 0 390.461 3.168 20 5 GGBDRN COc1cc2c(cc1CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000178876441 1429206576 /nfs/dbraw/zinc/20/65/76/1429206576.db2.gz QHJIBCRHVRNEBW-STQMWFEESA-N 0 0 385.420 3.487 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)c1C ZINC000147445621 1417747037 /nfs/dbraw/zinc/74/70/37/1417747037.db2.gz PPCDPXJIXFBPKL-KDOFPFPSSA-N 0 0 390.461 3.362 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1 ZINC000147461533 1417747999 /nfs/dbraw/zinc/74/79/99/1417747999.db2.gz GVBJPJWQFXQNAH-PKOBYXMFSA-N 0 0 390.461 3.182 20 5 GGBDRN O=C(c1ccc(F)c(C(F)(F)F)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000147820054 1417754318 /nfs/dbraw/zinc/75/43/18/1417754318.db2.gz KRWXJUSDRVUNTR-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN COCCOc1ccc([C@H](C)NC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1OC ZINC000148043194 1417758559 /nfs/dbraw/zinc/75/85/59/1417758559.db2.gz ZBIRAJXJSWLKCV-AWEZNQCLSA-N 0 0 388.420 3.428 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2I)ccc1O ZINC000148424997 1417763504 /nfs/dbraw/zinc/76/35/04/1417763504.db2.gz HZLCVPBIVADISI-UHFFFAOYSA-N 0 0 398.156 3.466 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)c1ccc(NC)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000149071102 1417771827 /nfs/dbraw/zinc/77/18/27/1417771827.db2.gz IDLHUUWMQPFGIY-INIZCTEOSA-N 0 0 389.383 3.200 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)c1ccc(NC)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000149071304 1417772259 /nfs/dbraw/zinc/77/22/59/1417772259.db2.gz IDLHUUWMQPFGIY-MRXNPFEDSA-N 0 0 389.383 3.200 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000149921616 1417781737 /nfs/dbraw/zinc/78/17/37/1417781737.db2.gz HPANUCCGHRYZDE-VQIMIIECSA-N 0 0 397.431 3.126 20 5 GGBDRN CC(C)(C)Oc1ccc(CNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000149953083 1417782522 /nfs/dbraw/zinc/78/25/22/1417782522.db2.gz VKINPWLCMAZICU-UHFFFAOYSA-N 0 0 395.419 3.283 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000149987217 1417783141 /nfs/dbraw/zinc/78/31/41/1417783141.db2.gz ZVWURVMYULBBRU-LPHOPBHVSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1OC[C@@H]1CCCCO1 ZINC000150008098 1417783506 /nfs/dbraw/zinc/78/35/06/1417783506.db2.gz PMCFQLUVOCBFCN-HNNXBMFYSA-N 0 0 388.424 3.076 20 5 GGBDRN Cc1cc(C(=O)NCC2(c3ccc4c(c3)OCO4)CCOCC2)ccc1[N+](=O)[O-] ZINC000150093060 1417784857 /nfs/dbraw/zinc/78/48/57/1417784857.db2.gz SVNJNBRPCWRHOA-UHFFFAOYSA-N 0 0 398.415 3.110 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(C)nn2-c2cc(C)nc(C)n2)cc1[N+](=O)[O-] ZINC000150694431 1417789505 /nfs/dbraw/zinc/78/95/05/1417789505.db2.gz FVZRGUKHWHBLKA-UHFFFAOYSA-N 0 0 380.408 3.310 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2NC1=O ZINC000150757522 1417801153 /nfs/dbraw/zinc/80/11/53/1417801153.db2.gz WKGRVDPSOHFUGO-ZDUSSCGKSA-N 0 0 391.387 3.016 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000150765113 1417802527 /nfs/dbraw/zinc/80/25/27/1417802527.db2.gz VDHXUIZERNJCDS-LSDHHAIUSA-N 0 0 399.447 3.032 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H](C)c2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000150778373 1417805126 /nfs/dbraw/zinc/80/51/26/1417805126.db2.gz SWTCYPMPYPLGMY-NSHDSACASA-N 0 0 376.390 3.389 20 5 GGBDRN COc1cc(S(=O)(=O)N(Cc2ccccc2F)C2CC2)ccc1[N+](=O)[O-] ZINC000150778248 1417805257 /nfs/dbraw/zinc/80/52/57/1417805257.db2.gz FLDHPNANDCPGRW-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN CCCNc1ccc(C(F)(F)F)cc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000150785016 1417806443 /nfs/dbraw/zinc/80/64/43/1417806443.db2.gz QKUHUTXGOKRILE-UHFFFAOYSA-N 0 0 398.341 3.236 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000150797662 1417808656 /nfs/dbraw/zinc/80/86/56/1417808656.db2.gz KOWILLMSYUAOAY-CYBMUJFWSA-N 0 0 393.399 3.075 20 5 GGBDRN COc1cc(S(=O)(=O)N(C2CC2)[C@@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000150798100 1417808769 /nfs/dbraw/zinc/80/87/69/1417808769.db2.gz VSDSZWBXFYCTNL-QGZVFWFLSA-N 0 0 388.445 3.444 20 5 GGBDRN COc1cc(S(=O)(=O)N(Cc2ccc(F)cc2F)C2CC2)ccc1[N+](=O)[O-] ZINC000150796742 1417808776 /nfs/dbraw/zinc/80/87/76/1417808776.db2.gz RGKXZILMNCVEHS-UHFFFAOYSA-N 0 0 398.387 3.235 20 5 GGBDRN C[C@@H]1CCC[C@H](C)N(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000150804516 1417810340 /nfs/dbraw/zinc/81/03/40/1417810340.db2.gz NOQJOLBWCQBBQT-KGLIPLIRSA-N 0 0 375.425 3.320 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)CCCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000150804674 1417810417 /nfs/dbraw/zinc/81/04/17/1417810417.db2.gz HQQGOZKEMUIFRA-HNNXBMFYSA-N 0 0 399.447 3.381 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000150804656 1417810485 /nfs/dbraw/zinc/81/04/85/1417810485.db2.gz HQQGOZKEMUIFRA-OAHLLOKOSA-N 0 0 399.447 3.381 20 5 GGBDRN COc1cccc(Br)c1OC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000150812971 1417812172 /nfs/dbraw/zinc/81/21/72/1417812172.db2.gz KIODKHQVZKJAQC-UHFFFAOYSA-N 0 0 382.166 3.350 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000150815592 1417812996 /nfs/dbraw/zinc/81/29/96/1417812996.db2.gz ZGGBMWLWTRDONZ-DZGCQCFKSA-N 0 0 376.434 3.170 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)s1 ZINC000150819168 1417813342 /nfs/dbraw/zinc/81/33/42/1417813342.db2.gz JGYMDNWKAJXQFG-NSHDSACASA-N 0 0 399.494 3.312 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000150818423 1417813412 /nfs/dbraw/zinc/81/34/12/1417813412.db2.gz FJFTXEAKVXFJIF-OAHLLOKOSA-N 0 0 379.438 3.160 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000150820988 1417813794 /nfs/dbraw/zinc/81/37/94/1417813794.db2.gz AEOUWKXNODIREQ-INIZCTEOSA-N 0 0 389.452 3.141 20 5 GGBDRN COc1cc(S(=O)(=O)NC(C)(C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000150828346 1417815351 /nfs/dbraw/zinc/81/53/51/1417815351.db2.gz NEFJTNHWBWHGJC-UHFFFAOYSA-N 0 0 386.376 3.095 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@@H](O)c2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000150837593 1417816856 /nfs/dbraw/zinc/81/68/56/1417816856.db2.gz OGPKNXRJGLOBFV-QGZVFWFLSA-N 0 0 381.388 3.465 20 5 GGBDRN 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1417824506 /nfs/dbraw/zinc/82/45/06/1417824506.db2.gz YBDUAVTYKFLQTD-UHFFFAOYSA-N 0 0 380.413 3.334 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)CCc2cccc([N+](=O)[O-])c2)nc1C ZINC000150872607 1417825074 /nfs/dbraw/zinc/82/50/74/1417825074.db2.gz PRBNLGKHBLMILJ-UHFFFAOYSA-N 0 0 377.422 3.132 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000150873628 1417825524 /nfs/dbraw/zinc/82/55/24/1417825524.db2.gz LEZVWEOQZKXAKI-CHWSQXEVSA-N 0 0 395.431 3.499 20 5 GGBDRN O=C(NCCc1ccc(Cl)nc1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000150880611 1417827146 /nfs/dbraw/zinc/82/71/46/1417827146.db2.gz AWXNPQAQGGMFGW-UHFFFAOYSA-N 0 0 384.617 3.378 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCc2nnc(-c3ccccc3)s2)cc1[N+](=O)[O-] ZINC000150884109 1417827822 /nfs/dbraw/zinc/82/78/22/1417827822.db2.gz XIARUOMCPNZBOB-UHFFFAOYSA-N 0 0 399.388 3.260 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000150884219 1417827839 /nfs/dbraw/zinc/82/78/39/1417827839.db2.gz 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ORJSBMLCZIIYFZ-BEVDRBHNSA-N 0 0 399.447 3.190 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)cc1[N+](=O)[O-] ZINC000151279192 1417913142 /nfs/dbraw/zinc/91/31/42/1417913142.db2.gz IROUUJLYVUMWBK-RHSMWYFYSA-N 0 0 388.468 3.197 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(F)c1 ZINC000151289312 1417916443 /nfs/dbraw/zinc/91/64/43/1417916443.db2.gz SZPJFOXWNGLZAJ-OAHLLOKOSA-N 0 0 380.759 3.422 20 5 GGBDRN COC(=O)C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1 ZINC000151297657 1417919070 /nfs/dbraw/zinc/91/90/70/1417919070.db2.gz OJEPASGDKNAUBG-HNNXBMFYSA-N 0 0 394.786 3.350 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CCO1 ZINC000151300219 1417919586 /nfs/dbraw/zinc/91/95/86/1417919586.db2.gz WAFAKGHHUOJHEK-FQEVSTJZSA-N 0 0 392.415 3.303 20 5 GGBDRN Cc1ccccc1[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CCO1 ZINC000151300292 1417920166 /nfs/dbraw/zinc/92/01/66/1417920166.db2.gz WAFAKGHHUOJHEK-HXUWFJFHSA-N 0 0 392.415 3.303 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)C[C@H](O)c2cccs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000151314397 1417923748 /nfs/dbraw/zinc/92/37/48/1417923748.db2.gz CEMWHNZKKUDJAE-OTYXRUKQSA-N 0 0 393.421 3.423 20 5 GGBDRN COC(=O)c1cc(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)c(C)s1 ZINC000151320988 1417925474 /nfs/dbraw/zinc/92/54/74/1417925474.db2.gz IAEZAPRUCIGPJT-UHFFFAOYSA-N 0 0 385.401 3.023 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3CCOC4(CCCC4)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000151349339 1417932397 /nfs/dbraw/zinc/93/23/97/1417932397.db2.gz GRGHOTOSBNGTIL-UHFFFAOYSA-N 0 0 398.463 3.242 20 5 GGBDRN CC(C)(CNC(=O)NCCn1cc([N+](=O)[O-])cn1)Cc1cccc(Cl)c1 ZINC000151352038 1417933400 /nfs/dbraw/zinc/93/34/00/1417933400.db2.gz WWBJBJSNZDNATL-UHFFFAOYSA-N 0 0 379.848 3.013 20 5 GGBDRN O=C(CCNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)N1CCCCCC1 ZINC000151354577 1417934308 /nfs/dbraw/zinc/93/43/08/1417934308.db2.gz KNCYEZPMVPUJRC-UHFFFAOYSA-N 0 0 388.468 3.062 20 5 GGBDRN O=C(Nc1cccc2[nH]ccc21)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000151357498 1417934823 /nfs/dbraw/zinc/93/48/23/1417934823.db2.gz XIYAYKFKINLLGJ-UHFFFAOYSA-N 0 0 393.403 3.066 20 5 GGBDRN O=C(NCCOc1ncccc1C(F)(F)F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000151377614 1417941642 /nfs/dbraw/zinc/94/16/42/1417941642.db2.gz NMOLUBZELYXISO-UHFFFAOYSA-N 0 0 389.717 3.471 20 5 GGBDRN CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151379804 1417942397 /nfs/dbraw/zinc/94/23/97/1417942397.db2.gz GVFXGHRZWMUMLT-PMACEKPBSA-N 0 0 383.448 3.004 20 5 GGBDRN Cc1ccccc1[C@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000151381750 1417942850 /nfs/dbraw/zinc/94/28/50/1417942850.db2.gz NFUHCJPVLFHMMS-HXUWFJFHSA-N 0 0 392.415 3.303 20 5 GGBDRN COC(=O)CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cccc(C)n1 ZINC000151386828 1417944763 /nfs/dbraw/zinc/94/47/63/1417944763.db2.gz ISXALODSPDHSDD-UHFFFAOYSA-N 0 0 397.309 3.137 20 5 GGBDRN O=C(NCCOc1ncccc1C(F)(F)F)c1cc([N+](=O)[O-])ccc1Cl ZINC000151402523 1417950335 /nfs/dbraw/zinc/95/03/35/1417950335.db2.gz BVNSRJWTDCNMIX-UHFFFAOYSA-N 0 0 389.717 3.471 20 5 GGBDRN COCCN(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000151403568 1417951233 /nfs/dbraw/zinc/95/12/33/1417951233.db2.gz YKQMJYXHBPJRNA-UHFFFAOYSA-N 0 0 377.353 3.002 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(Br)nc2)cc1[N+](=O)[O-] ZINC000151410315 1417954829 /nfs/dbraw/zinc/95/48/29/1417954829.db2.gz OHDVELKHZNWEOL-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)c1 ZINC000151409128 1417954913 /nfs/dbraw/zinc/95/49/13/1417954913.db2.gz OOWMBXBZTGBBEU-UHFFFAOYSA-N 0 0 391.430 3.169 20 5 GGBDRN CC(=O)c1cccc(S(=O)(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000151411507 1417956223 /nfs/dbraw/zinc/95/62/23/1417956223.db2.gz DZHAGFYSKNQUQH-UHFFFAOYSA-N 0 0 376.434 3.099 20 5 GGBDRN CN(Cc1nc2ccccc2s1)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000178935044 1429224544 /nfs/dbraw/zinc/22/45/44/1429224544.db2.gz QVLPDORAENALIC-UHFFFAOYSA-N 0 0 391.474 3.209 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000178936813 1429225101 /nfs/dbraw/zinc/22/51/01/1429225101.db2.gz BRCBOCQFIPDPNO-ZIAGYGMSSA-N 0 0 379.457 3.232 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)c1[N+](=O)[O-] ZINC000151474485 1417989135 /nfs/dbraw/zinc/98/91/35/1417989135.db2.gz LRLVTZHOICCNQF-HNNXBMFYSA-N 0 0 391.786 3.231 20 5 GGBDRN CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1C)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000151477223 1417992365 /nfs/dbraw/zinc/99/23/65/1417992365.db2.gz OZEXHALZQYKGEU-PZJWPPBQSA-N 0 0 397.475 3.313 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1C)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151477156 1417993377 /nfs/dbraw/zinc/99/33/77/1417993377.db2.gz OZEXHALZQYKGEU-CTNGQTDRSA-N 0 0 397.475 3.313 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CC2 ZINC000151480588 1417994443 /nfs/dbraw/zinc/99/44/43/1417994443.db2.gz ZINQMMUHKGWUER-MSOLQXFVSA-N 0 0 390.480 3.284 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC(OC[C@H]3CCCCO3)CC2)c1[N+](=O)[O-] ZINC000151481545 1417994963 /nfs/dbraw/zinc/99/49/63/1417994963.db2.gz PBPBTVKITFBFRU-MRXNPFEDSA-N 0 0 380.416 3.233 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000151495177 1418003021 /nfs/dbraw/zinc/00/30/21/1418003021.db2.gz WANVRGBGCPSNGY-HNNXBMFYSA-N 0 0 397.200 3.268 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000151515874 1418010528 /nfs/dbraw/zinc/01/05/28/1418010528.db2.gz CRLBGNNKAHUEQA-HNNXBMFYSA-N 0 0 397.200 3.268 20 5 GGBDRN Cn1ccnc1C[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000151518181 1418011784 /nfs/dbraw/zinc/01/17/84/1418011784.db2.gz BFKRRQIAKIYDJJ-GFCCVEGCSA-N 0 0 377.832 3.468 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCOC2(CCCC2)C1 ZINC000151566612 1418027019 /nfs/dbraw/zinc/02/70/19/1418027019.db2.gz BXHTZLFBDQMEEJ-UHFFFAOYSA-N 0 0 376.456 3.326 20 5 GGBDRN Cn1cc(C(=O)N2CCC(OC(C)(C)C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000151577923 1418030216 /nfs/dbraw/zinc/03/02/16/1418030216.db2.gz QGZGZZXHYVWGTN-UHFFFAOYSA-N 0 0 386.452 3.415 20 5 GGBDRN O=C([C@H](c1ccccc1)N1CCCCC1=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000151588716 1418033862 /nfs/dbraw/zinc/03/38/62/1418033862.db2.gz PHXXYULXCLFOIK-FQEVSTJZSA-N 0 0 379.416 3.238 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1noc(C)n1 ZINC000151607630 1418038263 /nfs/dbraw/zinc/03/82/63/1418038263.db2.gz OUNGTQXPNWEVMS-IBGZPJMESA-N 0 0 396.403 3.133 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1noc(C)n1 ZINC000151607573 1418038453 /nfs/dbraw/zinc/03/84/53/1418038453.db2.gz OUNGTQXPNWEVMS-LJQANCHMSA-N 0 0 396.403 3.133 20 5 GGBDRN COC[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC1 ZINC000151662469 1418053856 /nfs/dbraw/zinc/05/38/56/1418053856.db2.gz QITDGBWVGVYQTB-FZKQIMNGSA-N 0 0 384.436 3.318 20 5 GGBDRN COC[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC1 ZINC000151662316 1418054025 /nfs/dbraw/zinc/05/40/25/1418054025.db2.gz QITDGBWVGVYQTB-ACJLOTCBSA-N 0 0 384.436 3.318 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@H]2CC(=O)c2ccccc2)c1[N+](=O)[O-] ZINC000151664846 1418054408 /nfs/dbraw/zinc/05/44/08/1418054408.db2.gz MMVPYWVIGLXCME-INIZCTEOSA-N 0 0 384.436 3.295 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OS(=O)(=O)c1sccc1Br ZINC000151687187 1418061290 /nfs/dbraw/zinc/06/12/90/1418061290.db2.gz RETFHTNAUGEJFH-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](c1cccc(F)c1)C1CCCC1 ZINC000151690015 1418061610 /nfs/dbraw/zinc/06/16/10/1418061610.db2.gz VGMAVXRDZOEMDW-QGZVFWFLSA-N 0 0 375.404 3.161 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N(CCc1ccc(Cl)cc1)CC1CC1 ZINC000151692657 1418062909 /nfs/dbraw/zinc/06/29/09/1418062909.db2.gz YQCFHRXCRRAAJU-UHFFFAOYSA-N 0 0 391.859 3.109 20 5 GGBDRN COc1cc(CCNC(=O)c2cnc(C(C)C)s2)c([N+](=O)[O-])cc1OC ZINC000178951322 1429227834 /nfs/dbraw/zinc/22/78/34/1429227834.db2.gz FLQPXPDYUGKBOA-UHFFFAOYSA-N 0 0 379.438 3.164 20 5 GGBDRN CC[C@H](C)OCC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000178952056 1429227891 /nfs/dbraw/zinc/22/78/91/1429227891.db2.gz GODMSIGFHTWQCG-LBPRGKRZSA-N 0 0 389.374 3.077 20 5 GGBDRN Cc1ccc(OS(=O)(=O)c2sccc2Br)cc1[N+](=O)[O-] ZINC000151701714 1418066153 /nfs/dbraw/zinc/06/61/53/1418066153.db2.gz PCKFANPDRBCLKX-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2nc(-c3ccc(F)c(F)c3)no2)c1 ZINC000151722456 1418071360 /nfs/dbraw/zinc/07/13/60/1418071360.db2.gz WTWRTMCDDICMMY-UHFFFAOYSA-N 0 0 391.286 3.289 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(COc3cc([N+](=O)[O-])ccc3C)nc2c1 ZINC000151727280 1418072317 /nfs/dbraw/zinc/07/23/17/1418072317.db2.gz QXHTVNASHKBHIS-UHFFFAOYSA-N 0 0 376.390 3.417 20 5 GGBDRN CC(=O)Nc1cccc(OC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000151729681 1418073196 /nfs/dbraw/zinc/07/31/96/1418073196.db2.gz GBQBGEIQZOFJJU-UHFFFAOYSA-N 0 0 393.193 3.464 20 5 GGBDRN C[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc2c(c1)CCC(=O)N2 ZINC000178973558 1429232076 /nfs/dbraw/zinc/23/20/76/1429232076.db2.gz KEJPGNVUIKOHEQ-LBPRGKRZSA-N 0 0 392.415 3.381 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@H]2CC[C@@H](CO)CC2)CC1 ZINC000151742862 1418076214 /nfs/dbraw/zinc/07/62/14/1418076214.db2.gz ALPJBAGTZUDIOV-WKILWMFISA-N 0 0 375.469 3.112 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](Cc1ccccc1)c1ccccc1F ZINC000151750031 1418077602 /nfs/dbraw/zinc/07/76/02/1418077602.db2.gz HQVUHJRQEBFQJI-IBGZPJMESA-N 0 0 397.410 3.214 20 5 GGBDRN CCn1c(-c2cccc(C)c2)nnc1S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151756811 1418079354 /nfs/dbraw/zinc/07/93/54/1418079354.db2.gz KSDKCMOYZRSTLB-UHFFFAOYSA-N 0 0 386.433 3.156 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-] ZINC000151768059 1418082963 /nfs/dbraw/zinc/08/29/63/1418082963.db2.gz XBIWQPSJRILTEN-OAHLLOKOSA-N 0 0 379.438 3.160 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCc2nccn2CCc2ccccc2)c1[N+](=O)[O-] ZINC000151772885 1418084050 /nfs/dbraw/zinc/08/40/50/1418084050.db2.gz KTTAWUMVYPUVSN-UHFFFAOYSA-N 0 0 382.395 3.412 20 5 GGBDRN O=C(CN1CCC[C@H]1C[C@H](O)c1ccco1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000151774649 1418084283 /nfs/dbraw/zinc/08/42/83/1418084283.db2.gz RQINWRUDXBTWNZ-LRDDRELGSA-N 0 0 393.827 3.368 20 5 GGBDRN O=C(CN1CCC[C@H]1C[C@@H](O)c1ccco1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000151774580 1418084591 /nfs/dbraw/zinc/08/45/91/1418084591.db2.gz RQINWRUDXBTWNZ-BLLLJJGKSA-N 0 0 393.827 3.368 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000151815891 1418093608 /nfs/dbraw/zinc/09/36/08/1418093608.db2.gz CLNDJJYGOSBIHX-HNNXBMFYSA-N 0 0 398.467 3.175 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000151825697 1418095280 /nfs/dbraw/zinc/09/52/80/1418095280.db2.gz RWEVKKYUWNZLRH-AWEZNQCLSA-N 0 0 395.419 3.108 20 5 GGBDRN CCOC(=O)CC[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000178981784 1429233917 /nfs/dbraw/zinc/23/39/17/1429233917.db2.gz DWYVYLUAMYEZIE-LSDHHAIUSA-N 0 0 377.441 3.421 20 5 GGBDRN Cc1ccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])c(OC[C@@H]2CCCO2)c1 ZINC000151964013 1418107342 /nfs/dbraw/zinc/10/73/42/1418107342.db2.gz LWARYYRSDXZLAY-SFHVURJKSA-N 0 0 384.432 3.320 20 5 GGBDRN Cc1ccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])c(OC[C@H]2CCCO2)c1 ZINC000151964087 1418107480 /nfs/dbraw/zinc/10/74/80/1418107480.db2.gz LWARYYRSDXZLAY-GOSISDBHSA-N 0 0 384.432 3.320 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[C@H]3C[C@@H](O)c3ccco3)o2)cc1 ZINC000151964885 1418107796 /nfs/dbraw/zinc/10/77/96/1418107796.db2.gz PKMRCADZURPBIO-JKSUJKDBSA-N 0 0 384.392 3.326 20 5 GGBDRN O=C(C[C@@H]1COCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1cccs1 ZINC000151979300 1418111535 /nfs/dbraw/zinc/11/15/35/1418111535.db2.gz SHLOWAWLNUAKLO-CQSZACIVSA-N 0 0 394.836 3.424 20 5 GGBDRN CN1C(=O)CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c2ccccc21 ZINC000151994308 1418115552 /nfs/dbraw/zinc/11/55/52/1418115552.db2.gz MVSQWMXHKVRUSF-UHFFFAOYSA-N 0 0 379.294 3.237 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000152001708 1418117469 /nfs/dbraw/zinc/11/74/69/1418117469.db2.gz UBJRUXBTUKWYHC-LZQZEXGQSA-N 0 0 385.464 3.273 20 5 GGBDRN C[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H](O)Cc1ccccc1 ZINC000152019305 1418122174 /nfs/dbraw/zinc/12/21/74/1418122174.db2.gz VCALBOBTLKIYLN-SCLBCKFNSA-N 0 0 397.456 3.440 20 5 GGBDRN C[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H](O)Cc1ccccc1 ZINC000152019374 1418122312 /nfs/dbraw/zinc/12/23/12/1418122312.db2.gz VCALBOBTLKIYLN-FZKQIMNGSA-N 0 0 397.456 3.440 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@H](CC(C)C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000152043668 1418128775 /nfs/dbraw/zinc/12/87/75/1418128775.db2.gz NPBRHCZYYHXPCQ-MRXNPFEDSA-N 0 0 398.463 3.347 20 5 GGBDRN C[C@@H]1COCCN1c1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1 ZINC000152050550 1418130255 /nfs/dbraw/zinc/13/02/55/1418130255.db2.gz UPVYLYHUFVSBTA-LLVKDONJSA-N 0 0 377.347 3.350 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000152053891 1418131782 /nfs/dbraw/zinc/13/17/82/1418131782.db2.gz IATMWMLMGRVMCM-WFASDCNBSA-N 0 0 389.481 3.442 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@@H](O)Cc1ccccc1 ZINC000152079279 1418139389 /nfs/dbraw/zinc/13/93/89/1418139389.db2.gz MHFSEUMYKXZBSW-KKSFZXQISA-N 0 0 397.475 3.307 20 5 GGBDRN Cc1cc(C)cc(CCC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000152098249 1418145446 /nfs/dbraw/zinc/14/54/46/1418145446.db2.gz DDRNQSFQRQSQGN-UHFFFAOYSA-N 0 0 395.459 3.129 20 5 GGBDRN C[C@@H]1COCCN1c1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000152110425 1418147949 /nfs/dbraw/zinc/14/79/49/1418147949.db2.gz XJICPDDIZCSPEI-OAHLLOKOSA-N 0 0 385.420 3.228 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000152116208 1418149544 /nfs/dbraw/zinc/14/95/44/1418149544.db2.gz IOEQSYXKUOPADP-UHFFFAOYSA-N 0 0 386.799 3.022 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000152122971 1418151047 /nfs/dbraw/zinc/15/10/47/1418151047.db2.gz IAMPNLINNGNFDR-FOIQADDNSA-N 0 0 390.439 3.376 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000152134871 1418154035 /nfs/dbraw/zinc/15/40/35/1418154035.db2.gz DSLPOCAFJULDCD-UHFFFAOYSA-N 0 0 396.447 3.007 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](O)Cc1ccccc1 ZINC000152146116 1418157358 /nfs/dbraw/zinc/15/73/58/1418157358.db2.gz CNCCGZIHKTVPFL-GUYCJALGSA-N 0 0 392.839 3.125 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000152171362 1418163995 /nfs/dbraw/zinc/16/39/95/1418163995.db2.gz YGBSHYCSLOAMSO-NSHDSACASA-N 0 0 383.408 3.134 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000152182422 1418167462 /nfs/dbraw/zinc/16/74/62/1418167462.db2.gz ONWMXYDBRVVQSH-WBVHZDCISA-N 0 0 387.480 3.371 20 5 GGBDRN CC[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152185265 1418167932 /nfs/dbraw/zinc/16/79/32/1418167932.db2.gz XJYIJNLZTDAWSL-HNNXBMFYSA-N 0 0 377.441 3.389 20 5 GGBDRN O=C(CCc1nc(-c2ccccn2)no1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152183959 1418167951 /nfs/dbraw/zinc/16/79/51/1418167951.db2.gz FWKQRLPAUJGRKS-UHFFFAOYSA-N 0 0 393.403 3.164 20 5 GGBDRN O=C(COc1ccc2c(c1)CCC(=O)N2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152193907 1418169970 /nfs/dbraw/zinc/16/99/70/1418169970.db2.gz UCXULHWNDQDGPV-UHFFFAOYSA-N 0 0 395.415 3.050 20 5 GGBDRN O=C(NCCCc1nc2ccccc2[nH]1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000152196009 1418170156 /nfs/dbraw/zinc/17/01/56/1418170156.db2.gz XDTJDEILWINRLF-UHFFFAOYSA-N 0 0 379.420 3.172 20 5 GGBDRN O=C([C@H]1CC(=O)N(Cc2ccccc2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152202343 1418172188 /nfs/dbraw/zinc/17/21/88/1418172188.db2.gz YJXREDCUPYTVRM-SFHVURJKSA-N 0 0 393.443 3.135 20 5 GGBDRN C[C@H](C[C@H](O)c1ccco1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000152206991 1418172941 /nfs/dbraw/zinc/17/29/41/1418172941.db2.gz JQFCLFPIAOZERN-KDOFPFPSSA-N 0 0 387.436 3.420 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccco1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000152207071 1418172969 /nfs/dbraw/zinc/17/29/69/1418172969.db2.gz JQFCLFPIAOZERN-KBXCAEBGSA-N 0 0 387.436 3.420 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2cnn(C[C@H](O)COc3cccc4[nH]ccc43)c2)cc1 ZINC000152208429 1418173438 /nfs/dbraw/zinc/17/34/38/1418173438.db2.gz WGYSKIHDNUOPBR-KRWDZBQOSA-N 0 0 378.388 3.380 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2cnn(C[C@@H](O)COc3cccc4[nH]ccc43)c2)cc1 ZINC000152208333 1418173717 /nfs/dbraw/zinc/17/37/17/1418173717.db2.gz WGYSKIHDNUOPBR-QGZVFWFLSA-N 0 0 378.388 3.380 20 5 GGBDRN CCOc1ccc(OC[C@@H](O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000152214755 1418175293 /nfs/dbraw/zinc/17/52/93/1418175293.db2.gz QTAGEWUCYBIEHD-SFHVURJKSA-N 0 0 383.404 3.297 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C12CCC2 ZINC000152225786 1418178461 /nfs/dbraw/zinc/17/84/61/1418178461.db2.gz QWTQHQMSAPNJFI-GJZGRUSLSA-N 0 0 377.397 3.197 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2C[C@@H](C)OC[C@@H]2C)c1=S ZINC000152228867 1418179208 /nfs/dbraw/zinc/17/92/08/1418179208.db2.gz JTPWQOHZSLITLK-QWHCGFSZSA-N 0 0 377.470 3.076 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCOCC12CCC2 ZINC000152252623 1418184555 /nfs/dbraw/zinc/18/45/55/1418184555.db2.gz BRNDXTIBIISXGM-UHFFFAOYSA-N 0 0 387.358 3.197 20 5 GGBDRN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000152272271 1418190824 /nfs/dbraw/zinc/19/08/24/1418190824.db2.gz QSYBRCOIZWHSCB-MRXNPFEDSA-N 0 0 387.823 3.169 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCOCC12CCC2 ZINC000152277881 1418191888 /nfs/dbraw/zinc/19/18/88/1418191888.db2.gz JCUZJEVTULMOFF-UHFFFAOYSA-N 0 0 390.383 3.487 20 5 GGBDRN Cc1ccc(N2CCN(Cn3cc([N+](=O)[O-])c(-c4ccncc4)n3)CC2)cc1C ZINC000152280985 1418193600 /nfs/dbraw/zinc/19/36/00/1418193600.db2.gz NOXZUSANVMHYEM-UHFFFAOYSA-N 0 0 392.463 3.250 20 5 GGBDRN CCN(CC(=O)NCc1ccc(F)cc1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152287925 1418195668 /nfs/dbraw/zinc/19/56/68/1418195668.db2.gz AXSNXTOTGZWOQI-UHFFFAOYSA-N 0 0 393.802 3.166 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000179005751 1429240941 /nfs/dbraw/zinc/24/09/41/1429240941.db2.gz IWUJQISHSGXWSF-MAUKXSAKSA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCSC(F)(F)F)c(C(F)(F)F)c1 ZINC000179026768 1429245442 /nfs/dbraw/zinc/24/54/42/1429245442.db2.gz LJFUKPJHXQYZLD-UHFFFAOYSA-N 0 0 398.306 3.145 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cc1Cl ZINC000179030483 1429245940 /nfs/dbraw/zinc/24/59/40/1429245940.db2.gz GLZYSVIAFZQWJN-SFHVURJKSA-N 0 0 389.795 3.224 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cnn(CC(C)C)c1C(F)F ZINC000179035634 1429247372 /nfs/dbraw/zinc/24/73/72/1429247372.db2.gz ZHLNKHDJMCYAMP-UHFFFAOYSA-N 0 0 382.367 3.324 20 5 GGBDRN O=C1NC2(CCCCC2)C(=O)N1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000179044499 1429249082 /nfs/dbraw/zinc/24/90/82/1429249082.db2.gz DZJHURSXICZSBD-UHFFFAOYSA-N 0 0 382.214 3.112 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCc2c3ccccc3[nH]c2C1 ZINC000179054436 1429251253 /nfs/dbraw/zinc/25/12/53/1429251253.db2.gz PKGBHJIMOMFBKG-UHFFFAOYSA-N 0 0 380.404 3.353 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2cccc(Br)c2)cc1F ZINC000179073961 1429254965 /nfs/dbraw/zinc/25/49/65/1429254965.db2.gz CGDYXSRHBGPXCN-NSHDSACASA-N 0 0 386.173 3.315 20 5 GGBDRN COc1cc(CCNC(=O)C[C@@H](C)c2c(C)noc2C)c([N+](=O)[O-])cc1OC ZINC000179076323 1429255620 /nfs/dbraw/zinc/25/56/20/1429255620.db2.gz MOVCIUUXRLJRIO-LLVKDONJSA-N 0 0 391.424 3.069 20 5 GGBDRN CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000179097410 1429262641 /nfs/dbraw/zinc/26/26/41/1429262641.db2.gz QAAMWTMMVOZDQT-JIOITTSWSA-N 0 0 389.477 3.132 20 5 GGBDRN CS[C@H](C)CC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000179111412 1429265319 /nfs/dbraw/zinc/26/53/19/1429265319.db2.gz OGFRKDILYCXSDG-LLVKDONJSA-N 0 0 391.415 3.404 20 5 GGBDRN COC(=O)c1cc(OC[C@H](O)c2ccccc2Br)ccc1[N+](=O)[O-] ZINC000179114148 1429266234 /nfs/dbraw/zinc/26/62/34/1429266234.db2.gz GFPCWSZJBMRTBA-HNNXBMFYSA-N 0 0 396.193 3.256 20 5 GGBDRN COC(=O)c1cc(OC[C@H](O)Cc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000179113780 1429266965 /nfs/dbraw/zinc/26/69/65/1429266965.db2.gz ZUOCJLRHPWGLCE-CYBMUJFWSA-N 0 0 399.321 3.383 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000179143273 1429276113 /nfs/dbraw/zinc/27/61/13/1429276113.db2.gz NSOWULTWSSAJBB-IBGZPJMESA-N 0 0 377.441 3.248 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)n1nc(-c2cccs2)oc1=O ZINC000179146716 1429277574 /nfs/dbraw/zinc/27/75/74/1429277574.db2.gz LWMVYKHRIKSTMB-QMMMGPOBSA-N 0 0 394.796 3.326 20 5 GGBDRN O=C(CC1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1)N1CCCC1 ZINC000179157716 1429280233 /nfs/dbraw/zinc/28/02/33/1429280233.db2.gz VLUOFFIIOLQGFW-UHFFFAOYSA-N 0 0 398.463 3.474 20 5 GGBDRN CCCN(CC(=O)OC)C(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000179160223 1429281382 /nfs/dbraw/zinc/28/13/82/1429281382.db2.gz DUXLJWSRXPEFPY-UHFFFAOYSA-N 0 0 393.621 3.036 20 5 GGBDRN O=C(NCCc1c[nH]c2ccccc12)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179160924 1429281631 /nfs/dbraw/zinc/28/16/31/1429281631.db2.gz MXUZDWFZXUISDD-UHFFFAOYSA-N 0 0 375.388 3.234 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000179166147 1429283040 /nfs/dbraw/zinc/28/30/40/1429283040.db2.gz GOVPPNKUVWDHIM-LJQANCHMSA-N 0 0 396.378 3.133 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000179182217 1429288124 /nfs/dbraw/zinc/28/81/24/1429288124.db2.gz QYYPXKNYFOWDKS-GOSISDBHSA-N 0 0 387.436 3.086 20 5 GGBDRN O=[N+]([O-])c1ccc(C[N@H+](Cc2cn3ccccc3c2-c2nnn[n-]2)C2CC2)cc1 ZINC000826498276 1429297914 /nfs/dbraw/zinc/29/79/14/1429297914.db2.gz OBRDKTSESAUFGC-UHFFFAOYSA-N 0 0 389.419 3.192 20 5 GGBDRN CN(Cc1ccccc1N1CCOCC1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000179221669 1429298495 /nfs/dbraw/zinc/29/84/95/1429298495.db2.gz 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VOOWJEKMRTUNFK-CYBMUJFWSA-N 0 0 399.469 3.451 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)CCC2 ZINC000152988978 1422319162 /nfs/dbraw/zinc/31/91/62/1422319162.db2.gz VOOWJEKMRTUNFK-ZDUSSCGKSA-N 0 0 399.469 3.451 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)c1 ZINC000153002532 1422322770 /nfs/dbraw/zinc/32/27/70/1422322770.db2.gz XGYADFHRCGZDNQ-INIZCTEOSA-N 0 0 385.445 3.160 20 5 GGBDRN O=C(N[C@@H](CCCO)c1ccccc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153019621 1422328741 /nfs/dbraw/zinc/32/87/41/1422328741.db2.gz SZIVLHNGYBZNHK-SFHVURJKSA-N 0 0 380.404 3.024 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)c1 ZINC000153029725 1422332596 /nfs/dbraw/zinc/33/25/96/1422332596.db2.gz ZMSPLYXUULDVII-QGZVFWFLSA-N 0 0 396.852 3.231 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000153034635 1422334230 /nfs/dbraw/zinc/33/42/30/1422334230.db2.gz QPGHEQXHJCKJRQ-ZDUSSCGKSA-N 0 0 398.369 3.430 20 5 GGBDRN Cc1coc(-c2ccc(C)c(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)c2)n1 ZINC000153043826 1422337193 /nfs/dbraw/zinc/33/71/93/1422337193.db2.gz UZMHYVNSQNQGEO-UHFFFAOYSA-N 0 0 394.387 3.235 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(Nc2cccc(C)c2)CC1 ZINC000153065212 1422344596 /nfs/dbraw/zinc/34/45/96/1422344596.db2.gz VZSFLDRXMAFHGK-UHFFFAOYSA-N 0 0 398.463 3.427 20 5 GGBDRN COC(=O)C1(N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCCCC1 ZINC000153100913 1422357133 /nfs/dbraw/zinc/35/71/33/1422357133.db2.gz LGCUXALYGAMOPS-UHFFFAOYSA-N 0 0 389.452 3.143 20 5 GGBDRN COC(=O)C1(N(C)C(=O)c2cc([N+](=O)[O-])ccc2Br)CCCCC1 ZINC000153106316 1422359152 /nfs/dbraw/zinc/35/91/52/1422359152.db2.gz MRJCDIAMXVJTOE-UHFFFAOYSA-N 0 0 399.241 3.305 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)COc2cccc(I)c2)c1 ZINC000153116574 1422362730 /nfs/dbraw/zinc/36/27/30/1422362730.db2.gz OXEQGLWDMFEWGH-AWEZNQCLSA-N 0 0 385.157 3.312 20 5 GGBDRN CC(C)[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1 ZINC000153119024 1422363254 /nfs/dbraw/zinc/36/32/54/1422363254.db2.gz TYBFCVGBXFGOPE-KRWDZBQOSA-N 0 0 397.353 3.289 20 5 GGBDRN O=C(Nc1ccc(-c2ncco2)cc1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000153123601 1422364674 /nfs/dbraw/zinc/36/46/74/1422364674.db2.gz VVXHNWBOEBPCCD-UHFFFAOYSA-N 0 0 376.332 3.083 20 5 GGBDRN CC1(C)NC(=O)N(CCCOc2ccc(-c3ccccc3)cc2[N+](=O)[O-])C1=O ZINC000153129133 1422366841 /nfs/dbraw/zinc/36/68/41/1422366841.db2.gz JMISYMVWVRJENB-UHFFFAOYSA-N 0 0 383.404 3.361 20 5 GGBDRN COc1ccc(NC(=O)CN2CCc3ccc(Cl)cc3C2)c([N+](=O)[O-])c1 ZINC000153149982 1422372996 /nfs/dbraw/zinc/37/29/96/1422372996.db2.gz PRDPJZJUICXMTG-UHFFFAOYSA-N 0 0 375.812 3.254 20 5 GGBDRN Cc1cccc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c1 ZINC000153153752 1422373542 /nfs/dbraw/zinc/37/35/42/1422373542.db2.gz VEDQMDNJVIZZPU-HXUWFJFHSA-N 0 0 383.448 3.357 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000153159729 1422376878 /nfs/dbraw/zinc/37/68/78/1422376878.db2.gz GGGDJAMVUHLJHC-AWEZNQCLSA-N 0 0 391.449 3.196 20 5 GGBDRN COC(=O)C1(N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CCCCC1 ZINC000153160893 1422377657 /nfs/dbraw/zinc/37/76/57/1422377657.db2.gz ZLJLFWFRINVIJA-UHFFFAOYSA-N 0 0 375.425 3.117 20 5 GGBDRN O=C(NCc1nc(C(F)(F)F)cs1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000153168403 1422380093 /nfs/dbraw/zinc/38/00/93/1422380093.db2.gz KYGSBBHMOVQACJ-UHFFFAOYSA-N 0 0 397.338 3.186 20 5 GGBDRN O=C(Nc1ccc(-n2cncn2)cc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000153176193 1422382181 /nfs/dbraw/zinc/38/21/81/1422382181.db2.gz FCUHSHJCEFXOHN-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COc1ccc(C(C)(C)C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1OC ZINC000153183418 1422384103 /nfs/dbraw/zinc/38/41/03/1422384103.db2.gz AWFHMMSXTZLFKV-UHFFFAOYSA-N 0 0 384.392 3.405 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000153182954 1422384515 /nfs/dbraw/zinc/38/45/15/1422384515.db2.gz UFNABJMGYQXEHI-AWEZNQCLSA-N 0 0 394.435 3.335 20 5 GGBDRN Cc1cc(F)cc2c(O)c(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)cnc12 ZINC000153182824 1422384557 /nfs/dbraw/zinc/38/45/57/1422384557.db2.gz LQGBTNZQHOFCLQ-UHFFFAOYSA-N 0 0 381.323 3.012 20 5 GGBDRN NC(=O)c1cc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])c(Cl)c3)n2)c[nH]1 ZINC000153193139 1422388472 /nfs/dbraw/zinc/38/84/72/1422388472.db2.gz HZFWZQQBPUZIKI-UHFFFAOYSA-N 0 0 391.796 3.051 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)NCCc3ccncc3C)cc2)c(C)c1[N+](=O)[O-] ZINC000153196176 1422389265 /nfs/dbraw/zinc/38/92/65/1422389265.db2.gz WBEJTYVYKYPAAO-UHFFFAOYSA-N 0 0 393.447 3.132 20 5 GGBDRN COCCCOc1cc(C)ccc1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000153203656 1422392549 /nfs/dbraw/zinc/39/25/49/1422392549.db2.gz SNUJMKLGIRGJAE-UHFFFAOYSA-N 0 0 387.436 3.318 20 5 GGBDRN Cn1cc(Nc2cccc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c2)cn1 ZINC000153207804 1422393641 /nfs/dbraw/zinc/39/36/41/1422393641.db2.gz JFOXYAZRETVDNR-UHFFFAOYSA-N 0 0 377.364 3.201 20 5 GGBDRN CCC(CC)c1cc(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])on1 ZINC000153208853 1422393706 /nfs/dbraw/zinc/39/37/06/1422393706.db2.gz OUYUKHIOSZLXSU-UHFFFAOYSA-N 0 0 396.469 3.349 20 5 GGBDRN COc1ccc(C(C)=O)cc1CC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153221699 1422398877 /nfs/dbraw/zinc/39/88/77/1422398877.db2.gz VXVFGDVBABKVMW-UHFFFAOYSA-N 0 0 384.432 3.488 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(N2CCCCC2=O)CC1 ZINC000153228395 1422403346 /nfs/dbraw/zinc/40/33/46/1422403346.db2.gz GWHCSKXKHKOVLM-AWEZNQCLSA-N 0 0 399.451 3.183 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@@]2(CCOC2)C1 ZINC000153237922 1422410756 /nfs/dbraw/zinc/41/07/56/1422410756.db2.gz OJCOOSWTPCQJPY-OAHLLOKOSA-N 0 0 390.383 3.345 20 5 GGBDRN Cc1cccc([C@@H](CC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)NC(N)=O)c1 ZINC000153239906 1422411816 /nfs/dbraw/zinc/41/18/16/1422411816.db2.gz FOUKGBYRXUDXHL-LJQANCHMSA-N 0 0 398.463 3.142 20 5 GGBDRN O=C(COc1ccc2ccc(=O)oc2c1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153241598 1422413940 /nfs/dbraw/zinc/41/39/40/1422413940.db2.gz IDKWOSYZYNIBQR-UHFFFAOYSA-N 0 0 396.399 3.219 20 5 GGBDRN Cc1nn2c(nc(C)cc2C)c1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153258866 1422423723 /nfs/dbraw/zinc/42/37/23/1422423723.db2.gz YYTDIIRZPJEVNS-UHFFFAOYSA-N 0 0 381.436 3.315 20 5 GGBDRN O=C(CCc1nc(-c2ccccn2)no1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153261495 1422425117 /nfs/dbraw/zinc/42/51/17/1422425117.db2.gz SUPSGDKBYJCRSR-UHFFFAOYSA-N 0 0 395.419 3.112 20 5 GGBDRN Cc1c(C(=O)N2CCN(Cc3ccc(Cl)cc3)C(=O)C2)cccc1[N+](=O)[O-] ZINC000153279135 1422434938 /nfs/dbraw/zinc/43/49/38/1422434938.db2.gz DNUROVSCEJHCAM-UHFFFAOYSA-N 0 0 387.823 3.041 20 5 GGBDRN CS(=O)(=O)c1cccc(OCCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153279436 1422436399 /nfs/dbraw/zinc/43/63/99/1422436399.db2.gz GSXBGKAGUCMPNS-UHFFFAOYSA-N 0 0 390.461 3.042 20 5 GGBDRN O=C(CN(Cc1cccc([N+](=O)[O-])c1)C1CC1)N[C@@H]1CCOc2ccccc21 ZINC000153284981 1422438769 /nfs/dbraw/zinc/43/87/69/1422438769.db2.gz YYBFLVOVGZCLLX-LJQANCHMSA-N 0 0 381.432 3.199 20 5 GGBDRN O=C(CN(Cc1cccc([N+](=O)[O-])c1)C1CC1)N[C@H]1CCOc2ccccc21 ZINC000153285095 1422438929 /nfs/dbraw/zinc/43/89/29/1422438929.db2.gz YYBFLVOVGZCLLX-IBGZPJMESA-N 0 0 381.432 3.199 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000153284481 1422439453 /nfs/dbraw/zinc/43/94/53/1422439453.db2.gz MWPLSKWSGXAUJD-ZQMYSKGWSA-N 0 0 388.467 3.229 20 5 GGBDRN CCc1cc(=O)oc2cc(OC[C@H](O)COc3cccc([N+](=O)[O-])c3)ccc12 ZINC000153284520 1422439708 /nfs/dbraw/zinc/43/97/08/1422439708.db2.gz KAZBKHLGKNSEMB-OAHLLOKOSA-N 0 0 385.372 3.082 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCO[C@@H](c2cccc(OC(F)F)c2)C1 ZINC000153302171 1422452466 /nfs/dbraw/zinc/45/24/66/1422452466.db2.gz BAAJRKUKRIAJRN-GFCCVEGCSA-N 0 0 384.360 3.471 20 5 GGBDRN CCN(C[C@H]1COc2ccccc2O1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000153308026 1422458469 /nfs/dbraw/zinc/45/84/69/1422458469.db2.gz QRFYUOPKSXSSCC-AWEZNQCLSA-N 0 0 393.399 3.445 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2F)C1=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000153322729 1422469146 /nfs/dbraw/zinc/46/91/46/1422469146.db2.gz QUIPFYHGRKQKPB-OAHLLOKOSA-N 0 0 391.786 3.313 20 5 GGBDRN O=C(COC(=O)c1cc(Br)cc([N+](=O)[O-])c1)Nc1ccccc1 ZINC000153335971 1422476898 /nfs/dbraw/zinc/47/68/98/1422476898.db2.gz RIJPKOCSLKUTJI-UHFFFAOYSA-N 0 0 379.166 3.153 20 5 GGBDRN O=C(CCc1ccccc1)c1ccccc1OC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000153363052 1422496039 /nfs/dbraw/zinc/49/60/39/1422496039.db2.gz MFYXMNYKOBVCKI-GOSISDBHSA-N 0 0 395.415 3.047 20 5 GGBDRN O=C(NCCCOCCc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153369101 1422500747 /nfs/dbraw/zinc/50/07/47/1422500747.db2.gz FHHDLWMSUULDEH-UHFFFAOYSA-N 0 0 383.448 3.312 20 5 GGBDRN O=C(C[C@H]1COCCN1C(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000153375198 1422503653 /nfs/dbraw/zinc/50/36/53/1422503653.db2.gz BKIDBXLSBRHORP-IBGZPJMESA-N 0 0 382.416 3.028 20 5 GGBDRN Cc1cccc([C@@H](O)CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000153380186 1422506084 /nfs/dbraw/zinc/50/60/84/1422506084.db2.gz FKWPGUXINKSDMB-KRWDZBQOSA-N 0 0 383.429 3.490 20 5 GGBDRN Cc1c(C(=O)Nc2cccnc2OCC(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000153393950 1422511971 /nfs/dbraw/zinc/51/19/71/1422511971.db2.gz BNMRGQKHZURYAA-UHFFFAOYSA-N 0 0 382.279 3.103 20 5 GGBDRN Cc1c(C(=O)Nc2cccnc2OCC(F)F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000153397088 1422514188 /nfs/dbraw/zinc/51/41/88/1422514188.db2.gz SNDFIPGCTHZJAR-UHFFFAOYSA-N 0 0 396.306 3.411 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1OC)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000153403694 1422517102 /nfs/dbraw/zinc/51/71/02/1422517102.db2.gz DHFDUQIBQSKUEO-UHFFFAOYSA-N 0 0 399.447 3.413 20 5 GGBDRN Cc1c(C(=O)O[C@H]([C@@H]2CCCO2)C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000153409251 1422520330 /nfs/dbraw/zinc/52/03/30/1422520330.db2.gz WTLFRSFRQXUWCQ-NWDGAFQWSA-N 0 0 378.259 3.078 20 5 GGBDRN CN(C(=O)c1cn(-c2cccc(Cl)c2F)nn1)c1cccc([N+](=O)[O-])c1 ZINC000179788899 1429564539 /nfs/dbraw/zinc/56/45/39/1429564539.db2.gz SFCOUAVUTMAZMJ-UHFFFAOYSA-N 0 0 375.747 3.245 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000153415475 1422522895 /nfs/dbraw/zinc/52/28/95/1422522895.db2.gz LPRKYDAXSSRFDR-OAHLLOKOSA-N 0 0 398.337 3.232 20 5 GGBDRN Cc1c(NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)cnn1-c1ccccc1F ZINC000153418957 1422525128 /nfs/dbraw/zinc/52/51/28/1422525128.db2.gz LEWRPJIGFVVCQN-UHFFFAOYSA-N 0 0 388.330 3.385 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000153421567 1422526239 /nfs/dbraw/zinc/52/62/39/1422526239.db2.gz WDFNPYOZBDUYFA-INIZCTEOSA-N 0 0 378.331 3.410 20 5 GGBDRN O=C(N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1[nH]ncc1[N+](=O)[O-] ZINC000153443560 1422539643 /nfs/dbraw/zinc/53/96/43/1422539643.db2.gz LSZIZVOSGVBMEE-GOSISDBHSA-N 0 0 378.388 3.162 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1[nH]ncc1[N+](=O)[O-] ZINC000153443455 1422539693 /nfs/dbraw/zinc/53/96/93/1422539693.db2.gz LSZIZVOSGVBMEE-SFHVURJKSA-N 0 0 378.388 3.162 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1[N+](=O)[O-] ZINC000153446291 1422541148 /nfs/dbraw/zinc/54/11/48/1422541148.db2.gz CTCZUURWKSCKRX-AWEZNQCLSA-N 0 0 386.427 3.435 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1 ZINC000153470082 1422555306 /nfs/dbraw/zinc/55/53/06/1422555306.db2.gz XTOGBCLHTFUYHU-AWEZNQCLSA-N 0 0 384.722 3.171 20 5 GGBDRN O=C(NCc1cccc(Cn2ccnc2)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153572894 1422626587 /nfs/dbraw/zinc/62/65/87/1422626587.db2.gz YEERJIXZABPBOD-UHFFFAOYSA-N 0 0 391.431 3.108 20 5 GGBDRN COC(=O)[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(F)c1 ZINC000153579194 1422629654 /nfs/dbraw/zinc/62/96/54/1422629654.db2.gz BOCXTLKMYCJPTF-KRWDZBQOSA-N 0 0 394.786 3.350 20 5 GGBDRN C[C@@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1ccc2ccccc2c1 ZINC000153590593 1422636090 /nfs/dbraw/zinc/63/60/90/1422636090.db2.gz RBUALOWFYVSVPT-GFCCVEGCSA-N 0 0 385.807 3.441 20 5 GGBDRN Cc1c(C)n(C[C@H]2CCCO2)c2ncnc(NC(=O)c3ccc([N+](=O)[O-])cc3)c12 ZINC000153595476 1422638068 /nfs/dbraw/zinc/63/80/68/1422638068.db2.gz UIIHZKAAFNOCHU-MRXNPFEDSA-N 0 0 395.419 3.388 20 5 GGBDRN Cc1c(C)n(C[C@@H]2CCCO2)c2ncnc(NC(=O)c3ccc([N+](=O)[O-])cc3)c12 ZINC000153595376 1422638613 /nfs/dbraw/zinc/63/86/13/1422638613.db2.gz UIIHZKAAFNOCHU-INIZCTEOSA-N 0 0 395.419 3.388 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])C2)nc1 ZINC000153601777 1422641643 /nfs/dbraw/zinc/64/16/43/1422641643.db2.gz HWBJDTWHURFPJT-GFCCVEGCSA-N 0 0 375.816 3.202 20 5 GGBDRN COc1ccc(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])cc1Cl ZINC000153607057 1422645424 /nfs/dbraw/zinc/64/54/24/1422645424.db2.gz YSPORDRWGFTNHB-UHFFFAOYSA-N 0 0 399.856 3.119 20 5 GGBDRN Cc1cc(NC(=O)NCc2cccc(CN3CCO[C@@H](C)C3)c2)ccc1[N+](=O)[O-] ZINC000153612822 1422647920 /nfs/dbraw/zinc/64/79/20/1422647920.db2.gz NBHSWDAMOYUJTH-INIZCTEOSA-N 0 0 398.463 3.446 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000153614245 1422649283 /nfs/dbraw/zinc/64/92/83/1422649283.db2.gz BJUJBOTVMBHXTL-LSDHHAIUSA-N 0 0 376.457 3.452 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000153614099 1422649394 /nfs/dbraw/zinc/64/93/94/1422649394.db2.gz BJUJBOTVMBHXTL-HUUCEWRRSA-N 0 0 376.457 3.452 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(c2ncccc2F)C1 ZINC000153623024 1422653819 /nfs/dbraw/zinc/65/38/19/1422653819.db2.gz KFASZPSJNFZYOV-QWHCGFSZSA-N 0 0 390.440 3.005 20 5 GGBDRN O=C(NC[C@@H]1CCCO1)c1cccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000153621860 1422654900 /nfs/dbraw/zinc/65/49/00/1422654900.db2.gz NXGJBYIKYQEMLM-HNNXBMFYSA-N 0 0 390.827 3.164 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(c2ncccc2F)C1 ZINC000153623243 1422656078 /nfs/dbraw/zinc/65/60/78/1422656078.db2.gz KFASZPSJNFZYOV-STQMWFEESA-N 0 0 390.440 3.005 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(c3ncnc4ccsc43)CC2)ccc1[N+](=O)[O-] ZINC000153625073 1422657383 /nfs/dbraw/zinc/65/73/83/1422657383.db2.gz XXFTZKXEFCLRKN-UHFFFAOYSA-N 0 0 398.448 3.262 20 5 GGBDRN CC(C)[C@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1ccc(F)cc1 ZINC000153627596 1422658137 /nfs/dbraw/zinc/65/81/37/1422658137.db2.gz ILYHHHOBQKJZGP-INIZCTEOSA-N 0 0 381.791 3.063 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000153634652 1422663391 /nfs/dbraw/zinc/66/33/91/1422663391.db2.gz KQHQMQBMUXUAFM-CQSZACIVSA-N 0 0 375.347 3.379 20 5 GGBDRN O=C(CCCc1ccccc1)N1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153656093 1422683658 /nfs/dbraw/zinc/68/36/58/1422683658.db2.gz DLJWAKZTAKICPN-UHFFFAOYSA-N 0 0 388.855 3.315 20 5 GGBDRN Cc1cccc([C@H](O)CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000153671572 1422696350 /nfs/dbraw/zinc/69/63/50/1422696350.db2.gz XATOQVVVCLKHQG-OAHLLOKOSA-N 0 0 379.210 3.129 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](c1nc(C2CC2)no1)C(C)C ZINC000179805497 1429578590 /nfs/dbraw/zinc/57/85/90/1429578590.db2.gz JRWMQANJCGFIHE-QGZVFWFLSA-N 0 0 387.440 3.479 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000153674669 1422697544 /nfs/dbraw/zinc/69/75/44/1422697544.db2.gz HWUPCFDOCGKKHT-JLZZUVOBSA-N 0 0 380.828 3.091 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)n2)cc1 ZINC000153679894 1422699171 /nfs/dbraw/zinc/69/91/71/1422699171.db2.gz YDWYYWHRPIHZDY-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN Cc1cc(NC(=O)NCCCC(=O)N2Cc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000153685616 1422701592 /nfs/dbraw/zinc/70/15/92/1422701592.db2.gz AKHKOPGEIHEVFU-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN Cc1cc(NC(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000153686405 1422701939 /nfs/dbraw/zinc/70/19/39/1422701939.db2.gz XQMRKGDHPUMHIZ-CQSZACIVSA-N 0 0 376.457 3.309 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1cc(Br)cn1C ZINC000153704440 1422712287 /nfs/dbraw/zinc/71/22/87/1422712287.db2.gz RCMDOSSWNHULSM-UHFFFAOYSA-N 0 0 395.257 3.034 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COC2CCOCC2)c(Cc2ccccc2)c1 ZINC000153707898 1422713352 /nfs/dbraw/zinc/71/33/52/1422713352.db2.gz SMSKBLJNLIQYHK-LJQANCHMSA-N 0 0 387.432 3.121 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000153716976 1422718207 /nfs/dbraw/zinc/71/82/07/1422718207.db2.gz UDCSXUHCOWNGRR-HUUCEWRRSA-N 0 0 376.457 3.452 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000153716776 1422718813 /nfs/dbraw/zinc/71/88/13/1422718813.db2.gz UDCSXUHCOWNGRR-LSDHHAIUSA-N 0 0 376.457 3.452 20 5 GGBDRN COc1cccc2c1CC[C@H]2NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153719322 1422719792 /nfs/dbraw/zinc/71/97/92/1422719792.db2.gz KLZNSYXNISNMLX-QGZVFWFLSA-N 0 0 378.388 3.206 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCS(=O)(=O)c2ccc(F)cc2)c2ncccc12 ZINC000153731466 1422727603 /nfs/dbraw/zinc/72/76/03/1422727603.db2.gz QEGCAMAEFKCXNV-UHFFFAOYSA-N 0 0 375.381 3.168 20 5 GGBDRN CC(C)=CCC[C@]1(C)NC(=O)N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1=O ZINC000153732840 1422728035 /nfs/dbraw/zinc/72/80/35/1422728035.db2.gz CMFPRKIWVVIPRS-IBGZPJMESA-N 0 0 399.407 3.202 20 5 GGBDRN O=C(Cc1ccc(F)c(F)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000153739430 1422731489 /nfs/dbraw/zinc/73/14/89/1422731489.db2.gz DPSLGEHGHDCVRC-UHFFFAOYSA-N 0 0 376.359 3.486 20 5 GGBDRN CCc1noc(CC)c1CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000153740812 1422732591 /nfs/dbraw/zinc/73/25/91/1422732591.db2.gz RFCABKYKQYWMRC-UHFFFAOYSA-N 0 0 387.436 3.320 20 5 GGBDRN Cc1cccc(C)c1OC[C@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccccc1 ZINC000153763875 1422742855 /nfs/dbraw/zinc/74/28/55/1422742855.db2.gz SRFCXSQMXNEPEL-INIZCTEOSA-N 0 0 380.404 3.485 20 5 GGBDRN CC(C)C(=O)Nc1ccc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000153768902 1422745290 /nfs/dbraw/zinc/74/52/90/1422745290.db2.gz VNDXBOLGGPVVKR-UHFFFAOYSA-N 0 0 396.447 3.457 20 5 GGBDRN Cc1cc(NC(=O)N2CCOC[C@@H]2C[C@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000153768641 1422745455 /nfs/dbraw/zinc/74/54/55/1422745455.db2.gz SZUQLBDKMWPTRL-HOCLYGCPSA-N 0 0 391.449 3.321 20 5 GGBDRN Cc1cc(NC(=O)N2CCOC[C@H]2C[C@@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000153768978 1422746798 /nfs/dbraw/zinc/74/67/98/1422746798.db2.gz SZUQLBDKMWPTRL-GDBMZVCRSA-N 0 0 391.449 3.321 20 5 GGBDRN CCOC(=O)C[C@@H](C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000153771501 1422748233 /nfs/dbraw/zinc/74/82/33/1422748233.db2.gz IJVSVIHJDKEOIL-SSDOTTSWSA-N 0 0 393.621 3.082 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(NCCS(=O)(=O)c3ccc(F)cc3)ccc2c1 ZINC000153779624 1422752932 /nfs/dbraw/zinc/75/29/32/1422752932.db2.gz XTNQYZPTSDLRQW-UHFFFAOYSA-N 0 0 375.381 3.168 20 5 GGBDRN Cc1cnc(CS(=O)(=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000179809868 1429583365 /nfs/dbraw/zinc/58/33/65/1429583365.db2.gz IQOUGZGLLIVECF-UHFFFAOYSA-N 0 0 379.419 3.130 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(I)c([N+](=O)[O-])c2)ccn1 ZINC000153794867 1422762653 /nfs/dbraw/zinc/76/26/53/1422762653.db2.gz UHPHFRPEMGLFJE-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN C[C@@H](O)C[C@@H](C)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000153803088 1422766454 /nfs/dbraw/zinc/76/64/54/1422766454.db2.gz VALUTWPEGWKOBB-KFWWJZLASA-N 0 0 386.452 3.300 20 5 GGBDRN C[C@H](O)C[C@H](C)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000153803216 1422766894 /nfs/dbraw/zinc/76/68/94/1422766894.db2.gz VALUTWPEGWKOBB-KKUMJFAQSA-N 0 0 386.452 3.300 20 5 GGBDRN Cc1cc(NC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000153808663 1422770392 /nfs/dbraw/zinc/77/03/92/1422770392.db2.gz HGENPXXWFBJRHM-MRXNPFEDSA-N 0 0 388.811 3.262 20 5 GGBDRN C[C@H]1CCC[C@@H](CC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)C1 ZINC000153813318 1422773117 /nfs/dbraw/zinc/77/31/17/1422773117.db2.gz MGVGLWWAQHSYHQ-UONOGXRCSA-N 0 0 379.482 3.157 20 5 GGBDRN C[C@@H]1CCC[C@@H](CC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)C1 ZINC000153813222 1422774254 /nfs/dbraw/zinc/77/42/54/1422774254.db2.gz MGVGLWWAQHSYHQ-ZIAGYGMSSA-N 0 0 379.482 3.157 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccco1)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153821660 1422780530 /nfs/dbraw/zinc/78/05/30/1422780530.db2.gz CCHBMEGAOAIJBP-YOEHRIQHSA-N 0 0 375.425 3.322 20 5 GGBDRN CC[NH+](CC)Cc1cccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000153826946 1422783115 /nfs/dbraw/zinc/78/31/15/1422783115.db2.gz RFDIBZNYSYADIU-UHFFFAOYSA-N 0 0 393.465 3.246 20 5 GGBDRN Cc1cc(NC(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000153827116 1422783309 /nfs/dbraw/zinc/78/33/09/1422783309.db2.gz DMZDLXVXULNIBX-PKOBYXMFSA-N 0 0 385.420 3.260 20 5 GGBDRN O=C(CNC(=O)c1ccc2c(c1)CCC2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000153853541 1422798394 /nfs/dbraw/zinc/79/83/94/1422798394.db2.gz BWGHMZYFXQYANA-UHFFFAOYSA-N 0 0 393.443 3.005 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)CCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000153852926 1422798986 /nfs/dbraw/zinc/79/89/86/1422798986.db2.gz DKDAEMNRXDQNLU-CYBMUJFWSA-N 0 0 396.403 3.463 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OC[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000153859963 1422800760 /nfs/dbraw/zinc/80/07/60/1422800760.db2.gz KVQUMAZLXJNUEM-ZDUSSCGKSA-N 0 0 387.310 3.441 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cc(C)ccc2-n2cc(C)cn2)cc([N+](=O)[O-])c1 ZINC000153865715 1422801443 /nfs/dbraw/zinc/80/14/43/1422801443.db2.gz NQKOOPKCMLXTCB-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN COc1ccc([C@H](CO)N(C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000153878887 1422804234 /nfs/dbraw/zinc/80/42/34/1422804234.db2.gz PDFJGTUBBIWMAS-IBGZPJMESA-N 0 0 383.404 3.424 20 5 GGBDRN COc1ccc(C(=O)OCCNc2ccc(C(F)(F)F)cn2)cc1[N+](=O)[O-] ZINC000153902181 1422808131 /nfs/dbraw/zinc/80/81/31/1422808131.db2.gz ALGOQDGEHZUXAX-UHFFFAOYSA-N 0 0 385.298 3.286 20 5 GGBDRN COc1ccc(CN(CCO)Cc2ccc(Cl)c([N+](=O)[O-])c2)c(OC)c1 ZINC000153906371 1422808288 /nfs/dbraw/zinc/80/82/88/1422808288.db2.gz JSCBWECLILGDSK-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@@H](O)COc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000153908806 1422809003 /nfs/dbraw/zinc/80/90/03/1422809003.db2.gz UPQOVRCEALAPEQ-MRXNPFEDSA-N 0 0 377.368 3.074 20 5 GGBDRN O=C(NC[C@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000153910174 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ZINC000155431650 1423361298 /nfs/dbraw/zinc/36/12/98/1423361298.db2.gz QKEGCHCKVWXSJS-UHFFFAOYSA-N 0 0 377.466 3.477 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1 ZINC000155451014 1423370122 /nfs/dbraw/zinc/37/01/22/1423370122.db2.gz OTYCVJBVAATXDH-UHFFFAOYSA-N 0 0 394.313 3.025 20 5 GGBDRN CC(C)(C(N)=O)c1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000155466554 1423375875 /nfs/dbraw/zinc/37/58/75/1423375875.db2.gz SONDOQLTYINBMO-UHFFFAOYSA-N 0 0 382.420 3.184 20 5 GGBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OC[C@H](O)COC1CCOCC1 ZINC000155470470 1423377624 /nfs/dbraw/zinc/37/76/24/1423377624.db2.gz JTTVYQXAWCSQBO-GOSISDBHSA-N 0 0 387.432 3.121 20 5 GGBDRN O=C(NC[C@H]1CCCC[C@@H]1O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000155478953 1423381520 /nfs/dbraw/zinc/38/15/20/1423381520.db2.gz WFJNMUABRCZPQX-XLIONFOSSA-N 0 0 383.448 3.488 20 5 GGBDRN Cc1c(C(=O)NCC2([C@@H](O)c3ccccc3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000155492471 1423385459 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OAEYERAEQFQYLB-MRXNPFEDSA-N 0 0 384.436 3.067 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000155531655 1423402776 /nfs/dbraw/zinc/40/27/76/1423402776.db2.gz FROXANGPUYCMDE-UHFFFAOYSA-N 0 0 380.759 3.237 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@H](O)COCc2ccc(Cl)cc2)c1 ZINC000155533386 1423403593 /nfs/dbraw/zinc/40/35/93/1423403593.db2.gz VCHJWIQGKAMFMP-MRXNPFEDSA-N 0 0 380.828 3.271 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@H](O)CO[C@H]2CCCc3ccccc32)c1 ZINC000155534278 1423404627 /nfs/dbraw/zinc/40/46/27/1423404627.db2.gz SMJOZKZJIPDSFY-XLIONFOSSA-N 0 0 386.448 3.495 20 5 GGBDRN O=[N+]([O-])c1ccn(CCN[C@@H](c2ccccc2OC(F)F)C(F)(F)F)n1 ZINC000179915892 1429639153 /nfs/dbraw/zinc/63/91/53/1429639153.db2.gz RDBYCEBJSHLAHE-LBPRGKRZSA-N 0 0 380.273 3.286 20 5 GGBDRN O=[N+]([O-])c1ccn(CCN[C@H](c2ccccc2OC(F)F)C(F)(F)F)n1 ZINC000179915906 1429639162 /nfs/dbraw/zinc/63/91/62/1429639162.db2.gz RDBYCEBJSHLAHE-GFCCVEGCSA-N 0 0 380.273 3.286 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 ZINC000155541969 1423409625 /nfs/dbraw/zinc/40/96/25/1423409625.db2.gz WPDVJLQURJHONS-YJBOKZPZSA-N 0 0 390.823 3.213 20 5 GGBDRN CN(CC(=O)NCCc1csc(C(C)(C)C)n1)c1ccccc1[N+](=O)[O-] ZINC000155564097 1423420705 /nfs/dbraw/zinc/42/07/05/1423420705.db2.gz WBEVNJMIONNHMT-UHFFFAOYSA-N 0 0 376.482 3.144 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cc1OC ZINC000155570557 1423424215 /nfs/dbraw/zinc/42/42/15/1423424215.db2.gz OGWCXVJHVUNRMJ-ZDUSSCGKSA-N 0 0 387.436 3.111 20 5 GGBDRN C[C@H]1CN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@@H](c2ccsc2)O1 ZINC000155575553 1423426308 /nfs/dbraw/zinc/42/63/08/1423426308.db2.gz DMCBTORWLYTVOV-GUYCJALGSA-N 0 0 375.450 3.081 20 5 GGBDRN COc1cc(C(=O)NCc2ccccc2-n2nc(C)cc2C)ccc1[N+](=O)[O-] ZINC000155589246 1423433675 /nfs/dbraw/zinc/43/36/75/1423433675.db2.gz IAGVHDMLBKBBBI-UHFFFAOYSA-N 0 0 380.404 3.336 20 5 GGBDRN CC(C)CC[C@H]1CCCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000155590906 1423434799 /nfs/dbraw/zinc/43/47/99/1423434799.db2.gz YXAZBCLEBKQWOH-CQSZACIVSA-N 0 0 379.482 3.213 20 5 GGBDRN CC(C)CC[C@H]1CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000155608721 1423443412 /nfs/dbraw/zinc/44/34/12/1423443412.db2.gz QZTAFMZNTRVKSW-CYBMUJFWSA-N 0 0 381.860 3.405 20 5 GGBDRN COc1ccc(CN(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000155627604 1423454756 /nfs/dbraw/zinc/45/47/56/1423454756.db2.gz MTPCZGWHNVPQSQ-HNNXBMFYSA-N 0 0 396.852 3.217 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@H](C)c1ccc(Br)cc1 ZINC000155635614 1423460670 /nfs/dbraw/zinc/46/06/70/1423460670.db2.gz PSTZNYHBOIBABN-SNVBAGLBSA-N 0 0 382.214 3.209 20 5 GGBDRN C[C@H](O)C[C@@H]1CCCN1C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000155636533 1423460794 /nfs/dbraw/zinc/46/07/94/1423460794.db2.gz OZVOWEQHUZZKKV-RDJZCZTQSA-N 0 0 375.469 3.207 20 5 GGBDRN C[C@@H](O)C[C@@H]1CCCN1C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000155636325 1423460984 /nfs/dbraw/zinc/46/09/84/1423460984.db2.gz OZVOWEQHUZZKKV-WBVHZDCISA-N 0 0 375.469 3.207 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCC[C@H]1[C@@H]1CCCCC1=O ZINC000155643474 1423465166 /nfs/dbraw/zinc/46/51/66/1423465166.db2.gz ZAWHJZMGYJQKAM-ROUUACIJSA-N 0 0 382.420 3.144 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCC[C@H]1[C@H]1CCCCC1=O ZINC000155643709 1423465332 /nfs/dbraw/zinc/46/53/32/1423465332.db2.gz ZAWHJZMGYJQKAM-MSOLQXFVSA-N 0 0 382.420 3.144 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC(n2ccnn2)CC1 ZINC000155648380 1423467523 /nfs/dbraw/zinc/46/75/23/1423467523.db2.gz LLBFZQLLQUNMIT-UHFFFAOYSA-N 0 0 393.403 3.456 20 5 GGBDRN C[C@@H](O)C[C@@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000155665643 1423475851 /nfs/dbraw/zinc/47/58/51/1423475851.db2.gz YZXIWCGGFXEHFA-QAPCUYQASA-N 0 0 383.448 3.217 20 5 GGBDRN Cc1c(C(=O)N(C)[C@H](C)c2cccc(O)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000155671208 1423479187 /nfs/dbraw/zinc/47/91/87/1423479187.db2.gz XAOSFXFNLBMENL-GFCCVEGCSA-N 0 0 381.392 3.023 20 5 GGBDRN CC(C)Cc1nnc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000155692815 1423489173 /nfs/dbraw/zinc/48/91/73/1423489173.db2.gz HXYMUWYTULRJFK-UHFFFAOYSA-N 0 0 389.481 3.248 20 5 GGBDRN CN(C(=O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000155694530 1423490307 /nfs/dbraw/zinc/49/03/07/1423490307.db2.gz BPEFJBFUPHSREB-UHFFFAOYSA-N 0 0 384.392 3.130 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000155696490 1423491540 /nfs/dbraw/zinc/49/15/40/1423491540.db2.gz LMSYPQZJGYMAII-UHFFFAOYSA-N 0 0 382.420 3.156 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000155696602 1423491689 /nfs/dbraw/zinc/49/16/89/1423491689.db2.gz QNPXYDSIPLRXKC-UHFFFAOYSA-N 0 0 384.392 3.415 20 5 GGBDRN CC(C)(C)C(=O)Cn1cc(C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)nn1 ZINC000155697280 1423491711 /nfs/dbraw/zinc/49/17/11/1423491711.db2.gz ZBNBNMGQTAFXSE-UHFFFAOYSA-N 0 0 399.451 3.391 20 5 GGBDRN Cn1cc(OC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)cn1 ZINC000179929457 1429646981 /nfs/dbraw/zinc/64/69/81/1429646981.db2.gz XFLDOBWMUXEKPW-UHFFFAOYSA-N 0 0 382.163 3.040 20 5 GGBDRN CC(C)c1nnc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000155709257 1423499229 /nfs/dbraw/zinc/49/92/29/1423499229.db2.gz VFPBEWNJTYUIPY-UHFFFAOYSA-N 0 0 375.454 3.173 20 5 GGBDRN COCCn1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)n1 ZINC000155711457 1423500333 /nfs/dbraw/zinc/50/03/33/1423500333.db2.gz NMBYRADJWWUKAT-UHFFFAOYSA-N 0 0 378.454 3.438 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-])c1ccccn1 ZINC000155713297 1423501142 /nfs/dbraw/zinc/50/11/42/1423501142.db2.gz WHOVULHUDBFEPP-KKVAFCGZSA-N 0 0 398.463 3.444 20 5 GGBDRN Cc1cccc(C(=O)N[C@@H](C)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000155713628 1423501418 /nfs/dbraw/zinc/50/14/18/1423501418.db2.gz URSWLGAAENTDNZ-INIZCTEOSA-N 0 0 383.448 3.161 20 5 GGBDRN CC(C)(C)c1nnc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000155716060 1423502310 /nfs/dbraw/zinc/50/23/10/1423502310.db2.gz YXULMLRSIAJJOL-UHFFFAOYSA-N 0 0 389.481 3.347 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](C)c1cc(F)ccc1OC ZINC000179931691 1429648010 /nfs/dbraw/zinc/64/80/10/1429648010.db2.gz NPZDVOQTTOUPAH-NSHDSACASA-N 0 0 377.372 3.040 20 5 GGBDRN CC1CCN(c2cccc(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)c2)CC1 ZINC000155732637 1423509090 /nfs/dbraw/zinc/50/90/90/1423509090.db2.gz NVZDDVBVHOFLFN-UHFFFAOYSA-N 0 0 396.447 3.200 20 5 GGBDRN Cc1ccc2[nH]c([C@H]3CCCN(C(=O)C(C)(C)n4cc([N+](=O)[O-])cn4)C3)nc2c1 ZINC000155748959 1423516207 /nfs/dbraw/zinc/51/62/07/1423516207.db2.gz ILINWAOPOVRMGV-AWEZNQCLSA-N 0 0 396.451 3.117 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](c2ccsc2)O1 ZINC000155764279 1423523856 /nfs/dbraw/zinc/52/38/56/1423523856.db2.gz YUYFVILDXGMGQD-SCLBCKFNSA-N 0 0 398.444 3.444 20 5 GGBDRN O=C(NCc1cccc2c1OCCCO2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000155767541 1423525462 /nfs/dbraw/zinc/52/54/62/1423525462.db2.gz VLQKQCLNZHNVPP-UHFFFAOYSA-N 0 0 383.404 3.260 20 5 GGBDRN CC(C)c1ccc(N(C)C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000155769285 1423526944 /nfs/dbraw/zinc/52/69/44/1423526944.db2.gz YLPAXXRXOCSSAQ-UHFFFAOYSA-N 0 0 376.434 3.398 20 5 GGBDRN CC(=O)c1c(F)cc(F)cc1OCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000155787422 1423534424 /nfs/dbraw/zinc/53/44/24/1423534424.db2.gz HGAKYRMEDVUMMU-UHFFFAOYSA-N 0 0 392.314 3.453 20 5 GGBDRN CS(=O)(=O)CCc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000155826905 1423550244 /nfs/dbraw/zinc/55/02/44/1423550244.db2.gz UIDDLGMJEIHVTK-UHFFFAOYSA-N 0 0 382.825 3.088 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@H]2CCCOCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000179939520 1429652727 /nfs/dbraw/zinc/65/27/27/1429652727.db2.gz CQVVRMIEIPSBOY-ZBFHGGJFSA-N 0 0 384.436 3.462 20 5 GGBDRN COCCOc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1Cl ZINC000155848290 1423559889 /nfs/dbraw/zinc/55/98/89/1423559889.db2.gz PXZITHRXDLGRPM-UHFFFAOYSA-N 0 0 383.763 3.247 20 5 GGBDRN COCCCOc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)c1 ZINC000155850525 1423560545 /nfs/dbraw/zinc/56/05/45/1423560545.db2.gz FOMRINWHDYWOAL-UHFFFAOYSA-N 0 0 387.436 3.006 20 5 GGBDRN CC(C)COc1ccccc1CNC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000155848845 1423560683 /nfs/dbraw/zinc/56/06/83/1423560683.db2.gz KSYXGSMEHWYYFM-OAHLLOKOSA-N 0 0 399.447 3.064 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000179941022 1429653160 /nfs/dbraw/zinc/65/31/60/1429653160.db2.gz UGPBJPYKVISQDW-NVXWUHKLSA-N 0 0 385.464 3.136 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)C(=O)NCC2CCCC2)c1 ZINC000155874812 1423571827 /nfs/dbraw/zinc/57/18/27/1423571827.db2.gz KDBNCLGXVNJHDG-UHFFFAOYSA-N 0 0 379.482 3.132 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2cccc(F)c2F)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000155882908 1423576341 /nfs/dbraw/zinc/57/63/41/1423576341.db2.gz SQELUEBYNOWBIN-JTQLQIEISA-N 0 0 387.346 3.253 20 5 GGBDRN O=C(Nc1cccc(-n2ccnn2)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000155887751 1423579001 /nfs/dbraw/zinc/57/90/01/1423579001.db2.gz ZUGSSMTXZFSWSS-UHFFFAOYSA-N 0 0 378.392 3.028 20 5 GGBDRN Cc1cc(C(=O)N[C@H](C)C(=O)Nc2cccc(N3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000155900975 1423585447 /nfs/dbraw/zinc/58/54/47/1423585447.db2.gz GCNGBSVZPKLPRD-OAHLLOKOSA-N 0 0 396.447 3.260 20 5 GGBDRN C[C@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@H](c2ccsc2)O1 ZINC000155927919 1423598073 /nfs/dbraw/zinc/59/80/73/1423598073.db2.gz CAOOYKKPMJBOTJ-SCLBCKFNSA-N 0 0 398.444 3.444 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(OC(=O)c3c([N+](=O)[O-])cnn3C)cc2)cc1 ZINC000155939994 1423603099 /nfs/dbraw/zinc/60/30/99/1423603099.db2.gz KXVPPVTVAUMJFN-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN Cc1ccc(NC(=O)Nc2ccc(CCS(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000155959058 1423610204 /nfs/dbraw/zinc/61/02/04/1423610204.db2.gz ZAVQARKKFBFDOV-UHFFFAOYSA-N 0 0 377.422 3.134 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000155971756 1423615181 /nfs/dbraw/zinc/61/51/81/1423615181.db2.gz XFUULRKAFPOMGV-HNNXBMFYSA-N 0 0 397.746 3.067 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(Cl)cc1OC(F)F ZINC000155977183 1423617575 /nfs/dbraw/zinc/61/75/75/1423617575.db2.gz RXQZFVNKCNGXHP-UHFFFAOYSA-N 0 0 399.737 3.218 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN(Cc3ccccc3)[C@H](CO)C3CC3)o2)cc1 ZINC000156006038 1423631004 /nfs/dbraw/zinc/63/10/04/1423631004.db2.gz KSKTVPLBVPMISJ-LJQANCHMSA-N 0 0 394.431 3.418 20 5 GGBDRN Cc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2N)c(OCC(F)(F)F)c1 ZINC000156014372 1423634574 /nfs/dbraw/zinc/63/45/74/1423634574.db2.gz DODIUPUCPUNJQH-UHFFFAOYSA-N 0 0 383.326 3.357 20 5 GGBDRN NC(=O)COc1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000156017489 1423635272 /nfs/dbraw/zinc/63/52/72/1423635272.db2.gz ABYYWGDMLCYQMO-UHFFFAOYSA-N 0 0 384.417 3.195 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1OCC1CC1 ZINC000156054949 1423653259 /nfs/dbraw/zinc/65/32/59/1423653259.db2.gz MUMYLSMFAKOSNG-ZDUSSCGKSA-N 0 0 383.404 3.141 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000156056342 1423654149 /nfs/dbraw/zinc/65/41/49/1423654149.db2.gz CJTLQTGIZJQZAY-LBPRGKRZSA-N 0 0 381.404 3.111 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000179951637 1429660042 /nfs/dbraw/zinc/66/00/42/1429660042.db2.gz SKKXWXZQMTXYQK-SFHVURJKSA-N 0 0 385.420 3.408 20 5 GGBDRN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000156059067 1423655282 /nfs/dbraw/zinc/65/52/82/1423655282.db2.gz RKGWAQDAGFFBHB-FZKQIMNGSA-N 0 0 380.404 3.369 20 5 GGBDRN Cc1c(CC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cccc1[N+](=O)[O-] ZINC000156063875 1423657515 /nfs/dbraw/zinc/65/75/15/1423657515.db2.gz SMAJUYGWTKEBBG-UHFFFAOYSA-N 0 0 381.348 3.178 20 5 GGBDRN COc1cc(NCCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc(OC)c1 ZINC000156069111 1423659256 /nfs/dbraw/zinc/65/92/56/1423659256.db2.gz HDBORFLWTSFDNM-UHFFFAOYSA-N 0 0 379.800 3.107 20 5 GGBDRN 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1423702001 /nfs/dbraw/zinc/70/20/01/1423702001.db2.gz PRDJEDHBOJUUOK-UHFFFAOYSA-N 0 0 379.800 3.107 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@@H]3CCCOCC3)cc2[N+](=O)[O-])C1 ZINC000179959830 1429663933 /nfs/dbraw/zinc/66/39/33/1429663933.db2.gz YYJXEMUACVSPFG-BFYDXBDKSA-N 0 0 375.469 3.376 20 5 GGBDRN CN(C)c1nc2sc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)cc2s1 ZINC000179962362 1429664423 /nfs/dbraw/zinc/66/44/23/1429664423.db2.gz SNWIQXPHQUOHMH-UHFFFAOYSA-N 0 0 388.434 3.461 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2c(C)cc(N(C)C)cc2C)cc1[N+](=O)[O-] ZINC000156194111 1423718125 /nfs/dbraw/zinc/71/81/25/1423718125.db2.gz NARJNBBFCOOPEV-UHFFFAOYSA-N 0 0 379.438 3.087 20 5 GGBDRN COCCn1cc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c2ccccc21 ZINC000179966371 1429665818 /nfs/dbraw/zinc/66/58/18/1429665818.db2.gz GKYXXRRUDPRKSD-UHFFFAOYSA-N 0 0 379.376 3.325 20 5 GGBDRN Cc1ccc(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)c(OCC(F)(F)F)c1 ZINC000156244914 1423740209 /nfs/dbraw/zinc/74/02/09/1423740209.db2.gz 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GGBDRN C[C@@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@@H](c2ccsc2)O1 ZINC000156326830 1423781590 /nfs/dbraw/zinc/78/15/90/1423781590.db2.gz YAELOTUHKHUISU-DYVFJYSZSA-N 0 0 376.434 3.414 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)cc21 ZINC000156335520 1423786171 /nfs/dbraw/zinc/78/61/71/1423786171.db2.gz ZOIDBXKUCRIYAD-UHFFFAOYSA-N 0 0 386.383 3.007 20 5 GGBDRN COc1ccc(N(Cc2ccco2)C(=O)CCn2cc([N+](=O)[O-])cn2)cc1F ZINC000156360860 1423797412 /nfs/dbraw/zinc/79/74/12/1423797412.db2.gz OWDLWGKGOFGIHC-UHFFFAOYSA-N 0 0 388.355 3.156 20 5 GGBDRN O=C(O[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000156362588 1423798420 /nfs/dbraw/zinc/79/84/20/1423798420.db2.gz VENNHCRMSQMQQZ-DOPJRALCSA-N 0 0 383.404 3.285 20 5 GGBDRN COc1ccc(N(Cc2ccco2)C(=O)Cn2cc([N+](=O)[O-])nc2C)cc1F ZINC000156364892 1423799631 /nfs/dbraw/zinc/79/96/31/1423799631.db2.gz NEWWINNCYRIFQF-UHFFFAOYSA-N 0 0 388.355 3.074 20 5 GGBDRN COc1cc(NCCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc(OC)c1 ZINC000156373362 1423801045 /nfs/dbraw/zinc/80/10/45/1423801045.db2.gz PDWGDDLFDHFFFR-UHFFFAOYSA-N 0 0 393.827 3.036 20 5 GGBDRN COc1ccccc1C(C)(C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000156383066 1423802649 /nfs/dbraw/zinc/80/26/49/1423802649.db2.gz SFQWGQXEMBZLFQ-UHFFFAOYSA-N 0 0 380.404 3.454 20 5 GGBDRN COCCOc1cccc(CC(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)c1 ZINC000156391912 1423804404 /nfs/dbraw/zinc/80/44/04/1423804404.db2.gz KVGUZXXHYUHILD-UHFFFAOYSA-N 0 0 396.403 3.191 20 5 GGBDRN COc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1OC(F)F ZINC000156396596 1423804867 /nfs/dbraw/zinc/80/48/67/1423804867.db2.gz PCTQTJKEXOXGJD-UHFFFAOYSA-N 0 0 384.310 3.316 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCN(c2cccs2)CC1 ZINC000156396282 1423805039 /nfs/dbraw/zinc/80/50/39/1423805039.db2.gz OKSRZUQMDJLPSP-UHFFFAOYSA-N 0 0 386.477 3.219 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@H]1CCCOc2c(F)cccc21 ZINC000179982066 1429673691 /nfs/dbraw/zinc/67/36/91/1429673691.db2.gz 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CC[C@H](c1ccncc1)N(CC)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000157049828 1423910688 /nfs/dbraw/zinc/91/06/88/1423910688.db2.gz PEHSHCBRJZIFEY-QGZVFWFLSA-N 0 0 391.449 3.007 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000157049673 1423911266 /nfs/dbraw/zinc/91/12/66/1423911266.db2.gz PEHSHCBRJZIFEY-KRWDZBQOSA-N 0 0 391.449 3.007 20 5 GGBDRN O=C(Nc1ccn(-c2ncccc2C(F)(F)F)n1)c1ccccc1[N+](=O)[O-] ZINC000157060954 1423914528 /nfs/dbraw/zinc/91/45/28/1423914528.db2.gz SISDXRJWJKOQKJ-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCCc3c2cnn3C)cc1SC ZINC000157065814 1423916190 /nfs/dbraw/zinc/91/61/90/1423916190.db2.gz RJQSBJSNUMYGTG-ZDUSSCGKSA-N 0 0 390.465 3.208 20 5 GGBDRN CCN(CC)C(=O)[C@@H](C)Sc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000157083014 1423920941 /nfs/dbraw/zinc/92/09/41/1423920941.db2.gz CHHIVINXEFUEAR-GFCCVEGCSA-N 0 0 377.470 3.222 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c(C)c1 ZINC000157105140 1423926562 /nfs/dbraw/zinc/92/65/62/1423926562.db2.gz KTYSGVUYBRVHDZ-UHFFFAOYSA-N 0 0 379.319 3.390 20 5 GGBDRN Cn1cc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cn1 ZINC000157105026 1423926665 /nfs/dbraw/zinc/92/66/65/1423926665.db2.gz JHHYDRITAFTQIN-SFHVURJKSA-N 0 0 399.838 3.451 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000157136675 1423934384 /nfs/dbraw/zinc/93/43/84/1423934384.db2.gz GHUSMRKJMZLNSO-AWEZNQCLSA-N 0 0 383.832 3.281 20 5 GGBDRN CCn1c(SCC(=O)N[C@@H](C)C(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157145203 1423936409 /nfs/dbraw/zinc/93/64/09/1423936409.db2.gz BFGJTCNMNJDHQQ-LBPRGKRZSA-N 0 0 377.470 3.126 20 5 GGBDRN O=C(Nc1ccn(-c2ncccc2C(F)(F)F)n1)c1ccc([N+](=O)[O-])cc1 ZINC000157147971 1423937077 /nfs/dbraw/zinc/93/70/77/1423937077.db2.gz BWAPVVUBHLDQOV-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000157161065 1423941340 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1424123900 /nfs/dbraw/zinc/12/39/00/1424123900.db2.gz SVHMBSJQQIUSAI-UHFFFAOYSA-N 0 0 395.438 3.457 20 5 GGBDRN COc1cccc(COCCNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)c1 ZINC000157938070 1424124615 /nfs/dbraw/zinc/12/46/15/1424124615.db2.gz FDGXRQMENHDDLE-UHFFFAOYSA-N 0 0 399.447 3.468 20 5 GGBDRN CC[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000157942661 1424125455 /nfs/dbraw/zinc/12/54/55/1424125455.db2.gz ZLUUMXWRRPNLHN-MNOVXSKESA-N 0 0 385.367 3.220 20 5 GGBDRN CC[C@H]1CCC[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000157942813 1424125482 /nfs/dbraw/zinc/12/54/82/1424125482.db2.gz ZLUUMXWRRPNLHN-QWRGUYRKSA-N 0 0 385.367 3.220 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000157957648 1424128544 /nfs/dbraw/zinc/12/85/44/1424128544.db2.gz IATJXCOSPWWUFY-GFCCVEGCSA-N 0 0 396.852 3.231 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccccc1 ZINC000158013808 1424140019 /nfs/dbraw/zinc/14/00/19/1424140019.db2.gz 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CCOc1ccc(NC(=O)CN2CC[C@@H](c3ccccc3OC)C2)c([N+](=O)[O-])c1 ZINC000158124732 1424172910 /nfs/dbraw/zinc/17/29/10/1424172910.db2.gz HLIVZRWFBUEFKL-OAHLLOKOSA-N 0 0 399.447 3.430 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CC[C@H](c3ccccc3OC)C2)c([N+](=O)[O-])c1 ZINC000158124571 1424173177 /nfs/dbraw/zinc/17/31/77/1424173177.db2.gz HLIVZRWFBUEFKL-HNNXBMFYSA-N 0 0 399.447 3.430 20 5 GGBDRN O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000180029746 1429703566 /nfs/dbraw/zinc/70/35/66/1429703566.db2.gz SINGNHKCTVTPFJ-AWEZNQCLSA-N 0 0 387.823 3.027 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000158154657 1424180824 /nfs/dbraw/zinc/18/08/24/1424180824.db2.gz SUKZXKBDVCJBNO-SKDRFNHKSA-N 0 0 390.870 3.100 20 5 GGBDRN COc1ccc(N(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C(C)C)cc1F ZINC000158154970 1424180927 /nfs/dbraw/zinc/18/09/27/1424180927.db2.gz KHNXVTGXDGNJLJ-UHFFFAOYSA-N 0 0 399.382 3.378 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@H](Nc2ccccc2)C1 ZINC000158157279 1424181578 /nfs/dbraw/zinc/18/15/78/1424181578.db2.gz WTHMZLSIRNLWCR-INIZCTEOSA-N 0 0 375.450 3.168 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCC2(CCC2)C1 ZINC000158179559 1424187568 /nfs/dbraw/zinc/18/75/68/1424187568.db2.gz AGRHAYGZFLQOPJ-MRXNPFEDSA-N 0 0 393.871 3.405 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCC2(CCC2)C1 ZINC000158179426 1424187775 /nfs/dbraw/zinc/18/77/75/1424187775.db2.gz AGRHAYGZFLQOPJ-INIZCTEOSA-N 0 0 393.871 3.405 20 5 GGBDRN O=C(Nc1ccccc1Cn1cncn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000158186346 1424189094 /nfs/dbraw/zinc/18/90/94/1424189094.db2.gz XIUQQBUBIGLBLM-UHFFFAOYSA-N 0 0 392.419 3.431 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000158190821 1424191069 /nfs/dbraw/zinc/19/10/69/1424191069.db2.gz FIGOUFPURZKYDU-CABZTGNLSA-N 0 0 390.870 3.100 20 5 GGBDRN CN(C(=O)COc1cccc(NC(=O)c2ccco2)c1)c1cccc([N+](=O)[O-])c1 ZINC000158201591 1424193379 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C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000159323928 1424484991 /nfs/dbraw/zinc/48/49/91/1424484991.db2.gz ZPRIMIRJQKCWFX-SECBINFHSA-N 0 0 388.273 3.219 20 5 GGBDRN O=C(Nc1cnn(C[C@@H]2CCCO2)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000159325620 1424485977 /nfs/dbraw/zinc/48/59/77/1424485977.db2.gz SKZPJADQUFOYCX-KRWDZBQOSA-N 0 0 385.424 3.167 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCSc1nnc(Nc2ccccc2F)s1 ZINC000159367104 1424497170 /nfs/dbraw/zinc/49/71/70/1424497170.db2.gz FEJFITIWNOCMGL-UHFFFAOYSA-N 0 0 393.425 3.283 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1C[C@@H]1CCOC1 ZINC000159413147 1424500612 /nfs/dbraw/zinc/50/06/12/1424500612.db2.gz GFPRTSJNDLOZSL-INIZCTEOSA-N 0 0 387.440 3.270 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1CCC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1 ZINC000159450659 1424503582 /nfs/dbraw/zinc/50/35/82/1424503582.db2.gz UMCUYCVGQDQSDZ-OAHLLOKOSA-N 0 0 375.469 3.417 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000159476138 1424505209 /nfs/dbraw/zinc/50/52/09/1424505209.db2.gz KHFOKPMXMRNABA-UHFFFAOYSA-N 0 0 394.727 3.337 20 5 GGBDRN O=C(NCc1ccnc(OC2CCC2)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000159474728 1424505639 /nfs/dbraw/zinc/50/56/39/1424505639.db2.gz BGEFSGIPNZDWFT-UHFFFAOYSA-N 0 0 378.388 3.399 20 5 GGBDRN Cn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccccn1 ZINC000159501765 1424508472 /nfs/dbraw/zinc/50/84/72/1424508472.db2.gz IXUVLWXZFFZTGX-UHFFFAOYSA-N 0 0 395.404 3.128 20 5 GGBDRN C[C@]1(c2ccco2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1=O ZINC000159506156 1424508762 /nfs/dbraw/zinc/50/87/62/1424508762.db2.gz SUMJUQLSKRVEQW-OAHLLOKOSA-N 0 0 383.282 3.174 20 5 GGBDRN C[C@@]1(c2ccco2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1=O ZINC000159506027 1424509354 /nfs/dbraw/zinc/50/93/54/1424509354.db2.gz SUMJUQLSKRVEQW-HNNXBMFYSA-N 0 0 383.282 3.174 20 5 GGBDRN 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/nfs/dbraw/zinc/51/75/26/1424517526.db2.gz NSYWISVJMUITGS-OAQYLSRUSA-N 0 0 381.432 3.016 20 5 GGBDRN C[C@@H](CO)CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000159614323 1424518655 /nfs/dbraw/zinc/51/86/55/1424518655.db2.gz FDYOBPOSQWDOBE-GFCCVEGCSA-N 0 0 377.828 3.219 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)CSc1ccc([N+](=O)[O-])cn1 ZINC000159642502 1424520273 /nfs/dbraw/zinc/52/02/73/1424520273.db2.gz NBUMYNKHWIDVOW-UHFFFAOYSA-N 0 0 383.376 3.342 20 5 GGBDRN CN1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2ccc(F)cc21 ZINC000159652783 1424521304 /nfs/dbraw/zinc/52/13/04/1424521304.db2.gz KCNWXEMIMKTXHG-UHFFFAOYSA-N 0 0 381.367 3.016 20 5 GGBDRN O=C(Nc1cccn(CC(F)(F)F)c1=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000159662921 1424522236 /nfs/dbraw/zinc/52/22/36/1424522236.db2.gz WERXTJFYHMXHLR-UHFFFAOYSA-N 0 0 396.325 3.145 20 5 GGBDRN Cn1cc(C(=O)NCCc2cc3ccccc3[nH]2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000159663009 1424522258 /nfs/dbraw/zinc/52/22/58/1424522258.db2.gz FKYFATIZSBZWBP-UHFFFAOYSA-N 0 0 389.415 3.449 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000159697563 1424524790 /nfs/dbraw/zinc/52/47/90/1424524790.db2.gz PWYIFAITCVOBHP-FQEVSTJZSA-N 0 0 383.404 3.309 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cn1)NCCc1ccc(OC(F)F)cc1 ZINC000159706217 1424525658 /nfs/dbraw/zinc/52/56/58/1424525658.db2.gz JIUOUYGKTBSLOE-UHFFFAOYSA-N 0 0 383.376 3.042 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc(F)cc2)c(Br)c1 ZINC000159703991 1424525860 /nfs/dbraw/zinc/52/58/60/1424525860.db2.gz VQJIFSFRYPMLRS-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc(Cl)nc2)c(Br)c1 ZINC000159705306 1424525937 /nfs/dbraw/zinc/52/59/37/1424525937.db2.gz DGUYFGWTYIHKFG-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1cc(Cl)c2c(c1)OCCO2 ZINC000159700111 1424525993 /nfs/dbraw/zinc/52/59/93/1424525993.db2.gz WTHOZZLVIWOCQB-UHFFFAOYSA-N 0 0 391.811 3.061 20 5 GGBDRN Cc1cccc2c(CCNS(=O)(=O)CCc3ccc([N+](=O)[O-])cc3)c[nH]c21 ZINC000180091284 1429732967 /nfs/dbraw/zinc/73/29/67/1429732967.db2.gz PMKRHAMCMYLFHT-UHFFFAOYSA-N 0 0 387.461 3.089 20 5 GGBDRN CCCOc1cccc(CCNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000159736009 1424529146 /nfs/dbraw/zinc/52/91/46/1424529146.db2.gz FANXVRFARNOHKA-UHFFFAOYSA-N 0 0 395.415 3.198 20 5 GGBDRN COc1cccc(-c2nc(C)c(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)[nH]2)c1 ZINC000159756128 1424532659 /nfs/dbraw/zinc/53/26/59/1424532659.db2.gz TWLIBKYJEIRHRK-UHFFFAOYSA-N 0 0 395.419 3.144 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159784769 1424534984 /nfs/dbraw/zinc/53/49/84/1424534984.db2.gz KMEWFOJODRMVNO-NVXWUHKLSA-N 0 0 390.461 3.349 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3ccc([N+](=O)[O-])c(Cl)c3)CC2)n1 ZINC000159780457 1424535689 /nfs/dbraw/zinc/53/56/89/1424535689.db2.gz YJQYEIVPDCQCQP-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159796783 1424536298 /nfs/dbraw/zinc/53/62/98/1424536298.db2.gz OHFASVIQLNTJFO-CZUORRHYSA-N 0 0 394.424 3.180 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)n(C)c21 ZINC000159787226 1424536950 /nfs/dbraw/zinc/53/69/50/1424536950.db2.gz TYDGBZLNHWBCGA-UHFFFAOYSA-N 0 0 393.447 3.320 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000159796945 1424537805 /nfs/dbraw/zinc/53/78/05/1424537805.db2.gz BRZYBPZHJYSOJV-INIZCTEOSA-N 0 0 398.246 3.137 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000159811930 1424537986 /nfs/dbraw/zinc/53/79/86/1424537986.db2.gz DCKCNBZQNMJHLG-YJBOKZPZSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159826801 1424539985 /nfs/dbraw/zinc/53/99/85/1424539985.db2.gz JQPFVZYRWLBWIR-RDJZCZTQSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159827067 1424540872 /nfs/dbraw/zinc/54/08/72/1424540872.db2.gz JQPFVZYRWLBWIR-WBVHZDCISA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)c(F)c1 ZINC000159827380 1424540879 /nfs/dbraw/zinc/54/08/79/1424540879.db2.gz FETTURJMFQZJIJ-SUMWQHHRSA-N 0 0 394.424 3.180 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000159831099 1424540966 /nfs/dbraw/zinc/54/09/66/1424540966.db2.gz AQLWAHABWVLDIL-WBVHZDCISA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159842528 1424542264 /nfs/dbraw/zinc/54/22/64/1424542264.db2.gz JVIKBEUQPSLKIC-HOCLYGCPSA-N 0 0 376.434 3.041 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159851075 1424543694 /nfs/dbraw/zinc/54/36/94/1424543694.db2.gz DDWQQRCLTLOTCQ-YJBOKZPZSA-N 0 0 390.461 3.349 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000159864857 1424545144 /nfs/dbraw/zinc/54/51/44/1424545144.db2.gz MKJKKVLCKAZAIJ-OAHLLOKOSA-N 0 0 398.463 3.165 20 5 GGBDRN O=C(NC1(c2ccc(F)cc2)CCOCC1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000159863978 1424545309 /nfs/dbraw/zinc/54/53/09/1424545309.db2.gz LCGFYRDXOWAQNJ-UHFFFAOYSA-N 0 0 380.322 3.448 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1ccc(OC2CCCC2)nc1 ZINC000159892594 1424550472 /nfs/dbraw/zinc/55/04/72/1424550472.db2.gz MDIGRPRHNAQIHH-UHFFFAOYSA-N 0 0 384.436 3.353 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000159896421 1424550785 /nfs/dbraw/zinc/55/07/85/1424550785.db2.gz HCPFVKUGWMEGBN-AEFFLSMTSA-N 0 0 388.420 3.462 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000159896077 1424550871 /nfs/dbraw/zinc/55/08/71/1424550871.db2.gz HCPFVKUGWMEGBN-WMZOPIPTSA-N 0 0 388.420 3.462 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1ccc(-n2ccnc2)c(F)c1 ZINC000159945712 1424555440 /nfs/dbraw/zinc/55/54/40/1424555440.db2.gz PIORBEMNJGWLDP-UHFFFAOYSA-N 0 0 393.378 3.260 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccccc1 ZINC000159978523 1424558790 /nfs/dbraw/zinc/55/87/90/1424558790.db2.gz MLXHDAHORUUPKH-WMZOPIPTSA-N 0 0 397.475 3.480 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)cc1OC ZINC000159975788 1424559255 /nfs/dbraw/zinc/55/92/55/1424559255.db2.gz SYVZGALCXJUNBI-NBQZKYEYSA-N 0 0 382.416 3.318 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccccc1 ZINC000159978901 1424559316 /nfs/dbraw/zinc/55/93/16/1424559316.db2.gz MLXHDAHORUUPKH-SJLPKXTDSA-N 0 0 397.475 3.480 20 5 GGBDRN COc1cc(N2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)ccc1[N+](=O)[O-] ZINC000160005502 1424561665 /nfs/dbraw/zinc/56/16/65/1424561665.db2.gz ZPDMTERTGADHEC-LJQANCHMSA-N 0 0 377.441 3.441 20 5 GGBDRN C[NH+]1CCC2(CC1)C[C@@H](NC(=O)c1ccc([O-])c([N+](=O)[O-])c1)c1ccccc1O2 ZINC000160017460 1424563534 /nfs/dbraw/zinc/56/35/34/1424563534.db2.gz LSDDXJARYBXIMA-MRXNPFEDSA-N 0 0 397.431 3.018 20 5 GGBDRN CC(C)(CNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCC1 ZINC000160053041 1424567079 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393.165 3.436 20 5 GGBDRN C[C@H](Cc1ccccc1)OC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000160080300 1424571796 /nfs/dbraw/zinc/57/17/96/1424571796.db2.gz OBPZENVWPXURML-CQSZACIVSA-N 0 0 384.388 3.457 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCO[C@@H]([C@H]2CCCO2)C1 ZINC000160081599 1424572039 /nfs/dbraw/zinc/57/20/39/1424572039.db2.gz DXDPATUMKKVZLJ-ZIAGYGMSSA-N 0 0 389.330 3.025 20 5 GGBDRN CC(=O)N[C@@H](C)CCc1ccc(C(=O)CSc2ccc([N+](=O)[O-])cn2)cc1 ZINC000160133276 1424578245 /nfs/dbraw/zinc/57/82/45/1424578245.db2.gz KFEASVHMUNNCER-ZDUSSCGKSA-N 0 0 387.461 3.422 20 5 GGBDRN C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000160151235 1424580440 /nfs/dbraw/zinc/58/04/40/1424580440.db2.gz IKMMUIYKTAQPPG-UHFFFAOYSA-N 0 0 377.828 3.158 20 5 GGBDRN C[C@@H](OCCCNC(=O)CSc1ccc([N+](=O)[O-])cn1)c1ccccc1 ZINC000160164285 1424582326 /nfs/dbraw/zinc/58/23/26/1424582326.db2.gz HLMAQGLWDKTXCT-CQSZACIVSA-N 0 0 375.450 3.366 20 5 GGBDRN 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ZINC000160872782 1424640799 /nfs/dbraw/zinc/64/07/99/1424640799.db2.gz ARPYOBLJZRAYRX-UHFFFAOYSA-N 0 0 376.438 3.298 20 5 GGBDRN CCc1cc(NC(=O)Cc2ccc3c(c2)NC(=O)C3)c2cc([N+](=O)[O-])ccc2n1 ZINC000160870970 1424640810 /nfs/dbraw/zinc/64/08/10/1424640810.db2.gz LORVTQNTUJWRDH-UHFFFAOYSA-N 0 0 390.399 3.381 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000160885385 1424641333 /nfs/dbraw/zinc/64/13/33/1424641333.db2.gz VAPCSJKVJZCQBL-INIZCTEOSA-N 0 0 389.415 3.372 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(N2CCCCC2)cc1 ZINC000160907628 1424643170 /nfs/dbraw/zinc/64/31/70/1424643170.db2.gz XSLMPUJQWFCBFO-UHFFFAOYSA-N 0 0 382.420 3.471 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12 ZINC000160924070 1424644977 /nfs/dbraw/zinc/64/49/77/1424644977.db2.gz SFXZHOGZIJMUTC-VUXUOOGWSA-N 0 0 388.427 3.355 20 5 GGBDRN C[C@@H](C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1c(F)cccc1F ZINC000160932545 1424645999 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PVNMWCRXKBPSGN-SFHVURJKSA-N 0 0 382.424 3.209 20 5 GGBDRN CCc1ccc(C(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])cc1S(C)(=O)=O ZINC000162099555 1424816088 /nfs/dbraw/zinc/81/60/88/1424816088.db2.gz YYHMLOZRJOJGOF-UHFFFAOYSA-N 0 0 383.809 3.433 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N(CCc1cccc(F)c1)C1CCCC1 ZINC000162107567 1424816931 /nfs/dbraw/zinc/81/69/31/1424816931.db2.gz AIIACHIRFRPDSS-UHFFFAOYSA-N 0 0 389.431 3.127 20 5 GGBDRN CC(=O)CCc1ccc(OCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000162113466 1424817354 /nfs/dbraw/zinc/81/73/54/1424817354.db2.gz UOUCNBAHGZTEDO-UHFFFAOYSA-N 0 0 382.416 3.475 20 5 GGBDRN O=C(c1ccccc1)N1CCC[C@H](C(=O)N2CCCc3c([N+](=O)[O-])cccc32)C1 ZINC000162117334 1424817764 /nfs/dbraw/zinc/81/77/64/1424817764.db2.gz UEFPUNDQXDFSDA-KRWDZBQOSA-N 0 0 393.443 3.426 20 5 GGBDRN CCc1ccnc(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])c1 ZINC000180140972 1429755655 /nfs/dbraw/zinc/75/56/55/1429755655.db2.gz JVZUFIGCKOLDNT-MRXNPFEDSA-N 0 0 385.420 3.365 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cccs1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162132538 1424818594 /nfs/dbraw/zinc/81/85/94/1424818594.db2.gz WSNHNLCKWQSCCV-QGZVFWFLSA-N 0 0 387.461 3.390 20 5 GGBDRN O=C(COc1ccc2ccc(=O)oc2c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162128715 1424818658 /nfs/dbraw/zinc/81/86/58/1424818658.db2.gz CYNRYTZZBGKQCS-UHFFFAOYSA-N 0 0 380.356 3.059 20 5 GGBDRN CC(C)Cc1ccc(C(=O)C2CCN(C(=O)c3c([N+](=O)[O-])cnn3C)CC2)cc1 ZINC000162131012 1424818699 /nfs/dbraw/zinc/81/86/99/1424818699.db2.gz QSTWAGUHODQGHL-UHFFFAOYSA-N 0 0 398.463 3.262 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 ZINC000162148663 1424820035 /nfs/dbraw/zinc/82/00/35/1424820035.db2.gz KKQMFWNIMIFQKC-UHFFFAOYSA-N 0 0 389.387 3.239 20 5 GGBDRN CC(C)COC(=O)N1CCC(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)CC1 ZINC000162144983 1424820098 /nfs/dbraw/zinc/82/00/98/1424820098.db2.gz BPRRGYOBSHXONW-UHFFFAOYSA-N 0 0 389.452 3.379 20 5 GGBDRN CC(C)(CNS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000162152606 1424820358 /nfs/dbraw/zinc/82/03/58/1424820358.db2.gz UOEAJJGDEVOCKZ-UHFFFAOYSA-N 0 0 380.441 3.174 20 5 GGBDRN COc1ccccc1C(C)(C)NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000162149668 1424820484 /nfs/dbraw/zinc/82/04/84/1424820484.db2.gz NEWKNTZOZIHTOO-UHFFFAOYSA-N 0 0 378.450 3.001 20 5 GGBDRN O=C(COc1cccc(NC(=O)C2CC2)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162160634 1424821308 /nfs/dbraw/zinc/82/13/08/1424821308.db2.gz PTIPLPKXIDNVKP-UHFFFAOYSA-N 0 0 395.415 3.302 20 5 GGBDRN C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162160065 1424821425 /nfs/dbraw/zinc/82/14/25/1424821425.db2.gz CRWZJIQLIRWCCF-AWEZNQCLSA-N 0 0 383.404 3.189 20 5 GGBDRN COc1ccc(C(=O)NCCCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000162186929 1424824755 /nfs/dbraw/zinc/82/47/55/1424824755.db2.gz JAAOONWKUVQKMR-UHFFFAOYSA-N 0 0 397.431 3.093 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000162204831 1424826293 /nfs/dbraw/zinc/82/62/93/1424826293.db2.gz 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Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000162352733 1424841138 /nfs/dbraw/zinc/84/11/38/1424841138.db2.gz BRVJDRUESPFIHD-UHFFFAOYSA-N 0 0 379.376 3.141 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccccc1CN1CCCC1=O ZINC000162464485 1424855878 /nfs/dbraw/zinc/85/58/78/1424855878.db2.gz HRHHJRADWBPGNU-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000162470158 1424856398 /nfs/dbraw/zinc/85/63/98/1424856398.db2.gz SITFMOXHASODJC-IBGZPJMESA-N 0 0 384.436 3.098 20 5 GGBDRN C[C@@H](CC(=O)c1ccccc1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000162487038 1424857825 /nfs/dbraw/zinc/85/78/25/1424857825.db2.gz MLXYFMLXOPVORJ-AWEZNQCLSA-N 0 0 378.388 3.172 20 5 GGBDRN CC(=O)N1CC[C@@H](CN(C)C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000162489600 1424858653 /nfs/dbraw/zinc/85/86/53/1424858653.db2.gz WYFNUHMXBSMVQM-HNNXBMFYSA-N 0 0 393.509 3.283 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000162506625 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O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3ccccc3C2)c(C(F)(F)F)c1 ZINC000162661703 1424876671 /nfs/dbraw/zinc/87/66/71/1424876671.db2.gz CMSMBEKZZNQRDA-UHFFFAOYSA-N 0 0 386.351 3.361 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000162670641 1424877328 /nfs/dbraw/zinc/87/73/28/1424877328.db2.gz VHUBUYLWVPQHFG-UHFFFAOYSA-N 0 0 392.267 3.290 20 5 GGBDRN CCO[C@H](C)c1noc(CS(=O)(=O)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000180147792 1429760765 /nfs/dbraw/zinc/76/07/65/1429760765.db2.gz GIIQANZMRRZQQF-NEPJUHHUSA-N 0 0 383.426 3.060 20 5 GGBDRN O=Cc1cccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000162682249 1424879164 /nfs/dbraw/zinc/87/91/64/1424879164.db2.gz WPHJZBUUEMZVJO-UHFFFAOYSA-N 0 0 375.280 3.194 20 5 GGBDRN Cc1ccccc1-c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)no1 ZINC000162715519 1424884031 /nfs/dbraw/zinc/88/40/31/1424884031.db2.gz CBPSSZKMBKXOCJ-UHFFFAOYSA-N 0 0 382.376 3.376 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1 ZINC000162727661 1424885835 /nfs/dbraw/zinc/88/58/35/1424885835.db2.gz LMMWZAFOZWSTAU-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(CC(F)(F)F)[C@H](C)C1 ZINC000162738949 1424886797 /nfs/dbraw/zinc/88/67/97/1424886797.db2.gz HJVZBFBWJAKGKZ-LLVKDONJSA-N 0 0 391.415 3.415 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2nnc3n2CCCC3)CC1 ZINC000162749482 1424887686 /nfs/dbraw/zinc/88/76/86/1424887686.db2.gz FCAARFLLRDGLHU-UHFFFAOYSA-N 0 0 384.440 3.011 20 5 GGBDRN O=C(Nc1nnc2n1CCCC2)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000162757649 1424888305 /nfs/dbraw/zinc/88/83/05/1424888305.db2.gz QZGRPLDASRRGRR-UHFFFAOYSA-N 0 0 392.419 3.387 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000162771404 1424889182 /nfs/dbraw/zinc/88/91/82/1424889182.db2.gz VJRVBRBZPBQGGB-GFCCVEGCSA-N 0 0 398.444 3.066 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000162771488 1424889287 /nfs/dbraw/zinc/88/92/87/1424889287.db2.gz 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1424899781 /nfs/dbraw/zinc/89/97/81/1424899781.db2.gz LPLCYMGEHOSGCS-UHFFFAOYSA-N 0 0 377.404 3.143 20 5 GGBDRN Cc1cccnc1[C@@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])C(C)C ZINC000162889655 1424900041 /nfs/dbraw/zinc/90/00/41/1424900041.db2.gz NHJHNMHQRCYMKH-KRWDZBQOSA-N 0 0 377.466 3.157 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCCC[C@@H]2CC(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000162889856 1424900368 /nfs/dbraw/zinc/90/03/68/1424900368.db2.gz TXNUNVRGDMDUEK-MRXNPFEDSA-N 0 0 398.463 3.490 20 5 GGBDRN O=c1c(Cl)c(Cl)cnn1Cc1ccc([N+](=O)[O-])cc1Br ZINC000162902230 1424902978 /nfs/dbraw/zinc/90/29/78/1424902978.db2.gz RVSTZRREIFFJPP-UHFFFAOYSA-N 0 0 378.997 3.269 20 5 GGBDRN O=C(NCc1ccnc(N2CCCC2)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000162951267 1424911771 /nfs/dbraw/zinc/91/17/71/1424911771.db2.gz KZQPUUUCMXFHGV-UHFFFAOYSA-N 0 0 395.463 3.464 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1F ZINC000162949934 1424911872 /nfs/dbraw/zinc/91/18/72/1424911872.db2.gz FCLBJPMBOXRBLZ-UHFFFAOYSA-N 0 0 382.395 3.395 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1ccc(C(=O)OC(C)C)cc1 ZINC000162957181 1424913432 /nfs/dbraw/zinc/91/34/32/1424913432.db2.gz DSXVZUPRTCAQNO-UHFFFAOYSA-N 0 0 382.214 3.476 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCNC(=O)c1ccc(Cl)cc1 ZINC000162971074 1424915205 /nfs/dbraw/zinc/91/52/05/1424915205.db2.gz LSQZOBLKRLPJQQ-UHFFFAOYSA-N 0 0 376.800 3.108 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN(C)CCOCC2CC2)c1=S ZINC000163016740 1424924183 /nfs/dbraw/zinc/92/41/83/1424924183.db2.gz JBGLYDMNNQOLAX-UHFFFAOYSA-N 0 0 391.497 3.325 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1 ZINC000163069429 1424934663 /nfs/dbraw/zinc/93/46/63/1424934663.db2.gz SCCNSHZLBQSQAR-QGZVFWFLSA-N 0 0 395.337 3.053 20 5 GGBDRN C[C@@H](c1ccccn1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163065385 1424934730 /nfs/dbraw/zinc/93/47/30/1424934730.db2.gz KLXAOWYPZPKHKL-JTQLQIEISA-N 0 0 389.355 3.390 20 5 GGBDRN Cc1ccc(CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c(O[C@H]2CCOC2)c1 ZINC000163081184 1424936049 /nfs/dbraw/zinc/93/60/49/1424936049.db2.gz BOXOLHGKDFFUPV-ZDUSSCGKSA-N 0 0 392.358 3.279 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCCC(=O)N1Cc2ccccc2C1 ZINC000163108877 1424941453 /nfs/dbraw/zinc/94/14/53/1424941453.db2.gz CZQQIOLFAOXZHO-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCSC[C@H]1c1ccccc1 ZINC000163111343 1424942814 /nfs/dbraw/zinc/94/28/14/1424942814.db2.gz AGIRZTOAPBJQKH-KRWDZBQOSA-N 0 0 399.472 3.467 20 5 GGBDRN CCc1cc(N2CCC(NC(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)ncn1 ZINC000163128475 1424947728 /nfs/dbraw/zinc/94/77/28/1424947728.db2.gz YNXRCNDFOVDMQU-UHFFFAOYSA-N 0 0 384.440 3.046 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1 ZINC000163138908 1424949161 /nfs/dbraw/zinc/94/91/61/1424949161.db2.gz VHTBEJLNMPOCDC-MJGOQNOKSA-N 0 0 385.420 3.260 20 5 GGBDRN Cc1c(CC(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)cccc1[N+](=O)[O-] ZINC000163153492 1424950081 /nfs/dbraw/zinc/95/00/81/1424950081.db2.gz QXUYVKGYLUHNIV-OAHLLOKOSA-N 0 0 381.432 3.450 20 5 GGBDRN Cc1cccc(C(=O)OCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1F ZINC000163168830 1424952660 /nfs/dbraw/zinc/95/26/60/1424952660.db2.gz FBVPKQBORHFEHV-UHFFFAOYSA-N 0 0 380.759 3.283 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000180155752 1429767427 /nfs/dbraw/zinc/76/74/27/1429767427.db2.gz FOQXOGGCCUFANK-UHFFFAOYSA-N 0 0 379.319 3.085 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000163200082 1424958011 /nfs/dbraw/zinc/95/80/11/1424958011.db2.gz YNYIIVCAGCMWFN-HNNXBMFYSA-N 0 0 388.811 3.484 20 5 GGBDRN COc1ccc([C@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])c2ccccc2Cl)cc1 ZINC000163219767 1424961318 /nfs/dbraw/zinc/96/13/18/1424961318.db2.gz KTGFEQGYJCQYAZ-INIZCTEOSA-N 0 0 386.795 3.499 20 5 GGBDRN C[C@@](NC(=O)c1cccc(Cl)c1[N+](=O)[O-])(C(N)=O)c1cccc(Cl)c1 ZINC000163222273 1424961427 /nfs/dbraw/zinc/96/14/27/1424961427.db2.gz FLBNLRHDUZXOTR-INIZCTEOSA-N 0 0 382.203 3.032 20 5 GGBDRN CC(=O)N1CCc2sc(C(=O)COc3cc([N+](=O)[O-])ccc3Cl)cc2C1 ZINC000163280865 1424972848 /nfs/dbraw/zinc/97/28/48/1424972848.db2.gz CBCOHOOLXAESNY-UHFFFAOYSA-N 0 0 394.836 3.476 20 5 GGBDRN Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCCN1c1ncc([N+](=O)[O-])c(N)n1 ZINC000163297305 1424975428 /nfs/dbraw/zinc/97/54/28/1424975428.db2.gz JNWFYPFWWAFDJC-LLVKDONJSA-N 0 0 379.852 3.123 20 5 GGBDRN CC(C)OCCCNC(=O)C1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163314012 1424977947 /nfs/dbraw/zinc/97/79/47/1424977947.db2.gz BMQBHYLLDWADKQ-UHFFFAOYSA-N 0 0 397.903 3.392 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000163316037 1424978078 /nfs/dbraw/zinc/97/80/78/1424978078.db2.gz KPBBRZGMOVBRMG-WBVHZDCISA-N 0 0 376.434 3.102 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000163316265 1424978097 /nfs/dbraw/zinc/97/80/97/1424978097.db2.gz KPBBRZGMOVBRMG-NVXWUHKLSA-N 0 0 376.434 3.102 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000163315251 1424978215 /nfs/dbraw/zinc/97/82/15/1424978215.db2.gz DFMLARNQFUBYEL-WMZOPIPTSA-N 0 0 390.461 3.356 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cc(F)ccc2F)c(C(F)(F)F)c1 ZINC000163317523 1424978662 /nfs/dbraw/zinc/97/86/62/1424978662.db2.gz YZLZPDIJQRUAGI-UHFFFAOYSA-N 0 0 396.293 3.370 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)cc1C ZINC000163329141 1424980208 /nfs/dbraw/zinc/98/02/08/1424980208.db2.gz GAFGLGAFJAGNNK-FUHWJXTLSA-N 0 0 390.461 3.410 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)cc1C ZINC000163328898 1424980466 /nfs/dbraw/zinc/98/04/66/1424980466.db2.gz GAFGLGAFJAGNNK-WMZOPIPTSA-N 0 0 390.461 3.410 20 5 GGBDRN CC(C)(NC(=O)N[C@@H]1CCO[C@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000163343582 1424982083 /nfs/dbraw/zinc/98/20/83/1424982083.db2.gz FOZDUNRRRVRADR-RDTXWAMCSA-N 0 0 379.482 3.184 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000163346059 1424982779 /nfs/dbraw/zinc/98/27/79/1424982779.db2.gz NIXXPLLWKODMBV-CJNGLKHVSA-N 0 0 396.852 3.447 20 5 GGBDRN CC(C)C[C@H]1COCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163361401 1424984797 /nfs/dbraw/zinc/98/47/97/1424984797.db2.gz IRHHYNCKUATVEY-LBPRGKRZSA-N 0 0 396.387 3.049 20 5 GGBDRN CC(C)C[C@@H]1COCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163361269 1424984810 /nfs/dbraw/zinc/98/48/10/1424984810.db2.gz IRHHYNCKUATVEY-GFCCVEGCSA-N 0 0 396.387 3.049 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)S(=O)(=O)Cc1ncn(-c2ccccc2)n1 ZINC000180152995 1429764874 /nfs/dbraw/zinc/76/48/74/1429764874.db2.gz BDLGTFMUYRXOKB-CQSZACIVSA-N 0 0 386.433 3.160 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000163381530 1424989025 /nfs/dbraw/zinc/98/90/25/1424989025.db2.gz WMPNMYMODCJIFT-NVXWUHKLSA-N 0 0 376.434 3.102 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000163401130 1424991929 /nfs/dbraw/zinc/99/19/29/1424991929.db2.gz QPEZZQLQZQUQJV-WBVHZDCISA-N 0 0 376.434 3.102 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000163406484 1424992930 /nfs/dbraw/zinc/99/29/30/1424992930.db2.gz XIENBTCMYPHBOU-SJLPKXTDSA-N 0 0 390.461 3.410 20 5 GGBDRN CCN(Cc1ccccn1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163431050 1424997455 /nfs/dbraw/zinc/99/74/55/1424997455.db2.gz CGNWOUCVLLTBMT-UHFFFAOYSA-N 0 0 389.355 3.219 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1ccccc1OCC1CC1 ZINC000163501848 1425008302 /nfs/dbraw/zinc/00/83/02/1425008302.db2.gz JRGZKHUTVZQHNM-UHFFFAOYSA-N 0 0 390.461 3.046 20 5 GGBDRN COc1cc(N[C@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])s3)C2)cc(OC)c1 ZINC000163510129 1425009916 /nfs/dbraw/zinc/00/99/16/1425009916.db2.gz NDDCJORMLJBZAD-LBPRGKRZSA-N 0 0 391.449 3.390 20 5 GGBDRN CC[C@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000163554606 1425016666 /nfs/dbraw/zinc/01/66/66/1425016666.db2.gz DXLLGFSAGSAXOW-INIZCTEOSA-N 0 0 384.404 3.486 20 5 GGBDRN CC[C@@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000163554718 1425016698 /nfs/dbraw/zinc/01/66/98/1425016698.db2.gz DXLLGFSAGSAXOW-MRXNPFEDSA-N 0 0 384.404 3.486 20 5 GGBDRN C[C@H](O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000163558994 1425017802 /nfs/dbraw/zinc/01/78/02/1425017802.db2.gz REMKDJMGJPOREC-RDJZCZTQSA-N 0 0 383.448 3.440 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cnc(Cl)cc2C)cc1[N+](=O)[O-] ZINC000163623081 1425026116 /nfs/dbraw/zinc/02/61/16/1425026116.db2.gz VWEDDZBQEMDMNO-LLVKDONJSA-N 0 0 376.800 3.076 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000163653726 1425029403 /nfs/dbraw/zinc/02/94/03/1425029403.db2.gz RLWCBLWFCYABBJ-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN COc1ccc(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1Cl ZINC000163661603 1425030670 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ZINC000170627962 1425265702 /nfs/dbraw/zinc/26/57/02/1425265702.db2.gz ISHHKFDYAWRHEY-ZDUSSCGKSA-N 0 0 395.419 3.282 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000170630872 1425267100 /nfs/dbraw/zinc/26/71/00/1425267100.db2.gz JDLISNPPTJJKRZ-LLVKDONJSA-N 0 0 383.832 3.235 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000170630874 1425267219 /nfs/dbraw/zinc/26/72/19/1425267219.db2.gz HRBJRRYNYHJKLG-LLVKDONJSA-N 0 0 383.832 3.235 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000170630979 1425267857 /nfs/dbraw/zinc/26/78/57/1425267857.db2.gz CQDYMPATZCUYSJ-LLVKDONJSA-N 0 0 383.832 3.235 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000170634819 1425268381 /nfs/dbraw/zinc/26/83/81/1425268381.db2.gz PPJKILDKGBIDAY-HNNXBMFYSA-N 0 0 377.441 3.375 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(Nc3cccc(CN4CCOCC4)c3)cc2N1 ZINC000170640035 1425271167 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3.443 20 5 GGBDRN O=C(NCc1cc(F)cc2c1OCOC2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000170662685 1425282283 /nfs/dbraw/zinc/28/22/83/1425282283.db2.gz LZCNBAVIZYECRC-UHFFFAOYSA-N 0 0 387.367 3.105 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000170670980 1425289230 /nfs/dbraw/zinc/28/92/30/1425289230.db2.gz FVBQNLVWQGYCPO-MRXNPFEDSA-N 0 0 386.455 3.284 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OCc2cccnc2Cl)c([N+](=O)[O-])c1 ZINC000170742789 1425324511 /nfs/dbraw/zinc/32/45/11/1425324511.db2.gz WDNCFUGPLOHCTH-UHFFFAOYSA-N 0 0 399.856 3.253 20 5 GGBDRN COc1ccc(CN2CCC(NC(=O)c3cc(C)oc3C)CC2)cc1[N+](=O)[O-] ZINC000170775673 1425336462 /nfs/dbraw/zinc/33/64/62/1425336462.db2.gz GCAMTJYDFHHEBT-UHFFFAOYSA-N 0 0 387.436 3.208 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC(NC(=O)c2cc(C)oc2C)CC1 ZINC000170776800 1425337427 /nfs/dbraw/zinc/33/74/27/1425337427.db2.gz DDWAMZXAEILCBN-UHFFFAOYSA-N 0 0 387.436 3.208 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000170782604 1425341781 /nfs/dbraw/zinc/34/17/81/1425341781.db2.gz HXYKKQNNZYBQQD-CYBMUJFWSA-N 0 0 399.234 3.157 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2cccc(F)c2F)cc1Br ZINC000170788427 1425342996 /nfs/dbraw/zinc/34/29/96/1425342996.db2.gz VEUKKHBAJCCVJS-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000170795680 1425345390 /nfs/dbraw/zinc/34/53/90/1425345390.db2.gz UAHNIIJFTURDSC-SNVBAGLBSA-N 0 0 385.367 3.002 20 5 GGBDRN CSc1ccc(C(=O)OCc2nccn2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000170805282 1425349132 /nfs/dbraw/zinc/34/91/32/1425349132.db2.gz ITQRSTNVQVDONO-UHFFFAOYSA-N 0 0 375.328 3.433 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](c1nc(C2CC2)no1)C(C)C ZINC000170811628 1425351479 /nfs/dbraw/zinc/35/14/79/1425351479.db2.gz UNSZGQBSEPXRGJ-OAHLLOKOSA-N 0 0 389.412 3.060 20 5 GGBDRN CC(=O)N1CCC[C@@H](C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000170829797 1425358482 /nfs/dbraw/zinc/35/84/82/1425358482.db2.gz SIJHFFMUBPTIBQ-CQSZACIVSA-N 0 0 379.844 3.250 20 5 GGBDRN CCOc1ccccc1[C@@H](CC(=O)N(C)Cc1ccccc1[N+](=O)[O-])NC(C)=O ZINC000170841395 1425364064 /nfs/dbraw/zinc/36/40/64/1425364064.db2.gz LQXVWBOSDZZSBF-GOSISDBHSA-N 0 0 399.447 3.219 20 5 GGBDRN CCOc1ccccc1[C@@H](CC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)NC(C)=O ZINC000170842097 1425365552 /nfs/dbraw/zinc/36/55/52/1425365552.db2.gz YDTQJHAOFKHUMC-IFXJQAMLSA-N 0 0 399.447 3.438 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCN(C(=O)c2c(F)cccc2Cl)CC1 ZINC000170844099 1425365984 /nfs/dbraw/zinc/36/59/84/1425365984.db2.gz VWUWSEZOJGADEV-UHFFFAOYSA-N 0 0 397.815 3.047 20 5 GGBDRN COc1ccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1F ZINC000170845779 1425366419 /nfs/dbraw/zinc/36/64/19/1425366419.db2.gz XCCGLCZVJBMFKQ-UHFFFAOYSA-N 0 0 397.200 3.478 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000170852235 1425369484 /nfs/dbraw/zinc/36/94/84/1425369484.db2.gz PYYCIWIWAHUEAD-UHFFFAOYSA-N 0 0 384.298 3.286 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(OCc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000170853086 1425370275 /nfs/dbraw/zinc/37/02/75/1425370275.db2.gz IPZABXRGAHOMFS-UHFFFAOYSA-N 0 0 386.769 3.139 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CCCN1c1ncnc2sccc21)c1cccc([N+](=O)[O-])c1 ZINC000170870650 1425375023 /nfs/dbraw/zinc/37/50/23/1425375023.db2.gz SOKFEHFVAUUCBG-MLGOLLRUSA-N 0 0 397.460 3.446 20 5 GGBDRN Cc1cccc2c1CCN(Cn1nc(-c3cccc([N+](=O)[O-])c3)ccc1=O)C2 ZINC000170903818 1425386899 /nfs/dbraw/zinc/38/68/99/1425386899.db2.gz AXLXLPGRIFPSKD-UHFFFAOYSA-N 0 0 376.416 3.143 20 5 GGBDRN Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)cc1[N+](=O)[O-] ZINC000170915239 1425389282 /nfs/dbraw/zinc/38/92/82/1425389282.db2.gz YAWKKYNQKXJQNS-HNNXBMFYSA-N 0 0 397.431 3.000 20 5 GGBDRN Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)cc1[N+](=O)[O-] ZINC000170915240 1425389385 /nfs/dbraw/zinc/38/93/85/1425389385.db2.gz YAWKKYNQKXJQNS-OAHLLOKOSA-N 0 0 397.431 3.000 20 5 GGBDRN C[C@H]1Oc2c(cccc2C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)NC1=O ZINC000170920659 1425394136 /nfs/dbraw/zinc/39/41/36/1425394136.db2.gz MADYPEJDAGLFJI-SNVBAGLBSA-N 0 0 389.795 3.240 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H](c2ccccc2)c2ccc3[nH]cnc3c2)c1[N+](=O)[O-] ZINC000170921798 1425394996 /nfs/dbraw/zinc/39/49/96/1425394996.db2.gz QRSVZURTMXUHST-KRWDZBQOSA-N 0 0 390.403 3.032 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000170929228 1425398264 /nfs/dbraw/zinc/39/82/64/1425398264.db2.gz UINOLJHLUGQRNR-UHFFFAOYSA-N 0 0 396.447 3.042 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccccc1)C1CCC1 ZINC000170930368 1425398758 /nfs/dbraw/zinc/39/87/58/1425398758.db2.gz VIOISASQUMCUOO-GOSISDBHSA-N 0 0 383.404 3.200 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000170945718 1425404730 /nfs/dbraw/zinc/40/47/30/1425404730.db2.gz LSJOTXKAGVTOJH-CQSZACIVSA-N 0 0 391.468 3.289 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000170946176 1425405261 /nfs/dbraw/zinc/40/52/61/1425405261.db2.gz NNCIIAVWHCYROF-LLVKDONJSA-N 0 0 383.470 3.422 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000170947896 1425407072 /nfs/dbraw/zinc/40/70/72/1425407072.db2.gz UPGKPQCQVQYKIO-LBPRGKRZSA-N 0 0 395.431 3.499 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000170947438 1425407136 /nfs/dbraw/zinc/40/71/36/1425407136.db2.gz KKACETKHFNPOCY-CYBMUJFWSA-N 0 0 377.441 3.360 20 5 GGBDRN C[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1cc2ccccc2s1 ZINC000170968883 1425420581 /nfs/dbraw/zinc/42/05/81/1425420581.db2.gz OEANUNFOVWYHTA-GFCCVEGCSA-N 0 0 383.429 3.417 20 5 GGBDRN CN(CC(=O)N[C@@H](c1nccs1)c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000170984264 1425424774 /nfs/dbraw/zinc/42/47/74/1425424774.db2.gz YVHDXXRTKABQRN-LJQANCHMSA-N 0 0 396.472 3.389 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000170994037 1425426057 /nfs/dbraw/zinc/42/60/57/1425426057.db2.gz XQQLLYOFIIWBGA-IBGZPJMESA-N 0 0 387.411 3.389 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 ZINC000170996590 1425428232 /nfs/dbraw/zinc/42/82/32/1425428232.db2.gz VHQFXRXJQUITFG-SFHVURJKSA-N 0 0 381.432 3.106 20 5 GGBDRN C[C@H](NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000170997893 1425429154 /nfs/dbraw/zinc/42/91/54/1425429154.db2.gz YWNXRSASGPEZKC-MAUKXSAKSA-N 0 0 381.432 3.324 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000170997899 1425429164 /nfs/dbraw/zinc/42/91/64/1425429164.db2.gz YWNXRSASGPEZKC-QAPCUYQASA-N 0 0 381.432 3.324 20 5 GGBDRN O=C(Nc1nc2c(s1)COCC2)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000171018142 1425439618 /nfs/dbraw/zinc/43/96/18/1425439618.db2.gz JYBGHERJYKLNKH-UHFFFAOYSA-N 0 0 388.430 3.500 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2c(s1)COCC2 ZINC000171019623 1425440412 /nfs/dbraw/zinc/44/04/12/1425440412.db2.gz QGGLYZMMQVPTHN-UHFFFAOYSA-N 0 0 391.452 3.323 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ncc(-c2ccccc2)s1 ZINC000171023316 1425442867 /nfs/dbraw/zinc/44/28/67/1425442867.db2.gz CKNYSFPXQMVCDA-GFCCVEGCSA-N 0 0 396.428 3.475 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]1c1cccc(F)c1 ZINC000171023869 1425443635 /nfs/dbraw/zinc/44/36/35/1425443635.db2.gz WFDOJMKQKWPENS-FZKQIMNGSA-N 0 0 385.395 3.216 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(Cc1ccco1)C1CCCC1 ZINC000171024683 1425443848 /nfs/dbraw/zinc/44/38/48/1425443848.db2.gz KUYAXJVVGZZLQL-CQSZACIVSA-N 0 0 385.420 3.278 20 5 GGBDRN CC(C)CCOCCNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000171026715 1425445333 /nfs/dbraw/zinc/44/53/33/1425445333.db2.gz HWYWXYKYDXGYLT-UHFFFAOYSA-N 0 0 380.832 3.269 20 5 GGBDRN CC(C)COC(=O)N1CCC(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000171029773 1425446394 /nfs/dbraw/zinc/44/63/94/1425446394.db2.gz QJHWSHFVFNPASF-CQSZACIVSA-N 0 0 377.441 3.277 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 ZINC000171041427 1425451080 /nfs/dbraw/zinc/45/10/80/1425451080.db2.gz XCOIJNFDMQHJNQ-IAGOWNOFSA-N 0 0 376.434 3.102 20 5 GGBDRN Nc1ccc(C(=O)N(CCc2ccccc2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000171041666 1425451088 /nfs/dbraw/zinc/45/10/88/1425451088.db2.gz MTLIHCOCHGWVET-UHFFFAOYSA-N 0 0 376.416 3.457 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 ZINC000171042438 1425451765 /nfs/dbraw/zinc/45/17/65/1425451765.db2.gz FIIZDXZHNYCMFN-AEFFLSMTSA-N 0 0 376.434 3.102 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000171042075 1425451776 /nfs/dbraw/zinc/45/17/76/1425451776.db2.gz QXTGDONBKWYLLN-ROUUACIJSA-N 0 0 376.434 3.102 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 ZINC000171042434 1425452127 /nfs/dbraw/zinc/45/21/27/1425452127.db2.gz FIIZDXZHNYCMFN-FUHWJXTLSA-N 0 0 376.434 3.102 20 5 GGBDRN CC(C)[C@@H](CNC(=O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000171047296 1425454326 /nfs/dbraw/zinc/45/43/26/1425454326.db2.gz FINBPZUKYVDAOK-LJQANCHMSA-N 0 0 393.447 3.409 20 5 GGBDRN O=C(CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)N1CCc2ccccc21 ZINC000171051851 1425455821 /nfs/dbraw/zinc/45/58/21/1425455821.db2.gz HXIRHCLSSBXLMO-UHFFFAOYSA-N 0 0 381.413 3.129 20 5 GGBDRN CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000171057175 1425459129 /nfs/dbraw/zinc/45/91/29/1425459129.db2.gz QMAJYSGMENZSQU-PAQXCSQUSA-N 0 0 377.466 3.030 20 5 GGBDRN CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000171057167 1425459273 /nfs/dbraw/zinc/45/92/73/1425459273.db2.gz QMAJYSGMENZSQU-CWPOZZLXSA-N 0 0 377.466 3.030 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(OC(=O)CCn3cc([N+](=O)[O-])cn3)cc2)cc1 ZINC000171061675 1425461814 /nfs/dbraw/zinc/46/18/14/1425461814.db2.gz VEGSLUZJGJSJIY-UHFFFAOYSA-N 0 0 394.387 3.348 20 5 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ZINC000171090823 1425478342 /nfs/dbraw/zinc/47/83/42/1425478342.db2.gz FPPZJQMOXVJIPE-QGZVFWFLSA-N 0 0 382.420 3.029 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCC[C@@H]1C(=O)Nc2ccccc21 ZINC000171090820 1425478457 /nfs/dbraw/zinc/47/84/57/1425478457.db2.gz FPPZJQMOXVJIPE-KRWDZBQOSA-N 0 0 382.420 3.029 20 5 GGBDRN CO[C@H]1CCCN(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000171115587 1425490354 /nfs/dbraw/zinc/49/03/54/1425490354.db2.gz PDUWEQIMSUOVEN-HOCLYGCPSA-N 0 0 384.436 3.414 20 5 GGBDRN O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000171118032 1425491318 /nfs/dbraw/zinc/49/13/18/1425491318.db2.gz DJTFTIGKJSUPJM-OAHLLOKOSA-N 0 0 387.371 3.162 20 5 GGBDRN C[C@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc(N2CCCC2=O)c1 ZINC000171128663 1425495574 /nfs/dbraw/zinc/49/55/74/1425495574.db2.gz PUSIZAWYPYVYPJ-AWEZNQCLSA-N 0 0 397.431 3.439 20 5 GGBDRN CCc1noc2ncc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)cc12 ZINC000171135667 1425499260 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C[C@@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000171268049 1425585306 /nfs/dbraw/zinc/58/53/06/1425585306.db2.gz UZHIQMWKQSTSGD-LLVKDONJSA-N 0 0 375.347 3.053 20 5 GGBDRN COc1cc(CCNC(=O)C(C)(C)c2ccc(F)cc2)c([N+](=O)[O-])cc1OC ZINC000171272085 1425587153 /nfs/dbraw/zinc/58/71/53/1425587153.db2.gz OTNSITJHSVSOIT-UHFFFAOYSA-N 0 0 390.411 3.388 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCc2cc(-c3ccccc3)on2)cc1[N+](=O)[O-] ZINC000171272486 1425587355 /nfs/dbraw/zinc/58/73/55/1425587355.db2.gz CAXRVLLBQPAJHC-UHFFFAOYSA-N 0 0 382.332 3.396 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)c(C)o1 ZINC000171288270 1425595313 /nfs/dbraw/zinc/59/53/13/1425595313.db2.gz MSCPHAFOOTVHDQ-UHFFFAOYSA-N 0 0 385.420 3.148 20 5 GGBDRN Cc1csc(-c2ccc(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3)cc2)n1 ZINC000171290965 1425596702 /nfs/dbraw/zinc/59/67/02/1425596702.db2.gz KTGSARABDBORJO-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)c(C)o1 ZINC000171292783 1425598207 /nfs/dbraw/zinc/59/82/07/1425598207.db2.gz GMMLQPSCIACQJA-UHFFFAOYSA-N 0 0 385.420 3.148 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)c(C)o1 ZINC000171293040 1425599423 /nfs/dbraw/zinc/59/94/23/1425599423.db2.gz HEHXKAGNFMVBPH-UHFFFAOYSA-N 0 0 385.420 3.148 20 5 GGBDRN CC(C)(CCc1ccccc1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000171316778 1425614312 /nfs/dbraw/zinc/61/43/12/1425614312.db2.gz LFPGJZHJBIASPR-UHFFFAOYSA-N 0 0 379.420 3.317 20 5 GGBDRN C[C@H]1Cc2ccccc2N1C(=O)COC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000171328079 1425619116 /nfs/dbraw/zinc/61/91/16/1425619116.db2.gz HUKMQMADDLTUOC-JTQLQIEISA-N 0 0 376.315 3.008 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000171326520 1425619299 /nfs/dbraw/zinc/61/92/99/1425619299.db2.gz VEDHCNPVVLQCRI-NSHDSACASA-N 0 0 383.832 3.235 20 5 GGBDRN Cc1nn(C)c(C(=O)NCC(C)(C)c2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000171327074 1425619327 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ZINC000171441318 1425680225 /nfs/dbraw/zinc/68/02/25/1425680225.db2.gz SMNVMCWTOKEYRS-MRXNPFEDSA-N 0 0 398.423 3.165 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000171455157 1425685668 /nfs/dbraw/zinc/68/56/68/1425685668.db2.gz UTQYKBKWDKGWFE-PMACEKPBSA-N 0 0 392.415 3.431 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000171457129 1425687136 /nfs/dbraw/zinc/68/71/36/1425687136.db2.gz LRWWUPDGGQLQKR-PMACEKPBSA-N 0 0 392.415 3.431 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000171464165 1425690464 /nfs/dbraw/zinc/69/04/64/1425690464.db2.gz QKQFCNLANJNQHI-ROUUACIJSA-N 0 0 385.376 3.462 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000171464186 1425690500 /nfs/dbraw/zinc/69/05/00/1425690500.db2.gz QKQFCNLANJNQHI-QZTJIDSGSA-N 0 0 385.376 3.462 20 5 GGBDRN Cc1c(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000171464463 1425690618 /nfs/dbraw/zinc/69/06/18/1425690618.db2.gz GZRVEAILAOEQPW-ZWKOTPCHSA-N 0 0 385.376 3.462 20 5 GGBDRN Cc1c(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000171464469 1425690646 /nfs/dbraw/zinc/69/06/46/1425690646.db2.gz GZRVEAILAOEQPW-MSOLQXFVSA-N 0 0 385.376 3.462 20 5 GGBDRN Cc1csc(CCCCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)n1 ZINC000171474179 1425695771 /nfs/dbraw/zinc/69/57/71/1425695771.db2.gz IJYARFSWTLJLKQ-UHFFFAOYSA-N 0 0 378.410 3.329 20 5 GGBDRN C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000171474631 1425696158 /nfs/dbraw/zinc/69/61/58/1425696158.db2.gz BBZGLGWNCWRCIQ-ZMZPIMSZSA-N 0 0 380.360 3.152 20 5 GGBDRN Cc1nc(-c2c[nH]c(C(=O)Nc3n[nH]c(-c4cccc([N+](=O)[O-])c4)n3)c2)cs1 ZINC000171484686 1425701042 /nfs/dbraw/zinc/70/10/42/1425701042.db2.gz FUAKNQMLXNAEPN-UHFFFAOYSA-N 0 0 395.404 3.392 20 5 GGBDRN CC(C)[C@H]1CCC[C@H](NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000171519273 1425711860 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CSYHGQVTXGTIKS-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000171804355 1425824882 /nfs/dbraw/zinc/82/48/82/1425824882.db2.gz KQVKKOBIKMTVRG-UHFFFAOYSA-N 0 0 375.404 3.126 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(Oc3cccc(F)c3)nc2)c1[N+](=O)[O-] ZINC000171806744 1425825562 /nfs/dbraw/zinc/82/55/62/1425825562.db2.gz WJAPIFAVOWTWFT-UHFFFAOYSA-N 0 0 385.355 3.137 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C)c(NC(=O)c3ccncc3)c2)c1[N+](=O)[O-] ZINC000171805803 1425825563 /nfs/dbraw/zinc/82/55/63/1425825563.db2.gz IAOZXNQLGSMQPC-UHFFFAOYSA-N 0 0 394.391 3.088 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC2(c3ccccc3Cl)CCOCC2)c1[N+](=O)[O-] ZINC000171825287 1425829748 /nfs/dbraw/zinc/82/97/48/1425829748.db2.gz AGEUVNVJUXIRJQ-UHFFFAOYSA-N 0 0 392.843 3.012 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1C(=O)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000171824882 1425829962 /nfs/dbraw/zinc/82/99/62/1425829962.db2.gz MCQKEOQIZMZWII-KKUMJFAQSA-N 0 0 391.493 3.442 20 5 GGBDRN C=CC(=O)NCCNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000171832754 1425831503 /nfs/dbraw/zinc/83/15/03/1425831503.db2.gz RWMJOCAZOTWEGV-UHFFFAOYSA-N 0 0 385.445 3.086 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1ccc(Cl)cc1Cl ZINC000171832923 1425831615 /nfs/dbraw/zinc/83/16/15/1425831615.db2.gz SRVLGNNZWNOTDX-HNNXBMFYSA-N 0 0 384.219 3.434 20 5 GGBDRN CCc1nc([C@H](C)NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cs1 ZINC000171857187 1425836384 /nfs/dbraw/zinc/83/63/84/1425836384.db2.gz OHOZJDARBLQYJF-ZDUSSCGKSA-N 0 0 389.481 3.207 20 5 GGBDRN COCCOc1ccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000171865444 1425838658 /nfs/dbraw/zinc/83/86/58/1425838658.db2.gz WZQGKFRSVXXYFD-UHFFFAOYSA-N 0 0 382.376 3.058 20 5 GGBDRN COCCOc1ccc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)cc1 ZINC000171868160 1425839145 /nfs/dbraw/zinc/83/91/45/1425839145.db2.gz WIGYEEGLIZDXQA-UHFFFAOYSA-N 0 0 382.376 3.262 20 5 GGBDRN CNC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000171872558 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Cc1cc(S(=O)(=O)NC[C@@H](c2cccs2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000172015297 1425874223 /nfs/dbraw/zinc/87/42/23/1425874223.db2.gz RGMPXXAMZPMGOF-INIZCTEOSA-N 0 0 395.506 3.080 20 5 GGBDRN CCCC(=O)Nc1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000172017654 1425874703 /nfs/dbraw/zinc/87/47/03/1425874703.db2.gz NOGNDOLMBVFZFX-UHFFFAOYSA-N 0 0 391.449 3.120 20 5 GGBDRN CC(C)Cn1c(CCC(N)=O)nnc1SCc1cc([N+](=O)[O-])ccc1Cl ZINC000172023305 1425876294 /nfs/dbraw/zinc/87/62/94/1425876294.db2.gz CAMPYWJPIBVTHV-UHFFFAOYSA-N 0 0 397.888 3.206 20 5 GGBDRN C[C@@H](NC(=O)NC[C@@](C)(O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000172027900 1425877699 /nfs/dbraw/zinc/87/76/99/1425877699.db2.gz QBGDFBDGHRCEAW-ADLMAVQZSA-N 0 0 379.363 3.141 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000172029083 1425878338 /nfs/dbraw/zinc/87/83/38/1425878338.db2.gz DSNSEOCHYWJBQM-LLVKDONJSA-N 0 0 377.372 3.312 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 ZINC000172033851 1425879392 /nfs/dbraw/zinc/87/93/92/1425879392.db2.gz HUXUFGKILRYOQS-UHFFFAOYSA-N 0 0 390.461 3.444 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000172050254 1425882416 /nfs/dbraw/zinc/88/24/16/1425882416.db2.gz WKNAVDYZORGFCS-AREMUKBSSA-N 0 0 377.422 3.134 20 5 GGBDRN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)N1CCc2sccc2C1 ZINC000172050102 1425882512 /nfs/dbraw/zinc/88/25/12/1425882512.db2.gz FDCNSSFBVSLLNZ-LBPRGKRZSA-N 0 0 393.896 3.415 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2)no1 ZINC000172058900 1425885415 /nfs/dbraw/zinc/88/54/15/1425885415.db2.gz MPWWMCXYDZSOAF-UHFFFAOYSA-N 0 0 396.403 3.391 20 5 GGBDRN Cc1sc(=O)n(CCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000172065588 1425887501 /nfs/dbraw/zinc/88/75/01/1425887501.db2.gz HLXFEVIHRCFOIN-UHFFFAOYSA-N 0 0 377.466 3.262 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(CCc2cccnc2)CC1 ZINC000172070766 1425888436 /nfs/dbraw/zinc/88/84/36/1425888436.db2.gz AUOSZTMNQYTDTG-UHFFFAOYSA-N 0 0 380.370 3.373 20 5 GGBDRN C[C@H](CNC(=O)OC(C)(C)C)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172075563 1425890161 /nfs/dbraw/zinc/89/01/61/1425890161.db2.gz GZUCDNRKTOQSJZ-LLVKDONJSA-N 0 0 385.848 3.162 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000172087049 1425894014 /nfs/dbraw/zinc/89/40/14/1425894014.db2.gz KJQMFDZMGMRGTJ-CQSZACIVSA-N 0 0 389.433 3.217 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000172093141 1425894706 /nfs/dbraw/zinc/89/47/06/1425894706.db2.gz YTQRTGTXHVLQTJ-CZUORRHYSA-N 0 0 388.445 3.017 20 5 GGBDRN CN(C[C@H]1COc2ccccc2O1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172098421 1425895724 /nfs/dbraw/zinc/89/57/24/1425895724.db2.gz WZRCXOUBGYLHKS-AWEZNQCLSA-N 0 0 376.796 3.089 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](c1c(F)cccc1F)N(C)C ZINC000172104472 1425896659 /nfs/dbraw/zinc/89/66/59/1425896659.db2.gz QDZXJFVRZURNSM-OAHLLOKOSA-N 0 0 394.378 3.306 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000172109041 1425898100 /nfs/dbraw/zinc/89/81/00/1425898100.db2.gz XVCSJNDULSZUCF-UHFFFAOYSA-N 0 0 391.449 3.112 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000172115793 1425901073 /nfs/dbraw/zinc/90/10/73/1425901073.db2.gz BTVWJTBDWZTZFB-LBPRGKRZSA-N 0 0 397.859 3.164 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000172117103 1425902108 /nfs/dbraw/zinc/90/21/08/1425902108.db2.gz XJYJJQGOQOPPKY-AUUYWEPGSA-N 0 0 387.436 3.476 20 5 GGBDRN Cc1ccc2nc(CSCC(=O)N(C)Cc3ccccc3[N+](=O)[O-])cn2c1 ZINC000172129746 1425908261 /nfs/dbraw/zinc/90/82/61/1425908261.db2.gz XFBFJZHCDFFFOU-UHFFFAOYSA-N 0 0 384.461 3.443 20 5 GGBDRN O=C(NCCc1ccc2c(c1)CCO2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000172149572 1425920947 /nfs/dbraw/zinc/92/09/47/1425920947.db2.gz JTGWJCPZEFGGTJ-UHFFFAOYSA-N 0 0 381.432 3.102 20 5 GGBDRN CN(C)[C@@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000172158795 1425926028 /nfs/dbraw/zinc/92/60/28/1425926028.db2.gz FBEZVNIKLMJYIO-KRWDZBQOSA-N 0 0 392.406 3.317 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3cc([N+](=O)[O-])ccc3Cl)CC2)c1 ZINC000172174836 1425933725 /nfs/dbraw/zinc/93/37/25/1425933725.db2.gz MXJMRCGOMYELPG-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN COc1ccc(OC)c2c1CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]2O ZINC000172175207 1425933970 /nfs/dbraw/zinc/93/39/70/1425933970.db2.gz RNESWGGWQICOMN-HNNXBMFYSA-N 0 0 378.812 3.315 20 5 GGBDRN O=C(c1c(F)cccc1F)N1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172178499 1425935777 /nfs/dbraw/zinc/93/57/77/1425935777.db2.gz QWYUBEUAKKWFTQ-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN CC(C)OCCCNC(=O)C1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172178535 1425935812 /nfs/dbraw/zinc/93/58/12/1425935812.db2.gz NMLJJEUYAPXVBP-UHFFFAOYSA-N 0 0 397.903 3.392 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc(N3CCCC3)c(F)c2)ccc1[N+](=O)[O-] ZINC000172183071 1425937555 /nfs/dbraw/zinc/93/75/55/1425937555.db2.gz OGEMRUTYGQXRFR-UHFFFAOYSA-N 0 0 379.413 3.443 20 5 GGBDRN O=C([C@H]1C[C@@H]1c1c(F)cccc1F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000172217563 1425951661 /nfs/dbraw/zinc/95/16/61/1425951661.db2.gz YIQUSVKTWPGVSU-HOTGVXAUSA-N 0 0 387.386 3.325 20 5 GGBDRN Cc1ccc(N2CCCC2)c(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000172223219 1425953303 /nfs/dbraw/zinc/95/33/03/1425953303.db2.gz XISAJPWTMTVISX-UHFFFAOYSA-N 0 0 394.475 3.466 20 5 GGBDRN COc1cc(CCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1O ZINC000172231805 1425957804 /nfs/dbraw/zinc/95/78/04/1425957804.db2.gz NAUBAIAVLQKLMY-UHFFFAOYSA-N 0 0 387.436 3.472 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(CS(=O)(=O)Cc2nc(-c3ccccc3)no2)c1 ZINC000172237498 1425959862 /nfs/dbraw/zinc/95/98/62/1425959862.db2.gz AQEDPPRVRLUCPW-UHFFFAOYSA-N 0 0 393.808 3.413 20 5 GGBDRN Cc1nn(C)c(Cl)c1CS(=O)(=O)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172237706 1425960374 /nfs/dbraw/zinc/96/03/74/1425960374.db2.gz AMCCCSWSDKBVDB-UHFFFAOYSA-N 0 0 378.237 3.059 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1csc([N+](=O)[O-])c1 ZINC000172243334 1425962743 /nfs/dbraw/zinc/96/27/43/1425962743.db2.gz WQFSIEZPBVFHLA-LLVKDONJSA-N 0 0 383.376 3.266 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](OCc2ccncc2)C1 ZINC000172247107 1425965160 /nfs/dbraw/zinc/96/51/60/1425965160.db2.gz FOWIDLFDDLZOOX-PBHICJAKSA-N 0 0 387.461 3.288 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 ZINC000172254816 1425970258 /nfs/dbraw/zinc/97/02/58/1425970258.db2.gz AXZBRWVLKJUIPH-HHHXNRCGSA-N 0 0 390.465 3.011 20 5 GGBDRN COc1ccc(CN2CC[C@@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2=O)cc1 ZINC000172281302 1425978443 /nfs/dbraw/zinc/97/84/43/1425978443.db2.gz FZPGJZOTTBIYGA-LJQANCHMSA-N 0 0 392.415 3.365 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N[C@@H]1C[C@H]2CC[C@@H]1O2 ZINC000172280112 1425978520 /nfs/dbraw/zinc/97/85/20/1425978520.db2.gz BHQYYLJAOAAEOT-QBIMZIAESA-N 0 0 389.433 3.127 20 5 GGBDRN COc1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])c4cnccc34)C2=O)cc1 ZINC000172280846 1425978682 /nfs/dbraw/zinc/97/86/82/1425978682.db2.gz YMCLERFUGMJUKR-IBGZPJMESA-N 0 0 392.415 3.365 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc(-n3ccnc3)c(F)c2)ccc1[N+](=O)[O-] ZINC000172315842 1425993613 /nfs/dbraw/zinc/99/36/13/1425993613.db2.gz GNUDAOGPCPHZSM-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN O=C(COc1cccc2ccccc21)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172333242 1426003735 /nfs/dbraw/zinc/00/37/35/1426003735.db2.gz PHXVQKYDEMFICV-INIZCTEOSA-N 0 0 392.415 3.235 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCCCC[C@H]1c1ccco1 ZINC000172348200 1426010660 /nfs/dbraw/zinc/01/06/60/1426010660.db2.gz LGHBSGNLNQAKDT-HNNXBMFYSA-N 0 0 387.392 3.279 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172349590 1426011329 /nfs/dbraw/zinc/01/13/29/1426011329.db2.gz YOSUMVRIPGJCQY-QAPCUYQASA-N 0 0 386.452 3.352 20 5 GGBDRN Cn1ccnc1SCc1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])o1 ZINC000172360552 1426014059 /nfs/dbraw/zinc/01/40/59/1426014059.db2.gz WWTBSJFGQRPCAV-UHFFFAOYSA-N 0 0 384.417 3.417 20 5 GGBDRN Cn1c(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2cc(Cl)ccc21 ZINC000172358455 1426014106 /nfs/dbraw/zinc/01/41/06/1426014106.db2.gz KKEWIIAMGZQULZ-ZDUSSCGKSA-N 0 0 386.843 3.216 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cnc(Cl)c(Cl)c1 ZINC000172356598 1426014353 /nfs/dbraw/zinc/01/43/53/1426014353.db2.gz VCRDATHOFUYREW-UHFFFAOYSA-N 0 0 376.221 3.117 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1[N+](=O)[O-] ZINC000172363303 1426014487 /nfs/dbraw/zinc/01/44/87/1426014487.db2.gz MLGOMGQBXRJUKH-UHFFFAOYSA-N 0 0 394.771 3.365 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCN(C/C=C/c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000172361294 1426014653 /nfs/dbraw/zinc/01/46/53/1426014653.db2.gz STEIUKOIBMOGSA-RMKNXTFCSA-N 0 0 396.447 3.002 20 5 GGBDRN O=C([C@H]1CCN(c2ccc(Cl)cc2)C1=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172361590 1426014786 /nfs/dbraw/zinc/01/47/86/1426014786.db2.gz XRRHWZYTOHYNTA-HNNXBMFYSA-N 0 0 385.807 3.190 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2ccc(Cn3cccn3)cc2)c1[N+](=O)[O-] ZINC000172363983 1426015594 /nfs/dbraw/zinc/01/55/94/1426015594.db2.gz QJJBCOACOXURAC-UHFFFAOYSA-N 0 0 381.392 3.023 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCC[C@H]1NC(=O)OC(C)(C)C ZINC000172376467 1426018621 /nfs/dbraw/zinc/01/86/21/1426018621.db2.gz WZONVCWJLPHSPX-HUUCEWRRSA-N 0 0 377.441 3.247 20 5 GGBDRN O=C(Cc1csc(-c2ccoc2)n1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000172380871 1426020251 /nfs/dbraw/zinc/02/02/51/1426020251.db2.gz PPILHXPROREWSG-UHFFFAOYSA-N 0 0 398.444 3.203 20 5 GGBDRN C[C@H](NC(=O)[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000172384281 1426021639 /nfs/dbraw/zinc/02/16/39/1426021639.db2.gz WTZDVDXKBGKSCR-MAZHCROVSA-N 0 0 377.441 3.465 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cn(-c2cccc(C(F)(F)F)c2)nn1 ZINC000172385589 1426022327 /nfs/dbraw/zinc/02/23/27/1426022327.db2.gz OGDVEGSYFKNUBH-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN Cn1ccc2ccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)cc21 ZINC000172391929 1426024631 /nfs/dbraw/zinc/02/46/31/1426024631.db2.gz MKQJMPZHSXKZQD-UHFFFAOYSA-N 0 0 394.387 3.413 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172409644 1426029883 /nfs/dbraw/zinc/02/98/83/1426029883.db2.gz NNTWWJCBNDSCEY-GXTWGEPZSA-N 0 0 375.425 3.177 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1CC(c2c(F)cccc2F)=NO1 ZINC000172409919 1426029921 /nfs/dbraw/zinc/02/99/21/1426029921.db2.gz JMTBBAHKTGUQTA-AWEZNQCLSA-N 0 0 383.257 3.283 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(CN2CCCC2=O)cc1 ZINC000172413979 1426031364 /nfs/dbraw/zinc/03/13/64/1426031364.db2.gz NDYAOPVPBKCSQT-UHFFFAOYSA-N 0 0 395.459 3.470 20 5 GGBDRN Cc1ccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1S(C)(=O)=O ZINC000172414607 1426031725 /nfs/dbraw/zinc/03/17/25/1426031725.db2.gz AMPJGAOLVFOEHM-UHFFFAOYSA-N 0 0 390.461 3.059 20 5 GGBDRN C[C@H](NC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1)c1cccc([N+](=O)[O-])c1 ZINC000172414805 1426031821 /nfs/dbraw/zinc/03/18/21/1426031821.db2.gz CMSBVHPASZASFZ-QFYYESIMSA-N 0 0 375.331 3.243 20 5 GGBDRN CCOc1cn(-c2ccccc2)nc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172421433 1426035771 /nfs/dbraw/zinc/03/57/71/1426035771.db2.gz MSIPINFOEXCBID-UHFFFAOYSA-N 0 0 378.388 3.382 20 5 GGBDRN C[C@H](c1ccccc1)N1C[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])CC1=O ZINC000172422940 1426037072 /nfs/dbraw/zinc/03/70/72/1426037072.db2.gz PSNLOHQVUOTFCM-ZBFHGGJFSA-N 0 0 379.416 3.094 20 5 GGBDRN CCCCN1C(=O)c2ccc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])cc2C1=O ZINC000172423004 1426037719 /nfs/dbraw/zinc/03/77/19/1426037719.db2.gz LGTPNLDTWLRCPV-UHFFFAOYSA-N 0 0 393.399 3.194 20 5 GGBDRN CC(C)NC(=O)CSc1ccccc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172423700 1426037942 /nfs/dbraw/zinc/03/79/42/1426037942.db2.gz VXNZQXKVVHFSNX-UHFFFAOYSA-N 0 0 399.472 3.414 20 5 GGBDRN O=C([C@H]1CC(=O)N(c2ccccc2Cl)C1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424369 1426038509 /nfs/dbraw/zinc/03/85/09/1426038509.db2.gz FOKAYADJAXLROC-LBPRGKRZSA-N 0 0 385.807 3.190 20 5 GGBDRN CCOc1ccccc1[C@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])NC(C)=O ZINC000172424597 1426038585 /nfs/dbraw/zinc/03/85/85/1426038585.db2.gz NRRFBKNYVXZXDN-KRWDZBQOSA-N 0 0 397.431 3.150 20 5 GGBDRN Cc1nc(COc2ccccc2C(=O)N2CCc3c2cccc3[N+](=O)[O-])no1 ZINC000172424249 1426038683 /nfs/dbraw/zinc/03/86/83/1426038683.db2.gz GGQAKMWRDHBSDI-UHFFFAOYSA-N 0 0 380.360 3.068 20 5 GGBDRN O=C(CCNC(=O)c1ccc2ccccc2c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172425608 1426039002 /nfs/dbraw/zinc/03/90/02/1426039002.db2.gz VYPAYLAGDCGJHD-UHFFFAOYSA-N 0 0 389.411 3.457 20 5 GGBDRN O=C(c1ccccc1)N1CCC[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000172425258 1426039210 /nfs/dbraw/zinc/03/92/10/1426039210.db2.gz YUFLSUGYILNHIV-MRXNPFEDSA-N 0 0 379.416 3.036 20 5 GGBDRN C[C@@H]1CN(c2ccc(C(=O)N3CCCc4ccc([N+](=O)[O-])cc43)cn2)C[C@H](C)O1 ZINC000172425567 1426039529 /nfs/dbraw/zinc/03/95/29/1426039529.db2.gz KRAWDMRZOKLTCJ-GASCZTMLSA-N 0 0 396.447 3.196 20 5 GGBDRN CCOc1cc(C(=O)N2CCCN(C)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000172427356 1426040862 /nfs/dbraw/zinc/04/08/62/1426040862.db2.gz ZNGZMTDEONRJRU-UHFFFAOYSA-N 0 0 385.420 3.489 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCCN(C)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000172431700 1426041413 /nfs/dbraw/zinc/04/14/13/1426041413.db2.gz QTEQMWKHFNFWPN-UHFFFAOYSA-N 0 0 383.404 3.258 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000172434164 1426042351 /nfs/dbraw/zinc/04/23/51/1426042351.db2.gz RUVUKKPWKYNWNV-UHFFFAOYSA-N 0 0 399.451 3.195 20 5 GGBDRN C[C@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2 ZINC000172441059 1426043419 /nfs/dbraw/zinc/04/34/19/1426043419.db2.gz CIYNCYVNZLYHAJ-AWEZNQCLSA-N 0 0 396.447 3.473 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)Nc1nc2c(s1)COCC2 ZINC000172454191 1426046678 /nfs/dbraw/zinc/04/66/78/1426046678.db2.gz PASJGNFRBAZVGG-UHFFFAOYSA-N 0 0 376.438 3.268 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2csc(-c3cnccn3)n2)c([N+](=O)[O-])c1 ZINC000172478546 1426054378 /nfs/dbraw/zinc/05/43/78/1426054378.db2.gz TUEWBWVVOVAOLQ-UHFFFAOYSA-N 0 0 398.448 3.049 20 5 GGBDRN Cc1cccc2nc(CNC(=O)NCCCCc3ccc([N+](=O)[O-])cc3)cn21 ZINC000172489374 1426057608 /nfs/dbraw/zinc/05/76/08/1426057608.db2.gz YSLHFTVVUYHFOH-UHFFFAOYSA-N 0 0 381.436 3.373 20 5 GGBDRN COc1ccc(CN(C)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1O ZINC000172497315 1426059620 /nfs/dbraw/zinc/05/96/20/1426059620.db2.gz YKSNAOODZJWANB-UHFFFAOYSA-N 0 0 387.436 3.473 20 5 GGBDRN NC(=O)c1ccc(N2CCCC2)c(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000172506213 1426062883 /nfs/dbraw/zinc/06/28/83/1426062883.db2.gz BZXDYSDUTZWODS-UHFFFAOYSA-N 0 0 388.811 3.200 20 5 GGBDRN Cc1ncc(CN(C)C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])s1 ZINC000172515702 1426067216 /nfs/dbraw/zinc/06/72/16/1426067216.db2.gz SHRJFVNGLIAPLH-UHFFFAOYSA-N 0 0 377.470 3.312 20 5 GGBDRN CCOc1cccc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000172522534 1426070167 /nfs/dbraw/zinc/07/01/67/1426070167.db2.gz JLWDQHJPPXTYLC-UHFFFAOYSA-N 0 0 385.420 3.071 20 5 GGBDRN CCCc1nc(C)c(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000172534836 1426075776 /nfs/dbraw/zinc/07/57/76/1426075776.db2.gz SNXLIVVYSWTMRM-LBPRGKRZSA-N 0 0 375.454 3.034 20 5 GGBDRN CCCn1ccc2cc(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3)ccc21 ZINC000172549893 1426082948 /nfs/dbraw/zinc/08/29/48/1426082948.db2.gz WJCNTOPPVDMAKE-UHFFFAOYSA-N 0 0 380.404 3.214 20 5 GGBDRN CCCn1ccc2cc(NC(=O)C(=O)NCc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000172549165 1426083000 /nfs/dbraw/zinc/08/30/00/1426083000.db2.gz NBNDTNJAQRWAHQ-UHFFFAOYSA-N 0 0 380.404 3.214 20 5 GGBDRN O=C(/C=C/Sc1ccccc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000172559789 1426087551 /nfs/dbraw/zinc/08/75/51/1426087551.db2.gz DCNJKRPOCCQFTB-XNTDXEJSSA-N 0 0 397.456 3.185 20 5 GGBDRN CCCC(=O)N1CCC[C@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172573123 1426092921 /nfs/dbraw/zinc/09/29/21/1426092921.db2.gz SQYYPTNAQXHFHS-KRWDZBQOSA-N 0 0 375.469 3.072 20 5 GGBDRN C[C@H](NC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000172572937 1426093172 /nfs/dbraw/zinc/09/31/72/1426093172.db2.gz XGGOJIBADJGJFZ-NSHDSACASA-N 0 0 398.387 3.011 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)ccc1C(=O)N(C)C ZINC000172585115 1426099588 /nfs/dbraw/zinc/09/95/88/1426099588.db2.gz PTXBAWXWOTWXTP-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000172594757 1426104809 /nfs/dbraw/zinc/10/48/09/1426104809.db2.gz KCHAFEOFYWMQSM-DLBZAZTESA-N 0 0 384.432 3.383 20 5 GGBDRN Cc1ccc(NCCCNC(=O)C(=O)Nc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000172599864 1426107868 /nfs/dbraw/zinc/10/78/68/1426107868.db2.gz IBKBJJTVSCXSJT-UHFFFAOYSA-N 0 0 390.827 3.114 20 5 GGBDRN C[C@@](O)(CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000172629827 1426118765 /nfs/dbraw/zinc/11/87/65/1426118765.db2.gz XTHOCAVQTPATKM-GOSISDBHSA-N 0 0 377.466 3.186 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](CC(=O)OCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172629065 1426118845 /nfs/dbraw/zinc/11/88/45/1426118845.db2.gz 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Cc1cc(S(=O)(=O)N2CCCN(C)c3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000172678505 1426139798 /nfs/dbraw/zinc/13/97/98/1426139798.db2.gz TUGDQSDEZMWPKS-UHFFFAOYSA-N 0 0 379.413 3.078 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCOc2ccc(Cl)cc21 ZINC000172684597 1426141951 /nfs/dbraw/zinc/14/19/51/1426141951.db2.gz VEYXWVMQBOAWIM-UHFFFAOYSA-N 0 0 384.779 3.473 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](c1ccccc1)N1CCCCC1=O ZINC000172687830 1426143623 /nfs/dbraw/zinc/14/36/23/1426143623.db2.gz WWKWFYZETFKHKI-LJQANCHMSA-N 0 0 383.404 3.296 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1 ZINC000172688611 1426143716 /nfs/dbraw/zinc/14/37/16/1426143716.db2.gz FXFXZTLGIHPBJQ-MRXNPFEDSA-N 0 0 382.420 3.098 20 5 GGBDRN Cc1cc(C)c(OC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000172694219 1426146719 /nfs/dbraw/zinc/14/67/19/1426146719.db2.gz JKYHACWLZGUCIN-MRXNPFEDSA-N 0 0 383.404 3.064 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1c(Cl)cccc1Cl 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CQCOEFIXGGWONY-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN C[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)Oc1cccc(F)c1 ZINC000172747743 1426172339 /nfs/dbraw/zinc/17/23/39/1426172339.db2.gz ZGANSBFPIUDQFN-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN O=C([C@H](c1ccccc1)N1CCSCC1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172747019 1426172357 /nfs/dbraw/zinc/17/23/57/1426172357.db2.gz XNBNOYYVPQOCCQ-IBGZPJMESA-N 0 0 383.473 3.274 20 5 GGBDRN O=C1CCCN1C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccccc1 ZINC000172765571 1426177624 /nfs/dbraw/zinc/17/76/24/1426177624.db2.gz OSKKAMYUHNVYQT-GOSISDBHSA-N 0 0 394.431 3.255 20 5 GGBDRN COc1cc(CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c2ccccc2n1 ZINC000172768040 1426179047 /nfs/dbraw/zinc/17/90/47/1426179047.db2.gz USADSIKGISKDML-UHFFFAOYSA-N 0 0 396.359 3.298 20 5 GGBDRN O=C1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CCN1Cc1cccc(F)c1 ZINC000172770196 1426179934 /nfs/dbraw/zinc/17/99/34/1426179934.db2.gz APKFGSQKXYATEX-UHFFFAOYSA-N 0 0 395.337 3.184 20 5 GGBDRN O=C1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)CCN1Cc1cccc(F)c1 ZINC000172770273 1426179993 /nfs/dbraw/zinc/17/99/93/1426179993.db2.gz PAOZYBSOYPXDEP-UHFFFAOYSA-N 0 0 380.379 3.131 20 5 GGBDRN C[C@@H]1C[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C(=O)N1c1ccccc1 ZINC000172775931 1426182490 /nfs/dbraw/zinc/18/24/90/1426182490.db2.gz AQGPYUYPLBVYHB-SJKOYZFVSA-N 0 0 380.404 3.085 20 5 GGBDRN COc1ccccc1O[C@H](C)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000172778368 1426183958 /nfs/dbraw/zinc/18/39/58/1426183958.db2.gz RWJZYTNPEYGNIB-CYBMUJFWSA-N 0 0 385.420 3.375 20 5 GGBDRN COc1ccc(O[C@@H](C)CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000172778033 1426184013 /nfs/dbraw/zinc/18/40/13/1426184013.db2.gz MBNFAPRROAJUIS-ZDUSSCGKSA-N 0 0 385.420 3.375 20 5 GGBDRN CC(C)(C)OC(=O)CCCCCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000172787342 1426188138 /nfs/dbraw/zinc/18/81/38/1426188138.db2.gz JTBQXLJAUUVRAY-UHFFFAOYSA-N 0 0 376.413 3.145 20 5 GGBDRN CCCc1cc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n2ncnc2n1 ZINC000172787034 1426188287 /nfs/dbraw/zinc/18/82/87/1426188287.db2.gz MFMAFAGOQDBXQN-UHFFFAOYSA-N 0 0 382.424 3.033 20 5 GGBDRN C[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000172788417 1426188990 /nfs/dbraw/zinc/18/89/90/1426188990.db2.gz RFXCAHGLXHIBDB-XJKSGUPXSA-N 0 0 397.406 3.060 20 5 GGBDRN C[C@@H]1Cc2ccccc2CN1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000172791612 1426190609 /nfs/dbraw/zinc/19/06/09/1426190609.db2.gz UVKFYXUEVAVDTG-CQSZACIVSA-N 0 0 395.415 3.256 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000172796600 1426193522 /nfs/dbraw/zinc/19/35/22/1426193522.db2.gz XYERDPVAYCOWCY-VIFPVBQESA-N 0 0 382.367 3.364 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[C@@H](COCc2ccccc2)C1 ZINC000172806994 1426197634 /nfs/dbraw/zinc/19/76/34/1426197634.db2.gz SEWWBQFGSZEJNO-GOSISDBHSA-N 0 0 384.432 3.429 20 5 GGBDRN CCn1nc(C)c(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)c1C ZINC000172821164 1426204490 /nfs/dbraw/zinc/20/44/90/1426204490.db2.gz LMBFXABDMGIGBH-UHFFFAOYSA-N 0 0 378.454 3.309 20 5 GGBDRN CCc1cc(N(CCO)Cc2cccnc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000172820940 1426204642 /nfs/dbraw/zinc/20/46/42/1426204642.db2.gz YCQFJGBYIBMRCC-UHFFFAOYSA-N 0 0 379.420 3.008 20 5 GGBDRN COc1cc(CCNC(=O)c2cccc3ccc(C)nc32)c([N+](=O)[O-])cc1OC ZINC000172823447 1426205189 /nfs/dbraw/zinc/20/51/89/1426205189.db2.gz RNTWMFJESJXYRO-UHFFFAOYSA-N 0 0 395.415 3.441 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2NC(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000172824209 1426206150 /nfs/dbraw/zinc/20/61/50/1426206150.db2.gz ALRATPUAKFOYIT-HOTGVXAUSA-N 0 0 383.448 3.385 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1OC(F)F ZINC000172828984 1426207516 /nfs/dbraw/zinc/20/75/16/1426207516.db2.gz KUFKJZRUTHLMBU-SECBINFHSA-N 0 0 397.309 3.092 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1OC(F)F ZINC000172828981 1426207632 /nfs/dbraw/zinc/20/76/32/1426207632.db2.gz KUFKJZRUTHLMBU-VIFPVBQESA-N 0 0 397.309 3.092 20 5 GGBDRN C[C@@]1(C(=O)NCc2ccc([N+](=O)[O-])cc2)CCCN(C(=O)c2ccccc2)C1 ZINC000172846512 1426217187 /nfs/dbraw/zinc/21/71/87/1426217187.db2.gz XQOMGWGRVCZPCW-OAQYLSRUSA-N 0 0 381.432 3.154 20 5 GGBDRN Cn1ccc(N2CCC[C@H](NC(=O)c3cc4ccccc4c4cccnc34)C2=O)n1 ZINC000172847736 1426217765 /nfs/dbraw/zinc/21/77/65/1426217765.db2.gz SRURIFXAULDWCL-IBGZPJMESA-N 0 0 399.454 3.047 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000172851582 1426219390 /nfs/dbraw/zinc/21/93/90/1426219390.db2.gz USDXWBUYCXACDK-UHFFFAOYSA-N 0 0 379.438 3.201 20 5 GGBDRN Cc1cc(C)cc(C[C@H](C)NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000172851098 1426219757 /nfs/dbraw/zinc/21/97/57/1426219757.db2.gz BUXGFDGUDQJUOC-HOTGVXAUSA-N 0 0 383.448 3.077 20 5 GGBDRN O=C(CNc1ccc(Cl)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000172850806 1426219881 /nfs/dbraw/zinc/21/98/81/1426219881.db2.gz NKHFHXSJHKJOTR-KRWDZBQOSA-N 0 0 393.802 3.399 20 5 GGBDRN 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1426244222 /nfs/dbraw/zinc/24/42/22/1426244222.db2.gz PWXQZUTWFRCKBN-UHFFFAOYSA-N 0 0 383.383 3.368 20 5 GGBDRN COC(=O)c1cccc2c1CCCN2Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172896502 1426244609 /nfs/dbraw/zinc/24/46/09/1426244609.db2.gz JOANCEHNMAFRGD-UHFFFAOYSA-N 0 0 393.403 3.050 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1ccc(C(=O)Nc2ccncc2)cc1 ZINC000172901289 1426247938 /nfs/dbraw/zinc/24/79/38/1426247938.db2.gz YJAGTPSATBLFCU-UHFFFAOYSA-N 0 0 390.399 3.101 20 5 GGBDRN O=C(c1cccc(NCc2cc(F)ccc2[N+](=O)[O-])c1)N1CCC[C@H](CO)C1 ZINC000172900890 1426248017 /nfs/dbraw/zinc/24/80/17/1426248017.db2.gz PNTBLUGAPCMFHQ-AWEZNQCLSA-N 0 0 387.411 3.191 20 5 GGBDRN COc1ccccc1O[C@H](C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172909584 1426254426 /nfs/dbraw/zinc/25/44/26/1426254426.db2.gz IIGSLRXCJJOOTJ-GFCCVEGCSA-N 0 0 378.812 3.383 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000172909868 1426254634 /nfs/dbraw/zinc/25/46/34/1426254634.db2.gz 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Cc1ccc([N+](=O)[O-])c(C(=O)Oc2ccc(NC(=O)c3cnn(C)c3)cc2)c1 ZINC000172995607 1426300826 /nfs/dbraw/zinc/30/08/26/1426300826.db2.gz HPVDKMVUHYPHPA-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN CC(C)Nc1cc(F)ccc1NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000172998878 1426302151 /nfs/dbraw/zinc/30/21/51/1426302151.db2.gz JLTYBBKOFGUXLL-GFCCVEGCSA-N 0 0 388.399 3.311 20 5 GGBDRN CC(C)Nc1cc(F)ccc1NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000172998885 1426302168 /nfs/dbraw/zinc/30/21/68/1426302168.db2.gz JLTYBBKOFGUXLL-LBPRGKRZSA-N 0 0 388.399 3.311 20 5 GGBDRN CC(C)OC(=O)[C@@H](C)CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000173003507 1426304730 /nfs/dbraw/zinc/30/47/30/1426304730.db2.gz BEBPBPNSGQKTFQ-NSHDSACASA-N 0 0 377.422 3.036 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000173005758 1426305204 /nfs/dbraw/zinc/30/52/04/1426305204.db2.gz LIDIQWIKHSPKGQ-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000173006395 1426305244 /nfs/dbraw/zinc/30/52/44/1426305244.db2.gz FCQWCXPZUMLLDN-UHFFFAOYSA-N 0 0 386.795 3.200 20 5 GGBDRN COc1ccc(C(=O)C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000173007359 1426306035 /nfs/dbraw/zinc/30/60/35/1426306035.db2.gz GJUURFCBTSGOMJ-UHFFFAOYSA-N 0 0 382.416 3.267 20 5 GGBDRN CCC(CC)(CNC(=O)OC(C)(C)C)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173018008 1426309473 /nfs/dbraw/zinc/30/94/73/1426309473.db2.gz NNGSWWKFQLSXNO-UHFFFAOYSA-N 0 0 379.457 3.337 20 5 GGBDRN CN(CC(=O)N1CCC[C@@H]1c1cccc2c1OCCO2)c1ccccc1[N+](=O)[O-] ZINC000173024718 1426312960 /nfs/dbraw/zinc/31/29/60/1426312960.db2.gz XDUKQVUXHWSAGU-MRXNPFEDSA-N 0 0 397.431 3.166 20 5 GGBDRN CC(C)[C@@](C)(CNC(=O)OC(C)(C)C)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173037529 1426318018 /nfs/dbraw/zinc/31/80/18/1426318018.db2.gz PQYDYDVSEPBRQG-LJQANCHMSA-N 0 0 379.457 3.193 20 5 GGBDRN O=C([C@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000173036919 1426318167 /nfs/dbraw/zinc/31/81/67/1426318167.db2.gz SCCJVAPCZSJQCK-INIZCTEOSA-N 0 0 385.807 3.190 20 5 GGBDRN COc1cccc2c1OC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 ZINC000173050758 1426323513 /nfs/dbraw/zinc/32/35/13/1426323513.db2.gz UJOQYHCBGLPLHM-GFCCVEGCSA-N 0 0 396.321 3.356 20 5 GGBDRN Cc1cccc(N(C)C(=O)c2ccc(I)c([N+](=O)[O-])c2)n1 ZINC000173052395 1426324230 /nfs/dbraw/zinc/32/42/30/1426324230.db2.gz IFXIMDDROWMMHV-UHFFFAOYSA-N 0 0 397.172 3.179 20 5 GGBDRN CCc1cnc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000173055899 1426325327 /nfs/dbraw/zinc/32/53/27/1426325327.db2.gz QAEHFMCLSCNVEH-OAHLLOKOSA-N 0 0 388.449 3.165 20 5 GGBDRN O=C([C@H]1SCCc2sccc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000173062833 1426327189 /nfs/dbraw/zinc/32/71/89/1426327189.db2.gz GJJPKJBPWAQNDM-KRWDZBQOSA-N 0 0 389.502 3.336 20 5 GGBDRN Cc1sc(NC(=O)Cn2ccc([N+](=O)[O-])n2)nc1-c1ccc2c(c1)CCC2 ZINC000173061888 1426327307 /nfs/dbraw/zinc/32/73/07/1426327307.db2.gz JJIZJEHWAOBOPZ-UHFFFAOYSA-N 0 0 383.433 3.351 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173062251 1426327384 /nfs/dbraw/zinc/32/73/84/1426327384.db2.gz MMVZLBVEWOKDOU-UHFFFAOYSA-N 0 0 383.316 3.444 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173063890 1426327944 /nfs/dbraw/zinc/32/79/44/1426327944.db2.gz QSBYNHRVTMXPOK-GOSISDBHSA-N 0 0 397.431 3.084 20 5 GGBDRN O=C([C@H]1SCCc2sccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000173072350 1426330947 /nfs/dbraw/zinc/33/09/47/1426330947.db2.gz CWDCBVBATFTVIX-KRWDZBQOSA-N 0 0 389.502 3.336 20 5 GGBDRN Cc1c(C(=O)Nc2cc(-c3ccccc3)on2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000173070717 1426331045 /nfs/dbraw/zinc/33/10/45/1426331045.db2.gz YAASDMVAUCIQAO-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173073704 1426331643 /nfs/dbraw/zinc/33/16/43/1426331643.db2.gz WWRQOQBRGMQKNJ-UHFFFAOYSA-N 0 0 379.363 3.291 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CCCNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173077197 1426332955 /nfs/dbraw/zinc/33/29/55/1426332955.db2.gz RLFBOJFNTOPXEA-UHFFFAOYSA-N 0 0 378.432 3.380 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCN(c2nc3ccccc3s2)CC1 ZINC000173079234 1426333882 /nfs/dbraw/zinc/33/38/82/1426333882.db2.gz FYWOWXIDZATKTQ-UHFFFAOYSA-N 0 0 382.445 3.096 20 5 GGBDRN C[C@]1(C(=O)N2CCc3c2cccc3[N+](=O)[O-])CCCN(C(=O)c2ccccc2)C1 ZINC000173080917 1426334558 /nfs/dbraw/zinc/33/45/58/1426334558.db2.gz BUPNVMVRURRRBE-QFIPXVFZSA-N 0 0 393.443 3.426 20 5 GGBDRN CN(CC(=O)NCCc1nc(C(C)(C)C)cs1)c1ccccc1[N+](=O)[O-] ZINC000173083457 1426334833 /nfs/dbraw/zinc/33/48/33/1426334833.db2.gz SEJYDNDFGSBVEU-UHFFFAOYSA-N 0 0 376.482 3.144 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000173090747 1426338474 /nfs/dbraw/zinc/33/84/74/1426338474.db2.gz ONKRGJYZABQSCF-JTQLQIEISA-N 0 0 384.348 3.046 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000173093172 1426338840 /nfs/dbraw/zinc/33/88/40/1426338840.db2.gz MPKSWDHQLXDTAH-JTQLQIEISA-N 0 0 384.348 3.046 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2C(=O)Cc2cccc([N+](=O)[O-])c2)o1 ZINC000173101217 1426342041 /nfs/dbraw/zinc/34/20/41/1426342041.db2.gz BLSIVHLWNFXOOF-SFHVURJKSA-N 0 0 378.388 3.155 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)c(C)c1[N+](=O)[O-] ZINC000173103689 1426343269 /nfs/dbraw/zinc/34/32/69/1426343269.db2.gz AYNGIACIVQERCH-QGZVFWFLSA-N 0 0 376.432 3.321 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc21 ZINC000173111636 1426347887 /nfs/dbraw/zinc/34/78/87/1426347887.db2.gz WYWKSXXVKDQFJV-UHFFFAOYSA-N 0 0 386.795 3.201 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173114169 1426349662 /nfs/dbraw/zinc/34/96/62/1426349662.db2.gz PWIXFJVYLGIZQY-UHFFFAOYSA-N 0 0 393.447 3.150 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000173120445 1426351721 /nfs/dbraw/zinc/35/17/21/1426351721.db2.gz VWJKIPMEGOFWJU-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN Cc1c(C(=O)NCc2cccc(N3CC=CC3)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000173133821 1426356721 /nfs/dbraw/zinc/35/67/21/1426356721.db2.gz RMQQPJJKOKNVTI-UHFFFAOYSA-N 0 0 382.376 3.118 20 5 GGBDRN C[S@](=O)C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000173134340 1426357048 /nfs/dbraw/zinc/35/70/48/1426357048.db2.gz SVNFXZVWSWLSOT-CLYVBNDRSA-N 0 0 389.477 3.023 20 5 GGBDRN CNC(=O)c1ccc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173135044 1426357996 /nfs/dbraw/zinc/35/79/96/1426357996.db2.gz CQXLCNDMIJQWOK-UHFFFAOYSA-N 0 0 395.337 3.245 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C[S@](C)=O)c1ccccc1 ZINC000173137999 1426360192 /nfs/dbraw/zinc/36/01/92/1426360192.db2.gz NBRONZHPMMCBFI-ZOXZPVQOSA-N 0 0 392.502 3.311 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000173142591 1426362669 /nfs/dbraw/zinc/36/26/69/1426362669.db2.gz CHLUAKAHIOOVKE-SJKOYZFVSA-N 0 0 387.823 3.479 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173143431 1426363111 /nfs/dbraw/zinc/36/31/11/1426363111.db2.gz NWCQRGVWSYLLKG-KRWDZBQOSA-N 0 0 392.415 3.391 20 5 GGBDRN CCCCCC[C@H](C)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000173150294 1426366411 /nfs/dbraw/zinc/36/64/11/1426366411.db2.gz YQEGTIXTQRBMPB-INIZCTEOSA-N 0 0 375.469 3.486 20 5 GGBDRN COCCOC[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000173152710 1426367576 /nfs/dbraw/zinc/36/75/76/1426367576.db2.gz JRAKWHFOEPDTHT-INIZCTEOSA-N 0 0 399.447 3.464 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1cccc(NC(=O)N2CCCC2)c1 ZINC000173169167 1426374664 /nfs/dbraw/zinc/37/46/64/1426374664.db2.gz YNMCLXJSFZPRRF-UHFFFAOYSA-N 0 0 382.420 3.081 20 5 GGBDRN CN(C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)c1cnn(C)c1 ZINC000173173680 1426377312 /nfs/dbraw/zinc/37/73/12/1426377312.db2.gz OHAALTBAVBEBDP-UHFFFAOYSA-N 0 0 395.206 3.097 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)on1 ZINC000173180264 1426380079 /nfs/dbraw/zinc/38/00/79/1426380079.db2.gz FMIBSWPGLZZKAI-UHFFFAOYSA-N 0 0 394.815 3.395 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)on1 ZINC000173180204 1426380240 /nfs/dbraw/zinc/38/02/40/1426380240.db2.gz IRKZHAXIDVPKQH-UHFFFAOYSA-N 0 0 394.815 3.395 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cn(Cc2cccs2)nn1 ZINC000173186808 1426383012 /nfs/dbraw/zinc/38/30/12/1426383012.db2.gz UTVSUKHCWPRSLL-UHFFFAOYSA-N 0 0 391.840 3.222 20 5 GGBDRN NC(=O)c1c(Cl)cccc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000173188346 1426383596 /nfs/dbraw/zinc/38/35/96/1426383596.db2.gz JKLVBLYMPZKRTD-UHFFFAOYSA-N 0 0 398.600 3.362 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cl)c1C(N)=O ZINC000173189058 1426383662 /nfs/dbraw/zinc/38/36/62/1426383662.db2.gz WNGZDENPWYWNGL-VIFPVBQESA-N 0 0 379.825 3.466 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3C)CC2)cc1 ZINC000173191075 1426384409 /nfs/dbraw/zinc/38/44/09/1426384409.db2.gz DDPAYUBHAINPPL-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000173192055 1426385128 /nfs/dbraw/zinc/38/51/28/1426385128.db2.gz QDGSQLZKADHSQO-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)c2cnn(C)c2)cc1[N+](=O)[O-])c1ccccn1 ZINC000173199642 1426389196 /nfs/dbraw/zinc/38/91/96/1426389196.db2.gz FAQKPGFNMWXNCC-ZDUSSCGKSA-N 0 0 380.408 3.173 20 5 GGBDRN CN(CC(=O)NCc1ccc(OCC(F)(F)F)cc1)c1ccccc1[N+](=O)[O-] ZINC000173210911 1426396672 /nfs/dbraw/zinc/39/66/72/1426396672.db2.gz YLJHVCISPFGQKS-UHFFFAOYSA-N 0 0 397.353 3.289 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)C1CCN(c3ccccc3[N+](=O)[O-])CC1)CCO2 ZINC000173218351 1426401043 /nfs/dbraw/zinc/40/10/43/1426401043.db2.gz WHAYDPYTCPTSPX-UHFFFAOYSA-N 0 0 397.431 3.245 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1F ZINC000173223562 1426407559 /nfs/dbraw/zinc/40/75/59/1426407559.db2.gz APGBJFITPBVNMZ-HHHXNRCGSA-N 0 0 391.424 3.324 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)s1 ZINC000173231100 1426416230 /nfs/dbraw/zinc/41/62/30/1426416230.db2.gz NEXBKKYTNOQBAA-LLVKDONJSA-N 0 0 399.494 3.312 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173233449 1426419748 /nfs/dbraw/zinc/41/97/48/1426419748.db2.gz AMSADDWXLZSANR-UHFFFAOYSA-N 0 0 383.452 3.451 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000173233307 1426419757 /nfs/dbraw/zinc/41/97/57/1426419757.db2.gz QYTRLXVAJUDDEF-WMLDXEAASA-N 0 0 397.431 3.194 20 5 GGBDRN O=C(Nc1nc2ccccc2s1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173238678 1426423746 /nfs/dbraw/zinc/42/37/46/1426423746.db2.gz KCCCTLCQUXMAKU-NSHDSACASA-N 0 0 384.421 3.318 20 5 GGBDRN CCc1ccc(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1[N+](=O)[O-] ZINC000173246431 1426427882 /nfs/dbraw/zinc/42/78/82/1426427882.db2.gz JSDRKNUCJZGUFW-UHFFFAOYSA-N 0 0 380.404 3.207 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000173254557 1426433695 /nfs/dbraw/zinc/43/36/95/1426433695.db2.gz CIFKXIFMDRSSIP-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN CC(C)CNC(=O)c1ccccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173262869 1426440882 /nfs/dbraw/zinc/44/08/82/1426440882.db2.gz PAQANIARJSGUKB-UHFFFAOYSA-N 0 0 384.436 3.056 20 5 GGBDRN CN(CC(=O)Nc1ccccc1C(=O)N1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000173272235 1426450202 /nfs/dbraw/zinc/45/02/02/1426450202.db2.gz FXOLIPQIHVJCFF-UHFFFAOYSA-N 0 0 396.447 3.296 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccccc2C(=O)NC[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000173274746 1426453664 /nfs/dbraw/zinc/45/36/64/1426453664.db2.gz MIXLRIOFUCOZHQ-MRXNPFEDSA-N 0 0 397.431 3.318 20 5 GGBDRN CCc1ccc(C(=O)N[C@H](c2nccn2C)c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000173277922 1426454840 /nfs/dbraw/zinc/45/48/40/1426454840.db2.gz MEQDQCXHSREFAS-IBGZPJMESA-N 0 0 394.431 3.419 20 5 GGBDRN CCSCC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000173283089 1426460862 /nfs/dbraw/zinc/46/08/62/1426460862.db2.gz WHAQTSVSNSWJEO-WMLDXEAASA-N 0 0 393.509 3.156 20 5 GGBDRN O=C(NCc1cc(Cl)ccc1OC(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000173291740 1426471438 /nfs/dbraw/zinc/47/14/38/1426471438.db2.gz TUFVMLSRDJFJMU-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN Cc1sc(C(=O)N2CCN(C(=O)Nc3ccc(C)cc3)CC2)cc1[N+](=O)[O-] ZINC000173298925 1426480138 /nfs/dbraw/zinc/48/01/38/1426480138.db2.gz UCZIGXAGSHJMHF-UHFFFAOYSA-N 0 0 388.449 3.263 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCC[C@@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000173301415 1426482997 /nfs/dbraw/zinc/48/29/97/1426482997.db2.gz IIKLTVLLVDXDRD-CQSZACIVSA-N 0 0 380.422 3.421 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCC[C@@H]2c2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000173302374 1426484556 /nfs/dbraw/zinc/48/45/56/1426484556.db2.gz MLNUBCWEWFWMJH-CQSZACIVSA-N 0 0 380.422 3.421 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCC[C@H]2c2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000173302360 1426484892 /nfs/dbraw/zinc/48/48/92/1426484892.db2.gz MLNUBCWEWFWMJH-AWEZNQCLSA-N 0 0 380.422 3.421 20 5 GGBDRN CCc1ccc(C(=O)NCc2cccc(CN3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000173304480 1426486168 /nfs/dbraw/zinc/48/61/68/1426486168.db2.gz ZRAFGRXCACQTCV-UHFFFAOYSA-N 0 0 381.432 3.210 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)nc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173319271 1426502186 /nfs/dbraw/zinc/50/21/86/1426502186.db2.gz DNXAXCZWIQZSAP-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN CN(CCc1cccs1)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000173322625 1426505139 /nfs/dbraw/zinc/50/51/39/1426505139.db2.gz XEHUDYNYERRPNX-ZDUSSCGKSA-N 0 0 393.490 3.024 20 5 GGBDRN CCC[C@H](C)c1cc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])n[nH]1 ZINC000173325159 1426507742 /nfs/dbraw/zinc/50/77/42/1426507742.db2.gz BYBIKLNMMGHMRR-JTQLQIEISA-N 0 0 393.831 3.243 20 5 GGBDRN Cc1cccc(O[C@H](C)CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000173330645 1426511188 /nfs/dbraw/zinc/51/11/88/1426511188.db2.gz BTTBDQARCXYRLT-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000173329920 1426511651 /nfs/dbraw/zinc/51/16/51/1426511651.db2.gz OTNXNUDOIOBKPU-CYBMUJFWSA-N 0 0 395.375 3.488 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(C)cc2OCC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000173340863 1426519788 /nfs/dbraw/zinc/51/97/88/1426519788.db2.gz GTYFTUUQHHCTOA-UHFFFAOYSA-N 0 0 385.420 3.185 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CN(Cc2ccccc2F)c2ccccc2F)c1 ZINC000173340223 1426520393 /nfs/dbraw/zinc/52/03/93/1426520393.db2.gz ILYHTPZMOPVIOF-MRXNPFEDSA-N 0 0 388.374 3.137 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(NC(=O)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000173342149 1426521125 /nfs/dbraw/zinc/52/11/25/1426521125.db2.gz NJNCAJPEVQAVCB-UHFFFAOYSA-N 0 0 387.461 3.253 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)CN(C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000173343051 1426522015 /nfs/dbraw/zinc/52/20/15/1426522015.db2.gz GPFHLJVMXSWDOV-UHFFFAOYSA-N 0 0 398.463 3.053 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2coc(-c3ccccc3)n2)c(Cl)c1 ZINC000173348954 1426526364 /nfs/dbraw/zinc/52/63/64/1426526364.db2.gz OWLOKSZIZOYQBK-UHFFFAOYSA-N 0 0 393.808 3.382 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000173384816 1426560384 /nfs/dbraw/zinc/56/03/84/1426560384.db2.gz OLNDKGXPERCCEM-AWEZNQCLSA-N 0 0 376.394 3.457 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)c2ccc(CC)c([N+](=O)[O-])c2)nc1C ZINC000173397153 1426578304 /nfs/dbraw/zinc/57/83/04/1426578304.db2.gz BANQQLFWUIKYLF-UHFFFAOYSA-N 0 0 377.422 3.375 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000173399456 1426581291 /nfs/dbraw/zinc/58/12/91/1426581291.db2.gz XUMPYVBAPJUWFK-INIZCTEOSA-N 0 0 383.433 3.427 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000173400065 1426583136 /nfs/dbraw/zinc/58/31/36/1426583136.db2.gz PJDMESZWBLIECY-LJQANCHMSA-N 0 0 381.432 3.053 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H](C)Oc1cccc(Cl)c1 ZINC000173404340 1426589352 /nfs/dbraw/zinc/58/93/52/1426589352.db2.gz LROPNPOMSWXUNJ-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C2CC2)n1 ZINC000173407827 1426591473 /nfs/dbraw/zinc/59/14/73/1426591473.db2.gz WRTRXQRYKHXPAO-INIZCTEOSA-N 0 0 398.448 3.130 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@H](C)Oc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000173414299 1426597024 /nfs/dbraw/zinc/59/70/24/1426597024.db2.gz JPFLINXHIFPSTQ-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN CN(CC(=O)Nc1cccc(Oc2cnccn2)c1)c1ccccc1[N+](=O)[O-] ZINC000173417048 1426600181 /nfs/dbraw/zinc/60/01/81/1426600181.db2.gz MPWKWLZQLNEPPD-UHFFFAOYSA-N 0 0 379.376 3.252 20 5 GGBDRN Cc1ccc(O[C@H](C)CNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000173422618 1426605129 /nfs/dbraw/zinc/60/51/29/1426605129.db2.gz LMNZETXXYKHUOV-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1 ZINC000173425566 1426607815 /nfs/dbraw/zinc/60/78/15/1426607815.db2.gz JLVDWCCDOJFCBL-PXAZEXFGSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)c1 ZINC000173428894 1426611052 /nfs/dbraw/zinc/61/10/52/1426611052.db2.gz AMMNIYBQGNJRTK-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN O=C(CCNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1 ZINC000173433089 1426614096 /nfs/dbraw/zinc/61/40/96/1426614096.db2.gz ORNPDNRKDGUCCI-UHFFFAOYSA-N 0 0 381.310 3.372 20 5 GGBDRN CCn1c(C)nn(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1=S ZINC000173434998 1426616292 /nfs/dbraw/zinc/61/62/92/1426616292.db2.gz COMAXCWLKHTNRN-UHFFFAOYSA-N 0 0 377.470 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cn3ncn(C4CC4)c3=S)CC2)cc1 ZINC000173435116 1426616377 /nfs/dbraw/zinc/61/63/77/1426616377.db2.gz HCKUJKJMGRPMGU-UHFFFAOYSA-N 0 0 375.454 3.158 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cn3ncc4cc([N+](=O)[O-])ccc43)CC2)cc1 ZINC000173435528 1426616691 /nfs/dbraw/zinc/61/66/91/1426616691.db2.gz NUHIJYCKVUUQPT-UHFFFAOYSA-N 0 0 397.391 3.354 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cn3nccc3-c3cccnc3)CC2)cc1 ZINC000173435726 1426617220 /nfs/dbraw/zinc/61/72/20/1426617220.db2.gz PZMGOVIWJPNJAI-UHFFFAOYSA-N 0 0 379.420 3.354 20 5 GGBDRN CCN(Cc1ccccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-])C(C)=O ZINC000173452480 1426631223 /nfs/dbraw/zinc/63/12/23/1426631223.db2.gz FCVOKRJNUOORGE-UHFFFAOYSA-N 0 0 384.436 3.038 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@H]2CCCO[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000173457325 1426633260 /nfs/dbraw/zinc/63/32/60/1426633260.db2.gz YSBNQDMGUGUQTL-BEFAXECRSA-N 0 0 386.452 3.477 20 5 GGBDRN C[C@H]1CN(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)[C@@H]1c1ccccc1 ZINC000173457527 1426634394 /nfs/dbraw/zinc/63/43/94/1426634394.db2.gz KOHNQFYEXYCRQX-BTYIYWSLSA-N 0 0 376.416 3.469 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000173462256 1426635879 /nfs/dbraw/zinc/63/58/79/1426635879.db2.gz KHRMCJISCHQWRK-LBPRGKRZSA-N 0 0 391.399 3.065 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H](C)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000173462834 1426636666 /nfs/dbraw/zinc/63/66/66/1426636666.db2.gz BBYYBOYVWAGNTM-CVEARBPZSA-N 0 0 383.452 3.120 20 5 GGBDRN C[C@@H](c1nc(-c2ccccc2)no1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173462689 1426636753 /nfs/dbraw/zinc/63/67/53/1426636753.db2.gz HHZARRLZJNXSBM-ZFWWWQNUSA-N 0 0 380.408 3.287 20 5 GGBDRN Cc1cccc(C)c1NC(=O)[C@@H](C)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173465827 1426639419 /nfs/dbraw/zinc/63/94/19/1426639419.db2.gz KGLAKKMNOMHJOR-CVEARBPZSA-N 0 0 383.452 3.120 20 5 GGBDRN Cc1sc(NC(=O)CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1C ZINC000173466374 1426641065 /nfs/dbraw/zinc/64/10/65/1426641065.db2.gz AJPWKUJTKAMBEF-UHFFFAOYSA-N 0 0 388.493 3.342 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3nc(CCc4ccccc4)no3)CC2)cc1 ZINC000173466394 1426641219 /nfs/dbraw/zinc/64/12/19/1426641219.db2.gz GDCAKMHRLXMLSX-UHFFFAOYSA-N 0 0 393.447 3.085 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3coc(-c4cccc(F)c4)n3)C2)nc1 ZINC000173472421 1426647621 /nfs/dbraw/zinc/64/76/21/1426647621.db2.gz CGLDLFVENYLUTE-HNNXBMFYSA-N 0 0 383.383 3.470 20 5 GGBDRN CCc1ccc(C(=O)N(c2ncc(C(=O)OC)s2)C2CC2)cc1[N+](=O)[O-] ZINC000173478715 1426652533 /nfs/dbraw/zinc/65/25/33/1426652533.db2.gz XLSNRXQLPBPLRG-UHFFFAOYSA-N 0 0 375.406 3.210 20 5 GGBDRN CN1CCCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c2cc(Cl)ccc21 ZINC000173480586 1426654101 /nfs/dbraw/zinc/65/41/01/1426654101.db2.gz QRFZNRVMQKKRCY-UHFFFAOYSA-N 0 0 395.868 3.425 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@H](OCc2ccncc2)C1 ZINC000173491767 1426663668 /nfs/dbraw/zinc/66/36/68/1426663668.db2.gz LBWLCIBHNYJCIK-AWEZNQCLSA-N 0 0 395.337 3.440 20 5 GGBDRN CCc1ccc(C(=O)N(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000173496583 1426666989 /nfs/dbraw/zinc/66/69/89/1426666989.db2.gz XYNNKWJPUBOZJZ-HNNXBMFYSA-N 0 0 377.441 3.239 20 5 GGBDRN CC[C@@]1(C)CCCN(C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)C1 ZINC000173496946 1426667195 /nfs/dbraw/zinc/66/71/95/1426667195.db2.gz YZIHKEVREVHAMB-FQEVSTJZSA-N 0 0 384.436 3.101 20 5 GGBDRN CC[C@]1(C)CCCN(C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)C1 ZINC000173496935 1426667256 /nfs/dbraw/zinc/66/72/56/1426667256.db2.gz YZIHKEVREVHAMB-HXUWFJFHSA-N 0 0 384.436 3.101 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@](C)(CC)c2nccs2)c([N+](=O)[O-])c1 ZINC000173506059 1426674746 /nfs/dbraw/zinc/67/47/46/1426674746.db2.gz YFEIIQGBXYKRAO-QGZVFWFLSA-N 0 0 378.454 3.304 20 5 GGBDRN Cc1ccnc(-c2ccc(NC(=O)CN(C)c3ccccc3[N+](=O)[O-])cc2)n1 ZINC000173506606 1426675913 /nfs/dbraw/zinc/67/59/13/1426675913.db2.gz IBGDFPHCZGJNHD-UHFFFAOYSA-N 0 0 377.404 3.435 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173507648 1426677076 /nfs/dbraw/zinc/67/70/76/1426677076.db2.gz NIEYGLLADNQTML-UHFFFAOYSA-N 0 0 395.337 3.293 20 5 GGBDRN CC(C)Nc1ccc(F)cc1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000173510956 1426679641 /nfs/dbraw/zinc/67/96/41/1426679641.db2.gz OSHOBSDSGNSSKC-UHFFFAOYSA-N 0 0 375.356 3.384 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@@H](C)Oc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000173514777 1426685807 /nfs/dbraw/zinc/68/58/07/1426685807.db2.gz WEWDBSGNTKMNRK-SECBINFHSA-N 0 0 375.312 3.378 20 5 GGBDRN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173515572 1426687337 /nfs/dbraw/zinc/68/73/37/1426687337.db2.gz MSOIAEBADFETAW-UHFFFAOYSA-N 0 0 382.420 3.327 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2ccc(F)cc2O1 ZINC000173524269 1426697780 /nfs/dbraw/zinc/69/77/80/1426697780.db2.gz JJJYSYLLCMXPNG-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN COc1ccc(OC(F)F)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000173529171 1426702991 /nfs/dbraw/zinc/70/29/91/1426702991.db2.gz KHRAONBFCOBDJO-UHFFFAOYSA-N 0 0 381.335 3.280 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)Oc3cc(F)ccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000173528934 1426703286 /nfs/dbraw/zinc/70/32/86/1426703286.db2.gz GZYNDUQLHNZJTC-LLVKDONJSA-N 0 0 397.366 3.051 20 5 GGBDRN O=C([C@H]1SCCc2sccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000173532055 1426706620 /nfs/dbraw/zinc/70/66/20/1426706620.db2.gz MFPLQSWRUGHYIK-KRWDZBQOSA-N 0 0 389.502 3.336 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccc(F)cc2O1 ZINC000173532987 1426708660 /nfs/dbraw/zinc/70/86/60/1426708660.db2.gz IZGGZOXMZCLVQK-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN C[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000173534491 1426709807 /nfs/dbraw/zinc/70/98/07/1426709807.db2.gz UHRUZYBLDXAASQ-AWEZNQCLSA-N 0 0 389.402 3.321 20 5 GGBDRN CN(CC1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)C(=O)OC(C)(C)C ZINC000173535998 1426711858 /nfs/dbraw/zinc/71/18/58/1426711858.db2.gz ATBWIMPQCSKUCY-UHFFFAOYSA-N 0 0 391.468 3.243 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2ccc(F)cc2O1 ZINC000173537139 1426712523 /nfs/dbraw/zinc/71/25/23/1426712523.db2.gz UAYARZTXXKPPGH-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN CCCC(=O)Nc1cccc(CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000173537034 1426712535 /nfs/dbraw/zinc/71/25/35/1426712535.db2.gz BORTYWGNIGCMSA-UHFFFAOYSA-N 0 0 384.436 3.086 20 5 GGBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000173540796 1426715876 /nfs/dbraw/zinc/71/58/76/1426715876.db2.gz BGDBNWYIGKPYTD-OAHLLOKOSA-N 0 0 379.756 3.274 20 5 GGBDRN Cc1ccccc1-c1cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)n(C)n1 ZINC000173543783 1426716656 /nfs/dbraw/zinc/71/66/56/1426716656.db2.gz KEYKAXXDHFYKJP-UHFFFAOYSA-N 0 0 376.376 3.432 20 5 GGBDRN Cc1nn(CCC(=O)N2CCCN(C)c3ccc(Cl)cc32)c(C)c1[N+](=O)[O-] ZINC000173547802 1426721387 /nfs/dbraw/zinc/72/13/87/1426721387.db2.gz GHTXOSDGKWBETR-UHFFFAOYSA-N 0 0 391.859 3.325 20 5 GGBDRN COc1cc(OCC(=O)Nc2cc(-c3ccccc3C)nn2C)ccc1[N+](=O)[O-] ZINC000173550904 1426723837 /nfs/dbraw/zinc/72/38/37/1426723837.db2.gz WUEXTNGUEKXWHL-UHFFFAOYSA-N 0 0 396.403 3.330 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000173556506 1426728649 /nfs/dbraw/zinc/72/86/49/1426728649.db2.gz FPMBOWGQTQWZRX-HNNXBMFYSA-N 0 0 398.463 3.332 20 5 GGBDRN O=C([C@@H]1SCCc2ccccc21)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560194 1426730064 /nfs/dbraw/zinc/73/00/64/1426730064.db2.gz LAUPPZURKZDRBU-RDTXWAMCSA-N 0 0 384.461 3.033 20 5 GGBDRN O=C([C@H]1SCCc2ccccc21)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560180 1426730098 /nfs/dbraw/zinc/73/00/98/1426730098.db2.gz LAUPPZURKZDRBU-KDOFPFPSSA-N 0 0 384.461 3.033 20 5 GGBDRN O=C([C@H]1SCCc2ccccc21)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560155 1426730246 /nfs/dbraw/zinc/73/02/46/1426730246.db2.gz LAUPPZURKZDRBU-KSSFIOAISA-N 0 0 384.461 3.033 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CC[C@H](CSc2ccccc2)C1 ZINC000173563672 1426733251 /nfs/dbraw/zinc/73/32/51/1426733251.db2.gz CVISFHZFWADGBH-AWEZNQCLSA-N 0 0 385.445 3.174 20 5 GGBDRN CC(C)(C)OC(=O)NCc1ccc(C(=O)NCc2ccccc2[N+](=O)[O-])o1 ZINC000173569824 1426737381 /nfs/dbraw/zinc/73/73/81/1426737381.db2.gz PNHWTYVFWCKAQK-UHFFFAOYSA-N 0 0 375.381 3.143 20 5 GGBDRN Cc1ccccc1[C@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@H](C)CO1 ZINC000173573864 1426741531 /nfs/dbraw/zinc/74/15/31/1426741531.db2.gz OECSYNSYLBDEHY-IIBYNOLFSA-N 0 0 395.459 3.254 20 5 GGBDRN COC(=O)c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1Cl ZINC000173575509 1426742751 /nfs/dbraw/zinc/74/27/51/1426742751.db2.gz DZTVINCOSIBUFX-UHFFFAOYSA-N 0 0 377.784 3.110 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]3CCC[C@@H]32)cc1Br ZINC000173584641 1426748635 /nfs/dbraw/zinc/74/86/35/1426748635.db2.gz RYCAOBJVNOLNPD-GWCFXTLKSA-N 0 0 389.271 3.311 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](C)CO1 ZINC000173594377 1426759006 /nfs/dbraw/zinc/75/90/06/1426759006.db2.gz CVMIHYPPDUBEDK-CXAGYDPISA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2cccc([N+](=O)[O-])c2C)[C@H](C)CO1 ZINC000173594338 1426759031 /nfs/dbraw/zinc/75/90/31/1426759031.db2.gz JZIADPJHRZDSSC-RDTXWAMCSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000173594248 1426759048 /nfs/dbraw/zinc/75/90/48/1426759048.db2.gz CJYPIRNBNJECHA-BEFAXECRSA-N 0 0 390.461 3.195 20 5 GGBDRN CN(CC(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccccc1[N+](=O)[O-] ZINC000173596453 1426761625 /nfs/dbraw/zinc/76/16/25/1426761625.db2.gz UOWXUPJLLIRYRL-KRWDZBQOSA-N 0 0 385.420 3.228 20 5 GGBDRN CC[C@]1(C)CCCN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000173596984 1426763429 /nfs/dbraw/zinc/76/34/29/1426763429.db2.gz GFSFUXNOYXEDJP-QGZVFWFLSA-N 0 0 385.367 3.173 20 5 GGBDRN Cc1cnc([C@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C2CC2)s1 ZINC000173604782 1426778988 /nfs/dbraw/zinc/77/89/88/1426778988.db2.gz BOMWZQRCUPNALP-MRXNPFEDSA-N 0 0 383.433 3.427 20 5 GGBDRN CCNC(=O)c1ccc(Cl)cc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173610722 1426785465 /nfs/dbraw/zinc/78/54/65/1426785465.db2.gz RTLKLMNTYOWATH-UHFFFAOYSA-N 0 0 390.827 3.073 20 5 GGBDRN C[C@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c2cc(Cl)ccc2O1 ZINC000173611019 1426787017 /nfs/dbraw/zinc/78/70/17/1426787017.db2.gz VJKNPDUSKLBNTL-NSHDSACASA-N 0 0 399.794 3.257 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2cc(Cl)ccc2O1 ZINC000173611460 1426788525 /nfs/dbraw/zinc/78/85/25/1426788525.db2.gz RWLYQNPDLYSMCO-NSHDSACASA-N 0 0 399.794 3.257 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(C3N=NC(=S)N3C(C)C)CC2)c1 ZINC000173613865 1426790749 /nfs/dbraw/zinc/79/07/49/1426790749.db2.gz SCSLENLUDQLMIV-UHFFFAOYSA-N 0 0 389.481 3.384 20 5 GGBDRN Cc1cc(C)cc(NC(=O)C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000173614068 1426790802 /nfs/dbraw/zinc/79/08/02/1426790802.db2.gz JZJNQDJVEDNROK-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN COc1cc(OCC(=O)N[C@H](c2ncc(C)s2)C2CC2)ccc1[N+](=O)[O-] ZINC000173618148 1426798883 /nfs/dbraw/zinc/79/88/83/1426798883.db2.gz MYEHYWLBDHMAGV-INIZCTEOSA-N 0 0 377.422 3.015 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)N2CCc3c2cccc3[N+](=O)[O-])cs1 ZINC000173619963 1426800598 /nfs/dbraw/zinc/80/05/98/1426800598.db2.gz JODCJOPSTZKSNM-UHFFFAOYSA-N 0 0 388.449 3.168 20 5 GGBDRN C[C@H](NC(=O)Cc1csc(NC(=O)C(C)(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000173626129 1426802103 /nfs/dbraw/zinc/80/21/03/1426802103.db2.gz QRWXNCGNNUMGSC-NSHDSACASA-N 0 0 390.465 3.456 20 5 GGBDRN Cc1cnc([C@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C2CC2)s1 ZINC000173625985 1426802212 /nfs/dbraw/zinc/80/22/12/1426802212.db2.gz YEBQSFFJTHXGOU-MRXNPFEDSA-N 0 0 383.433 3.427 20 5 GGBDRN COc1ccc(OCCN2CCO[C@@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000173629590 1426802808 /nfs/dbraw/zinc/80/28/08/1426802808.db2.gz LRONJZAKEZLTLR-LJQANCHMSA-N 0 0 376.384 3.195 20 5 GGBDRN COc1ccc(OCCN2CCO[C@@H](c3cccc(F)c3)C2)c([N+](=O)[O-])c1 ZINC000173630241 1426803148 /nfs/dbraw/zinc/80/31/48/1426803148.db2.gz YJLGSVAMPGANGY-LJQANCHMSA-N 0 0 376.384 3.195 20 5 GGBDRN COc1ccc2c(c1)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@@H](C)O2 ZINC000173632323 1426803451 /nfs/dbraw/zinc/80/34/51/1426803451.db2.gz MJYRKZJXVXZWIZ-LLVKDONJSA-N 0 0 391.811 3.483 20 5 GGBDRN C[C@@H](CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1cccc(C(F)(F)F)c1 ZINC000173634247 1426804144 /nfs/dbraw/zinc/80/41/44/1426804144.db2.gz DMCACWLDOMTBNO-LBPRGKRZSA-N 0 0 397.353 3.085 20 5 GGBDRN C[C@H](CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1cccc(C(F)(F)F)c1 ZINC000173634262 1426804191 /nfs/dbraw/zinc/80/41/91/1426804191.db2.gz DMCACWLDOMTBNO-GFCCVEGCSA-N 0 0 397.353 3.085 20 5 GGBDRN O=C(CCc1nc2ccccc2[nH]1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173636510 1426805146 /nfs/dbraw/zinc/80/51/46/1426805146.db2.gz ISJWBVDSIIXLDV-UHFFFAOYSA-N 0 0 394.431 3.474 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1CNC(=O)c1ccccc1 ZINC000173638953 1426805857 /nfs/dbraw/zinc/80/58/57/1426805857.db2.gz GGOGBJDVKUYZBK-KRWDZBQOSA-N 0 0 397.431 3.028 20 5 GGBDRN CCC[C@@]1(C)CCCN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000173639208 1426806205 /nfs/dbraw/zinc/80/62/05/1426806205.db2.gz QHKNSAGAPOMHBF-SFHVURJKSA-N 0 0 379.482 3.215 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173641797 1426807263 /nfs/dbraw/zinc/80/72/63/1426807263.db2.gz VXQWSQBGGGAVPB-UHFFFAOYSA-N 0 0 377.378 3.248 20 5 GGBDRN O=C(NC[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000173644715 1426808278 /nfs/dbraw/zinc/80/82/78/1426808278.db2.gz FLWPQJBYAOEDNE-MRXNPFEDSA-N 0 0 385.395 3.159 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c1 ZINC000173644738 1426808424 /nfs/dbraw/zinc/80/84/24/1426808424.db2.gz UQSCOBUUQVIEIE-INIZCTEOSA-N 0 0 397.431 3.028 20 5 GGBDRN Cc1noc2nc(C)cc(C(=O)N3CCC(Oc4ccc([N+](=O)[O-])cc4)CC3)c12 ZINC000173645888 1426808816 /nfs/dbraw/zinc/80/88/16/1426808816.db2.gz AVHAJPVFEFDBJH-UHFFFAOYSA-N 0 0 396.403 3.431 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@@H](COCc2ccccc2)C1 ZINC000173649881 1426810136 /nfs/dbraw/zinc/81/01/36/1426810136.db2.gz GZWPDABPFYCDHH-GOSISDBHSA-N 0 0 383.448 3.380 20 5 GGBDRN O=C(NC[C@H]1CCCCN1C(=O)c1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000173650157 1426810419 /nfs/dbraw/zinc/81/04/19/1426810419.db2.gz JJOOKSKBXRCUBB-MRXNPFEDSA-N 0 0 385.395 3.159 20 5 GGBDRN CCC[C@@]1(C)CCCN(C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)C1 ZINC000173651228 1426810573 /nfs/dbraw/zinc/81/05/73/1426810573.db2.gz LVVUANIUJBKLPV-NRFANRHFSA-N 0 0 398.463 3.492 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)on1 ZINC000173652816 1426811087 /nfs/dbraw/zinc/81/10/87/1426811087.db2.gz XEPKPXRUBFHNSG-UHFFFAOYSA-N 0 0 377.397 3.190 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@H](c2ccccc2)CO1 ZINC000173673756 1426817088 /nfs/dbraw/zinc/81/70/88/1426817088.db2.gz DAIUGCHYXIWCCY-QRWLVFNGSA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)Cc1nccn1C(F)F ZINC000173675630 1426817502 /nfs/dbraw/zinc/81/75/02/1426817502.db2.gz HYLWQAHFACBFIJ-SECBINFHSA-N 0 0 387.774 3.299 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C3N=NC(=S)N3C(C)C)C2)c1 ZINC000173679664 1426818826 /nfs/dbraw/zinc/81/88/26/1426818826.db2.gz MASZUQTUJBHHLB-CYBMUJFWSA-N 0 0 389.481 3.384 20 5 GGBDRN CC(=O)N1CCC(CCC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173685461 1426820970 /nfs/dbraw/zinc/82/09/70/1426820970.db2.gz KDXNUBNYRBRICE-UHFFFAOYSA-N 0 0 375.469 3.072 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](n3ccnc3)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000173689444 1426821631 /nfs/dbraw/zinc/82/16/31/1426821631.db2.gz ZSQOTNSDHZHKCN-MRXNPFEDSA-N 0 0 398.444 3.092 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nc(CCc2ccccc2)no1 ZINC000173690542 1426822151 /nfs/dbraw/zinc/82/21/51/1426822151.db2.gz OOHGOSRTPZFJFH-UHFFFAOYSA-N 0 0 392.213 3.079 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@H](COCc2ccccc2)C1 ZINC000173693139 1426822879 /nfs/dbraw/zinc/82/28/79/1426822879.db2.gz WOYZCOGYTILKGC-KRWDZBQOSA-N 0 0 390.461 3.131 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)n1 ZINC000173702754 1426826070 /nfs/dbraw/zinc/82/60/70/1426826070.db2.gz JYUCGFNWTHILOR-JTQLQIEISA-N 0 0 384.314 3.325 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@H](c2ccccc2)CO1 ZINC000173703111 1426826290 /nfs/dbraw/zinc/82/62/90/1426826290.db2.gz ZJAOJLKJYFPAQS-DJJJIMSYSA-N 0 0 393.399 3.039 20 5 GGBDRN CC(C)[C@@H](C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000173708953 1426828191 /nfs/dbraw/zinc/82/81/91/1426828191.db2.gz MPQNPMOESQBROL-HXUWFJFHSA-N 0 0 395.459 3.319 20 5 GGBDRN CN(CC(=O)N[C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000173729070 1426833053 /nfs/dbraw/zinc/83/30/53/1426833053.db2.gz XRBNYNRFSMFXRO-NRFANRHFSA-N 0 0 397.431 3.070 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000173731953 1426833873 /nfs/dbraw/zinc/83/38/73/1426833873.db2.gz DEAKIWXJIMACCS-UHFFFAOYSA-N 0 0 390.299 3.251 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@H](c2ccccc2)CO1 ZINC000173731403 1426833906 /nfs/dbraw/zinc/83/39/06/1426833906.db2.gz DMBRONLTLKGYGK-QRWLVFNGSA-N 0 0 392.415 3.383 20 5 GGBDRN Cc1cccc(NC2CCN(C(=O)CN(C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000173732828 1426834131 /nfs/dbraw/zinc/83/41/31/1426834131.db2.gz LHWGYQIWTICBKC-UHFFFAOYSA-N 0 0 382.464 3.443 20 5 GGBDRN COc1ccc2c(c1)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CCO2 ZINC000173735961 1426834933 /nfs/dbraw/zinc/83/49/33/1426834933.db2.gz WQKYGYGTKOJSQQ-UHFFFAOYSA-N 0 0 377.784 3.094 20 5 GGBDRN Cc1nc(C)c(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])o1 ZINC000173735247 1426834948 /nfs/dbraw/zinc/83/49/48/1426834948.db2.gz LIXCJVKRWVLRSL-AWEZNQCLSA-N 0 0 375.381 3.012 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173736917 1426835252 /nfs/dbraw/zinc/83/52/52/1426835252.db2.gz FJJWKWQCBWSLHY-UHFFFAOYSA-N 0 0 388.371 3.165 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C12CCCC2 ZINC000173740470 1426835928 /nfs/dbraw/zinc/83/59/28/1426835928.db2.gz ACUFNHPGIMTFDS-GJZGRUSLSA-N 0 0 395.843 3.041 20 5 GGBDRN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173740773 1426836225 /nfs/dbraw/zinc/83/62/25/1426836225.db2.gz LZYNUVOUEONAAT-UHFFFAOYSA-N 0 0 384.436 3.116 20 5 GGBDRN CN(CC(=O)Nc1nc(CN2CCCCC2)cs1)c1ccccc1[N+](=O)[O-] ZINC000173748069 1426838751 /nfs/dbraw/zinc/83/87/51/1426838751.db2.gz JIOHMMHZXJNDDZ-UHFFFAOYSA-N 0 0 389.481 3.112 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@H]1n1cccn1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000173760508 1426842739 /nfs/dbraw/zinc/84/27/39/1426842739.db2.gz PGMLSHDRWPJMDR-IAGOWNOFSA-N 0 0 383.452 3.305 20 5 GGBDRN CN(CC(=O)Nc1ccccc1C(=O)NC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000173764527 1426844022 /nfs/dbraw/zinc/84/40/22/1426844022.db2.gz RPCZIJPUIBDWNU-UHFFFAOYSA-N 0 0 384.436 3.198 20 5 GGBDRN Cc1ccc(NCCCNC(=O)Nc2ccc3c(c2)NC(=O)CC3)c([N+](=O)[O-])c1 ZINC000173775275 1426847780 /nfs/dbraw/zinc/84/77/80/1426847780.db2.gz SFGMGBWOABFBCD-UHFFFAOYSA-N 0 0 397.435 3.412 20 5 GGBDRN COC[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccco1 ZINC000173781333 1426849928 /nfs/dbraw/zinc/84/99/28/1426849928.db2.gz PRAPEEHGTFRWJE-QGZVFWFLSA-N 0 0 376.412 3.252 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cn(Cc2cccs2)nn1 ZINC000173782909 1426850148 /nfs/dbraw/zinc/85/01/48/1426850148.db2.gz HATYXSSIAUXOBM-UHFFFAOYSA-N 0 0 385.449 3.347 20 5 GGBDRN CC(=O)c1ccccc1NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173798417 1426853982 /nfs/dbraw/zinc/85/39/82/1426853982.db2.gz SUQNZHHKTPZTJH-UHFFFAOYSA-N 0 0 397.431 3.279 20 5 GGBDRN COc1ccc(NC(=O)CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173798020 1426853988 /nfs/dbraw/zinc/85/39/88/1426853988.db2.gz KXMDYHQESUTJAR-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000173808028 1426856893 /nfs/dbraw/zinc/85/68/93/1426856893.db2.gz OBFLQBSFQZEKCB-LPHOPBHVSA-N 0 0 397.431 3.126 20 5 GGBDRN Cn1ccc2ccc(NC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc21 ZINC000173815373 1426858867 /nfs/dbraw/zinc/85/88/67/1426858867.db2.gz GCJOXXGTKCYTAB-UHFFFAOYSA-N 0 0 379.420 3.441 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H](c2nc(C)cs2)C1 ZINC000173816822 1426859002 /nfs/dbraw/zinc/85/90/02/1426859002.db2.gz ZAVGAFMTYWSKTJ-AWEZNQCLSA-N 0 0 395.506 3.490 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000173824714 1426861199 /nfs/dbraw/zinc/86/11/99/1426861199.db2.gz HOMDPULDNBADFS-HNNXBMFYSA-N 0 0 377.441 3.375 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000173824703 1426861257 /nfs/dbraw/zinc/86/12/57/1426861257.db2.gz HOMDPULDNBADFS-OAHLLOKOSA-N 0 0 377.441 3.375 20 5 GGBDRN CN(C[C@H]1CCCN1C(=O)c1cc(F)ccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000173826415 1426861719 /nfs/dbraw/zinc/86/17/19/1426861719.db2.gz BNGAZBUZQOEVFH-CYBMUJFWSA-N 0 0 381.404 3.205 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)ccc1C ZINC000173838028 1426865466 /nfs/dbraw/zinc/86/54/66/1426865466.db2.gz SFCYRAZMVWOMHW-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccc1C ZINC000173839958 1426866558 /nfs/dbraw/zinc/86/65/58/1426866558.db2.gz QJJKQJSKRIKUCK-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN O=C(NC1(c2cccc(F)c2)CCOCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000173843657 1426868094 /nfs/dbraw/zinc/86/80/94/1426868094.db2.gz LLWPCFZUNPQGGN-UHFFFAOYSA-N 0 0 384.367 3.046 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173848747 1426869718 /nfs/dbraw/zinc/86/97/18/1426869718.db2.gz AEOGGZVAEHEVMT-INIZCTEOSA-N 0 0 398.444 3.092 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000173848252 1426869794 /nfs/dbraw/zinc/86/97/94/1426869794.db2.gz RVCDFCMZIFTQRK-INIZCTEOSA-N 0 0 398.444 3.092 20 5 GGBDRN NC(=O)NCc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173862477 1426874108 /nfs/dbraw/zinc/87/41/08/1426874108.db2.gz QQJUACVBJMRRHM-UHFFFAOYSA-N 0 0 382.298 3.034 20 5 GGBDRN O=C(NC1CCN(CC(F)(F)F)CC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173877612 1426879078 /nfs/dbraw/zinc/87/90/78/1426879078.db2.gz STKDMPLQZJOMQO-UHFFFAOYSA-N 0 0 399.291 3.370 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc(-n3cncn3)c(C)c2)c([N+](=O)[O-])c1 ZINC000173880105 1426879868 /nfs/dbraw/zinc/87/98/68/1426879868.db2.gz JVKZIURIRFSLJN-UHFFFAOYSA-N 0 0 394.435 3.024 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@@H](C)CC ZINC000173892483 1426883201 /nfs/dbraw/zinc/88/32/01/1426883201.db2.gz MPYHLACYIVYWFP-BTYIYWSLSA-N 0 0 394.471 3.249 20 5 GGBDRN CN(Cc1cc2ccccc2o1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000173910973 1426889119 /nfs/dbraw/zinc/88/91/19/1426889119.db2.gz LNNYZQWCTKGMKL-UHFFFAOYSA-N 0 0 388.401 3.017 20 5 GGBDRN COc1cc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2ccccc2n1 ZINC000173911384 1426889662 /nfs/dbraw/zinc/88/96/62/1426889662.db2.gz WQGOXRYBXLHIHX-UHFFFAOYSA-N 0 0 380.404 3.493 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2)nc1 ZINC000173917541 1426891370 /nfs/dbraw/zinc/89/13/70/1426891370.db2.gz LKYSZWIAJULPTK-UHFFFAOYSA-N 0 0 376.372 3.423 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccncc3)n2-c2ccccc2)c1 ZINC000173922938 1426893127 /nfs/dbraw/zinc/89/31/27/1426893127.db2.gz PTJWRWLWEHTRJI-UHFFFAOYSA-N 0 0 393.432 3.226 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccc(OC(F)F)cc3)o2)c1 ZINC000173923219 1426893518 /nfs/dbraw/zinc/89/35/18/1426893518.db2.gz XUBHNHBLXLUPPK-UHFFFAOYSA-N 0 0 383.336 3.235 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c2cc(Cl)ccc2O1 ZINC000173928115 1426896030 /nfs/dbraw/zinc/89/60/30/1426896030.db2.gz SYJWAUYSHCMQAD-VIFPVBQESA-N 0 0 386.788 3.364 20 5 GGBDRN Cc1cccc(S(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000173929970 1426896638 /nfs/dbraw/zinc/89/66/38/1426896638.db2.gz FJCXFURSIJEJFB-UHFFFAOYSA-N 0 0 376.434 3.135 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)Cc3cccc(F)c3)CC2)cc1 ZINC000173930219 1426896760 /nfs/dbraw/zinc/89/67/60/1426896760.db2.gz DHXIWQNGRDOFDX-UHFFFAOYSA-N 0 0 394.424 3.107 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)cc1 ZINC000173930765 1426897219 /nfs/dbraw/zinc/89/72/19/1426897219.db2.gz QVUULZPECDSDGL-UHFFFAOYSA-N 0 0 398.387 3.105 20 5 GGBDRN Cc1ccc(F)cc1S(=O)(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173930949 1426897278 /nfs/dbraw/zinc/89/72/78/1426897278.db2.gz NFTXSSGHLSNVNS-UHFFFAOYSA-N 0 0 394.424 3.274 20 5 GGBDRN Cc1ccccc1CS(=O)(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173930726 1426897344 /nfs/dbraw/zinc/89/73/44/1426897344.db2.gz HNQJVLHRLJCNIS-UHFFFAOYSA-N 0 0 390.461 3.276 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)CC[C@H]1c1ccccc1 ZINC000173933772 1426898133 /nfs/dbraw/zinc/89/81/33/1426898133.db2.gz VCQFJWLJEALRMJ-DNVCBOLYSA-N 0 0 391.431 3.441 20 5 GGBDRN C[C@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)CC[C@H]1c1ccccc1 ZINC000173933780 1426898251 /nfs/dbraw/zinc/89/82/51/1426898251.db2.gz VCQFJWLJEALRMJ-HNAYVOBHSA-N 0 0 391.431 3.441 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)CC[C@H]1c1ccccc1 ZINC000173938231 1426899910 /nfs/dbraw/zinc/89/99/10/1426899910.db2.gz DRFVAGXQMUEVJD-CRAIPNDOSA-N 0 0 391.431 3.441 20 5 GGBDRN CC[C@@](C)(NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000173950440 1426905619 /nfs/dbraw/zinc/90/56/19/1426905619.db2.gz VDDHEGXDNAVEFN-QGZVFWFLSA-N 0 0 378.454 3.222 20 5 GGBDRN Cc1cc(S(=O)(=O)NC2(c3cccc(F)c3)CCOCC2)ccc1[N+](=O)[O-] ZINC000173956839 1426909300 /nfs/dbraw/zinc/90/93/00/1426909300.db2.gz CSVURTRWLZMILJ-UHFFFAOYSA-N 0 0 394.424 3.027 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@@H](O)c2ccc(OC(F)(F)F)cc2)nc1-c1ccncc1 ZINC000173959097 1426909937 /nfs/dbraw/zinc/90/99/37/1426909937.db2.gz IVBJUGWJVXVXRP-OAHLLOKOSA-N 0 0 394.309 3.486 20 5 GGBDRN Cc1ccc(C)c(OC[C@@H](O)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)c1C ZINC000173959476 1426909986 /nfs/dbraw/zinc/90/99/86/1426909986.db2.gz KXVCZOIMTYBSPH-KRWDZBQOSA-N 0 0 382.420 3.218 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@H](O)COCc2ccccc2Cl)nc1-c1ccncc1 ZINC000173959849 1426911230 /nfs/dbraw/zinc/91/12/30/1426911230.db2.gz FQFYHSGDUXKNSQ-HNNXBMFYSA-N 0 0 388.811 3.084 20 5 GGBDRN CN1CCOc2ccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)cc21 ZINC000173964604 1426913672 /nfs/dbraw/zinc/91/36/72/1426913672.db2.gz LUSAYXAYPFLGJZ-UHFFFAOYSA-N 0 0 382.420 3.276 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(OCc3ccccn3)c(F)c2)c1[N+](=O)[O-] ZINC000173981443 1426924277 /nfs/dbraw/zinc/92/42/77/1426924277.db2.gz WKVQESCZCSZACO-UHFFFAOYSA-N 0 0 385.355 3.002 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C2CC2)n1 ZINC000173987859 1426927737 /nfs/dbraw/zinc/92/77/37/1426927737.db2.gz FYHMSYMAUWQBBD-MRXNPFEDSA-N 0 0 384.417 3.082 20 5 GGBDRN CC(C)C[C@H](CCO)CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000173990198 1426929506 /nfs/dbraw/zinc/92/95/06/1426929506.db2.gz IBACAIPITYDOET-NSHDSACASA-N 0 0 380.413 3.048 20 5 GGBDRN Cc1ccc(OC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)c([N+](=O)[O-])c1 ZINC000173994283 1426931817 /nfs/dbraw/zinc/93/18/17/1426931817.db2.gz HEHHYRBGFHKWDC-UHFFFAOYSA-N 0 0 377.422 3.492 20 5 GGBDRN Cc1c(OC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cccc1[N+](=O)[O-] ZINC000174003259 1426936813 /nfs/dbraw/zinc/93/68/13/1426936813.db2.gz XQBFAJJZPQONDF-UHFFFAOYSA-N 0 0 375.768 3.305 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cnn(CC(=O)NC2CCCCC2)c1 ZINC000174004237 1426938038 /nfs/dbraw/zinc/93/80/38/1426938038.db2.gz WJNWCGZPIOIPMW-UHFFFAOYSA-N 0 0 399.451 3.109 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@@H](C)OC[C@H]1c1ccccc1 ZINC000174006371 1426938614 /nfs/dbraw/zinc/93/86/14/1426938614.db2.gz FXZPNWFKEBMXQH-BEFAXECRSA-N 0 0 399.447 3.394 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c2ccc(F)cc2O1 ZINC000174013375 1426943323 /nfs/dbraw/zinc/94/33/23/1426943323.db2.gz UEQNXLDPSALWSI-SNVBAGLBSA-N 0 0 383.335 3.003 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000174020574 1426948699 /nfs/dbraw/zinc/94/86/99/1426948699.db2.gz QGWYAUVCGFWFRY-MAUKXSAKSA-N 0 0 383.448 3.193 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1[N+](=O)[O-] ZINC000174044421 1426966824 /nfs/dbraw/zinc/96/68/24/1426966824.db2.gz PAJHRZWAIUYJHI-KRWDZBQOSA-N 0 0 397.479 3.495 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000174046744 1426969997 /nfs/dbraw/zinc/96/99/97/1426969997.db2.gz HQHNQAMGSXSGFE-HHHXNRCGSA-N 0 0 387.461 3.187 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc2c(C(C)C)nn(C)c2s1 ZINC000174047865 1426970186 /nfs/dbraw/zinc/97/01/86/1426970186.db2.gz OWEHRMVPUXVCMX-UHFFFAOYSA-N 0 0 377.426 3.028 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc(Br)cn1C(C)C ZINC000174047923 1426970285 /nfs/dbraw/zinc/97/02/85/1426970285.db2.gz RGYOXNXJCKHQBC-UHFFFAOYSA-N 0 0 385.218 3.102 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(NC(=O)CC(C)C)c(C)c1 ZINC000174048602 1426971118 /nfs/dbraw/zinc/97/11/18/1426971118.db2.gz CVPCXSLEVOCMES-UHFFFAOYSA-N 0 0 388.424 3.250 20 5 GGBDRN Cc1nn(CCC(=O)NCCc2c[nH]c3ccc(Cl)cc23)c(C)c1[N+](=O)[O-] ZINC000174056864 1426976919 /nfs/dbraw/zinc/97/69/19/1426976919.db2.gz AMVSGMPJXSKIGQ-UHFFFAOYSA-N 0 0 389.843 3.292 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@H]2n2cccn2)cc1SC ZINC000174056407 1426977478 /nfs/dbraw/zinc/97/74/78/1426977478.db2.gz ORRVWGAUZYPWFY-ZIAGYGMSSA-N 0 0 390.465 3.436 20 5 GGBDRN C[C@H]1CN(C)c2ccccc2N(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000174059690 1426979933 /nfs/dbraw/zinc/97/99/33/1426979933.db2.gz NKIZZNTZJKTVPI-ZDUSSCGKSA-N 0 0 392.415 3.169 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000174062637 1426981979 /nfs/dbraw/zinc/98/19/79/1426981979.db2.gz UJZPAFSNXAPJKI-HOCLYGCPSA-N 0 0 388.468 3.136 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](C)c2nc(C3CCCCC3)no2)ccc1[N+](=O)[O-] ZINC000174065971 1426983795 /nfs/dbraw/zinc/98/37/95/1426983795.db2.gz UBCWHYGEXSRIHE-GFCCVEGCSA-N 0 0 394.453 3.373 20 5 GGBDRN CC(C)C[C@H]1CC(=O)N(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000174080490 1426991550 /nfs/dbraw/zinc/99/15/50/1426991550.db2.gz YVXOSCRTOQBKKN-INIZCTEOSA-N 0 0 375.469 3.290 20 5 GGBDRN CCc1ccc(O)c(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000174084213 1426993882 /nfs/dbraw/zinc/99/38/82/1426993882.db2.gz YVWIARQROJNFSM-GOSISDBHSA-N 0 0 397.431 3.415 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)cc1[N+](=O)[O-] ZINC000174086569 1426994523 /nfs/dbraw/zinc/99/45/23/1426994523.db2.gz ZTYDKISEJCTLPN-CYBMUJFWSA-N 0 0 395.375 3.488 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])n1 ZINC000174088150 1426995468 /nfs/dbraw/zinc/99/54/68/1426995468.db2.gz OOIVYTINFUKWTN-SNVBAGLBSA-N 0 0 398.366 3.262 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])[C@H](c2ccccc2)CO1 ZINC000174092528 1426997180 /nfs/dbraw/zinc/99/71/80/1426997180.db2.gz IQHSDCSPWFVMPG-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN Cc1nc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)ccc1Br ZINC000174092480 1426997612 /nfs/dbraw/zinc/99/76/12/1426997612.db2.gz UUVOSQATWFWZJD-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])[C@H](c2ccccc2)CO1 ZINC000174092540 1426997681 /nfs/dbraw/zinc/99/76/81/1426997681.db2.gz IQHSDCSPWFVMPG-LRDDRELGSA-N 0 0 396.852 3.399 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)Cn2ncc3ccc([N+](=O)[O-])cc32)n1 ZINC000174092962 1426998299 /nfs/dbraw/zinc/99/82/99/1426998299.db2.gz LQHGDJGQOJRXBK-ZDUSSCGKSA-N 0 0 388.428 3.151 20 5 GGBDRN CC[C@H]1CN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1c1ccccc1 ZINC000174093985 1426999445 /nfs/dbraw/zinc/99/94/45/1426999445.db2.gz KZQYCHSBKGEUPQ-OXJNMPFZSA-N 0 0 395.459 3.367 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000174094708 1427000221 /nfs/dbraw/zinc/00/02/21/1427000221.db2.gz BCMOWHBKOHBSDE-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000174096209 1427000686 /nfs/dbraw/zinc/00/06/86/1427000686.db2.gz KIGOEMPOVGKEKR-KBXCAEBGSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cccc(Oc2ccc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)cc2)c1 ZINC000174099319 1427001940 /nfs/dbraw/zinc/00/19/40/1427001940.db2.gz GIKSBPLMQFJDAY-UHFFFAOYSA-N 0 0 379.372 3.496 20 5 GGBDRN Cc1cc(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c(C)n1CCc1cccs1 ZINC000174100092 1427002129 /nfs/dbraw/zinc/00/21/29/1427002129.db2.gz CXXHCIWYQKMHNV-UHFFFAOYSA-N 0 0 385.445 3.362 20 5 GGBDRN CN(C)CC(=O)Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000174103152 1427003361 /nfs/dbraw/zinc/00/33/61/1427003361.db2.gz NHNFSBCTHAQVIC-UHFFFAOYSA-N 0 0 376.800 3.001 20 5 GGBDRN CC[C@@H](C)C[C@@H](C)NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000174104190 1427003889 /nfs/dbraw/zinc/00/38/89/1427003889.db2.gz FEASSRGLDMRUQL-VXGBXAGGSA-N 0 0 377.470 3.429 20 5 GGBDRN CCCc1ncc(C(=O)OCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000174105056 1427004009 /nfs/dbraw/zinc/00/40/09/1427004009.db2.gz SGDBQNCJXXQXNF-UHFFFAOYSA-N 0 0 397.840 3.244 20 5 GGBDRN Cc1c(F)cccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000174109329 1427005873 /nfs/dbraw/zinc/00/58/73/1427005873.db2.gz CXYUTHBCCDVFSX-LLVKDONJSA-N 0 0 375.331 3.173 20 5 GGBDRN COC(=O)c1cc(O[C@H](C)c2nc(Cc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000174119075 1427009673 /nfs/dbraw/zinc/00/96/73/1427009673.db2.gz RZYBIRSINLIKMZ-GFCCVEGCSA-N 0 0 383.360 3.495 20 5 GGBDRN CCc1ccc(C(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1[N+](=O)[O-] ZINC000174131583 1427015864 /nfs/dbraw/zinc/01/58/64/1427015864.db2.gz AHKKIOVJAHJMIB-IBGZPJMESA-N 0 0 397.431 3.205 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(C)c(NS(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000174134490 1427016209 /nfs/dbraw/zinc/01/62/09/1427016209.db2.gz NUBPADDAEPAKEG-UHFFFAOYSA-N 0 0 377.422 3.089 20 5 GGBDRN CSC1(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCOCC1 ZINC000174146720 1427021532 /nfs/dbraw/zinc/02/15/32/1427021532.db2.gz KXYJVQGOCUBIAL-UHFFFAOYSA-N 0 0 396.512 3.183 20 5 GGBDRN O=C(Cn1ccc2c1cccc2[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000174160656 1427026617 /nfs/dbraw/zinc/02/66/17/1427026617.db2.gz GEDCWFIFHUBLKQ-IBGZPJMESA-N 0 0 383.379 3.289 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1[N+](=O)[O-] ZINC000174167767 1427030186 /nfs/dbraw/zinc/03/01/86/1427030186.db2.gz GEVICHNKOFOUMR-UHFFFAOYSA-N 0 0 396.447 3.456 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)c1 ZINC000174185431 1427038077 /nfs/dbraw/zinc/03/80/77/1427038077.db2.gz OJBVMMIHFCKKFQ-UHFFFAOYSA-N 0 0 382.464 3.368 20 5 GGBDRN CC[C@H](C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1)N1CCCC1=O ZINC000174186141 1427038691 /nfs/dbraw/zinc/03/86/91/1427038691.db2.gz NBCFFXCGGGSOTA-CQSZACIVSA-N 0 0 388.449 3.366 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000174189969 1427040932 /nfs/dbraw/zinc/04/09/32/1427040932.db2.gz GPJKULNNVXYTFT-LFYBBSHMSA-N 0 0 394.475 3.459 20 5 GGBDRN CCc1ccc(C(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000174191356 1427041648 /nfs/dbraw/zinc/04/16/48/1427041648.db2.gz QCMXKJNGKBAWAX-AWEZNQCLSA-N 0 0 391.468 3.486 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2ncnc3ccsc32)CC1 ZINC000174190579 1427042183 /nfs/dbraw/zinc/04/21/83/1427042183.db2.gz NXTNEJAVKNMGOU-UHFFFAOYSA-N 0 0 398.448 3.262 20 5 GGBDRN O=C(c1cc2ccccc2c2cccnc12)N1CC[C@H](CN2CCOCC2)C1 ZINC000174204495 1427048667 /nfs/dbraw/zinc/04/86/67/1427048667.db2.gz WEMQLJKMFUAQQB-QGZVFWFLSA-N 0 0 375.472 3.182 20 5 GGBDRN CCc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)CC2)cc1 ZINC000174208847 1427051731 /nfs/dbraw/zinc/05/17/31/1427051731.db2.gz HBKDQJKYCBXFRO-UHFFFAOYSA-N 0 0 398.419 3.336 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NCC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000174221102 1427057449 /nfs/dbraw/zinc/05/74/49/1427057449.db2.gz GONUKKUNTBMBJF-UHFFFAOYSA-N 0 0 396.369 3.438 20 5 GGBDRN O=C(OCCn1c(=O)oc2ccccc21)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000174222849 1427057902 /nfs/dbraw/zinc/05/79/02/1427057902.db2.gz OZYWNASAHJSJIK-UHFFFAOYSA-N 0 0 396.277 3.379 20 5 GGBDRN C[C@H]1CN(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000174231306 1427061238 /nfs/dbraw/zinc/06/12/38/1427061238.db2.gz YBKCSSMTHGEHIP-YJBOKZPZSA-N 0 0 382.416 3.438 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000174234901 1427063166 /nfs/dbraw/zinc/06/31/66/1427063166.db2.gz MLMOXORZOLVBTM-UHFFFAOYSA-N 0 0 396.447 3.499 20 5 GGBDRN O=C(NC[C@@H]1Cc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242116 1427065601 /nfs/dbraw/zinc/06/56/01/1427065601.db2.gz RJEUQOZSBOSEGY-INIZCTEOSA-N 0 0 381.432 3.488 20 5 GGBDRN O=C1[C@@H](N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCN1c1ccccc1F ZINC000174242011 1427065609 /nfs/dbraw/zinc/06/56/09/1427065609.db2.gz URLXRWPPZFXPNV-FQEVSTJZSA-N 0 0 399.422 3.383 20 5 GGBDRN O=C1[C@H](N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCN1c1ccccc1F ZINC000174242022 1427065814 /nfs/dbraw/zinc/06/58/14/1427065814.db2.gz URLXRWPPZFXPNV-HXUWFJFHSA-N 0 0 399.422 3.383 20 5 GGBDRN C[C@@H]1CCC[C@H](C)N1C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242299 1427065921 /nfs/dbraw/zinc/06/59/21/1427065921.db2.gz LWKVWXVEUKNWGF-IYBDPMFKSA-N 0 0 375.469 3.228 20 5 GGBDRN CC1CCC(NC(=O)CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000174243565 1427066310 /nfs/dbraw/zinc/06/63/10/1427066310.db2.gz VAQNQXZBIDNSPN-UHFFFAOYSA-N 0 0 375.469 3.133 20 5 GGBDRN C[C@H](NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000174248184 1427069169 /nfs/dbraw/zinc/06/91/69/1427069169.db2.gz XTLIPYUWMWPBKZ-INIZCTEOSA-N 0 0 383.448 3.315 20 5 GGBDRN Cc1nncn1CCNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000174260358 1427073937 /nfs/dbraw/zinc/07/39/37/1427073937.db2.gz NKPOZOYGCYLLBB-UHFFFAOYSA-N 0 0 397.460 3.384 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCc1nc(Cc2ccc(F)cc2)no1 ZINC000174264226 1427075027 /nfs/dbraw/zinc/07/50/27/1427075027.db2.gz YEIJPJLNVBGFRP-BJMVGYQFSA-N 0 0 383.335 3.464 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](n3ccnc3)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000174264400 1427075159 /nfs/dbraw/zinc/07/51/59/1427075159.db2.gz JWJWURGGSXEPIX-INIZCTEOSA-N 0 0 398.444 3.092 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Nc2cccc(N3CCCNC3=O)c2)cccc1[N+](=O)[O-] ZINC000174279832 1427082157 /nfs/dbraw/zinc/08/21/57/1427082157.db2.gz OHVSFIWVVLFYOT-AWEZNQCLSA-N 0 0 397.435 3.262 20 5 GGBDRN CC(C)[C@H]1CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCS1 ZINC000174303319 1427092963 /nfs/dbraw/zinc/09/29/63/1427092963.db2.gz BVFCYQBEXQNPOF-GOSISDBHSA-N 0 0 377.510 3.411 20 5 GGBDRN C[C@H](CCOc1ccccc1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000174321846 1427101292 /nfs/dbraw/zinc/10/12/92/1427101292.db2.gz SDLDXIRWSYIERD-CVEARBPZSA-N 0 0 384.436 3.108 20 5 GGBDRN CC[NH+](CC)CCOc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000174325320 1427102396 /nfs/dbraw/zinc/10/23/96/1427102396.db2.gz NMZGBAIJVGXAFN-UHFFFAOYSA-N 0 0 393.465 3.116 20 5 GGBDRN C[C@H](N[C@@H](C)c1nc(-c2cccc(F)c2)no1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000174332124 1427105457 /nfs/dbraw/zinc/10/54/57/1427105457.db2.gz IKRDMOVFZVWBPA-RYUDHWBXSA-N 0 0 399.382 3.462 20 5 GGBDRN C[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)Oc1ccccc1F ZINC000174333848 1427106273 /nfs/dbraw/zinc/10/62/73/1427106273.db2.gz 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1427228501 /nfs/dbraw/zinc/22/85/01/1427228501.db2.gz CCSVEHKJAVFZSP-UHFFFAOYSA-N 0 0 383.738 3.495 20 5 GGBDRN O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCC(F)F ZINC000174568068 1427228505 /nfs/dbraw/zinc/22/85/05/1427228505.db2.gz UEXGIZZIGSDKOL-UHFFFAOYSA-N 0 0 386.358 3.371 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000174569288 1427229684 /nfs/dbraw/zinc/22/96/84/1427229684.db2.gz YBDOJFAGOXAGEK-ACJLOTCBSA-N 0 0 385.395 3.073 20 5 GGBDRN CC(C)C[C@@H]1CCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000174579728 1427238344 /nfs/dbraw/zinc/23/83/44/1427238344.db2.gz FXPOEBKXLGFWCF-AWEZNQCLSA-N 0 0 375.425 3.178 20 5 GGBDRN CC(C)C[C@H]1CCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C1 ZINC000174585971 1427241789 /nfs/dbraw/zinc/24/17/89/1427241789.db2.gz IBUWPXYESMKQAH-CYBMUJFWSA-N 0 0 389.481 3.383 20 5 GGBDRN Cn1c(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)nc2cc(F)ccc21 ZINC000174600127 1427250934 /nfs/dbraw/zinc/25/09/34/1427250934.db2.gz 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COc1cccc(-c2noc([C@@H](C)NC(=O)c3ccc(C)c([N+](=O)[O-])c3)n2)c1 ZINC000174640282 1427280962 /nfs/dbraw/zinc/28/09/62/1427280962.db2.gz WVRYGZCHMNHQST-GFCCVEGCSA-N 0 0 382.376 3.453 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)OCc1ccccc1NC(=O)c1ccco1 ZINC000174659636 1427292755 /nfs/dbraw/zinc/29/27/55/1427292755.db2.gz BIOWBBYLQGNRMP-UHFFFAOYSA-N 0 0 398.375 3.079 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(N)c([N+](=O)[O-])c2)cc1Br ZINC000174665583 1427297078 /nfs/dbraw/zinc/29/70/78/1427297078.db2.gz OHGOGTRMQXRTGZ-UHFFFAOYSA-N 0 0 386.227 3.049 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000174672716 1427301123 /nfs/dbraw/zinc/30/11/23/1427301123.db2.gz GGDQGNWTNRTMIK-UHFFFAOYSA-N 0 0 375.400 3.073 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000174673168 1427301617 /nfs/dbraw/zinc/30/16/17/1427301617.db2.gz JKAXGJNYRZNWQW-SCLBCKFNSA-N 0 0 378.450 3.309 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1nc(C(C)(C)C)no1 ZINC000174676936 1427304212 /nfs/dbraw/zinc/30/42/12/1427304212.db2.gz SMUZGIGOXKLTHA-LBPRGKRZSA-N 0 0 387.440 3.367 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccnc(N3CCOCC3)c2)cc1OC(F)F ZINC000174678621 1427305207 /nfs/dbraw/zinc/30/52/07/1427305207.db2.gz GFVPOOQFQHJZIY-UHFFFAOYSA-N 0 0 380.351 3.040 20 5 GGBDRN COc1cc(C(=O)NCCC2CC2)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000174681064 1427307081 /nfs/dbraw/zinc/30/70/81/1427307081.db2.gz CEXLBMAMUMGYRL-UHFFFAOYSA-N 0 0 377.422 3.169 20 5 GGBDRN Cc1nc(COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)sc1C ZINC000174693830 1427314142 /nfs/dbraw/zinc/31/41/42/1427314142.db2.gz PPOABWQQMJLSAJ-NSHDSACASA-N 0 0 395.462 3.078 20 5 GGBDRN Cc1c(C(=O)Oc2cccc3c2CCCC3=O)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000174705505 1427320483 /nfs/dbraw/zinc/32/04/83/1427320483.db2.gz ZXUYSXOYMXVOQD-UHFFFAOYSA-N 0 0 392.371 3.222 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1nc(C(C)(C)C)no1 ZINC000174716589 1427327445 /nfs/dbraw/zinc/32/74/45/1427327445.db2.gz VYLNLPBVGSOBFN-GFCCVEGCSA-N 0 0 387.440 3.367 20 5 GGBDRN CN1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2cc(F)ccc21 ZINC000174723718 1427332245 /nfs/dbraw/zinc/33/22/45/1427332245.db2.gz KPIOBHGEJXMVPW-UHFFFAOYSA-N 0 0 381.367 3.016 20 5 GGBDRN CCC(CC)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C ZINC000174730041 1427335564 /nfs/dbraw/zinc/33/55/64/1427335564.db2.gz TXTLLHZZCVQEPX-UHFFFAOYSA-N 0 0 379.457 3.337 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)COc2ccc(F)c(F)c2)cc1OC(F)F ZINC000174729764 1427335611 /nfs/dbraw/zinc/33/56/11/1427335611.db2.gz NYRSWAGVZVKPBU-SNVBAGLBSA-N 0 0 390.289 3.326 20 5 GGBDRN Cc1cc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2cccnc2c1C ZINC000174745256 1427345238 /nfs/dbraw/zinc/34/52/38/1427345238.db2.gz LYCXHWGMINUYTJ-UHFFFAOYSA-N 0 0 392.415 3.357 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1nc(-c2cccc(F)c2)no1 ZINC000174747912 1427346285 /nfs/dbraw/zinc/34/62/85/1427346285.db2.gz BULLHUUTIJYUJU-NSHDSACASA-N 0 0 399.382 3.341 20 5 GGBDRN C[C@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174749205 1427347086 /nfs/dbraw/zinc/34/70/86/1427347086.db2.gz QQDZOIUJTIXSOI-NSHDSACASA-N 0 0 385.355 3.073 20 5 GGBDRN C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c(F)c1)c1cccc(-n2cccn2)c1 ZINC000174755597 1427350229 /nfs/dbraw/zinc/35/02/29/1427350229.db2.gz IVKRKHOJAMVRRK-CYBMUJFWSA-N 0 0 384.367 3.176 20 5 GGBDRN C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1nc(-c2cccc(F)c2)no1 ZINC000174758543 1427351948 /nfs/dbraw/zinc/35/19/48/1427351948.db2.gz AGDYHKPPKLUASW-NSHDSACASA-N 0 0 386.339 3.040 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000174787981 1427368093 /nfs/dbraw/zinc/36/80/93/1427368093.db2.gz WIJHNEJFXLCKJU-WMZOPIPTSA-N 0 0 384.498 3.170 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000174787969 1427368332 /nfs/dbraw/zinc/36/83/32/1427368332.db2.gz WIJHNEJFXLCKJU-AEFFLSMTSA-N 0 0 384.498 3.170 20 5 GGBDRN Cc1ccc(C(=O)N(C)Cc2nc([C@@H](C)OCC(C)C)no2)cc1[N+](=O)[O-] ZINC000174793104 1427370957 /nfs/dbraw/zinc/37/09/57/1427370957.db2.gz LEWAUDXHIGWUJC-CYBMUJFWSA-N 0 0 376.413 3.292 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2nc([C@@H](C)OCC(C)C)no2)c1 ZINC000174794533 1427372227 /nfs/dbraw/zinc/37/22/27/1427372227.db2.gz MXOSPGPEKHTGQR-CYBMUJFWSA-N 0 0 376.413 3.292 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)c2cc(F)ccc2[N+](=O)[O-])n1 ZINC000174794129 1427372483 /nfs/dbraw/zinc/37/24/83/1427372483.db2.gz YERQYSCDVKSQAH-LLVKDONJSA-N 0 0 380.376 3.123 20 5 GGBDRN Cc1cccc(C(=O)N(C)Cc2nc([C@H](C)OCC(C)C)no2)c1[N+](=O)[O-] ZINC000174794937 1427372953 /nfs/dbraw/zinc/37/29/53/1427372953.db2.gz QQSMMFDGTQGZSF-ZDUSSCGKSA-N 0 0 376.413 3.292 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@H](O)CO[C@H]3CCCc4ccccc43)n2)c1 ZINC000174796936 1427373707 /nfs/dbraw/zinc/37/37/07/1427373707.db2.gz WLIYTIFJPFQPLQ-ICSRJNTNSA-N 0 0 394.431 3.308 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@@H](O)COCc3ccccc3Cl)n2)c1 ZINC000174796959 1427374193 /nfs/dbraw/zinc/37/41/93/1427374193.db2.gz BBJHCTLBJPJQDG-MRXNPFEDSA-N 0 0 388.811 3.084 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)n1 ZINC000174800092 1427376410 /nfs/dbraw/zinc/37/64/10/1427376410.db2.gz LORXWDNQJHHROG-DNGMOHDESA-N 0 0 388.424 3.383 20 5 GGBDRN Cc1ccc(NC(=O)Cc2noc(CN(C)c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000174809937 1427381539 /nfs/dbraw/zinc/38/15/39/1427381539.db2.gz SLYUSUBIDAVKSL-UHFFFAOYSA-N 0 0 381.392 3.104 20 5 GGBDRN O=C(c1ccc(F)cc1)N1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174816345 1427384404 /nfs/dbraw/zinc/38/44/04/1427384404.db2.gz SPVBFPZTOBHVNJ-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN CC(C)COCCCNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174831930 1427393321 /nfs/dbraw/zinc/39/33/21/1427393321.db2.gz SBEXBOQATYXPBC-UHFFFAOYSA-N 0 0 379.457 3.210 20 5 GGBDRN COc1ccc(Cc2noc(CN(C)c3ccccc3[N+](=O)[O-])n2)cc1OC ZINC000174838012 1427397148 /nfs/dbraw/zinc/39/71/48/1427397148.db2.gz VDVXXCJFHIRNLH-UHFFFAOYSA-N 0 0 384.392 3.222 20 5 GGBDRN O=[N+]([O-])c1cccc(Cc2nc(-c3cccc(CN4CCOCC4)c3)no2)c1 ZINC000174838742 1427397638 /nfs/dbraw/zinc/39/76/38/1427397638.db2.gz CZDQOXNVPRWPTQ-UHFFFAOYSA-N 0 0 380.404 3.068 20 5 GGBDRN Cc1cc(C)n(-c2ccc(-c3noc(Cc4cccc([N+](=O)[O-])c4)n3)cn2)n1 ZINC000174839696 1427398424 /nfs/dbraw/zinc/39/84/24/1427398424.db2.gz NFWUYVPHQCJWMW-UHFFFAOYSA-N 0 0 376.376 3.433 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)NCc3cccc([N+](=O)[O-])c3)cc21 ZINC000174858292 1427410682 /nfs/dbraw/zinc/41/06/82/1427410682.db2.gz WNYXMZCBXABVMA-UHFFFAOYSA-N 0 0 383.408 3.009 20 5 GGBDRN COc1cccc(-c2noc(-c3nnn(-c4cccc([N+](=O)[O-])c4)c3C)n2)c1 ZINC000174858936 1427411763 /nfs/dbraw/zinc/41/17/63/1427411763.db2.gz KMGWPFJXQILSQO-UHFFFAOYSA-N 0 0 378.348 3.210 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)cc21 ZINC000174860009 1427412415 /nfs/dbraw/zinc/41/24/15/1427412415.db2.gz QVKYZSINTLRBDK-UHFFFAOYSA-N 0 0 397.435 3.051 20 5 GGBDRN COC(=O)c1cccc(-c2noc(-c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)n2)c1 ZINC000174868157 1427418597 /nfs/dbraw/zinc/41/85/97/1427418597.db2.gz HMNAHOMSPYTEOL-UHFFFAOYSA-N 0 0 391.343 3.284 20 5 GGBDRN COC(=O)c1cccc(-c2noc(-c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)n2)c1 ZINC000174871980 1427420181 /nfs/dbraw/zinc/42/01/81/1427420181.db2.gz KKVNEEGCJCLNJI-UHFFFAOYSA-N 0 0 391.343 3.284 20 5 GGBDRN O=C(Oc1ccc(OC(F)(F)F)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000174875471 1427421753 /nfs/dbraw/zinc/42/17/53/1427421753.db2.gz DENGGUSCYCWVJQ-UHFFFAOYSA-N 0 0 394.265 3.293 20 5 GGBDRN CCc1nsc(N2CCCN(Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)n1 ZINC000174882929 1427426206 /nfs/dbraw/zinc/42/62/06/1427426206.db2.gz LBXGMIXOSJYQHY-UHFFFAOYSA-N 0 0 381.889 3.374 20 5 GGBDRN CCOc1cc(C(=O)NCc2nc3cc(C)ccc3[nH]2)c([N+](=O)[O-])cc1OC ZINC000174884410 1427426778 /nfs/dbraw/zinc/42/67/78/1427426778.db2.gz DZLTVJAQPQAZOO-UHFFFAOYSA-N 0 0 384.392 3.117 20 5 GGBDRN Cc1ccc2[nH]c(CNC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)nc2c1 ZINC000174904695 1427437452 /nfs/dbraw/zinc/43/74/52/1427437452.db2.gz VCLQIVGLWZRQKS-UHFFFAOYSA-N 0 0 393.447 3.312 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2nc3cc(C)ccc3[nH]2)cc1OC ZINC000174905396 1427438589 /nfs/dbraw/zinc/43/85/89/1427438589.db2.gz BXZMEFYEBLLIME-UHFFFAOYSA-N 0 0 384.392 3.117 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000174912282 1427442621 /nfs/dbraw/zinc/44/26/21/1427442621.db2.gz HMYHGEBOQQHAAM-UHFFFAOYSA-N 0 0 398.463 3.134 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)NC(=O)Cc3ccccc3[N+](=O)[O-])ccc2NC1=O ZINC000174926650 1427448956 /nfs/dbraw/zinc/44/89/56/1427448956.db2.gz HDNSJVWWSWIWSD-YVEFUNNKSA-N 0 0 383.404 3.124 20 5 GGBDRN CCOC(=O)c1ccnc(N2C[C@H](c3ccccc3C)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000174926655 1427449057 /nfs/dbraw/zinc/44/90/57/1427449057.db2.gz VOURVWXJSGOUPM-WMLDXEAASA-N 0 0 385.420 3.441 20 5 GGBDRN O=C([C@H]1C[C@@]12CCc1ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000174946596 1427459891 /nfs/dbraw/zinc/45/98/91/1427459891.db2.gz FEYPJTBNEKQZHB-IFMALSPDSA-N 0 0 377.444 3.148 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000174951379 1427462572 /nfs/dbraw/zinc/46/25/72/1427462572.db2.gz FLYRQYPSIWRJLZ-SNVBAGLBSA-N 0 0 389.774 3.459 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3F)ccc2NC1=O ZINC000174963886 1427469048 /nfs/dbraw/zinc/46/90/48/1427469048.db2.gz GHRCQJFXQHZVHB-QFYYESIMSA-N 0 0 387.367 3.334 20 5 GGBDRN Cn1ccc2ccc(NC(=O)C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)cc21 ZINC000174966888 1427470591 /nfs/dbraw/zinc/47/05/91/1427470591.db2.gz UPXNRINWPXIGBY-UHFFFAOYSA-N 0 0 394.431 3.164 20 5 GGBDRN CC[C@@H]1Oc2cc([C@@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3)ccc2NC1=O ZINC000174965701 1427470850 /nfs/dbraw/zinc/47/08/50/1427470850.db2.gz CXQUXBGKRWLZHJ-PXAZEXFGSA-N 0 0 383.404 3.124 20 5 GGBDRN C[C@H](CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1cccc(F)c1 ZINC000174967767 1427471291 /nfs/dbraw/zinc/47/12/91/1427471291.db2.gz LNXCUOZLJMICHN-WMLDXEAASA-N 0 0 386.427 3.411 20 5 GGBDRN C[C@@H](CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1cccc(F)c1 ZINC000174967745 1427471362 /nfs/dbraw/zinc/47/13/62/1427471362.db2.gz LNXCUOZLJMICHN-PBHICJAKSA-N 0 0 386.427 3.411 20 5 GGBDRN C[C@H](CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1cccc(F)c1 ZINC000174967726 1427471429 /nfs/dbraw/zinc/47/14/29/1427471429.db2.gz LNXCUOZLJMICHN-YOEHRIQHSA-N 0 0 386.427 3.411 20 5 GGBDRN CC(C)Cn1cnc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000174987648 1427481448 /nfs/dbraw/zinc/48/14/48/1427481448.db2.gz NFFFIJBMKOUKPV-UHFFFAOYSA-N 0 0 380.470 3.047 20 5 GGBDRN O=C(CN(Cc1ccccc1)CC(F)F)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000174992006 1427484285 /nfs/dbraw/zinc/48/42/85/1427484285.db2.gz CVYKFYQIUPDPST-UHFFFAOYSA-N 0 0 393.346 3.029 20 5 GGBDRN CC(=O)Nc1cc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)ccc1F ZINC000174996370 1427485881 /nfs/dbraw/zinc/48/58/81/1427485881.db2.gz AHZJBTDXELORSF-UHFFFAOYSA-N 0 0 381.385 3.110 20 5 GGBDRN CC(=O)Nc1cccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1C ZINC000174997742 1427487058 /nfs/dbraw/zinc/48/70/58/1427487058.db2.gz DKHLSZAROHJPNB-UHFFFAOYSA-N 0 0 377.422 3.279 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNC1(c2nccs2)CCCC1 ZINC000175012471 1427496803 /nfs/dbraw/zinc/49/68/03/1427496803.db2.gz UBQLNVQIDJAIID-UHFFFAOYSA-N 0 0 376.438 3.058 20 5 GGBDRN COc1ccc(NC(=O)CNC2(c3nc(C)cs3)CCCC2)c([N+](=O)[O-])c1 ZINC000175018712 1427501324 /nfs/dbraw/zinc/50/13/24/1427501324.db2.gz FPAPXZCTNNRAHW-UHFFFAOYSA-N 0 0 390.465 3.366 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNC1(c2nc(C)cs2)CCCC1 ZINC000175020640 1427503512 /nfs/dbraw/zinc/50/35/12/1427503512.db2.gz MQRFTZMYRFUUEN-UHFFFAOYSA-N 0 0 390.465 3.366 20 5 GGBDRN CON(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)Cc1ccccc1C ZINC000175040818 1427514052 /nfs/dbraw/zinc/51/40/52/1427514052.db2.gz CBOCQSFXCTYMKE-CQSZACIVSA-N 0 0 393.465 3.128 20 5 GGBDRN COCc1cc([N+](=O)[O-])ccc1NCc1cccc(C(=O)NC[C@H]2CCCO2)c1 ZINC000175043605 1427516183 /nfs/dbraw/zinc/51/61/83/1427516183.db2.gz VEOAFFLUGPPZJJ-LJQANCHMSA-N 0 0 399.447 3.262 20 5 GGBDRN CCN(C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)CC(F)(F)F ZINC000175053066 1427521301 /nfs/dbraw/zinc/52/13/01/1427521301.db2.gz PKTPBOOXGVOGIB-NSHDSACASA-N 0 0 376.335 3.214 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1N(C)CCCOc1cccc(S(C)(=O)=O)c1 ZINC000175066370 1427527986 /nfs/dbraw/zinc/52/79/86/1427527986.db2.gz UFLLGHYQPFOUJW-UHFFFAOYSA-N 0 0 378.450 3.212 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CC[C@@H](Cc2ccccc2)C1 ZINC000175068266 1427528689 /nfs/dbraw/zinc/52/86/89/1427528689.db2.gz RSSZICXLITYXLM-AWEZNQCLSA-N 0 0 387.823 3.278 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000175072506 1427531598 /nfs/dbraw/zinc/53/15/98/1427531598.db2.gz BGQPMPUPENVYJE-CYBMUJFWSA-N 0 0 391.449 3.210 20 5 GGBDRN O=C(CN1CCC(=O)Nc2cc(F)ccc21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000175084403 1427537490 /nfs/dbraw/zinc/53/74/90/1427537490.db2.gz VJSWFDPMOQAKOB-UHFFFAOYSA-N 0 0 392.774 3.175 20 5 GGBDRN CN(C(=O)Cc1csc(NC(=O)C(C)(C)C)n1)c1ccc([N+](=O)[O-])cc1 ZINC000175084963 1427538258 /nfs/dbraw/zinc/53/82/58/1427538258.db2.gz JNPHNRMTUSGHJP-UHFFFAOYSA-N 0 0 376.438 3.241 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(Cc1ccco1)C[C@H]1CCCO1 ZINC000175089196 1427539746 /nfs/dbraw/zinc/53/97/46/1427539746.db2.gz BVRBQSMAPFZNQT-QGZVFWFLSA-N 0 0 394.449 3.175 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000175091753 1427541577 /nfs/dbraw/zinc/54/15/77/1427541577.db2.gz QEMVHTXWSGZNRG-LBPRGKRZSA-N 0 0 385.811 3.133 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000175092791 1427542173 /nfs/dbraw/zinc/54/21/73/1427542173.db2.gz RASPLLWJYUTJDF-KRWDZBQOSA-N 0 0 383.448 3.349 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000175094833 1427543507 /nfs/dbraw/zinc/54/35/07/1427543507.db2.gz IABCLRMPVNGHGE-INIZCTEOSA-N 0 0 386.452 3.134 20 5 GGBDRN CCc1noc(-c2ccc(C)c(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)c2)n1 ZINC000175099228 1427545686 /nfs/dbraw/zinc/54/56/86/1427545686.db2.gz NPYNALIBPQXBSE-UHFFFAOYSA-N 0 0 385.355 3.489 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1 ZINC000175099282 1427545856 /nfs/dbraw/zinc/54/58/56/1427545856.db2.gz VMMTVUWOAFICQY-MRXNPFEDSA-N 0 0 389.358 3.311 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1noc(-c2ccc(Cl)cc2)n1 ZINC000175101506 1427547399 /nfs/dbraw/zinc/54/73/99/1427547399.db2.gz KBRKGTUGANMDRZ-VIFPVBQESA-N 0 0 387.783 3.371 20 5 GGBDRN CN(CC(=O)N(Cc1ccco1)Cc1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000175103708 1427548613 /nfs/dbraw/zinc/54/86/13/1427548613.db2.gz VTVSHGWGLJMASJ-UHFFFAOYSA-N 0 0 380.404 3.248 20 5 GGBDRN CC(C)CCOc1ccc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000175112904 1427553096 /nfs/dbraw/zinc/55/30/96/1427553096.db2.gz KYEIOPUJRQPODZ-UHFFFAOYSA-N 0 0 385.420 3.275 20 5 GGBDRN Cc1ccc([C@@H](C)NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175118422 1427556285 /nfs/dbraw/zinc/55/62/85/1427556285.db2.gz XEZVNWXMOCSFMV-GFCCVEGCSA-N 0 0 379.394 3.159 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Oc1cc([N+](=O)[O-])ccc1C ZINC000175120546 1427557817 /nfs/dbraw/zinc/55/78/17/1427557817.db2.gz PCOPDSAOSGWRDH-GOSISDBHSA-N 0 0 399.378 3.176 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2ccc3nc(C4CC4)oc3c2)c([N+](=O)[O-])c1 ZINC000175122324 1427558495 /nfs/dbraw/zinc/55/84/95/1427558495.db2.gz GVYZQCFZNUKECE-UHFFFAOYSA-N 0 0 381.344 3.443 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCN(C(=O)c2cc(C)oc2C)CC1 ZINC000175126319 1427560012 /nfs/dbraw/zinc/56/00/12/1427560012.db2.gz WFVVLUOTYCQQFC-UHFFFAOYSA-N 0 0 387.436 3.161 20 5 GGBDRN CC(C)Nc1cc(F)ccc1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000175146830 1427567950 /nfs/dbraw/zinc/56/79/50/1427567950.db2.gz VXJHBEYHAPYFGN-UHFFFAOYSA-N 0 0 384.371 3.387 20 5 GGBDRN Cc1c(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cccc1N1CCNC1=O ZINC000175148727 1427568618 /nfs/dbraw/zinc/56/86/18/1427568618.db2.gz HTOCDYADVKAHFM-UHFFFAOYSA-N 0 0 382.420 3.098 20 5 GGBDRN CC(C)(NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccc([N+](=O)[O-])cc1 ZINC000175149624 1427569617 /nfs/dbraw/zinc/56/96/17/1427569617.db2.gz SINORQHDAWLXTR-UHFFFAOYSA-N 0 0 396.359 3.010 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000175151396 1427570088 /nfs/dbraw/zinc/57/00/88/1427570088.db2.gz VPHWUAMFRMDLPN-CQSZACIVSA-N 0 0 379.457 3.340 20 5 GGBDRN CC(C)(NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(F)c(F)c1 ZINC000175162424 1427576159 /nfs/dbraw/zinc/57/61/59/1427576159.db2.gz YCUPUYWNMICAIW-UHFFFAOYSA-N 0 0 387.342 3.380 20 5 GGBDRN COc1ccc(CN2CCCC[C@H]2CNC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000175166082 1427577693 /nfs/dbraw/zinc/57/76/93/1427577693.db2.gz AGRHIMBJLZHOBL-SFHVURJKSA-N 0 0 383.448 3.388 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@@H](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000175169389 1427578957 /nfs/dbraw/zinc/57/89/57/1427578957.db2.gz OAGKWKMUQYXTND-KBPBESRZSA-N 0 0 385.420 3.102 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)[C@H](C)c2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000175169741 1427579752 /nfs/dbraw/zinc/57/97/52/1427579752.db2.gz CSDWPXFMMCUCFP-MUDIAHQHSA-N 0 0 391.449 3.101 20 5 GGBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000175170043 1427579800 /nfs/dbraw/zinc/57/98/00/1427579800.db2.gz NLHXMAUWJKHXKI-KHXSAUHESA-N 0 0 387.461 3.414 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)NCc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000175171256 1427580756 /nfs/dbraw/zinc/58/07/56/1427580756.db2.gz JKRZKWXZFOSQMP-UHFFFAOYSA-N 0 0 397.479 3.129 20 5 GGBDRN CNC(=O)c1cc(OC)ccc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000175181235 1427586168 /nfs/dbraw/zinc/58/61/68/1427586168.db2.gz SBWMVDWQHRQBFA-UHFFFAOYSA-N 0 0 397.309 3.234 20 5 GGBDRN CN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1cc2ccccc2o1 ZINC000175180572 1427586355 /nfs/dbraw/zinc/58/63/55/1427586355.db2.gz QUYLSVACNZQLMZ-UHFFFAOYSA-N 0 0 383.360 3.140 20 5 GGBDRN O=C(NCc1ccc(O)c(F)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000175188339 1427590088 /nfs/dbraw/zinc/59/00/88/1427590088.db2.gz ZWKAZKONPRAECW-UHFFFAOYSA-N 0 0 389.383 3.193 20 5 GGBDRN COc1cc(C(=O)N2Cc3ccccc3N(C)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000175211558 1427603952 /nfs/dbraw/zinc/60/39/52/1427603952.db2.gz QNYVRVXRAVACEC-ZDUSSCGKSA-N 0 0 385.420 3.093 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCN(CC(F)(F)C(F)F)CC1 ZINC000175234787 1427616767 /nfs/dbraw/zinc/61/67/67/1427616767.db2.gz HJFFYIULMNYPAW-UHFFFAOYSA-N 0 0 379.354 3.012 20 5 GGBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000175244316 1427623313 /nfs/dbraw/zinc/62/33/13/1427623313.db2.gz UIESFZWQTNDSAT-HOTGVXAUSA-N 0 0 389.481 3.278 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(=S)n(CN3CCC(OC[C@H]4CCCO4)CC3)c2c1 ZINC000175251693 1427626647 /nfs/dbraw/zinc/62/66/47/1427626647.db2.gz NNTGQEABYKZXMZ-OAHLLOKOSA-N 0 0 393.465 3.489 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000175266283 1427634834 /nfs/dbraw/zinc/63/48/34/1427634834.db2.gz MQEDKGFUVJCZSW-UHFFFAOYSA-N 0 0 397.479 3.129 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)NCc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000175265906 1427634928 /nfs/dbraw/zinc/63/49/28/1427634928.db2.gz RRCRXKKWDYVILG-GFCCVEGCSA-N 0 0 397.391 3.214 20 5 GGBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000175269461 1427637246 /nfs/dbraw/zinc/63/72/46/1427637246.db2.gz ATBUFIVFMXKAAC-HZPDHXFCSA-N 0 0 375.450 3.230 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NC[C@@H](c2cccnc2)C(C)C)cc([N+](=O)[O-])c1 ZINC000175270334 1427638185 /nfs/dbraw/zinc/63/81/85/1427638185.db2.gz FNEYHHVSQIAXES-GOSISDBHSA-N 0 0 385.420 3.336 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCc1c[nH]c2c1cccc2C ZINC000175289916 1427650037 /nfs/dbraw/zinc/65/00/37/1427650037.db2.gz VQMQVQURCUZKRC-UHFFFAOYSA-N 0 0 382.420 3.435 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c(C)o1 ZINC000175307191 1427665718 /nfs/dbraw/zinc/66/57/18/1427665718.db2.gz HITBIYIZTCSAFQ-QGZVFWFLSA-N 0 0 399.350 3.435 20 5 GGBDRN Cc1c(C(=O)Oc2ccc(N3CCCC3)cc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000175309900 1427668033 /nfs/dbraw/zinc/66/80/33/1427668033.db2.gz FYSYOFBDCNSVJQ-UHFFFAOYSA-N 0 0 393.403 3.303 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@H]3c4ccccc4C[C@@H]3O)cc2[N+](=O)[O-])CC1 ZINC000175317690 1427673874 /nfs/dbraw/zinc/67/38/74/1427673874.db2.gz KUXMGQKQFHURBW-SFTDATJTSA-N 0 0 395.459 3.219 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N(C)c2ccc(Br)nc2)cc1[N+](=O)[O-] ZINC000175321262 1427676532 /nfs/dbraw/zinc/67/65/32/1427676532.db2.gz FZELKPOCJRPEQL-UHFFFAOYSA-N 0 0 395.169 3.246 20 5 GGBDRN C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc(Cc2ccccc2)no1 ZINC000175321762 1427676672 /nfs/dbraw/zinc/67/66/72/1427676672.db2.gz SQJRRPZBZUIQKB-CQSZACIVSA-N 0 0 395.419 3.248 20 5 GGBDRN O=c1ccc2cc(S(=O)(=O)Oc3cc([N+](=O)[O-])ccc3Cl)ccc2o1 ZINC000175322308 1427677672 /nfs/dbraw/zinc/67/76/72/1427677672.db2.gz NQCBNCXJLPIJSU-UHFFFAOYSA-N 0 0 381.749 3.122 20 5 GGBDRN NC(=O)c1c(Cl)cccc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000175334596 1427686790 /nfs/dbraw/zinc/68/67/90/1427686790.db2.gz TUUUVNCNMLGIJN-UHFFFAOYSA-N 0 0 398.600 3.362 20 5 GGBDRN CCCNS(=O)(=O)c1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 ZINC000175335340 1427687819 /nfs/dbraw/zinc/68/78/19/1427687819.db2.gz XBVGRHLXTUQXOE-UHFFFAOYSA-N 0 0 397.840 3.189 20 5 GGBDRN C[C@H]1CN(C(C)(C)CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000175338075 1427689190 /nfs/dbraw/zinc/68/91/90/1427689190.db2.gz GDDNXNFPXPZQJX-GJZGRUSLSA-N 0 0 392.500 3.017 20 5 GGBDRN C[C@@H]1CN(C(C)(C)CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000175338058 1427689531 /nfs/dbraw/zinc/68/95/31/1427689531.db2.gz GDDNXNFPXPZQJX-GASCZTMLSA-N 0 0 392.500 3.017 20 5 GGBDRN Cc1cc(=O)c(C(=O)Nc2cccc(F)c2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000175337982 1427689588 /nfs/dbraw/zinc/68/95/88/1427689588.db2.gz NUXKZVWHGSTNAM-UHFFFAOYSA-N 0 0 382.351 3.149 20 5 GGBDRN COc1ccc([C@H](O)CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000175349782 1427696971 /nfs/dbraw/zinc/69/69/71/1427696971.db2.gz PKMFZNFVLNUAPS-OAHLLOKOSA-N 0 0 384.310 3.086 20 5 GGBDRN CC(C)CC(C)(C)CNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000175352955 1427699908 /nfs/dbraw/zinc/69/99/08/1427699908.db2.gz WVLJQTOQOPQIOV-ZDUSSCGKSA-N 0 0 381.498 3.449 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1C(=O)N(C)C ZINC000175356033 1427702123 /nfs/dbraw/zinc/70/21/23/1427702123.db2.gz MOGBWOIPPVCISZ-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN O=C(NCc1ccccc1CN1CCCC1=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175357546 1427703740 /nfs/dbraw/zinc/70/37/40/1427703740.db2.gz QHUWQFKXLVZNAE-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN O=C(Nc1ccc(F)cn1)c1ccc(C(=O)Nc2ccc(F)cn2)c([N+](=O)[O-])c1 ZINC000175357843 1427703881 /nfs/dbraw/zinc/70/38/81/1427703881.db2.gz YHIZHAVWSJASRU-UHFFFAOYSA-N 0 0 399.313 3.168 20 5 GGBDRN CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175360528 1427705145 /nfs/dbraw/zinc/70/51/45/1427705145.db2.gz ZLUOVLOJNOUPPG-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN CSc1nnnn1-c1cccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1 ZINC000175360775 1427705774 /nfs/dbraw/zinc/70/57/74/1427705774.db2.gz AVBUHJSRFUZHQN-UHFFFAOYSA-N 0 0 390.812 3.198 20 5 GGBDRN C[C@H](NC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000175362502 1427706897 /nfs/dbraw/zinc/70/68/97/1427706897.db2.gz GZFMHNNJSGOMMI-KPZWWZAWSA-N 0 0 381.404 3.121 20 5 GGBDRN C[C@@H](NC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000175362513 1427706942 /nfs/dbraw/zinc/70/69/42/1427706942.db2.gz GZFMHNNJSGOMMI-KZULUSFZSA-N 0 0 381.404 3.121 20 5 GGBDRN C[C@@H](NC(=O)N1CCC(OC[C@@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000175379505 1427719581 /nfs/dbraw/zinc/71/95/81/1427719581.db2.gz TZAWEWCIYIVARU-KDOFPFPSSA-N 0 0 377.441 3.025 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1nccn1CCc1ccccc1 ZINC000175382600 1427721195 /nfs/dbraw/zinc/72/11/95/1427721195.db2.gz YYRNDXXTGBPZJY-UHFFFAOYSA-N 0 0 393.447 3.076 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H](C)CC ZINC000175382962 1427721338 /nfs/dbraw/zinc/72/13/38/1427721338.db2.gz GLBDWQKVRBTVLS-NOZJJQNGSA-N 0 0 376.331 3.321 20 5 GGBDRN COc1ccccc1[C@H](CC(C)C)NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000175384282 1427722820 /nfs/dbraw/zinc/72/28/20/1427722820.db2.gz GDNDWOOIRDJMHQ-SFHVURJKSA-N 0 0 399.447 3.237 20 5 GGBDRN CC(C)(NC(=O)NCc1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000175386746 1427724891 /nfs/dbraw/zinc/72/48/91/1427724891.db2.gz WWWUNMYSGGJVDI-UHFFFAOYSA-N 0 0 396.447 3.456 20 5 GGBDRN O=C(NCc1nccn1CCCc1ccccc1)NCc1cccc([N+](=O)[O-])c1 ZINC000175390656 1427727726 /nfs/dbraw/zinc/72/77/26/1427727726.db2.gz FRMBCVBSWLXFEK-UHFFFAOYSA-N 0 0 393.447 3.424 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N(CC2CCC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000175396474 1427730500 /nfs/dbraw/zinc/73/05/00/1427730500.db2.gz MFKUEIFXUXMLTH-UHFFFAOYSA-N 0 0 388.445 3.445 20 5 GGBDRN CN(CCCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000175398360 1427731216 /nfs/dbraw/zinc/73/12/16/1427731216.db2.gz QWLQOFKXTGHPAT-UHFFFAOYSA-N 0 0 376.379 3.013 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc3cc(F)ccc3n2C)cc1OC ZINC000175401671 1427733791 /nfs/dbraw/zinc/73/37/91/1427733791.db2.gz CMXOOWQFTKOQSL-UHFFFAOYSA-N 0 0 388.355 3.280 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)c([N+](=O)[O-])cc1OC ZINC000175408148 1427737443 /nfs/dbraw/zinc/73/74/43/1427737443.db2.gz KMZSSWMFJKWGTR-ZDUSSCGKSA-N 0 0 396.403 3.289 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000175415557 1427742837 /nfs/dbraw/zinc/74/28/37/1427742837.db2.gz RCQXSGKDQDXIPY-JGTBNHKDSA-N 0 0 390.461 3.392 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(c2cc(F)ccc2F)CC1 ZINC000175424208 1427746969 /nfs/dbraw/zinc/74/69/69/1427746969.db2.gz DKTVDBNDVNFUSK-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN COc1cccc([C@@H](C)CC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000175425516 1427747435 /nfs/dbraw/zinc/74/74/35/1427747435.db2.gz OZXZXFRUVHUSGM-HOCLYGCPSA-N 0 0 384.436 3.205 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000175426368 1427748561 /nfs/dbraw/zinc/74/85/61/1427748561.db2.gz QJXVUOFXWZLTCY-CANCMXDXSA-N 0 0 396.490 3.022 20 5 GGBDRN CCC(CC)[C@@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])N1CCOCC1 ZINC000175431232 1427751430 /nfs/dbraw/zinc/75/14/30/1427751430.db2.gz NGQXWEHPFPHSGJ-MRXNPFEDSA-N 0 0 383.876 3.115 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000175433928 1427753041 /nfs/dbraw/zinc/75/30/41/1427753041.db2.gz UWRWZNQUZGZBEN-HNNXBMFYSA-N 0 0 380.404 3.427 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000175436859 1427754161 /nfs/dbraw/zinc/75/41/61/1427754161.db2.gz LKFVQWAFHYLCDC-CYBMUJFWSA-N 0 0 385.445 3.413 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000175438224 1427755041 /nfs/dbraw/zinc/75/50/41/1427755041.db2.gz WZNGPABGDJXUOU-MRXNPFEDSA-N 0 0 379.416 3.351 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175438195 1427755047 /nfs/dbraw/zinc/75/50/47/1427755047.db2.gz AXHGLQRHMMTHHO-HNNXBMFYSA-N 0 0 379.416 3.351 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175441170 1427756391 /nfs/dbraw/zinc/75/63/91/1427756391.db2.gz ZUMNOINFDWBHPB-KRWDZBQOSA-N 0 0 393.443 3.280 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175444248 1427757799 /nfs/dbraw/zinc/75/77/99/1427757799.db2.gz CZYWHJHSNAMQBV-ZDUSSCGKSA-N 0 0 385.445 3.413 20 5 GGBDRN CC1(C)CCC(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000175445007 1427758253 /nfs/dbraw/zinc/75/82/53/1427758253.db2.gz PJJXHZAXHBXSFT-UHFFFAOYSA-N 0 0 388.468 3.031 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000175445513 1427758491 /nfs/dbraw/zinc/75/84/91/1427758491.db2.gz MWMILLXIIKSDCJ-CQSZACIVSA-N 0 0 397.406 3.490 20 5 GGBDRN CC(C)(NC(=O)NCC(=O)N1CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000175447275 1427759766 /nfs/dbraw/zinc/75/97/66/1427759766.db2.gz FKTLPWGUNFTFDV-UHFFFAOYSA-N 0 0 396.447 3.109 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1noc(Cc2ccccc2)n1 ZINC000175456671 1427764865 /nfs/dbraw/zinc/76/48/65/1427764865.db2.gz NSIQNSOFACIIKI-CYBMUJFWSA-N 0 0 381.392 3.129 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000175456870 1427765018 /nfs/dbraw/zinc/76/50/18/1427765018.db2.gz FXMZADODMAMBAI-GDBMZVCRSA-N 0 0 375.450 3.454 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000175456833 1427765214 /nfs/dbraw/zinc/76/52/14/1427765214.db2.gz FXMZADODMAMBAI-ZBFHGGJFSA-N 0 0 375.450 3.454 20 5 GGBDRN CN(Cc1ccccc1N1CCCC1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000175459153 1427766801 /nfs/dbraw/zinc/76/68/01/1427766801.db2.gz LHOQVQCACCBQFE-UHFFFAOYSA-N 0 0 375.450 3.016 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCC(OC[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000175463191 1427768447 /nfs/dbraw/zinc/76/84/47/1427768447.db2.gz WLJSKYIZMRRACL-YJBOKZPZSA-N 0 0 391.468 3.334 20 5 GGBDRN O=C([C@@H]1C[C@]12CCc1ccccc12)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000175468701 1427771173 /nfs/dbraw/zinc/77/11/73/1427771173.db2.gz INAYEGPPUOPDOO-UNMCSNQZSA-N 0 0 377.444 3.148 20 5 GGBDRN O=C([C@H]1C[C@@]12CCc1ccccc12)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000175468643 1427771227 /nfs/dbraw/zinc/77/12/27/1427771227.db2.gz INAYEGPPUOPDOO-IFMALSPDSA-N 0 0 377.444 3.148 20 5 GGBDRN O=C([C@@H]1C[C@@]12CCc1ccccc12)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000175468682 1427771406 /nfs/dbraw/zinc/77/14/06/1427771406.db2.gz INAYEGPPUOPDOO-RBBKRZOGSA-N 0 0 377.444 3.148 20 5 GGBDRN CC(C)[C@H](CNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccnc1 ZINC000175471821 1427773216 /nfs/dbraw/zinc/77/32/16/1427773216.db2.gz SLBNAFDDOQKPGH-FQEVSTJZSA-N 0 0 397.479 3.261 20 5 GGBDRN O=C(NCCNC(=O)c1cccc(Cl)c1[N+](=O)[O-])c1ccccc1Cl ZINC000175474587 1427774525 /nfs/dbraw/zinc/77/45/25/1427774525.db2.gz RZPCPHOSSXPOCP-UHFFFAOYSA-N 0 0 382.203 3.061 20 5 GGBDRN CC(C)[C@@H](CNC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cccnc1 ZINC000175481780 1427778686 /nfs/dbraw/zinc/77/86/86/1427778686.db2.gz XUDDGCMCRAOIQY-GOSISDBHSA-N 0 0 397.479 3.261 20 5 GGBDRN C[C@H]1CCCN(C(=O)C2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)C1 ZINC000175482041 1427779260 /nfs/dbraw/zinc/77/92/60/1427779260.db2.gz PTAGQBXWOSQQBU-ZDUSSCGKSA-N 0 0 393.871 3.359 20 5 GGBDRN O=C(Nc1cccc(N2CCCS2(=O)=O)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175487627 1427783189 /nfs/dbraw/zinc/78/31/89/1427783189.db2.gz LSOKVIWNNBPQIY-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN CC(C)[C@H](CNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1cccnc1 ZINC000175499650 1427791110 /nfs/dbraw/zinc/79/11/10/1427791110.db2.gz RDTWLHAIVVIUFJ-FQEVSTJZSA-N 0 0 397.479 3.261 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1nccn1CCc1ccccc1 ZINC000175506675 1427795285 /nfs/dbraw/zinc/79/52/85/1427795285.db2.gz ABNUSELWWDTQRL-UHFFFAOYSA-N 0 0 393.447 3.376 20 5 GGBDRN COc1ccc(OC(=O)c2ccc(Br)cc2[N+](=O)[O-])c([N+](=O)[O-])c1 ZINC000175519120 1427801703 /nfs/dbraw/zinc/80/17/03/1427801703.db2.gz JGSINIPXTDPVRW-UHFFFAOYSA-N 0 0 397.137 3.493 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000175536227 1427807273 /nfs/dbraw/zinc/80/72/73/1427807273.db2.gz DOMZOOCVJPDEMJ-CQSZACIVSA-N 0 0 385.420 3.277 20 5 GGBDRN Cc1cc(C)c2c(c1)CCCN2C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175537219 1427807894 /nfs/dbraw/zinc/80/78/94/1427807894.db2.gz CYJPWLNSQIQOHM-UHFFFAOYSA-N 0 0 399.472 3.382 20 5 GGBDRN C[C@H](NC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000175539133 1427808727 /nfs/dbraw/zinc/80/87/27/1427808727.db2.gz BMRKRZDLOOGUBC-OXJNMPFZSA-N 0 0 383.448 3.063 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(CC(F)(F)F)cc1 ZINC000175549767 1427812134 /nfs/dbraw/zinc/81/21/34/1427812134.db2.gz VINLOVBVAJIVCL-UHFFFAOYSA-N 0 0 381.310 3.068 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCn2c(nnc2-c2ccccc2)C1 ZINC000175552606 1427812705 /nfs/dbraw/zinc/81/27/05/1427812705.db2.gz JSZUSPFNPVGCFJ-UHFFFAOYSA-N 0 0 383.795 3.163 20 5 GGBDRN O=C(NC[C@@H](O)c1ccccc1F)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000175559260 1427814552 /nfs/dbraw/zinc/81/45/52/1427814552.db2.gz NKPANYGFYVIYLD-LJQANCHMSA-N 0 0 387.411 3.188 20 5 GGBDRN O=C(Nc1ccc(-n2cncn2)cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175563436 1427816142 /nfs/dbraw/zinc/81/61/42/1427816142.db2.gz MVJHTGNOXVUCAM-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CNC(=O)[C@H](C)CN(C)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000175583254 1427822303 /nfs/dbraw/zinc/82/23/03/1427822303.db2.gz NDHBDEBHTLUBOA-CYBMUJFWSA-N 0 0 381.498 3.187 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)c3cccc(Cl)c3[N+](=O)[O-])cn2)n1 ZINC000175591146 1427824799 /nfs/dbraw/zinc/82/47/99/1427824799.db2.gz OXSXJKDLSHNNPJ-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 ZINC000175599184 1427827344 /nfs/dbraw/zinc/82/73/44/1427827344.db2.gz BKDHFTKECKNDQK-UHFFFAOYSA-N 0 0 384.779 3.465 20 5 GGBDRN O=Cc1cc(F)c(OS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(F)c1 ZINC000175613656 1427832277 /nfs/dbraw/zinc/83/22/77/1427832277.db2.gz SMKRTFLWQNZXAM-UHFFFAOYSA-N 0 0 377.708 3.107 20 5 GGBDRN COc1cc(C(=O)NCc2cc(N(C)C)nc3ccccc23)ccc1[N+](=O)[O-] ZINC000175620366 1427834304 /nfs/dbraw/zinc/83/43/04/1427834304.db2.gz UIBHKEDJZHBDRF-UHFFFAOYSA-N 0 0 380.404 3.148 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(N(C)C)nc2ccccc12 ZINC000175620396 1427834329 /nfs/dbraw/zinc/83/43/29/1427834329.db2.gz UNTCCHJBQVNNFG-UHFFFAOYSA-N 0 0 380.404 3.148 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000175621040 1427834999 /nfs/dbraw/zinc/83/49/99/1427834999.db2.gz QSASNVVKWARDQC-NRRJATNASA-N 0 0 375.450 3.201 20 5 GGBDRN Cc1nc(NC(=O)[C@@H](NC(=O)c2ccccc2Cl)C(C)C)ccc1[N+](=O)[O-] ZINC000175673213 1427852411 /nfs/dbraw/zinc/85/24/11/1427852411.db2.gz NKWGAKKSUIGBIP-INIZCTEOSA-N 0 0 390.827 3.345 20 5 GGBDRN Cc1nc(NC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000175680688 1427855160 /nfs/dbraw/zinc/85/51/60/1427855160.db2.gz LWLBHFBVFSBXCZ-UHFFFAOYSA-N 0 0 396.447 3.108 20 5 GGBDRN Cc1cccc(OC[C@H](O)CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000175685854 1427856747 /nfs/dbraw/zinc/85/67/47/1427856747.db2.gz VLCSNYGQVQWQLY-CYBMUJFWSA-N 0 0 398.337 3.092 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)COc2ccc(C(F)(F)F)cc2)c1 ZINC000175689023 1427858208 /nfs/dbraw/zinc/85/82/08/1427858208.db2.gz CBNBWVBJDMALAD-ZDUSSCGKSA-N 0 0 398.337 3.092 20 5 GGBDRN CCN(C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1)CC(F)(F)F ZINC000175690036 1427858689 /nfs/dbraw/zinc/85/86/89/1427858689.db2.gz GDMTZNCMTQKWBN-NSHDSACASA-N 0 0 377.338 3.080 20 5 GGBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000175693395 1427860806 /nfs/dbraw/zinc/86/08/06/1427860806.db2.gz IMGALZNIFNHYKN-ACJLOTCBSA-N 0 0 388.445 3.017 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000175693415 1427860922 /nfs/dbraw/zinc/86/09/22/1427860922.db2.gz IMGALZNIFNHYKN-UGSOOPFHSA-N 0 0 388.445 3.017 20 5 GGBDRN CCNC(=O)c1cccc(OC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000175711102 1427867122 /nfs/dbraw/zinc/86/71/22/1427867122.db2.gz HWGHOZBFXNNBLZ-UHFFFAOYSA-N 0 0 393.193 3.326 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175724658 1427870723 /nfs/dbraw/zinc/87/07/23/1427870723.db2.gz WGSFECUPJBKZIF-SANMLTNESA-N 0 0 375.450 3.067 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c1[N+](=O)[O-] ZINC000175730543 1427871864 /nfs/dbraw/zinc/87/18/64/1427871864.db2.gz NCBOIPHGPJCXQX-UHFFFAOYSA-N 0 0 382.351 3.259 20 5 GGBDRN Cc1cc(F)cc(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)c1[N+](=O)[O-] ZINC000175730716 1427871908 /nfs/dbraw/zinc/87/19/08/1427871908.db2.gz MYKIIOLHHFVMBY-CYBMUJFWSA-N 0 0 383.383 3.456 20 5 GGBDRN CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000175733047 1427872841 /nfs/dbraw/zinc/87/28/41/1427872841.db2.gz IGGFWCMOOKTOCT-UHFFFAOYSA-N 0 0 389.383 3.152 20 5 GGBDRN COc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000175735236 1427873605 /nfs/dbraw/zinc/87/36/05/1427873605.db2.gz YZESOMFSNDSZOG-UHFFFAOYSA-N 0 0 375.356 3.005 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175734889 1427873645 /nfs/dbraw/zinc/87/36/45/1427873645.db2.gz IEJMCVYRYRGQLM-AWEZNQCLSA-N 0 0 384.436 3.213 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000175736499 1427874186 /nfs/dbraw/zinc/87/41/86/1427874186.db2.gz VHAOHIFTKGRNDD-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN CN1C(=O)COc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc21 ZINC000175742393 1427876141 /nfs/dbraw/zinc/87/61/41/1427876141.db2.gz VGOKPCNIJCYHSS-UHFFFAOYSA-N 0 0 383.385 3.417 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccnc(-n3cccn3)c2)cc1[N+](=O)[O-] ZINC000175742768 1427876655 /nfs/dbraw/zinc/87/66/55/1427876655.db2.gz FTBDXUOCBNEGAZ-AWEZNQCLSA-N 0 0 380.408 3.044 20 5 GGBDRN Cc1nc(-c2ccccc2)oc1C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000175761959 1427882513 /nfs/dbraw/zinc/88/25/13/1427882513.db2.gz BDRBRCBBJHWWRU-UHFFFAOYSA-N 0 0 381.344 3.354 20 5 GGBDRN Cc1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])c(OCC(=O)N(C)C)c1 ZINC000175768652 1427885918 /nfs/dbraw/zinc/88/59/18/1427885918.db2.gz FJZWISSHHOBOCQ-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN NC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)o1 ZINC000175770786 1427887220 /nfs/dbraw/zinc/88/72/20/1427887220.db2.gz WNPONGLVPYOXHE-UHFFFAOYSA-N 0 0 381.344 3.009 20 5 GGBDRN CCOC(=O)CN(Cc1ccccc1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175779280 1427890138 /nfs/dbraw/zinc/89/01/38/1427890138.db2.gz AHHXOUXGNFHUND-UHFFFAOYSA-N 0 0 376.796 3.454 20 5 GGBDRN CCOC(=O)c1ccnc(N2CC[C@H](OCCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000175783148 1427891228 /nfs/dbraw/zinc/89/12/28/1427891228.db2.gz WAIGBFPVKVESGR-KRWDZBQOSA-N 0 0 399.447 3.395 20 5 GGBDRN C[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000175803384 1427898650 /nfs/dbraw/zinc/89/86/50/1427898650.db2.gz XNDSEZFYVZWCQB-LBPRGKRZSA-N 0 0 399.382 3.387 20 5 GGBDRN Cc1cc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)ccc1-n1cncn1 ZINC000175807400 1427901335 /nfs/dbraw/zinc/90/13/35/1427901335.db2.gz CUTGAERSJCDLHA-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@@H](C)C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000175807346 1427901530 /nfs/dbraw/zinc/90/15/30/1427901530.db2.gz CBDIECVTLQFEMN-LLVKDONJSA-N 0 0 382.424 3.153 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccc1O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000175820256 1427910080 /nfs/dbraw/zinc/91/00/80/1427910080.db2.gz ZTSYMVCEAIAQFZ-UHFFFAOYSA-N 0 0 393.281 3.152 20 5 GGBDRN Cc1ccc(NCCCNC(=O)Nc2ccc([S@](C)=O)cc2)c([N+](=O)[O-])c1 ZINC000175834363 1427918521 /nfs/dbraw/zinc/91/85/21/1427918521.db2.gz CVGNWWUXRFFJQO-MHZLTWQESA-N 0 0 390.465 3.264 20 5 GGBDRN 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XZKOVBOPPJXIDQ-UHFFFAOYSA-N 0 0 397.416 3.288 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175957740 1427997139 /nfs/dbraw/zinc/99/71/39/1427997139.db2.gz RGPDIOOFBCZFST-QWHCGFSZSA-N 0 0 381.860 3.405 20 5 GGBDRN Cc1c(C(=O)N(CC(F)(F)F)C2CCC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000175969844 1428004557 /nfs/dbraw/zinc/00/45/57/1428004557.db2.gz URZZGEHVPIDTFJ-UHFFFAOYSA-N 0 0 383.330 3.041 20 5 GGBDRN CCNC(=O)c1ccc(OC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000175977862 1428010020 /nfs/dbraw/zinc/01/00/20/1428010020.db2.gz UZTACUCTNWOLKI-UHFFFAOYSA-N 0 0 393.193 3.326 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCc1ccc([N+](=O)[O-])cc1 ZINC000175984066 1428012419 /nfs/dbraw/zinc/01/24/19/1428012419.db2.gz HWAGEVMNUSLYHV-UHFFFAOYSA-N 0 0 394.181 3.124 20 5 GGBDRN Cc1nn(C)c(Cl)c1COC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175984962 1428012748 /nfs/dbraw/zinc/01/27/48/1428012748.db2.gz GYQJKFJKRKHGOR-UHFFFAOYSA-N 0 0 388.605 3.410 20 5 GGBDRN 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ZINC000176034700 1428038295 /nfs/dbraw/zinc/03/82/95/1428038295.db2.gz VJIKEZKJTSANMH-UHFFFAOYSA-N 0 0 380.404 3.038 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCC(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000176050063 1428050440 /nfs/dbraw/zinc/05/04/40/1428050440.db2.gz WARCCZXCZOHNHW-HNNXBMFYSA-N 0 0 376.457 3.056 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H](C)c1nc2cc(Cl)ccc2n1C ZINC000176050449 1428050636 /nfs/dbraw/zinc/05/06/36/1428050636.db2.gz KDARWUGLAFGGAO-JTQLQIEISA-N 0 0 391.815 3.334 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(CCCO)[C@@H]1CCc2ccccc21 ZINC000176050850 1428050914 /nfs/dbraw/zinc/05/09/14/1428050914.db2.gz HEGKAKGASLQIJF-LJQANCHMSA-N 0 0 399.447 3.185 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCCNC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000176051091 1428051672 /nfs/dbraw/zinc/05/16/72/1428051672.db2.gz ZGVQTMKINVJTRB-ZDUSSCGKSA-N 0 0 390.465 3.145 20 5 GGBDRN O=c1c2cc(Br)ccc2ncn1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000176053400 1428052978 /nfs/dbraw/zinc/05/29/78/1428052978.db2.gz GKMMXHXIIDVILF-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN Cc1cccc(OCCN(C)S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)c1 ZINC000176057753 1428056442 /nfs/dbraw/zinc/05/64/42/1428056442.db2.gz HATVGONGHHKXIL-UHFFFAOYSA-N 0 0 382.413 3.050 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000176071504 1428067017 /nfs/dbraw/zinc/06/70/17/1428067017.db2.gz WNUDEIUCCMURJJ-UHFFFAOYSA-N 0 0 388.387 3.447 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c(N)c([N+](=O)[O-])c1 ZINC000176071746 1428067872 /nfs/dbraw/zinc/06/78/72/1428067872.db2.gz CYKQFTLPNHWOPY-UHFFFAOYSA-N 0 0 382.420 3.364 20 5 GGBDRN C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 ZINC000176077721 1428070544 /nfs/dbraw/zinc/07/05/44/1428070544.db2.gz RHNSZHLCYSMYHU-AWEZNQCLSA-N 0 0 383.404 3.361 20 5 GGBDRN C[C@H](O)CC(C)(C)CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000176083308 1428073106 /nfs/dbraw/zinc/07/31/06/1428073106.db2.gz QZEZSYGXOPJJIZ-NSHDSACASA-N 0 0 391.390 3.329 20 5 GGBDRN CC1CCN(C(=O)c2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2N)CC1 ZINC000176088092 1428075876 /nfs/dbraw/zinc/07/58/76/1428075876.db2.gz MFQVPAWMJKSYJQ-UHFFFAOYSA-N 0 0 382.420 3.301 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000176089164 1428076622 /nfs/dbraw/zinc/07/66/22/1428076622.db2.gz AOAZAMGYNZTSGK-HNNXBMFYSA-N 0 0 394.214 3.437 20 5 GGBDRN C[C@@H](O)CC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000176102743 1428084358 /nfs/dbraw/zinc/08/43/58/1428084358.db2.gz VYUYCWOVNCXXIP-OAHLLOKOSA-N 0 0 377.485 3.358 20 5 GGBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000176110059 1428088460 /nfs/dbraw/zinc/08/84/60/1428088460.db2.gz ATDPWJWITYFBTA-ZDUSSCGKSA-N 0 0 384.379 3.063 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000176109933 1428088794 /nfs/dbraw/zinc/08/87/94/1428088794.db2.gz WHEMQKZSNVZXSA-HNNXBMFYSA-N 0 0 382.844 3.439 20 5 GGBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCN(c2cc(F)ccc2F)CC1 ZINC000176117755 1428093463 /nfs/dbraw/zinc/09/34/63/1428093463.db2.gz HWNUBIVVCQHNSE-UHFFFAOYSA-N 0 0 383.301 3.114 20 5 GGBDRN CC(C)(C)OC(=O)N(CCNC(=O)c1cccc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000176120090 1428094796 /nfs/dbraw/zinc/09/47/96/1428094796.db2.gz XNDYWTNYWRELKJ-UHFFFAOYSA-N 0 0 383.832 3.378 20 5 GGBDRN C[C@@H](O)CC(C)(C)CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000176122641 1428096815 /nfs/dbraw/zinc/09/68/15/1428096815.db2.gz GEEOIXWJMWTFAZ-OAHLLOKOSA-N 0 0 377.485 3.358 20 5 GGBDRN COc1cccc2c1OC[C@H](NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000176122728 1428096857 /nfs/dbraw/zinc/09/68/57/1428096857.db2.gz OAQNRUDGLKSIBX-XJKSGUPXSA-N 0 0 385.420 3.276 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@H]1[C@H]1CCCCC1=O ZINC000176128093 1428100702 /nfs/dbraw/zinc/10/07/02/1428100702.db2.gz XPJVVOZCJXPOCI-AEFFLSMTSA-N 0 0 382.420 3.144 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@@H]1[C@H]1CCCCC1=O ZINC000176128077 1428100707 /nfs/dbraw/zinc/10/07/07/1428100707.db2.gz XPJVVOZCJXPOCI-SJLPKXTDSA-N 0 0 382.420 3.144 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC[C@H]1[C@@H]1CCCCC1=O ZINC000176157147 1428125738 /nfs/dbraw/zinc/12/57/38/1428125738.db2.gz VLKRPDWOMBSGEQ-HOTGVXAUSA-N 0 0 382.420 3.144 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000176166263 1428132015 /nfs/dbraw/zinc/13/20/15/1428132015.db2.gz PEWWXFCCDSTBMP-LJQANCHMSA-N 0 0 396.399 3.329 20 5 GGBDRN Cc1c(C(=O)OC[C@H]2CC(=O)N(CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000176172498 1428137574 /nfs/dbraw/zinc/13/75/74/1428137574.db2.gz FRBSAIDJBRPJRD-KRWDZBQOSA-N 0 0 382.416 3.151 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000176172613 1428137910 /nfs/dbraw/zinc/13/79/10/1428137910.db2.gz GJUYZMFQEVWIOP-LJQANCHMSA-N 0 0 396.399 3.329 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000176178176 1428142433 /nfs/dbraw/zinc/14/24/33/1428142433.db2.gz 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1429885044 /nfs/dbraw/zinc/88/50/44/1429885044.db2.gz YLVIQPAEKYBSCQ-MRXNPFEDSA-N 0 0 387.440 3.109 20 5 GGBDRN CCC(CC)n1nc(C(=O)Nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)cc1C ZINC000180506953 1429885113 /nfs/dbraw/zinc/88/51/13/1429885113.db2.gz DXSUGPICWCPWEE-UHFFFAOYSA-N 0 0 383.412 3.498 20 5 GGBDRN Cc1c(OC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)cccc1[N+](=O)[O-] ZINC000180509318 1429885693 /nfs/dbraw/zinc/88/56/93/1429885693.db2.gz XXCNLMHNSBXEMB-UHFFFAOYSA-N 0 0 377.418 3.233 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@]2(C)CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000180508388 1429885756 /nfs/dbraw/zinc/88/57/56/1429885756.db2.gz GQKNTVMIVUKBEP-NRFANRHFSA-N 0 0 381.432 3.252 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000180520834 1429888773 /nfs/dbraw/zinc/88/87/73/1429888773.db2.gz LDHPPLNSSVZPSK-IAGOWNOFSA-N 0 0 377.347 3.202 20 5 GGBDRN C[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000180526095 1429889938 /nfs/dbraw/zinc/88/99/38/1429889938.db2.gz JRHWRNBXTMOGSV-GFCCVEGCSA-N 0 0 397.884 3.349 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 ZINC000180536211 1429892442 /nfs/dbraw/zinc/89/24/42/1429892442.db2.gz VBAWMORGHLKNPS-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN CCN(CC)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000180541450 1429893609 /nfs/dbraw/zinc/89/36/09/1429893609.db2.gz MJSXXPFMEJGVTE-UHFFFAOYSA-N 0 0 394.378 3.367 20 5 GGBDRN COc1cc(CCNC(=O)N[C@@H]2CC23CCCCC3)c([N+](=O)[O-])cc1OC ZINC000180544548 1429894288 /nfs/dbraw/zinc/89/42/88/1429894288.db2.gz RPZJWJVBWCLNSV-QGZVFWFLSA-N 0 0 377.441 3.177 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccn1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000180550215 1429895751 /nfs/dbraw/zinc/89/57/51/1429895751.db2.gz FTFAJNPNVZQPMZ-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN C[C@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000180564098 1429899004 /nfs/dbraw/zinc/89/90/04/1429899004.db2.gz SMNDLIVDCGQRLX-SCRDCRAPSA-N 0 0 379.844 3.015 20 5 GGBDRN 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ZINC000180622097 1429937833 /nfs/dbraw/zinc/93/78/33/1429937833.db2.gz SOFPEAAONSGJJJ-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(CN1CCCCCCC1=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180623241 1429938645 /nfs/dbraw/zinc/93/86/45/1429938645.db2.gz RDEOVYKNCNAXKP-UHFFFAOYSA-N 0 0 384.230 3.089 20 5 GGBDRN CN(C)C(=O)c1cccc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000180623328 1429938725 /nfs/dbraw/zinc/93/87/25/1429938725.db2.gz VKAICEWZALPTCA-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180623087 1429938790 /nfs/dbraw/zinc/93/87/90/1429938790.db2.gz DIGRHWDHYWUQQX-UHFFFAOYSA-N 0 0 396.153 3.283 20 5 GGBDRN Cn1c(=O)oc2c1cccc2C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180624218 1429939208 /nfs/dbraw/zinc/93/92/08/1429939208.db2.gz FOUUXMOXLCRMKN-UHFFFAOYSA-N 0 0 392.165 3.055 20 5 GGBDRN C[C@H](OC[C@H]1CCCCO1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180624435 1429939279 /nfs/dbraw/zinc/93/92/79/1429939279.db2.gz YYTULOCUDKTDCW-CMPLNLGQSA-N 0 0 387.230 3.270 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1ncn(-c2ccccc2)n1 ZINC000180624773 1429939306 /nfs/dbraw/zinc/93/93/06/1429939306.db2.gz HGMGWWHMSZTXRP-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CN(CC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)C(=O)c1cccs1 ZINC000180625317 1429939698 /nfs/dbraw/zinc/93/96/98/1429939698.db2.gz CCMKVKUHGXFDBW-UHFFFAOYSA-N 0 0 398.238 3.130 20 5 GGBDRN Cc1nc([C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])c2ccc(Cl)cc2)no1 ZINC000180628064 1429941221 /nfs/dbraw/zinc/94/12/21/1429941221.db2.gz AWXPZFMWFCEJBM-QGZVFWFLSA-N 0 0 386.795 3.388 20 5 GGBDRN CCCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180627904 1429941532 /nfs/dbraw/zinc/94/15/32/1429941532.db2.gz FYWOAGQYPLPURE-ZDUSSCGKSA-N 0 0 398.257 3.477 20 5 GGBDRN CCCc1csc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000180633501 1429944697 /nfs/dbraw/zinc/94/46/97/1429944697.db2.gz ZUDRQRCHGYHRML-UHFFFAOYSA-N 0 0 375.454 3.358 20 5 GGBDRN 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C[C@H]1C[C@H](C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC(C)(C)C1 ZINC000180694109 1429981617 /nfs/dbraw/zinc/98/16/17/1429981617.db2.gz WMYGOUXOBDNHHT-RDJZCZTQSA-N 0 0 387.480 3.342 20 5 GGBDRN CCCNC(=O)c1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1Cl ZINC000180695993 1429982244 /nfs/dbraw/zinc/98/22/44/1429982244.db2.gz QTEHXFYZHNCJQB-UHFFFAOYSA-N 0 0 376.800 3.223 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F ZINC000180699453 1429985281 /nfs/dbraw/zinc/98/52/81/1429985281.db2.gz UOOSHOMSTAOGOX-LBPRGKRZSA-N 0 0 391.346 3.025 20 5 GGBDRN C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180700704 1429985820 /nfs/dbraw/zinc/98/58/20/1429985820.db2.gz SALMCQWLHMHKBP-JTQLQIEISA-N 0 0 383.326 3.393 20 5 GGBDRN CC(=O)c1ccc(OCCCS(=O)(=O)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000180701982 1429986907 /nfs/dbraw/zinc/98/69/07/1429986907.db2.gz NCSRHSFRFLKOKX-UHFFFAOYSA-N 0 0 377.418 3.349 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000180702838 1429986950 /nfs/dbraw/zinc/98/69/50/1429986950.db2.gz SDOSVMPLAGJWKI-GFCCVEGCSA-N 0 0 375.347 3.325 20 5 GGBDRN CC[C@@]1(C(=O)NCc2ccccc2[N+](=O)[O-])CCCN1C(=O)OC(C)(C)C ZINC000180713479 1429994484 /nfs/dbraw/zinc/99/44/84/1429994484.db2.gz OBUYQLJGKFZDPX-IBGZPJMESA-N 0 0 377.441 3.391 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2nncn2C)CC1 ZINC000180746808 1430015237 /nfs/dbraw/zinc/01/52/37/1430015237.db2.gz IOSRNZFONVOKSM-UHFFFAOYSA-N 0 0 389.481 3.244 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1 ZINC000180754205 1430020404 /nfs/dbraw/zinc/02/04/04/1430020404.db2.gz BOWOVHDQWLOZLO-UHFFFAOYSA-N 0 0 388.277 3.104 20 5 GGBDRN O=C(Nc1cc(Cl)ccc1-n1cccn1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180756636 1430021283 /nfs/dbraw/zinc/02/12/83/1430021283.db2.gz XUEPABMGCUCSOU-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000180764792 1430026473 /nfs/dbraw/zinc/02/64/73/1430026473.db2.gz 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O=[N+]([O-])c1cccc(-c2nc(CN3CCC[C@@H](Cn4ccnn4)C3)cs2)c1 ZINC000180797797 1430046356 /nfs/dbraw/zinc/04/63/56/1430046356.db2.gz QSFSHJGNHSJXRB-CQSZACIVSA-N 0 0 384.465 3.222 20 5 GGBDRN Cc1cc(NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])n(Cc2ccccc2)n1 ZINC000180805441 1430051146 /nfs/dbraw/zinc/05/11/46/1430051146.db2.gz JJLXPIPXHIEASZ-UHFFFAOYSA-N 0 0 386.433 3.090 20 5 GGBDRN Cc1ccccc1Cn1c2ccccc2nc1NC(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000180808052 1430052546 /nfs/dbraw/zinc/05/25/46/1430052546.db2.gz LXRFWHXUPWAKGJ-UHFFFAOYSA-N 0 0 390.403 3.136 20 5 GGBDRN Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)n1 ZINC000180817632 1430056035 /nfs/dbraw/zinc/05/60/35/1430056035.db2.gz LPZKQNXFWGABEH-AWEZNQCLSA-N 0 0 379.420 3.471 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000180827224 1430060578 /nfs/dbraw/zinc/06/05/78/1430060578.db2.gz FOBJSOVTHCKZIR-ZDUSSCGKSA-N 0 0 392.818 3.465 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Oc2nncc3ccccc32)cc1 ZINC000180851947 1430069976 /nfs/dbraw/zinc/06/99/76/1430069976.db2.gz MNZXTIXWRWFUFU-UHFFFAOYSA-N 0 0 390.359 3.166 20 5 GGBDRN Cc1cc(C)cc(C2=CCN(C(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000180868437 1430077727 /nfs/dbraw/zinc/07/77/27/1430077727.db2.gz BCQACBVZXUDRKA-UHFFFAOYSA-N 0 0 393.443 3.257 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCn2cccc2[C@H]1c1ccccc1 ZINC000180872010 1430079815 /nfs/dbraw/zinc/07/98/15/1430079815.db2.gz NOVLWPIXSSXPLQ-LJQANCHMSA-N 0 0 391.383 3.370 20 5 GGBDRN O=C(Nc1n[nH]c(Cc2cccc(F)c2)n1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000180879482 1430084543 /nfs/dbraw/zinc/08/45/43/1430084543.db2.gz VIHWVSJFPGWDAV-UHFFFAOYSA-N 0 0 375.747 3.349 20 5 GGBDRN O=C(Nc1n[nH]c(Cc2cccc(F)c2)n1)c1ccc([N+](=O)[O-])cc1Cl ZINC000180879565 1430084684 /nfs/dbraw/zinc/08/46/84/1430084684.db2.gz NHHVACFOPZQEJW-UHFFFAOYSA-N 0 0 375.747 3.349 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC(c2c[nH]c3ncccc23)CC1 ZINC000180879546 1430084870 /nfs/dbraw/zinc/08/48/70/1430084870.db2.gz SIJNTIIEDJHDRI-UHFFFAOYSA-N 0 0 394.387 3.220 20 5 GGBDRN O=C(CCc1ccc2[nH]ccc2c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000180885340 1430088610 /nfs/dbraw/zinc/08/86/10/1430088610.db2.gz AJOMBHXHORGRRY-INIZCTEOSA-N 0 0 379.420 3.117 20 5 GGBDRN COC1(CNC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000180897341 1430096508 /nfs/dbraw/zinc/09/65/08/1430096508.db2.gz DASFOUGPYFDPCZ-UHFFFAOYSA-N 0 0 375.347 3.101 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2NC1=O ZINC000180926071 1430119235 /nfs/dbraw/zinc/11/92/35/1430119235.db2.gz XFAYYOAFCVSRJQ-JTQLQIEISA-N 0 0 395.824 3.032 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180943629 1430127910 /nfs/dbraw/zinc/12/79/10/1430127910.db2.gz KUIDEANRXQALHS-UHFFFAOYSA-N 0 0 379.420 3.272 20 5 GGBDRN C[C@@]1(c2ccc(F)cc2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000180946093 1430128443 /nfs/dbraw/zinc/12/84/43/1430128443.db2.gz OMPHQILVKXQETN-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN Cc1ccc(CN(CCO)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000180949393 1430130494 /nfs/dbraw/zinc/13/04/94/1430130494.db2.gz QCCDPXHQRKSKQY-UHFFFAOYSA-N 0 0 383.448 3.138 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12 ZINC000180957949 1430135454 /nfs/dbraw/zinc/13/54/54/1430135454.db2.gz NGSJXLJMHVRYLM-INIZCTEOSA-N 0 0 381.432 3.335 20 5 GGBDRN CC1CCN(C(=O)c2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)CC1 ZINC000180964124 1430139591 /nfs/dbraw/zinc/13/95/91/1430139591.db2.gz YHQUKPXLYIIFRP-UHFFFAOYSA-N 0 0 382.420 3.301 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12 ZINC000180972037 1430144135 /nfs/dbraw/zinc/14/41/35/1430144135.db2.gz SPISISLAHHSPFH-UKRRQHHQSA-N 0 0 399.472 3.277 20 5 GGBDRN C[C@H](CCO)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000180973766 1430145401 /nfs/dbraw/zinc/14/54/01/1430145401.db2.gz AIFBYMRIDHSARI-OAHLLOKOSA-N 0 0 382.420 3.418 20 5 GGBDRN C[C@]1(c2ccccc2F)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000180975276 1430146104 /nfs/dbraw/zinc/14/61/04/1430146104.db2.gz GWJZZZNMDAFNHT-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CN1CCN(Cc2nc3ccccc3[nH]2)CC1 ZINC000180979374 1430148843 /nfs/dbraw/zinc/14/88/43/1430148843.db2.gz TYOPHCYPKYFERQ-UHFFFAOYSA-N 0 0 385.855 3.442 20 5 GGBDRN Cc1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1NC(=O)c1ccncc1 ZINC000180985178 1430152480 /nfs/dbraw/zinc/15/24/80/1430152480.db2.gz NIZFDIIDQMEBAH-UHFFFAOYSA-N 0 0 391.387 3.385 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000181009527 1430164780 /nfs/dbraw/zinc/16/47/80/1430164780.db2.gz HCFRTXNFDYPKPE-VIFPVBQESA-N 0 0 385.346 3.165 20 5 GGBDRN CCCN1C(=O)CCc2cc(NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)ccc21 ZINC000181023519 1430172807 /nfs/dbraw/zinc/17/28/07/1430172807.db2.gz UECXTXVYLUWDHD-UHFFFAOYSA-N 0 0 399.451 3.126 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc(F)cc1[N+](=O)[O-] ZINC000181026854 1430174696 /nfs/dbraw/zinc/17/46/96/1430174696.db2.gz WBZARUIUXBQYCH-BBRMVZONSA-N 0 0 397.765 3.369 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000181031435 1430176608 /nfs/dbraw/zinc/17/66/08/1430176608.db2.gz IDXWXWPDWBXSFY-XJKSGUPXSA-N 0 0 396.806 3.323 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc4nncn4c3)cc2[N+](=O)[O-])C1 ZINC000181060019 1430192084 /nfs/dbraw/zinc/19/20/84/1430192084.db2.gz SNFKTRZTBMSVBV-OKILXGFUSA-N 0 0 394.435 3.372 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc4nncn4c3)cc2[N+](=O)[O-])C1 ZINC000181060039 1430192481 /nfs/dbraw/zinc/19/24/81/1430192481.db2.gz SNFKTRZTBMSVBV-KBPBESRZSA-N 0 0 394.435 3.372 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(-n2cnc3ccccc32)cc1 ZINC000181078677 1430200946 /nfs/dbraw/zinc/20/09/46/1430200946.db2.gz XBKMARLCLZJFMI-UHFFFAOYSA-N 0 0 387.399 3.446 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nc2c(s1)C[C@@H](C(C)(C)C)CC2 ZINC000181097940 1430208448 /nfs/dbraw/zinc/20/84/48/1430208448.db2.gz DAPCLVYZFQPWMT-NSHDSACASA-N 0 0 377.470 3.346 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(OCCc2ccccc2)nc1 ZINC000181103923 1430211137 /nfs/dbraw/zinc/21/11/37/1430211137.db2.gz NABCJDHYJAWGBI-UHFFFAOYSA-N 0 0 378.388 3.446 20 5 GGBDRN CCCN1c2ccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)cc2CCC1=O ZINC000181106185 1430212571 /nfs/dbraw/zinc/21/25/71/1430212571.db2.gz UIPIDSHGSPVNRJ-UHFFFAOYSA-N 0 0 382.420 3.427 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] ZINC000181112611 1430214845 /nfs/dbraw/zinc/21/48/45/1430214845.db2.gz SPIXFSWAOYKHBG-YJBOKZPZSA-N 0 0 392.843 3.098 20 5 GGBDRN CCCCN(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1 ZINC000181123589 1430218059 /nfs/dbraw/zinc/21/80/59/1430218059.db2.gz PJQLWKHYJLKLRW-GFCCVEGCSA-N 0 0 389.861 3.069 20 5 GGBDRN Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000181137721 1430222642 /nfs/dbraw/zinc/22/26/42/1430222642.db2.gz DIKYRCAKTKLALD-KRWDZBQOSA-N 0 0 383.448 3.349 20 5 GGBDRN COC[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181143819 1430225370 /nfs/dbraw/zinc/22/53/70/1430225370.db2.gz SRWPZKTUWFKWAM-HNNXBMFYSA-N 0 0 380.347 3.146 20 5 GGBDRN O=C(Nc1ccnn1Cc1ccccn1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000181146735 1430226258 /nfs/dbraw/zinc/22/62/58/1430226258.db2.gz LXQMVZGZYMDEFR-UHFFFAOYSA-N 0 0 392.419 3.431 20 5 GGBDRN O=C(Nc1cc(-c2cccs2)[nH]n1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000181167072 1430234967 /nfs/dbraw/zinc/23/49/67/1430234967.db2.gz CIDMKCDVASMSAG-UHFFFAOYSA-N 0 0 399.432 3.135 20 5 GGBDRN CCOc1cc(N(CCO)Cc2cnn(Cc3ccccc3)c2)ccc1[N+](=O)[O-] ZINC000181204842 1430247187 /nfs/dbraw/zinc/24/71/87/1430247187.db2.gz IZIGDMJNPKIAQE-UHFFFAOYSA-N 0 0 396.447 3.237 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCO[C@H](Cc2ccccc2)C1 ZINC000181213122 1430249262 /nfs/dbraw/zinc/24/92/62/1430249262.db2.gz RKZOJHVUNWWYIF-GOSISDBHSA-N 0 0 381.432 3.253 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCO[C@H](Cc2ccccc2)C1 ZINC000181225721 1430251335 /nfs/dbraw/zinc/25/13/35/1430251335.db2.gz DKZXNBSGOIPISL-LJQANCHMSA-N 0 0 395.459 3.279 20 5 GGBDRN CCCCN(C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)[C@@H]1CCS(=O)(=O)C1 ZINC000181229884 1430252608 /nfs/dbraw/zinc/25/26/08/1430252608.db2.gz DIDLNTGGGALBGY-CQSZACIVSA-N 0 0 383.470 3.033 20 5 GGBDRN O=C(Nc1ccn(Cc2ccncc2)n1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181232718 1430253343 /nfs/dbraw/zinc/25/33/43/1430253343.db2.gz XGCXUSRHWPFALV-UHFFFAOYSA-N 0 0 389.318 3.088 20 5 GGBDRN CCC[C@@H](C)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)n[nH]1 ZINC000181235613 1430253738 /nfs/dbraw/zinc/25/37/38/1430253738.db2.gz UKTACVANWQPTJK-CYBMUJFWSA-N 0 0 387.440 3.310 20 5 GGBDRN CCC[C@H](C)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)n[nH]1 ZINC000181235631 1430253800 /nfs/dbraw/zinc/25/38/00/1430253800.db2.gz UKTACVANWQPTJK-ZDUSSCGKSA-N 0 0 387.440 3.310 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(N2CCCC2=O)CC1 ZINC000181246051 1430256071 /nfs/dbraw/zinc/25/60/71/1430256071.db2.gz ALQRJHFIEXVYMT-UHFFFAOYSA-N 0 0 391.493 3.322 20 5 GGBDRN Cc1cccc(C2=CCN(C(=O)[C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000181252675 1430256886 /nfs/dbraw/zinc/25/68/86/1430256886.db2.gz WJSZBRIJUMNMGP-INIZCTEOSA-N 0 0 393.443 3.337 20 5 GGBDRN Cc1cccc(C2=CCN(C(=O)[C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000181252661 1430256899 /nfs/dbraw/zinc/25/68/99/1430256899.db2.gz WJSZBRIJUMNMGP-MRXNPFEDSA-N 0 0 393.443 3.337 20 5 GGBDRN O=C(NC[C@H]1CC(=O)N(C2CC2)C1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000181254637 1430257379 /nfs/dbraw/zinc/25/73/79/1430257379.db2.gz XVOXJFWNCFKVSY-CQSZACIVSA-N 0 0 394.431 3.079 20 5 GGBDRN O=C(Nc1cnn(Cc2ccccn2)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181270443 1430260128 /nfs/dbraw/zinc/26/01/28/1430260128.db2.gz TVRSMJNWWMCVMV-UHFFFAOYSA-N 0 0 389.318 3.088 20 5 GGBDRN Cc1nc([C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)c2ccc(Cl)cc2)no1 ZINC000181282093 1430262395 /nfs/dbraw/zinc/26/23/95/1430262395.db2.gz RSRVNRZOKNEMRW-HNNXBMFYSA-N 0 0 387.783 3.041 20 5 GGBDRN Cn1cnc(-c2ccc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)cc2)n1 ZINC000181308300 1430268963 /nfs/dbraw/zinc/26/89/63/1430268963.db2.gz JBHXUSYIXIQCKQ-UHFFFAOYSA-N 0 0 377.404 3.195 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000181311066 1430269989 /nfs/dbraw/zinc/26/99/89/1430269989.db2.gz CWYRUBIMGXIELA-CZUORRHYSA-N 0 0 379.775 3.230 20 5 GGBDRN Cn1c(COC(=O)CCCNc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 ZINC000181325074 1430273065 /nfs/dbraw/zinc/27/30/65/1430273065.db2.gz GNULOUWGDGUILW-UHFFFAOYSA-N 0 0 395.419 3.326 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181326877 1430273502 /nfs/dbraw/zinc/27/35/02/1430273502.db2.gz GMKRGVDAVGCJOX-QMMMGPOBSA-N 0 0 385.346 3.044 20 5 GGBDRN Cn1c(COC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)nnc1-c1ccccc1 ZINC000181332040 1430275122 /nfs/dbraw/zinc/27/51/22/1430275122.db2.gz GLZPIFDUORGVSI-UHFFFAOYSA-N 0 0 391.387 3.158 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccc(Br)nc1C 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388.330 3.286 20 5 GGBDRN Cn1cc(C(=O)Nc2ccc(OCCOc3ccccc3[N+](=O)[O-])cc2)cn1 ZINC000181634657 1430332053 /nfs/dbraw/zinc/33/20/53/1430332053.db2.gz APBUOTKRJRKWFF-UHFFFAOYSA-N 0 0 382.376 3.038 20 5 GGBDRN Cc1ccc(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)cc1[N+](=O)[O-] ZINC000181638327 1430332713 /nfs/dbraw/zinc/33/27/13/1430332713.db2.gz VAMDMYGTWYXBKE-UHFFFAOYSA-N 0 0 384.367 3.455 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000181652929 1430335306 /nfs/dbraw/zinc/33/53/06/1430335306.db2.gz NSQQEJLLPFLJDF-UHFFFAOYSA-N 0 0 381.335 3.310 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000181662646 1430337611 /nfs/dbraw/zinc/33/76/11/1430337611.db2.gz PRXOWGAWAIEXOE-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000181694102 1430342691 /nfs/dbraw/zinc/34/26/91/1430342691.db2.gz GJMLXAQFCOZYJT-UHFFFAOYSA-N 0 0 380.404 3.174 20 5 GGBDRN CC(C)S(=O)(=O)N(CCOc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000181725283 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ZINC000181888035 1430378104 /nfs/dbraw/zinc/37/81/04/1430378104.db2.gz MRDWOPNFJKPWPY-LLVKDONJSA-N 0 0 382.380 3.205 20 5 GGBDRN COc1ccc(C(=O)N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000181889638 1430378276 /nfs/dbraw/zinc/37/82/76/1430378276.db2.gz LIJJBDNGZVMHJV-YOEHRIQHSA-N 0 0 378.331 3.142 20 5 GGBDRN COc1ccc(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000181889445 1430378345 /nfs/dbraw/zinc/37/83/45/1430378345.db2.gz LIJJBDNGZVMHJV-RHSMWYFYSA-N 0 0 378.331 3.142 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(-c3ccc(OC(F)F)cc3)no2)c1[N+](=O)[O-] ZINC000181894137 1430379173 /nfs/dbraw/zinc/37/91/73/1430379173.db2.gz BJQPLZYTCGCIOC-UHFFFAOYSA-N 0 0 393.306 3.145 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)[nH]c(=O)n1 ZINC000181893148 1430379247 /nfs/dbraw/zinc/37/92/47/1430379247.db2.gz UWYDMVOQJOHQRP-UHFFFAOYSA-N 0 0 376.438 3.377 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC000181897443 1430379895 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390.343 3.431 20 5 GGBDRN CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@@H]1CCCN(c2ccccc2)C1 ZINC000181960319 1430388951 /nfs/dbraw/zinc/38/89/51/1430388951.db2.gz RLIYOWRMSSQIPG-MRXNPFEDSA-N 0 0 383.404 3.065 20 5 GGBDRN CCOc1cc(Cl)ccc1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000182001394 1430394489 /nfs/dbraw/zinc/39/44/89/1430394489.db2.gz LKVOVQWVKPBGOR-ZDUSSCGKSA-N 0 0 390.827 3.369 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000182004152 1430394864 /nfs/dbraw/zinc/39/48/64/1430394864.db2.gz HZUWTAXYVMZUMZ-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1-n1ccnn1 ZINC000182038650 1430400121 /nfs/dbraw/zinc/40/01/21/1430400121.db2.gz QASFGIYSEVBRCS-UHFFFAOYSA-N 0 0 375.291 3.029 20 5 GGBDRN COCc1ccc(CNC(=O)COc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000182110801 1430413708 /nfs/dbraw/zinc/41/37/08/1430413708.db2.gz WGHYIUHGDAFRJL-UHFFFAOYSA-N 0 0 398.337 3.455 20 5 GGBDRN COC(=O)CCCc1nc(COc2ccc(C(F)(F)F)cc2[N+](=O)[O-])no1 ZINC000182124338 1430415934 /nfs/dbraw/zinc/41/59/34/1430415934.db2.gz HCOZREBFHZZUHR-UHFFFAOYSA-N 0 0 389.286 3.071 20 5 GGBDRN CC[N@@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc([N+](=O)[O-])ccc1[O-] ZINC000182161056 1430422271 /nfs/dbraw/zinc/42/22/71/1430422271.db2.gz VHEDQTOPJCFBIG-QGZVFWFLSA-N 0 0 399.447 3.133 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)Cc1ccccc1C(F)(F)F ZINC000182177147 1430424825 /nfs/dbraw/zinc/42/48/25/1430424825.db2.gz UBRWSFOIONZBSV-LLVKDONJSA-N 0 0 384.358 3.256 20 5 GGBDRN Cc1ccccc1-c1nnc(SC[C@@H](O)COc2ccccc2[N+](=O)[O-])o1 ZINC000182181305 1430425468 /nfs/dbraw/zinc/42/54/68/1430425468.db2.gz LMUJUPCSGYPKRC-ZDUSSCGKSA-N 0 0 387.417 3.485 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN(Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000182215537 1430430980 /nfs/dbraw/zinc/43/09/80/1430430980.db2.gz QYPHYGFHSAOKTH-UHFFFAOYSA-N 0 0 396.415 3.311 20 5 GGBDRN C[C@H](c1cc(F)ccc1F)N(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182215455 1430431058 /nfs/dbraw/zinc/43/10/58/1430431058.db2.gz NKSABRFLPHZBQK-GFCCVEGCSA-N 0 0 384.404 3.340 20 5 GGBDRN CC1(C)CN(CC(F)(F)F)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182224543 1430432562 /nfs/dbraw/zinc/43/25/62/1430432562.db2.gz FWUJDHBTSPJVOB-UHFFFAOYSA-N 0 0 399.373 3.103 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000182225779 1430432917 /nfs/dbraw/zinc/43/29/17/1430432917.db2.gz LFYRHVRAHYOCRT-QGZVFWFLSA-N 0 0 389.383 3.105 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000182225759 1430433007 /nfs/dbraw/zinc/43/30/07/1430433007.db2.gz LFYRHVRAHYOCRT-KRWDZBQOSA-N 0 0 389.383 3.105 20 5 GGBDRN Cc1cc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)ccc1N1CCOCC1 ZINC000182228491 1430433785 /nfs/dbraw/zinc/43/37/85/1430433785.db2.gz BMTIQHYGHPXJEA-UHFFFAOYSA-N 0 0 394.431 3.402 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc(Cl)cc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000182237863 1430434972 /nfs/dbraw/zinc/43/49/72/1430434972.db2.gz VYRCOFMVWZBPNO-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN CN1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c2cc(Cl)ccc21 ZINC000182269509 1430440484 /nfs/dbraw/zinc/44/04/84/1430440484.db2.gz SBALPCIYAFFQFO-UHFFFAOYSA-N 0 0 375.768 3.074 20 5 GGBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000182271576 1430440672 /nfs/dbraw/zinc/44/06/72/1430440672.db2.gz CJSZUJPLKJKQKE-LBPRGKRZSA-N 0 0 398.394 3.123 20 5 GGBDRN CCc1nnc(NC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)[nH]1 ZINC000182276577 1430441537 /nfs/dbraw/zinc/44/15/37/1430441537.db2.gz OGOQECCTXISTNZ-UHFFFAOYSA-N 0 0 396.194 3.020 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)COc1ccc(OCC(F)(F)F)cc1 ZINC000182287007 1430442654 /nfs/dbraw/zinc/44/26/54/1430442654.db2.gz ZZNLJKZACJWMMB-GFCCVEGCSA-N 0 0 387.310 3.355 20 5 GGBDRN C[C@@H](C(=O)NCC(=O)Nc1ccc(F)c(F)c1F)c1ccc([N+](=O)[O-])cc1F ZINC000182286130 1430442780 /nfs/dbraw/zinc/44/27/80/1430442780.db2.gz NSJKYTMNVNBKOO-MRVPVSSYSA-N 0 0 399.300 3.010 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)COc1cccc(OCC(F)(F)F)c1 ZINC000182290116 1430443304 /nfs/dbraw/zinc/44/33/04/1430443304.db2.gz BACOOOKWDPPDOO-LBPRGKRZSA-N 0 0 387.310 3.355 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1F ZINC000182300671 1430445152 /nfs/dbraw/zinc/44/51/52/1430445152.db2.gz KXIPTXIPSNQMFX-LBPRGKRZSA-N 0 0 377.397 3.347 20 5 GGBDRN Cn1cc(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c(-c2ccccc2)n1 ZINC000182304084 1430445429 /nfs/dbraw/zinc/44/54/29/1430445429.db2.gz YQRIFVAMTSTURM-UHFFFAOYSA-N 0 0 389.415 3.336 20 5 GGBDRN Cc1cccc(CCCn2cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c2=O)c1 ZINC000182307417 1430445591 /nfs/dbraw/zinc/44/55/91/1430445591.db2.gz XQIQKNRQKMEQNM-UHFFFAOYSA-N 0 0 389.415 3.432 20 5 GGBDRN Cc1cc2ncn(C[C@@H](O)Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)c2cc1C ZINC000182307453 1430445763 /nfs/dbraw/zinc/44/57/63/1430445763.db2.gz KFZLZVNMUISZNK-QGZVFWFLSA-N 0 0 391.431 3.486 20 5 GGBDRN COc1ccc(COC[C@@H](O)Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)cc1 ZINC000182308089 1430446083 /nfs/dbraw/zinc/44/60/83/1430446083.db2.gz NJQMXFRWDGJEON-KRWDZBQOSA-N 0 0 383.404 3.045 20 5 GGBDRN O=[N+]([O-])c1ccccc1-c1cnn(C[C@@H](O)COc2cccc3[nH]ccc32)c1 ZINC000182310309 1430446509 /nfs/dbraw/zinc/44/65/09/1430446509.db2.gz ILTHFBBEPFBQNW-OAHLLOKOSA-N 0 0 378.388 3.380 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1C(=O)N1CCCC1 ZINC000182319455 1430448027 /nfs/dbraw/zinc/44/80/27/1430448027.db2.gz WFKVUTVYQZQKRH-UHFFFAOYSA-N 0 0 382.420 3.190 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000182322260 1430448264 /nfs/dbraw/zinc/44/82/64/1430448264.db2.gz QDXGDWNAXOYLHF-LLVKDONJSA-N 0 0 396.856 3.438 20 5 GGBDRN C[C@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1F)c1ccc([N+](=O)[O-])cc1F ZINC000182324111 1430448452 /nfs/dbraw/zinc/44/84/52/1430448452.db2.gz ADVLJDLHLZSNKY-VIFPVBQESA-N 0 0 384.360 3.019 20 5 GGBDRN Cn1nc(C2CCCC2)cc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000182322513 1430448506 /nfs/dbraw/zinc/44/85/06/1430448506.db2.gz UXLLPZHJCUNACT-UHFFFAOYSA-N 0 0 380.408 3.424 20 5 GGBDRN Cc1noc(C2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000182322869 1430448610 /nfs/dbraw/zinc/44/86/10/1430448610.db2.gz JZBJWAFQXBWUCT-UHFFFAOYSA-N 0 0 396.856 3.438 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(C(=O)c2nccn2C)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182337739 1430450471 /nfs/dbraw/zinc/45/04/71/1430450471.db2.gz YDHJIWGCQZHEEY-LBPRGKRZSA-N 0 0 396.378 3.441 20 5 GGBDRN O=C(NC[C@H](CCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182355277 1430452689 /nfs/dbraw/zinc/45/26/89/1430452689.db2.gz GJDLRTDSAPHXTH-ZDUSSCGKSA-N 0 0 380.347 3.092 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000182361208 1430453478 /nfs/dbraw/zinc/45/34/78/1430453478.db2.gz IVXRFCWNOLKHTN-UHFFFAOYSA-N 0 0 393.396 3.118 20 5 GGBDRN Cc1c(C(=O)Nc2cc(C3CCCC3)nn2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000182362807 1430453599 /nfs/dbraw/zinc/45/35/99/1430453599.db2.gz KUBTWDXSUMXZOO-UHFFFAOYSA-N 0 0 395.423 3.127 20 5 GGBDRN CC(C)n1nnnc1-c1ccc(NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1F ZINC000182389581 1430457866 /nfs/dbraw/zinc/45/78/66/1430457866.db2.gz SESRGZHDBPBOBQ-UHFFFAOYSA-N 0 0 399.386 3.290 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1n1ccnc1 ZINC000182397913 1430459842 /nfs/dbraw/zinc/45/98/42/1430459842.db2.gz MPMMKICJZRPIRT-FZMZJTMJSA-N 0 0 380.351 3.116 20 5 GGBDRN Cc1cc(NC(=O)c2sccc2S(=O)(=O)N2CCCC2)ccc1[N+](=O)[O-] ZINC000182403686 1430461232 /nfs/dbraw/zinc/46/12/32/1430461232.db2.gz YBQSAYABEACSBW-UHFFFAOYSA-N 0 0 395.462 3.002 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000182408536 1430461959 /nfs/dbraw/zinc/46/19/59/1430461959.db2.gz BLZNWGQMAPOASX-GOSISDBHSA-N 0 0 380.404 3.070 20 5 GGBDRN O=C(NCCOc1ccc(Cl)cn1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182412033 1430463127 /nfs/dbraw/zinc/46/31/27/1430463127.db2.gz GQDHZWKVOYXGRY-UHFFFAOYSA-N 0 0 387.726 3.053 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1c(F)cccc1F ZINC000182424255 1430465373 /nfs/dbraw/zinc/46/53/73/1430465373.db2.gz BUTIPSOSDOUFFP-HNNXBMFYSA-N 0 0 377.347 3.387 20 5 GGBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000182428645 1430466457 /nfs/dbraw/zinc/46/64/57/1430466457.db2.gz BZTVAVZVSYVCSS-LBPRGKRZSA-N 0 0 397.884 3.349 20 5 GGBDRN CC[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000182431501 1430466767 /nfs/dbraw/zinc/46/67/67/1430466767.db2.gz VDFDNGUUVCPUBH-QGZVFWFLSA-N 0 0 384.404 3.388 20 5 GGBDRN CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000182433088 1430466954 /nfs/dbraw/zinc/46/69/54/1430466954.db2.gz JOIHWOJIKWZTNL-UHFFFAOYSA-N 0 0 391.449 3.186 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1ccc(F)cc1F ZINC000182442937 1430468581 /nfs/dbraw/zinc/46/85/81/1430468581.db2.gz BQKDYFFGQMNILC-INIZCTEOSA-N 0 0 377.347 3.387 20 5 GGBDRN Cc1cc(NC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)ccc1[N+](=O)[O-] ZINC000182449765 1430469441 /nfs/dbraw/zinc/46/94/41/1430469441.db2.gz JBLDOVHHGQXZDN-OAHLLOKOSA-N 0 0 376.457 3.309 20 5 GGBDRN Cn1cc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)n1 ZINC000182451945 1430470061 /nfs/dbraw/zinc/47/00/61/1430470061.db2.gz APNGRRBQBKBOCZ-UHFFFAOYSA-N 0 0 379.420 3.037 20 5 GGBDRN C[C@@H](C(=O)N1CCN(CCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182462944 1430471615 /nfs/dbraw/zinc/47/16/15/1430471615.db2.gz TYSREKGTUZBPAF-MRXNPFEDSA-N 0 0 385.439 3.224 20 5 GGBDRN CC[C@H](N[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000182463157 1430471860 /nfs/dbraw/zinc/47/18/60/1430471860.db2.gz WMXYNZFYQJYNKX-FZMZJTMJSA-N 0 0 376.413 3.276 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)C(=O)c1cc3c(c([N+](=O)[O-])c1)OCO3)CCC2 ZINC000182464949 1430472181 /nfs/dbraw/zinc/47/21/81/1430472181.db2.gz LOFGGXOSJWFBOE-LBPRGKRZSA-N 0 0 389.433 3.492 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000182466935 1430472624 /nfs/dbraw/zinc/47/26/24/1430472624.db2.gz IAXGTBVXZVJGNO-UHFFFAOYSA-N 0 0 390.484 3.165 20 5 GGBDRN O=C(N[C@H](CCCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182472594 1430473529 /nfs/dbraw/zinc/47/35/29/1430473529.db2.gz LKOWOOXOIQDMOL-OAHLLOKOSA-N 0 0 380.347 3.440 20 5 GGBDRN CCn1c2ccc(C)cc2nc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000182476418 1430474043 /nfs/dbraw/zinc/47/40/43/1430474043.db2.gz PYMSFYXAAJRFNN-UHFFFAOYSA-N 0 0 391.387 3.367 20 5 GGBDRN C[C@H](C(=O)Nc1cccc(-c2nnnn2C2CC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182481996 1430475067 /nfs/dbraw/zinc/47/50/67/1430475067.db2.gz FCKLOQNCPTXQQZ-NSHDSACASA-N 0 0 396.382 3.465 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cc(OCC(F)F)ccn1 ZINC000182484807 1430475425 /nfs/dbraw/zinc/47/54/25/1430475425.db2.gz PYFKYDDQERSPLH-UHFFFAOYSA-N 0 0 389.261 3.487 20 5 GGBDRN CCS(=O)(=O)c1ccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000182486180 1430475640 /nfs/dbraw/zinc/47/56/40/1430475640.db2.gz AVJKZIAWIWAUPT-NSHDSACASA-N 0 0 380.397 3.270 20 5 GGBDRN COCCN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182489271 1430476392 /nfs/dbraw/zinc/47/63/92/1430476392.db2.gz LGZAOBTYJQIKFX-UHFFFAOYSA-N 0 0 380.347 3.485 20 5 GGBDRN CCc1cc(=O)c2cc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3C)ccc2[nH]1 ZINC000182499000 1430478654 /nfs/dbraw/zinc/47/86/54/1430478654.db2.gz SLCRBPPEIRMICP-UHFFFAOYSA-N 0 0 387.417 3.108 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182501837 1430479267 /nfs/dbraw/zinc/47/92/67/1430479267.db2.gz PLLQTTMEDFRGDT-SJLPKXTDSA-N 0 0 376.796 3.273 20 5 GGBDRN CCn1c2ccc(C)cc2nc1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000182503769 1430479654 /nfs/dbraw/zinc/47/96/54/1430479654.db2.gz YMTUAVNTFOYPHR-UHFFFAOYSA-N 0 0 391.391 3.106 20 5 GGBDRN CC[C@H](c1ccc(F)cc1)S(=O)(=O)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182507091 1430479953 /nfs/dbraw/zinc/47/99/53/1430479953.db2.gz WJFIZIZCUWEMFG-MAUKXSAKSA-N 0 0 397.424 3.040 20 5 GGBDRN C[C@@H](c1cccc(Cl)c1)S(=O)(=O)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182509113 1430480335 /nfs/dbraw/zinc/48/03/35/1430480335.db2.gz WAKXBUQHDLIJBW-SWLSCSKDSA-N 0 0 399.852 3.164 20 5 GGBDRN COc1cc(CNc2c(C)cccc2C(N)=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000182518906 1430482490 /nfs/dbraw/zinc/48/24/90/1430482490.db2.gz PJTSKZJGSVLSRS-UHFFFAOYSA-N 0 0 395.362 3.267 20 5 GGBDRN C[C@@](O)(CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000182525521 1430483471 /nfs/dbraw/zinc/48/34/71/1430483471.db2.gz AICBUDNLIGMPMP-OAQYLSRUSA-N 0 0 384.432 3.262 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccnc(O[C@H]2CCOC2)c1 ZINC000182526720 1430483539 /nfs/dbraw/zinc/48/35/39/1430483539.db2.gz ROECQGPPAUHIJK-HNNXBMFYSA-N 0 0 391.811 3.083 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccnc(O[C@@H]2CCOC2)c1 ZINC000182526702 1430483584 /nfs/dbraw/zinc/48/35/84/1430483584.db2.gz ROECQGPPAUHIJK-OAHLLOKOSA-N 0 0 391.811 3.083 20 5 GGBDRN C[C@H](C(=O)NCc1ccc(Cn2cccn2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182536346 1430485861 /nfs/dbraw/zinc/48/58/61/1430485861.db2.gz JOEAWTQELKFHRU-AWEZNQCLSA-N 0 0 382.395 3.399 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182544684 1430487732 /nfs/dbraw/zinc/48/77/32/1430487732.db2.gz SHSKAPNZTHARAN-CRAIPNDOSA-N 0 0 375.812 3.307 20 5 GGBDRN C[C@@H](C(=O)NCc1ccccc1CN1CCCC1=O)c1ccc([N+](=O)[O-])cc1F ZINC000182545810 1430488120 /nfs/dbraw/zinc/48/81/20/1430488120.db2.gz NJSAJKHKFYOAGV-CQSZACIVSA-N 0 0 399.422 3.276 20 5 GGBDRN Cn1c(=O)oc2ccc(NC(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])cc21 ZINC000182558939 1430491624 /nfs/dbraw/zinc/49/16/24/1430491624.db2.gz QIOSFLMEAFXPHP-UHFFFAOYSA-N 0 0 393.808 3.424 20 5 GGBDRN CN(C)C(=O)CC1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000182577811 1430496483 /nfs/dbraw/zinc/49/64/83/1430496483.db2.gz RRANTMGSAMWRPG-UHFFFAOYSA-N 0 0 375.450 3.140 20 5 GGBDRN COc1ccc(C(=O)N2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)cc1 ZINC000182592610 1430498922 /nfs/dbraw/zinc/49/89/22/1430498922.db2.gz YYUURPCEZLKTCX-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN CC(C)OCCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000182640552 1430507730 /nfs/dbraw/zinc/50/77/30/1430507730.db2.gz DLSNNWQXSMNSBX-UHFFFAOYSA-N 0 0 379.438 3.233 20 5 GGBDRN O=C(N[C@@H]1CCCCNC1=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000182646887 1430509225 /nfs/dbraw/zinc/50/92/25/1430509225.db2.gz FRFCDWLMVJSYNI-MRXNPFEDSA-N 0 0 391.493 3.276 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NC[C@@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000182668834 1430513800 /nfs/dbraw/zinc/51/38/00/1430513800.db2.gz AEMYEFIIDKPRSN-GFCCVEGCSA-N 0 0 398.510 3.297 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000182676293 1430515550 /nfs/dbraw/zinc/51/55/50/1430515550.db2.gz UQTREZSLUQHWTN-NSHDSACASA-N 0 0 393.852 3.484 20 5 GGBDRN CC(C)CCOC1CCN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000182689714 1430518068 /nfs/dbraw/zinc/51/80/68/1430518068.db2.gz NSEFCJFSYIPIIW-UHFFFAOYSA-N 0 0 397.859 3.240 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCc2c(cccc2NS(C)(=O)=O)C1 ZINC000182696317 1430520017 /nfs/dbraw/zinc/52/00/17/1430520017.db2.gz AJQNZHYMISQTDP-AWEZNQCLSA-N 0 0 389.477 3.394 20 5 GGBDRN Cc1c([C@H](C)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cccc1[N+](=O)[O-] ZINC000182700469 1430520890 /nfs/dbraw/zinc/52/08/90/1430520890.db2.gz KGBHHHNRVSRBGQ-INIZCTEOSA-N 0 0 398.463 3.347 20 5 GGBDRN CN(C)C(=O)C1(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000182703018 1430521697 /nfs/dbraw/zinc/52/16/97/1430521697.db2.gz YOLDBNGXEZKPKW-UHFFFAOYSA-N 0 0 399.900 3.105 20 5 GGBDRN CC[C@H](Nc1ccc(NC(=O)CN2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000182706782 1430523020 /nfs/dbraw/zinc/52/30/20/1430523020.db2.gz XSCQTYSNUPAXNZ-FQEVSTJZSA-N 0 0 398.463 3.429 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1c(F)cccc1N1CCCC1 ZINC000182719193 1430526114 /nfs/dbraw/zinc/52/61/14/1430526114.db2.gz QPVVJJSJUUUEEW-UHFFFAOYSA-N 0 0 393.440 3.319 20 5 GGBDRN COc1cccc2c1CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000182723803 1430527260 /nfs/dbraw/zinc/52/72/60/1430527260.db2.gz SBQXCZYQGRTPFY-UHFFFAOYSA-N 0 0 375.812 3.254 20 5 GGBDRN O=C(N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000182724115 1430527569 /nfs/dbraw/zinc/52/75/69/1430527569.db2.gz UKCKCQSLVRLYIX-RDJZCZTQSA-N 0 0 388.330 3.009 20 5 GGBDRN COc1cc(Cn2ccc3occc3c2=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000182735296 1430529999 /nfs/dbraw/zinc/52/99/99/1430529999.db2.gz RDNVBZGTFADXCJ-UHFFFAOYSA-N 0 0 380.303 3.204 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(-n3ncc4ccccc43)cc2)c1[N+](=O)[O-] ZINC000182738975 1430530844 /nfs/dbraw/zinc/53/08/44/1430530844.db2.gz OFUFLQBCBNLGMW-UHFFFAOYSA-N 0 0 376.376 3.472 20 5 GGBDRN CC[C@](C)(CCO)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000182743224 1430531584 /nfs/dbraw/zinc/53/15/84/1430531584.db2.gz LFAXUHWGAKLLTA-JLTOFOAXSA-N 0 0 386.452 3.444 20 5 GGBDRN COc1ccc(-c2noc(CN3CCc4ccc([N+](=O)[O-])cc43)n2)c(OC)c1 ZINC000182755706 1430534011 /nfs/dbraw/zinc/53/40/11/1430534011.db2.gz YJVILCPXXWSPJH-UHFFFAOYSA-N 0 0 382.376 3.225 20 5 GGBDRN Cc1cc(NC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000182761716 1430535572 /nfs/dbraw/zinc/53/55/72/1430535572.db2.gz DDPSDVNMLKMLKU-KRWDZBQOSA-N 0 0 382.420 3.388 20 5 GGBDRN Cc1cc(NC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000182761730 1430535620 /nfs/dbraw/zinc/53/56/20/1430535620.db2.gz DDPSDVNMLKMLKU-QGZVFWFLSA-N 0 0 382.420 3.388 20 5 GGBDRN CC1([C@H]2CCCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)C2)OCCO1 ZINC000182766519 1430536130 /nfs/dbraw/zinc/53/61/30/1430536130.db2.gz GCIOBCOOQLYEAO-KRWDZBQOSA-N 0 0 391.468 3.102 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)cn2)n1 ZINC000182766924 1430536548 /nfs/dbraw/zinc/53/65/48/1430536548.db2.gz FIDXIMMKSYOOHW-UHFFFAOYSA-N 0 0 380.408 3.422 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)CN2CCc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000182785637 1430539815 /nfs/dbraw/zinc/53/98/15/1430539815.db2.gz BNCXDDIPMKVTLY-AWEZNQCLSA-N 0 0 399.447 3.242 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182789220 1430540201 /nfs/dbraw/zinc/54/02/01/1430540201.db2.gz YTHRZFVCWVXEHV-UHFFFAOYSA-N 0 0 385.848 3.212 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000182792946 1430540969 /nfs/dbraw/zinc/54/09/69/1430540969.db2.gz DNROHPRIXBQFRX-ACJLOTCBSA-N 0 0 392.419 3.102 20 5 GGBDRN CN(Cc1nc[nH]n1)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000182794454 1430541346 /nfs/dbraw/zinc/54/13/46/1430541346.db2.gz NECBCLHHMUMYCM-UHFFFAOYSA-N 0 0 375.454 3.267 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000182794224 1430541420 /nfs/dbraw/zinc/54/14/20/1430541420.db2.gz NGDWNSUGBPXXLR-KUHUBIRLSA-N 0 0 377.404 3.399 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)on1 ZINC000182796111 1430541462 /nfs/dbraw/zinc/54/14/62/1430541462.db2.gz QWCYAPYMECZOQB-UHFFFAOYSA-N 0 0 394.815 3.395 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)cc([N+](=O)[O-])c1 ZINC000182801066 1430542160 /nfs/dbraw/zinc/54/21/60/1430542160.db2.gz QLLSJJVNEIUQRD-SCLBCKFNSA-N 0 0 383.404 3.390 20 5 GGBDRN C[C@@H](C(=O)N1CCC(CC(=O)N2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182802919 1430542702 /nfs/dbraw/zinc/54/27/02/1430542702.db2.gz RZQNMTDUDDCHDA-CQSZACIVSA-N 0 0 391.443 3.089 20 5 GGBDRN CC(C)(O)CN(Cc1ccccc1)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000182807373 1430544026 /nfs/dbraw/zinc/54/40/26/1430544026.db2.gz CFMNTTLUTNLVLZ-UHFFFAOYSA-N 0 0 394.431 3.194 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000182820354 1430546778 /nfs/dbraw/zinc/54/67/78/1430546778.db2.gz CQLJZVQLGMWIHP-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000182823853 1430547550 /nfs/dbraw/zinc/54/75/50/1430547550.db2.gz BFJXDJOLPZAVKY-UHFFFAOYSA-N 0 0 393.802 3.472 20 5 GGBDRN Cc1cccc(N(CCC(N)=O)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000182833384 1430549636 /nfs/dbraw/zinc/54/96/36/1430549636.db2.gz BZIDQJXKCJLSPH-UHFFFAOYSA-N 0 0 393.346 3.027 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H](C3(C)OCCO3)C2)cc1[N+](=O)[O-] ZINC000182835920 1430550723 /nfs/dbraw/zinc/55/07/23/1430550723.db2.gz WOSLNMCOZUOAOX-GOEBONIOSA-N 0 0 377.441 3.149 20 5 GGBDRN O=C(CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000182850917 1430553552 /nfs/dbraw/zinc/55/35/52/1430553552.db2.gz IPKKNOSKHAEQQU-GFCCVEGCSA-N 0 0 397.357 3.086 20 5 GGBDRN O=C(Nc1c[nH]nc1-c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000182860001 1430555386 /nfs/dbraw/zinc/55/53/86/1430555386.db2.gz XDSBUOQPOSGZKC-UHFFFAOYSA-N 0 0 385.767 3.216 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182863067 1430555710 /nfs/dbraw/zinc/55/57/10/1430555710.db2.gz GIKLOWNSZYTIRF-AWEZNQCLSA-N 0 0 382.342 3.216 20 5 GGBDRN O=C(Nc1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182871431 1430558511 /nfs/dbraw/zinc/55/85/11/1430558511.db2.gz OOLNOPAQNHWJGZ-UHFFFAOYSA-N 0 0 384.417 3.293 20 5 GGBDRN C[C@H](CCc1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182878747 1430560576 /nfs/dbraw/zinc/56/05/76/1430560576.db2.gz CRSNXSYBYQTHHH-MRXNPFEDSA-N 0 0 383.448 3.183 20 5 GGBDRN O=C(Nc1ccc(Cl)cc1F)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182884264 1430561635 /nfs/dbraw/zinc/56/16/35/1430561635.db2.gz XPCXPNPOSWTPER-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182884093 1430561758 /nfs/dbraw/zinc/56/17/58/1430561758.db2.gz HOYFOFZUHGAWDP-GFCCVEGCSA-N 0 0 398.341 3.053 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182886894 1430562434 /nfs/dbraw/zinc/56/24/34/1430562434.db2.gz JSMUIIAJAZQXCP-UHFFFAOYSA-N 0 0 389.839 3.057 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n(-c2ccccn2)n1 ZINC000182887604 1430562718 /nfs/dbraw/zinc/56/27/18/1430562718.db2.gz XDLJZZWTFKMTQE-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN Cc1ccccc1CCc1cc(NC(=O)COc2ccccc2[N+](=O)[O-])n[nH]1 ZINC000182891238 1430563735 /nfs/dbraw/zinc/56/37/35/1430563735.db2.gz XUIRMVAMBYPKIB-UHFFFAOYSA-N 0 0 380.404 3.429 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000182893261 1430564536 /nfs/dbraw/zinc/56/45/36/1430564536.db2.gz RWAZFEMYTJYCHV-SNVBAGLBSA-N 0 0 395.822 3.072 20 5 GGBDRN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000182897882 1430565674 /nfs/dbraw/zinc/56/56/74/1430565674.db2.gz LYWHUVDJQIDDCR-GOSISDBHSA-N 0 0 395.346 3.377 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182909381 1430568661 /nfs/dbraw/zinc/56/86/61/1430568661.db2.gz PGBQUSXCXLFIDE-NSHDSACASA-N 0 0 386.305 3.427 20 5 GGBDRN CN(Cc1ccccc1Cl)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182917468 1430571047 /nfs/dbraw/zinc/57/10/47/1430571047.db2.gz GUOLDVNGCWOBDV-UHFFFAOYSA-N 0 0 389.839 3.357 20 5 GGBDRN CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000182927860 1430574001 /nfs/dbraw/zinc/57/40/01/1430574001.db2.gz MVPRUIQJJWOHSH-AWEZNQCLSA-N 0 0 376.438 3.208 20 5 GGBDRN O=C(NCCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182930608 1430574349 /nfs/dbraw/zinc/57/43/49/1430574349.db2.gz RAECVGLDEICHAS-UHFFFAOYSA-N 0 0 389.839 3.057 20 5 GGBDRN COc1cccc([C@H]2[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC(=O)N2C2CC2)c1 ZINC000182932639 1430574860 /nfs/dbraw/zinc/57/48/60/1430574860.db2.gz XKCRTAKDIWAFTD-ICSRJNTNSA-N 0 0 395.415 3.294 20 5 GGBDRN COc1cccc([C@H]2[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC(=O)N2C2CC2)c1 ZINC000182933657 1430575231 /nfs/dbraw/zinc/57/52/31/1430575231.db2.gz BYGNCILVFCXSJU-QUCCMNQESA-N 0 0 395.415 3.294 20 5 GGBDRN CNC(=O)c1cc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)ccc1Cl ZINC000182963190 1430581619 /nfs/dbraw/zinc/58/16/19/1430581619.db2.gz GIDLYBOBIPLUPX-SECBINFHSA-N 0 0 379.775 3.489 20 5 GGBDRN Cc1ccc(NC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000182981851 1430584948 /nfs/dbraw/zinc/58/49/48/1430584948.db2.gz GWTSNNOUUGIOQV-MRXNPFEDSA-N 0 0 388.811 3.262 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182989412 1430586579 /nfs/dbraw/zinc/58/65/79/1430586579.db2.gz MHHKIIOAXZAIBN-MEDUHNTESA-N 0 0 388.811 3.191 20 5 GGBDRN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182989452 1430586612 /nfs/dbraw/zinc/58/66/12/1430586612.db2.gz MHHKIIOAXZAIBN-ZBEGNZNMSA-N 0 0 388.811 3.191 20 5 GGBDRN COc1ccc(C(=O)N(C)C)cc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000182990624 1430586978 /nfs/dbraw/zinc/58/69/78/1430586978.db2.gz UQNCLRATUBUNQQ-LLVKDONJSA-N 0 0 389.383 3.187 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2NC1=O ZINC000182993062 1430587347 /nfs/dbraw/zinc/58/73/47/1430587347.db2.gz LHASSHDTOXSFAZ-SNVBAGLBSA-N 0 0 391.330 3.431 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCO[C@@H](CCc2ccccc2)C1 ZINC000182992009 1430587503 /nfs/dbraw/zinc/58/75/03/1430587503.db2.gz RPDGMYWZNRFIAR-IBGZPJMESA-N 0 0 399.447 3.147 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N[C@@H]1CCCOCC1 ZINC000182993665 1430587698 /nfs/dbraw/zinc/58/76/98/1430587698.db2.gz BSXIPVSJVWDVCX-CQSZACIVSA-N 0 0 391.449 3.377 20 5 GGBDRN Cc1c([C@H](C)NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000183001021 1430589584 /nfs/dbraw/zinc/58/95/84/1430589584.db2.gz LUCWSWLQTPHBFI-LBPRGKRZSA-N 0 0 397.410 3.178 20 5 GGBDRN CC(C)(C)C[C@@H](NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)C(F)(F)F ZINC000183009390 1430591655 /nfs/dbraw/zinc/59/16/55/1430591655.db2.gz YISBJUSCGUYEPT-CYBMUJFWSA-N 0 0 385.346 3.272 20 5 GGBDRN O=C(Nc1cccc(-n2cccc2)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183026104 1430595603 /nfs/dbraw/zinc/59/56/03/1430595603.db2.gz OWIXCRRTRHLOCY-UHFFFAOYSA-N 0 0 392.415 3.474 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCc2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000183053051 1430600495 /nfs/dbraw/zinc/60/04/95/1430600495.db2.gz JXSFUAHWKHWMHH-UHFFFAOYSA-N 0 0 377.400 3.103 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183062950 1430603139 /nfs/dbraw/zinc/60/31/39/1430603139.db2.gz OUWVWOXIVODRTC-KGLIPLIRSA-N 0 0 380.351 3.306 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCCCC[C@H]2c2ccncc2)ccc1[N+](=O)[O-] ZINC000183117971 1430618737 /nfs/dbraw/zinc/61/87/37/1430618737.db2.gz VLDFZUCHYSUWRC-IBGZPJMESA-N 0 0 396.447 3.172 20 5 GGBDRN COCCN(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183118184 1430619224 /nfs/dbraw/zinc/61/92/24/1430619224.db2.gz KJMXYAHJVLNNHQ-UHFFFAOYSA-N 0 0 384.335 3.386 20 5 GGBDRN C[C@@H](C(=O)NCC(=O)Nc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000183137085 1430625425 /nfs/dbraw/zinc/62/54/25/1430625425.db2.gz YADWUCVRXCDHJJ-SNVBAGLBSA-N 0 0 379.775 3.246 20 5 GGBDRN CCOc1cccc(NC[C@H](c2ccc(C)o2)N2CCOCC2)c1[N+](=O)[O-] ZINC000183138788 1430626484 /nfs/dbraw/zinc/62/64/84/1430626484.db2.gz RLCIGEFHKQOBGV-MRXNPFEDSA-N 0 0 375.425 3.380 20 5 GGBDRN O=C(Nc1cccc(OC(F)F)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183142383 1430627570 /nfs/dbraw/zinc/62/75/70/1430627570.db2.gz WCVKTGAGYNOBEG-UHFFFAOYSA-N 0 0 393.346 3.285 20 5 GGBDRN O=C(CN1CCC(n2ccc(C(F)(F)F)n2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000183143506 1430627679 /nfs/dbraw/zinc/62/76/79/1430627679.db2.gz YYJGJMWOJRLKON-UHFFFAOYSA-N 0 0 397.357 3.086 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2ccccc2N2CCCCC2)cc([N+](=O)[O-])c1 ZINC000183144378 1430627930 /nfs/dbraw/zinc/62/79/30/1430627930.db2.gz SNMQVAOHZCGKGX-UHFFFAOYSA-N 0 0 397.431 3.302 20 5 GGBDRN CCOc1cccc(N2CCN(Cc3csc(CC)n3)CC2)c1[N+](=O)[O-] ZINC000183146566 1430628602 /nfs/dbraw/zinc/62/86/02/1430628602.db2.gz GTHCZVKGLXJIHC-UHFFFAOYSA-N 0 0 376.482 3.335 20 5 GGBDRN CCc1nc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)sc1C ZINC000183148081 1430629495 /nfs/dbraw/zinc/62/94/95/1430629495.db2.gz MBTSIWNTQVPYMY-UHFFFAOYSA-N 0 0 376.438 3.011 20 5 GGBDRN COc1cc(OCC(=O)NCc2ccccc2N2CCCCC2)ccc1[N+](=O)[O-] ZINC000183152835 1430630556 /nfs/dbraw/zinc/63/05/56/1430630556.db2.gz IKPDDLGXSGITRP-UHFFFAOYSA-N 0 0 399.447 3.289 20 5 GGBDRN O=C(Nc1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183155585 1430631081 /nfs/dbraw/zinc/63/10/81/1430631081.db2.gz SHISHMFUWKKERL-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN CCNc1ccc(Cl)cc1NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000183160015 1430633487 /nfs/dbraw/zinc/63/34/87/1430633487.db2.gz UJANUOWABNNVMH-NSHDSACASA-N 0 0 390.827 3.437 20 5 GGBDRN C[C@@H]1CC[C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1C ZINC000183171919 1430638357 /nfs/dbraw/zinc/63/83/57/1430638357.db2.gz KSJPDZHZHPAZEI-OUAUKWLOSA-N 0 0 385.367 3.076 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)[C@H](C)C2 ZINC000183173294 1430638468 /nfs/dbraw/zinc/63/84/68/1430638468.db2.gz DMOJZTQFBKXTTD-PJIJBLCYSA-N 0 0 381.432 3.071 20 5 GGBDRN O=C(Nc1nc2ccc(Cl)cn2n1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183179362 1430640606 /nfs/dbraw/zinc/64/06/06/1430640606.db2.gz ONCWDZCYAMTINR-UHFFFAOYSA-N 0 0 383.698 3.145 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CCN(c2ccccn2)C1 ZINC000183195464 1430644629 /nfs/dbraw/zinc/64/46/29/1430644629.db2.gz PUJQIMOXQOPOCT-ZDUSSCGKSA-N 0 0 392.868 3.130 20 5 GGBDRN COc1cc(CN2CC[C@H](Oc3cccc(F)c3)C2)c([N+](=O)[O-])cc1OC ZINC000183210094 1430648830 /nfs/dbraw/zinc/64/88/30/1430648830.db2.gz ABQPMGBXXYDKPG-INIZCTEOSA-N 0 0 376.384 3.404 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CC[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1 ZINC000183211676 1430649707 /nfs/dbraw/zinc/64/97/07/1430649707.db2.gz HIXLVVZSMKSXOA-OXFYSEKESA-N 0 0 383.448 3.286 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc(CN2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183222775 1430651449 /nfs/dbraw/zinc/65/14/49/1430651449.db2.gz OBXSSAAKWCCXJT-CQSZACIVSA-N 0 0 387.411 3.308 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(C)(CNC(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000183222999 1430651466 /nfs/dbraw/zinc/65/14/66/1430651466.db2.gz NHPBEJUYKRSFAE-UHFFFAOYSA-N 0 0 377.441 3.362 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000183223704 1430652242 /nfs/dbraw/zinc/65/22/42/1430652242.db2.gz KTUFETJJMAHBQZ-FZKQIMNGSA-N 0 0 387.436 3.150 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1ccccc1 ZINC000183234975 1430655232 /nfs/dbraw/zinc/65/52/32/1430655232.db2.gz YOAUVMTVVYFQBM-MRXNPFEDSA-N 0 0 388.445 3.329 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1ccccc1 ZINC000183239681 1430656903 /nfs/dbraw/zinc/65/69/03/1430656903.db2.gz TYZAETMMBKDNJJ-MRXNPFEDSA-N 0 0 388.445 3.329 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1cccs1 ZINC000183245921 1430658535 /nfs/dbraw/zinc/65/85/35/1430658535.db2.gz VHHLWBFLSQRCOT-CYBMUJFWSA-N 0 0 394.474 3.391 20 5 GGBDRN Cc1ccc(CN(C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C(C)C)s1 ZINC000183251605 1430660157 /nfs/dbraw/zinc/66/01/57/1430660157.db2.gz YDXJMOOALYBWMQ-UHFFFAOYSA-N 0 0 389.477 3.440 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000183255176 1430661184 /nfs/dbraw/zinc/66/11/84/1430661184.db2.gz FEAQOTADNHWNNJ-OAHLLOKOSA-N 0 0 392.408 3.160 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C)o1 ZINC000183255889 1430661615 /nfs/dbraw/zinc/66/16/15/1430661615.db2.gz WPBCCAXERBQBET-UHFFFAOYSA-N 0 0 380.422 3.037 20 5 GGBDRN Cc1c(CNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)oc2ccc(F)cc12 ZINC000183263292 1430663048 /nfs/dbraw/zinc/66/30/48/1430663048.db2.gz PAJRRROXYNKZKX-UHFFFAOYSA-N 0 0 399.378 3.143 20 5 GGBDRN O=C(Nc1n[nH]c(Cc2cccc(F)c2)n1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000183268562 1430665128 /nfs/dbraw/zinc/66/51/28/1430665128.db2.gz KQLLNOUMGRBRKM-UHFFFAOYSA-N 0 0 392.350 3.243 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)Cc1ncc(Cl)n1C ZINC000183280720 1430668796 /nfs/dbraw/zinc/66/87/96/1430668796.db2.gz FPSAZASHEAMDOI-JTQLQIEISA-N 0 0 376.804 3.225 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@@H](CCc2ccccc2)C1 ZINC000183285720 1430669534 /nfs/dbraw/zinc/66/95/34/1430669534.db2.gz XGJOGMCOKPKHHY-IBGZPJMESA-N 0 0 393.443 3.479 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000183299953 1430673037 /nfs/dbraw/zinc/67/30/37/1430673037.db2.gz QKTCIJLZMBMMGE-JTQLQIEISA-N 0 0 399.373 3.260 20 5 GGBDRN Cc1cccc(C(C)(C)CNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000183311111 1430675946 /nfs/dbraw/zinc/67/59/46/1430675946.db2.gz BJKMKBGPVGZZOH-UHFFFAOYSA-N 0 0 383.448 3.035 20 5 GGBDRN O=C(N[C@H]1CCCOc2c(F)cccc21)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000183317269 1430677623 /nfs/dbraw/zinc/67/76/23/1430677623.db2.gz RNXAJMPHYROLSG-INIZCTEOSA-N 0 0 397.362 3.219 20 5 GGBDRN O=C(c1cc(OCC(F)F)ccn1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000183334045 1430681650 /nfs/dbraw/zinc/68/16/50/1430681650.db2.gz YOZIMUIYTFKOKZ-UHFFFAOYSA-N 0 0 377.347 3.439 20 5 GGBDRN C[C@H](C(=O)NCc1nc(-c2cccs2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000183356463 1430687442 /nfs/dbraw/zinc/68/74/42/1430687442.db2.gz XNCVUYPZVVTBPO-VIFPVBQESA-N 0 0 376.369 3.265 20 5 GGBDRN C[C@@H](C(=O)NCc1nc(-c2cccs2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000183356480 1430687562 /nfs/dbraw/zinc/68/75/62/1430687562.db2.gz XNCVUYPZVVTBPO-SECBINFHSA-N 0 0 376.369 3.265 20 5 GGBDRN Cc1cccc(OC(F)F)c1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183366843 1430691307 /nfs/dbraw/zinc/69/13/07/1430691307.db2.gz GXEZNLQDODEUDQ-UHFFFAOYSA-N 0 0 393.346 3.182 20 5 GGBDRN Cc1ccccc1C(C)(C)CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183369782 1430692616 /nfs/dbraw/zinc/69/26/16/1430692616.db2.gz FVWPJTHEGQAUAU-UHFFFAOYSA-N 0 0 383.448 3.035 20 5 GGBDRN CCOc1ccccc1[C@H](CC)NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183372809 1430693455 /nfs/dbraw/zinc/69/34/55/1430693455.db2.gz KTEMESKDNHIWFG-KRWDZBQOSA-N 0 0 399.447 3.299 20 5 GGBDRN Cc1cc(NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])n(-c2ccc(F)cc2)n1 ZINC000183379209 1430694926 /nfs/dbraw/zinc/69/49/26/1430694926.db2.gz XXQNYNLHNSHRDC-UHFFFAOYSA-N 0 0 390.396 3.170 20 5 GGBDRN CSCCc1ccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000183390655 1430698439 /nfs/dbraw/zinc/69/84/39/1430698439.db2.gz IHWNVYWQWKFQOQ-UHFFFAOYSA-N 0 0 387.461 3.177 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1 ZINC000183390115 1430698623 /nfs/dbraw/zinc/69/86/23/1430698623.db2.gz JKIGINGBYISQNR-UHFFFAOYSA-N 0 0 378.392 3.024 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H](C)C(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000183394755 1430700412 /nfs/dbraw/zinc/70/04/12/1430700412.db2.gz VSXCXGYJLJZANK-HNNXBMFYSA-N 0 0 383.448 3.116 20 5 GGBDRN CCOc1cccc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000183397514 1430701374 /nfs/dbraw/zinc/70/13/74/1430701374.db2.gz QKFJQFGXIVERAT-HNNXBMFYSA-N 0 0 399.447 3.321 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H](c2ccccc2)C2CCC2)ccc1[N+](=O)[O-] ZINC000183415384 1430705731 /nfs/dbraw/zinc/70/57/31/1430705731.db2.gz YBHGOBMPCGMMQJ-FQEVSTJZSA-N 0 0 381.432 3.291 20 5 GGBDRN CCCN(CCC)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000183416803 1430706309 /nfs/dbraw/zinc/70/63/09/1430706309.db2.gz ACIIKULEBOGIJM-UHFFFAOYSA-N 0 0 385.424 3.087 20 5 GGBDRN COc1ccc([C@@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000183441361 1430712923 /nfs/dbraw/zinc/71/29/23/1430712923.db2.gz JXZCGEHVPBHEFW-IBGZPJMESA-N 0 0 390.461 3.217 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CCO1 ZINC000183443137 1430713494 /nfs/dbraw/zinc/71/34/94/1430713494.db2.gz PQIZENAPMJBSHD-KXBFYZLASA-N 0 0 386.452 3.494 20 5 GGBDRN NC(=O)c1ccc(CN[C@H](c2c(F)cccc2F)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000183460261 1430717216 /nfs/dbraw/zinc/71/72/16/1430717216.db2.gz GKZLHXMAECVXPG-CQSZACIVSA-N 0 0 389.280 3.365 20 5 GGBDRN CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000183460443 1430717243 /nfs/dbraw/zinc/71/72/43/1430717243.db2.gz LTQDXXZIDOOUIN-CJNGLKHVSA-N 0 0 375.450 3.341 20 5 GGBDRN Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183462610 1430718126 /nfs/dbraw/zinc/71/81/26/1430718126.db2.gz YIVNWMZFTOCBHA-ZDUSSCGKSA-N 0 0 397.435 3.147 20 5 GGBDRN CN(C)c1ccc(COC(=O)c2csc([C@@H]3CCCO3)n2)cc1[N+](=O)[O-] ZINC000183469520 1430719641 /nfs/dbraw/zinc/71/96/41/1430719641.db2.gz UNEMIERBOYBKTQ-HNNXBMFYSA-N 0 0 377.422 3.326 20 5 GGBDRN COc1cc(F)c([C@@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1OC ZINC000183479262 1430722334 /nfs/dbraw/zinc/72/23/34/1430722334.db2.gz QHRORAOVXUUUFA-GFCCVEGCSA-N 0 0 391.399 3.349 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000183478287 1430722537 /nfs/dbraw/zinc/72/25/37/1430722537.db2.gz ZKTOQSBEOMKKAL-BEFAXECRSA-N 0 0 386.452 3.494 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1OC(F)F ZINC000183491673 1430726408 /nfs/dbraw/zinc/72/64/08/1430726408.db2.gz NCAYTHMJMOAOPC-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCOc3c(Cl)cccc32)cc1 ZINC000183535626 1430737095 /nfs/dbraw/zinc/73/70/95/1430737095.db2.gz YDROGIBEOXGYFN-INIZCTEOSA-N 0 0 396.852 3.234 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1c2ccccc2CC[C@H]1n1ccnc1 ZINC000183557466 1430741591 /nfs/dbraw/zinc/74/15/91/1430741591.db2.gz XRGYITMMBQCHJH-AEFFLSMTSA-N 0 0 378.392 3.237 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1c2ccccc2CC[C@@H]1n1ccnc1 ZINC000183557449 1430741646 /nfs/dbraw/zinc/74/16/46/1430741646.db2.gz XRGYITMMBQCHJH-WMZOPIPTSA-N 0 0 378.392 3.237 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000183559997 1430741998 /nfs/dbraw/zinc/74/19/98/1430741998.db2.gz HTPRGIUKGHOZGI-HIFRSBDPSA-N 0 0 380.763 3.434 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000183561353 1430742291 /nfs/dbraw/zinc/74/22/91/1430742291.db2.gz NUNGKCVMJZQDLO-UHFFFAOYSA-N 0 0 389.843 3.383 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000183574272 1430744526 /nfs/dbraw/zinc/74/45/26/1430744526.db2.gz WHOOFYQJLQTOPD-JTQLQIEISA-N 0 0 379.779 3.183 20 5 GGBDRN Cc1ccc(Cl)cc1N1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000183577427 1430745132 /nfs/dbraw/zinc/74/51/32/1430745132.db2.gz VSXDNRVFKMOJNC-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN C[C@H](C(=O)NCC(=O)Nc1cccc2cccnc21)c1ccc([N+](=O)[O-])cc1F ZINC000183582107 1430746722 /nfs/dbraw/zinc/74/67/22/1430746722.db2.gz HMBZCCJRGKKTHJ-LBPRGKRZSA-N 0 0 396.378 3.141 20 5 GGBDRN COc1ccc(N(Cc2cccs2)C(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000183590996 1430749222 /nfs/dbraw/zinc/74/92/22/1430749222.db2.gz PRSMAGUKUZHKGH-UHFFFAOYSA-N 0 0 384.417 3.489 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccccn1 ZINC000183599807 1430751063 /nfs/dbraw/zinc/75/10/63/1430751063.db2.gz NFOFINLSEOOSRA-SFHVURJKSA-N 0 0 379.376 3.305 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000183601162 1430751594 /nfs/dbraw/zinc/75/15/94/1430751594.db2.gz NBBWVSCRXYRWQP-UHFFFAOYSA-N 0 0 393.806 3.132 20 5 GGBDRN CC(C)(COc1ncccc1C(F)(F)F)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183600452 1430751629 /nfs/dbraw/zinc/75/16/29/1430751629.db2.gz ATUXNRYSRAICTA-UHFFFAOYSA-N 0 0 399.329 3.383 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183600349 1430751712 /nfs/dbraw/zinc/75/17/12/1430751712.db2.gz UJNIFXNODPNKSZ-MRVPVSSYSA-N 0 0 386.334 3.248 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(OCC3CC3)cc2)ccc1[N+](=O)[O-] ZINC000183602947 1430752017 /nfs/dbraw/zinc/75/20/17/1430752017.db2.gz PLZRQDMWKDOKBD-UHFFFAOYSA-N 0 0 383.404 3.061 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000183602440 1430752237 /nfs/dbraw/zinc/75/22/37/1430752237.db2.gz KLLFSCHZLIXWMQ-UHFFFAOYSA-N 0 0 376.363 3.435 20 5 GGBDRN C[C@@H](C(=O)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000183606991 1430753207 /nfs/dbraw/zinc/75/32/07/1430753207.db2.gz LVYHMCLQDIFCCE-DGCLKSJQSA-N 0 0 387.415 3.239 20 5 GGBDRN Cc1ccc(C[C@H]2CCCN2C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000183606431 1430753234 /nfs/dbraw/zinc/75/32/34/1430753234.db2.gz PUWGBSVRFHGHIK-LJQANCHMSA-N 0 0 395.459 3.175 20 5 GGBDRN C[C@@H](C(=O)N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000183606954 1430753257 /nfs/dbraw/zinc/75/32/57/1430753257.db2.gz LVYHMCLQDIFCCE-YPMHNXCESA-N 0 0 387.415 3.239 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NC2(c3ccccc3)CCCC2)ccc1[N+](=O)[O-] ZINC000183609984 1430753831 /nfs/dbraw/zinc/75/38/31/1430753831.db2.gz XPXBDSIKNBDAAM-UHFFFAOYSA-N 0 0 381.432 3.219 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(CCc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000183610044 1430753863 /nfs/dbraw/zinc/75/38/63/1430753863.db2.gz CRAZCDVYMMUCHD-UHFFFAOYSA-N 0 0 399.422 3.006 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1OC(F)F ZINC000183613557 1430754562 /nfs/dbraw/zinc/75/45/62/1430754562.db2.gz OQGJMCLGUPWTLE-UHFFFAOYSA-N 0 0 393.346 3.182 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCN(Cc2cccc3ccccc32)CC1 ZINC000183614960 1430754566 /nfs/dbraw/zinc/75/45/66/1430754566.db2.gz KEDXDENVHMAECS-UHFFFAOYSA-N 0 0 391.431 3.493 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(Cc2ccc(F)cc2)CC2CC2)ccc1[N+](=O)[O-] ZINC000183616734 1430755652 /nfs/dbraw/zinc/75/56/52/1430755652.db2.gz UGAHLWDWSCFHCJ-UHFFFAOYSA-N 0 0 399.422 3.211 20 5 GGBDRN COc1cc(C)c([C@@H](C)NC(=O)CN2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000183623494 1430756855 /nfs/dbraw/zinc/75/68/55/1430756855.db2.gz PQTNRKJMBNMZRF-CQSZACIVSA-N 0 0 399.447 3.160 20 5 GGBDRN CC(C)CN(C[C@H](O)c1ccc(F)cc1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183622913 1430757088 /nfs/dbraw/zinc/75/70/88/1430757088.db2.gz BKRSHOIZPNDPEY-KRWDZBQOSA-N 0 0 376.388 3.352 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CCc2c1cccc2[N+](=O)[O-] ZINC000183623222 1430757202 /nfs/dbraw/zinc/75/72/02/1430757202.db2.gz ZBOHQQFCLCSSBU-UHFFFAOYSA-N 0 0 391.431 3.399 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000183627213 1430758036 /nfs/dbraw/zinc/75/80/36/1430758036.db2.gz KLZUXUAPWONFNH-UHFFFAOYSA-N 0 0 395.341 3.363 20 5 GGBDRN CCN(Cc1c(F)cccc1F)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183628935 1430758353 /nfs/dbraw/zinc/75/83/53/1430758353.db2.gz HJFZBGWGKMNTCO-UHFFFAOYSA-N 0 0 384.404 3.267 20 5 GGBDRN C[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1F ZINC000183644206 1430762494 /nfs/dbraw/zinc/76/24/94/1430762494.db2.gz KURLUGWOZWSGQW-TZMCWYRMSA-N 0 0 385.395 3.039 20 5 GGBDRN C[C@H](C(=O)NCc1cc(F)cc2c1OCOC2)c1ccc([N+](=O)[O-])cc1F ZINC000183648542 1430763480 /nfs/dbraw/zinc/76/34/80/1430763480.db2.gz PDPRJJQDFCSBLA-JTQLQIEISA-N 0 0 378.331 3.159 20 5 GGBDRN CCOC(=O)[C@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(O)c1 ZINC000183650269 1430763981 /nfs/dbraw/zinc/76/39/81/1430763981.db2.gz CKFCHZCNDXOKOW-GOSISDBHSA-N 0 0 397.387 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H](c2ccccc2)c2cccnc2)cc1 ZINC000183657735 1430765627 /nfs/dbraw/zinc/76/56/27/1430765627.db2.gz MKXADYJHRMPEMB-FQEVSTJZSA-N 0 0 397.456 3.241 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(F)cc2NC(C)C)ccc1[N+](=O)[O-] ZINC000183662186 1430766103 /nfs/dbraw/zinc/76/61/03/1430766103.db2.gz NTANPZOBJSNHEA-UHFFFAOYSA-N 0 0 388.399 3.231 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000183660323 1430766167 /nfs/dbraw/zinc/76/61/67/1430766167.db2.gz WKDOBFJKRYIAIM-MRXNPFEDSA-N 0 0 395.506 3.241 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCSC[C@@H]2c2ccccc2)cc1 ZINC000183664967 1430766506 /nfs/dbraw/zinc/76/65/06/1430766506.db2.gz DIPDSULSOOOJSJ-GOSISDBHSA-N 0 0 392.502 3.257 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2CCC(C)(CO)CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000183686446 1430772742 /nfs/dbraw/zinc/77/27/42/1430772742.db2.gz GVZKYDQKKDWNQA-OAHLLOKOSA-N 0 0 398.463 3.398 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000183690350 1430773903 /nfs/dbraw/zinc/77/39/03/1430773903.db2.gz BAMQGHDJABKHEW-IBGZPJMESA-N 0 0 396.378 3.213 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@H](C)C[C@@H]2c2ccccc2F)ccc1[N+](=O)[O-] ZINC000183695528 1430774959 /nfs/dbraw/zinc/77/49/59/1430774959.db2.gz GVCPVIYIZNBAPL-BFUOFWGJSA-N 0 0 399.422 3.382 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@H](O)Cc1ccccc1 ZINC000183700679 1430776574 /nfs/dbraw/zinc/77/65/74/1430776574.db2.gz RMHNQBSLQGHQQI-BLLLJJGKSA-N 0 0 394.880 3.449 20 5 GGBDRN CCCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@@H]1C[C@@H](OCC)C12CCCC2 ZINC000183704451 1430777427 /nfs/dbraw/zinc/77/74/27/1430777427.db2.gz HYTGEQOMTQDIRK-HZPDHXFCSA-N 0 0 376.457 3.162 20 5 GGBDRN CCCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@@H]1C[C@H](OCC)C12CCCC2 ZINC000183704416 1430777523 /nfs/dbraw/zinc/77/75/23/1430777523.db2.gz HYTGEQOMTQDIRK-CVEARBPZSA-N 0 0 376.457 3.162 20 5 GGBDRN C[C@H](C(=O)NCc1cccc(Cn2ccnc2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183719688 1430780116 /nfs/dbraw/zinc/78/01/16/1430780116.db2.gz OZJYRVCXKZRHEF-AWEZNQCLSA-N 0 0 382.395 3.399 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cc(F)ccc2NC(C)C)ccc1[N+](=O)[O-] ZINC000183741383 1430784614 /nfs/dbraw/zinc/78/46/14/1430784614.db2.gz VYOBGNIDYXNOEU-UHFFFAOYSA-N 0 0 388.399 3.231 20 5 GGBDRN CCC(CC)c1cc(CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)on1 ZINC000183746893 1430785997 /nfs/dbraw/zinc/78/59/97/1430785997.db2.gz PABDAAJDWZXOQB-UHFFFAOYSA-N 0 0 381.454 3.149 20 5 GGBDRN COc1ccc(-n2ccc(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)n2)cc1 ZINC000183748727 1430786326 /nfs/dbraw/zinc/78/63/26/1430786326.db2.gz BSZLYGPIXUSIJG-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN CCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000183769001 1430790032 /nfs/dbraw/zinc/79/00/32/1430790032.db2.gz QLKARMXTEFJOPT-NRFANRHFSA-N 0 0 396.491 3.154 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1cccc(NC(=O)C2CCCCC2)c1 ZINC000183800214 1430796750 /nfs/dbraw/zinc/79/67/50/1430796750.db2.gz NEXVTFUQKBKMQH-UHFFFAOYSA-N 0 0 397.435 3.021 20 5 GGBDRN Cc1c(CNCc2ccc([N+](=O)[O-])cc2Cl)c(=O)n(-c2ccccc2)n1C ZINC000183805501 1430798042 /nfs/dbraw/zinc/79/80/42/1430798042.db2.gz XUGOFNZIUHYRGP-UHFFFAOYSA-N 0 0 386.839 3.336 20 5 GGBDRN CN(C)C(=O)COc1ccccc1CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000183804209 1430798135 /nfs/dbraw/zinc/79/81/35/1430798135.db2.gz YFPFGJBWQDFBRG-UHFFFAOYSA-N 0 0 377.828 3.005 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)c(C)c1 ZINC000183816262 1430800328 /nfs/dbraw/zinc/80/03/28/1430800328.db2.gz IOQJYOCLRHLLFQ-PIGZYNQJSA-N 0 0 392.358 3.315 20 5 GGBDRN COC(=O)[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(F)c(C)c1 ZINC000183827147 1430802029 /nfs/dbraw/zinc/80/20/29/1430802029.db2.gz YHEDKUVHALLTTN-LJQANCHMSA-N 0 0 399.378 3.097 20 5 GGBDRN COc1cc(CSc2nc3ccccc3c(=O)n2C)c([N+](=O)[O-])cc1F ZINC000183830533 1430802162 /nfs/dbraw/zinc/80/21/62/1430802162.db2.gz NYLSOYGZYQFNEH-UHFFFAOYSA-N 0 0 375.381 3.282 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCN([C@@H](C)c2ccsc2)CC1 ZINC000183835879 1430802898 /nfs/dbraw/zinc/80/28/98/1430802898.db2.gz OXRWQVQQYRXMNI-AWEZNQCLSA-N 0 0 395.506 3.032 20 5 GGBDRN Cc1c(C(=O)NCc2ncc(-c3ccccc3)cn2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000183853444 1430805180 /nfs/dbraw/zinc/80/51/80/1430805180.db2.gz HODRAUCPNMQEPA-UHFFFAOYSA-N 0 0 393.359 3.198 20 5 GGBDRN COc1cc(CN2C(=O)N[C@@](C)(c3ccccc3C)C2=O)c([N+](=O)[O-])cc1F ZINC000183855756 1430805524 /nfs/dbraw/zinc/80/55/24/1430805524.db2.gz JJBMRWVNGTYINQ-IBGZPJMESA-N 0 0 387.367 3.018 20 5 GGBDRN CC(=O)C[C@H]1COCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000183865450 1430806524 /nfs/dbraw/zinc/80/65/24/1430806524.db2.gz XQOCZFDHDWKPPO-KRWDZBQOSA-N 0 0 383.404 3.159 20 5 GGBDRN C[C@H](C(=O)NCCc1nc2ccc(F)cc2n1C)c1ccc([N+](=O)[O-])cc1F ZINC000183872498 1430807175 /nfs/dbraw/zinc/80/71/75/1430807175.db2.gz XBKIHEIESRNANA-NSHDSACASA-N 0 0 388.374 3.222 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000183876615 1430807715 /nfs/dbraw/zinc/80/77/15/1430807715.db2.gz FSJBENCESDEYOC-MAUKXSAKSA-N 0 0 381.432 3.038 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000183884824 1430808915 /nfs/dbraw/zinc/80/89/15/1430808915.db2.gz JYWYWFRPPAUXBN-CQSZACIVSA-N 0 0 387.411 3.308 20 5 GGBDRN CCN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCN(c2ccccc2)C1=O ZINC000183886181 1430808927 /nfs/dbraw/zinc/80/89/27/1430808927.db2.gz LPYVIQSLCQXMPG-IFXJQAMLSA-N 0 0 399.422 3.491 20 5 GGBDRN C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000183892664 1430809529 /nfs/dbraw/zinc/80/95/29/1430809529.db2.gz CZRFBNQHHPXGID-XCLFUZPHSA-N 0 0 395.415 3.333 20 5 GGBDRN C[NH+](C)[C@H](CNC(=O)c1ccc([O-])c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000183894579 1430809755 /nfs/dbraw/zinc/80/97/55/1430809755.db2.gz ZCDOHSYMFCKREQ-OAHLLOKOSA-N 0 0 397.353 3.352 20 5 GGBDRN C[NH+](C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)c1cccc(C(F)(F)F)c1 ZINC000183898390 1430810356 /nfs/dbraw/zinc/81/03/56/1430810356.db2.gz DQSQWGLCAABDTL-OAHLLOKOSA-N 0 0 397.353 3.352 20 5 GGBDRN CCOc1cc(Cl)ccc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183904009 1430811155 /nfs/dbraw/zinc/81/11/55/1430811155.db2.gz ZBTBHXDAHGLNFG-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN CCC[C@@H]1CCCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000183910730 1430812244 /nfs/dbraw/zinc/81/22/44/1430812244.db2.gz VIBMSFKJQHGLQH-OAHLLOKOSA-N 0 0 384.436 3.244 20 5 GGBDRN CC(C)(NC(=O)Nc1ccccc1CN1CCNC1=O)c1ccc([N+](=O)[O-])cc1 ZINC000183934545 1430815073 /nfs/dbraw/zinc/81/50/73/1430815073.db2.gz DGHSXBFUVPOPPH-UHFFFAOYSA-N 0 0 397.435 3.177 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000183935396 1430815338 /nfs/dbraw/zinc/81/53/38/1430815338.db2.gz ZEBHASPYVPEPBN-UHFFFAOYSA-N 0 0 390.465 3.235 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000183939285 1430815486 /nfs/dbraw/zinc/81/54/86/1430815486.db2.gz RHKSRXNYXWKQPC-CRAIPNDOSA-N 0 0 384.436 3.081 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N(C)C[C@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000183945476 1430816415 /nfs/dbraw/zinc/81/64/15/1430816415.db2.gz HAZXABKHDXQHHF-RYUDHWBXSA-N 0 0 378.454 3.122 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N(C)C[C@@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000183945494 1430816499 /nfs/dbraw/zinc/81/64/99/1430816499.db2.gz HAZXABKHDXQHHF-NEPJUHHUSA-N 0 0 378.454 3.122 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@@H]1[C@@H]1CCCCC1=O ZINC000183959777 1430818710 /nfs/dbraw/zinc/81/87/10/1430818710.db2.gz BDXDRSBRXNURAW-JKSUJKDBSA-N 0 0 380.466 3.124 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)NC(C)(C)c2ncc(C)s2)c([N+](=O)[O-])c1 ZINC000183959066 1430818732 /nfs/dbraw/zinc/81/87/32/1430818732.db2.gz VTCBIWGHYZWLRA-NSHDSACASA-N 0 0 378.454 3.220 20 5 GGBDRN C[C@H](NC(=O)Nc1ccccc1CN1CCNC1=O)c1cccc([N+](=O)[O-])c1 ZINC000183962434 1430819453 /nfs/dbraw/zinc/81/94/53/1430819453.db2.gz DOMMJZHKJVKJAF-ZDUSSCGKSA-N 0 0 383.408 3.003 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1-c1ncco1 ZINC000183973599 1430821234 /nfs/dbraw/zinc/82/12/34/1430821234.db2.gz QZLUWWKWPDVGBU-UHFFFAOYSA-N 0 0 394.387 3.235 20 5 GGBDRN COC(=O)COc1ccc([C@@H](C)Nc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000183975589 1430821420 /nfs/dbraw/zinc/82/14/20/1430821420.db2.gz NSAMPEURMVDUHI-SNVBAGLBSA-N 0 0 376.394 3.029 20 5 GGBDRN COc1cc(CNc2cc3c(cc2Cl)NC(=O)CO3)c([N+](=O)[O-])cc1F ZINC000184003025 1430827254 /nfs/dbraw/zinc/82/72/54/1430827254.db2.gz CMSXQGYVGODWKD-UHFFFAOYSA-N 0 0 381.747 3.339 20 5 GGBDRN CC(C)[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Cl)cc1F ZINC000184003364 1430827275 /nfs/dbraw/zinc/82/72/75/1430827275.db2.gz VUMDSHDYJQTMLU-KRWDZBQOSA-N 0 0 381.791 3.063 20 5 GGBDRN COc1cc(CNc2cc(C(=O)N(C)C)ccc2OC)c([N+](=O)[O-])cc1F ZINC000184006746 1430827860 /nfs/dbraw/zinc/82/78/60/1430827860.db2.gz HQUUQHVKZFIVFZ-UHFFFAOYSA-N 0 0 377.372 3.065 20 5 GGBDRN COc1cc(CNc2ccc(C)cc2OCC(=O)N(C)C)c([N+](=O)[O-])cc1F ZINC000184007421 1430828144 /nfs/dbraw/zinc/82/81/44/1430828144.db2.gz CWHHTLPERRMNTQ-UHFFFAOYSA-N 0 0 391.399 3.130 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184017753 1430829528 /nfs/dbraw/zinc/82/95/28/1430829528.db2.gz SOVQCOROLMLGKZ-LBPRGKRZSA-N 0 0 394.424 3.329 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@]1(C)Cc1ccccc1 ZINC000184024163 1430830708 /nfs/dbraw/zinc/83/07/08/1430830708.db2.gz CVPMUQQYXZTQFL-OPAMFIHVSA-N 0 0 395.459 3.337 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@@]1(C)Cc1ccccc1 ZINC000184024133 1430830794 /nfs/dbraw/zinc/83/07/94/1430830794.db2.gz CVPMUQQYXZTQFL-ZHRRBRCNSA-N 0 0 395.459 3.337 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H]2CC(C)(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000184034547 1430832186 /nfs/dbraw/zinc/83/21/86/1430832186.db2.gz RKMZYWMBYPALLA-KRWDZBQOSA-N 0 0 381.432 3.172 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(O)(Cc2cccc(F)c2)CC1 ZINC000184040393 1430833037 /nfs/dbraw/zinc/83/30/37/1430833037.db2.gz ICDOEADGAYJZRI-UHFFFAOYSA-N 0 0 386.423 3.263 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCC(O)(Cc2cccc(F)c2)CC1 ZINC000184047082 1430833784 /nfs/dbraw/zinc/83/37/84/1430833784.db2.gz PRPPOOKRSYUQCL-RMKNXTFCSA-N 0 0 384.407 3.343 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000184103880 1430841726 /nfs/dbraw/zinc/84/17/26/1430841726.db2.gz DLIMGGJLNKFFLU-LSDHHAIUSA-N 0 0 377.441 3.419 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000184108518 1430842322 /nfs/dbraw/zinc/84/23/22/1430842322.db2.gz OFJXIZIHEVPXFH-NSHDSACASA-N 0 0 384.371 3.150 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000184116869 1430843348 /nfs/dbraw/zinc/84/33/48/1430843348.db2.gz BLFQQTSAFRDHMU-ZDUSSCGKSA-N 0 0 392.506 3.049 20 5 GGBDRN CCOc1cccc(N[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1[N+](=O)[O-] ZINC000184117780 1430843750 /nfs/dbraw/zinc/84/37/50/1430843750.db2.gz YTGQABANTDBSHF-QGZVFWFLSA-N 0 0 385.420 3.215 20 5 GGBDRN CCCN(CC(=O)OC(C)(C)C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000184120511 1430843961 /nfs/dbraw/zinc/84/39/61/1430843961.db2.gz SMTLNBPJGMYLRG-UHFFFAOYSA-N 0 0 375.425 3.199 20 5 GGBDRN CSc1ccc(C(=O)N2CCN([C@@H](C)c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000184121238 1430844003 /nfs/dbraw/zinc/84/40/03/1430844003.db2.gz IZROXVIRTYHYSQ-LBPRGKRZSA-N 0 0 392.506 3.292 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(Cc1ccco1)Cc1ccco1 ZINC000184122771 1430844254 /nfs/dbraw/zinc/84/42/54/1430844254.db2.gz IQXKYBHAUSDPPT-UHFFFAOYSA-N 0 0 376.390 3.313 20 5 GGBDRN O=C(c1ccccc1)C1CCN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000184154112 1430848067 /nfs/dbraw/zinc/84/80/67/1430848067.db2.gz ZHTWUBKEAOSCFT-UHFFFAOYSA-N 0 0 388.445 3.020 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1)n2C ZINC000184166505 1430849853 /nfs/dbraw/zinc/84/98/53/1430849853.db2.gz MCDGERCIVYWAFS-UHFFFAOYSA-N 0 0 386.433 3.142 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](COCC(C)C)c1ccco1 ZINC000184173425 1430850865 /nfs/dbraw/zinc/85/08/65/1430850865.db2.gz 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Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1[O-] ZINC000184512846 1430897010 /nfs/dbraw/zinc/89/70/10/1430897010.db2.gz MXTZALPNVYGDLZ-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184517843 1430897536 /nfs/dbraw/zinc/89/75/36/1430897536.db2.gz PHEJMSUNHSRZNZ-CZUORRHYSA-N 0 0 378.425 3.442 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCSC[C@H]2c2nccs2)cc1[N+](=O)[O-] ZINC000184534949 1430899639 /nfs/dbraw/zinc/89/96/39/1430899639.db2.gz KOUURAKNQLAVJN-ZDUSSCGKSA-N 0 0 394.434 3.198 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)NC(C)(C)CC(N)=O)cc2[N+](=O)[O-])cc1 ZINC000184561193 1430904996 /nfs/dbraw/zinc/90/49/96/1430904996.db2.gz NIRQQJZSJDGURH-UHFFFAOYSA-N 0 0 387.461 3.438 20 5 GGBDRN CC(C)n1nnnc1-c1ccccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000184564165 1430905878 /nfs/dbraw/zinc/90/58/78/1430905878.db2.gz PJVNFZLODOYFHE-UHFFFAOYSA-N 0 0 396.407 3.237 20 5 GGBDRN Cc1c(C(=O)N2CCSC[C@H]2c2nccs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000184567968 1430906241 /nfs/dbraw/zinc/90/62/41/1430906241.db2.gz PXVHWFMVJUXOJK-ZDUSSCGKSA-N 0 0 394.434 3.198 20 5 GGBDRN COc1ccc([C@@H](C)CCNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000184575197 1430907630 /nfs/dbraw/zinc/90/76/30/1430907630.db2.gz KNQUUBDVOITONE-AWEZNQCLSA-N 0 0 378.450 3.217 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])[C@H](C)CO1 ZINC000184584706 1430909955 /nfs/dbraw/zinc/90/99/55/1430909955.db2.gz QHAFURPRJBAQCH-BEFAXECRSA-N 0 0 390.461 3.195 20 5 GGBDRN Cc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1-c1nnnn1C1CC1 ZINC000184597500 1430913662 /nfs/dbraw/zinc/91/36/62/1430913662.db2.gz BHHOWZPGBRJGFX-UHFFFAOYSA-N 0 0 378.392 3.073 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1-c1nnnn1C1CC1 ZINC000184597859 1430914255 /nfs/dbraw/zinc/91/42/55/1430914255.db2.gz GLTHDEYNBKMDHW-UHFFFAOYSA-N 0 0 382.355 3.283 20 5 GGBDRN CCCOc1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000184602150 1430915525 /nfs/dbraw/zinc/91/55/25/1430915525.db2.gz QNAAZMXAXOCQLR-UHFFFAOYSA-N 0 0 378.816 3.431 20 5 GGBDRN Cc1cc(NC(=O)N2CCn3c(nnc3-c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000184603213 1430915903 /nfs/dbraw/zinc/91/59/03/1430915903.db2.gz QYBWRDZASUYVCC-UHFFFAOYSA-N 0 0 378.392 3.209 20 5 GGBDRN Cc1cc(NC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000184608318 1430917999 /nfs/dbraw/zinc/91/79/99/1430917999.db2.gz GZDOQPLQPCZPRE-UHFFFAOYSA-N 0 0 397.840 3.152 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCN([C@@H](C)c2nccs2)CC1 ZINC000184609412 1430918524 /nfs/dbraw/zinc/91/85/24/1430918524.db2.gz CUOCDUJAFIRHSC-AWEZNQCLSA-N 0 0 376.482 3.329 20 5 GGBDRN C[C@H](C(=O)N1CCC(OC[C@H]2CCCCO2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184610013 1430918578 /nfs/dbraw/zinc/91/85/78/1430918578.db2.gz BLPDZPAZJHDPGC-WMLDXEAASA-N 0 0 394.443 3.414 20 5 GGBDRN C[C@H](C(=O)N1CCN(c2cc(F)ccc2F)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184616784 1430920412 /nfs/dbraw/zinc/92/04/12/1430920412.db2.gz XGFPZOVOGCPEOK-LBPRGKRZSA-N 0 0 393.365 3.464 20 5 GGBDRN CC[C@@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])Oc1ccccc1F ZINC000184633831 1430924825 /nfs/dbraw/zinc/92/48/25/1430924825.db2.gz PDMFMPSEYLIJFG-AWEZNQCLSA-N 0 0 382.413 3.011 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000184634946 1430925917 /nfs/dbraw/zinc/92/59/17/1430925917.db2.gz UDFQROQTCGFVKF-UHFFFAOYSA-N 0 0 393.852 3.392 20 5 GGBDRN O=C(NCCc1ccc2c(c1)CCO2)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184638876 1430926376 /nfs/dbraw/zinc/92/63/76/1430926376.db2.gz MYOZGEJKZKVZBK-UHFFFAOYSA-N 0 0 375.812 3.225 20 5 GGBDRN CC[C@@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])Oc1cccc(C)c1 ZINC000184639558 1430927010 /nfs/dbraw/zinc/92/70/10/1430927010.db2.gz WNCJDKKQDJQIGA-INIZCTEOSA-N 0 0 378.450 3.180 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)n2C ZINC000184640867 1430927295 /nfs/dbraw/zinc/92/72/95/1430927295.db2.gz BKRWFNUNCVSEQV-UHFFFAOYSA-N 0 0 383.408 3.429 20 5 GGBDRN CC[C@@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])Oc1ccccc1C ZINC000184640353 1430927611 /nfs/dbraw/zinc/92/76/11/1430927611.db2.gz FPVLSGWUXUBXMT-INIZCTEOSA-N 0 0 378.450 3.180 20 5 GGBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184645155 1430928822 /nfs/dbraw/zinc/92/88/22/1430928822.db2.gz WPJBNBXSVQQNSY-KPZWWZAWSA-N 0 0 378.425 3.477 20 5 GGBDRN COC(=O)C1(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCCC1 ZINC000184646783 1430929006 /nfs/dbraw/zinc/92/90/06/1430929006.db2.gz WKOMJXVJTHXFGV-UHFFFAOYSA-N 0 0 388.342 3.467 20 5 GGBDRN CC[C@@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])Oc1cccc(F)c1 ZINC000184655971 1430931732 /nfs/dbraw/zinc/93/17/32/1430931732.db2.gz RNSMMWMGVACCGT-HNNXBMFYSA-N 0 0 382.413 3.011 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(NS(C)(=O)=O)c1 ZINC000184671029 1430938248 /nfs/dbraw/zinc/93/82/48/1430938248.db2.gz VAAZXOSMGNSYIT-AWEZNQCLSA-N 0 0 391.449 3.174 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184676574 1430939760 /nfs/dbraw/zinc/93/97/60/1430939760.db2.gz KIVBBELCRZNFII-JTQLQIEISA-N 0 0 379.848 3.029 20 5 GGBDRN CCc1nc([C@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cs1 ZINC000184679059 1430940140 /nfs/dbraw/zinc/94/01/40/1430940140.db2.gz UDDQJPFRJAKQPU-NSHDSACASA-N 0 0 378.454 3.302 20 5 GGBDRN CCc1nc([C@@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cs1 ZINC000184679038 1430940277 /nfs/dbraw/zinc/94/02/77/1430940277.db2.gz UDDQJPFRJAKQPU-LLVKDONJSA-N 0 0 378.454 3.302 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1N1CCOCC1 ZINC000184705192 1430947656 /nfs/dbraw/zinc/94/76/56/1430947656.db2.gz ARJODXGOLPUSLB-SFHVURJKSA-N 0 0 397.475 3.317 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCN(c2nccs2)CC1 ZINC000184708858 1430948203 /nfs/dbraw/zinc/94/82/03/1430948203.db2.gz VDEUMRSVOSCYGA-INIZCTEOSA-N 0 0 388.493 3.359 20 5 GGBDRN Nc1ccc2c(c1)CCC[C@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000184710410 1430949013 /nfs/dbraw/zinc/94/90/13/1430949013.db2.gz GTUZSVOJAVMNEM-OAHLLOKOSA-N 0 0 381.841 3.186 20 5 GGBDRN Nc1ccc2c(c1)CCC[C@@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000184710395 1430949210 /nfs/dbraw/zinc/94/92/10/1430949210.db2.gz GTUZSVOJAVMNEM-HNNXBMFYSA-N 0 0 381.841 3.186 20 5 GGBDRN CCCCNC(=O)[C@H]1CCCN(C(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184717016 1430951602 /nfs/dbraw/zinc/95/16/02/1430951602.db2.gz GIMCDCAQFJXMGT-ROUUACIJSA-N 0 0 389.496 3.318 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCC(=O)N1CCCCCC1 ZINC000184718555 1430952048 /nfs/dbraw/zinc/95/20/48/1430952048.db2.gz QUIWRWOWAHBDJL-KRWDZBQOSA-N 0 0 375.469 3.072 20 5 GGBDRN Cc1ccc(Cl)c(OC[C@@H](O)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)c1 ZINC000184719505 1430952352 /nfs/dbraw/zinc/95/23/52/1430952352.db2.gz GUWCADXLOYQRHJ-AWEZNQCLSA-N 0 0 388.811 3.255 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@@H](C)c2csc(CC)n2)c([N+](=O)[O-])c1 ZINC000184738355 1430959850 /nfs/dbraw/zinc/95/98/50/1430959850.db2.gz JWBHHXYCDUMNMO-NSHDSACASA-N 0 0 378.454 3.302 20 5 GGBDRN CCc1nc([C@@H](C)NCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)cs1 ZINC000184748057 1430964816 /nfs/dbraw/zinc/96/48/16/1430964816.db2.gz PAVLSHCPZSLTSY-LLVKDONJSA-N 0 0 378.454 3.302 20 5 GGBDRN COC[C@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccc(C)o1 ZINC000184752573 1430965856 /nfs/dbraw/zinc/96/58/56/1430965856.db2.gz LYCLHZXWYWQVNX-NHYWBVRUSA-N 0 0 381.816 3.454 20 5 GGBDRN COC[C@@H](N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccc(C)o1 ZINC000184752588 1430966102 /nfs/dbraw/zinc/96/61/02/1430966102.db2.gz LYCLHZXWYWQVNX-IAQYHMDHSA-N 0 0 381.816 3.454 20 5 GGBDRN Cc1cccc2c1N(C1CC1)CCN2C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000184760724 1430969386 /nfs/dbraw/zinc/96/93/86/1430969386.db2.gz OGFMNGRQENQKPS-UHFFFAOYSA-N 0 0 381.388 3.261 20 5 GGBDRN COC[C@@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(C)o1 ZINC000184766600 1430970826 /nfs/dbraw/zinc/97/08/26/1430970826.db2.gz CLIIJPUQLMGHJA-IAQYHMDHSA-N 0 0 381.816 3.454 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(c2nncn2C2CC2)CC1 ZINC000184768879 1430971422 /nfs/dbraw/zinc/97/14/22/1430971422.db2.gz OTAMFCVGURFRGC-MRXNPFEDSA-N 0 0 397.479 3.496 20 5 GGBDRN O=[N+]([O-])c1ccc(CNc2ncnc3c2cnn3-c2ccncc2)c(Cl)c1 ZINC000184768126 1430971453 /nfs/dbraw/zinc/97/14/53/1430971453.db2.gz BIONZQQIBYIOCB-UHFFFAOYSA-N 0 0 381.783 3.384 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)S(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000184767460 1430971605 /nfs/dbraw/zinc/97/16/05/1430971605.db2.gz FFTHKBRFSPMPCK-OAHLLOKOSA-N 0 0 392.477 3.244 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCc1nnc2n1CCCCC2 ZINC000184788594 1430977521 /nfs/dbraw/zinc/97/75/21/1430977521.db2.gz JNAFNLBSBPXNDD-KRWDZBQOSA-N 0 0 399.495 3.230 20 5 GGBDRN CC(C)[C@@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CC1 ZINC000184807217 1430983743 /nfs/dbraw/zinc/98/37/43/1430983743.db2.gz PHEWTPVHGGRSKS-HIFRSBDPSA-N 0 0 382.482 3.333 20 5 GGBDRN C/C=C/C[C@@H](CO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000184807036 1430983881 /nfs/dbraw/zinc/98/38/81/1430983881.db2.gz 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O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(OC(F)F)c1 ZINC000184827169 1430992918 /nfs/dbraw/zinc/99/29/18/1430992918.db2.gz IHCYURLPHHFMBM-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN([C@H](C)c2nccs2)CC1 ZINC000184826759 1430993271 /nfs/dbraw/zinc/99/32/71/1430993271.db2.gz FREGOCBGURCZGI-CYBMUJFWSA-N 0 0 375.454 3.270 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccccc1OC(F)F ZINC000184830154 1430995023 /nfs/dbraw/zinc/99/50/23/1430995023.db2.gz UPZBZNDUXFUXTJ-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN COc1c(C)ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000184830715 1430995241 /nfs/dbraw/zinc/99/52/41/1430995241.db2.gz OXBJJSGKTFZZTO-UHFFFAOYSA-N 0 0 391.811 3.129 20 5 GGBDRN CCc1cc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)ccc1C ZINC000184831041 1430995284 /nfs/dbraw/zinc/99/52/84/1430995284.db2.gz ZPMYXVSZFBRWFY-UHFFFAOYSA-N 0 0 375.812 3.374 20 5 GGBDRN CCc1ccc([C@H](COC)N[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000184832121 1430996008 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CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](Cc2nccn2C)C1 ZINC000184873664 1431009101 /nfs/dbraw/zinc/00/91/01/1431009101.db2.gz RHNUXDORYLHKHP-QZTJIDSGSA-N 0 0 384.480 3.378 20 5 GGBDRN C[C@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ncc(-c2ccccc2)o1 ZINC000184874282 1431009194 /nfs/dbraw/zinc/00/91/94/1431009194.db2.gz IYUMSHRFWVWWDP-AWEZNQCLSA-N 0 0 392.415 3.490 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1CC(=O)c1cnn(C)c1 ZINC000184887048 1431013292 /nfs/dbraw/zinc/01/32/92/1431013292.db2.gz QSPOHFWWEKVUHA-APWZRJJASA-N 0 0 398.463 3.161 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184919079 1431021145 /nfs/dbraw/zinc/02/11/45/1431021145.db2.gz FBFFVNHZCRFFAU-SNVBAGLBSA-N 0 0 376.315 3.231 20 5 GGBDRN C[C@@H](C(=O)N1CCCN(C(=O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184948370 1431028333 /nfs/dbraw/zinc/02/83/33/1431028333.db2.gz DKCIVJWBCPVXRN-OAHLLOKOSA-N 0 0 399.422 3.212 20 5 GGBDRN C[N@@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1 ZINC000184953179 1431029051 /nfs/dbraw/zinc/02/90/51/1431029051.db2.gz YCXHFVKKGJYFCM-UHFFFAOYSA-N 0 0 383.448 3.285 20 5 GGBDRN O=C1CC[C@H]2CN(S(=O)(=O)CCc3ccccc3[N+](=O)[O-])c3cccc1c32 ZINC000184957315 1431030660 /nfs/dbraw/zinc/03/06/60/1431030660.db2.gz HUBMCUITBFETBD-AWEZNQCLSA-N 0 0 386.429 3.047 20 5 GGBDRN O=C1CC[C@H]2CN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3F)c3cccc1c32 ZINC000184959062 1431030942 /nfs/dbraw/zinc/03/09/42/1431030942.db2.gz CLOJZXLPUMEIGW-JTQLQIEISA-N 0 0 376.365 3.003 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)C[C@H](C)c2nccs2)cc1OC ZINC000184961020 1431031483 /nfs/dbraw/zinc/03/14/83/1431031483.db2.gz WRZGHUNRTYNTNF-NSHDSACASA-N 0 0 379.438 3.334 20 5 GGBDRN CCOC(=O)c1csc(NC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000185007317 1431040816 /nfs/dbraw/zinc/04/08/16/1431040816.db2.gz MDVJYNQHDVKMRW-GFCCVEGCSA-N 0 0 377.422 3.435 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000185008353 1431041099 /nfs/dbraw/zinc/04/10/99/1431041099.db2.gz KEUPFGBRTWFMMS-CQSZACIVSA-N 0 0 393.459 3.382 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000185008333 1431041192 /nfs/dbraw/zinc/04/11/92/1431041192.db2.gz KEUPFGBRTWFMMS-AWEZNQCLSA-N 0 0 393.459 3.382 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1 ZINC000185013964 1431042345 /nfs/dbraw/zinc/04/23/45/1431042345.db2.gz YIOCRPVSWMWPDR-AWEZNQCLSA-N 0 0 376.434 3.206 20 5 GGBDRN O=C(COc1c(F)cccc1[N+](=O)[O-])NCCc1ccc(OC(F)F)cc1 ZINC000185015468 1431042596 /nfs/dbraw/zinc/04/25/96/1431042596.db2.gz DQIQVQDRJDPRDL-UHFFFAOYSA-N 0 0 384.310 3.073 20 5 GGBDRN C[C@H](C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000185018645 1431042925 /nfs/dbraw/zinc/04/29/25/1431042925.db2.gz GCNDFESWCJCGDC-LIRRHRJNSA-N 0 0 399.422 3.317 20 5 GGBDRN CN(C)C(=O)CNC(=O)c1cccc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000185021460 1431043326 /nfs/dbraw/zinc/04/33/26/1431043326.db2.gz BLCUZVPARMEIML-UHFFFAOYSA-N 0 0 393.852 3.217 20 5 GGBDRN C[C@H](C(=O)NCCc1cc(F)cc2c1OCOC2)c1ccc([N+](=O)[O-])cc1F ZINC000185026708 1431044334 /nfs/dbraw/zinc/04/43/34/1431044334.db2.gz FVSLTXAQAQYLLS-NSHDSACASA-N 0 0 392.358 3.202 20 5 GGBDRN CCNC(=O)CNC(=O)c1cccc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000185027076 1431044571 /nfs/dbraw/zinc/04/45/71/1431044571.db2.gz WUNISECQYALNEG-UHFFFAOYSA-N 0 0 393.852 3.265 20 5 GGBDRN C[C@H](C(=O)NC(C)(C)C(=O)NCC1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000185032620 1431045233 /nfs/dbraw/zinc/04/52/33/1431045233.db2.gz CLFCGDFSSPIWBV-ZDUSSCGKSA-N 0 0 393.459 3.429 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000185036266 1431046488 /nfs/dbraw/zinc/04/64/88/1431046488.db2.gz SXYJGMNWTSQSDW-CQSZACIVSA-N 0 0 393.459 3.335 20 5 GGBDRN CC(=O)N[C@@H](C)CCc1ccc(C(=O)COc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000185036229 1431046495 /nfs/dbraw/zinc/04/64/95/1431046495.db2.gz WXKIYARUOLARFF-ZDUSSCGKSA-N 0 0 388.395 3.453 20 5 GGBDRN O=C(NCc1ccccc1)c1nnc(COc2c(F)cccc2[N+](=O)[O-])s1 ZINC000185038678 1431046604 /nfs/dbraw/zinc/04/66/04/1431046604.db2.gz UZUURCFOOZCBLV-UHFFFAOYSA-N 0 0 388.380 3.094 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000185037594 1431046622 /nfs/dbraw/zinc/04/66/22/1431046622.db2.gz AVVXYKJILWEOHL-UHFFFAOYSA-N 0 0 379.416 3.465 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cn1 ZINC000185048350 1431049111 /nfs/dbraw/zinc/04/91/11/1431049111.db2.gz KXFCAGJGHGKYRB-LBPRGKRZSA-N 0 0 383.383 3.043 20 5 GGBDRN C[C@H](C(=O)NCCN1CCc2sccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000185081737 1431056069 /nfs/dbraw/zinc/05/60/69/1431056069.db2.gz LUOMCWQEIPCFLK-LBPRGKRZSA-N 0 0 377.441 3.073 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCOCC2)nc1 ZINC000185100728 1431061304 /nfs/dbraw/zinc/06/13/04/1431061304.db2.gz MURZWWGYNRJSRN-MRXNPFEDSA-N 0 0 384.436 3.034 20 5 GGBDRN C[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000185103214 1431061524 /nfs/dbraw/zinc/06/15/24/1431061524.db2.gz GJFSDILPJCXPFL-LBPRGKRZSA-N 0 0 399.382 3.098 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NCCOc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000185116557 1431064232 /nfs/dbraw/zinc/06/42/32/1431064232.db2.gz KFSGKAUNOHCRSR-CYBMUJFWSA-N 0 0 384.392 3.383 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1NS(C)(=O)=O ZINC000185121507 1431065773 /nfs/dbraw/zinc/06/57/73/1431065773.db2.gz ICIVRLZXRWERQQ-LLVKDONJSA-N 0 0 395.412 3.156 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NCCOc3ccccc3[N+](=O)[O-])n2)c1 ZINC000185124869 1431066486 /nfs/dbraw/zinc/06/64/86/1431066486.db2.gz RWHREKBLEQYLRS-ZDUSSCGKSA-N 0 0 384.392 3.383 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NCCOc3ccccc3[N+](=O)[O-])n2)c1 ZINC000185124884 1431066559 /nfs/dbraw/zinc/06/65/59/1431066559.db2.gz RWHREKBLEQYLRS-CYBMUJFWSA-N 0 0 384.392 3.383 20 5 GGBDRN COc1ccccc1S(=O)(=O)CCCNc1c(C)ccc([N+](=O)[O-])c1C ZINC000185127596 1431067217 /nfs/dbraw/zinc/06/72/17/1431067217.db2.gz MGPNDJANLZMNAA-UHFFFAOYSA-N 0 0 378.450 3.496 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000185131308 1431068233 /nfs/dbraw/zinc/06/82/33/1431068233.db2.gz AWCFEZBSQJDMOW-UHFFFAOYSA-N 0 0 376.800 3.320 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1C ZINC000185135116 1431069748 /nfs/dbraw/zinc/06/97/48/1431069748.db2.gz AOWIJXVPDURURN-IBGZPJMESA-N 0 0 388.445 3.032 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000185137987 1431070532 /nfs/dbraw/zinc/07/05/32/1431070532.db2.gz LRBQWPSGIDEXOC-KRWDZBQOSA-N 0 0 394.836 3.068 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000185143815 1431071499 /nfs/dbraw/zinc/07/14/99/1431071499.db2.gz NPPDOYLVQBTVOR-KRWDZBQOSA-N 0 0 394.836 3.068 20 5 GGBDRN Cc1nc(N2CCN(C(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)CC2)sc1C ZINC000185144804 1431071945 /nfs/dbraw/zinc/07/19/45/1431071945.db2.gz XEAIFRLFVIMXJL-NSHDSACASA-N 0 0 392.456 3.260 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1F)C(=O)N1CC(=O)Nc2ccccc21 ZINC000185151998 1431073005 /nfs/dbraw/zinc/07/30/05/1431073005.db2.gz XGVQKCWVNYEZOS-SNVBAGLBSA-N 0 0 375.381 3.200 20 5 GGBDRN CCc1ccccc1NC(=O)CNC(=O)CSc1ccc([N+](=O)[O-])cc1F ZINC000185151895 1431073013 /nfs/dbraw/zinc/07/30/13/1431073013.db2.gz HKFCMMVHIFAMMC-UHFFFAOYSA-N 0 0 391.424 3.143 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000185153446 1431073083 /nfs/dbraw/zinc/07/30/83/1431073083.db2.gz MSICHKHRYBGOAY-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000185157437 1431073702 /nfs/dbraw/zinc/07/37/02/1431073702.db2.gz ZUYXVVFRBIBAAA-KKUMJFAQSA-N 0 0 393.459 3.381 20 5 GGBDRN CCn1c2nnc(CSc3ccc([N+](=O)[O-])cc3F)n2c2ccccc2c1=O ZINC000185156117 1431073833 /nfs/dbraw/zinc/07/38/33/1431073833.db2.gz BPLCYOUOWFTMDG-UHFFFAOYSA-N 0 0 399.407 3.404 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000185160921 1431074686 /nfs/dbraw/zinc/07/46/86/1431074686.db2.gz KCACFJONQRCISJ-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN C[C@H](C(=O)N(Cc1ccncc1)C[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1F ZINC000185161375 1431075031 /nfs/dbraw/zinc/07/50/31/1431075031.db2.gz QUORRTPGUMIDFR-YOEHRIQHSA-N 0 0 387.411 3.440 20 5 GGBDRN COc1ccc2cc(CN(C)C(=O)Cn3cc([N+](=O)[O-])c(C4CC4)n3)ccc2c1 ZINC000185162210 1431075188 /nfs/dbraw/zinc/07/51/88/1431075188.db2.gz QUWUQWVWEZQTGC-UHFFFAOYSA-N 0 0 394.431 3.489 20 5 GGBDRN O=C(Cc1nc(Cn2cc([N+](=O)[O-])c(C3CC3)n2)cs1)Nc1ccccc1 ZINC000185167363 1431076193 /nfs/dbraw/zinc/07/61/93/1431076193.db2.gz LZHMTINYQLZVTO-UHFFFAOYSA-N 0 0 383.433 3.355 20 5 GGBDRN COC(=O)CC1(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CCCCC1 ZINC000185178480 1431078212 /nfs/dbraw/zinc/07/82/12/1431078212.db2.gz RCANTEJBVUEXET-UHFFFAOYSA-N 0 0 387.436 3.248 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N[C@H](C)c2nc(C(C)(C)C)no2)cccc1[N+](=O)[O-] ZINC000185185394 1431079713 /nfs/dbraw/zinc/07/97/13/1431079713.db2.gz NGMYRHSRRJSHSQ-NWDGAFQWSA-N 0 0 375.429 3.262 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1 ZINC000185194845 1431081542 /nfs/dbraw/zinc/08/15/42/1431081542.db2.gz WZNLJHRWROMGDY-QFBILLFUSA-N 0 0 399.447 3.064 20 5 GGBDRN CN(C)C(=O)c1cc(F)ccc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000185200973 1431083209 /nfs/dbraw/zinc/08/32/09/1431083209.db2.gz VUYGHRFZUVQQCY-UHFFFAOYSA-N 0 0 385.355 3.098 20 5 GGBDRN Cc1cc(C)cc([C@H]2CCN(C(=O)[C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000185203692 1431084278 /nfs/dbraw/zinc/08/42/78/1431084278.db2.gz CNMGSZMDIUWTOE-AEFFLSMTSA-N 0 0 395.459 3.346 20 5 GGBDRN C[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1nc(C2CCCCC2)no1 ZINC000185215040 1431086492 /nfs/dbraw/zinc/08/64/92/1431086492.db2.gz VYIIHIUQZBZFPM-XJKSGUPXSA-N 0 0 390.440 3.116 20 5 GGBDRN O=C(c1ncoc1-c1ccc(F)cc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000185215288 1431086869 /nfs/dbraw/zinc/08/68/69/1431086869.db2.gz MPJBWKKERRKNIH-UHFFFAOYSA-N 0 0 396.378 3.351 20 5 GGBDRN COCc1c(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1 ZINC000185215566 1431087106 /nfs/dbraw/zinc/08/71/06/1431087106.db2.gz ATBKSBCDRCPJCH-CQSZACIVSA-N 0 0 380.404 3.418 20 5 GGBDRN COc1ccc(-c2csc(CNC(=O)c3cc([N+](=O)[O-])cnc3N)c2)cc1 ZINC000185217571 1431087315 /nfs/dbraw/zinc/08/73/15/1431087315.db2.gz BJCXWGWTSVGANX-UHFFFAOYSA-N 0 0 384.417 3.239 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000185222492 1431088379 /nfs/dbraw/zinc/08/83/79/1431088379.db2.gz IWFZEUJLQPMRLL-CHWSQXEVSA-N 0 0 380.322 3.441 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000185224593 1431088939 /nfs/dbraw/zinc/08/89/39/1431088939.db2.gz KXKWBXBCOIIBBK-QGZVFWFLSA-N 0 0 383.448 3.230 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000185224575 1431088960 /nfs/dbraw/zinc/08/89/60/1431088960.db2.gz KXKWBXBCOIIBBK-KRWDZBQOSA-N 0 0 383.448 3.230 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCCC(N)=O)cc1 ZINC000185226266 1431089168 /nfs/dbraw/zinc/08/91/68/1431089168.db2.gz GWBVZKZGDGYUBC-HNNXBMFYSA-N 0 0 385.420 3.056 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCCC(N)=O)cc1 ZINC000185226285 1431089200 /nfs/dbraw/zinc/08/92/00/1431089200.db2.gz GWBVZKZGDGYUBC-OAHLLOKOSA-N 0 0 385.420 3.056 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(OCC(=O)N(C)C)c1 ZINC000185245029 1431092530 /nfs/dbraw/zinc/09/25/30/1431092530.db2.gz LGADGGJWRCYIKN-INIZCTEOSA-N 0 0 399.447 3.269 20 5 GGBDRN COc1cccc(NCc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000185243492 1431092650 /nfs/dbraw/zinc/09/26/50/1431092650.db2.gz JQXMANLOUMDZBW-GASCZTMLSA-N 0 0 399.447 3.465 20 5 GGBDRN COc1cccc(NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c1[N+](=O)[O-] ZINC000185243601 1431092680 /nfs/dbraw/zinc/09/26/80/1431092680.db2.gz XUWOVENEEIPCJJ-MRXNPFEDSA-N 0 0 385.420 3.124 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1OCCC(N)=O ZINC000185246160 1431092915 /nfs/dbraw/zinc/09/29/15/1431092915.db2.gz YVSHCCQOLIBRRV-OAHLLOKOSA-N 0 0 385.420 3.056 20 5 GGBDRN C[C@@H](C(=O)N1CCN([C@H](C)c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185245084 1431092919 /nfs/dbraw/zinc/09/29/19/1431092919.db2.gz SJMXDCZCSGGZNX-HUUCEWRRSA-N 0 0 386.427 3.138 20 5 GGBDRN C[C@@H](C(=O)NCc1cccnc1OCC(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000185247415 1431093302 /nfs/dbraw/zinc/09/33/02/1431093302.db2.gz DVYKCHKYLXRKGM-SNVBAGLBSA-N 0 0 383.326 3.193 20 5 GGBDRN CCC1(CC)CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@@]1=O ZINC000185252147 1431093967 /nfs/dbraw/zinc/09/39/67/1431093967.db2.gz XTFFELQAVNEQGD-MHZLTWQESA-N 0 0 391.493 3.415 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCN(C3CC3)c3ccc(F)cc32)cc([N+](=O)[O-])c1 ZINC000185266855 1431096878 /nfs/dbraw/zinc/09/68/78/1431096878.db2.gz STTYHJGSOLAYHH-UHFFFAOYSA-N 0 0 399.378 3.150 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccc(S(C)(=O)=O)cc1 ZINC000185269999 1431097200 /nfs/dbraw/zinc/09/72/00/1431097200.db2.gz OZBZYPDRXUGFPI-OAHLLOKOSA-N 0 0 390.461 3.230 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(=O)N1CCCc2ccccc21 ZINC000185271081 1431097604 /nfs/dbraw/zinc/09/76/04/1431097604.db2.gz RZIBUVAGBQSWPE-KRWDZBQOSA-N 0 0 395.459 3.259 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CS(C)(=O)=O ZINC000185285158 1431099644 /nfs/dbraw/zinc/09/96/44/1431099644.db2.gz ORPSUGUBRZIPKG-OAHLLOKOSA-N 0 0 390.461 3.347 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cc(F)cc2c1OCOC2 ZINC000185301404 1431105438 /nfs/dbraw/zinc/10/54/38/1431105438.db2.gz APSZYWTYVXCAQA-CQSZACIVSA-N 0 0 388.395 3.486 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn(Cc2ccccn2)c1 ZINC000185304899 1431106736 /nfs/dbraw/zinc/10/67/36/1431106736.db2.gz FDZHIFVKPRUKDR-INIZCTEOSA-N 0 0 379.420 3.442 20 5 GGBDRN O=C(CN1CC[C@H](c2c(F)cccc2F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000185309249 1431108479 /nfs/dbraw/zinc/10/84/79/1431108479.db2.gz QBKPWLYTLZRNSF-AWEZNQCLSA-N 0 0 387.386 3.252 20 5 GGBDRN O=C(CN1CC[C@@H](c2c(F)cccc2F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000185309234 1431108502 /nfs/dbraw/zinc/10/85/02/1431108502.db2.gz QBKPWLYTLZRNSF-CQSZACIVSA-N 0 0 387.386 3.252 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1COc2c(cccc2OC)C1 ZINC000185322403 1431113666 /nfs/dbraw/zinc/11/36/66/1431113666.db2.gz GQKKXQMNJZEPET-RDJZCZTQSA-N 0 0 384.432 3.292 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1COc2c(cccc2OC)C1 ZINC000185322386 1431113684 /nfs/dbraw/zinc/11/36/84/1431113684.db2.gz GQKKXQMNJZEPET-NVXWUHKLSA-N 0 0 384.432 3.292 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O ZINC000185362843 1431126291 /nfs/dbraw/zinc/12/62/91/1431126291.db2.gz BEXAVIYPDRZSLA-MAUKXSAKSA-N 0 0 399.422 3.224 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1nnnn1-c1ccccc1 ZINC000185372182 1431128661 /nfs/dbraw/zinc/12/86/61/1431128661.db2.gz DYODLCSHFZJCIH-ZBFHGGJFSA-N 0 0 394.435 3.017 20 5 GGBDRN COCC1=CCN(C(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000185376772 1431129531 /nfs/dbraw/zinc/12/95/31/1431129531.db2.gz DQYBWQQNVCEZQP-HZPDHXFCSA-N 0 0 387.480 3.496 20 5 GGBDRN COc1ccc(OCCN[C@H](C)c2nc(Cc3ccccc3)no2)c([N+](=O)[O-])c1 ZINC000185380648 1431130787 /nfs/dbraw/zinc/13/07/87/1431130787.db2.gz GPFSNIARQIQQBY-CQSZACIVSA-N 0 0 398.419 3.307 20 5 GGBDRN C[C@@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1nc(Cc2ccccc2)no1 ZINC000185384327 1431132199 /nfs/dbraw/zinc/13/21/99/1431132199.db2.gz GTZXIGHZBJNGCV-CYBMUJFWSA-N 0 0 396.403 3.286 20 5 GGBDRN CN(Cc1ccccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185394108 1431134952 /nfs/dbraw/zinc/13/49/52/1431134952.db2.gz VKRVBSSEUZSADI-UHFFFAOYSA-N 0 0 375.381 3.103 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)c2ncccc12 ZINC000185394658 1431135366 /nfs/dbraw/zinc/13/53/66/1431135366.db2.gz VGTKHQJEZVGTDL-SNVBAGLBSA-N 0 0 389.355 3.106 20 5 GGBDRN C[C@@H](N[C@@H](C)c1nc(Cc2ccccc2)no1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000185404404 1431137429 /nfs/dbraw/zinc/13/74/29/1431137429.db2.gz RKJHULWUXVVXKV-KGLIPLIRSA-N 0 0 395.419 3.246 20 5 GGBDRN C[C@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000185406160 1431137767 /nfs/dbraw/zinc/13/77/67/1431137767.db2.gz LXEWSNCSEFKSLK-ORAYPTAESA-N 0 0 397.410 3.174 20 5 GGBDRN C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1nc(Cc2ccccc2)no1 ZINC000185410999 1431139191 /nfs/dbraw/zinc/13/91/91/1431139191.db2.gz KLBXKFSSHSZKKU-CQSZACIVSA-N 0 0 395.419 3.248 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)N(C)C(=O)CO2 ZINC000185427712 1431143369 /nfs/dbraw/zinc/14/33/69/1431143369.db2.gz TVKPGIHHINBMEC-AWEZNQCLSA-N 0 0 383.404 3.157 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2)C2CC2)c2ncccc12 ZINC000185428296 1431143382 /nfs/dbraw/zinc/14/33/82/1431143382.db2.gz ZFERGBPJYDUJJW-UHFFFAOYSA-N 0 0 383.429 3.496 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccccc1S(C)(=O)=O ZINC000185431480 1431144185 /nfs/dbraw/zinc/14/41/85/1431144185.db2.gz ILLXJFMXDPCANH-OAHLLOKOSA-N 0 0 390.461 3.230 20 5 GGBDRN COC(=O)c1ccc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000185432414 1431144551 /nfs/dbraw/zinc/14/45/51/1431144551.db2.gz IRLDCFPWIPMFCM-UHFFFAOYSA-N 0 0 381.747 3.496 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)n2)cc1 ZINC000185434535 1431144973 /nfs/dbraw/zinc/14/49/73/1431144973.db2.gz ISFSSIHDBGEIMP-CYBMUJFWSA-N 0 0 398.394 3.348 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CC(N)=O)C1CCCCC1 ZINC000185434662 1431145091 /nfs/dbraw/zinc/14/50/91/1431145091.db2.gz XICITBWPAGQDIF-MAUKXSAKSA-N 0 0 375.469 3.104 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CC(N)=O)C1CCCCC1 ZINC000185434624 1431145132 /nfs/dbraw/zinc/14/51/32/1431145132.db2.gz XICITBWPAGQDIF-YJBOKZPZSA-N 0 0 375.469 3.104 20 5 GGBDRN CN(C)C(=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000185436288 1431145226 /nfs/dbraw/zinc/14/52/26/1431145226.db2.gz JDPWRGNOAKELHT-UHFFFAOYSA-N 0 0 393.509 3.475 20 5 GGBDRN C[C@@H](c1ccsc1)N1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000185442051 1431146211 /nfs/dbraw/zinc/14/62/11/1431146211.db2.gz IPBDBDXZILHOGD-AWEZNQCLSA-N 0 0 389.477 3.402 20 5 GGBDRN C[C@@H](N[C@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000185447605 1431147387 /nfs/dbraw/zinc/14/73/87/1431147387.db2.gz BEWWUIOULCQAMR-YJYMSZOUSA-N 0 0 397.410 3.174 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)[C@@H]1CCCN1C(=O)c1cccs1 ZINC000185450056 1431148652 /nfs/dbraw/zinc/14/86/52/1431148652.db2.gz VFYPUXXIQPFGLL-HNNXBMFYSA-N 0 0 396.428 3.448 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccco1)C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000185452075 1431148864 /nfs/dbraw/zinc/14/88/64/1431148864.db2.gz GEQOEECQKHMAOS-MRXNPFEDSA-N 0 0 382.376 3.129 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)[C@H]1CC(=O)Nc2cc(F)ccc21 ZINC000185453192 1431149033 /nfs/dbraw/zinc/14/90/33/1431149033.db2.gz IEMHVVDGVDGSKH-ZDUSSCGKSA-N 0 0 380.335 3.347 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)[C@@H]1CCCCN1C(=O)c1ccco1 ZINC000185457631 1431149412 /nfs/dbraw/zinc/14/94/12/1431149412.db2.gz QBQOQMPRXVZIPJ-INIZCTEOSA-N 0 0 394.387 3.369 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(OC[C@H]2CCCO2)CC1 ZINC000185466565 1431151483 /nfs/dbraw/zinc/15/14/83/1431151483.db2.gz VJMIXZVNCRLAHI-YLJYHZDGSA-N 0 0 390.480 3.350 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N2CCC(O)(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000185476643 1431153667 /nfs/dbraw/zinc/15/36/67/1431153667.db2.gz RSXCDYAVTBWKMH-MRXNPFEDSA-N 0 0 383.448 3.214 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]2C2CCCC2)c2ncccc12 ZINC000185491986 1431156964 /nfs/dbraw/zinc/15/69/64/1431156964.db2.gz XSIZATNJIMPYOG-OAHLLOKOSA-N 0 0 375.450 3.486 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCN([C@H](C)c2ccsc2)CC1 ZINC000185493752 1431157119 /nfs/dbraw/zinc/15/71/19/1431157119.db2.gz GUOQNFJLBRLLED-OAHLLOKOSA-N 0 0 388.493 3.282 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCc3cc(F)ccc32)c2ncccc12 ZINC000185495366 1431157206 /nfs/dbraw/zinc/15/72/06/1431157206.db2.gz CEWIYQJPPGYGDX-OAHLLOKOSA-N 0 0 387.392 3.248 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(c2ncccc2F)C1 ZINC000185498780 1431158200 /nfs/dbraw/zinc/15/82/00/1431158200.db2.gz VWVPLWQADMGVIA-HZPDHXFCSA-N 0 0 386.427 3.093 20 5 GGBDRN O=C(CN1CCC(O)(c2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000185510215 1431161373 /nfs/dbraw/zinc/16/13/73/1431161373.db2.gz XAURMFWMKRZUTN-UHFFFAOYSA-N 0 0 389.839 3.170 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCOc1ncccc1Cl ZINC000185511435 1431161744 /nfs/dbraw/zinc/16/17/44/1431161744.db2.gz LCDCEJDXZGUWCL-AWEZNQCLSA-N 0 0 377.828 3.407 20 5 GGBDRN O=C(CN1CCC(O)(c2ccccc2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000185517615 1431162899 /nfs/dbraw/zinc/16/28/99/1431162899.db2.gz PSJLEOCOAFDGPB-UHFFFAOYSA-N 0 0 389.839 3.170 20 5 GGBDRN C[C@H](C(=O)N1CCN(CC(F)(F)F)CC1(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000185520085 1431163414 /nfs/dbraw/zinc/16/34/14/1431163414.db2.gz YPGQACUZZCFVRF-NSHDSACASA-N 0 0 391.365 3.323 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)C(=O)NCC1CCCC1 ZINC000185526041 1431164593 /nfs/dbraw/zinc/16/45/93/1431164593.db2.gz FLXXWQLKQBQXGW-QGZVFWFLSA-N 0 0 389.496 3.365 20 5 GGBDRN CC(C)(C)N(Cc1ccccc1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000185538795 1431167074 /nfs/dbraw/zinc/16/70/74/1431167074.db2.gz WYQBLFLLSGKHRB-UHFFFAOYSA-N 0 0 390.461 3.439 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](c3ccccc3)C2)c2ncccc12 ZINC000185546122 1431167952 /nfs/dbraw/zinc/16/79/52/1431167952.db2.gz JTTOGBNDWHSJOP-OAHLLOKOSA-N 0 0 383.429 3.321 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(CC(F)(F)F)[C@H](C)C1 ZINC000185549129 1431169198 /nfs/dbraw/zinc/16/91/98/1431169198.db2.gz LPLXCQIOILIDRI-HIFRSBDPSA-N 0 0 387.402 3.259 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1cccc(S(C)(=O)=O)c1 ZINC000185552296 1431169418 /nfs/dbraw/zinc/16/94/18/1431169418.db2.gz JCKQHLWQIFJXCS-HNNXBMFYSA-N 0 0 390.461 3.230 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1 ZINC000185553693 1431169638 /nfs/dbraw/zinc/16/96/38/1431169638.db2.gz ZMJOWTPJLLUATH-UHFFFAOYSA-N 0 0 392.297 3.029 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccnc(O[C@@H]2CCOC2)c1 ZINC000185558545 1431170500 /nfs/dbraw/zinc/17/05/00/1431170500.db2.gz WVJZVTGZUYOUIE-GFCCVEGCSA-N 0 0 397.309 3.429 20 5 GGBDRN CC(C)(CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1F ZINC000185569651 1431172467 /nfs/dbraw/zinc/17/24/67/1431172467.db2.gz QIKRSLDSMKAAMC-UHFFFAOYSA-N 0 0 393.802 3.420 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCC[C@H](C(C)C)CC1 ZINC000185578872 1431175238 /nfs/dbraw/zinc/17/52/38/1431175238.db2.gz HOTVOFJRSNRRKQ-KBPBESRZSA-N 0 0 377.441 3.263 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccc(N2CCOCC2)nc1 ZINC000185591236 1431178230 /nfs/dbraw/zinc/17/82/30/1431178230.db2.gz PQWREIBPPIEGQB-KRWDZBQOSA-N 0 0 398.463 3.058 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccc(N2CCOCC2)nc1 ZINC000185591257 1431178264 /nfs/dbraw/zinc/17/82/64/1431178264.db2.gz PQWREIBPPIEGQB-QGZVFWFLSA-N 0 0 398.463 3.058 20 5 GGBDRN CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1nc(C)cs1 ZINC000185600645 1431180720 /nfs/dbraw/zinc/18/07/20/1431180720.db2.gz YFRRLPLTEHFCDH-LBPRGKRZSA-N 0 0 392.462 3.338 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)n2C ZINC000185599689 1431180722 /nfs/dbraw/zinc/18/07/22/1431180722.db2.gz WWMNIKZLWXGLIZ-LBPRGKRZSA-N 0 0 383.408 3.051 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)n2C ZINC000185599704 1431180743 /nfs/dbraw/zinc/18/07/43/1431180743.db2.gz WWMNIKZLWXGLIZ-GFCCVEGCSA-N 0 0 383.408 3.051 20 5 GGBDRN O=C(CN1CCO[C@H](c2cccc(Cl)c2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000185608920 1431182920 /nfs/dbraw/zinc/18/29/20/1431182920.db2.gz SYZNKSHLTUTEJK-KRWDZBQOSA-N 0 0 375.812 3.260 20 5 GGBDRN CCCO[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000185611144 1431183466 /nfs/dbraw/zinc/18/34/66/1431183466.db2.gz KXXNOWLJXSEKAU-CQSZACIVSA-N 0 0 393.465 3.113 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000185620676 1431186427 /nfs/dbraw/zinc/18/64/27/1431186427.db2.gz IIBLVTYDARGJOD-PKOBYXMFSA-N 0 0 392.839 3.061 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1[N+](=O)[O-] ZINC000185621891 1431186595 /nfs/dbraw/zinc/18/65/95/1431186595.db2.gz XBRSEFPMPAEKQC-LBPRGKRZSA-N 0 0 389.358 3.136 20 5 GGBDRN COc1ccccc1C(=O)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000185624893 1431187392 /nfs/dbraw/zinc/18/73/92/1431187392.db2.gz BZMSIBXPQXFWGJ-UHFFFAOYSA-N 0 0 396.321 3.377 20 5 GGBDRN CCc1nc([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)cs1 ZINC000185625774 1431187731 /nfs/dbraw/zinc/18/77/31/1431187731.db2.gz KWDHXZNCRQLDFO-SNVBAGLBSA-N 0 0 392.462 3.201 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000185632609 1431189290 /nfs/dbraw/zinc/18/92/90/1431189290.db2.gz MELNUZJBNFVYEO-LPHOPBHVSA-N 0 0 392.839 3.061 20 5 GGBDRN CN([C@H]1CCc2ccccc2C1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185642423 1431192872 /nfs/dbraw/zinc/19/28/72/1431192872.db2.gz QFSQLLBVBMJSIK-INIZCTEOSA-N 0 0 397.456 3.321 20 5 GGBDRN CN([C@@H]1CCc2ccccc2C1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185642398 1431193071 /nfs/dbraw/zinc/19/30/71/1431193071.db2.gz QFSQLLBVBMJSIK-MRXNPFEDSA-N 0 0 397.456 3.321 20 5 GGBDRN COC(=O)[C@H](C)Oc1ccc(CNCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000185649765 1431195721 /nfs/dbraw/zinc/19/57/21/1431195721.db2.gz OJGNEYTYSVBAOO-LBPRGKRZSA-N 0 0 378.812 3.478 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCc2ccccc2[C@H]1CO ZINC000185654017 1431196551 /nfs/dbraw/zinc/19/65/51/1431196551.db2.gz ALNFICAJBXQZTR-MRXNPFEDSA-N 0 0 392.864 3.459 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(F)cc2OCC(F)(F)F)c1[N+](=O)[O-] ZINC000185652953 1431196806 /nfs/dbraw/zinc/19/68/06/1431196806.db2.gz SDXIKMLVMGWCJS-UHFFFAOYSA-N 0 0 376.266 3.213 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2(c3ccccc3F)CC2)c2ncccc12 ZINC000185659844 1431198739 /nfs/dbraw/zinc/19/87/39/1431198739.db2.gz BZZKASHMVFQBGO-UHFFFAOYSA-N 0 0 387.392 3.250 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCc2c1cccc2-c1ccccc1 ZINC000185661475 1431199232 /nfs/dbraw/zinc/19/92/32/1431199232.db2.gz SDOUTPMJSFFQSR-UHFFFAOYSA-N 0 0 375.384 3.013 20 5 GGBDRN COC(=O)COc1ccc([C@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000185664249 1431199602 /nfs/dbraw/zinc/19/96/02/1431199602.db2.gz HHJPNCRZRMHSIC-LBPRGKRZSA-N 0 0 385.376 3.139 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000185677866 1431203088 /nfs/dbraw/zinc/20/30/88/1431203088.db2.gz CZVCMXDAIHZINI-QWHCGFSZSA-N 0 0 392.456 3.199 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(CC(F)(F)F)c2ccncc2)c1C ZINC000185676697 1431203264 /nfs/dbraw/zinc/20/32/64/1431203264.db2.gz PFEGFHLZKHTEPA-UHFFFAOYSA-N 0 0 389.355 3.364 20 5 GGBDRN C[C@H](C(=O)N1CCN(c2ncccc2Cl)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185678739 1431203820 /nfs/dbraw/zinc/20/38/20/1431203820.db2.gz BADDYJYUIHNJEW-LBPRGKRZSA-N 0 0 392.818 3.235 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCc2ccccc2[C@@H]1CO ZINC000185708015 1431211374 /nfs/dbraw/zinc/21/13/74/1431211374.db2.gz UUNGHDJDJNIVAD-KRWDZBQOSA-N 0 0 390.823 3.135 20 5 GGBDRN O=C(NCCc1ccc(OCC(F)(F)F)nc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000185709686 1431212372 /nfs/dbraw/zinc/21/23/72/1431212372.db2.gz JQQISQVYHCPYHP-UHFFFAOYSA-N 0 0 384.314 3.295 20 5 GGBDRN CC[C@](C)(NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1nccs1 ZINC000185732048 1431218082 /nfs/dbraw/zinc/21/80/82/1431218082.db2.gz YYYUWXIKCHAIEN-INIZCTEOSA-N 0 0 392.462 3.203 20 5 GGBDRN CC[C@@](C)(NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1nccs1 ZINC000185732068 1431218338 /nfs/dbraw/zinc/21/83/38/1431218338.db2.gz YYYUWXIKCHAIEN-MRXNPFEDSA-N 0 0 392.462 3.203 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000185735004 1431218931 /nfs/dbraw/zinc/21/89/31/1431218931.db2.gz MUOKUVBNXKMCOV-UHFFFAOYSA-N 0 0 399.369 3.179 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2(c3cccc(F)c3)CC2)c2ncccc12 ZINC000185734607 1431219201 /nfs/dbraw/zinc/21/92/01/1431219201.db2.gz CUFLSSABIFNFLO-UHFFFAOYSA-N 0 0 387.392 3.250 20 5 GGBDRN Cc1ccc2nc(CSc3nc4cc([N+](=O)[O-])ccc4c(=O)n3C)cn2c1 ZINC000185736682 1431219661 /nfs/dbraw/zinc/21/96/61/1431219661.db2.gz AECUMISSIIIMNQ-UHFFFAOYSA-N 0 0 381.417 3.090 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000185739117 1431220124 /nfs/dbraw/zinc/22/01/24/1431220124.db2.gz XSPYKLHMUGLFRB-JTQLQIEISA-N 0 0 390.383 3.445 20 5 GGBDRN Cc1ccc(NC(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)cc1C ZINC000185755085 1431225463 /nfs/dbraw/zinc/22/54/63/1431225463.db2.gz LRARQWTUZOLDBR-UHFFFAOYSA-N 0 0 398.444 3.189 20 5 GGBDRN COC(=O)COc1ccc(CN(C)c2ccc3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000185758330 1431226883 /nfs/dbraw/zinc/22/68/83/1431226883.db2.gz PLGJMXHRTPPJQK-UHFFFAOYSA-N 0 0 381.388 3.331 20 5 GGBDRN CC(C)c1noc([C@@H](C)Sc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)n1 ZINC000185770472 1431230524 /nfs/dbraw/zinc/23/05/24/1431230524.db2.gz UXXYBCHTQIWHES-SECBINFHSA-N 0 0 375.410 3.201 20 5 GGBDRN Cc1c(C(=O)Nc2cc(C)c(O)c(C)c2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000185770538 1431230962 /nfs/dbraw/zinc/23/09/62/1431230962.db2.gz WFSPWWHGONAPIO-UHFFFAOYSA-N 0 0 381.392 3.367 20 5 GGBDRN Cc1nn(CCC(=O)N2CCc3c2cccc3C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000185774094 1431231808 /nfs/dbraw/zinc/23/18/08/1431231808.db2.gz SZBYRFAODPADBY-UHFFFAOYSA-N 0 0 382.342 3.406 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(C(F)F)cc2)C1=O ZINC000185775605 1431232266 /nfs/dbraw/zinc/23/22/66/1431232266.db2.gz DORGLOYYOGJCDV-GOSISDBHSA-N 0 0 375.331 3.500 20 5 GGBDRN Cc1ccc(C)c(C(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)c1 ZINC000185777679 1431232676 /nfs/dbraw/zinc/23/26/76/1431232676.db2.gz HYDIJGATPSWRBQ-UHFFFAOYSA-N 0 0 383.429 3.434 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185781916 1431234465 /nfs/dbraw/zinc/23/44/65/1431234465.db2.gz SKTZEXJHZBNQFJ-SJKOYZFVSA-N 0 0 396.852 3.399 20 5 GGBDRN COC(=O)[C@@H](NCc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccc(F)c(C)c1 ZINC000185783661 1431234972 /nfs/dbraw/zinc/23/49/72/1431234972.db2.gz SNNVXPMNALVYOB-KRWDZBQOSA-N 0 0 380.347 3.194 20 5 GGBDRN CN1Cc2cc(NC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)ccc2NC1=O ZINC000185841811 1431249009 /nfs/dbraw/zinc/24/90/09/1431249009.db2.gz RRKXDHVRBPTXCK-UHFFFAOYSA-N 0 0 392.375 3.010 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)c1[N+](=O)[O-] ZINC000185851116 1431251825 /nfs/dbraw/zinc/25/18/25/1431251825.db2.gz JWTCPJWTSOUQHA-OAHLLOKOSA-N 0 0 385.811 3.448 20 5 GGBDRN COc1cccc2c1CC[C@@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185851861 1431251932 /nfs/dbraw/zinc/25/19/32/1431251932.db2.gz WOMBIYRURHVTJO-HNNXBMFYSA-N 0 0 399.428 3.117 20 5 GGBDRN COCCC1(CNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)CCCC1 ZINC000185852127 1431251979 /nfs/dbraw/zinc/25/19/79/1431251979.db2.gz CPSCXLLDQKZTPJ-UHFFFAOYSA-N 0 0 393.465 3.018 20 5 GGBDRN COCc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cnn1-c1ccccc1 ZINC000185852827 1431252446 /nfs/dbraw/zinc/25/24/46/1431252446.db2.gz XZFFEMPNHPBBOU-UHFFFAOYSA-N 0 0 378.388 3.130 20 5 GGBDRN CC(C)c1ccnc(N2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000185855650 1431253192 /nfs/dbraw/zinc/25/31/92/1431253192.db2.gz OEYLSOHMOGTAKP-UHFFFAOYSA-N 0 0 375.860 3.484 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)n1 ZINC000185859184 1431253998 /nfs/dbraw/zinc/25/39/98/1431253998.db2.gz SSEMPELJDPCYNM-KRWDZBQOSA-N 0 0 398.444 3.372 20 5 GGBDRN CCOCCC1(CNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)CCC1 ZINC000185859082 1431254250 /nfs/dbraw/zinc/25/42/50/1431254250.db2.gz BITAHLYHABRYMF-UHFFFAOYSA-N 0 0 393.465 3.018 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2[C@@H]3c4ccccc4C[C@H]23)c2ncccc12 ZINC000185860878 1431254837 /nfs/dbraw/zinc/25/48/37/1431254837.db2.gz BWSUSSYYQFIQJE-GPMSIDNRSA-N 0 0 395.440 3.007 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3ccc(F)cc3C2)c2ncccc12 ZINC000185864859 1431255849 /nfs/dbraw/zinc/25/58/49/1431255849.db2.gz DSTMUQXXVZBDRS-UHFFFAOYSA-N 0 0 387.392 3.029 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1cccc(F)c1F ZINC000185884756 1431263316 /nfs/dbraw/zinc/26/33/16/1431263316.db2.gz WZQAJPOKMOVKOK-SNVBAGLBSA-N 0 0 393.371 3.461 20 5 GGBDRN Cc1nc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)c2ccc(Cl)cc2)no1 ZINC000185904108 1431272068 /nfs/dbraw/zinc/27/20/68/1431272068.db2.gz OTJXMWCQCUPFKC-OAHLLOKOSA-N 0 0 387.783 3.041 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185915169 1431277583 /nfs/dbraw/zinc/27/75/83/1431277583.db2.gz YBCGIRXWDVKOBI-CXAGYDPISA-N 0 0 398.444 3.310 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2)c1 ZINC000185941453 1431288759 /nfs/dbraw/zinc/28/87/59/1431288759.db2.gz SEHOYZYCUYYHKF-CQSZACIVSA-N 0 0 375.450 3.235 20 5 GGBDRN CN(C)C(=O)c1cc(F)ccc1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000185946572 1431290832 /nfs/dbraw/zinc/29/08/32/1431290832.db2.gz CJUFTRYEHZGSGU-UHFFFAOYSA-N 0 0 388.399 3.267 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C12CCOCC2 ZINC000185948249 1431291716 /nfs/dbraw/zinc/29/17/16/1431291716.db2.gz DSGNJPVDYHDENX-JKSUJKDBSA-N 0 0 397.859 3.022 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C12CCOCC2 ZINC000185948305 1431291768 /nfs/dbraw/zinc/29/17/68/1431291768.db2.gz DSGNJPVDYHDENX-CVEARBPZSA-N 0 0 397.859 3.022 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)c1 ZINC000185962022 1431299232 /nfs/dbraw/zinc/29/92/32/1431299232.db2.gz STUXEFFONWFWBG-KRWDZBQOSA-N 0 0 376.796 3.471 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000185970514 1431301246 /nfs/dbraw/zinc/30/12/46/1431301246.db2.gz DIJMFULBGWYYJU-CQSZACIVSA-N 0 0 378.816 3.138 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(C2CC2)S(=O)(=O)Cc2noc3ccccc32)c1 ZINC000185975115 1431302845 /nfs/dbraw/zinc/30/28/45/1431302845.db2.gz POOAIVINBGZAQQ-UHFFFAOYSA-N 0 0 387.417 3.230 20 5 GGBDRN CSc1cccc(C(=O)NC[C@@H](c2ccco2)N2CCCC2)c1[N+](=O)[O-] ZINC000185981743 1431304412 /nfs/dbraw/zinc/30/44/12/1431304412.db2.gz UPANBPWMKPNTMF-AWEZNQCLSA-N 0 0 375.450 3.477 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@@H](c2cccc(O)c2)C1 ZINC000185997955 1431307790 /nfs/dbraw/zinc/30/77/90/1431307790.db2.gz LPLHVGVSGJKWDE-QGZVFWFLSA-N 0 0 391.811 3.237 20 5 GGBDRN Cn1ccnc1CC1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000186006048 1431309873 /nfs/dbraw/zinc/30/98/73/1431309873.db2.gz HQFJGNSUHYTUTI-UHFFFAOYSA-N 0 0 391.859 3.146 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H](CCO)c1ccccc1 ZINC000186007614 1431310001 /nfs/dbraw/zinc/31/00/01/1431310001.db2.gz GECDYDVRBDVNPX-CQSZACIVSA-N 0 0 377.828 3.214 20 5 GGBDRN O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(Cl)cc1 ZINC000186008094 1431310109 /nfs/dbraw/zinc/31/01/09/1431310109.db2.gz YRIBDRWHJJLFJN-UHFFFAOYSA-N 0 0 397.218 3.340 20 5 GGBDRN COc1ccccc1[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000186009812 1431310976 /nfs/dbraw/zinc/31/09/76/1431310976.db2.gz CNVLXASBZYCKBU-IBGZPJMESA-N 0 0 399.428 3.066 20 5 GGBDRN COc1ccc(OCCN(C)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186011711 1431311221 /nfs/dbraw/zinc/31/12/21/1431311221.db2.gz VMYMWTGTCNMBKF-UHFFFAOYSA-N 0 0 393.827 3.477 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC(OCc3ccc(F)cc3)CC2)c1 ZINC000186019563 1431312699 /nfs/dbraw/zinc/31/26/99/1431312699.db2.gz IKTWDDAPBCJVST-UHFFFAOYSA-N 0 0 394.424 3.104 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1[C@@H]1CCCCC1=O ZINC000186055581 1431320939 /nfs/dbraw/zinc/32/09/39/1431320939.db2.gz FMDKIVNYJZYFBM-HOTGVXAUSA-N 0 0 380.466 3.070 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCO[C@@H](CCc2ccccc2)C1 ZINC000186058330 1431321194 /nfs/dbraw/zinc/32/11/94/1431321194.db2.gz MTFFTSNTYNIXQI-IBGZPJMESA-N 0 0 383.448 3.175 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@H](CCc2ccccc2)C1 ZINC000186058476 1431321701 /nfs/dbraw/zinc/32/17/01/1431321701.db2.gz NFAXBWFUYUYSIH-SJLPKXTDSA-N 0 0 383.448 3.255 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCO[C@@H](CCc3ccccc3)C2)c2c(c1)COCO2 ZINC000186067932 1431323612 /nfs/dbraw/zinc/32/36/12/1431323612.db2.gz UFZHMRMBFLPNTC-FQEVSTJZSA-N 0 0 384.432 3.295 20 5 GGBDRN O=C(CN1CCC(C(=O)C(F)(F)F)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000186070294 1431324333 /nfs/dbraw/zinc/32/43/33/1431324333.db2.gz ODLWYHRKKGZANU-UHFFFAOYSA-N 0 0 393.749 3.030 20 5 GGBDRN CSc1cccc(C(=O)NCc2ccc(Cn3cccn3)cc2)c1[N+](=O)[O-] ZINC000186076751 1431325570 /nfs/dbraw/zinc/32/55/70/1431325570.db2.gz NULDPUJIELLTGX-UHFFFAOYSA-N 0 0 382.445 3.492 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@@H](CCc4ccccc4)C3)n2)cc1 ZINC000186092971 1431328952 /nfs/dbraw/zinc/32/89/52/1431328952.db2.gz QRGXONOJHXYMFY-IBGZPJMESA-N 0 0 394.431 3.478 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC1(Cc2cccc(F)c2)CCC1 ZINC000186095680 1431329258 /nfs/dbraw/zinc/32/92/58/1431329258.db2.gz UKWRTGYILRXVDK-UHFFFAOYSA-N 0 0 378.425 3.319 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000186097484 1431329751 /nfs/dbraw/zinc/32/97/51/1431329751.db2.gz BWWPVTOGTVVUGL-UHFFFAOYSA-N 0 0 387.274 3.124 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccc([N+](=O)[O-])s1 ZINC000186099790 1431329951 /nfs/dbraw/zinc/32/99/51/1431329951.db2.gz MFORKHGNPCHLMI-SNVBAGLBSA-N 0 0 399.350 3.210 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000186127720 1431336746 /nfs/dbraw/zinc/33/67/46/1431336746.db2.gz ZXGMCMSAYCDLHB-UHFFFAOYSA-N 0 0 387.274 3.124 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000186134740 1431338134 /nfs/dbraw/zinc/33/81/34/1431338134.db2.gz DMXGXXMPLIEXFG-UHFFFAOYSA-N 0 0 383.330 3.482 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCC[C@H]2CCCCO2)c(C(F)(F)F)c1 ZINC000186156582 1431343182 /nfs/dbraw/zinc/34/31/82/1431343182.db2.gz DTQXCLZQRRZQIL-GFCCVEGCSA-N 0 0 396.387 3.241 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@H]1CCO[C@]2(CCOC2)C1 ZINC000186171813 1431346326 /nfs/dbraw/zinc/34/63/26/1431346326.db2.gz GIQRKNXCPJUGBM-QMHKHESXSA-N 0 0 393.439 3.036 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000186184076 1431348279 /nfs/dbraw/zinc/34/82/79/1431348279.db2.gz IAZAKZAWRGLTPG-KGLIPLIRSA-N 0 0 389.431 3.416 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000186186615 1431348682 /nfs/dbraw/zinc/34/86/82/1431348682.db2.gz YFJKZAHDUKQBNL-QGZVFWFLSA-N 0 0 376.796 3.227 20 5 GGBDRN Cc1nn(CCC(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)c(C)c1[N+](=O)[O-] ZINC000186195418 1431350355 /nfs/dbraw/zinc/35/03/55/1431350355.db2.gz WRHSMXCMAOELAS-MRXNPFEDSA-N 0 0 392.843 3.052 20 5 GGBDRN CSc1cccc(C(=O)NCc2ccc(CN3CCCC3=O)cc2)c1[N+](=O)[O-] ZINC000186215328 1431354630 /nfs/dbraw/zinc/35/46/30/1431354630.db2.gz ITABXNKJVZPJNL-UHFFFAOYSA-N 0 0 399.472 3.369 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)[C@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000186272795 1431368368 /nfs/dbraw/zinc/36/83/68/1431368368.db2.gz HCXVUNYGYXVLCB-SNVBAGLBSA-N 0 0 386.376 3.263 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000186278054 1431369777 /nfs/dbraw/zinc/36/97/77/1431369777.db2.gz HMDUBISMZJLNGP-INIZCTEOSA-N 0 0 380.397 3.172 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000186286038 1431371767 /nfs/dbraw/zinc/37/17/67/1431371767.db2.gz RMSGMQGVFFYMTE-OAHLLOKOSA-N 0 0 380.397 3.268 20 5 GGBDRN CCc1c(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cnn1-c1ccc(OC)cc1 ZINC000186290618 1431372779 /nfs/dbraw/zinc/37/27/79/1431372779.db2.gz JAODTVCHRYVSRC-UHFFFAOYSA-N 0 0 381.392 3.307 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)[C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000186293163 1431373689 /nfs/dbraw/zinc/37/36/89/1431373689.db2.gz LUSFWANQVUPBIQ-HNNXBMFYSA-N 0 0 380.397 3.051 20 5 GGBDRN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1csc([N+](=O)[O-])c1 ZINC000186301308 1431376123 /nfs/dbraw/zinc/37/61/23/1431376123.db2.gz AEVVSUJWZKTKBO-ZDUSSCGKSA-N 0 0 395.506 3.389 20 5 GGBDRN C[C@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186306650 1431377641 /nfs/dbraw/zinc/37/76/41/1431377641.db2.gz HRCJMGUJQZVAPL-LBPRGKRZSA-N 0 0 381.860 3.340 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](C)c3cccc(O)c32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000186315379 1431380048 /nfs/dbraw/zinc/38/00/48/1431380048.db2.gz WFYVJRRJAFIAEE-GFCCVEGCSA-N 0 0 393.403 3.344 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000186316619 1431380358 /nfs/dbraw/zinc/38/03/58/1431380358.db2.gz LLRSHGNUBNDQDX-QGZVFWFLSA-N 0 0 394.786 3.366 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2c(O)cccc21 ZINC000186325216 1431382934 /nfs/dbraw/zinc/38/29/34/1431382934.db2.gz CBJPOIAVDDOBIZ-LBPRGKRZSA-N 0 0 379.376 3.035 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(C)cc1 ZINC000186326187 1431383189 /nfs/dbraw/zinc/38/31/89/1431383189.db2.gz WIPVVIZHUIQHNI-SFHVURJKSA-N 0 0 389.839 3.440 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)cccc1[N+](=O)[O-] ZINC000186325650 1431383209 /nfs/dbraw/zinc/38/32/09/1431383209.db2.gz LWCJJKHDJCHFEQ-OAHLLOKOSA-N 0 0 379.775 3.183 20 5 GGBDRN CCCS(=O)(=O)c1ccccc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186329139 1431384196 /nfs/dbraw/zinc/38/41/96/1431384196.db2.gz SRKSOMUMFOLGEY-UHFFFAOYSA-N 0 0 396.852 3.362 20 5 GGBDRN CCOc1cnc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cn1 ZINC000186341432 1431387660 /nfs/dbraw/zinc/38/76/60/1431387660.db2.gz GMORXOLPLJMUFB-UHFFFAOYSA-N 0 0 385.405 3.468 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cccs1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186343845 1431387998 /nfs/dbraw/zinc/38/79/98/1431387998.db2.gz QQOPQZYLGMPZQZ-HNNXBMFYSA-N 0 0 395.868 3.381 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186350318 1431389395 /nfs/dbraw/zinc/38/93/95/1431389395.db2.gz RCNKXDPZHXRWHC-OCCSQVGLSA-N 0 0 381.860 3.149 20 5 GGBDRN Cc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cnn1C1CCOCC1 ZINC000186351357 1431389558 /nfs/dbraw/zinc/38/95/58/1431389558.db2.gz QAOALRMEAAITPW-UHFFFAOYSA-N 0 0 378.816 3.035 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)[C@@H]1Oc1ccccc1 ZINC000186357076 1431390981 /nfs/dbraw/zinc/39/09/81/1431390981.db2.gz ZKIWXEBCDROPKT-QFUCXCTJSA-N 0 0 384.432 3.187 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000186381555 1431396872 /nfs/dbraw/zinc/39/68/72/1431396872.db2.gz YUXMJFNMNSEEHR-SFHVURJKSA-N 0 0 391.374 3.199 20 5 GGBDRN CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000186398431 1431401023 /nfs/dbraw/zinc/40/10/23/1431401023.db2.gz KEDPTQUXEFCMSO-KSSFIOAISA-N 0 0 381.432 3.077 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000186417484 1431411071 /nfs/dbraw/zinc/41/10/71/1431411071.db2.gz OLBIWIJUAJONGN-LLVKDONJSA-N 0 0 383.832 3.235 20 5 GGBDRN C[C@H](C(=O)NCCCc1nc2ccccc2n1C)c1ccc([N+](=O)[O-])cc1F ZINC000186419082 1431412264 /nfs/dbraw/zinc/41/22/64/1431412264.db2.gz CBDFLRNPVVJLAP-ZDUSSCGKSA-N 0 0 384.411 3.473 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186427072 1431415471 /nfs/dbraw/zinc/41/54/71/1431415471.db2.gz RPRRNOCXLUDSBY-NRFANRHFSA-N 0 0 381.432 3.445 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186435120 1431418627 /nfs/dbraw/zinc/41/86/27/1431418627.db2.gz XRBWKXKOMUAVED-QFIPXVFZSA-N 0 0 393.443 3.467 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186435097 1431418941 /nfs/dbraw/zinc/41/89/41/1431418941.db2.gz XRBWKXKOMUAVED-JOCHJYFZSA-N 0 0 393.443 3.467 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000186435690 1431419516 /nfs/dbraw/zinc/41/95/16/1431419516.db2.gz LQEXOSCKRJPYPE-UHFFFAOYSA-N 0 0 380.322 3.136 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)[C@H](C)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000186482762 1431432032 /nfs/dbraw/zinc/43/20/32/1431432032.db2.gz YGZFSZLTAAQUHP-GFCCVEGCSA-N 0 0 382.413 3.433 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(-c2cncnc2)cc1F ZINC000186499359 1431437934 /nfs/dbraw/zinc/43/79/34/1431437934.db2.gz NJRLZXKPOXWQFQ-UHFFFAOYSA-N 0 0 382.351 3.130 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(c3nccc(C(C)C)n3)CC2)cc1[N+](=O)[O-] ZINC000186502360 1431438877 /nfs/dbraw/zinc/43/88/77/1431438877.db2.gz ZFTGAUYGRGPLOP-UHFFFAOYSA-N 0 0 383.452 3.033 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)cc([N+](=O)[O-])c1F ZINC000186519950 1431444622 /nfs/dbraw/zinc/44/46/22/1431444622.db2.gz CHBUMIJAMBHMHK-IAQYHMDHSA-N 0 0 379.413 3.209 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@@H](OC(C)C)c2ccccc2OC)c1[N+](=O)[O-] ZINC000186526579 1431446201 /nfs/dbraw/zinc/44/62/01/1431446201.db2.gz IVCRCHPLSWHRMO-MRXNPFEDSA-N 0 0 390.440 3.175 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2C[C@@H](OCc3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000186540005 1431449499 /nfs/dbraw/zinc/44/94/99/1431449499.db2.gz KRJTYKDIQZVEGZ-JKSUJKDBSA-N 0 0 386.452 3.384 20 5 GGBDRN Cc1ccccc1C(NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccccc1C ZINC000186541122 1431449714 /nfs/dbraw/zinc/44/97/14/1431449714.db2.gz QMLQGFCRGPGHCG-UHFFFAOYSA-N 0 0 393.447 3.497 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)[C@H](C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000186540543 1431449745 /nfs/dbraw/zinc/44/97/45/1431449745.db2.gz XVSJLZJPJVODLZ-SNVBAGLBSA-N 0 0 386.376 3.263 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000186554256 1431452632 /nfs/dbraw/zinc/45/26/32/1431452632.db2.gz BMBVPZOSHXRIAF-UHFFFAOYSA-N 0 0 381.388 3.195 20 5 GGBDRN COc1cc(OCC(=O)Nc2nc3cccc(Cl)c3n2C)ccc1[N+](=O)[O-] ZINC000186558504 1431453767 /nfs/dbraw/zinc/45/37/67/1431453767.db2.gz IMEVGCLVPSKAEN-UHFFFAOYSA-N 0 0 390.783 3.161 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cccc1[N+](=O)[O-] ZINC000186562571 1431454864 /nfs/dbraw/zinc/45/48/64/1431454864.db2.gz JAAKNLBBGXLKIH-UHFFFAOYSA-N 0 0 381.388 3.195 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCc3cc(N)ccc32)cc1OC ZINC000186570375 1431456654 /nfs/dbraw/zinc/45/66/54/1431456654.db2.gz MYEOWROQKMNHNK-INIZCTEOSA-N 0 0 385.420 3.392 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)ccc1[N+](=O)[O-] ZINC000186575326 1431458475 /nfs/dbraw/zinc/45/84/75/1431458475.db2.gz IQFIWMFFFJKGGI-UHFFFAOYSA-N 0 0 381.388 3.195 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)NCC1(c2ccc(F)cc2Cl)CCCC1 ZINC000186585017 1431460840 /nfs/dbraw/zinc/46/08/40/1431460840.db2.gz UIPYDUAMFBCFQU-UHFFFAOYSA-N 0 0 380.807 3.212 20 5 GGBDRN CSc1cccc(C(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)c1[N+](=O)[O-] ZINC000186592671 1431463033 /nfs/dbraw/zinc/46/30/33/1431463033.db2.gz LENSHJIQANDFKF-WFASDCNBSA-N 0 0 385.445 3.241 20 5 GGBDRN CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000186595300 1431463825 /nfs/dbraw/zinc/46/38/25/1431463825.db2.gz WYAMSELJUJIWIM-UHFFFAOYSA-N 0 0 389.408 3.454 20 5 GGBDRN C[C@@H](C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1cn(C)c2ccccc12 ZINC000186649639 1431480224 /nfs/dbraw/zinc/48/02/24/1431480224.db2.gz SJOBWIVAAIDIMO-HUUCEWRRSA-N 0 0 393.447 3.298 20 5 GGBDRN CCOc1cc(C(=O)N[C@@H]2CCCc3cc(N)ccc32)c([N+](=O)[O-])cc1OC ZINC000186653672 1431481776 /nfs/dbraw/zinc/48/17/76/1431481776.db2.gz JODGMYNVPZIKIG-MRXNPFEDSA-N 0 0 385.420 3.392 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCN(C3CC3)c3ccc(F)cc32)cc1 ZINC000186674053 1431489126 /nfs/dbraw/zinc/48/91/26/1431489126.db2.gz JLIGYGJVUGMWFH-UHFFFAOYSA-N 0 0 391.424 3.053 20 5 GGBDRN O=C(CN1CC[C@@]2(C1)OCc1ccccc12)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000186683234 1431491071 /nfs/dbraw/zinc/49/10/71/1431491071.db2.gz XHFNRIQJGBXPLC-IBGZPJMESA-N 0 0 387.823 3.318 20 5 GGBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000186683764 1431491654 /nfs/dbraw/zinc/49/16/54/1431491654.db2.gz LBIMVJRVZWCFGR-GOEBONIOSA-N 0 0 396.230 3.214 20 5 GGBDRN O=C(CN1CC[C@@]2(C1)OCc1ccccc12)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186715513 1431499695 /nfs/dbraw/zinc/49/96/95/1431499695.db2.gz LMDVILBPNWAJHR-IBGZPJMESA-N 0 0 387.823 3.318 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccc([N+](=O)[O-])cc1 ZINC000186717199 1431500069 /nfs/dbraw/zinc/50/00/69/1431500069.db2.gz OOOBQUPVPXFZHM-AWEZNQCLSA-N 0 0 393.321 3.149 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccccc1[N+](=O)[O-] ZINC000186717045 1431500099 /nfs/dbraw/zinc/50/00/99/1431500099.db2.gz YKTMLLSFYIWQDX-ZDUSSCGKSA-N 0 0 393.321 3.149 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000186717953 1431500776 /nfs/dbraw/zinc/50/07/76/1431500776.db2.gz HEUGWCOAQNPXKE-UHFFFAOYSA-N 0 0 397.357 3.006 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1 ZINC000186720004 1431501153 /nfs/dbraw/zinc/50/11/53/1431501153.db2.gz PCCGLHVDFCJHEM-UHFFFAOYSA-N 0 0 392.297 3.029 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000186724501 1431502395 /nfs/dbraw/zinc/50/23/95/1431502395.db2.gz LBWLEHYBKUCERW-MEBBXXQBSA-N 0 0 391.346 3.062 20 5 GGBDRN Nc1ccc(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)cc1[N+](=O)[O-] ZINC000186730735 1431503803 /nfs/dbraw/zinc/50/38/03/1431503803.db2.gz WKTYXFMKKZKPTQ-UHFFFAOYSA-N 0 0 380.326 3.307 20 5 GGBDRN Cc1cc(OCC(=O)NCCc2ccc(OC(F)F)cc2)c(F)cc1[N+](=O)[O-] ZINC000186731745 1431504231 /nfs/dbraw/zinc/50/42/31/1431504231.db2.gz FBUXDXDJGFSYNK-UHFFFAOYSA-N 0 0 398.337 3.381 20 5 GGBDRN Nc1c(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)cccc1[N+](=O)[O-] ZINC000186745624 1431507103 /nfs/dbraw/zinc/50/71/03/1431507103.db2.gz XORAYISBEMUOJK-UHFFFAOYSA-N 0 0 380.326 3.307 20 5 GGBDRN CSc1cccc(C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1[N+](=O)[O-] ZINC000186753396 1431508562 /nfs/dbraw/zinc/50/85/62/1431508562.db2.gz XUMZPHIEVPTREY-UHFFFAOYSA-N 0 0 377.397 3.410 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCN(C3CC3)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000186766641 1431511133 /nfs/dbraw/zinc/51/11/33/1431511133.db2.gz NJQZJADYTBYLOF-UHFFFAOYSA-N 0 0 381.388 3.011 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000186774732 1431513455 /nfs/dbraw/zinc/51/34/55/1431513455.db2.gz BMMUUQJIITULBT-UHFFFAOYSA-N 0 0 396.268 3.180 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000186784458 1431515971 /nfs/dbraw/zinc/51/59/71/1431515971.db2.gz WQVJCSGLCCFYOE-SFHVURJKSA-N 0 0 399.382 3.387 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000186784496 1431516080 /nfs/dbraw/zinc/51/60/80/1431516080.db2.gz RGWISMWOFQFRHM-ZUZCIYMTSA-N 0 0 391.346 3.209 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000186784478 1431516093 /nfs/dbraw/zinc/51/60/93/1431516093.db2.gz RGWISMWOFQFRHM-BONVTDFDSA-N 0 0 391.346 3.209 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000186784523 1431516124 /nfs/dbraw/zinc/51/61/24/1431516124.db2.gz RGWISMWOFQFRHM-MEBBXXQBSA-N 0 0 391.346 3.209 20 5 GGBDRN Cn1c2ccccc2nc1C(C)(C)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000186800345 1431520121 /nfs/dbraw/zinc/52/01/21/1431520121.db2.gz MHZNDHGTHQVMIF-UHFFFAOYSA-N 0 0 381.436 3.335 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCSC2(CCOCC2)C1 ZINC000186824852 1431529626 /nfs/dbraw/zinc/52/96/26/1431529626.db2.gz JSQQHXYVLSBQNQ-GFCCVEGCSA-N 0 0 399.900 3.173 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CNC(=O)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000186849269 1431539499 /nfs/dbraw/zinc/53/94/99/1431539499.db2.gz ZDPBBEBRBBLOBG-UHFFFAOYSA-N 0 0 389.452 3.211 20 5 GGBDRN Cc1c(CC(=O)N[C@H](c2cnn(C)c2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000186864209 1431545277 /nfs/dbraw/zinc/54/52/77/1431545277.db2.gz QWKYDJYTTJQUDI-FQEVSTJZSA-N 0 0 382.395 3.224 20 5 GGBDRN Nc1ccc(C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000186864603 1431545519 /nfs/dbraw/zinc/54/55/19/1431545519.db2.gz URGDPKYDIJXYDR-LLVKDONJSA-N 0 0 391.811 3.498 20 5 GGBDRN C[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@@H+]1Cc1ccccc1 ZINC000186869947 1431547862 /nfs/dbraw/zinc/54/78/62/1431547862.db2.gz JWUUBQQZSKJRTG-RDJZCZTQSA-N 0 0 383.448 3.426 20 5 GGBDRN C[C@H]1CCCCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C1 ZINC000186869644 1431548109 /nfs/dbraw/zinc/54/81/09/1431548109.db2.gz HZKWQLCWOOFIBR-LBPRGKRZSA-N 0 0 375.454 3.137 20 5 GGBDRN COC(=O)c1scc(C)c1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000186881674 1431552832 /nfs/dbraw/zinc/55/28/32/1431552832.db2.gz PYLHUKZXFDKBAM-UHFFFAOYSA-N 0 0 386.389 3.189 20 5 GGBDRN COc1ccc(C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)cc1[N+](=O)[O-] ZINC000186886405 1431554932 /nfs/dbraw/zinc/55/49/32/1431554932.db2.gz IPORBEUSOMSHGY-KRWDZBQOSA-N 0 0 378.331 3.095 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000186888300 1431555488 /nfs/dbraw/zinc/55/54/88/1431555488.db2.gz JEOLTOFXELFYAV-GOSISDBHSA-N 0 0 391.374 3.275 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)ccc1[N+](=O)[O-] ZINC000186887683 1431555505 /nfs/dbraw/zinc/55/55/05/1431555505.db2.gz LUQODNZLXQEZRO-KRWDZBQOSA-N 0 0 378.331 3.095 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccsc1 ZINC000186898958 1431559428 /nfs/dbraw/zinc/55/94/28/1431559428.db2.gz SGTDEYNIRVEVGW-LBPRGKRZSA-N 0 0 388.323 3.319 20 5 GGBDRN CSc1cccc(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1[N+](=O)[O-] ZINC000186902613 1431560337 /nfs/dbraw/zinc/56/03/37/1431560337.db2.gz AYRLSHWPSHKHAF-MRXNPFEDSA-N 0 0 399.472 3.238 20 5 GGBDRN CSc1cccc(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1[N+](=O)[O-] ZINC000186902631 1431560494 /nfs/dbraw/zinc/56/04/94/1431560494.db2.gz AYRLSHWPSHKHAF-INIZCTEOSA-N 0 0 399.472 3.238 20 5 GGBDRN CN(CC1(O)CCCCCC1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000186915222 1431564247 /nfs/dbraw/zinc/56/42/47/1431564247.db2.gz BEUPSWOXHRYAOO-UHFFFAOYSA-N 0 0 375.469 3.352 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)n2)cc1 ZINC000186923056 1431567065 /nfs/dbraw/zinc/56/70/65/1431567065.db2.gz JQEUMLOYUDOLNU-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])n2)cc1 ZINC000186934538 1431570522 /nfs/dbraw/zinc/57/05/22/1431570522.db2.gz DYSKRRXLULJUJC-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NCC2(CO)CCCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000186943505 1431572827 /nfs/dbraw/zinc/57/28/27/1431572827.db2.gz WFRMRZNFVONRIZ-OAHLLOKOSA-N 0 0 398.463 3.445 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186947852 1431573941 /nfs/dbraw/zinc/57/39/41/1431573941.db2.gz CXUABEYJAWHBHR-OAQYLSRUSA-N 0 0 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3.457 20 5 GGBDRN COc1cc(OCC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000187694026 1431800844 /nfs/dbraw/zinc/80/08/44/1431800844.db2.gz STIHWDFXAURJBP-AWEZNQCLSA-N 0 0 398.337 3.445 20 5 GGBDRN Cc1nn(CCC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000187721361 1431803958 /nfs/dbraw/zinc/80/39/58/1431803958.db2.gz DZLFVOLBOFDSBY-AWEZNQCLSA-N 0 0 384.358 3.261 20 5 GGBDRN CC(C)c1ccc(C(=O)N[C@H](C)c2nnnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000187738943 1431806282 /nfs/dbraw/zinc/80/62/82/1431806282.db2.gz GAIJLSCGYCIYPH-CYBMUJFWSA-N 0 0 380.408 3.185 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000187751392 1431808127 /nfs/dbraw/zinc/80/81/27/1431808127.db2.gz COVNKZWINFUDNX-YVEFUNNKSA-N 0 0 399.369 3.218 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1[N+](=O)[O-] ZINC000187759922 1431809323 /nfs/dbraw/zinc/80/93/23/1431809323.db2.gz OPUOBFSTIAFAKF-HNNXBMFYSA-N 0 0 395.415 3.176 20 5 GGBDRN C[C@H](Nc1ccc(OC2COC2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000187766413 1431810018 /nfs/dbraw/zinc/81/00/18/1431810018.db2.gz VPORDMCRZYQMFG-NSHDSACASA-N 0 0 391.811 3.465 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)[C@H]2CCCC[C@H]2S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000187770778 1431810362 /nfs/dbraw/zinc/81/03/62/1431810362.db2.gz OFFUZJMCOAQPLL-DOTOQJQBSA-N 0 0 382.482 3.146 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000187775481 1431810956 /nfs/dbraw/zinc/81/09/56/1431810956.db2.gz YGDZVMSKFGOCLU-KVSKMBFKSA-N 0 0 395.459 3.241 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1(c2ccc(F)cc2F)CCCC1 ZINC000187781911 1431811874 /nfs/dbraw/zinc/81/18/74/1431811874.db2.gz ZYTJNJRSHILQKX-UHFFFAOYSA-N 0 0 378.379 3.006 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1CCC[C@H]1CCO ZINC000187816493 1431815852 /nfs/dbraw/zinc/81/58/52/1431815852.db2.gz BCFHAASTPCAYFY-WCQYABFASA-N 0 0 389.374 3.083 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ccc(Cl)cc2F)C1=O ZINC000187817440 1431815896 /nfs/dbraw/zinc/81/58/96/1431815896.db2.gz PYPIZJFMSQJYFC-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000187819063 1431816092 /nfs/dbraw/zinc/81/60/92/1431816092.db2.gz VUZBLVTXBKVPMF-JSGCOSHPSA-N 0 0 382.376 3.231 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCC(c2ccsc2)CC1 ZINC000187818842 1431816141 /nfs/dbraw/zinc/81/61/41/1431816141.db2.gz LPZJLEFBVBJWHX-UHFFFAOYSA-N 0 0 383.433 3.257 20 5 GGBDRN CC(C)c1ccc(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000187820972 1431816414 /nfs/dbraw/zinc/81/64/14/1431816414.db2.gz GVGMSECIIWUYJC-KRWDZBQOSA-N 0 0 390.461 3.234 20 5 GGBDRN CCc1cc(N2CCC(NC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)ncn1 ZINC000187823910 1431816863 /nfs/dbraw/zinc/81/68/63/1431816863.db2.gz BFOSISBCHUTNEL-UHFFFAOYSA-N 0 0 397.479 3.469 20 5 GGBDRN O=C([C@@H](O)Cc1cccc(C(F)(F)F)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000187825412 1431816874 /nfs/dbraw/zinc/81/68/74/1431816874.db2.gz IAIHCJPAQGCCOO-INIZCTEOSA-N 0 0 380.322 3.106 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@H]2CCC[C@@H]2CCO)cc1[N+](=O)[O-])c1ccccn1 ZINC000187847588 1431819591 /nfs/dbraw/zinc/81/95/91/1431819591.db2.gz DCYDGRWEPUKACV-DAYGRLMNSA-N 0 0 398.463 3.444 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@@H]3CCC[C@H]3CCO)cc2[N+](=O)[O-])CC1 ZINC000187855598 1431820580 /nfs/dbraw/zinc/82/05/80/1431820580.db2.gz IFDOEJBPIDCAAP-DOTOQJQBSA-N 0 0 375.469 3.112 20 5 GGBDRN NC(=O)c1ccc(CSCc2nc(-c3ccccc3F)no2)c([N+](=O)[O-])c1 ZINC000187874037 1431822397 /nfs/dbraw/zinc/82/23/97/1431822397.db2.gz LPNHRSXANOTANX-UHFFFAOYSA-N 0 0 388.380 3.316 20 5 GGBDRN Cc1cc(=O)c(C(=O)Nc2ccsc2Cl)nn1-c1ccccc1[N+](=O)[O-] ZINC000187885581 1431824024 /nfs/dbraw/zinc/82/40/24/1431824024.db2.gz LPTWQMUVMIVFPL-UHFFFAOYSA-N 0 0 390.808 3.416 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2ccn(-c3ccccc3F)n2)cccc1[N+](=O)[O-] ZINC000187943703 1431829914 /nfs/dbraw/zinc/82/99/14/1431829914.db2.gz NLKFWTJRBDXDBY-UHFFFAOYSA-N 0 0 389.408 3.343 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(Cc3csc(C)n3)CC2)c1[N+](=O)[O-] ZINC000188029760 1431837852 /nfs/dbraw/zinc/83/78/52/1431837852.db2.gz ZMYTWYDVAIJIDS-UHFFFAOYSA-N 0 0 392.506 3.040 20 5 GGBDRN CCN(C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)[C@H](C)Cc1ccsc1 ZINC000188040980 1431839229 /nfs/dbraw/zinc/83/92/29/1431839229.db2.gz HIKWSJSCLHNPFH-CYBMUJFWSA-N 0 0 375.450 3.383 20 5 GGBDRN CCCCNC(=O)C1CCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])CC1 ZINC000188048922 1431839804 /nfs/dbraw/zinc/83/98/04/1431839804.db2.gz RCWQVWAPJJZYCW-UHFFFAOYSA-N 0 0 379.482 3.085 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)CCN2C(=O)c3ccccc3C2=O)cc1[N+](=O)[O-] ZINC000188072596 1431842400 /nfs/dbraw/zinc/84/24/00/1431842400.db2.gz XUMICFZYBQAHRH-UHFFFAOYSA-N 0 0 395.415 3.086 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)c2cccc(SC)c2[N+](=O)[O-])CC1 ZINC000188071080 1431842433 /nfs/dbraw/zinc/84/24/33/1431842433.db2.gz XEJDIQANOLIGJJ-UHFFFAOYSA-N 0 0 393.509 3.474 20 5 GGBDRN CSc1cccc(C(=O)NCc2ccc(-n3ccnc3C)nc2)c1[N+](=O)[O-] ZINC000188073185 1431842647 /nfs/dbraw/zinc/84/26/47/1431842647.db2.gz QOSSWWHSTQHFTH-UHFFFAOYSA-N 0 0 383.433 3.136 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)c3cccc(SC)c3[N+](=O)[O-])n2)cc1 ZINC000188080336 1431843819 /nfs/dbraw/zinc/84/38/19/1431843819.db2.gz MQUODQCBXYKDRU-UHFFFAOYSA-N 0 0 398.444 3.441 20 5 GGBDRN Cc1cc(S(N)(=O)=O)cc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1C ZINC000188085884 1431844811 /nfs/dbraw/zinc/84/48/11/1431844811.db2.gz HKFVTHDXLANORC-UHFFFAOYSA-N 0 0 391.449 3.235 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(F)c(NS(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000188097741 1431846262 /nfs/dbraw/zinc/84/62/62/1431846262.db2.gz MXSWGKFDDBTYFZ-UHFFFAOYSA-N 0 0 395.412 3.481 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000188100279 1431846475 /nfs/dbraw/zinc/84/64/75/1431846475.db2.gz WKEBMGAZGFXAHR-KBPBESRZSA-N 0 0 393.509 3.474 20 5 GGBDRN COC(=O)[C@H]1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000188105436 1431847328 /nfs/dbraw/zinc/84/73/28/1431847328.db2.gz NYHATMAHQRFMKY-WBMJQRKESA-N 0 0 375.450 3.349 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000188116857 1431849023 /nfs/dbraw/zinc/84/90/23/1431849023.db2.gz MCMHORQELMOYFB-SJORKVTESA-N 0 0 381.432 3.369 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cc(F)ccc2Cl)C1=O ZINC000188130352 1431850721 /nfs/dbraw/zinc/85/07/21/1431850721.db2.gz VQLFHKJYRXQHNS-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(COc2cccc(F)c2)no1 ZINC000188151503 1431853437 /nfs/dbraw/zinc/85/34/37/1431853437.db2.gz VKOKDUOLNSGWBN-LLVKDONJSA-N 0 0 386.339 3.187 20 5 GGBDRN CSc1cccc(C(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000188159468 1431854607 /nfs/dbraw/zinc/85/46/07/1431854607.db2.gz VTVZZWPTRIBCMZ-CYBMUJFWSA-N 0 0 393.509 3.331 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NCC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188161580 1431854882 /nfs/dbraw/zinc/85/48/82/1431854882.db2.gz OQZKYTOKZHXYED-UHFFFAOYSA-N 0 0 382.342 3.048 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCc1ccc(-n2ccnc2)cc1 ZINC000188184169 1431857942 /nfs/dbraw/zinc/85/79/42/1431857942.db2.gz PSPHYLNORKWYKC-UHFFFAOYSA-N 0 0 393.428 3.320 20 5 GGBDRN O=C1N[C@@]2(CCCc3sccc32)C(=O)N1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000188199244 1431859694 /nfs/dbraw/zinc/85/96/94/1431859694.db2.gz HAFWUHFXZWDHIP-QGZVFWFLSA-N 0 0 375.381 3.079 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)c2ccc(N3CCOCC3)nc2)cc1[N+](=O)[O-] ZINC000188197995 1431859822 /nfs/dbraw/zinc/85/98/22/1431859822.db2.gz ZOCOYMVORFBJGP-UHFFFAOYSA-N 0 0 384.436 3.226 20 5 GGBDRN Cc1nn(Cc2ccccc2)c2sc(C(=O)Nc3c([N+](=O)[O-])cnn3C)cc12 ZINC000188213352 1431861523 /nfs/dbraw/zinc/86/15/23/1431861523.db2.gz DDDXKADYPPTYNL-UHFFFAOYSA-N 0 0 396.432 3.349 20 5 GGBDRN Cc1cc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)nc(C(F)(F)F)n1 ZINC000188214727 1431861556 /nfs/dbraw/zinc/86/15/56/1431861556.db2.gz GFLOBNQSXYAHMS-UHFFFAOYSA-N 0 0 392.297 3.354 20 5 GGBDRN CC[C@@H](CO)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000188238615 1431864733 /nfs/dbraw/zinc/86/47/33/1431864733.db2.gz GJZKTWGSLPRKCH-NSHDSACASA-N 0 0 391.811 3.001 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)c1[N+](=O)[O-] ZINC000188266441 1431867086 /nfs/dbraw/zinc/86/70/86/1431867086.db2.gz IMNGMVFLWOVNAB-JTQLQIEISA-N 0 0 398.250 3.196 20 5 GGBDRN CC(C)Cn1c(SCc2ccc([N+](=O)[O-])c(F)c2)nnc1N1CCOCC1 ZINC000188271311 1431867922 /nfs/dbraw/zinc/86/79/22/1431867922.db2.gz KIQXCURODQYQPV-UHFFFAOYSA-N 0 0 395.460 3.110 20 5 GGBDRN CC[C@@H](CO)NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000188282327 1431869095 /nfs/dbraw/zinc/86/90/95/1431869095.db2.gz JYBLSUHJTIHXFL-AWEZNQCLSA-N 0 0 377.828 3.361 20 5 GGBDRN CSc1cccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c1[N+](=O)[O-] ZINC000188297388 1431870748 /nfs/dbraw/zinc/87/07/48/1431870748.db2.gz UVOQFPSRUUJOLI-CYBMUJFWSA-N 0 0 385.445 3.131 20 5 GGBDRN C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000188331535 1431874189 /nfs/dbraw/zinc/87/41/89/1431874189.db2.gz AFTGQBNRDXZCPG-HNNXBMFYSA-N 0 0 389.477 3.328 20 5 GGBDRN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000188336677 1431874576 /nfs/dbraw/zinc/87/45/76/1431874576.db2.gz ZJIPAEGFZDJFCN-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000188336749 1431874631 /nfs/dbraw/zinc/87/46/31/1431874631.db2.gz ZJIPAEGFZDJFCN-BLLLJJGKSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000188338670 1431874743 /nfs/dbraw/zinc/87/47/43/1431874743.db2.gz LVCSLTRBJKHGNN-YVEFUNNKSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000188338646 1431874748 /nfs/dbraw/zinc/87/47/48/1431874748.db2.gz LVCSLTRBJKHGNN-SJKOYZFVSA-N 0 0 396.852 3.399 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000188350627 1431876071 /nfs/dbraw/zinc/87/60/71/1431876071.db2.gz XLBWFAWUXUODAN-SFHVURJKSA-N 0 0 376.359 3.406 20 5 GGBDRN Cc1cccc(N(C)CCCOc2ccc(S(C)(=O)=O)cc2)c1[N+](=O)[O-] ZINC000188368344 1431877812 /nfs/dbraw/zinc/87/78/12/1431877812.db2.gz VGVQXYLYNKQLEO-UHFFFAOYSA-N 0 0 378.450 3.212 20 5 GGBDRN COc1ccc(CCC(=O)N2CCN(c3cccc(C)c3[N+](=O)[O-])CC2)cc1 ZINC000188369011 1431877818 /nfs/dbraw/zinc/87/78/18/1431877818.db2.gz VUZKGORUBBCKQX-UHFFFAOYSA-N 0 0 383.448 3.193 20 5 GGBDRN Cc1c(CC(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)cccc1[N+](=O)[O-] ZINC000188384670 1431879619 /nfs/dbraw/zinc/87/96/19/1431879619.db2.gz GOHWFQAQIFZPPH-GOSISDBHSA-N 0 0 376.359 3.324 20 5 GGBDRN O=C(NCc1nc2ccccc2s1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188384256 1431879635 /nfs/dbraw/zinc/87/96/35/1431879635.db2.gz ZNZRCJBZIONLEF-UHFFFAOYSA-N 0 0 384.417 3.177 20 5 GGBDRN O=C(NCc1ccc(-c2nc3ccccc3[nH]2)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000188389370 1431880115 /nfs/dbraw/zinc/88/01/15/1431880115.db2.gz YZBQGEMJEHLUNI-UHFFFAOYSA-N 0 0 389.371 3.169 20 5 GGBDRN O=C(N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1(Cc2ccccc2F)CC1 ZINC000188428518 1431883519 /nfs/dbraw/zinc/88/35/19/1431883519.db2.gz WFSRKHQLLIHXIE-HNNXBMFYSA-N 0 0 384.411 3.165 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccccc2NC(=O)C[C@@H]2C=CCC2)c1[N+](=O)[O-] ZINC000188438224 1431884183 /nfs/dbraw/zinc/88/41/83/1431884183.db2.gz DKNFXOBBLVUXED-GFCCVEGCSA-N 0 0 383.408 3.427 20 5 GGBDRN C[C@@H](NC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000188442622 1431884422 /nfs/dbraw/zinc/88/44/22/1431884422.db2.gz UGGGROVWJVUJCH-BZNIZROVSA-N 0 0 382.338 3.394 20 5 GGBDRN Cc1nc2c(cnn2C(C)C)cc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188448503 1431884775 /nfs/dbraw/zinc/88/47/75/1431884775.db2.gz MPNSDSGJYJFMMZ-UHFFFAOYSA-N 0 0 395.419 3.132 20 5 GGBDRN O=C(CCc1cnn(-c2ccccc2)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188452728 1431884998 /nfs/dbraw/zinc/88/49/98/1431884998.db2.gz ACVZIHFOEIWQNR-UHFFFAOYSA-N 0 0 392.415 3.003 20 5 GGBDRN Cc1cc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c2c(n1)onc2C(C)C ZINC000188459285 1431885677 /nfs/dbraw/zinc/88/56/77/1431885677.db2.gz PNPFANZNEGHPGK-UHFFFAOYSA-N 0 0 396.403 3.466 20 5 GGBDRN Cc1oc(-c2ccccc2)nc1CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188483181 1431888092 /nfs/dbraw/zinc/88/80/92/1431888092.db2.gz KNAIVNDNRBVWLH-UHFFFAOYSA-N 0 0 393.399 3.391 20 5 GGBDRN O=C(CCc1nc2ccccc2s1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188497111 1431889167 /nfs/dbraw/zinc/88/91/67/1431889167.db2.gz OUOIMVIICKYMLE-UHFFFAOYSA-N 0 0 383.429 3.427 20 5 GGBDRN Cc1oc(-c2ccsc2)nc1CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188498485 1431889523 /nfs/dbraw/zinc/88/95/23/1431889523.db2.gz IAPAYPQHIRIGGG-UHFFFAOYSA-N 0 0 399.428 3.452 20 5 GGBDRN CC(=O)Nc1ccc(C)c(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000188524156 1431891824 /nfs/dbraw/zinc/89/18/24/1431891824.db2.gz ZUBMHCDIDWSPHX-UHFFFAOYSA-N 0 0 379.376 3.300 20 5 GGBDRN Cn1ccc2ccc(NC(=O)C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)cc21 ZINC000188544412 1431893765 /nfs/dbraw/zinc/89/37/65/1431893765.db2.gz SWEOMLJFIUHUIX-UHFFFAOYSA-N 0 0 392.415 3.216 20 5 GGBDRN O=C(Cc1coc(-c2cccs2)n1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188569446 1431896228 /nfs/dbraw/zinc/89/62/28/1431896228.db2.gz JZLSVCOPYSHOCR-UHFFFAOYSA-N 0 0 385.401 3.144 20 5 GGBDRN O=C(NCc1ccc(Cl)cc1F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000188578480 1431896728 /nfs/dbraw/zinc/89/67/28/1431896728.db2.gz VURCJKIWOZMIAG-UHFFFAOYSA-N 0 0 375.743 3.159 20 5 GGBDRN Cc1cc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c2cnn(C(C)C)c2n1 ZINC000188577452 1431896852 /nfs/dbraw/zinc/89/68/52/1431896852.db2.gz GCNBYWADSIWHKA-UHFFFAOYSA-N 0 0 395.419 3.132 20 5 GGBDRN CCOc1cc(OCC(=O)Nc2cc(C)nn2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000188583082 1431897296 /nfs/dbraw/zinc/89/72/96/1431897296.db2.gz PTKKDGFATRSTKS-UHFFFAOYSA-N 0 0 376.413 3.271 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000188608042 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NAGPRCXGEPWPNS-UHFFFAOYSA-N 0 0 391.391 3.199 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)O[C@H]2CCc3cccnc32)ccc1[N+](=O)[O-] ZINC000189268265 1432075420 /nfs/dbraw/zinc/07/54/20/1432075420.db2.gz ZIQTUTNMPMXAEW-MSOLQXFVSA-N 0 0 395.415 3.134 20 5 GGBDRN Cc1csc([C@@H]2COCCN2CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1 ZINC000189281441 1432077676 /nfs/dbraw/zinc/07/76/76/1432077676.db2.gz OPSXDADUHCSRJJ-AWEZNQCLSA-N 0 0 396.856 3.025 20 5 GGBDRN CC[C@@]1(CO)CCCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000189282672 1432078062 /nfs/dbraw/zinc/07/80/62/1432078062.db2.gz WGRSWCMQNBHTGO-INIZCTEOSA-N 0 0 389.374 3.179 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCC2CCN(CC(F)(F)F)CC2)c1 ZINC000189300592 1432081714 /nfs/dbraw/zinc/08/17/14/1432081714.db2.gz GNETYCQZVNUAEO-UHFFFAOYSA-N 0 0 391.415 3.321 20 5 GGBDRN Cc1csc([C@H]2COCCN2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000189305849 1432082520 /nfs/dbraw/zinc/08/25/20/1432082520.db2.gz KXNLENPMMSBLIV-MRXNPFEDSA-N 0 0 390.465 3.070 20 5 GGBDRN 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1432120619 /nfs/dbraw/zinc/12/06/19/1432120619.db2.gz RHQGRGKVBUTIPK-CYBMUJFWSA-N 0 0 394.815 3.031 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000189496095 1432135554 /nfs/dbraw/zinc/13/55/54/1432135554.db2.gz FPWBKQVXAOINDZ-IBGZPJMESA-N 0 0 394.431 3.110 20 5 GGBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189502158 1432137595 /nfs/dbraw/zinc/13/75/95/1432137595.db2.gz SJWCPUOLOANIHV-KPZWWZAWSA-N 0 0 389.839 3.309 20 5 GGBDRN CC(=O)N1CCN(Cc2cccc(NC/C=C/c3ccccc3[N+](=O)[O-])c2)CC1 ZINC000189510320 1432141810 /nfs/dbraw/zinc/14/18/10/1432141810.db2.gz DXBCTNWVQOSNMX-VMPITWQZSA-N 0 0 394.475 3.384 20 5 GGBDRN COCCc1ccccc1NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000189581987 1432166626 /nfs/dbraw/zinc/16/66/26/1432166626.db2.gz XSHLOJYMKVMSGG-UHFFFAOYSA-N 0 0 384.436 3.138 20 5 GGBDRN COc1cc(C(=O)NC(C)(C)C(=O)NCC2CCCCC2)cc([N+](=O)[O-])c1C ZINC000189585512 1432167282 /nfs/dbraw/zinc/16/72/82/1432167282.db2.gz CTCUZHDCGHWAON-UHFFFAOYSA-N 0 0 391.468 3.117 20 5 GGBDRN O=C(CCN1CCSC[C@@H]1c1nccs1)Nc1cc([N+](=O)[O-])ccc1F ZINC000189588667 1432168716 /nfs/dbraw/zinc/16/87/16/1432168716.db2.gz DUJZRCRQJUCBTH-CQSZACIVSA-N 0 0 396.469 3.309 20 5 GGBDRN CCOC(=O)[C@@](C)(CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000189595015 1432170814 /nfs/dbraw/zinc/17/08/14/1432170814.db2.gz GLTATDCPFZJYKF-VFNWGFHPSA-N 0 0 399.447 3.476 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189599475 1432171536 /nfs/dbraw/zinc/17/15/36/1432171536.db2.gz HKUGTCISCFOQME-OAHLLOKOSA-N 0 0 375.469 3.487 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000189601940 1432172465 /nfs/dbraw/zinc/17/24/65/1432172465.db2.gz OFQNDBOSAOWQJK-HZPDHXFCSA-N 0 0 395.415 3.030 20 5 GGBDRN Cc1nn(C)cc1[C@@H](C)Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000189601364 1432172548 /nfs/dbraw/zinc/17/25/48/1432172548.db2.gz LWWNFJGUPBSERI-SNVBAGLBSA-N 0 0 388.815 3.009 20 5 GGBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000189608606 1432174786 /nfs/dbraw/zinc/17/47/86/1432174786.db2.gz AQOAPFQXSYOKEZ-KRWDZBQOSA-N 0 0 382.351 3.173 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCCCOc1ccc(F)cc1 ZINC000189612870 1432177116 /nfs/dbraw/zinc/17/71/16/1432177116.db2.gz PMCWWANWIMQHOU-UHFFFAOYSA-N 0 0 382.413 3.409 20 5 GGBDRN C[C@@H](O)[C@](C)(CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000189647419 1432189824 /nfs/dbraw/zinc/18/98/24/1432189824.db2.gz HMKRWJKWCIJWIE-PXAZEXFGSA-N 0 0 398.506 3.102 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NC(C)(C)c1ccc(OC(F)(F)F)cc1 ZINC000189653482 1432192305 /nfs/dbraw/zinc/19/23/05/1432192305.db2.gz IPDTXGATRUKPEM-UHFFFAOYSA-N 0 0 386.330 3.050 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCCOCCc1ccccc1 ZINC000189710474 1432210570 /nfs/dbraw/zinc/21/05/70/1432210570.db2.gz NDRVSTGARIMJLS-UHFFFAOYSA-N 0 0 378.450 3.060 20 5 GGBDRN O=C([C@H](O)Cc1cccc(C(F)(F)F)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000189718213 1432213508 /nfs/dbraw/zinc/21/35/08/1432213508.db2.gz REAREXLCIHLANR-MRXNPFEDSA-N 0 0 380.322 3.106 20 5 GGBDRN C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)COCc1ccccc1 ZINC000189723891 1432215298 /nfs/dbraw/zinc/21/52/98/1432215298.db2.gz YJAAOGSSQGGPEQ-CQSZACIVSA-N 0 0 378.450 3.263 20 5 GGBDRN CCCCOc1ncccc1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000189734575 1432219111 /nfs/dbraw/zinc/21/91/11/1432219111.db2.gz MKWKWIRHLQJJJQ-UHFFFAOYSA-N 0 0 379.438 3.184 20 5 GGBDRN COc1ccc(CC[C@@H](C)Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000189750095 1432223110 /nfs/dbraw/zinc/22/31/10/1432223110.db2.gz RCSLTRUMAHITBG-CYBMUJFWSA-N 0 0 378.450 3.440 20 5 GGBDRN Cc1csc([C@H](NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C2CC2)n1 ZINC000189776892 1432232588 /nfs/dbraw/zinc/23/25/88/1432232588.db2.gz IYAJPEKXDZSSIJ-MRXNPFEDSA-N 0 0 388.449 3.284 20 5 GGBDRN CCN(C[C@H](O)C(F)(F)F)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000189783394 1432234407 /nfs/dbraw/zinc/23/44/07/1432234407.db2.gz KBJSWERCFFTTPT-LBPRGKRZSA-N 0 0 389.355 3.104 20 5 GGBDRN CCN(C[C@@H](O)C(F)(F)F)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000189783410 1432234579 /nfs/dbraw/zinc/23/45/79/1432234579.db2.gz KBJSWERCFFTTPT-GFCCVEGCSA-N 0 0 389.355 3.104 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCCc2nnc3n2CCCCC3)cc1[N+](=O)[O-] ZINC000189798296 1432238348 /nfs/dbraw/zinc/23/83/48/1432238348.db2.gz MPARREFIFWGKCU-UHFFFAOYSA-N 0 0 385.468 3.399 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1cccc(OCC(F)F)c1 ZINC000189798370 1432238514 /nfs/dbraw/zinc/23/85/14/1432238514.db2.gz UDVSNICHUUWFOX-UHFFFAOYSA-N 0 0 386.376 3.254 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(CC(F)(F)C(F)F)CC2)cc1[N+](=O)[O-] ZINC000189807874 1432240662 /nfs/dbraw/zinc/24/06/62/1432240662.db2.gz LSBXDZQEVAOBTJ-UHFFFAOYSA-N 0 0 391.365 3.376 20 5 GGBDRN Cc1nn(C)c(C)c1CN1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000189815550 1432243203 /nfs/dbraw/zinc/24/32/03/1432243203.db2.gz OXTHWUQKZKNWAK-UHFFFAOYSA-N 0 0 399.495 3.027 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000189818344 1432244184 /nfs/dbraw/zinc/24/41/84/1432244184.db2.gz VYPZPKBLSUEZIU-CQSZACIVSA-N 0 0 375.429 3.441 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000189818325 1432244295 /nfs/dbraw/zinc/24/42/95/1432244295.db2.gz VYPZPKBLSUEZIU-AWEZNQCLSA-N 0 0 375.429 3.441 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)cc([N+](=O)[O-])c1C ZINC000189855800 1432254887 /nfs/dbraw/zinc/25/48/87/1432254887.db2.gz AIRCBUXSOTURIS-UHFFFAOYSA-N 0 0 399.447 3.039 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC(OCCC(C)C)CC2)c1[N+](=O)[O-] ZINC000189861427 1432255925 /nfs/dbraw/zinc/25/59/25/1432255925.db2.gz WSIKSBUJKKFPEV-UHFFFAOYSA-N 0 0 384.498 3.427 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H](Cc1ccccc1)C(C)C ZINC000189862779 1432256369 /nfs/dbraw/zinc/25/63/69/1432256369.db2.gz YZBHANOWCYFAIN-QGZVFWFLSA-N 0 0 383.448 3.473 20 5 GGBDRN COC(=O)[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H]1C ZINC000189867445 1432257563 /nfs/dbraw/zinc/25/75/63/1432257563.db2.gz AZUWCTTUXWJINB-ONGXEEELSA-N 0 0 389.330 3.277 20 5 GGBDRN COC(=O)[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H]1C ZINC000189867479 1432257908 /nfs/dbraw/zinc/25/79/08/1432257908.db2.gz AZUWCTTUXWJINB-GXSJLCMTSA-N 0 0 389.330 3.277 20 5 GGBDRN CCN(C[C@H](O)C(F)(F)F)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000189874679 1432259627 /nfs/dbraw/zinc/25/96/27/1432259627.db2.gz VMUHSDFFTYVVIY-LBPRGKRZSA-N 0 0 389.355 3.104 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(Cc2ccco2)C[C@@H]2CCCO2)c1[N+](=O)[O-] ZINC000189883294 1432262395 /nfs/dbraw/zinc/26/23/95/1432262395.db2.gz YCTHICNSLYLDDR-INIZCTEOSA-N 0 0 394.449 3.175 20 5 GGBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000189894152 1432265624 /nfs/dbraw/zinc/26/56/24/1432265624.db2.gz QXLALKOSZQVYLY-GYSYKLTISA-N 0 0 397.378 3.314 20 5 GGBDRN CS(=O)(=O)c1cc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000189904255 1432268422 /nfs/dbraw/zinc/26/84/22/1432268422.db2.gz OJWCXWDXGGQHTB-UHFFFAOYSA-N 0 0 397.840 3.016 20 5 GGBDRN CC[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Oc1ccccc1F ZINC000189907532 1432269588 /nfs/dbraw/zinc/26/95/88/1432269588.db2.gz WDWHJVBOYHLOKO-CYBMUJFWSA-N 0 0 382.413 3.407 20 5 GGBDRN CC[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Oc1cccc(F)c1 ZINC000189920089 1432274110 /nfs/dbraw/zinc/27/41/10/1432274110.db2.gz DXZRWMQBJHYQIS-AWEZNQCLSA-N 0 0 382.413 3.407 20 5 GGBDRN CCN(c1ccccc1)S(=O)(=O)c1ccc(NC[C@@H](C)OC)c([N+](=O)[O-])c1 ZINC000189927421 1432277014 /nfs/dbraw/zinc/27/70/14/1432277014.db2.gz SBFIGNVPMUVANT-CQSZACIVSA-N 0 0 393.465 3.257 20 5 GGBDRN CC(C)c1cccc2c1CCN(C(=O)c1ccc(-n3cncn3)c([N+](=O)[O-])c1)C2 ZINC000189980828 1432297207 /nfs/dbraw/zinc/29/72/07/1432297207.db2.gz GXLBDNJSEHDSPH-UHFFFAOYSA-N 0 0 391.431 3.497 20 5 GGBDRN COC[C@@H](NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000189982477 1432298148 /nfs/dbraw/zinc/29/81/48/1432298148.db2.gz KJZIOYDIUGCEDD-OAHLLOKOSA-N 0 0 380.347 3.308 20 5 GGBDRN COc1ccc(C[C@@H](C)CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000189992761 1432301351 /nfs/dbraw/zinc/30/13/51/1432301351.db2.gz INJAUZFPIKJXNZ-CYBMUJFWSA-N 0 0 378.450 3.298 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H](CCCO)c2ccccc2)c1[N+](=O)[O-] ZINC000190003924 1432302827 /nfs/dbraw/zinc/30/28/27/1432302827.db2.gz QKTWKHFMWXFSFN-INIZCTEOSA-N 0 0 378.450 3.004 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)c3cc(OC)c(C)c([N+](=O)[O-])c3)n2)cc1 ZINC000190010638 1432304482 /nfs/dbraw/zinc/30/44/82/1432304482.db2.gz XBOJNHMMWNXNKQ-UHFFFAOYSA-N 0 0 396.403 3.036 20 5 GGBDRN COc1cc(OCC(=O)N(Cc2c(F)cccc2F)C2CC2)ccc1[N+](=O)[O-] ZINC000190014085 1432304990 /nfs/dbraw/zinc/30/49/90/1432304990.db2.gz CNOQJKKCTASFEO-UHFFFAOYSA-N 0 0 392.358 3.452 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000190029752 1432308032 /nfs/dbraw/zinc/30/80/32/1432308032.db2.gz GWXHWEUUBWANHM-BONVTDFDSA-N 0 0 391.346 3.209 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)c1c[nH]nc1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000190034299 1432308654 /nfs/dbraw/zinc/30/86/54/1432308654.db2.gz GDXKEKGRXUPKBY-HNNXBMFYSA-N 0 0 386.408 3.008 20 5 GGBDRN CC[C@H](C)Oc1cc(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)ccn1 ZINC000190046738 1432310139 /nfs/dbraw/zinc/31/01/39/1432310139.db2.gz OYHPBCOZPGVMJX-LBPRGKRZSA-N 0 0 379.438 3.183 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(Cc2nnc3n2CCC3)cc1 ZINC000190060380 1432312535 /nfs/dbraw/zinc/31/25/35/1432312535.db2.gz MLDVQTADYCYITA-UHFFFAOYSA-N 0 0 391.431 3.295 20 5 GGBDRN COc1cc(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cc([N+](=O)[O-])c1C ZINC000190061421 1432312612 /nfs/dbraw/zinc/31/26/12/1432312612.db2.gz ZGLKBIXPPGJMCJ-KRWDZBQOSA-N 0 0 397.431 3.005 20 5 GGBDRN Cn1ccc2cccc(NC(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)c21 ZINC000190061580 1432313013 /nfs/dbraw/zinc/31/30/13/1432313013.db2.gz VFGOWUFGUSGKTO-UHFFFAOYSA-N 0 0 379.420 3.441 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)c1[N+](=O)[O-] ZINC000190072593 1432314738 /nfs/dbraw/zinc/31/47/38/1432314738.db2.gz GFNBYGJWISJAGU-WBVHZDCISA-N 0 0 392.477 3.045 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])n1 ZINC000190078034 1432315404 /nfs/dbraw/zinc/31/54/04/1432315404.db2.gz PJGGLYFNXLXORL-MRXNPFEDSA-N 0 0 375.450 3.441 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(C)Cc2cccc(N(C)C)c2)c1[N+](=O)[O-] ZINC000190080213 1432315910 /nfs/dbraw/zinc/31/59/10/1432315910.db2.gz UXLXXGRJNWAJSW-UHFFFAOYSA-N 0 0 377.466 3.098 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000190080598 1432316104 /nfs/dbraw/zinc/31/61/04/1432316104.db2.gz VMOCMZJJYXQSLI-IUODEOHRSA-N 0 0 376.438 3.204 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000190080713 1432316381 /nfs/dbraw/zinc/31/63/81/1432316381.db2.gz ATLBCFHNHFHDNQ-QGZVFWFLSA-N 0 0 392.477 3.173 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c1 ZINC000190082406 1432316543 /nfs/dbraw/zinc/31/65/43/1432316543.db2.gz WYIFOPFVQJPEPI-UHFFFAOYSA-N 0 0 377.404 3.284 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000190086608 1432317468 /nfs/dbraw/zinc/31/74/68/1432317468.db2.gz FTWGSKVNPWACKF-KXBFYZLASA-N 0 0 385.420 3.180 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H](C)[C@@H]2COc3ccccc32)c1[N+](=O)[O-] ZINC000190087325 1432317527 /nfs/dbraw/zinc/31/75/27/1432317527.db2.gz NUNVLFDBKRSZIW-ZFWWWQNUSA-N 0 0 376.434 3.055 20 5 GGBDRN C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000190087016 1432317600 /nfs/dbraw/zinc/31/76/00/1432317600.db2.gz HIKVZXFEWOXVSK-GTNSWQLSSA-N 0 0 375.812 3.433 20 5 GGBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000190087030 1432317623 /nfs/dbraw/zinc/31/76/23/1432317623.db2.gz HIKVZXFEWOXVSK-PIGZYNQJSA-N 0 0 375.812 3.433 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H](C)[C@@H]2COc3ccccc32)c1[N+](=O)[O-] ZINC000190087344 1432317633 /nfs/dbraw/zinc/31/76/33/1432317633.db2.gz NUNVLFDBKRSZIW-HIFRSBDPSA-N 0 0 376.434 3.055 20 5 GGBDRN CCc1ccc([C@H]2CN(C(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCO2)cc1 ZINC000190109592 1432321513 /nfs/dbraw/zinc/32/15/13/1432321513.db2.gz HDWMJCQFBXYZDO-LJQANCHMSA-N 0 0 397.431 3.004 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1OC(F)F ZINC000190112554 1432321727 /nfs/dbraw/zinc/32/17/27/1432321727.db2.gz HSPHCYUPBBJJBM-UHFFFAOYSA-N 0 0 379.319 3.390 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3O)CC2)cc1[N+](=O)[O-] ZINC000190113645 1432322093 /nfs/dbraw/zinc/32/20/93/1432322093.db2.gz HKYUKWBISPHUID-UHFFFAOYSA-N 0 0 397.431 3.022 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(OC(F)(F)F)cc1 ZINC000190126897 1432324352 /nfs/dbraw/zinc/32/43/52/1432324352.db2.gz KOKKLQZTGBCELE-INIZCTEOSA-N 0 0 395.337 3.167 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000190133381 1432325405 /nfs/dbraw/zinc/32/54/05/1432325405.db2.gz ZYKFGHOYJMLJTG-RDJZCZTQSA-N 0 0 392.843 3.044 20 5 GGBDRN CC(C)c1ccc(C(=O)NC[C@@H](O)COc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000190134496 1432325940 /nfs/dbraw/zinc/32/59/40/1432325940.db2.gz GCHNBQNTIMZIJS-CYBMUJFWSA-N 0 0 394.374 3.166 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000190155411 1432329497 /nfs/dbraw/zinc/32/94/97/1432329497.db2.gz TYDZSISBNQDQTM-SJORKVTESA-N 0 0 390.461 3.410 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])o1 ZINC000190159899 1432330608 /nfs/dbraw/zinc/33/06/08/1432330608.db2.gz YZIKPHAMKGCDCC-HNNXBMFYSA-N 0 0 394.449 3.477 20 5 GGBDRN COc1cc(C(=O)NCc2cn(C)nc2-c2ccccc2)cc([N+](=O)[O-])c1C ZINC000190164409 1432331548 /nfs/dbraw/zinc/33/15/48/1432331548.db2.gz YLVCZXFHYADTOP-UHFFFAOYSA-N 0 0 380.404 3.242 20 5 GGBDRN COC(=O)c1ccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c(N(C)C)c1 ZINC000190182502 1432335235 /nfs/dbraw/zinc/33/52/35/1432335235.db2.gz DMFIUSIJAPCYBS-LLVKDONJSA-N 0 0 389.383 3.329 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000190187271 1432336748 /nfs/dbraw/zinc/33/67/48/1432336748.db2.gz JUMUNQNUUNAWDD-KRWDZBQOSA-N 0 0 392.477 3.090 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1nncn1C ZINC000190190561 1432337444 /nfs/dbraw/zinc/33/74/44/1432337444.db2.gz VWEHRQSGOQBTBL-CYBMUJFWSA-N 0 0 380.408 3.000 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)n1 ZINC000190201911 1432340077 /nfs/dbraw/zinc/34/00/77/1432340077.db2.gz RDMZLJQKLHOVPJ-HNNXBMFYSA-N 0 0 389.433 3.134 20 5 GGBDRN O=C(N[C@H]1CCCc2c(O)cccc21)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000190229893 1432345361 /nfs/dbraw/zinc/34/53/61/1432345361.db2.gz HFFMMDGIISFNAA-HNNXBMFYSA-N 0 0 378.388 3.294 20 5 GGBDRN O=C(N[C@H]1CCCc2c(O)cccc21)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000190239165 1432346735 /nfs/dbraw/zinc/34/67/35/1432346735.db2.gz IUKIXXFAYPJJBT-KRWDZBQOSA-N 0 0 378.388 3.294 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000190238259 1432346784 /nfs/dbraw/zinc/34/67/84/1432346784.db2.gz BJIWPMKTIRGYPI-CQSZACIVSA-N 0 0 393.396 3.344 20 5 GGBDRN O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000190237924 1432346860 /nfs/dbraw/zinc/34/68/60/1432346860.db2.gz UTMROKRSOXHALS-JXFKEZNVSA-N 0 0 397.431 3.288 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000190257217 1432349641 /nfs/dbraw/zinc/34/96/41/1432349641.db2.gz HNQYAOYJBSBESN-SFHVURJKSA-N 0 0 387.436 3.003 20 5 GGBDRN COc1ccc(S(=O)(=O)N(Cc2c(F)cccc2F)C2CC2)c([N+](=O)[O-])c1 ZINC000190284600 1432353159 /nfs/dbraw/zinc/35/31/59/1432353159.db2.gz WQRGNBMHRBFSJF-UHFFFAOYSA-N 0 0 398.387 3.235 20 5 GGBDRN COc1cc(OC)cc([C@H](Nc2ncc([N+](=O)[O-])s2)c2nccn2C)c1 ZINC000190309479 1432357593 /nfs/dbraw/zinc/35/75/93/1432357593.db2.gz IWWJOMFLRBTRTA-AWEZNQCLSA-N 0 0 375.410 3.004 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NCCc2ccc(F)c(F)c2)cc([N+](=O)[O-])c1 ZINC000190313543 1432358604 /nfs/dbraw/zinc/35/86/04/1432358604.db2.gz NKVXLOKFFMRWBH-UHFFFAOYSA-N 0 0 378.331 3.022 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000190326497 1432361979 /nfs/dbraw/zinc/36/19/79/1432361979.db2.gz WHYDJCWIQJTTIR-ZDUSSCGKSA-N 0 0 381.396 3.070 20 5 GGBDRN Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(-n2cc(Cl)cn2)n1 ZINC000190333146 1432363198 /nfs/dbraw/zinc/36/31/98/1432363198.db2.gz CWIPGMIPTAMUGM-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)C2=O)cc1 ZINC000190344454 1432365163 /nfs/dbraw/zinc/36/51/63/1432365163.db2.gz RYJCPUAMRNKNOR-KRWDZBQOSA-N 0 0 396.447 3.443 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)C2=O)cc1 ZINC000190344470 1432365189 /nfs/dbraw/zinc/36/51/89/1432365189.db2.gz RYJCPUAMRNKNOR-QGZVFWFLSA-N 0 0 396.447 3.443 20 5 GGBDRN COC(=O)[C@H](C)N(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCC1 ZINC000190354631 1432366634 /nfs/dbraw/zinc/36/66/34/1432366634.db2.gz MTNVYPNSQOPRLL-NSHDSACASA-N 0 0 389.433 3.275 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2=O)cc1 ZINC000190358062 1432366847 /nfs/dbraw/zinc/36/68/47/1432366847.db2.gz BRVFTTTULYWYJV-SFHVURJKSA-N 0 0 382.420 3.134 20 5 GGBDRN COC(=O)[C@H](C)N(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CCC1 ZINC000190361146 1432367246 /nfs/dbraw/zinc/36/72/46/1432367246.db2.gz YYVXIUDOMIPBJR-HNNXBMFYSA-N 0 0 392.455 3.097 20 5 GGBDRN Cc1cc(-n2cccn2)ccc1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000190373854 1432369209 /nfs/dbraw/zinc/36/92/09/1432369209.db2.gz CPNAOXFXWOCCIK-UHFFFAOYSA-N 0 0 386.433 3.073 20 5 GGBDRN CCOC(=O)[C@](C)(CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccccc1 ZINC000190376895 1432369656 /nfs/dbraw/zinc/36/96/56/1432369656.db2.gz JFAPELXISOQEEV-OAQYLSRUSA-N 0 0 397.431 3.412 20 5 GGBDRN COc1cc(C(=O)N[C@H](c2cnn(C)c2)c2ccc(F)cc2)cc([N+](=O)[O-])c1C ZINC000190379296 1432370124 /nfs/dbraw/zinc/37/01/24/1432370124.db2.gz HFUXQLGSXSETQS-IBGZPJMESA-N 0 0 398.394 3.304 20 5 GGBDRN Cc1c(C(=O)N2CCN(c3cncc4ccccc43)CC2)cccc1[N+](=O)[O-] ZINC000190390047 1432372071 /nfs/dbraw/zinc/37/20/71/1432372071.db2.gz AFUWWKJUMKNPAK-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCN(c2cncc3ccccc32)CC1 ZINC000190388982 1432372254 /nfs/dbraw/zinc/37/22/54/1432372254.db2.gz YWPCFWPSSSWTNX-UHFFFAOYSA-N 0 0 380.379 3.245 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000190396636 1432373131 /nfs/dbraw/zinc/37/31/31/1432373131.db2.gz JRXOCGKRKWFJEB-QGZVFWFLSA-N 0 0 398.506 3.227 20 5 GGBDRN CCc1ccc([C@@H]2CN(S(=O)(=O)c3c(C)cccc3[N+](=O)[O-])CCO2)cc1 ZINC000190405094 1432375006 /nfs/dbraw/zinc/37/50/06/1432375006.db2.gz DIMKXXHOJPFWJE-SFHVURJKSA-N 0 0 390.461 3.228 20 5 GGBDRN CCc1ccc([C@@H]2CN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])CCO2)cc1 ZINC000190408744 1432375480 /nfs/dbraw/zinc/37/54/80/1432375480.db2.gz VVGZENMAAQLESG-IBGZPJMESA-N 0 0 390.461 3.061 20 5 GGBDRN CCC1(CC)CCCN(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000190412300 1432376929 /nfs/dbraw/zinc/37/69/29/1432376929.db2.gz CBNDHRCFUGYYEX-UHFFFAOYSA-N 0 0 382.482 3.431 20 5 GGBDRN Cc1c(C(=O)Nc2cccc([N+](=O)[O-])c2C)nnn1Cc1ccc(F)cc1F ZINC000190427317 1432380021 /nfs/dbraw/zinc/38/00/21/1432380021.db2.gz OAMLJJPTHZPVDM-UHFFFAOYSA-N 0 0 387.346 3.382 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1[N+](=O)[O-] ZINC000190524404 1432397575 /nfs/dbraw/zinc/39/75/75/1432397575.db2.gz MCBLHEMTUUHBLY-UHFFFAOYSA-N 0 0 386.433 3.288 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000190539659 1432401087 /nfs/dbraw/zinc/40/10/87/1432401087.db2.gz RSQTVHLEKRCXPB-UHFFFAOYSA-N 0 0 382.420 3.365 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCC(Oc4ccc(F)nc4)CC3)n2)cc1 ZINC000190551504 1432404921 /nfs/dbraw/zinc/40/49/21/1432404921.db2.gz ZVHLNJMTXCCQHJ-UHFFFAOYSA-N 0 0 399.382 3.222 20 5 GGBDRN Cn1ccc2cccc(NC(=O)C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)c21 ZINC000190605147 1432417847 /nfs/dbraw/zinc/41/78/47/1432417847.db2.gz XBNNXMXBLMYZDU-UHFFFAOYSA-N 0 0 392.415 3.216 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000190659964 1432434167 /nfs/dbraw/zinc/43/41/67/1432434167.db2.gz CGROHBWCXKBMLH-IBGZPJMESA-N 0 0 392.477 3.088 20 5 GGBDRN COCCOc1ccc(CC(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cc1 ZINC000190674019 1432439357 /nfs/dbraw/zinc/43/93/57/1432439357.db2.gz BOTKOORFKCTTDV-UHFFFAOYSA-N 0 0 381.388 3.349 20 5 GGBDRN CC1(C)CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CC[C@@H]1C(F)(F)F ZINC000190717280 1432453601 /nfs/dbraw/zinc/45/36/01/1432453601.db2.gz IVYUVBBOSRMBLY-AWEZNQCLSA-N 0 0 397.353 3.487 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000190776239 1432475419 /nfs/dbraw/zinc/47/54/19/1432475419.db2.gz NJRRCCYZUJMZHW-HIFRSBDPSA-N 0 0 391.468 3.069 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(Cl)c(S(C)(=O)=O)c1 ZINC000190781820 1432477433 /nfs/dbraw/zinc/47/74/33/1432477433.db2.gz JLDDPZRNKGQJDB-UHFFFAOYSA-N 0 0 397.840 3.011 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2C[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1 ZINC000190850294 1432506883 /nfs/dbraw/zinc/50/68/83/1432506883.db2.gz NRQMOKRPTUKXOW-SYNHAJSKSA-N 0 0 383.448 3.143 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(-n2cccn2)cc1C ZINC000190854562 1432508738 /nfs/dbraw/zinc/50/87/38/1432508738.db2.gz RWWQVYHKGDARBV-UHFFFAOYSA-N 0 0 381.392 3.148 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccc(-n3cccn3)cc2C)c([N+](=O)[O-])c1 ZINC000190857414 1432510445 /nfs/dbraw/zinc/51/04/45/1432510445.db2.gz UWBUHVNENSOKSM-UHFFFAOYSA-N 0 0 381.392 3.148 20 5 GGBDRN C[C@H]1CCC[C@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000190960979 1432538462 /nfs/dbraw/zinc/53/84/62/1432538462.db2.gz ZODJHYOFSISSQH-RDJZCZTQSA-N 0 0 388.468 3.031 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC2(CCCC2)OC(C)(C)C1 ZINC000190987168 1432544148 /nfs/dbraw/zinc/54/41/48/1432544148.db2.gz VPOMPWXKSDVDCB-CQSZACIVSA-N 0 0 391.468 3.354 20 5 GGBDRN CC(C)(C)Cc1cc(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n[nH]1 ZINC000191032442 1432553838 /nfs/dbraw/zinc/55/38/38/1432553838.db2.gz NVQNMUNATLVMDM-UHFFFAOYSA-N 0 0 379.804 3.137 20 5 GGBDRN CCCc1c(NC(=O)CCn2cc([N+](=O)[O-])cn2)cnn1-c1ccc(F)cc1 ZINC000191082453 1432563834 /nfs/dbraw/zinc/56/38/34/1432563834.db2.gz UIKSQTVZUGTOGX-UHFFFAOYSA-N 0 0 386.387 3.097 20 5 GGBDRN Cc1c(C(=O)N2CCC([C@@H]3CCCO3)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000191102295 1432568484 /nfs/dbraw/zinc/56/84/84/1432568484.db2.gz JJIVRDPNFCGTBG-INIZCTEOSA-N 0 0 377.397 3.151 20 5 GGBDRN CCCOc1ccc(CNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)c1 ZINC000191115821 1432570478 /nfs/dbraw/zinc/57/04/78/1432570478.db2.gz WGOGIBPKYHTIJX-UHFFFAOYSA-N 0 0 399.447 3.047 20 5 GGBDRN COc1cc(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)cc([N+](=O)[O-])c1C ZINC000191136173 1432574630 /nfs/dbraw/zinc/57/46/30/1432574630.db2.gz YSYJLZIGGLWBFE-CQSZACIVSA-N 0 0 395.419 3.326 20 5 GGBDRN 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ZINC000191263301 1432611846 /nfs/dbraw/zinc/61/18/46/1432611846.db2.gz NPJBXGDKZIDBNP-FMKPAKJESA-N 0 0 384.436 3.054 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NC[C@@H]2CC[C@H](O)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000191263286 1432611903 /nfs/dbraw/zinc/61/19/03/1432611903.db2.gz NPJBXGDKZIDBNP-LZWOXQAQSA-N 0 0 384.436 3.054 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000191289779 1432622285 /nfs/dbraw/zinc/62/22/85/1432622285.db2.gz YZKSRMFWIAMRRE-DNVCBOLYSA-N 0 0 396.447 3.065 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000191301782 1432625643 /nfs/dbraw/zinc/62/56/43/1432625643.db2.gz LVMKIVSSZLDMHL-UHFFFAOYSA-N 0 0 387.387 3.177 20 5 GGBDRN CC(C)(C)c1nnc(NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000191308681 1432628030 /nfs/dbraw/zinc/62/80/30/1432628030.db2.gz XDPFDFRFRFIHKZ-UHFFFAOYSA-N 0 0 377.426 3.039 20 5 GGBDRN O=C(N[C@H]1CCCc2c(O)cccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000191311812 1432628637 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Cc1cc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)ccc1C(=O)N(C)C ZINC000191797050 1432727403 /nfs/dbraw/zinc/72/74/03/1432727403.db2.gz TZARRRUDWMYRKZ-UHFFFAOYSA-N 0 0 391.449 3.023 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)CCC2=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000191802178 1432728629 /nfs/dbraw/zinc/72/86/29/1432728629.db2.gz JUXVOOLTVKGZBE-UHFFFAOYSA-N 0 0 397.778 3.210 20 5 GGBDRN Cc1ccc(C[NH+](C)C)cc1[N-]S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000191803418 1432728937 /nfs/dbraw/zinc/72/89/37/1432728937.db2.gz FAWQJRZLGKBVHX-UHFFFAOYSA-N 0 0 377.466 3.382 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(c2ccccc2)[C@H]2CCOC2)c1C ZINC000191831367 1432734750 /nfs/dbraw/zinc/73/47/50/1432734750.db2.gz WFUFNIZMKXDLHU-INIZCTEOSA-N 0 0 376.434 3.196 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)cc([N+](=O)[O-])c1C ZINC000191838099 1432736716 /nfs/dbraw/zinc/73/67/16/1432736716.db2.gz PVBFAUUKAHAOPF-INIZCTEOSA-N 0 0 393.390 3.223 20 5 GGBDRN COc1cc(C(=O)NC[C@H](c2c(F)cccc2F)N(C)C)cc([N+](=O)[O-])c1C ZINC000191838110 1432736790 /nfs/dbraw/zinc/73/67/90/1432736790.db2.gz PVBFAUUKAHAOPF-MRXNPFEDSA-N 0 0 393.390 3.223 20 5 GGBDRN CC(C)(C)n1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)nn1 ZINC000191858514 1432741244 /nfs/dbraw/zinc/74/12/44/1432741244.db2.gz CFOHJGIEGNOGEK-UHFFFAOYSA-N 0 0 393.403 3.425 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@](C)(Cc1ccccc1)[C@@H](C)O ZINC000191860466 1432741501 /nfs/dbraw/zinc/74/15/01/1432741501.db2.gz ADAAVYPXQUKBQP-JLTOFOAXSA-N 0 0 387.436 3.355 20 5 GGBDRN COCCN(Cc1ccccc1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000191862632 1432741856 /nfs/dbraw/zinc/74/18/56/1432741856.db2.gz BUFIYOQPIFYWJY-UHFFFAOYSA-N 0 0 378.450 3.049 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-] ZINC000191871103 1432744141 /nfs/dbraw/zinc/74/41/41/1432744141.db2.gz JPMRPCLEEOFDHP-UHFFFAOYSA-N 0 0 393.446 3.407 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000191873349 1432744458 /nfs/dbraw/zinc/74/44/58/1432744458.db2.gz WPDDTCYKFWPTJC-CYBMUJFWSA-N 0 0 391.449 3.210 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000191873339 1432744479 /nfs/dbraw/zinc/74/44/79/1432744479.db2.gz WPDDTCYKFWPTJC-ZDUSSCGKSA-N 0 0 391.449 3.210 20 5 GGBDRN Cc1cccc(C[C@@H](CO)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)c1 ZINC000191881503 1432745959 /nfs/dbraw/zinc/74/59/59/1432745959.db2.gz ANRYMAZFIXPSRO-SFHVURJKSA-N 0 0 383.448 3.155 20 5 GGBDRN Cc1ccccc1C[C@H](CO)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000191881489 1432745983 /nfs/dbraw/zinc/74/59/83/1432745983.db2.gz BILAZAARYNVULS-CYBMUJFWSA-N 0 0 395.362 3.230 20 5 GGBDRN Cc1ccc(C[C@@H](CO)NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000191881435 1432746008 /nfs/dbraw/zinc/74/60/08/1432746008.db2.gz RUYHJNUCDIBPJJ-ZDUSSCGKSA-N 0 0 395.362 3.230 20 5 GGBDRN Cc1cccc(C[C@H](CO)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)c1 ZINC000191881512 1432746188 /nfs/dbraw/zinc/74/61/88/1432746188.db2.gz ANRYMAZFIXPSRO-GOSISDBHSA-N 0 0 383.448 3.155 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCC(OCCC(C)C)CC2)cc1[N+](=O)[O-] ZINC000191884601 1432746868 /nfs/dbraw/zinc/74/68/68/1432746868.db2.gz ALESMMXODAQOQP-UHFFFAOYSA-N 0 0 384.498 3.427 20 5 GGBDRN O=C(CCOCC(F)(F)C(F)F)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000191896537 1432750228 /nfs/dbraw/zinc/75/02/28/1432750228.db2.gz JNNGOONMRZTEIK-UHFFFAOYSA-N 0 0 390.293 3.026 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc3c(c2)ncn3-c2ccccc2)c1[N+](=O)[O-] ZINC000191906687 1432752376 /nfs/dbraw/zinc/75/23/76/1432752376.db2.gz MMUIMBXGNSREQY-UHFFFAOYSA-N 0 0 376.376 3.472 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCC(OC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000191910016 1432753742 /nfs/dbraw/zinc/75/37/42/1432753742.db2.gz WQMFIIWVQWRMFD-UHFFFAOYSA-N 0 0 382.482 3.324 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)[N-]c2nccc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000191917587 1432755268 /nfs/dbraw/zinc/75/52/68/1432755268.db2.gz GUNZNQXXZPYCPO-UHFFFAOYSA-N 0 0 384.417 3.469 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@@H](c2nc(C3CC3)no2)C(C)C)cc1[N+](=O)[O-] ZINC000191921370 1432756359 /nfs/dbraw/zinc/75/63/59/1432756359.db2.gz BTMQAQVNYCLFEW-OAHLLOKOSA-N 0 0 394.453 3.148 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)o1 ZINC000191979247 1432773404 /nfs/dbraw/zinc/77/34/04/1432773404.db2.gz QNOPVHSBMOYMHW-INIZCTEOSA-N 0 0 394.449 3.129 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC[C@@H]1c1cnn(C)c1 ZINC000191997336 1432776583 /nfs/dbraw/zinc/77/65/83/1432776583.db2.gz BYKXTQUJFQZZDX-CRAIPNDOSA-N 0 0 388.493 3.214 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC[C@H]1c1cnn(C)c1 ZINC000191998094 1432777211 /nfs/dbraw/zinc/77/72/11/1432777211.db2.gz NUIFNAZWTRYREK-WBMJQRKESA-N 0 0 392.506 3.126 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000192039124 1432784139 /nfs/dbraw/zinc/78/41/39/1432784139.db2.gz VSZKRSBKFNJMTN-DOTOQJQBSA-N 0 0 392.477 3.045 20 5 GGBDRN COc1cc(C(=O)NC[C@@](C)(Cc2ccccc2)[C@H](C)O)cc([N+](=O)[O-])c1C ZINC000192039476 1432784208 /nfs/dbraw/zinc/78/42/08/1432784208.db2.gz GFWOXCRMEMZALP-YCRPNKLZSA-N 0 0 386.448 3.271 20 5 GGBDRN COc1cc(C(=O)NC[C@](C)(Cc2ccccc2)[C@H](C)O)cc([N+](=O)[O-])c1C ZINC000192039482 1432784319 /nfs/dbraw/zinc/78/43/19/1432784319.db2.gz GFWOXCRMEMZALP-BTYIYWSLSA-N 0 0 386.448 3.271 20 5 GGBDRN Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1C ZINC000192043856 1432785654 /nfs/dbraw/zinc/78/56/54/1432785654.db2.gz NRLIAKUKOSXJBN-UHFFFAOYSA-N 0 0 388.815 3.276 20 5 GGBDRN C[C@@H](O)[C@](C)(CNC(=O)CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000192052225 1432788103 /nfs/dbraw/zinc/78/81/03/1432788103.db2.gz SUESXWZORBLAID-IERDGZPVSA-N 0 0 386.448 3.110 20 5 GGBDRN C[C@H](O)[C@](C)(CNC(=O)CCNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000192056776 1432788925 /nfs/dbraw/zinc/78/89/25/1432788925.db2.gz XSHIWMGLDAGXCD-KKSFZXQISA-N 0 0 385.464 3.143 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N(c1ccccc1)[C@@H]1CCOC1 ZINC000192058135 1432789508 /nfs/dbraw/zinc/78/95/08/1432789508.db2.gz QBVLHKIVZVABDF-GOSISDBHSA-N 0 0 378.388 3.216 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N(c1ccccc1)[C@@H]1CCOC1 ZINC000192063424 1432790590 /nfs/dbraw/zinc/79/05/90/1432790590.db2.gz HMROJGZZDMIWID-LJQANCHMSA-N 0 0 378.388 3.216 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000192073343 1432793166 /nfs/dbraw/zinc/79/31/66/1432793166.db2.gz HHTRZPXJXHWZRJ-UHFFFAOYSA-N 0 0 388.733 3.420 20 5 GGBDRN CCc1c(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cnn1-c1ccccc1Cl ZINC000192121235 1432801454 /nfs/dbraw/zinc/80/14/54/1432801454.db2.gz JJORYPKIDAQUTD-UHFFFAOYSA-N 0 0 388.815 3.291 20 5 GGBDRN CCCn1ccnc1CCCN(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1CC ZINC000192243650 1432821761 /nfs/dbraw/zinc/82/17/61/1432821761.db2.gz QLOLOBYQQPUWAK-UHFFFAOYSA-N 0 0 394.497 3.017 20 5 GGBDRN CCCn1ccnc1CCCN(C)S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000192244039 1432821842 /nfs/dbraw/zinc/82/18/42/1432821842.db2.gz MLMJCRBGERDIKY-UHFFFAOYSA-N 0 0 394.497 3.071 20 5 GGBDRN CCCn1ccnc1CCCN(C)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000192244894 1432822031 /nfs/dbraw/zinc/82/20/31/1432822031.db2.gz DBGCNOSGHCHZOI-UHFFFAOYSA-N 0 0 394.497 3.071 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000192248669 1432822508 /nfs/dbraw/zinc/82/25/08/1432822508.db2.gz XSLIJYGUUONSML-UHFFFAOYSA-N 0 0 389.412 3.123 20 5 GGBDRN CC(C)Oc1ccc(N(C)S(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000192256118 1432823379 /nfs/dbraw/zinc/82/33/79/1432823379.db2.gz HKZGLGCVQOPYLO-UHFFFAOYSA-N 0 0 378.450 3.391 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC(c2ccncc2)CC1 ZINC000192269266 1432825344 /nfs/dbraw/zinc/82/53/44/1432825344.db2.gz LIELUEJPYWSCEZ-UHFFFAOYSA-N 0 0 377.404 3.195 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN(Cc1c(F)cccc1F)C1CC1 ZINC000192299837 1432829074 /nfs/dbraw/zinc/82/90/74/1432829074.db2.gz NPNQIQJTJRFLAE-AWEZNQCLSA-N 0 0 378.375 3.277 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)C2=O)cc1 ZINC000192318574 1432831191 /nfs/dbraw/zinc/83/11/91/1432831191.db2.gz BDKYBLVYWXNMTH-QGZVFWFLSA-N 0 0 396.447 3.443 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H]1CCCc2c(O)cccc21 ZINC000192327299 1432832335 /nfs/dbraw/zinc/83/23/35/1432832335.db2.gz DNFAUTIWLWQNHB-AWEZNQCLSA-N 0 0 389.795 3.086 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000192346381 1432834794 /nfs/dbraw/zinc/83/47/94/1432834794.db2.gz AOEIDTQWDYCEEC-UHFFFAOYSA-N 0 0 376.434 3.445 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)c1oc2ccccc2c1C ZINC000192370078 1432838050 /nfs/dbraw/zinc/83/80/50/1432838050.db2.gz SKUITKAOTOPMMG-GFCCVEGCSA-N 0 0 397.387 3.474 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000192376438 1432838928 /nfs/dbraw/zinc/83/89/28/1432838928.db2.gz XGMVOUUWXANNMX-CYBMUJFWSA-N 0 0 387.358 3.279 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(O)(c2ccccc2Cl)CC1 ZINC000192402474 1432841085 /nfs/dbraw/zinc/84/10/85/1432841085.db2.gz JTMMXBOKUNTHPX-UHFFFAOYSA-N 0 0 390.823 3.381 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000192408445 1432841673 /nfs/dbraw/zinc/84/16/73/1432841673.db2.gz LTNITYUREGZJNQ-HNNXBMFYSA-N 0 0 375.356 3.121 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000192409316 1432841708 /nfs/dbraw/zinc/84/17/08/1432841708.db2.gz CAZZTCAQBLWFJJ-AWEZNQCLSA-N 0 0 375.356 3.121 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O ZINC000192455186 1432846712 /nfs/dbraw/zinc/84/67/12/1432846712.db2.gz JAZFHVZCFMQWKW-AWEZNQCLSA-N 0 0 391.786 3.231 20 5 GGBDRN O=C(NCCNC(=O)C1CC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000192454303 1432846763 /nfs/dbraw/zinc/84/67/63/1432846763.db2.gz VJGFACHKVIKGLU-UHFFFAOYSA-N 0 0 385.445 3.002 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000192456496 1432846976 /nfs/dbraw/zinc/84/69/76/1432846976.db2.gz ZLPWLYGTZMCACF-UHFFFAOYSA-N 0 0 396.852 3.314 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000192465623 1432848027 /nfs/dbraw/zinc/84/80/27/1432848027.db2.gz BVZWVQTYVLIRTR-LBPRGKRZSA-N 0 0 375.812 3.025 20 5 GGBDRN CCN(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccc(C)cc1C ZINC000192471289 1432848701 /nfs/dbraw/zinc/84/87/01/1432848701.db2.gz LFKMRKWRWBBRLI-UHFFFAOYSA-N 0 0 376.434 3.282 20 5 GGBDRN CSc1ccc(C(=O)NCc2cnn(Cc3ccccc3)c2)cc1[N+](=O)[O-] ZINC000192475170 1432849234 /nfs/dbraw/zinc/84/92/34/1432849234.db2.gz UCHPEOUKBDSPLH-UHFFFAOYSA-N 0 0 382.445 3.492 20 5 GGBDRN COCCN(C(=O)C[C@@H]1CCCO1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000192477488 1432849374 /nfs/dbraw/zinc/84/93/74/1432849374.db2.gz AVLFSYLJVCDLKE-HNNXBMFYSA-N 0 0 391.449 3.267 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(Sc3ncccn3)cc2C)c1[N+](=O)[O-] ZINC000192482414 1432849686 /nfs/dbraw/zinc/84/96/86/1432849686.db2.gz PANPWGUPORKGLJ-UHFFFAOYSA-N 0 0 384.421 3.382 20 5 GGBDRN COc1cccc(C(=O)NCCCc2nc(-c3ccncc3)cs2)c1[N+](=O)[O-] ZINC000192501471 1432851988 /nfs/dbraw/zinc/85/19/88/1432851988.db2.gz JTQNUOQQWPRDMA-UHFFFAOYSA-N 0 0 398.444 3.485 20 5 GGBDRN CCc1n[nH]c(C(=O)N(Cc2ccccn2)Cc2ccccc2C)c1[N+](=O)[O-] ZINC000192518117 1432853987 /nfs/dbraw/zinc/85/39/87/1432853987.db2.gz DKHVEOKTZUDLDD-UHFFFAOYSA-N 0 0 379.420 3.426 20 5 GGBDRN CCc1n[nH]c(C(=O)N(Cc2cccc(C)c2)Cc2ccccn2)c1[N+](=O)[O-] ZINC000192517908 1432854062 /nfs/dbraw/zinc/85/40/62/1432854062.db2.gz SOAKDTMXGJQUFD-UHFFFAOYSA-N 0 0 379.420 3.426 20 5 GGBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccccc1S(=O)(=O)C(F)(F)F ZINC000192523718 1432854694 /nfs/dbraw/zinc/85/46/94/1432854694.db2.gz HEMFDJRWPSHJRW-UHFFFAOYSA-N 0 0 392.286 3.280 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000192534345 1432856281 /nfs/dbraw/zinc/85/62/81/1432856281.db2.gz BBMIKSLSOYTKJI-CALCHBBNSA-N 0 0 397.475 3.476 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000192542723 1432857293 /nfs/dbraw/zinc/85/72/93/1432857293.db2.gz SLDQXTUKIFUPNV-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@H](c2nc(C(C)(C)C)cs2)C1 ZINC000192550833 1432858404 /nfs/dbraw/zinc/85/84/04/1432858404.db2.gz GEJWGGSDKDRUKT-LBPRGKRZSA-N 0 0 379.486 3.452 20 5 GGBDRN COc1ccc(-n2nnc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)c2C)cc1 ZINC000192550891 1432858433 /nfs/dbraw/zinc/85/84/33/1432858433.db2.gz HAKSFGLCQYVAIR-UHFFFAOYSA-N 0 0 389.318 3.023 20 5 GGBDRN CCc1n[nH]c(C(=O)N2C[C@@H](c3ccccc3Cl)OC[C@H]2C)c1[N+](=O)[O-] ZINC000192559458 1432859792 /nfs/dbraw/zinc/85/97/92/1432859792.db2.gz HMTCBHBGILMFJF-YGRLFVJLSA-N 0 0 378.816 3.136 20 5 GGBDRN C[C@@H]1C[C@@]2(CC(C)(C)C1)NC(=O)N(CN(C)Cc1ccccc1[N+](=O)[O-])C2=O ZINC000192560410 1432859936 /nfs/dbraw/zinc/85/99/36/1432859936.db2.gz KEFVNFDUPRLTTP-XOBRGWDASA-N 0 0 388.468 3.121 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC(O)(c2ccccc2Cl)CC1 ZINC000192567326 1432861280 /nfs/dbraw/zinc/86/12/80/1432861280.db2.gz IRKZHVRUZMJJLK-UHFFFAOYSA-N 0 0 389.839 3.170 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N(C)C[C@@H]2COc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000192575410 1432861922 /nfs/dbraw/zinc/86/19/22/1432861922.db2.gz ZRHOGNDBUZTCRF-LSDHHAIUSA-N 0 0 385.420 3.002 20 5 GGBDRN CC1CCC(NS(=O)(=O)c2ccc(NCCCCCO)c([N+](=O)[O-])c2)CC1 ZINC000192583403 1432863010 /nfs/dbraw/zinc/86/30/10/1432863010.db2.gz IIZPJENKAGSJCD-UHFFFAOYSA-N 0 0 399.513 3.026 20 5 GGBDRN COc1cccc(COC[C@H](O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000192586925 1432863244 /nfs/dbraw/zinc/86/32/44/1432863244.db2.gz GTUZJEQVMGBQIR-QGZVFWFLSA-N 0 0 394.855 3.266 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000192602791 1432864804 /nfs/dbraw/zinc/86/48/04/1432864804.db2.gz MMJDDJMTGIMLPB-GFCCVEGCSA-N 0 0 381.383 3.412 20 5 GGBDRN O=C(NC1CC1)c1ccc(N2CC=C(c3ccc(O)cc3)CC2)c([N+](=O)[O-])c1 ZINC000192604464 1432865201 /nfs/dbraw/zinc/86/52/01/1432865201.db2.gz YONPPONZEUWPMJ-UHFFFAOYSA-N 0 0 379.416 3.486 20 5 GGBDRN O=C(Nc1nc2c(s1)CCCC2)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000192605025 1432865258 /nfs/dbraw/zinc/86/52/58/1432865258.db2.gz LRTMVNGPWPDVJU-UHFFFAOYSA-N 0 0 387.465 3.284 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000192635199 1432869402 /nfs/dbraw/zinc/86/94/02/1432869402.db2.gz QWWACVSGSDUPGQ-UHFFFAOYSA-N 0 0 375.385 3.076 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1 ZINC000192639027 1432869983 /nfs/dbraw/zinc/86/99/83/1432869983.db2.gz FFMHXHZKXIQYQM-UHFFFAOYSA-N 0 0 383.404 3.157 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000192646046 1432870645 /nfs/dbraw/zinc/87/06/45/1432870645.db2.gz MWQDPTGZJQGISE-LJQANCHMSA-N 0 0 381.388 3.039 20 5 GGBDRN CCc1n[nH]c(C(=O)N(CCc2ccc(C)cc2)C[C@H]2CCCO2)c1[N+](=O)[O-] ZINC000192651173 1432871663 /nfs/dbraw/zinc/87/16/63/1432871663.db2.gz RSWOMKNPNQYZBK-MRXNPFEDSA-N 0 0 386.452 3.053 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000192671219 1432873746 /nfs/dbraw/zinc/87/37/46/1432873746.db2.gz JYBYUBXBRSSPRJ-UHFFFAOYSA-N 0 0 399.338 3.448 20 5 GGBDRN Cc1c(C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000192671005 1432873824 /nfs/dbraw/zinc/87/38/24/1432873824.db2.gz JQOJCINSGYZVFF-UHFFFAOYSA-N 0 0 399.338 3.448 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC[C@@H](Nc2cc(OC)cc(OC)c2)C1 ZINC000192687093 1432875426 /nfs/dbraw/zinc/87/54/26/1432875426.db2.gz QTBDLUHKTTUWHJ-CQSZACIVSA-N 0 0 389.456 3.218 20 5 GGBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CC[C@]2(CCOC2)C1 ZINC000192707048 1432877693 /nfs/dbraw/zinc/87/76/93/1432877693.db2.gz FUIKLMSULHRZTB-NRFANRHFSA-N 0 0 382.416 3.426 20 5 GGBDRN CC[C@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000192720945 1432879823 /nfs/dbraw/zinc/87/98/23/1432879823.db2.gz UKJUFLOWFIRHHF-ICSRJNTNSA-N 0 0 397.475 3.313 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1nc2c(s1)CCCCC2)c1cccc([N+](=O)[O-])c1 ZINC000192720996 1432879852 /nfs/dbraw/zinc/87/98/52/1432879852.db2.gz WQEDRHYXWAEKIZ-NSHDSACASA-N 0 0 388.449 3.136 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1 ZINC000192733578 1432881931 /nfs/dbraw/zinc/88/19/31/1432881931.db2.gz YAMVGIFDDAXBOC-HZPDHXFCSA-N 0 0 393.875 3.257 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCCCC[C@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000192742275 1432883301 /nfs/dbraw/zinc/88/33/01/1432883301.db2.gz KZARNKWRNQITNC-IBGZPJMESA-N 0 0 398.463 3.115 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)C1CCCCC1 ZINC000192755133 1432885151 /nfs/dbraw/zinc/88/51/51/1432885151.db2.gz JYKLFDRYELIWQD-KRWDZBQOSA-N 0 0 393.509 3.237 20 5 GGBDRN O=C1N[C@]2(CCCCc3ccccc32)C(=O)N1CCOc1cccc([N+](=O)[O-])c1 ZINC000192759474 1432885807 /nfs/dbraw/zinc/88/58/07/1432885807.db2.gz OOHXIMPIUZTZQU-NRFANRHFSA-N 0 0 395.415 3.147 20 5 GGBDRN COC(=O)[C@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000192771578 1432888240 /nfs/dbraw/zinc/88/82/40/1432888240.db2.gz PFBLNMWSZXGUEZ-GFCCVEGCSA-N 0 0 380.759 3.074 20 5 GGBDRN C[C@]1(c2ccc(F)cc2)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000192789851 1432891258 /nfs/dbraw/zinc/89/12/58/1432891258.db2.gz RDEZKBGAFUAFDI-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN CC[C@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000192795526 1432892003 /nfs/dbraw/zinc/89/20/03/1432892003.db2.gz QOHPQLFEROGSPB-LBPRGKRZSA-N 0 0 375.347 3.053 20 5 GGBDRN CC[C@@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000192795514 1432892012 /nfs/dbraw/zinc/89/20/12/1432892012.db2.gz QOHPQLFEROGSPB-GFCCVEGCSA-N 0 0 375.347 3.053 20 5 GGBDRN CCCN(C(=O)c1ccccc1NC(=O)c1n[nH]c(CC)c1[N+](=O)[O-])C(C)C ZINC000192799069 1432892522 /nfs/dbraw/zinc/89/25/22/1432892522.db2.gz OEWZLSGCBBIWAA-UHFFFAOYSA-N 0 0 387.440 3.393 20 5 GGBDRN C[C@]1(c2ccc(F)cc2F)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000192804903 1432893083 /nfs/dbraw/zinc/89/30/83/1432893083.db2.gz UDKNHCQRMDEXAG-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN NC(=O)c1ccc(CNc2cc(F)ccc2OCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000192806306 1432893359 /nfs/dbraw/zinc/89/33/59/1432893359.db2.gz JSWHSRIBWWWXRI-UHFFFAOYSA-N 0 0 387.289 3.386 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1 ZINC000192811481 1432893922 /nfs/dbraw/zinc/89/39/22/1432893922.db2.gz FJFSMJSANSWTMS-UHFFFAOYSA-N 0 0 382.351 3.149 20 5 GGBDRN COc1cc(Cn2cnc3ccc(C)cc3c2=O)c([N+](=O)[O-])cc1OC(F)F ZINC000192828195 1432896061 /nfs/dbraw/zinc/89/60/61/1432896061.db2.gz ILNVXZCFJXQIDC-UHFFFAOYSA-N 0 0 391.330 3.271 20 5 GGBDRN COc1cccc(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)c1[N+](=O)[O-] ZINC000192831255 1432896243 /nfs/dbraw/zinc/89/62/43/1432896243.db2.gz BARAOTAWJUKHBF-LBPRGKRZSA-N 0 0 382.376 3.187 20 5 GGBDRN CN(C(=O)CCn1c(=O)oc2cc(Cl)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000192835857 1432896705 /nfs/dbraw/zinc/89/67/05/1432896705.db2.gz OPMCOFDZZJSNLB-UHFFFAOYSA-N 0 0 375.768 3.209 20 5 GGBDRN CCCN(Cc1ccccc1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000192850500 1432898917 /nfs/dbraw/zinc/89/89/17/1432898917.db2.gz JVKLBGRGMBUDNX-UHFFFAOYSA-N 0 0 376.434 3.051 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CC=C(c3ccc(F)cc3)CC2)cc1 ZINC000192854826 1432899384 /nfs/dbraw/zinc/89/93/84/1432899384.db2.gz QHXKQUCLGAWTDB-UHFFFAOYSA-N 0 0 376.409 3.353 20 5 GGBDRN C[C@H]1CN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc21 ZINC000192858626 1432899852 /nfs/dbraw/zinc/89/98/52/1432899852.db2.gz NVAPFXARJNAOOM-JTQLQIEISA-N 0 0 391.330 3.285 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(CSc2nc[nH]n2)cc1 ZINC000192892848 1432903786 /nfs/dbraw/zinc/90/37/86/1432903786.db2.gz ZKTVZJRWWKSXCY-UHFFFAOYSA-N 0 0 383.433 3.277 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CNC(=O)Cc1cccc2ccccc21 ZINC000192892704 1432903856 /nfs/dbraw/zinc/90/38/56/1432903856.db2.gz YVRCYAMFZOGNHA-UHFFFAOYSA-N 0 0 391.427 3.065 20 5 GGBDRN O=C(c1cc(N2CC[C@@H](OCc3ccncc3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000192904150 1432905222 /nfs/dbraw/zinc/90/52/22/1432905222.db2.gz OZNKQFDCAUXQQP-GOSISDBHSA-N 0 0 396.447 3.021 20 5 GGBDRN O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000192906336 1432905422 /nfs/dbraw/zinc/90/54/22/1432905422.db2.gz NQTSNCDEQCVBBU-HNNXBMFYSA-N 0 0 399.428 3.324 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(OC(F)F)c3cccnc23)c1[N+](=O)[O-] ZINC000192906005 1432905620 /nfs/dbraw/zinc/90/56/20/1432905620.db2.gz IZDJLGNMLBRBAO-UHFFFAOYSA-N 0 0 377.307 3.282 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)c1[N+](=O)[O-] ZINC000192909630 1432905728 /nfs/dbraw/zinc/90/57/28/1432905728.db2.gz JHEYYANNOMBGGB-INIZCTEOSA-N 0 0 378.331 3.095 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1c(F)c(F)c(F)c(F)c1F ZINC000192908470 1432905869 /nfs/dbraw/zinc/90/58/69/1432905869.db2.gz PDEIYLYWNITFKG-UHFFFAOYSA-N 0 0 382.266 3.400 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)c1 ZINC000192909790 1432906159 /nfs/dbraw/zinc/90/61/59/1432906159.db2.gz DGKCUIBLUJWIDH-CYBMUJFWSA-N 0 0 387.417 3.304 20 5 GGBDRN COC[C@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000192925738 1432908643 /nfs/dbraw/zinc/90/86/43/1432908643.db2.gz FMDOSNONXJTILO-INIZCTEOSA-N 0 0 398.868 3.098 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CSc3n[nH]c(-c4ccccc4O)n3)n2)c1 ZINC000192954222 1432912483 /nfs/dbraw/zinc/91/24/83/1432912483.db2.gz DUSYHSDVOKXBJY-UHFFFAOYSA-N 0 0 396.388 3.428 20 5 GGBDRN Cc1c(NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cnn1C1CCCC1 ZINC000192980475 1432916166 /nfs/dbraw/zinc/91/61/66/1432916166.db2.gz KTDWLCZWJVPEKW-GOSISDBHSA-N 0 0 383.408 3.347 20 5 GGBDRN Cc1c(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cnn1C1CCCC1 ZINC000192980464 1432916364 /nfs/dbraw/zinc/91/63/64/1432916364.db2.gz KTDWLCZWJVPEKW-SFHVURJKSA-N 0 0 383.408 3.347 20 5 GGBDRN COc1ccc(NC(=O)CN2CC=C(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000192989326 1432918124 /nfs/dbraw/zinc/91/81/24/1432918124.db2.gz WWDXQPWFWVIFDQ-UHFFFAOYSA-N 0 0 385.395 3.470 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCC(OCc2ccccc2)CC1 ZINC000192992176 1432918272 /nfs/dbraw/zinc/91/82/72/1432918272.db2.gz BGLQASCVXKDOPX-UHFFFAOYSA-N 0 0 383.448 3.482 20 5 GGBDRN O=[N+]([O-])c1ccccc1-c1cnn(CCS(=O)(=O)c2ccc(F)cc2)c1 ZINC000193002642 1432920106 /nfs/dbraw/zinc/92/01/06/1432920106.db2.gz TYXUXQRVIMPFAT-UHFFFAOYSA-N 0 0 375.381 3.071 20 5 GGBDRN COc1ccccc1N1CC[C@@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1=O ZINC000193019045 1432922929 /nfs/dbraw/zinc/92/29/29/1432922929.db2.gz BRWNMRAYHOUIMG-QZTJIDSGSA-N 0 0 381.432 3.376 20 5 GGBDRN CCc1cc(Nc2cnn(CC(=O)OC)c2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000193019820 1432923127 /nfs/dbraw/zinc/92/31/27/1432923127.db2.gz CHLUMDGOUMUTSU-UHFFFAOYSA-N 0 0 396.407 3.036 20 5 GGBDRN C[C@H](c1ccccc1)N(C)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000193029734 1432924657 /nfs/dbraw/zinc/92/46/57/1432924657.db2.gz WQOOAFNCPCEVDI-HIFRSBDPSA-N 0 0 387.461 3.481 20 5 GGBDRN CCCNc1ccc(CNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1 ZINC000193032729 1432924830 /nfs/dbraw/zinc/92/48/30/1432924830.db2.gz KBLUVPDRBPQVPA-UHFFFAOYSA-N 0 0 394.435 3.236 20 5 GGBDRN CC(=O)N1CCC[C@@H](C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)C1 ZINC000193046160 1432927441 /nfs/dbraw/zinc/92/74/41/1432927441.db2.gz DYQGLYCOZJXYBM-CQSZACIVSA-N 0 0 388.449 3.224 20 5 GGBDRN CNC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 ZINC000193049489 1432928074 /nfs/dbraw/zinc/92/80/74/1432928074.db2.gz VBRQOJWPYQQHMA-UHFFFAOYSA-N 0 0 399.472 3.344 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cnn1C1CCCC1 ZINC000193053063 1432928642 /nfs/dbraw/zinc/92/86/42/1432928642.db2.gz FYWRVMRMJQFMTJ-LBPRGKRZSA-N 0 0 385.424 3.031 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccccc1N1CCCCCC1 ZINC000193064342 1432930845 /nfs/dbraw/zinc/93/08/45/1432930845.db2.gz MKMVWVXMIMPBFN-UHFFFAOYSA-N 0 0 396.447 3.344 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000193071644 1432931896 /nfs/dbraw/zinc/93/18/96/1432931896.db2.gz 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ZINC000193407477 1432992684 /nfs/dbraw/zinc/99/26/84/1432992684.db2.gz JCHVABKLQDHPCK-LJQANCHMSA-N 0 0 383.448 3.015 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000193413291 1432993864 /nfs/dbraw/zinc/99/38/64/1432993864.db2.gz NWLVIWOJRFHNHF-JTQLQIEISA-N 0 0 393.346 3.040 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000193415298 1432994167 /nfs/dbraw/zinc/99/41/67/1432994167.db2.gz ZQKKFXIEVIRZQO-LLVKDONJSA-N 0 0 377.347 3.340 20 5 GGBDRN CCCNC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000193416150 1432994212 /nfs/dbraw/zinc/99/42/12/1432994212.db2.gz QDCZVBXWKYNHRL-UHFFFAOYSA-N 0 0 387.461 3.392 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 ZINC000193416569 1432994500 /nfs/dbraw/zinc/99/45/00/1432994500.db2.gz DHPACAFCHBUKKJ-LLVKDONJSA-N 0 0 377.347 3.340 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CC(=O)N([C@H](C)c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000193438005 1432999097 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COc1ccc([N+](=O)[O-])cc1CNC(=O)COc1cccc(C(F)(F)F)c1 ZINC000193584593 1433023933 /nfs/dbraw/zinc/02/39/33/1433023933.db2.gz FOTJLYPRKZHESQ-UHFFFAOYSA-N 0 0 384.310 3.317 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C[C@@H]1c2ccccc2C=CN1C(C)=O ZINC000193587264 1433024182 /nfs/dbraw/zinc/02/41/82/1433024182.db2.gz GTEKICFCAXHBLZ-LJQANCHMSA-N 0 0 395.415 3.184 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cnn(-c2ccccc2F)c1C ZINC000193587009 1433024193 /nfs/dbraw/zinc/02/41/93/1433024193.db2.gz NVPVDQFTJMRSRJ-UHFFFAOYSA-N 0 0 384.367 3.167 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1COc2ccc(Cl)cc2C1 ZINC000193587862 1433024367 /nfs/dbraw/zinc/02/43/67/1433024367.db2.gz WKEJBIOLPLUHPC-CYBMUJFWSA-N 0 0 376.796 3.124 20 5 GGBDRN O=C(Nc1cccc(C[S@@](=O)c2ccccc2)c1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193589394 1433024701 /nfs/dbraw/zinc/02/47/01/1433024701.db2.gz DLWMZSMRXVIGOM-MUUNZHRXSA-N 0 0 397.412 3.256 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H](C)c1ccccc1Cl ZINC000193597297 1433026222 /nfs/dbraw/zinc/02/62/22/1433026222.db2.gz PMSXKNVAZNKLBZ-NSHDSACASA-N 0 0 391.811 3.415 20 5 GGBDRN O=C(CCC1CCCCC1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000193615118 1433029331 /nfs/dbraw/zinc/02/93/31/1433029331.db2.gz WUEOJSJGBNZGKN-UHFFFAOYSA-N 0 0 391.443 3.379 20 5 GGBDRN CC(=O)Nc1ccc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 ZINC000193633895 1433031519 /nfs/dbraw/zinc/03/15/19/1433031519.db2.gz HZUCXRXZUYCNOJ-UHFFFAOYSA-N 0 0 382.420 3.401 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)c(C(=O)NC2CC2)c1 ZINC000193634437 1433031548 /nfs/dbraw/zinc/03/15/48/1433031548.db2.gz FPTSYFCFHPNMOO-UHFFFAOYSA-N 0 0 388.811 3.462 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CC=C(c2ccc(O)cc2)CC1 ZINC000193640675 1433032512 /nfs/dbraw/zinc/03/25/12/1433032512.db2.gz WYQWEOLEANGBAX-UHFFFAOYSA-N 0 0 390.399 3.416 20 5 GGBDRN COC[C@@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccc(Cl)cc1 ZINC000193661217 1433035862 /nfs/dbraw/zinc/03/58/62/1433035862.db2.gz MEGWIHYEBMLENI-QGZVFWFLSA-N 0 0 389.839 3.115 20 5 GGBDRN Cc1cc(NC(=O)NCc2ccc(CN3CCCC3=O)cc2)ccc1[N+](=O)[O-] ZINC000193659475 1433035872 /nfs/dbraw/zinc/03/58/72/1433035872.db2.gz SCUJTCFJXUXLAK-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN Cc1cc(NC(=O)NC[C@H](c2ccccc2)N2CCOCC2)ccc1[N+](=O)[O-] ZINC000193677963 1433039162 /nfs/dbraw/zinc/03/91/62/1433039162.db2.gz HGAGNJFWNVNVQI-LJQANCHMSA-N 0 0 384.436 3.098 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(S(=O)(=O)C(F)F)cc1 ZINC000193679257 1433039166 /nfs/dbraw/zinc/03/91/66/1433039166.db2.gz ZEMUWXHXGLJXNP-UHFFFAOYSA-N 0 0 384.360 3.460 20 5 GGBDRN COc1ccccc1N1C[C@H](C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC1=O ZINC000193679148 1433039320 /nfs/dbraw/zinc/03/93/20/1433039320.db2.gz ONNXWIOWLIUXEN-CQSZACIVSA-N 0 0 383.404 3.212 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000193683862 1433040160 /nfs/dbraw/zinc/04/01/60/1433040160.db2.gz IPORFFKRIKBZJS-KRWDZBQOSA-N 0 0 389.408 3.087 20 5 GGBDRN COC[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000193687365 1433040765 /nfs/dbraw/zinc/04/07/65/1433040765.db2.gz RABHTKKOPZAVHS-KRWDZBQOSA-N 0 0 377.828 3.188 20 5 GGBDRN CC[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193707634 1433044265 /nfs/dbraw/zinc/04/42/65/1433044265.db2.gz BBTOAZHNTAKZAP-SNVBAGLBSA-N 0 0 377.260 3.311 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccccc2F)cc1Br ZINC000193708972 1433044556 /nfs/dbraw/zinc/04/45/56/1433044556.db2.gz WVFZCDMVLKTGAZ-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN CS(=O)(=O)Nc1cccc2c1CCN(c1ccc3ncccc3c1[N+](=O)[O-])C2 ZINC000193716125 1433045922 /nfs/dbraw/zinc/04/59/22/1433045922.db2.gz ZAFMHDJPATYSFU-UHFFFAOYSA-N 0 0 398.444 3.077 20 5 GGBDRN CN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000193729684 1433048552 /nfs/dbraw/zinc/04/85/52/1433048552.db2.gz RIWUCZFHKCRZLC-LSDHHAIUSA-N 0 0 397.218 3.419 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccc(F)c(F)c2)cc1Br ZINC000193734762 1433049536 /nfs/dbraw/zinc/04/95/36/1433049536.db2.gz VEUIZCUHAATSDV-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@H](COc2ccccc2Cl)C1 ZINC000193751870 1433052078 /nfs/dbraw/zinc/05/20/78/1433052078.db2.gz FBONIEDKBCIQAK-LBPRGKRZSA-N 0 0 391.811 3.280 20 5 GGBDRN CC(C)C(=O)Nc1ccc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000193782632 1433058199 /nfs/dbraw/zinc/05/81/99/1433058199.db2.gz KHMZLMFULUWQQJ-UHFFFAOYSA-N 0 0 385.420 3.275 20 5 GGBDRN COc1ccc(F)cc1[C@H](C)NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000193785439 1433059032 /nfs/dbraw/zinc/05/90/32/1433059032.db2.gz NOMUODPFXBPAFF-VIFPVBQESA-N 0 0 395.774 3.212 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H]1CCc2cc(F)ccc21 ZINC000193790766 1433060138 /nfs/dbraw/zinc/06/01/38/1433060138.db2.gz HHQYXROQQWWFND-AWEZNQCLSA-N 0 0 377.759 3.130 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H]1CCc2cc(F)ccc21 ZINC000193790749 1433060158 /nfs/dbraw/zinc/06/01/58/1433060158.db2.gz HHQYXROQQWWFND-CQSZACIVSA-N 0 0 377.759 3.130 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H]1CCc2cc(F)ccc21 ZINC000193790841 1433060197 /nfs/dbraw/zinc/06/01/97/1433060197.db2.gz ARHOCBAXWLORNO-AWEZNQCLSA-N 0 0 377.759 3.130 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(C2CC2)C2CCCC2)cc1Br ZINC000193799287 1433062020 /nfs/dbraw/zinc/06/20/20/1433062020.db2.gz LSFXDGTULMOFPV-UHFFFAOYSA-N 0 0 389.271 3.453 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCc3[nH]c4ccc(F)cc4c3C2)cc1[N+](=O)[O-] ZINC000193805577 1433063261 /nfs/dbraw/zinc/06/32/61/1433063261.db2.gz ZZNQRNBZQOYOKN-UHFFFAOYSA-N 0 0 396.378 3.047 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCc3[nH]c4ccc(F)cc4c3C2)cccc1[N+](=O)[O-] ZINC000193806005 1433063773 /nfs/dbraw/zinc/06/37/73/1433063773.db2.gz XNPGFFDGICGOGU-UHFFFAOYSA-N 0 0 396.378 3.047 20 5 GGBDRN C[C@H](c1ccccc1)N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000193812355 1433065153 /nfs/dbraw/zinc/06/51/53/1433065153.db2.gz RSXRCQUVGOGADE-LLVKDONJSA-N 0 0 393.346 3.354 20 5 GGBDRN COc1cccc(C(=O)NCC(=O)Nc2cc(Cl)ccc2Cl)c1[N+](=O)[O-] ZINC000193841336 1433070883 /nfs/dbraw/zinc/07/08/83/1433070883.db2.gz PCNGBSILGVVQOQ-UHFFFAOYSA-N 0 0 398.202 3.279 20 5 GGBDRN CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCc1cnc(C)s1 ZINC000193866315 1433075790 /nfs/dbraw/zinc/07/57/90/1433075790.db2.gz KFFCCWFYTXWMJW-UHFFFAOYSA-N 0 0 388.405 3.301 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)CCCCc1ccccc1 ZINC000193868677 1433076000 /nfs/dbraw/zinc/07/60/00/1433076000.db2.gz GBJFATQLCXNYOA-UHFFFAOYSA-N 0 0 385.420 3.023 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N(CC(F)F)c1ccc(F)cc1 ZINC000193870442 1433076278 /nfs/dbraw/zinc/07/62/78/1433076278.db2.gz PEAFNDYNNBBIJQ-UHFFFAOYSA-N 0 0 391.309 3.227 20 5 GGBDRN CN(C[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000193880182 1433077679 /nfs/dbraw/zinc/07/76/79/1433077679.db2.gz IAWKAYPXNKOSLN-CYBMUJFWSA-N 0 0 394.428 3.192 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCCCC[C@@H]1c1ccncc1 ZINC000193883536 1433077929 /nfs/dbraw/zinc/07/79/29/1433077929.db2.gz JADVPPMXKQWPGY-GOSISDBHSA-N 0 0 382.420 3.381 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCc2nc(N(C)C)no2)cc1[N+](=O)[O-] ZINC000193894356 1433079824 /nfs/dbraw/zinc/07/98/24/1433079824.db2.gz JTVWSWSECIQJOG-UHFFFAOYSA-N 0 0 393.469 3.112 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCN(C(=O)c2ccccc2)CC1 ZINC000193899652 1433080764 /nfs/dbraw/zinc/08/07/64/1433080764.db2.gz VWBCDMAFNPBWAX-UHFFFAOYSA-N 0 0 395.440 3.408 20 5 GGBDRN CC[C@@H](C)C(=O)Nc1cccc(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000193913605 1433083528 /nfs/dbraw/zinc/08/35/28/1433083528.db2.gz TZLFAROPHYYOIF-CYBMUJFWSA-N 0 0 391.449 3.058 20 5 GGBDRN C[C@@H]1CCCC[C@H]1CNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000193935317 1433088068 /nfs/dbraw/zinc/08/80/68/1433088068.db2.gz DJVVCIGBCDQQPN-OCCSQVGLSA-N 0 0 389.481 3.431 20 5 GGBDRN C[C@H]1CCCC[C@@H]1CNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000193935304 1433088084 /nfs/dbraw/zinc/08/80/84/1433088084.db2.gz DJVVCIGBCDQQPN-GXTWGEPZSA-N 0 0 389.481 3.431 20 5 GGBDRN Cc1cc(-c2noc(-c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)n2)ccc1F ZINC000193936257 1433088464 /nfs/dbraw/zinc/08/84/64/1433088464.db2.gz NMIQDWVMEXKKMX-UHFFFAOYSA-N 0 0 377.353 3.163 20 5 GGBDRN CN(C)C(=O)c1ccc(Cl)c(NC(=O)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000193939330 1433089022 /nfs/dbraw/zinc/08/90/22/1433089022.db2.gz FUXUTSWRHBVEBD-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000193941970 1433089333 /nfs/dbraw/zinc/08/93/33/1433089333.db2.gz VLBQZWXJTMLYNO-LLVKDONJSA-N 0 0 391.811 3.381 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193940913 1433089347 /nfs/dbraw/zinc/08/93/47/1433089347.db2.gz WTGLGKDIZJBZOX-SNVBAGLBSA-N 0 0 381.310 3.430 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193942911 1433089603 /nfs/dbraw/zinc/08/96/03/1433089603.db2.gz XCQYNHHSGYOFIU-JTQLQIEISA-N 0 0 379.319 3.012 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccccc1N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000193943469 1433089711 /nfs/dbraw/zinc/08/97/11/1433089711.db2.gz ZGANSRVQVKWSPM-AWEZNQCLSA-N 0 0 382.420 3.011 20 5 GGBDRN CC(C)COc1cccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193943877 1433089794 /nfs/dbraw/zinc/08/97/94/1433089794.db2.gz HTKURTZBEWMYTE-AWEZNQCLSA-N 0 0 385.420 3.446 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000193944626 1433089936 /nfs/dbraw/zinc/08/99/36/1433089936.db2.gz UERFJNWJZIVQGB-JTQLQIEISA-N 0 0 377.784 3.073 20 5 GGBDRN COc1ccc(Cl)cc1CNC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000193945192 1433090060 /nfs/dbraw/zinc/09/00/60/1433090060.db2.gz PDNZIGGZRIFBII-UHFFFAOYSA-N 0 0 379.800 3.265 20 5 GGBDRN C[C@@H]1CCCC[C@H]1CNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000193946046 1433090197 /nfs/dbraw/zinc/09/01/97/1433090197.db2.gz ACBAWSKNGQAQJE-KGLIPLIRSA-N 0 0 375.425 3.225 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc(Cl)c1N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000193945219 1433090199 /nfs/dbraw/zinc/09/01/99/1433090199.db2.gz LJHWKBONZKQJGX-NSHDSACASA-N 0 0 390.827 3.130 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H](C)c1cc(F)ccc1OC ZINC000193945964 1433090218 /nfs/dbraw/zinc/09/02/18/1433090218.db2.gz KIWYFFVYDSSSSE-LLVKDONJSA-N 0 0 377.372 3.312 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)Oc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000193948087 1433090352 /nfs/dbraw/zinc/09/03/52/1433090352.db2.gz AENMQGSEYKLYHE-UHFFFAOYSA-N 0 0 392.343 3.372 20 5 GGBDRN Cc1nn(-c2ccccc2C)c(C)c1CN(C)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000193956436 1433092096 /nfs/dbraw/zinc/09/20/96/1433092096.db2.gz PCQRECHXMQMAQB-UHFFFAOYSA-N 0 0 393.447 3.441 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193958982 1433092586 /nfs/dbraw/zinc/09/25/86/1433092586.db2.gz FAZGFRWADPPBHM-CQSZACIVSA-N 0 0 385.420 3.277 20 5 GGBDRN O=C(c1nc2cccnc2s1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000193967472 1433093739 /nfs/dbraw/zinc/09/37/39/1433093739.db2.gz JENBWBXEUUHIIU-UHFFFAOYSA-N 0 0 384.417 3.283 20 5 GGBDRN Cc1nn2c(nc(C)cc2C)c1C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000193972069 1433094457 /nfs/dbraw/zinc/09/44/57/1433094457.db2.gz WNIXQIROKNMAAV-UHFFFAOYSA-N 0 0 387.827 3.488 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000193978923 1433095218 /nfs/dbraw/zinc/09/52/18/1433095218.db2.gz QCZFDWOOEDHYRZ-OAHLLOKOSA-N 0 0 380.397 3.268 20 5 GGBDRN CCNC(=O)CN(CC)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000193981195 1433095525 /nfs/dbraw/zinc/09/55/25/1433095525.db2.gz SFBIDYHQBMWSEY-UHFFFAOYSA-N 0 0 387.461 3.344 20 5 GGBDRN O=C(NCc1nnc(C2CC2)o1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194002449 1433098998 /nfs/dbraw/zinc/09/89/98/1433098998.db2.gz YFBVEVBVXNPLIQ-UHFFFAOYSA-N 0 0 394.387 3.364 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCOc2cccc3ccccc32)cccc1[N+](=O)[O-] ZINC000194003695 1433099312 /nfs/dbraw/zinc/09/93/12/1433099312.db2.gz JKDGIMUZDLXIQI-UHFFFAOYSA-N 0 0 393.399 3.190 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000194027128 1433103543 /nfs/dbraw/zinc/10/35/43/1433103543.db2.gz KGOIMHWHPQRUBE-UHFFFAOYSA-N 0 0 398.202 3.165 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(=O)Nc1ccc(Cl)cc1Cl ZINC000194027235 1433103585 /nfs/dbraw/zinc/10/35/85/1433103585.db2.gz VHBJJIUBDKSXAI-UHFFFAOYSA-N 0 0 398.202 3.165 20 5 GGBDRN CCCCc1ccc(NC(=O)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000194027150 1433103595 /nfs/dbraw/zinc/10/35/95/1433103595.db2.gz SJZVFHRONCPCBR-UHFFFAOYSA-N 0 0 385.420 3.201 20 5 GGBDRN COc1ccc(CN(C(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)C2CC2)cc1 ZINC000194030478 1433104115 /nfs/dbraw/zinc/10/41/15/1433104115.db2.gz HSYWSHLZXQWZRY-UHFFFAOYSA-N 0 0 383.404 3.042 20 5 GGBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCN(c3cnccn3)CC2)s1 ZINC000194032666 1433104463 /nfs/dbraw/zinc/10/44/63/1433104463.db2.gz ZDQLDPKWDFCULF-UHFFFAOYSA-N 0 0 381.461 3.436 20 5 GGBDRN COc1cccc(C)c1NC(=O)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000194037671 1433105484 /nfs/dbraw/zinc/10/54/84/1433105484.db2.gz SFOSQRAHEVUPSD-UHFFFAOYSA-N 0 0 383.404 3.042 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000194048460 1433107265 /nfs/dbraw/zinc/10/72/65/1433107265.db2.gz TZRBPNYWOZSIBM-CQSZACIVSA-N 0 0 389.433 3.139 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2CCOc2ccccc2[N+](=O)[O-])o1 ZINC000194052959 1433108386 /nfs/dbraw/zinc/10/83/86/1433108386.db2.gz CJFFPGQBBVBFCX-SFHVURJKSA-N 0 0 380.404 3.465 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000194057766 1433109637 /nfs/dbraw/zinc/10/96/37/1433109637.db2.gz ONZCLOUKROPWGQ-MRXNPFEDSA-N 0 0 393.403 3.453 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)nnn1Cc1ccc(F)cc1 ZINC000194075037 1433112307 /nfs/dbraw/zinc/11/23/07/1433112307.db2.gz JKPQZFQPDRGRLR-LBPRGKRZSA-N 0 0 383.383 3.173 20 5 GGBDRN CC(C)Oc1ccccc1CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000194075826 1433112684 /nfs/dbraw/zinc/11/26/84/1433112684.db2.gz NHLXIFVJXIZUQB-UHFFFAOYSA-N 0 0 391.811 3.290 20 5 GGBDRN Cc1csc([C@@H]2CN(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CCO2)n1 ZINC000194079222 1433113219 /nfs/dbraw/zinc/11/32/19/1433113219.db2.gz NKXCPHLRUBOGEL-DOMZBBRYSA-N 0 0 376.438 3.204 20 5 GGBDRN COc1ccc(OC(=O)C2(c3cccc(F)c3)CCOCC2)c([N+](=O)[O-])c1 ZINC000194095747 1433116553 /nfs/dbraw/zinc/11/65/53/1433116553.db2.gz AEPYNKKTUSMAAU-UHFFFAOYSA-N 0 0 375.352 3.396 20 5 GGBDRN CCCCOc1ccc([C@H](C)NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1OC ZINC000194110686 1433119312 /nfs/dbraw/zinc/11/93/12/1433119312.db2.gz OGXNTMBCQHKBJD-LBPRGKRZSA-N 0 0 390.440 3.315 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@@H]2CCCC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000194117107 1433120257 /nfs/dbraw/zinc/12/02/57/1433120257.db2.gz MSMGOIMHCLVZNK-HUUCEWRRSA-N 0 0 391.468 3.054 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)ccc21 ZINC000194118249 1433120631 /nfs/dbraw/zinc/12/06/31/1433120631.db2.gz JYWTWZKFXYTAKA-UHFFFAOYSA-N 0 0 380.404 3.310 20 5 GGBDRN CCCN(C(=O)CCN1C(=O)COc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000194127390 1433122343 /nfs/dbraw/zinc/12/23/43/1433122343.db2.gz JXSIZIGZABJKOE-UHFFFAOYSA-N 0 0 383.404 3.154 20 5 GGBDRN CCCN(C(=O)Cc1csc(N2CCCC2=O)n1)c1cccc([N+](=O)[O-])c1 ZINC000194127435 1433122442 /nfs/dbraw/zinc/12/24/42/1433122442.db2.gz TWFVRJUBBIPJSU-UHFFFAOYSA-N 0 0 388.449 3.164 20 5 GGBDRN COc1cccc(C(=O)NCC2(c3ccc(F)cc3)CCOCC2)c1[N+](=O)[O-] ZINC000194130890 1433122737 /nfs/dbraw/zinc/12/27/37/1433122737.db2.gz IGBCGGOGNIPZAO-UHFFFAOYSA-N 0 0 388.395 3.221 20 5 GGBDRN CCCN(C(=O)C1CCN(C(=O)N2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194132354 1433122914 /nfs/dbraw/zinc/12/29/14/1433122914.db2.gz PMTJKLWRYUVVSG-UHFFFAOYSA-N 0 0 388.468 3.266 20 5 GGBDRN CCCN(C(=O)CN1c2ccccc2O[C@H](C)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000194132156 1433123006 /nfs/dbraw/zinc/12/30/06/1433123006.db2.gz QUCKEROARHNUKZ-CQSZACIVSA-N 0 0 383.404 3.152 20 5 GGBDRN CCCN(C(=O)c1ccc(S(=O)(=O)CC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000194132698 1433123017 /nfs/dbraw/zinc/12/30/17/1433123017.db2.gz VPGDDAHDTFAHRI-UHFFFAOYSA-N 0 0 376.434 3.445 20 5 GGBDRN CCCN(C(=O)[C@H](C)n1nnc(-c2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000194133497 1433123251 /nfs/dbraw/zinc/12/32/51/1433123251.db2.gz YBYWUZVUTGVPJJ-AWEZNQCLSA-N 0 0 380.408 3.253 20 5 GGBDRN CCCN(C(=O)Cc1cccc(S(=O)(=O)CC)c1)c1cccc([N+](=O)[O-])c1 ZINC000194134269 1433123300 /nfs/dbraw/zinc/12/33/00/1433123300.db2.gz IGLBZLWARSMBAZ-UHFFFAOYSA-N 0 0 390.461 3.374 20 5 GGBDRN CCCN(C(=O)c1ccc(CS(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000194134724 1433123572 /nfs/dbraw/zinc/12/35/72/1433123572.db2.gz POZUELRFHPKOEU-UHFFFAOYSA-N 0 0 376.434 3.196 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1Br ZINC000194135909 1433123592 /nfs/dbraw/zinc/12/35/92/1433123592.db2.gz IZNLITFCDAIQER-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c1[N+](=O)[O-] ZINC000194138971 1433124003 /nfs/dbraw/zinc/12/40/03/1433124003.db2.gz SKIRCRTZODWBFL-UHFFFAOYSA-N 0 0 397.431 3.411 20 5 GGBDRN CCCN(C(=O)CCN1C(=O)c2ccccc2C1=O)c1cccc([N+](=O)[O-])c1 ZINC000194141118 1433124416 /nfs/dbraw/zinc/12/44/16/1433124416.db2.gz KNLPMMQOFKGUGV-UHFFFAOYSA-N 0 0 381.388 3.024 20 5 GGBDRN CCCN(C(=O)c1ccc(C)c(S(C)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000194146338 1433126437 /nfs/dbraw/zinc/12/64/37/1433126437.db2.gz HLUMDOJNFQDFOK-UHFFFAOYSA-N 0 0 376.434 3.364 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000194180947 1433133041 /nfs/dbraw/zinc/13/30/41/1433133041.db2.gz OODJUWJEFBSYJW-UHFFFAOYSA-N 0 0 375.812 3.027 20 5 GGBDRN COc1cccc(C(=O)Nc2cccc(CN3CCCCC3=O)c2)c1[N+](=O)[O-] ZINC000194190255 1433134678 /nfs/dbraw/zinc/13/46/78/1433134678.db2.gz ZHQUDCDEBRUHIM-UHFFFAOYSA-N 0 0 383.404 3.368 20 5 GGBDRN O=C(c1n[nH]nc1-c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000194201700 1433137649 /nfs/dbraw/zinc/13/76/49/1433137649.db2.gz XVSGLSUWWYZZAO-UHFFFAOYSA-N 0 0 393.403 3.064 20 5 GGBDRN C[C@@H](O)c1ccc(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000194202806 1433137726 /nfs/dbraw/zinc/13/77/26/1433137726.db2.gz ODKDTAMZKKUXSL-OAHLLOKOSA-N 0 0 383.448 3.181 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc2[nH]c(-c3cccc(F)c3)nc2c1 ZINC000194205537 1433138661 /nfs/dbraw/zinc/13/86/61/1433138661.db2.gz OXTJVFRKAXOZNM-UHFFFAOYSA-N 0 0 380.339 3.112 20 5 GGBDRN C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000194218064 1433140933 /nfs/dbraw/zinc/14/09/33/1433140933.db2.gz WTCMCUBNOWREPT-SJCJKPOMSA-N 0 0 385.445 3.000 20 5 GGBDRN CC(=O)Nc1cccc2c1CCN(c1cc3c(cc1[N+](=O)[O-])CCC(=O)N3)C2 ZINC000194222154 1433141931 /nfs/dbraw/zinc/14/19/31/1433141931.db2.gz UFLUGSKXGXMGEU-UHFFFAOYSA-N 0 0 380.404 3.001 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000194252222 1433149327 /nfs/dbraw/zinc/14/93/27/1433149327.db2.gz OSZZOOHVLHCRMB-KRWDZBQOSA-N 0 0 396.403 3.195 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N(Cc1ccco1)C[C@H]1CCCO1 ZINC000194252236 1433149333 /nfs/dbraw/zinc/14/93/33/1433149333.db2.gz OSZZOOHVLHCRMB-QGZVFWFLSA-N 0 0 396.403 3.195 20 5 GGBDRN O=C(NCc1ccc(NC(=O)c2ccco2)cc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000194253498 1433149474 /nfs/dbraw/zinc/14/94/74/1433149474.db2.gz XTXLHXADIXDMLG-UHFFFAOYSA-N 0 0 394.387 3.440 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NC[C@H](C)c2nncn2C)cc1[N+](=O)[O-] ZINC000194255186 1433149829 /nfs/dbraw/zinc/14/98/29/1433149829.db2.gz IEBVOJWKANRDPT-ZDUSSCGKSA-N 0 0 391.497 3.395 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n[nH]1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000194271557 1433153555 /nfs/dbraw/zinc/15/35/55/1433153555.db2.gz KTEKDLIRNMNASE-UHFFFAOYSA-N 0 0 379.420 3.153 20 5 GGBDRN C[C@H](CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])Cn1cccn1 ZINC000194273745 1433153866 /nfs/dbraw/zinc/15/38/66/1433153866.db2.gz AFSILELHPZEKLR-MRXNPFEDSA-N 0 0 394.431 3.436 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000194286444 1433155545 /nfs/dbraw/zinc/15/55/45/1433155545.db2.gz FNCKMGUPSZVNKQ-DJJJIMSYSA-N 0 0 380.416 3.275 20 5 GGBDRN COc1cc(C(=O)N2CCN(c3cncc4ccccc43)CC2)ccc1[N+](=O)[O-] ZINC000194287720 1433156013 /nfs/dbraw/zinc/15/60/13/1433156013.db2.gz CMXJCMZDHBQYPO-UHFFFAOYSA-N 0 0 392.415 3.114 20 5 GGBDRN COc1cccc(C(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000194294088 1433156863 /nfs/dbraw/zinc/15/68/63/1433156863.db2.gz XNWNKJIDGWIOJP-UHFFFAOYSA-N 0 0 389.383 3.232 20 5 GGBDRN CCCn1c(C)nnc1C[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194298305 1433157696 /nfs/dbraw/zinc/15/76/96/1433157696.db2.gz XEXCTGPNASDAND-MHZLTWQESA-N 0 0 389.437 3.009 20 5 GGBDRN C[C@H](NC(=O)NCc1cccc(CN2CCCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000194316035 1433160049 /nfs/dbraw/zinc/16/00/49/1433160049.db2.gz XZNDGVBKALAKPA-HNNXBMFYSA-N 0 0 396.447 3.278 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCc1ccc(OC(F)(F)F)cc1 ZINC000194338826 1433163858 /nfs/dbraw/zinc/16/38/58/1433163858.db2.gz WWZRSTPPQXEZIP-UHFFFAOYSA-N 0 0 394.302 3.111 20 5 GGBDRN CCCOCc1ccccc1CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194348832 1433165029 /nfs/dbraw/zinc/16/50/29/1433165029.db2.gz PPVJWGCCENZYDV-UHFFFAOYSA-N 0 0 382.413 3.139 20 5 GGBDRN Cc1ccccc1OCCCN(C)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194352699 1433165698 /nfs/dbraw/zinc/16/56/98/1433165698.db2.gz MKJCQISETBEENB-UHFFFAOYSA-N 0 0 382.413 3.132 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194352078 1433165760 /nfs/dbraw/zinc/16/57/60/1433165760.db2.gz ZCWLUGVKAGEXGM-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(N2C[C@@H](C)O[C@@H](C)C2)ccn1 ZINC000194362778 1433167276 /nfs/dbraw/zinc/16/72/76/1433167276.db2.gz CVJXSTSKZDFYCF-GASCZTMLSA-N 0 0 384.436 3.473 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC1CCN(C(=O)Nc2ccccc2)CC1 ZINC000194379632 1433169190 /nfs/dbraw/zinc/16/91/90/1433169190.db2.gz MSQBMQPOGKNFCX-UHFFFAOYSA-N 0 0 382.420 3.330 20 5 GGBDRN CC(C)C(CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C(C)C ZINC000194388215 1433170823 /nfs/dbraw/zinc/17/08/23/1433170823.db2.gz KFBMNDANXJNTIQ-UHFFFAOYSA-N 0 0 387.383 3.179 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)cc([N+](=O)[O-])c1 ZINC000194390092 1433171264 /nfs/dbraw/zinc/17/12/64/1433171264.db2.gz NILWKRJDWWVBGO-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(=O)n(C)c3)cc2[N+](=O)[O-])C1 ZINC000194397316 1433172013 /nfs/dbraw/zinc/17/20/13/1433172013.db2.gz DNHMKEGRDSXNIM-ZIAGYGMSSA-N 0 0 384.436 3.028 20 5 GGBDRN C[C@@H](NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C(=O)NC(C)(C)C ZINC000194406613 1433173279 /nfs/dbraw/zinc/17/32/79/1433173279.db2.gz CUWOJCHTQMIJGR-CQSZACIVSA-N 0 0 399.447 3.207 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)cc([N+](=O)[O-])c1 ZINC000194418462 1433174858 /nfs/dbraw/zinc/17/48/58/1433174858.db2.gz GAKQXAHYYXUBPC-UHFFFAOYSA-N 0 0 398.350 3.267 20 5 GGBDRN C[C@H](NC(=O)NCc1cccc(Cn2ccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000194437051 1433177789 /nfs/dbraw/zinc/17/77/89/1433177789.db2.gz QZIUPOAMYCENCS-HNNXBMFYSA-N 0 0 379.420 3.400 20 5 GGBDRN O=C(c1ccsc1)N1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000194439617 1433178097 /nfs/dbraw/zinc/17/80/97/1433178097.db2.gz SLFATSZWIAGSPK-UHFFFAOYSA-N 0 0 393.852 3.298 20 5 GGBDRN CCOC(=O)CCN(C)C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000194465483 1433182481 /nfs/dbraw/zinc/18/24/81/1433182481.db2.gz ISRMDRAIIBXTBU-HUUCEWRRSA-N 0 0 391.468 3.102 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(NC(=O)Nc2ccccc2)CC1 ZINC000194482093 1433185443 /nfs/dbraw/zinc/18/54/43/1433185443.db2.gz YBCZOHFTCAKPIL-UHFFFAOYSA-N 0 0 382.420 3.330 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000194489391 1433186347 /nfs/dbraw/zinc/18/63/47/1433186347.db2.gz OLKWVNLIMLVOEC-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(NC(=O)c2cccnc2)cc1 ZINC000194509538 1433189968 /nfs/dbraw/zinc/18/99/68/1433189968.db2.gz VLHZDAHVQBHSLF-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN COc1cccc(C(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)c1[N+](=O)[O-] ZINC000194520214 1433191392 /nfs/dbraw/zinc/19/13/92/1433191392.db2.gz IKQNMBVKSACVIN-HNNXBMFYSA-N 0 0 378.388 3.244 20 5 GGBDRN COc1cccc(C(=O)N2C[C@H](n3cccn3)Cc3ccccc32)c1[N+](=O)[O-] ZINC000194520198 1433191402 /nfs/dbraw/zinc/19/14/02/1433191402.db2.gz IKQNMBVKSACVIN-OAHLLOKOSA-N 0 0 378.388 3.244 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCC[C@@H]2c2cccc(C)c2)cc1[N+](=O)[O-] ZINC000194521626 1433191647 /nfs/dbraw/zinc/19/16/47/1433191647.db2.gz GOQBWJRPKCJHPN-QGZVFWFLSA-N 0 0 397.431 3.005 20 5 GGBDRN COc1cccc(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)c1[N+](=O)[O-] ZINC000194527675 1433192646 /nfs/dbraw/zinc/19/26/46/1433192646.db2.gz PJEBQVIYDQVEQS-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN C[C@H](NC(=O)N(C)Cc1ccccc1N1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000194551841 1433196067 /nfs/dbraw/zinc/19/60/67/1433196067.db2.gz UKMGSXHFUAHYGP-INIZCTEOSA-N 0 0 398.463 3.334 20 5 GGBDRN C[C@H](NC(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194556160 1433196820 /nfs/dbraw/zinc/19/68/20/1433196820.db2.gz WMQRMFHNRASFBN-HNNXBMFYSA-N 0 0 396.447 3.260 20 5 GGBDRN C[C@@H](NC(=O)N1CCC(CC(=O)N2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194556331 1433196847 /nfs/dbraw/zinc/19/68/47/1433196847.db2.gz ACMVZZKGLHVVPR-OAHLLOKOSA-N 0 0 388.468 3.090 20 5 GGBDRN C[C@@H](NC(=O)N1CCCN(C(=O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194557319 1433197038 /nfs/dbraw/zinc/19/70/38/1433197038.db2.gz LRLSZICXAZHEKG-MRXNPFEDSA-N 0 0 396.447 3.214 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000194558484 1433197281 /nfs/dbraw/zinc/19/72/81/1433197281.db2.gz NCBKFOXLEMOXFO-MRXNPFEDSA-N 0 0 396.447 3.132 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(NC(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 ZINC000194560171 1433197646 /nfs/dbraw/zinc/19/76/46/1433197646.db2.gz LUJZMZLMBHUNJI-UHFFFAOYSA-N 0 0 381.432 3.246 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)c1 ZINC000194594165 1433202960 /nfs/dbraw/zinc/20/29/60/1433202960.db2.gz QYMHFUHSESITDO-MRXNPFEDSA-N 0 0 383.448 3.431 20 5 GGBDRN Cc1c(C(=O)N2CCCc3ccc(F)cc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000194606166 1433204448 /nfs/dbraw/zinc/20/44/48/1433204448.db2.gz YLXPVGCJIBGLBJ-UHFFFAOYSA-N 0 0 381.367 3.216 20 5 GGBDRN CSc1ccc(C(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000194612577 1433205514 /nfs/dbraw/zinc/20/55/14/1433205514.db2.gz OBFIQNRDSAEEPS-HNNXBMFYSA-N 0 0 385.445 3.020 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000194614592 1433205536 /nfs/dbraw/zinc/20/55/36/1433205536.db2.gz OCOVEBTZMYDKCZ-AWEZNQCLSA-N 0 0 377.441 3.280 20 5 GGBDRN COc1cccc(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1[N+](=O)[O-] ZINC000194616635 1433206126 /nfs/dbraw/zinc/20/61/26/1433206126.db2.gz KRSYBMIGKQPFCU-LBPRGKRZSA-N 0 0 382.376 3.068 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000194619334 1433206260 /nfs/dbraw/zinc/20/62/60/1433206260.db2.gz BTEOZQQCACNHCA-UHFFFAOYSA-N 0 0 389.795 3.175 20 5 GGBDRN Cc1cc(N2CCSCC2)ccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000194621078 1433206594 /nfs/dbraw/zinc/20/65/94/1433206594.db2.gz ZVZVJWGIHRXWEV-UHFFFAOYSA-N 0 0 393.490 3.257 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(C2N=NC(=S)N2C(C)C)CC1 ZINC000194630610 1433207883 /nfs/dbraw/zinc/20/78/83/1433207883.db2.gz JWCXGQCSMYHDEV-UHFFFAOYSA-N 0 0 389.481 3.384 20 5 GGBDRN CC(C)(C)[S@@](=O)Cc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000194633651 1433208597 /nfs/dbraw/zinc/20/85/97/1433208597.db2.gz YWMPQZVWHUVLFP-VWLOTQADSA-N 0 0 396.490 3.443 20 5 GGBDRN COc1ccc(CN(C)C(=O)[C@H](C)Sc2ncccc2[N+](=O)[O-])cc1F ZINC000194659475 1433212263 /nfs/dbraw/zinc/21/22/63/1433212263.db2.gz HCSPBWZWVHQVQI-NSHDSACASA-N 0 0 379.413 3.277 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1 ZINC000194672871 1433213854 /nfs/dbraw/zinc/21/38/54/1433213854.db2.gz GOXKJQSFMGRDNB-UHFFFAOYSA-N 0 0 383.433 3.351 20 5 GGBDRN COc1cccc(C(=O)NCCc2ccccc2OC(F)(F)F)c1[N+](=O)[O-] ZINC000194672731 1433213880 /nfs/dbraw/zinc/21/38/80/1433213880.db2.gz UQONYDKRCNNXME-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000194679388 1433214713 /nfs/dbraw/zinc/21/47/13/1433214713.db2.gz TUHUAQZESUBYQC-MRXNPFEDSA-N 0 0 387.823 3.434 20 5 GGBDRN CCOC(=O)[C@@H]1CCCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000194683084 1433215267 /nfs/dbraw/zinc/21/52/67/1433215267.db2.gz KULXNHZTZZSDOP-HNNXBMFYSA-N 0 0 389.433 3.276 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCC3CCOCC3)cc2[N+](=O)[O-])C1 ZINC000194688861 1433215693 /nfs/dbraw/zinc/21/56/93/1433215693.db2.gz KFJLRKVSHUTFFM-HUUCEWRRSA-N 0 0 375.469 3.234 20 5 GGBDRN COc1cccc(C(=O)NCc2ccccc2-n2nc(C)cc2C)c1[N+](=O)[O-] ZINC000194697219 1433216807 /nfs/dbraw/zinc/21/68/07/1433216807.db2.gz NIJKTQLLOGWDBL-UHFFFAOYSA-N 0 0 380.404 3.336 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC(C)(C)c1ccc2c(c1)OCCO2 ZINC000194711411 1433218593 /nfs/dbraw/zinc/21/85/93/1433218593.db2.gz CAXVYLCDRRHZBP-UHFFFAOYSA-N 0 0 399.447 3.485 20 5 GGBDRN COc1cc(CCNC(=O)c2nccc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000194714489 1433218783 /nfs/dbraw/zinc/21/87/83/1433218783.db2.gz UTDXQNOTTHXLCO-UHFFFAOYSA-N 0 0 381.388 3.133 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC2(c3ccc(F)cc3F)CCC2)cccc1[N+](=O)[O-] ZINC000194726755 1433220624 /nfs/dbraw/zinc/22/06/24/1433220624.db2.gz UEWAAQXJDHAPMM-UHFFFAOYSA-N 0 0 389.358 3.316 20 5 GGBDRN O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)Nc1cccc2ccccc21 ZINC000194746652 1433223626 /nfs/dbraw/zinc/22/36/26/1433223626.db2.gz RIMGERHLBAHCAI-UHFFFAOYSA-N 0 0 378.388 3.186 20 5 GGBDRN COc1ccccc1-n1ncc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1C ZINC000194752141 1433224527 /nfs/dbraw/zinc/22/45/27/1433224527.db2.gz TXCAGUNMKRHLEP-UHFFFAOYSA-N 0 0 380.404 3.070 20 5 GGBDRN CCn1ncc2ccc(NC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc21 ZINC000194760610 1433226348 /nfs/dbraw/zinc/22/63/48/1433226348.db2.gz JRXSKARSHKHSRS-UHFFFAOYSA-N 0 0 394.435 3.319 20 5 GGBDRN Cc1c(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)nnn1Cc1ccc(F)cc1 ZINC000194763083 1433226564 /nfs/dbraw/zinc/22/65/64/1433226564.db2.gz IZCGONBGTCBTLL-UHFFFAOYSA-N 0 0 395.394 3.275 20 5 GGBDRN O=C(N[C@H]1CC[C@H](CO)CC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194764957 1433227098 /nfs/dbraw/zinc/22/70/98/1433227098.db2.gz HYDVLSBKYPPRPV-WOVMCDHWSA-N 0 0 384.432 3.455 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC2(Cc3cccc(F)c3)CCC2)cccc1[N+](=O)[O-] ZINC000194767082 1433227583 /nfs/dbraw/zinc/22/75/83/1433227583.db2.gz QMBDVKQVPRGXLA-UHFFFAOYSA-N 0 0 385.395 3.262 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCc2c(cccc2N2CCOC2=O)C1 ZINC000194769956 1433228489 /nfs/dbraw/zinc/22/84/89/1433228489.db2.gz MYLGKPAXOKTMCH-UHFFFAOYSA-N 0 0 381.388 3.058 20 5 GGBDRN O=C(c1cc(N2CCCC2)ccn1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000194772834 1433228573 /nfs/dbraw/zinc/22/85/73/1433228573.db2.gz YKMDIUMLFAELKI-UHFFFAOYSA-N 0 0 396.447 3.274 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3c(C)cccc3[N+](=O)[O-])n2)c1 ZINC000194774947 1433228942 /nfs/dbraw/zinc/22/89/42/1433228942.db2.gz BXUWLJKMPFSLIA-GFCCVEGCSA-N 0 0 382.376 3.453 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000194776311 1433229464 /nfs/dbraw/zinc/22/94/64/1433229464.db2.gz MJOPKDPLOGZTJR-GOSISDBHSA-N 0 0 399.447 3.347 20 5 GGBDRN COc1ccc2c(c1)[nH]nc2NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000194799968 1433235277 /nfs/dbraw/zinc/23/52/77/1433235277.db2.gz SOFLNDLZHMKVRA-UHFFFAOYSA-N 0 0 381.392 3.332 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000194802441 1433236087 /nfs/dbraw/zinc/23/60/87/1433236087.db2.gz GXKKPOMFXCPBQT-INIZCTEOSA-N 0 0 381.432 3.185 20 5 GGBDRN C[C@@H]1CN(c2ccnc(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)c2)C[C@@H](C)O1 ZINC000194813759 1433238825 /nfs/dbraw/zinc/23/88/25/1433238825.db2.gz KJJILYALIMTJFG-HUUCEWRRSA-N 0 0 398.463 3.269 20 5 GGBDRN CCOc1ccc([C@@H](C)NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OCC ZINC000194829615 1433243047 /nfs/dbraw/zinc/24/30/47/1433243047.db2.gz NVIBJJMUTDCFGN-CYBMUJFWSA-N 0 0 387.436 3.342 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cnn1C1CCCC1 ZINC000194846910 1433247430 /nfs/dbraw/zinc/24/74/30/1433247430.db2.gz IDSYVWMGSBCKFZ-UHFFFAOYSA-N 0 0 385.424 3.409 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)NCCCc2cccc(Cl)c2)cc([N+](=O)[O-])c1 ZINC000194850375 1433248379 /nfs/dbraw/zinc/24/83/79/1433248379.db2.gz IVIUNMOYCHLWFX-UHFFFAOYSA-N 0 0 396.852 3.014 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000194859052 1433249894 /nfs/dbraw/zinc/24/98/94/1433249894.db2.gz SUJQNCZELYVLRQ-ZDUSSCGKSA-N 0 0 391.449 3.232 20 5 GGBDRN COc1cccc(C2CCN(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)CC2)c1 ZINC000194877150 1433254252 /nfs/dbraw/zinc/25/42/52/1433254252.db2.gz JXKIBQBUPVIHJN-UHFFFAOYSA-N 0 0 395.459 3.372 20 5 GGBDRN COc1cccc(C(=O)N2CCN([C@@H](C)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000194883359 1433256748 /nfs/dbraw/zinc/25/67/48/1433256748.db2.gz UPPOGKLKMOFIPK-ZDUSSCGKSA-N 0 0 375.450 3.184 20 5 GGBDRN COc1cccc(C2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000194895294 1433259488 /nfs/dbraw/zinc/25/94/88/1433259488.db2.gz VRJIIEZSNDIFEC-UHFFFAOYSA-N 0 0 394.424 3.311 20 5 GGBDRN COc1ccccc1N1CC[C@@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000194897224 1433259978 /nfs/dbraw/zinc/25/99/78/1433259978.db2.gz OBIZRNGXVUZXEN-INIZCTEOSA-N 0 0 399.447 3.015 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(N3CCOCC3)cn2)cc1[N+](=O)[O-] ZINC000194904498 1433261176 /nfs/dbraw/zinc/26/11/76/1433261176.db2.gz SLRALUYXZLWZOD-AWEZNQCLSA-N 0 0 385.424 3.018 20 5 GGBDRN O=C(c1ccc(F)cc1)C1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000194912220 1433263100 /nfs/dbraw/zinc/26/31/00/1433263100.db2.gz ONSXLUAYYXUFGV-UHFFFAOYSA-N 0 0 396.378 3.345 20 5 GGBDRN COC(=O)c1cccc(NC2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)c1 ZINC000194914326 1433263927 /nfs/dbraw/zinc/26/39/27/1433263927.db2.gz OBGJPDQJUXHDLT-UHFFFAOYSA-N 0 0 397.431 3.407 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCCOc1ccc(F)cc1F ZINC000194922704 1433265091 /nfs/dbraw/zinc/26/50/91/1433265091.db2.gz LLYGSLVDAODBQQ-UHFFFAOYSA-N 0 0 380.347 3.357 20 5 GGBDRN CN(CC(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000194930065 1433266791 /nfs/dbraw/zinc/26/67/91/1433266791.db2.gz OZGPGPYDGPQSJX-UHFFFAOYSA-N 0 0 399.422 3.292 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn(Cc2ccccn2)c1 ZINC000194934419 1433267823 /nfs/dbraw/zinc/26/78/23/1433267823.db2.gz DAEWWUDBHPHBGY-ZDUSSCGKSA-N 0 0 383.433 3.354 20 5 GGBDRN Cc1cc(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)c(N)c([N+](=O)[O-])c1 ZINC000194946179 1433270466 /nfs/dbraw/zinc/27/04/66/1433270466.db2.gz MWXBCWZAQPWVAZ-UHFFFAOYSA-N 0 0 385.395 3.360 20 5 GGBDRN Cc1cc(C)c(N2C[C@@H](C(=O)NCc3cccc([N+](=O)[O-])c3)CC2=O)c(C)c1 ZINC000194954268 1433272077 /nfs/dbraw/zinc/27/20/77/1433272077.db2.gz IOCVLAFJDWOIGR-KRWDZBQOSA-N 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COc1cc(CNc2nc3ccccn3n2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000195011323 1433280698 /nfs/dbraw/zinc/28/06/98/1433280698.db2.gz NRRGGWRQWKHOAP-UHFFFAOYSA-N 0 0 397.313 3.199 20 5 GGBDRN Cn1cc(-c2nnc(NCc3csc(-c4cccc([N+](=O)[O-])c4)n3)o2)cn1 ZINC000195019639 1433281582 /nfs/dbraw/zinc/28/15/82/1433281582.db2.gz YVOLDZSTVKYFOD-UHFFFAOYSA-N 0 0 383.393 3.114 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2nc3ccccc3s2)CC1 ZINC000195022304 1433281927 /nfs/dbraw/zinc/28/19/27/1433281927.db2.gz GXLHLQGFFUAPCP-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN Cn1ccnc1-c1nnc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000195028456 1433282828 /nfs/dbraw/zinc/28/28/28/1433282828.db2.gz OMMGYLLBCIAISO-UHFFFAOYSA-N 0 0 383.393 3.114 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1nccs1)c1ccccc1 ZINC000195036149 1433284092 /nfs/dbraw/zinc/28/40/92/1433284092.db2.gz XVGLSZWWYAQYCE-SFHVURJKSA-N 0 0 398.444 3.378 20 5 GGBDRN COc1cc(NC(=O)CCn2cc([N+](=O)[O-])c(C3CC3)n2)c(OC)cc1Cl ZINC000195041860 1433284562 /nfs/dbraw/zinc/28/45/62/1433284562.db2.gz LKDVZIAZQUVLGJ-UHFFFAOYSA-N 0 0 394.815 3.368 20 5 GGBDRN COc1ccc(NC(=O)CN[C@H](c2nccs2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000195046413 1433285128 /nfs/dbraw/zinc/28/51/28/1433285128.db2.gz FULPQACPNGJAPF-SFHVURJKSA-N 0 0 398.444 3.378 20 5 GGBDRN CCOc1ccc([C@@H]2CCCN2C(=O)Cn2cc([N+](=O)[O-])c(C3CC3)n2)cc1 ZINC000195053154 1433285871 /nfs/dbraw/zinc/28/58/71/1433285871.db2.gz YEMWGSIDFMGYFD-KRWDZBQOSA-N 0 0 384.436 3.431 20 5 GGBDRN CCc1ccc(NC(=O)c2nnc(Cn3cc([N+](=O)[O-])c(C4CC4)n3)s2)cc1 ZINC000195054254 1433286136 /nfs/dbraw/zinc/28/61/36/1433286136.db2.gz ZGKRQRQJHIYJCF-UHFFFAOYSA-N 0 0 398.448 3.383 20 5 GGBDRN Cc1ccc(NC(=O)c2nnc(Cn3cc([N+](=O)[O-])c(C4CC4)n3)s2)cc1 ZINC000195057399 1433286303 /nfs/dbraw/zinc/28/63/03/1433286303.db2.gz PCCHONAAJLLIKO-UHFFFAOYSA-N 0 0 384.421 3.129 20 5 GGBDRN COc1cccc(C2CCN(C(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000195056906 1433286414 /nfs/dbraw/zinc/28/64/14/1433286414.db2.gz OCMXQJNAPJWJOA-UHFFFAOYSA-N 0 0 397.431 3.257 20 5 GGBDRN CN(C(=O)CN[C@H](c1nccs1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000195059140 1433286599 /nfs/dbraw/zinc/28/65/99/1433286599.db2.gz SSDSSZZYQSZTTR-SFHVURJKSA-N 0 0 382.445 3.393 20 5 GGBDRN COc1cc(CCNC(=O)[C@H](C)Cc2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000195073901 1433289015 /nfs/dbraw/zinc/28/90/15/1433289015.db2.gz MLXHFJJMNQJJLP-CYBMUJFWSA-N 0 0 390.411 3.289 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H](C)Cc2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000195073888 1433289077 /nfs/dbraw/zinc/28/90/77/1433289077.db2.gz MLXHFJJMNQJJLP-ZDUSSCGKSA-N 0 0 390.411 3.289 20 5 GGBDRN Cc1cccc(C(=O)NCc2ccc(C(=O)Nc3ccncc3)cc2)c1[N+](=O)[O-] ZINC000195118886 1433294871 /nfs/dbraw/zinc/29/48/71/1433294871.db2.gz WBYLGGSIDYAEDP-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000195129481 1433296542 /nfs/dbraw/zinc/29/65/42/1433296542.db2.gz PPZCDGJLZCQUHL-QGZVFWFLSA-N 0 0 399.447 3.354 20 5 GGBDRN COc1ccc(CNc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000195135721 1433297602 /nfs/dbraw/zinc/29/76/02/1433297602.db2.gz RYLYVPPLOBPVOM-GJZGRUSLSA-N 0 0 399.447 3.465 20 5 GGBDRN C[C@@H]1CCCN(Cc2csc(NC(=O)c3cc([N+](=O)[O-])ccc3N)n2)C1 ZINC000195180422 1433303598 /nfs/dbraw/zinc/30/35/98/1433303598.db2.gz SNINBRHGVKMCSZ-LLVKDONJSA-N 0 0 375.454 3.118 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1 ZINC000195184767 1433304187 /nfs/dbraw/zinc/30/41/87/1433304187.db2.gz WLDYXVONFSDDTG-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000195218426 1433308321 /nfs/dbraw/zinc/30/83/21/1433308321.db2.gz UECGKKIHLDRKRF-DZGCQCFKSA-N 0 0 388.468 3.001 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1 ZINC000195215918 1433308371 /nfs/dbraw/zinc/30/83/71/1433308371.db2.gz PCCXXFUGUOMVNX-UHFFFAOYSA-N 0 0 396.428 3.007 20 5 GGBDRN COc1ccc(CC[C@H](C)NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 ZINC000195233308 1433310118 /nfs/dbraw/zinc/31/01/18/1433310118.db2.gz GHFDGVRXWQLEKG-LBPRGKRZSA-N 0 0 382.413 3.042 20 5 GGBDRN CCCOc1cc(NC(=O)Cc2cnn(C)c2)c([N+](=O)[O-])cc1OCCC ZINC000195245001 1433311525 /nfs/dbraw/zinc/31/15/25/1433311525.db2.gz LZZCXYFZJYQPGQ-UHFFFAOYSA-N 0 0 376.413 3.087 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000195269497 1433313934 /nfs/dbraw/zinc/31/39/34/1433313934.db2.gz OCHXSTSFGZEXRT-UHFFFAOYSA-N 0 0 384.436 3.025 20 5 GGBDRN Cc1cccnc1C(F)(F)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000195318920 1433318634 /nfs/dbraw/zinc/31/86/34/1433318634.db2.gz SLCBJTKSCFNYLW-UHFFFAOYSA-N 0 0 379.319 3.190 20 5 GGBDRN COc1cccc(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)c1[N+](=O)[O-] ZINC000195321821 1433318870 /nfs/dbraw/zinc/31/88/70/1433318870.db2.gz VUYGAVGBJSEISW-OAHLLOKOSA-N 0 0 377.828 3.290 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000195336193 1433320271 /nfs/dbraw/zinc/32/02/71/1433320271.db2.gz XQLVDFVYALLLJZ-UHFFFAOYSA-N 0 0 381.839 3.234 20 5 GGBDRN CN(CC1CCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000195342320 1433320712 /nfs/dbraw/zinc/32/07/12/1433320712.db2.gz ADFMKOBWPKNBFZ-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](c1ccccc1Cl)N1CCOCC1 ZINC000195348133 1433321378 /nfs/dbraw/zinc/32/13/78/1433321378.db2.gz QKVCLRGYXRKERQ-MRXNPFEDSA-N 0 0 393.875 3.258 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](c1ccccc1Cl)N1CCOCC1 ZINC000195348125 1433321386 /nfs/dbraw/zinc/32/13/86/1433321386.db2.gz QKVCLRGYXRKERQ-INIZCTEOSA-N 0 0 393.875 3.258 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(F)ccc1OCC(F)(F)F ZINC000195349622 1433321665 /nfs/dbraw/zinc/32/16/65/1433321665.db2.gz YQFYXQJKFJOPKA-UHFFFAOYSA-N 0 0 390.293 3.209 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000195356638 1433322105 /nfs/dbraw/zinc/32/21/05/1433322105.db2.gz REBBPDLFAOQDDJ-LBPRGKRZSA-N 0 0 388.449 3.014 20 5 GGBDRN Cc1c(C(=O)NCc2ccccc2-n2cccn2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195361410 1433322658 /nfs/dbraw/zinc/32/26/58/1433322658.db2.gz CXWVLXFCLGDQQG-UHFFFAOYSA-N 0 0 395.375 3.236 20 5 GGBDRN CC[C@@H](C)NC(=O)CCNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000195372220 1433323334 /nfs/dbraw/zinc/32/33/34/1433323334.db2.gz OVQYBCBZEJMEHH-OAHLLOKOSA-N 0 0 399.447 3.208 20 5 GGBDRN Cn1cc(NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])ccc1=O ZINC000195371834 1433323348 /nfs/dbraw/zinc/32/33/48/1433323348.db2.gz ZNCMISLBSXCCSA-UHFFFAOYSA-N 0 0 379.372 3.125 20 5 GGBDRN CC[C@H](C)NC(=O)CCNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000195372227 1433323635 /nfs/dbraw/zinc/32/36/35/1433323635.db2.gz OVQYBCBZEJMEHH-HNNXBMFYSA-N 0 0 399.447 3.208 20 5 GGBDRN CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000195379861 1433324140 /nfs/dbraw/zinc/32/41/40/1433324140.db2.gz WZPBGKRNEMPKLT-GWCFXTLKSA-N 0 0 393.490 3.239 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(OC)c(OCC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000195417263 1433327603 /nfs/dbraw/zinc/32/76/03/1433327603.db2.gz UIGKJGQFYAJNBT-UHFFFAOYSA-N 0 0 388.302 3.082 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)c1[N+](=O)[O-] ZINC000195425612 1433328284 /nfs/dbraw/zinc/32/82/84/1433328284.db2.gz BCMOGPAPWUUHKC-UHFFFAOYSA-N 0 0 392.265 3.335 20 5 GGBDRN COc1ccc(C)cc1S(=O)(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000195425875 1433328307 /nfs/dbraw/zinc/32/83/07/1433328307.db2.gz FVCHNECWRHNEOM-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN COc1ccc(C)cc1S(=O)(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000195429069 1433328505 /nfs/dbraw/zinc/32/85/05/1433328505.db2.gz XMPIWKZPWMVFFB-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN COc1cccc(C(=O)NCc2ccc(N3CCC(C)CC3)nc2)c1[N+](=O)[O-] ZINC000195430208 1433328762 /nfs/dbraw/zinc/32/87/62/1433328762.db2.gz DSYYJCJUGVOWNC-UHFFFAOYSA-N 0 0 384.436 3.165 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cccc(C(=O)N(C)c3ccccc3)c2)c1[N+](=O)[O-] ZINC000195437725 1433329519 /nfs/dbraw/zinc/32/95/19/1433329519.db2.gz WWITZLOMJWIEGW-UHFFFAOYSA-N 0 0 393.403 3.409 20 5 GGBDRN COc1ccc(CN(c2ccncc2)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000195442024 1433330156 /nfs/dbraw/zinc/33/01/56/1433330156.db2.gz REVPVJGGLGXJFS-UHFFFAOYSA-N 0 0 399.428 3.394 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c1[N+](=O)[O-] ZINC000195443860 1433330435 /nfs/dbraw/zinc/33/04/35/1433330435.db2.gz NAYJUSAPYQMRER-UHFFFAOYSA-N 0 0 385.424 3.005 20 5 GGBDRN O=C(Nc1ccnc2ccnn21)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000195451022 1433331277 /nfs/dbraw/zinc/33/12/77/1433331277.db2.gz ACXCNGXFHPXTSY-UHFFFAOYSA-N 0 0 389.371 3.469 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1cccc(CN2CCCCC2=O)c1 ZINC000195455591 1433331825 /nfs/dbraw/zinc/33/18/25/1433331825.db2.gz BTLCNWAXVIEUJS-UHFFFAOYSA-N 0 0 382.420 3.429 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000195461014 1433332649 /nfs/dbraw/zinc/33/26/49/1433332649.db2.gz ZIXPFIRZICQPBP-ZIAGYGMSSA-N 0 0 395.887 3.491 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccccc1N1CCOCC1 ZINC000195461048 1433332652 /nfs/dbraw/zinc/33/26/52/1433332652.db2.gz VEVXXIGSXPTLLE-UHFFFAOYSA-N 0 0 389.839 3.357 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000195467865 1433333793 /nfs/dbraw/zinc/33/37/93/1433333793.db2.gz XPHYYJDFPCRIKJ-SFHVURJKSA-N 0 0 396.447 3.386 20 5 GGBDRN Cc1c(NC(=O)NCc2cccc([N+](=O)[O-])c2)cccc1C(=O)N1CCCC1 ZINC000195471563 1433334246 /nfs/dbraw/zinc/33/42/46/1433334246.db2.gz USTBDRVDWRUULB-UHFFFAOYSA-N 0 0 382.420 3.461 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCC(OC2CCCC2)CC1 ZINC000195476733 1433334655 /nfs/dbraw/zinc/33/46/55/1433334655.db2.gz XFLKFNAIDVQRNR-UHFFFAOYSA-N 0 0 398.463 3.200 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1noc2ccccc21 ZINC000195475135 1433334673 /nfs/dbraw/zinc/33/46/73/1433334673.db2.gz JYKVLPDUGLHDDS-UHFFFAOYSA-N 0 0 375.406 3.482 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(SC(F)F)cc1 ZINC000195482358 1433335368 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ZINC000247312054 1433704008 /nfs/dbraw/zinc/70/40/08/1433704008.db2.gz IRRGDDCMGZZWRI-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CC[C@@]4(CCOC4)C3)cc2[N+](=O)[O-])C1 ZINC000247313745 1433704209 /nfs/dbraw/zinc/70/42/09/1433704209.db2.gz MBCNJGQPVYOWAV-WHSLLNHNSA-N 0 0 387.480 3.330 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1c2c(nc3ccccc31)CCC2 ZINC000247310502 1433704406 /nfs/dbraw/zinc/70/44/06/1433704406.db2.gz IHZRGOOOLPOYPG-UHFFFAOYSA-N 0 0 376.416 3.474 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000247320738 1433706209 /nfs/dbraw/zinc/70/62/09/1433706209.db2.gz ICDMQVZHXKZNAZ-CKEIUWERSA-N 0 0 395.415 3.296 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000247335447 1433709163 /nfs/dbraw/zinc/70/91/63/1433709163.db2.gz VXDBCCHGASECCK-GJZGRUSLSA-N 0 0 396.451 3.394 20 5 GGBDRN C[C@@H]1CN(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)[C@H]1c1ccccc1 ZINC000247391348 1433716137 /nfs/dbraw/zinc/71/61/37/1433716137.db2.gz GSGUSBJMLBYIKQ-CFCCAZDESA-N 0 0 394.431 3.012 20 5 GGBDRN C[C@@H]1CN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)[C@@H](c2ccccc2)CO1 ZINC000247419568 1433719794 /nfs/dbraw/zinc/71/97/94/1433719794.db2.gz KCPAPBNWCVTFOJ-DNVCBOLYSA-N 0 0 379.420 3.273 20 5 GGBDRN C[C@H]1CN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)[C@@H](c2ccccc2)CO1 ZINC000247419576 1433719812 /nfs/dbraw/zinc/71/98/12/1433719812.db2.gz KCPAPBNWCVTFOJ-HNAYVOBHSA-N 0 0 379.420 3.273 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCC1(c2ccccc2)CCCC1 ZINC000247444079 1433723378 /nfs/dbraw/zinc/72/33/78/1433723378.db2.gz XYDSTYHTYIQHNX-UHFFFAOYSA-N 0 0 395.415 3.131 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000247496051 1433729650 /nfs/dbraw/zinc/72/96/50/1433729650.db2.gz WPFGHZWGSDTFQN-GXTWGEPZSA-N 0 0 380.422 3.358 20 5 GGBDRN CC[C@H](NC(=O)N[C@H]1CCO[C@@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000247513484 1433732098 /nfs/dbraw/zinc/73/20/98/1433732098.db2.gz NKEKDVQQDZTDDW-ZVZYQTTQSA-N 0 0 379.482 3.400 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC[C@H](C)[C@@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000247662279 1433744632 /nfs/dbraw/zinc/74/46/32/1433744632.db2.gz QCEKJCTXGIVJGE-ZBEGNZNMSA-N 0 0 398.872 3.025 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000247695060 1433746418 /nfs/dbraw/zinc/74/64/18/1433746418.db2.gz TVUCQKRXSIXSAZ-SWLSCSKDSA-N 0 0 380.422 3.358 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000247731002 1433748489 /nfs/dbraw/zinc/74/84/89/1433748489.db2.gz VDUSXKMUZHRALB-PBFPGSCMSA-N 0 0 391.859 3.355 20 5 GGBDRN COc1cc(OCC(=O)OCc2csc(C(C)(C)C)n2)ccc1[N+](=O)[O-] ZINC000247815427 1433752574 /nfs/dbraw/zinc/75/25/74/1433752574.db2.gz AYZLSASSAURTMO-UHFFFAOYSA-N 0 0 380.422 3.480 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2n[nH]c(C(F)(F)F)n2)CC1 ZINC000247818047 1433752583 /nfs/dbraw/zinc/75/25/83/1433752583.db2.gz FHAKLSKDLWRNJK-UHFFFAOYSA-N 0 0 398.345 3.220 20 5 GGBDRN COc1ccc(CNC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)cc1OC ZINC000247896059 1433755600 /nfs/dbraw/zinc/75/56/00/1433755600.db2.gz OQWRJZZJHFJAIK-LLVKDONJSA-N 0 0 394.811 3.349 20 5 GGBDRN CC(=O)Nc1ccc(CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000247972969 1433760231 /nfs/dbraw/zinc/76/02/31/1433760231.db2.gz YXJLCXZWZZYUDQ-UHFFFAOYSA-N 0 0 393.403 3.229 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)C2CC2)cc1 ZINC000247987086 1433761504 /nfs/dbraw/zinc/76/15/04/1433761504.db2.gz KHYPWNYFNJZIPD-GOSISDBHSA-N 0 0 376.434 3.341 20 5 GGBDRN Cc1c(C(=O)N(C)[C@@H](C)c2ccc(F)cc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000248097115 1433769060 /nfs/dbraw/zinc/76/90/60/1433769060.db2.gz GXABYMGPENUDNL-LBPRGKRZSA-N 0 0 383.383 3.456 20 5 GGBDRN COc1ccc(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c(OC)c1 ZINC000248119168 1433770877 /nfs/dbraw/zinc/77/08/77/1433770877.db2.gz CWMDLIMDPBINCY-UHFFFAOYSA-N 0 0 399.447 3.145 20 5 GGBDRN Cn1ccnc1Sc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000248118865 1433770880 /nfs/dbraw/zinc/77/08/80/1433770880.db2.gz JMMRGVAUKTYGEF-UHFFFAOYSA-N 0 0 384.417 3.497 20 5 GGBDRN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000248130740 1433772238 /nfs/dbraw/zinc/77/22/38/1433772238.db2.gz QFVFKRVPWCHXCA-SNVBAGLBSA-N 0 0 391.330 3.001 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCCN(C(=O)c2cccc(C)c2)CC1 ZINC000248148057 1433774990 /nfs/dbraw/zinc/77/49/90/1433774990.db2.gz IJTSUAVCIHFOQD-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN CC(=O)N[C@@H](C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1)C(C)C ZINC000248206231 1433780139 /nfs/dbraw/zinc/78/01/39/1433780139.db2.gz BBZZTPJZWREBAG-OAHLLOKOSA-N 0 0 376.438 3.126 20 5 GGBDRN CCN(Cc1cccs1)C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000248239513 1433781828 /nfs/dbraw/zinc/78/18/28/1433781828.db2.gz GHOLYOGMBCATKO-GFCCVEGCSA-N 0 0 391.424 3.197 20 5 GGBDRN COc1ccc(-c2noc(CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)n2)cc1 ZINC000248243369 1433782435 /nfs/dbraw/zinc/78/24/35/1433782435.db2.gz KAUGPPQPCONXRO-UHFFFAOYSA-N 0 0 386.339 3.364 20 5 GGBDRN CCN(C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@H](C)c1cccc(OC)c1 ZINC000248248375 1433782829 /nfs/dbraw/zinc/78/28/29/1433782829.db2.gz NPGWYFBITDMFMA-CYBMUJFWSA-N 0 0 399.403 3.121 20 5 GGBDRN CC(C)C[C@H](NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000248252067 1433783502 /nfs/dbraw/zinc/78/35/02/1433783502.db2.gz JHNJYRYAFLEPNS-INIZCTEOSA-N 0 0 383.404 3.406 20 5 GGBDRN C[C@]1(O)CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)C1 ZINC000248343385 1433787218 /nfs/dbraw/zinc/78/72/18/1433787218.db2.gz KFXXQZUTEVMYJV-MJGOQNOKSA-N 0 0 389.839 3.385 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1 ZINC000248380246 1433790140 /nfs/dbraw/zinc/79/01/40/1433790140.db2.gz PKZWNPFLCQMXMK-UHFFFAOYSA-N 0 0 398.463 3.144 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000248384013 1433790954 /nfs/dbraw/zinc/79/09/54/1433790954.db2.gz CFMYNELAGFUPFJ-WFASDCNBSA-N 0 0 396.490 3.335 20 5 GGBDRN C[C@@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000248389583 1433793301 /nfs/dbraw/zinc/79/33/01/1433793301.db2.gz SMNDLIVDCGQRLX-DYEKYZERSA-N 0 0 379.844 3.015 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(CC(F)(F)F)[C@@H](C)C1 ZINC000248393371 1433794544 /nfs/dbraw/zinc/79/45/44/1433794544.db2.gz LPLXCQIOILIDRI-ZFWWWQNUSA-N 0 0 387.402 3.259 20 5 GGBDRN C[C@H](O)[C@H]1CCN(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000248415018 1433800897 /nfs/dbraw/zinc/80/08/97/1433800897.db2.gz NNYFJFIRDZERSM-DZKIICNBSA-N 0 0 384.436 3.006 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000248429359 1433802035 /nfs/dbraw/zinc/80/20/35/1433802035.db2.gz QHAFURPRJBAQCH-KXBFYZLASA-N 0 0 390.461 3.195 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N(C)C[C@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000248446824 1433803506 /nfs/dbraw/zinc/80/35/06/1433803506.db2.gz HAZXABKHDXQHHF-NWDGAFQWSA-N 0 0 378.454 3.122 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000248465369 1433805057 /nfs/dbraw/zinc/80/50/57/1433805057.db2.gz RPVAPFSDPANMAK-FVJLSDCUSA-N 0 0 386.448 3.105 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(C)C[C@@H](C)c1nccs1 ZINC000248465954 1433805129 /nfs/dbraw/zinc/80/51/29/1433805129.db2.gz RYYAOFUSFSOQEG-VXGBXAGGSA-N 0 0 378.454 3.122 20 5 GGBDRN O=C(c1ccc([O-])c([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248485508 1433805702 /nfs/dbraw/zinc/80/57/02/1433805702.db2.gz DZNJOEPCXPOREO-RBUKOAKNSA-N 0 0 395.459 3.427 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000248533880 1433807409 /nfs/dbraw/zinc/80/74/09/1433807409.db2.gz IWHQAOWWZRPHDS-YLJYHZDGSA-N 0 0 395.459 3.427 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000248548772 1433807895 /nfs/dbraw/zinc/80/78/95/1433807895.db2.gz FRXFPBMQTSNNIZ-RRFJBIMHSA-N 0 0 393.459 3.381 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000248548767 1433807954 /nfs/dbraw/zinc/80/79/54/1433807954.db2.gz FRXFPBMQTSNNIZ-RBSFLKMASA-N 0 0 393.459 3.381 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000248574555 1433809400 /nfs/dbraw/zinc/80/94/00/1433809400.db2.gz DHIGLWSIYQJFAW-GUYCJALGSA-N 0 0 375.450 3.324 20 5 GGBDRN C[C@@H]1CC[C@@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000248588159 1433810076 /nfs/dbraw/zinc/81/00/76/1433810076.db2.gz KILIOYYDDGFQID-YRGRVCCFSA-N 0 0 389.481 3.429 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000248619525 1433811764 /nfs/dbraw/zinc/81/17/64/1433811764.db2.gz ZUYXVVFRBIBAAA-RRFJBIMHSA-N 0 0 393.459 3.381 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)[C@@H]2CCCC[C@@H]21 ZINC000248647130 1433813556 /nfs/dbraw/zinc/81/35/56/1433813556.db2.gz PUYGIJUXVIQAAD-UMVBOHGHSA-N 0 0 375.450 3.342 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c1C ZINC000248665751 1433814469 /nfs/dbraw/zinc/81/44/69/1433814469.db2.gz WHVVIQIVVQPGCX-SJCJKPOMSA-N 0 0 375.450 3.378 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c1C ZINC000248692666 1433815531 /nfs/dbraw/zinc/81/55/31/1433815531.db2.gz YCBUGGHZLYVHKU-SJCJKPOMSA-N 0 0 375.450 3.378 20 5 GGBDRN O=C(N[C@@H]1C[C@H]2OCCC[C@@H]12)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000248737889 1433818868 /nfs/dbraw/zinc/81/88/68/1433818868.db2.gz PFSVRGKHQZJTII-ILZDJORESA-N 0 0 382.416 3.471 20 5 GGBDRN Cc1c(CS(=O)(=O)[C@H](C)C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000248889550 1433827993 /nfs/dbraw/zinc/82/79/93/1433827993.db2.gz WCBKTNQCNIRSCE-IARIHHJXSA-N 0 0 396.509 3.147 20 5 GGBDRN C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000249201308 1433838673 /nfs/dbraw/zinc/83/86/73/1433838673.db2.gz QXLALKOSZQVYLY-UHIISALHSA-N 0 0 397.378 3.314 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)c1[N+](=O)[O-] ZINC000249392044 1433842527 /nfs/dbraw/zinc/84/25/27/1433842527.db2.gz GCEMGBYJUHBNDO-DZGCQCFKSA-N 0 0 396.490 3.424 20 5 GGBDRN CCN(C[C@@H]1COc2ccccc2O1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000249501593 1433845212 /nfs/dbraw/zinc/84/52/12/1433845212.db2.gz ASXJTGAFJFOZIN-HUUCEWRRSA-N 0 0 385.420 3.084 20 5 GGBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000249550080 1433846856 /nfs/dbraw/zinc/84/68/56/1433846856.db2.gz HPIYRXUYPCRYAC-KZULUSFZSA-N 0 0 391.374 3.274 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000249601259 1433847808 /nfs/dbraw/zinc/84/78/08/1433847808.db2.gz YHTQRDIDXJHKEF-BEVDRBHNSA-N 0 0 383.448 3.286 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](c3ccccc3)OC[C@H]2C)c1[N+](=O)[O-] ZINC000249649176 1433848565 /nfs/dbraw/zinc/84/85/65/1433848565.db2.gz UCVNABCUJRXHFK-WBVHZDCISA-N 0 0 390.461 3.362 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000249697056 1433849210 /nfs/dbraw/zinc/84/92/10/1433849210.db2.gz UCPHIVGBUAUNJU-CYBMUJFWSA-N 0 0 395.419 3.117 20 5 GGBDRN Cc1noc([C@@H]2CCCN([C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)n1 ZINC000249706800 1433849284 /nfs/dbraw/zinc/84/92/84/1433849284.db2.gz OUYHWOUWPIEMRD-BXUZGUMPSA-N 0 0 384.396 3.277 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000251782843 1433860492 /nfs/dbraw/zinc/86/04/92/1433860492.db2.gz WGJPRCWMACOSIV-YWZLYKJASA-N 0 0 399.447 3.394 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@H]3OCCC[C@@H]23)cc1[N+](=O)[O-])c1ccccn1 ZINC000251947883 1433861874 /nfs/dbraw/zinc/86/18/74/1433861874.db2.gz VERPFGFRPOSWRA-JEOGCQQLSA-N 0 0 396.447 3.460 20 5 GGBDRN C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000252157780 1433862891 /nfs/dbraw/zinc/86/28/91/1433862891.db2.gz HMLKXAJJSKPJJG-NSHDSACASA-N 0 0 396.852 3.485 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)[C@H]1Oc1ccccc1 ZINC000253191037 1433865110 /nfs/dbraw/zinc/86/51/10/1433865110.db2.gz UEMBPMARUWJOPA-SFHLNBCPSA-N 0 0 384.432 3.269 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000253357958 1433866010 /nfs/dbraw/zinc/86/60/10/1433866010.db2.gz JSNIOCMHHHQIHT-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN COc1cc(OC)cc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000253478626 1433867821 /nfs/dbraw/zinc/86/78/21/1433867821.db2.gz MEAXCCYCMRGFFB-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN CCC1(CC)[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@H](C)[C@H]1OC ZINC000253556821 1433869290 /nfs/dbraw/zinc/86/92/90/1433869290.db2.gz RCQPQBPHLKFLPS-UZCIPKQKSA-N 0 0 387.436 3.418 20 5 GGBDRN Cc1c(C(=O)N[C@H](c2ccccc2)C2CC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000253599440 1433869935 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20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1OC ZINC000265132607 1434188781 /nfs/dbraw/zinc/18/87/81/1434188781.db2.gz MWTUZNUOHRVEOB-LLVKDONJSA-N 0 0 378.356 3.007 20 5 GGBDRN CC[C@@H](C(=O)N1CCC(Nc2c([N+](=O)[O-])c(C)nn2C)CC1)c1ccccc1 ZINC000265133082 1434188814 /nfs/dbraw/zinc/18/88/14/1434188814.db2.gz NPTHTCZYVQGVAH-QGZVFWFLSA-N 0 0 385.468 3.233 20 5 GGBDRN CC(C)(C)OC(=O)C1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000265149095 1434190658 /nfs/dbraw/zinc/19/06/58/1434190658.db2.gz PYZNLPOLPJJYDF-UHFFFAOYSA-N 0 0 391.468 3.367 20 5 GGBDRN COc1ccc([C@@H]2[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCC(=O)N2C)cc1 ZINC000265152995 1434190805 /nfs/dbraw/zinc/19/08/05/1434190805.db2.gz CZQPSZHUYPCLIS-YLJYHZDGSA-N 0 0 397.431 3.460 20 5 GGBDRN CC(C)NC(=O)c1ccc(N2CCN([C@@H](C)c3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC000265166387 1434192903 /nfs/dbraw/zinc/19/29/03/1434192903.db2.gz XPVSRSWWCAITHT-INIZCTEOSA-N 0 0 397.479 3.011 20 5 GGBDRN 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O=C(c1cc(NCc2cccc(-n3cncn3)c2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000265489715 1434238868 /nfs/dbraw/zinc/23/88/68/1434238868.db2.gz VSRXTIQIQRLSEY-UHFFFAOYSA-N 0 0 392.419 3.024 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)CNC(=O)OC(C)(C)C)c1 ZINC000265490456 1434239142 /nfs/dbraw/zinc/23/91/42/1434239142.db2.gz HQSGGKUKBGUABA-UHFFFAOYSA-N 0 0 383.470 3.350 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCCC[C@H]1c1ccco1 ZINC000265492963 1434239326 /nfs/dbraw/zinc/23/93/26/1434239326.db2.gz IKOBWJMOZNPIKO-AWEZNQCLSA-N 0 0 385.376 3.240 20 5 GGBDRN CNC(=O)c1ccc(Nc2ccc(CN(C(C)=O)C3CC3)cc2)c([N+](=O)[O-])c1 ZINC000265498578 1434239826 /nfs/dbraw/zinc/23/98/26/1434239826.db2.gz MHZFERYPRVPTEM-UHFFFAOYSA-N 0 0 382.420 3.209 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCCCC[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000265513335 1434240994 /nfs/dbraw/zinc/24/09/94/1434240994.db2.gz NHPPDUWDPWZXBZ-AWEZNQCLSA-N 0 0 392.433 3.349 20 5 GGBDRN CCOC(=O)c1ccnc(Sc2nnc(-c3ccoc3C)n2C)c1[N+](=O)[O-] ZINC000265530678 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376.482 3.471 20 5 GGBDRN CC[C@@H](C)[C@@H]1CCCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000265604276 1434249929 /nfs/dbraw/zinc/24/99/29/1434249929.db2.gz JBICFSZEKNUBSX-ZBFHGGJFSA-N 0 0 398.463 3.490 20 5 GGBDRN CC(C)n1c(CNC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])nc2ccccc21 ZINC000265608133 1434250066 /nfs/dbraw/zinc/25/00/66/1434250066.db2.gz NRJHNKVOPXTCNS-UHFFFAOYSA-N 0 0 396.403 3.033 20 5 GGBDRN CC[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1nnc2n1CCCCC2 ZINC000265620237 1434250905 /nfs/dbraw/zinc/25/09/05/1434250905.db2.gz ZNTXHMJXQQDSNV-HNNXBMFYSA-N 0 0 391.859 3.376 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3ccccc3OC)C2)cc([N+](=O)[O-])c1 ZINC000265645006 1434253084 /nfs/dbraw/zinc/25/30/84/1434253084.db2.gz ROYGMCCPDMFYOE-CQSZACIVSA-N 0 0 398.415 3.410 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000265651773 1434253567 /nfs/dbraw/zinc/25/35/67/1434253567.db2.gz UOCWUEZPENDKHU-ZDUSSCGKSA-N 0 0 386.404 3.250 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265693126 1434257274 /nfs/dbraw/zinc/25/72/74/1434257274.db2.gz AOEJPOIZHCAIMJ-UHFFFAOYSA-N 0 0 384.358 3.290 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000265718010 1434259824 /nfs/dbraw/zinc/25/98/24/1434259824.db2.gz ZIOIGNWURJSNHX-OAHLLOKOSA-N 0 0 385.420 3.311 20 5 GGBDRN CCNC(=O)COc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000265716754 1434259988 /nfs/dbraw/zinc/25/99/88/1434259988.db2.gz PZNBBFHHLYHALT-UHFFFAOYSA-N 0 0 385.420 3.026 20 5 GGBDRN CCc1ocnc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000265738967 1434261322 /nfs/dbraw/zinc/26/13/22/1434261322.db2.gz CNZURBOMYGCIBH-UHFFFAOYSA-N 0 0 398.341 3.126 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1[N+](=O)[O-] ZINC000265740165 1434261653 /nfs/dbraw/zinc/26/16/53/1434261653.db2.gz VLEGNOLPGYWNHU-OAHLLOKOSA-N 0 0 387.348 3.231 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1[N+](=O)[O-] ZINC000265740162 1434261673 /nfs/dbraw/zinc/26/16/73/1434261673.db2.gz VLEGNOLPGYWNHU-HNNXBMFYSA-N 0 0 387.348 3.231 20 5 GGBDRN COCCN(Cc1ccccn1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000265763322 1434263449 /nfs/dbraw/zinc/26/34/49/1434263449.db2.gz DIHZIFCODWKDTN-UHFFFAOYSA-N 0 0 386.452 3.171 20 5 GGBDRN O=C(NCc1cc(F)ccc1N1CCOCC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000265765268 1434263506 /nfs/dbraw/zinc/26/35/06/1434263506.db2.gz BOXZBCXUKDVSCL-UHFFFAOYSA-N 0 0 393.802 3.154 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)Nc1cccc(N2CCNC2=O)c1 ZINC000265779192 1434264538 /nfs/dbraw/zinc/26/45/38/1434264538.db2.gz NULAWXWRDVMVPH-UHFFFAOYSA-N 0 0 397.435 3.269 20 5 GGBDRN CC(=O)Nc1cccc(OCCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000265799168 1434266074 /nfs/dbraw/zinc/26/60/74/1434266074.db2.gz URZBVEGKSCVSPH-UHFFFAOYSA-N 0 0 385.420 3.026 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)cc([N+](=O)[O-])c1 ZINC000265807736 1434266755 /nfs/dbraw/zinc/26/67/55/1434266755.db2.gz OVYFNUMERUBEHF-UHFFFAOYSA-N 0 0 399.403 3.034 20 5 GGBDRN CC(C)(C(=O)N1CCC[C@@H](c2nnc3ccccn32)C1)c1ccc([N+](=O)[O-])cc1 ZINC000265811522 1434267343 /nfs/dbraw/zinc/26/73/43/1434267343.db2.gz PMFYQUKFNVZKTM-OAHLLOKOSA-N 0 0 393.447 3.321 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)Cc1ccc(S(C)(=O)=O)cc1 ZINC000265827156 1434269362 /nfs/dbraw/zinc/26/93/62/1434269362.db2.gz CFOFYLVUWQWTDD-UHFFFAOYSA-N 0 0 392.477 3.418 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000265829311 1434269651 /nfs/dbraw/zinc/26/96/51/1434269651.db2.gz SJOVIRQWKUDJSA-AWEZNQCLSA-N 0 0 391.468 3.246 20 5 GGBDRN CCCNC(=O)c1cccc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c1 ZINC000265831416 1434270023 /nfs/dbraw/zinc/27/00/23/1434270023.db2.gz CPGKIPMLUPVXNU-UHFFFAOYSA-N 0 0 399.403 3.148 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000265840911 1434271075 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BIRMLKWNQQILBI-UHFFFAOYSA-N 0 0 388.420 3.292 20 5 GGBDRN COc1cc(C(=O)N2CCCc3c(NC(C)=O)cccc32)cc([N+](=O)[O-])c1OC ZINC000265851312 1434272729 /nfs/dbraw/zinc/27/27/29/1434272729.db2.gz ARLCMXMCNPEGLK-UHFFFAOYSA-N 0 0 399.403 3.163 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2ccc(F)cc2OCC2CC2)c([N+](=O)[O-])c1 ZINC000265859136 1434273642 /nfs/dbraw/zinc/27/36/42/1434273642.db2.gz FVYFFBRRXUEVDS-UHFFFAOYSA-N 0 0 388.351 3.353 20 5 GGBDRN CCCN(C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000265863472 1434274591 /nfs/dbraw/zinc/27/45/91/1434274591.db2.gz MDBSXNOLJBKTSF-BMGDILEWSA-N 0 0 391.468 3.339 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2)cc([N+](=O)[O-])c1OC ZINC000265864486 1434274593 /nfs/dbraw/zinc/27/45/93/1434274593.db2.gz DSFVESLMGXRROY-UHFFFAOYSA-N 0 0 387.392 3.003 20 5 GGBDRN COc1ccc([C@H]2CCN(C(=O)c3cc(OC)c(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000265867138 1434275319 /nfs/dbraw/zinc/27/53/19/1434275319.db2.gz FMIIIHRQARZFJX-AWEZNQCLSA-N 0 0 386.404 3.250 20 5 GGBDRN 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ZINC000266006559 1434295764 /nfs/dbraw/zinc/29/57/64/1434295764.db2.gz RJCGBJSDZDPDJG-ZDUSSCGKSA-N 0 0 387.823 3.471 20 5 GGBDRN COC(=O)c1cnc(N(C(=O)c2cc(SC)ccc2[N+](=O)[O-])C2CC2)s1 ZINC000266010930 1434296094 /nfs/dbraw/zinc/29/60/94/1434296094.db2.gz CRRTXTDCMQOVGF-UHFFFAOYSA-N 0 0 393.446 3.369 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])cc1 ZINC000266010490 1434296099 /nfs/dbraw/zinc/29/60/99/1434296099.db2.gz UUUZDMAKNKISHR-AWEZNQCLSA-N 0 0 386.404 3.105 20 5 GGBDRN COC(=O)c1cnc(N(C(=O)CSc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000266013832 1434296274 /nfs/dbraw/zinc/29/62/74/1434296274.db2.gz DHOJYTUDFZJFTD-UHFFFAOYSA-N 0 0 393.446 3.126 20 5 GGBDRN CN(C)C(=O)C[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])c2ccc(Cl)cc21 ZINC000266014528 1434296541 /nfs/dbraw/zinc/29/65/41/1434296541.db2.gz UEISGCVLLZLLNG-GFCCVEGCSA-N 0 0 387.823 3.471 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)cc1OC ZINC000266027928 1434297957 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BLVPKBDHAMETLU-UHFFFAOYSA-N 0 0 381.454 3.276 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c1 ZINC000269310793 1434621539 /nfs/dbraw/zinc/62/15/39/1434621539.db2.gz AARSUQBLBGGCRW-LBPRGKRZSA-N 0 0 387.440 3.356 20 5 GGBDRN CCNC(=O)c1cc(Cl)ccc1NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000269324356 1434624215 /nfs/dbraw/zinc/62/42/15/1434624215.db2.gz CLFOOFCZSFWSFI-UHFFFAOYSA-N 0 0 379.804 3.097 20 5 GGBDRN CCC(CC)n1ccc(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)n1 ZINC000269329012 1434625309 /nfs/dbraw/zinc/62/53/09/1434625309.db2.gz HOSAFOGUGXFLNI-LJQANCHMSA-N 0 0 385.424 3.120 20 5 GGBDRN CCC(CC)n1ccc(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)n1 ZINC000269329011 1434625376 /nfs/dbraw/zinc/62/53/76/1434625376.db2.gz HOSAFOGUGXFLNI-IBGZPJMESA-N 0 0 385.424 3.120 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2nc(CN3CCC[C@@H](C)C3)cs2)c1[N+](=O)[O-] ZINC000269335202 1434626419 /nfs/dbraw/zinc/62/64/19/1434626419.db2.gz GNNNMZCIEBRCMW-LLVKDONJSA-N 0 0 392.485 3.382 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NC2(c3ccc(F)cc3)CCOCC2)c1[N+](=O)[O-] ZINC000269334109 1434626517 /nfs/dbraw/zinc/62/65/17/1434626517.db2.gz GCFDLNANKSALDG-UHFFFAOYSA-N 0 0 376.388 3.016 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H](O)c2cccc(F)c2)cc1SC ZINC000269339546 1434627188 /nfs/dbraw/zinc/62/71/88/1434627188.db2.gz FRDQAWDIUZRESC-BMLIUANNSA-N 0 0 394.424 3.316 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H](O)c2cccc(F)c2)cc1SC ZINC000269339549 1434627469 /nfs/dbraw/zinc/62/74/69/1434627469.db2.gz FRDQAWDIUZRESC-QGHHPUGFSA-N 0 0 394.424 3.316 20 5 GGBDRN Cc1cc(CNc2ccc([N+](=O)[O-])c(NCc3cc(C)no3)c2[N+](=O)[O-])on1 ZINC000269340868 1434627815 /nfs/dbraw/zinc/62/78/15/1434627815.db2.gz KJWRHLPESDECDW-UHFFFAOYSA-N 0 0 388.340 3.320 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000269346179 1434628614 /nfs/dbraw/zinc/62/86/14/1434628614.db2.gz FDEHUJVVRUDMCX-ZDUSSCGKSA-N 0 0 378.816 3.308 20 5 GGBDRN COc1ccc(CNc2nn3c(nnc3C(F)(F)F)c(C)c2C)cc1[N+](=O)[O-] ZINC000269347887 1434628855 /nfs/dbraw/zinc/62/88/55/1434628855.db2.gz DYEHPMAUEGCAOF-UHFFFAOYSA-N 0 0 396.329 3.289 20 5 GGBDRN Cn1ccnc1[C@H](O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000269347741 1434629094 /nfs/dbraw/zinc/62/90/94/1434629094.db2.gz IUCUHRPSLKTWTJ-XHDPSFHLSA-N 0 0 384.358 3.297 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C1(OCc2ccccc2)CCOCC1 ZINC000269355128 1434629929 /nfs/dbraw/zinc/62/99/29/1434629929.db2.gz PIAFEVFJEYZIAR-UHFFFAOYSA-N 0 0 386.404 3.308 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCc2ccnc(OCc3ccccc3)c2)c1[N+](=O)[O-] ZINC000269356746 1434630383 /nfs/dbraw/zinc/63/03/83/1434630383.db2.gz IBWIVQXTFQKSTM-UHFFFAOYSA-N 0 0 395.419 3.345 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000269367193 1434632066 /nfs/dbraw/zinc/63/20/66/1434632066.db2.gz KYOGMTMGRSNJKD-STQMWFEESA-N 0 0 387.440 3.307 20 5 GGBDRN COCCOc1ccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])cc1Cl 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/nfs/dbraw/zinc/64/31/25/1434643125.db2.gz XQXYFFMZUUDUQE-UHFFFAOYSA-N 0 0 396.407 3.419 20 5 GGBDRN COc1cc(CNc2ccc(OCC(C)(C)O)cc2)c([N+](=O)[O-])cc1OC ZINC000269442338 1434646744 /nfs/dbraw/zinc/64/67/44/1434646744.db2.gz JOCZSUOSOXEWKP-UHFFFAOYSA-N 0 0 376.409 3.374 20 5 GGBDRN Cc1nc(N2CCOCC2)ccc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000269452304 1434647788 /nfs/dbraw/zinc/64/77/88/1434647788.db2.gz LLXXWNJDIOAJJN-UHFFFAOYSA-N 0 0 376.800 3.041 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCCC2=O)cn1 ZINC000269453365 1434647939 /nfs/dbraw/zinc/64/79/39/1434647939.db2.gz HXSGXJJHHVQHKF-LBPRGKRZSA-N 0 0 386.433 3.236 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccccc2)C[C@H](O)c2ccco2)c1[N+](=O)[O-] ZINC000269453703 1434648300 /nfs/dbraw/zinc/64/83/00/1434648300.db2.gz GUXWMRNUBVMSKO-HNNXBMFYSA-N 0 0 398.419 3.410 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@@H](O)c1cccc(F)c1 ZINC000269457878 1434648596 /nfs/dbraw/zinc/64/85/96/1434648596.db2.gz VODXCCGAXJERTR-ORAYPTAESA-N 0 0 387.411 3.186 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@H](O)c1cccc(F)c1 ZINC000269457880 1434648656 /nfs/dbraw/zinc/64/86/56/1434648656.db2.gz VODXCCGAXJERTR-YJYMSZOUSA-N 0 0 387.411 3.186 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@@H](O)c1cccc(F)c1 ZINC000269457874 1434648718 /nfs/dbraw/zinc/64/87/18/1434648718.db2.gz VODXCCGAXJERTR-BFUOFWGJSA-N 0 0 387.411 3.186 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000269459274 1434649133 /nfs/dbraw/zinc/64/91/33/1434649133.db2.gz JBBWHSSYKNWQJU-QGZVFWFLSA-N 0 0 387.436 3.086 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000269462519 1434649345 /nfs/dbraw/zinc/64/93/45/1434649345.db2.gz SQHDOQCIBWRIBD-ZDUSSCGKSA-N 0 0 387.440 3.087 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000269467095 1434650258 /nfs/dbraw/zinc/65/02/58/1434650258.db2.gz UDFKRHSXCVPHFB-ZDUSSCGKSA-N 0 0 392.387 3.005 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1[N+](=O)[O-] ZINC000269477309 1434651132 /nfs/dbraw/zinc/65/11/32/1434651132.db2.gz VHSFVGCILOANMI-UHFFFAOYSA-N 0 0 390.400 3.436 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC[C@@H](OCCO)C1 ZINC000269492253 1434653562 /nfs/dbraw/zinc/65/35/62/1434653562.db2.gz MKQCBLXPDLNSQV-QGZVFWFLSA-N 0 0 386.404 3.001 20 5 GGBDRN COc1ccc(C(C)(C)CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1OC ZINC000269498445 1434654076 /nfs/dbraw/zinc/65/40/76/1434654076.db2.gz YRNPJFAYZPHSJD-UHFFFAOYSA-N 0 0 390.440 3.166 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)c1[N+](=O)[O-] ZINC000269503488 1434654534 /nfs/dbraw/zinc/65/45/34/1434654534.db2.gz NLLWPKDQFVWFFK-JTQLQIEISA-N 0 0 376.417 3.363 20 5 GGBDRN Cc1nc(N2CCOCC2)ccc1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000269521558 1434655998 /nfs/dbraw/zinc/65/59/98/1434655998.db2.gz ZDKIFOXAUDJPKX-UHFFFAOYSA-N 0 0 384.436 3.051 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)[C@H](O)c2cccc(F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000269531879 1434656829 /nfs/dbraw/zinc/65/68/29/1434656829.db2.gz IPVIGBJVGCERBP-DIFFPNOSSA-N 0 0 391.355 3.111 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)[C@H](O)c2cccc(F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000269531887 1434657177 /nfs/dbraw/zinc/65/71/77/1434657177.db2.gz IPVIGBJVGCERBP-GTNSWQLSSA-N 0 0 391.355 3.111 20 5 GGBDRN COCCCOc1cc(C)ccc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000269543696 1434658086 /nfs/dbraw/zinc/65/80/86/1434658086.db2.gz VVLFAHYPVYUCFN-UHFFFAOYSA-N 0 0 390.440 3.095 20 5 GGBDRN CC(C)(C(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000269554507 1434659080 /nfs/dbraw/zinc/65/90/80/1434659080.db2.gz OCKCMOGEUJHIIV-UHFFFAOYSA-N 0 0 390.461 3.098 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@H]2C[C@@H](O)c2cccs2)c1[N+](=O)[O-] ZINC000269554052 1434659129 /nfs/dbraw/zinc/65/91/29/1434659129.db2.gz YPJOYWKFSWZIGI-NWDGAFQWSA-N 0 0 378.454 3.231 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@@H](O)c2ccc(F)cc2)cc1SC ZINC000269579288 1434661006 /nfs/dbraw/zinc/66/10/06/1434661006.db2.gz RAPKXLKIIZRMHJ-DYZYQPBXSA-N 0 0 394.424 3.316 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@@H](O)c1c(F)cccc1F ZINC000269622156 1434664267 /nfs/dbraw/zinc/66/42/67/1434664267.db2.gz XRHRWKDYZHVLKL-CXAGYDPISA-N 0 0 380.347 3.124 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@H](O)c1c(F)cccc1F ZINC000269622163 1434664279 /nfs/dbraw/zinc/66/42/79/1434664279.db2.gz XRHRWKDYZHVLKL-GUYCJALGSA-N 0 0 380.347 3.124 20 5 GGBDRN Cc1c(CC(=O)N(C)Cc2nc([C@@H](C)OCC(C)C)no2)cccc1[N+](=O)[O-] ZINC000269632083 1434665309 /nfs/dbraw/zinc/66/53/09/1434665309.db2.gz UQZNGRPYYILHSZ-CQSZACIVSA-N 0 0 390.440 3.221 20 5 GGBDRN CSc1ccc(C(=O)c2ccccc2C(=O)N[C@H](C)CCO)cc1[N+](=O)[O-] ZINC000269666284 1434667834 /nfs/dbraw/zinc/66/78/34/1434667834.db2.gz JNKJLBBHRPUSHC-GFCCVEGCSA-N 0 0 388.445 3.048 20 5 GGBDRN COCCN(C(=O)Cc1cccc([N+](=O)[O-])c1C)c1ccc(OC)c(OC)c1 ZINC000269670007 1434668099 /nfs/dbraw/zinc/66/80/99/1434668099.db2.gz GFPZHKPWNJPCSM-UHFFFAOYSA-N 0 0 388.420 3.143 20 5 GGBDRN CC1(C2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)CC2)OCCO1 ZINC000269679683 1434668904 /nfs/dbraw/zinc/66/89/04/1434668904.db2.gz NTKOKEFDWBIIEG-UHFFFAOYSA-N 0 0 388.342 3.229 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC([C@H](O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000269726943 1434672261 /nfs/dbraw/zinc/67/22/61/1434672261.db2.gz QPZLEWIEKWEKRC-LJQANCHMSA-N 0 0 390.461 3.038 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000269739320 1434673115 /nfs/dbraw/zinc/67/31/15/1434673115.db2.gz UYYUPQRLJFHINR-CJNGLKHVSA-N 0 0 391.468 3.207 20 5 GGBDRN CC(=O)c1ccc(N[C@H](c2nc(-c3nc[nH]n3)no2)C(C)(C)C)c([N+](=O)[O-])c1 ZINC000269759132 1434674262 /nfs/dbraw/zinc/67/42/62/1434674262.db2.gz ZXGPYCKSCFMDQD-CYBMUJFWSA-N 0 0 385.384 3.165 20 5 GGBDRN CCC(CC)(CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])C(=O)OC ZINC000269786571 1434675388 /nfs/dbraw/zinc/67/53/88/1434675388.db2.gz CSFMDVGCLACJIB-UHFFFAOYSA-N 0 0 384.454 3.035 20 5 GGBDRN COc1cc(C(=O)Nc2cnccc2OC(C)(C)C)cc([N+](=O)[O-])c1OC ZINC000269821714 1434678656 /nfs/dbraw/zinc/67/86/56/1434678656.db2.gz VWZJMXGHJSOLPX-UHFFFAOYSA-N 0 0 375.381 3.437 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[C@H](O)c2cccs2)cc1OC ZINC000269825576 1434679198 /nfs/dbraw/zinc/67/91/98/1434679198.db2.gz KCDDKQHQUAASES-FZMZJTMJSA-N 0 0 394.449 3.306 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCOC[C@@H]1[C@H]1CCCCC1=O ZINC000269841940 1434680613 /nfs/dbraw/zinc/68/06/13/1434680613.db2.gz FDXQMBDZNGPFQQ-IAOVAPTHSA-N 0 0 392.477 3.062 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1cc2c(cc1Cl)OCCO2 ZINC000269842005 1434680641 /nfs/dbraw/zinc/68/06/41/1434680641.db2.gz FGDZZGKHNWBQHY-UHFFFAOYSA-N 0 0 398.824 3.004 20 5 GGBDRN O=Cc1ccc(OCC(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000269851239 1434681313 /nfs/dbraw/zinc/68/13/13/1434681313.db2.gz BUVXXUMDGGVHHG-WMZOPIPTSA-N 0 0 398.415 3.070 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@H](C)C[C@H](O)c2cccs2)cc([N+](=O)[O-])c1 ZINC000269853219 1434681412 /nfs/dbraw/zinc/68/14/12/1434681412.db2.gz RUIQUOZWBGUALT-ABAIWWIYSA-N 0 0 392.433 3.075 20 5 GGBDRN CCCOc1cc(NC(=O)N2CCC(CO)CC2)c([N+](=O)[O-])cc1OCCC ZINC000269877137 1434683682 /nfs/dbraw/zinc/68/36/82/1434683682.db2.gz WSTNXJKPWUJLIT-UHFFFAOYSA-N 0 0 395.456 3.409 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)Oc3ncccc32)cc1SC ZINC000269885534 1434684154 /nfs/dbraw/zinc/68/41/54/1434684154.db2.gz KHWWLPOETYVGAF-SNVBAGLBSA-N 0 0 375.406 3.148 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N[C@H]1CC[C@H](O)CC1 ZINC000269894585 1434684886 /nfs/dbraw/zinc/68/48/86/1434684886.db2.gz XMAFRNHBFRWMLE-CTYIDZIISA-N 0 0 391.449 3.111 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)CC(=O)c2cccs2)c([N+](=O)[O-])cc1OC ZINC000269921658 1434687022 /nfs/dbraw/zinc/68/70/22/1434687022.db2.gz USCALAXWGMGHDB-JTQLQIEISA-N 0 0 378.406 3.065 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cc1OC ZINC000269924203 1434687242 /nfs/dbraw/zinc/68/72/42/1434687242.db2.gz BMBBAZYTJVBXSQ-RZAIGCCYSA-N 0 0 390.436 3.080 20 5 GGBDRN COc1cc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc([N+](=O)[O-])c1OC ZINC000269958615 1434690021 /nfs/dbraw/zinc/69/00/21/1434690021.db2.gz RXNXEOQGCVZDDS-UHFFFAOYSA-N 0 0 387.348 3.113 20 5 GGBDRN Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000269998090 1434692318 /nfs/dbraw/zinc/69/23/18/1434692318.db2.gz LRQMVSOWCKKYRQ-UHFFFAOYSA-N 0 0 375.385 3.085 20 5 GGBDRN CCOc1cc(NC(=O)N(C)C[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])cc1OCC ZINC000269995352 1434692399 /nfs/dbraw/zinc/69/23/99/1434692399.db2.gz SRTBHWMZLNWRCA-DOMZBBRYSA-N 0 0 381.429 3.017 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1N1CCOC1=O)c1ccc([S@@](C)=O)cc1 ZINC000270017211 1434693613 /nfs/dbraw/zinc/69/36/13/1434693613.db2.gz CNOFFDRVGWZGBJ-KHXSAUHESA-N 0 0 389.433 3.462 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000270033098 1434694987 /nfs/dbraw/zinc/69/49/87/1434694987.db2.gz HMEVSCKBPQDSIX-KHXSAUHESA-N 0 0 387.461 3.398 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](C)c2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000270057892 1434697838 /nfs/dbraw/zinc/69/78/38/1434697838.db2.gz NZBNZEPFXPEVIN-QYOLQKOISA-N 0 0 377.422 3.077 20 5 GGBDRN Cc1nc2ccccc2n1C[C@H]1CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000270057971 1434697841 /nfs/dbraw/zinc/69/78/41/1434697841.db2.gz OBVKAXKBOXTNPB-OAHLLOKOSA-N 0 0 379.420 3.021 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](C)c2ccc([S@@](C)=O)cc2)c1[N+](=O)[O-] ZINC000270057895 1434697864 /nfs/dbraw/zinc/69/78/64/1434697864.db2.gz NZBNZEPFXPEVIN-RPHGYIDUSA-N 0 0 377.422 3.077 20 5 GGBDRN COc1cccc(OC)c1OC[C@@H](O)COc1cc(Cl)ccc1[N+](=O)[O-] ZINC000270071742 1434699242 /nfs/dbraw/zinc/69/92/42/1434699242.db2.gz FCGOCJPIQPEVTF-LBPRGKRZSA-N 0 0 383.784 3.084 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1csc([C@H]2CCCO2)n1 ZINC000270114524 1434704531 /nfs/dbraw/zinc/70/45/31/1434704531.db2.gz GRCBOPUYPZPYBO-CYBMUJFWSA-N 0 0 391.405 3.316 20 5 GGBDRN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000270116431 1434704813 /nfs/dbraw/zinc/70/48/13/1434704813.db2.gz NTAJUVGYNZPYRO-HNNXBMFYSA-N 0 0 379.420 3.140 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@H]2Cn2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000270118879 1434705142 /nfs/dbraw/zinc/70/51/42/1434705142.db2.gz LVIXVGLDYDPISL-HNNXBMFYSA-N 0 0 380.404 3.258 20 5 GGBDRN CC[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000270121978 1434705490 /nfs/dbraw/zinc/70/54/90/1434705490.db2.gz MIZHOEPYUYEHCZ-PZJWPPBQSA-N 0 0 393.447 3.222 20 5 GGBDRN CC[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000270141080 1434707135 /nfs/dbraw/zinc/70/71/35/1434707135.db2.gz PJBCAUXBWANSKP-IEBWSBKVSA-N 0 0 397.410 3.432 20 5 GGBDRN CCN(CC)C(=O)c1ccc(S(=O)(=O)Oc2cccc(C)c2[N+](=O)[O-])cc1 ZINC000270153877 1434707942 /nfs/dbraw/zinc/70/79/42/1434707942.db2.gz XMKYEQXKOMIMLO-UHFFFAOYSA-N 0 0 392.433 3.153 20 5 GGBDRN COc1cc(CN[C@H](C)c2ccc([S@@](C)=O)cc2)c([N+](=O)[O-])cc1OC ZINC000270161831 1434708434 /nfs/dbraw/zinc/70/84/34/1434708434.db2.gz UEAKRTRSFLZPBY-MZHQLVBMSA-N 0 0 378.450 3.200 20 5 GGBDRN C[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000270180349 1434710129 /nfs/dbraw/zinc/71/01/29/1434710129.db2.gz WSNRLOTWAHICNI-NRRJATNASA-N 0 0 375.450 3.012 20 5 GGBDRN CSc1ccc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000270201025 1434712086 /nfs/dbraw/zinc/71/20/86/1434712086.db2.gz JLYVORUBLCMFQP-ZDUSSCGKSA-N 0 0 390.417 3.024 20 5 GGBDRN CSc1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000270201022 1434712132 /nfs/dbraw/zinc/71/21/32/1434712132.db2.gz JLYVORUBLCMFQP-CYBMUJFWSA-N 0 0 390.417 3.024 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]2Cn2cnc3ccccc32)c1[N+](=O)[O-] ZINC000270224238 1434714717 /nfs/dbraw/zinc/71/47/17/1434714717.db2.gz PEUSXRDFEOPEAR-CYBMUJFWSA-N 0 0 382.424 3.096 20 5 GGBDRN COc1cccc(N2CC[C@H](NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)C2)c1 ZINC000270265284 1434717961 /nfs/dbraw/zinc/71/79/61/1434717961.db2.gz FGLXFRVYBJWSKD-HNNXBMFYSA-N 0 0 394.431 3.022 20 5 GGBDRN C[C@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 ZINC000270289692 1434720093 /nfs/dbraw/zinc/72/00/93/1434720093.db2.gz OULJITQIXFUWJJ-AWEZNQCLSA-N 0 0 398.419 3.154 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000270299537 1434720944 /nfs/dbraw/zinc/72/09/44/1434720944.db2.gz YUKYEVSDLDRSDF-CQSZACIVSA-N 0 0 377.441 3.248 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1ccc(N2CCCCC2)nc1 ZINC000270303669 1434721385 /nfs/dbraw/zinc/72/13/85/1434721385.db2.gz SPWJLLXZUWVZPI-UHFFFAOYSA-N 0 0 383.452 3.022 20 5 GGBDRN Cc1c(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)cnn1CCO[C@H]1CCCCO1 ZINC000270321819 1434723096 /nfs/dbraw/zinc/72/30/96/1434723096.db2.gz IRMJKDOGLVKPPW-KRWDZBQOSA-N 0 0 399.407 3.360 20 5 GGBDRN CC(C)(C)OC(=O)C1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000270326491 1434723518 /nfs/dbraw/zinc/72/35/18/1434723518.db2.gz LZVCPXBFFRKQBE-UHFFFAOYSA-N 0 0 387.436 3.199 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1ccc(CN2CCCC2=O)cc1 ZINC000270354924 1434725902 /nfs/dbraw/zinc/72/59/02/1434725902.db2.gz ALUVEUMJDFCBON-UHFFFAOYSA-N 0 0 382.420 3.081 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H]([C@@H]2CCCO2)C(F)(F)F)cc1OC ZINC000270366903 1434726961 /nfs/dbraw/zinc/72/69/61/1434726961.db2.gz RLQMHHCNCSUDIP-SMDDNHRTSA-N 0 0 393.314 3.269 20 5 GGBDRN CC(C)(O)COc1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000270387451 1434729174 /nfs/dbraw/zinc/72/91/74/1434729174.db2.gz RNUXIWUGTHZLJM-UHFFFAOYSA-N 0 0 383.404 3.407 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000270391299 1434729452 /nfs/dbraw/zinc/72/94/52/1434729452.db2.gz RWIHSZOYNHAWGM-UHFFFAOYSA-N 0 0 389.412 3.057 20 5 GGBDRN C[C@@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1nc(Cc2ccccc2)no1 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/nfs/dbraw/zinc/83/97/65/1434839765.db2.gz MMLXZXZQLKMKHS-OAHLLOKOSA-N 0 0 398.467 3.043 20 5 GGBDRN COc1ccccc1CC(=O)N1CCC(Nc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000271641499 1434841103 /nfs/dbraw/zinc/84/11/03/1434841103.db2.gz PWHCVLHIXHTADU-UHFFFAOYSA-N 0 0 387.411 3.388 20 5 GGBDRN CC(C)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCO1 ZINC000271655721 1434842290 /nfs/dbraw/zinc/84/22/90/1434842290.db2.gz ISISEMPIEQTDCX-GWCFXTLKSA-N 0 0 396.387 3.096 20 5 GGBDRN CC(=O)N1CCN(C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000271672143 1434843224 /nfs/dbraw/zinc/84/32/24/1434843224.db2.gz NERCTPAVIJOWIN-HNNXBMFYSA-N 0 0 388.468 3.232 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1COC2(CCCC2)O1 ZINC000271719077 1434846088 /nfs/dbraw/zinc/84/60/88/1434846088.db2.gz YXMSMFGJUYEIBG-QGZVFWFLSA-N 0 0 377.441 3.201 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCC2([C@@H](C)CCO)CCC2)cc1SC ZINC000271772390 1434849526 /nfs/dbraw/zinc/84/95/26/1434849526.db2.gz 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20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000271955018 1434861622 /nfs/dbraw/zinc/86/16/22/1434861622.db2.gz DYOXGDRLFJGUNR-LBPRGKRZSA-N 0 0 377.832 3.103 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CC[C@@H](c2ccccc2F)C1 ZINC000271963045 1434862112 /nfs/dbraw/zinc/86/21/12/1434862112.db2.gz LXROCDMHIJWNBU-OAHLLOKOSA-N 0 0 399.422 3.200 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CC[C@H](c2ccccc2F)C1 ZINC000271963044 1434862198 /nfs/dbraw/zinc/86/21/98/1434862198.db2.gz LXROCDMHIJWNBU-HNNXBMFYSA-N 0 0 399.422 3.200 20 5 GGBDRN Cc1csc2ncc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(=O)n12 ZINC000271986385 1434863687 /nfs/dbraw/zinc/86/36/87/1434863687.db2.gz PISIEKYBPPVWIF-UHFFFAOYSA-N 0 0 386.433 3.023 20 5 GGBDRN CC(C)CS(=O)(=O)N1CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000271995847 1434864481 /nfs/dbraw/zinc/86/44/81/1434864481.db2.gz ITQOJPREBQUHFY-UHFFFAOYSA-N 0 0 392.481 3.005 20 5 GGBDRN O=C(c1ccccc1)c1ccc(NC[C@H]2COC3(CCOCC3)O2)c([N+](=O)[O-])c1 ZINC000271997033 1434864658 /nfs/dbraw/zinc/86/46/58/1434864658.db2.gz IYUBRYIMKANMDY-KRWDZBQOSA-N 0 0 398.415 3.160 20 5 GGBDRN Cc1ccccc1[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000272040534 1434868103 /nfs/dbraw/zinc/86/81/03/1434868103.db2.gz YCISIBLDMUMQQZ-KRWDZBQOSA-N 0 0 395.459 3.370 20 5 GGBDRN CSc1ccc(N(C)C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000272046499 1434868497 /nfs/dbraw/zinc/86/84/97/1434868497.db2.gz YUSKLGXYRBTVCB-UHFFFAOYSA-N 0 0 387.461 3.430 20 5 GGBDRN CC(C)(C)[C@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H]1O ZINC000272081380 1434870752 /nfs/dbraw/zinc/87/07/52/1434870752.db2.gz JKGPUWYZWRXFEO-QFBILLFUSA-N 0 0 389.496 3.067 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CN(C)C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272085514 1434871103 /nfs/dbraw/zinc/87/11/03/1434871103.db2.gz GXBSXSODUCEBQZ-UHFFFAOYSA-N 0 0 391.374 3.401 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)CCO1 ZINC000272086295 1434871107 /nfs/dbraw/zinc/87/11/07/1434871107.db2.gz CCBUSVIHTJQJSB-GOEBONIOSA-N 0 0 380.441 3.326 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000272090106 1434871521 /nfs/dbraw/zinc/87/15/21/1434871521.db2.gz DAQJNIVNMUCGBC-BBRMVZONSA-N 0 0 378.425 3.080 20 5 GGBDRN O=C(Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)Nc1ccnn1C1CCCC1 ZINC000272130406 1434873910 /nfs/dbraw/zinc/87/39/10/1434873910.db2.gz WFYYLECIOODKPI-UHFFFAOYSA-N 0 0 380.408 3.409 20 5 GGBDRN CC(=O)N1CCc2cc(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000272143200 1434874469 /nfs/dbraw/zinc/87/44/69/1434874469.db2.gz KMQANWDUYNIIRM-UHFFFAOYSA-N 0 0 387.823 3.130 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCO[C@@H](CC(C)C)C2)cc1OC ZINC000272144411 1434874643 /nfs/dbraw/zinc/87/46/43/1434874643.db2.gz NDHBWGJMULPZJR-KBPBESRZSA-N 0 0 380.441 3.326 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCO[C@H](CC(C)C)C2)cc1OC ZINC000272144414 1434874684 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BTUDYTSXFZWRNO-ZBFHGGJFSA-N 0 0 391.468 3.289 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272193806 1434877281 /nfs/dbraw/zinc/87/72/81/1434877281.db2.gz BXVNXENSBFSQLO-JTQLQIEISA-N 0 0 380.832 3.498 20 5 GGBDRN COCC[C@@H](NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000272199411 1434877763 /nfs/dbraw/zinc/87/77/63/1434877763.db2.gz OFLKYNQDOPYEMT-CQSZACIVSA-N 0 0 377.397 3.082 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000272208093 1434878111 /nfs/dbraw/zinc/87/81/11/1434878111.db2.gz DZLPQQOYZQHTDP-NEPJUHHUSA-N 0 0 381.404 3.109 20 5 GGBDRN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272207978 1434878141 /nfs/dbraw/zinc/87/81/41/1434878141.db2.gz PRNOFVXHKZPQNN-UHFFFAOYSA-N 0 0 383.360 3.233 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000272208096 1434878217 /nfs/dbraw/zinc/87/82/17/1434878217.db2.gz DZLPQQOYZQHTDP-NWDGAFQWSA-N 0 0 381.404 3.109 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC(c3cc(C)n[nH]3)CC2)cc1SC ZINC000272224148 1434879250 /nfs/dbraw/zinc/87/92/50/1434879250.db2.gz LBAAXXAGXPQCGJ-UHFFFAOYSA-N 0 0 390.465 3.377 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1 ZINC000272224648 1434879330 /nfs/dbraw/zinc/87/93/30/1434879330.db2.gz COYHPNXROXPFTM-KBPBESRZSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1 ZINC000272224656 1434879361 /nfs/dbraw/zinc/87/93/61/1434879361.db2.gz COYHPNXROXPFTM-ZIAGYGMSSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](CCc2ccccc2)C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000272225603 1434879453 /nfs/dbraw/zinc/87/94/53/1434879453.db2.gz FGQSJMIYNHVGIV-OAHLLOKOSA-N 0 0 398.385 3.478 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 ZINC000272282981 1434884016 /nfs/dbraw/zinc/88/40/16/1434884016.db2.gz NBUOXRRWKBPYSL-GHMZBOCLSA-N 0 0 399.394 3.248 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC(C)(C)OC1(C)C ZINC000272295279 1434885198 /nfs/dbraw/zinc/88/51/98/1434885198.db2.gz MVCZZKCTZDEGDA-HNNXBMFYSA-N 0 0 382.482 3.409 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000272316389 1434886746 /nfs/dbraw/zinc/88/67/46/1434886746.db2.gz SQYMGOGKUAYOMG-RYUDHWBXSA-N 0 0 381.404 3.109 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCCOc3cc(F)ccc32)c([N+](=O)[O-])cc1OC ZINC000272322995 1434887158 /nfs/dbraw/zinc/88/71/58/1434887158.db2.gz WKOANDFTFITFGY-AWEZNQCLSA-N 0 0 390.367 3.395 20 5 GGBDRN Cc1cc(NC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)ccc1[N+](=O)[O-] ZINC000272321356 1434887223 /nfs/dbraw/zinc/88/72/23/1434887223.db2.gz WADYRYPMSUIZCU-UHFFFAOYSA-N 0 0 392.433 3.104 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000272332189 1434887802 /nfs/dbraw/zinc/88/78/02/1434887802.db2.gz LTMZJNNZNZRUGL-ZFWWWQNUSA-N 0 0 378.375 3.358 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC[C@H]2CC(=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000272349476 1434889444 /nfs/dbraw/zinc/88/94/44/1434889444.db2.gz YAAVUHHRGMSRPD-HNNXBMFYSA-N 0 0 388.445 3.240 20 5 GGBDRN CC(C)N1CCO[C@@H](c2noc(-c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)n2)C1 ZINC000272355327 1434889937 /nfs/dbraw/zinc/88/99/37/1434889937.db2.gz AUTWJFOWKIMKKY-CYBMUJFWSA-N 0 0 386.330 3.445 20 5 GGBDRN O=c1c(Cl)c(NCC[C@@H]2CCCCO2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000272394040 1434893315 /nfs/dbraw/zinc/89/33/15/1434893315.db2.gz IWJJYYPJMFLAHL-AWEZNQCLSA-N 0 0 378.816 3.165 20 5 GGBDRN COc1ccc(OC)c2c1CN(C(=O)Nc1ccc([N+](=O)[O-])c(C)c1)C[C@H]2O ZINC000272400333 1434893926 /nfs/dbraw/zinc/89/39/26/1434893926.db2.gz XILGERVNZDEFDQ-OAHLLOKOSA-N 0 0 387.392 3.002 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 ZINC000272415257 1434894678 /nfs/dbraw/zinc/89/46/78/1434894678.db2.gz GCSSDCUJHCCCJT-KGLIPLIRSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C1 ZINC000272415261 1434894702 /nfs/dbraw/zinc/89/47/02/1434894702.db2.gz GCSSDCUJHCCCJT-UONOGXRCSA-N 0 0 377.441 3.279 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000272423216 1434895355 /nfs/dbraw/zinc/89/53/55/1434895355.db2.gz OKOCIHWGAKECET-MNOVXSKESA-N 0 0 399.394 3.248 20 5 GGBDRN COCC[C@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000272424998 1434895424 /nfs/dbraw/zinc/89/54/24/1434895424.db2.gz FZGVXSYWZDRRDS-INIZCTEOSA-N 0 0 385.376 3.258 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC[C@H]1c1ncc[nH]1 ZINC000272443261 1434896664 /nfs/dbraw/zinc/89/66/64/1434896664.db2.gz FDBYQNZCXSVEQK-AWEZNQCLSA-N 0 0 377.832 3.451 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272449907 1434897248 /nfs/dbraw/zinc/89/72/48/1434897248.db2.gz CBGYSGFUPJNKFX-UHFFFAOYSA-N 0 0 397.422 3.184 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000272463779 1434897954 /nfs/dbraw/zinc/89/79/54/1434897954.db2.gz 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3.174 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCOCC2)C1 ZINC000272485733 1434899804 /nfs/dbraw/zinc/89/98/04/1434899804.db2.gz JXVRPBVHOPGMEN-UHFFFAOYSA-N 0 0 381.860 3.393 20 5 GGBDRN O=C(NCCCOCCOCc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000272488464 1434900025 /nfs/dbraw/zinc/90/00/25/1434900025.db2.gz FBOHYSICDZSNJX-UHFFFAOYSA-N 0 0 376.384 3.087 20 5 GGBDRN Cc1cc(C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)CC2)[nH]n1 ZINC000272496904 1434900561 /nfs/dbraw/zinc/90/05/61/1434900561.db2.gz NLHOZHNMEKDNKW-UHFFFAOYSA-N 0 0 380.351 3.248 20 5 GGBDRN Cn1ccnc1[C@H](NCCc1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000272497541 1434900763 /nfs/dbraw/zinc/90/07/63/1434900763.db2.gz GGFOOZHQHDLJCU-HXUWFJFHSA-N 0 0 394.431 3.021 20 5 GGBDRN COc1cc(CNc2ccc(CCO)cc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272506132 1434901464 /nfs/dbraw/zinc/90/14/64/1434901464.db2.gz WJKZKOMKKBBEIN-UHFFFAOYSA-N 0 0 382.363 3.394 20 5 GGBDRN Cn1ccnc1[C@H](N[C@@H]1CCO[C@@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272506291 1434901554 /nfs/dbraw/zinc/90/15/54/1434901554.db2.gz ICTJXWJXTPJJRN-SUMDDJOVSA-N 0 0 388.493 3.062 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC(OC2CCCCC2)CC1 ZINC000272513565 1434902770 /nfs/dbraw/zinc/90/27/70/1434902770.db2.gz YPRDWWZKHHWNNV-UHFFFAOYSA-N 0 0 376.409 3.277 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272516329 1434903083 /nfs/dbraw/zinc/90/30/83/1434903083.db2.gz NDMDKONNLOMJRV-UHFFFAOYSA-N 0 0 392.843 3.044 20 5 GGBDRN CO[C@H](C)c1nc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000272518980 1434903394 /nfs/dbraw/zinc/90/33/94/1434903394.db2.gz KVJSGYXJVXPVHB-MLGOLLRUSA-N 0 0 387.465 3.371 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCc3c(ncn3-c3ccccc3)C2)c2c(c1)COCO2 ZINC000272537490 1434905369 /nfs/dbraw/zinc/90/53/69/1434905369.db2.gz NHMNFZIWZJZQTI-UHFFFAOYSA-N 0 0 392.415 3.205 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272539084 1434905809 /nfs/dbraw/zinc/90/58/09/1434905809.db2.gz OREZZXNUUDISON-UYAOXDASSA-N 0 0 395.463 3.437 20 5 GGBDRN COc1ccc(OC)c(CCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272558466 1434907629 /nfs/dbraw/zinc/90/76/29/1434907629.db2.gz STMKWERYAKWIEI-HXUWFJFHSA-N 0 0 396.447 3.267 20 5 GGBDRN O=C1OCCN1c1cc([N+](=O)[O-])ccc1N1CC[C@H](COc2ccccc2)C1 ZINC000272566433 1434908473 /nfs/dbraw/zinc/90/84/73/1434908473.db2.gz WAOOCHLANDNUQE-HNNXBMFYSA-N 0 0 383.404 3.457 20 5 GGBDRN O=C1OCCN1c1cc([N+](=O)[O-])ccc1N1CC[C@@H](COc2ccccc2)C1 ZINC000272566436 1434908585 /nfs/dbraw/zinc/90/85/85/1434908585.db2.gz WAOOCHLANDNUQE-OAHLLOKOSA-N 0 0 383.404 3.457 20 5 GGBDRN Cn1ccnc1[C@@H](NCc1ccc(OCC2CC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000272575010 1434909456 /nfs/dbraw/zinc/90/94/56/1434909456.db2.gz WXMILOLHOIWUQQ-FQEVSTJZSA-N 0 0 393.447 3.391 20 5 GGBDRN COc1ccc(COCCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272580502 1434910247 /nfs/dbraw/zinc/91/02/47/1434910247.db2.gz XXYRAGXDOIQQOH-FQEVSTJZSA-N 0 0 396.447 3.233 20 5 GGBDRN COc1ccc2c(c1)OC[C@@H](N[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000272586754 1434911178 /nfs/dbraw/zinc/91/11/78/1434911178.db2.gz ZEYHNLFJAGEZNN-OXJNMPFZSA-N 0 0 394.431 3.020 20 5 GGBDRN O=C(c1cc2nsnc2c([N+](=O)[O-])c1)N1CCC([C@H](O)c2ccccc2)CC1 ZINC000272603103 1434913614 /nfs/dbraw/zinc/91/36/14/1434913614.db2.gz VGVZPEMHURPLRD-GOSISDBHSA-N 0 0 398.444 3.185 20 5 GGBDRN CC(C)N1CCO[C@@H](c2noc(CCOc3ccc(Cl)cc3[N+](=O)[O-])n2)C1 ZINC000272618428 1434915923 /nfs/dbraw/zinc/91/59/23/1434915923.db2.gz IJBMJIXVQVFKEY-OAHLLOKOSA-N 0 0 396.831 3.034 20 5 GGBDRN CC[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])[C@H](c1ccc(C)cc1)n1cncn1 ZINC000272638243 1434918447 /nfs/dbraw/zinc/91/84/47/1434918447.db2.gz BVUATMFNGWSIPX-YJBOKZPZSA-N 0 0 395.423 3.079 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000272652026 1434919699 /nfs/dbraw/zinc/91/96/99/1434919699.db2.gz FIQPOIXTUFHQRS-QWHCGFSZSA-N 0 0 393.444 3.147 20 5 GGBDRN CSc1nc(C)c(CCC(=O)OCc2ccc([N+](=O)[O-])c(C)c2)c(=O)[nH]1 ZINC000272662139 1434920810 /nfs/dbraw/zinc/92/08/10/1434920810.db2.gz HDTGVCCNNCULHS-UHFFFAOYSA-N 0 0 377.422 3.105 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cnc(N2CCCC[C@H]2C)c(C)c1 ZINC000272665031 1434920976 /nfs/dbraw/zinc/92/09/76/1434920976.db2.gz JFXZHCJRDSPKRW-CQSZACIVSA-N 0 0 386.456 3.211 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000272695935 1434923589 /nfs/dbraw/zinc/92/35/89/1434923589.db2.gz DJJQVCHRCJZLPH-UHFFFAOYSA-N 0 0 383.470 3.108 20 5 GGBDRN C[C@H](NC(=O)NCCCCNC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000272699643 1434924096 /nfs/dbraw/zinc/92/40/96/1434924096.db2.gz FIIOANANPXPANY-ZDUSSCGKSA-N 0 0 380.445 3.260 20 5 GGBDRN O=C(NCCCOCCOCc1ccccc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000272702100 1434924262 /nfs/dbraw/zinc/92/42/62/1434924262.db2.gz PVPVKRYDIMUZOS-UHFFFAOYSA-N 0 0 376.384 3.087 20 5 GGBDRN O=[N+]([O-])c1cccc(Cc2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)c1 ZINC000272707985 1434924670 /nfs/dbraw/zinc/92/46/70/1434924670.db2.gz XMCYHRDPRLXYSR-GOSISDBHSA-N 0 0 380.404 3.142 20 5 GGBDRN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000272731525 1434926657 /nfs/dbraw/zinc/92/66/57/1434926657.db2.gz PKDKOWBRKWVMKJ-AWEZNQCLSA-N 0 0 380.408 3.344 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000272739560 1434927061 /nfs/dbraw/zinc/92/70/61/1434927061.db2.gz LXEHTFJDIACDTA-UHFFFAOYSA-N 0 0 377.397 3.376 20 5 GGBDRN COc1cccc(CN(C[C@H]2CCCO2)C(=O)Nc2ccncc2[N+](=O)[O-])c1 ZINC000272744666 1434927681 /nfs/dbraw/zinc/92/76/81/1434927681.db2.gz RLWYOXDHVPZVIN-MRXNPFEDSA-N 0 0 386.408 3.212 20 5 GGBDRN Cc1ccnc(OC2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CC2)c1 ZINC000272753374 1434928102 /nfs/dbraw/zinc/92/81/02/1434928102.db2.gz AQQSDHAAHNPEBJ-UHFFFAOYSA-N 0 0 384.436 3.048 20 5 GGBDRN COc1ccc(NC(=O)N2CCN(c3nc(C)c(C)s3)CC2)cc1[N+](=O)[O-] ZINC000272760173 1434928810 /nfs/dbraw/zinc/92/88/10/1434928810.db2.gz AHBRZCLQHCDLQF-UHFFFAOYSA-N 0 0 391.453 3.031 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCCCNC(=O)OC(C)(C)C)c1 ZINC000272761369 1434929013 /nfs/dbraw/zinc/92/90/13/1434929013.db2.gz POPOZZHYLQAMOB-UHFFFAOYSA-N 0 0 383.470 3.351 20 5 GGBDRN COC[C@H](CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)OC ZINC000272766640 1434929565 /nfs/dbraw/zinc/92/95/65/1434929565.db2.gz WNUIKFVMVWJLKR-KRWDZBQOSA-N 0 0 375.381 3.170 20 5 GGBDRN COCCOc1cc(C)ccc1NC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000272773929 1434930139 /nfs/dbraw/zinc/93/01/39/1434930139.db2.gz QWROUYNSRCSBLR-LJQANCHMSA-N 0 0 399.403 3.060 20 5 GGBDRN O=C(NCCCOCCOCc1ccccc1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000272783357 1434930826 /nfs/dbraw/zinc/93/08/26/1434930826.db2.gz GEIHSADTTVHQJH-UHFFFAOYSA-N 0 0 394.374 3.226 20 5 GGBDRN COc1ccc(NC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)cc1[N+](=O)[O-] ZINC000272786274 1434930870 /nfs/dbraw/zinc/93/08/70/1434930870.db2.gz FUMLGOXDACIUSR-KRWDZBQOSA-N 0 0 389.408 3.246 20 5 GGBDRN COc1ccc(NC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)cc1[N+](=O)[O-] ZINC000272786280 1434930919 /nfs/dbraw/zinc/93/09/19/1434930919.db2.gz FUMLGOXDACIUSR-QGZVFWFLSA-N 0 0 389.408 3.246 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2ccc(C(=O)N3CCCC3)cc2)s1 ZINC000272795972 1434931632 /nfs/dbraw/zinc/93/16/32/1434931632.db2.gz DBBNMTZMMHPVNM-UHFFFAOYSA-N 0 0 396.446 3.088 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H](c2ccccc2C)C(C)C)cc1[N+](=O)[O-] ZINC000272810830 1434932662 /nfs/dbraw/zinc/93/26/62/1434932662.db2.gz BSIMJUFPWSKREL-GOSISDBHSA-N 0 0 385.420 3.364 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272813111 1434932912 /nfs/dbraw/zinc/93/29/12/1434932912.db2.gz JRWWWJLODAZKLA-KGLIPLIRSA-N 0 0 392.456 3.152 20 5 GGBDRN COc1ccc(CN(C)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000272830542 1434934533 /nfs/dbraw/zinc/93/45/33/1434934533.db2.gz MTVDQGQQROCXSP-UHFFFAOYSA-N 0 0 375.381 3.285 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2cccc(OC[C@@H]3CCCO3)c2)s1 ZINC000272851796 1434936148 /nfs/dbraw/zinc/93/61/48/1434936148.db2.gz OUYDSGBXJOHMDB-ZDUSSCGKSA-N 0 0 398.462 3.361 20 5 GGBDRN COc1ccc([C@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000272855085 1434936231 /nfs/dbraw/zinc/93/62/31/1434936231.db2.gz SQOARNNOVPLAEB-AWEZNQCLSA-N 0 0 386.330 3.483 20 5 GGBDRN Cc1cc(C)nc(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000272858524 1434936684 /nfs/dbraw/zinc/93/66/84/1434936684.db2.gz RNPHZTQGUMNMFF-UHFFFAOYSA-N 0 0 390.831 3.009 20 5 GGBDRN Cc1ccnc(OC2CCN(C(=O)c3cc(F)c(F)cc3[N+](=O)[O-])CC2)c1 ZINC000272866594 1434937317 /nfs/dbraw/zinc/93/73/17/1434937317.db2.gz YUECWXPZSJMTLQ-UHFFFAOYSA-N 0 0 377.347 3.260 20 5 GGBDRN COc1ccc(NC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000272868462 1434937512 /nfs/dbraw/zinc/93/75/12/1434937512.db2.gz UESSGMPMHGWNFX-INIZCTEOSA-N 0 0 398.419 3.089 20 5 GGBDRN COc1ccc(NC(=O)N2CCc3cc(OC)c(OC)cc3C2)cc1[N+](=O)[O-] ZINC000272881900 1434938479 /nfs/dbraw/zinc/93/84/79/1434938479.db2.gz WYHFUQNPQKHDEW-UHFFFAOYSA-N 0 0 387.392 3.211 20 5 GGBDRN CNC(=O)c1ccc(N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c([N+](=O)[O-])c1 ZINC000272887253 1434938605 /nfs/dbraw/zinc/93/86/05/1434938605.db2.gz INFZFFXCGJTUQI-LBPRGKRZSA-N 0 0 397.357 3.011 20 5 GGBDRN Cc1ccnc(OC2CCN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)c1 ZINC000272886956 1434938668 /nfs/dbraw/zinc/93/86/68/1434938668.db2.gz DGSSHHPWFBECBR-UHFFFAOYSA-N 0 0 395.419 3.392 20 5 GGBDRN CCCCCN(CCCOC)C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000272889326 1434938816 /nfs/dbraw/zinc/93/88/16/1434938816.db2.gz AOIFYLWMJOIFQJ-UHFFFAOYSA-N 0 0 399.875 3.033 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000272895523 1434939370 /nfs/dbraw/zinc/93/93/70/1434939370.db2.gz ZLMMEJYUDJBFJU-UHFFFAOYSA-N 0 0 392.456 3.152 20 5 GGBDRN COc1ccc(NC(=O)c2ccc(C[NH+]3CCC(CO)CC3)cc2)cc1[N+](=O)[O-] ZINC000272900406 1434939828 /nfs/dbraw/zinc/93/98/28/1434939828.db2.gz KGQITJTZKVQVKS-UHFFFAOYSA-N 0 0 399.447 3.060 20 5 GGBDRN O=C(Nc1ccc(NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1)C1CC1 ZINC000272903910 1434940006 /nfs/dbraw/zinc/94/00/06/1434940006.db2.gz KIQXAOTZZSCRHW-GOSISDBHSA-N 0 0 394.387 3.075 20 5 GGBDRN COc1cc(C(C)=O)ccc1SC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000272966272 1434945026 /nfs/dbraw/zinc/94/50/26/1434945026.db2.gz UJBAPNKBBVGSFZ-AWEZNQCLSA-N 0 0 377.418 3.338 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N(C)[C@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000272966879 1434945130 /nfs/dbraw/zinc/94/51/30/1434945130.db2.gz SLMIKJVULCRJMH-SFHVURJKSA-N 0 0 385.420 3.398 20 5 GGBDRN COc1cc(OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc(OC)c1OC ZINC000272985325 1434946879 /nfs/dbraw/zinc/94/68/79/1434946879.db2.gz VEXYPZYCSQNYHT-UHFFFAOYSA-N 0 0 377.349 3.066 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N[C@H]1CCOC2(CCCCC2)C1 ZINC000272990653 1434947400 /nfs/dbraw/zinc/94/74/00/1434947400.db2.gz SCIYTSCNVBQTKC-LBPRGKRZSA-N 0 0 395.843 3.185 20 5 GGBDRN CC(C)[C@@H]1C[C@@H](CC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000273028151 1434952363 /nfs/dbraw/zinc/95/23/63/1434952363.db2.gz XQMQPTQKNVVIGU-LPHOPBHVSA-N 0 0 375.469 3.085 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](C2(C)OCCO2)C1 ZINC000273057403 1434955876 /nfs/dbraw/zinc/95/58/76/1434955876.db2.gz AOEUTGOAOMCJFB-KBPBESRZSA-N 0 0 380.466 3.077 20 5 GGBDRN O=C(NCCCOCCO)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000273067569 1434957067 /nfs/dbraw/zinc/95/70/67/1434957067.db2.gz ZMBULCUOZKFSLR-UHFFFAOYSA-N 0 0 394.811 3.169 20 5 GGBDRN O=[N+]([O-])c1ccc(CNCc2ccnc(OC3CCOCC3)c2)c(Cl)c1 ZINC000273098423 1434960417 /nfs/dbraw/zinc/96/04/17/1434960417.db2.gz ODXFWZHVNNMBEI-UHFFFAOYSA-N 0 0 377.828 3.491 20 5 GGBDRN O=C(NC[C@@H](O)CCc1ccccc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000273109861 1434962117 /nfs/dbraw/zinc/96/21/17/1434962117.db2.gz AVNNXZIHMLRORA-AWEZNQCLSA-N 0 0 382.338 3.337 20 5 GGBDRN O=C(NC[C@H](O)CCc1ccccc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000273109866 1434962146 /nfs/dbraw/zinc/96/21/46/1434962146.db2.gz AVNNXZIHMLRORA-CQSZACIVSA-N 0 0 382.338 3.337 20 5 GGBDRN COCc1nsc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)n1 ZINC000273108676 1434962238 /nfs/dbraw/zinc/96/22/38/1434962238.db2.gz PVHGNXVRTNWALZ-UHFFFAOYSA-N 0 0 391.453 3.081 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(N(C)C)n1 ZINC000273114224 1434962676 /nfs/dbraw/zinc/96/26/76/1434962676.db2.gz OPJACJHSVHXIAL-UHFFFAOYSA-N 0 0 376.438 3.047 20 5 GGBDRN COc1cc(CN[C@H](CO)c2ccc(F)cc2)c([N+](=O)[O-])cc1OC(F)F ZINC000273130461 1434964610 /nfs/dbraw/zinc/96/46/10/1434964610.db2.gz RHMMUPBCNCRMEF-CYBMUJFWSA-N 0 0 386.326 3.167 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@H](O)CCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000273134792 1434965168 /nfs/dbraw/zinc/96/51/68/1434965168.db2.gz COCSYCLODXNZEX-UXHICEINSA-N 0 0 380.448 3.001 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273218031 1434973126 /nfs/dbraw/zinc/97/31/26/1434973126.db2.gz BLSUFCNOMJMMBS-HKUYNNGSSA-N 0 0 387.411 3.496 20 5 GGBDRN C[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)c(F)c1 ZINC000273226790 1434973747 /nfs/dbraw/zinc/97/37/47/1434973747.db2.gz VQBFLNDDZAXUFD-JTQLQIEISA-N 0 0 388.367 3.137 20 5 GGBDRN C[C@@]1(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCO[C@H]1C1CC1 ZINC000273239072 1434974536 /nfs/dbraw/zinc/97/45/36/1434974536.db2.gz FWDWCNMXSDKBBG-XZOQPEGZSA-N 0 0 376.456 3.229 20 5 GGBDRN C[C@]1(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCO[C@H]1C1CC1 ZINC000273239063 1434974570 /nfs/dbraw/zinc/97/45/70/1434974570.db2.gz FWDWCNMXSDKBBG-GOTSBHOMSA-N 0 0 376.456 3.229 20 5 GGBDRN Cn1c2ccccc2nc1[C@H]1CCCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000273248015 1434975472 /nfs/dbraw/zinc/97/54/72/1434975472.db2.gz YAIKPJKIENGPNP-DNVCBOLYSA-N 0 0 396.447 3.058 20 5 GGBDRN CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273257632 1434976159 /nfs/dbraw/zinc/97/61/59/1434976159.db2.gz FFMMHOIJIADBTI-VQIMIIECSA-N 0 0 388.395 3.491 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273265202 1434976439 /nfs/dbraw/zinc/97/64/39/1434976439.db2.gz AFXAHCALUARGTG-HNAYVOBHSA-N 0 0 387.411 3.450 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000273304090 1434979453 /nfs/dbraw/zinc/97/94/53/1434979453.db2.gz CIJWTBRMXMDPTE-XJKSGUPXSA-N 0 0 377.347 3.105 20 5 GGBDRN CN(CC(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000273320557 1434980605 /nfs/dbraw/zinc/98/06/05/1434980605.db2.gz RTYDZXAMHSMDSP-LPHOPBHVSA-N 0 0 387.411 3.207 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273346253 1434982197 /nfs/dbraw/zinc/98/21/97/1434982197.db2.gz BTJRGBUDCWDRBL-LBPRGKRZSA-N 0 0 376.392 3.318 20 5 GGBDRN CC1([C@@H]2CCCN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)OCCO1 ZINC000273351339 1434982624 /nfs/dbraw/zinc/98/26/24/1434982624.db2.gz BYPMCEIDXQDIJZ-GFCCVEGCSA-N 0 0 388.342 3.229 20 5 GGBDRN CCc1cccc(C)c1NC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273360446 1434983124 /nfs/dbraw/zinc/98/31/24/1434983124.db2.gz AQULWXDGVAUFFL-UHFFFAOYSA-N 0 0 391.449 3.061 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCCN(C(=O)c2ccsc2)CC1 ZINC000273373148 1434984239 /nfs/dbraw/zinc/98/42/39/1434984239.db2.gz HBYRIVSUIWPFIO-UHFFFAOYSA-N 0 0 392.412 3.175 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000273384092 1434985102 /nfs/dbraw/zinc/98/51/02/1434985102.db2.gz ZHDXCMDYSFRRGG-KDOFPFPSSA-N 0 0 394.424 3.470 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000273392532 1434985691 /nfs/dbraw/zinc/98/56/91/1434985691.db2.gz DUDWUWCJRJRQQI-CJNGLKHVSA-N 0 0 398.387 3.072 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273431986 1434988436 /nfs/dbraw/zinc/98/84/36/1434988436.db2.gz UYGUOTADCRZAIH-KSSFIOAISA-N 0 0 392.358 3.288 20 5 GGBDRN O=C(N[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000273435207 1434988705 /nfs/dbraw/zinc/98/87/05/1434988705.db2.gz WUDZTKQXFLBQDT-GUYCJALGSA-N 0 0 384.367 3.260 20 5 GGBDRN COc1ccccc1-c1noc([C@@H](C)NCCOc2cccc([N+](=O)[O-])c2)n1 ZINC000273439592 1434988836 /nfs/dbraw/zinc/98/88/36/1434988836.db2.gz ZBOVQTUMMVRHGI-CYBMUJFWSA-N 0 0 384.392 3.383 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273440237 1434988863 /nfs/dbraw/zinc/98/88/63/1434988863.db2.gz WCCNLKFHKWRJHO-PKOBYXMFSA-N 0 0 387.411 3.496 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000273449894 1434989587 /nfs/dbraw/zinc/98/95/87/1434989587.db2.gz XAOXTDZXUMIFAE-WMLDXEAASA-N 0 0 389.339 3.292 20 5 GGBDRN O=C(N[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000273449896 1434989648 /nfs/dbraw/zinc/98/96/48/1434989648.db2.gz XAOXTDZXUMIFAE-YOEHRIQHSA-N 0 0 389.339 3.292 20 5 GGBDRN CC(C)(C)OC(=O)N1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273466666 1434990479 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COCCOCc1noc(-c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)n1 ZINC000274243276 1435054251 /nfs/dbraw/zinc/05/42/51/1435054251.db2.gz WGJIDBIJPBBWIW-UHFFFAOYSA-N 0 0 376.413 3.044 20 5 GGBDRN COc1ccc(CN2CCCN(c3ccc(C(C)=O)cc3[N+](=O)[O-])CC2=O)cc1 ZINC000274252016 1435054966 /nfs/dbraw/zinc/05/49/66/1435054966.db2.gz HJIBKAAFTWABQY-UHFFFAOYSA-N 0 0 397.431 3.045 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000274264399 1435056117 /nfs/dbraw/zinc/05/61/17/1435056117.db2.gz LDBKLEQJMGOXQQ-AWEZNQCLSA-N 0 0 380.466 3.267 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)COc2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000274268695 1435056552 /nfs/dbraw/zinc/05/65/52/1435056552.db2.gz DQYJGKMUABWWLP-LBPRGKRZSA-N 0 0 392.383 3.397 20 5 GGBDRN C[C@@H](NC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000274274784 1435056915 /nfs/dbraw/zinc/05/69/15/1435056915.db2.gz IOSZINIHANOBRY-CYBMUJFWSA-N 0 0 395.415 3.320 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[C@H]1CCCCO1 ZINC000274284241 1435057755 /nfs/dbraw/zinc/05/77/55/1435057755.db2.gz YXOJOJKEJVPMFL-OAHLLOKOSA-N 0 0 382.482 3.412 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[C@@H]1CCCCO1 ZINC000274284240 1435057792 /nfs/dbraw/zinc/05/77/92/1435057792.db2.gz YXOJOJKEJVPMFL-HNNXBMFYSA-N 0 0 382.482 3.412 20 5 GGBDRN COc1cc(C(=O)N2C[C@H]3CCC(=O)c4cccc2c43)c([N+](=O)[O-])cc1OC ZINC000274287305 1435058051 /nfs/dbraw/zinc/05/80/51/1435058051.db2.gz FQIWYSZWKLDLHJ-LLVKDONJSA-N 0 0 382.372 3.333 20 5 GGBDRN COc1cc(C)c([C@@H](C)NC(=O)COc2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000274288285 1435058107 /nfs/dbraw/zinc/05/81/07/1435058107.db2.gz JQWACMZIHJFSPN-GFCCVEGCSA-N 0 0 392.383 3.316 20 5 GGBDRN CCCCCC(=O)NC1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000274288917 1435058264 /nfs/dbraw/zinc/05/82/64/1435058264.db2.gz QIJCYWIUCRRAMB-UHFFFAOYSA-N 0 0 381.448 3.403 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C1 ZINC000274293469 1435058573 /nfs/dbraw/zinc/05/85/73/1435058573.db2.gz RNNVZSRZTUREQZ-ZDUSSCGKSA-N 0 0 378.429 3.343 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc([N+](=O)[O-])c1 ZINC000274297021 1435058898 /nfs/dbraw/zinc/05/88/98/1435058898.db2.gz IRDWDGWYZRPVSN-LBPRGKRZSA-N 0 0 394.383 3.492 20 5 GGBDRN COc1cc(OCC(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)ccc1[N+](=O)[O-] ZINC000274296869 1435058936 /nfs/dbraw/zinc/05/89/36/1435058936.db2.gz IKNPNBKRKJCBOL-LBPRGKRZSA-N 0 0 382.372 3.089 20 5 GGBDRN O=C(CCCC(=O)c1ccc2c(c1)OCCO2)NCc1ccccc1[N+](=O)[O-] ZINC000274299394 1435059206 /nfs/dbraw/zinc/05/92/06/1435059206.db2.gz FSWCGABNKZYNIS-UHFFFAOYSA-N 0 0 384.388 3.035 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CC12CCCCC2 ZINC000274304076 1435059558 /nfs/dbraw/zinc/05/95/58/1435059558.db2.gz RIDYPUSGQAGWGE-CQSZACIVSA-N 0 0 394.493 3.431 20 5 GGBDRN COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000274315010 1435060916 /nfs/dbraw/zinc/06/09/16/1435060916.db2.gz NMTKUPZXYDNQBJ-UHFFFAOYSA-N 0 0 393.459 3.403 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC=C(C(F)(F)F)CC2)c2ncccc12 ZINC000274390386 1435067455 /nfs/dbraw/zinc/06/74/55/1435067455.db2.gz SDSSZQKNLBBQGK-UHFFFAOYSA-N 0 0 387.339 3.026 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)o1 ZINC000274396134 1435067783 /nfs/dbraw/zinc/06/77/83/1435067783.db2.gz RCVPZVSJSBURJE-CYBMUJFWSA-N 0 0 388.405 3.316 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000274398061 1435068099 /nfs/dbraw/zinc/06/80/99/1435068099.db2.gz UMKWKGKJZCDMDA-GFCCVEGCSA-N 0 0 385.449 3.052 20 5 GGBDRN COCCOc1ccc(C(=O)NCc2cc([N+](=O)[O-])ccc2OC)c(Cl)c1 ZINC000274409350 1435068717 /nfs/dbraw/zinc/06/87/17/1435068717.db2.gz HSQWSHKDNMNICJ-UHFFFAOYSA-N 0 0 394.811 3.212 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCC[C@H](CC(=O)OC(C)C)C2)cc1[N+](=O)[O-] ZINC000274513738 1435076001 /nfs/dbraw/zinc/07/60/01/1435076001.db2.gz VRKRCZSJGAGGTJ-CYBMUJFWSA-N 0 0 393.396 3.005 20 5 GGBDRN COc1ccccc1[C@H](CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])OC(C)C ZINC000274523244 1435076583 /nfs/dbraw/zinc/07/65/83/1435076583.db2.gz BNSWHEIBPSWUGF-HNNXBMFYSA-N 0 0 390.440 3.346 20 5 GGBDRN CCSCc1cc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)no1 ZINC000274549662 1435077927 /nfs/dbraw/zinc/07/79/27/1435077927.db2.gz WCSUHRULMBEAMW-UHFFFAOYSA-N 0 0 379.394 3.250 20 5 GGBDRN CC(C)(C(=O)N1CCSC2(CCOCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000274547930 1435077934 /nfs/dbraw/zinc/07/79/34/1435077934.db2.gz GUHDKXDCPPFTTH-UHFFFAOYSA-N 0 0 382.457 3.136 20 5 GGBDRN Cc1cc(NC(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)ccc1[N+](=O)[O-] ZINC000274574556 1435078924 /nfs/dbraw/zinc/07/89/24/1435078924.db2.gz BOROOTJSGJXAHB-SFHVURJKSA-N 0 0 398.419 3.342 20 5 GGBDRN CC(C)(C(=O)NC1CCC(O)(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000274603115 1435080323 /nfs/dbraw/zinc/08/03/23/1435080323.db2.gz IHJMBGUQGBDODA-UHFFFAOYSA-N 0 0 383.448 3.214 20 5 GGBDRN CNC(=O)C1CCC(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000274653203 1435083470 /nfs/dbraw/zinc/08/34/70/1435083470.db2.gz NTPACMACHVHKMS-UHFFFAOYSA-N 0 0 388.346 3.040 20 5 GGBDRN CC(C)(C(=O)N1CCC(c2nnc3n2CCCC3)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000274702275 1435086361 /nfs/dbraw/zinc/08/63/61/1435086361.db2.gz VTYCSBRWBAFYDZ-UHFFFAOYSA-N 0 0 397.479 3.206 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](CN1CCCC1=O)c1ccccc1 ZINC000274712554 1435087021 /nfs/dbraw/zinc/08/70/21/1435087021.db2.gz QQOIKWNIZKEYFR-KRWDZBQOSA-N 0 0 398.419 3.089 20 5 GGBDRN COc1cc(C(=O)N2C[C@@H](C)Oc3c(F)cccc32)cc([N+](=O)[O-])c1OC ZINC000274711520 1435087030 /nfs/dbraw/zinc/08/70/30/1435087030.db2.gz AASSYFMGDMEXDA-SNVBAGLBSA-N 0 0 376.340 3.179 20 5 GGBDRN COc1ccc(OC)c2c1CN(C(=O)Nc1ccc([N+](=O)[O-])cc1C)C[C@@H]2O ZINC000274728221 1435088115 /nfs/dbraw/zinc/08/81/15/1435088115.db2.gz TWKXLACAAFRPEM-HNNXBMFYSA-N 0 0 387.392 3.002 20 5 GGBDRN COc1ccc(OC)c2c1CN(C(=O)Nc1ccc([N+](=O)[O-])cc1C)C[C@H]2O ZINC000274728226 1435088117 /nfs/dbraw/zinc/08/81/17/1435088117.db2.gz TWKXLACAAFRPEM-OAHLLOKOSA-N 0 0 387.392 3.002 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1NCc1ccc(N2CCCS2(=O)=O)c(F)c1 ZINC000274751988 1435089506 /nfs/dbraw/zinc/08/95/06/1435089506.db2.gz PQMNNXWTAAUDON-UHFFFAOYSA-N 0 0 383.376 3.025 20 5 GGBDRN COc1cc(C=O)ccc1OCCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000274776766 1435091449 /nfs/dbraw/zinc/09/14/49/1435091449.db2.gz IZJVKZZVLBIINX-UHFFFAOYSA-N 0 0 398.415 3.376 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC(c2nnc3n2CCCC3)CC1 ZINC000274784398 1435092063 /nfs/dbraw/zinc/09/20/63/1435092063.db2.gz OMDWHMURYTXSRP-UHFFFAOYSA-N 0 0 395.419 3.289 20 5 GGBDRN Cc1[nH]nc(C(=O)N2CCc3cccc(NC(=O)OC(C)(C)C)c32)c1[N+](=O)[O-] ZINC000274812952 1435094831 /nfs/dbraw/zinc/09/48/31/1435094831.db2.gz QTAJFQDXKUUCIM-UHFFFAOYSA-N 0 0 387.396 3.176 20 5 GGBDRN CC(C)n1cccc1C(=O)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274825478 1435095926 /nfs/dbraw/zinc/09/59/26/1435095926.db2.gz YDJVWOQWNWIQHC-UHFFFAOYSA-N 0 0 396.451 3.206 20 5 GGBDRN CCOC(=O)[C@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(OC)c(F)c1 ZINC000274917963 1435103373 /nfs/dbraw/zinc/10/33/73/1435103373.db2.gz YBMDCHMPQJCTEU-GOSISDBHSA-N 0 0 392.383 3.145 20 5 GGBDRN CCOC(=O)C[C@](C)(NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-])C(C)C ZINC000274954884 1435105731 /nfs/dbraw/zinc/10/57/31/1435105731.db2.gz JFHMVIMQPIDFCM-IBGZPJMESA-N 0 0 396.440 3.100 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCO[C@H]2CC(C)C)cc1OC ZINC000274958134 1435106004 /nfs/dbraw/zinc/10/60/04/1435106004.db2.gz KDBKPNCDIDSIRN-HOCLYGCPSA-N 0 0 380.441 3.326 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCO[C@@H]2CC(C)C)cc1OC ZINC000274958133 1435106008 /nfs/dbraw/zinc/10/60/08/1435106008.db2.gz KDBKPNCDIDSIRN-GOEBONIOSA-N 0 0 380.441 3.326 20 5 GGBDRN COc1ccc(NC(=O)NCc2cc(COC(C)(C)C)on2)cc1[N+](=O)[O-] ZINC000274973497 1435106966 /nfs/dbraw/zinc/10/69/66/1435106966.db2.gz JRMPKTBTGNGGHN-UHFFFAOYSA-N 0 0 378.385 3.228 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccccc2NC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000274971616 1435106980 /nfs/dbraw/zinc/10/69/80/1435106980.db2.gz KLNWCMDPHNEMNP-UHFFFAOYSA-N 0 0 375.385 3.480 20 5 GGBDRN O=C(c1ccccc1)c1ccc(N2CCC(Cn3cncn3)CC2)c([N+](=O)[O-])c1 ZINC000274975873 1435107198 /nfs/dbraw/zinc/10/71/98/1435107198.db2.gz AQJIIPXSCULASS-UHFFFAOYSA-N 0 0 391.431 3.334 20 5 GGBDRN CC(=O)c1ccc(N2CCC(Oc3cncc(Cl)n3)CC2)c([N+](=O)[O-])c1 ZINC000275007050 1435109125 /nfs/dbraw/zinc/10/91/25/1435109125.db2.gz ICDGQBMCPKPDNI-UHFFFAOYSA-N 0 0 376.800 3.289 20 5 GGBDRN CCOC(=O)c1nc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)oc1C ZINC000275009705 1435109378 /nfs/dbraw/zinc/10/93/78/1435109378.db2.gz WTFVGALHFMUMTH-JTQLQIEISA-N 0 0 379.394 3.187 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCC(c2nnc3n2CCCC3)CC1 ZINC000275017788 1435110121 /nfs/dbraw/zinc/11/01/21/1435110121.db2.gz YZEHIHLAHIREHV-UHFFFAOYSA-N 0 0 389.843 3.196 20 5 GGBDRN COc1cc(CNCc2nc3cc(Cl)ccc3n2C)c([N+](=O)[O-])cc1OC ZINC000275055617 1435113184 /nfs/dbraw/zinc/11/31/84/1435113184.db2.gz NJXDWDVBUDERGL-UHFFFAOYSA-N 0 0 390.827 3.442 20 5 GGBDRN 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ZINC000278340643 1435381582 /nfs/dbraw/zinc/38/15/82/1435381582.db2.gz LURKYRGOIDKYCC-XJKSGUPXSA-N 0 0 391.468 3.350 20 5 GGBDRN Cc1cnc(C2CCN(C(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3C)CC2)s1 ZINC000278341040 1435381641 /nfs/dbraw/zinc/38/16/41/1435381641.db2.gz KDOHJCVHWSHESS-UHFFFAOYSA-N 0 0 388.449 3.013 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)c1ccc(C)cc1 ZINC000278367699 1435384557 /nfs/dbraw/zinc/38/45/57/1435384557.db2.gz QXLSAACLFCUVSI-QGZVFWFLSA-N 0 0 390.461 3.105 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3nnc(C4CC4)o3)CC2)c(C(F)(F)F)c1 ZINC000278376536 1435385309 /nfs/dbraw/zinc/38/53/09/1435385309.db2.gz LFUXVAJKLIJESC-UHFFFAOYSA-N 0 0 383.330 3.201 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc([C@H](c3cccc(F)c3)N3CCOCC3)n2)c1 ZINC000278378945 1435385502 /nfs/dbraw/zinc/38/55/02/1435385502.db2.gz YNOXITJIERKVOQ-KRWDZBQOSA-N 0 0 384.367 3.206 20 5 GGBDRN Cc1nnc(CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])n1C1CC1 ZINC000278384380 1435385968 /nfs/dbraw/zinc/38/59/68/1435385968.db2.gz 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MODGVVKDSRMRGV-UHFFFAOYSA-N 0 0 386.408 3.169 20 5 GGBDRN O=C(c1ccco1)N1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278508868 1435396011 /nfs/dbraw/zinc/39/60/11/1435396011.db2.gz YAISYONJHYNBLT-UHFFFAOYSA-N 0 0 384.314 3.318 20 5 GGBDRN CS(=O)(=O)Cc1cccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000278510522 1435396297 /nfs/dbraw/zinc/39/62/97/1435396297.db2.gz YCOUBDGWMAOCIX-UHFFFAOYSA-N 0 0 389.355 3.165 20 5 GGBDRN CNC(=O)C1CCC(Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278519934 1435396868 /nfs/dbraw/zinc/39/68/68/1435396868.db2.gz SHCBLEDJJHZGIJ-UHFFFAOYSA-N 0 0 396.316 3.361 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC(Oc2ncccc2F)CC1 ZINC000278526070 1435397418 /nfs/dbraw/zinc/39/74/18/1435397418.db2.gz LUMWNDNYSYUUIU-UHFFFAOYSA-N 0 0 398.394 3.154 20 5 GGBDRN CS(=O)(=O)Cc1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000278526653 1435397480 /nfs/dbraw/zinc/39/74/80/1435397480.db2.gz ZQIXUJMQEQLDHI-UHFFFAOYSA-N 0 0 389.355 3.165 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCCC[C@H]1CCO ZINC000278540348 1435398386 /nfs/dbraw/zinc/39/83/86/1435398386.db2.gz CDIQUFIICGPXEB-ZDUSSCGKSA-N 0 0 375.347 3.060 20 5 GGBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N1CCC(C2OCCO2)CC1 ZINC000278547538 1435399018 /nfs/dbraw/zinc/39/90/18/1435399018.db2.gz VLQQDAAETCXKAT-UHFFFAOYSA-N 0 0 397.300 3.233 20 5 GGBDRN C[C@@H](OC[C@@H]1CCCCO1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278552845 1435399485 /nfs/dbraw/zinc/39/94/85/1435399485.db2.gz UJNWROUMVPGXJE-ABAIWWIYSA-N 0 0 390.358 3.204 20 5 GGBDRN CCOC(=O)C1CCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278562725 1435400321 /nfs/dbraw/zinc/40/03/21/1435400321.db2.gz WRSPDEYNTGLKSU-UHFFFAOYSA-N 0 0 397.300 3.423 20 5 GGBDRN C[C@H](NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCOCC1 ZINC000278570619 1435401340 /nfs/dbraw/zinc/40/13/40/1435401340.db2.gz GICWOUTYGZXVAF-JTQLQIEISA-N 0 0 375.347 3.228 20 5 GGBDRN CC(=O)N(C)C1CCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278573084 1435401554 /nfs/dbraw/zinc/40/15/54/1435401554.db2.gz XOOKWMPSZQLQLT-UHFFFAOYSA-N 0 0 396.316 3.091 20 5 GGBDRN C[C@H](O)CC(C)(C)CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278623847 1435407003 /nfs/dbraw/zinc/40/70/03/1435407003.db2.gz KFLSUJKEHNNADJ-JTQLQIEISA-N 0 0 377.363 3.210 20 5 GGBDRN COCCN(C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1ccccc1 ZINC000278640585 1435408801 /nfs/dbraw/zinc/40/88/01/1435408801.db2.gz IWBKOKBKCHRGEB-CQSZACIVSA-N 0 0 397.435 3.390 20 5 GGBDRN COc1ccc([C@H]2CCN(C(=O)NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)cc1 ZINC000278646664 1435409508 /nfs/dbraw/zinc/40/95/08/1435409508.db2.gz JHDSMPADUHUDBH-AWEZNQCLSA-N 0 0 395.419 3.179 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000278647487 1435409725 /nfs/dbraw/zinc/40/97/25/1435409725.db2.gz JLZQUHYWUZOFQQ-CYBMUJFWSA-N 0 0 383.383 3.309 20 5 GGBDRN Cn1nc(C(F)(F)F)c(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1Cl ZINC000278652952 1435410409 /nfs/dbraw/zinc/41/04/09/1435410409.db2.gz JTSXFLKXFDBSFE-UHFFFAOYSA-N 0 0 388.737 3.167 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc(O)cc2OC(C)C)ccc1[N+](=O)[O-] ZINC000278654474 1435410743 /nfs/dbraw/zinc/41/07/43/1435410743.db2.gz SSKDVZOFWVZQCS-UHFFFAOYSA-N 0 0 376.365 3.114 20 5 GGBDRN Cc1cnccc1CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278663962 1435411537 /nfs/dbraw/zinc/41/15/37/1435411537.db2.gz MTLZFUBGYPGXIJ-UHFFFAOYSA-N 0 0 382.342 3.359 20 5 GGBDRN COc1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1-n1nnnc1C1CC1 ZINC000278664625 1435411737 /nfs/dbraw/zinc/41/17/37/1435411737.db2.gz OGHLHUHJINBMFM-UHFFFAOYSA-N 0 0 394.391 3.017 20 5 GGBDRN COc1cc(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1OC(=O)C1CC1 ZINC000278667178 1435411747 /nfs/dbraw/zinc/41/17/47/1435411747.db2.gz LBRHTPHTNZGVJC-UHFFFAOYSA-N 0 0 396.403 3.085 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCCCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000278670377 1435412611 /nfs/dbraw/zinc/41/26/11/1435412611.db2.gz LOVVTKJSBASGGI-MRXNPFEDSA-N 0 0 395.506 3.117 20 5 GGBDRN C[C@H](CC[S@](C)=O)NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000278672664 1435412798 /nfs/dbraw/zinc/41/27/98/1435412798.db2.gz KGRLMRGFFQYOOF-ASHKIFAZSA-N 0 0 390.461 3.061 20 5 GGBDRN Cc1nc([C@H](C)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)no1 ZINC000278675411 1435413248 /nfs/dbraw/zinc/41/32/48/1435413248.db2.gz REPIGIYMJKZMFG-JTQLQIEISA-N 0 0 385.346 3.188 20 5 GGBDRN CC(C)[C@H]1CN(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2ccccc21 ZINC000278684186 1435413729 /nfs/dbraw/zinc/41/37/29/1435413729.db2.gz IFIHJPCOBLCLRT-OAHLLOKOSA-N 0 0 388.445 3.398 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000278684710 1435414052 /nfs/dbraw/zinc/41/40/52/1435414052.db2.gz MKFLUHIRPRENMA-ZDUSSCGKSA-N 0 0 395.419 3.179 20 5 GGBDRN CN(C)c1cccc(CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000278691439 1435414395 /nfs/dbraw/zinc/41/43/95/1435414395.db2.gz OMXFCETYTGQOHA-UHFFFAOYSA-N 0 0 397.357 3.074 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC(OC2CCCC2)CC1 ZINC000278706936 1435415817 /nfs/dbraw/zinc/41/58/17/1435415817.db2.gz OFGJAKJVRRIAMK-UHFFFAOYSA-N 0 0 387.440 3.104 20 5 GGBDRN Cc1ccnc(-c2noc(CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n2)n1 ZINC000278710448 1435416241 /nfs/dbraw/zinc/41/62/41/1435416241.db2.gz NZIKREZCNYPFQG-UHFFFAOYSA-N 0 0 394.313 3.417 20 5 GGBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000278719275 1435416930 /nfs/dbraw/zinc/41/69/30/1435416930.db2.gz KYHIIKVCZIHFMP-SECBINFHSA-N 0 0 388.371 3.384 20 5 GGBDRN CCO[C@@H](CNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000278721278 1435417255 /nfs/dbraw/zinc/41/72/55/1435417255.db2.gz PPENTHHMFHKJAW-KRWDZBQOSA-N 0 0 383.408 3.048 20 5 GGBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)s1 ZINC000278724411 1435417686 /nfs/dbraw/zinc/41/76/86/1435417686.db2.gz PUTFZUVYZFDVDO-JTQLQIEISA-N 0 0 388.453 3.447 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[C@H](c2cccc(F)c2)C1 ZINC000278731792 1435418479 /nfs/dbraw/zinc/41/84/79/1435418479.db2.gz QMAPZDPUMRQQJY-ZDUSSCGKSA-N 0 0 383.383 3.309 20 5 GGBDRN CCn1nccc1C1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000278753814 1435420347 /nfs/dbraw/zinc/42/03/47/1435420347.db2.gz NREPTAFLVIVLPM-UHFFFAOYSA-N 0 0 398.872 3.033 20 5 GGBDRN CSc1cc2c(cc1CNCc1nc3cc([N+](=O)[O-])ccc3[nH]1)OCCO2 ZINC000278762676 1435421151 /nfs/dbraw/zinc/42/11/51/1435421151.db2.gz TXTQBNKETLYGAD-UHFFFAOYSA-N 0 0 386.433 3.254 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000278782975 1435423221 /nfs/dbraw/zinc/42/32/21/1435423221.db2.gz VGOYAVKHCWBLOZ-LBPRGKRZSA-N 0 0 375.347 3.370 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N(Cc1ccc(O)cc1)CC1CC1 ZINC000278791843 1435424079 /nfs/dbraw/zinc/42/40/79/1435424079.db2.gz WQQOBOCCUOAYEK-UHFFFAOYSA-N 0 0 395.419 3.299 20 5 GGBDRN COc1cc(CNc2ccc3c(c2)N(C(N)=O)CCC3)c([N+](=O)[O-])cc1OC ZINC000278811341 1435425837 /nfs/dbraw/zinc/42/58/37/1435425837.db2.gz SIMQUFNCUHYPBK-UHFFFAOYSA-N 0 0 386.408 3.055 20 5 GGBDRN CC1(C)[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H]2CCO[C@@H]21 ZINC000278813966 1435426043 /nfs/dbraw/zinc/42/60/43/1435426043.db2.gz XKHYEIBYLDTTEF-MJBXVCDLSA-N 0 0 387.358 3.226 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(C)c(C(=O)N2CCCCC2)c1 ZINC000278814613 1435426052 /nfs/dbraw/zinc/42/60/52/1435426052.db2.gz HVJYOIIFVFCBJH-UHFFFAOYSA-N 0 0 399.451 3.063 20 5 GGBDRN C[C@H]1C[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000278823819 1435427201 /nfs/dbraw/zinc/42/72/01/1435427201.db2.gz YGNRQYUOJXZCMJ-QWRGUYRKSA-N 0 0 375.347 3.228 20 5 GGBDRN C[C@@H]1C[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000278823815 1435427258 /nfs/dbraw/zinc/42/72/58/1435427258.db2.gz YGNRQYUOJXZCMJ-MNOVXSKESA-N 0 0 375.347 3.228 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)c(C)c1[N+](=O)[O-] ZINC000278823202 1435427347 /nfs/dbraw/zinc/42/73/47/1435427347.db2.gz CLBQRBGONXTRTH-MRVPVSSYSA-N 0 0 391.375 3.151 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(NCCC[C@H](C)O)c([N+](=O)[O-])c1 ZINC000278845885 1435430384 /nfs/dbraw/zinc/43/03/84/1435430384.db2.gz LKWPASRLWZYMJB-ZDUSSCGKSA-N 0 0 386.404 3.185 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(NCCC[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000278845883 1435430451 /nfs/dbraw/zinc/43/04/51/1435430451.db2.gz LKWPASRLWZYMJB-CYBMUJFWSA-N 0 0 386.404 3.185 20 5 GGBDRN CCn1nccc1C1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000278858001 1435431911 /nfs/dbraw/zinc/43/19/11/1435431911.db2.gz KVBRSXIKWUIMAT-OAHLLOKOSA-N 0 0 385.468 3.326 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000278892573 1435436576 /nfs/dbraw/zinc/43/65/76/1435436576.db2.gz FCRAOKYOVHVQPO-UHFFFAOYSA-N 0 0 382.464 3.466 20 5 GGBDRN C[C@H](NC(=O)C1CCC(NC(=O)C(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000278907633 1435438309 /nfs/dbraw/zinc/43/83/09/1435438309.db2.gz GFLXYMXKJHWCNA-HLIUYOAVSA-N 0 0 375.469 3.493 20 5 GGBDRN CCn1nccc1C1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000278920748 1435440005 /nfs/dbraw/zinc/44/00/05/1435440005.db2.gz RPLBLQGIHYIXAA-UHFFFAOYSA-N 0 0 391.859 3.283 20 5 GGBDRN C[C@@H]1OCC[C@@]1(O)CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000278926219 1435440965 /nfs/dbraw/zinc/44/09/65/1435440965.db2.gz XBQGUIBLSFVXBU-ORAYPTAESA-N 0 0 387.392 3.049 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000278942939 1435443080 /nfs/dbraw/zinc/44/30/80/1435443080.db2.gz XYVOOUUNIKWWAG-RDTXWAMCSA-N 0 0 395.419 3.191 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@@H](Oc3ncccc3F)C2)cc1[N+](=O)[O-] ZINC000278959158 1435445504 /nfs/dbraw/zinc/44/55/04/1435445504.db2.gz ZWKWJMXPBTZPKE-CYBMUJFWSA-N 0 0 390.371 3.213 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ncnn1-c1ccccc1 ZINC000278998282 1435450426 /nfs/dbraw/zinc/45/04/26/1435450426.db2.gz KCMUQVNLXKEZIP-UHFFFAOYSA-N 0 0 394.435 3.296 20 5 GGBDRN O=C(O[C@@H]([C@H]1CCCOC1)C(F)(F)F)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000279008048 1435451446 /nfs/dbraw/zinc/45/14/46/1435451446.db2.gz DOPHVSWDFCAZKO-NHYWBVRUSA-N 0 0 399.325 3.295 20 5 GGBDRN CCc1nnc([C@@H]2CN(Cc3cc(=O)oc4ccc5ccccc5c34)CCO2)o1 ZINC000279041491 1435454836 /nfs/dbraw/zinc/45/48/36/1435454836.db2.gz CRKHGORTUQHDPU-SFHVURJKSA-N 0 0 391.427 3.465 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000279045810 1435455293 /nfs/dbraw/zinc/45/52/93/1435455293.db2.gz AHYBKWYOKVCRIK-UHFFFAOYSA-N 0 0 385.468 3.410 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000279058333 1435456415 /nfs/dbraw/zinc/45/64/15/1435456415.db2.gz FDWTURXJDMIHLD-QGZVFWFLSA-N 0 0 385.424 3.032 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc([C@H]3CCCO3)nn2C)cc1SC ZINC000279062396 1435456870 /nfs/dbraw/zinc/45/68/70/1435456870.db2.gz DJVNDFRSMFMKSD-CYBMUJFWSA-N 0 0 392.437 3.163 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279062213 1435456924 /nfs/dbraw/zinc/45/69/24/1435456924.db2.gz DGBGLMMSVYQDQE-AWEZNQCLSA-N 0 0 394.815 3.241 20 5 GGBDRN C[C@H](O)C[C@H]1CCCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279072805 1435457824 /nfs/dbraw/zinc/45/78/24/1435457824.db2.gz RALSULSNVCAWGV-GXFFZTMASA-N 0 0 375.347 3.059 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NCC1(CCO)CCCC1 ZINC000279087678 1435459270 /nfs/dbraw/zinc/45/92/70/1435459270.db2.gz SQDCRDLKMWCZME-UHFFFAOYSA-N 0 0 389.374 3.356 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@@H](CCO)c1ccco1 ZINC000279114521 1435461679 /nfs/dbraw/zinc/46/16/79/1435461679.db2.gz WGJUYHVMENICPZ-ZDUSSCGKSA-N 0 0 387.314 3.130 20 5 GGBDRN COCCn1nc(C)c(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])c1C ZINC000279119414 1435462153 /nfs/dbraw/zinc/46/21/53/1435462153.db2.gz AARRDSXFXLXOEC-UHFFFAOYSA-N 0 0 384.795 3.028 20 5 GGBDRN C[C@H]1OCC[C@@]12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C[C@@H](C)O2 ZINC000279134759 1435464009 /nfs/dbraw/zinc/46/40/09/1435464009.db2.gz AETZZVBTVPSZHC-SEDUGSJDSA-N 0 0 376.434 3.218 20 5 GGBDRN CCn1nccc1C1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1 ZINC000279146203 1435465205 /nfs/dbraw/zinc/46/52/05/1435465205.db2.gz SKCUUCUWPORGPJ-UHFFFAOYSA-N 0 0 385.468 3.333 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2C[C@@H](O)C(C)(C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000279175815 1435467872 /nfs/dbraw/zinc/46/78/72/1435467872.db2.gz BHQRSBAHWWTUDQ-FZKQIMNGSA-N 0 0 384.436 3.006 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2C[C@H](O)C(C)(C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000279175811 1435467897 /nfs/dbraw/zinc/46/78/97/1435467897.db2.gz BHQRSBAHWWTUDQ-ACJLOTCBSA-N 0 0 384.436 3.006 20 5 GGBDRN CSC[C@](C)(O)CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000279184662 1435468523 /nfs/dbraw/zinc/46/85/23/1435468523.db2.gz MGVWRCMZEVQURH-LJQANCHMSA-N 0 0 390.461 3.018 20 5 GGBDRN CC1(C)C[C@@H](Nc2cccc(C(=O)NCCC(N)=O)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279190318 1435469408 /nfs/dbraw/zinc/46/94/08/1435469408.db2.gz WIHPDGSSTVYEDL-GOSISDBHSA-N 0 0 396.447 3.035 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)Nc2ccccc2N2CCCC2=O)cc1[N+](=O)[O-] ZINC000279206617 1435471425 /nfs/dbraw/zinc/47/14/25/1435471425.db2.gz LUTNVLVVTXDWFN-UHFFFAOYSA-N 0 0 386.383 3.179 20 5 GGBDRN Cc1cccnc1OC1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000279207090 1435471543 /nfs/dbraw/zinc/47/15/43/1435471543.db2.gz GPMUGFQFSRAMCB-UHFFFAOYSA-N 0 0 395.419 3.392 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(C(=O)NC2CC2)ccc1C ZINC000279226022 1435473674 /nfs/dbraw/zinc/47/36/74/1435473674.db2.gz DHDDTHMRVUEOKA-UHFFFAOYSA-N 0 0 383.404 3.446 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC2(CCOCC2)O1 ZINC000279225298 1435473714 /nfs/dbraw/zinc/47/37/14/1435473714.db2.gz OHRWSEXODPWQEN-LLVKDONJSA-N 0 0 388.342 3.024 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CC1 ZINC000279232127 1435474633 /nfs/dbraw/zinc/47/46/33/1435474633.db2.gz MZLHZUHFQNJJAO-UHFFFAOYSA-N 0 0 394.435 3.017 20 5 GGBDRN NC(=O)N1CCCc2ccc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)cc21 ZINC000279236209 1435475156 /nfs/dbraw/zinc/47/51/56/1435475156.db2.gz SCXWAQVJDQXFEC-UHFFFAOYSA-N 0 0 397.435 3.257 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000279239897 1435475620 /nfs/dbraw/zinc/47/56/20/1435475620.db2.gz GZXQICILNOIZKJ-GFCCVEGCSA-N 0 0 381.392 3.023 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000279239895 1435475825 /nfs/dbraw/zinc/47/58/25/1435475825.db2.gz NYROCHGYOBGOMH-UHFFFAOYSA-N 0 0 381.436 3.172 20 5 GGBDRN CCOc1cc(NC(=O)c2ccnn2CC(F)F)c([N+](=O)[O-])cc1OCC ZINC000279246472 1435476636 /nfs/dbraw/zinc/47/66/36/1435476636.db2.gz HPNGQDWSGUUDKJ-UHFFFAOYSA-N 0 0 384.339 3.106 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)Nc2ccc(NC(=O)C3CC3)cc2)cc1[N+](=O)[O-] ZINC000279247505 1435476766 /nfs/dbraw/zinc/47/67/66/1435476766.db2.gz SNMLOEKAAZIZRM-UHFFFAOYSA-N 0 0 386.383 3.401 20 5 GGBDRN C[C@@H]1CN(CCN(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@H](C)O1 ZINC000279262848 1435478729 /nfs/dbraw/zinc/47/87/29/1435478729.db2.gz IJNPYQDDMXVGHA-IYBDPMFKSA-N 0 0 393.487 3.275 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000279271048 1435479887 /nfs/dbraw/zinc/47/98/87/1435479887.db2.gz JMGHPPBVVIZQOY-AWEZNQCLSA-N 0 0 387.440 3.053 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)NCCCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000279273898 1435480194 /nfs/dbraw/zinc/48/01/94/1435480194.db2.gz WPRWYJCXAHEZMK-UHFFFAOYSA-N 0 0 385.399 3.039 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1 ZINC000279296685 1435483210 /nfs/dbraw/zinc/48/32/10/1435483210.db2.gz LPMPAUVZANICCC-UHFFFAOYSA-N 0 0 397.387 3.289 20 5 GGBDRN CCNC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)c1C ZINC000279300246 1435483549 /nfs/dbraw/zinc/48/35/49/1435483549.db2.gz MKAURQBOGPVZGJ-UHFFFAOYSA-N 0 0 385.424 3.363 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc2c(C(F)F)nn(C)c2s1 ZINC000279310499 1435485041 /nfs/dbraw/zinc/48/50/41/1435485041.db2.gz NAMMKEZFUNPKOT-UHFFFAOYSA-N 0 0 396.375 3.419 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000279311423 1435485146 /nfs/dbraw/zinc/48/51/46/1435485146.db2.gz XEMFXUVIWMSBIY-UHFFFAOYSA-N 0 0 383.452 3.405 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1ccc(N2CCOC2=O)cc1 ZINC000279312127 1435485232 /nfs/dbraw/zinc/48/52/32/1435485232.db2.gz NGFPOWHYMJTAOO-CYBMUJFWSA-N 0 0 399.403 3.441 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])sc1C ZINC000279319205 1435486050 /nfs/dbraw/zinc/48/60/50/1435486050.db2.gz AYDOBKQJPDGPKY-CYBMUJFWSA-N 0 0 375.406 3.124 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(CN2CCCC2=O)cc1 ZINC000279324144 1435486712 /nfs/dbraw/zinc/48/67/12/1435486712.db2.gz OILMUUWWAKLPTQ-UHFFFAOYSA-N 0 0 397.431 3.046 20 5 GGBDRN C[C@@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@H](C2CC2)O1 ZINC000279347719 1435489461 /nfs/dbraw/zinc/48/94/61/1435489461.db2.gz HXFNWZFKDHHCNB-QVKFZJNVSA-N 0 0 376.456 3.181 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@H](OCc2ccncc2)C1 ZINC000279360162 1435490946 /nfs/dbraw/zinc/49/09/46/1435490946.db2.gz SRIRXEGQGFATNZ-AWEZNQCLSA-N 0 0 393.802 3.143 20 5 GGBDRN C[C@H]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000279360070 1435491105 /nfs/dbraw/zinc/49/11/05/1435491105.db2.gz SPPOLRTYYVVPCD-MEDUHNTESA-N 0 0 380.807 3.236 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)cc1C(=O)N(C)C ZINC000279364838 1435491519 /nfs/dbraw/zinc/49/15/19/1435491519.db2.gz GKNLUJVYOKPWEG-UHFFFAOYSA-N 0 0 388.399 3.062 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)ccc1OC1CCOCC1 ZINC000279366378 1435491597 /nfs/dbraw/zinc/49/15/97/1435491597.db2.gz GOPLUKCVJUWQKV-UHFFFAOYSA-N 0 0 389.383 3.435 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)c1nc2ccccc2n1C ZINC000279377664 1435492742 /nfs/dbraw/zinc/49/27/42/1435492742.db2.gz HPMUWYYMFXZLTE-NSHDSACASA-N 0 0 385.399 3.178 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000279391802 1435494221 /nfs/dbraw/zinc/49/42/21/1435494221.db2.gz IXJKFNCKLWVMLA-MLGOLLRUSA-N 0 0 377.416 3.460 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000279391799 1435494241 /nfs/dbraw/zinc/49/42/41/1435494241.db2.gz IXJKFNCKLWVMLA-LRDDRELGSA-N 0 0 377.416 3.460 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2C ZINC000279397014 1435495044 /nfs/dbraw/zinc/49/50/44/1435495044.db2.gz UVTCYDGWSIWJMW-LBPRGKRZSA-N 0 0 383.404 3.003 20 5 GGBDRN Cc1nc2sccn2c1CN(C)C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279417746 1435497139 /nfs/dbraw/zinc/49/71/39/1435497139.db2.gz LCDMLVKKYCHKLD-UHFFFAOYSA-N 0 0 391.428 3.090 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)c1cccc(N2CCOC2=O)c1 ZINC000279422531 1435497552 /nfs/dbraw/zinc/49/75/52/1435497552.db2.gz WZZFLZSVZSTOKY-ZDUSSCGKSA-N 0 0 399.403 3.441 20 5 GGBDRN Cc1nc(CCNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cs1 ZINC000279428918 1435498435 /nfs/dbraw/zinc/49/84/35/1435498435.db2.gz GNULACYODKITJH-UHFFFAOYSA-N 0 0 388.371 3.420 20 5 GGBDRN CCc1cc(N2C[C@H](C)OC3(CCOCC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279448704 1435500591 /nfs/dbraw/zinc/50/05/91/1435500591.db2.gz LYTNKOHFRMWILL-HNNXBMFYSA-N 0 0 398.463 3.389 20 5 GGBDRN Cn1nc(C(F)F)c2cc(C(=O)NCCc3ccc([N+](=O)[O-])cc3)sc21 ZINC000279455434 1435501083 /nfs/dbraw/zinc/50/10/83/1435501083.db2.gz ZTPHAOPVFIDYCR-UHFFFAOYSA-N 0 0 380.376 3.453 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000279495501 1435505715 /nfs/dbraw/zinc/50/57/15/1435505715.db2.gz RZZUNCCRMGUVOD-BMIGLBTASA-N 0 0 379.413 3.106 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc([C@H]3CCCOC3)nn2C)cc1[N+](=O)[O-] ZINC000279504801 1435507100 /nfs/dbraw/zinc/50/71/00/1435507100.db2.gz YYIPBUPJRKDWPB-LBPRGKRZSA-N 0 0 376.438 3.197 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnc(-c2cc(F)ccc2C)s1 ZINC000279526865 1435509587 /nfs/dbraw/zinc/50/95/87/1435509587.db2.gz RHUKKCFOJALIAQ-UHFFFAOYSA-N 0 0 390.400 3.095 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@@H+]1Cc1ccccc1 ZINC000279531142 1435510199 /nfs/dbraw/zinc/51/01/99/1435510199.db2.gz VYNBHOIAFXHXKX-CQSZACIVSA-N 0 0 386.427 3.053 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000279559849 1435513096 /nfs/dbraw/zinc/51/30/96/1435513096.db2.gz RYLAYUXHNWDNMV-UHFFFAOYSA-N 0 0 394.378 3.432 20 5 GGBDRN C[NH+](C)CC1CCN(c2ccccc2NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC1 ZINC000279585569 1435516129 /nfs/dbraw/zinc/51/61/29/1435516129.db2.gz AIYLODYWKUJLDH-UHFFFAOYSA-N 0 0 398.463 3.331 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000279593041 1435516824 /nfs/dbraw/zinc/51/68/24/1435516824.db2.gz UPRDEQLDIPFMCM-UHFFFAOYSA-N 0 0 386.379 3.478 20 5 GGBDRN CN(CCCCCO)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000279600764 1435517872 /nfs/dbraw/zinc/51/78/72/1435517872.db2.gz VPMPWIHBQOTGQS-UHFFFAOYSA-N 0 0 377.363 3.037 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000279611853 1435518785 /nfs/dbraw/zinc/51/87/85/1435518785.db2.gz XBQCCXQLVJHVIQ-UHFFFAOYSA-N 0 0 397.479 3.259 20 5 GGBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CCC2(CC1)OCCO2 ZINC000279654027 1435524654 /nfs/dbraw/zinc/52/46/54/1435524654.db2.gz CEYRGPXTXGSKKW-UHFFFAOYSA-N 0 0 398.415 3.153 20 5 GGBDRN CCOC(=O)C1CCC(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC000279686481 1435529372 /nfs/dbraw/zinc/52/93/72/1435529372.db2.gz BKFNSPZZCDDURW-UHFFFAOYSA-N 0 0 386.807 3.168 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NC1CCN(CC(F)(F)F)CC1 ZINC000279686764 1435529640 /nfs/dbraw/zinc/52/96/40/1435529640.db2.gz BMSCNKRXDVBOIG-UHFFFAOYSA-N 0 0 397.756 3.073 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC(NC(=O)c2ccccc2)CC1 ZINC000279692595 1435530356 /nfs/dbraw/zinc/53/03/56/1435530356.db2.gz IEGALTJURUFASR-UHFFFAOYSA-N 0 0 397.431 3.028 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 ZINC000279691178 1435530443 /nfs/dbraw/zinc/53/04/43/1435530443.db2.gz HXELXGMXHRDVOJ-KRWDZBQOSA-N 0 0 399.403 3.363 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2cc(C)cc([N+](=O)[O-])c2)sc1C ZINC000279707897 1435533271 /nfs/dbraw/zinc/53/32/71/1435533271.db2.gz PPNQIPZXZIWEAX-CQSZACIVSA-N 0 0 389.433 3.432 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)c2c(OCC)cccc2[N+](=O)[O-])nc1C ZINC000279736478 1435536572 /nfs/dbraw/zinc/53/65/72/1435536572.db2.gz OICDWARYKRYPAW-UHFFFAOYSA-N 0 0 379.394 3.187 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)sc1C ZINC000279742686 1435537210 /nfs/dbraw/zinc/53/72/10/1435537210.db2.gz UAQOILVSAQIIJF-ZDUSSCGKSA-N 0 0 375.406 3.124 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000279770277 1435540766 /nfs/dbraw/zinc/54/07/66/1435540766.db2.gz MUEXUUADRXHHBA-CQSZACIVSA-N 0 0 399.451 3.075 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H](CO)CC2CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000279790278 1435543631 /nfs/dbraw/zinc/54/36/31/1435543631.db2.gz DGGXEFDYGLVCKC-WMLDXEAASA-N 0 0 398.463 3.444 20 5 GGBDRN COc1cc(C(=O)N2CCC(O)(Cc3cccc(C)c3)CC2)cc([N+](=O)[O-])c1C ZINC000279796758 1435544402 /nfs/dbraw/zinc/54/44/02/1435544402.db2.gz DTJPNKKXGZUFGQ-UHFFFAOYSA-N 0 0 398.459 3.430 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)c3sc(C)nc3C)CC2)ccc1[N+](=O)[O-] ZINC000279798646 1435544687 /nfs/dbraw/zinc/54/46/87/1435544687.db2.gz LRAJBOVRUCYVSO-UHFFFAOYSA-N 0 0 390.465 3.029 20 5 GGBDRN Cc1c(C(=O)O[C@@H]([C@@H]2CCCOC2)C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000279804047 1435545410 /nfs/dbraw/zinc/54/54/10/1435545410.db2.gz YHDDZHVJUTUTAD-RNCFNFMXSA-N 0 0 392.286 3.326 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC(n2c(C)nc3ccccc32)CC1 ZINC000279816394 1435546830 /nfs/dbraw/zinc/54/68/30/1435546830.db2.gz OVLZMUFTCMUNKC-UHFFFAOYSA-N 0 0 396.451 3.012 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccccc1CN1CCCC1=O ZINC000279824908 1435547670 /nfs/dbraw/zinc/54/76/70/1435547670.db2.gz YMEYRRHBRPOWHN-UHFFFAOYSA-N 0 0 397.431 3.046 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@@H]2CCCOC2)[nH]n1 ZINC000279839899 1435549965 /nfs/dbraw/zinc/54/99/65/1435549965.db2.gz FLPPDNNILXCCOT-NWDGAFQWSA-N 0 0 376.438 3.331 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000279856619 1435553009 /nfs/dbraw/zinc/55/30/09/1435553009.db2.gz GCILVTPHQOIILT-SECBINFHSA-N 0 0 384.314 3.483 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C(C)C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000279866816 1435555000 /nfs/dbraw/zinc/55/50/00/1435555000.db2.gz GBVHZKNLAGYPAU-QGZVFWFLSA-N 0 0 392.433 3.040 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(OC)c(OC)cc1OC ZINC000279867187 1435555149 /nfs/dbraw/zinc/55/51/49/1435555149.db2.gz BVTZLVVSGXGBMA-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN COc1ccc([C@@H](CO)N(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cc1 ZINC000279867909 1435555451 /nfs/dbraw/zinc/55/54/51/1435555451.db2.gz SQYYCBGVZMZRTB-QGZVFWFLSA-N 0 0 396.802 3.130 20 5 GGBDRN COc1cc(CNc2ccc(F)c(N3CCOC3=O)c2)c([N+](=O)[O-])cc1OC ZINC000279874122 1435556247 /nfs/dbraw/zinc/55/62/47/1435556247.db2.gz UEJNVXMCDANXHA-UHFFFAOYSA-N 0 0 391.355 3.320 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1N1C(=O)CNC1=O ZINC000279914199 1435562144 /nfs/dbraw/zinc/56/21/44/1435562144.db2.gz GENBRBDZWRHRIT-UHFFFAOYSA-N 0 0 396.403 3.335 20 5 GGBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000279972368 1435571132 /nfs/dbraw/zinc/57/11/32/1435571132.db2.gz KYYJUNAYRVPZDH-VIFPVBQESA-N 0 0 382.323 3.066 20 5 GGBDRN CCOc1cc(NC(=O)N2CCC[C@](C)(O)CC2)c([N+](=O)[O-])cc1OCC ZINC000279989351 1435573123 /nfs/dbraw/zinc/57/31/23/1435573123.db2.gz KIOOCZXSNHWAGV-SFHVURJKSA-N 0 0 381.429 3.161 20 5 GGBDRN C[C@](O)(CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C(F)(F)F ZINC000280007747 1435575961 /nfs/dbraw/zinc/57/59/61/1435575961.db2.gz XACXOMRRLNBWQR-KRWDZBQOSA-N 0 0 398.337 3.217 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CCNC(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000280018130 1435577552 /nfs/dbraw/zinc/57/75/52/1435577552.db2.gz NQAOJBJJHRITKL-UHFFFAOYSA-N 0 0 389.452 3.211 20 5 GGBDRN CO[C@]1(C)CCCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000280051801 1435583529 /nfs/dbraw/zinc/58/35/29/1435583529.db2.gz PZXZWJQFOIQVFC-HXUWFJFHSA-N 0 0 375.469 3.229 20 5 GGBDRN CN(C)C(=O)Nc1ccc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000280071122 1435586493 /nfs/dbraw/zinc/58/64/93/1435586493.db2.gz NBBIHUVCYSJDMY-UHFFFAOYSA-N 0 0 397.435 3.193 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000280070695 1435586669 /nfs/dbraw/zinc/58/66/69/1435586669.db2.gz HRDSWAVDINTYRC-OAHLLOKOSA-N 0 0 399.451 3.419 20 5 GGBDRN COCCOC1CCC(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])CC1 ZINC000280103184 1435592926 /nfs/dbraw/zinc/59/29/26/1435592926.db2.gz KWXKOSRUZBBHQL-UHFFFAOYSA-N 0 0 393.484 3.043 20 5 GGBDRN CC(C)CC(=O)N1CCC(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC000280118364 1435595149 /nfs/dbraw/zinc/59/51/49/1435595149.db2.gz KWBILGDJVQGDTC-UHFFFAOYSA-N 0 0 399.850 3.083 20 5 GGBDRN COCCOC1CCC(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000280122602 1435595940 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CC(C)N1CCO[C@@H](c2noc(-c3cc([N+](=O)[O-])ccc3N3CCCC3)n2)C1 ZINC000280255464 1435619731 /nfs/dbraw/zinc/61/97/31/1435619731.db2.gz JFVGIOGAQRWIQR-QGZVFWFLSA-N 0 0 387.440 3.027 20 5 GGBDRN Cc1ccc(N[C@@H](C)CCc2ccccc2[N+](=O)[O-])cc1N1C(=O)CNC1=O ZINC000280292745 1435628252 /nfs/dbraw/zinc/62/82/52/1435628252.db2.gz OGJCOUJMIBIHSJ-AWEZNQCLSA-N 0 0 382.420 3.393 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc1[N+](=O)[O-] ZINC000280312909 1435632862 /nfs/dbraw/zinc/63/28/62/1435632862.db2.gz XWAAINPJPZMHFI-UKRRQHHQSA-N 0 0 387.440 3.413 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccnc(OCC(F)(F)F)c1 ZINC000280360151 1435644065 /nfs/dbraw/zinc/64/40/65/1435644065.db2.gz IUKNOBOMFIBEIL-UHFFFAOYSA-N 0 0 399.325 3.260 20 5 GGBDRN Cc1c(N[C@@H](C)CCc2ccccc2[N+](=O)[O-])cccc1N1C(=O)CNC1=O ZINC000280383625 1435649861 /nfs/dbraw/zinc/64/98/61/1435649861.db2.gz WGOZMUCRBJRXPR-ZDUSSCGKSA-N 0 0 382.420 3.393 20 5 GGBDRN CCOc1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])c([N+](=O)[O-])cc1OCC ZINC000280390700 1435651118 /nfs/dbraw/zinc/65/11/18/1435651118.db2.gz FONBYCDHWITBIM-UHFFFAOYSA-N 0 0 389.364 3.482 20 5 GGBDRN Cc1cc(OCC(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1[N+](=O)[O-] ZINC000280427080 1435658874 /nfs/dbraw/zinc/65/88/74/1435658874.db2.gz RNABICIGJZRJPT-HNNXBMFYSA-N 0 0 395.419 3.082 20 5 GGBDRN CCC[C@@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](O)c1ccccc1 ZINC000280428439 1435659088 /nfs/dbraw/zinc/65/90/88/1435659088.db2.gz PXARSQJZPIOCQC-APWZRJJASA-N 0 0 397.435 3.173 20 5 GGBDRN Cc1cc(OCC(=O)Nc2ccccc2C(=O)N2CCCC2)ccc1[N+](=O)[O-] ZINC000280428773 1435659521 /nfs/dbraw/zinc/65/95/21/1435659521.db2.gz RVKJTVWFKVBONU-UHFFFAOYSA-N 0 0 383.404 3.157 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](CCS(C)(=O)=O)c1ccccc1 ZINC000280440410 1435661348 /nfs/dbraw/zinc/66/13/48/1435661348.db2.gz JZIVMVRHVFAUIO-INIZCTEOSA-N 0 0 390.461 3.369 20 5 GGBDRN C[C@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC2(CCOCC2)O1 ZINC000280467677 1435665657 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/nfs/dbraw/zinc/80/23/51/1435802351.db2.gz XFKCUVVPPBTIIK-CVEARBPZSA-N 0 0 385.445 3.003 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O ZINC000281286978 1435802426 /nfs/dbraw/zinc/80/24/26/1435802426.db2.gz CFCIJDZLIVYAOR-GUDXXQAFSA-N 0 0 377.441 3.397 20 5 GGBDRN O=C(CCNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])NC1CCCCC1 ZINC000281302502 1435803066 /nfs/dbraw/zinc/80/30/66/1435803066.db2.gz YYWXSHQKIHTFRF-UHFFFAOYSA-N 0 0 396.447 3.226 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000281302530 1435803093 /nfs/dbraw/zinc/80/30/93/1435803093.db2.gz AUDJVBNFGSGRJS-QGZVFWFLSA-N 0 0 394.435 3.364 20 5 GGBDRN Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000281306241 1435803249 /nfs/dbraw/zinc/80/32/49/1435803249.db2.gz KGEXVZNREYJLSM-KRWDZBQOSA-N 0 0 384.392 3.157 20 5 GGBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 ZINC000281319462 1435803680 /nfs/dbraw/zinc/80/36/80/1435803680.db2.gz ITXBTWNNBSFBIT-LBPRGKRZSA-N 0 0 387.392 3.081 20 5 GGBDRN Cc1nc(C2(NC(=O)CCOc3cc(C)ccc3[N+](=O)[O-])CCCCC2)no1 ZINC000281332250 1435804091 /nfs/dbraw/zinc/80/40/91/1435804091.db2.gz UDFBTSXVLHSIJL-UHFFFAOYSA-N 0 0 388.424 3.339 20 5 GGBDRN Cn1ncc2c1C[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)CC2 ZINC000281333812 1435804293 /nfs/dbraw/zinc/80/42/93/1435804293.db2.gz VZKHZCLQVKGUBX-GFCCVEGCSA-N 0 0 396.369 3.024 20 5 GGBDRN CC(C)(C)Nc1ccccc1NC(=O)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000281342512 1435804582 /nfs/dbraw/zinc/80/45/82/1435804582.db2.gz DBDFQOYFFULETG-UHFFFAOYSA-N 0 0 384.436 3.103 20 5 GGBDRN CC[C@H](C)N(CC(=O)OC)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000281342889 1435804611 /nfs/dbraw/zinc/80/46/11/1435804611.db2.gz LNGKJOINNGFIOW-NSHDSACASA-N 0 0 377.422 3.132 20 5 GGBDRN CC[C@@H](C)N(CC(=O)OC)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000281342888 1435804652 /nfs/dbraw/zinc/80/46/52/1435804652.db2.gz LNGKJOINNGFIOW-LLVKDONJSA-N 0 0 377.422 3.132 20 5 GGBDRN Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000281347291 1435804829 /nfs/dbraw/zinc/80/48/29/1435804829.db2.gz LVLICELDUVECII-SFHVURJKSA-N 0 0 383.404 3.073 20 5 GGBDRN COc1ccc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1OCCO ZINC000281348551 1435805018 /nfs/dbraw/zinc/80/50/18/1435805018.db2.gz VIFYYXCXUGVUEA-UHFFFAOYSA-N 0 0 388.420 3.025 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000281361782 1435805670 /nfs/dbraw/zinc/80/56/70/1435805670.db2.gz BVLJOCWZIQIMIV-INIZCTEOSA-N 0 0 398.463 3.487 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1 ZINC000281426941 1435808363 /nfs/dbraw/zinc/80/83/63/1435808363.db2.gz DVKXHICOSPCFOB-UHFFFAOYSA-N 0 0 398.419 3.289 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2nc(C(F)(F)F)cs2)c1 ZINC000281475823 1435810454 /nfs/dbraw/zinc/81/04/54/1435810454.db2.gz GOEVLHQPCTWZSI-UHFFFAOYSA-N 0 0 389.355 3.464 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCSC[C@H]2c2nccs2)c1 ZINC000281485072 1435810826 /nfs/dbraw/zinc/81/08/26/1435810826.db2.gz HDSHUTDOXZEPAJ-AWEZNQCLSA-N 0 0 393.490 3.445 20 5 GGBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000281493606 1435811128 /nfs/dbraw/zinc/81/11/28/1435811128.db2.gz QHGUSURFRBAJDO-LBPRGKRZSA-N 0 0 389.408 3.311 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c1[N+](=O)[O-] ZINC000281503020 1435811561 /nfs/dbraw/zinc/81/15/61/1435811561.db2.gz VYKKERJSUCEUIG-QGZVFWFLSA-N 0 0 383.404 3.073 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000281505320 1435811616 /nfs/dbraw/zinc/81/16/16/1435811616.db2.gz FUZPSGAMUVEYEE-AWEZNQCLSA-N 0 0 388.424 3.196 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H](OCc3ccncc3)C2)cc1Cl ZINC000281513167 1435811752 /nfs/dbraw/zinc/81/17/52/1435811752.db2.gz PTHZAKIPMHXZLP-CYBMUJFWSA-N 0 0 391.811 3.225 20 5 GGBDRN CO[C@H](C)c1nc(CNC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1 ZINC000281536501 1435812597 /nfs/dbraw/zinc/81/25/97/1435812597.db2.gz JYGLHCSMIADTMO-GFCCVEGCSA-N 0 0 379.438 3.152 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(C)s1 ZINC000281538761 1435812679 /nfs/dbraw/zinc/81/26/79/1435812679.db2.gz UMRUKBCKIIHGJH-NSHDSACASA-N 0 0 391.449 3.049 20 5 GGBDRN COC[C@H](C)Nc1ccccc1NC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000281537932 1435812738 /nfs/dbraw/zinc/81/27/38/1435812738.db2.gz SEAYXKBJPGMJDH-DJJJIMSYSA-N 0 0 398.419 3.173 20 5 GGBDRN COC[C@@H](C)Nc1ccccc1NC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000281537926 1435812743 /nfs/dbraw/zinc/81/27/43/1435812743.db2.gz SEAYXKBJPGMJDH-BFUOFWGJSA-N 0 0 398.419 3.173 20 5 GGBDRN COC[C@H](C)Nc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000281582185 1435814440 /nfs/dbraw/zinc/81/44/40/1435814440.db2.gz UZMHSXSDHUVYJX-ZDUSSCGKSA-N 0 0 389.408 3.068 20 5 GGBDRN C[C@]1(C(F)(F)F)c2ccccc2CCN1C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000281597444 1435815182 /nfs/dbraw/zinc/81/51/82/1435815182.db2.gz VDCOUTDUGYQDAS-MRXNPFEDSA-N 0 0 382.342 3.044 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccccc2C[S@](C)=O)c1 ZINC000281666256 1435817601 /nfs/dbraw/zinc/81/76/01/1435817601.db2.gz SVJSKTIZNULBQM-SANMLTNESA-N 0 0 376.434 3.189 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000281671681 1435817851 /nfs/dbraw/zinc/81/78/51/1435817851.db2.gz BQVWAFRQMQUFPL-LBPRGKRZSA-N 0 0 383.470 3.423 20 5 GGBDRN CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)[C@H](C)C1 ZINC000281669443 1435817908 /nfs/dbraw/zinc/81/79/08/1435817908.db2.gz DNLHNZDGLKXARA-WBVHZDCISA-N 0 0 375.469 3.471 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC(C)(C)c1cccs1 ZINC000281681265 1435818287 /nfs/dbraw/zinc/81/82/87/1435818287.db2.gz MZIMWOLUNLAITB-UHFFFAOYSA-N 0 0 391.449 3.088 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000281736424 1435819965 /nfs/dbraw/zinc/81/99/65/1435819965.db2.gz IGPGWKJNIPHQIH-ZDUSSCGKSA-N 0 0 393.444 3.149 20 5 GGBDRN Cc1cc(OCC(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000281735375 1435820036 /nfs/dbraw/zinc/82/00/36/1435820036.db2.gz RGLKJTDQQMANBI-LOKFHWFJSA-N 0 0 390.461 3.239 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000281736419 1435820039 /nfs/dbraw/zinc/82/00/39/1435820039.db2.gz IGPGWKJNIPHQIH-CYBMUJFWSA-N 0 0 393.444 3.149 20 5 GGBDRN CCN(C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)[C@@H]1CCNC1=O ZINC000281753600 1435820819 /nfs/dbraw/zinc/82/08/19/1435820819.db2.gz IBWRXDVAPBJYDV-QGZVFWFLSA-N 0 0 385.445 3.097 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](C)C[C@@H](O)c2cccs2)c1 ZINC000281764569 1435821127 /nfs/dbraw/zinc/82/11/27/1435821127.db2.gz ZGLDMEQRQMMHBB-UKRRQHHQSA-N 0 0 378.450 3.362 20 5 GGBDRN O=C(Nc1ccc(Cl)c(CN2CCOCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000281813683 1435822867 /nfs/dbraw/zinc/82/28/67/1435822867.db2.gz NPKJSJGVXQJGOK-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN COc1ccccc1N1C[C@@H](C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)CC1=O ZINC000281852442 1435824380 /nfs/dbraw/zinc/82/43/80/1435824380.db2.gz BGFJNVLSPXZQHA-LBPRGKRZSA-N 0 0 387.367 3.043 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2CCCC23CCOCC3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000281866796 1435824780 /nfs/dbraw/zinc/82/47/80/1435824780.db2.gz CGIXSSRYHPBOHB-OAHLLOKOSA-N 0 0 377.397 3.199 20 5 GGBDRN COc1ccc(CNC(=O)C(C)(C)Cc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000281880637 1435825344 /nfs/dbraw/zinc/82/53/44/1435825344.db2.gz NZXMNHMRNRYVAQ-UHFFFAOYSA-N 0 0 382.420 3.365 20 5 GGBDRN O=C(NCC1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1)C(F)(F)F ZINC000281903330 1435826125 /nfs/dbraw/zinc/82/61/25/1435826125.db2.gz PKFWIHVDMPDEPF-UHFFFAOYSA-N 0 0 397.300 3.091 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cc([N+](=O)[O-])c1OC ZINC000281908475 1435826340 /nfs/dbraw/zinc/82/63/40/1435826340.db2.gz GLCDKJQKXSZGRX-DUFGSWQCSA-N 0 0 392.452 3.014 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H](CO)c1ccc(OC)cc1 ZINC000281912403 1435826559 /nfs/dbraw/zinc/82/65/59/1435826559.db2.gz JBWVRWRLRCEONJ-KRWDZBQOSA-N 0 0 389.408 3.199 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000281916157 1435826694 /nfs/dbraw/zinc/82/66/94/1435826694.db2.gz GUCMGDMQCSLZIQ-QUSXHRHCSA-N 0 0 399.447 3.250 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000281926014 1435827129 /nfs/dbraw/zinc/82/71/29/1435827129.db2.gz LEXKJTLFFWWSJN-AWEZNQCLSA-N 0 0 377.441 3.362 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 ZINC000281928568 1435827233 /nfs/dbraw/zinc/82/72/33/1435827233.db2.gz KKMYZCTUQWFUJL-NSHDSACASA-N 0 0 384.392 3.371 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 ZINC000281928563 1435827284 /nfs/dbraw/zinc/82/72/84/1435827284.db2.gz KKMYZCTUQWFUJL-LLVKDONJSA-N 0 0 384.392 3.371 20 5 GGBDRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(N3CCOC3=O)cc2)ccc1[N+](=O)[O-] ZINC000281935762 1435827536 /nfs/dbraw/zinc/82/75/36/1435827536.db2.gz IGMAZOQHNWYAFT-CQSZACIVSA-N 0 0 399.403 3.116 20 5 GGBDRN Cc1cc(OCC(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)ccc1[N+](=O)[O-] ZINC000281938723 1435827578 /nfs/dbraw/zinc/82/75/78/1435827578.db2.gz IOKFIXZRHCISFY-SFHVURJKSA-N 0 0 399.403 3.038 20 5 GGBDRN Cc1cc(OCC(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)ccc1[N+](=O)[O-] ZINC000281938720 1435827600 /nfs/dbraw/zinc/82/76/00/1435827600.db2.gz IOKFIXZRHCISFY-GOSISDBHSA-N 0 0 399.403 3.038 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CCCC12CCOCC2 ZINC000281947601 1435827993 /nfs/dbraw/zinc/82/79/93/1435827993.db2.gz ILGOPQXLBAQXEW-INIZCTEOSA-N 0 0 382.844 3.483 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C[S@](C)=O)c1ccccc1 ZINC000281967785 1435828927 /nfs/dbraw/zinc/82/89/27/1435828927.db2.gz NRHPAIABYPCFMA-OQRWROFFSA-N 0 0 391.449 3.235 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C[S@@](C)=O)c1ccccc1 ZINC000281967778 1435828934 /nfs/dbraw/zinc/82/89/34/1435828934.db2.gz NRHPAIABYPCFMA-CHAGWJKLSA-N 0 0 391.449 3.235 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCCOC)Cc1ccncc1 ZINC000281969409 1435829077 /nfs/dbraw/zinc/82/90/77/1435829077.db2.gz NUODODGWPRYNHK-UHFFFAOYSA-N 0 0 388.424 3.459 20 5 GGBDRN CO[C@H]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000281998454 1435830410 /nfs/dbraw/zinc/83/04/10/1435830410.db2.gz XRJOEBTZCTVYNO-WBVHZDCISA-N 0 0 375.469 3.471 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000282014561 1435831071 /nfs/dbraw/zinc/83/10/71/1435831071.db2.gz PWCNRMDFHVWLJQ-INIZCTEOSA-N 0 0 387.440 3.257 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCSC2(CCOCC2)C1 ZINC000282016592 1435831243 /nfs/dbraw/zinc/83/12/43/1435831243.db2.gz RUUUEYQOGJMIGR-UHFFFAOYSA-N 0 0 381.454 3.123 20 5 GGBDRN O=C(NC1CC1)c1ccc(NC2CCN(c3nccs3)CC2)c([N+](=O)[O-])c1 ZINC000282018522 1435831266 /nfs/dbraw/zinc/83/12/66/1435831266.db2.gz YJBJHGDYXDQUNM-UHFFFAOYSA-N 0 0 387.465 3.024 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000282033261 1435831935 /nfs/dbraw/zinc/83/19/35/1435831935.db2.gz 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IIBKODSRWINSKB-KRWDZBQOSA-N 0 0 388.420 3.082 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c1 ZINC000283061345 1435872722 /nfs/dbraw/zinc/87/27/22/1435872722.db2.gz IHGCASJJNLLJJN-OAHLLOKOSA-N 0 0 397.431 3.119 20 5 GGBDRN CCc1c(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cnn1-c1ccccn1 ZINC000283067161 1435872899 /nfs/dbraw/zinc/87/28/99/1435872899.db2.gz DJJAMUSNXCINNZ-UHFFFAOYSA-N 0 0 379.420 3.053 20 5 GGBDRN CCOCCOCc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1C ZINC000283081602 1435873629 /nfs/dbraw/zinc/87/36/29/1435873629.db2.gz URQDKVXOXMHRQS-UHFFFAOYSA-N 0 0 394.449 3.257 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)[C@@H]1CCCCN1C(=O)c1ccco1 ZINC000283085112 1435873674 /nfs/dbraw/zinc/87/36/74/1435873674.db2.gz QEBHQLGQIYSPEJ-ZDUSSCGKSA-N 0 0 377.784 3.475 20 5 GGBDRN CO[C@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2Cc2cccs2)C1 ZINC000283130360 1435875945 /nfs/dbraw/zinc/87/59/45/1435875945.db2.gz XNBRNRAHELJXLN-HNNXBMFYSA-N 0 0 385.449 3.188 20 5 GGBDRN COC(=O)c1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000283168913 1435877672 /nfs/dbraw/zinc/87/76/72/1435877672.db2.gz DAXKXEKYOLBFNC-UHFFFAOYSA-N 0 0 387.392 3.096 20 5 GGBDRN C[C@@H](COCC(F)(F)F)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000283188754 1435878495 /nfs/dbraw/zinc/87/84/95/1435878495.db2.gz YMNTUPPYTIHECD-NSHDSACASA-N 0 0 383.326 3.354 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(-c2cccnc2)n1C[C@@H]1CCCO1 ZINC000283222717 1435880044 /nfs/dbraw/zinc/88/00/44/1435880044.db2.gz CIGBCSNJPBKWOW-KRWDZBQOSA-N 0 0 394.435 3.064 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1 ZINC000283236581 1435880635 /nfs/dbraw/zinc/88/06/35/1435880635.db2.gz PSWQLTRHYFYZAY-UHFFFAOYSA-N 0 0 398.423 3.226 20 5 GGBDRN CN(Cc1ccco1)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@@H]1CCOC1 ZINC000283261781 1435881854 /nfs/dbraw/zinc/88/18/54/1435881854.db2.gz FEWNCACZQWJGDS-AWEZNQCLSA-N 0 0 383.408 3.119 20 5 GGBDRN CN(Cc1ccco1)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@H]1CCOC1 ZINC000283261789 1435881889 /nfs/dbraw/zinc/88/18/89/1435881889.db2.gz FEWNCACZQWJGDS-CQSZACIVSA-N 0 0 383.408 3.119 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000283272263 1435882345 /nfs/dbraw/zinc/88/23/45/1435882345.db2.gz VSDZNFVDLBZLRI-SJCJKPOMSA-N 0 0 377.347 3.105 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000283272267 1435882348 /nfs/dbraw/zinc/88/23/48/1435882348.db2.gz VSDZNFVDLBZLRI-SJKOYZFVSA-N 0 0 377.347 3.105 20 5 GGBDRN Cc1cccc(C)c1CS(=O)(=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283343060 1435885179 /nfs/dbraw/zinc/88/51/79/1435885179.db2.gz AYCWSZKDRYGRSS-UHFFFAOYSA-N 0 0 376.434 3.155 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)c1 ZINC000283350689 1435885639 /nfs/dbraw/zinc/88/56/39/1435885639.db2.gz ZBBRFPTUEKAQML-KRWDZBQOSA-N 0 0 389.452 3.047 20 5 GGBDRN C[C@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccc([S@@](C)=O)cc1 ZINC000283369672 1435886406 /nfs/dbraw/zinc/88/64/06/1435886406.db2.gz CMQFWDBEFWNQLO-PGGUUEOZSA-N 0 0 389.477 3.277 20 5 GGBDRN C[C@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccc([S@](C)=O)cc1 ZINC000283369674 1435886462 /nfs/dbraw/zinc/88/64/62/1435886462.db2.gz CMQFWDBEFWNQLO-PWFNWSNSSA-N 0 0 389.477 3.277 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(-c2ccccn2)n1C[C@H]1CCCO1 ZINC000283369778 1435886521 /nfs/dbraw/zinc/88/65/21/1435886521.db2.gz KMLDPECBOGSIHI-MRXNPFEDSA-N 0 0 394.435 3.064 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000283379643 1435886998 /nfs/dbraw/zinc/88/69/98/1435886998.db2.gz KBCHJMOMSKIBJK-ATZDWAIDSA-N 0 0 379.416 3.344 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(N3CCCCC3)nc2)c1 ZINC000283418914 1435888956 /nfs/dbraw/zinc/88/89/56/1435888956.db2.gz ILWKGRBHKSFEFS-UHFFFAOYSA-N 0 0 384.436 3.309 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N[C@@H]1CCCC12CCOCC2 ZINC000283429516 1435889481 /nfs/dbraw/zinc/88/94/81/1435889481.db2.gz HFNNVIVTAICIHO-CQSZACIVSA-N 0 0 390.408 3.352 20 5 GGBDRN CCCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H](C)C(=O)Nc1ccccc1 ZINC000283448841 1435890298 /nfs/dbraw/zinc/89/02/98/1435890298.db2.gz KOUVAUWAHHWAGN-GFCCVEGCSA-N 0 0 388.399 3.196 20 5 GGBDRN Cc1occc1CN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@H]1CCOC1 ZINC000283475088 1435891584 /nfs/dbraw/zinc/89/15/84/1435891584.db2.gz SSHSJRFABSOBBP-OAHLLOKOSA-N 0 0 397.435 3.428 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc2c(c1)NC(=O)CCS2 ZINC000283480985 1435891806 /nfs/dbraw/zinc/89/18/06/1435891806.db2.gz ZCBHQCYWAUEFNW-UHFFFAOYSA-N 0 0 385.445 3.344 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3C[C@@H]4CCC[C@H]4C3)n2C[C@@H]2CCCO2)c1 ZINC000283497042 1435892636 /nfs/dbraw/zinc/89/26/36/1435892636.db2.gz QPQYFQABJYJXOS-BQFCYCMXSA-N 0 0 383.452 3.269 20 5 GGBDRN CCCS(=O)(=O)c1ccccc1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283534241 1435894250 /nfs/dbraw/zinc/89/42/50/1435894250.db2.gz HTYURWZNYDUISO-UHFFFAOYSA-N 0 0 390.461 3.093 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCc1nnc(-c2ccccc2)o1 ZINC000283542243 1435894708 /nfs/dbraw/zinc/89/47/08/1435894708.db2.gz IIAMQMFSRNTDHW-UHFFFAOYSA-N 0 0 380.404 3.279 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(-c2cccn2C)n1C[C@H]1CCCO1 ZINC000283546951 1435894821 /nfs/dbraw/zinc/89/48/21/1435894821.db2.gz SYOISBCAJOYSLZ-MRXNPFEDSA-N 0 0 396.451 3.007 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3C[C@@H]4CCC[C@H]4C3)n2C[C@@H]2CCOC2)c1 ZINC000283565387 1435895705 /nfs/dbraw/zinc/89/57/05/1435895705.db2.gz ZLAUTGYGEJFZGU-XIRDDKMYSA-N 0 0 383.452 3.126 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OC(F)F)nc2)cc1OC ZINC000283564260 1435895744 /nfs/dbraw/zinc/89/57/44/1435895744.db2.gz JBHMONBBEIMLCB-UHFFFAOYSA-N 0 0 383.307 3.251 20 5 GGBDRN Cc1nc(COc2cccc(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)c2)no1 ZINC000283566939 1435895836 /nfs/dbraw/zinc/89/58/36/1435895836.db2.gz KBEOYCVWLWGGNT-UHFFFAOYSA-N 0 0 396.403 3.180 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000283567523 1435895873 /nfs/dbraw/zinc/89/58/73/1435895873.db2.gz JHFISWGQRXMOIL-CVEARBPZSA-N 0 0 384.461 3.267 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)c1 ZINC000283565729 1435895893 /nfs/dbraw/zinc/89/58/93/1435895893.db2.gz VFTLFIRINGPBLC-OAHLLOKOSA-N 0 0 399.447 3.258 20 5 GGBDRN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000283588390 1435896781 /nfs/dbraw/zinc/89/67/81/1435896781.db2.gz LRAXRPXZCAZYEB-PKOBYXMFSA-N 0 0 384.432 3.417 20 5 GGBDRN COc1ccc(OC)c([C@H]2C[C@H]2C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000283588383 1435896785 /nfs/dbraw/zinc/89/67/85/1435896785.db2.gz LRAXRPXZCAZYEB-IEBWSBKVSA-N 0 0 384.432 3.417 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1 ZINC000283612331 1435897891 /nfs/dbraw/zinc/89/78/91/1435897891.db2.gz ZNYJOAFOUYUWDE-UHFFFAOYSA-N 0 0 393.440 3.123 20 5 GGBDRN CC(=O)c1cc(N2CCC[C@H](c3nnc4n3CCCCC4)C2)ccc1[N+](=O)[O-] ZINC000283619146 1435898137 /nfs/dbraw/zinc/89/81/37/1435898137.db2.gz SLTHSAZFZLSEEV-HNNXBMFYSA-N 0 0 383.452 3.499 20 5 GGBDRN CC(=O)N(CCC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000283694771 1435905427 /nfs/dbraw/zinc/90/54/27/1435905427.db2.gz UUKNYBMBXORQJN-UHFFFAOYSA-N 0 0 383.448 3.035 20 5 GGBDRN CC(C)S(=O)(=O)c1ccccc1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283698651 1435906224 /nfs/dbraw/zinc/90/62/24/1435906224.db2.gz VGOUYORAEPUGPW-UHFFFAOYSA-N 0 0 390.461 3.092 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C1CCC(NC(=O)C(C)(C)C)CC1 ZINC000283720931 1435910788 /nfs/dbraw/zinc/91/07/88/1435910788.db2.gz YAIIBBTWPOEIPJ-UHFFFAOYSA-N 0 0 389.496 3.317 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000283739926 1435914036 /nfs/dbraw/zinc/91/40/36/1435914036.db2.gz XJMZLTRZYLULBO-LPHOPBHVSA-N 0 0 385.464 3.333 20 5 GGBDRN Cn1c2ccc(CNC(=O)COc3ccccc3[N+](=O)[O-])cc2nc1C1CC1 ZINC000283753960 1435917164 /nfs/dbraw/zinc/91/71/64/1435917164.db2.gz QTOGRPNTPSPYSF-UHFFFAOYSA-N 0 0 380.404 3.054 20 5 GGBDRN O=C(CCS(=O)(=O)[C@@H]1CCCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000283759046 1435917851 /nfs/dbraw/zinc/91/78/51/1435917851.db2.gz HIVDUKITJQLVNA-GOSISDBHSA-N 0 0 388.445 3.416 20 5 GGBDRN Cn1cc([N+](=O)[O-])c(-c2nc(C3(NC(=O)OC(C)(C)C)CCCCC3)no2)n1 ZINC000283782310 1435922761 /nfs/dbraw/zinc/92/27/61/1435922761.db2.gz FNSSBWJJEQHAJG-UHFFFAOYSA-N 0 0 392.416 3.062 20 5 GGBDRN CCOC(=O)[C@@H](C)NC(=O)c1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1F ZINC000283789072 1435924142 /nfs/dbraw/zinc/92/41/42/1435924142.db2.gz FKLVYQICQMIZJB-GFCCVEGCSA-N 0 0 389.383 3.027 20 5 GGBDRN CC(C)(C)OC(=O)NC(C)(C)c1noc(-c2n[nH]c3ccc([N+](=O)[O-])cc32)n1 ZINC000283799794 1435926289 /nfs/dbraw/zinc/92/62/89/1435926289.db2.gz HPIWVBKFLSOYGI-UHFFFAOYSA-N 0 0 388.384 3.281 20 5 GGBDRN Cc1ccc(C)c(CS(=O)(=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000283808680 1435927866 /nfs/dbraw/zinc/92/78/66/1435927866.db2.gz OMSPFXPJGLNCDQ-UHFFFAOYSA-N 0 0 376.434 3.155 20 5 GGBDRN Cc1nc2cc(CNC(=O)COc3ccccc3[N+](=O)[O-])ccc2n1C1CC1 ZINC000283817255 1435929809 /nfs/dbraw/zinc/92/98/09/1435929809.db2.gz YMBRTKRDHQCCLD-UHFFFAOYSA-N 0 0 380.404 3.283 20 5 GGBDRN COC1(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)CCOCC1 ZINC000283981253 1435966424 /nfs/dbraw/zinc/96/64/24/1435966424.db2.gz SXECRXHWIKYIFG-UHFFFAOYSA-N 0 0 377.422 3.161 20 5 GGBDRN Cc1cccc([C@H](C)S(=O)(=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000284007257 1435972195 /nfs/dbraw/zinc/97/21/95/1435972195.db2.gz ZDZGOEVIDQYRCD-AWEZNQCLSA-N 0 0 376.434 3.408 20 5 GGBDRN CC[C@@H](c1ccccc1)S(=O)(=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000284021663 1435973718 /nfs/dbraw/zinc/97/37/18/1435973718.db2.gz ZYIKWQCITNJRFG-KRWDZBQOSA-N 0 0 376.434 3.490 20 5 GGBDRN C[C@@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000284042010 1435979278 /nfs/dbraw/zinc/97/92/78/1435979278.db2.gz IZXNZHBIIUPCML-CYBMUJFWSA-N 0 0 384.392 3.481 20 5 GGBDRN CCO[C@@H]1C[C@H](O)C12CCN(C(=O)Nc1cccc([N+](=O)[O-])c1Cl)CC2 ZINC000284067837 1435984625 /nfs/dbraw/zinc/98/46/25/1435984625.db2.gz QSZHSIKERNCKBX-UONOGXRCSA-N 0 0 383.832 3.032 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284067725 1435984744 /nfs/dbraw/zinc/98/47/44/1435984744.db2.gz KMRKCVCFJVQQRD-QDXKXIGTSA-N 0 0 377.422 3.433 20 5 GGBDRN COCc1ncsc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000284076548 1435986250 /nfs/dbraw/zinc/98/62/50/1435986250.db2.gz SBVRTCIJMBFVOU-UHFFFAOYSA-N 0 0 389.355 3.402 20 5 GGBDRN CC(C)(C)OC(=O)NC(C)(C)c1noc(-c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n1 ZINC000284120541 1435994309 /nfs/dbraw/zinc/99/43/09/1435994309.db2.gz XFPZVCVKQGTMGS-UHFFFAOYSA-N 0 0 393.356 3.313 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1-c1nc(C(C)(C)NC(=O)OC(C)(C)C)no1 ZINC000284164777 1436001041 /nfs/dbraw/zinc/00/10/41/1436001041.db2.gz ZRZYTBVOGDKYLL-UHFFFAOYSA-N 0 0 378.385 3.413 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[C@H](O)c2ccc(F)cc2)c1 ZINC000284225794 1436005367 /nfs/dbraw/zinc/00/53/67/1436005367.db2.gz BFSXIHFHYHVPSR-XIKOKIGWSA-N 0 0 376.384 3.375 20 5 GGBDRN O=C([C@@H]1CCC(=O)c2ccccc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000284315560 1436012554 /nfs/dbraw/zinc/01/25/54/1436012554.db2.gz LTNCMBJNENTRHO-LJQANCHMSA-N 0 0 379.416 3.004 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000284325336 1436013477 /nfs/dbraw/zinc/01/34/77/1436013477.db2.gz IHAWWDNAUPRHOV-SCLBCKFNSA-N 0 0 391.374 3.184 20 5 GGBDRN CCN(CC)C(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(C)c2F)cc1 ZINC000284449593 1436022765 /nfs/dbraw/zinc/02/27/65/1436022765.db2.gz WYRYECWKUHIUTJ-UHFFFAOYSA-N 0 0 387.411 3.454 20 5 GGBDRN NC(=O)[C@@H]1CCCN(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000284466008 1436023863 /nfs/dbraw/zinc/02/38/63/1436023863.db2.gz ARCHOMDNZYGYBK-CYBMUJFWSA-N 0 0 384.392 3.116 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000284514250 1436027542 /nfs/dbraw/zinc/02/75/42/1436027542.db2.gz VWCKOVOIWXHYOJ-SJKOYZFVSA-N 0 0 391.399 3.418 20 5 GGBDRN CCCN(C(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000284559800 1436030229 /nfs/dbraw/zinc/03/02/29/1436030229.db2.gz DZFVQOIZNLXMQS-QGZVFWFLSA-N 0 0 388.445 3.299 20 5 GGBDRN C[C@@]1(C2CC2)NC(=O)N(c2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2)C1=O ZINC000284643865 1436036661 /nfs/dbraw/zinc/03/66/61/1436036661.db2.gz VWFAAYODCADDFH-FQEVSTJZSA-N 0 0 394.387 3.072 20 5 GGBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC2(CCOCC2)CC1 ZINC000284647159 1436036935 /nfs/dbraw/zinc/03/69/35/1436036935.db2.gz DYRGVIQYKJNILD-CYBMUJFWSA-N 0 0 381.860 3.468 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC3(CCOCC3)CC2)cc1SC ZINC000284700495 1436041117 /nfs/dbraw/zinc/04/11/17/1436041117.db2.gz YXUINZCDFJIIFJ-UHFFFAOYSA-N 0 0 380.466 3.358 20 5 GGBDRN CCCCCC(=O)NC1CCN(C(=O)c2cc([N+](=O)[O-])cc(C)c2F)CC1 ZINC000284745215 1436045442 /nfs/dbraw/zinc/04/54/42/1436045442.db2.gz UAJWMVRATNCCOL-UHFFFAOYSA-N 0 0 379.432 3.343 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC2(CCOCC2)CC1 ZINC000284803192 1436051477 /nfs/dbraw/zinc/05/14/77/1436051477.db2.gz HGJKUTNYPPKSBG-UHFFFAOYSA-N 0 0 394.493 3.366 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCCCC2)cc1-c1nn[n-]n1 ZINC000826498720 1442006677 /nfs/dbraw/zinc/00/66/77/1442006677.db2.gz GZDAUAMJBYFXFB-UHFFFAOYSA-N 0 0 393.451 3.373 20 5 GGBDRN C[N@@H+]1CCC[C@H](CNc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000821623494 1442388335 /nfs/dbraw/zinc/38/83/35/1442388335.db2.gz MBRYVEQOBQKTGK-DYVFJYSZSA-N 0 0 399.480 3.331 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H](C[NH+]2CCCCC2)c2ccccc2)c(-c2nnn[n-]2)c1 ZINC000823640125 1443220808 /nfs/dbraw/zinc/22/08/08/1443220808.db2.gz ULEHHSSQIWLSSS-IBGZPJMESA-N 0 0 393.451 3.414 20 5 GGBDRN C[C@@H]([NH2+]CCSCc1ccccc1-c1nn[n-]n1)c1ccc([N+](=O)[O-])cc1 ZINC000820427244 1446843452 /nfs/dbraw/zinc/84/34/52/1446843452.db2.gz QOMCCWQJALNLLG-CYBMUJFWSA-N 0 0 384.465 3.359 20 5 GGBDRN C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC000820761583 1446980532 /nfs/dbraw/zinc/98/05/32/1446980532.db2.gz XZMWROBTNWSFRN-WMLDXEAASA-N 0 0 393.451 3.097 20 5 GGBDRN C[C@H]1C[C@H](Nc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000820669140 1447164069 /nfs/dbraw/zinc/16/40/69/1447164069.db2.gz YWQMNHCEGRZQAP-WMLDXEAASA-N 0 0 393.451 3.240 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1Cc1ccc(Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cc1 ZINC000824941636 1449267552 /nfs/dbraw/zinc/26/75/52/1449267552.db2.gz ZHVSNLCMQXNTRU-ZDUSSCGKSA-N 0 0 394.439 3.288 20 5 GGBDRN C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820420363 1450151451 /nfs/dbraw/zinc/15/14/51/1450151451.db2.gz PPDQFEPWFHTSQN-AWEZNQCLSA-N 0 0 393.451 3.095 20 5 GGBDRN C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)[C@@H]1c1ccc(Cl)cc1 ZINC000826029589 1450427320 /nfs/dbraw/zinc/42/73/20/1450427320.db2.gz UMILIOIGDGJIPR-SJORKVTESA-N 0 0 399.842 3.286 20 5 GGBDRN CCc1ccc([C@H](CNc2ccc([N+](=O)[O-])c(-c3nn[n-]n3)c2)[NH+](C)C)cc1 ZINC000825704069 1450504546 /nfs/dbraw/zinc/50/45/46/1450504546.db2.gz CBQFWUXFIPAKMY-SFHVURJKSA-N 0 0 381.440 3.052 20 5 GGBDRN O=C1Nc2ccccc2[C@@H]2CN(C(F)(F)c3cc([N+](=O)[O-])cnc3Cl)C[C@H]12 ZINC001164401840 718856627 /nfs/dbraw/zinc/85/66/27/718856627.db2.gz DCHTVVNULYCFBV-RYUDHWBXSA-N 0 0 394.765 3.360 20 5 GGBDRN O=[N+]([O-])c1cnc(Cl)c(C(F)(F)N2CC[C@@H](O)[C@@H]2Cc2ccccc2)c1 ZINC001164835630 720488190 /nfs/dbraw/zinc/48/81/90/720488190.db2.gz ZHZQWZZMHGBBNT-LSDHHAIUSA-N 0 0 383.782 3.370 20 5 GGBDRN CC[C@H]1N(C(F)(F)c2cc([N+](=O)[O-])cnc2Cl)CCC[C@@]12CCC(=O)N2 ZINC001164843873 720750284 /nfs/dbraw/zinc/75/02/84/720750284.db2.gz MCVLQQWREKQQQL-IUODEOHRSA-N 0 0 388.802 3.216 20 5 GGBDRN Cc1cc(N2C[C@@H]3CN(Cc4nccs4)C[C@H]3C2)nc2ccc([N+](=O)[O-])cc12 ZINC001164785899 721399839 /nfs/dbraw/zinc/39/98/39/721399839.db2.gz NNXORAUGHTUTFK-GJZGRUSLSA-N 0 0 395.488 3.476 20 5 GGBDRN O=[N+]([O-])c1cccc2ccc(N3C[C@H]4CN(Cc5nccs5)C[C@@H]4C3)nc21 ZINC001164782174 721407094 /nfs/dbraw/zinc/40/70/94/721407094.db2.gz DYIJORTWCXEABB-HUUCEWRRSA-N 0 0 381.461 3.168 20 5 GGBDRN Cc1cnc(N2CCc3c(CN(C)Cc4ccco4)cncc3C2)c([N+](=O)[O-])c1 ZINC001164908361 721745725 /nfs/dbraw/zinc/74/57/25/721745725.db2.gz GPICLACVOPYYQS-UHFFFAOYSA-N 0 0 393.447 3.481 20 5 GGBDRN Cc1cnc2n1CCN(C)C21CCN(c2ccc3ccc([N+](=O)[O-])cc3n2)CC1 ZINC001164916446 721814505 /nfs/dbraw/zinc/81/45/05/721814505.db2.gz DPDCXZLPQUATPW-UHFFFAOYSA-N 0 0 392.463 3.089 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(C=Cc3ccc(-c4nn[nH]n4)cn3)cs2)c1 ZINC000738368052 945263717 /nfs/dbraw/zinc/26/37/17/945263717.db2.gz ZKXMNFXKKMRYDD-SREVYHEPSA-N 0 0 377.389 3.464 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(-c2nn[nH]n2)cc1 ZINC000544226086 944636158 /nfs/dbraw/zinc/63/61/58/944636158.db2.gz JMJUNGRQTLWPLK-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)Nc2cc(-c3nn[nH]n3)ccc2O)cc1[N+](=O)[O-] ZINC000824137210 946599327 /nfs/dbraw/zinc/59/93/27/946599327.db2.gz YPCIBOXLJQUQRX-UHFFFAOYSA-N 0 0 382.380 3.030 20 5 GGBDRN C[C@@H](Nc1c([N+](=O)[O-])ncn1C)c1ccc(-c2cccc(-c3nn[nH]n3)c2)cc1 ZINC000824648006 946884773 /nfs/dbraw/zinc/88/47/73/946884773.db2.gz CTZXRCTWEPIULE-GFCCVEGCSA-N 0 0 390.407 3.349 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCO[C@H](c2cccc(-c3nn[nH]n3)c2)C1 ZINC000826293746 947852676 /nfs/dbraw/zinc/85/26/76/947852676.db2.gz ZVASQXNOTAVQMY-LIRRHRJNSA-N 0 0 394.435 3.218 20 5 GGBDRN Cc1sc(NC(=O)CSc2ccccc2[N+](=O)[O-])c(-c2nn[nH]n2)c1C ZINC000826349257 948090776 /nfs/dbraw/zinc/09/07/76/948090776.db2.gz BBRZJKBEICAXDI-UHFFFAOYSA-N 0 0 390.450 3.184 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H](O)CSc2ccc(-c3nn[nH]n3)cc2Cl)cc1 ZINC000826498453 948413326 /nfs/dbraw/zinc/41/33/26/948413326.db2.gz VKZKZHVXGWUVQM-ZDUSSCGKSA-N 0 0 377.813 3.254 20 5 GGBDRN C[C@H](c1cccc(-c2nn[nH]n2)c1)N(C)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC001575503225 949042419 /nfs/dbraw/zinc/04/24/19/949042419.db2.gz KLBFKWRGKHYNPR-GFCCVEGCSA-N 0 0 398.448 3.087 20 5 GGBDRN C[C@@H](c1cccc(-c2nn[nH]n2)c1)N(C)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC001575503228 949044229 /nfs/dbraw/zinc/04/42/29/949044229.db2.gz KLBFKWRGKHYNPR-LBPRGKRZSA-N 0 0 398.448 3.087 20 5 GGBDRN C[C@@H](c1cccc(-c2nn[nH]n2)c1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC001575514745 949177571 /nfs/dbraw/zinc/17/75/71/949177571.db2.gz YNWOZQRNHNXYIP-JTQLQIEISA-N 0 0 386.799 3.262 20 5 GGBDRN CC(C)(C)Oc1ccccc1CNc1ccc([N+](=O)[O-])c(N)c1-c1nn[nH]n1 ZINC001573876804 950682299 /nfs/dbraw/zinc/68/22/99/950682299.db2.gz WIOJFAXKLLISGW-UHFFFAOYSA-N 0 0 383.412 3.147 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCc2ccc(-c3nn[nH]n3)s2)cc1[N+](=O)[O-] ZINC001573882336 950776456 /nfs/dbraw/zinc/77/64/56/950776456.db2.gz ZMJRCBFIRCRSPZ-UHFFFAOYSA-N 0 0 386.437 3.064 20 5 GGBDRN CC(C)(C)n1cc(-c2nn[nH]n2)cc1NC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001573887977 950857399 /nfs/dbraw/zinc/85/73/99/950857399.db2.gz MDGPJNFQJADOLF-CABCVRRESA-N 0 0 395.423 3.074 20 5 GGBDRN CC(C)(C)n1cc(-c2nn[nH]n2)cc1NC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001573887980 950860732 /nfs/dbraw/zinc/86/07/32/950860732.db2.gz MDGPJNFQJADOLF-LSDHHAIUSA-N 0 0 395.423 3.074 20 5 GGBDRN O=C([O-])C[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001594987254 951024380 /nfs/dbraw/zinc/02/43/80/951024380.db2.gz WENUUPSMWVFCHV-NSHDSACASA-N 0 0 380.788 3.127 20 5 GGBDRN O=C([O-])CC[C@H]1CCC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001595017185 951297047 /nfs/dbraw/zinc/29/70/47/951297047.db2.gz RWPZTRVBFUSEMK-LLVKDONJSA-N 0 0 394.815 3.375 20 5 GGBDRN O=C([O-])CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CCOCC1 ZINC001595056071 951500313 /nfs/dbraw/zinc/50/03/13/951500313.db2.gz VQRBPRKNZYETOS-UHFFFAOYSA-N 0 0 377.224 3.357 20 5 GGBDRN C[C@@H](CNc1ccc([N+](=O)[O-])c(N)c1-c1nn[nH]n1)c1nc2ccccc2s1 ZINC001575133636 952105946 /nfs/dbraw/zinc/10/59/46/952105946.db2.gz FQIGNCZLALBZKK-VIFPVBQESA-N 0 0 396.436 3.182 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001595192811 952294551 /nfs/dbraw/zinc/29/45/51/952294551.db2.gz SXMFOZMKEUIYTR-AWEZNQCLSA-N 0 0 379.210 3.143 20 5 GGBDRN C[C@@H](Cc1nc2ccccc2s1)Nc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001575206006 952526314 /nfs/dbraw/zinc/52/63/14/952526314.db2.gz GCTRTZVXGOUXKY-JTQLQIEISA-N 0 0 381.421 3.428 20 5 GGBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@@H]2C(=O)[O-])cc1OC ZINC000566354205 953625231 /nfs/dbraw/zinc/62/52/31/953625231.db2.gz QHJNMHIWDMYGAC-UKRRQHHQSA-N 0 0 380.441 3.467 20 5 GGBDRN COc1cc(C[N@@H+]2CCCC[C@@H]2CC(=O)[O-])c([N+](=O)[O-])cc1OCC(F)F ZINC000593744294 953755178 /nfs/dbraw/zinc/75/51/78/953755178.db2.gz CMZJLSKJDUIHQG-GFCCVEGCSA-N 0 0 388.367 3.077 20 5 GGBDRN C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(N2CCC[C@@H](C(=O)[O-])C2)o1 ZINC001593755330 954447403 /nfs/dbraw/zinc/44/74/03/954447403.db2.gz HKIBCLYEQJVCTL-MRXNPFEDSA-N 0 0 387.436 3.163 20 5 GGBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@]2(C)C(=O)[O-])cc1OC ZINC001589458861 954856074 /nfs/dbraw/zinc/85/60/74/954856074.db2.gz NUTWVBVXZKAWOX-ORAYPTAESA-N 0 0 380.441 3.467 20 5 GGBDRN C[C@@]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])(C(=O)[O-])c1ccccc1 ZINC001589128811 956184649 /nfs/dbraw/zinc/18/46/49/956184649.db2.gz NWSAMCBSOYQVHY-INIZCTEOSA-N 0 0 379.210 3.447 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Br ZINC001574781773 957783079 /nfs/dbraw/zinc/78/30/79/957783079.db2.gz QSZDAGWKQGIBOB-HNNXBMFYSA-N 0 0 379.210 3.143 20 5 GGBDRN Cc1ccc(C[N@@H+]2CCCN(c3nc(C)cc(C(=O)[O-])c3[N+](=O)[O-])CC2)cc1 ZINC001329580151 961278985 /nfs/dbraw/zinc/27/89/85/961278985.db2.gz WEUUSFQGSMSTQN-UHFFFAOYSA-N 0 0 384.436 3.017 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2C[C@@H](C)[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1 ZINC000263351749 962505606 /nfs/dbraw/zinc/50/56/06/962505606.db2.gz PYSQEBLBIWBMTC-IDHHARJASA-N 0 0 397.431 3.236 20 5 GGBDRN COc1cc(C[NH2+]Cc2ccc(C(=O)[O-])cc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000263445083 962629008 /nfs/dbraw/zinc/62/90/08/962629008.db2.gz XOUJPJZROBKZOZ-UHFFFAOYSA-N 0 0 396.346 3.235 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](c2ccccc2)[C@H](C(=O)[O-])C1 ZINC001605309891 973130729 /nfs/dbraw/zinc/13/07/29/973130729.db2.gz QXMFWURDWQGMBO-ZWKOTPCHSA-N 0 0 397.431 3.032 20 5 GGBDRN C[C@@H](c1ccncc1)[NH+]1CCC(Nc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000515302527 974297551 /nfs/dbraw/zinc/29/75/51/974297551.db2.gz XCMAYVYHZHGFJB-AWEZNQCLSA-N 0 0 384.436 3.254 20 5 GGBDRN C[N@@H+]1CCC[C@@H](CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000517378798 974316985 /nfs/dbraw/zinc/31/69/85/974316985.db2.gz VMJCPKRSYBFJHD-NHYWBVRUSA-N 0 0 376.438 3.245 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000518381465 974322219 /nfs/dbraw/zinc/32/22/19/974322219.db2.gz SDIHVQHOCZNCLI-CXAGYDPISA-N 0 0 384.436 3.319 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CC[NH+](C(C)(C)CC(C)(C)C)CC2)n1 ZINC000519711538 974334056 /nfs/dbraw/zinc/33/40/56/974334056.db2.gz WGLOBGJQLVZGHY-UHFFFAOYSA-N 0 0 378.473 3.333 20 5 GGBDRN C[C@@H]1C[C@@H](CCNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000520588584 974339583 /nfs/dbraw/zinc/33/95/83/974339583.db2.gz SQZAANPDAARFGE-GDBMZVCRSA-N 0 0 384.436 3.401 20 5 GGBDRN C[C@@H]1C[C@H](CCNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000520588587 974340254 /nfs/dbraw/zinc/34/02/54/974340254.db2.gz SQZAANPDAARFGE-ZBFHGGJFSA-N 0 0 384.436 3.401 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000566292232 974603377 /nfs/dbraw/zinc/60/33/77/974603377.db2.gz ZTMBKUHELKXCBN-GOEBONIOSA-N 0 0 384.436 3.319 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)n1 ZINC000566293812 974604533 /nfs/dbraw/zinc/60/45/33/974604533.db2.gz GIOZOEURYFRTBS-CQSZACIVSA-N 0 0 398.463 3.262 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)n1 ZINC000566293888 974604679 /nfs/dbraw/zinc/60/46/79/974604679.db2.gz JIFYJWXCDNSDCI-UHFFFAOYSA-N 0 0 390.827 3.418 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(N2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000567275537 974630475 /nfs/dbraw/zinc/63/04/75/974630475.db2.gz POTNXDJXPWEGMO-NRFANRHFSA-N 0 0 381.432 3.395 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000567977061 974651325 /nfs/dbraw/zinc/65/13/25/974651325.db2.gz YPKNVMMFSIQNAN-OAHLLOKOSA-N 0 0 384.436 3.097 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)n1 ZINC000568397863 974670107 /nfs/dbraw/zinc/67/01/07/974670107.db2.gz DPDIQOQMFQIQOO-KRWDZBQOSA-N 0 0 398.463 3.133 20 5 GGBDRN C[C@H]1CN(Cc2cccc(CNc3ccc(CC(=O)[O-])cc3[N+](=O)[O-])c2)CCO1 ZINC000570166580 974706174 /nfs/dbraw/zinc/70/61/74/974706174.db2.gz SFWXGJMCNDCWHR-HNNXBMFYSA-N 0 0 399.447 3.055 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1CCC1CCN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000570686079 974716846 /nfs/dbraw/zinc/71/68/46/974716846.db2.gz IMUBSASAOHPNSI-CQSZACIVSA-N 0 0 376.457 3.169 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CC[N@H+](Cc3ccccc3)C(C)(C)C2)n1 ZINC000573688473 974769883 /nfs/dbraw/zinc/76/98/83/974769883.db2.gz SLLJYMFETMQWLU-UHFFFAOYSA-N 0 0 384.436 3.097 20 5 GGBDRN O=C([O-])c1ccnc(N2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000575062450 974794778 /nfs/dbraw/zinc/79/47/78/974794778.db2.gz MMXRGKBMGLPLIQ-FUHWJXTLSA-N 0 0 396.447 3.179 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)n1 ZINC000576758071 974821787 /nfs/dbraw/zinc/82/17/87/974821787.db2.gz GFVXYXACRPZJJM-ZDUSSCGKSA-N 0 0 385.424 3.029 20 5 GGBDRN C[C@@H]1C[C@H](CCNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000577183284 974830278 /nfs/dbraw/zinc/83/02/78/974830278.db2.gz WZWMWLLRJYZWOM-ZBFHGGJFSA-N 0 0 384.436 3.401 20 5 GGBDRN O=C([O-])c1ccnc(N[C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-] ZINC000592976945 974979036 /nfs/dbraw/zinc/97/90/36/974979036.db2.gz IMXBGDWGWCBQMH-KBAYOESNSA-N 0 0 396.447 3.401 20 5 GGBDRN C[C@H]([NH2+]C(C)(C)CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 ZINC000736663505 978347860 /nfs/dbraw/zinc/34/78/60/978347860.db2.gz ZFLQJJZXECVXSH-ZDUSSCGKSA-N 0 0 385.420 3.152 20 5 GGBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2cc(C(=O)[O-])ccc2NC1=O ZINC001592546647 978433608 /nfs/dbraw/zinc/43/36/08/978433608.db2.gz VXYLABOOTQBUKU-ACJLOTCBSA-N 0 0 397.431 3.157 20 5 GGBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2cc(C(=O)[O-])ccc2NC1=O ZINC001592546648 978433745 /nfs/dbraw/zinc/43/37/45/978433745.db2.gz VXYLABOOTQBUKU-FZKQIMNGSA-N 0 0 397.431 3.157 20 5 GGBDRN O=C([O-])Cc1ccc(N2CCC(C[NH+]3CCCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000844206345 979352965 /nfs/dbraw/zinc/35/29/65/979352965.db2.gz GJDDKUWRLXXUAJ-UHFFFAOYSA-N 0 0 375.469 3.314 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCC(C)(C)[N@@H+]2CCc3ccccc3C2)n1 ZINC000844207979 979357644 /nfs/dbraw/zinc/35/76/44/979357644.db2.gz KWZGCSLJQUHANG-UHFFFAOYSA-N 0 0 384.436 3.245 20 5 GGBDRN CC1(C)CN(c2ccc(CC(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000844208370 979357947 /nfs/dbraw/zinc/35/79/47/979357947.db2.gz KMCUHNJXMSRRIQ-UHFFFAOYSA-N 0 0 383.448 3.323 20 5 GGBDRN O=C([O-])Cc1ccc(N2CCC[C@H](C[NH+]3CCCCCC3)C2)c([N+](=O)[O-])c1 ZINC000844209860 979361744 /nfs/dbraw/zinc/36/17/44/979361744.db2.gz YBQZWDKGLGVXRQ-QGZVFWFLSA-N 0 0 375.469 3.314 20 5 GGBDRN C[C@](Cc1ccc(Cl)cc1)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)[O-] ZINC001592838633 979590117 /nfs/dbraw/zinc/59/01/17/979590117.db2.gz AKFDQZZFWLXNPS-GOSISDBHSA-N 0 0 388.811 3.300 20 5 GGBDRN C[C@@](Cc1ccc(Cl)cc1)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)[O-] ZINC001592838635 979590362 /nfs/dbraw/zinc/59/03/62/979590362.db2.gz AKFDQZZFWLXNPS-SFHVURJKSA-N 0 0 388.811 3.300 20 5 GGBDRN O=C([O-])CC[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000901679454 980442424 /nfs/dbraw/zinc/44/24/24/980442424.db2.gz TUKQCQAFYUWRSP-ZDUSSCGKSA-N 0 0 376.331 3.069 20 5 GGBDRN CO[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H](C(=O)[O-])C1 ZINC000902032206 980704149 /nfs/dbraw/zinc/70/41/49/980704149.db2.gz LGVHNTVUBSMFIN-BLLLJJGKSA-N 0 0 376.434 3.387 20 5 GGBDRN CO[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H](C(=O)[O-])C1 ZINC000902032207 980704272 /nfs/dbraw/zinc/70/42/72/980704272.db2.gz LGVHNTVUBSMFIN-LRDDRELGSA-N 0 0 376.434 3.387 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)[NH2+]Cc3cc(C(=O)[O-])ccc3[N+](=O)[O-])ccc2NC1=O ZINC001595499641 981265668 /nfs/dbraw/zinc/26/56/68/981265668.db2.gz NQTCWYKHTHPFIY-APPDUMDISA-N 0 0 399.403 3.253 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)[NH2+]Cc3cc(C(=O)[O-])ccc3[N+](=O)[O-])ccc2NC1=O ZINC001595499645 981265810 /nfs/dbraw/zinc/26/58/10/981265810.db2.gz NQTCWYKHTHPFIY-PIGZYNQJSA-N 0 0 399.403 3.253 20 5 GGBDRN CC[C@@](C)(C(=O)[O-])[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CC1 ZINC001594778318 981775902 /nfs/dbraw/zinc/77/59/02/981775902.db2.gz OGRTUHNHVZQMCG-KRWDZBQOSA-N 0 0 383.832 3.152 20 5 GGBDRN CCC[N@H+](Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC001595899825 982949606 /nfs/dbraw/zinc/94/96/06/982949606.db2.gz NWOPZCDCDYBODP-KYNGSXCRSA-N 0 0 392.452 3.084 20 5 GGBDRN CC[NH+](CC)CCN(CCC(F)(F)F)c1nc(C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC001596268701 983686285 /nfs/dbraw/zinc/68/62/85/983686285.db2.gz KMUFUERVRJZJHI-UHFFFAOYSA-N 0 0 392.378 3.097 20 5 GGBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCc2cc(C(=O)[O-])ccc2NC1=O ZINC001589002309 984947316 /nfs/dbraw/zinc/94/73/16/984947316.db2.gz PGAUHVFKNXIJBK-XWGMLZDCSA-N 0 0 395.415 3.239 20 5 GGBDRN CCO[C@H]1C[C@]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)(C(=O)[O-])C1(C)C ZINC001596836946 985488955 /nfs/dbraw/zinc/48/89/55/985488955.db2.gz GSUPAWTXFZEVPB-LPHOPBHVSA-N 0 0 380.441 3.130 20 5 GGBDRN C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594487687 985576626 /nfs/dbraw/zinc/57/66/26/985576626.db2.gz UTDLEQFVNDREQU-DOMZBBRYSA-N 0 0 393.440 3.028 20 5 GGBDRN C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594487695 985576640 /nfs/dbraw/zinc/57/66/40/985576640.db2.gz UTDLEQFVNDREQU-WFASDCNBSA-N 0 0 393.440 3.028 20 5 GGBDRN C[C@H]1C[N@H+](Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C ZINC001594533134 986134380 /nfs/dbraw/zinc/13/43/80/986134380.db2.gz APACIELFIRSMTE-SWLSCSKDSA-N 0 0 393.440 3.028 20 5 GGBDRN C[C@@H](C(=O)[O-])[C@@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 ZINC001589469878 986949017 /nfs/dbraw/zinc/94/90/17/986949017.db2.gz QBHXXJVNSYJKEZ-KZULUSFZSA-N 0 0 389.383 3.114 20 5 GGBDRN CC(C)(C)CC(C)(C)[NH+]1CCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC001589742733 988020122 /nfs/dbraw/zinc/02/01/22/988020122.db2.gz XTDZIJFCSRZDKH-UHFFFAOYSA-N 0 0 391.468 3.266 20 5 GGBDRN CSCc1cc(F)ccc1C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001599802258 988196300 /nfs/dbraw/zinc/19/63/00/988196300.db2.gz IUKJRUHCAGCIAZ-UHFFFAOYSA-N 0 0 394.424 3.350 20 5 GGBDRN CSc1ccc(CC[NH2+]Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)cc1 ZINC001599812678 988364792 /nfs/dbraw/zinc/36/47/92/988364792.db2.gz KQCUJBMLFWRXFN-UHFFFAOYSA-N 0 0 376.434 3.112 20 5 GGBDRN C[NH+](C)C(C)(C)CNc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-] ZINC001598164541 990674348 /nfs/dbraw/zinc/67/43/48/990674348.db2.gz AMCWOZZXKFGECL-UHFFFAOYSA-N 0 0 385.420 3.276 20 5 GGBDRN C[NH+](C)C1(CNc2c(Cl)cc([N+](=O)[O-])cc2C(=O)[O-])Cc2ccccc2C1 ZINC001598184369 990754156 /nfs/dbraw/zinc/75/41/56/990754156.db2.gz QJKZCFZJTITRCT-UHFFFAOYSA-N 0 0 389.839 3.458 20 5 GGBDRN COc1cccc(SCC[NH2+][C@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)c1 ZINC001599684158 990959944 /nfs/dbraw/zinc/95/99/44/990959944.db2.gz NVRFMFKMYSJMKR-SFHVURJKSA-N 0 0 376.434 3.285 20 5 GGBDRN C[NH+](C)Cc1cc(NCc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)ccc1Cl ZINC001598248730 991023122 /nfs/dbraw/zinc/02/31/22/991023122.db2.gz JIUMCJAMYIRJGT-UHFFFAOYSA-N 0 0 393.827 3.385 20 5 GGBDRN CC(C)[C@H](CNCc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[NH+]1CCCCCC1 ZINC001590990238 991205759 /nfs/dbraw/zinc/20/57/59/991205759.db2.gz WAGJEHZOUFUWRB-SFHVURJKSA-N 0 0 393.484 3.048 20 5 GGBDRN C[N@H+](Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-])CC(C)(C)CNC(=O)OC(C)(C)C ZINC001598507340 992522225 /nfs/dbraw/zinc/52/22/25/992522225.db2.gz NVQOQRMPPYLLAV-UHFFFAOYSA-N 0 0 395.456 3.276 20 5 GGBDRN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)Cc1ccc(C(=O)[O-])cn1 ZINC001598519665 992663870 /nfs/dbraw/zinc/66/38/70/992663870.db2.gz MUYSQVQFRALUKF-UHFFFAOYSA-N 0 0 380.198 3.083 20 5 GGBDRN CN(c1ccccc1)C1CC[NH+](Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)CC1 ZINC001598544262 992929402 /nfs/dbraw/zinc/92/94/02/992929402.db2.gz LXESNHXXGZYDGN-UHFFFAOYSA-N 0 0 399.447 3.159 20 5 GGBDRN C[C@]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593249517 994478664 /nfs/dbraw/zinc/47/86/64/994478664.db2.gz XHCUGQMWMPPECR-NVXWUHKLSA-N 0 0 382.775 3.010 20 5 GGBDRN COc1cccc([C@@H](CNc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])[NH+]2CCCC2)c1 ZINC001599657180 994600774 /nfs/dbraw/zinc/60/07/74/994600774.db2.gz IORYRKVGCCBCCJ-HXUWFJFHSA-N 0 0 399.447 3.480 20 5 GGBDRN C[C@@]([NH2+]Cc1ccc(Br)cc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593291707 994670864 /nfs/dbraw/zinc/67/08/64/994670864.db2.gz BOBJKNWOBSLMOK-INIZCTEOSA-N 0 0 379.210 3.447 20 5 GGBDRN C[C@@]([NH2+]Cc1cc2c(c(Cl)c1)OCO2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593292085 994675124 /nfs/dbraw/zinc/67/51/24/994675124.db2.gz HLTVFHMPXRIILP-KRWDZBQOSA-N 0 0 378.768 3.067 20 5 GGBDRN C[C@]([NH2+]Cc1cc2ccc(F)cc2[nH]c1=O)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593293301 994682628 /nfs/dbraw/zinc/68/26/28/994682628.db2.gz UBIXASDOTULRLA-LJQANCHMSA-N 0 0 385.351 3.077 20 5 GGBDRN C[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccccc1-n1cccn1 ZINC001593298051 994709780 /nfs/dbraw/zinc/70/97/80/994709780.db2.gz CXTYCDQSZNYBTF-CQSZACIVSA-N 0 0 396.403 3.095 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[C@H]1Oc2ccccc2[C@H]1C ZINC001593298214 994711221 /nfs/dbraw/zinc/71/12/21/994711221.db2.gz FQTZKPZIADHYPY-UVARLRKDSA-N 0 0 386.404 3.101 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC001593298211 994711687 /nfs/dbraw/zinc/71/16/87/994711687.db2.gz FQTZKPZIADHYPY-KQHSUYLTSA-N 0 0 386.404 3.101 20 5 GGBDRN COc1cc(C[N@@H+]2CCC[C@H](c3ncc(C(=O)[O-])s3)C2)ccc1[N+](=O)[O-] ZINC001599407856 997359862 /nfs/dbraw/zinc/35/98/62/997359862.db2.gz RYNCDUUEKUAMMV-LBPRGKRZSA-N 0 0 377.422 3.138 20 5 GGBDRN COc1cc(C[NH2+][C@@H](C(=O)[O-])c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC001599414566 997483237 /nfs/dbraw/zinc/48/32/37/997483237.db2.gz IFQPILAZVJIGLM-OAHLLOKOSA-N 0 0 395.209 3.281 20 5 GGBDRN CO[C@@H]1CCC[C@@H]([C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C(=O)[O-])C1 ZINC001599108715 997527924 /nfs/dbraw/zinc/52/79/24/997527924.db2.gz LRPDPGMMRUWWDG-MZMPZRCHSA-N 0 0 380.441 3.130 20 5 GGBDRN C[C@@]1(CNC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CCC[N@@H+]1Cc1ccccc1 ZINC001594026588 997559510 /nfs/dbraw/zinc/55/95/10/997559510.db2.gz BFXPMWLKZOKSNB-NRFANRHFSA-N 0 0 397.431 3.078 20 5 GGBDRN C[C@]1(CNC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CCC[N@@H+]1Cc1ccccc1 ZINC001594026589 997559714 /nfs/dbraw/zinc/55/97/14/997559714.db2.gz BFXPMWLKZOKSNB-OAQYLSRUSA-N 0 0 397.431 3.078 20 5 GGBDRN COc1ccc([C@@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C(=O)[O-])cc1Cl ZINC001599527992 997596933 /nfs/dbraw/zinc/59/69/33/997596933.db2.gz RSKKORCCRYOECS-MRXNPFEDSA-N 0 0 380.784 3.051 20 5 GGBDRN COc1ccc([C@H]([NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])C(=O)[O-])cc1 ZINC001599533203 997695439 /nfs/dbraw/zinc/69/54/39/997695439.db2.gz WNFMUSPXHFZHIM-HNNXBMFYSA-N 0 0 395.209 3.281 20 5 GGBDRN COc1ccc([C@@H]([NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])C(=O)[O-])cc1 ZINC001599533204 997696429 /nfs/dbraw/zinc/69/64/29/997696429.db2.gz WNFMUSPXHFZHIM-OAHLLOKOSA-N 0 0 395.209 3.281 20 5 GGBDRN COc1ccc(C[N@@H+]2CC[C@H]2CNc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC001599561050 998196578 /nfs/dbraw/zinc/19/65/78/998196578.db2.gz CCTIWQWTKHXNRV-OOYWPUHTSA-N 0 0 397.431 3.388 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@]2(C(=O)[O-])CC[C@@H](C)c3ccccc32)c1 ZINC001598989062 998719687 /nfs/dbraw/zinc/71/96/87/998719687.db2.gz ZEOCASFPWHQBDU-LRTDBIEQSA-N 0 0 398.415 3.348 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@@H+]2Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001594329263 999264906 /nfs/dbraw/zinc/26/49/06/999264906.db2.gz VKUNVWCLDDKJSL-HQJJXPTPSA-N 0 0 376.453 3.445 20 5 GGBDRN COCc1ccc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cc1 ZINC000417566300 1126080401 /nfs/dbraw/zinc/08/04/01/1126080401.db2.gz RBJHEDCTBYFFHD-LJQANCHMSA-N 0 0 383.404 3.008 20 5 GGBDRN CCOc1cccc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])c1 ZINC000276938089 1126078156 /nfs/dbraw/zinc/07/81/56/1126078156.db2.gz ACHAUFFTBUUMMH-IBGZPJMESA-N 0 0 383.404 3.260 20 5 GGBDRN COCc1cccc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])c1 ZINC000277400837 1126078876 /nfs/dbraw/zinc/07/88/76/1126078876.db2.gz RWNZXPWRXBEDQW-IBGZPJMESA-N 0 0 383.404 3.008 20 5 GGBDRN Cc1cnn(C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C(=O)[O-])c1 ZINC000426723576 1126082596 /nfs/dbraw/zinc/08/25/96/1126082596.db2.gz MQCBRLXEZQANEZ-INIZCTEOSA-N 0 0 386.433 3.071 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc(F)ccc1F ZINC000426726176 1126083328 /nfs/dbraw/zinc/08/33/28/1126083328.db2.gz HTQKAIKDPFJQLF-KRWDZBQOSA-N 0 0 375.331 3.140 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc(F)ccc1F ZINC000426726177 1126083361 /nfs/dbraw/zinc/08/33/61/1126083361.db2.gz HTQKAIKDPFJQLF-QGZVFWFLSA-N 0 0 375.331 3.140 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc2ncccc2c1 ZINC000426727481 1126083421 /nfs/dbraw/zinc/08/34/21/1126083421.db2.gz OYLVDWCNXHBHOP-HXUWFJFHSA-N 0 0 390.399 3.410 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc(F)c(F)c1 ZINC000426740263 1126085501 /nfs/dbraw/zinc/08/55/01/1126085501.db2.gz AKVPZZOECAYGBU-QGZVFWFLSA-N 0 0 375.331 3.140 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000426744450 1126086134 /nfs/dbraw/zinc/08/61/34/1126086134.db2.gz QZQCQALHYCTKFK-INIZCTEOSA-N 0 0 393.321 3.279 20 5 GGBDRN COc1ccc(-c2ccc(C[NH2+][C@H](Cc3ccco3)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000426817248 1126092304 /nfs/dbraw/zinc/09/23/04/1126092304.db2.gz OKBIKJAXMGLBJP-MRXNPFEDSA-N 0 0 386.360 3.242 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc(F)c1F ZINC000579188568 1126098312 /nfs/dbraw/zinc/09/83/12/1126098312.db2.gz ASDWQJMMSZJNHD-INIZCTEOSA-N 0 0 375.331 3.140 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001118027113 1126146438 /nfs/dbraw/zinc/14/64/38/1126146438.db2.gz REMOXXIKNHUKQD-FQEVSTJZSA-N 0 0 379.416 3.350 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc2c(c1)CCC2 ZINC001118027114 1126146549 /nfs/dbraw/zinc/14/65/49/1126146549.db2.gz REMOXXIKNHUKQD-HXUWFJFHSA-N 0 0 379.416 3.350 20 5 GGBDRN COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000089919287 230957491 /nfs/dbraw/zinc/95/74/91/230957491.db2.gz VVFLURVYGIEGDJ-ZBEGNZNMSA-N 0 0 399.241 3.209 20 5 GGBDRN Cc1cc(C(=O)N2CCC(N3CCc4ccccc43)CC2)c(N)c([N+](=O)[O-])c1 ZINC000225736858 222693705 /nfs/dbraw/zinc/69/37/05/222693705.db2.gz XRKWPMQSLZBSQN-UHFFFAOYSA-N 0 0 380.448 3.153 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC=C(c2cc3cccnc3[nH]2)CC1 ZINC000359865821 212119955 /nfs/dbraw/zinc/11/99/55/212119955.db2.gz HPUPMIFANFCFIQ-UHFFFAOYSA-N 0 0 388.387 3.277 20 5 GGBDRN COc1cc(CN2CCOC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000359865322 212120065 /nfs/dbraw/zinc/12/00/65/212120065.db2.gz DJWHOBXLGYEZMK-LLVKDONJSA-N 0 0 378.347 3.013 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000024107210 212106513 /nfs/dbraw/zinc/10/65/13/212106513.db2.gz ZOMKPTYZHOUFQC-UHFFFAOYSA-N 0 0 397.313 3.243 20 5 GGBDRN COc1cc2c(cc1OC)CN(c1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])CC2 ZINC000030619427 212108693 /nfs/dbraw/zinc/10/86/93/212108693.db2.gz UPHXEBIVYAGYOW-UHFFFAOYSA-N 0 0 399.447 3.313 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCOc2ccc(Cl)cc2)C1=O ZINC000004477677 212102672 /nfs/dbraw/zinc/10/26/72/212102672.db2.gz QDWCQVPNMOCBLY-GOSISDBHSA-N 0 0 389.795 3.094 20 5 GGBDRN CCCc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000013947159 212104580 /nfs/dbraw/zinc/10/45/80/212104580.db2.gz OALJQLBAVHWUBY-UHFFFAOYSA-N 0 0 389.477 3.058 20 5 GGBDRN CCc1ccc(-c2noc(CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)n2)cc1 ZINC000016210246 212104529 /nfs/dbraw/zinc/10/45/29/212104529.db2.gz ZKCKROSZXBUSNV-UHFFFAOYSA-N 0 0 378.344 3.003 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(F)cc2Cl)C1=O ZINC000008645991 212103165 /nfs/dbraw/zinc/10/31/65/212103165.db2.gz BYSDIZLGBOWRQR-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN O=C(CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000006101559 212102814 /nfs/dbraw/zinc/10/28/14/212102814.db2.gz BUSFLPJCQXUYHB-UHFFFAOYSA-N 0 0 394.170 3.136 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1[N+](=O)[O-] ZINC000001466658 220498988 /nfs/dbraw/zinc/49/89/88/220498988.db2.gz KNLSQUQFEXACCA-KRWDZBQOSA-N 0 0 381.388 3.163 20 5 GGBDRN O=C(COc1ccc2c(c1)CCC2)OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000002661971 220550991 /nfs/dbraw/zinc/55/09/91/220550991.db2.gz AOGIQWRWJWGEMD-UHFFFAOYSA-N 0 0 385.372 3.072 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1ccc2c(c1)OCCO2 ZINC000003306274 220624672 /nfs/dbraw/zinc/62/46/72/220624672.db2.gz SOJXFSXYXCXWOX-LLVKDONJSA-N 0 0 390.417 3.494 20 5 GGBDRN C[C@H](OC(=O)c1cccn1C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000004564350 220732598 /nfs/dbraw/zinc/73/25/98/220732598.db2.gz 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ZINC000049618565 222001043 /nfs/dbraw/zinc/00/10/43/222001043.db2.gz BBNKBLPQAXVIKX-UHFFFAOYSA-N 0 0 383.404 3.082 20 5 GGBDRN O=C(COC(=O)c1csc([N+](=O)[O-])c1)Nc1ccc(N2CCCC2)cc1 ZINC000051672250 222006804 /nfs/dbraw/zinc/00/68/04/222006804.db2.gz PAFVFHYFWJARSI-UHFFFAOYSA-N 0 0 375.406 3.052 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CCC(CO)CC2)c([N+](=O)[O-])c1 ZINC000052807628 222008088 /nfs/dbraw/zinc/00/80/88/222008088.db2.gz QTGCFXFGBNDIDX-FQEVSTJZSA-N 0 0 383.448 3.287 20 5 GGBDRN CNC(=O)c1ccc(Sc2nnc(C)n2-c2ccccc2C)c([N+](=O)[O-])c1 ZINC000053554725 222010786 /nfs/dbraw/zinc/01/07/86/222010786.db2.gz WAHAPJNNJOKSLV-UHFFFAOYSA-N 0 0 383.433 3.303 20 5 GGBDRN CNC(=O)c1ccc(Oc2cccc(I)c2)c([N+](=O)[O-])c1 ZINC000053549192 222011749 /nfs/dbraw/zinc/01/17/49/222011749.db2.gz LKHNYGULZMELOB-UHFFFAOYSA-N 0 0 398.156 3.351 20 5 GGBDRN C[C@@H]1CN(Cc2cccc(CNC(=O)Nc3cccc([N+](=O)[O-])c3)c2)CCO1 ZINC000058162289 222042747 /nfs/dbraw/zinc/04/27/47/222042747.db2.gz OWOCCVZVOGENIB-OAHLLOKOSA-N 0 0 384.436 3.137 20 5 GGBDRN Cc1csc([C@@](O)(CC(=O)Nc2cccc([N+](=O)[O-])c2)C(F)(F)F)n1 ZINC000065512320 222133761 /nfs/dbraw/zinc/13/37/61/222133761.db2.gz JVWVRILSJDVFJZ-ZDUSSCGKSA-N 0 0 375.328 3.138 20 5 GGBDRN COc1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000095989260 222370018 /nfs/dbraw/zinc/37/00/18/222370018.db2.gz KGNNIMXOYCIOAX-QWHCGFSZSA-N 0 0 393.440 3.073 20 5 GGBDRN Cc1nc(NC(=O)c2csc([N+](=O)[O-])c2)ccc1I ZINC000170654481 222561680 /nfs/dbraw/zinc/56/16/80/222561680.db2.gz UMUDTBWSLLBYPY-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN C[S@@](=O)Cc1cc(NC(=O)COc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000115265913 564188664 /nfs/dbraw/zinc/18/86/64/564188664.db2.gz LIXZJAYAOALFIG-VWLOTQADSA-N 0 0 382.825 3.144 20 5 GGBDRN C[S@@](=O)Cc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000115270032 564189482 /nfs/dbraw/zinc/18/94/82/564189482.db2.gz WSEFIAAASFNKLE-VWLOTQADSA-N 0 0 382.825 3.144 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(I)cn2)ccc1[N+](=O)[O-] ZINC000115630548 564196286 /nfs/dbraw/zinc/19/62/86/564196286.db2.gz JDNGTPNISVJBFU-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N(CC2CC2)CC2CC2)c1 ZINC000115591237 564196844 /nfs/dbraw/zinc/19/68/44/564196844.db2.gz NQGIVKJTZBUKLC-UHFFFAOYSA-N 0 0 389.271 3.168 20 5 GGBDRN O=C(CCS(=O)(=O)c1ccc(Cl)cc1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000003416314 564197054 /nfs/dbraw/zinc/19/70/54/564197054.db2.gz SKHTVGYBVPGZKU-UHFFFAOYSA-N 0 0 386.788 3.190 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)c1[N+](=O)[O-] ZINC000115724855 564198614 /nfs/dbraw/zinc/19/86/14/564198614.db2.gz UWGZTBRVAQNJFC-RUZDIDTESA-N 0 0 384.845 3.055 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(I)cc1 ZINC000003563900 564199240 /nfs/dbraw/zinc/19/92/40/564199240.db2.gz WKUHVAMFNCAQJF-UHFFFAOYSA-N 0 0 398.156 3.217 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCSC[C@H]2c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000116135963 564203577 /nfs/dbraw/zinc/20/35/77/564203577.db2.gz IYDDUTPWXIZBFG-ZDUSSCGKSA-N 0 0 380.857 3.220 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCSC[C@@H]2c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000116135959 564203687 /nfs/dbraw/zinc/20/36/87/564203687.db2.gz IYDDUTPWXIZBFG-CYBMUJFWSA-N 0 0 380.857 3.220 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cc(Br)c2c(c1)OCCO2 ZINC000116320180 564207767 /nfs/dbraw/zinc/20/77/67/564207767.db2.gz PNPVWEZPCDLWCQ-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN Cc1csc(C(C)(C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000116378466 564209499 /nfs/dbraw/zinc/20/94/99/564209499.db2.gz UDBPUHCGCUIPOI-UHFFFAOYSA-N 0 0 375.859 3.227 20 5 GGBDRN O=C(COc1ccc(I)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000005050573 564211277 /nfs/dbraw/zinc/21/12/77/564211277.db2.gz UWGRWWQBITWJCN-UHFFFAOYSA-N 0 0 398.156 3.217 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000005121356 564212264 /nfs/dbraw/zinc/21/22/64/564212264.db2.gz DOIKBUXOCKHQCI-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN COC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000005173288 564213943 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CNc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 ZINC000007101575 564231639 /nfs/dbraw/zinc/23/16/39/564231639.db2.gz FKXUCRGLLURWDX-UHFFFAOYSA-N 0 0 393.372 3.238 20 5 GGBDRN CN(Cc1nc2ccccc2s1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000007365837 564236414 /nfs/dbraw/zinc/23/64/14/564236414.db2.gz RPNFNVUUJPNRRQ-UHFFFAOYSA-N 0 0 377.447 3.244 20 5 GGBDRN C[C@H](Sc1nnc(N)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000007535879 564237813 /nfs/dbraw/zinc/23/78/13/564237813.db2.gz PFGZRUNFEYLCKJ-YFKPBYRVSA-N 0 0 393.372 3.167 20 5 GGBDRN COc1ccc(CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1Br ZINC000007634412 564238943 /nfs/dbraw/zinc/23/89/43/564238943.db2.gz TWSUQEQFVJUKST-UHFFFAOYSA-N 0 0 391.177 3.162 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N(C)CCOc2ccccc2)cc1[N+](=O)[O-] ZINC000007684502 564239768 /nfs/dbraw/zinc/23/97/68/564239768.db2.gz BQKSUKMEUVMCMW-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN COc1cccc(CN(C)S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1 ZINC000007684818 564240110 /nfs/dbraw/zinc/24/01/10/564240110.db2.gz CCALUTFZZGCAHQ-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccc(Br)cc1 ZINC000007952620 564243466 /nfs/dbraw/zinc/24/34/66/564243466.db2.gz OUCPOVYYHBTHTF-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN O=C(c1ccc(Br)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690999 564244014 /nfs/dbraw/zinc/24/40/14/564244014.db2.gz QHCNBVZMXVPXCD-CYBMUJFWSA-N 0 0 391.225 3.079 20 5 GGBDRN O=C(CCc1ccc(Cl)s1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689091 564244258 /nfs/dbraw/zinc/24/42/58/564244258.db2.gz SVRSZEPDHRJAKV-NSHDSACASA-N 0 0 380.857 3.350 20 5 GGBDRN O=C(c1ccc(Br)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690998 564244285 /nfs/dbraw/zinc/24/42/85/564244285.db2.gz QHCNBVZMXVPXCD-ZDUSSCGKSA-N 0 0 391.225 3.079 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2cccs2)C[C@H]2CCCO2)cc1 ZINC000008059647 564245222 /nfs/dbraw/zinc/24/52/22/564245222.db2.gz FYZAEXLBKILNIN-CQSZACIVSA-N 0 0 382.463 3.026 20 5 GGBDRN NS(=O)(=O)c1ccc(Sc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000008149673 564245723 /nfs/dbraw/zinc/24/57/23/564245723.db2.gz GMXKKPMRYPYVKI-UHFFFAOYSA-N 0 0 389.252 3.156 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1Br ZINC000008183739 564246919 /nfs/dbraw/zinc/24/69/19/564246919.db2.gz IDOGMBWDQUPCLV-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1Sc1nnc(-c2ccc(Br)cc2)o1 ZINC000008318570 564248004 /nfs/dbraw/zinc/24/80/04/564248004.db2.gz CWDFHRGSNOVDIW-UHFFFAOYSA-N 0 0 382.199 3.292 20 5 GGBDRN Cc1sc2nc(Sc3c([N+](=O)[O-])ncn3C)n(C(C)C)c(=O)c2c1C ZINC000008376481 564248565 /nfs/dbraw/zinc/24/85/65/564248565.db2.gz JNCQSSLCAIJDDN-UHFFFAOYSA-N 0 0 379.467 3.449 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)nc1C ZINC000008334545 564248997 /nfs/dbraw/zinc/24/89/97/564248997.db2.gz AMMGXGIGHWBZGA-UHFFFAOYSA-N 0 0 381.435 3.267 20 5 GGBDRN CC(C)[C@H]1OCCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000118977977 564249447 /nfs/dbraw/zinc/24/94/47/564249447.db2.gz 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ZINC000010302680 564255807 /nfs/dbraw/zinc/25/58/07/564255807.db2.gz RUHQEAQKYGDVAL-UHFFFAOYSA-N 0 0 375.435 3.183 20 5 GGBDRN O=C(CN1CCc2sccc2C1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000010340947 564256854 /nfs/dbraw/zinc/25/68/54/564256854.db2.gz RXQAQSZPKSQVHJ-UHFFFAOYSA-N 0 0 396.266 3.416 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)CCC2CC2)cc1[N+](=O)[O-] ZINC000119153797 564257308 /nfs/dbraw/zinc/25/73/08/564257308.db2.gz VSCYEYQBUKQDJI-UHFFFAOYSA-N 0 0 377.260 3.086 20 5 GGBDRN O=[N+]([O-])c1nn(Cc2ccn(-c3c(F)cccc3F)n2)cc1Br ZINC000119177835 564257868 /nfs/dbraw/zinc/25/78/68/564257868.db2.gz CHFKXJQROJVXEV-UHFFFAOYSA-N 0 0 384.140 3.066 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-] ZINC000010683738 564259917 /nfs/dbraw/zinc/25/99/17/564259917.db2.gz RLNMILZGLLARAD-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN CCOC(=O)Cc1csc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])n1 ZINC000011172346 564261836 /nfs/dbraw/zinc/26/18/36/564261836.db2.gz QTIUXFRFKBWVLM-UHFFFAOYSA-N 0 0 381.435 3.131 20 5 GGBDRN CNc1nnc(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])s1 ZINC000011115820 564262070 /nfs/dbraw/zinc/26/20/70/564262070.db2.gz OGFCKKFPZYCVOF-UHFFFAOYSA-N 0 0 378.382 3.390 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCO[C@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000011454722 564263588 /nfs/dbraw/zinc/26/35/88/564263588.db2.gz NZCYNEGBQUZFNN-LLVKDONJSA-N 0 0 379.463 3.372 20 5 GGBDRN Cc1ccc(C(=O)NCC(=O)Nc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000012459218 564268468 /nfs/dbraw/zinc/26/84/68/564268468.db2.gz GYBRAEOALRTVRE-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCS(=O)CC3)o2)c(Br)c1 ZINC000119414391 564270212 /nfs/dbraw/zinc/27/02/12/564270212.db2.gz MOHSHINIMQDPME-UHFFFAOYSA-N 0 0 399.266 3.182 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1nc2ccccc2s1 ZINC000119503705 564274293 /nfs/dbraw/zinc/27/42/93/564274293.db2.gz LPZWGYCRVRJSQY-UHFFFAOYSA-N 0 0 383.838 3.336 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1ccccc1OC(F)F ZINC000119526778 564275278 /nfs/dbraw/zinc/27/52/78/564275278.db2.gz QADHIGACEGGATE-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN Cc1ccccc1OCCN(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119519400 564275334 /nfs/dbraw/zinc/27/53/34/564275334.db2.gz RUZYCFCCKCWZPJ-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000014097690 564279326 /nfs/dbraw/zinc/27/93/26/564279326.db2.gz JQDLAYGCRSGWRM-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000014101996 564279341 /nfs/dbraw/zinc/27/93/41/564279341.db2.gz OYTSAVPUSDGUPD-OAHLLOKOSA-N 0 0 383.857 3.421 20 5 GGBDRN COc1cccc(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)c1 ZINC000119651375 564281153 /nfs/dbraw/zinc/28/11/53/564281153.db2.gz YXEOFRFPOJGWIL-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN CNS(=O)(=O)c1ccc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000014303854 564281578 /nfs/dbraw/zinc/28/15/78/564281578.db2.gz KFSXHRGPAAQBQQ-UHFFFAOYSA-N 0 0 395.384 3.195 20 5 GGBDRN Cc1sc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C(N)=O)c1C ZINC000119674184 564283088 /nfs/dbraw/zinc/28/30/88/564283088.db2.gz ZUTVNAFOCJHMGL-JTQLQIEISA-N 0 0 379.463 3.491 20 5 GGBDRN CNS(=O)(=O)c1ccc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000119687971 564283091 /nfs/dbraw/zinc/28/30/91/564283091.db2.gz GIUCRNOTVIZKSJ-NSHDSACASA-N 0 0 383.857 3.007 20 5 GGBDRN CCCCCC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000014826958 564283437 /nfs/dbraw/zinc/28/34/37/564283437.db2.gz YHXZHYGVQDGXBG-UHFFFAOYSA-N 0 0 383.451 3.403 20 5 GGBDRN Cc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c(Cl)c1 ZINC000014861197 564283470 /nfs/dbraw/zinc/28/34/70/564283470.db2.gz KAEMWEHZKAFMKS-UHFFFAOYSA-N 0 0 379.825 3.386 20 5 GGBDRN O=C(CNc1cccc(Br)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000119700291 564283843 /nfs/dbraw/zinc/28/38/43/564283843.db2.gz MCKMOQYUHJWGHX-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN CN(CCOc1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000015141713 564284218 /nfs/dbraw/zinc/28/42/18/564284218.db2.gz WYXPLRYZVHJRNR-UHFFFAOYSA-N 0 0 384.841 3.167 20 5 GGBDRN Cc1nnc(Sc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000015165268 564284450 /nfs/dbraw/zinc/28/44/50/564284450.db2.gz JQFYRDXWKJXQBU-UHFFFAOYSA-N 0 0 385.370 3.199 20 5 GGBDRN CN(Cc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1S(N)(=O)=O ZINC000015169145 564284721 /nfs/dbraw/zinc/28/47/21/564284721.db2.gz UXJIZUHJFWAMOT-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN CN(Cc1ccc(Cl)c(Cl)c1)c1ccc([N+](=O)[O-])cc1S(N)(=O)=O ZINC000015170640 564284780 /nfs/dbraw/zinc/28/47/80/564284780.db2.gz VKYPNKLYQSVVST-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN CSc1ccccc1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000015305662 564285117 /nfs/dbraw/zinc/28/51/17/564285117.db2.gz RXTMZLGUHINQOH-UHFFFAOYSA-N 0 0 377.447 3.146 20 5 GGBDRN O=C(CNc1cccc([N+](=O)[O-])c1)Nc1ccccc1I ZINC000015288950 564285505 /nfs/dbraw/zinc/28/55/05/564285505.db2.gz RDLWLRDZRXWAIH-UHFFFAOYSA-N 0 0 397.172 3.250 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)CCOc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000015364833 564286131 /nfs/dbraw/zinc/28/61/31/564286131.db2.gz ODWSVWMIBYJMOO-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)CCOc1ccccc1Cl ZINC000015364806 564286555 /nfs/dbraw/zinc/28/65/55/564286555.db2.gz YWOLNAMJOVEYSB-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccc([N+](=O)[O-])cc1Br ZINC000119753497 564286888 /nfs/dbraw/zinc/28/68/88/564286888.db2.gz KIWURFXWJWXLRE-YUELXQCFSA-N 0 0 395.253 3.435 20 5 GGBDRN O=C(c1ccccc1Br)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000015382152 564287329 /nfs/dbraw/zinc/28/73/29/564287329.db2.gz NQTAQEOXOPSAMW-UHFFFAOYSA-N 0 0 390.237 3.320 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1Cn1nnc(-c2ccc(Br)cc2)n1 ZINC000015481675 564288113 /nfs/dbraw/zinc/28/81/13/564288113.db2.gz GXYUBIPASRZKOU-UHFFFAOYSA-N 0 0 390.197 3.068 20 5 GGBDRN O=C(CNC(=O)Cc1ccccc1[N+](=O)[O-])Nc1cc(Cl)ccc1Cl ZINC000015478069 564288212 /nfs/dbraw/zinc/28/82/12/564288212.db2.gz BUKOMNISCITDDZ-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000015815478 564290452 /nfs/dbraw/zinc/29/04/52/564290452.db2.gz QIQGONJTVJITFC-UHFFFAOYSA-N 0 0 380.447 3.038 20 5 GGBDRN O=C(Nc1ccc(Br)cn1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000119843148 564291010 /nfs/dbraw/zinc/29/10/10/564291010.db2.gz YFRZOHIYVDNXDV-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000016086715 564291130 /nfs/dbraw/zinc/29/11/30/564291130.db2.gz MYDUPBSFXLLVPZ-JTQLQIEISA-N 0 0 385.239 3.397 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1CCc2ccccc21 ZINC000119843918 564291218 /nfs/dbraw/zinc/29/12/18/564291218.db2.gz QCCAWFZZBVRYBK-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)Cc2ccc(Br)cc2)cc1 ZINC000119863044 564291622 /nfs/dbraw/zinc/29/16/22/564291622.db2.gz DMLZRGRBCKUCAV-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000016130141 564292396 /nfs/dbraw/zinc/29/23/96/564292396.db2.gz IVYNMEWPNZIINL-UHFFFAOYSA-N 0 0 376.312 3.423 20 5 GGBDRN O=C(CN1CCc2ccccc2C1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000016443114 564294301 /nfs/dbraw/zinc/29/43/01/564294301.db2.gz JIWQEQNEPPIZLJ-UHFFFAOYSA-N 0 0 390.237 3.354 20 5 GGBDRN O=c1c2cc(Br)cc(F)c2ncn1Cc1ccccc1[N+](=O)[O-] ZINC000119916108 564294739 /nfs/dbraw/zinc/29/47/39/564294739.db2.gz AIJUAYYVOITMSJ-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN O=C(COc1cccc(Br)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000016744045 564296231 /nfs/dbraw/zinc/29/62/31/564296231.db2.gz QPHCXQCXJCSRKG-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CNC(=O)c1ccccc1[N+](=O)[O-] ZINC000017958580 564300052 /nfs/dbraw/zinc/30/00/52/564300052.db2.gz NAEGQYZLUJBQEH-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2cccs2)c(C(F)(F)F)c1 ZINC000120026125 564300777 /nfs/dbraw/zinc/30/07/77/564300777.db2.gz WTTLGTBIYUPXOY-UHFFFAOYSA-N 0 0 395.384 3.066 20 5 GGBDRN O=C(c1cccc(I)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000018234457 564301289 /nfs/dbraw/zinc/30/12/89/564301289.db2.gz MCPUTJUDEAHOFJ-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN CN(Cc1ccc(Br)s1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000018107692 564301501 /nfs/dbraw/zinc/30/15/01/564301501.db2.gz SPSTUHKOQDIISQ-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN CCNc1nnc(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)s1 ZINC000018662878 564302554 /nfs/dbraw/zinc/30/25/54/564302554.db2.gz DZBZTEUYKWWYSL-QMMMGPOBSA-N 0 0 383.455 3.006 20 5 GGBDRN CNS(=O)(=O)c1ccc(Sc2nc3cc(Cl)ccc3[nH]2)c([N+](=O)[O-])c1 ZINC000018900664 564302567 /nfs/dbraw/zinc/30/25/67/564302567.db2.gz FOPJJQLLEMMPSW-UHFFFAOYSA-N 0 0 398.853 3.184 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCC(C)(C)CO)cc2[N+](=O)[O-])n1 ZINC000120060107 564302801 /nfs/dbraw/zinc/30/28/01/564302801.db2.gz AISSSKSQKNNXKH-UHFFFAOYSA-N 0 0 381.479 3.259 20 5 GGBDRN O=C(Nc1nnc(-c2ccsc2)s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000120150205 564306575 /nfs/dbraw/zinc/30/65/75/564306575.db2.gz BOWYBTJWUYSAOV-UHFFFAOYSA-N 0 0 377.363 3.335 20 5 GGBDRN O=C(Nc1ccc(Br)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000020674228 564307672 /nfs/dbraw/zinc/30/76/72/564307672.db2.gz XMEUUYXYGDXDLR-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN CN(CC(F)F)C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000120168431 564307887 /nfs/dbraw/zinc/30/78/87/564307887.db2.gz RMQBJZWSWBQTOX-UHFFFAOYSA-N 0 0 379.150 3.424 20 5 GGBDRN CNS(=O)(=O)c1ccc(Nc2ccc3nc(C)sc3c2)c([N+](=O)[O-])c1 ZINC000020666889 564308146 /nfs/dbraw/zinc/30/81/46/564308146.db2.gz ARRULAJDEQJSLC-UHFFFAOYSA-N 0 0 378.435 3.165 20 5 GGBDRN NC(=O)Nc1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000120287152 564313626 /nfs/dbraw/zinc/31/36/26/564313626.db2.gz YDUMBDOLLUJONC-UHFFFAOYSA-N 0 0 379.170 3.100 20 5 GGBDRN COCC(C)(C)NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000120292096 564313849 /nfs/dbraw/zinc/31/38/49/564313849.db2.gz MQCLEYWOYNMRMJ-UHFFFAOYSA-N 0 0 387.223 3.242 20 5 GGBDRN CCSc1nnc(SCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)s1 ZINC000022060400 564314132 /nfs/dbraw/zinc/31/41/32/564314132.db2.gz LZRYKDZUENKUHM-UHFFFAOYSA-N 0 0 382.492 3.240 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccccc1Br ZINC000022456666 564317182 /nfs/dbraw/zinc/31/71/82/564317182.db2.gz WKEONGCFLPPDCV-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CCOC(=O)c1sc(N(C(=O)c2ccc([N+](=O)[O-])s2)C2CC2)nc1C ZINC000120421332 564319578 /nfs/dbraw/zinc/31/95/78/564319578.db2.gz LBSHLFRYFHCDAP-UHFFFAOYSA-N 0 0 381.435 3.407 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)cc1O ZINC000120472182 564321196 /nfs/dbraw/zinc/32/11/96/564321196.db2.gz SOKDGKRUAMDEMJ-UHFFFAOYSA-N 0 0 395.209 3.344 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)s2)c([N+](=O)[O-])c1 ZINC000023399320 564324109 /nfs/dbraw/zinc/32/41/09/564324109.db2.gz BSDAIERYQLYOAE-UHFFFAOYSA-N 0 0 376.843 3.139 20 5 GGBDRN CN(Cc1ccc(Cl)s1)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000023643901 564326123 /nfs/dbraw/zinc/32/61/23/564326123.db2.gz OIGDVZYCVNQQNX-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN Cc1cc(NC(=O)[C@@H](C)Oc2cccnc2[N+](=O)[O-])ccc1Br ZINC000023753736 564326410 /nfs/dbraw/zinc/32/64/10/564326410.db2.gz UEJKPXZCLFJBGK-SNVBAGLBSA-N 0 0 380.198 3.467 20 5 GGBDRN C[C@H](Sc1nnc(C2CC2)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000024853049 564333886 /nfs/dbraw/zinc/33/38/86/564333886.db2.gz BLRCTYMDJWEGIV-QMMMGPOBSA-N 0 0 381.845 3.373 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000120743195 564334553 /nfs/dbraw/zinc/33/45/53/564334553.db2.gz IJSXUASZKUEKSA-GFCCVEGCSA-N 0 0 377.447 3.119 20 5 GGBDRN C[C@@H](Sc1nnc(C2CC2)n1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000024966525 564334564 /nfs/dbraw/zinc/33/45/64/564334564.db2.gz JWHHIWOKTOMEPG-MRVPVSSYSA-N 0 0 381.845 3.373 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)Nc3cnn(C)c3)cc2[N+](=O)[O-])n1 ZINC000025305361 564336969 /nfs/dbraw/zinc/33/69/69/564336969.db2.gz AYSSSPFKHZMKDM-UHFFFAOYSA-N 0 0 375.435 3.497 20 5 GGBDRN CC(C)c1cc(Br)ccc1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000120791636 564337204 /nfs/dbraw/zinc/33/72/04/564337204.db2.gz FLLAUTGIAVZQMG-UHFFFAOYSA-N 0 0 394.225 3.281 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000025375474 564338847 /nfs/dbraw/zinc/33/88/47/564338847.db2.gz UXQPWFZGYHRNDZ-NXEZZACHSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000025375485 564338876 /nfs/dbraw/zinc/33/88/76/564338876.db2.gz UXQPWFZGYHRNDZ-UWVGGRQHSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000025376479 564338961 /nfs/dbraw/zinc/33/89/61/564338961.db2.gz ZZDKAOWJVRKMMF-NXEZZACHSA-N 0 0 382.360 3.003 20 5 GGBDRN O=C(NCCNc1ncc(C(F)(F)F)cc1Cl)c1ccc([N+](=O)[O-])o1 ZINC000025828288 564341466 /nfs/dbraw/zinc/34/14/66/564341466.db2.gz XBAYXGZMLCDZLE-UHFFFAOYSA-N 0 0 378.694 3.097 20 5 GGBDRN Cc1nc(-c2ccc(CCNC(=O)c3cc([N+](=O)[O-])cn3C)s2)cs1 ZINC000025951167 564342823 /nfs/dbraw/zinc/34/28/23/564342823.db2.gz XHFWJIMXKGQURJ-UHFFFAOYSA-N 0 0 376.463 3.399 20 5 GGBDRN CS(=O)(=O)Nc1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1F ZINC000026290265 564345542 /nfs/dbraw/zinc/34/55/42/564345542.db2.gz OIMRRWJLDHAJJL-UHFFFAOYSA-N 0 0 387.776 3.011 20 5 GGBDRN CCNc1nnc(SCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)s1 ZINC000026415430 564346560 /nfs/dbraw/zinc/34/65/60/564346560.db2.gz XFHSQVWDHVEDCZ-UHFFFAOYSA-N 0 0 383.455 3.008 20 5 GGBDRN O=C(NCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(Cl)cc1 ZINC000026408785 564347156 /nfs/dbraw/zinc/34/71/56/564347156.db2.gz PUNRDUXZIQBRII-UHFFFAOYSA-N 0 0 382.203 3.061 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2CCO[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000121049959 564350237 /nfs/dbraw/zinc/35/02/37/564350237.db2.gz QEKMQGRCAIWDDG-SWLSCSKDSA-N 0 0 383.242 3.353 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000121049800 564350291 /nfs/dbraw/zinc/35/02/91/564350291.db2.gz QEKMQGRCAIWDDG-IUODEOHRSA-N 0 0 383.242 3.353 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cccc(N(C)C)n2)cc1[N+](=O)[O-] ZINC000121056935 564351002 /nfs/dbraw/zinc/35/10/02/564351002.db2.gz SSBYUEKZVAACHA-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000121054442 564351064 /nfs/dbraw/zinc/35/10/64/564351064.db2.gz HEIRPYYOZVSYHB-LLVKDONJSA-N 0 0 377.447 3.114 20 5 GGBDRN C[C@@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000121054275 564351253 /nfs/dbraw/zinc/35/12/53/564351253.db2.gz HEIRPYYOZVSYHB-NSHDSACASA-N 0 0 377.447 3.114 20 5 GGBDRN O=C(Cn1cnc([N+](=O)[O-])c1)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000026981889 564351982 /nfs/dbraw/zinc/35/19/82/564351982.db2.gz WPALJMQDEXEDOT-UHFFFAOYSA-N 0 0 393.119 3.211 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1ccc(Br)s1 ZINC000027367662 564353743 /nfs/dbraw/zinc/35/37/43/564353743.db2.gz BMXRFQHABSEZLK-UHFFFAOYSA-N 0 0 399.270 3.330 20 5 GGBDRN CCOC(=O)[C@@H]1CCCCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000121109748 564353875 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O=C(c1cc(Br)ccc1O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121401382 564367848 /nfs/dbraw/zinc/36/78/48/564367848.db2.gz KTRKHDPGCAHGAO-UHFFFAOYSA-N 0 0 377.194 3.261 20 5 GGBDRN CNS(=O)(=O)c1cccc(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)c1 ZINC000121438214 564368609 /nfs/dbraw/zinc/36/86/09/564368609.db2.gz CYSWVKWQYICBAN-UHFFFAOYSA-N 0 0 390.248 3.422 20 5 GGBDRN COc1cc(OCC(=O)Nc2nc(C(F)(F)F)cs2)ccc1[N+](=O)[O-] ZINC000121444721 564370113 /nfs/dbraw/zinc/37/01/13/564370113.db2.gz GPYRIFRTTRZVLM-UHFFFAOYSA-N 0 0 377.300 3.096 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1ccc(Cl)cc1 ZINC000029939727 564375627 /nfs/dbraw/zinc/37/56/27/564375627.db2.gz MHTFEDXFRUNDRY-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCOc1ccc(Cl)cc1 ZINC000029940444 564375947 /nfs/dbraw/zinc/37/59/47/564375947.db2.gz AJWJCUCWSQSFDE-UHFFFAOYSA-N 0 0 391.232 3.259 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)Cc1ccc(Br)o1 ZINC000030214754 564378022 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CCOCc1ccccc1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000030518889 564381951 /nfs/dbraw/zinc/38/19/51/564381951.db2.gz DVALULJCSSJSAP-UHFFFAOYSA-N 0 0 384.841 3.263 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccsc2)CC1 ZINC000030540944 564382077 /nfs/dbraw/zinc/38/20/77/564382077.db2.gz JLLBDTBHMFLQKF-UHFFFAOYSA-N 0 0 377.491 3.093 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1csc(Br)c1 ZINC000031201982 564387463 /nfs/dbraw/zinc/38/74/63/564387463.db2.gz LJXCHYZDQGSDGS-UHFFFAOYSA-N 0 0 399.270 3.330 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1cc(Br)c2c(c1)OCCO2 ZINC000121841858 564389691 /nfs/dbraw/zinc/38/96/91/564389691.db2.gz UXGFSJWRZYUHCI-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN O=C(COc1ccccc1Br)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000031671158 564390943 /nfs/dbraw/zinc/39/09/43/564390943.db2.gz VQENICHPAQZGIG-UHFFFAOYSA-N 0 0 395.165 3.104 20 5 GGBDRN Cc1nccn1CCCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121902149 564392269 /nfs/dbraw/zinc/39/22/69/564392269.db2.gz 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ZINC000122516825 564417510 /nfs/dbraw/zinc/41/75/10/564417510.db2.gz IOZWXQJAABJVQC-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN CCC1(CO)CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000122514156 564417571 /nfs/dbraw/zinc/41/75/71/564417571.db2.gz CAWBXPDTRFLSCL-UHFFFAOYSA-N 0 0 397.280 3.075 20 5 GGBDRN C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122545937 564418133 /nfs/dbraw/zinc/41/81/33/564418133.db2.gz BPEDOQYEEVPDQB-NSHDSACASA-N 0 0 383.857 3.089 20 5 GGBDRN CCc1noc(CC)c1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000122600850 564420093 /nfs/dbraw/zinc/42/00/93/564420093.db2.gz OXKHEDPYVPVOGZ-UHFFFAOYSA-N 0 0 396.241 3.329 20 5 GGBDRN O=C(COc1ccc(Br)cc1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122689511 564423903 /nfs/dbraw/zinc/42/39/03/564423903.db2.gz RSJXSQRTDIJARK-UHFFFAOYSA-N 0 0 391.181 3.251 20 5 GGBDRN CCCc1ccc(C(=O)Cn2cc(Br)cc([N+](=O)[O-])c2=O)cc1 ZINC000122696973 564424106 /nfs/dbraw/zinc/42/41/06/564424106.db2.gz RDEIWFFDWLKKOX-UHFFFAOYSA-N 0 0 379.210 3.354 20 5 GGBDRN COc1c(Cl)cccc1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000122732589 564424818 /nfs/dbraw/zinc/42/48/18/564424818.db2.gz KJEUJNBKRIDVMU-UHFFFAOYSA-N 0 0 384.175 3.487 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)COc2ccc(F)cc2Br)c1 ZINC000122744550 564425821 /nfs/dbraw/zinc/42/58/21/564425821.db2.gz ZVYJKIYNUWXCNC-GFCCVEGCSA-N 0 0 386.173 3.315 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)COc2ccc(F)cc2Br)c1 ZINC000122744325 564425931 /nfs/dbraw/zinc/42/59/31/564425931.db2.gz ZVYJKIYNUWXCNC-LBPRGKRZSA-N 0 0 386.173 3.315 20 5 GGBDRN O=C(Cc1ccc(Br)cc1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122760997 564427049 /nfs/dbraw/zinc/42/70/49/564427049.db2.gz KUBUVGOVZAFZEV-UHFFFAOYSA-N 0 0 375.182 3.415 20 5 GGBDRN O=C1c2ccccc2C(=O)N1CCOc1c(Br)cccc1[N+](=O)[O-] ZINC000122779896 564427752 /nfs/dbraw/zinc/42/77/52/564427752.db2.gz MOTVPJKCQGKKJH-UHFFFAOYSA-N 0 0 391.177 3.032 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccc(Br)cc1)CCC2 ZINC000040631110 564428074 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COc1ccc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000122836996 564429770 /nfs/dbraw/zinc/42/97/70/564429770.db2.gz BRPXNIRICTYLDO-CQSZACIVSA-N 0 0 382.463 3.499 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000122884343 564430357 /nfs/dbraw/zinc/43/03/57/564430357.db2.gz XXXFOAYEAGRNKW-UHFFFAOYSA-N 0 0 383.476 3.395 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000122882268 564430703 /nfs/dbraw/zinc/43/07/03/564430703.db2.gz DSJCHULMZKXRCG-UHFFFAOYSA-N 0 0 382.463 3.327 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCc2csc(=O)[nH]2)cc1[N+](=O)[O-] ZINC000122898343 564431657 /nfs/dbraw/zinc/43/16/57/564431657.db2.gz HWSQRLQZYWHXHI-UHFFFAOYSA-N 0 0 381.479 3.413 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-] ZINC000122934899 564432449 /nfs/dbraw/zinc/43/24/49/564432449.db2.gz OLDAPDITMFOAQH-UHFFFAOYSA-N 0 0 385.448 3.160 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000122945591 564433330 /nfs/dbraw/zinc/43/33/30/564433330.db2.gz ZXLRYHUVNCBMRM-AWEZNQCLSA-N 0 0 382.463 3.499 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCc3ccsc3C2)cc1[N+](=O)[O-] ZINC000122981301 564434251 /nfs/dbraw/zinc/43/42/51/564434251.db2.gz XHQPOTOKJREGGR-UHFFFAOYSA-N 0 0 378.475 3.483 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2ccccc2Br)cc1[N+](=O)[O-] ZINC000041779437 564436385 /nfs/dbraw/zinc/43/63/85/564436385.db2.gz ZPMOVUHXVKGZPI-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN CC[C@@H]1CCCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000123050339 564436811 /nfs/dbraw/zinc/43/68/11/564436811.db2.gz WBCCCIBVELBLRJ-SNVBAGLBSA-N 0 0 388.205 3.462 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCOc3c(Cl)cccc32)c(Cl)c1 ZINC000123059392 564437119 /nfs/dbraw/zinc/43/71/19/564437119.db2.gz NJPLBWDHOFKARW-UHFFFAOYSA-N 0 0 389.216 3.489 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)Cc1cc(Br)cn1C ZINC000123056673 564437787 /nfs/dbraw/zinc/43/77/87/564437787.db2.gz UFMAJVBTCHJTMO-UHFFFAOYSA-N 0 0 397.229 3.368 20 5 GGBDRN COc1cc(C(=O)Nc2nc(C(F)(F)F)cs2)c([N+](=O)[O-])cc1OC ZINC000041867187 564438487 /nfs/dbraw/zinc/43/84/87/564438487.db2.gz SPOAWDMUXXWTRN-UHFFFAOYSA-N 0 0 377.300 3.340 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2c3ccccc3C[C@H]2O)cc1[N+](=O)[O-] ZINC000123157782 564439884 /nfs/dbraw/zinc/43/98/84/564439884.db2.gz JNMYUXUHHJOEPG-CVEARBPZSA-N 0 0 391.221 3.054 20 5 GGBDRN COc1ccc(CSc2nnc(N(C(C)=O)C3CC3)s2)cc1[N+](=O)[O-] ZINC000042155948 564442966 /nfs/dbraw/zinc/44/29/66/564442966.db2.gz MLJGTRRNHWDJOZ-UHFFFAOYSA-N 0 0 380.451 3.263 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cc1[N+](=O)[O-] ZINC000123346747 564446113 /nfs/dbraw/zinc/44/61/13/564446113.db2.gz UGNLYMDGAKEQGC-UHFFFAOYSA-N 0 0 379.419 3.348 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cc(Br)c2c(c1)OCCO2 ZINC000123344757 564446254 /nfs/dbraw/zinc/44/62/54/564446254.db2.gz RLMXPOUDZJDOHW-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN CC(C)C(=O)N1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000123546083 564452940 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/nfs/dbraw/zinc/61/25/28/564612528.db2.gz YWQBGZMSPNEAET-UHFFFAOYSA-N 0 0 395.257 3.301 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2nccs2)CC1 ZINC000128309976 564614455 /nfs/dbraw/zinc/61/44/55/564614455.db2.gz BQZIOOSGJDKSIZ-UHFFFAOYSA-N 0 0 378.479 3.126 20 5 GGBDRN CCOC(=O)CC[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000128303329 564614537 /nfs/dbraw/zinc/61/45/37/564614537.db2.gz BPYHWPXXFHWAJJ-LLVKDONJSA-N 0 0 386.246 3.312 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc2c(c(Br)c1)OCO2 ZINC000055222798 564617415 /nfs/dbraw/zinc/61/74/15/564617415.db2.gz TWTIBKJZAWVTBD-UHFFFAOYSA-N 0 0 393.193 3.358 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000055258753 564618532 /nfs/dbraw/zinc/61/85/32/564618532.db2.gz LAYADOULMLAXNN-UWVGGRQHSA-N 0 0 381.376 3.036 20 5 GGBDRN CN(Cc1nc2ccccc2s1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000128563138 564623033 /nfs/dbraw/zinc/62/30/33/564623033.db2.gz GVSUOTFLMLKRDU-UHFFFAOYSA-N 0 0 381.410 3.164 20 5 GGBDRN 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397.156 3.155 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCn1cc(Br)ccc1=O ZINC000129402076 564647683 /nfs/dbraw/zinc/64/76/83/564647683.db2.gz VUQNBDXYYNCGJC-UHFFFAOYSA-N 0 0 394.225 3.165 20 5 GGBDRN O=C(Nc1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1Br ZINC000129466822 564649171 /nfs/dbraw/zinc/64/91/71/564649171.db2.gz MJXHWFLGZABEDK-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000129453873 564649243 /nfs/dbraw/zinc/64/92/43/564649243.db2.gz XHSWWMQLVTWHGL-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN CCC[C@H]1SCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000129448194 564649445 /nfs/dbraw/zinc/64/94/45/564649445.db2.gz MYRLCZQULXHQMI-GFCCVEGCSA-N 0 0 384.401 3.477 20 5 GGBDRN Cc1ccn(CC[S@@](=O)c2cc(Cl)ccc2Cl)c(=O)c1[N+](=O)[O-] ZINC000129592347 564653594 /nfs/dbraw/zinc/65/35/94/564653594.db2.gz JQXZUTOSJNAYJG-QHCPKHFHSA-N 0 0 375.233 3.180 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCOc3c(Cl)cccc32)cc1 ZINC000057010609 564655902 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GGBDRN COc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000130010767 564666708 /nfs/dbraw/zinc/66/67/08/564666708.db2.gz IPSYEKFZQUVHFA-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)cc1 ZINC000057482917 564668875 /nfs/dbraw/zinc/66/88/75/564668875.db2.gz DLHORINMIHKCDJ-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Br)cn2)cc1OC ZINC000057807079 564674075 /nfs/dbraw/zinc/67/40/75/564674075.db2.gz CYCWJNSIXPWEJY-UHFFFAOYSA-N 0 0 396.197 3.412 20 5 GGBDRN CCOc1cc(C(=O)Nc2ccc(Br)cn2)c([N+](=O)[O-])cc1OC ZINC000057807591 564674136 /nfs/dbraw/zinc/67/41/36/564674136.db2.gz HISTUXBCSSNMCY-UHFFFAOYSA-N 0 0 396.197 3.412 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2nnc(NCC(F)(F)F)s2)c([N+](=O)[O-])c1 ZINC000057829632 564675428 /nfs/dbraw/zinc/67/54/28/564675428.db2.gz JJYHCMRGJRHUKQ-UHFFFAOYSA-N 0 0 381.317 3.480 20 5 GGBDRN Cc1ccc(Br)cc1S(=O)(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000058094382 564679484 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COc1ccc(CN(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1O ZINC000130661203 564688647 /nfs/dbraw/zinc/68/86/47/564688647.db2.gz XTAQWDWOUCXUKG-UHFFFAOYSA-N 0 0 395.209 3.344 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2sccc2Br)cc([N+](=O)[O-])c1 ZINC000058764548 564688684 /nfs/dbraw/zinc/68/86/84/564688684.db2.gz DDFZNQPJISEIPF-UHFFFAOYSA-N 0 0 399.222 3.135 20 5 GGBDRN O=C(NCc1sccc1Br)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000058766881 564689990 /nfs/dbraw/zinc/68/99/90/564689990.db2.gz KSMDBFBRPZHIAX-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000130768626 564691526 /nfs/dbraw/zinc/69/15/26/564691526.db2.gz IKSIFSGSERERBD-WFASDCNBSA-N 0 0 382.463 3.115 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000059407871 564693592 /nfs/dbraw/zinc/69/35/92/564693592.db2.gz IZEFJTFMZPEBJX-SNVBAGLBSA-N 0 0 384.219 3.283 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000059407867 564693807 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C[C@@H](COc1cccc(F)c1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000060509616 564698975 /nfs/dbraw/zinc/69/89/75/564698975.db2.gz BRUSOKSXWDNHSH-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(-c3csnn3)cc2)cc1[N+](=O)[O-] ZINC000060554320 564700425 /nfs/dbraw/zinc/70/04/25/564700425.db2.gz JQUGXIXMLGWAIV-UHFFFAOYSA-N 0 0 376.419 3.223 20 5 GGBDRN CS(=O)(=O)c1ccc(NCc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000060707201 564701078 /nfs/dbraw/zinc/70/10/78/564701078.db2.gz UZJXJNFCQLOEJZ-UHFFFAOYSA-N 0 0 385.239 3.373 20 5 GGBDRN O=c1[nH]cnc2cc(NCc3ccc(Br)cc3)c([N+](=O)[O-])cc12 ZINC000060773958 564701893 /nfs/dbraw/zinc/70/18/93/564701893.db2.gz DXVJXCJMUAISSH-UHFFFAOYSA-N 0 0 375.182 3.206 20 5 GGBDRN O=c1[nH]cnc2cc(NCCc3ccccc3Br)c([N+](=O)[O-])cc12 ZINC000060864180 564701972 /nfs/dbraw/zinc/70/19/72/564701972.db2.gz NHTYAGBUPLEDRQ-UHFFFAOYSA-N 0 0 389.209 3.248 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCn2nnc(-c3ccc(Br)cc3)n2)cc1 ZINC000060816676 564702294 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GGBDRN O=C(CN1CCc2ccc([N+](=O)[O-])cc2C1)Nc1ccccc1Br ZINC000131280965 564706947 /nfs/dbraw/zinc/70/69/47/564706947.db2.gz ICAPGVNSGHELKV-UHFFFAOYSA-N 0 0 390.237 3.354 20 5 GGBDRN CCCN(CC(F)F)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000131289826 564707109 /nfs/dbraw/zinc/70/71/09/564707109.db2.gz ZPKIJEBDXLQNBO-UHFFFAOYSA-N 0 0 398.147 3.317 20 5 GGBDRN Cc1cccc(OCc2nnnn2-c2ccccc2Br)c1[N+](=O)[O-] ZINC000131308363 564708200 /nfs/dbraw/zinc/70/82/00/564708200.db2.gz OGJIAIVXTQGKEI-UHFFFAOYSA-N 0 0 390.197 3.220 20 5 GGBDRN COc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000062514567 564712422 /nfs/dbraw/zinc/71/24/22/564712422.db2.gz LUAIABGMTOPHFS-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN CCN(CCn1cc([N+](=O)[O-])ccc1=O)Cc1cc(Br)ccc1F ZINC000131481840 564713618 /nfs/dbraw/zinc/71/36/18/564713618.db2.gz ZAHQMMDMWZIUHM-UHFFFAOYSA-N 0 0 398.232 3.180 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cccc(O)c2F)c(C(F)(F)F)c1 ZINC000131512826 564715054 /nfs/dbraw/zinc/71/50/54/564715054.db2.gz 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ZINC000063796864 564723042 /nfs/dbraw/zinc/72/30/42/564723042.db2.gz RXIUXRUMGZDIQH-UHFFFAOYSA-N 0 0 393.241 3.269 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000063846397 564723695 /nfs/dbraw/zinc/72/36/95/564723695.db2.gz BNTCCIAOEWNFBU-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=C(NCCc1ccccc1Br)NCc1ccc([N+](=O)[O-])cc1 ZINC000064242212 564726562 /nfs/dbraw/zinc/72/65/62/564726562.db2.gz OFUHYBBXJYATMP-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000064418841 564729233 /nfs/dbraw/zinc/72/92/33/564729233.db2.gz LHTYEEUGWWJXHL-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN COC(=O)c1csc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000131986996 564730553 /nfs/dbraw/zinc/73/05/53/564730553.db2.gz DHEYINDZCOZKBS-UHFFFAOYSA-N 0 0 399.222 3.387 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000064511696 564731781 /nfs/dbraw/zinc/73/17/81/564731781.db2.gz FCOIYOSYZCKHHO-UHFFFAOYSA-N 0 0 394.225 3.094 20 5 GGBDRN CS(=O)(=O)Nc1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1Cl ZINC000132056662 564732518 /nfs/dbraw/zinc/73/25/18/564732518.db2.gz DMSVNGWQEOWYGN-UHFFFAOYSA-N 0 0 387.776 3.011 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Br)s1 ZINC000132252303 564737568 /nfs/dbraw/zinc/73/75/68/564737568.db2.gz AUEVZKOUFFXPDG-UHFFFAOYSA-N 0 0 377.241 3.244 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)c2cc(Cl)ccc2Cl)cc1 ZINC000064953440 564737814 /nfs/dbraw/zinc/73/78/14/564737814.db2.gz IMSCIWKIBNQRNJ-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1csc(C)n1 ZINC000132277639 564738617 /nfs/dbraw/zinc/73/86/17/564738617.db2.gz ALUJCYKXURYRMI-UHFFFAOYSA-N 0 0 381.479 3.071 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cc(F)ccc1Br ZINC000132338274 564740371 /nfs/dbraw/zinc/74/03/71/564740371.db2.gz YUKXUGXVIXIFTF-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1csc(Br)c1 ZINC000065511745 564744027 /nfs/dbraw/zinc/74/40/27/564744027.db2.gz 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564747270 /nfs/dbraw/zinc/74/72/70/564747270.db2.gz CWMUCEJUXVTERX-UHFFFAOYSA-N 0 0 384.479 3.056 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000132574466 564747831 /nfs/dbraw/zinc/74/78/31/564747831.db2.gz HYJVGPBUDGZDGC-UHFFFAOYSA-N 0 0 392.209 3.246 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCc2ccccc2C1 ZINC000132635970 564748845 /nfs/dbraw/zinc/74/88/45/564748845.db2.gz QTZQPBPGPKVXBH-UHFFFAOYSA-N 0 0 375.222 3.485 20 5 GGBDRN Cc1cc(C(=O)NCCOc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000065765458 564749430 /nfs/dbraw/zinc/74/94/30/564749430.db2.gz IJHLVHYWAAUFHH-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN COc1cc(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)ccc1SC ZINC000132689063 564750192 /nfs/dbraw/zinc/75/01/92/564750192.db2.gz AIDKBSVIQQWJMH-UHFFFAOYSA-N 0 0 385.239 3.298 20 5 GGBDRN O=c1c(Br)cn(Cc2cc(-c3cccs3)on2)cc1[N+](=O)[O-] ZINC000132714539 564750994 /nfs/dbraw/zinc/75/09/94/564750994.db2.gz RMKKRRPBEXZGPI-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1cc(F)ccc1Br ZINC000065874197 564751052 /nfs/dbraw/zinc/75/10/52/564751052.db2.gz WKHWHEYKSMDNEE-UHFFFAOYSA-N 0 0 382.189 3.225 20 5 GGBDRN CN(Cc1csc(Br)c1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000065895534 564751585 /nfs/dbraw/zinc/75/15/85/564751585.db2.gz VVULTVHGRBQBOQ-UHFFFAOYSA-N 0 0 384.255 3.489 20 5 GGBDRN C[C@@H](O)C[C@H](C)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000132758949 564752208 /nfs/dbraw/zinc/75/22/08/564752208.db2.gz ZTEQKJUFKOARIJ-JGVFFNPUSA-N 0 0 379.638 3.148 20 5 GGBDRN C[C@H](O)C[C@H](C)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000132759354 564752232 /nfs/dbraw/zinc/75/22/32/564752232.db2.gz ZTEQKJUFKOARIJ-YUMQZZPRSA-N 0 0 379.638 3.148 20 5 GGBDRN O=c1c(Br)cn(Cc2coc(-c3cccs3)n2)cc1[N+](=O)[O-] ZINC000132802664 564753530 /nfs/dbraw/zinc/75/35/30/564753530.db2.gz DXFHSQFHPAIHBO-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN O=c1c(Br)cn(CCCOCCc2ccccc2)cc1[N+](=O)[O-] ZINC000132848367 564755035 /nfs/dbraw/zinc/75/50/35/564755035.db2.gz UIYIOTNEWLDVGV-UHFFFAOYSA-N 0 0 381.226 3.168 20 5 GGBDRN CC(C)c1cc(Br)ccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000132899081 564756991 /nfs/dbraw/zinc/75/69/91/564756991.db2.gz WKQNQQSBSFYUOW-UHFFFAOYSA-N 0 0 394.225 3.281 20 5 GGBDRN O=C(NCc1ccc(Br)s1)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066290945 564760814 /nfs/dbraw/zinc/76/08/14/564760814.db2.gz COPBGZGLQWZOKS-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN COc1ccc2c(c1)CN(S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000066334376 564762447 /nfs/dbraw/zinc/76/24/47/564762447.db2.gz MNHDUDSSMDSEDI-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN Nc1c(C(=O)N2CCc3cc(Br)ccc32)cc(F)cc1[N+](=O)[O-] ZINC000066338416 564763432 /nfs/dbraw/zinc/76/34/32/564763432.db2.gz YLTJWMXBSISCOQ-UHFFFAOYSA-N 0 0 380.173 3.282 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1ncc(-c2ccccc2Br)o1 ZINC000133142950 564764388 /nfs/dbraw/zinc/76/43/88/564764388.db2.gz SDZXHYMONQPQOI-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CSc2nc3cc(Cl)cnc3[nH]2)c1 ZINC000066399729 564764823 /nfs/dbraw/zinc/76/48/23/564764823.db2.gz CAUSXJGCGQAIHD-LLVKDONJSA-N 0 0 380.813 3.052 20 5 GGBDRN COc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000133195568 564765800 /nfs/dbraw/zinc/76/58/00/564765800.db2.gz UDRVUYONKIHUSA-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN CCc1nc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cs1 ZINC000133175447 564765852 /nfs/dbraw/zinc/76/58/52/564765852.db2.gz UPROMNVSRIVQDX-UHFFFAOYSA-N 0 0 398.282 3.278 20 5 GGBDRN CCCN(CC(F)F)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000066576886 564769352 /nfs/dbraw/zinc/76/93/52/564769352.db2.gz MLTXJCGWQNNODI-UHFFFAOYSA-N 0 0 387.202 3.023 20 5 GGBDRN CCCN(CC1CC1)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000066568845 564769464 /nfs/dbraw/zinc/76/94/64/564769464.db2.gz YCFBHIUIVVNTHB-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)Cc2ccc(Br)o2)c1[N+](=O)[O-] ZINC000133359232 564771028 /nfs/dbraw/zinc/77/10/28/564771028.db2.gz OHHSYAZUPPMHBG-UHFFFAOYSA-N 0 0 384.186 3.158 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@H]1c1ccccc1Br ZINC000133485252 564776245 /nfs/dbraw/zinc/77/62/45/564776245.db2.gz HXGQGGDZXNILJF-AWEZNQCLSA-N 0 0 393.241 3.226 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCOc1ccccc1Br ZINC000133512192 564776925 /nfs/dbraw/zinc/77/69/25/564776925.db2.gz LLVHDBJNRJPDCM-UHFFFAOYSA-N 0 0 379.166 3.344 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000133513102 564776951 /nfs/dbraw/zinc/77/69/51/564776951.db2.gz PUVVSHLEHZMJKL-UHFFFAOYSA-N 0 0 383.231 3.465 20 5 GGBDRN COc1cccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000133684329 564781765 /nfs/dbraw/zinc/78/17/65/564781765.db2.gz AWOQIJGTRADJOA-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN NC(=O)Nc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000133672484 564782076 /nfs/dbraw/zinc/78/20/76/564782076.db2.gz ADJBPOXYDLHVNQ-UHFFFAOYSA-N 0 0 394.181 3.110 20 5 GGBDRN Cc1ccccc1CNC(=O)COc1ccc([N+](=O)[O-])cc1Br ZINC000133692026 564782626 /nfs/dbraw/zinc/78/26/26/564782626.db2.gz 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ZINC000133845962 564787119 /nfs/dbraw/zinc/78/71/19/564787119.db2.gz ZHPKNKKVDSDJTI-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN C[C@@H](COCC(F)(F)F)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000067277070 564787812 /nfs/dbraw/zinc/78/78/12/564787812.db2.gz PZQVDKARRWPKGO-IUCAKERBSA-N 0 0 384.738 3.099 20 5 GGBDRN COCCOCCCCNc1ccc(I)cc1[N+](=O)[O-] ZINC000133953388 564789573 /nfs/dbraw/zinc/78/95/73/564789573.db2.gz GOXAXAGDLADZQA-UHFFFAOYSA-N 0 0 394.209 3.055 20 5 GGBDRN CN(Cc1ccc(Br)o1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067376999 564790201 /nfs/dbraw/zinc/79/02/01/564790201.db2.gz FSSSNDBJLWKANS-CQSZACIVSA-N 0 0 394.225 3.188 20 5 GGBDRN CCCNc1nnc(S[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000067428831 564792444 /nfs/dbraw/zinc/79/24/44/564792444.db2.gz RRWWOYUJJYAAIO-LBPRGKRZSA-N 0 0 379.467 3.166 20 5 GGBDRN CCCNc1nnc(S[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000067428830 564792459 /nfs/dbraw/zinc/79/24/59/564792459.db2.gz RRWWOYUJJYAAIO-GFCCVEGCSA-N 0 0 379.467 3.166 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1C ZINC000134090795 564793538 /nfs/dbraw/zinc/79/35/38/564793538.db2.gz ZMVOKBQAHXZVRE-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@@H](c2ccc(Br)cc2)C1 ZINC000067826923 564799453 /nfs/dbraw/zinc/79/94/53/564799453.db2.gz GCDCMNNXUMDVBX-CYBMUJFWSA-N 0 0 381.182 3.164 20 5 GGBDRN COc1ccc(CC(=O)NCc2cc(Br)ccc2F)cc1[N+](=O)[O-] ZINC000067801246 564800083 /nfs/dbraw/zinc/80/00/83/564800083.db2.gz MAXGFKKGNOBMQS-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(Br)cc2O)cc1[N+](=O)[O-] ZINC000067906727 564802763 /nfs/dbraw/zinc/80/27/63/564802763.db2.gz GCBZERYZVVNFAH-UHFFFAOYSA-N 0 0 381.182 3.253 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(Br)c[nH]c1=O ZINC000067941248 564803427 /nfs/dbraw/zinc/80/34/27/564803427.db2.gz YVWNLMBJAWFJRB-QMMMGPOBSA-N 0 0 398.238 3.165 20 5 GGBDRN Cc1c(OCc2nnnn2-c2ccccc2Br)cccc1[N+](=O)[O-] ZINC000067952500 564803898 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CSC[C@H]1CCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000134628534 564808955 /nfs/dbraw/zinc/80/89/55/564808955.db2.gz AVEMWPZJOIQAOJ-SECBINFHSA-N 0 0 385.294 3.418 20 5 GGBDRN O=C(Cc1ccc(Br)cc1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068186986 564810976 /nfs/dbraw/zinc/81/09/76/564810976.db2.gz POGWUZMQBYHBPW-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000134658869 564811048 /nfs/dbraw/zinc/81/10/48/564811048.db2.gz WBFGKBPRXVNISG-GFCCVEGCSA-N 0 0 388.873 3.408 20 5 GGBDRN O=C(Cc1ccc(F)c(Br)c1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068186553 564811228 /nfs/dbraw/zinc/81/12/28/564811228.db2.gz HLYTZYRZZQQWKV-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cc(Br)ccc1F ZINC000068186399 564811235 /nfs/dbraw/zinc/81/12/35/564811235.db2.gz LRGPRFSTMAGFRX-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000134663372 564812023 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O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cccc(Cl)c1SCC(F)F ZINC000134994694 564820986 /nfs/dbraw/zinc/82/09/86/564820986.db2.gz SPCKMKRQBSCDDJ-UHFFFAOYSA-N 0 0 376.772 3.441 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000135048638 564822176 /nfs/dbraw/zinc/82/21/76/564822176.db2.gz PPZSELAHWGGOSO-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H]1CCCc2sccc21 ZINC000135035960 564822273 /nfs/dbraw/zinc/82/22/73/564822273.db2.gz MQOFGOQQOAOBCP-GFCCVEGCSA-N 0 0 379.825 3.442 20 5 GGBDRN COCCN(CC(F)(F)F)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000068775750 564826400 /nfs/dbraw/zinc/82/64/00/564826400.db2.gz UEQKPDPZUOHNMA-VIFPVBQESA-N 0 0 384.738 3.053 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCOc3ccc(F)cc32)c(Cl)c1 ZINC000068937849 564829366 /nfs/dbraw/zinc/82/93/66/564829366.db2.gz HBBWEMDWTUTKFQ-CYBMUJFWSA-N 0 0 386.788 3.189 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCC2(Sc3ccccc3)CC2)cc1 ZINC000068945545 564830472 /nfs/dbraw/zinc/83/04/72/564830472.db2.gz RZBDPUWKIGNAQT-UHFFFAOYSA-N 0 0 378.475 3.339 20 5 GGBDRN CSC[C@H]1CCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000135431527 564830867 /nfs/dbraw/zinc/83/08/67/564830867.db2.gz AGQOPJTWIPBAOM-LLVKDONJSA-N 0 0 388.287 3.123 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000069137157 564834351 /nfs/dbraw/zinc/83/43/51/564834351.db2.gz NYDNMANSOLUWHP-CQSZACIVSA-N 0 0 393.193 3.001 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCc2cc(Br)ccc21 ZINC000069361131 564838673 /nfs/dbraw/zinc/83/86/73/564838673.db2.gz HKTGIGORTVWHQA-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCOc1ncc(Cl)cc1Cl ZINC000135847966 564840707 /nfs/dbraw/zinc/84/07/07/564840707.db2.gz JACWXMNZMXHBOU-UHFFFAOYSA-N 0 0 384.219 3.424 20 5 GGBDRN CCC(=O)[C@@H]1CCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000136006924 564844002 /nfs/dbraw/zinc/84/40/02/564844002.db2.gz WDDRRZQLDVFCNN-AWEZNQCLSA-N 0 0 383.242 3.260 20 5 GGBDRN CCC(=O)[C@H]1CCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000136006961 564844111 /nfs/dbraw/zinc/84/41/11/564844111.db2.gz WDDRRZQLDVFCNN-CQSZACIVSA-N 0 0 383.242 3.260 20 5 GGBDRN O=C(NCCc1ccc(Cl)s1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136466557 564851253 /nfs/dbraw/zinc/85/12/53/564851253.db2.gz OPVFUPOSZFTMAJ-UHFFFAOYSA-N 0 0 386.882 3.367 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000070751829 564851396 /nfs/dbraw/zinc/85/13/96/564851396.db2.gz COQBERFONSWMFU-LBPRGKRZSA-N 0 0 380.447 3.037 20 5 GGBDRN O=C(NCCc1ccccc1Cl)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136695652 564853411 /nfs/dbraw/zinc/85/34/11/564853411.db2.gz HTDHKRXORVNAOF-UHFFFAOYSA-N 0 0 380.853 3.305 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Cl)cc1OCC(F)(F)F ZINC000071070281 564855029 /nfs/dbraw/zinc/85/50/29/564855029.db2.gz PLRMAKGARLAXGW-UHFFFAOYSA-N 0 0 378.694 3.025 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCCO)c1nc(C)cs1 ZINC000136947027 564856543 /nfs/dbraw/zinc/85/65/43/564856543.db2.gz QJXHYALHXAILJW-ZDUSSCGKSA-N 0 0 381.479 3.325 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)CCOc1ccc(Cl)cc1 ZINC000071906027 564859311 /nfs/dbraw/zinc/85/93/11/564859311.db2.gz YIFJZKQCTGTFKS-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccc(Br)cc1F ZINC000072105654 564861662 /nfs/dbraw/zinc/86/16/62/564861662.db2.gz LQTLUIZIBXDYLW-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN O=c1c2cc(Br)ccc2ncn1Cc1c(F)cccc1[N+](=O)[O-] ZINC000078412132 564862537 /nfs/dbraw/zinc/86/25/37/564862537.db2.gz RHYZJYJCIQWGGC-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1CCCCO1 ZINC000139766539 564869596 /nfs/dbraw/zinc/86/95/96/564869596.db2.gz DABVQGRLICYRGY-NSHDSACASA-N 0 0 378.372 3.391 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000142996636 564876323 /nfs/dbraw/zinc/87/63/23/564876323.db2.gz FEBIZNKDBVJUHP-CYBMUJFWSA-N 0 0 380.857 3.497 20 5 GGBDRN O=C(NC[C@@H](O)COc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000143782945 564876401 /nfs/dbraw/zinc/87/64/01/564876401.db2.gz UYJSYMPYKXREHW-GFCCVEGCSA-N 0 0 385.203 3.071 20 5 GGBDRN O=C(NCCc1ccccc1Br)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000145242662 564878362 /nfs/dbraw/zinc/87/83/62/564878362.db2.gz JCEOXEYYICDPDF-UHFFFAOYSA-N 0 0 389.209 3.206 20 5 GGBDRN CNc1ccc(C(=O)NCCc2ccccc2Br)cc1[N+](=O)[O-] ZINC000145254794 564878806 /nfs/dbraw/zinc/87/88/06/564878806.db2.gz QXYLJGLJUOAZDO-UHFFFAOYSA-N 0 0 378.226 3.372 20 5 GGBDRN COCCN(Cc1cccs1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000145612596 564879337 /nfs/dbraw/zinc/87/93/37/564879337.db2.gz ZDQBBSJSGQQGCD-UHFFFAOYSA-N 0 0 390.870 3.147 20 5 GGBDRN O=C(NC1(c2cccc(Br)c2)CCOCC1)c1cc([N+](=O)[O-])c[nH]1 ZINC000145956133 564879486 /nfs/dbraw/zinc/87/94/86/564879486.db2.gz ZXELBYDWMITFHD-UHFFFAOYSA-N 0 0 394.225 3.121 20 5 GGBDRN C[C@@H](Cc1cccc(Br)c1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000145488481 564879681 /nfs/dbraw/zinc/87/96/81/564879681.db2.gz VLMGWVFWJQLGOT-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000092706134 564880446 /nfs/dbraw/zinc/88/04/46/564880446.db2.gz MHXMBNNPTCKHGG-CQSZACIVSA-N 0 0 398.301 3.342 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1ccc(OC(F)F)cc1 ZINC000146535702 564881958 /nfs/dbraw/zinc/88/19/58/564881958.db2.gz RMABYSSUEJNBFF-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN CN(Cc1ccc(F)cc1F)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000146673681 564882085 /nfs/dbraw/zinc/88/20/85/564882085.db2.gz UXOOYXUPEBDQJC-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccncc2Br)c(Cl)c1 ZINC000147718652 564882654 /nfs/dbraw/zinc/88/26/54/564882654.db2.gz RUUYMIJEJGDTHW-UHFFFAOYSA-N 0 0 392.618 3.207 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)sc1Br ZINC000150120434 564886801 /nfs/dbraw/zinc/88/68/01/564886801.db2.gz SEWWUBWRDHHYSF-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN C[C@@H]1[C@H](C)N(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCS1(=O)=O ZINC000093559803 564888158 /nfs/dbraw/zinc/88/81/58/564888158.db2.gz UZTNYBHQUKZQCG-QWHCGFSZSA-N 0 0 380.491 3.331 20 5 GGBDRN COC(=O)CCN(CC(C)C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000150762878 564890069 /nfs/dbraw/zinc/89/00/69/564890069.db2.gz WRTIGZBWMDSLKQ-UHFFFAOYSA-N 0 0 387.230 3.019 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1CCOc1ccc(F)cc1Cl ZINC000093888369 564891680 /nfs/dbraw/zinc/89/16/80/564891680.db2.gz WOQZKMSWPOPDAM-UHFFFAOYSA-N 0 0 391.580 3.391 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCc3c(Cl)cccc3C2)ccc1[N+](=O)[O-] ZINC000150818011 564891832 /nfs/dbraw/zinc/89/18/32/564891832.db2.gz URRXYFJPEDXMMH-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)[C@H](C)c2sc(C)nc2C)ccc1[N+](=O)[O-] ZINC000150811318 564891984 /nfs/dbraw/zinc/89/19/84/564891984.db2.gz HICFCCDDSDTVMP-SNVBAGLBSA-N 0 0 385.467 3.058 20 5 GGBDRN COc1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000150879163 564895573 /nfs/dbraw/zinc/89/55/73/564895573.db2.gz ISACKJHUIFTMSQ-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN COC(=O)c1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000150913427 564896726 /nfs/dbraw/zinc/89/67/26/564896726.db2.gz JPNCFOATGNZOSH-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN CCc1nn(C)c(N(C)CC(=O)Nc2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000094131658 564897474 /nfs/dbraw/zinc/89/74/74/564897474.db2.gz JTBOMMHEJOXHOX-UHFFFAOYSA-N 0 0 386.239 3.272 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)Nc1sc(C)c(C)c1C ZINC000150924612 564897609 /nfs/dbraw/zinc/89/76/09/564897609.db2.gz QASFAVZNRSSEFW-UHFFFAOYSA-N 0 0 387.259 3.488 20 5 GGBDRN CCc1nn(C)c(N[C@@H]2CCN(c3ccccc3Br)C2)c1[N+](=O)[O-] ZINC000094158132 564898009 /nfs/dbraw/zinc/89/80/09/564898009.db2.gz VPEWXEVCRYFIJC-LLVKDONJSA-N 0 0 394.273 3.344 20 5 GGBDRN CCc1nn(C)c(N[C@H]2CCN(c3ccccc3Br)C2)c1[N+](=O)[O-] ZINC000094158133 564898091 /nfs/dbraw/zinc/89/80/91/564898091.db2.gz VPEWXEVCRYFIJC-NSHDSACASA-N 0 0 394.273 3.344 20 5 GGBDRN CCc1nn(C)c(N2CCO[C@@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000094152459 564898195 /nfs/dbraw/zinc/89/81/95/564898195.db2.gz KPQOKNFXGNWYAQ-CQSZACIVSA-N 0 0 395.257 3.231 20 5 GGBDRN CC(C)(C)OC1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000150951085 564898874 /nfs/dbraw/zinc/89/88/74/564898874.db2.gz HEDBROOBAXQVME-UHFFFAOYSA-N 0 0 376.862 3.216 20 5 GGBDRN CC[C@@H](COC)NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000150966167 564900193 /nfs/dbraw/zinc/90/01/93/564900193.db2.gz NFRLDAKQDNMKFH-VIFPVBQESA-N 0 0 387.223 3.242 20 5 GGBDRN CC(C)CO[C@@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000151014310 564901727 /nfs/dbraw/zinc/90/17/27/564901727.db2.gz FPAZJWOVJAHXGW-LLVKDONJSA-N 0 0 397.280 3.337 20 5 GGBDRN Cc1cccc(N2CCN(c3ncc(Br)cc3[N+](=O)[O-])CC2)c1 ZINC000096573030 564901964 /nfs/dbraw/zinc/90/19/64/564901964.db2.gz CFYNEDIJLLYVOD-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NC(c1cccs1)c1cccs1 ZINC000151071827 564903663 /nfs/dbraw/zinc/90/36/63/564903663.db2.gz MDOTWXRYBDFJKY-UHFFFAOYSA-N 0 0 377.451 3.003 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCCc1cscn1 ZINC000097348163 564907239 /nfs/dbraw/zinc/90/72/39/564907239.db2.gz RBWSXIWUASJIGM-UHFFFAOYSA-N 0 0 375.191 3.311 20 5 GGBDRN Cc1ccccc1CNC(=O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000151147375 564907314 /nfs/dbraw/zinc/90/73/14/564907314.db2.gz HADIFEUFHHOLED-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN CN(c1ccccc1F)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000097548745 564908498 /nfs/dbraw/zinc/90/84/98/564908498.db2.gz LIHLYJZDQMXKEY-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN CN1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)c2ccccc21 ZINC000151180769 564909066 /nfs/dbraw/zinc/90/90/66/564909066.db2.gz CEENQETUQGMJIG-UHFFFAOYSA-N 0 0 390.237 3.383 20 5 GGBDRN Cc1nn(C)c(C(=O)NC2(c3ccc(Br)cc3)CCC2)c1[N+](=O)[O-] ZINC000098102573 564913807 /nfs/dbraw/zinc/91/38/07/564913807.db2.gz MTHUWXNTVTXDND-UHFFFAOYSA-N 0 0 393.241 3.208 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2cc(Br)cs2)c([N+](=O)[O-])c1 ZINC000101572651 564918495 /nfs/dbraw/zinc/91/84/95/564918495.db2.gz ZFZFHKREQPTNEI-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1cccc(OCCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000151435058 564920034 /nfs/dbraw/zinc/92/00/34/564920034.db2.gz NWCHKVZGNFLIRM-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc2cc(Br)ccc2c1 ZINC000151487938 564922436 /nfs/dbraw/zinc/92/24/36/564922436.db2.gz YYSQQMZTZHRKPM-UHFFFAOYSA-N 0 0 389.209 3.137 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H](O)Cc1ccccc1 ZINC000151512918 564923135 /nfs/dbraw/zinc/92/31/35/564923135.db2.gz JIFCPVFHSPKGQR-BDJLRTHQSA-N 0 0 393.237 3.079 20 5 GGBDRN Cn1c(=O)oc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)ccc21 ZINC000151517953 564924450 /nfs/dbraw/zinc/92/44/50/564924450.db2.gz WVNRORWMDVZEGD-UHFFFAOYSA-N 0 0 392.165 3.055 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000102203112 564926938 /nfs/dbraw/zinc/92/69/38/564926938.db2.gz CEIPOGMJAOLQJC-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCc1cccc(F)c1 ZINC000151566101 564927381 /nfs/dbraw/zinc/92/73/81/564927381.db2.gz CRKFOGDWOTYKJT-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000102241711 564927504 /nfs/dbraw/zinc/92/75/04/564927504.db2.gz PXQVUOXFJABLCS-LLVKDONJSA-N 0 0 395.257 3.036 20 5 GGBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC)c1ccc(Br)cn1 ZINC000102255735 564927644 /nfs/dbraw/zinc/92/76/44/564927644.db2.gz NNWCWAFKPWVBDF-UHFFFAOYSA-N 0 0 380.198 3.428 20 5 GGBDRN COc1ccc(C(=O)NCc2ccc(O)c(Br)c2)cc1[N+](=O)[O-] ZINC000151582600 564927996 /nfs/dbraw/zinc/92/79/96/564927996.db2.gz LFPUCCXZDQSYNM-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)c2ccccc2C1 ZINC000151592734 564928361 /nfs/dbraw/zinc/92/83/61/564928361.db2.gz YIBSQOMDGWYWCM-UHFFFAOYSA-N 0 0 390.237 3.450 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2cc(F)ccc2Cl)c([N+](=O)[O-])c1 ZINC000102742122 564933339 /nfs/dbraw/zinc/93/33/39/564933339.db2.gz YPXJGZRXOAEIBG-UHFFFAOYSA-N 0 0 383.788 3.217 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000151790120 564936838 /nfs/dbraw/zinc/93/68/38/564936838.db2.gz RNOQDXJBXQXRQO-UHFFFAOYSA-N 0 0 394.225 3.471 20 5 GGBDRN CCOC(=O)CN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CCCC1 ZINC000151778159 564936884 /nfs/dbraw/zinc/93/68/84/564936884.db2.gz JVQYLEBPMXCUEP-UHFFFAOYSA-N 0 0 399.241 3.305 20 5 GGBDRN C[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@H](O)Cc1ccccc1 ZINC000151884824 564940101 /nfs/dbraw/zinc/94/01/01/564940101.db2.gz KMEMUTDMRLUZEU-BDJLRTHQSA-N 0 0 393.237 3.079 20 5 GGBDRN Cn1c(Sc2ccc(Br)cc2[N+](=O)[O-])nnc1-c1cnccn1 ZINC000151906964 564941152 /nfs/dbraw/zinc/94/11/52/564941152.db2.gz FDXUYCWXQHGLSH-UHFFFAOYSA-N 0 0 393.226 3.094 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Br)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000103036789 564941264 /nfs/dbraw/zinc/94/12/64/564941264.db2.gz NGOUGLDBEMKLEM-AWEZNQCLSA-N 0 0 390.237 3.366 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Br)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000103037116 564941897 /nfs/dbraw/zinc/94/18/97/564941897.db2.gz IVWRPZCWWLHXGH-CQSZACIVSA-N 0 0 390.237 3.366 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])c(Cl)c1 ZINC000103059662 564942072 /nfs/dbraw/zinc/94/20/72/564942072.db2.gz RGBJYEVRXYFWQA-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000151981108 564943388 /nfs/dbraw/zinc/94/33/88/564943388.db2.gz LVAFUTJGGCMPLN-GFCCVEGCSA-N 0 0 381.738 3.415 20 5 GGBDRN C[C@@H](c1ccco1)N(C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000103158058 564943688 /nfs/dbraw/zinc/94/36/88/564943688.db2.gz DHVCYMPECUTQII-VIFPVBQESA-N 0 0 389.227 3.332 20 5 GGBDRN CN(CC1CCCC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000103158205 564943764 /nfs/dbraw/zinc/94/37/64/564943764.db2.gz IAGPIXBPYDZQBP-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1Br)Nc1ccccc1 ZINC000152180476 564949505 /nfs/dbraw/zinc/94/95/05/564949505.db2.gz IIEJXAMLYROYCY-UHFFFAOYSA-N 0 0 392.209 3.116 20 5 GGBDRN CSCC[C@@H](C)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000152283745 564953619 /nfs/dbraw/zinc/95/36/19/564953619.db2.gz BOPQEEMUVIXXRS-SNVBAGLBSA-N 0 0 375.288 3.500 20 5 GGBDRN O=[N+]([O-])c1nn(C[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1Br ZINC000152297067 564953755 /nfs/dbraw/zinc/95/37/55/564953755.db2.gz ZIMBXDZODLNSEO-DOMZBBRYSA-N 0 0 396.241 3.009 20 5 GGBDRN C[C@H](CC(=O)c1cccs1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000152314965 564954565 /nfs/dbraw/zinc/95/45/65/564954565.db2.gz MXZLGGRPHZMMQL-SECBINFHSA-N 0 0 388.854 3.250 20 5 GGBDRN O=C(CNC(=O)Cc1cccc([N+](=O)[O-])c1)Nc1cc(Cl)ccc1Cl ZINC000152317659 564955438 /nfs/dbraw/zinc/95/54/38/564955438.db2.gz NZRVYITXYBFHIS-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CC[C@H]2OCCC[C@@H]2C1 ZINC000152378946 564957279 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Cc1nn(C)c(N2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c1[N+](=O)[O-] ZINC000154444494 565039474 /nfs/dbraw/zinc/03/94/74/565039474.db2.gz CFQTWLJAQHMERM-SECBINFHSA-N 0 0 375.376 3.496 20 5 GGBDRN Cc1ncc(CN2CCN(c3ccc(Br)cc3[N+](=O)[O-])CC2)s1 ZINC000110555887 565041887 /nfs/dbraw/zinc/04/18/87/565041887.db2.gz YLIRWTOJCUYAQY-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN CCC[C@H](O)CNC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000154528493 565042420 /nfs/dbraw/zinc/04/24/20/565042420.db2.gz HOGQXOMIDYTOJV-LBPRGKRZSA-N 0 0 381.479 3.402 20 5 GGBDRN CS[C@H]1CCCCN(c2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])C1 ZINC000154635897 565047278 /nfs/dbraw/zinc/04/72/78/565047278.db2.gz YRCIWXYIZNZNIX-JTQLQIEISA-N 0 0 380.438 3.313 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@@H]1CCc2c1cccc2O ZINC000154740308 565050893 /nfs/dbraw/zinc/05/08/93/565050893.db2.gz DZSTXFNAUKVQBK-OAHLLOKOSA-N 0 0 391.221 3.409 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])CCC2 ZINC000111365698 565053381 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565226115 /nfs/dbraw/zinc/22/61/15/565226115.db2.gz XEUYLLREMZZQCN-UHFFFAOYSA-N 0 0 384.841 3.267 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000294751509 565226187 /nfs/dbraw/zinc/22/61/87/565226187.db2.gz ITOBFQPDDHZUPR-ZBFHGGJFSA-N 0 0 399.216 3.280 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2Cl)c1[N+](=O)[O-] ZINC000294765553 565227173 /nfs/dbraw/zinc/22/71/73/565227173.db2.gz RAJHLLTWSAPCNB-YFKPBYRVSA-N 0 0 377.710 3.185 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2Cl)c1[N+](=O)[O-] ZINC000294765545 565227355 /nfs/dbraw/zinc/22/73/55/565227355.db2.gz RAJHLLTWSAPCNB-RXMQYKEDSA-N 0 0 377.710 3.185 20 5 GGBDRN C[S@@](=O)Cc1ccccc1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185903057 565227868 /nfs/dbraw/zinc/22/78/68/565227868.db2.gz MFNWXJBKFVMXOW-RUZDIDTESA-N 0 0 381.841 3.448 20 5 GGBDRN O=C1N[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N2CCSC[C@@H]12 ZINC000270821416 565229611 /nfs/dbraw/zinc/22/96/11/565229611.db2.gz RWMWIHOLBZPXAV-SWLSCSKDSA-N 0 0 379.825 3.054 20 5 GGBDRN COC(=O)CCc1csc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)n1 ZINC000294805573 565229657 /nfs/dbraw/zinc/22/96/57/565229657.db2.gz BOKDITOKBSIGJM-UHFFFAOYSA-N 0 0 383.813 3.371 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000160147910 565232495 /nfs/dbraw/zinc/23/24/95/565232495.db2.gz LGVFOOIBZFVLGD-UHFFFAOYSA-N 0 0 393.119 3.362 20 5 GGBDRN C[C@@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185970486 565232720 /nfs/dbraw/zinc/23/27/20/565232720.db2.gz PWLRHVVDUGVLJT-NSHDSACASA-N 0 0 377.447 3.114 20 5 GGBDRN CCc1[nH]nc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1Br ZINC000294867944 565233550 /nfs/dbraw/zinc/23/35/50/565233550.db2.gz GRQZWXDZSFBCJP-UHFFFAOYSA-N 0 0 395.213 3.244 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000185981605 565233733 /nfs/dbraw/zinc/23/37/33/565233733.db2.gz HRLAVMMFQMPNAF-GFCCVEGCSA-N 0 0 397.204 3.207 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC000185988132 565234182 /nfs/dbraw/zinc/23/41/82/565234182.db2.gz XDXNSZWWMVEPRU-CYBMUJFWSA-N 0 0 382.825 3.090 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(Br)c(C)nc1OC ZINC000185993098 565234235 /nfs/dbraw/zinc/23/42/35/565234235.db2.gz WPAJGGWKNKQOBW-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN Cc1nc(N2CCO[C@@H](c3ccc(F)c(Br)c3)C2)ncc1[N+](=O)[O-] ZINC000294901552 565235021 /nfs/dbraw/zinc/23/50/21/565235021.db2.gz HBPLKHIGVIVZID-CQSZACIVSA-N 0 0 397.204 3.173 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCN(c2cccs2)CC1 ZINC000186017326 565235186 /nfs/dbraw/zinc/23/51/86/565235186.db2.gz PFTGMKWUUAZUKG-UHFFFAOYSA-N 0 0 380.857 3.342 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1 ZINC000186031845 565235621 /nfs/dbraw/zinc/23/56/21/565235621.db2.gz IKYYVTPBULWAGF-JKSUJKDBSA-N 0 0 382.825 3.057 20 5 GGBDRN CC(C)[C@@]1(CO)CCCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000294916534 565235754 /nfs/dbraw/zinc/23/57/54/565235754.db2.gz WGULCZSZEUPITI-INIZCTEOSA-N 0 0 385.258 3.228 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1Br ZINC000186021368 565235836 /nfs/dbraw/zinc/23/58/36/565235836.db2.gz VOYDEWMGTFWRMY-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN CN(C[C@H](O)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160216885 565236709 /nfs/dbraw/zinc/23/67/09/565236709.db2.gz WBWSUSQSIOQJKI-VIFPVBQESA-N 0 0 375.225 3.001 20 5 GGBDRN O=C1CCCC[C@H]1[C@H]1CCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000186059216 565237023 /nfs/dbraw/zinc/23/70/23/565237023.db2.gz HRYOFRMXPHAKEI-WCQYABFASA-N 0 0 386.857 3.161 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000295012969 565239016 /nfs/dbraw/zinc/23/90/16/565239016.db2.gz VSOPXESVHNQECS-GDBMZVCRSA-N 0 0 381.226 3.141 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc(CCO)cc2)cc1[N+](=O)[O-] ZINC000160377021 565242320 /nfs/dbraw/zinc/24/23/20/565242320.db2.gz LPXSVJFDZNAPOV-UHFFFAOYSA-N 0 0 379.210 3.453 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000160385931 565242815 /nfs/dbraw/zinc/24/28/15/565242815.db2.gz VPHACMPZDAKVQV-QWHCGFSZSA-N 0 0 380.388 3.178 20 5 GGBDRN Cc1ccc(C)n1C1CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000271253921 565244963 /nfs/dbraw/zinc/24/49/63/565244963.db2.gz JQQKZABRPKJTEL-UHFFFAOYSA-N 0 0 383.495 3.320 20 5 GGBDRN C[C@@H]1C[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCO1 ZINC000271261487 565245317 /nfs/dbraw/zinc/24/53/17/565245317.db2.gz KVUBGHVHKUURGK-VXNVDRBHSA-N 0 0 377.622 3.308 20 5 GGBDRN Cc1cc(Cl)c(C(=O)NC2CCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000295123082 565246418 /nfs/dbraw/zinc/24/64/18/565246418.db2.gz KATFOCXTIUXEBV-UHFFFAOYSA-N 0 0 380.857 3.412 20 5 GGBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccc2c(c1)OCO2 ZINC000160507237 565248346 /nfs/dbraw/zinc/24/83/46/565248346.db2.gz GMJIKGWFIKZHAU-UHFFFAOYSA-N 0 0 393.193 3.292 20 5 GGBDRN COC1(C)CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CC1 ZINC000295149242 565248371 /nfs/dbraw/zinc/24/83/71/565248371.db2.gz LXROPXHURAVCAH-UHFFFAOYSA-N 0 0 383.253 3.091 20 5 GGBDRN COc1ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])c(I)c1 ZINC000295160479 565249542 /nfs/dbraw/zinc/24/95/42/565249542.db2.gz OQONWVWOWOFQPZ-UHFFFAOYSA-N 0 0 392.193 3.074 20 5 GGBDRN CC(C)[C@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000271351158 565249922 /nfs/dbraw/zinc/24/99/22/565249922.db2.gz DXWPKJPAVKYVHH-GXFFZTMASA-N 0 0 389.221 3.430 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271382358 565250338 /nfs/dbraw/zinc/25/03/38/565250338.db2.gz KGFBDGZJSUKENP-WPRPVWTQSA-N 0 0 376.481 3.045 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](Oc3ccccc3Cl)C2)cc1 ZINC000160561392 565250343 /nfs/dbraw/zinc/25/03/43/565250343.db2.gz PABFRVCJYCOLCD-CYBMUJFWSA-N 0 0 382.825 3.090 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCO[C@H](c3ccccc3)C2)s1 ZINC000160549601 565250562 /nfs/dbraw/zinc/25/05/62/565250562.db2.gz FNAAZGHOAMNNIG-OCCSQVGLSA-N 0 0 382.463 3.392 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCO[C@@H](c3ccccc3)C2)s1 ZINC000160549956 565250586 /nfs/dbraw/zinc/25/05/86/565250586.db2.gz FNAAZGHOAMNNIG-GXTWGEPZSA-N 0 0 382.463 3.392 20 5 GGBDRN C[C@H]1C[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000271379914 565250597 /nfs/dbraw/zinc/25/05/97/565250597.db2.gz QTOXCWBTIAHJOX-DTWKUNHWSA-N 0 0 375.194 3.041 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCO[C@@H](c3ccccc3)C2)s1 ZINC000160549841 565250770 /nfs/dbraw/zinc/25/07/70/565250770.db2.gz FNAAZGHOAMNNIG-TZMCWYRMSA-N 0 0 382.463 3.392 20 5 GGBDRN C[C@H]1C[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000271379916 565250794 /nfs/dbraw/zinc/25/07/94/565250794.db2.gz QTOXCWBTIAHJOX-IUCAKERBSA-N 0 0 375.194 3.041 20 5 GGBDRN CC1(C)C[C@H](Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000160596375 565251573 /nfs/dbraw/zinc/25/15/73/565251573.db2.gz XBYHTBVAJUXCGM-SECBINFHSA-N 0 0 382.360 3.258 20 5 GGBDRN COC(=O)c1c(C)c(NC(=O)CCC(C)(C)[N+](=O)[O-])ccc1Br ZINC000295214403 565251740 /nfs/dbraw/zinc/25/17/40/565251740.db2.gz UZXPXGQBUXLXDM-UHFFFAOYSA-N 0 0 387.230 3.318 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000160581027 565252008 /nfs/dbraw/zinc/25/20/08/565252008.db2.gz JKTKUWQZNQLBQZ-GFCCVEGCSA-N 0 0 382.825 3.090 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000186288522 565252047 /nfs/dbraw/zinc/25/20/47/565252047.db2.gz NDAQZZQRROVGQR-CQSZACIVSA-N 0 0 397.204 3.057 20 5 GGBDRN COC[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000271389599 565252055 /nfs/dbraw/zinc/25/20/55/565252055.db2.gz UOJZLZFFAOFQMS-NSHDSACASA-N 0 0 392.405 3.138 20 5 GGBDRN CC(C)(C)c1nc(CCNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cs1 ZINC000271445396 565253509 /nfs/dbraw/zinc/25/35/09/565253509.db2.gz WEOGBBFSXXTTMF-UHFFFAOYSA-N 0 0 389.524 3.468 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCCN(c3ccccc3)C2)s1 ZINC000271463595 565254323 /nfs/dbraw/zinc/25/43/23/565254323.db2.gz ZAPAFPAQLFKCFS-GFCCVEGCSA-N 0 0 381.479 3.141 20 5 GGBDRN CC1(C)C[C@@H](O)CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)C1 ZINC000295256368 565255123 /nfs/dbraw/zinc/25/51/23/565255123.db2.gz GLHHTDQEWOSCER-VIFPVBQESA-N 0 0 397.280 3.073 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC(c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000186337841 565255528 /nfs/dbraw/zinc/25/55/28/565255528.db2.gz DCYZKERWBZICRY-UHFFFAOYSA-N 0 0 382.463 3.233 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCC(c3ccsc3)CC2)c([N+](=O)[O-])c1 ZINC000186334352 565255681 /nfs/dbraw/zinc/25/56/81/565255681.db2.gz XOOFNTLLPCSLSQ-UHFFFAOYSA-N 0 0 382.463 3.233 20 5 GGBDRN Cn1cc(-c2ncc(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)s2)cn1 ZINC000186331691 565255901 /nfs/dbraw/zinc/25/59/01/565255901.db2.gz KIHCYEIHZMCPCA-UHFFFAOYSA-N 0 0 377.813 3.035 20 5 GGBDRN CO[C@@H]1CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CC1(C)C ZINC000295281621 565257554 /nfs/dbraw/zinc/25/75/54/565257554.db2.gz BJSHGIRCEXKCAI-LLVKDONJSA-N 0 0 397.280 3.337 20 5 GGBDRN Cc1csc([C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(F)(F)F)n1 ZINC000295349812 565261059 /nfs/dbraw/zinc/26/10/59/565261059.db2.gz KGUYGYROZRNYAE-GFCCVEGCSA-N 0 0 375.328 3.158 20 5 GGBDRN CC[C@@H](CSC)N(C)C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000271623837 565261208 /nfs/dbraw/zinc/26/12/08/565261208.db2.gz PUGMPHHLAAKUID-VIFPVBQESA-N 0 0 378.397 3.418 20 5 GGBDRN Cn1ccnc1[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000372950464 565262067 /nfs/dbraw/zinc/26/20/67/565262067.db2.gz UWASDIMGPROUCA-NSHDSACASA-N 0 0 393.241 3.111 20 5 GGBDRN CC(C)c1nnc(CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)s1 ZINC000295366587 565262085 /nfs/dbraw/zinc/26/20/85/565262085.db2.gz OZXNEEICLWYFTO-UHFFFAOYSA-N 0 0 377.451 3.109 20 5 GGBDRN CNS(=O)(=O)c1ccc([C@@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000271652770 565262410 /nfs/dbraw/zinc/26/24/10/565262410.db2.gz IOJJVDPNQLDDKS-LLVKDONJSA-N 0 0 383.857 3.007 20 5 GGBDRN Cn1ccnc1[C@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000373004981 565264130 /nfs/dbraw/zinc/26/41/30/565264130.db2.gz XIXGAXOJHVJTCM-ZDUSSCGKSA-N 0 0 379.258 3.470 20 5 GGBDRN Cc1ccc(Br)cc1NC(=O)CCNc1ncc([N+](=O)[O-])c(C)n1 ZINC000295410269 565264884 /nfs/dbraw/zinc/26/48/84/565264884.db2.gz DEIQAPATZXOWNN-UHFFFAOYSA-N 0 0 394.229 3.205 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000186531213 565266244 /nfs/dbraw/zinc/26/62/44/565266244.db2.gz GTJKGJYYZOEVAJ-SMDDNHRTSA-N 0 0 381.841 3.415 20 5 GGBDRN COc1nc(C)c(Br)cc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000186532543 565266606 /nfs/dbraw/zinc/26/66/06/565266606.db2.gz FKXZJBUSBXOCGQ-UHFFFAOYSA-N 0 0 392.209 3.272 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000186564555 565268257 /nfs/dbraw/zinc/26/82/57/565268257.db2.gz KXURIKZEGBQZIN-SECBINFHSA-N 0 0 383.202 3.014 20 5 GGBDRN COC(=O)[C@](C)(NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Cl)c(Cl)c1 ZINC000186574188 565269805 /nfs/dbraw/zinc/26/98/05/565269805.db2.gz BGLCMLHDIXNVFX-OAHLLOKOSA-N 0 0 387.175 3.313 20 5 GGBDRN CC[C@H]1[C@@H](C)CCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000186611661 565272046 /nfs/dbraw/zinc/27/20/46/565272046.db2.gz WOOLOYHLLXNPML-ONGXEEELSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1noc(C)c1CSCC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272086310 565277586 /nfs/dbraw/zinc/27/75/86/565277586.db2.gz CCGWTNULEDAPCN-UHFFFAOYSA-N 0 0 383.857 3.445 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000186715934 565279087 /nfs/dbraw/zinc/27/90/87/565279087.db2.gz ZTDOTTISTSFPTA-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN CSc1cccc(C(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000186717047 565280720 /nfs/dbraw/zinc/28/07/20/565280720.db2.gz WNNKJEMTETZFNT-JTQLQIEISA-N 0 0 377.388 3.025 20 5 GGBDRN Cc1cnc([C@@H](C)CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])s1 ZINC000186729781 565281278 /nfs/dbraw/zinc/28/12/78/565281278.db2.gz IZSMTJTVJHAEJN-QMMMGPOBSA-N 0 0 375.859 3.095 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@H]1[C@H]1CCCC1=O ZINC000272216172 565281403 /nfs/dbraw/zinc/28/14/03/565281403.db2.gz SLDGVZHNSRAJGE-PWSUYJOCSA-N 0 0 399.216 3.470 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CCO1 ZINC000272258671 565282634 /nfs/dbraw/zinc/28/26/34/565282634.db2.gz UUOGLZSVKUQPMZ-AAEUAGOBSA-N 0 0 376.500 3.456 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](CCO)c1ccc(Cl)cc1 ZINC000295719807 565283738 /nfs/dbraw/zinc/28/37/38/565283738.db2.gz UCHOBLRHCSBKHN-AWEZNQCLSA-N 0 0 384.841 3.187 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)[C@@H](O)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000272310959 565283976 /nfs/dbraw/zinc/28/39/76/565283976.db2.gz YGJLALJZMZKXBB-JKYUHCHBSA-N 0 0 387.223 3.039 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)[C@H](O)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000272310961 565284007 /nfs/dbraw/zinc/28/40/07/565284007.db2.gz YGJLALJZMZKXBB-UOWDBTKRSA-N 0 0 387.223 3.039 20 5 GGBDRN O=C(c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)N1C[C@@H](F)[C@@H](F)C1 ZINC000295785332 565287049 /nfs/dbraw/zinc/28/70/49/565287049.db2.gz TVUWKQWDGURFQG-PHIMTYICSA-N 0 0 391.161 3.219 20 5 GGBDRN COCc1ccc([C@H]2CCCN2c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])o1 ZINC000161556516 565287736 /nfs/dbraw/zinc/28/77/36/565287736.db2.gz SLLLAQKNHIYHCX-LLVKDONJSA-N 0 0 386.451 3.141 20 5 GGBDRN CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000272459718 565288212 /nfs/dbraw/zinc/28/82/12/565288212.db2.gz KPWPNAFNCHUQGD-TVQRCGJNSA-N 0 0 389.221 3.120 20 5 GGBDRN Cn1ccnc1[C@H]1N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1(C)C ZINC000295818956 565288522 /nfs/dbraw/zinc/28/85/22/565288522.db2.gz HNAXULCHDISQEG-CYBMUJFWSA-N 0 0 393.241 3.314 20 5 GGBDRN Cc1noc(C)c1N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000161676244 565289744 /nfs/dbraw/zinc/28/97/44/565289744.db2.gz NPZPPMZEQKQUPP-UHFFFAOYSA-N 0 0 379.316 3.044 20 5 GGBDRN Cn1ccnc1[C@@H]1N(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000295941618 565294607 /nfs/dbraw/zinc/29/46/07/565294607.db2.gz QECCZSLGIJVECN-ZDUSSCGKSA-N 0 0 393.241 3.314 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N2CCC[C@H]2[C@@H]2CCCO2)c1Cl ZINC000295939525 565295314 /nfs/dbraw/zinc/29/53/14/565295314.db2.gz ITZNIRUPRZTZGL-JQWIXIFHSA-N 0 0 395.264 3.234 20 5 GGBDRN CN(Cc1csc2ccccc12)c1cc([N+](=O)[O-])ccc1S(N)(=O)=O ZINC000161887086 565296234 /nfs/dbraw/zinc/29/62/34/565296234.db2.gz MIOBKIPTINLIHT-UHFFFAOYSA-N 0 0 377.447 3.093 20 5 GGBDRN CC[C@@H]1CN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CCCO1 ZINC000295988591 565297303 /nfs/dbraw/zinc/29/73/03/565297303.db2.gz LIXRHUAJVBFRNE-SECBINFHSA-N 0 0 383.253 3.091 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000161912560 565297496 /nfs/dbraw/zinc/29/74/96/565297496.db2.gz NEIVTKHTGILZRY-UHFFFAOYSA-N 0 0 399.241 3.163 20 5 GGBDRN COCc1nc(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cs1 ZINC000295992498 565297585 /nfs/dbraw/zinc/29/75/85/565297585.db2.gz JXCSVVNHMGQZKC-UHFFFAOYSA-N 0 0 375.328 3.147 20 5 GGBDRN C[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H]1CCCN(C2CCC2)C1 ZINC000272792389 565297898 /nfs/dbraw/zinc/29/78/98/565297898.db2.gz CLBQTURPBBRUMW-NEPJUHHUSA-N 0 0 387.527 3.125 20 5 GGBDRN Cn1ccnc1[C@H]1N(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1(C)C ZINC000296015198 565298362 /nfs/dbraw/zinc/29/83/62/565298362.db2.gz WQJSIBPGIAVQSP-CYBMUJFWSA-N 0 0 393.241 3.314 20 5 GGBDRN CC[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000272822500 565298632 /nfs/dbraw/zinc/29/86/32/565298632.db2.gz JCGCZVHJMGOCIJ-OAHLLOKOSA-N 0 0 383.857 3.137 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccsc1 ZINC000186969090 565298737 /nfs/dbraw/zinc/29/87/37/565298737.db2.gz YLMXCUHFPNHOJO-GFCCVEGCSA-N 0 0 399.222 3.063 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccsc1 ZINC000186969107 565299368 /nfs/dbraw/zinc/29/93/68/565299368.db2.gz YLMXCUHFPNHOJO-LBPRGKRZSA-N 0 0 399.222 3.063 20 5 GGBDRN CN(C)C(=O)CC1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000272842941 565299879 /nfs/dbraw/zinc/29/98/79/565299879.db2.gz ITLURUHVTASOFG-UHFFFAOYSA-N 0 0 384.274 3.048 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC(CCCO)CC2)cc1[N+](=O)[O-] ZINC000272881574 565301057 /nfs/dbraw/zinc/30/10/57/565301057.db2.gz YCGQTEAASCXLCU-UHFFFAOYSA-N 0 0 385.258 3.290 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000186995406 565301209 /nfs/dbraw/zinc/30/12/09/565301209.db2.gz CPEXBQXESKEJJV-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN CO[C@@]1(C)CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000373759583 565301823 /nfs/dbraw/zinc/30/18/23/565301823.db2.gz SRMIKBORAWTKQN-INIZCTEOSA-N 0 0 385.258 3.317 20 5 GGBDRN Cc1nc(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)ccc1[C@@H](C)O ZINC000272940373 565302326 /nfs/dbraw/zinc/30/23/26/565302326.db2.gz HEEKPAKZDMUKIK-SNVBAGLBSA-N 0 0 394.225 3.044 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCSC[C@H]1c1nccs1 ZINC000187023015 565302499 /nfs/dbraw/zinc/30/24/99/565302499.db2.gz UZCSRLCHLSODMD-AWEZNQCLSA-N 0 0 378.479 3.088 20 5 GGBDRN O=C(NCC[C@@H]1CCCCO1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000272940321 565302514 /nfs/dbraw/zinc/30/25/14/565302514.db2.gz HDYSFZQFMITQCD-JTQLQIEISA-N 0 0 375.194 3.185 20 5 GGBDRN O=C(NCc1ccc(Br)cc1Cl)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187027366 565303676 /nfs/dbraw/zinc/30/36/76/565303676.db2.gz HIQZNKWBJOZBCC-UHFFFAOYSA-N 0 0 386.589 3.041 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCS[C@H]2COCC[C@@H]21 ZINC000272998698 565304786 /nfs/dbraw/zinc/30/47/86/565304786.db2.gz MFOJZSINWZBIFA-FZMZJTMJSA-N 0 0 388.898 3.073 20 5 GGBDRN CO[C@@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2Cl)CC1(C)C ZINC000296157757 565305742 /nfs/dbraw/zinc/30/57/42/565305742.db2.gz SRQDYQPUIFCVGR-CYBMUJFWSA-N 0 0 397.280 3.337 20 5 GGBDRN O=C(CN1CCSC[C@@H]1c1nccs1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000187063261 565306498 /nfs/dbraw/zinc/30/64/98/565306498.db2.gz RFYWIZIROUKLEO-CYBMUJFWSA-N 0 0 398.897 3.433 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N[C@H]2CCOC3(CCC3)C2)c1Cl ZINC000296221941 565308138 /nfs/dbraw/zinc/30/81/38/565308138.db2.gz KFWFYRQPRCSWTP-VIFPVBQESA-N 0 0 395.264 3.282 20 5 GGBDRN Cc1cc(Br)c(NC(=O)C(=O)N(C)[C@@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000273122936 565308290 /nfs/dbraw/zinc/30/82/90/565308290.db2.gz ZWKQIQPYBLBDHN-JTQLQIEISA-N 0 0 386.246 3.107 20 5 GGBDRN C[C@@H]1C[C@H](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000273112964 565308332 /nfs/dbraw/zinc/30/83/32/565308332.db2.gz CPKFLMKDXCQCBJ-NXEZZACHSA-N 0 0 389.221 3.431 20 5 GGBDRN O=C(N[C@@H]1COc2ccccc2C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000162232029 565309602 /nfs/dbraw/zinc/30/96/02/565309602.db2.gz SMTZVYZUBRZYIJ-ZDUSSCGKSA-N 0 0 377.194 3.091 20 5 GGBDRN O=C(CSc1nnc(NC[C@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC000273154675 565310604 /nfs/dbraw/zinc/31/06/04/565310604.db2.gz IUXLVMGAGHJKRU-GFCCVEGCSA-N 0 0 380.451 3.012 20 5 GGBDRN CS(=O)(=O)C1(c2noc(CSc3ccc([N+](=O)[O-])cc3)n2)CCCC1 ZINC000296292128 565311237 /nfs/dbraw/zinc/31/12/37/565311237.db2.gz DCIQKMDETUUGIM-UHFFFAOYSA-N 0 0 383.451 3.084 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)CC1CC(F)(F)C1 ZINC000296358046 565314857 /nfs/dbraw/zinc/31/48/57/565314857.db2.gz QTISEWLMXNEFGS-UHFFFAOYSA-N 0 0 386.170 3.111 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Nc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000187170571 565315213 /nfs/dbraw/zinc/31/52/13/565315213.db2.gz URZJVBBALUNGNC-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000162378053 565315360 /nfs/dbraw/zinc/31/53/60/565315360.db2.gz GOGSXMLWXGSDEQ-JKSUJKDBSA-N 0 0 380.853 3.266 20 5 GGBDRN Cc1c(CC(=O)NCCOc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000162442294 565317750 /nfs/dbraw/zinc/31/77/50/565317750.db2.gz QGKUKBSIHWSMNY-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCOC[C@@H]1c1ccccc1 ZINC000374121361 565322036 /nfs/dbraw/zinc/32/20/36/565322036.db2.gz NEWPUAWIYCACCJ-OAHLLOKOSA-N 0 0 382.825 3.010 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1[C@H](O)C(F)(F)F ZINC000162702896 565325448 /nfs/dbraw/zinc/32/54/48/565325448.db2.gz GLUOUZDNJREXRL-YPMHNXCESA-N 0 0 378.372 3.235 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)c1ccc(C)c(Br)c1 ZINC000187351270 565325508 /nfs/dbraw/zinc/32/55/08/565325508.db2.gz DLVMWIDHNYSEMW-UHFFFAOYSA-N 0 0 381.230 3.224 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2F)c(C(F)(F)F)c1 ZINC000162701926 565325947 /nfs/dbraw/zinc/32/59/47/565325947.db2.gz JBEJUAHAQVQSOF-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1c1ncc([N+](=O)[O-])cn1 ZINC000273573298 565326039 /nfs/dbraw/zinc/32/60/39/565326039.db2.gz AOPMSFSXLQWGJI-YGRLFVJLSA-N 0 0 379.214 3.114 20 5 GGBDRN C[C@@H]1[C@H](c2ccc(Br)cc2)OCCN1c1ncc([N+](=O)[O-])cn1 ZINC000273573294 565326070 /nfs/dbraw/zinc/32/60/70/565326070.db2.gz AOPMSFSXLQWGJI-QMTHXVAHSA-N 0 0 379.214 3.114 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ncc(C)cc2Br)cc([N+](=O)[O-])c1 ZINC000162853606 565330563 /nfs/dbraw/zinc/33/05/63/565330563.db2.gz DZCFDJUWKNCCAC-UHFFFAOYSA-N 0 0 394.181 3.100 20 5 GGBDRN CCOc1ccc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)cc1Br ZINC000187427513 565331319 /nfs/dbraw/zinc/33/13/19/565331319.db2.gz DANDWJJBGIBXBX-UHFFFAOYSA-N 0 0 397.229 3.290 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Nc2cc(F)ccc2Cl)cc1[N+](=O)[O-] ZINC000187421580 565331380 /nfs/dbraw/zinc/33/13/80/565331380.db2.gz AFHQMLPEKQQZQM-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN CC(C)N(C(=O)c1cc(I)cc([N+](=O)[O-])c1)C(C)C ZINC000162924187 565331456 /nfs/dbraw/zinc/33/14/56/565331456.db2.gz NIKIVLONNWKTCR-UHFFFAOYSA-N 0 0 376.194 3.458 20 5 GGBDRN C[C@@H]1COCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)C1 ZINC000374340750 565332919 /nfs/dbraw/zinc/33/29/19/565332919.db2.gz LNRWYTTXUHHDTA-QMMMGPOBSA-N 0 0 377.622 3.119 20 5 GGBDRN O=C(NC[C@H]1CCCCC1(F)F)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000296748215 565333213 /nfs/dbraw/zinc/33/32/13/565333213.db2.gz GWNMPBOZDFCYQR-SECBINFHSA-N 0 0 375.759 3.128 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H](C2CCOCC2)C1 ZINC000374364788 565333710 /nfs/dbraw/zinc/33/37/10/565333710.db2.gz HPJFNOWOXBKUGE-GFCCVEGCSA-N 0 0 383.242 3.246 20 5 GGBDRN COC[C@@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccc(Cl)cc1 ZINC000296769523 565335748 /nfs/dbraw/zinc/33/57/48/565335748.db2.gz MOARONJBOYNRHL-OAHLLOKOSA-N 0 0 384.841 3.451 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(CC[C@H]3CCOC3)n2)c(Br)c1 ZINC000273797955 565336758 /nfs/dbraw/zinc/33/67/58/565336758.db2.gz IQRCHTHCKRIIMD-JTQLQIEISA-N 0 0 382.214 3.300 20 5 GGBDRN CSc1ccc(C(=O)Nc2nc(-c3nccn3C)cs2)cc1[N+](=O)[O-] ZINC000163138458 565337956 /nfs/dbraw/zinc/33/79/56/565337956.db2.gz AEPKXQBMRXYWKY-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCO2)CC1 ZINC000187518699 565338433 /nfs/dbraw/zinc/33/84/33/565338433.db2.gz BQHUJPLSYSCPPP-HNNXBMFYSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCO2)CC1 ZINC000187518718 565338436 /nfs/dbraw/zinc/33/84/36/565338436.db2.gz BQHUJPLSYSCPPP-OAHLLOKOSA-N 0 0 383.242 3.389 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](c1ccc(Br)cc1)C1CCC1 ZINC000163182748 565338792 /nfs/dbraw/zinc/33/87/92/565338792.db2.gz DNMIZCKOLDKCPY-AWEZNQCLSA-N 0 0 393.241 3.362 20 5 GGBDRN CN(C(C1CC1)C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163169320 565338934 /nfs/dbraw/zinc/33/89/34/565338934.db2.gz DFPKTYKJADLGSE-UHFFFAOYSA-N 0 0 378.372 3.423 20 5 GGBDRN C[C@@](O)(Cc1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1)C1CC1 ZINC000273826276 565339237 /nfs/dbraw/zinc/33/92/37/565339237.db2.gz LILBREQOMCPBHA-OAHLLOKOSA-N 0 0 382.214 3.035 20 5 GGBDRN CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000163205888 565339821 /nfs/dbraw/zinc/33/98/21/565339821.db2.gz DKCATJSBADKEMT-CYBMUJFWSA-N 0 0 376.722 3.207 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC([C@H]2CCCO2)CC1 ZINC000187556470 565340708 /nfs/dbraw/zinc/34/07/08/565340708.db2.gz ACCLLYPIEMPKFG-MRXNPFEDSA-N 0 0 397.269 3.317 20 5 GGBDRN CCN(c1cccnc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163268012 565341099 /nfs/dbraw/zinc/34/10/99/565341099.db2.gz NLAIYRBGQUPGPW-UHFFFAOYSA-N 0 0 375.328 3.224 20 5 GGBDRN CCOC(=O)C(C)(C)c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000273869092 565342146 /nfs/dbraw/zinc/34/21/46/565342146.db2.gz PXNWJSPKVRKHCU-UHFFFAOYSA-N 0 0 398.213 3.172 20 5 GGBDRN O=C(NC[C@@H]1CCCCC1(F)F)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000296876015 565342443 /nfs/dbraw/zinc/34/24/43/565342443.db2.gz OOHDQDONGKEHAT-VIFPVBQESA-N 0 0 375.759 3.128 20 5 GGBDRN Cc1cc(Br)cc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000187590006 565342895 /nfs/dbraw/zinc/34/28/95/565342895.db2.gz PMEMTDUTEIZADA-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)c2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000187625707 565346465 /nfs/dbraw/zinc/34/64/65/565346465.db2.gz YVVHWBMSXBREKN-UHFFFAOYSA-N 0 0 392.767 3.360 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000163564849 565348755 /nfs/dbraw/zinc/34/87/55/565348755.db2.gz YSNJHEFWBGWJAK-JKSUJKDBSA-N 0 0 380.853 3.266 20 5 GGBDRN COc1ccc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1Cl ZINC000163667081 565350137 /nfs/dbraw/zinc/35/01/37/565350137.db2.gz NHCMKPGOSSPKSB-UHFFFAOYSA-N 0 0 384.175 3.487 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000187709235 565350209 /nfs/dbraw/zinc/35/02/09/565350209.db2.gz VDVRSGOHLMYXIJ-XPTSAGLGSA-N 0 0 380.750 3.462 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000187690492 565350354 /nfs/dbraw/zinc/35/03/54/565350354.db2.gz FJJAQIVKWDPKJK-OTYXRUKQSA-N 0 0 380.750 3.462 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000187747149 565352680 /nfs/dbraw/zinc/35/26/80/565352680.db2.gz IUHRFYHTJGSFEV-HZMBPMFUSA-N 0 0 380.750 3.462 20 5 GGBDRN CC[C@@H](CSC)NC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000164124405 565356290 /nfs/dbraw/zinc/35/62/90/565356290.db2.gz LRYZUSZFJPECKJ-QMMMGPOBSA-N 0 0 394.234 3.071 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cc1 ZINC000164001434 565354788 /nfs/dbraw/zinc/35/47/88/565354788.db2.gz VUNAIZFIZBNJKT-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN CO[C@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1(C)C ZINC000297078452 565355095 /nfs/dbraw/zinc/35/50/95/565355095.db2.gz QIPMBWOOJIJVKR-LBPRGKRZSA-N 0 0 389.221 3.384 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cccc(C(N)=O)c2)cc1[N+](=O)[O-] ZINC000164193716 565356306 /nfs/dbraw/zinc/35/63/06/565356306.db2.gz XVXNXQIOQJBAMU-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000187804966 565357122 /nfs/dbraw/zinc/35/71/22/565357122.db2.gz XZARZBFYVYSFPO-OTYXRUKQSA-N 0 0 380.750 3.462 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC[C@H](O)CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000297133073 565357956 /nfs/dbraw/zinc/35/79/56/565357956.db2.gz ZNGSPPLMVNDDJW-LBPRGKRZSA-N 0 0 385.258 3.289 20 5 GGBDRN COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000274154232 565358720 /nfs/dbraw/zinc/35/87/20/565358720.db2.gz DIZHAHLDSKEXHJ-VIFPVBQESA-N 0 0 376.312 3.033 20 5 GGBDRN O=C(N[C@H]1CCO[C@H](C2CC2)C1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000274188818 565361052 /nfs/dbraw/zinc/36/10/52/565361052.db2.gz FMTCLGLBLICDOY-GWCFXTLKSA-N 0 0 387.205 3.184 20 5 GGBDRN CC(C)(C)OC(=O)Cc1noc(-c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000274223360 565363006 /nfs/dbraw/zinc/36/30/06/565363006.db2.gz QUPAMMVLCFGOBQ-UHFFFAOYSA-N 0 0 384.186 3.292 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3sccc3Br)CC2)cn1 ZINC000164713940 565362995 /nfs/dbraw/zinc/36/29/95/565362995.db2.gz BQGFQWNNIVAEPC-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC(n2cccn2)CC1 ZINC000375053096 565365743 /nfs/dbraw/zinc/36/57/43/565365743.db2.gz VBPHVSOOMNDORQ-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000375045529 565365937 /nfs/dbraw/zinc/36/59/37/565365937.db2.gz ZNYJYQOHPXWFPA-LLVKDONJSA-N 0 0 393.241 3.409 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(c2ncc([N+](=O)[O-])cc2Br)CC1 ZINC000274329710 565367676 /nfs/dbraw/zinc/36/76/76/565367676.db2.gz VYSRVJUQSLADCW-SNVBAGLBSA-N 0 0 398.286 3.092 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000274377393 565368676 /nfs/dbraw/zinc/36/86/76/565368676.db2.gz XTYJWWIXRVQPIH-NSHDSACASA-N 0 0 380.857 3.224 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)c2ccccc21 ZINC000375113905 565368989 /nfs/dbraw/zinc/36/89/89/565368989.db2.gz OVAWHOMQABSAIV-LBPRGKRZSA-N 0 0 380.809 3.148 20 5 GGBDRN C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)CCO[C@@H]1C1CC1 ZINC000375132983 565370470 /nfs/dbraw/zinc/37/04/70/565370470.db2.gz BOKAWVNFKLMHJQ-GDBMZVCRSA-N 0 0 383.242 3.292 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(N2CCSC3(CCOCC3)C2)cc1Cl ZINC000274487661 565372010 /nfs/dbraw/zinc/37/20/10/565372010.db2.gz PJIXVCLCQNLERT-UHFFFAOYSA-N 0 0 386.857 3.137 20 5 GGBDRN C[C@H]1OCCN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H]1C ZINC000166118041 565373283 /nfs/dbraw/zinc/37/32/83/565373283.db2.gz GNACUMHDFLXWCT-NXEZZACHSA-N 0 0 378.372 3.342 20 5 GGBDRN C[C@@H]1OCCN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000166117920 565373755 /nfs/dbraw/zinc/37/37/55/565373755.db2.gz GNACUMHDFLXWCT-UWVGGRQHSA-N 0 0 378.372 3.342 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000166237570 565374110 /nfs/dbraw/zinc/37/41/10/565374110.db2.gz GUZAMGZLFSOSCL-ZJUUUORDSA-N 0 0 377.260 3.024 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC2(CCOCC2)C1 ZINC000274607286 565375132 /nfs/dbraw/zinc/37/51/32/565375132.db2.gz VTKRSQSEFUDUBT-CYBMUJFWSA-N 0 0 382.507 3.200 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@@H]1CCCO1 ZINC000375264823 565378204 /nfs/dbraw/zinc/37/82/04/565378204.db2.gz CSBSLLNKHJODOK-CABCVRRESA-N 0 0 383.242 3.070 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000167556632 565378612 /nfs/dbraw/zinc/37/86/12/565378612.db2.gz YSSKXDUCSRUXLN-GXFFZTMASA-N 0 0 382.825 3.091 20 5 GGBDRN CCN(CC(=O)Nc1c(Cl)cccc1Cl)c1ncc([N+](=O)[O-])c(C)n1 ZINC000297616171 565378759 /nfs/dbraw/zinc/37/87/59/565378759.db2.gz VZUCLYZRFBXJNN-UHFFFAOYSA-N 0 0 384.223 3.465 20 5 GGBDRN CC(C)(C)OC(=O)[C@H]1CCCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000167701873 565379160 /nfs/dbraw/zinc/37/91/60/565379160.db2.gz XORHCLJQDZOLJH-JTQLQIEISA-N 0 0 386.246 3.310 20 5 GGBDRN C[C@H](NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000167566436 565379434 /nfs/dbraw/zinc/37/94/34/565379434.db2.gz JXJBHQYWGVWFSQ-JQWIXIFHSA-N 0 0 382.825 3.091 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1OCc1noc(C2CC2)n1 ZINC000274775893 565381014 /nfs/dbraw/zinc/38/10/14/565381014.db2.gz XPNBFQCXYOUKCE-UHFFFAOYSA-N 0 0 387.133 3.039 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000297905412 565391347 /nfs/dbraw/zinc/39/13/47/565391347.db2.gz XACCLJDXICUQGG-GDBMZVCRSA-N 0 0 381.226 3.141 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000297905415 565391502 /nfs/dbraw/zinc/39/15/02/565391502.db2.gz XACCLJDXICUQGG-GOEBONIOSA-N 0 0 381.226 3.141 20 5 GGBDRN CCc1nc([C@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2Cl)cs1 ZINC000298022242 565396097 /nfs/dbraw/zinc/39/60/97/565396097.db2.gz DIXQHAYZWHUYLD-QMMMGPOBSA-N 0 0 382.829 3.083 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@H](C(N)=O)c1ccc(Br)cc1 ZINC000170908997 565398032 /nfs/dbraw/zinc/39/80/32/565398032.db2.gz JFLTVNKMGOOMJX-HNNXBMFYSA-N 0 0 378.226 3.016 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@@H](C(N)=O)c1ccc(Br)cc1 ZINC000170909000 565398432 /nfs/dbraw/zinc/39/84/32/565398432.db2.gz JFLTVNKMGOOMJX-OAHLLOKOSA-N 0 0 378.226 3.016 20 5 GGBDRN O=C(NOCCC(F)(F)F)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000275245238 565398929 /nfs/dbraw/zinc/39/89/29/565398929.db2.gz UDQCTIRPMCVJAH-UHFFFAOYSA-N 0 0 375.072 3.110 20 5 GGBDRN CC[C@@]1(CO)CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000275250424 565399431 /nfs/dbraw/zinc/39/94/31/565399431.db2.gz VNLBVMKSFVGCLD-OAHLLOKOSA-N 0 0 389.221 3.121 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCC([C@H](O)c3ncc[nH]3)CC2)c(Br)c1 ZINC000375658391 565400024 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CO[C@H](C)c1noc(COc2cc(F)c(Br)cc2[N+](=O)[O-])n1 ZINC000188658227 565415014 /nfs/dbraw/zinc/41/50/14/565415014.db2.gz CMMBXSOZFSOELA-ZCFIWIBFSA-N 0 0 376.138 3.166 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1ccccc1Br ZINC000171168065 565415814 /nfs/dbraw/zinc/41/58/14/565415814.db2.gz CRSCFZKCFMTWKC-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000171202452 565416684 /nfs/dbraw/zinc/41/66/84/565416684.db2.gz MJZNCOCMYGLNCI-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN COc1c(Br)cccc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376034580 565418666 /nfs/dbraw/zinc/41/86/66/565418666.db2.gz LFBSWORNEOTKGS-UHFFFAOYSA-N 0 0 395.257 3.400 20 5 GGBDRN CCN([C@@H](C)Cc1ccsc1)S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-] ZINC000188758891 565421567 /nfs/dbraw/zinc/42/15/67/565421567.db2.gz JKBJKUXTBSCJCR-LBPRGKRZSA-N 0 0 384.479 3.307 20 5 GGBDRN Cc1cccc2c1N(S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])CC2 ZINC000171263582 565422487 /nfs/dbraw/zinc/42/24/87/565422487.db2.gz 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Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1cccc(Br)c1)C(C)C ZINC000299387475 565449854 /nfs/dbraw/zinc/44/98/54/565449854.db2.gz ZSRSVGFLFUCHMN-UHFFFAOYSA-N 0 0 395.257 3.299 20 5 GGBDRN CCOC(=O)[C@@H](CC)N(C(=O)c1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000189213953 565451438 /nfs/dbraw/zinc/45/14/38/565451438.db2.gz LORSBBPKPZTCPA-CQSZACIVSA-N 0 0 399.241 3.304 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H]2CCc3c2cccc3Br)c1[N+](=O)[O-] ZINC000171808569 565451704 /nfs/dbraw/zinc/45/17/04/565451704.db2.gz NBWRWGODVCJPRI-GFCCVEGCSA-N 0 0 379.214 3.060 20 5 GGBDRN CSCC1CCC(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000299487411 565451868 /nfs/dbraw/zinc/45/18/68/565451868.db2.gz ZWEQFEWWIRPIAB-UHFFFAOYSA-N 0 0 385.873 3.225 20 5 GGBDRN CCc1n[nH]c(C(=O)NCCCOc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000171805989 565451955 /nfs/dbraw/zinc/45/19/55/565451955.db2.gz FKNAHMRNEXAFLM-UHFFFAOYSA-N 0 0 387.223 3.386 20 5 GGBDRN C[C@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000171841291 565454318 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397.229 3.142 20 5 GGBDRN CCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H](C)CS(=O)(=O)CC ZINC000171954339 565458821 /nfs/dbraw/zinc/45/88/21/565458821.db2.gz DJUOLEUUFDLRHV-LLVKDONJSA-N 0 0 384.479 3.095 20 5 GGBDRN CCOC(=O)[C@H](C)N(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)C1CC1 ZINC000189319253 565459274 /nfs/dbraw/zinc/45/92/74/565459274.db2.gz QBVWNTWQTLXHID-JTQLQIEISA-N 0 0 399.241 3.222 20 5 GGBDRN Cn1cc([C@@H]2CSCCN2Cc2ccc(Br)c([N+](=O)[O-])c2)cn1 ZINC000276766996 565460505 /nfs/dbraw/zinc/46/05/05/565460505.db2.gz HOTRDLBVPSXFOI-HNNXBMFYSA-N 0 0 397.298 3.381 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000171967193 565460515 /nfs/dbraw/zinc/46/05/15/565460515.db2.gz UMUHAWFHJCVGKD-GFCCVEGCSA-N 0 0 386.788 3.189 20 5 GGBDRN O=C(C1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1)N1CCCC1 ZINC000301059860 565461193 /nfs/dbraw/zinc/46/11/93/565461193.db2.gz BIHQOSIBZLRMAI-UHFFFAOYSA-N 0 0 382.258 3.196 20 5 GGBDRN C[C@H](Oc1ccccc1Br)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000171992707 565461988 /nfs/dbraw/zinc/46/19/88/565461988.db2.gz ADCHYIDWOURAHS-NSHDSACASA-N 0 0 379.210 3.441 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCN(c2cccc(O)c2)CC1 ZINC000301074920 565462782 /nfs/dbraw/zinc/46/27/82/565462782.db2.gz OJESUCUNKBFDQQ-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN CNC(=O)c1ccc(CN(C)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000301080739 565462864 /nfs/dbraw/zinc/46/28/64/565462864.db2.gz IDUCTCMMNFXEHE-UHFFFAOYSA-N 0 0 378.226 3.353 20 5 GGBDRN NS(=O)(=O)c1cc(N[C@H]2CCSc3c(F)cccc32)cc([N+](=O)[O-])c1 ZINC000301062497 565463059 /nfs/dbraw/zinc/46/30/59/565463059.db2.gz ACTQSLREWYEBBK-AWEZNQCLSA-N 0 0 383.426 3.030 20 5 GGBDRN CNC(=O)c1ccc(NCc2ccc(Br)c(F)c2)c([N+](=O)[O-])c1 ZINC000301061649 565463102 /nfs/dbraw/zinc/46/31/02/565463102.db2.gz BSIKGHJJMXCBBL-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN COc1cccc(N2CCN(c3ncc(Br)cc3[N+](=O)[O-])CC2)c1 ZINC000301088076 565463549 /nfs/dbraw/zinc/46/35/49/565463549.db2.gz KOUDELFWLYQGAR-UHFFFAOYSA-N 0 0 393.241 3.088 20 5 GGBDRN 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399.837 3.475 20 5 GGBDRN CNC(=O)c1ccc(NC[C@H](O)c2ccc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000301247851 565474275 /nfs/dbraw/zinc/47/42/75/565474275.db2.gz LSPCCADTGYXTMG-HNNXBMFYSA-N 0 0 384.219 3.407 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCCOc1cccnc1 ZINC000301243643 565474341 /nfs/dbraw/zinc/47/43/41/565474341.db2.gz AKECFVZOTNGHEK-UHFFFAOYSA-N 0 0 385.161 3.085 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC(c2ccccc2Br)CC1 ZINC000189580726 565475358 /nfs/dbraw/zinc/47/53/58/565475358.db2.gz CRGBJOYGHSXIJO-UHFFFAOYSA-N 0 0 379.214 3.100 20 5 GGBDRN CC[C@H](C)c1nnc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2Br)[nH]1 ZINC000277114335 565476376 /nfs/dbraw/zinc/47/63/76/565476376.db2.gz DUABQHCSVFWMGU-IUCAKERBSA-N 0 0 396.245 3.480 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000172295144 565476587 /nfs/dbraw/zinc/47/65/87/565476587.db2.gz IGBWGYMAKUMTNR-UHFFFAOYSA-N 0 0 381.230 3.005 20 5 GGBDRN COc1ccc(C)cc1-n1nnnc1Sc1ncc([N+](=O)[O-])cc1Cl ZINC000301277880 565476825 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ZINC000173487145 565561054 /nfs/dbraw/zinc/56/10/54/565561054.db2.gz RFVWBPJYKNGJCK-HNNXBMFYSA-N 0 0 381.479 3.406 20 5 GGBDRN C[C@H]1CSCCN(c2ccc([N+](=O)[O-])c(N3CCSC[C@H](C)C3)n2)C1 ZINC000302864773 565561710 /nfs/dbraw/zinc/56/17/10/565561710.db2.gz XPZQUPFYJDJUCM-ZIAGYGMSSA-N 0 0 382.555 3.368 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000173535451 565564749 /nfs/dbraw/zinc/56/47/49/565564749.db2.gz ICJZZWUNYRWKKR-UHFFFAOYSA-N 0 0 395.384 3.199 20 5 GGBDRN C[C@H](CCc1ccc(Br)cc1)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000302991161 565566309 /nfs/dbraw/zinc/56/63/09/565566309.db2.gz LHWMITYWPKSWQA-SNVBAGLBSA-N 0 0 394.225 3.209 20 5 GGBDRN CC(C)N(Cc1csc(CS(C)(=O)=O)n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000173564996 565566897 /nfs/dbraw/zinc/56/68/97/565566897.db2.gz DPVHCJMWLYUSCA-UHFFFAOYSA-N 0 0 383.495 3.007 20 5 GGBDRN C[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000278594581 565568411 /nfs/dbraw/zinc/56/84/11/565568411.db2.gz BQHQEQUIXXQPTL-MRVPVSSYSA-N 0 0 375.328 3.326 20 5 GGBDRN COC[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000278670323 565571952 /nfs/dbraw/zinc/57/19/52/565571952.db2.gz FZGVSNMQJDIEAH-HNNXBMFYSA-N 0 0 384.841 3.451 20 5 GGBDRN Cc1oc(Br)cc1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000396661887 565573224 /nfs/dbraw/zinc/57/32/24/565573224.db2.gz ARDGUVHIOQDFBW-UHFFFAOYSA-N 0 0 394.225 3.221 20 5 GGBDRN C[C@H]1Cc2cc(S(=O)(=O)NCc3ccccc3[N+](=O)[O-])cc(Cl)c2O1 ZINC000303748226 565573656 /nfs/dbraw/zinc/57/36/56/565573656.db2.gz GVSPWMLEXHSDIV-JTQLQIEISA-N 0 0 382.825 3.050 20 5 GGBDRN C[C@@H]1Cc2cc(S(=O)(=O)NCc3ccccc3[N+](=O)[O-])cc(Cl)c2O1 ZINC000303748228 565574216 /nfs/dbraw/zinc/57/42/16/565574216.db2.gz GVSPWMLEXHSDIV-SNVBAGLBSA-N 0 0 382.825 3.050 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C(C)(C)O1 ZINC000278735238 565575503 /nfs/dbraw/zinc/57/55/03/565575503.db2.gz SGOKQLYRTNBQHN-MRVPVSSYSA-N 0 0 377.260 3.495 20 5 GGBDRN C[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1 ZINC000173701815 565576673 /nfs/dbraw/zinc/57/66/73/565576673.db2.gz JGKUBMBRCAFEBZ-LBPRGKRZSA-N 0 0 384.841 3.135 20 5 GGBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCN(Cc3ccccc3)C2)c(Br)c1 ZINC000309865777 565577527 /nfs/dbraw/zinc/57/75/27/565577527.db2.gz FJMLBBGSUULIOX-CYBMUJFWSA-N 0 0 377.242 3.439 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N[C@H]1CCN(Cc2ccccc2)C1 ZINC000309743544 565577749 /nfs/dbraw/zinc/57/77/49/565577749.db2.gz STDRWKYEJQYJLR-ZDUSSCGKSA-N 0 0 377.242 3.439 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)c1[N+](=O)[O-] ZINC000278843007 565580709 /nfs/dbraw/zinc/58/07/09/565580709.db2.gz DIZVDWCEYOMVJV-ZCFIWIBFSA-N 0 0 377.348 3.408 20 5 GGBDRN O=C(c1cscc1Br)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000404864599 565583966 /nfs/dbraw/zinc/58/39/66/565583966.db2.gz ZXWKTYOTWJWLNR-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN CC(=O)c1ccc(Cl)c(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000191176586 565586031 /nfs/dbraw/zinc/58/60/31/565586031.db2.gz GDAYORYVSIDNPN-UHFFFAOYSA-N 0 0 382.825 3.435 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000173805573 565588778 /nfs/dbraw/zinc/58/87/78/565588778.db2.gz OTDWNZORXIPCJB-CQSZACIVSA-N 0 0 388.804 3.053 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000173808106 565588865 /nfs/dbraw/zinc/58/88/65/565588865.db2.gz ZUQCEQGOWUKBDY-AWEZNQCLSA-N 0 0 388.804 3.053 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CCC(C)(C)C1 ZINC000407978693 565589436 /nfs/dbraw/zinc/58/94/36/565589436.db2.gz DLWSMNNPUOMEKS-UHFFFAOYSA-N 0 0 388.205 3.380 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)C[C@@H]1C ZINC000407979262 565589609 /nfs/dbraw/zinc/58/96/09/565589609.db2.gz UZDYZXBKXCHTDC-BDAKNGLRSA-N 0 0 388.205 3.378 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)Nc1cc2c(cc1Cl)CCC2=O ZINC000191229324 565590264 /nfs/dbraw/zinc/59/02/64/565590264.db2.gz CPUQJSLYBXVGCK-UHFFFAOYSA-N 0 0 380.809 3.486 20 5 GGBDRN CN(Cc1cccc(Br)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000315323339 565590332 /nfs/dbraw/zinc/59/03/32/565590332.db2.gz LTVCXQGFFVEXNN-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000279037394 565591146 /nfs/dbraw/zinc/59/11/46/565591146.db2.gz CJBHUJQODDQGLQ-ZDUSSCGKSA-N 0 0 395.213 3.195 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC000408050990 565592359 /nfs/dbraw/zinc/59/23/59/565592359.db2.gz HJQIDHQQPHSJSX-ZJUUUORDSA-N 0 0 377.260 3.024 20 5 GGBDRN Cc1c(Br)c(=O)n(CC(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000317551670 565593985 /nfs/dbraw/zinc/59/39/85/565593985.db2.gz YELOWBAUKZPFJC-UHFFFAOYSA-N 0 0 385.601 3.364 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)cs1 ZINC000191302928 565594853 /nfs/dbraw/zinc/59/48/53/565594853.db2.gz SBLUWBUTSHUSCS-UHFFFAOYSA-N 0 0 393.416 3.239 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000173880098 565595460 /nfs/dbraw/zinc/59/54/60/565595460.db2.gz BUDFDAOVDLJZOK-JOCHJYFZSA-N 0 0 383.223 3.347 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cc(F)c(Br)cc2F)c1 ZINC000317877491 565595793 /nfs/dbraw/zinc/59/57/93/565595793.db2.gz YLUFLFMHCBVMKJ-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCCc2ccc(Br)s2)n1 ZINC000318641821 565596318 /nfs/dbraw/zinc/59/63/18/565596318.db2.gz AJHLPQZHWBIUHX-UHFFFAOYSA-N 0 0 386.227 3.255 20 5 GGBDRN Cn1ccnc1[C@@](O)(CCNc1cc(Cl)ccc1[N+](=O)[O-])C(F)(F)F ZINC000279155947 565598076 /nfs/dbraw/zinc/59/80/76/565598076.db2.gz BGIYRPNDJVPFIC-ZDUSSCGKSA-N 0 0 378.738 3.234 20 5 GGBDRN C[C@@H](CO)CS[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000173930292 565599180 /nfs/dbraw/zinc/59/91/80/565599180.db2.gz ORDNAAXIKMDMMV-QWRGUYRKSA-N 0 0 381.479 3.407 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC(C)(C)[C@@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000408206561 565599307 /nfs/dbraw/zinc/59/93/07/565599307.db2.gz OUCZPZUVUZXOTF-CABCVRRESA-N 0 0 388.873 3.135 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(NCCc3cccs3)s2)c1 ZINC000173923531 565599445 /nfs/dbraw/zinc/59/94/45/565599445.db2.gz RXJJRBKZAOFYHM-UHFFFAOYSA-N 0 0 382.496 3.151 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1N1CCC(Nc2cccc(Br)c2)CC1 ZINC000279167789 565599479 /nfs/dbraw/zinc/59/94/79/565599479.db2.gz UOJWNTBSODJDEC-UHFFFAOYSA-N 0 0 380.246 3.172 20 5 GGBDRN O=C(NCCCn1cc(Br)cn1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000319589268 565599425 /nfs/dbraw/zinc/59/94/25/565599425.db2.gz WHGHGLNSMGTEML-UHFFFAOYSA-N 0 0 387.621 3.027 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2n[nH]c(-c3ccccc3Br)n2)c1 ZINC000173923159 565599682 /nfs/dbraw/zinc/59/96/82/565599682.db2.gz IYXBLXWUNKUVCB-UHFFFAOYSA-N 0 0 395.242 3.131 20 5 GGBDRN COc1ccc(C(=O)OCc2ncc(C)c([N+](=O)[O-])c2C)nc1Br ZINC000191377344 565600381 /nfs/dbraw/zinc/60/03/81/565600381.db2.gz LFRFRRSWFINMJY-UHFFFAOYSA-N 0 0 396.197 3.130 20 5 GGBDRN Cc1ccc(NS(C)(=O)=O)c(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000173970005 565603130 /nfs/dbraw/zinc/60/31/30/565603130.db2.gz SZNLFRPZACHZGZ-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)Cc1cccc(Br)c1 ZINC000320563919 565603393 /nfs/dbraw/zinc/60/33/93/565603393.db2.gz SANZSALYHCXEKX-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000279254089 565604121 /nfs/dbraw/zinc/60/41/21/565604121.db2.gz HNZMFIXMBQTJQU-ZDUSSCGKSA-N 0 0 395.213 3.195 20 5 GGBDRN O=[N+]([O-])c1cnc(NCCc2ccc3c(c2)OCCO3)c(Br)c1 ZINC000321291455 565605581 /nfs/dbraw/zinc/60/55/81/565605581.db2.gz HKYBAJRLMLIHAV-UHFFFAOYSA-N 0 0 380.198 3.178 20 5 GGBDRN CCOC(=O)CCN(C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000321537094 565605625 /nfs/dbraw/zinc/60/56/25/565605625.db2.gz ZOSLNIOEDRSEJG-UHFFFAOYSA-N 0 0 382.214 3.295 20 5 GGBDRN C[C@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC[S@@]1=O ZINC000408372943 565606065 /nfs/dbraw/zinc/60/60/65/565606065.db2.gz CJLPSTUKSWCVCA-VCGICTTQSA-N 0 0 398.282 3.253 20 5 GGBDRN CN(C(=O)Cc1ccc(I)cc1)c1cccc([N+](=O)[O-])c1 ZINC000191462602 565606494 /nfs/dbraw/zinc/60/64/94/565606494.db2.gz JDYSYPIDCKWKHG-UHFFFAOYSA-N 0 0 396.184 3.405 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCSC2(CCCCC2)C1 ZINC000408388282 565607451 /nfs/dbraw/zinc/60/74/51/565607451.db2.gz BJXKAYAAKCWWLF-UHFFFAOYSA-N 0 0 386.495 3.044 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1cc(Br)cc2c1OCC2 ZINC000322238265 565608985 /nfs/dbraw/zinc/60/89/85/565608985.db2.gz ZVUVIDARXZBJGI-UHFFFAOYSA-N 0 0 381.230 3.429 20 5 GGBDRN Cc1ccc(C(=O)Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)c(C)c1 ZINC000322293421 565609125 /nfs/dbraw/zinc/60/91/25/565609125.db2.gz RRYSNGIDBZLUDY-UHFFFAOYSA-N 0 0 379.210 3.327 20 5 GGBDRN C[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H]1C ZINC000408445578 565609372 /nfs/dbraw/zinc/60/93/72/565609372.db2.gz ADWZTDZPVUERBU-UWVGGRQHSA-N 0 0 377.260 3.166 20 5 GGBDRN COC(=O)c1ccc(CNCc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000322783310 565609992 /nfs/dbraw/zinc/60/99/92/565609992.db2.gz JLEJGYFGHOYNIC-UHFFFAOYSA-N 0 0 379.210 3.434 20 5 GGBDRN O=C(NCc1cc(Br)cc2c1OCC2)c1ccc([N+](=O)[O-])cc1 ZINC000322700449 565610386 /nfs/dbraw/zinc/61/03/86/565610386.db2.gz QJAPMULJYODGPG-UHFFFAOYSA-N 0 0 377.194 3.222 20 5 GGBDRN Cc1c(Br)c(NC[C@@H]2CCN(CC(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000322571258 565610770 /nfs/dbraw/zinc/61/07/70/565610770.db2.gz SMTNVUMVWLFNLB-VIFPVBQESA-N 0 0 397.195 3.357 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N(C)Cc2cccc(Br)c2)n1 ZINC000322564320 565610914 /nfs/dbraw/zinc/61/09/14/565610914.db2.gz FVFNPRWKDOJYFW-UHFFFAOYSA-N 0 0 380.198 3.175 20 5 GGBDRN Cc1cc(N2C[C@@H](C)OC3(CCOCC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000408450821 565611120 /nfs/dbraw/zinc/61/11/20/565611120.db2.gz IYKSMDQSCIKTRM-GFCCVEGCSA-N 0 0 385.258 3.440 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000279401336 565611407 /nfs/dbraw/zinc/61/14/07/565611407.db2.gz WEHGXOJONZRQBB-ZDUSSCGKSA-N 0 0 395.213 3.195 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(Nc2ccc(Br)c(OC)c2)n1 ZINC000322899322 565611652 /nfs/dbraw/zinc/61/16/52/565611652.db2.gz CHNQHKPSOUSPEN-UHFFFAOYSA-N 0 0 382.170 3.291 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCc2cc(Br)ccc2C1 ZINC000191548276 565612228 /nfs/dbraw/zinc/61/22/28/565612228.db2.gz YLURADDSSKYVCB-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN O=C(Nc1cncc(Br)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191566235 565613443 /nfs/dbraw/zinc/61/34/43/565613443.db2.gz RFEXRNBQKQCWCZ-UHFFFAOYSA-N 0 0 393.197 3.047 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1ccc(I)cc1 ZINC000174106718 565613428 /nfs/dbraw/zinc/61/34/28/565613428.db2.gz YQFXCZZFWLQIQT-UHFFFAOYSA-N 0 0 396.140 3.156 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCc2cc(Br)ccc2C1 ZINC000191564808 565613596 /nfs/dbraw/zinc/61/35/96/565613596.db2.gz HODZXUXEZSRHKW-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCc3cc(Br)ccc3C2)c1[N+](=O)[O-] ZINC000191583106 565615491 /nfs/dbraw/zinc/61/54/91/565615491.db2.gz OOHYOINDWLNUDU-UHFFFAOYSA-N 0 0 393.241 3.231 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2cc(Br)ccc2C1 ZINC000191585173 565615944 /nfs/dbraw/zinc/61/59/44/565615944.db2.gz IVAHTWXTRDWYGS-UHFFFAOYSA-N 0 0 376.210 3.138 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCc1ccc(Br)cc1 ZINC000324077625 565616750 /nfs/dbraw/zinc/61/67/50/565616750.db2.gz FCFKICKFMYKJRJ-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCCc1ccc(Br)cc1 ZINC000324541641 565617388 /nfs/dbraw/zinc/61/73/88/565617388.db2.gz OCIWMDMXBDJKFE-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCCCn1cc(Br)cn1 ZINC000279585422 565620868 /nfs/dbraw/zinc/62/08/68/565620868.db2.gz ZYCYQPJDYYDDQZ-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN Cc1ccc(CCS(=O)(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000409509698 565621483 /nfs/dbraw/zinc/62/14/83/565621483.db2.gz XPTXSFJEKKBXPP-UHFFFAOYSA-N 0 0 382.869 3.261 20 5 GGBDRN COC(=O)[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@H]1C ZINC000325495020 565621598 /nfs/dbraw/zinc/62/15/98/565621598.db2.gz NZCYCIXVNMCGHG-BXKDBHETSA-N 0 0 394.225 3.151 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)s1 ZINC000279617442 565623764 /nfs/dbraw/zinc/62/37/64/565623764.db2.gz YLYIXZKIYMQNDY-UHFFFAOYSA-N 0 0 383.451 3.080 20 5 GGBDRN COc1cc(F)cc(CNC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000409558398 565624811 /nfs/dbraw/zinc/62/48/11/565624811.db2.gz UUDZCABQWUHNCF-UHFFFAOYSA-N 0 0 389.202 3.497 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc2nccnc2c1Br ZINC000326640918 565625202 /nfs/dbraw/zinc/62/52/02/565625202.db2.gz UGEDUGWZALHGCM-UHFFFAOYSA-N 0 0 387.193 3.482 20 5 GGBDRN C[S@@](=O)C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000174302523 565628213 /nfs/dbraw/zinc/62/82/13/565628213.db2.gz OMWRYZJLCPEIFF-IVCQMTBJSA-N 0 0 380.853 3.027 20 5 GGBDRN C[S@](=O)C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000174302538 565628284 /nfs/dbraw/zinc/62/82/84/565628284.db2.gz OMWRYZJLCPEIFF-LMKMVOKYSA-N 0 0 380.853 3.027 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1CCN(CC(F)(F)F)C1 ZINC000279697935 565628317 /nfs/dbraw/zinc/62/83/17/565628317.db2.gz IZRIKVPYYKPWFT-JTQLQIEISA-N 0 0 379.766 3.091 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccc(I)c(Cl)c2)nc1 ZINC000409635714 565629106 /nfs/dbraw/zinc/62/91/06/565629106.db2.gz OAZBTIQWXSRQNZ-UHFFFAOYSA-N 0 0 389.580 3.282 20 5 GGBDRN CC(=O)NCCN(Cc1ccc(Cl)cc1Cl)c1ccc([N+](=O)[O-])cn1 ZINC000409646646 565630289 /nfs/dbraw/zinc/63/02/89/565630289.db2.gz WDQYFHMSMAAPHY-UHFFFAOYSA-N 0 0 383.235 3.439 20 5 GGBDRN Cc1cc(N2CCC[C@H](S(C)(=O)=O)CC2)c(Br)cc1[N+](=O)[O-] ZINC000409673942 565632751 /nfs/dbraw/zinc/63/27/51/565632751.db2.gz XVEPMUAFJPZYPT-NSHDSACASA-N 0 0 391.287 3.069 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000279765574 565632947 /nfs/dbraw/zinc/63/29/47/565632947.db2.gz UWKDRWYNZMDAAM-ZDUSSCGKSA-N 0 0 395.213 3.195 20 5 GGBDRN CN(CCOc1ccccc1Cl)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000328070762 565634507 /nfs/dbraw/zinc/63/45/07/565634507.db2.gz VVFQJNLQSVUBGA-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CCO[C@]2(CCSC2)C1 ZINC000279826707 565635372 /nfs/dbraw/zinc/63/53/72/565635372.db2.gz CLGYJVDGILEXMQ-MEDUHNTESA-N 0 0 388.848 3.101 20 5 GGBDRN O=[N+]([O-])c1cnc(NCCCOc2ncc(C(F)(F)F)cc2Cl)s1 ZINC000409713562 565636731 /nfs/dbraw/zinc/63/67/31/565636731.db2.gz DDQVSVRRRXICAT-UHFFFAOYSA-N 0 0 382.751 3.421 20 5 GGBDRN C[C@H](O)C[C@@H]1CCCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000279862815 565637360 /nfs/dbraw/zinc/63/73/60/565637360.db2.gz SKTLUKKUYKUFLM-ONGXEEELSA-N 0 0 389.221 3.262 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@H](C2CC2)O1 ZINC000279864481 565637369 /nfs/dbraw/zinc/63/73/69/565637369.db2.gz GNFKROOPIWYSPW-ISVAXAHUSA-N 0 0 387.205 3.136 20 5 GGBDRN C[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000279885925 565638332 /nfs/dbraw/zinc/63/83/32/565638332.db2.gz FLYIQSLFJSUGEP-LLVKDONJSA-N 0 0 394.225 3.399 20 5 GGBDRN O=C(N[C@H]1CCCC12CCOCC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000409794785 565640008 /nfs/dbraw/zinc/64/00/08/565640008.db2.gz NMFAVJZTZSDRTL-AWEZNQCLSA-N 0 0 383.242 3.436 20 5 GGBDRN O=C(N[C@@H]1CCCC12CCOCC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000409794788 565640104 /nfs/dbraw/zinc/64/01/04/565640104.db2.gz NMFAVJZTZSDRTL-CQSZACIVSA-N 0 0 383.242 3.436 20 5 GGBDRN C[C@H](CCc1cccn1C)NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000174591540 565645790 /nfs/dbraw/zinc/64/57/90/565645790.db2.gz PMNLSGQASVKJPQ-LLVKDONJSA-N 0 0 380.242 3.447 20 5 GGBDRN Cc1c[nH+]ccc1[N-]S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000174608845 565646581 /nfs/dbraw/zinc/64/65/81/565646581.db2.gz NIQPDCRUJNVDFT-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN COc1cc(NC(=O)CNc2ccccc2[N+](=O)[O-])ccc1Br ZINC000174605847 565646672 /nfs/dbraw/zinc/64/66/72/565646672.db2.gz XPXUERAMNIWYIL-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C1(c2cncc(Br)c2)CC1 ZINC000409883942 565646618 /nfs/dbraw/zinc/64/66/18/565646618.db2.gz CTGAQIKOJLEKTM-UHFFFAOYSA-N 0 0 390.237 3.143 20 5 GGBDRN Cc1csc([C@@H](NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)C2CC2)n1 ZINC000191990604 565647156 /nfs/dbraw/zinc/64/71/56/565647156.db2.gz SHEZZDMTEFUATE-HNNXBMFYSA-N 0 0 381.479 3.406 20 5 GGBDRN COc1cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)ccc1Br ZINC000174605978 565647578 /nfs/dbraw/zinc/64/75/78/565647578.db2.gz PKMPHCMQBKTVDZ-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN O=C(Cc1ccc(I)cc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000192032709 565650768 /nfs/dbraw/zinc/65/07/68/565650768.db2.gz UXSKZIGSIMRJQP-UHFFFAOYSA-N 0 0 396.184 3.058 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000280110929 565652559 /nfs/dbraw/zinc/65/25/59/565652559.db2.gz KLARHPVVHLEIER-VAXYEAPXSA-N 0 0 390.864 3.126 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@@H](O)C(F)(F)F ZINC000410061095 565662102 /nfs/dbraw/zinc/66/21/02/565662102.db2.gz CJNAUAODVZMLMA-CYBMUJFWSA-N 0 0 380.388 3.386 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1SCc1nnnn1CC(F)(F)F ZINC000192136695 565662430 /nfs/dbraw/zinc/66/24/30/565662430.db2.gz HALRFGRLTSJKRS-UHFFFAOYSA-N 0 0 398.164 3.198 20 5 GGBDRN COc1cc(C(=O)NCCc2nc(C(F)(F)F)cs2)ccc1[N+](=O)[O-] ZINC000174831630 565662609 /nfs/dbraw/zinc/66/26/09/565662609.db2.gz YOQSBVAWCVMWFO-UHFFFAOYSA-N 0 0 375.328 3.051 20 5 GGBDRN C[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000280288147 565663385 /nfs/dbraw/zinc/66/33/85/565663385.db2.gz DZLMDWVAMMUHLR-MNOVXSKESA-N 0 0 393.241 3.430 20 5 GGBDRN Cc1ccc2[nH]c(CNC(=O)c3ccc([N+](=O)[O-])cc3Br)nc2c1 ZINC000174896210 565666375 /nfs/dbraw/zinc/66/63/75/565666375.db2.gz BKOQJVYWKLXTDX-UHFFFAOYSA-N 0 0 389.209 3.472 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H](CO)c1cccc(Cl)c1F ZINC000410173272 565669482 /nfs/dbraw/zinc/66/94/82/565669482.db2.gz OYJZGIPFNYYWJW-AWEZNQCLSA-N 0 0 384.816 3.329 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H]2CCCC[C@H]2OC(F)F)c1C ZINC000410172724 565669545 /nfs/dbraw/zinc/66/95/45/565669545.db2.gz FBQZBWMKMRETFT-CHWSQXEVSA-N 0 0 378.397 3.040 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCCC[C@H]2OC(F)F)cc1C ZINC000410178892 565669634 /nfs/dbraw/zinc/66/96/34/565669634.db2.gz LZCKYXGFGWCLLJ-DGCLKSJQSA-N 0 0 378.397 3.040 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC2(CCOCC2)O1 ZINC000280469955 565673831 /nfs/dbraw/zinc/67/38/31/565673831.db2.gz MYHGUIVVDRBSSC-GFCCVEGCSA-N 0 0 385.258 3.127 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(c3ccncc3)CC2)c(Cl)c1 ZINC000192260612 565675482 /nfs/dbraw/zinc/67/54/82/565675482.db2.gz IQKBMOAOJGYCGQ-UHFFFAOYSA-N 0 0 381.841 3.212 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1c(F)ccc(Br)c1F ZINC000410295762 565675446 /nfs/dbraw/zinc/67/54/46/565675446.db2.gz CFIRGVWLNHHWHY-UHFFFAOYSA-N 0 0 396.147 3.394 20 5 GGBDRN O=C(Nc1nc2c(s1)COCC2)c1cccc([N+](=O)[O-])c1Br ZINC000192264978 565675573 /nfs/dbraw/zinc/67/55/73/565675573.db2.gz DCKQCJURGPMFNI-UHFFFAOYSA-N 0 0 384.211 3.139 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCCC[C@H]1c1ncon1 ZINC000192336439 565680425 /nfs/dbraw/zinc/68/04/25/565680425.db2.gz UEFLDTHAJRLDCQ-NSHDSACASA-N 0 0 381.186 3.108 20 5 GGBDRN Cc1csc([C@H](NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C2CC2)n1 ZINC000175132937 565681016 /nfs/dbraw/zinc/68/10/16/565681016.db2.gz IGWWKEAAUWGGHC-CQSZACIVSA-N 0 0 381.479 3.406 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1 ZINC000410396347 565682121 /nfs/dbraw/zinc/68/21/21/565682121.db2.gz GQKIQTBOMNFZRL-UHFFFAOYSA-N 0 0 378.694 3.175 20 5 GGBDRN CN1CCOc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc21 ZINC000192367301 565683061 /nfs/dbraw/zinc/68/30/61/565683061.db2.gz NCTBJHPZOKHSJD-UHFFFAOYSA-N 0 0 392.209 3.438 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCO[C@H](c2ccco2)C1 ZINC000192363827 565683485 /nfs/dbraw/zinc/68/34/85/565683485.db2.gz WOHBFRNUKKININ-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)c2cccc([N+](=O)[O-])c2Br)ccn1 ZINC000192373323 565683498 /nfs/dbraw/zinc/68/34/98/565683498.db2.gz USJATIURQXZETQ-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCO[C@@H](c2ccco2)C1 ZINC000192363831 565683733 /nfs/dbraw/zinc/68/37/33/565683733.db2.gz WOHBFRNUKKININ-CYBMUJFWSA-N 0 0 381.182 3.164 20 5 GGBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)c(I)c1 ZINC000192400036 565684670 /nfs/dbraw/zinc/68/46/70/565684670.db2.gz QLVVXKLVQICNSY-UHFFFAOYSA-N 0 0 388.117 3.053 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cc(Cl)c(F)c(Cl)c1 ZINC000192420328 565687597 /nfs/dbraw/zinc/68/75/97/565687597.db2.gz ZDYJLMMUULKDKZ-UHFFFAOYSA-N 0 0 386.166 3.409 20 5 GGBDRN Cc1c(NC(=O)N2CCO[C@@H]3CCC[C@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000280694275 565689435 /nfs/dbraw/zinc/68/94/35/565689435.db2.gz HCBKVQREKLDSOU-TZMCWYRMSA-N 0 0 384.230 3.451 20 5 GGBDRN O=C(Nc1ccnn1Cc1cccc(Br)c1)c1ccc([N+](=O)[O-])o1 ZINC000192471084 565694196 /nfs/dbraw/zinc/69/41/96/565694196.db2.gz OFEPRBAEDYWIGZ-UHFFFAOYSA-N 0 0 391.181 3.447 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@@H](c2ccc(Br)cc2)C1 ZINC000192529466 565698373 /nfs/dbraw/zinc/69/83/73/565698373.db2.gz ICZQXKYRPYUULH-CQSZACIVSA-N 0 0 395.257 3.460 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@H](c2cccc(Br)c2)C1 ZINC000192548897 565699625 /nfs/dbraw/zinc/69/96/25/565699625.db2.gz NQADQVDBZHUVGI-AWEZNQCLSA-N 0 0 395.257 3.460 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1nc2c(s1)CCCC2 ZINC000175475733 565701794 /nfs/dbraw/zinc/70/17/94/565701794.db2.gz DFSONLPOGVJTLN-UHFFFAOYSA-N 0 0 381.479 3.059 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)Cc2nc3c(s2)CCCC3)ccc1[N+](=O)[O-] ZINC000175475014 565701855 /nfs/dbraw/zinc/70/18/55/565701855.db2.gz KSIFDRODKVYHPN-UHFFFAOYSA-N 0 0 381.479 3.059 20 5 GGBDRN CCc1cnc(CN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])s1 ZINC000175468744 565701861 /nfs/dbraw/zinc/70/18/61/565701861.db2.gz KDTQNSKXAYRRAE-UHFFFAOYSA-N 0 0 375.859 3.088 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Br)c(C2CC2)n1 ZINC000410959941 565702128 /nfs/dbraw/zinc/70/21/28/565702128.db2.gz AQGWQSMOLVFDET-UHFFFAOYSA-N 0 0 392.209 3.069 20 5 GGBDRN Cn1ccnc1[C@H]1OCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1Br ZINC000280898245 565702299 /nfs/dbraw/zinc/70/22/99/565702299.db2.gz BHVXPNUTKUTMPE-KBPBESRZSA-N 0 0 381.230 3.423 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc(Br)cc1 ZINC000192639782 565702961 /nfs/dbraw/zinc/70/29/61/565702961.db2.gz DCFXAQVZEDUHIA-OAHLLOKOSA-N 0 0 395.253 3.229 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1nc(C)cs1)C(F)(F)F ZINC000411009293 565703997 /nfs/dbraw/zinc/70/39/97/565703997.db2.gz XBZPEWKBJJCIQD-NSHDSACASA-N 0 0 375.328 3.402 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1c(C)ccc(F)c1Br ZINC000411018557 565704561 /nfs/dbraw/zinc/70/45/61/565704561.db2.gz RVTBNWBPPQAVEQ-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N(c1ccc(Br)cc1)C1CC1 ZINC000411054007 565708615 /nfs/dbraw/zinc/70/86/15/565708615.db2.gz ZDJWULMEAPNBCZ-UHFFFAOYSA-N 0 0 379.214 3.140 20 5 GGBDRN NC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000175570322 565709682 /nfs/dbraw/zinc/70/96/82/565709682.db2.gz PADZMJBSGPROJM-UHFFFAOYSA-N 0 0 398.600 3.362 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)C[C@H]1C(N)=O ZINC000330503538 565709950 /nfs/dbraw/zinc/70/99/50/565709950.db2.gz FFDOSCSHRVEWAL-OQPBUACISA-N 0 0 384.230 3.442 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2CCC(F)(F)CC2)c(C(F)(F)F)c1 ZINC000330529722 565710948 /nfs/dbraw/zinc/71/09/48/565710948.db2.gz LXDWEOVUANURBH-UHFFFAOYSA-N 0 0 388.314 3.470 20 5 GGBDRN Cc1c(Br)ccc2c1N(C(=O)CCn1cc([N+](=O)[O-])cn1)CCC2 ZINC000411096408 565711181 /nfs/dbraw/zinc/71/11/81/565711181.db2.gz TWJZGRIBHJMOMC-UHFFFAOYSA-N 0 0 393.241 3.232 20 5 GGBDRN O=C(NCCOc1cccc(F)c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175605176 565711606 /nfs/dbraw/zinc/71/16/06/565711606.db2.gz HWKQVLPNXJXEFK-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN CN(CC(=O)Nc1ccccc1)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175601490 565711700 /nfs/dbraw/zinc/71/17/00/565711700.db2.gz LQIYKXRYISKKQX-UHFFFAOYSA-N 0 0 392.209 3.068 20 5 GGBDRN Cc1ncsc1CCS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175630729 565712579 /nfs/dbraw/zinc/71/25/79/565712579.db2.gz IAPUTJCSJZAXJJ-UHFFFAOYSA-N 0 0 391.268 3.139 20 5 GGBDRN Cc1nc(NC(=O)c2cccc(I)c2)ccc1[N+](=O)[O-] ZINC000175667546 565714907 /nfs/dbraw/zinc/71/49/07/565714907.db2.gz KTYRUVDJNYSCKR-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN Cc1nc(NC(=O)c2ccccc2I)ccc1[N+](=O)[O-] ZINC000175679460 565716301 /nfs/dbraw/zinc/71/63/01/565716301.db2.gz DNFVAJSBACVSSZ-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN O=[N+]([O-])c1cc(F)c(S(=O)(=O)N2CCC[C@H]2c2ccncc2)cc1Cl ZINC000281216289 565718042 /nfs/dbraw/zinc/71/80/42/565718042.db2.gz QSNLVMBWFCELBD-ZDUSSCGKSA-N 0 0 385.804 3.308 20 5 GGBDRN COCCN(CC(F)(F)F)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175700265 565718129 /nfs/dbraw/zinc/71/81/29/565718129.db2.gz DGRVQEALRXEDDZ-UHFFFAOYSA-N 0 0 385.136 3.008 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2nnc(C(F)(F)F)s2)c1 ZINC000281296108 565721971 /nfs/dbraw/zinc/72/19/71/565721971.db2.gz RCDXHVVFQGGTBL-UHFFFAOYSA-N 0 0 376.316 3.181 20 5 GGBDRN Cc1cc(I)cnc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000175760068 565722182 /nfs/dbraw/zinc/72/21/82/565722182.db2.gz RILZHSUYXWYXSG-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)c2cccc(Cl)c2[N+](=O)[O-])nc1C ZINC000175816997 565724547 /nfs/dbraw/zinc/72/45/47/565724547.db2.gz UGICKPHHYMWXLQ-UHFFFAOYSA-N 0 0 383.813 3.466 20 5 GGBDRN CC(=O)N[C@@H]1CC[C@@H](C(F)(F)F)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000330848485 565724943 /nfs/dbraw/zinc/72/49/43/565724943.db2.gz MDNNHVISAZGCIA-OCCSQVGLSA-N 0 0 379.766 3.280 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc3ncccc3c2)c(Cl)c1 ZINC000193031436 565726845 /nfs/dbraw/zinc/72/68/45/565726845.db2.gz KFPIRQRMWZOEBF-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN O=C(NCC1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000281413827 565730208 /nfs/dbraw/zinc/73/02/08/565730208.db2.gz YKXJVEMSVFSKQA-UHFFFAOYSA-N 0 0 379.766 3.139 20 5 GGBDRN CC[C@H]1C[C@H](C)CN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000330946459 565730973 /nfs/dbraw/zinc/73/09/73/565730973.db2.gz LBCQEVCPTOLVDY-ONGXEEELSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1cnc(C(C)(C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000175888486 565731231 /nfs/dbraw/zinc/73/12/31/565731231.db2.gz ARXPNDORBHUBAL-UHFFFAOYSA-N 0 0 375.859 3.227 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000331001870 565734685 /nfs/dbraw/zinc/73/46/85/565734685.db2.gz QUCQOKIKSXPORA-CQSZACIVSA-N 0 0 376.862 3.040 20 5 GGBDRN O=C(CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-])Nc1ccccc1 ZINC000175945061 565735414 /nfs/dbraw/zinc/73/54/14/565735414.db2.gz DQPJUSFXKBLKGS-UHFFFAOYSA-N 0 0 392.209 3.116 20 5 GGBDRN C[S@](=O)Cc1cccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000175976420 565738137 /nfs/dbraw/zinc/73/81/37/565738137.db2.gz JQOKSHQAJSIGMA-QHCPKHFHSA-N 0 0 397.250 3.488 20 5 GGBDRN O=C(Nc1cnn(CC(F)F)c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175981742 565739362 /nfs/dbraw/zinc/73/93/62/565739362.db2.gz NSZSMAVIEPEMID-UHFFFAOYSA-N 0 0 375.129 3.071 20 5 GGBDRN CCC(CC)NC(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193245466 565739873 /nfs/dbraw/zinc/73/98/73/565739873.db2.gz SRFZPMJGRVUXRU-UHFFFAOYSA-N 0 0 376.194 3.426 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NCc1ccco1 ZINC000193235485 565740057 /nfs/dbraw/zinc/74/00/57/565740057.db2.gz UKNJFIWJFQVYSY-UHFFFAOYSA-N 0 0 386.145 3.031 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccs3)nn2C)c1 ZINC000193241241 565740380 /nfs/dbraw/zinc/74/03/80/565740380.db2.gz CIBOZNMWLXDZRR-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN CO[C@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@H](C)C1 ZINC000281646931 565740840 /nfs/dbraw/zinc/74/08/40/565740840.db2.gz BCPRFMASRRFLRS-SCZZXKLOSA-N 0 0 375.194 3.136 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1ccc(Br)cc1[N+](=O)[O-])CCO2 ZINC000176019934 565741272 /nfs/dbraw/zinc/74/12/72/565741272.db2.gz JYKITKHLIXEMBQ-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCCCCCO)cc2[N+](=O)[O-])n1 ZINC000193263370 565741482 /nfs/dbraw/zinc/74/14/82/565741482.db2.gz LOFZZDTWZIVCSY-UHFFFAOYSA-N 0 0 381.479 3.403 20 5 GGBDRN Cc1cccnc1NC(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193281157 565742072 /nfs/dbraw/zinc/74/20/72/565742072.db2.gz MQVOHPQZJUKSJE-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN CCCCN(C)C(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193305594 565743538 /nfs/dbraw/zinc/74/35/38/565743538.db2.gz IPMKDQPRRVRXOR-UHFFFAOYSA-N 0 0 376.194 3.380 20 5 GGBDRN CC[C@H](C)N(C)C(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193337943 565745601 /nfs/dbraw/zinc/74/56/01/565745601.db2.gz IOAKNHIMUOVOKJ-QMMMGPOBSA-N 0 0 376.194 3.378 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cc(C)c(Br)cn2)cc([N+](=O)[O-])c1 ZINC000176074240 565745820 /nfs/dbraw/zinc/74/58/20/565745820.db2.gz DOAYEBOZZBUZMX-UHFFFAOYSA-N 0 0 394.181 3.100 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ncccc2Br)c([N+](=O)[O-])c1 ZINC000193325044 565746128 /nfs/dbraw/zinc/74/61/28/565746128.db2.gz VRRIJQITFVAFEO-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1c(F)cccc1Br ZINC000176084467 565747580 /nfs/dbraw/zinc/74/75/80/565747580.db2.gz LTFNXSNZYUPZKW-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCSC2(CCC2)CC1 ZINC000411734306 565748602 /nfs/dbraw/zinc/74/86/02/565748602.db2.gz AQMRCHZUUSBRSX-UHFFFAOYSA-N 0 0 383.857 3.075 20 5 GGBDRN O=C(CSCC(=O)c1ccc(Cl)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000176132120 565752375 /nfs/dbraw/zinc/75/23/75/565752375.db2.gz AWNFJNXSSRQQIO-UHFFFAOYSA-N 0 0 378.837 3.481 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ncccc1Br ZINC000193471873 565753892 /nfs/dbraw/zinc/75/38/92/565753892.db2.gz QQJFLQZJUIYEHO-UHFFFAOYSA-N 0 0 394.181 3.166 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1Cc2cc(Br)ccc2O1 ZINC000193460986 565753948 /nfs/dbraw/zinc/75/39/48/565753948.db2.gz KZNQQCVPRAYWKM-OAHLLOKOSA-N 0 0 393.193 3.308 20 5 GGBDRN CC[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000331321989 565754053 /nfs/dbraw/zinc/75/40/53/565754053.db2.gz CPVUMVWZJFNMTB-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2Cc3cc(Br)ccc3O2)c([N+](=O)[O-])c1 ZINC000193461021 565754306 /nfs/dbraw/zinc/75/43/06/565754306.db2.gz DOEFNBIJJBJURD-OAHLLOKOSA-N 0 0 393.193 3.308 20 5 GGBDRN CC[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331339045 565755510 /nfs/dbraw/zinc/75/55/10/565755510.db2.gz LZTAZMXLEPIYOR-JTQLQIEISA-N 0 0 377.260 3.311 20 5 GGBDRN COCCN(C(C)=O)c1nc(CSc2ccc([N+](=O)[O-])cc2F)cs1 ZINC000193504317 565755970 /nfs/dbraw/zinc/75/59/70/565755970.db2.gz DOAPGIHAQFMGEF-UHFFFAOYSA-N 0 0 385.442 3.482 20 5 GGBDRN O=C(Nc1nnc(-c2cccc(Cl)c2)s1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193535582 565759713 /nfs/dbraw/zinc/75/97/13/565759713.db2.gz PIGXCSDODOBVEY-UHFFFAOYSA-N 0 0 377.769 3.120 20 5 GGBDRN O=C([C@H]1Cc2cc(Br)ccc2O1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000193563696 565762048 /nfs/dbraw/zinc/76/20/48/565762048.db2.gz QAWDTFLUVIHRFS-MRXNPFEDSA-N 0 0 389.205 3.250 20 5 GGBDRN CCS[C@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000176303005 565763025 /nfs/dbraw/zinc/76/30/25/565763025.db2.gz VPJYTVQQHIPYOP-JQWIXIFHSA-N 0 0 385.873 3.367 20 5 GGBDRN Cc1nc(NC(=O)[C@H]2Cc3cc(Br)ccc3O2)ccc1[N+](=O)[O-] ZINC000193585270 565763415 /nfs/dbraw/zinc/76/34/15/565763415.db2.gz VCAVPHOSGWYAHF-CYBMUJFWSA-N 0 0 378.182 3.003 20 5 GGBDRN Cc1nc(NC(=O)[C@@H]2Cc3cc(Br)ccc3O2)ccc1[N+](=O)[O-] ZINC000193585258 565763497 /nfs/dbraw/zinc/76/34/97/565763497.db2.gz VCAVPHOSGWYAHF-ZDUSSCGKSA-N 0 0 378.182 3.003 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccoc2Br)c([N+](=O)[O-])c1 ZINC000193610853 565765709 /nfs/dbraw/zinc/76/57/09/565765709.db2.gz WGXCCKRRUUVSDG-UHFFFAOYSA-N 0 0 382.214 3.491 20 5 GGBDRN CC1CN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)C1 ZINC000412020485 565766006 /nfs/dbraw/zinc/76/60/06/565766006.db2.gz KTKKPAWHCBMKNR-UHFFFAOYSA-N 0 0 377.447 3.224 20 5 GGBDRN O=C(NC[C@@H]1CCCC(F)(F)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000282122424 565766302 /nfs/dbraw/zinc/76/63/02/565766302.db2.gz LUJODNWROJCKMG-SECBINFHSA-N 0 0 375.759 3.128 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1cnc2ccccc2n1 ZINC000176372914 565767071 /nfs/dbraw/zinc/76/70/71/565767071.db2.gz GJUCJCYKIUQVRJ-UHFFFAOYSA-N 0 0 387.193 3.482 20 5 GGBDRN O=C(N[C@@H]1CCCC12CCOCC2)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000282166023 565768154 /nfs/dbraw/zinc/76/81/54/565768154.db2.gz YENCNZNGXGCTPU-CQSZACIVSA-N 0 0 383.242 3.436 20 5 GGBDRN Cc1cn([C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)nc1[N+](=O)[O-] ZINC000282206046 565768874 /nfs/dbraw/zinc/76/88/74/565768874.db2.gz IRHIBGZBUFSVLB-NSHDSACASA-N 0 0 381.230 3.082 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC=CCC1 ZINC000193670149 565769567 /nfs/dbraw/zinc/76/95/67/565769567.db2.gz ZUMRCMUBZHYGGT-SNVBAGLBSA-N 0 0 386.189 3.346 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)NC1CCN(c2nccs2)CC1 ZINC000282225976 565770727 /nfs/dbraw/zinc/77/07/27/565770727.db2.gz NCOMDQDWXYPBAB-UHFFFAOYSA-N 0 0 381.845 3.495 20 5 GGBDRN CC[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(I)c2C)C1 ZINC000193758557 565773829 /nfs/dbraw/zinc/77/38/29/565773829.db2.gz FUANLXXLIHRCTL-JTQLQIEISA-N 0 0 388.205 3.380 20 5 GGBDRN CC[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(I)c2C)C1 ZINC000193758547 565773836 /nfs/dbraw/zinc/77/38/36/565773836.db2.gz FUANLXXLIHRCTL-SNVBAGLBSA-N 0 0 388.205 3.380 20 5 GGBDRN CN(CCSc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000193744276 565773889 /nfs/dbraw/zinc/77/38/89/565773889.db2.gz MIMNCZRNWWQHKM-UHFFFAOYSA-N 0 0 380.491 3.222 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000331664262 565774544 /nfs/dbraw/zinc/77/45/44/565774544.db2.gz WZCPYECFZVXNAF-GZBFAFLISA-N 0 0 384.885 3.492 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(I)c2C)cn1 ZINC000193789686 565775707 /nfs/dbraw/zinc/77/57/07/565775707.db2.gz FVIYGDPKWPBACD-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000282382934 565776722 /nfs/dbraw/zinc/77/67/22/565776722.db2.gz JFZAZOFXXWFVRN-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)NC1CCN(c2nccs2)CC1 ZINC000282376962 565777104 /nfs/dbraw/zinc/77/71/04/565777104.db2.gz XEZCWQWTYBRNFR-UHFFFAOYSA-N 0 0 381.845 3.495 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCn2c3ccccc3nc21 ZINC000193796969 565777214 /nfs/dbraw/zinc/77/72/14/565777214.db2.gz RKGCKORTEBQEBK-UHFFFAOYSA-N 0 0 387.193 3.367 20 5 GGBDRN O=[N+]([O-])c1cc(CN[C@]2(CO)CCOc3ccccc32)ccc1Br ZINC000282458839 565780046 /nfs/dbraw/zinc/78/00/46/565780046.db2.gz SXNWXRQXZXLGEM-KRWDZBQOSA-N 0 0 393.237 3.117 20 5 GGBDRN CSc1cccc(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)c1[N+](=O)[O-] ZINC000412345674 565782341 /nfs/dbraw/zinc/78/23/41/565782341.db2.gz HBEBARDZZAFFFB-SNVBAGLBSA-N 0 0 377.388 3.073 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC(c2ccc(Br)cc2)CC1 ZINC000282533651 565783290 /nfs/dbraw/zinc/78/32/90/565783290.db2.gz CFFWLUDOQMMHAW-UHFFFAOYSA-N 0 0 379.214 3.100 20 5 GGBDRN COc1cccc(C(=O)NCCc2ccc(Br)s2)c1[N+](=O)[O-] ZINC000193937705 565783788 /nfs/dbraw/zinc/78/37/88/565783788.db2.gz KWMASJDUJMYINH-UHFFFAOYSA-N 0 0 385.239 3.400 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000331780818 565784229 /nfs/dbraw/zinc/78/42/29/565784229.db2.gz GBMSHXVGGHOEPS-NILFDRSVSA-N 0 0 383.242 3.353 20 5 GGBDRN CC(C)Oc1cc(C(=O)NCc2cc(Br)ccn2)ccc1[N+](=O)[O-] ZINC000412366286 565784491 /nfs/dbraw/zinc/78/44/91/565784491.db2.gz RBTGGROCFZVNRY-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193940108 565784471 /nfs/dbraw/zinc/78/44/71/565784471.db2.gz KCLWVRODFJLNOD-SNVBAGLBSA-N 0 0 392.209 3.173 20 5 GGBDRN Cc1nc(C(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)c(Br)s1 ZINC000412377005 565785445 /nfs/dbraw/zinc/78/54/45/565785445.db2.gz XTIRNYHARVOBGB-UHFFFAOYSA-N 0 0 398.238 3.157 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000331820708 565785597 /nfs/dbraw/zinc/78/55/97/565785597.db2.gz PKALMDWTBUJWGJ-UXIGCNINSA-N 0 0 383.242 3.123 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]1C(C)C ZINC000331896664 565790888 /nfs/dbraw/zinc/79/08/88/565790888.db2.gz DUXOQTLLTXJCQJ-CYBMUJFWSA-N 0 0 388.205 3.378 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000176663015 565792011 /nfs/dbraw/zinc/79/20/11/565792011.db2.gz ZUPPSXWYDSRRPO-AWEZNQCLSA-N 0 0 381.841 3.477 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000282722538 565793918 /nfs/dbraw/zinc/79/39/18/565793918.db2.gz LQGRWKUABOWVKF-CYBMUJFWSA-N 0 0 384.841 3.127 20 5 GGBDRN CON(CC1CCOCC1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000282719042 565794155 /nfs/dbraw/zinc/79/41/55/565794155.db2.gz VVPZTDFXEITGBG-UHFFFAOYSA-N 0 0 388.218 3.179 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCC(=O)Nc1ccc(Br)cc1 ZINC000194107220 565794639 /nfs/dbraw/zinc/79/46/39/565794639.db2.gz NZGYHBFEECKDBO-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000331948193 565794638 /nfs/dbraw/zinc/79/46/38/565794638.db2.gz GDBNJKYZGUGVPT-IMJJTQAJSA-N 0 0 397.269 3.052 20 5 GGBDRN CCC[C@@]1(COC)CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000194128847 565795756 /nfs/dbraw/zinc/79/57/56/565795756.db2.gz GBCYPLHHRAHVPH-HNNXBMFYSA-N 0 0 376.862 3.218 20 5 GGBDRN CCC[C@]1(COC)CCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000194128686 565795828 /nfs/dbraw/zinc/79/58/28/565795828.db2.gz LXOGLECHAMYTEM-OAHLLOKOSA-N 0 0 376.862 3.218 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCc3ccc(Br)cc3C2)c1[N+](=O)[O-] ZINC000331961914 565796538 /nfs/dbraw/zinc/79/65/38/565796538.db2.gz JROPMKMADSKEKL-UHFFFAOYSA-N 0 0 393.241 3.402 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H]1C1CCOCC1 ZINC000331974749 565797379 /nfs/dbraw/zinc/79/73/79/565797379.db2.gz RXHGARUSLRRGKZ-OAHLLOKOSA-N 0 0 383.242 3.389 20 5 GGBDRN COc1cccc(C(=O)NCCOc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000194167302 565798155 /nfs/dbraw/zinc/79/81/55/565798155.db2.gz AQDFZIXJVHUDKV-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1cc(F)cc(Br)c1 ZINC000176723839 565798818 /nfs/dbraw/zinc/79/88/18/565798818.db2.gz PZQGIRIFQJPYFQ-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN C[C@@H]1CN2CCCC[C@H]2CN1C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000332008991 565799227 /nfs/dbraw/zinc/79/92/27/565799227.db2.gz QJOVGHFOSVUFLZ-ZJUUUORDSA-N 0 0 388.287 3.118 20 5 GGBDRN CO[C@](C)([C@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000412608064 565799128 /nfs/dbraw/zinc/79/91/28/565799128.db2.gz XKRUWXQSJRBVSK-MGPLVRAMSA-N 0 0 385.258 3.220 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(C2CCCC2)C1 ZINC000332013142 565799331 /nfs/dbraw/zinc/79/93/31/565799331.db2.gz ZQNRVGZOXUGHIG-SNVBAGLBSA-N 0 0 396.241 3.087 20 5 GGBDRN CC(C)(CNC(=O)c1sc(Br)cc1[N+](=O)[O-])OCC1CC1 ZINC000412626587 565801566 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CC(C)(C(=O)N1CCc2c(Cl)c(Cl)ccc2C1)n1cc([N+](=O)[O-])cn1 ZINC000332206925 565815607 /nfs/dbraw/zinc/81/56/07/565815607.db2.gz YYHPTPVQOHTUEM-UHFFFAOYSA-N 0 0 383.235 3.418 20 5 GGBDRN Cc1cc([C@H]2CCCN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])C2)[nH]n1 ZINC000283336914 565815693 /nfs/dbraw/zinc/81/56/93/565815693.db2.gz ANZKSWDRUKQAGC-NSHDSACASA-N 0 0 393.241 3.409 20 5 GGBDRN O=C(NCCCOCC(F)(F)F)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176977277 565819825 /nfs/dbraw/zinc/81/98/25/565819825.db2.gz HJYWEGZCBHWVNB-UHFFFAOYSA-N 0 0 385.136 3.056 20 5 GGBDRN CC(C)(CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1cccnc1 ZINC000412891329 565820007 /nfs/dbraw/zinc/82/00/07/565820007.db2.gz JDQWDZMZNRAPJO-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@@](=O)C(C)(C)CC1 ZINC000332239639 565820198 /nfs/dbraw/zinc/82/01/98/565820198.db2.gz UDTITFHUWYCVAI-RUZDIDTESA-N 0 0 384.523 3.469 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000176987889 565820727 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379.210 3.304 20 5 GGBDRN C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)Oc1ccccc1Br ZINC000177066582 565826654 /nfs/dbraw/zinc/82/66/54/565826654.db2.gz FFNBWKWMUSVYOD-JTQLQIEISA-N 0 0 394.225 3.137 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000283694464 565827151 /nfs/dbraw/zinc/82/71/51/565827151.db2.gz XKRXDJDMNSVLRU-UHFFFAOYSA-N 0 0 381.841 3.088 20 5 GGBDRN CCc1nc(CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cs1 ZINC000177086031 565827236 /nfs/dbraw/zinc/82/72/36/565827236.db2.gz AULWPVMUJGQEEU-UHFFFAOYSA-N 0 0 384.255 3.349 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1 ZINC000194625972 565827895 /nfs/dbraw/zinc/82/78/95/565827895.db2.gz PBKDXENCBREYDH-UHFFFAOYSA-N 0 0 378.797 3.235 20 5 GGBDRN Cc1cc(CS(=O)(=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000283751500 565828462 /nfs/dbraw/zinc/82/84/62/565828462.db2.gz GGKNORRKEHLIJV-UHFFFAOYSA-N 0 0 382.463 3.217 20 5 GGBDRN CN(Cc1ccc(Br)cc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000194654086 565829136 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Cc1ccc(Br)cc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000194701110 565831137 /nfs/dbraw/zinc/83/11/37/565831137.db2.gz ZGBAKLMTMUUCKR-UHFFFAOYSA-N 0 0 398.238 3.096 20 5 GGBDRN Cc1csc([C@H]2CCCN(S(=O)(=O)c3c(F)cccc3[N+](=O)[O-])C2)n1 ZINC000332371237 565833100 /nfs/dbraw/zinc/83/31/00/565833100.db2.gz WVOHDGKMYPHZTQ-NSHDSACASA-N 0 0 385.442 3.067 20 5 GGBDRN Cc1csc([C@@H]2CCCN(S(=O)(=O)c3c(F)cccc3[N+](=O)[O-])C2)n1 ZINC000332371236 565833235 /nfs/dbraw/zinc/83/32/35/565833235.db2.gz WVOHDGKMYPHZTQ-LLVKDONJSA-N 0 0 385.442 3.067 20 5 GGBDRN C[C@H]1CC(=O)CC[C@H]1C(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000283885182 565833754 /nfs/dbraw/zinc/83/37/54/565833754.db2.gz AJTIOOQWZPYHPW-CMPLNLGQSA-N 0 0 395.253 3.247 20 5 GGBDRN CCc1ocnc1C(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000283861954 565833916 /nfs/dbraw/zinc/83/39/16/565833916.db2.gz BPLNDPRKOFCWJW-UHFFFAOYSA-N 0 0 380.198 3.106 20 5 GGBDRN O=C(C1CCSCC1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000283890282 565835284 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XRHMIGHRPXEYHK-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN Cc1cccn2cc(CNC(=O)c3ccc(Br)cc3[N+](=O)[O-])nc12 ZINC000177271696 565840707 /nfs/dbraw/zinc/84/07/07/565840707.db2.gz GEGTUCKYWRUPKI-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN O=C(NCc1nc2ccccc2[nH]1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177280337 565841146 /nfs/dbraw/zinc/84/11/46/565841146.db2.gz ZHQPZCBPPBKYSQ-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN C[C@]1(c2ccc(Cl)s2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2F)C1=O ZINC000177289287 565841547 /nfs/dbraw/zinc/84/15/47/565841547.db2.gz QNIOLHHQBGHYSC-OAHLLOKOSA-N 0 0 383.788 3.416 20 5 GGBDRN O=[N+]([O-])c1cnc(NC[C@@H](CO)Cc2ccc(Br)cc2)c(F)c1 ZINC000413259701 565842457 /nfs/dbraw/zinc/84/24/57/565842457.db2.gz IMTVMVLJNHYFLR-NSHDSACASA-N 0 0 384.205 3.155 20 5 GGBDRN COC1(CC(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CCC1 ZINC000284152844 565844488 /nfs/dbraw/zinc/84/44/88/565844488.db2.gz QLVHNACTFJMGGA-UHFFFAOYSA-N 0 0 383.242 3.201 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1SC[C@@H]1CCCS(=O)(=O)C1 ZINC000284233693 565846814 /nfs/dbraw/zinc/84/68/14/565846814.db2.gz NGALTPNSDPVUEY-VIFPVBQESA-N 0 0 380.285 3.274 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(c2ncc(Cl)cc2Br)CC1 ZINC000413334823 565847138 /nfs/dbraw/zinc/84/71/38/565847138.db2.gz OPQZGQWRTUTRRV-UHFFFAOYSA-N 0 0 398.648 3.127 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 ZINC000284287255 565847737 /nfs/dbraw/zinc/84/77/37/565847737.db2.gz SNHNBORORYNRLU-IAQYHMDHSA-N 0 0 383.242 3.353 20 5 GGBDRN CC(C)(C)OC(=O)[C@@]1(C)CCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000413355068 565847823 /nfs/dbraw/zinc/84/78/23/565847823.db2.gz IDZCWXOGHZVFRK-HNNXBMFYSA-N 0 0 386.246 3.310 20 5 GGBDRN O=C(C[C@@H]1CCCCO1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284259608 565847837 /nfs/dbraw/zinc/84/78/37/565847837.db2.gz XPBPPHOJXVFKRF-NSHDSACASA-N 0 0 383.242 3.201 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(NCC2(N3CCOCC3)CCOCC2)c(Cl)c1 ZINC000413407339 565850178 /nfs/dbraw/zinc/85/01/78/565850178.db2.gz NVAATUVCXQESDH-UHFFFAOYSA-N 0 0 390.267 3.195 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@@H](CO)Cc2cc(F)cc(Br)c2)cn1 ZINC000413445247 565852313 /nfs/dbraw/zinc/85/23/13/565852313.db2.gz WLSQNCYVVRVZBY-NSHDSACASA-N 0 0 384.205 3.155 20 5 GGBDRN CC(C)Oc1cc(C(=O)Nc2sccc2S(C)(=O)=O)ccc1[N+](=O)[O-] ZINC000413469619 565854964 /nfs/dbraw/zinc/85/49/64/565854964.db2.gz KZPGHNJPBMPWAW-UHFFFAOYSA-N 0 0 384.435 3.099 20 5 GGBDRN NC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(Cl)c1 ZINC000177497803 565855400 /nfs/dbraw/zinc/85/54/00/565855400.db2.gz WDXBZIUDZCYPBJ-CQSZACIVSA-N 0 0 382.203 3.248 20 5 GGBDRN Cc1c(Br)c(N2C[C@@H](O)C[C@@H]2c2ccccc2)ncc1[N+](=O)[O-] ZINC000413501963 565855858 /nfs/dbraw/zinc/85/58/58/565855858.db2.gz MLADXWQFJCZEKM-QWHCGFSZSA-N 0 0 378.226 3.373 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1CCCO[C@@H](CF)C1 ZINC000413486138 565856048 /nfs/dbraw/zinc/85/60/48/565856048.db2.gz VMZWJXCCQNJDBS-NSHDSACASA-N 0 0 384.205 3.470 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000177514840 565856333 /nfs/dbraw/zinc/85/63/33/565856333.db2.gz OXZPEXYFGIGEDZ-LRDDRELGSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1cc(NCCC(C)(C)S(C)(=O)=O)c(Br)cc1[N+](=O)[O-] ZINC000413524893 565858419 /nfs/dbraw/zinc/85/84/19/565858419.db2.gz XLFGXWRWNDVUDP-UHFFFAOYSA-N 0 0 379.276 3.291 20 5 GGBDRN O=C([C@@H]1CC1(Cl)Cl)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284546757 565858955 /nfs/dbraw/zinc/85/89/55/565858955.db2.gz PTVIBDOCINQZKR-VIFPVBQESA-N 0 0 394.052 3.436 20 5 GGBDRN O=C([C@H]1CC1(Cl)Cl)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284546752 565859058 /nfs/dbraw/zinc/85/90/58/565859058.db2.gz PTVIBDOCINQZKR-SECBINFHSA-N 0 0 394.052 3.436 20 5 GGBDRN Cc1c(Br)c(N2CCC[C@H](N3CCCC3=O)CC2)ncc1[N+](=O)[O-] ZINC000413563375 565859353 /nfs/dbraw/zinc/85/93/53/565859353.db2.gz BYXWXEAWBMPPKP-LBPRGKRZSA-N 0 0 397.273 3.042 20 5 GGBDRN COc1ccc(CN(C)c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1Cl ZINC000413549927 565859682 /nfs/dbraw/zinc/85/96/82/565859682.db2.gz HCYVQBPCIYJBDH-UHFFFAOYSA-N 0 0 390.870 3.358 20 5 GGBDRN O=C(CC[C@H]1CCOC1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284616648 565861213 /nfs/dbraw/zinc/86/12/13/565861213.db2.gz UKMDYHCYUDQPQW-NSHDSACASA-N 0 0 383.242 3.059 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)c1c(F)cccc1Cl ZINC000177579355 565861240 /nfs/dbraw/zinc/86/12/40/565861240.db2.gz HAEIAUNYZMYTMT-SECBINFHSA-N 0 0 388.804 3.435 20 5 GGBDRN CSc1ccc(C(=O)NC2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000195156274 565862015 /nfs/dbraw/zinc/86/20/15/565862015.db2.gz ZUAKXVWGHTZKKR-UHFFFAOYSA-N 0 0 377.388 3.073 20 5 GGBDRN O=C1CCCC[C@H]1[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000177620482 565863190 /nfs/dbraw/zinc/86/31/90/565863190.db2.gz GPDYSKNVKHFUFE-JSGCOSHPSA-N 0 0 386.857 3.161 20 5 GGBDRN CS(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(Br)c1 ZINC000177625081 565863264 /nfs/dbraw/zinc/86/32/64/565863264.db2.gz DHJLPCZUVTVLLT-UHFFFAOYSA-N 0 0 399.266 3.319 20 5 GGBDRN CC(C)n1cc(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)cn1 ZINC000284660889 565864824 /nfs/dbraw/zinc/86/48/24/565864824.db2.gz WRXORDFWNXQLBR-UHFFFAOYSA-N 0 0 393.241 3.333 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCC2(CCOCC2)CC1 ZINC000284698339 565865713 /nfs/dbraw/zinc/86/57/13/565865713.db2.gz YVYVLXBMVBFNDA-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)C1CCC(CO)CC1 ZINC000284727928 565867543 /nfs/dbraw/zinc/86/75/43/565867543.db2.gz GHJLYKLNZLIHIX-UHFFFAOYSA-N 0 0 385.258 3.289 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC2(CCOCC2)CC1 ZINC000284747574 565868226 /nfs/dbraw/zinc/86/82/26/565868226.db2.gz BUJQJMAMNMVPFR-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccc(Br)c(F)c1 ZINC000195238881 565868569 /nfs/dbraw/zinc/86/85/69/565868569.db2.gz ZFMSRPYZDXNVNX-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000284808857 565871515 /nfs/dbraw/zinc/87/15/15/565871515.db2.gz WSTUUBPAQVBQQE-HIFRSBDPSA-N 0 0 383.242 3.449 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(F)cc2Br)ccc1[N+](=O)[O-] ZINC000195316548 565875815 /nfs/dbraw/zinc/87/58/15/565875815.db2.gz NAVCIHIDNVRIHM-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1ccc(C[C@@H](C)NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)s1 ZINC000177833872 565876165 /nfs/dbraw/zinc/87/61/65/565876165.db2.gz PLVBREOXPPXJSC-SECBINFHSA-N 0 0 381.841 3.304 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)s1 ZINC000177833880 565876276 /nfs/dbraw/zinc/87/62/76/565876276.db2.gz PLVBREOXPPXJSC-VIFPVBQESA-N 0 0 381.841 3.304 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC2(CCOCC2)CC1 ZINC000284909363 565876370 /nfs/dbraw/zinc/87/63/70/565876370.db2.gz NWSMNEQAKPFYHL-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN O=[N+]([O-])c1cnn(CCN2CCOc3cc(Br)c(Cl)cc32)c1 ZINC000177861304 565878130 /nfs/dbraw/zinc/87/81/30/565878130.db2.gz RRXATRBHCXKTOH-UHFFFAOYSA-N 0 0 387.621 3.106 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@H](C)c2ncc(C)s2)cc1[N+](=O)[O-] ZINC000177922446 565881020 /nfs/dbraw/zinc/88/10/20/565881020.db2.gz MLJZTYIWDFJCOJ-LLVKDONJSA-N 0 0 381.479 3.479 20 5 GGBDRN COc1cc(CNCc2nccs2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000195422155 565881599 /nfs/dbraw/zinc/88/15/99/565881599.db2.gz XKBDABMROXOKNT-UHFFFAOYSA-N 0 0 377.344 3.291 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC2(CCOCC2)CC1 ZINC000284977680 565881866 /nfs/dbraw/zinc/88/18/66/565881866.db2.gz RHJXNJWZZDYPGM-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN COc1ccc(Br)c(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000195425115 565882048 /nfs/dbraw/zinc/88/20/48/565882048.db2.gz CMFOMUKHCOZFEW-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(Cc1ccccn1)C1CC1 ZINC000177957939 565883148 /nfs/dbraw/zinc/88/31/48/565883148.db2.gz SOVKAYUZPXBRNZ-UHFFFAOYSA-N 0 0 381.841 3.305 20 5 GGBDRN CO[C@@](C)([C@@H](C)NC(=O)c1sc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000413960755 565883716 /nfs/dbraw/zinc/88/37/16/565883716.db2.gz QXIHBLVCYJOWHU-UHLUBPPHSA-N 0 0 377.260 3.352 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CCCC(F)(F)[C@@H]1O ZINC000413984523 565884229 /nfs/dbraw/zinc/88/42/29/565884229.db2.gz FEXLGRWWQYXMIU-TVQRCGJNSA-N 0 0 380.800 3.005 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCc2c(Br)cccc2C1 ZINC000195464031 565885604 /nfs/dbraw/zinc/88/56/04/565885604.db2.gz CBUMFGKFZCDAFQ-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN CCN(CC)[C@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccsc1 ZINC000195568683 565890018 /nfs/dbraw/zinc/89/00/18/565890018.db2.gz KTYIBIYXQOTSGG-MRXNPFEDSA-N 0 0 383.495 3.018 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000195683321 565891305 /nfs/dbraw/zinc/89/13/05/565891305.db2.gz FVHWSJCGKXJOBO-SECBINFHSA-N 0 0 396.216 3.440 20 5 GGBDRN Cc1cccc(OC[C@@H](C)NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000195669336 565891702 /nfs/dbraw/zinc/89/17/02/565891702.db2.gz NDSCYQUKADYTKP-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(Br)ccc1O ZINC000195711407 565891755 /nfs/dbraw/zinc/89/17/55/565891755.db2.gz GITFOHMUCLNMOS-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN Cc1nc(CN2CCN(c3ccc(Br)cc3[N+](=O)[O-])CC2)cs1 ZINC000198704889 565892966 /nfs/dbraw/zinc/89/29/66/565892966.db2.gz OYZNBCAULAYMDK-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccc(Br)s2)ccc1[N+](=O)[O-] ZINC000217214498 565897578 /nfs/dbraw/zinc/89/75/78/565897578.db2.gz SIPJVGAXOLWILU-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)c2nnc(NC3CCCCC3)s2)c1 ZINC000178114667 565897898 /nfs/dbraw/zinc/89/78/98/565897898.db2.gz GHEXBIJOQALHND-UHFFFAOYSA-N 0 0 382.467 3.165 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCCC[C@@H]2c2cc[nH]n2)cc1[N+](=O)[O-] ZINC000285332490 565901527 /nfs/dbraw/zinc/90/15/27/565901527.db2.gz OMNAWHRONSGWML-CYBMUJFWSA-N 0 0 384.845 3.196 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCN(Cc3ccc(Br)s3)CC2)n1 ZINC000178151738 565901781 /nfs/dbraw/zinc/90/17/81/565901781.db2.gz WLZVGTAXDSWAGD-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NC[C@H](O)c1ccsc1 ZINC000218906527 565902319 /nfs/dbraw/zinc/90/23/19/565902319.db2.gz MMXBCZOGJOBBRQ-LBPRGKRZSA-N 0 0 390.202 3.406 20 5 GGBDRN C[C@@](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)(C(N)=O)c1cccc(Cl)c1 ZINC000178168840 565902760 /nfs/dbraw/zinc/90/27/60/565902760.db2.gz XSOTZSIKHLLRFF-INIZCTEOSA-N 0 0 382.203 3.032 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)CCCn1ccnc1 ZINC000285368655 565903326 /nfs/dbraw/zinc/90/33/26/565903326.db2.gz SZHAEOQJONPNCO-UHFFFAOYSA-N 0 0 381.230 3.025 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)N2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC000285367023 565903443 /nfs/dbraw/zinc/90/34/43/565903443.db2.gz QYKREZYPMJUGKS-GFCCVEGCSA-N 0 0 388.808 3.026 20 5 GGBDRN O=C(Nc1nc2c(s1)COCC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178201899 565905812 /nfs/dbraw/zinc/90/58/12/565905812.db2.gz DLEGJDPIHKGDMZ-UHFFFAOYSA-N 0 0 384.211 3.139 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(O)c(Br)c1 ZINC000178267743 565908870 /nfs/dbraw/zinc/90/88/70/565908870.db2.gz JNPYDWKSSFQIEB-UHFFFAOYSA-N 0 0 394.225 3.405 20 5 GGBDRN COC(=O)c1cc(-c2nc(-c3ccc(Br)o3)no2)cc([N+](=O)[O-])c1 ZINC000178274817 565909817 /nfs/dbraw/zinc/90/98/17/565909817.db2.gz QIHUPYIWVCQSSJ-UHFFFAOYSA-N 0 0 394.137 3.454 20 5 GGBDRN CS(=O)(=O)c1cccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000178446785 565919271 /nfs/dbraw/zinc/91/92/71/565919271.db2.gz MMOYGZDQPUPYLJ-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN O=[N+]([O-])c1ccn(CCSc2nnc(Cc3cccs3)n2C2CC2)n1 ZINC000178480476 565920481 /nfs/dbraw/zinc/92/04/81/565920481.db2.gz KDEHEGRQGNFXNK-UHFFFAOYSA-N 0 0 376.467 3.162 20 5 GGBDRN COc1ccc(Nc2nnc(SCCn3ccc([N+](=O)[O-])n3)s2)cc1 ZINC000178461544 565920905 /nfs/dbraw/zinc/92/09/05/565920905.db2.gz UFPXHKIRIBEGNG-UHFFFAOYSA-N 0 0 378.439 3.187 20 5 GGBDRN O=[N+]([O-])c1ccn(CCSc2nnc(NCc3ccc(F)cc3)s2)n1 ZINC000178484587 565921532 /nfs/dbraw/zinc/92/15/32/565921532.db2.gz GAYIJCZVWVSVGR-UHFFFAOYSA-N 0 0 380.430 3.186 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(CCCO)c1ccc(Cl)cc1 ZINC000414388986 565921613 /nfs/dbraw/zinc/92/16/13/565921613.db2.gz NVTPVBBQRUUSHD-UHFFFAOYSA-N 0 0 384.841 3.134 20 5 GGBDRN O=[N+]([O-])c1ccn(CCSc2nnc(NCCc3cccs3)s2)n1 ZINC000178486346 565922109 /nfs/dbraw/zinc/92/21/09/565922109.db2.gz NKCRYFKVEOZYPG-UHFFFAOYSA-N 0 0 382.496 3.151 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NCc1ccc(O)c(Br)c1 ZINC000178536141 565924619 /nfs/dbraw/zinc/92/46/19/565924619.db2.gz ZFBSIQGBOAGDJX-UHFFFAOYSA-N 0 0 380.198 3.062 20 5 GGBDRN C[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1cc(F)c(Cl)cc1Cl ZINC000178552252 565925893 /nfs/dbraw/zinc/92/58/93/565925893.db2.gz YHHYBFRXQNQQHI-QMMMGPOBSA-N 0 0 388.182 3.080 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@@H]1[C@H]1CCCO1 ZINC000285780928 565926851 /nfs/dbraw/zinc/92/68/51/565926851.db2.gz LKTAZOQUWLJZNC-DGCLKSJQSA-N 0 0 387.205 3.280 20 5 GGBDRN Nc1ccc(C(=O)N[C@H](c2cncc(Br)c2)C2CC2)cc1[N+](=O)[O-] ZINC000285794166 565927370 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CCOC(=O)CN(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)C(C)C ZINC000178836057 565940435 /nfs/dbraw/zinc/94/04/35/565940435.db2.gz AJPQYRHHBSICOZ-UHFFFAOYSA-N 0 0 387.230 3.079 20 5 GGBDRN CC[C@@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H](C)[S@]1=O ZINC000286166682 565945724 /nfs/dbraw/zinc/94/57/24/565945724.db2.gz WPNRFGSJMNKQIF-NNJUXLKUSA-N 0 0 375.288 3.089 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)N2CCCC[C@@H]2c2ncc[nH]2)c1 ZINC000286164974 565946084 /nfs/dbraw/zinc/94/60/84/565946084.db2.gz YDZYKSROZRJOFM-LLVKDONJSA-N 0 0 388.808 3.026 20 5 GGBDRN C[C@H](CN(C)S(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F)c1nccs1 ZINC000286199295 565947086 /nfs/dbraw/zinc/94/70/86/565947086.db2.gz ANERPXYTZCEVFQ-MRVPVSSYSA-N 0 0 393.849 3.268 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CC[C@H](C(F)(F)F)[C@H](CO)C2)c(Br)c1 ZINC000286223277 565948285 /nfs/dbraw/zinc/94/82/85/565948285.db2.gz DCUJGUMOJDJOJZ-WPRPVWTQSA-N 0 0 383.164 3.354 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](C(F)(F)F)[C@H](CO)C2)c(Br)c1 ZINC000286223275 565948578 /nfs/dbraw/zinc/94/85/78/565948578.db2.gz DCUJGUMOJDJOJZ-WCBMZHEXSA-N 0 0 383.164 3.354 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@](O)(C(F)(F)F)CC2)c(Br)c1 ZINC000286299571 565953089 /nfs/dbraw/zinc/95/30/89/565953089.db2.gz IFKGIFCEIIZVPQ-LLVKDONJSA-N 0 0 384.152 3.036 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1OC[C@H](O)COc1ccccc1F ZINC000179064960 565955373 /nfs/dbraw/zinc/95/53/73/565955373.db2.gz FQWJKHNZDJITAK-LLVKDONJSA-N 0 0 386.173 3.315 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OC[C@H](O)COc1cccc(Br)c1 ZINC000179065181 565955382 /nfs/dbraw/zinc/95/53/82/565955382.db2.gz XBTNRKIHSPSXEI-CYBMUJFWSA-N 0 0 398.209 3.185 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H]1c1cccnc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000286419094 565958679 /nfs/dbraw/zinc/95/86/79/565958679.db2.gz OUJUISLXTUIBPR-DZGCQCFKSA-N 0 0 392.209 3.012 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2ccccc2F)c(Br)c1 ZINC000179113124 565958953 /nfs/dbraw/zinc/95/89/53/565958953.db2.gz ZYHCMBWXQXBFCM-LLVKDONJSA-N 0 0 386.173 3.315 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 ZINC000286426492 565958975 /nfs/dbraw/zinc/95/89/75/565958975.db2.gz RLOSWKUJGRARFK-PSASIEDQSA-N 0 0 383.164 3.354 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1COc2ccc(Br)cc21 ZINC000179159124 565962426 /nfs/dbraw/zinc/96/24/26/565962426.db2.gz UBVDPWAWCDQYMN-CQSZACIVSA-N 0 0 377.194 3.150 20 5 GGBDRN C[C@]12CCN(c3ccc([N+](=O)[O-])cc3S(C)(=O)=O)C[C@H]1C2(Cl)Cl ZINC000286558273 565966976 /nfs/dbraw/zinc/96/69/76/565966976.db2.gz UQPPXDLCVMONKO-OLZOCXBDSA-N 0 0 379.265 3.018 20 5 GGBDRN C[C@@]12CCN(c3ccc([N+](=O)[O-])cc3S(C)(=O)=O)C[C@@H]1C2(Cl)Cl ZINC000286558274 565967347 /nfs/dbraw/zinc/96/73/47/565967347.db2.gz UQPPXDLCVMONKO-QWHCGFSZSA-N 0 0 379.265 3.018 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1Br ZINC000286564833 565968447 /nfs/dbraw/zinc/96/84/47/565968447.db2.gz PGDFZAXPESUERJ-WDEREUQCSA-N 0 0 397.191 3.350 20 5 GGBDRN Cc1noc([C@@H]2CCCN2C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000286738532 565976904 /nfs/dbraw/zinc/97/69/04/565976904.db2.gz WAXGJZXGJIYNTM-LBPRGKRZSA-N 0 0 395.213 3.334 20 5 GGBDRN Cc1noc([C@H]2CCCN2C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000286738527 565976931 /nfs/dbraw/zinc/97/69/31/565976931.db2.gz WAXGJZXGJIYNTM-GFCCVEGCSA-N 0 0 395.213 3.334 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)COc1ccccc1Br ZINC000179390508 565977500 /nfs/dbraw/zinc/97/75/00/565977500.db2.gz CARTXSDEHFFVRB-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN Cc1nn(C)cc1[C@H](C)NC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000179422983 565979501 /nfs/dbraw/zinc/97/95/01/565979501.db2.gz TXSOIJZSYDBHHK-QMMMGPOBSA-N 0 0 382.218 3.282 20 5 GGBDRN CCOC1CC2(C1)CCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)C2 ZINC000286777046 565979725 /nfs/dbraw/zinc/97/97/25/565979725.db2.gz UMOMCJUCIGJBPN-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(NCC(F)(F)Br)c1sc(Br)cc1[N+](=O)[O-] ZINC000286878364 565984821 /nfs/dbraw/zinc/98/48/21/565984821.db2.gz ZYPMDBLNULSIQK-UHFFFAOYSA-N 0 0 393.991 3.136 20 5 GGBDRN O=C([C@@H]1COc2ccc(Br)cc21)N1CCc2c1cccc2[N+](=O)[O-] ZINC000179511736 565985586 /nfs/dbraw/zinc/98/55/86/565985586.db2.gz XSXBEZAYIBIKML-CYBMUJFWSA-N 0 0 389.205 3.423 20 5 GGBDRN CCN(CC)[C@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000179576278 565990102 /nfs/dbraw/zinc/99/01/02/565990102.db2.gz NJIYQGIECVORPY-GFCCVEGCSA-N 0 0 387.483 3.148 20 5 GGBDRN COc1ccc(CCCN(C)c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000179574017 565990331 /nfs/dbraw/zinc/99/03/31/565990331.db2.gz FRZCGSSKZIAZIU-UHFFFAOYSA-N 0 0 384.479 3.137 20 5 GGBDRN CN(CCCOc1ccc(F)cc1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000179568963 565990493 /nfs/dbraw/zinc/99/04/93/565990493.db2.gz RVRRXWHCXDMFAV-UHFFFAOYSA-N 0 0 388.442 3.104 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179598040 565991299 /nfs/dbraw/zinc/99/12/99/565991299.db2.gz QJSOIWSISXHCCX-SNVBAGLBSA-N 0 0 393.245 3.132 20 5 GGBDRN O=C(NCc1ccsc1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000179587758 565991363 /nfs/dbraw/zinc/99/13/63/565991363.db2.gz LQBIHBXEXRYQOU-UHFFFAOYSA-N 0 0 388.186 3.191 20 5 GGBDRN C[C@@H](NC(=O)NCCCn1cc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000287000297 565991411 /nfs/dbraw/zinc/99/14/11/565991411.db2.gz DBTBHEOXSHSEIN-LLVKDONJSA-N 0 0 396.245 3.004 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c(Br)c1 ZINC000179597958 565991652 /nfs/dbraw/zinc/99/16/52/565991652.db2.gz DZEXZGGNRGACSP-JTQLQIEISA-N 0 0 393.245 3.132 20 5 GGBDRN CC(C)Oc1cccc(CN(C)c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000179614427 565992500 /nfs/dbraw/zinc/99/25/00/565992500.db2.gz LYUNJTKXNIPHME-UHFFFAOYSA-N 0 0 384.479 3.483 20 5 GGBDRN CCCCO[C@H]1C[C@H](Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1(C)C ZINC000179602920 565992544 /nfs/dbraw/zinc/99/25/44/565992544.db2.gz MHKBSYQORYITII-RYUDHWBXSA-N 0 0 376.500 3.456 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@H]32)cc1[N+](=O)[O-] ZINC000245528316 565994597 /nfs/dbraw/zinc/99/45/97/565994597.db2.gz WNDCGPRVDMBQGT-LNSITVRQSA-N 0 0 383.242 3.353 20 5 GGBDRN Cc1ccc(Br)c(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000179636761 565995408 /nfs/dbraw/zinc/99/54/08/565995408.db2.gz OQLMHGCGCVDYDX-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CCS[C@@H](c2ccccc2)C1 ZINC000363234676 565996831 /nfs/dbraw/zinc/99/68/31/565996831.db2.gz RCEBDMFCHQCRSK-CQSZACIVSA-N 0 0 382.438 3.213 20 5 GGBDRN CC(C)N(CC(N)=O)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000179658863 565997918 /nfs/dbraw/zinc/99/79/18/565997918.db2.gz AUGJYEAETRXLLP-UHFFFAOYSA-N 0 0 396.241 3.313 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC000363305964 565999092 /nfs/dbraw/zinc/99/90/92/565999092.db2.gz VGCITUFVVARRRC-LLVKDONJSA-N 0 0 388.854 3.072 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)CCc2ccccc2[N+](=O)[O-])c2ccccc2S1 ZINC000179668266 565998968 /nfs/dbraw/zinc/99/89/68/565998968.db2.gz FRWTVZMAVLUCIW-ZDUSSCGKSA-N 0 0 378.475 3.468 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cc(Br)cc(C(F)(F)F)c1 ZINC000179734745 566004118 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GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCS[C@H]2CCCC[C@H]21 ZINC000246096778 566016321 /nfs/dbraw/zinc/01/63/21/566016321.db2.gz HUUCQZZHEGIHHK-YPMHNXCESA-N 0 0 376.887 3.297 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000246091708 566016522 /nfs/dbraw/zinc/01/65/22/566016522.db2.gz MAWDDWYPCLKJOM-KCPJHIHWSA-N 0 0 395.253 3.353 20 5 GGBDRN O=C1CCCC[C@@H]1[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000246104120 566017733 /nfs/dbraw/zinc/01/77/33/566017733.db2.gz BGXGAKJHXUKMRT-OLZOCXBDSA-N 0 0 386.857 3.161 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCS[C@H]2CCCC[C@H]21 ZINC000246138527 566018488 /nfs/dbraw/zinc/01/84/88/566018488.db2.gz NIFLZRFYTIKSNQ-YPMHNXCESA-N 0 0 376.887 3.297 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCS[C@@H]2CCCC[C@H]21 ZINC000246138517 566019020 /nfs/dbraw/zinc/01/90/20/566019020.db2.gz NIFLZRFYTIKSNQ-DGCLKSJQSA-N 0 0 376.887 3.297 20 5 GGBDRN CCn1cc(Br)cc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 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CCCN(CC(=O)OCC)C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000555866306 566256610 /nfs/dbraw/zinc/25/66/10/566256610.db2.gz FLVOUCUTQNSZQS-UHFFFAOYSA-N 0 0 387.230 3.081 20 5 GGBDRN COCCC1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000599371511 566256629 /nfs/dbraw/zinc/25/66/29/566256629.db2.gz OXGFOGNPUPWGRC-UHFFFAOYSA-N 0 0 397.280 3.339 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000444884844 566256993 /nfs/dbraw/zinc/25/69/93/566256993.db2.gz YXWATDWFKSMZIH-UHFFFAOYSA-N 0 0 388.225 3.280 20 5 GGBDRN Cc1cc(N[C@H]2CCCN(c3ccnn3C)C2)c(Br)cc1[N+](=O)[O-] ZINC000444879262 566257506 /nfs/dbraw/zinc/25/75/06/566257506.db2.gz SSNCTUWIPDDPMM-LBPRGKRZSA-N 0 0 394.273 3.480 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2C[C@@H](C)C(F)(F)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000599377010 566258399 /nfs/dbraw/zinc/25/83/99/566258399.db2.gz FZTNKSUBACNAFM-RKDXNWHRSA-N 0 0 382.816 3.468 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000462183308 566260460 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Cn1cc(Cl)c(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)n1 ZINC000599453709 566265168 /nfs/dbraw/zinc/26/51/68/566265168.db2.gz YMSGPHJBVNHKIW-UHFFFAOYSA-N 0 0 376.722 3.186 20 5 GGBDRN C[C@@H]1CC(F)(F)CCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000599463490 566265353 /nfs/dbraw/zinc/26/53/53/566265353.db2.gz WYAFQIINQWRNNK-MRVPVSSYSA-N 0 0 399.213 3.166 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(F)cc1Cl)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000509134904 566266352 /nfs/dbraw/zinc/26/63/52/566266352.db2.gz DCNQGQLJBJUSPL-VIFPVBQESA-N 0 0 386.788 3.188 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])S(=O)(=O)Cc1cc(Cl)ccc1F ZINC000509134789 566266781 /nfs/dbraw/zinc/26/67/81/566266781.db2.gz CZBVDRJIBQJHHS-UHFFFAOYSA-N 0 0 386.832 3.392 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000509147780 566267718 /nfs/dbraw/zinc/26/77/18/566267718.db2.gz XJBLOCMALKULRJ-LLVKDONJSA-N 0 0 382.825 3.358 20 5 GGBDRN C[C@H]1CC(F)(F)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000599468781 566267835 /nfs/dbraw/zinc/26/78/35/566267835.db2.gz ITILFOHGXYTWFS-QMMMGPOBSA-N 0 0 388.314 3.422 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)CCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000509154868 566267947 /nfs/dbraw/zinc/26/79/47/566267947.db2.gz OKNYNKDIUBQOSD-UHFFFAOYSA-N 0 0 384.841 3.120 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Cc2noc(-c3ccc(Cl)cc3)n2)c1 ZINC000509147462 566268008 /nfs/dbraw/zinc/26/80/08/566268008.db2.gz UJJBIEJECDYSNG-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN COc1ccc(Cl)c(S(=O)(=O)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000509143583 566268347 /nfs/dbraw/zinc/26/83/47/566268347.db2.gz XWDZXKZVKPXPOS-UHFFFAOYSA-N 0 0 384.841 3.120 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCc3c(O)cccc3C2)cc1[N+](=O)[O-] ZINC000599491417 566268690 /nfs/dbraw/zinc/26/86/90/566268690.db2.gz RNNDNEHRMATUAS-UHFFFAOYSA-N 0 0 382.825 3.009 20 5 GGBDRN CC[C@@H]1CCCC[N@@H+]1CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599493000 566268915 /nfs/dbraw/zinc/26/89/15/566268915.db2.gz HXUWCJLMQWSLDP-GFCCVEGCSA-N 0 0 384.274 3.352 20 5 GGBDRN CC(C)(CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1cccc(Br)c1 ZINC000445184455 566271088 /nfs/dbraw/zinc/27/10/88/566271088.db2.gz DWYSKJYJXMDCMY-UHFFFAOYSA-N 0 0 394.225 3.166 20 5 GGBDRN CN1CCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c2ccc(Cl)cc21 ZINC000599530650 566271654 /nfs/dbraw/zinc/27/16/54/566271654.db2.gz RXUBTMZCDGQIKF-UHFFFAOYSA-N 0 0 381.841 3.034 20 5 GGBDRN CN(Cc1ccoc1)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000535021787 566272401 /nfs/dbraw/zinc/27/24/01/566272401.db2.gz BVFCBDQOLDPPGW-UHFFFAOYSA-N 0 0 386.145 3.065 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC[N@@H+](C2CCCC2)CC1 ZINC000599543426 566274332 /nfs/dbraw/zinc/27/43/32/566274332.db2.gz AKIWNBSPHYKMNH-UHFFFAOYSA-N 0 0 396.285 3.448 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])[C@H]2CCCO[C@H]21 ZINC000599574984 566275111 /nfs/dbraw/zinc/27/51/11/566275111.db2.gz FNBHTTVMPDNDDN-OWYVNGRQSA-N 0 0 383.242 3.291 20 5 GGBDRN CN(CCc1cccc(Br)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000462288163 566275310 /nfs/dbraw/zinc/27/53/10/566275310.db2.gz LYJNJCAHKDOJTQ-UHFFFAOYSA-N 0 0 399.266 3.221 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1cc[nH]c(=O)c1Br ZINC000445252236 566276719 /nfs/dbraw/zinc/27/67/19/566276719.db2.gz VFSFZYCVEDICBC-UHFFFAOYSA-N 0 0 380.198 3.256 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000445258816 566278464 /nfs/dbraw/zinc/27/84/64/566278464.db2.gz HBADPTLSNRFPDL-UHFFFAOYSA-N 0 0 398.238 3.339 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1C ZINC000445256660 566278563 /nfs/dbraw/zinc/27/85/63/566278563.db2.gz AVNUGBSGHOJBPO-UHFFFAOYSA-N 0 0 398.238 3.339 20 5 GGBDRN Cn1cc([N+](=O)[O-])c(C(=O)NCCc2c[nH]c3cc(Cl)cc(Cl)c23)n1 ZINC000482055120 566278943 /nfs/dbraw/zinc/27/89/43/566278943.db2.gz OKQFPJRLSAQNSY-UHFFFAOYSA-N 0 0 382.207 3.089 20 5 GGBDRN C[C@H](Cc1cc(Br)ccc1F)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000535133833 566279843 /nfs/dbraw/zinc/27/98/43/566279843.db2.gz LMBZRKFRKQQNIV-SECBINFHSA-N 0 0 384.205 3.196 20 5 GGBDRN CC(C)(C)OC(=O)CCCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599622510 566280404 /nfs/dbraw/zinc/28/04/04/566280404.db2.gz LCXLKHPOWPIVMQ-UHFFFAOYSA-N 0 0 387.230 3.209 20 5 GGBDRN CCOc1cnc(-c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)cn1 ZINC000445300708 566280904 /nfs/dbraw/zinc/28/09/04/566280904.db2.gz LALVLSRGNGOAEA-UHFFFAOYSA-N 0 0 392.169 3.263 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCN(c2cccs2)CC1 ZINC000599659434 566283941 /nfs/dbraw/zinc/28/39/41/566283941.db2.gz ITMCKTMBICXKNA-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN O=C(Cc1noc(-c2ccc([N+](=O)[O-])[nH]2)n1)Nc1cccc(Cl)c1Cl ZINC000445370737 566284622 /nfs/dbraw/zinc/28/46/22/566284622.db2.gz NQHUYGILGXJNKA-UHFFFAOYSA-N 0 0 382.163 3.461 20 5 GGBDRN C[C@H]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000599661926 566284784 /nfs/dbraw/zinc/28/47/84/566284784.db2.gz HAPVVQCFHCHNHS-SMDDNHRTSA-N 0 0 393.241 3.277 20 5 GGBDRN O=C(Cc1noc(-c2cc([N+](=O)[O-])c[nH]2)n1)Nc1cc(Cl)cc(Cl)c1 ZINC000445377978 566286712 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O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC([C@H]2CCOC2)CC1 ZINC000599751885 566292982 /nfs/dbraw/zinc/29/29/82/566292982.db2.gz FBIONWVPJMZRBR-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN COCC[C@@H](Cc1ccco1)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599757785 566293277 /nfs/dbraw/zinc/29/32/77/566293277.db2.gz MXJKBJYNKWCFFF-NSHDSACASA-N 0 0 397.225 3.328 20 5 GGBDRN C[C@]1(CNC(=O)c2c(Br)cccc2[N+](=O)[O-])CCO[C@@H]1C1CC1 ZINC000599770357 566294404 /nfs/dbraw/zinc/29/44/04/566294404.db2.gz CLPQCCKBYXFXNR-GDBMZVCRSA-N 0 0 383.242 3.292 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000462400165 566296269 /nfs/dbraw/zinc/29/62/69/566296269.db2.gz DROKDLGTRXCAET-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OC(F)F)cc1F ZINC000509379114 566296468 /nfs/dbraw/zinc/29/64/68/566296468.db2.gz OWUIQZPORRCKIA-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C)c1ccc(Cl)cc1 ZINC000462405135 566296387 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C[C@H](Oc1ccccc1Br)c1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000445575335 566298286 /nfs/dbraw/zinc/29/82/86/566298286.db2.gz QGNXPIQIGZGFMO-QMMMGPOBSA-N 0 0 394.185 3.281 20 5 GGBDRN CC(C)n1cc(Br)cc1-c1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000445572384 566298533 /nfs/dbraw/zinc/29/85/33/566298533.db2.gz DNPNYDNCTXCDOB-UHFFFAOYSA-N 0 0 381.190 3.190 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(CSc2cccc(Br)c2)n1 ZINC000445581097 566298608 /nfs/dbraw/zinc/29/86/08/566298608.db2.gz XSYCIBDEJGJKMO-UHFFFAOYSA-N 0 0 396.226 3.433 20 5 GGBDRN CC[C@H](C)c1nnc([C@H](C)NC(=O)c2c(Br)cccc2[N+](=O)[O-])[nH]1 ZINC000599828198 566299457 /nfs/dbraw/zinc/29/94/57/566299457.db2.gz OWPHDIPHGJDECB-IUCAKERBSA-N 0 0 396.245 3.480 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(Cc3ccc(Br)c(F)c3)n2)n1C ZINC000445600377 566299473 /nfs/dbraw/zinc/29/94/73/566299473.db2.gz JNPSOXASGASIRI-UHFFFAOYSA-N 0 0 396.176 3.179 20 5 GGBDRN CCC[C@@H](CNC(=O)c1c(Br)cccc1[N+](=O)[O-])C(=O)OCC ZINC000599848828 566299720 /nfs/dbraw/zinc/29/97/20/566299720.db2.gz JKMYAYVDGSGNDU-JTQLQIEISA-N 0 0 387.230 3.067 20 5 GGBDRN Cc1c(Br)c(N2CCC[C@H]2C(=O)OC(C)(C)C)ncc1[N+](=O)[O-] ZINC000445599975 566299984 /nfs/dbraw/zinc/29/99/84/566299984.db2.gz KEPDKMMFFFLCSI-JTQLQIEISA-N 0 0 386.246 3.371 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CC[C@@H](Oc2ccncc2)C1 ZINC000599848556 566300053 /nfs/dbraw/zinc/30/00/53/566300053.db2.gz FKLOVLXDJHRAIF-GFCCVEGCSA-N 0 0 392.209 3.046 20 5 GGBDRN CC(C)OC(=O)CC[C@@H](C)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599857571 566300883 /nfs/dbraw/zinc/30/08/83/566300883.db2.gz MYAIPGUHSVGSIV-SNVBAGLBSA-N 0 0 387.230 3.207 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(CCc3cccc(Br)c3)n2)n1C ZINC000445621573 566301085 /nfs/dbraw/zinc/30/10/85/566301085.db2.gz VLTAJQSKYXCUKY-UHFFFAOYSA-N 0 0 392.213 3.234 20 5 GGBDRN COc1ccc(-c2nc(-c3c([N+](=O)[O-])nc(C)n3C)no2)cc1Br ZINC000445617136 566301218 /nfs/dbraw/zinc/30/12/18/566301218.db2.gz XARKEUJSECTHIG-UHFFFAOYSA-N 0 0 394.185 3.125 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3cc(F)ccc3Br)n2)n1C ZINC000445615970 566301498 /nfs/dbraw/zinc/30/14/98/566301498.db2.gz NMVAXGDEBICMLY-UHFFFAOYSA-N 0 0 382.149 3.255 20 5 GGBDRN Cc1cc(-c2nc(-c3c([N+](=O)[O-])nc(C)n3C)no2)c(Br)s1 ZINC000445616525 566301861 /nfs/dbraw/zinc/30/18/61/566301861.db2.gz QFQYHZKEYFBZDQ-UHFFFAOYSA-N 0 0 384.215 3.486 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2cccs2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000575956918 566302063 /nfs/dbraw/zinc/30/20/63/566302063.db2.gz IIXLCVQEQXRLIX-HNNXBMFYSA-N 0 0 384.479 3.003 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N(C[C@H]1CCOC1)C1CC1 ZINC000462438687 566302414 /nfs/dbraw/zinc/30/24/14/566302414.db2.gz UMEDCWNPGFWDMW-SECBINFHSA-N 0 0 395.264 3.091 20 5 GGBDRN Cc1n[nH]cc1C1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000599917896 566303394 /nfs/dbraw/zinc/30/33/94/566303394.db2.gz HHLZDPFNPNPOGD-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000556456597 566303605 /nfs/dbraw/zinc/30/36/05/566303605.db2.gz UOOLOSHMURRSQI-LKFCYVNXSA-N 0 0 399.241 3.079 20 5 GGBDRN CN(Cc1ccc(Br)cc1Cl)C(=O)c1cc([N+](=O)[O-])cnc1N ZINC000482373727 566304293 /nfs/dbraw/zinc/30/42/93/566304293.db2.gz AQNXZWMZJMVNBE-UHFFFAOYSA-N 0 0 399.632 3.260 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCc1ccc(F)cc1F ZINC000445687889 566304547 /nfs/dbraw/zinc/30/45/47/566304547.db2.gz BIRCSIDJVTVLOB-UHFFFAOYSA-N 0 0 385.164 3.494 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCc1ccc(F)c(F)c1 ZINC000445693764 566305421 /nfs/dbraw/zinc/30/54/21/566305421.db2.gz WIJCJRYXXYNZBP-UHFFFAOYSA-N 0 0 385.164 3.494 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCc2ncsc2C1 ZINC000445695862 566305439 /nfs/dbraw/zinc/30/54/39/566305439.db2.gz ABYIOLYSYYVCKY-UHFFFAOYSA-N 0 0 394.261 3.105 20 5 GGBDRN Cc1ccc(Br)cc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000535458559 566306479 /nfs/dbraw/zinc/30/64/79/566306479.db2.gz IYJYNUXPSXQPRN-UHFFFAOYSA-N 0 0 375.182 3.216 20 5 GGBDRN Cc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c(Br)c1 ZINC000535459364 566306993 /nfs/dbraw/zinc/30/69/93/566306993.db2.gz LRPHMQQKRUAIAV-UHFFFAOYSA-N 0 0 375.182 3.216 20 5 GGBDRN Cc1cc(CNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)nc(C)n1 ZINC000556482999 566307068 /nfs/dbraw/zinc/30/70/68/566307068.db2.gz QXBNKXXQHWSTFK-UHFFFAOYSA-N 0 0 379.214 3.003 20 5 GGBDRN CC(C)[C@H](CO)[C@@H](NC(=O)c1c(Br)cccc1[N+](=O)[O-])C(C)C ZINC000599989840 566307257 /nfs/dbraw/zinc/30/72/57/566307257.db2.gz YGCBEZCLFDCXPQ-NHYWBVRUSA-N 0 0 387.274 3.376 20 5 GGBDRN O=C(NC[C@H](CO)C1CCCCC1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599974404 566307445 /nfs/dbraw/zinc/30/74/45/566307445.db2.gz FCZIWESMQCYDSR-GFCCVEGCSA-N 0 0 385.258 3.276 20 5 GGBDRN CC(C)[C@]1(CO)CCCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599986409 566308083 /nfs/dbraw/zinc/30/80/83/566308083.db2.gz ZASRSXZMGHBDOR-MRXNPFEDSA-N 0 0 385.258 3.228 20 5 GGBDRN CC(C)(CNC(=O)c1c(Br)cccc1[N+](=O)[O-])c1ccccn1 ZINC000599984201 566308151 /nfs/dbraw/zinc/30/81/51/566308151.db2.gz XYOHWRSGNUSYBT-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN C[C@H]1CCC[C@@H](N(C)C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000556506754 566308380 /nfs/dbraw/zinc/30/83/80/566308380.db2.gz VIHRXWQTBGEXMF-GXFFZTMASA-N 0 0 398.257 3.333 20 5 GGBDRN CC(C)(CNC(=O)c1c(Br)cccc1[N+](=O)[O-])c1cccnc1 ZINC000600018900 566310691 /nfs/dbraw/zinc/31/06/91/566310691.db2.gz BJAUHPOEWQAFJD-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN CSc1cccc(C(=O)N[C@@H](C)c2nc(C(F)(F)F)no2)c1[N+](=O)[O-] ZINC000600031885 566310791 /nfs/dbraw/zinc/31/07/91/566310791.db2.gz PPTVNFXVLPRQGW-LURJTMIESA-N 0 0 376.316 3.210 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1cc(Cl)cc(F)c1Br ZINC000576058216 566310967 /nfs/dbraw/zinc/31/09/67/566310967.db2.gz HLKLYNOOUBZZAW-UHFFFAOYSA-N 0 0 377.557 3.136 20 5 GGBDRN O=C(NCC[C@@H]1CC=CCC1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000600043736 566311273 /nfs/dbraw/zinc/31/12/73/566311273.db2.gz MRYKPVNBSSUYMI-LLVKDONJSA-N 0 0 396.241 3.158 20 5 GGBDRN C[C@@H]1c2cccc(Br)c2CCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000509493397 566311293 /nfs/dbraw/zinc/31/12/93/566311293.db2.gz PSIIWKZKLVGXJQ-GFCCVEGCSA-N 0 0 392.253 3.138 20 5 GGBDRN C[C@@H]1CC[C@@H](NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000556552316 566312695 /nfs/dbraw/zinc/31/26/95/566312695.db2.gz DHOZGIPSKMOZPL-CKYFFXLPSA-N 0 0 398.257 3.237 20 5 GGBDRN C[C@H]1CC2(CN1C(=O)c1c(Br)cccc1[N+](=O)[O-])CCOCC2 ZINC000600076631 566313351 /nfs/dbraw/zinc/31/33/51/566313351.db2.gz XDGUJOICIXXVOZ-NSHDSACASA-N 0 0 383.242 3.389 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420754182 566314069 /nfs/dbraw/zinc/31/40/69/566314069.db2.gz OEUBNSQCJSVWFG-LBPRGKRZSA-N 0 0 380.388 3.132 20 5 GGBDRN CCOC(=O)[C@]1(C)CCC[C@@H]1NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000600110852 566315742 /nfs/dbraw/zinc/31/57/42/566315742.db2.gz XAUKZUOMJPPRSG-BLLLJJGKSA-N 0 0 399.241 3.209 20 5 GGBDRN Cc1nc(CN(C)S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])cs1 ZINC000462528230 566316798 /nfs/dbraw/zinc/31/67/98/566316798.db2.gz LRCALAXTUBRDHN-UHFFFAOYSA-N 0 0 396.277 3.487 20 5 GGBDRN CCC[C@H](C)C(=O)NCCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482598487 566319119 /nfs/dbraw/zinc/31/91/19/566319119.db2.gz AZADNAIDUJCDLI-NSHDSACASA-N 0 0 387.889 3.009 20 5 GGBDRN Cc1cc(Br)c(O)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000482579434 566319892 /nfs/dbraw/zinc/31/98/92/566319892.db2.gz NXMVIOWIZPTPHD-UHFFFAOYSA-N 0 0 394.225 3.446 20 5 GGBDRN Cc1cc(CN2CC(Oc3ccc([N+](=O)[O-])cc3)C2)ncc1Br ZINC000600165449 566320187 /nfs/dbraw/zinc/32/01/87/566320187.db2.gz PZNDROLNKYVTJU-UHFFFAOYSA-N 0 0 378.226 3.324 20 5 GGBDRN CN(CCC(F)(F)F)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462548525 566322468 /nfs/dbraw/zinc/32/24/68/566322468.db2.gz JQHBPMSHKQYMBC-UHFFFAOYSA-N 0 0 381.159 3.475 20 5 GGBDRN CCc1cccnc1NC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000535745618 566324526 /nfs/dbraw/zinc/32/45/26/566324526.db2.gz XJLUVILGZLSQCY-UHFFFAOYSA-N 0 0 397.172 3.409 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H](Sc2ccc(Br)cc2)C1 ZINC000600214630 566324817 /nfs/dbraw/zinc/32/48/17/566324817.db2.gz CRNHYVZCJQRSOA-NSHDSACASA-N 0 0 397.254 3.087 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2ccc(N(C)C)nc2)cc1[N+](=O)[O-] ZINC000509667163 566326340 /nfs/dbraw/zinc/32/63/40/566326340.db2.gz YWFZGGLQSJHCLY-UHFFFAOYSA-N 0 0 393.241 3.057 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC=C(c2ccccc2Cl)CC1 ZINC000535783543 566326477 /nfs/dbraw/zinc/32/64/77/566326477.db2.gz BKJQLYBWVPPBSJ-UHFFFAOYSA-N 0 0 379.825 3.121 20 5 GGBDRN NS(=O)(=O)c1ccc(OCc2cccc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000446071794 566327819 /nfs/dbraw/zinc/32/78/19/566327819.db2.gz RLUMRSMIBGJOHM-UHFFFAOYSA-N 0 0 377.205 3.128 20 5 GGBDRN CN(Cc1c(F)cccc1Cl)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000535798491 566328037 /nfs/dbraw/zinc/32/80/37/566328037.db2.gz KEQDQYYGUFMRGX-UHFFFAOYSA-N 0 0 378.834 3.489 20 5 GGBDRN COc1ccccc1C1(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000535796325 566328412 /nfs/dbraw/zinc/32/84/12/566328412.db2.gz VYMCKYMCXOSFRU-UHFFFAOYSA-N 0 0 382.463 3.212 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000509683313 566328417 /nfs/dbraw/zinc/32/84/17/566328417.db2.gz ZLVPFGFCYMOCJB-CYBMUJFWSA-N 0 0 391.221 3.399 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000462595334 566329629 /nfs/dbraw/zinc/32/96/29/566329629.db2.gz TVMJZZWNNULXED-UHFFFAOYSA-N 0 0 382.463 3.197 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1Br ZINC000576262312 566330703 /nfs/dbraw/zinc/33/07/03/566330703.db2.gz CDRKBYUHSIQTPN-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccncc1Br ZINC000462616915 566333920 /nfs/dbraw/zinc/33/39/20/566333920.db2.gz QBKZMAJYVOWXDE-LBPRGKRZSA-N 0 0 378.226 3.382 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H]2CCOc3c(Cl)cccc32)c([N+](=O)[O-])c1 ZINC000509774603 566336349 /nfs/dbraw/zinc/33/63/49/566336349.db2.gz DIAARECKCVTJPC-ZDUSSCGKSA-N 0 0 382.825 3.359 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N(CC(F)(F)F)[C@@H]1CCCOC1 ZINC000446212827 566336605 /nfs/dbraw/zinc/33/66/05/566336605.db2.gz YXSTVJQDCDQHML-GFCCVEGCSA-N 0 0 378.372 3.257 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCC(C2CC2)C2CC2)c(C(F)(F)F)c1 ZINC000576336981 566336832 /nfs/dbraw/zinc/33/68/32/566336832.db2.gz CVPQVPOQXGFYIJ-UHFFFAOYSA-N 0 0 378.372 3.328 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000509782454 566337659 /nfs/dbraw/zinc/33/76/59/566337659.db2.gz SVDZRMWXONNXBR-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C)c1cccc(Cl)c1 ZINC000462671928 566338238 /nfs/dbraw/zinc/33/82/38/566338238.db2.gz BWODSUZVEMZGNR-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN Cc1cccc(OC[C@@H](O)COc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000535912746 566338242 /nfs/dbraw/zinc/33/82/42/566338242.db2.gz BYKPCSKNUSOWOV-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN CCO[C@H]1C[C@@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C12CCCC2 ZINC000462662820 566338537 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Cc1cc(S(=O)(=O)NC[C@H](C)Oc2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000462702285 566342837 /nfs/dbraw/zinc/34/28/37/566342837.db2.gz JKJMXOKSYUDTKI-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN NC(=O)CSc1nnc(Sc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)s1 ZINC000535989150 566343658 /nfs/dbraw/zinc/34/36/58/566343658.db2.gz SAIRFIZLMRKKOX-UHFFFAOYSA-N 0 0 396.397 3.194 20 5 GGBDRN O=C(NC[C@H](CO)C1CCCCC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000509865135 566344119 /nfs/dbraw/zinc/34/41/19/566344119.db2.gz RJUYMJOHROWQJG-CYBMUJFWSA-N 0 0 385.258 3.276 20 5 GGBDRN CC(C)(C)CNC(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000600533562 566344184 /nfs/dbraw/zinc/34/41/84/566344184.db2.gz KTZXGPFYOUNLCF-UHFFFAOYSA-N 0 0 396.241 3.447 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H](C)Oc1ccccc1Cl ZINC000462707534 566344574 /nfs/dbraw/zinc/34/45/74/566344574.db2.gz FOMCZBCPJUXBAH-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCN(Cc3ccsc3)CC2)c(Br)c1 ZINC000536021891 566344592 /nfs/dbraw/zinc/34/45/92/566344592.db2.gz OGJWHVHPJIQWIH-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN COc1cc(CS(=O)(=O)c2cccs2)c([N+](=O)[O-])cc1OCC(F)F ZINC000600529923 566344740 /nfs/dbraw/zinc/34/47/40/566344740.db2.gz OSCXZHLAXMICDZ-UHFFFAOYSA-N 0 0 393.389 3.283 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H](C)Oc1cccc(Cl)c1 ZINC000462705324 566344901 /nfs/dbraw/zinc/34/49/01/566344901.db2.gz PHKWKZKSKVVLCO-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1ccccc1O[C@@H](C)CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000462702734 566345034 /nfs/dbraw/zinc/34/50/34/566345034.db2.gz IFJSITSWSVYBRK-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])Oc1cccc(F)c1 ZINC000462711432 566345856 /nfs/dbraw/zinc/34/58/56/566345856.db2.gz JKMURLZZGQQCCX-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN Cn1ncc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1C(F)(F)F ZINC000446366374 566345867 /nfs/dbraw/zinc/34/58/67/566345867.db2.gz IQSSIPAWBXMZLA-UHFFFAOYSA-N 0 0 393.119 3.362 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])Oc1ccc(F)cc1 ZINC000462709585 566345982 /nfs/dbraw/zinc/34/59/82/566345982.db2.gz YQDLJPCSGGVXNR-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](C)Oc1cccc(Cl)c1 ZINC000462713219 566346283 /nfs/dbraw/zinc/34/62/83/566346283.db2.gz ZKWBZTPQWPBXAK-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Br)cn1 ZINC000482976392 566346875 /nfs/dbraw/zinc/34/68/75/566346875.db2.gz HRHBCCAFJUVNAL-SECBINFHSA-N 0 0 376.214 3.479 20 5 GGBDRN Cc1ccccc1O[C@@H](C)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000462716987 566347360 /nfs/dbraw/zinc/34/73/60/566347360.db2.gz GOBZHNAVCFWRCK-LBPRGKRZSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(CCO)Cc1ccc(Br)s1 ZINC000482975400 566347683 /nfs/dbraw/zinc/34/76/83/566347683.db2.gz INVUEVXDOGJQMK-UHFFFAOYSA-N 0 0 399.266 3.362 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N(CCO)Cc1ccc(Br)s1 ZINC000482974214 566347765 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Cn1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc(Br)c1=O ZINC000446495522 566352181 /nfs/dbraw/zinc/35/21/81/566352181.db2.gz BDPPFVROWHTKAN-UHFFFAOYSA-N 0 0 392.165 3.055 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1-c1nc(C2(c3ccccc3Br)CC2)no1 ZINC000576503999 566352386 /nfs/dbraw/zinc/35/23/86/566352386.db2.gz SQZCGRVLZNMUJV-UHFFFAOYSA-N 0 0 390.197 3.221 20 5 GGBDRN Cc1nn(C)c(C)c1CNc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000462789053 566352798 /nfs/dbraw/zinc/35/27/98/566352798.db2.gz DFGRXHYQXSXOGP-UHFFFAOYSA-N 0 0 390.241 3.290 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1cc(Cl)sc1Cl ZINC000536129901 566353042 /nfs/dbraw/zinc/35/30/42/566353042.db2.gz FOBLQCVMMWAGSP-UHFFFAOYSA-N 0 0 397.261 3.450 20 5 GGBDRN O=C(N[C@H](c1cc(F)cc(Br)c1)C1CC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000556980041 566353378 /nfs/dbraw/zinc/35/33/78/566353378.db2.gz JYIQHHRGSGXOQQ-ZDUSSCGKSA-N 0 0 383.177 3.101 20 5 GGBDRN CN(CCc1cccc(Br)c1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000462840479 566358308 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GGBDRN C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000446739232 566364751 /nfs/dbraw/zinc/36/47/51/566364751.db2.gz RVAMZNCKHQHOCL-GWCFXTLKSA-N 0 0 385.251 3.078 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H](COC(F)F)C1 ZINC000557126811 566365383 /nfs/dbraw/zinc/36/53/83/566365383.db2.gz XVWVOIYHQXJAFC-NXEZZACHSA-N 0 0 378.759 3.103 20 5 GGBDRN Cc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1Br ZINC000536354819 566367919 /nfs/dbraw/zinc/36/79/19/566367919.db2.gz PMKCCTHXZSBROV-UHFFFAOYSA-N 0 0 375.182 3.216 20 5 GGBDRN Cc1ccccc1[C@H]1C(=O)NCCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000600842804 566369299 /nfs/dbraw/zinc/36/92/99/566369299.db2.gz ROWUUJSKOXDZOF-INIZCTEOSA-N 0 0 390.237 3.343 20 5 GGBDRN CO[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000462958077 566370337 /nfs/dbraw/zinc/37/03/37/566370337.db2.gz OGDLHPFWTHNPTN-INIZCTEOSA-N 0 0 384.841 3.451 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)c(C)cc1Br ZINC000557168452 566370403 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CN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446953014 566373643 /nfs/dbraw/zinc/37/36/43/566373643.db2.gz WQLWGNCUUHVPTI-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN Cc1cc(CCNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)on1 ZINC000483338402 566374441 /nfs/dbraw/zinc/37/44/41/566374441.db2.gz UYOPHOFXSVWZTP-UHFFFAOYSA-N 0 0 383.202 3.326 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3ccccc32)c(Br)c1 ZINC000446969954 566375080 /nfs/dbraw/zinc/37/50/80/566375080.db2.gz SWYUNYQRYONCOI-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCc3ccccc32)c(Br)c1 ZINC000446961030 566375686 /nfs/dbraw/zinc/37/56/86/566375686.db2.gz TYZZVMQPQUVOQB-CQSZACIVSA-N 0 0 397.250 3.323 20 5 GGBDRN COC(=O)CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ncc(C)s1 ZINC000536468540 566376146 /nfs/dbraw/zinc/37/61/46/566376146.db2.gz PYHJPWCSSXIYNG-UHFFFAOYSA-N 0 0 381.435 3.267 20 5 GGBDRN C[C@@H](Sc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@H](C)O ZINC000463027632 566376962 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Cc1c(Cl)cc(S(=O)(=O)N2CC[C@H](c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000601457123 566406254 /nfs/dbraw/zinc/40/62/54/566406254.db2.gz JTCWGNIFUMZBDJ-ZDUSSCGKSA-N 0 0 381.841 3.130 20 5 GGBDRN NC(=O)c1ccc(N2CCc3ccc(Br)cc3C2)c([N+](=O)[O-])c1 ZINC000557672303 566406318 /nfs/dbraw/zinc/40/63/18/566406318.db2.gz HSPFOSIZKVTPBK-UHFFFAOYSA-N 0 0 376.210 3.019 20 5 GGBDRN NC(=O)c1cccc(N[C@@H]2C[C@H]2c2ccc(Br)s2)c1[N+](=O)[O-] ZINC000557670985 566406398 /nfs/dbraw/zinc/40/63/98/566406398.db2.gz JRVJTRMTCGBWBD-PSASIEDQSA-N 0 0 382.239 3.486 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@@H](c2ccncc2)C1 ZINC000601450227 566406745 /nfs/dbraw/zinc/40/67/45/566406745.db2.gz NWPJZENPVPWLIO-CYBMUJFWSA-N 0 0 381.841 3.212 20 5 GGBDRN O=C1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C2(CCC2)C1 ZINC000601444817 566406812 /nfs/dbraw/zinc/40/68/12/566406812.db2.gz YUIMYRMOJSOYNW-UHFFFAOYSA-N 0 0 393.248 3.178 20 5 GGBDRN COCCCOc1ccc(CNc2c(Br)cncc2[N+](=O)[O-])cc1 ZINC000557697836 566409734 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GGBDRN Cc1c(Br)c(NCc2ccc(OC(F)F)cn2)ncc1[N+](=O)[O-] ZINC000447694200 566423615 /nfs/dbraw/zinc/42/36/15/566423615.db2.gz PWHVANUEPDNDGN-UHFFFAOYSA-N 0 0 389.156 3.091 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@@H](C)c2cnc(C)s2)cc1[N+](=O)[O-] ZINC000601772696 566424006 /nfs/dbraw/zinc/42/40/06/566424006.db2.gz LAIDUCLXTBYSGM-JTQLQIEISA-N 0 0 381.479 3.479 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@H](O)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000447719880 566424750 /nfs/dbraw/zinc/42/47/50/566424750.db2.gz PWSFJUHDQKLZNP-CYBMUJFWSA-N 0 0 391.221 3.230 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](CO)Cc1ccc(Br)cc1 ZINC000577318019 566424829 /nfs/dbraw/zinc/42/48/29/566424829.db2.gz UCLLDONUHQVLRY-CYBMUJFWSA-N 0 0 397.273 3.145 20 5 GGBDRN CC1(C)Cc2c(cccc2Br)[C@@H]1NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000557828338 566425488 /nfs/dbraw/zinc/42/54/88/566425488.db2.gz YXNWWDRYBLFLQL-ZDUSSCGKSA-N 0 0 379.214 3.134 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2ccc(Cl)s2)c2ncccc12 ZINC000463676542 566426510 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387.177 3.383 20 5 GGBDRN O=C(c1ccsc1Br)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000449889087 566613592 /nfs/dbraw/zinc/61/35/92/566613592.db2.gz RLRIFEKKYDMCTF-VIFPVBQESA-N 0 0 397.254 3.140 20 5 GGBDRN Cc1cc(Br)cc2c1CN(c1cccc(C(N)=O)c1[N+](=O)[O-])CC2 ZINC000579507824 566614503 /nfs/dbraw/zinc/61/45/03/566614503.db2.gz KPPNEWIZIUWOMW-UHFFFAOYSA-N 0 0 390.237 3.327 20 5 GGBDRN Cc1cc(N2CC[C@H]3[C@@H](C2)NC(=O)N3C(C)C)c(Br)cc1[N+](=O)[O-] ZINC000560341150 566617429 /nfs/dbraw/zinc/61/74/29/566617429.db2.gz SXTHCMRMFWQLBP-OLZOCXBDSA-N 0 0 397.273 3.047 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ccccc2OCC2CC2)cc1[N+](=O)[O-] ZINC000467042599 566619574 /nfs/dbraw/zinc/61/95/74/566619574.db2.gz ANKVUTIUADSCDH-UHFFFAOYSA-N 0 0 382.463 3.232 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](CO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000539983594 566619922 /nfs/dbraw/zinc/61/99/22/566619922.db2.gz JHMCCORUDGNKLS-AWEZNQCLSA-N 0 0 385.258 3.337 20 5 GGBDRN Cc1ccccc1[C@H](CO)NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000539985280 566620090 /nfs/dbraw/zinc/62/00/90/566620090.db2.gz BOBDSDXRNLNOIR-HNNXBMFYSA-N 0 0 393.237 3.438 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000467056299 566621079 /nfs/dbraw/zinc/62/10/79/566621079.db2.gz BGPYOXWEVZYMOM-NHYWBVRUSA-N 0 0 382.463 3.115 20 5 GGBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467049672 566621668 /nfs/dbraw/zinc/62/16/68/566621668.db2.gz VKTLPBYIKHBMFC-VFZGTOFNSA-N 0 0 388.442 3.158 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000467062953 566622155 /nfs/dbraw/zinc/62/21/55/566622155.db2.gz HOAWCWACVAEDFU-TVQRCGJNSA-N 0 0 388.492 3.177 20 5 GGBDRN CO[C@H](c1ccccc1F)[C@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467064287 566622470 /nfs/dbraw/zinc/62/24/70/566622470.db2.gz UWZWEELVUHLMCO-VFZGTOFNSA-N 0 0 388.442 3.158 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC[C@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000467069730 566622627 /nfs/dbraw/zinc/62/26/27/566622627.db2.gz 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CC(C)CN(C(C)C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488692658 566740766 /nfs/dbraw/zinc/74/07/66/566740766.db2.gz CUDAAZGHYKUBOM-UHFFFAOYSA-N 0 0 379.276 3.412 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCCCc1nc(C)cs1 ZINC000608913743 566742046 /nfs/dbraw/zinc/74/20/46/566742046.db2.gz RUUDNSDCWPZYTA-UHFFFAOYSA-N 0 0 383.495 3.223 20 5 GGBDRN O=C(NCc1cc(F)ccc1Br)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000516005073 566742203 /nfs/dbraw/zinc/74/22/03/566742203.db2.gz SQNDGWSTGZLYLO-UHFFFAOYSA-N 0 0 393.172 3.303 20 5 GGBDRN COc1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c(Br)c1 ZINC000608901000 566742202 /nfs/dbraw/zinc/74/22/02/566742202.db2.gz QLXCNEAEWIGHCR-UHFFFAOYSA-N 0 0 397.229 3.208 20 5 GGBDRN C[C@@H](c1ncc(Br)cn1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000561849178 566743222 /nfs/dbraw/zinc/74/32/22/566743222.db2.gz FLGBIOLBEHCOBD-LBPRGKRZSA-N 0 0 392.257 3.031 20 5 GGBDRN COC(=O)[C@H]1CCN(c2ncc([N+](=O)[O-])c(C)c2Br)[C@H]1C(C)C ZINC000488715245 566743229 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Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(Cc2ccncn2)no1 ZINC000516213597 566753659 /nfs/dbraw/zinc/75/36/59/566753659.db2.gz ZSKJIHRHYQIXLV-UHFFFAOYSA-N 0 0 376.170 3.097 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCc2nc(C(C)(C)C)cs2)cc1[N+](=O)[O-] ZINC000609199073 566754481 /nfs/dbraw/zinc/75/44/81/566754481.db2.gz VBSPBPWRWGKPGD-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN CN(Cc1ccc(Br)c(F)c1)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000427179127 566754985 /nfs/dbraw/zinc/75/49/85/566754985.db2.gz RZXCDROTQFRPCR-UHFFFAOYSA-N 0 0 399.220 3.087 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc3cccc(Br)c3n2)c1[N+](=O)[O-] ZINC000562001978 566755679 /nfs/dbraw/zinc/75/56/79/566755679.db2.gz RVQUNIIXBWILFG-UHFFFAOYSA-N 0 0 390.197 3.200 20 5 GGBDRN CC[C@H]1CN(C)CCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000562002626 566756143 /nfs/dbraw/zinc/75/61/43/566756143.db2.gz IHYGRXCDHHHHKX-NSHDSACASA-N 0 0 396.296 3.006 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000541854789 566756204 /nfs/dbraw/zinc/75/62/04/566756204.db2.gz JWHUBNRMWREBDM-AAEUAGOBSA-N 0 0 376.210 3.225 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000541854791 566756636 /nfs/dbraw/zinc/75/66/36/566756636.db2.gz JWHUBNRMWREBDM-WCQYABFASA-N 0 0 376.210 3.225 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](C)Sc2ccccc21 ZINC000469050997 566756682 /nfs/dbraw/zinc/75/66/82/566756682.db2.gz TVOJJQDFLGABNN-NSHDSACASA-N 0 0 380.447 3.293 20 5 GGBDRN CN(CCc1ccc(Br)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000609315080 566757857 /nfs/dbraw/zinc/75/78/57/566757857.db2.gz QGCYPYMFXHQPBY-UHFFFAOYSA-N 0 0 399.266 3.221 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000609315508 566757895 /nfs/dbraw/zinc/75/78/95/566757895.db2.gz BWJQCONJBBGKLU-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1Br ZINC000609316474 566758034 /nfs/dbraw/zinc/75/80/34/566758034.db2.gz HCGPAQIVOZBPMO-UHFFFAOYSA-N 0 0 381.230 3.176 20 5 GGBDRN CC[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000488937854 566759046 /nfs/dbraw/zinc/75/90/46/566759046.db2.gz JOESBEASZQIHQF-SNVBAGLBSA-N 0 0 377.260 3.168 20 5 GGBDRN CCOc1c(Cl)cc(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)cc1Cl ZINC000469074254 566759081 /nfs/dbraw/zinc/75/90/81/566759081.db2.gz SODVMLFSVMLRKL-UHFFFAOYSA-N 0 0 386.191 3.101 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCc1ccc(Br)cc1 ZINC000609322245 566759138 /nfs/dbraw/zinc/75/91/38/566759138.db2.gz YDDQNGCFOMIZMP-UHFFFAOYSA-N 0 0 378.226 3.476 20 5 GGBDRN O=C(NCCCOc1ccc(Cl)cc1Cl)Nc1ccncc1[N+](=O)[O-] ZINC000541925121 566759438 /nfs/dbraw/zinc/75/94/38/566759438.db2.gz UGPCBDIEHZFFBG-UHFFFAOYSA-N 0 0 385.207 3.309 20 5 GGBDRN CCn1cc(S(=O)(=O)N(CC(C)C)c2cccc(Cl)c2)c([N+](=O)[O-])n1 ZINC000451111957 566759506 /nfs/dbraw/zinc/75/95/06/566759506.db2.gz ICQUKGHRZAUBFS-UHFFFAOYSA-N 0 0 386.861 3.316 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCCc2sccc2C1 ZINC000609342390 566759718 /nfs/dbraw/zinc/75/97/18/566759718.db2.gz ZZIXCLVPZCPTHK-UHFFFAOYSA-N 0 0 379.825 3.223 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])N(C)c1ccccc1 ZINC000516341929 566760097 /nfs/dbraw/zinc/76/00/97/566760097.db2.gz GZTKOCFXWCXHMB-LBPRGKRZSA-N 0 0 383.857 3.051 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N[C@H](CO)c3ccc(Br)cc3)ccc2c1 ZINC000488993568 566762036 /nfs/dbraw/zinc/76/20/36/566762036.db2.gz CDLCKXHEKXCMDT-MRXNPFEDSA-N 0 0 388.221 3.473 20 5 GGBDRN CSc1ccc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000609391446 566762040 /nfs/dbraw/zinc/76/20/40/566762040.db2.gz MPRCLUJANSNCLZ-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN CN(Cc1ccc(Br)s1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000516431143 566763264 /nfs/dbraw/zinc/76/32/64/566763264.db2.gz LPNHDFRKJIPYLJ-UHFFFAOYSA-N 0 0 388.218 3.412 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)c1ccc(F)c(Br)c1 ZINC000609393429 566763497 /nfs/dbraw/zinc/76/34/97/566763497.db2.gz UMPZCBBVGZTRCB-SSDOTTSWSA-N 0 0 384.161 3.088 20 5 GGBDRN CC(C)(C(=O)NCCCc1cccc(Br)c1)n1cc([N+](=O)[O-])cn1 ZINC000609410688 566763568 /nfs/dbraw/zinc/76/35/68/566763568.db2.gz VISVTBBBHJFVOE-UHFFFAOYSA-N 0 0 395.257 3.038 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCCc1cccc(Br)c1 ZINC000609410299 566763613 /nfs/dbraw/zinc/76/36/13/566763613.db2.gz LJGICJKGLCBCQM-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCCc1cccc(Br)c1 ZINC000609410222 566763944 /nfs/dbraw/zinc/76/39/44/566763944.db2.gz DATNIJDYRRFNNE-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(C)c1 ZINC000609418817 566764081 /nfs/dbraw/zinc/76/40/81/566764081.db2.gz WANKYNJMCAVRFO-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000609418165 566764182 /nfs/dbraw/zinc/76/41/82/566764182.db2.gz UCGGTUPJHUISHU-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000609442179 566764956 /nfs/dbraw/zinc/76/49/56/566764956.db2.gz CHDALFKIPJADJL-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCc1ccc(Cl)s1 ZINC000562126279 566765226 /nfs/dbraw/zinc/76/52/26/566765226.db2.gz XGHIAMMAGPXJQR-UHFFFAOYSA-N 0 0 381.841 3.170 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cccc(Br)c3F)CC2)cn1 ZINC000581290835 566765262 /nfs/dbraw/zinc/76/52/62/566765262.db2.gz IVFDWSVLLKBEBV-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2COc3ccc(Br)cc32)cc1[N+](=O)[O-] ZINC000542003006 566767273 /nfs/dbraw/zinc/76/72/73/566767273.db2.gz NKFSHOYKLATGQO-GFCCVEGCSA-N 0 0 393.193 3.481 20 5 GGBDRN O=C(Cn1cc(Br)cn1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000541997268 566767596 /nfs/dbraw/zinc/76/75/96/566767596.db2.gz GZEMOWFOLMCQQF-UHFFFAOYSA-N 0 0 393.119 3.211 20 5 GGBDRN Nc1c(C(=O)NCc2cc(F)ccc2Br)cc(F)cc1[N+](=O)[O-] ZINC000516539844 566767945 /nfs/dbraw/zinc/76/79/45/566767945.db2.gz SWNVSWXJHNZKAT-UHFFFAOYSA-N 0 0 386.152 3.148 20 5 GGBDRN Cc1cc(Br)ccc1CNC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000609505873 566768180 /nfs/dbraw/zinc/76/81/80/566768180.db2.gz OZXAVSMPOVWESX-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN CN1C(=O)COc2cc(Nc3ccc([N+](=O)[O-])cc3Br)ccc21 ZINC000542007877 566768398 /nfs/dbraw/zinc/76/83/98/566768398.db2.gz BXKMRONABVFYJT-UHFFFAOYSA-N 0 0 378.182 3.456 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2Br)C1)c1cccc([N+](=O)[O-])c1 ZINC000609508986 566768467 /nfs/dbraw/zinc/76/84/67/566768467.db2.gz CFIRLDJZOOWBBG-ZDUSSCGKSA-N 0 0 390.237 3.366 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N(CCO)Cc1cccc(Br)c1 ZINC000489106123 566769809 /nfs/dbraw/zinc/76/98/09/566769809.db2.gz VDAOKUNEPJZXLL-UHFFFAOYSA-N 0 0 397.200 3.131 20 5 GGBDRN Cc1cc(Br)ccc1CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000609542656 566769846 /nfs/dbraw/zinc/76/98/46/566769846.db2.gz UKPPBNVMPDVBJN-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccc(Br)cc2C)cc1[N+](=O)[O-] ZINC000609542406 566770081 /nfs/dbraw/zinc/77/00/81/566770081.db2.gz FVOSTCAVHINNMB-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCc1cc(Cl)sc1Cl ZINC000542042607 566770693 /nfs/dbraw/zinc/77/06/93/566770693.db2.gz IOMWSKPYAIUNPA-UHFFFAOYSA-N 0 0 382.250 3.223 20 5 GGBDRN O=c1oc2cc(Br)ccc2n1CCOc1cccc([N+](=O)[O-])c1 ZINC000542049898 566771895 /nfs/dbraw/zinc/77/18/95/566771895.db2.gz CXYXULTWHUDWTO-UHFFFAOYSA-N 0 0 379.166 3.344 20 5 GGBDRN CCc1n[nH]c(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1Br ZINC000469204035 566772007 /nfs/dbraw/zinc/77/20/07/566772007.db2.gz FBQJLKUBWMRZMD-UHFFFAOYSA-N 0 0 393.241 3.448 20 5 GGBDRN Cc1noc(CSCc2cc(I)cc([N+](=O)[O-])c2)n1 ZINC000562234212 566772204 /nfs/dbraw/zinc/77/22/04/566772204.db2.gz NXVVIHISNBHKRU-UHFFFAOYSA-N 0 0 391.190 3.324 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3csc(Br)c3C)n2)n1C ZINC000581396147 566773472 /nfs/dbraw/zinc/77/34/72/566773472.db2.gz OQMDFOZYXOLDKK-UHFFFAOYSA-N 0 0 384.215 3.486 20 5 GGBDRN CCOc1ccc2[nH]c(Sc3sc(S(C)(=O)=O)cc3[N+](=O)[O-])nc2c1 ZINC000542103919 566775017 /nfs/dbraw/zinc/77/50/17/566775017.db2.gz RIGQEBOMVCQPKT-UHFFFAOYSA-N 0 0 399.475 3.486 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Sc2nccn2Cc2ccccc2)s1 ZINC000542102861 566775819 /nfs/dbraw/zinc/77/58/19/566775819.db2.gz RXIHWVKYCISFGU-UHFFFAOYSA-N 0 0 395.487 3.456 20 5 GGBDRN CC(C)(C)OC(=O)CCC(C)(C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000542123837 566776939 /nfs/dbraw/zinc/77/69/39/566776939.db2.gz SDMRZMKAJPYJEW-UHFFFAOYSA-N 0 0 392.499 3.372 20 5 GGBDRN CCN(Cc1ccccc1Br)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000542134943 566777207 /nfs/dbraw/zinc/77/72/07/566777207.db2.gz BYDYJGLXXCPQQP-UHFFFAOYSA-N 0 0 378.226 3.483 20 5 GGBDRN COC(=O)c1cc(Br)cc(C(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000562274073 566777415 /nfs/dbraw/zinc/77/74/15/566777415.db2.gz WYXZMMGFXRTZQV-UHFFFAOYSA-N 0 0 393.193 3.074 20 5 GGBDRN CC(=O)c1cccc(N(Cc2c(Cl)cccc2[N+](=O)[O-])S(C)(=O)=O)c1 ZINC000489267838 566778364 /nfs/dbraw/zinc/77/83/64/566778364.db2.gz LUBRNHDTQAENIB-UHFFFAOYSA-N 0 0 382.825 3.417 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1cc(O)ccc1Br)CCO2 ZINC000516693661 566779095 /nfs/dbraw/zinc/77/90/95/566779095.db2.gz YCLXEBAFNOPECF-UHFFFAOYSA-N 0 0 379.210 3.458 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1Br ZINC000469297382 566779338 /nfs/dbraw/zinc/77/93/38/566779338.db2.gz OIOVRLBFWKXWJH-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(Br)cc1O ZINC000516754173 566779709 /nfs/dbraw/zinc/77/97/09/566779709.db2.gz URRRDNBGFXRULM-UHFFFAOYSA-N 0 0 381.182 3.471 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2cc(Br)cs2)ccc1[N+](=O)[O-] ZINC000609673830 566780762 /nfs/dbraw/zinc/78/07/62/566780762.db2.gz XMWJELXJKDQQDH-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1cccc(Cl)c1 ZINC000516755929 566781523 /nfs/dbraw/zinc/78/15/23/566781523.db2.gz OQFPIHGBQBVONW-UHFFFAOYSA-N 0 0 382.825 3.318 20 5 GGBDRN CC[C@H](Cc1ccc(Cl)cc1)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000609704719 566781658 /nfs/dbraw/zinc/78/16/58/566781658.db2.gz BGYFCQNTYOKWRW-CYBMUJFWSA-N 0 0 383.857 3.329 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N(CCO)Cc1cccc(F)c1 ZINC000427587812 566782037 /nfs/dbraw/zinc/78/20/37/566782037.db2.gz KXVAEFCSJPHPEE-UHFFFAOYSA-N 0 0 397.200 3.131 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NC1(c2nccs2)CCCC1 ZINC000609708677 566781998 /nfs/dbraw/zinc/78/19/98/566781998.db2.gz PLFRNMJIGIJADO-UHFFFAOYSA-N 0 0 387.870 3.453 20 5 GGBDRN CC1(C)[C@H](C(F)(F)F)CCN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000469332205 566782118 /nfs/dbraw/zinc/78/21/18/566782118.db2.gz LRROHFNUAUMKQU-CYBMUJFWSA-N 0 0 380.388 3.130 20 5 GGBDRN O=[N+]([O-])c1cncc(I)c1N1CCC[C@H]1c1ccccn1 ZINC000581478624 566782056 /nfs/dbraw/zinc/78/20/56/566782056.db2.gz ITGWTJFDBOIRPV-LBPRGKRZSA-N 0 0 396.188 3.331 20 5 GGBDRN CCN(C(=O)c1ccc([N+](=O)[O-])cc1OC)c1ccc(Br)cn1 ZINC000427608350 566782825 /nfs/dbraw/zinc/78/28/25/566782825.db2.gz XXNIBNMUDXVGMV-UHFFFAOYSA-N 0 0 380.198 3.428 20 5 GGBDRN COc1ccc(Cl)cc1N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000469337714 566782868 /nfs/dbraw/zinc/78/28/68/566782868.db2.gz QUSSGQQBHMXEJY-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCc2ccc(O)cc2C1 ZINC000427618548 566782959 /nfs/dbraw/zinc/78/29/59/566782959.db2.gz QKESHHWLTMOJCE-UHFFFAOYSA-N 0 0 377.194 3.261 20 5 GGBDRN CC1(C)CN(c2ccc(I)cc2[N+](=O)[O-])CCCO1 ZINC000609765015 566783603 /nfs/dbraw/zinc/78/36/03/566783603.db2.gz GMORWIUVQVFABF-UHFFFAOYSA-N 0 0 376.194 3.205 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@@H]2c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000516805926 566783839 /nfs/dbraw/zinc/78/38/39/566783839.db2.gz FHIGZEZWDGMDNQ-CYBMUJFWSA-N 0 0 391.225 3.312 20 5 GGBDRN CCc1ccccc1NC(=O)Cn1cc([N+](=O)[O-])c(C)c(Br)c1=O ZINC000542219335 566783998 /nfs/dbraw/zinc/78/39/98/566783998.db2.gz OJIDJGSWBANDHX-UHFFFAOYSA-N 0 0 394.225 3.029 20 5 GGBDRN Cc1nc2ccccc2nc1Cn1cc([N+](=O)[O-])c(C)c(Br)c1=O ZINC000542219785 566784249 /nfs/dbraw/zinc/78/42/49/566784249.db2.gz ULIDZOYRCMWYGP-UHFFFAOYSA-N 0 0 389.209 3.127 20 5 GGBDRN COC(=O)C1(N(C)C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000542231107 566784634 /nfs/dbraw/zinc/78/46/34/566784634.db2.gz OQYYATPWHWDIKB-UHFFFAOYSA-N 0 0 386.857 3.285 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCS[C@@H](c2ccccc2)C1 ZINC000609802086 566786397 /nfs/dbraw/zinc/78/63/97/566786397.db2.gz JNBQOVMJWKVGOD-MRXNPFEDSA-N 0 0 378.475 3.382 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N1CCS[C@@H](c2ccccc2)C1 ZINC000609802029 566786726 /nfs/dbraw/zinc/78/67/26/566786726.db2.gz GPJGSFHXEJPQNI-OAHLLOKOSA-N 0 0 382.438 3.213 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(F)c(Br)c1 ZINC000542259780 566787993 /nfs/dbraw/zinc/78/79/93/566787993.db2.gz PDEQQTLGRPHFBR-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000609824732 566788532 /nfs/dbraw/zinc/78/85/32/566788532.db2.gz LPFQZNSABHJCEL-NHYWBVRUSA-N 0 0 390.889 3.368 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H]1CSc2ccccc21 ZINC000609813233 566788678 /nfs/dbraw/zinc/78/86/78/566788678.db2.gz SOXYGNSRKJDJCC-CYBMUJFWSA-N 0 0 377.809 3.150 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000609824729 566788727 /nfs/dbraw/zinc/78/87/27/566788727.db2.gz LPFQZNSABHJCEL-IAQYHMDHSA-N 0 0 390.889 3.368 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000609824727 566788975 /nfs/dbraw/zinc/78/89/75/566788975.db2.gz LPFQZNSABHJCEL-ABAIWWIYSA-N 0 0 390.889 3.368 20 5 GGBDRN C[C@@H]1C[C@@H](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000542273274 566789656 /nfs/dbraw/zinc/78/96/56/566789656.db2.gz CZOBIRQUMRAJPF-NEPJUHHUSA-N 0 0 385.258 3.221 20 5 GGBDRN NS(=O)(=O)c1cccc(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000581577871 566789735 /nfs/dbraw/zinc/78/97/35/566789735.db2.gz YVKXGAROZFJCEV-ZJUUUORDSA-N 0 0 381.376 3.023 20 5 GGBDRN COc1cc(Br)ccc1OC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000489459853 566789842 /nfs/dbraw/zinc/78/98/42/566789842.db2.gz USGGGXNBQCZUTC-ZDUSSCGKSA-N 0 0 398.209 3.185 20 5 GGBDRN O=C(NCc1cocn1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000609857214 566790018 /nfs/dbraw/zinc/79/00/18/566790018.db2.gz CHTZIUHEOJRLBW-UHFFFAOYSA-N 0 0 382.163 3.005 20 5 GGBDRN CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N(C)Cc1ccc(Cl)s1 ZINC000609840156 566790175 /nfs/dbraw/zinc/79/01/75/566790175.db2.gz CAWSQPVQHUZKJA-NSHDSACASA-N 0 0 385.877 3.201 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N=c1cc(-c2ccc(Cl)s2)[nH][nH]1 ZINC000427713516 566790447 /nfs/dbraw/zinc/79/04/47/566790447.db2.gz QBLMKPQSJJBKKI-UHFFFAOYSA-N 0 0 378.797 3.383 20 5 GGBDRN CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)Nc1ccc(Br)cc1 ZINC000609847017 566790530 /nfs/dbraw/zinc/79/05/30/566790530.db2.gz JNVYRRRDFSZUGE-LBPRGKRZSA-N 0 0 396.245 3.228 20 5 GGBDRN C[C@H]1Cc2cc(S(=O)(=O)NCc3cccc([N+](=O)[O-])c3)cc(Cl)c2O1 ZINC000609895989 566793663 /nfs/dbraw/zinc/79/36/63/566793663.db2.gz FQLCQVJQRFQXLJ-JTQLQIEISA-N 0 0 382.825 3.050 20 5 GGBDRN CCOC(=O)c1ccnc(Sc2nnc(-c3cccs3)o2)c1[N+](=O)[O-] ZINC000609960845 566797314 /nfs/dbraw/zinc/79/73/14/566797314.db2.gz UTVJBGCEMGLOJX-UHFFFAOYSA-N 0 0 378.391 3.429 20 5 GGBDRN Cn1c(=O)c(COc2ccc([N+](=O)[O-])cc2Br)nc2ccccc21 ZINC000609961709 566797342 /nfs/dbraw/zinc/79/73/42/566797342.db2.gz BOCVDFQAILLSOV-UHFFFAOYSA-N 0 0 390.193 3.183 20 5 GGBDRN Cc1ccn2c(=O)cc(COc3ccc([N+](=O)[O-])cc3Br)nc2c1 ZINC000609961754 566797734 /nfs/dbraw/zinc/79/77/34/566797734.db2.gz DCGXHJIWVRHLOD-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN COCCN(Cc1cc(Br)cs1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000427788847 566798402 /nfs/dbraw/zinc/79/84/02/566798402.db2.gz MCIRZFZBFGHIHN-UHFFFAOYSA-N 0 0 388.243 3.036 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000610006067 566799060 /nfs/dbraw/zinc/79/90/60/566799060.db2.gz XAPYSNJUSBBHBL-UHFFFAOYSA-N 0 0 384.841 3.470 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CN2CC(C(F)(F)F)C2)c1 ZINC000562535578 566799993 /nfs/dbraw/zinc/79/99/93/566799993.db2.gz ZPDCIUIBQZHFNA-UHFFFAOYSA-N 0 0 386.111 3.194 20 5 GGBDRN CCn1nc(C)c(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1C ZINC000610044050 566800062 /nfs/dbraw/zinc/80/00/62/566800062.db2.gz MFEORNHZZAHBPA-UHFFFAOYSA-N 0 0 381.230 3.121 20 5 GGBDRN CC(C)(C(=O)Nc1cc(Br)c[nH]c1=O)c1ccc([N+](=O)[O-])cc1 ZINC000610042201 566800292 /nfs/dbraw/zinc/80/02/92/566800292.db2.gz LBSCXIULJVYJRK-UHFFFAOYSA-N 0 0 380.198 3.374 20 5 GGBDRN COc1nc(C)cc(C)c1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000610044077 566800548 /nfs/dbraw/zinc/80/05/48/566800548.db2.gz POGIAZJWZCIFQX-UHFFFAOYSA-N 0 0 394.225 3.308 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1cccs1 ZINC000610043126 566800632 /nfs/dbraw/zinc/80/06/32/566800632.db2.gz GKYMVWVMRJRUHB-GFCCVEGCSA-N 0 0 399.222 3.063 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc(Br)cn2)c([N+](=O)[O-])c1 ZINC000610052153 566800649 /nfs/dbraw/zinc/80/06/49/566800649.db2.gz CKRHCRYDSOLEGO-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN Cc1noc2ncc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)cc12 ZINC000610063980 566802074 /nfs/dbraw/zinc/80/20/74/566802074.db2.gz UPSPWIHJALESTO-UHFFFAOYSA-N 0 0 377.154 3.454 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2cncc(Br)c2)c([N+](=O)[O-])c1 ZINC000610056289 566802406 /nfs/dbraw/zinc/80/24/06/566802406.db2.gz LVZZJTIXOQONNA-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2SCCN2S(=O)(=O)CC2CC(F)(F)C2)cc1 ZINC000451366506 566803627 /nfs/dbraw/zinc/80/36/27/566803627.db2.gz YHQUVDKFFQKJQA-ZDUSSCGKSA-N 0 0 378.422 3.017 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)CC2CC(F)(F)C2)cc1 ZINC000451366505 566804099 /nfs/dbraw/zinc/80/40/99/566804099.db2.gz YHQUVDKFFQKJQA-CYBMUJFWSA-N 0 0 378.422 3.017 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@H](CO)c1ccccc1Cl ZINC000489720174 566804781 /nfs/dbraw/zinc/80/47/81/566804781.db2.gz NSZICMPRIPKXCR-GFCCVEGCSA-N 0 0 383.231 3.336 20 5 GGBDRN C[C@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000581763517 566805916 /nfs/dbraw/zinc/80/59/16/566805916.db2.gz ACJCPRXXDDYJSO-JTQLQIEISA-N 0 0 382.825 3.394 20 5 GGBDRN CCOC(=O)c1cc(Nc2ncc([N+](=O)[O-])c(C)c2Br)cn1C ZINC000542506424 566807189 /nfs/dbraw/zinc/80/71/89/566807189.db2.gz DHZKCRWWZCWTOD-UHFFFAOYSA-N 0 0 383.202 3.320 20 5 GGBDRN Cc1c(Br)c(NCc2nncn2-c2ccccc2)ncc1[N+](=O)[O-] ZINC000542506845 566807249 /nfs/dbraw/zinc/80/72/49/566807249.db2.gz LXOPUJNBGBNXOY-UHFFFAOYSA-N 0 0 389.213 3.254 20 5 GGBDRN Cc1c(Br)c(N2CCN([C@@H](C)C(F)(F)F)CC2)ncc1[N+](=O)[O-] ZINC000542505616 566807271 /nfs/dbraw/zinc/80/72/71/566807271.db2.gz JRARTEAKVYZVQO-VIFPVBQESA-N 0 0 397.195 3.134 20 5 GGBDRN Cc1c(Br)c(N(C)Cc2ccc3c(c2)OCO3)ncc1[N+](=O)[O-] ZINC000542519314 566808279 /nfs/dbraw/zinc/80/82/79/566808279.db2.gz PQLNVCGNSOXWMA-UHFFFAOYSA-N 0 0 380.198 3.426 20 5 GGBDRN NS(=O)(=O)c1c(N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000610133820 566808775 /nfs/dbraw/zinc/80/87/75/566808775.db2.gz XVJJXKBFKHBHCF-QPUJVOFHSA-N 0 0 385.804 3.003 20 5 GGBDRN Cc1c(Br)c(N(C)C[C@H]2COc3ccccc3O2)ncc1[N+](=O)[O-] ZINC000542521287 566808747 /nfs/dbraw/zinc/80/87/47/566808747.db2.gz IUVKVIOJDZAGBO-NSHDSACASA-N 0 0 394.225 3.337 20 5 GGBDRN NS(=O)(=O)c1c(N[C@@H]2C[C@H]2c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000610133819 566809121 /nfs/dbraw/zinc/80/91/21/566809121.db2.gz XVJJXKBFKHBHCF-PRHODGIISA-N 0 0 385.804 3.003 20 5 GGBDRN CCOc1cc(Br)c(F)cc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000427993585 566809727 /nfs/dbraw/zinc/80/97/27/566809727.db2.gz OWZHJVJPNLYWJB-UHFFFAOYSA-N 0 0 399.176 3.125 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000610136649 566810409 /nfs/dbraw/zinc/81/04/09/566810409.db2.gz XDSQAKBMBWTIRQ-UONOGXRCSA-N 0 0 376.862 3.072 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1cccc(F)c1F ZINC000489774891 566810336 /nfs/dbraw/zinc/81/03/36/566810336.db2.gz XXEZKKRHBUDTFC-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000610158822 566811886 /nfs/dbraw/zinc/81/18/86/566811886.db2.gz POUUYFONBYHAOZ-UHFFFAOYSA-N 0 0 378.226 3.489 20 5 GGBDRN CCOC(=O)c1cc(Br)ccc1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000610176011 566812165 /nfs/dbraw/zinc/81/21/65/566812165.db2.gz PRNRCAJVGKUAAY-UHFFFAOYSA-N 0 0 396.197 3.125 20 5 GGBDRN COc1cc(CCNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1C ZINC000610161570 566812250 /nfs/dbraw/zinc/81/22/50/566812250.db2.gz CERWAZIFULTAEZ-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CN(CCOc1ccc(Br)cc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610221122 566814962 /nfs/dbraw/zinc/81/49/62/566814962.db2.gz BAINXQHTWOYYFL-UHFFFAOYSA-N 0 0 393.237 3.437 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000610217720 566815638 /nfs/dbraw/zinc/81/56/38/566815638.db2.gz IFBZUAGFTXPZJD-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCc2ccc(Cl)cc2F)c([N+](=O)[O-])c1 ZINC000489901144 566816267 /nfs/dbraw/zinc/81/62/67/566816267.db2.gz VNYCMXCOGMKNIA-UHFFFAOYSA-N 0 0 387.820 3.250 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)C[C@H]2CCCCC2(F)F)c(Cl)c1 ZINC000451415937 566816342 /nfs/dbraw/zinc/81/63/42/566816342.db2.gz WYIDBCXNTPXQDL-LLVKDONJSA-N 0 0 382.816 3.493 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCOC2(CCOCC2)CC1 ZINC000581939820 566817281 /nfs/dbraw/zinc/81/72/81/566817281.db2.gz KIMNTOPEDFRVDK-UHFFFAOYSA-N 0 0 385.258 3.129 20 5 GGBDRN COc1ccc(COc2ccc([N+](=O)[O-])c(CO)c2)c(Br)c1OC ZINC000428093101 566817810 /nfs/dbraw/zinc/81/78/10/566817810.db2.gz RFXMUZRCXIGWNQ-UHFFFAOYSA-N 0 0 398.209 3.446 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000610259994 566818662 /nfs/dbraw/zinc/81/86/62/566818662.db2.gz FPYRNBIYVUQVHK-NSHDSACASA-N 0 0 385.854 3.159 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N1CCc2c(ccc(Cl)c2Cl)C1 ZINC000610262350 566819005 /nfs/dbraw/zinc/81/90/05/566819005.db2.gz CCQDEECMEPAZSY-UHFFFAOYSA-N 0 0 388.232 3.044 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000610264268 566819905 /nfs/dbraw/zinc/81/99/05/566819905.db2.gz CUUQCICZSJQYRU-CYBMUJFWSA-N 0 0 399.881 3.122 20 5 GGBDRN O=C(Nc1cccc2[nH]c(=O)oc21)c1ccc(Br)cc1[N+](=O)[O-] ZINC000581975447 566819974 /nfs/dbraw/zinc/81/99/74/566819974.db2.gz FDERCUXDHJDSQU-UHFFFAOYSA-N 0 0 378.138 3.456 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)NCC(C1CC1)C1CC1 ZINC000610270018 566820309 /nfs/dbraw/zinc/82/03/09/566820309.db2.gz ABSGPWYGJPXGFZ-UHFFFAOYSA-N 0 0 389.271 3.072 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C(C)(C)CO1 ZINC000610264114 566820574 /nfs/dbraw/zinc/82/05/74/566820574.db2.gz VZQMOBFHVGCDNF-UHFFFAOYSA-N 0 0 397.280 3.480 20 5 GGBDRN O=C(NC[C@H]1CSCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])s1 ZINC000469843985 566820709 /nfs/dbraw/zinc/82/07/09/566820709.db2.gz UGNMBRVVIDMIIR-AWEZNQCLSA-N 0 0 377.491 3.004 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NC[C@H]1CCCCC(F)(F)C1 ZINC000489994391 566821713 /nfs/dbraw/zinc/82/17/13/566821713.db2.gz KUJBRRORIFTSMJ-ZDUSSCGKSA-N 0 0 376.425 3.272 20 5 GGBDRN O=C(NC[C@@H]1CSCCN1Cc1ccccc1)c1csc([N+](=O)[O-])c1 ZINC000469866792 566821650 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Cc1c(Br)c(=O)n(CCCCC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000543147517 566857265 /nfs/dbraw/zinc/85/72/65/566857265.db2.gz VFXLZUBAEFUNNH-UHFFFAOYSA-N 0 0 389.246 3.339 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2cn3cc(Cl)ccc3n2)cc1[N+](=O)[O-] ZINC000543148829 566857422 /nfs/dbraw/zinc/85/74/22/566857422.db2.gz NQSCHJKVOXIKNW-UHFFFAOYSA-N 0 0 397.616 3.177 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000543170454 566859872 /nfs/dbraw/zinc/85/98/72/566859872.db2.gz YUQDKOYBUZTODA-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000610768752 566860790 /nfs/dbraw/zinc/86/07/90/566860790.db2.gz HCASJKJBJDLZGD-SECBINFHSA-N 0 0 393.610 3.157 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN(c1ccc(Br)cc1)C1CC1 ZINC000451668006 566860813 /nfs/dbraw/zinc/86/08/13/566860813.db2.gz KATAIYMLAYFNKY-UHFFFAOYSA-N 0 0 378.226 3.188 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NCC3(CO)CC3)cc2[N+](=O)[O-])n1 ZINC000610767914 566861250 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O=[N+]([O-])c1cc(Br)cnc1NC[C@]1(CO)C[C@H]1c1ccc(F)cc1 ZINC000428688998 566869530 /nfs/dbraw/zinc/86/95/30/566869530.db2.gz IEVOGPAHVUYFOG-BBRMVZONSA-N 0 0 396.216 3.470 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@@H]1CCOC2(CCC2)C1 ZINC000610863052 566871179 /nfs/dbraw/zinc/87/11/79/566871179.db2.gz KELJIEVMTWRSJB-GFCCVEGCSA-N 0 0 383.242 3.118 20 5 GGBDRN COc1ccc2c(c1)CCN(S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000518218538 566871737 /nfs/dbraw/zinc/87/17/37/566871737.db2.gz NLBLRLVVQJYPJO-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Br)c2)C1)c1csc([N+](=O)[O-])c1 ZINC000470438141 566871925 /nfs/dbraw/zinc/87/19/25/566871925.db2.gz MIPLXVZFRBWEKM-LBPRGKRZSA-N 0 0 396.266 3.428 20 5 GGBDRN O=C(N[C@@H]1CCN(c2cccc(Br)c2)C1)c1csc([N+](=O)[O-])c1 ZINC000470438137 566872437 /nfs/dbraw/zinc/87/24/37/566872437.db2.gz MIPLXVZFRBWEKM-GFCCVEGCSA-N 0 0 396.266 3.428 20 5 GGBDRN CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)c1c([N+](=O)[O-])ncn1C ZINC000610915271 566873774 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O=C(NC[C@@H](O)CCc1ccccc1)c1ccc([N+](=O)[O-])cc1Br ZINC000543385918 566875725 /nfs/dbraw/zinc/87/57/25/566875725.db2.gz FYEIQQAPZDKVEG-AWEZNQCLSA-N 0 0 393.237 3.081 20 5 GGBDRN CCN(CCc1cccs1)S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1 ZINC000490759550 566877416 /nfs/dbraw/zinc/87/74/16/566877416.db2.gz OYQVWZGWDGMPOC-UHFFFAOYSA-N 0 0 388.442 3.057 20 5 GGBDRN C[C@@H]1COCCCN1C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000610948406 566877436 /nfs/dbraw/zinc/87/74/36/566877436.db2.gz DHMXNWGMBACEHQ-SNVBAGLBSA-N 0 0 378.372 3.343 20 5 GGBDRN CN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCCc2c1cnn2C ZINC000610986126 566878657 /nfs/dbraw/zinc/87/86/57/566878657.db2.gz UBMMYDBWWPASSK-CYBMUJFWSA-N 0 0 393.241 3.240 20 5 GGBDRN Cc1c(Br)c(N2CC[C@@H](OCc3ccccn3)C2)ncc1[N+](=O)[O-] ZINC000543436103 566880344 /nfs/dbraw/zinc/88/03/44/566880344.db2.gz GKXOEXFHVSJGAM-CYBMUJFWSA-N 0 0 393.241 3.251 20 5 GGBDRN Cc1c(Br)c(NC[C@H](C[C@@H](C)O)c2ccccc2)ncc1[N+](=O)[O-] ZINC000543436458 566881848 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CO[C@@H](C)c1nc(CNc2ncc([N+](=O)[O-])c(C)c2Br)cs1 ZINC000543436168 566882889 /nfs/dbraw/zinc/88/28/89/566882889.db2.gz CZAKEMDIYDFCHG-QMMMGPOBSA-N 0 0 387.259 3.259 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@H]1c1ccc(O)cc1 ZINC000611020052 566883659 /nfs/dbraw/zinc/88/36/59/566883659.db2.gz VEQKMMWNVPOWFS-AWEZNQCLSA-N 0 0 382.825 3.480 20 5 GGBDRN Cc1c(Br)c(Oc2ccc(S(C)(=O)=O)cc2)ncc1[N+](=O)[O-] ZINC000543451211 566883899 /nfs/dbraw/zinc/88/38/99/566883899.db2.gz UCBUGIIKZGSZDS-UHFFFAOYSA-N 0 0 387.211 3.257 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@H]1c1ccc(O)cc1 ZINC000611020053 566884700 /nfs/dbraw/zinc/88/47/00/566884700.db2.gz VEQKMMWNVPOWFS-CQSZACIVSA-N 0 0 382.825 3.480 20 5 GGBDRN CC[C@H](C)[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000543483999 566885349 /nfs/dbraw/zinc/88/53/49/566885349.db2.gz JKQORENPUPTLOK-CABZTGNLSA-N 0 0 392.499 3.228 20 5 GGBDRN COc1ccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c(OC)n1 ZINC000611072603 566886224 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GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC(Oc2ccncc2)C1 ZINC000612285613 566963376 /nfs/dbraw/zinc/96/33/76/566963376.db2.gz KAOJXNPAIZVTAI-UHFFFAOYSA-N 0 0 379.825 3.025 20 5 GGBDRN Cc1c(Br)c(NCC(=O)N(C)C2CCCCC2)ncc1[N+](=O)[O-] ZINC000519779094 566969443 /nfs/dbraw/zinc/96/94/43/566969443.db2.gz CIUAYYBLJUTEBA-UHFFFAOYSA-N 0 0 385.262 3.264 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)nc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429947972 566969605 /nfs/dbraw/zinc/96/96/05/566969605.db2.gz LZQGZNBDTVWUTL-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1OC ZINC000429966967 566971512 /nfs/dbraw/zinc/97/15/12/566971512.db2.gz KRFQDGOXVUMPNW-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3ccc(F)c(Br)c3)no2)c1[N+](=O)[O-] ZINC000544594480 566971639 /nfs/dbraw/zinc/97/16/39/566971639.db2.gz UXGWNQQDAGTYGI-UHFFFAOYSA-N 0 0 396.176 3.179 20 5 GGBDRN Cc1c(Br)c(Nc2cnn(C[C@H]3CCCO3)c2)ncc1[N+](=O)[O-] ZINC000612438621 566972032 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Cc1c(Br)c(N2C[C@H](C)O[C@H](C(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000612446353 566974965 /nfs/dbraw/zinc/97/49/65/566974965.db2.gz HKQPFIPKEPAJJQ-RCOVLWMOSA-N 0 0 384.152 3.217 20 5 GGBDRN COc1nc(C)cc(C)c1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000612444719 566975067 /nfs/dbraw/zinc/97/50/67/566975067.db2.gz BEQXWVIMKJFDDJ-UHFFFAOYSA-N 0 0 381.230 3.115 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1c[nH]c2ncc(Br)cc12 ZINC000471766963 566975585 /nfs/dbraw/zinc/97/55/85/566975585.db2.gz GBXCOHCUMKPPBA-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000519891258 566977654 /nfs/dbraw/zinc/97/76/54/566977654.db2.gz PEMLLSMJFDIZMZ-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN CC(C)CN(Cc1ccccc1Br)C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000564478351 566977871 /nfs/dbraw/zinc/97/78/71/566977871.db2.gz OAYGZMIKGBXSHV-UHFFFAOYSA-N 0 0 381.230 3.379 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC2(c3nccs3)CCCC2)c1 ZINC000544662401 566977935 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NS(=O)(=O)c1cccc(Oc2ccc(-c3cscn3)cc2)c1[N+](=O)[O-] ZINC000612660741 566986893 /nfs/dbraw/zinc/98/68/93/566986893.db2.gz SAQGSBJVDQEIAW-UHFFFAOYSA-N 0 0 377.403 3.158 20 5 GGBDRN COc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1O ZINC000494321188 566987533 /nfs/dbraw/zinc/98/75/33/566987533.db2.gz WHLDXGFVKQHAGV-UHFFFAOYSA-N 0 0 381.182 3.253 20 5 GGBDRN NS(=O)(=O)c1cccc(NC[C@H]2CCCC[C@@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000612660631 566987560 /nfs/dbraw/zinc/98/75/60/566987560.db2.gz FIEPXIMVPCRKIQ-ZJUUUORDSA-N 0 0 381.376 3.023 20 5 GGBDRN CO[C@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000612679765 566988530 /nfs/dbraw/zinc/98/85/30/566988530.db2.gz VSHUPZPLOVVFFZ-MRXNPFEDSA-N 0 0 384.841 3.055 20 5 GGBDRN Cc1ccc(CSCCNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000544750784 566990914 /nfs/dbraw/zinc/99/09/14/566990914.db2.gz VFYDOPXYJFNBJF-UHFFFAOYSA-N 0 0 380.491 3.256 20 5 GGBDRN O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)c1sccc1Br ZINC000520250018 566991638 /nfs/dbraw/zinc/99/16/38/566991638.db2.gz WEASRSNAAMMREA-UHFFFAOYSA-N 0 0 394.206 3.012 20 5 GGBDRN Cc1cccnc1C(C)(C)CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000583901311 566994682 /nfs/dbraw/zinc/99/46/82/566994682.db2.gz XFKVHLHJJINQMB-UHFFFAOYSA-N 0 0 383.857 3.208 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(NCC(=O)Nc2ccc(Br)cc2)c1 ZINC000520307194 566995542 /nfs/dbraw/zinc/99/55/42/566995542.db2.gz FBIZCGHLQROUKS-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN COC(=O)CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC(C)(F)F ZINC000452596184 566995775 /nfs/dbraw/zinc/99/57/75/566995775.db2.gz ASEPCHUUPCKUMM-UHFFFAOYSA-N 0 0 376.381 3.025 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCC=Cc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000452614011 566997016 /nfs/dbraw/zinc/99/70/16/566997016.db2.gz OSALORNMSLCIPN-HWKANZROSA-N 0 0 393.241 3.476 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H](CO)c1ccc(Br)c(F)c1 ZINC000494401994 566998397 /nfs/dbraw/zinc/99/83/97/566998397.db2.gz CMVOMJWYZDMQCM-CQSZACIVSA-N 0 0 398.188 3.352 20 5 GGBDRN C[C@@H]1CN(Cc2cc(I)cc([N+](=O)[O-])c2)CC(C)(C)O1 ZINC000583963344 566998984 /nfs/dbraw/zinc/99/89/84/566998984.db2.gz FRUNTWNBOYCOQC-SNVBAGLBSA-N 0 0 390.221 3.199 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000520347671 566998997 /nfs/dbraw/zinc/99/89/97/566998997.db2.gz XRIMPFOEZNLSOM-HOTGVXAUSA-N 0 0 391.221 3.408 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000520347796 566999086 /nfs/dbraw/zinc/99/90/86/566999086.db2.gz ZITNFOVVFAJEKE-ZIAGYGMSSA-N 0 0 391.221 3.408 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000520347794 566999863 /nfs/dbraw/zinc/99/98/63/566999863.db2.gz ZITNFOVVFAJEKE-KGLIPLIRSA-N 0 0 391.221 3.408 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1OCCc1nc(COCC(F)(F)F)no1 ZINC000612874401 567000827 /nfs/dbraw/zinc/00/08/27/567000827.db2.gz ODWFOCGLVCJCPQ-UHFFFAOYSA-N 0 0 381.694 3.332 20 5 GGBDRN CCNc1ccc(C(=O)N2CCSC[C@@H]2c2nccs2)cc1[N+](=O)[O-] ZINC000472098624 567001751 /nfs/dbraw/zinc/00/17/51/567001751.db2.gz VLQGRJRXYPIWCN-CQSZACIVSA-N 0 0 378.479 3.413 20 5 GGBDRN NC(=O)c1cccc(-c2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)c1 ZINC000612900605 567002634 /nfs/dbraw/zinc/00/26/34/567002634.db2.gz JQEMZHWMOLSSNO-UHFFFAOYSA-N 0 0 389.165 3.173 20 5 GGBDRN CCc1c(-c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)cnn1C ZINC000612956061 567004556 /nfs/dbraw/zinc/00/45/56/567004556.db2.gz BRPCFTDBGVCGKS-UHFFFAOYSA-N 0 0 392.213 3.294 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H]2CC=CCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430298630 567005670 /nfs/dbraw/zinc/00/56/70/567005670.db2.gz CZSWGNTZQOWRJE-NSHDSACASA-N 0 0 396.241 3.077 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000452689089 567006272 /nfs/dbraw/zinc/00/62/72/567006272.db2.gz VPOOQDGLVTYTKB-MAZHCROVSA-N 0 0 397.269 3.431 20 5 GGBDRN CCCCN(C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C)C1CC1 ZINC000430310344 567007324 /nfs/dbraw/zinc/00/73/24/567007324.db2.gz AEWRIWBBZTVBNH-UHFFFAOYSA-N 0 0 398.257 3.395 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cncc(I)c3)n2)cc1 ZINC000544933500 567007437 /nfs/dbraw/zinc/00/74/37/567007437.db2.gz STQXBVMVXAKGLS-UHFFFAOYSA-N 0 0 394.128 3.311 20 5 GGBDRN CC[C@H]1CCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430305249 567007371 /nfs/dbraw/zinc/00/73/71/567007371.db2.gz QYHLBJPZTCZWAJ-NSHDSACASA-N 0 0 384.230 3.005 20 5 GGBDRN CS(=O)(=O)c1cc(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)ccc1Cl ZINC000544935452 567007530 /nfs/dbraw/zinc/00/75/30/567007530.db2.gz QUDPUGLJJXYKTI-UHFFFAOYSA-N 0 0 379.781 3.369 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@@H](C(C)C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430311111 567008045 /nfs/dbraw/zinc/00/80/45/567008045.db2.gz HDKNENLMUBZVOG-LLVKDONJSA-N 0 0 398.257 3.109 20 5 GGBDRN CC[C@H]1[C@H](C)CCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430318954 567008172 /nfs/dbraw/zinc/00/81/72/567008172.db2.gz LPRXEBPEWYBQIG-RNCFNFMXSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCCC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430319050 567008258 /nfs/dbraw/zinc/00/82/58/567008258.db2.gz UYHFCXLRSKQOKU-SNVBAGLBSA-N 0 0 398.257 3.395 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CC[C@H](C)CC2)cc(Br)cc1[N+](=O)[O-] ZINC000430314659 567008266 /nfs/dbraw/zinc/00/82/66/567008266.db2.gz KVCFGRKMBBPDNC-OTCDBFHCSA-N 0 0 398.257 3.299 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@H]2C(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430313101 567008269 /nfs/dbraw/zinc/00/82/69/567008269.db2.gz DXLYZKWYRGMUST-ZDUSSCGKSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@@H](C)CC2(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430318317 567008334 /nfs/dbraw/zinc/00/83/34/567008334.db2.gz TWSVMWQRWLOYTA-VIFPVBQESA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430316392 567008568 /nfs/dbraw/zinc/00/85/68/567008568.db2.gz DGZLFIOQUBPTFM-VIFPVBQESA-N 0 0 384.230 3.005 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)[C@@H](C)C2CCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430314285 567008628 /nfs/dbraw/zinc/00/86/28/567008628.db2.gz JHYLOLRQDMHYPA-JTQLQIEISA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2CCCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430310846 567008872 /nfs/dbraw/zinc/00/88/72/567008872.db2.gz FHVSIXLAVAGNII-UHFFFAOYSA-N 0 0 398.257 3.301 20 5 GGBDRN CC[C@H](C)CN(C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430312485 567008919 /nfs/dbraw/zinc/00/89/19/567008919.db2.gz BOVWQAGAGZFUDZ-VIFPVBQESA-N 0 0 386.246 3.109 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H]2CC[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430328237 567009543 /nfs/dbraw/zinc/00/95/43/567009543.db2.gz DJVMWRGMKXYYOO-ONGXEEELSA-N 0 0 398.257 3.157 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCC(C)(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430334027 567009669 /nfs/dbraw/zinc/00/96/69/567009669.db2.gz SWWUPLUZTJBKPA-UHFFFAOYSA-N 0 0 386.246 3.157 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2[C@H](C)CC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430333091 567009699 /nfs/dbraw/zinc/00/96/99/567009699.db2.gz RKOQNMXEYGOCQH-DTORHVGOSA-N 0 0 384.230 3.004 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@@H](C)[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430329115 567009914 /nfs/dbraw/zinc/00/99/14/567009914.db2.gz PIVGQWXTCGEGMD-NXEZZACHSA-N 0 0 398.257 3.109 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](C)CCC2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000430321124 567010093 /nfs/dbraw/zinc/01/00/93/567010093.db2.gz BKZVPUYKHPNRBR-VIFPVBQESA-N 0 0 398.257 3.299 20 5 GGBDRN O=C(NC[C@H]1CCOC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1Br ZINC000452729254 567011013 /nfs/dbraw/zinc/01/10/13/567011013.db2.gz GSSUSQMJVAJGSV-NSHDSACASA-N 0 0 383.242 3.436 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[S@@](=O)CC1 ZINC000430344230 567011162 /nfs/dbraw/zinc/01/11/62/567011162.db2.gz LGCBDRXNMXDENZ-CANCMXDXSA-N 0 0 384.523 3.326 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@H](C)[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430338378 567011225 /nfs/dbraw/zinc/01/12/25/567011225.db2.gz HQFRQFJGXNGBNU-GXSJLCMTSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCCC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430342337 567011369 /nfs/dbraw/zinc/01/13/69/567011369.db2.gz JTTZYVQXNSPHKT-SKDRFNHKSA-N 0 0 398.257 3.299 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCCC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430342335 567011495 /nfs/dbraw/zinc/01/14/95/567011495.db2.gz JTTZYVQXNSPHKT-JOYOIKCWSA-N 0 0 398.257 3.299 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[S@](=O)CC1 ZINC000430339174 567011499 /nfs/dbraw/zinc/01/14/99/567011499.db2.gz COKCLPDLDJCIST-ZJWNCGCPSA-N 0 0 384.523 3.470 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCC[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430353725 567011638 /nfs/dbraw/zinc/01/16/38/567011638.db2.gz OHPPWUXCDABAGQ-SNVBAGLBSA-N 0 0 398.257 3.253 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCc1cc(F)ccc1Br ZINC000494609758 567011686 /nfs/dbraw/zinc/01/16/86/567011686.db2.gz TVCXUKHNSYKTMQ-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN COc1ccc(Br)cc1[C@@H]1CCCN1CCn1cc([N+](=O)[O-])cn1 ZINC000472231265 567011675 /nfs/dbraw/zinc/01/16/75/567011675.db2.gz PFESIEDGJQIRPH-HNNXBMFYSA-N 0 0 395.257 3.400 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1-c1nc(Cc2nc3cc(Cl)ccc3s2)no1 ZINC000544979124 567012076 /nfs/dbraw/zinc/01/20/76/567012076.db2.gz TUYPNAWYSSBULW-UHFFFAOYSA-N 0 0 376.785 3.232 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@H]3CCC[C@@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000430358420 567012561 /nfs/dbraw/zinc/01/25/61/567012561.db2.gz XSAGMASTWOHNIS-MFKMUULPSA-N 0 0 396.241 3.005 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2nc(C(C)(C)C)cs2)c1C ZINC000520555924 567012445 /nfs/dbraw/zinc/01/24/45/567012445.db2.gz ZDEBMMVKXPYSRO-UHFFFAOYSA-N 0 0 383.495 3.444 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCCc1cc(Br)ccc1F ZINC000494622365 567013440 /nfs/dbraw/zinc/01/34/40/567013440.db2.gz UFHIEDDPFPBAQC-UHFFFAOYSA-N 0 0 397.200 3.478 20 5 GGBDRN COc1cc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000564864054 567014255 /nfs/dbraw/zinc/01/42/55/567014255.db2.gz QEUZDOOLYCQYTJ-CYBMUJFWSA-N 0 0 397.225 3.218 20 5 GGBDRN C[C@H]1CC2(CCC2)CN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000584128737 567014246 /nfs/dbraw/zinc/01/42/46/567014246.db2.gz UFPYZTKMBOZMDA-JTQLQIEISA-N 0 0 396.241 3.087 20 5 GGBDRN CNc1nccc(C(=O)NC(C)(C)c2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000584121995 567014318 /nfs/dbraw/zinc/01/43/18/567014318.db2.gz FELVYLCNUVOZIJ-UHFFFAOYSA-N 0 0 383.235 3.425 20 5 GGBDRN Cc1cccnc1CCCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000452779136 567016648 /nfs/dbraw/zinc/01/66/48/567016648.db2.gz FHMOARNZPRILAG-UHFFFAOYSA-N 0 0 378.226 3.423 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(Br)c(F)c1 ZINC000520714893 567020521 /nfs/dbraw/zinc/02/05/21/567020521.db2.gz SXHDRXVEWVHDJQ-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CCO[C@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC000452829294 567020444 /nfs/dbraw/zinc/02/04/44/567020444.db2.gz MWYUNCDDYJUDIT-NHYWBVRUSA-N 0 0 385.258 3.173 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CC[C@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000452838965 567022400 /nfs/dbraw/zinc/02/24/00/567022400.db2.gz DGEKWLIUCNJDRP-LBPRGKRZSA-N 0 0 393.241 3.029 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CC[C@@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000452843602 567023237 /nfs/dbraw/zinc/02/32/37/567023237.db2.gz JJIFWOAPWIKSHS-LLVKDONJSA-N 0 0 379.214 3.019 20 5 GGBDRN CN(CCN(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000520777487 567023752 /nfs/dbraw/zinc/02/37/52/567023752.db2.gz GBEGYGRYJOUEMV-UHFFFAOYSA-N 0 0 383.857 3.005 20 5 GGBDRN COc1cc(Cl)ccc1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000520777874 567024302 /nfs/dbraw/zinc/02/43/02/567024302.db2.gz OAQAOIHTBDWYMO-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CC[C@H](c2cccc(Br)c2)C1 ZINC000452872205 567028116 /nfs/dbraw/zinc/02/81/16/567028116.db2.gz QCRHBACAOHDMEO-NSHDSACASA-N 0 0 392.209 3.088 20 5 GGBDRN Cc1cc(OCC(=O)NCCc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000430693656 567028732 /nfs/dbraw/zinc/02/87/32/567028732.db2.gz ODACEXUFRDRRGB-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN COC[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000520878253 567028894 /nfs/dbraw/zinc/02/88/94/567028894.db2.gz RNYHXPRNZIYONJ-INIZCTEOSA-N 0 0 384.841 3.055 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NC2CC(OCc3ccccc3)C2)s1 ZINC000545205910 567028866 /nfs/dbraw/zinc/02/88/66/567028866.db2.gz ACIORUDNZAAJSN-UHFFFAOYSA-N 0 0 382.463 3.220 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)NC2(c3ccccc3)CC2)c1 ZINC000520895314 567031429 /nfs/dbraw/zinc/03/14/29/567031429.db2.gz BTFXMECVYZTBFO-UHFFFAOYSA-N 0 0 397.250 3.325 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@H]3CCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000545230871 567031697 /nfs/dbraw/zinc/03/16/97/567031697.db2.gz HAEOBFFUXNWDBA-GFCCVEGCSA-N 0 0 379.463 3.142 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]([C@@H](CO)C1CC1)C1CC1 ZINC000452919575 567033002 /nfs/dbraw/zinc/03/30/02/567033002.db2.gz GIIJMUKPBSNMRK-HOCLYGCPSA-N 0 0 397.269 3.193 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)CSc2ccccc2[N+](=O)[O-])n1 ZINC000430749153 567033131 /nfs/dbraw/zinc/03/31/31/567033131.db2.gz UEMLIOIFNIVLRD-ZDUSSCGKSA-N 0 0 379.463 3.052 20 5 GGBDRN Cc1cc(Br)ccc1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000521001040 567033989 /nfs/dbraw/zinc/03/39/89/567033989.db2.gz QAUNIXZLLJVMPN-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]([C@H](CO)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000452948426 567035518 /nfs/dbraw/zinc/03/55/18/567035518.db2.gz SYQYGJPDMTYKTD-CZUORRHYSA-N 0 0 397.269 3.193 20 5 GGBDRN Cc1cc(OCC(=O)N(C)Cc2cc(Br)cn2C)ccc1[N+](=O)[O-] ZINC000430821652 567035995 /nfs/dbraw/zinc/03/59/95/567035995.db2.gz IZSIEJAKCJUYDB-UHFFFAOYSA-N 0 0 396.241 3.042 20 5 GGBDRN NS(=O)(=O)c1ccc(NCCc2cc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000584363561 567036886 /nfs/dbraw/zinc/03/68/86/567036886.db2.gz OCHAEOCURVJMIK-UHFFFAOYSA-N 0 0 377.447 3.112 20 5 GGBDRN Cc1cc(Br)ccc1S(=O)(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000472586662 567038373 /nfs/dbraw/zinc/03/83/73/567038373.db2.gz QBUHUMUVBKIHLH-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCS[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000613475649 567039835 /nfs/dbraw/zinc/03/98/35/567039835.db2.gz SITRGOQLDVNIRI-AWEZNQCLSA-N 0 0 384.504 3.444 20 5 GGBDRN Cc1cc(Br)ccc1S(=O)(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000472590245 567040409 /nfs/dbraw/zinc/04/04/09/567040409.db2.gz MMPFFYRNQJJSBO-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CC(C)[C@@H](CO)[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000453001698 567040933 /nfs/dbraw/zinc/04/09/33/567040933.db2.gz XSADAEMIIQKOPQ-HIFRSBDPSA-N 0 0 387.274 3.376 20 5 GGBDRN Cc1cc(I)cc(NC(=O)c2ccc([N+](=O)[O-])n2C)c1 ZINC000584426946 567041589 /nfs/dbraw/zinc/04/15/89/567041589.db2.gz ZIMJFMXFNCSHIP-UHFFFAOYSA-N 0 0 385.161 3.099 20 5 GGBDRN CCc1nnc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000565128477 567041683 /nfs/dbraw/zinc/04/16/83/567041683.db2.gz WQPQNMOZIXXOLU-UHFFFAOYSA-N 0 0 375.435 3.062 20 5 GGBDRN CCN(Cc1ccc(Cl)cc1)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000521157893 567045308 /nfs/dbraw/zinc/04/53/08/567045308.db2.gz ITLXZWJUAJOVGL-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cc1Br ZINC000472736766 567048242 /nfs/dbraw/zinc/04/82/42/567048242.db2.gz SITKASBQGPKNGG-UHFFFAOYSA-N 0 0 396.172 3.382 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc([C@@H]3CCC[C@H](O)C3)n2)c(Br)c1 ZINC000521222099 567048846 /nfs/dbraw/zinc/04/88/46/567048846.db2.gz KBHDBUZCBBZACH-PWSUYJOCSA-N 0 0 382.214 3.350 20 5 GGBDRN C[C@H](CC(=O)c1ccccc1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000431068236 567049959 /nfs/dbraw/zinc/04/99/59/567049959.db2.gz BJCQNPOXXXHLKK-LLVKDONJSA-N 0 0 382.825 3.188 20 5 GGBDRN C[C@H]1CCCC[C@H]1NS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000521288207 567051788 /nfs/dbraw/zinc/05/17/88/567051788.db2.gz JAFQHVYKAFNULB-TVQRCGJNSA-N 0 0 377.260 3.214 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N(Cc1cscn1)c1ccccc1 ZINC000521263246 567052855 /nfs/dbraw/zinc/05/28/55/567052855.db2.gz CLNKTECXORUSFB-UHFFFAOYSA-N 0 0 375.431 3.447 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1Cc2cccc(Br)c2C1 ZINC000613726234 567058264 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COC(=O)c1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c1Cl ZINC000431180371 567063971 /nfs/dbraw/zinc/06/39/71/567063971.db2.gz GXGDGMZXLHXATN-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN COC(=O)c1cccc(NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])c1Cl ZINC000431179454 567064173 /nfs/dbraw/zinc/06/41/73/567064173.db2.gz GNTHWPPUOHRTAS-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN CCOc1ccc(Br)cc1-c1noc(Cn2cc([N+](=O)[O-])cn2)n1 ZINC000545632744 567066364 /nfs/dbraw/zinc/06/63/64/567066364.db2.gz TZOVJGPRACHWDP-UHFFFAOYSA-N 0 0 394.185 3.051 20 5 GGBDRN COc1ccc(Br)cc1-c1noc(-c2ccc([N+](=O)[O-])n2C)n1 ZINC000545631390 567066735 /nfs/dbraw/zinc/06/67/35/567066735.db2.gz BTJYDLBYPZXKRH-UHFFFAOYSA-N 0 0 379.170 3.421 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCCO)c1ccc(Cl)cn1 ZINC000473195491 567066898 /nfs/dbraw/zinc/06/68/98/567066898.db2.gz WELZGGVNVRDQGH-SNVBAGLBSA-N 0 0 381.841 3.219 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(Cc2ccc(F)c(Br)c2)no1 ZINC000545656448 567068429 /nfs/dbraw/zinc/06/84/29/567068429.db2.gz MXEOTBHVKUUWCC-UHFFFAOYSA-N 0 0 396.176 3.023 20 5 GGBDRN CN1C(=O)N[C@@]2(CCC[C@@H]2CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)C1=O ZINC000613883796 567069201 /nfs/dbraw/zinc/06/92/01/567069201.db2.gz JASORWWTHMXBEE-ANRSDYALSA-N 0 0 387.223 3.034 20 5 GGBDRN Cc1csc(Sc2ccc(-c3nc(C[S@](C)=O)no3)cc2[N+](=O)[O-])n1 ZINC000545726483 567071026 /nfs/dbraw/zinc/07/10/26/567071026.db2.gz DERYLVNARVNTPY-VWLOTQADSA-N 0 0 396.475 3.439 20 5 GGBDRN COc1ccc(-c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)cn1 ZINC000545742872 567072712 /nfs/dbraw/zinc/07/27/12/567072712.db2.gz WXCAAIQPWMKLBM-UHFFFAOYSA-N 0 0 391.181 3.402 20 5 GGBDRN Cc1cc(Br)ccc1Cc1noc(CCn2cc([N+](=O)[O-])cn2)n1 ZINC000545764899 567073933 /nfs/dbraw/zinc/07/39/33/567073933.db2.gz MVXBEVIWAFOWBD-UHFFFAOYSA-N 0 0 392.213 3.079 20 5 GGBDRN O=[N+]([O-])c1cccc(/C=C/c2nc(Cn3cc(Br)cn3)no2)c1 ZINC000545758647 567074623 /nfs/dbraw/zinc/07/46/23/567074623.db2.gz VWPHFTBSOPNIPL-SNAWJCMRSA-N 0 0 376.170 3.156 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1Cc2ccccc2CO1 ZINC000565561540 567077536 /nfs/dbraw/zinc/07/75/36/567077536.db2.gz LDCKIKVIRZUNBD-UHFFFAOYSA-N 0 0 377.194 3.374 20 5 GGBDRN C[C@H](c1noc(CCn2cc([N+](=O)[O-])cn2)n1)c1ccc(Br)cc1 ZINC000545834762 567079097 /nfs/dbraw/zinc/07/90/97/567079097.db2.gz MSXPWNSKAALHLB-JTQLQIEISA-N 0 0 392.213 3.331 20 5 GGBDRN C[C@@H](c1noc(CCn2cc([N+](=O)[O-])cn2)n1)c1ccc(Br)cc1 ZINC000545834763 567080102 /nfs/dbraw/zinc/08/01/02/567080102.db2.gz MSXPWNSKAALHLB-SNVBAGLBSA-N 0 0 392.213 3.331 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)C(=O)OC(C)C ZINC000585700986 567080330 /nfs/dbraw/zinc/08/03/30/567080330.db2.gz FXVJADDRIRCVGQ-SNVBAGLBSA-N 0 0 387.230 3.078 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1csc(N(C)C)n1 ZINC000585700424 567080534 /nfs/dbraw/zinc/08/05/34/567080534.db2.gz JOKXZWARUXCTIU-UHFFFAOYSA-N 0 0 399.270 3.118 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C12CCC2 ZINC000431442636 567081955 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CS(=O)(=O)c1cccc(N2CC(Cc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000497524752 567105029 /nfs/dbraw/zinc/10/50/29/567105029.db2.gz VWIBUKCCVXRCED-UHFFFAOYSA-N 0 0 380.853 3.331 20 5 GGBDRN Cc1cc(Br)cn2cc(CNC(=O)c3csc([N+](=O)[O-])c3)nc12 ZINC000546111576 567105366 /nfs/dbraw/zinc/10/53/66/567105366.db2.gz FXCMYQNOHJSJQL-UHFFFAOYSA-N 0 0 395.238 3.305 20 5 GGBDRN CC(C)N(Cc1cccc(Br)c1)C(=O)c1cc([N+](=O)[O-])cnc1N ZINC000546098635 567105606 /nfs/dbraw/zinc/10/56/06/567105606.db2.gz GFMNPGRFRIZHBF-UHFFFAOYSA-N 0 0 393.241 3.385 20 5 GGBDRN C[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])Oc1ccccc1Br ZINC000587991813 567106159 /nfs/dbraw/zinc/10/61/59/567106159.db2.gz AFPMOSUWJHPRTB-SNVBAGLBSA-N 0 0 394.225 3.336 20 5 GGBDRN CS(=O)(=O)c1cccc(Nc2ccc(OC(F)F)c(F)c2)c1[N+](=O)[O-] ZINC000497534481 567106439 /nfs/dbraw/zinc/10/64/39/567106439.db2.gz QSFRNMUFLWFTJR-UHFFFAOYSA-N 0 0 376.312 3.482 20 5 GGBDRN CS(=O)(=O)c1cccc(NC[C@H]2SCCc3ccccc32)c1[N+](=O)[O-] ZINC000497534687 567106587 /nfs/dbraw/zinc/10/65/87/567106587.db2.gz LKMGATAIXUZXJZ-OAHLLOKOSA-N 0 0 378.475 3.441 20 5 GGBDRN C[C@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431789625 567106837 /nfs/dbraw/zinc/10/68/37/567106837.db2.gz BOAVBFDKMRMIBD-NWDGAFQWSA-N 0 0 384.274 3.208 20 5 GGBDRN C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431789627 567107706 /nfs/dbraw/zinc/10/77/06/567107706.db2.gz BOAVBFDKMRMIBD-VXGBXAGGSA-N 0 0 384.274 3.208 20 5 GGBDRN COc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000522249001 567109018 /nfs/dbraw/zinc/10/90/18/567109018.db2.gz GANZQELLRWFARO-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN O=[N+]([O-])c1cc2c(ncnc2NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)s1 ZINC000588026893 567109357 /nfs/dbraw/zinc/10/93/57/567109357.db2.gz UTLWBERXJGXTEH-AMIZOPFISA-N 0 0 376.360 3.495 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccc(Br)cc1 ZINC000565898756 567109663 /nfs/dbraw/zinc/10/96/63/567109663.db2.gz UPDXYERHLWXLFA-UHFFFAOYSA-N 0 0 392.253 3.470 20 5 GGBDRN CCn1cc(CNc2c3cc(Br)ccc3ncc2[N+](=O)[O-])cn1 ZINC000588078045 567112111 /nfs/dbraw/zinc/11/21/11/567112111.db2.gz IUGKBNAHJZKBMG-UHFFFAOYSA-N 0 0 376.214 3.156 20 5 GGBDRN C[C@@H](Oc1ccc([N+](=O)[O-])c(CO)c1)C(=O)Nc1ccc(Br)cc1 ZINC000431879833 567114040 /nfs/dbraw/zinc/11/40/40/567114040.db2.gz FGEJBUWDCQMCJH-SNVBAGLBSA-N 0 0 395.209 3.256 20 5 GGBDRN COc1cc(S(=O)(=O)N(CC(F)(F)F)[C@@H](C)C(C)C)ccc1[N+](=O)[O-] ZINC000565951175 567114289 /nfs/dbraw/zinc/11/42/89/567114289.db2.gz LGQDHIVEGUYJDA-JTQLQIEISA-N 0 0 384.376 3.201 20 5 GGBDRN COc1cc(S(=O)(=O)N(CC(F)(F)F)[C@H](C)C(C)C)ccc1[N+](=O)[O-] ZINC000565951180 567114697 /nfs/dbraw/zinc/11/46/97/567114697.db2.gz LGQDHIVEGUYJDA-SNVBAGLBSA-N 0 0 384.376 3.201 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCNc2ccccc2[N+](=O)[O-])sc1Cl ZINC000473910278 567114832 /nfs/dbraw/zinc/11/48/32/567114832.db2.gz FSKRIYCVJBNSEE-UHFFFAOYSA-N 0 0 375.859 3.009 20 5 GGBDRN CCO[C@H]1C[C@](O)(CNc2ncc([N+](=O)[O-])c(C)c2Br)C1(C)C ZINC000473913563 567114863 /nfs/dbraw/zinc/11/48/63/567114863.db2.gz OTLSWPOKSSJCJL-NHYWBVRUSA-N 0 0 388.262 3.039 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1nc(CSc2ccc(Cl)cc2)no1 ZINC000546236164 567115414 /nfs/dbraw/zinc/11/54/14/567115414.db2.gz MXWHEFDUIXUDAB-UHFFFAOYSA-N 0 0 378.797 3.134 20 5 GGBDRN O=C(NCc1ccc2c(c1)COC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431904200 567115469 /nfs/dbraw/zinc/11/54/69/567115469.db2.gz RCJFFXBHDLSNKE-UHFFFAOYSA-N 0 0 377.194 3.318 20 5 GGBDRN O=[N+]([O-])c1ccccc1Cc1noc(-c2cc(I)c[nH]2)n1 ZINC000546243233 567117523 /nfs/dbraw/zinc/11/75/23/567117523.db2.gz UNWAFRPMIIFYPC-UHFFFAOYSA-N 0 0 396.144 3.168 20 5 GGBDRN C[C@@H](CC(=O)OC(C)(C)C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431930303 567118217 /nfs/dbraw/zinc/11/82/17/567118217.db2.gz FEVSEUUKUFPMQE-VIFPVBQESA-N 0 0 387.230 3.207 20 5 GGBDRN O=C1Nc2ccccc2[C@@]12CCN(c1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000614524418 567118624 /nfs/dbraw/zinc/11/86/24/567118624.db2.gz FIJOAOZMCFVZLF-KRWDZBQOSA-N 0 0 388.221 3.458 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000522555266 567119121 /nfs/dbraw/zinc/11/91/21/567119121.db2.gz UPZPUYMZAVIPSO-CABZTGNLSA-N 0 0 388.779 3.361 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)n(-c2cccc(Br)c2)n1 ZINC000522545685 567119821 /nfs/dbraw/zinc/11/98/21/567119821.db2.gz CJUYHAPGAOMPTR-UHFFFAOYSA-N 0 0 390.197 3.432 20 5 GGBDRN Cc1nn(CCC(=O)NCCc2c(Cl)cccc2Cl)c(C)c1[N+](=O)[O-] ZINC000522571116 567120713 /nfs/dbraw/zinc/12/07/13/567120713.db2.gz KOVKSKMYMDEGME-UHFFFAOYSA-N 0 0 385.251 3.464 20 5 GGBDRN Cc1ccc(-c2nc(NC(=O)c3ccc(Br)cc3[N+](=O)[O-])n[nH]2)o1 ZINC000497740021 567120952 /nfs/dbraw/zinc/12/09/52/567120952.db2.gz RXHZQKSRPNURFW-UHFFFAOYSA-N 0 0 392.169 3.296 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CC(F)(F)F)no2)c(I)c1 ZINC000546272668 567121331 /nfs/dbraw/zinc/12/13/31/567121331.db2.gz JVWUVXFWKABMPL-UHFFFAOYSA-N 0 0 399.066 3.354 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1-c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000566034423 567121503 /nfs/dbraw/zinc/12/15/03/567121503.db2.gz KDJATMYGSLKZNN-UHFFFAOYSA-N 0 0 392.169 3.066 20 5 GGBDRN C[C@H](COc1cccc(F)c1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000497774410 567122854 /nfs/dbraw/zinc/12/28/54/567122854.db2.gz TXTGTDTXPHJSAH-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN COc1ccc(Br)cc1-c1noc(-c2c([N+](=O)[O-])c(C)nn2C)n1 ZINC000546340021 567123754 /nfs/dbraw/zinc/12/37/54/567123754.db2.gz RCKIVZSTSWMFCW-UHFFFAOYSA-N 0 0 394.185 3.125 20 5 GGBDRN Cc1c(Br)cccc1S(=O)(=O)NCc1ccccc1[N+](=O)[O-] ZINC000474040212 567127642 /nfs/dbraw/zinc/12/76/42/567127642.db2.gz ZTYMZGJXNCMUMO-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000522739223 567128498 /nfs/dbraw/zinc/12/84/98/567128498.db2.gz MZGFUNHWQMCCDW-UHFFFAOYSA-N 0 0 382.825 3.141 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H]2C[C@H]2C(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000453941749 567128890 /nfs/dbraw/zinc/12/88/90/567128890.db2.gz BIZXQLKRMDSKCM-JQWIXIFHSA-N 0 0 398.257 3.013 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1CC[C@@H]2CCC[C@@H]21 ZINC000614644890 567129772 /nfs/dbraw/zinc/12/97/72/567129772.db2.gz XVFJANMXWKOEIX-ZANVPECISA-N 0 0 386.189 3.214 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1CC[C@@H]2CCC[C@H]21 ZINC000614644889 567130397 /nfs/dbraw/zinc/13/03/97/567130397.db2.gz XVFJANMXWKOEIX-TVQRCGJNSA-N 0 0 386.189 3.214 20 5 GGBDRN Cc1c(-c2nc(Cc3cc(Br)c[nH]c3=O)no2)cccc1[N+](=O)[O-] ZINC000546475947 567132241 /nfs/dbraw/zinc/13/22/41/567132241.db2.gz IYMNPQZXKCGYED-UHFFFAOYSA-N 0 0 391.181 3.407 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)CCc2ccccc2)cc1 ZINC000497933794 567132703 /nfs/dbraw/zinc/13/27/03/567132703.db2.gz GYBKSTBSNPYYGR-QGZVFWFLSA-N 0 0 378.475 3.215 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)Cc2ccc(F)cc2)cc1 ZINC000497934475 567133141 /nfs/dbraw/zinc/13/31/41/567133141.db2.gz MHYRJSXNFSKWSZ-MRXNPFEDSA-N 0 0 382.438 3.311 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2SCCN2S(=O)(=O)c2c(F)cccc2F)cc1 ZINC000497936937 567133939 /nfs/dbraw/zinc/13/39/39/567133939.db2.gz KICCAJFAAWFVGJ-HNNXBMFYSA-N 0 0 386.401 3.309 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2SCCN2S(=O)(=O)Cc2cccc(F)c2)cc1 ZINC000497936795 567134173 /nfs/dbraw/zinc/13/41/73/567134173.db2.gz IXUUKRFGYRSVND-INIZCTEOSA-N 0 0 382.438 3.311 20 5 GGBDRN CS(=O)(=O)c1ccc2c(c1)CCN(c1c(Cl)cccc1[N+](=O)[O-])CC2 ZINC000432166175 567134963 /nfs/dbraw/zinc/13/49/63/567134963.db2.gz JXHFLQJNSIHOGY-UHFFFAOYSA-N 0 0 380.853 3.257 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)Cc2ccccc2F)cc1 ZINC000497968092 567136812 /nfs/dbraw/zinc/13/68/12/567136812.db2.gz GKCMBVCHZLKGNG-MRXNPFEDSA-N 0 0 382.438 3.311 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000497968345 567136995 /nfs/dbraw/zinc/13/69/95/567136995.db2.gz ZSGIECKMVWDIKV-MRXNPFEDSA-N 0 0 382.438 3.479 20 5 GGBDRN Cc1n[nH]c(C(=O)N(Cc2cccc(Br)c2)C2CC2)c1[N+](=O)[O-] ZINC000522927722 567137702 /nfs/dbraw/zinc/13/77/02/567137702.db2.gz XZJDQRCJIAEJKP-UHFFFAOYSA-N 0 0 379.214 3.194 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2SCCN2S(=O)(=O)c2ccc(F)c(F)c2)cc1 ZINC000497968083 567137672 /nfs/dbraw/zinc/13/76/72/567137672.db2.gz GIXDVUKBHVULEM-HNNXBMFYSA-N 0 0 386.401 3.309 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2SCCN2S(=O)(=O)Cc2ccccc2F)cc1 ZINC000497968091 567137819 /nfs/dbraw/zinc/13/78/19/567137819.db2.gz GKCMBVCHZLKGNG-INIZCTEOSA-N 0 0 382.438 3.311 20 5 GGBDRN O=C(Nc1ncc(-c2ccc(Br)cc2)s1)c1n[nH]cc1[N+](=O)[O-] ZINC000588780850 567137922 /nfs/dbraw/zinc/13/79/22/567137922.db2.gz BLNXZLJAEGPCCQ-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3ccc(Br)c(F)c3)no2)c1[N+](=O)[O-] ZINC000546561090 567138189 /nfs/dbraw/zinc/13/81/89/567138189.db2.gz MHXNUJXHIQRYAV-UHFFFAOYSA-N 0 0 396.176 3.179 20 5 GGBDRN CCCN(CC1CC1)S(=O)(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497982578 567138569 /nfs/dbraw/zinc/13/85/69/567138569.db2.gz KBZSTJMZSYWMHX-MRXNPFEDSA-N 0 0 385.511 3.009 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1Oc1cc(Br)cc(C(=O)OC)c1 ZINC000588822876 567138654 /nfs/dbraw/zinc/13/86/54/567138654.db2.gz GEAPJUXKKGTUNK-UHFFFAOYSA-N 0 0 384.186 3.461 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000474142273 567140134 /nfs/dbraw/zinc/14/01/34/567140134.db2.gz OCMHSECGOWARPA-SNVBAGLBSA-N 0 0 379.214 3.313 20 5 GGBDRN O=C(Nc1nc(-c2cccs2)ns1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000497985693 567140573 /nfs/dbraw/zinc/14/05/73/567140573.db2.gz NXWNZYSEUXAXNH-UHFFFAOYSA-N 0 0 376.375 3.156 20 5 GGBDRN CN(CCn1cc(Br)cn1)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000588864649 567140873 /nfs/dbraw/zinc/14/08/73/567140873.db2.gz LBKGLQNAXSQIGD-UHFFFAOYSA-N 0 0 376.214 3.238 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NC[C@H](CO)c1ccc(Cl)cc1 ZINC000588847015 567141278 /nfs/dbraw/zinc/14/12/78/567141278.db2.gz IKOSXCRHLLBNOM-SNVBAGLBSA-N 0 0 386.633 3.016 20 5 GGBDRN COc1ccc(Br)c(OC[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000432251899 567141399 /nfs/dbraw/zinc/14/13/99/567141399.db2.gz VJAAJFXRDDHQNS-LLVKDONJSA-N 0 0 398.209 3.185 20 5 GGBDRN COc1ccc(Br)c(OC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000432250993 567141469 /nfs/dbraw/zinc/14/14/69/567141469.db2.gz PCIMLWKZRJYDQN-GFCCVEGCSA-N 0 0 398.209 3.185 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C(C)(C)C1 ZINC000474164143 567142254 /nfs/dbraw/zinc/14/22/54/567142254.db2.gz LNKTXOSLVDJVRM-SECBINFHSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCN(C)c2ccc(Cl)cc21 ZINC000474173385 567143225 /nfs/dbraw/zinc/14/32/25/567143225.db2.gz GWMNLBSTOXJMNR-UHFFFAOYSA-N 0 0 381.841 3.202 20 5 GGBDRN CO[C@@]1(C(F)(F)F)CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000614830314 567143390 /nfs/dbraw/zinc/14/33/90/567143390.db2.gz VUXFQHRTJIOUBG-NSHDSACASA-N 0 0 384.152 3.300 20 5 GGBDRN Cc1ccc2nc(COc3ccc([N+](=O)[O-])cc3Br)cc(=O)n2c1 ZINC000523109460 567144129 /nfs/dbraw/zinc/14/41/29/567144129.db2.gz HKANSLVLCZZVON-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCC[C@@H](C2CC2)C1 ZINC000588904071 567144359 /nfs/dbraw/zinc/14/43/59/567144359.db2.gz RSHYVEOAXMDYSN-LLVKDONJSA-N 0 0 389.271 3.168 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCN(C)c2ccc(Cl)cc21 ZINC000474183620 567144540 /nfs/dbraw/zinc/14/45/40/567144540.db2.gz QZTPZBJIFXUPDF-UHFFFAOYSA-N 0 0 381.841 3.202 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCC[C@@H](C3CC3)C2)c1 ZINC000588904253 567144653 /nfs/dbraw/zinc/14/46/53/567144653.db2.gz ZRBXSEYUZWSIOQ-LLVKDONJSA-N 0 0 389.271 3.168 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@@H](Cc2ccc(Br)cc2)C1 ZINC000498032770 567145173 /nfs/dbraw/zinc/14/51/73/567145173.db2.gz SGOGGTQCXWAYCD-LBPRGKRZSA-N 0 0 378.226 3.390 20 5 GGBDRN Cn1c(C(=O)N2CC[C@H](Cc3ccc(Br)cc3)C2)ccc1[N+](=O)[O-] ZINC000498039241 567145238 /nfs/dbraw/zinc/14/52/38/567145238.db2.gz FUCWHGOQKDWILS-CYBMUJFWSA-N 0 0 392.253 3.401 20 5 GGBDRN COc1cccc2c1CCCN2S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000432282465 567145217 /nfs/dbraw/zinc/14/52/17/567145217.db2.gz BXOHVNKKVRFBIK-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN CO[C@@]1(C(F)(F)F)CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000614898415 567146257 /nfs/dbraw/zinc/14/62/57/567146257.db2.gz ZGICBZFKNXAXFQ-AWEZNQCLSA-N 0 0 380.750 3.361 20 5 GGBDRN CO[C@]1(C(F)(F)F)CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000614898416 567147385 /nfs/dbraw/zinc/14/73/85/567147385.db2.gz ZGICBZFKNXAXFQ-CQSZACIVSA-N 0 0 380.750 3.361 20 5 GGBDRN Cc1nn(CCC(=O)N(C)Cc2ccccc2Br)c(C)c1[N+](=O)[O-] ZINC000523288408 567149324 /nfs/dbraw/zinc/14/93/24/567149324.db2.gz RANNAQOQOUUFCB-UHFFFAOYSA-N 0 0 395.257 3.219 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1cc(Cl)ccc1N1CCSCC1 ZINC000523317277 567149470 /nfs/dbraw/zinc/14/94/70/567149470.db2.gz YONHIIKMIBAASY-UHFFFAOYSA-N 0 0 380.857 3.392 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCNc2c(Cl)cccc2[N+](=O)[O-])s1 ZINC000432342253 567151870 /nfs/dbraw/zinc/15/18/70/567151870.db2.gz HYGQVQKINNIJJP-UHFFFAOYSA-N 0 0 375.859 3.009 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000566396598 567155687 /nfs/dbraw/zinc/15/56/87/567155687.db2.gz LRSQKHJFNKUJDJ-NHYWBVRUSA-N 0 0 390.889 3.368 20 5 GGBDRN COc1ccc(S(=O)(=O)NC(C)(C)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000523415381 567155947 /nfs/dbraw/zinc/15/59/47/567155947.db2.gz XDXMBVGCLFIFFY-UHFFFAOYSA-N 0 0 384.841 3.470 20 5 GGBDRN CN(C)c1cc(Br)cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000432394334 567156773 /nfs/dbraw/zinc/15/67/73/567156773.db2.gz IXWKNCAKQNGDQN-UHFFFAOYSA-N 0 0 378.226 3.353 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H]1COc2ccc(Cl)cc21 ZINC000474300306 567157121 /nfs/dbraw/zinc/15/71/21/567157121.db2.gz AQGYFESKKVLHKC-NSHDSACASA-N 0 0 389.216 3.314 20 5 GGBDRN CN(Cc1csc2ccccc12)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 ZINC000589106795 567157374 /nfs/dbraw/zinc/15/73/74/567157374.db2.gz LPQOMNPKSOFUCX-UHFFFAOYSA-N 0 0 377.447 3.093 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1COc2ccc(Cl)cc21 ZINC000474300305 567157994 /nfs/dbraw/zinc/15/79/94/567157994.db2.gz AQGYFESKKVLHKC-LLVKDONJSA-N 0 0 389.216 3.314 20 5 GGBDRN NC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)ccc1Cl ZINC000523497443 567159293 /nfs/dbraw/zinc/15/92/93/567159293.db2.gz FOAGDFYELNGWOL-UHFFFAOYSA-N 0 0 398.600 3.362 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1nc2cc(Cl)ccc2s1 ZINC000546797839 567159452 /nfs/dbraw/zinc/15/94/52/567159452.db2.gz IZQZWFCRXZHMFG-UHFFFAOYSA-N 0 0 397.865 3.478 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCC2(c3cccc(Cl)c3)CC2)c(F)c1 ZINC000523523092 567160241 /nfs/dbraw/zinc/16/02/41/567160241.db2.gz MOHGRHQTYGVAMX-UHFFFAOYSA-N 0 0 384.816 3.397 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](C2CC2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000566464029 567161694 /nfs/dbraw/zinc/16/16/94/567161694.db2.gz MQFPDEUWYCJTKS-AWEZNQCLSA-N 0 0 385.258 3.193 20 5 GGBDRN Cc1cc(Br)cn2cc(CNC(=O)c3ccc([N+](=O)[O-])s3)nc12 ZINC000546823772 567163240 /nfs/dbraw/zinc/16/32/40/567163240.db2.gz OAXMWYCZFRDNKU-UHFFFAOYSA-N 0 0 395.238 3.305 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1ncc(Br)s1 ZINC000432497744 567163890 /nfs/dbraw/zinc/16/38/90/567163890.db2.gz ZSNUEKDFDCTQMN-UHFFFAOYSA-N 0 0 393.222 3.086 20 5 GGBDRN CCN(CCC1CC1)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000546868483 567166593 /nfs/dbraw/zinc/16/65/93/567166593.db2.gz BATDDHDAWVXWQY-UHFFFAOYSA-N 0 0 388.205 3.462 20 5 GGBDRN NS(=O)(=O)c1ccc(OCCc2cccc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000432540466 567166951 /nfs/dbraw/zinc/16/69/51/567166951.db2.gz HOYLDOUZSKHUAR-UHFFFAOYSA-N 0 0 391.232 3.171 20 5 GGBDRN CN(Cc1cccn1C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000589255213 567170160 /nfs/dbraw/zinc/17/01/60/567170160.db2.gz PIQJNRFMDZYYBI-UHFFFAOYSA-N 0 0 385.205 3.170 20 5 GGBDRN Cc1noc(C)c1N(C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000589256385 567170280 /nfs/dbraw/zinc/17/02/80/567170280.db2.gz DWACBRRFPSQIDB-UHFFFAOYSA-N 0 0 387.177 3.441 20 5 GGBDRN COc1c(C(=O)NCCc2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000474416515 567170278 /nfs/dbraw/zinc/17/02/78/567170278.db2.gz RJCCTOXQZHNIHW-UHFFFAOYSA-N 0 0 385.239 3.400 20 5 GGBDRN C[C@H](NCc1cc(I)cc([N+](=O)[O-])c1)c1ccccn1 ZINC000589258462 567170317 /nfs/dbraw/zinc/17/03/17/567170317.db2.gz CMTLETAASUUQNU-JTQLQIEISA-N 0 0 383.189 3.445 20 5 GGBDRN CNc1ccc(C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)cc1[N+](=O)[O-] ZINC000523749137 567170510 /nfs/dbraw/zinc/17/05/10/567170510.db2.gz MTORPHLVURPPKP-VWLOTQADSA-N 0 0 381.841 3.421 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@@](=O)C[C@H](C)C1 ZINC000432588688 567170931 /nfs/dbraw/zinc/17/09/31/567170931.db2.gz QHOOLAJQSKGJEM-YMXBGEKHSA-N 0 0 384.523 3.328 20 5 GGBDRN COc1ccc(CNc2nc3cc(Br)ccc3[nH]2)cc1[N+](=O)[O-] ZINC000566600554 567171976 /nfs/dbraw/zinc/17/19/76/567171976.db2.gz RENKNNMKSBRTOI-UHFFFAOYSA-N 0 0 377.198 3.276 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000589297068 567173201 /nfs/dbraw/zinc/17/32/01/567173201.db2.gz JWGHANVMSPSXPL-CYBMUJFWSA-N 0 0 389.271 3.166 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1C[C@H](CO)c2ccccc21 ZINC000498372377 567174888 /nfs/dbraw/zinc/17/48/88/567174888.db2.gz HJCHSAGCARFMFC-LLVKDONJSA-N 0 0 377.194 3.094 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1C[C@H](CO)c2ccccc21 ZINC000498375723 567175039 /nfs/dbraw/zinc/17/50/39/567175039.db2.gz NHOITKLMMLAAQP-SNVBAGLBSA-N 0 0 377.194 3.094 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CCC(F)(F)F)CC(F)(F)F ZINC000566658865 567177003 /nfs/dbraw/zinc/17/70/03/567177003.db2.gz CPYWPMQMYCMDON-UHFFFAOYSA-N 0 0 394.293 3.409 20 5 GGBDRN CCOc1ccc(Br)cc1-c1noc(-c2c([N+](=O)[O-])cnn2C)n1 ZINC000547061286 567181615 /nfs/dbraw/zinc/18/16/15/567181615.db2.gz UZXOMDOXDOEYET-UHFFFAOYSA-N 0 0 394.185 3.207 20 5 GGBDRN O=C(CNc1ccc([N+](=O)[O-])s1)N1CCN(c2ccc(Cl)cc2)CC1 ZINC000589570120 567184225 /nfs/dbraw/zinc/18/42/25/567184225.db2.gz IRHRUXKSNHEXAH-UHFFFAOYSA-N 0 0 380.857 3.070 20 5 GGBDRN NC(=O)c1ccnc(N2CCC[C@H]2c2ccccc2Br)c1[N+](=O)[O-] ZINC000589582598 567184289 /nfs/dbraw/zinc/18/42/89/567184289.db2.gz JRWCDNHCVPMAPV-ZDUSSCGKSA-N 0 0 391.225 3.193 20 5 GGBDRN COc1ccc(Cc2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)cn1 ZINC000547133614 567185482 /nfs/dbraw/zinc/18/54/82/567185482.db2.gz DJIHVCZUKHHZGY-UHFFFAOYSA-N 0 0 391.181 3.402 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1-c1nc(Cn2cc(Br)cn2)no1 ZINC000547152844 567186008 /nfs/dbraw/zinc/18/60/08/567186008.db2.gz KCJUDUNTWGQJHU-UHFFFAOYSA-N 0 0 384.577 3.306 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(COc3cccnc3)n2)c(Br)c1 ZINC000547154072 567186031 /nfs/dbraw/zinc/18/60/31/567186031.db2.gz ZGLOEIZVVUQUEO-UHFFFAOYSA-N 0 0 391.181 3.305 20 5 GGBDRN O=C(Nc1ccnn1Cc1cccc(Br)c1)c1ccc([N+](=O)[O-])[nH]1 ZINC000524174566 567186178 /nfs/dbraw/zinc/18/61/78/567186178.db2.gz WDTRKZHKBCDAIS-UHFFFAOYSA-N 0 0 390.197 3.183 20 5 GGBDRN Cc1ncncc1-c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000547153425 567186364 /nfs/dbraw/zinc/18/63/64/567186364.db2.gz FFZVZGZVSVVHBU-UHFFFAOYSA-N 0 0 376.170 3.097 20 5 GGBDRN O=[N+]([O-])c1ccc2c(-c3nc(Cn4cc(Br)cn4)no3)c[nH]c2c1 ZINC000547158308 567186530 /nfs/dbraw/zinc/18/65/30/567186530.db2.gz YTFMJYNTYOGWKJ-UHFFFAOYSA-N 0 0 389.169 3.133 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000474657802 567186803 /nfs/dbraw/zinc/18/68/03/567186803.db2.gz GUZWLTBTYAVFMK-SNVBAGLBSA-N 0 0 393.610 3.157 20 5 GGBDRN CCc1ccc(-c2nc(Cn3cc(Br)cn3)no2)cc1[N+](=O)[O-] ZINC000547156377 567186934 /nfs/dbraw/zinc/18/69/34/567186934.db2.gz WTHPTUJVIHICPH-UHFFFAOYSA-N 0 0 378.186 3.215 20 5 GGBDRN CCn1[nH]c(=NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1C1CC1 ZINC000432753927 567187461 /nfs/dbraw/zinc/18/74/61/567187461.db2.gz GYEWVEFKSSXQGG-UHFFFAOYSA-N 0 0 379.214 3.125 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3ccc(Br)cc3C)no2)c1[N+](=O)[O-] ZINC000547177729 567188541 /nfs/dbraw/zinc/18/85/41/567188541.db2.gz JLWPPSJCEJNEIW-UHFFFAOYSA-N 0 0 392.213 3.348 20 5 GGBDRN CC[C@@H](NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)[C@@H](O)C(F)(F)F ZINC000498574246 567188776 /nfs/dbraw/zinc/18/87/76/567188776.db2.gz XNAQZDPOSGVUIL-MWLCHTKSSA-N 0 0 399.163 3.097 20 5 GGBDRN Cc1c(Cc2noc(-c3cc(S(C)(=O)=O)cs3)n2)cccc1[N+](=O)[O-] ZINC000547193506 567190099 /nfs/dbraw/zinc/19/00/99/567190099.db2.gz CCPAQIBHISLEEX-UHFFFAOYSA-N 0 0 379.419 3.009 20 5 GGBDRN O=C(N=c1cc(-c2ccccc2)[nH][nH]1)c1ccc([N+](=O)[O-])cc1Br ZINC000524255071 567190119 /nfs/dbraw/zinc/19/01/19/567190119.db2.gz FHHPIMBXNSMILT-UHFFFAOYSA-N 0 0 387.193 3.422 20 5 GGBDRN C[C@@H]1Cc2cc(S(=O)(=O)NCc3ccc([N+](=O)[O-])cc3)cc(Cl)c2O1 ZINC000524243811 567190849 /nfs/dbraw/zinc/19/08/49/567190849.db2.gz PGPZZIUMHMJTCF-SNVBAGLBSA-N 0 0 382.825 3.050 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCc1ccc(Cl)c(C)c1 ZINC000589703085 567192084 /nfs/dbraw/zinc/19/20/84/567192084.db2.gz FHEMNAWYSLGMAQ-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CCc2c1cccc2Br ZINC000524335002 567193901 /nfs/dbraw/zinc/19/39/01/567193901.db2.gz WKCFMFDYQPEXEK-CYBMUJFWSA-N 0 0 397.250 3.323 20 5 GGBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1NCc1nc(CO)cs1 ZINC000432822620 567194467 /nfs/dbraw/zinc/19/44/67/567194467.db2.gz NGNCNRYCPPHNCA-UHFFFAOYSA-N 0 0 384.286 3.205 20 5 GGBDRN CCOc1ccccc1CCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000524314302 567194488 /nfs/dbraw/zinc/19/44/88/567194488.db2.gz MFDCDOFWOOADIU-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN COc1cccc(N2CC[C@@H](Nc3ncc(Br)cc3[N+](=O)[O-])C2)c1 ZINC000474769966 567197791 /nfs/dbraw/zinc/19/77/91/567197791.db2.gz DQNUPHYFFDKNGJ-GFCCVEGCSA-N 0 0 393.241 3.452 20 5 GGBDRN Cc1ccc(C(=O)NCc2ccccc2[N+](=O)[O-])cc1I ZINC000524383259 567197935 /nfs/dbraw/zinc/19/79/35/567197935.db2.gz VPFUPJJHARLHBD-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN CS(=O)(=O)Cc1ccc(Nc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000474778987 567198795 /nfs/dbraw/zinc/19/87/95/567198795.db2.gz GEDDASDOTALFFB-UHFFFAOYSA-N 0 0 386.227 3.041 20 5 GGBDRN COC(=O)[C@@H](CNc1ncc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000474779592 567198804 /nfs/dbraw/zinc/19/88/04/567198804.db2.gz WYXFJLJHQMHVBQ-LBPRGKRZSA-N 0 0 380.198 3.121 20 5 GGBDRN CCCCCNC(=O)C1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000474785934 567198847 /nfs/dbraw/zinc/19/88/47/567198847.db2.gz WNRDAFMFDVULDA-UHFFFAOYSA-N 0 0 399.289 3.275 20 5 GGBDRN COCCNc1ccc(CNc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000474785504 567198915 /nfs/dbraw/zinc/19/89/15/567198915.db2.gz SMHLQTCYVZJOET-UHFFFAOYSA-N 0 0 381.230 3.423 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(C3CC3)CC2)c(Br)c1 ZINC000589925156 567199150 /nfs/dbraw/zinc/19/91/50/567199150.db2.gz DYFLWGVVLBHDSO-UHFFFAOYSA-N 0 0 389.271 3.168 20 5 GGBDRN COc1ccc(OCCN(C)c2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000474786493 567199273 /nfs/dbraw/zinc/19/92/73/567199273.db2.gz TUROEKDVGGIIHG-UHFFFAOYSA-N 0 0 382.214 3.276 20 5 GGBDRN COc1cc(Br)cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000498771214 567199471 /nfs/dbraw/zinc/19/94/71/567199471.db2.gz REFGYBQFWAQXDY-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCCc2cccs2)c2ncccc12 ZINC000547332978 567201469 /nfs/dbraw/zinc/20/14/69/567201469.db2.gz MFPSKGOQSUNEMB-UHFFFAOYSA-N 0 0 377.447 3.116 20 5 GGBDRN CN(Cc1ccc(F)c(Cl)c1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000432879667 567201785 /nfs/dbraw/zinc/20/17/85/567201785.db2.gz UWNUECFNNSZHCB-UHFFFAOYSA-N 0 0 378.834 3.489 20 5 GGBDRN COc1ccc2c(c1)CCCN(S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)C2 ZINC000547351356 567203119 /nfs/dbraw/zinc/20/31/19/567203119.db2.gz DSOLECROENSBLK-UHFFFAOYSA-N 0 0 382.463 3.110 20 5 GGBDRN CN(CCSc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Cc1ccccc1 ZINC000432916016 567203947 /nfs/dbraw/zinc/20/39/47/567203947.db2.gz GQHCKZRNEKMFBK-UHFFFAOYSA-N 0 0 380.491 3.222 20 5 GGBDRN CN(CCSc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])Cc1ccccc1 ZINC000432924575 567204583 /nfs/dbraw/zinc/20/45/83/567204583.db2.gz MSURJRDTHHMFTC-UHFFFAOYSA-N 0 0 380.491 3.222 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc(Br)c2ccccc2c1 ZINC000590097544 567207334 /nfs/dbraw/zinc/20/73/34/567207334.db2.gz UVCAWSBRSIIFLV-UHFFFAOYSA-N 0 0 389.209 3.137 20 5 GGBDRN C[C@@H](Cc1cccc(O)c1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000432986149 567212930 /nfs/dbraw/zinc/21/29/30/567212930.db2.gz PYKQHAXDJGMRSZ-JTQLQIEISA-N 0 0 379.210 3.424 20 5 GGBDRN CSc1ccc(-c2nsc(NC(=O)c3cc([N+](=O)[O-])cn3C)n2)cc1 ZINC000524769735 567213614 /nfs/dbraw/zinc/21/36/14/567213614.db2.gz DLDHXNXUVVQGCE-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCNc2ncccc2I)cc1 ZINC000524843255 567216720 /nfs/dbraw/zinc/21/67/20/567216720.db2.gz BKFYFNPEBOJYDW-UHFFFAOYSA-N 0 0 385.161 3.085 20 5 GGBDRN C[C@H](CCNS(=O)(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000567093789 567217187 /nfs/dbraw/zinc/21/71/87/567217187.db2.gz FHKPQLYFBGWEBV-GFCCVEGCSA-N 0 0 383.857 3.417 20 5 GGBDRN Cc1nc2ccc(Br)cn2c1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000475012239 567219624 /nfs/dbraw/zinc/21/96/24/567219624.db2.gz GEDQSWOLIJREJH-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccnn1C ZINC000616014660 567221906 /nfs/dbraw/zinc/22/19/06/567221906.db2.gz ZKYMTJGGYRAZIU-CYBMUJFWSA-N 0 0 395.257 3.260 20 5 GGBDRN O=C(N=c1cc(-c2cccs2)[nH][nH]1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000433096511 567221931 /nfs/dbraw/zinc/22/19/31/567221931.db2.gz DVJKAPBMBGLQQE-UHFFFAOYSA-N 0 0 393.222 3.483 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@@H](Oc2cncc(Br)c2)C1 ZINC000590390596 567222878 /nfs/dbraw/zinc/22/28/78/567222878.db2.gz REMUERBDIMYSQL-SNVBAGLBSA-N 0 0 398.238 3.107 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000590390595 567223021 /nfs/dbraw/zinc/22/30/21/567223021.db2.gz REMUERBDIMYSQL-JTQLQIEISA-N 0 0 398.238 3.107 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CC[C@@H](Oc2cncc(Br)c2)C1 ZINC000590389607 567223074 /nfs/dbraw/zinc/22/30/74/567223074.db2.gz BHIYFTZWXYUELK-GFCCVEGCSA-N 0 0 392.209 3.046 20 5 GGBDRN Cc1ccnc(NC(=O)CN(C)c2cc(C)c([N+](=O)[O-])cc2Br)c1 ZINC000616058178 567224150 /nfs/dbraw/zinc/22/41/50/567224150.db2.gz QXTJTXNLFFKFCM-UHFFFAOYSA-N 0 0 393.241 3.444 20 5 GGBDRN O=C(NC[C@H]1CCCN(CC(F)(F)F)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000590401414 567224253 /nfs/dbraw/zinc/22/42/53/567224253.db2.gz DPMVEPRZNHQYJA-SNVBAGLBSA-N 0 0 379.766 3.252 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@](O)(C(F)(F)F)C1 ZINC000590425011 567225830 /nfs/dbraw/zinc/22/58/30/567225830.db2.gz CTSZWDMRGIVEHD-YMTOWFKASA-N 0 0 378.372 3.283 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[C@@](O)(C(F)(F)F)C1 ZINC000590432514 567226024 /nfs/dbraw/zinc/22/60/24/567226024.db2.gz QUQDAQORUWMWRO-RNCFNFMXSA-N 0 0 398.790 3.302 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](CO)c2ccc(Br)c(F)c2)cc([N+](=O)[O-])c1 ZINC000590456579 567227195 /nfs/dbraw/zinc/22/71/95/567227195.db2.gz KTZGNCFEIICXFT-HNNXBMFYSA-N 0 0 397.200 3.268 20 5 GGBDRN Cc1c(Cn2nnc(Cc3ccccc3Br)n2)cccc1[N+](=O)[O-] ZINC000499163224 567229064 /nfs/dbraw/zinc/22/90/64/567229064.db2.gz YRIUZLOTPZBWPV-UHFFFAOYSA-N 0 0 388.225 3.291 20 5 GGBDRN CC(C)(C)Cc1cc(=NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[nH][nH]1 ZINC000433177060 567229406 /nfs/dbraw/zinc/22/94/06/567229406.db2.gz RUECMWFZTOSKJG-UHFFFAOYSA-N 0 0 381.230 3.343 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@@H](CO)CC(F)(F)F ZINC000475189347 567231465 /nfs/dbraw/zinc/23/14/65/567231465.db2.gz AGBMXTHSBSHNOJ-SSDOTTSWSA-N 0 0 375.225 3.048 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCc2cscc2C(F)(F)F)cc1 ZINC000567283988 567233654 /nfs/dbraw/zinc/23/36/54/567233654.db2.gz BNCANFXCNJFVIZ-UHFFFAOYSA-N 0 0 394.396 3.239 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@H](C)S1 ZINC000525188083 567233730 /nfs/dbraw/zinc/23/37/30/567233730.db2.gz WVOFDXIPOYOKGA-YUMQZZPRSA-N 0 0 385.294 3.416 20 5 GGBDRN O=C(c1cccc(Cl)c1)N1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1 ZINC000590574952 567233938 /nfs/dbraw/zinc/23/39/38/567233938.db2.gz QIRSWSBVFWCYOG-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN Cc1ccn2c(=O)cc(COc3ccc(Br)cc3[N+](=O)[O-])nc2c1 ZINC000525188120 567234180 /nfs/dbraw/zinc/23/41/80/567234180.db2.gz FFMGLHZWNPJHAA-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN CC(C)(CNS(=O)(=O)c1cccnc1[N+](=O)[O-])c1c(F)cccc1Cl ZINC000525188337 567234428 /nfs/dbraw/zinc/23/44/28/567234428.db2.gz FVWAGDYBFZFZLT-UHFFFAOYSA-N 0 0 387.820 3.038 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@H](C)S1 ZINC000525188082 567234781 /nfs/dbraw/zinc/23/47/81/567234781.db2.gz WVOFDXIPOYOKGA-OCAPTIKFSA-N 0 0 385.294 3.416 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NCCC(F)(F)F ZINC000525190814 567234848 /nfs/dbraw/zinc/23/48/48/567234848.db2.gz NZSNXZDFNHHQTR-UHFFFAOYSA-N 0 0 381.376 3.134 20 5 GGBDRN COc1cc(Br)ccc1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000499278270 567235114 /nfs/dbraw/zinc/23/51/14/567235114.db2.gz YUURVSWLFJENBM-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cc(Br)c2c(c1)OCCO2 ZINC000499293276 567237050 /nfs/dbraw/zinc/23/70/50/567237050.db2.gz HVTOQGBHPBMYNK-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN Cc1nc(NC(=O)C2=Cc3cc(Br)ccc3OC2)ccc1[N+](=O)[O-] ZINC000475317614 567241060 /nfs/dbraw/zinc/24/10/60/567241060.db2.gz OAQUPWWLURUMPN-UHFFFAOYSA-N 0 0 390.193 3.475 20 5 GGBDRN O=[N+]([O-])c1ncccc1NC[C@@H](CO)Cc1cc(Br)ccc1F ZINC000590726056 567241677 /nfs/dbraw/zinc/24/16/77/567241677.db2.gz BHHVPIDSXYVEMQ-JTQLQIEISA-N 0 0 384.205 3.155 20 5 GGBDRN COc1ccc(Br)cc1C[C@@H](CO)CNc1cccnc1[N+](=O)[O-] ZINC000590733193 567241873 /nfs/dbraw/zinc/24/18/73/567241873.db2.gz MLVYUDDCLYWBLP-LLVKDONJSA-N 0 0 396.241 3.024 20 5 GGBDRN COc1ccc(C[C@@H](CO)CNc2cccnc2[N+](=O)[O-])cc1Br ZINC000590726130 567241994 /nfs/dbraw/zinc/24/19/94/567241994.db2.gz OSUSAVAWYCDWQC-GFCCVEGCSA-N 0 0 396.241 3.024 20 5 GGBDRN CC(C)Oc1cc(C(=O)N(C)c2ncc(Br)cn2)ccc1[N+](=O)[O-] ZINC000567402953 567242709 /nfs/dbraw/zinc/24/27/09/567242709.db2.gz BQUOWHMRLXLLAM-UHFFFAOYSA-N 0 0 395.213 3.211 20 5 GGBDRN O=C(COc1ccc(I)cc1[N+](=O)[O-])C1CCCC1 ZINC000475894521 567286184 /nfs/dbraw/zinc/28/61/84/567286184.db2.gz BUJKGQGVZIMGFK-UHFFFAOYSA-N 0 0 375.162 3.338 20 5 GGBDRN Cc1nc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])sc1Br ZINC000455216953 567248404 /nfs/dbraw/zinc/24/84/04/567248404.db2.gz VNEUOGHBQHIZES-UHFFFAOYSA-N 0 0 399.270 3.464 20 5 GGBDRN CSCC[C@@H](C)N(C)c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000433431622 567248701 /nfs/dbraw/zinc/24/87/01/567248701.db2.gz WUDXMFIIPRCEIH-LLVKDONJSA-N 0 0 382.873 3.372 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1cc2ccccc2[nH]1 ZINC000433441079 567249659 /nfs/dbraw/zinc/24/96/59/567249659.db2.gz BBLKBLOEETVONH-UHFFFAOYSA-N 0 0 379.825 3.251 20 5 GGBDRN COc1cc(C(=O)N(C)c2ccc(Br)cn2)cc([N+](=O)[O-])c1OC ZINC000525558934 567253183 /nfs/dbraw/zinc/25/31/83/567253183.db2.gz PIDCZAIVPUMCHB-UHFFFAOYSA-N 0 0 396.197 3.046 20 5 GGBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)CCn1cc(Br)cn1 ZINC000590872510 567254962 /nfs/dbraw/zinc/25/49/62/567254962.db2.gz ISESWDKXRDAURC-UHFFFAOYSA-N 0 0 396.245 3.403 20 5 GGBDRN COc1ccc(NC(=O)COc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000525626237 567257332 /nfs/dbraw/zinc/25/73/32/567257332.db2.gz NFDIZKVFUHOLQL-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN CN(CCOc1ccc(Br)cc1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000499606918 567260033 /nfs/dbraw/zinc/26/00/33/567260033.db2.gz BYBFMPCVFXZWHM-UHFFFAOYSA-N 0 0 394.225 3.091 20 5 GGBDRN Cc1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1I ZINC000499603403 567260164 /nfs/dbraw/zinc/26/01/64/567260164.db2.gz HXQMCDJQBVYGJR-UHFFFAOYSA-N 0 0 397.172 3.342 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N1CCC[C@@H]1Cc1ccccc1Cl ZINC000525700566 567260197 /nfs/dbraw/zinc/26/01/97/567260197.db2.gz WVSAOXBGCOHLOZ-CYBMUJFWSA-N 0 0 381.841 3.039 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCCc1nc2cc(Cl)ccc2s1 ZINC000499621869 567261805 /nfs/dbraw/zinc/26/18/05/567261805.db2.gz WCEBHPWOIJTGLL-UHFFFAOYSA-N 0 0 376.825 3.413 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[C@@H](CO)C1 ZINC000567642253 567262719 /nfs/dbraw/zinc/26/27/19/567262719.db2.gz YRCBBFFLQVGWAT-NWDGAFQWSA-N 0 0 385.258 3.194 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(Cc2cc[nH]c(=O)c2Br)n1 ZINC000567649479 567264133 /nfs/dbraw/zinc/26/41/33/567264133.db2.gz UXUUKFJBXJULLO-UHFFFAOYSA-N 0 0 391.181 3.407 20 5 GGBDRN Cc1c(Br)cc(-c2nc(-c3ccc([N+](=O)[O-])s3)no2)c(=O)n1C ZINC000567649097 567264348 /nfs/dbraw/zinc/26/43/48/567264348.db2.gz DFDXGTFHUWDCMZ-UHFFFAOYSA-N 0 0 397.210 3.143 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCCO[C@@H]2c2cnn(C)c2)ncc1[N+](=O)[O-] ZINC000433647339 567264904 /nfs/dbraw/zinc/26/49/04/567264904.db2.gz WLGBBCTYPSGHQB-SMDDNHRTSA-N 0 0 396.245 3.126 20 5 GGBDRN CC(C)N(CC1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000567676242 567266927 /nfs/dbraw/zinc/26/69/27/567266927.db2.gz NBQFKBCHYZYHSL-UHFFFAOYSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(Br)cc1 ZINC000475675968 567267255 /nfs/dbraw/zinc/26/72/55/567267255.db2.gz VORSZMAOAAQSPU-INIZCTEOSA-N 0 0 390.237 3.030 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC2(CCC2)S(=O)(=O)CC1 ZINC000591195711 567268457 /nfs/dbraw/zinc/26/84/57/567268457.db2.gz AIRKOLUJWUQJSX-UHFFFAOYSA-N 0 0 378.372 3.161 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CC2(CCC2)c2cc(Br)ccc21 ZINC000433735449 567268787 /nfs/dbraw/zinc/26/87/87/567268787.db2.gz LVHSWTSKPLMORM-UHFFFAOYSA-N 0 0 391.225 3.022 20 5 GGBDRN O=[N+]([O-])c1cccc2ncnc(NCc3ccc(F)cc3Br)c21 ZINC000547960355 567269555 /nfs/dbraw/zinc/26/95/55/567269555.db2.gz KSOSGXIUMOMOGD-UHFFFAOYSA-N 0 0 377.173 3.474 20 5 GGBDRN Cc1nccc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1Br ZINC000525848784 567269938 /nfs/dbraw/zinc/26/99/38/567269938.db2.gz YVCWGADDASOUHZ-UHFFFAOYSA-N 0 0 399.632 3.458 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000455408966 567270454 /nfs/dbraw/zinc/27/04/54/567270454.db2.gz ZPQUVLHBKXSGCG-JRPNMDOOSA-N 0 0 398.257 3.372 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCc2ccc(Br)c(F)c2)c1[N+](=O)[O-] ZINC000433751510 567270520 /nfs/dbraw/zinc/27/05/20/567270520.db2.gz MZIAHUDPXWVRDS-UHFFFAOYSA-N 0 0 385.193 3.273 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000433738474 567270695 /nfs/dbraw/zinc/27/06/95/567270695.db2.gz DTKRTPLLFQHZRU-UHFFFAOYSA-N 0 0 385.294 3.418 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC[C@H](OCC2CC2)C1 ZINC000547982533 567270767 /nfs/dbraw/zinc/27/07/67/567270767.db2.gz WEZXKTLZMCLKEE-ZDUSSCGKSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1 ZINC000455408965 567271049 /nfs/dbraw/zinc/27/10/49/567271049.db2.gz ZPQUVLHBKXSGCG-HFAKWTLXSA-N 0 0 398.257 3.372 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC[C@@H](OCC2CC2)C1 ZINC000547982532 567271664 /nfs/dbraw/zinc/27/16/64/567271664.db2.gz WEZXKTLZMCLKEE-CYBMUJFWSA-N 0 0 383.242 3.389 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1CC[C@H](C2CCC2)C1 ZINC000591333448 567274785 /nfs/dbraw/zinc/27/47/85/567274785.db2.gz DAOFECARMMYLKP-NSHDSACASA-N 0 0 378.372 3.424 20 5 GGBDRN CCOc1cc(Br)c(NC(=O)c2c[nH]nc2[N+](=O)[O-])cc1OCC ZINC000591317316 567274815 /nfs/dbraw/zinc/27/48/15/567274815.db2.gz HOTTYOXFYPQXFV-UHFFFAOYSA-N 0 0 399.201 3.130 20 5 GGBDRN CC[C@H]1Cc2c(Br)cccc2CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000567768916 567275407 /nfs/dbraw/zinc/27/54/07/567275407.db2.gz DJDPBTUGPDSFOA-JTQLQIEISA-N 0 0 379.214 3.058 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c1 ZINC000433831588 567275285 /nfs/dbraw/zinc/27/52/85/567275285.db2.gz NPIVIIOTPLSRLY-UHFFFAOYSA-N 0 0 397.229 3.142 20 5 GGBDRN Cc1cc(Br)cc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000548042953 567276975 /nfs/dbraw/zinc/27/69/75/567276975.db2.gz KOKNIIPADPHXIE-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000567784721 567277515 /nfs/dbraw/zinc/27/75/15/567277515.db2.gz TYNKOIZZOMSJPF-DOTOQJQBSA-N 0 0 395.253 3.449 20 5 GGBDRN CNc1nc(C(=O)N(C)CCc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000455563165 567282671 /nfs/dbraw/zinc/28/26/71/567282671.db2.gz VMWMHARPFMAGRU-UHFFFAOYSA-N 0 0 393.241 3.109 20 5 GGBDRN CSc1ccccc1NC(=O)[C@@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000526019882 567283129 /nfs/dbraw/zinc/28/31/29/567283129.db2.gz SOKGRHVMDSSXOQ-LLVKDONJSA-N 0 0 380.447 3.118 20 5 GGBDRN CNc1ccc(C(=O)N[C@H](C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000526024614 567283377 /nfs/dbraw/zinc/28/33/77/567283377.db2.gz IVDRVDWRNRBWDP-SECBINFHSA-N 0 0 379.214 3.285 20 5 GGBDRN O=C(Nc1cc(Br)ccn1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000499919976 567283626 /nfs/dbraw/zinc/28/36/26/567283626.db2.gz KDUALOZDPBOARV-UHFFFAOYSA-N 0 0 377.198 3.343 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000433982666 567285473 /nfs/dbraw/zinc/28/54/73/567285473.db2.gz YTYKJBRBJHKAKP-UHFFFAOYSA-N 0 0 399.220 3.315 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCc2cc(F)ccc2Br)c1[N+](=O)[O-] ZINC000433984862 567285618 /nfs/dbraw/zinc/28/56/18/567285618.db2.gz SMDLENJIKBNWET-UHFFFAOYSA-N 0 0 385.193 3.273 20 5 GGBDRN O=C(COc1ccc(I)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000475899467 567285974 /nfs/dbraw/zinc/28/59/74/567285974.db2.gz RYQZDEWJHPFBRE-UHFFFAOYSA-N 0 0 397.168 3.390 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(CO)c1)Cc1ccc(Br)cc1 ZINC000475893170 567286079 /nfs/dbraw/zinc/28/60/79/567286079.db2.gz VINRLPOZUUTIMF-UHFFFAOYSA-N 0 0 380.194 3.040 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2cc(Br)cc(F)c2C1 ZINC000500037741 567293602 /nfs/dbraw/zinc/29/36/02/567293602.db2.gz UVKDOFXPRJTHAL-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)c2ccc([N+](=O)[O-])o2)nc1C(F)(F)F ZINC000567995441 567296603 /nfs/dbraw/zinc/29/66/03/567296603.db2.gz KNVJGNFETDWEBB-UHFFFAOYSA-N 0 0 379.272 3.092 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1noc(C(F)F)n1 ZINC000591784340 567296871 /nfs/dbraw/zinc/29/68/71/567296871.db2.gz QNNKEKYZKWBCSC-RXMQYKEDSA-N 0 0 391.128 3.169 20 5 GGBDRN C[C@H](C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)N(C)CC(F)(F)F ZINC000476116943 567299039 /nfs/dbraw/zinc/29/90/39/567299039.db2.gz GAEWUPNZKBXKIB-QMTHXVAHSA-N 0 0 377.388 3.051 20 5 GGBDRN Cn1cc([C@@H]2N(C(=O)c3ccc([N+](=O)[O-])cc3Br)CC2(C)C)cn1 ZINC000568053708 567300440 /nfs/dbraw/zinc/30/04/40/567300440.db2.gz FEVYDIHYIQEKMB-AWEZNQCLSA-N 0 0 393.241 3.314 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000526973797 567301864 /nfs/dbraw/zinc/30/18/64/567301864.db2.gz HCWIAMZFQJKQKA-SNVBAGLBSA-N 0 0 379.214 3.313 20 5 GGBDRN C[C@@H]1OCC[C@]12CN(Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000568080416 567302992 /nfs/dbraw/zinc/30/29/92/567302992.db2.gz FPYBFTQKHQDUHB-WQGACYEGSA-N 0 0 385.258 3.126 20 5 GGBDRN C[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])Oc1ccc(Br)cc1 ZINC000500166617 567303896 /nfs/dbraw/zinc/30/38/96/567303896.db2.gz WUMVFMRDHQDQOI-SNVBAGLBSA-N 0 0 394.225 3.137 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CC2(CCC2)c2cc(Br)ccc21 ZINC000434376623 567306951 /nfs/dbraw/zinc/30/69/51/567306951.db2.gz GFEWKGTYJJQLAR-UHFFFAOYSA-N 0 0 391.225 3.173 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1cc(OC)c(O)cc1Br ZINC000591997856 567308782 /nfs/dbraw/zinc/30/87/82/567308782.db2.gz DKAAMJYRWDFNJX-UHFFFAOYSA-N 0 0 385.218 3.208 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(Br)c(F)c1 ZINC000500271219 567310485 /nfs/dbraw/zinc/31/04/85/567310485.db2.gz ABQOIEZWRUYDOW-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN CN(C[C@H]1COc2ccccc2O1)c1c(Br)cncc1[N+](=O)[O-] ZINC000500272041 567311086 /nfs/dbraw/zinc/31/10/86/567311086.db2.gz MGIXKOWHRWVGCT-JTQLQIEISA-N 0 0 380.198 3.029 20 5 GGBDRN Cc1ccccc1CN1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000500263649 567311249 /nfs/dbraw/zinc/31/12/49/567311249.db2.gz URMVKUHRCKIMMJ-UHFFFAOYSA-N 0 0 391.269 3.383 20 5 GGBDRN C[C@H](Nc1c(Br)cncc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000500290985 567312114 /nfs/dbraw/zinc/31/21/14/567312114.db2.gz VZSLXOQEZTWCEZ-AUADJRAKSA-N 0 0 384.255 3.085 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCc1ncoc1-c1ccccc1 ZINC000500290584 567312613 /nfs/dbraw/zinc/31/26/13/567312613.db2.gz SRWFNNZBBMSNFG-UHFFFAOYSA-N 0 0 375.182 3.441 20 5 GGBDRN O=C(N[C@@H]1COc2cc(F)c(Br)cc21)c1cccc([N+](=O)[O-])c1 ZINC000500318381 567313517 /nfs/dbraw/zinc/31/35/17/567313517.db2.gz AJBUCJRPHYBDAA-CYBMUJFWSA-N 0 0 381.157 3.360 20 5 GGBDRN O=[N+]([O-])c1ccc(CSCc2nnnn2CC2CCOCC2)c(Cl)c1 ZINC000434624845 567315964 /nfs/dbraw/zinc/31/59/64/567315964.db2.gz BAKQXWYPDUMIQI-UHFFFAOYSA-N 0 0 383.861 3.095 20 5 GGBDRN O=c1c(Cl)c(NCC2CCSCC2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000500384240 567317535 /nfs/dbraw/zinc/31/75/35/567317535.db2.gz DEPURUJGNQCVOM-UHFFFAOYSA-N 0 0 380.857 3.349 20 5 GGBDRN CCCN(Cc1ccccc1Br)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000476345408 567317435 /nfs/dbraw/zinc/31/74/35/567317435.db2.gz BHKAROGFNHXVGL-UHFFFAOYSA-N 0 0 381.230 3.143 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2cc(F)cc(F)c2)c(Cl)c1 ZINC000500376326 567317650 /nfs/dbraw/zinc/31/76/50/567317650.db2.gz DLRWUGCKHMMZPP-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN CCOc1cc(CS(=O)(=O)Cc2nc(C3CC3)cs2)ccc1[N+](=O)[O-] ZINC000434640695 567317648 /nfs/dbraw/zinc/31/76/48/567317648.db2.gz NRXNBLWAJYTNMG-UHFFFAOYSA-N 0 0 382.463 3.442 20 5 GGBDRN O=C(NCc1ccc(O)c(Br)c1)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000476392505 567320585 /nfs/dbraw/zinc/32/05/85/567320585.db2.gz PERPOBXZDNUMHE-UHFFFAOYSA-N 0 0 390.193 3.474 20 5 GGBDRN COc1cc(C)cc(C)c1S(=O)(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000434751468 567324491 /nfs/dbraw/zinc/32/44/91/567324491.db2.gz GCCDCTHMNVTTJQ-UHFFFAOYSA-N 0 0 384.841 3.352 20 5 GGBDRN COc1c(C(=O)N=c2cc(-c3ccc(Cl)s3)[nH][nH]2)cccc1[N+](=O)[O-] ZINC000476480105 567327143 /nfs/dbraw/zinc/32/71/43/567327143.db2.gz HWOQEBJIIQCLCS-UHFFFAOYSA-N 0 0 378.797 3.383 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSc1nnc(-c2cccc(Br)c2)o1 ZINC000476498428 567328167 /nfs/dbraw/zinc/32/81/67/567328167.db2.gz AWYBQNVSNXJXIZ-UHFFFAOYSA-N 0 0 396.226 3.433 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@@H](CO)CC1CCCC1 ZINC000500532430 567328776 /nfs/dbraw/zinc/32/87/76/567328776.db2.gz LYAGBWHSSKCTPM-ZDUSSCGKSA-N 0 0 399.285 3.205 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)Cc2cc(Cl)ccc2F)ccc1[N+](=O)[O-] ZINC000434779475 567329404 /nfs/dbraw/zinc/32/94/04/567329404.db2.gz VSRYUMVPTHQJFG-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN Cc1cccc(F)c1S(=O)(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000476507454 567330194 /nfs/dbraw/zinc/33/01/94/567330194.db2.gz ICZWARMKANHPBY-MRXNPFEDSA-N 0 0 382.438 3.479 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSc1nnc2c(Cl)cc(C(F)(F)F)cn12 ZINC000476515525 567331232 /nfs/dbraw/zinc/33/12/32/567331232.db2.gz IZTTUBCSIAKZLK-UHFFFAOYSA-N 0 0 392.750 3.336 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSc1nnc(COc2ccc(Cl)cc2)o1 ZINC000476522931 567332503 /nfs/dbraw/zinc/33/25/03/567332503.db2.gz SIOCPBJNXUNTTI-UHFFFAOYSA-N 0 0 381.801 3.236 20 5 GGBDRN C[C@@H](C(=O)N[C@@H](CO)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000617758655 567333071 /nfs/dbraw/zinc/33/30/71/567333071.db2.gz AROZDFNDBPOCLZ-BZNIZROVSA-N 0 0 393.237 3.311 20 5 GGBDRN O=C(NC[C@@H](CO)CC1CCCC1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000500603263 567333086 /nfs/dbraw/zinc/33/30/86/567333086.db2.gz WQZSTEFVYVFVRR-LBPRGKRZSA-N 0 0 385.258 3.276 20 5 GGBDRN CSc1cccc(C(=O)N2CCC([C@H](O)C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000548581423 567333482 /nfs/dbraw/zinc/33/34/82/567333482.db2.gz OINFFVVIDAMBNZ-ZDUSSCGKSA-N 0 0 378.372 3.092 20 5 GGBDRN C[C@H]1c2c(Cl)cc(Cl)cc2CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000434908313 567334836 /nfs/dbraw/zinc/33/48/36/567334836.db2.gz ZNWNLUQTJUZBAS-HZMBPMFUSA-N 0 0 385.251 3.078 20 5 GGBDRN NC(=O)[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000434952386 567335823 /nfs/dbraw/zinc/33/58/23/567335823.db2.gz UDQLWHXUBFRDBJ-LLVKDONJSA-N 0 0 385.605 3.044 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2cc([N-]S(=O)(=O)c3ccc(Cl)cc3)n[nH]2)c1 ZINC000434964675 567336113 /nfs/dbraw/zinc/33/61/13/567336113.db2.gz BPFYKDVNXGQGGO-UHFFFAOYSA-N 0 0 378.797 3.439 20 5 GGBDRN Cc1cccc(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1Br ZINC000434949620 567336209 /nfs/dbraw/zinc/33/62/09/567336209.db2.gz CZKQWEXWDSKYDN-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CC[C@H]1CN(c2nnc(CSc3ccccc3[N+](=O)[O-])n2C)CCS1 ZINC000592401105 567336420 /nfs/dbraw/zinc/33/64/20/567336420.db2.gz AIUXOEPVXWULLF-LBPRGKRZSA-N 0 0 379.511 3.347 20 5 GGBDRN C[C@@H](Cc1nc(-c2ccc([N+](=O)[O-])s2)no1)n1cc(Br)cn1 ZINC000592408734 567336490 /nfs/dbraw/zinc/33/64/90/567336490.db2.gz KUTWDRDKHBBQGI-ZETCQYMHSA-N 0 0 384.215 3.469 20 5 GGBDRN O=C(NCc1c(Cl)cccc1Cl)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000527459537 567336391 /nfs/dbraw/zinc/33/63/91/567336391.db2.gz DWLHQINALWLBDF-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN CCn1c(CSc2ccccc2[N+](=O)[O-])nnc1N1CCSC[C@H]1C ZINC000592409661 567336872 /nfs/dbraw/zinc/33/68/72/567336872.db2.gz GBVGRSDTTRPBFU-GFCCVEGCSA-N 0 0 379.511 3.440 20 5 GGBDRN Cc1cc(Br)c2c(c1)CN(C(=O)c1cc([N+](=O)[O-])cn1C)CC2 ZINC000548619991 567337755 /nfs/dbraw/zinc/33/77/55/567337755.db2.gz RYTJRVMMWQZPGX-UHFFFAOYSA-N 0 0 378.226 3.203 20 5 GGBDRN CC[C@@H]1[C@H](C)CCN1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000476598042 567338306 /nfs/dbraw/zinc/33/83/06/567338306.db2.gz HMTNUGCVZDWQPH-NOZJJQNGSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc(Cl)c1S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000617841692 567341019 /nfs/dbraw/zinc/34/10/19/567341019.db2.gz OJHJRIMBUACKSN-SNVBAGLBSA-N 0 0 382.825 3.394 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)NCCOc1c(Cl)cc(Cl)cc1Cl ZINC000476672178 567344070 /nfs/dbraw/zinc/34/40/70/567344070.db2.gz WUXVSAYUROJGBZ-UHFFFAOYSA-N 0 0 393.614 3.097 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(Cl)c(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000500776014 567344434 /nfs/dbraw/zinc/34/44/34/567344434.db2.gz CTNCRPSQAVTRLR-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN O=C(Nc1nc(-c2cccc(Br)c2)cs1)c1c[nH]nc1[N+](=O)[O-] ZINC000548747788 567346124 /nfs/dbraw/zinc/34/61/24/567346124.db2.gz VFBYEKDZEWIBRR-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]([C@@H](CO)C1CC1)C1CC1 ZINC000456150396 567346389 /nfs/dbraw/zinc/34/63/89/567346389.db2.gz NULSGYYNUMLMHB-GUYCJALGSA-N 0 0 384.885 3.254 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H](C)n1cc(Br)cn1 ZINC000592573670 567346664 /nfs/dbraw/zinc/34/66/64/567346664.db2.gz JSVMVSJVDWDHOQ-VIFPVBQESA-N 0 0 383.202 3.152 20 5 GGBDRN Cc1ccc(SCCNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000500815450 567347134 /nfs/dbraw/zinc/34/71/34/567347134.db2.gz BUTSPSPHJCRQLM-UHFFFAOYSA-N 0 0 380.491 3.157 20 5 GGBDRN C[C@H](CC(=O)N(C)Cc1ccccc1[N+](=O)[O-])n1cc(Br)cn1 ZINC000592578896 567347122 /nfs/dbraw/zinc/34/71/22/567347122.db2.gz GDIPRIWTVFVFRB-LLVKDONJSA-N 0 0 381.230 3.164 20 5 GGBDRN O=c1c2cc(Br)c(F)cc2ncn1CCc1ccc([N+](=O)[O-])cc1 ZINC000568674121 567347514 /nfs/dbraw/zinc/34/75/14/567347514.db2.gz SZUJPWHYQDBNLO-UHFFFAOYSA-N 0 0 392.184 3.449 20 5 GGBDRN CCOC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000456165617 567347566 /nfs/dbraw/zinc/34/75/66/567347566.db2.gz XPPQWNHYJKCITG-OCCSQVGLSA-N 0 0 399.241 3.209 20 5 GGBDRN C[C@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])n1cc(Br)cn1 ZINC000592595179 567348347 /nfs/dbraw/zinc/34/83/47/567348347.db2.gz CUOMBYSYKCQSDT-SNVBAGLBSA-N 0 0 379.214 3.094 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCSC[C@@H]1C1CC1 ZINC000456194053 567350264 /nfs/dbraw/zinc/35/02/64/567350264.db2.gz ZPKJVPCVHRDVMM-CQSZACIVSA-N 0 0 385.283 3.254 20 5 GGBDRN COc1ccc(NC(=O)C[C@H](C)n2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000592617574 567350440 /nfs/dbraw/zinc/35/04/40/567350440.db2.gz FNLNZQRSHGYDLB-VIFPVBQESA-N 0 0 383.202 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)c(Cl)c1 ZINC000435225491 567350790 /nfs/dbraw/zinc/35/07/90/567350790.db2.gz HRLFDLPUWZOUHR-XOKHGSTOSA-N 0 0 378.837 3.255 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21 ZINC000435223756 567351101 /nfs/dbraw/zinc/35/11/01/567351101.db2.gz BPFCDZOIMIOPBG-XOKHGSTOSA-N 0 0 378.837 3.255 20 5 GGBDRN Cc1ncc(NC(=O)c2ccc([N+](=O)[O-])cc2I)s1 ZINC000500911367 567352477 /nfs/dbraw/zinc/35/24/77/567352477.db2.gz PPISPICIONMZPK-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN Cc1c(NC(=O)N2CCC[C@H](C)[C@@H]2CO)cc(Br)cc1[N+](=O)[O-] ZINC000435322225 567355052 /nfs/dbraw/zinc/35/50/52/567355052.db2.gz BATDKKIJWAHLBQ-XPTSAGLGSA-N 0 0 386.246 3.290 20 5 GGBDRN C[C@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000568770681 567355252 /nfs/dbraw/zinc/35/52/52/567355252.db2.gz LDPDCRGFMMUZEA-MADCSZMMSA-N 0 0 397.254 3.293 20 5 GGBDRN Cc1c(NC(=O)N2CCC[C@@H](C)[C@@H]2CO)cc(Br)cc1[N+](=O)[O-] ZINC000435322224 567355217 /nfs/dbraw/zinc/35/52/17/567355217.db2.gz BATDKKIJWAHLBQ-OTYXRUKQSA-N 0 0 386.246 3.290 20 5 GGBDRN Cn1c(C(=O)N[C@@H]2CCc3c2ccc(F)c3Br)ccc1[N+](=O)[O-] ZINC000456263548 567355812 /nfs/dbraw/zinc/35/58/12/567355812.db2.gz FMWYMBIWSINLJL-LLVKDONJSA-N 0 0 382.189 3.252 20 5 GGBDRN O=C(NCCc1c[nH]c2ncccc12)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000500980694 567357038 /nfs/dbraw/zinc/35/70/38/567357038.db2.gz DKHZFNQPFXLWNP-UHFFFAOYSA-N 0 0 389.209 3.206 20 5 GGBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C(=O)OC(C)(C)C ZINC000592718603 567356974 /nfs/dbraw/zinc/35/69/74/567356974.db2.gz GSFDGARFXZCASB-LBPRGKRZSA-N 0 0 387.230 3.207 20 5 GGBDRN CC(C)N(Cc1cc(Br)ccc1F)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000500988705 567357195 /nfs/dbraw/zinc/35/71/95/567357195.db2.gz KSTJSJNJDIFUII-UHFFFAOYSA-N 0 0 399.220 3.281 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2CCO[C@H]2C2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435331357 567357874 /nfs/dbraw/zinc/35/78/74/567357874.db2.gz GGHQKTGUIVTURW-RISCZKNCSA-N 0 0 384.230 3.355 20 5 GGBDRN C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC2(CCCC2)O1 ZINC000592738125 567359194 /nfs/dbraw/zinc/35/91/94/567359194.db2.gz YWQNXPZYRXVCNT-GFCCVEGCSA-N 0 0 397.269 3.460 20 5 GGBDRN C[C@H]1SCC[C@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000592737355 567359558 /nfs/dbraw/zinc/35/95/58/567359558.db2.gz WIMICLXVPMTMSK-MWLCHTKSSA-N 0 0 377.388 3.426 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)c1ccc(Br)cc1C ZINC000501026354 567360194 /nfs/dbraw/zinc/36/01/94/567360194.db2.gz UZKARKRUIQXIMQ-UHFFFAOYSA-N 0 0 381.230 3.224 20 5 GGBDRN CC(C)[C@@H]1C[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000456307186 567361422 /nfs/dbraw/zinc/36/14/22/567361422.db2.gz YYUBOBBQXMQGHF-CABZTGNLSA-N 0 0 388.205 3.221 20 5 GGBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N(Cc1cc(Br)ccc1F)C1CC1 ZINC000548928660 567361981 /nfs/dbraw/zinc/36/19/81/567361981.db2.gz YRDAYZQPTNMRNY-UHFFFAOYSA-N 0 0 383.177 3.024 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)[C@H](C(N)=O)c1ccc(Br)cc1 ZINC000548926835 567362000 /nfs/dbraw/zinc/36/20/00/567362000.db2.gz CXSALABQYOGSFR-INIZCTEOSA-N 0 0 392.253 3.058 20 5 GGBDRN COc1ccc(C(=O)Nc2cc(OC)c(Br)cn2)cc1[N+](=O)[O-] ZINC000477002219 567363742 /nfs/dbraw/zinc/36/37/42/567363742.db2.gz FRQCAZWQHKXKDL-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000435431055 567364313 /nfs/dbraw/zinc/36/43/13/567364313.db2.gz BMKBWEQSGRUFJL-QWHCGFSZSA-N 0 0 397.250 3.192 20 5 GGBDRN O=C(N[C@@H]1CCc2cc(O)ccc2C1)c1ccc([N+](=O)[O-])cc1Br ZINC000618250077 567365231 /nfs/dbraw/zinc/36/52/31/567365231.db2.gz NMWAKOXZZANPPV-GFCCVEGCSA-N 0 0 391.221 3.350 20 5 GGBDRN CCn1ccnc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000456354597 567365366 /nfs/dbraw/zinc/36/53/66/567365366.db2.gz NPXSCWDYVPMXKJ-SNVBAGLBSA-N 0 0 381.230 3.373 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCOc2ccc(C(F)(F)F)cc2)cc1 ZINC000477032023 567365452 /nfs/dbraw/zinc/36/54/52/567365452.db2.gz AWKIEUFELRRNQJ-UHFFFAOYSA-N 0 0 375.324 3.466 20 5 GGBDRN CCOC(=O)C[C@@H](C)N(C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501108658 567365757 /nfs/dbraw/zinc/36/57/57/567365757.db2.gz QWMSHOHYOZNKDU-SECBINFHSA-N 0 0 388.218 3.163 20 5 GGBDRN C[C@@H](c1cnn(C)c1)N(C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501121601 567365798 /nfs/dbraw/zinc/36/57/98/567365798.db2.gz XJGZWUXJQCUFJC-VIFPVBQESA-N 0 0 382.218 3.316 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000435434013 567366074 /nfs/dbraw/zinc/36/60/74/567366074.db2.gz VRNABHHFNBQDDL-UONOGXRCSA-N 0 0 382.825 3.091 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nnc(-c3cccc(Cl)c3)o2)cc1 ZINC000477034310 567366989 /nfs/dbraw/zinc/36/69/89/567366989.db2.gz XXFOSIUGJFSOMW-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN Cc1cc(C)c(NC(=O)CS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000477040756 567367186 /nfs/dbraw/zinc/36/71/86/567367186.db2.gz CANABVCJOPONRF-UHFFFAOYSA-N 0 0 382.825 3.277 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Sc1cccs1)[C@@H]1CCS(=O)(=O)C1 ZINC000435441596 567367396 /nfs/dbraw/zinc/36/73/96/567367396.db2.gz CWGSQBOFFUGKKM-SNVBAGLBSA-N 0 0 398.487 3.181 20 5 GGBDRN O=C(CS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Nc1cc(Cl)ccc1Cl ZINC000477063212 567368175 /nfs/dbraw/zinc/36/81/75/567368175.db2.gz YYZPSYZJTRMDTB-UHFFFAOYSA-N 0 0 389.216 3.314 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cccs1 ZINC000592866827 567370329 /nfs/dbraw/zinc/37/03/29/567370329.db2.gz LWISKYIMJIVUCC-CYBMUJFWSA-N 0 0 381.841 3.135 20 5 GGBDRN C[C@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])Cc1cccs1 ZINC000477084344 567370391 /nfs/dbraw/zinc/37/03/91/567370391.db2.gz DYOCCYUPWCVUDT-LBPRGKRZSA-N 0 0 383.495 3.197 20 5 GGBDRN CCOC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000456400547 567371053 /nfs/dbraw/zinc/37/10/53/567371053.db2.gz GNOPAJUUECTFNM-RISCZKNCSA-N 0 0 399.241 3.127 20 5 GGBDRN O=C(Nc1ccc(Br)cn1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000477099904 567371384 /nfs/dbraw/zinc/37/13/84/567371384.db2.gz LWTMTEKVAVGHSI-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](C1CC1)C(C)(C)CO ZINC000569000426 567372126 /nfs/dbraw/zinc/37/21/26/567372126.db2.gz NLDZBLFKFWQWMC-CQSZACIVSA-N 0 0 385.258 3.193 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](C1CC1)C(C)(C)CO ZINC000569000425 567372673 /nfs/dbraw/zinc/37/26/73/567372673.db2.gz NLDZBLFKFWQWMC-AWEZNQCLSA-N 0 0 385.258 3.193 20 5 GGBDRN CCN(CCCNc1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-])S(C)(=O)=O ZINC000549106285 567373480 /nfs/dbraw/zinc/37/34/80/567373480.db2.gz QXDLOSHDLUIVIX-UHFFFAOYSA-N 0 0 383.392 3.006 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2C[C@H](C)n3ccnc32)cc1[N+](=O)[O-] ZINC000456420965 567373744 /nfs/dbraw/zinc/37/37/44/567373744.db2.gz MWOSEGYNGZJUDI-UFBFGSQYSA-N 0 0 379.214 3.298 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2C[C@@H](C)n3ccnc32)cc1[N+](=O)[O-] ZINC000456420963 567374101 /nfs/dbraw/zinc/37/41/01/567374101.db2.gz MWOSEGYNGZJUDI-PRHODGIISA-N 0 0 379.214 3.298 20 5 GGBDRN O=C(NCC1(c2ccc(Br)cc2)CCCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000549172568 567376919 /nfs/dbraw/zinc/37/69/19/567376919.db2.gz FCMSZPQGMZEOTN-UHFFFAOYSA-N 0 0 393.241 3.322 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000435593740 567377028 /nfs/dbraw/zinc/37/70/28/567377028.db2.gz OMTFHNKBOZKNCM-SWLSCSKDSA-N 0 0 384.816 3.363 20 5 GGBDRN O=C(NCCCCSc1ccccc1Br)c1c[nH]nc1[N+](=O)[O-] ZINC000549172955 567377407 /nfs/dbraw/zinc/37/74/07/567377407.db2.gz IQTWBEDZKJGSMM-UHFFFAOYSA-N 0 0 399.270 3.383 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1NCc1ccc(F)cn1 ZINC000477172292 567377823 /nfs/dbraw/zinc/37/78/23/567377823.db2.gz UEBYGCLKMQZEIM-UHFFFAOYSA-N 0 0 377.173 3.474 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1ccnc(N(C)C)c1 ZINC000569128213 567380922 /nfs/dbraw/zinc/38/09/22/567380922.db2.gz HNJQHQPHMTZCJY-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN C[C@H](c1cccs1)c1noc(-c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)n1 ZINC000569153117 567381900 /nfs/dbraw/zinc/38/19/00/567381900.db2.gz JFHMCSZZWOQHAM-SECBINFHSA-N 0 0 379.419 3.262 20 5 GGBDRN O=C(N[C@@H]1COc2cc(F)c(Br)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000501324084 567381968 /nfs/dbraw/zinc/38/19/68/567381968.db2.gz OQERPEBRZJLEQQ-CYBMUJFWSA-N 0 0 381.157 3.360 20 5 GGBDRN CC[C@@H](C)CN(CC)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000569147278 567382240 /nfs/dbraw/zinc/38/22/40/567382240.db2.gz YQXYXQKJJVXMMM-SNVBAGLBSA-N 0 0 386.246 3.190 20 5 GGBDRN Cc1nn(Cc2ccc(I)c(Cl)c2)cc1[N+](=O)[O-] ZINC000435658361 567383248 /nfs/dbraw/zinc/38/32/48/567383248.db2.gz ZJUYLYLNVKJINP-UHFFFAOYSA-N 0 0 377.569 3.406 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CN2CCC[C@@H]2C(F)F)c1 ZINC000569174319 567383568 /nfs/dbraw/zinc/38/35/68/567383568.db2.gz WFQBKXZNAVFKCG-LLVKDONJSA-N 0 0 382.148 3.429 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000477260914 567384463 /nfs/dbraw/zinc/38/44/63/567384463.db2.gz TXZFRUSVHLKSRG-AWEZNQCLSA-N 0 0 397.204 3.111 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593085539 567384826 /nfs/dbraw/zinc/38/48/26/567384826.db2.gz YKHBNDZECPCKOB-UHFFFAOYSA-N 0 0 377.319 3.410 20 5 GGBDRN O=C(N[C@H](CC1CC1)c1cc(F)cc(Br)c1)c1c[nH]nc1[N+](=O)[O-] ZINC000549331738 567386315 /nfs/dbraw/zinc/38/63/15/567386315.db2.gz NVVBAWPRPYKTSB-CYBMUJFWSA-N 0 0 397.204 3.491 20 5 GGBDRN C[C@@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)c1ccc(S(C)(=O)=O)cc1 ZINC000618410247 567387840 /nfs/dbraw/zinc/38/78/40/567387840.db2.gz ZWUKOWKMHRCYJT-SECBINFHSA-N 0 0 379.419 3.262 20 5 GGBDRN COc1cccc(C(=O)Nc2nc3cc(Br)ccc3[nH]2)c1[N+](=O)[O-] ZINC000435823945 567391461 /nfs/dbraw/zinc/39/14/61/567391461.db2.gz BUMNWWVFKYTLBB-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN CCn1cc(S(=O)(=O)N[C@H](C)c2cc3ccccc3s2)c([N+](=O)[O-])n1 ZINC000549520286 567394760 /nfs/dbraw/zinc/39/47/60/567394760.db2.gz NJHUXEQKRHTYIF-SNVBAGLBSA-N 0 0 380.451 3.065 20 5 GGBDRN NC(=O)c1ccc(CNC2(c3ccc(Br)cc3)CC2)c([N+](=O)[O-])c1 ZINC000477464072 567396506 /nfs/dbraw/zinc/39/65/06/567396506.db2.gz LVBFAERIADUNGM-UHFFFAOYSA-N 0 0 390.237 3.235 20 5 GGBDRN C[S@@](=O)c1cccc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000477497698 567397421 /nfs/dbraw/zinc/39/74/21/567397421.db2.gz JGTKBMMSSPGMMW-RUZDIDTESA-N 0 0 381.841 3.350 20 5 GGBDRN C[S@](=O)c1cccc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000477497699 567398107 /nfs/dbraw/zinc/39/81/07/567398107.db2.gz JGTKBMMSSPGMMW-VWLOTQADSA-N 0 0 381.841 3.350 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)c1[N+](=O)[O-] ZINC000435964061 567398257 /nfs/dbraw/zinc/39/82/57/567398257.db2.gz VZOONLVDZVCOEH-CMPLNLGQSA-N 0 0 393.241 3.490 20 5 GGBDRN CO[C@H]1C[C@@H](N(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C12CCC2 ZINC000456662567 567399120 /nfs/dbraw/zinc/39/91/20/567399120.db2.gz 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O=[N+]([O-])c1cncc(Br)c1N1Cc2cnn(-c3ccccc3)c2C1 ZINC000549684169 567402761 /nfs/dbraw/zinc/40/27/61/567402761.db2.gz KKYPRQCWVLMKDY-UHFFFAOYSA-N 0 0 386.209 3.458 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1cccc(Br)c1 ZINC000501729145 567403808 /nfs/dbraw/zinc/40/38/08/567403808.db2.gz NFTOGEJSSJOGMB-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN O=C(N[C@@H]1CCC[C@H]1OC(F)F)c1ccc([N+](=O)[O-])cc1Br ZINC000501735746 567404452 /nfs/dbraw/zinc/40/44/52/567404452.db2.gz FACPRTLVBCCOCP-GHMZBOCLSA-N 0 0 379.157 3.247 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(NCCc3ccc(Br)cc3Cl)nn21 ZINC000549696619 567404741 /nfs/dbraw/zinc/40/47/41/567404741.db2.gz GJUXAMRUIOQRRT-UHFFFAOYSA-N 0 0 396.632 3.130 20 5 GGBDRN Cc1cc([C@H]2CCCN2C(=O)c2c[nH]nc2[N+](=O)[O-])ccc1Br ZINC000549773979 567410227 /nfs/dbraw/zinc/41/02/27/567410227.db2.gz SJTINLZUIYBLLY-CYBMUJFWSA-N 0 0 379.214 3.366 20 5 GGBDRN CO[C@]1(C)C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000436169733 567411279 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O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC([C@H]3CCCCO3)CC2)c(Cl)c1 ZINC000594868135 567522075 /nfs/dbraw/zinc/52/20/75/567522075.db2.gz YKLVNQNVVPFMSW-OAHLLOKOSA-N 0 0 388.873 3.218 20 5 GGBDRN CC(C)[C@]1(C)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000458117603 567523375 /nfs/dbraw/zinc/52/33/75/567523375.db2.gz UEQVRIPXLPQOIL-OCCSQVGLSA-N 0 0 388.205 3.364 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000594872161 567523382 /nfs/dbraw/zinc/52/33/82/567523382.db2.gz VODBFFBVQHCJKO-IUODEOHRSA-N 0 0 388.873 3.218 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000594872063 567523396 /nfs/dbraw/zinc/52/33/96/567523396.db2.gz URBDFIUEORQCCS-SWLSCSKDSA-N 0 0 388.873 3.218 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000594872160 567523838 /nfs/dbraw/zinc/52/38/38/567523838.db2.gz VODBFFBVQHCJKO-DOMZBBRYSA-N 0 0 388.873 3.218 20 5 GGBDRN O=c1onc(-c2cccc(Br)c2)n1Cc1cccc([N+](=O)[O-])c1 ZINC000504173233 567524339 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Cc1cc(CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)nc(C)n1 ZINC000551677118 567528330 /nfs/dbraw/zinc/52/83/30/567528330.db2.gz DFZBOTHPUAXAKX-UHFFFAOYSA-N 0 0 379.214 3.003 20 5 GGBDRN CC(C)(C)[C@H]1C[C@@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CCO1 ZINC000479379607 567529495 /nfs/dbraw/zinc/52/94/95/567529495.db2.gz SBSHSCQKOWSWHQ-GXFFZTMASA-N 0 0 376.862 3.120 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCC(=O)Nc1cccc(Br)c1 ZINC000479373808 567529503 /nfs/dbraw/zinc/52/95/03/567529503.db2.gz KBJRXIZGNTZQSM-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(c2cccc(Br)c2)CC1 ZINC000551698788 567530057 /nfs/dbraw/zinc/53/00/57/567530057.db2.gz QHPJOEIUOCZQRB-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN CC(C)(C)[C@H]1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000479383307 567530601 /nfs/dbraw/zinc/53/06/01/567530601.db2.gz YUSOASDOYCBEHG-QMTHXVAHSA-N 0 0 376.862 3.120 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CC[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000479391925 567530741 /nfs/dbraw/zinc/53/07/41/567530741.db2.gz OKGZTMJJFKLHSG-NSHDSACASA-N 0 0 389.271 3.086 20 5 GGBDRN C[C@@H](Sc1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000504356274 567531401 /nfs/dbraw/zinc/53/14/01/567531401.db2.gz VMMRKDKDNFUUEM-LLVKDONJSA-N 0 0 380.447 3.118 20 5 GGBDRN CO[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C12CCC2 ZINC000458208239 567532020 /nfs/dbraw/zinc/53/20/20/567532020.db2.gz YWLFSDAYLBILKU-KGLIPLIRSA-N 0 0 383.242 3.353 20 5 GGBDRN CCc1cccc(NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000551727658 567532990 /nfs/dbraw/zinc/53/29/90/567532990.db2.gz RDPXVCGYXWYPPA-UHFFFAOYSA-N 0 0 392.209 3.497 20 5 GGBDRN C[C@H]1CCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C[C@H](C)C1 ZINC000551727678 567533418 /nfs/dbraw/zinc/53/34/18/567533418.db2.gz GZGHOCPOKVCEOB-WDEREUQCSA-N 0 0 398.257 3.190 20 5 GGBDRN Cc1cccc(C(=O)NCC(=O)Nc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000479441782 567535985 /nfs/dbraw/zinc/53/59/85/567535985.db2.gz OYGCGNTVHQIYFZ-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN Cc1c(CN[C@H](C(N)=O)c2ccc(Br)cc2F)cccc1[N+](=O)[O-] ZINC000479481852 567539480 /nfs/dbraw/zinc/53/94/80/567539480.db2.gz ICUIFXACUPZTQP-HNNXBMFYSA-N 0 0 396.216 3.121 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CCCOc2ccccc21 ZINC000504544602 567539902 /nfs/dbraw/zinc/53/99/02/567539902.db2.gz BKXPIQVTRKTKSK-CYBMUJFWSA-N 0 0 382.825 3.440 20 5 GGBDRN CC[C@@H](C)N(CC)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000595060861 567540826 /nfs/dbraw/zinc/54/08/26/567540826.db2.gz IITQBKZAFVPLAX-SECBINFHSA-N 0 0 386.246 3.251 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000504694006 567544237 /nfs/dbraw/zinc/54/42/37/567544237.db2.gz DCGZKCJWWFJXJR-KRWDZBQOSA-N 0 0 380.853 3.469 20 5 GGBDRN COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000479604766 567547586 /nfs/dbraw/zinc/54/75/86/567547586.db2.gz WJBUNZPFCVATPI-GXFFZTMASA-N 0 0 386.857 3.140 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2cc(F)cc(Br)c2)cc1 ZINC000438859181 567550789 /nfs/dbraw/zinc/55/07/89/567550789.db2.gz OMONLFGKMAEZQW-ZDUSSCGKSA-N 0 0 386.173 3.315 20 5 GGBDRN Cc1noc(CN(C)CC(=O)Nc2ccc(Br)cc2C)c1[N+](=O)[O-] ZINC000595290767 567551378 /nfs/dbraw/zinc/55/13/78/567551378.db2.gz MSAUCQCVWHXMRX-UHFFFAOYSA-N 0 0 397.229 3.033 20 5 GGBDRN Cc1ccc(Br)cc1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000438886412 567552309 /nfs/dbraw/zinc/55/23/09/567552309.db2.gz MOBTUXBNQQNMRE-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1c(CNC(=O)NCc2ccc(O)c(Br)c2)cccc1[N+](=O)[O-] ZINC000479685956 567552528 /nfs/dbraw/zinc/55/25/28/567552528.db2.gz LDYBBNREHTUXQF-UHFFFAOYSA-N 0 0 394.225 3.371 20 5 GGBDRN COC[C@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000438897406 567553758 /nfs/dbraw/zinc/55/37/58/567553758.db2.gz VOOPLESZHRIJAJ-ZYHUDNBSSA-N 0 0 396.241 3.146 20 5 GGBDRN COC[C@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@H](C)O1 ZINC000438897400 567553880 /nfs/dbraw/zinc/55/38/80/567553880.db2.gz VOOPLESZHRIJAJ-CMPLNLGQSA-N 0 0 396.241 3.146 20 5 GGBDRN COCc1nc(Cc2noc(CSc3ccc([N+](=O)[O-])cc3)n2)cs1 ZINC000571365750 567555871 /nfs/dbraw/zinc/55/58/71/567555871.db2.gz VEVWYZQTIYJQPL-UHFFFAOYSA-N 0 0 378.435 3.464 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC3(CCCC3=O)CC2)cc1[N+](=O)[O-] ZINC000595349382 567556729 /nfs/dbraw/zinc/55/67/29/567556729.db2.gz XAOQALIMYKXOAZ-UHFFFAOYSA-N 0 0 386.857 3.081 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)N(C)C(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000479767908 567557361 /nfs/dbraw/zinc/55/73/61/567557361.db2.gz CEBXNIJHGNQTLB-GFCCVEGCSA-N 0 0 395.257 3.482 20 5 GGBDRN C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000571370852 567558154 /nfs/dbraw/zinc/55/81/54/567558154.db2.gz GBNYUIIOGICJJN-SSDOTTSWSA-N 0 0 383.177 3.163 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000438979080 567558474 /nfs/dbraw/zinc/55/84/74/567558474.db2.gz ZSSRNPLTEXHVOY-UHFFFAOYSA-N 0 0 395.746 3.487 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000438973085 567558565 /nfs/dbraw/zinc/55/85/65/567558565.db2.gz MKEVOXUPLKXBCM-UHFFFAOYSA-N 0 0 395.746 3.487 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)Cc1c(Cl)cccc1Cl ZINC000438995217 567560662 /nfs/dbraw/zinc/56/06/62/567560662.db2.gz AZOTZKFSTBMKAM-UHFFFAOYSA-N 0 0 376.221 3.263 20 5 GGBDRN CC1C[C@H]2CC[C@@H](C1)N2S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000595383001 567560836 /nfs/dbraw/zinc/56/08/36/567560836.db2.gz TZZSUCXPRZCJQA-CLYYMRHHSA-N 0 0 389.271 3.309 20 5 GGBDRN Cc1noc(CN[C@@H](C)c2cc3c(cc2Br)OCCO3)c1[N+](=O)[O-] ZINC000595413666 567561988 /nfs/dbraw/zinc/56/19/88/567561988.db2.gz FGTSWBHGMCEWLK-QMMMGPOBSA-N 0 0 398.213 3.276 20 5 GGBDRN CN(C[C@@H]1CC1(C)C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000595412988 567562684 /nfs/dbraw/zinc/56/26/84/567562684.db2.gz VHQWRHQRDFZTFC-VIFPVBQESA-N 0 0 377.260 3.024 20 5 GGBDRN Cc1noc(CN[C@@H](CO)c2ccc(Cl)cc2C(F)(F)F)c1[N+](=O)[O-] ZINC000595465309 567566851 /nfs/dbraw/zinc/56/68/51/567566851.db2.gz CBDFTMKOPWONIL-NSHDSACASA-N 0 0 379.722 3.387 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1cccc(Cl)c1 ZINC000479908801 567567287 /nfs/dbraw/zinc/56/72/87/567567287.db2.gz AFORKCIILAPTSR-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1ccccc1Cl ZINC000479932674 567570548 /nfs/dbraw/zinc/57/05/48/567570548.db2.gz ZOUXKPBVTYIPCF-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2nc3cccnc3n2C)cc1[N+](=O)[O-] ZINC000505354179 567571376 /nfs/dbraw/zinc/57/13/76/567571376.db2.gz UZECZNAJLUBOTA-UHFFFAOYSA-N 0 0 390.197 3.200 20 5 GGBDRN CSc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000479989460 567572811 /nfs/dbraw/zinc/57/28/11/567572811.db2.gz DWTBCRWWSDYAMQ-UHFFFAOYSA-N 0 0 386.882 3.491 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000439224674 567573001 /nfs/dbraw/zinc/57/30/01/567573001.db2.gz QVWRFLDEDRPPJE-KOLCDFICSA-N 0 0 391.287 3.475 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000439224675 567573274 /nfs/dbraw/zinc/57/32/74/567573274.db2.gz QVWRFLDEDRPPJE-MWLCHTKSSA-N 0 0 391.287 3.475 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)Cc1c(F)cccc1F ZINC000479988501 567573308 /nfs/dbraw/zinc/57/33/08/567573308.db2.gz DKSOHIGYLNJULN-UHFFFAOYSA-N 0 0 390.795 3.189 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2C[C@@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000439222202 567573416 /nfs/dbraw/zinc/57/34/16/567573416.db2.gz DXVYSDRYZIPANE-DTWKUNHWSA-N 0 0 377.260 3.085 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)NC/C=C\c1ccccc1 ZINC000480001569 567574169 /nfs/dbraw/zinc/57/41/69/567574169.db2.gz ZDNTXXDCEBZCPT-DAXSKMNVSA-N 0 0 397.250 3.349 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000439244867 567574376 /nfs/dbraw/zinc/57/43/76/567574376.db2.gz HYRGRVJFOFDKKJ-NXEZZACHSA-N 0 0 391.287 3.332 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)NC2CCCCC2)cc1[N+](=O)[O-] ZINC000439243068 567574669 /nfs/dbraw/zinc/57/46/69/567574669.db2.gz BDYORNBYEAEWPU-UHFFFAOYSA-N 0 0 377.260 3.277 20 5 GGBDRN CO[C@@H](c1ccccc1Cl)[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000479997507 567574729 /nfs/dbraw/zinc/57/47/29/567574729.db2.gz YXKHZSNSJOWPBM-MEDUHNTESA-N 0 0 384.841 3.303 20 5 GGBDRN CCCCOC1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000439234378 567574955 /nfs/dbraw/zinc/57/49/55/567574955.db2.gz IQEYOWIATYEZSE-UHFFFAOYSA-N 0 0 376.862 3.218 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)[C@@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000439244544 567575266 /nfs/dbraw/zinc/57/52/66/567575266.db2.gz HMPJURNHJRDHFW-JTQLQIEISA-N 0 0 379.276 3.331 20 5 GGBDRN C[C@@H]1CSC[C@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000552322876 567577798 /nfs/dbraw/zinc/57/77/98/567577798.db2.gz COENNWCHNZHYDC-BXKDBHETSA-N 0 0 377.388 3.283 20 5 GGBDRN C[C@H](c1noc(-c2cc([N+](=O)[O-])nn2C)n1)c1ccc(Br)cc1 ZINC000571629713 567578645 /nfs/dbraw/zinc/57/86/45/567578645.db2.gz MJVHWFKOHZRXKE-QMMMGPOBSA-N 0 0 378.186 3.293 20 5 GGBDRN CN(C[C@@H]1CCCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1)S(C)(=O)=O ZINC000571663435 567579983 /nfs/dbraw/zinc/57/99/83/567579983.db2.gz UVIPYURMDHCDEY-JTQLQIEISA-N 0 0 396.296 3.009 20 5 GGBDRN CN(C(=O)CSCC(=O)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])nc1 ZINC000439296861 567580908 /nfs/dbraw/zinc/58/09/08/567580908.db2.gz LMUFDHQIRBUQKR-UHFFFAOYSA-N 0 0 379.825 3.222 20 5 GGBDRN CCc1ccc(S(=O)(=O)N[C@@H](c2ncc(C)s2)C2CC2)cc1[N+](=O)[O-] ZINC000571674188 567581173 /nfs/dbraw/zinc/58/11/73/567581173.db2.gz OWZKZQIFLUCIOY-OAHLLOKOSA-N 0 0 381.479 3.352 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1cn2cc(Br)cc(C)c2n1 ZINC000480104582 567582103 /nfs/dbraw/zinc/58/21/03/567582103.db2.gz KPJRHFGWIDQYHW-UHFFFAOYSA-N 0 0 393.245 3.450 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000505584676 567585830 /nfs/dbraw/zinc/58/58/30/567585830.db2.gz HWENHVPPHCSKQM-UHFFFAOYSA-N 0 0 380.198 3.039 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1c(F)cccc1Br ZINC000552402315 567587592 /nfs/dbraw/zinc/58/75/92/567587592.db2.gz STGWAWKKVQJFDV-UHFFFAOYSA-N 0 0 379.145 3.047 20 5 GGBDRN O=[N+]([O-])c1ccc(CNCc2cn(-c3ccccc3Br)nn2)cc1 ZINC000552413188 567588333 /nfs/dbraw/zinc/58/83/33/567588333.db2.gz NJPAXIVDDCPSQY-UHFFFAOYSA-N 0 0 388.225 3.228 20 5 GGBDRN C[C@H](C(=O)Nc1cc(Cl)ccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000530298924 567590990 /nfs/dbraw/zinc/59/09/90/567590990.db2.gz CLOAVIQNNXBOOO-SECBINFHSA-N 0 0 386.788 3.188 20 5 GGBDRN O=C(N[C@@H](Cc1cccc(Br)c1)CC1CC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000552461655 567591393 /nfs/dbraw/zinc/59/13/93/567591393.db2.gz VYHBKHTYLXNCNO-CYBMUJFWSA-N 0 0 393.241 3.222 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(C)c1Cl ZINC000530325675 567591839 /nfs/dbraw/zinc/59/18/39/567591839.db2.gz BCDOMLQMWIOFAT-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1n[nH]c(C(F)(F)F)n1 ZINC000505753856 567594590 /nfs/dbraw/zinc/59/45/90/567594590.db2.gz ZLPOXUACTCEKKX-UHFFFAOYSA-N 0 0 375.332 3.486 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1Oc1ccc(C(=O)OC)cc1Br ZINC000530368541 567597132 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Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](COC(F)F)C1 ZINC000552693221 567601891 /nfs/dbraw/zinc/60/18/91/567601891.db2.gz BUIWBKPURZGAIZ-SECBINFHSA-N 0 0 393.184 3.367 20 5 GGBDRN Cc1cc(N2CCC[C@@H](N3CCCC3=O)C2)c(Br)cc1[N+](=O)[O-] ZINC000530437141 567602150 /nfs/dbraw/zinc/60/21/50/567602150.db2.gz FGMLSMKNSPICGR-GFCCVEGCSA-N 0 0 382.258 3.257 20 5 GGBDRN CO[C@@]1(C)CCCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000480413487 567602537 /nfs/dbraw/zinc/60/25/37/567602537.db2.gz RQCOGASUSQNUGX-ZDUSSCGKSA-N 0 0 383.253 3.091 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCCC2(CCC2)C1 ZINC000480425752 567603347 /nfs/dbraw/zinc/60/33/47/567603347.db2.gz KKXDYDQKFHSKAM-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN Cc1nc(C)c(Br)c(N2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000596048515 567604402 /nfs/dbraw/zinc/60/44/02/567604402.db2.gz AXLVIDKLZGTMGW-UHFFFAOYSA-N 0 0 392.257 3.091 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCc2ccc(Cl)cc21 ZINC000505981859 567605058 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GGBDRN O=[N+]([O-])c1cccc(Br)c1NCc1cccnc1N1CCOCC1 ZINC000596072748 567607151 /nfs/dbraw/zinc/60/71/51/567607151.db2.gz HEWSANFWWUIONU-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)s1 ZINC000480495141 567607965 /nfs/dbraw/zinc/60/79/65/567607965.db2.gz AYVDLVZGZUHTEE-UHFFFAOYSA-N 0 0 377.447 3.032 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(F)c(Br)c(Cl)c1 ZINC000552760253 567608090 /nfs/dbraw/zinc/60/80/90/567608090.db2.gz UWHBWYVDBOCVOW-UHFFFAOYSA-N 0 0 391.584 3.293 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])cn2C)c(C)cc1Br ZINC000552756725 567608741 /nfs/dbraw/zinc/60/87/41/567608741.db2.gz PIEPVUXNQGYLHN-UHFFFAOYSA-N 0 0 396.197 3.043 20 5 GGBDRN O=c1[nH]ccc(N2CCO[C@H](c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000596091209 567608921 /nfs/dbraw/zinc/60/89/21/567608921.db2.gz YHYTXJKZWYNXNH-ZDUSSCGKSA-N 0 0 380.198 3.036 20 5 GGBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C)[C@H](O)C(F)(F)F ZINC000572064012 567609920 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3.225 20 5 GGBDRN CCOC(=O)c1cccc(Sc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])c1 ZINC000480579541 567613579 /nfs/dbraw/zinc/61/35/79/567613579.db2.gz KTQQHLIDGKADOH-UHFFFAOYSA-N 0 0 381.431 3.326 20 5 GGBDRN CCOC(=O)c1cccc(Sc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000480584894 567613789 /nfs/dbraw/zinc/61/37/89/567613789.db2.gz VKLBEQFZQAUQKW-UHFFFAOYSA-N 0 0 387.460 3.388 20 5 GGBDRN CNS(=O)(=O)c1ccc(NCc2cc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000552878668 567615022 /nfs/dbraw/zinc/61/50/22/567615022.db2.gz IWLWAKBCKFNVOH-UHFFFAOYSA-N 0 0 377.447 3.330 20 5 GGBDRN Cc1ccc(SC[C@@H](C)Nc2ccc(S(N)(=O)=O)c([N+](=O)[O-])c2)cc1 ZINC000596197828 567615137 /nfs/dbraw/zinc/61/51/37/567615137.db2.gz XIYZLUVIJJZCTM-GFCCVEGCSA-N 0 0 381.479 3.143 20 5 GGBDRN CN(Cc1ccccc1)C(=O)CNc1ccc(Br)cc1[N+](=O)[O-] ZINC000530616711 567615261 /nfs/dbraw/zinc/61/52/61/567615261.db2.gz VKGYBWPOKXQSPH-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN CSc1ccccc1CN(C)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000480606697 567616065 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GGBDRN O=[N+]([O-])c1cccc(Br)c1NC[C@@H]1CCC2(CCOCC2)[C@@H]1O ZINC000596227954 567617736 /nfs/dbraw/zinc/61/77/36/567617736.db2.gz VAJSZXGIHPMPLK-XHDPSFHLSA-N 0 0 385.258 3.337 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1Sc1ccc(S(=O)(=O)N2CCCC2)cn1 ZINC000552910901 567617880 /nfs/dbraw/zinc/61/78/80/567617880.db2.gz CZUQNJHOKFCUSH-UHFFFAOYSA-N 0 0 383.426 3.065 20 5 GGBDRN Nc1c(C(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000530675652 567617906 /nfs/dbraw/zinc/61/79/06/567617906.db2.gz XALFFSUUKCUKQT-OLZOCXBDSA-N 0 0 376.210 3.225 20 5 GGBDRN CCOc1ccc(Br)cc1-c1noc(-c2cc([N+](=O)[O-])nn2C)n1 ZINC000572162410 567618100 /nfs/dbraw/zinc/61/81/00/567618100.db2.gz UIKHWUZUWRQQIB-UHFFFAOYSA-N 0 0 394.185 3.207 20 5 GGBDRN Cn1nccc1[C@H]1C[C@@H](Nc2c(Br)cccc2[N+](=O)[O-])CCO1 ZINC000596256487 567618223 /nfs/dbraw/zinc/61/82/23/567618223.db2.gz AXZDTJFPYAEOEW-IINYFYTJSA-N 0 0 381.230 3.423 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H](OCC(F)(F)F)C2)c(Br)c1 ZINC000530668211 567618260 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O=[N+]([O-])c1cc2c(ncnc2NCCS(=O)(=O)c2ccc(Cl)cc2)s1 ZINC000552993189 567620564 /nfs/dbraw/zinc/62/05/64/567620564.db2.gz PVWIWZBBTVNOMO-UHFFFAOYSA-N 0 0 398.853 3.139 20 5 GGBDRN Cc1cc(OCCOc2ccc(S(C)(=O)=O)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000506430439 567624864 /nfs/dbraw/zinc/62/48/64/567624864.db2.gz CBMVJCQBJAWPEK-UHFFFAOYSA-N 0 0 385.825 3.418 20 5 GGBDRN Cc1cc(OCc2csc(CS(C)(=O)=O)n2)c(Cl)cc1[N+](=O)[O-] ZINC000506434308 567625643 /nfs/dbraw/zinc/62/56/43/567625643.db2.gz URZFPBPGNBTNES-UHFFFAOYSA-N 0 0 376.843 3.137 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NCc1cccnc1N1CCCC1 ZINC000596356490 567626436 /nfs/dbraw/zinc/62/64/36/567626436.db2.gz IBGLTKNBJYLPSJ-UHFFFAOYSA-N 0 0 378.230 3.360 20 5 GGBDRN Cc1c(Br)cccc1S(=O)(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000530855924 567626621 /nfs/dbraw/zinc/62/66/21/567626621.db2.gz JWSVDCGSOCGLNN-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CCOC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cn1C ZINC000440479926 567629812 /nfs/dbraw/zinc/62/98/12/567629812.db2.gz 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ZINC000480812088 567632394 /nfs/dbraw/zinc/63/23/94/567632394.db2.gz LBWNXRZFXGOFLV-MRVPVSSYSA-N 0 0 381.186 3.107 20 5 GGBDRN Cc1c(Br)c(NCC(=O)N2Cc3ccccc3C2)ncc1[N+](=O)[O-] ZINC000480820698 567633798 /nfs/dbraw/zinc/63/37/98/567633798.db2.gz FLWGOICMTMVFCN-UHFFFAOYSA-N 0 0 391.225 3.015 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCN(c3ccc(Br)cc3)CC2)c(F)c1 ZINC000596456266 567634161 /nfs/dbraw/zinc/63/41/61/567634161.db2.gz LUUTURSYYCOAKT-UHFFFAOYSA-N 0 0 381.205 3.218 20 5 GGBDRN O=C(CNc1ccc(Br)cc1[N+](=O)[O-])N1Cc2ccccc2C1 ZINC000480841218 567635539 /nfs/dbraw/zinc/63/55/39/567635539.db2.gz BGLSOBBVJILSEB-UHFFFAOYSA-N 0 0 376.210 3.312 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H]1CCCc2c(O)cccc21 ZINC000480840542 567635578 /nfs/dbraw/zinc/63/55/78/567635578.db2.gz FMOGBCOGBCJFIJ-ZDUSSCGKSA-N 0 0 382.825 3.310 20 5 GGBDRN NS(=O)(=O)c1c(NC[C@H]2CCC[C@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000530995032 567636169 /nfs/dbraw/zinc/63/61/69/567636169.db2.gz JJFOETXDPAJODF-UWVGGRQHSA-N 0 0 381.376 3.023 20 5 GGBDRN O=C(Nc1cc(Br)ccc1O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000531015385 567637049 /nfs/dbraw/zinc/63/70/49/567637049.db2.gz YHVJMRTXURTTQW-UHFFFAOYSA-N 0 0 395.165 3.086 20 5 GGBDRN CN(c1ccccc1)[C@H]1CCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000596517576 567637057 /nfs/dbraw/zinc/63/70/57/567637057.db2.gz MZMUXZCEXMYWDX-ZDUSSCGKSA-N 0 0 377.242 3.467 20 5 GGBDRN CN(c1ccccc1)[C@@H]1CCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000596517575 567637717 /nfs/dbraw/zinc/63/77/17/567637717.db2.gz MZMUXZCEXMYWDX-CYBMUJFWSA-N 0 0 377.242 3.467 20 5 GGBDRN Cc1ccc(NC[C@H]2CCN(S(=O)(=O)c3cccs3)C2)c([N+](=O)[O-])c1 ZINC000553245082 567637953 /nfs/dbraw/zinc/63/79/53/567637953.db2.gz JOIPDYAPLGVBIC-CYBMUJFWSA-N 0 0 381.479 3.087 20 5 GGBDRN NC(=O)c1cccc(N2CCc3cc(Br)ccc3C2)c1[N+](=O)[O-] ZINC000553245597 567638191 /nfs/dbraw/zinc/63/81/91/567638191.db2.gz APVQXLVHHJRXOQ-UHFFFAOYSA-N 0 0 376.210 3.019 20 5 GGBDRN C[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@]1(C)CO ZINC000596544518 567638445 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Cn1ccnc1[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000553265957 567640727 /nfs/dbraw/zinc/64/07/27/567640727.db2.gz KEBPPXRLVJHNRH-OAHLLOKOSA-N 0 0 380.857 3.341 20 5 GGBDRN Cc1sc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)nc1-c1ccc(Cl)cc1 ZINC000506735914 567641443 /nfs/dbraw/zinc/64/14/43/567641443.db2.gz OXTDTOGDJPXVIM-UHFFFAOYSA-N 0 0 377.813 3.333 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCC3(CCCCC3)O2)c(Cl)c1 ZINC000480899615 567641678 /nfs/dbraw/zinc/64/16/78/567641678.db2.gz PUCNWRRTSLQSHO-CYBMUJFWSA-N 0 0 388.873 3.408 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NC[C@@H]1CCC2(CCCCC2)O1 ZINC000480902843 567641835 /nfs/dbraw/zinc/64/18/35/567641835.db2.gz WGSHHBKYKPTFQK-LBPRGKRZSA-N 0 0 388.873 3.408 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(Nc2ncnc3sc([N+](=O)[O-])cc32)cc1 ZINC000553288618 567641797 /nfs/dbraw/zinc/64/17/97/567641797.db2.gz IAFWDTIOCFDKQJ-UHFFFAOYSA-N 0 0 379.423 3.105 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCS(=O)(=O)c2ccc(Br)cc2)cc1 ZINC000553294116 567642038 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GGBDRN C[C@H](c1ccccc1[N+](=O)[O-])N(C)CC(=O)Nc1ccc(Br)cn1 ZINC000441493401 567666006 /nfs/dbraw/zinc/66/60/06/567666006.db2.gz SWKCCUAYDYIYHP-LLVKDONJSA-N 0 0 393.241 3.384 20 5 GGBDRN CS(=O)(=O)c1cccnc1CNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000553569196 567667140 /nfs/dbraw/zinc/66/71/40/567667140.db2.gz ZQXVHVKBQWKGFA-UHFFFAOYSA-N 0 0 376.221 3.312 20 5 GGBDRN COC(=O)c1cnc(N2CCc3ccc(Br)cc3C2)c([N+](=O)[O-])c1 ZINC000553563063 567667480 /nfs/dbraw/zinc/66/74/80/567667480.db2.gz DWCGJSRPQMRZME-UHFFFAOYSA-N 0 0 392.209 3.102 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccc(Br)c(F)c3)CC2)cn1 ZINC000507216711 567667569 /nfs/dbraw/zinc/66/75/69/567667569.db2.gz VLPZGQGWYPBIAU-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN CC(C)(C)n1cc(Br)c(C(=O)NCc2cccc([N+](=O)[O-])c2)n1 ZINC000596972322 567668144 /nfs/dbraw/zinc/66/81/44/567668144.db2.gz WLANDWQPWVOYHA-UHFFFAOYSA-N 0 0 381.230 3.239 20 5 GGBDRN Cc1c(Br)cncc1CN1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000596978442 567668165 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GGBDRN CC(C)(C)Oc1cccc(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)n1 ZINC000507373705 567677077 /nfs/dbraw/zinc/67/70/77/567677077.db2.gz VVWHFPPIKLOVBC-UHFFFAOYSA-N 0 0 382.214 3.140 20 5 GGBDRN CSc1ccc(C(=O)N2C[C@H](C(F)(F)F)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000553711458 567677683 /nfs/dbraw/zinc/67/76/83/567677683.db2.gz JSFCMNXVLMZHJP-GFCCVEGCSA-N 0 0 378.372 3.499 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCn2cc(Br)cn2)cc1OC(F)F ZINC000553728533 567679115 /nfs/dbraw/zinc/67/91/15/567679115.db2.gz WJBJWAUUPUKPOV-UHFFFAOYSA-N 0 0 377.145 3.267 20 5 GGBDRN Cc1c(CNC(=O)[C@H]2COc3ccc(Br)cc32)cccc1[N+](=O)[O-] ZINC000481488400 567681500 /nfs/dbraw/zinc/68/15/00/567681500.db2.gz FTIHPZWVWRDHTA-AWEZNQCLSA-N 0 0 391.221 3.458 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000507530783 567683449 /nfs/dbraw/zinc/68/34/49/567683449.db2.gz MXISHNIODJKWHI-UHFFFAOYSA-N 0 0 377.447 3.334 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)CCOc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000507504408 567684131 /nfs/dbraw/zinc/68/41/31/567684131.db2.gz OPCOHTUQVSBSNI-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN COc1cccc(OCCSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)c1 ZINC000507619054 567690289 /nfs/dbraw/zinc/69/02/89/567690289.db2.gz XEXSRRPHQFXUHW-UHFFFAOYSA-N 0 0 383.447 3.178 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC(C)=C(C)C2)cc1[N+](=O)[O-] ZINC000481604153 567690415 /nfs/dbraw/zinc/69/04/15/567690415.db2.gz BUNTZICSTXRBTA-UHFFFAOYSA-N 0 0 389.271 3.397 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1cc2c(c(Br)c1)OCO2 ZINC000460487606 567690718 /nfs/dbraw/zinc/69/07/18/567690718.db2.gz IMDCUMFLIRRVLF-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN Cc1cccc(OC[C@@H](O)COc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000573148640 567691220 /nfs/dbraw/zinc/69/12/20/567691220.db2.gz UBJREUXYJRWIQM-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN CC(=O)Nc1cccc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)c1 ZINC000507635773 567691689 /nfs/dbraw/zinc/69/16/89/567691689.db2.gz MYSFTDCDXBQBAP-UHFFFAOYSA-N 0 0 380.447 3.249 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2cccnc2C(F)(F)F)c(Cl)c1 ZINC000553860739 567691846 /nfs/dbraw/zinc/69/18/46/567691846.db2.gz NEGRFOPVOCEEPS-UHFFFAOYSA-N 0 0 395.746 3.141 20 5 GGBDRN O=C(COc1ccc(Br)cc1)NCCc1ccccc1[N+](=O)[O-] ZINC000460502769 567691798 /nfs/dbraw/zinc/69/17/98/567691798.db2.gz IXYAKVSXQIMQRI-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN COc1cc(Br)ccc1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000460503593 567692270 /nfs/dbraw/zinc/69/22/70/567692270.db2.gz UUJVNDZYWWZBDL-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)Cc1cccc(Br)c1 ZINC000573191473 567695361 /nfs/dbraw/zinc/69/53/61/567695361.db2.gz GUQLSWBISMEZQV-UHFFFAOYSA-N 0 0 399.266 3.319 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CCN2S(=O)(=O)Cc1ccc(Br)cc1 ZINC000460636380 567695375 /nfs/dbraw/zinc/69/53/75/567695375.db2.gz NRGDYNWRXFIDAQ-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CCN2S(=O)(=O)c1ccc(Br)cc1 ZINC000460635268 567695496 /nfs/dbraw/zinc/69/54/96/567695496.db2.gz KKLBKJJQXQDVPX-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN O=C(CCS(=O)(=O)Cc1ccccc1Cl)Nc1ccccc1[N+](=O)[O-] ZINC000507679180 567696255 /nfs/dbraw/zinc/69/62/55/567696255.db2.gz SGBJTACJJPZWAC-UHFFFAOYSA-N 0 0 382.825 3.192 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccc3c(c2)CCS3(=O)=O)c(Br)c1 ZINC000532069955 567696437 /nfs/dbraw/zinc/69/64/37/567696437.db2.gz HUCDUQPSFJOXTQ-UHFFFAOYSA-N 0 0 397.250 3.299 20 5 GGBDRN Cc1cc(N2CCCC[C@H](S(C)(=O)=O)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000573215042 567696609 /nfs/dbraw/zinc/69/66/09/567696609.db2.gz VIEUEPKFIBCXTD-NSHDSACASA-N 0 0 380.388 3.326 20 5 GGBDRN COc1cc(OC[C@@H](O)COc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000481702284 567696770 /nfs/dbraw/zinc/69/67/70/567696770.db2.gz GXFBZOVOJXUCLC-LBPRGKRZSA-N 0 0 398.209 3.185 20 5 GGBDRN COc1cc(CCNc2ncc(Br)cc2C)c([N+](=O)[O-])cc1OC ZINC000532079827 567697420 /nfs/dbraw/zinc/69/74/20/567697420.db2.gz MKFHFQRUGOCLGQ-UHFFFAOYSA-N 0 0 396.241 3.154 20 5 GGBDRN C[C@H]1Oc2cc(F)ccc2[C@H]1NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000553906266 567697487 /nfs/dbraw/zinc/69/74/87/567697487.db2.gz ORVSFABGHYLLEQ-GLEZIHRCSA-N 0 0 386.788 3.188 20 5 GGBDRN C[C@@H](Cc1ccccc1Br)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000532107646 567697776 /nfs/dbraw/zinc/69/77/76/567697776.db2.gz QQPZQZBPYAVLCG-NSHDSACASA-N 0 0 399.266 3.267 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC(C)(C)[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000553911882 567698883 /nfs/dbraw/zinc/69/88/83/567698883.db2.gz QYVPTAAOOSIDDS-OAHLLOKOSA-N 0 0 382.463 3.437 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN[C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000481732880 567699623 /nfs/dbraw/zinc/69/96/23/567699623.db2.gz DXHNLKRAWJWZHH-CQSZACIVSA-N 0 0 383.221 3.471 20 5 GGBDRN CNc1ccc(C(=O)NCCOc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000532145488 567700332 /nfs/dbraw/zinc/70/03/32/567700332.db2.gz XJJGHHHWXDCQCV-UHFFFAOYSA-N 0 0 385.207 3.147 20 5 GGBDRN CN(Cc1nc(-c2ccc(Br)cn2)no1)c1ccccc1[N+](=O)[O-] ZINC000460820161 567703246 /nfs/dbraw/zinc/70/32/46/567703246.db2.gz MROHZFIZSZESIP-UHFFFAOYSA-N 0 0 390.197 3.439 20 5 GGBDRN CCc1nc(C)c(CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)o1 ZINC000554006627 567704875 /nfs/dbraw/zinc/70/48/75/567704875.db2.gz LIPITQLUUXHKGA-UHFFFAOYSA-N 0 0 382.214 3.455 20 5 GGBDRN CC1(C)COCN1C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000597619526 567708760 /nfs/dbraw/zinc/70/87/60/567708760.db2.gz ZATIZTYWLPOQPX-UHFFFAOYSA-N 0 0 385.207 3.296 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1ccc(Cl)s1 ZINC000573411747 567710875 /nfs/dbraw/zinc/71/08/75/567710875.db2.gz RSUDAXKQYOPAMA-UHFFFAOYSA-N 0 0 381.841 3.469 20 5 GGBDRN CCc1ncc(S(=O)(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)s1 ZINC000460939781 567710935 /nfs/dbraw/zinc/71/09/35/567710935.db2.gz XXFUXEJYSNFDSD-AWEZNQCLSA-N 0 0 385.492 3.050 20 5 GGBDRN Cc1c(Br)c(NCc2nc(-c3ccncc3)no2)ncc1[N+](=O)[O-] ZINC000573406054 567711524 /nfs/dbraw/zinc/71/15/24/567711524.db2.gz MTCLWAJFZKPKLJ-UHFFFAOYSA-N 0 0 391.185 3.118 20 5 GGBDRN C[C@@]1(CNC(=O)CSc2ccccc2[N+](=O)[O-])OCCc2sccc21 ZINC000460976435 567714734 /nfs/dbraw/zinc/71/47/34/567714734.db2.gz JEPFOUDNCLVTLS-KRWDZBQOSA-N 0 0 378.475 3.353 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1C[C@@H]2CCCC[C@@H]21 ZINC000597829555 567718091 /nfs/dbraw/zinc/71/80/91/567718091.db2.gz OPRMLXACANOZFS-ZANVPECISA-N 0 0 386.189 3.214 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCc2cc(Br)ccc21 ZINC000532494310 567718338 /nfs/dbraw/zinc/71/83/38/567718338.db2.gz LRZMMVYICZQPFZ-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCC(=O)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000597860671 567720515 /nfs/dbraw/zinc/72/05/15/567720515.db2.gz BOHPZRKQOJTJGE-UHFFFAOYSA-N 0 0 385.207 3.361 20 5 GGBDRN C[C@@H](N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)C(C)(C)C ZINC000532614779 567724329 /nfs/dbraw/zinc/72/43/29/567724329.db2.gz NNMCRAKUSVXXPH-SECBINFHSA-N 0 0 379.276 3.412 20 5 GGBDRN C[C@H](N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)C(C)(C)C ZINC000532614780 567724474 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O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cncc(Cl)c1Br ZINC000508127574 567731279 /nfs/dbraw/zinc/73/12/79/567731279.db2.gz ZYLSUGXWSTUSFG-UHFFFAOYSA-N 0 0 392.618 3.207 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2ccc3[nH]ccc3c2)c(Cl)c1 ZINC000443103779 567732537 /nfs/dbraw/zinc/73/25/37/567732537.db2.gz SLHMAKFQMGOGCA-UHFFFAOYSA-N 0 0 379.825 3.251 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1[C@H](C)CO ZINC000598021083 567732656 /nfs/dbraw/zinc/73/26/56/567732656.db2.gz QLJXPRCNCKSBOX-MEBBXXQBSA-N 0 0 385.258 3.289 20 5 GGBDRN O=C(c1cc(Br)cs1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461398361 567733146 /nfs/dbraw/zinc/73/31/46/567733146.db2.gz KZIQJXZYWCCJTM-UHFFFAOYSA-N 0 0 383.223 3.454 20 5 GGBDRN CCc1nc(COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])no1 ZINC000508159687 567734474 /nfs/dbraw/zinc/73/44/74/567734474.db2.gz GHUWJGHMBIXDDP-UHFFFAOYSA-N 0 0 379.170 3.430 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@H](C)[C@H]2CCO)cc1[N+](=O)[O-] ZINC000598067947 567737496 /nfs/dbraw/zinc/73/74/96/567737496.db2.gz LXXYGPYZKIZEMA-IINYFYTJSA-N 0 0 385.258 3.289 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C)[C@H]1CCO ZINC000598066367 567737589 /nfs/dbraw/zinc/73/75/89/567737589.db2.gz DCEMFUKWBQFGEH-ZUZCIYMTSA-N 0 0 385.258 3.289 20 5 GGBDRN Cn1c(=O)[nH]c2ccc(NC(=O)c3ccc(Br)cc3[N+](=O)[O-])cc21 ZINC000443191240 567739174 /nfs/dbraw/zinc/73/91/74/567739174.db2.gz XAYIMASPQGVRAJ-UHFFFAOYSA-N 0 0 391.181 3.202 20 5 GGBDRN C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Br)s1 ZINC000443227123 567741413 /nfs/dbraw/zinc/74/14/13/567741413.db2.gz PJWMZLNQZVSCCN-QMMMGPOBSA-N 0 0 391.268 3.458 20 5 GGBDRN Cn1cc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C(F)(F)F)n1 ZINC000508300943 567742351 /nfs/dbraw/zinc/74/23/51/567742351.db2.gz QCJNMPLZKUPGRG-UHFFFAOYSA-N 0 0 393.119 3.362 20 5 GGBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCSCC1 ZINC000532922406 567743196 /nfs/dbraw/zinc/74/31/96/567743196.db2.gz RNKBTWUNFHTMMI-NSHDSACASA-N 0 0 378.479 3.094 20 5 GGBDRN O=C(CSCc1ccncc1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000461681766 567743845 /nfs/dbraw/zinc/74/38/45/567743845.db2.gz MLCIPYFJRRTVRO-KRWDZBQOSA-N 0 0 375.475 3.497 20 5 GGBDRN CN(C(=O)Cn1cc(Cl)cn1)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000554737371 567746744 /nfs/dbraw/zinc/74/67/44/567746744.db2.gz FHANGVIPGHOCAM-UHFFFAOYSA-N 0 0 377.813 3.231 20 5 GGBDRN Cc1cc(N[C@H](C(N)=O)c2cccc(Br)c2)c(F)cc1[N+](=O)[O-] ZINC000461777731 567746998 /nfs/dbraw/zinc/74/69/98/567746998.db2.gz NTBQWIVTKJBQPK-AWEZNQCLSA-N 0 0 382.189 3.443 20 5 GGBDRN COCc1csc(CNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c1 ZINC000598206900 567747434 /nfs/dbraw/zinc/74/74/34/567747434.db2.gz KNUVHCHCMOZCPV-UHFFFAOYSA-N 0 0 382.463 3.463 20 5 GGBDRN COC(=O)[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000533054851 567748127 /nfs/dbraw/zinc/74/81/27/567748127.db2.gz WURXSKHBERFFOJ-HNNXBMFYSA-N 0 0 379.210 3.361 20 5 GGBDRN CN(Cc1ccc(Br)o1)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C ZINC000508436410 567748062 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386.882 3.459 20 5 GGBDRN O=C1C[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])CN1c1ccccc1F ZINC000461982654 567757614 /nfs/dbraw/zinc/75/76/14/567757614.db2.gz JJQHUUMLAGNIKZ-SNVBAGLBSA-N 0 0 395.188 3.109 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(-c2cc(Br)ccc2C)no1 ZINC000508623872 567758355 /nfs/dbraw/zinc/75/83/55/567758355.db2.gz CJBHXWBERVDXCD-UHFFFAOYSA-N 0 0 378.186 3.269 20 5 GGBDRN C[C@H](Nc1ncc([N+](=O)[O-])cn1)c1ccc(Br)cc1OCCCO ZINC000461997168 567758794 /nfs/dbraw/zinc/75/87/94/567758794.db2.gz SWBSKZKQCONDOX-JTQLQIEISA-N 0 0 397.229 3.082 20 5 GGBDRN C[C@@H](Sc1cccc(C(N)=O)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000554944912 567758957 /nfs/dbraw/zinc/75/89/57/567758957.db2.gz IBZPHOLAQSGAQZ-SECBINFHSA-N 0 0 379.825 3.466 20 5 GGBDRN COc1ccccc1OCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000533212519 567759298 /nfs/dbraw/zinc/75/92/98/567759298.db2.gz KDCZVNJDZXZFMD-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN O=C(Cc1cc(Br)ccc1F)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000533226339 567759472 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CCOc1cc(Br)c(F)cc1NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000554988023 567761009 /nfs/dbraw/zinc/76/10/09/567761009.db2.gz ISGPFXTVQITAMC-UHFFFAOYSA-N 0 0 399.176 3.356 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCCn1cc(Br)cn1 ZINC000555009107 567762454 /nfs/dbraw/zinc/76/24/54/567762454.db2.gz IIFFXKMHJIFCSF-UHFFFAOYSA-N 0 0 396.245 3.328 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(Cc2ccnn2C)no1 ZINC000574198273 567762507 /nfs/dbraw/zinc/76/25/07/567762507.db2.gz WJXVFSAONBGGLW-UHFFFAOYSA-N 0 0 378.186 3.040 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(Cc2cc(F)cc(Br)c2)no1 ZINC000508685496 567762854 /nfs/dbraw/zinc/76/28/54/567762854.db2.gz GYSCBOIGVPWCFP-UHFFFAOYSA-N 0 0 396.176 3.023 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H](CO)c2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000598400726 567763802 /nfs/dbraw/zinc/76/38/02/567763802.db2.gz XQLUPPRVPFMCPJ-NSHDSACASA-N 0 0 387.223 3.041 20 5 GGBDRN Cc1cc(I)cc(NC(=O)c2cc([N+](=O)[O-])cn2C)c1 ZINC000574227081 567765247 /nfs/dbraw/zinc/76/52/47/567765247.db2.gz 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ZINC000462081500 567768473 /nfs/dbraw/zinc/76/84/73/567768473.db2.gz SJSKFXFOZMCFHJ-UHFFFAOYSA-N 0 0 380.369 3.462 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)CCc2ccccc2Br)cc1 ZINC000462087477 567768708 /nfs/dbraw/zinc/76/87/08/567768708.db2.gz JIKBMKMYTIRMDL-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN O=C(Nc1cccc(-c2c[nH]nn2)c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000443668681 567769663 /nfs/dbraw/zinc/76/96/63/567769663.db2.gz VARQFQRDNQCBQT-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN O=[N+]([O-])c1ccccc1CNS(=O)(=O)CCc1ccccc1Br ZINC000462093891 567769812 /nfs/dbraw/zinc/76/98/12/567769812.db2.gz SYNILASCADEZAA-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN CCOC(=O)[C@@]1(C)CCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000598484666 567771657 /nfs/dbraw/zinc/77/16/57/567771657.db2.gz NKWMJVDBZFHOTC-CJNGLKHVSA-N 0 0 399.241 3.209 20 5 GGBDRN CC[C@@H](Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1 ZINC000555135605 567772228 /nfs/dbraw/zinc/77/22/28/567772228.db2.gz LPIXPCNXZOMAAA-ZDUSSCGKSA-N 0 0 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Cn1cc([C@H]2C[C@H](Nc3ccc([N+](=O)[O-])cc3Br)CCO2)cn1 ZINC000599104405 567805764 /nfs/dbraw/zinc/80/57/64/567805764.db2.gz BLVPXGNRIPATFN-IAQYHMDHSA-N 0 0 381.230 3.423 20 5 GGBDRN Cn1cc([C@@H]2C[C@@H](Nc3c(Br)cccc3[N+](=O)[O-])CCO2)cn1 ZINC000599106327 567805892 /nfs/dbraw/zinc/80/58/92/567805892.db2.gz FLWZTWGKOAOCPQ-FZMZJTMJSA-N 0 0 381.230 3.423 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000599108081 567805896 /nfs/dbraw/zinc/80/58/96/567805896.db2.gz QRXNTRWGWMLMMT-NSHDSACASA-N 0 0 399.632 3.458 20 5 GGBDRN COc1cc(Br)c(COc2ccc([N+](=O)[O-])c(CO)c2)cc1OC ZINC000574953065 567805913 /nfs/dbraw/zinc/80/59/13/567805913.db2.gz JFXRFVAJKJPLLT-UHFFFAOYSA-N 0 0 398.209 3.446 20 5 GGBDRN Cc1nc(N2CC[C@@H](Oc3cncc(Br)c3)C2)ccc1[N+](=O)[O-] ZINC000599106437 567805986 /nfs/dbraw/zinc/80/59/86/567805986.db2.gz IDZWHXOOYVGREH-GFCCVEGCSA-N 0 0 379.214 3.113 20 5 GGBDRN Cc1sc(C(=O)NC[C@H](CO)Cc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000444498551 567806389 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599174498 /nfs/dbraw/zinc/17/44/98/599174498.db2.gz WMMSNEYLQVTBFV-UHFFFAOYSA-N 0 0 394.160 3.256 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1OCc1cccc(-c2nn[nH]n2)c1 ZINC000738361274 599174557 /nfs/dbraw/zinc/17/45/57/599174557.db2.gz XCHMTHBUTUKECP-UHFFFAOYSA-N 0 0 376.170 3.116 20 5 GGBDRN CC(C)OC(=O)NCc1ccc(Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000735894807 599205517 /nfs/dbraw/zinc/20/55/17/599205517.db2.gz MLDXQIHWVJNRQA-UHFFFAOYSA-N 0 0 397.395 3.153 20 5 GGBDRN CN(Cc1ccccc1F)c1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000736828459 599255615 /nfs/dbraw/zinc/25/56/15/599255615.db2.gz KPNWZPIJKPIETO-UHFFFAOYSA-N 0 0 379.355 3.099 20 5 GGBDRN Cc1ccc(OCCNc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000737364892 599256156 /nfs/dbraw/zinc/25/61/56/599256156.db2.gz HCTJTRZPRHOUIA-UHFFFAOYSA-N 0 0 391.391 3.122 20 5 GGBDRN O=Cc1cc(Oc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])ccc1Br ZINC000823557963 607306258 /nfs/dbraw/zinc/30/62/58/607306258.db2.gz WTSVPFLGUZLMGR-UHFFFAOYSA-N 0 0 390.153 3.142 20 5 GGBDRN Cc1cccc2c1ncc(-c1nn[nH]n1)c2N(C)Cc1ccccc1[N+](=O)[O-] ZINC000737409484 599270312 /nfs/dbraw/zinc/27/03/12/599270312.db2.gz ORIXIQBSMOSMBF-UHFFFAOYSA-N 0 0 375.392 3.268 20 5 GGBDRN Cc1c(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cccc1-c1nn[nH]n1 ZINC000822108490 607321135 /nfs/dbraw/zinc/32/11/35/607321135.db2.gz JZRLXMQBBINCDA-UHFFFAOYSA-N 0 0 392.297 3.354 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CSCCOc1cccc(-c2nn[nH]n2)c1 ZINC000737115151 598313625 /nfs/dbraw/zinc/31/36/25/598313625.db2.gz LKJBMMUBVVHVAE-UHFFFAOYSA-N 0 0 387.421 3.096 20 5 GGBDRN COc1ccc(CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)c(C(F)(F)F)c1 ZINC000737094821 598352916 /nfs/dbraw/zinc/35/29/16/598352916.db2.gz AUFCGMQXEDKZQB-UHFFFAOYSA-N 0 0 394.313 3.414 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2cccc(OCC(F)F)c2)c(-c2nn[nH]n2)c1 ZINC000738368911 598353599 /nfs/dbraw/zinc/35/35/99/598353599.db2.gz FPPQKPRDKZOPIH-UHFFFAOYSA-N 0 0 376.323 3.031 20 5 GGBDRN COc1ccccc1CC1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)CC1 ZINC000737152641 598353664 /nfs/dbraw/zinc/35/36/64/598353664.db2.gz KYUUKIRMCHHSLI-UHFFFAOYSA-N 0 0 394.435 3.243 20 5 GGBDRN COc1ccc(C(C)(C)CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1OC ZINC000737073880 598363252 /nfs/dbraw/zinc/36/32/52/598363252.db2.gz UVICQPSSZKILNS-UHFFFAOYSA-N 0 0 398.423 3.182 20 5 GGBDRN O=[N+]([O-])c1cnc(Oc2cccc(Oc3ccccn3)c2)c(-c2nn[nH]n2)c1 ZINC000738374728 598498886 /nfs/dbraw/zinc/49/88/86/598498886.db2.gz SROYVBCQPXMLGS-UHFFFAOYSA-N 0 0 377.320 3.150 20 5 GGBDRN COc1cccc(C2(CNc3ncc([N+](=O)[O-])cc3-c3nn[nH]n3)CCCC2)c1 ZINC000737130881 598503751 /nfs/dbraw/zinc/50/37/51/598503751.db2.gz ZJRADUWEXSKGSE-UHFFFAOYSA-N 0 0 395.423 3.102 20 5 GGBDRN O=C(Nc1ccccc1-c1nn[nH]n1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738192696 598572606 /nfs/dbraw/zinc/57/26/06/598572606.db2.gz WJGPNWOCWPHYTI-UHFFFAOYSA-N 0 0 393.388 3.151 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@H](O)c2ccc(Cl)cc2Cl)c(-c2nn[nH]n2)c1 ZINC000738368904 598679146 /nfs/dbraw/zinc/67/91/46/598679146.db2.gz 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CC(C)n1cc([C@@H](C)Nc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)cn1 ZINC000820451646 599553834 /nfs/dbraw/zinc/55/38/34/599553834.db2.gz WNGFTYZTVJCMFK-LLVKDONJSA-N 0 0 393.411 3.274 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)Nc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000822520056 599558830 /nfs/dbraw/zinc/55/88/30/599558830.db2.gz QSRISPBQXUXNSG-MRVPVSSYSA-N 0 0 380.368 3.101 20 5 GGBDRN O=C(OCc1ccccc1-c1nn[nH]n1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000823431802 599621066 /nfs/dbraw/zinc/62/10/66/599621066.db2.gz XZVHQEBVISQAAH-UHFFFAOYSA-N 0 0 393.281 3.151 20 5 GGBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1cccc(-n2cccn2)c1 ZINC000820461318 599687166 /nfs/dbraw/zinc/68/71/66/599687166.db2.gz HHLCDYNPSSJNAA-LBPRGKRZSA-N 0 0 376.380 3.134 20 5 GGBDRN C[C@@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000820455682 599687256 /nfs/dbraw/zinc/68/72/56/599687256.db2.gz LLAOEALKOXRRKJ-GFCCVEGCSA-N 0 0 376.380 3.134 20 5 GGBDRN 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609507490 /nfs/dbraw/zinc/50/74/90/609507490.db2.gz IFFDOFOBKIPTDL-NTMALXAHSA-N 0 0 384.783 3.470 20 5 GGBDRN CC(=CC(=O)Nc1ccc(-c2nn[nH]n2)cc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000823942735 609507602 /nfs/dbraw/zinc/50/76/02/609507602.db2.gz IFFDOFOBKIPTDL-CSKARUKUSA-N 0 0 384.783 3.470 20 5 GGBDRN COc1cccc([C@H]2C[C@@H](C)CN2c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)c1 ZINC000826215550 609593180 /nfs/dbraw/zinc/59/31/80/609593180.db2.gz RYUKVOJAJZEOLX-KZULUSFZSA-N 0 0 380.408 3.371 20 5 GGBDRN C[C@H]1C[C@H](C(=O)Nc2cc(-c3nn[nH]n3)cc([N+](=O)[O-])c2Cl)C[C@@H](C)C1 ZINC000824875732 609596961 /nfs/dbraw/zinc/59/69/61/609596961.db2.gz OGNRRRBADBCPNL-JZYVYDRUSA-N 0 0 378.820 3.439 20 5 GGBDRN C[C@H]1CC(C(=O)Nc2cc(-c3nn[nH]n3)cc([N+](=O)[O-])c2Cl)C[C@H](C)C1 ZINC000824875733 609597527 /nfs/dbraw/zinc/59/75/27/609597527.db2.gz OGNRRRBADBCPNL-RKDXNWHRSA-N 0 0 378.820 3.439 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000481712678 650651637 /nfs/dbraw/zinc/65/16/37/650651637.db2.gz 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NC(=O)[C@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])c1ccccc1 ZINC000053945415 1406562016 /nfs/dbraw/zinc/56/20/16/1406562016.db2.gz CSINQKSUJKABRT-LJQANCHMSA-N 0 0 375.384 3.464 20 5 GGBDRN NC(=O)[C@@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])c1ccccc1 ZINC000053945414 1406562455 /nfs/dbraw/zinc/56/24/55/1406562455.db2.gz CSINQKSUJKABRT-IBGZPJMESA-N 0 0 375.384 3.464 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCCc2cnn(C)c2)cc1[N+](=O)[O-] ZINC000053970482 1406574867 /nfs/dbraw/zinc/57/48/67/1406574867.db2.gz VYYIVIVNTUBJRV-UHFFFAOYSA-N 0 0 376.482 3.439 20 5 GGBDRN COc1cc(CCNC(=O)NCc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC ZINC000054024041 1406591243 /nfs/dbraw/zinc/59/12/43/1406591243.db2.gz CWETYBKVABJKAR-UHFFFAOYSA-N 0 0 393.827 3.307 20 5 GGBDRN COc1cc(CCNC(=O)NCCC2=CCCCC2)c([N+](=O)[O-])cc1OC ZINC000054026808 1406592108 /nfs/dbraw/zinc/59/21/08/1406592108.db2.gz FXWUKMHBOHVZCH-UHFFFAOYSA-N 0 0 377.441 3.344 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000054032919 1406594652 /nfs/dbraw/zinc/59/46/52/1406594652.db2.gz WQZJPLBDBPLMBQ-UHFFFAOYSA-N 0 0 399.422 3.211 20 5 GGBDRN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000054034059 1406595369 /nfs/dbraw/zinc/59/53/69/1406595369.db2.gz WBXNIMCAKZCLKB-HNNXBMFYSA-N 0 0 382.376 3.281 20 5 GGBDRN O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000054034060 1406595608 /nfs/dbraw/zinc/59/56/08/1406595608.db2.gz WBXNIMCAKZCLKB-OAHLLOKOSA-N 0 0 382.376 3.281 20 5 GGBDRN CSc1ccccc1NC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000054058464 1406605009 /nfs/dbraw/zinc/60/50/09/1406605009.db2.gz PUVZWTKGSUJRTC-UHFFFAOYSA-N 0 0 377.397 3.167 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1F ZINC000054067111 1406608421 /nfs/dbraw/zinc/60/84/21/1406608421.db2.gz RYNHJGDSQBGRAG-CYBMUJFWSA-N 0 0 390.390 3.466 20 5 GGBDRN Cc1cc(C)cc(N2CC[C@@H](C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000054096746 1406615306 /nfs/dbraw/zinc/61/53/06/1406615306.db2.gz HWGAWTCTRTVWQS-KXBFYZLASA-N 0 0 381.432 3.442 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000054096737 1406615642 /nfs/dbraw/zinc/61/56/42/1406615642.db2.gz DJGLJURLJXFAGI-YVEFUNNKSA-N 0 0 387.823 3.479 20 5 GGBDRN Cc1nccc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 ZINC000054102436 1406619937 /nfs/dbraw/zinc/61/99/37/1406619937.db2.gz AOMOKUSCYCIDSH-ZDUSSCGKSA-N 0 0 392.419 3.191 20 5 GGBDRN O=C(NCCc1ccc(O)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000054116548 1406622026 /nfs/dbraw/zinc/62/20/26/1406622026.db2.gz SKMDPDVJTUZAKN-UHFFFAOYSA-N 0 0 384.310 3.214 20 5 GGBDRN O=C(CCC1CCCCC1)N1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000054124066 1406624859 /nfs/dbraw/zinc/62/48/59/1406624859.db2.gz RBLLIBZZLXMLGK-UHFFFAOYSA-N 0 0 391.497 3.313 20 5 GGBDRN O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000054133037 1406626626 /nfs/dbraw/zinc/62/66/26/1406626626.db2.gz XKPFSHBVIKAHHA-UHFFFAOYSA-N 0 0 385.395 3.290 20 5 GGBDRN O=C(NCc1cc(Cl)c2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1F ZINC000054131103 1406626998 /nfs/dbraw/zinc/62/69/98/1406626998.db2.gz BNCZSIZPJWVRDE-UHFFFAOYSA-N 0 0 380.759 3.479 20 5 GGBDRN C[C@@H]1CN(Cc2csc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n2)C[C@@H](C)O1 ZINC000054152220 1406633998 /nfs/dbraw/zinc/63/39/98/1406633998.db2.gz NGEFPEBAPDFUQI-GHMZBOCLSA-N 0 0 394.428 3.052 20 5 GGBDRN Cc1cccc(OC[C@H](C)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000054165006 1406635764 /nfs/dbraw/zinc/63/57/64/1406635764.db2.gz MEDVBEBVAAFUGX-HNNXBMFYSA-N 0 0 380.404 3.286 20 5 GGBDRN COc1cc(C(=O)NCCCCN(C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000054167498 1406636919 /nfs/dbraw/zinc/63/69/19/1406636919.db2.gz JVBGISUXICTRFO-UHFFFAOYSA-N 0 0 387.436 3.258 20 5 GGBDRN CSc1nccn1-c1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000054167592 1406637489 /nfs/dbraw/zinc/63/74/89/1406637489.db2.gz DLIONZKTELZBRI-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN CC(C)c1c(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccn1 ZINC000054167676 1406637630 /nfs/dbraw/zinc/63/76/30/1406637630.db2.gz FJHCABZPEMVJAW-UHFFFAOYSA-N 0 0 379.420 3.271 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cccc(NC(=O)c2cccnc2)c1 ZINC000054167695 1406637734 /nfs/dbraw/zinc/63/77/34/1406637734.db2.gz KVRIILDKAYBUSW-UHFFFAOYSA-N 0 0 390.399 3.215 20 5 GGBDRN COc1cc(OC)c(OC)c2[nH]c(C(=O)NCCc3ccc([N+](=O)[O-])cc3)cc21 ZINC000054167671 1406637746 /nfs/dbraw/zinc/63/77/46/1406637746.db2.gz KFRGSGPZTSGGGY-UHFFFAOYSA-N 0 0 399.403 3.074 20 5 GGBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1 ZINC000054196108 1406647230 /nfs/dbraw/zinc/64/72/30/1406647230.db2.gz VUSKYUFPSIUCNC-GFCCVEGCSA-N 0 0 399.403 3.162 20 5 GGBDRN O=C(NCCc1ccccc1C(F)(F)F)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000054196948 1406648026 /nfs/dbraw/zinc/64/80/26/1406648026.db2.gz RGGHAGMDKPEEBH-UHFFFAOYSA-N 0 0 378.310 3.462 20 5 GGBDRN COC(=O)c1cc(C(=O)NCCc2ccccc2C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000054197061 1406648381 /nfs/dbraw/zinc/64/83/81/1406648381.db2.gz ABBMCDFDKYZTRR-UHFFFAOYSA-N 0 0 396.321 3.373 20 5 GGBDRN CC[C@]1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)cc2)CCC(=O)NC1=O ZINC000054199019 1406650386 /nfs/dbraw/zinc/65/03/86/1406650386.db2.gz MDNITVXIYHIGIN-OAQYLSRUSA-N 0 0 395.415 3.240 20 5 GGBDRN CNC(=O)c1ccc(Cl)cc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000054213466 1406652930 /nfs/dbraw/zinc/65/29/30/1406652930.db2.gz RDJXQQDKOSQMNA-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN O=C(NCCN1C(=O)c2ccccc2C1=O)c1cc2ccccc2c2cccnc12 ZINC000054233217 1406662755 /nfs/dbraw/zinc/66/27/55/1406662755.db2.gz XQRRGDRQHNYAQQ-UHFFFAOYSA-N 0 0 395.418 3.414 20 5 GGBDRN COc1ccc(OC)c(CCNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000054264564 1406671204 /nfs/dbraw/zinc/67/12/04/1406671204.db2.gz PCWXPPYIHQLJRQ-CYBMUJFWSA-N 0 0 390.461 3.452 20 5 GGBDRN O=C(COc1cccc(C(=O)NC2CC2)c1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000054270927 1406673304 /nfs/dbraw/zinc/67/33/04/1406673304.db2.gz GBTRNSSWPVKHRO-UHFFFAOYSA-N 0 0 389.795 3.158 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCc2ccc(Cn3cncn3)cc2)cc1[N+](=O)[O-] ZINC000054276780 1406676738 /nfs/dbraw/zinc/67/67/38/1406676738.db2.gz BTRGXYZBSKZWMP-UHFFFAOYSA-N 0 0 393.447 3.462 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(-n2cccn2)c(F)c1 ZINC000054293626 1406684079 /nfs/dbraw/zinc/68/40/79/1406684079.db2.gz LPGSYTLBCSJRLM-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000054326708 1406691511 /nfs/dbraw/zinc/69/15/11/1406691511.db2.gz OKYMPJJBHATMDU-HZPDHXFCSA-N 0 0 377.441 3.089 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(C(=O)Nc2ncccc2C)CC1 ZINC000054349182 1406697145 /nfs/dbraw/zinc/69/71/45/1406697145.db2.gz YDYRRWGFKPREIP-UHFFFAOYSA-N 0 0 397.435 3.489 20 5 GGBDRN CC1=C(C(=O)Nc2cccc(Cl)c2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1 ZINC000054357319 1406700183 /nfs/dbraw/zinc/70/01/83/1406700183.db2.gz GDOUFVUKSUVJEL-AWEZNQCLSA-N 0 0 392.824 3.273 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000054364272 1406703631 /nfs/dbraw/zinc/70/36/31/1406703631.db2.gz ZMPJPCMHMWWANF-UHFFFAOYSA-N 0 0 375.450 3.013 20 5 GGBDRN CC(=O)Nc1cccc2c1CCCN2[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000054367495 1406705177 /nfs/dbraw/zinc/70/51/77/1406705177.db2.gz QWMACHYGOMPRFA-ZDUSSCGKSA-N 0 0 382.420 3.333 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1coc(-c2cccs2)n1 ZINC000054393743 1406718793 /nfs/dbraw/zinc/71/87/93/1406718793.db2.gz NHFRALBIQPUJOY-UHFFFAOYSA-N 0 0 387.421 3.223 20 5 GGBDRN Cc1cc(C)n(-c2ccc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)cn2)n1 ZINC000054412018 1406727594 /nfs/dbraw/zinc/72/75/94/1406727594.db2.gz YWONWFJNGRZUJD-UHFFFAOYSA-N 0 0 380.408 3.157 20 5 GGBDRN COc1cc2c(cc1OC)[C@H](c1ccccc1)N(Cn1nccc1[N+](=O)[O-])CC2 ZINC000054428007 1406733427 /nfs/dbraw/zinc/73/34/27/1406733427.db2.gz DKCGBEQSKWONBO-NRFANRHFSA-N 0 0 394.431 3.414 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1ccc(OCC(F)(F)F)cc1 ZINC000054423295 1406730003 /nfs/dbraw/zinc/73/00/03/1406730003.db2.gz ZYNGRRYUIHVAJR-UHFFFAOYSA-N 0 0 379.294 3.294 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCc2nnnn2-c2ccc(C(F)(F)F)cc2)c1 ZINC000054448270 1406739742 /nfs/dbraw/zinc/73/97/42/1406739742.db2.gz WNRRBMPOKVNFEY-UHFFFAOYSA-N 0 0 379.298 3.477 20 5 GGBDRN Cc1cc(OCc2nnnn2-c2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000054448267 1406739909 /nfs/dbraw/zinc/73/99/09/1406739909.db2.gz MBIVLZWABWUSFD-UHFFFAOYSA-N 0 0 379.298 3.477 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCCN2CCCCCC2=O)cc1[N+](=O)[O-] ZINC000054463438 1406742636 /nfs/dbraw/zinc/74/26/36/1406742636.db2.gz JFJGWPKACKAKJV-UHFFFAOYSA-N 0 0 375.469 3.415 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OCc1nnnn1-c1ccc(C(F)(F)F)cc1 ZINC000054461843 1406742756 /nfs/dbraw/zinc/74/27/56/1406742756.db2.gz QFZREIHACCYZMN-UHFFFAOYSA-N 0 0 379.298 3.477 20 5 GGBDRN CC[C@H](C)NC(=O)c1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000054478747 1406748257 /nfs/dbraw/zinc/74/82/57/1406748257.db2.gz BENFOAWGDLSMTM-AWEZNQCLSA-N 0 0 384.436 3.487 20 5 GGBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000054478746 1406748625 /nfs/dbraw/zinc/74/86/25/1406748625.db2.gz BENFOAWGDLSMTM-CQSZACIVSA-N 0 0 384.436 3.487 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N2CCN(Cc3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000054485883 1406751185 /nfs/dbraw/zinc/75/11/85/1406751185.db2.gz CMFNLWSVRDVMQW-UHFFFAOYSA-N 0 0 382.464 3.245 20 5 GGBDRN O=[N+]([O-])c1cccc(N2CCN(Cn3ncn(-c4ccccc4)c3=S)CC2)c1 ZINC000054516125 1406759729 /nfs/dbraw/zinc/75/97/29/1406759729.db2.gz BOCCOGALASBLPX-UHFFFAOYSA-N 0 0 396.476 3.091 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)c2ccccc2)CC1 ZINC000054537562 1406764723 /nfs/dbraw/zinc/76/47/23/1406764723.db2.gz DGUHFASCHVHHGL-UHFFFAOYSA-N 0 0 388.445 3.187 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCCC(=O)Nc1ccc(Cl)cc1 ZINC000054593073 1406779400 /nfs/dbraw/zinc/77/94/00/1406779400.db2.gz PYEOSSSGUNAERY-UHFFFAOYSA-N 0 0 391.811 3.162 20 5 GGBDRN CCOc1ccccc1CNC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000054603698 1406780287 /nfs/dbraw/zinc/78/02/87/1406780287.db2.gz OCUOMLCBMQYZQS-UHFFFAOYSA-N 0 0 384.436 3.025 20 5 GGBDRN O=C(Nc1ncn(Cc2ccccc2)n1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000054627620 1406791193 /nfs/dbraw/zinc/79/11/93/1406791193.db2.gz FORWZCJPGWLKAH-UHFFFAOYSA-N 0 0 378.392 3.061 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)NCCc3ccc(O)cc3)cc2)c(C)c1[N+](=O)[O-] ZINC000054632395 1406792070 /nfs/dbraw/zinc/79/20/70/1406792070.db2.gz LTHQZIMMAMIIBS-UHFFFAOYSA-N 0 0 394.431 3.135 20 5 GGBDRN CC[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000054644094 1406793952 /nfs/dbraw/zinc/79/39/52/1406793952.db2.gz NLOZHBDENHZEOL-QGZVFWFLSA-N 0 0 385.420 3.359 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000054644453 1406794010 /nfs/dbraw/zinc/79/40/10/1406794010.db2.gz MHMXXUKNOTXTGS-UHFFFAOYSA-N 0 0 387.436 3.386 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000054645713 1406795151 /nfs/dbraw/zinc/79/51/51/1406795151.db2.gz RCXBDCPDCDJYHE-UHFFFAOYSA-N 0 0 398.463 3.343 20 5 GGBDRN Cc1nc2ccccc2n1CCCNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000054645601 1406795395 /nfs/dbraw/zinc/79/53/95/1406795395.db2.gz PCRUWSACSRKEFS-UHFFFAOYSA-N 0 0 381.436 3.185 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)C2)n1 ZINC000054660910 1406798888 /nfs/dbraw/zinc/79/88/88/1406798888.db2.gz IITZGLKLTQSVOF-HNNXBMFYSA-N 0 0 399.451 3.296 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000054663411 1406799640 /nfs/dbraw/zinc/79/96/40/1406799640.db2.gz VHXJKTUJOLNBDE-WCQYABFASA-N 0 0 376.438 3.173 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000054663409 1406799868 /nfs/dbraw/zinc/79/98/68/1406799868.db2.gz VHXJKTUJOLNBDE-YPMHNXCESA-N 0 0 376.438 3.173 20 5 GGBDRN COc1cc(CN2CCC[C@@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000054676497 1406802676 /nfs/dbraw/zinc/80/26/76/1406802676.db2.gz HALNHPZBCDCJCW-LLVKDONJSA-N 0 0 398.366 3.276 20 5 GGBDRN Cc1noc(C2CCN([C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)n1 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/nfs/dbraw/zinc/89/81/48/1398898148.db2.gz BVASCEJWBVCGTP-UHFFFAOYSA-N 0 0 391.811 3.153 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000010621154 1398904152 /nfs/dbraw/zinc/90/41/52/1398904152.db2.gz WMSNRXGGVOIWMG-UHFFFAOYSA-N 0 0 381.388 3.348 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000010621171 1398904167 /nfs/dbraw/zinc/90/41/67/1398904167.db2.gz SXRYWTRCWKGNTN-UHFFFAOYSA-N 0 0 381.388 3.348 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)c(C(F)(F)F)c1 ZINC000010641332 1398905449 /nfs/dbraw/zinc/90/54/49/1398905449.db2.gz LWQYZDHLUGFLHD-UHFFFAOYSA-N 0 0 399.329 3.024 20 5 GGBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010646875 1398906593 /nfs/dbraw/zinc/90/65/93/1398906593.db2.gz NAVCUEBUEDOURJ-VIFPVBQESA-N 0 0 393.739 3.340 20 5 GGBDRN COc1ccc(C(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)cc1Br ZINC000010646978 1398906595 /nfs/dbraw/zinc/90/65/95/1398906595.db2.gz GBVOEDLMYGDBPV-UHFFFAOYSA-N 0 0 394.177 3.406 20 5 GGBDRN C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000010666664 1398909211 /nfs/dbraw/zinc/90/92/11/1398909211.db2.gz CBCHZZNYHNKWRN-SECBINFHSA-N 0 0 393.739 3.340 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)Oc2cccc3c2CCC3=O)cc1[N+](=O)[O-] ZINC000010678219 1398910310 /nfs/dbraw/zinc/91/03/10/1398910310.db2.gz BHDZJOPAFYDOFJ-UHFFFAOYSA-N 0 0 381.793 3.453 20 5 GGBDRN CCOc1ccc(NC(=O)COC(=O)c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000010743559 1398916591 /nfs/dbraw/zinc/91/65/91/1398916591.db2.gz DEFGYFGQYRSPEL-UHFFFAOYSA-N 0 0 378.768 3.442 20 5 GGBDRN CNc1ccc(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000010738835 1398916791 /nfs/dbraw/zinc/91/67/91/1398916791.db2.gz UHOPCHHPXRDRBH-QGZVFWFLSA-N 0 0 385.420 3.449 20 5 GGBDRN COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000010749461 1398917452 /nfs/dbraw/zinc/91/74/52/1398917452.db2.gz RIHNKFWWHDGFMU-UHFFFAOYSA-N 0 0 394.767 3.019 20 5 GGBDRN C[C@H](OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000010759690 1398918260 /nfs/dbraw/zinc/91/82/60/1398918260.db2.gz OSGJUJXXYHNJOG-QNCMIEPLSA-N 0 0 385.332 3.087 20 5 GGBDRN O=C(NC1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000010779080 1398919537 /nfs/dbraw/zinc/91/95/37/1398919537.db2.gz MIIGHLXGYZUXET-UHFFFAOYSA-N 0 0 387.823 3.283 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(Br)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000010802921 1398921627 /nfs/dbraw/zinc/92/16/27/1398921627.db2.gz SQCSEUFBFCJDIM-MRVPVSSYSA-N 0 0 383.154 3.134 20 5 GGBDRN C[C@H](OC(=O)C1CCC1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000010808546 1398921683 /nfs/dbraw/zinc/92/16/83/1398921683.db2.gz FVXLEEGTTZYXSE-JTQLQIEISA-N 0 0 375.406 3.389 20 5 GGBDRN C[C@H](OC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010805102 1398921901 /nfs/dbraw/zinc/92/19/01/1398921901.db2.gz ORHGNUGTKGKUHS-QMMMGPOBSA-N 0 0 384.175 3.481 20 5 GGBDRN COC(=O)c1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1 ZINC000010808866 1398922457 /nfs/dbraw/zinc/92/24/57/1398922457.db2.gz CRTVAXOHYFSORS-UHFFFAOYSA-N 0 0 396.302 3.244 20 5 GGBDRN Cc1cc(C(=O)NCCNc2ccccc2[N+](=O)[O-])c2cnn(C(C)C)c2n1 ZINC000010810019 1398922490 /nfs/dbraw/zinc/92/24/90/1398922490.db2.gz VOLVGQHTSQHRQX-UHFFFAOYSA-N 0 0 382.424 3.071 20 5 GGBDRN C[C@H](OC(=O)Cc1cccc2cccnc21)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000010830989 1398924058 /nfs/dbraw/zinc/92/40/58/1398924058.db2.gz KOUYSEBHTQUJSN-ZDUSSCGKSA-N 0 0 379.372 3.256 20 5 GGBDRN COc1ccc(OC)c(NC(=O)[C@@H](C)Oc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000010845653 1398924568 /nfs/dbraw/zinc/92/45/68/1398924568.db2.gz JBVIPRDRPQATSP-LLVKDONJSA-N 0 0 376.365 3.027 20 5 GGBDRN CCOC(=O)c1cc(C(=O)OCC(=O)c2ccc(CC)cc2)cc([N+](=O)[O-])c1 ZINC000010855454 1398925260 /nfs/dbraw/zinc/92/52/60/1398925260.db2.gz FFRZNVCTXSUWIT-UHFFFAOYSA-N 0 0 385.372 3.374 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cc2c(cc1Cl)OCCO2 ZINC000010857892 1398925270 /nfs/dbraw/zinc/92/52/70/1398925270.db2.gz WYMBVXIFAYBXAF-UHFFFAOYSA-N 0 0 393.783 3.079 20 5 GGBDRN COc1cc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc2c1OCCO2 ZINC000010902031 1398929738 /nfs/dbraw/zinc/92/97/38/1398929738.db2.gz LFTCBHCZUBLKOL-UHFFFAOYSA-N 0 0 392.795 3.300 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000010895510 1398930194 /nfs/dbraw/zinc/93/01/94/1398930194.db2.gz AUSGTVWKKCGYGJ-IBGZPJMESA-N 0 0 397.410 3.175 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000010895509 1398930215 /nfs/dbraw/zinc/93/02/15/1398930215.db2.gz AUSGTVWKKCGYGJ-LJQANCHMSA-N 0 0 397.410 3.175 20 5 GGBDRN CSc1ccc(C(=O)N2CCC[C@@H](c3nnc4ccccn43)C2)cc1[N+](=O)[O-] ZINC000010919755 1398932443 /nfs/dbraw/zinc/93/24/43/1398932443.db2.gz HWEIFXZKRJMBLW-CQSZACIVSA-N 0 0 397.460 3.379 20 5 GGBDRN COc1ccccc1CNC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000010958770 1398936509 /nfs/dbraw/zinc/93/65/09/1398936509.db2.gz IKERBVWVPRNKFA-UHFFFAOYSA-N 0 0 382.319 3.143 20 5 GGBDRN COc1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c(OC)c1 ZINC000010958814 1398936726 /nfs/dbraw/zinc/93/67/26/1398936726.db2.gz XGLRZHVWQZBDFJ-UHFFFAOYSA-N 0 0 398.318 3.474 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1F ZINC000010965694 1398937288 /nfs/dbraw/zinc/93/72/88/1398937288.db2.gz FOTOWNRHBAWEDH-UHFFFAOYSA-N 0 0 376.340 3.085 20 5 GGBDRN CCCc1nnc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])s1 ZINC000010966830 1398937292 /nfs/dbraw/zinc/93/72/92/1398937292.db2.gz CRXUPRUEPVUOBC-UHFFFAOYSA-N 0 0 388.352 3.261 20 5 GGBDRN C[C@H](Oc1ccc(F)cc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000010965379 1398937344 /nfs/dbraw/zinc/93/73/44/1398937344.db2.gz APJXGPZQRISCNU-NSHDSACASA-N 0 0 376.340 3.301 20 5 GGBDRN C[C@H](Oc1cccc(Cl)c1)C(=O)OCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000010970052 1398937480 /nfs/dbraw/zinc/93/74/80/1398937480.db2.gz FCRLCOXPEAZBCI-LBPRGKRZSA-N 0 0 392.795 3.222 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)C23CC4CC(CC(C4)C2)C3)CC1 ZINC000010976353 1398938346 /nfs/dbraw/zinc/93/83/46/1398938346.db2.gz IVYVKMSZGPCLAD-UHFFFAOYSA-N 0 0 397.475 3.096 20 5 GGBDRN CC(=O)c1ccc(N2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)c(F)c1 ZINC000011005540 1398941745 /nfs/dbraw/zinc/94/17/45/1398941745.db2.gz GQEMWDVXTDZKTB-UHFFFAOYSA-N 0 0 385.395 3.207 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000011008618 1398942585 /nfs/dbraw/zinc/94/25/85/1398942585.db2.gz VJTDTTSGHOHNHK-CQSZACIVSA-N 0 0 384.440 3.324 20 5 GGBDRN C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000011012403 1398943430 /nfs/dbraw/zinc/94/34/30/1398943430.db2.gz WOUSIFWRKVBKEW-LRDDRELGSA-N 0 0 396.875 3.085 20 5 GGBDRN COC(=O)c1ccccc1NC(=O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000011011882 1398943453 /nfs/dbraw/zinc/94/34/53/1398943453.db2.gz FTQXWIHAJXSTNY-UHFFFAOYSA-N 0 0 391.811 3.105 20 5 GGBDRN COc1ccc(OC)c(NC(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000011011737 1398943606 /nfs/dbraw/zinc/94/36/06/1398943606.db2.gz PWAXPAKFYPIVSV-UHFFFAOYSA-N 0 0 393.827 3.336 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000011011970 1398943649 /nfs/dbraw/zinc/94/36/49/1398943649.db2.gz XCXVTAPAFDCYIZ-UHFFFAOYSA-N 0 0 390.827 3.277 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000011025182 1398944915 /nfs/dbraw/zinc/94/49/15/1398944915.db2.gz DZIQGHNWJZQIBQ-UHFFFAOYSA-N 0 0 393.739 3.260 20 5 GGBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000011028640 1398944947 /nfs/dbraw/zinc/94/49/47/1398944947.db2.gz GZXBYEQSKDURHU-VIFPVBQESA-N 0 0 393.739 3.340 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000011025409 1398944975 /nfs/dbraw/zinc/94/49/75/1398944975.db2.gz ZEHPXXVXNQJWLE-SECBINFHSA-N 0 0 393.739 3.340 20 5 GGBDRN O=C(OCc1cc(=O)oc2cc(O)ccc12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000011025342 1398945054 /nfs/dbraw/zinc/94/50/54/1398945054.db2.gz QIPNCZYJYARQOO-UHFFFAOYSA-N 0 0 375.720 3.417 20 5 GGBDRN COc1cc(CCNC(=O)c2ccccc2SC)c([N+](=O)[O-])cc1OC ZINC000011080685 1398949132 /nfs/dbraw/zinc/94/91/32/1398949132.db2.gz BNOHMQOVHROYBF-UHFFFAOYSA-N 0 0 376.434 3.306 20 5 GGBDRN COc1cc(CCNC(=O)Cn2c(C)cc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000011081990 1398949165 /nfs/dbraw/zinc/94/91/65/1398949165.db2.gz HIEHPCNRKGIBTD-UHFFFAOYSA-N 0 0 397.431 3.234 20 5 GGBDRN COc1cc(CCNC(=O)COc2cccc(Cl)c2)c([N+](=O)[O-])cc1OC ZINC000011080965 1398949209 /nfs/dbraw/zinc/94/92/09/1398949209.db2.gz GTDWMPWLXJLKIT-UHFFFAOYSA-N 0 0 394.811 3.003 20 5 GGBDRN COc1cc(CCNC(=O)c2cccc(OC(F)F)c2)c([N+](=O)[O-])cc1OC ZINC000011081201 1398949240 /nfs/dbraw/zinc/94/92/40/1398949240.db2.gz IZJHIIFKOJUISX-UHFFFAOYSA-N 0 0 396.346 3.186 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)N1c2ccccc2CC[C@@H]1C ZINC000011084805 1398949248 /nfs/dbraw/zinc/94/92/48/1398949248.db2.gz AQSPMCGWKLSSEY-ZDUSSCGKSA-N 0 0 384.388 3.128 20 5 GGBDRN O=C(NCCCOc1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000011085892 1398949262 /nfs/dbraw/zinc/94/92/62/1398949262.db2.gz GJFVNALCPRRYAM-UHFFFAOYSA-N 0 0 383.448 3.397 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccc(Br)cc1 ZINC000011081323 1398949264 /nfs/dbraw/zinc/94/92/64/1398949264.db2.gz ITPAIQBNRKHEME-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN CCOc1ccc(NC(=O)COC(=O)c2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000011129023 1398953117 /nfs/dbraw/zinc/95/31/17/1398953117.db2.gz VALYLBNCKSKSOJ-UHFFFAOYSA-N 0 0 380.303 3.067 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccc(NC(=O)c2ccco2)cc1 ZINC000011145176 1398953550 /nfs/dbraw/zinc/95/35/50/1398953550.db2.gz SHILPTGBWNJQPF-UHFFFAOYSA-N 0 0 379.372 3.299 20 5 GGBDRN CC(C)CNC(=O)c1ccccc1NC(=O)CNc1ccc(F)c([N+](=O)[O-])c1 ZINC000011161422 1398955089 /nfs/dbraw/zinc/95/50/89/1398955089.db2.gz RFZUNECUCSKFKI-UHFFFAOYSA-N 0 0 388.399 3.170 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)C23CC4CC(CC(C4)C2)C3)CC1 ZINC000011166143 1398955938 /nfs/dbraw/zinc/95/59/38/1398955938.db2.gz UTEUEUAHBSESSW-UHFFFAOYSA-N 0 0 397.475 3.096 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000011226203 1398961677 /nfs/dbraw/zinc/96/16/77/1398961677.db2.gz ZREPVCKFBCFNCS-UHFFFAOYSA-N 0 0 387.348 3.443 20 5 GGBDRN O=C(OCCCn1c(=O)[nH]c2ccccc21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000011226624 1398961891 /nfs/dbraw/zinc/96/18/91/1398961891.db2.gz MJSRSPHDRXMIKX-UHFFFAOYSA-N 0 0 396.403 3.059 20 5 GGBDRN Nc1nc(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)nc2ccccc12 ZINC000011228069 1398961980 /nfs/dbraw/zinc/96/19/80/1398961980.db2.gz SEGBUNBLRQTDCI-UHFFFAOYSA-N 0 0 379.376 3.052 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@@H]1[C@@H](C=C(C)C)C1(C)C ZINC000011260367 1398964880 /nfs/dbraw/zinc/96/48/80/1398964880.db2.gz UIYMVESGVCNDGT-DYVFJYSZSA-N 0 0 376.409 3.324 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)c([N+](=O)[O-])c1 ZINC000011259962 1398964912 /nfs/dbraw/zinc/96/49/12/1398964912.db2.gz MXCOAPARRWNUNS-DYVFJYSZSA-N 0 0 376.409 3.324 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000055536224 1406993126 /nfs/dbraw/zinc/99/31/26/1406993126.db2.gz DMCLVYXMEVQOTO-KRWDZBQOSA-N 0 0 386.404 3.336 20 5 GGBDRN COc1ccc(-c2cc(COC(=O)COc3ccccc3[N+](=O)[O-])on2)cc1 ZINC000011297743 1398967152 /nfs/dbraw/zinc/96/71/52/1398967152.db2.gz LLCIAFXBKXDHCL-UHFFFAOYSA-N 0 0 384.344 3.381 20 5 GGBDRN CCc1cccc(C)c1NC(=O)COC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000011312349 1398968891 /nfs/dbraw/zinc/96/88/91/1398968891.db2.gz CVCIPKPDYWXQRD-UHFFFAOYSA-N 0 0 385.420 3.450 20 5 GGBDRN C[C@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@@H]1C ZINC000011313075 1398968977 /nfs/dbraw/zinc/96/89/77/1398968977.db2.gz BGHCROQAAFEBMN-GJZGRUSLSA-N 0 0 397.431 3.306 20 5 GGBDRN O=C(CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)OCc1cccc2cccnc21 ZINC000011315437 1398969386 /nfs/dbraw/zinc/96/93/86/1398969386.db2.gz IBPPPUUQBLARAC-UHFFFAOYSA-N 0 0 399.790 3.270 20 5 GGBDRN CC(=O)Nc1ccc(C(=O)[C@H](C)OC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000011315430 1398969437 /nfs/dbraw/zinc/96/94/37/1398969437.db2.gz LYTOPUPLCRRPNV-ZDUSSCGKSA-N 0 0 399.403 3.170 20 5 GGBDRN Cc1ccc(-c2noc(COC(=O)CCNc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000011315128 1398969575 /nfs/dbraw/zinc/96/95/75/1398969575.db2.gz DEJBTLOATKJNSC-UHFFFAOYSA-N 0 0 382.376 3.499 20 5 GGBDRN CC[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1 ZINC000011320946 1398969903 /nfs/dbraw/zinc/96/99/03/1398969903.db2.gz LUGAOQQQQJLUQK-QGZVFWFLSA-N 0 0 388.445 3.325 20 5 GGBDRN CCc1cc2c(COC(=O)Cc3ccccc3[N+](=O)[O-])cc(=O)oc2cc1O ZINC000011330828 1398971145 /nfs/dbraw/zinc/97/11/45/1398971145.db2.gz TZBIPYNBNNKWSA-UHFFFAOYSA-N 0 0 383.356 3.255 20 5 GGBDRN CCc1ccccc1N1C[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1=O ZINC000011354320 1398971667 /nfs/dbraw/zinc/97/16/67/1398971667.db2.gz ZDBFMAUPKJVXRA-AWEZNQCLSA-N 0 0 383.404 3.157 20 5 GGBDRN CCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccc(OC)c(OC)c1 ZINC000011366183 1398973538 /nfs/dbraw/zinc/97/35/38/1398973538.db2.gz HKWDJEYDDHIAJJ-UHFFFAOYSA-N 0 0 387.436 3.381 20 5 GGBDRN O=C(c1ccc(CNc2ccc([N+](=O)[O-])c3nonc32)cc1)N1CCCCC1 ZINC000011380159 1398975281 /nfs/dbraw/zinc/97/52/81/1398975281.db2.gz WITDKBSSELTZMA-UHFFFAOYSA-N 0 0 381.392 3.369 20 5 GGBDRN CCCCNS(=O)(=O)c1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000011381641 1398976202 /nfs/dbraw/zinc/97/62/02/1398976202.db2.gz GBDBGWAXRGGUFV-UHFFFAOYSA-N 0 0 391.449 3.234 20 5 GGBDRN O=C(OCc1nccn1C(F)F)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000011394828 1398976770 /nfs/dbraw/zinc/97/67/70/1398976770.db2.gz RLOGELDLCIRMDU-UHFFFAOYSA-N 0 0 380.351 3.146 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](OC(=O)[C@H]2CCCO2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000011392907 1398976814 /nfs/dbraw/zinc/97/68/14/1398976814.db2.gz SMJGAGUBQYMPTI-QZTJIDSGSA-N 0 0 384.388 3.305 20 5 GGBDRN CNc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCCC2=O)c(OC)c1 ZINC000011419380 1398979236 /nfs/dbraw/zinc/97/92/36/1398979236.db2.gz ZFQYRMQPDHHDRZ-UHFFFAOYSA-N 0 0 384.392 3.024 20 5 GGBDRN 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ZINC000055631475 1407030890 /nfs/dbraw/zinc/03/08/90/1407030890.db2.gz RVOBKTOLZHETFG-KRWDZBQOSA-N 0 0 392.433 3.262 20 5 GGBDRN CCNc1ccc(C(=O)O[C@H](C)C(=O)NCc2ccccc2C)cc1[N+](=O)[O-] ZINC000022486621 1399468800 /nfs/dbraw/zinc/46/88/00/1399468800.db2.gz LGFSIMDVTCUXBL-CQSZACIVSA-N 0 0 385.420 3.197 20 5 GGBDRN C[C@H](NC(=O)[C@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000022488889 1399468816 /nfs/dbraw/zinc/46/88/16/1399468816.db2.gz KYTTZBNNWJMBPG-RYUDHWBXSA-N 0 0 397.387 3.346 20 5 GGBDRN CCc1cccc(CC)c1NC(=O)[C@@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000022488318 1399468871 /nfs/dbraw/zinc/46/88/71/1399468871.db2.gz YVEQYGDGJWQEKB-GFCCVEGCSA-N 0 0 385.420 3.486 20 5 GGBDRN CSc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000022487831 1399469049 /nfs/dbraw/zinc/46/90/49/1399469049.db2.gz KRSHRPNRJHFPSD-JTQLQIEISA-N 0 0 375.406 3.083 20 5 GGBDRN C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2CC[C@@H]1C ZINC000022489129 1399469403 /nfs/dbraw/zinc/46/94/03/1399469403.db2.gz KKVQADRTWZJSIJ-STQMWFEESA-N 0 0 383.404 3.090 20 5 GGBDRN O=C(COC(=O)c1cc2ccccc2cc1O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022491349 1399469440 /nfs/dbraw/zinc/46/94/40/1399469440.db2.gz GYMSGMDBDXQLJL-UHFFFAOYSA-N 0 0 392.367 3.200 20 5 GGBDRN COc1ccc([C@H](NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000022500460 1399470630 /nfs/dbraw/zinc/47/06/30/1399470630.db2.gz WCNNNQPNMLGNRG-LJQANCHMSA-N 0 0 384.388 3.028 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000022542338 1399473901 /nfs/dbraw/zinc/47/39/01/1399473901.db2.gz PKXPEBJLNJEIBA-GFCCVEGCSA-N 0 0 399.428 3.408 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@H](C)OC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000022547652 1399474632 /nfs/dbraw/zinc/47/46/32/1399474632.db2.gz YRDNQEYFHUKSLF-LBPRGKRZSA-N 0 0 376.796 3.418 20 5 GGBDRN O=C(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])NCC1(c2ccccc2)CC1 ZINC000022547330 1399474717 /nfs/dbraw/zinc/47/47/17/1399474717.db2.gz HVORAIFQPRAPOQ-UHFFFAOYSA-N 0 0 388.807 3.253 20 5 GGBDRN Cc1nc(NC(=O)[C@@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)sc1C ZINC000022550809 1399475261 /nfs/dbraw/zinc/47/52/61/1399475261.db2.gz UBYOAKLOZRGEEJ-OALRPVAKSA-N 0 0 375.406 3.252 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@H](C)OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000022550881 1399475390 /nfs/dbraw/zinc/47/53/90/1399475390.db2.gz XKKMGZKGSJYMPK-YHVDPYDOSA-N 0 0 382.416 3.207 20 5 GGBDRN COc1ccc(/C=C/C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000022552456 1399475806 /nfs/dbraw/zinc/47/58/06/1399475806.db2.gz AFDLVYCKRPNBIU-TZIYXEQSSA-N 0 0 384.388 3.495 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022556097 1399476675 /nfs/dbraw/zinc/47/66/75/1399476675.db2.gz OJNZRGRHEURQFE-UHFFFAOYSA-N 0 0 377.740 3.125 20 5 GGBDRN CCCCCNC(=O)[C@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559425 1399477262 /nfs/dbraw/zinc/47/72/62/1399477262.db2.gz IWXCUNSBRNUJRN-AWEZNQCLSA-N 0 0 377.441 3.047 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559457 1399477426 /nfs/dbraw/zinc/47/74/26/1399477426.db2.gz BSDPMUYQJHRLHQ-ZIAGYGMSSA-N 0 0 377.441 3.045 20 5 GGBDRN O=C(/C=C/c1ccc(Cl)cc1)OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022560932 1399477451 /nfs/dbraw/zinc/47/74/51/1399477451.db2.gz JORQSHAJEGPJTH-FPYGCLRLSA-N 0 0 386.791 3.394 20 5 GGBDRN CC(=O)N1CCN(c2ccc(C(=O)Oc3c(C)cccc3C)cc2[N+](=O)[O-])CC1 ZINC000022562036 1399478078 /nfs/dbraw/zinc/47/80/78/1399478078.db2.gz UKAIMEIECHAWRY-UHFFFAOYSA-N 0 0 397.431 3.099 20 5 GGBDRN CC(=O)N1CCN(c2ccc(C(=O)Nc3c(C)cccc3C)cc2[N+](=O)[O-])CC1 ZINC000022568980 1399478586 /nfs/dbraw/zinc/47/85/86/1399478586.db2.gz CUCAQQTWPORWCQ-UHFFFAOYSA-N 0 0 396.447 3.132 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)Cc2c[nH]c3ccccc23)cccc1[N+](=O)[O-] ZINC000022580121 1399480072 /nfs/dbraw/zinc/48/00/72/1399480072.db2.gz AZOIKGJYNSMLRB-CYBMUJFWSA-N 0 0 381.388 3.497 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCCNC(=O)c1ccc(F)cc1F ZINC000022589020 1399480481 /nfs/dbraw/zinc/48/04/81/1399480481.db2.gz RXSFLIRTVHPNLP-UHFFFAOYSA-N 0 0 393.346 3.030 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C1CCN(C(=O)c2ccc(F)cc2F)CC1 ZINC000022590103 1399480591 /nfs/dbraw/zinc/48/05/91/1399480591.db2.gz ZNZTXBXCZRLGMX-UHFFFAOYSA-N 0 0 389.358 3.364 20 5 GGBDRN COc1ccc(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000022596009 1399481339 /nfs/dbraw/zinc/48/13/39/1399481339.db2.gz LGRWMUHUXOHTIJ-LBPRGKRZSA-N 0 0 376.434 3.409 20 5 GGBDRN CN(Cc1c(F)cccc1Cl)C(=O)COC(=O)c1ccc([N+](=O)[O-])s1 ZINC000022616178 1399482601 /nfs/dbraw/zinc/48/26/01/1399482601.db2.gz BCABPDUOZOOQJQ-UHFFFAOYSA-N 0 0 386.788 3.264 20 5 GGBDRN COc1ccccc1OCCNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000022639156 1399485181 /nfs/dbraw/zinc/48/51/81/1399485181.db2.gz HHOGJEQIQXIXQG-CYBMUJFWSA-N 0 0 376.434 3.279 20 5 GGBDRN CC(=O)N1CCc2cc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)ccc21 ZINC000022642424 1399485299 /nfs/dbraw/zinc/48/52/99/1399485299.db2.gz WNDUQHPWERGLIQ-UHFFFAOYSA-N 0 0 394.431 3.356 20 5 GGBDRN CCOCCOCc1cccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000055633264 1407032479 /nfs/dbraw/zinc/03/24/79/1407032479.db2.gz ABVCCFNCXROGGZ-UHFFFAOYSA-N 0 0 394.449 3.257 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccc(Br)o2)cccc1[N+](=O)[O-] ZINC000022654279 1399487253 /nfs/dbraw/zinc/48/72/53/1399487253.db2.gz HZHDLORGGRABNU-SECBINFHSA-N 0 0 397.181 3.443 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000022668585 1399488778 /nfs/dbraw/zinc/48/87/78/1399488778.db2.gz XJEIGOMXIJWNDX-GFCCVEGCSA-N 0 0 376.796 3.418 20 5 GGBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCc1ccccc1F ZINC000022669082 1399489198 /nfs/dbraw/zinc/48/91/98/1399489198.db2.gz DJDJHBWAYWSXIW-JTQLQIEISA-N 0 0 380.759 3.249 20 5 GGBDRN COc1cccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1OC ZINC000022677703 1399489612 /nfs/dbraw/zinc/48/96/12/1399489612.db2.gz XVMVRGXYPDHAFK-GFCCVEGCSA-N 0 0 388.376 3.104 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000022702951 1399493616 /nfs/dbraw/zinc/49/36/16/1399493616.db2.gz IIRPRQJYWKCKLD-UHFFFAOYSA-N 0 0 394.330 3.012 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000022711131 1399494716 /nfs/dbraw/zinc/49/47/16/1399494716.db2.gz BAACDFFHMXEISR-UHFFFAOYSA-N 0 0 394.330 3.046 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(OC)c1 ZINC000022736512 1399497052 /nfs/dbraw/zinc/49/70/52/1399497052.db2.gz JSYJEJXGWSEYEI-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(=O)c3ccccc3o2)cccc1[N+](=O)[O-] ZINC000022756317 1399498873 /nfs/dbraw/zinc/49/88/73/1399498873.db2.gz QGCJOXQOSTYZOV-GFCCVEGCSA-N 0 0 396.355 3.194 20 5 GGBDRN COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000022761333 1399499683 /nfs/dbraw/zinc/49/96/83/1399499683.db2.gz UUPOHDKFRREUFH-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN C[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)NCc1ccccc1F ZINC000022794411 1399504378 /nfs/dbraw/zinc/50/43/78/1399504378.db2.gz AIZPVZJPDZXIKY-SNVBAGLBSA-N 0 0 380.759 3.249 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000022793523 1399504429 /nfs/dbraw/zinc/50/44/29/1399504429.db2.gz BURHXKRVXZFVMX-GFCCVEGCSA-N 0 0 376.796 3.418 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@H](C)OC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000022793516 1399504475 /nfs/dbraw/zinc/50/44/75/1399504475.db2.gz UHHYXBAEWBULHE-ZDUSSCGKSA-N 0 0 390.823 3.461 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(Cl)ccc2O)cccc1[N+](=O)[O-] ZINC000022795691 1399505017 /nfs/dbraw/zinc/50/50/17/1399505017.db2.gz CXULIAHYBYQSTN-SNVBAGLBSA-N 0 0 378.768 3.446 20 5 GGBDRN CC(C)(C)c1ccc(OCCNc2ccc([N+](=O)[O-])cc2S(N)(=O)=O)cc1 ZINC000022808276 1399506330 /nfs/dbraw/zinc/50/63/30/1399506330.db2.gz MPAICFCPQRPJJM-UHFFFAOYSA-N 0 0 393.465 3.031 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)nc1 ZINC000022804160 1399506332 /nfs/dbraw/zinc/50/63/32/1399506332.db2.gz UAWANFULMAAGHK-UHFFFAOYSA-N 0 0 387.749 3.384 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000022812377 1399507121 /nfs/dbraw/zinc/50/71/21/1399507121.db2.gz NKLMAAASDMJHJD-UHFFFAOYSA-N 0 0 375.450 3.382 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)CSCc1ccc(F)cc1 ZINC000022832822 1399509364 /nfs/dbraw/zinc/50/93/64/1399509364.db2.gz DKCGIAPXWULDCN-UHFFFAOYSA-N 0 0 392.408 3.457 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H](NC(C)=O)c1ccc(Cl)cc1 ZINC000022862613 1399511636 /nfs/dbraw/zinc/51/16/36/1399511636.db2.gz JTPOAWOQODBGFA-HNNXBMFYSA-N 0 0 391.811 3.463 20 5 GGBDRN COC(=O)c1cc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c(F)cc1F ZINC000022890078 1399514194 /nfs/dbraw/zinc/51/41/94/1399514194.db2.gz VXWYXJVBQNCWJV-UHFFFAOYSA-N 0 0 379.319 3.100 20 5 GGBDRN COc1ccc(C(=O)OCC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000022907195 1399516126 /nfs/dbraw/zinc/51/61/26/1399516126.db2.gz LDLQTTJQFPHKLB-FQEVSTJZSA-N 0 0 398.415 3.336 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000022911054 1399516153 /nfs/dbraw/zinc/51/61/53/1399516153.db2.gz JGRQMCQWSDAYJQ-GFCCVEGCSA-N 0 0 385.376 3.046 20 5 GGBDRN COc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000022907649 1399516165 /nfs/dbraw/zinc/51/61/65/1399516165.db2.gz YITBDVSLIYUDGP-KGLIPLIRSA-N 0 0 386.404 3.335 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000022911177 1399516185 /nfs/dbraw/zinc/51/61/85/1399516185.db2.gz QSKSWHZOXFEEJI-GFCCVEGCSA-N 0 0 388.376 3.104 20 5 GGBDRN COc1ccc(C(=O)OCC(=O)N[C@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000022907189 1399516201 /nfs/dbraw/zinc/51/62/01/1399516201.db2.gz LDLQTTJQFPHKLB-HXUWFJFHSA-N 0 0 398.415 3.336 20 5 GGBDRN Cc1c(C(=O)O[C@H](C)C(=O)N[C@H]2CCOc3ccccc32)cccc1[N+](=O)[O-] ZINC000022911251 1399516826 /nfs/dbraw/zinc/51/68/26/1399516826.db2.gz DQDHGWPNJFTZAS-CJNGLKHVSA-N 0 0 384.388 3.089 20 5 GGBDRN COc1ccc(-n2c(C)nnc2SCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000022927090 1399517653 /nfs/dbraw/zinc/51/76/53/1399517653.db2.gz JRYNUDHTMUZRIL-UHFFFAOYSA-N 0 0 399.432 3.223 20 5 GGBDRN CC(=O)c1ccc(N2CCC[C@@H](c3nnc4n3CCCCC4)C2)c([N+](=O)[O-])c1 ZINC000022977773 1399520932 /nfs/dbraw/zinc/52/09/32/1399520932.db2.gz XKRPMFQUSGHYGA-MRXNPFEDSA-N 0 0 383.452 3.499 20 5 GGBDRN Cc1nn(CC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000023004107 1399524607 /nfs/dbraw/zinc/52/46/07/1399524607.db2.gz CMOCRZUVMLAKKL-UHFFFAOYSA-N 0 0 380.408 3.110 20 5 GGBDRN CCOc1cc(C(=O)Nc2cc(NC(C)=O)ccc2F)c([N+](=O)[O-])cc1OC ZINC000023003458 1399524918 /nfs/dbraw/zinc/52/49/18/1399524918.db2.gz ICOIRVSOLSLCBH-UHFFFAOYSA-N 0 0 391.355 3.352 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1 ZINC000023103008 1399531824 /nfs/dbraw/zinc/53/18/24/1399531824.db2.gz BMXREXSKAPUXQE-LBPRGKRZSA-N 0 0 383.404 3.443 20 5 GGBDRN O=C(NCC(=O)N1CCC[C@H]1c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000023112146 1399533001 /nfs/dbraw/zinc/53/30/01/1399533001.db2.gz QJKXHQUFSLJOFS-KRWDZBQOSA-N 0 0 387.823 3.342 20 5 GGBDRN CC(C)(Oc1ccc(F)cc1)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000023122514 1399533879 /nfs/dbraw/zinc/53/38/79/1399533879.db2.gz UGJGQEBJNZVRDG-UHFFFAOYSA-N 0 0 387.411 3.240 20 5 GGBDRN O=C(Nc1ccc(N2CCCC2)cn1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000023137612 1399534851 /nfs/dbraw/zinc/53/48/51/1399534851.db2.gz CJIAHTKBPPQFMC-UHFFFAOYSA-N 0 0 381.436 3.443 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2C(F)(F)F)nn1 ZINC000023152915 1399535583 /nfs/dbraw/zinc/53/55/83/1399535583.db2.gz VJXXQAYGWOQURU-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN CC[C@H](C)NC(=O)[C@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000023204919 1399538863 /nfs/dbraw/zinc/53/88/63/1399538863.db2.gz SNVCZUQCFNMHOV-GJZGRUSLSA-N 0 0 391.468 3.291 20 5 GGBDRN C[C@H](OC(=O)[C@H]1Cc2ccccc2S1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000023205042 1399539431 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UEYSWEUARCCOSW-KRWDZBQOSA-N 0 0 384.392 3.148 20 5 GGBDRN Cc1ccnn1-c1ccc(C(=O)OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC000027952818 1400109905 /nfs/dbraw/zinc/10/99/05/1400109905.db2.gz CIOKNXPNAMRDPB-UHFFFAOYSA-N 0 0 398.350 3.024 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(OC(F)(F)F)cc1 ZINC000027967285 1400111635 /nfs/dbraw/zinc/11/16/35/1400111635.db2.gz HIACRALRHVCIFG-UHFFFAOYSA-N 0 0 390.339 3.280 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000027968714 1400112499 /nfs/dbraw/zinc/11/24/99/1400112499.db2.gz PVCBDJAECVJABB-UHFFFAOYSA-N 0 0 398.444 3.258 20 5 GGBDRN CCOc1cc(C(=O)O[C@H](C(=O)OC)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000028000537 1400116473 /nfs/dbraw/zinc/11/64/73/1400116473.db2.gz DUJIKTHTVCOWJC-KRWDZBQOSA-N 0 0 389.360 3.073 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c1 ZINC000028040706 1400121523 /nfs/dbraw/zinc/12/15/23/1400121523.db2.gz PJZOUHWGKHBLMY-CYBMUJFWSA-N 0 0 391.449 3.210 20 5 GGBDRN O=C(N[C@@H]1CCSc2c(F)cccc21)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000028044639 1400122375 /nfs/dbraw/zinc/12/23/75/1400122375.db2.gz VVHSZNIZEVWYHK-GFCCVEGCSA-N 0 0 376.365 3.430 20 5 GGBDRN O=C(N[C@H]1CCSc2c(F)cccc21)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000028044637 1400122582 /nfs/dbraw/zinc/12/25/82/1400122582.db2.gz VVHSZNIZEVWYHK-LBPRGKRZSA-N 0 0 376.365 3.430 20 5 GGBDRN CCOc1cc2c(cc1CNC(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)O[C@H](C)C2 ZINC000028064319 1400124538 /nfs/dbraw/zinc/12/45/38/1400124538.db2.gz FKLLATQJFSNPDE-LLVKDONJSA-N 0 0 396.403 3.123 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000028064978 1400125173 /nfs/dbraw/zinc/12/51/73/1400125173.db2.gz SNPPPBZTCDPPLT-MRXNPFEDSA-N 0 0 394.387 3.220 20 5 GGBDRN CC(C)(C)N(Cc1ccccc1)C(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000028069738 1400125707 /nfs/dbraw/zinc/12/57/07/1400125707.db2.gz LLKWTAJJNHWFIW-UHFFFAOYSA-N 0 0 383.404 3.330 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCN(Cc2ccccc2)CC1 ZINC000028087256 1400128315 /nfs/dbraw/zinc/12/83/15/1400128315.db2.gz KXLNKJYWLKFKQP-UHFFFAOYSA-N 0 0 380.448 3.127 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)nc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000028093063 1400128763 /nfs/dbraw/zinc/12/87/63/1400128763.db2.gz ZSXKVBYELDLMPL-UHFFFAOYSA-N 0 0 392.419 3.031 20 5 GGBDRN Cc1ccccc1[C@@H]1CCCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000055779810 1407082032 /nfs/dbraw/zinc/08/20/32/1407082032.db2.gz XOYFRILGPHSPBA-INIZCTEOSA-N 0 0 399.472 3.458 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2nnnn2C2CCCC2)cccc1[N+](=O)[O-] ZINC000028144395 1400133521 /nfs/dbraw/zinc/13/35/21/1400133521.db2.gz DTABIBZAXYMWRX-LLVKDONJSA-N 0 0 376.442 3.124 20 5 GGBDRN Cc1nc2ccccc2nc1SCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000028191341 1400138045 /nfs/dbraw/zinc/13/80/45/1400138045.db2.gz XDTZYYAHSQVZGN-UHFFFAOYSA-N 0 0 398.400 3.306 20 5 GGBDRN CCOc1ccc(NC(=O)COC(=O)/C=C/c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000028301427 1400147884 /nfs/dbraw/zinc/14/78/84/1400147884.db2.gz NHIRLXXUTBVMED-RMKNXTFCSA-N 0 0 388.351 3.328 20 5 GGBDRN CCOc1ccc(NC(=O)COC(=O)/C=C/c2cccs2)c([N+](=O)[O-])c1 ZINC000028301861 1400148081 /nfs/dbraw/zinc/14/80/81/1400148081.db2.gz MBBDGAINPHEOSH-SOFGYWHQSA-N 0 0 376.390 3.250 20 5 GGBDRN CCc1nc(COC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cs1 ZINC000028355706 1400155208 /nfs/dbraw/zinc/15/52/08/1400155208.db2.gz AJGXBAZKKHXYJU-UHFFFAOYSA-N 0 0 391.405 3.045 20 5 GGBDRN CC[C@H](NC(=O)COC(=O)c1cc([N+](=O)[O-])cn1C)c1ccc(Cl)cc1 ZINC000028383677 1400158556 /nfs/dbraw/zinc/15/85/56/1400158556.db2.gz DZEFNWGXDNKWIF-AWEZNQCLSA-N 0 0 379.800 3.011 20 5 GGBDRN C[C@@H](Nc1cccc(CN2CCCC2=O)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000028386839 1400158614 /nfs/dbraw/zinc/15/86/14/1400158614.db2.gz PFKDUUHNSUXWCI-CQSZACIVSA-N 0 0 382.420 3.156 20 5 GGBDRN CCOc1ccccc1C(=O)N[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000055797368 1407085144 /nfs/dbraw/zinc/08/51/44/1407085144.db2.gz DGGDQEXBXASFSC-IBGZPJMESA-N 0 0 399.447 3.064 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000028423256 1400164769 /nfs/dbraw/zinc/16/47/69/1400164769.db2.gz QXCBTHQLQDBFAJ-LBPRGKRZSA-N 0 0 387.348 3.304 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)OC(=O)c2c(C)cccc2[N+](=O)[O-])c(OC)c1 ZINC000028424035 1400164780 /nfs/dbraw/zinc/16/47/80/1400164780.db2.gz FKCJIDGBZTXOLB-GFCCVEGCSA-N 0 0 388.376 3.104 20 5 GGBDRN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000028424106 1400165076 /nfs/dbraw/zinc/16/50/76/1400165076.db2.gz CKFCDYLFGLDVOY-KGLIPLIRSA-N 0 0 386.404 3.335 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@H](C)C(=O)N[C@H]1CCOc2ccccc21 ZINC000028424143 1400165094 /nfs/dbraw/zinc/16/50/94/1400165094.db2.gz FCENXXURCPEEBO-HIFRSBDPSA-N 0 0 384.388 3.089 20 5 GGBDRN O=C(/C=C/c1ccc(I)o1)NCc1ccc([N+](=O)[O-])cc1 ZINC000055797314 1407085381 /nfs/dbraw/zinc/08/53/81/1407085381.db2.gz GZVFHUIJIQGYRX-SOFGYWHQSA-N 0 0 398.156 3.122 20 5 GGBDRN CC(C)CNC(=O)COC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000028442529 1400166330 /nfs/dbraw/zinc/16/63/30/1400166330.db2.gz XGAACSGLVXVPNO-HUUCEWRRSA-N 0 0 391.468 3.006 20 5 GGBDRN CCOc1ccc(C=O)c(OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000028452064 1400166962 /nfs/dbraw/zinc/16/69/62/1400166962.db2.gz AGRTYDZYQSTNPK-UHFFFAOYSA-N 0 0 378.768 3.477 20 5 GGBDRN Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000055798735 1407085736 /nfs/dbraw/zinc/08/57/36/1407085736.db2.gz OAYUXTXRBOYGFM-UHFFFAOYSA-N 0 0 382.395 3.395 20 5 GGBDRN CCN(c1ccccc1)S(=O)(=O)c1ccc(NCCCOC)c([N+](=O)[O-])c1 ZINC000028498923 1400171934 /nfs/dbraw/zinc/17/19/34/1400171934.db2.gz HKSYVHGSUBOMQO-UHFFFAOYSA-N 0 0 393.465 3.258 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccc(NC(=O)Nc2ccccc2)c1 ZINC000028512255 1400173243 /nfs/dbraw/zinc/17/32/43/1400173243.db2.gz FSVMEHQDCBLSSF-UHFFFAOYSA-N 0 0 380.364 3.074 20 5 GGBDRN Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)NCc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000055798893 1407085969 /nfs/dbraw/zinc/08/59/69/1407085969.db2.gz IINJFBMAENCXEQ-QGZVFWFLSA-N 0 0 396.447 3.464 20 5 GGBDRN CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccccc2[N+](=O)[O-])NC(=S)N1 ZINC000028526783 1400175388 /nfs/dbraw/zinc/17/53/88/1400175388.db2.gz PMGYYGBGCTXSGD-MRXNPFEDSA-N 0 0 386.408 3.165 20 5 GGBDRN CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccccc2[N+](=O)[O-])NC(=S)N1 ZINC000028526785 1400175648 /nfs/dbraw/zinc/17/56/48/1400175648.db2.gz PMGYYGBGCTXSGD-INIZCTEOSA-N 0 0 386.408 3.165 20 5 GGBDRN Cc1cc(C)c(OCC(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000028606680 1400176499 /nfs/dbraw/zinc/17/64/99/1400176499.db2.gz HGRFIXHGQROJPR-OAHLLOKOSA-N 0 0 386.404 3.469 20 5 GGBDRN O=C(COC(=O)COc1cccc2ccccc21)Nc1cc([N+](=O)[O-])ccc1F ZINC000028610263 1400176883 /nfs/dbraw/zinc/17/68/83/1400176883.db2.gz CXGRKPPBOJXYKZ-UHFFFAOYSA-N 0 0 398.346 3.448 20 5 GGBDRN O=C(COC(=O)COc1cccc2ccccc21)Nc1cccc([N+](=O)[O-])c1 ZINC000028610249 1400177049 /nfs/dbraw/zinc/17/70/49/1400177049.db2.gz GMIVXJFCWTVBHI-UHFFFAOYSA-N 0 0 380.356 3.309 20 5 GGBDRN CCOc1ccc(NC(=O)COC(=O)Cc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000028612301 1400177143 /nfs/dbraw/zinc/17/71/43/1400177143.db2.gz SYECCTMBMMTJOO-UHFFFAOYSA-N 0 0 392.795 3.371 20 5 GGBDRN O=C(/C=C/c1ccc(O)cc1)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000028613932 1400177818 /nfs/dbraw/zinc/17/78/18/1400177818.db2.gz YLBMMKJLBRKAFR-FPYGCLRLSA-N 0 0 376.752 3.149 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000028614331 1400177820 /nfs/dbraw/zinc/17/78/20/1400177820.db2.gz NBFSPKKXALVRSP-XCVCLJGOSA-N 0 0 396.315 3.310 20 5 GGBDRN Cc1ccc(OCC(=O)OCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000028614138 1400177821 /nfs/dbraw/zinc/17/78/21/1400177821.db2.gz YIOPCOXPKKURPW-UHFFFAOYSA-N 0 0 378.768 3.117 20 5 GGBDRN CCOc1ccc(OCC)c(NCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000028664059 1400182073 /nfs/dbraw/zinc/18/20/73/1400182073.db2.gz YWOKLVGERIWHFD-UHFFFAOYSA-N 0 0 389.408 3.451 20 5 GGBDRN C[C@@H](OC(=O)COc1ccccc1F)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000028674263 1400183511 /nfs/dbraw/zinc/18/35/11/1400183511.db2.gz HYDMJOUNYJWSBC-SNVBAGLBSA-N 0 0 396.758 3.337 20 5 GGBDRN C[C@@H]1CCCN(Cc2csc(NC(=O)COc3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000028682541 1400184088 /nfs/dbraw/zinc/18/40/88/1400184088.db2.gz HMUNFOWYGPLFGP-CYBMUJFWSA-N 0 0 390.465 3.301 20 5 GGBDRN Cc1nc(CC(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 ZINC000028689505 1400185767 /nfs/dbraw/zinc/18/57/67/1400185767.db2.gz NXSKQJCPPMLVIX-UHFFFAOYSA-N 0 0 388.371 3.149 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)c(C)o1 ZINC000055806808 1407087103 /nfs/dbraw/zinc/08/71/03/1407087103.db2.gz UJDJYPPQIYXBHW-UHFFFAOYSA-N 0 0 391.811 3.056 20 5 GGBDRN CC(C)NC(=O)c1ccc(N2CCN(Cc3ccsc3)CC2)c([N+](=O)[O-])c1 ZINC000028743157 1400191006 /nfs/dbraw/zinc/19/10/06/1400191006.db2.gz MZJMWPVMIGETMJ-UHFFFAOYSA-N 0 0 388.493 3.117 20 5 GGBDRN CC(C)(C)OC(=O)N1CCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000028739439 1400191008 /nfs/dbraw/zinc/19/10/08/1400191008.db2.gz KQQOXOYQAOQKSA-UHFFFAOYSA-N 0 0 394.453 3.382 20 5 GGBDRN CCCCNC(=O)[C@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775175 1400194319 /nfs/dbraw/zinc/19/43/19/1400194319.db2.gz PZQMYYIHWDJUAP-HNNXBMFYSA-N 0 0 380.444 3.003 20 5 GGBDRN CCC(CC)NC(=O)[C@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775192 1400194456 /nfs/dbraw/zinc/19/44/56/1400194456.db2.gz LLIBSXHFIRITBF-HNNXBMFYSA-N 0 0 394.471 3.391 20 5 GGBDRN CCC(CC)NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775189 1400194534 /nfs/dbraw/zinc/19/45/34/1400194534.db2.gz LLIBSXHFIRITBF-OAHLLOKOSA-N 0 0 394.471 3.391 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775160 1400194568 /nfs/dbraw/zinc/19/45/68/1400194568.db2.gz HRWNMQDSKPCMJL-CABCVRRESA-N 0 0 380.444 3.001 20 5 GGBDRN COc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2Cl)cc(OC)c1OC ZINC000028783326 1400195250 /nfs/dbraw/zinc/19/52/50/1400195250.db2.gz DDAPVOPFHIGGCT-UHFFFAOYSA-N 0 0 396.783 3.292 20 5 GGBDRN Cc1ccc(O[C@@H](C)C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000028804746 1400198492 /nfs/dbraw/zinc/19/84/92/1400198492.db2.gz VKOHCZSAEVZOIH-ZDUSSCGKSA-N 0 0 383.360 3.464 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)OCc1ccc(F)cc1Cl ZINC000028864825 1400206025 /nfs/dbraw/zinc/20/60/25/1400206025.db2.gz ARCMPTXPRLVRTK-UHFFFAOYSA-N 0 0 380.759 3.251 20 5 GGBDRN CN(C(=O)CN1CCN(c2cccc(Cl)c2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000028927577 1400212579 /nfs/dbraw/zinc/21/25/79/1400212579.db2.gz DEEOJGVUOMVMFF-UHFFFAOYSA-N 0 0 388.855 3.033 20 5 GGBDRN C[C@@H]1CCCN(Cc2csc(NC(=O)COc3cccc([N+](=O)[O-])c3)n2)C1 ZINC000028931712 1400213282 /nfs/dbraw/zinc/21/32/82/1400213282.db2.gz HYBJIVRQQFKPHL-CYBMUJFWSA-N 0 0 390.465 3.301 20 5 GGBDRN CN(CCOc1ccc(Cl)cc1)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000028960402 1400216796 /nfs/dbraw/zinc/21/67/96/1400216796.db2.gz MJMHCIUYJSGRSC-UHFFFAOYSA-N 0 0 377.828 3.222 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(Cc3csc(C)n3)CC2)cc1[N+](=O)[O-] ZINC000028959354 1400216834 /nfs/dbraw/zinc/21/68/34/1400216834.db2.gz PCIDLPXKRCXBGI-UHFFFAOYSA-N 0 0 392.506 3.040 20 5 GGBDRN CN(C(=O)CN1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000028974505 1400219315 /nfs/dbraw/zinc/21/93/15/1400219315.db2.gz IMCVNNHPZDVBJW-SFHVURJKSA-N 0 0 397.431 3.166 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N[C@H](C)CN2CCCC2=O)cc1[N+](=O)[O-] ZINC000055811829 1407089521 /nfs/dbraw/zinc/08/95/21/1407089521.db2.gz IBORLQSPTYWOIG-CQSZACIVSA-N 0 0 393.509 3.474 20 5 GGBDRN CCOCc1ccc(CNC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000028993360 1400222519 /nfs/dbraw/zinc/22/25/19/1400222519.db2.gz NQWLBMNCWYJKMH-UHFFFAOYSA-N 0 0 398.463 3.163 20 5 GGBDRN C[C@@H](c1nnc(Sc2ncccc2[N+](=O)[O-])n1-c1ccc(F)cc1)N(C)C ZINC000029001521 1400223917 /nfs/dbraw/zinc/22/39/17/1400223917.db2.gz HBWXJPLSHWUEQH-NSHDSACASA-N 0 0 388.428 3.483 20 5 GGBDRN CNc1ccc(C(=O)N[C@H](c2nccn2C)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000029080624 1400233882 /nfs/dbraw/zinc/23/38/82/1400233882.db2.gz NSGCKSTWPMDXJV-KRWDZBQOSA-N 0 0 383.383 3.029 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000029112970 1400242646 /nfs/dbraw/zinc/24/26/46/1400242646.db2.gz DVNJONVBCGYXBF-KRWDZBQOSA-N 0 0 376.409 3.426 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000029152258 1400248919 /nfs/dbraw/zinc/24/89/19/1400248919.db2.gz QXFBTTLNNMEVQB-UHFFFAOYSA-N 0 0 396.428 3.395 20 5 GGBDRN CCCOc1ccc(CNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])cc1OC ZINC000029172842 1400253906 /nfs/dbraw/zinc/25/39/06/1400253906.db2.gz KBEZSIPFPHLVCP-UHFFFAOYSA-N 0 0 384.392 3.241 20 5 GGBDRN COC(=O)C1(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCCCCC1 ZINC000029207753 1400258567 /nfs/dbraw/zinc/25/85/67/1400258567.db2.gz NAMQTGQSIKZSOR-ZDUSSCGKSA-N 0 0 380.466 3.458 20 5 GGBDRN Cc1ccc(C2=NN(C(=O)Cn3cnc([N+](=O)[O-])c3)[C@H](c3ccco3)C2)cc1 ZINC000029211211 1400258939 /nfs/dbraw/zinc/25/89/39/1400258939.db2.gz KEPYEUPFMJUZJP-INIZCTEOSA-N 0 0 379.376 3.071 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1ccc(Cn2cccn2)cc1 ZINC000029229952 1400263029 /nfs/dbraw/zinc/26/30/29/1400263029.db2.gz VJMYKMZHVRYIPS-UHFFFAOYSA-N 0 0 393.447 3.348 20 5 GGBDRN Cc1cc([C@H]2CCCN2C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)no1 ZINC000029239474 1400264567 /nfs/dbraw/zinc/26/45/67/1400264567.db2.gz OTWBHJUVHHZXOU-QGZVFWFLSA-N 0 0 384.436 3.471 20 5 GGBDRN C[C@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1 ZINC000029243419 1400265235 /nfs/dbraw/zinc/26/52/35/1400265235.db2.gz KTGGBGDOIBTGGN-NSHDSACASA-N 0 0 395.337 3.221 20 5 GGBDRN CN(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)[C@H]1CCCc2ccccc21 ZINC000029258627 1400267550 /nfs/dbraw/zinc/26/75/50/1400267550.db2.gz NCBXVBFISAOOJV-KRWDZBQOSA-N 0 0 377.404 3.325 20 5 GGBDRN NC(=O)c1ccc(CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000029264854 1400269556 /nfs/dbraw/zinc/26/95/56/1400269556.db2.gz 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393.465 3.313 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000029441588 1400299535 /nfs/dbraw/zinc/29/95/35/1400299535.db2.gz QCUQURMDZPXBEO-UHFFFAOYSA-N 0 0 381.432 3.200 20 5 GGBDRN COc1ccc([C@@H](CNc2ccccc2[N+](=O)[O-])N2CCOCC2)cc1OC ZINC000029460865 1400302737 /nfs/dbraw/zinc/30/27/37/1400302737.db2.gz DHPABVGUJJTUPM-GOSISDBHSA-N 0 0 387.436 3.097 20 5 GGBDRN O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)Nc1cccc(Cl)c1Cl ZINC000029472078 1400303522 /nfs/dbraw/zinc/30/35/22/1400303522.db2.gz WLZKIOYWNZQLIJ-UHFFFAOYSA-N 0 0 396.186 3.266 20 5 GGBDRN COc1ccc(CN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C2CC2)cc1 ZINC000029502631 1400306757 /nfs/dbraw/zinc/30/67/57/1400306757.db2.gz BLMDLOMYXXBRIO-UHFFFAOYSA-N 0 0 379.420 3.484 20 5 GGBDRN COc1ccc2ccccc2c1CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000029528415 1400310353 /nfs/dbraw/zinc/31/03/53/1400310353.db2.gz GLNSSOYPGSXAJL-UHFFFAOYSA-N 0 0 387.417 3.016 20 5 GGBDRN COc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])c4cccnc43)CC2)c1 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NRCWHPMAIQCLQX-CYBMUJFWSA-N 0 0 383.433 3.354 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000055972752 1407154547 /nfs/dbraw/zinc/15/45/47/1407154547.db2.gz KCZFJFVQEJVIJA-GOSISDBHSA-N 0 0 383.429 3.366 20 5 GGBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)N(C(=O)C(C)(C)C)CCO2 ZINC000055974184 1407154994 /nfs/dbraw/zinc/15/49/94/1407154994.db2.gz ZLEJFKNHVCQTFZ-UHFFFAOYSA-N 0 0 398.419 3.322 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCC(Oc2ccccc2)CC1 ZINC000055976711 1407155987 /nfs/dbraw/zinc/15/59/87/1407155987.db2.gz LSYCUMHZEVPHEW-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)C[C@H](C)O1 ZINC000055988704 1407162104 /nfs/dbraw/zinc/16/21/04/1407162104.db2.gz KORWOXWFDIUNFK-OKILXGFUSA-N 0 0 383.404 3.097 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)C[C@H](C)O1 ZINC000055988705 1407162378 /nfs/dbraw/zinc/16/23/78/1407162378.db2.gz KORWOXWFDIUNFK-KBPBESRZSA-N 0 0 383.404 3.097 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C[C@H]1CN(C(=O)c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000055988062 1407160853 /nfs/dbraw/zinc/16/08/53/1407160853.db2.gz SFVIQKLVFVQUIU-KBPBESRZSA-N 0 0 383.404 3.097 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1 ZINC000055988163 1407161538 /nfs/dbraw/zinc/16/15/38/1407161538.db2.gz FYQXZNZVLUKTGE-GASCZTMLSA-N 0 0 397.431 3.025 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(NC(=O)c3csc([N+](=O)[O-])c3)cc2)C[C@H](C)O1 ZINC000055989386 1407162882 /nfs/dbraw/zinc/16/28/82/1407162882.db2.gz GUJDHBNHAUXAHE-RYUDHWBXSA-N 0 0 389.433 3.158 20 5 GGBDRN CCCOc1ccc(NC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000055990265 1407163182 /nfs/dbraw/zinc/16/31/82/1407163182.db2.gz COTQBMUEBAUTTA-UHFFFAOYSA-N 0 0 399.403 3.056 20 5 GGBDRN O=C(NCCC(=O)N1CCC[C@H]1Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000055991678 1407163800 /nfs/dbraw/zinc/16/38/00/1407163800.db2.gz CLQFIPIQNRRNIE-IBGZPJMESA-N 0 0 399.422 3.088 20 5 GGBDRN O=C(NCCC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000055991679 1407164152 /nfs/dbraw/zinc/16/41/52/1407164152.db2.gz CLQFIPIQNRRNIE-LJQANCHMSA-N 0 0 399.422 3.088 20 5 GGBDRN C[C@H](Cn1ccnc1)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000055996508 1407166148 /nfs/dbraw/zinc/16/61/48/1407166148.db2.gz OJWFAVXONGJXQQ-HUUCEWRRSA-N 0 0 394.435 3.178 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000055999155 1407166544 /nfs/dbraw/zinc/16/65/44/1407166544.db2.gz PCNLURSAWHQRQA-KRWDZBQOSA-N 0 0 395.394 3.162 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(OCc3ccccc3)CC2)c(F)c1 ZINC000056001663 1407168523 /nfs/dbraw/zinc/16/85/23/1407168523.db2.gz AYUFAQZPPDXGHM-UHFFFAOYSA-N 0 0 394.424 3.104 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@@H]2C2CCCC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000056034286 1407176349 /nfs/dbraw/zinc/17/63/49/1407176349.db2.gz NHNNRWRINJHJRB-MRXNPFEDSA-N 0 0 396.447 3.244 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCC[C@H]1C1CCCC1 ZINC000056034295 1407176396 /nfs/dbraw/zinc/17/63/96/1407176396.db2.gz RLRBEEOSQSCGMI-INIZCTEOSA-N 0 0 387.436 3.464 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@H]2C2CCCC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000056034287 1407176585 /nfs/dbraw/zinc/17/65/85/1407176585.db2.gz NHNNRWRINJHJRB-INIZCTEOSA-N 0 0 396.447 3.244 20 5 GGBDRN Cc1cn2c(CN(C)S(=O)(=O)c3ccc([N+](=O)[O-])cc3C)c(C)nc2s1 ZINC000056057284 1407183937 /nfs/dbraw/zinc/18/39/37/1407183937.db2.gz DTQYBFVPDZSDGK-UHFFFAOYSA-N 0 0 394.478 3.050 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccnc(OCc2ccccc2)c1 ZINC000056060859 1407185618 /nfs/dbraw/zinc/18/56/18/1407185618.db2.gz WXDQNEDKJFMHPX-UHFFFAOYSA-N 0 0 399.428 3.047 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccnc(Oc3ccccc3)c2)cc1 ZINC000056063234 1407186421 /nfs/dbraw/zinc/18/64/21/1407186421.db2.gz VCMOZZPJYDONPG-UHFFFAOYSA-N 0 0 385.401 3.261 20 5 GGBDRN CCCC(=O)Nc1ccc(CNS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000056068504 1407189437 /nfs/dbraw/zinc/18/94/37/1407189437.db2.gz IBSHJMQQZHZQMW-UHFFFAOYSA-N 0 0 391.449 3.120 20 5 GGBDRN CCCC(=O)Nc1ccc(CNS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000056068395 1407189666 /nfs/dbraw/zinc/18/96/66/1407189666.db2.gz PZQWNVPDSXVQAE-UHFFFAOYSA-N 0 0 391.449 3.120 20 5 GGBDRN CC(C)[C@H](C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)n1nnc(-c2ccccc2)n1 ZINC000056083391 1407196843 /nfs/dbraw/zinc/19/68/43/1407196843.db2.gz IYNSXVHUXMXKSN-RDTXWAMCSA-N 0 0 394.435 3.323 20 5 GGBDRN Cc1ccc(OCCCCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056087684 1407197495 /nfs/dbraw/zinc/19/74/95/1407197495.db2.gz NMUKKFXGTGJBKA-UHFFFAOYSA-N 0 0 378.450 3.182 20 5 GGBDRN CCCCOc1ccc(CCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056087266 1407197749 /nfs/dbraw/zinc/19/77/49/1407197749.db2.gz QWLNBEODLNOSHG-UHFFFAOYSA-N 0 0 392.477 3.436 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)c1ccc(OC(C)C)cc1 ZINC000056077773 1407193469 /nfs/dbraw/zinc/19/34/69/1407193469.db2.gz JAMITBLUNPLRDU-ZDUSSCGKSA-N 0 0 394.449 3.430 20 5 GGBDRN CCOc1ccc(S(=O)(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OCC ZINC000056108738 1407208396 /nfs/dbraw/zinc/20/83/96/1407208396.db2.gz SHTPPSQLHBNAST-CYBMUJFWSA-N 0 0 394.449 3.432 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000056111537 1407209361 /nfs/dbraw/zinc/20/93/61/1407209361.db2.gz RRIPSWNQJPLBLL-HUUCEWRRSA-N 0 0 381.404 3.300 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc([N+](=O)[O-])c[nH]1 ZINC000056112783 1407210028 /nfs/dbraw/zinc/21/00/28/1407210028.db2.gz HAQOJLITJYDGME-UHFFFAOYSA-N 0 0 384.314 3.031 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000056119913 1407212892 /nfs/dbraw/zinc/21/28/92/1407212892.db2.gz JFHXLOQHASLWKO-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000056119853 1407213107 /nfs/dbraw/zinc/21/31/07/1407213107.db2.gz RTMDUOGWXGPKET-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000056110737 1407209131 /nfs/dbraw/zinc/20/91/31/1407209131.db2.gz GNCIJIYKYUYXID-HUUCEWRRSA-N 0 0 377.441 3.469 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@@H]1c1ccccc1C ZINC000056123998 1407215430 /nfs/dbraw/zinc/21/54/30/1407215430.db2.gz YISXBTHTIQJYJL-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000056137532 1407221583 /nfs/dbraw/zinc/22/15/83/1407221583.db2.gz KYRRGZBIMIQZMW-FUHWJXTLSA-N 0 0 394.424 3.241 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000056137731 1407221431 /nfs/dbraw/zinc/22/14/31/1407221431.db2.gz DOUCFXLEWQZSPN-FUHWJXTLSA-N 0 0 394.424 3.241 20 5 GGBDRN COC(=O)[C@@H](C)Sc1ccccc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000056147315 1407226498 /nfs/dbraw/zinc/22/64/98/1407226498.db2.gz GUQYRIILQBTUGQ-CYBMUJFWSA-N 0 0 388.445 3.221 20 5 GGBDRN 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ZINC000046033569 1404280606 /nfs/dbraw/zinc/28/06/06/1404280606.db2.gz ZOMIITDBHQREKB-UHFFFAOYSA-N 0 0 394.449 3.131 20 5 GGBDRN COc1ccc(C(=O)N=c2[nH]cc(Cc3ccccc3F)s2)cc1[N+](=O)[O-] ZINC000046038085 1404281142 /nfs/dbraw/zinc/28/11/42/1404281142.db2.gz ODKATYZVERVYHX-UHFFFAOYSA-N 0 0 387.392 3.464 20 5 GGBDRN C[C@H]1CCCC[C@@H]1OCCN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000046065519 1404287649 /nfs/dbraw/zinc/28/76/49/1404287649.db2.gz YPLHSISWQNFDHA-GJZGRUSLSA-N 0 0 381.498 3.009 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1OCCN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000046065517 1404288011 /nfs/dbraw/zinc/28/80/11/1404288011.db2.gz YPLHSISWQNFDHA-CABCVRRESA-N 0 0 381.498 3.009 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3cccc(C)c3[N+](=O)[O-])c2)n1 ZINC000046065713 1404288021 /nfs/dbraw/zinc/28/80/21/1404288021.db2.gz GCQWXLUHUFPEFN-UHFFFAOYSA-N 0 0 378.388 3.468 20 5 GGBDRN COCCN(C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1)C1CC1 ZINC000046134034 1404309350 /nfs/dbraw/zinc/30/93/50/1404309350.db2.gz RILMWPAAQYISFV-HUUCEWRRSA-N 0 0 375.469 3.328 20 5 GGBDRN C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000046136878 1404309858 /nfs/dbraw/zinc/30/98/58/1404309858.db2.gz QMMKIPPHNAIQGH-GFCCVEGCSA-N 0 0 391.424 3.111 20 5 GGBDRN CCOc1ccc(C(=O)N[C@H](C(=O)NCc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000046146881 1404311656 /nfs/dbraw/zinc/31/16/56/1404311656.db2.gz UZEFEKDYPZMWAE-IBGZPJMESA-N 0 0 399.447 3.064 20 5 GGBDRN Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC000046147609 1404311700 /nfs/dbraw/zinc/31/17/00/1404311700.db2.gz ZQVAVXWRTYCPKF-SFHVURJKSA-N 0 0 395.459 3.380 20 5 GGBDRN COc1ccc(-c2noc(CCCC(=O)NCc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000046149469 1404312099 /nfs/dbraw/zinc/31/20/99/1404312099.db2.gz DWSVLPQGSLSEMA-UHFFFAOYSA-N 0 0 396.403 3.293 20 5 GGBDRN CCOc1ccc(-c2noc(CCC(=O)NCc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000046149614 1404312479 /nfs/dbraw/zinc/31/24/79/1404312479.db2.gz ZIHWSAVYEYOCEH-UHFFFAOYSA-N 0 0 396.403 3.293 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@H](C(=O)NCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000046149721 1404312538 /nfs/dbraw/zinc/31/25/38/1404312538.db2.gz MQZHYDMDGNBAMO-SFHVURJKSA-N 0 0 381.432 3.072 20 5 GGBDRN Cn1ccnc1Sc1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000046183540 1404324263 /nfs/dbraw/zinc/32/42/63/1404324263.db2.gz YFKKAVCZVYZURN-UHFFFAOYSA-N 0 0 384.417 3.497 20 5 GGBDRN CCOc1cc(C(=O)Nc2ccc(C)cc2C(=O)OC)c([N+](=O)[O-])cc1OC ZINC000046186535 1404325801 /nfs/dbraw/zinc/32/58/01/1404325801.db2.gz VHSVFRSMSLFYGF-UHFFFAOYSA-N 0 0 388.376 3.349 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)CC[C@H]1CCCO1)c1ccccc1[N+](=O)[O-] ZINC000046189023 1404326790 /nfs/dbraw/zinc/32/67/90/1404326790.db2.gz MAWKYYYUXXLEGI-ZBFHGGJFSA-N 0 0 378.425 3.053 20 5 GGBDRN COCCN(C(=O)COc1cccc([N+](=O)[O-])c1)c1nc2ccccc2s1 ZINC000046196837 1404328078 /nfs/dbraw/zinc/32/80/78/1404328078.db2.gz DJJBUNFFDHRZAC-UHFFFAOYSA-N 0 0 387.417 3.263 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCC[C@@H]2c2cc(C)on2)cc1[N+](=O)[O-] ZINC000046198044 1404328298 /nfs/dbraw/zinc/32/82/98/1404328298.db2.gz DDXABUAVRWMKII-OAHLLOKOSA-N 0 0 391.449 3.497 20 5 GGBDRN C[C@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2 ZINC000046207775 1404331292 /nfs/dbraw/zinc/33/12/92/1404331292.db2.gz DZOJGMCIPFCDKE-RYUDHWBXSA-N 0 0 385.445 3.447 20 5 GGBDRN Cc1c([C@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1 ZINC000046213493 1404332896 /nfs/dbraw/zinc/33/28/96/1404332896.db2.gz QDXAFBACAGCDMW-ZDUSSCGKSA-N 0 0 398.394 3.484 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1 ZINC000046213491 1404332905 /nfs/dbraw/zinc/33/29/05/1404332905.db2.gz QDXAFBACAGCDMW-CYBMUJFWSA-N 0 0 398.394 3.484 20 5 GGBDRN COc1cc(C(=O)N2CCCc3cc(F)c(F)cc32)c([N+](=O)[O-])cc1OC ZINC000046222656 1404335218 /nfs/dbraw/zinc/33/52/18/1404335218.db2.gz FPQBOFIBINTQFW-UHFFFAOYSA-N 0 0 378.331 3.483 20 5 GGBDRN CC(C)C(=O)Nc1cccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000046220904 1404335396 /nfs/dbraw/zinc/33/53/96/1404335396.db2.gz WDLHSGOIOPQXJL-UHFFFAOYSA-N 0 0 394.391 3.022 20 5 GGBDRN CCc1ccccc1N1C[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC1=O ZINC000046223389 1404336168 /nfs/dbraw/zinc/33/61/68/1404336168.db2.gz RHIKTTCEZYATKF-KRWDZBQOSA-N 0 0 381.432 3.169 20 5 GGBDRN CC(C)Cn1nc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2ccccc2c1=O ZINC000046223435 1404336322 /nfs/dbraw/zinc/33/63/22/1404336322.db2.gz VOMFTCZKBWYUIN-UHFFFAOYSA-N 0 0 394.431 3.233 20 5 GGBDRN Cc1ccc(C(=O)N[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000046223372 1404336543 /nfs/dbraw/zinc/33/65/43/1404336543.db2.gz QIEPGVNSDCCCHY-LJQANCHMSA-N 0 0 383.448 3.316 20 5 GGBDRN C[C@@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000046243766 1404342514 /nfs/dbraw/zinc/34/25/14/1404342514.db2.gz KPACVCCUDPHHOD-AWEZNQCLSA-N 0 0 388.493 3.021 20 5 GGBDRN COC(=O)c1cc(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)oc1C ZINC000046264419 1404350210 /nfs/dbraw/zinc/35/02/10/1404350210.db2.gz BMUQOHLDPGXFJV-NSHDSACASA-N 0 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Cc1cccc(C(=O)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)c1[N+](=O)[O-] ZINC000046335826 1404367787 /nfs/dbraw/zinc/36/77/87/1404367787.db2.gz GWYJONLEJUEAQF-CQSZACIVSA-N 0 0 397.431 3.052 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cccc1[N+](=O)[O-] ZINC000046336780 1404369043 /nfs/dbraw/zinc/36/90/43/1404369043.db2.gz SJTXXDGYWHQAEA-CQSZACIVSA-N 0 0 397.431 3.052 20 5 GGBDRN COc1cc([C@H](C)NC(=O)Cn2cc([N+](=O)[O-])cn2)ccc1OCCC(C)C ZINC000046338750 1404369704 /nfs/dbraw/zinc/36/97/04/1404369704.db2.gz CRCIVCVCBVEQPL-AWEZNQCLSA-N 0 0 390.440 3.102 20 5 GGBDRN COc1ccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000046343711 1404372936 /nfs/dbraw/zinc/37/29/36/1404372936.db2.gz RYTPLTDHZJAQMD-GASCZTMLSA-N 0 0 399.447 3.465 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1nc2ccccc2[nH]1 ZINC000046354834 1404380467 /nfs/dbraw/zinc/38/04/67/1404380467.db2.gz VPJUUGJXUGGFEF-MRXNPFEDSA-N 0 0 378.392 3.475 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000056693771 1407401016 /nfs/dbraw/zinc/40/10/16/1407401016.db2.gz YAWNGMGRFFPTTB-SNVBAGLBSA-N 0 0 376.800 3.491 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1CCN(C(=O)Nc2ccccc2)CC1 ZINC000046361831 1404383861 /nfs/dbraw/zinc/38/38/61/1404383861.db2.gz HJOHPSCAAFBNME-UHFFFAOYSA-N 0 0 396.447 3.497 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc2oc(C3CC3)nc2c1 ZINC000046392586 1404394958 /nfs/dbraw/zinc/39/49/58/1404394958.db2.gz BYMIDNCTSREHBH-UHFFFAOYSA-N 0 0 394.387 3.372 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@H](C)c2cc(F)ccc2OC)cc([N+](=O)[O-])c1 ZINC000046401138 1404399395 /nfs/dbraw/zinc/39/93/95/1404399395.db2.gz QUSGFFBLDJSELZ-NSHDSACASA-N 0 0 390.367 3.410 20 5 GGBDRN COc1ccc(F)cc1[C@H](C)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000046400151 1404399415 /nfs/dbraw/zinc/39/94/15/1404399415.db2.gz UDHRWXAWNCPRAB-LBPRGKRZSA-N 0 0 384.367 3.419 20 5 GGBDRN 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ZINC000046470436 1404431316 /nfs/dbraw/zinc/43/13/16/1404431316.db2.gz PSLTWKOAKYADMP-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN CS(=O)(=O)c1ccc(Nc2cccc(N3CCCCC3=O)c2)c([N+](=O)[O-])c1 ZINC000046485464 1404440993 /nfs/dbraw/zinc/44/09/93/1404440993.db2.gz IVJFKQLJRIGTBQ-UHFFFAOYSA-N 0 0 389.433 3.259 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCO[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000046495176 1404443948 /nfs/dbraw/zinc/44/39/48/1404443948.db2.gz SDKBZULLPOICTI-WMLDXEAASA-N 0 0 380.466 3.007 20 5 GGBDRN O=C(OCc1nc(-c2ccsc2)no1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000046499526 1404447666 /nfs/dbraw/zinc/44/76/66/1404447666.db2.gz LDLPUHUMVIKVRW-UHFFFAOYSA-N 0 0 397.372 3.249 20 5 GGBDRN Cc1ccccc1N1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000046502908 1404449315 /nfs/dbraw/zinc/44/93/15/1404449315.db2.gz ANPSFCGPSZCZCD-UHFFFAOYSA-N 0 0 379.420 3.275 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000046534856 1404467580 /nfs/dbraw/zinc/46/75/80/1404467580.db2.gz SGXSNOOPLDCCHZ-UHFFFAOYSA-N 0 0 384.436 3.076 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000046535660 1404468440 /nfs/dbraw/zinc/46/84/40/1404468440.db2.gz HEPPVVYJMMRYMG-UHFFFAOYSA-N 0 0 395.419 3.032 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000046541350 1404470408 /nfs/dbraw/zinc/47/04/08/1404470408.db2.gz ULUWSOGGYTTXPX-UHFFFAOYSA-N 0 0 388.811 3.238 20 5 GGBDRN COCCOCc1cccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1 ZINC000046615621 1404512685 /nfs/dbraw/zinc/51/26/85/1404512685.db2.gz SHPHQNSSTFGSRV-UHFFFAOYSA-N 0 0 396.403 3.196 20 5 GGBDRN CN(CCCCc1ccccc1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000046633052 1404521082 /nfs/dbraw/zinc/52/10/82/1404521082.db2.gz ZOLQSJKEQIBTSX-UHFFFAOYSA-N 0 0 379.420 3.270 20 5 GGBDRN COC(=O)COc1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000046661485 1404538823 /nfs/dbraw/zinc/53/88/23/1404538823.db2.gz MFKJTBSSRXBLDH-GFCCVEGCSA-N 0 0 390.417 3.266 20 5 GGBDRN Cc1cc(N(C)C)ccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000046675305 1404546018 /nfs/dbraw/zinc/54/60/18/1404546018.db2.gz IMCFJBRPEPIYMN-UHFFFAOYSA-N 0 0 398.419 3.296 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCc1cccc(OCC(F)(F)F)c1 ZINC000046678448 1404548325 /nfs/dbraw/zinc/54/83/25/1404548325.db2.gz LHUOEEHTYVELDE-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN CCOc1ccc([C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)c2ccccc2)cc1 ZINC000046710304 1404560534 /nfs/dbraw/zinc/56/05/34/1404560534.db2.gz ZIDDYQHDUKDFCZ-HXUWFJFHSA-N 0 0 380.404 3.096 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NCCc2c(F)cccc2F)cc([N+](=O)[O-])c1 ZINC000046730997 1404571607 /nfs/dbraw/zinc/57/16/07/1404571607.db2.gz VMGPRKRADJPRGS-UHFFFAOYSA-N 0 0 378.331 3.022 20 5 GGBDRN CCOc1cc(C(=O)NCCc2c(F)cccc2F)c([N+](=O)[O-])cc1OC ZINC000046731170 1404571714 /nfs/dbraw/zinc/57/17/14/1404571714.db2.gz YPTZBEUFDRNRDA-UHFFFAOYSA-N 0 0 380.347 3.253 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCc2c(F)cccc2F)cc1OC ZINC000046731189 1404571746 /nfs/dbraw/zinc/57/17/46/1404571746.db2.gz LKCORYCZWAIIQJ-UHFFFAOYSA-N 0 0 380.347 3.253 20 5 GGBDRN O=C(Nc1nnc(-c2ccccn2)s1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000046754670 1404578799 /nfs/dbraw/zinc/57/87/99/1404578799.db2.gz BETBLRYHSNZTEL-UHFFFAOYSA-N 0 0 382.405 3.335 20 5 GGBDRN O=C(Nc1cccc(N2CCCC2=O)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000046762348 1404580823 /nfs/dbraw/zinc/58/08/23/1404580823.db2.gz VLCFQJDCFGYAOA-UHFFFAOYSA-N 0 0 391.387 3.160 20 5 GGBDRN CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCC(=O)c1ccccc1 ZINC000046761000 1404580923 /nfs/dbraw/zinc/58/09/23/1404580923.db2.gz FHZRVQWCTQZEEI-UHFFFAOYSA-N 0 0 395.371 3.219 20 5 GGBDRN CC(C)(C)c1nnc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000056737274 1407414807 /nfs/dbraw/zinc/41/48/07/1407414807.db2.gz SAIQTHOGSDMWGN-UHFFFAOYSA-N 0 0 390.469 3.098 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CC(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC000046767158 1404583252 /nfs/dbraw/zinc/58/32/52/1404583252.db2.gz PYEXIKQWRXDHKF-UHFFFAOYSA-N 0 0 393.447 3.168 20 5 GGBDRN CC[C@@H]1CCc2nc(NC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)sc2C1 ZINC000046784790 1404588292 /nfs/dbraw/zinc/58/82/92/1404588292.db2.gz HSRWTCNLPUKEOC-LLVKDONJSA-N 0 0 398.448 3.399 20 5 GGBDRN O=C(Nc1ccn(Cc2ccccc2)n1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000046785796 1404589401 /nfs/dbraw/zinc/58/94/01/1404589401.db2.gz MVTKQCGRXXMVJV-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN CCOc1cc(C(=O)Nc2ccn(Cc3ccccc3)n2)c([N+](=O)[O-])cc1OC ZINC000046794658 1404591189 /nfs/dbraw/zinc/59/11/89/1404591189.db2.gz SWIAHJRFCUBGIQ-UHFFFAOYSA-N 0 0 396.403 3.499 20 5 GGBDRN CCOc1cc(C(=O)Nc2cccc(-c3nnco3)c2)c([N+](=O)[O-])cc1OC ZINC000046793569 1404591207 /nfs/dbraw/zinc/59/12/07/1404591207.db2.gz LBNLXIGVOHPIOF-UHFFFAOYSA-N 0 0 384.348 3.304 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccn(Cc3ccccc3)n2)cc1[N+](=O)[O-] ZINC000046795016 1404592354 /nfs/dbraw/zinc/59/23/54/1404592354.db2.gz VPXMCMXDFFTSNK-UHFFFAOYSA-N 0 0 381.348 3.309 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)nc1 ZINC000046808420 1404597312 /nfs/dbraw/zinc/59/73/12/1404597312.db2.gz ORDIQNKWAWUIRH-UHFFFAOYSA-N 0 0 382.420 3.098 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)nc1 ZINC000046808761 1404597440 /nfs/dbraw/zinc/59/74/40/1404597440.db2.gz ROCISNNSYMJQEO-UHFFFAOYSA-N 0 0 382.420 3.098 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cccc(C)c3[N+](=O)[O-])C2)nc1 ZINC000046817386 1404600971 /nfs/dbraw/zinc/60/09/71/1404600971.db2.gz VVVGLQQAKZZKNB-HNNXBMFYSA-N 0 0 382.420 3.098 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CNC(=O)c1ccc(C(C)(C)C)cc1 ZINC000046864031 1404616121 /nfs/dbraw/zinc/61/61/21/1404616121.db2.gz BLAFKENAVSPIMQ-UHFFFAOYSA-N 0 0 383.448 3.281 20 5 GGBDRN O=C(NCCC1CCCCC1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000046902934 1404629391 /nfs/dbraw/zinc/62/93/91/1404629391.db2.gz PAGQWVSEMHLGGJ-UHFFFAOYSA-N 0 0 394.497 3.094 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cc(OC)c(OC)c(OC)c1 ZINC000046923755 1404636560 /nfs/dbraw/zinc/63/65/60/1404636560.db2.gz YPFZJIMHAWQZGJ-LLVKDONJSA-N 0 0 390.392 3.120 20 5 GGBDRN CCCOc1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C)c1 ZINC000056747186 1407417934 /nfs/dbraw/zinc/41/79/34/1407417934.db2.gz SRMNVBLPYBCYQI-UHFFFAOYSA-N 0 0 399.451 3.441 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N(C)c2ccccc2)cc1OC ZINC000046951120 1404649031 /nfs/dbraw/zinc/64/90/31/1404649031.db2.gz NAOKSPSMINYNLO-CQSZACIVSA-N 0 0 387.436 3.257 20 5 GGBDRN CCOc1cc(C(=O)NCCOc2c(C)cccc2C)c([N+](=O)[O-])cc1OC ZINC000047024409 1404678757 /nfs/dbraw/zinc/67/87/57/1404678757.db2.gz FCCJLNCYVFWSCP-UHFFFAOYSA-N 0 0 388.420 3.428 20 5 GGBDRN O=Cc1ccc(OS(=O)(=O)c2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000047030124 1404680677 /nfs/dbraw/zinc/68/06/77/1404680677.db2.gz VXAIOTTVLZGMRD-UHFFFAOYSA-N 0 0 375.280 3.194 20 5 GGBDRN O=C(NCc1ccoc1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000047089114 1404701258 /nfs/dbraw/zinc/70/12/58/1404701258.db2.gz VIUUTXWGJBMZJW-UHFFFAOYSA-N 0 0 398.341 3.238 20 5 GGBDRN COc1cc(C)c([C@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000047109875 1404709388 /nfs/dbraw/zinc/70/93/88/1404709388.db2.gz KKZKLGNYLAVNIQ-NSHDSACASA-N 0 0 384.392 3.288 20 5 GGBDRN CCCNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c1 ZINC000047119838 1404714190 /nfs/dbraw/zinc/71/41/90/1404714190.db2.gz QMTZARDCINOMGV-UHFFFAOYSA-N 0 0 386.364 3.204 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000047125045 1404714660 /nfs/dbraw/zinc/71/46/60/1404714660.db2.gz PNAUHUPFJWTHQS-UHFFFAOYSA-N 0 0 376.800 3.320 20 5 GGBDRN O=C(NCCOc1ccc2c(c1)OCO2)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000047130777 1404716931 /nfs/dbraw/zinc/71/69/31/1404716931.db2.gz CAADXJOFZQYYNI-UHFFFAOYSA-N 0 0 379.756 3.177 20 5 GGBDRN O=C(Cn1nccc1[N+](=O)[O-])Nc1cc(-c2ccccc2)nn1-c1ccccc1 ZINC000047169961 1404729777 /nfs/dbraw/zinc/72/97/77/1404729777.db2.gz OUNYYBWZTZKSME-UHFFFAOYSA-N 0 0 388.387 3.283 20 5 GGBDRN O=C(Cn1nccc1[N+](=O)[O-])N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000047169083 1404730249 /nfs/dbraw/zinc/73/02/49/1404730249.db2.gz HCTKTVRBPJGAGV-GFCCVEGCSA-N 0 0 387.446 3.292 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCNC(=O)C[C@H]1c1ccccc1 ZINC000047175658 1404733333 /nfs/dbraw/zinc/73/33/33/1404733333.db2.gz AXXMYHXQTVZIAO-KDOFPFPSSA-N 0 0 399.472 3.165 20 5 GGBDRN CCn1cnnc1CNC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000047200934 1404744981 /nfs/dbraw/zinc/74/49/81/1404744981.db2.gz YYUMWLCSCBKYSH-UHFFFAOYSA-N 0 0 377.470 3.274 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccc(Cn3cccn3)cc2)c1C ZINC000047211432 1404749113 /nfs/dbraw/zinc/74/91/13/1404749113.db2.gz CVALPSVIEMMURH-UHFFFAOYSA-N 0 0 386.433 3.257 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cccnc2N2CCCC2)cc([N+](=O)[O-])c1 ZINC000047225823 1404753886 /nfs/dbraw/zinc/75/38/86/1404753886.db2.gz QUVBDFUMWZHKRB-UHFFFAOYSA-N 0 0 384.392 3.019 20 5 GGBDRN O=C(Nc1cccnc1N1CCCC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047225845 1404754113 /nfs/dbraw/zinc/75/41/13/1404754113.db2.gz ZOGRALWOFUHUIZ-UHFFFAOYSA-N 0 0 395.463 3.445 20 5 GGBDRN O=C(NCc1cccc(CN2CCOCC2)c1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000047227849 1404757096 /nfs/dbraw/zinc/75/70/96/1404757096.db2.gz USPMDZAVKYHLPO-UHFFFAOYSA-N 0 0 389.839 3.010 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000047229512 1404758251 /nfs/dbraw/zinc/75/82/51/1404758251.db2.gz WRBDZUPSFOXTDL-UHFFFAOYSA-N 0 0 379.420 3.272 20 5 GGBDRN O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000047292828 1404791701 /nfs/dbraw/zinc/79/17/01/1404791701.db2.gz BVCRVGHYJDNNEH-UHFFFAOYSA-N 0 0 388.811 3.134 20 5 GGBDRN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000047292702 1404791764 /nfs/dbraw/zinc/79/17/64/1404791764.db2.gz ZJJQPCLOKGRDRS-LBPRGKRZSA-N 0 0 388.811 3.134 20 5 GGBDRN Cc1c(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C ZINC000047318809 1404803847 /nfs/dbraw/zinc/80/38/47/1404803847.db2.gz IXOCSWOIJSHMQM-ZDUSSCGKSA-N 0 0 395.419 3.275 20 5 GGBDRN Cn1cc(-c2nc(COC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cs2)cn1 ZINC000047317383 1404804007 /nfs/dbraw/zinc/80/40/07/1404804007.db2.gz ILWITJIZUGCPHQ-UHFFFAOYSA-N 0 0 378.797 3.462 20 5 GGBDRN Cc1c(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C ZINC000047318811 1404804043 /nfs/dbraw/zinc/80/40/43/1404804043.db2.gz IXOCSWOIJSHMQM-CYBMUJFWSA-N 0 0 395.419 3.275 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cc(-c3nnco3)ccc2C)cc([N+](=O)[O-])c1 ZINC000047320609 1404804856 /nfs/dbraw/zinc/80/48/56/1404804856.db2.gz MPKUJJQJPZECNL-UHFFFAOYSA-N 0 0 396.359 3.382 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000047323307 1404805651 /nfs/dbraw/zinc/80/56/51/1404805651.db2.gz ANAHQSMYCMTFFQ-UHFFFAOYSA-N 0 0 376.457 3.452 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)Nc3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000047322956 1404805681 /nfs/dbraw/zinc/80/56/81/1404805681.db2.gz ZJXKMAUTUGWRSR-AWEZNQCLSA-N 0 0 383.408 3.181 20 5 GGBDRN Cc1ccc(NC(=O)NCc2cccc(CN3CCOCC3)c2)cc1[N+](=O)[O-] ZINC000047323214 1404805688 /nfs/dbraw/zinc/80/56/88/1404805688.db2.gz NGDRYVWOLNCXMG-UHFFFAOYSA-N 0 0 384.436 3.057 20 5 GGBDRN O=C(NCc1cccc(C(=O)NCc2ccco2)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000047322886 1404805826 /nfs/dbraw/zinc/80/58/26/1404805826.db2.gz CQUOIAHZMSXIOO-UHFFFAOYSA-N 0 0 394.387 3.440 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000047323362 1404805880 /nfs/dbraw/zinc/80/58/80/1404805880.db2.gz FAFUPINZDJDDFF-OAHLLOKOSA-N 0 0 397.435 3.489 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000047346932 1404812190 /nfs/dbraw/zinc/81/21/90/1404812190.db2.gz PSWXHJHOIXDUTB-HXUWFJFHSA-N 0 0 383.404 3.047 20 5 GGBDRN Cc1c(NC(=O)NCc2cccc(CN3CCOCC3)c2)cccc1[N+](=O)[O-] ZINC000047345877 1404812225 /nfs/dbraw/zinc/81/22/25/1404812225.db2.gz XQMZMUSHPKBCAG-UHFFFAOYSA-N 0 0 384.436 3.057 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000047346930 1404812305 /nfs/dbraw/zinc/81/23/05/1404812305.db2.gz PSWXHJHOIXDUTB-FQEVSTJZSA-N 0 0 383.404 3.047 20 5 GGBDRN C[C@]1(c2ccc(Cl)cc2)NC(=O)N(CCOc2ccc([N+](=O)[O-])cc2)C1=O ZINC000047346684 1404812388 /nfs/dbraw/zinc/81/23/88/1404812388.db2.gz SFNJUFHRZMKFPH-GOSISDBHSA-N 0 0 389.795 3.094 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)nc1 ZINC000047345920 1404812413 /nfs/dbraw/zinc/81/24/13/1404812413.db2.gz NJGUPAUXESSNCV-HNNXBMFYSA-N 0 0 397.435 3.489 20 5 GGBDRN CC[C@]1(c2ccc(F)cc2)NC(=O)N(Cc2ccc(OC)c([N+](=O)[O-])c2)C1=O ZINC000047347939 1404813120 /nfs/dbraw/zinc/81/31/20/1404813120.db2.gz UXLXTISQHJFUSS-LJQANCHMSA-N 0 0 387.367 3.100 20 5 GGBDRN C[C@@]1(c2cc3ccccc3o2)NC(=O)N(CCOc2cccc([N+](=O)[O-])c2)C1=O ZINC000047354307 1404814201 /nfs/dbraw/zinc/81/42/01/1404814201.db2.gz FXHDPAGEPVALAU-FQEVSTJZSA-N 0 0 395.371 3.187 20 5 GGBDRN COc1ccc(CC[C@]2(C)NC(=O)N(Cc3cccc([N+](=O)[O-])c3C)C2=O)cc1 ZINC000047354026 1404814235 /nfs/dbraw/zinc/81/42/35/1404814235.db2.gz 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O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@@H](c4ccc(F)cc4)C3)n2)cc1 ZINC000047406812 1404829052 /nfs/dbraw/zinc/82/90/52/1404829052.db2.gz TZHVLEOHIDHYGV-QGZVFWFLSA-N 0 0 384.367 3.357 20 5 GGBDRN O=C(NCc1ccc(-n2cncn2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000047419262 1404831613 /nfs/dbraw/zinc/83/16/13/1404831613.db2.gz RMZDODSSJXIBRN-UHFFFAOYSA-N 0 0 379.401 3.320 20 5 GGBDRN O=C(Nc1cccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1)c1cccnc1 ZINC000047444468 1404838873 /nfs/dbraw/zinc/83/88/73/1404838873.db2.gz UHJOYWQZRCJMFF-UHFFFAOYSA-N 0 0 388.383 3.445 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N([C@H](C)C2CC2)C2CC2)cc1OC ZINC000047449108 1404840651 /nfs/dbraw/zinc/84/06/51/1404840651.db2.gz QGPUMDCMEDYRNC-GFCCVEGCSA-N 0 0 378.425 3.032 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cnn1C ZINC000047491709 1404851234 /nfs/dbraw/zinc/85/12/34/1404851234.db2.gz KDKLVTKBCWLJDV-SNVBAGLBSA-N 0 0 399.373 3.335 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CNC(=O)c1ccc(Cl)cc1Cl 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CCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000064128693 1408491099 /nfs/dbraw/zinc/49/10/99/1408491099.db2.gz WYVVSGQHBVOJQS-UHFFFAOYSA-N 0 0 392.209 3.359 20 5 GGBDRN CCN(CCC(=O)OC)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000064302011 1408531380 /nfs/dbraw/zinc/53/13/80/1408531380.db2.gz DQRMHJXNSFJLNY-UHFFFAOYSA-N 0 0 385.420 3.232 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1 ZINC000064331939 1408535027 /nfs/dbraw/zinc/53/50/27/1408535027.db2.gz GPINONSPPBDIDW-UHFFFAOYSA-N 0 0 382.424 3.222 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N1N=C(c2cccs2)C[C@@H]1c1ccco1 ZINC000064332034 1408535069 /nfs/dbraw/zinc/53/50/69/1408535069.db2.gz ZBQYYGFOZMFBSA-CYBMUJFWSA-N 0 0 385.405 3.132 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1 ZINC000064332164 1408535973 /nfs/dbraw/zinc/53/59/73/1408535973.db2.gz DUSSNDFJSLPWSK-ZDUSSCGKSA-N 0 0 385.405 3.132 20 5 GGBDRN CC(C)N(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350029 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3.102 20 5 GGBDRN CN(CCOc1ccccc1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000064691071 1408597025 /nfs/dbraw/zinc/59/70/25/1408597025.db2.gz PAJUCGIYTCYFKY-UHFFFAOYSA-N 0 0 380.404 3.146 20 5 GGBDRN COCCN(Cc1ccco1)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000064724002 1408600665 /nfs/dbraw/zinc/60/06/65/1408600665.db2.gz XKKNLSSIZWPOMX-GFCCVEGCSA-N 0 0 382.800 3.284 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(S(C)(=O)=O)c1 ZINC000064723315 1408600875 /nfs/dbraw/zinc/60/08/75/1408600875.db2.gz YQTLUXUYTQJEFE-JTQLQIEISA-N 0 0 398.824 3.058 20 5 GGBDRN CN(CCOc1ccc(F)cc1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000064760950 1408609617 /nfs/dbraw/zinc/60/96/17/1408609617.db2.gz DPKUWRNHGQRUQC-UHFFFAOYSA-N 0 0 398.394 3.285 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1c[nH]c2ncccc12)c1ccccc1[N+](=O)[O-] ZINC000064760764 1408609671 /nfs/dbraw/zinc/60/96/71/1408609671.db2.gz CGRVMRFXYXEEFQ-MRXNPFEDSA-N 0 0 396.403 3.284 20 5 GGBDRN CNC(=O)c1cc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)ccc1Cl ZINC000064838220 1408619937 /nfs/dbraw/zinc/61/99/37/1408619937.db2.gz FPOBCDRXRPBLNE-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2ccc(Br)cc2)c1 ZINC000064845412 1408621068 /nfs/dbraw/zinc/62/10/68/1408621068.db2.gz TUVFZIFRVXXHEO-UHFFFAOYSA-N 0 0 379.166 3.187 20 5 GGBDRN COc1ccc(OCCSCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000064855061 1408621729 /nfs/dbraw/zinc/62/17/29/1408621729.db2.gz XIBQAZRKVKZCRA-UHFFFAOYSA-N 0 0 388.445 3.305 20 5 GGBDRN COc1cccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000064867005 1408622410 /nfs/dbraw/zinc/62/24/10/1408622410.db2.gz VGMDQUHQAYUOTN-KRWDZBQOSA-N 0 0 385.420 3.007 20 5 GGBDRN CC(C)CC(=O)Nc1cccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1 ZINC000064879071 1408624868 /nfs/dbraw/zinc/62/48/68/1408624868.db2.gz GUNREZOGGLOPCU-UHFFFAOYSA-N 0 0 388.399 3.231 20 5 GGBDRN CC[C@@H](C)[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)OC ZINC000064894195 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375.450 3.059 20 5 GGBDRN Cc1ccc(CNCc2ccccc2S(=O)(=O)NC(C)(C)C)cc1[N+](=O)[O-] ZINC000065013809 1408636076 /nfs/dbraw/zinc/63/60/76/1408636076.db2.gz SUNVHUSHXHMZCP-UHFFFAOYSA-N 0 0 391.493 3.270 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000065070960 1408641415 /nfs/dbraw/zinc/64/14/15/1408641415.db2.gz HFYHOIXHSPPHCZ-SNVBAGLBSA-N 0 0 377.784 3.474 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000065076401 1408641955 /nfs/dbraw/zinc/64/19/55/1408641955.db2.gz PPCOADBEVJUAPE-CYBMUJFWSA-N 0 0 386.408 3.009 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000065091852 1408644151 /nfs/dbraw/zinc/64/41/51/1408644151.db2.gz YOQGQYHAHVIBJY-QGZVFWFLSA-N 0 0 388.445 3.498 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@H](C)COc2cccc(C)c2)cc([N+](=O)[O-])c1 ZINC000065116362 1408646251 /nfs/dbraw/zinc/64/62/51/1408646251.db2.gz DJGNDPOJXCUBFL-AWEZNQCLSA-N 0 0 386.404 3.277 20 5 GGBDRN 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COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(-n2ccnc2)c(F)c1 ZINC000067556215 1409160402 /nfs/dbraw/zinc/16/04/02/1409160402.db2.gz IOXSSOJBHQSQPU-UHFFFAOYSA-N 0 0 385.355 3.250 20 5 GGBDRN COCc1nc2cc(NC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)ccc2o1 ZINC000176613617 1428380306 /nfs/dbraw/zinc/38/03/06/1428380306.db2.gz CPIKDQAGILQWNZ-UHFFFAOYSA-N 0 0 393.359 3.320 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000067592683 1409178728 /nfs/dbraw/zinc/17/87/28/1409178728.db2.gz SWUKRZGZSAWBTH-GFCCVEGCSA-N 0 0 399.230 3.380 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCC2(c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] ZINC000067598379 1409181363 /nfs/dbraw/zinc/18/13/63/1409181363.db2.gz UEXHWPJUIZUMQB-UHFFFAOYSA-N 0 0 387.823 3.343 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@H](c2ccccc2)CC1 ZINC000067598670 1409182430 /nfs/dbraw/zinc/18/24/30/1409182430.db2.gz HCQXHQBWYFUPQC-INIZCTEOSA-N 0 0 397.431 3.338 20 5 GGBDRN Cc1cccc(C)c1OC[C@@H](O)CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000067604196 1409184039 /nfs/dbraw/zinc/18/40/39/1409184039.db2.gz GULHQNRWUOFMTG-YJBOKZPZSA-N 0 0 387.436 3.012 20 5 GGBDRN Cc1cccc(C)c1OC[C@@H](O)CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000067604200 1409184344 /nfs/dbraw/zinc/18/43/44/1409184344.db2.gz GULHQNRWUOFMTG-QAPCUYQASA-N 0 0 387.436 3.012 20 5 GGBDRN O=C(NCc1nccn1CCCc1ccccc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000176637262 1428387604 /nfs/dbraw/zinc/38/76/04/1428387604.db2.gz ASJQGSMCITZOQF-UHFFFAOYSA-N 0 0 382.395 3.493 20 5 GGBDRN Cc1nn(CCC(=O)Oc2ccccc2OCC(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000067644017 1409193932 /nfs/dbraw/zinc/19/39/32/1409193932.db2.gz FXPQZIUFVFVNLU-UHFFFAOYSA-N 0 0 387.314 3.345 20 5 GGBDRN COCc1ccccc1CNC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000067648578 1409197791 /nfs/dbraw/zinc/19/77/91/1409197791.db2.gz HBZVAMOPXXWGDB-UHFFFAOYSA-N 0 0 379.210 3.434 20 5 GGBDRN CC(=O)c1sc(NC(=O)CCn2cc([N+](=O)[O-])cn2)nc1-c1ccccc1 ZINC000067658026 1409198989 /nfs/dbraw/zinc/19/89/89/1409198989.db2.gz WOFTXZADSIUVSM-UHFFFAOYSA-N 0 0 385.405 3.146 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1nc(-c2ccc(F)c(F)c2)cs1 ZINC000067657970 1409199071 /nfs/dbraw/zinc/19/90/71/1409199071.db2.gz GFODGLAFUGRPLR-UHFFFAOYSA-N 0 0 379.348 3.222 20 5 GGBDRN C[C@@H](COCC(F)(F)F)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000067676749 1409204623 /nfs/dbraw/zinc/20/46/23/1409204623.db2.gz NIXYIODDQFRWMW-ZETCQYMHSA-N 0 0 387.261 3.285 20 5 GGBDRN O=C(NCc1ccccc1N1CCOCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000067679728 1409205207 /nfs/dbraw/zinc/20/52/07/1409205207.db2.gz ZMZQYCFZNLDDRI-UHFFFAOYSA-N 0 0 375.812 3.015 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1ccc(COCC(F)(F)F)cc1 ZINC000067707059 1409210891 /nfs/dbraw/zinc/21/08/91/1409210891.db2.gz LZKLQAYNSVKSOT-UHFFFAOYSA-N 0 0 397.353 3.402 20 5 GGBDRN C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC000067708821 1409211548 /nfs/dbraw/zinc/21/15/48/1409211548.db2.gz WJWNMNZGFSALOR-CYBMUJFWSA-N 0 0 382.420 3.233 20 5 GGBDRN O=C(Nc1ccc2oc(=O)ccc2c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000067719418 1409214438 /nfs/dbraw/zinc/21/44/38/1409214438.db2.gz RHXKKHAAOUIOFE-UHFFFAOYSA-N 0 0 394.387 3.055 20 5 GGBDRN O=C(Nc1ccc2oc(=O)ccc2c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000067719202 1409214584 /nfs/dbraw/zinc/21/45/84/1409214584.db2.gz ANQKKVJXWZPPLK-UHFFFAOYSA-N 0 0 394.387 3.055 20 5 GGBDRN COc1cccc(CN(C[C@@H]2CCCO2)C(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000067722735 1409215081 /nfs/dbraw/zinc/21/50/81/1409215081.db2.gz RWOFSBBUIUPIBM-FQEVSTJZSA-N 0 0 399.447 3.494 20 5 GGBDRN CN(C)C(=O)Sc1cccc(Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)c1 ZINC000176627849 1428384034 /nfs/dbraw/zinc/38/40/34/1428384034.db2.gz YPTYQDUMTSQUHH-UHFFFAOYSA-N 0 0 384.417 3.127 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCN1Cc2ccccc2C1 ZINC000067743963 1409219045 /nfs/dbraw/zinc/21/90/45/1409219045.db2.gz BYGHOFNYNKQZIW-UHFFFAOYSA-N 0 0 397.478 3.287 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1nncn1C(C)(C)C ZINC000067750964 1409221213 /nfs/dbraw/zinc/22/12/13/1409221213.db2.gz UFTWPISLOSEMIJ-UHFFFAOYSA-N 0 0 379.442 3.071 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)Sc2nncn2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000067751255 1409221411 /nfs/dbraw/zinc/22/14/11/1409221411.db2.gz SIFQVJAKJGUMMZ-SNVBAGLBSA-N 0 0 379.442 3.069 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nncn1C(C)(C)C ZINC000067752991 1409221864 /nfs/dbraw/zinc/22/18/64/1409221864.db2.gz XJQKHYPUOACKAY-JTQLQIEISA-N 0 0 379.442 3.069 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c1 ZINC000067751980 1409222019 /nfs/dbraw/zinc/22/20/19/1409222019.db2.gz JQBMFAHBBSAXAW-UHFFFAOYSA-N 0 0 389.795 3.401 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000067753274 1409222257 /nfs/dbraw/zinc/22/22/57/1409222257.db2.gz FEEHMTJVIPRPDC-SFHVURJKSA-N 0 0 388.445 3.284 20 5 GGBDRN CC(C)c1cccc(N(C)C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c1 ZINC000067763399 1409224245 /nfs/dbraw/zinc/22/42/45/1409224245.db2.gz JBJYQOKSHVOSIU-UHFFFAOYSA-N 0 0 376.434 3.398 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1C(F)(F)F ZINC000067766484 1409225237 /nfs/dbraw/zinc/22/52/37/1409225237.db2.gz KGLUVGOHKZNVRL-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN CCCOc1ccc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000067766098 1409225271 /nfs/dbraw/zinc/22/52/71/1409225271.db2.gz DSGUSOQETKWOGG-UHFFFAOYSA-N 0 0 391.811 3.292 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2 ZINC000067766549 1409225324 /nfs/dbraw/zinc/22/53/24/1409225324.db2.gz JPWSPWHRNGFTAR-UHFFFAOYSA-N 0 0 387.395 3.421 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cc1ccccc1 ZINC000067766623 1409225356 /nfs/dbraw/zinc/22/53/56/1409225356.db2.gz SJOCWXJKCLZVDC-UHFFFAOYSA-N 0 0 389.411 3.441 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1OC1CCCC1 ZINC000067766035 1409225419 /nfs/dbraw/zinc/22/54/19/1409225419.db2.gz AXZJYLBGVUZDBW-UHFFFAOYSA-N 0 0 383.404 3.171 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2csc(CC)n2)cc1OC ZINC000067769410 1409226141 /nfs/dbraw/zinc/22/61/41/1409226141.db2.gz MWPXJXWYPXXPLC-UHFFFAOYSA-N 0 0 379.438 3.293 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000067789548 1409232023 /nfs/dbraw/zinc/23/20/23/1409232023.db2.gz JEFVFIGAOKAYME-UHFFFAOYSA-N 0 0 378.406 3.331 20 5 GGBDRN COc1ccc(CC(=O)N(Cc2cccs2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000067794666 1409232655 /nfs/dbraw/zinc/23/26/55/1409232655.db2.gz AAOKKJIBRJEEMW-OAHLLOKOSA-N 0 0 390.461 3.415 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(OC(F)F)c(OC)c2)cc1[N+](=O)[O-] ZINC000067794800 1409232667 /nfs/dbraw/zinc/23/26/67/1409232667.db2.gz DNICIMVWPUCCMO-UHFFFAOYSA-N 0 0 396.346 3.072 20 5 GGBDRN COc1ccc(CC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000067794659 1409232713 /nfs/dbraw/zinc/23/27/13/1409232713.db2.gz AAOKKJIBRJEEMW-HNNXBMFYSA-N 0 0 390.461 3.415 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc3c(cc2Cl)OCCO3)cc1[N+](=O)[O-] ZINC000067795763 1409232945 /nfs/dbraw/zinc/23/29/45/1409232945.db2.gz CEXMHZWJKYRTJF-UHFFFAOYSA-N 0 0 378.768 3.209 20 5 GGBDRN COc1ccc(CC(=O)Nc2c3c(nn2-c2ccccc2)CCC3)cc1[N+](=O)[O-] ZINC000067796434 1409233395 /nfs/dbraw/zinc/23/33/95/1409233395.db2.gz JHSZGUSHOKAVIO-UHFFFAOYSA-N 0 0 392.415 3.459 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccnn2Cc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000067801990 1409234320 /nfs/dbraw/zinc/23/43/20/1409234320.db2.gz VOADHUYCACJJJN-UHFFFAOYSA-N 0 0 380.404 3.338 20 5 GGBDRN C[C@@H](Sc1ncccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000067807351 1409234694 /nfs/dbraw/zinc/23/46/94/1409234694.db2.gz PHMNAXXSZMPEQR-LLVKDONJSA-N 0 0 375.406 3.270 20 5 GGBDRN COc1ccc(CC(=O)NCc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000067814345 1409236669 /nfs/dbraw/zinc/23/66/69/1409236669.db2.gz HZKYWSHXNBDDHL-UHFFFAOYSA-N 0 0 398.337 3.403 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(NC(C)=O)ccc2Cl)cc1[N+](=O)[O-] ZINC000067817429 1409237275 /nfs/dbraw/zinc/23/72/75/1409237275.db2.gz NARVOXFZXIMHGW-UHFFFAOYSA-N 0 0 377.784 3.396 20 5 GGBDRN COc1ccc(CC(=O)N(Cc2ccccc2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000067818715 1409237643 /nfs/dbraw/zinc/23/76/43/1409237643.db2.gz JIZVNQYVECAXRU-GOSISDBHSA-N 0 0 384.432 3.354 20 5 GGBDRN COc1ccc(CC(=O)N[C@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000067819123 1409237896 /nfs/dbraw/zinc/23/78/96/1409237896.db2.gz SUYIUCWELYDRCD-AWEZNQCLSA-N 0 0 376.796 3.439 20 5 GGBDRN O=C(COc1ccccc1OCC(F)(F)F)NCc1cccc([N+](=O)[O-])c1 ZINC000067820446 1409238163 /nfs/dbraw/zinc/23/81/63/1409238163.db2.gz TYSATQJGXSGTLV-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067821309 1409238245 /nfs/dbraw/zinc/23/82/45/1409238245.db2.gz LVICTYFNMAZLKI-ZDUSSCGKSA-N 0 0 382.420 3.393 20 5 GGBDRN COc1ccc(CC(=O)N2CCC[C@@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000067820883 1409238260 /nfs/dbraw/zinc/23/82/60/1409238260.db2.gz YDYJVKXMQVZUSI-QGZVFWFLSA-N 0 0 394.431 3.396 20 5 GGBDRN COC(=O)C[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1cccs1 ZINC000067825833 1409238653 /nfs/dbraw/zinc/23/86/53/1409238653.db2.gz AYOWTMYQBSDVHJ-AWEZNQCLSA-N 0 0 387.417 3.032 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCCc1ccc(-n2cccn2)cc1 ZINC000067825947 1409238696 /nfs/dbraw/zinc/23/86/96/1409238696.db2.gz SFLIOBMRGGSKJC-UHFFFAOYSA-N 0 0 389.415 3.094 20 5 GGBDRN C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000067825073 1409238771 /nfs/dbraw/zinc/23/87/71/1409238771.db2.gz HXLYUUSHVZSBCE-SNVBAGLBSA-N 0 0 394.330 3.440 20 5 GGBDRN COc1ccc(CC(=O)NCCCc2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000067834834 1409241018 /nfs/dbraw/zinc/24/10/18/1409241018.db2.gz NFHAUMAVOKHWOJ-UHFFFAOYSA-N 0 0 389.477 3.230 20 5 GGBDRN CCOc1ccccc1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067844500 1409242893 /nfs/dbraw/zinc/24/28/93/1409242893.db2.gz OADWDBOXKAOCSV-UHFFFAOYSA-N 0 0 380.404 3.152 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000067869640 1409246570 /nfs/dbraw/zinc/24/65/70/1409246570.db2.gz RMESGSDEHZQNCM-GOSISDBHSA-N 0 0 395.415 3.360 20 5 GGBDRN O=C(NCCCCCc1ccccc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000067876051 1409248228 /nfs/dbraw/zinc/24/82/28/1409248228.db2.gz AGDFPFFJUDDICL-UHFFFAOYSA-N 0 0 379.420 3.318 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C12CCCCC2 ZINC000176642717 1428388546 /nfs/dbraw/zinc/38/85/46/1428388546.db2.gz KVBNEJOTOXZLFO-MSOLQXFVSA-N 0 0 399.447 3.294 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C12CCCCC2 ZINC000176642654 1428388842 /nfs/dbraw/zinc/38/88/42/1428388842.db2.gz KVBNEJOTOXZLFO-ZWKOTPCHSA-N 0 0 399.447 3.294 20 5 GGBDRN COc1ccc(CC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-] ZINC000067903421 1409252715 /nfs/dbraw/zinc/25/27/15/1409252715.db2.gz FYEHFEUKCSGAFN-UHFFFAOYSA-N 0 0 392.415 3.338 20 5 GGBDRN COc1ccc(CC(=O)NCCCCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000067902798 1409252732 /nfs/dbraw/zinc/25/27/32/1409252732.db2.gz FTBOVFWZBKZBGB-UHFFFAOYSA-N 0 0 376.384 3.260 20 5 GGBDRN C[C@@H]1CN(Cc2cccc(CNc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])c2)CCO1 ZINC000067903805 1409253084 /nfs/dbraw/zinc/25/30/84/1409253084.db2.gz TYKRNASUSMBQDB-CQSZACIVSA-N 0 0 386.408 3.336 20 5 GGBDRN COc1ccc(CC(=O)NCCCn2c(C)nc3ccccc32)cc1[N+](=O)[O-] ZINC000067906801 1409253541 /nfs/dbraw/zinc/25/35/41/1409253541.db2.gz QNCLTKWFEDUXGJ-UHFFFAOYSA-N 0 0 382.420 3.011 20 5 GGBDRN CSCCc1ccc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000067938189 1409260453 /nfs/dbraw/zinc/26/04/53/1409260453.db2.gz RZAIRGYDSMWDPB-CYBMUJFWSA-N 0 0 387.461 3.257 20 5 GGBDRN CSCCc1ccc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000067938188 1409260647 /nfs/dbraw/zinc/26/06/47/1409260647.db2.gz RZAIRGYDSMWDPB-ZDUSSCGKSA-N 0 0 387.461 3.257 20 5 GGBDRN O=C(Nc1cc(-c2ccccc2)on1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000176644916 1428389650 /nfs/dbraw/zinc/38/96/50/1428389650.db2.gz HLTIBDXEKWGMEP-UHFFFAOYSA-N 0 0 376.328 3.344 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc(NC(C)=O)cc2Cl)ccc1[N+](=O)[O-] 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Cc1cc(Cl)c(S(=O)(=O)NC(C)(C)c2nccs2)cc1[N+](=O)[O-] ZINC000176718163 1428431831 /nfs/dbraw/zinc/43/18/31/1428431831.db2.gz SONFSAJJGKZVQY-UHFFFAOYSA-N 0 0 375.859 3.227 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccccc1OCc1cscn1 ZINC000071036839 1409814857 /nfs/dbraw/zinc/81/48/57/1409814857.db2.gz GIMDSEKIXYSQKV-UHFFFAOYSA-N 0 0 398.444 3.472 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCOC[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000071042612 1409815134 /nfs/dbraw/zinc/81/51/34/1409815134.db2.gz AIFKHXNIGHWJHJ-OAHLLOKOSA-N 0 0 382.482 3.110 20 5 GGBDRN CC(C)C[C@H]1COCCN1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000071040724 1409815213 /nfs/dbraw/zinc/81/52/13/1409815213.db2.gz NSOXOUJVTOZGIK-LBPRGKRZSA-N 0 0 390.358 3.423 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCOC[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000071042615 1409815517 /nfs/dbraw/zinc/81/55/17/1409815517.db2.gz AIFKHXNIGHWJHJ-HNNXBMFYSA-N 0 0 382.482 3.110 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)o1 ZINC000176720100 1428432424 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XYTKFICWWRPWOH-UHFFFAOYSA-N 0 0 388.355 3.497 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)o1 ZINC000176720115 1428433208 /nfs/dbraw/zinc/43/32/08/1428433208.db2.gz DHVVJNOZKYFTEJ-ORAYPTAESA-N 0 0 375.425 3.381 20 5 GGBDRN NC(=O)c1ccc(CNc2cc3c(cc2Cl)OCCCO3)c([N+](=O)[O-])c1 ZINC000071848287 1409827229 /nfs/dbraw/zinc/82/72/29/1409827229.db2.gz BOTFQWLGCARNRR-UHFFFAOYSA-N 0 0 377.784 3.121 20 5 GGBDRN CCOc1ccc(-c2noc(CNc3cc([N+](=O)[O-])ccc3NCCO)n2)cc1 ZINC000071872286 1409828469 /nfs/dbraw/zinc/82/84/69/1409828469.db2.gz BUYVTABPAWAGRU-UHFFFAOYSA-N 0 0 399.407 3.060 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(CCOc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000071906187 1409829718 /nfs/dbraw/zinc/82/97/18/1409829718.db2.gz AHLQQZBYRUCGGQ-UHFFFAOYSA-N 0 0 383.448 3.130 20 5 GGBDRN O=C(NC[C@@H](O)c1ccc(F)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000071942905 1409832056 /nfs/dbraw/zinc/83/20/56/1409832056.db2.gz UVPGAHZZBWUVFV-CYBMUJFWSA-N 0 0 385.298 3.190 20 5 GGBDRN CCOc1cc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])ccc1OC(F)F ZINC000071968292 1409834022 /nfs/dbraw/zinc/83/40/22/1409834022.db2.gz KMMITYXYBJRBOD-UHFFFAOYSA-N 0 0 381.335 3.306 20 5 GGBDRN Cc1c(OCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)cccc1[N+](=O)[O-] ZINC000071963138 1409834087 /nfs/dbraw/zinc/83/40/87/1409834087.db2.gz MXXRWHCHNFZYFU-UHFFFAOYSA-N 0 0 387.436 3.077 20 5 GGBDRN Cc1ccc([C@H](CNc2nc3ccccn3c2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000071968864 1409834315 /nfs/dbraw/zinc/83/43/15/1409834315.db2.gz PNBUKBSKRIWQCF-KRWDZBQOSA-N 0 0 381.436 3.036 20 5 GGBDRN Cc1cccc(OC[C@H](O)CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000176721829 1428433990 /nfs/dbraw/zinc/43/39/90/1428433990.db2.gz JBMMVFANWNEZSB-DOTOQJQBSA-N 0 0 387.436 3.012 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000072051649 1409841976 /nfs/dbraw/zinc/84/19/76/1409841976.db2.gz ZRHFLSNGEFECCB-QGZVFWFLSA-N 0 0 375.469 3.072 20 5 GGBDRN COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)c2[nH]nc(C)c2[N+](=O)[O-])cc1 ZINC000072061695 1409843452 /nfs/dbraw/zinc/84/34/52/1409843452.db2.gz ZLCKICRUZHXPBM-KRWDZBQOSA-N 0 0 398.394 3.488 20 5 GGBDRN CC(C)[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCCC1=O ZINC000072068451 1409844705 /nfs/dbraw/zinc/84/47/05/1409844705.db2.gz WABILWTXFPTHCZ-MRXNPFEDSA-N 0 0 388.449 3.304 20 5 GGBDRN CC(C)COC(=O)N1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000072072363 1409845077 /nfs/dbraw/zinc/84/50/77/1409845077.db2.gz XTDLSAOYRMSEKP-UHFFFAOYSA-N 0 0 383.832 3.189 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCN(Cc2cccc(O)c2)CC1 ZINC000072074998 1409845829 /nfs/dbraw/zinc/84/58/29/1409845829.db2.gz VMLSECBEDICGET-UHFFFAOYSA-N 0 0 390.827 3.304 20 5 GGBDRN CN(C)CCN(c1ccccc1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000072074355 1409846084 /nfs/dbraw/zinc/84/60/84/1409846084.db2.gz VXYDNRSIIVCRNG-UHFFFAOYSA-N 0 0 383.857 3.005 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000072078501 1409846246 /nfs/dbraw/zinc/84/62/46/1409846246.db2.gz MBMCSNHEWQOGRB-OAHLLOKOSA-N 0 0 386.383 3.079 20 5 GGBDRN Cc1n[nH]c(C(=O)NCc2ccc(OC(C)C)cc2C(F)(F)F)c1[N+](=O)[O-] ZINC000072083478 1409847138 /nfs/dbraw/zinc/84/71/38/1409847138.db2.gz ISPZOSIGRKKNLC-UHFFFAOYSA-N 0 0 386.330 3.362 20 5 GGBDRN CC(C)N(Cc1ccccc1)C(=O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000072085991 1409847395 /nfs/dbraw/zinc/84/73/95/1409847395.db2.gz QPHDZELVYNPAHI-UHFFFAOYSA-N 0 0 379.420 3.291 20 5 GGBDRN COc1cccc(OS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000072097433 1409848735 /nfs/dbraw/zinc/84/87/35/1409848735.db2.gz JJBQRAXOEPLPIT-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1C ZINC000072104879 1409849029 /nfs/dbraw/zinc/84/90/29/1409849029.db2.gz ZVCFEIAZGXMAHE-KRWDZBQOSA-N 0 0 387.461 3.393 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CCO1 ZINC000073913469 1409867217 /nfs/dbraw/zinc/86/72/17/1409867217.db2.gz NKDRTAJDYPJEOE-YQQAZPJKSA-N 0 0 375.469 3.328 20 5 GGBDRN CCO[C@H](CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(C)C ZINC000074293664 1409871153 /nfs/dbraw/zinc/87/11/53/1409871153.db2.gz GSZCVHGTQXGYQV-LJQANCHMSA-N 0 0 377.485 3.379 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000176726889 1428436925 /nfs/dbraw/zinc/43/69/25/1428436925.db2.gz STNAOBXOQKMDFD-JKSUJKDBSA-N 0 0 390.484 3.302 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000176726917 1428436953 /nfs/dbraw/zinc/43/69/53/1428436953.db2.gz STNAOBXOQKMDFD-HZPDHXFCSA-N 0 0 390.484 3.302 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCOC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000176725735 1428437151 /nfs/dbraw/zinc/43/71/51/1428437151.db2.gz GTKDZQZAPKYNGX-UHFFFAOYSA-N 0 0 388.873 3.280 20 5 GGBDRN Cc1cncc(NC(=O)c2cc([N+](=O)[O-])ccc2I)c1 ZINC000176728432 1428437866 /nfs/dbraw/zinc/43/78/66/1428437866.db2.gz ZKPICFIZFDRYHS-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C[C@@H]3CCCO3)cc2[N+](=O)[O-])C1 ZINC000076967462 1409892373 /nfs/dbraw/zinc/89/23/73/1409892373.db2.gz WTMKFSFVUYCDTR-INMHGKMJSA-N 0 0 375.469 3.328 20 5 GGBDRN Cc1c(NC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)cccc1[N+](=O)[O-] ZINC000078072739 1409907771 /nfs/dbraw/zinc/90/77/71/1409907771.db2.gz IYCYVLQWDUJWOW-OAHLLOKOSA-N 0 0 376.457 3.309 20 5 GGBDRN CCCCNC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000176733965 1428441754 /nfs/dbraw/zinc/44/17/54/1428441754.db2.gz RRTIKOBHNSCNAM-WBVHZDCISA-N 0 0 390.484 3.302 20 5 GGBDRN COCCCOc1cccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000176736033 1428441786 /nfs/dbraw/zinc/44/17/86/1428441786.db2.gz RSTRXGOOBDSNOP-UHFFFAOYSA-N 0 0 396.403 3.448 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(OCC(F)(F)C(F)F)nc1 ZINC000078505944 1409921778 /nfs/dbraw/zinc/92/17/78/1409921778.db2.gz DMWQWODKOJCXJA-UHFFFAOYSA-N 0 0 387.289 3.450 20 5 GGBDRN CC(=O)Nc1cccc(OCCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000078506024 1409921810 /nfs/dbraw/zinc/92/18/10/1409921810.db2.gz WOUJTPOCFKBEPT-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN Cc1cccc2sc(NC(=O)[C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)nc21 ZINC000078532067 1409923840 /nfs/dbraw/zinc/92/38/40/1409923840.db2.gz AVEKNBICKWTFQU-LLVKDONJSA-N 0 0 384.417 3.270 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc(C(=O)OCc2ccccc2)c1 ZINC000078557348 1409925805 /nfs/dbraw/zinc/92/58/05/1409925805.db2.gz LQENWWMZTYWNEL-UHFFFAOYSA-N 0 0 394.387 3.095 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000078608249 1409929244 /nfs/dbraw/zinc/92/92/44/1409929244.db2.gz FPEZIZQPVYIKRB-UHFFFAOYSA-N 0 0 384.436 3.243 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2csc(-c3ccoc3)n2)C1=O ZINC000078665330 1409932238 /nfs/dbraw/zinc/93/22/38/1409932238.db2.gz QAXUERJQMUCUAK-SFHVURJKSA-N 0 0 398.400 3.279 20 5 GGBDRN COc1ccc(C(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000078663892 1409932317 /nfs/dbraw/zinc/93/23/17/1409932317.db2.gz FGNDKFNXKIFUCC-CQSZACIVSA-N 0 0 384.310 3.086 20 5 GGBDRN CCC[C@]1(C)CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1 ZINC000078690579 1409933404 /nfs/dbraw/zinc/93/34/04/1409933404.db2.gz QAGGXDBRYXXXAV-HXUWFJFHSA-N 0 0 375.469 3.474 20 5 GGBDRN Cc1cc(NC(=O)CCNc2ccccc2[N+](=O)[O-])ccc1C(=O)NC(C)C ZINC000078717530 1409934104 /nfs/dbraw/zinc/93/41/04/1409934104.db2.gz LPXPRGLEOYZVAC-UHFFFAOYSA-N 0 0 384.436 3.482 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCO[C@H](c3nccs3)C2)cc1[N+](=O)[O-] ZINC000176738089 1428442613 /nfs/dbraw/zinc/44/26/13/1428442613.db2.gz JOYHPMQWYCJTNH-WFASDCNBSA-N 0 0 376.438 3.204 20 5 GGBDRN CCCCC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)OC ZINC000176747171 1428446664 /nfs/dbraw/zinc/44/66/64/1428446664.db2.gz LBDGLFDYLFSGMY-ZDUSSCGKSA-N 0 0 387.230 3.209 20 5 GGBDRN CCc1ccccc1NC(=O)CN(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000079323509 1409968728 /nfs/dbraw/zinc/96/87/28/1409968728.db2.gz PQANZZVAWYCCMG-UHFFFAOYSA-N 0 0 398.463 3.446 20 5 GGBDRN O=C(Cn1cnc2ccc([N+](=O)[O-])cc2c1=O)Nc1ccc(Cl)cc1Cl ZINC000079368221 1409973270 /nfs/dbraw/zinc/97/32/70/1409973270.db2.gz HJBSHJNEXJMQCZ-UHFFFAOYSA-N 0 0 393.186 3.250 20 5 GGBDRN Cc1occc1-c1nnc(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)o1 ZINC000079438879 1409976403 /nfs/dbraw/zinc/97/64/03/1409976403.db2.gz OAGLWCSXJGPBLW-UHFFFAOYSA-N 0 0 378.341 3.416 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@@H](C)c3nc[nH]n3)cc2[N+](=O)[O-])n1 ZINC000176744669 1428445684 /nfs/dbraw/zinc/44/56/84/1428445684.db2.gz ATSMNGITDUGJDL-VIFPVBQESA-N 0 0 390.450 3.120 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000079631352 1409984600 /nfs/dbraw/zinc/98/46/00/1409984600.db2.gz QKMWUZKLTSAHKQ-CABCVRRESA-N 0 0 375.469 3.231 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N(C)C[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-] ZINC000176746655 1428446630 /nfs/dbraw/zinc/44/66/30/1428446630.db2.gz APUOOJDDEHHCNW-ZBFHGGJFSA-N 0 0 385.420 3.446 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN([C@@H](C)c3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000176748848 1428447188 /nfs/dbraw/zinc/44/71/88/1428447188.db2.gz 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Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000097589929 1410381240 /nfs/dbraw/zinc/38/12/40/1410381240.db2.gz GJRRMBLREZIYTI-HKMNZKMDSA-N 0 0 397.456 3.457 20 5 GGBDRN CCN(CC(=O)Nc1ccccc1OC)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000098065633 1410404287 /nfs/dbraw/zinc/40/42/87/1410404287.db2.gz NVMBNTFPRIUGNQ-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N(CCO)Cc1ccccc1 ZINC000098074809 1410406720 /nfs/dbraw/zinc/40/67/20/1410406720.db2.gz UMKSADATSWQBCJ-UHFFFAOYSA-N 0 0 383.448 3.220 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000098080881 1410410137 /nfs/dbraw/zinc/41/01/37/1410410137.db2.gz NGRLGEVGDKWZKA-UHFFFAOYSA-N 0 0 387.436 3.340 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000098080905 1410410240 /nfs/dbraw/zinc/41/02/40/1410410240.db2.gz BORCBHPWHPNLCR-CQSZACIVSA-N 0 0 394.435 3.075 20 5 GGBDRN Cc1nn(C)c(C(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)c1[N+](=O)[O-] ZINC000098097924 1410413451 /nfs/dbraw/zinc/41/34/51/1410413451.db2.gz YDKNOZINGZBVKF-UHFFFAOYSA-N 0 0 382.342 3.460 20 5 GGBDRN COc1ccc(N(Cc2ccccc2)C(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1 ZINC000098100832 1410415856 /nfs/dbraw/zinc/41/58/56/1410415856.db2.gz RLZHNTHSVVOUQH-UHFFFAOYSA-N 0 0 380.404 3.492 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCC(c3c(C)[nH]c4ccccc43)CC2)c1[N+](=O)[O-] ZINC000098100556 1410416067 /nfs/dbraw/zinc/41/60/67/1410416067.db2.gz NHXJBMMUWWRITM-UHFFFAOYSA-N 0 0 381.436 3.446 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)c1[N+](=O)[O-] ZINC000098102461 1410417303 /nfs/dbraw/zinc/41/73/03/1410417303.db2.gz WMBRGALHIFKZEW-GFCCVEGCSA-N 0 0 394.815 3.100 20 5 GGBDRN COc1ccc([C@H](NC(=O)c2c([N+](=O)[O-])c(C)nn2C)c2ccc(F)cc2)cc1 ZINC000098102874 1410418547 /nfs/dbraw/zinc/41/85/47/1410418547.db2.gz KQLBDFFGTBWTME-QGZVFWFLSA-N 0 0 398.394 3.304 20 5 GGBDRN CN(c1ccccc1)C1CCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000176819906 1428482512 /nfs/dbraw/zinc/48/25/12/1428482512.db2.gz JMSWDOFTBZHQDQ-UHFFFAOYSA-N 0 0 392.463 3.412 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)c1cccc(NC(=O)CCn2ccnc2)c1 ZINC000098104911 1410419243 /nfs/dbraw/zinc/41/92/43/1410419243.db2.gz VUYYEJQVOYFJBO-UHFFFAOYSA-N 0 0 394.387 3.348 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(-c3cn4c(n3)CCCC4)cc2)c1[N+](=O)[O-] ZINC000098105386 1410419376 /nfs/dbraw/zinc/41/93/76/1410419376.db2.gz DVYWHGIAZADNFQ-UHFFFAOYSA-N 0 0 380.408 3.089 20 5 GGBDRN Cc1ccc(CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)C(C)C)s1 ZINC000098115388 1410424624 /nfs/dbraw/zinc/42/46/24/1410424624.db2.gz ALJWIKQFHUFDFV-UHFFFAOYSA-N 0 0 389.433 3.310 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000176820222 1428483105 /nfs/dbraw/zinc/48/31/05/1428483105.db2.gz VEDNXXYDWUDVTB-GFCCVEGCSA-N 0 0 382.376 3.068 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000176820209 1428483168 /nfs/dbraw/zinc/48/31/68/1428483168.db2.gz VEDNXXYDWUDVTB-LBPRGKRZSA-N 0 0 382.376 3.068 20 5 GGBDRN CC(=O)N1CCN(c2ccc(C(=O)Oc3cccc(C)c3C)cc2[N+](=O)[O-])CC1 ZINC000098144241 1410433747 /nfs/dbraw/zinc/43/37/47/1410433747.db2.gz HHGRJUXULBKSNE-UHFFFAOYSA-N 0 0 397.431 3.099 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000101515865 1410442312 /nfs/dbraw/zinc/44/23/12/1410442312.db2.gz VKTYUSDAWYPORC-MRXNPFEDSA-N 0 0 391.468 3.152 20 5 GGBDRN Nc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccncc3)c2)cc1[N+](=O)[O-] ZINC000101518909 1410444986 /nfs/dbraw/zinc/44/49/86/1410444986.db2.gz VLBHLKVQUZCONB-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN Cc1ccc(C(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000101532763 1410451839 /nfs/dbraw/zinc/45/18/39/1410451839.db2.gz HPARUKWGJYUWOH-UHFFFAOYSA-N 0 0 383.404 3.250 20 5 GGBDRN O=C(CC1CCCCC1)N1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000101537776 1410453966 /nfs/dbraw/zinc/45/39/66/1410453966.db2.gz JGEMOJBLZOFEAS-UHFFFAOYSA-N 0 0 385.468 3.017 20 5 GGBDRN CC(C)COC[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000101539880 1410454866 /nfs/dbraw/zinc/45/48/66/1410454866.db2.gz IQFPUOBZJFTPDN-HNNXBMFYSA-N 0 0 382.438 3.417 20 5 GGBDRN CNC(=O)c1ccc(NCCc2ccc(OC)c(OC(F)F)c2)c([N+](=O)[O-])c1 ZINC000101539949 1410455388 /nfs/dbraw/zinc/45/53/88/1410455388.db2.gz MVOZZYCYXLVPFI-UHFFFAOYSA-N 0 0 395.362 3.219 20 5 GGBDRN O=c1ccc(-c2ccc3c(c2)OCCCO3)nn1Cc1ccc([N+](=O)[O-])cc1 ZINC000101541193 1410456315 /nfs/dbraw/zinc/45/63/15/1410456315.db2.gz YRVQEXVTOJNHOZ-UHFFFAOYSA-N 0 0 379.372 3.028 20 5 GGBDRN COc1ccc(CN2CCN(C(=O)CC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000101555855 1410462790 /nfs/dbraw/zinc/46/27/90/1410462790.db2.gz HXPSVVATFHSICI-UHFFFAOYSA-N 0 0 375.469 3.218 20 5 GGBDRN O=C(CN1CCC(Nc2ccc(F)cc2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000101561329 1410464897 /nfs/dbraw/zinc/46/48/97/1410464897.db2.gz OOFWFMGHWPGZEX-UHFFFAOYSA-N 0 0 398.438 3.200 20 5 GGBDRN COc1ccc(CCCN(C)S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000101573773 1410469786 /nfs/dbraw/zinc/46/97/86/1410469786.db2.gz DQONMXNVUQZGQV-UHFFFAOYSA-N 0 0 378.450 3.165 20 5 GGBDRN CC(C)COC[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000101576933 1410471124 /nfs/dbraw/zinc/47/11/24/1410471124.db2.gz QDBLOKLPIVXWJN-INIZCTEOSA-N 0 0 382.438 3.021 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](COCC(C)C)c2ccco2)cc1[N+](=O)[O-] ZINC000101576992 1410471138 /nfs/dbraw/zinc/47/11/38/1410471138.db2.gz CVSIQOMDUUDQDY-OAHLLOKOSA-N 0 0 382.438 3.188 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)Oc2ccc3c(c2)CCCC3=O)cc1C ZINC000101576542 1410471152 /nfs/dbraw/zinc/47/11/52/1410471152.db2.gz IHNWUTBSEDVYJX-UHFFFAOYSA-N 0 0 375.402 3.498 20 5 GGBDRN CCN(Cc1c(F)cccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000101580091 1410472264 /nfs/dbraw/zinc/47/22/64/1410472264.db2.gz RPKRVLYECLFPEF-UHFFFAOYSA-N 0 0 386.376 3.092 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 ZINC000101602115 1410475323 /nfs/dbraw/zinc/47/53/23/1410475323.db2.gz UKZQDMJHZDPOAR-UHFFFAOYSA-N 0 0 393.403 3.066 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000101682679 1410490128 /nfs/dbraw/zinc/49/01/28/1410490128.db2.gz QPCGBMYTFFKWQG-UHFFFAOYSA-N 0 0 383.448 3.081 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@H](c2ccco2)C1 ZINC000176828582 1428489329 /nfs/dbraw/zinc/48/93/29/1428489329.db2.gz LWVDPVYMIIUMLA-INIZCTEOSA-N 0 0 380.784 3.210 20 5 GGBDRN O=C(Nc1cccc(C(F)(F)F)n1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000101823887 1410506585 /nfs/dbraw/zinc/50/65/85/1410506585.db2.gz JBIUAOOWRHDSIT-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC(n2ccnc2)CC1 ZINC000101866396 1410510952 /nfs/dbraw/zinc/51/09/52/1410510952.db2.gz QZZLAFZSAOHMGO-LBPRGKRZSA-N 0 0 378.816 3.076 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000101905715 1410516118 /nfs/dbraw/zinc/51/61/18/1410516118.db2.gz CIVWLSBYGZZHKQ-CYBMUJFWSA-N 0 0 392.481 3.458 20 5 GGBDRN Cc1ccc(-n2cc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)nn2)cc1 ZINC000101949947 1410530658 /nfs/dbraw/zinc/53/06/58/1410530658.db2.gz ZWVCCNYFNUGBCC-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN COc1ccc2c(c1)C[C@@H](C(=O)Nc1cc(-c3cccc([N+](=O)[O-])c3)[nH]n1)CO2 ZINC000101950042 1410530883 /nfs/dbraw/zinc/53/08/83/1410530883.db2.gz FFVMTTVXDYZOFX-CQSZACIVSA-N 0 0 394.387 3.183 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cnc(-c2ncccn2)s1 ZINC000101949817 1410531232 /nfs/dbraw/zinc/53/12/32/1410531232.db2.gz TYIZURGLXMOTLY-UHFFFAOYSA-N 0 0 393.388 3.151 20 5 GGBDRN CC(C)(C)OCc1cccc(CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000102113579 1410565808 /nfs/dbraw/zinc/56/58/08/1410565808.db2.gz OMHKUBDQBMELPQ-UHFFFAOYSA-N 0 0 385.420 3.165 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)OCCOc1c(Cl)cc(Cl)cc1Cl ZINC000102139057 1410568873 /nfs/dbraw/zinc/56/88/73/1410568873.db2.gz GSFCHLTVSICBRM-UHFFFAOYSA-N 0 0 394.598 3.374 20 5 GGBDRN CN(Cc1nccn1C)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000102201406 1410577720 /nfs/dbraw/zinc/57/77/20/1410577720.db2.gz RMLSJWYHSIIAGD-UHFFFAOYSA-N 0 0 388.371 3.098 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1csc(-c2ccccn2)n1 ZINC000102202105 1410578012 /nfs/dbraw/zinc/57/80/12/1410578012.db2.gz YXZJCYSJRYXOHO-UHFFFAOYSA-N 0 0 380.227 3.429 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)NC1(c2ccccc2)CCC1 ZINC000102201857 1410578081 /nfs/dbraw/zinc/57/80/81/1410578081.db2.gz JCERXWGIPFFAIE-UHFFFAOYSA-N 0 0 393.241 3.058 20 5 GGBDRN CC(=O)c1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000102210402 1410578940 /nfs/dbraw/zinc/57/89/40/1410578940.db2.gz YMDAWJQMYJYUTC-IBGZPJMESA-N 0 0 395.415 3.349 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000102214338 1410580052 /nfs/dbraw/zinc/58/00/52/1410580052.db2.gz GVVUSRHSXDJDLL-GOSISDBHSA-N 0 0 397.431 3.464 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1[N+](=O)[O-] ZINC000102220415 1410581488 /nfs/dbraw/zinc/58/14/88/1410581488.db2.gz FXCWVACAFJSBTB-KRWDZBQOSA-N 0 0 398.375 3.055 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cc(F)cc(F)c2)ccc1[N+](=O)[O-] ZINC000102222612 1410582273 /nfs/dbraw/zinc/58/22/73/1410582273.db2.gz SZDKDZNNXUTRLB-KRWDZBQOSA-N 0 0 389.358 3.425 20 5 GGBDRN Cc1nn(CCC(=O)N(Cc2ccccc2)c2ccccn2)c(C)c1[N+](=O)[O-] ZINC000102223415 1410582460 /nfs/dbraw/zinc/58/24/60/1410582460.db2.gz ZVCVUCZXPXRADO-UHFFFAOYSA-N 0 0 379.420 3.427 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cccc3c[nH]nc32)ccc1[N+](=O)[O-] ZINC000102224462 1410582993 /nfs/dbraw/zinc/58/29/93/1410582993.db2.gz QHHZHQBRGKKWHI-KRWDZBQOSA-N 0 0 393.403 3.023 20 5 GGBDRN COc1ccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1OC1CCCC1 ZINC000102225844 1410583384 /nfs/dbraw/zinc/58/33/84/1410583384.db2.gz RCIRIQIQGRHKEK-UHFFFAOYSA-N 0 0 388.424 3.495 20 5 GGBDRN COc1cc([C@H](C)NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)ccc1OC(C)C ZINC000102228874 1410584346 /nfs/dbraw/zinc/58/43/46/1410584346.db2.gz HDFFJIFHRYPNOP-ZDUSSCGKSA-N 0 0 390.440 3.200 20 5 GGBDRN COc1ccccc1-c1csc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)n1 ZINC000102229640 1410584402 /nfs/dbraw/zinc/58/44/02/1410584402.db2.gz ZCAPKJJDYCYMPT-UHFFFAOYSA-N 0 0 387.421 3.297 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)c1oc2ccccc2c1CS(C)(=O)=O ZINC000102232037 1410585043 /nfs/dbraw/zinc/58/50/43/1410585043.db2.gz PNOYJUXBMUNVKM-UHFFFAOYSA-N 0 0 389.385 3.413 20 5 GGBDRN CCCOc1ccc([C@H](C)NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1OC ZINC000102231335 1410585356 /nfs/dbraw/zinc/58/53/56/1410585356.db2.gz QCLMGEUXUIIKHP-ZDUSSCGKSA-N 0 0 390.440 3.201 20 5 GGBDRN CCC(=O)Nc1ccc(Cl)c(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1 ZINC000102232401 1410585459 /nfs/dbraw/zinc/58/54/59/1410585459.db2.gz YDWVVBNUMXWSJX-UHFFFAOYSA-N 0 0 379.804 3.167 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N(C)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000102235118 1410586314 /nfs/dbraw/zinc/58/63/14/1410586314.db2.gz CDXQAMAMZHGKPQ-GOSISDBHSA-N 0 0 385.395 3.310 20 5 GGBDRN CCCC(=O)Nc1cccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1C ZINC000102240974 1410587549 /nfs/dbraw/zinc/58/75/49/1410587549.db2.gz 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GGBDRN O=C(CCC(=O)N1CCSc2ccccc21)NCc1cccc([N+](=O)[O-])c1 ZINC000106912054 1411319061 /nfs/dbraw/zinc/31/90/61/1411319061.db2.gz CXUCBRPMOBGDJM-UHFFFAOYSA-N 0 0 385.445 3.130 20 5 GGBDRN Cc1cc(C(=O)Nc2nnc(Cc3ccc(F)cc3)s2)c(N)c([N+](=O)[O-])c1 ZINC000106922611 1411321062 /nfs/dbraw/zinc/32/10/62/1411321062.db2.gz MTBZBJUXQVLECW-UHFFFAOYSA-N 0 0 387.396 3.319 20 5 GGBDRN O=C(c1ccsc1)N1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177018081 1428555981 /nfs/dbraw/zinc/55/59/81/1428555981.db2.gz KAFRUSJBMYOKLA-UHFFFAOYSA-N 0 0 386.433 3.146 20 5 GGBDRN COc1ccc2oc([C@@H](C)NC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)c(C)c2c1 ZINC000106961272 1411328533 /nfs/dbraw/zinc/32/85/33/1411328533.db2.gz DECIZXOCFLXVLR-GFCCVEGCSA-N 0 0 397.387 3.474 20 5 GGBDRN COc1ccc2oc([C@H](C)NC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)c(C)c2c1 ZINC000106961273 1411328801 /nfs/dbraw/zinc/32/88/01/1411328801.db2.gz DECIZXOCFLXVLR-LBPRGKRZSA-N 0 0 397.387 3.474 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCCc2ccc(OCC(C)C)cc2)cc1[N+](=O)[O-] 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1411835423 /nfs/dbraw/zinc/83/54/23/1411835423.db2.gz XROPQOFHOSGMAU-CQSZACIVSA-N 0 0 395.868 3.113 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1c2ccccc2oc1C(=O)c1ccco1 ZINC000110169790 1411835477 /nfs/dbraw/zinc/83/54/77/1411835477.db2.gz GTAPXGPJUFXEFY-UHFFFAOYSA-N 0 0 380.316 3.000 20 5 GGBDRN O=C(NCC1(c2ccccc2)CC1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110188918 1411836184 /nfs/dbraw/zinc/83/61/84/1411836184.db2.gz HYBOITFGDFILQU-HNNXBMFYSA-N 0 0 399.472 3.109 20 5 GGBDRN CN(C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)C1CCCCCC1 ZINC000110187889 1411836237 /nfs/dbraw/zinc/83/62/37/1411836237.db2.gz NFQDPVQBHCZZHF-CQSZACIVSA-N 0 0 379.482 3.442 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110213408 1411837885 /nfs/dbraw/zinc/83/78/85/1411837885.db2.gz NUIMSMWGGXEDMA-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CN(C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc(F)cc1 ZINC000110233632 1411839276 /nfs/dbraw/zinc/83/92/76/1411839276.db2.gz ALUDUBFDCNQCAC-ZDUSSCGKSA-N 0 0 377.397 3.063 20 5 GGBDRN COc1cc(C)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110235061 1411839284 /nfs/dbraw/zinc/83/92/84/1411839284.db2.gz QXJPVOANVNEPNG-CYBMUJFWSA-N 0 0 389.433 3.217 20 5 GGBDRN O=C(NCc1ccc(CN2CCCC2=O)cc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110237232 1411839483 /nfs/dbraw/zinc/83/94/83/1411839483.db2.gz QRMZQGOJDHFDBN-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)c(C)o1 ZINC000110247903 1411840190 /nfs/dbraw/zinc/84/01/90/1411840190.db2.gz UTBVBOXKNFKIDX-UHFFFAOYSA-N 0 0 391.811 3.056 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1c(N2CCCC2)cccc1N1CCCC1 ZINC000110274116 1411841948 /nfs/dbraw/zinc/84/19/48/1411841948.db2.gz YMAQJCQQTLANJC-UHFFFAOYSA-N 0 0 398.467 3.021 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(C)c1 ZINC000110275156 1411842086 /nfs/dbraw/zinc/84/20/86/1411842086.db2.gz ITQVFBMGICNKCK-CQSZACIVSA-N 0 0 389.433 3.217 20 5 GGBDRN CN(CC(=O)Nc1cc(F)cc(F)c1)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110276797 1411842269 /nfs/dbraw/zinc/84/22/69/1411842269.db2.gz KEULHLDYGKOTDT-UHFFFAOYSA-N 0 0 383.738 3.237 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110281583 1411842549 /nfs/dbraw/zinc/84/25/49/1411842549.db2.gz INELRLAABNGJGH-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN Cc1ccc(CN(C)C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)s1 ZINC000110281951 1411842575 /nfs/dbraw/zinc/84/25/75/1411842575.db2.gz ZFAFNDUSKMYTTM-CYBMUJFWSA-N 0 0 393.490 3.289 20 5 GGBDRN C[C@H]1Cc2ccccc2N(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000110299886 1411842978 /nfs/dbraw/zinc/84/29/78/1411842978.db2.gz IZGDYYIVJAUBLV-BBRMVZONSA-N 0 0 399.472 3.486 20 5 GGBDRN COc1cc(OCC(=O)N(CC(C)(C)C)CC(F)(F)F)ccc1[N+](=O)[O-] ZINC000110300367 1411843091 /nfs/dbraw/zinc/84/30/91/1411843091.db2.gz CBSXMNUWBALHLR-UHFFFAOYSA-N 0 0 378.347 3.419 20 5 GGBDRN CC[C@@H](C)CN(C)C(=O)c1ccc(I)c([N+](=O)[O-])c1 ZINC000110328920 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ORVDUDZFLLLWHQ-UHFFFAOYSA-N 0 0 377.404 3.385 20 5 GGBDRN CN(CCn1cccn1)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000110431694 1411850383 /nfs/dbraw/zinc/85/03/83/1411850383.db2.gz BJSPETKYAXBXBR-UHFFFAOYSA-N 0 0 379.420 3.176 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)CCn2cccn2)cc1[N+](=O)[O-])c1ccccn1 ZINC000110431137 1411850435 /nfs/dbraw/zinc/85/04/35/1411850435.db2.gz JNYMYYRLTMGGAS-HNNXBMFYSA-N 0 0 394.435 3.132 20 5 GGBDRN CN(CCn1cccn1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000110429970 1411850459 /nfs/dbraw/zinc/85/04/59/1411850459.db2.gz FVPBYPMDUMCHLC-UHFFFAOYSA-N 0 0 388.371 3.061 20 5 GGBDRN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000110456915 1411851106 /nfs/dbraw/zinc/85/11/06/1411851106.db2.gz KBLPAEDFEQJFQG-TXEJJXNPSA-N 0 0 381.404 3.204 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C1CCCCC1 ZINC000110459809 1411851348 /nfs/dbraw/zinc/85/13/48/1411851348.db2.gz DZXAOWAWWUTTAO-CYBMUJFWSA-N 0 0 381.429 3.391 20 5 GGBDRN 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ZINC000112259164 1412105093 /nfs/dbraw/zinc/10/50/93/1412105093.db2.gz AAPVPMMGRDWMGL-UHFFFAOYSA-N 0 0 376.434 3.099 20 5 GGBDRN Cc1ccc(C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)cc1[N+](=O)[O-] ZINC000112259007 1412105171 /nfs/dbraw/zinc/10/51/71/1412105171.db2.gz SXJJBBOMWBHLAS-UHFFFAOYSA-N 0 0 376.434 3.479 20 5 GGBDRN Cc1ccc2oc(N3CCN(C(=O)c4cc(C)cc([N+](=O)[O-])c4)CC3)nc2c1 ZINC000112264610 1412108756 /nfs/dbraw/zinc/10/87/56/1412108756.db2.gz ZDUIFCJBNPNNFH-UHFFFAOYSA-N 0 0 380.404 3.315 20 5 GGBDRN Cc1ccc2oc(N3CCN(C(=O)c4cc([N+](=O)[O-])ccc4C)CC3)nc2c1 ZINC000112264811 1412109003 /nfs/dbraw/zinc/10/90/03/1412109003.db2.gz JPWKROZDEUQSTQ-UHFFFAOYSA-N 0 0 380.404 3.315 20 5 GGBDRN Cc1ccc2oc(N3CCN(C(=O)c4cccc([N+](=O)[O-])c4C)CC3)nc2c1 ZINC000112263948 1412109554 /nfs/dbraw/zinc/10/95/54/1412109554.db2.gz UWLBKDNDYOQCCL-UHFFFAOYSA-N 0 0 380.404 3.315 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCC[S@@](=O)C(C)(C)C)CC1 ZINC000112299648 1412127181 /nfs/dbraw/zinc/12/71/81/1412127181.db2.gz 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CCc1cc(N2CCC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)ncn1 ZINC000112508098 1412159386 /nfs/dbraw/zinc/15/93/86/1412159386.db2.gz AVGCDBDXBPAPOB-HNNXBMFYSA-N 0 0 384.440 3.046 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N(C)Cc2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000177200621 1428628645 /nfs/dbraw/zinc/62/86/45/1428628645.db2.gz LYFYUSVWKGEDAD-CQSZACIVSA-N 0 0 381.436 3.249 20 5 GGBDRN O=c1cc(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c2cc3c(cc2o1)CCC3 ZINC000112522287 1412161790 /nfs/dbraw/zinc/16/17/90/1412161790.db2.gz OEOZFIUBFUPXIA-UHFFFAOYSA-N 0 0 388.383 3.497 20 5 GGBDRN C[C@H](NC(=O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Cl)cc1 ZINC000112522110 1412161895 /nfs/dbraw/zinc/16/18/95/1412161895.db2.gz ZEEVDDRLVLXOCB-LBPRGKRZSA-N 0 0 385.811 3.384 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCn1cccn1)c1ccccc1 ZINC000112548125 1412166999 /nfs/dbraw/zinc/16/69/99/1412166999.db2.gz RQRVWASVBLSQNM-SFHVURJKSA-N 0 0 399.838 3.414 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccc(C(=O)N2CCC(C)CC2)cn1 ZINC000112553258 1412167707 /nfs/dbraw/zinc/16/77/07/1412167707.db2.gz FTQNNKQQYAHWQM-UHFFFAOYSA-N 0 0 384.436 3.483 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)COc1nc(Cc2ccc(F)cc2)no1 ZINC000112562745 1412168741 /nfs/dbraw/zinc/16/87/41/1412168741.db2.gz QFDAOQCNYGAYQW-UHFFFAOYSA-N 0 0 386.339 3.034 20 5 GGBDRN COc1ccc(OC(=O)c2cc(Cl)nc(N3CCCC3)c2)c([N+](=O)[O-])c1 ZINC000112565170 1412168864 /nfs/dbraw/zinc/16/88/64/1412168864.db2.gz PJCQJIOYLGFKGG-UHFFFAOYSA-N 0 0 377.784 3.471 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1nc(-c2ccc(F)cc2)ns1 ZINC000112594558 1412175798 /nfs/dbraw/zinc/17/57/98/1412175798.db2.gz LYFGGQFNQGUNBK-UHFFFAOYSA-N 0 0 392.343 3.409 20 5 GGBDRN COc1cc(OCC(=O)NC2(c3nc(C)cs3)CCCC2)ccc1[N+](=O)[O-] ZINC000112598037 1412177165 /nfs/dbraw/zinc/17/71/65/1412177165.db2.gz WWDYOMXLSYSDKU-UHFFFAOYSA-N 0 0 391.449 3.333 20 5 GGBDRN Cc1ccc(NC(=O)CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(Cl)c1 ZINC000112656849 1412187563 /nfs/dbraw/zinc/18/75/63/1412187563.db2.gz SWKMCLRSZDAFGW-ZDUSSCGKSA-N 0 0 389.843 3.077 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000112670360 1412188722 /nfs/dbraw/zinc/18/87/22/1412188722.db2.gz RJDJMETWYKRNKI-KRWDZBQOSA-N 0 0 392.459 3.282 20 5 GGBDRN CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000112675444 1412190441 /nfs/dbraw/zinc/19/04/41/1412190441.db2.gz KDVACTCKRRQIDX-GFCCVEGCSA-N 0 0 381.860 3.263 20 5 GGBDRN O=C(Nc1nc(-c2ccc(F)cc2)ns1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000112687329 1412193088 /nfs/dbraw/zinc/19/30/88/1412193088.db2.gz AMCSSKOTIRYKIB-UHFFFAOYSA-N 0 0 384.352 3.381 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(CCO)CCc1ccccc1 ZINC000112726630 1412204017 /nfs/dbraw/zinc/20/40/17/1412204017.db2.gz HZICPOCDQQIJJZ-UHFFFAOYSA-N 0 0 397.456 3.396 20 5 GGBDRN C[C@@H](NC(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000112744630 1412208892 /nfs/dbraw/zinc/20/88/92/1412208892.db2.gz QUMLNJSLODZGEH-HUUCEWRRSA-N 0 0 390.484 3.240 20 5 GGBDRN C[C@H]1CCC[C@H](OCC(=O)OCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)C1 ZINC000112759538 1412213122 /nfs/dbraw/zinc/21/31/22/1412213122.db2.gz UMHQHEVFLBFFRJ-YJBOKZPZSA-N 0 0 391.468 3.345 20 5 GGBDRN Cc1nc2c(s1)[C@H](OC(=O)c1cn(-c3cccc([N+](=O)[O-])c3)nn1)CCC2 ZINC000112767395 1412214428 /nfs/dbraw/zinc/21/44/28/1412214428.db2.gz AINJMNBAVQUKNG-OAHLLOKOSA-N 0 0 385.405 3.175 20 5 GGBDRN O=C1[C@@H](Sc2nccn2Cc2ccccn2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000112772649 1412215569 /nfs/dbraw/zinc/21/55/69/1412215569.db2.gz ZRQMMLVPXUDCLY-KRWDZBQOSA-N 0 0 395.444 3.132 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1ccc(F)cc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000112777340 1412215811 /nfs/dbraw/zinc/21/58/11/1412215811.db2.gz ONRIIJIWXSQOPW-JKSUJKDBSA-N 0 0 387.386 3.325 20 5 GGBDRN O=C([C@@H]1C[C@@H]1c1ccc(F)cc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000112777338 1412216121 /nfs/dbraw/zinc/21/61/21/1412216121.db2.gz ONRIIJIWXSQOPW-HZPDHXFCSA-N 0 0 387.386 3.325 20 5 GGBDRN O=C([C@@H]1C[C@@H]1c1ccc(F)cc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000112791896 1412217992 /nfs/dbraw/zinc/21/79/92/1412217992.db2.gz YJZVERUNPVIKEG-QZTJIDSGSA-N 0 0 387.386 3.325 20 5 GGBDRN O=C(Nc1ccc(Cl)nn1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000112808484 1412220046 /nfs/dbraw/zinc/22/00/46/1412220046.db2.gz CYZVZFPQHAXEML-UHFFFAOYSA-N 0 0 376.678 3.232 20 5 GGBDRN CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000112823449 1412222120 /nfs/dbraw/zinc/22/21/20/1412222120.db2.gz LDDBYNUKBJOADC-IBGZPJMESA-N 0 0 399.838 3.478 20 5 GGBDRN C[C@@H]1CC[C@@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000112836192 1412223268 /nfs/dbraw/zinc/22/32/68/1412223268.db2.gz NYRSARUIAHDVKD-YRGRVCCFSA-N 0 0 389.481 3.429 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC(C)(C)c1ccc(F)cc1Cl ZINC000112841724 1412223831 /nfs/dbraw/zinc/22/38/31/1412223831.db2.gz DJGBRAHTEDFYBU-UHFFFAOYSA-N 0 0 382.823 3.376 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@H](C)N1C(=O)OC(C)(C)C ZINC000112842916 1412224261 /nfs/dbraw/zinc/22/42/61/1412224261.db2.gz CRXNVORRTCVYAJ-RYUDHWBXSA-N 0 0 381.404 3.204 20 5 GGBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)c1nc(-c2ccncc2)cs1 ZINC000112909121 1412236272 /nfs/dbraw/zinc/23/62/72/1412236272.db2.gz YLVFVRFYSRLLQZ-VIFPVBQESA-N 0 0 387.396 3.326 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(CN3CCC[C@H]3COc3ccccc3)n2)c1 ZINC000112959623 1412246615 /nfs/dbraw/zinc/24/66/15/1412246615.db2.gz NDSDMRLKSMFJEE-SFHVURJKSA-N 0 0 379.420 3.354 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)COC[C@H]3CCCO3)n2)cc1[N+](=O)[O-] ZINC000113019132 1412255553 /nfs/dbraw/zinc/25/55/53/1412255553.db2.gz HUTLIUOOIOCNBP-CYBMUJFWSA-N 0 0 377.422 3.161 20 5 GGBDRN Cc1ccc(N(C)C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1Cl ZINC000113070384 1412258379 /nfs/dbraw/zinc/25/83/79/1412258379.db2.gz VMXKDPXWUDXPEO-UHFFFAOYSA-N 0 0 393.852 3.411 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccnn2-c2ccccc2C)ccc1[N+](=O)[O-] ZINC000113137889 1412267560 /nfs/dbraw/zinc/26/75/60/1412267560.db2.gz FVOVOQNPXLNKHJ-UHFFFAOYSA-N 0 0 382.376 3.115 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)cccc1[N+](=O)[O-] ZINC000113191410 1412272884 /nfs/dbraw/zinc/27/28/84/1412272884.db2.gz MHAARTCECGAUNH-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN C[C@]1(c2ccccc2)CCCN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)C1 ZINC000113213100 1412276922 /nfs/dbraw/zinc/27/69/22/1412276922.db2.gz SUUKSOMNUXKDBP-NRFANRHFSA-N 0 0 391.431 3.369 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc2nc(C3CC3)oc2c1 ZINC000177220991 1428638624 /nfs/dbraw/zinc/63/86/24/1428638624.db2.gz UTOCWCIGEGUQJG-UHFFFAOYSA-N 0 0 394.387 3.211 20 5 GGBDRN CNC(=O)c1ccc(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000113320183 1412292050 /nfs/dbraw/zinc/29/20/50/1412292050.db2.gz YXVZUXLLZPDAPY-UHFFFAOYSA-N 0 0 382.445 3.368 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1C[C@@H]1c1ccc(F)cc1F ZINC000113429299 1412305603 /nfs/dbraw/zinc/30/56/03/1412305603.db2.gz 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/nfs/dbraw/zinc/60/57/73/1412605773.db2.gz FIKROMUTMGMBBK-UHFFFAOYSA-N 0 0 379.438 3.192 20 5 GGBDRN CCc1ccc(OCC(=O)c2ccc(CCNC(C)=O)s2)c([N+](=O)[O-])c1 ZINC000115200650 1412606062 /nfs/dbraw/zinc/60/60/62/1412606062.db2.gz HOFAOMGAYPETBI-UHFFFAOYSA-N 0 0 376.434 3.159 20 5 GGBDRN CCc1ccc(OCC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000115200817 1412606106 /nfs/dbraw/zinc/60/61/06/1412606106.db2.gz NIYVQCYEFKIVIF-LJQANCHMSA-N 0 0 388.395 3.275 20 5 GGBDRN CC(C)[C@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000115210815 1412609952 /nfs/dbraw/zinc/60/99/52/1412609952.db2.gz BHJCWOMGCZNZCD-SFHVURJKSA-N 0 0 387.367 3.155 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000177269637 1428663738 /nfs/dbraw/zinc/66/37/38/1428663738.db2.gz FKTWYLYGZSZAGP-UHFFFAOYSA-N 0 0 397.431 3.318 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(OCC(=O)N(C)C)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000115232323 1412615539 /nfs/dbraw/zinc/61/55/39/1412615539.db2.gz FLASDMHLQDLGRO-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(OCC(=O)N(C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000115232213 1412616025 /nfs/dbraw/zinc/61/60/25/1412616025.db2.gz DMXMPHQYFRQHHM-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCSC[C@@H]1c1ccccc1 ZINC000115234654 1412616557 /nfs/dbraw/zinc/61/65/57/1412616557.db2.gz FLEODKGLLOHNHT-GOSISDBHSA-N 0 0 395.444 3.106 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCSC[C@H]1c1ccccc1 ZINC000115235909 1412617879 /nfs/dbraw/zinc/61/78/79/1412617879.db2.gz LUPLQWRAEKLXQY-KRWDZBQOSA-N 0 0 376.409 3.429 20 5 GGBDRN Cc1cccc([C@@H](C)NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1C ZINC000115288297 1412634411 /nfs/dbraw/zinc/63/44/11/1412634411.db2.gz ZHTOLZSZPHTHBR-CYBMUJFWSA-N 0 0 387.461 3.280 20 5 GGBDRN Cc1ccnc(-c2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)n1 ZINC000115312573 1412645227 /nfs/dbraw/zinc/64/52/27/1412645227.db2.gz DSEXGCCLEMIURC-UHFFFAOYSA-N 0 0 384.417 3.469 20 5 GGBDRN C[C@@H]1Oc2ccccc2N(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1=O ZINC000115403272 1412667116 /nfs/dbraw/zinc/66/71/16/1412667116.db2.gz LFRYBHHRTBDACB-JTQLQIEISA-N 0 0 375.768 3.001 20 5 GGBDRN O=C(NCc1nc(-c2cccc(Cl)c2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000115408960 1412668204 /nfs/dbraw/zinc/66/82/04/1412668204.db2.gz RDKZUBDMFKNTCG-UHFFFAOYSA-N 0 0 376.731 3.367 20 5 GGBDRN O=C(NCc1nc(-c2cccc(Cl)c2)no1)c1cc(F)ccc1[N+](=O)[O-] ZINC000115410335 1412669081 /nfs/dbraw/zinc/66/90/81/1412669081.db2.gz BMOXGYBWCVRUON-UHFFFAOYSA-N 0 0 376.731 3.367 20 5 GGBDRN O=C(NCCOC[C@H]1CCCO1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000115431882 1412674371 /nfs/dbraw/zinc/67/43/71/1412674371.db2.gz DAQPPYZXQQRXKK-GOSISDBHSA-N 0 0 399.447 3.132 20 5 GGBDRN CC(C)(C)OC(=O)CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000115463842 1412683680 /nfs/dbraw/zinc/68/36/80/1412683680.db2.gz WONJDHHVDZLAOW-UHFFFAOYSA-N 0 0 385.420 3.278 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCSC[C@@H]1c1ccccc1 ZINC000115475202 1412685495 /nfs/dbraw/zinc/68/54/95/1412685495.db2.gz VLSSNIIZFFSYEX-RDTXWAMCSA-N 0 0 399.472 3.030 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCSC[C@@H]1c1ccccc1 ZINC000115475199 1412685834 /nfs/dbraw/zinc/68/58/34/1412685834.db2.gz VLSSNIIZFFSYEX-KBXCAEBGSA-N 0 0 399.472 3.030 20 5 GGBDRN CCc1[nH]n(C)c2nnc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)c1-2 ZINC000115495325 1412692083 /nfs/dbraw/zinc/69/20/83/1412692083.db2.gz WCZQBBBIOOWNAJ-UHFFFAOYSA-N 0 0 397.420 3.143 20 5 GGBDRN Cc1ccnc(N(C)C[C@@H](O)COc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000115516211 1412700702 /nfs/dbraw/zinc/70/07/02/1412700702.db2.gz JJNUTOBGIOPVLH-GFCCVEGCSA-N 0 0 385.342 3.193 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)CCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000177283620 1428670398 /nfs/dbraw/zinc/67/03/98/1428670398.db2.gz ZRIMRRIXHUQQSB-UHFFFAOYSA-N 0 0 397.475 3.271 20 5 GGBDRN O=C(CN1CCSC[C@@H]1c1ccccc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000115559487 1412710534 /nfs/dbraw/zinc/71/05/34/1412710534.db2.gz RDDVBXMDPZISOP-LJQANCHMSA-N 0 0 383.473 3.274 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000115587469 1412721080 /nfs/dbraw/zinc/72/10/80/1412721080.db2.gz VTMVJOVMGQSIIX-UKRRQHHQSA-N 0 0 376.434 3.170 20 5 GGBDRN CN([C@@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000115588039 1412721929 /nfs/dbraw/zinc/72/19/29/1412721929.db2.gz QZDBAFOLIJVLOL-OAHLLOKOSA-N 0 0 393.440 3.023 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115590755 1412722634 /nfs/dbraw/zinc/72/26/34/1412722634.db2.gz XFDBJMVDUAGFFW-UHFFFAOYSA-N 0 0 394.424 3.343 20 5 GGBDRN CC1CCN(c2ccc(CNC(=O)CCOc3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000115669798 1412754234 /nfs/dbraw/zinc/75/42/34/1412754234.db2.gz XZMNLWLBBAZOLZ-UHFFFAOYSA-N 0 0 398.463 3.311 20 5 GGBDRN Cc1cc(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)c(N)c([N+](=O)[O-])c1 ZINC000115715615 1412771340 /nfs/dbraw/zinc/77/13/40/1412771340.db2.gz NFDCCAWRDLHCRD-UHFFFAOYSA-N 0 0 387.783 3.119 20 5 GGBDRN O=C(Cc1c[nH]c2ccc(F)cc12)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000115712308 1412771912 /nfs/dbraw/zinc/77/19/12/1412771912.db2.gz FQOKOMYFBQTIIC-UHFFFAOYSA-N 0 0 380.339 3.182 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000115721549 1412772719 /nfs/dbraw/zinc/77/27/19/1412772719.db2.gz WKXHIIUNRBTFHB-UKRRQHHQSA-N 0 0 377.400 3.455 20 5 GGBDRN O=C(Nc1ccc2c(c1)C(=O)CCC2)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000177297641 1428676847 /nfs/dbraw/zinc/67/68/47/1428676847.db2.gz NNHGZLSHNVIVDP-UHFFFAOYSA-N 0 0 394.431 3.468 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(C(=O)c3ccc(O)cc3)CC2)c1 ZINC000115872490 1412805642 /nfs/dbraw/zinc/80/56/42/1412805642.db2.gz GSHPNDOJWKIYFY-UHFFFAOYSA-N 0 0 384.388 3.044 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000115878835 1412807490 /nfs/dbraw/zinc/80/74/90/1412807490.db2.gz DOTJAXFXMPMJHT-HNNXBMFYSA-N 0 0 390.827 3.404 20 5 GGBDRN C[C@@H]1CCC[C@H](CCNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000115893200 1412811563 /nfs/dbraw/zinc/81/15/63/1412811563.db2.gz DCVYZZKYIKPAAF-VXGBXAGGSA-N 0 0 399.394 3.467 20 5 GGBDRN CC(C)[C@H]1CCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000115912140 1412814947 /nfs/dbraw/zinc/81/49/47/1412814947.db2.gz SNVRFCXCHLSCSO-MRXNPFEDSA-N 0 0 381.498 3.394 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)O[C@@H](c1ccc(Br)cc1)C1CC1 ZINC000115922292 1412815484 /nfs/dbraw/zinc/81/54/84/1412815484.db2.gz JEHSADHSUCRZOB-OAHLLOKOSA-N 0 0 380.198 3.248 20 5 GGBDRN Cc1sc2nc(CCC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)[nH]c(=O)c2c1C ZINC000115922097 1412815639 /nfs/dbraw/zinc/81/56/39/1412815639.db2.gz BXYHCEFOSGEYGK-UHFFFAOYSA-N 0 0 386.433 3.389 20 5 GGBDRN CCc1ccc(OC(=O)CCn2cnc3c(C)cccc3c2=O)c([N+](=O)[O-])c1 ZINC000115925965 1412816286 /nfs/dbraw/zinc/81/62/86/1412816286.db2.gz QQLPMLWHWLJJSN-UHFFFAOYSA-N 0 0 381.388 3.171 20 5 GGBDRN CCc1ccc(OC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)c([N+](=O)[O-])c1 ZINC000115926579 1412816332 /nfs/dbraw/zinc/81/63/32/1412816332.db2.gz ZRXSUKFPLLMEGW-UHFFFAOYSA-N 0 0 395.415 3.479 20 5 GGBDRN CCc1ccc(OC(=O)CCCc2nc3ccccc3c(=O)[nH]2)c([N+](=O)[O-])c1 ZINC000115927340 1412816359 /nfs/dbraw/zinc/81/63/59/1412816359.db2.gz WLNLCGIHMUXCPG-UHFFFAOYSA-N 0 0 381.388 3.322 20 5 GGBDRN CS(=O)(=O)Cc1nc2ccccc2n1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000115965609 1412818518 /nfs/dbraw/zinc/81/85/18/1412818518.db2.gz JHNCPUVTBYZYFZ-UHFFFAOYSA-N 0 0 379.825 3.191 20 5 GGBDRN C[C@@H](c1ccccc1)N1C(=O)C(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115965497 1412818595 /nfs/dbraw/zinc/81/85/95/1412818595.db2.gz QTPPPPWWDFIMKX-NSHDSACASA-N 0 0 387.779 3.300 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1c2cccc(F)c2CC[C@@H]1C ZINC000177301405 1428678218 /nfs/dbraw/zinc/67/82/18/1428678218.db2.gz NICSYHXZPHAHTA-SGTLLEGYSA-N 0 0 385.395 3.421 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2c3cccc(F)c3CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000177301622 1428678242 /nfs/dbraw/zinc/67/82/42/1428678242.db2.gz KKSGJTKRUDDMFS-BBATYDOGSA-N 0 0 385.395 3.421 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2c3cccc(F)c3CC[C@H]2C)cccc1[N+](=O)[O-] ZINC000177301658 1428678254 /nfs/dbraw/zinc/67/82/54/1428678254.db2.gz KKSGJTKRUDDMFS-ADLMAVQZSA-N 0 0 385.395 3.421 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1c2cccc(F)c2CC[C@H]1C ZINC000177301452 1428678265 /nfs/dbraw/zinc/67/82/65/1428678265.db2.gz NICSYHXZPHAHTA-KZULUSFZSA-N 0 0 385.395 3.421 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1c(F)cccc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000115994483 1412820529 /nfs/dbraw/zinc/82/05/29/1412820529.db2.gz VCKREUSKIMSTGU-HZPDHXFCSA-N 0 0 387.386 3.325 20 5 GGBDRN CC(C)(NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000115998001 1412820804 /nfs/dbraw/zinc/82/08/04/1412820804.db2.gz NTSKLRQWXNGMQR-UHFFFAOYSA-N 0 0 383.404 3.334 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 ZINC000116030187 1412823110 /nfs/dbraw/zinc/82/31/10/1412823110.db2.gz JEUXOWJSDMZUAT-HHHXNRCGSA-N 0 0 392.481 3.176 20 5 GGBDRN CCNC(=O)c1ccc(OC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000116036661 1412824412 /nfs/dbraw/zinc/82/44/12/1412824412.db2.gz KFIBMSWIPMCGCB-UHFFFAOYSA-N 0 0 383.404 3.164 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000116044966 1412824564 /nfs/dbraw/zinc/82/45/64/1412824564.db2.gz GWZOLBCOBIJVFW-HNNXBMFYSA-N 0 0 378.432 3.437 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H]2CCC[C@H](C(=O)NC(C)C)C2)cc1[N+](=O)[O-] ZINC000116051996 1412825080 /nfs/dbraw/zinc/82/50/80/1412825080.db2.gz OANKMKMWACWLDF-GXTWGEPZSA-N 0 0 379.482 3.130 20 5 GGBDRN Cn1cc(-c2nc(C(=O)OCc3cc([N+](=O)[O-])ccc3Cl)cs2)cn1 ZINC000116062320 1412826502 /nfs/dbraw/zinc/82/65/02/1412826502.db2.gz WMLIMTGTUVJZLB-UHFFFAOYSA-N 0 0 378.797 3.462 20 5 GGBDRN O=C(OCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(N2CCNC2=O)cc1 ZINC000116061768 1412826574 /nfs/dbraw/zinc/82/65/74/1412826574.db2.gz GNWBQDDBVOKXBB-UHFFFAOYSA-N 0 0 375.768 3.135 20 5 GGBDRN O=C(OCc1cc([N+](=O)[O-])ccc1Cl)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000116062672 1412826879 /nfs/dbraw/zinc/82/68/79/1412826879.db2.gz PNQKSBUYJJYZCD-UHFFFAOYSA-N 0 0 381.684 3.422 20 5 GGBDRN Cc1cccc2c(=O)n(CC(=O)OCc3cc([N+](=O)[O-])ccc3Cl)cnc12 ZINC000116062806 1412827005 /nfs/dbraw/zinc/82/70/05/1412827005.db2.gz MGSJYPVJEHFUAZ-UHFFFAOYSA-N 0 0 387.779 3.010 20 5 GGBDRN O=C(Cc1csc(N2CCCC2=O)n1)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116062635 1412827040 /nfs/dbraw/zinc/82/70/40/1412827040.db2.gz JIUHYYBQOJMDAH-UHFFFAOYSA-N 0 0 395.824 3.117 20 5 GGBDRN CCN(C[C@H]1CCCO1)C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000116066638 1412827408 /nfs/dbraw/zinc/82/74/08/1412827408.db2.gz JMBHKSRBADJHEP-DOTOQJQBSA-N 0 0 375.469 3.472 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000116086788 1412829837 /nfs/dbraw/zinc/82/98/37/1412829837.db2.gz KHGWYJJTXWSNOP-UHFFFAOYSA-N 0 0 395.246 3.255 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000116093643 1412831037 /nfs/dbraw/zinc/83/10/37/1412831037.db2.gz WPPNLBLHJYMHII-ZWNOBZJWSA-N 0 0 377.303 3.376 20 5 GGBDRN O=C(N[C@@H]1C[C@H]1c1c(F)cccc1F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116097121 1412831729 /nfs/dbraw/zinc/83/17/29/1412831729.db2.gz LGORJCRDZXXXLK-CXAGYDPISA-N 0 0 384.342 3.345 20 5 GGBDRN O=C(N[C@H]1C[C@@H]1c1c(F)cccc1F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116097119 1412831744 /nfs/dbraw/zinc/83/17/44/1412831744.db2.gz LGORJCRDZXXXLK-GUYCJALGSA-N 0 0 384.342 3.345 20 5 GGBDRN CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1 ZINC000116097601 1412831748 /nfs/dbraw/zinc/83/17/48/1412831748.db2.gz QBXORGPOZZPRQI-UHFFFAOYSA-N 0 0 395.412 3.063 20 5 GGBDRN COc1cc(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)c([N+](=O)[O-])cc1OC ZINC000116097804 1412831770 /nfs/dbraw/zinc/83/17/70/1412831770.db2.gz WYEHSCUTTKKBOB-ZANVPECISA-N 0 0 378.331 3.176 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC2(c3nccs3)CCCC2)cc1[N+](=O)[O-] ZINC000116102704 1412832269 /nfs/dbraw/zinc/83/22/69/1412832269.db2.gz VBXIMBMZHUKPHO-UHFFFAOYSA-N 0 0 376.394 3.467 20 5 GGBDRN O=C(NC1CCN(C(=O)Nc2ccccc2)CC1)c1cc(F)ccc1[N+](=O)[O-] ZINC000116103011 1412832322 /nfs/dbraw/zinc/83/23/22/1412832322.db2.gz MTWUKMPRFKTCJB-UHFFFAOYSA-N 0 0 386.383 3.160 20 5 GGBDRN O=C(NC1(c2nccs2)CCCC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116104558 1412832830 /nfs/dbraw/zinc/83/28/30/1412832830.db2.gz PFUJBBVNWQLTSZ-UHFFFAOYSA-N 0 0 383.433 3.436 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2cccc(F)c2)C1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000116108875 1412833192 /nfs/dbraw/zinc/83/31/92/1412833192.db2.gz SFAHRWOYXFPLTA-GFCCVEGCSA-N 0 0 379.338 3.411 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H]1CCCN(c2cccc(F)c2)C1 ZINC000116108949 1412833259 /nfs/dbraw/zinc/83/32/59/1412833259.db2.gz YWNXBKKDUSUMDV-CQSZACIVSA-N 0 0 391.374 3.037 20 5 GGBDRN COc1cc(C(=O)NC(C)(C)c2nccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000116138612 1412835957 /nfs/dbraw/zinc/83/59/57/1412835957.db2.gz TVDZTCJFOPHXAZ-UHFFFAOYSA-N 0 0 387.364 3.326 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000177304990 1428680240 /nfs/dbraw/zinc/68/02/40/1428680240.db2.gz YJDAMYLGGZDHJZ-LUGWNYHVSA-N 0 0 391.405 3.074 20 5 GGBDRN Cc1ccc(CCNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000116208423 1412842799 /nfs/dbraw/zinc/84/27/99/1412842799.db2.gz ZYDSZVXWDPBOQJ-HXUWFJFHSA-N 0 0 395.459 3.175 20 5 GGBDRN COc1ccc(OC)c2c1CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]2O ZINC000116272329 1412847097 /nfs/dbraw/zinc/84/70/97/1412847097.db2.gz DXQDYXZSDSVHFT-HNNXBMFYSA-N 0 0 378.812 3.315 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CN1CCN(Cc2cn3ccccc3n2)CC1 ZINC000116271197 1412847170 /nfs/dbraw/zinc/84/71/70/1412847170.db2.gz KLGUDOVLYFAPJX-UHFFFAOYSA-N 0 0 385.855 3.214 20 5 GGBDRN CC(C)Oc1ccccc1CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000116313181 1412849275 /nfs/dbraw/zinc/84/92/75/1412849275.db2.gz RDRINSWMTIDXAX-UHFFFAOYSA-N 0 0 383.448 3.273 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000116420534 1412857081 /nfs/dbraw/zinc/85/70/81/1412857081.db2.gz WVMLDWLLUDHGJZ-SWLSCSKDSA-N 0 0 377.347 3.237 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000177310016 1428681639 /nfs/dbraw/zinc/68/16/39/1428681639.db2.gz HFGKALZDBFVLSD-PWFNWSNSSA-N 0 0 389.477 3.354 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccco1)Cc1ccc(O)cc1 ZINC000116445486 1412861509 /nfs/dbraw/zinc/86/15/09/1412861509.db2.gz PZLBBYXJYOSRDL-UHFFFAOYSA-N 0 0 384.392 3.017 20 5 GGBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000177310061 1428682207 /nfs/dbraw/zinc/68/22/07/1428682207.db2.gz HFGKALZDBFVLSD-LOKFHWFJSA-N 0 0 389.477 3.354 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1ccc(OC2CCCCC2)nc1 ZINC000116455169 1412862684 /nfs/dbraw/zinc/86/26/84/1412862684.db2.gz CZHYYDWRPOYHQA-UHFFFAOYSA-N 0 0 385.420 3.397 20 5 GGBDRN CC(C)(C)c1ccc([C@H](O)CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000116455213 1412862695 /nfs/dbraw/zinc/86/26/95/1412862695.db2.gz ISYBBZUBMCRLJL-GOSISDBHSA-N 0 0 390.411 3.260 20 5 GGBDRN COC(=O)c1ccc(N2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])[C@@H](C)C2)cc1 ZINC000116460749 1412863859 /nfs/dbraw/zinc/86/38/59/1412863859.db2.gz MWWBFNSWZOSFBM-HNNXBMFYSA-N 0 0 397.431 3.041 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000116460820 1412863928 /nfs/dbraw/zinc/86/39/28/1412863928.db2.gz JSOUUOVYKVMPTH-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000116463757 1412864336 /nfs/dbraw/zinc/86/43/36/1412864336.db2.gz XPTDAFAYHROCNJ-FQEVSTJZSA-N 0 0 399.447 3.420 20 5 GGBDRN CC(C)COC(=O)N1CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000116524869 1412871850 /nfs/dbraw/zinc/87/18/50/1412871850.db2.gz PRLJUNWBRSUYIZ-UHFFFAOYSA-N 0 0 395.481 3.014 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCCN(Cc2ccc(F)cc2)CC1 ZINC000116571345 1412878552 /nfs/dbraw/zinc/87/85/52/1412878552.db2.gz YIQXYLYULMGXOX-UHFFFAOYSA-N 0 0 375.375 3.221 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000116583303 1412882523 /nfs/dbraw/zinc/88/25/23/1412882523.db2.gz NCSIWMSBBJOQAX-XPTSAGLGSA-N 0 0 395.749 3.137 20 5 GGBDRN CN(C)[C@@H](CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000116619277 1412887551 /nfs/dbraw/zinc/88/75/51/1412887551.db2.gz ZDNIGAFBRKOZDH-AWEZNQCLSA-N 0 0 381.816 3.029 20 5 GGBDRN COc1ccccc1CCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116619981 1412888039 /nfs/dbraw/zinc/88/80/39/1412888039.db2.gz KPVLZLAHDCEZDW-UHFFFAOYSA-N 0 0 378.812 3.385 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(-n2cncn2)cc1 ZINC000116624272 1412888250 /nfs/dbraw/zinc/88/82/50/1412888250.db2.gz BRGRWTIQPVANIF-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(-n2ccnc2)nc1 ZINC000116624695 1412888597 /nfs/dbraw/zinc/88/85/97/1412888597.db2.gz SXTXIZXZEUVOJW-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN COc1c(C)cnc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000116636178 1412889467 /nfs/dbraw/zinc/88/94/67/1412889467.db2.gz ZFWRYPQJZWIGCS-UHFFFAOYSA-N 0 0 393.827 3.354 20 5 GGBDRN Cc1ccc(C(N)=O)cc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116635481 1412889601 /nfs/dbraw/zinc/88/96/01/1412889601.db2.gz XKEKRSRHSXWSTC-UHFFFAOYSA-N 0 0 377.784 3.063 20 5 GGBDRN C[C@@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000116645320 1412891271 /nfs/dbraw/zinc/89/12/71/1412891271.db2.gz SYFZRBWDGNLARL-GFCCVEGCSA-N 0 0 391.811 3.161 20 5 GGBDRN Cc1nn(CCC(=O)N(C)Cc2ccccc2N2CCCC2)c(C)c1[N+](=O)[O-] ZINC000116651380 1412891523 /nfs/dbraw/zinc/89/15/23/1412891523.db2.gz ORNKVERIPLNUHK-UHFFFAOYSA-N 0 0 385.468 3.057 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(OCC(C)C)nc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000116650361 1412891722 /nfs/dbraw/zinc/89/17/22/1412891722.db2.gz XYIKCCITHPLOHL-UHFFFAOYSA-N 0 0 396.407 3.166 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(Cc1cc(F)ccc1F)c1ccccc1 ZINC000116658437 1412893061 /nfs/dbraw/zinc/89/30/61/1412893061.db2.gz BBIAVCZHAKRDCG-UHFFFAOYSA-N 0 0 399.353 3.268 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1[N+](=O)[O-] ZINC000116660437 1412893581 /nfs/dbraw/zinc/89/35/81/1412893581.db2.gz FYGNEKCLOALCPA-LBPRGKRZSA-N 0 0 395.337 3.344 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000116659955 1412893606 /nfs/dbraw/zinc/89/36/06/1412893606.db2.gz ONESHXTXDURGII-GFCCVEGCSA-N 0 0 377.347 3.205 20 5 GGBDRN CCNc1ccc(C(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc1[N+](=O)[O-] ZINC000116679222 1412895733 /nfs/dbraw/zinc/89/57/33/1412895733.db2.gz LOYYIXSIYMPQNG-UHFFFAOYSA-N 0 0 391.449 3.132 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000116682707 1412896516 /nfs/dbraw/zinc/89/65/16/1412896516.db2.gz JCQZOSVUOPSSBZ-ACMAXOTASA-N 0 0 388.445 3.142 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000116684089 1412896832 /nfs/dbraw/zinc/89/68/32/1412896832.db2.gz FDIDBLDXFJMNMU-SANMLTNESA-N 0 0 396.852 3.396 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000116684076 1412896997 /nfs/dbraw/zinc/89/69/97/1412896997.db2.gz WAPBBIBJHSOXSA-MHZLTWQESA-N 0 0 398.387 3.020 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)o1 ZINC000116702616 1412899075 /nfs/dbraw/zinc/89/90/75/1412899075.db2.gz XJYSQYUMUAFKNU-HNNXBMFYSA-N 0 0 389.364 3.235 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)o1 ZINC000116706906 1412899406 /nfs/dbraw/zinc/89/94/06/1412899406.db2.gz KTJMDRPSMNAORM-SFHVURJKSA-N 0 0 385.420 3.310 20 5 GGBDRN CCOC(=O)c1oc2ccccc2c1CNC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000116708786 1412899964 /nfs/dbraw/zinc/89/99/64/1412899964.db2.gz FHYNAQGBQCSJCT-UHFFFAOYSA-N 0 0 398.371 3.456 20 5 GGBDRN COc1ccc(C)cc1N1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1=O ZINC000116710251 1412900686 /nfs/dbraw/zinc/90/06/86/1412900686.db2.gz FUAQKLABSOEBOB-LBPRGKRZSA-N 0 0 387.367 3.043 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116847175 1412940915 /nfs/dbraw/zinc/94/09/15/1412940915.db2.gz KOIALBVCPKZPBL-AREMUKBSSA-N 0 0 396.852 3.396 20 5 GGBDRN COCCOC1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000116872662 1412946377 /nfs/dbraw/zinc/94/63/77/1412946377.db2.gz LGQFCWXYBVTAKH-UHFFFAOYSA-N 0 0 384.432 3.458 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000116873364 1412946533 /nfs/dbraw/zinc/94/65/33/1412946533.db2.gz ZMWUZPDDYIANKC-IBGZPJMESA-N 0 0 385.420 3.412 20 5 GGBDRN Cc1ccc(OC2CCN(CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000116883617 1412947986 /nfs/dbraw/zinc/94/79/86/1412947986.db2.gz UDEDYRDCNHRQOV-UHFFFAOYSA-N 0 0 383.448 3.409 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000116903276 1412952448 /nfs/dbraw/zinc/95/24/48/1412952448.db2.gz WSIJCYVQAHWUFQ-UHFFFAOYSA-N 0 0 390.461 3.444 20 5 GGBDRN Cc1cc(Cl)cc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1O ZINC000116979105 1412970612 /nfs/dbraw/zinc/97/06/12/1412970612.db2.gz DMWIBEJGQZXJFN-UHFFFAOYSA-N 0 0 398.202 3.284 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116983702 1412971509 /nfs/dbraw/zinc/97/15/09/1412971509.db2.gz NSJBRITWYFETLB-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cc1)C(C)C ZINC000116981902 1412971603 /nfs/dbraw/zinc/97/16/03/1412971603.db2.gz GSLFFEVLKYTSDW-UHFFFAOYSA-N 0 0 384.436 3.495 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000177327424 1428691010 /nfs/dbraw/zinc/69/10/10/1428691010.db2.gz HKWJLJDDDMTJGC-SNVBAGLBSA-N 0 0 386.330 3.266 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000116986127 1412973433 /nfs/dbraw/zinc/97/34/33/1412973433.db2.gz VDBURAVZVKDXPW-IBGZPJMESA-N 0 0 387.436 3.034 20 5 GGBDRN COCCCCCOC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000116991735 1412974673 /nfs/dbraw/zinc/97/46/73/1412974673.db2.gz RVGAMOWSPQRGDU-UHFFFAOYSA-N 0 0 393.177 3.173 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000117001114 1412975333 /nfs/dbraw/zinc/97/53/33/1412975333.db2.gz LTMURZIQMGPUKX-UHFFFAOYSA-N 0 0 383.404 3.157 20 5 GGBDRN Cc1cc(=O)oc2cc(OCCCn3c(=O)oc4ccc([N+](=O)[O-])cc43)ccc12 ZINC000117108186 1413000406 /nfs/dbraw/zinc/00/04/06/1413000406.db2.gz UJDNKLUKLAPMRY-UHFFFAOYSA-N 0 0 396.355 3.387 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCOc1cc(F)ccc1[N+](=O)[O-] ZINC000117108343 1413000452 /nfs/dbraw/zinc/00/04/52/1413000452.db2.gz SSJPZRDPUXHKOI-UHFFFAOYSA-N 0 0 377.284 3.019 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCSc1nncn1-c1ccccc1 ZINC000117108312 1413000516 /nfs/dbraw/zinc/00/05/16/1413000516.db2.gz DPQHPZZESRTTKN-UHFFFAOYSA-N 0 0 397.416 3.266 20 5 GGBDRN COC(=O)c1ccc(SCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)cc1 ZINC000117109381 1413000559 /nfs/dbraw/zinc/00/05/59/1413000559.db2.gz FCCCNGVCPYXQMB-UHFFFAOYSA-N 0 0 388.401 3.472 20 5 GGBDRN CC(C)(C)c1nnc(SCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[nH]1 ZINC000117109290 1413000613 /nfs/dbraw/zinc/00/06/13/1413000613.db2.gz ZSKFFYUGHDYFMX-UHFFFAOYSA-N 0 0 377.426 3.101 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCOc1nnc(-c2ccccc2)o1 ZINC000117109471 1413000725 /nfs/dbraw/zinc/00/07/25/1413000725.db2.gz WGBOFFYSAWLRTM-UHFFFAOYSA-N 0 0 382.332 3.022 20 5 GGBDRN Cc1c(Cn2nnc([C@H](NC(=O)c3ccccc3)C(C)C)n2)cccc1[N+](=O)[O-] ZINC000117118346 1413002341 /nfs/dbraw/zinc/00/23/41/1413002341.db2.gz UYGKWZWLCCAALB-GOSISDBHSA-N 0 0 394.435 3.065 20 5 GGBDRN CC[C@H]1CCCN(C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)CC1 ZINC000117158874 1413007417 /nfs/dbraw/zinc/00/74/17/1413007417.db2.gz CBUIHYIXUGYZFJ-HNNXBMFYSA-N 0 0 384.436 3.101 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCN(c3ccc(F)cc3C)C2)c1 ZINC000117190506 1413010183 /nfs/dbraw/zinc/01/01/83/1413010183.db2.gz IKTNDNHJZDWPNZ-OAHLLOKOSA-N 0 0 387.411 3.450 20 5 GGBDRN CS[C@@H]1CCC[C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000117224005 1413013324 /nfs/dbraw/zinc/01/33/24/1413013324.db2.gz AQNWUVJWZBWHGK-GXTWGEPZSA-N 0 0 393.465 3.073 20 5 GGBDRN CN(C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1C2CC3CC(C2)CC1C3 ZINC000117237490 1413017628 /nfs/dbraw/zinc/01/76/28/1413017628.db2.gz YYGABGZJHXYPJT-UHFFFAOYSA-N 0 0 381.432 3.333 20 5 GGBDRN CCOc1cc(F)ccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000117239728 1413017935 /nfs/dbraw/zinc/01/79/35/1413017935.db2.gz LKLKPOCZWGULSH-UHFFFAOYSA-N 0 0 395.774 3.155 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N1CCCc2cc(F)ccc21 ZINC000117239769 1413017971 /nfs/dbraw/zinc/01/79/71/1413017971.db2.gz AKGPQLBLLHVBDO-UHFFFAOYSA-N 0 0 391.786 3.097 20 5 GGBDRN CCNc1ccc(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)cc1[N+](=O)[O-] ZINC000117268431 1413021831 /nfs/dbraw/zinc/02/18/31/1413021831.db2.gz NLDSSPDMEOGTMP-OKILXGFUSA-N 0 0 399.451 3.288 20 5 GGBDRN CC(C)(CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)Cc1ccccc1 ZINC000117297246 1413023652 /nfs/dbraw/zinc/02/36/52/1413023652.db2.gz KEXWGZKGZJWPBW-UHFFFAOYSA-N 0 0 379.416 3.435 20 5 GGBDRN COC(=O)N(C)Cc1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000117329678 1413025649 /nfs/dbraw/zinc/02/56/49/1413025649.db2.gz QIFCINPVZJCMMZ-UHFFFAOYSA-N 0 0 397.391 3.455 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CN1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000117326006 1413025749 /nfs/dbraw/zinc/02/57/49/1413025749.db2.gz RKQRARPNOPFQSC-UHFFFAOYSA-N 0 0 399.247 3.277 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(OCc2nnnn2-c2ccc(OC(F)F)cc2)c1 ZINC000177333558 1428695156 /nfs/dbraw/zinc/69/51/56/1428695156.db2.gz BQDPEAPNTQUEKL-UHFFFAOYSA-N 0 0 397.725 3.404 20 5 GGBDRN NC(=O)c1ccc(CN2CCC(C(F)(F)F)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000117352812 1413028664 /nfs/dbraw/zinc/02/86/64/1413028664.db2.gz SWLKOGKOAIHFHA-UHFFFAOYSA-N 0 0 385.264 3.010 20 5 GGBDRN CCCc1noc(CSCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)n1 ZINC000117380465 1413032561 /nfs/dbraw/zinc/03/25/61/1413032561.db2.gz JSIOGLOPSBJFOQ-UHFFFAOYSA-N 0 0 378.410 3.162 20 5 GGBDRN CC(C)CCNC(=O)[C@H](C)SCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117381065 1413032832 /nfs/dbraw/zinc/03/28/32/1413032832.db2.gz NGANLRCCGBLFJM-ZDUSSCGKSA-N 0 0 395.481 3.177 20 5 GGBDRN C[C@@H](SCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C(=O)NC1CCCC1 ZINC000117381108 1413032891 /nfs/dbraw/zinc/03/28/91/1413032891.db2.gz WTBCAQSQARHGQQ-GFCCVEGCSA-N 0 0 393.465 3.073 20 5 GGBDRN CC(C)CCNC(=O)[C@@H](C)SCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117381063 1413033162 /nfs/dbraw/zinc/03/31/62/1413033162.db2.gz NGANLRCCGBLFJM-CYBMUJFWSA-N 0 0 395.481 3.177 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000117426525 1413035215 /nfs/dbraw/zinc/03/52/15/1413035215.db2.gz VXILDKOZDBYYNQ-UHFFFAOYSA-N 0 0 388.268 3.227 20 5 GGBDRN COC(=O)c1c(NC(=O)COc2cccc([N+](=O)[O-])c2C)sc2c1CCC2 ZINC000117463792 1413038762 /nfs/dbraw/zinc/03/87/62/1413038762.db2.gz STGXFQJGXBMWKG-UHFFFAOYSA-N 0 0 390.417 3.258 20 5 GGBDRN COc1cc(F)c(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1F ZINC000177334262 1428696241 /nfs/dbraw/zinc/69/62/41/1428696241.db2.gz ZFUPNKUNDBDSKK-UHFFFAOYSA-N 0 0 392.362 3.236 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(Oc3nccc(C)n3)cc2)c(C)c1[N+](=O)[O-] ZINC000177335635 1428696759 /nfs/dbraw/zinc/69/67/59/1428696759.db2.gz HSKBHNGUJIDHLI-UHFFFAOYSA-N 0 0 396.407 3.328 20 5 GGBDRN CS(=O)(=O)c1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cn1 ZINC000117516425 1413046102 /nfs/dbraw/zinc/04/61/02/1413046102.db2.gz GHMDKBYBDACFBY-UHFFFAOYSA-N 0 0 377.425 3.439 20 5 GGBDRN O=C(NC[C@H]1CCc2ccccc2C1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000117519815 1413046499 /nfs/dbraw/zinc/04/64/99/1413046499.db2.gz NINXUWZJAFESEI-LBPRGKRZSA-N 0 0 387.823 3.108 20 5 GGBDRN CC[C@@H]1CCCN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000117518518 1413046788 /nfs/dbraw/zinc/04/67/88/1413046788.db2.gz AUOSDAFEUHKXOV-LLVKDONJSA-N 0 0 385.367 3.173 20 5 GGBDRN COc1ccc(Cc2noc(-c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)n2)cc1 ZINC000117541353 1413051366 /nfs/dbraw/zinc/05/13/66/1413051366.db2.gz CCDNHYKOYXARPQ-UHFFFAOYSA-N 0 0 378.344 3.086 20 5 GGBDRN O=C(NCc1cccc(NC(=O)c2ccccn2)c1)c1ccc([N+](=O)[O-])s1 ZINC000117563877 1413052885 /nfs/dbraw/zinc/05/28/85/1413052885.db2.gz PMRZMKGNSIMSKH-UHFFFAOYSA-N 0 0 382.401 3.234 20 5 GGBDRN COCCOc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000117608108 1413056172 /nfs/dbraw/zinc/05/61/72/1413056172.db2.gz FGBOAEVTWHITAB-UHFFFAOYSA-N 0 0 378.812 3.132 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(-n2cncn2)c(F)c1 ZINC000117624862 1413057421 /nfs/dbraw/zinc/05/74/21/1413057421.db2.gz IQYUOKAGRJRIIA-UHFFFAOYSA-N 0 0 375.747 3.149 20 5 GGBDRN COc1ccc(OC)c(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000117627416 1413057655 /nfs/dbraw/zinc/05/76/55/1413057655.db2.gz SSWIXGMOBNMQQG-UHFFFAOYSA-N 0 0 378.812 3.167 20 5 GGBDRN COc1ccc(C(=O)N(C)C)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117623203 1413057758 /nfs/dbraw/zinc/05/77/58/1413057758.db2.gz NNNRUZLGCXOYND-UHFFFAOYSA-N 0 0 391.811 3.140 20 5 GGBDRN CC(C)(C)OC(=O)N(CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000117646950 1413060712 /nfs/dbraw/zinc/06/07/12/1413060712.db2.gz VRTLWIBFVAUGHH-UHFFFAOYSA-N 0 0 397.859 3.306 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117654164 1413061045 /nfs/dbraw/zinc/06/10/45/1413061045.db2.gz BKJITVZDKDTPMQ-UHFFFAOYSA-N 0 0 377.828 3.251 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(CC(F)(F)F)c1ccccc1 ZINC000117655308 1413061335 /nfs/dbraw/zinc/06/13/35/1413061335.db2.gz KKOUESBHRJVUMK-UHFFFAOYSA-N 0 0 391.309 3.385 20 5 GGBDRN O=C(Nc1ccc(-c2nc[nH]n2)cc1)c1cc([N+](=O)[O-])ccc1Br ZINC000117661681 1413062385 /nfs/dbraw/zinc/06/23/85/1413062385.db2.gz ANPDQSWENGMOIZ-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN O=C(OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cn(-c2ccccc2)nn1 ZINC000117676877 1413064490 /nfs/dbraw/zinc/06/44/90/1413064490.db2.gz DMPUQQUWALOIOD-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN O=C(Cc1cn2ccccc2n1)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117677449 1413065291 /nfs/dbraw/zinc/06/52/91/1413065291.db2.gz MCCYTIQXKIVOAV-UHFFFAOYSA-N 0 0 378.344 3.183 20 5 GGBDRN CN(C)C(=O)c1ccc(C(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000117677006 1413065416 /nfs/dbraw/zinc/06/54/16/1413065416.db2.gz BPZFSPFQCBCHQD-UHFFFAOYSA-N 0 0 395.371 3.309 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1 ZINC000117707984 1413068460 /nfs/dbraw/zinc/06/84/60/1413068460.db2.gz USYMQGGHPAJGCB-KRWDZBQOSA-N 0 0 383.404 3.155 20 5 GGBDRN CCc1ccc(C(C)(C)CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000177340435 1428698613 /nfs/dbraw/zinc/69/86/13/1428698613.db2.gz SNSWNCYYHSWRST-UHFFFAOYSA-N 0 0 383.448 3.498 20 5 GGBDRN Cc1c(C(=O)Nc2nncn2Cc2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000117734427 1413072788 /nfs/dbraw/zinc/07/27/88/1413072788.db2.gz FSXBZCLQJYVRTO-UHFFFAOYSA-N 0 0 396.363 3.012 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCCc1nccn1Cc1ccccc1 ZINC000117750250 1413074874 /nfs/dbraw/zinc/07/48/74/1413074874.db2.gz MSGCRFFZUOZWCP-UHFFFAOYSA-N 0 0 398.850 3.394 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000117749826 1413074972 /nfs/dbraw/zinc/07/49/72/1413074972.db2.gz URYGDCCUTNHNKD-CQSZACIVSA-N 0 0 399.838 3.240 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000117774627 1413077799 /nfs/dbraw/zinc/07/77/99/1413077799.db2.gz SGYRIRMQXQXUQL-DZGCQCFKSA-N 0 0 395.887 3.334 20 5 GGBDRN CC(C)n1cnnc1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000117794884 1413079611 /nfs/dbraw/zinc/07/96/11/1413079611.db2.gz DZNRBLHABKRMEG-UHFFFAOYSA-N 0 0 391.859 3.369 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCC(=O)OCc1ccccc1Cl ZINC000117805057 1413080352 /nfs/dbraw/zinc/08/03/52/1413080352.db2.gz HREXKCJILMVECM-UHFFFAOYSA-N 0 0 397.214 3.304 20 5 GGBDRN C[C@H](c1cccnc1)N1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000117806436 1413081047 /nfs/dbraw/zinc/08/10/47/1413081047.db2.gz YLBOBJGLHKUBGW-CQSZACIVSA-N 0 0 388.855 3.091 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000117929357 1413090285 /nfs/dbraw/zinc/09/02/85/1413090285.db2.gz ZBIOEZLDBKGIQX-QGZVFWFLSA-N 0 0 389.477 3.495 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000117951776 1413091912 /nfs/dbraw/zinc/09/19/12/1413091912.db2.gz ZMZDHGHIQHZPOA-GFCCVEGCSA-N 0 0 390.469 3.467 20 5 GGBDRN COc1ccc(-c2nnc(CNC(=O)Nc3cc([N+](=O)[O-])ccc3C)[nH]2)cc1 ZINC000118007099 1413095888 /nfs/dbraw/zinc/09/58/88/1413095888.db2.gz PESXZNYSDGPHJI-UHFFFAOYSA-N 0 0 382.380 3.019 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000177349551 1428701354 /nfs/dbraw/zinc/70/13/54/1428701354.db2.gz XOXCGMUAIIICAE-LBPRGKRZSA-N 0 0 395.431 3.499 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccc(-n3ccnc3)c(F)c2)ccc1Cl ZINC000118161394 1413117670 /nfs/dbraw/zinc/11/76/70/1413117670.db2.gz UDDZCMSTLYAOMO-UHFFFAOYSA-N 0 0 396.787 3.374 20 5 GGBDRN O=C(Cc1ccccc1OC(F)F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000118191357 1413121023 /nfs/dbraw/zinc/12/10/23/1413121023.db2.gz XZGSEAQTOJOXOQ-UHFFFAOYSA-N 0 0 391.374 3.088 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Oc2nccc(C)n2)cc1 ZINC000177354861 1428703160 /nfs/dbraw/zinc/70/31/60/1428703160.db2.gz NSFUZSUUJNOYQO-UHFFFAOYSA-N 0 0 382.380 3.019 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cnn(CC(F)(F)F)c1 ZINC000118235723 1413131074 /nfs/dbraw/zinc/13/10/74/1413131074.db2.gz IYUNGLSOWVLAGD-UHFFFAOYSA-N 0 0 392.721 3.415 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000118272540 1413139986 /nfs/dbraw/zinc/13/99/86/1413139986.db2.gz VJGXNNPXRHMAHU-KDOFPFPSSA-N 0 0 386.452 3.352 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000118276183 1413140648 /nfs/dbraw/zinc/14/06/48/1413140648.db2.gz IGLZKZZRMFKGBA-KBXCAEBGSA-N 0 0 386.452 3.352 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCOc2cc(F)ccc21 ZINC000118277651 1413142133 /nfs/dbraw/zinc/14/21/33/1413142133.db2.gz HAGRWPDQPNVBSE-UHFFFAOYSA-N 0 0 385.395 3.376 20 5 GGBDRN CCO[C@@H](CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCC1 ZINC000177361703 1428704536 /nfs/dbraw/zinc/70/45/36/1428704536.db2.gz RZLGATLLVDXIEQ-IBGZPJMESA-N 0 0 386.452 3.496 20 5 GGBDRN Cc1cccc2c(=O)n(CC(=O)Oc3cc([N+](=O)[O-])c(Cl)cc3C)cnc12 ZINC000118295804 1413144584 /nfs/dbraw/zinc/14/45/84/1413144584.db2.gz QHPJAAVSLMLDPZ-UHFFFAOYSA-N 0 0 387.779 3.181 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000118441540 1413161032 /nfs/dbraw/zinc/16/10/32/1413161032.db2.gz IONGOFLTLDAEGO-UHFFFAOYSA-N 0 0 390.732 3.372 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C ZINC000118470049 1413163356 /nfs/dbraw/zinc/16/33/56/1413163356.db2.gz HMWVFCFVJFLATN-SUMWQHHRSA-N 0 0 379.457 3.244 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118469907 1413163466 /nfs/dbraw/zinc/16/34/66/1413163466.db2.gz ZTINFNKJQWRUKV-HNNXBMFYSA-N 0 0 384.219 3.434 20 5 GGBDRN COc1ccc(C(=O)NC[C@@H](O)c2cc(Cl)cc(Cl)c2)cc1[N+](=O)[O-] ZINC000118517924 1413170142 /nfs/dbraw/zinc/17/01/42/1413170142.db2.gz ZXGRLLJTXMGNEH-CQSZACIVSA-N 0 0 385.203 3.374 20 5 GGBDRN Cc1cc(C(=O)NC[C@@H](O)c2cc(Cl)cc(Cl)c2)c(N)c([N+](=O)[O-])c1 ZINC000118519432 1413170590 /nfs/dbraw/zinc/17/05/90/1413170590.db2.gz FPWJDAFIYPIGTN-CQSZACIVSA-N 0 0 384.219 3.256 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000118595692 1413192471 /nfs/dbraw/zinc/19/24/71/1413192471.db2.gz GZMQVCDPBBZVOH-ABAIWWIYSA-N 0 0 397.859 3.144 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000177373133 1428708617 /nfs/dbraw/zinc/70/86/17/1428708617.db2.gz LOLORNFAMMDWOH-NRRJATNASA-N 0 0 375.450 3.235 20 5 GGBDRN CN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(Cl)nn1 ZINC000118613538 1413197460 /nfs/dbraw/zinc/19/74/60/1413197460.db2.gz QCIUUSOHZFIVHJ-UHFFFAOYSA-N 0 0 378.819 3.261 20 5 GGBDRN CCc1nnc(COC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)n1C ZINC000118616459 1413198272 /nfs/dbraw/zinc/19/82/72/1413198272.db2.gz LAFXEWPIAJLYFY-UHFFFAOYSA-N 0 0 382.376 3.435 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)COc1ccc2c(c1)CCC(=O)N2 ZINC000118634702 1413199882 /nfs/dbraw/zinc/19/98/82/1413199882.db2.gz NGKYNGKKDFVCRF-UHFFFAOYSA-N 0 0 389.795 3.459 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)C1CCN(C(=O)N2CCCC2)CC1 ZINC000118634355 1413199934 /nfs/dbraw/zinc/19/99/34/1413199934.db2.gz KYGPOAIJTCRLIX-UHFFFAOYSA-N 0 0 394.859 3.423 20 5 GGBDRN Cn1c(CCCNC(=O)CCNc2ccccc2[N+](=O)[O-])nc2ccccc21 ZINC000118658868 1413201909 /nfs/dbraw/zinc/20/19/09/1413201909.db2.gz XADXKNMXFKDBKB-UHFFFAOYSA-N 0 0 381.436 3.033 20 5 GGBDRN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000118664322 1413203285 /nfs/dbraw/zinc/20/32/85/1413203285.db2.gz KBOPVIFGZAPYBG-DYEKYZERSA-N 0 0 379.844 3.158 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689506 1413204840 /nfs/dbraw/zinc/20/48/40/1413204840.db2.gz AATWXZCQZFEHBA-CYBMUJFWSA-N 0 0 392.868 3.448 20 5 GGBDRN Cc1ccc(C)c(C(=O)CCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689235 1413204855 /nfs/dbraw/zinc/20/48/55/1413204855.db2.gz JZGXCUJUWPEKHR-INIZCTEOSA-N 0 0 396.447 3.283 20 5 GGBDRN CC(C)Oc1ccccc1CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689582 1413204988 /nfs/dbraw/zinc/20/49/88/1413204988.db2.gz FNCOKLAZARWXHC-INIZCTEOSA-N 0 0 384.436 3.033 20 5 GGBDRN O=C(/C=C/c1nc2ccccc2s1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689249 1413205151 /nfs/dbraw/zinc/20/51/51/1413205151.db2.gz IPPLELUZKWAQDQ-SBDDDAINSA-N 0 0 395.444 3.326 20 5 GGBDRN Cc1ccc2c(CC(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c[nH]c2c1 ZINC000118689020 1413205202 /nfs/dbraw/zinc/20/52/02/1413205202.db2.gz WHSYJAGFVSADIZ-OAHLLOKOSA-N 0 0 379.420 3.035 20 5 GGBDRN CC(C)Oc1ccccc1CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689584 1413205207 /nfs/dbraw/zinc/20/52/07/1413205207.db2.gz FNCOKLAZARWXHC-MRXNPFEDSA-N 0 0 384.436 3.033 20 5 GGBDRN Cc1ccc(C)c(C(=O)CCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689237 1413205210 /nfs/dbraw/zinc/20/52/10/1413205210.db2.gz JZGXCUJUWPEKHR-MRXNPFEDSA-N 0 0 396.447 3.283 20 5 GGBDRN CC(C)COc1cccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689143 1413205227 /nfs/dbraw/zinc/20/52/27/1413205227.db2.gz INYFQSQYWQUCJB-INIZCTEOSA-N 0 0 384.436 3.351 20 5 GGBDRN O=C(N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1(c2ccc(Cl)cc2)CC1 ZINC000118690322 1413205510 /nfs/dbraw/zinc/20/55/10/1413205510.db2.gz CZYLUUKQRYPXAF-OAHLLOKOSA-N 0 0 386.839 3.388 20 5 GGBDRN O=C(c1ccc(OC(F)(F)F)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690424 1413205568 /nfs/dbraw/zinc/20/55/68/1413205568.db2.gz AEEBHIRVRYLCCD-GFCCVEGCSA-N 0 0 396.325 3.215 20 5 GGBDRN O=C(Cc1ccc(C(F)(F)F)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689959 1413205577 /nfs/dbraw/zinc/20/55/77/1413205577.db2.gz WPCXBZLJEFMPRF-AWEZNQCLSA-N 0 0 394.353 3.264 20 5 GGBDRN O=C(Cc1ccc(C(F)(F)F)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689961 1413205615 /nfs/dbraw/zinc/20/56/15/1413205615.db2.gz WPCXBZLJEFMPRF-CQSZACIVSA-N 0 0 394.353 3.264 20 5 GGBDRN COc1cc(C2(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)CC2)ccc1C ZINC000118689865 1413205712 /nfs/dbraw/zinc/20/57/12/1413205712.db2.gz SWFCMIMXKOGNSD-MRXNPFEDSA-N 0 0 396.447 3.051 20 5 GGBDRN O=C(c1ccc(-n2cccc2)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690068 1413205722 /nfs/dbraw/zinc/20/57/22/1413205722.db2.gz CNYHOKFGIIISBQ-INIZCTEOSA-N 0 0 377.404 3.107 20 5 GGBDRN O=C(Cc1ccc2c(c1)CCCC2)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690340 1413205755 /nfs/dbraw/zinc/20/57/55/1413205755.db2.gz RKFJULPEDRSEJG-SFHVURJKSA-N 0 0 380.448 3.124 20 5 GGBDRN CCOc1ccc2cc(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)[nH]c2c1 ZINC000118690149 1413205768 /nfs/dbraw/zinc/20/57/68/1413205768.db2.gz YLJKHJOAXQTOHM-CQSZACIVSA-N 0 0 395.419 3.196 20 5 GGBDRN O=C([C@@H]1C[C@@H]1c1cccc(Cl)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690694 1413206209 /nfs/dbraw/zinc/20/62/09/1413206209.db2.gz USHDXJQBAVMXSS-USXIJHARSA-N 0 0 386.839 3.460 20 5 GGBDRN O=C(c1csc(-c2ccccc2)n1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691095 1413206285 /nfs/dbraw/zinc/20/62/85/1413206285.db2.gz BZWCAKIIFUZWDW-AWEZNQCLSA-N 0 0 395.444 3.440 20 5 GGBDRN O=C(c1ccccc1C(F)(F)F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690590 1413206327 /nfs/dbraw/zinc/20/63/27/1413206327.db2.gz LDONTQSOKAFSCN-NSHDSACASA-N 0 0 380.326 3.335 20 5 GGBDRN CCCN(C)c1ccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118690685 1413206436 /nfs/dbraw/zinc/20/64/36/1413206436.db2.gz YIXKGMLKGKXKNR-MRXNPFEDSA-N 0 0 383.452 3.163 20 5 GGBDRN CCCCOc1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118690488 1413206524 /nfs/dbraw/zinc/20/65/24/1413206524.db2.gz DTFGQIGUONYKCU-INIZCTEOSA-N 0 0 384.436 3.495 20 5 GGBDRN O=C(CCSc1ccccc1F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691103 1413206957 /nfs/dbraw/zinc/20/69/57/1413206957.db2.gz LWGFVIYAZGBEDO-CYBMUJFWSA-N 0 0 390.440 3.324 20 5 GGBDRN O=C(NCC1(O)CCCCCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000118698907 1413207541 /nfs/dbraw/zinc/20/75/41/1413207541.db2.gz MHZCAXIDLSCDIW-UHFFFAOYSA-N 0 0 390.358 3.351 20 5 GGBDRN O=C(Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000118701098 1413208039 /nfs/dbraw/zinc/20/80/39/1413208039.db2.gz QITWCQDMZKMPCJ-MSOLQXFVSA-N 0 0 396.403 3.406 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cnn(-c3ccccc3)c2C)cc([N+](=O)[O-])c1 ZINC000118723470 1413209848 /nfs/dbraw/zinc/20/98/48/1413209848.db2.gz RBVPQDLQULWWTR-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2c(C)nn(-c3ccccc3)c2C)cc([N+](=O)[O-])c1 ZINC000118723662 1413209917 /nfs/dbraw/zinc/20/99/17/1413209917.db2.gz POQDFNQCDXNVPF-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccc(-n3nc(C)cc3C)cc2)cc([N+](=O)[O-])c1 ZINC000118723394 1413209965 /nfs/dbraw/zinc/20/99/65/1413209965.db2.gz DXMZLRRBJQHRLM-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cnn(-c3ccc(F)cc3)c2C)cc([N+](=O)[O-])c1 ZINC000118723539 1413209967 /nfs/dbraw/zinc/20/99/67/1413209967.db2.gz XRXBSOZGKCSBCR-UHFFFAOYSA-N 0 0 398.350 3.267 20 5 GGBDRN CCc1nnnn1-c1ccccc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000118742495 1413214735 /nfs/dbraw/zinc/21/47/35/1413214735.db2.gz AQRMXRCTRXVKCG-LBPRGKRZSA-N 0 0 398.448 3.252 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000177380816 1428711321 /nfs/dbraw/zinc/71/13/21/1428711321.db2.gz YGWGICBLDVINOI-NRRJATNASA-N 0 0 375.450 3.235 20 5 GGBDRN O=C(CN1CCC(c2c[nH]c3ncccc23)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000118837410 1413240547 /nfs/dbraw/zinc/24/05/47/1413240547.db2.gz JHXAWRRYABRWAJ-UHFFFAOYSA-N 0 0 379.420 3.289 20 5 GGBDRN CCO[C@@H](CCNC(=O)NCc1cc([N+](=O)[O-])ccc1OC)C1CCCC1 ZINC000177381727 1428712009 /nfs/dbraw/zinc/71/20/09/1428712009.db2.gz BLSPRXYCNHDUNR-SFHVURJKSA-N 0 0 379.457 3.388 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc(Cl)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118867145 1413252963 /nfs/dbraw/zinc/25/29/63/1413252963.db2.gz SBLYYAKTNUXFAR-WFASDCNBSA-N 0 0 389.843 3.157 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](C)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000118866443 1413253619 /nfs/dbraw/zinc/25/36/19/1413253619.db2.gz PWGBAIIQZYDVJG-HOTGVXAUSA-N 0 0 383.452 3.120 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1Cl)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866901 1413254224 /nfs/dbraw/zinc/25/42/24/1413254224.db2.gz HDQWQDGWWOHEPI-STQMWFEESA-N 0 0 389.843 3.157 20 5 GGBDRN CCc1ccc(NC(=O)[C@@H](C)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118867153 1413254307 /nfs/dbraw/zinc/25/43/07/1413254307.db2.gz RHYHVMUZAZWXCO-PBHICJAKSA-N 0 0 383.452 3.066 20 5 GGBDRN Cc1cc(NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)ccc1OCC[NH+]1CCCC1 ZINC000118957628 1413274788 /nfs/dbraw/zinc/27/47/88/1413274788.db2.gz VEPOBMNQAQITND-UHFFFAOYSA-N 0 0 385.420 3.336 20 5 GGBDRN Cc1c(CC(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000119014061 1413304051 /nfs/dbraw/zinc/30/40/51/1413304051.db2.gz IOPGEEPPYSMWCZ-OAHLLOKOSA-N 0 0 391.468 3.209 20 5 GGBDRN C[C@H]1CN(C)c2ccccc2CN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000177393111 1428716706 /nfs/dbraw/zinc/71/67/06/1428716706.db2.gz ZFOKFTBWAUUBBF-AWEZNQCLSA-N 0 0 379.420 3.485 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cnc1Cl ZINC000119038816 1413312849 /nfs/dbraw/zinc/31/28/49/1413312849.db2.gz KEFPOMIXYXPFGA-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000119042442 1413314656 /nfs/dbraw/zinc/31/46/56/1413314656.db2.gz YCOCURRAOZHTEJ-APWZRJJASA-N 0 0 385.420 3.323 20 5 GGBDRN O=C(Nc1ccccc1O[C@H]1CCOC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000119047771 1413315790 /nfs/dbraw/zinc/31/57/90/1413315790.db2.gz JBFUKRWOLNNTNI-INIZCTEOSA-N 0 0 394.387 3.201 20 5 GGBDRN COc1ccc(-c2ccc(CN3CCCN(C(=O)C4CC4)CC3)o2)c([N+](=O)[O-])c1 ZINC000119049531 1413316957 /nfs/dbraw/zinc/31/69/57/1413316957.db2.gz LULZBDQFDLVPEX-UHFFFAOYSA-N 0 0 399.447 3.308 20 5 GGBDRN Cc1c(CC(=O)NCC(=O)Nc2cccc3ccccc32)cccc1[N+](=O)[O-] ZINC000119050402 1413317468 /nfs/dbraw/zinc/31/74/68/1413317468.db2.gz WEVLECPLUREOEA-UHFFFAOYSA-N 0 0 377.400 3.354 20 5 GGBDRN CCO[C@@H]1C[C@H](O)C12CCN(Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)CC2 ZINC000119057269 1413319558 /nfs/dbraw/zinc/31/95/58/1413319558.db2.gz WKWHUNXSSKOVLI-ZWKOTPCHSA-N 0 0 387.436 3.002 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)CC2 ZINC000119057657 1413319661 /nfs/dbraw/zinc/31/96/61/1413319661.db2.gz WKWHUNXSSKOVLI-MSOLQXFVSA-N 0 0 387.436 3.002 20 5 GGBDRN CC(=O)c1csc(C(=O)OCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)c1 ZINC000119057514 1413319829 /nfs/dbraw/zinc/31/98/29/1413319829.db2.gz JWJNGHNKFKAYFN-UHFFFAOYSA-N 0 0 389.433 3.327 20 5 GGBDRN C[C@@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Oc2ccccc2)cc1 ZINC000119059894 1413320640 /nfs/dbraw/zinc/32/06/40/1413320640.db2.gz SIKNMTJPNMKUBJ-OAHLLOKOSA-N 0 0 393.399 3.426 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000119063995 1413322927 /nfs/dbraw/zinc/32/29/27/1413322927.db2.gz ZCHRRAKNXZDGKR-NSHDSACASA-N 0 0 383.832 3.330 20 5 GGBDRN CCc1nc2c(s1)[C@H](N(C)C(=O)CCn1cc([N+](=O)[O-])nc1C)CCC2 ZINC000119076056 1413327488 /nfs/dbraw/zinc/32/74/88/1413327488.db2.gz DHDBPOPPXOITNS-CYBMUJFWSA-N 0 0 377.470 3.045 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1cccnc1OCC(F)(F)F ZINC000119078186 1413327960 /nfs/dbraw/zinc/32/79/60/1413327960.db2.gz CPHGZQURKHPPMR-UHFFFAOYSA-N 0 0 383.326 3.180 20 5 GGBDRN Cc1cc(C(=O)N[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)cc([N+](=O)[O-])c1 ZINC000177399698 1428718520 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393.399 3.426 20 5 GGBDRN CC(=O)N(CCc1ccccc1)CC(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000119120360 1413345389 /nfs/dbraw/zinc/34/53/89/1413345389.db2.gz KBGVWSLSUQOFFB-UHFFFAOYSA-N 0 0 392.415 3.173 20 5 GGBDRN O=C(NCc1ccc(CN2CCCC2=O)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119126643 1413347935 /nfs/dbraw/zinc/34/79/35/1413347935.db2.gz VJZKNSWCBQCSRP-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN CC(C)CSCCCn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O ZINC000119133287 1413350389 /nfs/dbraw/zinc/35/03/89/1413350389.db2.gz UFGAJPITSBNNNY-UHFFFAOYSA-N 0 0 387.465 3.270 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C12CCC2 ZINC000119144029 1413354118 /nfs/dbraw/zinc/35/41/18/1413354118.db2.gz MXQZXOZXLJTCPM-DLBZAZTESA-N 0 0 377.441 3.093 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NCc1ccnc(N2CCCC2)c1 ZINC000119145546 1413354462 /nfs/dbraw/zinc/35/44/62/1413354462.db2.gz HKSLNUXFIGJNAL-UHFFFAOYSA-N 0 0 397.479 3.412 20 5 GGBDRN C[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1nc(Cc2ccccc2)no1 ZINC000119152146 1413356985 /nfs/dbraw/zinc/35/69/85/1413356985.db2.gz MPUPWHZUCXPGSX-CQSZACIVSA-N 0 0 380.404 3.379 20 5 GGBDRN CC(=O)c1ccc(OCc2ccc(S(=O)(=O)C(F)F)cc2)c([N+](=O)[O-])c1 ZINC000119153107 1413357568 /nfs/dbraw/zinc/35/75/68/1413357568.db2.gz IYXTUGWPPQTRCU-UHFFFAOYSA-N 0 0 385.344 3.373 20 5 GGBDRN COC(=O)[C@@H](C)[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000177409931 1428723427 /nfs/dbraw/zinc/72/34/27/1428723427.db2.gz QYLJELSGPLAWMH-UGSOOPFHSA-N 0 0 396.403 3.285 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000119179373 1413366876 /nfs/dbraw/zinc/36/68/76/1413366876.db2.gz QODJVQLVNQAGEM-CYBMUJFWSA-N 0 0 383.832 3.378 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(C(=O)Nc2ccccc2)cc1 ZINC000119181823 1413368316 /nfs/dbraw/zinc/36/83/16/1413368316.db2.gz BOXIOWDYDHQAFE-UHFFFAOYSA-N 0 0 394.387 3.209 20 5 GGBDRN CC1(C)C[C@H](NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2ccccc21 ZINC000119186337 1413369425 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387.392 3.096 20 5 GGBDRN CC(=O)c1ccc(OCC(=O)NCCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000119202434 1413374457 /nfs/dbraw/zinc/37/44/57/1413374457.db2.gz AWJWVSTWVIPEQE-UHFFFAOYSA-N 0 0 376.796 3.189 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](C[C@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000119202761 1413374470 /nfs/dbraw/zinc/37/44/70/1413374470.db2.gz VCGDUPSCOBMRCU-LRDDRELGSA-N 0 0 387.392 3.096 20 5 GGBDRN COc1cc(Cn2nnc(-c3ccccc3C)n2)c([N+](=O)[O-])cc1OC(F)F ZINC000119220044 1413379248 /nfs/dbraw/zinc/37/92/48/1413379248.db2.gz BVFSWRIPERRAJZ-UHFFFAOYSA-N 0 0 391.334 3.215 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(O[C@@H]3CCCC[C@@H]3O)cc2)c1[N+](=O)[O-] ZINC000119226033 1413381664 /nfs/dbraw/zinc/38/16/64/1413381664.db2.gz XPHYTHIOVKIESD-JKSUJKDBSA-N 0 0 388.424 3.205 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(O[C@H]3CCCC[C@@H]3O)cc2)c1[N+](=O)[O-] ZINC000119226106 1413381679 /nfs/dbraw/zinc/38/16/79/1413381679.db2.gz XPHYTHIOVKIESD-HOTGVXAUSA-N 0 0 388.424 3.205 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000119228507 1413382335 /nfs/dbraw/zinc/38/23/35/1413382335.db2.gz JJTAMQFYEFQIMN-KGLIPLIRSA-N 0 0 394.435 3.387 20 5 GGBDRN O=C(c1ccc([O-])c([N+](=O)[O-])c1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000119248108 1413388254 /nfs/dbraw/zinc/38/82/54/1413388254.db2.gz DZNJOEPCXPOREO-MOPGFXCFSA-N 0 0 395.459 3.427 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCc2cnn(C)c2C)cc1 ZINC000119258041 1413391257 /nfs/dbraw/zinc/39/12/57/1413391257.db2.gz UFOGQERKIFWBDW-UHFFFAOYSA-N 0 0 396.403 3.368 20 5 GGBDRN COC(=O)[C@@H](C)[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000177411929 1428724759 /nfs/dbraw/zinc/72/47/59/1428724759.db2.gz LTKWKJODXAMWTO-SCLBCKFNSA-N 0 0 396.403 3.285 20 5 GGBDRN COC(=O)[C@@H](C)[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000177411891 1428724876 /nfs/dbraw/zinc/72/48/76/1428724876.db2.gz LTKWKJODXAMWTO-UGSOOPFHSA-N 0 0 396.403 3.285 20 5 GGBDRN CSc1ccccc1NC(=O)CN(C)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000119290203 1413400704 /nfs/dbraw/zinc/40/07/04/1413400704.db2.gz ADFMBLVMOCMCDV-UHFFFAOYSA-N 0 0 387.461 3.346 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000119300120 1413403972 /nfs/dbraw/zinc/40/39/72/1413403972.db2.gz KGUUYQAIYRZCFM-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN COc1cccc([C@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])c2ccccc2Cl)c1 ZINC000119304609 1413405104 /nfs/dbraw/zinc/40/51/04/1413405104.db2.gz LKBAWJLPIBDYRH-INIZCTEOSA-N 0 0 386.795 3.499 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccccc1Cl ZINC000119303686 1413405416 /nfs/dbraw/zinc/40/54/16/1413405416.db2.gz AETAEEVBXNCUJZ-INIZCTEOSA-N 0 0 386.795 3.499 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000119330005 1413413665 /nfs/dbraw/zinc/41/36/65/1413413665.db2.gz OFJADFSHRVXNKD-UHFFFAOYSA-N 0 0 380.326 3.366 20 5 GGBDRN Cc1cccc(-c2cccc(CNC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)c2)c1 ZINC000119332081 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3.245 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCC(OCc3ccccc3)CC2)cs1 ZINC000119378278 1413429468 /nfs/dbraw/zinc/42/94/68/1413429468.db2.gz XKVOUIKFQGGVAY-UHFFFAOYSA-N 0 0 382.463 3.026 20 5 GGBDRN C[C@@H](c1ccsc1)N1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000119383702 1413431014 /nfs/dbraw/zinc/43/10/14/1413431014.db2.gz NVYKTTHTDPNSBG-HNNXBMFYSA-N 0 0 388.493 3.287 20 5 GGBDRN Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)c2c([N+](=O)[O-])cnn2C)cc1 ZINC000119405809 1413436386 /nfs/dbraw/zinc/43/63/86/1413436386.db2.gz KONVXQWHCLFOBW-UHFFFAOYSA-N 0 0 382.424 3.372 20 5 GGBDRN CSc1cc(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)ccc1NC(C)=O ZINC000119410204 1413437664 /nfs/dbraw/zinc/43/76/64/1413437664.db2.gz PHRULEJPQONTPA-UHFFFAOYSA-N 0 0 385.445 3.474 20 5 GGBDRN CN(Cc1ccccc1OC(F)(F)F)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119414003 1413438949 /nfs/dbraw/zinc/43/89/49/1413438949.db2.gz BYXXKGIIBXUJDN-UHFFFAOYSA-N 0 0 396.368 3.376 20 5 GGBDRN 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ZINC000119493867 1413465404 /nfs/dbraw/zinc/46/54/04/1413465404.db2.gz LARJNLRBCFWJBN-UHFFFAOYSA-N 0 0 394.431 3.249 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC(c3ccc(O)cc3)CC2)cc1 ZINC000119512372 1413471615 /nfs/dbraw/zinc/47/16/15/1413471615.db2.gz WCZPSVHKCPPRMQ-UHFFFAOYSA-N 0 0 376.434 3.010 20 5 GGBDRN CCOC(=O)C[C@H]1CCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000119515604 1413472805 /nfs/dbraw/zinc/47/28/05/1413472805.db2.gz WOUPJLBRKFQFMI-MRXNPFEDSA-N 0 0 392.455 3.099 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)NCc2cc(Br)ccc2F)cs1 ZINC000119517617 1413473633 /nfs/dbraw/zinc/47/36/33/1413473633.db2.gz WJTQNGBNHUFZJJ-UHFFFAOYSA-N 0 0 395.231 3.036 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000119520132 1413474028 /nfs/dbraw/zinc/47/40/28/1413474028.db2.gz GONBLZCUCXWTPO-LJQANCHMSA-N 0 0 398.394 3.210 20 5 GGBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(Cl)c(N2CCNC2=O)c1 ZINC000119528275 1413476444 /nfs/dbraw/zinc/47/64/44/1413476444.db2.gz 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O=[N+]([O-])c1cc(S(=O)(=O)NCc2ccc(F)cc2C(F)(F)F)cs1 ZINC000119562574 1413486510 /nfs/dbraw/zinc/48/65/10/1413486510.db2.gz LNKPJZMUNJGAQH-UHFFFAOYSA-N 0 0 384.332 3.293 20 5 GGBDRN O=C(C[C@@H]1COCCN1CCOc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000119564852 1413487899 /nfs/dbraw/zinc/48/78/99/1413487899.db2.gz FTUGHJCLZGQJEM-OAHLLOKOSA-N 0 0 376.434 3.009 20 5 GGBDRN O=C(C[C@H]1COCCN1CCOc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000119564939 1413487983 /nfs/dbraw/zinc/48/79/83/1413487983.db2.gz FTUGHJCLZGQJEM-HNNXBMFYSA-N 0 0 376.434 3.009 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000119568460 1413488636 /nfs/dbraw/zinc/48/86/36/1413488636.db2.gz GZRUBDHWOQFBLO-HNNXBMFYSA-N 0 0 386.379 3.016 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(-n2cnc3ccccc32)nc1 ZINC000119568227 1413488710 /nfs/dbraw/zinc/48/87/10/1413488710.db2.gz FVFJKPFRYSMTIJ-UHFFFAOYSA-N 0 0 399.370 3.457 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CCN(Cc2nc3ccccc3[nH]2)CC1 ZINC000119571780 1413489753 /nfs/dbraw/zinc/48/97/53/1413489753.db2.gz SKSRWGLWRPTZQR-UHFFFAOYSA-N 0 0 385.855 3.442 20 5 GGBDRN CC(=O)N1CC[C@@H](CN(C)C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000119590675 1413496042 /nfs/dbraw/zinc/49/60/42/1413496042.db2.gz MVZYRAFSKKVAGC-INIZCTEOSA-N 0 0 396.447 3.279 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000177426263 1428732046 /nfs/dbraw/zinc/73/20/46/1428732046.db2.gz MMJNMNVSPKMYKH-KUHUBIRLSA-N 0 0 380.404 3.023 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)cc2)C[C@@H](C)O1 ZINC000119619420 1413505462 /nfs/dbraw/zinc/50/54/62/1413505462.db2.gz NUNKRPJLGXNGPR-VXGBXAGGSA-N 0 0 388.399 3.182 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCN(Cc2ccccc2)CC1 ZINC000119621612 1413506209 /nfs/dbraw/zinc/50/62/09/1413506209.db2.gz PCARQELEMPUYBO-UHFFFAOYSA-N 0 0 376.416 3.101 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000119625440 1413508079 /nfs/dbraw/zinc/50/80/79/1413508079.db2.gz SKZXTSJHZATXFC-UHFFFAOYSA-N 0 0 399.447 3.413 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)cc2)C[C@H](C)O1 ZINC000119626817 1413508108 /nfs/dbraw/zinc/50/81/08/1413508108.db2.gz OTYWTKQWUYNRBI-STQMWFEESA-N 0 0 395.419 3.337 20 5 GGBDRN CCCn1c(C)nnc1CSc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000119635584 1413510960 /nfs/dbraw/zinc/51/09/60/1413510960.db2.gz ASVXOSHTTDCUHI-UHFFFAOYSA-N 0 0 387.469 3.475 20 5 GGBDRN COC(=O)C1C(C)=NC(=S)N[C@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000119638914 1413512249 /nfs/dbraw/zinc/51/22/49/1413512249.db2.gz HWOIXQVFNMOVRT-HNNXBMFYSA-N 0 0 389.458 3.289 20 5 GGBDRN CC(C)CC(=O)Nc1cccc(CNS(=O)(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000119651779 1413516317 /nfs/dbraw/zinc/51/63/17/1413516317.db2.gz UJKJLKNEDTUZEY-UHFFFAOYSA-N 0 0 397.478 3.119 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCC(OCCc3ccccc3)CC2)cs1 ZINC000119657491 1413518466 /nfs/dbraw/zinc/51/84/66/1413518466.db2.gz BTTXCXQSDVGTND-UHFFFAOYSA-N 0 0 396.490 3.069 20 5 GGBDRN COc1cc(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)ccc1OCC(F)(F)F ZINC000119663648 1413521713 /nfs/dbraw/zinc/52/17/13/1413521713.db2.gz UGSARANREOVDAA-UHFFFAOYSA-N 0 0 399.325 3.057 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2OCC(F)(F)F)cc1 ZINC000119664667 1413521832 /nfs/dbraw/zinc/52/18/32/1413521832.db2.gz QDCPGKDVQOUGIT-UHFFFAOYSA-N 0 0 390.339 3.014 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000119682468 1413529601 /nfs/dbraw/zinc/52/96/01/1413529601.db2.gz VIBZCYSCXNKYFX-CZUORRHYSA-N 0 0 386.379 3.330 20 5 GGBDRN CCCN([C@@H](C)C(=O)Nc1ccccc1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119681678 1413529611 /nfs/dbraw/zinc/52/96/11/1413529611.db2.gz BALRMNQXZPCDRA-LBPRGKRZSA-N 0 0 397.478 3.084 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000119680667 1413529901 /nfs/dbraw/zinc/52/99/01/1413529901.db2.gz KDRXYXRTKJLNAU-UHFFFAOYSA-N 0 0 388.323 3.449 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000119694197 1413534739 /nfs/dbraw/zinc/53/47/39/1413534739.db2.gz VCEDZKAZOICQFD-IBGZPJMESA-N 0 0 392.415 3.173 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cc(F)ccc1Oc1ccccc1 ZINC000119703694 1413539094 /nfs/dbraw/zinc/53/90/94/1413539094.db2.gz YOBBRJPJHBPQIA-UHFFFAOYSA-N 0 0 383.335 3.327 20 5 GGBDRN CCN(C1CCCC1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000119715605 1413542450 /nfs/dbraw/zinc/54/24/50/1413542450.db2.gz BGTOKUJQFWPAHL-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCN(c2ccccc2F)CC1 ZINC000119726720 1413546873 /nfs/dbraw/zinc/54/68/73/1413546873.db2.gz QHFJMBBNDCAXDL-UHFFFAOYSA-N 0 0 380.379 3.245 20 5 GGBDRN CCOc1cc(C(=O)N(C)C)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000119732799 1413548923 /nfs/dbraw/zinc/54/89/23/1413548923.db2.gz HRBNQKNILHLXQA-UHFFFAOYSA-N 0 0 389.383 3.016 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000119750725 1413554913 /nfs/dbraw/zinc/55/49/13/1413554913.db2.gz LHMHMSMEWHZROC-MSOLQXFVSA-N 0 0 386.452 3.052 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2ccccc2[C@@H]1CO ZINC000119751791 1413555500 /nfs/dbraw/zinc/55/55/00/1413555500.db2.gz JSEOUSQHFHPZPB-HNNXBMFYSA-N 0 0 393.346 3.320 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 ZINC000119753837 1413556105 /nfs/dbraw/zinc/55/61/05/1413556105.db2.gz GFMBADAUPMCGLW-KBPBESRZSA-N 0 0 377.441 3.469 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000119773130 1413563311 /nfs/dbraw/zinc/56/33/11/1413563311.db2.gz LTCYNSLMCKEXQT-LBPRGKRZSA-N 0 0 379.394 3.159 20 5 GGBDRN C[C@@H](O)CNC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000119775120 1413564222 /nfs/dbraw/zinc/56/42/22/1413564222.db2.gz SFNZFMDPYHRFMG-SNVBAGLBSA-N 0 0 389.458 3.466 20 5 GGBDRN Cn1cc(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119789245 1413570086 /nfs/dbraw/zinc/57/00/86/1413570086.db2.gz KLTOKDPPZKZYOA-IPELMVKDSA-N 0 0 396.447 3.073 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCCc2cc(F)ccc21 ZINC000119790217 1413570134 /nfs/dbraw/zinc/57/01/34/1413570134.db2.gz LRJSVZJMGMCUPJ-SGTLLEGYSA-N 0 0 385.395 3.046 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCCc2cc(F)ccc21 ZINC000119789929 1413570138 /nfs/dbraw/zinc/57/01/38/1413570138.db2.gz LRJSVZJMGMCUPJ-KPZWWZAWSA-N 0 0 385.395 3.046 20 5 GGBDRN O=C(CNc1ccccc1OC(F)(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000119795963 1413572604 /nfs/dbraw/zinc/57/26/04/1413572604.db2.gz XHQYESKLAFZNNB-UHFFFAOYSA-N 0 0 381.310 3.495 20 5 GGBDRN Cc1cc(C(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000119796341 1413572726 /nfs/dbraw/zinc/57/27/26/1413572726.db2.gz IVNIHNDXXPMKKZ-LSDHHAIUSA-N 0 0 377.441 3.469 20 5 GGBDRN O=C(c1ccc(F)cc1)[C@H]1CCCN(S(=O)(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000119800771 1413573947 /nfs/dbraw/zinc/57/39/47/1413573947.db2.gz YWOHQCRDITXDAV-LBPRGKRZSA-N 0 0 398.437 3.079 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CCCOCCc2ccccc2)CC1 ZINC000119801312 1413574121 /nfs/dbraw/zinc/57/41/21/1413574121.db2.gz VMGSGXISGAYCCG-UHFFFAOYSA-N 0 0 397.475 3.002 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cc(F)cc3cccnc32)CC1 ZINC000119801969 1413574670 /nfs/dbraw/zinc/57/46/70/1413574670.db2.gz PQYJKNPEZFEZGY-UHFFFAOYSA-N 0 0 394.406 3.240 20 5 GGBDRN Cc1cccc(C(=O)N[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000119803778 1413575152 /nfs/dbraw/zinc/57/51/52/1413575152.db2.gz RZIKXRYXQXPBMW-KGLIPLIRSA-N 0 0 377.441 3.469 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCOC[C@H]1C[C@@H](O)c1cccs1 ZINC000119812925 1413578606 /nfs/dbraw/zinc/57/86/06/1413578606.db2.gz FLMHRTMIMBBSDO-HUUCEWRRSA-N 0 0 377.422 3.013 20 5 GGBDRN CCC1CCN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000119814883 1413579247 /nfs/dbraw/zinc/57/92/47/1413579247.db2.gz PCFWEDAQGFXBNW-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCOC[C@@H]1C[C@H](O)c1cccs1 ZINC000119816896 1413579780 /nfs/dbraw/zinc/57/97/80/1413579780.db2.gz JVCMVGOGCQFWNS-GJZGRUSLSA-N 0 0 377.422 3.013 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCOC[C@H]1C[C@H](O)c1cccs1 ZINC000119816695 1413579988 /nfs/dbraw/zinc/57/99/88/1413579988.db2.gz JVCMVGOGCQFWNS-CABCVRRESA-N 0 0 377.422 3.013 20 5 GGBDRN CC(C)Oc1cccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000119828580 1413584532 /nfs/dbraw/zinc/58/45/32/1413584532.db2.gz LWLQDUYIHGCQLH-UHFFFAOYSA-N 0 0 383.448 3.340 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)C[C@@H](O)COCc1ccccc1 ZINC000119830541 1413585881 /nfs/dbraw/zinc/58/58/81/1413585881.db2.gz DFKMWOGLLMZJPE-QGZVFWFLSA-N 0 0 387.436 3.253 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)C[C@H](O)COCc1ccccc1 ZINC000119830398 1413585985 /nfs/dbraw/zinc/58/59/85/1413585985.db2.gz DFKMWOGLLMZJPE-KRWDZBQOSA-N 0 0 387.436 3.253 20 5 GGBDRN CCOc1cc(C(=O)NCCc2cc3ccccc3[nH]2)c([N+](=O)[O-])cc1OC ZINC000119833164 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O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccnc(Br)c1 ZINC000120741909 1413890318 /nfs/dbraw/zinc/89/03/18/1413890318.db2.gz FQXFDBOCXUGTAU-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CC(=O)c1ccc(OCc2nc(COc3ccc(F)cc3)no2)c([N+](=O)[O-])c1 ZINC000120771857 1413898290 /nfs/dbraw/zinc/89/82/90/1413898290.db2.gz ZKUHEXMAIDIIOC-UHFFFAOYSA-N 0 0 387.323 3.478 20 5 GGBDRN O=C(NCc1nc(C(F)(F)F)cs1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000120780868 1413901128 /nfs/dbraw/zinc/90/11/28/1413901128.db2.gz VKYFISJQAWNTOG-UHFFFAOYSA-N 0 0 386.355 3.338 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120781686 1413901183 /nfs/dbraw/zinc/90/11/83/1413901183.db2.gz IKFBZXDYXCUCJF-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN COc1cc(OC)c(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1F ZINC000120793027 1413904719 /nfs/dbraw/zinc/90/47/19/1413904719.db2.gz LWCLVUWZWJWBQI-UHFFFAOYSA-N 0 0 386.339 3.189 20 5 GGBDRN COc1ccc(NC(=O)C[C@@H](NC(C)=O)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000120806397 1413909237 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20 5 GGBDRN Cn1ccnc1C[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000120839311 1413922032 /nfs/dbraw/zinc/92/20/32/1413922032.db2.gz CEMDFZKIMVVWPO-ZDUSSCGKSA-N 0 0 376.844 3.006 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000120842685 1413923549 /nfs/dbraw/zinc/92/35/49/1413923549.db2.gz XNDDTRSPJSAEES-UHFFFAOYSA-N 0 0 382.420 3.493 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)n(C)c21 ZINC000120849786 1413926004 /nfs/dbraw/zinc/92/60/04/1413926004.db2.gz HHEIZMRMUITKHS-UHFFFAOYSA-N 0 0 379.420 3.294 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCN(c2cccc(O)c2)CC1 ZINC000120860222 1413929228 /nfs/dbraw/zinc/92/92/28/1413929228.db2.gz FHVICPOFRQALDB-UHFFFAOYSA-N 0 0 398.463 3.155 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1c(F)cc(F)cc1F ZINC000120866141 1413931043 /nfs/dbraw/zinc/93/10/43/1413931043.db2.gz TWZVODDRDDPOSQ-UHFFFAOYSA-N 0 0 395.337 3.388 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000120873123 1413933384 /nfs/dbraw/zinc/93/33/84/1413933384.db2.gz KNJWQYOFUQNKHC-NXEZZACHSA-N 0 0 377.260 3.166 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1cccc2[nH]ccc21 ZINC000120873672 1413933591 /nfs/dbraw/zinc/93/35/91/1413933591.db2.gz WIGWCTNXOPILJF-UHFFFAOYSA-N 0 0 380.404 3.452 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1cc(F)cc(F)c1 ZINC000120877069 1413934362 /nfs/dbraw/zinc/93/43/62/1413934362.db2.gz NQIKNTKEFMQECO-UHFFFAOYSA-N 0 0 377.347 3.249 20 5 GGBDRN O=C(NCc1ccc(-n2cncn2)cc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120877741 1413934777 /nfs/dbraw/zinc/93/47/77/1413934777.db2.gz POPKABGPDXATSP-UHFFFAOYSA-N 0 0 392.419 3.050 20 5 GGBDRN CC(C)N(C1CCC1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000120878293 1413934794 /nfs/dbraw/zinc/93/47/94/1413934794.db2.gz CGOPWJANFPFWHH-UHFFFAOYSA-N 0 0 377.260 3.309 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000120877236 1413935062 /nfs/dbraw/zinc/93/50/62/1413935062.db2.gz LAPSEXRDWPZVLJ-MRXNPFEDSA-N 0 0 387.440 3.198 20 5 GGBDRN CC(=O)c1ccc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000120880710 1413935333 /nfs/dbraw/zinc/93/53/33/1413935333.db2.gz CFYCLUUZCWXTDX-UHFFFAOYSA-N 0 0 383.404 3.173 20 5 GGBDRN CCO[C@H](C)C(=O)N(CCOC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000120886145 1413937677 /nfs/dbraw/zinc/93/76/77/1413937677.db2.gz HZJKCIFPXRZTRP-GFCCVEGCSA-N 0 0 379.438 3.123 20 5 GGBDRN COc1cccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1OC ZINC000120889219 1413938745 /nfs/dbraw/zinc/93/87/45/1413938745.db2.gz TVVXAIWFGUDYOE-UHFFFAOYSA-N 0 0 385.420 3.486 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000120905631 1413943517 /nfs/dbraw/zinc/94/35/17/1413943517.db2.gz QWJGTCKGXPXCEG-CYBMUJFWSA-N 0 0 394.435 3.020 20 5 GGBDRN O=C(C[C@@H]1COCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccco1 ZINC000120937788 1413953479 /nfs/dbraw/zinc/95/34/79/1413953479.db2.gz XJWCYRGTFBIHGC-QGZVFWFLSA-N 0 0 397.387 3.317 20 5 GGBDRN CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000120948543 1413957434 /nfs/dbraw/zinc/95/74/34/1413957434.db2.gz LETKLFSQGXPKJX-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN CC(C)(NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000120952311 1413957913 /nfs/dbraw/zinc/95/79/13/1413957913.db2.gz QNHWZUJGMPWRQZ-UHFFFAOYSA-N 0 0 376.796 3.491 20 5 GGBDRN Cc1c(-c2nc(COc3ccc(F)cc3)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000120969877 1413963690 /nfs/dbraw/zinc/96/36/90/1413963690.db2.gz SJSCHOLPCJRVOQ-UHFFFAOYSA-N 0 0 396.338 3.252 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2ccc(-c3csnn3)cc2)c1F ZINC000120975129 1413964999 /nfs/dbraw/zinc/96/49/99/1413964999.db2.gz LQSILMFDBAHZJE-UHFFFAOYSA-N 0 0 394.409 3.362 20 5 GGBDRN CC(C)(CO)[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000120996424 1413971553 /nfs/dbraw/zinc/97/15/53/1413971553.db2.gz RJKAFJYBJZWHTO-IBGZPJMESA-N 0 0 385.464 3.239 20 5 GGBDRN NC(=O)NCc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000120998549 1413972061 /nfs/dbraw/zinc/97/20/61/1413972061.db2.gz AUOMDUSDDCCYFF-UHFFFAOYSA-N 0 0 382.298 3.034 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cccn(Cc2ccc(F)cc2)c1=O ZINC000121001009 1413972902 /nfs/dbraw/zinc/97/29/02/1413972902.db2.gz IBSBSZLLSPPJCK-UHFFFAOYSA-N 0 0 381.363 3.125 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2ccc(-c3cc[nH]n3)cc2)c1F ZINC000121002556 1413973537 /nfs/dbraw/zinc/97/35/37/1413973537.db2.gz PZBFFOXLJDKVKT-UHFFFAOYSA-N 0 0 376.369 3.233 20 5 GGBDRN O=C(COc1ccc(N2CCCC2=O)cc1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000121005378 1413974164 /nfs/dbraw/zinc/97/41/64/1413974164.db2.gz MFJNOMRAIXJPNC-UHFFFAOYSA-N 0 0 395.415 3.080 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O ZINC000121014529 1413977113 /nfs/dbraw/zinc/97/71/13/1413977113.db2.gz TWEWVGPWAVOUFM-UHFFFAOYSA-N 0 0 397.362 3.205 20 5 GGBDRN C[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H](c2ccsc2)O1 ZINC000121014086 1413977264 /nfs/dbraw/zinc/97/72/64/1413977264.db2.gz OCHSKXJOGAATLN-FZKQIMNGSA-N 0 0 387.461 3.007 20 5 GGBDRN O=C(CCC(=O)N1CCCc2ccc([N+](=O)[O-])cc21)N1CCc2sccc2C1 ZINC000121018685 1413978659 /nfs/dbraw/zinc/97/86/59/1413978659.db2.gz OGXHXZSABDLJHO-UHFFFAOYSA-N 0 0 399.472 3.301 20 5 GGBDRN C=C1c2ccccc2C(=O)N1CCC(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000121040423 1413986633 /nfs/dbraw/zinc/98/66/33/1413986633.db2.gz BWCUVUBLOPWKQG-UHFFFAOYSA-N 0 0 377.400 3.391 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)cccc1[N+](=O)[O-] ZINC000121041709 1413987119 /nfs/dbraw/zinc/98/71/19/1413987119.db2.gz CANFELLFBUTPAN-MRXNPFEDSA-N 0 0 383.448 3.478 20 5 GGBDRN Cc1nn(C)c2sc(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)cc12 ZINC000121044743 1413987706 /nfs/dbraw/zinc/98/77/06/1413987706.db2.gz VPMPEIAECVXCNX-UHFFFAOYSA-N 0 0 388.405 3.265 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CC[C@@H](Oc2ccncc2)C1 ZINC000121051005 1413989098 /nfs/dbraw/zinc/98/90/98/1413989098.db2.gz YSYPISXTSWKWSW-GOSISDBHSA-N 0 0 396.447 3.274 20 5 GGBDRN CC(C)COC(=O)N1CCC(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000121051800 1413989758 /nfs/dbraw/zinc/98/97/58/1413989758.db2.gz PBLPHPUZEXRJHU-UHFFFAOYSA-N 0 0 389.452 3.379 20 5 GGBDRN COCCOc1cc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)nc2ccccc21 ZINC000121066789 1413994599 /nfs/dbraw/zinc/99/45/99/1413994599.db2.gz QNOGTTGGYOJFIF-UHFFFAOYSA-N 0 0 393.399 3.371 20 5 GGBDRN Cc1ccccc1Cc1nnc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)o1 ZINC000121079430 1413999533 /nfs/dbraw/zinc/99/95/33/1413999533.db2.gz VRZXCTCFPBLIFM-UHFFFAOYSA-N 0 0 393.447 3.199 20 5 GGBDRN C[C@H](c1cn(-c2ccccc2)nn1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000121079261 1413999690 /nfs/dbraw/zinc/99/96/90/1413999690.db2.gz PZSUNUIHWBRGRG-MRXNPFEDSA-N 0 0 378.436 3.059 20 5 GGBDRN CCOC(=O)C1C(c2ccc([N+](=O)[O-])cc2)=NC(=S)N[C@H]1c1cccs1 ZINC000121081225 1414000302 /nfs/dbraw/zinc/00/03/02/1414000302.db2.gz WTNARPMCGWELLE-HNNXBMFYSA-N 0 0 389.458 3.150 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000121083533 1414001537 /nfs/dbraw/zinc/00/15/37/1414001537.db2.gz KSKDMFSWTJLYTG-HXUWFJFHSA-N 0 0 381.363 3.414 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NC[C@H](Nc1ccccc1)C(C)C ZINC000121088721 1414003593 /nfs/dbraw/zinc/00/35/93/1414003593.db2.gz WPCOIZZODKPGMH-KRWDZBQOSA-N 0 0 398.463 3.403 20 5 GGBDRN Cc1cc(=O)oc2cc(OC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)ccc12 ZINC000121089871 1414004171 /nfs/dbraw/zinc/00/41/71/1414004171.db2.gz QSPDPICUIMPXFS-UHFFFAOYSA-N 0 0 384.300 3.445 20 5 GGBDRN COc1ccc([C@H](C)N(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000121093611 1414005563 /nfs/dbraw/zinc/00/55/63/1414005563.db2.gz HGUJKAOBWFLIRD-AWEZNQCLSA-N 0 0 385.420 3.378 20 5 GGBDRN Cc1cccc2nc(CNC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)cn21 ZINC000121095230 1414005890 /nfs/dbraw/zinc/00/58/90/1414005890.db2.gz CEOZMEFPXSBQLU-UHFFFAOYSA-N 0 0 379.420 3.425 20 5 GGBDRN Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])C1 ZINC000121115599 1414013000 /nfs/dbraw/zinc/01/30/00/1414013000.db2.gz FOILDOSTLFKRDW-RDJZCZTQSA-N 0 0 382.416 3.499 20 5 GGBDRN O=C(/C=C/c1ccc(Cl)nc1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000121115275 1414013128 /nfs/dbraw/zinc/01/31/28/1414013128.db2.gz BIQPPWAPVNZDHP-HWKANZROSA-N 0 0 375.768 3.456 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C12CCCCC2 ZINC000121126759 1414017513 /nfs/dbraw/zinc/01/75/13/1414017513.db2.gz VVNBRBOSIWZAMB-IRXDYDNUSA-N 0 0 389.452 3.120 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC1 ZINC000121130885 1414018732 /nfs/dbraw/zinc/01/87/32/1414018732.db2.gz OYZHJSZTUWOEBZ-UHFFFAOYSA-N 0 0 389.452 3.000 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000121142373 1414022953 /nfs/dbraw/zinc/02/29/53/1414022953.db2.gz NCEWQVQDDRLBAV-GUYCJALGSA-N 0 0 375.450 3.365 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)c(C)c1[N+](=O)[O-] ZINC000121148696 1414024987 /nfs/dbraw/zinc/02/49/87/1414024987.db2.gz 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C[C@@H](C(=O)N(C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1cccs1 ZINC000121799558 1414261249 /nfs/dbraw/zinc/26/12/49/1414261249.db2.gz DTDGNSGZBYGTBO-SECBINFHSA-N 0 0 388.854 3.261 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)s1 ZINC000121812203 1414265378 /nfs/dbraw/zinc/26/53/78/1414265378.db2.gz MSTODKZPXHDFIJ-NSHDSACASA-N 0 0 375.450 3.267 20 5 GGBDRN Cc1nc(COc2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)cc2)no1 ZINC000121813349 1414265824 /nfs/dbraw/zinc/26/58/24/1414265824.db2.gz TUGHHOOKCYLSDT-UHFFFAOYSA-N 0 0 382.376 3.355 20 5 GGBDRN CC(C)[C@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Nc1ccccc1 ZINC000121817900 1414267695 /nfs/dbraw/zinc/26/76/95/1414267695.db2.gz GXVKAWAHXYCUOY-KRWDZBQOSA-N 0 0 394.435 3.042 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc([N+](=O)[O-])c1 ZINC000121828032 1414270710 /nfs/dbraw/zinc/27/07/10/1414270710.db2.gz YLAZCLHSBXEMQF-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN 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O=c1ccc([N+](=O)[O-])cn1CCSc1ncnc2sc3c(c21)CCCC3 ZINC000121838432 1414274395 /nfs/dbraw/zinc/27/43/95/1414274395.db2.gz KDKNJIODESELMV-UHFFFAOYSA-N 0 0 388.474 3.432 20 5 GGBDRN C[C@H](Cc1nnc(SCCn2cc([N+](=O)[O-])ccc2=O)o1)c1ccccc1 ZINC000121854323 1414278731 /nfs/dbraw/zinc/27/87/31/1414278731.db2.gz JKRPMPOVTWSHDU-CYBMUJFWSA-N 0 0 386.433 3.278 20 5 GGBDRN Cc1n[nH]cc1CCCNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000121865950 1414283701 /nfs/dbraw/zinc/28/37/01/1414283701.db2.gz FBEYTBGDTABYHL-UHFFFAOYSA-N 0 0 399.373 3.196 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(C(=O)OC(C)(C)C)c(C)c1 ZINC000121876325 1414287507 /nfs/dbraw/zinc/28/75/07/1414287507.db2.gz UZTPWBHESWGDQP-UHFFFAOYSA-N 0 0 388.424 3.392 20 5 GGBDRN Cc1n[nH]cc1CCCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000121877491 1414287657 /nfs/dbraw/zinc/28/76/57/1414287657.db2.gz VLYDSHIILGIPGG-UHFFFAOYSA-N 0 0 385.468 3.225 20 5 GGBDRN COc1cccc2c1CC[C@H]2NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000121882736 1414289858 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/nfs/dbraw/zinc/51/02/13/1414510213.db2.gz NCSYCLZOMKGHKR-HXUWFJFHSA-N 0 0 394.431 3.194 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])n1 ZINC000122593064 1414511439 /nfs/dbraw/zinc/51/14/39/1414511439.db2.gz MQYSJDZWQARIKC-INIZCTEOSA-N 0 0 375.450 3.441 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)ccc1Cl ZINC000122606200 1414514798 /nfs/dbraw/zinc/51/47/98/1414514798.db2.gz PBLMWYAYQPNFAW-UHFFFAOYSA-N 0 0 393.802 3.465 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)cc1 ZINC000122615556 1414517970 /nfs/dbraw/zinc/51/79/70/1414517970.db2.gz MDXUQJDYVFTAAV-MRXNPFEDSA-N 0 0 378.425 3.128 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000122620603 1414519765 /nfs/dbraw/zinc/51/97/65/1414519765.db2.gz YAYPOLQBMSBPJU-CYBMUJFWSA-N 0 0 382.388 3.126 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000122621692 1414520337 /nfs/dbraw/zinc/52/03/37/1414520337.db2.gz CCYAIBRGSQXVJU-CYBMUJFWSA-N 0 0 382.388 3.126 20 5 GGBDRN CC(=O)c1ccc(OCCCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122623687 1414520614 /nfs/dbraw/zinc/52/06/14/1414520614.db2.gz XQPTWLNYPPKUON-UHFFFAOYSA-N 0 0 382.376 3.471 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C2CCCC2)C(F)(F)F)c([N+](=O)[O-])cc1OC ZINC000177625797 1428814959 /nfs/dbraw/zinc/81/49/59/1428814959.db2.gz RMFQSDJOGOBXPO-AWEZNQCLSA-N 0 0 376.331 3.463 20 5 GGBDRN Cc1cc([C@@H]2CN(S(=O)(=O)c3cccc([N+](=O)[O-])c3C)CCO2)ccc1F ZINC000122624725 1414521583 /nfs/dbraw/zinc/52/15/83/1414521583.db2.gz AXXKLAPSSOFBDB-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(OCC(F)(F)F)nc1 ZINC000122626588 1414522324 /nfs/dbraw/zinc/52/23/24/1414522324.db2.gz JVPFTFGQBIASDZ-UHFFFAOYSA-N 0 0 381.270 3.060 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)n1 ZINC000122637849 1414525676 /nfs/dbraw/zinc/52/56/76/1414525676.db2.gz JPPOLHVTLNHUMG-QGZVFWFLSA-N 0 0 375.450 3.441 20 5 GGBDRN CC(=O)CCc1ccc(OCCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122638555 1414525729 /nfs/dbraw/zinc/52/57/29/1414525729.db2.gz QBWVZBNERHSVQK-UHFFFAOYSA-N 0 0 396.403 3.400 20 5 GGBDRN CC(=O)CCc1ccc(O[C@H](C)C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122638320 1414525753 /nfs/dbraw/zinc/52/57/53/1414525753.db2.gz LPQXBOMWPVEHCH-CYBMUJFWSA-N 0 0 396.403 3.399 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](c2ccc(F)cc2)C[C@@H]1C ZINC000122641133 1414526156 /nfs/dbraw/zinc/52/61/56/1414526156.db2.gz XIGRRRDPIZTMAV-JSGCOSHPSA-N 0 0 394.424 3.309 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1cccs1 ZINC000122640219 1414526433 /nfs/dbraw/zinc/52/64/33/1414526433.db2.gz HVWPFSWWHVHMKH-LBPRGKRZSA-N 0 0 389.389 3.442 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1c1cccc(C)n1 ZINC000122643716 1414527518 /nfs/dbraw/zinc/52/75/18/1414527518.db2.gz OIHWSJZFJBNSLM-QGZVFWFLSA-N 0 0 375.450 3.386 20 5 GGBDRN COCCOCc1cc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)ccc1F ZINC000122644539 1414527600 /nfs/dbraw/zinc/52/76/00/1414527600.db2.gz VVTAPXSJTLLKQN-UHFFFAOYSA-N 0 0 388.355 3.026 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cc(F)cc(N2CCOCC2)c1 ZINC000122644641 1414527790 /nfs/dbraw/zinc/52/77/90/1414527790.db2.gz QZZRGVNHIVRKPS-UHFFFAOYSA-N 0 0 398.394 3.233 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Oc1cc(F)cc(F)c1 ZINC000122646379 1414528277 /nfs/dbraw/zinc/52/82/77/1414528277.db2.gz LXOCVJHOZREPIA-UHFFFAOYSA-N 0 0 378.287 3.167 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N[C@@H](C)C[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000122656821 1414530670 /nfs/dbraw/zinc/53/06/70/1414530670.db2.gz HYJNLMRHEVPJBD-BLLLJJGKSA-N 0 0 398.868 3.347 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000122657694 1414531129 /nfs/dbraw/zinc/53/11/29/1414531129.db2.gz NKDUXKUKQVXFOL-XJKSGUPXSA-N 0 0 378.425 3.442 20 5 GGBDRN Cc1nc2c(cnn2C(C)C)cc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 ZINC000122659042 1414531400 /nfs/dbraw/zinc/53/14/00/1414531400.db2.gz OBAIAQCUZODZDZ-UHFFFAOYSA-N 0 0 379.380 3.357 20 5 GGBDRN Cc1noc2nc(C3CC3)cc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c12 ZINC000122661248 1414532449 /nfs/dbraw/zinc/53/24/49/1414532449.db2.gz QNSFWCQFTLNFRY-UHFFFAOYSA-N 0 0 378.348 3.445 20 5 GGBDRN Cc1c(C(=O)NCCc2c(F)cccc2F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122667749 1414533678 /nfs/dbraw/zinc/53/36/78/1414533678.db2.gz LNFVCEZSPHJTKP-UHFFFAOYSA-N 0 0 379.319 3.371 20 5 GGBDRN Cc1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)ccc1N1C(=O)CCC1=O ZINC000122679305 1414536246 /nfs/dbraw/zinc/53/62/46/1414536246.db2.gz GZEWNJYXUOPTIK-UHFFFAOYSA-N 0 0 381.388 3.046 20 5 GGBDRN Cc1ccc2oc(C(=O)N3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)cc2c1 ZINC000122682978 1414537009 /nfs/dbraw/zinc/53/70/09/1414537009.db2.gz UEOUQPWEPQKSAX-UHFFFAOYSA-N 0 0 393.399 3.248 20 5 GGBDRN Cc1ccc(-c2nc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)cs2)n1C ZINC000122685773 1414537710 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385.811 3.300 20 5 GGBDRN O=C(c1cc2ccccc2s1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122713922 1414546257 /nfs/dbraw/zinc/54/62/57/1414546257.db2.gz ZQYGPDJCZIBFGA-UHFFFAOYSA-N 0 0 395.440 3.408 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@H]1CCC[C@H](O)C1 ZINC000122715362 1414546461 /nfs/dbraw/zinc/54/64/61/1414546461.db2.gz LUTPTAUDDPUNSV-AAEUAGOBSA-N 0 0 389.374 3.083 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccccc1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000122718503 1414547653 /nfs/dbraw/zinc/54/76/53/1414547653.db2.gz QNFXAXXGZSYIEC-XHDPSFHLSA-N 0 0 384.841 3.039 20 5 GGBDRN COCCCOC1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000122726904 1414549933 /nfs/dbraw/zinc/54/99/33/1414549933.db2.gz WUDMSMCHNXFYSR-ZDUSSCGKSA-N 0 0 399.875 3.093 20 5 GGBDRN CCc1sc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1C ZINC000122726808 1414550122 /nfs/dbraw/zinc/55/01/22/1414550122.db2.gz WUJXTGXTWZZODN-UHFFFAOYSA-N 0 0 387.461 3.125 20 5 GGBDRN 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ZINC000122744317 1414554595 /nfs/dbraw/zinc/55/45/95/1414554595.db2.gz FPIWRKAXADHGFQ-UHFFFAOYSA-N 0 0 396.407 3.184 20 5 GGBDRN COC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc(F)c(F)c1 ZINC000122746818 1414555307 /nfs/dbraw/zinc/55/53/07/1414555307.db2.gz UPEVWOXMZUBOFL-HNNXBMFYSA-N 0 0 381.335 3.391 20 5 GGBDRN COc1ccc(NC(C)=O)cc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000122746182 1414555342 /nfs/dbraw/zinc/55/53/42/1414555342.db2.gz AGFHRERKJSGTKU-UHFFFAOYSA-N 0 0 382.376 3.224 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCc2nc(C(C)C)no2)cc1[N+](=O)[O-] ZINC000122753423 1414556367 /nfs/dbraw/zinc/55/63/67/1414556367.db2.gz YDOLMWSEGXITBV-UHFFFAOYSA-N 0 0 397.229 3.145 20 5 GGBDRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000122756604 1414557198 /nfs/dbraw/zinc/55/71/98/1414557198.db2.gz ZRWYELRSTCKYPO-ZBFHGGJFSA-N 0 0 398.463 3.490 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2cccc(O)c2)CC1 ZINC000122755767 1414557231 /nfs/dbraw/zinc/55/72/31/1414557231.db2.gz 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ZINC000122803355 1414568549 /nfs/dbraw/zinc/56/85/49/1414568549.db2.gz CSDXKOIUOSKYHD-UHFFFAOYSA-N 0 0 384.367 3.071 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2Cc3ccccc3C[C@@H]2c2nnc(C)o2)c1 ZINC000122804680 1414569281 /nfs/dbraw/zinc/56/92/81/1414569281.db2.gz NXOGWOMWDJBPCG-GOSISDBHSA-N 0 0 394.387 3.235 20 5 GGBDRN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122803630 1414569382 /nfs/dbraw/zinc/56/93/82/1414569382.db2.gz OUTUVSGVSYDIPR-GOSISDBHSA-N 0 0 391.387 3.374 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnc1Cl ZINC000122809852 1414570652 /nfs/dbraw/zinc/57/06/52/1414570652.db2.gz KUKUEMOSBHRETQ-UHFFFAOYSA-N 0 0 381.841 3.305 20 5 GGBDRN CCc1noc(CC)c1CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000122815285 1414571945 /nfs/dbraw/zinc/57/19/45/1414571945.db2.gz KAFGVUDNRXTQTQ-UHFFFAOYSA-N 0 0 379.438 3.368 20 5 GGBDRN CCn1c(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])nnc1-c1cccnc1 ZINC000122816066 1414571990 /nfs/dbraw/zinc/57/19/90/1414571990.db2.gz 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ZINC000122872168 1414585634 /nfs/dbraw/zinc/58/56/34/1414585634.db2.gz IXXKSJCPVJPHTM-UHFFFAOYSA-N 0 0 388.323 3.201 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCC2(c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000122883261 1414588211 /nfs/dbraw/zinc/58/82/11/1414588211.db2.gz QHKRTSDVJQWCBM-UHFFFAOYSA-N 0 0 387.823 3.343 20 5 GGBDRN CC[C@H]1CCCC[C@H]1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000122891567 1414590439 /nfs/dbraw/zinc/59/04/39/1414590439.db2.gz UKLVCQGGBDPUPY-UONOGXRCSA-N 0 0 394.497 3.093 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2c(F)cc(F)cc2C1 ZINC000122898810 1414592008 /nfs/dbraw/zinc/59/20/08/1414592008.db2.gz FDYXDMOWNNUUIU-UHFFFAOYSA-N 0 0 384.342 3.257 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000122900513 1414592508 /nfs/dbraw/zinc/59/25/08/1414592508.db2.gz BBRHTJKLBUYXBQ-KSSFIOAISA-N 0 0 398.394 3.339 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)NCc2nc(C3CC3)cs2)cc1[N+](=O)[O-] ZINC000122900904 1414592785 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KKCYJQZPCGTNPR-APWZRJJASA-N 0 0 388.395 3.227 20 5 GGBDRN O=c1ccc2cc(S(=O)(=O)Oc3cc(Cl)ccc3[N+](=O)[O-])ccc2o1 ZINC000123052104 1414628294 /nfs/dbraw/zinc/62/82/94/1414628294.db2.gz GFFBRNGUZHVTGX-UHFFFAOYSA-N 0 0 381.749 3.122 20 5 GGBDRN CC[C@H]1CCc2ccccc2N1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000177654381 1428823667 /nfs/dbraw/zinc/82/36/67/1428823667.db2.gz XQYGXXQXFAJGNN-HNNXBMFYSA-N 0 0 388.445 3.370 20 5 GGBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OS(=O)(=O)CC[C@@H]1CCCO1 ZINC000123059857 1414630178 /nfs/dbraw/zinc/63/01/78/1414630178.db2.gz QWDBJFYJLBQDFT-KRWDZBQOSA-N 0 0 391.445 3.463 20 5 GGBDRN COc1cc(CN2CCC(NC(=O)c3ccccc3)CC2)c([N+](=O)[O-])cc1OC ZINC000123062245 1414631503 /nfs/dbraw/zinc/63/15/03/1414631503.db2.gz OLMLDBPHVLRJBU-UHFFFAOYSA-N 0 0 399.447 3.006 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](c1nccn1C)c1ccc(F)cc1 ZINC000123071068 1414633305 /nfs/dbraw/zinc/63/33/05/1414633305.db2.gz AFEARIGTSGNHKV-KRWDZBQOSA-N 0 0 399.382 3.387 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCOc1cccc2ccccc21 ZINC000123077313 1414635317 /nfs/dbraw/zinc/63/53/17/1414635317.db2.gz NJGCSAHCSFFNFM-UHFFFAOYSA-N 0 0 393.399 3.190 20 5 GGBDRN Cc1cccn2cc(CCNC(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)nc12 ZINC000123094677 1414639896 /nfs/dbraw/zinc/63/98/96/1414639896.db2.gz XIORZBHWZYFZQK-UHFFFAOYSA-N 0 0 393.447 3.468 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2c(F)cc(F)cc2C1 ZINC000123103074 1414642566 /nfs/dbraw/zinc/64/25/66/1414642566.db2.gz UGZJOVWVUFCHAB-UHFFFAOYSA-N 0 0 384.342 3.257 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@]2(CCc3ccccc32)C1 ZINC000123116357 1414645370 /nfs/dbraw/zinc/64/53/70/1414645370.db2.gz XRNKAYRWWUMFAK-HXUWFJFHSA-N 0 0 383.404 3.309 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@](C)(O)c1ccccc1Cl ZINC000123123664 1414647405 /nfs/dbraw/zinc/64/74/05/1414647405.db2.gz HLCUSIBGBGSURA-QGZVFWFLSA-N 0 0 379.800 3.286 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@H](CCc2ccccc2)C1 ZINC000123122936 1414647527 /nfs/dbraw/zinc/64/75/27/1414647527.db2.gz RRCSKAXZPODPOY-QGZVFWFLSA-N 0 0 385.420 3.469 20 5 GGBDRN O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123130856 1414649366 /nfs/dbraw/zinc/64/93/66/1414649366.db2.gz FEAFTRYLGLJJTH-HNNXBMFYSA-N 0 0 376.416 3.399 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCc1nnc(-c2ccccc2)o1 ZINC000177659768 1428825436 /nfs/dbraw/zinc/82/54/36/1428825436.db2.gz ABGGMZYSGYPWEL-UHFFFAOYSA-N 0 0 395.419 3.196 20 5 GGBDRN CC(C)(C)NS(=O)(=O)Cc1cccc(NCc2cccc([N+](=O)[O-])c2)c1 ZINC000123136968 1414651233 /nfs/dbraw/zinc/65/12/33/1414651233.db2.gz QEFIBBREMMDMJL-UHFFFAOYSA-N 0 0 377.466 3.425 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000123143669 1414652337 /nfs/dbraw/zinc/65/23/37/1414652337.db2.gz QJRPAJNTAQUTRR-ZBFHGGJFSA-N 0 0 390.415 3.138 20 5 GGBDRN CC[C@@H](C)Oc1ccc(NC(=O)C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000123143396 1414652400 /nfs/dbraw/zinc/65/24/00/1414652400.db2.gz ICGLQVQQTARRRY-CQSZACIVSA-N 0 0 397.431 3.296 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000123143872 1414652965 /nfs/dbraw/zinc/65/29/65/1414652965.db2.gz QJRPAJNTAQUTRR-HOCLYGCPSA-N 0 0 390.415 3.138 20 5 GGBDRN O=C(NCc1cn(-c2ccccc2)nn1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000123153177 1414655079 /nfs/dbraw/zinc/65/50/79/1414655079.db2.gz LOFUSSUFKNSZIL-UHFFFAOYSA-N 0 0 392.419 3.050 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](c1c(F)cccc1F)N(C)C ZINC000123162577 1414657886 /nfs/dbraw/zinc/65/78/86/1414657886.db2.gz JWSKKSPQPQRZLH-HNNXBMFYSA-N 0 0 394.378 3.306 20 5 GGBDRN COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2c2nnc(C)o2)cc1[N+](=O)[O-] ZINC000123170007 1414659355 /nfs/dbraw/zinc/65/93/55/1414659355.db2.gz IUYMCTGYYWPSOI-KRWDZBQOSA-N 0 0 394.387 3.235 20 5 GGBDRN CN(Cc1ccc([S@@](C)=O)cc1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000177662170 1428826077 /nfs/dbraw/zinc/82/60/77/1428826077.db2.gz UAFIBJPBMARBHA-HHHXNRCGSA-N 0 0 387.461 3.179 20 5 GGBDRN COc1ccc([C@H](CCO)NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000123191380 1414664493 /nfs/dbraw/zinc/66/44/93/1414664493.db2.gz ITVZPLPTQMUWIV-KRWDZBQOSA-N 0 0 378.812 3.039 20 5 GGBDRN CC(C)(C)c1ccc(CNC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000123207884 1414668243 /nfs/dbraw/zinc/66/82/43/1414668243.db2.gz WQHIFFPMHPJZPL-UHFFFAOYSA-N 0 0 383.404 3.117 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCC(OC2CCCCC2)CC1 ZINC000123243706 1414677186 /nfs/dbraw/zinc/67/71/86/1414677186.db2.gz BDKQZEWSQOWIRZ-UHFFFAOYSA-N 0 0 380.416 3.453 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000123258827 1414680197 /nfs/dbraw/zinc/68/01/97/1414680197.db2.gz XGENJWHJDAWMRY-BLLLJJGKSA-N 0 0 394.424 3.289 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccn(-c2ccccc2)n1 ZINC000123277975 1414685455 /nfs/dbraw/zinc/68/54/55/1414685455.db2.gz NETUQIGPGXGNEA-UHFFFAOYSA-N 0 0 380.360 3.194 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000123281937 1414686955 /nfs/dbraw/zinc/68/69/55/1414686955.db2.gz DUDZXCSUVDYVLH-HNNXBMFYSA-N 0 0 396.490 3.335 20 5 GGBDRN COc1ccc(OC)c(CCCNC(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000123289760 1414688531 /nfs/dbraw/zinc/68/85/31/1414688531.db2.gz DSLWMOGAOXQWFV-UHFFFAOYSA-N 0 0 387.436 3.087 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1 ZINC000123299174 1414691378 /nfs/dbraw/zinc/69/13/78/1414691378.db2.gz HATNFXXEZPUKJX-HHHXNRCGSA-N 0 0 390.465 3.162 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000123335800 1414698867 /nfs/dbraw/zinc/69/88/67/1414698867.db2.gz SLNVNJIVLOUYKR-UHFFFAOYSA-N 0 0 384.436 3.025 20 5 GGBDRN Cc1cc(OC[C@@H](O)Cn2cc([N+](=O)[O-])ccc2=O)c(C(C)C)cc1Cl ZINC000123342609 1414701074 /nfs/dbraw/zinc/70/10/74/1414701074.db2.gz HXLSUVYKEXPVTQ-AWEZNQCLSA-N 0 0 380.828 3.282 20 5 GGBDRN Cc1cc(=O)n(C[C@@H](O)COc2ccc(-c3ccccc3)cc2)cc1[N+](=O)[O-] ZINC000123363487 1414707272 /nfs/dbraw/zinc/70/72/72/1414707272.db2.gz KTYAHIJTHBCBRD-GOSISDBHSA-N 0 0 380.400 3.172 20 5 GGBDRN Cc1cc(=O)n(C[C@H](O)COc2ccc(-c3ccccc3)cc2)cc1[N+](=O)[O-] ZINC000123363282 1414707379 /nfs/dbraw/zinc/70/73/79/1414707379.db2.gz KTYAHIJTHBCBRD-SFHVURJKSA-N 0 0 380.400 3.172 20 5 GGBDRN O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000123371256 1414708563 /nfs/dbraw/zinc/70/85/63/1414708563.db2.gz CLIMMRGVMXPGHQ-LBPRGKRZSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCC(OC2CCCCC2)CC1 ZINC000123372251 1414709350 /nfs/dbraw/zinc/70/93/50/1414709350.db2.gz ZHLXUGTXMRWGAD-UHFFFAOYSA-N 0 0 399.451 3.129 20 5 GGBDRN Cc1cc(=O)n(C[C@H](O)COC(c2ccccc2)c2ccccc2)cc1[N+](=O)[O-] ZINC000123379763 1414711246 /nfs/dbraw/zinc/71/12/46/1414711246.db2.gz MESLMKRWPUSKKT-IBGZPJMESA-N 0 0 394.427 3.232 20 5 GGBDRN CC[C@H](C)NC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SCC(C)C ZINC000123384807 1414712508 /nfs/dbraw/zinc/71/25/08/1414712508.db2.gz BNOOYDQTKDIUKO-QWHCGFSZSA-N 0 0 381.498 3.376 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)n1 ZINC000177673713 1428830371 /nfs/dbraw/zinc/83/03/71/1428830371.db2.gz OBNRDYZLIHSICM-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000123430083 1414728204 /nfs/dbraw/zinc/72/82/04/1414728204.db2.gz NGCUHVNMHMWLOQ-ZDUSSCGKSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000123430344 1414729733 /nfs/dbraw/zinc/72/97/33/1414729733.db2.gz NGCUHVNMHMWLOQ-CYBMUJFWSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N(CCc1ccccc1)[C@H]1CCOC1 ZINC000123449050 1414735508 /nfs/dbraw/zinc/73/55/08/1414735508.db2.gz WSKFNFDDIYCDLA-IBGZPJMESA-N 0 0 393.443 3.479 20 5 GGBDRN Cc1c(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)cccc1[N+](=O)[O-] ZINC000123451347 1414735874 /nfs/dbraw/zinc/73/58/74/1414735874.db2.gz XHBIETDFBAIUGE-OAHLLOKOSA-N 0 0 379.457 3.111 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[C@H](c2ccccc2OC)C1 ZINC000123456230 1414737745 /nfs/dbraw/zinc/73/77/45/1414737745.db2.gz ZBZUSHDQNNPSIO-AWEZNQCLSA-N 0 0 385.420 3.311 20 5 GGBDRN COC(=O)CCCc1csc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000123465278 1414740549 /nfs/dbraw/zinc/74/05/49/1414740549.db2.gz FBPGYEFQPUATHW-UHFFFAOYSA-N 0 0 383.813 3.453 20 5 GGBDRN COC(=O)CCCc1csc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000123463202 1414740613 /nfs/dbraw/zinc/74/06/13/1414740613.db2.gz ASKSKBTXHWPSHV-UHFFFAOYSA-N 0 0 397.840 3.382 20 5 GGBDRN O=C(Nc1ccnn1C[C@@H]1CCOC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000123484002 1414748812 /nfs/dbraw/zinc/74/88/12/1414748812.db2.gz PXWJCWRKGXANHF-LBPRGKRZSA-N 0 0 399.432 3.204 20 5 GGBDRN O=C(NC[C@@H](O)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000123495024 1414751605 /nfs/dbraw/zinc/75/16/05/1414751605.db2.gz JASUBFMTYZKMGL-LJQANCHMSA-N 0 0 387.411 3.188 20 5 GGBDRN O=C(Nc1cccc(OC(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000123501575 1414754383 /nfs/dbraw/zinc/75/43/83/1414754383.db2.gz OMXRRUPDSFWACN-UHFFFAOYSA-N 0 0 385.710 3.427 20 5 GGBDRN O=C(NC[C@H]1[C@@H]2c3ccccc3C[C@H]12)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000123555665 1414773190 /nfs/dbraw/zinc/77/31/90/1414773190.db2.gz RGGXMWNHFZZITO-NJDAHSKKSA-N 0 0 392.459 3.012 20 5 GGBDRN COC(=O)CCCc1csc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)n1 ZINC000123572691 1414778790 /nfs/dbraw/zinc/77/87/90/1414778790.db2.gz RHKWCVBBNNMCAA-JXMROGBWSA-N 0 0 375.406 3.199 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000123578496 1414781118 /nfs/dbraw/zinc/78/11/18/1414781118.db2.gz DYRSIYTULGDYCE-QAPCUYQASA-N 0 0 388.395 3.471 20 5 GGBDRN C[C@H](OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000123629861 1414800944 /nfs/dbraw/zinc/80/09/44/1414800944.db2.gz BTVMVZIESSLLFX-NSHDSACASA-N 0 0 383.320 3.002 20 5 GGBDRN CCc1ccc(C(=O)Nc2nc(CCCC(=O)OC)cs2)cc1[N+](=O)[O-] ZINC000123634670 1414801199 /nfs/dbraw/zinc/80/11/99/1414801199.db2.gz XIPBVJJFWDFRBX-UHFFFAOYSA-N 0 0 377.422 3.362 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c(Cl)c1 ZINC000123649035 1414803499 /nfs/dbraw/zinc/80/34/99/1414803499.db2.gz QRLFKRMZYZQPKQ-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)Oc1cccc(Br)c1 ZINC000123647814 1414803530 /nfs/dbraw/zinc/80/35/30/1414803530.db2.gz XJPKUUNRICMJGO-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN CCn1c(SCCOC[C@@H]2CCCO2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123665447 1414805907 /nfs/dbraw/zinc/80/59/07/1414805907.db2.gz PJHLGCQNBQEGGM-HNNXBMFYSA-N 0 0 378.454 3.161 20 5 GGBDRN CC[NH+](CC)Cc1ccccc1C[N-]S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123682322 1414809034 /nfs/dbraw/zinc/80/90/34/1414809034.db2.gz HISVKQWGBPAPGR-UHFFFAOYSA-N 0 0 395.456 3.054 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC[C@@H]2[C@H](O)C(F)(F)F)ccc1Br ZINC000123683057 1414809413 /nfs/dbraw/zinc/80/94/13/1414809413.db2.gz VSGDFGOBOAIFLH-PWSUYJOCSA-N 0 0 383.164 3.245 20 5 GGBDRN CCn1c(S[C@H](C)C(=O)NC2CCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123691525 1414810657 /nfs/dbraw/zinc/81/06/57/1414810657.db2.gz JALRKRAHIWYPBF-GFCCVEGCSA-N 0 0 389.481 3.413 20 5 GGBDRN C[C@@H](C(=O)N(C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000123698969 1414811781 /nfs/dbraw/zinc/81/17/81/1414811781.db2.gz ZSQUXVAGIHGTKH-LLVKDONJSA-N 0 0 382.825 3.199 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccccn3)n2-c2ccccc2)c1 ZINC000123700076 1414811838 /nfs/dbraw/zinc/81/18/38/1414811838.db2.gz KHZCJCOSPUQWHF-UHFFFAOYSA-N 0 0 393.432 3.226 20 5 GGBDRN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000123723176 1414815701 /nfs/dbraw/zinc/81/57/01/1414815701.db2.gz AKYHRRRXBPGCEF-NSHDSACASA-N 0 0 389.795 3.376 20 5 GGBDRN COC(=O)Cc1ccc(OC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000123749606 1414819696 /nfs/dbraw/zinc/81/96/96/1414819696.db2.gz ITKLJQKWIXEABI-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)cc(F)cc1[N+](=O)[O-] ZINC000123762285 1414820877 /nfs/dbraw/zinc/82/08/77/1414820877.db2.gz DVFPHEBCYYGAAG-WMLDXEAASA-N 0 0 391.374 3.184 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123758296 1414820934 /nfs/dbraw/zinc/82/09/34/1414820934.db2.gz FQCLBLRUDUQRCR-UHFFFAOYSA-N 0 0 397.384 3.241 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCN(Cc2ccccc2)c2ccccc21 ZINC000123779012 1414823754 /nfs/dbraw/zinc/82/37/54/1414823754.db2.gz ZUXUJDUAIHDLBW-UHFFFAOYSA-N 0 0 391.431 3.385 20 5 GGBDRN C[C@H](c1ccco1)N(C)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000123786173 1414824414 /nfs/dbraw/zinc/82/44/14/1414824414.db2.gz SSUKYDHMNNBDDN-SECBINFHSA-N 0 0 389.227 3.332 20 5 GGBDRN C[C@@H](c1ccco1)N(C)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000123785949 1414824542 /nfs/dbraw/zinc/82/45/42/1414824542.db2.gz SSUKYDHMNNBDDN-VIFPVBQESA-N 0 0 389.227 3.332 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1c(C)cccc1C(=O)N1CCCC1 ZINC000123792140 1414825107 /nfs/dbraw/zinc/82/51/07/1414825107.db2.gz CCASYODPALJOEN-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[C@H](O)c2ccc(F)cc2)c1C ZINC000123819854 1414829338 /nfs/dbraw/zinc/82/93/38/1414829338.db2.gz GPHWKVYQDNSUOC-SJCJKPOMSA-N 0 0 396.440 3.141 20 5 GGBDRN Cc1noc(-c2ccccc2)c1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000123834685 1414832072 /nfs/dbraw/zinc/83/20/72/1414832072.db2.gz IBQZKGOBDLAAKG-UHFFFAOYSA-N 0 0 381.344 3.388 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[C@@H](O)c2ccc(F)cc2)cc1C ZINC000123845853 1414833670 /nfs/dbraw/zinc/83/36/70/1414833670.db2.gz HNTHZILSRGGZGP-CXAGYDPISA-N 0 0 396.440 3.141 20 5 GGBDRN O=C(NCc1ccc(NC(=O)c2cccnc2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000123857802 1414836235 /nfs/dbraw/zinc/83/62/35/1414836235.db2.gz MWSCMWHERSHFHN-UHFFFAOYSA-N 0 0 376.372 3.172 20 5 GGBDRN Cc1nc2cc(C(=O)OCCn3cc([N+](=O)[O-])cn3)ccc2n1-c1ccccc1 ZINC000177735847 1428845469 /nfs/dbraw/zinc/84/54/69/1428845469.db2.gz DRSFVAVSJZVLFM-UHFFFAOYSA-N 0 0 391.387 3.296 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccco1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000123863921 1414838051 /nfs/dbraw/zinc/83/80/51/1414838051.db2.gz SOGZERSIFMYOQH-TVQRCGJNSA-N 0 0 383.198 3.192 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OC[C@H](O)c2ccccc2)c1 ZINC000123864390 1414838082 /nfs/dbraw/zinc/83/80/82/1414838082.db2.gz UFMZWQHRRGQZBH-ZDUSSCGKSA-N 0 0 385.157 3.312 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(NC(=O)c2cccnc2)cc1 ZINC000123879783 1414841026 /nfs/dbraw/zinc/84/10/26/1414841026.db2.gz HQUCBFWNKOFFQV-UHFFFAOYSA-N 0 0 390.399 3.101 20 5 GGBDRN CC(=O)CCc1ccc(OC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1 ZINC000123881563 1414841858 /nfs/dbraw/zinc/84/18/58/1414841858.db2.gz IJDRDJZXJOPTLA-UHFFFAOYSA-N 0 0 394.387 3.225 20 5 GGBDRN O=C(Nc1ccc(CNC(=O)c2ccccc2[N+](=O)[O-])cc1)c1cccnc1 ZINC000123888126 1414843530 /nfs/dbraw/zinc/84/35/30/1414843530.db2.gz IMHNAXUWFNRXPK-UHFFFAOYSA-N 0 0 376.372 3.172 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](CC(=O)OCc2ccc([N+](=O)[O-])cc2)C1 ZINC000123892346 1414844645 /nfs/dbraw/zinc/84/46/45/1414844645.db2.gz XGCKSYBFXZZBTL-MRXNPFEDSA-N 0 0 377.441 3.106 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000123899472 1414845791 /nfs/dbraw/zinc/84/57/91/1414845791.db2.gz ADHUXKAFGHSZNP-UHFFFAOYSA-N 0 0 392.415 3.213 20 5 GGBDRN Cc1cccc(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)c1[N+](=O)[O-] ZINC000123919008 1414849518 /nfs/dbraw/zinc/84/95/18/1414849518.db2.gz YMGQRBCVQCSDDI-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN C[C@H](c1ccccc1Cl)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000123928383 1414851541 /nfs/dbraw/zinc/85/15/41/1414851541.db2.gz ROHWHGQLYOVEBL-LLVKDONJSA-N 0 0 389.795 3.376 20 5 GGBDRN COc1cc(C[NH2+]CCc2nc(-c3ccccn3)cs2)c([N+](=O)[O-])cc1O ZINC000123937385 1414853100 /nfs/dbraw/zinc/85/31/00/1414853100.db2.gz PVNZVNMLJKBHJX-UHFFFAOYSA-N 0 0 386.433 3.160 20 5 GGBDRN O=C(c1ccncc1F)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000123982335 1414862526 /nfs/dbraw/zinc/86/25/26/1414862526.db2.gz IACOJPPLWUJORA-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN Cc1nc2ccccc2n1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000123991919 1414864411 /nfs/dbraw/zinc/86/44/11/1414864411.db2.gz SBQWHAGHTKXEPW-UHFFFAOYSA-N 0 0 377.404 3.093 20 5 GGBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000124011270 1414868501 /nfs/dbraw/zinc/86/85/01/1414868501.db2.gz UGDHHQVDYNAZMH-ZDUSSCGKSA-N 0 0 383.383 3.077 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(C)cc3)C2)c([N+](=O)[O-])c1 ZINC000124025667 1414871476 /nfs/dbraw/zinc/87/14/76/1414871476.db2.gz SVKDFEWMFFVALH-INIZCTEOSA-N 0 0 397.431 3.403 20 5 GGBDRN Cc1nc(C)c(CCNS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)s1 ZINC000124023542 1414871626 /nfs/dbraw/zinc/87/16/26/1414871626.db2.gz OHOISNZJBXDZHB-UHFFFAOYSA-N 0 0 389.886 3.151 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N(Cc1ccco1)C[C@H]1CCCO1 ZINC000124028198 1414872028 /nfs/dbraw/zinc/87/20/28/1414872028.db2.gz BDNHZHLQOJJBQM-QGZVFWFLSA-N 0 0 383.404 3.419 20 5 GGBDRN O=C(NCCCN1CCCCCC1=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000124031624 1414872977 /nfs/dbraw/zinc/87/29/77/1414872977.db2.gz JVYCYAQKSXIOQC-UHFFFAOYSA-N 0 0 387.358 3.136 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)[C@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000124053679 1414877007 /nfs/dbraw/zinc/87/70/07/1414877007.db2.gz SELJPDBTSZWVSO-HNNXBMFYSA-N 0 0 395.506 3.254 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(c2cc(Cl)c(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC000124072495 1414880388 /nfs/dbraw/zinc/88/03/88/1414880388.db2.gz CCWOCGHTLWJVEL-LBPRGKRZSA-N 0 0 397.859 3.168 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000177731544 1428844591 /nfs/dbraw/zinc/84/45/91/1428844591.db2.gz CNTCJJVEIUXSBK-ASHKIFAZSA-N 0 0 389.477 3.272 20 5 GGBDRN C[C@H](c1cc(F)ccc1F)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000124093840 1414884179 /nfs/dbraw/zinc/88/41/79/1414884179.db2.gz CEGGNZOBDWFEMF-SNVBAGLBSA-N 0 0 391.330 3.001 20 5 GGBDRN CC1(O)CCN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CC1 ZINC000177734532 1428844921 /nfs/dbraw/zinc/84/49/21/1428844921.db2.gz NISBBMIXIHXEJS-UHFFFAOYSA-N 0 0 399.234 3.074 20 5 GGBDRN CCc1cccc2c(CCNS(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)c[nH]c21 ZINC000177734305 1428844938 /nfs/dbraw/zinc/84/49/38/1428844938.db2.gz GWTVQKAECVFQJI-UHFFFAOYSA-N 0 0 387.461 3.301 20 5 GGBDRN C[C@@H](NC(=O)C1CCCCC1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000124106835 1414886704 /nfs/dbraw/zinc/88/67/04/1414886704.db2.gz PFCFDXVSHDLORK-OAHLLOKOSA-N 0 0 375.469 3.119 20 5 GGBDRN CCOC(CN1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1)OCC ZINC000124109097 1414887189 /nfs/dbraw/zinc/88/71/89/1414887189.db2.gz ZBRHFEYBVMVDRY-UHFFFAOYSA-N 0 0 391.390 3.135 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000124119368 1414888751 /nfs/dbraw/zinc/88/87/51/1414888751.db2.gz YIWIMYGHHDGYJG-UHFFFAOYSA-N 0 0 383.364 3.132 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000124123804 1414889649 /nfs/dbraw/zinc/88/96/49/1414889649.db2.gz DATJLKYLUVJYSM-UHFFFAOYSA-N 0 0 381.344 3.458 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1 ZINC000124156273 1414897197 /nfs/dbraw/zinc/89/71/97/1414897197.db2.gz ARGZYIPSOSUXBK-OAHLLOKOSA-N 0 0 376.457 3.228 20 5 GGBDRN Cc1cccc2c(CCNS(=O)(=O)c3cccc(F)c3[N+](=O)[O-])c[nH]c21 ZINC000177736570 1428846028 /nfs/dbraw/zinc/84/60/28/1428846028.db2.gz UFEOREYTBZMVGG-UHFFFAOYSA-N 0 0 377.397 3.045 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCN(c2nccs2)CC1 ZINC000124162517 1414897662 /nfs/dbraw/zinc/89/76/62/1414897662.db2.gz JCJSAQABQJPPCQ-UHFFFAOYSA-N 0 0 386.355 3.033 20 5 GGBDRN Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cccc1C(N)=O ZINC000124176063 1414900539 /nfs/dbraw/zinc/90/05/39/1414900539.db2.gz JRNUAOQRBLIASI-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN CC(C)(NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCC1CCCCC1 ZINC000124179593 1414901504 /nfs/dbraw/zinc/90/15/04/1414901504.db2.gz JXRNUXFAMJAPIW-UHFFFAOYSA-N 0 0 381.860 3.453 20 5 GGBDRN C[C@@H](Sc1nnc(-c2ccncc2)o1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000124187058 1414903858 /nfs/dbraw/zinc/90/38/58/1414903858.db2.gz DATNHTGZOBCICG-SECBINFHSA-N 0 0 389.368 3.298 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCc2c(Cl)cccc2C1 ZINC000124194589 1414905800 /nfs/dbraw/zinc/90/58/00/1414905800.db2.gz JNNPYLSWCOUAGW-UHFFFAOYSA-N 0 0 383.791 3.288 20 5 GGBDRN Cc1ccc(-c2ncco2)cc1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000124203854 1414908035 /nfs/dbraw/zinc/90/80/35/1414908035.db2.gz SNQKFOBQTGLIAK-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(CN2CCCC2=O)cc1 ZINC000124203978 1414908064 /nfs/dbraw/zinc/90/80/64/1414908064.db2.gz QRBUMIPFHYLCCG-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN Cc1c(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cccc1C(=O)N1CCCC1 ZINC000124217280 1414911472 /nfs/dbraw/zinc/91/14/72/1414911472.db2.gz OLIWBHSJGAGTCI-UHFFFAOYSA-N 0 0 398.375 3.300 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000124235643 1414916180 /nfs/dbraw/zinc/91/61/80/1414916180.db2.gz PAFYIMCAKZGWRH-RAXLEYEMSA-N 0 0 397.431 3.494 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000124241678 1414917244 /nfs/dbraw/zinc/91/72/44/1414917244.db2.gz GXMIVXKAZGSBTM-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN O=C(COc1ccccc1Cc1ccccc1)OCCn1cc([N+](=O)[O-])cn1 ZINC000177742939 1428847742 /nfs/dbraw/zinc/84/77/42/1428847742.db2.gz HHQKMKOLUAPTDI-UHFFFAOYSA-N 0 0 381.388 3.004 20 5 GGBDRN CCC(CC)(CCO)CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000124258414 1414922889 /nfs/dbraw/zinc/92/28/89/1414922889.db2.gz SPGCRKDUTQMBSS-UHFFFAOYSA-N 0 0 378.878 3.024 20 5 GGBDRN O=C(CNc1ccccc1OCC(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000124261442 1414923610 /nfs/dbraw/zinc/92/36/10/1414923610.db2.gz HTIFOWIFWUICRT-UHFFFAOYSA-N 0 0 377.347 3.240 20 5 GGBDRN CCC(CC)(CCO)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000124296363 1414931994 /nfs/dbraw/zinc/93/19/94/1414931994.db2.gz NJLYGWUHQLZNEK-UHFFFAOYSA-N 0 0 398.403 3.081 20 5 GGBDRN CCOC(=O)CN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C1CCCC1 ZINC000177746986 1428848871 /nfs/dbraw/zinc/84/88/71/1428848871.db2.gz XMEKAZQDLKWERA-UHFFFAOYSA-N 0 0 375.425 3.117 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc2c(c1)N(C)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000124300757 1414933415 /nfs/dbraw/zinc/93/34/15/1414933415.db2.gz YAIFUQFZIQQBSE-ZDUSSCGKSA-N 0 0 375.450 3.017 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc2c(c1)N(C)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000124300970 1414933654 /nfs/dbraw/zinc/93/36/54/1414933654.db2.gz YAIFUQFZIQQBSE-CYBMUJFWSA-N 0 0 375.450 3.017 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000124339121 1414943472 /nfs/dbraw/zinc/94/34/72/1414943472.db2.gz CTGWCEAMOQWDQI-UHFFFAOYSA-N 0 0 391.449 3.236 20 5 GGBDRN COc1cc(S(=O)(=O)[N-]c2ccccc2N2CCCCC2)ccc1[N+](=O)[O-] ZINC000124377436 1414952165 /nfs/dbraw/zinc/95/21/65/1414952165.db2.gz YNMFAJXCYNTGRT-UHFFFAOYSA-N 0 0 391.449 3.395 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)Cc1ccc([N+](=O)[O-])cc1F ZINC000124381426 1414953568 /nfs/dbraw/zinc/95/35/68/1414953568.db2.gz QRWKMEJCZWFGNS-MRXNPFEDSA-N 0 0 386.301 3.497 20 5 GGBDRN CC(C)Oc1cccc(CN(C)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 ZINC000124388743 1414955676 /nfs/dbraw/zinc/95/56/76/1414955676.db2.gz NWXACBPMSCYCCQ-UHFFFAOYSA-N 0 0 383.404 3.068 20 5 GGBDRN CC(C)Oc1cccc(CN(C)Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)c1 ZINC000124392725 1414956693 /nfs/dbraw/zinc/95/66/93/1414956693.db2.gz CQVHSNZRBWMKPG-UHFFFAOYSA-N 0 0 398.419 3.288 20 5 GGBDRN Cc1sc(S(=O)(=O)N(CCO)[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000124400166 1414958876 /nfs/dbraw/zinc/95/88/76/1414958876.db2.gz LWWAPDIRARLODN-OAHLLOKOSA-N 0 0 396.490 3.025 20 5 GGBDRN CN(C[C@@H]1CCC[C@@H]1O)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000124414139 1414962322 /nfs/dbraw/zinc/96/23/22/1414962322.db2.gz WLBZLWXHDMTLGG-JXFKEZNVSA-N 0 0 383.448 3.440 20 5 GGBDRN CCN(Cc1ccccc1Cl)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000124448534 1414970880 /nfs/dbraw/zinc/97/08/80/1414970880.db2.gz RZOIUAMSMDDRPX-UHFFFAOYSA-N 0 0 389.795 3.205 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(Cn3ncc4ccc([N+](=O)[O-])cc43)CC2)c1 ZINC000124449198 1414971491 /nfs/dbraw/zinc/97/14/91/1414971491.db2.gz ULDMLKZVUWSCEZ-UHFFFAOYSA-N 0 0 393.447 3.059 20 5 GGBDRN CCc1c(C(=O)OCCn2cc([N+](=O)[O-])cn2)cnn1-c1cccc(Cl)c1 ZINC000177761374 1428852329 /nfs/dbraw/zinc/85/23/29/1428852329.db2.gz PZLGYLKYUXBLJZ-UHFFFAOYSA-N 0 0 389.799 3.050 20 5 GGBDRN CCc1cnc(CN(C)CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000177762478 1428852725 /nfs/dbraw/zinc/85/27/25/1428852725.db2.gz WWOPCFUADCXBRR-UHFFFAOYSA-N 0 0 378.454 3.083 20 5 GGBDRN CCOc1ccc(NC(=O)CNc2cc(F)c(OC)c(F)c2)c([N+](=O)[O-])c1 ZINC000124496011 1414981539 /nfs/dbraw/zinc/98/15/39/1414981539.db2.gz DDFWQXDLCAQKQF-UHFFFAOYSA-N 0 0 381.335 3.331 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CC[C@H](Oc2cccc(Cl)c2)C1 ZINC000124513437 1414984726 /nfs/dbraw/zinc/98/47/26/1414984726.db2.gz 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CCc1noc(CC)c1CNS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C ZINC000124583210 1414998965 /nfs/dbraw/zinc/99/89/65/1414998965.db2.gz RMHIFLGZFPNKJY-UHFFFAOYSA-N 0 0 387.845 3.148 20 5 GGBDRN Cc1ccc(OCc2ccc(C(=O)OCCn3cc([N+](=O)[O-])cn3)o2)c(C)c1 ZINC000177772204 1428854608 /nfs/dbraw/zinc/85/46/08/1428854608.db2.gz RFJDXKKNPVFTCC-UHFFFAOYSA-N 0 0 385.376 3.437 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCCc3cc(F)cc(F)c32)ccc1[N+](=O)[O-] ZINC000124616076 1415005937 /nfs/dbraw/zinc/00/59/37/1415005937.db2.gz QHNBFQHVTIRNDY-UHFFFAOYSA-N 0 0 384.360 3.023 20 5 GGBDRN O=C1NCCN(Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000124618593 1415006578 /nfs/dbraw/zinc/00/65/78/1415006578.db2.gz JSAHKPZEFOVKFR-MRXNPFEDSA-N 0 0 379.338 3.287 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000177773201 1428855108 /nfs/dbraw/zinc/85/51/08/1428855108.db2.gz GGZCPJSBLJABMI-UHFFFAOYSA-N 0 0 396.190 3.141 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1csc(-c2ccc(Cl)s2)n1 ZINC000177773402 1428855290 /nfs/dbraw/zinc/85/52/90/1428855290.db2.gz USJWYWYDAJUBMF-UHFFFAOYSA-N 0 0 384.826 3.487 20 5 GGBDRN Cc1c(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cccc1C(=O)N1CCSCC1 ZINC000124670575 1415017924 /nfs/dbraw/zinc/01/79/24/1415017924.db2.gz PRZDGYJRIQLPPI-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000124683323 1415020966 /nfs/dbraw/zinc/02/09/66/1415020966.db2.gz KCJHFMFWRALXSR-IAQYHMDHSA-N 0 0 398.872 3.025 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000124688500 1415022190 /nfs/dbraw/zinc/02/21/90/1415022190.db2.gz COMBDWOMXSIIKC-SFHVURJKSA-N 0 0 392.477 3.264 20 5 GGBDRN O=C(Cc1c[nH]c2ncccc12)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000124694063 1415023173 /nfs/dbraw/zinc/02/31/73/1415023173.db2.gz ORBZDQIMMNHKSO-UHFFFAOYSA-N 0 0 380.404 3.084 20 5 GGBDRN CCOC(=O)C1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1 ZINC000124703550 1415025460 /nfs/dbraw/zinc/02/54/60/1415025460.db2.gz 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CCc1nn(C)c(CC)c1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000124747450 1415035168 /nfs/dbraw/zinc/03/51/68/1415035168.db2.gz LZURVNUUGJYGRE-UHFFFAOYSA-N 0 0 385.468 3.327 20 5 GGBDRN C[C@H](O)C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000124750528 1415036283 /nfs/dbraw/zinc/03/62/83/1415036283.db2.gz PFIVYGRTZMRPOH-GXTWGEPZSA-N 0 0 398.868 3.081 20 5 GGBDRN O=C(CCCc1ccccn1)OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000124758304 1415038022 /nfs/dbraw/zinc/03/80/22/1415038022.db2.gz GFERBUCEZQUBFF-KRWDZBQOSA-N 0 0 397.431 3.161 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NCCc1ccc(Cl)nc1 ZINC000124765317 1415039082 /nfs/dbraw/zinc/03/90/82/1415039082.db2.gz UMJAQBCXQSIENM-UHFFFAOYSA-N 0 0 390.248 3.126 20 5 GGBDRN CC(C)C(=O)Nc1cccc(NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000124766099 1415039087 /nfs/dbraw/zinc/03/90/87/1415039087.db2.gz QQUSZAQZUKGLLS-UHFFFAOYSA-N 0 0 382.420 3.191 20 5 GGBDRN CCOC(=O)C1CCC(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC1 ZINC000124766367 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CC(=O)N(Cc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1)C1CC1 ZINC000124888219 1415067457 /nfs/dbraw/zinc/06/74/57/1415067457.db2.gz OZHFNMMSQXOWJK-UHFFFAOYSA-N 0 0 383.404 3.123 20 5 GGBDRN COc1ccc(N(C(C)C)S(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000124905633 1415070217 /nfs/dbraw/zinc/07/02/17/1415070217.db2.gz PVGWKWKSXMAFLN-UHFFFAOYSA-N 0 0 382.413 3.487 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2nccn2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000124914783 1415072075 /nfs/dbraw/zinc/07/20/75/1415072075.db2.gz IKHLMCRDNBFTDU-UHFFFAOYSA-N 0 0 385.445 3.263 20 5 GGBDRN CC(C)[NH+]1CCN(c2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3[O-])cc2)CC1 ZINC000124917637 1415072313 /nfs/dbraw/zinc/07/23/13/1415072313.db2.gz AUYYJZPCMHZFRU-UHFFFAOYSA-N 0 0 384.436 3.083 20 5 GGBDRN Cc1sc(S(=O)(=O)Oc2cc([N+](=O)[O-])ccc2Cl)cc1[N+](=O)[O-] ZINC000124924528 1415074038 /nfs/dbraw/zinc/07/40/38/1415074038.db2.gz QLCHYSJPCGQWEU-UHFFFAOYSA-N 0 0 378.771 3.294 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cccnc1OCC(F)F ZINC000124934222 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GTKRYONGEKKUIL-CYBMUJFWSA-N 0 0 392.818 3.465 20 5 GGBDRN C[C@H](CC(=O)c1cccs1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000124953276 1415080502 /nfs/dbraw/zinc/08/05/02/1415080502.db2.gz OGDIIFLCMIPVBZ-GFCCVEGCSA-N 0 0 384.417 3.233 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cccc(NC(=O)[C@@H]2CCCO2)c1 ZINC000124962534 1415081843 /nfs/dbraw/zinc/08/18/43/1415081843.db2.gz HLHZOAATHSHLAO-INIZCTEOSA-N 0 0 391.330 3.243 20 5 GGBDRN CCC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000124971934 1415083970 /nfs/dbraw/zinc/08/39/70/1415083970.db2.gz PGXPHIDQXYWEHM-GFCCVEGCSA-N 0 0 395.437 3.048 20 5 GGBDRN O=C(CCc1ccccc1)N1CCC(C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])CC1 ZINC000124972046 1415084203 /nfs/dbraw/zinc/08/42/03/1415084203.db2.gz ODFFLHKZGFGWPO-UHFFFAOYSA-N 0 0 397.431 3.110 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccnc(OCC(F)F)c1 ZINC000124993614 1415088210 /nfs/dbraw/zinc/08/82/10/1415088210.db2.gz FUUKNVBPBJHFKN-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN CN(C)C(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000125007047 1415090826 /nfs/dbraw/zinc/09/08/26/1415090826.db2.gz XUXRZBNJDAUNOA-UHFFFAOYSA-N 0 0 395.337 3.245 20 5 GGBDRN CCCCC(=O)N1CSC[C@@H]1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177836321 1428868939 /nfs/dbraw/zinc/86/89/39/1428868939.db2.gz FHEUSUXIOVXZTN-XJKSGUPXSA-N 0 0 379.482 3.172 20 5 GGBDRN NC(=O)c1ccc(CN2CCC(Oc3ccc(F)cc3F)CC2)c([N+](=O)[O-])c1 ZINC000125057002 1415100639 /nfs/dbraw/zinc/10/06/39/1415100639.db2.gz RXGBUNNYLTVNJK-UHFFFAOYSA-N 0 0 391.374 3.015 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000125074801 1415104064 /nfs/dbraw/zinc/10/40/64/1415104064.db2.gz LOZLQPIVRATOKV-NOZJJQNGSA-N 0 0 383.198 3.192 20 5 GGBDRN CCCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1C[C@H](OCC)C12CCCCC2 ZINC000125123112 1415114279 /nfs/dbraw/zinc/11/42/79/1415114279.db2.gz GHDWQRCNHPCWAM-HOTGVXAUSA-N 0 0 378.473 3.308 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000177829652 1428867104 /nfs/dbraw/zinc/86/71/04/1428867104.db2.gz BNVLLGLQELZXMF-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN CC(C)CCC[C@@H](C)NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125138203 1415117105 /nfs/dbraw/zinc/11/71/05/1415117105.db2.gz FJQGQMUPPPTJPJ-MRXNPFEDSA-N 0 0 390.484 3.277 20 5 GGBDRN CC(C)CCC[C@H](C)NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125138468 1415117227 /nfs/dbraw/zinc/11/72/27/1415117227.db2.gz FJQGQMUPPPTJPJ-INIZCTEOSA-N 0 0 390.484 3.277 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)CCC2 ZINC000125144326 1415118256 /nfs/dbraw/zinc/11/82/56/1415118256.db2.gz OCMCWBRVKFSOMK-AWEZNQCLSA-N 0 0 388.449 3.088 20 5 GGBDRN COc1nn(C)c2nc(C)c(CCC(=O)Oc3cc([N+](=O)[O-])ccc3C)c(C)c12 ZINC000125156497 1415120821 /nfs/dbraw/zinc/12/08/21/1415120821.db2.gz SGZDJYYJYMHCHA-UHFFFAOYSA-N 0 0 398.419 3.349 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CNC(=O)c1ccc2c(c1)CCC2 ZINC000125182310 1415125531 /nfs/dbraw/zinc/12/55/31/1415125531.db2.gz CJAWAWHHDYVDMF-UHFFFAOYSA-N 0 0 395.459 3.251 20 5 GGBDRN CC(C)C[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000125183418 1415126101 /nfs/dbraw/zinc/12/61/01/1415126101.db2.gz CMSAVSFORNRLQP-HNNXBMFYSA-N 0 0 377.828 3.314 20 5 GGBDRN COC(=O)c1ccc(CN(C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000125190291 1415127015 /nfs/dbraw/zinc/12/70/15/1415127015.db2.gz FQJPFINQEMXXEG-CQSZACIVSA-N 0 0 385.420 3.149 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc1[N+](=O)[O-] ZINC000177833669 1428868220 /nfs/dbraw/zinc/86/82/20/1428868220.db2.gz QADASWZDNWPMQT-LLVKDONJSA-N 0 0 398.387 3.391 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000177833007 1428868295 /nfs/dbraw/zinc/86/82/95/1428868295.db2.gz ZYSJRVVQHDXVHD-ZFWWWQNUSA-N 0 0 377.441 3.480 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1[N+](=O)[O-] ZINC000177836857 1428869079 /nfs/dbraw/zinc/86/90/79/1428869079.db2.gz IWCALQQXKHUKFV-NSHDSACASA-N 0 0 396.359 3.144 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)Oc1ccc(Br)nc1 ZINC000125209346 1415131096 /nfs/dbraw/zinc/13/10/96/1415131096.db2.gz IQZMFTYLIBQMPM-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN Cc1cc(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)c(N)c([N+](=O)[O-])c1 ZINC000125214130 1415131999 /nfs/dbraw/zinc/13/19/99/1415131999.db2.gz CTQSBWGYTFEFCL-LBPRGKRZSA-N 0 0 381.392 3.069 20 5 GGBDRN O=C(NCc1nncn1-c1ccccc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125214499 1415132027 /nfs/dbraw/zinc/13/20/27/1415132027.db2.gz IBTCKXHKRKPMOC-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1[N+](=O)[O-] ZINC000177836843 1428869046 /nfs/dbraw/zinc/86/90/46/1428869046.db2.gz IWCALQQXKHUKFV-LLVKDONJSA-N 0 0 396.359 3.144 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000177836066 1428869058 /nfs/dbraw/zinc/86/90/58/1428869058.db2.gz MCBANKLHSKYOHS-CRAIPNDOSA-N 0 0 396.447 3.028 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(C)c(S(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000177835436 1428868749 /nfs/dbraw/zinc/86/87/49/1428868749.db2.gz XAJNDCJPKDBMCJ-CYBMUJFWSA-N 0 0 376.434 3.106 20 5 GGBDRN COc1cc(Cl)c(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000125265590 1415146535 /nfs/dbraw/zinc/14/65/35/1415146535.db2.gz OXASLJUIUOIBEO-UHFFFAOYSA-N 0 0 379.800 3.107 20 5 GGBDRN Cc1nnc(-c2ccccc2C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])o1 ZINC000125298843 1415156480 /nfs/dbraw/zinc/15/64/80/1415156480.db2.gz HWQCZMNEKQOSTJ-UHFFFAOYSA-N 0 0 395.419 3.494 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000125298511 1415156737 /nfs/dbraw/zinc/15/67/37/1415156737.db2.gz LSLHGPXBAHUXQH-GFCCVEGCSA-N 0 0 391.449 3.232 20 5 GGBDRN Cc1cccc2c1N(S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1)CC2 ZINC000177844293 1428870799 /nfs/dbraw/zinc/87/07/99/1428870799.db2.gz RZPPDDLVEPFTQO-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN Cc1cccc(Oc2cc(CNC(=O)c3c([N+](=O)[O-])cnn3C)ccn2)c1C ZINC000125340129 1415168494 /nfs/dbraw/zinc/16/84/94/1415168494.db2.gz WSPZWALXNNPHSX-UHFFFAOYSA-N 0 0 381.392 3.062 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000177847531 1428871629 /nfs/dbraw/zinc/87/16/29/1428871629.db2.gz CLRJCOGCXUAOPM-DOTOQJQBSA-N 0 0 390.484 3.158 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000177847437 1428871707 /nfs/dbraw/zinc/87/17/07/1428871707.db2.gz DWXIKCIIZSGXKL-LLVKDONJSA-N 0 0 390.465 3.374 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OCC1CCN(CC(F)(F)F)CC1 ZINC000125367312 1415178261 /nfs/dbraw/zinc/17/82/61/1415178261.db2.gz NTVWCKMOZVSIGL-UHFFFAOYSA-N 0 0 399.369 3.436 20 5 GGBDRN CCCNC(=O)C1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000125390166 1415184900 /nfs/dbraw/zinc/18/49/00/1415184900.db2.gz BDIHLAYGWNUFCV-UHFFFAOYSA-N 0 0 388.493 3.457 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000125416499 1415191510 /nfs/dbraw/zinc/19/15/10/1415191510.db2.gz VQHRVFWRHSEGLJ-ZDUSSCGKSA-N 0 0 391.449 3.065 20 5 GGBDRN O=C(CCCOc1ccccc1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125421225 1415193626 /nfs/dbraw/zinc/19/36/26/1415193626.db2.gz FASFEKRXLMHVBB-AWEZNQCLSA-N 0 0 388.399 3.001 20 5 GGBDRN O=C(c1ccc(OCC2CC2)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125421706 1415193672 /nfs/dbraw/zinc/19/36/72/1415193672.db2.gz HCYWNUQVLFUQSC-INIZCTEOSA-N 0 0 382.420 3.105 20 5 GGBDRN Cc1c(OC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)cccc1[N+](=O)[O-] ZINC000125427447 1415194832 /nfs/dbraw/zinc/19/48/32/1415194832.db2.gz VALJOHHZHRVQCF-HNNXBMFYSA-N 0 0 377.441 3.276 20 5 GGBDRN CCOc1cc(C(=O)NCc2nc(C3CC3)cs2)c([N+](=O)[O-])cc1OC ZINC000125442487 1415199746 /nfs/dbraw/zinc/19/97/46/1415199746.db2.gz QGDCIGCBXAHHCW-UHFFFAOYSA-N 0 0 377.422 3.266 20 5 GGBDRN O=C(c1cc2ccccc2cc1O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125447951 1415201121 /nfs/dbraw/zinc/20/11/21/1415201121.db2.gz QTXVMYQGGCUAGU-OAHLLOKOSA-N 0 0 378.388 3.175 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCCc2ccc3[nH]c(=O)[nH]c3c2)cc1[N+](=O)[O-] ZINC000177857313 1428874473 /nfs/dbraw/zinc/87/44/73/1428874473.db2.gz BUISPNJNCFNXDT-ZDUSSCGKSA-N 0 0 382.420 3.273 20 5 GGBDRN Cc1cccc(C(C)(C)NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000125457133 1415204745 /nfs/dbraw/zinc/20/47/45/1415204745.db2.gz ZQVQJJRKPRGXIB-UHFFFAOYSA-N 0 0 387.461 3.146 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000125460712 1415205165 /nfs/dbraw/zinc/20/51/65/1415205165.db2.gz RHFGWRRAAMSHAX-LZQZEXGQSA-N 0 0 385.464 3.273 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000125460278 1415205475 /nfs/dbraw/zinc/20/54/75/1415205475.db2.gz RHFGWRRAAMSHAX-IPELMVKDSA-N 0 0 385.464 3.273 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC(C(=O)N2CCCC2)CC1 ZINC000125472338 1415209684 /nfs/dbraw/zinc/20/96/84/1415209684.db2.gz PJSZQAUIGNFXHL-UHFFFAOYSA-N 0 0 399.369 3.088 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)cc1[N+](=O)[O-] ZINC000177862683 1428876443 /nfs/dbraw/zinc/87/64/43/1428876443.db2.gz HZMFKAKCYWAADD-IUODEOHRSA-N 0 0 379.482 3.028 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1noc(-c2ccccc2)n1 ZINC000125482532 1415211932 /nfs/dbraw/zinc/21/19/32/1415211932.db2.gz RIUZIBSNVVUMFK-SNVBAGLBSA-N 0 0 383.320 3.044 20 5 GGBDRN Cc1cccc2c1N(C(=O)CCCn1c(=O)oc3cc([N+](=O)[O-])ccc31)CC2 ZINC000125486422 1415212280 /nfs/dbraw/zinc/21/22/80/1415212280.db2.gz JFFYJXMRWYFBAI-UHFFFAOYSA-N 0 0 381.388 3.181 20 5 GGBDRN Cc1c(C(=O)Nc2nc(C(C)(C)C)cs2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000125493203 1415213773 /nfs/dbraw/zinc/21/37/73/1415213773.db2.gz KBVCNWXJXJLWDE-UHFFFAOYSA-N 0 0 386.437 3.490 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1csc([N+](=O)[O-])c1 ZINC000177867782 1428877709 /nfs/dbraw/zinc/87/77/09/1428877709.db2.gz KRBYWKUICTWHOL-ZDUSSCGKSA-N 0 0 388.323 3.060 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)Cc1ccc(F)cc1 ZINC000125507917 1415216765 /nfs/dbraw/zinc/21/67/65/1415216765.db2.gz FUEVXFDVZSTJST-UHFFFAOYSA-N 0 0 390.186 3.405 20 5 GGBDRN Cc1ccc(S(=O)(=O)Oc2c(Br)cccc2[N+](=O)[O-])s1 ZINC000125508088 1415216795 /nfs/dbraw/zinc/21/67/95/1415216795.db2.gz QQGCDLQANXFVEZ-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1ccc(F)cc1F ZINC000125509941 1415216835 /nfs/dbraw/zinc/21/68/35/1415216835.db2.gz UOWJSHXFNDLNLN-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCc2c(C)nc3cc(=O)[nH]n3c2C)cc1[N+](=O)[O-] ZINC000177868175 1428878181 /nfs/dbraw/zinc/87/81/81/1428878181.db2.gz AFZZWUHEMGXLAU-GFCCVEGCSA-N 0 0 397.435 3.078 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000125518144 1415218921 /nfs/dbraw/zinc/21/89/21/1415218921.db2.gz ZSXRJPDIGOIZHK-GFCCVEGCSA-N 0 0 382.376 3.187 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1cccc(F)c1 ZINC000125520360 1415219546 /nfs/dbraw/zinc/21/95/46/1415219546.db2.gz MZDATDVNPAONHP-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)Cc2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000125525203 1415220485 /nfs/dbraw/zinc/22/04/85/1415220485.db2.gz KXAMOYAONFJVCY-UHFFFAOYSA-N 0 0 397.884 3.443 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(N3C(=O)CCC3=O)c2)cc1[N+](=O)[O-] ZINC000177839204 1428869869 /nfs/dbraw/zinc/86/98/69/1428869869.db2.gz VVMNAKCDACFJPH-ZDUSSCGKSA-N 0 0 381.388 3.048 20 5 GGBDRN Cc1ccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1NS(C)(=O)=O ZINC000177839670 1428869914 /nfs/dbraw/zinc/86/99/14/1428869914.db2.gz NRMVCIQIYUTYAX-CYBMUJFWSA-N 0 0 391.449 3.074 20 5 GGBDRN CC[C@H]1CN(Cc2cc(OC)c(OCC(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000125558812 1415226513 /nfs/dbraw/zinc/22/65/13/1415226513.db2.gz NWTZAJUYGJTQPR-LBPRGKRZSA-N 0 0 378.347 3.155 20 5 GGBDRN CCS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177841583 1428870248 /nfs/dbraw/zinc/87/02/48/1428870248.db2.gz CLSAJHVIFMEVAB-CYBMUJFWSA-N 0 0 376.434 3.188 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)cc1[N+](=O)[O-] ZINC000177842626 1428870259 /nfs/dbraw/zinc/87/02/59/1428870259.db2.gz WNADIIGQMNBXNK-PXNSSMCTSA-N 0 0 397.475 3.372 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)cc1[N+](=O)[O-] ZINC000177842603 1428870325 /nfs/dbraw/zinc/87/03/25/1428870325.db2.gz WNADIIGQMNBXNK-FXAWDEMLSA-N 0 0 397.475 3.372 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)cc1[N+](=O)[O-] ZINC000177842591 1428870405 /nfs/dbraw/zinc/87/04/05/1428870405.db2.gz WNADIIGQMNBXNK-YLJYHZDGSA-N 0 0 397.475 3.372 20 5 GGBDRN Cc1cnn(-c2ccc(NC(=O)COc3ccc([N+](=O)[O-])c(F)c3)cc2F)c1 ZINC000125565780 1415227894 /nfs/dbraw/zinc/22/78/94/1415227894.db2.gz KXZMFUMNHHJZKW-UHFFFAOYSA-N 0 0 388.330 3.385 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCc2nc(-c3ccccn3)no2)cc1[N+](=O)[O-] ZINC000177874135 1428879142 /nfs/dbraw/zinc/87/91/42/1428879142.db2.gz OARUJFVYAAESQZ-CYBMUJFWSA-N 0 0 381.392 3.158 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-] ZINC000177873369 1428879169 /nfs/dbraw/zinc/87/91/69/1428879169.db2.gz NHQMTTPCDZJOOU-ZDUSSCGKSA-N 0 0 396.378 3.079 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NCc2ccccc2[N+](=O)[O-])c1 ZINC000125573383 1415229222 /nfs/dbraw/zinc/22/92/22/1415229222.db2.gz WTFFVLHCZKRUBE-CQSZACIVSA-N 0 0 377.466 3.425 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000177874536 1428879318 /nfs/dbraw/zinc/87/93/18/1428879318.db2.gz JBKJZCPTRBCSIJ-ZBFHGGJFSA-N 0 0 385.420 3.368 20 5 GGBDRN Cc1c(CSC(C)C)cccc1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000125587068 1415232692 /nfs/dbraw/zinc/23/26/92/1415232692.db2.gz QUSIBPQVWHWKPL-UHFFFAOYSA-N 0 0 375.450 3.345 20 5 GGBDRN O=[N+]([O-])c1ccc[nH]c1=NNS(=O)(=O)c1cc2cc(Cl)ccc2s1 ZINC000125591761 1415233637 /nfs/dbraw/zinc/23/36/37/1415233637.db2.gz IBKWPSWIBZKWLE-UHFFFAOYSA-N 0 0 384.826 3.163 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000177876036 1428880009 /nfs/dbraw/zinc/88/00/09/1428880009.db2.gz VEMBYQHUYLSWCD-UTKZUKDTSA-N 0 0 396.491 3.069 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000177876021 1428880149 /nfs/dbraw/zinc/88/01/49/1428880149.db2.gz VEMBYQHUYLSWCD-LAUBAEHRSA-N 0 0 396.491 3.069 20 5 GGBDRN C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)c1cccc([N+](=O)[O-])c1[O-] ZINC000125624975 1415240380 /nfs/dbraw/zinc/24/03/80/1415240380.db2.gz TVLLWRCBDQZPSW-UHFFFAOYSA-N 0 0 377.828 3.158 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nnc(-c2ccccc2)s1 ZINC000125631079 1415241596 /nfs/dbraw/zinc/24/15/96/1415241596.db2.gz FRZBHDHQRHDKMW-UHFFFAOYSA-N 0 0 380.227 3.429 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccc(F)cc1F ZINC000125639024 1415243794 /nfs/dbraw/zinc/24/37/94/1415243794.db2.gz KCECLLPLVTVXDZ-INIZCTEOSA-N 0 0 398.387 3.158 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1nc(C(F)(F)F)cs1 ZINC000125641509 1415244162 /nfs/dbraw/zinc/24/41/62/1415244162.db2.gz KIFYGDWUBNDXNY-UHFFFAOYSA-N 0 0 390.343 3.078 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NCc2cccc([N+](=O)[O-])c2)c1 ZINC000125641609 1415244239 /nfs/dbraw/zinc/24/42/39/1415244239.db2.gz VMLGWAVJMCUDJK-AWEZNQCLSA-N 0 0 377.466 3.425 20 5 GGBDRN C[C@H](OC1CCCCCC1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125649714 1415246414 /nfs/dbraw/zinc/24/64/14/1415246414.db2.gz ZBICGGPPLGQDTM-GJZGRUSLSA-N 0 0 376.457 3.131 20 5 GGBDRN CC[C@H](OC1CCCCC1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125661542 1415248525 /nfs/dbraw/zinc/24/85/25/1415248525.db2.gz PQHGWBXYUVODEN-YOEHRIQHSA-N 0 0 376.457 3.131 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2C)c1[N+](=O)[O-] ZINC000125664345 1415248976 /nfs/dbraw/zinc/24/89/76/1415248976.db2.gz DZQFAZIAEODABO-ZDUSSCGKSA-N 0 0 399.451 3.212 20 5 GGBDRN CCCCN(CC)C(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1Br ZINC000125717535 1415260839 /nfs/dbraw/zinc/26/08/39/1415260839.db2.gz KAAXTPPYYTXIDL-UHFFFAOYSA-N 0 0 386.246 3.253 20 5 GGBDRN O=C(NCc1cccc(Cn2cccn2)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000125716990 1415261227 /nfs/dbraw/zinc/26/12/27/1415261227.db2.gz DLYXFXSTFCQRBX-UHFFFAOYSA-N 0 0 387.399 3.318 20 5 GGBDRN Cc1cccc([C@H]2CCCN2C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1 ZINC000177892219 1428885317 /nfs/dbraw/zinc/88/53/17/1428885317.db2.gz NCHMCEFKPAWZPQ-QGZVFWFLSA-N 0 0 377.404 3.461 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000125729642 1415264016 /nfs/dbraw/zinc/26/40/16/1415264016.db2.gz WCOGCTOSHNEKAI-ZFWWWQNUSA-N 0 0 396.490 3.411 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1csc(-c2ccc3c(c2)OCO3)n1 ZINC000125735264 1415265841 /nfs/dbraw/zinc/26/58/41/1415265841.db2.gz KYJWDKKZRMZWQE-UHFFFAOYSA-N 0 0 397.368 3.403 20 5 GGBDRN COC(=O)[C@H]1C[C@@H](OC)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000125740646 1415267751 /nfs/dbraw/zinc/26/77/51/1415267751.db2.gz OVSVSUCSAFJBDQ-GDBMZVCRSA-N 0 0 376.434 3.086 20 5 GGBDRN CC(C)(NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000125740939 1415267865 /nfs/dbraw/zinc/26/78/65/1415267865.db2.gz LFUGCDJJTNGAQC-UHFFFAOYSA-N 0 0 385.811 3.494 20 5 GGBDRN COC(=O)CN(Cc1ccc(Cl)cc1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000125758405 1415272196 /nfs/dbraw/zinc/27/21/96/1415272196.db2.gz SXCRIHIPWVBTOO-UHFFFAOYSA-N 0 0 390.823 3.383 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000125770245 1415276041 /nfs/dbraw/zinc/27/60/41/1415276041.db2.gz OPEMWDDWXNZDTK-OAHLLOKOSA-N 0 0 387.346 3.335 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000125786767 1415280333 /nfs/dbraw/zinc/28/03/33/1415280333.db2.gz VATOVZRQWNUZQH-DNVCBOLYSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000125786189 1415280530 /nfs/dbraw/zinc/28/05/30/1415280530.db2.gz VATOVZRQWNUZQH-KXBFYZLASA-N 0 0 397.431 3.126 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccccc1N1CCCC1=O ZINC000125790454 1415281474 /nfs/dbraw/zinc/28/14/74/1415281474.db2.gz UJJBNFUDJIOCIN-UHFFFAOYSA-N 0 0 378.388 3.384 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN(Cc3ccco3)C[C@H]3CCCO3)o2)cc1 ZINC000125793065 1415282147 /nfs/dbraw/zinc/28/21/47/1415282147.db2.gz ZWVPGQZOAZTZMA-QGZVFWFLSA-N 0 0 384.392 3.419 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN(Cc3ccco3)C[C@@H]3CCCO3)o2)cc1 ZINC000125792825 1415282298 /nfs/dbraw/zinc/28/22/98/1415282298.db2.gz ZWVPGQZOAZTZMA-KRWDZBQOSA-N 0 0 384.392 3.419 20 5 GGBDRN CC(=O)Nc1ccc(S[C@@H](C)C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000125799478 1415284432 /nfs/dbraw/zinc/28/44/32/1415284432.db2.gz HXODTNCRPQGKBV-ZDUSSCGKSA-N 0 0 387.461 3.393 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@@H]2C[C@@H](O)c2cccs2)cc1 ZINC000125814116 1415288144 /nfs/dbraw/zinc/28/81/44/1415288144.db2.gz PNBNUWYWJVTRGW-HZPDHXFCSA-N 0 0 396.490 3.074 20 5 GGBDRN Cc1cccc2c1CCN2C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000125821418 1415289891 /nfs/dbraw/zinc/28/98/91/1415289891.db2.gz WKQCBFQWBBSARB-UHFFFAOYSA-N 0 0 395.444 3.386 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000125831248 1415292337 /nfs/dbraw/zinc/29/23/37/1415292337.db2.gz XIPWSMLXXPNNFI-HNNXBMFYSA-N 0 0 386.427 3.192 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N(CCO)Cc1ccccc1 ZINC000125830740 1415292387 /nfs/dbraw/zinc/29/23/87/1415292387.db2.gz QNELHDBYHFZIAH-UHFFFAOYSA-N 0 0 381.335 3.223 20 5 GGBDRN Cc1c(CC(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)cccc1[N+](=O)[O-] ZINC000125845403 1415295844 /nfs/dbraw/zinc/29/58/44/1415295844.db2.gz PMTVJNUGEKFKJW-ZDUSSCGKSA-N 0 0 380.404 3.416 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC(OC2CCCCC2)CC1 ZINC000125855730 1415297990 /nfs/dbraw/zinc/29/79/90/1415297990.db2.gz RDBCYWRIPJNVMU-UHFFFAOYSA-N 0 0 382.482 3.406 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1 ZINC000125855497 1415298113 /nfs/dbraw/zinc/29/81/13/1415298113.db2.gz QJMNBMRYFDBQQM-QGZVFWFLSA-N 0 0 396.447 3.198 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000125864384 1415300310 /nfs/dbraw/zinc/30/03/10/1415300310.db2.gz WZZYZFDSZDCZSH-CYBMUJFWSA-N 0 0 381.404 3.172 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000125868617 1415301198 /nfs/dbraw/zinc/30/11/98/1415301198.db2.gz NFJXCOVIZPAHDF-BDJLRTHQSA-N 0 0 392.843 3.255 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000125889514 1415305291 /nfs/dbraw/zinc/30/52/91/1415305291.db2.gz RQROCYKSGPKKNL-DNVCBOLYSA-N 0 0 383.452 3.115 20 5 GGBDRN CN(C)c1ccc(C(=O)c2ccccc2C(=O)NC2CC=CC2)cc1[N+](=O)[O-] ZINC000125889369 1415305391 /nfs/dbraw/zinc/30/53/91/1415305391.db2.gz COAHDGUKHVCGJL-UHFFFAOYSA-N 0 0 379.416 3.340 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C1CCN(c2nc3ccccc3o2)CC1 ZINC000125888151 1415305507 /nfs/dbraw/zinc/30/55/07/1415305507.db2.gz FMMXRPPTGJQFHD-UHFFFAOYSA-N 0 0 380.404 3.269 20 5 GGBDRN COC(=O)c1ccc(OC[C@H](O)c2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000125897566 1415307034 /nfs/dbraw/zinc/30/70/34/1415307034.db2.gz MLDVSWFRDAPMCF-AWEZNQCLSA-N 0 0 396.193 3.256 20 5 GGBDRN Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCCN1CCn1ccc([N+](=O)[O-])n1 ZINC000125898886 1415307813 /nfs/dbraw/zinc/30/78/13/1415307813.db2.gz DUDGRVCKYWTOII-AWEZNQCLSA-N 0 0 380.880 3.443 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCN(Cc2ccccc2)c2ccccc21 ZINC000125907300 1415309359 /nfs/dbraw/zinc/30/93/59/1415309359.db2.gz KKHTTWKGFCBACX-UHFFFAOYSA-N 0 0 391.431 3.235 20 5 GGBDRN CC(C)[C@H]1OCCC[C@@H]1CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000177947627 1428898282 /nfs/dbraw/zinc/89/82/82/1428898282.db2.gz YGOVNANCYVYOFN-YLJYHZDGSA-N 0 0 389.496 3.379 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)n1nc(-c2cccs2)oc1=O ZINC000177947818 1428898328 /nfs/dbraw/zinc/89/83/28/1428898328.db2.gz YASJWPXSAGXIAV-MRVPVSSYSA-N 0 0 394.796 3.326 20 5 GGBDRN CCOc1cn(-c2ccccc2)nc1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125924292 1415314346 /nfs/dbraw/zinc/31/43/46/1415314346.db2.gz RIELSTSNQFYSRY-UHFFFAOYSA-N 0 0 380.404 3.152 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1cnc(-c2ccc3c(c2)OCO3)s1 ZINC000125924032 1415314498 /nfs/dbraw/zinc/31/44/98/1415314498.db2.gz HMRUPNOITHWQBT-UHFFFAOYSA-N 0 0 397.412 3.420 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)NCC(=O)c3cccs3)cc2)c(C)c1[N+](=O)[O-] ZINC000125931626 1415316005 /nfs/dbraw/zinc/31/60/05/1415316005.db2.gz SGLIYBVNQITZHA-UHFFFAOYSA-N 0 0 398.444 3.131 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(Cl)cc1)NCCc1cccc([N+](=O)[O-])c1 ZINC000125932995 1415316252 /nfs/dbraw/zinc/31/62/52/1415316252.db2.gz ABDNGNGDLDTHRI-UHFFFAOYSA-N 0 0 389.839 3.117 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC2CCN(c3ccccc3)CC2)c1 ZINC000125952172 1415321094 /nfs/dbraw/zinc/32/10/94/1415321094.db2.gz CYOUWQQXLCSMNQ-UHFFFAOYSA-N 0 0 383.448 3.457 20 5 GGBDRN CC(=O)NC[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000177968319 1428906864 /nfs/dbraw/zinc/90/68/64/1428906864.db2.gz BAQXRWNWSUWROI-HXUWFJFHSA-N 0 0 397.431 3.229 20 5 GGBDRN C[C@H](O)c1ccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000177957685 1428900327 /nfs/dbraw/zinc/90/03/27/1428900327.db2.gz DABJCKRJILJREE-LBPRGKRZSA-N 0 0 378.812 3.387 20 5 GGBDRN CC(C)=CC(=O)NCc1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000125955101 1415321664 /nfs/dbraw/zinc/32/16/64/1415321664.db2.gz XQOOQUYFPAPCST-UHFFFAOYSA-N 0 0 381.432 3.150 20 5 GGBDRN Cn1c2ccccc2nc1[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000125958300 1415322348 /nfs/dbraw/zinc/32/23/48/1415322348.db2.gz KPYJBGJAZNWZDN-LJQANCHMSA-N 0 0 376.420 3.057 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125961289 1415323075 /nfs/dbraw/zinc/32/30/75/1415323075.db2.gz LBEGKYNHBBCDJR-GFCCVEGCSA-N 0 0 375.406 3.343 20 5 GGBDRN O=C(CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccs1 ZINC000125969278 1415325291 /nfs/dbraw/zinc/32/52/91/1415325291.db2.gz LKCGTZVHKLCRPJ-UHFFFAOYSA-N 0 0 388.323 3.210 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1c(Cl)cccc1Cl ZINC000126001117 1415333743 /nfs/dbraw/zinc/33/37/43/1415333743.db2.gz XAYVELFPLPCLTH-HNNXBMFYSA-N 0 0 398.246 3.477 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000126003546 1415334498 /nfs/dbraw/zinc/33/44/98/1415334498.db2.gz CVUTVKVUGOVRLN-UHFFFAOYSA-N 0 0 384.392 3.076 20 5 GGBDRN C[C@H](CO)N(C)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000126014978 1415336834 /nfs/dbraw/zinc/33/68/34/1415336834.db2.gz VPBBKMFFPUMWNW-GFCCVEGCSA-N 0 0 377.828 3.313 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1ccc2ccccc2c1 ZINC000126022496 1415338543 /nfs/dbraw/zinc/33/85/43/1415338543.db2.gz UAGODSQDWHYPBH-HXUWFJFHSA-N 0 0 379.416 3.323 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000126021494 1415338629 /nfs/dbraw/zinc/33/86/29/1415338629.db2.gz YVUDWCDECSSRLY-KRWDZBQOSA-N 0 0 376.416 3.485 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCO)c(NCc2nnc(-c3ccc(Cl)cc3)o2)c1 ZINC000126024260 1415339236 /nfs/dbraw/zinc/33/92/36/1415339236.db2.gz QONZEVRCEIQPKY-UHFFFAOYSA-N 0 0 389.799 3.315 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)Oc1ccc(F)c(F)c1 ZINC000126028317 1415339619 /nfs/dbraw/zinc/33/96/19/1415339619.db2.gz UDZIBOADRLWIPH-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN Cc1cc2oc(=O)cc(CNc3cc([N+](=O)[O-])ccc3NCCO)c2cc1C ZINC000126026100 1415339996 /nfs/dbraw/zinc/33/99/96/1415339996.db2.gz FVBGJJJOLHSLIM-UHFFFAOYSA-N 0 0 383.404 3.334 20 5 GGBDRN CC(C)C(=O)N(C)Cc1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000126037983 1415341787 /nfs/dbraw/zinc/34/17/87/1415341787.db2.gz IQDYDKVGAXBQHH-UHFFFAOYSA-N 0 0 383.448 3.182 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000126046812 1415344278 /nfs/dbraw/zinc/34/42/78/1415344278.db2.gz ZFPKAUDZIMEOHN-NRFANRHFSA-N 0 0 381.432 3.021 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)Cn1c3ccccc3c(=O)c3ccccc31)CCO2 ZINC000126048862 1415344598 /nfs/dbraw/zinc/34/45/98/1415344598.db2.gz UHCMWHAJLZDAME-UHFFFAOYSA-N 0 0 385.423 3.284 20 5 GGBDRN Cc1c(CC(=O)N(C)Cc2nccn2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000126057698 1415346840 /nfs/dbraw/zinc/34/68/40/1415346840.db2.gz MSBDSOHZOFSLLM-UHFFFAOYSA-N 0 0 378.432 3.349 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1c(Cl)cccc1Cl ZINC000126063429 1415348871 /nfs/dbraw/zinc/34/88/71/1415348871.db2.gz JKZYAIOPQHKANM-HNNXBMFYSA-N 0 0 398.246 3.477 20 5 GGBDRN CC(C)(C)OC(=O)NC1(CC(=O)NCCc2cccc([N+](=O)[O-])c2)CCC1 ZINC000126068897 1415349824 /nfs/dbraw/zinc/34/98/24/1415349824.db2.gz FJKQFXKLVOJRIA-UHFFFAOYSA-N 0 0 377.441 3.091 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)o1 ZINC000126077856 1415352018 /nfs/dbraw/zinc/35/20/18/1415352018.db2.gz NFQBHTRNLPZZRY-INIZCTEOSA-N 0 0 384.392 3.374 20 5 GGBDRN O=C(c1cccc(N2CCCNC2=O)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126086211 1415353821 /nfs/dbraw/zinc/35/38/21/1415353821.db2.gz QOEFCKYCGWLFMB-UHFFFAOYSA-N 0 0 394.431 3.319 20 5 GGBDRN O=C(CNC(=O)c1cccc(Cl)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126090318 1415355262 /nfs/dbraw/zinc/35/52/62/1415355262.db2.gz FNNGTEHOKZAHDS-UHFFFAOYSA-N 0 0 387.823 3.169 20 5 GGBDRN CN1CCC(=O)Nc2cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)ccc21 ZINC000126097750 1415357422 /nfs/dbraw/zinc/35/74/22/1415357422.db2.gz VSPIOILXFIFNPC-UHFFFAOYSA-N 0 0 394.431 3.178 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)o1 ZINC000126143557 1415368412 /nfs/dbraw/zinc/36/84/12/1415368412.db2.gz BEMNOLRKPSOHMN-SFHVURJKSA-N 0 0 387.436 3.461 20 5 GGBDRN C[C@@H](O)CN(C)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000126145073 1415368851 /nfs/dbraw/zinc/36/88/51/1415368851.db2.gz OFDZXWHQHMMDJC-GFCCVEGCSA-N 0 0 377.828 3.313 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc(CN2CCCC2=O)cc1 ZINC000126147200 1415369636 /nfs/dbraw/zinc/36/96/36/1415369636.db2.gz HMEIZPKHZJXPKD-UHFFFAOYSA-N 0 0 382.420 3.158 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCC[C@H](Nc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000126160685 1415373252 /nfs/dbraw/zinc/37/32/52/1415373252.db2.gz FOAUHEIPGGHUNK-KRWDZBQOSA-N 0 0 383.404 3.098 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](C)[C@@H](n3ccnc3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126162277 1415373737 /nfs/dbraw/zinc/37/37/37/1415373737.db2.gz RRFWJAGTCNXOSR-BZNIZROVSA-N 0 0 387.396 3.040 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](C)[C@@H](n3ccnc3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126162043 1415373815 /nfs/dbraw/zinc/37/38/15/1415373815.db2.gz RRFWJAGTCNXOSR-ZBEGNZNMSA-N 0 0 387.396 3.040 20 5 GGBDRN COc1ccccc1OC[C@H](C)CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000126185713 1415379799 /nfs/dbraw/zinc/37/97/99/1415379799.db2.gz XPNTZZZIDUPFOH-OAHLLOKOSA-N 0 0 387.436 3.160 20 5 GGBDRN Cc1ccc(OS(=O)(=O)c2sccc2Br)c([N+](=O)[O-])c1 ZINC000126206884 1415384514 /nfs/dbraw/zinc/38/45/14/1415384514.db2.gz IGXRYWMPUFEYFC-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN O=C(Nc1ccc(N2CCNC2=O)cc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126209227 1415384868 /nfs/dbraw/zinc/38/48/68/1415384868.db2.gz XCTMZSQUNGXYQD-UHFFFAOYSA-N 0 0 394.309 3.396 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccccc1OCC(F)(F)F ZINC000126237541 1415391262 /nfs/dbraw/zinc/39/12/62/1415391262.db2.gz JNGHJVTXVCLLBH-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)n(-c2ccccc2)n1 ZINC000126256172 1415395988 /nfs/dbraw/zinc/39/59/88/1415395988.db2.gz KJYFIIVCEZPLLR-CQSZACIVSA-N 0 0 393.447 3.341 20 5 GGBDRN C[C@H](CS(C)(=O)=O)N(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000126269328 1415398675 /nfs/dbraw/zinc/39/86/75/1415398675.db2.gz JPPDHURLZDQLEY-CYBMUJFWSA-N 0 0 378.450 3.252 20 5 GGBDRN Cc1cc(NC(=O)CSCc2cscn2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126292185 1415407573 /nfs/dbraw/zinc/40/75/73/1415407573.db2.gz UMQPFPQVKYBIOO-UHFFFAOYSA-N 0 0 389.462 3.417 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000126307592 1415413774 /nfs/dbraw/zinc/41/37/74/1415413774.db2.gz PFJFWSISCDXYFJ-KRWDZBQOSA-N 0 0 376.416 3.485 20 5 GGBDRN CC(C)(C)OC(=O)c1ccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c(F)c1 ZINC000126318514 1415416273 /nfs/dbraw/zinc/41/62/73/1415416273.db2.gz YIHPXWBQFYGHRX-UHFFFAOYSA-N 0 0 392.387 3.260 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](Cc3ccccc3)C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000126317420 1415416283 /nfs/dbraw/zinc/41/62/83/1415416283.db2.gz XATKCIPZFPNGBR-QGZVFWFLSA-N 0 0 391.431 3.189 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1 ZINC000126316973 1415416318 /nfs/dbraw/zinc/41/63/18/1415416318.db2.gz XUOJFPZLNUYNEH-UHFFFAOYSA-N 0 0 377.360 3.313 20 5 GGBDRN CCNc1ccc(C(=O)Nc2cc(CN3CCOCC3)ccc2C)cc1[N+](=O)[O-] ZINC000126324643 1415418061 /nfs/dbraw/zinc/41/80/61/1415418061.db2.gz GOXXNHICEBAFGV-UHFFFAOYSA-N 0 0 398.463 3.420 20 5 GGBDRN O=C(CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)Nc1ccc(Cl)cc1 ZINC000126328512 1415418670 /nfs/dbraw/zinc/41/86/70/1415418670.db2.gz SWHSJUALPOLGIS-UHFFFAOYSA-N 0 0 384.779 3.165 20 5 GGBDRN C[C@@H](Nc1cnn(CC(F)(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000126344206 1415422427 /nfs/dbraw/zinc/42/24/27/1415422427.db2.gz PTYQQRONYKKYQV-MRVPVSSYSA-N 0 0 391.737 3.446 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccn(Cc2ccccc2)n1 ZINC000126348029 1415422805 /nfs/dbraw/zinc/42/28/05/1415422805.db2.gz CZEXJPWJTOGHDQ-UHFFFAOYSA-N 0 0 380.408 3.073 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126351518 1415424430 /nfs/dbraw/zinc/42/44/30/1415424430.db2.gz DILSCZAHWVXQLD-LOKFHWFJSA-N 0 0 389.477 3.277 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000126351644 1415424484 /nfs/dbraw/zinc/42/44/84/1415424484.db2.gz GLHQYZCPYUFWHH-CQSZACIVSA-N 0 0 394.474 3.391 20 5 GGBDRN COc1cc(CNCc2ncccc2F)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000126362479 1415426768 /nfs/dbraw/zinc/42/67/68/1415426768.db2.gz SUSQEXJTTSSVGK-UHFFFAOYSA-N 0 0 389.305 3.368 20 5 GGBDRN CC(C)(C)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1 ZINC000126362740 1415427454 /nfs/dbraw/zinc/42/74/54/1415427454.db2.gz IQKWBKRVBUOFNN-MRXNPFEDSA-N 0 0 375.400 3.189 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000126392463 1415436498 /nfs/dbraw/zinc/43/64/98/1415436498.db2.gz DBYRLALZVYCWRH-LJQANCHMSA-N 0 0 383.448 3.386 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC000126394942 1415437264 /nfs/dbraw/zinc/43/72/64/1415437264.db2.gz DTLQIKAGAXRLTA-UHFFFAOYSA-N 0 0 387.827 3.209 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1ccccn1 ZINC000126398843 1415437787 /nfs/dbraw/zinc/43/77/87/1415437787.db2.gz HIEATAWCFMYJFW-IBGZPJMESA-N 0 0 378.388 3.100 20 5 GGBDRN Cc1c(CC(=O)Nc2n[nH]cc2-c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000126397926 1415437809 /nfs/dbraw/zinc/43/78/09/1415437809.db2.gz HZRBSSLFXIILDO-UHFFFAOYSA-N 0 0 380.360 3.203 20 5 GGBDRN O=C(NC[C@H](O)c1ccc(F)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126420590 1415447688 /nfs/dbraw/zinc/44/76/88/1415447688.db2.gz FXEXLJCIWGEMJC-INIZCTEOSA-N 0 0 387.392 3.321 20 5 GGBDRN COc1cc(C)c(CN(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000126439441 1415453659 /nfs/dbraw/zinc/45/36/59/1415453659.db2.gz PLRCHEVAWFJLHJ-UHFFFAOYSA-N 0 0 387.436 3.305 20 5 GGBDRN COc1ccc(C[S@@](=O)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1F ZINC000126443393 1415454640 /nfs/dbraw/zinc/45/46/40/1415454640.db2.gz BIYJSQFMQYZMMV-SANMLTNESA-N 0 0 381.381 3.058 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1cc2ccccc2s1 ZINC000126451365 1415456435 /nfs/dbraw/zinc/45/64/35/1415456435.db2.gz JAZPMOCRBDELRT-INIZCTEOSA-N 0 0 385.445 3.385 20 5 GGBDRN O=C(Nc1ccc(N2CCC(O)CC2)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000126463734 1415459894 /nfs/dbraw/zinc/45/98/94/1415459894.db2.gz FPRLOIVANFIYGI-UHFFFAOYSA-N 0 0 375.812 3.462 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000126477135 1415465325 /nfs/dbraw/zinc/46/53/25/1415465325.db2.gz KMLUCBQPQGMOAN-HOTGVXAUSA-N 0 0 376.457 3.020 20 5 GGBDRN O=c1c2cnn(-c3cccc(Cl)c3)c2ncn1Cc1c(F)cccc1[N+](=O)[O-] ZINC000126484423 1415467469 /nfs/dbraw/zinc/46/74/69/1415467469.db2.gz QVAQRCNTTGPLSH-UHFFFAOYSA-N 0 0 399.769 3.331 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126487216 1415467899 /nfs/dbraw/zinc/46/78/99/1415467899.db2.gz CZFPFRKWKCRHQO-UHFFFAOYSA-N 0 0 393.447 3.439 20 5 GGBDRN O=C(NC[C@H]1CCN(CC(F)(F)F)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126528776 1415478669 /nfs/dbraw/zinc/47/86/69/1415478669.db2.gz NPNHVTFUTCCYFI-SECBINFHSA-N 0 0 399.291 3.228 20 5 GGBDRN CCN(Cc1ccccc1NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)=O ZINC000126531719 1415479418 /nfs/dbraw/zinc/47/94/18/1415479418.db2.gz ITGPDQYICNTNJH-UHFFFAOYSA-N 0 0 384.436 3.322 20 5 GGBDRN O=C(Cc1ccc(F)cc1Cl)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000126563845 1415492633 /nfs/dbraw/zinc/49/26/33/1415492633.db2.gz GQRRYYARRUCEBL-CYBMUJFWSA-N 0 0 378.791 3.038 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000126573515 1415497482 /nfs/dbraw/zinc/49/74/82/1415497482.db2.gz JZRQHVGBZZXCCN-GFCCVEGCSA-N 0 0 381.404 3.111 20 5 GGBDRN O=C(NC[C@](O)(c1ccccc1)C(F)(F)F)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000126595372 1415502464 /nfs/dbraw/zinc/50/24/64/1415502464.db2.gz ATERBWAGJVPDLI-HNNXBMFYSA-N 0 0 388.729 3.428 20 5 GGBDRN O=C(Nc1ccc(N2CCNC2=O)cc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000126603421 1415504663 /nfs/dbraw/zinc/50/46/63/1415504663.db2.gz JFAFLDZLGCYLKG-UHFFFAOYSA-N 0 0 375.772 3.422 20 5 GGBDRN O=C(NCC1CC1)[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000126610271 1415506204 /nfs/dbraw/zinc/50/62/04/1415506204.db2.gz SQKXZKABGJGFAJ-GFCCVEGCSA-N 0 0 380.832 3.018 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(CC(F)F)CC1 ZINC000126629542 1415511588 /nfs/dbraw/zinc/51/15/88/1415511588.db2.gz MBEICXVRNFSGML-UHFFFAOYSA-N 0 0 387.452 3.366 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000126657228 1415519496 /nfs/dbraw/zinc/51/94/96/1415519496.db2.gz NLWCCOHDQWWKLX-LLVKDONJSA-N 0 0 375.356 3.268 20 5 GGBDRN CC[C@@H](NC(=O)CCn1cc([N+](=O)[O-])nc1C)c1nc(-c2ccccc2)c[nH]1 ZINC000126699395 1415529626 /nfs/dbraw/zinc/52/96/26/1415529626.db2.gz ODCUBSLIISSDEW-OAHLLOKOSA-N 0 0 382.424 3.147 20 5 GGBDRN COc1cccc(COc2cccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])c2C)c1 ZINC000126697538 1415530156 /nfs/dbraw/zinc/53/01/56/1415530156.db2.gz MXRVOHOUPUZJFR-UHFFFAOYSA-N 0 0 382.376 3.466 20 5 GGBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)c1ccc(N2CCOC2=O)cc1 ZINC000126730962 1415541738 /nfs/dbraw/zinc/54/17/38/1415541738.db2.gz WCJJUEMBXVXLJY-UHFFFAOYSA-N 0 0 392.371 3.298 20 5 GGBDRN Cc1c(C(=O)NCc2ccnc(N3CCCCC3)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000126737346 1415543382 /nfs/dbraw/zinc/54/33/82/1415543382.db2.gz JHPAHMXYMSWFGV-UHFFFAOYSA-N 0 0 399.407 3.127 20 5 GGBDRN CN(C)c1cc(C(=O)O[C@H](c2cccnc2)c2ccccc2[N+](=O)[O-])ccn1 ZINC000126741340 1415544562 /nfs/dbraw/zinc/54/45/62/1415544562.db2.gz XJEHQQQYPMIHGJ-LJQANCHMSA-N 0 0 378.388 3.397 20 5 GGBDRN CN(C)c1cc(C(=O)O[C@@H](c2cccnc2)c2ccccc2[N+](=O)[O-])ccn1 ZINC000126741107 1415544745 /nfs/dbraw/zinc/54/47/45/1415544745.db2.gz XJEHQQQYPMIHGJ-IBGZPJMESA-N 0 0 378.388 3.397 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000178031312 1428945589 /nfs/dbraw/zinc/94/55/89/1428945589.db2.gz HDJUECBAYNMYQI-MPEQGZPJSA-N 0 0 393.509 3.005 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(CC)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000126770168 1415553882 /nfs/dbraw/zinc/55/38/82/1415553882.db2.gz DPWRKZKQVHQXBX-INIZCTEOSA-N 0 0 397.431 3.373 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(CC)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000126770404 1415553950 /nfs/dbraw/zinc/55/39/50/1415553950.db2.gz DPWRKZKQVHQXBX-MRXNPFEDSA-N 0 0 397.431 3.373 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2nc(C3CC3)cs2)cc1OC ZINC000126777351 1415556409 /nfs/dbraw/zinc/55/64/09/1415556409.db2.gz NKUAHEUJJKEJBP-UHFFFAOYSA-N 0 0 377.422 3.266 20 5 GGBDRN CC1CCN(CC(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000126789693 1415559294 /nfs/dbraw/zinc/55/92/94/1415559294.db2.gz CFYVVXJQPGGFDF-UHFFFAOYSA-N 0 0 397.431 3.484 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(-c2cn3cccnc3n2)cc1 ZINC000126795909 1415561837 /nfs/dbraw/zinc/56/18/37/1415561837.db2.gz ZZULTLSYFOVURQ-UHFFFAOYSA-N 0 0 389.371 3.322 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2[nH]nc(CC)c2[N+](=O)[O-])c(OC(F)F)c1 ZINC000178037537 1428950438 /nfs/dbraw/zinc/95/04/38/1428950438.db2.gz UPBLFLCEVXNKDP-UHFFFAOYSA-N 0 0 398.366 3.201 20 5 GGBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000126851173 1415584493 /nfs/dbraw/zinc/58/44/93/1415584493.db2.gz KWCJIAZKWFOPSA-HNNXBMFYSA-N 0 0 377.466 3.491 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)CC(=O)c2ccc(F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000126851406 1415584526 /nfs/dbraw/zinc/58/45/26/1415584526.db2.gz VRDCUACNCVIVOC-SNVBAGLBSA-N 0 0 389.339 3.342 20 5 GGBDRN COc1ccc(C2(CNC(=O)CCc3cccc([N+](=O)[O-])c3)CCOCC2)cc1 ZINC000126861638 1415588053 /nfs/dbraw/zinc/58/80/53/1415588053.db2.gz BKMZDIWHMCGRQB-UHFFFAOYSA-N 0 0 398.459 3.401 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCc2c3ccccc3[nH]c2C1 ZINC000126917435 1415607585 /nfs/dbraw/zinc/60/75/85/1415607585.db2.gz YPEAMNNXZKPPTO-UHFFFAOYSA-N 0 0 380.404 3.082 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])CCO2 ZINC000126929174 1415612233 /nfs/dbraw/zinc/61/22/33/1415612233.db2.gz MYPLXALVKSLSTQ-UHFFFAOYSA-N 0 0 397.309 3.279 20 5 GGBDRN CN(C)C(=O)c1ccnc(NCc2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000126943755 1415615081 /nfs/dbraw/zinc/61/50/81/1415615081.db2.gz MYWORBQLVGCOTA-UHFFFAOYSA-N 0 0 379.214 3.066 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)Cc2cc(Cl)cn2C)cc1[N+](=O)[O-] ZINC000126965786 1415620315 /nfs/dbraw/zinc/62/03/15/1415620315.db2.gz RYFRCLBIHLEWKU-UHFFFAOYSA-N 0 0 392.264 3.369 20 5 GGBDRN COc1cc(CN2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000126978191 1415623966 /nfs/dbraw/zinc/62/39/66/1415623966.db2.gz UJHJZIMTOCAIHV-PHIMTYICSA-N 0 0 378.347 3.154 20 5 GGBDRN CC(C)(CO)[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000126985900 1415625610 /nfs/dbraw/zinc/62/56/10/1415625610.db2.gz JKFXLKSDBMVRHF-HXUWFJFHSA-N 0 0 397.475 3.465 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCCCNC(=O)C(C)C ZINC000126998445 1415630528 /nfs/dbraw/zinc/63/05/28/1415630528.db2.gz WEQYBEWBANPWES-UHFFFAOYSA-N 0 0 381.498 3.235 20 5 GGBDRN COc1c(C)ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000178065313 1428966392 /nfs/dbraw/zinc/96/63/92/1428966392.db2.gz OCQUZRFAPCGXOM-CQSZACIVSA-N 0 0 385.420 3.345 20 5 GGBDRN CCOc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000178068034 1428966964 /nfs/dbraw/zinc/96/69/64/1428966964.db2.gz CZYNKKCCSCOABO-CQSZACIVSA-N 0 0 385.420 3.426 20 5 GGBDRN CCOc1cc(C)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178067204 1428966971 /nfs/dbraw/zinc/96/69/71/1428966971.db2.gz AQZVXWSXHPSHTD-AWEZNQCLSA-N 0 0 385.420 3.426 20 5 GGBDRN Cc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1N(C)C ZINC000178067030 1428967044 /nfs/dbraw/zinc/96/70/44/1428967044.db2.gz XGAWUGAAAFCHQS-AWEZNQCLSA-N 0 0 384.436 3.094 20 5 GGBDRN Cn1cnnc1Sc1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000127051873 1415648720 /nfs/dbraw/zinc/64/87/20/1415648720.db2.gz ZIGSPPVDWPEETA-UHFFFAOYSA-N 0 0 387.396 3.195 20 5 GGBDRN O=C(Cn1cc(-c2ccccc2)cn1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000127069179 1415653688 /nfs/dbraw/zinc/65/36/88/1415653688.db2.gz UKEQZUCEDAEIOO-UHFFFAOYSA-N 0 0 394.387 3.258 20 5 GGBDRN C[C@H]1CCCN(Cc2csc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)n2)C1 ZINC000127105485 1415661291 /nfs/dbraw/zinc/66/12/91/1415661291.db2.gz NPICBMUCHOSHPO-JTQLQIEISA-N 0 0 393.444 3.257 20 5 GGBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000127106701 1415662429 /nfs/dbraw/zinc/66/24/29/1415662429.db2.gz HCUPHEYPBBXEAP-ZDUSSCGKSA-N 0 0 396.378 3.311 20 5 GGBDRN C[C@@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1noc(-c2ccccc2)n1 ZINC000178078783 1428972242 /nfs/dbraw/zinc/97/22/42/1428972242.db2.gz HERINOAYMNDTOZ-CYBMUJFWSA-N 0 0 396.407 3.117 20 5 GGBDRN Cc1c(CC(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000127132145 1415667033 /nfs/dbraw/zinc/66/70/33/1415667033.db2.gz ZWFXEXXSVSCQSS-LJQANCHMSA-N 0 0 395.459 3.257 20 5 GGBDRN CCCCn1ccnc1-c1cccc(NC(=O)NCCn2cc([N+](=O)[O-])cn2)c1 ZINC000127144553 1415670695 /nfs/dbraw/zinc/67/06/95/1415670695.db2.gz MVXHQFMEYQZBSF-UHFFFAOYSA-N 0 0 397.439 3.277 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000127147211 1415671078 /nfs/dbraw/zinc/67/10/78/1415671078.db2.gz XJNWVTJDGIIMHX-ZDUSSCGKSA-N 0 0 393.802 3.405 20 5 GGBDRN C[C@@](O)(CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccsc1 ZINC000127148391 1415671876 /nfs/dbraw/zinc/67/18/76/1415671876.db2.gz PXBJSYVDWZUHOB-CQSZACIVSA-N 0 0 385.239 3.056 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)Cc1cccc(OC(F)(F)F)c1 ZINC000127152687 1415672968 /nfs/dbraw/zinc/67/29/68/1415672968.db2.gz APAUAZAZHRUDNZ-UHFFFAOYSA-N 0 0 386.330 3.047 20 5 GGBDRN Nc1c(C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)cc(F)cc1[N+](=O)[O-] ZINC000127150251 1415673219 /nfs/dbraw/zinc/67/32/19/1415673219.db2.gz DWPIVBQZKRRHGV-UHFFFAOYSA-N 0 0 383.383 3.212 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@](C)(O)c1ccc(F)cc1 ZINC000127160063 1415675083 /nfs/dbraw/zinc/67/50/83/1415675083.db2.gz BBAMQJWDFKAUDY-GOSISDBHSA-N 0 0 378.425 3.483 20 5 GGBDRN COc1ccc(OCC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000127161669 1415675467 /nfs/dbraw/zinc/67/54/67/1415675467.db2.gz XNNNKCQJZYFSQX-LLVKDONJSA-N 0 0 380.347 3.480 20 5 GGBDRN COc1ccc(OCC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000127161410 1415675485 /nfs/dbraw/zinc/67/54/85/1415675485.db2.gz XNNNKCQJZYFSQX-NSHDSACASA-N 0 0 380.347 3.480 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)Cc1cnn(-c2ccccc2)c1 ZINC000127171352 1415678297 /nfs/dbraw/zinc/67/82/97/1415678297.db2.gz DZTZSYKHLLWLCL-OAHLLOKOSA-N 0 0 379.420 3.240 20 5 GGBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000127172106 1415678589 /nfs/dbraw/zinc/67/85/89/1415678589.db2.gz OGMPFUSVHMOEIR-JTQLQIEISA-N 0 0 375.312 3.033 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1N1CCCCC1 ZINC000178085616 1428975331 /nfs/dbraw/zinc/97/53/31/1428975331.db2.gz VYZFKBZJIVAFAD-UHFFFAOYSA-N 0 0 392.847 3.257 20 5 GGBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)COc1ccc([N+](=O)[O-])cc1C=O ZINC000127188008 1415681542 /nfs/dbraw/zinc/68/15/42/1415681542.db2.gz KGOAPNCTNZYNHJ-NSHDSACASA-N 0 0 378.331 3.284 20 5 GGBDRN CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178086826 1428975982 /nfs/dbraw/zinc/97/59/82/1428975982.db2.gz JAHHLOZAKIOPIC-HXUWFJFHSA-N 0 0 394.431 3.285 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000178062530 1428963663 /nfs/dbraw/zinc/96/36/63/1428963663.db2.gz QUNPYXOITRWUTE-ZDUSSCGKSA-N 0 0 378.388 3.267 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc(F)c(F)c2F)cc1[N+](=O)[O-] ZINC000178061553 1428963721 /nfs/dbraw/zinc/96/37/21/1428963721.db2.gz VKMXZVQZINHOCK-SECBINFHSA-N 0 0 381.310 3.136 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000178062490 1428964018 /nfs/dbraw/zinc/96/40/18/1428964018.db2.gz USYCEHLJQDDJFY-VIFPVBQESA-N 0 0 381.310 3.136 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C12CCC2 ZINC000127227673 1415694251 /nfs/dbraw/zinc/69/42/51/1415694251.db2.gz JSUUYGBHBFEOHE-OALUTQOASA-N 0 0 398.463 3.056 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC(C)(C)c2ccccc21 ZINC000127226997 1415694502 /nfs/dbraw/zinc/69/45/02/1415694502.db2.gz BQPILNHRNZMEDR-UGSOOPFHSA-N 0 0 381.432 3.252 20 5 GGBDRN COc1cc(N2CCC(OC(=O)Cc3csc(C)n3)CC2)ccc1[N+](=O)[O-] ZINC000127227481 1415694581 /nfs/dbraw/zinc/69/45/81/1415694581.db2.gz WVGAKJDLMDRYQL-UHFFFAOYSA-N 0 0 391.449 3.123 20 5 GGBDRN CCn1ncc2ccc(NC(=O)C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc21 ZINC000178062977 1428964899 /nfs/dbraw/zinc/96/48/99/1428964899.db2.gz IVOUWMIFLWCWFZ-CYBMUJFWSA-N 0 0 395.419 3.089 20 5 GGBDRN NS(=O)(=O)c1ccc2c(c1)CCN2Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000127288003 1415721410 /nfs/dbraw/zinc/72/14/10/1415721410.db2.gz DPSVESACTQQZTQ-UHFFFAOYSA-N 0 0 399.428 3.065 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 ZINC000127291448 1415722025 /nfs/dbraw/zinc/72/20/25/1415722025.db2.gz ZNJWJWNCLRIOQM-YJBOKZPZSA-N 0 0 390.823 3.213 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000178102283 1428982516 /nfs/dbraw/zinc/98/25/16/1428982516.db2.gz PMGTZQHDZBSPHQ-UHFFFAOYSA-N 0 0 382.420 3.459 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000127321145 1415736555 /nfs/dbraw/zinc/73/65/55/1415736555.db2.gz QLVJJHWLHHYZBU-OLZOCXBDSA-N 0 0 377.828 3.061 20 5 GGBDRN CCS[C@H]1CCC[C@@H]1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000178111176 1428986745 /nfs/dbraw/zinc/98/67/45/1428986745.db2.gz QDIADVPQORSSEB-BBRMVZONSA-N 0 0 393.465 3.073 20 5 GGBDRN CC[C@@H](CNC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)Oc1ccccc1C ZINC000178111271 1428986808 /nfs/dbraw/zinc/98/68/08/1428986808.db2.gz NUKUJDMGWZUSEO-INIZCTEOSA-N 0 0 385.420 3.124 20 5 GGBDRN CC1(C)C[C@H](NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccccc21 ZINC000127362857 1415753930 /nfs/dbraw/zinc/75/39/30/1415753930.db2.gz OJKANFIXQKEXNS-HNNXBMFYSA-N 0 0 381.388 3.042 20 5 GGBDRN COc1ccc(C)cc1[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127366040 1415754592 /nfs/dbraw/zinc/75/45/92/1415754592.db2.gz ZXTDPUJYJHKWKV-OAHLLOKOSA-N 0 0 399.447 3.239 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C1(C)C ZINC000127392239 1415763943 /nfs/dbraw/zinc/76/39/43/1415763943.db2.gz QHTLZGRTZJLZJH-LSDHHAIUSA-N 0 0 379.413 3.395 20 5 GGBDRN CC[C@H](CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)Oc1cccc(C)c1 ZINC000178089425 1428976543 /nfs/dbraw/zinc/97/65/43/1428976543.db2.gz XKDSFNUZLQGCQL-MRXNPFEDSA-N 0 0 385.420 3.124 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)nc2ccccc21 ZINC000127429966 1415775952 /nfs/dbraw/zinc/77/59/52/1415775952.db2.gz HRGCQOXPLDJVHA-UHFFFAOYSA-N 0 0 378.388 3.453 20 5 GGBDRN O=C(Nc1ccc2ncsc2c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127457159 1415786051 /nfs/dbraw/zinc/78/60/51/1415786051.db2.gz KGCHQDAEYNULLV-UHFFFAOYSA-N 0 0 384.417 3.293 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000127466798 1415790997 /nfs/dbraw/zinc/79/09/97/1415790997.db2.gz NGXZXAWBNIVSNU-UHFFFAOYSA-N 0 0 383.282 3.494 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)nc2ccccc21 ZINC000127477492 1415794902 /nfs/dbraw/zinc/79/49/02/1415794902.db2.gz HIEBMOLLHHFXCU-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN CCOc1ccc(NC(=O)COc2ccc(Br)nc2)c([N+](=O)[O-])c1 ZINC000127486167 1415798933 /nfs/dbraw/zinc/79/89/33/1415798933.db2.gz IVFHMMXWBJGCFR-UHFFFAOYSA-N 0 0 396.197 3.169 20 5 GGBDRN COCCC(=O)N1CCC(NC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000178144695 1428998229 /nfs/dbraw/zinc/99/82/29/1428998229.db2.gz YQADXYMAAOVSIZ-UHFFFAOYSA-N 0 0 391.471 3.145 20 5 GGBDRN CC[C@H]1c2ccsc2CCN1C(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000127510078 1415802921 /nfs/dbraw/zinc/80/29/21/1415802921.db2.gz BLQAVIHSQUPTDV-ZDUSSCGKSA-N 0 0 387.417 3.100 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000127538917 1415806974 /nfs/dbraw/zinc/80/69/74/1415806974.db2.gz PYBZNPSPPSQDHZ-LLVKDONJSA-N 0 0 399.350 3.317 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000127556825 1415809426 /nfs/dbraw/zinc/80/94/26/1415809426.db2.gz HRAXIVHGTZYXAM-UHFFFAOYSA-N 0 0 391.449 3.318 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1OS(=O)(=O)c1cnn(-c2ccccc2F)c1 ZINC000127558803 1415809828 /nfs/dbraw/zinc/80/98/28/1415809828.db2.gz BORPMPIHIHYXFS-UHFFFAOYSA-N 0 0 397.771 3.341 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)ccc1[N+](=O)[O-] ZINC000127572854 1415812002 /nfs/dbraw/zinc/81/20/02/1415812002.db2.gz BPXJLQYMRPUOLE-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN CCc1cc(N2CCC(NC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2)ncn1 ZINC000127576034 1415812595 /nfs/dbraw/zinc/81/25/95/1415812595.db2.gz NIKMEWLHYFCRKA-UHFFFAOYSA-N 0 0 398.467 3.355 20 5 GGBDRN C[C@@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000127583583 1415814411 /nfs/dbraw/zinc/81/44/11/1415814411.db2.gz GYPQEPBMQPTJPE-OAHLLOKOSA-N 0 0 397.431 3.264 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1 ZINC000127596762 1415816329 /nfs/dbraw/zinc/81/63/29/1415816329.db2.gz WCQICPYJKSJVSX-UHFFFAOYSA-N 0 0 398.387 3.389 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OCC(F)F ZINC000127600673 1415816838 /nfs/dbraw/zinc/81/68/38/1415816838.db2.gz QJNJPMGZDZLMKF-UHFFFAOYSA-N 0 0 393.346 3.433 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1 ZINC000178152989 1429001454 /nfs/dbraw/zinc/00/14/54/1429001454.db2.gz LOSLQKXZXMHXAI-UHFFFAOYSA-N 0 0 390.465 3.085 20 5 GGBDRN CC[C@@H](Cc1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127629646 1415823205 /nfs/dbraw/zinc/82/32/05/1415823205.db2.gz KCKANFREIFGPNQ-KRWDZBQOSA-N 0 0 383.448 3.183 20 5 GGBDRN COc1ccc(N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(OC)c1 ZINC000127630696 1415823279 /nfs/dbraw/zinc/82/32/79/1415823279.db2.gz JSKKLMNPKKEAPF-UHFFFAOYSA-N 0 0 382.376 3.074 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@H]3CCC[C@H]3O)cc2[N+](=O)[O-])CC1 ZINC000127641758 1415824781 /nfs/dbraw/zinc/82/47/81/1415824781.db2.gz AUQWVDJJIAPWMF-VQIMIIECSA-N 0 0 375.469 3.064 20 5 GGBDRN COc1ccc(-c2nc(NC(=O)c3c([N+](=O)[O-])c(C)nn3C)sc2C)cc1 ZINC000127639401 1415824888 /nfs/dbraw/zinc/82/48/88/1415824888.db2.gz HMATWHRAWSQRNQ-UHFFFAOYSA-N 0 0 387.421 3.330 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@@H]3CCC[C@@H]3O)cc2[N+](=O)[O-])CC1 ZINC000127641046 1415824905 /nfs/dbraw/zinc/82/49/05/1415824905.db2.gz AUQWVDJJIAPWMF-LPHOPBHVSA-N 0 0 375.469 3.064 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@H]3CCC[C@@H]3O)cc2[N+](=O)[O-])CC1 ZINC000127641322 1415824937 /nfs/dbraw/zinc/82/49/37/1415824937.db2.gz AUQWVDJJIAPWMF-APWZRJJASA-N 0 0 375.469 3.064 20 5 GGBDRN CC(C)(CNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1cccs1 ZINC000127648973 1415825952 /nfs/dbraw/zinc/82/59/52/1415825952.db2.gz OOUKAYAONYHDFN-UHFFFAOYSA-N 0 0 389.477 3.201 20 5 GGBDRN CN(C(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C1CC1 ZINC000127661794 1415828648 /nfs/dbraw/zinc/82/86/48/1415828648.db2.gz GLDACNRDTQFJOU-MRXNPFEDSA-N 0 0 391.493 3.028 20 5 GGBDRN C[C@@H](O)[C@@H]1CCCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000127668768 1415829805 /nfs/dbraw/zinc/82/98/05/1415829805.db2.gz HXVRVWJNSNXRJU-NVXWUHKLSA-N 0 0 375.469 3.064 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000127670855 1415830430 /nfs/dbraw/zinc/83/04/30/1415830430.db2.gz BYPDVTYRQGZZHK-SFHVURJKSA-N 0 0 398.463 3.407 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)s1 ZINC000127672097 1415830438 /nfs/dbraw/zinc/83/04/38/1415830438.db2.gz NVHIFXADCQGOQV-ZDUSSCGKSA-N 0 0 389.477 3.162 20 5 GGBDRN Nc1c(C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)cccc1[N+](=O)[O-] ZINC000178163114 1429003470 /nfs/dbraw/zinc/00/34/70/1429003470.db2.gz LODOPODMXNLVRA-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1Oc1ncc(I)cn1 ZINC000127683615 1415832608 /nfs/dbraw/zinc/83/26/08/1415832608.db2.gz SDTYOUOSVHKNKS-UHFFFAOYSA-N 0 0 377.525 3.435 20 5 GGBDRN Cc1cccc([C@@H](C)CNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000127684890 1415832656 /nfs/dbraw/zinc/83/26/56/1415832656.db2.gz ADJNVXFDHGGVQJ-INIZCTEOSA-N 0 0 383.448 3.273 20 5 GGBDRN C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)Cc1cccs1 ZINC000127692671 1415834263 /nfs/dbraw/zinc/83/42/63/1415834263.db2.gz NJYVJWJIKXBSFC-CQSZACIVSA-N 0 0 389.477 3.102 20 5 GGBDRN Cc1ccccc1Cc1nnc(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000127692676 1415834268 /nfs/dbraw/zinc/83/42/68/1415834268.db2.gz WOEJJHBQXIJKPI-UHFFFAOYSA-N 0 0 376.376 3.184 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)n1 ZINC000178168699 1429005002 /nfs/dbraw/zinc/00/50/02/1429005002.db2.gz VPHGTCWKYUBWFO-OAHLLOKOSA-N 0 0 394.435 3.231 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1cc(F)ccc1N1CCC(O)CC1 ZINC000127704815 1415836310 /nfs/dbraw/zinc/83/63/10/1415836310.db2.gz UUDITWNLHTUNOA-NSHDSACASA-N 0 0 393.440 3.248 20 5 GGBDRN COc1cccc(C2(NS(=O)(=O)c3cc(Cl)ccc3[N+](=O)[O-])CC2)c1 ZINC000127710060 1415837312 /nfs/dbraw/zinc/83/73/12/1415837312.db2.gz CFQGWSUOKWHCNR-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127717331 1415838351 /nfs/dbraw/zinc/83/83/51/1415838351.db2.gz CBERYWTYFJYUBI-HOTGVXAUSA-N 0 0 383.448 3.353 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCN(c2ccc(O)cc2)CC1 ZINC000127717594 1415838564 /nfs/dbraw/zinc/83/85/64/1415838564.db2.gz SNZQVMIFLLPHEM-UHFFFAOYSA-N 0 0 395.337 3.282 20 5 GGBDRN CCS[C@@H]1CCC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127721202 1415838877 /nfs/dbraw/zinc/83/88/77/1415838877.db2.gz HNJYAOCZDHMXNK-HUUCEWRRSA-N 0 0 393.509 3.226 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)c1[N+](=O)[O-] ZINC000127722892 1415838974 /nfs/dbraw/zinc/83/89/74/1415838974.db2.gz KMIICGRZGAZNFS-UHFFFAOYSA-N 0 0 392.721 3.484 20 5 GGBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127732764 1415840681 /nfs/dbraw/zinc/84/06/81/1415840681.db2.gz JOFUARQWKPGMQP-AEFFLSMTSA-N 0 0 395.459 3.450 20 5 GGBDRN Cc1ncc(CN2CCN(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2)s1 ZINC000127737937 1415841808 /nfs/dbraw/zinc/84/18/08/1415841808.db2.gz NAUUOCQSGVXVRM-UHFFFAOYSA-N 0 0 389.481 3.326 20 5 GGBDRN CC(C)C[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127749616 1415843505 /nfs/dbraw/zinc/84/35/05/1415843505.db2.gz HUBYMTOKQLYGNR-INIZCTEOSA-N 0 0 375.469 3.330 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ncc(Cc3ccc(C)c(F)c3)s2)c1[N+](=O)[O-] ZINC000127753378 1415844011 /nfs/dbraw/zinc/84/40/11/1415844011.db2.gz QDPKFPKZQKMTOC-UHFFFAOYSA-N 0 0 389.412 3.384 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2ccccc2COCc2ccccc2)c1[N+](=O)[O-] ZINC000127767835 1415846917 /nfs/dbraw/zinc/84/69/17/1415846917.db2.gz VKPFPROGAFZRLV-UHFFFAOYSA-N 0 0 394.431 3.284 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCCN(C(=O)c2ccccc2F)CC1 ZINC000127794152 1415851758 /nfs/dbraw/zinc/85/17/58/1415851758.db2.gz IJZHPAFPCUXBIZ-UHFFFAOYSA-N 0 0 386.383 3.114 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)cn1 ZINC000127819418 1415856479 /nfs/dbraw/zinc/85/64/79/1415856479.db2.gz BZXSCILCFUSKSD-KRWDZBQOSA-N 0 0 389.358 3.237 20 5 GGBDRN O=C(NCCCS(=O)(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000127832114 1415859087 /nfs/dbraw/zinc/85/90/87/1415859087.db2.gz KTURFSOBISCDCX-UHFFFAOYSA-N 0 0 397.840 3.234 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1 ZINC000127837276 1415860494 /nfs/dbraw/zinc/86/04/94/1415860494.db2.gz IHLRNZZKSZBXRD-BFYDXBDKSA-N 0 0 390.484 3.317 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](Cc1ccccc1)C(=O)NC1CC1 ZINC000127840367 1415860745 /nfs/dbraw/zinc/86/07/45/1415860745.db2.gz VKSDCXVIIKWWBB-QGZVFWFLSA-N 0 0 396.447 3.223 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCc1cccc(C(=O)N(C)C)c1 ZINC000127853240 1415863541 /nfs/dbraw/zinc/86/35/41/1415863541.db2.gz MINDAALNUBZUKQ-UHFFFAOYSA-N 0 0 384.436 3.278 20 5 GGBDRN CCCOc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000127857526 1415863941 /nfs/dbraw/zinc/86/39/41/1415863941.db2.gz ZZQJFGSETYMTQB-UHFFFAOYSA-N 0 0 385.420 3.473 20 5 GGBDRN Cc1cc(C)c(OC(=O)Cn2nc(-c3ccccc3)ccc2=O)c([N+](=O)[O-])c1 ZINC000127856712 1415864143 /nfs/dbraw/zinc/86/41/43/1415864143.db2.gz RHRNUDUPWIPUOV-UHFFFAOYSA-N 0 0 379.372 3.041 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)C[C@@H]3CCC[C@@H]3O)cc2[N+](=O)[O-])C1 ZINC000127883528 1415869580 /nfs/dbraw/zinc/86/95/80/1415869580.db2.gz OBHAKALBQNVNJC-MQJTVSLUSA-N 0 0 389.496 3.310 20 5 GGBDRN O=C(CSc1ncccc1[N+](=O)[O-])N1CCN(c2cccc(Cl)c2)CC1 ZINC000127895430 1415872098 /nfs/dbraw/zinc/87/20/98/1415872098.db2.gz HIJPTQYZGDVNKO-UHFFFAOYSA-N 0 0 392.868 3.084 20 5 GGBDRN Cc1cc(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc([N+](=O)[O-])c1 ZINC000127903903 1415873194 /nfs/dbraw/zinc/87/31/94/1415873194.db2.gz GPIBBULBMSVNCN-AWEZNQCLSA-N 0 0 377.441 3.280 20 5 GGBDRN Cc1cccc([C@@H](O)CN(Cc2ccccc2)C(=O)c2c([N+](=O)[O-])cnn2C)c1 ZINC000127919596 1415875300 /nfs/dbraw/zinc/87/53/00/1415875300.db2.gz UOBAEKHKQCVDBW-IBGZPJMESA-N 0 0 394.431 3.013 20 5 GGBDRN C[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)OC(C)(C)C ZINC000127929790 1415877019 /nfs/dbraw/zinc/87/70/19/1415877019.db2.gz NGOXJUYNVXWGDB-JTQLQIEISA-N 0 0 377.422 3.178 20 5 GGBDRN 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1429014479 /nfs/dbraw/zinc/01/44/79/1429014479.db2.gz QBEMAHPOLRIPEH-UHFFFAOYSA-N 0 0 394.412 3.342 20 5 GGBDRN Nc1c(C(=O)NCC2(c3ccccc3Cl)CCOCC2)cccc1[N+](=O)[O-] ZINC000178194255 1429015168 /nfs/dbraw/zinc/01/51/68/1429015168.db2.gz OQOBITNXSPPHSW-UHFFFAOYSA-N 0 0 389.839 3.309 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc(C)nc2Br)ccc1[N+](=O)[O-] ZINC000128026934 1415895931 /nfs/dbraw/zinc/89/59/31/1415895931.db2.gz QLTDWMYBYVNJNI-UHFFFAOYSA-N 0 0 396.197 3.087 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)cccc1[N+](=O)[O-] ZINC000178197946 1429016274 /nfs/dbraw/zinc/01/62/74/1429016274.db2.gz GPABYWXDZZTSSY-UHFFFAOYSA-N 0 0 395.375 3.269 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)CCOc1ccc(Cl)cc1 ZINC000128036691 1415898022 /nfs/dbraw/zinc/89/80/22/1415898022.db2.gz BNJSCERHMSSPNJ-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN COc1ccccc1-c1nn(C)cc1C(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000128041330 1415899177 /nfs/dbraw/zinc/89/91/77/1415899177.db2.gz JCWXPMJUGAAFLO-UHFFFAOYSA-N 0 0 378.388 3.207 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)CCOc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000128040661 1415899461 /nfs/dbraw/zinc/89/94/61/1415899461.db2.gz CJPNGFSPOXFCTC-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)n1 ZINC000178201725 1429016993 /nfs/dbraw/zinc/01/69/93/1429016993.db2.gz CHIZUKJKXWZEPU-UHFFFAOYSA-N 0 0 378.791 3.053 20 5 GGBDRN CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2N)c1 ZINC000178201229 1429017128 /nfs/dbraw/zinc/01/71/28/1429017128.db2.gz LSLNLRVCZHIFBO-SANMLTNESA-N 0 0 375.450 3.477 20 5 GGBDRN CC(=O)N(CCc1ccccc1)CC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000128089513 1415910004 /nfs/dbraw/zinc/91/00/04/1415910004.db2.gz DROANLHVFROKAI-MRXNPFEDSA-N 0 0 383.448 3.172 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H](c1ccccc1)N1CCSCC1 ZINC000128093035 1415910948 /nfs/dbraw/zinc/91/09/48/1415910948.db2.gz HRLTUGLWMVIBAV-QGZVFWFLSA-N 0 0 375.425 3.463 20 5 GGBDRN O=C(CNc1ccc(OC(F)(F)F)cc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178241234 1429028680 /nfs/dbraw/zinc/02/86/80/1429028680.db2.gz DDVXDTNDNSRHTL-UHFFFAOYSA-N 0 0 381.310 3.495 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCN(C(=O)C2CCCC2)C1 ZINC000128145734 1415924074 /nfs/dbraw/zinc/92/40/74/1415924074.db2.gz WHJBVHPZPFMUHD-LBPRGKRZSA-N 0 0 380.832 3.161 20 5 GGBDRN Cn1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1ccncc1 ZINC000128154452 1415926946 /nfs/dbraw/zinc/92/69/46/1415926946.db2.gz ZHFKUHIGUTYURJ-UHFFFAOYSA-N 0 0 395.404 3.128 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000128165383 1415929531 /nfs/dbraw/zinc/92/95/31/1415929531.db2.gz IPYBOEUOIJHQFB-UHFFFAOYSA-N 0 0 390.783 3.119 20 5 GGBDRN C[C@@H](OC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1 ZINC000128168395 1415930133 /nfs/dbraw/zinc/93/01/33/1415930133.db2.gz XWKIQKNQLBCQCA-SECBINFHSA-N 0 0 385.344 3.195 20 5 GGBDRN COc1cc(F)c([C@@H](C)NCC(=O)Nc2ccccc2[N+](=O)[O-])cc1OC ZINC000178207106 1429018932 /nfs/dbraw/zinc/01/89/32/1429018932.db2.gz LLRSIYXEQRHBRO-LLVKDONJSA-N 0 0 377.372 3.040 20 5 GGBDRN CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000128171635 1415930879 /nfs/dbraw/zinc/93/08/79/1415930879.db2.gz BYJXTTKBXQKNAB-QGZVFWFLSA-N 0 0 391.468 3.433 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1C ZINC000128174909 1415931301 /nfs/dbraw/zinc/93/13/01/1415931301.db2.gz GAVAEUFWSDGDGR-UHFFFAOYSA-N 0 0 394.391 3.003 20 5 GGBDRN Cn1c(Cl)cnc1COc1cc([N+](=O)[O-])ccc1I ZINC000128174015 1415931494 /nfs/dbraw/zinc/93/14/94/1415931494.db2.gz ZVSIBRWBPXIFEN-UHFFFAOYSA-N 0 0 393.568 3.165 20 5 GGBDRN Cc1nn(C)c(C(=O)OCc2nc3cc(C(F)(F)F)ccc3o2)c1[N+](=O)[O-] ZINC000128184695 1415934220 /nfs/dbraw/zinc/93/42/20/1415934220.db2.gz SZMVNJXDEKNMPW-UHFFFAOYSA-N 0 0 384.270 3.154 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)Oc3cc(C)ccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000178213568 1429019776 /nfs/dbraw/zinc/01/97/76/1429019776.db2.gz GUHSMDSPAOXSJI-ZDUSSCGKSA-N 0 0 393.403 3.220 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1cc(OC)ccc1OC(F)F ZINC000128187637 1415934826 /nfs/dbraw/zinc/93/48/26/1415934826.db2.gz DRYUCSQOAAQXCU-UHFFFAOYSA-N 0 0 381.335 3.177 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(CCO)Cc1ccccc1 ZINC000128191942 1415935336 /nfs/dbraw/zinc/93/53/36/1415935336.db2.gz PNCBYYAHIOVYBE-UHFFFAOYSA-N 0 0 386.451 3.176 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)[C@@H](OC)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000128190610 1415935416 /nfs/dbraw/zinc/93/54/16/1415935416.db2.gz MGLNPULXAZZATD-MGPLVRAMSA-N 0 0 380.832 3.430 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OCc2ccc(CO)cc2)c1 ZINC000128197508 1415936600 /nfs/dbraw/zinc/93/66/00/1415936600.db2.gz PFKHFFPQSBXXFA-UHFFFAOYSA-N 0 0 385.157 3.271 20 5 GGBDRN CC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000128200747 1415937279 /nfs/dbraw/zinc/93/72/79/1415937279.db2.gz YHTCARBUZBZPRY-SFHVURJKSA-N 0 0 381.432 3.125 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000178222410 1429022368 /nfs/dbraw/zinc/02/23/68/1429022368.db2.gz XUTRVWUSJDLGOI-AWEZNQCLSA-N 0 0 394.214 3.437 20 5 GGBDRN C[C@@H]1CCN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H](C)C1 ZINC000128272826 1415952287 /nfs/dbraw/zinc/95/22/87/1415952287.db2.gz CNSBOUFDVOJNPA-MNOVXSKESA-N 0 0 385.367 3.029 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1cc2ccccc2s1 ZINC000128275234 1415952358 /nfs/dbraw/zinc/95/23/58/1415952358.db2.gz OPLMOQOOZVSMIJ-MRXNPFEDSA-N 0 0 385.445 3.385 20 5 GGBDRN CC(C)NS(=O)(=O)c1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000128280011 1415953686 /nfs/dbraw/zinc/95/36/86/1415953686.db2.gz KXMHVVXJEBACLW-UHFFFAOYSA-N 0 0 397.840 3.187 20 5 GGBDRN Cc1nnnn1-c1cccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000128291314 1415956246 /nfs/dbraw/zinc/95/62/46/1415956246.db2.gz IDAXHTOJLBMOMJ-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN O=C(CN1CC[C@@H](Oc2ccccc2Cl)C1)Nc1ccccc1[N+](=O)[O-] ZINC000128319140 1415961899 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388.387 3.283 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1NCCCO[C@@H]1CCOC1 ZINC000128360245 1415970502 /nfs/dbraw/zinc/97/05/02/1415970502.db2.gz IUJWIUWEERWYIO-SNVBAGLBSA-N 0 0 379.291 3.129 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1-c1ncco1 ZINC000128381823 1415975405 /nfs/dbraw/zinc/97/54/05/1415975405.db2.gz YFLMQHDQQNSDSY-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1 ZINC000128395593 1415977832 /nfs/dbraw/zinc/97/78/32/1415977832.db2.gz CSUBEJNNIJJPFU-UHFFFAOYSA-N 0 0 381.385 3.138 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000128410992 1415981244 /nfs/dbraw/zinc/98/12/44/1415981244.db2.gz ZEBLLNDOMSPZJN-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN CCCC[C@@H](COC)NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000128417000 1415982523 /nfs/dbraw/zinc/98/25/23/1415982523.db2.gz JXUFCNPOCJOWBV-SFHVURJKSA-N 0 0 388.468 3.391 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000128417356 1415982665 /nfs/dbraw/zinc/98/26/65/1415982665.db2.gz CYDXEIXLWVIMDR-DHZHZOJOSA-N 0 0 389.433 3.398 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OC[C@@H]1CC(=O)N(c2ccccc2)C1 ZINC000128491400 1415999263 /nfs/dbraw/zinc/99/92/63/1415999263.db2.gz KDQPVHILHWWKRF-CQSZACIVSA-N 0 0 393.399 3.215 20 5 GGBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(C)cc2=O)c(C)n1Cc1ccccc1 ZINC000128496401 1416000451 /nfs/dbraw/zinc/00/04/51/1416000451.db2.gz OWGXXDQLLOLXCC-UHFFFAOYSA-N 0 0 379.416 3.414 20 5 GGBDRN Cc1cc(=O)n(CC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1[N+](=O)[O-] ZINC000128499483 1416000517 /nfs/dbraw/zinc/00/05/17/1416000517.db2.gz PNZJJAGSYOLGIJ-UHFFFAOYSA-N 0 0 393.399 3.283 20 5 GGBDRN Cc1ccc(CCC2CCN(C(=O)Cn3cc([N+](=O)[O-])c(C)cc3=O)CC2)cc1 ZINC000128514248 1416003976 /nfs/dbraw/zinc/00/39/76/1416003976.db2.gz QLNPEIYXMOZKHI-UHFFFAOYSA-N 0 0 397.475 3.245 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000128514607 1416004068 /nfs/dbraw/zinc/00/40/68/1416004068.db2.gz RDYWDORXDGGPSM-HNNXBMFYSA-N 0 0 398.868 3.210 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000128522814 1416005386 /nfs/dbraw/zinc/00/53/86/1416005386.db2.gz BJSHZPVNEQKGGW-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000128529705 1416006914 /nfs/dbraw/zinc/00/69/14/1416006914.db2.gz MHAMBQDFORQLPB-UHFFFAOYSA-N 0 0 391.811 3.162 20 5 GGBDRN CCOc1ccc(C(=O)N(C)C)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000128532010 1416007768 /nfs/dbraw/zinc/00/77/68/1416007768.db2.gz JXDVNYZULMKAIU-UHFFFAOYSA-N 0 0 385.420 3.185 20 5 GGBDRN CCNC(=O)c1ccc(Cl)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000128541877 1416008741 /nfs/dbraw/zinc/00/87/41/1416008741.db2.gz HHHISXGTBSVFRU-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CCc1ccc(-c2csc(NC(=O)Cn3cc([N+](=O)[O-])c(C)cc3=O)n2)cc1 ZINC000128550892 1416011652 /nfs/dbraw/zinc/01/16/52/1416011652.db2.gz 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Cc1c(CC(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)cccc1[N+](=O)[O-] ZINC000128597240 1416021268 /nfs/dbraw/zinc/02/12/68/1416021268.db2.gz ZWXBRPCMHLXBQA-AWEZNQCLSA-N 0 0 380.404 3.297 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCc2c(F)ccc(C)c21 ZINC000128599337 1416022064 /nfs/dbraw/zinc/02/20/64/1416022064.db2.gz JBBLGIJUICPATQ-UHFFFAOYSA-N 0 0 380.397 3.192 20 5 GGBDRN Cc1ccc(NC(=O)C2CC2)cc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178282801 1429041501 /nfs/dbraw/zinc/04/15/01/1429041501.db2.gz ZERGXAHSPWTUQG-UHFFFAOYSA-N 0 0 394.431 3.253 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@@H]2CC(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000128640475 1416031587 /nfs/dbraw/zinc/03/15/87/1416031587.db2.gz YCZQHMYEGUFWMT-OAHLLOKOSA-N 0 0 384.436 3.100 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@H]2CC(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000128640689 1416031782 /nfs/dbraw/zinc/03/17/82/1416031782.db2.gz YCZQHMYEGUFWMT-HNNXBMFYSA-N 0 0 384.436 3.100 20 5 GGBDRN Cc1ccc(OCCN(C)C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000128655187 1416034858 /nfs/dbraw/zinc/03/48/58/1416034858.db2.gz KKBCMYZXKCMPKR-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2C[C@H]3CCCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000178292035 1429043915 /nfs/dbraw/zinc/04/39/15/1429043915.db2.gz MZBZWFIOHUSUJL-ZHALLVOQSA-N 0 0 385.464 3.156 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)ccc1[N+](=O)[O-] ZINC000178246602 1429031499 /nfs/dbraw/zinc/03/14/99/1429031499.db2.gz FHRXZQOIFJKEKR-UHFFFAOYSA-N 0 0 386.433 3.114 20 5 GGBDRN Cc1cc(=O)n(CC(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)cc1[N+](=O)[O-] ZINC000128688511 1416043812 /nfs/dbraw/zinc/04/38/12/1416043812.db2.gz NQSAECRZYOPPHM-FQEVSTJZSA-N 0 0 387.411 3.252 20 5 GGBDRN Cc1cc(C(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000128695755 1416044703 /nfs/dbraw/zinc/04/47/03/1416044703.db2.gz CCMXYOHSCRLXAY-UHFFFAOYSA-N 0 0 377.441 3.469 20 5 GGBDRN COC(=O)C[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccs1 ZINC000128694685 1416044876 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O=C(N[C@H]1CCN(c2ccc(F)cc2F)C1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000128757855 1416060975 /nfs/dbraw/zinc/06/09/75/1416060975.db2.gz PMCFEZAIOATUFY-JTQLQIEISA-N 0 0 383.301 3.160 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)CN(C)c2ccccc21 ZINC000128771675 1416064540 /nfs/dbraw/zinc/06/45/40/1416064540.db2.gz CCXBSKLENVNYII-AWEZNQCLSA-N 0 0 384.436 3.134 20 5 GGBDRN NC(=O)CCOc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000128771650 1416064645 /nfs/dbraw/zinc/06/46/45/1416064645.db2.gz GDWFPDMOBHYHSZ-UHFFFAOYSA-N 0 0 397.309 3.120 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)c1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-] ZINC000128773753 1416065386 /nfs/dbraw/zinc/06/53/86/1416065386.db2.gz RCFKNMHKGYNHBN-HNNXBMFYSA-N 0 0 391.811 3.456 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccco1)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000128786618 1416068355 /nfs/dbraw/zinc/06/83/55/1416068355.db2.gz UQPOIEIRNBYVTP-CABZTGNLSA-N 0 0 385.323 3.423 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000128798092 1416071481 /nfs/dbraw/zinc/07/14/81/1416071481.db2.gz MOEVBLONMLQITN-KRWDZBQOSA-N 0 0 387.461 3.290 20 5 GGBDRN O=C(c1ncoc1-c1ccc(F)cc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000128803069 1416072230 /nfs/dbraw/zinc/07/22/30/1416072230.db2.gz UCFVSECDYHVVNG-UHFFFAOYSA-N 0 0 396.378 3.351 20 5 GGBDRN C[C@@H](c1ccccc1F)S(=O)(=O)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000128803484 1416072642 /nfs/dbraw/zinc/07/26/42/1416072642.db2.gz YQLXIPJVCAIZAZ-NSHDSACASA-N 0 0 381.381 3.276 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCOC[C@H]1C1CC1 ZINC000128822278 1416078025 /nfs/dbraw/zinc/07/80/25/1416078025.db2.gz TZWOHOMXNKKBNJ-HNNXBMFYSA-N 0 0 387.358 3.053 20 5 GGBDRN COc1cc(N2CCC(OC(=O)CCc3ccccn3)CC2)ccc1[N+](=O)[O-] ZINC000128834460 1416080641 /nfs/dbraw/zinc/08/06/41/1416080641.db2.gz BHWXZFFLKOIGOL-UHFFFAOYSA-N 0 0 385.420 3.143 20 5 GGBDRN O=C(Nc1cccnc1OCC(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000128840702 1416082907 /nfs/dbraw/zinc/08/29/07/1416082907.db2.gz 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GGBDRN C[C@H](Nc1ccc(C(=O)N2CCOC[C@@H]2C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000128912337 1416100021 /nfs/dbraw/zinc/10/00/21/1416100021.db2.gz JGHLFBFDIWVJIC-VBKZILBWSA-N 0 0 396.447 3.414 20 5 GGBDRN CC[C@H]1CCC[C@@H](NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)C1 ZINC000128914800 1416101053 /nfs/dbraw/zinc/10/10/53/1416101053.db2.gz OYVXLLMMEWEAFH-LSDHHAIUSA-N 0 0 384.436 3.148 20 5 GGBDRN CC[C@@H]1CCC[C@@H](NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)C1 ZINC000128914601 1416101226 /nfs/dbraw/zinc/10/12/26/1416101226.db2.gz OYVXLLMMEWEAFH-HUUCEWRRSA-N 0 0 384.436 3.148 20 5 GGBDRN CC[C@@H](CCO)CNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000128922425 1416102710 /nfs/dbraw/zinc/10/27/10/1416102710.db2.gz HFEXTBCZICVIMS-XHSDSOJGSA-N 0 0 377.485 3.216 20 5 GGBDRN Cc1cc(Cl)ncc1NC(=O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000178309052 1429048407 /nfs/dbraw/zinc/04/84/07/1429048407.db2.gz GJKLQEZQODBGRT-UHFFFAOYSA-N 0 0 390.827 3.029 20 5 GGBDRN 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Cc1c(CC(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)cccc1[N+](=O)[O-] ZINC000129538493 1416224418 /nfs/dbraw/zinc/22/44/18/1416224418.db2.gz QNRZETHKXJWHDW-UHFFFAOYSA-N 0 0 395.390 3.434 20 5 GGBDRN O=C(CNC(=O)c1cccc(Cl)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129545924 1416225448 /nfs/dbraw/zinc/22/54/48/1416225448.db2.gz KRYJWJOYMKEUID-UHFFFAOYSA-N 0 0 387.823 3.169 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)c1[N+](=O)[O-] ZINC000129548284 1416225923 /nfs/dbraw/zinc/22/59/23/1416225923.db2.gz VXCKNFLEGQIBEN-LBPRGKRZSA-N 0 0 391.403 3.253 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129553442 1416226895 /nfs/dbraw/zinc/22/68/95/1416226895.db2.gz MPZHVPGWJKQSHR-UHFFFAOYSA-N 0 0 389.339 3.212 20 5 GGBDRN CCc1[nH]c(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C)c1C(=O)OC ZINC000129565547 1416229310 /nfs/dbraw/zinc/22/93/10/1416229310.db2.gz STUGANKXYHEKBQ-UHFFFAOYSA-N 0 0 385.420 3.385 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000129570735 1416230237 /nfs/dbraw/zinc/23/02/37/1416230237.db2.gz QBORZYIXPJOLHZ-UHFFFAOYSA-N 0 0 384.367 3.232 20 5 GGBDRN Cc1ccn(CC(=O)Nc2ccccc2Cc2ccccc2)c(=O)c1[N+](=O)[O-] ZINC000129584253 1416232781 /nfs/dbraw/zinc/23/27/81/1416232781.db2.gz UJADHVJHJKYSDG-UHFFFAOYSA-N 0 0 377.400 3.294 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H](O)c1ccc2ccccc2c1 ZINC000129586357 1416232969 /nfs/dbraw/zinc/23/29/69/1416232969.db2.gz IMSOFBXOPURZCG-IBGZPJMESA-N 0 0 380.400 3.367 20 5 GGBDRN O=C(CCc1nc(-c2ccoc2)no1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129599170 1416234919 /nfs/dbraw/zinc/23/49/19/1416234919.db2.gz ZDHNRGAORDZNKC-UHFFFAOYSA-N 0 0 382.376 3.362 20 5 GGBDRN Cc1ccn(CC(=O)c2ccc(NC(=O)c3ccccc3)cc2)c(=O)c1[N+](=O)[O-] ZINC000129613712 1416237245 /nfs/dbraw/zinc/23/72/45/1416237245.db2.gz GNLLGVWVABMJCG-UHFFFAOYSA-N 0 0 391.383 3.200 20 5 GGBDRN C[C@H](NC(=O)OCc1ccccc1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129617673 1416237855 /nfs/dbraw/zinc/23/78/55/1416237855.db2.gz 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ZINC000129682872 1416248014 /nfs/dbraw/zinc/24/80/14/1416248014.db2.gz AYIBRRWWROAHCJ-UHFFFAOYSA-N 0 0 377.347 3.439 20 5 GGBDRN Cc1ccc(-c2noc(CCC(=O)NCc3ccccc3[N+](=O)[O-])n2)cc1F ZINC000129687033 1416248424 /nfs/dbraw/zinc/24/84/24/1416248424.db2.gz NPCZMPZDHAKXKA-UHFFFAOYSA-N 0 0 384.367 3.341 20 5 GGBDRN CN(Cc1c(F)cccc1Cl)C(=O)COc1cc(C=O)ccc1[N+](=O)[O-] ZINC000129702995 1416251377 /nfs/dbraw/zinc/25/13/77/1416251377.db2.gz BZYKXSBQRPMEIE-UHFFFAOYSA-N 0 0 380.759 3.237 20 5 GGBDRN O=C(c1cn(Cc2cccc(F)c2)nn1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129733628 1416255639 /nfs/dbraw/zinc/25/56/39/1416255639.db2.gz QICBMMJXQBJGNG-UHFFFAOYSA-N 0 0 395.394 3.179 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000129748531 1416257834 /nfs/dbraw/zinc/25/78/34/1416257834.db2.gz FBQVYEGJXNBSTG-OAHLLOKOSA-N 0 0 396.490 3.167 20 5 GGBDRN Cn1cc(Nc2cccc(C(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)c2)cn1 ZINC000129756849 1416259248 /nfs/dbraw/zinc/25/92/48/1416259248.db2.gz 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O=C(Nc1cccc(F)c1F)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129932786 1416287331 /nfs/dbraw/zinc/28/73/31/1416287331.db2.gz MNYWUXDZFCXNPZ-UHFFFAOYSA-N 0 0 375.331 3.003 20 5 GGBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1cc(F)ccc1F ZINC000129932878 1416287502 /nfs/dbraw/zinc/28/75/02/1416287502.db2.gz RYOODCNSNXZUGL-MRXNPFEDSA-N 0 0 398.387 3.158 20 5 GGBDRN CCC[C@H](NCc1ccccc1S(=O)(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000129934731 1416287813 /nfs/dbraw/zinc/28/78/13/1416287813.db2.gz ZKHZZMXELQNKAN-SFHVURJKSA-N 0 0 391.493 3.476 20 5 GGBDRN CCCCn1ncc(NC(=O)C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000129940846 1416288678 /nfs/dbraw/zinc/28/86/78/1416288678.db2.gz OLBMLRVUVOAWTI-UHFFFAOYSA-N 0 0 399.451 3.030 20 5 GGBDRN CCOc1cc(-c2ccccc2)sc1C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000129940935 1416288732 /nfs/dbraw/zinc/28/87/32/1416288732.db2.gz DVKVALFQECFFHI-UHFFFAOYSA-N 0 0 386.433 3.349 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129942902 1416288923 /nfs/dbraw/zinc/28/89/23/1416288923.db2.gz NGQDBKRBQXVBGF-UHFFFAOYSA-N 0 0 393.321 3.142 20 5 GGBDRN O=C(Nc1cccc2cccnc21)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129948616 1416289453 /nfs/dbraw/zinc/28/94/53/1416289453.db2.gz UQQKRWRTSCKTTC-UHFFFAOYSA-N 0 0 390.399 3.273 20 5 GGBDRN O=C(C(=O)N1CCCc2ccc(F)cc21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129946516 1416289580 /nfs/dbraw/zinc/28/95/80/1416289580.db2.gz LDPSEPVLJFHWHF-UHFFFAOYSA-N 0 0 397.406 3.204 20 5 GGBDRN CSc1ccccc1NC(=O)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129955301 1416290322 /nfs/dbraw/zinc/29/03/22/1416290322.db2.gz ZPQZGSUWUNSTFA-UHFFFAOYSA-N 0 0 385.445 3.446 20 5 GGBDRN CN(CC(=O)O[C@@H](c1cccnc1)c1ccccc1[N+](=O)[O-])[C@@H]1CCSC1 ZINC000129984216 1416296339 /nfs/dbraw/zinc/29/63/39/1416296339.db2.gz FTROLYQKHFKJOZ-BEFAXECRSA-N 0 0 387.461 3.060 20 5 GGBDRN O=C(Nc1cc(F)cc(F)c1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000129992101 1416298243 /nfs/dbraw/zinc/29/82/43/1416298243.db2.gz 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OWYJFBPUBQMHKT-ZDUSSCGKSA-N 0 0 375.404 3.235 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)c1c(Cl)cccc1Cl ZINC000131726310 1416605346 /nfs/dbraw/zinc/60/53/46/1416605346.db2.gz FSGJKMHZHNYGMS-CYBMUJFWSA-N 0 0 385.203 3.374 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000131728069 1416605880 /nfs/dbraw/zinc/60/58/80/1416605880.db2.gz CWMMGZLIHYTVEC-NVXWUHKLSA-N 0 0 381.432 3.038 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc(-c2ccncc2)no1 ZINC000131730145 1416606618 /nfs/dbraw/zinc/60/66/18/1416606618.db2.gz RZMLXVABSNCDEU-UHFFFAOYSA-N 0 0 385.405 3.082 20 5 GGBDRN Cc1cc(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)c(N)c([N+](=O)[O-])c1 ZINC000131739959 1416608408 /nfs/dbraw/zinc/60/84/08/1416608408.db2.gz MWUHWSXBJSLIOV-ZDUSSCGKSA-N 0 0 384.219 3.256 20 5 GGBDRN Cc1ccc(OCc2nnc(C(=O)NCc3ccccc3)s2)cc1[N+](=O)[O-] ZINC000131745114 1416609781 /nfs/dbraw/zinc/60/97/81/1416609781.db2.gz YZBVXHAMVAEXKW-UHFFFAOYSA-N 0 0 384.417 3.264 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccc(F)cc1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178578244 1429112131 /nfs/dbraw/zinc/11/21/31/1429112131.db2.gz SYGDHDWBFCGLNW-DJJJIMSYSA-N 0 0 398.394 3.162 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000131750998 1416611530 /nfs/dbraw/zinc/61/15/30/1416611530.db2.gz FXGQPHFBMBQSBN-LBPRGKRZSA-N 0 0 389.358 3.190 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC000131753611 1416612166 /nfs/dbraw/zinc/61/21/66/1416612166.db2.gz GGCLLNIFUFNHIN-KRWDZBQOSA-N 0 0 395.419 3.034 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1[N+](=O)[O-] ZINC000131756384 1416613406 /nfs/dbraw/zinc/61/34/06/1416613406.db2.gz FSCGLGGCJSBTAK-MJGOQNOKSA-N 0 0 397.431 3.096 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178578263 1429112343 /nfs/dbraw/zinc/11/23/43/1429112343.db2.gz SYGDHDWBFCGLNW-ORAYPTAESA-N 0 0 398.394 3.162 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])ccc1N ZINC000131775193 1416617399 /nfs/dbraw/zinc/61/73/99/1416617399.db2.gz TVIODJUQDROVOU-KRWDZBQOSA-N 0 0 385.420 3.298 20 5 GGBDRN Cc1cc(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])ccc1N ZINC000131775387 1416617437 /nfs/dbraw/zinc/61/74/37/1416617437.db2.gz TVIODJUQDROVOU-QGZVFWFLSA-N 0 0 385.420 3.298 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1 ZINC000131788733 1416620636 /nfs/dbraw/zinc/62/06/36/1416620636.db2.gz PAGIDVOCOUVVAR-CQSZACIVSA-N 0 0 386.379 3.478 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1 ZINC000131788539 1416620748 /nfs/dbraw/zinc/62/07/48/1416620748.db2.gz PAGIDVOCOUVVAR-AWEZNQCLSA-N 0 0 386.379 3.478 20 5 GGBDRN CNC(=O)c1ccc(N2CC[C@H](Oc3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000131800742 1416624210 /nfs/dbraw/zinc/62/42/10/1416624210.db2.gz CLJXQIBFEIFLCX-ZDUSSCGKSA-N 0 0 375.812 3.266 20 5 GGBDRN CC(=O)N[C@H](CC(=O)Oc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000131802807 1416624836 /nfs/dbraw/zinc/62/48/36/1416624836.db2.gz XODOKQXGGPTKDP-MRXNPFEDSA-N 0 0 378.331 3.354 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Oc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000131802632 1416624959 /nfs/dbraw/zinc/62/49/59/1416624959.db2.gz XODOKQXGGPTKDP-INIZCTEOSA-N 0 0 378.331 3.354 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc(-c3csnn3)cc2)cc([N+](=O)[O-])c1F ZINC000131807884 1416626066 /nfs/dbraw/zinc/62/60/66/1416626066.db2.gz DLSJPIZDFCKTMA-UHFFFAOYSA-N 0 0 394.409 3.362 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000131817965 1416627775 /nfs/dbraw/zinc/62/77/75/1416627775.db2.gz LVJTYBCQBRTGKO-UHFFFAOYSA-N 0 0 386.799 3.103 20 5 GGBDRN O=C(NCc1cn(-c2ccccc2)nn1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000131841228 1416633151 /nfs/dbraw/zinc/63/31/51/1416633151.db2.gz QLWMWIUWVYUOLJ-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)cc1[N+](=O)[O-] ZINC000131852726 1416635064 /nfs/dbraw/zinc/63/50/64/1416635064.db2.gz CSWOIBOYZPLVNW-UHFFFAOYSA-N 0 0 386.433 3.468 20 5 GGBDRN Cc1ccc(-n2cnnc2SCC(=O)Oc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000131909436 1416648586 /nfs/dbraw/zinc/64/85/86/1416648586.db2.gz RYNQVKAOBLBUGX-UHFFFAOYSA-N 0 0 384.417 3.490 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)n1 ZINC000131921128 1416651611 /nfs/dbraw/zinc/65/16/11/1416651611.db2.gz PSSZMTNWEFQCIP-UHFFFAOYSA-N 0 0 395.423 3.026 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc2c(c1)CC(=O)N2 ZINC000131932863 1416654349 /nfs/dbraw/zinc/65/43/49/1416654349.db2.gz LKLSTTILZVISCJ-ZDUSSCGKSA-N 0 0 394.431 3.181 20 5 GGBDRN O=C(Nc1ccnn1C[C@@H]1CCOC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000131933623 1416655036 /nfs/dbraw/zinc/65/50/36/1416655036.db2.gz CODPYOHGVBFPEL-JTQLQIEISA-N 0 0 384.314 3.099 20 5 GGBDRN O=C(NCc1ccc(OCC2CC2)nc1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000131938316 1416655489 /nfs/dbraw/zinc/65/54/89/1416655489.db2.gz SGTMPJFZVKHZCD-UHFFFAOYSA-N 0 0 378.388 3.257 20 5 GGBDRN Cc1c(C(=O)NCc2csc(-c3ccco3)n2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000131950700 1416657867 /nfs/dbraw/zinc/65/78/67/1416657867.db2.gz YDLUPASAMJSERS-UHFFFAOYSA-N 0 0 388.361 3.458 20 5 GGBDRN Cc1cc(Cl)ncc1NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000131964239 1416660801 /nfs/dbraw/zinc/66/08/01/1416660801.db2.gz IOUPORKBNNUOBE-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN COCCOc1cc(C)ccc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000131974564 1416663929 /nfs/dbraw/zinc/66/39/29/1416663929.db2.gz YBXDVWRDUKVIRT-UHFFFAOYSA-N 0 0 392.839 3.441 20 5 GGBDRN O=C(Nc1cc(-c2cccnc2)[nH]n1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000131999729 1416670261 /nfs/dbraw/zinc/67/02/61/1416670261.db2.gz CVYGRQQSKRDMQJ-UHFFFAOYSA-N 0 0 378.392 3.232 20 5 GGBDRN Cc1cccc([C@H](O)CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000132018523 1416675110 /nfs/dbraw/zinc/67/51/10/1416675110.db2.gz JLIJTWWXOQWBSB-OAHLLOKOSA-N 0 0 379.210 3.129 20 5 GGBDRN O=C(Nc1cccc(-c2cn[nH]c2)c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000132050665 1416682980 /nfs/dbraw/zinc/68/29/80/1416682980.db2.gz HKQYVJJMQJTJCA-UHFFFAOYSA-N 0 0 393.403 3.074 20 5 GGBDRN O=C(Nc1ccccc1CN1CCOCC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000132081094 1416690678 /nfs/dbraw/zinc/69/06/78/1416690678.db2.gz KYQMXQQJCUIBKN-UHFFFAOYSA-N 0 0 396.447 3.017 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N(Cc1ccccc1F)C1CCCCC1 ZINC000178605275 1429119487 /nfs/dbraw/zinc/11/94/87/1429119487.db2.gz JOQHFFMBKBHMNP-UHFFFAOYSA-N 0 0 389.431 3.475 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000132104330 1416696860 /nfs/dbraw/zinc/69/68/60/1416696860.db2.gz SURGLVRZOMMFMU-CQSZACIVSA-N 0 0 391.786 3.313 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000132112067 1416698832 /nfs/dbraw/zinc/69/88/32/1416698832.db2.gz VIHNGUDGXUJGFM-UHFFFAOYSA-N 0 0 392.165 3.468 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)n1 ZINC000132122319 1416701759 /nfs/dbraw/zinc/70/17/59/1416701759.db2.gz MUQRKMIFJARGGT-UHFFFAOYSA-N 0 0 394.431 3.499 20 5 GGBDRN C[C@H](c1ccc(F)c(F)c1)S(=O)(=O)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000132138610 1416705746 /nfs/dbraw/zinc/70/57/46/1416705746.db2.gz SFSYAFUCBGYJSR-SNVBAGLBSA-N 0 0 399.371 3.416 20 5 GGBDRN C[C@@H](c1ccc(F)c(F)c1)S(=O)(=O)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000132138373 1416705909 /nfs/dbraw/zinc/70/59/09/1416705909.db2.gz SFSYAFUCBGYJSR-JTQLQIEISA-N 0 0 399.371 3.416 20 5 GGBDRN COc1cc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)ccc1OCc1cnn(C)c1 ZINC000132140144 1416706421 /nfs/dbraw/zinc/70/64/21/1416706421.db2.gz PLZAZVNPMRODLO-UHFFFAOYSA-N 0 0 396.403 3.193 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1F ZINC000132177391 1416712283 /nfs/dbraw/zinc/71/22/83/1416712283.db2.gz HSYNZOPPNPJVMF-KRWDZBQOSA-N 0 0 389.358 3.030 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(C(=O)N(C)C)cc1 ZINC000132185632 1416713662 /nfs/dbraw/zinc/71/36/62/1416713662.db2.gz YMJGPQASRQLWLQ-UHFFFAOYSA-N 0 0 387.461 3.339 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)NCc2ccc([C@@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000178613580 1429122492 /nfs/dbraw/zinc/12/24/92/1429122492.db2.gz ROOCAJYIVHYQNK-LLVKDONJSA-N 0 0 384.841 3.088 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N[C@H](C)Cc1c(F)cccc1F ZINC000132232504 1416721149 /nfs/dbraw/zinc/72/11/49/1416721149.db2.gz UDEYKVWWCTURDV-LLVKDONJSA-N 0 0 380.347 3.008 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 ZINC000132238053 1416721944 /nfs/dbraw/zinc/72/19/44/1416721944.db2.gz RFBLFWDBNWJEPE-LLVKDONJSA-N 0 0 380.347 3.480 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(-c2cnco2)cc1 ZINC000132290827 1416730369 /nfs/dbraw/zinc/73/03/69/1416730369.db2.gz BKGIGFBNMITSRS-UHFFFAOYSA-N 0 0 377.353 3.498 20 5 GGBDRN Cc1oc(-c2ccccc2)nc1Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1 ZINC000132303634 1416731834 /nfs/dbraw/zinc/73/18/34/1416731834.db2.gz FCWVVNDRQNZEOU-UHFFFAOYSA-N 0 0 378.344 3.423 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000132306639 1416732454 /nfs/dbraw/zinc/73/24/54/1416732454.db2.gz VWVVFGBYTVSTGD-UHFFFAOYSA-N 0 0 376.800 3.272 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1ncc(-c2ccc(F)cc2)o1 ZINC000132305156 1416732630 /nfs/dbraw/zinc/73/26/30/1416732630.db2.gz GTBLRAAUFONNSB-UHFFFAOYSA-N 0 0 382.307 3.254 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1ccc(CC[NH+]2CCCC2)cc1 ZINC000132316114 1416734267 /nfs/dbraw/zinc/73/42/67/1416734267.db2.gz FMXSMJRDCHWESQ-UHFFFAOYSA-N 0 0 375.450 3.034 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1nc(-c2ccc(Cl)cc2)no1 ZINC000132318394 1416735308 /nfs/dbraw/zinc/73/53/08/1416735308.db2.gz OGRDNGGMXIPVCK-UHFFFAOYSA-N 0 0 399.750 3.163 20 5 GGBDRN CCC[C@H](NC(=O)Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000132321951 1416735781 /nfs/dbraw/zinc/73/57/81/1416735781.db2.gz GYHVXFNJTKGUPM-KRWDZBQOSA-N 0 0 396.403 3.069 20 5 GGBDRN Cc1c(CC(=O)N[C@@H](C)c2ccc(N3CCOC3=O)cc2)cccc1[N+](=O)[O-] ZINC000178625966 1429124466 /nfs/dbraw/zinc/12/44/66/1429124466.db2.gz PPVKGBJISGFITO-AWEZNQCLSA-N 0 0 383.404 3.280 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000132329882 1416737853 /nfs/dbraw/zinc/73/78/53/1416737853.db2.gz RNQSYGDFDZPSSK-CABCVRRESA-N 0 0 375.425 3.177 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1nnc(-c2ccccc2Cl)o1 ZINC000132339328 1416740583 /nfs/dbraw/zinc/74/05/83/1416740583.db2.gz JXZZSJNQMAGKCD-UHFFFAOYSA-N 0 0 399.750 3.163 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1cccc(COCC(F)(F)F)c1 ZINC000132349249 1416741969 /nfs/dbraw/zinc/74/19/69/1416741969.db2.gz UXFGLKYOWRKVCY-UHFFFAOYSA-N 0 0 398.337 3.369 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1 ZINC000132348196 1416742043 /nfs/dbraw/zinc/74/20/43/1416742043.db2.gz WBUCMKLLTWQFII-UHFFFAOYSA-N 0 0 388.767 3.012 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N(C)CCCOc1ccccc1 ZINC000132348422 1416742128 /nfs/dbraw/zinc/74/21/28/1416742128.db2.gz BQSXEZZMGCUTSI-UHFFFAOYSA-N 0 0 382.413 3.132 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCc1nc2ccccc2s1 ZINC000132355381 1416743401 /nfs/dbraw/zinc/74/34/01/1416743401.db2.gz HRYDMDAHFQDZMG-UHFFFAOYSA-N 0 0 381.410 3.131 20 5 GGBDRN O=C(Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc2ccccc21 ZINC000132364359 1416745671 /nfs/dbraw/zinc/74/56/71/1416745671.db2.gz LPICFRDPCGLBEI-UHFFFAOYSA-N 0 0 390.355 3.203 20 5 GGBDRN COc1ccc([C@H]2CCCN2Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)cc1 ZINC000132369646 1416746727 /nfs/dbraw/zinc/74/67/27/1416746727.db2.gz HJYPAXCUDRGPCI-GOSISDBHSA-N 0 0 396.403 3.215 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000132379098 1416748557 /nfs/dbraw/zinc/74/85/57/1416748557.db2.gz WODVJKCEPPVXPE-SFHVURJKSA-N 0 0 399.472 3.376 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1 ZINC000132398248 1416752409 /nfs/dbraw/zinc/75/24/09/1416752409.db2.gz FNMZVOHVDOIUQS-LLVKDONJSA-N 0 0 395.412 3.063 20 5 GGBDRN CC1(C)SC(=O)N(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)C1=O ZINC000132397897 1416752788 /nfs/dbraw/zinc/75/27/88/1416752788.db2.gz OEFFXZIQMSIPDH-UHFFFAOYSA-N 0 0 391.371 3.391 20 5 GGBDRN Cn1c2ccc(NC(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)cc2nc1C(C)(C)C ZINC000132409371 1416754539 /nfs/dbraw/zinc/75/45/39/1416754539.db2.gz ZSTCBDXGEZCSHF-UHFFFAOYSA-N 0 0 384.440 3.349 20 5 GGBDRN CO[C@H]1CCCN([C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000178634053 1429126506 /nfs/dbraw/zinc/12/65/06/1429126506.db2.gz XPDIPQCGWQKFDT-WFASDCNBSA-N 0 0 390.465 3.156 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N2CCc3ccsc3C2)c([N+](=O)[O-])c1 ZINC000132446039 1416761446 /nfs/dbraw/zinc/76/14/46/1416761446.db2.gz ZBVAPFHSWDVQDQ-UHFFFAOYSA-N 0 0 395.506 3.250 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@@H](C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000132451907 1416763242 /nfs/dbraw/zinc/76/32/42/1416763242.db2.gz SRIORWMLNCNDEA-OAHLLOKOSA-N 0 0 386.379 3.121 20 5 GGBDRN O=C(N[C@H]1CCO[C@]2(CCSC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000132453543 1416763883 /nfs/dbraw/zinc/76/38/83/1416763883.db2.gz CULCYRMMRGTFIR-SWLSCSKDSA-N 0 0 390.383 3.398 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000132474852 1416768705 /nfs/dbraw/zinc/76/87/05/1416768705.db2.gz GDRORAYHTFKURB-UHFFFAOYSA-N 0 0 376.800 3.272 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)Oc3cc(F)cc([N+](=O)[O-])c3)cc2)no1 ZINC000132489452 1416771925 /nfs/dbraw/zinc/77/19/25/1416771925.db2.gz RFQIBCKGHAUBSJ-UHFFFAOYSA-N 0 0 387.323 3.478 20 5 GGBDRN CCCN(CCC)C(=O)CCC(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000132490489 1416772052 /nfs/dbraw/zinc/77/20/52/1416772052.db2.gz FAQMCKULPIHMJW-UHFFFAOYSA-N 0 0 387.440 3.148 20 5 GGBDRN COc1ccc2c(c1)C=C(C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)CO2 ZINC000132490929 1416772092 /nfs/dbraw/zinc/77/20/92/1416772092.db2.gz DRKHPYYXTQDGGJ-UHFFFAOYSA-N 0 0 392.371 3.204 20 5 GGBDRN COc1cc(F)c(NS(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)cc1F ZINC000132495811 1416773032 /nfs/dbraw/zinc/77/30/32/1416773032.db2.gz RHDWYVGAWNKGMC-UHFFFAOYSA-N 0 0 376.312 3.130 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000132510494 1416775894 /nfs/dbraw/zinc/77/58/94/1416775894.db2.gz LMBACJVORQEJSQ-UHFFFAOYSA-N 0 0 396.447 3.219 20 5 GGBDRN O=C(Oc1cc(F)cc([N+](=O)[O-])c1)[C@@H]1CCCCN1C(=O)c1cccs1 ZINC000132513620 1416776360 /nfs/dbraw/zinc/77/63/60/1416776360.db2.gz GQJZIVDMLPHMOI-AWEZNQCLSA-N 0 0 378.381 3.396 20 5 GGBDRN Cc1c(C(=O)N[C@H](CCCO)c2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000132523625 1416777134 /nfs/dbraw/zinc/77/71/34/1416777134.db2.gz PBEBVSPJNIFEAG-MRXNPFEDSA-N 0 0 387.392 3.363 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000132545832 1416782671 /nfs/dbraw/zinc/78/26/71/1416782671.db2.gz ZCDWLJIICHLVHW-YJBOKZPZSA-N 0 0 385.376 3.462 20 5 GGBDRN COc1ccccc1NC(=O)Cc1noc(-c2cc(Cl)cc([N+](=O)[O-])c2)n1 ZINC000132559782 1416785198 /nfs/dbraw/zinc/78/51/98/1416785198.db2.gz TXMNAYPXCVUUCW-UHFFFAOYSA-N 0 0 388.767 3.488 20 5 GGBDRN Cn1cc(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000132577729 1416787744 /nfs/dbraw/zinc/78/77/44/1416787744.db2.gz XRBWKDPWDUXVBR-UHFFFAOYSA-N 0 0 386.295 3.262 20 5 GGBDRN CCn1c(SCC(=O)Oc2cc(F)cc([N+](=O)[O-])c2)nnc1-c1ccco1 ZINC000132587641 1416789103 /nfs/dbraw/zinc/78/91/03/1416789103.db2.gz XAKIVFMNHRRYLR-UHFFFAOYSA-N 0 0 392.368 3.303 20 5 GGBDRN COc1ccc(-c2noc(CN3CCc4ccc([N+](=O)[O-])cc4C3)n2)c(OC)c1 ZINC000132588980 1416789108 /nfs/dbraw/zinc/78/91/08/1416789108.db2.gz SISYXVDBWUINSU-UHFFFAOYSA-N 0 0 396.403 3.220 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(C[C@@H](O)CO[C@H]1CCCc3ccccc31)CC2 ZINC000132589912 1416789483 /nfs/dbraw/zinc/78/94/83/1416789483.db2.gz FQAQVUJAADGVLD-IRLDBZIGSA-N 0 0 382.460 3.408 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1CNC1(c2ccc(F)cc2F)CCC1 ZINC000132589766 1416789606 /nfs/dbraw/zinc/78/96/06/1416789606.db2.gz HPSACRLSINWTNF-UHFFFAOYSA-N 0 0 387.342 3.096 20 5 GGBDRN 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O=C(NCCc1cccc([N+](=O)[O-])c1)c1cccc(NC(=O)c2cccnc2)c1 ZINC000133152956 1416858113 /nfs/dbraw/zinc/85/81/13/1416858113.db2.gz ZJEJTCYTUKTOJI-UHFFFAOYSA-N 0 0 390.399 3.215 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(C[C@@H](O)c3cccc(Br)c3)n2)cc1 ZINC000133157706 1416858515 /nfs/dbraw/zinc/85/85/15/1416858515.db2.gz KYNFZGPXPGRSBS-OAHLLOKOSA-N 0 0 389.209 3.349 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133162610 1416859517 /nfs/dbraw/zinc/85/95/17/1416859517.db2.gz SOCAUAIYPREBSB-PBHICJAKSA-N 0 0 380.404 3.247 20 5 GGBDRN Cc1cc(NC(=O)COc2cccc([N+](=O)[O-])c2)ccc1N1CCSCC1 ZINC000133205628 1416864286 /nfs/dbraw/zinc/86/42/86/1416864286.db2.gz ZGQJDDFQSOVOCO-UHFFFAOYSA-N 0 0 387.461 3.474 20 5 GGBDRN COc1ccc(CCCN(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000133212695 1416865038 /nfs/dbraw/zinc/86/50/38/1416865038.db2.gz PZQPUIFNIVLTJA-UHFFFAOYSA-N 0 0 394.431 3.494 20 5 GGBDRN CC(C)[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)S(=O)(=O)C1CCCCC1 ZINC000133214490 1416865401 /nfs/dbraw/zinc/86/54/01/1416865401.db2.gz RPWPYXATUUQKCM-SFHVURJKSA-N 0 0 396.509 3.026 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cn1)NCCc1cccc([N+](=O)[O-])c1 ZINC000133241965 1416869289 /nfs/dbraw/zinc/86/92/89/1416869289.db2.gz ONDNJAKRLLNZQW-UHFFFAOYSA-N 0 0 385.367 3.460 20 5 GGBDRN CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000133244063 1416869632 /nfs/dbraw/zinc/86/96/32/1416869632.db2.gz SYTJGKWAJLYVKW-INIZCTEOSA-N 0 0 377.441 3.043 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000133252051 1416870252 /nfs/dbraw/zinc/87/02/52/1416870252.db2.gz HZIBMNDROWSELK-OAHLLOKOSA-N 0 0 379.457 3.193 20 5 GGBDRN Cc1cc(NC(=O)COc2ccccc2[N+](=O)[O-])ccc1N1CCSCC1 ZINC000133259951 1416871233 /nfs/dbraw/zinc/87/12/33/1416871233.db2.gz HMPOGMLQIIOWBE-UHFFFAOYSA-N 0 0 387.461 3.474 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC([C@H](O)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000133261575 1416871614 /nfs/dbraw/zinc/87/16/14/1416871614.db2.gz VVYJDUICUHFWSK-GOSISDBHSA-N 0 0 385.420 3.117 20 5 GGBDRN C[C@@H]1CN(c2ccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2)C[C@@H](C)O1 ZINC000133278361 1416873465 /nfs/dbraw/zinc/87/34/65/1416873465.db2.gz HLXMTQYVUDZBPD-ZIAGYGMSSA-N 0 0 391.449 3.009 20 5 GGBDRN O=C([C@H]1CCCN(CC(F)(F)F)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178679142 1429138960 /nfs/dbraw/zinc/13/89/60/1429138960.db2.gz AQPJPIVLRKWQOG-AWEZNQCLSA-N 0 0 385.386 3.360 20 5 GGBDRN CC(C)[C@H](C)N(C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000133299939 1416876314 /nfs/dbraw/zinc/87/63/14/1416876314.db2.gz IWSJYRUKDLHUIS-JTQLQIEISA-N 0 0 385.367 3.170 20 5 GGBDRN O=C(NC1CCC(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1)C1CCCC1 ZINC000133303801 1416876623 /nfs/dbraw/zinc/87/66/23/1416876623.db2.gz QFQDIKOVJYTFFV-UHFFFAOYSA-N 0 0 387.480 3.119 20 5 GGBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000133336613 1416880110 /nfs/dbraw/zinc/88/01/10/1416880110.db2.gz QFESKCLIRDBIKS-OAHLLOKOSA-N 0 0 379.756 3.274 20 5 GGBDRN CCOC(=O)c1ccnc(NCC2(c3ccccc3)CCOCC2)c1[N+](=O)[O-] ZINC000133360998 1416882340 /nfs/dbraw/zinc/88/23/40/1416882340.db2.gz YYGLUBCIRXWMPJ-UHFFFAOYSA-N 0 0 385.420 3.327 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000133378381 1416884050 /nfs/dbraw/zinc/88/40/50/1416884050.db2.gz SECGDIJRUQDNTI-UKRRQHHQSA-N 0 0 377.441 3.360 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1CN(CCC(F)(F)F)CC1CC1 ZINC000133388968 1416884888 /nfs/dbraw/zinc/88/48/88/1416884888.db2.gz RJTYCYRQQWNLQO-UHFFFAOYSA-N 0 0 386.330 3.033 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)C(=O)Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000133390604 1416885140 /nfs/dbraw/zinc/88/51/40/1416885140.db2.gz VWOFJMILDIQOKN-GFCCVEGCSA-N 0 0 378.454 3.301 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)C(=O)Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000133390415 1416885246 /nfs/dbraw/zinc/88/52/46/1416885246.db2.gz VWOFJMILDIQOKN-LBPRGKRZSA-N 0 0 378.454 3.301 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCO[C@@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000133411782 1416887364 /nfs/dbraw/zinc/88/73/64/1416887364.db2.gz WEGIMYIQLSYEGB-OAHLLOKOSA-N 0 0 391.811 3.398 20 5 GGBDRN O=[N+]([O-])c1cc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000133414295 1416887483 /nfs/dbraw/zinc/88/74/83/1416887483.db2.gz QETGFBNUWNXOPH-UHFFFAOYSA-N 0 0 385.785 3.141 20 5 GGBDRN Cc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)ccc1C(=O)N(C)C ZINC000133423083 1416888367 /nfs/dbraw/zinc/88/83/67/1416888367.db2.gz RRKFLCTXWVIIOW-UHFFFAOYSA-N 0 0 375.812 3.440 20 5 GGBDRN O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC[C@H]1CO ZINC000133446625 1416890663 /nfs/dbraw/zinc/89/06/63/1416890663.db2.gz JVYWOTVLMSVBJP-HNNXBMFYSA-N 0 0 389.839 3.457 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)ccc1C(=O)N(C)C ZINC000133450097 1416890841 /nfs/dbraw/zinc/89/08/41/1416890841.db2.gz ONGMHWAAUPLRIF-UHFFFAOYSA-N 0 0 386.364 3.074 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccc1C(=O)N(C)C ZINC000133448722 1416890852 /nfs/dbraw/zinc/89/08/52/1416890852.db2.gz ZVZVKSWWQJBEPA-UHFFFAOYSA-N 0 0 396.447 3.458 20 5 GGBDRN Cc1cccc(C)c1Cn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O ZINC000133455341 1416891325 /nfs/dbraw/zinc/89/13/25/1416891325.db2.gz WSIXGYSCSBMQPT-UHFFFAOYSA-N 0 0 375.388 3.156 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@H]2CCN(c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000133452887 1416891339 /nfs/dbraw/zinc/89/13/39/1416891339.db2.gz KMTBQFLBJOCFNV-CYBMUJFWSA-N 0 0 388.399 3.244 20 5 GGBDRN COc1ccc(-c2nc(COC(=O)CCc3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000133472756 1416893076 /nfs/dbraw/zinc/89/30/76/1416893076.db2.gz PNXZQSTYSWCBAP-UHFFFAOYSA-N 0 0 383.360 3.329 20 5 GGBDRN Cc1cccc(F)c1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000133480621 1416894010 /nfs/dbraw/zinc/89/40/10/1416894010.db2.gz MYMMSHBLDQMGHL-UHFFFAOYSA-N 0 0 392.412 3.094 20 5 GGBDRN CCc1ccc([C@@H](COC)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000133498684 1416895901 /nfs/dbraw/zinc/89/59/01/1416895901.db2.gz DYSYYEFRWXZKSF-QGZVFWFLSA-N 0 0 384.392 3.053 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCN(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000133502187 1416896095 /nfs/dbraw/zinc/89/60/95/1416896095.db2.gz KACYFOJGGZGJRS-UHFFFAOYSA-N 0 0 390.827 3.147 20 5 GGBDRN COc1cc(F)c(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1OC ZINC000133522131 1416897672 /nfs/dbraw/zinc/89/76/72/1416897672.db2.gz XAYSOOIRQJPWCA-UHFFFAOYSA-N 0 0 375.356 3.341 20 5 GGBDRN Cc1nn(C)c(C(=O)OCc2nc(-c3c(F)cccc3F)cs2)c1[N+](=O)[O-] ZINC000133519001 1416897751 /nfs/dbraw/zinc/89/77/51/1416897751.db2.gz UWBBANCMOVUEKZ-UHFFFAOYSA-N 0 0 394.359 3.395 20 5 GGBDRN Cc1cc(F)ccc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000133528265 1416898210 /nfs/dbraw/zinc/89/82/10/1416898210.db2.gz PDLGVIHENGKMHL-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1nc(-c2c(F)cccc2F)cs1 ZINC000133541848 1416899690 /nfs/dbraw/zinc/89/96/90/1416899690.db2.gz GRPRZDKAEKABJO-UHFFFAOYSA-N 0 0 394.359 3.245 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000133548997 1416900810 /nfs/dbraw/zinc/90/08/10/1416900810.db2.gz AIJGHSJQKDQHPR-UHFFFAOYSA-N 0 0 397.137 3.493 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000133558186 1416903900 /nfs/dbraw/zinc/90/39/00/1416903900.db2.gz ADTBKOXEWRRRFL-ZFWWWQNUSA-N 0 0 377.441 3.360 20 5 GGBDRN COc1ccccc1OC[C@H](C)CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000133568049 1416905695 /nfs/dbraw/zinc/90/56/95/1416905695.db2.gz DHTQFVBFRKMPCQ-OAHLLOKOSA-N 0 0 387.436 3.160 20 5 GGBDRN Cc1cc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccc1C(=O)N(C)C ZINC000133596388 1416914261 /nfs/dbraw/zinc/91/42/61/1416914261.db2.gz ZHHIIOROHUXLAV-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000133624486 1416924071 /nfs/dbraw/zinc/92/40/71/1416924071.db2.gz GQRDQXCQKUIXIW-UHFFFAOYSA-N 0 0 380.404 3.483 20 5 GGBDRN CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000178695852 1429143790 /nfs/dbraw/zinc/14/37/90/1429143790.db2.gz QKBFDVMARFRJIT-LJQANCHMSA-N 0 0 384.432 3.079 20 5 GGBDRN Cc1nc(NC(=O)CCCCCNC(=O)NC2CCCCC2)ccc1[N+](=O)[O-] ZINC000133652633 1416931319 /nfs/dbraw/zinc/93/13/19/1416931319.db2.gz JUOOTWVQAHMVHC-UHFFFAOYSA-N 0 0 391.472 3.429 20 5 GGBDRN Nc1ccc(C(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] ZINC000133665497 1416934241 /nfs/dbraw/zinc/93/42/41/1416934241.db2.gz IZXBHRBAELDXDM-UHFFFAOYSA-N 0 0 384.219 3.119 20 5 GGBDRN CN(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000133673870 1416937154 /nfs/dbraw/zinc/93/71/54/1416937154.db2.gz GEWPBZCPGWJNDK-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)o1 ZINC000133672879 1416937174 /nfs/dbraw/zinc/93/71/74/1416937174.db2.gz XAEOZWFNAHDUGR-SFHVURJKSA-N 0 0 396.403 3.150 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1nc(-c2ccc3c(c2)CCC3)cs1 ZINC000178698257 1429144512 /nfs/dbraw/zinc/14/45/12/1429144512.db2.gz RNLFBHQLUAJWCS-UHFFFAOYSA-N 0 0 396.428 3.007 20 5 GGBDRN O=C(NC[C@H]1CCN(c2ccc(F)c(F)c2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000133680393 1416939547 /nfs/dbraw/zinc/93/95/47/1416939547.db2.gz CAKOYRBCNBBVFQ-LLVKDONJSA-N 0 0 379.338 3.268 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000133689880 1416941766 /nfs/dbraw/zinc/94/17/66/1416941766.db2.gz LXWOWTPWPJJABL-OAHLLOKOSA-N 0 0 397.200 3.268 20 5 GGBDRN O=C(Cn1ccnc1[C@@H](O)c1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000133699057 1416944336 /nfs/dbraw/zinc/94/43/36/1416944336.db2.gz YDGPXUFIPCGSRJ-KRWDZBQOSA-N 0 0 386.795 3.165 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3ccc(F)cc3[N+](=O)[O-])n2)c1 ZINC000133708378 1416947987 /nfs/dbraw/zinc/94/79/87/1416947987.db2.gz ZYZUFYXRWHMJFB-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN O=C(Nc1ccccc1OCC1CC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000133716829 1416950245 /nfs/dbraw/zinc/95/02/45/1416950245.db2.gz SQAJGYSNGQTXNC-UHFFFAOYSA-N 0 0 379.376 3.217 20 5 GGBDRN CCc1c(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)nnn1-c1cccc(Cl)c1 ZINC000133732117 1416952729 /nfs/dbraw/zinc/95/27/29/1416952729.db2.gz KEQAJDGJEAIXBG-UHFFFAOYSA-N 0 0 386.799 3.347 20 5 GGBDRN COc1cc(C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1[N+](=O)[O-] ZINC000133755613 1416957386 /nfs/dbraw/zinc/95/73/86/1416957386.db2.gz HSLNCRMERCVQOX-ZDUSSCGKSA-N 0 0 381.392 3.017 20 5 GGBDRN COc1cc(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)ccc1[N+](=O)[O-] ZINC000133755833 1416957526 /nfs/dbraw/zinc/95/75/26/1416957526.db2.gz HSLNCRMERCVQOX-CYBMUJFWSA-N 0 0 381.392 3.017 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000133764021 1416958758 /nfs/dbraw/zinc/95/87/58/1416958758.db2.gz RRJYBJNJQJUFNS-NSHDSACASA-N 0 0 380.397 3.091 20 5 GGBDRN O=C(NCCc1nc2c(s1)CCCC2)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000133770002 1416960143 /nfs/dbraw/zinc/96/01/43/1416960143.db2.gz BDQWDDYUACWMSW-UHFFFAOYSA-N 0 0 386.477 3.241 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2CCC[C@@](C)(O)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000133772768 1416960760 /nfs/dbraw/zinc/96/07/60/1416960760.db2.gz UXNDBGXJBKLNSK-JLTOFOAXSA-N 0 0 384.436 3.150 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000133775518 1416961427 /nfs/dbraw/zinc/96/14/27/1416961427.db2.gz JCAHYTPRXMWTTC-KBPBESRZSA-N 0 0 377.441 3.360 20 5 GGBDRN COc1cc(C(=O)N(Cc2cccs2)C[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000133778751 1416961690 /nfs/dbraw/zinc/96/16/90/1416961690.db2.gz YNJXSFNRLGBIKA-CQSZACIVSA-N 0 0 376.434 3.486 20 5 GGBDRN C[C@@H]1CCC[C@H](C)N(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000133786793 1416963380 /nfs/dbraw/zinc/96/33/80/1416963380.db2.gz QWEAVFCPYQRFCJ-RDBSUJKOSA-N 0 0 379.482 3.298 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NCC2(CC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000133813529 1416968648 /nfs/dbraw/zinc/96/86/48/1416968648.db2.gz DPHMJDGENHJYNV-GOSISDBHSA-N 0 0 387.480 3.450 20 5 GGBDRN Cc1c(CC(=O)NC(C)(C)C(=O)NCC2CCCCC2)cccc1[N+](=O)[O-] ZINC000133814579 1416968873 /nfs/dbraw/zinc/96/88/73/1416968873.db2.gz FUBKPLQAIACUJO-UHFFFAOYSA-N 0 0 375.469 3.037 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)o1 ZINC000133822482 1416970406 /nfs/dbraw/zinc/97/04/06/1416970406.db2.gz DTFZSVMQOWBMLH-INIZCTEOSA-N 0 0 376.434 3.442 20 5 GGBDRN CC(C)c1nc2n(n1)C[C@@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CC2 ZINC000133822097 1416970571 /nfs/dbraw/zinc/97/05/71/1416970571.db2.gz FXNUNUZQUBASRU-AWEZNQCLSA-N 0 0 385.468 3.352 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)o1 ZINC000133822682 1416970620 /nfs/dbraw/zinc/97/06/20/1416970620.db2.gz DTFZSVMQOWBMLH-MRXNPFEDSA-N 0 0 376.434 3.442 20 5 GGBDRN Cc1csc(N2CCN(Cc3ccc(Br)c([N+](=O)[O-])c3)CC2)n1 ZINC000133834273 1416972872 /nfs/dbraw/zinc/97/28/72/1416972872.db2.gz GIUWSRIWIXVGBR-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN O=C(CCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)NCc1ccccc1 ZINC000133836644 1416973517 /nfs/dbraw/zinc/97/35/17/1416973517.db2.gz QHVUQEJZFYTIRB-UHFFFAOYSA-N 0 0 376.800 3.076 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)nn1C ZINC000133840629 1416974842 /nfs/dbraw/zinc/97/48/42/1416974842.db2.gz IQAHLKVZNDBVER-ZDUSSCGKSA-N 0 0 380.408 3.457 20 5 GGBDRN Cc1ccc2cccc(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2n1 ZINC000133843066 1416976066 /nfs/dbraw/zinc/97/60/66/1416976066.db2.gz PGIBJTMJTLZOKI-OAHLLOKOSA-N 0 0 377.404 3.173 20 5 GGBDRN CCOC(=O)c1cccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000133845936 1416976913 /nfs/dbraw/zinc/97/69/13/1416976913.db2.gz LEJHZXGTCUMNRR-UHFFFAOYSA-N 0 0 380.360 3.210 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000133870941 1416983404 /nfs/dbraw/zinc/98/34/04/1416983404.db2.gz RBSHLAVXPOIDAN-LJQANCHMSA-N 0 0 389.839 3.458 20 5 GGBDRN C[C@]1(c2cccs2)NC(=O)N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1=O ZINC000133877146 1416985650 /nfs/dbraw/zinc/98/56/50/1416985650.db2.gz LOLZMUMRHJVSJY-GOSISDBHSA-N 0 0 398.400 3.279 20 5 GGBDRN CN(C)C(=O)c1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000133886592 1416988165 /nfs/dbraw/zinc/98/81/65/1416988165.db2.gz BGZORHWLTLJGDY-UHFFFAOYSA-N 0 0 393.193 3.278 20 5 GGBDRN Cc1csc(N2CCN(Cc3cc([N+](=O)[O-])ccc3OC(F)F)CC2)n1 ZINC000133887475 1416988836 /nfs/dbraw/zinc/98/88/36/1416988836.db2.gz WEMJKOKMPWJQFR-UHFFFAOYSA-N 0 0 384.408 3.283 20 5 GGBDRN O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000133889538 1416989063 /nfs/dbraw/zinc/98/90/63/1416989063.db2.gz DSFVIYSYJVKUKJ-UHFFFAOYSA-N 0 0 385.395 3.290 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000133931570 1416997167 /nfs/dbraw/zinc/99/71/67/1416997167.db2.gz YBWXYSYVXSDLNB-UHFFFAOYSA-N 0 0 392.165 3.468 20 5 GGBDRN COc1ccc(COCCCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000133949978 1417000647 /nfs/dbraw/zinc/00/06/47/1417000647.db2.gz XWJFWEQSQWMVGP-UHFFFAOYSA-N 0 0 395.415 3.488 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)cc2)no1 ZINC000133957707 1417001735 /nfs/dbraw/zinc/00/17/35/1417001735.db2.gz VUBOZLNSSZQOBA-UHFFFAOYSA-N 0 0 383.364 3.075 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCO[C@@H](c2ccccc2F)C1 ZINC000133960227 1417001881 /nfs/dbraw/zinc/00/18/81/1417001881.db2.gz ADGVOLARWHAEIB-GOSISDBHSA-N 0 0 381.363 3.496 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000133984379 1417005597 /nfs/dbraw/zinc/00/55/97/1417005597.db2.gz OZLFPIQBSBKTIX-CHWSQXEVSA-N 0 0 395.431 3.499 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)NC(=O)c3ccc(F)cc3[N+](=O)[O-])ccc2NC1=O ZINC000133993226 1417006741 /nfs/dbraw/zinc/00/67/41/1417006741.db2.gz CGJIOQBQAIDNMC-MGPLVRAMSA-N 0 0 387.367 3.334 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000133994946 1417006772 /nfs/dbraw/zinc/00/67/72/1417006772.db2.gz AXCJGBHAAJVFCI-CZUORRHYSA-N 0 0 391.468 3.350 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000133997924 1417007977 /nfs/dbraw/zinc/00/79/77/1417007977.db2.gz NORYDRVTWUZNSB-GOSISDBHSA-N 0 0 396.403 3.150 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000134000310 1417008135 /nfs/dbraw/zinc/00/81/35/1417008135.db2.gz JHZLKRKYDUPLEV-MLGOLLRUSA-N 0 0 386.433 3.084 20 5 GGBDRN C[C@H]1CCC[C@H](C)C12NC(=O)N(Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)C2=O ZINC000134005736 1417008921 /nfs/dbraw/zinc/00/89/21/1417008921.db2.gz JAUWPTJMPGEUOF-STQMWFEESA-N 0 0 398.419 3.497 20 5 GGBDRN Cc1nc(NC(=O)c2nc(C(C)C)n(-c3ccccc3F)n2)ccc1[N+](=O)[O-] ZINC000134020469 1417010753 /nfs/dbraw/zinc/01/07/53/1417010753.db2.gz BFTOFSGYJMESSU-UHFFFAOYSA-N 0 0 384.371 3.394 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2cccc(OCC(F)F)c2)c1[N+](=O)[O-] ZINC000134023877 1417011086 /nfs/dbraw/zinc/01/10/86/1417011086.db2.gz QGRWZHNTDNHWGU-UHFFFAOYSA-N 0 0 381.335 3.423 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134026250 1417011548 /nfs/dbraw/zinc/01/15/48/1417011548.db2.gz AVFLCPINHQFUEA-UHFFFAOYSA-N 0 0 382.288 3.114 20 5 GGBDRN Cn1cc(CNc2cccc(C[S@@](C)=O)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134045809 1417014226 /nfs/dbraw/zinc/01/42/26/1417014226.db2.gz JYVSDKXANSTXRC-MHZLTWQESA-N 0 0 384.461 3.486 20 5 GGBDRN C[C@H]1CN(c2ccccc2NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000134059661 1417015923 /nfs/dbraw/zinc/01/59/23/1417015923.db2.gz YNMRAQFXRWJRQE-STQMWFEESA-N 0 0 395.419 3.337 20 5 GGBDRN O=C(NCc1ccccc1OCCO)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134061130 1417016613 /nfs/dbraw/zinc/01/66/13/1417016613.db2.gz KSIQCPJKEZEQRC-UHFFFAOYSA-N 0 0 399.428 3.019 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000134105286 1417022909 /nfs/dbraw/zinc/02/29/09/1417022909.db2.gz UBJCSMBZMHNWMI-CQSZACIVSA-N 0 0 379.432 3.283 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCO[C@H](c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000134132306 1417027097 /nfs/dbraw/zinc/02/70/97/1417027097.db2.gz KQYSISAWMFXSOR-HNNXBMFYSA-N 0 0 393.346 3.023 20 5 GGBDRN O=C(NCCC1Cc2ccccc2C1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000134144407 1417028958 /nfs/dbraw/zinc/02/89/58/1417028958.db2.gz FBTCXUUMOZAENZ-UHFFFAOYSA-N 0 0 387.823 3.108 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCO[C@@H](c3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000134148412 1417029426 /nfs/dbraw/zinc/02/94/26/1417029426.db2.gz IRTBUWJOPPAVGN-OAHLLOKOSA-N 0 0 391.811 3.398 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCO[C@H](c3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000134148186 1417029468 /nfs/dbraw/zinc/02/94/68/1417029468.db2.gz IRTBUWJOPPAVGN-HNNXBMFYSA-N 0 0 391.811 3.398 20 5 GGBDRN O=C1CN(c2ccccc2)C(=O)N1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134155685 1417030616 /nfs/dbraw/zinc/03/06/16/1417030616.db2.gz BRHYIZBKKIRYPQ-UHFFFAOYSA-N 0 0 378.344 3.219 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@H](C)CCC[C@@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000134162043 1417030994 /nfs/dbraw/zinc/03/09/94/1417030994.db2.gz AHWXVRLLIOGIBE-KGLIPLIRSA-N 0 0 384.436 3.100 20 5 GGBDRN COc1cc(S(=O)(=O)Oc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000134199142 1417037201 /nfs/dbraw/zinc/03/72/01/1417037201.db2.gz DFUPUMDZJWBNRH-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1 ZINC000134218223 1417039157 /nfs/dbraw/zinc/03/91/57/1417039157.db2.gz FSCMYIPHPVZCLJ-UHFFFAOYSA-N 0 0 392.331 3.465 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)co2)cc1 ZINC000134220734 1417039662 /nfs/dbraw/zinc/03/96/62/1417039662.db2.gz UIDTZXZXNIVZFF-UHFFFAOYSA-N 0 0 392.331 3.465 20 5 GGBDRN CSCC[C@H](C)NC(=O)c1ccc(I)c([N+](=O)[O-])c1 ZINC000134238088 1417042830 /nfs/dbraw/zinc/04/28/30/1417042830.db2.gz HIUWLWMNOPZGOR-QMMMGPOBSA-N 0 0 394.234 3.071 20 5 GGBDRN Cc1ccnc([C@H](NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)n1 ZINC000134254678 1417044552 /nfs/dbraw/zinc/04/45/52/1417044552.db2.gz IRLSUKJTNGBVCF-MEDUHNTESA-N 0 0 390.827 3.381 20 5 GGBDRN CSCC[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000134253485 1417044581 /nfs/dbraw/zinc/04/45/81/1417044581.db2.gz JOJDOQCXDHIOBG-QMMMGPOBSA-N 0 0 394.234 3.071 20 5 GGBDRN Cc1ccc(-c2nc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n[nH]2)cc1 ZINC000134258157 1417044876 /nfs/dbraw/zinc/04/48/76/1417044876.db2.gz GQDQGSUSSYJIHY-UHFFFAOYSA-N 0 0 376.376 3.351 20 5 GGBDRN COc1ccc(C)cc1[C@]1(C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2F)C1=O ZINC000134272714 1417047474 /nfs/dbraw/zinc/04/74/74/1417047474.db2.gz NIQLXHNDGBUPMM-IBGZPJMESA-N 0 0 387.367 3.018 20 5 GGBDRN O=C(Nc1ccccc1N1CCCC1=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134275257 1417048254 /nfs/dbraw/zinc/04/82/54/1417048254.db2.gz MESGFAOHNAFZGG-UHFFFAOYSA-N 0 0 391.387 3.160 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc(C)c1F ZINC000134278296 1417048515 /nfs/dbraw/zinc/04/85/15/1417048515.db2.gz HMJZKIDMHSWTNS-UHFFFAOYSA-N 0 0 391.424 3.010 20 5 GGBDRN O=C(CN(CCCO)Cc1cccc(Cl)c1)Nc1ccccc1[N+](=O)[O-] ZINC000134282058 1417049137 /nfs/dbraw/zinc/04/91/37/1417049137.db2.gz LOGLTCWCVTUFMO-UHFFFAOYSA-N 0 0 377.828 3.071 20 5 GGBDRN C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)C2=O ZINC000134280191 1417049376 /nfs/dbraw/zinc/04/93/76/1417049376.db2.gz UHCHHJLUGMOGRW-CHWSQXEVSA-N 0 0 398.419 3.497 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[C@@H](O)c1ccc(Cl)cc1Cl ZINC000134294656 1417051494 /nfs/dbraw/zinc/05/14/94/1417051494.db2.gz UUWZLPFFCUHXLZ-CQSZACIVSA-N 0 0 381.171 3.231 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCc2c(F)cc(F)cc2C1 ZINC000134294696 1417051572 /nfs/dbraw/zinc/05/15/72/1417051572.db2.gz NZPKFGXTHJHZJU-UHFFFAOYSA-N 0 0 384.342 3.257 20 5 GGBDRN COc1cc(C(=O)N2CCc3c(F)cc(F)cc3C2)c([N+](=O)[O-])cc1OC ZINC000134296809 1417052032 /nfs/dbraw/zinc/05/20/32/1417052032.db2.gz BCFMEFMZMDFMFY-UHFFFAOYSA-N 0 0 378.331 3.089 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000134308950 1417053688 /nfs/dbraw/zinc/05/36/88/1417053688.db2.gz CYGAAKPUEJIJTA-UHFFFAOYSA-N 0 0 393.403 3.091 20 5 GGBDRN CCN(CC)c1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cn1 ZINC000134308016 1417053716 /nfs/dbraw/zinc/05/37/16/1417053716.db2.gz DDTLCGWTPNBASJ-UHFFFAOYSA-N 0 0 380.408 3.274 20 5 GGBDRN C[C@@H](C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1c(F)cccc1F ZINC000134306908 1417053761 /nfs/dbraw/zinc/05/37/61/1417053761.db2.gz TZYLGPMBFAAAAG-CYBMUJFWSA-N 0 0 375.375 3.325 20 5 GGBDRN CCCNC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC)CC1 ZINC000134328239 1417056239 /nfs/dbraw/zinc/05/62/39/1417056239.db2.gz NMWPNSNUGCDEGK-UHFFFAOYSA-N 0 0 379.482 3.085 20 5 GGBDRN CCOc1cc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)ccc1OC ZINC000134326487 1417056278 /nfs/dbraw/zinc/05/62/78/1417056278.db2.gz MQPRDKTUZJDNOG-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN CC(C)NC(=O)c1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134339784 1417057783 /nfs/dbraw/zinc/05/77/83/1417057783.db2.gz ITUIAXKXOFAVKL-UHFFFAOYSA-N 0 0 393.403 3.171 20 5 GGBDRN COc1ccc(CCCN(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134356913 1417060442 /nfs/dbraw/zinc/06/04/42/1417060442.db2.gz HMZLWWORORTWGX-UHFFFAOYSA-N 0 0 394.431 3.494 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC1(Cc2ccccc2)CCC1 ZINC000134372064 1417061933 /nfs/dbraw/zinc/06/19/33/1417061933.db2.gz HLHZILCVRFGWSI-MRXNPFEDSA-N 0 0 395.459 3.242 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(-c3cccc(F)c3F)[nH]n2)c(C)c1[N+](=O)[O-] ZINC000134380716 1417062517 /nfs/dbraw/zinc/06/25/17/1417062517.db2.gz GMAFHKMGPGSDAN-UHFFFAOYSA-N 0 0 390.350 3.105 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)c1[N+](=O)[O-] ZINC000134398133 1417064939 /nfs/dbraw/zinc/06/49/39/1417064939.db2.gz GGDMNSHHBWZVMN-JTQLQIEISA-N 0 0 395.822 3.072 20 5 GGBDRN COc1cc(Cn2cnc(C3CCC3)cc2=O)c([N+](=O)[O-])cc1OC(F)F ZINC000134445551 1417068981 /nfs/dbraw/zinc/06/89/81/1417068981.db2.gz XCLNIRXVEVCGLV-UHFFFAOYSA-N 0 0 381.335 3.077 20 5 GGBDRN CCN(C[C@H]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1)CC(F)(F)F ZINC000134462252 1417071996 /nfs/dbraw/zinc/07/19/96/1417071996.db2.gz FAWHSJJHBGDRNY-LLVKDONJSA-N 0 0 377.338 3.080 20 5 GGBDRN O=C(NCCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000134467070 1417073024 /nfs/dbraw/zinc/07/30/24/1417073024.db2.gz NCXKTFIBSVFZNQ-UHFFFAOYSA-N 0 0 377.338 3.128 20 5 GGBDRN CC[C@H](O)CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000134473003 1417074549 /nfs/dbraw/zinc/07/45/49/1417074549.db2.gz UWKNZUQSPOCCEC-SFHVURJKSA-N 0 0 382.420 3.418 20 5 GGBDRN O=C(NCc1nccn1CCCc1ccccc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000134482108 1417075446 /nfs/dbraw/zinc/07/54/46/1417075446.db2.gz YJCQZBYREOLYGU-UHFFFAOYSA-N 0 0 382.395 3.493 20 5 GGBDRN CC(C)NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000134489215 1417076016 /nfs/dbraw/zinc/07/60/16/1417076016.db2.gz KWASGOIZDFCZQU-UHFFFAOYSA-N 0 0 379.482 3.274 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3ccc(OCC(F)(F)F)nc3)n2)cc1 ZINC000134499665 1417077435 /nfs/dbraw/zinc/07/74/35/1417077435.db2.gz DMEVRYIBGNATRB-UHFFFAOYSA-N 0 0 379.298 3.238 20 5 GGBDRN COc1ccccc1[C@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)N(C)C ZINC000134500466 1417077517 /nfs/dbraw/zinc/07/75/17/1417077517.db2.gz WRZXGUGWABTPOU-INIZCTEOSA-N 0 0 377.828 3.290 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C)[C@@H](C)[C@H]1Cc2ccccc2O1 ZINC000134520709 1417080928 /nfs/dbraw/zinc/08/09/28/1417080928.db2.gz NSELWPGRXBEMIE-KBXCAEBGSA-N 0 0 397.431 3.001 20 5 GGBDRN CC(=O)N(C)c1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134524994 1417081589 /nfs/dbraw/zinc/08/15/89/1417081589.db2.gz BJPOGAGZQQKJSW-UHFFFAOYSA-N 0 0 379.376 3.016 20 5 GGBDRN CC(C)c1nc2c(n1C)CCN(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000134541717 1417084506 /nfs/dbraw/zinc/08/45/06/1417084506.db2.gz LVWBLCXDPDXPMU-UHFFFAOYSA-N 0 0 381.436 3.060 20 5 GGBDRN O=C(NCc1cccc(OC(F)F)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134548587 1417085326 /nfs/dbraw/zinc/08/53/26/1417085326.db2.gz JYCWXIZOPQTQSC-UHFFFAOYSA-N 0 0 388.330 3.312 20 5 GGBDRN CC1N=NC(=S)N1c1cccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000134554434 1417086565 /nfs/dbraw/zinc/08/65/65/1417086565.db2.gz CHIWNKFAHZUUJZ-UHFFFAOYSA-N 0 0 383.433 3.344 20 5 GGBDRN O=C(N[C@@H]1CCCOc2ccccc21)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134564580 1417087980 /nfs/dbraw/zinc/08/79/80/1417087980.db2.gz HYRNIMJYTARFFW-OAHLLOKOSA-N 0 0 378.388 3.424 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N(C)c1ccccn1 ZINC000134577900 1417090316 /nfs/dbraw/zinc/09/03/16/1417090316.db2.gz CEMQMONGWHUKAY-MRXNPFEDSA-N 0 0 390.827 3.061 20 5 GGBDRN CC(C)c1nc(CCNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cs1 ZINC000134577297 1417090406 /nfs/dbraw/zinc/09/04/06/1417090406.db2.gz PLHYCTBXVZRWAQ-UHFFFAOYSA-N 0 0 385.449 3.333 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000134580676 1417090900 /nfs/dbraw/zinc/09/09/00/1417090900.db2.gz WQDMFHXVRGJGEO-SGTLLEGYSA-N 0 0 375.400 3.042 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000134592440 1417093193 /nfs/dbraw/zinc/09/31/93/1417093193.db2.gz LDKCPRDRFSALQF-ORAYPTAESA-N 0 0 398.394 3.162 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccc(F)cc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000134592398 1417093534 /nfs/dbraw/zinc/09/35/34/1417093534.db2.gz LDKCPRDRFSALQF-DJJJIMSYSA-N 0 0 398.394 3.162 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000134597283 1417094565 /nfs/dbraw/zinc/09/45/65/1417094565.db2.gz FKNRYBINFPRYOY-UHFFFAOYSA-N 0 0 387.417 3.379 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C ZINC000134621455 1417098777 /nfs/dbraw/zinc/09/87/77/1417098777.db2.gz GXWOFIWLEGSCEB-UKRRQHHQSA-N 0 0 379.457 3.481 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@H]1C ZINC000134621501 1417099190 /nfs/dbraw/zinc/09/91/90/1417099190.db2.gz GXWOFIWLEGSCEB-HIFRSBDPSA-N 0 0 379.457 3.481 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N[C@@H]2CCOC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000134639963 1417102939 /nfs/dbraw/zinc/10/29/39/1417102939.db2.gz HWQUUCYHPQEUBN-GFCCVEGCSA-N 0 0 388.873 3.327 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCOC3(CCCCC3)C2)cc1C ZINC000134664337 1417109274 /nfs/dbraw/zinc/10/92/74/1417109274.db2.gz PPYICXHXKNQWCG-OAHLLOKOSA-N 0 0 382.482 3.372 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134688885 1417112696 /nfs/dbraw/zinc/11/26/96/1417112696.db2.gz ZLFMBGVILCBISE-MRXNPFEDSA-N 0 0 391.431 3.179 20 5 GGBDRN CCC1(CO)CCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC000134706319 1417115003 /nfs/dbraw/zinc/11/50/03/1417115003.db2.gz RONPEDYCEZOGDU-UHFFFAOYSA-N 0 0 390.358 3.161 20 5 GGBDRN O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134730340 1417117743 /nfs/dbraw/zinc/11/77/43/1417117743.db2.gz UWWVFEOVCHUMAY-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN Cc1cc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)ccc1C(=O)N(C)C ZINC000134739026 1417118771 /nfs/dbraw/zinc/11/87/71/1417118771.db2.gz GGQVTOKQFRBFDD-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN COC(=O)[C@@H](C)c1c(C)nn(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1C ZINC000134741251 1417119277 /nfs/dbraw/zinc/11/92/77/1417119277.db2.gz VKQJDJZKXBCTKD-NSHDSACASA-N 0 0 384.392 3.388 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000134743423 1417119556 /nfs/dbraw/zinc/11/95/56/1417119556.db2.gz JURCYZIONLYFSF-KRWDZBQOSA-N 0 0 376.416 3.485 20 5 GGBDRN Cc1cc([C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)ccc1F ZINC000134775133 1417123723 /nfs/dbraw/zinc/12/37/23/1417123723.db2.gz DIMATMSEQCGPIG-GOSISDBHSA-N 0 0 376.359 3.324 20 5 GGBDRN COc1cc(-c2noc(-c3ccc(F)cc3[N+](=O)[O-])n2)cc(OC)c1OC ZINC000134790231 1417126198 /nfs/dbraw/zinc/12/61/98/1417126198.db2.gz ZCRAMDUZNTZXKE-UHFFFAOYSA-N 0 0 375.312 3.477 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O ZINC000134816906 1417130881 /nfs/dbraw/zinc/13/08/81/1417130881.db2.gz GUVBVQHYFPJXGF-UHFFFAOYSA-N 0 0 377.759 3.073 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1[N+](=O)[O-] ZINC000134822643 1417131530 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0 0 377.832 3.440 20 5 GGBDRN CN(C)c1nc2cc(NC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)ccc2o1 ZINC000134895238 1417141254 /nfs/dbraw/zinc/14/12/54/1417141254.db2.gz QGXXHNGDWNJEKL-UHFFFAOYSA-N 0 0 392.375 3.240 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCc2c(F)cc(F)cc2C1 ZINC000134899943 1417141859 /nfs/dbraw/zinc/14/18/59/1417141859.db2.gz RFNWGIZHLLLJCU-UHFFFAOYSA-N 0 0 384.342 3.257 20 5 GGBDRN CN(C)c1cccc(CN(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000134913284 1417143632 /nfs/dbraw/zinc/14/36/32/1417143632.db2.gz SNPJSLIWQTVYKX-UHFFFAOYSA-N 0 0 379.420 3.119 20 5 GGBDRN CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134923408 1417145772 /nfs/dbraw/zinc/14/57/72/1417145772.db2.gz QYCLXCHEXJNASS-GFCCVEGCSA-N 0 0 381.860 3.263 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134962734 1417153276 /nfs/dbraw/zinc/15/32/76/1417153276.db2.gz REVOUNWVEIZQPX-OAHLLOKOSA-N 0 0 394.431 3.398 20 5 GGBDRN Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000135001237 1417159440 /nfs/dbraw/zinc/15/94/40/1417159440.db2.gz CRSKIAJFUCQRDL-QGZVFWFLSA-N 0 0 397.456 3.227 20 5 GGBDRN COc1cc(OCC(=O)NC(C)(C)c2nc(C)c(C)s2)ccc1[N+](=O)[O-] ZINC000135005806 1417160084 /nfs/dbraw/zinc/16/00/84/1417160084.db2.gz BBCSFXLSSFFYFJ-UHFFFAOYSA-N 0 0 379.438 3.107 20 5 GGBDRN COC(=O)c1cccc(NC2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000135017494 1417162465 /nfs/dbraw/zinc/16/24/65/1417162465.db2.gz PSIQJHLRNXTYJV-UHFFFAOYSA-N 0 0 389.433 3.160 20 5 GGBDRN CN(CCOC(=O)CCc1nc(C2CCCC2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000135055309 1417168024 /nfs/dbraw/zinc/16/80/24/1417168024.db2.gz MMSLOYHQYTUKLW-UHFFFAOYSA-N 0 0 388.424 3.248 20 5 GGBDRN O=C(c1cc(C2CCCCC2)n[nH]1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135116512 1417173693 /nfs/dbraw/zinc/17/36/93/1417173693.db2.gz UBFJLEFZDVYJOD-AWEZNQCLSA-N 0 0 384.440 3.087 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1COC1CCOCC1 ZINC000135147877 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KUFQJZAKLSCBSM-YJBOKZPZSA-N 0 0 390.823 3.213 20 5 GGBDRN COc1cc(NCCNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc(OC)c1 ZINC000139622976 1417466626 /nfs/dbraw/zinc/46/66/26/1417466626.db2.gz ULVSMHCJARREIU-UHFFFAOYSA-N 0 0 379.800 3.107 20 5 GGBDRN C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000139664772 1417468670 /nfs/dbraw/zinc/46/86/70/1417468670.db2.gz HOPOMEWFOSTSKT-NSHDSACASA-N 0 0 383.832 3.330 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000139691123 1417469587 /nfs/dbraw/zinc/46/95/87/1417469587.db2.gz QXIBMRBHBYXIMA-UHFFFAOYSA-N 0 0 378.410 3.391 20 5 GGBDRN Cc1nn(C)c(C)c1NC(=O)COC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000139794579 1417473562 /nfs/dbraw/zinc/47/35/62/1417473562.db2.gz MKQKYXBUTCRPEV-UHFFFAOYSA-N 0 0 388.424 3.038 20 5 GGBDRN CCNC(=O)COc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000139799460 1417474840 /nfs/dbraw/zinc/47/48/40/1417474840.db2.gz UXEYIVXKKNJYFQ-UHFFFAOYSA-N 0 0 392.799 3.407 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC[C@@H]3CCCCO3)cc2[N+](=O)[O-])C1 ZINC000139870559 1417478336 /nfs/dbraw/zinc/47/83/36/1417478336.db2.gz VUWKCHCAFWPYAN-INMHGKMJSA-N 0 0 375.469 3.376 20 5 GGBDRN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000140244856 1417493314 /nfs/dbraw/zinc/49/33/14/1417493314.db2.gz ITKRPTWIWQCIKM-IFXJQAMLSA-N 0 0 380.404 3.369 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCC[C@H]2c2cccc(C)n2)c([N+](=O)[O-])c1 ZINC000140274368 1417496339 /nfs/dbraw/zinc/49/63/39/1417496339.db2.gz LDCZMWCDADOAEV-SFHVURJKSA-N 0 0 384.436 3.473 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000140403599 1417501652 /nfs/dbraw/zinc/50/16/52/1417501652.db2.gz MMEGAZBZZHHZMX-SNUQEOBHSA-N 0 0 381.860 3.202 20 5 GGBDRN CCO[C@H](C(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000140504031 1417505264 /nfs/dbraw/zinc/50/52/64/1417505264.db2.gz FMURFGVMEOFIPK-IBGZPJMESA-N 0 0 388.420 3.049 20 5 GGBDRN COc1cc(CCNC(=O)c2cnc(C(C)(C)C)s2)c([N+](=O)[O-])cc1OC ZINC000140504917 1417505663 /nfs/dbraw/zinc/50/56/63/1417505663.db2.gz ZBVWQOJZJQOTAT-UHFFFAOYSA-N 0 0 393.465 3.339 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@@H]1COc2ccccc21 ZINC000178838480 1429189781 /nfs/dbraw/zinc/18/97/81/1429189781.db2.gz TZIZVERCLJZESA-CJNGLKHVSA-N 0 0 378.388 3.075 20 5 GGBDRN CC(C)N(CC(=O)N[C@@H]1CCOc2ccccc21)Cc1ccc([N+](=O)[O-])cc1 ZINC000140793774 1417517111 /nfs/dbraw/zinc/51/71/11/1417517111.db2.gz SKEKHQAAZPDXHI-LJQANCHMSA-N 0 0 383.448 3.445 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1 ZINC000141406024 1417537324 /nfs/dbraw/zinc/53/73/24/1417537324.db2.gz VLICZMCJDPOAKQ-QGZVFWFLSA-N 0 0 382.376 3.340 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc2[nH]c(Cc3ccccc3F)nc2c1 ZINC000141836753 1417560143 /nfs/dbraw/zinc/56/01/43/1417560143.db2.gz CXQGTCZEGUWZKT-UHFFFAOYSA-N 0 0 394.366 3.036 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CC[C@@H]2c2ccccc2)nn1-c1ccccc1[N+](=O)[O-] ZINC000141836474 1417560571 /nfs/dbraw/zinc/56/05/71/1417560571.db2.gz LCJRHZVKHZIBRM-MRXNPFEDSA-N 0 0 390.399 3.036 20 5 GGBDRN CNc1ccc(C(=O)N(Cc2cccc(OC)c2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000142306687 1417581755 /nfs/dbraw/zinc/58/17/55/1417581755.db2.gz TWHQBNKHWTZEDD-GOSISDBHSA-N 0 0 399.447 3.467 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000142436731 1417587717 /nfs/dbraw/zinc/58/77/17/1417587717.db2.gz AEYMBKYYNXPFSL-CYBMUJFWSA-N 0 0 386.408 3.232 20 5 GGBDRN O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc2ccccc21 ZINC000142775188 1417599015 /nfs/dbraw/zinc/59/90/15/1417599015.db2.gz UXHWAWYIKFKZQS-UHFFFAOYSA-N 0 0 399.428 3.055 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(-n2ccnc2C)c(F)c1 ZINC000144435267 1417662340 /nfs/dbraw/zinc/66/23/40/1417662340.db2.gz DTXNAQUEMUKWIY-UHFFFAOYSA-N 0 0 384.367 3.167 20 5 GGBDRN Cc1nc([C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)c2ccccc2F)no1 ZINC000178861438 1429199746 /nfs/dbraw/zinc/19/97/46/1429199746.db2.gz PQBHADSJLVGIOM-MRXNPFEDSA-N 0 0 385.355 3.014 20 5 GGBDRN O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000144921681 1417675501 /nfs/dbraw/zinc/67/55/01/1417675501.db2.gz MTXPGZCXXNATKM-RDTXWAMCSA-N 0 0 385.376 3.401 20 5 GGBDRN COC(=O)c1cc(C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000144915114 1417676422 /nfs/dbraw/zinc/67/64/22/1417676422.db2.gz XULUQUCTZYHFKS-KXBFYZLASA-N 0 0 398.415 3.279 20 5 GGBDRN O=C(COc1cc(Cl)ccc1[N+](=O)[O-])N1CCN(Cc2cccs2)CC1 ZINC000144948429 1417677366 /nfs/dbraw/zinc/67/73/66/1417677366.db2.gz WGJSOCBRNGNOAO-UHFFFAOYSA-N 0 0 395.868 3.033 20 5 GGBDRN CC[C@@H](C)Oc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000144974868 1417678082 /nfs/dbraw/zinc/67/80/82/1417678082.db2.gz WNAIFWUTZBLRMM-CQSZACIVSA-N 0 0 385.420 3.369 20 5 GGBDRN CC[C@H](C)Oc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000144978827 1417678493 /nfs/dbraw/zinc/67/84/93/1417678493.db2.gz QQCZNIWGFNPOLK-AWEZNQCLSA-N 0 0 385.420 3.369 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1cnc(-c2ccccc2)nc1 ZINC000145532689 1417690860 /nfs/dbraw/zinc/69/08/60/1417690860.db2.gz LJGPDEBZIVQXMK-UHFFFAOYSA-N 0 0 378.392 3.285 20 5 GGBDRN CC[C@H](C)N(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000145787605 1417700614 /nfs/dbraw/zinc/70/06/14/1417700614.db2.gz NSBMVZVSWGBHKJ-AWEZNQCLSA-N 0 0 390.461 3.439 20 5 GGBDRN CCC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1 ZINC000145802090 1417700821 /nfs/dbraw/zinc/70/08/21/1417700821.db2.gz CMJDNXGDOZMDGQ-QGZVFWFLSA-N 0 0 376.434 3.270 20 5 GGBDRN COCCN1C(=O)c2ccccc2N[C@@H]1c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000145809296 1417701810 /nfs/dbraw/zinc/70/18/10/1417701810.db2.gz KHQRIIHJSIFTBQ-INIZCTEOSA-N 0 0 393.346 3.409 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(OC(F)F)c(OC)c2)c1 ZINC000145958584 1417705640 /nfs/dbraw/zinc/70/56/40/1417705640.db2.gz AMRBACOQQMDGDY-UHFFFAOYSA-N 0 0 382.319 3.143 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000146241143 1417713149 /nfs/dbraw/zinc/71/31/49/1417713149.db2.gz PBVXUQNDFRCLME-AEFFLSMTSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000146312506 1417715101 /nfs/dbraw/zinc/71/51/01/1417715101.db2.gz KUGKLHLCNKAUMS-APWZRJJASA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000146314872 1417715365 /nfs/dbraw/zinc/71/53/65/1417715365.db2.gz CCMYTHLXEUSHAL-QAPCUYQASA-N 0 0 376.434 3.041 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000146297186 1417715437 /nfs/dbraw/zinc/71/54/37/1417715437.db2.gz HWRDNGZTUCOVAN-VQIMIIECSA-N 0 0 390.461 3.349 20 5 GGBDRN COc1ccc(CN2CC[C@H](Nc3c(F)cc([N+](=O)[O-])cc3F)C2=O)cc1 ZINC000178871085 1429203836 /nfs/dbraw/zinc/20/38/36/1429203836.db2.gz NZOBQQKJSIOKRB-INIZCTEOSA-N 0 0 377.347 3.095 20 5 GGBDRN Cc1cc(S(=O)(=O)N(CCCO)Cc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000178870133 1429204057 /nfs/dbraw/zinc/20/40/57/1429204057.db2.gz 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GGBDRN COc1cccc(Cn2nccc2NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1OC ZINC000147459420 1417748126 /nfs/dbraw/zinc/74/81/26/1417748126.db2.gz QRPULHPJQDIHNT-UHFFFAOYSA-N 0 0 396.403 3.418 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cc1 ZINC000147461734 1417748226 /nfs/dbraw/zinc/74/82/26/1417748226.db2.gz GVBJPJWQFXQNAH-HKUYNNGSSA-N 0 0 390.461 3.182 20 5 GGBDRN Cc1cc(C(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)cc([N+](=O)[O-])c1 ZINC000148230060 1417761181 /nfs/dbraw/zinc/76/11/81/1417761181.db2.gz JCXKPNJCSUDFDL-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN Cc1cc(C(=O)NCC2(c3ccc4c(c3)OCO4)CCOCC2)cc([N+](=O)[O-])c1 ZINC000148422112 1417763932 /nfs/dbraw/zinc/76/39/32/1417763932.db2.gz CTBHMQSAODXBEF-UHFFFAOYSA-N 0 0 398.415 3.110 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)c1 ZINC000148498939 1417764472 /nfs/dbraw/zinc/76/44/72/1417764472.db2.gz UEHQVMMTLIJTRZ-ZIAGYGMSSA-N 0 0 385.420 3.469 20 5 GGBDRN Cc1nc(-c2ccc(CNC(=O)CCn3cc([N+](=O)[O-])nc3C)cc2)cs1 ZINC000148701629 1417767389 /nfs/dbraw/zinc/76/73/89/1417767389.db2.gz LNNIYOCGJGXBRQ-UHFFFAOYSA-N 0 0 385.449 3.238 20 5 GGBDRN COc1ccc(F)cc1[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000149117820 1417772715 /nfs/dbraw/zinc/77/27/15/1417772715.db2.gz RIYQGRLUEDACDN-NSHDSACASA-N 0 0 378.356 3.007 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(COCc2ccco2)c1 ZINC000149635176 1417778895 /nfs/dbraw/zinc/77/88/95/1417778895.db2.gz TUDKQNBQGKPKDX-UHFFFAOYSA-N 0 0 384.392 3.438 20 5 GGBDRN CCc1nc(CN(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cs1 ZINC000149755330 1417779309 /nfs/dbraw/zinc/77/93/09/1417779309.db2.gz WREYDXSOFUYCJZ-UHFFFAOYSA-N 0 0 388.493 3.489 20 5 GGBDRN COc1cc(OCC(=O)N[C@H]2CCCOc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000149870002 1417781221 /nfs/dbraw/zinc/78/12/21/1417781221.db2.gz OYRCUUZVGCWGTF-HNNXBMFYSA-N 0 0 390.367 3.151 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000149985943 1417782820 /nfs/dbraw/zinc/78/28/20/1417782820.db2.gz 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ZINC000150797696 1417808608 /nfs/dbraw/zinc/80/86/08/1417808608.db2.gz KOWILLMSYUAOAY-ZDUSSCGKSA-N 0 0 393.399 3.075 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000150798385 1417809077 /nfs/dbraw/zinc/80/90/77/1417809077.db2.gz HVMWTEKUZUUVJP-CQSZACIVSA-N 0 0 397.406 3.490 20 5 GGBDRN C[C@@H]1CCC[C@@H](C)N(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000150804563 1417810435 /nfs/dbraw/zinc/81/04/35/1417810435.db2.gz NOQJOLBWCQBBQT-ZIAGYGMSSA-N 0 0 375.425 3.320 20 5 GGBDRN O=C(Nc1ccc(-c2ccccc2)nn1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000150808043 1417810787 /nfs/dbraw/zinc/81/07/87/1417810787.db2.gz LFAUWNYZWLFTOU-UHFFFAOYSA-N 0 0 386.371 3.490 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@H](C)c2nc(C(C)(C)C)cs2)ccc1[N+](=O)[O-] ZINC000150811197 1417811668 /nfs/dbraw/zinc/81/16/68/1417811668.db2.gz HFXCXUBGPLPVHZ-SNVBAGLBSA-N 0 0 399.494 3.397 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)CCCNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000150810770 1417811745 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20 5 GGBDRN CCOC(=O)c1ccnc(N(C)[C@H]2CCCN(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000150843745 1417818636 /nfs/dbraw/zinc/81/86/36/1417818636.db2.gz OTRWPSCSFVHZRL-INIZCTEOSA-N 0 0 384.436 3.272 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N(C)C[C@@H](O)C3CC3)cc2[N+](=O)[O-])n1 ZINC000150844040 1417818944 /nfs/dbraw/zinc/81/89/44/1417818944.db2.gz UIPUZJJVGABBCG-CQSZACIVSA-N 0 0 393.490 3.354 20 5 GGBDRN Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1 ZINC000150856165 1417821746 /nfs/dbraw/zinc/82/17/46/1417821746.db2.gz CIHHDASNPWHJCG-UHFFFAOYSA-N 0 0 392.375 3.184 20 5 GGBDRN CC(=O)c1ccc(Cl)c(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1 ZINC000150877819 1417826639 /nfs/dbraw/zinc/82/66/39/1417826639.db2.gz ABMILXPFMHMECE-UHFFFAOYSA-N 0 0 385.767 3.284 20 5 GGBDRN O=C(NCCCO[C@@H]1CCOC1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000150884108 1417827752 /nfs/dbraw/zinc/82/77/52/1417827752.db2.gz WGHGDWSIQONIPL-QGZVFWFLSA-N 0 0 385.420 3.264 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1C(=O)N1CCC2(CCCC2)CC1 ZINC000150892213 1417829320 /nfs/dbraw/zinc/82/93/20/1417829320.db2.gz PQAGJIHXGMSYOG-CQSZACIVSA-N 0 0 391.493 3.444 20 5 GGBDRN CCOC(=O)c1csc(N(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C2CC2)n1 ZINC000150899006 1417830754 /nfs/dbraw/zinc/83/07/54/1417830754.db2.gz KXWICFUKSXQSCX-BJMVGYQFSA-N 0 0 387.417 3.437 20 5 GGBDRN CCOC(=O)c1csc(N(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000150905504 1417832109 /nfs/dbraw/zinc/83/21/09/1417832109.db2.gz PZGUGJWODKFXFP-UHFFFAOYSA-N 0 0 375.406 3.346 20 5 GGBDRN CCOC(=O)c1csc(N(C(=O)c2cccc([N+](=O)[O-])c2C)C2CC2)n1 ZINC000150910640 1417833112 /nfs/dbraw/zinc/83/31/12/1417833112.db2.gz ZTPAZLXDJBPTSL-UHFFFAOYSA-N 0 0 375.406 3.346 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3c(c2)NC(=O)CC3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000150918195 1417835171 /nfs/dbraw/zinc/83/51/71/1417835171.db2.gz SNJFLARWQXJGGP-UHFFFAOYSA-N 0 0 384.348 3.257 20 5 GGBDRN 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RBMYXNDEIPOEQK-UHFFFAOYSA-N 0 0 385.351 3.045 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCc3c(cccc3N3CCOC3=O)C2)c1[N+](=O)[O-] ZINC000150986027 1417850003 /nfs/dbraw/zinc/85/00/03/1417850003.db2.gz MNXDCXIATSEIOU-UHFFFAOYSA-N 0 0 399.378 3.197 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000150993768 1417851723 /nfs/dbraw/zinc/85/17/23/1417851723.db2.gz ZOPNJMHFOBDPRI-ZDUSSCGKSA-N 0 0 383.832 3.281 20 5 GGBDRN CN1CCc2ccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)cc2C1=O ZINC000151014685 1417855578 /nfs/dbraw/zinc/85/55/78/1417855578.db2.gz UBZJLGVMKZXJAI-UHFFFAOYSA-N 0 0 394.431 3.075 20 5 GGBDRN CCCOc1cc(C)ccc1CNC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000151033898 1417859374 /nfs/dbraw/zinc/85/93/74/1417859374.db2.gz ZFTPTANMRMRWEN-OAHLLOKOSA-N 0 0 399.447 3.127 20 5 GGBDRN COc1ccc(CSCC(=O)NCCc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000151035532 1417859762 /nfs/dbraw/zinc/85/97/62/1417859762.db2.gz DJFFXKMGZVFYEP-UHFFFAOYSA-N 0 0 395.868 3.244 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCCc2nc(C(F)(F)F)cs2)c1[N+](=O)[O-] ZINC000151042301 1417860972 /nfs/dbraw/zinc/86/09/72/1417860972.db2.gz JTBBKCVHILZHAG-UHFFFAOYSA-N 0 0 377.319 3.490 20 5 GGBDRN CCOCCOc1cc(C)ccc1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000151044160 1417861374 /nfs/dbraw/zinc/86/13/74/1417861374.db2.gz OIGFQAWNXLEHAP-UHFFFAOYSA-N 0 0 376.384 3.388 20 5 GGBDRN Cn1ccnc1[C@H](CCc1ccccc1)OC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000151049427 1417861869 /nfs/dbraw/zinc/86/18/69/1417861869.db2.gz UDDYJJDMVSWMIJ-SFHVURJKSA-N 0 0 380.404 3.441 20 5 GGBDRN Cc1ccc(CNC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c(OC(C)C)c1 ZINC000151056177 1417863657 /nfs/dbraw/zinc/86/36/57/1417863657.db2.gz MFUDTEGGUQJEAZ-OAHLLOKOSA-N 0 0 399.447 3.125 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000151068889 1417866535 /nfs/dbraw/zinc/86/65/35/1417866535.db2.gz YNBHCIXNNOIZMJ-RFKZRZAASA-N 0 0 375.425 3.028 20 5 GGBDRN O=C(Nc1ccc2c(c1)NC(=O)CC2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000151077764 1417868256 /nfs/dbraw/zinc/86/82/56/1417868256.db2.gz VXZKKMKISJSDMG-UHFFFAOYSA-N 0 0 394.431 3.335 20 5 GGBDRN CC[C@@](C)(NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000151098839 1417871900 /nfs/dbraw/zinc/87/19/00/1417871900.db2.gz YSEJGQGRCSYDBC-QGZVFWFLSA-N 0 0 379.438 3.432 20 5 GGBDRN Cc1nc(CCNC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])sc1C ZINC000151101836 1417872542 /nfs/dbraw/zinc/87/25/42/1417872542.db2.gz JNHCAWJMKJZUAI-UHFFFAOYSA-N 0 0 391.497 3.320 20 5 GGBDRN O=C(NCc1cccc(N2CC=CC2)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000151104168 1417872849 /nfs/dbraw/zinc/87/28/49/1417872849.db2.gz CEBICQHTPXBEGD-UHFFFAOYSA-N 0 0 378.432 3.475 20 5 GGBDRN COc1cc(OCC(=O)Nc2cc(C3CCCCC3)nn2C)ccc1[N+](=O)[O-] ZINC000151106232 1417873352 /nfs/dbraw/zinc/87/33/52/1417873352.db2.gz WQXZUOKXTAXQEL-UHFFFAOYSA-N 0 0 388.424 3.402 20 5 GGBDRN NC(=O)c1ccc(CSc2n[nH]c(-c3cc(F)cc(F)c3)n2)c([N+](=O)[O-])c1 ZINC000151115319 1417874937 /nfs/dbraw/zinc/87/49/37/1417874937.db2.gz GGRXCOORKODLJY-UHFFFAOYSA-N 0 0 391.359 3.049 20 5 GGBDRN CCOc1cc(C)ccc1CNC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000151123899 1417877002 /nfs/dbraw/zinc/87/70/02/1417877002.db2.gz UVOZEUJFSAOENV-UHFFFAOYSA-N 0 0 395.419 3.121 20 5 GGBDRN CCN(C(=O)CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000151123256 1417877007 /nfs/dbraw/zinc/87/70/07/1417877007.db2.gz RJZIRUCFIXYWPK-LJQANCHMSA-N 0 0 381.432 3.181 20 5 GGBDRN Cc1ccc(-c2nnco2)cc1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000151152496 1417883172 /nfs/dbraw/zinc/88/31/72/1417883172.db2.gz BJSWWXWKWBCUTG-UHFFFAOYSA-N 0 0 382.380 3.187 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@@H](C(=O)OCCc2ccccc2[N+](=O)[O-])C1 ZINC000151178177 1417888777 /nfs/dbraw/zinc/88/87/77/1417888777.db2.gz XWRINTPYRJZYIU-LJQANCHMSA-N 0 0 396.443 3.162 20 5 GGBDRN C[C@@H](CCNC(=O)NCCn1cc([N+](=O)[O-])cn1)c1cccc(C(F)(F)F)c1 ZINC000151201201 1417892702 /nfs/dbraw/zinc/89/27/02/1417892702.db2.gz DYXNXRNPDQONNL-LBPRGKRZSA-N 0 0 399.373 3.303 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cccs1)C(=O)OCCc1ccccc1[N+](=O)[O-] ZINC000151208784 1417894458 /nfs/dbraw/zinc/89/44/58/1417894458.db2.gz MYVZDFRQHMGROS-INIZCTEOSA-N 0 0 376.434 3.197 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C2CCCCC2)C1=O ZINC000151224420 1417897247 /nfs/dbraw/zinc/89/72/47/1417897247.db2.gz ZLUOJQAILIJNOK-SUMWQHHRSA-N 0 0 391.493 3.125 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)ccc1[N+](=O)[O-] ZINC000178920969 1429220701 /nfs/dbraw/zinc/22/07/01/1429220701.db2.gz NIFMJWCXAPFKFB-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000151235196 1417899156 /nfs/dbraw/zinc/89/91/56/1417899156.db2.gz JHMBQRQPRVDJAE-JCKWVBRZSA-N 0 0 379.482 3.318 20 5 GGBDRN C[C@H](CC(=O)c1ccccc1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000178922047 1429220820 /nfs/dbraw/zinc/22/08/20/1429220820.db2.gz UEALWGJGUBYTPW-LLVKDONJSA-N 0 0 382.825 3.188 20 5 GGBDRN COC(=O)c1ccc(OCc2nc(-c3ccc(F)c(C)c3)no2)c([N+](=O)[O-])c1 ZINC000151242552 1417901177 /nfs/dbraw/zinc/90/11/77/1417901177.db2.gz SXAOTIARGXNUAH-UHFFFAOYSA-N 0 0 387.323 3.458 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC[C@H](C)[C@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000151254209 1417904954 /nfs/dbraw/zinc/90/49/54/1417904954.db2.gz QCEKJCTXGIVJGE-MEDUHNTESA-N 0 0 398.872 3.025 20 5 GGBDRN Cc1cccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000151274678 1417911071 /nfs/dbraw/zinc/91/10/71/1417911071.db2.gz WBBGESARPAWWET-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN Cc1ccc(C)c(N2CCN(C(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000151283213 1417914139 /nfs/dbraw/zinc/91/41/39/1417914139.db2.gz YMZFHAYHBMVGCI-UHFFFAOYSA-N 0 0 398.419 3.391 20 5 GGBDRN Cc1c(C(=O)N2c3ccccc3CC[C@H]2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000151297238 1417919103 /nfs/dbraw/zinc/91/91/03/1417919103.db2.gz JESZCKSOPZSHKN-CYBMUJFWSA-N 0 0 377.404 3.465 20 5 GGBDRN C[C@@H](NC(=O)c1cc(F)c([N+](=O)[O-])cc1F)c1cccc(N2CCCC2=O)c1 ZINC000151311065 1417923225 /nfs/dbraw/zinc/92/32/25/1417923225.db2.gz RKGAOHGSPJZOEM-LLVKDONJSA-N 0 0 389.358 3.491 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCOc1ncccc1C(F)(F)F ZINC000151340082 1417930230 /nfs/dbraw/zinc/93/02/30/1417930230.db2.gz KIPNKQFBYZZOOH-UHFFFAOYSA-N 0 0 383.326 3.136 20 5 GGBDRN CC(C)CC1(CNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])CCC1 ZINC000151375911 1417941154 /nfs/dbraw/zinc/94/11/54/1417941154.db2.gz QXJLGGXCKKWEPB-UHFFFAOYSA-N 0 0 381.860 3.311 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000151381686 1417942878 /nfs/dbraw/zinc/94/28/78/1417942878.db2.gz NFUHCJPVLFHMMS-FQEVSTJZSA-N 0 0 392.415 3.303 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)C[C@H](O)c1ccc(F)cc1 ZINC000151395862 1417948233 /nfs/dbraw/zinc/94/82/33/1417948233.db2.gz LENKKPUDWMTADG-BZNIZROVSA-N 0 0 377.372 3.376 20 5 GGBDRN CC(=O)c1cc(Cl)ccc1OS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000178928879 1429222811 /nfs/dbraw/zinc/22/28/11/1429222811.db2.gz MPACBXYOKIVWBJ-UHFFFAOYSA-N 0 0 383.809 3.402 20 5 GGBDRN CC(=O)c1ccc(S(=O)(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000151413164 1417956517 /nfs/dbraw/zinc/95/65/17/1417956517.db2.gz GWGABTNRAAJNAZ-UHFFFAOYSA-N 0 0 376.434 3.099 20 5 GGBDRN COC1(CNC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CCOCC1 ZINC000151425437 1417961496 /nfs/dbraw/zinc/96/14/96/1417961496.db2.gz DQMJKMNOOJPAFD-UHFFFAOYSA-N 0 0 399.447 3.132 20 5 GGBDRN Cc1ccoc1C(=O)NCCCNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000151432496 1417966521 /nfs/dbraw/zinc/96/65/21/1417966521.db2.gz FQRIDLBYSJPBGT-UHFFFAOYSA-N 0 0 380.788 3.091 20 5 GGBDRN COc1ccc([C@H]2CCCN2S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000178932932 1429223854 /nfs/dbraw/zinc/22/38/54/1429223854.db2.gz YXHZCLSQERYZNR-LJQANCHMSA-N 0 0 390.461 3.313 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000178935562 1429224118 /nfs/dbraw/zinc/22/41/18/1429224118.db2.gz OWSBVDCKKAEMOV-LJQANCHMSA-N 0 0 392.477 3.463 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000178934860 1429224221 /nfs/dbraw/zinc/22/42/21/1429224221.db2.gz PFKXZUKHHMTHNM-UHFFFAOYSA-N 0 0 390.461 3.140 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N(Cc1ccccc1F)C1CC1 ZINC000178934789 1429224443 /nfs/dbraw/zinc/22/44/43/1429224443.db2.gz IZDDZRYKTFXISW-UHFFFAOYSA-N 0 0 378.425 3.271 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(Cc2ccccc2F)C2CC2)cc1 ZINC000178934805 1429224549 /nfs/dbraw/zinc/22/45/49/1429224549.db2.gz KADUNXMORZJFQK-UHFFFAOYSA-N 0 0 378.425 3.271 20 5 GGBDRN CCOC(=O)c1cc(N[C@@H]2CCN(C3CCCCC3)C2=O)ccc1[N+](=O)[O-] ZINC000151459454 1417982038 /nfs/dbraw/zinc/98/20/38/1417982038.db2.gz QGSHLZWWWPJLQJ-MRXNPFEDSA-N 0 0 375.425 3.117 20 5 GGBDRN C[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000151461678 1417983246 /nfs/dbraw/zinc/98/32/46/1417983246.db2.gz NJZHYMIEIGKKEO-BZNIZROVSA-N 0 0 382.342 3.420 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000178938291 1429225234 /nfs/dbraw/zinc/22/52/34/1429225234.db2.gz DBBJNVCKFUFWSK-IBGZPJMESA-N 0 0 390.461 3.313 20 5 GGBDRN C[C@H](c1ccc(F)c(F)c1)N(C)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000178939119 1429225519 /nfs/dbraw/zinc/22/55/19/1429225519.db2.gz ZQIFCBBSFIDCIV-GFCCVEGCSA-N 0 0 384.404 3.438 20 5 GGBDRN CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1C)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151477086 1417991492 /nfs/dbraw/zinc/99/14/92/1417991492.db2.gz OZEXHALZQYKGEU-FPOVZHCZSA-N 0 0 397.475 3.313 20 5 GGBDRN CC[C@H](NC(=O)c1cccc(C)c1[N+](=O)[O-])[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151479145 1417992383 /nfs/dbraw/zinc/99/23/83/1417992383.db2.gz MXIZXESFVGQEEE-PMACEKPBSA-N 0 0 397.475 3.313 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000151488504 1418000528 /nfs/dbraw/zinc/00/05/28/1418000528.db2.gz YDMNAGCBIVLZDE-OAHLLOKOSA-N 0 0 379.210 3.129 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCN(c3cc(F)ccc3F)CC2)c1[N+](=O)[O-] ZINC000151493520 1418001776 /nfs/dbraw/zinc/00/17/76/1418001776.db2.gz QXUAVXLUEMPZNG-UHFFFAOYSA-N 0 0 379.338 3.283 20 5 GGBDRN Cc1ccc([C@@H](O)CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cc1 ZINC000151505622 1418006404 /nfs/dbraw/zinc/00/64/04/1418006404.db2.gz NNOWCDSFAABFSY-INIZCTEOSA-N 0 0 393.237 3.438 20 5 GGBDRN Cn1c(-c2ccncc2)nn(CN2CCCc3ccc([N+](=O)[O-])cc32)c1=S ZINC000151514838 1418010087 /nfs/dbraw/zinc/01/00/87/1418010087.db2.gz SZZKFBBZDZZPSF-UHFFFAOYSA-N 0 0 382.449 3.332 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@@H](O)c2ccsc2)cc1[N+](=O)[O-] ZINC000151553937 1418022407 /nfs/dbraw/zinc/02/24/07/1418022407.db2.gz ULUIGSIRRGEYQH-CYBMUJFWSA-N 0 0 385.239 3.191 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000151574144 1418029249 /nfs/dbraw/zinc/02/92/49/1418029249.db2.gz UHYDORVEVKHSQK-CYBMUJFWSA-N 0 0 399.230 3.000 20 5 GGBDRN O=C(CCN1C(=O)CCc2ccccc21)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000151609640 1418039360 /nfs/dbraw/zinc/03/93/60/1418039360.db2.gz WGMXOCTWQNYNDG-UHFFFAOYSA-N 0 0 375.331 3.181 20 5 GGBDRN CC(C)(NC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)NCC1CCCCC1 ZINC000151634088 1418046182 /nfs/dbraw/zinc/04/61/82/1418046182.db2.gz LDXLMTGGTBVYQQ-UHFFFAOYSA-N 0 0 381.860 3.453 20 5 GGBDRN C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc2c(c1)CCC(=O)N2 ZINC000178973569 1429231932 /nfs/dbraw/zinc/23/19/32/1429231932.db2.gz KEJPGNVUIKOHEQ-GFCCVEGCSA-N 0 0 392.415 3.381 20 5 GGBDRN CC(C)(NC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)NCC1CCCCC1 ZINC000151651785 1418050659 /nfs/dbraw/zinc/05/06/59/1418050659.db2.gz QAVORRZLKJNHGK-UHFFFAOYSA-N 0 0 393.509 3.278 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000151666963 1418055134 /nfs/dbraw/zinc/05/51/34/1418055134.db2.gz VXABSBKSMCSFSW-FQEVSTJZSA-N 0 0 391.431 3.149 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC(C)(c2ccccc2)CC1 ZINC000151678686 1418058300 /nfs/dbraw/zinc/05/83/00/1418058300.db2.gz JLXXRHBHFADBAP-INIZCTEOSA-N 0 0 395.459 3.293 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)CCc2ccccc2[N+](=O)[O-])s1 ZINC000178952703 1429227561 /nfs/dbraw/zinc/22/75/61/1429227561.db2.gz NMSOISDFHDILKN-ZDUSSCGKSA-N 0 0 397.522 3.487 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000151688715 1418061581 /nfs/dbraw/zinc/06/15/81/1418061581.db2.gz WMPQCMBJZDLWMV-OLZOCXBDSA-N 0 0 379.848 3.278 20 5 GGBDRN O=C(CN1CCc2c1cccc2[N+](=O)[O-])N[C@@H](c1nccs1)c1ccccc1 ZINC000178947854 1429227650 /nfs/dbraw/zinc/22/76/50/1429227650.db2.gz CTKINBPCSNRMLW-LJQANCHMSA-N 0 0 394.456 3.320 20 5 GGBDRN C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000151688603 1418061940 /nfs/dbraw/zinc/06/19/40/1418061940.db2.gz WMPQCMBJZDLWMV-CHWSQXEVSA-N 0 0 379.848 3.278 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000178952735 1429227668 /nfs/dbraw/zinc/22/76/68/1429227668.db2.gz IVNLXOWIWKDMQI-ZDUSSCGKSA-N 0 0 397.522 3.487 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@H]3C[C@@H](O)c3ccco3)n2)cc1 ZINC000151740936 1418075669 /nfs/dbraw/zinc/07/56/69/1418075669.db2.gz WYLBEQOTSZQTSM-JKSUJKDBSA-N 0 0 384.392 3.326 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000151748517 1418077526 /nfs/dbraw/zinc/07/75/26/1418077526.db2.gz UABSYIKWEQVJRT-HNNXBMFYSA-N 0 0 384.440 3.149 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1)[C@@H]1CCCO1 ZINC000151748678 1418077781 /nfs/dbraw/zinc/07/77/81/1418077781.db2.gz TWSAGSSTMXIJRN-ROUUACIJSA-N 0 0 386.452 3.144 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000151757745 1418080001 /nfs/dbraw/zinc/08/00/01/1418080001.db2.gz DAADYUJRKIJIOP-OAHLLOKOSA-N 0 0 379.438 3.160 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-] ZINC000151768002 1418083024 /nfs/dbraw/zinc/08/30/24/1418083024.db2.gz XBIWQPSJRILTEN-HNNXBMFYSA-N 0 0 379.438 3.160 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cnn(-c2ccccc2)c1C ZINC000178974872 1429232478 /nfs/dbraw/zinc/23/24/78/1429232478.db2.gz LDSRIIHLWJPCAJ-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN Cc1c(CN2C(=O)N[C@]3(CCc4cc(Cl)ccc43)C2=O)cccc1[N+](=O)[O-] ZINC000151800833 1418089976 /nfs/dbraw/zinc/08/99/76/1418089976.db2.gz LZXGYGQMXOPSBS-IBGZPJMESA-N 0 0 385.807 3.450 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N(C)CCCOc2ccc(S(C)(=O)=O)cc2)c1 ZINC000151950598 1418102746 /nfs/dbraw/zinc/10/27/46/1418102746.db2.gz RDZIMJHHXIFRKA-UHFFFAOYSA-N 0 0 378.450 3.212 20 5 GGBDRN O=C(CN1CCC[C@H]1C[C@@H](O)c1ccco1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000151963942 1418107399 /nfs/dbraw/zinc/10/73/99/1418107399.db2.gz OCTPGZRRMBNAOR-XJKSGUPXSA-N 0 0 393.827 3.368 20 5 GGBDRN Cc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)c(OC[C@H]2CCCO2)c1 ZINC000151966297 1418107996 /nfs/dbraw/zinc/10/79/96/1418107996.db2.gz LWOGWAKHLYYNBJ-LJQANCHMSA-N 0 0 384.432 3.320 20 5 GGBDRN COC(=O)C1CCC(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000151967702 1418108245 /nfs/dbraw/zinc/10/82/45/1418108245.db2.gz DXFSQKHJRFGIFA-UHFFFAOYSA-N 0 0 375.425 3.001 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H](O)Cc1ccccc1 ZINC000151981769 1418111771 /nfs/dbraw/zinc/11/17/71/1418111771.db2.gz HUORQZFJJVHYMV-MEDUHNTESA-N 0 0 382.338 3.336 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H](O)Cc1ccccc1 ZINC000151982046 1418112494 /nfs/dbraw/zinc/11/24/94/1418112494.db2.gz HUORQZFJJVHYMV-BZNIZROVSA-N 0 0 382.338 3.336 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000152006420 1418118637 /nfs/dbraw/zinc/11/86/37/1418118637.db2.gz QPJMRBPPJHLVFX-QGZVFWFLSA-N 0 0 396.852 3.152 20 5 GGBDRN CN(Cc1ccccc1N1CCOCC1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000152009055 1418119055 /nfs/dbraw/zinc/11/90/55/1418119055.db2.gz IAVXGUVYGIAQGI-UHFFFAOYSA-N 0 0 383.448 3.023 20 5 GGBDRN COc1cc(NC(C)=O)ccc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000152011257 1418119838 /nfs/dbraw/zinc/11/98/38/1418119838.db2.gz XMPMWXCYMPBXQH-UHFFFAOYSA-N 0 0 383.364 3.224 20 5 GGBDRN C[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](O)Cc1ccccc1 ZINC000152019547 1418122340 /nfs/dbraw/zinc/12/23/40/1418122340.db2.gz VCALBOBTLKIYLN-ACJLOTCBSA-N 0 0 397.456 3.440 20 5 GGBDRN Cc1nc(Sc2nnc(-c3cnccn3)n2Cc2ccco2)ccc1[N+](=O)[O-] ZINC000152027846 1418124995 /nfs/dbraw/zinc/12/49/95/1418124995.db2.gz CPAICRLFFOYCBD-UHFFFAOYSA-N 0 0 395.404 3.139 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000152058190 1418132901 /nfs/dbraw/zinc/13/29/01/1418132901.db2.gz IVBVJNUCFQSOFH-BHADISHBSA-N 0 0 394.855 3.479 20 5 GGBDRN COc1ccc(NC(=O)CNc2cc(C)ccc2-n2cc(C)cn2)c([N+](=O)[O-])c1 ZINC000152057961 1418133139 /nfs/dbraw/zinc/13/31/39/1418133139.db2.gz GWAJOVOPDSJJOQ-UHFFFAOYSA-N 0 0 395.419 3.457 20 5 GGBDRN O=C(N[C@H]1[C@H]2CCO[C@@H]2C12CCCC2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000152073409 1418138020 /nfs/dbraw/zinc/13/80/20/1418138020.db2.gz UCDNIAPSSDRVDV-UXPWSPDFSA-N 0 0 399.491 3.275 20 5 GGBDRN 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ZINC000152122876 1418151039 /nfs/dbraw/zinc/15/10/39/1418151039.db2.gz IAMPNLINNGNFDR-MGPUTAFESA-N 0 0 390.439 3.376 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C12CCC2 ZINC000152130138 1418152341 /nfs/dbraw/zinc/15/23/41/1418152341.db2.gz JSNVWGHOUCHLTN-OALUTQOASA-N 0 0 387.480 3.275 20 5 GGBDRN O=C(c1cn(Cc2cccc(F)c2)nn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152175525 1418165241 /nfs/dbraw/zinc/16/52/41/1418165241.db2.gz QXBWUARANZXDKX-UHFFFAOYSA-N 0 0 395.394 3.179 20 5 GGBDRN O=C(NC1(c2cccc(F)c2)CCOCC1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000152188692 1418168669 /nfs/dbraw/zinc/16/86/69/1418168669.db2.gz IENIYKNUWXBDJX-UHFFFAOYSA-N 0 0 380.322 3.448 20 5 GGBDRN CN(C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)C1(C(N)=O)CCCC1 ZINC000152203194 1418172074 /nfs/dbraw/zinc/17/20/74/1418172074.db2.gz RSMSUPQFJQRCJY-UHFFFAOYSA-N 0 0 382.420 3.209 20 5 GGBDRN COC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000152204822 1418172663 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COC[C@H](NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)C1CC1 ZINC000152296204 1418197914 /nfs/dbraw/zinc/19/79/14/1418197914.db2.gz QSPHYBMEOSFZBT-AWEZNQCLSA-N 0 0 399.234 3.242 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000179012387 1429242847 /nfs/dbraw/zinc/24/28/47/1429242847.db2.gz POGXKQLOSRLUBP-LLVKDONJSA-N 0 0 397.478 3.127 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@@]1(O)CCc2ccccc21 ZINC000179054946 1429251044 /nfs/dbraw/zinc/25/10/44/1429251044.db2.gz PEPPKSXCFVMQCQ-NRFANRHFSA-N 0 0 383.448 3.051 20 5 GGBDRN CC(C)(CO)[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000179078064 1429256661 /nfs/dbraw/zinc/25/66/61/1429256661.db2.gz YRYVYDCQSVUZOA-MRXNPFEDSA-N 0 0 392.477 3.213 20 5 GGBDRN C[C@H](NC(=O)NCCOc1ncccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000179071920 1429254739 /nfs/dbraw/zinc/25/47/39/1429254739.db2.gz AMMPRPOITRKTNE-NSHDSACASA-N 0 0 398.341 3.448 20 5 GGBDRN O=C(c1cccc(F)n1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000179075135 1429255143 /nfs/dbraw/zinc/25/51/43/1429255143.db2.gz OHVBANQPMLIKOQ-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN CC(C)(CO)[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000179078055 1429256470 /nfs/dbraw/zinc/25/64/70/1429256470.db2.gz YRYVYDCQSVUZOA-INIZCTEOSA-N 0 0 392.477 3.213 20 5 GGBDRN Cc1ccc(N2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)cc1C ZINC000179088390 1429258703 /nfs/dbraw/zinc/25/87/03/1429258703.db2.gz VBMHGBOBPXQQAU-UHFFFAOYSA-N 0 0 383.448 3.400 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCc1nnc(-c2ccccc2)o1 ZINC000179099912 1429262060 /nfs/dbraw/zinc/26/20/60/1429262060.db2.gz XXQDBWKOZHJLNV-UHFFFAOYSA-N 0 0 391.387 3.028 20 5 GGBDRN COC(=O)c1cc(OC[C@H](O)c2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000179113830 1429266809 /nfs/dbraw/zinc/26/68/09/1429266809.db2.gz OVTBCVQDNQCLKF-HNNXBMFYSA-N 0 0 396.193 3.256 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1cccn1C ZINC000179124257 1429269870 /nfs/dbraw/zinc/26/98/70/1429269870.db2.gz 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O=C(Nc1ncccc1OC(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179176082 1429285575 /nfs/dbraw/zinc/28/55/75/1429285575.db2.gz KDONLHDLMCNLRS-UHFFFAOYSA-N 0 0 375.291 3.029 20 5 GGBDRN CC(C)[C@](C)(O)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000179178037 1429286725 /nfs/dbraw/zinc/28/67/25/1429286725.db2.gz USMUXCZOUDKQER-CYBMUJFWSA-N 0 0 379.638 3.148 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC[C@H](COc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000179179579 1429286870 /nfs/dbraw/zinc/28/68/70/1429286870.db2.gz IBUJAFWZPVQOOM-LBPRGKRZSA-N 0 0 392.843 3.465 20 5 GGBDRN CNC(=O)CCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000179184096 1429288386 /nfs/dbraw/zinc/28/83/86/1429288386.db2.gz DQKNKYSNXMMCSL-UHFFFAOYSA-N 0 0 387.461 3.344 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCC1(c2ccc(F)cc2F)CC1 ZINC000179216396 1429297307 /nfs/dbraw/zinc/29/73/07/1429297307.db2.gz GQSHACBXMMHSCD-UHFFFAOYSA-N 0 0 391.374 3.413 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000179232111 1429300533 /nfs/dbraw/zinc/30/05/33/1429300533.db2.gz HQPUEXYZGNKPKK-WBMJQRKESA-N 0 0 399.472 3.425 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 ZINC000179232125 1429300815 /nfs/dbraw/zinc/30/08/15/1429300815.db2.gz HQPUEXYZGNKPKK-LRDDRELGSA-N 0 0 399.472 3.425 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H](C)[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179234698 1429301279 /nfs/dbraw/zinc/30/12/79/1429301279.db2.gz MZJIROPUVUNFOL-BOABCZMQSA-N 0 0 393.465 3.192 20 5 GGBDRN CC(C)n1ccc(CS(=O)(=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000179236706 1429301932 /nfs/dbraw/zinc/30/19/32/1429301932.db2.gz PIEQFLNPZMVAPE-UHFFFAOYSA-N 0 0 390.421 3.142 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@H]1CCOC1)c1ccccc1 ZINC000179253110 1429305930 /nfs/dbraw/zinc/30/59/30/1429305930.db2.gz GLPHPKMBRVUFQE-SUMWQHHRSA-N 0 0 375.812 3.307 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)N1CCc2sccc2C1 ZINC000179246054 1429303699 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383.448 3.228 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179316949 1429326524 /nfs/dbraw/zinc/32/65/24/1429326524.db2.gz JTPUSSOATHAIRW-CWTRNNRKSA-N 0 0 385.395 3.386 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000179318332 1429327117 /nfs/dbraw/zinc/32/71/17/1429327117.db2.gz DVJKBVFHNSSFRV-AWEZNQCLSA-N 0 0 387.436 3.290 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000179318342 1429327206 /nfs/dbraw/zinc/32/72/06/1429327206.db2.gz DVJKBVFHNSSFRV-CQSZACIVSA-N 0 0 387.436 3.290 20 5 GGBDRN O=C(NCc1coc(-c2cccs2)n1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179325296 1429329150 /nfs/dbraw/zinc/32/91/50/1429329150.db2.gz RMZSAAUVCIVSJQ-UHFFFAOYSA-N 0 0 395.400 3.427 20 5 GGBDRN COc1ccc(C[C@H](C)C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000179328694 1429330548 /nfs/dbraw/zinc/33/05/48/1429330548.db2.gz MHOJUXRDICEXNO-INIZCTEOSA-N 0 0 383.448 3.131 20 5 GGBDRN O=C(c1cnc2ccc(F)cc2c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000179328656 1429330593 /nfs/dbraw/zinc/33/05/93/1429330593.db2.gz NXLWJRCEVBVHFD-UHFFFAOYSA-N 0 0 380.379 3.245 20 5 GGBDRN C[C@H](NC(=O)NC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000179329773 1429330935 /nfs/dbraw/zinc/33/09/35/1429330935.db2.gz BNIZTHKZLPHDKO-MGPLVRAMSA-N 0 0 381.791 3.481 20 5 GGBDRN COc1ccc(CN(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c(OC)c1 ZINC000179332689 1429331588 /nfs/dbraw/zinc/33/15/88/1429331588.db2.gz QRJCQYKWQXVKJP-UHFFFAOYSA-N 0 0 383.404 3.294 20 5 GGBDRN COC(=O)CCc1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000179334507 1429332514 /nfs/dbraw/zinc/33/25/14/1429332514.db2.gz VMPIMDVHFVDULR-UHFFFAOYSA-N 0 0 381.388 3.363 20 5 GGBDRN COc1ccccc1OC[C@@H](C)CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000179367337 1429346932 /nfs/dbraw/zinc/34/69/32/1429346932.db2.gz YNYVFBWRJXLJSX-HNNXBMFYSA-N 0 0 387.436 3.460 20 5 GGBDRN O=C(NCCc1ccc2c(c1)OCCO2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179385082 1429353501 /nfs/dbraw/zinc/35/35/01/1429353501.db2.gz UOAWRGFGFSHTQW-UHFFFAOYSA-N 0 0 397.431 3.283 20 5 GGBDRN COCCOc1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c(C)c1 ZINC000179389397 1429354873 /nfs/dbraw/zinc/35/48/73/1429354873.db2.gz VAPCKMCDEDFGJC-UHFFFAOYSA-N 0 0 396.403 3.366 20 5 GGBDRN CC[C@@H](NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1c(C)noc1C ZINC000179396995 1429358240 /nfs/dbraw/zinc/35/82/40/1429358240.db2.gz VWMOOQXSSJXLAE-QGZVFWFLSA-N 0 0 387.440 3.183 20 5 GGBDRN CC(C)NC(=O)c1ccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000179402319 1429360196 /nfs/dbraw/zinc/36/01/96/1429360196.db2.gz ZVHRMHVOYFIEQK-UHFFFAOYSA-N 0 0 383.448 3.486 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)Cc1ccc(C(C)C)cc1 ZINC000179413568 1429364520 /nfs/dbraw/zinc/36/45/20/1429364520.db2.gz OGGKTBDEWWCJFO-AWEZNQCLSA-N 0 0 399.447 3.413 20 5 GGBDRN O=C(NCc1ccn2ccnc2c1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000179419319 1429367272 /nfs/dbraw/zinc/36/72/72/1429367272.db2.gz ZJCCAPMGCJZTPV-UHFFFAOYSA-N 0 0 390.197 3.327 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179440971 1429377363 /nfs/dbraw/zinc/37/73/63/1429377363.db2.gz IKDCINDNDCLFGJ-GOSISDBHSA-N 0 0 381.432 3.418 20 5 GGBDRN CCOC(=O)c1cc(NC[C@H]2CC(=O)N(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000179439137 1429376125 /nfs/dbraw/zinc/37/61/25/1429376125.db2.gz KKJPHSDQQZHAML-MRXNPFEDSA-N 0 0 397.431 3.232 20 5 GGBDRN Cc1cc(F)ccc1-n1cc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)nn1 ZINC000179477275 1429388596 /nfs/dbraw/zinc/38/85/96/1429388596.db2.gz MGEAPUKDQBWULV-UHFFFAOYSA-N 0 0 377.282 3.154 20 5 GGBDRN O=C(OCCc1ccc([N+](=O)[O-])cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179510830 1429402645 /nfs/dbraw/zinc/40/26/45/1429402645.db2.gz RWAZGZQUQZMXTH-UHFFFAOYSA-N 0 0 382.332 3.088 20 5 GGBDRN Cc1nc(COc2cccc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])c2)no1 ZINC000179511924 1429403431 /nfs/dbraw/zinc/40/34/31/1429403431.db2.gz BZDSAEKGSBLYDC-UHFFFAOYSA-N 0 0 380.360 3.068 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[C@H](c4nnc(C5CC5)[nH]4)C3)o2)cc1 ZINC000179514216 1429404084 /nfs/dbraw/zinc/40/40/84/1429404084.db2.gz JOAOSDIILWHAOV-AWEZNQCLSA-N 0 0 395.423 3.020 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@H](c4nnc(C5CC5)[nH]4)C3)n2)cc1 ZINC000179508672 1429401453 /nfs/dbraw/zinc/40/14/53/1429401453.db2.gz NHQNXSJBNLTVEV-AWEZNQCLSA-N 0 0 395.423 3.020 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCC[C@@H]1c1cccc(F)c1 ZINC000179518818 1429407041 /nfs/dbraw/zinc/40/70/41/1429407041.db2.gz RKLATYUTSSWBRH-QGZVFWFLSA-N 0 0 378.425 3.443 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C(=O)NCC2CC2)C1 ZINC000179520090 1429407479 /nfs/dbraw/zinc/40/74/79/1429407479.db2.gz PFKFYGCZUNOJDU-AWEZNQCLSA-N 0 0 391.493 3.085 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000179520097 1429407582 /nfs/dbraw/zinc/40/75/82/1429407582.db2.gz PFKFYGCZUNOJDU-CQSZACIVSA-N 0 0 391.493 3.085 20 5 GGBDRN CS(=O)(=O)c1cccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000179523880 1429409225 /nfs/dbraw/zinc/40/92/25/1429409225.db2.gz MLIPFWRQWHEQCE-UHFFFAOYSA-N 0 0 389.433 3.195 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCCc2ccc(C)cc21 ZINC000179527928 1429410609 /nfs/dbraw/zinc/41/06/09/1429410609.db2.gz KAUHGKYXAXRQOP-MRXNPFEDSA-N 0 0 383.404 3.044 20 5 GGBDRN COc1cc(CN2CCc3c(cccc3NC(C)=O)C2)c([N+](=O)[O-])cc1OC ZINC000179530694 1429411950 /nfs/dbraw/zinc/41/19/50/1429411950.db2.gz CXEZPDQOZGGXKK-UHFFFAOYSA-N 0 0 385.420 3.129 20 5 GGBDRN O=C(Nc1ccon1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000179534515 1429415546 /nfs/dbraw/zinc/41/55/46/1429415546.db2.gz GCWGDXXGZKOLOH-UHFFFAOYSA-N 0 0 384.314 3.457 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000179539402 1429417482 /nfs/dbraw/zinc/41/74/82/1429417482.db2.gz VHHNFLADNZOACA-UHFFFAOYSA-N 0 0 378.388 3.162 20 5 GGBDRN CCOc1ccc([C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)c2ccccc2)cc1 ZINC000179541142 1429418456 /nfs/dbraw/zinc/41/84/56/1429418456.db2.gz KYACERQZLAZOOU-GOSISDBHSA-N 0 0 380.404 3.246 20 5 GGBDRN CCOc1ccc([C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)c2ccccc2)cc1 ZINC000179541151 1429418491 /nfs/dbraw/zinc/41/84/91/1429418491.db2.gz KYACERQZLAZOOU-SFHVURJKSA-N 0 0 380.404 3.246 20 5 GGBDRN O=C(Nc1ccc2[nH]c(Cc3ccccc3F)nc2c1)c1n[nH]cc1[N+](=O)[O-] ZINC000179543280 1429419396 /nfs/dbraw/zinc/41/93/96/1429419396.db2.gz YUIUBNTUBKESTG-UHFFFAOYSA-N 0 0 380.339 3.176 20 5 GGBDRN Cc1nn(CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000179543637 1429420427 /nfs/dbraw/zinc/42/04/27/1429420427.db2.gz CNQGUJAPBVJJGJ-OAHLLOKOSA-N 0 0 399.495 3.181 20 5 GGBDRN Cc1cccc(NC(=O)CN(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1C ZINC000179543887 1429420448 /nfs/dbraw/zinc/42/04/48/1429420448.db2.gz UMDKOGFOQKMQPF-UHFFFAOYSA-N 0 0 392.415 3.471 20 5 GGBDRN C[C@@H](CC(=O)OCc1ccccc1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179543395 1429420910 /nfs/dbraw/zinc/42/09/10/1429420910.db2.gz ZKBHQZJFVURWKN-AWEZNQCLSA-N 0 0 395.415 3.257 20 5 GGBDRN Cc1nn(CN2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000179546057 1429423423 /nfs/dbraw/zinc/42/34/23/1429423423.db2.gz NCGSSSZWJPQEFT-AWEZNQCLSA-N 0 0 389.456 3.057 20 5 GGBDRN O=C(Nc1ccn(Cc2ccccc2)n1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179549152 1429424355 /nfs/dbraw/zinc/42/43/55/1429424355.db2.gz PRCAYJGKJOUMDC-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1CCC1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1 ZINC000820703843 1429421686 /nfs/dbraw/zinc/42/16/86/1429421686.db2.gz KATVORWBTJIQES-HNNXBMFYSA-N 0 0 399.499 3.256 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000179552803 1429427813 /nfs/dbraw/zinc/42/78/13/1429427813.db2.gz XREBKRYTGBVAKM-OAHLLOKOSA-N 0 0 383.452 3.078 20 5 GGBDRN O=C(NCCCc1nc2ccccc2[nH]1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179559969 1429431956 /nfs/dbraw/zinc/43/19/56/1429431956.db2.gz UQVOPCCJQHUKQB-UHFFFAOYSA-N 0 0 375.388 3.382 20 5 GGBDRN COC(=O)c1cc(CN(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)oc1C ZINC000179557890 1429431062 /nfs/dbraw/zinc/43/10/62/1429431062.db2.gz ZCDQQDBZJDSHRT-UHFFFAOYSA-N 0 0 383.360 3.103 20 5 GGBDRN CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000179571480 1429441370 /nfs/dbraw/zinc/44/13/70/1429441370.db2.gz YZLXCESKWZPVJJ-UHFFFAOYSA-N 0 0 384.436 3.322 20 5 GGBDRN COCCn1nc(C)c(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000179577080 1429446962 /nfs/dbraw/zinc/44/69/62/1429446962.db2.gz VKEZPWKEQUQTAA-GFCCVEGCSA-N 0 0 375.429 3.246 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)N1CCc2sccc2C1 ZINC000179581379 1429451028 /nfs/dbraw/zinc/45/10/28/1429451028.db2.gz TUEMPYIBQZOSDE-ZDUSSCGKSA-N 0 0 396.472 3.381 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)CCC2 ZINC000179595295 1429460198 /nfs/dbraw/zinc/46/01/98/1429460198.db2.gz KEAPDSYNXPBAKC-MRXNPFEDSA-N 0 0 388.445 3.114 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000179591871 1429458076 /nfs/dbraw/zinc/45/80/76/1429458076.db2.gz RCVIXXJJXVKCBB-MRXNPFEDSA-N 0 0 382.420 3.073 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179601030 1429465176 /nfs/dbraw/zinc/46/51/76/1429465176.db2.gz UHRWVPNGWDGAGH-GFCCVEGCSA-N 0 0 386.412 3.010 20 5 GGBDRN CCc1n[nH]c(C(=O)N(C)Cc2c(C)nn(-c3ccccc3C)c2C)c1[N+](=O)[O-] ZINC000179603233 1429465578 /nfs/dbraw/zinc/46/55/78/1429465578.db2.gz CRBQNYPPDCKNQO-UHFFFAOYSA-N 0 0 396.451 3.263 20 5 GGBDRN O=C(C[C@H](O)c1ccc(Cl)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000179604678 1429467363 /nfs/dbraw/zinc/46/73/63/1429467363.db2.gz UEAMVSIYUVVPEU-SFHVURJKSA-N 0 0 389.839 3.021 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000179611191 1429470404 /nfs/dbraw/zinc/47/04/04/1429470404.db2.gz NNSXEALIUNQXPX-UHFFFAOYSA-N 0 0 398.463 3.254 20 5 GGBDRN CS(=O)(=O)Nc1cc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)ccc1F ZINC000179623107 1429475033 /nfs/dbraw/zinc/47/50/33/1429475033.db2.gz KNRNTFQEIDOAQX-UHFFFAOYSA-N 0 0 387.776 3.011 20 5 GGBDRN Cc1cc(F)ccc1-n1cc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)nn1 ZINC000179616441 1429472358 /nfs/dbraw/zinc/47/23/58/1429472358.db2.gz ZIKAUHZGJBWBJQ-UHFFFAOYSA-N 0 0 392.350 3.424 20 5 GGBDRN C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(OCC(=O)NC2CC2)cc1 ZINC000179655722 1429493187 /nfs/dbraw/zinc/49/31/87/1429493187.db2.gz JXTDGXNZYYLVMW-CYBMUJFWSA-N 0 0 387.411 3.242 20 5 GGBDRN O=C(Nc1ccccc1OCC1CC1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179668163 1429498334 /nfs/dbraw/zinc/49/83/34/1429498334.db2.gz YCRJABZIAQWCLL-UHFFFAOYSA-N 0 0 397.431 3.473 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179669311 1429499340 /nfs/dbraw/zinc/49/93/40/1429499340.db2.gz WVJWQMDRTLSORX-UHFFFAOYSA-N 0 0 381.310 3.101 20 5 GGBDRN CCn1c(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)nc2ccccc21 ZINC000179675549 1429502241 /nfs/dbraw/zinc/50/22/41/1429502241.db2.gz QOKDRZJCJNSQIA-UHFFFAOYSA-N 0 0 389.415 3.485 20 5 GGBDRN O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CC[C@H](CO)C1 ZINC000179678170 1429503802 /nfs/dbraw/zinc/50/38/02/1429503802.db2.gz RHUJTKHRBCUXAD-LBPRGKRZSA-N 0 0 376.796 3.495 20 5 GGBDRN CCCc1cc(NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n(C)n1 ZINC000179678864 1429503811 /nfs/dbraw/zinc/50/38/11/1429503811.db2.gz CSFVCFAVAHMHIS-UHFFFAOYSA-N 0 0 387.440 3.356 20 5 GGBDRN CCOC(=O)C1(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)CC1 ZINC000179683418 1429505238 /nfs/dbraw/zinc/50/52/38/1429505238.db2.gz MQVLRDDQVFHPCY-UHFFFAOYSA-N 0 0 375.406 3.309 20 5 GGBDRN Cc1cc(F)ccc1-n1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)nn1 ZINC000179693451 1429510349 /nfs/dbraw/zinc/51/03/49/1429510349.db2.gz AKOLOYBXZRIAAH-UHFFFAOYSA-N 0 0 395.394 3.428 20 5 GGBDRN O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CC[C@H](CO)C1 ZINC000179698826 1429512284 /nfs/dbraw/zinc/51/22/84/1429512284.db2.gz JEIJTGPOUBBVMK-ZDUSSCGKSA-N 0 0 389.839 3.315 20 5 GGBDRN 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ZINC000152803326 1422254902 /nfs/dbraw/zinc/25/49/02/1422254902.db2.gz AZBDRWWASIOBCL-AWEZNQCLSA-N 0 0 399.241 3.192 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)[C@H]1CSCCS1 ZINC000152809685 1422257236 /nfs/dbraw/zinc/25/72/36/1422257236.db2.gz KEYGBWMDQPORKE-LLVKDONJSA-N 0 0 378.269 3.249 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc(-n2nnnc2C2CC2)ccc1F ZINC000152809606 1422257363 /nfs/dbraw/zinc/25/73/63/1422257363.db2.gz FMEFPLKBDVANDP-UHFFFAOYSA-N 0 0 396.382 3.158 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000152833514 1422265545 /nfs/dbraw/zinc/26/55/45/1422265545.db2.gz RTHXJKAJNCFIPA-UHFFFAOYSA-N 0 0 395.257 3.146 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Oc1cc(F)cc(Br)c1 ZINC000152833236 1422265608 /nfs/dbraw/zinc/26/56/08/1422265608.db2.gz IZJUEJCYSDHCBE-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN CCOc1ccc([C@@H](C)NCc2cccnc2N2CCOCC2)cc1[N+](=O)[O-] ZINC000152840180 1422266994 /nfs/dbraw/zinc/26/69/94/1422266994.db2.gz POIPFZCDDFYIMV-OAHLLOKOSA-N 0 0 386.452 3.076 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)OC(C)(C)C ZINC000152859779 1422274099 /nfs/dbraw/zinc/27/40/99/1422274099.db2.gz NSOMYVHZXZAIMY-CYBMUJFWSA-N 0 0 377.441 3.045 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)COc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 ZINC000152866036 1422276595 /nfs/dbraw/zinc/27/65/95/1422276595.db2.gz XXDGYNDTPUJCJE-NSHDSACASA-N 0 0 399.247 3.269 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCN(c4ccc(O)cc4)CC3)co2)cc1 ZINC000152867655 1422276963 /nfs/dbraw/zinc/27/69/63/1422276963.db2.gz MDWJFNWYABZDIU-UHFFFAOYSA-N 0 0 380.404 3.278 20 5 GGBDRN COc1ccccc1COC1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000179759358 1429544146 /nfs/dbraw/zinc/54/41/46/1429544146.db2.gz VHEJGIFNUMIUAX-UHFFFAOYSA-N 0 0 399.447 3.223 20 5 GGBDRN Cc1cc(F)cc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000152877094 1422279801 /nfs/dbraw/zinc/27/98/01/1422279801.db2.gz IRROVUUSSUXELX-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCOC2(C1)CCCCCC2 ZINC000152887776 1422284517 /nfs/dbraw/zinc/28/45/17/1422284517.db2.gz HFARFNQAXRLKDR-OAHLLOKOSA-N 0 0 391.468 3.356 20 5 GGBDRN O=C(N[C@@H](CCCO)c1ccccc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000152906011 1422290802 /nfs/dbraw/zinc/29/08/02/1422290802.db2.gz OWDCMFFNCHULPA-KRWDZBQOSA-N 0 0 380.404 3.024 20 5 GGBDRN C[C@H](CNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Cc1cccs1 ZINC000152908481 1422291915 /nfs/dbraw/zinc/29/19/15/1422291915.db2.gz KFCBCVTWXVYERE-NSHDSACASA-N 0 0 395.868 3.035 20 5 GGBDRN CSc1ccc(C(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1[N+](=O)[O-] ZINC000152916263 1422295284 /nfs/dbraw/zinc/29/52/84/1422295284.db2.gz SBWWFYWFIRIJHG-HNNXBMFYSA-N 0 0 385.445 3.160 20 5 GGBDRN C[C@H]1C[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2[O-])CC[N@@H+]1Cc1ccccc1 ZINC000152923347 1422297511 /nfs/dbraw/zinc/29/75/11/1422297511.db2.gz KLUHWKJMGRRPQE-DOTOQJQBSA-N 0 0 383.448 3.426 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@H](O)COc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000152925418 1422298332 /nfs/dbraw/zinc/29/83/32/1422298332.db2.gz YAYNNDVYYVQRSO-INIZCTEOSA-N 0 0 377.368 3.074 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCCN1C(=O)c2ccccc2C1=O ZINC000152938625 1422302486 /nfs/dbraw/zinc/30/24/86/1422302486.db2.gz WCDOTSGPDKOMEJ-UHFFFAOYSA-N 0 0 381.388 3.227 20 5 GGBDRN Cc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)CC2)cc1C ZINC000152941234 1422303023 /nfs/dbraw/zinc/30/30/23/1422303023.db2.gz CMCFXJBMIUIJSY-UHFFFAOYSA-N 0 0 398.419 3.391 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000152941376 1422303025 /nfs/dbraw/zinc/30/30/25/1422303025.db2.gz CNXVNLNAZAZGQK-UHFFFAOYSA-N 0 0 396.428 3.395 20 5 GGBDRN COC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)c2ccccc21 ZINC000179762505 1429546631 /nfs/dbraw/zinc/54/66/31/1429546631.db2.gz YPMJCJJFCGAWKK-HNNXBMFYSA-N 0 0 377.356 3.060 20 5 GGBDRN C[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)OC(C)(C)C ZINC000152959321 1422307992 /nfs/dbraw/zinc/30/79/92/1422307992.db2.gz YKDOJIYFKLJUPN-AWEZNQCLSA-N 0 0 380.444 3.001 20 5 GGBDRN Cc1nc2ccc(NC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2o1 ZINC000152975135 1422313686 /nfs/dbraw/zinc/31/36/86/1422313686.db2.gz DWCBIXPQHKLKEG-UHFFFAOYSA-N 0 0 381.392 3.399 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)Cc2cc(C)nn2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000152984823 1422317491 /nfs/dbraw/zinc/31/74/91/1422317491.db2.gz LCHWDRZRUCHRGT-AWEZNQCLSA-N 0 0 394.431 3.459 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2)CN1c1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] ZINC000152984930 1422317585 /nfs/dbraw/zinc/31/75/85/1422317585.db2.gz PSIPGNHZIXKYNN-GOEBONIOSA-N 0 0 389.477 3.228 20 5 GGBDRN Cc1cc(C)c(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 ZINC000152995469 1422320321 /nfs/dbraw/zinc/32/03/21/1422320321.db2.gz VSLXMPCYDAYFDF-UHFFFAOYSA-N 0 0 381.432 3.118 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000153010609 1422325625 /nfs/dbraw/zinc/32/56/25/1422325625.db2.gz DKKNZDPJIBSYCQ-OAHLLOKOSA-N 0 0 394.431 3.215 20 5 GGBDRN Cc1ccc(N2CC[C@@H](NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000153014173 1422326086 /nfs/dbraw/zinc/32/60/86/1422326086.db2.gz LXNDUIZBBOOGOX-QGZVFWFLSA-N 0 0 387.823 3.021 20 5 GGBDRN Cc1ccc(N2CC[C@H](NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000153014077 1422326336 /nfs/dbraw/zinc/32/63/36/1422326336.db2.gz LXNDUIZBBOOGOX-KRWDZBQOSA-N 0 0 387.823 3.021 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@@H]2c2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000153019541 1422328605 /nfs/dbraw/zinc/32/86/05/1422328605.db2.gz NZGYJHGSIWMHDZ-XHDPSFHLSA-N 0 0 397.403 3.091 20 5 GGBDRN O=C(N[C@@H](CCCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000153036058 1422335080 /nfs/dbraw/zinc/33/50/80/1422335080.db2.gz GXCCCIYWIJJROX-IBGZPJMESA-N 0 0 383.448 3.439 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCCO[C@H]2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000153061316 1422343798 /nfs/dbraw/zinc/34/37/98/1422343798.db2.gz DSLFMYYQVWXCEM-SUMWQHHRSA-N 0 0 399.513 3.098 20 5 GGBDRN O=C(NCc1nncn1C1CC1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000153071203 1422346488 /nfs/dbraw/zinc/34/64/88/1422346488.db2.gz PECLCDPJUAEXOR-UHFFFAOYSA-N 0 0 392.419 3.063 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)CCCNc2c([N+](=O)[O-])c(C)nn2C)cc1 ZINC000153073880 1422347152 /nfs/dbraw/zinc/34/71/52/1422347152.db2.gz NWNFGVKEFLGFQI-CYBMUJFWSA-N 0 0 389.456 3.105 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)CCCNc2c([N+](=O)[O-])c(C)nn2C)cc1 ZINC000153073981 1422347530 /nfs/dbraw/zinc/34/75/30/1422347530.db2.gz NWNFGVKEFLGFQI-ZDUSSCGKSA-N 0 0 389.456 3.105 20 5 GGBDRN Cc1ccc(N2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CC2)cc1C ZINC000153084924 1422350727 /nfs/dbraw/zinc/35/07/27/1422350727.db2.gz CUFRZQXGUSDXSY-UHFFFAOYSA-N 0 0 379.420 3.050 20 5 GGBDRN Cc1c(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000153112637 1422360278 /nfs/dbraw/zinc/36/02/78/1422360278.db2.gz WWXBPXMNWBQWLX-JZXOWHBKSA-N 0 0 381.388 3.436 20 5 GGBDRN Cc1c(C(=O)NCc2nc(C(F)(F)F)cs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000153114300 1422361427 /nfs/dbraw/zinc/36/14/27/1422361427.db2.gz AEXNBUJMJIBUIR-UHFFFAOYSA-N 0 0 390.299 3.217 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)Cc2cc(C)nn2-c2ccccc2)c1 ZINC000153119231 1422363318 /nfs/dbraw/zinc/36/33/18/1422363318.db2.gz CYWJQXRADOZSKL-AWEZNQCLSA-N 0 0 394.431 3.459 20 5 GGBDRN O=C(N[C@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000153124892 1422365074 /nfs/dbraw/zinc/36/50/74/1422365074.db2.gz NOKKLOOJTHRULP-NSHDSACASA-N 0 0 398.316 3.156 20 5 GGBDRN Cc1cnccc1CCNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000153124508 1422365569 /nfs/dbraw/zinc/36/55/69/1422365569.db2.gz PDAKCLIVSXJHFQ-UHFFFAOYSA-N 0 0 396.369 3.478 20 5 GGBDRN COc1ccc(C(=O)N[C@H](C)Cc2cc(C)nn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000153143255 1422370485 /nfs/dbraw/zinc/37/04/85/1422370485.db2.gz BXQUXVACYKVFGI-CQSZACIVSA-N 0 0 394.431 3.459 20 5 GGBDRN CN(C)c1ccccc1N(C)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000153146663 1422371275 /nfs/dbraw/zinc/37/12/75/1422371275.db2.gz WKKUPAHFBPIFEG-UHFFFAOYSA-N 0 0 398.419 3.012 20 5 GGBDRN Cc1cccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c1 ZINC000153153824 1422373831 /nfs/dbraw/zinc/37/38/31/1422373831.db2.gz VEDQMDNJVIZZPU-FQEVSTJZSA-N 0 0 383.448 3.357 20 5 GGBDRN O=c1c(Cl)c(N(Cc2cccnc2)C2CC2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000153160237 1422376522 /nfs/dbraw/zinc/37/65/22/1422376522.db2.gz UIRVPIHTJCIXJF-UHFFFAOYSA-N 0 0 397.822 3.358 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000153165984 1422379320 /nfs/dbraw/zinc/37/93/20/1422379320.db2.gz NDMXXAVAJSERHQ-CQSZACIVSA-N 0 0 391.449 3.196 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000153194424 1422388193 /nfs/dbraw/zinc/38/81/93/1422388193.db2.gz NLCYGEJYWUXBMJ-HNNXBMFYSA-N 0 0 392.415 3.419 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2F)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000153197382 1422389879 /nfs/dbraw/zinc/38/98/79/1422389879.db2.gz OONUTEHSBFQJED-ZDUSSCGKSA-N 0 0 391.786 3.313 20 5 GGBDRN COCc1cccc(CNC(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000153207802 1422394100 /nfs/dbraw/zinc/39/41/00/1422394100.db2.gz KXZWRISOHRABLQ-UHFFFAOYSA-N 0 0 395.362 3.071 20 5 GGBDRN CN(C)c1nnc(-c2ccc(NC(=O)NCc3cccc([N+](=O)[O-])c3)cc2)o1 ZINC000179770792 1429551662 /nfs/dbraw/zinc/55/16/62/1429551662.db2.gz CSQIQQLQNDVHJW-UHFFFAOYSA-N 0 0 382.380 3.033 20 5 GGBDRN CC[C@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1cc(F)ccc1F ZINC000179770330 1429551876 /nfs/dbraw/zinc/55/18/76/1429551876.db2.gz HPCWNECRILFCDT-ZDUSSCGKSA-N 0 0 393.346 3.281 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(N2CCCCC2=O)CC1 ZINC000153228490 1422403381 /nfs/dbraw/zinc/40/33/81/1422403381.db2.gz GWHCSKXKHKOVLM-CQSZACIVSA-N 0 0 399.451 3.183 20 5 GGBDRN C[C@@H]1Oc2c(cccc2C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)NC1=O ZINC000153232620 1422406690 /nfs/dbraw/zinc/40/66/90/1422406690.db2.gz MERRSYVCJZXMPK-ZDUSSCGKSA-N 0 0 383.404 3.067 20 5 GGBDRN O=C(CCCc1ccc2[nH]c(=O)[nH]c2c1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153236874 1422410949 /nfs/dbraw/zinc/41/09/49/1422410949.db2.gz IYPWSWUOMDQGFT-UHFFFAOYSA-N 0 0 396.447 3.226 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CC[C@]4(CCOC4)C3)cc2[N+](=O)[O-])C1 ZINC000153249205 1422417562 /nfs/dbraw/zinc/41/75/62/1422417562.db2.gz MBCNJGQPVYOWAV-ZOCZFRKYSA-N 0 0 387.480 3.330 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCN(Cc2cccc(F)c2)CC1 ZINC000179774585 1429553771 /nfs/dbraw/zinc/55/37/71/1429553771.db2.gz FJEKBOSOFSSSAY-UHFFFAOYSA-N 0 0 394.406 3.240 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000153269529 1422430952 /nfs/dbraw/zinc/43/09/52/1422430952.db2.gz ICDMQVZHXKZNAZ-JKIFEVAISA-N 0 0 395.415 3.296 20 5 GGBDRN COC(=O)c1sccc1NC(=O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153277128 1422435122 /nfs/dbraw/zinc/43/51/22/1422435122.db2.gz DKKAXSWTXQRZLS-UHFFFAOYSA-N 0 0 389.433 3.046 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000153284580 1422438288 /nfs/dbraw/zinc/43/82/88/1422438288.db2.gz MWPLSKWSGXAUJD-VSDWSMLSSA-N 0 0 388.467 3.229 20 5 GGBDRN Cn1cnnc1Sc1ccccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000153293848 1422445776 /nfs/dbraw/zinc/44/57/76/1422445776.db2.gz FVTGJUXTPLQZFH-UHFFFAOYSA-N 0 0 383.433 3.446 20 5 GGBDRN CCC(=O)N1CC[C@@H](NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000153296115 1422449425 /nfs/dbraw/zinc/44/94/25/1422449425.db2.gz UKMGNAZXXIJBJG-MRXNPFEDSA-N 0 0 382.420 3.079 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2cccc(OC(F)F)c2)C1 ZINC000153301925 1422453374 /nfs/dbraw/zinc/45/33/74/1422453374.db2.gz GWLYCHNTPVDOEO-QGZVFWFLSA-N 0 0 392.358 3.339 20 5 GGBDRN CC(=O)N1CCCc2cc(S(=O)(=O)Nc3ccc(C)c([N+](=O)[O-])c3)ccc21 ZINC000153348216 1422483546 /nfs/dbraw/zinc/48/35/46/1422483546.db2.gz WDUQDUPLLHKYRD-UHFFFAOYSA-N 0 0 389.433 3.003 20 5 GGBDRN Cc1nn(C)c(Cl)c1COC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000153350273 1422484693 /nfs/dbraw/zinc/48/46/93/1422484693.db2.gz UWAJDCZZELGDGU-UHFFFAOYSA-N 0 0 388.605 3.410 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NCc3cccc(N(C)C)n3)cc2[N+](=O)[O-])CC1 ZINC000153361550 1422493560 /nfs/dbraw/zinc/49/35/60/1422493560.db2.gz ULPQQMXPRQZWDA-UHFFFAOYSA-N 0 0 397.479 3.222 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000153379780 1422505747 /nfs/dbraw/zinc/50/57/47/1422505747.db2.gz MYDMWVNIFLJNSU-KRWDZBQOSA-N 0 0 392.358 3.339 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1cc(Cl)ccc1-n1cncn1 ZINC000153387514 1422509728 /nfs/dbraw/zinc/50/97/28/1422509728.db2.gz GLZLBRBQMPEHKB-UHFFFAOYSA-N 0 0 375.747 3.149 20 5 GGBDRN Cc1c(C(=O)O[C@@H]([C@H]2CCCO2)C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000153409366 1422519775 /nfs/dbraw/zinc/51/97/75/1422519775.db2.gz WTLFRSFRQXUWCQ-NEPJUHHUSA-N 0 0 378.259 3.078 20 5 GGBDRN Cc1c(C(=O)O[C@@H]([C@@H]2CCCO2)C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000153409138 1422520185 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RDYMBRKOOJROKN-CQSZACIVSA-N 0 0 384.722 3.171 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccc(-c2ncco2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000153466297 1422552789 /nfs/dbraw/zinc/55/27/89/1422552789.db2.gz BAJOQNAXVXPBGI-LBPRGKRZSA-N 0 0 380.360 3.066 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1cccc([N+](=O)[O-])c1C)c1ccc(Cl)c(F)c1 ZINC000153472454 1422556623 /nfs/dbraw/zinc/55/66/23/1422556623.db2.gz CJEFQSIDRCISRJ-OAHLLOKOSA-N 0 0 380.759 3.340 20 5 GGBDRN O=C(NCc1ccccc1CN1CCCC1=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000153483853 1422562962 /nfs/dbraw/zinc/56/29/62/1422562962.db2.gz VLRKVHVUGZXENS-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN Cc1cccc([C@H](O)CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 ZINC000153499626 1422571710 /nfs/dbraw/zinc/57/17/10/1422571710.db2.gz FJFNFSGRZOINIT-JOCHJYFZSA-N 0 0 386.451 3.313 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3C)CC2)c1 ZINC000153501556 1422572893 /nfs/dbraw/zinc/57/28/93/1422572893.db2.gz QFICFNDKPPNCQI-UHFFFAOYSA-N 0 0 389.477 3.477 20 5 GGBDRN CCCNC(=O)c1cccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000153510213 1422578017 /nfs/dbraw/zinc/57/80/17/1422578017.db2.gz HHBIGPYGIHWRQN-UHFFFAOYSA-N 0 0 380.404 3.397 20 5 GGBDRN CCO[C@@H]1C[C@H](O)C12CCN(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC000153515484 1422579772 /nfs/dbraw/zinc/57/97/72/1422579772.db2.gz CDYDWRKUWYTRTK-LSDHHAIUSA-N 0 0 383.832 3.032 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccc(Cl)c(F)c1 ZINC000153524587 1422584566 /nfs/dbraw/zinc/58/45/66/1422584566.db2.gz LQVUNPQPDCBWCJ-HNNXBMFYSA-N 0 0 380.759 3.340 20 5 GGBDRN COc1cc(C)ccc1CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000153536799 1422592412 /nfs/dbraw/zinc/59/24/12/1422592412.db2.gz UCTYPYFIHBFFPO-UHFFFAOYSA-N 0 0 380.404 3.242 20 5 GGBDRN Cc1c(C)n(C[C@@H]2CCCO2)c2ncnc(NC(=O)c3ccccc3[N+](=O)[O-])c12 ZINC000153542628 1422599197 /nfs/dbraw/zinc/59/91/97/1422599197.db2.gz YOWMDLXSJIKARP-AWEZNQCLSA-N 0 0 395.419 3.388 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000153551216 1422605299 /nfs/dbraw/zinc/60/52/99/1422605299.db2.gz PGGYJSBOEODVLJ-LBPRGKRZSA-N 0 0 376.848 3.345 20 5 GGBDRN O=C(OCCn1cnc([N+](=O)[O-])n1)c1ccc(N2CCCc3ccccc32)cc1 ZINC000153557733 1422611923 /nfs/dbraw/zinc/61/19/23/1422611923.db2.gz RRBNMTDKFZVRQM-UHFFFAOYSA-N 0 0 393.403 3.128 20 5 GGBDRN CCN(CC)c1ccc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cn1 ZINC000153558767 1422614940 /nfs/dbraw/zinc/61/49/40/1422614940.db2.gz ZPJDYZDOYQNIOO-UHFFFAOYSA-N 0 0 383.452 3.104 20 5 GGBDRN CCc1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000153560028 1422616217 /nfs/dbraw/zinc/61/62/17/1422616217.db2.gz HZQOVHTXGCODDJ-GOSISDBHSA-N 0 0 382.416 3.271 20 5 GGBDRN CN(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Cc1nc[nH]n1 ZINC000179798419 1429572161 /nfs/dbraw/zinc/57/21/61/1429572161.db2.gz YDVAOTPZQMZKFL-UHFFFAOYSA-N 0 0 389.419 3.198 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000153569967 1422624090 /nfs/dbraw/zinc/62/40/90/1422624090.db2.gz VYPJEHQEQVKLJF-OAHLLOKOSA-N 0 0 386.456 3.379 20 5 GGBDRN Cn1cnc(-c2cccc(NCc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000153571618 1422624810 /nfs/dbraw/zinc/62/48/10/1422624810.db2.gz VBBSRZZBNLMARO-UHFFFAOYSA-N 0 0 389.419 3.403 20 5 GGBDRN C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccc(OCC(=O)NC2CC2)cc1 ZINC000153598413 1422639733 /nfs/dbraw/zinc/63/97/33/1422639733.db2.gz NELMIANNJSNKIJ-LLVKDONJSA-N 0 0 390.827 3.474 20 5 GGBDRN CCc1cc(N2CCC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2)ncn1 ZINC000153619286 1422652652 /nfs/dbraw/zinc/65/26/52/1422652652.db2.gz FPJCIVVVQBXOAA-INIZCTEOSA-N 0 0 384.440 3.046 20 5 GGBDRN CCc1cc(N2CCC[C@@H](NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2)ncn1 ZINC000153619405 1422653538 /nfs/dbraw/zinc/65/35/38/1422653538.db2.gz FPJCIVVVQBXOAA-MRXNPFEDSA-N 0 0 384.440 3.046 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000153632751 1422661892 /nfs/dbraw/zinc/66/18/92/1422661892.db2.gz IETWVGLNTWUAJM-UHFFFAOYSA-N 0 0 396.447 3.003 20 5 GGBDRN COC(=O)c1ccc(OC[C@@H](O)c2ccccc2Br)c([N+](=O)[O-])c1 ZINC000153642009 1422669292 /nfs/dbraw/zinc/66/92/92/1422669292.db2.gz UCPKLXVJFBVDGF-CQSZACIVSA-N 0 0 396.193 3.256 20 5 GGBDRN Cc1cc(Cl)cc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1O ZINC000179804279 1429577197 /nfs/dbraw/zinc/57/71/97/1429577197.db2.gz RNHHBAUFZUPBRA-JTQLQIEISA-N 0 0 377.784 3.019 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)CC3(O)CCCC3)cc2[N+](=O)[O-])C1 ZINC000153657931 1422683576 /nfs/dbraw/zinc/68/35/76/1422683576.db2.gz FHTSDIGCTXRDEH-IYBDPMFKSA-N 0 0 389.496 3.454 20 5 GGBDRN COc1cccc2c1CC[C@H]2NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000153662314 1422687272 /nfs/dbraw/zinc/68/72/72/1422687272.db2.gz XNQMCKMGCSZOKO-QGZVFWFLSA-N 0 0 378.388 3.206 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1 ZINC000179805520 1429578412 /nfs/dbraw/zinc/57/84/12/1429578412.db2.gz FHNNCPWAISEENE-UHFFFAOYSA-N 0 0 394.424 3.456 20 5 GGBDRN O=C(c1c(F)cccc1Cl)N1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153696995 1422708410 /nfs/dbraw/zinc/70/84/10/1422708410.db2.gz JGNPLSKFCCHUFZ-UHFFFAOYSA-N 0 0 399.209 3.398 20 5 GGBDRN CC(C)[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C2CC2)no1 ZINC000179806209 1429579784 /nfs/dbraw/zinc/57/97/84/1429579784.db2.gz UBJNTURTCLZZJO-HNNXBMFYSA-N 0 0 393.831 3.434 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COC2CCOCC2)c(-c2cccs2)c1 ZINC000153704566 1422712173 /nfs/dbraw/zinc/71/21/73/1422712173.db2.gz UCQCYEKIJXBAHK-AWEZNQCLSA-N 0 0 379.434 3.259 20 5 GGBDRN Cc1cc(NC(=O)N(C)CC(=O)Nc2cc(F)cc(F)c2)ccc1[N+](=O)[O-] ZINC000153716208 1422718303 /nfs/dbraw/zinc/71/83/03/1422718303.db2.gz AKHFXEIZJFTDNO-UHFFFAOYSA-N 0 0 378.335 3.284 20 5 GGBDRN Cc1c(C(=O)N2CCCc3cccc(F)c32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000153725706 1422725168 /nfs/dbraw/zinc/72/51/68/1422725168.db2.gz OMTXAKNPPJYXDR-UHFFFAOYSA-N 0 0 381.367 3.216 20 5 GGBDRN CC(C)OCCCNC(=O)C1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153739723 1422731172 /nfs/dbraw/zinc/73/11/72/1422731172.db2.gz 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CC1(C)C[C@@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])CCO1 ZINC000153801038 1422764569 /nfs/dbraw/zinc/76/45/69/1422764569.db2.gz IFEDNRHQGTXOJJ-JTQLQIEISA-N 0 0 376.331 3.223 20 5 GGBDRN Cc1cc(NC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000153808548 1422769848 /nfs/dbraw/zinc/76/98/48/1422769848.db2.gz HGENPXXWFBJRHM-INIZCTEOSA-N 0 0 388.811 3.262 20 5 GGBDRN C[C@H]1CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C[C@H]1n1ccnc1 ZINC000153822501 1422779683 /nfs/dbraw/zinc/77/96/83/1422779683.db2.gz YAVSASCHQASRTO-QFBILLFUSA-N 0 0 385.468 3.407 20 5 GGBDRN C[C@@H]1CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C[C@H]1n1ccnc1 ZINC000153822391 1422780536 /nfs/dbraw/zinc/78/05/36/1422780536.db2.gz YAVSASCHQASRTO-VQIMIIECSA-N 0 0 385.468 3.407 20 5 GGBDRN C[C@H]1CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C[C@@H]1n1ccnc1 ZINC000153822278 1422780552 /nfs/dbraw/zinc/78/05/52/1422780552.db2.gz YAVSASCHQASRTO-LPHOPBHVSA-N 0 0 385.468 3.407 20 5 GGBDRN CCOc1ncccc1CNC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000153827031 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AJOWKMHFMUFLNL-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN COc1ccc([C@H]2CCN(CC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])C2)cc1 ZINC000155298013 1423306676 /nfs/dbraw/zinc/30/66/76/1423306676.db2.gz IURUSRYNHZUHCN-HNNXBMFYSA-N 0 0 385.420 3.040 20 5 GGBDRN CCNC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000155321342 1423316209 /nfs/dbraw/zinc/31/62/09/1423316209.db2.gz ZBSAKNWGNAJXFS-UHFFFAOYSA-N 0 0 398.463 3.099 20 5 GGBDRN O=C(Nc1cccn(CC(F)(F)F)c1=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000155358761 1423331337 /nfs/dbraw/zinc/33/13/37/1423331337.db2.gz MOFMPOUEDHAXFX-UHFFFAOYSA-N 0 0 375.690 3.225 20 5 GGBDRN O=C(c1cccc(OC(F)(F)F)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000155364321 1423334076 /nfs/dbraw/zinc/33/40/76/1423334076.db2.gz MTBQASMYYFGGRU-GFCCVEGCSA-N 0 0 396.325 3.215 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(C)(C)C(N)=O)cc1 ZINC000155369909 1423337368 /nfs/dbraw/zinc/33/73/68/1423337368.db2.gz RNMLOCSKPUFPJI-LBPRGKRZSA-N 0 0 387.461 3.477 20 5 GGBDRN 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YRFCXUATFLVEJX-CYBMUJFWSA-N 0 0 377.828 3.361 20 5 GGBDRN CC[C@@H](CO)NC(=O)c1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000155534046 1423404908 /nfs/dbraw/zinc/40/49/08/1423404908.db2.gz YRFCXUATFLVEJX-ZDUSSCGKSA-N 0 0 377.828 3.361 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@@H](O)CO[C@H]2CCCc3ccccc32)c1 ZINC000155534377 1423404921 /nfs/dbraw/zinc/40/49/21/1423404921.db2.gz SMJOZKZJIPDSFY-PXNSSMCTSA-N 0 0 386.448 3.495 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@H]1CCCC[C@@H]1O ZINC000155535407 1423405860 /nfs/dbraw/zinc/40/58/60/1423405860.db2.gz KYTVFMJEVMNFER-ABAIWWIYSA-N 0 0 389.374 3.083 20 5 GGBDRN CC[C@@H](CO)NC(=O)Cc1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000155543955 1423410640 /nfs/dbraw/zinc/41/06/40/1423410640.db2.gz SKDCQXMUTIKGCK-AWEZNQCLSA-N 0 0 391.855 3.290 20 5 GGBDRN COc1cc(NCc2c(Cl)cccc2[N+](=O)[O-])ccc1S(=O)(=O)N(C)C ZINC000155560706 1423418200 /nfs/dbraw/zinc/41/82/00/1423418200.db2.gz YVOFMFKYIVQVOK-UHFFFAOYSA-N 0 0 399.856 3.119 20 5 GGBDRN Cc1coc(-c2cc(NC(=O)C(=O)NCc3ccc([N+](=O)[O-])cc3)ccc2C)n1 ZINC000155562940 1423419424 /nfs/dbraw/zinc/41/94/24/1423419424.db2.gz VJBAXIUPBKANCN-UHFFFAOYSA-N 0 0 394.387 3.122 20 5 GGBDRN COCCN(C(=O)c1cc(C)ncn1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000155590128 1423434569 /nfs/dbraw/zinc/43/45/69/1423434569.db2.gz HHLMCJRKXUBXCU-UHFFFAOYSA-N 0 0 399.432 3.110 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000155605989 1423441166 /nfs/dbraw/zinc/44/11/66/1423441166.db2.gz GJSFJRMHNSDCTI-LBPRGKRZSA-N 0 0 389.374 3.489 20 5 GGBDRN O=C(CNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)Nc1cccc2cccnc21 ZINC000155621134 1423451249 /nfs/dbraw/zinc/45/12/49/1423451249.db2.gz VXTCDTSJHMNIRO-UHFFFAOYSA-N 0 0 384.779 3.165 20 5 GGBDRN CN(CCOc1ccccc1[N+](=O)[O-])[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155621625 1423451334 /nfs/dbraw/zinc/45/13/34/1423451334.db2.gz BCJVEUHDLMKQOD-HNNXBMFYSA-N 0 0 396.852 3.087 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@@H](C)c1ccc(Br)cc1 ZINC000155635516 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CC[C@@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1c(C)noc1C ZINC000155769982 1423527017 /nfs/dbraw/zinc/52/70/17/1423527017.db2.gz ZFCPUVDKCMRWEV-SMDDNHRTSA-N 0 0 376.413 3.276 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(Cc2cccc(F)c2)CC1 ZINC000155798770 1423538849 /nfs/dbraw/zinc/53/88/49/1423538849.db2.gz BWSAJAOMKYPRMD-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000155798170 1423539255 /nfs/dbraw/zinc/53/92/55/1423539255.db2.gz IYZSQNIVPDURHR-UHFFFAOYSA-N 0 0 389.375 3.069 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(O)c(-c2nc3ccccc3s2)c1 ZINC000179935510 1429651382 /nfs/dbraw/zinc/65/13/82/1429651382.db2.gz HMJOAOUSIAJZCE-UHFFFAOYSA-N 0 0 395.400 3.412 20 5 GGBDRN Cc1cc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cnc1Cl ZINC000155820245 1423546956 /nfs/dbraw/zinc/54/69/56/1423546956.db2.gz KIOIOCPLVVLOCG-NSHDSACASA-N 0 0 394.840 3.256 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2coc(-c3cccs3)n2)cc([N+](=O)[O-])c1F 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ZINC000156133177 1423687240 /nfs/dbraw/zinc/68/72/40/1423687240.db2.gz XWRREKMXHJJNAV-UHFFFAOYSA-N 0 0 394.431 3.038 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCCOCC3)cc2[N+](=O)[O-])C1 ZINC000179959796 1429663657 /nfs/dbraw/zinc/66/36/57/1429663657.db2.gz YYJXEMUACVSPFG-HLLBOEOZSA-N 0 0 375.469 3.376 20 5 GGBDRN Cc1c(CS(=O)(=O)CC(=O)NCCCC2CCCCC2)cccc1[N+](=O)[O-] ZINC000156170763 1423705389 /nfs/dbraw/zinc/70/53/89/1423705389.db2.gz KPNLFODGDXVCJS-UHFFFAOYSA-N 0 0 396.509 3.295 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(CSc2nc[nH]n2)cc1 ZINC000179961055 1429664728 /nfs/dbraw/zinc/66/47/28/1429664728.db2.gz VPVCHPQOEIRYOE-UHFFFAOYSA-N 0 0 395.404 3.134 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(-n2cc[nH]c2=S)cc1 ZINC000179963418 1429664953 /nfs/dbraw/zinc/66/49/53/1429664953.db2.gz VSRKPTBLLGGHLQ-UHFFFAOYSA-N 0 0 380.389 3.198 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2)n(-c2ccccc2)n1 ZINC000156212708 1423729406 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Cn1cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc(Cl)c1=O ZINC000156401580 1423805805 /nfs/dbraw/zinc/80/58/05/1423805805.db2.gz WYELYQVHUAPAKZ-UHFFFAOYSA-N 0 0 390.808 3.323 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)Oc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000156405451 1423806526 /nfs/dbraw/zinc/80/65/26/1423806526.db2.gz HZIHLLMDEWQQMO-UHFFFAOYSA-N 0 0 377.418 3.235 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N1CCC[C@H]1CCCc1ccccc1 ZINC000156449044 1423811614 /nfs/dbraw/zinc/81/16/14/1423811614.db2.gz FKPRZHZUHCDANB-LJQANCHMSA-N 0 0 395.459 3.339 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCN(c2cccs2)CC1 ZINC000156462373 1423813139 /nfs/dbraw/zinc/81/31/39/1423813139.db2.gz YAKGQAXJPKCADH-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN Cc1cc(Br)cnc1NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000156459707 1423813311 /nfs/dbraw/zinc/81/33/11/1423813311.db2.gz FEMUPILKMGMILO-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000156468084 1423813905 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ISVHDVKBCKSKFY-KRWDZBQOSA-N 0 0 382.416 3.130 20 5 GGBDRN O=C(c1cccs1)N1CCCC[C@@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156498775 1423819012 /nfs/dbraw/zinc/81/90/12/1423819012.db2.gz KLKOWEHJLKKWHF-QGZVFWFLSA-N 0 0 399.472 3.236 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156501158 1423819467 /nfs/dbraw/zinc/81/94/67/1423819467.db2.gz FJAVROBMXXDOKP-LJQANCHMSA-N 0 0 399.422 3.073 20 5 GGBDRN CC(C)(C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc2c(c1)OCCO2 ZINC000156514249 1423821517 /nfs/dbraw/zinc/82/15/17/1423821517.db2.gz FCOBXEJBZSNJEO-UHFFFAOYSA-N 0 0 382.416 3.229 20 5 GGBDRN O=C(N1CCc2ccc([N+](=O)[O-])cc2C1)[C@@]12CCC(=O)N1c1ccccc1S2 ZINC000156518730 1423822517 /nfs/dbraw/zinc/82/25/17/1423822517.db2.gz GGLXGWSUOKGOIJ-FQEVSTJZSA-N 0 0 395.440 3.109 20 5 GGBDRN CC[C@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156541010 1423825315 /nfs/dbraw/zinc/82/53/15/1423825315.db2.gz XWXGAEYPBWFSHQ-MGPUTAFESA-N 0 0 395.459 3.324 20 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O=C(c1ccc(OC[C@H]2CCCO2)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156588433 1423833180 /nfs/dbraw/zinc/83/31/80/1423833180.db2.gz REMASYVDGIEQPE-HXUWFJFHSA-N 0 0 382.416 3.351 20 5 GGBDRN O=C(c1ccnc(OCC(F)(F)F)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156591133 1423833204 /nfs/dbraw/zinc/83/32/04/1423833204.db2.gz DQLJSNBNSHBNRI-UHFFFAOYSA-N 0 0 381.310 3.129 20 5 GGBDRN CCNc1ccc(C(=O)NCc2ccc(C)cc2O[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000156597211 1423834018 /nfs/dbraw/zinc/83/40/18/1423834018.db2.gz HMSVUNXOPDOUNX-QGZVFWFLSA-N 0 0 399.447 3.433 20 5 GGBDRN Cc1cccc(C(=O)N[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C(C)C)c1 ZINC000156602928 1423834596 /nfs/dbraw/zinc/83/45/96/1423834596.db2.gz ANINXLONOYQEQG-HXUWFJFHSA-N 0 0 395.459 3.243 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(CN2CCOC2=O)cc1 ZINC000156603122 1423834758 /nfs/dbraw/zinc/83/47/58/1423834758.db2.gz RBYLDPBLEHZZHW-UHFFFAOYSA-N 0 0 394.387 3.210 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000179985975 1429675816 /nfs/dbraw/zinc/67/58/16/1429675816.db2.gz HFGMVCATXOZWKV-UHFFFAOYSA-N 0 0 394.387 3.056 20 5 GGBDRN COc1cccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1OC(F)F ZINC000156629886 1423838218 /nfs/dbraw/zinc/83/82/18/1423838218.db2.gz IRCJDRQWOCJSDL-UHFFFAOYSA-N 0 0 378.331 3.403 20 5 GGBDRN O=C(c1ncccc1OCC(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156633159 1423838727 /nfs/dbraw/zinc/83/87/27/1423838727.db2.gz UOJXPLPVISTPBT-UHFFFAOYSA-N 0 0 381.310 3.129 20 5 GGBDRN COc1ccc(Cn2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)cn2)cc1 ZINC000156634189 1423838786 /nfs/dbraw/zinc/83/87/86/1423838786.db2.gz WJMCYENCDCHIPK-UHFFFAOYSA-N 0 0 392.415 3.047 20 5 GGBDRN COC(=O)c1ccc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000156638533 1423839472 /nfs/dbraw/zinc/83/94/72/1423839472.db2.gz COPVBRFAMFWRCF-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000156645003 1423840274 /nfs/dbraw/zinc/84/02/74/1423840274.db2.gz YUCUMUFDYUJPGF-UHFFFAOYSA-N 0 0 396.153 3.283 20 5 GGBDRN O=C(CCNC(=O)c1ccsc1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000156648137 1423840721 /nfs/dbraw/zinc/84/07/21/1423840721.db2.gz ADPGTAZNRROHFV-UHFFFAOYSA-N 0 0 398.238 3.177 20 5 GGBDRN Cc1nnc(Sc2ccc(NC(=O)Cn3ccc([N+](=O)[O-])n3)c(C)c2)s1 ZINC000156659261 1423842924 /nfs/dbraw/zinc/84/29/24/1423842924.db2.gz OEMWFEANAXWLQN-UHFFFAOYSA-N 0 0 390.450 3.050 20 5 GGBDRN O=C(c1cc(NCCCOCC2CCOCC2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000156696639 1423850237 /nfs/dbraw/zinc/85/02/37/1423850237.db2.gz UUQYCBZDNIHNPQ-UHFFFAOYSA-N 0 0 391.468 3.076 20 5 GGBDRN CCc1ccccc1CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-] ZINC000156718918 1423853101 /nfs/dbraw/zinc/85/31/01/1423853101.db2.gz WAQSTOPGTMKEMS-CYBMUJFWSA-N 0 0 385.420 3.061 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)OCc2cccc([N+](=O)[O-])c2)cc1 ZINC000156735144 1423856551 /nfs/dbraw/zinc/85/65/51/1423856551.db2.gz YRNNGWRZWSQEAY-UHFFFAOYSA-N 0 0 377.418 3.064 20 5 GGBDRN O=C(Nc1cc(C2CC2)nn1-c1ncccn1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000156767346 1423861709 /nfs/dbraw/zinc/86/17/09/1423861709.db2.gz KCYHTDVOMTZSPZ-UHFFFAOYSA-N 0 0 384.783 3.354 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccn1 ZINC000156784171 1423864441 /nfs/dbraw/zinc/86/44/41/1423864441.db2.gz PTOKSVSFNQHSSC-UHFFFAOYSA-N 0 0 384.436 3.307 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc(C(C)(C)C(N)=O)cc2)c1 ZINC000156788359 1423864991 /nfs/dbraw/zinc/86/49/91/1423864991.db2.gz ZFUPQPVGJLJWEL-UHFFFAOYSA-N 0 0 385.420 3.074 20 5 GGBDRN Cc1cc(F)ccc1C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000156792548 1423865570 /nfs/dbraw/zinc/86/55/70/1423865570.db2.gz PIVLDSIASAAKEO-UHFFFAOYSA-N 0 0 380.759 3.283 20 5 GGBDRN O=C(N[C@@H]1CCC[C@H](C2CC2)C1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000156802231 1423867016 /nfs/dbraw/zinc/86/70/16/1423867016.db2.gz LGSQASWEHPLWRC-RRFJBIMHSA-N 0 0 391.493 3.346 20 5 GGBDRN O=C(N[C@@H]1CCC[C@H](C2CC2)C1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000156802375 1423867165 /nfs/dbraw/zinc/86/71/65/1423867165.db2.gz LGSQASWEHPLWRC-ZNMIVQPWSA-N 0 0 391.493 3.346 20 5 GGBDRN CCn1c(SCCNC(=O)C2CCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000156837629 1423873093 /nfs/dbraw/zinc/87/30/93/1423873093.db2.gz LJLMAPNSDAPJOU-UHFFFAOYSA-N 0 0 389.481 3.272 20 5 GGBDRN C[C@H]([NH2+]C[C@H](O)c1cc(Cl)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000156843463 1423873634 /nfs/dbraw/zinc/87/36/34/1423873634.db2.gz JPWRYKHVRCVPIT-ZBEGNZNMSA-N 0 0 378.812 3.404 20 5 GGBDRN O=C(Nc1ccc(-c2ncco2)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000156846211 1423874652 /nfs/dbraw/zinc/87/46/52/1423874652.db2.gz HXTDWZHCBCILHJ-UHFFFAOYSA-N 0 0 376.332 3.083 20 5 GGBDRN Cc1ccc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1-n1cnnn1 ZINC000156851849 1423875255 /nfs/dbraw/zinc/87/52/55/1423875255.db2.gz RPIWHAHWAVFGAM-UHFFFAOYSA-N 0 0 393.407 3.075 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(N[C@H](CCCO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000156872575 1423878612 /nfs/dbraw/zinc/87/86/12/1423878612.db2.gz AQBKJPFIPQKPLH-QGZVFWFLSA-N 0 0 394.431 3.485 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(N[C@@H](CCCO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000156872420 1423878633 /nfs/dbraw/zinc/87/86/33/1423878633.db2.gz AQBKJPFIPQKPLH-KRWDZBQOSA-N 0 0 394.431 3.485 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCN(c2cccs2)CC1 ZINC000156877535 1423879226 /nfs/dbraw/zinc/87/92/26/1423879226.db2.gz DYPGUGDSPDFIIR-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN C[C@@]1(c2ccccc2)CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000156876020 1423879252 /nfs/dbraw/zinc/87/92/52/1423879252.db2.gz WHWHDHUUFGVOKK-NRFANRHFSA-N 0 0 392.415 3.168 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000156879988 1423879654 /nfs/dbraw/zinc/87/96/54/1423879654.db2.gz LMOSNEPEZSSRKG-SFHVURJKSA-N 0 0 392.839 3.428 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCN(c2cccs2)CC1 ZINC000156885532 1423880411 /nfs/dbraw/zinc/88/04/11/1423880411.db2.gz JPVYOXBZMKGIDQ-GFCCVEGCSA-N 0 0 395.868 3.426 20 5 GGBDRN Cc1nn(C)c2nc(C)cc(C(=O)NCCCNc3ccc(C)cc3[N+](=O)[O-])c12 ZINC000156888862 1423880848 /nfs/dbraw/zinc/88/08/48/1423880848.db2.gz ZMKJCCYXBOENSS-UHFFFAOYSA-N 0 0 396.451 3.034 20 5 GGBDRN CCCC(=O)N1CCCC[C@H]1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000156896449 1423882009 /nfs/dbraw/zinc/88/20/09/1423882009.db2.gz ZCBHOFUHBPDMRT-KRWDZBQOSA-N 0 0 390.484 3.003 20 5 GGBDRN CCN(C)C(=O)c1cccc(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000156893225 1423882029 /nfs/dbraw/zinc/88/20/29/1423882029.db2.gz AAPOKKJSEWRZGF-UHFFFAOYSA-N 0 0 398.463 3.227 20 5 GGBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000156897828 1423882519 /nfs/dbraw/zinc/88/25/19/1423882519.db2.gz KTWQTZXQGHEDSY-INIZCTEOSA-N 0 0 380.408 3.098 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)OCCc3cnccn3)cc2[N+](=O)[O-])C1 ZINC000179991994 1429679650 /nfs/dbraw/zinc/67/96/50/1429679650.db2.gz GUCWGBPZUZUFKT-GASCZTMLSA-N 0 0 384.436 3.267 20 5 GGBDRN COc1ccc(CC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1OC ZINC000156909702 1423884144 /nfs/dbraw/zinc/88/41/44/1423884144.db2.gz ZTKBKTSMQBJJEU-UHFFFAOYSA-N 0 0 387.436 3.081 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2cc(=O)[nH]c3cc(F)ccc32)c([N+](=O)[O-])c1 ZINC000156910767 1423884153 /nfs/dbraw/zinc/88/41/53/1423884153.db2.gz ZIKZBHJPEWDPNB-UHFFFAOYSA-N 0 0 398.394 3.116 20 5 GGBDRN CCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1CO ZINC000156913405 1423884821 /nfs/dbraw/zinc/88/48/21/1423884821.db2.gz XAMZFKWZBPFUJI-UHFFFAOYSA-N 0 0 385.420 3.338 20 5 GGBDRN Cc1ccc(CN2CCOCC2)cc1NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000156914963 1423885384 /nfs/dbraw/zinc/88/53/84/1423885384.db2.gz PXCBLDDQSKKGCR-UHFFFAOYSA-N 0 0 387.411 3.435 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1C ZINC000156920911 1423885992 /nfs/dbraw/zinc/88/59/92/1423885992.db2.gz YPNYCCVMIPQOJF-UHFFFAOYSA-N 0 0 393.396 3.036 20 5 GGBDRN Cc1nn(C)c2sc(C(=O)NCCCNc3ccc(C)cc3[N+](=O)[O-])cc12 ZINC000156935088 1423889023 /nfs/dbraw/zinc/88/90/23/1423889023.db2.gz KSOWRCWISGZAEB-UHFFFAOYSA-N 0 0 387.465 3.392 20 5 GGBDRN Cc1ccc(CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c(O[C@@H]2CCOC2)c1 ZINC000156932773 1423889118 /nfs/dbraw/zinc/88/91/18/1423889118.db2.gz JLAMVFKUUNCICN-NTPDMAOXSA-N 0 0 382.416 3.401 20 5 GGBDRN CC(=O)Nc1cc(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])ccc1C ZINC000156944025 1423890855 /nfs/dbraw/zinc/89/08/55/1423890855.db2.gz NNZGTDNMABWNCL-UHFFFAOYSA-N 0 0 384.436 3.402 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000156986405 1423897846 /nfs/dbraw/zinc/89/78/46/1423897846.db2.gz GEHQSWFGVQALGW-CABCVRRESA-N 0 0 397.460 3.267 20 5 GGBDRN C[C@]1(c2ccccc2)CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000156991891 1423898245 /nfs/dbraw/zinc/89/82/45/1423898245.db2.gz MXEFPKNBBWVMED-OAQYLSRUSA-N 0 0 392.415 3.168 20 5 GGBDRN CC(C)Oc1cccc(CN(C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000157008106 1423901715 /nfs/dbraw/zinc/90/17/15/1423901715.db2.gz KEOKPCGWDBWJHZ-UHFFFAOYSA-N 0 0 382.413 3.342 20 5 GGBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN(C2CC2)[C@@H]2CCS(=O)(=O)C2)s1 ZINC000157040431 1423908836 /nfs/dbraw/zinc/90/88/36/1423908836.db2.gz ZFMLEAJXYCRJFG-CQSZACIVSA-N 0 0 392.502 3.475 20 5 GGBDRN O=C(Nc1nc2ccc(Cl)cn2n1)c1cc([N+](=O)[O-])ccc1Br ZINC000157056561 1423913237 /nfs/dbraw/zinc/91/32/37/1423913237.db2.gz JSZXZNGXVLZJKS-UHFFFAOYSA-N 0 0 396.588 3.306 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@@H]2CCCCC2(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000157059737 1423914072 /nfs/dbraw/zinc/91/40/72/1423914072.db2.gz GRKKHZWNZWSGDZ-QGZVFWFLSA-N 0 0 384.436 3.148 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCCc3c2cnn3C)cc1SC ZINC000157065696 1423915066 /nfs/dbraw/zinc/91/50/66/1423915066.db2.gz RJQSBJSNUMYGTG-CYBMUJFWSA-N 0 0 390.465 3.208 20 5 GGBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000157073917 1423917747 /nfs/dbraw/zinc/91/77/47/1423917747.db2.gz HQMKHCQWGQGFOP-QGZVFWFLSA-N 0 0 380.408 3.098 20 5 GGBDRN Cc1c(C(=O)N(C)[C@H]2CCCc3c2cnn3C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000157074010 1423917800 /nfs/dbraw/zinc/91/78/00/1423917800.db2.gz AITNRIWSXDZCOV-AWEZNQCLSA-N 0 0 387.396 3.003 20 5 GGBDRN CCCCNC(=O)[C@@H](C)Sc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000157082242 1423920922 /nfs/dbraw/zinc/92/09/22/1423920922.db2.gz FRSJMVQOYKTILY-GFCCVEGCSA-N 0 0 377.470 3.270 20 5 GGBDRN CCn1c(SCC(=O)N2CCC[C@H](C)C2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157111644 1423928255 /nfs/dbraw/zinc/92/82/55/1423928255.db2.gz GPMYLHALLDJNOX-ZDUSSCGKSA-N 0 0 389.481 3.224 20 5 GGBDRN Cc1ccccc1NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000157115937 1423929551 /nfs/dbraw/zinc/92/95/51/1423929551.db2.gz KBZBYUBKKKBQRB-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN Nc1c(C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)cccc1[N+](=O)[O-] ZINC000157120545 1423930206 /nfs/dbraw/zinc/93/02/06/1423930206.db2.gz FDCFIJVABZIRMQ-UHFFFAOYSA-N 0 0 392.297 3.029 20 5 GGBDRN Cn1cnnc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000157148175 1423937183 /nfs/dbraw/zinc/93/71/83/1423937183.db2.gz IJUMTSUUPJNNAD-UHFFFAOYSA-N 0 0 386.799 3.241 20 5 GGBDRN CCn1c(SCc2ccc(C(N)=O)cc2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157151211 1423938359 /nfs/dbraw/zinc/93/83/59/1423938359.db2.gz YZTVUKAHUYXQBD-UHFFFAOYSA-N 0 0 383.433 3.264 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000157159783 1423941409 /nfs/dbraw/zinc/94/14/09/1423941409.db2.gz ZLTFDQXVNAAVEJ-UHFFFAOYSA-N 0 0 395.419 3.108 20 5 GGBDRN CC1(C)CCCC[C@H]1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000157188182 1423950123 /nfs/dbraw/zinc/95/01/23/1423950123.db2.gz XRULOMRMRZJYHF-MRXNPFEDSA-N 0 0 375.425 3.368 20 5 GGBDRN Cn1cnnc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000157208172 1423955554 /nfs/dbraw/zinc/95/55/54/1423955554.db2.gz DDNMEUGNCJEXTG-UHFFFAOYSA-N 0 0 386.799 3.241 20 5 GGBDRN O=[N+]([O-])c1cc(CSCc2ncn(-c3ccccc3)n2)c2c(c1)COCO2 ZINC000180004338 1429685993 /nfs/dbraw/zinc/68/59/93/1429685993.db2.gz UUHHYAYHTSMEQT-UHFFFAOYSA-N 0 0 384.417 3.475 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000157218186 1423958876 /nfs/dbraw/zinc/95/88/76/1423958876.db2.gz ZJJVITHXOGQGES-IAQYHMDHSA-N 0 0 391.786 3.307 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000157231787 1423961814 /nfs/dbraw/zinc/96/18/14/1423961814.db2.gz AGJHQXBYJJRDOC-GOSISDBHSA-N 0 0 380.408 3.184 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1ccc(F)cc1OC(F)F ZINC000157257845 1423968667 /nfs/dbraw/zinc/96/86/67/1423968667.db2.gz ZSVOPSXHWOHYDG-UHFFFAOYSA-N 0 0 390.339 3.320 20 5 GGBDRN Cc1ccc2c(c1)N(S(=O)(=O)CCc1ccccc1[N+](=O)[O-])C[C@H](C)O2 ZINC000157291455 1423975715 /nfs/dbraw/zinc/97/57/15/1423975715.db2.gz RBVDRXTVGNKFCK-AWEZNQCLSA-N 0 0 376.434 3.063 20 5 GGBDRN O=C(Nc1nc2ccc(Cl)cn2n1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000157289633 1423975745 /nfs/dbraw/zinc/97/57/45/1423975745.db2.gz QZCXXYCMVVRPCR-UHFFFAOYSA-N 0 0 396.588 3.306 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000180009001 1429687857 /nfs/dbraw/zinc/68/78/57/1429687857.db2.gz GZSUHRYQLGONBU-SFHVURJKSA-N 0 0 395.459 3.299 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1 ZINC000180008401 1429687900 /nfs/dbraw/zinc/68/79/00/1429687900.db2.gz OBTZPYKEIHMCBD-HNNXBMFYSA-N 0 0 399.472 3.095 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000180009013 1429688003 /nfs/dbraw/zinc/68/80/03/1429688003.db2.gz GZSUHRYQLGONBU-GOSISDBHSA-N 0 0 395.459 3.299 20 5 GGBDRN NC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)c([N+](=O)[O-])c1 ZINC000157334250 1423987335 /nfs/dbraw/zinc/98/73/35/1423987335.db2.gz MDSLHOUKTOUTCG-UHFFFAOYSA-N 0 0 389.839 3.391 20 5 GGBDRN Cc1ccnc([C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000157340947 1423989740 /nfs/dbraw/zinc/98/97/40/1423989740.db2.gz STLHJJQLXNNETR-SFHVURJKSA-N 0 0 381.436 3.175 20 5 GGBDRN CCCC1(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CCC1 ZINC000157358406 1423994279 /nfs/dbraw/zinc/99/42/79/1423994279.db2.gz CZQUZGCLOXBBOT-ZDUSSCGKSA-N 0 0 379.482 3.348 20 5 GGBDRN CCCC1(CNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CCC1 ZINC000157389078 1424000430 /nfs/dbraw/zinc/00/04/30/1424000430.db2.gz PPWFQWYCOMUHDN-UHFFFAOYSA-N 0 0 375.425 3.370 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccn1 ZINC000157386125 1424000542 /nfs/dbraw/zinc/00/05/42/1424000542.db2.gz DFOCPXUYPHDUMG-UHFFFAOYSA-N 0 0 384.436 3.307 20 5 GGBDRN O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000180010637 1429689771 /nfs/dbraw/zinc/68/97/71/1429689771.db2.gz CTTFKQRQMVWCRE-AWEZNQCLSA-N 0 0 387.823 3.027 20 5 GGBDRN COCCCOc1cccc(CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000157454826 1424014377 /nfs/dbraw/zinc/01/43/77/1424014377.db2.gz ZYCPCQADGNXSGF-UHFFFAOYSA-N 0 0 380.347 3.218 20 5 GGBDRN CCc1ccc(-c2nc(C[S@@](=O)CCn3cc([N+](=O)[O-])cn3)cs2)cc1 ZINC000157461452 1424015828 /nfs/dbraw/zinc/01/58/28/1424015828.db2.gz NPEWSOXCLZWRFS-AREMUKBSSA-N 0 0 390.490 3.426 20 5 GGBDRN CCOC(=O)c1ccc2c(c1)CCCN2C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000157477676 1424019895 /nfs/dbraw/zinc/01/98/95/1424019895.db2.gz VDEZSZWVZSLPOG-UHFFFAOYSA-N 0 0 386.379 3.433 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2C=CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000157498766 1424023751 /nfs/dbraw/zinc/02/37/51/1424023751.db2.gz XBVMKGULOBNVAM-GFCCVEGCSA-N 0 0 389.433 3.477 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000157505943 1424025985 /nfs/dbraw/zinc/02/59/85/1424025985.db2.gz QWDPKQZXVVRVEN-SFHVURJKSA-N 0 0 392.839 3.428 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000157530432 1424031093 /nfs/dbraw/zinc/03/10/93/1424031093.db2.gz SAGQZASKUCLXPN-HNNXBMFYSA-N 0 0 388.811 3.484 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000157539605 1424033081 /nfs/dbraw/zinc/03/30/81/1424033081.db2.gz MFLGCZFFCLJXAA-INIZCTEOSA-N 0 0 399.447 3.333 20 5 GGBDRN O=[N+]([O-])c1cnn(CC[S@](=O)Cc2csc(-c3ccccc3F)n2)c1 ZINC000157547496 1424035084 /nfs/dbraw/zinc/03/50/84/1424035084.db2.gz DJYGUUQZSZHIPM-RUZDIDTESA-N 0 0 380.426 3.003 20 5 GGBDRN CCC(CC)(CO)CNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000157596684 1424044998 /nfs/dbraw/zinc/04/49/98/1424044998.db2.gz FKQFBKUNTIDNMB-UHFFFAOYSA-N 0 0 380.832 3.005 20 5 GGBDRN CCN1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)sc2C1 ZINC000180016321 1429693904 /nfs/dbraw/zinc/69/39/04/1429693904.db2.gz GZIFHHVWFAMNGP-UHFFFAOYSA-N 0 0 398.391 3.283 20 5 GGBDRN C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[S@@](=O)CCn1cc([N+](=O)[O-])cn1 ZINC000157627284 1424051951 /nfs/dbraw/zinc/05/19/51/1424051951.db2.gz DSPQFULBYHESIE-AFNXNYLOSA-N 0 0 395.828 3.005 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1nnc(C[C@H]2CCS(=O)(=O)C2)o1 ZINC000180016949 1429694266 /nfs/dbraw/zinc/69/42/66/1429694266.db2.gz QHMJGTIMRBJVLY-NWDGAFQWSA-N 0 0 397.478 3.117 20 5 GGBDRN O=C(CN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000157641526 1424055141 /nfs/dbraw/zinc/05/51/41/1424055141.db2.gz GGWPNXZITXJPIV-OAHLLOKOSA-N 0 0 385.395 3.267 20 5 GGBDRN O=C(CN1CCC[C@H](C(=O)c2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000157641364 1424055364 /nfs/dbraw/zinc/05/53/64/1424055364.db2.gz GGWPNXZITXJPIV-HNNXBMFYSA-N 0 0 385.395 3.267 20 5 GGBDRN CCc1c(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cnn1CC(C)C ZINC000157707652 1424070140 /nfs/dbraw/zinc/07/01/40/1424070140.db2.gz HWBIVLJMERLFLV-UHFFFAOYSA-N 0 0 376.413 3.279 20 5 GGBDRN CCc1c(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cnn1CC(C)C ZINC000157720585 1424073642 /nfs/dbraw/zinc/07/36/42/1424073642.db2.gz OJEGBURLAUAFBM-UHFFFAOYSA-N 0 0 382.424 3.448 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O ZINC000180020621 1429697335 /nfs/dbraw/zinc/69/73/35/1429697335.db2.gz LNUBYNWIYFKCAZ-SFHVURJKSA-N 0 0 395.459 3.441 20 5 GGBDRN O=C(NCCOC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000157785727 1424088173 /nfs/dbraw/zinc/08/81/73/1424088173.db2.gz GEAHAZUHRDDWEY-UHFFFAOYSA-N 0 0 382.294 3.200 20 5 GGBDRN Cc1cc(OC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)ccc1F ZINC000157798478 1424090535 /nfs/dbraw/zinc/09/05/35/1424090535.db2.gz VJVQBOTZQLUBOO-LLVKDONJSA-N 0 0 376.315 3.140 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1nnnn1-c1ccccc1 ZINC000157829445 1424098041 /nfs/dbraw/zinc/09/80/41/1424098041.db2.gz BWTHAVLIIMEBCL-GFCCVEGCSA-N 0 0 398.448 3.174 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000157833027 1424098509 /nfs/dbraw/zinc/09/85/09/1424098509.db2.gz BDXLRWKRCHNBAY-UHFFFAOYSA-N 0 0 385.424 3.485 20 5 GGBDRN CCC[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1nnc2ccccn21 ZINC000157840215 1424100328 /nfs/dbraw/zinc/10/03/28/1424100328.db2.gz LYMIUDCWSNXGTD-CYBMUJFWSA-N 0 0 384.396 3.309 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(N3CCO[C@@]4(CCc5ccccc54)C3)n2)cc1 ZINC000157873751 1424108876 /nfs/dbraw/zinc/10/88/76/1424108876.db2.gz 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O=C(Cc1cccc(OCc2cccnc2)c1)NCc1cccc([N+](=O)[O-])c1 ZINC000180027311 1429701523 /nfs/dbraw/zinc/70/15/23/1429701523.db2.gz BEFJBIXZSQTPIK-UHFFFAOYSA-N 0 0 377.400 3.428 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cccc(C(=O)Nc3ccncc3)c2)c1[N+](=O)[O-] ZINC000158046289 1424147339 /nfs/dbraw/zinc/14/73/39/1424147339.db2.gz LEGGKAWTFUIDSW-UHFFFAOYSA-N 0 0 394.391 3.170 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cccc(C(=O)Nc3ccccn3)c2)c1[N+](=O)[O-] ZINC000158046126 1424147458 /nfs/dbraw/zinc/14/74/58/1424147458.db2.gz ZGCWMTLEPLXMLY-UHFFFAOYSA-N 0 0 394.391 3.170 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[C@@H](O)c2cccs2)cc1C ZINC000158055245 1424150678 /nfs/dbraw/zinc/15/06/78/1424150678.db2.gz LABYKXIBBKWYFY-TZMCWYRMSA-N 0 0 384.479 3.064 20 5 GGBDRN CN(C(=O)[C@H]1CCCN1c1ncnc2sccc21)c1cccc([N+](=O)[O-])c1 ZINC000158062441 1424154008 /nfs/dbraw/zinc/15/40/08/1424154008.db2.gz NPFPLLMOOAIZMR-OAHLLOKOSA-N 0 0 383.433 3.231 20 5 GGBDRN COc1cc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)ccc1OCc1cnn(C)c1 ZINC000158064479 1424154134 /nfs/dbraw/zinc/15/41/34/1424154134.db2.gz HUJCEFZJKIHUTK-UHFFFAOYSA-N 0 0 396.403 3.193 20 5 GGBDRN CN(C(=O)[C@@H]1CCCN1c1ncnc2sccc21)c1cccc([N+](=O)[O-])c1 ZINC000158062303 1424154339 /nfs/dbraw/zinc/15/43/39/1424154339.db2.gz NPFPLLMOOAIZMR-HNNXBMFYSA-N 0 0 383.433 3.231 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(-c2nnn[n-]2)ccc1F ZINC000826500435 1424167377 /nfs/dbraw/zinc/16/73/77/1424167377.db2.gz YHVPNKQQHUWGNB-UGSOOPFHSA-N 0 0 396.426 3.415 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)o1 ZINC000158136967 1424176243 /nfs/dbraw/zinc/17/62/43/1424176243.db2.gz RMYQITMUYIXDIR-SFHVURJKSA-N 0 0 396.403 3.150 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000158157430 1424181562 /nfs/dbraw/zinc/18/15/62/1424181562.db2.gz WTHMZLSIRNLWCR-MRXNPFEDSA-N 0 0 375.450 3.168 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC000158159600 1424182200 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380.397 3.008 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H](C)C[C@H](O)c1cccs1 ZINC000158254664 1424209313 /nfs/dbraw/zinc/20/93/13/1424209313.db2.gz OXPBBZRPGRRKNL-JSGCOSHPSA-N 0 0 384.479 3.064 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000158257071 1424210607 /nfs/dbraw/zinc/21/06/07/1424210607.db2.gz PEVYBEXNWAHEGC-IBGZPJMESA-N 0 0 395.415 3.394 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000180035851 1429706512 /nfs/dbraw/zinc/70/65/12/1429706512.db2.gz AMQQCMLALLUOKF-HNNXBMFYSA-N 0 0 392.477 3.039 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000158271081 1424214642 /nfs/dbraw/zinc/21/46/42/1424214642.db2.gz HNXZVEKRQOYQFV-UHFFFAOYSA-N 0 0 388.561 3.129 20 5 GGBDRN CS[C@H]1CCCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C1 ZINC000158276770 1424215066 /nfs/dbraw/zinc/21/50/66/1424215066.db2.gz CVCPNZNRWRWSDI-NSHDSACASA-N 0 0 378.903 3.463 20 5 GGBDRN 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ZINC000180066550 1429722629 /nfs/dbraw/zinc/72/26/29/1429722629.db2.gz QOTWUDJCWFASNR-JTQLQIEISA-N 0 0 387.458 3.497 20 5 GGBDRN O=C(O[C@@H]([C@H]1CCCO1)C(F)(F)F)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000159010624 1424394832 /nfs/dbraw/zinc/39/48/32/1424394832.db2.gz AADAPARRAPPACU-KGLIPLIRSA-N 0 0 385.298 3.047 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)Oc1cccc(-n2ccnc2)c1 ZINC000159014392 1424395436 /nfs/dbraw/zinc/39/54/36/1424395436.db2.gz YXRQOXPHEZOKIU-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN Cn1c(=O)oc2cc(NC(=O)NCCCCc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000159031873 1424399926 /nfs/dbraw/zinc/39/99/26/1424399926.db2.gz XYKHBLZHOSIJKZ-UHFFFAOYSA-N 0 0 384.392 3.184 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cnn(C)c1 ZINC000159057292 1424406892 /nfs/dbraw/zinc/40/68/92/1424406892.db2.gz IEHLRWMNTZILTM-VIFPVBQESA-N 0 0 388.371 3.317 20 5 GGBDRN O=C(NCC1([C@H](O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000159062578 1424408064 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ZINC000159343770 1424490765 /nfs/dbraw/zinc/49/07/65/1424490765.db2.gz KOHYCMKMWWDYJV-CZUORRHYSA-N 0 0 376.840 3.462 20 5 GGBDRN CC[C@](C)(NS(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000180084586 1429730079 /nfs/dbraw/zinc/73/00/79/1429730079.db2.gz ARXVFJZILXRFIK-HNNXBMFYSA-N 0 0 387.458 3.411 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000159358682 1424495296 /nfs/dbraw/zinc/49/52/96/1424495296.db2.gz AYQKSTFIKXMJJQ-AUUYWEPGSA-N 0 0 380.404 3.023 20 5 GGBDRN O=C(NC1CC1)c1ccc(NCc2ccc(OCC3CC3)nc2)c([N+](=O)[O-])c1 ZINC000159359246 1424496193 /nfs/dbraw/zinc/49/61/93/1424496193.db2.gz SGYADIHUPKKDFO-UHFFFAOYSA-N 0 0 382.420 3.283 20 5 GGBDRN Cc1ccc(Nc2nnc(SCCn3cc([N+](=O)[O-])ccc3=O)s2)cc1 ZINC000159369920 1424497108 /nfs/dbraw/zinc/49/71/08/1424497108.db2.gz QJYLEWZUWPBBBT-UHFFFAOYSA-N 0 0 389.462 3.452 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000159402946 1424499876 /nfs/dbraw/zinc/49/98/76/1424499876.db2.gz SDIJRJRCLDRGGR-HNNXBMFYSA-N 0 0 394.431 3.492 20 5 GGBDRN COc1ccc(-c2nc(COC(=O)Cc3cccc([N+](=O)[O-])c3C)no2)cc1 ZINC000159414031 1424500521 /nfs/dbraw/zinc/50/05/21/1424500521.db2.gz UDAWIUQRHRGSNN-UHFFFAOYSA-N 0 0 383.360 3.248 20 5 GGBDRN CCn1c(=O)c2cc(F)ccc2nc1SCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000159436028 1424502996 /nfs/dbraw/zinc/50/29/96/1424502996.db2.gz NROVRWJMDOURSS-UHFFFAOYSA-N 0 0 387.392 3.439 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1 ZINC000159450794 1424503718 /nfs/dbraw/zinc/50/37/18/1424503718.db2.gz UMCUYCVGQDQSDZ-HNNXBMFYSA-N 0 0 375.469 3.417 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000159483888 1424506069 /nfs/dbraw/zinc/50/60/69/1424506069.db2.gz LRIPXNBOISJDLZ-HOTGVXAUSA-N 0 0 377.397 3.231 20 5 GGBDRN Cc1nc(COC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(C)s1 ZINC000159494705 1424507395 /nfs/dbraw/zinc/50/73/95/1424507395.db2.gz BWSPJXJRYMNKBV-UHFFFAOYSA-N 0 0 391.405 3.100 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c[nH]c1=O ZINC000159498189 1424507970 /nfs/dbraw/zinc/50/79/70/1424507970.db2.gz VEJZUTTUYUPOEY-STQMWFEESA-N 0 0 384.436 3.326 20 5 GGBDRN O=[N+]([O-])c1ccc(CSc2nnnn2C[C@@H]2CCCO2)c(C(F)(F)F)c1 ZINC000159496632 1424508135 /nfs/dbraw/zinc/50/81/35/1424508135.db2.gz NMDDJTVKCROHRO-NSHDSACASA-N 0 0 389.359 3.071 20 5 GGBDRN CO[C@]1(C)C[C@@H](OC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000159507342 1424508990 /nfs/dbraw/zinc/50/89/90/1424508990.db2.gz VAAKATIFOCMVSG-DNVCBOLYSA-N 0 0 392.408 3.030 20 5 GGBDRN C[C@H](O)CN(C)[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000159511647 1424509028 /nfs/dbraw/zinc/50/90/28/1424509028.db2.gz SJVHSIUMYZEJRY-SJCJKPOMSA-N 0 0 377.828 3.241 20 5 GGBDRN CO[C@@]1(C)C[C@H](OC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000159507751 1424509305 /nfs/dbraw/zinc/50/93/05/1424509305.db2.gz VAAKATIFOCMVSG-KXBFYZLASA-N 0 0 392.408 3.030 20 5 GGBDRN O=Cc1ccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)c(F)c1 ZINC000159511583 1424509373 /nfs/dbraw/zinc/50/93/73/1424509373.db2.gz MSYKULJBEGNGEX-UHFFFAOYSA-N 0 0 393.270 3.333 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@]4(CCc5ccccc54)C3)n2)cc1 ZINC000159558568 1424513702 /nfs/dbraw/zinc/51/37/02/1424513702.db2.gz GEARPLBFAWNEJZ-OAQYLSRUSA-N 0 0 392.415 3.319 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCO[C@]4(CCc5ccccc54)C3)n2)c1 ZINC000159575437 1424514996 /nfs/dbraw/zinc/51/49/96/1424514996.db2.gz WMFRQUVFFLTTDE-OAQYLSRUSA-N 0 0 392.415 3.319 20 5 GGBDRN O=C(NCCc1cc2ccccc2[nH]1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000159584144 1424515885 /nfs/dbraw/zinc/51/58/85/1424515885.db2.gz HZLUEPPEOHXNBO-UHFFFAOYSA-N 0 0 375.388 3.234 20 5 GGBDRN O=C(Nc1ccnn1C[C@@H]1CCOC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000159586337 1424516506 /nfs/dbraw/zinc/51/65/06/1424516506.db2.gz LXDARMXIPWMZIL-HNNXBMFYSA-N 0 0 385.424 3.024 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 ZINC000159614121 1424518356 /nfs/dbraw/zinc/51/83/56/1424518356.db2.gz LYIRNNDUCRBDQD-LLVKDONJSA-N 0 0 399.394 3.250 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)c2nc(-c3ccncc3)cs2)c1[N+](=O)[O-] ZINC000159612594 1424518571 /nfs/dbraw/zinc/51/85/71/1424518571.db2.gz IZIHHFCDVVRUES-JTQLQIEISA-N 0 0 386.437 3.280 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)c1 ZINC000159618639 1424518604 /nfs/dbraw/zinc/51/86/04/1424518604.db2.gz NHBZFFXKMHLYMV-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN CS[C@H](CO)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000159647218 1424520701 /nfs/dbraw/zinc/52/07/01/1424520701.db2.gz PGQTUZFUIQNCKJ-FZKQIMNGSA-N 0 0 389.477 3.049 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@]2(CCc3ccccc32)C1 ZINC000159661938 1424522322 /nfs/dbraw/zinc/52/23/22/1424522322.db2.gz UNJABSODDGAGFE-YCRPNKLZSA-N 0 0 381.432 3.096 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCO[C@]4(CCc5ccccc54)C3)o2)cc1 ZINC000159673767 1424522697 /nfs/dbraw/zinc/52/26/97/1424522697.db2.gz RREMOJGPMZRUEM-OAQYLSRUSA-N 0 0 392.415 3.319 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1noc(C2CCCCC2)n1 ZINC000159682479 1424524027 /nfs/dbraw/zinc/52/40/27/1424524027.db2.gz VKXURCOFLAPMEZ-UHFFFAOYSA-N 0 0 381.392 3.298 20 5 GGBDRN O=C(Nc1ccnn1C[C@@H]1CCOC1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000159695187 1424525244 /nfs/dbraw/zinc/52/52/44/1424525244.db2.gz JPORGOGRYAVUCE-HNNXBMFYSA-N 0 0 385.424 3.024 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)[C@H](c2ccccc2)CO1 ZINC000159726128 1424527428 /nfs/dbraw/zinc/52/74/28/1424527428.db2.gz SKYVHMJKBDWUDW-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN O=C(Nc1cccn(CC(F)(F)F)c1=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000159746641 1424530636 /nfs/dbraw/zinc/53/06/36/1424530636.db2.gz VJYWFJXHAJRSID-UHFFFAOYSA-N 0 0 375.690 3.225 20 5 GGBDRN Cc1c(CC(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)cccc1[N+](=O)[O-] ZINC000159772750 1424533756 /nfs/dbraw/zinc/53/37/56/1424533756.db2.gz HTTHZWVHXNVIGG-HNNXBMFYSA-N 0 0 379.420 3.246 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000159770598 1424534006 /nfs/dbraw/zinc/53/40/06/1424534006.db2.gz ZYXDNTYYAPLCLS-AWEZNQCLSA-N 0 0 396.422 3.400 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159784386 1424534722 /nfs/dbraw/zinc/53/47/22/1424534722.db2.gz KMEWFOJODRMVNO-RDJZCZTQSA-N 0 0 390.461 3.349 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000159823075 1424539755 /nfs/dbraw/zinc/53/97/55/1424539755.db2.gz PYWLQAOXWCUHAZ-CXAGYDPISA-N 0 0 397.431 3.132 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)c(F)c1 ZINC000159827619 1424540701 /nfs/dbraw/zinc/54/07/01/1424540701.db2.gz FETTURJMFQZJIJ-CXAGYDPISA-N 0 0 394.424 3.180 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000159832032 1424541079 /nfs/dbraw/zinc/54/10/79/1424541079.db2.gz WKTNAKPMVZGMKX-LPHOPBHVSA-N 0 0 390.461 3.182 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159842758 1424542018 /nfs/dbraw/zinc/54/20/18/1424542018.db2.gz JVIKBEUQPSLKIC-ZBFHGGJFSA-N 0 0 376.434 3.041 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159851326 1424543056 /nfs/dbraw/zinc/54/30/56/1424543056.db2.gz DDWQQRCLTLOTCQ-QAPCUYQASA-N 0 0 390.461 3.349 20 5 GGBDRN CC[C@H](C)NC(=O)c1cccc(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000159865010 1424544622 /nfs/dbraw/zinc/54/46/22/1424544622.db2.gz MKJKKVLCKAZAIJ-HNNXBMFYSA-N 0 0 398.463 3.165 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cccn(CC(F)(F)F)c1=O ZINC000159882553 1424548318 /nfs/dbraw/zinc/54/83/18/1424548318.db2.gz VYIHALHXUNUQSL-UHFFFAOYSA-N 0 0 387.339 3.050 20 5 GGBDRN Cc1ncsc1CNc1nc(C)c([N+](=O)[O-])c(NCc2scnc2C)n1 ZINC000159891174 1424551034 /nfs/dbraw/zinc/55/10/34/1424551034.db2.gz QEJSIZQQRRIRCY-UHFFFAOYSA-N 0 0 391.482 3.447 20 5 GGBDRN CC[NH+]1CCN(c2ccc(NC(=O)c3ccc([O-])c([N+](=O)[O-])c3)c(C)c2)CC1 ZINC000159905708 1424551741 /nfs/dbraw/zinc/55/17/41/1424551741.db2.gz KQGMQWNQPUVGMZ-UHFFFAOYSA-N 0 0 384.436 3.003 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1ccn(CCC(C)C)n1 ZINC000159943114 1424554375 /nfs/dbraw/zinc/55/43/75/1424554375.db2.gz HDTCPUYEBQFCOT-CYBMUJFWSA-N 0 0 375.429 3.285 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000159955700 1424556745 /nfs/dbraw/zinc/55/67/45/1424556745.db2.gz PGIBTUDYJZNKAV-NRFANRHFSA-N 0 0 392.415 3.316 20 5 GGBDRN CN(CCOC(=O)c1cnc(-c2ccccc2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000159966479 1424558049 /nfs/dbraw/zinc/55/80/49/1424558049.db2.gz RQCLPSDQORUEQH-UHFFFAOYSA-N 0 0 378.388 3.345 20 5 GGBDRN O=C(NC1CC1)c1cccc(OC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000159993832 1424560884 /nfs/dbraw/zinc/56/08/84/1424560884.db2.gz MDCBWZQRKZRVBR-UHFFFAOYSA-N 0 0 377.356 3.254 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)OCc1ccc(Br)cc1C ZINC000160007939 1424562086 /nfs/dbraw/zinc/56/20/86/1424562086.db2.gz FFJXOCXDZVDLKM-UHFFFAOYSA-N 0 0 382.214 3.304 20 5 GGBDRN C[C@@H](O)C[C@@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000160031818 1424564417 /nfs/dbraw/zinc/56/44/17/1424564417.db2.gz VAWQEMFKOJVDSU-APWZRJJASA-N 0 0 397.475 3.480 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1ccc2oc(N(C)C)nc2c1 ZINC000160069171 1424569865 /nfs/dbraw/zinc/56/98/65/1424569865.db2.gz FCSXJBUSVAJHGV-LLVKDONJSA-N 0 0 399.407 3.250 20 5 GGBDRN Cc1nc2ccccc2n1CCCNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000160077481 1424571672 /nfs/dbraw/zinc/57/16/72/1424571672.db2.gz HMNVOSKZPFULHI-UHFFFAOYSA-N 0 0 381.436 3.185 20 5 GGBDRN CCOC(=O)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000160082246 1424571933 /nfs/dbraw/zinc/57/19/33/1424571933.db2.gz ZADRTVVMSGBBIH-JTQLQIEISA-N 0 0 389.330 3.421 20 5 GGBDRN CCS[C@H]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C1 ZINC000180097146 1429736531 /nfs/dbraw/zinc/73/65/31/1429736531.db2.gz GDDZOWRRYNYVCY-RYUDHWBXSA-N 0 0 376.475 3.337 20 5 GGBDRN Cn1cc(C[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)cn1 ZINC000160113254 1424575221 /nfs/dbraw/zinc/57/52/21/1424575221.db2.gz COEJGRXMRQDOIN-LLVKDONJSA-N 0 0 397.357 3.444 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](CC)c2c(C)noc2C)cc1OC ZINC000160110172 1424575485 /nfs/dbraw/zinc/57/54/85/1424575485.db2.gz UKOFVNGNCHSNKY-CYBMUJFWSA-N 0 0 377.397 3.488 20 5 GGBDRN COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160116537 1424576015 /nfs/dbraw/zinc/57/60/15/1424576015.db2.gz LICOJHBZCDSQCE-KOLCDFICSA-N 0 0 375.303 3.077 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cn1)N[C@@H](c1nccs1)c1ccccc1 ZINC000160118561 1424576423 /nfs/dbraw/zinc/57/64/23/1424576423.db2.gz MZKZRDLVUZLMCO-MRXNPFEDSA-N 0 0 386.458 3.444 20 5 GGBDRN CCOC(=O)[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000160127989 1424576645 /nfs/dbraw/zinc/57/66/45/1424576645.db2.gz ZADRTVVMSGBBIH-SNVBAGLBSA-N 0 0 389.330 3.421 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cn1)N[C@H](c1nccs1)c1ccccc1 ZINC000160118425 1424576811 /nfs/dbraw/zinc/57/68/11/1424576811.db2.gz MZKZRDLVUZLMCO-INIZCTEOSA-N 0 0 386.458 3.444 20 5 GGBDRN C[C@H](O)C[C@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000160205143 1424587487 /nfs/dbraw/zinc/58/74/87/1424587487.db2.gz OWOAKNOZCSJTDO-WMLDXEAASA-N 0 0 383.448 3.454 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)c1c(Cl)cccc1Cl ZINC000160238310 1424589851 /nfs/dbraw/zinc/58/98/51/1424589851.db2.gz IFGNQHFCQFRUMR-HNNXBMFYSA-N 0 0 398.246 3.431 20 5 GGBDRN Cc1c(CC(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000160246661 1424589949 /nfs/dbraw/zinc/58/99/49/1424589949.db2.gz GPHYBDBKGQXMJN-UHFFFAOYSA-N 0 0 396.447 3.258 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCC[C@H](Cn2ccnn2)C1 ZINC000160257410 1424590467 /nfs/dbraw/zinc/59/04/67/1424590467.db2.gz HQZLUJZPTCBPRN-NSHDSACASA-N 0 0 398.345 3.149 20 5 GGBDRN Cc1nn(C)c(C)c1OCC(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000160265161 1424591512 /nfs/dbraw/zinc/59/15/12/1424591512.db2.gz OLFHYVDHNFCTQT-UHFFFAOYSA-N 0 0 392.843 3.421 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)C12CCCCC2 ZINC000160299498 1424593734 /nfs/dbraw/zinc/59/37/34/1424593734.db2.gz PHMUHRZKWBBENV-SJORKVTESA-N 0 0 389.452 3.086 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)C12CCCCC2 ZINC000160303752 1424593804 /nfs/dbraw/zinc/59/38/04/1424593804.db2.gz XZVJMASJUHEYOG-SJORKVTESA-N 0 0 389.452 3.086 20 5 GGBDRN O=C(Nc1cccc(C[S@@](=O)Cc2ccccc2)c1)c1n[nH]cc1[N+](=O)[O-] ZINC000160306977 1424594466 /nfs/dbraw/zinc/59/44/66/1424594466.db2.gz JHMSJVSYWXDIKT-HHHXNRCGSA-N 0 0 384.417 3.019 20 5 GGBDRN O=C(CCC1CCCC1)Cn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O ZINC000160311141 1424594500 /nfs/dbraw/zinc/59/45/00/1424594500.db2.gz DSULBDRWVFZXBE-UHFFFAOYSA-N 0 0 395.419 3.030 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cn1)NCc1ccc(OC(F)(F)F)cc1 ZINC000160314934 1424594530 /nfs/dbraw/zinc/59/45/30/1424594530.db2.gz JYLQDPTZYNYUAF-UHFFFAOYSA-N 0 0 387.339 3.297 20 5 GGBDRN O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000160318300 1424594537 /nfs/dbraw/zinc/59/45/37/1424594537.db2.gz DPWKHJOIWORTNA-MRXNPFEDSA-N 0 0 384.436 3.392 20 5 GGBDRN NC(=O)[C@@H]1CCCN1Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000160307275 1424594567 /nfs/dbraw/zinc/59/45/67/1424594567.db2.gz BHNMGHJPGRVFHI-AWEZNQCLSA-N 0 0 375.812 3.490 20 5 GGBDRN O=C(Nc1cccc(C[S@](=O)Cc2ccccc2)c1)c1n[nH]cc1[N+](=O)[O-] ZINC000160306806 1424594635 /nfs/dbraw/zinc/59/46/35/1424594635.db2.gz JHMSJVSYWXDIKT-MHZLTWQESA-N 0 0 384.417 3.019 20 5 GGBDRN Cc1nnc(SCCn2cc([N+](=O)[O-])ccc2=O)n1[C@H]1CCC[C@@H](C)C1 ZINC000160336086 1424595849 /nfs/dbraw/zinc/59/58/49/1424595849.db2.gz GBQJDQPVZVIBCL-OCCSQVGLSA-N 0 0 377.470 3.200 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@H]1CCN(c2ccccn2)C1 ZINC000160328217 1424595971 /nfs/dbraw/zinc/59/59/71/1424595971.db2.gz NJLQUZSVVPSVKP-LBPRGKRZSA-N 0 0 395.341 3.409 20 5 GGBDRN Cc1nnc(SCCn2cc([N+](=O)[O-])ccc2=O)n1[C@@H]1CCC[C@H](C)C1 ZINC000160335684 1424596035 /nfs/dbraw/zinc/59/60/35/1424596035.db2.gz GBQJDQPVZVIBCL-GXTWGEPZSA-N 0 0 377.470 3.200 20 5 GGBDRN O=C(N[C@H]1CCOC2(CCCCC2)C1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000160349666 1424597028 /nfs/dbraw/zinc/59/70/28/1424597028.db2.gz JLEKSRIJYJEKMS-ZDUSSCGKSA-N 0 0 385.420 3.048 20 5 GGBDRN CCOCCO[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000160354592 1424597817 /nfs/dbraw/zinc/59/78/17/1424597817.db2.gz JCAGSDSHGKPUMX-LBPRGKRZSA-N 0 0 391.346 3.273 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1N[C@H]1CCO[C@H](C2CC2)C1 ZINC000160360973 1424598190 /nfs/dbraw/zinc/59/81/90/1424598190.db2.gz QIHFOMBBIINNJC-HZMBPMFUSA-N 0 0 394.371 3.258 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1N[C@H]1CCO[C@@H](C2CC2)C1 ZINC000160361244 1424598684 /nfs/dbraw/zinc/59/86/84/1424598684.db2.gz QIHFOMBBIINNJC-IINYFYTJSA-N 0 0 394.371 3.258 20 5 GGBDRN O=c1c(Cl)c(N[C@H]2CCO[C@@H](C3CC3)C2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000160365799 1424598690 /nfs/dbraw/zinc/59/86/90/1424598690.db2.gz YKKPOGPUXOYNDL-BLLLJJGKSA-N 0 0 390.827 3.164 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCC1(c2ccccc2)CCOCC1 ZINC000160389872 1424600023 /nfs/dbraw/zinc/60/00/23/1424600023.db2.gz QCKRETRZYKPFJA-UHFFFAOYSA-N 0 0 383.448 3.185 20 5 GGBDRN COC(=O)C1CCC(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000160384730 1424600156 /nfs/dbraw/zinc/60/01/56/1424600156.db2.gz HMZFKPKZMZXGOY-UHFFFAOYSA-N 0 0 389.330 3.467 20 5 GGBDRN COc1ccc([C@@H](C)N(C)S(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000160404601 1424602397 /nfs/dbraw/zinc/60/23/97/1424602397.db2.gz YMXFNHHCXUIIJO-CQSZACIVSA-N 0 0 378.450 3.169 20 5 GGBDRN CCOc1cc(C(=O)N[C@H](CC)c2c(C)noc2C)c([N+](=O)[O-])cc1OC ZINC000160438552 1424603907 /nfs/dbraw/zinc/60/39/07/1424603907.db2.gz MAVIDISMDDALDL-CYBMUJFWSA-N 0 0 377.397 3.488 20 5 GGBDRN Cc1c(CC(=O)NCCc2nccn2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000160466285 1424605609 /nfs/dbraw/zinc/60/56/09/1424605609.db2.gz UDWIURFPEUZYCU-UHFFFAOYSA-N 0 0 378.432 3.049 20 5 GGBDRN CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000160469264 1424605670 /nfs/dbraw/zinc/60/56/70/1424605670.db2.gz SFDCIFUUHVNFLR-QRWLVFNGSA-N 0 0 395.459 3.211 20 5 GGBDRN CC(C)Oc1ccc(CNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000160474254 1424606819 /nfs/dbraw/zinc/60/68/19/1424606819.db2.gz FMRVVGAVZOTFBO-UHFFFAOYSA-N 0 0 378.450 3.044 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)cccc1[N+](=O)[O-] ZINC000160493510 1424608627 /nfs/dbraw/zinc/60/86/27/1424608627.db2.gz YFXUEOVXQPTQPG-KRWDZBQOSA-N 0 0 397.479 3.170 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C(=O)N(C)C)CC1 ZINC000160511982 1424609555 /nfs/dbraw/zinc/60/95/55/1424609555.db2.gz PUXVIZNFAKZJJI-UHFFFAOYSA-N 0 0 393.509 3.283 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(Sc3nncn3C)cc2)cccc1[N+](=O)[O-] ZINC000160513901 1424610444 /nfs/dbraw/zinc/61/04/44/1424610444.db2.gz LHAMFLRRHLUDFS-UHFFFAOYSA-N 0 0 383.433 3.364 20 5 GGBDRN CS(=O)(=O)c1cccc(N[C@H]2CCO[C@@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000160525759 1424611363 /nfs/dbraw/zinc/61/13/63/1424611363.db2.gz YRIHRRVJRJHCGG-GOEBONIOSA-N 0 0 376.434 3.331 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000160542494 1424612046 /nfs/dbraw/zinc/61/20/46/1424612046.db2.gz ZOUBWFYPGRBLLL-CQSZACIVSA-N 0 0 376.434 3.090 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1 ZINC000160551650 1424613354 /nfs/dbraw/zinc/61/33/54/1424613354.db2.gz KBKDQUMIQIILSR-OAHLLOKOSA-N 0 0 390.461 3.398 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1 ZINC000160543696 1424613409 /nfs/dbraw/zinc/61/34/09/1424613409.db2.gz JJICHAHCEIDDLJ-CQSZACIVSA-N 0 0 376.434 3.090 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc([N+](=O)[O-])c1F ZINC000180105571 1429739871 /nfs/dbraw/zinc/73/98/71/1429739871.db2.gz PXDPVANGEGZBGI-LLVKDONJSA-N 0 0 397.384 3.298 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCn2ncnc21 ZINC000160555893 1424613832 /nfs/dbraw/zinc/61/38/32/1424613832.db2.gz XBPYMNDBQLKXTI-CQSZACIVSA-N 0 0 375.454 3.199 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000160559951 1424614286 /nfs/dbraw/zinc/61/42/86/1424614286.db2.gz FWXXWGOSHXGBRO-CYBMUJFWSA-N 0 0 377.397 3.423 20 5 GGBDRN Cc1cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)nn1-c1ccc(F)cc1F ZINC000160589076 1424616592 /nfs/dbraw/zinc/61/65/92/1424616592.db2.gz MLJLPDCJQWLJEH-UHFFFAOYSA-N 0 0 386.358 3.340 20 5 GGBDRN Cc1c(CC(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)cccc1[N+](=O)[O-] ZINC000160607393 1424618333 /nfs/dbraw/zinc/61/83/33/1424618333.db2.gz FBKGHUPKASLREE-UHFFFAOYSA-N 0 0 387.411 3.461 20 5 GGBDRN Cc1nc(N2CCN(C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)CC2)sc1C ZINC000160626698 1424620256 /nfs/dbraw/zinc/62/02/56/1424620256.db2.gz VIRKXBLTBYTQKI-UHFFFAOYSA-N 0 0 380.857 3.284 20 5 GGBDRN O=C(Nc1cccc(C[S@](=O)C2CCCCC2)c1)c1n[nH]cc1[N+](=O)[O-] ZINC000160637519 1424621180 /nfs/dbraw/zinc/62/11/80/1424621180.db2.gz XQDBZNBYYMOYFA-AREMUKBSSA-N 0 0 376.438 3.152 20 5 GGBDRN CC(C)CSCCCNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000160653736 1424623469 /nfs/dbraw/zinc/62/34/69/1424623469.db2.gz DMOMANJFENIIOU-ZDUSSCGKSA-N 0 0 399.538 3.156 20 5 GGBDRN COc1cc(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000160677126 1424625724 /nfs/dbraw/zinc/62/57/24/1424625724.db2.gz OOWZIRPZVVRTOH-UHFFFAOYSA-N 0 0 391.811 3.406 20 5 GGBDRN CC(C)(NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1cn(-c2ccccc2)nn1 ZINC000160695125 1424627138 /nfs/dbraw/zinc/62/71/38/1424627138.db2.gz GVSDTYWWAYCFDQ-UHFFFAOYSA-N 0 0 385.811 3.494 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H](c2cccnc2)C(C)C)cc([N+](=O)[O-])c1F ZINC000180106587 1429740780 /nfs/dbraw/zinc/74/07/80/1429740780.db2.gz BEIJFNOXXKIIMG-OAHLLOKOSA-N 0 0 381.429 3.155 20 5 GGBDRN Cc1c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cnn1C1CCOCC1 ZINC000160711294 1424628957 /nfs/dbraw/zinc/62/89/57/1424628957.db2.gz GBXWFVBJYXRCKL-UHFFFAOYSA-N 0 0 392.843 3.377 20 5 GGBDRN CN(Cc1cnn(-c2ccccc2)c1)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000160725564 1424629591 /nfs/dbraw/zinc/62/95/91/1424629591.db2.gz BWGFITFKSWJELA-UHFFFAOYSA-N 0 0 390.403 3.463 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCc1ccc(-c2nc3ccccc3s2)o1 ZINC000160713258 1424629715 /nfs/dbraw/zinc/62/97/15/1424629715.db2.gz RFDRPXCQNQTXRW-UHFFFAOYSA-N 0 0 383.389 3.128 20 5 GGBDRN O=C(NCc1ccco1)[C@@H]1CCCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160740352 1424631889 /nfs/dbraw/zinc/63/18/89/1424631889.db2.gz JQBOSTMXIOJBAP-HNNXBMFYSA-N 0 0 383.326 3.492 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cccc3c2CN(C(C)C)C3)cc1[N+](=O)[O-] ZINC000160761433 1424633684 /nfs/dbraw/zinc/63/36/84/1424633684.db2.gz MJHMWSBEAXNEJD-UHFFFAOYSA-N 0 0 391.449 3.128 20 5 GGBDRN CN(Cc1cccn1C)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000160767645 1424633886 /nfs/dbraw/zinc/63/38/86/1424633886.db2.gz RYXAODYELGSAJV-UHFFFAOYSA-N 0 0 384.358 3.413 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1csc(-c2ccco2)n1 ZINC000160797225 1424635470 /nfs/dbraw/zinc/63/54/70/1424635470.db2.gz QBXGCHGTSXINFI-UHFFFAOYSA-N 0 0 387.421 3.223 20 5 GGBDRN CCS(=O)(=O)c1cccc(CC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000160814077 1424636213 /nfs/dbraw/zinc/63/62/13/1424636213.db2.gz SJIBHYGPVBDVCZ-AWEZNQCLSA-N 0 0 390.461 3.117 20 5 GGBDRN CCc1cc(NC(=O)Cn2c(C)c(C)sc2=O)c2cc([N+](=O)[O-])ccc2n1 ZINC000160854164 1424638757 /nfs/dbraw/zinc/63/87/57/1424638757.db2.gz ZFMHWRWPHNNJJE-UHFFFAOYSA-N 0 0 386.433 3.184 20 5 GGBDRN CCc1cc(NC(=O)CCCNC(=O)c2ccco2)c2cc([N+](=O)[O-])ccc2n1 ZINC000160874826 1424640729 /nfs/dbraw/zinc/64/07/29/1424640729.db2.gz ITRGFYDIXQGHDS-UHFFFAOYSA-N 0 0 396.403 3.447 20 5 GGBDRN CCC(=O)N1CCC[C@H](C(=O)Nc2cc(CC)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000160882925 1424641505 /nfs/dbraw/zinc/64/15/05/1424641505.db2.gz JEQUZFGUUQNUHI-ZDUSSCGKSA-N 0 0 384.436 3.293 20 5 GGBDRN CS(=O)(=O)Cc1cc(F)ccc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000160948782 1424646945 /nfs/dbraw/zinc/64/69/45/1424646945.db2.gz POOVBQOCYGDEPX-UHFFFAOYSA-N 0 0 386.788 3.184 20 5 GGBDRN COc1cc(CN(C)CC(=O)Nc2cccc(Cl)c2)c([N+](=O)[O-])cc1OC ZINC000180114397 1429743717 /nfs/dbraw/zinc/74/37/17/1429743717.db2.gz HJLIHJYPJXXOQH-UHFFFAOYSA-N 0 0 393.827 3.336 20 5 GGBDRN Cc1ccc(N2CCCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC2)nn1 ZINC000161003142 1424651229 /nfs/dbraw/zinc/65/12/29/1424651229.db2.gz OLFBUYPIHNVRQW-UHFFFAOYSA-N 0 0 381.358 3.429 20 5 GGBDRN O=C(CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)NCc1ccccn1 ZINC000161020300 1424652943 /nfs/dbraw/zinc/65/29/43/1424652943.db2.gz IFNSEOKBGHTIBK-UHFFFAOYSA-N 0 0 377.404 3.170 20 5 GGBDRN CC(C)CCn1ccc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000161052023 1424655018 /nfs/dbraw/zinc/65/50/18/1424655018.db2.gz ZZZIVPGUSADGQY-UHFFFAOYSA-N 0 0 386.456 3.192 20 5 GGBDRN CON(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCCc2sccc21 ZINC000161061302 1424655799 /nfs/dbraw/zinc/65/57/99/1424655799.db2.gz WOUGODHDJJYNCD-ZDUSSCGKSA-N 0 0 397.478 3.328 20 5 GGBDRN CC(C)(CNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CCCC1 ZINC000161076740 1424656663 /nfs/dbraw/zinc/65/66/63/1424656663.db2.gz XORUDNCASIQACM-UHFFFAOYSA-N 0 0 381.860 3.311 20 5 GGBDRN CCc1nc(-c2ccccc2NC(=O)CCNc2ccccc2[N+](=O)[O-])n[nH]1 ZINC000161087163 1424656715 /nfs/dbraw/zinc/65/67/15/1424656715.db2.gz MIEZPAYKKDONJM-UHFFFAOYSA-N 0 0 380.408 3.383 20 5 GGBDRN COCCN(Cc1cccnc1)c1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000161226147 1424667901 /nfs/dbraw/zinc/66/79/01/1424667901.db2.gz ZUWJUBBEIVYTAR-UHFFFAOYSA-N 0 0 379.420 3.408 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(C2CCCCC2)C1=O ZINC000161232334 1424668949 /nfs/dbraw/zinc/66/89/49/1424668949.db2.gz UMIQENGLNSSGFL-INIZCTEOSA-N 0 0 391.493 3.370 20 5 GGBDRN C[C@H](C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1c(F)cccc1F ZINC000161245398 1424670023 /nfs/dbraw/zinc/67/00/23/1424670023.db2.gz OHOXAXWLNBTPIZ-RYUDHWBXSA-N 0 0 376.363 3.085 20 5 GGBDRN Nc1c(Cl)cc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl ZINC000161241361 1424670028 /nfs/dbraw/zinc/67/00/28/1424670028.db2.gz BUWIAZMVIRDYOH-JTQLQIEISA-N 0 0 396.234 3.205 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000161288367 1424672592 /nfs/dbraw/zinc/67/25/92/1424672592.db2.gz UXVSDZSDKZJUAD-UHFFFAOYSA-N 0 0 386.769 3.108 20 5 GGBDRN C[C@](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)(C(N)=O)c1cccc(Cl)c1 ZINC000161299397 1424673700 /nfs/dbraw/zinc/67/37/00/1424673700.db2.gz NJXWIIGNSAXNGX-MRXNPFEDSA-N 0 0 382.203 3.032 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCCC[C@@H]1CCCc1ccccc1 ZINC000161307974 1424674891 /nfs/dbraw/zinc/67/48/91/1424674891.db2.gz OEPLILJAXHULEU-GOSISDBHSA-N 0 0 383.448 3.161 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCCC[C@H]1CCCc1ccccc1 ZINC000161322973 1424676672 /nfs/dbraw/zinc/67/66/72/1424676672.db2.gz OYYNJMCZSZPFQY-SFHVURJKSA-N 0 0 383.448 3.161 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(Cc1cccs1)Cc1cccs1 ZINC000161313618 1424676723 /nfs/dbraw/zinc/67/67/23/1424676723.db2.gz MBNCUJNIXUTMRS-UHFFFAOYSA-N 0 0 389.458 3.109 20 5 GGBDRN C[C@H](SCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C(=O)OC(C)(C)C ZINC000161336553 1424677815 /nfs/dbraw/zinc/67/78/15/1424677815.db2.gz ZWFSWTLTMAYXGK-NSHDSACASA-N 0 0 382.438 3.356 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1Cl)N1CCOC[C@@H]1C1CC1 ZINC000161334986 1424678741 /nfs/dbraw/zinc/67/87/41/1424678741.db2.gz AXPNLRZYEPUCLC-GFCCVEGCSA-N 0 0 389.633 3.262 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N(Cc1ccco1)c1ccccn1 ZINC000161358856 1424681164 /nfs/dbraw/zinc/68/11/64/1424681164.db2.gz WRNMNCYLTGZHGJ-UHFFFAOYSA-N 0 0 387.417 3.162 20 5 GGBDRN CN(CCOCc1ccccc1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000161470160 1424693384 /nfs/dbraw/zinc/69/33/84/1424693384.db2.gz AFXVPKUTKRJNTK-UHFFFAOYSA-N 0 0 383.448 3.484 20 5 GGBDRN CCOc1cccc([C@H](C)NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000161476082 1424693540 /nfs/dbraw/zinc/69/35/40/1424693540.db2.gz PLDSIHBBBLWCEO-AWEZNQCLSA-N 0 0 378.450 3.217 20 5 GGBDRN Cc1c(C(=O)N(C)CCOCc2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000161488442 1424694537 /nfs/dbraw/zinc/69/45/37/1424694537.db2.gz COVMEORSNIAHBW-UHFFFAOYSA-N 0 0 387.392 3.409 20 5 GGBDRN CCO[C@H](C)c1nc(CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cs1 ZINC000161499457 1424695908 /nfs/dbraw/zinc/69/59/08/1424695908.db2.gz GJRQTFRXFXDKSI-GFCCVEGCSA-N 0 0 375.450 3.276 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cccc(C(F)(F)F)n2)cc([N+](=O)[O-])c1 ZINC000161514573 1424697800 /nfs/dbraw/zinc/69/78/00/1424697800.db2.gz WSIGKZYXPKFIPO-UHFFFAOYSA-N 0 0 383.282 3.438 20 5 GGBDRN COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000161550724 1424707432 /nfs/dbraw/zinc/70/74/32/1424707432.db2.gz AZFJFWLCDGMHIF-UHFFFAOYSA-N 0 0 394.387 3.057 20 5 GGBDRN CCc1ccc([C@@H]2CCCCCN2C(=O)NCCn2cc([N+](=O)[O-])cn2)o1 ZINC000161569988 1424714079 /nfs/dbraw/zinc/71/40/79/1424714079.db2.gz ZVKUFBRSSJWSII-INIZCTEOSA-N 0 0 375.429 3.274 20 5 GGBDRN Cc1ccc(-c2[nH]nc(NC(=O)c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)c2C)o1 ZINC000161572818 1424714585 /nfs/dbraw/zinc/71/45/85/1424714585.db2.gz OSHYITIPJJVCDO-UHFFFAOYSA-N 0 0 393.359 3.289 20 5 GGBDRN O=C(NCc1ccc(COC2CCOCC2)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000161576114 1424716333 /nfs/dbraw/zinc/71/63/33/1424716333.db2.gz FVENCFDQFDIUKI-UHFFFAOYSA-N 0 0 388.395 3.360 20 5 GGBDRN C[C@H]1CC(NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C[C@H](C)O1 ZINC000161596296 1424720602 /nfs/dbraw/zinc/72/06/02/1424720602.db2.gz MCKKAMPKFTWTHH-KBPBESRZSA-N 0 0 377.441 3.104 20 5 GGBDRN Cc1c(CC(=O)NCc2ccc(OCC(F)(F)F)nc2)cccc1[N+](=O)[O-] ZINC000161622426 1424726388 /nfs/dbraw/zinc/72/63/88/1424726388.db2.gz KBIVULBSZRDSBE-UHFFFAOYSA-N 0 0 383.326 3.098 20 5 GGBDRN Cc1c(CC(=O)NCc2ccc(NC(=O)NC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000161630781 1424729326 /nfs/dbraw/zinc/72/93/26/1424729326.db2.gz VOHNTTLNCHINLL-UHFFFAOYSA-N 0 0 384.436 3.292 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000161665836 1424735711 /nfs/dbraw/zinc/73/57/11/1424735711.db2.gz SYGAWONIEGIKJE-YWZLYKJASA-N 0 0 383.448 3.437 20 5 GGBDRN COc1ccc(C(C)(C)CNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000161692553 1424742327 /nfs/dbraw/zinc/74/23/27/1424742327.db2.gz BRVGDGRIMOUSMN-UHFFFAOYSA-N 0 0 392.477 3.043 20 5 GGBDRN O=C(NCCCc1nc2ccccc2[nH]1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180128455 1429749704 /nfs/dbraw/zinc/74/97/04/1429749704.db2.gz JORNNFKGEFMWHG-UHFFFAOYSA-N 0 0 390.346 3.435 20 5 GGBDRN CCOC(=O)c1sc2cccc(F)c2c1Cn1cccc([N+](=O)[O-])c1=O ZINC000161702184 1424744708 /nfs/dbraw/zinc/74/47/08/1424744708.db2.gz NEYKKWLPGPSSMC-UHFFFAOYSA-N 0 0 376.365 3.335 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000161717266 1424749689 /nfs/dbraw/zinc/74/96/89/1424749689.db2.gz ZNSNOTMOGCFZFU-MRXNPFEDSA-N 0 0 396.321 3.307 20 5 GGBDRN Cc1cc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c2cnn(C)c2n1 ZINC000161726901 1424751388 /nfs/dbraw/zinc/75/13/88/1424751388.db2.gz SCCWBVJCFHGJKI-UHFFFAOYSA-N 0 0 376.376 3.294 20 5 GGBDRN Cc1cc(NC(=O)C2CCN(C(=O)C(C)C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161759032 1424758622 /nfs/dbraw/zinc/75/86/22/1424758622.db2.gz JJRRPRVVCDBVRC-UHFFFAOYSA-N 0 0 384.436 3.285 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000161764117 1424759388 /nfs/dbraw/zinc/75/93/88/1424759388.db2.gz PDIJLCWAFXMQGE-ZJUUUORDSA-N 0 0 377.260 3.024 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@H](CC)c2c(C)noc2C)cc([N+](=O)[O-])c1 ZINC000161771128 1424760595 /nfs/dbraw/zinc/76/05/95/1424760595.db2.gz WXNUCQOADBGNLZ-HNNXBMFYSA-N 0 0 375.381 3.257 20 5 GGBDRN Cc1c(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000161807235 1424768344 /nfs/dbraw/zinc/76/83/44/1424768344.db2.gz DMHVTEUQEQOFLW-UHFFFAOYSA-N 0 0 386.320 3.313 20 5 GGBDRN O=C(Cc1ccc(NC(=O)C2CC2)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161832952 1424775780 /nfs/dbraw/zinc/77/57/80/1424775780.db2.gz VHCLSGJPJSPNAA-UHFFFAOYSA-N 0 0 379.416 3.465 20 5 GGBDRN O=C([C@@H](c1ccccc1F)N1CCOCC1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161833293 1424775948 /nfs/dbraw/zinc/77/59/48/1424775948.db2.gz LZQJCPXKSXFURN-HXUWFJFHSA-N 0 0 399.422 3.087 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1coc(-c2c(F)cccc2F)n1 ZINC000161838109 1424777034 /nfs/dbraw/zinc/77/70/34/1424777034.db2.gz BZLNCLKZAAPPSW-UHFFFAOYSA-N 0 0 385.282 3.324 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)Cc1cc(C)nn1-c1ccccc1 ZINC000161861209 1424782174 /nfs/dbraw/zinc/78/21/74/1424782174.db2.gz YSEPOUMDIRBIPT-CQSZACIVSA-N 0 0 393.447 3.492 20 5 GGBDRN COc1cc2c(cc1CNc1cc3c(cc1[N+](=O)[O-])CCC(=O)N3)O[C@H](C)C2 ZINC000161867858 1424783725 /nfs/dbraw/zinc/78/37/25/1424783725.db2.gz CCQYMPYIZSPHPA-LLVKDONJSA-N 0 0 383.404 3.424 20 5 GGBDRN CC(C)S(=O)(=O)c1ccccc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161883058 1424787100 /nfs/dbraw/zinc/78/71/00/1424787100.db2.gz IRPJKUKAZAGLIW-UHFFFAOYSA-N 0 0 388.445 3.370 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(F)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161885034 1424788005 /nfs/dbraw/zinc/78/80/05/1424788005.db2.gz VADKNNMPRHLAFU-UHFFFAOYSA-N 0 0 385.395 3.223 20 5 GGBDRN O=C(c1nc(N2CCCC2)ncc1Cl)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161910243 1424793302 /nfs/dbraw/zinc/79/33/02/1424793302.db2.gz KBKVDAZIUHWVQF-UHFFFAOYSA-N 0 0 387.827 3.231 20 5 GGBDRN C[C@@H](c1ccccc1)N1C[C@H](C(=O)N2CCCc3c([N+](=O)[O-])cccc32)CC1=O ZINC000161931808 1424800135 /nfs/dbraw/zinc/80/01/35/1424800135.db2.gz RDTXMUQDJUQTML-DOTOQJQBSA-N 0 0 393.443 3.484 20 5 GGBDRN CCCN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H](C)C(=O)Nc1ccccc1 ZINC000161944300 1424801549 /nfs/dbraw/zinc/80/15/49/1424801549.db2.gz IIVLBWIANBRRQF-ZDUSSCGKSA-N 0 0 395.419 3.351 20 5 GGBDRN O=C(c1ccc(N2CCOCC2)c(F)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161948312 1424802004 /nfs/dbraw/zinc/80/20/04/1424802004.db2.gz QOPQRJGWIXGCRZ-UHFFFAOYSA-N 0 0 385.395 3.164 20 5 GGBDRN COc1ccc(-c2ccc(CNc3cccnc3-n3cncn3)o2)c([N+](=O)[O-])c1 ZINC000161946965 1424802158 /nfs/dbraw/zinc/80/21/58/1424802158.db2.gz SLGDRTRNCHPPKU-UHFFFAOYSA-N 0 0 392.375 3.451 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161960936 1424803590 /nfs/dbraw/zinc/80/35/90/1424803590.db2.gz PEBJTDWWKVBXIQ-INIZCTEOSA-N 0 0 375.425 3.274 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)o1 ZINC000161969614 1424804780 /nfs/dbraw/zinc/80/47/80/1424804780.db2.gz CWQCJZOQBFIQEY-HNNXBMFYSA-N 0 0 375.337 3.220 20 5 GGBDRN O=C(Cc1ccc(OCc2ccccn2)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000161985898 1424806033 /nfs/dbraw/zinc/80/60/33/1424806033.db2.gz VIVKASIRKUPRAJ-UHFFFAOYSA-N 0 0 377.400 3.428 20 5 GGBDRN O=C([C@H](c1cccc(F)c1)N1CCOCC1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161982542 1424806124 /nfs/dbraw/zinc/80/61/24/1424806124.db2.gz VNFWBKJASWBNSB-FQEVSTJZSA-N 0 0 399.422 3.087 20 5 GGBDRN O=C(c1ccco1)N1CCCC[C@@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161999997 1424807340 /nfs/dbraw/zinc/80/73/40/1424807340.db2.gz YLQNMVPHZCWSJZ-QGZVFWFLSA-N 0 0 383.404 3.162 20 5 GGBDRN O=C(c1ccco1)N1CCCC[C@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161999857 1424807439 /nfs/dbraw/zinc/80/74/39/1424807439.db2.gz YLQNMVPHZCWSJZ-KRWDZBQOSA-N 0 0 383.404 3.162 20 5 GGBDRN C[C@H](CNc1ccccc1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000162028261 1424810180 /nfs/dbraw/zinc/81/01/80/1424810180.db2.gz NCNOPKVVXHCHNS-CQSZACIVSA-N 0 0 379.420 3.226 20 5 GGBDRN CC(C)[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162041339 1424811256 /nfs/dbraw/zinc/81/12/56/1424811256.db2.gz RLGDVFYJPDGFTR-NRFANRHFSA-N 0 0 395.459 3.258 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H](O)c1ccc(F)cc1 ZINC000162055998 1424812285 /nfs/dbraw/zinc/81/22/85/1424812285.db2.gz ZDCMAFDKLZZQJM-VFZGTOFNSA-N 0 0 397.200 3.348 20 5 GGBDRN CCc1cccc(Cc2cnc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)s2)c1 ZINC000162085734 1424814682 /nfs/dbraw/zinc/81/46/82/1424814682.db2.gz ACGHYFCGETYVBD-UHFFFAOYSA-N 0 0 398.444 3.005 20 5 GGBDRN CN(CC(C)(C)CN1CCOCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000162082988 1424814760 /nfs/dbraw/zinc/81/47/60/1424814760.db2.gz LGSHEYIYCGJAEF-UHFFFAOYSA-N 0 0 384.864 3.070 20 5 GGBDRN COc1ccc(CN2CCCC[C@H]2C(N)=O)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000162109457 1424816900 /nfs/dbraw/zinc/81/69/00/1424816900.db2.gz AHFGFUFDYRLJHE-SFHVURJKSA-N 0 0 399.447 3.022 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000162110432 1424817117 /nfs/dbraw/zinc/81/71/17/1424817117.db2.gz ATWLSBNQESUIFA-UHFFFAOYSA-N 0 0 388.445 3.370 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)c1c(C)noc1C ZINC000162120367 1424817810 /nfs/dbraw/zinc/81/78/10/1424817810.db2.gz VVBDCSMAPBPVRE-LLVKDONJSA-N 0 0 393.465 3.472 20 5 GGBDRN O=C(c1ccc(S(=O)(=O)C(F)F)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162131426 1424818535 /nfs/dbraw/zinc/81/85/35/1424818535.db2.gz CBENBCNQPVWHCF-UHFFFAOYSA-N 0 0 396.371 3.184 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000162161691 1424821206 /nfs/dbraw/zinc/82/12/06/1424821206.db2.gz PNOTWPHKVCODSA-CYBMUJFWSA-N 0 0 396.852 3.231 20 5 GGBDRN C[C@@H]1Oc2ccccc2N(CCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)C1=O ZINC000162159486 1424821219 /nfs/dbraw/zinc/82/12/19/1424821219.db2.gz XIBQXAQBOSYEKG-AWEZNQCLSA-N 0 0 395.415 3.078 20 5 GGBDRN Cc1ccc(C)n1-c1c(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cnn1C ZINC000162164522 1424821766 /nfs/dbraw/zinc/82/17/66/1424821766.db2.gz KNVWKOUHKJEBPJ-UHFFFAOYSA-N 0 0 379.420 3.329 20 5 GGBDRN CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162172812 1424822465 /nfs/dbraw/zinc/82/24/65/1424822465.db2.gz FIZQZIDJMPGBMZ-UHFFFAOYSA-N 0 0 377.441 3.425 20 5 GGBDRN COc1cc(C)cc(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000162175927 1424822827 /nfs/dbraw/zinc/82/28/27/1424822827.db2.gz IHPAIIKHXBYXFJ-UHFFFAOYSA-N 0 0 383.448 3.445 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N[C@H]1CCCc2sccc21 ZINC000162193563 1424825212 /nfs/dbraw/zinc/82/52/12/1424825212.db2.gz KPSOZBBAPXQLDG-LBPRGKRZSA-N 0 0 393.852 3.233 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000162204719 1424826142 /nfs/dbraw/zinc/82/61/42/1424826142.db2.gz NTOMIOVRWHKWFT-FQEVSTJZSA-N 0 0 393.443 3.374 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCc1cc(Br)cs1 ZINC000162213907 1424827332 /nfs/dbraw/zinc/82/73/32/1424827332.db2.gz NSCICNHPJRZWHR-UHFFFAOYSA-N 0 0 395.231 3.036 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cccc(OCc2cccc(F)c2)c1 ZINC000162241013 1424830075 /nfs/dbraw/zinc/83/00/75/1424830075.db2.gz KNVZGVIRHYYLNU-UHFFFAOYSA-N 0 0 397.362 3.113 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000162245406 1424830588 /nfs/dbraw/zinc/83/05/88/1424830588.db2.gz PVQSTZKMGHZWDM-UHFFFAOYSA-N 0 0 396.230 3.255 20 5 GGBDRN CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162271623 1424833145 /nfs/dbraw/zinc/83/31/45/1424833145.db2.gz IGPGUAUHGZXICS-GOSISDBHSA-N 0 0 395.459 3.402 20 5 GGBDRN O=C(NCc1ccco1)c1cccc(CSCCn2cc([N+](=O)[O-])cn2)c1 ZINC000162283675 1424834177 /nfs/dbraw/zinc/83/41/77/1424834177.db2.gz NEOWVWSHUIOEBN-UHFFFAOYSA-N 0 0 386.433 3.248 20 5 GGBDRN COCCCCCOC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000162366662 1424842051 /nfs/dbraw/zinc/84/20/51/1424842051.db2.gz BDLBGSUSHMQWGA-UHFFFAOYSA-N 0 0 393.177 3.173 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(N3CCOCC3)nc2C)cc1[N+](=O)[O-] ZINC000162413494 1424848217 /nfs/dbraw/zinc/84/82/17/1424848217.db2.gz UXKQDHJDDZKCPW-CQSZACIVSA-N 0 0 399.451 3.326 20 5 GGBDRN C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H](O)c1ccc(F)cc1 ZINC000162452921 1424854070 /nfs/dbraw/zinc/85/40/70/1424854070.db2.gz PXKDUSJWZIEXLL-ORAYPTAESA-N 0 0 375.400 3.164 20 5 GGBDRN Cc1nc(N2CCN(C(=O)c3ccc([N+](=O)[O-])c(Cl)c3)CC2)sc1C ZINC000162452878 1424854165 /nfs/dbraw/zinc/85/41/65/1424854165.db2.gz WCSJKZGYJUAOCC-UHFFFAOYSA-N 0 0 380.857 3.284 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162466098 1424855638 /nfs/dbraw/zinc/85/56/38/1424855638.db2.gz AIFCJJSYHVLGQU-UHFFFAOYSA-N 0 0 396.369 3.492 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccccc1CN1CCOCC1 ZINC000162469320 1424856355 /nfs/dbraw/zinc/85/63/55/1424856355.db2.gz JIEZYNLMHLZRGD-UHFFFAOYSA-N 0 0 384.436 3.057 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@@H]2[C@H](C1)OCCN2Cc1ccccc1 ZINC000162492117 1424858553 /nfs/dbraw/zinc/85/85/53/1424858553.db2.gz OUZUWKGDMNIIQL-UXHICEINSA-N 0 0 396.447 3.020 20 5 GGBDRN CC(=O)N1CC[C@H](CN(C)C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000162489704 1424858562 /nfs/dbraw/zinc/85/85/62/1424858562.db2.gz WYFNUHMXBSMVQM-OAHLLOKOSA-N 0 0 393.509 3.283 20 5 GGBDRN CC(C)OC(=O)[C@H](C)N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000162519410 1424861157 /nfs/dbraw/zinc/86/11/57/1424861157.db2.gz SEGBLJUYXMUKBH-NSHDSACASA-N 0 0 377.422 3.130 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000162530773 1424862794 /nfs/dbraw/zinc/86/27/94/1424862794.db2.gz SJBXAYOVQBTSFE-CABCVRRESA-N 0 0 376.457 3.452 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)o1 ZINC000162530411 1424863151 /nfs/dbraw/zinc/86/31/51/1424863151.db2.gz IUHVXDVCKJXYJX-MRXNPFEDSA-N 0 0 394.449 3.477 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(c2ncnc3sccc32)CC1 ZINC000162549408 1424864975 /nfs/dbraw/zinc/86/49/75/1424864975.db2.gz WPLSWYCHQSDQJA-UHFFFAOYSA-N 0 0 398.448 3.262 20 5 GGBDRN COc1cc(NCCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc(OC)c1 ZINC000162555138 1424865618 /nfs/dbraw/zinc/86/56/18/1424865618.db2.gz DXZNBDLNRPDPIA-UHFFFAOYSA-N 0 0 379.800 3.107 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000162559870 1424866215 /nfs/dbraw/zinc/86/62/15/1424866215.db2.gz HDLPENJFWOTBNQ-HNNXBMFYSA-N 0 0 380.422 3.168 20 5 GGBDRN CCN(C[C@H]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1)CC(F)(F)F ZINC000162557153 1424866276 /nfs/dbraw/zinc/86/62/76/1424866276.db2.gz HQIGHYYKAQPDOD-CQSZACIVSA-N 0 0 388.390 3.011 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000162575285 1424867629 /nfs/dbraw/zinc/86/76/29/1424867629.db2.gz NQRKERMOUVWWDL-MRXNPFEDSA-N 0 0 380.422 3.001 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000162592486 1424869676 /nfs/dbraw/zinc/86/96/76/1424869676.db2.gz NORMUSSKRZBSDG-UHFFFAOYSA-N 0 0 389.843 3.301 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000162595758 1424870186 /nfs/dbraw/zinc/87/01/86/1424870186.db2.gz UROZPRPEDSJKDR-AWEZNQCLSA-N 0 0 376.457 3.309 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@@H](O)c1ccc(F)cc1 ZINC000162680139 1424879097 /nfs/dbraw/zinc/87/90/97/1424879097.db2.gz QNPMUHNMBFIZAY-ORAYPTAESA-N 0 0 387.411 3.186 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)n1 ZINC000162682531 1424879977 /nfs/dbraw/zinc/87/99/77/1424879977.db2.gz QKTSKRCWOAULFR-UHFFFAOYSA-N 0 0 390.469 3.061 20 5 GGBDRN COc1cccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000162696746 1424881661 /nfs/dbraw/zinc/88/16/61/1424881661.db2.gz BHCWHKVBYDGKKS-UHFFFAOYSA-N 0 0 390.339 3.101 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCCC(=O)N1CCc2ccccc21 ZINC000162694845 1424881832 /nfs/dbraw/zinc/88/18/32/1424881832.db2.gz RSXHYVAWWACWEG-UHFFFAOYSA-N 0 0 382.420 3.394 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000162734068 1424886326 /nfs/dbraw/zinc/88/63/26/1424886326.db2.gz PXWHRBRYLSQIBZ-GDLCADMTSA-N 0 0 383.351 3.275 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCC[C@H]1COc1ccccc1 ZINC000162749078 1424887281 /nfs/dbraw/zinc/88/72/81/1424887281.db2.gz XLYRYFXUPIJXCU-KRWDZBQOSA-N 0 0 390.461 3.011 20 5 GGBDRN CCO[C@@H](C)c1noc(CS(=O)(=O)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000180147773 1429761320 /nfs/dbraw/zinc/76/13/20/1429761320.db2.gz GIIQANZMRRZQQF-RYUDHWBXSA-N 0 0 383.426 3.060 20 5 GGBDRN Cc1ccc(Cc2cnc(NC(=O)c3c([N+](=O)[O-])cnn3C)s2)cc1F ZINC000162785459 1424890610 /nfs/dbraw/zinc/89/06/10/1424890610.db2.gz BYPHOXFVMGNUSZ-UHFFFAOYSA-N 0 0 375.385 3.075 20 5 GGBDRN Cc1c(CC(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000162793754 1424891106 /nfs/dbraw/zinc/89/11/06/1424891106.db2.gz ZMNOQNPDIZABDU-UHFFFAOYSA-N 0 0 396.447 3.258 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3nnc4n3CCCC4)cc2[N+](=O)[O-])C1 ZINC000162806585 1424891928 /nfs/dbraw/zinc/89/19/28/1424891928.db2.gz FSISCUSLMLLVDX-ZIAGYGMSSA-N 0 0 398.467 3.257 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)CN1CCOCC1 ZINC000162811866 1424892809 /nfs/dbraw/zinc/89/28/09/1424892809.db2.gz JNYDPPZZLOILLM-OAHLLOKOSA-N 0 0 395.525 3.041 20 5 GGBDRN C[C@@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1nnc2ccccn21 ZINC000162813733 1424892937 /nfs/dbraw/zinc/89/29/37/1424892937.db2.gz JLDLFLFGJMMNDZ-CYBMUJFWSA-N 0 0 380.408 3.073 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H](O)c1ccc(F)cc1 ZINC000162863742 1424897547 /nfs/dbraw/zinc/89/75/47/1424897547.db2.gz VUHHAICBFAXLPD-DJJJIMSYSA-N 0 0 387.411 3.186 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H](O)c1ccc(F)cc1 ZINC000162864023 1424897614 /nfs/dbraw/zinc/89/76/14/1424897614.db2.gz VUHHAICBFAXLPD-ORAYPTAESA-N 0 0 387.411 3.186 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](c1cccs1)N1CCOCC1 ZINC000162870353 1424897935 /nfs/dbraw/zinc/89/79/35/1424897935.db2.gz UFKQYIYRYGOZOK-INIZCTEOSA-N 0 0 390.465 3.160 20 5 GGBDRN Cc1cccnc1[C@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])C(C)C ZINC000162889529 1424900660 /nfs/dbraw/zinc/90/06/60/1424900660.db2.gz NHJHNMHQRCYMKH-QGZVFWFLSA-N 0 0 377.466 3.157 20 5 GGBDRN COc1ccc(-n2nc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])cc2C)cc1 ZINC000180151440 1429763220 /nfs/dbraw/zinc/76/32/20/1429763220.db2.gz LBFCZZLGFZYSEM-UHFFFAOYSA-N 0 0 378.388 3.300 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(Cl)nc2)c(C(F)(F)F)c1 ZINC000162904415 1424902690 /nfs/dbraw/zinc/90/26/90/1424902690.db2.gz MEOWBEYLAWTHFI-UHFFFAOYSA-N 0 0 395.746 3.141 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O ZINC000162927010 1424907331 /nfs/dbraw/zinc/90/73/31/1424907331.db2.gz GBAOWUZFDJOWGI-HNNXBMFYSA-N 0 0 390.346 3.108 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1noc(-c2ccccc2)n1 ZINC000162925426 1424907491 /nfs/dbraw/zinc/90/74/91/1424907491.db2.gz XETGFFXQPYYABE-JTQLQIEISA-N 0 0 378.348 3.012 20 5 GGBDRN CC(C)OC(=O)c1ccc(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)cc1 ZINC000162963711 1424914531 /nfs/dbraw/zinc/91/45/31/1424914531.db2.gz CGOWUKAGBISLMK-UHFFFAOYSA-N 0 0 393.399 3.432 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](c1ccccc1)N1CCOCC1 ZINC000162972718 1424916106 /nfs/dbraw/zinc/91/61/06/1424916106.db2.gz VKGNSKKWDBBMJT-LJQANCHMSA-N 0 0 384.436 3.098 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O ZINC000163026073 1424925923 /nfs/dbraw/zinc/92/59/23/1424925923.db2.gz NEVGDCGGLWXUHV-LJQANCHMSA-N 0 0 396.447 3.258 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000163044200 1424929631 /nfs/dbraw/zinc/92/96/31/1424929631.db2.gz GICYQYRPEFTQPR-NSHDSACASA-N 0 0 390.346 3.108 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000163046878 1424930490 /nfs/dbraw/zinc/93/04/90/1424930490.db2.gz SYWHNFDEPIJPSZ-UHFFFAOYSA-N 0 0 377.422 3.019 20 5 GGBDRN CN(c1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1F)C1CCCCC1 ZINC000163055785 1424932407 /nfs/dbraw/zinc/93/24/07/1424932407.db2.gz QGYVFXFQXIASNL-UHFFFAOYSA-N 0 0 375.404 3.489 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000163060970 1424933586 /nfs/dbraw/zinc/93/35/86/1424933586.db2.gz RLLGNPPVGOTQCZ-KRWDZBQOSA-N 0 0 388.395 3.396 20 5 GGBDRN C[C@H](c1cccnc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163068713 1424934571 /nfs/dbraw/zinc/93/45/71/1424934571.db2.gz PJXORICDIYPDSD-SNVBAGLBSA-N 0 0 389.355 3.390 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCSC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000163122554 1424945368 /nfs/dbraw/zinc/94/53/68/1424945368.db2.gz MXUDBAPBYJXVHC-QGZVFWFLSA-N 0 0 385.445 3.158 20 5 GGBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000163167618 1424952625 /nfs/dbraw/zinc/95/26/25/1424952625.db2.gz OCVGXTCTGUIFOX-UHFFFAOYSA-N 0 0 398.394 3.471 20 5 GGBDRN C[C@@](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)(C(N)=O)c1cccc(Cl)c1 ZINC000163167932 1424952681 /nfs/dbraw/zinc/95/26/81/1424952681.db2.gz QMULICYYSRXMQC-INIZCTEOSA-N 0 0 382.203 3.032 20 5 GGBDRN Cc1ccc([C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)N2CCOCC2)cc1 ZINC000163181587 1424955142 /nfs/dbraw/zinc/95/51/42/1424955142.db2.gz CLPPENTUSVTYOH-HXUWFJFHSA-N 0 0 398.463 3.407 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cccc(COC2CCCCC2)c1 ZINC000163194015 1424956758 /nfs/dbraw/zinc/95/67/58/1424956758.db2.gz BVALSKXQZQKNGR-UHFFFAOYSA-N 0 0 385.420 3.245 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@](C)(C(N)=O)c2cccc(Cl)c2)c1 ZINC000163223457 1424962462 /nfs/dbraw/zinc/96/24/62/1424962462.db2.gz HBRNRIVQIJNDIN-KRWDZBQOSA-N 0 0 393.852 3.101 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000163267456 1424969646 /nfs/dbraw/zinc/96/96/46/1424969646.db2.gz GXTMAPBACJYPIT-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN O=C(c1ccc(F)c(F)c1)N1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163277038 1424971592 /nfs/dbraw/zinc/97/15/92/1424971592.db2.gz USBLTQRVNHKYLP-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN CCc1ccc(OCC(=O)c2cc3c(s2)CCN(C(C)=O)C3)c([N+](=O)[O-])c1 ZINC000163277932 1424972291 /nfs/dbraw/zinc/97/22/91/1424972291.db2.gz PNNBJMPADQVIPE-UHFFFAOYSA-N 0 0 388.445 3.385 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CCN(Cc2cn3ccccc3n2)CC1 ZINC000163285885 1424973711 /nfs/dbraw/zinc/97/37/11/1424973711.db2.gz JFWKAOVGAUGRRW-UHFFFAOYSA-N 0 0 385.855 3.214 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000163315158 1424978203 /nfs/dbraw/zinc/97/82/03/1424978203.db2.gz DFMLARNQFUBYEL-AEFFLSMTSA-N 0 0 390.461 3.356 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)c1C ZINC000163337277 1424981422 /nfs/dbraw/zinc/98/14/22/1424981422.db2.gz PFFZNNNPTYDMFF-AEFFLSMTSA-N 0 0 390.461 3.410 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000163346435 1424982712 /nfs/dbraw/zinc/98/27/12/1424982712.db2.gz NIXXPLLWKODMBV-XJKSGUPXSA-N 0 0 396.852 3.447 20 5 GGBDRN CC(C)c1cc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)on1 ZINC000163362173 1424984699 /nfs/dbraw/zinc/98/46/99/1424984699.db2.gz AUBNUPZCILKSFC-UHFFFAOYSA-N 0 0 393.343 3.204 20 5 GGBDRN CCOC[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000163360440 1424984901 /nfs/dbraw/zinc/98/49/01/1424984901.db2.gz KXEUPXHXEJRZLP-LLVKDONJSA-N 0 0 396.387 3.051 20 5 GGBDRN Cc1c(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cnn1C1CCOCC1 ZINC000163362432 1424985383 /nfs/dbraw/zinc/98/53/83/1424985383.db2.gz PAJLHDFRDQOBCO-UHFFFAOYSA-N 0 0 386.452 3.204 20 5 GGBDRN CC[C@@H](CSC)N(C)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000180152793 1429764605 /nfs/dbraw/zinc/76/46/05/1429764605.db2.gz YIYUOXBRDYBSKY-VIFPVBQESA-N 0 0 397.316 3.119 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000163377619 1424988095 /nfs/dbraw/zinc/98/80/95/1424988095.db2.gz QNFLRRBRILLRGG-INIZCTEOSA-N 0 0 398.463 3.499 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccncc1 ZINC000163381436 1424989132 /nfs/dbraw/zinc/98/91/32/1424989132.db2.gz WJVPGVOWJBUSFG-CYBMUJFWSA-N 0 0 389.355 3.438 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000163381288 1424989199 /nfs/dbraw/zinc/98/91/99/1424989199.db2.gz WMPNMYMODCJIFT-WBVHZDCISA-N 0 0 376.434 3.102 20 5 GGBDRN CN(C)C(=O)c1ccnc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000163438595 1424998941 /nfs/dbraw/zinc/99/89/41/1424998941.db2.gz JYCPXIFGUNQJKY-UHFFFAOYSA-N 0 0 397.416 3.067 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000163447143 1425000685 /nfs/dbraw/zinc/00/06/85/1425000685.db2.gz LEZQGGAYDKZHOY-INIZCTEOSA-N 0 0 398.463 3.499 20 5 GGBDRN Cc1cc(C(=O)N2CCN(Cc3c(Cl)cccc3[N+](=O)[O-])CC2)c(C)o1 ZINC000163444635 1425000851 /nfs/dbraw/zinc/00/08/51/1425000851.db2.gz PDYAJHDVJRUMFW-UHFFFAOYSA-N 0 0 377.828 3.416 20 5 GGBDRN O=C(NCc1nc(C(F)(F)F)cs1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000163444960 1425001177 /nfs/dbraw/zinc/00/11/77/1425001177.db2.gz UPQCUQINMHTYJN-UHFFFAOYSA-N 0 0 397.338 3.186 20 5 GGBDRN CN(CCC1CCOCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163457925 1425002448 /nfs/dbraw/zinc/00/24/48/1425002448.db2.gz KPXZMFNCSMXFLD-UHFFFAOYSA-N 0 0 396.387 3.051 20 5 GGBDRN CC(C)CO[C@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000163467490 1425003722 /nfs/dbraw/zinc/00/37/22/1425003722.db2.gz NWJGZZUKDSHTTR-LBPRGKRZSA-N 0 0 396.387 3.049 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000163510888 1425010088 /nfs/dbraw/zinc/01/00/88/1425010088.db2.gz AYUSVRHOPOSLPU-QGZVFWFLSA-N 0 0 377.466 3.335 20 5 GGBDRN C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)c2)C1 ZINC000163582926 1425021161 /nfs/dbraw/zinc/02/11/61/1425021161.db2.gz YXYKWSGETLNILY-CRAIPNDOSA-N 0 0 399.447 3.491 20 5 GGBDRN C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)c2)C1 ZINC000163582716 1425021181 /nfs/dbraw/zinc/02/11/81/1425021181.db2.gz YXYKWSGETLNILY-QAPCUYQASA-N 0 0 399.447 3.491 20 5 GGBDRN COCCOc1ccc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000163598629 1425022558 /nfs/dbraw/zinc/02/25/58/1425022558.db2.gz UQVJAPKLMMYLTH-UHFFFAOYSA-N 0 0 383.408 3.028 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NC1CCN(c2ccc(C(C)(C)C)cc2)CC1 ZINC000163603218 1425023349 /nfs/dbraw/zinc/02/33/49/1425023349.db2.gz SFPVCTNEBSPZCX-UHFFFAOYSA-N 0 0 385.468 3.025 20 5 GGBDRN Cc1nnc(-c2cccc(C(=O)OCCN(C)c3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000163619854 1425025433 /nfs/dbraw/zinc/02/54/33/1425025433.db2.gz GONAVNRFLNXFBH-UHFFFAOYSA-N 0 0 382.376 3.246 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cnc1Cl ZINC000163633479 1425026986 /nfs/dbraw/zinc/02/69/86/1425026986.db2.gz XVFPRMPYICKIQE-UHFFFAOYSA-N 0 0 381.841 3.305 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000163637169 1425027837 /nfs/dbraw/zinc/02/78/37/1425027837.db2.gz KCWKDCRAPPOOCM-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN COc1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1Cl ZINC000163649980 1425029212 /nfs/dbraw/zinc/02/92/12/1425029212.db2.gz PGDCENOQTQCUBT-UHFFFAOYSA-N 0 0 384.175 3.487 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000163649069 1425029364 /nfs/dbraw/zinc/02/93/64/1425029364.db2.gz KVTZDGHXYHBJQC-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN COc1ccc([C@H](C)CCNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000163672912 1425032355 /nfs/dbraw/zinc/03/23/55/1425032355.db2.gz YCWYOGBUGZCEFG-OAHLLOKOSA-N 0 0 392.477 3.259 20 5 GGBDRN O=C(CCc1nc(-c2ccoc2)no1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163759791 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384.404 3.270 20 5 GGBDRN COc1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(OC)c1 ZINC000164331639 1425099784 /nfs/dbraw/zinc/09/97/84/1425099784.db2.gz AQXUYHQNIPGTQW-UHFFFAOYSA-N 0 0 385.420 3.486 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC([C@H](O)c2ccccc2)CC1 ZINC000164409448 1425108550 /nfs/dbraw/zinc/10/85/50/1425108550.db2.gz AXGAOUGLBMZEBM-FOIQADDNSA-N 0 0 383.448 3.367 20 5 GGBDRN O=C(NCC1CC[NH+](Cc2cccs2)CC1)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000164426977 1425110199 /nfs/dbraw/zinc/11/01/99/1425110199.db2.gz UVXWWYOTWOHKKX-UHFFFAOYSA-N 0 0 375.450 3.004 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc(Cl)ccc1OC1CCCC1 ZINC000164438429 1425112518 /nfs/dbraw/zinc/11/25/18/1425112518.db2.gz VSEVUWIVJJWQOW-UHFFFAOYSA-N 0 0 378.816 3.196 20 5 GGBDRN C[C@H]1CCN(C)c2ccccc2N1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000164440431 1425112779 /nfs/dbraw/zinc/11/27/79/1425112779.db2.gz HYHBDJZBRPIEHL-HNNXBMFYSA-N 0 0 389.477 3.202 20 5 GGBDRN 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ZINC000165698938 1425192550 /nfs/dbraw/zinc/19/25/50/1425192550.db2.gz VXWJRNOYMQPNOP-INIZCTEOSA-N 0 0 385.420 3.352 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCC1(c2ccc(F)cc2F)CC1 ZINC000165737875 1425194159 /nfs/dbraw/zinc/19/41/59/1425194159.db2.gz KQONUQNWZKYMQQ-UHFFFAOYSA-N 0 0 396.415 3.067 20 5 GGBDRN Cc1cc(NC(=O)c2c([N+](=O)[O-])cnn2C)n(-c2cccc(C(F)(F)F)c2)n1 ZINC000166082182 1425205589 /nfs/dbraw/zinc/20/55/89/1425205589.db2.gz ABGJIRFZNWHUSA-UHFFFAOYSA-N 0 0 394.313 3.094 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(-c2nnn[n-]2)c1 ZINC000826499848 1425205772 /nfs/dbraw/zinc/20/57/72/1425205772.db2.gz AKRGXFUJSNYZPW-QAPCUYQASA-N 0 0 378.436 3.276 20 5 GGBDRN C[C@@H]1OCCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000166276739 1425209347 /nfs/dbraw/zinc/20/93/47/1425209347.db2.gz GPCMKZLPMHFXNH-QWRGUYRKSA-N 0 0 375.347 3.051 20 5 GGBDRN Cc1cccc([C@H]2CCCN2C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000167131007 1425222451 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CHVTZIAJWPNBIG-HNNXBMFYSA-N 0 0 377.441 3.375 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@@H](N(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000170635294 1425269276 /nfs/dbraw/zinc/26/92/76/1425269276.db2.gz CHVTZIAJWPNBIG-OAHLLOKOSA-N 0 0 377.441 3.375 20 5 GGBDRN O=C(Oc1ccccc1)N1CCCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000170636887 1425269677 /nfs/dbraw/zinc/26/96/77/1425269677.db2.gz INQXRNJYPBPJGS-UHFFFAOYSA-N 0 0 375.406 3.003 20 5 GGBDRN Cn1c(Sc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)nnc1-c1cccs1 ZINC000170639371 1425271198 /nfs/dbraw/zinc/27/11/98/1425271198.db2.gz YYGGGUSUNRPSQL-UHFFFAOYSA-N 0 0 387.446 3.488 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(Nc3ccc(N4CCC(O)CC4)cc3)cc2N1 ZINC000170639644 1425271562 /nfs/dbraw/zinc/27/15/62/1425271562.db2.gz HZSYNOJSVVIKMV-UHFFFAOYSA-N 0 0 382.420 3.184 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000170641329 1425272415 /nfs/dbraw/zinc/27/24/15/1425272415.db2.gz AIEIJHDYLTUEBL-NSHDSACASA-N 0 0 381.458 3.140 20 5 GGBDRN 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ZINC000170683318 1425296028 /nfs/dbraw/zinc/29/60/28/1425296028.db2.gz MKVOYVGUCKKTTD-UHFFFAOYSA-N 0 0 385.405 3.446 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(-c3cn4c(n3)CCCC4)cc2)c1[N+](=O)[O-] ZINC000170694841 1425304815 /nfs/dbraw/zinc/30/48/15/1425304815.db2.gz QCICUQOUZXCIQV-UHFFFAOYSA-N 0 0 380.408 3.332 20 5 GGBDRN CC(C)[C@@H](CNC(=O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000170698621 1425305729 /nfs/dbraw/zinc/30/57/29/1425305729.db2.gz FQNYIGGFLDSNQZ-LJQANCHMSA-N 0 0 393.447 3.409 20 5 GGBDRN Cc1cccc(C2(CNC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)CCCC2)c1 ZINC000170709103 1425311588 /nfs/dbraw/zinc/31/15/88/1425311588.db2.gz URIPBSIMTPXFNC-UHFFFAOYSA-N 0 0 381.432 3.470 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000170720278 1425316638 /nfs/dbraw/zinc/31/66/38/1425316638.db2.gz JFRFZCCOXHLAMI-KRWDZBQOSA-N 0 0 385.420 3.477 20 5 GGBDRN CC(=O)[C@@H]1CC(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)=NN1c1ccccc1 ZINC000170744596 1425325307 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CC(=O)N1CCC(CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000170894264 1425383407 /nfs/dbraw/zinc/38/34/07/1425383407.db2.gz XADFGPKDYICDEH-UHFFFAOYSA-N 0 0 396.447 3.327 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@H](c2ccccc2)c2ccc3[nH]cnc3c2)c1[N+](=O)[O-] ZINC000170921799 1425394740 /nfs/dbraw/zinc/39/47/40/1425394740.db2.gz QRSVZURTMXUHST-QGZVFWFLSA-N 0 0 390.403 3.032 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NCc3cccc(CO)c3)cc2[N+](=O)[O-])CC1 ZINC000170925340 1425395540 /nfs/dbraw/zinc/39/55/40/1425395540.db2.gz CLEQJFKTKJFYJB-UHFFFAOYSA-N 0 0 383.448 3.253 20 5 GGBDRN CCCCN(C)c1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000170957881 1425415851 /nfs/dbraw/zinc/41/58/51/1425415851.db2.gz SIJMYJLDRUNCGQ-UHFFFAOYSA-N 0 0 398.463 3.428 20 5 GGBDRN C[C@H](NC(=O)c1sccc1S(=O)(=O)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000170989964 1425425532 /nfs/dbraw/zinc/42/55/32/1425425532.db2.gz CYWRUTBBLAQFHL-QMMMGPOBSA-N 0 0 390.389 3.144 20 5 GGBDRN O=C(OCCc1ccc([N+](=O)[O-])cc1)c1sccc1S(=O)(=O)C(F)F ZINC000170996219 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1425600787 /nfs/dbraw/zinc/60/07/87/1425600787.db2.gz XUXABEFCZUWESN-UHFFFAOYSA-N 0 0 394.431 3.071 20 5 GGBDRN COc1ccc(NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c(C)c1 ZINC000171305335 1425605590 /nfs/dbraw/zinc/60/55/90/1425605590.db2.gz CKTQOTLCLAOPNE-UHFFFAOYSA-N 0 0 394.387 3.018 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n(-c2ccccn2)n1 ZINC000171310123 1425608832 /nfs/dbraw/zinc/60/88/32/1425608832.db2.gz OJHJPUHBHKZDMU-UHFFFAOYSA-N 0 0 378.392 3.311 20 5 GGBDRN Cc1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1-n1cnnn1 ZINC000171369287 1425644492 /nfs/dbraw/zinc/64/44/92/1425644492.db2.gz HDCUYMAGFTUJBH-UHFFFAOYSA-N 0 0 395.423 3.321 20 5 GGBDRN CCc1n[nH]c(C(=O)NC[C@H](c2cccc(Cl)c2)N2CCCC2)c1[N+](=O)[O-] ZINC000171371346 1425645263 /nfs/dbraw/zinc/64/52/63/1425645263.db2.gz BNGMORFGAHTBKO-OAHLLOKOSA-N 0 0 391.859 3.101 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCCO2)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000171381649 1425651028 /nfs/dbraw/zinc/65/10/28/1425651028.db2.gz SILZXULOGAEHDP-UHFFFAOYSA-N 0 0 382.420 3.274 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[C@H](C)NC(=O)C1CCCC1 ZINC000171394677 1425660028 /nfs/dbraw/zinc/66/00/28/1425660028.db2.gz WBUQMODCMPHPGE-HNNXBMFYSA-N 0 0 375.469 3.417 20 5 GGBDRN O=C(NC[C@@](O)(c1ccccc1)C(F)(F)F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000171395568 1425660514 /nfs/dbraw/zinc/66/05/14/1425660514.db2.gz VAYKSSOBWKISEO-OAHLLOKOSA-N 0 0 388.729 3.428 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(OCCC(C)C)c(OC)c2)c1[N+](=O)[O-] ZINC000171399859 1425662292 /nfs/dbraw/zinc/66/22/92/1425662292.db2.gz HDXJVVWPIHFXFD-UHFFFAOYSA-N 0 0 390.440 3.244 20 5 GGBDRN O=C(c1cnc(-c2ccccn2)s1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000171412236 1425668159 /nfs/dbraw/zinc/66/81/59/1425668159.db2.gz IQMPDDLLSKGOIZ-UHFFFAOYSA-N 0 0 395.444 3.076 20 5 GGBDRN Cc1ccc(CN(C)C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000171421508 1425671288 /nfs/dbraw/zinc/67/12/88/1425671288.db2.gz DACNYUWBRKOVID-FQEVSTJZSA-N 0 0 395.459 3.475 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](c2ccccc2)c2ccncc2)c(C)c1[N+](=O)[O-] ZINC000171423806 1425672108 /nfs/dbraw/zinc/67/21/08/1425672108.db2.gz ZXPMLQRXUZKZNF-LJQANCHMSA-N 0 0 379.420 3.099 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Oc2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000171423136 1425672237 /nfs/dbraw/zinc/67/22/37/1425672237.db2.gz SFJYVVLMRDACQW-INIZCTEOSA-N 0 0 390.342 3.392 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)c(C)c1[N+](=O)[O-] ZINC000171441311 1425680370 /nfs/dbraw/zinc/68/03/70/1425680370.db2.gz SMNVMCWTOKEYRS-INIZCTEOSA-N 0 0 398.423 3.165 20 5 GGBDRN COc1cccc(C2CCN(C(=O)CCn3nc(C)c([N+](=O)[O-])c3C)CC2)c1 ZINC000171445062 1425682217 /nfs/dbraw/zinc/68/22/17/1425682217.db2.gz XRNSWBPCIPQLCW-UHFFFAOYSA-N 0 0 386.452 3.213 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000171455169 1425685391 /nfs/dbraw/zinc/68/53/91/1425685391.db2.gz UTQYKBKWDKGWFE-UXHICEINSA-N 0 0 392.415 3.431 20 5 GGBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000171457438 1425687184 /nfs/dbraw/zinc/68/71/84/1425687184.db2.gz HDEINXWQNACBGP-WOJBJXKFSA-N 0 0 392.415 3.431 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000171457434 1425687399 /nfs/dbraw/zinc/68/73/99/1425687399.db2.gz HDEINXWQNACBGP-UXHICEINSA-N 0 0 392.415 3.431 20 5 GGBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000171457151 1425687508 /nfs/dbraw/zinc/68/75/08/1425687508.db2.gz LRWWUPDGGQLQKR-WOJBJXKFSA-N 0 0 392.415 3.431 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000171464171 1425690576 /nfs/dbraw/zinc/69/05/76/1425690576.db2.gz QKQFCNLANJNQHI-ZWKOTPCHSA-N 0 0 385.376 3.462 20 5 GGBDRN Cc1c(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000171464459 1425690773 /nfs/dbraw/zinc/69/07/73/1425690773.db2.gz GZRVEAILAOEQPW-ROUUACIJSA-N 0 0 385.376 3.462 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](c2nccs2)c2ccccc2)cc1[N+](=O)[O-] ZINC000171473360 1425695093 /nfs/dbraw/zinc/69/50/93/1425695093.db2.gz MTDOXRVVMPCYRP-MRXNPFEDSA-N 0 0 396.428 3.204 20 5 GGBDRN C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000171474636 1425696044 /nfs/dbraw/zinc/69/60/44/1425696044.db2.gz BBZGLGWNCWRCIQ-VOJFVSQTSA-N 0 0 380.360 3.152 20 5 GGBDRN Cc1c(C(=O)N2CCc3ccccc3[C@@H]2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000171507237 1425708546 /nfs/dbraw/zinc/70/85/46/1425708546.db2.gz DPDYYSUEDSWCDP-ZDUSSCGKSA-N 0 0 377.404 3.243 20 5 GGBDRN CN(C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1)C(=O)OC(C)(C)C ZINC000171524779 1425716336 /nfs/dbraw/zinc/71/63/36/1425716336.db2.gz AMWBDIYAEKITDD-LBPRGKRZSA-N 0 0 381.404 3.063 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CN(C)C(=O)OC(C)(C)C)C1 ZINC000171525332 1425716799 /nfs/dbraw/zinc/71/67/99/1425716799.db2.gz NADVUTJCZIWGMD-CQSZACIVSA-N 0 0 377.441 3.232 20 5 GGBDRN CN(C[C@H]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000171525382 1425717053 /nfs/dbraw/zinc/71/70/53/1425717053.db2.gz HAKAIZCDIBHNEH-GFCCVEGCSA-N 0 0 381.404 3.063 20 5 GGBDRN O=C([C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CCCc2ccccc2C1 ZINC000171529556 1425718742 /nfs/dbraw/zinc/71/87/42/1425718742.db2.gz CAWUMZBPKXKDLI-MRXNPFEDSA-N 0 0 397.406 3.062 20 5 GGBDRN C[C@@H](NC(=O)C[C@@H](C)S(=O)(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000171545930 1425728421 /nfs/dbraw/zinc/72/84/21/1425728421.db2.gz JPOGQYDITNFVMM-CHWSQXEVSA-N 0 0 394.424 3.164 20 5 GGBDRN COC(=O)CCc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000171549884 1425730367 /nfs/dbraw/zinc/73/03/67/1425730367.db2.gz XKCPYHWSTCKHNT-UHFFFAOYSA-N 0 0 394.387 3.138 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3c(c2)CCC(=O)N3C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000171559544 1425735498 /nfs/dbraw/zinc/73/54/98/1425735498.db2.gz DZGBWQQGABHBJY-UHFFFAOYSA-N 0 0 398.375 3.281 20 5 GGBDRN CCCN(C(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000171561842 1425736450 /nfs/dbraw/zinc/73/64/50/1425736450.db2.gz BYGRUTRFQSHSPS-MRXNPFEDSA-N 0 0 377.441 3.456 20 5 GGBDRN CC(=O)c1ccc(N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000171563595 1425738117 /nfs/dbraw/zinc/73/81/17/1425738117.db2.gz ZQSORZIGSVQSPJ-AWEZNQCLSA-N 0 0 377.441 3.491 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3cccc(-c4nnn[n-]4)c3)o2)cc1 ZINC000738359727 1425745201 /nfs/dbraw/zinc/74/52/01/1425745201.db2.gz MVSDBCISRJHAER-UHFFFAOYSA-N 0 0 376.376 3.325 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)c1 ZINC000171586142 1425746197 /nfs/dbraw/zinc/74/61/97/1425746197.db2.gz JZOXCGQHCCOYMT-CQSZACIVSA-N 0 0 387.411 3.262 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000171587072 1425746971 /nfs/dbraw/zinc/74/69/71/1425746971.db2.gz WSTZTUREOOCAJO-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)c1 ZINC000171587464 1425747790 /nfs/dbraw/zinc/74/77/90/1425747790.db2.gz VLWMOGHPJVTTEU-ZDUSSCGKSA-N 0 0 375.450 3.184 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000171590207 1425750899 /nfs/dbraw/zinc/75/08/99/1425750899.db2.gz LFQGGZRADNXBNA-INIZCTEOSA-N 0 0 383.448 3.051 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000171590520 1425751851 /nfs/dbraw/zinc/75/18/51/1425751851.db2.gz VWXAGCSKSOABRI-CYBMUJFWSA-N 0 0 375.450 3.184 20 5 GGBDRN COc1ccc([C@@H]2Nc3ccccc3C(=O)N2C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000171603738 1425756546 /nfs/dbraw/zinc/75/65/46/1425756546.db2.gz SEXUXRSBHYMWFR-IFXJQAMLSA-N 0 0 383.404 3.349 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@H]1CSCN1C(=O)C(C)(C)C ZINC000171629918 1425765199 /nfs/dbraw/zinc/76/51/99/1425765199.db2.gz YOZXXPOXRUANIR-AWEZNQCLSA-N 0 0 399.900 3.154 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000171669730 1425783393 /nfs/dbraw/zinc/78/33/93/1425783393.db2.gz FUMQXVRDYSIAET-GFCCVEGCSA-N 0 0 383.832 3.378 20 5 GGBDRN CCN1C(=S)N=NC1CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000171672079 1425784230 /nfs/dbraw/zinc/78/42/30/1425784230.db2.gz QBSKXPGWBOPUBB-UHFFFAOYSA-N 0 0 377.473 3.261 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000171713605 1425800416 /nfs/dbraw/zinc/80/04/16/1425800416.db2.gz AUSYTOCEROGGHK-INIZCTEOSA-N 0 0 389.458 3.428 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000171713204 1425800500 /nfs/dbraw/zinc/80/05/00/1425800500.db2.gz LKJNSSZIULTAML-INIZCTEOSA-N 0 0 389.458 3.428 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2nccs2)c2ccccc2)c(F)c1 ZINC000171713172 1425800652 /nfs/dbraw/zinc/80/06/52/1425800652.db2.gz SVPGGYVLCKAMDH-OAHLLOKOSA-N 0 0 393.421 3.258 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000171713205 1425800715 /nfs/dbraw/zinc/80/07/15/1425800715.db2.gz LKJNSSZIULTAML-MRXNPFEDSA-N 0 0 389.458 3.428 20 5 GGBDRN Cc1cc(C)cc([C@@H](C)NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c1 ZINC000171719525 1425802815 /nfs/dbraw/zinc/80/28/15/1425802815.db2.gz FQBBBLFKOLDFRD-CYBMUJFWSA-N 0 0 376.434 3.106 20 5 GGBDRN O=C(Nc1ccccc1)NC1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000171726728 1425804709 /nfs/dbraw/zinc/80/47/09/1425804709.db2.gz VNDYKGHNSXYWHU-UHFFFAOYSA-N 0 0 397.435 3.091 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000171736927 1425807354 /nfs/dbraw/zinc/80/73/54/1425807354.db2.gz FTUZAPAWZXLTQN-OAHLLOKOSA-N 0 0 375.356 3.066 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1nnc(Cc2ccccc2F)s1 ZINC000171740272 1425808623 /nfs/dbraw/zinc/80/86/23/1425808623.db2.gz UKRXLRWHLOVEKP-UHFFFAOYSA-N 0 0 387.396 3.498 20 5 GGBDRN CC(C)CCOC1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000171758422 1425813080 /nfs/dbraw/zinc/81/30/80/1425813080.db2.gz NMWFQXDVUPWHRS-LJQANCHMSA-N 0 0 375.469 3.227 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc3nc(N4CCCC4)sc3c2)c1[N+](=O)[O-] ZINC000171758512 1425813177 /nfs/dbraw/zinc/81/31/77/1425813177.db2.gz YYLVSBYMGXQTFV-UHFFFAOYSA-N 0 0 386.437 3.343 20 5 GGBDRN O=C1[C@@H](N2CCC(Nc3ccc(F)cc3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000171758914 1425813189 /nfs/dbraw/zinc/81/31/89/1425813189.db2.gz LXEQBXRKKVEKGH-FQEVSTJZSA-N 0 0 398.438 3.416 20 5 GGBDRN CC(C)N(C)c1cccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000171767070 1425814935 /nfs/dbraw/zinc/81/49/35/1425814935.db2.gz ZDGLKJBVLAJDEG-UHFFFAOYSA-N 0 0 384.436 3.037 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H](O)c1ccc2ccccc2c1 ZINC000171768026 1425815301 /nfs/dbraw/zinc/81/53/01/1425815301.db2.gz QIOKPEPXVZNZRV-LJQANCHMSA-N 0 0 395.415 3.289 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2ccccc2)c2cccnc2)c(F)c1 ZINC000171768911 1425815495 /nfs/dbraw/zinc/81/54/95/1425815495.db2.gz YZFTVPBABZSCHD-SFHVURJKSA-N 0 0 387.392 3.197 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](c1ccccc1)c1cccnc1 ZINC000171768788 1425815708 /nfs/dbraw/zinc/81/57/08/1425815708.db2.gz XPBRFQHYKRGWLR-LJQANCHMSA-N 0 0 383.429 3.366 20 5 GGBDRN CCS(=O)(=O)c1ccc(Cl)c(C(=O)OCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000171770792 1425815933 /nfs/dbraw/zinc/81/59/33/1425815933.db2.gz GLPRBJOOFBCGBY-UHFFFAOYSA-N 0 0 397.836 3.441 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-] ZINC000171769313 1425815993 /nfs/dbraw/zinc/81/59/93/1425815993.db2.gz BKXLCNBBLINAEV-IBGZPJMESA-N 0 0 383.429 3.366 20 5 GGBDRN CCN1CCN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccccc21 ZINC000171778315 1425818191 /nfs/dbraw/zinc/81/81/91/1425818191.db2.gz YMEUYLFOXDPZLE-UHFFFAOYSA-N 0 0 381.841 3.283 20 5 GGBDRN Cc1cc(=O)c(-c2nc(-c3ccccc3)no2)nn1-c1ccccc1[N+](=O)[O-] ZINC000171777933 1425818290 /nfs/dbraw/zinc/81/82/90/1425818290.db2.gz TYBDZEARMKORGV-UHFFFAOYSA-N 0 0 375.344 3.166 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCCC(=O)N1Cc2ccccc2C1 ZINC000171779971 1425818580 /nfs/dbraw/zinc/81/85/80/1425818580.db2.gz MQTPUCFRWVHMQL-UHFFFAOYSA-N 0 0 396.447 3.059 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCCC(=O)N1CCc2ccccc21 ZINC000171782129 1425819132 /nfs/dbraw/zinc/81/91/32/1425819132.db2.gz PIWFYWJYQJJUEM-UHFFFAOYSA-N 0 0 396.447 3.106 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000171786567 1425820297 /nfs/dbraw/zinc/82/02/97/1425820297.db2.gz KNJXMISHAJVFRS-CQSZACIVSA-N 0 0 399.403 3.484 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2csc([N+](=O)[O-])c2)cc1C ZINC000171795998 1425822739 /nfs/dbraw/zinc/82/27/39/1425822739.db2.gz ZXLZULVIHGLAMH-AWEZNQCLSA-N 0 0 391.474 3.427 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC[C@H](c3nc4cc(C)ccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000171806704 1425825341 /nfs/dbraw/zinc/82/53/41/1425825341.db2.gz LDFMLHRMPFGQSP-LBPRGKRZSA-N 0 0 382.424 3.085 20 5 GGBDRN CCc1n[nH]c(C(=O)NC[C@H](C)CSc2ccccc2OC)c1[N+](=O)[O-] ZINC000171809645 1425826274 /nfs/dbraw/zinc/82/62/74/1425826274.db2.gz ICBNISUCXHDLDY-NSHDSACASA-N 0 0 378.454 3.047 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000171822382 1425829553 /nfs/dbraw/zinc/82/95/53/1425829553.db2.gz YBKKGLVGBXTRPW-UHFFFAOYSA-N 0 0 390.783 3.119 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000171826675 1425829745 /nfs/dbraw/zinc/82/97/45/1425829745.db2.gz COSCIOSRJRJFIX-QGZVFWFLSA-N 0 0 392.843 3.120 20 5 GGBDRN COCCOc1ccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000171832970 1425831521 /nfs/dbraw/zinc/83/15/21/1425831521.db2.gz RZNUXJAVPOLITC-UHFFFAOYSA-N 0 0 396.403 3.366 20 5 GGBDRN O=C(NCCCC1CCCC1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171835568 1425832446 /nfs/dbraw/zinc/83/24/46/1425832446.db2.gz FYJNJFPBSYSEBU-CQSZACIVSA-N 0 0 379.482 3.348 20 5 GGBDRN COc1ccc(S(=O)(=O)NC2(c3nc(C)cs3)CCCC2)c([N+](=O)[O-])c1 ZINC000171838867 1425832709 /nfs/dbraw/zinc/83/27/09/1425832709.db2.gz YTMDWSJKBNAOSA-UHFFFAOYSA-N 0 0 397.478 3.116 20 5 GGBDRN O=C(Oc1cccc2ncccc21)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171843457 1425833195 /nfs/dbraw/zinc/83/31/95/1425833195.db2.gz QADHFLYVBLAACJ-CQSZACIVSA-N 0 0 397.412 3.415 20 5 GGBDRN C[C@@H](Cc1cccs1)NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171842133 1425833394 /nfs/dbraw/zinc/83/33/94/1425833394.db2.gz IGHMGJTVJWGGAB-WCQYABFASA-N 0 0 393.490 3.070 20 5 GGBDRN C[C@H](O)c1ccc(CNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])cc1 ZINC000171861241 1425837108 /nfs/dbraw/zinc/83/71/08/1425837108.db2.gz GUHNVOKZIHBEFY-JTQLQIEISA-N 0 0 386.376 3.257 20 5 GGBDRN O=C(Nc1nc(-c2ccc[nH]2)cs1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171860569 1425837292 /nfs/dbraw/zinc/83/72/92/1425837292.db2.gz NUTLMBDDLPXABD-UHFFFAOYSA-N 0 0 381.373 3.140 20 5 GGBDRN CN(CCCOc1ccc(F)cc1)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171863358 1425837551 /nfs/dbraw/zinc/83/75/51/1425837551.db2.gz APLWUQHPNZPAHU-UHFFFAOYSA-N 0 0 399.378 3.117 20 5 GGBDRN O=C(Nc1ccc(OC2CCCC2)nc1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171869269 1425839161 /nfs/dbraw/zinc/83/91/61/1425839161.db2.gz WSPLTEPXUCIPBQ-UHFFFAOYSA-N 0 0 394.387 3.405 20 5 GGBDRN COc1cccc([C@@H](O)CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000171874854 1425840318 /nfs/dbraw/zinc/84/03/18/1425840318.db2.gz ZPAKIFSLQLYQDD-KRWDZBQOSA-N 0 0 399.428 3.190 20 5 GGBDRN CCN1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc21 ZINC000171892779 1425845801 /nfs/dbraw/zinc/84/58/01/1425845801.db2.gz LMZGQUOSLSVJLE-UHFFFAOYSA-N 0 0 377.404 3.267 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCN(CC)c3ccccc32)cc1OC ZINC000171892947 1425845856 /nfs/dbraw/zinc/84/58/56/1425845856.db2.gz DMTGMCINPJWFBN-UHFFFAOYSA-N 0 0 385.420 3.489 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000171913686 1425850746 /nfs/dbraw/zinc/85/07/46/1425850746.db2.gz FYDVNHOWJPDMBG-KRWDZBQOSA-N 0 0 390.823 3.495 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)Oc1ccc(F)cc1Cl ZINC000171927618 1425855103 /nfs/dbraw/zinc/85/51/03/1425855103.db2.gz UUPGOQBIWZNRGO-SNVBAGLBSA-N 0 0 382.775 3.480 20 5 GGBDRN Cc1ccccc1-n1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000171934676 1425855936 /nfs/dbraw/zinc/85/59/36/1425855936.db2.gz MYRZYCGIKXOKBL-UHFFFAOYSA-N 0 0 391.431 3.051 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NC[C@](O)(c3ccccc3)C(F)(F)F)cc2N1 ZINC000171940977 1425857451 /nfs/dbraw/zinc/85/74/51/1425857451.db2.gz RRBDDLXGWQRVON-KRWDZBQOSA-N 0 0 395.337 3.342 20 5 GGBDRN COC(=O)[C@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c2ccccc21 ZINC000171938588 1425857623 /nfs/dbraw/zinc/85/76/23/1425857623.db2.gz CGXZKYSOCJALQY-INIZCTEOSA-N 0 0 395.415 3.112 20 5 GGBDRN COC(=O)[C@@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c2ccccc21 ZINC000171938657 1425857641 /nfs/dbraw/zinc/85/76/41/1425857641.db2.gz IMAHVSCLEXURHK-OAHLLOKOSA-N 0 0 381.388 3.086 20 5 GGBDRN Cc1ccccc1[C@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C(C)C ZINC000171949196 1425859670 /nfs/dbraw/zinc/85/96/70/1425859670.db2.gz RQFMEDQGGDLIEE-GOSISDBHSA-N 0 0 390.461 3.434 20 5 GGBDRN CN(CC1CCCCC1)C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171954802 1425860272 /nfs/dbraw/zinc/86/02/72/1425860272.db2.gz AFZLSWMSVSJCRV-CQSZACIVSA-N 0 0 379.482 3.300 20 5 GGBDRN CN(CC1CCCCC1)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171954798 1425860533 /nfs/dbraw/zinc/86/05/33/1425860533.db2.gz AFZLSWMSVSJCRV-AWEZNQCLSA-N 0 0 379.482 3.300 20 5 GGBDRN Cc1c([C@@H](C)Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])cnn1C ZINC000171972992 1425865602 /nfs/dbraw/zinc/86/56/02/1425865602.db2.gz GALRZJRRXQQPOM-MRVPVSSYSA-N 0 0 392.359 3.103 20 5 GGBDRN Cc1c(C(=O)N(C)CCc2ccc(Cl)cc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000172007916 1425872507 /nfs/dbraw/zinc/87/25/07/1425872507.db2.gz MWBBECCECYMVAA-UHFFFAOYSA-N 0 0 399.838 3.452 20 5 GGBDRN CN(CCc1ccc(Cl)cc1)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000172007898 1425872543 /nfs/dbraw/zinc/87/25/43/1425872543.db2.gz YJZNWJKNDMIUNN-UHFFFAOYSA-N 0 0 385.811 3.144 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)ccc12 ZINC000172015012 1425874034 /nfs/dbraw/zinc/87/40/34/1425874034.db2.gz RNLVVPYPTVMFSF-UHFFFAOYSA-N 0 0 389.385 3.340 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000172016386 1425874613 /nfs/dbraw/zinc/87/46/13/1425874613.db2.gz NTGOYWKOHORXPB-UHFFFAOYSA-N 0 0 388.445 3.187 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000172016294 1425874740 /nfs/dbraw/zinc/87/47/40/1425874740.db2.gz NZTDSFQKAUZHGY-SFHVURJKSA-N 0 0 376.434 3.438 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC(OCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000172016067 1425874754 /nfs/dbraw/zinc/87/47/54/1425874754.db2.gz ZLOCLWZWYJOAGK-UHFFFAOYSA-N 0 0 390.461 3.273 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000172018304 1425875065 /nfs/dbraw/zinc/87/50/65/1425875065.db2.gz ZDTCWXWDRSJIPI-QGZVFWFLSA-N 0 0 396.852 3.319 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000172018584 1425875231 /nfs/dbraw/zinc/87/52/31/1425875231.db2.gz SAXDZQFZHMQQKV-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](c2nccs2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000172020536 1425875576 /nfs/dbraw/zinc/87/55/76/1425875576.db2.gz CFVNBOLKFLMWGC-INIZCTEOSA-N 0 0 389.458 3.428 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000172019890 1425875722 /nfs/dbraw/zinc/87/57/22/1425875722.db2.gz XKJYWWKHWUVXGM-ROUUACIJSA-N 0 0 376.434 3.102 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000172020273 1425875741 /nfs/dbraw/zinc/87/57/41/1425875741.db2.gz QVTQOUMHCWBFPK-QGZVFWFLSA-N 0 0 376.434 3.438 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](c3ccccc3)OC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000172020104 1425875802 /nfs/dbraw/zinc/87/58/02/1425875802.db2.gz KIPWBSMTMFCDJE-KSSFIOAISA-N 0 0 376.434 3.054 20 5 GGBDRN CCOc1ccc2c(c1)CN(S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1)CC2 ZINC000172019345 1425875838 /nfs/dbraw/zinc/87/58/38/1425875838.db2.gz NNUFSKSIYADHDX-UHFFFAOYSA-N 0 0 376.434 3.049 20 5 GGBDRN O=C1N[C@]2(CCc3ccccc3C2)C(=O)N1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172022352 1425876187 /nfs/dbraw/zinc/87/61/87/1425876187.db2.gz CIXXISMLCDWBTL-IBGZPJMESA-N 0 0 385.807 3.228 20 5 GGBDRN Cc1ccc(N2C(=O)C(=O)N(Cc3cc([N+](=O)[O-])ccc3Cl)C2=O)c(C)c1 ZINC000172023826 1425876240 /nfs/dbraw/zinc/87/62/40/1425876240.db2.gz IRIITKJFCWWSMC-UHFFFAOYSA-N 0 0 387.779 3.360 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000172025943 1425877217 /nfs/dbraw/zinc/87/72/17/1425877217.db2.gz XJDOXMVICONGSE-NSHDSACASA-N 0 0 377.372 3.312 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000172031371 1425878631 /nfs/dbraw/zinc/87/86/31/1425878631.db2.gz BSKAKKDLTYSAIV-UHFFFAOYSA-N 0 0 375.812 3.196 20 5 GGBDRN COc1cc(CCNC(=O)c2ccnc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000172037810 1425880173 /nfs/dbraw/zinc/88/01/73/1425880173.db2.gz WXMRGGLFMHCSRV-UHFFFAOYSA-N 0 0 381.388 3.133 20 5 GGBDRN Cc1ccc(-c2noc(CCCn3c4ccc([N+](=O)[O-])cc4oc3=O)n2)cc1 ZINC000172056370 1425884627 /nfs/dbraw/zinc/88/46/27/1425884627.db2.gz WCNFBPCQWWRKTC-UHFFFAOYSA-N 0 0 380.360 3.494 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CCCN(c2ccccc2)C1 ZINC000172063368 1425887114 /nfs/dbraw/zinc/88/71/14/1425887114.db2.gz UNYMBBULOULNGM-MRXNPFEDSA-N 0 0 384.436 3.072 20 5 GGBDRN O=C(CN1CCCCCCC1=O)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172080480 1425891834 /nfs/dbraw/zinc/89/18/34/1425891834.db2.gz YCXINKGAWGNRCM-UHFFFAOYSA-N 0 0 387.392 3.086 20 5 GGBDRN C[C@H](CCC1CCCCC1)NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000172085423 1425893586 /nfs/dbraw/zinc/89/35/86/1425893586.db2.gz HRZUHMADLGIJFE-CYBMUJFWSA-N 0 0 382.482 3.477 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000172087044 1425893990 /nfs/dbraw/zinc/89/39/90/1425893990.db2.gz KJQMFDZMGMRGTJ-AWEZNQCLSA-N 0 0 389.433 3.217 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2O3)cc1[N+](=O)[O-])c1ccccn1 ZINC000172100407 1425896115 /nfs/dbraw/zinc/89/61/15/1425896115.db2.gz SSPMFYWIACPTIS-JTYAGIKBSA-N 0 0 382.420 3.213 20 5 GGBDRN COc1cc(CCNC(=O)c2cc3cc(F)ccc3o2)c([N+](=O)[O-])cc1OC ZINC000172101351 1425896209 /nfs/dbraw/zinc/89/62/09/1425896209.db2.gz BJPXCSBGVXKBQE-UHFFFAOYSA-N 0 0 388.351 3.470 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1noc(C)n1 ZINC000172119152 1425902904 /nfs/dbraw/zinc/90/29/04/1425902904.db2.gz JGSSLHIQFCSRQC-MRXNPFEDSA-N 0 0 383.364 3.206 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](OCc2ccncc2)C1 ZINC000172124705 1425906386 /nfs/dbraw/zinc/90/63/86/1425906386.db2.gz YFVBYUWGMOYJRZ-INIZCTEOSA-N 0 0 375.812 3.003 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1ccc2c(c1)CCC2 ZINC000172129471 1425908630 /nfs/dbraw/zinc/90/86/30/1425908630.db2.gz KWITZYWHQZINBV-UHFFFAOYSA-N 0 0 387.399 3.027 20 5 GGBDRN CC(C)[C@H](C)N(CC(F)(F)F)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000172130098 1425908886 /nfs/dbraw/zinc/90/88/86/1425908886.db2.gz YLYCPTWOCBCXOA-JTQLQIEISA-N 0 0 396.387 3.047 20 5 GGBDRN CCc1ccc(OCC(=O)Nc2ccc(CN3CCOCC3)cc2)c([N+](=O)[O-])c1 ZINC000172134362 1425910475 /nfs/dbraw/zinc/91/04/75/1425910475.db2.gz JXRPQTRPUYJLPP-UHFFFAOYSA-N 0 0 399.447 3.007 20 5 GGBDRN CCc1ccc(COc2c([N+](=O)[O-])cc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000172160793 1425927376 /nfs/dbraw/zinc/92/73/76/1425927376.db2.gz NVLAZIODGFYKGF-UHFFFAOYSA-N 0 0 380.378 3.048 20 5 GGBDRN COc1ccc(OC)c2c1CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H]2O ZINC000172175210 1425933855 /nfs/dbraw/zinc/93/38/55/1425933855.db2.gz RNESWGGWQICOMN-OAHLLOKOSA-N 0 0 378.812 3.315 20 5 GGBDRN C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172178271 1425935127 /nfs/dbraw/zinc/93/51/27/1425935127.db2.gz OUMVXFMLTRKCCF-LLVKDONJSA-N 0 0 383.857 3.089 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)O[C@@H](c1ccc(Br)cc1)C1CC1 ZINC000172190702 1425939909 /nfs/dbraw/zinc/93/99/09/1425939909.db2.gz SHINWRXVPVLKHV-OAHLLOKOSA-N 0 0 380.198 3.248 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1c(F)cccc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000172218103 1425951622 /nfs/dbraw/zinc/95/16/22/1425951622.db2.gz JKXGPRPRQSWSIX-ZIAGYGMSSA-N 0 0 387.386 3.325 20 5 GGBDRN C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Oc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000820570268 1425959382 /nfs/dbraw/zinc/95/93/82/1425959382.db2.gz FTKCNVDWJLPWOI-CQSZACIVSA-N 0 0 394.435 3.379 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC(F)F ZINC000172236422 1425959569 /nfs/dbraw/zinc/95/95/69/1425959569.db2.gz MKOSZRLMULDCQY-LLVKDONJSA-N 0 0 393.346 3.321 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)c1csc([N+](=O)[O-])c1 ZINC000172243329 1425962523 /nfs/dbraw/zinc/96/25/23/1425962523.db2.gz WQFSIEZPBVFHLA-NSHDSACASA-N 0 0 383.376 3.266 20 5 GGBDRN COc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])c4cccnc34)C2=O)cc1 ZINC000172280920 1425978603 /nfs/dbraw/zinc/97/86/03/1425978603.db2.gz URABODVRFOVJGO-GOSISDBHSA-N 0 0 392.415 3.365 20 5 GGBDRN CC[C@H]1CCCN(C(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000172323198 1425998456 /nfs/dbraw/zinc/99/84/56/1425998456.db2.gz RWSXPXNSVSTGEC-AWEZNQCLSA-N 0 0 379.457 3.376 20 5 GGBDRN COc1cc(CCNC(=O)N2CCCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000172323202 1425998471 /nfs/dbraw/zinc/99/84/71/1425998471.db2.gz ZCNIARJVYXYGOE-OAHLLOKOSA-N 0 0 379.457 3.375 20 5 GGBDRN O=C(N[C@H]1CS(=O)(=O)c2ccccc21)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000172327226 1426000983 /nfs/dbraw/zinc/00/09/83/1426000983.db2.gz KOUUERUEJHHPJO-ZDUSSCGKSA-N 0 0 388.426 3.068 20 5 GGBDRN COc1cc(CCNC(=O)c2coc(-c3ccccc3)n2)c([N+](=O)[O-])cc1OC ZINC000172328230 1426001784 /nfs/dbraw/zinc/00/17/84/1426001784.db2.gz SOWXJKQZIKGNLR-UHFFFAOYSA-N 0 0 397.387 3.240 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC1(c2ccc(F)cc2)CCOCC1 ZINC000172332953 1426002820 /nfs/dbraw/zinc/00/28/20/1426002820.db2.gz KVVHPOWMOIZLIN-UHFFFAOYSA-N 0 0 394.424 3.027 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1(c2ccc(F)cc2)CCOCC1 ZINC000172332839 1426002944 /nfs/dbraw/zinc/00/29/44/1426002944.db2.gz ALJSGWAALJZRQC-UHFFFAOYSA-N 0 0 394.424 3.027 20 5 GGBDRN Cc1cc(S(=O)(=O)NC2(c3ccc(F)cc3)CCOCC2)ccc1[N+](=O)[O-] ZINC000172332833 1426002996 /nfs/dbraw/zinc/00/29/96/1426002996.db2.gz ZJMLFUMFNJCYTP-UHFFFAOYSA-N 0 0 394.424 3.027 20 5 GGBDRN Cc1cc(C)c(OCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000172332610 1426003009 /nfs/dbraw/zinc/00/30/09/1426003009.db2.gz NXGRSBOLGVEJAC-MRXNPFEDSA-N 0 0 384.436 3.007 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC1(c2ccc(F)cc2)CCOCC1 ZINC000172332727 1426003056 /nfs/dbraw/zinc/00/30/56/1426003056.db2.gz VPTYVSBTBGBJMK-UHFFFAOYSA-N 0 0 394.424 3.027 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc2n1 ZINC000172333231 1426003454 /nfs/dbraw/zinc/00/34/54/1426003454.db2.gz HOSWIMLNYNKFGP-AWEZNQCLSA-N 0 0 377.404 3.173 20 5 GGBDRN O=C(/C=C/c1ccc(Cl)s1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172333094 1426003463 /nfs/dbraw/zinc/00/34/63/1426003463.db2.gz ZNFYORXQIJGTAB-ZXCPCRMDSA-N 0 0 378.841 3.431 20 5 GGBDRN O=C(COc1cccc2ccccc21)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172333245 1426003594 /nfs/dbraw/zinc/00/35/94/1426003594.db2.gz PHXVQKYDEMFICV-MRXNPFEDSA-N 0 0 392.415 3.235 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cnc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000172356074 1426013180 /nfs/dbraw/zinc/01/31/80/1426013180.db2.gz HQEQZMORMFJXCW-MRVPVSSYSA-N 0 0 376.221 3.336 20 5 GGBDRN CCOC(=O)c1ccnc(NCCc2nc3ccccc3n2CC)c1[N+](=O)[O-] ZINC000172367436 1426016225 /nfs/dbraw/zinc/01/62/25/1426016225.db2.gz MTJFPQSBJAHNHN-UHFFFAOYSA-N 0 0 383.408 3.191 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(OCCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000172367293 1426016340 /nfs/dbraw/zinc/01/63/40/1426016340.db2.gz NNBYRNKZXVFPFS-UHFFFAOYSA-N 0 0 399.447 3.395 20 5 GGBDRN C[C@@H]1CSCCN1c1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000172373641 1426018364 /nfs/dbraw/zinc/01/83/64/1426018364.db2.gz SDARPYVXZBMEKZ-CYBMUJFWSA-N 0 0 393.490 3.337 20 5 GGBDRN C[C@@H](O)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000172402726 1426027726 /nfs/dbraw/zinc/02/77/26/1426027726.db2.gz GQMNKABTBLKEKZ-SNVBAGLBSA-N 0 0 379.210 3.341 20 5 GGBDRN CN(C)c1cccc(-c2nnc(SCc3cc(F)ccc3[N+](=O)[O-])n2N)c1 ZINC000172404173 1426027901 /nfs/dbraw/zinc/02/79/01/1426027901.db2.gz DVOROKDKARQKJO-UHFFFAOYSA-N 0 0 388.428 3.065 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CC(c3c(F)cccc3F)=NO2)c([N+](=O)[O-])c1 ZINC000172407703 1426029143 /nfs/dbraw/zinc/02/91/43/1426029143.db2.gz RXBVQCCYTJEVBX-HNNXBMFYSA-N 0 0 377.303 3.013 20 5 GGBDRN O=C(NCc1ccccc1CN1CCCC1=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000172410889 1426029666 /nfs/dbraw/zinc/02/96/66/1426029666.db2.gz ZYZMXYBRJZOUTR-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN CSc1nnnn1-c1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000172410946 1426029689 /nfs/dbraw/zinc/02/96/89/1426029689.db2.gz AUUCPFXVEMNDAR-UHFFFAOYSA-N 0 0 390.812 3.198 20 5 GGBDRN Cn1c(CC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 ZINC000172413822 1426031328 /nfs/dbraw/zinc/03/13/28/1426031328.db2.gz SKKIWCTXSGZJTK-UHFFFAOYSA-N 0 0 393.447 3.072 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172414840 1426031779 /nfs/dbraw/zinc/03/17/79/1426031779.db2.gz LBFIUEDTVGWMBW-AEFFLSMTSA-N 0 0 389.496 3.318 20 5 GGBDRN C[C@@H](NC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1)c1cccc([N+](=O)[O-])c1 ZINC000172414810 1426032064 /nfs/dbraw/zinc/03/20/64/1426032064.db2.gz CMSBVHPASZASFZ-HWPZZCPQSA-N 0 0 375.331 3.243 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CC(c2c(F)cccc2F)=NO1)c1cccc([N+](=O)[O-])c1 ZINC000172414813 1426032240 /nfs/dbraw/zinc/03/22/40/1426032240.db2.gz CMSBVHPASZASFZ-MGPLVRAMSA-N 0 0 375.331 3.243 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccccc1N1CCOCC1 ZINC000172415706 1426033345 /nfs/dbraw/zinc/03/33/45/1426033345.db2.gz ZIXYEPZWUTZKET-UHFFFAOYSA-N 0 0 383.448 3.184 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cccc(-c2nccn2C)c1 ZINC000172416194 1426033358 /nfs/dbraw/zinc/03/33/58/1426033358.db2.gz CBJGQHSMFGIFIF-UHFFFAOYSA-N 0 0 381.392 3.326 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172415975 1426033825 /nfs/dbraw/zinc/03/38/25/1426033825.db2.gz DKJVLAZIYPHSTI-KRWDZBQOSA-N 0 0 389.496 3.318 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])c1c(F)cccc1F ZINC000172420093 1426035539 /nfs/dbraw/zinc/03/55/39/1426035539.db2.gz YQCUYVBYCMVNPX-HNNXBMFYSA-N 0 0 389.358 3.030 20 5 GGBDRN O=C(c1ccc(OCC(F)(F)C(F)F)nc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172420716 1426035865 /nfs/dbraw/zinc/03/58/65/1426035865.db2.gz AQJVZWZXSQHDHO-UHFFFAOYSA-N 0 0 399.300 3.472 20 5 GGBDRN Cc1ccc(C(=O)N[C@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C(C)C)cc1 ZINC000172421196 1426036258 /nfs/dbraw/zinc/03/62/58/1426036258.db2.gz TZXXJBRPLFLPPZ-IBGZPJMESA-N 0 0 381.432 3.247 20 5 GGBDRN O=C(c1ccc(F)cc1)N1CCC[C@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000172422844 1426037279 /nfs/dbraw/zinc/03/72/79/1426037279.db2.gz KMZITYTZWVQCPH-HNNXBMFYSA-N 0 0 397.406 3.175 20 5 GGBDRN CC(C)Cn1nc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c2ccccc2c1=O ZINC000172423736 1426037992 /nfs/dbraw/zinc/03/79/92/1426037992.db2.gz FQMAQXBDNBXADX-UHFFFAOYSA-N 0 0 392.415 3.164 20 5 GGBDRN CSCc1nc2ccccc2n1CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424238 1426038460 /nfs/dbraw/zinc/03/84/60/1426038460.db2.gz HTKOTVDSDCHZBX-UHFFFAOYSA-N 0 0 382.445 3.397 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000172425673 1426039290 /nfs/dbraw/zinc/03/92/90/1426039290.db2.gz UATGUBCKUPGRAJ-HZPDHXFCSA-N 0 0 395.459 3.407 20 5 GGBDRN O=C(c1ccccc1)N1CCC[C@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000172425257 1426039361 /nfs/dbraw/zinc/03/93/61/1426039361.db2.gz YUFLSUGYILNHIV-INIZCTEOSA-N 0 0 379.416 3.036 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824658245 1426040111 /nfs/dbraw/zinc/04/01/11/1426040111.db2.gz VFHYNVAXAWICHL-GDBMZVCRSA-N 0 0 393.451 3.097 20 5 GGBDRN CN1CCCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc21 ZINC000172430392 1426041254 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HXSVHELBZHIHIW-LBPRGKRZSA-N 0 0 389.433 3.477 20 5 GGBDRN COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000172488917 1426057692 /nfs/dbraw/zinc/05/76/92/1426057692.db2.gz GOYNBKMPCREGNG-HNNXBMFYSA-N 0 0 380.832 3.357 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1ccc(F)cc1 ZINC000172496010 1426059813 /nfs/dbraw/zinc/05/98/13/1426059813.db2.gz XIJLGVARUMPKKN-GOSISDBHSA-N 0 0 375.400 3.089 20 5 GGBDRN COc1cc(CCNC(=O)C(C)(C)c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000172505783 1426063211 /nfs/dbraw/zinc/06/32/11/1426063211.db2.gz HQYAADGAQQFIRT-UHFFFAOYSA-N 0 0 390.411 3.388 20 5 GGBDRN Cc1cc(NC(=O)C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)no1 ZINC000172506123 1426063241 /nfs/dbraw/zinc/06/32/41/1426063241.db2.gz OIFYIVMMTRACQL-UHFFFAOYSA-N 0 0 392.799 3.036 20 5 GGBDRN C[C@H]1CCCN(C(=O)C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)C1 ZINC000172508419 1426064397 /nfs/dbraw/zinc/06/43/97/1426064397.db2.gz XQIGUVJONKYZNP-ZDUSSCGKSA-N 0 0 393.871 3.359 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2scnc2c1 ZINC000172522517 1426069909 /nfs/dbraw/zinc/06/99/09/1426069909.db2.gz VNCPJSWMWSOPPN-UHFFFAOYSA-N 0 0 398.444 3.282 20 5 GGBDRN O=C(c1cccn1Cc1cccs1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172535095 1426076049 /nfs/dbraw/zinc/07/60/49/1426076049.db2.gz LEHNDKGMUKABPV-CQSZACIVSA-N 0 0 397.460 3.228 20 5 GGBDRN CCc1nc2cc(NC(=O)C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc2o1 ZINC000172540800 1426079405 /nfs/dbraw/zinc/07/94/05/1426079405.db2.gz XQLUJXNLKLRTGJ-NSHDSACASA-N 0 0 382.376 3.114 20 5 GGBDRN C[C@@H](NC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000172572943 1426093023 /nfs/dbraw/zinc/09/30/23/1426093023.db2.gz XGGOJIBADJGJFZ-LLVKDONJSA-N 0 0 398.387 3.011 20 5 GGBDRN O=C(CNC(=O)c1cccc(Cl)c1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000172573217 1426093887 /nfs/dbraw/zinc/09/38/87/1426093887.db2.gz LDJONNOSWHEJAH-UHFFFAOYSA-N 0 0 389.839 3.117 20 5 GGBDRN O=C(NCc1nc(C(F)(F)F)cs1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172612120 1426112865 /nfs/dbraw/zinc/11/28/65/1426112865.db2.gz MUTPHOWRRZNIRK-UHFFFAOYSA-N 0 0 397.338 3.186 20 5 GGBDRN C[C@H](N[C@@H](C)c1nnc2ccccn21)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172614130 1426113910 /nfs/dbraw/zinc/11/39/10/1426113910.db2.gz KKDYNWZJUMZDLY-RYUDHWBXSA-N 0 0 379.380 3.099 20 5 GGBDRN C[C@@H](N[C@H](C)c1nnc2ccccn21)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172614142 1426114514 /nfs/dbraw/zinc/11/45/14/1426114514.db2.gz KKDYNWZJUMZDLY-VXGBXAGGSA-N 0 0 379.380 3.099 20 5 GGBDRN C[C@](O)(CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000172629832 1426118909 /nfs/dbraw/zinc/11/89/09/1426118909.db2.gz XTHOCAVQTPATKM-SFHVURJKSA-N 0 0 377.466 3.186 20 5 GGBDRN C[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000172672007 1426136770 /nfs/dbraw/zinc/13/67/70/1426136770.db2.gz UONQKCFVLOFQSU-LBPRGKRZSA-N 0 0 397.884 3.349 20 5 GGBDRN COc1cc(N2CCC(OC(=O)CCc3cscn3)CC2)ccc1[N+](=O)[O-] ZINC000172674532 1426137721 /nfs/dbraw/zinc/13/77/21/1426137721.db2.gz RHWPNKFVGQIAPC-UHFFFAOYSA-N 0 0 391.449 3.205 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](c1cccc(F)c1)N1CCOCC1 ZINC000172688313 1426143664 /nfs/dbraw/zinc/14/36/64/1426143664.db2.gz YXPJIDGUHTXMIG-QGZVFWFLSA-N 0 0 393.802 3.399 20 5 GGBDRN CC[C@H]1CN(C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c2ccccc2O1 ZINC000172689808 1426144148 /nfs/dbraw/zinc/14/41/48/1426144148.db2.gz OWBIKIBZRWZNMA-INIZCTEOSA-N 0 0 393.403 3.302 20 5 GGBDRN CCc1ccccc1CNC(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000172707885 1426152839 /nfs/dbraw/zinc/15/28/39/1426152839.db2.gz RTNMDTXSPRLNBU-UHFFFAOYSA-N 0 0 387.436 3.216 20 5 GGBDRN COc1cccc(Cn2nccc2NC(=O)Cc2cccc([N+](=O)[O-])c2)c1OC ZINC000172706885 1426152890 /nfs/dbraw/zinc/15/28/90/1426152890.db2.gz AQLHHVNOYZCEIZ-UHFFFAOYSA-N 0 0 396.403 3.038 20 5 GGBDRN O=C(c1ncoc1-c1ccc2c(c1)OCCO2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000172717093 1426157768 /nfs/dbraw/zinc/15/77/68/1426157768.db2.gz KTJGINYDKCOBRF-UHFFFAOYSA-N 0 0 393.355 3.224 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1ccn(-c3ccc([N+](=O)[O-])cc3)n1)C[C@@H](C)O2 ZINC000172717628 1426157885 /nfs/dbraw/zinc/15/78/85/1426157885.db2.gz PBYPLUVXPOIAQR-CYBMUJFWSA-N 0 0 394.387 3.217 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1ccc(NC(=O)c2ccco2)cc1 ZINC000172721422 1426160084 /nfs/dbraw/zinc/16/00/84/1426160084.db2.gz YJRFFEXWPUIRSP-UHFFFAOYSA-N 0 0 379.372 3.299 20 5 GGBDRN Cc1ccc(N2CCC[C@H](NC(=O)c3c(Cl)cccc3[N+](=O)[O-])C2=O)cc1 ZINC000172730374 1426164576 /nfs/dbraw/zinc/16/45/76/1426164576.db2.gz BMPFGGBTSSHBDK-HNNXBMFYSA-N 0 0 387.823 3.482 20 5 GGBDRN Cc1ccc(N2CCC[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000172734939 1426166715 /nfs/dbraw/zinc/16/67/15/1426166715.db2.gz QODOOMDOTNNKID-QGZVFWFLSA-N 0 0 387.823 3.482 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H](C)Oc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000172739101 1426168459 /nfs/dbraw/zinc/16/84/59/1426168459.db2.gz LOBMJWAHKPNRPW-SNVBAGLBSA-N 0 0 377.328 3.148 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N(Cc1ccc(C(=O)NC2CC2)cc1)C1CC1 ZINC000172740143 1426169171 /nfs/dbraw/zinc/16/91/71/1426169171.db2.gz IVGMRZANVQAJFN-UHFFFAOYSA-N 0 0 393.443 3.221 20 5 GGBDRN C[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)Oc1cccc(F)c1 ZINC000172742636 1426169922 /nfs/dbraw/zinc/16/99/22/1426169922.db2.gz CQCOEFIXGGWONY-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C(=O)NCC(F)(F)F)cc1 ZINC000172743265 1426169954 /nfs/dbraw/zinc/16/99/54/1426169954.db2.gz SKKPGYSEXLHKJX-UHFFFAOYSA-N 0 0 381.310 3.068 20 5 GGBDRN C[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)Oc1cccc(F)c1 ZINC000172746264 1426171462 /nfs/dbraw/zinc/17/14/62/1426171462.db2.gz ASPLFRHKPPRUSY-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN COc1cc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2n1 ZINC000172766060 1426178340 /nfs/dbraw/zinc/17/83/40/1426178340.db2.gz FPZKQVOTWJUGQA-UHFFFAOYSA-N 0 0 381.388 3.237 20 5 GGBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CCN(c2ncnc3ccsc32)CC1 ZINC000172765981 1426178546 /nfs/dbraw/zinc/17/85/46/1426178546.db2.gz MBCMUWHCBKKLPV-UHFFFAOYSA-N 0 0 392.444 3.474 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000172775564 1426182699 /nfs/dbraw/zinc/18/26/99/1426182699.db2.gz FBNHPOUOXLZKPM-LPMFXHHGSA-N 0 0 399.422 3.462 20 5 GGBDRN COc1ccc(O[C@H](C)CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000172778039 1426184004 /nfs/dbraw/zinc/18/40/04/1426184004.db2.gz MBNFAPRROAJUIS-CYBMUJFWSA-N 0 0 385.420 3.375 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000172779599 1426184767 /nfs/dbraw/zinc/18/47/67/1426184767.db2.gz NBNABLUKOWAKHD-IUODEOHRSA-N 0 0 385.445 3.241 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000172782287 1426185333 /nfs/dbraw/zinc/18/53/33/1426185333.db2.gz DCFAHVQVRTXLMF-VOJFVSQTSA-N 0 0 391.374 3.318 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000172782300 1426185351 /nfs/dbraw/zinc/18/53/51/1426185351.db2.gz DCFAHVQVRTXLMF-BBATYDOGSA-N 0 0 391.374 3.318 20 5 GGBDRN COc1ccccc1NC(=O)C1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000172784124 1426186558 /nfs/dbraw/zinc/18/65/58/1426186558.db2.gz VMZVUTOUOCDXHT-UHFFFAOYSA-N 0 0 397.431 3.403 20 5 GGBDRN CS(=O)(=O)c1ccccc1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000172787277 1426188130 /nfs/dbraw/zinc/18/81/30/1426188130.db2.gz NZRWJOWJZIRWJL-UHFFFAOYSA-N 0 0 376.434 3.046 20 5 GGBDRN Cc1noc(-c2cccnc2N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000172787085 1426188377 /nfs/dbraw/zinc/18/83/77/1426188377.db2.gz RQLVNJXHTWZCDF-UHFFFAOYSA-N 0 0 381.392 3.396 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(CN(C)C(=O)C(C)C)cc1 ZINC000172788421 1426188915 /nfs/dbraw/zinc/18/89/15/1426188915.db2.gz ZBRBUNZFAIZKAX-UHFFFAOYSA-N 0 0 399.447 3.148 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)c1 ZINC000172788497 1426188979 /nfs/dbraw/zinc/18/89/79/1426188979.db2.gz OTYGJUKJOHPHHL-MLGOLLRUSA-N 0 0 385.445 3.241 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCN(c3ccc(CC)cc3)CC2)c1[N+](=O)[O-] ZINC000172789573 1426189869 /nfs/dbraw/zinc/18/98/69/1426189869.db2.gz AQUJWCYUQQNDPW-UHFFFAOYSA-N 0 0 384.436 3.056 20 5 GGBDRN CNC(=O)c1cccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1 ZINC000172793464 1426190982 /nfs/dbraw/zinc/19/09/82/1426190982.db2.gz JZVQLMSMXMWGSF-UHFFFAOYSA-N 0 0 395.337 3.159 20 5 GGBDRN COc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cc1N1CCCCC1=O ZINC000172795811 1426192701 /nfs/dbraw/zinc/19/27/01/1426192701.db2.gz HUOFQIXWDWSKTF-UHFFFAOYSA-N 0 0 383.404 3.302 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC[C@H](COCc2ccccc2)C1 ZINC000172805966 1426197841 /nfs/dbraw/zinc/19/78/41/1426197841.db2.gz NYSXRAVHTCRFTQ-HNNXBMFYSA-N 0 0 385.376 3.182 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](COCc2ccccc2)C1 ZINC000172809657 1426199282 /nfs/dbraw/zinc/19/92/82/1426199282.db2.gz DAGTZAONCYMSAN-QGZVFWFLSA-N 0 0 383.448 3.340 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)c1 ZINC000172809740 1426199394 /nfs/dbraw/zinc/19/93/94/1426199394.db2.gz JDTKQYGNJVLHHE-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(C(=O)NCc2ccccn2)c1 ZINC000172809753 1426199419 /nfs/dbraw/zinc/19/94/19/1426199419.db2.gz ZGHPZGIMHVMPOR-UHFFFAOYSA-N 0 0 390.399 3.101 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](COCc3ccccc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000172812108 1426199974 /nfs/dbraw/zinc/19/99/74/1426199974.db2.gz CIXYYGBHMYDCCF-INIZCTEOSA-N 0 0 399.403 3.490 20 5 GGBDRN CCOCCCNC(=O)c1cccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000172823143 1426205410 /nfs/dbraw/zinc/20/54/10/1426205410.db2.gz LWSPDQBCJOBPKA-UHFFFAOYSA-N 0 0 385.420 3.312 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000172824212 1426206057 /nfs/dbraw/zinc/20/60/57/1426206057.db2.gz ALRATPUAKFOYIT-HZPDHXFCSA-N 0 0 383.448 3.385 20 5 GGBDRN Cc1cc(C)cc(C[C@@H](C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000172851210 1426219373 /nfs/dbraw/zinc/21/93/73/1426219373.db2.gz BPKMEAYSEFMUGP-CQSZACIVSA-N 0 0 379.416 3.414 20 5 GGBDRN Cc1ccc(N2CCC[C@H](NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)C2)cc1 ZINC000172857676 1426223117 /nfs/dbraw/zinc/22/31/17/1426223117.db2.gz YEUYKUQJQFKIEU-HNNXBMFYSA-N 0 0 384.392 3.210 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1F ZINC000172862422 1426226392 /nfs/dbraw/zinc/22/63/92/1426226392.db2.gz KASDHZRFBKBKBJ-INIZCTEOSA-N 0 0 389.358 3.030 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1ccccc1C(=O)N1CCOCC1 ZINC000172870886 1426231689 /nfs/dbraw/zinc/23/16/89/1426231689.db2.gz RUPFBDFOBINNJM-UHFFFAOYSA-N 0 0 399.447 3.467 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CC2 ZINC000172875462 1426234346 /nfs/dbraw/zinc/23/43/46/1426234346.db2.gz NUDSFOWDBCLYHA-IRXDYDNUSA-N 0 0 390.461 3.202 20 5 GGBDRN COc1ccc(C2(CNC(=O)Cc3cccc([N+](=O)[O-])c3)CCOCC2)cc1 ZINC000172883226 1426237804 /nfs/dbraw/zinc/23/78/04/1426237804.db2.gz CMQNXNPNXNEVKW-UHFFFAOYSA-N 0 0 384.432 3.011 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1C ZINC000172890262 1426241306 /nfs/dbraw/zinc/24/13/06/1426241306.db2.gz WPGBNGLYSRPTJG-UHFFFAOYSA-N 0 0 391.449 3.236 20 5 GGBDRN CN(CCOc1ccc(Cl)cc1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172892037 1426242048 /nfs/dbraw/zinc/24/20/48/1426242048.db2.gz SMHIZGRHWXEZCE-UHFFFAOYSA-N 0 0 387.827 3.475 20 5 GGBDRN CN(Cc1cnn(-c2ccccc2)c1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172892824 1426242194 /nfs/dbraw/zinc/24/21/94/1426242194.db2.gz UNRQNTOMZVONFR-UHFFFAOYSA-N 0 0 389.419 3.129 20 5 GGBDRN COc1cc(C)c(CN(C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)cc1OC ZINC000172892506 1426242265 /nfs/dbraw/zinc/24/22/65/1426242265.db2.gz LESPYAFMEHWDGG-UHFFFAOYSA-N 0 0 397.435 3.268 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000172895295 1426243623 /nfs/dbraw/zinc/24/36/23/1426243623.db2.gz AFZYUNVPTOYPNG-UHFFFAOYSA-N 0 0 382.416 3.494 20 5 GGBDRN COc1ccc(NCc2cc([N+](=O)[O-])ccc2OC(C)C)cc1-n1nnnc1C ZINC000172896338 1426243856 /nfs/dbraw/zinc/24/38/56/1426243856.db2.gz KPULSDAFMPBLLP-UHFFFAOYSA-N 0 0 398.423 3.287 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccccc1OCC(F)(F)F ZINC000172897112 1426244423 /nfs/dbraw/zinc/24/44/23/1426244423.db2.gz PWJJHNFHNUBEAB-UHFFFAOYSA-N 0 0 379.294 3.294 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC000172897637 1426244521 /nfs/dbraw/zinc/24/45/21/1426244521.db2.gz KVJRFKFTBCPDGS-SECBINFHSA-N 0 0 386.788 3.364 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC000172897639 1426244639 /nfs/dbraw/zinc/24/46/39/1426244639.db2.gz KVJRFKFTBCPDGS-VIFPVBQESA-N 0 0 386.788 3.364 20 5 GGBDRN O=[N+]([O-])c1cn(CN2CCO[C@H](c3cccc(F)c3)C2)nc1-c1ccncc1 ZINC000172900801 1426247249 /nfs/dbraw/zinc/24/72/49/1426247249.db2.gz AWQIPHYNAQHLMW-SFHVURJKSA-N 0 0 383.383 3.023 20 5 GGBDRN Cc1c(CNc2cccc(C(=O)N3CCC(CO)CC3)c2)cccc1[N+](=O)[O-] ZINC000172901320 1426247316 /nfs/dbraw/zinc/24/73/16/1426247316.db2.gz MIRFYDMKFIYNLD-UHFFFAOYSA-N 0 0 383.448 3.360 20 5 GGBDRN Cc1c(CNc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)cccc1[N+](=O)[O-] ZINC000172900816 1426247471 /nfs/dbraw/zinc/24/74/71/1426247471.db2.gz JERHZIQCOOQIOG-MRXNPFEDSA-N 0 0 383.448 3.360 20 5 GGBDRN O=[N+]([O-])c1cn(CN2CCO[C@@H](c3cccc(F)c3)C2)nc1-c1ccncc1 ZINC000172900807 1426247528 /nfs/dbraw/zinc/24/75/28/1426247528.db2.gz AWQIPHYNAQHLMW-GOSISDBHSA-N 0 0 383.383 3.023 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000172904451 1426250171 /nfs/dbraw/zinc/25/01/71/1426250171.db2.gz ZNTZXLNPSSSQDE-HNNXBMFYSA-N 0 0 399.447 3.401 20 5 GGBDRN COc1cc(NCc2csc([N+](=O)[O-])c2)ccc1S(=O)(=O)N1CCCC1 ZINC000172910776 1426254460 /nfs/dbraw/zinc/25/44/60/1426254460.db2.gz GIXFXVPHZVFGGB-UHFFFAOYSA-N 0 0 397.478 3.062 20 5 GGBDRN COc1cc(NCc2cccc([N+](=O)[O-])c2)ccc1S(=O)(=O)N1CCCC1 ZINC000172910761 1426254835 /nfs/dbraw/zinc/25/48/35/1426254835.db2.gz IBOXWYRYZFCGLF-UHFFFAOYSA-N 0 0 391.449 3.000 20 5 GGBDRN COC(=O)c1cc(Br)ccc1OC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172913754 1426258391 /nfs/dbraw/zinc/25/83/91/1426258391.db2.gz MMCRJKXBFVXSGZ-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NCc1cccc([N+](=O)[O-])c1 ZINC000172915696 1426260042 /nfs/dbraw/zinc/26/00/42/1426260042.db2.gz CIMMYSAGHZSFNX-UHFFFAOYSA-N 0 0 393.465 3.244 20 5 GGBDRN C[C@@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)Sc1ccccc1 ZINC000172917515 1426261030 /nfs/dbraw/zinc/26/10/30/1426261030.db2.gz OPAQTQPPTSGDDN-LBPRGKRZSA-N 0 0 383.429 3.347 20 5 GGBDRN C[C@H](CNC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)Sc1ccccc1 ZINC000172916526 1426261319 /nfs/dbraw/zinc/26/13/19/1426261319.db2.gz WOFIRYJXRCXXFT-KGLIPLIRSA-N 0 0 387.461 3.010 20 5 GGBDRN Cc1ccc(C(=O)NC2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)s1 ZINC000172917116 1426261397 /nfs/dbraw/zinc/26/13/97/1426261397.db2.gz BHJYYCOJRZZWDW-UHFFFAOYSA-N 0 0 387.461 3.308 20 5 GGBDRN C[C@@H](CNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)Sc1ccccc1 ZINC000172918962 1426262158 /nfs/dbraw/zinc/26/21/58/1426262158.db2.gz BYJQBLDPFZJUPH-ZDUSSCGKSA-N 0 0 383.433 3.086 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Sc1ccccc1 ZINC000172919344 1426263221 /nfs/dbraw/zinc/26/32/21/1426263221.db2.gz PQPMYBPNHATQEJ-ZDUSSCGKSA-N 0 0 383.433 3.086 20 5 GGBDRN Cc1c(C(=O)NC[C@H](C)Sc2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000172920529 1426263461 /nfs/dbraw/zinc/26/34/61/1426263461.db2.gz PEOCGJXUKSDYOO-ZDUSSCGKSA-N 0 0 397.460 3.395 20 5 GGBDRN O=C(CNc1ccc(F)cc1OC(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000172931429 1426270739 /nfs/dbraw/zinc/27/07/39/1426270739.db2.gz BDOICDXARFMJFO-UHFFFAOYSA-N 0 0 381.310 3.337 20 5 GGBDRN CCOC(=O)[C@H](C)NC(=O)c1ccc(NCc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000172936170 1426273913 /nfs/dbraw/zinc/27/39/13/1426273913.db2.gz SRNMJYBUZPTHKZ-LBPRGKRZSA-N 0 0 389.383 3.027 20 5 GGBDRN O=C(CNc1cccc(CC(F)(F)F)c1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000172937615 1426273920 /nfs/dbraw/zinc/27/39/20/1426273920.db2.gz WDUHAFBMLAHDFB-UHFFFAOYSA-N 0 0 397.309 3.479 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000172945167 1426278691 /nfs/dbraw/zinc/27/86/91/1426278691.db2.gz JBMGABBVEVHNOC-HNNXBMFYSA-N 0 0 389.839 3.194 20 5 GGBDRN CN(CC(=O)Nc1ccnn1CCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000172953236 1426282588 /nfs/dbraw/zinc/28/25/88/1426282588.db2.gz PCKCWFNWJDZIPH-UHFFFAOYSA-N 0 0 379.420 3.109 20 5 GGBDRN CC(C)(C)OC(=O)CCNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000172964367 1426285314 /nfs/dbraw/zinc/28/53/14/1426285314.db2.gz GFXATAYWGXVVTQ-UHFFFAOYSA-N 0 0 380.444 3.003 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)c3cc(C)ccc3[N+](=O)[O-])cc2)n1 ZINC000172964086 1426285640 /nfs/dbraw/zinc/28/56/40/1426285640.db2.gz TTXUPAOUBJLHPQ-UHFFFAOYSA-N 0 0 380.404 3.488 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc(N2CCCNC2=O)c1 ZINC000172983516 1426293992 /nfs/dbraw/zinc/29/39/92/1426293992.db2.gz MGXXJVXRFPPLOK-UHFFFAOYSA-N 0 0 388.811 3.349 20 5 GGBDRN COCCCOC1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000172986020 1426295328 /nfs/dbraw/zinc/29/53/28/1426295328.db2.gz XPFMINNQKHRKPF-UHFFFAOYSA-N 0 0 378.450 3.467 20 5 GGBDRN Cc1ccc(-c2nc(CCNC(=O)CN(C)c3ccccc3[N+](=O)[O-])co2)cc1 ZINC000172988979 1426298116 /nfs/dbraw/zinc/29/81/16/1426298116.db2.gz NKZKITCZHJZXLP-UHFFFAOYSA-N 0 0 394.431 3.353 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCCc2ncc[nH]2)cc1 ZINC000172991538 1426298873 /nfs/dbraw/zinc/29/88/73/1426298873.db2.gz RCAOAKKKHPBDOY-UHFFFAOYSA-N 0 0 382.376 3.091 20 5 GGBDRN CCC[C@@H]1[C@H](C)CCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000172992875 1426299359 /nfs/dbraw/zinc/29/93/59/1426299359.db2.gz QIBQOZBRCQNHHS-GDBMZVCRSA-N 0 0 398.463 3.490 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)cc1 ZINC000173000161 1426303060 /nfs/dbraw/zinc/30/30/60/1426303060.db2.gz XPYMUFOQUFNQMW-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nnc3n2CCCC3)cc1 ZINC000173002177 1426303458 /nfs/dbraw/zinc/30/34/58/1426303458.db2.gz SEUVWRDACCQCDN-UHFFFAOYSA-N 0 0 377.404 3.371 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)Cc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000173005118 1426304656 /nfs/dbraw/zinc/30/46/56/1426304656.db2.gz SSBOTCRLCKZNOH-SFHVURJKSA-N 0 0 399.472 3.294 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)Cc2cccc([N+](=O)[O-])c2)c1C ZINC000173005278 1426304723 /nfs/dbraw/zinc/30/47/23/1426304723.db2.gz CLZPIGPDDZKELH-GOSISDBHSA-N 0 0 399.472 3.294 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2C)c1 ZINC000173005287 1426304904 /nfs/dbraw/zinc/30/49/04/1426304904.db2.gz YIVKCUQNTDVNJC-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)c1 ZINC000173011087 1426307630 /nfs/dbraw/zinc/30/76/30/1426307630.db2.gz RXXBMTPWHUXANM-QGZVFWFLSA-N 0 0 387.823 3.434 20 5 GGBDRN CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000173025393 1426313287 /nfs/dbraw/zinc/31/32/87/1426313287.db2.gz BKFMZFPYKXTEST-UHFFFAOYSA-N 0 0 390.461 3.489 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c1 ZINC000173025570 1426313433 /nfs/dbraw/zinc/31/34/33/1426313433.db2.gz WGZFBCXXRQZWTM-UHFFFAOYSA-N 0 0 376.434 3.479 20 5 GGBDRN CC(C)S(=O)(=O)Cc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000173025599 1426313559 /nfs/dbraw/zinc/31/35/59/1426313559.db2.gz LEKNKBXBDFQTJY-UHFFFAOYSA-N 0 0 376.434 3.099 20 5 GGBDRN COc1cccc2c1OC[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 ZINC000173050764 1426323269 /nfs/dbraw/zinc/32/32/69/1426323269.db2.gz UJOQYHCBGLPLHM-LBPRGKRZSA-N 0 0 396.321 3.356 20 5 GGBDRN CN(CC(=O)N[C@H](c1ccccc1)c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000173052375 1426324004 /nfs/dbraw/zinc/32/40/04/1426324004.db2.gz OZODWJULCQOEIM-OAQYLSRUSA-N 0 0 376.416 3.332 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C(=O)Nc2cccnc2)cc1 ZINC000173063712 1426327974 /nfs/dbraw/zinc/32/79/74/1426327974.db2.gz NMGDQAZONWOQCN-UHFFFAOYSA-N 0 0 376.372 3.423 20 5 GGBDRN Cc1cncc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 ZINC000173081792 1426334483 /nfs/dbraw/zinc/33/44/83/1426334483.db2.gz LVUWPUIRBLUMCG-UHFFFAOYSA-N 0 0 394.353 3.279 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000173091264 1426338532 /nfs/dbraw/zinc/33/85/32/1426338532.db2.gz OOPWKTHDMCYSOF-SNVBAGLBSA-N 0 0 398.375 3.355 20 5 GGBDRN CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000173103831 1426343207 /nfs/dbraw/zinc/34/32/07/1426343207.db2.gz JYCABBONEAXBDN-KRWDZBQOSA-N 0 0 388.395 3.309 20 5 GGBDRN CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000173103824 1426343518 /nfs/dbraw/zinc/34/35/18/1426343518.db2.gz JYCABBONEAXBDN-QGZVFWFLSA-N 0 0 388.395 3.309 20 5 GGBDRN CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173107821 1426345940 /nfs/dbraw/zinc/34/59/40/1426345940.db2.gz HRAGXYWEJSOQAX-KRWDZBQOSA-N 0 0 397.410 3.312 20 5 GGBDRN Cn1c(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc21 ZINC000173113139 1426348840 /nfs/dbraw/zinc/34/88/40/1426348840.db2.gz IXXXEVHILFLEGN-UHFFFAOYSA-N 0 0 378.310 3.430 20 5 GGBDRN CN(CC(=O)Nc1nc(Cc2ccccc2)ns1)c1ccccc1[N+](=O)[O-] ZINC000173124639 1426352269 /nfs/dbraw/zinc/35/22/69/1426352269.db2.gz XKXJSDOMWDDYIG-UHFFFAOYSA-N 0 0 383.433 3.112 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(C(=O)NCc3ccc(F)cc3)CC2)c1 ZINC000173132238 1426356097 /nfs/dbraw/zinc/35/60/97/1426356097.db2.gz AMKJZULNHWKQGC-UHFFFAOYSA-N 0 0 399.422 3.211 20 5 GGBDRN C[C@@H](NC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000173142574 1426362528 /nfs/dbraw/zinc/36/25/28/1426362528.db2.gz CHLUAKAHIOOVKE-PXAZEXFGSA-N 0 0 387.823 3.479 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173144013 1426363417 /nfs/dbraw/zinc/36/34/17/1426363417.db2.gz SNETYXNSWPPLLN-MRXNPFEDSA-N 0 0 378.388 3.001 20 5 GGBDRN Cc1cc(C(=O)Nc2cc(-n3nnnc3C3CC3)ccc2F)cc([N+](=O)[O-])c1 ZINC000173153104 1426367454 /nfs/dbraw/zinc/36/74/54/1426367454.db2.gz RYWQKFOLQIEZJP-UHFFFAOYSA-N 0 0 382.355 3.148 20 5 GGBDRN COc1ccc([C@H]2CCCN2C(=O)CN(C)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000173153891 1426367916 /nfs/dbraw/zinc/36/79/16/1426367916.db2.gz KILXSLIZTWHRDR-QGZVFWFLSA-N 0 0 399.447 3.412 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cccc(Oc3cccnn3)c2)c(C)c1[N+](=O)[O-] ZINC000173164922 1426372886 /nfs/dbraw/zinc/37/28/86/1426372886.db2.gz DYZZHZHMSQOOIY-UHFFFAOYSA-N 0 0 382.380 3.019 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)c1 ZINC000173164982 1426373041 /nfs/dbraw/zinc/37/30/41/1426373041.db2.gz SQCGBDUNYTZNPD-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN O=C(Nc1cccc(Oc2cccnn2)c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000173164410 1426373072 /nfs/dbraw/zinc/37/30/72/1426373072.db2.gz SSXVNERMLGXVND-UHFFFAOYSA-N 0 0 376.332 3.306 20 5 GGBDRN O=C(CCC1CCCCC1)N1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000173168529 1426374636 /nfs/dbraw/zinc/37/46/36/1426374636.db2.gz QOHJBGQENZVDBF-UHFFFAOYSA-N 0 0 387.480 3.169 20 5 GGBDRN Cc1cnc([C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C2CC2)s1 ZINC000173173282 1426377042 /nfs/dbraw/zinc/37/70/42/1426377042.db2.gz RJIFTUNYSDQBHZ-CYBMUJFWSA-N 0 0 394.840 3.219 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C1(N2CCOCC2)CCCC1 ZINC000173178719 1426379777 /nfs/dbraw/zinc/37/97/77/1426379777.db2.gz NTSPNIACPNCSIW-CYBMUJFWSA-N 0 0 381.860 3.012 20 5 GGBDRN CN(CC(=O)Nc1cc2c(cc1Cl)OCCCO2)c1ccccc1[N+](=O)[O-] ZINC000173178784 1426379811 /nfs/dbraw/zinc/37/98/11/1426379811.db2.gz XVJANTAHQRXHAA-UHFFFAOYSA-N 0 0 391.811 3.484 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(C(=O)N2CCCC2)CC1 ZINC000173182187 1426380778 /nfs/dbraw/zinc/38/07/78/1426380778.db2.gz ANTHGQZWTFGMRS-UHFFFAOYSA-N 0 0 399.369 3.088 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccccc1Cn1cncn1 ZINC000173186880 1426383040 /nfs/dbraw/zinc/38/30/40/1426383040.db2.gz ZGVDKRZUNYBIRL-UHFFFAOYSA-N 0 0 385.811 3.160 20 5 GGBDRN CN(CC(=O)NC[C@H](O)c1ccc2ccccc2c1)c1ccccc1[N+](=O)[O-] ZINC000173219231 1426400891 /nfs/dbraw/zinc/40/08/91/1426400891.db2.gz WNWZHFMOMBZALK-FQEVSTJZSA-N 0 0 379.416 3.034 20 5 GGBDRN COc1ccc([C@H]2CCCN2C(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000173221593 1426403905 /nfs/dbraw/zinc/40/39/05/1426403905.db2.gz IREAXGIWMULUIR-MRXNPFEDSA-N 0 0 399.447 3.412 20 5 GGBDRN CN(C)C(=O)c1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173226845 1426410981 /nfs/dbraw/zinc/41/09/81/1426410981.db2.gz GOHOCUJTGUOSDE-UHFFFAOYSA-N 0 0 395.337 3.245 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)s1 ZINC000173231115 1426415860 /nfs/dbraw/zinc/41/58/60/1426415860.db2.gz NEXBKKYTNOQBAA-NSHDSACASA-N 0 0 399.494 3.312 20 5 GGBDRN CN(C[C@@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1)C(=O)OC(C)(C)C ZINC000173236103 1426421733 /nfs/dbraw/zinc/42/17/33/1426421733.db2.gz NKHSFAGTZSAPMA-INIZCTEOSA-N 0 0 391.468 3.243 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)c1 ZINC000173243982 1426426243 /nfs/dbraw/zinc/42/62/43/1426426243.db2.gz GMSKFOVNIBHGBP-MRXNPFEDSA-N 0 0 383.448 3.054 20 5 GGBDRN C[C@@H]1CCN(C)c2ccccc2N1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000173249902 1426430643 /nfs/dbraw/zinc/43/06/43/1426430643.db2.gz GGLMPRDRZFREOK-CQSZACIVSA-N 0 0 392.419 3.051 20 5 GGBDRN C[C@H]1CCN(C)c2ccccc2N1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000173249918 1426430698 /nfs/dbraw/zinc/43/06/98/1426430698.db2.gz GGLMPRDRZFREOK-AWEZNQCLSA-N 0 0 392.419 3.051 20 5 GGBDRN CC(C)NC(=O)Nc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000173255329 1426434297 /nfs/dbraw/zinc/43/42/97/1426434297.db2.gz HFDWOUWSNOKURV-UHFFFAOYSA-N 0 0 385.424 3.200 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000173255683 1426434363 /nfs/dbraw/zinc/43/43/63/1426434363.db2.gz RKXLOTGUMZLSMB-OCCSQVGLSA-N 0 0 380.422 3.358 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@H](C)C[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000173256219 1426434972 /nfs/dbraw/zinc/43/49/72/1426434972.db2.gz WPFGHZWGSDTFQN-JSGCOSHPSA-N 0 0 380.422 3.358 20 5 GGBDRN O=C(Nc1ccc2c(c1)NC(=O)CC2)c1cc([N+](=O)[O-])ccc1Br ZINC000173284521 1426462373 /nfs/dbraw/zinc/46/23/73/1426462373.db2.gz FAHVMXVFHMPJKS-UHFFFAOYSA-N 0 0 390.193 3.494 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(Cn2cc[nH]c2=S)CC1 ZINC000173293213 1426473272 /nfs/dbraw/zinc/47/32/72/1426473272.db2.gz YXQIBRFSGLCHHG-UHFFFAOYSA-N 0 0 387.387 3.252 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)cc1 ZINC000173297361 1426478455 /nfs/dbraw/zinc/47/84/55/1426478455.db2.gz NIKMCEVQNNUGEQ-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)cc1 ZINC000173298468 1426480307 /nfs/dbraw/zinc/48/03/07/1426480307.db2.gz LSBRLCZNVWZCSK-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)cc1[N+](=O)[O-] ZINC000173299148 1426480894 /nfs/dbraw/zinc/48/08/94/1426480894.db2.gz ZIODDQDXSQGGPE-UHFFFAOYSA-N 0 0 375.768 3.394 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC[C@H]1c1ccc(C)o1 ZINC000173302662 1426484484 /nfs/dbraw/zinc/48/44/84/1426484484.db2.gz AQBQXTQKOFKNDI-AWEZNQCLSA-N 0 0 380.422 3.421 20 5 GGBDRN NC(=O)CNC(=O)c1cccc(NC(=O)c2c3ccccc3cc3ccccc32)c1 ZINC000173304319 1426485911 /nfs/dbraw/zinc/48/59/11/1426485911.db2.gz DQXXDKWPTBDDLP-UHFFFAOYSA-N 0 0 397.434 3.460 20 5 GGBDRN COc1ccc(-c2nsc(NC(=O)CN(C)c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000173303324 1426486443 /nfs/dbraw/zinc/48/64/43/1426486443.db2.gz LOXSTLQSKQKYBI-UHFFFAOYSA-N 0 0 399.432 3.197 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)Nc1ccn(Cc2ccncc2)n1 ZINC000173311027 1426494767 /nfs/dbraw/zinc/49/47/67/1426494767.db2.gz BEVCPUWXRYXHOS-UHFFFAOYSA-N 0 0 394.435 3.379 20 5 GGBDRN CCc1ccc(C(=O)NCc2ccc(-n3nc(C)cc3C)nc2)cc1[N+](=O)[O-] ZINC000173316908 1426500589 /nfs/dbraw/zinc/50/05/89/1426500589.db2.gz QXDDIFXYWYHVFB-UHFFFAOYSA-N 0 0 379.420 3.285 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(OCCn3cncn3)c2)cc1[N+](=O)[O-] ZINC000173318787 1426501542 /nfs/dbraw/zinc/50/15/42/1426501542.db2.gz WWZBXPBWUKXXRL-UHFFFAOYSA-N 0 0 381.392 3.080 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)cc1[N+](=O)[O-] ZINC000173321845 1426504501 /nfs/dbraw/zinc/50/45/01/1426504501.db2.gz WTKAKBRRTYSELW-QGZVFWFLSA-N 0 0 396.447 3.352 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)cc1[N+](=O)[O-] ZINC000173337653 1426518440 /nfs/dbraw/zinc/51/84/40/1426518440.db2.gz MHCZQLUDCIGMJF-UHFFFAOYSA-N 0 0 397.431 3.190 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)CN(Cc2ccccc2F)c2ccccc2F)c1 ZINC000173340206 1426520127 /nfs/dbraw/zinc/52/01/27/1426520127.db2.gz ILYHTPZMOPVIOF-INIZCTEOSA-N 0 0 388.374 3.137 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1coc(-c2ccccc2)n1 ZINC000173347237 1426524672 /nfs/dbraw/zinc/52/46/72/1426524672.db2.gz IZXRXGPTRVNGPG-UHFFFAOYSA-N 0 0 387.417 3.291 20 5 GGBDRN CCc1ccc(C(=O)NCC(=O)Nc2ccc(C)cc2Cl)cc1[N+](=O)[O-] ZINC000173352906 1426529748 /nfs/dbraw/zinc/52/97/48/1426529748.db2.gz DWZGWWYIQZXGJV-UHFFFAOYSA-N 0 0 375.812 3.488 20 5 GGBDRN CCCCCCNC(=O)[C@H]1CCCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C1 ZINC000173358548 1426532627 /nfs/dbraw/zinc/53/26/27/1426532627.db2.gz AZPODCWMILZQJH-INIZCTEOSA-N 0 0 375.469 3.452 20 5 GGBDRN CCCCCCNC(=O)[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000173358834 1426533865 /nfs/dbraw/zinc/53/38/65/1426533865.db2.gz YGBGECOBVXPNDV-KRWDZBQOSA-N 0 0 375.469 3.072 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1C(=O)OCc1ccccc1 ZINC000173369301 1426541860 /nfs/dbraw/zinc/54/18/60/1426541860.db2.gz ZXMPEDPRBUOQDU-LJQANCHMSA-N 0 0 397.431 3.050 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN(CCO)[C@H]3CCc4ccccc43)o2)cc1 ZINC000173387344 1426563627 /nfs/dbraw/zinc/56/36/27/1426563627.db2.gz AMLHPWXLEYKICZ-SFHVURJKSA-N 0 0 380.404 3.127 20 5 GGBDRN CN(CC(=O)NCc1cccc(NC(=O)C2CCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000173389558 1426567386 /nfs/dbraw/zinc/56/73/86/1426567386.db2.gz BMAZUEIADHOUOP-UHFFFAOYSA-N 0 0 396.447 3.086 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@H](c2nc(C)cs2)C2CC2)cc([N+](=O)[O-])c1 ZINC000173395180 1426574269 /nfs/dbraw/zinc/57/42/69/1426574269.db2.gz MKOBKCZCDXOYIJ-OAHLLOKOSA-N 0 0 389.433 3.418 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@H](c2nc(C)cs2)C2CC2)cc([N+](=O)[O-])c1 ZINC000173396466 1426576352 /nfs/dbraw/zinc/57/63/52/1426576352.db2.gz VJWWAWPBJOWMRZ-AWEZNQCLSA-N 0 0 375.406 3.027 20 5 GGBDRN CCc1ccc(C(=O)Oc2ccc(NC(=O)c3cnn(C)c3)cc2)cc1[N+](=O)[O-] ZINC000173397059 1426577467 /nfs/dbraw/zinc/57/74/67/1426577467.db2.gz VLJQRRSHMMUERC-UHFFFAOYSA-N 0 0 394.387 3.362 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000173399446 1426581054 /nfs/dbraw/zinc/58/10/54/1426581054.db2.gz XUMPYVBAPJUWFK-MRXNPFEDSA-N 0 0 383.433 3.427 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 ZINC000173400515 1426582235 /nfs/dbraw/zinc/58/22/35/1426582235.db2.gz HQGXXWPLBBYDPP-UHFFFAOYSA-N 0 0 388.811 3.050 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H](C)Oc1cccc(Cl)c1 ZINC000173404354 1426589513 /nfs/dbraw/zinc/58/95/13/1426589513.db2.gz LROPNPOMSWXUNJ-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H](C)Oc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000173412603 1426595443 /nfs/dbraw/zinc/59/54/43/1426595443.db2.gz GFYXQMSSQASMSS-NSHDSACASA-N 0 0 391.811 3.079 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2)CCO1 ZINC000173412117 1426595691 /nfs/dbraw/zinc/59/56/91/1426595691.db2.gz SOTDHVAZWHKEON-HNNXBMFYSA-N 0 0 384.436 3.484 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1-n1cnnn1 ZINC000173412685 1426595718 /nfs/dbraw/zinc/59/57/18/1426595718.db2.gz HSFYLQRKMCUQBL-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)N1CCCC[C@@H]1C ZINC000173413857 1426596262 /nfs/dbraw/zinc/59/62/62/1426596262.db2.gz XXTVHBSAIBNZDK-QWRGUYRKSA-N 0 0 387.358 3.133 20 5 GGBDRN COc1cc(OCC(=O)N[C@H](c2nc(C)cs2)C2CC2)ccc1[N+](=O)[O-] ZINC000173413954 1426596322 /nfs/dbraw/zinc/59/63/22/1426596322.db2.gz DEERYWHJLDCIDD-INIZCTEOSA-N 0 0 377.422 3.015 20 5 GGBDRN C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)N1CCCC[C@H]1C ZINC000173413845 1426596454 /nfs/dbraw/zinc/59/64/54/1426596454.db2.gz XXTVHBSAIBNZDK-MNOVXSKESA-N 0 0 387.358 3.133 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)n1 ZINC000173415235 1426598420 /nfs/dbraw/zinc/59/84/20/1426598420.db2.gz RJYIWKPMVZBWNL-INIZCTEOSA-N 0 0 383.433 3.427 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1 ZINC000173418347 1426601845 /nfs/dbraw/zinc/60/18/45/1426601845.db2.gz ACFIRPFQCJJDAB-HNNXBMFYSA-N 0 0 386.383 3.079 20 5 GGBDRN CC(C)c1nccn1CCC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173423882 1426606044 /nfs/dbraw/zinc/60/60/44/1426606044.db2.gz KHAYMCZYXKRXBU-UHFFFAOYSA-N 0 0 386.452 3.375 20 5 GGBDRN CCc1ccc(C(=O)N[C@H](c2noc(C)n2)c2ccccc2OC)cc1[N+](=O)[O-] ZINC000173424783 1426607029 /nfs/dbraw/zinc/60/70/29/1426607029.db2.gz ZTGRDQVPVHMZEW-SFHVURJKSA-N 0 0 396.403 3.377 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1 ZINC000173425163 1426607884 /nfs/dbraw/zinc/60/78/84/1426607884.db2.gz YRRJKFDJYCVWPM-DYVFJYSZSA-N 0 0 394.424 3.193 20 5 GGBDRN O=C1C[C@@H](c2ccccc2)N1CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173434754 1426616115 /nfs/dbraw/zinc/61/61/15/1426616115.db2.gz HVVJACDPGWCFFM-FQEVSTJZSA-N 0 0 381.432 3.369 20 5 GGBDRN CN(CC(=O)Nc1ccccc1)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173439538 1426620132 /nfs/dbraw/zinc/62/01/32/1426620132.db2.gz FFFFFDZBJFNJBT-UHFFFAOYSA-N 0 0 381.310 3.324 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000173462248 1426635662 /nfs/dbraw/zinc/63/56/62/1426635662.db2.gz QONJMKULPXVKRL-MRXNPFEDSA-N 0 0 383.452 3.040 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173462207 1426635711 /nfs/dbraw/zinc/63/57/11/1426635711.db2.gz UIVQQQVJQXGZTC-AWEZNQCLSA-N 0 0 389.843 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3cc([N+](=O)[O-])ccc3Cl)C2)nc1 ZINC000173465362 1426639571 /nfs/dbraw/zinc/63/95/71/1426639571.db2.gz GODUWGDBMKPUEP-GFCCVEGCSA-N 0 0 377.788 3.238 20 5 GGBDRN Cc1cc(C)cc(NC(=O)[C@H](C)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000173466223 1426640721 /nfs/dbraw/zinc/64/07/21/1426640721.db2.gz MFMCWBWORYDGMQ-HOTGVXAUSA-N 0 0 383.452 3.120 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3csc(-c4ccccn4)n3)C2)nc1 ZINC000173466069 1426641084 /nfs/dbraw/zinc/64/10/84/1426641084.db2.gz SIKLDKNHNZZDCM-ZDUSSCGKSA-N 0 0 382.449 3.195 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])C2)nc1 ZINC000173466892 1426642350 /nfs/dbraw/zinc/64/23/50/1426642350.db2.gz QSSHUPDMBXPNTC-CYBMUJFWSA-N 0 0 377.788 3.238 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc3ccn(CC(=O)NC)c3c2)cc1[N+](=O)[O-] ZINC000173476438 1426650306 /nfs/dbraw/zinc/65/03/06/1426650306.db2.gz SFJSIDQRMBGBIF-UHFFFAOYSA-N 0 0 380.404 3.110 20 5 GGBDRN Cc1c(NCc2cc([N+](=O)[O-])ccc2OC(C)C)cccc1C(=O)NCCO ZINC000173475908 1426650521 /nfs/dbraw/zinc/65/05/21/1426650521.db2.gz FUOQTJLIFNURJE-UHFFFAOYSA-N 0 0 387.436 3.025 20 5 GGBDRN CN1CCCN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c2cc(Cl)ccc21 ZINC000173480789 1426654263 /nfs/dbraw/zinc/65/42/63/1426654263.db2.gz OQOYILKOABHMFI-UHFFFAOYSA-N 0 0 399.831 3.423 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000173483176 1426656814 /nfs/dbraw/zinc/65/68/14/1426656814.db2.gz YYKAECCTZPCVES-OAHLLOKOSA-N 0 0 378.450 3.245 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1 ZINC000173494868 1426666390 /nfs/dbraw/zinc/66/63/90/1426666390.db2.gz VNNOMIPENPVXMI-YLJYHZDGSA-N 0 0 386.452 3.082 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)CN(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000173504864 1426673557 /nfs/dbraw/zinc/67/35/57/1426673557.db2.gz GWPMSFKGCSRXGY-ZDUSSCGKSA-N 0 0 375.450 3.184 20 5 GGBDRN CC(C)Nc1ccc(F)cc1NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000173511258 1426680713 /nfs/dbraw/zinc/68/07/13/1426680713.db2.gz YSAPORKAYYSWCD-LBPRGKRZSA-N 0 0 388.399 3.311 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@H](C)Oc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000173514769 1426685712 /nfs/dbraw/zinc/68/57/12/1426685712.db2.gz WEWDBSGNTKMNRK-VIFPVBQESA-N 0 0 375.312 3.378 20 5 GGBDRN Cc1csc([C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000173522185 1426695438 /nfs/dbraw/zinc/69/54/38/1426695438.db2.gz SELCCSCZZMZMDZ-OAHLLOKOSA-N 0 0 375.454 3.222 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1coc(-c2ccccc2)n1 ZINC000173522121 1426696277 /nfs/dbraw/zinc/69/62/77/1426696277.db2.gz WHIMEKJNJHHMPE-UHFFFAOYSA-N 0 0 381.392 3.161 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2ccc(F)cc2O1 ZINC000173524255 1426697348 /nfs/dbraw/zinc/69/73/48/1426697348.db2.gz JJJYSYLLCMXPNG-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN O=C([C@@H]1SCCc2sccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000173532067 1426706612 /nfs/dbraw/zinc/70/66/12/1426706612.db2.gz MFPLQSWRUGHYIK-QGZVFWFLSA-N 0 0 389.502 3.336 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(-c3ccccc3C)nn2C)c(C)c1[N+](=O)[O-] ZINC000173540987 1426715863 /nfs/dbraw/zinc/71/58/63/1426715863.db2.gz LPCIXTAGYCIGKV-UHFFFAOYSA-N 0 0 382.424 3.146 20 5 GGBDRN C[C@H]1CN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)[C@H](c2ccccc2)CO1 ZINC000173542569 1426716628 /nfs/dbraw/zinc/71/66/28/1426716628.db2.gz KCPAPBNWCVTFOJ-KXBFYZLASA-N 0 0 379.420 3.273 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000173550270 1426723381 /nfs/dbraw/zinc/72/33/81/1426723381.db2.gz DRVASCPDQWAOOR-INIZCTEOSA-N 0 0 379.420 3.269 20 5 GGBDRN Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000173551512 1426724013 /nfs/dbraw/zinc/72/40/13/1426724013.db2.gz FNUFUZWERYFNBY-SFHVURJKSA-N 0 0 383.448 3.349 20 5 GGBDRN O=C([C@@H]1SCCc2sccc21)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560128 1426730261 /nfs/dbraw/zinc/73/02/61/1426730261.db2.gz QVIMNOPKRYBLJO-MEDUHNTESA-N 0 0 390.490 3.095 20 5 GGBDRN CCCOc1ccc(CCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000173559761 1426730299 /nfs/dbraw/zinc/73/02/99/1426730299.db2.gz AMIMBSDHKNLHKN-KRWDZBQOSA-N 0 0 398.463 3.424 20 5 GGBDRN C[C@@H](CCc1cccc(F)c1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560049 1426730348 /nfs/dbraw/zinc/73/03/48/1426730348.db2.gz FORILJSFSZTMCZ-WMLDXEAASA-N 0 0 386.427 3.411 20 5 GGBDRN COc1cc(CCNC(=O)N2Cc3ccccc3C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000173572239 1426739390 /nfs/dbraw/zinc/73/93/90/1426739390.db2.gz NKSCKZNIZJBAPD-CQSZACIVSA-N 0 0 399.447 3.311 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000173572681 1426739483 /nfs/dbraw/zinc/73/94/83/1426739483.db2.gz QKULVOGFQNFFCK-ZIAGYGMSSA-N 0 0 379.457 3.375 20 5 GGBDRN COc1cc(CCNC(=O)N2CCC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000173572571 1426739605 /nfs/dbraw/zinc/73/96/05/1426739605.db2.gz HCKXFKOJGRWLFZ-UKRRQHHQSA-N 0 0 377.441 3.129 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@H](C)CO1 ZINC000173573850 1426741029 /nfs/dbraw/zinc/74/10/29/1426741029.db2.gz OECSYNSYLBDEHY-IERDGZPVSA-N 0 0 395.459 3.254 20 5 GGBDRN COc1ccc(NC(=O)CN2C[C@H](c3ccccc3C)OC[C@H]2C)c([N+](=O)[O-])c1 ZINC000173575285 1426741967 /nfs/dbraw/zinc/74/19/67/1426741967.db2.gz QCIRDLYMDATQJT-FOIQADDNSA-N 0 0 399.447 3.312 20 5 GGBDRN COc1ccc(NC(=O)CN2C[C@@H](c3ccccc3C)OC[C@H]2C)c([N+](=O)[O-])c1 ZINC000173575272 1426741995 /nfs/dbraw/zinc/74/19/95/1426741995.db2.gz QCIRDLYMDATQJT-QRWLVFNGSA-N 0 0 399.447 3.312 20 5 GGBDRN Cc1ccccc1[C@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@H](C)CO1 ZINC000173575409 1426742706 /nfs/dbraw/zinc/74/27/06/1426742706.db2.gz PWIRHFIVQGOWPC-IIBYNOLFSA-N 0 0 395.459 3.254 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000173592531 1426756622 /nfs/dbraw/zinc/75/66/22/1426756622.db2.gz XUSSIJVFBAGCKD-RDTXWAMCSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000173592519 1426756925 /nfs/dbraw/zinc/75/69/25/1426756925.db2.gz XUSSIJVFBAGCKD-KDOFPFPSSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H](C)CO1 ZINC000173592551 1426757007 /nfs/dbraw/zinc/75/70/07/1426757007.db2.gz QZMGABUTNZCSLH-PBHICJAKSA-N 0 0 376.434 3.054 20 5 GGBDRN COc1cc(CCNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1O ZINC000173594177 1426758664 /nfs/dbraw/zinc/75/86/64/1426758664.db2.gz DAFIMDVTJIQDQQ-UHFFFAOYSA-N 0 0 384.310 3.300 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@H](C)CO1 ZINC000173595147 1426759539 /nfs/dbraw/zinc/75/95/39/1426759539.db2.gz DGRBVRCSTOIBNH-CJNGLKHVSA-N 0 0 394.424 3.193 20 5 GGBDRN CN(CC(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000173603190 1426775021 /nfs/dbraw/zinc/77/50/21/1426775021.db2.gz RNKUNTLDZVOCKU-UHFFFAOYSA-N 0 0 384.436 3.198 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C2CC2)s1 ZINC000173603874 1426776157 /nfs/dbraw/zinc/77/61/57/1426776157.db2.gz XGHSFXSXXYPTMK-INIZCTEOSA-N 0 0 383.433 3.427 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1C ZINC000173614050 1426790698 /nfs/dbraw/zinc/79/06/98/1426790698.db2.gz GMTMGRMWBZEXCO-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN CC(C)N1C(=S)N=NC1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000173614015 1426790773 /nfs/dbraw/zinc/79/07/73/1426790773.db2.gz FPYYDQNNOHMCPK-UHFFFAOYSA-N 0 0 389.481 3.005 20 5 GGBDRN CN(CC(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000173614907 1426792109 /nfs/dbraw/zinc/79/21/09/1426792109.db2.gz ONQHFPIVTPOIPN-UHFFFAOYSA-N 0 0 399.447 3.475 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H](C)Oc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000173616468 1426796902 /nfs/dbraw/zinc/79/69/02/1426796902.db2.gz UDWPDCJOAVHYSS-NSHDSACASA-N 0 0 391.811 3.079 20 5 GGBDRN CN(CC(=O)Nc1nc2c(s1)C(=O)CC(C)(C)C2)c1ccccc1[N+](=O)[O-] ZINC000173620151 1426800485 /nfs/dbraw/zinc/80/04/85/1426800485.db2.gz ZAHLZUHLHFOXGE-UHFFFAOYSA-N 0 0 388.449 3.281 20 5 GGBDRN COc1ccc(OCCN2CCO[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000173629575 1426802842 /nfs/dbraw/zinc/80/28/42/1426802842.db2.gz LRONJZAKEZLTLR-IBGZPJMESA-N 0 0 376.384 3.195 20 5 GGBDRN C[C@H](CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)c1cccc(F)c1 ZINC000173633268 1426803725 /nfs/dbraw/zinc/80/37/25/1426803725.db2.gz TUSVAVXYQXKNES-OAHLLOKOSA-N 0 0 399.422 3.292 20 5 GGBDRN Cc1cc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)ccc1[N+](=O)[O-] ZINC000173633903 1426804086 /nfs/dbraw/zinc/80/40/86/1426804086.db2.gz YPVMSWZLEZDOFE-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN O=C(Cc1cc(F)ccc1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173633718 1426804110 /nfs/dbraw/zinc/80/41/10/1426804110.db2.gz GFFUFQATPNZOGB-UHFFFAOYSA-N 0 0 376.359 3.486 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173634044 1426804117 /nfs/dbraw/zinc/80/41/17/1426804117.db2.gz KZKGZJRXBWFFSJ-UHFFFAOYSA-N 0 0 385.376 3.116 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000173633687 1426804187 /nfs/dbraw/zinc/80/41/87/1426804187.db2.gz XHIIFJREODXNFV-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN O=C(c1cc2ccccc2[nH]c1=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173634417 1426804550 /nfs/dbraw/zinc/80/45/50/1426804550.db2.gz KYZFPSYMJYKENQ-UHFFFAOYSA-N 0 0 393.399 3.120 20 5 GGBDRN O=C(c1cnc2ccccc2n1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173636422 1426805162 /nfs/dbraw/zinc/80/51/62/1426805162.db2.gz LXIJKZMXIDUZOF-UHFFFAOYSA-N 0 0 378.388 3.222 20 5 GGBDRN O=C(Cc1noc2ccccc12)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173638129 1426805823 /nfs/dbraw/zinc/80/58/23/1426805823.db2.gz VROCKMPSVDEXCN-UHFFFAOYSA-N 0 0 381.388 3.349 20 5 GGBDRN O=C(c1cnc2ccccc2c1O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173638626 1426805899 /nfs/dbraw/zinc/80/58/99/1426805899.db2.gz LRHRLLRAAOOFBW-UHFFFAOYSA-N 0 0 393.399 3.120 20 5 GGBDRN O=C(c1cc(F)cc2nc[nH]c21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173639007 1426806097 /nfs/dbraw/zinc/80/60/97/1426806097.db2.gz RWJPHZCSTBLWIR-UHFFFAOYSA-N 0 0 384.367 3.294 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173640855 1426806797 /nfs/dbraw/zinc/80/67/97/1426806797.db2.gz NBORFQAOPVVDNJ-UHFFFAOYSA-N 0 0 377.378 3.248 20 5 GGBDRN CN(C)[C@H](C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000173641074 1426806821 /nfs/dbraw/zinc/80/68/21/1426806821.db2.gz KGCBAKNDHHVYEF-FQEVSTJZSA-N 0 0 383.448 3.268 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173641057 1426806889 /nfs/dbraw/zinc/80/68/89/1426806889.db2.gz MQVCUMWGIDMIOK-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173645014 1426808721 /nfs/dbraw/zinc/80/87/21/1426808721.db2.gz KNROCOKPUBIRAB-UHFFFAOYSA-N 0 0 385.376 3.116 20 5 GGBDRN Cc1cc(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000173649977 1426809983 /nfs/dbraw/zinc/80/99/83/1426809983.db2.gz XEWYLRSWDUOVQH-GOSISDBHSA-N 0 0 381.432 3.328 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)on1 ZINC000173649964 1426809991 /nfs/dbraw/zinc/80/99/91/1426809991.db2.gz AXEDFNCWPGLCDZ-UHFFFAOYSA-N 0 0 398.423 3.306 20 5 GGBDRN O=C(NC[C@@H]1CCCCN1C(=O)c1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000173650144 1426810077 /nfs/dbraw/zinc/81/00/77/1426810077.db2.gz JJOOKSKBXRCUBB-INIZCTEOSA-N 0 0 385.395 3.159 20 5 GGBDRN CC(C)(C)OC(=O)CCCCCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000173652341 1426810953 /nfs/dbraw/zinc/81/09/53/1426810953.db2.gz QAQJOAFCJFPSJA-UHFFFAOYSA-N 0 0 376.413 3.103 20 5 GGBDRN CC(C)(C)OC(=O)NCc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2)o1 ZINC000173668348 1426815204 /nfs/dbraw/zinc/81/52/04/1426815204.db2.gz BXFBCGJKHRAGOD-UHFFFAOYSA-N 0 0 375.381 3.143 20 5 GGBDRN CN1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c2cc(Cl)ccc21 ZINC000173668952 1426815671 /nfs/dbraw/zinc/81/56/71/1426815671.db2.gz ZHWYHEJITFVVRR-UHFFFAOYSA-N 0 0 376.756 3.253 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)Cc1nccn1C(F)F ZINC000173675616 1426817522 /nfs/dbraw/zinc/81/75/22/1426817522.db2.gz HYLWQAHFACBFIJ-VIFPVBQESA-N 0 0 387.774 3.299 20 5 GGBDRN CN(C)C(=O)c1ccc(Cl)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000173678192 1426818566 /nfs/dbraw/zinc/81/85/66/1426818566.db2.gz PYAHNBFYRRGDMD-UHFFFAOYSA-N 0 0 390.827 3.025 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OCc2cccc(Cl)n2)c([N+](=O)[O-])c1 ZINC000173679658 1426818922 /nfs/dbraw/zinc/81/89/22/1426818922.db2.gz ITICEBIBYXABJY-UHFFFAOYSA-N 0 0 399.856 3.253 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000173679905 1426819211 /nfs/dbraw/zinc/81/92/11/1426819211.db2.gz MYWRGHUWSMVHJG-AWEZNQCLSA-N 0 0 389.481 3.005 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)Cc1nccn1C(F)F ZINC000173681080 1426819633 /nfs/dbraw/zinc/81/96/33/1426819633.db2.gz ONLIYBXHJJYNSC-VIFPVBQESA-N 0 0 387.774 3.299 20 5 GGBDRN C[C@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@H](c2ccccc2)CO1 ZINC000173683902 1426820388 /nfs/dbraw/zinc/82/03/88/1426820388.db2.gz SBOQLFJZMCPFDI-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@@H](c2ccccc2)CO1 ZINC000173683933 1426820476 /nfs/dbraw/zinc/82/04/76/1426820476.db2.gz SBOQLFJZMCPFDI-MGPUTAFESA-N 0 0 392.415 3.383 20 5 GGBDRN COC(=O)c1ccc(OCc2nc(CCc3ccccc3)no2)c([N+](=O)[O-])c1 ZINC000173685519 1426820793 /nfs/dbraw/zinc/82/07/93/1426820793.db2.gz NKEJRCADSHWVAV-UHFFFAOYSA-N 0 0 383.360 3.129 20 5 GGBDRN O=C(c1ccc2ccccc2c1O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173685264 1426820886 /nfs/dbraw/zinc/82/08/86/1426820886.db2.gz FLCAALVUBXCIIR-CQSZACIVSA-N 0 0 378.388 3.175 20 5 GGBDRN O=C([C@@H]1C[C@]12CCCc1ccccc12)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173684729 1426820906 /nfs/dbraw/zinc/82/09/06/1426820906.db2.gz KXURHZHTJRSIBS-BPXKWBHBSA-N 0 0 392.459 3.297 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](n2ccnc2)Cc2ccccc21 ZINC000173690214 1426822002 /nfs/dbraw/zinc/82/20/02/1426822002.db2.gz GVPYKOOQLPDIFR-QGZVFWFLSA-N 0 0 398.444 3.092 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](c2ccccc2)CO1 ZINC000173693984 1426823229 /nfs/dbraw/zinc/82/32/29/1426823229.db2.gz ASIWKSXTFDLJLK-FOIQADDNSA-N 0 0 392.415 3.383 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@H](COCc2ccccc2)C1 ZINC000173695183 1426823417 /nfs/dbraw/zinc/82/34/17/1426823417.db2.gz XNOQVRZDHDEIHS-KRWDZBQOSA-N 0 0 390.461 3.131 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@@H](COCc2ccccc2)C1 ZINC000173695196 1426823578 /nfs/dbraw/zinc/82/35/78/1426823578.db2.gz XNOQVRZDHDEIHS-QGZVFWFLSA-N 0 0 390.461 3.131 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](c2ccccc2)CO1 ZINC000173703141 1426826405 /nfs/dbraw/zinc/82/64/05/1426826405.db2.gz ZJAOJLKJYFPAQS-ORAYPTAESA-N 0 0 393.399 3.039 20 5 GGBDRN C[NH+](C)CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)cc1Cl ZINC000173708086 1426827540 /nfs/dbraw/zinc/82/75/40/1426827540.db2.gz ITDCVFACWFTUEU-UHFFFAOYSA-N 0 0 379.800 3.147 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])Oc1ccccc1Cl ZINC000173711183 1426828642 /nfs/dbraw/zinc/82/86/42/1426828642.db2.gz MJNUWDBPCLIPNX-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN COC[C@@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000173732135 1426833726 /nfs/dbraw/zinc/83/37/26/1426833726.db2.gz DHALEUUCUCBQQG-CYBMUJFWSA-N 0 0 382.800 3.422 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)c1 ZINC000173737739 1426835228 /nfs/dbraw/zinc/83/52/28/1426835228.db2.gz XJTMTSWIHRQKKD-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C12CCCC2 ZINC000173740498 1426836071 /nfs/dbraw/zinc/83/60/71/1426836071.db2.gz ACUFNHPGIMTFDS-CABCVRRESA-N 0 0 395.843 3.041 20 5 GGBDRN COC(=O)c1cc(C(=O)N2C[C@H](C)CN(C)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000173743338 1426836867 /nfs/dbraw/zinc/83/68/67/1426836867.db2.gz OGJISJZABKAQBD-CYBMUJFWSA-N 0 0 383.404 3.114 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)Oc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000173749029 1426839026 /nfs/dbraw/zinc/83/90/26/1426839026.db2.gz BOHCDONADYNJAF-UHFFFAOYSA-N 0 0 391.323 3.445 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173756510 1426841141 /nfs/dbraw/zinc/84/11/41/1426841141.db2.gz QUVDJKMANCQPRT-UHFFFAOYSA-N 0 0 383.282 3.494 20 5 GGBDRN COc1ccccc1C[C@@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000173760492 1426842777 /nfs/dbraw/zinc/84/27/77/1426842777.db2.gz VZRXGUXKEHTSHU-CQSZACIVSA-N 0 0 378.450 3.164 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000173761550 1426842961 /nfs/dbraw/zinc/84/29/61/1426842961.db2.gz UUPULSWHZITNJU-AWEZNQCLSA-N 0 0 378.450 3.164 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2cc(N(C)C)nc3ccccc23)c1[N+](=O)[O-] ZINC000173786747 1426851023 /nfs/dbraw/zinc/85/10/23/1426851023.db2.gz VQBCBUYUTWTKDF-UHFFFAOYSA-N 0 0 395.419 3.393 20 5 GGBDRN C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173798053 1426853912 /nfs/dbraw/zinc/85/39/12/1426853912.db2.gz STNRBGCIQCXBBV-AWEZNQCLSA-N 0 0 394.431 3.436 20 5 GGBDRN CC(C)CN(C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000173798302 1426854005 /nfs/dbraw/zinc/85/40/05/1426854005.db2.gz GXXOWCHJTHDZMS-UHFFFAOYSA-N 0 0 375.469 3.085 20 5 GGBDRN CC(=O)c1cccc(NC(=O)CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000173798842 1426854287 /nfs/dbraw/zinc/85/42/87/1426854287.db2.gz KEODSTMINAXDIJ-UHFFFAOYSA-N 0 0 397.431 3.279 20 5 GGBDRN C[C@H](C(=O)NC1CCCCC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173799634 1426854328 /nfs/dbraw/zinc/85/43/28/1426854328.db2.gz IERXAJXMVOARKL-OAHLLOKOSA-N 0 0 375.469 3.275 20 5 GGBDRN O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)Nc1ccc(F)cc1F ZINC000173799577 1426854383 /nfs/dbraw/zinc/85/43/83/1426854383.db2.gz VVCMDNLTXOWHSS-UHFFFAOYSA-N 0 0 391.374 3.355 20 5 GGBDRN O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)Nc1ccc(Cl)cn1 ZINC000173799143 1426854386 /nfs/dbraw/zinc/85/43/86/1426854386.db2.gz GOKCGZZAPFOIJX-UHFFFAOYSA-N 0 0 390.827 3.125 20 5 GGBDRN Cc1ccc(-c2ocnc2C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000173813156 1426858381 /nfs/dbraw/zinc/85/83/81/1426858381.db2.gz DMYHZOXKKULAPS-OAHLLOKOSA-N 0 0 393.403 3.280 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H](c2nc(C)cs2)C1 ZINC000173816890 1426859022 /nfs/dbraw/zinc/85/90/22/1426859022.db2.gz ZAVGAFMTYWSKTJ-CQSZACIVSA-N 0 0 395.506 3.490 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1c1noc(C(C)C)n1 ZINC000173821216 1426860192 /nfs/dbraw/zinc/86/01/92/1426860192.db2.gz STNSRBXIVJMSFN-CQSZACIVSA-N 0 0 394.453 3.189 20 5 GGBDRN CN(CC(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000173820827 1426860244 /nfs/dbraw/zinc/86/02/44/1426860244.db2.gz REEYDNHHSKYHFN-DYESRHJHSA-N 0 0 383.448 3.315 20 5 GGBDRN CN(C[C@@H]1CCCN1C(=O)c1cc(F)ccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000173826404 1426861470 /nfs/dbraw/zinc/86/14/70/1426861470.db2.gz BNGAZBUZQOEVFH-ZDUSSCGKSA-N 0 0 381.404 3.205 20 5 GGBDRN Cc1c(C(=O)N2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000173825604 1426861575 /nfs/dbraw/zinc/86/15/75/1426861575.db2.gz KHEFQVDCTVSMBN-CQSZACIVSA-N 0 0 377.441 3.375 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC1(c2cccc(F)c2)CCOCC1 ZINC000173844016 1426868165 /nfs/dbraw/zinc/86/81/65/1426868165.db2.gz BAZYUSJXYKPENK-UHFFFAOYSA-N 0 0 388.395 3.325 20 5 GGBDRN CC[NH+](CC)CCC[C@H](C)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000821188920 1426869333 /nfs/dbraw/zinc/86/93/33/1426869333.db2.gz GHLOYCGQDCKJGR-ZDUSSCGKSA-N 0 0 398.471 3.246 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1-c1nc(C2CC2)no1 ZINC000173850457 1426870639 /nfs/dbraw/zinc/87/06/39/1426870639.db2.gz SWNXHTPMEACJQL-UHFFFAOYSA-N 0 0 388.771 3.011 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cc(Cl)ccc1-c1nc(C2CC2)no1 ZINC000173852594 1426871687 /nfs/dbraw/zinc/87/16/87/1426871687.db2.gz GKFRUMTYLPZXNL-UHFFFAOYSA-N 0 0 388.771 3.011 20 5 GGBDRN O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173854082 1426871777 /nfs/dbraw/zinc/87/17/77/1426871777.db2.gz INDGGIOCTMPVPA-GFCCVEGCSA-N 0 0 393.321 3.149 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000173859273 1426873180 /nfs/dbraw/zinc/87/31/80/1426873180.db2.gz DKUUVLSNQARGDK-HNNXBMFYSA-N 0 0 389.456 3.034 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000173866513 1426875878 /nfs/dbraw/zinc/87/58/78/1426875878.db2.gz UTCZXKVJUYNXRL-HNNXBMFYSA-N 0 0 389.456 3.034 20 5 GGBDRN CCOc1ccccc1[C@H](CC(C)C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000173870928 1426877124 /nfs/dbraw/zinc/87/71/24/1426877124.db2.gz KTPPTFGEFWNJPA-KRWDZBQOSA-N 0 0 387.436 3.059 20 5 GGBDRN Cc1cc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)ccc1-n1cncn1 ZINC000173873229 1426878075 /nfs/dbraw/zinc/87/80/75/1426878075.db2.gz VOEKISKWYSWEGG-UHFFFAOYSA-N 0 0 379.420 3.237 20 5 GGBDRN CC(C)(C)OC(=O)NC1CCC(NC(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000173878864 1426879441 /nfs/dbraw/zinc/87/94/41/1426879441.db2.gz VQMANJMJCQVPJE-UHFFFAOYSA-N 0 0 377.441 3.089 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cn3nc(C4CC4)sc3=S)CC2)cc1 ZINC000173879156 1426879517 /nfs/dbraw/zinc/87/95/17/1426879517.db2.gz VTWKAWWXZCGJEH-UHFFFAOYSA-N 0 0 377.495 3.239 20 5 GGBDRN Cc1cnc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000173887958 1426881831 /nfs/dbraw/zinc/88/18/31/1426881831.db2.gz SKGKNSPSKCETPA-UHFFFAOYSA-N 0 0 376.438 3.113 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000173904194 1426886485 /nfs/dbraw/zinc/88/64/85/1426886485.db2.gz AFBYZGMOEUVHTC-UHFFFAOYSA-N 0 0 398.370 3.418 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ncccc1OCc1cccc(Cl)c1 ZINC000173906532 1426887171 /nfs/dbraw/zinc/88/71/71/1426887171.db2.gz NKKXRRQSEKSFQC-UHFFFAOYSA-N 0 0 387.783 3.057 20 5 GGBDRN Cc1cc(N(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)ncc1[N+](=O)[O-] ZINC000173914194 1426890458 /nfs/dbraw/zinc/89/04/58/1426890458.db2.gz HBCMLBHSTXVJTM-ZDUSSCGKSA-N 0 0 385.342 3.193 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCN1C(=O)OC(C)(C)C ZINC000173919518 1426892007 /nfs/dbraw/zinc/89/20/07/1426892007.db2.gz JAZIFMVBGQPSEW-LLVKDONJSA-N 0 0 383.832 3.330 20 5 GGBDRN C[C@@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CCN1C(=O)OC(C)(C)C ZINC000173920978 1426892720 /nfs/dbraw/zinc/89/27/20/1426892720.db2.gz NMQMFAVCWFKEBQ-DNGMOHDESA-N 0 0 375.425 3.076 20 5 GGBDRN Cc1sc(NC(=O)CS(=O)(=O)Cc2cccc([N+](=O)[O-])c2C)c(C)c1C ZINC000173929043 1426896041 /nfs/dbraw/zinc/89/60/41/1426896041.db2.gz MYCFNGWFJSDVCL-UHFFFAOYSA-N 0 0 396.490 3.443 20 5 GGBDRN CN(Cc1cc2ccccc2o1)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000173929181 1426896069 /nfs/dbraw/zinc/89/60/69/1426896069.db2.gz NXNKDMJGENMSCL-UHFFFAOYSA-N 0 0 377.360 3.194 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c2cc(Cl)ccc2O1 ZINC000173928104 1426896189 /nfs/dbraw/zinc/89/61/89/1426896189.db2.gz SYJWAUYSHCMQAD-SECBINFHSA-N 0 0 386.788 3.364 20 5 GGBDRN Cc1ccccc1NC(=O)CCS(=O)(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000173928909 1426896245 /nfs/dbraw/zinc/89/62/45/1426896245.db2.gz YTZUDLOORIZUEG-UHFFFAOYSA-N 0 0 376.434 3.155 20 5 GGBDRN Cc1cccc(CS(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000173930569 1426897301 /nfs/dbraw/zinc/89/73/01/1426897301.db2.gz GOPIKSQDLGZPAR-UHFFFAOYSA-N 0 0 390.461 3.276 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)c3ccccc3Cl)CC2)cc1 ZINC000173930697 1426897322 /nfs/dbraw/zinc/89/73/22/1426897322.db2.gz GWRHABMKNDFEKV-UHFFFAOYSA-N 0 0 396.852 3.480 20 5 GGBDRN CC(C)(Cc1ccc(Cl)cc1Cl)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000173937104 1426899452 /nfs/dbraw/zinc/89/94/52/1426899452.db2.gz GEHPABGPUIIVLB-UHFFFAOYSA-N 0 0 398.246 3.201 20 5 GGBDRN COc1ccc2c(c1)N(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C[C@H](C)O2 ZINC000173944105 1426902403 /nfs/dbraw/zinc/90/24/03/1426902403.db2.gz UAUNUIBQBMUEAT-LBPRGKRZSA-N 0 0 382.376 3.441 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC2(c3cccc(F)c3)CCOCC2)cc1[N+](=O)[O-] ZINC000173959019 1426909813 /nfs/dbraw/zinc/90/98/13/1426909813.db2.gz YWVPHNDENATDJP-UHFFFAOYSA-N 0 0 394.424 3.027 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@H](O)c2ccc(OC(F)(F)F)cc2)nc1-c1ccncc1 ZINC000173959105 1426910242 /nfs/dbraw/zinc/91/02/42/1426910242.db2.gz IVBJUGWJVXVXRP-HNNXBMFYSA-N 0 0 394.309 3.486 20 5 GGBDRN Cc1cccc([C@H](C)S(=O)(=O)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1 ZINC000173975590 1426920749 /nfs/dbraw/zinc/92/07/49/1426920749.db2.gz DYVHPGKFIVABKY-ZDUSSCGKSA-N 0 0 377.418 3.446 20 5 GGBDRN C[C@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000173985560 1426927803 /nfs/dbraw/zinc/92/78/03/1426927803.db2.gz UOOXFTYRYDFAPU-KPZWWZAWSA-N 0 0 387.823 3.198 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000173987890 1426928513 /nfs/dbraw/zinc/92/85/13/1426928513.db2.gz KEIDNAJENCCHQA-CYBMUJFWSA-N 0 0 388.804 3.053 20 5 GGBDRN CC(C)C[C@@H](CCO)CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000173990185 1426929697 /nfs/dbraw/zinc/92/96/97/1426929697.db2.gz IBACAIPITYDOET-LLVKDONJSA-N 0 0 380.413 3.048 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)c2nc3sccn3c2[N+](=O)[O-])n1 ZINC000173991823 1426930461 /nfs/dbraw/zinc/93/04/61/1426930461.db2.gz JTDYNCKYPDWWCI-SNVBAGLBSA-N 0 0 380.430 3.057 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)c2nc3sccn3c2[N+](=O)[O-])n1 ZINC000173991812 1426930622 /nfs/dbraw/zinc/93/06/22/1426930622.db2.gz JTDYNCKYPDWWCI-JTQLQIEISA-N 0 0 380.430 3.057 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c2ccc(F)cc2O1 ZINC000174013385 1426943245 /nfs/dbraw/zinc/94/32/45/1426943245.db2.gz UEQNXLDPSALWSI-JTQLQIEISA-N 0 0 383.335 3.003 20 5 GGBDRN CCc1ccc(C(=O)Nn2cnc3sc4c(c3c2=O)CCCC4)cc1[N+](=O)[O-] ZINC000174028723 1426953755 /nfs/dbraw/zinc/95/37/55/1426953755.db2.gz YVERSCAEEAKIJR-UHFFFAOYSA-N 0 0 398.444 3.191 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C2CC2)s1 ZINC000174029188 1426954219 /nfs/dbraw/zinc/95/42/19/1426954219.db2.gz MODFROULWIDCMB-INIZCTEOSA-N 0 0 384.417 3.082 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(c3cc(C)nc(C(C)C)n3)CC2)cc1[N+](=O)[O-] ZINC000174031437 1426955050 /nfs/dbraw/zinc/95/50/50/1426955050.db2.gz RFLYOIDIMHFINM-UHFFFAOYSA-N 0 0 397.479 3.341 20 5 GGBDRN CCOc1cc(C(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)c([N+](=O)[O-])cc1OC ZINC000174054773 1426974823 /nfs/dbraw/zinc/97/48/23/1426974823.db2.gz IZJWPJQLYHDNRP-CABCVRRESA-N 0 0 388.424 3.112 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1F ZINC000174054277 1426975176 /nfs/dbraw/zinc/97/51/76/1426975176.db2.gz JCGXVFRKLKUSAG-AREMUKBSSA-N 0 0 377.397 3.298 20 5 GGBDRN O=C(N[C@H]1COc2ccccc2C1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174058969 1426979016 /nfs/dbraw/zinc/97/90/16/1426979016.db2.gz VFTMRJKZXDZQGV-MRXNPFEDSA-N 0 0 397.431 3.151 20 5 GGBDRN C[C@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1nc(C2CCCCC2)no1 ZINC000174067464 1426984250 /nfs/dbraw/zinc/98/42/50/1426984250.db2.gz NOQRKYASSBMFQM-JTQLQIEISA-N 0 0 398.416 3.204 20 5 GGBDRN Cc1nn([C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)c(C)c1[N+](=O)[O-] ZINC000174070384 1426985629 /nfs/dbraw/zinc/98/56/29/1426985629.db2.gz WDUJDYJUSDEIFC-AWEZNQCLSA-N 0 0 380.351 3.378 20 5 GGBDRN CCc1ccc(C(=O)N2CCCN(C(=O)c3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC000174070888 1426986299 /nfs/dbraw/zinc/98/62/99/1426986299.db2.gz ROVNMPDUJVIGKA-UHFFFAOYSA-N 0 0 399.422 3.285 20 5 GGBDRN CCc1ccc(C(=O)N2CCCN(C(=O)c3cccc(F)c3)CC2)cc1[N+](=O)[O-] ZINC000174071529 1426986515 /nfs/dbraw/zinc/98/65/15/1426986515.db2.gz OHDLPRHSAYHORG-UHFFFAOYSA-N 0 0 399.422 3.285 20 5 GGBDRN Cc1nn(C)c(C)c1CNC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000174075056 1426988948 /nfs/dbraw/zinc/98/89/48/1426988948.db2.gz VQWFCZSVGKMCQS-KBPBESRZSA-N 0 0 399.495 3.357 20 5 GGBDRN CN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174083507 1426992928 /nfs/dbraw/zinc/99/29/28/1426992928.db2.gz XOWBGUBHOCZERH-LBPRGKRZSA-N 0 0 383.832 3.330 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)cc1[N+](=O)[O-] ZINC000174086557 1426994759 /nfs/dbraw/zinc/99/47/59/1426994759.db2.gz ZTYDKISEJCTLPN-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN CCc1ccc(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC000174090008 1426996248 /nfs/dbraw/zinc/99/62/48/1426996248.db2.gz KUXIGKZNNRDTLX-UHFFFAOYSA-N 0 0 399.422 3.331 20 5 GGBDRN Cc1nn(C)c(C)c1CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000174090563 1426996823 /nfs/dbraw/zinc/99/68/23/1426996823.db2.gz QNKUWKDKERQFLD-UHFFFAOYSA-N 0 0 399.373 3.082 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000174093399 1426998552 /nfs/dbraw/zinc/99/85/52/1426998552.db2.gz BDAUBAHNDARNFC-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN CC[C@@H]1CN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1c1ccccc1 ZINC000174093947 1426999489 /nfs/dbraw/zinc/99/94/89/1426999489.db2.gz KZQYCHSBKGEUPQ-UZLBHIALSA-N 0 0 395.459 3.367 20 5 GGBDRN CC[C@@H]1CN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1c1ccccc1 ZINC000174093975 1426999528 /nfs/dbraw/zinc/99/95/28/1426999528.db2.gz KZQYCHSBKGEUPQ-OXQOHEQNSA-N 0 0 395.459 3.367 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000174094425 1427000091 /nfs/dbraw/zinc/00/00/91/1427000091.db2.gz PRKNACWUMYCJBQ-WMLDXEAASA-N 0 0 376.434 3.054 20 5 GGBDRN CCN(CC1CCN(Cn2nc(C)c([N+](=O)[O-])c2C)CC1)C(=O)OC(C)(C)C ZINC000174094554 1427000397 /nfs/dbraw/zinc/00/03/97/1427000397.db2.gz LFTIQDIGLVAJBQ-UHFFFAOYSA-N 0 0 395.504 3.335 20 5 GGBDRN O=[N+]([O-])c1cc(N[C@H](C[NH+]2CCCC2)c2ccccc2)ccc1-c1nnn[n-]1 ZINC000823634194 1427000494 /nfs/dbraw/zinc/00/04/94/1427000494.db2.gz CJVKVVZLFOBDQO-QGZVFWFLSA-N 0 0 379.424 3.024 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H](c2ccccc2)CO1 ZINC000174095889 1427000736 /nfs/dbraw/zinc/00/07/36/1427000736.db2.gz PDBTTYGGWJCJBB-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN Cc1cc(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c(C)n1CCc1ccccc1 ZINC000174099236 1427002053 /nfs/dbraw/zinc/00/20/53/1427002053.db2.gz XVHMQZZDAIFSJM-UHFFFAOYSA-N 0 0 379.416 3.300 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000174101838 1427002527 /nfs/dbraw/zinc/00/25/27/1427002527.db2.gz RZILDGAAGAYIAR-UHFFFAOYSA-N 0 0 377.441 3.287 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)n2)cc1C ZINC000174100622 1427002756 /nfs/dbraw/zinc/00/27/56/1427002756.db2.gz MKTBGDDYSAHPJG-UHFFFAOYSA-N 0 0 384.417 3.136 20 5 GGBDRN C[C@@H](C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(F)c1 ZINC000174105088 1427004171 /nfs/dbraw/zinc/00/41/71/1427004171.db2.gz VKXSWDZDVWANAA-LLVKDONJSA-N 0 0 394.786 3.464 20 5 GGBDRN CC[C@@H](C)C[C@H](C)NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000174104218 1427004234 /nfs/dbraw/zinc/00/42/34/1427004234.db2.gz FEASSRGLDMRUQL-NEPJUHHUSA-N 0 0 377.470 3.429 20 5 GGBDRN Cc1c(F)cccc1NC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000174109341 1427006136 /nfs/dbraw/zinc/00/61/36/1427006136.db2.gz CXYUTHBCCDVFSX-NSHDSACASA-N 0 0 375.331 3.173 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000174110483 1427006529 /nfs/dbraw/zinc/00/65/29/1427006529.db2.gz DFZNCYJBKOFJSG-OAHLLOKOSA-N 0 0 389.456 3.034 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(NS(=O)(=O)CC)cc2)cc1[N+](=O)[O-] ZINC000174112103 1427007248 /nfs/dbraw/zinc/00/72/48/1427007248.db2.gz LYJPHJRBQDJSKZ-UHFFFAOYSA-N 0 0 377.422 3.171 20 5 GGBDRN C[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000174126580 1427013156 /nfs/dbraw/zinc/01/31/56/1427013156.db2.gz YORZLMQBJUBBGY-QAPCUYQASA-N 0 0 383.448 3.426 20 5 GGBDRN CCc1ccc(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000174129656 1427014457 /nfs/dbraw/zinc/01/44/57/1427014457.db2.gz YZKPXYXOLWVGBK-SFHVURJKSA-N 0 0 381.432 3.251 20 5 GGBDRN CCc1nc(CN2CCN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CC2)cs1 ZINC000174129371 1427014568 /nfs/dbraw/zinc/01/45/68/1427014568.db2.gz FEDDWKZXEVGFRZ-UHFFFAOYSA-N 0 0 388.493 3.134 20 5 GGBDRN CCc1ccc(C(=O)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1[N+](=O)[O-] ZINC000174131599 1427015961 /nfs/dbraw/zinc/01/59/61/1427015961.db2.gz AHKKIOVJAHJMIB-LJQANCHMSA-N 0 0 397.431 3.205 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)C1 ZINC000174151010 1427022509 /nfs/dbraw/zinc/02/25/09/1427022509.db2.gz PHXRTYAERHIEBP-YOEHRIQHSA-N 0 0 375.469 3.314 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)C1 ZINC000174150975 1427022786 /nfs/dbraw/zinc/02/27/86/1427022786.db2.gz PHXRTYAERHIEBP-RHSMWYFYSA-N 0 0 375.469 3.314 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccccc2)nc1 ZINC000174160778 1427026766 /nfs/dbraw/zinc/02/67/66/1427026766.db2.gz XALVRZONHZCJSP-UHFFFAOYSA-N 0 0 391.387 3.293 20 5 GGBDRN O=C(COC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCc2ccccc21 ZINC000174165662 1427028460 /nfs/dbraw/zinc/02/84/60/1427028460.db2.gz BFTZSDCANIWUEZ-UHFFFAOYSA-N 0 0 394.305 3.360 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)NCc2ccc([N+](=O)[O-])cc2)n1 ZINC000174166030 1427028912 /nfs/dbraw/zinc/02/89/12/1427028912.db2.gz SAKNHVQLQLVSGD-CYBMUJFWSA-N 0 0 391.428 3.053 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000174169439 1427030551 /nfs/dbraw/zinc/03/05/51/1427030551.db2.gz KLAPRZXTHJHQGS-LBPRGKRZSA-N 0 0 377.401 3.375 20 5 GGBDRN C[C@H]1CN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2NC1=O ZINC000174182378 1427036488 /nfs/dbraw/zinc/03/64/88/1427036488.db2.gz HKLFEYPPYUOEKQ-NSHDSACASA-N 0 0 388.811 3.282 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000174183813 1427037291 /nfs/dbraw/zinc/03/72/91/1427037291.db2.gz UEMRVDZLBLCSHJ-AWEZNQCLSA-N 0 0 395.419 3.350 20 5 GGBDRN C[C@H](NC(=O)Nc1cccc(N2CCCNC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000174186026 1427038352 /nfs/dbraw/zinc/03/83/52/1427038352.db2.gz DCKFTUYUZRQMAF-ZDUSSCGKSA-N 0 0 383.408 3.397 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)n1 ZINC000174187942 1427040082 /nfs/dbraw/zinc/04/00/82/1427040082.db2.gz YQKFRFFVLMLZSM-UHFFFAOYSA-N 0 0 390.469 3.061 20 5 GGBDRN Cc1cccc(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)c1[N+](=O)[O-] ZINC000174189766 1427041029 /nfs/dbraw/zinc/04/10/29/1427041029.db2.gz JOJYCTVYZXJIIB-UHFFFAOYSA-N 0 0 382.464 3.368 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(c2ccc(N(C)C)cc2)CC1 ZINC000174190957 1427042065 /nfs/dbraw/zinc/04/20/65/1427042065.db2.gz KFRSYYWQTGOEMB-UHFFFAOYSA-N 0 0 382.464 3.368 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccnn2-c2ccccc2)cc([N+](=O)[O-])c1 ZINC000174199395 1427046085 /nfs/dbraw/zinc/04/60/85/1427046085.db2.gz JOVAEMJQBAKUCB-UHFFFAOYSA-N 0 0 380.360 3.210 20 5 GGBDRN Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1-n1cncn1 ZINC000174214668 1427054500 /nfs/dbraw/zinc/05/45/00/1427054500.db2.gz HFIYBDKTKDYYDS-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000174221452 1427057296 /nfs/dbraw/zinc/05/72/96/1427057296.db2.gz OPIFJESALPNGQV-UHFFFAOYSA-N 0 0 382.342 3.048 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)NCC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000174221116 1427057497 /nfs/dbraw/zinc/05/74/97/1427057497.db2.gz QKVWLBFLUJMCPR-UHFFFAOYSA-N 0 0 382.342 3.048 20 5 GGBDRN O=C(NC[C@H]1Cc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242104 1427065813 /nfs/dbraw/zinc/06/58/13/1427065813.db2.gz RJEUQOZSBOSEGY-MRXNPFEDSA-N 0 0 381.432 3.488 20 5 GGBDRN CC(=O)Nc1nc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000174242689 1427066421 /nfs/dbraw/zinc/06/64/21/1427066421.db2.gz YSOMPUQVUNZIOQ-UHFFFAOYSA-N 0 0 376.438 3.053 20 5 GGBDRN O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N(C1CC1)C1CCCC1 ZINC000174244418 1427066893 /nfs/dbraw/zinc/06/68/93/1427066893.db2.gz HROHLROQQFGDOM-UHFFFAOYSA-N 0 0 387.480 3.372 20 5 GGBDRN C[C@H](c1nnnn1-c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174246277 1427067833 /nfs/dbraw/zinc/06/78/33/1427067833.db2.gz TWOIBDJOUKGNOI-OAHLLOKOSA-N 0 0 394.435 3.175 20 5 GGBDRN CC[C@@H]1CCCCN1C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174246031 1427067883 /nfs/dbraw/zinc/06/78/83/1427067883.db2.gz GJROHXVASAFEQO-MRXNPFEDSA-N 0 0 375.469 3.229 20 5 GGBDRN C[C@@H](C(=O)NCc1cccs1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174247038 1427068386 /nfs/dbraw/zinc/06/83/86/1427068386.db2.gz FQXYDWBNKJNPDA-AWEZNQCLSA-N 0 0 389.477 3.204 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174249344 1427069825 /nfs/dbraw/zinc/06/98/25/1427069825.db2.gz CZWRKPRWIIVOQE-BEFAXECRSA-N 0 0 375.469 3.133 20 5 GGBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174278507 1427081211 /nfs/dbraw/zinc/08/12/11/1427081211.db2.gz YOHYGNOSZLVQBM-OAHLLOKOSA-N 0 0 399.447 3.484 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cccc(N2CCCNC2=O)c1 ZINC000174288853 1427087239 /nfs/dbraw/zinc/08/72/39/1427087239.db2.gz PTKLRWAEXCKECF-UHFFFAOYSA-N 0 0 397.435 3.345 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000174300893 1427092173 /nfs/dbraw/zinc/09/21/73/1427092173.db2.gz VDWKLUHKRQQOTC-JSGCOSHPSA-N 0 0 387.465 3.279 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(CCc1ccc(C)cc1)CC(F)(F)F ZINC000174302244 1427092499 /nfs/dbraw/zinc/09/24/99/1427092499.db2.gz ZPNJULCJHGJDRU-UHFFFAOYSA-N 0 0 398.385 3.432 20 5 GGBDRN Cc1nc(CNC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])sc1C ZINC000174307075 1427094434 /nfs/dbraw/zinc/09/44/34/1427094434.db2.gz FJEGZZKDBGYNME-UHFFFAOYSA-N 0 0 377.470 3.278 20 5 GGBDRN C[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)Oc1ccccc1F ZINC000174309658 1427095447 /nfs/dbraw/zinc/09/54/47/1427095447.db2.gz UJQLXLBQFGGRPQ-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN C[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)Oc1ccccc1F ZINC000174314862 1427097837 /nfs/dbraw/zinc/09/78/37/1427097837.db2.gz AVXXXKQSWFIMRM-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN C[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)Oc1ccccc1F ZINC000174314876 1427097906 /nfs/dbraw/zinc/09/79/06/1427097906.db2.gz AVXXXKQSWFIMRM-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN Cc1nc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)sc1C ZINC000174324130 1427101942 /nfs/dbraw/zinc/10/19/42/1427101942.db2.gz LNMMMNHQEZFUFV-UHFFFAOYSA-N 0 0 390.465 3.421 20 5 GGBDRN C[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1nc(-c2cccc(F)c2)no1 ZINC000174332139 1427105306 /nfs/dbraw/zinc/10/53/06/1427105306.db2.gz IKRDMOVFZVWBPA-NWDGAFQWSA-N 0 0 399.382 3.462 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)c2cc(Cl)ccc2Cl)c([N+](=O)[O-])c1 ZINC000174333957 1427106130 /nfs/dbraw/zinc/10/61/30/1427106130.db2.gz LUNOKCDJJTVYDO-UHFFFAOYSA-N 0 0 398.202 3.269 20 5 GGBDRN Cc1[nH]c2c(cccc2C(=O)OCCNc2ccc(C(N)=O)cc2[N+](=O)[O-])c1C ZINC000174334109 1427106214 /nfs/dbraw/zinc/10/62/14/1427106214.db2.gz IMAGOCBVUGELND-UHFFFAOYSA-N 0 0 396.403 3.061 20 5 GGBDRN Cc1c2ccccc2oc1C(=O)OCCNc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000174334170 1427106669 /nfs/dbraw/zinc/10/66/69/1427106669.db2.gz LWSHHMWIDFAPKA-UHFFFAOYSA-N 0 0 383.360 3.017 20 5 GGBDRN Cc1c(C(=O)NC[C@H](C)Oc2ccccc2F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000174334704 1427106980 /nfs/dbraw/zinc/10/69/80/1427106980.db2.gz ITWIZESLMOLISV-JTQLQIEISA-N 0 0 391.355 3.456 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(N3CCCCC3)cc2)no1 ZINC000174337173 1427108369 /nfs/dbraw/zinc/10/83/69/1427108369.db2.gz DCHLMXGLYRKUDF-UHFFFAOYSA-N 0 0 382.424 3.383 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000174343242 1427111326 /nfs/dbraw/zinc/11/13/26/1427111326.db2.gz OQZATGYZPURHPU-RDJZCZTQSA-N 0 0 391.468 3.337 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000174343260 1427111444 /nfs/dbraw/zinc/11/14/44/1427111444.db2.gz OQZATGYZPURHPU-WBVHZDCISA-N 0 0 391.468 3.337 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000174344059 1427111661 /nfs/dbraw/zinc/11/16/61/1427111661.db2.gz BOBRTKQHOBQSEC-RYUDHWBXSA-N 0 0 383.470 3.470 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)Oc1ccc(F)cc1 ZINC000174361619 1427120044 /nfs/dbraw/zinc/12/00/44/1427120044.db2.gz CFXZXBJBPYLIGP-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN O=C(OC[C@H]1CCN(c2ccccc2)C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000174374206 1427126085 /nfs/dbraw/zinc/12/60/85/1427126085.db2.gz BPRAKSWETSXOQF-INIZCTEOSA-N 0 0 392.415 3.464 20 5 GGBDRN Cc1c(C(=O)NC[C@H](C)Oc2ccc(F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000174378233 1427128441 /nfs/dbraw/zinc/12/84/41/1427128441.db2.gz CJBJFJSWELWQIF-JTQLQIEISA-N 0 0 377.328 3.148 20 5 GGBDRN O=C(OC[C@@H]1CCN(c2ccccc2)C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000174382607 1427130023 /nfs/dbraw/zinc/13/00/23/1427130023.db2.gz QVAPVFLDGHIFSK-MRXNPFEDSA-N 0 0 392.415 3.464 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000174383700 1427130869 /nfs/dbraw/zinc/13/08/69/1427130869.db2.gz DEINABBNAOAPGO-NEPJUHHUSA-N 0 0 399.900 3.111 20 5 GGBDRN C[C@@H](CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1(C)OCCO1 ZINC000174389387 1427133561 /nfs/dbraw/zinc/13/35/61/1427133561.db2.gz LFULKPPITRVDLB-GFCCVEGCSA-N 0 0 391.449 3.237 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000174394645 1427136604 /nfs/dbraw/zinc/13/66/04/1427136604.db2.gz RUGKCYGJDOYSGO-DGCLKSJQSA-N 0 0 375.450 3.183 20 5 GGBDRN Cc1ccccc1[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000174397853 1427138339 /nfs/dbraw/zinc/13/83/39/1427138339.db2.gz DJSKPKYTCGBZRU-FZKQIMNGSA-N 0 0 385.376 3.414 20 5 GGBDRN CC(C)NC(=O)CCCC(=O)OCc1ccc([N+](=O)[O-])cc1Br ZINC000174400961 1427140257 /nfs/dbraw/zinc/14/02/57/1427140257.db2.gz QWXCFQKTBGJDJY-UHFFFAOYSA-N 0 0 387.230 3.095 20 5 GGBDRN Cc1nn(CCC(=O)N2C[C@@H](c3ccccc3C)OC[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000174421216 1427150229 /nfs/dbraw/zinc/15/02/29/1427150229.db2.gz LJYCZOQFIGEKED-KDOFPFPSSA-N 0 0 386.452 3.095 20 5 GGBDRN CN1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2ccc(F)cc21 ZINC000174442951 1427158798 /nfs/dbraw/zinc/15/87/98/1427158798.db2.gz CFGQEIBPRWITIO-UHFFFAOYSA-N 0 0 381.367 3.016 20 5 GGBDRN CN1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccc(F)cc21 ZINC000174446755 1427159944 /nfs/dbraw/zinc/15/99/44/1427159944.db2.gz NRZXLVQFCLVEDI-UHFFFAOYSA-N 0 0 381.367 3.016 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2nc3cc(F)ccc3[nH]2)cc1SC ZINC000174452623 1427162602 /nfs/dbraw/zinc/16/26/02/1427162602.db2.gz PDARFXWNDSCTKY-UHFFFAOYSA-N 0 0 390.396 3.271 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCN(C)c3cc(F)ccc32)cc([N+](=O)[O-])c1 ZINC000174459889 1427166578 /nfs/dbraw/zinc/16/65/78/1427166578.db2.gz VNZIVJHWIHKKIR-UHFFFAOYSA-N 0 0 387.367 3.007 20 5 GGBDRN C[C@](O)(CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000174464997 1427169035 /nfs/dbraw/zinc/16/90/35/1427169035.db2.gz YTYVAUAUOUIICD-IBGZPJMESA-N 0 0 393.390 3.089 20 5 GGBDRN Cc1c(C(=O)N2CCOC3(CCCCC3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000174468048 1427169991 /nfs/dbraw/zinc/16/99/91/1427169991.db2.gz FCVDQMPBNDHXGQ-UHFFFAOYSA-N 0 0 377.397 3.295 20 5 GGBDRN O=C(Nc1nc2ccc(F)cn2n1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000174474915 1427172662 /nfs/dbraw/zinc/17/26/62/1427172662.db2.gz KYTPZOAKYIAPRD-UHFFFAOYSA-N 0 0 384.371 3.019 20 5 GGBDRN COc1ccc(CCNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000174482201 1427176506 /nfs/dbraw/zinc/17/65/06/1427176506.db2.gz CFJBLZPZNVMJDU-UHFFFAOYSA-N 0 0 399.447 3.399 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000174484956 1427177155 /nfs/dbraw/zinc/17/71/55/1427177155.db2.gz QLLDDNWFAXZIPT-LJQANCHMSA-N 0 0 375.425 3.021 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000174484969 1427177244 /nfs/dbraw/zinc/17/72/44/1427177244.db2.gz QLLDDNWFAXZIPT-IBGZPJMESA-N 0 0 375.425 3.021 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCC(C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000174491081 1427179456 /nfs/dbraw/zinc/17/94/56/1427179456.db2.gz DAWNNXCLWGGGCV-LJQANCHMSA-N 0 0 387.480 3.402 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nc2cc(F)ccc2[nH]1 ZINC000174504607 1427189558 /nfs/dbraw/zinc/18/95/58/1427189558.db2.gz IDNXNVSVZYSHLG-LLVKDONJSA-N 0 0 388.424 3.450 20 5 GGBDRN CCOc1cc(N2CCC(OC(=O)c3c(C)noc3C)CC2)ccc1[N+](=O)[O-] ZINC000174550802 1427219447 /nfs/dbraw/zinc/21/94/47/1427219447.db2.gz FJGCGHFHWCJYDR-UHFFFAOYSA-N 0 0 389.408 3.424 20 5 GGBDRN C[C@@H](CCc1cccn1C)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000174553561 1427220903 /nfs/dbraw/zinc/22/09/03/1427220903.db2.gz XELXKBAWVDRAAI-ZDUSSCGKSA-N 0 0 379.844 3.493 20 5 GGBDRN CC[NH+](CC)Cc1ccc(CNc2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)cc1 ZINC000821197927 1427223544 /nfs/dbraw/zinc/22/35/44/1427223544.db2.gz OXKANXFXNBMHMH-UHFFFAOYSA-N 0 0 381.440 3.229 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@@H](C)CCc2cccn2C)cc1[N+](=O)[O-] ZINC000174565240 1427226754 /nfs/dbraw/zinc/22/67/54/1427226754.db2.gz VFDORPXEXFJKFV-AWEZNQCLSA-N 0 0 391.493 3.313 20 5 GGBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000174571974 1427232014 /nfs/dbraw/zinc/23/20/14/1427232014.db2.gz ZDDGBCFQUMRZMY-OAHLLOKOSA-N 0 0 394.431 3.492 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000174571965 1427232516 /nfs/dbraw/zinc/23/25/16/1427232516.db2.gz ZDDGBCFQUMRZMY-HNNXBMFYSA-N 0 0 394.431 3.492 20 5 GGBDRN CC(C)C[C@@H]1CCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C1 ZINC000174585957 1427241677 /nfs/dbraw/zinc/24/16/77/1427241677.db2.gz IBUWPXYESMKQAH-ZDUSSCGKSA-N 0 0 389.481 3.383 20 5 GGBDRN CC(C)C[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000174585243 1427241688 /nfs/dbraw/zinc/24/16/88/1427241688.db2.gz PDVKCWWUKBOYRU-KGLIPLIRSA-N 0 0 379.482 3.156 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CC[C@H](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000174589297 1427244585 /nfs/dbraw/zinc/24/45/85/1427244585.db2.gz JHAGMGRYCMDMLW-APWZRJJASA-N 0 0 387.480 3.402 20 5 GGBDRN Cc1cccc(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000174598956 1427250228 /nfs/dbraw/zinc/25/02/28/1427250228.db2.gz SVLROXSVLRKDQM-UHFFFAOYSA-N 0 0 395.459 3.114 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OC[C@@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000174609939 1427260121 /nfs/dbraw/zinc/26/01/21/1427260121.db2.gz KFPBBLUOVIZKRL-VEGGFIAOSA-N 0 0 380.400 3.200 20 5 GGBDRN O=C(NCCc1cccc(O)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174614364 1427262661 /nfs/dbraw/zinc/26/26/61/1427262661.db2.gz WVHDGRKBEYXNBU-UHFFFAOYSA-N 0 0 385.420 3.096 20 5 GGBDRN Cn1c2ccc(F)cc2nc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174614458 1427262867 /nfs/dbraw/zinc/26/28/67/1427262867.db2.gz IBHOMIUCQPTRBI-UHFFFAOYSA-N 0 0 397.410 3.476 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccc(F)cc1)CC(F)(F)F ZINC000174615492 1427263802 /nfs/dbraw/zinc/26/38/02/1427263802.db2.gz VDTGKJOSPDWVLK-UHFFFAOYSA-N 0 0 388.321 3.220 20 5 GGBDRN Cc1cc(NC(=O)C(=O)NCc2ccccc2[N+](=O)[O-])c2cccnc2c1C ZINC000174619512 1427266581 /nfs/dbraw/zinc/26/65/81/1427266581.db2.gz HKGYJWFOABWKLY-UHFFFAOYSA-N 0 0 378.388 3.015 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3ccc([N+](=O)[O-])c(C)c3)n2)c1 ZINC000174637318 1427280083 /nfs/dbraw/zinc/28/00/83/1427280083.db2.gz RLHIHPZLMUBLHA-GFCCVEGCSA-N 0 0 382.376 3.453 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)CSc2nc(-c3ccc(F)cc3)cs2)c1 ZINC000174672235 1427300748 /nfs/dbraw/zinc/30/07/48/1427300748.db2.gz WXJKKUZMIVPTDJ-CYBMUJFWSA-N 0 0 380.426 3.207 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000174673284 1427301221 /nfs/dbraw/zinc/30/12/21/1427301221.db2.gz OAFFEYJJUWQNRL-UHFFFAOYSA-N 0 0 393.465 3.246 20 5 GGBDRN Cc1c(Cl)cccc1-n1ccnc1SC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174687152 1427310280 /nfs/dbraw/zinc/31/02/80/1427310280.db2.gz KAFLYQVFKUQHMB-CYBMUJFWSA-N 0 0 393.856 3.092 20 5 GGBDRN COc1ccc(-c2ccc(CNC(=O)c3c([N+](=O)[O-])c(C)nn3C)cc2)cc1 ZINC000174688546 1427311041 /nfs/dbraw/zinc/31/10/41/1427311041.db2.gz VZQDKNLQUYNKGY-UHFFFAOYSA-N 0 0 380.404 3.242 20 5 GGBDRN COc1cc(N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1[N+](=O)[O-] ZINC000174689796 1427311245 /nfs/dbraw/zinc/31/12/45/1427311245.db2.gz FNZUDYUYOILLHM-CYBMUJFWSA-N 0 0 385.420 3.434 20 5 GGBDRN COc1cc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000174699135 1427317113 /nfs/dbraw/zinc/31/71/13/1427317113.db2.gz QGXSMHLQWBAPMO-ZDUSSCGKSA-N 0 0 386.326 3.474 20 5 GGBDRN CN1CCOc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)cc21 ZINC000174700024 1427317869 /nfs/dbraw/zinc/31/78/69/1427317869.db2.gz UFCLOIASPMOLKS-UHFFFAOYSA-N 0 0 382.420 3.276 20 5 GGBDRN CC(C)(C)OC(=O)NC(C)(C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000174710210 1427323569 /nfs/dbraw/zinc/32/35/69/1427323569.db2.gz NFZZOSYYOGPKKH-UHFFFAOYSA-N 0 0 385.848 3.210 20 5 GGBDRN CN(C(=O)/C=C/c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174721890 1427330810 /nfs/dbraw/zinc/33/08/10/1427330810.db2.gz YYAGILOQMTZUFO-OJXHRBAXSA-N 0 0 375.425 3.076 20 5 GGBDRN CN1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c2cc(F)ccc21 ZINC000174722527 1427331767 /nfs/dbraw/zinc/33/17/67/1427331767.db2.gz DKOVWSINGGAQGX-UHFFFAOYSA-N 0 0 384.411 3.431 20 5 GGBDRN NC(=O)C[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000174727587 1427334137 /nfs/dbraw/zinc/33/41/37/1427334137.db2.gz CRSOIUUKQUZYQH-CQSZACIVSA-N 0 0 399.472 3.474 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@H](O)COc2ccc(F)c(F)c2)cc1OC(F)F ZINC000174729755 1427335505 /nfs/dbraw/zinc/33/55/05/1427335505.db2.gz NYRSWAGVZVKPBU-JTQLQIEISA-N 0 0 390.289 3.326 20 5 GGBDRN Cc1csc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000174732301 1427336744 /nfs/dbraw/zinc/33/67/44/1427336744.db2.gz LBCIXXDEPCLLNJ-UHFFFAOYSA-N 0 0 376.438 3.113 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)ccc1[N+](=O)[O-] ZINC000174742395 1427342967 /nfs/dbraw/zinc/34/29/67/1427342967.db2.gz KGWJNPFQUYVVHW-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1cccc(CC(F)(F)F)c1 ZINC000174745463 1427345079 /nfs/dbraw/zinc/34/50/79/1427345079.db2.gz GMIQQFGILOMMKQ-UHFFFAOYSA-N 0 0 395.337 3.297 20 5 GGBDRN Cc1cc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1OC(C)C ZINC000174745380 1427345321 /nfs/dbraw/zinc/34/53/21/1427345321.db2.gz SDLNISHSWNUSQH-UHFFFAOYSA-N 0 0 385.420 3.288 20 5 GGBDRN COc1ccc(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)cc1[N+](=O)[O-] ZINC000174747264 1427345924 /nfs/dbraw/zinc/34/59/24/1427345924.db2.gz XPMBHSWIJSPRNN-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000174748903 1427346871 /nfs/dbraw/zinc/34/68/71/1427346871.db2.gz SPXJKLWKZKSFRH-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN C[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174756881 1427350861 /nfs/dbraw/zinc/35/08/61/1427350861.db2.gz IKFMZUPGVAHLJV-NSHDSACASA-N 0 0 386.339 3.040 20 5 GGBDRN CC(C)(C)Oc1ccc(NC(=O)C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000174780363 1427363077 /nfs/dbraw/zinc/36/30/77/1427363077.db2.gz JXMOXIGNLQYWRG-UHFFFAOYSA-N 0 0 385.420 3.070 20 5 GGBDRN Cc1ccc(C(=O)N(C)Cc2nc([C@H](C)OCC(C)C)no2)cc1[N+](=O)[O-] ZINC000174793113 1427371117 /nfs/dbraw/zinc/37/11/17/1427371117.db2.gz LEWAUDXHIGWUJC-ZDUSSCGKSA-N 0 0 376.413 3.292 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2ccccc2N(C)CC[C@H]1C ZINC000174797250 1427374078 /nfs/dbraw/zinc/37/40/78/1427374078.db2.gz VXROUXDZKNULST-CQSZACIVSA-N 0 0 384.436 3.277 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@H](O)COCc3ccc(Cl)cc3)n2)c1 ZINC000174797780 1427374221 /nfs/dbraw/zinc/37/42/21/1427374221.db2.gz SMCLHGFHLUAUGR-KRWDZBQOSA-N 0 0 388.811 3.084 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@@H](O)COc3cccc4ccccc43)n2)c1 ZINC000174797955 1427374850 /nfs/dbraw/zinc/37/48/50/1427374850.db2.gz UFHFMPCAUBUUOC-GOSISDBHSA-N 0 0 390.399 3.446 20 5 GGBDRN Cc1cc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)c2cccnc2c1C ZINC000174799641 1427375280 /nfs/dbraw/zinc/37/52/80/1427375280.db2.gz REONAQAXSUEHOS-UHFFFAOYSA-N 0 0 378.388 3.015 20 5 GGBDRN CCCn1ccc2ccc(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3)cc21 ZINC000174799741 1427375354 /nfs/dbraw/zinc/37/53/54/1427375354.db2.gz RLKDLIBWUHSICB-UHFFFAOYSA-N 0 0 380.404 3.214 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)n1 ZINC000174800085 1427376229 /nfs/dbraw/zinc/37/62/29/1427376229.db2.gz LORXWDNQJHHROG-RNVIBTMRSA-N 0 0 388.424 3.383 20 5 GGBDRN CCN(CC1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1)C(=O)OC(C)(C)C ZINC000174805122 1427378317 /nfs/dbraw/zinc/37/83/17/1427378317.db2.gz JWIUXFUVDRFTBS-UHFFFAOYSA-N 0 0 381.429 3.297 20 5 GGBDRN O=C(CN1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1)Nc1ccccc1 ZINC000174815091 1427383282 /nfs/dbraw/zinc/38/32/82/1427383282.db2.gz KRWFELAXZXRYQM-UHFFFAOYSA-N 0 0 388.855 3.005 20 5 GGBDRN CCOCCCNC(=O)C1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174819910 1427386422 /nfs/dbraw/zinc/38/64/22/1427386422.db2.gz STPQVDJCEBIRCV-UHFFFAOYSA-N 0 0 383.876 3.003 20 5 GGBDRN CO[C@]1(C)C[C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1(C)C ZINC000174826030 1427388521 /nfs/dbraw/zinc/38/85/21/1427388521.db2.gz FMDBUIXTDMUNSW-AUSIDOKSSA-N 0 0 378.472 3.475 20 5 GGBDRN CO[C@]1(C)C[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1(C)C ZINC000174826041 1427389345 /nfs/dbraw/zinc/38/93/45/1427389345.db2.gz FMDBUIXTDMUNSW-WMZHIEFXSA-N 0 0 378.472 3.475 20 5 GGBDRN O=C(c1c(F)cccc1F)N1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174844061 1427402285 /nfs/dbraw/zinc/40/22/85/1427402285.db2.gz PCVSILRFQISYMZ-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N3CCOc4ccncc43)cc2[N+](=O)[O-])CC1 ZINC000174898201 1427434325 /nfs/dbraw/zinc/43/43/25/1427434325.db2.gz GPVRUIHMCPGBQI-UHFFFAOYSA-N 0 0 382.420 3.265 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)c3cc(F)ccc3[N+](=O)[O-])ccc2NC1=O ZINC000174916757 1427445109 /nfs/dbraw/zinc/44/51/09/1427445109.db2.gz VQPIFZOBOCFZRG-QLJPJBMISA-N 0 0 387.367 3.334 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)c3csc([N+](=O)[O-])c3)ccc2NC1=O ZINC000174922199 1427447544 /nfs/dbraw/zinc/44/75/44/1427447544.db2.gz UNALCCRAFXUQOV-ZANVPECISA-N 0 0 375.406 3.257 20 5 GGBDRN CC[C@@H]1Oc2cc([C@@H](C)NC(=O)c3csc([N+](=O)[O-])c3)ccc2NC1=O ZINC000174922160 1427447691 /nfs/dbraw/zinc/44/76/91/1427447691.db2.gz UNALCCRAFXUQOV-RNCFNFMXSA-N 0 0 375.406 3.257 20 5 GGBDRN CCOC(=O)c1ccnc(N2C[C@@H](c3ccccc3C)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000174926678 1427448857 /nfs/dbraw/zinc/44/88/57/1427448857.db2.gz VOURVWXJSGOUPM-YOEHRIQHSA-N 0 0 385.420 3.441 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)Cc3ccc([N+](=O)[O-])cc3)ccc2NC1=O ZINC000174935120 1427453851 /nfs/dbraw/zinc/45/38/51/1427453851.db2.gz SDJRSMCHZYUPMP-SJCJKPOMSA-N 0 0 383.404 3.124 20 5 GGBDRN O=C([C@H]1C[C@]12CCc1ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000174946616 1427459718 /nfs/dbraw/zinc/45/97/18/1427459718.db2.gz FEYPJTBNEKQZHB-IRLDBZIGSA-N 0 0 377.444 3.148 20 5 GGBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000174953301 1427464103 /nfs/dbraw/zinc/46/41/03/1427464103.db2.gz QIZYWBIKXWSDOV-UHFFFAOYSA-N 0 0 390.783 3.119 20 5 GGBDRN COc1ccc([C@H](C)CC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000174966553 1427470774 /nfs/dbraw/zinc/47/07/74/1427470774.db2.gz ZDHVDPJSVVXATB-MRXNPFEDSA-N 0 0 383.448 3.446 20 5 GGBDRN O=C([C@@H]1C[C@]12CCc1ccccc12)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174974902 1427474831 /nfs/dbraw/zinc/47/48/31/1427474831.db2.gz AUCGMOZAEQNJRZ-AVRDEDQJSA-N 0 0 377.444 3.148 20 5 GGBDRN CC[C@@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Oc1ccccc1C ZINC000174988296 1427481672 /nfs/dbraw/zinc/48/16/72/1427481672.db2.gz JUVXVVVJNUFHRK-INIZCTEOSA-N 0 0 395.419 3.071 20 5 GGBDRN CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000175000393 1427489378 /nfs/dbraw/zinc/48/93/78/1427489378.db2.gz DNTIONDQALULCB-UHFFFAOYSA-N 0 0 377.422 3.279 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCC2(C1)CCCCCC2 ZINC000174999536 1427489599 /nfs/dbraw/zinc/48/95/99/1427489599.db2.gz KJYKEJMIJZQYPO-UHFFFAOYSA-N 0 0 387.436 3.466 20 5 GGBDRN CC(C)NS(=O)(=O)c1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 ZINC000175012759 1427497570 /nfs/dbraw/zinc/49/75/70/1427497570.db2.gz MPOSZCWVLCIHOF-UHFFFAOYSA-N 0 0 397.840 3.187 20 5 GGBDRN Cc1csc(C2(NCC(=O)N3CCc4cc([N+](=O)[O-])ccc43)CCCC2)n1 ZINC000175018226 1427501446 /nfs/dbraw/zinc/50/14/46/1427501446.db2.gz UMVBXFROSJOZNM-UHFFFAOYSA-N 0 0 386.477 3.308 20 5 GGBDRN COCc1cc([N+](=O)[O-])ccc1NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1 ZINC000175043583 1427516290 /nfs/dbraw/zinc/51/62/90/1427516290.db2.gz VEOAFFLUGPPZJJ-IBGZPJMESA-N 0 0 399.447 3.262 20 5 GGBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000175045664 1427517240 /nfs/dbraw/zinc/51/72/40/1427517240.db2.gz ZRBUUXGBKVYTOL-AWEZNQCLSA-N 0 0 382.844 3.439 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CC[C@H](Cc2ccccc2)C1 ZINC000175068279 1427528469 /nfs/dbraw/zinc/52/84/69/1427528469.db2.gz RSSZICXLITYXLM-CQSZACIVSA-N 0 0 387.823 3.278 20 5 GGBDRN COC(=O)c1ccc(Cl)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000175068603 1427529427 /nfs/dbraw/zinc/52/94/27/1427529427.db2.gz VTZWRLKTUCUHHP-UHFFFAOYSA-N 0 0 377.784 3.110 20 5 GGBDRN COc1ccc(NC(=O)c2ccc(CNC(=O)C=C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000175072120 1427530851 /nfs/dbraw/zinc/53/08/51/1427530851.db2.gz VHVIGZPMTNEYAK-UHFFFAOYSA-N 0 0 383.404 3.438 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H](c1ccccc1F)N1CCOCC1 ZINC000175074076 1427532262 /nfs/dbraw/zinc/53/22/62/1427532262.db2.gz XLELKACYHLPPDZ-IBGZPJMESA-N 0 0 387.411 3.363 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](c1ccccc1F)N1CCOCC1 ZINC000175074057 1427532306 /nfs/dbraw/zinc/53/23/06/1427532306.db2.gz XLELKACYHLPPDZ-LJQANCHMSA-N 0 0 387.411 3.363 20 5 GGBDRN NC(=O)CSc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000175079619 1427535311 /nfs/dbraw/zinc/53/53/11/1427535311.db2.gz IBPDYTWWXSJKRT-UHFFFAOYSA-N 0 0 399.350 3.443 20 5 GGBDRN O=C1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccc(F)cc2N1 ZINC000175081113 1427536028 /nfs/dbraw/zinc/53/60/28/1427536028.db2.gz FAGFQUCHKRQPAT-UHFFFAOYSA-N 0 0 383.339 3.133 20 5 GGBDRN O=C1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccc(F)cc2N1 ZINC000175081936 1427536893 /nfs/dbraw/zinc/53/68/93/1427536893.db2.gz KHUJJLZQECHDLG-UHFFFAOYSA-N 0 0 383.339 3.133 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCN(CC2CC2)c2ccccc21 ZINC000175084451 1427537443 /nfs/dbraw/zinc/53/74/43/1427537443.db2.gz DTGRAWGEWMKKOZ-UHFFFAOYSA-N 0 0 382.376 3.380 20 5 GGBDRN Nc1c(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000175094328 1427542682 /nfs/dbraw/zinc/54/26/82/1427542682.db2.gz ZHPJHVXVWKLQHG-MRXNPFEDSA-N 0 0 387.411 3.180 20 5 GGBDRN COc1c(C)cnc(CN(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1C ZINC000175094567 1427543408 /nfs/dbraw/zinc/54/34/08/1427543408.db2.gz ZMWHEJQMFPNOLM-UHFFFAOYSA-N 0 0 393.465 3.053 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC[C@@H](Nc2ccccc2)C1 ZINC000175100249 1427545584 /nfs/dbraw/zinc/54/55/84/1427545584.db2.gz RHUSZAZAAQGUSI-MRXNPFEDSA-N 0 0 375.450 3.087 20 5 GGBDRN O=C(Cc1ccc(NC(=O)C2CC2)cc1)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000175099161 1427545732 /nfs/dbraw/zinc/54/57/32/1427545732.db2.gz PCXNMFPZNBLAFJ-UHFFFAOYSA-N 0 0 375.331 3.403 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000175101563 1427547005 /nfs/dbraw/zinc/54/70/05/1427547005.db2.gz HKMQPVVTGLFSEO-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCO[C@@H](c2ccccc2F)C1 ZINC000175101470 1427547124 /nfs/dbraw/zinc/54/71/24/1427547124.db2.gz OWSGPJMEOPOHJQ-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1noc(-c2ccc(Cl)cc2)n1 ZINC000175101528 1427547358 /nfs/dbraw/zinc/54/73/58/1427547358.db2.gz KBRKGTUGANMDRZ-SECBINFHSA-N 0 0 387.783 3.371 20 5 GGBDRN Cc1ccc([C@H](C)NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000175115119 1427553560 /nfs/dbraw/zinc/55/35/60/1427553560.db2.gz SPUOTFCUPUAABA-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN CC(=O)Nc1cc(S(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1C ZINC000175116400 1427554450 /nfs/dbraw/zinc/55/44/50/1427554450.db2.gz RHYAFYNFNUWQSI-CYBMUJFWSA-N 0 0 391.449 3.210 20 5 GGBDRN Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000175115694 1427554557 /nfs/dbraw/zinc/55/45/57/1427554557.db2.gz XQENYIISFSNIQQ-LBPRGKRZSA-N 0 0 379.394 3.159 20 5 GGBDRN Cc1ccc(C(=O)N(C)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(F)c1 ZINC000175115861 1427554570 /nfs/dbraw/zinc/55/45/70/1427554570.db2.gz LKRUWZNBKVKPHA-UHFFFAOYSA-N 0 0 386.788 3.157 20 5 GGBDRN Cc1ccc([C@H](C)NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000175119100 1427557154 /nfs/dbraw/zinc/55/71/54/1427557154.db2.gz YHNCMBSEKQYYPO-LBPRGKRZSA-N 0 0 379.394 3.159 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Oc1cccc([N+](=O)[O-])c1C ZINC000175120529 1427557642 /nfs/dbraw/zinc/55/76/42/1427557642.db2.gz BQHFZWBWTQFSEX-KRWDZBQOSA-N 0 0 399.378 3.176 20 5 GGBDRN COc1cccc(CCNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000175136101 1427564234 /nfs/dbraw/zinc/56/42/34/1427564234.db2.gz BKWXFJQPTJKKGZ-UHFFFAOYSA-N 0 0 399.447 3.399 20 5 GGBDRN Cc1ccc(CCC(=O)NCC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175148792 1427568579 /nfs/dbraw/zinc/56/85/79/1427568579.db2.gz WZCFTPYJASRGMZ-UHFFFAOYSA-N 0 0 383.448 3.004 20 5 GGBDRN COC(=O)CCN(CC(C)C)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000175148423 1427568598 /nfs/dbraw/zinc/56/85/98/1427568598.db2.gz YCWWKYAIEUTYPP-UHFFFAOYSA-N 0 0 376.331 3.275 20 5 GGBDRN CC(C)(NC(=O)CCCNC(=O)NC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000175148495 1427568700 /nfs/dbraw/zinc/56/87/00/1427568700.db2.gz QWCWNSNTSWXDNF-UHFFFAOYSA-N 0 0 390.484 3.358 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175148975 1427568743 /nfs/dbraw/zinc/56/87/43/1427568743.db2.gz RXKQWBIZQSXKLN-LBPRGKRZSA-N 0 0 389.839 3.418 20 5 GGBDRN O=C(N[C@@H](CN1CCCC1=O)c1ccccc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000175148594 1427568838 /nfs/dbraw/zinc/56/88/38/1427568838.db2.gz DHXYGERKEFNHNO-KRWDZBQOSA-N 0 0 387.823 3.342 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1CC(=O)OC(C)(C)C ZINC000175150094 1427569259 /nfs/dbraw/zinc/56/92/59/1427569259.db2.gz PIGSIMDLVIBXCD-UHFFFAOYSA-N 0 0 388.424 3.013 20 5 GGBDRN CS(=O)(=O)Cc1ccccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000175156112 1427572237 /nfs/dbraw/zinc/57/22/37/1427572237.db2.gz MTPZLPYVUBNDDB-UHFFFAOYSA-N 0 0 397.840 3.115 20 5 GGBDRN O=C(Nc1cccnc1N1CCOCC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000175157668 1427573093 /nfs/dbraw/zinc/57/30/93/1427573093.db2.gz BEQYNTCYAVVMOT-UHFFFAOYSA-N 0 0 396.325 3.098 20 5 GGBDRN C[C@H](C(=O)OCCNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000175162105 1427575435 /nfs/dbraw/zinc/57/54/35/1427575435.db2.gz VAIDZLSNZWUITE-VIFPVBQESA-N 0 0 397.840 3.167 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@@H](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000175169371 1427579133 /nfs/dbraw/zinc/57/91/33/1427579133.db2.gz OAGKWKMUQYXTND-KGLIPLIRSA-N 0 0 385.420 3.102 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000175170009 1427579700 /nfs/dbraw/zinc/57/97/00/1427579700.db2.gz NLHXMAUWJKHXKI-MUDIAHQHSA-N 0 0 387.461 3.414 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000175169990 1427579907 /nfs/dbraw/zinc/57/99/07/1427579907.db2.gz NLHXMAUWJKHXKI-JWNZJDHWSA-N 0 0 387.461 3.414 20 5 GGBDRN CN(C)c1cc(CNC(=O)NCc2ccccc2[N+](=O)[O-])c2ccccc2n1 ZINC000175170129 1427579961 /nfs/dbraw/zinc/57/99/61/1427579961.db2.gz MQKBRFNGZYXNCU-UHFFFAOYSA-N 0 0 379.420 3.208 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000175169723 1427579976 /nfs/dbraw/zinc/57/99/76/1427579976.db2.gz CSDWPXFMMCUCFP-JWNZJDHWSA-N 0 0 391.449 3.101 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)NCc3ccccc3[N+](=O)[O-])n2)c1 ZINC000175170931 1427580573 /nfs/dbraw/zinc/58/05/73/1427580573.db2.gz YWYOKJDJEIYTIM-LBPRGKRZSA-N 0 0 397.391 3.214 20 5 GGBDRN Cc1cccc(N(CCC(N)=O)C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000175180044 1427585413 /nfs/dbraw/zinc/58/54/13/1427585413.db2.gz SIVOPPNSLUGYIB-UHFFFAOYSA-N 0 0 395.337 3.444 20 5 GGBDRN CC[C@@H](NC(=O)Nc1ccc(N2CCOCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000175186799 1427588887 /nfs/dbraw/zinc/58/88/87/1427588887.db2.gz RDBMHRRFMAJBEL-QGZVFWFLSA-N 0 0 385.424 3.099 20 5 GGBDRN Cc1ccc(-n2cnnn2)cc1NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175189296 1427589912 /nfs/dbraw/zinc/58/99/12/1427589912.db2.gz XDDHUJCPLBECJO-CYBMUJFWSA-N 0 0 381.396 3.070 20 5 GGBDRN COc1ccc([C@H](C)CCNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175201813 1427596471 /nfs/dbraw/zinc/59/64/71/1427596471.db2.gz YZDQCDWUVRLETH-CYBMUJFWSA-N 0 0 385.420 3.160 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000175228544 1427614097 /nfs/dbraw/zinc/61/40/97/1427614097.db2.gz QOFSWFDPTVMRBJ-OAHLLOKOSA-N 0 0 377.485 3.368 20 5 GGBDRN Cc1ccccc1[C@@H](O)CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175231297 1427615181 /nfs/dbraw/zinc/61/51/81/1427615181.db2.gz XJVPGEUEUNFDQP-HNNXBMFYSA-N 0 0 379.210 3.129 20 5 GGBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000175244329 1427623171 /nfs/dbraw/zinc/62/31/71/1427623171.db2.gz UIESFZWQTNDSAT-HZPDHXFCSA-N 0 0 389.481 3.278 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1cccnc1 ZINC000175264968 1427634902 /nfs/dbraw/zinc/63/49/02/1427634902.db2.gz MNBIPZSQCJBBHK-GOSISDBHSA-N 0 0 379.420 3.345 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000175267780 1427635813 /nfs/dbraw/zinc/63/58/13/1427635813.db2.gz DEAIVQBGEIDAPK-LLVKDONJSA-N 0 0 385.355 3.344 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1cccnc1 ZINC000175274599 1427640814 /nfs/dbraw/zinc/64/08/14/1427640814.db2.gz FKQJBRMKBIYRCS-LJQANCHMSA-N 0 0 379.420 3.345 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCn2c(nnc2-c2ccccc2)C1 ZINC000175287376 1427648673 /nfs/dbraw/zinc/64/86/73/1427648673.db2.gz CCPRYZAURAOTBM-UHFFFAOYSA-N 0 0 379.420 3.268 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](C)Oc1ccc(F)cc1 ZINC000175289724 1427650269 /nfs/dbraw/zinc/65/02/69/1427650269.db2.gz XSLOZJJEHONCKO-LBPRGKRZSA-N 0 0 377.372 3.009 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](c1nc(C)cs1)C1CC1 ZINC000175289942 1427650321 /nfs/dbraw/zinc/65/03/21/1427650321.db2.gz CXBCODHTDCGERZ-OAHLLOKOSA-N 0 0 376.438 3.319 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[C@@H](COCc2ccccc2)C1 ZINC000175292092 1427651006 /nfs/dbraw/zinc/65/10/06/1427651006.db2.gz DFHLCMJOTYKNCT-QGZVFWFLSA-N 0 0 399.447 3.352 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H](C)Oc1cccc(F)c1 ZINC000175292027 1427651069 /nfs/dbraw/zinc/65/10/69/1427651069.db2.gz IIQJEBMODSKMOE-GFCCVEGCSA-N 0 0 377.372 3.009 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c(C)o1 ZINC000175307212 1427665697 /nfs/dbraw/zinc/66/56/97/1427665697.db2.gz HITBIYIZTCSAFQ-KRWDZBQOSA-N 0 0 399.350 3.435 20 5 GGBDRN COc1ccc(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)cc1[N+](=O)[O-] ZINC000175311143 1427668285 /nfs/dbraw/zinc/66/82/85/1427668285.db2.gz JGCIYVLKAZCWIS-GFCCVEGCSA-N 0 0 382.376 3.068 20 5 GGBDRN O=C(N[C@H]1c2ccccc2C[C@@H]1O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175312622 1427668914 /nfs/dbraw/zinc/66/89/14/1427668914.db2.gz QKVITIWVRZHVNS-IRXDYDNUSA-N 0 0 381.413 3.106 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000175313115 1427669618 /nfs/dbraw/zinc/66/96/18/1427669618.db2.gz NWGSZZRQMABFOY-LBPRGKRZSA-N 0 0 382.376 3.068 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1 ZINC000175313213 1427670035 /nfs/dbraw/zinc/67/00/35/1427670035.db2.gz HKBZHGLASURLCB-UHFFFAOYSA-N 0 0 398.810 3.283 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1 ZINC000175315202 1427671446 /nfs/dbraw/zinc/67/14/46/1427671446.db2.gz KHTPLBAXWZALNV-UHFFFAOYSA-N 0 0 398.810 3.283 20 5 GGBDRN COc1cc(C(=O)N(C)c2ccc(Br)nc2)c([N+](=O)[O-])cc1OC ZINC000175320184 1427675982 /nfs/dbraw/zinc/67/59/82/1427675982.db2.gz DMKXKMZPQLYDMI-UHFFFAOYSA-N 0 0 396.197 3.046 20 5 GGBDRN C[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1nc(Cc2ccccc2)no1 ZINC000175322270 1427677393 /nfs/dbraw/zinc/67/73/93/1427677393.db2.gz WMMZSPAAABFCGQ-CQSZACIVSA-N 0 0 396.403 3.215 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000175329680 1427683108 /nfs/dbraw/zinc/68/31/08/1427683108.db2.gz OSWKGWBUVVALNI-GFCCVEGCSA-N 0 0 382.376 3.068 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)CCO2 ZINC000175336273 1427687359 /nfs/dbraw/zinc/68/73/59/1427687359.db2.gz NWFRAEAUQQZHGF-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN C[C@@H]1CN(C(C)(C)CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000175338096 1427689178 /nfs/dbraw/zinc/68/91/78/1427689178.db2.gz GDDNXNFPXPZQJX-HUUCEWRRSA-N 0 0 392.500 3.017 20 5 GGBDRN CC(C)CC(C)(C)CNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000175352972 1427699688 /nfs/dbraw/zinc/69/96/88/1427699688.db2.gz WVLJQTOQOPQIOV-CYBMUJFWSA-N 0 0 381.498 3.449 20 5 GGBDRN O=C(NCc1nccn1CCc1ccccc1)NCc1ccccc1[N+](=O)[O-] ZINC000175354899 1427701157 /nfs/dbraw/zinc/70/11/57/1427701157.db2.gz YLIFLFUMVQWIRD-UHFFFAOYSA-N 0 0 379.420 3.033 20 5 GGBDRN C[C@H](NC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000175362465 1427706660 /nfs/dbraw/zinc/70/66/60/1427706660.db2.gz GZFMHNNJSGOMMI-SGTLLEGYSA-N 0 0 381.404 3.121 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000175367471 1427710575 /nfs/dbraw/zinc/71/05/75/1427710575.db2.gz OANBWJHPPZYDEH-UHFFFAOYSA-N 0 0 376.390 3.170 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)OCc2nc(Cc3ccc(F)cc3)no2)c1 ZINC000175375902 1427717795 /nfs/dbraw/zinc/71/77/95/1427717795.db2.gz MWMUMWAIOMIWHP-UHFFFAOYSA-N 0 0 387.323 3.073 20 5 GGBDRN C[C@@H](NC(=O)N1CCC(OC[C@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000175379540 1427719578 /nfs/dbraw/zinc/71/95/78/1427719578.db2.gz TZAWEWCIYIVARU-RDTXWAMCSA-N 0 0 377.441 3.025 20 5 GGBDRN CCc1nnc(-c2cccc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)c2)o1 ZINC000175382093 1427721034 /nfs/dbraw/zinc/72/10/34/1427721034.db2.gz MGBNHWVWVXIDNZ-UHFFFAOYSA-N 0 0 378.348 3.336 20 5 GGBDRN CCc1nnc(-c2cccc(NC(=O)CN(C)c3ccccc3[N+](=O)[O-])c2)o1 ZINC000175384111 1427723073 /nfs/dbraw/zinc/72/30/73/1427723073.db2.gz ZNDXUMNYPKAIFU-UHFFFAOYSA-N 0 0 381.392 3.282 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCN(C)c3cc(F)ccc32)cc1OC ZINC000175398423 1427731124 /nfs/dbraw/zinc/73/11/24/1427731124.db2.gz RSJMJGXGBJTLHY-UHFFFAOYSA-N 0 0 389.383 3.238 20 5 GGBDRN COc1cc(C(=O)OCc2nc(Cc3ccc(F)cc3)no2)ccc1[N+](=O)[O-] ZINC000175398084 1427731317 /nfs/dbraw/zinc/73/13/17/1427731317.db2.gz ALGXSNTZMBVEGA-UHFFFAOYSA-N 0 0 387.323 3.073 20 5 GGBDRN Nc1cc(CCCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])nn1-c1ccccc1 ZINC000175400871 1427732691 /nfs/dbraw/zinc/73/26/91/1427732691.db2.gz WFKCGNNHEAVPAI-UHFFFAOYSA-N 0 0 399.838 3.379 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000175410506 1427739468 /nfs/dbraw/zinc/73/94/68/1427739468.db2.gz XYDPQZNVAOROGL-UHFFFAOYSA-N 0 0 384.436 3.079 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000175415535 1427742527 /nfs/dbraw/zinc/74/25/27/1427742527.db2.gz RCQXSGKDQDXIPY-QWVSSGJLSA-N 0 0 390.461 3.392 20 5 GGBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCN(c2cc(F)ccc2F)CC1 ZINC000175416080 1427742891 /nfs/dbraw/zinc/74/28/91/1427742891.db2.gz SJNKGHAMPJUOHO-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000175422020 1427745753 /nfs/dbraw/zinc/74/57/53/1427745753.db2.gz PHOKSGSHBPQVGA-SHZVTRLKSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000175424283 1427746870 /nfs/dbraw/zinc/74/68/70/1427746870.db2.gz MHFYGIZARJEFLJ-SHZVTRLKSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000175428738 1427749699 /nfs/dbraw/zinc/74/96/99/1427749699.db2.gz RWHYXJXBRVEMJL-SHZVTRLKSA-N 0 0 396.490 3.022 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1noc(Cc2ccccc2)n1 ZINC000175438579 1427755051 /nfs/dbraw/zinc/75/50/51/1427755051.db2.gz VHDPRIDOQHRPLK-CQSZACIVSA-N 0 0 395.419 3.172 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175447102 1427759637 /nfs/dbraw/zinc/75/96/37/1427759637.db2.gz PTTFYDVJQKNKIT-INIZCTEOSA-N 0 0 379.416 3.351 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000175456852 1427764872 /nfs/dbraw/zinc/76/48/72/1427764872.db2.gz FXMZADODMAMBAI-HOCLYGCPSA-N 0 0 375.450 3.454 20 5 GGBDRN CCSCC[C@@H](C)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000175461952 1427767464 /nfs/dbraw/zinc/76/74/64/1427767464.db2.gz KRDNRNJSMSKVQE-CHWSQXEVSA-N 0 0 397.472 3.077 20 5 GGBDRN O=C([C@H]1C[C@]12CCc1ccccc12)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000175468662 1427771287 /nfs/dbraw/zinc/77/12/87/1427771287.db2.gz INAYEGPPUOPDOO-IRLDBZIGSA-N 0 0 377.444 3.148 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)CC2)nc(C)n1 ZINC000175470276 1427771849 /nfs/dbraw/zinc/77/18/49/1427771849.db2.gz RRQFOWCIOMWDOT-UHFFFAOYSA-N 0 0 389.843 3.054 20 5 GGBDRN COCc1cccc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000175472355 1427773051 /nfs/dbraw/zinc/77/30/51/1427773051.db2.gz DDPJHXVLTWGXAI-UHFFFAOYSA-N 0 0 399.447 3.494 20 5 GGBDRN Cc1sc(NC(=O)CN2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C)c1C ZINC000175477861 1427776962 /nfs/dbraw/zinc/77/69/62/1427776962.db2.gz VAVFSAQJVPOZEC-UHFFFAOYSA-N 0 0 388.493 3.342 20 5 GGBDRN CC(C)(NC(=O)NCCNC(=O)CC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000175479540 1427777571 /nfs/dbraw/zinc/77/75/71/1427777571.db2.gz JDWHNEWORBVXMB-UHFFFAOYSA-N 0 0 390.484 3.216 20 5 GGBDRN CC(C)[C@H](CNC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cccnc1 ZINC000175481799 1427778746 /nfs/dbraw/zinc/77/87/46/1427778746.db2.gz XUDDGCMCRAOIQY-SFHVURJKSA-N 0 0 397.479 3.261 20 5 GGBDRN CC(C)(NC(=O)NCc1cc(F)cc2c1OCOC2)c1ccc([N+](=O)[O-])cc1 ZINC000175487543 1427783167 /nfs/dbraw/zinc/78/31/67/1427783167.db2.gz GPTOVFRWTBQBHK-UHFFFAOYSA-N 0 0 389.383 3.335 20 5 GGBDRN COc1cccc2c1OC[C@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000175499404 1427790977 /nfs/dbraw/zinc/79/09/77/1427790977.db2.gz JRRANUKPGWFQCA-OAHLLOKOSA-N 0 0 385.420 3.141 20 5 GGBDRN CN(Cc1cnn(-c2ccccc2)c1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000175510378 1427797846 /nfs/dbraw/zinc/79/78/46/1427797846.db2.gz UYVJJEMGUIYRAL-HXUWFJFHSA-N 0 0 391.431 3.018 20 5 GGBDRN CN(Cc1cnn(-c2ccccc2)c1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000175510401 1427798182 /nfs/dbraw/zinc/79/81/82/1427798182.db2.gz UYVJJEMGUIYRAL-FQEVSTJZSA-N 0 0 391.431 3.018 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(OCc3ccccn3)c(F)c2)c1[N+](=O)[O-] ZINC000175519288 1427801677 /nfs/dbraw/zinc/80/16/77/1427801677.db2.gz ILHYKDQCCJAPMO-UHFFFAOYSA-N 0 0 385.355 3.246 20 5 GGBDRN CCOC[C@@H]1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000175535328 1427807290 /nfs/dbraw/zinc/80/72/90/1427807290.db2.gz GQQVNDHLOJEPMH-GFCCVEGCSA-N 0 0 389.374 3.301 20 5 GGBDRN Cc1cc(C)c2c(c1)CCCN2C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000175541794 1427809179 /nfs/dbraw/zinc/80/91/79/1427809179.db2.gz IFJYFRSJKYSWMM-UHFFFAOYSA-N 0 0 377.404 3.385 20 5 GGBDRN COc1ccc([C@@H](C)CC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000175547804 1427811254 /nfs/dbraw/zinc/81/12/54/1427811254.db2.gz GETCKGFXIKGCPH-INIZCTEOSA-N 0 0 383.448 3.446 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000175549993 1427812011 /nfs/dbraw/zinc/81/20/11/1427812011.db2.gz XSRRPGUYEKSWNW-RYZVSIALSA-N 0 0 376.434 3.174 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000175550841 1427812200 /nfs/dbraw/zinc/81/22/00/1427812200.db2.gz HWHUINKARXWWBW-RYZVSIALSA-N 0 0 376.434 3.174 20 5 GGBDRN O=C(Oc1ccc2c(c1)CCC(=O)N2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175556432 1427814079 /nfs/dbraw/zinc/81/40/79/1427814079.db2.gz JMLZDWFRTQRNCK-UHFFFAOYSA-N 0 0 391.177 3.461 20 5 GGBDRN CCSCC[C@H](C)N(C)C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000175571223 1427818511 /nfs/dbraw/zinc/81/85/11/1427818511.db2.gz FYZOHXAPADJYKD-LBPRGKRZSA-N 0 0 377.470 3.088 20 5 GGBDRN CCSCC[C@@H](C)N(C)C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000175571201 1427818624 /nfs/dbraw/zinc/81/86/24/1427818624.db2.gz FYZOHXAPADJYKD-GFCCVEGCSA-N 0 0 377.470 3.088 20 5 GGBDRN Cc1cc(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)c(N)c([N+](=O)[O-])c1 ZINC000175601683 1427828105 /nfs/dbraw/zinc/82/81/05/1427828105.db2.gz UVAXLWJPKSWWDB-SNVBAGLBSA-N 0 0 385.355 3.166 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(N(C)C)nc3ccccc23)c1 ZINC000175617017 1427833376 /nfs/dbraw/zinc/83/33/76/1427833376.db2.gz VOFRWDJCIAHXCO-UHFFFAOYSA-N 0 0 380.404 3.148 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000175621025 1427834766 /nfs/dbraw/zinc/83/47/66/1427834766.db2.gz QSASNVVKWARDQC-SRGMZFCMSA-N 0 0 375.450 3.201 20 5 GGBDRN CNC(=O)[C@@H](C)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000175632830 1427838979 /nfs/dbraw/zinc/83/89/79/1427838979.db2.gz QHEMMOOHBYZXBM-ZDUSSCGKSA-N 0 0 387.461 3.200 20 5 GGBDRN COc1ccc(-c2noc(CCCC(=O)Nc3ccc([N+](=O)[O-])c(C)n3)n2)cc1 ZINC000175675483 1427853108 /nfs/dbraw/zinc/85/31/08/1427853108.db2.gz COFOQOVDNRQPCZ-UHFFFAOYSA-N 0 0 397.391 3.318 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000175676476 1427853454 /nfs/dbraw/zinc/85/34/54/1427853454.db2.gz GEVJYCWTNCEFBT-GOSISDBHSA-N 0 0 398.394 3.210 20 5 GGBDRN COc1ccc2c(C)c(CCC(=O)Nc3ccc([N+](=O)[O-])c(C)n3)c(=O)oc2c1 ZINC000175680258 1427854696 /nfs/dbraw/zinc/85/46/96/1427854696.db2.gz CZBKMEFKWWLVSI-UHFFFAOYSA-N 0 0 397.387 3.293 20 5 GGBDRN Cc1nc(NC(=O)C2CCN(c3nc4ccccc4o3)CC2)ccc1[N+](=O)[O-] ZINC000175680497 1427854869 /nfs/dbraw/zinc/85/48/69/1427854869.db2.gz LYGLZFRZJYQMEM-UHFFFAOYSA-N 0 0 381.392 3.295 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175681333 1427855313 /nfs/dbraw/zinc/85/53/13/1427855313.db2.gz ACNVWKLHGCEIFV-UHFFFAOYSA-N 0 0 394.181 3.238 20 5 GGBDRN O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1cccc([N+](=O)[O-])c1 ZINC000175688316 1427857735 /nfs/dbraw/zinc/85/77/35/1427857735.db2.gz JKCJTRXFZSMAKY-UHFFFAOYSA-N 0 0 388.390 3.058 20 5 GGBDRN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000175693373 1427860821 /nfs/dbraw/zinc/86/08/21/1427860821.db2.gz IMGALZNIFNHYKN-SCLBCKFNSA-N 0 0 388.445 3.017 20 5 GGBDRN Cc1ccn(C)c(=O)c1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000175696681 1427861630 /nfs/dbraw/zinc/86/16/30/1427861630.db2.gz XQQDJJUIQBAIJS-UHFFFAOYSA-N 0 0 384.436 3.091 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000175697158 1427861959 /nfs/dbraw/zinc/86/19/59/1427861959.db2.gz GMHKMOKZKPYAIF-QWRGUYRKSA-N 0 0 393.802 3.383 20 5 GGBDRN COc1ccc(S(=O)(=O)N(Cc2ccccc2)CC(F)F)c([N+](=O)[O-])c1 ZINC000175714845 1427867762 /nfs/dbraw/zinc/86/77/62/1427867762.db2.gz FVKIQKRPHNZYHH-UHFFFAOYSA-N 0 0 386.376 3.059 20 5 GGBDRN Cc1cc(F)cc(C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)c1[N+](=O)[O-] ZINC000175730692 1427871998 /nfs/dbraw/zinc/87/19/98/1427871998.db2.gz MYKIIOLHHFVMBY-ZDUSSCGKSA-N 0 0 383.383 3.456 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccc(NC(=O)N(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000175734403 1427873263 /nfs/dbraw/zinc/87/32/63/1427873263.db2.gz RLSOJLXWKZDFMV-CYBMUJFWSA-N 0 0 385.424 3.249 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000175735640 1427873462 /nfs/dbraw/zinc/87/34/62/1427873462.db2.gz PLMBHTNDRIEZCW-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN Cc1cccc(NC(=O)COC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000175735600 1427873692 /nfs/dbraw/zinc/87/36/92/1427873692.db2.gz OGRQISOCLSXXPO-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN C[C@H](NC(=O)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000175735700 1427873787 /nfs/dbraw/zinc/87/37/87/1427873787.db2.gz UQAARMDCIFZLDX-DEYYWGMASA-N 0 0 382.420 3.149 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1[N+](=O)[O-] ZINC000175736059 1427874153 /nfs/dbraw/zinc/87/41/53/1427874153.db2.gz ZTCWYAFSTSKMQB-GOSISDBHSA-N 0 0 399.422 3.006 20 5 GGBDRN C[C@@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1noc(Cc2ccccc2)n1 ZINC000175737588 1427874709 /nfs/dbraw/zinc/87/47/09/1427874709.db2.gz GVWWNKKFQDASPU-CQSZACIVSA-N 0 0 395.419 3.471 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000175740179 1427875721 /nfs/dbraw/zinc/87/57/21/1427875721.db2.gz NJIPYOPHPAQOQO-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccnc(-n3cccn3)c2)cc1[N+](=O)[O-] ZINC000175742751 1427876509 /nfs/dbraw/zinc/87/65/09/1427876509.db2.gz FTBDXUOCBNEGAZ-CQSZACIVSA-N 0 0 380.408 3.044 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000175770729 1427887247 /nfs/dbraw/zinc/88/72/47/1427887247.db2.gz YYCDCJFWIZJATO-UHFFFAOYSA-N 0 0 395.337 3.345 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC[C@@H]2C[C@H](O)c2cccs2)c1[N+](=O)[O-] ZINC000175778560 1427889598 /nfs/dbraw/zinc/88/95/98/1427889598.db2.gz WEIYMMYYPNIPID-OCCSQVGLSA-N 0 0 391.449 3.321 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC[C@H]2C[C@H](O)c2cccs2)c1[N+](=O)[O-] ZINC000175778580 1427889644 /nfs/dbraw/zinc/88/96/44/1427889644.db2.gz WEIYMMYYPNIPID-JSGCOSHPSA-N 0 0 391.449 3.321 20 5 GGBDRN NC(=O)C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1cccc(Cl)c1 ZINC000175781076 1427890769 /nfs/dbraw/zinc/89/07/69/1427890769.db2.gz QKCSJWCHAMIUCD-CQSZACIVSA-N 0 0 388.811 3.162 20 5 GGBDRN CNC(=O)c1ccc(N2CC[C@H](OCCCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000175783199 1427891331 /nfs/dbraw/zinc/89/13/31/1427891331.db2.gz KXLZIKYWDQZVPV-SFHVURJKSA-N 0 0 383.448 3.183 20 5 GGBDRN CCc1nnc(-c2ccc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)cc2)o1 ZINC000175797225 1427896564 /nfs/dbraw/zinc/89/65/64/1427896564.db2.gz UUDVMYAZVAPITH-UHFFFAOYSA-N 0 0 378.348 3.336 20 5 GGBDRN CO[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000175800737 1427897429 /nfs/dbraw/zinc/89/74/29/1427897429.db2.gz XULMZCXOMCTGTM-KRWDZBQOSA-N 0 0 377.828 3.478 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n(-c2ccc(C)nn2)n1 ZINC000175801193 1427898166 /nfs/dbraw/zinc/89/81/66/1427898166.db2.gz DOLLMCVQRUNNEE-UHFFFAOYSA-N 0 0 393.407 3.014 20 5 GGBDRN Cc1ccc(CCC(=O)NCCOC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 ZINC000175801322 1427898225 /nfs/dbraw/zinc/89/82/25/1427898225.db2.gz JEDCOSZSRPSYSR-UHFFFAOYSA-N 0 0 390.823 3.462 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)c(C)o1 ZINC000175807552 1427901391 /nfs/dbraw/zinc/90/13/91/1427901391.db2.gz ZDORGHCDIFGMKB-UHFFFAOYSA-N 0 0 391.811 3.056 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000175810661 1427904243 /nfs/dbraw/zinc/90/42/43/1427904243.db2.gz QTENOASNPNTWNS-UHFFFAOYSA-N 0 0 378.379 3.431 20 5 GGBDRN C[C@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@@H](C)C1CCCCC1 ZINC000175813674 1427905609 /nfs/dbraw/zinc/90/56/09/1427905609.db2.gz AXTCWKOYDRRZNS-OLZOCXBDSA-N 0 0 382.482 3.333 20 5 GGBDRN COCCOc1ccc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175814731 1427906370 /nfs/dbraw/zinc/90/63/70/1427906370.db2.gz DJQHHHCVQDVEGR-OAHLLOKOSA-N 0 0 387.436 3.489 20 5 GGBDRN C[C@@H]([C@H](C)NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)C1CCCCC1 ZINC000175813848 1427906493 /nfs/dbraw/zinc/90/64/93/1427906493.db2.gz FIQNRQIKAYKCLW-STQMWFEESA-N 0 0 375.425 3.224 20 5 GGBDRN Cc1nn(C)c(C(=O)N(Cc2cc(F)ccc2F)C2CCCC2)c1[N+](=O)[O-] ZINC000175815701 1427907438 /nfs/dbraw/zinc/90/74/38/1427907438.db2.gz YWKIFTCOMAULOE-UHFFFAOYSA-N 0 0 378.379 3.500 20 5 GGBDRN Cc1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1NS(C)(=O)=O ZINC000175826435 1427914351 /nfs/dbraw/zinc/91/43/51/1427914351.db2.gz DLFWCTLAIRFNPE-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1 ZINC000175828419 1427914715 /nfs/dbraw/zinc/91/47/15/1427914715.db2.gz GORZDVUZVHMCMF-JTQLQIEISA-N 0 0 377.784 3.474 20 5 GGBDRN COc1ccc(S(=O)(=O)N(Cc2ccccc2)CC(F)F)cc1[N+](=O)[O-] ZINC000175841450 1427924327 /nfs/dbraw/zinc/92/43/27/1427924327.db2.gz DJWUKIRENHIRLG-UHFFFAOYSA-N 0 0 386.376 3.059 20 5 GGBDRN CN(C(=O)CN1CCC[C@@H]1C[C@H](O)c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000175845150 1427926612 /nfs/dbraw/zinc/92/66/12/1427926612.db2.gz CWEDFMASNMFSEW-SJORKVTESA-N 0 0 389.477 3.207 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2nncn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000175851885 1427932539 /nfs/dbraw/zinc/93/25/39/1427932539.db2.gz RJWVDADPNDSTER-CQSZACIVSA-N 0 0 380.408 3.044 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(CCc1ccccc1)[C@H]1CCOC1 ZINC000175859803 1427937361 /nfs/dbraw/zinc/93/73/61/1427937361.db2.gz CRCUOQGWMGVDEX-KRWDZBQOSA-N 0 0 385.420 3.469 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000175889042 1427953012 /nfs/dbraw/zinc/95/30/12/1427953012.db2.gz IBCRGKWJJNUVGZ-CQSZACIVSA-N 0 0 384.436 3.213 20 5 GGBDRN Cc1cnc(C(C)(C)NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])s1 ZINC000175890162 1427954125 /nfs/dbraw/zinc/95/41/25/1427954125.db2.gz OMPBCJLIZFKARN-UHFFFAOYSA-N 0 0 375.859 3.227 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(C)Cc2ncc(CC)s2)cc([N+](=O)[O-])c1 ZINC000175894961 1427956493 /nfs/dbraw/zinc/95/64/93/1427956493.db2.gz HEVNTIJJQABSTL-UHFFFAOYSA-N 0 0 377.422 3.063 20 5 GGBDRN C[C@@H](NC(=O)N(C)Cc1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000175902755 1427961026 /nfs/dbraw/zinc/96/10/26/1427961026.db2.gz KQYWQNPMHAZEGJ-SRGMZFCMSA-N 0 0 375.450 3.235 20 5 GGBDRN C[C@H](NC(=O)N(C)Cc1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000175902773 1427961153 /nfs/dbraw/zinc/96/11/53/1427961153.db2.gz KQYWQNPMHAZEGJ-WHDAMIPWSA-N 0 0 375.450 3.235 20 5 GGBDRN C[C@@H](NC(=O)N(C)Cc1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000175902794 1427961309 /nfs/dbraw/zinc/96/13/09/1427961309.db2.gz KQYWQNPMHAZEGJ-ZBSNKRKSSA-N 0 0 375.450 3.235 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc(C)n1 ZINC000175904105 1427961969 /nfs/dbraw/zinc/96/19/69/1427961969.db2.gz JVSJZCQYILLBPH-CQSZACIVSA-N 0 0 398.467 3.031 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000175905159 1427962749 /nfs/dbraw/zinc/96/27/49/1427962749.db2.gz BFYCKFHJZYIHDF-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN CN(CC(=O)Nc1cccc(Oc2cccnn2)c1)c1ccccc1[N+](=O)[O-] ZINC000175910488 1427966300 /nfs/dbraw/zinc/96/63/00/1427966300.db2.gz IFOTVVSRMCHSDI-UHFFFAOYSA-N 0 0 379.376 3.252 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H](C)C2(N3CCOCC3)CCCC2)cc1[N+](=O)[O-] ZINC000175923027 1427973645 /nfs/dbraw/zinc/97/36/45/1427973645.db2.gz ZVUOVCHDTGVWLP-AWEZNQCLSA-N 0 0 393.509 3.080 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CN1CC[C@H](OCCCc2ccccc2)C1 ZINC000175924564 1427975381 /nfs/dbraw/zinc/97/53/81/1427975381.db2.gz QNSDHCMIZHDXOD-SFHVURJKSA-N 0 0 397.431 3.184 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CN1CC[C@@H](OCCCc2ccccc2)C1 ZINC000175924547 1427975393 /nfs/dbraw/zinc/97/53/93/1427975393.db2.gz QNSDHCMIZHDXOD-GOSISDBHSA-N 0 0 397.431 3.184 20 5 GGBDRN COCCOc1ccc(Cl)cc1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000175927543 1427978832 /nfs/dbraw/zinc/97/88/32/1427978832.db2.gz ZWNSLWHMUATABN-UHFFFAOYSA-N 0 0 393.827 3.115 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)cccc1[N+](=O)[O-] ZINC000175941156 1427986520 /nfs/dbraw/zinc/98/65/20/1427986520.db2.gz YAKHKCAFWODCLJ-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN C/C(=C\C(=O)OCCn1c(C)ncc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000175951113 1427991962 /nfs/dbraw/zinc/99/19/62/1427991962.db2.gz PYEWZXOAVGMNPP-PKNBQFBNSA-N 0 0 381.335 3.348 20 5 GGBDRN COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)cc1OCC(F)(F)F ZINC000175952589 1427992837 /nfs/dbraw/zinc/99/28/37/1427992837.db2.gz URVBHBYHYYXEFX-UHFFFAOYSA-N 0 0 385.298 3.379 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc2n(C)c3ccccc3n12 ZINC000175953610 1427994715 /nfs/dbraw/zinc/99/47/15/1427994715.db2.gz KDPNKSQQFJESIY-UHFFFAOYSA-N 0 0 396.432 3.168 20 5 GGBDRN CN(c1ccccc1)C1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000175960660 1427999737 /nfs/dbraw/zinc/99/97/37/1427999737.db2.gz BNCUXEIWQIIGAH-UHFFFAOYSA-N 0 0 382.464 3.448 20 5 GGBDRN COc1ccc(NC(=O)CN2CCSC3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000175964388 1428002437 /nfs/dbraw/zinc/00/24/37/1428002437.db2.gz WCUGNMDNGJXBDG-UHFFFAOYSA-N 0 0 379.482 3.294 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)NCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000175975945 1428008585 /nfs/dbraw/zinc/00/85/85/1428008585.db2.gz NVDFOUSJCKAUSJ-LBPRGKRZSA-N 0 0 397.391 3.214 20 5 GGBDRN CCCC[C@H](CCC)NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000175991968 1428017357 /nfs/dbraw/zinc/01/73/57/1428017357.db2.gz ZNOBVEPZSHUSKD-KRWDZBQOSA-N 0 0 390.484 3.421 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000175993921 1428018451 /nfs/dbraw/zinc/01/84/51/1428018451.db2.gz SMCCMKOAPJKCTR-CHWSQXEVSA-N 0 0 385.330 3.400 20 5 GGBDRN Cc1cc(C(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000176008078 1428024416 /nfs/dbraw/zinc/02/44/16/1428024416.db2.gz JILRNGUUBHCQCF-GFCCVEGCSA-N 0 0 397.435 3.260 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000176008065 1428024555 /nfs/dbraw/zinc/02/45/55/1428024555.db2.gz JILRNGUUBHCQCF-LBPRGKRZSA-N 0 0 397.435 3.260 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000176015171 1428028261 /nfs/dbraw/zinc/02/82/61/1428028261.db2.gz NRYHTLGDTJGGPI-NSHDSACASA-N 0 0 383.832 3.235 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NC2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000176019840 1428030014 /nfs/dbraw/zinc/03/00/14/1428030014.db2.gz DXFAYLQMJVUUGB-LBPRGKRZSA-N 0 0 388.390 3.290 20 5 GGBDRN CC(C)[C@@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccnc1 ZINC000176027427 1428034955 /nfs/dbraw/zinc/03/49/55/1428034955.db2.gz HYRCHBWYOJBQSS-CQSZACIVSA-N 0 0 390.827 3.138 20 5 GGBDRN CC(C)[C@@H](CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cccnc1 ZINC000176036667 1428039692 /nfs/dbraw/zinc/03/96/92/1428039692.db2.gz BCFOAVGFDHDRHD-CQSZACIVSA-N 0 0 390.827 3.138 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000176049396 1428049956 /nfs/dbraw/zinc/04/99/56/1428049956.db2.gz IDQGWWIHIARANR-AWEZNQCLSA-N 0 0 384.436 3.465 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000176049412 1428050094 /nfs/dbraw/zinc/05/00/94/1428050094.db2.gz IDQGWWIHIARANR-CQSZACIVSA-N 0 0 384.436 3.465 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCC(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000176050047 1428050904 /nfs/dbraw/zinc/05/09/04/1428050904.db2.gz WARCCZXCZOHNHW-OAHLLOKOSA-N 0 0 376.457 3.056 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)S(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC000176057707 1428056879 /nfs/dbraw/zinc/05/68/79/1428056879.db2.gz JABUREHCUABLRY-UHFFFAOYSA-N 0 0 382.413 3.262 20 5 GGBDRN O=C(NC[C@@H]1CSCCS1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000176059624 1428059313 /nfs/dbraw/zinc/05/93/13/1428059313.db2.gz QKIWWXHAXAXPFT-CQSZACIVSA-N 0 0 381.523 3.164 20 5 GGBDRN O=C(C=Cc1ccccc1[N+](=O)[O-])N1CCOC[C@H]1CC(=O)c1cccs1 ZINC000176078084 1428070232 /nfs/dbraw/zinc/07/02/32/1428070232.db2.gz VSBNYFCNZOBCLN-MVGZEHJDSA-N 0 0 386.429 3.170 20 5 GGBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@@H]1CC(=O)c1cccs1 ZINC000176081187 1428071916 /nfs/dbraw/zinc/07/19/16/1428071916.db2.gz UKNFDLQFPOWWRV-WHWKNOJMSA-N 0 0 386.429 3.170 20 5 GGBDRN C[C@H](O)CC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000176102763 1428084006 /nfs/dbraw/zinc/08/40/06/1428084006.db2.gz VYUYCWOVNCXXIP-HNNXBMFYSA-N 0 0 377.485 3.358 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000176109541 1428087806 /nfs/dbraw/zinc/08/78/06/1428087806.db2.gz YQZMRFBEOWMDIK-AWEZNQCLSA-N 0 0 382.844 3.439 20 5 GGBDRN CC1CCN(C(=O)c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N)cc2)CC1 ZINC000176112744 1428090204 /nfs/dbraw/zinc/09/02/04/1428090204.db2.gz STZJTHSZSNCPMA-UHFFFAOYSA-N 0 0 382.420 3.301 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCN(c2cc(F)ccc2F)CC1 ZINC000176117379 1428092717 /nfs/dbraw/zinc/09/27/17/1428092717.db2.gz YSJMHCSHXZHCKX-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCN(c2cc(F)ccc2F)CC1 ZINC000176117504 1428093511 /nfs/dbraw/zinc/09/35/11/1428093511.db2.gz TWJRWWHEVOFFTB-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCN(c2cc(F)ccc2F)CC1 ZINC000176117723 1428093575 /nfs/dbraw/zinc/09/35/75/1428093575.db2.gz VPTFTWITOIQKDN-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@H]1[C@@H]1CCCCC1=O ZINC000176128060 1428100834 /nfs/dbraw/zinc/10/08/34/1428100834.db2.gz XPJVVOZCJXPOCI-WMZOPIPTSA-N 0 0 382.420 3.144 20 5 GGBDRN CC(=O)Nc1ccc(CCNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000176130902 1428104087 /nfs/dbraw/zinc/10/40/87/1428104087.db2.gz VYAIBKDGCPNJOO-CQSZACIVSA-N 0 0 384.436 3.465 20 5 GGBDRN COc1ccccc1C[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000176133569 1428107288 /nfs/dbraw/zinc/10/72/88/1428107288.db2.gz XTNFREKTHHKDAW-QGZVFWFLSA-N 0 0 399.447 3.234 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(C(=O)c2cc[nH]c2)cc1 ZINC000176133398 1428107422 /nfs/dbraw/zinc/10/74/22/1428107422.db2.gz JLFRGLZIWUOWOP-UHFFFAOYSA-N 0 0 379.372 3.093 20 5 GGBDRN O=[N+]([O-])c1ccccc1C=CC[N@H+](Cc1ccc(-c2nnn[n-]2)cc1)C1CC1 ZINC000826500392 1428114272 /nfs/dbraw/zinc/11/42/72/1428114272.db2.gz WXKDKSWDPHPHDQ-HYXAFXHYSA-N 0 0 376.420 3.453 20 5 GGBDRN CCc1ccc(C(=O)OC[C@@H]2CC(=O)N(CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176165931 1428132177 /nfs/dbraw/zinc/13/21/77/1428132177.db2.gz XTJIIAIXUKZSCV-QGZVFWFLSA-N 0 0 396.443 3.405 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000176167945 1428134049 /nfs/dbraw/zinc/13/40/49/1428134049.db2.gz XZHGGOSFSZNZEY-UHFFFAOYSA-N 0 0 396.447 3.293 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000176172595 1428137561 /nfs/dbraw/zinc/13/75/61/1428137561.db2.gz GJUYZMFQEVWIOP-IBGZPJMESA-N 0 0 396.399 3.329 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176180429 1428144468 /nfs/dbraw/zinc/14/44/68/1428144468.db2.gz BKHZCBIVJAMBPW-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN Cc1cc(=O)n(C)cc1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000176187091 1428150510 /nfs/dbraw/zinc/15/05/10/1428150510.db2.gz QBQJZCMYDNFKRV-ZIAGYGMSSA-N 0 0 398.463 3.337 20 5 GGBDRN Cc1cc(=O)n(C)cc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000176187078 1428150769 /nfs/dbraw/zinc/15/07/69/1428150769.db2.gz QBQJZCMYDNFKRV-KBPBESRZSA-N 0 0 398.463 3.337 20 5 GGBDRN O=C(OCCn1cnc([N+](=O)[O-])n1)c1cc(C2CC2)nc2ccc(Cl)cc21 ZINC000176190602 1428154491 /nfs/dbraw/zinc/15/44/91/1428154491.db2.gz IOZZQPSAVVPLTJ-UHFFFAOYSA-N 0 0 387.783 3.122 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC(=O)Nc1ccc(F)c(F)c1F ZINC000176219136 1428174398 /nfs/dbraw/zinc/17/43/98/1428174398.db2.gz VZQXGNKKMLQOSL-UHFFFAOYSA-N 0 0 396.325 3.389 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccccc1C(=O)NC[C@@H]1CCCO1 ZINC000176221486 1428176160 /nfs/dbraw/zinc/17/61/60/1428176160.db2.gz ZWAJVNUPZPGYBV-KRWDZBQOSA-N 0 0 397.431 3.075 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000176223731 1428176636 /nfs/dbraw/zinc/17/66/36/1428176636.db2.gz SKZHHZCLXHHWIS-UHFFFAOYSA-N 0 0 399.407 3.474 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000176230742 1428180508 /nfs/dbraw/zinc/18/05/08/1428180508.db2.gz DMCHROWDUMNBJR-XJKSGUPXSA-N 0 0 375.450 3.183 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000176230706 1428180765 /nfs/dbraw/zinc/18/07/65/1428180765.db2.gz DMCHROWDUMNBJR-CJNGLKHVSA-N 0 0 375.450 3.183 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000176230720 1428180856 /nfs/dbraw/zinc/18/08/56/1428180856.db2.gz DMCHROWDUMNBJR-BBRMVZONSA-N 0 0 375.450 3.183 20 5 GGBDRN Cc1cc(F)cc(C(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)c1[N+](=O)[O-] ZINC000176239010 1428186622 /nfs/dbraw/zinc/18/66/22/1428186622.db2.gz DJWMMNXTYNLONW-KRWDZBQOSA-N 0 0 385.395 3.310 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000176245051 1428191343 /nfs/dbraw/zinc/19/13/43/1428191343.db2.gz GLJLSJBKYHPPCC-UHFFFAOYSA-N 0 0 397.475 3.271 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCC[S@](=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000176248353 1428194577 /nfs/dbraw/zinc/19/45/77/1428194577.db2.gz ICBZRIRDTMJQRV-RXAIFQJESA-N 0 0 389.477 3.212 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@@H]2C[C@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000176250620 1428195286 /nfs/dbraw/zinc/19/52/86/1428195286.db2.gz FHWQCBWWBJGQHP-HIFRSBDPSA-N 0 0 376.434 3.393 20 5 GGBDRN O=C(NCc1ccnc(N2CCCC2)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180175688 1429781980 /nfs/dbraw/zinc/78/19/80/1429781980.db2.gz LECRMMDQEIMSTI-UHFFFAOYSA-N 0 0 392.362 3.121 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CCO)cc([N+](=O)[O-])c1F ZINC000180177039 1429783337 /nfs/dbraw/zinc/78/33/37/1429783337.db2.gz FLEOCNGMXRBSKY-AWEZNQCLSA-N 0 0 396.440 3.004 20 5 GGBDRN C[C@@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000180180107 1429785707 /nfs/dbraw/zinc/78/57/07/1429785707.db2.gz FWIXRHCIBJTJMT-ZDUSSCGKSA-N 0 0 398.868 3.210 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CCO)c1C ZINC000180181552 1429787520 /nfs/dbraw/zinc/78/75/20/1429787520.db2.gz JIEZJHHTHFKAEO-HNNXBMFYSA-N 0 0 392.477 3.173 20 5 GGBDRN CC[N@@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000180192483 1429794963 /nfs/dbraw/zinc/79/49/63/1429794963.db2.gz OXCMYXQTSDTTFG-KRWDZBQOSA-N 0 0 399.447 3.133 20 5 GGBDRN CC(C)(O)CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000180207097 1429801881 /nfs/dbraw/zinc/80/18/81/1429801881.db2.gz MGVKUSDSFWEBMA-UHFFFAOYSA-N 0 0 391.855 3.460 20 5 GGBDRN CC(C)Oc1cccc(CN(C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000180212928 1429803525 /nfs/dbraw/zinc/80/35/25/1429803525.db2.gz FQQDABCBXHBFJB-UHFFFAOYSA-N 0 0 392.477 3.386 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180229297 1429808702 /nfs/dbraw/zinc/80/87/02/1429808702.db2.gz KZVLUWSDCRMVCD-KBXCAEBGSA-N 0 0 394.786 3.413 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NC2(c3ccc(F)cc3F)CCC2)cc1 ZINC000180234445 1429810361 /nfs/dbraw/zinc/81/03/61/1429810361.db2.gz SIIXYYCRCSQIIR-UHFFFAOYSA-N 0 0 396.415 3.414 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])n1 ZINC000180237549 1429811217 /nfs/dbraw/zinc/81/12/17/1429811217.db2.gz UENSQYOKWRHXAJ-UHFFFAOYSA-N 0 0 380.408 3.456 20 5 GGBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000180238578 1429811627 /nfs/dbraw/zinc/81/16/27/1429811627.db2.gz HVTVXJXLQYIZTF-HOTGVXAUSA-N 0 0 379.775 3.351 20 5 GGBDRN COc1cc(CN2CCO[C@@H](c3ccco3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180243206 1429812956 /nfs/dbraw/zinc/81/29/56/1429812956.db2.gz OFZJLNIJFYTSTG-QGZVFWFLSA-N 0 0 398.362 3.414 20 5 GGBDRN CCCc1cnc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)s1 ZINC000180256141 1429816469 /nfs/dbraw/zinc/81/64/69/1429816469.db2.gz DJBLVIJCDJMDBH-NSHDSACASA-N 0 0 394.478 3.309 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000180256280 1429816496 /nfs/dbraw/zinc/81/64/96/1429816496.db2.gz UHQUQEVXKWLESP-WMZOPIPTSA-N 0 0 394.786 3.413 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180258114 1429817181 /nfs/dbraw/zinc/81/71/81/1429817181.db2.gz HWCJKDMDSCTDAF-SJLPKXTDSA-N 0 0 394.786 3.413 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(c2ccccn2)C1 ZINC000180263794 1429818158 /nfs/dbraw/zinc/81/81/58/1429818158.db2.gz HRIZNTZXDYOVDB-CQSZACIVSA-N 0 0 386.477 3.499 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(c2ccccn2)C1 ZINC000180263812 1429818194 /nfs/dbraw/zinc/81/81/94/1429818194.db2.gz HRIZNTZXDYOVDB-AWEZNQCLSA-N 0 0 386.477 3.499 20 5 GGBDRN CCC[C@@](C)(CO)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000180264955 1429818578 /nfs/dbraw/zinc/81/85/78/1429818578.db2.gz YAYFLKAOUSPQBJ-XOBRGWDASA-N 0 0 386.452 3.444 20 5 GGBDRN CCCN1C(=O)CCc2cc(NC(=O)CN(C)c3ccccc3[N+](=O)[O-])ccc21 ZINC000180271652 1429820500 /nfs/dbraw/zinc/82/05/00/1429820500.db2.gz KRUQGSSJXXYLGB-UHFFFAOYSA-N 0 0 396.447 3.359 20 5 GGBDRN CN(C(=O)CCNC(=O)C(C)(C)C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180284180 1429824188 /nfs/dbraw/zinc/82/41/88/1429824188.db2.gz MCWDDGUTCRVCQW-UHFFFAOYSA-N 0 0 390.465 3.234 20 5 GGBDRN CCOCCN(C)C(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC000180286462 1429824919 /nfs/dbraw/zinc/82/49/19/1429824919.db2.gz ZFCQYXRSFCCNOJ-UHFFFAOYSA-N 0 0 399.447 3.000 20 5 GGBDRN C[C@@H](OC[C@@H]1CCCO1)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180292776 1429826934 /nfs/dbraw/zinc/82/69/34/1429826934.db2.gz WUKIRGKGCDURMJ-OLZOCXBDSA-N 0 0 391.449 3.265 20 5 GGBDRN CC(=O)N[C@@H](C)C(=O)N(CC(C)C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180299729 1429829618 /nfs/dbraw/zinc/82/96/18/1429829618.db2.gz HTYPWDMPJLZQOH-LBPRGKRZSA-N 0 0 390.465 3.232 20 5 GGBDRN COc1ccc(CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H](CO)C(C)C)cc1 ZINC000180302560 1429830322 /nfs/dbraw/zinc/83/03/22/1429830322.db2.gz HNQBBIWNSGGETQ-HXUWFJFHSA-N 0 0 386.448 3.192 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC[C@H]2CC(=O)c2ccccc2)c1[N+](=O)[O-] ZINC000180332640 1429838137 /nfs/dbraw/zinc/83/81/37/1429838137.db2.gz UMQXDODXDPKIRA-HNNXBMFYSA-N 0 0 383.404 3.408 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3c(C4CC4)nc4sccn34)C2)nc1 ZINC000180344194 1429841073 /nfs/dbraw/zinc/84/10/73/1429841073.db2.gz AWADKZOERDVUJS-CYBMUJFWSA-N 0 0 384.465 3.263 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1cc(C)ccc1C ZINC000180348186 1429842137 /nfs/dbraw/zinc/84/21/37/1429842137.db2.gz IQUCPKJEECYQMN-UHFFFAOYSA-N 0 0 393.403 3.283 20 5 GGBDRN Cn1cnnc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000180348838 1429842285 /nfs/dbraw/zinc/84/22/85/1429842285.db2.gz FAERPVFJJIIFEJ-UHFFFAOYSA-N 0 0 389.318 3.244 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000180352236 1429843227 /nfs/dbraw/zinc/84/32/27/1429843227.db2.gz RUFFLIUOUADJTL-UHFFFAOYSA-N 0 0 386.433 3.073 20 5 GGBDRN O=C(Nc1c(F)cc(Cl)cc1F)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000180354450 1429844384 /nfs/dbraw/zinc/84/43/84/1429844384.db2.gz CTBMJIVCNKVRRA-UHFFFAOYSA-N 0 0 379.710 3.359 20 5 GGBDRN CC(C)C[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C(=O)Nc1nccs1 ZINC000180360487 1429846128 /nfs/dbraw/zinc/84/61/28/1429846128.db2.gz DRTZNDHWAUACMZ-CYBMUJFWSA-N 0 0 396.856 3.488 20 5 GGBDRN CC(C)C[C@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1nccs1 ZINC000180368585 1429848160 /nfs/dbraw/zinc/84/81/60/1429848160.db2.gz VOFZMWHSGBUEQU-PXTSUWAFSA-N 0 0 388.449 3.234 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cnn1-c1ccccc1F ZINC000180371399 1429849200 /nfs/dbraw/zinc/84/92/00/1429849200.db2.gz QVZUYFGTKDRUGV-UHFFFAOYSA-N 0 0 397.366 3.114 20 5 GGBDRN Cc1c([C@H](C)Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)cnn1C ZINC000180397355 1429856680 /nfs/dbraw/zinc/85/66/80/1429856680.db2.gz MRBOXFAZCVHZAD-JTQLQIEISA-N 0 0 388.815 3.009 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000180398166 1429856724 /nfs/dbraw/zinc/85/67/24/1429856724.db2.gz BMZAECZELAZRPH-UHFFFAOYSA-N 0 0 396.190 3.141 20 5 GGBDRN CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(-c2nnn[n-]2)c1 ZINC000825127612 1429856894 /nfs/dbraw/zinc/85/68/94/1429856894.db2.gz OGMRAQXIWVZNOX-HNNXBMFYSA-N 0 0 384.465 3.435 20 5 GGBDRN CC(C)NC(=O)c1ccc(NCCCN(C)CC(F)(F)F)c([N+](=O)[O-])c1 ZINC000180403713 1429858778 /nfs/dbraw/zinc/85/87/78/1429858778.db2.gz PMQFJZYUOLZMRF-UHFFFAOYSA-N 0 0 376.379 3.029 20 5 GGBDRN CC1(C)CN(CC(F)(F)F)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000180411916 1429861362 /nfs/dbraw/zinc/86/13/62/1429861362.db2.gz RODWRELUUNZABG-UHFFFAOYSA-N 0 0 393.793 3.276 20 5 GGBDRN CCOC(=O)c1cc(C)sc1NC(=O)CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180433818 1429868616 /nfs/dbraw/zinc/86/86/16/1429868616.db2.gz GMEQSFJCZJLVGZ-GFCCVEGCSA-N 0 0 391.449 3.431 20 5 GGBDRN C[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000180447298 1429871516 /nfs/dbraw/zinc/87/15/16/1429871516.db2.gz IKBUSDZPTFVCER-SNVBAGLBSA-N 0 0 378.772 3.446 20 5 GGBDRN O=C(CCS(=O)(=O)C1CCCC1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180468020 1429876186 /nfs/dbraw/zinc/87/61/86/1429876186.db2.gz OSSOUSNLBAKZML-UHFFFAOYSA-N 0 0 394.371 3.300 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cc(-n2cccn2)ccn1 ZINC000180469071 1429876188 /nfs/dbraw/zinc/87/61/88/1429876188.db2.gz CTGBNCVHXYUAHD-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CC(=O)N(Cc2ccco2)C1 ZINC000180468282 1429876206 /nfs/dbraw/zinc/87/62/06/1429876206.db2.gz SZPGZRJNNWBXPG-JTQLQIEISA-N 0 0 397.309 3.194 20 5 GGBDRN CC(C)n1nnnc1-c1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1F ZINC000180471618 1429877395 /nfs/dbraw/zinc/87/73/95/1429877395.db2.gz UVONZPBMOHSRGP-UHFFFAOYSA-N 0 0 376.373 3.282 20 5 GGBDRN Cc1ccc(Sc2ccc(CN3CCN4C(=O)NC[C@@H]4C3)cc2[N+](=O)[O-])cc1 ZINC000180479616 1429879448 /nfs/dbraw/zinc/87/94/48/1429879448.db2.gz PDEIVOUQFYIXNZ-MRXNPFEDSA-N 0 0 398.488 3.264 20 5 GGBDRN CN(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)Cc1cc(F)c(F)c(F)c1 ZINC000180490180 1429881513 /nfs/dbraw/zinc/88/15/13/1429881513.db2.gz MXSKLHMJUHOQKB-UHFFFAOYSA-N 0 0 379.338 3.033 20 5 GGBDRN Cc1ccc([C@@](O)(CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C(F)(F)F)o1 ZINC000180491985 1429881654 /nfs/dbraw/zinc/88/16/54/1429881654.db2.gz GOSBMZKBIDNGIT-HNNXBMFYSA-N 0 0 398.297 3.151 20 5 GGBDRN COc1cc(NC(=O)CN(C)C/C=C/c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000180499690 1429883467 /nfs/dbraw/zinc/88/34/67/1429883467.db2.gz JLRTZANYXNRNOF-SOFGYWHQSA-N 0 0 385.420 3.196 20 5 GGBDRN CCc1cc(NC(=O)c2ccc3c(c2)nnn3C)c2cc([N+](=O)[O-])ccc2n1 ZINC000180504607 1429884462 /nfs/dbraw/zinc/88/44/62/1429884462.db2.gz UKLXTBQUGUQXRX-UHFFFAOYSA-N 0 0 376.376 3.239 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N(C)Cc2cc(F)c(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000180504645 1429884465 /nfs/dbraw/zinc/88/44/65/1429884465.db2.gz LWACROWLECIFNG-JTQLQIEISA-N 0 0 397.353 3.480 20 5 GGBDRN CCc1cc(NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000180505596 1429884610 /nfs/dbraw/zinc/88/46/10/1429884610.db2.gz UWHRIMMOHPNWDW-CQSZACIVSA-N 0 0 396.447 3.293 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@]2(C)CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000180508409 1429885739 /nfs/dbraw/zinc/88/57/39/1429885739.db2.gz GQKNTVMIVUKBEP-OAQYLSRUSA-N 0 0 381.432 3.252 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000180520529 1429888581 /nfs/dbraw/zinc/88/85/81/1429888581.db2.gz QSTBJDIVDLUTDL-UHFFFAOYSA-N 0 0 380.326 3.396 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000180520855 1429888589 /nfs/dbraw/zinc/88/85/89/1429888589.db2.gz LDHPPLNSSVZPSK-DLBZAZTESA-N 0 0 377.347 3.202 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccccc1COCc1ccccc1 ZINC000180529681 1429891025 /nfs/dbraw/zinc/89/10/25/1429891025.db2.gz VZMLVBCTVGSWRJ-UHFFFAOYSA-N 0 0 392.415 3.219 20 5 GGBDRN Cn1cnn(-c2ccc(NC(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)cc2)c1=O ZINC000180530414 1429891332 /nfs/dbraw/zinc/89/13/32/1429891332.db2.gz BHENQBOCBRRTSQ-UHFFFAOYSA-N 0 0 395.419 3.029 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)c1cccc(OCc2ccccn2)c1 ZINC000180539157 1429893159 /nfs/dbraw/zinc/89/31/59/1429893159.db2.gz XRRMEHJMFVLYFC-ZDUSSCGKSA-N 0 0 393.403 3.037 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 ZINC000180555644 1429896681 /nfs/dbraw/zinc/89/66/81/1429896681.db2.gz KPWRUZNCGLCCLA-UHFFFAOYSA-N 0 0 383.389 3.138 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000180555692 1429896704 /nfs/dbraw/zinc/89/67/04/1429896704.db2.gz KUJJVQBCILLUME-UHFFFAOYSA-N 0 0 393.346 3.079 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000180560940 1429897780 /nfs/dbraw/zinc/89/77/80/1429897780.db2.gz GRHUMEJANZGLDD-UHFFFAOYSA-N 0 0 388.387 3.045 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)cc1O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000180560050 1429897783 /nfs/dbraw/zinc/89/77/83/1429897783.db2.gz OQQICSNCTSBLRZ-NSHDSACASA-N 0 0 396.325 3.041 20 5 GGBDRN C[C@@H]1CN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@@H]2CCCC[C@@H]21 ZINC000180560307 1429897979 /nfs/dbraw/zinc/89/79/79/1429897979.db2.gz HJEUQJJWSJVFJF-FVQBIDKESA-N 0 0 387.436 3.320 20 5 GGBDRN C[C@@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000180564119 1429898898 /nfs/dbraw/zinc/89/88/98/1429898898.db2.gz SMNDLIVDCGQRLX-YRGRVCCFSA-N 0 0 379.844 3.015 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000180582135 1429911651 /nfs/dbraw/zinc/91/16/51/1429911651.db2.gz DWBVFTYXKGEXDB-MSOLQXFVSA-N 0 0 391.374 3.245 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000180582154 1429911851 /nfs/dbraw/zinc/91/18/51/1429911851.db2.gz DWBVFTYXKGEXDB-ROUUACIJSA-N 0 0 391.374 3.245 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccn1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000180592416 1429918160 /nfs/dbraw/zinc/91/81/60/1429918160.db2.gz ZFRZHSWKEAKDRU-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccn1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000180592490 1429918536 /nfs/dbraw/zinc/91/85/36/1429918536.db2.gz IQRNWSFFJBFJCH-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180594684 1429920263 /nfs/dbraw/zinc/92/02/63/1429920263.db2.gz CPOSBKHHTRDEPV-UHFFFAOYSA-N 0 0 397.218 3.195 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccn1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000180613769 1429933811 /nfs/dbraw/zinc/93/38/11/1429933811.db2.gz WPTZZBIVXVVNRY-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(-n2ccnn2)cc1 ZINC000180618189 1429935619 /nfs/dbraw/zinc/93/56/19/1429935619.db2.gz BJABNCASVUIIHV-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000180621195 1429936960 /nfs/dbraw/zinc/93/69/60/1429936960.db2.gz WGWJDLIMWMOOTA-IRXDYDNUSA-N 0 0 377.347 3.202 20 5 GGBDRN C[C@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180624394 1429939472 /nfs/dbraw/zinc/93/94/72/1429939472.db2.gz YYTULOCUDKTDCW-JQWIXIFHSA-N 0 0 387.230 3.270 20 5 GGBDRN CCC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180626565 1429940434 /nfs/dbraw/zinc/94/04/34/1429940434.db2.gz SBJJJQHCFDLDCA-GFCCVEGCSA-N 0 0 384.230 3.087 20 5 GGBDRN CCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180626581 1429940446 /nfs/dbraw/zinc/94/04/46/1429940446.db2.gz SBJJJQHCFDLDCA-LBPRGKRZSA-N 0 0 384.230 3.087 20 5 GGBDRN COc1ccccc1CCCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000180642889 1429951229 /nfs/dbraw/zinc/95/12/29/1429951229.db2.gz NUEPJOYLLGINFB-FQEVSTJZSA-N 0 0 383.404 3.003 20 5 GGBDRN O=C(Nc1c[nH]nc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000180647957 1429953951 /nfs/dbraw/zinc/95/39/51/1429953951.db2.gz IXBHVIQYKKJRAE-UHFFFAOYSA-N 0 0 385.767 3.216 20 5 GGBDRN CCCn1cc(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cn1 ZINC000180649393 1429954409 /nfs/dbraw/zinc/95/44/09/1429954409.db2.gz RANWKZAYLSHAIQ-INIZCTEOSA-N 0 0 388.424 3.014 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1 ZINC000180651743 1429956751 /nfs/dbraw/zinc/95/67/51/1429956751.db2.gz ZYEDTYFUIVDEAE-QGZVFWFLSA-N 0 0 388.855 3.397 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N[C@H]2CC23CCCCC3)ccc1[N+](=O)[O-] ZINC000180652748 1429957633 /nfs/dbraw/zinc/95/76/33/1429957633.db2.gz JLHBKFAQXSQGJR-MSOLQXFVSA-N 0 0 385.464 3.347 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1cccnc1Oc1cccc(F)c1 ZINC000180654147 1429958299 /nfs/dbraw/zinc/95/82/99/1429958299.db2.gz MTXCUNHMETVKOK-UHFFFAOYSA-N 0 0 382.351 3.433 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000180699470 1429984750 /nfs/dbraw/zinc/98/47/50/1429984750.db2.gz UOOSHOMSTAOGOX-GFCCVEGCSA-N 0 0 391.346 3.025 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc2c(c1)CC(=O)N2 ZINC000180701693 1429986732 /nfs/dbraw/zinc/98/67/32/1429986732.db2.gz XILTYFROLHRDDW-VIFPVBQESA-N 0 0 391.330 3.182 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000180705121 1429988381 /nfs/dbraw/zinc/98/83/81/1429988381.db2.gz MLJRDAPHCUMIIQ-UHFFFAOYSA-N 0 0 379.319 3.198 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(C(=O)Nc2ccncc2)c1 ZINC000180732344 1430005719 /nfs/dbraw/zinc/00/57/19/1430005719.db2.gz OOJFCRMIQUVYQM-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000180739121 1430009653 /nfs/dbraw/zinc/00/96/53/1430009653.db2.gz SALSLANLBZYTSO-ZDUSSCGKSA-N 0 0 388.855 3.395 20 5 GGBDRN COc1ccc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])cc1OC1CCCC1 ZINC000180752081 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387.461 3.468 20 5 GGBDRN O=C(c1ccc(F)c(Cl)c1F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000181984142 1430392109 /nfs/dbraw/zinc/39/21/09/1430392109.db2.gz KIAJXMWDXIYVQH-SECBINFHSA-N 0 0 382.754 3.248 20 5 GGBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCNC(=O)[C@H]1c1ccccc1Cl ZINC000181998706 1430393961 /nfs/dbraw/zinc/39/39/61/1430393961.db2.gz IESZERRTRJEFSS-QGZVFWFLSA-N 0 0 398.806 3.043 20 5 GGBDRN CN(C)c1cccc([C@@H]2CCCN2C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c1 ZINC000182003802 1430394745 /nfs/dbraw/zinc/39/47/45/1430394745.db2.gz AFXOODIWPDLHMG-INIZCTEOSA-N 0 0 383.404 3.367 20 5 GGBDRN COc1ccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 ZINC000182004488 1430394991 /nfs/dbraw/zinc/39/49/91/1430394991.db2.gz JKUXQCLSHFHECT-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN O=C(Nc1cnn(CC(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182022470 1430398334 /nfs/dbraw/zinc/39/83/34/1430398334.db2.gz JJUCBSSMCAQCDK-UHFFFAOYSA-N 0 0 380.229 3.207 20 5 GGBDRN O=C(Nc1cccc(OCC(F)F)n1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182035364 1430399488 /nfs/dbraw/zinc/39/94/88/1430399488.db2.gz VOTSXMWZODXIJA-UHFFFAOYSA-N 0 0 389.261 3.487 20 5 GGBDRN Cc1ccc(CCCOc2c([N+](=O)[O-])cc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000182036733 1430399841 /nfs/dbraw/zinc/39/98/41/1430399841.db2.gz DNJXVERIHLFQHH-UHFFFAOYSA-N 0 0 394.405 3.227 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCn2cccc2[C@@H]1c1ccccc1 ZINC000182054996 1430403115 /nfs/dbraw/zinc/40/31/15/1430403115.db2.gz HJWKYHROQWZSLF-AVRDEDQJSA-N 0 0 393.443 3.241 20 5 GGBDRN O=C(NCCCNc1cccc(F)c1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000182067668 1430405204 /nfs/dbraw/zinc/40/52/04/1430405204.db2.gz KARJXLBQYBYQBX-UHFFFAOYSA-N 0 0 383.383 3.152 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H](c1nccs1)c1ccccc1 ZINC000182082759 1430408214 /nfs/dbraw/zinc/40/82/14/1430408214.db2.gz UENJCEXVVPKNIS-YJBOKZPZSA-N 0 0 385.445 3.170 20 5 GGBDRN CNC(=O)c1ccc(NCCCc2nc(-c3ccc(F)cc3)no2)c([N+](=O)[O-])c1 ZINC000182083521 1430408366 /nfs/dbraw/zinc/40/83/66/1430408366.db2.gz CZMWSZKCVBLJGJ-UHFFFAOYSA-N 0 0 399.382 3.188 20 5 GGBDRN Cc1ccc(C[C@@H](C)C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000182104509 1430412852 /nfs/dbraw/zinc/41/28/52/1430412852.db2.gz JNMBPNJYCJYTQG-QGZVFWFLSA-N 0 0 395.459 3.066 20 5 GGBDRN CC[NH+](CC)CCN(Cc1cccs1)C(=O)c1cc([N+](=O)[O-])ccc1[O-] ZINC000182106836 1430412940 /nfs/dbraw/zinc/41/29/40/1430412940.db2.gz FKKDTDJHASHJAH-UHFFFAOYSA-N 0 0 377.466 3.346 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1[O-])N1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000182123815 1430415948 /nfs/dbraw/zinc/41/59/48/1430415948.db2.gz OLIAVEPJBJUURC-PXNSSMCTSA-N 0 0 395.459 3.427 20 5 GGBDRN O=C(Nc1nc(-c2cccs2)ns1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000182145286 1430419758 /nfs/dbraw/zinc/41/97/58/1430419758.db2.gz NEJDBZBDQPUAQL-UHFFFAOYSA-N 0 0 399.417 3.008 20 5 GGBDRN O=C(Nc1ccc2c(c1)NC(=O)CC2)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182166611 1430423257 /nfs/dbraw/zinc/42/32/57/1430423257.db2.gz GEJHHEHTEPOITC-UHFFFAOYSA-N 0 0 377.303 3.333 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000182168752 1430423550 /nfs/dbraw/zinc/42/35/50/1430423550.db2.gz ZTTALZHRSMPBOS-MRXNPFEDSA-N 0 0 395.506 3.143 20 5 GGBDRN CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1cc([N+](=O)[O-])ccc1[O-] ZINC000182179274 1430425056 /nfs/dbraw/zinc/42/50/56/1430425056.db2.gz FLCUFNTZWBCNLC-UHFFFAOYSA-N 0 0 384.436 3.074 20 5 GGBDRN Cc1ccccc1-c1nnc(SC[C@H](O)COc2ccccc2[N+](=O)[O-])o1 ZINC000182181286 1430425424 /nfs/dbraw/zinc/42/54/24/1430425424.db2.gz LMUJUPCSGYPKRC-CYBMUJFWSA-N 0 0 387.417 3.485 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CSc1n[nH]c(-c2ccccc2F)n1 ZINC000182181044 1430425488 /nfs/dbraw/zinc/42/54/88/1430425488.db2.gz ICDZAECYYPGJDA-NSHDSACASA-N 0 0 390.396 3.051 20 5 GGBDRN CN1CCCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c2cc(Cl)ccc21 ZINC000182183018 1430425793 /nfs/dbraw/zinc/42/57/93/1430425793.db2.gz DMADTBSMPHRVMT-UHFFFAOYSA-N 0 0 389.795 3.464 20 5 GGBDRN Cc1ccc(-c2nnc(SC[C@H](O)COc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000182183873 1430426003 /nfs/dbraw/zinc/42/60/03/1430426003.db2.gz IBSOTZRFYWPWCS-CQSZACIVSA-N 0 0 387.417 3.485 20 5 GGBDRN COc1cccc([C@@H]2CCCN2CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000182200166 1430428759 /nfs/dbraw/zinc/42/87/59/1430428759.db2.gz FMHVYZALNXDCQE-IBGZPJMESA-N 0 0 390.461 3.214 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN(Cc1ccco1)Cc1cccnc1 ZINC000182201417 1430429135 /nfs/dbraw/zinc/42/91/35/1430429135.db2.gz ZFASBKGDTPPEGD-KRWDZBQOSA-N 0 0 383.404 3.025 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN(Cc1ccco1)Cc1cccnc1 ZINC000182201396 1430429148 /nfs/dbraw/zinc/42/91/48/1430429148.db2.gz ZFASBKGDTPPEGD-QGZVFWFLSA-N 0 0 383.404 3.025 20 5 GGBDRN COc1ccc([C@H](C)N(C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000182203459 1430429564 /nfs/dbraw/zinc/42/95/64/1430429564.db2.gz YZANRKOHUREDPF-AWEZNQCLSA-N 0 0 378.450 3.070 20 5 GGBDRN C[C@@]1(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCCc2ccccc21 ZINC000182205896 1430429797 /nfs/dbraw/zinc/42/97/97/1430429797.db2.gz CQBNQLAVGAAWKU-QFIPXVFZSA-N 0 0 391.427 3.460 20 5 GGBDRN C[C@]1(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCCc2ccccc21 ZINC000182205879 1430429890 /nfs/dbraw/zinc/42/98/90/1430429890.db2.gz CQBNQLAVGAAWKU-JOCHJYFZSA-N 0 0 391.427 3.460 20 5 GGBDRN O=C(NCCCc1nc(-c2ccc(F)cc2)no1)NCc1ccccc1[N+](=O)[O-] ZINC000182207566 1430430312 /nfs/dbraw/zinc/43/03/12/1430430312.db2.gz VHBKFAWZLQQDBJ-UHFFFAOYSA-N 0 0 399.382 3.216 20 5 GGBDRN COc1ccc(CCNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1OC ZINC000182221936 1430432343 /nfs/dbraw/zinc/43/23/43/1430432343.db2.gz ZPWSFDOYIWWLGX-GFCCVEGCSA-N 0 0 376.384 3.214 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1nc(C(C)(C)C)no1 ZINC000182236658 1430434622 /nfs/dbraw/zinc/43/46/22/1430434622.db2.gz JGXUSTPZZFSPOV-QMMMGPOBSA-N 0 0 384.339 3.368 20 5 GGBDRN CC1(C)CN(CC(F)(F)F)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182240504 1430435356 /nfs/dbraw/zinc/43/53/56/1430435356.db2.gz RSPHRSLIIHAUEN-UHFFFAOYSA-N 0 0 399.373 3.103 20 5 GGBDRN CC1(C)CN(CC(F)(F)F)CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000182242970 1430435882 /nfs/dbraw/zinc/43/58/82/1430435882.db2.gz AIGHGEZTEPCLSE-UHFFFAOYSA-N 0 0 399.373 3.103 20 5 GGBDRN Cn1cc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])c(-c2ccccc2)n1 ZINC000182252114 1430437406 /nfs/dbraw/zinc/43/74/06/1430437406.db2.gz HCVNIGRXUNWIBU-UHFFFAOYSA-N 0 0 380.404 3.081 20 5 GGBDRN O=C(NCCc1nc2cc(F)ccc2[nH]1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182251075 1430437459 /nfs/dbraw/zinc/43/74/59/1430437459.db2.gz HYDYLVGEKKIPNB-UHFFFAOYSA-N 0 0 394.309 3.184 20 5 GGBDRN Cc1cc(NC(=O)C2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)no1 ZINC000182254532 1430437698 /nfs/dbraw/zinc/43/76/98/1430437698.db2.gz FOSQZCXGJHMIBQ-UHFFFAOYSA-N 0 0 378.816 3.395 20 5 GGBDRN Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c(-c2ccccc2)n1 ZINC000182254703 1430437955 /nfs/dbraw/zinc/43/79/55/1430437955.db2.gz RQXKHUMRZXUAHJ-UHFFFAOYSA-N 0 0 387.399 3.474 20 5 GGBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(F)cc1 ZINC000182257429 1430438415 /nfs/dbraw/zinc/43/84/15/1430438415.db2.gz TZDAYPRXVMTCLF-OAHLLOKOSA-N 0 0 384.310 3.453 20 5 GGBDRN CC(C)[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1F ZINC000182259319 1430438547 /nfs/dbraw/zinc/43/85/47/1430438547.db2.gz OBOWVRUYJKGGDQ-KRWDZBQOSA-N 0 0 381.791 3.063 20 5 GGBDRN C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000182261160 1430439122 /nfs/dbraw/zinc/43/91/22/1430439122.db2.gz IBOYMPFUKHELGJ-NSHDSACASA-N 0 0 395.337 3.300 20 5 GGBDRN COc1ccc(OC[C@H](O)COc2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000182266761 1430440001 /nfs/dbraw/zinc/44/00/01/1430440001.db2.gz PSOLFJVFKLFMOM-LLVKDONJSA-N 0 0 387.310 3.441 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NCC2(CO)CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000182278667 1430441734 /nfs/dbraw/zinc/44/17/34/1430441734.db2.gz FHJOZKIOIPXDEB-CQSZACIVSA-N 0 0 384.436 3.055 20 5 GGBDRN COc1cccc(N2CCN(C(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000182278596 1430441872 /nfs/dbraw/zinc/44/18/72/1430441872.db2.gz UDUFRDYCGFNPBT-AWEZNQCLSA-N 0 0 387.411 3.195 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)COc1ccc(-c2noc(C3CC3)n2)cc1 ZINC000182291195 1430443573 /nfs/dbraw/zinc/44/35/73/1430443573.db2.gz IIDBLTGBIVXMMR-HNNXBMFYSA-N 0 0 397.387 3.341 20 5 GGBDRN CC(=O)c1cccc(OC[C@@H](O)Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)c1 ZINC000182307112 1430445598 /nfs/dbraw/zinc/44/55/98/1430445598.db2.gz XRMKTJHBVBOBRD-KRWDZBQOSA-N 0 0 381.388 3.101 20 5 GGBDRN CC(=O)c1cccc(OC[C@H](O)Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)c1 ZINC000182307090 1430445783 /nfs/dbraw/zinc/44/57/83/1430445783.db2.gz XRMKTJHBVBOBRD-QGZVFWFLSA-N 0 0 381.388 3.101 20 5 GGBDRN CCCCN(CCCO)C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000182316896 1430447594 /nfs/dbraw/zinc/44/75/94/1430447594.db2.gz LLMUPALSARGNPB-UHFFFAOYSA-N 0 0 377.485 3.456 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1C(=O)N(C)C ZINC000182331306 1430449635 /nfs/dbraw/zinc/44/96/35/1430449635.db2.gz BBYOPOFRRBAQCX-UHFFFAOYSA-N 0 0 393.346 3.459 20 5 GGBDRN Cc1cc(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)nn1-c1ccc(C)cc1 ZINC000182336739 1430450464 /nfs/dbraw/zinc/45/04/64/1430450464.db2.gz BMBZNOKRPNASAI-UHFFFAOYSA-N 0 0 391.431 3.399 20 5 GGBDRN CN(CC(=O)NC1CC1)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000182351419 1430452501 /nfs/dbraw/zinc/45/25/01/1430452501.db2.gz YUUQFHQVZNVIEM-UHFFFAOYSA-N 0 0 391.493 3.228 20 5 GGBDRN O=C(NC[C@@H](CCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182355299 1430452686 /nfs/dbraw/zinc/45/26/86/1430452686.db2.gz GJDLRTDSAPHXTH-CYBMUJFWSA-N 0 0 380.347 3.092 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCN(c2cccs2)CC1 ZINC000182381270 1430456228 /nfs/dbraw/zinc/45/62/28/1430456228.db2.gz SPNMIOBWLNFNBG-UHFFFAOYSA-N 0 0 383.376 3.220 20 5 GGBDRN CC[C@H](C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1)N1CCCC1=O ZINC000182382217 1430456563 /nfs/dbraw/zinc/45/65/63/1430456563.db2.gz IGNNVRKAWDXQJE-CQSZACIVSA-N 0 0 388.449 3.082 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000182404603 1430461524 /nfs/dbraw/zinc/46/15/24/1430461524.db2.gz ZJCNHEVKHFUZEM-UHFFFAOYSA-N 0 0 391.449 3.184 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc(OCC(F)F)cc1 ZINC000182415032 1430463555 /nfs/dbraw/zinc/46/35/55/1430463555.db2.gz PCQQHYVKWRLMMG-UHFFFAOYSA-N 0 0 386.376 3.059 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000182416703 1430464064 /nfs/dbraw/zinc/46/40/64/1430464064.db2.gz QQASJFPKLSOTFC-UHFFFAOYSA-N 0 0 390.484 3.165 20 5 GGBDRN Cc1cc(NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000182423354 1430465111 /nfs/dbraw/zinc/46/51/11/1430465111.db2.gz GBOYTMWKFULPLL-KRWDZBQOSA-N 0 0 381.432 3.323 20 5 GGBDRN CCOc1ccccc1C(=O)NCCCC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000182427049 1430466084 /nfs/dbraw/zinc/46/60/84/1430466084.db2.gz XZEBIQBIFAJDKE-UHFFFAOYSA-N 0 0 385.420 3.451 20 5 GGBDRN CC[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000182428606 1430466357 /nfs/dbraw/zinc/46/63/57/1430466357.db2.gz MCLDCXAECLNXQG-QGZVFWFLSA-N 0 0 384.404 3.388 20 5 GGBDRN Cc1cc(NC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)ccc1[N+](=O)[O-] ZINC000182430225 1430466472 /nfs/dbraw/zinc/46/64/72/1430466472.db2.gz HQDUXLGVJQWBKY-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)n(C)c21 ZINC000182433655 1430466939 /nfs/dbraw/zinc/46/69/39/1430466939.db2.gz VCAWGWQFKQZHAE-UHFFFAOYSA-N 0 0 390.346 3.321 20 5 GGBDRN Cc1cc(NC(=O)CSc2nnc(-c3cccs3)n2C)ccc1[N+](=O)[O-] ZINC000182436241 1430467796 /nfs/dbraw/zinc/46/77/96/1430467796.db2.gz IWQROPWMVQUBTH-UHFFFAOYSA-N 0 0 389.462 3.491 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000182443396 1430468589 /nfs/dbraw/zinc/46/85/89/1430468589.db2.gz ZSGJLICBKLKRCE-SFHVURJKSA-N 0 0 398.394 3.210 20 5 GGBDRN CCn1c2ccc(C)cc2nc1NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000182469948 1430473093 /nfs/dbraw/zinc/47/30/93/1430473093.db2.gz FGSZNXUGVWTANO-UHFFFAOYSA-N 0 0 384.392 3.299 20 5 GGBDRN CCOC(=O)Cc1csc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000182476267 1430473954 /nfs/dbraw/zinc/47/39/54/1430473954.db2.gz CFJKFTFQPARYNQ-VIFPVBQESA-N 0 0 381.385 3.038 20 5 GGBDRN CCS(=O)(=O)c1ccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000182486198 1430475740 /nfs/dbraw/zinc/47/57/40/1430475740.db2.gz AVJKZIAWIWAUPT-LLVKDONJSA-N 0 0 380.397 3.270 20 5 GGBDRN CCn1c2ccc(C)cc2nc1NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000182492172 1430476698 /nfs/dbraw/zinc/47/66/98/1430476698.db2.gz XYMSLOPHVVTRCO-CYBMUJFWSA-N 0 0 395.419 3.030 20 5 GGBDRN COc1cc(CNc2ccc(C(N)=O)c(C)c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182495438 1430477443 /nfs/dbraw/zinc/47/74/43/1430477443.db2.gz SVYRVVRJHDZLAG-UHFFFAOYSA-N 0 0 395.362 3.267 20 5 GGBDRN C[C@H](C(=O)NCCc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182499733 1430478653 /nfs/dbraw/zinc/47/86/53/1430478653.db2.gz KIHISSHZQYGLMT-AWEZNQCLSA-N 0 0 382.395 3.382 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182501872 1430479251 /nfs/dbraw/zinc/47/92/51/1430479251.db2.gz PLLQTTMEDFRGDT-AEFFLSMTSA-N 0 0 376.796 3.273 20 5 GGBDRN Cc1cc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)nn1-c1ccccc1Cl ZINC000182512886 1430481158 /nfs/dbraw/zinc/48/11/58/1430481158.db2.gz HAOFZRHRKVBJQQ-UHFFFAOYSA-N 0 0 388.815 3.276 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000182511441 1430481219 /nfs/dbraw/zinc/48/12/19/1430481219.db2.gz SJACEVKCDYZBTL-JTQLQIEISA-N 0 0 384.358 3.390 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000182527612 1430483932 /nfs/dbraw/zinc/48/39/32/1430483932.db2.gz HZYCDLBMYBGZGW-GFCCVEGCSA-N 0 0 381.392 3.454 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182535841 1430485767 /nfs/dbraw/zinc/48/57/67/1430485767.db2.gz HNUJUMNMZURCDF-GFCCVEGCSA-N 0 0 399.378 3.125 20 5 GGBDRN Cc1cc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)nn1-c1cc(C)cc(C)c1 ZINC000182536713 1430485888 /nfs/dbraw/zinc/48/58/88/1430485888.db2.gz NZZOEQCZQASQHI-UHFFFAOYSA-N 0 0 382.424 3.239 20 5 GGBDRN O=C(CCc1ccc2[nH]ccc2c1)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182536043 1430485894 /nfs/dbraw/zinc/48/58/94/1430485894.db2.gz CRLZCTPLHKGFAB-UHFFFAOYSA-N 0 0 376.376 3.433 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000182543398 1430487421 /nfs/dbraw/zinc/48/74/21/1430487421.db2.gz PPEMRDSXUNAYGH-XJKSGUPXSA-N 0 0 378.816 3.184 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000182544349 1430487667 /nfs/dbraw/zinc/48/76/67/1430487667.db2.gz FBFWKGWDODQERD-GFCCVEGCSA-N 0 0 381.392 3.454 20 5 GGBDRN O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000182551040 1430489881 /nfs/dbraw/zinc/48/98/81/1430489881.db2.gz MHRBEZBPUYLIIN-RDJZCZTQSA-N 0 0 386.795 3.385 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000182554491 1430490519 /nfs/dbraw/zinc/49/05/19/1430490519.db2.gz PCKRDLOPZVNDDR-UHFFFAOYSA-N 0 0 379.420 3.131 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c(C)c2)C1 ZINC000182568020 1430493957 /nfs/dbraw/zinc/49/39/57/1430493957.db2.gz UPSBBSDBEVJRLN-GFCCVEGCSA-N 0 0 387.367 3.043 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N(c2ccc(F)c(C)c2)C1 ZINC000182568036 1430494217 /nfs/dbraw/zinc/49/42/17/1430494217.db2.gz UPSBBSDBEVJRLN-LBPRGKRZSA-N 0 0 387.367 3.043 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)c([N+](=O)[O-])c1 ZINC000182568913 1430494404 /nfs/dbraw/zinc/49/44/04/1430494404.db2.gz ZWGDLZQIOVVERU-GFCCVEGCSA-N 0 0 387.367 3.043 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)c([N+](=O)[O-])c1 ZINC000182568931 1430494427 /nfs/dbraw/zinc/49/44/27/1430494427.db2.gz ZWGDLZQIOVVERU-LBPRGKRZSA-N 0 0 387.367 3.043 20 5 GGBDRN Cc1c(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cnn1-c1ccccc1F ZINC000182570411 1430494871 /nfs/dbraw/zinc/49/48/71/1430494871.db2.gz GKVSEPAISWVGBA-UHFFFAOYSA-N 0 0 384.323 3.209 20 5 GGBDRN O=C1NCCN(Cc2csc([N+](=O)[O-])c2)[C@@H]1c1ccccc1C(F)(F)F ZINC000182575564 1430496114 /nfs/dbraw/zinc/49/61/14/1430496114.db2.gz BLYXTVFQAUPYNJ-CQSZACIVSA-N 0 0 385.367 3.348 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 ZINC000182591087 1430498554 /nfs/dbraw/zinc/49/85/54/1430498554.db2.gz DYBVVDSMOANNSE-HNNXBMFYSA-N 0 0 397.431 3.151 20 5 GGBDRN COc1cccc(C(=O)N2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000182592308 1430499003 /nfs/dbraw/zinc/49/90/03/1430499003.db2.gz SIDXGIZFFQKICS-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN Cc1csc([C@H](C)CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000182605903 1430501154 /nfs/dbraw/zinc/50/11/54/1430501154.db2.gz NIAJJOFNDVSWQY-CYBMUJFWSA-N 0 0 388.493 3.496 20 5 GGBDRN Cn1cnnc1-c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000182607550 1430501588 /nfs/dbraw/zinc/50/15/88/1430501588.db2.gz QDEPZKDECDLEFN-UHFFFAOYSA-N 0 0 389.318 3.244 20 5 GGBDRN C[C@@H](C(=O)NC[C@H](C)N1CCc2sccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000182631686 1430505678 /nfs/dbraw/zinc/50/56/78/1430505678.db2.gz IWCJHYQOLQFOAB-QWHCGFSZSA-N 0 0 391.468 3.462 20 5 GGBDRN COCC(=O)N1CCc2c1cccc2NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000182650142 1430509955 /nfs/dbraw/zinc/50/99/55/1430509955.db2.gz BGCUACRUKASQNP-UHFFFAOYSA-N 0 0 389.795 3.036 20 5 GGBDRN Cc1nc(-c2ccc(NC(=O)COc3cccc([N+](=O)[O-])c3)cc2Cl)n[nH]1 ZINC000182688478 1430517511 /nfs/dbraw/zinc/51/75/11/1430517511.db2.gz ZKENFFXUSUWJOX-UHFFFAOYSA-N 0 0 387.783 3.359 20 5 GGBDRN COc1cccc(CC(=O)N2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000182694764 1430519482 /nfs/dbraw/zinc/51/94/82/1430519482.db2.gz QSVCOMPURLPJFA-QGZVFWFLSA-N 0 0 397.475 3.360 20 5 GGBDRN Cc1ccc([C@H](C)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000182697789 1430520378 /nfs/dbraw/zinc/52/03/78/1430520378.db2.gz UCHFIFKREOPMBB-INIZCTEOSA-N 0 0 398.463 3.347 20 5 GGBDRN Cc1c([C@@H](C)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cccc1[N+](=O)[O-] ZINC000182700453 1430520726 /nfs/dbraw/zinc/52/07/26/1430520726.db2.gz KGBHHHNRVSRBGQ-MRXNPFEDSA-N 0 0 398.463 3.347 20 5 GGBDRN Cc1ccccc1-n1nccc1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000182722395 1430527184 /nfs/dbraw/zinc/52/71/84/1430527184.db2.gz MAFTUCDNPYJRMT-UHFFFAOYSA-N 0 0 386.433 3.073 20 5 GGBDRN COc1ccc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c2cccnc12 ZINC000182729252 1430528556 /nfs/dbraw/zinc/52/85/56/1430528556.db2.gz LHJGTSHYPDXIII-UHFFFAOYSA-N 0 0 387.417 3.136 20 5 GGBDRN Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000182729653 1430528673 /nfs/dbraw/zinc/52/86/73/1430528673.db2.gz ZOYRUGXAAWYYJE-ZDUSSCGKSA-N 0 0 394.497 3.412 20 5 GGBDRN COc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1NS(C)(=O)=O ZINC000182730281 1430528784 /nfs/dbraw/zinc/52/87/84/1430528784.db2.gz YKKMCSFMIQFKKI-LBPRGKRZSA-N 0 0 379.438 3.456 20 5 GGBDRN CC[C@](C)(CCO)NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000182734571 1430529842 /nfs/dbraw/zinc/52/98/42/1430529842.db2.gz KYVGEDWYVBRCIO-OAHLLOKOSA-N 0 0 377.363 3.083 20 5 GGBDRN COC(=O)c1ccc(Cl)c(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)c1 ZINC000182745306 1430531819 /nfs/dbraw/zinc/53/18/19/1430531819.db2.gz QHMKATYINDJJQA-UHFFFAOYSA-N 0 0 399.790 3.307 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N1CCC(OC2CCCC2)CC1 ZINC000182759855 1430534774 /nfs/dbraw/zinc/53/47/74/1430534774.db2.gz WZRMZTFXJDIYFM-UHFFFAOYSA-N 0 0 386.445 3.155 20 5 GGBDRN COc1cc(NC(=O)CN2CCc3ccc([N+](=O)[O-])cc32)c(OC)cc1Cl ZINC000182759592 1430534850 /nfs/dbraw/zinc/53/48/50/1430534850.db2.gz LPMOJQDQJTVYNS-UHFFFAOYSA-N 0 0 391.811 3.267 20 5 GGBDRN Cc1cc(N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)nn1-c1cccc(F)c1 ZINC000182758418 1430534884 /nfs/dbraw/zinc/53/48/84/1430534884.db2.gz GVUGSWJWVCHGCW-GOSISDBHSA-N 0 0 395.394 3.445 20 5 GGBDRN Cc1cccnc1[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000182758982 1430534946 /nfs/dbraw/zinc/53/49/46/1430534946.db2.gz CPBKEUONGOIFLD-OAHLLOKOSA-N 0 0 390.827 3.404 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F ZINC000182774316 1430537301 /nfs/dbraw/zinc/53/73/01/1430537301.db2.gz CPEZLTWYJNQOHA-CQSZACIVSA-N 0 0 392.284 3.188 20 5 GGBDRN COc1cc(OC)c(NC(=O)CN2CCc3ccc([N+](=O)[O-])cc32)cc1Cl ZINC000182777457 1430538133 /nfs/dbraw/zinc/53/81/33/1430538133.db2.gz WKIGDWSMAIBUGH-UHFFFAOYSA-N 0 0 391.811 3.267 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)CN2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000182786109 1430539821 /nfs/dbraw/zinc/53/98/21/1430539821.db2.gz SRKWWSYYFIBDML-UHFFFAOYSA-N 0 0 396.447 3.078 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(CN3CCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000182800105 1430542167 /nfs/dbraw/zinc/54/21/67/1430542167.db2.gz AVMIFAGILDWTFG-UHFFFAOYSA-N 0 0 387.417 3.092 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCO[C@@H](Cc2ccccc2)C1 ZINC000182801375 1430542507 /nfs/dbraw/zinc/54/25/07/1430542507.db2.gz LXKDSJXGIRWDKA-HNNXBMFYSA-N 0 0 392.358 3.280 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000182803287 1430543070 /nfs/dbraw/zinc/54/30/70/1430543070.db2.gz PYLCHEZETKHTNY-IFXJQAMLSA-N 0 0 377.404 3.399 20 5 GGBDRN CN(C)c1cc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c2ccccc2n1 ZINC000182808625 1430544009 /nfs/dbraw/zinc/54/40/09/1430544009.db2.gz JPIGXXMEBCVJOZ-UHFFFAOYSA-N 0 0 376.376 3.338 20 5 GGBDRN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000182808050 1430544036 /nfs/dbraw/zinc/54/40/36/1430544036.db2.gz GYBYFIDFJHLZQR-LIRRHRJNSA-N 0 0 377.404 3.399 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000182824329 1430547627 /nfs/dbraw/zinc/54/76/27/1430547627.db2.gz UODWAIIKTCTTSZ-CYBMUJFWSA-N 0 0 387.411 3.294 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000182842109 1430551769 /nfs/dbraw/zinc/55/17/69/1430551769.db2.gz BIZHHQQWOBGPHT-VIFPVBQESA-N 0 0 379.775 3.489 20 5 GGBDRN CN(C)C(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000182849204 1430553160 /nfs/dbraw/zinc/55/31/60/1430553160.db2.gz MGJJJYOUWRHMDV-UHFFFAOYSA-N 0 0 379.482 3.085 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000182858853 1430555161 /nfs/dbraw/zinc/55/51/61/1430555161.db2.gz BVXHELJXFGAODU-WBMJQRKESA-N 0 0 397.859 3.287 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182861886 1430555986 /nfs/dbraw/zinc/55/59/86/1430555986.db2.gz JVMGQJRWHHRVPI-NSHDSACASA-N 0 0 386.305 3.427 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182861906 1430556000 /nfs/dbraw/zinc/55/60/00/1430556000.db2.gz JVMGQJRWHHRVPI-LLVKDONJSA-N 0 0 386.305 3.427 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182863868 1430556264 /nfs/dbraw/zinc/55/62/64/1430556264.db2.gz QMILGYHGMCZHCS-UHFFFAOYSA-N 0 0 391.811 3.346 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182866567 1430556579 /nfs/dbraw/zinc/55/65/79/1430556579.db2.gz TUIMSUZTHUNMMG-ZDUSSCGKSA-N 0 0 382.342 3.216 20 5 GGBDRN C[C@H](C(=O)N[C@H](C[S@](C)=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000182870591 1430557994 /nfs/dbraw/zinc/55/79/94/1430557994.db2.gz QBTRQJRSQFBUCN-LQRUBRGNSA-N 0 0 378.425 3.073 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)cn2)n1 ZINC000182877513 1430560013 /nfs/dbraw/zinc/56/00/13/1430560013.db2.gz XKLDBCKOCSBKSE-CQSZACIVSA-N 0 0 397.410 3.351 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)cc1[N+](=O)[O-] ZINC000182880486 1430560884 /nfs/dbraw/zinc/56/08/84/1430560884.db2.gz QQKWUKIHPKTVIP-LBPRGKRZSA-N 0 0 398.341 3.296 20 5 GGBDRN CN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)c1ccc(N2CCOCC2)nc1 ZINC000182890929 1430563411 /nfs/dbraw/zinc/56/34/11/1430563411.db2.gz AJHOKTMFLDZKHY-UHFFFAOYSA-N 0 0 398.463 3.401 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc(OCCn2cncn2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182898297 1430565644 /nfs/dbraw/zinc/56/56/44/1430565644.db2.gz PPARVBPPPARTJT-CYBMUJFWSA-N 0 0 399.382 3.147 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000182899038 1430566230 /nfs/dbraw/zinc/56/62/30/1430566230.db2.gz GGBYJPIRNDQKAS-CYBMUJFWSA-N 0 0 377.803 3.325 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000182905581 1430567921 /nfs/dbraw/zinc/56/79/21/1430567921.db2.gz GCGBBDKNJHXVBO-LBPRGKRZSA-N 0 0 393.802 3.161 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182912071 1430569170 /nfs/dbraw/zinc/56/91/70/1430569170.db2.gz UIRPQINLAIBSOR-GFCCVEGCSA-N 0 0 398.341 3.296 20 5 GGBDRN Cc1cc(NCc2ccnc(N3CCOCC3)c2)c2cccc([N+](=O)[O-])c2n1 ZINC000182917159 1430570541 /nfs/dbraw/zinc/57/05/41/1430570541.db2.gz SFIPVBMRFOHLSN-UHFFFAOYSA-N 0 0 379.420 3.295 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccc(F)cc1F ZINC000182924745 1430572976 /nfs/dbraw/zinc/57/29/76/1430572976.db2.gz VPWFBOBAQWJMPR-GFCCVEGCSA-N 0 0 391.374 3.201 20 5 GGBDRN O=C(Nc1cccc2cccnc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182924644 1430573191 /nfs/dbraw/zinc/57/31/91/1430573191.db2.gz VRGBVTXKIBGBJU-UHFFFAOYSA-N 0 0 378.388 3.232 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1 ZINC000182930890 1430574790 /nfs/dbraw/zinc/57/47/90/1430574790.db2.gz NFKYJCCWONVLGF-LLVKDONJSA-N 0 0 393.802 3.405 20 5 GGBDRN COc1cccc([C@H]2[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC(=O)N2C2CC2)c1 ZINC000182932601 1430574850 /nfs/dbraw/zinc/57/48/50/1430574850.db2.gz XKCRTAKDIWAFTD-QUCCMNQESA-N 0 0 395.415 3.294 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1 ZINC000182930910 1430574854 /nfs/dbraw/zinc/57/48/54/1430574854.db2.gz NFKYJCCWONVLGF-NSHDSACASA-N 0 0 393.802 3.405 20 5 GGBDRN COc1ccc(NC(=O)c2cn(-c3cccc(Cl)c3F)nn2)c([N+](=O)[O-])c1 ZINC000182932360 1430574920 /nfs/dbraw/zinc/57/49/20/1430574920.db2.gz NOONWINLLLBAPC-UHFFFAOYSA-N 0 0 391.746 3.229 20 5 GGBDRN COc1cccc([C@@H]2[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC(=O)N2C2CC2)c1 ZINC000182933643 1430575250 /nfs/dbraw/zinc/57/52/50/1430575250.db2.gz BYGNCILVFCXSJU-UYAOXDASSA-N 0 0 395.415 3.294 20 5 GGBDRN CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccc(OC)cc1 ZINC000182936212 1430575578 /nfs/dbraw/zinc/57/55/78/1430575578.db2.gz GTKCLLRUMCTLDF-SFHVURJKSA-N 0 0 399.447 3.321 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000182936583 1430576076 /nfs/dbraw/zinc/57/60/76/1430576076.db2.gz ZKAQMXHXHZHNEK-UHFFFAOYSA-N 0 0 390.321 3.470 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccccc1[N+](=O)[O-] ZINC000182954527 1430580046 /nfs/dbraw/zinc/58/00/46/1430580046.db2.gz AYZZGLCPWKIMLU-CQSZACIVSA-N 0 0 394.214 3.437 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000182962047 1430581313 /nfs/dbraw/zinc/58/13/13/1430581313.db2.gz GBEAVQGANISLNK-UHFFFAOYSA-N 0 0 390.321 3.470 20 5 GGBDRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCCC[C@@H]1C ZINC000182968246 1430582689 /nfs/dbraw/zinc/58/26/89/1430582689.db2.gz LEXMLAHHIMTWAV-NWDGAFQWSA-N 0 0 399.900 3.246 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCCC[C@H]1C ZINC000182968267 1430582725 /nfs/dbraw/zinc/58/27/25/1430582725.db2.gz LEXMLAHHIMTWAV-NEPJUHHUSA-N 0 0 399.900 3.246 20 5 GGBDRN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000182970672 1430582938 /nfs/dbraw/zinc/58/29/38/1430582938.db2.gz ILGAAIGKVPPLNH-NHYWBVRUSA-N 0 0 388.811 3.191 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000182970652 1430583082 /nfs/dbraw/zinc/58/30/82/1430583082.db2.gz ILGAAIGKVPPLNH-ABAIWWIYSA-N 0 0 388.811 3.191 20 5 GGBDRN O=C(c1cn(-c2cccc(Cl)c2F)nn1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000182974497 1430583690 /nfs/dbraw/zinc/58/36/90/1430583690.db2.gz WBYIFOLGRXFMQW-UHFFFAOYSA-N 0 0 387.758 3.171 20 5 GGBDRN Cc1c([C@@H](C)Nc2ccc(CC(=O)N3CCOCC3)cc2)cccc1[N+](=O)[O-] ZINC000182983481 1430585279 /nfs/dbraw/zinc/58/52/79/1430585279.db2.gz FCGCMKKJZKQQKJ-MRXNPFEDSA-N 0 0 383.448 3.478 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000182985308 1430585462 /nfs/dbraw/zinc/58/54/62/1430585462.db2.gz FYGQKURUIZOKFS-ZDUSSCGKSA-N 0 0 378.347 3.466 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1CN1CCOCC1)c1ccc([N+](=O)[O-])cc1F ZINC000182985024 1430585492 /nfs/dbraw/zinc/58/54/92/1430585492.db2.gz DZHOUQCJNJBGGC-AWEZNQCLSA-N 0 0 387.411 3.308 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2NC1=O ZINC000182993080 1430587451 /nfs/dbraw/zinc/58/74/51/1430587451.db2.gz LHASSHDTOXSFAZ-JTQLQIEISA-N 0 0 391.330 3.431 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1Cl ZINC000183000590 1430589245 /nfs/dbraw/zinc/58/92/45/1430589245.db2.gz UHIPZWOVMMFPTL-SECBINFHSA-N 0 0 379.775 3.489 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CCC(c2ccccc2)CC1 ZINC000183012027 1430592316 /nfs/dbraw/zinc/59/23/16/1430592316.db2.gz AYTVQMWJAMIWTI-UHFFFAOYSA-N 0 0 395.459 3.451 20 5 GGBDRN CNC(=O)[C@@H](C)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000183019925 1430594008 /nfs/dbraw/zinc/59/40/08/1430594008.db2.gz NARKUADLRACPFZ-ZDUSSCGKSA-N 0 0 393.509 3.331 20 5 GGBDRN CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c2cc(F)ccc21 ZINC000183045500 1430599172 /nfs/dbraw/zinc/59/91/72/1430599172.db2.gz RECIRDLLQXGQAB-UHFFFAOYSA-N 0 0 381.310 3.432 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)ccc1[N+](=O)[O-] ZINC000183055935 1430601326 /nfs/dbraw/zinc/60/13/26/1430601326.db2.gz KTRXSTYARQTMPV-HNNXBMFYSA-N 0 0 399.447 3.298 20 5 GGBDRN CC[C@H](C)Oc1cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccn1 ZINC000183074436 1430606220 /nfs/dbraw/zinc/60/62/20/1430606220.db2.gz KXCXQJGYIZHTAE-HNNXBMFYSA-N 0 0 384.436 3.130 20 5 GGBDRN Cc1cc([C@H](C)NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)s1 ZINC000183074596 1430606506 /nfs/dbraw/zinc/60/65/06/1430606506.db2.gz SHXRKSCWPVZACN-LBPRGKRZSA-N 0 0 375.450 3.189 20 5 GGBDRN Cn1cnc(-c2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc2)n1 ZINC000183109757 1430616342 /nfs/dbraw/zinc/61/63/42/1430616342.db2.gz SQCDVEPRJAOHKI-UHFFFAOYSA-N 0 0 389.318 3.244 20 5 GGBDRN CCN(C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@@H](C)c1cccc(OC)c1 ZINC000183110917 1430616670 /nfs/dbraw/zinc/61/66/70/1430616670.db2.gz GBLFZCQQHHOYOY-HNNXBMFYSA-N 0 0 399.447 3.251 20 5 GGBDRN O=C(NCc1ccccc1N1CCCCC1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000183134659 1430624845 /nfs/dbraw/zinc/62/48/45/1430624845.db2.gz AXTZPPAZSLJHHE-UHFFFAOYSA-N 0 0 383.404 3.244 20 5 GGBDRN C[S@@](=O)C[C@@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000183139880 1430626988 /nfs/dbraw/zinc/62/69/88/1430626988.db2.gz LWMQDZKUDWWXTG-DNOBIOAJSA-N 0 0 385.445 3.459 20 5 GGBDRN C[S@@](=O)C[C@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000183139842 1430627076 /nfs/dbraw/zinc/62/70/76/1430627076.db2.gz LWMQDZKUDWWXTG-XRHLQHRESA-N 0 0 385.445 3.459 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CCCc2ccc(F)cc21 ZINC000183144210 1430628093 /nfs/dbraw/zinc/62/80/93/1430628093.db2.gz ISTATLFKXXYWAD-UHFFFAOYSA-N 0 0 385.395 3.164 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CC1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183154879 1430631123 /nfs/dbraw/zinc/63/11/23/1430631123.db2.gz CHPJVSJJMOCVIY-UHFFFAOYSA-N 0 0 399.422 3.032 20 5 GGBDRN COc1ccc(OC)c(CCNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000183155921 1430631870 /nfs/dbraw/zinc/63/18/70/1430631870.db2.gz FVXCRMXVYFAEML-GFCCVEGCSA-N 0 0 376.384 3.214 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC[C@@H]2CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000183165711 1430635921 /nfs/dbraw/zinc/63/59/21/1430635921.db2.gz KNYRBVGALKHUJK-LJQANCHMSA-N 0 0 395.459 3.257 20 5 GGBDRN C[C@H]1CCCN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccccc21 ZINC000183191578 1430643433 /nfs/dbraw/zinc/64/34/33/1430643433.db2.gz OWTNISQZWDMZDR-ZDUSSCGKSA-N 0 0 381.388 3.433 20 5 GGBDRN COc1ccc([C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000183213713 1430649480 /nfs/dbraw/zinc/64/94/80/1430649480.db2.gz MUNSQZFQPWPFDH-MRXNPFEDSA-N 0 0 383.326 3.435 20 5 GGBDRN C[C@@H](C(=O)NCc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183240495 1430657682 /nfs/dbraw/zinc/65/76/82/1430657682.db2.gz OJXVQSFCKXENQA-GFCCVEGCSA-N 0 0 386.358 3.479 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1cccs1 ZINC000183243036 1430658184 /nfs/dbraw/zinc/65/81/84/1430658184.db2.gz UWAJDSNUSOJEAL-LLVKDONJSA-N 0 0 398.437 3.222 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cccc(COC(C)C)c2)ccc1[N+](=O)[O-] ZINC000183263881 1430663611 /nfs/dbraw/zinc/66/36/11/1430663611.db2.gz HTRLBFXSLHBBJD-UHFFFAOYSA-N 0 0 385.420 3.197 20 5 GGBDRN COc1ccccc1CN(Cc1cccs1)C(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183321145 1430678574 /nfs/dbraw/zinc/67/85/74/1430678574.db2.gz BBWMXPBSTAUJBV-UHFFFAOYSA-N 0 0 398.444 3.485 20 5 GGBDRN Cc1cc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)nn1-c1cccc(Cl)c1 ZINC000183324189 1430679478 /nfs/dbraw/zinc/67/94/78/1430679478.db2.gz KJXVHPQBFGLQRS-UHFFFAOYSA-N 0 0 388.815 3.276 20 5 GGBDRN Cc1nc(CN(C)C(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)no1 ZINC000183336521 1430682248 /nfs/dbraw/zinc/68/22/48/1430682248.db2.gz QZOJWVFXSSOBPI-CHWSQXEVSA-N 0 0 387.440 3.041 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccn(-c3ccc(F)cc3C)n2)cc([N+](=O)[O-])c1 ZINC000183337180 1430682294 /nfs/dbraw/zinc/68/22/94/1430682294.db2.gz ZUTSYXDMMLOPNZ-UHFFFAOYSA-N 0 0 398.350 3.267 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(-c2ncn(C)n2)cc1 ZINC000183344904 1430683987 /nfs/dbraw/zinc/68/39/87/1430683987.db2.gz RPFUDCHDBKXBAP-UHFFFAOYSA-N 0 0 379.420 3.441 20 5 GGBDRN COC(=O)CN(CCc1ccccc1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000183355965 1430687446 /nfs/dbraw/zinc/68/74/46/1430687446.db2.gz VIDPTNVAINVQLC-UHFFFAOYSA-N 0 0 397.431 3.027 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCC2(c3ccc(F)cc3)CCC2)ccc1[N+](=O)[O-] ZINC000183362933 1430689836 /nfs/dbraw/zinc/68/98/36/1430689836.db2.gz TWTUBXSUTGFKSA-UHFFFAOYSA-N 0 0 399.422 3.010 20 5 GGBDRN Cc1noc(-c2ccccc2)c1NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000183382980 1430696702 /nfs/dbraw/zinc/69/67/02/1430696702.db2.gz ZOBQVTJOSVRPDH-ZDUSSCGKSA-N 0 0 394.387 3.315 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@H](Oc4cccc(F)c4)C3)n2)c1 ZINC000183387057 1430697652 /nfs/dbraw/zinc/69/76/52/1430697652.db2.gz LNMODCIDAQZMGE-KRWDZBQOSA-N 0 0 384.367 3.437 20 5 GGBDRN Cn1c2ccc(NS(=O)(=O)Cc3ccccc3[N+](=O)[O-])cc2nc1C1CC1 ZINC000183386625 1430697791 /nfs/dbraw/zinc/69/77/91/1430697791.db2.gz XQMOHZJOMCHVQT-UHFFFAOYSA-N 0 0 386.433 3.301 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC[C@H](c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000183389492 1430698194 /nfs/dbraw/zinc/69/81/94/1430698194.db2.gz BDXCQOPBYWCMMV-SFHVURJKSA-N 0 0 395.459 3.429 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183393849 1430699817 /nfs/dbraw/zinc/69/98/17/1430699817.db2.gz FHXNCYZKJAVXDK-SFHVURJKSA-N 0 0 397.431 3.005 20 5 GGBDRN Cc1ccccc1CC(C)(C)NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183398244 1430701151 /nfs/dbraw/zinc/70/11/51/1430701151.db2.gz FBZBIEZPCZOAEA-UHFFFAOYSA-N 0 0 383.448 3.079 20 5 GGBDRN CCOc1cccc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000183397493 1430701368 /nfs/dbraw/zinc/70/13/68/1430701368.db2.gz QKFJQFGXIVERAT-OAHLLOKOSA-N 0 0 399.447 3.321 20 5 GGBDRN O=C(N[C@@H]1CCCOc2ccccc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183414494 1430705425 /nfs/dbraw/zinc/70/54/25/1430705425.db2.gz RMIHSFPZTKCMLJ-QGZVFWFLSA-N 0 0 397.431 3.075 20 5 GGBDRN Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183422528 1430707726 /nfs/dbraw/zinc/70/77/26/1430707726.db2.gz BODSHRIZAVIFGW-UHFFFAOYSA-N 0 0 397.435 3.195 20 5 GGBDRN Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183427418 1430709085 /nfs/dbraw/zinc/70/90/85/1430709085.db2.gz HPCMPQPANJJRLG-UHFFFAOYSA-N 0 0 397.435 3.005 20 5 GGBDRN CN(C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cnc2N)cc1)C1CCCCC1 ZINC000183438214 1430712255 /nfs/dbraw/zinc/71/22/55/1430712255.db2.gz FDMBBRWVLVDCTQ-UHFFFAOYSA-N 0 0 397.435 3.229 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183461639 1430717555 /nfs/dbraw/zinc/71/75/55/1430717555.db2.gz PMYRMDXTTZEQFK-LBPRGKRZSA-N 0 0 397.435 3.005 20 5 GGBDRN CN(C)c1ccc(COC(=O)c2csc([C@H]3CCCO3)n2)cc1[N+](=O)[O-] ZINC000183469539 1430719628 /nfs/dbraw/zinc/71/96/28/1430719628.db2.gz UNEMIERBOYBKTQ-OAHLLOKOSA-N 0 0 377.422 3.326 20 5 GGBDRN CN(C)c1ccc(COC(=O)CCc2nnc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000183472135 1430719929 /nfs/dbraw/zinc/71/99/29/1430719929.db2.gz NKFRYWKXNARFQX-UHFFFAOYSA-N 0 0 396.403 3.387 20 5 GGBDRN CC(C)Oc1ccc(CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000183472174 1430719968 /nfs/dbraw/zinc/71/99/68/1430719968.db2.gz OYRBTPSOMXOIOY-UHFFFAOYSA-N 0 0 378.450 3.044 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCC2(Sc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000183474886 1430720887 /nfs/dbraw/zinc/72/08/87/1430720887.db2.gz UFORMIZQXUEWTI-UHFFFAOYSA-N 0 0 399.472 3.074 20 5 GGBDRN COc1cc(F)c([C@H](C)NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000183479147 1430722367 /nfs/dbraw/zinc/72/23/67/1430722367.db2.gz XFSLHLMZVAIMKB-LBPRGKRZSA-N 0 0 391.399 3.349 20 5 GGBDRN CC(C)(C)[C@@H]1CCc2nc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)sc2C1 ZINC000183481079 1430723119 /nfs/dbraw/zinc/72/31/19/1430723119.db2.gz RGFGOVBGJGGIMJ-LLVKDONJSA-N 0 0 390.465 3.003 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCSc3c(F)cccc32)cc1 ZINC000183491908 1430726476 /nfs/dbraw/zinc/72/64/76/1430726476.db2.gz AKJAEFXIXVBYCS-INIZCTEOSA-N 0 0 396.465 3.433 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1nc(C)cs1 ZINC000183510997 1430731564 /nfs/dbraw/zinc/73/15/64/1430731564.db2.gz ZNNYVENDVLIEHE-CQSZACIVSA-N 0 0 390.465 3.077 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cc(OCC(F)F)ccn1 ZINC000183519016 1430733559 /nfs/dbraw/zinc/73/35/59/1430733559.db2.gz AKLOFKMPENKFAM-UHFFFAOYSA-N 0 0 389.318 3.276 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N(Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC000183524403 1430734578 /nfs/dbraw/zinc/73/45/78/1430734578.db2.gz WFMLQEVSHRYZNC-UHFFFAOYSA-N 0 0 382.420 3.092 20 5 GGBDRN O=C(NC1CC1)c1ccc(CN(C(=O)Nc2ccncc2[N+](=O)[O-])C2CC2)cc1 ZINC000183547271 1430739745 /nfs/dbraw/zinc/73/97/45/1430739745.db2.gz NKSJEMCNGGJSSM-UHFFFAOYSA-N 0 0 395.419 3.079 20 5 GGBDRN O=C(CCCNC(=O)Nc1ccncc1[N+](=O)[O-])Nc1ccc(Cl)cc1 ZINC000183549680 1430740002 /nfs/dbraw/zinc/74/00/02/1430740002.db2.gz DXTPRWAVNRNMIL-UHFFFAOYSA-N 0 0 377.788 3.184 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000183560014 1430742004 /nfs/dbraw/zinc/74/20/04/1430742004.db2.gz HTPRGIUKGHOZGI-DZGCQCFKSA-N 0 0 380.763 3.434 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1NC(=O)C[C@@H]1C=CCC1 ZINC000183564521 1430742912 /nfs/dbraw/zinc/74/29/12/1430742912.db2.gz SYXWBZXBNATZLE-GFCCVEGCSA-N 0 0 381.392 3.119 20 5 GGBDRN CCS[C@H]1CCCCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000183563647 1430742921 /nfs/dbraw/zinc/74/29/21/1430742921.db2.gz HDXARHUFEDHBDF-HNNXBMFYSA-N 0 0 393.509 3.179 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N(C)[C@@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000183574237 1430744544 /nfs/dbraw/zinc/74/45/44/1430744544.db2.gz JDPHDNHFWACLTE-HXUWFJFHSA-N 0 0 399.447 3.189 20 5 GGBDRN C[C@@H](C(=O)NCC(=O)Nc1cccc2cccnc21)c1ccc([N+](=O)[O-])cc1F ZINC000183582126 1430746689 /nfs/dbraw/zinc/74/66/89/1430746689.db2.gz HMBZCCJRGKKTHJ-GFCCVEGCSA-N 0 0 396.378 3.141 20 5 GGBDRN C[C@H](C(=O)NCCNC(=O)CC1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000183584870 1430747760 /nfs/dbraw/zinc/74/77/60/1430747760.db2.gz QRLIKHVVPBOJLP-ZDUSSCGKSA-N 0 0 379.432 3.040 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000183600261 1430751168 /nfs/dbraw/zinc/75/11/68/1430751168.db2.gz SVQAAEBBUMJOOQ-JTQLQIEISA-N 0 0 379.779 3.183 20 5 GGBDRN COc1cc(C)c([C@H](C)NC(=O)CN2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000183623511 1430757233 /nfs/dbraw/zinc/75/72/33/1430757233.db2.gz PQTNRKJMBNMZRF-AWEZNQCLSA-N 0 0 399.447 3.160 20 5 GGBDRN COc1cc(OC)c(NC(=O)CN2CCc3c2cccc3[N+](=O)[O-])cc1Cl ZINC000183625478 1430757574 /nfs/dbraw/zinc/75/75/74/1430757574.db2.gz XQYNUJROQCVYDO-UHFFFAOYSA-N 0 0 391.811 3.267 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)CN2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000183625056 1430757619 /nfs/dbraw/zinc/75/76/19/1430757619.db2.gz BLFFORJRBQCVOF-CQSZACIVSA-N 0 0 399.447 3.242 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCN(c2ccc(F)cc2Cl)CC1 ZINC000183625326 1430757663 /nfs/dbraw/zinc/75/76/63/1430757663.db2.gz SBYBXMQTPQHLPO-UHFFFAOYSA-N 0 0 379.779 3.136 20 5 GGBDRN COc1ccc(-c2noc(CN3CCc4c3cccc4[N+](=O)[O-])n2)c(OC)c1 ZINC000183628369 1430757871 /nfs/dbraw/zinc/75/78/71/1430757871.db2.gz MVJNNODKRSBKOD-UHFFFAOYSA-N 0 0 382.376 3.225 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCN(Cc2ccccc2)CC1 ZINC000183626747 1430758087 /nfs/dbraw/zinc/75/80/87/1430758087.db2.gz VHDBVCBLVNSNJA-UHFFFAOYSA-N 0 0 391.374 3.154 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(CN3CCc4c3cccc4[N+](=O)[O-])nc2c1 ZINC000183627373 1430758101 /nfs/dbraw/zinc/75/81/01/1430758101.db2.gz BCNHYFNAGZQBQN-UHFFFAOYSA-N 0 0 387.417 3.092 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN1CCc2c1cccc2[N+](=O)[O-] ZINC000183628990 1430758555 /nfs/dbraw/zinc/75/85/55/1430758555.db2.gz VNCIYUHNOHQTJR-UHFFFAOYSA-N 0 0 399.447 3.023 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000183643936 1430761999 /nfs/dbraw/zinc/76/19/99/1430761999.db2.gz QLDBPYUCVMILRL-WMLDXEAASA-N 0 0 399.422 3.177 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000183644911 1430762616 /nfs/dbraw/zinc/76/26/16/1430762616.db2.gz BMWVODYINGPVRF-FUHWJXTLSA-N 0 0 395.459 3.346 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC000183672213 1430768744 /nfs/dbraw/zinc/76/87/44/1430768744.db2.gz YTMFSFKXTAQFSF-KRWDZBQOSA-N 0 0 392.452 3.171 20 5 GGBDRN O=C(c1scnc1C1CCCC1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000183677830 1430769961 /nfs/dbraw/zinc/76/99/61/1430769961.db2.gz BXUHNEJOULGPDB-CYBMUJFWSA-N 0 0 387.465 3.431 20 5 GGBDRN Cc1cc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)ccc1OC(C)C ZINC000183677920 1430770141 /nfs/dbraw/zinc/77/01/41/1430770141.db2.gz AEDIGTVPINEVKU-UHFFFAOYSA-N 0 0 385.420 3.367 20 5 GGBDRN O=C(c1scnc1C1CCCC1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000183677848 1430770313 /nfs/dbraw/zinc/77/03/13/1430770313.db2.gz BXUHNEJOULGPDB-ZDUSSCGKSA-N 0 0 387.465 3.431 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccccc2CC(F)(F)F)ccc1[N+](=O)[O-] ZINC000183688109 1430773067 /nfs/dbraw/zinc/77/30/67/1430773067.db2.gz KNIMEULFLULSDP-UHFFFAOYSA-N 0 0 395.337 3.377 20 5 GGBDRN C[C@@H](C(=O)N(C)CC(=O)Nc1cc(F)cc(F)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183689650 1430773925 /nfs/dbraw/zinc/77/39/25/1430773925.db2.gz YOGUCHGXPKNEKN-SNVBAGLBSA-N 0 0 395.337 3.213 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@@H](C)C[C@@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000183691081 1430774297 /nfs/dbraw/zinc/77/42/97/1430774297.db2.gz MAPLVRHYFCYKND-ORAYPTAESA-N 0 0 399.422 3.382 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@@H](C)C[C@@H]2c2ccccc2F)ccc1[N+](=O)[O-] ZINC000183695549 1430775056 /nfs/dbraw/zinc/77/50/56/1430775056.db2.gz GVCPVIYIZNBAPL-ORAYPTAESA-N 0 0 399.422 3.382 20 5 GGBDRN O=C1CC[C@H]2CN(S(=O)(=O)CCc3ccc([N+](=O)[O-])cc3)c3cccc1c32 ZINC000183703023 1430777377 /nfs/dbraw/zinc/77/73/77/1430777377.db2.gz YTAPGJVGGKVGAC-AWEZNQCLSA-N 0 0 386.429 3.047 20 5 GGBDRN O=C1CC[C@@H]2CN(S(=O)(=O)CCc3ccc([N+](=O)[O-])cc3)c3cccc1c32 ZINC000183703043 1430777433 /nfs/dbraw/zinc/77/74/33/1430777433.db2.gz YTAPGJVGGKVGAC-CQSZACIVSA-N 0 0 386.429 3.047 20 5 GGBDRN COc1ccc2ccccc2c1CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000183750289 1430786951 /nfs/dbraw/zinc/78/69/51/1430786951.db2.gz CRZNWEYJFDNQAA-UHFFFAOYSA-N 0 0 387.417 3.016 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1N1CCOCC1 ZINC000183759819 1430788183 /nfs/dbraw/zinc/78/81/83/1430788183.db2.gz FVKVFDBUEYVBQQ-UHFFFAOYSA-N 0 0 375.812 3.015 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)c(C)c1 ZINC000183814792 1430800154 /nfs/dbraw/zinc/80/01/54/1430800154.db2.gz RFUOGGLWJHDOJX-HNNXBMFYSA-N 0 0 380.759 3.340 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)c(C)c1 ZINC000183816233 1430800313 /nfs/dbraw/zinc/80/03/13/1430800313.db2.gz IOQJYOCLRHLLFQ-APPDUMDISA-N 0 0 392.358 3.315 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)c(C)c1 ZINC000183816219 1430800418 /nfs/dbraw/zinc/80/04/18/1430800418.db2.gz IOQJYOCLRHLLFQ-GTNSWQLSSA-N 0 0 392.358 3.315 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCN([C@H](C)c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000183836672 1430802988 /nfs/dbraw/zinc/80/29/88/1430802988.db2.gz QIRBBVBGBNHBQA-CQSZACIVSA-N 0 0 395.506 3.032 20 5 GGBDRN CC[C@@H]1Cc2ccccc2CN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000183837030 1430803059 /nfs/dbraw/zinc/80/30/59/1430803059.db2.gz QXCKCXYMODRHMN-MRXNPFEDSA-N 0 0 399.472 3.149 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCN([C@H](C)c2ccsc2)CC1 ZINC000183840746 1430803484 /nfs/dbraw/zinc/80/34/84/1430803484.db2.gz JLWKQVQKAUIIJW-CQSZACIVSA-N 0 0 395.506 3.032 20 5 GGBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000183839641 1430803523 /nfs/dbraw/zinc/80/35/23/1430803523.db2.gz RAHPDPGWQYBXJO-UHFFFAOYSA-N 0 0 394.366 3.416 20 5 GGBDRN COc1cc(COc2nc(Cc3ccc(F)cc3)no2)c([N+](=O)[O-])cc1F ZINC000183857278 1430805750 /nfs/dbraw/zinc/80/57/50/1430805750.db2.gz MOGLLZCLXQVNPE-UHFFFAOYSA-N 0 0 377.303 3.434 20 5 GGBDRN C[C@H](C(=O)Nc1cc(C2CC2)nn1-c1ncccn1)c1ccc([N+](=O)[O-])cc1F ZINC000183864645 1430806193 /nfs/dbraw/zinc/80/61/93/1430806193.db2.gz HIUQJJQGPWFPQE-NSHDSACASA-N 0 0 396.382 3.329 20 5 GGBDRN COc1cc(CN2C(=O)N[C@](C)(CCC=C(C)C)C2=O)c([N+](=O)[O-])cc1F ZINC000183865904 1430806450 /nfs/dbraw/zinc/80/64/50/1430806450.db2.gz DGWXHRNSIHHNJG-GOSISDBHSA-N 0 0 379.388 3.299 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 ZINC000183872222 1430807228 /nfs/dbraw/zinc/80/72/28/1430807228.db2.gz CHBYCELVHIPMNE-UHFFFAOYSA-N 0 0 389.433 3.287 20 5 GGBDRN C[C@@H](C(=O)NCCc1nc2ccc(F)cc2n1C)c1ccc([N+](=O)[O-])cc1F ZINC000183872513 1430807260 /nfs/dbraw/zinc/80/72/60/1430807260.db2.gz XBKIHEIESRNANA-LLVKDONJSA-N 0 0 388.374 3.222 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000183876597 1430807789 /nfs/dbraw/zinc/80/77/89/1430807789.db2.gz FSJBENCESDEYOC-YJBOKZPZSA-N 0 0 381.432 3.038 20 5 GGBDRN CCN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCN(c2ccccc2)C1=O ZINC000183886238 1430808764 /nfs/dbraw/zinc/80/87/64/1430808764.db2.gz LPYVIQSLCQXMPG-KUHUBIRLSA-N 0 0 399.422 3.491 20 5 GGBDRN CCN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCN(c2ccccc2)C1=O ZINC000183886216 1430808933 /nfs/dbraw/zinc/80/89/33/1430808933.db2.gz LPYVIQSLCQXMPG-AUUYWEPGSA-N 0 0 399.422 3.491 20 5 GGBDRN O=C(Nc1ccnn1-c1cccc(F)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000183895863 1430810041 /nfs/dbraw/zinc/81/00/41/1430810041.db2.gz SKZIHTMIULJHQG-UHFFFAOYSA-N 0 0 392.350 3.358 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000183911067 1430812250 /nfs/dbraw/zinc/81/22/50/1430812250.db2.gz JKMUIJRCSKZOQO-UHFFFAOYSA-N 0 0 375.469 3.404 20 5 GGBDRN CCC[C@H]1CCCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000183910749 1430812339 /nfs/dbraw/zinc/81/23/39/1430812339.db2.gz VIBMSFKJQHGLQH-HNNXBMFYSA-N 0 0 384.436 3.244 20 5 GGBDRN CCCOc1cc(F)ccc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183914945 1430812759 /nfs/dbraw/zinc/81/27/59/1430812759.db2.gz HLBWBKNBNAKCKI-UHFFFAOYSA-N 0 0 389.383 3.200 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1 ZINC000183925505 1430814121 /nfs/dbraw/zinc/81/41/21/1430814121.db2.gz CPXQGPHHNPJFEJ-UHFFFAOYSA-N 0 0 375.469 3.404 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1 ZINC000183925651 1430814228 /nfs/dbraw/zinc/81/42/28/1430814228.db2.gz NNRSFKBIWWPUNK-UHFFFAOYSA-N 0 0 399.794 3.452 20 5 GGBDRN CC[C@@H](CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-])Oc1ccccc1Cl ZINC000183939622 1430815479 /nfs/dbraw/zinc/81/54/79/1430815479.db2.gz DTTSEKWEWVDHBC-NSHDSACASA-N 0 0 399.856 3.165 20 5 GGBDRN Nc1ccnc(CNC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)n1 ZINC000183940792 1430815846 /nfs/dbraw/zinc/81/58/46/1430815846.db2.gz LNSMOHKQQLKDLP-UHFFFAOYSA-N 0 0 387.465 3.179 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000183942834 1430816123 /nfs/dbraw/zinc/81/61/23/1430816123.db2.gz KTZKQLBWZHPPKF-UHFFFAOYSA-N 0 0 391.468 3.104 20 5 GGBDRN CC(C)c1ccnc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000183948061 1430817017 /nfs/dbraw/zinc/81/70/17/1430817017.db2.gz PPIRDWUOYCIRHG-UHFFFAOYSA-N 0 0 389.843 3.124 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC[C@@H]2[C@@H]2CCCCC2=O)c1C ZINC000183957415 1430818479 /nfs/dbraw/zinc/81/84/79/1430818479.db2.gz QLFHTTISHRLXAM-LSDHHAIUSA-N 0 0 380.466 3.124 20 5 GGBDRN CCOc1ccc(NC(=O)CN(C)C[C@@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000183960654 1430819128 /nfs/dbraw/zinc/81/91/28/1430819128.db2.gz JTMHQOPRNXFNPQ-GFCCVEGCSA-N 0 0 378.454 3.124 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccccc1CN1CCNC1=O)c1cccc([N+](=O)[O-])c1 ZINC000183962451 1430819330 /nfs/dbraw/zinc/81/93/30/1430819330.db2.gz DOMMJZHKJVKJAF-CYBMUJFWSA-N 0 0 383.408 3.003 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccc(C(F)F)cc2)CC1 ZINC000183969661 1430820508 /nfs/dbraw/zinc/82/05/08/1430820508.db2.gz RAHPIQGADYOGDN-UHFFFAOYSA-N 0 0 375.375 3.490 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cc(C3CCCCC3)nn2C)ccc1[N+](=O)[O-] ZINC000183969058 1430820517 /nfs/dbraw/zinc/82/05/17/1430820517.db2.gz LDJAZHCJNZNYNQ-UHFFFAOYSA-N 0 0 399.451 3.053 20 5 GGBDRN C[C@]1(Cc2ccccc2)CCCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000184009755 1430828429 /nfs/dbraw/zinc/82/84/29/1430828429.db2.gz YSPGLBXHZNLPBM-OAQYLSRUSA-N 0 0 391.431 3.413 20 5 GGBDRN C[C@@H](C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184016685 1430829514 /nfs/dbraw/zinc/82/95/14/1430829514.db2.gz MVBUSDDAERVLFF-KUHUBIRLSA-N 0 0 399.422 3.491 20 5 GGBDRN CCOc1ccc(C(=O)N(C)C)cc1NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184017657 1430829575 /nfs/dbraw/zinc/82/95/75/1430829575.db2.gz IBLVRGGYTLCRFW-UHFFFAOYSA-N 0 0 391.399 3.455 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184022948 1430830442 /nfs/dbraw/zinc/83/04/42/1430830442.db2.gz VUZAWMWEUGFDOE-LLVKDONJSA-N 0 0 399.353 3.344 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000184029924 1430831595 /nfs/dbraw/zinc/83/15/95/1430831595.db2.gz KILIOYYDDGFQID-DYEKYZERSA-N 0 0 389.481 3.429 20 5 GGBDRN Cn1nc(C2CCCC2)cc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000184032788 1430831798 /nfs/dbraw/zinc/83/17/98/1430831798.db2.gz VDTVQAWHJDPNFX-UHFFFAOYSA-N 0 0 381.392 3.080 20 5 GGBDRN CCc1nnnn1-c1ccccc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184032454 1430831836 /nfs/dbraw/zinc/83/18/36/1430831836.db2.gz XESKFWRHAAGCLO-NSHDSACASA-N 0 0 384.371 3.014 20 5 GGBDRN COc1ccc([C@@H](CO)N(C)C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000184046562 1430833905 /nfs/dbraw/zinc/83/39/05/1430833905.db2.gz MYXBBKDYXBBDEU-KZULUSFZSA-N 0 0 376.384 3.038 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCOC[C@H]1[C@H]1CCCCC1=O ZINC000184059456 1430835804 /nfs/dbraw/zinc/83/58/04/1430835804.db2.gz VZAAMEUTHPGPDK-CABCVRRESA-N 0 0 388.445 3.410 20 5 GGBDRN Cc1oc2ccccc2c1CNC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000184060429 1430836080 /nfs/dbraw/zinc/83/60/80/1430836080.db2.gz XTRYYZOVQHEDLZ-GFCCVEGCSA-N 0 0 381.388 3.084 20 5 GGBDRN COCCn1c2ccccc2nc1NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000184063483 1430836668 /nfs/dbraw/zinc/83/66/68/1430836668.db2.gz ZZOUJLHZEKIVFQ-UHFFFAOYSA-N 0 0 391.387 3.391 20 5 GGBDRN COCCn1c(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)nc2ccccc21 ZINC000184084167 1430839042 /nfs/dbraw/zinc/83/90/42/1430839042.db2.gz UVIGBZDPAFTCEI-UHFFFAOYSA-N 0 0 393.403 3.253 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCc1ccc(C(F)(F)F)cc1 ZINC000184112843 1430842792 /nfs/dbraw/zinc/84/27/92/1430842792.db2.gz NHEQETHIBDTXPY-UHFFFAOYSA-N 0 0 388.367 3.276 20 5 GGBDRN CCOc1cccc(N[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1[N+](=O)[O-] ZINC000184117797 1430843727 /nfs/dbraw/zinc/84/37/27/1430843727.db2.gz YTGQABANTDBSHF-KRWDZBQOSA-N 0 0 385.420 3.215 20 5 GGBDRN COc1ccc(NC(=O)CN[C@@H](COCC(C)C)c2ccco2)c([N+](=O)[O-])c1 ZINC000184149606 1430847534 /nfs/dbraw/zinc/84/75/34/1430847534.db2.gz HLYZRWFEDRKNCM-INIZCTEOSA-N 0 0 391.424 3.138 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccc(OC(F)(F)F)cc1 ZINC000184149127 1430847606 /nfs/dbraw/zinc/84/76/06/1430847606.db2.gz GOAGGHNDIFVLTG-UHFFFAOYSA-N 0 0 390.339 3.113 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCCCOc1ccc(F)cc1 ZINC000184150919 1430847763 /nfs/dbraw/zinc/84/77/63/1430847763.db2.gz MEMFVUOWUAKMQA-UHFFFAOYSA-N 0 0 382.413 3.013 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000184175578 1430851128 /nfs/dbraw/zinc/85/11/28/1430851128.db2.gz QLBSFEBHCOTYCH-UHFFFAOYSA-N 0 0 381.432 3.211 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](COCC(C)C)c1ccco1 ZINC000184185765 1430853079 /nfs/dbraw/zinc/85/30/79/1430853079.db2.gz IHHHKFQCQXCPKZ-KRWDZBQOSA-N 0 0 375.425 3.438 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)n2C ZINC000184192543 1430854186 /nfs/dbraw/zinc/85/41/86/1430854186.db2.gz IKAQQTWJEYSPHS-LLVKDONJSA-N 0 0 386.383 3.049 20 5 GGBDRN COc1cc(CN2CCC[C@@H](CNC(=O)C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184214628 1430857251 /nfs/dbraw/zinc/85/72/51/1430857251.db2.gz PLQHZRKHTZAEMF-ZDUSSCGKSA-N 0 0 381.448 3.117 20 5 GGBDRN C[C@H](C(=O)Nc1nc(-c2cnn(C)c2)cs1)c1ccc([N+](=O)[O-])cc1F ZINC000184220591 1430858302 /nfs/dbraw/zinc/85/83/02/1430858302.db2.gz OOOZAJZRVVFELG-VIFPVBQESA-N 0 0 375.385 3.333 20 5 GGBDRN COc1cc(CN(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c([N+](=O)[O-])cc1F ZINC000184222105 1430858315 /nfs/dbraw/zinc/85/83/15/1430858315.db2.gz UXFOURAPKFIZRY-GFCCVEGCSA-N 0 0 396.440 3.339 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(Cc1ccc(F)cc1F)C1CC1 ZINC000184229801 1430859561 /nfs/dbraw/zinc/85/95/61/1430859561.db2.gz XWHGFEWKPKKVBJ-UHFFFAOYSA-N 0 0 382.388 3.367 20 5 GGBDRN COc1cc(CN2CCC(NC(=O)c3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000184231561 1430859848 /nfs/dbraw/zinc/85/98/48/1430859848.db2.gz VDGLDGZZNFLVQW-UHFFFAOYSA-N 0 0 387.411 3.137 20 5 GGBDRN COc1cc(CN2CCOC[C@H]2C[C@H](O)c2cccs2)c([N+](=O)[O-])cc1F ZINC000184233920 1430860078 /nfs/dbraw/zinc/86/00/78/1430860078.db2.gz VARJWFWOGZLEHD-CJNGLKHVSA-N 0 0 396.440 3.129 20 5 GGBDRN COc1cc(CN2CCOC[C@@H]2C[C@H](O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184237166 1430860571 /nfs/dbraw/zinc/86/05/71/1430860571.db2.gz GBBGUXMODPQECF-LPHOPBHVSA-N 0 0 390.411 3.067 20 5 GGBDRN CCN(Cc1cc(OC)c(F)cc1[N+](=O)[O-])Cc1nc2ccccc2c(=O)[nH]1 ZINC000184238126 1430860765 /nfs/dbraw/zinc/86/07/65/1430860765.db2.gz BYFYUWWNWCURDN-UHFFFAOYSA-N 0 0 386.383 3.001 20 5 GGBDRN COc1cc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)c([N+](=O)[O-])cc1F ZINC000184240713 1430861069 /nfs/dbraw/zinc/86/10/69/1430861069.db2.gz LCLHVWFTIWYNGI-UHFFFAOYSA-N 0 0 387.411 3.009 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000184241385 1430861074 /nfs/dbraw/zinc/86/10/74/1430861074.db2.gz NJVKXOJDFDBLNI-MRXNPFEDSA-N 0 0 396.852 3.319 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000184240241 1430861141 /nfs/dbraw/zinc/86/11/41/1430861141.db2.gz YBHJHJWPRIMPNC-MRXNPFEDSA-N 0 0 396.852 3.319 20 5 GGBDRN CCCCCNC(=O)C1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184244075 1430861613 /nfs/dbraw/zinc/86/16/13/1430861613.db2.gz DQBHVDURICSLEI-UHFFFAOYSA-N 0 0 381.448 3.261 20 5 GGBDRN COc1cc(CN2CCCN(C(=O)c3ccsc3)CC2)c([N+](=O)[O-])cc1F ZINC000184250062 1430862375 /nfs/dbraw/zinc/86/23/75/1430862375.db2.gz SYBNGPSNJVRCGM-UHFFFAOYSA-N 0 0 393.440 3.152 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 ZINC000184252900 1430862694 /nfs/dbraw/zinc/86/26/94/1430862694.db2.gz QHAXLXYSBAUDFY-UHFFFAOYSA-N 0 0 391.449 3.232 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184258507 1430863458 /nfs/dbraw/zinc/86/34/58/1430863458.db2.gz UOTUOPPMVMHFNF-KBPBESRZSA-N 0 0 381.448 3.259 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2NC(=O)c2cc([N+](=O)[O-])ccc2N)C[C@H](C)O1 ZINC000184279436 1430866905 /nfs/dbraw/zinc/86/69/05/1430866905.db2.gz PTRXLKGEBZHWQP-KBPBESRZSA-N 0 0 384.436 3.039 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)c2cc([N+](=O)[O-])ccc2N)C[C@@H](C)O1 ZINC000184279453 1430866999 /nfs/dbraw/zinc/86/69/99/1430866999.db2.gz PTRXLKGEBZHWQP-ZIAGYGMSSA-N 0 0 384.436 3.039 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)cc21 ZINC000184286269 1430868159 /nfs/dbraw/zinc/86/81/59/1430868159.db2.gz NJFJYIMRKZEFJB-LBPRGKRZSA-N 0 0 398.394 3.177 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)cc21 ZINC000184286287 1430868162 /nfs/dbraw/zinc/86/81/62/1430868162.db2.gz NJFJYIMRKZEFJB-GFCCVEGCSA-N 0 0 398.394 3.177 20 5 GGBDRN Cc1ccccc1C(NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccccc1C ZINC000184288430 1430868815 /nfs/dbraw/zinc/86/88/15/1430868815.db2.gz QOVLDQPSWLLFGI-UHFFFAOYSA-N 0 0 391.427 3.279 20 5 GGBDRN COc1cc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c([N+](=O)[O-])cc1F ZINC000184290902 1430868926 /nfs/dbraw/zinc/86/89/26/1430868926.db2.gz ZRIKXMNTVUJLDL-GFCCVEGCSA-N 0 0 375.404 3.118 20 5 GGBDRN C[C@H](C(=O)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184306643 1430871246 /nfs/dbraw/zinc/87/12/46/1430871246.db2.gz XTRVLQBKYLXDOH-LXIYXOSZSA-N 0 0 385.395 3.148 20 5 GGBDRN C[C@H](C(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184306624 1430871280 /nfs/dbraw/zinc/87/12/80/1430871280.db2.gz XTRVLQBKYLXDOH-VBHSOAQHSA-N 0 0 385.395 3.148 20 5 GGBDRN COc1ccc(O[C@H](C)CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000184312712 1430872033 /nfs/dbraw/zinc/87/20/33/1430872033.db2.gz FLDGARJXLQBTJR-CHWSQXEVSA-N 0 0 376.384 3.430 20 5 GGBDRN COc1ccc(O[C@H](C)CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000184312673 1430872054 /nfs/dbraw/zinc/87/20/54/1430872054.db2.gz FLDGARJXLQBTJR-OLZOCXBDSA-N 0 0 376.384 3.430 20 5 GGBDRN CCOC(=O)[C@H](Cc1cccc2ccccc21)NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000184332842 1430874161 /nfs/dbraw/zinc/87/41/61/1430874161.db2.gz VZRSLHPQBLWOGP-INIZCTEOSA-N 0 0 382.372 3.245 20 5 GGBDRN CCOC(=O)[C@@H](Cc1cccc2ccccc21)NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000184332824 1430874198 /nfs/dbraw/zinc/87/41/98/1430874198.db2.gz VZRSLHPQBLWOGP-MRXNPFEDSA-N 0 0 382.372 3.245 20 5 GGBDRN COc1ccccc1CN(C[C@H]1CCCO1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000184342249 1430875223 /nfs/dbraw/zinc/87/52/23/1430875223.db2.gz YQXHSSZBPMIPMF-MRXNPFEDSA-N 0 0 385.420 3.007 20 5 GGBDRN CSc1c(F)cc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000184346068 1430875986 /nfs/dbraw/zinc/87/59/86/1430875986.db2.gz AFGYTEDBLBFJOV-VIFPVBQESA-N 0 0 395.387 3.411 20 5 GGBDRN COc1cc(CNc2ccc(C)c(-c3nnnn3C3CC3)c2)c([N+](=O)[O-])cc1O ZINC000184353730 1430876968 /nfs/dbraw/zinc/87/69/68/1430876968.db2.gz GHBDEQBKCKNPAH-UHFFFAOYSA-N 0 0 396.407 3.218 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCCO2)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184356464 1430877462 /nfs/dbraw/zinc/87/74/62/1430877462.db2.gz VXCYFVBIGMKMPE-UHFFFAOYSA-N 0 0 377.784 3.019 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NCc1ccccc1Cn1cccn1 ZINC000184359692 1430878089 /nfs/dbraw/zinc/87/80/89/1430878089.db2.gz LVWINPNZLQONAA-UHFFFAOYSA-N 0 0 399.838 3.492 20 5 GGBDRN Cc1nc2ccccc2n1CCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184362723 1430878364 /nfs/dbraw/zinc/87/83/64/1430878364.db2.gz RVXIBZCBYSTLRY-UHFFFAOYSA-N 0 0 387.827 3.406 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000184370371 1430879395 /nfs/dbraw/zinc/87/93/95/1430879395.db2.gz JVRPLUKXAYGOAA-LBPRGKRZSA-N 0 0 382.388 3.360 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)ccc1[N+](=O)[O-] ZINC000184370460 1430879627 /nfs/dbraw/zinc/87/96/27/1430879627.db2.gz TZKLUMXMRFYMCF-LBPRGKRZSA-N 0 0 382.388 3.360 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000184371801 1430879870 /nfs/dbraw/zinc/87/98/70/1430879870.db2.gz BKNCWFNXSWBPGK-LBPRGKRZSA-N 0 0 382.388 3.360 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)ccc1[N+](=O)[O-] ZINC000184374710 1430880284 /nfs/dbraw/zinc/88/02/84/1430880284.db2.gz PPRUAXAFPXHKIW-NSHDSACASA-N 0 0 398.387 3.060 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1 ZINC000184377376 1430880615 /nfs/dbraw/zinc/88/06/15/1430880615.db2.gz PHQQETRDVYRQAS-CQSZACIVSA-N 0 0 396.415 3.235 20 5 GGBDRN Cc1nn(-c2ccccc2)c2sc(C(=O)Nc3c([N+](=O)[O-])cnn3C)cc12 ZINC000184395172 1430882743 /nfs/dbraw/zinc/88/27/43/1430882743.db2.gz RWRRQSOTWNMCGR-UHFFFAOYSA-N 0 0 382.405 3.289 20 5 GGBDRN CCOc1ccc(-c2nc(CC(=O)Nc3c([N+](=O)[O-])cnn3C)cs2)cc1 ZINC000184399720 1430883066 /nfs/dbraw/zinc/88/30/66/1430883066.db2.gz BMKNQDMVWSGWRJ-UHFFFAOYSA-N 0 0 387.421 3.032 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O ZINC000184401219 1430883471 /nfs/dbraw/zinc/88/34/71/1430883471.db2.gz LYWGKXVJCPYVAC-KRWDZBQOSA-N 0 0 392.371 3.035 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184404745 1430884011 /nfs/dbraw/zinc/88/40/11/1430884011.db2.gz PZANQUHLSQVBKK-QGZVFWFLSA-N 0 0 376.434 3.270 20 5 GGBDRN COc1ccc(C2(NS(=O)(=O)Cc3ccccc3[N+](=O)[O-])CCCC2)cc1 ZINC000184406664 1430884261 /nfs/dbraw/zinc/88/42/61/1430884261.db2.gz XSURYGCDUGNCEI-UHFFFAOYSA-N 0 0 390.461 3.492 20 5 GGBDRN COc1cc(CCNC(=O)N2CCc3c2cccc3F)c([N+](=O)[O-])cc1OC ZINC000184417715 1430885662 /nfs/dbraw/zinc/88/56/62/1430885662.db2.gz WBOYIVIGKWTRMF-UHFFFAOYSA-N 0 0 389.383 3.066 20 5 GGBDRN COCCNC(=O)c1ccc(Cl)c(NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000184433906 1430887347 /nfs/dbraw/zinc/88/73/47/1430887347.db2.gz YHNGGEUKNBVLSX-UHFFFAOYSA-N 0 0 377.828 3.279 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184456889 1430890004 /nfs/dbraw/zinc/89/00/04/1430890004.db2.gz QMUNUXCVYOTOGL-CYBMUJFWSA-N 0 0 397.859 3.240 20 5 GGBDRN COCCOc1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000184459397 1430890111 /nfs/dbraw/zinc/89/01/11/1430890111.db2.gz PBQKDHXJICYQDB-UHFFFAOYSA-N 0 0 393.827 3.273 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCCc1nc(C2CCCCC2)cs1 ZINC000184462440 1430890511 /nfs/dbraw/zinc/89/05/11/1430890511.db2.gz USRMFZXVLRLYFU-UHFFFAOYSA-N 0 0 375.454 3.049 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000184467471 1430890834 /nfs/dbraw/zinc/89/08/34/1430890834.db2.gz MVDQQVRSIUZZDZ-CQSZACIVSA-N 0 0 388.424 3.199 20 5 GGBDRN CC(C)c1ccnc(N2CCN(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000184476028 1430892259 /nfs/dbraw/zinc/89/22/59/1430892259.db2.gz NGAUWLSHTQZYFE-HNNXBMFYSA-N 0 0 398.467 3.101 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1cccc(CS(C)(=O)=O)c1 ZINC000184478681 1430892298 /nfs/dbraw/zinc/89/22/98/1430892298.db2.gz MAQOZIHOAXNQIN-UHFFFAOYSA-N 0 0 391.449 3.078 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NCc1ccccc1-n1ccnc1 ZINC000184483469 1430893008 /nfs/dbraw/zinc/89/30/08/1430893008.db2.gz DJZRMHHVGLRPMP-UHFFFAOYSA-N 0 0 385.811 3.433 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000184503227 1430895731 /nfs/dbraw/zinc/89/57/31/1430895731.db2.gz MBSOQTNJHYGIKS-UHFFFAOYSA-N 0 0 390.461 3.276 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C)Cc1ccc(F)c(F)c1 ZINC000184507212 1430896354 /nfs/dbraw/zinc/89/63/54/1430896354.db2.gz LWBLFNHJXLDPAS-UHFFFAOYSA-N 0 0 377.347 3.087 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 ZINC000184512407 1430896790 /nfs/dbraw/zinc/89/67/90/1430896790.db2.gz BAQJIBYFPLUSDY-PKOBYXMFSA-N 0 0 397.431 3.187 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184515373 1430897288 /nfs/dbraw/zinc/89/72/88/1430897288.db2.gz QYHNVGAKXFEBKX-SJKOYZFVSA-N 0 0 398.868 3.444 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184515335 1430897325 /nfs/dbraw/zinc/89/73/25/1430897325.db2.gz QYHNVGAKXFEBKX-PXAZEXFGSA-N 0 0 398.868 3.444 20 5 GGBDRN COC(=O)CN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1cccc(F)c1 ZINC000184518080 1430897498 /nfs/dbraw/zinc/89/74/98/1430897498.db2.gz FGTOBCUABLIYRX-LLVKDONJSA-N 0 0 378.331 3.183 20 5 GGBDRN COC(=O)CN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1cccc(F)c1 ZINC000184518061 1430897637 /nfs/dbraw/zinc/89/76/37/1430897637.db2.gz FGTOBCUABLIYRX-NSHDSACASA-N 0 0 378.331 3.183 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000184530351 1430899226 /nfs/dbraw/zinc/89/92/26/1430899226.db2.gz YKXILVJVIOESPF-SJKOYZFVSA-N 0 0 382.420 3.155 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(Cc1cccc(O)c1)CC1CC1 ZINC000184543254 1430901659 /nfs/dbraw/zinc/90/16/59/1430901659.db2.gz VNNOOWUDPCHTGP-UHFFFAOYSA-N 0 0 376.434 3.042 20 5 GGBDRN COc1ccc(C(=O)Nc2ccccc2-c2nnnn2C(C)C)cc1[N+](=O)[O-] ZINC000184558186 1430904292 /nfs/dbraw/zinc/90/42/92/1430904292.db2.gz GBLNHQWNEMFRPD-UHFFFAOYSA-N 0 0 382.380 3.090 20 5 GGBDRN C[C@@H](C(=O)N(C)Cc1ccc([S@@](C)=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000184559370 1430904476 /nfs/dbraw/zinc/90/44/76/1430904476.db2.gz DNSLCCPEJYTBDQ-MZHQLVBMSA-N 0 0 378.425 3.233 20 5 GGBDRN C[C@@H](C(=O)N(C)Cc1ccc([S@](C)=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000184559332 1430904501 /nfs/dbraw/zinc/90/45/01/1430904501.db2.gz DNSLCCPEJYTBDQ-RYZVSIALSA-N 0 0 378.425 3.233 20 5 GGBDRN COc1ccc(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000184562153 1430905432 /nfs/dbraw/zinc/90/54/32/1430905432.db2.gz UNOOWGKDEZFCMB-UHFFFAOYSA-N 0 0 381.791 3.438 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184566733 1430906523 /nfs/dbraw/zinc/90/65/23/1430906523.db2.gz XYZZMPYWLCZDNT-NSHDSACASA-N 0 0 389.383 3.187 20 5 GGBDRN O=C(CCNC(=O)c1cc2ccccc2c2cccnc12)NCc1ccccn1 ZINC000184567472 1430906546 /nfs/dbraw/zinc/90/65/46/1430906546.db2.gz MKBBUWOBYVWIJQ-UHFFFAOYSA-N 0 0 384.439 3.219 20 5 GGBDRN Cc1ccccc1Cc1nc2ccccc2n1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000184572561 1430907229 /nfs/dbraw/zinc/90/72/29/1430907229.db2.gz SVDLOVABEMMGMQ-SFHVURJKSA-N 0 0 391.431 3.101 20 5 GGBDRN CC(=O)c1ccc(N2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)c(F)c1 ZINC000184582382 1430909415 /nfs/dbraw/zinc/90/94/15/1430909415.db2.gz OPTYHKGKADQESC-UHFFFAOYSA-N 0 0 385.395 3.207 20 5 GGBDRN Cc1c(CC(=O)Nc2ccccc2-c2nnnn2C(C)C)cccc1[N+](=O)[O-] ZINC000184592204 1430912801 /nfs/dbraw/zinc/91/28/01/1430912801.db2.gz PYEOHLWAQGWQGQ-UHFFFAOYSA-N 0 0 380.408 3.319 20 5 GGBDRN Cc1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc1-c1nnnn1C1CC1 ZINC000184596369 1430914001 /nfs/dbraw/zinc/91/40/01/1430914001.db2.gz NFMWAIRYJPVZBU-UHFFFAOYSA-N 0 0 378.392 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ZINC000184996215 1431038264 /nfs/dbraw/zinc/03/82/64/1431038264.db2.gz BIVPOMVBARJCGE-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C1=O ZINC000185009120 1431041093 /nfs/dbraw/zinc/04/10/93/1431041093.db2.gz DHQJBNFJSKJWBT-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)COc1c(F)cccc1[N+](=O)[O-] ZINC000185013866 1431042092 /nfs/dbraw/zinc/04/20/92/1431042092.db2.gz UXLNYDGCGPEHBL-UHFFFAOYSA-N 0 0 384.310 3.373 20 5 GGBDRN COCc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cnn1-c1ccccc1 ZINC000185013630 1431042433 /nfs/dbraw/zinc/04/24/33/1431042433.db2.gz UIPQWNNCJJEHIX-UHFFFAOYSA-N 0 0 382.376 3.188 20 5 GGBDRN C[C@H](OCCCNC(=O)COc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000185016431 1431042642 /nfs/dbraw/zinc/04/26/42/1431042642.db2.gz BRRLDNMIADQBAI-AWEZNQCLSA-N 0 0 376.384 3.397 20 5 GGBDRN Cc1cc(NC(=O)COc2c(F)cccc2[N+](=O)[O-])n(-c2ccc(F)cc2)n1 ZINC000185021605 1431043361 /nfs/dbraw/zinc/04/33/61/1431043361.db2.gz QRQOOVPFOXZZKY-UHFFFAOYSA-N 0 0 388.330 3.385 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCN1CCCCCC1=O ZINC000185025768 1431044118 /nfs/dbraw/zinc/04/41/18/1431044118.db2.gz YBJUMEKKZVLLIS-KRWDZBQOSA-N 0 0 375.469 3.072 20 5 GGBDRN Cc1nc(N2CCOCC2)ccc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185028781 1431044805 /nfs/dbraw/zinc/04/48/05/1431044805.db2.gz LSBZFYMALOCBOM-GFCCVEGCSA-N 0 0 388.399 3.016 20 5 GGBDRN C[C@@H](C(=O)NC(C)(C)C(=O)NCC1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000185032636 1431045123 /nfs/dbraw/zinc/04/51/23/1431045123.db2.gz CLFCGDFSSPIWBV-CYBMUJFWSA-N 0 0 393.459 3.429 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000185033492 1431045611 /nfs/dbraw/zinc/04/56/11/1431045611.db2.gz IUBOBKBRCQJNGJ-LLVKDONJSA-N 0 0 395.412 3.238 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000185036242 1431046275 /nfs/dbraw/zinc/04/62/75/1431046275.db2.gz SXYJGMNWTSQSDW-AWEZNQCLSA-N 0 0 393.459 3.335 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000185036124 1431046392 /nfs/dbraw/zinc/04/63/92/1431046392.db2.gz RMDMFISUOIEVDC-ZDUSSCGKSA-N 0 0 393.459 3.381 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000185044079 1431047888 /nfs/dbraw/zinc/04/78/88/1431047888.db2.gz RVVNPSBWGGBAHW-UHFFFAOYSA-N 0 0 395.415 3.302 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@H]1C(=O)Nc2ccccc21 ZINC000185044264 1431048124 /nfs/dbraw/zinc/04/81/24/1431048124.db2.gz GBBRABCXPOXSMI-MAUKXSAKSA-N 0 0 381.432 3.406 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@H]1C(=O)Nc2ccccc21 ZINC000185044284 1431048178 /nfs/dbraw/zinc/04/81/78/1431048178.db2.gz GBBRABCXPOXSMI-CRAIPNDOSA-N 0 0 381.432 3.406 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OC ZINC000185046424 1431048676 /nfs/dbraw/zinc/04/86/76/1431048676.db2.gz ZNBKXHFTJPFGQI-UZLBHIALSA-N 0 0 396.443 3.290 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc(C)c(C(=O)OC)s1 ZINC000185048499 1431049171 /nfs/dbraw/zinc/04/91/71/1431049171.db2.gz JCDGRURGJCOSQW-GFCCVEGCSA-N 0 0 377.422 3.354 20 5 GGBDRN Cc1c(=O)[nH]c(SCc2ccc(C(N)=O)cc2[N+](=O)[O-])nc1-c1ccccc1 ZINC000185051440 1431049411 /nfs/dbraw/zinc/04/94/11/1431049411.db2.gz KMLKRPCPTWIUBN-UHFFFAOYSA-N 0 0 396.428 3.045 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1ccc(C(=O)NC)cc1 ZINC000185053971 1431050310 /nfs/dbraw/zinc/05/03/10/1431050310.db2.gz BGASSTFQNGWISN-QGZVFWFLSA-N 0 0 383.448 3.182 20 5 GGBDRN C[C@@H](C(=O)NCc1cccc(Cn2cccn2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000185060757 1431051809 /nfs/dbraw/zinc/05/18/09/1431051809.db2.gz RERPVRLWYFYOSN-CQSZACIVSA-N 0 0 382.395 3.399 20 5 GGBDRN COc1cc2c(cc1CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)O[C@H](C)C2 ZINC000185076933 1431054784 /nfs/dbraw/zinc/05/47/84/1431054784.db2.gz PREIAHPWSNRPDQ-VXGBXAGGSA-N 0 0 388.395 3.486 20 5 GGBDRN CSCc1ccccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000185076731 1431054805 /nfs/dbraw/zinc/05/48/05/1431054805.db2.gz CQSSTLQYTRAIQE-UHFFFAOYSA-N 0 0 393.852 3.480 20 5 GGBDRN C[C@@H](C(=O)NCCN1CCc2sccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000185081754 1431056100 /nfs/dbraw/zinc/05/61/00/1431056100.db2.gz LUOMCWQEIPCFLK-GFCCVEGCSA-N 0 0 377.441 3.073 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCc2c1cccc2-c1ccccc1 ZINC000185087710 1431057531 /nfs/dbraw/zinc/05/75/31/1431057531.db2.gz FVCFYDHONVFWLJ-UHFFFAOYSA-N 0 0 377.404 3.231 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000185097092 1431059895 /nfs/dbraw/zinc/05/98/95/1431059895.db2.gz PSZSACFFDTVZBF-CQSZACIVSA-N 0 0 376.434 3.206 20 5 GGBDRN COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000185097550 1431060215 /nfs/dbraw/zinc/06/02/15/1431060215.db2.gz GDKIOJIIQUGVQV-NSHDSACASA-N 0 0 382.376 3.075 20 5 GGBDRN C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000185098226 1431060631 /nfs/dbraw/zinc/06/06/31/1431060631.db2.gz UVKBQYDKXDERLC-GFCCVEGCSA-N 0 0 399.382 3.463 20 5 GGBDRN COc1cccc(NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c1[N+](=O)[O-] ZINC000185098545 1431060759 /nfs/dbraw/zinc/06/07/59/1431060759.db2.gz NPCFJYFYVSMGTD-KRWDZBQOSA-N 0 0 375.400 3.228 20 5 GGBDRN COc1ccccc1C1(CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000185103350 1431061700 /nfs/dbraw/zinc/06/17/00/1431061700.db2.gz OIYSYJNOQZOUQQ-UHFFFAOYSA-N 0 0 390.461 3.145 20 5 GGBDRN COCc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cnn1-c1ccccc1 ZINC000185107406 1431062199 /nfs/dbraw/zinc/06/21/99/1431062199.db2.gz MYCCLHIPYPOERF-UHFFFAOYSA-N 0 0 378.388 3.130 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000185116127 1431064304 /nfs/dbraw/zinc/06/43/04/1431064304.db2.gz OEHGILWHZWKRID-UHFFFAOYSA-N 0 0 390.827 3.201 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c(Cl)c1 ZINC000185126596 1431067193 /nfs/dbraw/zinc/06/71/93/1431067193.db2.gz NKHSRCRVECQVIH-SECBINFHSA-N 0 0 379.775 3.489 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NCCOc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000185127941 1431067665 /nfs/dbraw/zinc/06/76/65/1431067665.db2.gz SIFFIJKUUWTQHY-CYBMUJFWSA-N 0 0 384.392 3.383 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1C ZINC000185140402 1431070851 /nfs/dbraw/zinc/07/08/51/1431070851.db2.gz KAXNYFCZKSJRBM-IBGZPJMESA-N 0 0 388.445 3.032 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000185144142 1431071592 /nfs/dbraw/zinc/07/15/92/1431071592.db2.gz KXNHXHPKJRKMQT-LJQANCHMSA-N 0 0 388.445 3.032 20 5 GGBDRN Cc1ccc2c(c1)c(=O)n(C)c1nnc(CSc3ccc([N+](=O)[O-])cc3F)n12 ZINC000185147359 1431072555 /nfs/dbraw/zinc/07/25/55/1431072555.db2.gz PQLVKISBWDPZQD-UHFFFAOYSA-N 0 0 399.407 3.229 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)C(=O)CSc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000185159237 1431074449 /nfs/dbraw/zinc/07/44/49/1431074449.db2.gz QSOYBYMDRPSXOI-UHFFFAOYSA-N 0 0 391.424 3.232 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)N1N=C(c2ccco2)C[C@@H]1c1ccco1 ZINC000185166365 1431076347 /nfs/dbraw/zinc/07/63/47/1431076347.db2.gz SQMCWJRNYGJDKX-CQSZACIVSA-N 0 0 395.375 3.233 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCC1(CCOCc2ccccc2)CC1 ZINC000185185565 1431079738 /nfs/dbraw/zinc/07/97/38/1431079738.db2.gz IXNDAKWOWNTOKE-UHFFFAOYSA-N 0 0 390.461 3.260 20 5 GGBDRN CCNC(=O)COc1ccc(NC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000185194230 1431081861 /nfs/dbraw/zinc/08/18/61/1431081861.db2.gz PDXSYOZHWTVGRH-INIZCTEOSA-N 0 0 399.447 3.317 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C)c(-n2cnnn2)c1 ZINC000185197847 1431082632 /nfs/dbraw/zinc/08/26/32/1431082632.db2.gz MQRLWEJSPOUOPB-OAHLLOKOSA-N 0 0 380.408 3.086 20 5 GGBDRN CN(C)C(=O)c1cc(F)ccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000185201016 1431083512 /nfs/dbraw/zinc/08/35/12/1431083512.db2.gz NCDFGGRHZQLMLS-UHFFFAOYSA-N 0 0 385.355 3.098 20 5 GGBDRN Cc1cc(C)cc([C@@H]2CCN(C(=O)[C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000185203673 1431084041 /nfs/dbraw/zinc/08/40/41/1431084041.db2.gz CNMGSZMDIUWTOE-SJLPKXTDSA-N 0 0 395.459 3.346 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@H](C)c1nc(C(C)(C)C)no1 ZINC000185204752 1431084542 /nfs/dbraw/zinc/08/45/42/1431084542.db2.gz ZBUGIDJBEILGJA-GFCCVEGCSA-N 0 0 375.429 3.263 20 5 GGBDRN C[C@H](C(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185206200 1431084643 /nfs/dbraw/zinc/08/46/43/1431084643.db2.gz FZKGAHXRZPZSLG-HOCLYGCPSA-N 0 0 399.422 3.002 20 5 GGBDRN COCc1c(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1 ZINC000185215543 1431087157 /nfs/dbraw/zinc/08/71/57/1431087157.db2.gz ATBKSBCDRCPJCH-AWEZNQCLSA-N 0 0 380.404 3.418 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000185216672 1431087260 /nfs/dbraw/zinc/08/72/60/1431087260.db2.gz STMWZZOKWPOAAI-INIZCTEOSA-N 0 0 399.447 3.317 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000185222551 1431088548 /nfs/dbraw/zinc/08/85/48/1431088548.db2.gz IWFZEUJLQPMRLL-STQMWFEESA-N 0 0 380.322 3.441 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000185229394 1431089690 /nfs/dbraw/zinc/08/96/90/1431089690.db2.gz RQFUSSHPJKWXEV-QGZVFWFLSA-N 0 0 383.448 3.230 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nncn1-c1ccccc1 ZINC000185229076 1431089803 /nfs/dbraw/zinc/08/98/03/1431089803.db2.gz HZJZDMGIOJTPDK-MRXNPFEDSA-N 0 0 379.420 3.061 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(-n2cncn2)cc1 ZINC000185234539 1431091007 /nfs/dbraw/zinc/09/10/07/1431091007.db2.gz OKVXLJTUOLWHMK-QGZVFWFLSA-N 0 0 379.420 3.061 20 5 GGBDRN C[C@H](C(=O)NCCCC(=O)N1Cc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000185237645 1431091325 /nfs/dbraw/zinc/09/13/25/1431091325.db2.gz TWZPKZMNUVBDEN-AWEZNQCLSA-N 0 0 399.422 3.276 20 5 GGBDRN COc1cccc(NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1[N+](=O)[O-] ZINC000185253803 1431094386 /nfs/dbraw/zinc/09/43/86/1431094386.db2.gz IBHGSKJHROZCPG-KRWDZBQOSA-N 0 0 375.400 3.228 20 5 GGBDRN COc1cccc(NC[C@H](c2cccc(F)c2)N2CCOCC2)c1[N+](=O)[O-] ZINC000185253818 1431094415 /nfs/dbraw/zinc/09/44/15/1431094415.db2.gz IBHGSKJHROZCPG-QGZVFWFLSA-N 0 0 375.400 3.228 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1 ZINC000185260232 1431095950 /nfs/dbraw/zinc/09/59/50/1431095950.db2.gz XVUKYEADYUKSOF-HUUCEWRRSA-N 0 0 387.402 3.164 20 5 GGBDRN COCCNc1ccccc1CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185286536 1431099946 /nfs/dbraw/zinc/09/99/46/1431099946.db2.gz MNEAKNXRDHQDNJ-ZDUSSCGKSA-N 0 0 375.400 3.212 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn(Cc2ccccn2)c1 ZINC000185304920 1431106942 /nfs/dbraw/zinc/10/69/42/1431106942.db2.gz FDZHIFVKPRUKDR-MRXNPFEDSA-N 0 0 379.420 3.442 20 5 GGBDRN O=C(CN1CC[C@H](c2c(F)cccc2F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000185314715 1431110361 /nfs/dbraw/zinc/11/03/61/1431110361.db2.gz FFYIVGFQKVKWCP-AWEZNQCLSA-N 0 0 387.386 3.252 20 5 GGBDRN CCc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2)cnn1-c1ccc(OC)cc1 ZINC000185320672 1431112926 /nfs/dbraw/zinc/11/29/26/1431112926.db2.gz AFWRQFWASLJOFA-UHFFFAOYSA-N 0 0 380.404 3.282 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCOCC2)cn1 ZINC000185322825 1431114009 /nfs/dbraw/zinc/11/40/09/1431114009.db2.gz IRGQJSGCLGZDMV-MRXNPFEDSA-N 0 0 384.436 3.034 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1ccc(NC(C)=O)cc1 ZINC000185331295 1431117019 /nfs/dbraw/zinc/11/70/19/1431117019.db2.gz WQIXFDMLLYJRNH-GOSISDBHSA-N 0 0 383.448 3.481 20 5 GGBDRN NC(=O)CCCNC(=O)c1cccc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000185332762 1431117332 /nfs/dbraw/zinc/11/73/32/1431117332.db2.gz GYYMMIHMWVKAKA-UHFFFAOYSA-N 0 0 393.852 3.395 20 5 GGBDRN COc1cccc(N2CCC(c3nc(-c4ccccn4)no3)CC2)c1[N+](=O)[O-] ZINC000185334828 1431117828 /nfs/dbraw/zinc/11/78/28/1431117828.db2.gz CQYKZNLITGMBJG-UHFFFAOYSA-N 0 0 381.392 3.432 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])c1 ZINC000185359067 1431125736 /nfs/dbraw/zinc/12/57/36/1431125736.db2.gz NMBTXUUTAUMZBG-KRWDZBQOSA-N 0 0 390.465 3.438 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N[C@@H](c1ncc(C)s1)C1CC1 ZINC000185371603 1431128699 /nfs/dbraw/zinc/12/86/99/1431128699.db2.gz NKIHNJNFHORUMO-BDJLRTHQSA-N 0 0 390.465 3.436 20 5 GGBDRN COCC1=CCN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000185376732 1431129480 /nfs/dbraw/zinc/12/94/80/1431129480.db2.gz DQYBWQQNVCEZQP-IYBDPMFKSA-N 0 0 387.480 3.496 20 5 GGBDRN CCOC(=O)[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(OC)c(F)c1 ZINC000185385604 1431132870 /nfs/dbraw/zinc/13/28/70/1431132870.db2.gz RDNFKPWJWNYVDT-QGZVFWFLSA-N 0 0 380.347 3.276 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1ccc(F)cc1F ZINC000185399057 1431136242 /nfs/dbraw/zinc/13/62/42/1431136242.db2.gz VEWNYWGTEFQPLT-SNVBAGLBSA-N 0 0 393.371 3.461 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCNC(=O)c1occc1C ZINC000185399840 1431136247 /nfs/dbraw/zinc/13/62/47/1431136247.db2.gz QXVWLULPAPMHDF-INIZCTEOSA-N 0 0 387.436 3.001 20 5 GGBDRN CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185405737 1431137739 /nfs/dbraw/zinc/13/77/39/1431137739.db2.gz XGMLGKAPCWRKGQ-UHFFFAOYSA-N 0 0 375.381 3.497 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cccc(C(=O)N(C)C)c1 ZINC000185408811 1431138405 /nfs/dbraw/zinc/13/84/05/1431138405.db2.gz RXLKFFPLXVFAMB-SFHVURJKSA-N 0 0 397.475 3.224 20 5 GGBDRN C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1nc(Cc2ccccc2)no1 ZINC000185410975 1431138814 /nfs/dbraw/zinc/13/88/14/1431138814.db2.gz KLBXKFSSHSZKKU-AWEZNQCLSA-N 0 0 395.419 3.248 20 5 GGBDRN C[C@H](N[C@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000185411857 1431138952 /nfs/dbraw/zinc/13/89/52/1431138952.db2.gz HRVCJFPLDNCODJ-DJJJIMSYSA-N 0 0 397.410 3.174 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)c2ncccc12 ZINC000185426888 1431143176 /nfs/dbraw/zinc/14/31/76/1431143176.db2.gz YAFITTLUMUCGAT-OAHLLOKOSA-N 0 0 384.417 3.064 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)N(C)C(=O)CO2 ZINC000185427729 1431143298 /nfs/dbraw/zinc/14/32/98/1431143298.db2.gz TVKPGIHHINBMEC-CQSZACIVSA-N 0 0 383.404 3.157 20 5 GGBDRN COc1ccccc1-c1nc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)n[nH]1 ZINC000185430367 1431143602 /nfs/dbraw/zinc/14/36/02/1431143602.db2.gz LVUFXDZGYAUNEB-SNVBAGLBSA-N 0 0 385.355 3.270 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN([C@H](C)C(F)(F)F)CC1 ZINC000185439049 1431146014 /nfs/dbraw/zinc/14/60/14/1431146014.db2.gz IPTZKXBBUQCQHD-HIFRSBDPSA-N 0 0 387.402 3.259 20 5 GGBDRN CCCCN(CC(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185448697 1431147812 /nfs/dbraw/zinc/14/78/12/1431147812.db2.gz HOWUEVCYIDAGDM-UHFFFAOYSA-N 0 0 391.371 3.496 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@H](C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000185449606 1431148030 /nfs/dbraw/zinc/14/80/30/1431148030.db2.gz NVCNKZMKJBTFDT-ZDUSSCGKSA-N 0 0 384.436 3.366 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)C1CCN(C(=O)N2CCCC2)CC1 ZINC000185452636 1431148915 /nfs/dbraw/zinc/14/89/15/1431148915.db2.gz DKPCUNHLNUOTRM-UHFFFAOYSA-N 0 0 397.435 3.009 20 5 GGBDRN COc1cccc(N2CCN(Cc3ccc(Cl)cc3)C(=O)C2)c1[N+](=O)[O-] ZINC000185455589 1431149354 /nfs/dbraw/zinc/14/93/54/1431149354.db2.gz OIHKBOLGYSKPQM-UHFFFAOYSA-N 0 0 375.812 3.106 20 5 GGBDRN CCS(=O)(=O)c1ccccc1C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000185459827 1431149961 /nfs/dbraw/zinc/14/99/61/1431149961.db2.gz SCNTVRIZOLEOHU-UHFFFAOYSA-N 0 0 385.401 3.189 20 5 GGBDRN CCOc1cccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)c1 ZINC000185465766 1431151488 /nfs/dbraw/zinc/15/14/88/1431151488.db2.gz RTSNPPJEYTXKTM-UHFFFAOYSA-N 0 0 387.417 3.020 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(CSCCO)ccn1 ZINC000185469117 1431151825 /nfs/dbraw/zinc/15/18/25/1431151825.db2.gz KANFGUUQWJFLOA-MRXNPFEDSA-N 0 0 389.477 3.423 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC(O)(c4ccccc4)CC3)o2)cc1 ZINC000185488065 1431156068 /nfs/dbraw/zinc/15/60/68/1431156068.db2.gz KTTGCOSZUGNFRJ-UHFFFAOYSA-N 0 0 380.404 3.128 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCOc1ccc(Cl)cn1 ZINC000185511538 1431161740 /nfs/dbraw/zinc/16/17/40/1431161740.db2.gz PDWUBRILRBFAPU-CQSZACIVSA-N 0 0 377.828 3.407 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2nccc(C(C)C)n2)CC1 ZINC000185522425 1431163872 /nfs/dbraw/zinc/16/38/72/1431163872.db2.gz OQFQUKVWUBJWLY-UHFFFAOYSA-N 0 0 384.440 3.171 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCO[C@]2(CCSC2)C1 ZINC000185524302 1431163989 /nfs/dbraw/zinc/16/39/89/1431163989.db2.gz GRQJMAPNHWIEPL-GPMSIDNRSA-N 0 0 378.494 3.334 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCO[C@]2(CCSC2)C1 ZINC000185524339 1431164111 /nfs/dbraw/zinc/16/41/11/1431164111.db2.gz GRQJMAPNHWIEPL-JTDSTZFVSA-N 0 0 378.494 3.334 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)C(=O)NCC(C)(C)C ZINC000185529457 1431164764 /nfs/dbraw/zinc/16/47/64/1431164764.db2.gz XIPWXSGYPKDPKS-HNNXBMFYSA-N 0 0 377.485 3.221 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2cccc(F)c2O1 ZINC000185536464 1431166526 /nfs/dbraw/zinc/16/65/26/1431166526.db2.gz GJLULUZGBWTHJW-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN CC(C)(C)N(Cc1ccccc1)C(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 ZINC000185537443 1431166722 /nfs/dbraw/zinc/16/67/22/1431166722.db2.gz YUIMIGIHMVBAHJ-UHFFFAOYSA-N 0 0 397.431 3.148 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2cccc(F)c2O1 ZINC000185568265 1431172103 /nfs/dbraw/zinc/17/21/03/1431172103.db2.gz WZKZHXRZAUZFQR-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2cccc(F)c2O1 ZINC000185568245 1431172227 /nfs/dbraw/zinc/17/22/27/1431172227.db2.gz WZKZHXRZAUZFQR-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCC[C@H](C(C)C)CC1 ZINC000185578904 1431175066 /nfs/dbraw/zinc/17/50/66/1431175066.db2.gz HOTVOFJRSNRRKQ-UONOGXRCSA-N 0 0 377.441 3.263 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1nc(C)cs1 ZINC000185600656 1431180730 /nfs/dbraw/zinc/18/07/30/1431180730.db2.gz YFRRLPLTEHFCDH-GFCCVEGCSA-N 0 0 392.462 3.338 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000185602816 1431181615 /nfs/dbraw/zinc/18/16/15/1431181615.db2.gz DCNDSKUQQMUREQ-GFCCVEGCSA-N 0 0 390.827 3.157 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000185616099 1431184832 /nfs/dbraw/zinc/18/48/32/1431184832.db2.gz BNAJWTDKVYAHCK-LBPRGKRZSA-N 0 0 389.358 3.136 20 5 GGBDRN CC(C)(C)OCc1cc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)no1 ZINC000185622581 1431186826 /nfs/dbraw/zinc/18/68/26/1431186826.db2.gz ZKIOFHUGAWZGFO-UHFFFAOYSA-N 0 0 385.380 3.336 20 5 GGBDRN CCS[C@@H]1CCCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185628973 1431188753 /nfs/dbraw/zinc/18/87/53/1431188753.db2.gz OZMPFARZHHQXOK-CYBMUJFWSA-N 0 0 395.506 3.439 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2cccc(F)c2O1 ZINC000185647968 1431195264 /nfs/dbraw/zinc/19/52/64/1431195264.db2.gz SPZOTEMDNCXJPN-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000185653199 1431196527 /nfs/dbraw/zinc/19/65/27/1431196527.db2.gz VYAQJZJCYYXIHB-UHFFFAOYSA-N 0 0 375.234 3.028 20 5 GGBDRN COC(=O)COc1ccc([C@@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000185664272 1431199575 /nfs/dbraw/zinc/19/95/75/1431199575.db2.gz HHJPNCRZRMHSIC-GFCCVEGCSA-N 0 0 385.376 3.139 20 5 GGBDRN C[C@@H](C(=O)N1CCN([C@@H](C)c2nccs2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185677845 1431203478 /nfs/dbraw/zinc/20/34/78/1431203478.db2.gz CZVCMXDAIHZINI-OLZOCXBDSA-N 0 0 392.456 3.199 20 5 GGBDRN Cc1cc(OCC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)c(F)cc1[N+](=O)[O-] ZINC000185680315 1431204000 /nfs/dbraw/zinc/20/40/00/1431204000.db2.gz STGHDVYPVGQESF-GOSISDBHSA-N 0 0 392.358 3.160 20 5 GGBDRN C[C@@H](C(=O)Nc1cc(F)cc(N2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000185706736 1431211848 /nfs/dbraw/zinc/21/18/48/1431211848.db2.gz RQBSWZJAVBAZFU-GFCCVEGCSA-N 0 0 391.374 3.452 20 5 GGBDRN CCCN([C@H](C)C(=O)Nc1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000185743056 1431221249 /nfs/dbraw/zinc/22/12/49/1431221249.db2.gz DXQCAGCWFRQRBQ-CQSZACIVSA-N 0 0 391.449 3.023 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccc(Oc3ccccc3)nc2)c1 ZINC000185743821 1431221580 /nfs/dbraw/zinc/22/15/80/1431221580.db2.gz SPJWKSXTHRNMSJ-UHFFFAOYSA-N 0 0 385.401 3.261 20 5 GGBDRN CCc1ccccc1NC(=O)CSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C ZINC000185750553 1431223617 /nfs/dbraw/zinc/22/36/17/1431223617.db2.gz WUWAVTMYFJRYCO-UHFFFAOYSA-N 0 0 398.444 3.135 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC(=O)c1ccc(Cl)cc1 ZINC000185764394 1431228751 /nfs/dbraw/zinc/22/87/51/1431228751.db2.gz OUHGRQNXBJQVDG-UHFFFAOYSA-N 0 0 389.820 3.470 20 5 GGBDRN C[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185767848 1431229920 /nfs/dbraw/zinc/22/99/20/1431229920.db2.gz KBPIEJPYKWGSJH-ZDUSSCGKSA-N 0 0 383.429 3.279 20 5 GGBDRN Cc1ccc(NC(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)c(C)c1 ZINC000185781131 1431233987 /nfs/dbraw/zinc/23/39/87/1431233987.db2.gz LMVQRMRJKLXFIB-UHFFFAOYSA-N 0 0 398.444 3.189 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ccc(C(F)F)cc2)C1=O ZINC000185785162 1431235230 /nfs/dbraw/zinc/23/52/30/1431235230.db2.gz QGHRUCNCVYPUIS-SFHVURJKSA-N 0 0 375.331 3.500 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCc1cc(-c2ccco2)on1 ZINC000185785545 1431235315 /nfs/dbraw/zinc/23/53/15/1431235315.db2.gz JAFXKPVKBBLMDS-UHFFFAOYSA-N 0 0 384.373 3.382 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ccc(C(F)F)cc2)C1=O ZINC000185785183 1431235584 /nfs/dbraw/zinc/23/55/84/1431235584.db2.gz QGHRUCNCVYPUIS-GOSISDBHSA-N 0 0 375.331 3.500 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCSC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000185796453 1431238483 /nfs/dbraw/zinc/23/84/83/1431238483.db2.gz LYAAQYXPIMSLNK-CQSZACIVSA-N 0 0 379.482 3.272 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185802023 1431239458 /nfs/dbraw/zinc/23/94/58/1431239458.db2.gz NKCHSPHISJDCMM-OLZOCXBDSA-N 0 0 395.506 3.438 20 5 GGBDRN O=C(N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1[nH]ncc1[N+](=O)[O-] ZINC000185801855 1431239492 /nfs/dbraw/zinc/23/94/92/1431239492.db2.gz LHTPIITZARDPBL-NSHDSACASA-N 0 0 387.396 3.388 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000185815044 1431242588 /nfs/dbraw/zinc/24/25/88/1431242588.db2.gz YTMBPNLUEIKYIN-NSHDSACASA-N 0 0 389.367 3.157 20 5 GGBDRN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c(C)c(C)c1O ZINC000185815253 1431242599 /nfs/dbraw/zinc/24/25/99/1431242599.db2.gz NUQQHUDGQNNRRY-UHFFFAOYSA-N 0 0 385.420 3.315 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000185815064 1431242681 /nfs/dbraw/zinc/24/26/81/1431242681.db2.gz YTMBPNLUEIKYIN-LLVKDONJSA-N 0 0 389.367 3.157 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N(Cc2ccco2)Cc2ccc(O)cc2)c1 ZINC000185828582 1431245053 /nfs/dbraw/zinc/24/50/53/1431245053.db2.gz BQCUZBUULMHOIZ-UHFFFAOYSA-N 0 0 388.401 3.285 20 5 GGBDRN CN1Cc2cc(NC(=O)c3ccc([N+](=O)[O-])c4cccnc34)ccc2NC1=O ZINC000185844745 1431249707 /nfs/dbraw/zinc/24/97/07/1431249707.db2.gz BBGDEFVXPFRVTM-UHFFFAOYSA-N 0 0 377.360 3.373 20 5 GGBDRN O=[N+]([O-])c1ccc(CNCc2ccc(N3CCCS3(=O)=O)cc2)c(Cl)c1 ZINC000185855513 1431252974 /nfs/dbraw/zinc/25/29/74/1431252974.db2.gz XHFXKPRRYCKESS-UHFFFAOYSA-N 0 0 395.868 3.078 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC(O)(c2ccccc2)CC1 ZINC000185863293 1431255172 /nfs/dbraw/zinc/25/51/72/1431255172.db2.gz QJBLFQMQABGMNW-UHFFFAOYSA-N 0 0 392.358 3.320 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)c2ncccc12 ZINC000185865303 1431256050 /nfs/dbraw/zinc/25/60/50/1431256050.db2.gz LRCRKRYAUUKHLD-MOXGXCLJSA-N 0 0 395.440 3.150 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1nc(C2CCCCC2)no1 ZINC000185866067 1431256485 /nfs/dbraw/zinc/25/64/85/1431256485.db2.gz FJVSBXPTSPEXIJ-LLVKDONJSA-N 0 0 380.426 3.065 20 5 GGBDRN COc1ccc(F)cc1CC(=O)Nc1cc(C)nn1-c1ccc([N+](=O)[O-])cc1 ZINC000185901180 1431270076 /nfs/dbraw/zinc/27/00/76/1431270076.db2.gz DMDPWZLARSXDHC-UHFFFAOYSA-N 0 0 384.367 3.418 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@H](OCCCc3ccccc3)C2)c1 ZINC000185916673 1431277754 /nfs/dbraw/zinc/27/77/54/1431277754.db2.gz CPZJUHIUEGAAQU-SFHVURJKSA-N 0 0 390.461 3.007 20 5 GGBDRN C[C@H]1C[C@@H](c2cccnc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185915227 1431277796 /nfs/dbraw/zinc/27/77/96/1431277796.db2.gz YBCGIRXWDVKOBI-GUYCJALGSA-N 0 0 398.444 3.310 20 5 GGBDRN O=C(c1ccc(-c2nc[nH]n2)cc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000185945954 1431290437 /nfs/dbraw/zinc/29/04/37/1431290437.db2.gz XTUBGSGNNMIEBN-UHFFFAOYSA-N 0 0 393.403 3.064 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000185959360 1431297836 /nfs/dbraw/zinc/29/78/36/1431297836.db2.gz RDDFOVAIMBORBU-KRWDZBQOSA-N 0 0 376.796 3.227 20 5 GGBDRN COc1ccc(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000185961207 1431298337 /nfs/dbraw/zinc/29/83/37/1431298337.db2.gz WHECUJQNBXEAHK-QGZVFWFLSA-N 0 0 376.796 3.471 20 5 GGBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CCC(C(=O)C(F)(F)F)CC1 ZINC000185987512 1431305520 /nfs/dbraw/zinc/30/55/20/1431305520.db2.gz HVRKKNQFYXOYQX-UHFFFAOYSA-N 0 0 392.305 3.258 20 5 GGBDRN Cc1noc(C2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000185993709 1431306995 /nfs/dbraw/zinc/30/69/95/1431306995.db2.gz ZXJSTYCPKOGLMN-UHFFFAOYSA-N 0 0 379.804 3.029 20 5 GGBDRN Cc1nccn1C[C@H]1CCCN1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186004430 1431309500 /nfs/dbraw/zinc/30/95/00/1431309500.db2.gz WGBQDYXIMFTICD-OAHLLOKOSA-N 0 0 377.832 3.127 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000186005338 1431309584 /nfs/dbraw/zinc/30/95/84/1431309584.db2.gz GNXRSTNSDZGGPN-HNNXBMFYSA-N 0 0 379.800 3.433 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1nc(C(C)(C)C)no1 ZINC000186007383 1431309813 /nfs/dbraw/zinc/30/98/13/1431309813.db2.gz MTMWVTAHOCKQKK-VIFPVBQESA-N 0 0 381.820 3.489 20 5 GGBDRN CN(C[C@H]1COc2ccccc2O1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186009168 1431310292 /nfs/dbraw/zinc/31/02/92/1431310292.db2.gz RIDBAZFJNZJXQT-AWEZNQCLSA-N 0 0 391.811 3.230 20 5 GGBDRN CCOC(=O)c1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186011106 1431310618 /nfs/dbraw/zinc/31/06/18/1431310618.db2.gz ISJHJQYEDBZYBL-UHFFFAOYSA-N 0 0 391.811 3.424 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCC(Cn2cccn2)CC1 ZINC000186011002 1431310716 /nfs/dbraw/zinc/31/07/16/1431310716.db2.gz WKDLOQVRKPLTCV-UHFFFAOYSA-N 0 0 377.832 3.067 20 5 GGBDRN Cc1c(C(=O)Nc2ncn(C3CCCCC3)n2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000186010879 1431310799 /nfs/dbraw/zinc/31/07/99/1431310799.db2.gz CQHMPVCNOYZLQK-UHFFFAOYSA-N 0 0 388.384 3.469 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000186011477 1431311140 /nfs/dbraw/zinc/31/11/40/1431311140.db2.gz VXZCKWGVTZZZEJ-CQSZACIVSA-N 0 0 378.450 3.103 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 ZINC000186018001 1431312335 /nfs/dbraw/zinc/31/23/35/1431312335.db2.gz SSOCULQFMXTRTE-CVEARBPZSA-N 0 0 393.871 3.293 20 5 GGBDRN CSc1cccc(C(=O)NCc2ccccc2Cn2cccn2)c1[N+](=O)[O-] ZINC000186027207 1431313692 /nfs/dbraw/zinc/31/36/92/1431313692.db2.gz BGGKEAPRWZXKGU-UHFFFAOYSA-N 0 0 382.445 3.492 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000186049282 1431319723 /nfs/dbraw/zinc/31/97/23/1431319723.db2.gz NLSXITBWXOAWDT-OAHLLOKOSA-N 0 0 392.408 3.160 20 5 GGBDRN CSc1cccc(C(=O)NCCc2ccc(-n3cccn3)cc2)c1[N+](=O)[O-] ZINC000186052617 1431319991 /nfs/dbraw/zinc/31/99/91/1431319991.db2.gz JJPMQYMJCZVGHF-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCO[C@H](CCc4ccccc4)C3)n2)c1 ZINC000186060617 1431322004 /nfs/dbraw/zinc/32/20/04/1431322004.db2.gz RMBSGZQMRQMMES-LJQANCHMSA-N 0 0 394.431 3.478 20 5 GGBDRN Cc1cccc2c1N(C1CC1)CCN2S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000186065723 1431323090 /nfs/dbraw/zinc/32/30/90/1431323090.db2.gz KREMHEJWMBZRIS-UHFFFAOYSA-N 0 0 387.461 3.222 20 5 GGBDRN Cc1cccc2c1N(C1CC1)CCN2S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000186074388 1431325125 /nfs/dbraw/zinc/32/51/25/1431325125.db2.gz QVUVRWOFUFNZRW-UHFFFAOYSA-N 0 0 387.461 3.222 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCC[C@H]2CCCCO2)c(S(=O)(=O)N2CCCC2)c1 ZINC000186079128 1431325833 /nfs/dbraw/zinc/32/58/33/1431325833.db2.gz SRJQXUYCHYQVGI-MRXNPFEDSA-N 0 0 397.497 3.141 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000186092348 1431328762 /nfs/dbraw/zinc/32/87/62/1431328762.db2.gz HBJQVMQIGKXXLY-AWEZNQCLSA-N 0 0 393.321 3.149 20 5 GGBDRN O=C(CCN1CCO[C@H](CCc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000186092719 1431328912 /nfs/dbraw/zinc/32/89/12/1431328912.db2.gz YAYHYCOITNGDRK-GOSISDBHSA-N 0 0 383.448 3.257 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1nnc(-c2c(F)cccc2Cl)s1 ZINC000186096844 1431329834 /nfs/dbraw/zinc/32/98/34/1431329834.db2.gz RPBXJKMQTADJBU-UHFFFAOYSA-N 0 0 394.775 3.135 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC2(Cc3cccc(F)c3)CCC2)cc1 ZINC000186099603 1431330062 /nfs/dbraw/zinc/33/00/62/1431330062.db2.gz DHMSRVAAVWIGGW-UHFFFAOYSA-N 0 0 378.425 3.319 20 5 GGBDRN O=C(NCC(F)(F)CO)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000186103325 1431331314 /nfs/dbraw/zinc/33/13/14/1431331314.db2.gz JWCLYLHWPMETME-UHFFFAOYSA-N 0 0 386.738 3.398 20 5 GGBDRN CSc1cccc(C(=O)NCc2cccc(CN3CCCC3=O)c2)c1[N+](=O)[O-] ZINC000186142376 1431340209 /nfs/dbraw/zinc/34/02/09/1431340209.db2.gz WKSVIMNGFURDFE-UHFFFAOYSA-N 0 0 399.472 3.369 20 5 GGBDRN Cn1nc(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c2ccccc21 ZINC000186155561 1431343162 /nfs/dbraw/zinc/34/31/62/1431343162.db2.gz OVPJJQIGMUGWCB-UHFFFAOYSA-N 0 0 375.388 3.002 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nn(C)c2ccccc12 ZINC000186158697 1431343778 /nfs/dbraw/zinc/34/37/78/1431343778.db2.gz GKXJJQXXOLPSOF-INIZCTEOSA-N 0 0 380.448 3.409 20 5 GGBDRN CC(C)n1cnnc1C1CCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000186171224 1431346236 /nfs/dbraw/zinc/34/62/36/1431346236.db2.gz ALLZBBKYHWYJPT-CYBMUJFWSA-N 0 0 389.431 3.416 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@H]1CCO[C@@]2(CCOC2)C1 ZINC000186171848 1431346284 /nfs/dbraw/zinc/34/62/84/1431346284.db2.gz GIQRKNXCPJUGBM-HJPURHCSSA-N 0 0 393.439 3.036 20 5 GGBDRN Cc1nn(CCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c(C)c1[N+](=O)[O-] ZINC000186184124 1431348355 /nfs/dbraw/zinc/34/83/55/1431348355.db2.gz DQNKXXIGUURPRT-CYBMUJFWSA-N 0 0 378.379 3.093 20 5 GGBDRN CCCN(Cc1ccccc1)S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1 ZINC000186216731 1431355070 /nfs/dbraw/zinc/35/50/70/1431355070.db2.gz ZDVYTGNMGDLWAQ-UHFFFAOYSA-N 0 0 382.413 3.343 20 5 GGBDRN C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000186224253 1431356907 /nfs/dbraw/zinc/35/69/07/1431356907.db2.gz TXMPBZVSPJTJDQ-NRFANRHFSA-N 0 0 391.431 3.413 20 5 GGBDRN O=C(Nc1cncnc1N1CCCC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000186246841 1431361757 /nfs/dbraw/zinc/36/17/57/1431361757.db2.gz CTKBBVDTXLGLRG-UHFFFAOYSA-N 0 0 396.432 3.361 20 5 GGBDRN O=C1[C@H](Nc2cnn(Cc3ccccc3)c2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000186247433 1431362045 /nfs/dbraw/zinc/36/20/45/1431362045.db2.gz WUTQEJNUTMTSDF-LJQANCHMSA-N 0 0 377.404 3.057 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cc1 ZINC000186275960 1431369220 /nfs/dbraw/zinc/36/92/20/1431369220.db2.gz GEOAEILUFLBXDI-HNNXBMFYSA-N 0 0 388.367 3.360 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@H](c1ccccc1)C(F)(F)F ZINC000186278964 1431370344 /nfs/dbraw/zinc/37/03/44/1431370344.db2.gz RQJQJEIFXIIYLX-CQSZACIVSA-N 0 0 388.367 3.360 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000186286060 1431372155 /nfs/dbraw/zinc/37/21/55/1431372155.db2.gz RMSGMQGVFFYMTE-HNNXBMFYSA-N 0 0 380.397 3.268 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c2c(O)cccc21 ZINC000186293465 1431373718 /nfs/dbraw/zinc/37/37/18/1431373718.db2.gz WNJBSYGIWBXRNQ-LBPRGKRZSA-N 0 0 379.376 3.035 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c2c(O)cccc21 ZINC000186293698 1431374042 /nfs/dbraw/zinc/37/40/42/1431374042.db2.gz WOUYHSKZBBIIGN-NSHDSACASA-N 0 0 379.372 3.296 20 5 GGBDRN CCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(=O)OC(C)(C)C ZINC000186302860 1431376774 /nfs/dbraw/zinc/37/67/74/1431376774.db2.gz WXQIXEINQDQGJW-UHFFFAOYSA-N 0 0 385.848 3.240 20 5 GGBDRN Cc1nc(-c2ncccn2)sc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186306798 1431378232 /nfs/dbraw/zinc/37/82/32/1431378232.db2.gz GKFBNTMEUDZTKH-UHFFFAOYSA-N 0 0 389.824 3.400 20 5 GGBDRN CCN(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)[C@@H](C)Cc1ccsc1 ZINC000186313027 1431379321 /nfs/dbraw/zinc/37/93/21/1431379321.db2.gz ZVZFXTFIZQWJDG-ZDUSSCGKSA-N 0 0 385.449 3.330 20 5 GGBDRN Cc1cc(CNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1Cl ZINC000186312699 1431379333 /nfs/dbraw/zinc/37/93/33/1431379333.db2.gz VNWQPISHCUIOQW-UHFFFAOYSA-N 0 0 396.230 3.256 20 5 GGBDRN COCCOCc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000186317087 1431380657 /nfs/dbraw/zinc/38/06/57/1431380657.db2.gz GCHIYHSRDPNORL-UHFFFAOYSA-N 0 0 396.802 3.480 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)cc(F)cc1[N+](=O)[O-] ZINC000186324924 1431383096 /nfs/dbraw/zinc/38/30/96/1431383096.db2.gz BTXVNHURRLTRLZ-HNNXBMFYSA-N 0 0 397.765 3.322 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)c1[N+](=O)[O-] ZINC000186325558 1431383431 /nfs/dbraw/zinc/38/34/31/1431383431.db2.gz UAADDOMWDADDJT-AWEZNQCLSA-N 0 0 396.806 3.277 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCN1C(=O)c1ccccc1 ZINC000186330835 1431384724 /nfs/dbraw/zinc/38/47/24/1431384724.db2.gz DQWSIGHNJPRLLR-QGZVFWFLSA-N 0 0 387.823 3.169 20 5 GGBDRN C[C@H](NC(=O)Nc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186335857 1431386313 /nfs/dbraw/zinc/38/63/13/1431386313.db2.gz WTAFZWYMEHUZCU-NSHDSACASA-N 0 0 376.800 3.075 20 5 GGBDRN O=C(Cc1ccc(NC(=O)C2CC2)cc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186337836 1431386641 /nfs/dbraw/zinc/38/66/41/1431386641.db2.gz MNOPLSCMKRKRMO-UHFFFAOYSA-N 0 0 387.823 3.456 20 5 GGBDRN CC(=O)CCc1ccc(OCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186344680 1431388229 /nfs/dbraw/zinc/38/82/29/1431388229.db2.gz DLFNKPIGOHDSBI-UHFFFAOYSA-N 0 0 390.823 3.465 20 5 GGBDRN CC(C)C[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)N1CCCCC1=O ZINC000186345856 1431388521 /nfs/dbraw/zinc/38/85/21/1431388521.db2.gz FJEIZHQNQAFAFE-INIZCTEOSA-N 0 0 381.860 3.292 20 5 GGBDRN O=C(CCCNC(=O)c1ccccc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186349745 1431389157 /nfs/dbraw/zinc/38/91/57/1431389157.db2.gz STSDLYQQKDOQTB-UHFFFAOYSA-N 0 0 375.812 3.075 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(CN2CCCC2=O)cc1 ZINC000186349330 1431389178 /nfs/dbraw/zinc/38/91/78/1431389178.db2.gz WLXVTNAOODJHSL-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN CCN(C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)[C@@H](C)Cc1ccsc1 ZINC000186350194 1431389228 /nfs/dbraw/zinc/38/92/28/1431389228.db2.gz HFBNZFFTISTNMO-ZDUSSCGKSA-N 0 0 385.449 3.330 20 5 GGBDRN COc1cccc(CO[C@@H](C)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186349846 1431389364 /nfs/dbraw/zinc/38/93/64/1431389364.db2.gz YVAXNNDUNAFVTC-LBPRGKRZSA-N 0 0 378.812 3.478 20 5 GGBDRN CCN(Cc1ccccc1C)S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1 ZINC000186351444 1431389720 /nfs/dbraw/zinc/38/97/20/1431389720.db2.gz HESJXBXZHXVAPT-UHFFFAOYSA-N 0 0 382.413 3.262 20 5 GGBDRN CC(=O)N[C@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000186351672 1431389727 /nfs/dbraw/zinc/38/97/27/1431389727.db2.gz MXRROZOFVXGQRZ-QGZVFWFLSA-N 0 0 375.812 3.132 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186350374 1431389772 /nfs/dbraw/zinc/38/97/72/1431389772.db2.gz RCNKXDPZHXRWHC-GXTWGEPZSA-N 0 0 381.860 3.149 20 5 GGBDRN C[C@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)NC(=O)C1CCCCC1 ZINC000186353131 1431390055 /nfs/dbraw/zinc/39/00/55/1431390055.db2.gz WFZIZODDGXQRLK-GFCCVEGCSA-N 0 0 381.860 3.340 20 5 GGBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)[C@H](C)Cc1ccsc1 ZINC000186363232 1431392219 /nfs/dbraw/zinc/39/22/19/1431392219.db2.gz JPQHKQWJQCVMJI-GFCCVEGCSA-N 0 0 396.490 3.153 20 5 GGBDRN Cc1cccc(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)c1[N+](=O)[O-] ZINC000186413386 1431408853 /nfs/dbraw/zinc/40/88/53/1431408853.db2.gz MTYFWQMVBSJDIC-UHFFFAOYSA-N 0 0 376.359 3.305 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000186413605 1431409089 /nfs/dbraw/zinc/40/90/89/1431409089.db2.gz ZZIHSRNTTHWHHF-UHFFFAOYSA-N 0 0 392.358 3.005 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC[C@@H](C)C1 ZINC000186455373 1431423490 /nfs/dbraw/zinc/42/34/90/1431423490.db2.gz XBBVENWHNNQLLP-PBHICJAKSA-N 0 0 393.509 3.095 20 5 GGBDRN C[C@H](C1CC1)n1cc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cn1 ZINC000186452446 1431423599 /nfs/dbraw/zinc/42/35/99/1431423599.db2.gz RNWYFXAKECKQGM-GFCCVEGCSA-N 0 0 399.407 3.089 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC[C@H](C)C1 ZINC000186455392 1431424273 /nfs/dbraw/zinc/42/42/73/1431424273.db2.gz XBBVENWHNNQLLP-YOEHRIQHSA-N 0 0 393.509 3.095 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186462952 1431425861 /nfs/dbraw/zinc/42/58/61/1431425861.db2.gz KDTKRKPSOGPVSF-UHFFFAOYSA-N 0 0 375.450 3.391 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000186513001 1431443084 /nfs/dbraw/zinc/44/30/84/1431443084.db2.gz YUUJSMIHGODCHD-SJKOYZFVSA-N 0 0 375.450 3.378 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCC1(Cc2ccccc2)CCCCC1 ZINC000186515188 1431443744 /nfs/dbraw/zinc/44/37/44/1431443744.db2.gz NQTHGLHPJXEZRC-UHFFFAOYSA-N 0 0 383.448 3.066 20 5 GGBDRN Nc1c(C(=O)NCC2(CCOCc3ccccc3)CC2)cc(F)cc1[N+](=O)[O-] ZINC000186517418 1431444173 /nfs/dbraw/zinc/44/41/73/1431444173.db2.gz UACVNMVBQGMUFT-UHFFFAOYSA-N 0 0 387.411 3.433 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000186516460 1431444220 /nfs/dbraw/zinc/44/42/20/1431444220.db2.gz XUSBKLJIWDNAPA-XHDPSFHLSA-N 0 0 379.413 3.209 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)c1C ZINC000186523056 1431445708 /nfs/dbraw/zinc/44/57/08/1431445708.db2.gz WHVVIQIVVQPGCX-YVEFUNNKSA-N 0 0 375.450 3.378 20 5 GGBDRN CCc1nnnn1-c1ccccc1NC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186525678 1431446359 /nfs/dbraw/zinc/44/63/59/1431446359.db2.gz BMPUSYQDDUNPFH-UHFFFAOYSA-N 0 0 384.421 3.107 20 5 GGBDRN COc1ccccc1[C@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)OC(C)C ZINC000186531379 1431447289 /nfs/dbraw/zinc/44/72/89/1431447289.db2.gz MBYHYVKCOBPOGQ-SFHVURJKSA-N 0 0 398.419 3.376 20 5 GGBDRN COc1ccccc1[C@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])OC(C)C ZINC000186531639 1431447787 /nfs/dbraw/zinc/44/77/87/1431447787.db2.gz FFTOFDKVPHOUEZ-IBGZPJMESA-N 0 0 387.436 3.298 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])OC(C)C ZINC000186531659 1431447819 /nfs/dbraw/zinc/44/78/19/1431447819.db2.gz FFTOFDKVPHOUEZ-LJQANCHMSA-N 0 0 387.436 3.298 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2C[C@H](OCc3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000186539946 1431449036 /nfs/dbraw/zinc/44/90/36/1431449036.db2.gz KRJTYKDIQZVEGZ-CVEARBPZSA-N 0 0 386.452 3.384 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000186557165 1431453499 /nfs/dbraw/zinc/45/34/99/1431453499.db2.gz LHJUDSSPYTUZNR-NSHDSACASA-N 0 0 387.421 3.375 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(Cc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000186559860 1431453889 /nfs/dbraw/zinc/45/38/89/1431453889.db2.gz NZSBTXYRVROFNS-UHFFFAOYSA-N 0 0 398.387 3.235 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc([N+](=O)[O-])c1 ZINC000186565050 1431455113 /nfs/dbraw/zinc/45/51/13/1431455113.db2.gz CBZIXSQYTZUNFS-UHFFFAOYSA-N 0 0 381.388 3.195 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCc3cc(N)ccc32)cc1OC ZINC000186570358 1431456728 /nfs/dbraw/zinc/45/67/28/1431456728.db2.gz MYEOWROQKMNHNK-MRXNPFEDSA-N 0 0 385.420 3.392 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(-c2cncnc2)cc1F ZINC000186574247 1431457857 /nfs/dbraw/zinc/45/78/57/1431457857.db2.gz VGKBOJHDERVVCJ-UHFFFAOYSA-N 0 0 378.323 3.320 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])c1 ZINC000186600039 1431465152 /nfs/dbraw/zinc/46/51/52/1431465152.db2.gz GJGPSGYFGLSNKT-LHSJRXKWSA-N 0 0 397.431 3.062 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 ZINC000186603843 1431466270 /nfs/dbraw/zinc/46/62/70/1431466270.db2.gz UNDYZRSYPGGOAJ-OAHLLOKOSA-N 0 0 390.443 3.197 20 5 GGBDRN Cc1ccccc1C(NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1C ZINC000186621553 1431471767 /nfs/dbraw/zinc/47/17/67/1431471767.db2.gz PTHGWXLSXUVPIU-UHFFFAOYSA-N 0 0 391.427 3.279 20 5 GGBDRN CCn1c(SCC(=O)c2c(C)noc2C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000186633908 1431475162 /nfs/dbraw/zinc/47/51/62/1431475162.db2.gz JDQMQJYILYBWJJ-UHFFFAOYSA-N 0 0 387.421 3.453 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186676781 1431489692 /nfs/dbraw/zinc/48/96/92/1431489692.db2.gz FXOXBGFJHPIRCR-LHSJRXKWSA-N 0 0 397.431 3.062 20 5 GGBDRN O=C(CN1CC[C@]2(C1)OCc1ccccc12)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000186683217 1431491122 /nfs/dbraw/zinc/49/11/22/1431491122.db2.gz XHFNRIQJGBXPLC-LJQANCHMSA-N 0 0 387.823 3.318 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@H](O)[C@@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000186690977 1431493314 /nfs/dbraw/zinc/49/33/14/1431493314.db2.gz YVUIUYKYJVKLQM-HZMBPMFUSA-N 0 0 393.490 3.354 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000186703775 1431496066 /nfs/dbraw/zinc/49/60/66/1431496066.db2.gz VZWKGIXFLQCEIV-LLVKDONJSA-N 0 0 382.804 3.060 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000186703755 1431496302 /nfs/dbraw/zinc/49/63/02/1431496302.db2.gz VZWKGIXFLQCEIV-NSHDSACASA-N 0 0 382.804 3.060 20 5 GGBDRN C[C@H](NC(=O)NCc1cc(COC(C)(C)C)on1)c1cccc([N+](=O)[O-])c1 ZINC000186719585 1431501286 /nfs/dbraw/zinc/50/12/86/1431501286.db2.gz ZUSXVHPYAXBXTA-LBPRGKRZSA-N 0 0 376.413 3.458 20 5 GGBDRN Cc1cc(OCC(=O)NCc2ccc(OC(F)F)cc2)c(F)cc1[N+](=O)[O-] ZINC000186730345 1431503711 /nfs/dbraw/zinc/50/37/11/1431503711.db2.gz SFBLSCPCYWGTER-UHFFFAOYSA-N 0 0 384.310 3.339 20 5 GGBDRN CC(C)(C)c1cnc(CCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)o1 ZINC000186749953 1431507588 /nfs/dbraw/zinc/50/75/88/1431507588.db2.gz ORCLJRSOZJSJIG-UHFFFAOYSA-N 0 0 386.452 3.162 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000186788511 1431517005 /nfs/dbraw/zinc/51/70/05/1431517005.db2.gz WHAWQTBAJASGGI-QGZVFWFLSA-N 0 0 375.356 3.348 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000186788489 1431517112 /nfs/dbraw/zinc/51/71/12/1431517112.db2.gz WHAWQTBAJASGGI-KRWDZBQOSA-N 0 0 375.356 3.348 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@H](O)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000186819668 1431527906 /nfs/dbraw/zinc/52/79/06/1431527906.db2.gz YHTQRDIDXJHKEF-XPGWFJOJSA-N 0 0 383.448 3.286 20 5 GGBDRN Cc1c(CC(=O)NCC2=CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000186831555 1431531840 /nfs/dbraw/zinc/53/18/40/1431531840.db2.gz OVZYBXXMSPEGML-UHFFFAOYSA-N 0 0 389.452 3.129 20 5 GGBDRN Cc1c(CC(=O)N[C@@H](c2cnn(C)c2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000186864229 1431545799 /nfs/dbraw/zinc/54/57/99/1431545799.db2.gz QWKYDJYTTJQUDI-HXUWFJFHSA-N 0 0 382.395 3.224 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000186874270 1431549705 /nfs/dbraw/zinc/54/97/05/1431549705.db2.gz ZWEJLWKIFMXAJS-GOSISDBHSA-N 0 0 392.358 3.242 20 5 GGBDRN COC(=O)c1scc(C)c1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186879316 1431551370 /nfs/dbraw/zinc/55/13/70/1431551370.db2.gz CRAVTFIXMRKSET-UHFFFAOYSA-N 0 0 386.389 3.189 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000186888281 1431555720 /nfs/dbraw/zinc/55/57/20/1431555720.db2.gz JEOLTOFXELFYAV-SFHVURJKSA-N 0 0 391.374 3.275 20 5 GGBDRN CSc1cccc(C(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000186898055 1431559303 /nfs/dbraw/zinc/55/93/03/1431559303.db2.gz WGOFWRWLPJYMPL-OAHLLOKOSA-N 0 0 399.472 3.095 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C(=O)OC)c1ccsc1 ZINC000186916491 1431564485 /nfs/dbraw/zinc/56/44/85/1431564485.db2.gz GFVDRBYVTVKIBX-CZUORRHYSA-N 0 0 376.434 3.256 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCSC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000186915882 1431564642 /nfs/dbraw/zinc/56/46/42/1431564642.db2.gz YNJCBVQBXSLCBB-LBPRGKRZSA-N 0 0 386.355 3.267 20 5 GGBDRN O=C(Nc1nc(-c2c(F)cccc2F)cs1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000186921048 1431566115 /nfs/dbraw/zinc/56/61/15/1431566115.db2.gz ZQYSRWBXKYSBHV-UHFFFAOYSA-N 0 0 378.316 3.349 20 5 GGBDRN COC(=O)c1scc(C)c1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000186924411 1431567628 /nfs/dbraw/zinc/56/76/28/1431567628.db2.gz DUDZPWYMMXFEPC-UHFFFAOYSA-N 0 0 386.389 3.189 20 5 GGBDRN O=C(NCc1ccccc1COCc1ccccc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000186932651 1431569863 /nfs/dbraw/zinc/56/98/63/1431569863.db2.gz BIELRXZYSVNLBC-UHFFFAOYSA-N 0 0 393.399 3.342 20 5 GGBDRN COc1cc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c([N+](=O)[O-])cc1F ZINC000186946305 1431573637 /nfs/dbraw/zinc/57/36/37/1431573637.db2.gz NQEMZOKZMSBZJU-UHFFFAOYSA-N 0 0 392.402 3.451 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000186950388 1431575168 /nfs/dbraw/zinc/57/51/68/1431575168.db2.gz CINDQZPJVSJYGY-FQEVSTJZSA-N 0 0 389.411 3.227 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000186957374 1431576624 /nfs/dbraw/zinc/57/66/24/1431576624.db2.gz SGUVDTHXKHUPLH-LJQANCHMSA-N 0 0 383.360 3.083 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(CC(F)(F)F)CC2(C)C)c1[N+](=O)[O-] ZINC000186965730 1431578950 /nfs/dbraw/zinc/57/89/50/1431578950.db2.gz GAIIYVRHHMNRIK-UHFFFAOYSA-N 0 0 391.415 3.415 20 5 GGBDRN CSCCCCCNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000186970740 1431579752 /nfs/dbraw/zinc/57/97/52/1431579752.db2.gz YUVBURQCRRUJIR-QGZVFWFLSA-N 0 0 393.509 3.157 20 5 GGBDRN Cc1nc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)sc1Cc1ccccc1F ZINC000186974682 1431580634 /nfs/dbraw/zinc/58/06/34/1431580634.db2.gz SMCNJSMKFMNXOV-UHFFFAOYSA-N 0 0 388.380 3.443 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@H](C(N)=O)C1 ZINC000187006155 1431587523 /nfs/dbraw/zinc/58/75/23/1431587523.db2.gz LGULVAOQCNBFCM-UGSOOPFHSA-N 0 0 382.420 3.064 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nn(C)c2ccccc12 ZINC000187004707 1431587678 /nfs/dbraw/zinc/58/76/78/1431587678.db2.gz 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GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCSC[C@@H]3c3nccs3)o2)cc1 ZINC000187021663 1431592271 /nfs/dbraw/zinc/59/22/71/1431592271.db2.gz CADNZYQLYJFXBX-CYBMUJFWSA-N 0 0 389.462 3.391 20 5 GGBDRN O=C(NCCOc1ccccc1-c1ccccc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187025184 1431593967 /nfs/dbraw/zinc/59/39/67/1431593967.db2.gz UBXVZCUFBKHLDM-UHFFFAOYSA-N 0 0 379.372 3.171 20 5 GGBDRN Cc1c(NC(=O)CCN2CCSC[C@H]2c2nccs2)cccc1[N+](=O)[O-] ZINC000187027660 1431594358 /nfs/dbraw/zinc/59/43/58/1431594358.db2.gz ZXTINIINDFJBAY-HNNXBMFYSA-N 0 0 392.506 3.478 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCCC[C@H]3O)cc2[N+](=O)[O-])C1 ZINC000187036546 1431596753 /nfs/dbraw/zinc/59/67/53/1431596753.db2.gz NNCKTIDIKWJYQY-QHHYFVSCSA-N 0 0 375.469 3.110 20 5 GGBDRN O=C(N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187044638 1431598896 /nfs/dbraw/zinc/59/88/96/1431598896.db2.gz OOCAPVXQDDMHTM-CYBMUJFWSA-N 0 0 379.319 3.104 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCSC[C@@H]3c3nccs3)n2)c1 ZINC000187053727 1431600365 /nfs/dbraw/zinc/60/03/65/1431600365.db2.gz UJQWPFDQWHCNBB-CYBMUJFWSA-N 0 0 389.462 3.391 20 5 GGBDRN CSc1cccc(C(=O)N2CCN([C@H](C)c3nccs3)CC2)c1[N+](=O)[O-] ZINC000187085666 1431609737 /nfs/dbraw/zinc/60/97/37/1431609737.db2.gz KPQQHGACTBFIDL-GFCCVEGCSA-N 0 0 392.506 3.292 20 5 GGBDRN Nc1c(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)cc(F)cc1[N+](=O)[O-] ZINC000187144362 1431629791 /nfs/dbraw/zinc/62/97/91/1431629791.db2.gz FWLQXWUEHCGYBY-UHFFFAOYSA-N 0 0 398.394 3.258 20 5 GGBDRN COC(=O)C[C@@](C)(NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)c1ccccn1 ZINC000187154093 1431632697 /nfs/dbraw/zinc/63/26/97/1431632697.db2.gz PJDJOZFYSHMKPA-OAQYLSRUSA-N 0 0 399.447 3.496 20 5 GGBDRN Cc1cc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)ccc1[N+](=O)[O-] ZINC000187154317 1431632734 /nfs/dbraw/zinc/63/27/34/1431632734.db2.gz DOTPGEDWQDJYON-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN CC[C@@]1(CO)CCCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000187167454 1431636641 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IHBBDUHHAXOYCI-IIBYNOLFSA-N 0 0 399.447 3.153 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000187234115 1431659535 /nfs/dbraw/zinc/65/95/35/1431659535.db2.gz LCOMQIDDBPXDLF-UHFFFAOYSA-N 0 0 394.424 3.311 20 5 GGBDRN CCN(c1ccc(F)c(F)c1)S(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1 ZINC000187265932 1431673980 /nfs/dbraw/zinc/67/39/80/1431673980.db2.gz WGSUZFLGSTVUCW-UHFFFAOYSA-N 0 0 390.339 3.236 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1[N+](=O)[O-] ZINC000187268970 1431674408 /nfs/dbraw/zinc/67/44/08/1431674408.db2.gz CSAWFAXFIJUTQE-UHFFFAOYSA-N 0 0 397.431 3.443 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000187288026 1431682810 /nfs/dbraw/zinc/68/28/10/1431682810.db2.gz VHBMCXDURIKDPG-GOSISDBHSA-N 0 0 391.374 3.193 20 5 GGBDRN O=C(CCN1CCO[C@@H](c2ccc(F)cc2F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000187290480 1431683788 /nfs/dbraw/zinc/68/37/88/1431683788.db2.gz HDSYMJANFMZBAD-GOSISDBHSA-N 0 0 391.374 3.275 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000187290952 1431683938 /nfs/dbraw/zinc/68/39/38/1431683938.db2.gz DFCDIYFOGOHLMI-NEPJUHHUSA-N 0 0 382.413 3.213 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC1CCC(O)(c2cccnc2)CC1 ZINC000187299494 1431687063 /nfs/dbraw/zinc/68/70/63/1431687063.db2.gz UPPXFNGAYBSMHX-UHFFFAOYSA-N 0 0 387.461 3.029 20 5 GGBDRN CC1(C)[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1OCc1ccccc1 ZINC000187305361 1431689122 /nfs/dbraw/zinc/68/91/22/1431689122.db2.gz QECUQLAYHIVFAS-QZTJIDSGSA-N 0 0 397.431 3.033 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H](O)Cc1cccc(C(F)(F)F)c1 ZINC000187346185 1431704213 /nfs/dbraw/zinc/70/42/13/1431704213.db2.gz UXZCQZCAXDCONO-AWEZNQCLSA-N 0 0 394.309 3.032 20 5 GGBDRN CCN(C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@H](C)Cc1ccsc1 ZINC000187372152 1431712094 /nfs/dbraw/zinc/71/20/94/1431712094.db2.gz XQIOCKJXGADYPE-CQSZACIVSA-N 0 0 389.477 3.174 20 5 GGBDRN COCC(=O)N1CCc2cc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])ccc21 ZINC000187444348 1431732060 /nfs/dbraw/zinc/73/20/60/1431732060.db2.gz AUZMSASYGBMPGH-UHFFFAOYSA-N 0 0 389.795 3.036 20 5 GGBDRN Cn1cc(CCNC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccc(F)cc21 ZINC000187462009 1431738169 /nfs/dbraw/zinc/73/81/69/1431738169.db2.gz CTFDKBYAKJVAGE-UHFFFAOYSA-N 0 0 385.395 3.353 20 5 GGBDRN C[C@](O)(CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000187468010 1431740021 /nfs/dbraw/zinc/74/00/21/1431740021.db2.gz MXVUYUCGKHZKIC-QFIPXVFZSA-N 0 0 397.475 3.225 20 5 GGBDRN COCCC1(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCCCC1 ZINC000187486413 1431746009 /nfs/dbraw/zinc/74/60/09/1431746009.db2.gz ABJDHSCEYHYFJF-UHFFFAOYSA-N 0 0 387.436 3.153 20 5 GGBDRN CC(=O)N1CCN(Cc2ccccc2NCc2cccc([N+](=O)[O-])c2C)CC1 ZINC000187529775 1431757928 /nfs/dbraw/zinc/75/79/28/1431757928.db2.gz KWRSGVSNCVSCJR-UHFFFAOYSA-N 0 0 382.464 3.179 20 5 GGBDRN CCOc1ccc2c(c1)[C@H](NC(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)CCO2 ZINC000187535258 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ZINC000187678366 1431798353 /nfs/dbraw/zinc/79/83/53/1431798353.db2.gz UYTSPDYYAWIHMT-MRXNPFEDSA-N 0 0 379.482 3.006 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CSC[C@@H]2C(=O)N(C)C(C)C)cc1[N+](=O)[O-] ZINC000187678212 1431798396 /nfs/dbraw/zinc/79/83/96/1431798396.db2.gz GFJCKZOWEDGAAJ-MRXNPFEDSA-N 0 0 379.482 3.100 20 5 GGBDRN COC[C@H](C)n1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000187687594 1431800339 /nfs/dbraw/zinc/80/03/39/1431800339.db2.gz LNGLNKIQNLEQEV-WDEREUQCSA-N 0 0 381.820 3.091 20 5 GGBDRN COC[C@@H](C)n1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000187687573 1431800391 /nfs/dbraw/zinc/80/03/91/1431800391.db2.gz LNGLNKIQNLEQEV-MNOVXSKESA-N 0 0 381.820 3.091 20 5 GGBDRN COC[C@H](C)n1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000187687557 1431800407 /nfs/dbraw/zinc/80/04/07/1431800407.db2.gz LNGLNKIQNLEQEV-QWRGUYRKSA-N 0 0 381.820 3.091 20 5 GGBDRN CN(CC(=O)NC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000187712924 1431802923 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387.461 3.330 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCC(c2ccsc2)CC1 ZINC000187995607 1431834669 /nfs/dbraw/zinc/83/46/69/1431834669.db2.gz NBXHGYGTAFREQR-UHFFFAOYSA-N 0 0 383.433 3.257 20 5 GGBDRN CSCc1cccc(CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000188009448 1431836113 /nfs/dbraw/zinc/83/61/13/1431836113.db2.gz AOBCYCRSFLMDHS-UHFFFAOYSA-N 0 0 393.852 3.366 20 5 GGBDRN CCN1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1=O ZINC000188052372 1431840172 /nfs/dbraw/zinc/84/01/72/1431840172.db2.gz IHFBUDOOTLMQIL-UHFFFAOYSA-N 0 0 399.472 3.440 20 5 GGBDRN CCN(C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H](C)Cc1ccsc1 ZINC000188059464 1431840935 /nfs/dbraw/zinc/84/09/35/1431840935.db2.gz GFCHDPTZANIPFI-LBPRGKRZSA-N 0 0 375.450 3.383 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(c3ncccc3Cl)CC2)c1[N+](=O)[O-] ZINC000188072273 1431842394 /nfs/dbraw/zinc/84/23/94/1431842394.db2.gz LPSKIDQATBYIKQ-UHFFFAOYSA-N 0 0 392.868 3.328 20 5 GGBDRN CC(C)c1ccc(C(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000188081798 1431844121 /nfs/dbraw/zinc/84/41/21/1431844121.db2.gz KJEZJEGUAQTHCN-KRWDZBQOSA-N 0 0 395.459 3.497 20 5 GGBDRN CCN1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1=O ZINC000188081952 1431844124 /nfs/dbraw/zinc/84/41/24/1431844124.db2.gz PBYFYXPQPJYWSN-UHFFFAOYSA-N 0 0 383.404 3.082 20 5 GGBDRN CCN1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1=O ZINC000188088198 1431845010 /nfs/dbraw/zinc/84/50/10/1431845010.db2.gz IYRHYBIYJWSOBN-UHFFFAOYSA-N 0 0 382.420 3.033 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2cccc(CN3CCOCC3)n2)cc1[N+](=O)[O-] ZINC000188097714 1431846315 /nfs/dbraw/zinc/84/63/15/1431846315.db2.gz LRYZFEUHIYFGIX-UHFFFAOYSA-N 0 0 384.436 3.198 20 5 GGBDRN CCCCNC(=O)[C@H]1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000188100400 1431846480 /nfs/dbraw/zinc/84/64/80/1431846480.db2.gz HUMHLZOYBNKBBB-ZDUSSCGKSA-N 0 0 379.482 3.085 20 5 GGBDRN Cc1nc(CN2CCN(C(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)oc1C ZINC000188122854 1431849626 /nfs/dbraw/zinc/84/96/26/1431849626.db2.gz NEQLCFYWNVCVFX-UHFFFAOYSA-N 0 0 386.452 3.281 20 5 GGBDRN CC(C)c1ccc(C(=O)NC2CCN(C(=O)c3ccncc3)CC2)cc1[N+](=O)[O-] ZINC000188121978 1431849647 /nfs/dbraw/zinc/84/96/47/1431849647.db2.gz MBRFKYUPVFPEMJ-UHFFFAOYSA-N 0 0 396.447 3.148 20 5 GGBDRN CSc1cccc(C(=O)N2CCCN(Cc3cscn3)CC2)c1[N+](=O)[O-] ZINC000188122134 1431849648 /nfs/dbraw/zinc/84/96/48/1431849648.db2.gz MSNYJUURDNADDA-UHFFFAOYSA-N 0 0 392.506 3.121 20 5 GGBDRN O=c1cc(-c2nc(COc3cccc(F)c3)no2)c2cc([N+](=O)[O-])ccc2[nH]1 ZINC000188123003 1431849770 /nfs/dbraw/zinc/84/97/70/1431849770.db2.gz HJHFGZNPESMOSF-UHFFFAOYSA-N 0 0 382.307 3.204 20 5 GGBDRN CSc1cccc(C(=O)NCCCC(=O)N2CCc3ccccc32)c1[N+](=O)[O-] ZINC000188156902 1431854032 /nfs/dbraw/zinc/85/40/32/1431854032.db2.gz VOJJQKCARUYMGP-UHFFFAOYSA-N 0 0 399.472 3.416 20 5 GGBDRN CSc1cccc(C(=O)NCCCC(=O)N2Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000188156324 1431854053 /nfs/dbraw/zinc/85/40/53/1431854053.db2.gz ROXYYVVBUUQSSR-UHFFFAOYSA-N 0 0 399.472 3.369 20 5 GGBDRN CCCOc1ccc(CNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000188164908 1431855174 /nfs/dbraw/zinc/85/51/74/1431855174.db2.gz JCTOQKXMPGRICN-UHFFFAOYSA-N 0 0 385.420 3.255 20 5 GGBDRN CSc1cccc(C(=O)N2CCN([C@@H](C)c3cccnc3)CC2)c1[N+](=O)[O-] ZINC000188163488 1431855198 /nfs/dbraw/zinc/85/51/98/1431855198.db2.gz HCMGGBOCIBDVLQ-AWEZNQCLSA-N 0 0 386.477 3.231 20 5 GGBDRN CSc1cccc(C(=O)NCCc2nnc(-c3ccccc3)o2)c1[N+](=O)[O-] ZINC000188182493 1431857776 /nfs/dbraw/zinc/85/77/76/1431857776.db2.gz MMUWCCDHRVXVRY-UHFFFAOYSA-N 0 0 384.417 3.339 20 5 GGBDRN CCc1ccccc1Cn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O ZINC000188186573 1431858240 /nfs/dbraw/zinc/85/82/40/1431858240.db2.gz TVAPOASGAKZBOV-UHFFFAOYSA-N 0 0 375.388 3.101 20 5 GGBDRN COCCNc1ccccc1CNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000188189019 1431858505 /nfs/dbraw/zinc/85/85/05/1431858505.db2.gz VEXJZVLMZISVDV-UHFFFAOYSA-N 0 0 375.450 3.305 20 5 GGBDRN COC(=O)C[C@@](C)(NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccccn1 ZINC000188253347 1431865862 /nfs/dbraw/zinc/86/58/62/1431865862.db2.gz OGZRUWUGXZJQEJ-HXUWFJFHSA-N 0 0 385.420 3.322 20 5 GGBDRN COc1cc(CCNC(=O)NC2(Cc3ccccc3)CC2)c([N+](=O)[O-])cc1OC ZINC000188257658 1431866337 /nfs/dbraw/zinc/86/63/37/1431866337.db2.gz VRZWCACMPUNPAR-UHFFFAOYSA-N 0 0 399.447 3.229 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000188296708 1431870711 /nfs/dbraw/zinc/87/07/11/1431870711.db2.gz PAOIRNBUJWMFMZ-KRWDZBQOSA-N 0 0 393.346 3.487 20 5 GGBDRN COCc1cccc(CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000188319388 1431872558 /nfs/dbraw/zinc/87/25/58/1431872558.db2.gz AWXWGIVCWAYZNU-UHFFFAOYSA-N 0 0 384.432 3.354 20 5 GGBDRN Cc1c(-c2nc(COc3ccccc3F)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000188331165 1431874100 /nfs/dbraw/zinc/87/41/00/1431874100.db2.gz YQSQYHQDNKIGDB-UHFFFAOYSA-N 0 0 396.338 3.252 20 5 GGBDRN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000188331558 1431874149 /nfs/dbraw/zinc/87/41/49/1431874149.db2.gz AFTGQBNRDXZCPG-OAHLLOKOSA-N 0 0 389.477 3.328 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000188367137 1431877555 /nfs/dbraw/zinc/87/75/55/1431877555.db2.gz ICOAHLMKTKIMAD-AWEZNQCLSA-N 0 0 398.868 3.126 20 5 GGBDRN Cc1cccc(N(C)CCCOc2cccc(S(C)(=O)=O)c2)c1[N+](=O)[O-] ZINC000188371168 1431878074 /nfs/dbraw/zinc/87/80/74/1431878074.db2.gz PWFKDKISWQQIEP-UHFFFAOYSA-N 0 0 378.450 3.212 20 5 GGBDRN O=C(N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1(Cc2ccccc2F)CC1 ZINC000188428546 1431883452 /nfs/dbraw/zinc/88/34/52/1431883452.db2.gz WFSRKHQLLIHXIE-OAHLLOKOSA-N 0 0 384.411 3.165 20 5 GGBDRN Cc1nc2cc(F)ccc2cc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188451959 1431885031 /nfs/dbraw/zinc/88/50/31/1431885031.db2.gz CPXXPHBQJRTLCD-UHFFFAOYSA-N 0 0 381.363 3.494 20 5 GGBDRN Cc1c(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cnn1-c1ccc(F)cc1 ZINC000188454314 1431885277 /nfs/dbraw/zinc/88/52/77/1431885277.db2.gz SXVOYHLSMOCKPP-UHFFFAOYSA-N 0 0 396.378 3.131 20 5 GGBDRN CCOc1ccc2cc(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)[nH]c2c1 ZINC000188460627 1431885964 /nfs/dbraw/zinc/88/59/64/1431885964.db2.gz VTLUNUKXNUFBAI-UHFFFAOYSA-N 0 0 381.388 3.378 20 5 GGBDRN O=C(Cc1ccccc1OC(F)F)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188471867 1431887002 /nfs/dbraw/zinc/88/70/02/1431887002.db2.gz BSDSQBIFGHDRLP-UHFFFAOYSA-N 0 0 378.331 3.029 20 5 GGBDRN CC(C)(C)n1nc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cc1C1CC1 ZINC000188477731 1431887679 /nfs/dbraw/zinc/88/76/79/1431887679.db2.gz RSZKZFNBRHXNJB-UHFFFAOYSA-N 0 0 384.436 3.327 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@H]3OCCC[C@H]23)cc1[N+](=O)[O-])c1ccccn1 ZINC000188485181 1431888375 /nfs/dbraw/zinc/88/83/75/1431888375.db2.gz VERPFGFRPOSWRA-ASCUOWJESA-N 0 0 396.447 3.460 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@H](OC1CCOCC1)c1ccccc1 ZINC000188488348 1431888541 /nfs/dbraw/zinc/88/85/41/1431888541.db2.gz GTPQYEJCCJUVBI-VLIAUNLRSA-N 0 0 399.447 3.232 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@H](OC1CCOCC1)c1ccccc1 ZINC000188488327 1431888614 /nfs/dbraw/zinc/88/86/14/1431888614.db2.gz GTPQYEJCCJUVBI-XOBRGWDASA-N 0 0 399.447 3.232 20 5 GGBDRN CC(=O)Nc1cccc(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1C ZINC000188493406 1431889061 /nfs/dbraw/zinc/88/90/61/1431889061.db2.gz QCPFIWOHCNYZSH-UHFFFAOYSA-N 0 0 384.436 3.402 20 5 GGBDRN O=C(Nc1ccc2scnc2c1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000188499824 1431889425 /nfs/dbraw/zinc/88/94/25/1431889425.db2.gz GCDFFRKANLLXIJ-UHFFFAOYSA-N 0 0 396.428 3.334 20 5 GGBDRN Cc1cc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)nn1-c1ccc(F)cc1 ZINC000188502692 1431889702 /nfs/dbraw/zinc/88/97/02/1431889702.db2.gz DXRNTTVECIQJSH-UHFFFAOYSA-N 0 0 396.378 3.131 20 5 GGBDRN C[C@@H](NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)c1nc2ccccc2[nH]1 ZINC000188507101 1431890131 /nfs/dbraw/zinc/89/01/31/1431890131.db2.gz JKRYCPAYGQWQPF-GFCCVEGCSA-N 0 0 381.392 3.005 20 5 GGBDRN O=C(CCCc1nc2ccccc2[nH]1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188512295 1431890633 /nfs/dbraw/zinc/89/06/33/1431890633.db2.gz SQYVBVDIUJTNGO-UHFFFAOYSA-N 0 0 380.404 3.084 20 5 GGBDRN Cc1ccc2[nH]c([C@H]3CCCN(C(=O)c4cc([N+](=O)[O-])ccc4N)C3)nc2c1 ZINC000188516582 1431890992 /nfs/dbraw/zinc/89/09/92/1431890992.db2.gz HPINSGUTVAHHBL-ZDUSSCGKSA-N 0 0 379.420 3.382 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)cc([N+](=O)[O-])c1C ZINC000188517487 1431891219 /nfs/dbraw/zinc/89/12/19/1431891219.db2.gz CIXGLBZIYDATLZ-UHFFFAOYSA-N 0 0 381.392 3.362 20 5 GGBDRN O=C(Cc1ccc(OC(F)F)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188517147 1431891234 /nfs/dbraw/zinc/89/12/34/1431891234.db2.gz GMGOYKJHGQOWJX-UHFFFAOYSA-N 0 0 378.331 3.029 20 5 GGBDRN Cc1ccc(C2(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)CCOCC2)cc1 ZINC000188542990 1431893763 /nfs/dbraw/zinc/89/37/63/1431893763.db2.gz JAUITMSBQUJNHK-UHFFFAOYSA-N 0 0 396.443 3.241 20 5 GGBDRN O=C(NCc1ccccc1OC(F)F)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188547695 1431894172 /nfs/dbraw/zinc/89/41/72/1431894172.db2.gz HEHAMLSIOWTMRY-UHFFFAOYSA-N 0 0 393.346 3.169 20 5 GGBDRN CC1=NN(c2ccc(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)cc2)CC1 ZINC000188554836 1431894738 /nfs/dbraw/zinc/89/47/38/1431894738.db2.gz NRAPKIRLAKIUTD-UHFFFAOYSA-N 0 0 380.404 3.084 20 5 GGBDRN Cc1c(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cnn1Cc1ccccc1 ZINC000188576285 1431896645 /nfs/dbraw/zinc/89/66/45/1431896645.db2.gz IGUIGAFHHRKRJK-UHFFFAOYSA-N 0 0 392.415 3.051 20 5 GGBDRN Cc1nc(C(F)(F)F)ccc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188583547 1431897175 /nfs/dbraw/zinc/89/71/75/1431897175.db2.gz BWBFETZQOHOMAD-UHFFFAOYSA-N 0 0 381.310 3.220 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188583311 1431897230 /nfs/dbraw/zinc/89/72/30/1431897230.db2.gz AVRUFYKZJQOIBZ-UHFFFAOYSA-N 0 0 392.415 3.301 20 5 GGBDRN CCOCc1ccccc1CNC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188609666 1431899787 /nfs/dbraw/zinc/89/97/87/1431899787.db2.gz FRUYBUMMQLGJBD-UHFFFAOYSA-N 0 0 385.420 3.104 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000188618445 1431904011 /nfs/dbraw/zinc/90/40/11/1431904011.db2.gz KPBXUKBRJHZJKJ-LJQANCHMSA-N 0 0 389.402 3.496 20 5 GGBDRN O=C(CCOCC(F)(F)C(F)F)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000188705905 1431940046 /nfs/dbraw/zinc/94/00/46/1431940046.db2.gz JMZXQQICWOJOFG-UHFFFAOYSA-N 0 0 390.236 3.442 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)c1cnn(C(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000188762336 1431963946 /nfs/dbraw/zinc/96/39/46/1431963946.db2.gz SSJGJUHQFXZVGM-INIZCTEOSA-N 0 0 388.424 3.185 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1cnn(C(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000188762359 1431964543 /nfs/dbraw/zinc/96/45/43/1431964543.db2.gz SSJGJUHQFXZVGM-MRXNPFEDSA-N 0 0 388.424 3.185 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c1 ZINC000188790587 1431976019 /nfs/dbraw/zinc/97/60/19/1431976019.db2.gz YVYZCDLDMPCYRJ-UHFFFAOYSA-N 0 0 383.404 3.304 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(N3CCC(C)CC3)nc2)cc([N+](=O)[O-])c1C ZINC000188823801 1431990305 /nfs/dbraw/zinc/99/03/05/1431990305.db2.gz LMAMTMQZQDHCID-UHFFFAOYSA-N 0 0 398.463 3.473 20 5 GGBDRN CCSCC[C@@H](C)N(C)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000188923112 1432009786 /nfs/dbraw/zinc/00/97/86/1432009786.db2.gz TYWZDMMKICVAHK-CQSZACIVSA-N 0 0 381.498 3.035 20 5 GGBDRN Cc1sc2ncn(NC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)c(=O)c2c1C ZINC000188938261 1432012713 /nfs/dbraw/zinc/01/27/13/1432012713.db2.gz VQZIOMVZYUJAAH-UHFFFAOYSA-N 0 0 386.433 3.490 20 5 GGBDRN CCc1cccc(Cn2cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c2=O)c1 ZINC000188953763 1432015547 /nfs/dbraw/zinc/01/55/47/1432015547.db2.gz NSIOSXSRRBZZPX-UHFFFAOYSA-N 0 0 375.388 3.101 20 5 GGBDRN Cn1cc(CCC(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])cn1 ZINC000188968872 1432018490 /nfs/dbraw/zinc/01/84/90/1432018490.db2.gz RBWMLTGCAJBSTJ-UHFFFAOYSA-N 0 0 380.404 3.479 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccccc2NS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000188970932 1432019496 /nfs/dbraw/zinc/01/94/96/1432019496.db2.gz OKOZLZLILUSCDW-UHFFFAOYSA-N 0 0 377.422 3.342 20 5 GGBDRN Cn1ccc(C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])cc1=O ZINC000188976727 1432020221 /nfs/dbraw/zinc/02/02/21/1432020221.db2.gz ZABMYFJIFGJCOH-UHFFFAOYSA-N 0 0 379.372 3.125 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CCOCC(F)(F)C(F)(F)F ZINC000188985728 1432022111 /nfs/dbraw/zinc/02/21/11/1432022111.db2.gz UKIQBNGEPZKNSM-UHFFFAOYSA-N 0 0 393.268 3.033 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)CCCNc2ccc([N+](=O)[O-])cc2)n1 ZINC000189038813 1432032202 /nfs/dbraw/zinc/03/22/02/1432032202.db2.gz XRLSTEKYNMVBNW-MRXNPFEDSA-N 0 0 390.465 3.152 20 5 GGBDRN C[C@H](CN(C)C(=O)c1cc([N+](=O)[O-])cnc1N)Oc1ccc(Cl)c(Cl)c1 ZINC000189054799 1432035901 /nfs/dbraw/zinc/03/59/01/1432035901.db2.gz TWLGFZGLBFGKAW-SECBINFHSA-N 0 0 399.234 3.418 20 5 GGBDRN COc1ccc(CC(C)(C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000189064824 1432038429 /nfs/dbraw/zinc/03/84/29/1432038429.db2.gz RLTZUANVFMAPFL-UHFFFAOYSA-N 0 0 395.415 3.196 20 5 GGBDRN Cc1cc(C(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)nc(C(F)(F)F)n1 ZINC000189067575 1432038854 /nfs/dbraw/zinc/03/88/54/1432038854.db2.gz SDTHDUBLRXAUIU-UHFFFAOYSA-N 0 0 384.314 3.135 20 5 GGBDRN CCN(C(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)[C@@H](C)c1cccc(O)c1 ZINC000189096501 1432044297 /nfs/dbraw/zinc/04/42/97/1432044297.db2.gz CBVBOOQKAAAQTE-AWEZNQCLSA-N 0 0 385.420 3.465 20 5 GGBDRN CCSc1cc(CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)ccn1 ZINC000189102526 1432045734 /nfs/dbraw/zinc/04/57/34/1432045734.db2.gz FAVIYGUXWRPTMO-UHFFFAOYSA-N 0 0 383.433 3.218 20 5 GGBDRN CO[C@H]1C[C@H](c2nc(C)no2)N(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000189116650 1432047900 /nfs/dbraw/zinc/04/79/00/1432047900.db2.gz PJTCMWQNWFNZMG-XJKSGUPXSA-N 0 0 388.424 3.186 20 5 GGBDRN CCOC(=O)[C@@](C)(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000189155687 1432053825 /nfs/dbraw/zinc/05/38/25/1432053825.db2.gz WWOMKKQAGZJBAZ-IBGZPJMESA-N 0 0 390.823 3.499 20 5 GGBDRN CCOC(=O)[C@](C)(CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000189157951 1432054301 /nfs/dbraw/zinc/05/43/01/1432054301.db2.gz VHKPYBYGLMYCMV-LJQANCHMSA-N 0 0 390.823 3.499 20 5 GGBDRN CCOC(=O)c1c(C)oc2nc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)nc(N)c21 ZINC000189159351 1432054756 /nfs/dbraw/zinc/05/47/56/1432054756.db2.gz CUJDNRROQMQCCI-SNVBAGLBSA-N 0 0 399.407 3.049 20 5 GGBDRN CCOC(=O)[C@@H](CC)N(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C1CC1 ZINC000189183356 1432059751 /nfs/dbraw/zinc/05/97/51/1432059751.db2.gz CVQUVMKVPLFTEY-MRXNPFEDSA-N 0 0 375.425 3.115 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(N3CCC(O)CC3)cc2)cc([N+](=O)[O-])c1C ZINC000189195380 1432061266 /nfs/dbraw/zinc/06/12/66/1432061266.db2.gz LMDJKZYAXJWYLW-UHFFFAOYSA-N 0 0 385.420 3.125 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccc(Cl)cc1F ZINC000189198532 1432061657 /nfs/dbraw/zinc/06/16/57/1432061657.db2.gz BEBDNOQITVDOJL-UHFFFAOYSA-N 0 0 379.775 3.259 20 5 GGBDRN CCOC(=O)[C@@H](CC)N(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000189227029 1432067048 /nfs/dbraw/zinc/06/70/48/1432067048.db2.gz ILLXWBUZLPAYEF-MRXNPFEDSA-N 0 0 389.452 3.141 20 5 GGBDRN Cc1csc([C@H]2COCCN2CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000189256285 1432072484 /nfs/dbraw/zinc/07/24/84/1432072484.db2.gz XKHVTXWXEPGHTC-MRXNPFEDSA-N 0 0 390.465 3.070 20 5 GGBDRN C[C@@H](CCNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])CC(C)(C)C ZINC000189257619 1432072541 /nfs/dbraw/zinc/07/25/41/1432072541.db2.gz UUKKNVWZDNRTOA-LBPRGKRZSA-N 0 0 381.498 3.364 20 5 GGBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000189265060 1432074238 /nfs/dbraw/zinc/07/42/38/1432074238.db2.gz KLJVTSBPFRDYME-AWEZNQCLSA-N 0 0 382.351 3.173 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000189296978 1432080698 /nfs/dbraw/zinc/08/06/98/1432080698.db2.gz ZGSCCDGOPGNDSU-UHFFFAOYSA-N 0 0 396.369 3.147 20 5 GGBDRN COCC(=O)N1CCc2cc(NCc3ccc([N+](=O)[O-])cc3Cl)ccc21 ZINC000189297259 1432081117 /nfs/dbraw/zinc/08/11/17/1432081117.db2.gz OAKJPCLQXNGOSQ-UHFFFAOYSA-N 0 0 375.812 3.396 20 5 GGBDRN C[C@@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000189302465 1432081879 /nfs/dbraw/zinc/08/18/79/1432081879.db2.gz FGXJKLWVHSWUPL-LLVKDONJSA-N 0 0 391.365 3.228 20 5 GGBDRN C[C@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000189302439 1432081909 /nfs/dbraw/zinc/08/19/09/1432081909.db2.gz FGXJKLWVHSWUPL-NSHDSACASA-N 0 0 391.365 3.228 20 5 GGBDRN CSc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000189305548 1432082488 /nfs/dbraw/zinc/08/24/88/1432082488.db2.gz AANJGZMMFCHENS-UHFFFAOYSA-N 0 0 391.415 3.321 20 5 GGBDRN CCN(C[C@H](O)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000189325520 1432086532 /nfs/dbraw/zinc/08/65/32/1432086532.db2.gz UOJAZUHTTFOARO-JTQLQIEISA-N 0 0 389.252 3.391 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1 ZINC000189335182 1432088404 /nfs/dbraw/zinc/08/84/04/1432088404.db2.gz RTLFCMFDZMCEHJ-UHFFFAOYSA-N 0 0 386.383 3.220 20 5 GGBDRN CCOC(=O)[C@H](C)N(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CC1 ZINC000189358062 1432092749 /nfs/dbraw/zinc/09/27/49/1432092749.db2.gz LNUPEOFMUVUAAA-HNNXBMFYSA-N 0 0 392.455 3.097 20 5 GGBDRN COC(=O)c1cnc(N[C@@H](C)Cc2cc(C)nn2-c2ccccc2)c([N+](=O)[O-])c1 ZINC000189363040 1432093601 /nfs/dbraw/zinc/09/36/01/1432093601.db2.gz IUFSHZCCIMVVOE-ZDUSSCGKSA-N 0 0 395.419 3.314 20 5 GGBDRN CC(C)(C)c1csc(CNC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000189372515 1432095037 /nfs/dbraw/zinc/09/50/37/1432095037.db2.gz CUVNLABPKVGOSJ-UHFFFAOYSA-N 0 0 390.465 3.322 20 5 GGBDRN COCCc1ccccc1NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000189405803 1432099638 /nfs/dbraw/zinc/09/96/38/1432099638.db2.gz XUMJBRHUYNPUBL-UHFFFAOYSA-N 0 0 384.436 3.138 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000189404369 1432099753 /nfs/dbraw/zinc/09/97/53/1432099753.db2.gz CMCYQZDKOZBEGJ-NSHDSACASA-N 0 0 377.347 3.464 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCSC[C@@H]2c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000189465738 1432122191 /nfs/dbraw/zinc/12/21/91/1432122191.db2.gz WMNDXMVWOSLUTR-CXAGYDPISA-N 0 0 389.481 3.197 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000189465726 1432122264 /nfs/dbraw/zinc/12/22/64/1432122264.db2.gz QLXKEOJTCLKRFQ-GOSISDBHSA-N 0 0 381.432 3.335 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1OC[C@@H]1CCCCO1 ZINC000189469538 1432123321 /nfs/dbraw/zinc/12/33/21/1432123321.db2.gz XLWAEJMLUWPQNQ-AWEZNQCLSA-N 0 0 394.815 3.031 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000189477507 1432127055 /nfs/dbraw/zinc/12/70/55/1432127055.db2.gz WWMDTIWPUDHUON-HXUWFJFHSA-N 0 0 394.431 3.110 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000189496117 1432135022 /nfs/dbraw/zinc/13/50/22/1432135022.db2.gz FPWBKQVXAOINDZ-LJQANCHMSA-N 0 0 394.431 3.110 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000189498181 1432136072 /nfs/dbraw/zinc/13/60/72/1432136072.db2.gz XZAFRBJEGDBCES-INIZCTEOSA-N 0 0 395.337 3.410 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@H](C)[C@@H]3CO)cc2[N+](=O)[O-])n1 ZINC000189506943 1432139756 /nfs/dbraw/zinc/13/97/56/1432139756.db2.gz SSJJUHFLLPNNON-YGRLFVJLSA-N 0 0 393.490 3.354 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@H](C)[C@H]3CO)cc2[N+](=O)[O-])n1 ZINC000189506964 1432140082 /nfs/dbraw/zinc/14/00/82/1432140082.db2.gz SSJJUHFLLPNNON-IINYFYTJSA-N 0 0 393.490 3.354 20 5 GGBDRN COc1cc(C(=O)N2CCN(Cc3cccc(F)c3)CC2)cc([N+](=O)[O-])c1C ZINC000189507700 1432140742 /nfs/dbraw/zinc/14/07/42/1432140742.db2.gz FVYFTWZLCXZHHY-UHFFFAOYSA-N 0 0 387.411 3.009 20 5 GGBDRN COCCc1ccccc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000189535604 1432152020 /nfs/dbraw/zinc/15/20/20/1432152020.db2.gz ZYRXAYIGZZYBAN-UHFFFAOYSA-N 0 0 384.436 3.138 20 5 GGBDRN O=C(N[C@@H]1CCOc2ccc(F)cc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000189539165 1432153814 /nfs/dbraw/zinc/15/38/14/1432153814.db2.gz PIFZWKMJSCAJKW-QGZVFWFLSA-N 0 0 387.367 3.030 20 5 GGBDRN CCc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)N(C)C)cc1 ZINC000189574680 1432164677 /nfs/dbraw/zinc/16/46/77/1432164677.db2.gz PXLSUGQKWBFRLN-GOSISDBHSA-N 0 0 391.493 3.276 20 5 GGBDRN O=C(N[C@@H]1CC[C@H](Cc2ccccc2)C1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000189584386 1432167725 /nfs/dbraw/zinc/16/77/25/1432167725.db2.gz UXFXHNRTTTWARZ-SJLPKXTDSA-N 0 0 391.431 3.317 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000189594930 1432170183 /nfs/dbraw/zinc/17/01/83/1432170183.db2.gz SSLMUUBSPFEUCA-VBKZILBWSA-N 0 0 385.420 3.086 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189599453 1432171519 /nfs/dbraw/zinc/17/15/19/1432171519.db2.gz HKUGTCISCFOQME-HNNXBMFYSA-N 0 0 375.469 3.487 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(-n3cccn3)cc2C)c([N+](=O)[O-])cc1OC ZINC000189622956 1432181854 /nfs/dbraw/zinc/18/18/54/1432181854.db2.gz NVOPYTGJXVCQEV-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN C[C@@H](O)[C@](C)(CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000189647858 1432189472 /nfs/dbraw/zinc/18/94/72/1432189472.db2.gz QGTKMWZWJYXUOD-KUHUBIRLSA-N 0 0 392.477 3.040 20 5 GGBDRN C[C@H](O)[C@@](C)(CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000189647435 1432189682 /nfs/dbraw/zinc/18/96/82/1432189682.db2.gz HMKRWJKWCIJWIE-YVEFUNNKSA-N 0 0 398.506 3.102 20 5 GGBDRN Cc1nn(C)c(C(=O)NC(C)(C)c2ccc(OC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000189652185 1432191769 /nfs/dbraw/zinc/19/17/69/1432191769.db2.gz NHLXKUMRMXAEDU-UHFFFAOYSA-N 0 0 386.330 3.200 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)cc([N+](=O)[O-])c1C ZINC000189655765 1432192841 /nfs/dbraw/zinc/19/28/41/1432192841.db2.gz YKTHGZTUFIJTHN-KRWDZBQOSA-N 0 0 386.448 3.444 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)c[nH]2)c1[N+](=O)[O-] ZINC000189697504 1432207453 /nfs/dbraw/zinc/20/74/53/1432207453.db2.gz DMVRHNMPIAEERU-MRXNPFEDSA-N 0 0 394.435 3.394 20 5 GGBDRN Cc1ccc([C@H](C)NS(=O)(=O)CCc2ccc3c(c2)CCO3)cc1[N+](=O)[O-] ZINC000189698160 1432207487 /nfs/dbraw/zinc/20/74/87/1432207487.db2.gz YEPYVTQVFFPMCR-AWEZNQCLSA-N 0 0 390.461 3.061 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000189718422 1432213271 /nfs/dbraw/zinc/21/32/71/1432213271.db2.gz VJJGEHGZESWKET-BTYIYWSLSA-N 0 0 399.447 3.394 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000189718459 1432213373 /nfs/dbraw/zinc/21/33/73/1432213373.db2.gz VJJGEHGZESWKET-YCRPNKLZSA-N 0 0 399.447 3.394 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccc(CC(F)(F)F)cc1)CC2 ZINC000189818592 1432244343 /nfs/dbraw/zinc/24/43/43/1432244343.db2.gz KLXGQPQROBZHPM-UHFFFAOYSA-N 0 0 386.351 3.451 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000189829408 1432246840 /nfs/dbraw/zinc/24/68/40/1432246840.db2.gz RFJJZZXYEKGTLB-MRXNPFEDSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1cc(-n2cccn2)ccc1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000189829025 1432247008 /nfs/dbraw/zinc/24/70/08/1432247008.db2.gz JEPLPKCPGMSTEM-IBGZPJMESA-N 0 0 377.404 3.306 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1ccc(Cl)c(F)c1 ZINC000189834726 1432249098 /nfs/dbraw/zinc/24/90/98/1432249098.db2.gz YHGAPQCVBCVQPK-UHFFFAOYSA-N 0 0 399.769 3.331 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ccc(Cl)c(F)c2)C1=O ZINC000189835552 1432249135 /nfs/dbraw/zinc/24/91/35/1432249135.db2.gz LHJGAEBNPZMMMC-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)cc([N+](=O)[O-])c1C ZINC000189836879 1432249627 /nfs/dbraw/zinc/24/96/27/1432249627.db2.gz VYBFUDSCPXVMKR-GFCCVEGCSA-N 0 0 396.403 3.495 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H](Cc2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC000189848112 1432252222 /nfs/dbraw/zinc/25/22/22/1432252222.db2.gz PIJOHNBZTCECAP-KRWDZBQOSA-N 0 0 383.448 3.473 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H](Cc2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC000189848093 1432252432 /nfs/dbraw/zinc/25/24/32/1432252432.db2.gz PIJOHNBZTCECAP-QGZVFWFLSA-N 0 0 383.448 3.473 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c2cccc(Cl)c2O1 ZINC000189855948 1432254852 /nfs/dbraw/zinc/25/48/52/1432254852.db2.gz LOCQZMHQTXTWQP-LLVKDONJSA-N 0 0 399.794 3.257 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)NCc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000189859445 1432255763 /nfs/dbraw/zinc/25/57/63/1432255763.db2.gz ZMCHUIUUNYJIQH-UHFFFAOYSA-N 0 0 381.392 3.170 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCCN(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000189875789 1432259637 /nfs/dbraw/zinc/25/96/37/1432259637.db2.gz DGMFDFODWFYQSB-UHFFFAOYSA-N 0 0 389.477 3.113 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1 ZINC000189879823 1432260874 /nfs/dbraw/zinc/26/08/74/1432260874.db2.gz MLQLWHQXELRIQU-UHFFFAOYSA-N 0 0 397.840 3.316 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@H]2CCN(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000189881176 1432261079 /nfs/dbraw/zinc/26/10/79/1432261079.db2.gz SCRKPVPVMJUSCE-MRXNPFEDSA-N 0 0 389.477 3.016 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(Cc2ccco2)C[C@H]2CCCO2)c1[N+](=O)[O-] ZINC000189883313 1432262433 /nfs/dbraw/zinc/26/24/33/1432262433.db2.gz YCTHICNSLYLDDR-MRXNPFEDSA-N 0 0 394.449 3.175 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H](COCc2ccccc2)C1 ZINC000189889875 1432264642 /nfs/dbraw/zinc/26/46/42/1432264642.db2.gz OGFVUFKNMORDHA-INIZCTEOSA-N 0 0 390.461 3.041 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)CC2 ZINC000189895343 1432266195 /nfs/dbraw/zinc/26/61/95/1432266195.db2.gz IXQIXFIZNJQJSN-QZTJIDSGSA-N 0 0 376.453 3.110 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1cnn([C@@H](C)C2CC2)c1 ZINC000189920501 1432274016 /nfs/dbraw/zinc/27/40/16/1432274016.db2.gz QHNSNLYQNAVULN-AWEZNQCLSA-N 0 0 399.451 3.138 20 5 GGBDRN CCN(c1ccccc1)S(=O)(=O)c1ccc(NC[C@H](C)OC)c([N+](=O)[O-])c1 ZINC000189927443 1432277211 /nfs/dbraw/zinc/27/72/11/1432277211.db2.gz SBFIGNVPMUVANT-AWEZNQCLSA-N 0 0 393.465 3.257 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CC[C@@H](Nc3ccccc3)C2)c1[N+](=O)[O-] ZINC000189935888 1432280404 /nfs/dbraw/zinc/28/04/04/1432280404.db2.gz AUENTIBCCWVFNP-MRXNPFEDSA-N 0 0 375.450 3.087 20 5 GGBDRN CCCOc1cccc(CCNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c1 ZINC000189957194 1432288816 /nfs/dbraw/zinc/28/88/16/1432288816.db2.gz WRZGOTGHNUBSDO-UHFFFAOYSA-N 0 0 378.450 3.442 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2OCCn2ccnc2)cc([N+](=O)[O-])c1C ZINC000189959068 1432289334 /nfs/dbraw/zinc/28/93/34/1432289334.db2.gz WPGVHUFJCBLXHC-UHFFFAOYSA-N 0 0 396.403 3.440 20 5 GGBDRN CN(CCc1ccncc1)c1ccc([N+](=O)[O-])c(N(C)CCc2ccncc2)n1 ZINC000189977116 1432295511 /nfs/dbraw/zinc/29/55/11/1432295511.db2.gz QEZRVWFPNOKRQF-UHFFFAOYSA-N 0 0 392.463 3.138 20 5 GGBDRN COc1cc(C(=O)N2CCN(CC(F)(F)F)CC2(C)C)cc([N+](=O)[O-])c1C ZINC000189995607 1432301168 /nfs/dbraw/zinc/30/11/68/1432301168.db2.gz MSUWEGUITFIPHT-UHFFFAOYSA-N 0 0 389.374 3.011 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(Cc1c(F)cccc1F)C1CC1 ZINC000189994144 1432301180 /nfs/dbraw/zinc/30/11/80/1432301180.db2.gz ADACENXBXLGSNG-UHFFFAOYSA-N 0 0 399.357 3.259 20 5 GGBDRN Cc1nn(CCC(=O)N(Cc2c(F)cccc2F)C2CC2)c(C)c1[N+](=O)[O-] ZINC000189997272 1432301676 /nfs/dbraw/zinc/30/16/76/1432301676.db2.gz SGORMTOQRSJFJL-UHFFFAOYSA-N 0 0 378.379 3.268 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H](CCCO)c2ccccc2)c1[N+](=O)[O-] ZINC000190003942 1432302971 /nfs/dbraw/zinc/30/29/71/1432302971.db2.gz QKTWKHFMWXFSFN-MRXNPFEDSA-N 0 0 378.450 3.004 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC[C@H]2CCCC2=O)cc1[N+](=O)[O-])c1ccccn1 ZINC000190006359 1432303479 /nfs/dbraw/zinc/30/34/79/1432303479.db2.gz UCVKIGDJYSBULY-UKRRQHHQSA-N 0 0 382.420 3.262 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCc2ccc(C(C)C)cc21 ZINC000190008974 1432304245 /nfs/dbraw/zinc/30/42/45/1432304245.db2.gz BITJNZCFICJSKE-QGZVFWFLSA-N 0 0 397.431 3.469 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc([N+](=O)[O-])c1C ZINC000190010515 1432304412 /nfs/dbraw/zinc/30/44/12/1432304412.db2.gz FENPPUYVLHHHKR-CRAIPNDOSA-N 0 0 392.358 3.450 20 5 GGBDRN CC(C)OC1CCC(NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000190015489 1432305428 /nfs/dbraw/zinc/30/54/28/1432305428.db2.gz KSCFYIBSGUIZMS-UHFFFAOYSA-N 0 0 377.441 3.104 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(Cc1c(F)cccc1F)C1CC1 ZINC000190016183 1432305763 /nfs/dbraw/zinc/30/57/63/1432305763.db2.gz TVSXAGXCQDKMIS-UHFFFAOYSA-N 0 0 376.315 3.407 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(Cc3cccc(O)c3)CC2)cc1[N+](=O)[O-] ZINC000190028910 1432307774 /nfs/dbraw/zinc/30/77/74/1432307774.db2.gz KNTGRVDGQUFLLV-UHFFFAOYSA-N 0 0 383.448 3.382 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cccc1[N+](=O)[O-] ZINC000190036866 1432308865 /nfs/dbraw/zinc/30/88/65/1432308865.db2.gz BJBVHXQXSYSHBY-UHFFFAOYSA-N 0 0 377.404 3.284 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cc([N+](=O)[O-])c1 ZINC000190052057 1432311670 /nfs/dbraw/zinc/31/16/70/1432311670.db2.gz SICQWQGYNNEXFS-UHFFFAOYSA-N 0 0 377.404 3.284 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)c1[N+](=O)[O-] ZINC000190072581 1432314650 /nfs/dbraw/zinc/31/46/50/1432314650.db2.gz GFNBYGJWISJAGU-NVXWUHKLSA-N 0 0 392.477 3.045 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NCc2csc(-c3ccco3)n2)c1[N+](=O)[O-] ZINC000190077318 1432315293 /nfs/dbraw/zinc/31/52/93/1432315293.db2.gz AHAJHRPFTZKWEI-UHFFFAOYSA-N 0 0 393.446 3.407 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000190080564 1432316317 /nfs/dbraw/zinc/31/63/17/1432316317.db2.gz VMOCMZJJYXQSLI-SWLSCSKDSA-N 0 0 376.438 3.204 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1 ZINC000190081254 1432316419 /nfs/dbraw/zinc/31/64/19/1432316419.db2.gz JWOXYUYKDVPNKL-UHFFFAOYSA-N 0 0 377.404 3.284 20 5 GGBDRN O=C(Nc1ccc(Cc2nnc3n2CCC3)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000190091188 1432318076 /nfs/dbraw/zinc/31/80/76/1432318076.db2.gz QRNZDCMNRPPNDO-UHFFFAOYSA-N 0 0 381.367 3.115 20 5 GGBDRN CCCOc1ccc(CNC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000190096207 1432318744 /nfs/dbraw/zinc/31/87/44/1432318744.db2.gz FMRFSEBKPNUERN-OAHLLOKOSA-N 0 0 399.447 3.127 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CCO)c1[N+](=O)[O-] ZINC000190106491 1432320793 /nfs/dbraw/zinc/32/07/93/1432320793.db2.gz YFDJDKXPUIOVKR-INIZCTEOSA-N 0 0 392.477 3.173 20 5 GGBDRN COc1cc(C(=O)NCc2cn(-c3ccccc3)nc2C)cc([N+](=O)[O-])c1C ZINC000190109976 1432321379 /nfs/dbraw/zinc/32/13/79/1432321379.db2.gz DQHHEWNQTLZZLS-UHFFFAOYSA-N 0 0 380.404 3.336 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000190111765 1432321736 /nfs/dbraw/zinc/32/17/36/1432321736.db2.gz TWRRZSUXJJUDMI-GJZGRUSLSA-N 0 0 378.816 3.115 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC[C@H]2[C@@H]2CCCCC2=O)c1[N+](=O)[O-] ZINC000190114502 1432322514 /nfs/dbraw/zinc/32/25/14/1432322514.db2.gz LSJNBDSCZHFLDA-GJZGRUSLSA-N 0 0 380.466 3.124 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(CC(C)(C)O)C3CC3)cc2[N+](=O)[O-])C1 ZINC000190117506 1432322910 /nfs/dbraw/zinc/32/29/10/1432322910.db2.gz SJZMJOFDPAQXOH-GJZGRUSLSA-N 0 0 389.496 3.453 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000190155466 1432329674 /nfs/dbraw/zinc/32/96/74/1432329674.db2.gz TYDZSISBNQDQTM-DLBZAZTESA-N 0 0 390.461 3.410 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CC[C@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC000190161485 1432330561 /nfs/dbraw/zinc/33/05/61/1432330561.db2.gz YWIWZIZFFQZKNF-LJQANCHMSA-N 0 0 388.445 3.032 20 5 GGBDRN COC(=O)c1cnc(NCc2ccc(COCC(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000190165951 1432331843 /nfs/dbraw/zinc/33/18/43/1432331843.db2.gz YLWNJUYMPSKHNG-UHFFFAOYSA-N 0 0 399.325 3.467 20 5 GGBDRN COC(=O)c1cnc(N(C)CCCc2cc(-c3ccccc3)n[nH]2)c([N+](=O)[O-])c1 ZINC000190168866 1432332418 /nfs/dbraw/zinc/33/24/18/1432332418.db2.gz ADQYEYDZYGIHJH-UHFFFAOYSA-N 0 0 395.419 3.236 20 5 GGBDRN COC(=O)c1cnc(NCc2ccccc2OCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000190169405 1432332573 /nfs/dbraw/zinc/33/25/73/1432332573.db2.gz IJSLIKVPOUEKBJ-UHFFFAOYSA-N 0 0 385.298 3.330 20 5 GGBDRN COC(=O)c1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c(N(C)C)c1 ZINC000190176374 1432334070 /nfs/dbraw/zinc/33/40/70/1432334070.db2.gz RHYNGWOHFSUDRV-UHFFFAOYSA-N 0 0 391.811 3.282 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCOc3c(F)cccc32)c1[N+](=O)[O-] ZINC000190184879 1432335786 /nfs/dbraw/zinc/33/57/86/1432335786.db2.gz FUMOOLGLXYMJEO-AWEZNQCLSA-N 0 0 380.397 3.153 20 5 GGBDRN COc1ccc(OCC(=O)N2CCC(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000190188592 1432336724 /nfs/dbraw/zinc/33/67/24/1432336724.db2.gz SANJWAHJOUOSII-UHFFFAOYSA-N 0 0 384.432 3.464 20 5 GGBDRN COc1ccccc1-c1nc(C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)no1 ZINC000190196292 1432338280 /nfs/dbraw/zinc/33/82/80/1432338280.db2.gz IORPBUGQWFTTKR-UHFFFAOYSA-N 0 0 398.375 3.266 20 5 GGBDRN CC1(C)CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@H]1C(F)(F)F ZINC000190196612 1432338546 /nfs/dbraw/zinc/33/85/46/1432338546.db2.gz WHRVMGRQVRLFNT-OAHLLOKOSA-N 0 0 385.386 3.394 20 5 GGBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000190207680 1432341200 /nfs/dbraw/zinc/34/12/00/1432341200.db2.gz AMWBCENOSAYCDD-QGZVFWFLSA-N 0 0 378.388 3.294 20 5 GGBDRN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000190215391 1432342660 /nfs/dbraw/zinc/34/26/60/1432342660.db2.gz GQAVRZBRLOSJBV-PXNSSMCTSA-N 0 0 392.415 3.288 20 5 GGBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000190229874 1432345245 /nfs/dbraw/zinc/34/52/45/1432345245.db2.gz HFFMMDGIISFNAA-OAHLLOKOSA-N 0 0 378.388 3.294 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000190237939 1432346872 /nfs/dbraw/zinc/34/68/72/1432346872.db2.gz UTMROKRSOXHALS-OXJNMPFZSA-N 0 0 397.431 3.288 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000190237906 1432346906 /nfs/dbraw/zinc/34/69/06/1432346906.db2.gz UTMROKRSOXHALS-OXQOHEQNSA-N 0 0 397.431 3.288 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])n1 ZINC000190242417 1432347574 /nfs/dbraw/zinc/34/75/74/1432347574.db2.gz MDSPNNAZWPNIQJ-HNNXBMFYSA-N 0 0 389.433 3.134 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)cc1[N+](=O)[O-] ZINC000190258931 1432350005 /nfs/dbraw/zinc/35/00/05/1432350005.db2.gz XCJOORAWJSJYIR-CRAIPNDOSA-N 0 0 385.464 3.334 20 5 GGBDRN O=C(NCCc1ccc(F)c(F)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000190268753 1432351291 /nfs/dbraw/zinc/35/12/91/1432351291.db2.gz NDTSCOKBAROPIS-UHFFFAOYSA-N 0 0 389.402 3.448 20 5 GGBDRN O=C(N[C@H]1CCOc2c(F)cccc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000190273580 1432352061 /nfs/dbraw/zinc/35/20/61/1432352061.db2.gz UAGVODALIBGPOG-KRWDZBQOSA-N 0 0 387.367 3.030 20 5 GGBDRN CCOc1cc(C(=O)NCCc2ccc(F)c(F)c2)c([N+](=O)[O-])cc1OC ZINC000190279180 1432352594 /nfs/dbraw/zinc/35/25/94/1432352594.db2.gz PRQSQJKIZCPXOZ-UHFFFAOYSA-N 0 0 380.347 3.253 20 5 GGBDRN O=C(N[C@H]1CCCc2c(O)cccc21)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000190281693 1432352818 /nfs/dbraw/zinc/35/28/18/1432352818.db2.gz GZFAGFWDISJQFB-INIZCTEOSA-N 0 0 378.388 3.294 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(Cc1c(F)cccc1F)C1CC1 ZINC000190287982 1432353941 /nfs/dbraw/zinc/35/39/41/1432353941.db2.gz UNXVLKJRTXYUNR-UHFFFAOYSA-N 0 0 382.388 3.367 20 5 GGBDRN COc1cc(C(=O)N2CCN([C@@H](C)c3ccsc3)CC2)cc([N+](=O)[O-])c1C ZINC000190293853 1432355283 /nfs/dbraw/zinc/35/52/83/1432355283.db2.gz NDPSHDJHRPLLGE-AWEZNQCLSA-N 0 0 389.477 3.492 20 5 GGBDRN CCCCOc1ccc(CNC(=O)Cn2cc([N+](=O)[O-])nc2C)cc1Cl ZINC000190301904 1432356334 /nfs/dbraw/zinc/35/63/34/1432356334.db2.gz HFMKSCRTCUPHCR-UHFFFAOYSA-N 0 0 380.832 3.248 20 5 GGBDRN CCc1ccc([C@@H]2CN(CC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])CCO2)cc1 ZINC000190306089 1432356540 /nfs/dbraw/zinc/35/65/40/1432356540.db2.gz HYYMQWZRYDXWFA-FQEVSTJZSA-N 0 0 399.447 3.178 20 5 GGBDRN Cc1ccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)c(-n2cc(Cl)cn2)n1 ZINC000190324059 1432361327 /nfs/dbraw/zinc/36/13/27/1432361327.db2.gz VBEBKJHGXKRRJW-UHFFFAOYSA-N 0 0 399.838 3.386 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC(C)(C(C)C)CC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000190332112 1432363350 /nfs/dbraw/zinc/36/33/50/1432363350.db2.gz CUUPZOUBWQDIIJ-UHFFFAOYSA-N 0 0 398.463 3.347 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(c3cncc4ccccc43)CC2)cc1[N+](=O)[O-] ZINC000190387877 1432371788 /nfs/dbraw/zinc/37/17/88/1432371788.db2.gz PWSDMXUXYJYVPU-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN Cc1ccc([C@H]2CSCCN2C(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000190397556 1432373519 /nfs/dbraw/zinc/37/35/19/1432373519.db2.gz LKBVRALHUJUASR-GOSISDBHSA-N 0 0 399.472 3.467 20 5 GGBDRN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N ZINC000190398988 1432373802 /nfs/dbraw/zinc/37/38/02/1432373802.db2.gz JPMUKKVMSCCQPZ-UHFFFAOYSA-N 0 0 382.420 3.410 20 5 GGBDRN CCc1ccc([C@H]2CN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)cc1 ZINC000190405162 1432374842 /nfs/dbraw/zinc/37/48/42/1432374842.db2.gz NCYUHGFNYKSOHN-QGZVFWFLSA-N 0 0 394.424 3.059 20 5 GGBDRN CCn1c(CCNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)nc2ccccc21 ZINC000190471611 1432388186 /nfs/dbraw/zinc/38/81/86/1432388186.db2.gz GGVBUWIMADWVHM-UHFFFAOYSA-N 0 0 382.420 3.254 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3cccs3)CC2)cc1[N+](=O)[O-] ZINC000190476671 1432388813 /nfs/dbraw/zinc/38/88/13/1432388813.db2.gz CWXFQQNKCQUCDP-UHFFFAOYSA-N 0 0 387.461 3.378 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)cc([N+](=O)[O-])c1C ZINC000190536433 1432400055 /nfs/dbraw/zinc/40/00/55/1432400055.db2.gz YTVXKLQNAROODW-SFHVURJKSA-N 0 0 392.358 3.404 20 5 GGBDRN COc1cc(C(=O)NC[C@H](c2ccco2)N2CCCCC2)cc([N+](=O)[O-])c1C ZINC000190574468 1432411063 /nfs/dbraw/zinc/41/10/63/1432411063.db2.gz ZIARARBDILLAFS-QGZVFWFLSA-N 0 0 387.436 3.462 20 5 GGBDRN CCCc1cnc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000190606670 1432418342 /nfs/dbraw/zinc/41/83/42/1432418342.db2.gz FBOHXUQJVCXWBL-NSHDSACASA-N 0 0 376.438 3.128 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@H]2C[C@H](O)C2(C)C)cc1[N+](=O)[O-])c1ccccn1 ZINC000190605774 1432418528 /nfs/dbraw/zinc/41/85/28/1432418528.db2.gz KWNOBKUODAYKIE-IGNZVWTISA-N 0 0 384.436 3.052 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@H](O)C2(C)C)cc1[N+](=O)[O-])c1ccccn1 ZINC000190605734 1432418600 /nfs/dbraw/zinc/41/86/00/1432418600.db2.gz KWNOBKUODAYKIE-RZAIGCCYSA-N 0 0 384.436 3.052 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ncc(C(C)C)s2)cc1[N+](=O)[O-] ZINC000190606729 1432418611 /nfs/dbraw/zinc/41/86/11/1432418611.db2.gz QQIJXRJTEYPRHM-NSHDSACASA-N 0 0 376.438 3.299 20 5 GGBDRN COc1cc(C(=O)NCC(=O)Nc2c(C)cc(C)cc2C)cc([N+](=O)[O-])c1C ZINC000190616909 1432421580 /nfs/dbraw/zinc/42/15/80/1432421580.db2.gz NRIUITHPCKRFNV-UHFFFAOYSA-N 0 0 385.420 3.206 20 5 GGBDRN Cc1ccccc1C[C@H](CO)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000190630168 1432425271 /nfs/dbraw/zinc/42/52/71/1432425271.db2.gz DBZCODKAOLUCLS-MRXNPFEDSA-N 0 0 397.456 3.360 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000190656852 1432432876 /nfs/dbraw/zinc/43/28/76/1432432876.db2.gz TWTLTVBTNHMONA-IBGZPJMESA-N 0 0 392.477 3.255 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000190658536 1432433770 /nfs/dbraw/zinc/43/37/70/1432433770.db2.gz PFIVJXRMZOFKAM-IBGZPJMESA-N 0 0 392.477 3.255 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)cc1[N+](=O)[O-] ZINC000190662212 1432434775 /nfs/dbraw/zinc/43/47/75/1432434775.db2.gz AIWJIBAKXDURFX-UHFFFAOYSA-N 0 0 399.422 3.456 20 5 GGBDRN CC[C@H]1CCCCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000190663570 1432435761 /nfs/dbraw/zinc/43/57/61/1432435761.db2.gz XRIUPZWTLGIBMM-NSHDSACASA-N 0 0 385.367 3.316 20 5 GGBDRN CCNC(=O)COc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000190663664 1432435815 /nfs/dbraw/zinc/43/58/15/1432435815.db2.gz QSWZELNWIMTUPO-UHFFFAOYSA-N 0 0 385.420 3.485 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Oc1ccc([C@@H]2CCOC2)cc1 ZINC000190664995 1432436887 /nfs/dbraw/zinc/43/68/87/1432436887.db2.gz GVUJETBCCWMDTC-MRXNPFEDSA-N 0 0 377.418 3.050 20 5 GGBDRN CC1(C)CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)CC[C@H]1C(F)(F)F ZINC000190670316 1432438614 /nfs/dbraw/zinc/43/86/14/1432438614.db2.gz OARICEJAVJBWNI-CQSZACIVSA-N 0 0 397.357 3.226 20 5 GGBDRN COc1cc(C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1C ZINC000190727189 1432457828 /nfs/dbraw/zinc/45/78/28/1432457828.db2.gz PASIJRLTACHNPO-BLLLJJGKSA-N 0 0 390.358 3.125 20 5 GGBDRN CC(C)c1cnc(NC(=O)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000190798253 1432484595 /nfs/dbraw/zinc/48/45/95/1432484595.db2.gz KVHNETZCHCFVOZ-UHFFFAOYSA-N 0 0 388.449 3.304 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N2CCC([C@H]3CCCO3)CC2)c([N+](=O)[O-])c1 ZINC000190823773 1432494648 /nfs/dbraw/zinc/49/46/48/1432494648.db2.gz NMAPBOBEFGOTAX-LJQANCHMSA-N 0 0 390.484 3.306 20 5 GGBDRN Cc1cc(-n2cccn2)ccc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000190858523 1432510340 /nfs/dbraw/zinc/51/03/40/1432510340.db2.gz LOSDTELZGNYLST-UHFFFAOYSA-N 0 0 377.404 3.090 20 5 GGBDRN CCc1ccc([C@@H]2CN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CCO2)cc1 ZINC000190897611 1432523402 /nfs/dbraw/zinc/52/34/02/1432523402.db2.gz AZOJMSZMGUSWGO-SFHVURJKSA-N 0 0 380.404 3.247 20 5 GGBDRN CCC[C@H]1CCCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000190903695 1432525234 /nfs/dbraw/zinc/52/52/34/1432525234.db2.gz LRRATXAWBXNIFP-NSHDSACASA-N 0 0 385.367 3.316 20 5 GGBDRN COc1cc(C(=O)Nc2cc(F)c(F)cc2NC(C)=O)cc([N+](=O)[O-])c1C ZINC000190952824 1432536611 /nfs/dbraw/zinc/53/66/11/1432536611.db2.gz HTMYBYFMSKVQMX-UHFFFAOYSA-N 0 0 379.319 3.401 20 5 GGBDRN C[C@H]1CCC[C@@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000190961011 1432538286 /nfs/dbraw/zinc/53/82/86/1432538286.db2.gz ZODJHYOFSISSQH-DOTOQJQBSA-N 0 0 388.468 3.031 20 5 GGBDRN C[C@@H]1CCC[C@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000190960962 1432538310 /nfs/dbraw/zinc/53/83/10/1432538310.db2.gz ZODJHYOFSISSQH-WBVHZDCISA-N 0 0 388.468 3.031 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CC3(CCCC3)OC(C)(C)C2)c([N+](=O)[O-])c1 ZINC000190973418 1432541156 /nfs/dbraw/zinc/54/11/56/1432541156.db2.gz UQMLNTAFWXYHDN-CQSZACIVSA-N 0 0 391.468 3.354 20 5 GGBDRN CCC1(CC)CCCN(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CC1 ZINC000190976452 1432541595 /nfs/dbraw/zinc/54/15/95/1432541595.db2.gz HHMQRTWWZWNDAJ-UHFFFAOYSA-N 0 0 382.482 3.431 20 5 GGBDRN CCn1c(SC[C@H]2CC3(CCC3)C(=O)O2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000191011432 1432549519 /nfs/dbraw/zinc/54/95/19/1432549519.db2.gz ISILRRAMLRCNDZ-CQSZACIVSA-N 0 0 388.449 3.451 20 5 GGBDRN Cc1ccc(C[C@@H](CO)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000191041366 1432555659 /nfs/dbraw/zinc/55/56/59/1432555659.db2.gz ZJHBHZBXXFVTPZ-INIZCTEOSA-N 0 0 397.456 3.360 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2ccc(C(F)(F)F)cc2C)cc1[N+](=O)[O-] ZINC000191054877 1432558620 /nfs/dbraw/zinc/55/86/20/1432558620.db2.gz ZEBJAFIZFIRTPI-UHFFFAOYSA-N 0 0 395.337 3.485 20 5 GGBDRN CCc1cc(O)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000191090522 1432565654 /nfs/dbraw/zinc/56/56/54/1432565654.db2.gz BRDZHSIHABCQCV-LJQANCHMSA-N 0 0 397.431 3.415 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000191093835 1432566379 /nfs/dbraw/zinc/56/63/79/1432566379.db2.gz ASEBHXUCOCIBFW-GFCCVEGCSA-N 0 0 383.832 3.378 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000191094298 1432566455 /nfs/dbraw/zinc/56/64/55/1432566455.db2.gz DHXWRWKSIRUKAY-KUCQQTCKSA-N 0 0 375.425 3.124 20 5 GGBDRN Cc1c(C(=O)N2CCC([C@H]3CCCO3)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000191102315 1432568429 /nfs/dbraw/zinc/56/84/29/1432568429.db2.gz JJIVRDPNFCGTBG-MRXNPFEDSA-N 0 0 377.397 3.151 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc([N+](=O)[O-])c1C ZINC000191111637 1432570283 /nfs/dbraw/zinc/57/02/83/1432570283.db2.gz MPRIFYDWYLZAPO-GOSISDBHSA-N 0 0 392.358 3.404 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000191125457 1432572663 /nfs/dbraw/zinc/57/26/63/1432572663.db2.gz UNPYNPMPSFMUEZ-GFCCVEGCSA-N 0 0 383.832 3.378 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191146886 1432576233 /nfs/dbraw/zinc/57/62/33/1432576233.db2.gz QUCSXNBGQQHLMO-UHFFFAOYSA-N 0 0 388.399 3.001 20 5 GGBDRN O=C(Nc1cccc(OC(F)F)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191223426 1432596423 /nfs/dbraw/zinc/59/64/23/1432596423.db2.gz MMIADEZWLSPISS-UHFFFAOYSA-N 0 0 379.319 3.491 20 5 GGBDRN O=C1CCc2cc(Cl)c(NS(=O)(=O)CCc3ccccc3[N+](=O)[O-])cc21 ZINC000191228876 1432597500 /nfs/dbraw/zinc/59/75/00/1432597500.db2.gz PABBEFZYIYBNPC-UHFFFAOYSA-N 0 0 394.836 3.362 20 5 GGBDRN Cc1cccc(C[C@@H](CO)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000191237621 1432599870 /nfs/dbraw/zinc/59/98/70/1432599870.db2.gz TWNPQSMDGAZJCH-INIZCTEOSA-N 0 0 397.456 3.360 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC[C@H]2CC[C@H](O)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000191263335 1432612074 /nfs/dbraw/zinc/61/20/74/1432612074.db2.gz NPJBXGDKZIDBNP-YCPHGPKFSA-N 0 0 384.436 3.054 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@@H]3CC[C@@H](O)C3)cc2[N+](=O)[O-])n1 ZINC000191276714 1432617974 /nfs/dbraw/zinc/61/79/74/1432617974.db2.gz XHDLFSORENHFNF-DGCLKSJQSA-N 0 0 393.490 3.402 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000191289767 1432622210 /nfs/dbraw/zinc/62/22/10/1432622210.db2.gz YZKSRMFWIAMRRE-BEFAXECRSA-N 0 0 396.447 3.065 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)cc1 ZINC000191301690 1432625292 /nfs/dbraw/zinc/62/52/92/1432625292.db2.gz WOXRKHIEBFGVQR-UHFFFAOYSA-N 0 0 387.387 3.177 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCc1cccc(C(=O)N(C)C)c1 ZINC000191324595 1432632876 /nfs/dbraw/zinc/63/28/76/1432632876.db2.gz PZRTUDWWJZXEFN-UHFFFAOYSA-N 0 0 384.436 3.278 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000191326430 1432633053 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COc1cccc(Cl)c1CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000191867759 1432743818 /nfs/dbraw/zinc/74/38/18/1432743818.db2.gz VIHSCPJXFGRSCU-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN Cc1ccccc1C[C@H](CO)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000191870643 1432743953 /nfs/dbraw/zinc/74/39/53/1432743953.db2.gz PAKPYODFSLBLGU-GOSISDBHSA-N 0 0 383.448 3.155 20 5 GGBDRN Cc1ccc(C[C@H](CO)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 ZINC000191877760 1432745215 /nfs/dbraw/zinc/74/52/15/1432745215.db2.gz OSSQOBRGJGKADR-GOSISDBHSA-N 0 0 383.448 3.155 20 5 GGBDRN Cc1ccccc1C[C@@H](CO)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000191881478 1432746155 /nfs/dbraw/zinc/74/61/55/1432746155.db2.gz BILAZAARYNVULS-ZDUSSCGKSA-N 0 0 395.362 3.230 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)[N-]c2cc(C3CCCC3)nn2C)cc1[N+](=O)[O-] ZINC000191916978 1432755168 /nfs/dbraw/zinc/75/51/68/1432755168.db2.gz RKPRQHSWTHVAJZ-UHFFFAOYSA-N 0 0 378.454 3.404 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000191931319 1432758769 /nfs/dbraw/zinc/75/87/69/1432758769.db2.gz PGLCSPAHVRKJBS-UHFFFAOYSA-N 0 0 377.784 3.177 20 5 GGBDRN Cc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)nnn1Cc1ccc(F)cc1F ZINC000191933320 1432759092 /nfs/dbraw/zinc/75/90/92/1432759092.db2.gz PLCLMTKGEYZOLF-UHFFFAOYSA-N 0 0 387.346 3.098 20 5 GGBDRN Cc1c(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)nnn1Cc1ccc(F)cc1F ZINC000191943732 1432762395 /nfs/dbraw/zinc/76/23/95/1432762395.db2.gz UIFFDSLTSBXEIX-UHFFFAOYSA-N 0 0 387.346 3.382 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N(c2ccccc2)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000191963382 1432768526 /nfs/dbraw/zinc/76/85/26/1432768526.db2.gz GZACEMZIVSQFLN-MRXNPFEDSA-N 0 0 376.434 3.196 20 5 GGBDRN COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000191969385 1432770674 /nfs/dbraw/zinc/77/06/74/1432770674.db2.gz ARCGAVPYBGTEKT-UHFFFAOYSA-N 0 0 398.202 3.165 20 5 GGBDRN CCCC(=O)N1CCC[C@H]1C(=O)Nc1cc(CC)nc2ccc([N+](=O)[O-])cc21 ZINC000191979284 1432773550 /nfs/dbraw/zinc/77/35/50/1432773550.db2.gz ULWSXSHOGSVMQZ-SFHVURJKSA-N 0 0 384.436 3.435 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC[C@@H]1c1cnn(C)c1 ZINC000191998081 1432777035 /nfs/dbraw/zinc/77/70/35/1432777035.db2.gz NUIFNAZWTRYREK-MLGOLLRUSA-N 0 0 392.506 3.126 20 5 GGBDRN C[C@@H](O)[C@@](C)(CNC(=O)CSc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000192029260 1432781715 /nfs/dbraw/zinc/78/17/15/1432781715.db2.gz OBMVTPUYMQWEKJ-FOIQADDNSA-N 0 0 388.489 3.433 20 5 GGBDRN C[C@H](O)[C@@](C)(CNC(=O)CSc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000192029254 1432781847 /nfs/dbraw/zinc/78/18/47/1432781847.db2.gz OBMVTPUYMQWEKJ-MGPUTAFESA-N 0 0 388.489 3.433 20 5 GGBDRN O=C1Nc2ccccc2CC[C@H]1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000192048226 1432786767 /nfs/dbraw/zinc/78/67/67/1432786767.db2.gz NGROROJKKVFAMY-HXUWFJFHSA-N 0 0 381.432 3.392 20 5 GGBDRN C[C@H](O)[C@@](C)(CNC(=O)CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000192052229 1432788305 /nfs/dbraw/zinc/78/83/05/1432788305.db2.gz SUESXWZORBLAID-HRAATJIYSA-N 0 0 386.448 3.110 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(c1ccccc1)[C@H]1CCOC1 ZINC000192081569 1432794831 /nfs/dbraw/zinc/79/48/31/1432794831.db2.gz CKAWTFRYJOVITQ-SFHVURJKSA-N 0 0 378.388 3.216 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2nnnn2CC(F)(F)F)c(Cc2ccccc2)c1 ZINC000192126634 1432802442 /nfs/dbraw/zinc/80/24/42/1432802442.db2.gz LORDRTACARRFGV-UHFFFAOYSA-N 0 0 393.325 3.313 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3ccn(-c4ccc(F)cc4F)n3)n2)cc1 ZINC000192139449 1432805289 /nfs/dbraw/zinc/80/52/89/1432805289.db2.gz QZQGROJIJREPCG-UHFFFAOYSA-N 0 0 382.330 3.366 20 5 GGBDRN CCn1c2ccccc2nc1[C@H]1CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000192144374 1432806563 /nfs/dbraw/zinc/80/65/63/1432806563.db2.gz BVVIPYYYSALRFR-QGZVFWFLSA-N 0 0 379.420 3.405 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H]1CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000192144370 1432806572 /nfs/dbraw/zinc/80/65/72/1432806572.db2.gz BVVIPYYYSALRFR-KRWDZBQOSA-N 0 0 379.420 3.405 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000192144395 1432806711 /nfs/dbraw/zinc/80/67/11/1432806711.db2.gz DYFYYEVAIXKITD-UHFFFAOYSA-N 0 0 391.471 3.399 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000192250248 1432822828 /nfs/dbraw/zinc/82/28/28/1432822828.db2.gz ZQDHYBONQKZVQQ-UHFFFAOYSA-N 0 0 383.452 3.316 20 5 GGBDRN CC(C)Oc1ccc(N(C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000192258079 1432823671 /nfs/dbraw/zinc/82/36/71/1432823671.db2.gz QBQCXNRVIFCTHR-UHFFFAOYSA-N 0 0 378.450 3.391 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC(c3ccncc3)CC2)c1C ZINC000192260823 1432823853 /nfs/dbraw/zinc/82/38/53/1432823853.db2.gz UXOBPEGEOPNGHA-UHFFFAOYSA-N 0 0 375.450 3.175 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(c2ccncc2)CC1 ZINC000192260163 1432823941 /nfs/dbraw/zinc/82/39/41/1432823941.db2.gz LKVWIYXPGIQGOT-UHFFFAOYSA-N 0 0 375.450 3.121 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000192268461 1432825127 /nfs/dbraw/zinc/82/51/27/1432825127.db2.gz OSWXNACBOYGKCC-BBRMVZONSA-N 0 0 396.852 3.304 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c(Cl)c1 ZINC000192268117 1432825146 /nfs/dbraw/zinc/82/51/46/1432825146.db2.gz BGPLUFDYYWHXOW-GUYCJALGSA-N 0 0 396.852 3.304 20 5 GGBDRN Cc1c([C@H](C)Nc2ccc([N+](=O)[O-])c(N[C@@H](C)c3cnn(C)c3C)n2)cnn1C ZINC000192275854 1432826007 /nfs/dbraw/zinc/82/60/07/1432826007.db2.gz RDSFRDAEXDADEE-RYUDHWBXSA-N 0 0 398.471 3.420 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(c2ccncc2)CC1 ZINC000192288042 1432827657 /nfs/dbraw/zinc/82/76/57/1432827657.db2.gz ZRDRJFFUDRAWER-UHFFFAOYSA-N 0 0 377.404 3.195 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN(Cc2c(F)cccc2F)C2CC2)cc1 ZINC000192299023 1432829040 /nfs/dbraw/zinc/82/90/40/1432829040.db2.gz YVYPYROYBOLWOD-UHFFFAOYSA-N 0 0 396.415 3.311 20 5 GGBDRN CSc1cccc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3)C2=O)c1[N+](=O)[O-] ZINC000192298840 1432829089 /nfs/dbraw/zinc/82/90/89/1432829089.db2.gz HVDQSCIDFQEWGT-INIZCTEOSA-N 0 0 399.472 3.156 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2cccc(CO)c2)nc1NCc1cccc(CO)c1 ZINC000192304800 1432829785 /nfs/dbraw/zinc/82/97/85/1432829785.db2.gz AZSBDECQGLUVCE-UHFFFAOYSA-N 0 0 394.431 3.199 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N(Cc1c(F)cccc1F)C1CC1 ZINC000192304337 1432829803 /nfs/dbraw/zinc/82/98/03/1432829803.db2.gz PVZUJPYFGBZRON-UHFFFAOYSA-N 0 0 375.331 3.003 20 5 GGBDRN CCCC1CCC(N(C)C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000192344130 1432834428 /nfs/dbraw/zinc/83/44/28/1432834428.db2.gz YARCUJYZYGAAHF-UHFFFAOYSA-N 0 0 382.482 3.429 20 5 GGBDRN Cc1c(NC(=O)CCc2cccc([N+](=O)[O-])c2)nnn1Cc1ccccc1F ZINC000192376005 1432838687 /nfs/dbraw/zinc/83/86/87/1432838687.db2.gz NGUXYDBAUVZUKG-UHFFFAOYSA-N 0 0 383.383 3.253 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000192376433 1432838970 /nfs/dbraw/zinc/83/89/70/1432838970.db2.gz XGMVOUUWXANNMX-ZDUSSCGKSA-N 0 0 387.358 3.279 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000192377655 1432839182 /nfs/dbraw/zinc/83/91/82/1432839182.db2.gz BNQJKUCWZKICEV-ZDUSSCGKSA-N 0 0 387.358 3.279 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000192409319 1432841625 /nfs/dbraw/zinc/84/16/25/1432841625.db2.gz CAZZTCAQBLWFJJ-CQSZACIVSA-N 0 0 375.356 3.121 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000192409283 1432841651 /nfs/dbraw/zinc/84/16/51/1432841651.db2.gz DGNNHRUTEHYJLM-ZDUSSCGKSA-N 0 0 395.774 3.466 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)c1ccc(F)cc1 ZINC000192427425 1432843958 /nfs/dbraw/zinc/84/39/58/1432843958.db2.gz DHJORZPGLXKYJF-OAHLLOKOSA-N 0 0 389.383 3.429 20 5 GGBDRN COc1cc(Cn2cnc3c(C)csc3c2=O)c([N+](=O)[O-])cc1OC(F)F ZINC000192450779 1432846254 /nfs/dbraw/zinc/84/62/54/1432846254.db2.gz CFSDBSSOISYRLS-UHFFFAOYSA-N 0 0 397.359 3.333 20 5 GGBDRN O=C(C1CCN(c2ncc([N+](=O)[O-])s2)CC1)N(Cc1ccccc1)C1CC1 ZINC000192462991 1432847775 /nfs/dbraw/zinc/84/77/75/1432847775.db2.gz WQNKCCDXSUFWJR-UHFFFAOYSA-N 0 0 386.477 3.459 20 5 GGBDRN Cc1cc(C(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)c(C)n1Cc1ccco1 ZINC000192471819 1432848669 /nfs/dbraw/zinc/84/86/69/1432848669.db2.gz BNFCEVBBGFPMFH-UHFFFAOYSA-N 0 0 395.371 3.445 20 5 GGBDRN Cc1ccc(Cn2nccc2NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000192502664 1432851962 /nfs/dbraw/zinc/85/19/62/1432851962.db2.gz NEADJCYFIORBME-UHFFFAOYSA-N 0 0 392.375 3.179 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000192503026 1432852031 /nfs/dbraw/zinc/85/20/31/1432852031.db2.gz SAUZVEMXJFQIEV-MRXNPFEDSA-N 0 0 378.331 3.095 20 5 GGBDRN Cc1cc(=O)oc2cc(NC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)ccc12 ZINC000192503271 1432852167 /nfs/dbraw/zinc/85/21/67/1432852167.db2.gz FFPFJAAXDPBTNU-UHFFFAOYSA-N 0 0 390.355 3.448 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC(NC(=O)Nc2ccc(F)cc2)CC1 ZINC000192505727 1432852478 /nfs/dbraw/zinc/85/24/78/1432852478.db2.gz XTWLSEGDZAPZIT-UHFFFAOYSA-N 0 0 390.419 3.049 20 5 GGBDRN Cc1cc(C)c(OC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000192510492 1432852975 /nfs/dbraw/zinc/85/29/75/1432852975.db2.gz NRHGKDVNFWLTKM-HNNXBMFYSA-N 0 0 375.425 3.045 20 5 GGBDRN COc1cccc(C(=O)NCCCOc2cccc3cccnc32)c1[N+](=O)[O-] ZINC000192520764 1432854216 /nfs/dbraw/zinc/85/42/16/1432854216.db2.gz ZGWPPWFOQZVBOK-UHFFFAOYSA-N 0 0 381.388 3.351 20 5 GGBDRN COc1ccc(-n2nnc(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)c2C)cc1 ZINC000192524614 1432854870 /nfs/dbraw/zinc/85/48/70/1432854870.db2.gz WJBPGFNPAUKPJV-UHFFFAOYSA-N 0 0 381.392 3.362 20 5 GGBDRN CN(CCn1cccn1)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192525625 1432854907 /nfs/dbraw/zinc/85/49/07/1432854907.db2.gz CWFWRRWEGHJHDN-UHFFFAOYSA-N 0 0 380.404 3.143 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCC1(c2ccc3c(c2)OCO3)CCOCC1 ZINC000192529796 1432855395 /nfs/dbraw/zinc/85/53/95/1432855395.db2.gz VTLRCZHAQJQPAB-UHFFFAOYSA-N 0 0 388.424 3.009 20 5 GGBDRN O=C(NCc1nc(-c2ccncc2)no1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000192531187 1432855562 /nfs/dbraw/zinc/85/55/62/1432855562.db2.gz VFBLCOVGGPMUSU-UHFFFAOYSA-N 0 0 381.373 3.185 20 5 GGBDRN O=C(Nc1cccc(N2CCCCC2=O)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000192539844 1432856794 /nfs/dbraw/zinc/85/67/94/1432856794.db2.gz BKJKKCYVKJIQGW-UHFFFAOYSA-N 0 0 384.348 3.272 20 5 GGBDRN NC(=O)c1c(NC(=O)CSCc2ccc([N+](=O)[O-])cc2)sc2c1CCC2 ZINC000192541875 1432857231 /nfs/dbraw/zinc/85/72/31/1432857231.db2.gz DVHVOBAACJHTJS-UHFFFAOYSA-N 0 0 391.474 3.116 20 5 GGBDRN C[C@@H]1CN(c2ccc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)cn2)C[C@H](C)O1 ZINC000192550955 1432858497 /nfs/dbraw/zinc/85/84/97/1432858497.db2.gz LCDINDJLGGAZTQ-PHIMTYICSA-N 0 0 392.362 3.134 20 5 GGBDRN O=C(Cc1cnn(-c2ccccc2)c1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000192551735 1432858687 /nfs/dbraw/zinc/85/86/87/1432858687.db2.gz JAIBKYXQPONNEK-UHFFFAOYSA-N 0 0 394.387 3.123 20 5 GGBDRN C[C@H]1C[C@@]2(CC(C)(C)C1)NC(=O)N(CN(C)Cc1ccccc1[N+](=O)[O-])C2=O ZINC000192560395 1432859955 /nfs/dbraw/zinc/85/99/55/1432859955.db2.gz KEFVNFDUPRLTTP-VLIAUNLRSA-N 0 0 388.468 3.121 20 5 GGBDRN CCCN(CC(=O)Nc1ccc(Cl)cc1)C(=O)c1[nH]nc(CC)c1[N+](=O)[O-] ZINC000192562650 1432860476 /nfs/dbraw/zinc/86/04/76/1432860476.db2.gz BLISKSBBXXFRTP-UHFFFAOYSA-N 0 0 393.831 3.025 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC(O)(c2ccccc2Cl)CC1 ZINC000192579226 1432862502 /nfs/dbraw/zinc/86/25/02/1432862502.db2.gz BQBCCPRMSGKXOQ-UHFFFAOYSA-N 0 0 390.823 3.137 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCc1nc(-c2cccc(Cl)c2)no1 ZINC000192597363 1432864328 /nfs/dbraw/zinc/86/43/28/1432864328.db2.gz PGTMJBFDYHDWJU-UHFFFAOYSA-N 0 0 376.804 3.478 20 5 GGBDRN COc1cccc(C(=O)N2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000192601687 1432864858 /nfs/dbraw/zinc/86/48/58/1432864858.db2.gz DWXJSOCCRAWPDW-CQSZACIVSA-N 0 0 386.379 3.478 20 5 GGBDRN Cc1cc(=O)oc2cc(NC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)ccc12 ZINC000192616444 1432866746 /nfs/dbraw/zinc/86/67/46/1432866746.db2.gz XCRUDRGVOVMBLP-UHFFFAOYSA-N 0 0 390.355 3.448 20 5 GGBDRN Cc1ccc(CNC(=O)c2c(C)cccc2[N+](=O)[O-])c(-n2cc(Cl)cn2)n1 ZINC000192626295 1432867847 /nfs/dbraw/zinc/86/78/47/1432867847.db2.gz VPYUZGLNZGKBRS-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(CCS(=O)(=O)c2ccc(F)cc2)C2CC2)c1 ZINC000192626625 1432867858 /nfs/dbraw/zinc/86/78/58/1432867858.db2.gz RVWNROJNWKYMKQ-UHFFFAOYSA-N 0 0 378.425 3.172 20 5 GGBDRN CN(CC(=O)N(C)Cc1c(F)cccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000192635810 1432869394 /nfs/dbraw/zinc/86/93/94/1432869394.db2.gz DNVISKQZDAPPMI-UHFFFAOYSA-N 0 0 379.819 3.478 20 5 GGBDRN CN(C)S(=O)(=O)c1ccccc1CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192644313 1432870627 /nfs/dbraw/zinc/87/06/27/1432870627.db2.gz VNZCOBCJGDKBRD-GOSISDBHSA-N 0 0 389.477 3.012 20 5 GGBDRN O=C(Nc1ccnn1Cc1ccc(F)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000192669867 1432873620 /nfs/dbraw/zinc/87/36/20/1432873620.db2.gz PPXZCTAVWZIDLQ-UHFFFAOYSA-N 0 0 385.311 3.139 20 5 GGBDRN O=C(NCCc1cccc2ccccc21)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000192683132 1432875232 /nfs/dbraw/zinc/87/52/32/1432875232.db2.gz AXZWKCRPMVYKMK-UHFFFAOYSA-N 0 0 387.399 3.301 20 5 GGBDRN CN(C)c1ncncc1NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192694206 1432876117 /nfs/dbraw/zinc/87/61/17/1432876117.db2.gz NSIQFUITDIYXKQ-UHFFFAOYSA-N 0 0 393.403 3.282 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000192701423 1432877125 /nfs/dbraw/zinc/87/71/25/1432877125.db2.gz ZQXVBSOGWXNAIW-AWEZNQCLSA-N 0 0 380.759 3.074 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1 ZINC000192717360 1432879238 /nfs/dbraw/zinc/87/92/38/1432879238.db2.gz UIRSYKHRTOFMBL-UHFFFAOYSA-N 0 0 387.411 3.009 20 5 GGBDRN CC[C@@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])[C@H]1CN(Cc2ccccc2)CCO1 ZINC000192720983 1432879786 /nfs/dbraw/zinc/87/97/86/1432879786.db2.gz UKJUFLOWFIRHHF-UYAOXDASSA-N 0 0 397.475 3.313 20 5 GGBDRN CC[C@@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000192720959 1432879890 /nfs/dbraw/zinc/87/98/90/1432879890.db2.gz UKJUFLOWFIRHHF-QUCCMNQESA-N 0 0 397.475 3.313 20 5 GGBDRN CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000192730387 1432881299 /nfs/dbraw/zinc/88/12/99/1432881299.db2.gz AWSCWLAPVPOHIK-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(S(=O)(=O)NC(C)C)c1 ZINC000192729977 1432881403 /nfs/dbraw/zinc/88/14/03/1432881403.db2.gz YZYXRWBZZMBZFG-UHFFFAOYSA-N 0 0 391.449 3.151 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CNC(=O)c1ccccc1OC(F)F ZINC000192729705 1432881436 /nfs/dbraw/zinc/88/14/36/1432881436.db2.gz OKBJNQRDMILTFO-UHFFFAOYSA-N 0 0 393.346 3.182 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000192733525 1432882042 /nfs/dbraw/zinc/88/20/42/1432882042.db2.gz YAMVGIFDDAXBOC-HOTGVXAUSA-N 0 0 393.875 3.257 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1 ZINC000192733542 1432882106 /nfs/dbraw/zinc/88/21/06/1432882106.db2.gz YAMVGIFDDAXBOC-JKSUJKDBSA-N 0 0 393.875 3.257 20 5 GGBDRN CCOc1cc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)ccc1O ZINC000192750809 1432884574 /nfs/dbraw/zinc/88/45/74/1432884574.db2.gz CNUDWJFKPWETDS-UKTHLTGXSA-N 0 0 379.372 3.353 20 5 GGBDRN COc1cc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)cc(OC)c1 ZINC000192750901 1432884704 /nfs/dbraw/zinc/88/47/04/1432884704.db2.gz JFQCXNJATWVXPG-QPEQYQDCSA-N 0 0 379.372 3.266 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCCN(C(=O)c2ccc(F)cc2)CC1 ZINC000192758170 1432885508 /nfs/dbraw/zinc/88/55/08/1432885508.db2.gz FSCGZKRBPOUPMO-UHFFFAOYSA-N 0 0 386.383 3.114 20 5 GGBDRN O=C1N[C@@]2(CCCCc3ccccc32)C(=O)N1CCOc1cccc([N+](=O)[O-])c1 ZINC000192759488 1432885853 /nfs/dbraw/zinc/88/58/53/1432885853.db2.gz OOHXIMPIUZTZQU-OAQYLSRUSA-N 0 0 395.415 3.147 20 5 GGBDRN Cc1nc(NC(=O)c2ccc([N+](=O)[O-])s2)sc1-c1n[nH]c(=S)n1C ZINC000192777598 1432889080 /nfs/dbraw/zinc/88/90/80/1432889080.db2.gz LBKOCYIYVSABFU-UHFFFAOYSA-N 0 0 382.452 3.132 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192777800 1432889331 /nfs/dbraw/zinc/88/93/31/1432889331.db2.gz IGALDSXEQRNSPK-UHFFFAOYSA-N 0 0 381.432 3.211 20 5 GGBDRN CCO[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1 ZINC000192781392 1432890123 /nfs/dbraw/zinc/89/01/23/1432890123.db2.gz FBNVJZSXNDBLOC-IBGZPJMESA-N 0 0 380.404 3.288 20 5 GGBDRN CC(C)(C)CC(C)(C)NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000192794879 1432892061 /nfs/dbraw/zinc/89/20/61/1432892061.db2.gz WLAWFWFCAHOABX-UHFFFAOYSA-N 0 0 387.383 3.466 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2ccc(NCCCCO)c([N+](=O)[O-])c2)c(C)c1 ZINC000192802460 1432892818 /nfs/dbraw/zinc/89/28/18/1432892818.db2.gz PBNLUNVTAJYEKN-UHFFFAOYSA-N 0 0 393.465 3.197 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000192828611 1432895926 /nfs/dbraw/zinc/89/59/26/1432895926.db2.gz XYLHTBOCMDZGJK-LJQANCHMSA-N 0 0 383.404 3.061 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1cccc(OCC(=O)N2CCCC2)c1 ZINC000192828228 1432895961 /nfs/dbraw/zinc/89/59/61/1432895961.db2.gz PBVLTNWPEIRVTO-UHFFFAOYSA-N 0 0 385.420 3.217 20 5 GGBDRN CSc1ccc(C(=O)NCc2ccccc2CN2CCCC2=O)cc1[N+](=O)[O-] ZINC000192832408 1432896553 /nfs/dbraw/zinc/89/65/53/1432896553.db2.gz BUTWIJGAXKQGGW-UHFFFAOYSA-N 0 0 399.472 3.369 20 5 GGBDRN CCOCCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000192835862 1432896713 /nfs/dbraw/zinc/89/67/13/1432896713.db2.gz JBRGEKRSXAUFKZ-UHFFFAOYSA-N 0 0 384.841 3.480 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](c2c(F)cccc2F)C(F)(F)F)c1[N+](=O)[O-] ZINC000192858489 1432899841 /nfs/dbraw/zinc/89/98/41/1432899841.db2.gz BWMPHKQXOPJIQF-GFCCVEGCSA-N 0 0 378.257 3.192 20 5 GGBDRN COc1ccc2ccccc2c1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000192859424 1432899933 /nfs/dbraw/zinc/89/99/33/1432899933.db2.gz KLJHEIKRLRKNPU-UHFFFAOYSA-N 0 0 386.429 3.376 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCCc2ccc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000192870812 1432901489 /nfs/dbraw/zinc/90/14/89/1432901489.db2.gz NWNRUEBKTARDTL-UHFFFAOYSA-N 0 0 397.214 3.452 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)c1[N+](=O)[O-] ZINC000192909642 1432905884 /nfs/dbraw/zinc/90/58/84/1432905884.db2.gz JHEYYANNOMBGGB-MRXNPFEDSA-N 0 0 378.331 3.095 20 5 GGBDRN CCc1n[nH]c(C(=O)NC(C)(C)c2ccc(OC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000192935207 1432909907 /nfs/dbraw/zinc/90/99/07/1432909907.db2.gz UHNLUHUVRYSALY-UHFFFAOYSA-N 0 0 386.330 3.444 20 5 GGBDRN Cc1nc2ccc(NC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc2o1 ZINC000192937684 1432910338 /nfs/dbraw/zinc/91/03/38/1432910338.db2.gz LJXUZJINLMQFGE-UHFFFAOYSA-N 0 0 381.392 3.399 20 5 GGBDRN COc1cccc2c1CCN(S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000192943082 1432911119 /nfs/dbraw/zinc/91/11/19/1432911119.db2.gz GFWQMKGLBSLDPN-UHFFFAOYSA-N 0 0 396.852 3.046 20 5 GGBDRN CSc1ccc(C(=O)NCC(=O)N2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000192954569 1432912679 /nfs/dbraw/zinc/91/26/79/1432912679.db2.gz LRBLAHPNBQBJMR-UHFFFAOYSA-N 0 0 385.445 3.026 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1nc(-c2cc3ccccc3o2)cs1 ZINC000192966302 1432914287 /nfs/dbraw/zinc/91/42/87/1432914287.db2.gz GEAYMQNPYWAKRK-UHFFFAOYSA-N 0 0 396.384 3.265 20 5 GGBDRN CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000192973506 1432915406 /nfs/dbraw/zinc/91/54/06/1432915406.db2.gz ODAFSQGHGLEESY-DTWKUNHWSA-N 0 0 377.319 3.323 20 5 GGBDRN C[C@H](CCc1ccccc1)NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192976757 1432916039 /nfs/dbraw/zinc/91/60/39/1432916039.db2.gz WUTBGCJIAMPGIK-QGZVFWFLSA-N 0 0 382.464 3.448 20 5 GGBDRN CC(C)c1ccccc1NC(=O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192987969 1432917869 /nfs/dbraw/zinc/91/78/69/1432917869.db2.gz MKDCGCCABZIQEC-UHFFFAOYSA-N 0 0 382.464 3.479 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000192999231 1432919500 /nfs/dbraw/zinc/91/95/00/1432919500.db2.gz ANQXQLVSFYDPHA-UKRRQHHQSA-N 0 0 379.457 3.375 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@@H](C)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000192999068 1432919641 /nfs/dbraw/zinc/91/96/41/1432919641.db2.gz 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Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000193119544 1432938964 /nfs/dbraw/zinc/93/89/64/1432938964.db2.gz TVDVPYHIQNIIAC-LLVKDONJSA-N 0 0 388.449 3.054 20 5 GGBDRN CCc1nc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1C ZINC000193119583 1432939340 /nfs/dbraw/zinc/93/93/40/1432939340.db2.gz QGXPPPRYIXOWEJ-SNVBAGLBSA-N 0 0 376.438 3.046 20 5 GGBDRN CCCc1csc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000193119607 1432939411 /nfs/dbraw/zinc/93/94/11/1432939411.db2.gz LCZVAEJEGVATEK-LLVKDONJSA-N 0 0 376.438 3.128 20 5 GGBDRN COc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1Cl ZINC000193119703 1432939470 /nfs/dbraw/zinc/93/94/70/1432939470.db2.gz IPXWLSXZRYYRLI-NSHDSACASA-N 0 0 391.811 3.381 20 5 GGBDRN CN(Cc1ccccc1OC(F)(F)F)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000193131686 1432941397 /nfs/dbraw/zinc/94/13/97/1432941397.db2.gz NDRUKDADPTYIFS-UHFFFAOYSA-N 0 0 390.339 3.314 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccnc1N1CCCC1 ZINC000193143491 1432944119 /nfs/dbraw/zinc/94/41/19/1432944119.db2.gz RNFILWOMBJGLRL-UHFFFAOYSA-N 0 0 378.335 3.444 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1 ZINC000193153535 1432945952 /nfs/dbraw/zinc/94/59/52/1432945952.db2.gz QBQSSHZHJKCRJZ-UHFFFAOYSA-N 0 0 399.794 3.336 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccccn3)no2)ccc1[N+](=O)[O-] ZINC000193158529 1432947512 /nfs/dbraw/zinc/94/75/12/1432947512.db2.gz DAAPIFVOKDELCB-INIZCTEOSA-N 0 0 379.376 3.326 20 5 GGBDRN O=C(NCc1cc(Cl)c2c(c1)OCCO2)NCc1ccccc1[N+](=O)[O-] ZINC000193201371 1432957421 /nfs/dbraw/zinc/95/74/21/1432957421.db2.gz XYDZFIFIRCLHIM-UHFFFAOYSA-N 0 0 377.784 3.019 20 5 GGBDRN O=C(NCc1cccc(CN2CCCC2=O)c1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000193213776 1432959313 /nfs/dbraw/zinc/95/93/13/1432959313.db2.gz DCEKJXMZUMSJTR-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN C[C@H]1CCc2ccccc2N1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000193223355 1432961500 /nfs/dbraw/zinc/96/15/00/1432961500.db2.gz 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399.451 3.194 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000193607093 1433027957 /nfs/dbraw/zinc/02/79/57/1433027957.db2.gz IAPPRQPQUSYHAK-NSHDSACASA-N 0 0 377.347 3.340 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)[C@@H](C)c2cc(F)ccc2F)cccc1[N+](=O)[O-] ZINC000193608551 1433028183 /nfs/dbraw/zinc/02/81/83/1433028183.db2.gz CZPHXAOHOOBFMA-NSHDSACASA-N 0 0 377.347 3.340 20 5 GGBDRN Cc1cc(NC(=O)NCc2ccccc2CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000193611001 1433028517 /nfs/dbraw/zinc/02/85/17/1433028517.db2.gz FXSLPXZBVLPYQT-UHFFFAOYSA-N 0 0 384.436 3.057 20 5 GGBDRN CCCN(CC1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193718454 1433046503 /nfs/dbraw/zinc/04/65/03/1433046503.db2.gz BGYYTSOZLQIHIZ-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000193639720 1433032586 /nfs/dbraw/zinc/03/25/86/1433032586.db2.gz TYMRDJKUXLLKKR-MRXNPFEDSA-N 0 0 375.425 3.113 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000193642288 1433033116 /nfs/dbraw/zinc/03/31/16/1433033116.db2.gz ORIWVWLDXYKKFH-UHFFFAOYSA-N 0 0 383.360 3.447 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)ccc1[N+](=O)[O-] ZINC000193646960 1433033661 /nfs/dbraw/zinc/03/36/61/1433033661.db2.gz RNPRRYXBOAHCLH-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCCc2csc3ccccc23)cc1[N+](=O)[O-] ZINC000193655401 1433034926 /nfs/dbraw/zinc/03/49/26/1433034926.db2.gz XQXCGLZEKLVYCM-UHFFFAOYSA-N 0 0 383.429 3.415 20 5 GGBDRN CC(C)CCOC1CCN(C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000193660427 1433035843 /nfs/dbraw/zinc/03/58/43/1433035843.db2.gz NTNONGQHZIUEPD-UHFFFAOYSA-N 0 0 397.859 3.240 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc2sc(N(C)C)nc2s1 ZINC000193663903 1433036310 /nfs/dbraw/zinc/03/63/10/1433036310.db2.gz BZIYTKYPCSJJPN-UHFFFAOYSA-N 0 0 392.462 3.271 20 5 GGBDRN COC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc(Cl)cc1 ZINC000193663058 1433036350 /nfs/dbraw/zinc/03/63/50/1433036350.db2.gz RRRGVVKXRLCHBP-MRXNPFEDSA-N 0 0 393.827 3.173 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000193664468 1433036752 /nfs/dbraw/zinc/03/67/52/1433036752.db2.gz HPVPEVALBNTRKH-UHFFFAOYSA-N 0 0 391.811 3.244 20 5 GGBDRN COC[C@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccc(Cl)cc1 ZINC000193669303 1433037383 /nfs/dbraw/zinc/03/73/83/1433037383.db2.gz FEIXPZZKMUTXMH-KRWDZBQOSA-N 0 0 389.839 3.115 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1C ZINC000193668365 1433037469 /nfs/dbraw/zinc/03/74/69/1433037469.db2.gz PXTIBYISEWTJPD-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1csc2ccccc12 ZINC000193671544 1433038002 /nfs/dbraw/zinc/03/80/02/1433038002.db2.gz WXXAIPJKXFXSQE-UHFFFAOYSA-N 0 0 399.428 3.415 20 5 GGBDRN Cc1cc(C)c(CCNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c(C)c1 ZINC000193673896 1433038340 /nfs/dbraw/zinc/03/83/40/1433038340.db2.gz KGIRGCGEGZLPSH-UHFFFAOYSA-N 0 0 389.839 3.471 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccccc1)C(C)(C)C ZINC000193674981 1433038634 /nfs/dbraw/zinc/03/86/34/1433038634.db2.gz VHRSTZYUQFMYKF-KRWDZBQOSA-N 0 0 385.420 3.446 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000193678234 1433039144 /nfs/dbraw/zinc/03/91/44/1433039144.db2.gz IKTULKGZCSEUFF-UHFFFAOYSA-N 0 0 391.811 3.244 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)c1 ZINC000193678681 1433039289 /nfs/dbraw/zinc/03/92/89/1433039289.db2.gz RDMVCABUHWVIEG-UHFFFAOYSA-N 0 0 398.419 3.160 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1 ZINC000193685063 1433040538 /nfs/dbraw/zinc/04/05/38/1433040538.db2.gz FSSCEUYXUDHXPV-AWEZNQCLSA-N 0 0 395.375 3.113 20 5 GGBDRN CC1CCC(N(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000193686163 1433040561 /nfs/dbraw/zinc/04/05/61/1433040561.db2.gz OEUWFZCDTLJYJH-UHFFFAOYSA-N 0 0 385.367 3.172 20 5 GGBDRN Cc1nnc([C@H]2Cc3ccccc3CN2CC(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000193701821 1433043174 /nfs/dbraw/zinc/04/31/74/1433043174.db2.gz ZEWZFSHCDQIHFA-GOSISDBHSA-N 0 0 393.403 3.024 20 5 GGBDRN Cc1cc(NC(=O)CSCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n(C)n1 ZINC000193703044 1433043382 /nfs/dbraw/zinc/04/33/82/1433043382.db2.gz RHWPGZFQVJLFHQ-UHFFFAOYSA-N 0 0 387.421 3.164 20 5 GGBDRN CN(Cc1cnn(-c2ccccc2)c1)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000193702851 1433043500 /nfs/dbraw/zinc/04/35/00/1433043500.db2.gz GCTPYYXFDGLLHB-UHFFFAOYSA-N 0 0 377.404 3.302 20 5 GGBDRN C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193706830 1433044385 /nfs/dbraw/zinc/04/43/85/1433044385.db2.gz VMUZXCISJGVCQS-JTQLQIEISA-N 0 0 397.250 3.497 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3ccccc32)cc1Br ZINC000193711357 1433044877 /nfs/dbraw/zinc/04/48/77/1433044877.db2.gz DAXMLGUGGLZZKE-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN COc1ccc(OS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)cc1 ZINC000193710716 1433044960 /nfs/dbraw/zinc/04/49/60/1433044960.db2.gz MKPYUKFVOAWIKH-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H](C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000193713495 1433045469 /nfs/dbraw/zinc/04/54/69/1433045469.db2.gz YBHLLJIDORBFDC-CYBMUJFWSA-N 0 0 387.392 3.394 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000193713510 1433045489 /nfs/dbraw/zinc/04/54/89/1433045489.db2.gz YBHLLJIDORBFDC-ZDUSSCGKSA-N 0 0 387.392 3.394 20 5 GGBDRN CS(=O)(=O)Nc1cccc2c1CCN(c1ccc([N+](=O)[O-])c3cnccc31)C2 ZINC000193716789 1433046212 /nfs/dbraw/zinc/04/62/12/1433046212.db2.gz KYHWFMWQOZNHSV-UHFFFAOYSA-N 0 0 398.444 3.077 20 5 GGBDRN Cc1cc(NC(=O)NCCc2cc(F)cc3c2OCOC3)ccc1[N+](=O)[O-] ZINC000193728853 1433048285 /nfs/dbraw/zinc/04/82/85/1433048285.db2.gz LNERMIUZKKYQSR-UHFFFAOYSA-N 0 0 375.356 3.273 20 5 GGBDRN Cc1c(C(=O)NCc2ccccc2OC(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000193727654 1433048292 /nfs/dbraw/zinc/04/82/92/1433048292.db2.gz CCUCGTWPOUCUKJ-UHFFFAOYSA-N 0 0 395.419 3.201 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCc1nnnn1-c1ccc(OC(F)F)cc1 ZINC000193728893 1433048383 /nfs/dbraw/zinc/04/83/83/1433048383.db2.gz UIFRJZBETYBEMK-UHFFFAOYSA-N 0 0 390.350 3.401 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000193734482 1433049175 /nfs/dbraw/zinc/04/91/75/1433049175.db2.gz STJOSGVPZAAPHV-LLVKDONJSA-N 0 0 388.449 3.051 20 5 GGBDRN O=C(Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193740417 1433050347 /nfs/dbraw/zinc/05/03/47/1433050347.db2.gz UODCAKMBJIBQMG-UHFFFAOYSA-N 0 0 393.281 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)Oc1c(F)cccc1F ZINC000193740121 1433050399 /nfs/dbraw/zinc/05/03/99/1433050399.db2.gz JWNPOCKKNDQFIH-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000193746572 1433051191 /nfs/dbraw/zinc/05/11/91/1433051191.db2.gz NDIYWDVKLVIURW-UHFFFAOYSA-N 0 0 394.431 3.483 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1ccc(CN2CCCC2=O)cc1 ZINC000193749023 1433051574 /nfs/dbraw/zinc/05/15/74/1433051574.db2.gz FKHJMUAXUHVHQI-UHFFFAOYSA-N 0 0 382.420 3.081 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000193758005 1433053780 /nfs/dbraw/zinc/05/37/80/1433053780.db2.gz QVNWWAJZKFSNQV-GJZGRUSLSA-N 0 0 397.431 3.405 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC=C(c3ccc(F)cc3)CC2)c(F)c1 ZINC000193764719 1433054994 /nfs/dbraw/zinc/05/49/94/1433054994.db2.gz WJBDFJQJVNIXIU-UHFFFAOYSA-N 0 0 380.372 3.351 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCCN(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000193778846 1433057396 /nfs/dbraw/zinc/05/73/96/1433057396.db2.gz BMWDPEYOSWVYEM-KRWDZBQOSA-N 0 0 382.464 3.443 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])o1 ZINC000193786600 1433059273 /nfs/dbraw/zinc/05/92/73/1433059273.db2.gz AQVGWAUUYMKXLA-SFHVURJKSA-N 0 0 395.375 3.494 20 5 GGBDRN CN(C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)[C@@H]1CCc2ccccc21 ZINC000193786233 1433059305 /nfs/dbraw/zinc/05/93/05/1433059305.db2.gz DXYRKYNDTDHXRR-KBXCAEBGSA-N 0 0 397.406 3.233 20 5 GGBDRN CCOc1cc(C(=O)N2CCn3c4ccccc4nc32)c([N+](=O)[O-])cc1OC ZINC000193800049 1433062347 /nfs/dbraw/zinc/06/23/47/1433062347.db2.gz ZEVVQVLXFGLOTM-UHFFFAOYSA-N 0 0 382.376 3.012 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000193802464 1433062784 /nfs/dbraw/zinc/06/27/84/1433062784.db2.gz JXGOIYGJHGJLOP-LJQANCHMSA-N 0 0 399.447 3.494 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000193802451 1433062794 /nfs/dbraw/zinc/06/27/94/1433062794.db2.gz JXGOIYGJHGJLOP-IBGZPJMESA-N 0 0 399.447 3.494 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccccc1C(F)(F)F ZINC000193811717 1433064783 /nfs/dbraw/zinc/06/47/83/1433064783.db2.gz QAAQKXZNUWOKNU-UHFFFAOYSA-N 0 0 381.310 3.211 20 5 GGBDRN C[C@@H](c1ccccc1)N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000193812338 1433065101 /nfs/dbraw/zinc/06/51/01/1433065101.db2.gz RSXRCQUVGOGADE-NSHDSACASA-N 0 0 393.346 3.354 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1cccc(OC(F)(F)F)c1 ZINC000193813517 1433065273 /nfs/dbraw/zinc/06/52/73/1433065273.db2.gz VKYFPDOZBYXCPV-UHFFFAOYSA-N 0 0 397.309 3.091 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(-c2nccs2)cc1 ZINC000193813989 1433065397 /nfs/dbraw/zinc/06/53/97/1433065397.db2.gz IAIJLRVVJKGMBC-UHFFFAOYSA-N 0 0 396.428 3.315 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2cccnc12 ZINC000193813571 1433065416 /nfs/dbraw/zinc/06/54/16/1433065416.db2.gz XVNZYTKEOIIHOP-UHFFFAOYSA-N 0 0 378.388 3.049 20 5 GGBDRN C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000193814476 1433065681 /nfs/dbraw/zinc/06/56/81/1433065681.db2.gz IFFFUBSLXUIAMF-VQIMIIECSA-N 0 0 390.484 3.022 20 5 GGBDRN C[C@@H]1CCC[C@H](N(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000193833201 1433068870 /nfs/dbraw/zinc/06/88/70/1433068870.db2.gz CIFZIRQRQLOSHP-MNOVXSKESA-N 0 0 385.367 3.172 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3cccc(Cn4ccnc4)c3)cc2N1 ZINC000193841476 1433070886 /nfs/dbraw/zinc/07/08/86/1433070886.db2.gz DANUTIYKFSRZLR-UHFFFAOYSA-N 0 0 377.404 3.336 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(CC(F)F)c1ccc(F)cc1 ZINC000193853613 1433073235 /nfs/dbraw/zinc/07/32/35/1433073235.db2.gz SMBUWQHEEIQKIS-UHFFFAOYSA-N 0 0 391.309 3.227 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000193855028 1433073680 /nfs/dbraw/zinc/07/36/80/1433073680.db2.gz PCURINKCHWOTMW-UHFFFAOYSA-N 0 0 393.346 3.183 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3cccnc3OCC(F)(F)F)cc2N1 ZINC000193859083 1433074589 /nfs/dbraw/zinc/07/45/89/1433074589.db2.gz UULHLAOYUMHGDE-UHFFFAOYSA-N 0 0 396.325 3.428 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000193876670 1433076922 /nfs/dbraw/zinc/07/69/22/1433076922.db2.gz HIGWQBUDHOELLN-UHFFFAOYSA-N 0 0 386.408 3.227 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)c1[N+](=O)[O-] ZINC000193878058 1433077279 /nfs/dbraw/zinc/07/72/79/1433077279.db2.gz VQNNEOJJLCYWQD-UHFFFAOYSA-N 0 0 376.376 3.432 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCCCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000193881773 1433077675 /nfs/dbraw/zinc/07/76/75/1433077675.db2.gz BWUXHRRADLTHCP-KRWDZBQOSA-N 0 0 382.420 3.381 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCc2cccc(OCC(F)(F)F)c2)c1 ZINC000193888526 1433078720 /nfs/dbraw/zinc/07/87/20/1433078720.db2.gz BYKGEINYEVBSKC-UHFFFAOYSA-N 0 0 390.339 3.014 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000193900018 1433080793 /nfs/dbraw/zinc/08/07/93/1433080793.db2.gz SDLFCYDPMOTXQE-MRXNPFEDSA-N 0 0 389.358 3.045 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@H]2Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000193902432 1433081421 /nfs/dbraw/zinc/08/14/21/1433081421.db2.gz UIXGGOZQGIZQCE-INIZCTEOSA-N 0 0 385.395 3.215 20 5 GGBDRN Cc1occc1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193908732 1433082571 /nfs/dbraw/zinc/08/25/71/1433082571.db2.gz WGCFTLVXUMHKPF-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2nc3ccccc3s2)CC1 ZINC000193914817 1433083961 /nfs/dbraw/zinc/08/39/61/1433083961.db2.gz RDDZONKZYDBWJA-UHFFFAOYSA-N 0 0 398.444 3.176 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2nc3ccccc3s2)CC1 ZINC000193915859 1433084137 /nfs/dbraw/zinc/08/41/37/1433084137.db2.gz XTFHRMGXDSMGBJ-UHFFFAOYSA-N 0 0 382.445 3.096 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC(OCCC(C)C)CC2)c1C ZINC000193921929 1433085194 /nfs/dbraw/zinc/08/51/94/1433085194.db2.gz OQWULFMMMIYOSW-UHFFFAOYSA-N 0 0 384.498 3.427 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N([C@H](C)c2ccccc2)C1 ZINC000193925274 1433085936 /nfs/dbraw/zinc/08/59/36/1433085936.db2.gz MESGYOUMJUOHEE-HIFRSBDPSA-N 0 0 383.404 3.152 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000193939990 1433089098 /nfs/dbraw/zinc/08/90/98/1433089098.db2.gz INMFTMYHGWCOGF-JTQLQIEISA-N 0 0 381.310 3.430 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000193940047 1433089255 /nfs/dbraw/zinc/08/92/55/1433089255.db2.gz SFJGWBWKXDTAGU-SNVBAGLBSA-N 0 0 381.310 3.430 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193940818 1433089273 /nfs/dbraw/zinc/08/92/73/1433089273.db2.gz QJNYKGGUDXPGMT-SNVBAGLBSA-N 0 0 397.309 3.309 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccccc1OC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000193941884 1433089431 /nfs/dbraw/zinc/08/94/31/1433089431.db2.gz NKUYDOKPSNUBTA-JTQLQIEISA-N 0 0 379.319 3.012 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2cccnc12 ZINC000193942958 1433089505 /nfs/dbraw/zinc/08/95/05/1433089505.db2.gz WOIVDFQAPMBJET-ZDUSSCGKSA-N 0 0 378.388 3.267 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccc(OC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000193942880 1433089551 /nfs/dbraw/zinc/08/95/51/1433089551.db2.gz YHWOQDPAXZMUIQ-SNVBAGLBSA-N 0 0 397.309 3.309 20 5 GGBDRN Cc1ncc(-c2ccc(NC(=O)C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2)o1 ZINC000193943190 1433089562 /nfs/dbraw/zinc/08/95/62/1433089562.db2.gz WUKSBLHJMKFCPH-GFCCVEGCSA-N 0 0 394.387 3.374 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2cccnc12 ZINC000193942977 1433089583 /nfs/dbraw/zinc/08/95/83/1433089583.db2.gz WOIVDFQAPMBJET-CYBMUJFWSA-N 0 0 378.388 3.267 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccccc1OC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000193942717 1433089703 /nfs/dbraw/zinc/08/97/03/1433089703.db2.gz UYBCLISESUVLRD-SNVBAGLBSA-N 0 0 397.309 3.309 20 5 GGBDRN COc1ccccc1CN(C(=O)NCc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000193944721 1433089929 /nfs/dbraw/zinc/08/99/29/1433089929.db2.gz CNHJYXOWKFHLPO-UHFFFAOYSA-N 0 0 385.420 3.486 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000193946670 1433090310 /nfs/dbraw/zinc/09/03/10/1433090310.db2.gz QXAULLDMOJHFOK-GOSISDBHSA-N 0 0 389.383 3.026 20 5 GGBDRN O=C(NCc1ccc2[nH]c(=O)[nH]c2c1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000193960564 1433092683 /nfs/dbraw/zinc/09/26/83/1433092683.db2.gz XRFISHOCOZFFOL-UHFFFAOYSA-N 0 0 395.297 3.105 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCC[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000193978938 1433095300 /nfs/dbraw/zinc/09/53/00/1433095300.db2.gz QCZFDWOOEDHYRZ-HNNXBMFYSA-N 0 0 380.397 3.268 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000193983518 1433096149 /nfs/dbraw/zinc/09/61/49/1433096149.db2.gz BMFUKEYZSIDWTK-UHFFFAOYSA-N 0 0 377.422 3.004 20 5 GGBDRN COc1cccc(C(=O)Nc2cc(C(=O)N(C)C)ccc2Cl)c1[N+](=O)[O-] ZINC000193992844 1433097336 /nfs/dbraw/zinc/09/73/36/1433097336.db2.gz QDLNTDJDDMQPHX-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCC[C@H]2c2cccc(C)c2)cc1[N+](=O)[O-] ZINC000193994840 1433098066 /nfs/dbraw/zinc/09/80/66/1433098066.db2.gz CTFQJDGVCOKGDG-INIZCTEOSA-N 0 0 376.434 3.438 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(=O)Nc1c(C)cccc1C(C)C ZINC000194027565 1433103903 /nfs/dbraw/zinc/10/39/03/1433103903.db2.gz YXRCNUQMZSGEDL-UHFFFAOYSA-N 0 0 385.420 3.290 20 5 GGBDRN COc1cc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])ccc1OCC(F)(F)F ZINC000194032715 1433104474 /nfs/dbraw/zinc/10/44/74/1433104474.db2.gz RVYDERVIAKNDQQ-UHFFFAOYSA-N 0 0 399.325 3.256 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000194037324 1433105415 /nfs/dbraw/zinc/10/54/15/1433105415.db2.gz VTQCYNLRVKSNOH-UHFFFAOYSA-N 0 0 388.399 3.092 20 5 GGBDRN COc1cccc(C(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)c1[N+](=O)[O-] ZINC000194037912 1433105433 /nfs/dbraw/zinc/10/54/33/1433105433.db2.gz QLOVDEKDNISQGZ-UHFFFAOYSA-N 0 0 375.406 3.467 20 5 GGBDRN COc1cccc(C)c1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000194037530 1433105453 /nfs/dbraw/zinc/10/54/53/1433105453.db2.gz FUSGNVNPXUDNQG-UHFFFAOYSA-N 0 0 383.404 3.042 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2nc(-c3ccccc3)cs2)ccc1[N+](=O)[O-] ZINC000194037345 1433105514 /nfs/dbraw/zinc/10/55/14/1433105514.db2.gz RPYICPZHLXFOMA-UHFFFAOYSA-N 0 0 396.428 3.395 20 5 GGBDRN CC[C@H]1c2ccsc2CCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000194048473 1433107261 /nfs/dbraw/zinc/10/72/61/1433107261.db2.gz TZRBPNYWOZSIBM-AWEZNQCLSA-N 0 0 389.433 3.139 20 5 GGBDRN CCOC(=O)c1c2c(sc1NC(=O)c1c([N+](=O)[O-])c(C)nn1C)CCCC2 ZINC000194068010 1433111041 /nfs/dbraw/zinc/11/10/41/1433111041.db2.gz PBUYYFVEOOARAO-UHFFFAOYSA-N 0 0 392.437 3.006 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000194070561 1433111759 /nfs/dbraw/zinc/11/17/59/1433111759.db2.gz ZIEMSADAMHMMNB-FXAWDEMLSA-N 0 0 398.463 3.474 20 5 GGBDRN O=C(NCC[C@@H]1C(=O)Nc2ccccc21)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000194088317 1433114773 /nfs/dbraw/zinc/11/47/73/1433114773.db2.gz DCOYJBWDRPIAFC-INIZCTEOSA-N 0 0 394.431 3.051 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)C(=O)N1CCC[C@H]1C1CCCC1 ZINC000194096737 1433116764 /nfs/dbraw/zinc/11/67/64/1433116764.db2.gz VCIFQYCAWIXFNQ-AWEZNQCLSA-N 0 0 397.378 3.316 20 5 GGBDRN O=C(NCC[C@@H]1C(=O)Nc2ccccc21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000194096859 1433116904 /nfs/dbraw/zinc/11/69/04/1433116904.db2.gz OBDRZYIRZMJFNL-HNNXBMFYSA-N 0 0 380.404 3.025 20 5 GGBDRN CCCN(C(=O)[C@@H](C)N1C(=O)c2ccccc2C1=O)c1cccc([N+](=O)[O-])c1 ZINC000194123226 1433121391 /nfs/dbraw/zinc/12/13/91/1433121391.db2.gz DHEADQJIDUSRGP-CYBMUJFWSA-N 0 0 381.388 3.023 20 5 GGBDRN CCCN(C(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000194121741 1433121449 /nfs/dbraw/zinc/12/14/49/1433121449.db2.gz NWLVBVZPCPGJIU-QGZVFWFLSA-N 0 0 396.447 3.285 20 5 GGBDRN CCCN(C(=O)c1cnc2sc(C)c(C)n2c1=O)c1cccc([N+](=O)[O-])c1 ZINC000194126555 1433122097 /nfs/dbraw/zinc/12/20/97/1433122097.db2.gz LFAIIMNPGBBNEW-UHFFFAOYSA-N 0 0 386.433 3.338 20 5 GGBDRN CCCN(C(=O)c1ccc(=O)n(Cc2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000194127000 1433122333 /nfs/dbraw/zinc/12/23/33/1433122333.db2.gz QLOZDKQPKXSMGP-UHFFFAOYSA-N 0 0 392.415 3.257 20 5 GGBDRN CCCN(C(=O)CCn1cnc2sccc2c1=O)c1cccc([N+](=O)[O-])c1 ZINC000194132322 1433123028 /nfs/dbraw/zinc/12/30/28/1433123028.db2.gz DCLIOBVLNIIEKU-UHFFFAOYSA-N 0 0 386.433 3.200 20 5 GGBDRN CCCN(CC1CCCCC1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000194145055 1433125843 /nfs/dbraw/zinc/12/58/43/1433125843.db2.gz POCGJLGUHWXLAO-UHFFFAOYSA-N 0 0 377.441 3.361 20 5 GGBDRN CCCN(C(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000194146051 1433126462 /nfs/dbraw/zinc/12/64/62/1433126462.db2.gz VMYQHCZLIKZMJN-INIZCTEOSA-N 0 0 388.468 3.266 20 5 GGBDRN CC1(C)CCN(C(=O)c2cc3ccccc3c3cccnc23)CCS1(=O)=O ZINC000194169858 1433131117 /nfs/dbraw/zinc/13/11/17/1433131117.db2.gz FDBNJSAIZPOZPD-UHFFFAOYSA-N 0 0 382.485 3.427 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000194183295 1433134072 /nfs/dbraw/zinc/13/40/72/1433134072.db2.gz OCJHMADSGPYPLN-ZFWWWQNUSA-N 0 0 393.509 3.474 20 5 GGBDRN COc1ccc2ccccc2c1CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1 ZINC000194208751 1433139361 /nfs/dbraw/zinc/13/93/61/1433139361.db2.gz ZAOKRRSNXPRLIZ-UHFFFAOYSA-N 0 0 387.417 3.016 20 5 GGBDRN O=C1CCCN1Cc1ccc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1 ZINC000194221234 1433141452 /nfs/dbraw/zinc/14/14/52/1433141452.db2.gz IZBZJNOOXQDHTJ-UHFFFAOYSA-N 0 0 394.431 3.214 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NC[C@@H](C)c2nncn2C)cc1[N+](=O)[O-] ZINC000194255173 1433149870 /nfs/dbraw/zinc/14/98/70/1433149870.db2.gz IEBVOJWKANRDPT-CYBMUJFWSA-N 0 0 391.497 3.395 20 5 GGBDRN O=C(Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1)c1ccc([N+](=O)[O-])s1 ZINC000194259028 1433150701 /nfs/dbraw/zinc/15/07/01/1433150701.db2.gz MCTWHPHFNXFSDA-UHFFFAOYSA-N 0 0 395.824 3.034 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)CC1 ZINC000194270416 1433153085 /nfs/dbraw/zinc/15/30/85/1433153085.db2.gz CQUVBFMIQRWZDU-UHFFFAOYSA-N 0 0 393.509 3.474 20 5 GGBDRN COc1cccc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ncccn2)c1[N+](=O)[O-] ZINC000194276128 1433154055 /nfs/dbraw/zinc/15/40/55/1433154055.db2.gz CRFPEIPTOPHFDL-UHFFFAOYSA-N 0 0 396.407 3.129 20 5 GGBDRN Cc1c(CC(=O)N2CCN(c3cncc4ccccc43)CC2)cccc1[N+](=O)[O-] ZINC000194283488 1433154972 /nfs/dbraw/zinc/15/49/72/1433154972.db2.gz MNYDUNVFZKJRJZ-UHFFFAOYSA-N 0 0 390.443 3.343 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3cncc4ccccc43)CC2)cc([N+](=O)[O-])c1 ZINC000194283153 1433155004 /nfs/dbraw/zinc/15/50/04/1433155004.db2.gz MXIQKRRXRLKOTI-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN CCOC(=O)[C@]1(C(C)C)CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000194286427 1433155551 /nfs/dbraw/zinc/15/55/51/1433155551.db2.gz FNCKMGUPSZVNKQ-ORAYPTAESA-N 0 0 380.416 3.275 20 5 GGBDRN C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000194293630 1433156790 /nfs/dbraw/zinc/15/67/90/1433156790.db2.gz YUKPODFCAPAIAH-SJKOYZFVSA-N 0 0 391.493 3.132 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC3(c4nc[nH]n4)CCC3)cc2[N+](=O)[O-])C1 ZINC000194292872 1433156866 /nfs/dbraw/zinc/15/68/66/1433156866.db2.gz ALEAKRCSDWYQSH-ZIAGYGMSSA-N 0 0 398.467 3.004 20 5 GGBDRN CCOC(=O)[C@]1(C(C)C)CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000194295270 1433157219 /nfs/dbraw/zinc/15/72/19/1433157219.db2.gz BEKVBYCQNJMSNM-HXUWFJFHSA-N 0 0 385.420 3.194 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000194303040 1433158398 /nfs/dbraw/zinc/15/83/98/1433158398.db2.gz AFTOUAABRWBUEX-CQSZACIVSA-N 0 0 385.420 3.249 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC1(c2ccccc2)CCOCC1 ZINC000194314783 1433160001 /nfs/dbraw/zinc/16/00/01/1433160001.db2.gz NOWWPNWVXHYPQR-UHFFFAOYSA-N 0 0 383.448 3.485 20 5 GGBDRN COc1cccc(C(=O)Nc2nnc(Cc3ccccc3F)s2)c1[N+](=O)[O-] ZINC000194317952 1433160661 /nfs/dbraw/zinc/16/06/61/1433160661.db2.gz SLALLTKPVINFHB-UHFFFAOYSA-N 0 0 388.380 3.437 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000194325613 1433161692 /nfs/dbraw/zinc/16/16/92/1433161692.db2.gz CORZWJAWNMBXLS-FQEVSTJZSA-N 0 0 376.416 3.356 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c(Cl)c1 ZINC000194330659 1433162703 /nfs/dbraw/zinc/16/27/03/1433162703.db2.gz AKZMZYVOCNCOSZ-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)c3cccc(F)c3[N+](=O)[O-])ccc12 ZINC000194332692 1433162897 /nfs/dbraw/zinc/16/28/97/1433162897.db2.gz GQDDSNGNIWGXEL-UHFFFAOYSA-N 0 0 393.348 3.170 20 5 GGBDRN CN(CCOc1cccc(Cl)c1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194337314 1433163504 /nfs/dbraw/zinc/16/35/04/1433163504.db2.gz ZMIRCRXDEHGILX-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194337166 1433163566 /nfs/dbraw/zinc/16/35/66/1433163566.db2.gz PLEVNFLLWXMLGW-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@H]1CCSc2ccc(F)cc21 ZINC000194337499 1433163589 /nfs/dbraw/zinc/16/35/89/1433163589.db2.gz JTLLDNVLXDZGIK-LBPRGKRZSA-N 0 0 386.401 3.388 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCCCCOc1ccc(F)cc1 ZINC000194339172 1433163788 /nfs/dbraw/zinc/16/37/88/1433163788.db2.gz KYDRWSAUHWTOQH-UHFFFAOYSA-N 0 0 386.376 3.011 20 5 GGBDRN C[C@H](NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000194346152 1433164746 /nfs/dbraw/zinc/16/47/46/1433164746.db2.gz RKTUJPOQULZEBH-VIFPVBQESA-N 0 0 390.339 3.375 20 5 GGBDRN CN(c1ccccc1)C1CCN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000194349182 1433165141 /nfs/dbraw/zinc/16/51/41/1433165141.db2.gz GSQBLSZKLZDLPE-UHFFFAOYSA-N 0 0 393.440 3.023 20 5 GGBDRN C[C@@H](CN1CCCC1=O)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000194366590 1433167843 /nfs/dbraw/zinc/16/78/43/1433167843.db2.gz SFWDSOOXGYJQAS-AWEZNQCLSA-N 0 0 382.420 3.079 20 5 GGBDRN COCCn1cc(C(=O)NCc2cc([N+](=O)[O-])ccc2OC)c2ccccc21 ZINC000194383534 1433169725 /nfs/dbraw/zinc/16/97/25/1433169725.db2.gz JMSDCWWAVQRSEC-UHFFFAOYSA-N 0 0 383.404 3.135 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000194383605 1433169728 /nfs/dbraw/zinc/16/97/28/1433169728.db2.gz GGGPRSQVWNKAEV-OAHLLOKOSA-N 0 0 383.452 3.241 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 ZINC000194389215 1433170835 /nfs/dbraw/zinc/17/08/35/1433170835.db2.gz YTTDYBKTMRLCEG-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN Cc1nn(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1Br ZINC000194389179 1433170903 /nfs/dbraw/zinc/17/09/03/1433170903.db2.gz SNLVCPHCYDGXDY-UHFFFAOYSA-N 0 0 387.621 3.463 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC1CCN(C(=O)c2ccccc2F)CC1 ZINC000194405243 1433172939 /nfs/dbraw/zinc/17/29/39/1433172939.db2.gz CGAUFLIOWLSOLY-UHFFFAOYSA-N 0 0 385.395 3.077 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n(-c2ccc(F)cc2)n1 ZINC000194417573 1433174849 /nfs/dbraw/zinc/17/48/49/1433174849.db2.gz SJRSRJUSTFJMOS-UHFFFAOYSA-N 0 0 385.311 3.389 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1c[nH]c(=S)n1-c1ccccc1 ZINC000194417455 1433174854 /nfs/dbraw/zinc/17/48/54/1433174854.db2.gz QSXZUNZGFPVRNI-UHFFFAOYSA-N 0 0 384.417 3.008 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(C)n(-c2nccs2)c1C ZINC000194419007 1433175154 /nfs/dbraw/zinc/17/51/54/1433175154.db2.gz NFIODGWBZRUROL-UHFFFAOYSA-N 0 0 386.433 3.397 20 5 GGBDRN CC(C)n1nccc1NC(=O)[C@@H](C)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000194428539 1433176555 /nfs/dbraw/zinc/17/65/55/1433176555.db2.gz DRVXWFFMSZPHKC-GFCCVEGCSA-N 0 0 379.848 3.485 20 5 GGBDRN CC(C)n1nccc1NC(=O)[C@H](C)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000194428550 1433176588 /nfs/dbraw/zinc/17/65/88/1433176588.db2.gz DRVXWFFMSZPHKC-LBPRGKRZSA-N 0 0 379.848 3.485 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@H](c3nc(N(C)C)no3)C2)cc1[N+](=O)[O-] ZINC000194462479 1433182212 /nfs/dbraw/zinc/18/22/12/1433182212.db2.gz QNJPPGZEKLSIGO-AWEZNQCLSA-N 0 0 387.440 3.187 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000194461453 1433182340 /nfs/dbraw/zinc/18/23/40/1433182340.db2.gz PXWKFVFJDKMDLK-CQSZACIVSA-N 0 0 384.436 3.295 20 5 GGBDRN C[C@H]1CCCC[C@H]1CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194463725 1433182496 /nfs/dbraw/zinc/18/24/96/1433182496.db2.gz IYMHVZJNWNATIR-QWRGUYRKSA-N 0 0 385.367 3.077 20 5 GGBDRN C[C@@H]1CCCC[C@H]1CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194463711 1433182591 /nfs/dbraw/zinc/18/25/91/1433182591.db2.gz IYMHVZJNWNATIR-MNOVXSKESA-N 0 0 385.367 3.077 20 5 GGBDRN CC[C@@]1(c2ccc(NC(=O)c3c(C)cccc3[N+](=O)[O-])cc2)CCC(=O)NC1=O ZINC000194479491 1433184792 /nfs/dbraw/zinc/18/47/92/1433184792.db2.gz YOEIAHFRFKRYEW-NRFANRHFSA-N 0 0 395.415 3.240 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1 ZINC000194487857 1433186258 /nfs/dbraw/zinc/18/62/58/1433186258.db2.gz ODKDDLNUHQYPNC-MRXNPFEDSA-N 0 0 383.448 3.054 20 5 GGBDRN COc1cc(CCNC(=O)N[C@H](C)c2cc(C)oc2C)c([N+](=O)[O-])cc1OC ZINC000194491066 1433186571 /nfs/dbraw/zinc/18/65/71/1433186571.db2.gz LNMMQSREZTWDEU-GFCCVEGCSA-N 0 0 391.424 3.425 20 5 GGBDRN CSc1ccc(C(=O)N2CCc3c(cccc3NC(C)=O)C2)cc1[N+](=O)[O-] ZINC000194494228 1433187176 /nfs/dbraw/zinc/18/71/76/1433187176.db2.gz NEVOPVAMVWQSOL-UHFFFAOYSA-N 0 0 385.445 3.474 20 5 GGBDRN CC(=O)Nc1cccc2c1CCN(C(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)C2 ZINC000194495357 1433187417 /nfs/dbraw/zinc/18/74/17/1433187417.db2.gz NHNOFIKBEIMIAA-UHFFFAOYSA-N 0 0 394.431 3.326 20 5 GGBDRN CC(=O)Nc1cccc2c1CCN(C(=O)CSc1ccc([N+](=O)[O-])cc1)C2 ZINC000194504794 1433188884 /nfs/dbraw/zinc/18/88/84/1433188884.db2.gz IWVKZAHHWKBNCA-UHFFFAOYSA-N 0 0 385.445 3.230 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(C(=O)N2CCSCC2)c1 ZINC000194505127 1433189198 /nfs/dbraw/zinc/18/91/98/1433189198.db2.gz MOFWWIMLEBXNFS-UHFFFAOYSA-N 0 0 385.445 3.345 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000194518500 1433191069 /nfs/dbraw/zinc/19/10/69/1433191069.db2.gz LADPSFOLRANJJK-CQSZACIVSA-N 0 0 377.441 3.280 20 5 GGBDRN COc1cc(CCNC(=O)NCc2ccc(C)c(F)c2)c([N+](=O)[O-])cc1OC ZINC000194518497 1433191092 /nfs/dbraw/zinc/19/10/92/1433191092.db2.gz SVVDEKNGDYMRCH-UHFFFAOYSA-N 0 0 391.399 3.101 20 5 GGBDRN C[C@H](NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194558557 1433197226 /nfs/dbraw/zinc/19/72/26/1433197226.db2.gz JAOZPYVGWYGNDZ-AWEZNQCLSA-N 0 0 399.407 3.096 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000194559106 1433197246 /nfs/dbraw/zinc/19/72/46/1433197246.db2.gz MCFRWJPLJBEGKG-HNNXBMFYSA-N 0 0 390.484 3.336 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)c3c(C)cccc3[N+](=O)[O-])cc2)n1 ZINC000194570846 1433199225 /nfs/dbraw/zinc/19/92/25/1433199225.db2.gz RJNDAKQTDXHMMD-UHFFFAOYSA-N 0 0 380.404 3.488 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)N1Cc2ccccc2C1 ZINC000194580495 1433201121 /nfs/dbraw/zinc/20/11/21/1433201121.db2.gz GFQMSZKAJCWTPB-UHFFFAOYSA-N 0 0 383.223 3.062 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1Cl ZINC000194598718 1433203541 /nfs/dbraw/zinc/20/35/41/1433203541.db2.gz OXWIXAQCCUSLLV-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN O=C(NCc1ccc2ncccc2c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000194599268 1433203633 /nfs/dbraw/zinc/20/36/33/1433203633.db2.gz JFYBMSYPEKCMCS-UHFFFAOYSA-N 0 0 391.431 3.175 20 5 GGBDRN O=[N+]([O-])c1cc(CSc2nnc(Cc3ccccc3)[nH]2)c2c(c1)COCO2 ZINC000194603598 1433204264 /nfs/dbraw/zinc/20/42/64/1433204264.db2.gz JBLQEDVZNCHMND-UHFFFAOYSA-N 0 0 384.417 3.463 20 5 GGBDRN O=C(N[C@@H]1CCc2n[nH]cc2C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194607851 1433204995 /nfs/dbraw/zinc/20/49/95/1433204995.db2.gz QARTZJQXCHQPKG-MRXNPFEDSA-N 0 0 392.415 3.184 20 5 GGBDRN COc1cccc(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)c1[N+](=O)[O-] ZINC000194612983 1433205554 /nfs/dbraw/zinc/20/55/54/1433205554.db2.gz YRHUUGUDSVIRLI-LBPRGKRZSA-N 0 0 382.376 3.068 20 5 GGBDRN Cc1c(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)nnn1Cc1ccc(F)cc1 ZINC000194617163 1433206074 /nfs/dbraw/zinc/20/60/74/1433206074.db2.gz AZTKRBQFHNRYMA-UHFFFAOYSA-N 0 0 397.410 3.347 20 5 GGBDRN COc1cccc(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1[N+](=O)[O-] ZINC000194616649 1433206079 /nfs/dbraw/zinc/20/60/79/1433206079.db2.gz KRSYBMIGKQPFCU-GFCCVEGCSA-N 0 0 382.376 3.068 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)ccc21 ZINC000194620377 1433206568 /nfs/dbraw/zinc/20/65/68/1433206568.db2.gz SVJJRQGVQWAENW-UHFFFAOYSA-N 0 0 394.412 3.490 20 5 GGBDRN COc1c(C)cnc(CN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000194621309 1433206853 /nfs/dbraw/zinc/20/68/53/1433206853.db2.gz URRGCYPUZOIUGL-UHFFFAOYSA-N 0 0 399.856 3.089 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000194622660 1433206869 /nfs/dbraw/zinc/20/68/69/1433206869.db2.gz OKJBYMSLBDCUSM-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)CCCCc1ccccc1 ZINC000194631493 1433208235 /nfs/dbraw/zinc/20/82/35/1433208235.db2.gz LPVGYUVKJQVKCV-MRXNPFEDSA-N 0 0 383.448 3.194 20 5 GGBDRN CC(C)(C)[S@](=O)Cc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000194633666 1433208542 /nfs/dbraw/zinc/20/85/42/1433208542.db2.gz YWMPQZVWHUVLFP-RUZDIDTESA-N 0 0 396.490 3.443 20 5 GGBDRN Cc1cc2ncn(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)c2cc1C ZINC000194643224 1433210221 /nfs/dbraw/zinc/21/02/21/1433210221.db2.gz SJFMCUODULRQKL-UHFFFAOYSA-N 0 0 396.403 3.361 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1[N+](=O)[O-] ZINC000194662640 1433212484 /nfs/dbraw/zinc/21/24/84/1433212484.db2.gz KIXINZWXYZQBGG-UHFFFAOYSA-N 0 0 389.748 3.405 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2ccc(Cl)cn2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000194670641 1433213426 /nfs/dbraw/zinc/21/34/26/1433213426.db2.gz IRORIYFEEHEHQV-JTQLQIEISA-N 0 0 386.799 3.023 20 5 GGBDRN CCOC(=O)[C@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194683629 1433215256 /nfs/dbraw/zinc/21/52/56/1433215256.db2.gz JLLJPGJKQFFDAG-OAHLLOKOSA-N 0 0 389.433 3.276 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](C2N=NC(=S)N2C(C)C)C1 ZINC000194694776 1433216346 /nfs/dbraw/zinc/21/63/46/1433216346.db2.gz SVSAVKSZTQKADB-CYBMUJFWSA-N 0 0 389.481 3.384 20 5 GGBDRN CC(C)c1ncc(Cl)c(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000194693068 1433216366 /nfs/dbraw/zinc/21/63/66/1433216366.db2.gz QSNFLSQVJLVUPT-UHFFFAOYSA-N 0 0 389.843 3.124 20 5 GGBDRN Cc1nc(CN2CCC(CNC(=O)c3c(C)cccc3[N+](=O)[O-])CC2)oc1C ZINC000194695491 1433216630 /nfs/dbraw/zinc/21/66/30/1433216630.db2.gz FQDUJBBWEQRLLM-UHFFFAOYSA-N 0 0 386.452 3.150 20 5 GGBDRN Cc1ccc2oc(N3CCN(C(=O)c4c(C)cccc4[N+](=O)[O-])CC3)nc2c1 ZINC000194698752 1433216795 /nfs/dbraw/zinc/21/67/95/1433216795.db2.gz HCXMIXWPGLQKRY-UHFFFAOYSA-N 0 0 380.404 3.315 20 5 GGBDRN CCn1ncc2ccc(NC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)cc21 ZINC000194709227 1433218286 /nfs/dbraw/zinc/21/82/86/1433218286.db2.gz SENUZVBVWSQWJI-UHFFFAOYSA-N 0 0 376.376 3.402 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC1(c2ccc(F)cc2F)CCC1 ZINC000194724560 1433220202 /nfs/dbraw/zinc/22/02/02/1433220202.db2.gz ICMOBFJIGAQALF-UHFFFAOYSA-N 0 0 389.358 3.316 20 5 GGBDRN C[C@@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194728366 1433221206 /nfs/dbraw/zinc/22/12/06/1433221206.db2.gz MZVCNPXGKGNUJX-JTQLQIEISA-N 0 0 395.437 3.253 20 5 GGBDRN Cc1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1N1CCCS1(=O)=O ZINC000194748078 1433223956 /nfs/dbraw/zinc/22/39/56/1433223956.db2.gz FKPBVKLRGPCKGU-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1=O ZINC000194754240 1433225345 /nfs/dbraw/zinc/22/53/45/1433225345.db2.gz NCHMFRLXRZOTNA-CQSZACIVSA-N 0 0 387.823 3.482 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCC(O)(c3c(F)cccc3F)CC2)c([N+](=O)[O-])c1 ZINC000194759499 1433225833 /nfs/dbraw/zinc/22/58/33/1433225833.db2.gz FGHRTEMHKBZUKU-UHFFFAOYSA-N 0 0 393.346 3.265 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(-c3cnco3)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000194758895 1433225837 /nfs/dbraw/zinc/22/58/37/1433225837.db2.gz LFGXCBDRHUSSHJ-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN COc1ccc(OC(=O)CCn2c(=O)oc3cc(Cl)ccc32)c([N+](=O)[O-])c1 ZINC000194759883 1433225892 /nfs/dbraw/zinc/22/58/92/1433225892.db2.gz OPDHWFSJSGCBCO-UHFFFAOYSA-N 0 0 392.751 3.160 20 5 GGBDRN COc1ccc(CSCC(=O)N(C)[C@@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000194771981 1433228659 /nfs/dbraw/zinc/22/86/59/1433228659.db2.gz AMHURBRPCYTIHY-ZDUSSCGKSA-N 0 0 375.450 3.451 20 5 GGBDRN Cc1ccc(CNC(=O)C2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 ZINC000194792599 1433233363 /nfs/dbraw/zinc/23/33/63/1433233363.db2.gz SZGFCQOLCZASSJ-UHFFFAOYSA-N 0 0 395.459 3.380 20 5 GGBDRN CSc1ccc(C(=O)NCc2ccc(-n3ccnc3C)nc2)cc1[N+](=O)[O-] ZINC000194792787 1433233868 /nfs/dbraw/zinc/23/38/68/1433233868.db2.gz QRLYXWUHAWWPLG-UHFFFAOYSA-N 0 0 383.433 3.136 20 5 GGBDRN COc1ccccc1-n1ncc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1C ZINC000194794900 1433234146 /nfs/dbraw/zinc/23/41/46/1433234146.db2.gz BDGMUWOPBZBYMB-UHFFFAOYSA-N 0 0 378.388 3.300 20 5 GGBDRN COc1ccc2c(c1)[nH]nc2NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194799007 1433235435 /nfs/dbraw/zinc/23/54/35/1433235435.db2.gz YNJHXGNGTDYQFO-UHFFFAOYSA-N 0 0 378.291 3.333 20 5 GGBDRN CN(C[C@@H]1CCC[C@H]1O)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194807049 1433236959 /nfs/dbraw/zinc/23/69/59/1433236959.db2.gz ONZCRWHCLCCZOO-OXJNMPFZSA-N 0 0 384.432 3.407 20 5 GGBDRN CCOc1ccc(C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1[N+](=O)[O-] ZINC000194812834 1433238279 /nfs/dbraw/zinc/23/82/79/1433238279.db2.gz ZHDUJZQIUFFGDT-UHFFFAOYSA-N 0 0 389.383 3.222 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(C)n(Cc2ccccn2)c1C ZINC000194815277 1433239377 /nfs/dbraw/zinc/23/93/77/1433239377.db2.gz HXDYXFAWYICKGD-UHFFFAOYSA-N 0 0 394.431 3.395 20 5 GGBDRN COc1cccc(C(=O)N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000194827823 1433242323 /nfs/dbraw/zinc/24/23/23/1433242323.db2.gz GWNMHCPZBJZWJZ-YOEHRIQHSA-N 0 0 378.331 3.142 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cnc(-c2ccccc2)nc1 ZINC000194828545 1433242503 /nfs/dbraw/zinc/24/25/03/1433242503.db2.gz ZCZQHQZBYAQSGN-UHFFFAOYSA-N 0 0 379.376 3.382 20 5 GGBDRN COc1cccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000194830604 1433243099 /nfs/dbraw/zinc/24/30/99/1433243099.db2.gz XERNOJLVHDZUFU-CYBMUJFWSA-N 0 0 375.812 3.266 20 5 GGBDRN CN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194835285 1433244483 /nfs/dbraw/zinc/24/44/83/1433244483.db2.gz WUPHENJWGBAGAL-MRXNPFEDSA-N 0 0 398.337 3.169 20 5 GGBDRN COc1cc(CCNC(=O)CCc2cccc(F)c2F)c([N+](=O)[O-])cc1OC ZINC000194841480 1433246000 /nfs/dbraw/zinc/24/60/00/1433246000.db2.gz SYONRVOZRMRDQA-UHFFFAOYSA-N 0 0 394.374 3.182 20 5 GGBDRN COc1cccc(C2CCN(CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)CC2)c1 ZINC000194843279 1433246519 /nfs/dbraw/zinc/24/65/19/1433246519.db2.gz NWHAKOLBQKSXIL-UHFFFAOYSA-N 0 0 395.415 3.037 20 5 GGBDRN O=C(NCCCc1cccc(Cl)c1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000194845712 1433247442 /nfs/dbraw/zinc/24/74/42/1433247442.db2.gz MWXNGKPCGGJKSW-UHFFFAOYSA-N 0 0 385.811 3.192 20 5 GGBDRN O=C(NC1CCC(CO)CC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194848982 1433247869 /nfs/dbraw/zinc/24/78/69/1433247869.db2.gz HYDVLSBKYPPRPV-UHFFFAOYSA-N 0 0 384.432 3.455 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000194849591 1433248313 /nfs/dbraw/zinc/24/83/13/1433248313.db2.gz ALCARMIYGAHOPS-CYBMUJFWSA-N 0 0 398.337 3.092 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000194849709 1433248597 /nfs/dbraw/zinc/24/85/97/1433248597.db2.gz OBWKEMFDBIZHFJ-NSHDSACASA-N 0 0 399.230 3.380 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NCc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])n2)c1 ZINC000194858528 1433250245 /nfs/dbraw/zinc/25/02/45/1433250245.db2.gz OTRDAYIPGONKDV-LLVKDONJSA-N 0 0 399.363 3.412 20 5 GGBDRN CC1(CO)CCN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC1 ZINC000194861409 1433251263 /nfs/dbraw/zinc/25/12/63/1433251263.db2.gz DMNVBIVCSUBXPX-UHFFFAOYSA-N 0 0 384.432 3.408 20 5 GGBDRN O=C(NCC1(CO)CCCC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194871556 1433253180 /nfs/dbraw/zinc/25/31/80/1433253180.db2.gz IYDJMWILZPAINU-UHFFFAOYSA-N 0 0 384.432 3.456 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OS(=O)(=O)c2cccc(Cl)c2Cl)c1 ZINC000194897435 1433259836 /nfs/dbraw/zinc/25/98/36/1433259836.db2.gz UPTRWEAHUZTBGL-UHFFFAOYSA-N 0 0 376.173 3.482 20 5 GGBDRN Cc1c(C(=O)Nc2cnn(Cc3ccccn3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000194909481 1433262389 /nfs/dbraw/zinc/26/23/89/1433262389.db2.gz YKAJOPQWKOOUNG-UHFFFAOYSA-N 0 0 396.363 3.012 20 5 GGBDRN CC(C)CCOC1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000194915595 1433263882 /nfs/dbraw/zinc/26/38/82/1433263882.db2.gz QLWWVYYXMGYZSI-UHFFFAOYSA-N 0 0 386.452 3.448 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000194919924 1433264458 /nfs/dbraw/zinc/26/44/58/1433264458.db2.gz WCCRDGDMPYXRID-QGZVFWFLSA-N 0 0 390.484 3.213 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000194921198 1433264831 /nfs/dbraw/zinc/26/48/31/1433264831.db2.gz VEXSNOYPOFTARJ-UHFFFAOYSA-N 0 0 391.374 3.355 20 5 GGBDRN COc1cccc(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000194926037 1433265902 /nfs/dbraw/zinc/26/59/02/1433265902.db2.gz CIUZUDQNRPPJDH-UHFFFAOYSA-N 0 0 386.379 3.478 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n(-c2ccccn2)n1 ZINC000194929870 1433266756 /nfs/dbraw/zinc/26/67/56/1433266756.db2.gz FRFHWTILQPBIEY-UHFFFAOYSA-N 0 0 392.419 3.336 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cnn(Cc2ccccn2)c1 ZINC000194932945 1433267577 /nfs/dbraw/zinc/26/75/77/1433267577.db2.gz QCVDRTPLIUYWJX-UHFFFAOYSA-N 0 0 380.408 3.065 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1nc2c(s1)C[C@@H](c1ccccc1)CC2 ZINC000194934191 1433267776 /nfs/dbraw/zinc/26/77/76/1433267776.db2.gz KYGTYIHDFXURGR-ZDUSSCGKSA-N 0 0 383.433 3.159 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(OCCc3ccccc3)CC2)c1 ZINC000194944510 1433270168 /nfs/dbraw/zinc/27/01/68/1433270168.db2.gz RYMRKIXOYKFZMI-UHFFFAOYSA-N 0 0 384.432 3.467 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cnc2c(cnn2Cc2ccccc2)c1 ZINC000194951988 1433271773 /nfs/dbraw/zinc/27/17/73/1433271773.db2.gz JFQYXTUNPAXEFS-UHFFFAOYSA-N 0 0 387.399 3.318 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1 ZINC000194970122 1433274491 /nfs/dbraw/zinc/27/44/91/1433274491.db2.gz UIIIVQOCNNSLJV-KRWDZBQOSA-N 0 0 381.392 3.373 20 5 GGBDRN CC1(C)CCN(Cc2cc(=O)oc3ccc4ccccc4c23)CCS1(=O)=O ZINC000194973777 1433275084 /nfs/dbraw/zinc/27/50/84/1433275084.db2.gz IUILAVZIIQTNLQ-UHFFFAOYSA-N 0 0 385.485 3.345 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCC1CCOCC1 ZINC000194991508 1433277963 /nfs/dbraw/zinc/27/79/63/1433277963.db2.gz SFZVFJSEEQMYKR-UHFFFAOYSA-N 0 0 391.449 3.234 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000194999015 1433278724 /nfs/dbraw/zinc/27/87/24/1433278724.db2.gz RZKUZYNJQPGFEL-UHFFFAOYSA-N 0 0 387.411 3.009 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCOC[C@]34CCOC4)o2)c(Cl)c1 ZINC000195017469 1433281265 /nfs/dbraw/zinc/28/12/65/1433281265.db2.gz HGRIKLYISPNFOY-GOSISDBHSA-N 0 0 378.812 3.500 20 5 GGBDRN C[C@@H]1CCc2c(sc3nc(Cn4cc([N+](=O)[O-])c(C5CC5)n4)nc(N)c23)C1 ZINC000195039659 1433284268 /nfs/dbraw/zinc/28/42/68/1433284268.db2.gz SZBDHSQUTLFUHK-SECBINFHSA-N 0 0 384.465 3.429 20 5 GGBDRN COc1ccc(NC(=O)CN[C@@H](c2nccs2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000195046430 1433284998 /nfs/dbraw/zinc/28/49/98/1433284998.db2.gz FULPQACPNGJAPF-GOSISDBHSA-N 0 0 398.444 3.378 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H](c2nccs2)c2ccccc2)c1 ZINC000195061462 1433286911 /nfs/dbraw/zinc/28/69/11/1433286911.db2.gz NAGJKSYXQYVSAW-AEFFLSMTSA-N 0 0 385.445 3.170 20 5 GGBDRN Cc1c(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)oc2ccc(F)cc12 ZINC000195071915 1433288829 /nfs/dbraw/zinc/28/88/29/1433288829.db2.gz PNMSWVZMTXDGMZ-UHFFFAOYSA-N 0 0 385.351 3.352 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000195129465 1433296547 /nfs/dbraw/zinc/29/65/47/1433296547.db2.gz PPZCDGJLZCQUHL-KRWDZBQOSA-N 0 0 399.447 3.354 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@H](C)c2ccco2)c([N+](=O)[O-])cc1OC ZINC000195129400 1433296765 /nfs/dbraw/zinc/29/67/65/1433296765.db2.gz GASXBEKYXDNRNC-GFCCVEGCSA-N 0 0 377.397 3.150 20 5 GGBDRN CCOc1cc(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c([N+](=O)[O-])cc1OC ZINC000195130754 1433296848 /nfs/dbraw/zinc/29/68/48/1433296848.db2.gz CTQUMVNPLLOMOM-NSHDSACASA-N 0 0 384.392 3.369 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCNC(=O)C[C@@H]1c1ccccc1 ZINC000195136617 1433297666 /nfs/dbraw/zinc/29/76/66/1433297666.db2.gz SXUMGYRKRLJUEK-OAHLLOKOSA-N 0 0 388.811 3.343 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCNC(=O)C[C@H]1c1ccccc1 ZINC000195136609 1433297764 /nfs/dbraw/zinc/29/77/64/1433297764.db2.gz SXUMGYRKRLJUEK-HNNXBMFYSA-N 0 0 388.811 3.343 20 5 GGBDRN O=C(NCc1nccn1C(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000195186302 1433304520 /nfs/dbraw/zinc/30/45/20/1433304520.db2.gz LDWVNWGHUKKXAR-UHFFFAOYSA-N 0 0 379.348 3.240 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000195198862 1433306199 /nfs/dbraw/zinc/30/61/99/1433306199.db2.gz LHDKPEJBINSAJD-HIFRSBDPSA-N 0 0 393.509 3.474 20 5 GGBDRN CC1(C)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCS1(=O)=O ZINC000195201777 1433306470 /nfs/dbraw/zinc/30/64/70/1433306470.db2.gz NCXKNMCNDIVHTL-UHFFFAOYSA-N 0 0 378.450 3.254 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(C(=O)N(C)C)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195214149 1433307999 /nfs/dbraw/zinc/30/79/99/1433307999.db2.gz FUKABMKNXQSELM-UHFFFAOYSA-N 0 0 386.364 3.074 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(OCCC(C)C)CC1 ZINC000195232686 1433310184 /nfs/dbraw/zinc/31/01/84/1433310184.db2.gz ZVLBPYHJSMWLCH-UHFFFAOYSA-N 0 0 384.498 3.373 20 5 GGBDRN O=C(NCc1ccc(Br)c(F)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000195237310 1433310644 /nfs/dbraw/zinc/31/06/44/1433310644.db2.gz ZPMDEDKSNHYGNN-UHFFFAOYSA-N 0 0 398.144 3.335 20 5 GGBDRN CCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000195240125 1433310809 /nfs/dbraw/zinc/31/08/09/1433310809.db2.gz JMKYUIMYMNJKHT-UHFFFAOYSA-N 0 0 386.364 3.122 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2C(=O)NCc2ccco2)ccc1[N+](=O)[O-] ZINC000195247030 1433311515 /nfs/dbraw/zinc/31/15/15/1433311515.db2.gz JCBMTPRKMUJKCX-UHFFFAOYSA-N 0 0 395.371 3.379 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc(Cn2nc(C)cc2C)c1 ZINC000195254781 1433312194 /nfs/dbraw/zinc/31/21/94/1433312194.db2.gz RIYWOYRSMSHVSB-UHFFFAOYSA-N 0 0 394.431 3.395 20 5 GGBDRN O=C(NCC(F)(F)F)c1ccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000195261298 1433312880 /nfs/dbraw/zinc/31/28/80/1433312880.db2.gz XKCIBBUTWPUGNB-UHFFFAOYSA-N 0 0 385.273 3.278 20 5 GGBDRN O=C(NCc1ccccn1)c1cccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1 ZINC000195290371 1433315562 /nfs/dbraw/zinc/31/55/62/1433315562.db2.gz ZXDISHUCGCVOCA-UHFFFAOYSA-N 0 0 394.362 3.311 20 5 GGBDRN O=C(NCc1ccc(NC(=O)c2cccnc2)cc1)c1ccc([N+](=O)[O-])s1 ZINC000195292208 1433315952 /nfs/dbraw/zinc/31/59/52/1433315952.db2.gz OBGHYZFMNWKAFC-UHFFFAOYSA-N 0 0 382.401 3.234 20 5 GGBDRN Cc1c(NC(=O)c2csc([N+](=O)[O-])c2)cccc1C(=O)N1CCSCC1 ZINC000195304561 1433317110 /nfs/dbraw/zinc/31/71/10/1433317110.db2.gz HFCZNVAMEPVYLT-UHFFFAOYSA-N 0 0 391.474 3.406 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC(OC2CCCC2)CC1 ZINC000195317180 1433318380 /nfs/dbraw/zinc/31/83/80/1433318380.db2.gz YVYLUNAPHKALOC-AWEZNQCLSA-N 0 0 391.468 3.354 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)c1[N+](=O)[O-] ZINC000195322245 1433318901 /nfs/dbraw/zinc/31/89/01/1433318901.db2.gz GGZAVSUVNFPHDH-UHFFFAOYSA-N 0 0 395.868 3.276 20 5 GGBDRN COc1cccc(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)c1[N+](=O)[O-] ZINC000195321814 1433318912 /nfs/dbraw/zinc/31/89/12/1433318912.db2.gz VUYGAVGBJSEISW-HNNXBMFYSA-N 0 0 377.828 3.290 20 5 GGBDRN O=C(NCCCn1cccn1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000195344963 1433321045 /nfs/dbraw/zinc/32/10/45/1433321045.db2.gz PDPCGNNACKQQJO-UHFFFAOYSA-N 0 0 380.404 3.190 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000195356645 1433322101 /nfs/dbraw/zinc/32/21/01/1433322101.db2.gz REBBPDLFAOQDDJ-GFCCVEGCSA-N 0 0 388.449 3.014 20 5 GGBDRN CCn1ncc2ccc(NC(=O)c3nnn(-c4cccc([N+](=O)[O-])c4)c3C)cc21 ZINC000195359724 1433322746 /nfs/dbraw/zinc/32/27/46/1433322746.db2.gz DLUMNQCELYTOMZ-UHFFFAOYSA-N 0 0 391.391 3.106 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3scnc3c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000195384239 1433324605 /nfs/dbraw/zinc/32/46/05/1433324605.db2.gz QPRQZKMLFBMIRT-UHFFFAOYSA-N 0 0 380.389 3.346 20 5 GGBDRN Cc1c(C(=O)N2CCC(OC3CCCC3)CC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000195398397 1433325447 /nfs/dbraw/zinc/32/54/47/1433325447.db2.gz DDQJEPOIUMLALV-UHFFFAOYSA-N 0 0 399.451 3.048 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccc(Oc2ccccc2)nc1 ZINC000195414059 1433327216 /nfs/dbraw/zinc/32/72/16/1433327216.db2.gz YDRMSKNQNWWZNT-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCc1ccc(Oc2ccccc2)nc1 ZINC000195415198 1433327271 /nfs/dbraw/zinc/32/72/71/1433327271.db2.gz KRBUASJMLUEDFU-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN CCCN(CCC)C(=O)c1ccc(NC(=O)c2n[nH]c(CC)c2[N+](=O)[O-])cc1 ZINC000195433255 1433329116 /nfs/dbraw/zinc/32/91/16/1433329116.db2.gz 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ZINC000237464853 1433404550 /nfs/dbraw/zinc/40/45/50/1433404550.db2.gz UUOPXTVHJZENOI-GFCCVEGCSA-N 0 0 397.884 3.349 20 5 GGBDRN C[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000237578287 1433410587 /nfs/dbraw/zinc/41/05/87/1433410587.db2.gz UUOPXTVHJZENOI-LBPRGKRZSA-N 0 0 397.884 3.349 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1COc2ccccc2O1 ZINC000245400258 1433460365 /nfs/dbraw/zinc/46/03/65/1433460365.db2.gz XSPSEJXYZIQEDB-BBRMVZONSA-N 0 0 396.403 3.478 20 5 GGBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000245402553 1433460660 /nfs/dbraw/zinc/46/06/60/1433460660.db2.gz ILYTXLBSKNZJNL-KZULUSFZSA-N 0 0 391.374 3.274 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](c2ccccc2)OC[C@H]1C ZINC000245403830 1433461107 /nfs/dbraw/zinc/46/11/07/1433461107.db2.gz NCXBSNTYFOJJEH-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)OC[C@H]2C)cc1[N+](=O)[O-] ZINC000245404871 1433461380 /nfs/dbraw/zinc/46/13/80/1433461380.db2.gz QUNPMEPIEAMQQO-RDTXWAMCSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)OC[C@H]2C)cc1[N+](=O)[O-] ZINC000245404870 1433461515 /nfs/dbraw/zinc/46/15/15/1433461515.db2.gz QUNPMEPIEAMQQO-KDOFPFPSSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000245419810 1433464049 /nfs/dbraw/zinc/46/40/49/1433464049.db2.gz MHFYGIZARJEFLJ-ZJWNCGCPSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000245422306 1433464673 /nfs/dbraw/zinc/46/46/73/1433464673.db2.gz PHOKSGSHBPQVGA-ZJWNCGCPSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000245424315 1433465274 /nfs/dbraw/zinc/46/52/74/1433465274.db2.gz RWHYXJXBRVEMJL-YMXBGEKHSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000245427618 1433465626 /nfs/dbraw/zinc/46/56/26/1433465626.db2.gz WCSJSEWOFQMIEH-ZJWNCGCPSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000245425839 1433465786 /nfs/dbraw/zinc/46/57/86/1433465786.db2.gz UHMZKDBABQIVSD-ZJWNCGCPSA-N 0 0 396.490 3.022 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245442447 1433468915 /nfs/dbraw/zinc/46/89/15/1433468915.db2.gz WIJHNEJFXLCKJU-FUHWJXTLSA-N 0 0 384.498 3.170 20 5 GGBDRN C[C@H](c1nc(Cc2ccccc2)no1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245448784 1433469567 /nfs/dbraw/zinc/46/95/67/1433469567.db2.gz NDJYCYBLDDAOIO-GDBMZVCRSA-N 0 0 394.435 3.211 20 5 GGBDRN Cc1cc(C)cc(NC(=O)[C@H](C)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000245447633 1433469655 /nfs/dbraw/zinc/46/96/55/1433469655.db2.gz MFMCWBWORYDGMQ-JKSUJKDBSA-N 0 0 383.452 3.120 20 5 GGBDRN CCO[C@H](C)c1nc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000245464687 1433473551 /nfs/dbraw/zinc/47/35/51/1433473551.db2.gz YAMKJJDQSSGORO-CHWSQXEVSA-N 0 0 377.470 3.230 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@H]3CC[C@H](O)CC3)cc2[N+](=O)[O-])C1 ZINC000245513057 1433479699 /nfs/dbraw/zinc/47/96/99/1433479699.db2.gz OIYZUTRFISPNBY-MUIFIZLQSA-N 0 0 375.469 3.110 20 5 GGBDRN O=C(O[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000245520327 1433480684 /nfs/dbraw/zinc/48/06/84/1433480684.db2.gz BRANVQVLHIDWTR-KBAYOESNSA-N 0 0 383.404 3.285 20 5 GGBDRN C[C@@H]1C[C@@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000245580456 1433487799 /nfs/dbraw/zinc/48/77/99/1433487799.db2.gz ISMIWTKRPPLRQJ-PTEHBNRSSA-N 0 0 389.374 3.488 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCO[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000245634574 1433493442 /nfs/dbraw/zinc/49/34/42/1433493442.db2.gz VZGCAONBQKKZCC-WMZOPIPTSA-N 0 0 383.448 3.174 20 5 GGBDRN C[C@@H]1C[C@H](C)C[C@@]2(C1)NC(=O)N(Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)C2=O ZINC000245633128 1433493471 /nfs/dbraw/zinc/49/34/71/1433493471.db2.gz UHCHHJLUGMOGRW-NXCRSVRDSA-N 0 0 398.419 3.497 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN(CC(F)(F)F)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000245641077 1433494381 /nfs/dbraw/zinc/49/43/81/1433494381.db2.gz AKJNPTSAXDBMDV-QWHCGFSZSA-N 0 0 388.390 3.242 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(CC(F)(F)F)[C@H](C)C1 ZINC000245656889 1433496565 /nfs/dbraw/zinc/49/65/65/1433496565.db2.gz DXVBRUKDIWUTNK-NEPJUHHUSA-N 0 0 391.415 3.170 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCO[C@H]([C@H]4CCCO4)C3)cs2)c1 ZINC000245698083 1433501844 /nfs/dbraw/zinc/50/18/44/1433501844.db2.gz BFYOEYYEYMNTTH-SJORKVTESA-N 0 0 375.450 3.098 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)C[C@H]3CCC[C@@H]3O)cc2[N+](=O)[O-])C1 ZINC000245714437 1433504868 /nfs/dbraw/zinc/50/48/68/1433504868.db2.gz OBHAKALBQNVNJC-MJEZEWASSA-N 0 0 389.496 3.310 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)C[C@@H]2CCC[C@H]2O)cc1[N+](=O)[O-])c1ccccn1 ZINC000245730516 1433506966 /nfs/dbraw/zinc/50/69/66/1433506966.db2.gz RSJCGQBDAIFLJM-DKICVRJWSA-N 0 0 398.463 3.396 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1 ZINC000245737164 1433508416 /nfs/dbraw/zinc/50/84/16/1433508416.db2.gz DHFJMELDHYAPFS-SICZQGKRSA-N 0 0 393.509 3.349 20 5 GGBDRN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245896823 1433536242 /nfs/dbraw/zinc/53/62/42/1433536242.db2.gz PIRMNGJEQVQSOX-DLBZAZTESA-N 0 0 393.465 3.037 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])C[C@H]1C ZINC000245929645 1433545506 /nfs/dbraw/zinc/54/55/06/1433545506.db2.gz PDIJLCWAFXMQGE-VHSXEESVSA-N 0 0 377.260 3.024 20 5 GGBDRN O=C(CN(C[C@H]1CCCO1)[C@H]1CCSC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000245929967 1433545864 /nfs/dbraw/zinc/54/58/64/1433545864.db2.gz UPNIVVNRLCMPRJ-UONOGXRCSA-N 0 0 399.900 3.173 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CCC[C@](C)(O)C2)c([N+](=O)[O-])c1 ZINC000245952404 1433550015 /nfs/dbraw/zinc/55/00/15/1433550015.db2.gz SSQYRQTWPCVWPR-FPOVZHCZSA-N 0 0 383.448 3.430 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)C[C@H]1C ZINC000245965145 1433551350 /nfs/dbraw/zinc/55/13/50/1433551350.db2.gz VLAVYLIYFNYJFA-NXEZZACHSA-N 0 0 377.260 3.024 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000246034680 1433559792 /nfs/dbraw/zinc/55/97/92/1433559792.db2.gz AQMQYJYDXZDIRC-CXAGYDPISA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)CO1 ZINC000246056404 1433562601 /nfs/dbraw/zinc/56/26/01/1433562601.db2.gz CVMIHYPPDUBEDK-SUMWQHHRSA-N 0 0 394.424 3.193 20 5 GGBDRN CC1(C)[C@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)[C@H]2CCO[C@H]21 ZINC000246059591 1433562836 /nfs/dbraw/zinc/56/28/36/1433562836.db2.gz BGANTSZMBIYIGF-OASPWFOLSA-N 0 0 384.230 3.292 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000246063005 1433563290 /nfs/dbraw/zinc/56/32/90/1433563290.db2.gz DKCVVMOUGBSOEG-SCLBCKFNSA-N 0 0 394.424 3.193 20 5 GGBDRN CO[C@@H]1CCCN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000246062500 1433563298 /nfs/dbraw/zinc/56/32/98/1433563298.db2.gz AYMRIENSNWKOTO-HLLBOEOZSA-N 0 0 375.469 3.328 20 5 GGBDRN CO[C@@H]1CCCN(C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000246062509 1433563417 /nfs/dbraw/zinc/56/34/17/1433563417.db2.gz AYMRIENSNWKOTO-YQQAZPJKSA-N 0 0 375.469 3.328 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCS[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000246064584 1433563800 /nfs/dbraw/zinc/56/38/00/1433563800.db2.gz BNLQWECCHLCBBH-NVXWUHKLSA-N 0 0 379.482 3.292 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000246065488 1433564149 /nfs/dbraw/zinc/56/41/49/1433564149.db2.gz DRIUYBGZAXAALB-SCLBCKFNSA-N 0 0 394.424 3.193 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000246095621 1433567900 /nfs/dbraw/zinc/56/79/00/1433567900.db2.gz MHJMGVFQPFIZBA-NUEKZKHPSA-N 0 0 385.445 3.406 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC[C@H]2[C@H]2CCCCC2=O)c1C ZINC000246116684 1433571032 /nfs/dbraw/zinc/57/10/32/1433571032.db2.gz CPANTYUMOGGKIL-CVEARBPZSA-N 0 0 380.466 3.124 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000246128010 1433572315 /nfs/dbraw/zinc/57/23/15/1433572315.db2.gz JLVDWCCDOJFCBL-YVEFUNNKSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2cccc([N+](=O)[O-])c2C)[C@@H](C)CO1 ZINC000246137839 1433573552 /nfs/dbraw/zinc/57/35/52/1433573552.db2.gz JZIADPJHRZDSSC-KBXCAEBGSA-N 0 0 390.461 3.362 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 ZINC000246146786 1433574672 /nfs/dbraw/zinc/57/46/72/1433574672.db2.gz PXWHRBRYLSQIBZ-ZLKJLUDKSA-N 0 0 383.351 3.275 20 5 GGBDRN CCc1ccc(NC(=O)[C@@H](C)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000246180943 1433578679 /nfs/dbraw/zinc/57/86/79/1433578679.db2.gz RHYHVMUZAZWXCO-RHSMWYFYSA-N 0 0 383.452 3.066 20 5 GGBDRN C[C@H](C(=O)Nc1cccc(Cl)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246183673 1433579211 /nfs/dbraw/zinc/57/92/11/1433579211.db2.gz SBLYYAKTNUXFAR-IUODEOHRSA-N 0 0 389.843 3.157 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@@H](O)c1ccc(F)cc1 ZINC000246186390 1433579355 /nfs/dbraw/zinc/57/93/55/1433579355.db2.gz HWXUMEKCOXYKTM-BWACUDIHSA-N 0 0 378.425 3.453 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H](O)c1ccc(F)cc1 ZINC000246186400 1433579536 /nfs/dbraw/zinc/57/95/36/1433579536.db2.gz HWXUMEKCOXYKTM-PEBVRCNWSA-N 0 0 378.425 3.453 20 5 GGBDRN C[C@@H]1CCC[C@H](CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000246189315 1433579772 /nfs/dbraw/zinc/57/97/72/1433579772.db2.gz RWQYIDKCYZLZLI-HZSPNIEDSA-N 0 0 379.482 3.203 20 5 GGBDRN O=C1CCCN1CC[C@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000246215359 1433582940 /nfs/dbraw/zinc/58/29/40/1433582940.db2.gz CVOMIOBIMMLFCW-LAUBAEHRSA-N 0 0 395.459 3.245 20 5 GGBDRN 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COc1ccc(NC(=O)CN2C[C@@H](c3ccsc3)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000246437035 1433612610 /nfs/dbraw/zinc/61/26/10/1433612610.db2.gz KRPROTHMAKIYMK-SJCJKPOMSA-N 0 0 391.449 3.065 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000246436312 1433612852 /nfs/dbraw/zinc/61/28/52/1433612852.db2.gz KPUVYAYMXYNYAF-SUMWQHHRSA-N 0 0 375.450 3.365 20 5 GGBDRN C[C@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H](c2ccsc2)O1 ZINC000246499963 1433621675 /nfs/dbraw/zinc/62/16/75/1433621675.db2.gz OCHSKXJOGAATLN-UGSOOPFHSA-N 0 0 387.461 3.007 20 5 GGBDRN C[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H](c2ccsc2)O1 ZINC000246499938 1433621696 /nfs/dbraw/zinc/62/16/96/1433621696.db2.gz OCHSKXJOGAATLN-ACJLOTCBSA-N 0 0 387.461 3.007 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000246501821 1433622179 /nfs/dbraw/zinc/62/21/79/1433622179.db2.gz XUSSIJVFBAGCKD-KBXCAEBGSA-N 0 0 376.434 3.054 20 5 GGBDRN CCOC(=O)c1ccnc(N2C[C@H](c3ccccc3C)OC[C@H]2C)c1[N+](=O)[O-] ZINC000246521805 1433624900 /nfs/dbraw/zinc/62/49/00/1433624900.db2.gz VOURVWXJSGOUPM-RHSMWYFYSA-N 0 0 385.420 3.441 20 5 GGBDRN CCOC(=O)c1ccnc(N2C[C@@H](c3ccccc3C)OC[C@H]2C)c1[N+](=O)[O-] ZINC000246521800 1433625035 /nfs/dbraw/zinc/62/50/35/1433625035.db2.gz VOURVWXJSGOUPM-PBHICJAKSA-N 0 0 385.420 3.441 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[C@@H](OCCC(C)C)C1 ZINC000246563875 1433631778 /nfs/dbraw/zinc/63/17/78/1433631778.db2.gz UYSDDKDHUKABSX-GDBMZVCRSA-N 0 0 379.457 3.067 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000246593425 1433636578 /nfs/dbraw/zinc/63/65/78/1433636578.db2.gz UANZMODGXLVLIK-PXAZEXFGSA-N 0 0 391.449 3.065 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000246593433 1433636656 /nfs/dbraw/zinc/63/66/56/1433636656.db2.gz UANZMODGXLVLIK-SJCJKPOMSA-N 0 0 391.449 3.065 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000246607920 1433639023 /nfs/dbraw/zinc/63/90/23/1433639023.db2.gz UTIKMRHMKPUVMM-XNJGSVPQSA-N 0 0 375.450 3.445 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000246607911 1433639068 /nfs/dbraw/zinc/63/90/68/1433639068.db2.gz UTIKMRHMKPUVMM-PBFPGSCMSA-N 0 0 375.450 3.445 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000246623080 1433641201 /nfs/dbraw/zinc/64/12/01/1433641201.db2.gz YZUJFRJBZAOWSN-YZVOILCLSA-N 0 0 381.432 3.118 20 5 GGBDRN C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccsc2)O1 ZINC000246642252 1433644214 /nfs/dbraw/zinc/64/42/14/1433644214.db2.gz WWEJGBMFYRFVKK-DYVFJYSZSA-N 0 0 375.450 3.447 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000246686361 1433650065 /nfs/dbraw/zinc/65/00/65/1433650065.db2.gz RCMGMDPJAFMIJC-NVVRBJDHSA-N 0 0 381.498 3.343 20 5 GGBDRN 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PBJGYJVGGNMDBS-KUHUBIRLSA-N 0 0 381.432 3.289 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@@H]23)cc1[N+](=O)[O-] ZINC000248164958 1433776483 /nfs/dbraw/zinc/77/64/83/1433776483.db2.gz HNBMUBRLVNLFNU-CWFSZBLJSA-N 0 0 384.457 3.291 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000248166357 1433776742 /nfs/dbraw/zinc/77/67/42/1433776742.db2.gz RRVQNLZLCFJCTM-AWEZNQCLSA-N 0 0 383.404 3.469 20 5 GGBDRN COc1ccc(-c2nc(Cn3cnc4cc([N+](=O)[O-])ccc4c3=O)co2)cc1 ZINC000248176437 1433777723 /nfs/dbraw/zinc/77/77/23/1433777723.db2.gz ALWFXLWDHNMHQW-UHFFFAOYSA-N 0 0 378.344 3.017 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCCC[C@H]1C(C)(C)C ZINC000248230618 1433781502 /nfs/dbraw/zinc/78/15/02/1433781502.db2.gz BMFIDHYPMDXAKR-XKQJLSEDSA-N 0 0 375.469 3.434 20 5 GGBDRN C[C@H](OCCCNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000248321509 1433785216 /nfs/dbraw/zinc/78/52/16/1433785216.db2.gz UWGMGORYCQTJHL-HNNXBMFYSA-N 0 0 395.419 3.073 20 5 GGBDRN C[C@H](NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1ccc(Cl)cc1 ZINC000248379398 1433790252 /nfs/dbraw/zinc/79/02/52/1433790252.db2.gz MSPIOAGSTQDXAT-JTQLQIEISA-N 0 0 375.768 3.034 20 5 GGBDRN C[C@@H]1CN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)[C@H]2CCCC[C@@H]12 ZINC000248384164 1433790908 /nfs/dbraw/zinc/79/09/08/1433790908.db2.gz CXTYYYGTNZNACE-OSMZGAPFSA-N 0 0 397.378 3.172 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@H](C)[C@H]3CCCC[C@H]32)nn1-c1ccccc1[N+](=O)[O-] ZINC000248385831 1433792126 /nfs/dbraw/zinc/79/21/26/1433792126.db2.gz KCSGODNEQIAXAR-NUEKZKHPSA-N 0 0 396.447 3.100 20 5 GGBDRN C[C@@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000248389585 1433792943 /nfs/dbraw/zinc/79/29/43/1433792943.db2.gz SMNDLIVDCGQRLX-MBNYWOFBSA-N 0 0 379.844 3.015 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@H](C)[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000248410952 1433800355 /nfs/dbraw/zinc/80/03/55/1433800355.db2.gz DLLRGPJSKVHSBA-CWRNSKLLSA-N 0 0 391.468 3.375 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 ZINC000248439645 1433802792 /nfs/dbraw/zinc/80/27/92/1433802792.db2.gz IRXHXLGUEDOHOJ-CRAIPNDOSA-N 0 0 395.525 3.291 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000248445807 1433803373 /nfs/dbraw/zinc/80/33/73/1433803373.db2.gz GROMMLGEBHUNEN-VQIMIIECSA-N 0 0 392.839 3.061 20 5 GGBDRN C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000248527248 1433807023 /nfs/dbraw/zinc/80/70/23/1433807023.db2.gz HCOGRKXREWTXPH-ATCWAGBWSA-N 0 0 389.481 3.429 20 5 GGBDRN C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000248527476 1433807024 /nfs/dbraw/zinc/80/70/24/1433807024.db2.gz HKPABYSGHNIHBR-MCBXIFIFSA-N 0 0 375.425 3.224 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3C[C@@H](C)OC[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000248534299 1433807377 /nfs/dbraw/zinc/80/73/77/1433807377.db2.gz UZKNAHXUHWGOCD-XUWVNRHRSA-N 0 0 375.469 3.327 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@H]([C@H](C)O)C2)c([N+](=O)[O-])c1 ZINC000248537691 1433807567 /nfs/dbraw/zinc/80/75/67/1433807567.db2.gz HIXLVVZSMKSXOA-KNBMTAEXSA-N 0 0 383.448 3.286 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)cc([N+](=O)[O-])c1F ZINC000248568928 1433808871 /nfs/dbraw/zinc/80/88/71/1433808871.db2.gz CHBUMIJAMBHMHK-NHYWBVRUSA-N 0 0 379.413 3.209 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)C[C@H]2c2cccnc2)cc([N+](=O)[O-])c1F ZINC000248568927 1433808884 /nfs/dbraw/zinc/80/88/84/1433808884.db2.gz CHBUMIJAMBHMHK-ABAIWWIYSA-N 0 0 379.413 3.209 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000248611879 1433811202 /nfs/dbraw/zinc/81/12/02/1433811202.db2.gz IIBLVTYDARGJOD-IEBWSBKVSA-N 0 0 392.839 3.061 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000248615749 1433811528 /nfs/dbraw/zinc/81/15/28/1433811528.db2.gz KETXEAPPNZPIRB-FVQBIDKESA-N 0 0 379.844 3.395 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C[C@H]1C ZINC000248618346 1433811711 /nfs/dbraw/zinc/81/17/11/1433811711.db2.gz SENDTKNQQQBKAS-MCIONIFRSA-N 0 0 375.425 3.224 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCS[C@@H]3CCCC[C@H]32)c2ncccc12 ZINC000248635200 1433812942 /nfs/dbraw/zinc/81/29/42/1433812942.db2.gz JYNLJMLVOBOLEL-HUUCEWRRSA-N 0 0 393.490 3.192 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCS[C@H]3CCCC[C@H]32)c2ncccc12 ZINC000248635199 1433812958 /nfs/dbraw/zinc/81/29/58/1433812958.db2.gz JYNLJMLVOBOLEL-CABCVRRESA-N 0 0 393.490 3.192 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)[C@@H]2CCCC[C@H]21 ZINC000248647133 1433813507 /nfs/dbraw/zinc/81/35/07/1433813507.db2.gz PUYGIJUXVIQAAD-VNHYZAJKSA-N 0 0 375.450 3.342 20 5 GGBDRN C[C@@H]1C[C@H]2CCCC[C@H]2N1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000248661004 1433814237 /nfs/dbraw/zinc/81/42/37/1433814237.db2.gz ZVVQLZVUMAFLHA-UMVBOHGHSA-N 0 0 375.450 3.485 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c1C ZINC000248665746 1433814364 /nfs/dbraw/zinc/81/43/64/1433814364.db2.gz WHVVIQIVVQPGCX-PXAZEXFGSA-N 0 0 375.450 3.378 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000248681920 1433815000 /nfs/dbraw/zinc/81/50/00/1433815000.db2.gz FXOXBGFJHPIRCR-SZNDQCEHSA-N 0 0 397.431 3.062 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000248681918 1433815005 /nfs/dbraw/zinc/81/50/05/1433815005.db2.gz FXOXBGFJHPIRCR-QKKBWIMNSA-N 0 0 397.431 3.062 20 5 GGBDRN COC(=O)[C@@H]1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000248903401 1433828613 /nfs/dbraw/zinc/82/86/13/1433828613.db2.gz NYHATMAHQRFMKY-BLLLJJGKSA-N 0 0 375.450 3.349 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCOC[C@@H]1[C@H]1CCCCC1=O ZINC000248944884 1433830136 /nfs/dbraw/zinc/83/01/36/1433830136.db2.gz ZEUCXDOQMVEOBS-BHIYHBOVSA-N 0 0 388.464 3.150 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000248948204 1433830207 /nfs/dbraw/zinc/83/02/07/1433830207.db2.gz AUZIQLYBVRWWFN-XJKSGUPXSA-N 0 0 396.490 3.424 20 5 GGBDRN C[C@H](C(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000249344470 1433841553 /nfs/dbraw/zinc/84/15/53/1433841553.db2.gz JJWHPXCEPHEJJN-LYOVBCGYSA-N 0 0 392.349 3.437 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@H]1Oc1ccccc1 ZINC000249421475 1433843477 /nfs/dbraw/zinc/84/34/77/1433843477.db2.gz HQIXQLBXYOASJA-GUDVDZBRSA-N 0 0 385.420 3.019 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000249547407 1433846726 /nfs/dbraw/zinc/84/67/26/1433846726.db2.gz LICQOROXTKOHHB-NVXWUHKLSA-N 0 0 390.461 3.362 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000249547843 1433846738 /nfs/dbraw/zinc/84/67/38/1433846738.db2.gz GVBLABPVWIHGNA-KPZWWZAWSA-N 0 0 391.374 3.274 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000249601263 1433847840 /nfs/dbraw/zinc/84/78/40/1433847840.db2.gz YHTQRDIDXJHKEF-YSSFQJQWSA-N 0 0 383.448 3.286 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000249682266 1433848817 /nfs/dbraw/zinc/84/88/17/1433848817.db2.gz FXQCUJNHFHQFHX-VXGBXAGGSA-N 0 0 377.832 3.178 20 5 GGBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000249689621 1433849063 /nfs/dbraw/zinc/84/90/63/1433849063.db2.gz XAYRJYRMJGDBAE-VXGBXAGGSA-N 0 0 377.832 3.178 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NO[C@H]3CCCCO3)cc2[N+](=O)[O-])C1 ZINC000249727031 1433850053 /nfs/dbraw/zinc/85/00/53/1433850053.db2.gz QPGYLIYPIFQDBJ-IYOUNJFTSA-N 0 0 377.441 3.265 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NO[C@H]3CCCCO3)cc2[N+](=O)[O-])C1 ZINC000249727033 1433850071 /nfs/dbraw/zinc/85/00/71/1433850071.db2.gz QPGYLIYPIFQDBJ-LBTNJELSSA-N 0 0 377.441 3.265 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@@H](O)C2(C)C)cc1[N+](=O)[O-])c1ccccn1 ZINC000249975433 1433853889 /nfs/dbraw/zinc/85/38/89/1433853889.db2.gz KWNOBKUODAYKIE-JBBXEZCESA-N 0 0 384.436 3.052 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@H]2C[C@@H](O)C2(C)C)cc1[N+](=O)[O-])c1ccccn1 ZINC000249975441 1433853935 /nfs/dbraw/zinc/85/39/35/1433853935.db2.gz KWNOBKUODAYKIE-UYHISHBKSA-N 0 0 384.436 3.052 20 5 GGBDRN COc1cc(C[N@@H+]2CC[C@@H](O)[C@H](C)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000250142432 1433854801 /nfs/dbraw/zinc/85/48/01/1433854801.db2.gz ZGEMIKISANKVDJ-DNVCBOLYSA-N 0 0 386.448 3.385 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000250226737 1433855149 /nfs/dbraw/zinc/85/51/49/1433855149.db2.gz GWWRSMURXBSBJT-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000250586248 1433857025 /nfs/dbraw/zinc/85/70/25/1433857025.db2.gz QKWYCZALGQKEQL-CXAGYDPISA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000250641231 1433857095 /nfs/dbraw/zinc/85/70/95/1433857095.db2.gz UGDJRUXXHJLSPT-KBXCAEBGSA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](c2ccccc2)O1 ZINC000250671665 1433857154 /nfs/dbraw/zinc/85/71/54/1433857154.db2.gz XQPJROSBKQOFRS-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@H]1CN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](c2ccccc2)O1 ZINC000250640631 1433857167 /nfs/dbraw/zinc/85/71/67/1433857167.db2.gz TUEWGCFNEOZYGK-KXBFYZLASA-N 0 0 379.420 3.273 20 5 GGBDRN C[C@@H]1CCC[C@@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)[C@H]1C ZINC000251853752 1433860846 /nfs/dbraw/zinc/86/08/46/1433860846.db2.gz PGBUYTTWNTYAOM-MBNYWOFBSA-N 0 0 389.481 3.429 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCC[C@H](C)C1 ZINC000251973851 1433861749 /nfs/dbraw/zinc/86/17/49/1433861749.db2.gz YHUOJVQGUAWDHB-QRTARXTBSA-N 0 0 393.509 3.141 20 5 GGBDRN CCc1cc2c(ncn(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2=O)s1 ZINC000251978493 1433861819 /nfs/dbraw/zinc/86/18/19/1433861819.db2.gz FIURBKQHLVNVLN-UHFFFAOYSA-N 0 0 383.389 3.027 20 5 GGBDRN CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000252162271 1433862765 /nfs/dbraw/zinc/86/27/65/1433862765.db2.gz PZNHHGDBONQCQC-NONVJHHQSA-N 0 0 375.469 3.290 20 5 GGBDRN C[C@@H]1CCC[C@H](N(C)C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000252440999 1433863212 /nfs/dbraw/zinc/86/32/12/1433863212.db2.gz KFMZJKBJIDAQBF-HZSPNIEDSA-N 0 0 379.482 3.298 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000253357959 1433866097 /nfs/dbraw/zinc/86/60/97/1433866097.db2.gz JSNIOCMHHHQIHT-WMLDXEAASA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](c2ccccc2)O1 ZINC000253358847 1433866232 /nfs/dbraw/zinc/86/62/32/1433866232.db2.gz WCEMWOIMDCIVFG-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN 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O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCc1cccc(NC(=O)[C@H]2CCCO2)c1 ZINC000255046545 1433874888 /nfs/dbraw/zinc/87/48/88/1433874888.db2.gz YAOOCWYABCAFSM-SCEWNMGZSA-N 0 0 395.415 3.042 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000255134427 1433877220 /nfs/dbraw/zinc/87/72/20/1433877220.db2.gz XAFITOJHAYKUPY-YWEYNIOJSA-N 0 0 386.839 3.001 20 5 GGBDRN O=C(c1c(F)cccc1F)N1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255164024 1433877774 /nfs/dbraw/zinc/87/77/74/1433877774.db2.gz WNFOYMAWHDVVLQ-XQRVVYSFSA-N 0 0 387.386 3.344 20 5 GGBDRN COc1ccccc1/C=C(\C(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccccc1 ZINC000255196590 1433878348 /nfs/dbraw/zinc/87/83/48/1433878348.db2.gz RYGMIEYFPUERPH-UYRXBGFRSA-N 0 0 392.415 3.157 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCc1ccccc1CN1CCCC1=O ZINC000255224748 1433878689 /nfs/dbraw/zinc/87/86/89/1433878689.db2.gz MBNJLXPMCQSSAK-XFXZXTDPSA-N 0 0 379.416 3.047 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc2nc(N3CCOCC3)oc2c1 ZINC000255386046 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QKILFCCCEHSXRC-WDZFZDKYSA-N 0 0 394.431 3.293 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)CC2CCCCC2)CC1 ZINC000255698535 1433888238 /nfs/dbraw/zinc/88/82/38/1433888238.db2.gz GDORTVSWTBHKKG-FLIBITNWSA-N 0 0 385.464 3.249 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000255768660 1433889276 /nfs/dbraw/zinc/88/92/76/1433889276.db2.gz IHXNIZYOQKVQNO-HWYHOQROSA-N 0 0 389.452 3.371 20 5 GGBDRN COc1ccc(/C=C2\NC(=S)N(c3ccc(C)c(C)c3)C2=O)cc1[N+](=O)[O-] ZINC000255771467 1433889460 /nfs/dbraw/zinc/88/94/60/1433889460.db2.gz KGNTYJDTTDUCQY-DHDCSXOGSA-N 0 0 383.429 3.482 20 5 GGBDRN O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C/c1cc(O)ccc1Br ZINC000255871962 1433890687 /nfs/dbraw/zinc/89/06/87/1433890687.db2.gz PMTZVOJQCJTBDE-RIYZIHGNSA-N 0 0 389.161 3.407 20 5 GGBDRN O=C(/C=C\c1nc2ccccc2s1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000255904021 1433891595 /nfs/dbraw/zinc/89/15/95/1433891595.db2.gz IPPLELUZKWAQDQ-WSROAFLRSA-N 0 0 395.444 3.326 20 5 GGBDRN CC[C@@H](C)[C@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(=O)OC ZINC000255945706 1433892312 /nfs/dbraw/zinc/89/23/12/1433892312.db2.gz BICUETHFOJXTEH-KDOFPFPSSA-N 0 0 391.468 3.149 20 5 GGBDRN CN1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000255954482 1433892673 /nfs/dbraw/zinc/89/26/73/1433892673.db2.gz NGCXKWFDHFMRIU-SFHVURJKSA-N 0 0 388.855 3.175 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCNC[C@@H]1c1cccc(F)c1 ZINC000261714209 1433899719 /nfs/dbraw/zinc/89/97/19/1433899719.db2.gz DSRALDHLQIEJNC-HXUWFJFHSA-N 0 0 398.438 3.121 20 5 GGBDRN CCOc1ccc(C(=O)N2CCNC[C@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000261956347 1433915676 /nfs/dbraw/zinc/91/56/76/1433915676.db2.gz LZSCQWIYFQAQEB-KRWDZBQOSA-N 0 0 389.839 3.434 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCNC[C@H]1c1cccc(F)c1 ZINC000261976767 1433918648 /nfs/dbraw/zinc/91/86/48/1433918648.db2.gz NTQRIRKYTSYFTP-UGSOOPFHSA-N 0 0 389.452 3.388 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCNC[C@H]1c1cccc(F)c1 ZINC000261976760 1433918712 /nfs/dbraw/zinc/91/87/12/1433918712.db2.gz NTQRIRKYTSYFTP-ACJLOTCBSA-N 0 0 389.452 3.388 20 5 GGBDRN CSc1ccc(C(=O)N2CCNC[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000262097510 1433927097 /nfs/dbraw/zinc/92/70/97/1433927097.db2.gz YYYHLWBRJNIYCU-MRXNPFEDSA-N 0 0 375.425 3.243 20 5 GGBDRN COc1cc(C[N@@H+]2CCC[C@@H](CCC(=O)[O-])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000263026271 1433978712 /nfs/dbraw/zinc/97/87/12/1433978712.db2.gz AQPAJUNXYKAASG-NSHDSACASA-N 0 0 388.367 3.282 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000263507019 1434009843 /nfs/dbraw/zinc/00/98/43/1434009843.db2.gz MIOIJNFQELYEAP-UHFFFAOYSA-N 0 0 387.436 3.226 20 5 GGBDRN C[N@H+](CC(=O)[O-])[C@@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000263522160 1434011297 /nfs/dbraw/zinc/01/12/97/1434011297.db2.gz ROEBSRSEDVNLPC-MRXNPFEDSA-N 0 0 387.436 3.226 20 5 GGBDRN O=C([O-])C[N@H+](CC1CC1)C1CC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000263531182 1434011986 /nfs/dbraw/zinc/01/19/86/1434011986.db2.gz WOHXGBTXHMQJEV-UHFFFAOYSA-N 0 0 399.447 3.272 20 5 GGBDRN C[N@H+](CC(=O)[O-])[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000263560373 1434013192 /nfs/dbraw/zinc/01/31/92/1434013192.db2.gz RCHYBEGPTSMBSS-MRXNPFEDSA-N 0 0 384.436 3.032 20 5 GGBDRN Cc1cc(N2CCC[C@@H]([N@H+](C)CC(=O)[O-])CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000263567791 1434013794 /nfs/dbraw/zinc/01/37/94/1434013794.db2.gz XVCQPRRBJKYJMG-GFCCVEGCSA-N 0 0 389.374 3.297 20 5 GGBDRN Cc1nn(CCC(=O)N(Cc2cccs2)C[C@H]2CCCO2)c(C)c1[N+](=O)[O-] ZINC000263641587 1434014551 /nfs/dbraw/zinc/01/45/51/1434014551.db2.gz CBFOGHURKJQDHA-OAHLLOKOSA-N 0 0 392.481 3.068 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](C)c2ccccc2OC(F)F)c(C)c1[N+](=O)[O-] ZINC000263646101 1434015082 /nfs/dbraw/zinc/01/50/82/1434015082.db2.gz FNUADIFKZCOUHL-SNVBAGLBSA-N 0 0 382.367 3.277 20 5 GGBDRN COCCOc1ccc(F)cc1NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000263653867 1434016247 /nfs/dbraw/zinc/01/62/47/1434016247.db2.gz LUADAAYDZUHARN-UHFFFAOYSA-N 0 0 393.371 3.089 20 5 GGBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H]1OCCc2ccccc21 ZINC000263667856 1434017775 /nfs/dbraw/zinc/01/77/75/1434017775.db2.gz FTHUDOJSVXOAMH-SFHVURJKSA-N 0 0 380.404 3.391 20 5 GGBDRN Cc1ccsc1CNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000263666960 1434017833 /nfs/dbraw/zinc/01/78/33/1434017833.db2.gz LEWBBTIGRFBHGN-INIZCTEOSA-N 0 0 387.461 3.194 20 5 GGBDRN Cc1ccsc1CNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000263666965 1434017922 /nfs/dbraw/zinc/01/79/22/1434017922.db2.gz LEWBBTIGRFBHGN-MRXNPFEDSA-N 0 0 387.461 3.194 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000263672601 1434018660 /nfs/dbraw/zinc/01/86/60/1434018660.db2.gz FIJQYODATQTILP-CABCVRRESA-N 0 0 393.509 3.230 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N[C@H](C)CCc2ccco2)ccc1[N+](=O)[O-] ZINC000263685110 1434020788 /nfs/dbraw/zinc/02/07/88/1434020788.db2.gz PYWQCGQQMNFIRI-BEFAXECRSA-N 0 0 399.447 3.238 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccc(N2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000263686436 1434021047 /nfs/dbraw/zinc/02/10/47/1434021047.db2.gz LQKDXQUTDTXYRD-CQSZACIVSA-N 0 0 382.420 3.011 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000263695769 1434022090 /nfs/dbraw/zinc/02/20/90/1434022090.db2.gz SJQKTZAUSCUSRX-UHFFFAOYSA-N 0 0 399.451 3.109 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000263714430 1434024473 /nfs/dbraw/zinc/02/44/73/1434024473.db2.gz KWLLYZPQXBPYMI-OAHLLOKOSA-N 0 0 386.383 3.079 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000263715427 1434024569 /nfs/dbraw/zinc/02/45/69/1434024569.db2.gz KSMUEBZBSLNEEO-GFCCVEGCSA-N 0 0 382.848 3.408 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(OCC(F)(F)F)cc2)c(C)c1[N+](=O)[O-] ZINC000263720252 1434025134 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PHUUAOIECRTNPS-CYBMUJFWSA-N 0 0 390.461 3.094 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000263957507 1434053499 /nfs/dbraw/zinc/05/34/99/1434053499.db2.gz UEWUMSDDKCAIQM-CYBMUJFWSA-N 0 0 383.433 3.461 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(-c2nc(C(C)C)no2)cc1 ZINC000263960356 1434053793 /nfs/dbraw/zinc/05/37/93/1434053793.db2.gz JREHKRBPYVLQAG-UHFFFAOYSA-N 0 0 384.396 3.302 20 5 GGBDRN COc1cccc(N2CC[C@H](NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])C2)c1 ZINC000263969815 1434055255 /nfs/dbraw/zinc/05/52/55/1434055255.db2.gz DNKPSHKRVMJANU-ZDUSSCGKSA-N 0 0 375.812 3.266 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000263972384 1434055823 /nfs/dbraw/zinc/05/58/23/1434055823.db2.gz IAIKBKCJNYFXIG-CYBMUJFWSA-N 0 0 375.812 3.266 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c(C)c1[N+](=O)[O-] ZINC000263980242 1434057036 /nfs/dbraw/zinc/05/70/36/1434057036.db2.gz KLHKVRXWPLMDDB-KRWDZBQOSA-N 0 0 384.440 3.188 20 5 GGBDRN 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ZINC000264017566 1434062408 /nfs/dbraw/zinc/06/24/08/1434062408.db2.gz WYUWPVDDPSNOFK-QGZVFWFLSA-N 0 0 396.451 3.049 20 5 GGBDRN CC(=O)Nc1ccc(CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000264020281 1434062906 /nfs/dbraw/zinc/06/29/06/1434062906.db2.gz HEFVXTARFMDGMF-UHFFFAOYSA-N 0 0 396.447 3.126 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C ZINC000264022249 1434063171 /nfs/dbraw/zinc/06/31/71/1434063171.db2.gz WUKZMMWLSSAPQH-GFCCVEGCSA-N 0 0 394.431 3.179 20 5 GGBDRN COc1ccc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000264028952 1434063940 /nfs/dbraw/zinc/06/39/40/1434063940.db2.gz JXXWFRNISWKDRK-KRWDZBQOSA-N 0 0 376.796 3.471 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)OCc2noc(C(C)(C)C)n2)cc1SC ZINC000264040399 1434065176 /nfs/dbraw/zinc/06/51/76/1434065176.db2.gz PUTUDFBFYHQFQD-UHFFFAOYSA-N 0 0 381.410 3.363 20 5 GGBDRN COc1cccc(N2CC[C@H](NC(=O)N(C)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000264047032 1434065977 /nfs/dbraw/zinc/06/59/77/1434065977.db2.gz PJQBGBLMTWWEOA-INIZCTEOSA-N 0 0 384.436 3.024 20 5 GGBDRN COc1cc(C(=O)NCC(C)(C)c2ccc(F)cc2)c([N+](=O)[O-])cc1OC ZINC000264053279 1434066924 /nfs/dbraw/zinc/06/69/24/1434066924.db2.gz COTSIJLHYRVDLM-UHFFFAOYSA-N 0 0 376.384 3.459 20 5 GGBDRN CC(C)n1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1N(C)C ZINC000264068400 1434068740 /nfs/dbraw/zinc/06/87/40/1434068740.db2.gz RAWVHOZPYXVVON-UHFFFAOYSA-N 0 0 389.441 3.176 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2C ZINC000264073425 1434069149 /nfs/dbraw/zinc/06/91/49/1434069149.db2.gz UHMHPNUHBMWCPA-CHWSQXEVSA-N 0 0 399.472 3.472 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC(Oc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000264074423 1434069364 /nfs/dbraw/zinc/06/93/64/1434069364.db2.gz QCDHYFLXCYCZFF-UHFFFAOYSA-N 0 0 376.434 3.046 20 5 GGBDRN Cc1noc(C)c1NC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000264085122 1434070389 /nfs/dbraw/zinc/07/03/89/1434070389.db2.gz RTBWIMJQDVXBJN-UHFFFAOYSA-N 0 0 387.318 3.452 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(C3N=NC(=S)N3C3CC3)CC2)cc1[N+](=O)[O-] ZINC000264105916 1434072239 /nfs/dbraw/zinc/07/22/39/1434072239.db2.gz CPOMJWWQJLKGHV-UHFFFAOYSA-N 0 0 387.465 3.138 20 5 GGBDRN CON(C)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 ZINC000264105997 1434072326 /nfs/dbraw/zinc/07/23/26/1434072326.db2.gz GIGSQHCNFGGVRR-UHFFFAOYSA-N 0 0 398.419 3.081 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCCCNc2ccccn2)cc1OC ZINC000264119377 1434073518 /nfs/dbraw/zinc/07/35/18/1434073518.db2.gz DXKQEIXNROLVCW-UHFFFAOYSA-N 0 0 388.424 3.019 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2C)c1[N+](=O)[O-] ZINC000264142684 1434075304 /nfs/dbraw/zinc/07/53/04/1434075304.db2.gz GPBSBOCWHWVCGP-UHFFFAOYSA-N 0 0 395.423 3.172 20 5 GGBDRN O=C(C=Cc1ccccc1[N+](=O)[O-])N1CCC(C2N=NC(=S)N2C2CC2)CC1 ZINC000264144413 1434075509 /nfs/dbraw/zinc/07/55/09/1434075509.db2.gz HYJXSZQKLHTTPI-VMPITWQZSA-N 0 0 399.476 3.229 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2cnc(CCN3CCO[C@H](c4nccs4)C3)o2)c1 ZINC000264167923 1434077777 /nfs/dbraw/zinc/07/77/77/1434077777.db2.gz HKMOVVFWMHPUJR-INIZCTEOSA-N 0 0 386.433 3.322 20 5 GGBDRN COC(=O)[C@@H](NCc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])c1ccccc1 ZINC000264174470 1434078319 /nfs/dbraw/zinc/07/83/19/1434078319.db2.gz IRZCJWUOUUAPGJ-INIZCTEOSA-N 0 0 396.346 3.209 20 5 GGBDRN COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])c1 ZINC000264185950 1434079181 /nfs/dbraw/zinc/07/91/81/1434079181.db2.gz MOQRARILPRFUIK-UHFFFAOYSA-N 0 0 391.384 3.234 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCO[C@@H](c3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000264196873 1434080943 /nfs/dbraw/zinc/08/09/43/1434080943.db2.gz HGANGCVZWKUOKM-QGZVFWFLSA-N 0 0 396.852 3.230 20 5 GGBDRN CNC(=O)c1ccc(N2CCO[C@@H](c3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000264254648 1434088238 /nfs/dbraw/zinc/08/82/38/1434088238.db2.gz YSGWPCZXBOKFHC-QGZVFWFLSA-N 0 0 375.812 3.186 20 5 GGBDRN C[C@H](c1cccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c1)N1CCOCC1 ZINC000264264890 1434089524 /nfs/dbraw/zinc/08/95/24/1434089524.db2.gz 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ZINC000264466124 1434116336 /nfs/dbraw/zinc/11/63/36/1434116336.db2.gz HTOKTCXURSWTLX-UHFFFAOYSA-N 0 0 393.852 3.231 20 5 GGBDRN C[C@H](CN(C)C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000264470347 1434117001 /nfs/dbraw/zinc/11/70/01/1434117001.db2.gz IYCIONPWVCUMEB-CYBMUJFWSA-N 0 0 389.839 3.240 20 5 GGBDRN COc1cc(F)c(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1OC ZINC000264487636 1434119148 /nfs/dbraw/zinc/11/91/48/1434119148.db2.gz ZBSLQLBDISVRDF-UHFFFAOYSA-N 0 0 378.356 3.467 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000264491718 1434119835 /nfs/dbraw/zinc/11/98/35/1434119835.db2.gz YHFINPZJNFLCLZ-UHFFFAOYSA-N 0 0 386.452 3.247 20 5 GGBDRN CCCC[C@H]1CCC[C@@H]1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000264495492 1434120209 /nfs/dbraw/zinc/12/02/09/1434120209.db2.gz OTLPDPGUXFZGSO-JSGCOSHPSA-N 0 0 381.860 3.453 20 5 GGBDRN Cc1cccc(N2C(=O)N[C@H](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2=O)c1 ZINC000264516887 1434122901 /nfs/dbraw/zinc/12/29/01/1434122901.db2.gz 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GGBDRN O=Cc1ccc(OCC(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000264594123 1434132336 /nfs/dbraw/zinc/13/23/36/1434132336.db2.gz RKMXPNSHXJCQFW-UWJYYQICSA-N 0 0 398.415 3.070 20 5 GGBDRN CC[C@](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)(C(=O)OC)c1ccccc1 ZINC000264597537 1434132663 /nfs/dbraw/zinc/13/26/63/1434132663.db2.gz IRNYGVFAWWASCK-HXUWFJFHSA-N 0 0 396.403 3.213 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000264597720 1434132683 /nfs/dbraw/zinc/13/26/83/1434132683.db2.gz CKMXBMJCCIUJCK-AWEZNQCLSA-N 0 0 382.424 3.268 20 5 GGBDRN Cc1c(NC(=O)N2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000264606780 1434133950 /nfs/dbraw/zinc/13/39/50/1434133950.db2.gz DLBAOMYTVXXPJL-LZWOXQAQSA-N 0 0 376.457 3.009 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2ccc(OCC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000264633407 1434137562 /nfs/dbraw/zinc/13/75/62/1434137562.db2.gz ZMHZDAAJLMGDKI-UHFFFAOYSA-N 0 0 386.330 3.142 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[S@](=O)Cc1ccccc1 ZINC000264636261 1434137801 /nfs/dbraw/zinc/13/78/01/1434137801.db2.gz DQDNAIYGUXCDKE-RXBISOJRSA-N 0 0 392.502 3.141 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[S@@](=O)Cc1ccccc1 ZINC000264636255 1434137924 /nfs/dbraw/zinc/13/79/24/1434137924.db2.gz DQDNAIYGUXCDKE-IYJVBRSBSA-N 0 0 392.502 3.141 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCOc3ccccc32)cc1OC ZINC000264641484 1434138725 /nfs/dbraw/zinc/13/87/25/1434138725.db2.gz OLKXETUAMZRKSW-CYBMUJFWSA-N 0 0 386.404 3.298 20 5 GGBDRN COc1cc(OC)c(CCNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(OC)c1 ZINC000264642548 1434139221 /nfs/dbraw/zinc/13/92/21/1434139221.db2.gz GORSYYRQHUTXRC-UHFFFAOYSA-N 0 0 394.811 3.247 20 5 GGBDRN Cn1cc(-c2noc(CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n2)cn1 ZINC000264657767 1434140530 /nfs/dbraw/zinc/14/05/30/1434140530.db2.gz YQBQNKPESGKPKO-UHFFFAOYSA-N 0 0 382.302 3.052 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2ccnc(OCc3ccccc3)c2)c1[N+](=O)[O-] ZINC000264674317 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CYSCAZHYQBFBHE-CYBMUJFWSA-N 0 0 389.481 3.384 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C2N=NC(=S)N2C(C)C)C1 ZINC000264700767 1434145895 /nfs/dbraw/zinc/14/58/95/1434145895.db2.gz CYSCAZHYQBFBHE-ZDUSSCGKSA-N 0 0 389.481 3.384 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC(=O)N1Cc2ccccc2C1 ZINC000264726812 1434149039 /nfs/dbraw/zinc/14/90/39/1434149039.db2.gz MQFPAPKNDQKDQX-UHFFFAOYSA-N 0 0 398.419 3.048 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000264758949 1434152410 /nfs/dbraw/zinc/15/24/10/1434152410.db2.gz TZBNSBOXIUIXDY-JTQLQIEISA-N 0 0 381.339 3.331 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C ZINC000264843682 1434159039 /nfs/dbraw/zinc/15/90/39/1434159039.db2.gz NILSEFUDMRNVRY-UHFFFAOYSA-N 0 0 387.440 3.422 20 5 GGBDRN CN(C(=O)c1csc(CNC(=O)OC(C)(C)C)n1)c1ccc([N+](=O)[O-])cc1 ZINC000264851898 1434159567 /nfs/dbraw/zinc/15/95/67/1434159567.db2.gz KNVJPZJHPIIMCV-UHFFFAOYSA-N 0 0 392.437 3.353 20 5 GGBDRN CC(C)(C)OC(=O)NCc1nc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cs1 ZINC000264893741 1434162990 /nfs/dbraw/zinc/16/29/90/1434162990.db2.gz YDEDSYBESOHBSS-UHFFFAOYSA-N 0 0 378.410 3.328 20 5 GGBDRN O=C(CCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)Nc1ccccc1 ZINC000264908204 1434163903 /nfs/dbraw/zinc/16/39/03/1434163903.db2.gz DQJQRYHARFWTMJ-UHFFFAOYSA-N 0 0 382.420 3.272 20 5 GGBDRN COC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000264914918 1434164348 /nfs/dbraw/zinc/16/43/48/1434164348.db2.gz OEOHXXZGCPCSKF-MRXNPFEDSA-N 0 0 375.469 3.330 20 5 GGBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C(=O)Nc1ccccc1 ZINC000264927806 1434165114 /nfs/dbraw/zinc/16/51/14/1434165114.db2.gz ODKUCNIHLBLXEN-AWEZNQCLSA-N 0 0 382.420 3.270 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCc3c2cccc3O)c([N+](=O)[O-])cc1OC(F)F ZINC000264939196 1434166031 /nfs/dbraw/zinc/16/60/31/1434166031.db2.gz QIMXURPQRVWMMN-GFCCVEGCSA-N 0 0 394.330 3.328 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCc3c2cccc3O)c([N+](=O)[O-])cc1OC(F)F ZINC000264939197 1434166125 /nfs/dbraw/zinc/16/61/25/1434166125.db2.gz QIMXURPQRVWMMN-LBPRGKRZSA-N 0 0 394.330 3.328 20 5 GGBDRN O=C(NCc1ccnc(OC2CCOCC2)c1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000264959016 1434168042 /nfs/dbraw/zinc/16/80/42/1434168042.db2.gz LPSUGUCUCLHVFN-UHFFFAOYSA-N 0 0 397.387 3.224 20 5 GGBDRN CCN1C(=S)N=NC1[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000264960885 1434168194 /nfs/dbraw/zinc/16/81/94/1434168194.db2.gz XDYXWJXWGPPOPI-SNVBAGLBSA-N 0 0 395.872 3.168 20 5 GGBDRN COc1cc(CC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)cc(OC)c1OC ZINC000264968624 1434169386 /nfs/dbraw/zinc/16/93/86/1434169386.db2.gz CQOHTJGUKHANIS-UHFFFAOYSA-N 0 0 386.404 3.143 20 5 GGBDRN O=C(NCc1ccnc(OC2CCOCC2)c1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000264985280 1434171485 /nfs/dbraw/zinc/17/14/85/1434171485.db2.gz IOIGDZVSHGQANP-UHFFFAOYSA-N 0 0 391.811 3.131 20 5 GGBDRN Cc1nn(C)c(N2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000264995620 1434172701 /nfs/dbraw/zinc/17/27/01/1434172701.db2.gz CHZLQGOTRMERED-UHFFFAOYSA-N 0 0 395.822 3.284 20 5 GGBDRN CCOc1ccccc1C(=O)NCCCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000265008114 1434174158 /nfs/dbraw/zinc/17/41/58/1434174158.db2.gz PEUVIBLDMTYSTA-UHFFFAOYSA-N 0 0 396.403 3.406 20 5 GGBDRN COc1cc(CCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc(OC)c1OC ZINC000265017604 1434175227 /nfs/dbraw/zinc/17/52/27/1434175227.db2.gz SDZGOKMDDVUOMJ-UHFFFAOYSA-N 0 0 385.376 3.456 20 5 GGBDRN Cc1c(NC(=O)NCc2ccnc(OC3CCOCC3)c2)cccc1[N+](=O)[O-] ZINC000265030580 1434176691 /nfs/dbraw/zinc/17/66/91/1434176691.db2.gz VAOJVWASNALQMT-UHFFFAOYSA-N 0 0 386.408 3.178 20 5 GGBDRN Cc1cc(NC(=O)[C@@H](C)SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)no1 ZINC000265043103 1434178085 /nfs/dbraw/zinc/17/80/85/1434178085.db2.gz YVZUFCRODBVVGM-SNVBAGLBSA-N 0 0 389.393 3.202 20 5 GGBDRN CCOC(=O)c1csc(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000265047416 1434178377 /nfs/dbraw/zinc/17/83/77/1434178377.db2.gz NVPWEUBKVXETQN-SNVBAGLBSA-N 0 0 395.462 3.025 20 5 GGBDRN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 ZINC000265045021 1434178381 /nfs/dbraw/zinc/17/83/81/1434178381.db2.gz ODHINRRJYZOPAO-OAHLLOKOSA-N 0 0 396.451 3.128 20 5 GGBDRN COC(=O)[C@H]1CC12CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)CC2 ZINC000265050548 1434178917 /nfs/dbraw/zinc/17/89/17/1434178917.db2.gz SVYHWWJTLDWTMS-LLVKDONJSA-N 0 0 399.350 3.003 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](C)Oc2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000265075066 1434181907 /nfs/dbraw/zinc/18/19/07/1434181907.db2.gz LHQMITMPEYWXEO-LLVKDONJSA-N 0 0 396.346 3.402 20 5 GGBDRN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000265081335 1434182845 /nfs/dbraw/zinc/18/28/45/1434182845.db2.gz RJFMUBJDGPVFAD-UHFFFAOYSA-N 0 0 394.790 3.206 20 5 GGBDRN COc1ccc([C@@H]2[C@@H](C(=O)Oc3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1 ZINC000265108440 1434185731 /nfs/dbraw/zinc/18/57/31/1434185731.db2.gz BZHZFOMOXDFRKZ-PKOBYXMFSA-N 0 0 384.388 3.119 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C(=O)N1CCCC[C@@H]1C ZINC000265128073 1434188057 /nfs/dbraw/zinc/18/80/57/1434188057.db2.gz LZTCPSZLBDCFFP-LSDHHAIUSA-N 0 0 388.468 3.032 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1OC ZINC000265132609 1434188892 /nfs/dbraw/zinc/18/88/92/1434188892.db2.gz MWTUZNUOHRVEOB-NSHDSACASA-N 0 0 378.356 3.007 20 5 GGBDRN COc1cc(F)c([C@@H](C)NCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1OC ZINC000265166872 1434193190 /nfs/dbraw/zinc/19/31/90/1434193190.db2.gz SRGXXSINIHOBBR-LLVKDONJSA-N 0 0 392.383 3.468 20 5 GGBDRN CNC(=O)c1ccc(N[C@@H](C)c2cc(OC)c(OC)cc2F)c([N+](=O)[O-])c1 ZINC000265187667 1434196385 /nfs/dbraw/zinc/19/63/85/1434196385.db2.gz IAUFSJWMOOWKDP-JTQLQIEISA-N 0 0 377.372 3.284 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@H](C)c3cccnc3)CC2)c1 ZINC000265205164 1434199062 /nfs/dbraw/zinc/19/90/62/1434199062.db2.gz DUHORMOSUNATCP-CQSZACIVSA-N 0 0 386.477 3.231 20 5 GGBDRN CN1C(=S)N=NC1[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000265213879 1434200500 /nfs/dbraw/zinc/20/05/00/1434200500.db2.gz VJKGCKRXZHZVIG-VIFPVBQESA-N 0 0 396.860 3.077 20 5 GGBDRN CCc1cnccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000265229168 1434203758 /nfs/dbraw/zinc/20/37/58/1434203758.db2.gz PAEOZLDEASEQHH-GOSISDBHSA-N 0 0 382.420 3.104 20 5 GGBDRN C[C@@H](NC(=O)N1CCN([C@@H](C)c2cccnc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000265244645 1434206546 /nfs/dbraw/zinc/20/65/46/1434206546.db2.gz WXHMAHZQSZZYFR-CVEARBPZSA-N 0 0 383.452 3.139 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCOC[C@H]2c2ccc(C)o2)cc1SC ZINC000265250667 1434207361 /nfs/dbraw/zinc/20/73/61/1434207361.db2.gz JPOUEIGRIHURER-AWEZNQCLSA-N 0 0 392.433 3.440 20 5 GGBDRN Cc1ccnc(NCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000265258789 1434208772 /nfs/dbraw/zinc/20/87/72/1434208772.db2.gz RYKCGVWPHOOIQF-HUUCEWRRSA-N 0 0 384.436 3.160 20 5 GGBDRN C[C@@H](c1cccnc1)N1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000265259870 1434208975 /nfs/dbraw/zinc/20/89/75/1434208975.db2.gz KTQMLZCELIISGF-HNNXBMFYSA-N 0 0 395.463 3.083 20 5 GGBDRN COC(=O)NCc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000265291484 1434213163 /nfs/dbraw/zinc/21/31/63/1434213163.db2.gz MECVWTDJEBHBDV-UHFFFAOYSA-N 0 0 398.419 3.303 20 5 GGBDRN O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000265294692 1434213459 /nfs/dbraw/zinc/21/34/59/1434213459.db2.gz NEISMKXKIBLTSI-ZDUSSCGKSA-N 0 0 390.417 3.150 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 ZINC000265298278 1434213853 /nfs/dbraw/zinc/21/38/53/1434213853.db2.gz XAFXUGTWTCWBIO-HHHXNRCGSA-N 0 0 390.465 3.011 20 5 GGBDRN CCOc1cc(NC(=O)[C@H](C)Oc2cccnc2)c([N+](=O)[O-])cc1OCC ZINC000265296553 1434213859 /nfs/dbraw/zinc/21/38/59/1434213859.db2.gz DXBLCQPCHJSZPE-LBPRGKRZSA-N 0 0 375.381 3.193 20 5 GGBDRN COc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c(OC)c1OC ZINC000265300678 1434214507 /nfs/dbraw/zinc/21/45/07/1434214507.db2.gz GCQZXMLESUAVBB-UHFFFAOYSA-N 0 0 394.811 3.133 20 5 GGBDRN CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000265302648 1434215081 /nfs/dbraw/zinc/21/50/81/1434215081.db2.gz PPTMXUBRODWKLS-CYUPMTOZSA-N 0 0 379.844 3.025 20 5 GGBDRN COC(=O)NCc1ccc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000265327316 1434218981 /nfs/dbraw/zinc/21/89/81/1434218981.db2.gz LVWDKNCYRFNXGP-CYBMUJFWSA-N 0 0 386.408 3.198 20 5 GGBDRN CC(C)(C)Oc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000265347464 1434222403 /nfs/dbraw/zinc/22/24/03/1434222403.db2.gz YQKZWYNAEGMJAW-UHFFFAOYSA-N 0 0 392.433 3.428 20 5 GGBDRN CCCC[C@@H](COC)NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000265466048 1434236918 /nfs/dbraw/zinc/23/69/18/1434236918.db2.gz VMSNNHSLCQJJJA-JTQLQIEISA-N 0 0 376.356 3.140 20 5 GGBDRN CCn1cc(CNCc2cc(OC)c(OCC(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000265528657 1434242819 /nfs/dbraw/zinc/24/28/19/1434242819.db2.gz PERYPWPIRBESEA-UHFFFAOYSA-N 0 0 388.346 3.051 20 5 GGBDRN O=C(NCc1ccc(F)cc1)C1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000265536005 1434243582 /nfs/dbraw/zinc/24/35/82/1434243582.db2.gz OFUGUWPBGHKCMO-UHFFFAOYSA-N 0 0 392.818 3.315 20 5 GGBDRN C[C@@H](Oc1cccnc1)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000265547526 1434244771 /nfs/dbraw/zinc/24/47/71/1434244771.db2.gz ISMPMXNSTXHTOL-GFCCVEGCSA-N 0 0 383.326 3.348 20 5 GGBDRN CCOC(=O)c1ccnc(NCC(=O)Nc2c(C)cc(C)cc2C)c1[N+](=O)[O-] ZINC000265549182 1434244892 /nfs/dbraw/zinc/24/48/92/1434244892.db2.gz GIDJHMKAPMXYNB-UHFFFAOYSA-N 0 0 386.408 3.142 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)c1[N+](=O)[O-] ZINC000265592517 1434249018 /nfs/dbraw/zinc/24/90/18/1434249018.db2.gz PSHRAMUOEYDCMR-NSHDSACASA-N 0 0 384.392 3.224 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(C(=O)Nc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000265597635 1434249337 /nfs/dbraw/zinc/24/93/37/1434249337.db2.gz QWZKCMWGTCFCGQ-UHFFFAOYSA-N 0 0 398.419 3.022 20 5 GGBDRN CC[C@@H](C)[C@H]1CCCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000265604273 1434249953 /nfs/dbraw/zinc/24/99/53/1434249953.db2.gz JBICFSZEKNUBSX-GDBMZVCRSA-N 0 0 398.463 3.490 20 5 GGBDRN CCOC(=O)c1ccnc(NC2CCN(C(=O)C(CC)CC)CC2)c1[N+](=O)[O-] ZINC000265610045 1434250063 /nfs/dbraw/zinc/25/00/63/1434250063.db2.gz VBHXSCOPDPPWJI-UHFFFAOYSA-N 0 0 392.456 3.006 20 5 GGBDRN CCOC(=O)c1ccnc(Sc2nnc(-c3ccco3)n2CC)c1[N+](=O)[O-] ZINC000265621694 1434251064 /nfs/dbraw/zinc/25/10/64/1434251064.db2.gz YAZNKGCXGALOAC-UHFFFAOYSA-N 0 0 389.393 3.189 20 5 GGBDRN Cc1noc(C)c1C[C@@H](C)Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000265622917 1434251132 /nfs/dbraw/zinc/25/11/32/1434251132.db2.gz YDNUQBMSEKBSML-MRVPVSSYSA-N 0 0 389.380 3.239 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000265622922 1434251207 /nfs/dbraw/zinc/25/12/07/1434251207.db2.gz YDNUQBMSEKBSML-QMMMGPOBSA-N 0 0 389.380 3.239 20 5 GGBDRN COc1cc(C(=O)NCc2ccccc2OCC2CC2)c([N+](=O)[O-])cc1OC ZINC000265718364 1434259841 /nfs/dbraw/zinc/25/98/41/1434259841.db2.gz LGHNONLBLIRFAV-UHFFFAOYSA-N 0 0 386.404 3.331 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000265724872 1434260585 /nfs/dbraw/zinc/26/05/85/1434260585.db2.gz OQNGSELYZJJUFP-SFHVURJKSA-N 0 0 384.436 3.110 20 5 GGBDRN CCOc1ccc(NC(=O)CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000265753922 1434262682 /nfs/dbraw/zinc/26/26/82/1434262682.db2.gz IEJLYXIJOXQUJK-UHFFFAOYSA-N 0 0 385.420 3.026 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000265768304 1434263709 /nfs/dbraw/zinc/26/37/09/1434263709.db2.gz MDCHTACMEUDMGF-UHFFFAOYSA-N 0 0 390.461 3.059 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCC1CC1 ZINC000265777082 1434264438 /nfs/dbraw/zinc/26/44/38/1434264438.db2.gz FZBMIZKJMKQWRQ-UHFFFAOYSA-N 0 0 383.404 3.142 20 5 GGBDRN O=C(NCc1cc(F)ccc1N1CCOCC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000265791130 1434265457 /nfs/dbraw/zinc/26/54/57/1434265457.db2.gz KBUOUDLMYHVFPH-UHFFFAOYSA-N 0 0 393.802 3.154 20 5 GGBDRN C[C@@](O)(CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1cccs1 ZINC000265792383 1434265555 /nfs/dbraw/zinc/26/55/55/1434265555.db2.gz HYOODGOILSIGOR-GOSISDBHSA-N 0 0 375.450 3.212 20 5 GGBDRN CC(C)(C(=O)Nc1ccn(CCc2ccncc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000265807679 1434266752 /nfs/dbraw/zinc/26/67/52/1434266752.db2.gz XGDODVALEHWVMF-UHFFFAOYSA-N 0 0 379.420 3.345 20 5 GGBDRN Cc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1NS(C)(=O)=O ZINC000265813501 1434267212 /nfs/dbraw/zinc/26/72/12/1434267212.db2.gz PWUFQBKRLYYTRT-UHFFFAOYSA-N 0 0 391.449 3.191 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000265840912 1434271017 /nfs/dbraw/zinc/27/10/17/1434271017.db2.gz DLDYHAAGEDRIAY-WFASDCNBSA-N 0 0 377.441 3.279 20 5 GGBDRN C[C@@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC000265842257 1434271525 /nfs/dbraw/zinc/27/15/25/1434271525.db2.gz DQHNNRLSZXEPBQ-MVHLYKQMSA-N 0 0 389.452 3.370 20 5 GGBDRN CC(C)(C)OC(=O)NC1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000265843689 1434271619 /nfs/dbraw/zinc/27/16/19/1434271619.db2.gz WBXANZBNZOTDPA-UHFFFAOYSA-N 0 0 391.468 3.388 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N2CCC[C@@H](c3ncc[nH]3)C2)c([N+](=O)[O-])c1 ZINC000265860511 1434273963 /nfs/dbraw/zinc/27/39/63/1434273963.db2.gz SWPVUBUNRDCXGM-OAHLLOKOSA-N 0 0 386.456 3.018 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N2CCC[C@H](c3ncc[nH]3)C2)c([N+](=O)[O-])c1 ZINC000265860507 1434274016 /nfs/dbraw/zinc/27/40/16/1434274016.db2.gz SWPVUBUNRDCXGM-HNNXBMFYSA-N 0 0 386.456 3.018 20 5 GGBDRN CCCN(C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000265863476 1434274556 /nfs/dbraw/zinc/27/45/56/1434274556.db2.gz MDBSXNOLJBKTSF-QGTPRVQTSA-N 0 0 391.468 3.339 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC[C@H]1NC(=O)OC(C)(C)C ZINC000265876225 1434276466 /nfs/dbraw/zinc/27/64/66/1434276466.db2.gz KLGZSMBCSJWGTP-XHDPSFHLSA-N 0 0 381.404 3.109 20 5 GGBDRN 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ZINC000265898186 1434279840 /nfs/dbraw/zinc/27/98/40/1434279840.db2.gz HDIWLOLLMCIWFW-INIZCTEOSA-N 0 0 387.392 3.093 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCOc3ccc(F)cc32)cc([N+](=O)[O-])c1OC ZINC000265900207 1434279930 /nfs/dbraw/zinc/27/99/30/1434279930.db2.gz PTZRQLMTPXYLCH-CYBMUJFWSA-N 0 0 376.340 3.005 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCc2[nH]c(=O)ccc21 ZINC000265909831 1434281638 /nfs/dbraw/zinc/28/16/38/1434281638.db2.gz IUJVEDNLRZODNR-SFHVURJKSA-N 0 0 384.436 3.395 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](COC)c2ccc(CC)o2)cc1OC ZINC000265924160 1434283539 /nfs/dbraw/zinc/28/35/39/1434283539.db2.gz MWLRFBDNAIYWCF-AWEZNQCLSA-N 0 0 392.408 3.275 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCN(c2cccc(O)c2)CC1 ZINC000265923306 1434283682 /nfs/dbraw/zinc/28/36/82/1434283682.db2.gz CQNIKIBMQGMYBG-CQSZACIVSA-N 0 0 395.419 3.234 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](COC)c2ccc(CC)o2)cc1OC ZINC000265924162 1434283703 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CC(C)CCSc1ccc(C(=O)NCC2(O)CCOCC2)cc1[N+](=O)[O-] ZINC000266522132 1434346434 /nfs/dbraw/zinc/34/64/34/1434346434.db2.gz FDLZUVPNSBJVHC-UHFFFAOYSA-N 0 0 382.482 3.004 20 5 GGBDRN Cc1ccc(N2CCOC2=O)cc1N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000266537489 1434347586 /nfs/dbraw/zinc/34/75/86/1434347586.db2.gz GMQJNNVJQJNMHP-ZDUSSCGKSA-N 0 0 384.392 3.299 20 5 GGBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000266550137 1434348792 /nfs/dbraw/zinc/34/87/92/1434348792.db2.gz LJHAQTHUCIDVNB-HNNXBMFYSA-N 0 0 394.435 3.121 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000266550139 1434348824 /nfs/dbraw/zinc/34/88/24/1434348824.db2.gz LJHAQTHUCIDVNB-OAHLLOKOSA-N 0 0 394.435 3.121 20 5 GGBDRN COc1ccc(CNC(=O)N2CC[C@@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000266567872 1434350391 /nfs/dbraw/zinc/35/03/91/1434350391.db2.gz WMBYCTUFKRVTND-GOSISDBHSA-N 0 0 399.447 3.352 20 5 GGBDRN COc1ccc(CNC(=O)N2CC[C@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000266567875 1434350412 /nfs/dbraw/zinc/35/04/12/1434350412.db2.gz WMBYCTUFKRVTND-SFHVURJKSA-N 0 0 399.447 3.352 20 5 GGBDRN CCC[C@@](C)(O)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000266570458 1434350547 /nfs/dbraw/zinc/35/05/47/1434350547.db2.gz SJTIQWXUESCFIA-VBKZILBWSA-N 0 0 386.452 3.444 20 5 GGBDRN CCC[C@@](C)(O)CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000266570455 1434350552 /nfs/dbraw/zinc/35/05/52/1434350552.db2.gz SJTIQWXUESCFIA-JLTOFOAXSA-N 0 0 386.452 3.444 20 5 GGBDRN Cc1c(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cccc1N1CCOC1=O ZINC000266597473 1434352993 /nfs/dbraw/zinc/35/29/93/1434352993.db2.gz OXXWMPQVKVRKSQ-CYBMUJFWSA-N 0 0 384.392 3.299 20 5 GGBDRN Cc1ccc(N2CCOC2=O)cc1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000266602525 1434353365 /nfs/dbraw/zinc/35/33/65/1434353365.db2.gz OMOULXGKVKJOIF-CYBMUJFWSA-N 0 0 384.392 3.299 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)ccc2NC1=O ZINC000266611691 1434354427 /nfs/dbraw/zinc/35/44/27/1434354427.db2.gz BILURJCCGCERSW-ZBEGNZNMSA-N 0 0 399.403 3.204 20 5 GGBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(Cc2nc3ccccc3c(=O)[nH]2)CC1 ZINC000266615096 1434354834 /nfs/dbraw/zinc/35/48/34/1434354834.db2.gz DFHWRTQGLOCPBL-HNNXBMFYSA-N 0 0 393.447 3.122 20 5 GGBDRN CC(C)(C)Oc1ccccc1NC(=O)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000266634351 1434356985 /nfs/dbraw/zinc/35/69/85/1434356985.db2.gz DHVMORVMVTVEAD-UHFFFAOYSA-N 0 0 385.420 3.070 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)NC(=O)c3cc(OC)ccc3[N+](=O)[O-])ccc2NC1=O ZINC000266645286 1434358245 /nfs/dbraw/zinc/35/82/45/1434358245.db2.gz MKYLARWGUTYJBM-APPDUMDISA-N 0 0 399.403 3.204 20 5 GGBDRN COC(=O)c1cc(OCc2nc([C@H](C)OCC(C)C)no2)ccc1[N+](=O)[O-] ZINC000266648160 1434358673 /nfs/dbraw/zinc/35/86/73/1434358673.db2.gz XCSNNLOXZLRBHF-NSHDSACASA-N 0 0 379.369 3.077 20 5 GGBDRN CN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000266664725 1434360991 /nfs/dbraw/zinc/36/09/91/1434360991.db2.gz DYFUONXVUIGOSY-ZDUSSCGKSA-N 0 0 388.424 3.158 20 5 GGBDRN CN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000266664723 1434361069 /nfs/dbraw/zinc/36/10/69/1434361069.db2.gz DYFUONXVUIGOSY-CYBMUJFWSA-N 0 0 388.424 3.158 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCOc3ccc(OC)cc32)cc1OC ZINC000266669009 1434361765 /nfs/dbraw/zinc/36/17/65/1434361765.db2.gz OIWOXTZBMNLGGG-UHFFFAOYSA-N 0 0 388.376 3.050 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000266672748 1434362114 /nfs/dbraw/zinc/36/21/14/1434362114.db2.gz IFJUQWUHFXWVBZ-LLVKDONJSA-N 0 0 380.376 3.123 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])[C@H](C)CC ZINC000266675184 1434362359 /nfs/dbraw/zinc/36/23/59/1434362359.db2.gz QDFDYSOYKIYYBK-BMIGLBTASA-N 0 0 384.454 3.033 20 5 GGBDRN Cc1cc(C(=O)N(C)Cc2nc([C@@H](C)OCC(C)C)no2)cc([N+](=O)[O-])c1 ZINC000266691290 1434364202 /nfs/dbraw/zinc/36/42/02/1434364202.db2.gz NMCSGKNONJHSMN-CYBMUJFWSA-N 0 0 376.413 3.292 20 5 GGBDRN CC[C@H](C)Oc1cccc(NC(=O)C(=O)NCCc2ccccc2[N+](=O)[O-])c1 ZINC000266706002 1434365659 /nfs/dbraw/zinc/36/56/59/1434365659.db2.gz NCTQHFGKQAARIQ-AWEZNQCLSA-N 0 0 385.420 3.070 20 5 GGBDRN COc1ccc(OC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1OC ZINC000266707290 1434365835 /nfs/dbraw/zinc/36/58/35/1434365835.db2.gz ZNAKLBACQVCSPJ-UHFFFAOYSA-N 0 0 386.404 3.434 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1csc(NC(=O)C(C)(C)C)n1 ZINC000266707550 1434365892 /nfs/dbraw/zinc/36/58/92/1434365892.db2.gz ZNTMRGAXBFBQNJ-UHFFFAOYSA-N 0 0 392.437 3.226 20 5 GGBDRN CC[C@H](C)Oc1ccc(NC(=O)C(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000266720053 1434367579 /nfs/dbraw/zinc/36/75/79/1434367579.db2.gz OLXGYTDKSKVEKY-AWEZNQCLSA-N 0 0 385.420 3.070 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2nc([C@H](C)OCC(C)C)no2)c1 ZINC000266739279 1434369638 /nfs/dbraw/zinc/36/96/38/1434369638.db2.gz PSVBZYRLOBEZEE-NSHDSACASA-N 0 0 379.369 3.077 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)Cc1nccn1C(F)F ZINC000266750838 1434371044 /nfs/dbraw/zinc/37/10/44/1434371044.db2.gz PYXSDULUJWIAAR-SNVBAGLBSA-N 0 0 378.339 3.429 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])n1 ZINC000266760463 1434372317 /nfs/dbraw/zinc/37/23/17/1434372317.db2.gz PXWKRKCQLYYHDI-NSHDSACASA-N 0 0 394.453 3.244 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)CCOc2cccc([N+](=O)[O-])c2)n1 ZINC000266764918 1434372795 /nfs/dbraw/zinc/37/27/95/1434372795.db2.gz UJRSLTCFDBVIOU-AWEZNQCLSA-N 0 0 378.429 3.222 20 5 GGBDRN COc1ccc(CNC(=O)N(Cc2ccc(O)cc2)CC2CC2)cc1[N+](=O)[O-] ZINC000266816516 1434378372 /nfs/dbraw/zinc/37/83/72/1434378372.db2.gz XCRRFUHJJKUFCH-UHFFFAOYSA-N 0 0 385.420 3.431 20 5 GGBDRN Cc1nc(CN2CCC(CNc3ccc([N+](=O)[O-])c(N)c3F)CC2)oc1C ZINC000266826738 1434379377 /nfs/dbraw/zinc/37/93/77/1434379377.db2.gz BGJHLUDYQTWZFM-UHFFFAOYSA-N 0 0 377.420 3.245 20 5 GGBDRN CCOC(=O)c1csc(N(C)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000266832474 1434379896 /nfs/dbraw/zinc/37/98/96/1434379896.db2.gz DCZMXAYCQJNXBQ-JTQLQIEISA-N 0 0 395.462 3.372 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000266862979 1434383034 /nfs/dbraw/zinc/38/30/34/1434383034.db2.gz PTHWHBGGVAPESX-UHFFFAOYSA-N 0 0 388.371 3.454 20 5 GGBDRN C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000266902336 1434386964 /nfs/dbraw/zinc/38/69/64/1434386964.db2.gz XMHZTJJWSLWLOJ-RDJZCZTQSA-N 0 0 391.431 3.269 20 5 GGBDRN COC(=O)c1sc(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])nc1C(C)(C)C ZINC000266928065 1434389518 /nfs/dbraw/zinc/38/95/18/1434389518.db2.gz MGXJMVKTLMEOPD-UHFFFAOYSA-N 0 0 393.421 3.396 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000266946395 1434391491 /nfs/dbraw/zinc/39/14/91/1434391491.db2.gz SNTBGMYQWFZEBP-NEPJUHHUSA-N 0 0 377.832 3.178 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000266946403 1434391527 /nfs/dbraw/zinc/39/15/27/1434391527.db2.gz SNTBGMYQWFZEBP-VXGBXAGGSA-N 0 0 377.832 3.178 20 5 GGBDRN COCc1cc([N+](=O)[O-])ccc1N1CCC(C(=O)NC2CCCCC2)CC1 ZINC000266958313 1434392910 /nfs/dbraw/zinc/39/29/10/1434392910.db2.gz HFUBLKZEUHRPTI-UHFFFAOYSA-N 0 0 375.469 3.407 20 5 GGBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000266958139 1434393063 /nfs/dbraw/zinc/39/30/63/1434393063.db2.gz VWOGNNMBAIPQHJ-VXGBXAGGSA-N 0 0 377.832 3.178 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCO[C@H]2c2ccccc2)cc1OC ZINC000266962150 1434393231 /nfs/dbraw/zinc/39/32/31/1434393231.db2.gz MTYDSSPVVKACEE-BEFAXECRSA-N 0 0 386.404 3.262 20 5 GGBDRN Cc1nc2sccn2c1CN(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000266974744 1434394805 /nfs/dbraw/zinc/39/48/05/1434394805.db2.gz NHSNMKQNKPMBTP-UHFFFAOYSA-N 0 0 399.476 3.485 20 5 GGBDRN O=C(NCCc1cccs1)C1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000266997940 1434397312 /nfs/dbraw/zinc/39/73/12/1434397312.db2.gz FREWUXRCGNYLFH-UHFFFAOYSA-N 0 0 391.468 3.366 20 5 GGBDRN COCc1cc([N+](=O)[O-])ccc1N1CCCN(C(=O)c2ccc(F)cc2)CC1 ZINC000266996971 1434397349 /nfs/dbraw/zinc/39/73/49/1434397349.db2.gz XBLIAKGFVKYOKJ-UHFFFAOYSA-N 0 0 387.411 3.233 20 5 GGBDRN O=C(c1ccc(F)cc1)N1CCCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000267005251 1434398025 /nfs/dbraw/zinc/39/80/25/1434398025.db2.gz FLNBEHIYOAVEBW-UHFFFAOYSA-N 0 0 375.375 3.221 20 5 GGBDRN CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000267022187 1434399631 /nfs/dbraw/zinc/39/96/31/1434399631.db2.gz KPLFWVBLMHHYJQ-UHFFFAOYSA-N 0 0 388.399 3.153 20 5 GGBDRN COc1cc(CSc2nnc(N)n2C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000267031206 1434400661 /nfs/dbraw/zinc/40/06/61/1434400661.db2.gz LLIIFDDSHDXWFN-UHFFFAOYSA-N 0 0 387.368 3.006 20 5 GGBDRN Cc1nc2n(n1)CCN(C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1)C2 ZINC000267146620 1434410488 /nfs/dbraw/zinc/41/04/88/1434410488.db2.gz VQPCIXYOFVHZDQ-UHFFFAOYSA-N 0 0 389.481 3.289 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1N1CCC(OCCCNC(=O)OC(C)(C)C)CC1 ZINC000267146671 1434410503 /nfs/dbraw/zinc/41/05/03/1434410503.db2.gz BBANUUMCRHAWEF-UHFFFAOYSA-N 0 0 394.472 3.198 20 5 GGBDRN CCOC(=O)c1csc(N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000267161336 1434411535 /nfs/dbraw/zinc/41/15/35/1434411535.db2.gz QMLMFXWICCCPGZ-UHFFFAOYSA-N 0 0 377.422 3.169 20 5 GGBDRN O=C(c1cc(NCc2cccnc2-n2cccn2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000267164317 1434411687 /nfs/dbraw/zinc/41/16/87/1434411687.db2.gz AULYZAQDPPYKTL-UHFFFAOYSA-N 0 0 392.419 3.024 20 5 GGBDRN CCN(C[C@H]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1)CC(F)(F)F ZINC000267223120 1434415002 /nfs/dbraw/zinc/41/50/02/1434415002.db2.gz OCWRYCBACJMINK-LLVKDONJSA-N 0 0 377.338 3.080 20 5 GGBDRN Cc1cc(C(=O)N2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000267223055 1434415060 /nfs/dbraw/zinc/41/50/60/1434415060.db2.gz UPUBIEUDIXSCRE-UHFFFAOYSA-N 0 0 383.404 3.100 20 5 GGBDRN CCN(C[C@@H]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)C1)CC(F)(F)F ZINC000267226158 1434415257 /nfs/dbraw/zinc/41/52/57/1434415257.db2.gz OSBOIHCBXXYHKU-LBPRGKRZSA-N 0 0 398.385 3.422 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(N(C)C[C@H]2CCOC2)c([N+](=O)[O-])c1 ZINC000267247124 1434416702 /nfs/dbraw/zinc/41/67/02/1434416702.db2.gz HUYKKEXDMBSPFH-CQSZACIVSA-N 0 0 398.415 3.085 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CCC(NC(N)=O)CC2)cc1[N+](=O)[O-] ZINC000267252180 1434416884 /nfs/dbraw/zinc/41/68/84/1434416884.db2.gz RVMHZKDIZQVOHO-UHFFFAOYSA-N 0 0 394.497 3.006 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000267320161 1434422636 /nfs/dbraw/zinc/42/26/36/1434422636.db2.gz VUQPHFKTAYAZQQ-CYBMUJFWSA-N 0 0 388.424 3.158 20 5 GGBDRN C[C@@H](Nc1ccccc1OCC(=O)N1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000267328240 1434423339 /nfs/dbraw/zinc/42/33/39/1434423339.db2.gz QWEAIMSERPLLPF-OAHLLOKOSA-N 0 0 385.420 3.006 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000267343740 1434424455 /nfs/dbraw/zinc/42/44/55/1434424455.db2.gz DCTXVZRBVDCSBL-LBPRGKRZSA-N 0 0 377.832 3.440 20 5 GGBDRN CC[C@H](NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1nnc2n1CCCCC2 ZINC000267355995 1434425400 /nfs/dbraw/zinc/42/54/00/1434425400.db2.gz QHQWKQFYOOSBOT-CJNGLKHVSA-N 0 0 386.456 3.424 20 5 GGBDRN CC[C@@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1nnc2n1CCCCC2 ZINC000267356002 1434425405 /nfs/dbraw/zinc/42/54/05/1434425405.db2.gz QHQWKQFYOOSBOT-XJKSGUPXSA-N 0 0 386.456 3.424 20 5 GGBDRN COC[C@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000267368132 1434426412 /nfs/dbraw/zinc/42/64/12/1434426412.db2.gz JJAKFNQHTKONNI-LBPRGKRZSA-N 0 0 390.364 3.292 20 5 GGBDRN COC1CCN([C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)CC1 ZINC000267396554 1434429018 /nfs/dbraw/zinc/42/90/18/1434429018.db2.gz FCODLLFIOIWVES-GFCCVEGCSA-N 0 0 390.465 3.156 20 5 GGBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc21)N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000267417715 1434430737 /nfs/dbraw/zinc/43/07/37/1434430737.db2.gz RASXWZVAPLPSHW-MRXNPFEDSA-N 0 0 387.436 3.266 20 5 GGBDRN CC(C)(C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000267432024 1434432320 /nfs/dbraw/zinc/43/23/20/1434432320.db2.gz VMGXIGXLPJUSSD-IBGZPJMESA-N 0 0 390.480 3.449 20 5 GGBDRN COc1cc(COc2ncc(C)cc2[N+](=O)[O-])c([N+](=O)[O-])cc1OC(F)F ZINC000267434794 1434432491 /nfs/dbraw/zinc/43/24/91/1434432491.db2.gz XMVMFIFCCBPNNQ-UHFFFAOYSA-N 0 0 385.279 3.395 20 5 GGBDRN Cc1c(NC(=O)N2CC[C@H](N(C)C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000267458643 1434435813 /nfs/dbraw/zinc/43/58/13/1434435813.db2.gz PIUFESUTNQAGMS-ZDUSSCGKSA-N 0 0 378.429 3.376 20 5 GGBDRN COC[C@@H]1CCN([C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000267466860 1434436735 /nfs/dbraw/zinc/43/67/35/1434436735.db2.gz WRARUGIWTKCCSK-QWHCGFSZSA-N 0 0 390.465 3.014 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000267475092 1434438039 /nfs/dbraw/zinc/43/80/39/1434438039.db2.gz AAKAXWUXYANCMG-NVXWUHKLSA-N 0 0 389.477 3.497 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc2nc(C3CC3)oc2c1 ZINC000267496159 1434440940 /nfs/dbraw/zinc/44/09/40/1434440940.db2.gz 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/nfs/dbraw/zinc/63/18/04/1434631804.db2.gz MEBHGKRQNGATFF-DJJJIMSYSA-N 0 0 387.411 3.186 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000269366089 1434631889 /nfs/dbraw/zinc/63/18/89/1434631889.db2.gz KRONZRWVPGVLIG-UHFFFAOYSA-N 0 0 387.440 3.241 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H](O)c1cccc(F)c1 ZINC000269366319 1434631897 /nfs/dbraw/zinc/63/18/97/1434631897.db2.gz MEBHGKRQNGATFF-YJYMSZOUSA-N 0 0 387.411 3.186 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccccc2NC(=O)N2CCCC2)c1[N+](=O)[O-] ZINC000269371156 1434632975 /nfs/dbraw/zinc/63/29/75/1434632975.db2.gz MCXGJQIEKADNNW-UHFFFAOYSA-N 0 0 386.412 3.321 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCc2ccc(N3CCC(C)CC3)nc2)c1[N+](=O)[O-] ZINC000269373243 1434633475 /nfs/dbraw/zinc/63/34/75/1434633475.db2.gz MUWFKWLVXMZNTE-UHFFFAOYSA-N 0 0 386.456 3.003 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)c1[N+](=O)[O-] ZINC000269380633 1434634914 /nfs/dbraw/zinc/63/49/14/1434634914.db2.gz JJIFNANLOYQIGI-ZDUSSCGKSA-N 0 0 384.396 3.421 20 5 GGBDRN Cc1nn(C)c(N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000269385048 1434635791 /nfs/dbraw/zinc/63/57/91/1434635791.db2.gz QRGQQBYSXSURBA-CYBMUJFWSA-N 0 0 386.456 3.066 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccncc2)Cc2cccnc2)c1[N+](=O)[O-] ZINC000269390195 1434636374 /nfs/dbraw/zinc/63/63/74/1434636374.db2.gz LQSLUZDTTFRXEZ-UHFFFAOYSA-N 0 0 380.408 3.074 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000269390446 1434636382 /nfs/dbraw/zinc/63/63/82/1434636382.db2.gz LVULRTBYVGHSEY-UHFFFAOYSA-N 0 0 379.804 3.049 20 5 GGBDRN COc1cc(CN(C)C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])ccc1SC ZINC000269393729 1434637269 /nfs/dbraw/zinc/63/72/69/1434637269.db2.gz MNTOMCNMVAYEBE-UHFFFAOYSA-N 0 0 378.454 3.444 20 5 GGBDRN CCCNC(=O)c1ccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])cc1Cl ZINC000269394922 1434637309 /nfs/dbraw/zinc/63/73/09/1434637309.db2.gz MRRNIWURMVFDTF-UHFFFAOYSA-N 0 0 393.831 3.487 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1[N+](=O)[O-] ZINC000269400149 1434638665 /nfs/dbraw/zinc/63/86/65/1434638665.db2.gz SUTQVBLPSKULJU-UHFFFAOYSA-N 0 0 385.424 3.320 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1OC ZINC000269411013 1434640828 /nfs/dbraw/zinc/64/08/28/1434640828.db2.gz VPDKKVWSQWWGSH-UHFFFAOYSA-N 0 0 376.413 3.169 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c1[N+](=O)[O-] ZINC000269422721 1434643392 /nfs/dbraw/zinc/64/33/92/1434643392.db2.gz XUJGVDHCQFTLQP-NSHDSACASA-N 0 0 385.424 3.281 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c1[N+](=O)[O-] ZINC000269438378 1434645601 /nfs/dbraw/zinc/64/56/01/1434645601.db2.gz OWVFYRBVXWOHPI-ZDUSSCGKSA-N 0 0 387.440 3.087 20 5 GGBDRN CC(C)(C)OC(=O)NCc1nc(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)cs1 ZINC000269436796 1434645720 /nfs/dbraw/zinc/64/57/20/1434645720.db2.gz OONUQPGGXIPDHT-UHFFFAOYSA-N 0 0 397.384 3.434 20 5 GGBDRN CCOC(=O)N(C)c1ccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])cc1 ZINC000269440064 1434646361 /nfs/dbraw/zinc/64/63/61/1434646361.db2.gz PDJZMBGOICXXGU-UHFFFAOYSA-N 0 0 375.385 3.286 20 5 GGBDRN CSCc1noc(CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000269450752 1434647614 /nfs/dbraw/zinc/64/76/14/1434647614.db2.gz CVFAAPLXPHYOQH-UHFFFAOYSA-N 0 0 388.352 3.014 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@H]2c2nc3ccccc3n2C)c1[N+](=O)[O-] ZINC000269473271 1434650992 /nfs/dbraw/zinc/65/09/92/1434650992.db2.gz UYYYZQHTGXKPOM-AWEZNQCLSA-N 0 0 382.424 3.305 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])o1 ZINC000269487795 1434652982 /nfs/dbraw/zinc/65/29/82/1434652982.db2.gz LAZLYBCHUKHSNX-AWEZNQCLSA-N 0 0 396.407 3.073 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(SC(=O)N(C)C)cc2)c1[N+](=O)[O-] ZINC000269500695 1434654050 /nfs/dbraw/zinc/65/40/50/1434654050.db2.gz ZCHWDZYFOBLGHB-UHFFFAOYSA-N 0 0 377.426 3.467 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(CO)CC2)cc1 ZINC000269507476 1434654787 /nfs/dbraw/zinc/65/47/87/1434654787.db2.gz FSBIMFYRFZUSRH-UHFFFAOYSA-N 0 0 386.404 3.240 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)[C@@H](O)c2cccc(F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000269531871 1434656881 /nfs/dbraw/zinc/65/68/81/1434656881.db2.gz IPVIGBJVGCERBP-APPDUMDISA-N 0 0 391.355 3.111 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000269541436 1434657735 /nfs/dbraw/zinc/65/77/35/1434657735.db2.gz VIAGXEADBUJMBG-QYOLQKOISA-N 0 0 378.454 3.012 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)c1[N+](=O)[O-] ZINC000269541434 1434657871 /nfs/dbraw/zinc/65/78/71/1434657871.db2.gz VIAGXEADBUJMBG-KPHLJTLVSA-N 0 0 378.454 3.012 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]2C[C@H](O)c2cccs2)c1[N+](=O)[O-] ZINC000269554049 1434659089 /nfs/dbraw/zinc/65/90/89/1434659089.db2.gz YPJOYWKFSWZIGI-NEPJUHHUSA-N 0 0 378.454 3.231 20 5 GGBDRN Cc1nnc([C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)C2)[nH]1 ZINC000269567863 1434659877 /nfs/dbraw/zinc/65/98/77/1434659877.db2.gz GDDVAZKCIADSFX-JTQLQIEISA-N 0 0 383.330 3.060 20 5 GGBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@H](O)c1c(F)cccc1F ZINC000269574441 1434660450 /nfs/dbraw/zinc/66/04/50/1434660450.db2.gz QFBWDPNUXQQNNY-GUYCJALGSA-N 0 0 380.347 3.124 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H](O)c2ccc(F)cc2)cc1SC ZINC000269579283 1434660913 /nfs/dbraw/zinc/66/09/13/1434660913.db2.gz RAPKXLKIIZRMHJ-BMLIUANNSA-N 0 0 394.424 3.316 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000269613304 1434663538 /nfs/dbraw/zinc/66/35/38/1434663538.db2.gz QGHOYRYVOGPVHD-UHFFFAOYSA-N 0 0 380.832 3.071 20 5 GGBDRN NC(=O)C1CCN(c2ccc(Nc3c(F)cc([N+](=O)[O-])cc3F)cc2)CC1 ZINC000269619602 1434664017 /nfs/dbraw/zinc/66/40/17/1434664017.db2.gz HXUQIDISTPCZDA-UHFFFAOYSA-N 0 0 376.363 3.318 20 5 GGBDRN COC1(C(=O)Nc2cccc([N+](=O)[O-])c2C)CCN(C(=O)OC(C)(C)C)CC1 ZINC000269644195 1434666347 /nfs/dbraw/zinc/66/63/47/1434666347.db2.gz XLTFSEODCBRURL-UHFFFAOYSA-N 0 0 393.440 3.258 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)cccc1[N+](=O)[O-] ZINC000269738211 1434673092 /nfs/dbraw/zinc/67/30/92/1434673092.db2.gz UQQKZDLUOILSCI-UHFFFAOYSA-N 0 0 396.447 3.174 20 5 GGBDRN COc1cc(C(=O)NC[C@H](C)SC)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000269802263 1434676931 /nfs/dbraw/zinc/67/69/31/1434676931.db2.gz BWJLEYBWTOGVHQ-JTQLQIEISA-N 0 0 397.478 3.120 20 5 GGBDRN CNC(=O)CCCN(C)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000269842198 1434680626 /nfs/dbraw/zinc/68/06/26/1434680626.db2.gz IANWWFXSLBAOQQ-UHFFFAOYSA-N 0 0 381.498 3.331 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@H](C)C[C@H](O)c2cccs2)cc([N+](=O)[O-])c1 ZINC000269853224 1434681359 /nfs/dbraw/zinc/68/13/59/1434681359.db2.gz RUIQUOZWBGUALT-NHYWBVRUSA-N 0 0 392.433 3.075 20 5 GGBDRN CCOc1cc(NC(=O)N2CCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])cc1OCC ZINC000269873669 1434683141 /nfs/dbraw/zinc/68/31/41/1434683141.db2.gz ZNPBOTTUKWPXOU-CHWSQXEVSA-N 0 0 381.429 3.159 20 5 GGBDRN CCOc1cc(NC(=O)N2CCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])cc1OCC ZINC000269873674 1434683154 /nfs/dbraw/zinc/68/31/54/1434683154.db2.gz ZNPBOTTUKWPXOU-QWHCGFSZSA-N 0 0 381.429 3.159 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1oc(=O)n2C ZINC000269905050 1434685716 /nfs/dbraw/zinc/68/57/16/1434685716.db2.gz NOZUHYDMRXIISD-UHFFFAOYSA-N 0 0 384.392 3.482 20 5 GGBDRN CCOc1cc(NC(=O)N[C@@H]2CCOC(C)(C)C2)c([N+](=O)[O-])cc1OCC ZINC000269909996 1434686286 /nfs/dbraw/zinc/68/62/86/1434686286.db2.gz GJLXSAATVGRKDF-GFCCVEGCSA-N 0 0 381.429 3.471 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)cc1OC ZINC000269924200 1434687273 /nfs/dbraw/zinc/68/72/73/1434687273.db2.gz BMBBAZYTJVBXSQ-JBBXEZCESA-N 0 0 390.436 3.080 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cc1SC ZINC000269960853 1434690324 /nfs/dbraw/zinc/69/03/24/1434690324.db2.gz UBCQXXBCYVPRMJ-JECHBYEQSA-N 0 0 392.477 3.403 20 5 GGBDRN CC(=O)Nc1ccc(OC[C@@H](O)CSCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000269959390 1434690383 /nfs/dbraw/zinc/69/03/83/1434690383.db2.gz XUWHEQCYOHTWLR-QGZVFWFLSA-N 0 0 376.434 3.226 20 5 GGBDRN CC(=O)Nc1ccc(OC[C@H](O)CSCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000269959389 1434690389 /nfs/dbraw/zinc/69/03/89/1434690389.db2.gz XUWHEQCYOHTWLR-KRWDZBQOSA-N 0 0 376.434 3.226 20 5 GGBDRN Cc1nc(N2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)CC2)sc1C ZINC000269968336 1434690872 /nfs/dbraw/zinc/69/08/72/1434690872.db2.gz DHRCLCYBUCUSHI-UHFFFAOYSA-N 0 0 385.449 3.112 20 5 GGBDRN CCOc1cc(NC(=O)N(C)C[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])cc1OCC ZINC000269995356 1434692383 /nfs/dbraw/zinc/69/23/83/1434692383.db2.gz SRTBHWMZLNWRCA-WFASDCNBSA-N 0 0 381.429 3.017 20 5 GGBDRN COCCOc1ccc(CNC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000270002696 1434692882 /nfs/dbraw/zinc/69/28/82/1434692882.db2.gz JUMZMGXNVAUHOR-UHFFFAOYSA-N 0 0 390.461 3.170 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000270033100 1434695051 /nfs/dbraw/zinc/69/50/51/1434695051.db2.gz HMEVSCKBPQDSIX-MUDIAHQHSA-N 0 0 387.461 3.398 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000270033097 1434695066 /nfs/dbraw/zinc/69/50/66/1434695066.db2.gz HMEVSCKBPQDSIX-JWNZJDHWSA-N 0 0 387.461 3.398 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@H]2CC[C@H](O)CC2)cc1 ZINC000270047060 1434696389 /nfs/dbraw/zinc/69/63/89/1434696389.db2.gz GFIFFYSYKAUSOT-CTYIDZIISA-N 0 0 386.404 3.429 20 5 GGBDRN CC[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000270085509 1434701119 /nfs/dbraw/zinc/70/11/19/1434701119.db2.gz GLYJENLREUKIME-PZJWPPBQSA-N 0 0 393.447 3.222 20 5 GGBDRN CCOc1ccc(OC[C@@H](O)COc2ccc(C(C)=O)cc2[N+](=O)[O-])cc1 ZINC000270092538 1434702210 /nfs/dbraw/zinc/70/22/10/1434702210.db2.gz INDYYSXXCXSDEZ-OAHLLOKOSA-N 0 0 375.377 3.015 20 5 GGBDRN COC(=O)CCSc1cccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1 ZINC000270101169 1434702938 /nfs/dbraw/zinc/70/29/38/1434702938.db2.gz LVLFOFAMIWPRAP-UHFFFAOYSA-N 0 0 392.437 3.349 20 5 GGBDRN COc1cccc(OC)c1OC[C@@H](O)COc1cc([N+](=O)[O-])ccc1Cl ZINC000270108401 1434703762 /nfs/dbraw/zinc/70/37/62/1434703762.db2.gz KQXYSRAXFPSROR-LBPRGKRZSA-N 0 0 383.784 3.084 20 5 GGBDRN CC[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])[C@H](c1ccc(C)cc1)n1cncn1 ZINC000270141078 1434707103 /nfs/dbraw/zinc/70/71/03/1434707103.db2.gz PJBCAUXBWANSKP-HKUYNNGSSA-N 0 0 397.410 3.432 20 5 GGBDRN CC[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000270141056 1434707124 /nfs/dbraw/zinc/70/71/24/1434707124.db2.gz PIJHWWLOVMFIDC-GHTZIAJQSA-N 0 0 393.447 3.222 20 5 GGBDRN C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc([S@](C)=O)cc1 ZINC000270152699 1434707852 /nfs/dbraw/zinc/70/78/52/1434707852.db2.gz SJFCOQVSPRKTEX-PWFNWSNSSA-N 0 0 389.477 3.402 20 5 GGBDRN C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc([S@](C)=O)cc1 ZINC000270170239 1434709064 /nfs/dbraw/zinc/70/90/64/1434709064.db2.gz VIWQTCXXULQWPX-JWNZJDHWSA-N 0 0 387.461 3.398 20 5 GGBDRN 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Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1 ZINC000272224653 1434879294 /nfs/dbraw/zinc/87/92/94/1434879294.db2.gz COYHPNXROXPFTM-UONOGXRCSA-N 0 0 377.441 3.279 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000272222978 1434879398 /nfs/dbraw/zinc/87/93/98/1434879398.db2.gz AGCWDQKJCXLNMM-STQMWFEESA-N 0 0 390.440 3.471 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000272225602 1434879506 /nfs/dbraw/zinc/87/95/06/1434879506.db2.gz FGQSJMIYNHVGIV-HNNXBMFYSA-N 0 0 398.385 3.478 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000272229633 1434879937 /nfs/dbraw/zinc/87/99/37/1434879937.db2.gz UHRJKIUEFCZFPV-UKRRQHHQSA-N 0 0 392.456 3.040 20 5 GGBDRN CCOC(=O)c1cc(N2CCC(c3nncn3C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000272247640 1434881402 /nfs/dbraw/zinc/88/14/02/1434881402.db2.gz LJJOMCHCOROFFU-UHFFFAOYSA-N 0 0 387.440 3.328 20 5 GGBDRN CCCOc1cc(NC(=O)N[C@H](C)c2nc[nH]n2)c([N+](=O)[O-])cc1OCCC ZINC000272252293 1434881766 /nfs/dbraw/zinc/88/17/66/1434881766.db2.gz IRGBSFHDNBLUEN-LLVKDONJSA-N 0 0 392.416 3.173 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000272254206 1434881922 /nfs/dbraw/zinc/88/19/22/1434881922.db2.gz TXACIVSSNWMTSC-LLVKDONJSA-N 0 0 398.385 3.433 20 5 GGBDRN Cc1cc(NC(=O)c2cc(S(C)(=O)=O)ccc2OC(C)C)ccc1[N+](=O)[O-] ZINC000272267944 1434882799 /nfs/dbraw/zinc/88/27/99/1434882799.db2.gz MUIYYQDPBOGHSZ-UHFFFAOYSA-N 0 0 392.433 3.346 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000272275870 1434883408 /nfs/dbraw/zinc/88/34/08/1434883408.db2.gz MCOUTSKNGPKPDH-KGLIPLIRSA-N 0 0 377.441 3.279 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccn(CC(F)(F)F)n1 ZINC000272282215 1434884033 /nfs/dbraw/zinc/88/40/33/1434884033.db2.gz DSMXMJIZKACJRE-UHFFFAOYSA-N 0 0 391.737 3.371 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)cc([N+](=O)[O-])c1 ZINC000272281890 1434884073 /nfs/dbraw/zinc/88/40/73/1434884073.db2.gz IOGQPTFMCOOBMX-KGLIPLIRSA-N 0 0 377.441 3.279 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000272316386 1434886852 /nfs/dbraw/zinc/88/68/52/1434886852.db2.gz SQYMGOGKUAYOMG-NWDGAFQWSA-N 0 0 381.404 3.109 20 5 GGBDRN C[C@H](O)C[C@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000272332171 1434887744 /nfs/dbraw/zinc/88/77/44/1434887744.db2.gz LTMZJNNZNZRUGL-DZGCQCFKSA-N 0 0 378.375 3.358 20 5 GGBDRN Cc1ccc(C(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000272334354 1434887928 /nfs/dbraw/zinc/88/79/28/1434887928.db2.gz OIAGMDXOUCJWTH-DZGCQCFKSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1ccc(C(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000272334370 1434887991 /nfs/dbraw/zinc/88/79/91/1434887991.db2.gz OIAGMDXOUCJWTH-ZFWWWQNUSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000272345298 1434889206 /nfs/dbraw/zinc/88/92/06/1434889206.db2.gz QBMYDRNYDXOEGA-DZGCQCFKSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000272384564 1434892579 /nfs/dbraw/zinc/89/25/79/1434892579.db2.gz WAKLNEPQYVUWNY-CYBMUJFWSA-N 0 0 393.831 3.071 20 5 GGBDRN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272409622 1434894470 /nfs/dbraw/zinc/89/44/70/1434894470.db2.gz KXNGHXDVGRTVDD-KBXCAEBGSA-N 0 0 384.388 3.221 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1 ZINC000272415254 1434894706 /nfs/dbraw/zinc/89/47/06/1434894706.db2.gz GCSSDCUJHCCCJT-KBPBESRZSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 ZINC000272415264 1434894725 /nfs/dbraw/zinc/89/47/25/1434894725.db2.gz GCSSDCUJHCCCJT-ZIAGYGMSSA-N 0 0 377.441 3.279 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1c1nnc2n1CCCC2 ZINC000272432038 1434895785 /nfs/dbraw/zinc/89/57/85/1434895785.db2.gz DBTWTPOSRGPAAH-QGZVFWFLSA-N 0 0 398.467 3.002 20 5 GGBDRN O=C(N(Cc1ccncc1)C[C@H]1CCCO1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272441317 1434896457 /nfs/dbraw/zinc/89/64/57/1434896457.db2.gz BEERUYNBIUTKCW-QGZVFWFLSA-N 0 0 391.374 3.289 20 5 GGBDRN CC(=O)N1CCc2sc(C(=O)Cn3nc(C)c4cc([N+](=O)[O-])ccc43)cc2C1 ZINC000272452326 1434897360 /nfs/dbraw/zinc/89/73/60/1434897360.db2.gz MTZKMZGXOYAUCE-UHFFFAOYSA-N 0 0 398.444 3.102 20 5 GGBDRN COc1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000272461764 1434897888 /nfs/dbraw/zinc/89/78/88/1434897888.db2.gz CPOKTASBMKSBBH-AWEZNQCLSA-N 0 0 386.404 3.153 20 5 GGBDRN COCc1cc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000272470309 1434898539 /nfs/dbraw/zinc/89/85/39/1434898539.db2.gz AEODYKMIYQISLL-LJQANCHMSA-N 0 0 384.411 3.493 20 5 GGBDRN CC(C)(C)OC(=O)NC1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272477182 1434899053 /nfs/dbraw/zinc/89/90/53/1434899053.db2.gz GEAGMOINWLAJJQ-UHFFFAOYSA-N 0 0 399.394 3.202 20 5 GGBDRN CN(C)[C@@H](CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000272496118 1434900481 /nfs/dbraw/zinc/90/04/81/1434900481.db2.gz FYKOWRMNCATXFA-ROUUACIJSA-N 0 0 385.493 3.372 20 5 GGBDRN CO[C@@H](C)c1nc(CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000272510130 1434902088 /nfs/dbraw/zinc/90/20/88/1434902088.db2.gz YGIGWMDPJRZHII-JTQLQIEISA-N 0 0 398.872 3.454 20 5 GGBDRN Cn1ccnc1[C@@H](NCCN1CCc2sccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000272514096 1434902741 /nfs/dbraw/zinc/90/27/41/1434902741.db2.gz JSLDALLACAALJN-IBGZPJMESA-N 0 0 397.504 3.127 20 5 GGBDRN COc1cccc(O[C@H](C)CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272537900 1434905450 /nfs/dbraw/zinc/90/54/50/1434905450.db2.gz OKBZJHKSODAMKZ-FOIQADDNSA-N 0 0 396.447 3.483 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272539078 1434905648 /nfs/dbraw/zinc/90/56/48/1434905648.db2.gz OREZZXNUUDISON-ICSRJNTNSA-N 0 0 395.463 3.437 20 5 GGBDRN CCc1nn(C)c(CC)c1CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272542010 1434906088 /nfs/dbraw/zinc/90/60/88/1434906088.db2.gz PJJFWCXXFQJFMV-IBGZPJMESA-N 0 0 382.468 3.066 20 5 GGBDRN Cn1ccnc1[C@@H](NCc1cccc2c1OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000272549668 1434906807 /nfs/dbraw/zinc/90/68/07/1434906807.db2.gz RBRXRORKDVDHTP-IBGZPJMESA-N 0 0 394.431 3.369 20 5 GGBDRN CCc1cc(NC[C@H]2CC(=O)N(C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272561729 1434908103 /nfs/dbraw/zinc/90/81/03/1434908103.db2.gz VPURLWXLQOZEGM-CYBMUJFWSA-N 0 0 381.436 3.037 20 5 GGBDRN COc1cc(-c2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)ccc1[N+](=O)[O-] ZINC000272570006 1434908698 /nfs/dbraw/zinc/90/86/98/1434908698.db2.gz CWFDNZVOIZJUGH-GOSISDBHSA-N 0 0 396.403 3.227 20 5 GGBDRN COc1cc(-c2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)ccc1[N+](=O)[O-] ZINC000272570011 1434908780 /nfs/dbraw/zinc/90/87/80/1434908780.db2.gz CWFDNZVOIZJUGH-SFHVURJKSA-N 0 0 396.403 3.227 20 5 GGBDRN COCCOc1ccc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272572115 1434909133 /nfs/dbraw/zinc/90/91/33/1434909133.db2.gz WFINRYGIRFOWIE-HXUWFJFHSA-N 0 0 396.447 3.233 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@@](C)(O)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000272585849 1434910843 /nfs/dbraw/zinc/91/08/43/1434910843.db2.gz ZCRRKQJXCYZQJR-AZUAARDMSA-N 0 0 384.411 3.054 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000272643439 1434918952 /nfs/dbraw/zinc/91/89/52/1434918952.db2.gz LXXAYXSHZLZDDM-CQSZACIVSA-N 0 0 398.467 3.363 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(NC(=O)NC2CC2)cc1 ZINC000272648969 1434919398 /nfs/dbraw/zinc/91/93/98/1434919398.db2.gz DPROFEKRENFVLO-LLVKDONJSA-N 0 0 384.396 3.156 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000272652025 1434919764 /nfs/dbraw/zinc/91/97/64/1434919764.db2.gz FIQPOIXTUFHQRS-OLZOCXBDSA-N 0 0 393.444 3.147 20 5 GGBDRN CC(C)[C@@H]1C[C@@H](CC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)CCO1 ZINC000272690289 1434923154 /nfs/dbraw/zinc/92/31/54/1434923154.db2.gz DFKSNVSZDKWUND-LPHOPBHVSA-N 0 0 375.469 3.085 20 5 GGBDRN C[C@@H](NC(=O)NCCCCNC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000272699640 1434924046 /nfs/dbraw/zinc/92/40/46/1434924046.db2.gz FIIOANANPXPANY-CYBMUJFWSA-N 0 0 380.445 3.260 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CCOC)c1ccco1 ZINC000272724242 1434926091 /nfs/dbraw/zinc/92/60/91/1434926091.db2.gz UFRAWBVPUJRDFP-OAHLLOKOSA-N 0 0 394.449 3.434 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000272759989 1434928859 /nfs/dbraw/zinc/92/88/59/1434928859.db2.gz ACKNUNDBPBHLFA-AWEZNQCLSA-N 0 0 398.419 3.486 20 5 GGBDRN CC[C@@H](NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 ZINC000272765387 1434929292 /nfs/dbraw/zinc/92/92/92/1434929292.db2.gz BCTNXMUOARPWIL-CYBMUJFWSA-N 0 0 388.428 3.194 20 5 GGBDRN CC[C@H](NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 ZINC000272765389 1434929377 /nfs/dbraw/zinc/92/93/77/1434929377.db2.gz BCTNXMUOARPWIL-ZDUSSCGKSA-N 0 0 388.428 3.194 20 5 GGBDRN COc1ccc(NC(=O)CCCOc2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000272768848 1434929513 /nfs/dbraw/zinc/92/95/13/1434929513.db2.gz DWIYCTWIXAMLGG-UHFFFAOYSA-N 0 0 399.403 3.286 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCCCC(=O)OCc1ccccc1 ZINC000272783705 1434930748 /nfs/dbraw/zinc/93/07/48/1434930748.db2.gz OROMTAYDIBAIPR-UHFFFAOYSA-N 0 0 386.404 3.004 20 5 GGBDRN COc1ccc(NC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000272784395 1434930986 /nfs/dbraw/zinc/93/09/86/1434930986.db2.gz FMSXGGCBPVBBGM-UHFFFAOYSA-N 0 0 394.428 3.124 20 5 GGBDRN COc1ccc(NC(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)cc1[N+](=O)[O-] ZINC000272801247 1434932039 /nfs/dbraw/zinc/93/20/39/1434932039.db2.gz HTHKTEQHTHFKDU-INIZCTEOSA-N 0 0 393.440 3.185 20 5 GGBDRN COc1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000272825876 1434934028 /nfs/dbraw/zinc/93/40/28/1434934028.db2.gz LXJNYSLHVXPPMS-UHFFFAOYSA-N 0 0 379.413 3.189 20 5 GGBDRN COc1ccc(NC(=O)[C@H](c2ccccc2)N2CCCCC2=O)cc1[N+](=O)[O-] ZINC000272832855 1434934690 /nfs/dbraw/zinc/93/46/90/1434934690.db2.gz RKXMESOYAJIGHL-IBGZPJMESA-N 0 0 383.404 3.296 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272837866 1434935010 /nfs/dbraw/zinc/93/50/10/1434935010.db2.gz NXFVBDVYAXXWGW-KBPBESRZSA-N 0 0 392.456 3.152 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272837870 1434935135 /nfs/dbraw/zinc/93/51/35/1434935135.db2.gz NXFVBDVYAXXWGW-UONOGXRCSA-N 0 0 392.456 3.152 20 5 GGBDRN CC(C)NC(=O)c1ccc(NCc2ccc(N3CCOC3=O)cc2)c([N+](=O)[O-])c1 ZINC000272841675 1434935215 /nfs/dbraw/zinc/93/52/15/1434935215.db2.gz NANHMJDSQXLNFV-UHFFFAOYSA-N 0 0 398.419 3.302 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC(CCCO)CC1 ZINC000272845903 1434935631 /nfs/dbraw/zinc/93/56/31/1434935631.db2.gz PBJJWXXTEYDXTK-UHFFFAOYSA-N 0 0 378.472 3.166 20 5 GGBDRN COc1ccc(NC(=O)NCc2ccnc(N3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000272845297 1434935641 /nfs/dbraw/zinc/93/56/41/1434935641.db2.gz PFTJYGNRTJIEEO-UHFFFAOYSA-N 0 0 385.424 3.310 20 5 GGBDRN COc1ccc(NC(=O)N2CCO[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000272854635 1434936203 /nfs/dbraw/zinc/93/62/03/1434936203.db2.gz RAXRWUYBNJBBRT-KRWDZBQOSA-N 0 0 375.356 3.348 20 5 GGBDRN COc1ccc([C@@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000272855087 1434936285 /nfs/dbraw/zinc/93/62/85/1434936285.db2.gz SQOARNNOVPLAEB-CQSZACIVSA-N 0 0 386.330 3.483 20 5 GGBDRN O=C(NC1CC1)c1ccc(NCc2ccc(N3CCOC3=O)cc2)c([N+](=O)[O-])c1 ZINC000272856308 1434936483 /nfs/dbraw/zinc/93/64/83/1434936483.db2.gz PONFILCXYANICL-UHFFFAOYSA-N 0 0 396.403 3.056 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1csc([N+](=O)[O-])c1 ZINC000272858216 1434936631 /nfs/dbraw/zinc/93/66/31/1434936631.db2.gz WWVPVMBFXMQJDQ-OLZOCXBDSA-N 0 0 381.454 3.270 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N(C)[C@@H](C)c2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000272860534 1434936716 /nfs/dbraw/zinc/93/67/16/1434936716.db2.gz IYMCZXOCBSEYDB-AWEZNQCLSA-N 0 0 385.420 3.378 20 5 GGBDRN COc1ccc(NC(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000272862704 1434936901 /nfs/dbraw/zinc/93/69/01/1434936901.db2.gz SIKGAUMWSHMNKS-NSHDSACASA-N 0 0 384.392 3.371 20 5 GGBDRN COc1ccc(NC(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000272862697 1434936917 /nfs/dbraw/zinc/93/69/17/1434936917.db2.gz SIKGAUMWSHMNKS-LLVKDONJSA-N 0 0 384.392 3.371 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H](c2ccccc2)C(C)(C)C)cc1[N+](=O)[O-] ZINC000272865957 1434937336 /nfs/dbraw/zinc/93/73/36/1434937336.db2.gz JOXPQNIDOCLTIH-QGZVFWFLSA-N 0 0 385.420 3.446 20 5 GGBDRN COc1ccc(NC(=O)C(=O)NC[C@@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000272866059 1434937339 /nfs/dbraw/zinc/93/73/39/1434937339.db2.gz JQWRHVBHRIAMAX-MRXNPFEDSA-N 0 0 385.420 3.098 20 5 GGBDRN COc1ccc(NC(=O)N[C@H](c2nc(C3CC3)no2)C(C)C)cc1[N+](=O)[O-] ZINC000272869519 1434937463 /nfs/dbraw/zinc/93/74/63/1434937463.db2.gz UIMRNFXPTWBKPM-AWEZNQCLSA-N 0 0 375.385 3.383 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@H]2C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000272868378 1434937495 /nfs/dbraw/zinc/93/74/95/1434937495.db2.gz UATJTROOTYVGKE-ZFWWWQNUSA-N 0 0 375.381 3.316 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000272868377 1434937515 /nfs/dbraw/zinc/93/75/15/1434937515.db2.gz UATJTROOTYVGKE-UKRRQHHQSA-N 0 0 375.381 3.316 20 5 GGBDRN COc1ccc(NC(=O)N[C@@H](c2nc(C3CC3)no2)C(C)C)cc1[N+](=O)[O-] ZINC000272869523 1434937534 /nfs/dbraw/zinc/93/75/34/1434937534.db2.gz UIMRNFXPTWBKPM-CQSZACIVSA-N 0 0 375.385 3.383 20 5 GGBDRN Cc1nc(CN2CCN(c3cc(C)[nH+]c4ccc([N+](=O)[O-])cc43)CC2)oc1C ZINC000272870546 1434937601 /nfs/dbraw/zinc/93/76/01/1434937601.db2.gz SJVLGDMVBZEGBP-UHFFFAOYSA-N 0 0 381.436 3.378 20 5 GGBDRN COc1ccc(NC(=O)NCCCC(=O)N2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000272890200 1434939089 /nfs/dbraw/zinc/93/90/89/1434939089.db2.gz YNLAHBIRHFDNIN-UHFFFAOYSA-N 0 0 398.419 3.048 20 5 GGBDRN O=C(Nc1ccc(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1)C1CC1 ZINC000272903914 1434939993 /nfs/dbraw/zinc/93/99/93/1434939993.db2.gz KIQXAOTZZSCRHW-SFHVURJKSA-N 0 0 394.387 3.075 20 5 GGBDRN CC(C)(C(=O)NCc1ccc(N2CCOC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000272941083 1434942630 /nfs/dbraw/zinc/94/26/30/1434942630.db2.gz ISZCDFJTPKXNAW-UHFFFAOYSA-N 0 0 383.404 3.145 20 5 GGBDRN Cc1cc(C2CCN(CC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])CC2)n[nH]1 ZINC000272947974 1434943294 /nfs/dbraw/zinc/94/32/94/1434943294.db2.gz MBMPNHQQAQEHIJ-UHFFFAOYSA-N 0 0 377.832 3.098 20 5 GGBDRN COc1cccc2c1CCN(c1ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c1)C2 ZINC000272951780 1434943719 /nfs/dbraw/zinc/94/37/19/1434943719.db2.gz XUWDMWHKVMWRAO-UHFFFAOYSA-N 0 0 381.432 3.402 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000272951882 1434943732 /nfs/dbraw/zinc/94/37/32/1434943732.db2.gz QKSBBJQKULSKLE-DOTOQJQBSA-N 0 0 397.431 3.070 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000272951895 1434943772 /nfs/dbraw/zinc/94/37/72/1434943772.db2.gz QKSBBJQKULSKLE-WBVHZDCISA-N 0 0 397.431 3.070 20 5 GGBDRN CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000272975162 1434945547 /nfs/dbraw/zinc/94/55/47/1434945547.db2.gz SJBKGLWLLBUWQW-DGCLKSJQSA-N 0 0 399.900 3.104 20 5 GGBDRN COc1cc(CCNC(=O)C[C@@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000272983893 1434946876 /nfs/dbraw/zinc/94/68/76/1434946876.db2.gz RUUJCPHQILZTAG-PBHICJAKSA-N 0 0 394.468 3.112 20 5 GGBDRN Cc1ccc(C)n1C1CCN(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272998713 1434948551 /nfs/dbraw/zinc/94/85/51/1434948551.db2.gz GWNQGKSGQWAGHH-UHFFFAOYSA-N 0 0 391.493 3.124 20 5 GGBDRN Cc1nc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1[C@H](C)O ZINC000273026807 1434951970 /nfs/dbraw/zinc/95/19/70/1434951970.db2.gz SDECREZVZDRNOQ-JTQLQIEISA-N 0 0 383.326 3.300 20 5 GGBDRN O=C(c1cc2nsnc2c([N+](=O)[O-])c1)N1CC[C@@H](COc2ccccc2)C1 ZINC000273041207 1434953849 /nfs/dbraw/zinc/95/38/49/1434953849.db2.gz VILSRATVVGFIGP-GFCCVEGCSA-N 0 0 384.417 3.141 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](C2(C)OCCO2)C1 ZINC000273057405 1434955964 /nfs/dbraw/zinc/95/59/64/1434955964.db2.gz AOEUTGOAOMCJFB-KGLIPLIRSA-N 0 0 380.466 3.077 20 5 GGBDRN CC(C)N1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)sc2C1 ZINC000273079740 1434958358 /nfs/dbraw/zinc/95/83/58/1434958358.db2.gz XJBYHJVHZYWBDC-UHFFFAOYSA-N 0 0 389.481 3.136 20 5 GGBDRN Cc1nnc([C@@H]2CCCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C2)[nH]1 ZINC000273101688 1434961192 /nfs/dbraw/zinc/96/11/92/1434961192.db2.gz AQSXFFMZAGAMAN-LLVKDONJSA-N 0 0 395.872 3.173 20 5 GGBDRN O=C(c1cc(NC[C@H](O)CCc2ccccc2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000273141816 1434965872 /nfs/dbraw/zinc/96/58/72/1434965872.db2.gz KFRGZUQRXJXPDQ-GOSISDBHSA-N 0 0 383.448 3.236 20 5 GGBDRN CCOc1cccc(N2CCC(C(=O)N3CCC(C)CC3)CC2)c1[N+](=O)[O-] ZINC000273175603 1434968991 /nfs/dbraw/zinc/96/89/91/1434968991.db2.gz NEVBPCZQUUNNIW-UHFFFAOYSA-N 0 0 375.469 3.468 20 5 GGBDRN O=C1[C@@H](Nc2ccc([N+](=O)[O-])c3cnccc23)CCCN1Cc1ccccn1 ZINC000273186454 1434970380 /nfs/dbraw/zinc/97/03/80/1434970380.db2.gz QTBDQJIRHQBSON-SFHVURJKSA-N 0 0 377.404 3.141 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273218035 1434973180 /nfs/dbraw/zinc/97/31/80/1434973180.db2.gz BLSUFCNOMJMMBS-MJGOQNOKSA-N 0 0 387.411 3.496 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273265204 1434976533 /nfs/dbraw/zinc/97/65/33/1434976533.db2.gz AFXAHCALUARGTG-KXBFYZLASA-N 0 0 387.411 3.450 20 5 GGBDRN COc1ccccc1-c1noc([C@@H](C)NCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000273264322 1434976538 /nfs/dbraw/zinc/97/65/38/1434976538.db2.gz FGRDRUORQRLOCO-CYBMUJFWSA-N 0 0 384.392 3.383 20 5 GGBDRN O=C1[C@@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CCCN1Cc1ccccn1 ZINC000273267313 1434976732 /nfs/dbraw/zinc/97/67/32/1434976732.db2.gz ZVKCSIGMBBSSFC-AWEZNQCLSA-N 0 0 392.362 3.194 20 5 GGBDRN CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273268541 1434976959 /nfs/dbraw/zinc/97/69/59/1434976959.db2.gz HANDBIHLZMUCNF-PKOBYXMFSA-N 0 0 388.395 3.491 20 5 GGBDRN Cc1cc(-c2noc([C@H](C)NC[C@@H](O)c3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000273273733 1434977346 /nfs/dbraw/zinc/97/73/46/1434977346.db2.gz FDVXPJVOZYVCBG-YVEFUNNKSA-N 0 0 386.383 3.477 20 5 GGBDRN O=C(NCC1(O)CCOCC1)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273285094 1434978005 /nfs/dbraw/zinc/97/80/05/1434978005.db2.gz AFZKRIRMRBZWOS-UHFFFAOYSA-N 0 0 394.493 3.148 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000273304080 1434979419 /nfs/dbraw/zinc/97/94/19/1434979419.db2.gz CIJWTBRMXMDPTE-CJNGLKHVSA-N 0 0 377.347 3.105 20 5 GGBDRN CCc1ccc(-c2noc([C@H](C)NCc3ccc(C(N)=O)cc3[N+](=O)[O-])n2)cc1 ZINC000273331931 1434981538 /nfs/dbraw/zinc/98/15/38/1434981538.db2.gz SOSRRFVEGMYICW-LBPRGKRZSA-N 0 0 395.419 3.157 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000273350940 1434982630 /nfs/dbraw/zinc/98/26/30/1434982630.db2.gz CLTBYFVBBXCUFL-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN COCCOCCN(Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273352431 1434982633 /nfs/dbraw/zinc/98/26/33/1434982633.db2.gz CRFGTYTYOJOHGI-UHFFFAOYSA-N 0 0 391.399 3.431 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000273356535 1434982919 /nfs/dbraw/zinc/98/29/19/1434982919.db2.gz DMTHWCLJLPMTNU-QGZVFWFLSA-N 0 0 377.372 3.376 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 ZINC000273376977 1434984345 /nfs/dbraw/zinc/98/43/45/1434984345.db2.gz QPVPJEUQGQGZJU-HNNXBMFYSA-N 0 0 392.437 3.161 20 5 GGBDRN CCN(CC(F)F)C(=O)c1ccc(C(=O)N(CC)CC(F)F)c([N+](=O)[O-])c1 ZINC000273381354 1434985014 /nfs/dbraw/zinc/98/50/14/1434985014.db2.gz BFKQYKRPNXITJI-UHFFFAOYSA-N 0 0 393.337 3.049 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000273392536 1434985670 /nfs/dbraw/zinc/98/56/70/1434985670.db2.gz DUDWUWCJRJRQQI-CZUORRHYSA-N 0 0 398.387 3.072 20 5 GGBDRN CNC(=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273392042 1434985726 /nfs/dbraw/zinc/98/57/26/1434985726.db2.gz FHMWJIGDOAODIA-UHFFFAOYSA-N 0 0 379.482 3.133 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000273392539 1434985793 /nfs/dbraw/zinc/98/57/93/1434985793.db2.gz DUDWUWCJRJRQQI-XJKSGUPXSA-N 0 0 398.387 3.072 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000273397106 1434985997 /nfs/dbraw/zinc/98/59/97/1434985997.db2.gz FSIMERVKYMBNFH-AEFFLSMTSA-N 0 0 394.424 3.074 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273440234 1434988833 /nfs/dbraw/zinc/98/88/33/1434988833.db2.gz WCCNLKFHKWRJHO-HKUYNNGSSA-N 0 0 387.411 3.496 20 5 GGBDRN COc1ccccc1-c1noc([C@H](C)NCCOc2cccc([N+](=O)[O-])c2)n1 ZINC000273439599 1434988933 /nfs/dbraw/zinc/98/89/33/1434988933.db2.gz ZBOVQTUMMVRHGI-ZDUSSCGKSA-N 0 0 384.392 3.383 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273457146 1434989961 /nfs/dbraw/zinc/98/99/61/1434989961.db2.gz MDWJGHQVQFMLKI-UHFFFAOYSA-N 0 0 388.399 3.490 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000273461684 1434990146 /nfs/dbraw/zinc/99/01/46/1434990146.db2.gz NCVQKSLMTUBNHL-UHFFFAOYSA-N 0 0 393.806 3.132 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)Nc1ccc([N+](=O)[O-])cc1F)CC2 ZINC000273468234 1434990727 /nfs/dbraw/zinc/99/07/27/1434990727.db2.gz NYGWLTXEYNVTBJ-UHFFFAOYSA-N 0 0 375.356 3.341 20 5 GGBDRN CC(=O)N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC12CCCCC2 ZINC000273478493 1434991233 /nfs/dbraw/zinc/99/12/33/1434991233.db2.gz PYEVWINLFSRPQF-UHFFFAOYSA-N 0 0 378.404 3.133 20 5 GGBDRN O=C(NCc1ccnc(OC2CCOCC2)c1)Nc1ccc([N+](=O)[O-])cc1F ZINC000273492022 1434991983 /nfs/dbraw/zinc/99/19/83/1434991983.db2.gz SPCXTNMSUINOHV-UHFFFAOYSA-N 0 0 390.371 3.008 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCOC[C@H]1C[C@@H](O)c1cccs1 ZINC000273493480 1434992185 /nfs/dbraw/zinc/99/21/85/1434992185.db2.gz SYCMOUYAIWFUPS-IUODEOHRSA-N 0 0 395.412 3.152 20 5 GGBDRN O=C(CNc1ccccc1[C@@H](O)C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000273498727 1434992457 /nfs/dbraw/zinc/99/24/57/1434992457.db2.gz OXIUZDOHMZWDPH-QGZVFWFLSA-N 0 0 395.337 3.192 20 5 GGBDRN CN(Cc1ccccc1N1CCOCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273499411 1434992688 /nfs/dbraw/zinc/99/26/88/1434992688.db2.gz UVAMWOYJLJAXFZ-UHFFFAOYSA-N 0 0 388.399 3.234 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273499434 1434992740 /nfs/dbraw/zinc/99/27/40/1434992740.db2.gz UVSXVICDEOCFFK-LLVKDONJSA-N 0 0 382.392 3.112 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@]12CCCO2 ZINC000273513979 1434993977 /nfs/dbraw/zinc/99/39/77/1434993977.db2.gz CWYXHRSCGHTSHC-LZWOXQAQSA-N 0 0 388.342 3.070 20 5 GGBDRN CC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1nnc2n1CCCCC2 ZINC000273522601 1434994276 /nfs/dbraw/zinc/99/42/76/1434994276.db2.gz YYUQAZZFTFQMAV-CYBMUJFWSA-N 0 0 376.392 3.325 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCCCOCc1ccccc1 ZINC000273574133 1434997768 /nfs/dbraw/zinc/99/77/68/1434997768.db2.gz FPFRVCXQZIEBBU-UHFFFAOYSA-N 0 0 378.450 3.011 20 5 GGBDRN Cc1ccsc1C(=O)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000273602461 1434999311 /nfs/dbraw/zinc/99/93/11/1434999311.db2.gz ZDPPEQNEDVBPLW-UHFFFAOYSA-N 0 0 385.449 3.194 20 5 GGBDRN C[C@H]1C[C@H](CCNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCO1 ZINC000273605487 1434999516 /nfs/dbraw/zinc/99/95/16/1434999516.db2.gz SFNPOQQCOVNNLN-DLBZAZTESA-N 0 0 378.472 3.476 20 5 GGBDRN COc1cc(CN[C@@H](C)c2nnc(C)s2)c([N+](=O)[O-])cc1OCC(F)F ZINC000273615014 1434999798 /nfs/dbraw/zinc/99/97/98/1434999798.db2.gz PAHWDHXPHGGTLP-QMMMGPOBSA-N 0 0 388.396 3.258 20 5 GGBDRN COc1cc(CN[C@H](C)c2nnc(C)s2)c([N+](=O)[O-])cc1OCC(F)F ZINC000273615011 1434999928 /nfs/dbraw/zinc/99/99/28/1434999928.db2.gz PAHWDHXPHGGTLP-MRVPVSSYSA-N 0 0 388.396 3.258 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc(-c2ccc(C(=O)N3CCOCC3)cc2)no1 ZINC000273648323 1435002387 /nfs/dbraw/zinc/00/23/87/1435002387.db2.gz CGOZRNWCZFZZIJ-UHFFFAOYSA-N 0 0 394.387 3.093 20 5 GGBDRN CC(C)(C)OC(=O)NCCc1noc(CCCNc2ccc([N+](=O)[O-])cc2)n1 ZINC000273670736 1435003886 /nfs/dbraw/zinc/00/38/86/1435003886.db2.gz GZQJKPJJQCUZAO-UHFFFAOYSA-N 0 0 391.428 3.090 20 5 GGBDRN Cc1nnc([C@@H](C)NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)s1 ZINC000273680887 1435004685 /nfs/dbraw/zinc/00/46/85/1435004685.db2.gz MISZTZUCZDJECD-GFCCVEGCSA-N 0 0 389.481 3.482 20 5 GGBDRN COc1cc(OC)c(-c2noc(-c3n[nH]c(C(C)C)c3[N+](=O)[O-])n2)cc1OC ZINC000273704594 1435006591 /nfs/dbraw/zinc/00/65/91/1435006591.db2.gz KFLKAUWEKAKJNT-UHFFFAOYSA-N 0 0 389.368 3.184 20 5 GGBDRN O=c1nc(Cc2noc(-c3ccc([N+](=O)[O-])[nH]3)n2)[nH]c2scc(C3CC3)c21 ZINC000273706835 1435006831 /nfs/dbraw/zinc/00/68/31/1435006831.db2.gz HHGRAQWOVXIRKI-UHFFFAOYSA-N 0 0 384.377 3.151 20 5 GGBDRN Cc1nn(CCc2nc(-c3cccc(NC(=O)C(C)C)c3)no2)c(C)c1[N+](=O)[O-] ZINC000273733282 1435009216 /nfs/dbraw/zinc/00/92/16/1435009216.db2.gz MZYTZEMOURFSKV-UHFFFAOYSA-N 0 0 398.423 3.295 20 5 GGBDRN CCc1nc(Cc2noc(COc3ccc([N+](=O)[O-])c(OC)c3)n2)cs1 ZINC000273770111 1435012591 /nfs/dbraw/zinc/01/25/91/1435012591.db2.gz DXNHZCBZBVUINL-UHFFFAOYSA-N 0 0 376.394 3.175 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nc([C@@H]3CN(C4CC4)CCO3)no2)cc(C(F)(F)F)c1 ZINC000273778748 1435013538 /nfs/dbraw/zinc/01/35/38/1435013538.db2.gz FJYCHDSZYBFZAL-ZDUSSCGKSA-N 0 0 384.314 3.199 20 5 GGBDRN O=C(CC1CCCC1)Nc1ccc(-c2noc(Cn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000273781609 1435013718 /nfs/dbraw/zinc/01/37/18/1435013718.db2.gz GAMODAXLYCQRAU-UHFFFAOYSA-N 0 0 396.407 3.408 20 5 GGBDRN CCc1nc(Cc2noc([C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)n2)cs1 ZINC000273794877 1435015183 /nfs/dbraw/zinc/01/51/83/1435015183.db2.gz HMWMLALPYLNIMP-JTQLQIEISA-N 0 0 387.421 3.079 20 5 GGBDRN CCc1nc(Cc2noc([C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)n2)cs1 ZINC000273794880 1435015188 /nfs/dbraw/zinc/01/51/88/1435015188.db2.gz HMWMLALPYLNIMP-SNVBAGLBSA-N 0 0 387.421 3.079 20 5 GGBDRN O=C1CCCN1Cc1cccc(-c2noc(Cc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000273795989 1435015342 /nfs/dbraw/zinc/01/53/42/1435015342.db2.gz HEWKPAHVUUJDTG-UHFFFAOYSA-N 0 0 378.388 3.358 20 5 GGBDRN COc1ccc2nc(-c3noc(CCn4nc(C)c([N+](=O)[O-])c4C)n3)ccc2c1 ZINC000273796213 1435015379 /nfs/dbraw/zinc/01/53/79/1435015379.db2.gz VPSWDCFVZYIFMV-UHFFFAOYSA-N 0 0 394.391 3.258 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2nc(-c3ccc(N4CCCC4)cn3)no2)cc1F ZINC000273799350 1435015493 /nfs/dbraw/zinc/01/54/93/1435015493.db2.gz HLRNGNKTQPHCCL-UHFFFAOYSA-N 0 0 385.355 3.358 20 5 GGBDRN O=C1C[C@@H](c2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)CN1CC1CCC1 ZINC000273799878 1435015679 /nfs/dbraw/zinc/01/56/79/1435015679.db2.gz BOEHVACGHMBWRZ-CQSZACIVSA-N 0 0 397.435 3.335 20 5 GGBDRN CC(C)(C(=O)N1CCC[C@@H](C2(C)OCCO2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273806044 1435016229 /nfs/dbraw/zinc/01/62/29/1435016229.db2.gz CAADFXMZYINJRK-CYBMUJFWSA-N 0 0 380.416 3.013 20 5 GGBDRN CN1C(=O)COc2ccc(NC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)cc21 ZINC000273810539 1435016751 /nfs/dbraw/zinc/01/67/51/1435016751.db2.gz BIXDRGKLPUKLDQ-UHFFFAOYSA-N 0 0 387.367 3.005 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000273816341 1435017638 /nfs/dbraw/zinc/01/76/38/1435017638.db2.gz BXUIAECGMFAIBC-QGZVFWFLSA-N 0 0 397.431 3.087 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc([C@@H]2CN(C3CC3)CCO2)no1 ZINC000273825132 1435018600 /nfs/dbraw/zinc/01/86/00/1435018600.db2.gz JHUBMBGTISUFMJ-ABAIWWIYSA-N 0 0 376.438 3.367 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(-c2ccc(COCC(F)(F)F)cc2)no1 ZINC000273826473 1435018871 /nfs/dbraw/zinc/01/88/71/1435018871.db2.gz YKDFUGBNNJXUPX-UHFFFAOYSA-N 0 0 397.313 3.277 20 5 GGBDRN CC(C)(C(=O)N[C@H]1CCO[C@@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273835814 1435019711 /nfs/dbraw/zinc/01/97/11/1435019711.db2.gz FLUZKFFAPZPACE-SGTLLEGYSA-N 0 0 382.457 3.182 20 5 GGBDRN CC(C)(C(=O)NCc1cccc(C(=O)NC2CC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000273846650 1435020825 /nfs/dbraw/zinc/02/08/25/1435020825.db2.gz GYKJINGTDZYFMC-UHFFFAOYSA-N 0 0 399.422 3.220 20 5 GGBDRN CC(C)(C(=O)Nc1cc(C2CCOCC2)[nH]n1)c1ccc([N+](=O)[O-])cc1F ZINC000273847486 1435021077 /nfs/dbraw/zinc/02/10/77/1435021077.db2.gz KUKRKQMEIZKGQF-UHFFFAOYSA-N 0 0 376.388 3.267 20 5 GGBDRN CC[C@@H](C)Oc1cc(-c2noc(CCn3nc(C)c([N+](=O)[O-])c3C)n2)ccn1 ZINC000273847936 1435021099 /nfs/dbraw/zinc/02/10/99/1435021099.db2.gz FUOZRYOSBPHIAL-LLVKDONJSA-N 0 0 386.412 3.273 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(-c3nc(C[S@@](C)=O)no3)cc2[N+](=O)[O-])C1 ZINC000273855646 1435022025 /nfs/dbraw/zinc/02/20/25/1435022025.db2.gz IZWJPEWNHFUJNW-DYTRLKRPSA-N 0 0 378.454 3.006 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(COc3cccc([N+](=O)[O-])c3)n2)cs1 ZINC000273864861 1435023029 /nfs/dbraw/zinc/02/30/29/1435023029.db2.gz CJKFYEVNLGIGCL-SNVBAGLBSA-N 0 0 376.394 3.312 20 5 GGBDRN Cc1c(Cc2nc([C@@H]3CC(=O)N(c4ccccc4)C3)no2)cccc1[N+](=O)[O-] ZINC000273864908 1435023045 /nfs/dbraw/zinc/02/30/45/1435023045.db2.gz JQQUMPRLBRIUFU-OAHLLOKOSA-N 0 0 378.388 3.398 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000273868067 1435023630 /nfs/dbraw/zinc/02/36/30/1435023630.db2.gz NBDDNZGWWMMIGI-NSHDSACASA-N 0 0 377.401 3.218 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000273868065 1435023703 /nfs/dbraw/zinc/02/37/03/1435023703.db2.gz NBDDNZGWWMMIGI-LLVKDONJSA-N 0 0 377.401 3.218 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000273878247 1435024546 /nfs/dbraw/zinc/02/45/46/1435024546.db2.gz LICQGLQGUMNCTG-UHFFFAOYSA-N 0 0 387.411 3.078 20 5 GGBDRN COc1cc(-c2nc(CN(C)C(=O)OC(C)(C)C)no2)cc([N+](=O)[O-])c1OC ZINC000273880837 1435024752 /nfs/dbraw/zinc/02/47/52/1435024752.db2.gz OJIIPPWTFVIJJJ-UHFFFAOYSA-N 0 0 394.384 3.029 20 5 GGBDRN C[C@H]1Oc2ccc(NC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)cc2NC1=O ZINC000273881566 1435024838 /nfs/dbraw/zinc/02/48/38/1435024838.db2.gz LSTGOMYWBMSSHY-SNVBAGLBSA-N 0 0 387.367 3.370 20 5 GGBDRN CC(C)(C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1F ZINC000273884008 1435025037 /nfs/dbraw/zinc/02/50/37/1435025037.db2.gz TXSFRSNORDQQPH-CQSZACIVSA-N 0 0 399.422 3.213 20 5 GGBDRN CC1CCN(c2ccc(-c3nc(Cc4ccc([N+](=O)[O-])cn4)no3)cn2)CC1 ZINC000273894407 1435026090 /nfs/dbraw/zinc/02/60/90/1435026090.db2.gz JNAUOTCZRPVZFG-UHFFFAOYSA-N 0 0 380.408 3.262 20 5 GGBDRN COc1cc(-c2nc([C@@H]3CC(=O)N(Cc4ccccc4)C3)no2)ccc1[N+](=O)[O-] ZINC000273897181 1435026464 /nfs/dbraw/zinc/02/64/64/1435026464.db2.gz GPBCDOOGGVITAV-OAHLLOKOSA-N 0 0 394.387 3.170 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273897653 1435026565 /nfs/dbraw/zinc/02/65/65/1435026565.db2.gz NVEJQEZZFNFJAI-WANDFBQESA-N 0 0 384.473 3.208 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273897642 1435026671 /nfs/dbraw/zinc/02/66/71/1435026671.db2.gz NVEJQEZZFNFJAI-NVIBNEEGSA-N 0 0 384.473 3.208 20 5 GGBDRN Cc1nnc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)s1 ZINC000273904751 1435027249 /nfs/dbraw/zinc/02/72/49/1435027249.db2.gz HMMJVZUISHVCOF-NSHDSACASA-N 0 0 375.454 3.236 20 5 GGBDRN CCOc1ccccc1OCCCc1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000273907468 1435027557 /nfs/dbraw/zinc/02/75/57/1435027557.db2.gz KKFPOMZHFVVDSF-UHFFFAOYSA-N 0 0 384.392 3.374 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3nc([C@H]4CN(C5CC5)CCO4)no3)cs2)cc1 ZINC000273924736 1435029148 /nfs/dbraw/zinc/02/91/48/1435029148.db2.gz QVHHCGFBASVIBB-OAHLLOKOSA-N 0 0 399.432 3.304 20 5 GGBDRN O=C1[C@@H](Nc2ncc([N+](=O)[O-])cn2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000273931056 1435029655 /nfs/dbraw/zinc/02/96/55/1435029655.db2.gz KNHGWYMUNZTEGM-AWEZNQCLSA-N 0 0 395.341 3.007 20 5 GGBDRN CC(C)(C(=O)NCC[S@](=O)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000273930766 1435029689 /nfs/dbraw/zinc/02/96/89/1435029689.db2.gz RPHQWNWTMMZQAI-MHZLTWQESA-N 0 0 392.452 3.077 20 5 GGBDRN CN1CCc2ccc(NC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)cc2C1=O ZINC000273938518 1435030200 /nfs/dbraw/zinc/03/02/00/1435030200.db2.gz SLDLIWPZTJVWMH-UHFFFAOYSA-N 0 0 385.395 3.278 20 5 GGBDRN CC(C)(c1nc([C@@H]2CC(=O)N(CC3CCC3)C2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000273944848 1435030899 /nfs/dbraw/zinc/03/08/99/1435030899.db2.gz MSTLTTGTQCRMPU-CQSZACIVSA-N 0 0 384.436 3.420 20 5 GGBDRN CC(C)(c1nc([C@H]2CC(=O)N(CC3CCC3)C2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000273944844 1435030957 /nfs/dbraw/zinc/03/09/57/1435030957.db2.gz MSTLTTGTQCRMPU-AWEZNQCLSA-N 0 0 384.436 3.420 20 5 GGBDRN COc1cccc(OC)c1OCc1noc(CCc2cccc([N+](=O)[O-])c2)n1 ZINC000273948667 1435031341 /nfs/dbraw/zinc/03/13/41/1435031341.db2.gz MZDHIZGSVFJDLQ-UHFFFAOYSA-N 0 0 385.376 3.359 20 5 GGBDRN COc1ccc(-c2nc(-c3cccc(CN4CCCC4=O)c3)no2)cc1[N+](=O)[O-] ZINC000273948767 1435031362 /nfs/dbraw/zinc/03/13/62/1435031362.db2.gz STDVFNQWUPZXSR-UHFFFAOYSA-N 0 0 394.387 3.443 20 5 GGBDRN Cc1cc(-c2nc([C@@H]3CC(=O)N(Cc4ccccc4)C3)no2)cc([N+](=O)[O-])c1 ZINC000273967317 1435033073 /nfs/dbraw/zinc/03/30/73/1435033073.db2.gz LERJJZBBAYWSFJ-MRXNPFEDSA-N 0 0 378.388 3.469 20 5 GGBDRN CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1ccc(S(C)(=O)=O)cc1 ZINC000273973032 1435033527 /nfs/dbraw/zinc/03/35/27/1435033527.db2.gz XQXPGQARQSVYOV-UHFFFAOYSA-N 0 0 394.424 3.078 20 5 GGBDRN Cc1cc(Cc2noc(CN3c4ccccc4O[C@@H](C)C3=O)n2)ccc1[N+](=O)[O-] ZINC000273977303 1435033974 /nfs/dbraw/zinc/03/39/74/1435033974.db2.gz PEZFSQFRSICBLM-ZDUSSCGKSA-N 0 0 394.387 3.191 20 5 GGBDRN O=C1CCCN1Cc1ccc(-c2noc(COc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000273991543 1435035114 /nfs/dbraw/zinc/03/51/14/1435035114.db2.gz XFUCKVOSYNZKFG-UHFFFAOYSA-N 0 0 394.387 3.346 20 5 GGBDRN CCS[C@H](C)c1noc(-c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)n1 ZINC000274000504 1435035856 /nfs/dbraw/zinc/03/58/56/1435035856.db2.gz RCXYXVDGCKMCMN-LLVKDONJSA-N 0 0 387.421 3.313 20 5 GGBDRN COc1ccc(C[C@@H](C)c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1OC ZINC000274007677 1435036586 /nfs/dbraw/zinc/03/65/86/1435036586.db2.gz RUAIRKDFWXMBAT-GFCCVEGCSA-N 0 0 384.392 3.327 20 5 GGBDRN CC(C)(C)C(=O)NCc1ccc(-c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1 ZINC000274025817 1435038041 /nfs/dbraw/zinc/03/80/41/1435038041.db2.gz TVOALQOMACHRRW-UHFFFAOYSA-N 0 0 395.419 3.293 20 5 GGBDRN C[C@@H](OC[C@H]1CCCCO1)c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000274029096 1435038233 /nfs/dbraw/zinc/03/82/33/1435038233.db2.gz SSXDOWHQZFLYCU-ZIAGYGMSSA-N 0 0 376.413 3.279 20 5 GGBDRN CCOc1cccc(NCc2ccc(N3CCCS3(=O)=O)cc2)c1[N+](=O)[O-] ZINC000274028889 1435038295 /nfs/dbraw/zinc/03/82/95/1435038295.db2.gz GNVBRJLRKKFKLV-UHFFFAOYSA-N 0 0 391.449 3.146 20 5 GGBDRN O=C1C[C@@H](c2noc(C(F)(F)c3ccc([N+](=O)[O-])cc3)n2)CN1CC1CCC1 ZINC000274030438 1435038472 /nfs/dbraw/zinc/03/84/72/1435038472.db2.gz UBIPHJRNBKGABY-GFCCVEGCSA-N 0 0 392.362 3.234 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3cnc(OCC4CC4)c(Cl)c3)n2)nc1 ZINC000274030714 1435038500 /nfs/dbraw/zinc/03/85/00/1435038500.db2.gz UEPJQKCCFHJQLO-UHFFFAOYSA-N 0 0 387.783 3.468 20 5 GGBDRN Cc1nnc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)s1 ZINC000274056795 1435040120 /nfs/dbraw/zinc/04/01/20/1435040120.db2.gz UVFJSDULCISCSI-GFCCVEGCSA-N 0 0 389.481 3.482 20 5 GGBDRN O=C1C[C@H](c2noc(Cn3ccc4cc([N+](=O)[O-])ccc43)n2)CN1CC1CCC1 ZINC000274061587 1435040481 /nfs/dbraw/zinc/04/04/81/1435040481.db2.gz VWQDKXYIFXDIBJ-HNNXBMFYSA-N 0 0 395.419 3.097 20 5 GGBDRN Cc1cc(Cc2noc([C@@H]3CCCN(C(=O)N4CCCC4)C3)n2)ccc1[N+](=O)[O-] ZINC000274059292 1435040493 /nfs/dbraw/zinc/04/04/93/1435040493.db2.gz VUAMABOUUGJPAY-MRXNPFEDSA-N 0 0 399.451 3.272 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000274067219 1435040982 /nfs/dbraw/zinc/04/09/82/1435040982.db2.gz PVCFEOKFQGZCQD-UHFFFAOYSA-N 0 0 378.257 3.386 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1noc(CCc2nc(C3CCCC3)no2)n1 ZINC000274077220 1435041826 /nfs/dbraw/zinc/04/18/26/1435041826.db2.gz XHUCYTJLPFNPGG-UHFFFAOYSA-N 0 0 398.423 3.458 20 5 GGBDRN COc1ccc(C(=O)CCCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1 ZINC000274077167 1435041905 /nfs/dbraw/zinc/04/19/05/1435041905.db2.gz WXWJDGXMAWQZHX-UHFFFAOYSA-N 0 0 382.376 3.178 20 5 GGBDRN COCc1ncc(-c2noc(-c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)n2)c(N)n1 ZINC000274080177 1435041977 /nfs/dbraw/zinc/04/19/77/1435041977.db2.gz UZWZBJKWXBITHS-UHFFFAOYSA-N 0 0 384.396 3.128 20 5 GGBDRN O=C(NC1CC1)c1ccc(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)cc1 ZINC000274083190 1435042212 /nfs/dbraw/zinc/04/22/12/1435042212.db2.gz XTFNNJITXNGALC-UHFFFAOYSA-N 0 0 393.403 3.192 20 5 GGBDRN CCC(CC)N1C[C@@H](c2nc(CCNc3ccccc3[N+](=O)[O-])no2)CC1=O ZINC000274087672 1435042500 /nfs/dbraw/zinc/04/25/00/1435042500.db2.gz YEJMXPINJAPBCQ-ZDUSSCGKSA-N 0 0 387.440 3.137 20 5 GGBDRN Cc1ccccc1[C@H](Cc1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1)NC(N)=O ZINC000274087584 1435042515 /nfs/dbraw/zinc/04/25/15/1435042515.db2.gz XRNRVTUXSBVTBR-INIZCTEOSA-N 0 0 395.419 3.138 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc([C@@H]2CC(=O)N(Cc3ccccc3)C2)no1 ZINC000274093842 1435043038 /nfs/dbraw/zinc/04/30/38/1435043038.db2.gz UNZBAOUDGZBZHZ-OAHLLOKOSA-N 0 0 378.388 3.469 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@@H]1COC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000274110928 1435044622 /nfs/dbraw/zinc/04/46/22/1435044622.db2.gz QWRNUNHVIUHJAA-MSOLQXFVSA-N 0 0 386.452 3.083 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@H]1COC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000274110932 1435044650 /nfs/dbraw/zinc/04/46/50/1435044650.db2.gz QWRNUNHVIUHJAA-ROUUACIJSA-N 0 0 386.452 3.083 20 5 GGBDRN COCCOc1ccc(Cc2noc(CNc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000274120049 1435045163 /nfs/dbraw/zinc/04/51/63/1435045163.db2.gz WJFCZAMZJUSDPJ-UHFFFAOYSA-N 0 0 384.392 3.206 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@]2(CCN(C(=O)c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000274174588 1435048873 /nfs/dbraw/zinc/04/88/73/1435048873.db2.gz HKFGHXWAFVEUBJ-IBGZPJMESA-N 0 0 375.425 3.068 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 ZINC000274235216 1435053468 /nfs/dbraw/zinc/05/34/68/1435053468.db2.gz ZBRJIIKLJWTHQN-CZUORRHYSA-N 0 0 380.466 3.021 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H](C2CC2)C1 ZINC000274235210 1435053539 /nfs/dbraw/zinc/05/35/39/1435053539.db2.gz ZBRJIIKLJWTHQN-BBRMVZONSA-N 0 0 380.466 3.021 20 5 GGBDRN Cc1cc(=O)c(-c2nc([C@@H]3CCCS3)no2)nn1-c1ccccc1[N+](=O)[O-] ZINC000274241921 1435054131 /nfs/dbraw/zinc/05/41/31/1435054131.db2.gz WCGLADTTYHHBCL-AWEZNQCLSA-N 0 0 385.405 3.067 20 5 GGBDRN Cc1cc(=O)c(-c2nc([C@H]3CCCS3)no2)nn1-c1ccccc1[N+](=O)[O-] ZINC000274241925 1435054196 /nfs/dbraw/zinc/05/41/96/1435054196.db2.gz WCGLADTTYHHBCL-CQSZACIVSA-N 0 0 385.405 3.067 20 5 GGBDRN COc1ccc(OC)c([C@H](O)CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000274246907 1435054566 /nfs/dbraw/zinc/05/45/66/1435054566.db2.gz HIBPGHZIGJVTQD-QGZVFWFLSA-N 0 0 389.408 3.084 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc(N2CCOC2=O)cc1 ZINC000274268591 1435056525 /nfs/dbraw/zinc/05/65/25/1435056525.db2.gz MBOYAJXCQPUQKI-UHFFFAOYSA-N 0 0 384.392 3.490 20 5 GGBDRN O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000274270714 1435056540 /nfs/dbraw/zinc/05/65/40/1435056540.db2.gz ZVPJBNUAVFEDKY-YOEHRIQHSA-N 0 0 384.388 3.016 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000274270712 1435056576 /nfs/dbraw/zinc/05/65/76/1435056576.db2.gz ZVPJBNUAVFEDKY-WMLDXEAASA-N 0 0 384.388 3.016 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000274269451 1435056594 /nfs/dbraw/zinc/05/65/94/1435056594.db2.gz AATJPSDJBQBKFT-AWEZNQCLSA-N 0 0 388.493 3.234 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)CC1(C)C ZINC000274277695 1435057098 /nfs/dbraw/zinc/05/70/98/1435057098.db2.gz YDUOLHDTDTYKSX-GFCCVEGCSA-N 0 0 389.481 3.383 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)CC1(C)C ZINC000274277699 1435057168 /nfs/dbraw/zinc/05/71/68/1435057168.db2.gz YDUOLHDTDTYKSX-LBPRGKRZSA-N 0 0 389.481 3.383 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000274288359 1435058116 /nfs/dbraw/zinc/05/81/16/1435058116.db2.gz DNADTIRTGADFQG-LBPRGKRZSA-N 0 0 396.419 3.049 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1cccc(C(=O)NC2CC2)c1 ZINC000274315348 1435060906 /nfs/dbraw/zinc/06/09/06/1435060906.db2.gz XKKAOGXBVFAYMR-UHFFFAOYSA-N 0 0 382.420 3.426 20 5 GGBDRN CCCOc1cc(NC(=O)C2(C(=O)OC)CC2)c([N+](=O)[O-])cc1OCCC ZINC000274329713 1435062243 /nfs/dbraw/zinc/06/22/43/1435062243.db2.gz VYVKMENEWRZKCZ-UHFFFAOYSA-N 0 0 380.397 3.064 20 5 GGBDRN COc1cc2c(cc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)NC(=O)CC2 ZINC000274329514 1435062275 /nfs/dbraw/zinc/06/22/75/1435062275.db2.gz KXOBXYYOSAUKJU-LBPRGKRZSA-N 0 0 398.419 3.236 20 5 GGBDRN COc1cc(CN(C)Cc2nccn2CC(F)(F)F)c([N+](=O)[O-])cc1F ZINC000274332129 1435062468 /nfs/dbraw/zinc/06/24/68/1435062468.db2.gz RJYGJIPZDXJCAI-UHFFFAOYSA-N 0 0 376.310 3.133 20 5 GGBDRN O=C(Nc1ccc(Cc2nnc3n2CCCCC3)cc1)c1ccc([N+](=O)[O-])[nH]1 ZINC000274365374 1435065563 /nfs/dbraw/zinc/06/55/63/1435065563.db2.gz NJZVSVKOMXJTGB-UHFFFAOYSA-N 0 0 380.408 3.084 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000274370576 1435065962 /nfs/dbraw/zinc/06/59/62/1435065962.db2.gz OLBHCXUEKAKBCU-NSHDSACASA-N 0 0 379.417 3.101 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000274424251 1435070170 /nfs/dbraw/zinc/07/01/70/1435070170.db2.gz OUCOTPZHJNJZJK-GFCCVEGCSA-N 0 0 385.449 3.052 20 5 GGBDRN COc1ccc2c(c1)nc(CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O)n2C ZINC000274450211 1435071864 /nfs/dbraw/zinc/07/18/64/1435071864.db2.gz ILEFRIZFUOIWLQ-UHFFFAOYSA-N 0 0 397.391 3.059 20 5 GGBDRN COCCOCCOCCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000274508777 1435075597 /nfs/dbraw/zinc/07/55/97/1435075597.db2.gz GSGGJJUODNWFNB-UHFFFAOYSA-N 0 0 382.460 3.188 20 5 GGBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CCSC2(CCOCC2)C1 ZINC000274531048 1435077021 /nfs/dbraw/zinc/07/70/21/1435077021.db2.gz YTZWOVTYYBCQRW-UHFFFAOYSA-N 0 0 384.429 3.013 20 5 GGBDRN COc1cccc(N2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c1[N+](=O)[O-] ZINC000274574015 1435078796 /nfs/dbraw/zinc/07/87/96/1435078796.db2.gz FHGRRDQIMIVCCL-UHFFFAOYSA-N 0 0 399.403 3.187 20 5 GGBDRN Cc1ccc(NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c([N+](=O)[O-])c1 ZINC000274668255 1435084284 /nfs/dbraw/zinc/08/42/84/1435084284.db2.gz GTDKDMHHCMMWRY-UHFFFAOYSA-N 0 0 379.413 3.194 20 5 GGBDRN COc1ccc(C(=O)Nc2ncc(C3(O)CCCCC3)s2)cc1[N+](=O)[O-] ZINC000274706623 1435086602 /nfs/dbraw/zinc/08/66/02/1435086602.db2.gz RVHUMHBCSUCDLF-UHFFFAOYSA-N 0 0 377.422 3.464 20 5 GGBDRN COc1cc(NC(=O)COc2cc(C)c([N+](=O)[O-])cc2F)cc(OC)c1OC ZINC000274708518 1435086847 /nfs/dbraw/zinc/08/68/47/1435086847.db2.gz BPLOANCPDPJDMC-UHFFFAOYSA-N 0 0 394.355 3.086 20 5 GGBDRN CCOC(=O)c1cc(N2CCC(c3nnc4n3CCCC4)CC2)ccc1[N+](=O)[O-] ZINC000274737571 1435088504 /nfs/dbraw/zinc/08/85/04/1435088504.db2.gz MXKFPIVIURZXDB-UHFFFAOYSA-N 0 0 399.451 3.083 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC(c2nnc3n2CCCC3)CC1 ZINC000274761061 1435090448 /nfs/dbraw/zinc/09/04/48/1435090448.db2.gz OSXOOTXZGFWYBE-UHFFFAOYSA-N 0 0 397.479 3.468 20 5 GGBDRN CC(C)(C(=O)N1CCC(C(=O)C(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000274760767 1435090468 /nfs/dbraw/zinc/09/04/68/1435090468.db2.gz XJMPSTSANAVMFR-UHFFFAOYSA-N 0 0 390.333 3.382 20 5 GGBDRN Cc1cc(NC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000274771431 1435091097 /nfs/dbraw/zinc/09/10/97/1435091097.db2.gz CWEOWHYVWVSGQH-CYBMUJFWSA-N 0 0 378.429 3.282 20 5 GGBDRN Cc1c(NC(=O)N2CCC(c3nnc4n3CCCC4)CC2)cccc1[N+](=O)[O-] ZINC000274776918 1435091703 /nfs/dbraw/zinc/09/17/03/1435091703.db2.gz UJKNSPGFHJXPDR-UHFFFAOYSA-N 0 0 384.440 3.243 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC(c2nnc3n2CCCC3)CC1 ZINC000274794842 1435093220 /nfs/dbraw/zinc/09/32/20/1435093220.db2.gz ZRQPFNRIPVKEPS-UHFFFAOYSA-N 0 0 389.843 3.196 20 5 GGBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CCC(c2nnc3n2CCCC3)CC1 ZINC000274794623 1435093222 /nfs/dbraw/zinc/09/32/22/1435093222.db2.gz ZGFUZEPCZCDGBI-UHFFFAOYSA-N 0 0 378.436 3.455 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC(c2nnc3n2CCCC3)CC1 ZINC000274832145 1435096369 /nfs/dbraw/zinc/09/63/69/1435096369.db2.gz ZZADMBOMMTVHBW-UHFFFAOYSA-N 0 0 389.843 3.196 20 5 GGBDRN COc1cc(CNCc2nc3cccc(Cl)c3n2C)c([N+](=O)[O-])cc1OC ZINC000274853635 1435098120 /nfs/dbraw/zinc/09/81/20/1435098120.db2.gz YMSRGRYBZHHSQK-UHFFFAOYSA-N 0 0 390.827 3.442 20 5 GGBDRN Cn1ccnc1[C@H](NCc1ccc(C(C)(C)O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000274905128 1435102786 /nfs/dbraw/zinc/10/27/86/1435102786.db2.gz IDYCFNATQYXBBP-LJQANCHMSA-N 0 0 380.448 3.435 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])c1ccc(OC)c(F)c1 ZINC000274933223 1435104253 /nfs/dbraw/zinc/10/42/53/1435104253.db2.gz BYHBEQPEYJDNNN-KRWDZBQOSA-N 0 0 390.367 3.085 20 5 GGBDRN 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CCOc1cc(NC(=O)[C@@H](CC2CCC2)NC(C)=O)c([N+](=O)[O-])cc1OCC ZINC000278478932 1435393894 /nfs/dbraw/zinc/39/38/94/1435393894.db2.gz JRBWVCBNRQZCJT-OAHLLOKOSA-N 0 0 393.440 3.026 20 5 GGBDRN COC(=O)C[C@](C)(NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)c1ccncc1 ZINC000278498485 1435395345 /nfs/dbraw/zinc/39/53/45/1435395345.db2.gz CLNQUWWOQWHBPR-IBGZPJMESA-N 0 0 386.408 3.207 20 5 GGBDRN Cc1nc(C)n(C[C@H]2CCCN(c3cc(C(F)(F)F)ncc3[N+](=O)[O-])C2)n1 ZINC000278528001 1435397439 /nfs/dbraw/zinc/39/74/39/1435397439.db2.gz ZSUBTUDFNASJMK-LBPRGKRZSA-N 0 0 384.362 3.134 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@H]1CCO[C@H](C2CC2)C1 ZINC000278538543 1435398263 /nfs/dbraw/zinc/39/82/63/1435398263.db2.gz CHYIQVFWXLFGNW-ZFWWWQNUSA-N 0 0 387.358 3.370 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1OC(C)C ZINC000278539499 1435398337 /nfs/dbraw/zinc/39/83/37/1435398337.db2.gz RRBPGLJLFBJWJB-UHFFFAOYSA-N 0 0 392.433 3.346 20 5 GGBDRN CC(=O)N1CCC(CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC1 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ZINC000279164826 1435466552 /nfs/dbraw/zinc/46/65/52/1435466552.db2.gz CCWBLULKIYJQOA-INIZCTEOSA-N 0 0 375.400 3.044 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N[C@H](CCCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000279164827 1435466662 /nfs/dbraw/zinc/46/66/62/1435466662.db2.gz CCWBLULKIYJQOA-MRXNPFEDSA-N 0 0 375.400 3.044 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(C3CCC3)cc2)cc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000279172900 1435467282 /nfs/dbraw/zinc/46/72/82/1435467282.db2.gz HMKPFMZNYXWTAU-UHFFFAOYSA-N 0 0 389.433 3.070 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)CC1 ZINC000279176738 1435467896 /nfs/dbraw/zinc/46/78/96/1435467896.db2.gz HYSDDSQOPWMNRA-UHFFFAOYSA-N 0 0 387.396 3.048 20 5 GGBDRN CC1(C)C[C@H](Nc2cccc(C(=O)NCCC(N)=O)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279190322 1435469271 /nfs/dbraw/zinc/46/92/71/1435469271.db2.gz WIHPDGSSTVYEDL-SFHVURJKSA-N 0 0 396.447 3.035 20 5 GGBDRN COc1ccc(CCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cc1OC ZINC000279228388 1435473987 /nfs/dbraw/zinc/47/39/87/1435473987.db2.gz YGYMGRGSDUTBHB-UHFFFAOYSA-N 0 0 396.802 3.306 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279237414 1435475411 /nfs/dbraw/zinc/47/54/11/1435475411.db2.gz RCCCZLCGAJAYTF-SGTLLEGYSA-N 0 0 375.400 3.042 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000279237126 1435475451 /nfs/dbraw/zinc/47/54/51/1435475451.db2.gz PUQOBIQLOUNLTA-UHFFFAOYSA-N 0 0 386.383 3.241 20 5 GGBDRN Cc1cccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c1C(=O)N1CCCC1 ZINC000279259249 1435478596 /nfs/dbraw/zinc/47/85/96/1435478596.db2.gz SXZMVEZZGWFZLL-UHFFFAOYSA-N 0 0 386.383 3.113 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000279262285 1435478836 /nfs/dbraw/zinc/47/88/36/1435478836.db2.gz IFVFZVCJFBKUNJ-MRVPVSSYSA-N 0 0 383.273 3.019 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000279271078 1435479911 /nfs/dbraw/zinc/47/99/11/1435479911.db2.gz VJMHCPBRYYAVRA-UHFFFAOYSA-N 0 0 388.399 3.115 20 5 GGBDRN C[C@@H]1OCC[C@]12CN(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000279270962 1435479921 /nfs/dbraw/zinc/47/99/21/1435479921.db2.gz JLUFJOPQPMXHSW-GDLVEWKHSA-N 0 0 388.342 3.022 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@H]2CCCOC2)nn1C ZINC000279275012 1435480578 /nfs/dbraw/zinc/48/05/78/1435480578.db2.gz JTEIRBPNDOQDBR-STQMWFEESA-N 0 0 390.465 3.342 20 5 GGBDRN CC(C)(C)c1cnc(COC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)s1 ZINC000279291763 1435482469 /nfs/dbraw/zinc/48/24/69/1435482469.db2.gz MMYCXKPJLNILQQ-UHFFFAOYSA-N 0 0 398.462 3.109 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])o1 ZINC000279297676 1435483283 /nfs/dbraw/zinc/48/32/83/1435483283.db2.gz MZNBFKKRTPXFLI-OAHLLOKOSA-N 0 0 382.775 3.431 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1CC(=O)c1cccs1 ZINC000279307028 1435484396 /nfs/dbraw/zinc/48/43/96/1435484396.db2.gz AJMPRTSOIXXAEC-SNVBAGLBSA-N 0 0 377.397 3.255 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)sc1C ZINC000279309961 1435484910 /nfs/dbraw/zinc/48/49/10/1435484910.db2.gz AEWASJIYWUZKEX-CQSZACIVSA-N 0 0 389.433 3.053 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1 ZINC000279323530 1435486329 /nfs/dbraw/zinc/48/63/29/1435486329.db2.gz CBJFJTZJPWURQG-QZTJIDSGSA-N 0 0 389.383 3.251 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279322587 1435486472 /nfs/dbraw/zinc/48/64/72/1435486472.db2.gz NACAVEWSXLOUIF-SNVBAGLBSA-N 0 0 398.341 3.493 20 5 GGBDRN COC(=O)c1[nH]c(C)c(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1C ZINC000279342543 1435488630 /nfs/dbraw/zinc/48/86/30/1435488630.db2.gz SBSCKZYJMZNUOC-UHFFFAOYSA-N 0 0 399.325 3.275 20 5 GGBDRN C[C@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@@H](C2CC2)O1 ZINC000279347718 1435489353 /nfs/dbraw/zinc/48/93/53/1435489353.db2.gz HXFNWZFKDHHCNB-BTYIYWSLSA-N 0 0 376.456 3.181 20 5 GGBDRN C[C@H]1OCC[C@]12CN(C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)CCO2 ZINC000279354477 1435490113 /nfs/dbraw/zinc/49/01/13/1435490113.db2.gz GKGQDMZHHIKDJY-VFNWGFHPSA-N 0 0 398.415 3.407 20 5 GGBDRN C[C@@H]1OCC[C@]12CN(C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)CCO2 ZINC000279354468 1435490264 /nfs/dbraw/zinc/49/02/64/1435490264.db2.gz GKGQDMZHHIKDJY-BTYIYWSLSA-N 0 0 398.415 3.407 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@@H](OCc2ccncc2)C1 ZINC000279360165 1435490967 /nfs/dbraw/zinc/49/09/67/1435490967.db2.gz SRIRXEGQGFATNZ-CQSZACIVSA-N 0 0 393.802 3.143 20 5 GGBDRN C[C@@H]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000279360068 1435490972 /nfs/dbraw/zinc/49/09/72/1435490972.db2.gz SPPOLRTYYVVPCD-BDJLRTHQSA-N 0 0 380.807 3.236 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2C)sc1C ZINC000279361264 1435491128 /nfs/dbraw/zinc/49/11/28/1435491128.db2.gz DTDBOYYBMDZEIB-AWEZNQCLSA-N 0 0 389.433 3.432 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(OCCOC)c(F)c1 ZINC000279365190 1435491525 /nfs/dbraw/zinc/49/15/25/1435491525.db2.gz RKFJFRLEYFIYLK-UHFFFAOYSA-N 0 0 378.356 3.410 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279369031 1435492001 /nfs/dbraw/zinc/49/20/01/1435492001.db2.gz SLXCVNBBDDZHHD-ZDUSSCGKSA-N 0 0 384.314 3.451 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000279383794 1435493421 /nfs/dbraw/zinc/49/34/21/1435493421.db2.gz FSRDSNHDNIRKPV-UHFFFAOYSA-N 0 0 394.435 3.017 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000279385888 1435493776 /nfs/dbraw/zinc/49/37/76/1435493776.db2.gz QYGSGSZLKNEMIQ-ZDUSSCGKSA-N 0 0 385.424 3.049 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)nnn1CC1CCCC1 ZINC000279388148 1435493780 /nfs/dbraw/zinc/49/37/80/1435493780.db2.gz GXBWKUNKDQSHTP-UHFFFAOYSA-N 0 0 380.408 3.485 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000279391804 1435494307 /nfs/dbraw/zinc/49/43/07/1435494307.db2.gz IXJKFNCKLWVMLA-WBMJQRKESA-N 0 0 377.416 3.460 20 5 GGBDRN Cn1ncc2c1CCC[C@H]2NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279398896 1435495086 /nfs/dbraw/zinc/49/50/86/1435495086.db2.gz CSUPBKJVQAVILC-CQSZACIVSA-N 0 0 397.357 3.224 20 5 GGBDRN Cn1c2ccccc2nc1[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000279400231 1435495344 /nfs/dbraw/zinc/49/53/44/1435495344.db2.gz JOKDBHGNNIHGJZ-MRXNPFEDSA-N 0 0 383.383 3.180 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1cccc2c1OCCO2 ZINC000279403949 1435495557 /nfs/dbraw/zinc/49/55/57/1435495557.db2.gz JWPGWZHPJWDGFN-HNNXBMFYSA-N 0 0 387.367 3.065 20 5 GGBDRN C[C@H]1OCC[C@]12CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C[C@@H](C)O2 ZINC000279424497 1435497938 /nfs/dbraw/zinc/49/79/38/1435497938.db2.gz UAKVIQXPOWKJFJ-UVWXRNBGSA-N 0 0 388.342 3.022 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3C[C@H](O)C(C)(C)C3)cc2[N+](=O)[O-])n1 ZINC000279433139 1435498724 /nfs/dbraw/zinc/49/87/24/1435498724.db2.gz UNRUEZXMFGQILR-AWEZNQCLSA-N 0 0 393.490 3.354 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N2CCC[C@@H]2[C@H]2CCCCC2=O)cc1[N+](=O)[O-] ZINC000279446307 1435500322 /nfs/dbraw/zinc/50/03/22/1435500322.db2.gz NPHUCTGDQIYZOF-IUODEOHRSA-N 0 0 377.416 3.164 20 5 GGBDRN CCc1cc(N2C[C@@H](C)OC3(CCOCC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279448707 1435500667 /nfs/dbraw/zinc/50/06/67/1435500667.db2.gz LYTNKOHFRMWILL-OAHLLOKOSA-N 0 0 398.463 3.389 20 5 GGBDRN O=C(c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)N1CC(=O)N(CC2CC2)C1 ZINC000279460770 1435501898 /nfs/dbraw/zinc/50/18/98/1435501898.db2.gz MSLMSFPRKSQHPC-UHFFFAOYSA-N 0 0 397.381 3.024 20 5 GGBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCC(c2ncc3n2CCCC3)CC1 ZINC000279463803 1435502336 /nfs/dbraw/zinc/50/23/36/1435502336.db2.gz DKZLACGKEOYBEH-UHFFFAOYSA-N 0 0 390.390 3.426 20 5 GGBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)N1CC(=O)N(C2CC2)C1 ZINC000279507476 1435507309 /nfs/dbraw/zinc/50/73/09/1435507309.db2.gz JBULEJQIAKONRO-UHFFFAOYSA-N 0 0 382.376 3.183 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)CC1 ZINC000279512991 1435508111 /nfs/dbraw/zinc/50/81/11/1435508111.db2.gz OUZWHMMWZQUFSD-UHFFFAOYSA-N 0 0 387.396 3.048 20 5 GGBDRN Cc1nccn1CCCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279529724 1435510058 /nfs/dbraw/zinc/51/00/58/1435510058.db2.gz PCJZJWZKWIVLKP-UHFFFAOYSA-N 0 0 385.346 3.008 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279544523 1435511503 /nfs/dbraw/zinc/51/15/03/1435511503.db2.gz VXFMRKKFMRAKPS-ZUZCIYMTSA-N 0 0 381.429 3.103 20 5 GGBDRN Cc1ccnc(-c2n[nH]c([C@@H](C)NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000279544678 1435511845 /nfs/dbraw/zinc/51/18/45/1435511845.db2.gz QJPGLEUTBNYWKF-QWHCGFSZSA-N 0 0 395.423 3.205 20 5 GGBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000279617897 1435519715 /nfs/dbraw/zinc/51/97/15/1435519715.db2.gz CHBNIPCGBXVMDZ-ZDUSSCGKSA-N 0 0 385.424 3.064 20 5 GGBDRN Cc1cc(N2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279623121 1435520242 /nfs/dbraw/zinc/52/02/42/1435520242.db2.gz YQFFVQXUXLXWFU-AVYPCKFXSA-N 0 0 384.436 3.133 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)sc1C ZINC000279657975 1435524955 /nfs/dbraw/zinc/52/49/55/1435524955.db2.gz KIRJYCFQMSQWAC-AWEZNQCLSA-N 0 0 389.433 3.053 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279666820 1435526309 /nfs/dbraw/zinc/52/63/09/1435526309.db2.gz JEPSZUGGVCFZEB-CQSZACIVSA-N 0 0 382.779 3.154 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)sc1C ZINC000279675117 1435527732 /nfs/dbraw/zinc/52/77/32/1435527732.db2.gz MEUZIQASLYBUFM-AWEZNQCLSA-N 0 0 389.433 3.432 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(N2CCCC2=O)cc1 ZINC000279708584 1435533285 /nfs/dbraw/zinc/53/32/85/1435533285.db2.gz KQKIUZVSNLLOGY-UHFFFAOYSA-N 0 0 383.404 3.050 20 5 GGBDRN CC(C)(C)c1cnc(COC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)s1 ZINC000279720985 1435535093 /nfs/dbraw/zinc/53/50/93/1435535093.db2.gz ZRADENKWIWOPSJ-UHFFFAOYSA-N 0 0 398.462 3.109 20 5 GGBDRN Cc1c(NC(=O)NCCc2cccc([N+](=O)[O-])c2)cccc1NC(=O)N(C)C ZINC000279739291 1435536914 /nfs/dbraw/zinc/53/69/14/1435536914.db2.gz TTWKXJPHSZPIRO-UHFFFAOYSA-N 0 0 385.424 3.361 20 5 GGBDRN COc1cc(C(=O)N2CCC(O)(Cc3cccc(C)c3)CC2)ccc1[N+](=O)[O-] ZINC000279777297 1435541558 /nfs/dbraw/zinc/54/15/58/1435541558.db2.gz CBFQKZXCYOZQDQ-UHFFFAOYSA-N 0 0 384.432 3.122 20 5 GGBDRN Cc1cccc(CC2(O)CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)c1 ZINC000279797801 1435544407 /nfs/dbraw/zinc/54/44/07/1435544407.db2.gz NAGCXNZBAJMRHT-UHFFFAOYSA-N 0 0 398.459 3.339 20 5 GGBDRN Cc1c(C(=O)O[C@H]([C@@H]2CCCOC2)C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000279804043 1435545400 /nfs/dbraw/zinc/54/54/00/1435545400.db2.gz YHDDZHVJUTUTAD-NOZJJQNGSA-N 0 0 392.286 3.326 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@@H](C)c1ccc(-n2cncn2)cc1 ZINC000279827339 1435548002 /nfs/dbraw/zinc/54/80/02/1435548002.db2.gz YTOLXXMGXMOQSN-AWEZNQCLSA-N 0 0 395.419 3.407 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(-c2nnnn2C2CC2)c1 ZINC000279836018 1435548838 /nfs/dbraw/zinc/54/88/38/1435548838.db2.gz ZMNPGFGUOJZKKI-UHFFFAOYSA-N 0 0 394.391 3.234 20 5 GGBDRN CCc1cc2nncn2c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000279837913 1435549191 /nfs/dbraw/zinc/54/91/91/1435549191.db2.gz CRDQPZWVFKSECD-LLVKDONJSA-N 0 0 386.437 3.023 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@H]2CCCOC2)[nH]n1 ZINC000279839894 1435549525 /nfs/dbraw/zinc/54/95/25/1435549525.db2.gz FLPPDNNILXCCOT-NEPJUHHUSA-N 0 0 376.438 3.331 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000279846513 1435550891 /nfs/dbraw/zinc/55/08/91/1435550891.db2.gz DVHMAEPBHQFJHJ-LLVKDONJSA-N 0 0 393.831 3.197 20 5 GGBDRN CC(=O)N1CCC[C@@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000279852753 1435552015 /nfs/dbraw/zinc/55/20/15/1435552015.db2.gz UAIBXEGCNFESSF-HNNXBMFYSA-N 0 0 377.444 3.082 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000279878199 1435556940 /nfs/dbraw/zinc/55/69/40/1435556940.db2.gz CJQUXEISNVNLBN-UHFFFAOYSA-N 0 0 389.383 3.211 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)cc([N+](=O)[O-])c1C ZINC000279884163 1435557766 /nfs/dbraw/zinc/55/77/66/1435557766.db2.gz BMTQFZBWPVXQKF-UHFFFAOYSA-N 0 0 387.392 3.050 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc2c(cc1OC)CCC(=O)N2 ZINC000279904728 1435560617 /nfs/dbraw/zinc/56/06/17/1435560617.db2.gz DWWQVRYVAQWUKS-UHFFFAOYSA-N 0 0 385.376 3.139 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CCNC(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000279922400 1435563666 /nfs/dbraw/zinc/56/36/66/1435563666.db2.gz HKPXABZKDCYMEW-UHFFFAOYSA-N 0 0 393.415 3.421 20 5 GGBDRN C[C@]1(C(N)=O)CCN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000279930565 1435564991 /nfs/dbraw/zinc/56/49/91/1435564991.db2.gz FJNGIGOZTZAAGP-IBGZPJMESA-N 0 0 385.445 3.084 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000279937053 1435566067 /nfs/dbraw/zinc/56/60/67/1435566067.db2.gz GDBMXCNEKZBHTF-INIZCTEOSA-N 0 0 392.452 3.184 20 5 GGBDRN C[C@H](O)C[C@@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279951922 1435568388 /nfs/dbraw/zinc/56/83/88/1435568388.db2.gz XSPVQNHTZCSUMX-WFASDCNBSA-N 0 0 375.450 3.484 20 5 GGBDRN Cc1ccc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cc1N1C(=O)CNC1=O ZINC000279960215 1435569700 /nfs/dbraw/zinc/56/97/00/1435569700.db2.gz IOFANBHFANFBAQ-UHFFFAOYSA-N 0 0 396.403 3.137 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@](C)(OC)CC1 ZINC000279971586 1435570933 /nfs/dbraw/zinc/57/09/33/1435570933.db2.gz KKOFCSBPESAOCO-GOSISDBHSA-N 0 0 382.482 3.365 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@](C)(OC)CC1 ZINC000279971590 1435571118 /nfs/dbraw/zinc/57/11/18/1435571118.db2.gz KKOFCSBPESAOCO-SFHVURJKSA-N 0 0 382.482 3.365 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000279981339 1435572042 /nfs/dbraw/zinc/57/20/42/1435572042.db2.gz LKBLPFHGEVYZMD-CQSZACIVSA-N 0 0 399.451 3.455 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@](C)(C(N)=O)C2)cc1[N+](=O)[O-] ZINC000280006441 1435575434 /nfs/dbraw/zinc/57/54/34/1435575434.db2.gz KTGIGWXVMNUAMJ-GOSISDBHSA-N 0 0 379.482 3.071 20 5 GGBDRN Cc1nc(CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])ccc1[C@@H](C)O ZINC000280014295 1435576975 /nfs/dbraw/zinc/57/69/75/1435576975.db2.gz WLZBMFKAYGGBGE-SNVBAGLBSA-N 0 0 381.791 3.003 20 5 GGBDRN COCCOC1CCC(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000280034285 1435580320 /nfs/dbraw/zinc/58/03/20/1435580320.db2.gz VBKRJYDSEPDVDZ-UHFFFAOYSA-N 0 0 376.453 3.308 20 5 GGBDRN CC[C@@H](c1ccccc1)N1CC(=O)N(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1=O ZINC000280060398 1435584782 /nfs/dbraw/zinc/58/47/82/1435584782.db2.gz KHIVCTDGEHFOIJ-KRWDZBQOSA-N 0 0 393.403 3.387 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000280070690 1435586793 /nfs/dbraw/zinc/58/67/93/1435586793.db2.gz HRDSWAVDINTYRC-HNNXBMFYSA-N 0 0 399.451 3.419 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CCCc3n[nH]cc32)cc1[N+](=O)[O-])c1ccccn1 ZINC000280096911 1435591537 /nfs/dbraw/zinc/59/15/37/1435591537.db2.gz MFJYJFXTBOPBIZ-ZDUSSCGKSA-N 0 0 392.419 3.479 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1C(N)=O ZINC000280101857 1435592840 /nfs/dbraw/zinc/59/28/40/1435592840.db2.gz PKQGSHWFHQUXLL-UHFFFAOYSA-N 0 0 385.420 3.397 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000280140972 1435598887 /nfs/dbraw/zinc/59/88/87/1435598887.db2.gz MJAHKXJHRWXIGP-OAHLLOKOSA-N 0 0 399.451 3.419 20 5 GGBDRN Cc1nn(CCc2nc(-c3ccc(N4CCCC4)cc3)no2)c(C)c1[N+](=O)[O-] ZINC000280202803 1435608179 /nfs/dbraw/zinc/60/81/79/1435608179.db2.gz BLXFYXXELSVWFX-UHFFFAOYSA-N 0 0 382.424 3.301 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(CN2CCOCC2)ccc1C ZINC000280217051 1435610289 /nfs/dbraw/zinc/61/02/89/1435610289.db2.gz AKXDYJYLFZFFOA-UHFFFAOYSA-N 0 0 399.447 3.386 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1 ZINC000280268827 1435622042 /nfs/dbraw/zinc/62/20/42/1435622042.db2.gz MKXHIGMRSMJFDJ-DOMZBBRYSA-N 0 0 378.772 3.001 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC(C)=C(C)C1 ZINC000280279356 1435624665 /nfs/dbraw/zinc/62/46/65/1435624665.db2.gz SABPKDULCQBSAV-KRWDZBQOSA-N 0 0 391.493 3.015 20 5 GGBDRN Cc1c(NC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000280352664 1435642728 /nfs/dbraw/zinc/64/27/28/1435642728.db2.gz BDMMNSZDVDOIBI-HNNXBMFYSA-N 0 0 376.434 3.060 20 5 GGBDRN Cc1cccc(CC2(O)CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000280362217 1435644867 /nfs/dbraw/zinc/64/48/67/1435644867.db2.gz SCHMEOZPIFMJEL-UHFFFAOYSA-N 0 0 397.475 3.225 20 5 GGBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCCO2)N1CCC(OCc2ccccc2)CC1 ZINC000280372871 1435646646 /nfs/dbraw/zinc/64/66/46/1435646646.db2.gz CUOZKESCMANCSA-UHFFFAOYSA-N 0 0 398.415 3.187 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCC(C(=O)C(F)(F)F)CC1 ZINC000280382488 1435649321 /nfs/dbraw/zinc/64/93/21/1435649321.db2.gz FNMFKQVVLGBMLP-UHFFFAOYSA-N 0 0 396.724 3.300 20 5 GGBDRN Cc1c(N[C@H](C)CCc2ccccc2[N+](=O)[O-])cccc1N1C(=O)CNC1=O ZINC000280383623 1435649589 /nfs/dbraw/zinc/64/95/89/1435649589.db2.gz WGOZMUCRBJRXPR-CYBMUJFWSA-N 0 0 382.420 3.393 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1C(N)=O ZINC000280389030 1435651032 /nfs/dbraw/zinc/65/10/32/1435651032.db2.gz AGGVNKJEWZKLAZ-UHFFFAOYSA-N 0 0 386.408 3.145 20 5 GGBDRN CCC[C@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](O)c1ccccc1 ZINC000280428446 1435658902 /nfs/dbraw/zinc/65/89/02/1435658902.db2.gz PXARSQJZPIOCQC-QFBILLFUSA-N 0 0 397.435 3.173 20 5 GGBDRN C[C@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@]2(CCOC2)O1 ZINC000280430349 1435659747 /nfs/dbraw/zinc/65/97/47/1435659747.db2.gz ZZGKCVMYSHJKDY-UGSOOPFHSA-N 0 0 375.450 3.098 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000280493309 1435669162 /nfs/dbraw/zinc/66/91/62/1435669162.db2.gz IHRYVJPBLMIKPU-AWEZNQCLSA-N 0 0 398.419 3.120 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1C(N)=O ZINC000280507499 1435671150 /nfs/dbraw/zinc/67/11/50/1435671150.db2.gz MUPZZTXQMKWNJS-GFCCVEGCSA-N 0 0 386.408 3.364 20 5 GGBDRN CCn1cc(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c(C(F)(F)F)n1 ZINC000280517712 1435672378 /nfs/dbraw/zinc/67/23/78/1435672378.db2.gz AUFZSXMWTOTPIQ-UHFFFAOYSA-N 0 0 399.373 3.370 20 5 GGBDRN CC(=O)N1CCC[C@H](CNc2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000280524365 1435673316 /nfs/dbraw/zinc/67/33/16/1435673316.db2.gz QZYZGYVYSXDDBL-SNVBAGLBSA-N 0 0 390.318 3.192 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NCc1nnc(C2CC2)n1C1CC1 ZINC000280541039 1435676197 /nfs/dbraw/zinc/67/61/97/1435676197.db2.gz SNFFRRDBNAVLIL-UHFFFAOYSA-N 0 0 393.806 3.050 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)c1cc(OC)c(OC)c(OC)c1 ZINC000280559065 1435679884 /nfs/dbraw/zinc/67/98/84/1435679884.db2.gz UVIHZDFQZJYVOI-UHFFFAOYSA-N 0 0 390.392 3.296 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2c2ccc([N+](=O)[O-])c3nonc32)sc1C ZINC000280578082 1435682484 /nfs/dbraw/zinc/68/24/84/1435682484.db2.gz VZMGIDXWBXLQNV-LLVKDONJSA-N 0 0 389.393 3.024 20 5 GGBDRN CC[C@@H](C)c1nnc([C@@H](C)NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000280613025 1435689558 /nfs/dbraw/zinc/68/95/58/1435689558.db2.gz ZESFMTYXGWRTPR-RKDXNWHRSA-N 0 0 383.811 3.439 20 5 GGBDRN CC[C@@H](C)c1nnc([C@H](C)NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000280612994 1435689601 /nfs/dbraw/zinc/68/96/01/1435689601.db2.gz ZESFMTYXGWRTPR-BDAKNGLRSA-N 0 0 383.811 3.439 20 5 GGBDRN O=C(Nc1cccc(N2CCC2=O)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000280725754 1435709603 /nfs/dbraw/zinc/70/96/03/1435709603.db2.gz UVYCPNVPJWDJQK-UHFFFAOYSA-N 0 0 394.431 3.187 20 5 GGBDRN COc1cc(CNc2ccc(C(=O)N3CCCC3)cc2)c([N+](=O)[O-])cc1OC ZINC000280775150 1435718570 /nfs/dbraw/zinc/71/85/70/1435718570.db2.gz PCZMJSHMAXGOKJ-UHFFFAOYSA-N 0 0 385.420 3.460 20 5 GGBDRN CCOc1ccc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1OC ZINC000280779229 1435718772 /nfs/dbraw/zinc/71/87/72/1435718772.db2.gz ZTQLJTANQKBUHD-UHFFFAOYSA-N 0 0 388.376 3.416 20 5 GGBDRN C[C@H](CO)N(CC1CCC1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000280784883 1435720221 /nfs/dbraw/zinc/72/02/21/1435720221.db2.gz KIIDTQKIDDHNEI-GFCCVEGCSA-N 0 0 375.450 3.341 20 5 GGBDRN COc1ccc(CN[C@@H](c2ccc(C)cc2)[C@H](C)S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000280786819 1435720585 /nfs/dbraw/zinc/72/05/85/1435720585.db2.gz IXHGYDKEQADLJI-IFXJQAMLSA-N 0 0 392.477 3.176 20 5 GGBDRN Cc1cc(OCC(=O)Nc2cccc(C[S@@](C)=O)c2C)ccc1[N+](=O)[O-] ZINC000280852520 1435731112 /nfs/dbraw/zinc/73/11/12/1435731112.db2.gz CODDDAVRLDHAFH-AREMUKBSSA-N 0 0 376.434 3.108 20 5 GGBDRN CCCNC(=O)C1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC1 ZINC000280900938 1435738823 /nfs/dbraw/zinc/73/88/23/1435738823.db2.gz HMWSRIKJYZFCSJ-UHFFFAOYSA-N 0 0 396.447 3.035 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1 ZINC000280933971 1435744022 /nfs/dbraw/zinc/74/40/22/1435744022.db2.gz KSWKNIICCKMIJG-HNNXBMFYSA-N 0 0 399.447 3.258 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000280962727 1435748269 /nfs/dbraw/zinc/74/82/69/1435748269.db2.gz HDOATDFKFMZIIH-RNJTYBCJSA-N 0 0 391.468 3.075 20 5 GGBDRN Cc1c(CC(=O)NCc2ccncc2OCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000280998891 1435753782 /nfs/dbraw/zinc/75/37/82/1435753782.db2.gz AKUSXOGHEZIHNB-UHFFFAOYSA-N 0 0 383.326 3.098 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1ccncc1OCC(F)(F)F ZINC000281019898 1435757951 /nfs/dbraw/zinc/75/79/51/1435757951.db2.gz CIDUOYVZIFLJSN-UHFFFAOYSA-N 0 0 383.326 3.180 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](OCc2ccncc2)C1 ZINC000281024786 1435758558 /nfs/dbraw/zinc/75/85/58/1435758558.db2.gz OPZGWHSQHNKVKC-KDOFPFPSSA-N 0 0 395.419 3.392 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](OCc2ccncc2)C1 ZINC000281024780 1435758802 /nfs/dbraw/zinc/75/88/02/1435758802.db2.gz OPZGWHSQHNKVKC-KBXCAEBGSA-N 0 0 395.419 3.392 20 5 GGBDRN CN(C)C(=O)C1(CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CCCC1 ZINC000281037055 1435761011 /nfs/dbraw/zinc/76/10/11/1435761011.db2.gz VYINNPMTDVNCGA-UHFFFAOYSA-N 0 0 396.447 3.035 20 5 GGBDRN O=C(NC1CCC2(CC1)OCCO2)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000281050848 1435763648 /nfs/dbraw/zinc/76/36/48/1435763648.db2.gz XKPDTVARYMDVIX-UHFFFAOYSA-N 0 0 383.404 3.072 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCN(Cc2ccco2)CC1 ZINC000281057848 1435765680 /nfs/dbraw/zinc/76/56/80/1435765680.db2.gz SOQZSNDOCIWKKK-CQSZACIVSA-N 0 0 383.408 3.117 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])[C@@H](C)S(C)(=O)=O)cc1 ZINC000281089069 1435771862 /nfs/dbraw/zinc/77/18/62/1435771862.db2.gz CXBXUVQOTHDCSV-RDTXWAMCSA-N 0 0 390.461 3.116 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])[C@H](C)S(C)(=O)=O)cc1 ZINC000281089066 1435772307 /nfs/dbraw/zinc/77/23/07/1435772307.db2.gz CXBXUVQOTHDCSV-KSSFIOAISA-N 0 0 390.461 3.116 20 5 GGBDRN COC(=O)[C@@H](C)N(C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CCC1 ZINC000281097191 1435773279 /nfs/dbraw/zinc/77/32/79/1435773279.db2.gz FMRGTUAPDIOJPB-CYBMUJFWSA-N 0 0 383.404 3.213 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)c3ccc([N+](=O)[O-])nc3)cc2[N+](=O)[O-])CC1 ZINC000281097264 1435773621 /nfs/dbraw/zinc/77/36/21/1435773621.db2.gz FNRTWUPCGCHVJN-UHFFFAOYSA-N 0 0 399.407 3.411 20 5 GGBDRN Cc1cc(OCC(=O)O[C@H]([C@H]2CCCOC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000281101210 1435774477 /nfs/dbraw/zinc/77/44/77/1435774477.db2.gz MMBHZMGQTXSVOO-XHDPSFHLSA-N 0 0 377.315 3.183 20 5 GGBDRN Cc1cc(OCC(=O)O[C@@H]([C@@H]2CCCOC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000281101204 1435774519 /nfs/dbraw/zinc/77/45/19/1435774519.db2.gz MMBHZMGQTXSVOO-ABAIWWIYSA-N 0 0 377.315 3.183 20 5 GGBDRN 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Cc1ccc(NC(=O)CS[C@@H](C)C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc1 ZINC000281162887 1435787045 /nfs/dbraw/zinc/78/70/45/1435787045.db2.gz LZKQGSGHZQCSRW-ZDUSSCGKSA-N 0 0 388.449 3.021 20 5 GGBDRN COc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cc1[N+](=O)[O-] ZINC000281167518 1435788094 /nfs/dbraw/zinc/78/80/94/1435788094.db2.gz KXNNNLUKHJYVJJ-NOVWEMISSA-N 0 0 391.468 3.075 20 5 GGBDRN Cc1c(NC(=O)N(C)C)cccc1N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000281168570 1435788105 /nfs/dbraw/zinc/78/81/05/1435788105.db2.gz PQMGOEGBNGULHP-CYBMUJFWSA-N 0 0 385.424 3.436 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000281165761 1435788139 /nfs/dbraw/zinc/78/81/39/1435788139.db2.gz KWNRNGBZPXZOJA-FDPIWHGQSA-N 0 0 375.469 3.108 20 5 GGBDRN COCC[C@H](CO)NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000281171005 1435788571 /nfs/dbraw/zinc/78/85/71/1435788571.db2.gz BOVGITJAVZNXDU-CQSZACIVSA-N 0 0 394.811 3.168 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccc(OC)cc1OC ZINC000281176370 1435789947 /nfs/dbraw/zinc/78/99/47/1435789947.db2.gz LMBPZBKOJVYANF-UHFFFAOYSA-N 0 0 375.381 3.061 20 5 GGBDRN CN(C(=O)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1)c1ccccc1 ZINC000281200300 1435794802 /nfs/dbraw/zinc/79/48/02/1435794802.db2.gz STUHPLRJTBKPPL-ZDUSSCGKSA-N 0 0 387.823 3.373 20 5 GGBDRN Cc1cc(OCC(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000281205200 1435795362 /nfs/dbraw/zinc/79/53/62/1435795362.db2.gz SBSNPANEKNALQG-LPHOPBHVSA-N 0 0 388.395 3.458 20 5 GGBDRN Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000281214202 1435797424 /nfs/dbraw/zinc/79/74/24/1435797424.db2.gz CYEVESPGCDBZOI-LJQANCHMSA-N 0 0 397.431 3.002 20 5 GGBDRN CN(C(=O)[C@H]1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1)c1ccccc1 ZINC000281213274 1435797808 /nfs/dbraw/zinc/79/78/08/1435797808.db2.gz UKWWXOQWGWOFGG-ZDUSSCGKSA-N 0 0 387.823 3.373 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000281243391 1435800516 /nfs/dbraw/zinc/80/05/16/1435800516.db2.gz COLGECFOFZCJGC-IKTSWFPUSA-N 0 0 385.464 3.407 20 5 GGBDRN Cc1nn(CCC(=O)Oc2ccc3c(c2)C(=O)CC(C)(C)O3)c(C)c1[N+](=O)[O-] ZINC000281245702 1435800585 /nfs/dbraw/zinc/80/05/85/1435800585.db2.gz QIDHZDKATJRTMC-UHFFFAOYSA-N 0 0 387.392 3.148 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cc1[N+](=O)[O-] ZINC000281247369 1435800742 /nfs/dbraw/zinc/80/07/42/1435800742.db2.gz DJPSXUBNPFRCGY-NVJLRMAKSA-N 0 0 391.424 3.213 20 5 GGBDRN NC(=O)c1ccc(SCc2nc([C@H]3CCC(F)(F)C3)no2)c([N+](=O)[O-])c1 ZINC000281249514 1435800855 /nfs/dbraw/zinc/80/08/55/1435800855.db2.gz DOJDFAAFCNMSJQ-VIFPVBQESA-N 0 0 384.364 3.272 20 5 GGBDRN Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000281254372 1435800924 /nfs/dbraw/zinc/80/09/24/1435800924.db2.gz HCISEHPBDCWGQU-KRWDZBQOSA-N 0 0 384.392 3.157 20 5 GGBDRN 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1435802879 /nfs/dbraw/zinc/80/28/79/1435802879.db2.gz YMWGUPALOGVHRC-UHFFFAOYSA-N 0 0 397.391 3.034 20 5 GGBDRN COC[C@@H](C)Nc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000281328577 1435804056 /nfs/dbraw/zinc/80/40/56/1435804056.db2.gz JFXHHWFRWMCJGP-GFCCVEGCSA-N 0 0 377.372 3.198 20 5 GGBDRN Cn1ncc2c1C[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)CC2 ZINC000281333816 1435804289 /nfs/dbraw/zinc/80/42/89/1435804289.db2.gz VZKHZCLQVKGUBX-LBPRGKRZSA-N 0 0 396.369 3.024 20 5 GGBDRN CCNC(=O)Nc1cccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1C ZINC000281339877 1435804513 /nfs/dbraw/zinc/80/45/13/1435804513.db2.gz ZBWOBAZBYLIOQV-UHFFFAOYSA-N 0 0 386.408 3.371 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(O[C@H]2CCN(C)C2=O)cc1C ZINC000281351654 1435805065 /nfs/dbraw/zinc/80/50/65/1435805065.db2.gz MDAZYQFVTBPALV-SFHVURJKSA-N 0 0 383.404 3.073 20 5 GGBDRN Cc1nnc([C@H]2CCCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])C2)[nH]1 ZINC000281361153 1435805508 /nfs/dbraw/zinc/80/55/08/1435805508.db2.gz 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CCOc1ccc([N+](=O)[O-])cc1NC(=O)Cc1cc(OC)c(OC)c(OC)c1 ZINC000281446377 1435809265 /nfs/dbraw/zinc/80/92/65/1435809265.db2.gz RSLIFBWWQAFLOY-UHFFFAOYSA-N 0 0 390.392 3.201 20 5 GGBDRN CCn1c(SCC2(CC(=O)OC)CC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000281457307 1435809594 /nfs/dbraw/zinc/80/95/94/1435809594.db2.gz MHZSCVIHGZZZQM-UHFFFAOYSA-N 0 0 376.438 3.309 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc1[N+](=O)[O-] ZINC000281456861 1435809657 /nfs/dbraw/zinc/80/96/57/1435809657.db2.gz SKIBXKLGFZSCAI-IBGZPJMESA-N 0 0 397.431 3.327 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000281460594 1435809862 /nfs/dbraw/zinc/80/98/62/1435809862.db2.gz BYSDALNJXOZPSU-SFHVURJKSA-N 0 0 394.435 3.364 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)[C@@H](C)CC)C1 ZINC000281468117 1435810148 /nfs/dbraw/zinc/81/01/48/1435810148.db2.gz TYMYYFPXZBXKPW-KBPBESRZSA-N 0 0 377.441 3.217 20 5 GGBDRN CCOC(=O)[C@@]1(COC)CCCN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000281512466 1435811738 /nfs/dbraw/zinc/81/17/38/1435811738.db2.gz XKTLSCOOKNMKKC-IBGZPJMESA-N 0 0 393.440 3.035 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@H](OCc3ccncc3)C2)cc1Cl ZINC000281513172 1435811795 /nfs/dbraw/zinc/81/17/95/1435811795.db2.gz PTHZAKIPMHXZLP-ZDUSSCGKSA-N 0 0 391.811 3.225 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O ZINC000281519261 1435811977 /nfs/dbraw/zinc/81/19/77/1435811977.db2.gz XYUVLSZSDAANIA-GUDXXQAFSA-N 0 0 377.441 3.397 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O ZINC000281519269 1435812017 /nfs/dbraw/zinc/81/20/17/1435812017.db2.gz XYUVLSZSDAANIA-SDNTUTLCSA-N 0 0 377.441 3.397 20 5 GGBDRN COc1cc(C(=O)N(C)CCCOCc2ccccc2)cc([N+](=O)[O-])c1OC ZINC000281516285 1435812044 /nfs/dbraw/zinc/81/20/44/1435812044.db2.gz KZBADULJBMQAKE-UHFFFAOYSA-N 0 0 388.420 3.291 20 5 GGBDRN CC[C@H](C)c1nnc([C@@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[nH]1 ZINC000281542938 1435812935 /nfs/dbraw/zinc/81/29/35/1435812935.db2.gz KLUHTOIEQYBLPV-QWHCGFSZSA-N 0 0 375.429 3.181 20 5 GGBDRN CC[C@H](C)c1nnc([C@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[nH]1 ZINC000281542940 1435812953 /nfs/dbraw/zinc/81/29/53/1435812953.db2.gz KLUHTOIEQYBLPV-STQMWFEESA-N 0 0 375.429 3.181 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(CN2CCCC2=O)cc1 ZINC000281546617 1435813080 /nfs/dbraw/zinc/81/30/80/1435813080.db2.gz YSTIWZAQSYTESW-UHFFFAOYSA-N 0 0 383.404 3.368 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2nnc(CC(F)(F)F)s2)c1 ZINC000281552195 1435813263 /nfs/dbraw/zinc/81/32/63/1435813263.db2.gz KZVUUFKHVRPBOJ-UHFFFAOYSA-N 0 0 390.343 3.267 20 5 GGBDRN CNC(=O)[C@@]1(C)CCN(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000281568090 1435813931 /nfs/dbraw/zinc/81/39/31/1435813931.db2.gz YTGARMCPOCEZSC-FQEVSTJZSA-N 0 0 398.419 3.377 20 5 GGBDRN CCC(=O)c1ccc(Nc2cnn(Cc3nnc4n3CCCC4)c2)c([N+](=O)[O-])c1 ZINC000281584661 1435814624 /nfs/dbraw/zinc/81/46/24/1435814624.db2.gz WRZYTTSMYIWMHB-UHFFFAOYSA-N 0 0 395.423 3.104 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccn(CCc3ccncc3)n2)c1 ZINC000281656391 1435817170 /nfs/dbraw/zinc/81/71/70/1435817170.db2.gz SCJOTJQZEJEXLP-UHFFFAOYSA-N 0 0 395.419 3.145 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)c1 ZINC000281668363 1435817738 /nfs/dbraw/zinc/81/77/38/1435817738.db2.gz SZQXVHMSFDZNSI-FUHWJXTLSA-N 0 0 386.448 3.343 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccccc1)C1CC1 ZINC000281693485 1435818582 /nfs/dbraw/zinc/81/85/82/1435818582.db2.gz OPZIEWUHNLMNKX-UHFFFAOYSA-N 0 0 383.404 3.123 20 5 GGBDRN CCC(=O)c1ccc(N2CCC(CNC(=O)C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000281710374 1435819099 /nfs/dbraw/zinc/81/90/99/1435819099.db2.gz CJIWKXJYHWLHLQ-UHFFFAOYSA-N 0 0 387.358 3.082 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H]1CCc2ccccc21 ZINC000281718947 1435819442 /nfs/dbraw/zinc/81/94/42/1435819442.db2.gz RSSRRAZLAAGLEL-KRWDZBQOSA-N 0 0 383.404 3.078 20 5 GGBDRN Cc1cc(OCC(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000281735372 1435820017 /nfs/dbraw/zinc/82/00/17/1435820017.db2.gz RGLKJTDQQMANBI-ASHKIFAZSA-N 0 0 390.461 3.239 20 5 GGBDRN Cc1cc(OCC(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000281735378 1435820022 /nfs/dbraw/zinc/82/00/22/1435820022.db2.gz RGLKJTDQQMANBI-PGGUUEOZSA-N 0 0 390.461 3.239 20 5 GGBDRN CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(N3CCCO[C@H](CC)C3)n2)CCCO1 ZINC000281744459 1435820348 /nfs/dbraw/zinc/82/03/48/1435820348.db2.gz DQENVTWEPVUZCY-HZPDHXFCSA-N 0 0 378.473 3.000 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000281745994 1435820479 /nfs/dbraw/zinc/82/04/79/1435820479.db2.gz VJUXSKHORHTWON-LBPRGKRZSA-N 0 0 389.383 3.291 20 5 GGBDRN C[S@@](=O)C1(CNC(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000281751808 1435820631 /nfs/dbraw/zinc/82/06/31/1435820631.db2.gz JIYGVHMXYFBDBL-AREMUKBSSA-N 0 0 390.486 3.387 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000281751344 1435820673 /nfs/dbraw/zinc/82/06/73/1435820673.db2.gz SBFGUHBMQNQCTH-OAHLLOKOSA-N 0 0 378.454 3.036 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](C)C[C@H](O)c2cccs2)c1 ZINC000281764568 1435821151 /nfs/dbraw/zinc/82/11/51/1435821151.db2.gz ZGLDMEQRQMMHBB-HIFRSBDPSA-N 0 0 378.450 3.362 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000281763051 1435821157 /nfs/dbraw/zinc/82/11/57/1435821157.db2.gz SQPSIEUBWWHNPW-AWEZNQCLSA-N 0 0 398.872 3.381 20 5 GGBDRN Cc1cc(OCC(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000281789329 1435822005 /nfs/dbraw/zinc/82/20/05/1435822005.db2.gz USHBKSBXPBMWMB-AWEZNQCLSA-N 0 0 396.403 3.133 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NC2CCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000281813080 1435822887 /nfs/dbraw/zinc/82/28/87/1435822887.db2.gz INMCOXOCHXUFJY-ZDUSSCGKSA-N 0 0 389.481 3.389 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3ccncc3OCC(F)(F)F)cc2N1 ZINC000281820149 1435823195 /nfs/dbraw/zinc/82/31/95/1435823195.db2.gz JRNBVGFRSKPCSL-UHFFFAOYSA-N 0 0 396.325 3.428 20 5 GGBDRN Cc1cc(Cl)nc(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000281853228 1435824366 /nfs/dbraw/zinc/82/43/66/1435824366.db2.gz YPYRMBNDYFEFLM-UHFFFAOYSA-N 0 0 388.855 3.484 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CCCC12CCOCC2 ZINC000281855343 1435824387 /nfs/dbraw/zinc/82/43/87/1435824387.db2.gz JVOHRBKLQQVLCW-INIZCTEOSA-N 0 0 381.860 3.439 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000281889490 1435825618 /nfs/dbraw/zinc/82/56/18/1435825618.db2.gz STONCRKHVOHGIN-MRXNPFEDSA-N 0 0 376.388 3.083 20 5 GGBDRN Cc1cc(OCC(=O)N[C@H](C)c2cccc(N3CCOC3=O)c2)ccc1[N+](=O)[O-] ZINC000281924452 1435826994 /nfs/dbraw/zinc/82/69/94/1435826994.db2.gz HHWUIQLKMZXOSK-CQSZACIVSA-N 0 0 399.403 3.116 20 5 GGBDRN Cc1cc(OCC(=O)N[C@@H](C)c2cccc(N3CCOC3=O)c2)ccc1[N+](=O)[O-] ZINC000281924447 1435827056 /nfs/dbraw/zinc/82/70/56/1435827056.db2.gz HHWUIQLKMZXOSK-AWEZNQCLSA-N 0 0 399.403 3.116 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCCC12CCOCC2 ZINC000281947603 1435827974 /nfs/dbraw/zinc/82/79/74/1435827974.db2.gz ILGOPQXLBAQXEW-MRXNPFEDSA-N 0 0 382.844 3.483 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C[S@](C)=O)c1ccccc1 ZINC000281967782 1435828916 /nfs/dbraw/zinc/82/89/16/1435828916.db2.gz NRHPAIABYPCFMA-JWIGPWBQSA-N 0 0 391.449 3.235 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000281983187 1435829557 /nfs/dbraw/zinc/82/95/57/1435829557.db2.gz MRTOPQDUSVTJNT-OAHLLOKOSA-N 0 0 387.440 3.257 20 5 GGBDRN CN(C(=O)[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1)c1ccccc1 ZINC000281988257 1435829869 /nfs/dbraw/zinc/82/98/69/1435829869.db2.gz ZNHOKXITAPIHJK-CYBMUJFWSA-N 0 0 387.823 3.373 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)CC1 ZINC000281997035 1435830289 /nfs/dbraw/zinc/83/02/89/1435830289.db2.gz QCBVZQAIKPGXQB-UHFFFAOYSA-N 0 0 379.413 3.191 20 5 GGBDRN CO[C@H]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000281998449 1435830341 /nfs/dbraw/zinc/83/03/41/1435830341.db2.gz XRJOEBTZCTVYNO-RDJZCZTQSA-N 0 0 375.469 3.471 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)C1 ZINC000282087361 1435834096 /nfs/dbraw/zinc/83/40/96/1435834096.db2.gz YCWZFEOCIZYCJI-AWEZNQCLSA-N 0 0 392.456 3.154 20 5 GGBDRN Cc1c(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000282103316 1435834743 /nfs/dbraw/zinc/83/47/43/1435834743.db2.gz OEGTXHHCGMDEEY-QXHJTNOSSA-N 0 0 391.424 3.213 20 5 GGBDRN COC(=O)[C@]1(C)CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@H]1C ZINC000282106814 1435834888 /nfs/dbraw/zinc/83/48/88/1435834888.db2.gz HVZIJEGJDXXKGK-MCMMXHMISA-N 0 0 378.428 3.365 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCO[C@@]2(CCSC2)C1 ZINC000282107828 1435834921 /nfs/dbraw/zinc/83/49/21/1435834921.db2.gz ZSVCNTTWVYNJNZ-SJCJKPOMSA-N 0 0 381.454 3.170 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1csc([C@H](C)OC)n1 ZINC000282109376 1435834955 /nfs/dbraw/zinc/83/49/55/1435834955.db2.gz ZVGSIKYAVDEMTC-JTQLQIEISA-N 0 0 380.426 3.479 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCO[C@]2(CCSC2)C1 ZINC000282107837 1435834963 /nfs/dbraw/zinc/83/49/63/1435834963.db2.gz ZSVCNTTWVYNJNZ-YVEFUNNKSA-N 0 0 381.454 3.170 20 5 GGBDRN CC(C)(C)OC(=O)NCCCOC1CCN(c2cc(N)ccc2[N+](=O)[O-])CC1 ZINC000282143732 1435836269 /nfs/dbraw/zinc/83/62/69/1435836269.db2.gz DXBQLMCBHMJXPA-UHFFFAOYSA-N 0 0 394.472 3.077 20 5 GGBDRN COC(=O)[C@]1(C)CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@H]1C ZINC000282150255 1435836497 /nfs/dbraw/zinc/83/64/97/1435836497.db2.gz LRTCQKKGANARQM-MCMMXHMISA-N 0 0 378.428 3.365 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCC23CCOCC3)cc1SC ZINC000282173864 1435837233 /nfs/dbraw/zinc/83/72/33/1435837233.db2.gz YWCOMQRFWONCAQ-INIZCTEOSA-N 0 0 380.466 3.404 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)COc1ccc(N2CCCC2=O)cc1 ZINC000282242678 1435839752 /nfs/dbraw/zinc/83/97/52/1435839752.db2.gz IMBLBAILFOPOMY-UHFFFAOYSA-N 0 0 387.367 3.187 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000282275428 1435841209 /nfs/dbraw/zinc/84/12/09/1435841209.db2.gz YMUMJQPPXQSJJK-MQMHXKEQSA-N 0 0 389.358 3.182 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000282320477 1435842995 /nfs/dbraw/zinc/84/29/95/1435842995.db2.gz DZYKYJPNBCTESL-UHFFFAOYSA-N 0 0 395.868 3.017 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1OC(F)F ZINC000282359155 1435844359 /nfs/dbraw/zinc/84/43/59/1435844359.db2.gz DDLLQQGQLZPQPF-UHFFFAOYSA-N 0 0 379.363 3.309 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1 ZINC000282373759 1435844940 /nfs/dbraw/zinc/84/49/40/1435844940.db2.gz AEVCLSNQEXMUJQ-UHFFFAOYSA-N 0 0 394.391 3.234 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(CS(C)(=O)=O)c2C)c1 ZINC000282400002 1435845942 /nfs/dbraw/zinc/84/59/42/1435845942.db2.gz ACWYWOPVEFMWFX-UHFFFAOYSA-N 0 0 392.433 3.099 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282417317 1435846474 /nfs/dbraw/zinc/84/64/74/1435846474.db2.gz LMAWZXBDTHCYMO-CQSZACIVSA-N 0 0 384.436 3.498 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(N2CCCC2=O)cc1 ZINC000282437012 1435847188 /nfs/dbraw/zinc/84/71/88/1435847188.db2.gz MTZYCXOZQNXQBR-UHFFFAOYSA-N 0 0 396.447 3.106 20 5 GGBDRN Cc1cc(F)c(NC(=O)[C@H]2CCCCN2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000282448963 1435847534 /nfs/dbraw/zinc/84/75/34/1435847534.db2.gz NRINDBDEKJULKT-CQSZACIVSA-N 0 0 375.356 3.269 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C1CCN(C(=O)OCC(C)C)CC1 ZINC000282450122 1435847633 /nfs/dbraw/zinc/84/76/33/1435847633.db2.gz VMERYPGGRPBQMF-UHFFFAOYSA-N 0 0 381.404 3.485 20 5 GGBDRN C[C@H](C1CCCCC1)N(C)C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000282457713 1435847991 /nfs/dbraw/zinc/84/79/91/1435847991.db2.gz JLWPKGFAFCHKTH-GFCCVEGCSA-N 0 0 381.860 3.405 20 5 GGBDRN COc1ccc(NC(C)=O)cc1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282472143 1435848421 /nfs/dbraw/zinc/84/84/21/1435848421.db2.gz LHXCPWCCHQVMKD-UHFFFAOYSA-N 0 0 386.408 3.268 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)CCO1 ZINC000282477916 1435848731 /nfs/dbraw/zinc/84/87/31/1435848731.db2.gz LUXOJJBNNZAMHD-BBRMVZONSA-N 0 0 395.431 3.081 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000282483446 1435848755 /nfs/dbraw/zinc/84/87/55/1435848755.db2.gz MOKWYCJVCCFCKD-AWEZNQCLSA-N 0 0 399.407 3.031 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1CN1CCOCC1 ZINC000282498202 1435849327 /nfs/dbraw/zinc/84/93/27/1435849327.db2.gz OAGBIMPRMWWTCS-UHFFFAOYSA-N 0 0 398.463 3.133 20 5 GGBDRN Cc1ncc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C2CC2)n1 ZINC000282530685 1435850360 /nfs/dbraw/zinc/85/03/60/1435850360.db2.gz IJRWDPZUFPIXIA-UHFFFAOYSA-N 0 0 382.420 3.254 20 5 GGBDRN COc1cc(CC(=O)Nc2cc([N+](=O)[O-])c(C)cc2F)cc(OC)c1OC ZINC000282534646 1435850492 /nfs/dbraw/zinc/85/04/92/1435850492.db2.gz VRYUTIDYAXKRTQ-UHFFFAOYSA-N 0 0 378.356 3.249 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NCc1ccccc1OC(C)C ZINC000282578159 1435852345 /nfs/dbraw/zinc/85/23/45/1435852345.db2.gz SHVLPENNETURGD-UHFFFAOYSA-N 0 0 389.383 3.084 20 5 GGBDRN CC(C)NC(=O)Nc1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282576294 1435852350 /nfs/dbraw/zinc/85/23/50/1435852350.db2.gz VPNVJLLJACCOPE-UHFFFAOYSA-N 0 0 384.436 3.439 20 5 GGBDRN CSc1nc(C)c(CCC(=O)Nc2cc([N+](=O)[O-])c(C)cc2F)c(=O)[nH]1 ZINC000282580487 1435852404 /nfs/dbraw/zinc/85/24/04/1435852404.db2.gz ZOLBRCREQPIXJK-UHFFFAOYSA-N 0 0 380.401 3.140 20 5 GGBDRN CCS(=O)(=O)c1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282586842 1435852749 /nfs/dbraw/zinc/85/27/49/1435852749.db2.gz XQZCJDKCZIHPMU-UHFFFAOYSA-N 0 0 391.449 3.095 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 ZINC000282603257 1435853339 /nfs/dbraw/zinc/85/33/39/1435853339.db2.gz YFTVEFPZEJFBFA-OALUTQOASA-N 0 0 387.480 3.025 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1nnc(CC(F)(F)F)s1 ZINC000282608914 1435853511 /nfs/dbraw/zinc/85/35/11/1435853511.db2.gz HBCUBUSGNKZWSQ-UHFFFAOYSA-N 0 0 389.359 3.258 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000282609989 1435853550 /nfs/dbraw/zinc/85/35/50/1435853550.db2.gz IPOLZUANIKPPRU-HNNXBMFYSA-N 0 0 383.408 3.331 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])C(C)(C)C1 ZINC000282613602 1435853641 /nfs/dbraw/zinc/85/36/41/1435853641.db2.gz CFQQGXQWHRGAIZ-OAHLLOKOSA-N 0 0 395.431 3.499 20 5 GGBDRN COc1ccccc1[C@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C1 ZINC000282618788 1435853888 /nfs/dbraw/zinc/85/38/88/1435853888.db2.gz ZROHDMMTLZUGHR-HNNXBMFYSA-N 0 0 379.420 3.393 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000282619892 1435853930 /nfs/dbraw/zinc/85/39/30/1435853930.db2.gz 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ZINC000282782115 1435860145 /nfs/dbraw/zinc/86/01/45/1435860145.db2.gz LMVPBVFNROZITP-GOSISDBHSA-N 0 0 386.455 3.082 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3noc(C4CC4)n3)C2)c1 ZINC000282787714 1435860330 /nfs/dbraw/zinc/86/03/30/1435860330.db2.gz GREVZAJPNDOOGZ-CYBMUJFWSA-N 0 0 386.408 3.274 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3noc(C4CC4)n3)C2)c1 ZINC000282787716 1435860336 /nfs/dbraw/zinc/86/03/36/1435860336.db2.gz GREVZAJPNDOOGZ-ZDUSSCGKSA-N 0 0 386.408 3.274 20 5 GGBDRN COCc1cc(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)ccc1F ZINC000282791033 1435860427 /nfs/dbraw/zinc/86/04/27/1435860427.db2.gz PNOOISXGPANYAS-UHFFFAOYSA-N 0 0 375.400 3.264 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)CNC(=O)OC(C)(C)C)c1 ZINC000282801856 1435860910 /nfs/dbraw/zinc/86/09/10/1435860910.db2.gz IHFKGFPRHGLKQF-UHFFFAOYSA-N 0 0 381.429 3.027 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OC)c(OC)c2OC)c1 ZINC000282829366 1435862067 /nfs/dbraw/zinc/86/20/67/1435862067.db2.gz 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ZINC000282977581 1435868582 /nfs/dbraw/zinc/86/85/82/1435868582.db2.gz FJXGLVDUCPAWEX-UHFFFAOYSA-N 0 0 393.447 3.361 20 5 GGBDRN CCOCCCn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccccc1[N+](=O)[O-] ZINC000282999112 1435869681 /nfs/dbraw/zinc/86/96/81/1435869681.db2.gz LRNPLBXWSSIMMC-UHFFFAOYSA-N 0 0 384.440 3.244 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000283003687 1435869845 /nfs/dbraw/zinc/86/98/45/1435869845.db2.gz OEZQJEGKAVCSCZ-UHFFFAOYSA-N 0 0 396.856 3.480 20 5 GGBDRN Cc1cc(C)cc([C@H](O)CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000283017800 1435870612 /nfs/dbraw/zinc/87/06/12/1435870612.db2.gz LXZWUGFGJJWLAM-UXHICEINSA-N 0 0 380.448 3.358 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCC(=O)OC2CCCCC2)cc1SC ZINC000283037422 1435871507 /nfs/dbraw/zinc/87/15/07/1435871507.db2.gz AUJZUTFULSHYEV-UHFFFAOYSA-N 0 0 396.465 3.321 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C1(OCc2ccccc2)CCOCC1 ZINC000283041911 1435871761 /nfs/dbraw/zinc/87/17/61/1435871761.db2.gz 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ZINC000283248009 1435881154 /nfs/dbraw/zinc/88/11/54/1435881154.db2.gz DOITYKMJMIJPSA-XYJFISCASA-N 0 0 383.452 3.269 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1 ZINC000283283965 1435882794 /nfs/dbraw/zinc/88/27/94/1435882794.db2.gz UPAVWMZUUDRBDL-UHFFFAOYSA-N 0 0 385.420 3.391 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)c1 ZINC000283316990 1435884007 /nfs/dbraw/zinc/88/40/07/1435884007.db2.gz WVQOQDBISXYZKU-HNNXBMFYSA-N 0 0 398.419 3.030 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)c1 ZINC000283350707 1435885659 /nfs/dbraw/zinc/88/56/59/1435885659.db2.gz ZBBRFPTUEKAQML-QGZVFWFLSA-N 0 0 389.452 3.047 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2nc3ccccc3n2CC)c1 ZINC000283390330 1435887471 /nfs/dbraw/zinc/88/74/71/1435887471.db2.gz GMWBQTGRMUZKMY-UHFFFAOYSA-N 0 0 382.420 3.336 20 5 GGBDRN Cc1ccc([C@H](C)NCc2noc(CNC(=O)OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000283463620 1435891108 /nfs/dbraw/zinc/89/11/08/1435891108.db2.gz YYEDUMKXHATNGO-LBPRGKRZSA-N 0 0 391.428 3.162 20 5 GGBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000283521027 1435893719 /nfs/dbraw/zinc/89/37/19/1435893719.db2.gz KIXIINPUFZVHKR-HNNXBMFYSA-N 0 0 383.452 3.499 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCc2cc(F)ccc21 ZINC000283528724 1435894091 /nfs/dbraw/zinc/89/40/91/1435894091.db2.gz HMFRLQBXZWLPMP-UHFFFAOYSA-N 0 0 385.351 3.011 20 5 GGBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)Cc1ccc([S@](C)=O)cc1 ZINC000283546456 1435894783 /nfs/dbraw/zinc/89/47/83/1435894783.db2.gz STVLRTDZJSQAGU-NDEPHWFRSA-N 0 0 399.476 3.247 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(-c2cccn2C)n1C[C@@H]1CCCO1 ZINC000283546948 1435894829 /nfs/dbraw/zinc/89/48/29/1435894829.db2.gz SYOISBCAJOYSLZ-INIZCTEOSA-N 0 0 396.451 3.007 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3C[C@@H]4CCC[C@H]4C3)n2C[C@H]2CCOC2)c1 ZINC000283565380 1435895709 /nfs/dbraw/zinc/89/57/09/1435895709.db2.gz ZLAUTGYGEJFZGU-PVAVHDDUSA-N 0 0 383.452 3.126 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000283572749 1435896044 /nfs/dbraw/zinc/89/60/44/1435896044.db2.gz JUJXCFGLUSAPII-SJORKVTESA-N 0 0 391.431 3.130 20 5 GGBDRN COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000283588387 1435896792 /nfs/dbraw/zinc/89/67/92/1435896792.db2.gz LRAXRPXZCAZYEB-MJGOQNOKSA-N 0 0 384.432 3.417 20 5 GGBDRN CC(=O)c1cc(NCCCS(=O)(=O)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000283606391 1435897692 /nfs/dbraw/zinc/89/76/92/1435897692.db2.gz REUIYHGZRQQBTI-UHFFFAOYSA-N 0 0 376.434 3.214 20 5 GGBDRN Cc1cc2nc(C)c(CCC(=O)N(C)CCc3cccc([N+](=O)[O-])c3)c(C)n2n1 ZINC000283626271 1435898360 /nfs/dbraw/zinc/89/83/60/1435898360.db2.gz OQFCEIQTNYVPRD-UHFFFAOYSA-N 0 0 395.463 3.196 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CC[C@@H]1Cc2ccccc2NC1=O ZINC000283635841 1435898878 /nfs/dbraw/zinc/89/88/78/1435898878.db2.gz PHJPMOWALKGLKE-QGZVFWFLSA-N 0 0 381.432 3.187 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)c1 ZINC000283679579 1435902544 /nfs/dbraw/zinc/90/25/44/1435902544.db2.gz VYUAFUUZYNFTQL-INIZCTEOSA-N 0 0 383.404 3.143 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000283691887 1435904598 /nfs/dbraw/zinc/90/45/98/1435904598.db2.gz UNJRXTZSNWYYIA-KRWDZBQOSA-N 0 0 397.435 3.043 20 5 GGBDRN Cc1nn(C)c2nc(C3CC3)cc(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)c12 ZINC000283701582 1435907282 /nfs/dbraw/zinc/90/72/82/1435907282.db2.gz VSLFRCQVXPZBNM-UHFFFAOYSA-N 0 0 393.447 3.377 20 5 GGBDRN CC(C)COC(=O)N1CCC(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000283709577 1435908409 /nfs/dbraw/zinc/90/84/09/1435908409.db2.gz WPTVZGDNAUXUGA-UHFFFAOYSA-N 0 0 391.468 3.100 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(CNc3ccc(N)cc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000283764427 1435918997 /nfs/dbraw/zinc/91/89/97/1435918997.db2.gz NLYIDSRWFUSJBD-OKILXGFUSA-N 0 0 384.436 3.039 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(CNc3ccc(N)cc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000283763753 1435919070 /nfs/dbraw/zinc/91/90/70/1435919070.db2.gz NLYIDSRWFUSJBD-KBPBESRZSA-N 0 0 384.436 3.039 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000283810592 1435928716 /nfs/dbraw/zinc/92/87/16/1435928716.db2.gz XFOSAJJEXYJROH-SJORKVTESA-N 0 0 392.419 3.199 20 5 GGBDRN COc1ccc(C)cc1C[S@@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283821455 1435930763 /nfs/dbraw/zinc/93/07/63/1435930763.db2.gz PZFHOEXBLVGVNR-SANMLTNESA-N 0 0 376.434 3.189 20 5 GGBDRN Cc1cc(C)cc(CS(=O)(=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000283837839 1435933946 /nfs/dbraw/zinc/93/39/46/1435933946.db2.gz RNJSUWAXROPZIM-UHFFFAOYSA-N 0 0 376.434 3.155 20 5 GGBDRN O=C(CC[S@@](=O)Cc1ccn(C2CCCC2)n1)Nc1ccccc1[N+](=O)[O-] ZINC000283864220 1435939773 /nfs/dbraw/zinc/93/97/73/1435939773.db2.gz SQDKTPQCLZTRHY-HHHXNRCGSA-N 0 0 390.465 3.184 20 5 GGBDRN COc1cc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc(OC)c1OC ZINC000283875232 1435941412 /nfs/dbraw/zinc/94/14/12/1435941412.db2.gz ALDCRSDWKMPYJM-LLVKDONJSA-N 0 0 391.380 3.380 20 5 GGBDRN CCn1cnnc1[C@H]1CCCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2F)C1 ZINC000283896388 1435947498 /nfs/dbraw/zinc/94/74/98/1435947498.db2.gz JGAYZVHMWQZHGU-LBPRGKRZSA-N 0 0 376.392 3.065 20 5 GGBDRN O=c1ccn(Cc2nc(C3(c4ccccc4F)CCCC3)no2)cc1[N+](=O)[O-] ZINC000283946354 1435959273 /nfs/dbraw/zinc/95/92/73/1435959273.db2.gz NSOAWNKNKJRTPP-UHFFFAOYSA-N 0 0 384.367 3.187 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000283962763 1435962471 /nfs/dbraw/zinc/96/24/71/1435962471.db2.gz KZYMMUUBWOJUQJ-MEDUHNTESA-N 0 0 391.374 3.318 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)N[C@H](C)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000283962759 1435962841 /nfs/dbraw/zinc/96/28/41/1435962841.db2.gz KZYMMUUBWOJUQJ-BDJLRTHQSA-N 0 0 391.374 3.318 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2nc(Cc3cccnc3)no2)ccc1[N+](=O)[O-] ZINC000284000055 1435970962 /nfs/dbraw/zinc/97/09/62/1435970962.db2.gz QDLJIIAWGXIOQH-QGZVFWFLSA-N 0 0 393.403 3.249 20 5 GGBDRN Cc1nc(CN2CCN(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3F)CC2)cs1 ZINC000283995959 1435970987 /nfs/dbraw/zinc/97/09/87/1435970987.db2.gz NBJFUDXMZDVBKW-UHFFFAOYSA-N 0 0 393.444 3.157 20 5 GGBDRN CCCOc1cc(NC(=O)C2(OC)CCOCC2)c([N+](=O)[O-])cc1OCCC ZINC000284000662 1435971253 /nfs/dbraw/zinc/97/12/53/1435971253.db2.gz UPMQWECDCBTSOU-UHFFFAOYSA-N 0 0 396.440 3.307 20 5 GGBDRN Cc1cccc([C@@H](C)S(=O)(=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000284007276 1435972128 /nfs/dbraw/zinc/97/21/28/1435972128.db2.gz ZDZGOEVIDQYRCD-CQSZACIVSA-N 0 0 376.434 3.408 20 5 GGBDRN CCC(CC)n1ccc(C[S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000284016479 1435973598 /nfs/dbraw/zinc/97/35/98/1435973598.db2.gz ZPXFPNAHWWODDD-MHZLTWQESA-N 0 0 392.481 3.430 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284067728 1435984791 /nfs/dbraw/zinc/98/47/91/1435984791.db2.gz KMRKCVCFJVQQRD-RYZVSIALSA-N 0 0 377.422 3.433 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1F ZINC000284147415 1435998966 /nfs/dbraw/zinc/99/89/66/1435998966.db2.gz ZBBJZACVRUWAAM-UHFFFAOYSA-N 0 0 392.818 3.049 20 5 GGBDRN Cc1cc(F)c(NC(=O)N2CCc3c(nc(C(C)C)n3C)C2)cc1[N+](=O)[O-] ZINC000284152685 1436000125 /nfs/dbraw/zinc/00/01/25/1436000125.db2.gz VXWSJLYKHCDPMN-UHFFFAOYSA-N 0 0 375.404 3.489 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)c1nc(C2CCCCC2)no1 ZINC000284191249 1436002920 /nfs/dbraw/zinc/00/29/20/1436002920.db2.gz YYVPSABPPWKOFU-VIFPVBQESA-N 0 0 377.376 3.238 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[C@H](O)c2ccc(F)cc2)c1 ZINC000284225785 1436005348 /nfs/dbraw/zinc/00/53/48/1436005348.db2.gz BFSXIHFHYHVPSR-SGTLLEGYSA-N 0 0 376.384 3.375 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)c1 ZINC000284276123 1436009253 /nfs/dbraw/zinc/00/92/53/1436009253.db2.gz FDDWXOMUSRZHBJ-LJQANCHMSA-N 0 0 388.420 3.244 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)c2cccc(OC(C)C)c2)c1 ZINC000284276117 1436009353 /nfs/dbraw/zinc/00/93/53/1436009353.db2.gz FDDWXOMUSRZHBJ-IBGZPJMESA-N 0 0 388.420 3.244 20 5 GGBDRN O=C([C@H]1CCC(=O)c2ccccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000284285837 1436009994 /nfs/dbraw/zinc/00/99/94/1436009994.db2.gz KCKNCKXDYFQKAL-KRWDZBQOSA-N 0 0 379.416 3.004 20 5 GGBDRN COC1(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)CCOCC1 ZINC000284399160 1436018808 /nfs/dbraw/zinc/01/88/08/1436018808.db2.gz TXFNJJDHEYDCEE-UHFFFAOYSA-N 0 0 377.422 3.161 20 5 GGBDRN CCOCCOCc1cccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c1C ZINC000284448893 1436022402 /nfs/dbraw/zinc/02/24/02/1436022402.db2.gz QVVQGAPOLDKKGS-UHFFFAOYSA-N 0 0 391.399 3.430 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000284463232 1436023627 /nfs/dbraw/zinc/02/36/27/1436023627.db2.gz SAEHPXYBNIFBQG-CYBMUJFWSA-N 0 0 385.424 3.009 20 5 GGBDRN CCOc1cc(C(=O)N(C)C)ccc1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284517018 1436027679 /nfs/dbraw/zinc/02/76/79/1436027679.db2.gz UKFWLOOVOZRGCD-UHFFFAOYSA-N 0 0 388.380 3.216 20 5 GGBDRN CCS(=O)(=O)c1ccc([C@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000284717601 1436042813 /nfs/dbraw/zinc/04/28/13/1436042813.db2.gz JDNZVCPBQAOAIT-LBPRGKRZSA-N 0 0 389.433 3.380 20 5 GGBDRN CC[NH+](CC)CCC[C@@H](C)Nc1cc(-c2nn[n-]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000821188919 1443584386 /nfs/dbraw/zinc/58/43/86/1443584386.db2.gz GHLOYCGQDCKJGR-CYBMUJFWSA-N 0 0 398.471 3.246 20 5 GGBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824658246 1447064150 /nfs/dbraw/zinc/06/41/50/1447064150.db2.gz VFHYNVAXAWICHL-GOEBONIOSA-N 0 0 393.451 3.097 20 5 GGBDRN COc1ccc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1-c1nnn[n-]1 ZINC000826202718 1449797266 /nfs/dbraw/zinc/79/72/66/1449797266.db2.gz KGXVOLGYITXVML-UHFFFAOYSA-N 0 0 382.424 3.197 20 5 GGBDRN Cc1c(C[NH+]2CCC(Oc3ccc(-c4nnn[n-]4)cc3)CC2)cccc1[N+](=O)[O-] ZINC000737210254 1450357284 /nfs/dbraw/zinc/35/72/84/1450357284.db2.gz CJQINJKIFRFBFE-UHFFFAOYSA-N 0 0 394.435 3.127 20 5 GGBDRN O=C1Nc2ccccc2[C@@H]2CN(C(F)(F)c3ccc([N+](=O)[O-])c(Cl)n3)C[C@H]12 ZINC001164409598 718856146 /nfs/dbraw/zinc/85/61/46/718856146.db2.gz VXFVQJIPJHZTDS-QWRGUYRKSA-N 0 0 394.765 3.360 20 5 GGBDRN O=C1Nc2ccccc2[C@@H]2CN(C(F)(F)c3ccc([N+](=O)[O-])c(Cl)n3)C[C@@H]12 ZINC001164409600 718856257 /nfs/dbraw/zinc/85/62/57/718856257.db2.gz VXFVQJIPJHZTDS-WDEREUQCSA-N 0 0 394.765 3.360 20 5 GGBDRN O=C1Nc2ccccc2[C@H]2CN(C(F)(F)c3cc([N+](=O)[O-])cnc3Cl)C[C@@H]12 ZINC001164401842 718856507 /nfs/dbraw/zinc/85/65/07/718856507.db2.gz DCHTVVNULYCFBV-VXGBXAGGSA-N 0 0 394.765 3.360 20 5 GGBDRN CC(C)n1nc(CN(C)C)c2c1CN(c1ncc([N+](=O)[O-])cc1Cl)CC2 ZINC001164646861 719307303 /nfs/dbraw/zinc/30/73/03/719307303.db2.gz JDOOGPQIQZYBQC-UHFFFAOYSA-N 0 0 378.864 3.045 20 5 GGBDRN O=[N+]([O-])c1cnc(Cl)c(C(F)(F)N2CC[C@@H](O)[C@H]2Cc2ccccc2)c1 ZINC001164835629 720488262 /nfs/dbraw/zinc/48/82/62/720488262.db2.gz ZHZQWZZMHGBBNT-HUUCEWRRSA-N 0 0 383.782 3.370 20 5 GGBDRN CC[C@H]1N(C(F)(F)c2cc([N+](=O)[O-])cnc2Cl)CCC[C@]12CCC(=O)N2 ZINC001164843870 720750066 /nfs/dbraw/zinc/75/00/66/720750066.db2.gz MCVLQQWREKQQQL-DOMZBBRYSA-N 0 0 388.802 3.216 20 5 GGBDRN COC[C@]12CCCO[C@@H]1CCN(C(F)(F)c1ccc([N+](=O)[O-])c(Cl)n1)C2 ZINC001164852085 720825196 /nfs/dbraw/zinc/82/51/96/720825196.db2.gz YTJLLLMBQIWDCH-UKRRQHHQSA-N 0 0 391.802 3.210 20 5 GGBDRN COC[C@@]12CCCO[C@@H]1CCN(C(F)(F)c1ccc([N+](=O)[O-])c(Cl)n1)C2 ZINC001164852084 720825345 /nfs/dbraw/zinc/82/53/45/720825345.db2.gz YTJLLLMBQIWDCH-HIFRSBDPSA-N 0 0 391.802 3.210 20 5 GGBDRN COC[C@]12CCCO[C@@H]1CCN(C(F)(F)c1cc([N+](=O)[O-])cnc1Cl)C2 ZINC001164846088 720825898 /nfs/dbraw/zinc/82/58/98/720825898.db2.gz DDKDPZWPSCAOEH-UKRRQHHQSA-N 0 0 391.802 3.210 20 5 GGBDRN O=[N+]([O-])c1cccc2nc(N3C[C@H]4CN(Cc5nccs5)C[C@H]4C3)ccc21 ZINC001164783431 721407725 /nfs/dbraw/zinc/40/77/25/721407725.db2.gz IIFADLBMYCSMMF-OKILXGFUSA-N 0 0 381.461 3.168 20 5 GGBDRN O=[N+]([O-])c1cc2ccccc2nc1N1C[C@H]2CN(Cc3nccs3)C[C@@H]2C1 ZINC001164784235 721418647 /nfs/dbraw/zinc/41/86/47/721418647.db2.gz KWAWTTPXEOBFRD-HUUCEWRRSA-N 0 0 381.461 3.168 20 5 GGBDRN O=[N+]([O-])c1ccc2ccnc(N3C[C@H]4CN(Cc5nccs5)C[C@H]4C3)c2c1 ZINC001164781794 721422521 /nfs/dbraw/zinc/42/25/21/721422521.db2.gz FERHFFVLSXRVMK-GASCZTMLSA-N 0 0 381.461 3.168 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1N1CCc2c(CN(C)Cc3ccco3)cncc2C1 ZINC001164908267 721744432 /nfs/dbraw/zinc/74/44/32/721744432.db2.gz GHAWZSAMGRDWRW-UHFFFAOYSA-N 0 0 393.447 3.481 20 5 GGBDRN CN(Cc1ccco1)Cc1cncc2c1CCN(c1ncc(F)cc1[N+](=O)[O-])C2 ZINC001164910046 721749042 /nfs/dbraw/zinc/74/90/42/721749042.db2.gz ZLASXYNFRDBVCA-UHFFFAOYSA-N 0 0 397.410 3.312 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)N2CCc3ncnc(C4CC4)c3CC2)cnc1Cl ZINC001164914723 721803356 /nfs/dbraw/zinc/80/33/56/721803356.db2.gz FFOYYJNALPCYHR-UHFFFAOYSA-N 0 0 395.797 3.461 20 5 GGBDRN CCOC(=O)C1(F)CCN(C(F)(F)c2ccc([N+](=O)[O-])c(Cl)n2)CC1 ZINC001165017228 721834353 /nfs/dbraw/zinc/83/43/53/721834353.db2.gz ITKLZGDTJJVPGY-UHFFFAOYSA-N 0 0 381.738 3.060 20 5 GGBDRN Cc1cc(Cl)nc(N2CCN(CCOc3ccccc3)CC2)c1[N+](=O)[O-] ZINC001165044928 721954567 /nfs/dbraw/zinc/95/45/67/721954567.db2.gz RKBNKNZWNHTTBB-UHFFFAOYSA-N 0 0 376.844 3.153 20 5 GGBDRN O=[N+]([O-])c1c(Cl)cc(Cl)nc1N1CCN(CCOc2ccccc2)CC1 ZINC001165044697 721955762 /nfs/dbraw/zinc/95/57/62/721955762.db2.gz OTOCOKUEWIJIHP-UHFFFAOYSA-N 0 0 397.262 3.498 20 5 GGBDRN COC(=O)CCN(Cc1ccco1)C(F)(F)c1cnc(Cl)c([N+](=O)[O-])c1 ZINC001165050190 721982170 /nfs/dbraw/zinc/98/21/70/721982170.db2.gz QTFPQHOVILTQHD-UHFFFAOYSA-N 0 0 389.742 3.351 20 5 GGBDRN O=[N+]([O-])c1cnc(Cl)nc1N1CCC[C@]2(CCN2Cc2cccc(F)c2)C1 ZINC001164993684 722191794 /nfs/dbraw/zinc/19/17/94/722191794.db2.gz HOTHVHBRKDLNOC-SFHVURJKSA-N 0 0 391.834 3.422 20 5 GGBDRN C[C@H](Sc1ccccc1-c1nn[nH]n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000736193428 944758076 /nfs/dbraw/zinc/75/80/76/944758076.db2.gz QYPROAATOGXQJN-VIFPVBQESA-N 0 0 388.384 3.033 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1-c1nn[nH]n1 ZINC000823426225 946428688 /nfs/dbraw/zinc/42/86/88/946428688.db2.gz DPKNXONVCSZJPF-UHFFFAOYSA-N 0 0 393.281 3.151 20 5 GGBDRN CC(=CC(=O)Nc1sc(C)c(C)c1-c1nn[nH]n1)c1ccc([N+](=O)[O-])cc1 ZINC000823942367 946523493 /nfs/dbraw/zinc/52/34/93/946523493.db2.gz CKVREANCMDVFKV-CMDGGOBGSA-N 0 0 384.421 3.495 20 5 GGBDRN O=C(C[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1ccc(F)cc1 ZINC000826405006 948231749 /nfs/dbraw/zinc/23/17/49/948231749.db2.gz SFPZMWDRRHOYGG-CQSZACIVSA-N 0 0 396.382 3.156 20 5 GGBDRN O=C(CCCc1ccsc1)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000826406736 948237949 /nfs/dbraw/zinc/23/79/49/948237949.db2.gz KKRBTXUMJLYVEY-UHFFFAOYSA-N 0 0 392.828 3.451 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCO[C@@H](c3cccc(-c4nn[nH]n4)c3)C2)c(Cl)c1 ZINC000826498763 948413851 /nfs/dbraw/zinc/41/38/51/948413851.db2.gz ITOSKMIVHLUULC-MRXNPFEDSA-N 0 0 386.799 3.006 20 5 GGBDRN CC(C)(C)O[C@H]1C[C@@H](Nc2cc(F)c(-c3nn[nH]n3)cc2[N+](=O)[O-])C12CCC2 ZINC001573863366 950475557 /nfs/dbraw/zinc/47/55/57/950475557.db2.gz FJHAISKXIZTJKU-CABCVRRESA-N 0 0 390.419 3.452 20 5 GGBDRN C[C@H]1CCc2ccccc2N1CCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001576214806 950682144 /nfs/dbraw/zinc/68/21/44/950682144.db2.gz CFYTZYCQIHEMSR-ZDUSSCGKSA-N 0 0 379.424 3.028 20 5 GGBDRN C[C@@H](CNc1cc(F)c(-c2nn[nH]n2)cc1[N+](=O)[O-])Oc1ccc(Cl)cc1 ZINC001575121998 951999627 /nfs/dbraw/zinc/99/96/27/951999627.db2.gz ITQDMOPJIMMXPJ-VIFPVBQESA-N 0 0 392.778 3.447 20 5 GGBDRN C[C@H](Cc1ccc(-c2nn[nH]n2)cc1)C(=O)O[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001575189676 952457644 /nfs/dbraw/zinc/45/76/44/952457644.db2.gz PKPHTXJQXPRDDG-OLZOCXBDSA-N 0 0 381.392 3.258 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)Nc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC001575206009 952527184 /nfs/dbraw/zinc/52/71/84/952527184.db2.gz GCTRTZVXGOUXKY-SNVBAGLBSA-N 0 0 381.421 3.428 20 5 GGBDRN COc1ccc(C[NH2+][C@H]2C[C@H](C(=O)[O-])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000582677733 953725003 /nfs/dbraw/zinc/72/50/03/953725003.db2.gz VEPPLPIJZICVAL-WKILWMFISA-N 0 0 386.404 3.135 20 5 GGBDRN CN(c1ccccc1)c1ccc(C[NH2+]CC2(C(=O)[O-])CCOCC2)cc1[N+](=O)[O-] ZINC000592424877 953744647 /nfs/dbraw/zinc/74/46/47/953744647.db2.gz WJDXECXWVBIBTP-UHFFFAOYSA-N 0 0 399.447 3.334 20 5 GGBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](C(=O)[O-])C2)cc1OC ZINC000593742467 953754701 /nfs/dbraw/zinc/75/47/01/953754701.db2.gz MTRMNEAAJXVVEJ-UONOGXRCSA-N 0 0 380.441 3.325 20 5 GGBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](C(=O)[O-])C2)cc1OC ZINC000593742465 953755035 /nfs/dbraw/zinc/75/50/35/953755035.db2.gz MTRMNEAAJXVVEJ-KBPBESRZSA-N 0 0 380.441 3.325 20 5 GGBDRN COc1cc(C[N@@H+]2CCCC[C@H]2CC(=O)[O-])c([N+](=O)[O-])cc1OCC(F)F ZINC000593744299 953755663 /nfs/dbraw/zinc/75/56/63/953755663.db2.gz CMZJLSKJDUIHQG-LBPRGKRZSA-N 0 0 388.367 3.077 20 5 GGBDRN O=C([O-])CCC[NH+]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000262204380 961550106 /nfs/dbraw/zinc/55/01/06/961550106.db2.gz HTYNYRYJWWNCEY-UHFFFAOYSA-N 0 0 389.477 3.306 20 5 GGBDRN COc1cc(C[NH2+][C@H]2C[C@@H](C(=O)[O-])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC001574185618 962830170 /nfs/dbraw/zinc/83/01/70/962830170.db2.gz VVCLYBXBRJCIMJ-IYBDPMFKSA-N 0 0 386.404 3.135 20 5 GGBDRN CCOc1cc(N2CC[NH+](Cc3cccc(C(=O)[O-])c3)CC2)ccc1[N+](=O)[O-] ZINC000414641135 973945521 /nfs/dbraw/zinc/94/55/21/973945521.db2.gz SPHQYWPCTAQYOC-UHFFFAOYSA-N 0 0 385.420 3.014 20 5 GGBDRN Cc1cc(NCC2(O)CC[NH+](Cc3ccccc3)CC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000514792357 974292473 /nfs/dbraw/zinc/29/24/73/974292473.db2.gz LXWVBDNAIZDVCD-UHFFFAOYSA-N 0 0 399.447 3.040 20 5 GGBDRN Cc1cc(N2CC[NH+](CCc3cccs3)CC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000517032615 974314084 /nfs/dbraw/zinc/31/40/84/974314084.db2.gz CZSWMGPUKHCMHP-UHFFFAOYSA-N 0 0 375.450 3.028 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000518381466 974322187 /nfs/dbraw/zinc/32/21/87/974322187.db2.gz SDIHVQHOCZNCLI-DYVFJYSZSA-N 0 0 384.436 3.319 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)n1 ZINC000518306107 974322618 /nfs/dbraw/zinc/32/26/18/974322618.db2.gz MPIPWKLZOMRBFT-INIZCTEOSA-N 0 0 384.436 3.402 20 5 GGBDRN O=C([O-])c1cnc(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000563205020 974519673 /nfs/dbraw/zinc/51/96/73/974519673.db2.gz CYVIIPVIEPRXAK-LBPRGKRZSA-N 0 0 376.438 3.074 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)n1 ZINC000563538164 974535730 /nfs/dbraw/zinc/53/57/30/974535730.db2.gz RVWMCGSYTVGMAD-OAHLLOKOSA-N 0 0 390.484 3.477 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N(C)CCC2CCN(c3cc[nH+]cc3)CC2)n1 ZINC000565034028 974563808 /nfs/dbraw/zinc/56/38/08/974563808.db2.gz DOKABQLWDJTNPM-UHFFFAOYSA-N 0 0 399.451 3.134 20 5 GGBDRN Cc1cc(NCc2cccc(CN3CCO[C@H](C)C3)c2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000565038731 974564746 /nfs/dbraw/zinc/56/47/46/974564746.db2.gz VVADOUGYAQUOTI-OAHLLOKOSA-N 0 0 399.447 3.434 20 5 GGBDRN Cc1cc(NCc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000566291896 974603384 /nfs/dbraw/zinc/60/33/84/974603384.db2.gz NORLNRIDABJQJL-SFHVURJKSA-N 0 0 399.447 3.170 20 5 GGBDRN CC[NH+](CC)CCN(Cc1ccccc1)c1nc(C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000566295548 974604162 /nfs/dbraw/zinc/60/41/62/974604162.db2.gz PTYHKNBBAZMKFV-UHFFFAOYSA-N 0 0 386.452 3.345 20 5 GGBDRN O=C([O-])CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(F)c(F)c1 ZINC000566362059 974610710 /nfs/dbraw/zinc/61/07/10/974610710.db2.gz NHZXUNDEMXYOKL-UHFFFAOYSA-N 0 0 380.347 3.229 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(N2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000567275538 974630546 /nfs/dbraw/zinc/63/05/46/974630546.db2.gz POTNXDJXPWEGMO-OAQYLSRUSA-N 0 0 381.432 3.395 20 5 GGBDRN Cc1cc(N2C[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000569977544 974702900 /nfs/dbraw/zinc/70/29/00/974702900.db2.gz OZYBWCKBLLAQBI-CALCHBBNSA-N 0 0 381.432 3.170 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)n1 ZINC000572042719 974740920 /nfs/dbraw/zinc/74/09/20/974740920.db2.gz AHGWZMGFQGLHQE-GFCCVEGCSA-N 0 0 376.438 3.074 20 5 GGBDRN C[C@H](C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1)C(=O)[O-] ZINC000572532965 974749839 /nfs/dbraw/zinc/74/98/39/974749839.db2.gz LOMRVICZDCPCEU-CQSZACIVSA-N 0 0 396.403 3.368 20 5 GGBDRN O=C([O-])Cc1ccc(NCc2ccc(OCC[NH+]3CCCC3)cc2)c([N+](=O)[O-])c1 ZINC000573252955 974762806 /nfs/dbraw/zinc/76/28/06/974762806.db2.gz OYIWDAUFULSTFW-UHFFFAOYSA-N 0 0 399.447 3.309 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)n1 ZINC000575127850 974795500 /nfs/dbraw/zinc/79/55/00/974795500.db2.gz SGBLTVDJSDNACB-OAHLLOKOSA-N 0 0 398.463 3.405 20 5 GGBDRN CC(C)C1CCC([NH+]2CCN(c3nccc(C(=O)[O-])c3[N+](=O)[O-])CC2)CC1 ZINC000577734089 974841540 /nfs/dbraw/zinc/84/15/40/974841540.db2.gz QXZQTNZFWLMJHE-UHFFFAOYSA-N 0 0 376.457 3.025 20 5 GGBDRN COc1cc(C[N@H+]([C@@H](C)C(=O)[O-])C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000578339738 974852742 /nfs/dbraw/zinc/85/27/42/974852742.db2.gz ONXPPSJCTKPWDR-JTQLQIEISA-N 0 0 388.367 3.075 20 5 GGBDRN C[C@H](CNc1ccc(CC(=O)[O-])cc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000582005815 974919279 /nfs/dbraw/zinc/91/92/79/974919279.db2.gz MODTYTVCKLVFGF-GFCCVEGCSA-N 0 0 375.450 3.142 20 5 GGBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCC(C(=O)[O-])CC2)cc1OC ZINC000593733265 974983814 /nfs/dbraw/zinc/98/38/14/974983814.db2.gz KMUTZDYGRRFDEU-CYBMUJFWSA-N 0 0 380.441 3.325 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c1 ZINC000593741919 974986806 /nfs/dbraw/zinc/98/68/06/974986806.db2.gz SUQMHZLMUAGKQR-HBFSDRIKSA-N 0 0 382.416 3.298 20 5 GGBDRN C[C@H](CC(=O)[O-])[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000630222884 975168860 /nfs/dbraw/zinc/16/88/60/975168860.db2.gz GBPYXIMFGNMQEL-OAHLLOKOSA-N 0 0 377.444 3.009 20 5 GGBDRN CC(C)(C(=O)[O-])[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000630227398 975175469 /nfs/dbraw/zinc/17/54/69/975175469.db2.gz IVVGHEUOOJGFHV-UHFFFAOYSA-N 0 0 377.444 3.009 20 5 GGBDRN CC(C)n1ncc2c1[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)CCC2 ZINC001592158489 977037824 /nfs/dbraw/zinc/03/78/24/977037824.db2.gz PVFPODLJIDAGEO-OAHLLOKOSA-N 0 0 388.424 3.003 20 5 GGBDRN C[C@@H](CC(=O)Nc1cccc(C(=O)[O-])c1)[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001592269337 977527423 /nfs/dbraw/zinc/52/74/23/977527423.db2.gz QIYXADGLGGYULI-KGLIPLIRSA-N 0 0 385.420 3.403 20 5 GGBDRN C[C@@H]([NH2+]C(C)(C)CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 ZINC000736663501 978347967 /nfs/dbraw/zinc/34/79/67/978347967.db2.gz ZFLQJJZXECVXSH-CYBMUJFWSA-N 0 0 385.420 3.152 20 5 GGBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2cc(C(=O)[O-])ccc2NC1=O ZINC001592546650 978433633 /nfs/dbraw/zinc/43/36/33/978433633.db2.gz VXYLABOOTQBUKU-UGSOOPFHSA-N 0 0 397.431 3.157 20 5 GGBDRN O=C([O-])[C@H]1CCC[N@@H+]1Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000833772436 979240308 /nfs/dbraw/zinc/24/03/08/979240308.db2.gz LWIQBGWDODFANK-LJQANCHMSA-N 0 0 392.415 3.497 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2ccc(CC(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000844207201 979356062 /nfs/dbraw/zinc/35/60/62/979356062.db2.gz CBFRXJLHVMAJHE-WBVHZDCISA-N 0 0 375.469 3.313 20 5 GGBDRN CCC(CC)[C@H](CNC(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C)[NH+](C)C ZINC001595105897 979426834 /nfs/dbraw/zinc/42/68/34/979426834.db2.gz FHWKPPJQQRITTA-INIZCTEOSA-N 0 0 380.445 3.089 20 5 GGBDRN O=C([O-])C[N@H+](Cc1ccc(C(F)(F)F)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000846269563 979435391 /nfs/dbraw/zinc/43/53/91/979435391.db2.gz SFDJGWHTLCEHJM-MRXNPFEDSA-N 0 0 398.337 3.234 20 5 GGBDRN CC[C@]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)(C(=O)[O-])c1ccc(Cl)cc1 ZINC001595293853 980404416 /nfs/dbraw/zinc/40/44/16/980404416.db2.gz YVQATVIMCNAGIM-SJLPKXTDSA-N 0 0 378.812 3.261 20 5 GGBDRN O=C([O-])CC[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000901678947 980441630 /nfs/dbraw/zinc/44/16/30/980441630.db2.gz TUKQCQAFYUWRSP-CYBMUJFWSA-N 0 0 376.331 3.069 20 5 GGBDRN CO[C@H]1CC[N@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[C@@H](C(=O)[O-])C1 ZINC000902031708 980703320 /nfs/dbraw/zinc/70/33/20/980703320.db2.gz LFBQMHRQBZTIOE-FXAWDEMLSA-N 0 0 399.447 3.427 20 5 GGBDRN CC[C@](C)(C(=O)[O-])[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CC1 ZINC001594778319 981775776 /nfs/dbraw/zinc/77/57/76/981775776.db2.gz OGRTUHNHVZQMCG-QGZVFWFLSA-N 0 0 383.832 3.152 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N(CC[NH+](C)C)Cc2cccc(Cl)c2)n1 ZINC000910353012 981887911 /nfs/dbraw/zinc/88/79/11/981887911.db2.gz VIJPNLWYCJLRJU-UHFFFAOYSA-N 0 0 392.843 3.218 20 5 GGBDRN O=C([O-])/C=C\c1ccc(NC2CC[NH+](Cc3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC000917080923 982679446 /nfs/dbraw/zinc/67/94/46/982679446.db2.gz NYMLHIAMOPESGN-ALCCZGGFSA-N 0 0 382.420 3.164 20 5 GGBDRN CCOCCC[N@@H+]1CC[C@H](Nc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1 ZINC001596917459 985962040 /nfs/dbraw/zinc/96/20/40/985962040.db2.gz WYLFPHURNKTHBS-ZEXGLFEZSA-N 0 0 391.468 3.242 20 5 GGBDRN C[C@@H]1C[N@@H+](CCCCNc2c(Cl)cc([N+](=O)[O-])cc2C(=O)[O-])C[C@H](C)O1 ZINC001594527615 986081201 /nfs/dbraw/zinc/08/12/01/986081201.db2.gz HBGXCABUBINEAF-TXEJJXNPSA-N 0 0 385.848 3.248 20 5 GGBDRN CCOc1cc(N2CC[NH+](C[C@H]3CCCC[C@H]3C(=O)[O-])CC2)ccc1[N+](=O)[O-] ZINC001597041738 986488444 /nfs/dbraw/zinc/48/84/44/986488444.db2.gz AOZFNUVNFHNGMX-NVXWUHKLSA-N 0 0 391.468 3.007 20 5 GGBDRN C[C@H](C(=O)[O-])[C@@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 ZINC001589469877 986948880 /nfs/dbraw/zinc/94/88/80/986948880.db2.gz QBHXXJVNSYJKEZ-KPZWWZAWSA-N 0 0 389.383 3.114 20 5 GGBDRN C[C@H](C(=O)[O-])[C@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 ZINC001589469879 986949097 /nfs/dbraw/zinc/94/90/97/986949097.db2.gz QBHXXJVNSYJKEZ-SGTLLEGYSA-N 0 0 389.383 3.114 20 5 GGBDRN CC(C)(C(=O)[O-])[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC001589602016 987430317 /nfs/dbraw/zinc/43/03/17/987430317.db2.gz UFSZXKUWUNPYOI-SFHVURJKSA-N 0 0 385.420 3.365 20 5 GGBDRN CCc1cccc2c(CC[NH2+]Cc3ccc(OCC(=O)[O-])c([N+](=O)[O-])c3)c[nH]c21 ZINC001597603086 988459363 /nfs/dbraw/zinc/45/93/63/988459363.db2.gz DAUUEODDNNMHON-UHFFFAOYSA-N 0 0 397.431 3.434 20 5 GGBDRN CCc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001597603503 988468073 /nfs/dbraw/zinc/46/80/73/988468073.db2.gz GJSGFFWOFWLQDL-INIZCTEOSA-N 0 0 386.404 3.234 20 5 GGBDRN CSc1ccc(OCC[NH2+][C@@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1 ZINC001599819923 988495123 /nfs/dbraw/zinc/49/51/23/988495123.db2.gz GDFRVWWCNMWFEW-GOSISDBHSA-N 0 0 376.434 3.285 20 5 GGBDRN C[C@@H]([NH2+]CC(=O)Nc1sc2c(c1C(=O)[O-])CCC2)c1ccc([N+](=O)[O-])cc1 ZINC001599841422 988842281 /nfs/dbraw/zinc/84/22/81/988842281.db2.gz GXMDHEJGGSTTMH-SNVBAGLBSA-N 0 0 389.433 3.133 20 5 GGBDRN C[NH+](C)[C@@H](CNc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC001598176035 990726590 /nfs/dbraw/zinc/72/65/90/990726590.db2.gz KEIACPIJOYIYIQ-IBGZPJMESA-N 0 0 397.431 3.276 20 5 GGBDRN C[NH+](C)C1(CNc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC001598184120 990751620 /nfs/dbraw/zinc/75/16/20/990751620.db2.gz HKHZERBMMAFSMS-UHFFFAOYSA-N 0 0 383.404 3.030 20 5 GGBDRN CC(C)(O)C[N@@H+]1CCc2c(cccc2Nc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001590899193 990854497 /nfs/dbraw/zinc/85/44/97/990854497.db2.gz SEFWSIRCIAAZPP-UHFFFAOYSA-N 0 0 385.420 3.166 20 5 GGBDRN C[NH+](C)CC1CCN(c2ccc(Nc3ncc(C(=O)[O-])cc3[N+](=O)[O-])cc2)CC1 ZINC001598211278 990854481 /nfs/dbraw/zinc/85/44/81/990854481.db2.gz QWWDOINLDQWJSO-UHFFFAOYSA-N 0 0 399.451 3.210 20 5 GGBDRN COc1cccc(SCC[NH2+][C@@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)c1 ZINC001599684157 990959850 /nfs/dbraw/zinc/95/98/50/990959850.db2.gz NVRFMFKMYSJMKR-GOSISDBHSA-N 0 0 376.434 3.285 20 5 GGBDRN CC(C)[C@@H](CNCc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[NH+]1CCCCCC1 ZINC001590990236 991205816 /nfs/dbraw/zinc/20/58/16/991205816.db2.gz WAGJEHZOUFUWRB-GOSISDBHSA-N 0 0 393.484 3.048 20 5 GGBDRN CN(C)c1ncc(C[NH2+][C@@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC001598359187 991488268 /nfs/dbraw/zinc/48/82/68/991488268.db2.gz JEKCNLYIYREXPB-OAQYLSRUSA-N 0 0 394.431 3.299 20 5 GGBDRN CC(C)CCOC1CC[NH+](Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)CC1 ZINC001591256434 992156417 /nfs/dbraw/zinc/15/64/17/992156417.db2.gz KUZXXCKODKPTRP-UHFFFAOYSA-N 0 0 380.441 3.085 20 5 GGBDRN CC(C)C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(C)C(=O)[O-] ZINC001591290747 992238854 /nfs/dbraw/zinc/23/88/54/992238854.db2.gz FSWACNSSUKEQJW-UHFFFAOYSA-N 0 0 385.848 3.256 20 5 GGBDRN CC(C)C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC(C)(C)C(=O)[O-] ZINC001591321794 992289860 /nfs/dbraw/zinc/28/98/60/992289860.db2.gz IQVYUBYJMCSYGW-UHFFFAOYSA-N 0 0 383.420 3.131 20 5 GGBDRN C[N@H+](Cc1ccccc1)C1CN(c2c(Cl)cc([N+](=O)[O-])cc2C(=O)[O-])C1 ZINC001598529107 992756406 /nfs/dbraw/zinc/75/64/06/992756406.db2.gz UATAVFWQDSEGBE-UHFFFAOYSA-N 0 0 375.812 3.267 20 5 GGBDRN COc1cccc([C@@H](C(=O)[O-])[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001599649430 994473821 /nfs/dbraw/zinc/47/38/21/994473821.db2.gz FQJQQMHCVAXSKD-IBGZPJMESA-N 0 0 386.404 3.273 20 5 GGBDRN COc1cccc([C@](C)(CC(=O)[O-])[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC001599655875 994579369 /nfs/dbraw/zinc/57/93/69/994579369.db2.gz PTXIZNHRTQRBGM-IBGZPJMESA-N 0 0 392.383 3.231 20 5 GGBDRN C[C@@]([NH2+]CCc1cccc2c1OC(F)(F)O2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593275913 994631232 /nfs/dbraw/zinc/63/12/32/994631232.db2.gz WGOIKBBJHISEOB-KRWDZBQOSA-N 0 0 394.330 3.048 20 5 GGBDRN C[C@]([NH2+]C[C@H](O)c1cccc2ccccc21)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593286199 994642448 /nfs/dbraw/zinc/64/24/48/994642448.db2.gz PPKRJMMVLQOKCM-PZJWPPBQSA-N 0 0 380.400 3.371 20 5 GGBDRN C[C@@]([NH2+]C[C@H](O)c1cccc2ccccc21)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593286198 994642577 /nfs/dbraw/zinc/64/25/77/994642577.db2.gz PPKRJMMVLQOKCM-FPOVZHCZSA-N 0 0 380.400 3.371 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1cc(F)ccc1N(C)C ZINC001593298240 994711157 /nfs/dbraw/zinc/71/11/57/994711157.db2.gz GIMGOYZYRUYVEJ-LBPRGKRZSA-N 0 0 391.399 3.114 20 5 GGBDRN C[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](Cc1ccccc1)C(=O)[O-] ZINC001593312193 994795120 /nfs/dbraw/zinc/79/51/20/994795120.db2.gz PXOHRBMBAXJBOV-GUYCJALGSA-N 0 0 396.403 3.066 20 5 GGBDRN C[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](Cc1ccccc1)C(=O)[O-] ZINC001593317312 994818469 /nfs/dbraw/zinc/81/84/69/994818469.db2.gz OZAIIRCIFBHGQQ-DYVFJYSZSA-N 0 0 396.403 3.066 20 5 GGBDRN COC(=O)[C@@H](C)C[N@H+](Cc1ccccc1)Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001598689752 995046031 /nfs/dbraw/zinc/04/60/31/995046031.db2.gz QIMAVDKQBRVCAK-AWEZNQCLSA-N 0 0 386.404 3.104 20 5 GGBDRN CC1(C)CCC[C@]([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])(C(=O)[O-])C1 ZINC001593895738 996750517 /nfs/dbraw/zinc/75/05/17/996750517.db2.gz MULPYJZRHNZBDQ-QGZVFWFLSA-N 0 0 383.832 3.200 20 5 GGBDRN COc1ccc([C@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C(=O)[O-])cc1Cl ZINC001599530686 997646635 /nfs/dbraw/zinc/64/66/35/997646635.db2.gz FGQAFSHYYSNOJP-INIZCTEOSA-N 0 0 380.784 3.181 20 5 GGBDRN COc1ccc([C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C(=O)[O-])c(OC)c1 ZINC001599532592 997684963 /nfs/dbraw/zinc/68/49/63/997684963.db2.gz SICAFCBPWGINGN-MRXNPFEDSA-N 0 0 380.784 3.181 20 5 GGBDRN COc1c(O)ccc(C[NH2+][C@H](C(=O)[O-])c2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC001599345085 997990091 /nfs/dbraw/zinc/99/00/91/997990091.db2.gz QDFOBSZHFGJJMP-KRWDZBQOSA-N 0 0 382.372 3.378 20 5 GGBDRN COc1ccc(C[N@@H+]2CC[C@@H]2CNc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC001599561051 998195628 /nfs/dbraw/zinc/19/56/28/998195628.db2.gz CCTIWQWTKHXNRV-VWTAQGJOSA-N 0 0 397.431 3.388 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](c2ccc(F)cc2F)[C@H](C(=O)[O-])C1 ZINC001599461995 998289508 /nfs/dbraw/zinc/28/95/08/998289508.db2.gz GPQGGKOPJNUJDY-JKSUJKDBSA-N 0 0 392.358 3.182 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C(=O)[O-])c2cccc3ccccc32)c1 ZINC001598988974 998719348 /nfs/dbraw/zinc/71/93/48/998719348.db2.gz XKUHVVJQCYOWIM-LJQANCHMSA-N 0 0 394.383 3.450 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C(=O)[O-])c2cccc3ccccc32)c1 ZINC001598988973 998719407 /nfs/dbraw/zinc/71/94/07/998719407.db2.gz XKUHVVJQCYOWIM-IBGZPJMESA-N 0 0 394.383 3.450 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@]2(C(=O)[O-])CC[C@H](C)c3ccccc32)c1 ZINC001598989064 998719768 /nfs/dbraw/zinc/71/97/68/998719768.db2.gz ZEOCASFPWHQBDU-ZSEKCTLFSA-N 0 0 398.415 3.348 20 5 GGBDRN C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@@H+]1Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594297405 999147151 /nfs/dbraw/zinc/14/71/51/999147151.db2.gz WXJACUKWTNBMJM-TZMCWYRMSA-N 0 0 378.425 3.235 20 5 GGBDRN CO[C@@H](C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccccc1Cl ZINC001599054055 999216236 /nfs/dbraw/zinc/21/62/36/999216236.db2.gz KAIJTRFSAKOWAD-KRWDZBQOSA-N 0 0 394.811 3.189 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@@H+]2Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001594329264 999264612 /nfs/dbraw/zinc/26/46/12/999264612.db2.gz VKUNVWCLDDKJSL-JXIYXGQPSA-N 0 0 376.453 3.445 20 5 GGBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001599064267 999288112 /nfs/dbraw/zinc/28/81/12/999288112.db2.gz VNWSCTZULKGNJO-BLVKFPJESA-N 0 0 392.383 3.063 20 5 GGBDRN CC1CC[NH+](CC[C@H]2CCCN2Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1 ZINC001594418676 999562709 /nfs/dbraw/zinc/56/27/09/999562709.db2.gz HZROWIZSSNDJPW-GOSISDBHSA-N 0 0 375.469 3.379 20 5 GGBDRN CC1CC[NH+](CC[C@@H]2CCCN2Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1 ZINC001594418679 999562818 /nfs/dbraw/zinc/56/28/18/999562818.db2.gz HZROWIZSSNDJPW-SFHVURJKSA-N 0 0 375.469 3.379 20 5 GGBDRN C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594425922 999590442 /nfs/dbraw/zinc/59/04/42/999590442.db2.gz CEQQWSPVHPYRHD-MRXNPFEDSA-N 0 0 383.448 3.389 20 5 GGBDRN CCOc1ccc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cc1 ZINC000277134129 1126078184 /nfs/dbraw/zinc/07/81/84/1126078184.db2.gz BTTVAQYJZJFXGA-IBGZPJMESA-N 0 0 383.404 3.260 20 5 GGBDRN CCOc1ccc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cc1 ZINC000277134143 1126078200 /nfs/dbraw/zinc/07/82/00/1126078200.db2.gz BTTVAQYJZJFXGA-LJQANCHMSA-N 0 0 383.404 3.260 20 5 GGBDRN COCc1ccc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cc1 ZINC000417566299 1126080408 /nfs/dbraw/zinc/08/04/08/1126080408.db2.gz RBJHEDCTBYFFHD-IBGZPJMESA-N 0 0 383.404 3.008 20 5 GGBDRN CCCOc1ccc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cc1OC ZINC000277254981 1126078367 /nfs/dbraw/zinc/07/83/67/1126078367.db2.gz KEJFKBFRWTYXKY-KRWDZBQOSA-N 0 0 388.420 3.178 20 5 GGBDRN COc1ccc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])c(Cl)c1OC ZINC000277278712 1126078651 /nfs/dbraw/zinc/07/86/51/1126078651.db2.gz LXBSTDBOOPAUGX-AWEZNQCLSA-N 0 0 394.811 3.051 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000426645285 1126081157 /nfs/dbraw/zinc/08/11/57/1126081157.db2.gz GGVWSMJQWWCGEL-SFHVURJKSA-N 0 0 382.372 3.346 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426655999 1126081380 /nfs/dbraw/zinc/08/13/80/1126081380.db2.gz VNNOJMKDZQKQQD-SFHVURJKSA-N 0 0 382.372 3.346 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000426722387 1126082470 /nfs/dbraw/zinc/08/24/70/1126082470.db2.gz HOYFTVWFUJSOHG-IBGZPJMESA-N 0 0 396.378 3.482 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000426728152 1126083610 /nfs/dbraw/zinc/08/36/10/1126083610.db2.gz TXBUAZCSMGTSSG-LJQANCHMSA-N 0 0 396.378 3.482 20 5 GGBDRN COc1ccc(C)cc1C[NH2+][C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)[O-] ZINC000426729474 1126083783 /nfs/dbraw/zinc/08/37/83/1126083783.db2.gz DADHFPHLEBAMKX-SFHVURJKSA-N 0 0 383.404 3.179 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc(F)cc(F)c1 ZINC000426730523 1126084114 /nfs/dbraw/zinc/08/41/14/1126084114.db2.gz AEBZLCIKPNTYHJ-QGZVFWFLSA-N 0 0 375.331 3.140 20 5 GGBDRN CC(C)c1ccc(C[NH2+][C@@H](Cc2ccc3c(c2)OCO3)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426774747 1126089952 /nfs/dbraw/zinc/08/99/52/1126089952.db2.gz WDEQCZFKWGTZLH-INIZCTEOSA-N 0 0 386.404 3.232 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(OCC(F)F)cc1 ZINC000426811860 1126091940 /nfs/dbraw/zinc/09/19/40/1126091940.db2.gz VQWKYZWRXDQBOG-HNNXBMFYSA-N 0 0 380.347 3.024 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](Cc1ccc(OC(F)F)cc1)C(=O)[O-] ZINC000426814246 1126092108 /nfs/dbraw/zinc/09/21/08/1126092108.db2.gz DPDJZPPXWJOCIE-INIZCTEOSA-N 0 0 380.347 3.290 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc(F)cc1F ZINC000567560551 1126097940 /nfs/dbraw/zinc/09/79/40/1126097940.db2.gz RQBVQBDQQBGJJS-KRWDZBQOSA-N 0 0 375.331 3.140 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc(F)c1F ZINC000579188569 1126098463 /nfs/dbraw/zinc/09/84/63/1126098463.db2.gz ASDWQJMMSZJNHD-MRXNPFEDSA-N 0 0 375.331 3.140 20 5 GGBDRN CC(C)c1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])cc1[N+](=O)[O-] ZINC000756369173 1126107648 /nfs/dbraw/zinc/10/76/48/1126107648.db2.gz YFFGIMJHPWEAQB-INIZCTEOSA-N 0 0 387.392 3.412 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)[O-] ZINC000756378917 1126107830 /nfs/dbraw/zinc/10/78/30/1126107830.db2.gz IHYQGCLDIYMXCC-SFHVURJKSA-N 0 0 398.375 3.078 20 5 GGBDRN Cc1cc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cnc1Cl ZINC000756378938 1126107900 /nfs/dbraw/zinc/10/79/00/1126107900.db2.gz INWSXZWNFDTUTI-INIZCTEOSA-N 0 0 388.811 3.218 20 5 GGBDRN COCc1csc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])c1 ZINC001330125106 1126175192 /nfs/dbraw/zinc/17/51/92/1126175192.db2.gz ZMUIFQOLZZDGQS-KRWDZBQOSA-N 0 0 389.433 3.070 20 5 GGBDRN O=C([O-])[C@@H](Cc1cc2ccccc2o1)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001601659428 1126224066 /nfs/dbraw/zinc/22/40/66/1126224066.db2.gz ZDNMRTMMIKVUKW-MRXNPFEDSA-N 0 0 376.315 3.405 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Br ZINC001601660602 1126224833 /nfs/dbraw/zinc/22/48/33/1126224833.db2.gz VKMXJADZBYZCLN-OAHLLOKOSA-N 0 0 379.210 3.143 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc(OC(F)(F)F)cc1)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC001608542068 1126237178 /nfs/dbraw/zinc/23/71/78/1126237178.db2.gz OYECOVISXZKCJB-AWEZNQCLSA-N 0 0 384.310 3.279 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNc2cc(C)c([N+](=O)[O-])cn2)s1 ZINC000470867744 532537505 /nfs/dbraw/zinc/53/75/05/532537505.db2.gz YWMYTYXZWFJDMP-UHFFFAOYSA-N 0 0 384.483 3.002 20 5 GGBDRN Cc1c(Br)c(NCCCc2nnc3n2CCCC3)ncc1[N+](=O)[O-] ZINC000542505948 532774384 /nfs/dbraw/zinc/77/43/84/532774384.db2.gz HVEGUMBQSUYZBO-UHFFFAOYSA-N 0 0 395.261 3.033 20 5 GGBDRN COc1cc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC ZINC000002626825 203952679 /nfs/dbraw/zinc/95/26/79/203952679.db2.gz IVWHZRPWWHRQGG-UHFFFAOYSA-N 0 0 378.406 3.351 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1CCOc1cccc(Br)c1 ZINC000003339230 203999432 /nfs/dbraw/zinc/99/94/32/203999432.db2.gz XXVGHQIUQZGILF-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)NCC(C)C)cc1 ZINC000003352786 204000115 /nfs/dbraw/zinc/00/01/15/204000115.db2.gz GACDIMAMFATXDJ-UHFFFAOYSA-N 0 0 392.433 3.057 20 5 GGBDRN COc1cc(C(=O)OCC(=O)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC ZINC000003362570 204001052 /nfs/dbraw/zinc/00/10/52/204001052.db2.gz GZTYYOZXKLRTOX-UHFFFAOYSA-N 0 0 379.752 3.305 20 5 GGBDRN CCOC(=O)c1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000003416234 204004988 /nfs/dbraw/zinc/00/49/88/204004988.db2.gz MXXKVHKZFZDYNS-UHFFFAOYSA-N 0 0 378.768 3.442 20 5 GGBDRN Cc1c(NC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000003428281 204006192 /nfs/dbraw/zinc/00/61/92/204006192.db2.gz OCQVIDHLYMADPR-UHFFFAOYSA-N 0 0 382.825 3.359 20 5 GGBDRN COc1ccc(C(=O)OCC(=O)Nc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000003442444 204008058 /nfs/dbraw/zinc/00/80/58/204008058.db2.gz UFOKMCQKRHFNOL-UHFFFAOYSA-N 0 0 382.731 3.191 20 5 GGBDRN Cc1cccc(C(C)C)c1NC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O ZINC000003493668 204010823 /nfs/dbraw/zinc/01/08/23/204010823.db2.gz ROFSJAMMBZHENL-UHFFFAOYSA-N 0 0 381.388 3.261 20 5 GGBDRN COc1ccc(C(=O)OCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000004846357 204082169 /nfs/dbraw/zinc/08/21/69/204082169.db2.gz MWQBQNWCTUSVDN-UHFFFAOYSA-N 0 0 398.293 3.418 20 5 GGBDRN O=C(N[C@@H]1CCCc2ccccc21)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000004895456 204087490 /nfs/dbraw/zinc/08/74/90/204087490.db2.gz QAQYMISQJBHFMQ-LJQANCHMSA-N 0 0 381.432 3.239 20 5 GGBDRN CNc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000005363645 204128076 /nfs/dbraw/zinc/12/80/76/204128076.db2.gz QNAGCIQGINTWDJ-RGCMKSIDSA-N 0 0 377.441 3.123 20 5 GGBDRN O=C(Cc1sc(N2CCCCC2)nc1O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000005156929 204114716 /nfs/dbraw/zinc/11/47/16/204114716.db2.gz GKZHDDXZSJYHCL-ZDUSSCGKSA-N 0 0 396.856 3.061 20 5 GGBDRN O=C(Cc1sc(N2CCCCC2)nc1O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000005156928 204115130 /nfs/dbraw/zinc/11/51/30/204115130.db2.gz GKZHDDXZSJYHCL-CYBMUJFWSA-N 0 0 396.856 3.061 20 5 GGBDRN O=C(Nc1c2ccccc2oc1C(=O)N1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000005298175 204124698 /nfs/dbraw/zinc/12/46/98/204124698.db2.gz ICPSTEKICFJFPI-UHFFFAOYSA-N 0 0 395.371 3.066 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000005347380 204126566 /nfs/dbraw/zinc/12/65/66/204126566.db2.gz UYYIURPMRMDDJF-UHFFFAOYSA-N 0 0 382.413 3.343 20 5 GGBDRN COc1ccc(C)cc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000005701622 204147402 /nfs/dbraw/zinc/14/74/02/204147402.db2.gz MYXOIJPDOXKNDS-UHFFFAOYSA-N 0 0 399.432 3.444 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000005699922 204147864 /nfs/dbraw/zinc/14/78/64/204147864.db2.gz PLZVIRXMOPCMIJ-UHFFFAOYSA-N 0 0 382.420 3.154 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccccc1Br ZINC000005745178 204150620 /nfs/dbraw/zinc/15/06/20/204150620.db2.gz CWYUVQANPDJPHF-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ncnc2sc(C)c(C)c21 ZINC000005850821 204154843 /nfs/dbraw/zinc/15/48/43/204154843.db2.gz OFYHXUPASHSTIS-UHFFFAOYSA-N 0 0 388.405 3.242 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1csc2c1CCCC2 ZINC000005968867 204160095 /nfs/dbraw/zinc/16/00/95/204160095.db2.gz RHFZLUBTFJTLPH-UHFFFAOYSA-N 0 0 390.417 3.339 20 5 GGBDRN C[C@@H](NC(=O)COc1cccnc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000005970713 204160728 /nfs/dbraw/zinc/16/07/28/204160728.db2.gz SHTDTHRGUUGICC-SNVBAGLBSA-N 0 0 380.198 3.009 20 5 GGBDRN CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000006049071 204163437 /nfs/dbraw/zinc/16/34/37/204163437.db2.gz HFXTVAVOEUPTNR-UHFFFAOYSA-N 0 0 393.783 3.191 20 5 GGBDRN COc1cccc(CN(C)C(=O)COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000006084562 204164267 /nfs/dbraw/zinc/16/42/67/204164267.db2.gz JZPHUYMBPIVETP-UHFFFAOYSA-N 0 0 392.795 3.072 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCOc2cccc(Cl)c2)C1=O ZINC000006083334 204164919 /nfs/dbraw/zinc/16/49/19/204164919.db2.gz DNQNTNDZVJLSDH-SFHVURJKSA-N 0 0 389.795 3.094 20 5 GGBDRN O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)OCCO2 ZINC000006226441 204170773 /nfs/dbraw/zinc/17/07/73/204170773.db2.gz WYOJJHCBIAKRLO-UHFFFAOYSA-N 0 0 377.736 3.059 20 5 GGBDRN CC[C@H](C)c1ccc(NC(=O)Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)cc1 ZINC000006224733 204171110 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/nfs/dbraw/zinc/24/23/69/564242369.db2.gz WAZWNIZQSAPXKP-UHFFFAOYSA-N 0 0 383.426 3.065 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(I)c1 ZINC000007920935 564242451 /nfs/dbraw/zinc/24/24/51/564242451.db2.gz SZYQMCIOLGGITM-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(S(C)(=O)=O)c1 ZINC000007944601 564243525 /nfs/dbraw/zinc/24/35/25/564243525.db2.gz OIBPANKILOJQFO-NSHDSACASA-N 0 0 380.447 3.118 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1Br ZINC000008146426 564246466 /nfs/dbraw/zinc/24/64/66/564246466.db2.gz ZRXVDIFUCCJFNB-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC2CCC3(CC2)OCCO3)cc1[N+](=O)[O-] ZINC000119045014 564252295 /nfs/dbraw/zinc/25/22/95/564252295.db2.gz YHGNRHXNWCXLOD-UHFFFAOYSA-N 0 0 399.241 3.081 20 5 GGBDRN C[C@@H](Sc1ccc(Br)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCO1 ZINC000119161727 564257258 /nfs/dbraw/zinc/25/72/58/564257258.db2.gz PXPOMVCRAOGNHD-KOLCDFICSA-N 0 0 389.271 3.133 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCC1(O)CCCCCC1 ZINC000119197935 564259294 /nfs/dbraw/zinc/25/92/94/564259294.db2.gz JSMHIISLTHXGAU-UHFFFAOYSA-N 0 0 385.258 3.101 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCc1ccc(Br)s1 ZINC000010821575 564259745 /nfs/dbraw/zinc/25/97/45/564259745.db2.gz ZDIWRFDWQKZSCN-UHFFFAOYSA-N 0 0 385.239 3.157 20 5 GGBDRN COc1cc(Cn2ncc(Cl)c(Cl)c2=O)c([N+](=O)[O-])cc1OC(F)F ZINC000119256918 564261760 /nfs/dbraw/zinc/26/17/60/564261760.db2.gz BNOKKBGNXWTFIP-UHFFFAOYSA-N 0 0 396.133 3.117 20 5 GGBDRN COC(=O)c1cc(Br)ccc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000119257417 564262136 /nfs/dbraw/zinc/26/21/36/564262136.db2.gz UMXGFVVJMUSATK-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN COC(=O)c1cc(Br)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000119257629 564262242 /nfs/dbraw/zinc/26/22/42/564262242.db2.gz KMCHSGNPVVXJAR-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000011443208 564262992 /nfs/dbraw/zinc/26/29/92/564262992.db2.gz SAOOQFUSMHJNRU-UHFFFAOYSA-N 0 0 382.829 3.427 20 5 GGBDRN CN(C(=O)CSc1nnc(-c2cccs2)o1)c1ccc([N+](=O)[O-])cc1 ZINC000011703777 564265138 /nfs/dbraw/zinc/26/51/38/564265138.db2.gz GGWKQVZTVUAJHH-UHFFFAOYSA-N 0 0 376.419 3.461 20 5 GGBDRN O=C(Cc1ccccc1I)Nc1ccc([N+](=O)[O-])cc1 ZINC000119385466 564268167 /nfs/dbraw/zinc/26/81/67/564268167.db2.gz MKTAKWDUVGOMSV-UHFFFAOYSA-N 0 0 382.157 3.381 20 5 GGBDRN COc1ccc(Cl)c(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000119425550 564270206 /nfs/dbraw/zinc/27/02/06/564270206.db2.gz MVGQBVHWLZDVLM-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN CN1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)sc2C1 ZINC000119443122 564271158 /nfs/dbraw/zinc/27/11/58/564271158.db2.gz HBDAVBKSOWRIDP-UHFFFAOYSA-N 0 0 397.254 3.054 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)CN(C)CC2 ZINC000119472467 564272627 /nfs/dbraw/zinc/27/26/27/564272627.db2.gz DCPBJHOPHJVAAI-UHFFFAOYSA-N 0 0 378.479 3.404 20 5 GGBDRN CN(CCOc1ccc(F)cc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119518838 564275226 /nfs/dbraw/zinc/27/52/26/564275226.db2.gz BWYVEDVZDCQOKD-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN CN(Cc1ccc(F)c(F)c1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119536500 564275991 /nfs/dbraw/zinc/27/59/91/564275991.db2.gz YWZZUQSDSZJNOY-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccc(Br)cc1)CC2 ZINC000014099048 564279379 /nfs/dbraw/zinc/27/93/79/564279379.db2.gz ZMCKEHRTVVFYSW-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1C1CC1 ZINC000014065343 564279642 /nfs/dbraw/zinc/27/96/42/564279642.db2.gz OBCKFIXAEBTGEV-UHFFFAOYSA-N 0 0 381.845 3.468 20 5 GGBDRN O=C(NCCCF)C(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000119656802 564281835 /nfs/dbraw/zinc/28/18/35/564281835.db2.gz ZKZPYPOCEAKEAS-UHFFFAOYSA-N 0 0 383.426 3.222 20 5 GGBDRN Cc1sc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C(N)=O)c1C ZINC000119674033 564282733 /nfs/dbraw/zinc/28/27/33/564282733.db2.gz ZUTVNAFOCJHMGL-SNVBAGLBSA-N 0 0 379.463 3.491 20 5 GGBDRN COC(=O)c1cc(Br)ccc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000014786191 564283336 /nfs/dbraw/zinc/28/33/36/564283336.db2.gz QILGCHBNTZWIJI-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000015143593 564284508 /nfs/dbraw/zinc/28/45/08/564284508.db2.gz GJPWDDKFCBFGMS-UHFFFAOYSA-N 0 0 384.841 3.297 20 5 GGBDRN CC[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000119726179 564284797 /nfs/dbraw/zinc/28/47/97/564284797.db2.gz AIJQCSRKDCETFM-HNNXBMFYSA-N 0 0 383.857 3.137 20 5 GGBDRN CNS(=O)(=O)c1cccc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000119713437 564285119 /nfs/dbraw/zinc/28/51/19/564285119.db2.gz DXQNNZMDNSUYDX-LLVKDONJSA-N 0 0 383.857 3.007 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)CCOc1cccc(Cl)c1 ZINC000015362133 564286241 /nfs/dbraw/zinc/28/62/41/564286241.db2.gz SPULBDGCPAFPGE-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN CCCN(CCC)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000119747977 564286693 /nfs/dbraw/zinc/28/66/93/564286693.db2.gz CPOTVWDSGLACEP-UHFFFAOYSA-N 0 0 376.194 3.462 20 5 GGBDRN Cc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1Cl ZINC000015415026 564287491 /nfs/dbraw/zinc/28/74/91/564287491.db2.gz QDTLVNHBQLQGCG-UHFFFAOYSA-N 0 0 379.825 3.386 20 5 GGBDRN O=c1c2cc(Br)cc(F)c2ncn1Cc1cccc([N+](=O)[O-])c1 ZINC000119781859 564288236 /nfs/dbraw/zinc/28/82/36/564288236.db2.gz WHQXWLIJLLRPIA-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000015619452 564289102 /nfs/dbraw/zinc/28/91/02/564289102.db2.gz VOBSZDDURSVEKE-UHFFFAOYSA-N 0 0 398.238 3.096 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)CCOc1ccc(Cl)cc1 ZINC000016084542 564290958 /nfs/dbraw/zinc/29/09/58/564290958.db2.gz SIKCCZLAZNHBKN-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN C[C@@H](Sc1nnnn1C(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000016290432 564292416 /nfs/dbraw/zinc/29/24/16/564292416.db2.gz MWZGDCOEJNVWBQ-MRVPVSSYSA-N 0 0 384.849 3.109 20 5 GGBDRN O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)c1ccc(Cl)c(Cl)c1 ZINC000016657132 564295237 /nfs/dbraw/zinc/29/52/37/564295237.db2.gz OAWOIURYZJKWGW-UHFFFAOYSA-N 0 0 379.155 3.381 20 5 GGBDRN C[C@@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)Sc1ccc(Br)cc1 ZINC000119935708 564296007 /nfs/dbraw/zinc/29/60/07/564296007.db2.gz VBIOSBIFKPREAD-VIFPVBQESA-N 0 0 399.270 3.001 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](C)Oc2cccnc2[N+](=O)[O-])c(Br)c1 ZINC000016793398 564296147 /nfs/dbraw/zinc/29/61/47/564296147.db2.gz CGPURDGYPDEPMD-JTQLQIEISA-N 0 0 380.198 3.467 20 5 GGBDRN CCCCN(CC)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000119964261 564298195 /nfs/dbraw/zinc/29/81/95/564298195.db2.gz OCTDKNKJPXZSBL-UHFFFAOYSA-N 0 0 376.194 3.462 20 5 GGBDRN CCCN(CC1CC1)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000119996187 564299059 /nfs/dbraw/zinc/29/90/59/564299059.db2.gz MKCWYLODFDXRFG-UHFFFAOYSA-N 0 0 388.205 3.462 20 5 GGBDRN O=Cc1ccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000018054565 564300284 /nfs/dbraw/zinc/30/02/84/564300284.db2.gz BZAPAWZLIWKXSK-UHFFFAOYSA-N 0 0 375.280 3.493 20 5 GGBDRN O=C(c1c(Cl)cccc1Cl)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000020413301 564306280 /nfs/dbraw/zinc/30/62/80/564306280.db2.gz NWHORJTVCWHURH-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ccccc1Br ZINC000120171583 564307560 /nfs/dbraw/zinc/30/75/60/564307560.db2.gz LCNQSGQEOTYFNI-UHFFFAOYSA-N 0 0 388.015 3.330 20 5 GGBDRN CCOC(=O)CS[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000021347389 564310155 /nfs/dbraw/zinc/31/01/55/564310155.db2.gz XRUWWHXURVBMBJ-MRVPVSSYSA-N 0 0 380.344 3.237 20 5 GGBDRN Cc1cc(OCc2cc(=O)n3cc(Br)ccc3n2)ccc1[N+](=O)[O-] ZINC000021587878 564310839 /nfs/dbraw/zinc/31/08/39/564310839.db2.gz QTFOKHFCEASDIC-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000120256460 564312188 /nfs/dbraw/zinc/31/21/88/564312188.db2.gz YLLAVKKMSPXVAR-UHFFFAOYSA-N 0 0 387.193 3.024 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(NC4CC4)s3)o2)cc1 ZINC000022173381 564313899 /nfs/dbraw/zinc/31/38/99/564313899.db2.gz LQPWCWCCIZKEFT-UHFFFAOYSA-N 0 0 376.423 3.363 20 5 GGBDRN O=c1[nH]cnc2cc(NCCc3ccc(Br)s3)c([N+](=O)[O-])cc12 ZINC000022136098 564314102 /nfs/dbraw/zinc/31/41/02/564314102.db2.gz WBSHXRABKMLXLT-UHFFFAOYSA-N 0 0 395.238 3.310 20 5 GGBDRN C[C@@H](NC(=O)c1cc(I)cc([N+](=O)[O-])c1)c1ccccn1 ZINC000120504417 564322829 /nfs/dbraw/zinc/32/28/29/564322829.db2.gz MUBGMCDJMAFHFH-SECBINFHSA-N 0 0 397.172 3.085 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000023389759 564324220 /nfs/dbraw/zinc/32/42/20/564324220.db2.gz PWWKOEOLKLPAEN-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN CN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccc(Cl)s1 ZINC000023706616 564326419 /nfs/dbraw/zinc/32/64/19/564326419.db2.gz PTYTVYIIFOEAQX-UHFFFAOYSA-N 0 0 383.813 3.109 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000120605558 564328973 /nfs/dbraw/zinc/32/89/73/564328973.db2.gz BDDMIUCBPLMLGS-OLZOCXBDSA-N 0 0 380.388 3.178 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000120605056 564328999 /nfs/dbraw/zinc/32/89/99/564328999.db2.gz BDDMIUCBPLMLGS-QWHCGFSZSA-N 0 0 380.388 3.178 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CSc1nnc(N(C(C)=O)C2CC2)s1 ZINC000025362215 564337775 /nfs/dbraw/zinc/33/77/75/564337775.db2.gz VHKDWWNEXMFSAH-UHFFFAOYSA-N 0 0 380.451 3.263 20 5 GGBDRN O=C(c1cc(Cl)cc(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000025496793 564339728 /nfs/dbraw/zinc/33/97/28/564339728.db2.gz VCAJGWCNWUPCHP-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN COCCN(C(=O)[C@@H](C)SC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000120886487 564342340 /nfs/dbraw/zinc/34/23/40/564342340.db2.gz TVRBDYSGQZZBCU-LLVKDONJSA-N 0 0 381.479 3.449 20 5 GGBDRN O=c1c2cccc(Br)c2ncn1CCOc1ccc([N+](=O)[O-])cc1 ZINC000120942038 564344092 /nfs/dbraw/zinc/34/40/92/564344092.db2.gz XRTVLJATTRIRAC-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1ccc(Br)s1 ZINC000026166413 564344582 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O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2cc(Cl)sc2Cl)cc1 ZINC000026874351 564350662 /nfs/dbraw/zinc/35/06/62/564350662.db2.gz YCSNXSRUGXEGJH-UHFFFAOYSA-N 0 0 396.277 3.354 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(S(C)(=O)=O)ccc2F)c1 ZINC000026858063 564351091 /nfs/dbraw/zinc/35/10/91/564351091.db2.gz ONXWESLPRVUIMG-UHFFFAOYSA-N 0 0 384.410 3.112 20 5 GGBDRN O=C([C@H]1COc2ccc(Br)cc21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000121064842 564351245 /nfs/dbraw/zinc/35/12/45/564351245.db2.gz YQXQPQUSKYIBAN-AWEZNQCLSA-N 0 0 389.205 3.423 20 5 GGBDRN CN(Cc1ccc(Br)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027350085 564354044 /nfs/dbraw/zinc/35/40/44/564354044.db2.gz OZTAUPXNRYYZJK-UHFFFAOYSA-N 0 0 378.226 3.088 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC[C@@H]1c1ccccc1Br ZINC000121115053 564354033 /nfs/dbraw/zinc/35/40/33/564354033.db2.gz BGFPKXWVANGJSS-OAHLLOKOSA-N 0 0 393.241 3.308 20 5 GGBDRN O=C(CN1CCc2c(Br)cccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000121142525 564354950 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GGBDRN Cc1sc(S(=O)(=O)N(C)Cc2ccc(Br)o2)cc1[N+](=O)[O-] ZINC000123104326 564438500 /nfs/dbraw/zinc/43/85/00/564438500.db2.gz SKZVKKVTHGMASN-UHFFFAOYSA-N 0 0 395.256 3.141 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1coc(-c2cccs2)n1 ZINC000042158131 564442751 /nfs/dbraw/zinc/44/27/51/564442751.db2.gz LGBKNUVWVAVEOP-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN CCCNC(=O)CSc1nnc(SCCc2ccc([N+](=O)[O-])cc2)s1 ZINC000042152601 564442830 /nfs/dbraw/zinc/44/28/30/564442830.db2.gz FAXBMNFBCQPBPM-UHFFFAOYSA-N 0 0 398.535 3.399 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OCc1cc(=O)n2cc(Br)ccc2n1 ZINC000042180155 564443795 /nfs/dbraw/zinc/44/37/95/564443795.db2.gz MWNJEUOESFKHOD-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN O=C(/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)N[C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000123455117 564448397 /nfs/dbraw/zinc/44/83/97/564448397.db2.gz SECJZWZXXHOKMZ-XYBXCPIQSA-N 0 0 382.869 3.432 20 5 GGBDRN O=C(CCNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(Br)cc1 ZINC000042654059 564448627 /nfs/dbraw/zinc/44/86/27/564448627.db2.gz NWMBLMGWZQPWPT-UHFFFAOYSA-N 0 0 392.209 3.116 20 5 GGBDRN O=C(Nc1cc(Br)ccn1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000123572498 564453769 /nfs/dbraw/zinc/45/37/69/564453769.db2.gz RVRPGWRZLCARFZ-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000123563404 564453876 /nfs/dbraw/zinc/45/38/76/564453876.db2.gz MZJWGZIBTFSCDN-SNVBAGLBSA-N 0 0 379.214 3.100 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cc(Br)ccn2)cc([N+](=O)[O-])c1 ZINC000123612166 564455776 /nfs/dbraw/zinc/45/57/76/564455776.db2.gz WYCKSJBEPJRCEX-UHFFFAOYSA-N 0 0 394.181 3.181 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCN(CC(F)(F)F)CC1 ZINC000123635148 564456681 /nfs/dbraw/zinc/45/66/81/564456681.db2.gz WXNHMGIALMQMMF-UHFFFAOYSA-N 0 0 380.754 3.350 20 5 GGBDRN CN(Cc1ccc(Br)cc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000043531263 564459617 /nfs/dbraw/zinc/45/96/17/564459617.db2.gz ZGYRLCJXAWYZEZ-UHFFFAOYSA-N 0 0 399.266 3.319 20 5 GGBDRN Cc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)s1 ZINC000123821469 564462214 /nfs/dbraw/zinc/46/22/14/564462214.db2.gz MNOQMRTWORPCGB-QMMMGPOBSA-N 0 0 375.497 3.420 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc2[nH]c(-c3csc([N+](=O)[O-])c3)nc2c1 ZINC000123837051 564463321 /nfs/dbraw/zinc/46/33/21/564463321.db2.gz DDFBTMIPGKDFKR-UHFFFAOYSA-N 0 0 380.451 3.230 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCCC[C@H]1c1ncon1 ZINC000123930444 564466514 /nfs/dbraw/zinc/46/65/14/564466514.db2.gz ZTZPRRYVYIJKDK-LBPRGKRZSA-N 0 0 381.186 3.108 20 5 GGBDRN CN(CC(=O)Nc1ccccc1Br)C(=O)c1csc([N+](=O)[O-])c1 ZINC000044311162 564466976 /nfs/dbraw/zinc/46/69/76/564466976.db2.gz SMOKCVWDMREBOL-UHFFFAOYSA-N 0 0 398.238 3.130 20 5 GGBDRN CN(CCC(=O)OC(C)(C)C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000124111282 564472145 /nfs/dbraw/zinc/47/21/45/564472145.db2.gz JYKYTUAVLMQTSI-UHFFFAOYSA-N 0 0 387.230 3.161 20 5 GGBDRN Cc1cc([C@@H]2CCCN2S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)no1 ZINC000044783499 564472343 /nfs/dbraw/zinc/47/23/43/564472343.db2.gz IWCSJSHBZIUOMW-AWEZNQCLSA-N 0 0 385.829 3.379 20 5 GGBDRN CCOc1ccc(CN(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000044760557 564472389 /nfs/dbraw/zinc/47/23/89/564472389.db2.gz JOYWQIDXNAXHPZ-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cnn(CC(F)F)c2)cc1[N+](=O)[O-] ZINC000124316592 564478795 /nfs/dbraw/zinc/47/87/95/564478795.db2.gz AANLOLNOCDXWSB-UHFFFAOYSA-N 0 0 389.156 3.380 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCc1cccc(Br)c1 ZINC000045174011 564478917 /nfs/dbraw/zinc/47/89/17/564478917.db2.gz QPYMPVLMMXPQSQ-UHFFFAOYSA-N 0 0 378.226 3.476 20 5 GGBDRN O=C(NCc1cc2c(c(Br)c1)OCO2)c1ccc(F)cc1[N+](=O)[O-] ZINC000124418871 564481888 /nfs/dbraw/zinc/48/18/88/564481888.db2.gz VLPZICZHHIVWIC-UHFFFAOYSA-N 0 0 397.156 3.155 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1ccc(Cl)s1 ZINC000045602893 564485907 /nfs/dbraw/zinc/48/59/07/564485907.db2.gz LPQKTVZQVHBHTA-JTQLQIEISA-N 0 0 381.841 3.087 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCO[C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000124623391 564488724 /nfs/dbraw/zinc/48/87/24/564488724.db2.gz ASTLFAPMHPGAPE-OAHLLOKOSA-N 0 0 382.463 3.035 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCO[C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000124623152 564488736 /nfs/dbraw/zinc/48/87/36/564488736.db2.gz ASTLFAPMHPGAPE-HNNXBMFYSA-N 0 0 382.463 3.035 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000045798745 564489756 /nfs/dbraw/zinc/48/97/56/564489756.db2.gz NQTQKQAOHCKPPA-OAHLLOKOSA-N 0 0 382.438 3.390 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2ccc(Br)s2)cc1 ZINC000045810788 564489760 /nfs/dbraw/zinc/48/97/60/564489760.db2.gz NTMNNVAPOQJMBC-UHFFFAOYSA-N 0 0 391.268 3.038 20 5 GGBDRN COc1ccccc1C[C@@H](C)N(C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000124780021 564492356 /nfs/dbraw/zinc/49/23/56/564492356.db2.gz YLETVZNUGNJESB-LLVKDONJSA-N 0 0 384.479 3.225 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)CCOc1ccccc1Cl ZINC000046033941 564493796 /nfs/dbraw/zinc/49/37/96/564493796.db2.gz ZKSQMGFAXZNMNZ-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc(-c3ccc(Cl)cc3)no2)cc1 ZINC000046153806 564496479 /nfs/dbraw/zinc/49/64/79/564496479.db2.gz MWMHZNRSPSTSDQ-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCc2cccs2)c(S(=O)(=O)N2CCCC2)c1 ZINC000046229271 564499464 /nfs/dbraw/zinc/49/94/64/564499464.db2.gz UOQLXAVYPFKKFL-UHFFFAOYSA-N 0 0 381.479 3.095 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(N)=O)c(Cl)c1 ZINC000046241962 564499728 /nfs/dbraw/zinc/49/97/28/564499728.db2.gz VRZQLESZEFAWJY-VIFPVBQESA-N 0 0 379.825 3.466 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(CC(F)(F)F)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000125019208 564501126 /nfs/dbraw/zinc/50/11/26/564501126.db2.gz PKRYGIYZRPFNBL-JTQLQIEISA-N 0 0 377.388 3.025 20 5 GGBDRN CCc1nc(CN2CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC2)no1 ZINC000125062626 564501550 /nfs/dbraw/zinc/50/15/50/564501550.db2.gz QZZFFRRGUNBOPW-UHFFFAOYSA-N 0 0 386.239 3.169 20 5 GGBDRN Cc1sc(S(=O)(=O)NCCc2c[nH]c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000125068635 564501582 /nfs/dbraw/zinc/50/15/82/564501582.db2.gz ZBBQZHFLMJNBQE-UHFFFAOYSA-N 0 0 383.426 3.106 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)s1 ZINC000046388583 564502636 /nfs/dbraw/zinc/50/26/36/564502636.db2.gz ZPPIMYGPDHJQGZ-ZJUUUORDSA-N 0 0 381.841 3.305 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000046738195 564506532 /nfs/dbraw/zinc/50/65/32/564506532.db2.gz ZNJFDHHHNDGKDI-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN COCCN(C1CCCC1)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000046800665 564508045 /nfs/dbraw/zinc/50/80/45/564508045.db2.gz SGWMRXITIOBNRP-UHFFFAOYSA-N 0 0 376.862 3.136 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccccc1Br ZINC000046801116 564508111 /nfs/dbraw/zinc/50/81/11/564508111.db2.gz ILVIKPARXUVKEO-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN O=[N+]([O-])c1cccc(OCCSc2nnnn2-c2ccc(Cl)cc2)c1 ZINC000046875630 564508956 /nfs/dbraw/zinc/50/89/56/564508956.db2.gz UVFOGQKGXWKUCN-UHFFFAOYSA-N 0 0 377.813 3.395 20 5 GGBDRN O=C(NCCCCNc1ccccn1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000125272861 564509060 /nfs/dbraw/zinc/50/90/60/564509060.db2.gz QDTZIMYVGGJVFI-UHFFFAOYSA-N 0 0 393.241 3.374 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@H](c3cc[nH]n3)C2)cc1[N+](=O)[O-] ZINC000125330269 564511078 /nfs/dbraw/zinc/51/10/78/564511078.db2.gz IUXUMEJRZPEQHO-NSHDSACASA-N 0 0 393.241 3.409 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@@H](c3cc[nH]n3)C2)cc1[N+](=O)[O-] ZINC000125330505 564511306 /nfs/dbraw/zinc/51/13/06/564511306.db2.gz IUXUMEJRZPEQHO-LLVKDONJSA-N 0 0 393.241 3.409 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCNc1ncc(Cl)cc1Cl ZINC000047163461 564514178 /nfs/dbraw/zinc/51/41/78/564514178.db2.gz OQYWFZHHEZOYDK-UHFFFAOYSA-N 0 0 385.207 3.147 20 5 GGBDRN O=C(CNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1ccc(Br)cc1 ZINC000047322977 564518316 /nfs/dbraw/zinc/51/83/16/564518316.db2.gz BTZRSNZNFFAHQP-UHFFFAOYSA-N 0 0 393.197 3.118 20 5 GGBDRN COc1ccc(Cn2nnc(-c3ccc(Br)cc3)n2)cc1[N+](=O)[O-] ZINC000047370017 564518759 /nfs/dbraw/zinc/51/87/59/564518759.db2.gz UXRKSOBEUHSXPF-UHFFFAOYSA-N 0 0 390.197 3.068 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cc(Cl)cc(Cl)c1 ZINC000047339835 564519097 /nfs/dbraw/zinc/51/90/97/564519097.db2.gz GQFDMEHXUWGYPD-UHFFFAOYSA-N 0 0 382.159 3.448 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1cc(Br)ccc1F ZINC000047368385 564519200 /nfs/dbraw/zinc/51/92/00/564519200.db2.gz GPADKDAVHBNXPR-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NCc2csc([N+](=O)[O-])c2)c1 ZINC000125603533 564519695 /nfs/dbraw/zinc/51/96/95/564519695.db2.gz XHSTYKBLLNBDLI-GFCCVEGCSA-N 0 0 383.495 3.486 20 5 GGBDRN COc1cc(C(=O)NCCSC(F)(F)F)c([N+](=O)[O-])cc1OC(F)F ZINC000047425529 564520659 /nfs/dbraw/zinc/52/06/59/564520659.db2.gz BCDBAJHOJJPMIG-UHFFFAOYSA-N 0 0 390.286 3.188 20 5 GGBDRN CN(Cc1ccc(F)c(F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000047543936 564522724 /nfs/dbraw/zinc/52/27/24/564522724.db2.gz ABFLPUJHAFACBB-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN CN(CCOc1ccccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000047543523 564522943 /nfs/dbraw/zinc/52/29/43/564522943.db2.gz OTFUVMZXDLRVSS-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN O=C(Cc1ccc(F)c(Br)c1)NCCc1cccc([N+](=O)[O-])c1 ZINC000125801408 564527293 /nfs/dbraw/zinc/52/72/93/564527293.db2.gz SSCCETRNERTLCU-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN O=c1c(Br)cn(Cc2nnc(-c3ccccc3)s2)cc1[N+](=O)[O-] ZINC000125836797 564529143 /nfs/dbraw/zinc/52/91/43/564529143.db2.gz MCQRBTJAMRGKSP-UHFFFAOYSA-N 0 0 393.222 3.086 20 5 GGBDRN O=C(Cc1cc(Br)ccc1F)NCCc1cccc([N+](=O)[O-])c1 ZINC000125831431 564529276 /nfs/dbraw/zinc/52/92/76/564529276.db2.gz LOOXSXNQNIZNNR-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1nnc(-c2ccccc2)s1 ZINC000125837024 564529383 /nfs/dbraw/zinc/52/93/83/564529383.db2.gz UPSOUVICVWBIQF-UHFFFAOYSA-N 0 0 393.222 3.086 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000048038630 564530602 /nfs/dbraw/zinc/53/06/02/564530602.db2.gz LBLWVTYJGGFPSL-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1nc(NC(=O)Cc2ccccc2I)ccc1[N+](=O)[O-] ZINC000125912045 564530927 /nfs/dbraw/zinc/53/09/27/564530927.db2.gz LDTGWMMPYQGUBK-UHFFFAOYSA-N 0 0 397.172 3.084 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)ccc1Br ZINC000048038679 564530942 /nfs/dbraw/zinc/53/09/42/564530942.db2.gz AMNGKCWUIKDANM-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN COc1ccc(Br)c(CC(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000126040347 564534844 /nfs/dbraw/zinc/53/48/44/564534844.db2.gz JSRMTIBCNXTDGW-UHFFFAOYSA-N 0 0 393.237 3.267 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1ccc(O)c(Br)c1 ZINC000126057866 564534963 /nfs/dbraw/zinc/53/49/63/564534963.db2.gz XICYFWKTCBYFNX-UHFFFAOYSA-N 0 0 394.225 3.105 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1COc2ccc(Br)cc21 ZINC000126041391 564535294 /nfs/dbraw/zinc/53/52/94/564535294.db2.gz ZMMKRPXTQDHJIA-HNNXBMFYSA-N 0 0 391.221 3.192 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NC1(c2ccc(Br)cc2)CC1 ZINC000048277622 564535428 /nfs/dbraw/zinc/53/54/28/564535428.db2.gz IAUCBOHGUAQUMA-UHFFFAOYSA-N 0 0 397.250 3.325 20 5 GGBDRN COC(=O)c1ccsc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000126072629 564535986 /nfs/dbraw/zinc/53/59/86/564535986.db2.gz BMHVTFWAGFMGAN-UHFFFAOYSA-N 0 0 399.222 3.387 20 5 GGBDRN O=C(COc1cccc(I)c1)c1ccc([N+](=O)[O-])cc1 ZINC000048403429 564539150 /nfs/dbraw/zinc/53/91/50/564539150.db2.gz DIUBPRRLIVOHLN-UHFFFAOYSA-N 0 0 383.141 3.461 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1sccc1Br ZINC000048444868 564540385 /nfs/dbraw/zinc/54/03/85/564540385.db2.gz GYYDWZBSZQLKHB-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(Br)s1)c1cccc([N+](=O)[O-])c1 ZINC000048445469 564540399 /nfs/dbraw/zinc/54/03/99/564540399.db2.gz BYRWYLDHBCDREG-QMMMGPOBSA-N 0 0 391.268 3.458 20 5 GGBDRN C[C@H](NS(=O)(=O)c1sccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000048445466 564540425 /nfs/dbraw/zinc/54/04/25/564540425.db2.gz SIGZYYHNEMSXAQ-QMMMGPOBSA-N 0 0 391.268 3.458 20 5 GGBDRN CCCN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000126212593 564540886 /nfs/dbraw/zinc/54/08/86/564540886.db2.gz SBKNPSQYJXLOLB-JTQLQIEISA-N 0 0 386.239 3.493 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(Cl)cc1Cl ZINC000048652749 564543554 /nfs/dbraw/zinc/54/35/54/564543554.db2.gz AMUYVHNDDFDFSK-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN COC(=O)c1cccc(C(=O)COc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000126288923 564544142 /nfs/dbraw/zinc/54/41/42/564544142.db2.gz UFGAPVYJJFVDPE-UHFFFAOYSA-N 0 0 394.177 3.406 20 5 GGBDRN Cc1c(CS(=O)(=O)CC(=O)Nc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000048717711 564544347 /nfs/dbraw/zinc/54/43/47/564544347.db2.gz SLIVKOKLGLRCSM-UHFFFAOYSA-N 0 0 382.825 3.110 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)Cc2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000126299957 564544791 /nfs/dbraw/zinc/54/47/91/564544791.db2.gz BDKOZHNZKJKYIV-UHFFFAOYSA-N 0 0 380.369 3.203 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000048791935 564545481 /nfs/dbraw/zinc/54/54/81/564545481.db2.gz YFXRVHWNUJFNJB-JTQLQIEISA-N 0 0 392.209 3.173 20 5 GGBDRN COC[C@@H](NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)c1ccco1 ZINC000126394703 564547476 /nfs/dbraw/zinc/54/74/76/564547476.db2.gz DMYVAPQAGHUTTD-GFCCVEGCSA-N 0 0 383.198 3.376 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)c(Br)c1 ZINC000126445147 564549639 /nfs/dbraw/zinc/54/96/39/564549639.db2.gz ZXLHEZGMIFKPCR-UHFFFAOYSA-N 0 0 388.609 3.029 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC000126567496 564553385 /nfs/dbraw/zinc/55/33/85/564553385.db2.gz QJYMZZOHWJKKDV-HNNXBMFYSA-N 0 0 382.825 3.010 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1ccc([N+](=O)[O-])cc1Br)CCO2 ZINC000126707494 564558695 /nfs/dbraw/zinc/55/86/95/564558695.db2.gz ZCDJBZUQHUILRA-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN COc1ccc(OCCSc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000050932205 564560650 /nfs/dbraw/zinc/56/06/50/564560650.db2.gz LTHHUABAZCJXKG-UHFFFAOYSA-N 0 0 383.447 3.178 20 5 GGBDRN CS(=O)(=O)Cc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1F ZINC000126742120 564560887 /nfs/dbraw/zinc/56/08/87/564560887.db2.gz POAXMMLLRYGVKE-UHFFFAOYSA-N 0 0 386.788 3.184 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@H](c2ccccc2Br)C1 ZINC000126754934 564560982 /nfs/dbraw/zinc/56/09/82/564560982.db2.gz KIZUGMGAZRSHGK-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@@H](c2ccccc2Br)C1 ZINC000126755193 564561161 /nfs/dbraw/zinc/56/11/61/564561161.db2.gz KIZUGMGAZRSHGK-CYBMUJFWSA-N 0 0 381.182 3.164 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cccc(OC(F)F)c2)c(Cl)c1 ZINC000051157309 564562049 /nfs/dbraw/zinc/56/20/49/564562049.db2.gz GIVNVOWBDYZSSQ-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN COC(=O)c1cccc(C(=O)COc2c(Br)cccc2[N+](=O)[O-])c1 ZINC000126941512 564568638 /nfs/dbraw/zinc/56/86/38/564568638.db2.gz WOHLQTWHBQIBJK-UHFFFAOYSA-N 0 0 394.177 3.406 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NCc1ccsc1 ZINC000052129347 564569074 /nfs/dbraw/zinc/56/90/74/564569074.db2.gz AVZDVOOGKZRDQC-UHFFFAOYSA-N 0 0 381.479 3.443 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000126979491 564569663 /nfs/dbraw/zinc/56/96/63/564569663.db2.gz CUNYECTUWROVBW-UHFFFAOYSA-N 0 0 389.271 3.230 20 5 GGBDRN O=C(c1cccc(Cl)c1Cl)N1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000052361848 564571164 /nfs/dbraw/zinc/57/11/64/564571164.db2.gz XTJJHBVDJMESML-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCc1cccc(Cl)c1Cl ZINC000052405877 564571415 /nfs/dbraw/zinc/57/14/15/564571415.db2.gz DMIIMHMLKMDMNQ-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN NS(=O)(=O)c1ccc(NCCc2cccc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000052405883 564571708 /nfs/dbraw/zinc/57/17/08/564571708.db2.gz JILIILUXJSUOAS-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1cc([N+](=O)[O-])ccc1Br)CCO2 ZINC000127053031 564572297 /nfs/dbraw/zinc/57/22/97/564572297.db2.gz SKPCJOPUNNXGPJ-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN O=C(COc1ccccc1Br)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000127113247 564573387 /nfs/dbraw/zinc/57/33/87/564573387.db2.gz NPVRAHDCJDQEGT-UHFFFAOYSA-N 0 0 391.181 3.251 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)cc1Br ZINC000127130853 564574349 /nfs/dbraw/zinc/57/43/49/564574349.db2.gz ATOLSFPNRKAFFH-UHFFFAOYSA-N 0 0 388.609 3.029 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)o1 ZINC000127177572 564575870 /nfs/dbraw/zinc/57/58/70/564575870.db2.gz YZXACMWRSXBEIA-GFCCVEGCSA-N 0 0 386.451 3.230 20 5 GGBDRN NC(=O)c1ccc(CN2CCc3cc(Br)ccc32)c([N+](=O)[O-])c1 ZINC000127253600 564578129 /nfs/dbraw/zinc/57/81/29/564578129.db2.gz QPRSOVBAOYMYLU-UHFFFAOYSA-N 0 0 376.210 3.019 20 5 GGBDRN C[C@H](Sc1nnc(N2CCCC2)s1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000052911647 564578594 /nfs/dbraw/zinc/57/85/94/564578594.db2.gz GEDJORVPQUYMHQ-JTQLQIEISA-N 0 0 379.467 3.166 20 5 GGBDRN C[C@@H](Oc1ccc(Br)cc1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053217080 564583117 /nfs/dbraw/zinc/58/31/17/564583117.db2.gz YVIAREIVSQGOKT-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN O=C(COc1cccc(Br)c1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053216193 564583164 /nfs/dbraw/zinc/58/31/64/564583164.db2.gz QRRYNJLPAVOANN-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN C[C@H](Oc1ccc(Br)cc1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053217078 564583204 /nfs/dbraw/zinc/58/32/04/564583204.db2.gz YVIAREIVSQGOKT-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN Cc1[nH]nc2ncc(NC(=O)c3cc(Br)cc([N+](=O)[O-])c3)cc12 ZINC000127458347 564584577 /nfs/dbraw/zinc/58/45/77/564584577.db2.gz HHCAISYGHNJHMX-UHFFFAOYSA-N 0 0 376.170 3.189 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCc1ccc(F)cc1Br ZINC000053327916 564585768 /nfs/dbraw/zinc/58/57/68/564585768.db2.gz NYHDTRNMOOLFIS-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN CNC(=O)c1ccc(NCCc2ccc(Br)s2)c([N+](=O)[O-])c1 ZINC000053555469 564590637 /nfs/dbraw/zinc/59/06/37/564590637.db2.gz 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ZINC000054131638 564599916 /nfs/dbraw/zinc/59/99/16/564599916.db2.gz WIKCBWANJYQNLP-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1ccc(Br)s1 ZINC000054647425 564607430 /nfs/dbraw/zinc/60/74/30/564607430.db2.gz MYUHTYAUNHQXRR-UHFFFAOYSA-N 0 0 384.255 3.461 20 5 GGBDRN O=C(c1c(Cl)cccc1Cl)N1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000054838612 564610693 /nfs/dbraw/zinc/61/06/93/564610693.db2.gz SOJFUTXQIYRMGE-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000054900127 564611979 /nfs/dbraw/zinc/61/19/79/564611979.db2.gz RYOITCUGTKCQID-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000054900355 564612102 /nfs/dbraw/zinc/61/21/02/564612102.db2.gz YTXODFYAHXFETE-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN O=C(Cn1cc(Br)c([N+](=O)[O-])n1)Nc1ccc(C(F)(F)F)cc1 ZINC000054919512 564612395 /nfs/dbraw/zinc/61/23/95/564612395.db2.gz QKPKAZBRZUGYCH-UHFFFAOYSA-N 0 0 393.119 3.211 20 5 GGBDRN CC(C)[C@H](CNC(=O)Cn1cc(Br)c([N+](=O)[O-])n1)c1ccccc1 ZINC000054917613 564612405 /nfs/dbraw/zinc/61/24/05/564612405.db2.gz YJPBUEVIKGAXSX-ZDUSSCGKSA-N 0 0 395.257 3.110 20 5 GGBDRN O=C(Cn1cc(Br)c([N+](=O)[O-])n1)Nc1c(Cl)cccc1Cl ZINC000054919604 564612618 /nfs/dbraw/zinc/61/26/18/564612618.db2.gz PKAWXDQZCYUPQO-UHFFFAOYSA-N 0 0 394.012 3.499 20 5 GGBDRN CC(=O)N(c1nc(Cn2cnc([N+](=O)[O-])n2)cs1)c1ccc(Cl)cc1 ZINC000054917174 564612642 /nfs/dbraw/zinc/61/26/42/564612642.db2.gz MAVKPOZKSCZLCB-UHFFFAOYSA-N 0 0 378.801 3.029 20 5 GGBDRN CC(C)(C)c1ccccc1NC(=O)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000054919650 564612775 /nfs/dbraw/zinc/61/27/75/564612775.db2.gz XKNZUBOHPPROIY-UHFFFAOYSA-N 0 0 381.230 3.490 20 5 GGBDRN CC(C)(C)N(Cc1ccccc1)C(=O)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000054919767 564612851 /nfs/dbraw/zinc/61/28/51/564612851.db2.gz RICKBHUDGIDJOV-UHFFFAOYSA-N 0 0 395.257 3.381 20 5 GGBDRN COc1ccc(-c2nc(Cn3cc(Br)c([N+](=O)[O-])n3)co2)cc1 ZINC000054919158 564612918 /nfs/dbraw/zinc/61/29/18/564612918.db2.gz GRRYHKZXXNWFRR-UHFFFAOYSA-N 0 0 379.170 3.266 20 5 GGBDRN Cc1ccc([C@H](NC(=O)Cn2cc(Br)c([N+](=O)[O-])n2)C2CC2)cc1 ZINC000054919140 564612974 /nfs/dbraw/zinc/61/29/74/564612974.db2.gz QCKOFKTXZIPNBE-HNNXBMFYSA-N 0 0 393.241 3.130 20 5 GGBDRN CN(CC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(Br)s1 ZINC000055012790 564613499 /nfs/dbraw/zinc/61/34/99/564613499.db2.gz LLEBLTUGUOKCCZ-UHFFFAOYSA-N 0 0 398.238 3.130 20 5 GGBDRN CCOC(=O)CC[C@@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000128326292 564615277 /nfs/dbraw/zinc/61/52/77/564615277.db2.gz HDERAKOLKOGDEB-NSHDSACASA-N 0 0 386.246 3.312 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccc(Br)c(C)n1 ZINC000128436974 564618492 /nfs/dbraw/zinc/61/84/92/564618492.db2.gz SSCZUHCINMNZPF-UHFFFAOYSA-N 0 0 395.213 3.391 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cc2c(c(Br)c1)OCO2 ZINC000055285442 564618832 /nfs/dbraw/zinc/61/88/32/564618832.db2.gz ADAQCNCCCIYXDE-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN Cc1cc(=O)n(CC[S@@](=O)c2cc(Cl)ccc2Cl)cc1[N+](=O)[O-] ZINC000128453597 564619260 /nfs/dbraw/zinc/61/92/60/564619260.db2.gz HHPNDJVGBUSLGI-QHCPKHFHSA-N 0 0 375.233 3.180 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000055446773 564621966 /nfs/dbraw/zinc/62/19/66/564621966.db2.gz KISGNRBQAGPCDZ-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(Br)ccc2OC(C)C)c1[N+](=O)[O-] ZINC000128601394 564622612 /nfs/dbraw/zinc/62/26/12/564622612.db2.gz BSSFAGMEJGVIPG-UHFFFAOYSA-N 0 0 397.229 3.439 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000128570737 564622757 /nfs/dbraw/zinc/62/27/57/564622757.db2.gz YKGMTMPEDCVGQY-UHFFFAOYSA-N 0 0 389.209 3.472 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccccc1Br ZINC000055546675 564623627 /nfs/dbraw/zinc/62/36/27/564623627.db2.gz VIUMJTNUWHSXKB-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN O=C(CNc1ccc(Br)cc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000055576638 564624442 /nfs/dbraw/zinc/62/44/42/564624442.db2.gz VZTKSSKNTZGPHR-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN Cc1cc(=O)n(CC(=O)N(C)Cc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] ZINC000128638507 564624941 /nfs/dbraw/zinc/62/49/41/564624941.db2.gz MTMCTHDLLZYTQR-UHFFFAOYSA-N 0 0 384.219 3.030 20 5 GGBDRN C[S@](=O)c1cccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000128657163 564624945 /nfs/dbraw/zinc/62/49/45/564624945.db2.gz VXEVEFFDVXBMEJ-JOCHJYFZSA-N 0 0 383.223 3.347 20 5 GGBDRN CN(C(=O)[C@@H]1COc2ccc(Br)cc21)c1cccc([N+](=O)[O-])c1 ZINC000128686728 564625710 /nfs/dbraw/zinc/62/57/10/564625710.db2.gz OVCSXMOYFWQBHF-CQSZACIVSA-N 0 0 377.194 3.496 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCc2c(Br)cccc2C1 ZINC000128691926 564626806 /nfs/dbraw/zinc/62/68/06/564626806.db2.gz KUYJSNDPCVFELQ-UHFFFAOYSA-N 0 0 375.222 3.485 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCc1ccc(F)c(Br)c1 ZINC000055865488 564633632 /nfs/dbraw/zinc/63/36/32/564633632.db2.gz MSPUCTKPDLCVRA-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](c1ccc(Br)cc1)C1CCC1 ZINC000055909235 564634125 /nfs/dbraw/zinc/63/41/25/564634125.db2.gz XSVVGUGRTXHPHG-MRXNPFEDSA-N 0 0 393.241 3.211 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000128968750 564634752 /nfs/dbraw/zinc/63/47/52/564634752.db2.gz WNOSZKCBTPRRFF-BZNIZROVSA-N 0 0 384.841 3.303 20 5 GGBDRN COc1cccc([C@H]2CCCN2c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000129106750 564637796 /nfs/dbraw/zinc/63/77/96/564637796.db2.gz PWNSZNCWQVOKHX-CYBMUJFWSA-N 0 0 382.463 3.410 20 5 GGBDRN CN(CCOc1ccc(Cl)cc1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000129079001 564638108 /nfs/dbraw/zinc/63/81/08/564638108.db2.gz QSDCKBKMQBKNGQ-UHFFFAOYSA-N 0 0 390.870 3.228 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC(c3ccc(O)cc3)CC2)s1 ZINC000129120242 564638566 /nfs/dbraw/zinc/63/85/66/564638566.db2.gz ZRSXNPXBWMLYPR-UHFFFAOYSA-N 0 0 382.463 3.149 20 5 GGBDRN CN(CCCOc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000056047510 564638506 /nfs/dbraw/zinc/63/85/06/564638506.db2.gz VROZFVDGSRMKQV-UHFFFAOYSA-N 0 0 384.841 3.338 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000056058245 564638561 /nfs/dbraw/zinc/63/85/61/564638561.db2.gz KILCXUIDQOQNKS-MRVPVSSYSA-N 0 0 398.238 3.176 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cc(Br)cs2)c(F)c1 ZINC000056094482 564641440 /nfs/dbraw/zinc/64/14/40/564641440.db2.gz QWOKNTCYPGFNHI-UHFFFAOYSA-N 0 0 395.231 3.036 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000056108802 564641499 /nfs/dbraw/zinc/64/14/99/564641499.db2.gz VVRXKFVMHGKZDT-SNVBAGLBSA-N 0 0 385.239 3.397 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1cc(Br)cs1 ZINC000056094504 564641564 /nfs/dbraw/zinc/64/15/64/564641564.db2.gz NLWAGVSVJTTXIJ-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000129283042 564644636 /nfs/dbraw/zinc/64/46/36/564644636.db2.gz IVEZMXBFXLJLMP-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN O=C([C@H]1COc2ccc(Br)cc21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000129403552 564647249 /nfs/dbraw/zinc/64/72/49/564647249.db2.gz FGVVSJXNZCOMHR-AWEZNQCLSA-N 0 0 389.205 3.423 20 5 GGBDRN Cc1cnc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c(Br)c1 ZINC000129461269 564649425 /nfs/dbraw/zinc/64/94/25/564649425.db2.gz QBOUXANSBVSAGA-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN Cc1ccn(CC[S@](=O)c2cc(Cl)ccc2Cl)c(=O)c1[N+](=O)[O-] ZINC000129592540 564653443 /nfs/dbraw/zinc/65/34/43/564653443.db2.gz JQXZUTOSJNAYJG-HSZRJFAPSA-N 0 0 375.233 3.180 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCCNc2ccccn2)cc1[N+](=O)[O-] ZINC000129752785 564659170 /nfs/dbraw/zinc/65/91/70/564659170.db2.gz VWEDCJUFDRWNDM-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000057084635 564659788 /nfs/dbraw/zinc/65/97/88/564659788.db2.gz KQPSZCMLMSRPRJ-INIZCTEOSA-N 0 0 376.825 3.412 20 5 GGBDRN Cc1nn(C)c(NC[C@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000057151232 564662766 /nfs/dbraw/zinc/66/27/66/564662766.db2.gz FSSBCVJDGUDZSQ-GFCCVEGCSA-N 0 0 394.273 3.338 20 5 GGBDRN Cc1ccn(CC(=O)N[C@H](C)c2ccc(Cl)cc2Cl)c(=O)c1[N+](=O)[O-] ZINC000129842370 564663122 /nfs/dbraw/zinc/66/31/22/564663122.db2.gz DJFZWMXJIFSKBX-SNVBAGLBSA-N 0 0 384.219 3.249 20 5 GGBDRN Cc1ccn(CC(=O)N[C@@H](C)c2ccc(Cl)c(Cl)c2)c(=O)c1[N+](=O)[O-] ZINC000129896794 564663865 /nfs/dbraw/zinc/66/38/65/564663865.db2.gz DKFADXPMJSYJNM-JTQLQIEISA-N 0 0 384.219 3.249 20 5 GGBDRN CN(CCOc1cccc(Cl)c1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000129879341 564663974 /nfs/dbraw/zinc/66/39/74/564663974.db2.gz JUBZEMRSKXMXJD-UHFFFAOYSA-N 0 0 384.841 3.089 20 5 GGBDRN O=C(NCCOc1cccc(Br)c1)NCc1ccccc1[N+](=O)[O-] ZINC000057364672 564665898 /nfs/dbraw/zinc/66/58/98/564665898.db2.gz TYWIJSTUOGXAGY-UHFFFAOYSA-N 0 0 394.225 3.236 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000057424701 564667707 /nfs/dbraw/zinc/66/77/07/564667707.db2.gz WGMANDDFNFMUJO-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN CC(C)(C)c1nc(CCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC000130116906 564669575 /nfs/dbraw/zinc/66/95/75/564669575.db2.gz UKDQGSPWSIZTQP-UHFFFAOYSA-N 0 0 383.495 3.011 20 5 GGBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2I)sn1 ZINC000130100634 564669609 /nfs/dbraw/zinc/66/96/09/564669609.db2.gz GXDHOUGTVFIQLL-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN CN(Cc1ccc(Cl)s1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000057670873 564670728 /nfs/dbraw/zinc/67/07/28/564670728.db2.gz HMYIHVLPQFWOGJ-UHFFFAOYSA-N 0 0 377.813 3.163 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000057785390 564674086 /nfs/dbraw/zinc/67/40/86/564674086.db2.gz MDXSUKKXDJFOOD-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN Cc1noc(C)c1C[C@@H](C)NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000130245557 564674490 /nfs/dbraw/zinc/67/44/90/564674490.db2.gz ULPMTIMBOIYPDU-MRVPVSSYSA-N 0 0 382.214 3.323 20 5 GGBDRN O=[N+]([O-])c1sccc1NCC1CCN(S(=O)(=O)c2ccccc2)CC1 ZINC000057856505 564676736 /nfs/dbraw/zinc/67/67/36/564676736.db2.gz VZTLMDNXUKISND-UHFFFAOYSA-N 0 0 381.479 3.169 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CSc2nnc(-c3cccs3)o2)c1 ZINC000058012287 564677906 /nfs/dbraw/zinc/67/79/06/564677906.db2.gz HMQFCKZOVFYRKX-NSHDSACASA-N 0 0 379.419 3.238 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc32)ccc1Br ZINC000058492955 564684312 /nfs/dbraw/zinc/68/43/12/564684312.db2.gz RTASCUBXDMKRRH-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CC(=O)c1ccc(N[C@H](C(N)=O)c2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000058554076 564685032 /nfs/dbraw/zinc/68/50/32/564685032.db2.gz CJXWIOOOEPIAFA-HNNXBMFYSA-N 0 0 392.209 3.198 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)Cn2nnc3cc(Cl)c(Cl)cc32)c1 ZINC000130608631 564686872 /nfs/dbraw/zinc/68/68/72/564686872.db2.gz NYSBMYVYODKRLJ-JTQLQIEISA-N 0 0 383.191 3.086 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2CCSc3c(F)cccc32)cc1 ZINC000130766690 564691326 /nfs/dbraw/zinc/69/13/26/564691326.db2.gz JSZVEBJEKKPSHD-OAHLLOKOSA-N 0 0 382.438 3.390 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000130766319 564691976 /nfs/dbraw/zinc/69/19/76/564691976.db2.gz AYPAJBMPDIWCGK-DOMZBBRYSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000130784640 564692418 /nfs/dbraw/zinc/69/24/18/564692418.db2.gz KCYCRCGMZSGKBR-LRDDRELGSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000130800937 564692584 /nfs/dbraw/zinc/69/25/84/564692584.db2.gz YBXIAKAJBQUCPI-WFASDCNBSA-N 0 0 382.463 3.115 20 5 GGBDRN O=C(Nc1ccc(Br)cn1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000059251023 564692772 /nfs/dbraw/zinc/69/27/72/564692772.db2.gz CXHMVMBTWNLOJP-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COc1ccc(Br)cc1C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000059400192 564693828 /nfs/dbraw/zinc/69/38/28/564693828.db2.gz QNEQANUVSVYPGL-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN Cc1ncc(CS(=O)(=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000130825992 564693894 /nfs/dbraw/zinc/69/38/94/564693894.db2.gz GOZIGCWOUMWOMK-UHFFFAOYSA-N 0 0 379.419 3.130 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCOc1cccc(Br)c1 ZINC000059851669 564693939 /nfs/dbraw/zinc/69/39/39/564693939.db2.gz UXXCTHGZHNFAGE-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cc(Br)c1=O)c1ccc(F)c(Cl)c1 ZINC000130860440 564694934 /nfs/dbraw/zinc/69/49/34/564694934.db2.gz DRTBCHRMYKRBTF-UHFFFAOYSA-N 0 0 389.564 3.194 20 5 GGBDRN O=C(NC[C@H](O)COc1cccc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000060084222 564695015 /nfs/dbraw/zinc/69/50/15/564695015.db2.gz YXKCHOKUMUHILC-LBPRGKRZSA-N 0 0 385.203 3.071 20 5 GGBDRN CN(C)CCN(c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000130936089 564696996 /nfs/dbraw/zinc/69/69/96/564696996.db2.gz QVYZJSSIKWYNCY-UHFFFAOYSA-N 0 0 383.857 3.005 20 5 GGBDRN Cc1nn(CCC(=O)NCCc2cc(Cl)cc(Cl)c2)c(C)c1[N+](=O)[O-] ZINC000060365164 564697753 /nfs/dbraw/zinc/69/77/53/564697753.db2.gz FBPSQRPZPLWMLX-UHFFFAOYSA-N 0 0 385.251 3.464 20 5 GGBDRN Cc1cc(C)c(C(=O)Cn2cc([N+](=O)[O-])cc(Br)c2=O)c(C)c1 ZINC000130976139 564697874 /nfs/dbraw/zinc/69/78/74/564697874.db2.gz UIDCCPLUGLLVOQ-UHFFFAOYSA-N 0 0 379.210 3.327 20 5 GGBDRN COCCN(Cc1cccs1)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000060441790 564698311 /nfs/dbraw/zinc/69/83/11/564698311.db2.gz KTVIDWKUBQHURA-UHFFFAOYSA-N 0 0 384.479 3.110 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2csc(C(C)C)n2)cc1[N+](=O)[O-] ZINC000060429418 564698474 /nfs/dbraw/zinc/69/84/74/564698474.db2.gz USWXQLDWJQYBNF-UHFFFAOYSA-N 0 0 384.483 3.037 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cc(Cl)c(Cl)cc1Cl ZINC000131064531 564699647 /nfs/dbraw/zinc/69/96/47/564699647.db2.gz NASHRIBDQYJJDK-UHFFFAOYSA-N 0 0 376.583 3.355 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1cc(F)ccc1Br ZINC000060815635 564701850 /nfs/dbraw/zinc/70/18/50/564701850.db2.gz XNIXUBLWPXCBMT-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@H]1c1cccc(Br)c1 ZINC000131247385 564706391 /nfs/dbraw/zinc/70/63/91/564706391.db2.gz BHSJWCLUVVRKKQ-INIZCTEOSA-N 0 0 392.253 3.356 20 5 GGBDRN CN(Cc1ccc(Cl)s1)C(=O)CN1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000131472121 564712702 /nfs/dbraw/zinc/71/27/02/564712702.db2.gz QQHMFKTVJBKXKT-UHFFFAOYSA-N 0 0 379.869 3.326 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OCc1nnnn1-c1ccccc1Br ZINC000131488395 564713628 /nfs/dbraw/zinc/71/36/28/564713628.db2.gz XJXAMOOJPSUODG-UHFFFAOYSA-N 0 0 390.197 3.220 20 5 GGBDRN CS(=O)(=O)c1ccc(Sc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000063131708 564713896 /nfs/dbraw/zinc/71/38/96/564713896.db2.gz YWABOXBKNGVQFR-UHFFFAOYSA-N 0 0 389.252 3.307 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc([N+](=O)[O-])s1 ZINC000131513244 564714378 /nfs/dbraw/zinc/71/43/78/564714378.db2.gz LAGUQYZDJDHMLZ-NSHDSACASA-N 0 0 379.825 3.235 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000131539415 564714813 /nfs/dbraw/zinc/71/48/13/564714813.db2.gz YZPYMNNCSBXEPH-JOCHJYFZSA-N 0 0 383.223 3.347 20 5 GGBDRN CCc1nc(CN(C)S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cs1 ZINC000063199496 564715112 /nfs/dbraw/zinc/71/51/12/564715112.db2.gz RMQKJFQHLVQPEM-UHFFFAOYSA-N 0 0 389.886 3.396 20 5 GGBDRN CCO[C@H]1CCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000063249121 564715128 /nfs/dbraw/zinc/71/51/28/564715128.db2.gz KYBNEBOTYUAKTR-NSHDSACASA-N 0 0 376.194 3.205 20 5 GGBDRN O=[N+]([O-])c1sccc1NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000063256405 564715984 /nfs/dbraw/zinc/71/59/84/564715984.db2.gz VZEACBMCJTXQEP-UHFFFAOYSA-N 0 0 381.479 3.443 20 5 GGBDRN CC(=O)Nc1cc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)ccc1Cl ZINC000063444008 564717658 /nfs/dbraw/zinc/71/76/58/564717658.db2.gz VJCHNPLSTSTBDR-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN CC(=O)Nc1cc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)ccc1Cl ZINC000063444011 564717994 /nfs/dbraw/zinc/71/79/94/564717994.db2.gz SJNJISXQYJPBKV-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000131639463 564718491 /nfs/dbraw/zinc/71/84/91/564718491.db2.gz JJGDJIUAMMKKST-UHFFFAOYSA-N 0 0 393.193 3.358 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC([C@@H](O)C(F)(F)F)CC2)c1 ZINC000131671474 564719511 /nfs/dbraw/zinc/71/95/11/564719511.db2.gz VKARIHULJKIXCY-CYBMUJFWSA-N 0 0 378.372 3.092 20 5 GGBDRN O=C(NCc1cc2c(c(Br)c1)OCO2)c1csc([N+](=O)[O-])c1 ZINC000063714454 564720448 /nfs/dbraw/zinc/72/04/48/564720448.db2.gz NEBQUGAVBCDNAT-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000131701278 564721103 /nfs/dbraw/zinc/72/11/03/564721103.db2.gz SLJJCJVFXFXDTO-ZYHUDNBSSA-N 0 0 385.873 3.319 20 5 GGBDRN O=C(NCc1cc2c(c(Br)c1)OCO2)c1ccccc1[N+](=O)[O-] ZINC000063715699 564721331 /nfs/dbraw/zinc/72/13/31/564721331.db2.gz NNKMYTSWFMBLLD-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN O=C(NCc1cc2c(c(Br)c1)OCO2)c1ccc([N+](=O)[O-])cc1 ZINC000063715868 564721956 /nfs/dbraw/zinc/72/19/56/564721956.db2.gz SUQFUTNOSIYJPX-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN COC(=O)c1sccc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000131722499 564722341 /nfs/dbraw/zinc/72/23/41/564722341.db2.gz VIDVLVODTMJMLO-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000063849219 564723618 /nfs/dbraw/zinc/72/36/18/564723618.db2.gz NYDNMANSOLUWHP-AWEZNQCLSA-N 0 0 393.193 3.001 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000131817968 564724891 /nfs/dbraw/zinc/72/48/91/564724891.db2.gz PBJONQHCMFPZOQ-NSHDSACASA-N 0 0 387.223 3.041 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)s1 ZINC000064114989 564726078 /nfs/dbraw/zinc/72/60/78/564726078.db2.gz PWCDGVHKTMFJMU-UHFFFAOYSA-N 0 0 377.857 3.280 20 5 GGBDRN C[C@@H](Nc1c([N+](=O)[O-])ncn1C)c1cc2c(cc1Br)OCCO2 ZINC000064029963 564726327 /nfs/dbraw/zinc/72/63/27/564726327.db2.gz NAFSKPVDDLUFCA-MRVPVSSYSA-N 0 0 383.202 3.035 20 5 GGBDRN O=C(Nc1cccc(C(=O)N2CCSCC2)c1)c1ccc([N+](=O)[O-])s1 ZINC000064431924 564730253 /nfs/dbraw/zinc/73/02/53/564730253.db2.gz VWFXKVKGZCVZBA-UHFFFAOYSA-N 0 0 377.447 3.098 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000064511099 564731509 /nfs/dbraw/zinc/73/15/09/564731509.db2.gz DWJATNOPPICMAT-UHFFFAOYSA-N 0 0 398.188 3.017 20 5 GGBDRN CSc1ccc(Cl)cc1NC(=O)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000064578831 564732937 /nfs/dbraw/zinc/73/29/37/564732937.db2.gz VATBTUQKWODCIJ-UHFFFAOYSA-N 0 0 379.825 3.225 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2I)CC[C@@H]1C ZINC000132258854 564737546 /nfs/dbraw/zinc/73/75/46/564737546.db2.gz MXZYNUYCXQWLPX-UWVGGRQHSA-N 0 0 388.205 3.318 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc(C2CC2)c1Br)c1cccc([N+](=O)[O-])c1 ZINC000065108267 564740423 /nfs/dbraw/zinc/74/04/23/564740423.db2.gz KMDRZMTYPQULAS-QMMMGPOBSA-N 0 0 379.214 3.449 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1OC(F)(F)F ZINC000132350364 564740502 /nfs/dbraw/zinc/74/05/02/564740502.db2.gz ICFBWNUSUDMOEN-UHFFFAOYSA-N 0 0 376.312 3.319 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N(CCO)C3CC3)cc2[N+](=O)[O-])n1 ZINC000132471390 564744778 /nfs/dbraw/zinc/74/47/78/564744778.db2.gz UPZGIMPIHQFTCD-UHFFFAOYSA-N 0 0 379.463 3.108 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCc1cc(Br)ccc1F ZINC000065568586 564744833 /nfs/dbraw/zinc/74/48/33/564744833.db2.gz ANIKMFIMJVCINF-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCc1cc(Br)ccc1F ZINC000065567023 564744995 /nfs/dbraw/zinc/74/49/95/564744995.db2.gz PQOOGPNQMVPGOJ-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1nc2ccccc2s1 ZINC000065685035 564747639 /nfs/dbraw/zinc/74/76/39/564747639.db2.gz PMYHTEQWOGBBHK-UHFFFAOYSA-N 0 0 377.447 3.245 20 5 GGBDRN O=C(Nc1cc(-c2cccnc2)[nH]n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000132644418 564748767 /nfs/dbraw/zinc/74/87/67/564748767.db2.gz JTNQNVMPWJKXBT-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCCN2S(=O)(=O)c1cccc2c1N=S=N2 ZINC000132628860 564748774 /nfs/dbraw/zinc/74/87/74/564748774.db2.gz 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564751082 /nfs/dbraw/zinc/75/10/82/564751082.db2.gz WMVOEHRSCOGAJD-UHFFFAOYSA-N 0 0 387.621 3.260 20 5 GGBDRN C[C@@H](O)C[C@@H](C)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000132759154 564751702 /nfs/dbraw/zinc/75/17/02/564751702.db2.gz ZTEQKJUFKOARIJ-HTQZYQBOSA-N 0 0 379.638 3.148 20 5 GGBDRN C[C@@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl)C[C@H](C)O ZINC000132759548 564751750 /nfs/dbraw/zinc/75/17/50/564751750.db2.gz ZTEQKJUFKOARIJ-SFYZADRCSA-N 0 0 379.638 3.148 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCc2cc(Br)ccc21 ZINC000065899137 564751728 /nfs/dbraw/zinc/75/17/28/564751728.db2.gz BDZKCNUBUZDFET-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN O=c1c(Br)cn(Cc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] ZINC000132824056 564753613 /nfs/dbraw/zinc/75/36/13/564753613.db2.gz RCHLJFWTOKFWFI-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN Cc1cc(C)c(C(=O)Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)cc1C ZINC000132805421 564753953 /nfs/dbraw/zinc/75/39/53/564753953.db2.gz BTNOAEHAUJLULJ-UHFFFAOYSA-N 0 0 379.210 3.327 20 5 GGBDRN 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O=C(Cc1ccccc1Br)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068186056 564811275 /nfs/dbraw/zinc/81/12/75/564811275.db2.gz WOWCUDKCTSKUTK-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCOC3(CCCCC3)C2)c(Cl)c1 ZINC000134671504 564811923 /nfs/dbraw/zinc/81/19/23/564811923.db2.gz JPWHQZACAKLJDC-GFCCVEGCSA-N 0 0 388.873 3.408 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cc(Br)c1=O)c1ccc(Cl)s1 ZINC000135053918 564822949 /nfs/dbraw/zinc/82/29/49/564822949.db2.gz WUJBRLBWDBJRPD-UHFFFAOYSA-N 0 0 377.603 3.117 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)Cc2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-] ZINC000135057338 564823216 /nfs/dbraw/zinc/82/32/16/564823216.db2.gz QRHGRIXGQFZBPP-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000135200026 564825105 /nfs/dbraw/zinc/82/51/05/564825105.db2.gz GAIBIJHVGZBUHP-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1ncccc1Br ZINC000135237078 564826011 /nfs/dbraw/zinc/82/60/11/564826011.db2.gz FYSCDXGMPIGUNO-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN CC(C)CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000068827110 564827091 /nfs/dbraw/zinc/82/70/91/564827091.db2.gz HHKMNGHHZOXVPJ-RYUDHWBXSA-N 0 0 385.511 3.112 20 5 GGBDRN CC(C)CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000068827116 564827473 /nfs/dbraw/zinc/82/74/73/564827473.db2.gz HHKMNGHHZOXVPJ-VXGBXAGGSA-N 0 0 385.511 3.112 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCc3cc(Br)ccc32)cc1 ZINC000068902026 564828375 /nfs/dbraw/zinc/82/83/75/564828375.db2.gz DQSQMMDYVWCNAS-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000068950582 564830647 /nfs/dbraw/zinc/83/06/47/564830647.db2.gz MMGBNPIQSXHTOV-UHFFFAOYSA-N 0 0 387.820 3.250 20 5 GGBDRN CNS(=O)(=O)c1ccc(-c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)cc1 ZINC000069162436 564834500 /nfs/dbraw/zinc/83/45/00/564834500.db2.gz IAGPWUGZWNHGHO-UHFFFAOYSA-N 0 0 375.431 3.293 20 5 GGBDRN O=C(NO[C@H]1CCCCO1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000136012926 564844156 /nfs/dbraw/zinc/84/41/56/564844156.db2.gz UJXYIJKLRVPVCP-JTQLQIEISA-N 0 0 379.594 3.199 20 5 GGBDRN O=C(NCCc1cccc(Cl)c1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136129025 564845852 /nfs/dbraw/zinc/84/58/52/564845852.db2.gz CDHVNSUUHCIEOA-UHFFFAOYSA-N 0 0 380.853 3.305 20 5 GGBDRN Cc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1NS(C)(=O)=O ZINC000136664032 564853655 /nfs/dbraw/zinc/85/36/55/564853655.db2.gz VSFISPNMEKBNKE-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN O=C(Cc1cc(Br)ccc1F)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000136862331 564855290 /nfs/dbraw/zinc/85/52/90/564855290.db2.gz HBOQVAPBASSGOG-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(Cl)nc1 ZINC000136832752 564855404 /nfs/dbraw/zinc/85/54/04/564855404.db2.gz XCBVQOPJITUOMV-UHFFFAOYSA-N 0 0 381.841 3.312 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccc(Br)s1 ZINC000071322652 564855872 /nfs/dbraw/zinc/85/58/72/564855872.db2.gz QGDIVCGXKQMRFK-UHFFFAOYSA-N 0 0 391.268 3.038 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1cc(Br)cs1 ZINC000071322388 564856053 /nfs/dbraw/zinc/85/60/53/564856053.db2.gz AVKHATRHYNKHEJ-UHFFFAOYSA-N 0 0 391.268 3.038 20 5 GGBDRN Cc1cc(Br)cn2cc(CNC(=O)c3ccc([N+](=O)[O-])cc3)nc12 ZINC000071446714 564856300 /nfs/dbraw/zinc/85/63/00/564856300.db2.gz VLUIUJOQURBSSX-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCCO)c1nc(C)cs1 ZINC000136947063 564856617 /nfs/dbraw/zinc/85/66/17/564856617.db2.gz QJXHYALHXAILJW-CYBMUJFWSA-N 0 0 381.479 3.325 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2ccc(S(=O)(=O)N3CCCC3)o2)c(Cl)c1 ZINC000071907089 564858645 /nfs/dbraw/zinc/85/86/45/564858645.db2.gz HCRQVYMBRMQKFL-UHFFFAOYSA-N 0 0 386.813 3.205 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)s1 ZINC000137176304 564859568 /nfs/dbraw/zinc/85/95/68/564859568.db2.gz UDUNVCYKBSIRKY-NSHDSACASA-N 0 0 380.491 3.410 20 5 GGBDRN Cc1ccc(C[C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)s1 ZINC000137176272 564859588 /nfs/dbraw/zinc/85/95/88/564859588.db2.gz UDUNVCYKBSIRKY-LLVKDONJSA-N 0 0 380.491 3.410 20 5 GGBDRN COc1c(C(=O)Nc2cccc(I)c2)cccc1[N+](=O)[O-] ZINC000137552234 564863096 /nfs/dbraw/zinc/86/30/96/564863096.db2.gz LIIAEFRTNOEAGP-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1NS(C)(=O)=O ZINC000138487646 564866762 /nfs/dbraw/zinc/86/67/62/564866762.db2.gz LCWKMUCOGFOGQG-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN CCOc1ncccc1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000084802907 564868790 /nfs/dbraw/zinc/86/87/90/564868790.db2.gz XMINVANSUOBXOI-UHFFFAOYSA-N 0 0 380.198 3.081 20 5 GGBDRN Cc1noc(C2CCN(Cc3ccc(Br)c([N+](=O)[O-])c3)CC2)n1 ZINC000091834676 564872668 /nfs/dbraw/zinc/87/26/68/564872668.db2.gz QVXQEFKHABXWKL-UHFFFAOYSA-N 0 0 381.230 3.428 20 5 GGBDRN CC(C)(CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccncc1 ZINC000091863307 564872932 /nfs/dbraw/zinc/87/29/32/564872932.db2.gz AOKPQDJCGLURJR-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN CC(C)(CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccncc1 ZINC000091865284 564874302 /nfs/dbraw/zinc/87/43/02/564874302.db2.gz QVTZRUPWPNCDFV-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000142996831 564876052 /nfs/dbraw/zinc/87/60/52/564876052.db2.gz FEBIZNKDBVJUHP-ZDUSSCGKSA-N 0 0 380.857 3.497 20 5 GGBDRN O=C(NC[C@H](O)COc1cccc(Cl)c1Cl)c1csc([N+](=O)[O-])c1 ZINC000143863344 564877900 /nfs/dbraw/zinc/87/79/00/564877900.db2.gz RZZXPVHIZHLYOI-VIFPVBQESA-N 0 0 391.232 3.133 20 5 GGBDRN CC(C)C(=O)NC[C@@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000092706133 564880589 /nfs/dbraw/zinc/88/05/89/564880589.db2.gz MHXMBNNPTCKHGG-AWEZNQCLSA-N 0 0 398.301 3.342 20 5 GGBDRN COc1ccc(CCCNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000146174270 564880987 /nfs/dbraw/zinc/88/09/87/564880987.db2.gz HOXDXZDEJFUIQP-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(Br)ccc2F)c1 ZINC000146699402 564881807 /nfs/dbraw/zinc/88/18/07/564881807.db2.gz KXKJWYZFIDZMFT-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000146878831 564881987 /nfs/dbraw/zinc/88/19/87/564881987.db2.gz KCRCWWJAGGDEOS-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCCOC1CCCCC1 ZINC000146577051 564882101 /nfs/dbraw/zinc/88/21/01/564882101.db2.gz BJOQWAIXZQIAQZ-UHFFFAOYSA-N 0 0 376.862 3.266 20 5 GGBDRN CCc1nn(C)c(NC[C@@H](O)COc2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000092829175 564882307 /nfs/dbraw/zinc/88/23/07/564882307.db2.gz FSZCMLNXDPFFJR-SECBINFHSA-N 0 0 389.239 3.049 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(F)cc2Br)c1 ZINC000147698127 564882816 /nfs/dbraw/zinc/88/28/16/564882816.db2.gz GEMYKURCRHDSON-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1Nc1cccc(CN2CCOCC2)c1 ZINC000147098806 564883119 /nfs/dbraw/zinc/88/31/19/564883119.db2.gz CMJDAIJSJQZIND-UHFFFAOYSA-N 0 0 393.241 3.328 20 5 GGBDRN C[C@H](CS(C)(=O)=O)N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093384220 564886096 /nfs/dbraw/zinc/88/60/96/564886096.db2.gz OFGKTDHASQNTRV-LLVKDONJSA-N 0 0 386.857 3.373 20 5 GGBDRN C[C@@H](CS(C)(=O)=O)N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093384219 564886527 /nfs/dbraw/zinc/88/65/27/564886527.db2.gz OFGKTDHASQNTRV-NSHDSACASA-N 0 0 386.857 3.373 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2)sc1Br ZINC000150129702 564887075 /nfs/dbraw/zinc/88/70/75/564887075.db2.gz XDYRVKHTQDSOJZ-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN COCc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000150717404 564887738 /nfs/dbraw/zinc/88/77/38/564887738.db2.gz ZCCSTHLMONDPEL-UHFFFAOYSA-N 0 0 379.210 3.434 20 5 GGBDRN C[C@H]1[C@H](C)S(=O)(=O)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000093559408 564888375 /nfs/dbraw/zinc/88/83/75/564888375.db2.gz MJFUZWKOOGDPIY-STQMWFEESA-N 0 0 380.491 3.331 20 5 GGBDRN O=C1CCCCN1C1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000093741539 564889032 /nfs/dbraw/zinc/88/90/32/564889032.db2.gz XTBHISWXBOMBRB-UHFFFAOYSA-N 0 0 396.285 3.334 20 5 GGBDRN O=C(Nc1ccc2oc(=O)[nH]c2c1)c1ccc([N+](=O)[O-])cc1Br ZINC000150748307 564889073 /nfs/dbraw/zinc/88/90/73/564889073.db2.gz PIPLBANQIVWYGL-UHFFFAOYSA-N 0 0 378.138 3.044 20 5 GGBDRN CN(Cc1cc([O-])ccc1[N+](=O)[O-])[C@H](CO)c1cccc(Br)c1 ZINC000093815434 564890364 /nfs/dbraw/zinc/89/03/64/564890364.db2.gz UWJZMSNSYWBAGF-MRXNPFEDSA-N 0 0 381.226 3.228 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)Cc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000150773360 564890417 /nfs/dbraw/zinc/89/04/17/564890417.db2.gz RAOCPJODMSDYMN-UHFFFAOYSA-N 0 0 376.843 3.139 20 5 GGBDRN COc1cc(S(=O)(=O)NC2(c3cccc(Cl)c3)CC2)ccc1[N+](=O)[O-] ZINC000150818854 564891851 /nfs/dbraw/zinc/89/18/51/564891851.db2.gz HUHJQTNAMWJOHH-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN COc1cc(S(=O)(=O)NC2(c3ccc(Cl)cc3)CC2)ccc1[N+](=O)[O-] ZINC000150813866 564892271 /nfs/dbraw/zinc/89/22/71/564892271.db2.gz QCMQOFOVZAWCDA-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN O=C(Nc1nnc(C(F)F)s1)c1ccc([N+](=O)[O-])cc1Br ZINC000150900286 564896479 /nfs/dbraw/zinc/89/64/79/564896479.db2.gz ABXXYDZCFBTHSD-UHFFFAOYSA-N 0 0 379.142 3.399 20 5 GGBDRN COc1cc(F)cc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000094097426 564896552 /nfs/dbraw/zinc/89/65/52/564896552.db2.gz NPMWWHKTXQYOCN-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1NC[C@@H](O)COc1ccccc1Br ZINC000150919857 564897458 /nfs/dbraw/zinc/89/74/58/564897458.db2.gz GSGTZIXWWRGTFB-SNVBAGLBSA-N 0 0 385.189 3.348 20 5 GGBDRN CCCOc1ncccc1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000150919516 564897586 /nfs/dbraw/zinc/89/75/86/564897586.db2.gz NSHBQFDQGXOTLG-UHFFFAOYSA-N 0 0 394.225 3.471 20 5 GGBDRN CCc1nn(C)c(N2CCO[C@@H](c3ccccc3Br)C2)c1[N+](=O)[O-] ZINC000094153192 564897977 /nfs/dbraw/zinc/89/79/77/564897977.db2.gz VKPRYORKWZDVHL-CQSZACIVSA-N 0 0 395.257 3.231 20 5 GGBDRN CCc1nn(C)c(NCc2cc(Br)c(OC)c(OC)c2)c1[N+](=O)[O-] ZINC000094152612 564897984 /nfs/dbraw/zinc/89/79/84/564897984.db2.gz XWPGMDDNWMLZKG-UHFFFAOYSA-N 0 0 399.245 3.283 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1ncc(-c2ccccc2Br)o1 ZINC000150948415 564898238 /nfs/dbraw/zinc/89/82/38/564898238.db2.gz WOHRVXCDYIKGLI-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000150948846 564899190 /nfs/dbraw/zinc/89/91/90/564899190.db2.gz DNZYOFJCUVFNLB-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC=C(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000095441211 564899353 /nfs/dbraw/zinc/89/93/53/564899353.db2.gz PPTASFTYADDRHD-UHFFFAOYSA-N 0 0 384.763 3.440 20 5 GGBDRN CSc1ccc(C(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1[N+](=O)[O-] ZINC000150969647 564899789 /nfs/dbraw/zinc/89/97/89/564899789.db2.gz MHPFICAJMHBPCT-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN O=c1n(CCCNc2c(Cl)cc([N+](=O)[O-])cc2Cl)nc2n1CCCC2 ZINC000095997096 564899998 /nfs/dbraw/zinc/89/99/98/564899998.db2.gz IJXNZRAFMUIIOG-UHFFFAOYSA-N 0 0 386.239 3.098 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2cc(Cl)c3c(c2)OCCCO3)cc1 ZINC000095948639 564900277 /nfs/dbraw/zinc/90/02/77/564900277.db2.gz RCDDJZDLGWSMOW-UHFFFAOYSA-N 0 0 383.809 3.383 20 5 GGBDRN COC(=O)c1cccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1C ZINC000096013507 564901181 /nfs/dbraw/zinc/90/11/81/564901181.db2.gz KLDLQCDEJURPGE-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cnn(C)c3)cs2)c1 ZINC000151013950 564901905 /nfs/dbraw/zinc/90/19/05/564901905.db2.gz KCMATQONMXHUCF-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCN(c2ccc(F)cc2)CC1 ZINC000096573027 564902353 /nfs/dbraw/zinc/90/23/53/564902353.db2.gz LHGWMOISNNJELA-UHFFFAOYSA-N 0 0 381.205 3.218 20 5 GGBDRN Cc1ccc(C(N)=O)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000151019189 564902872 /nfs/dbraw/zinc/90/28/72/564902872.db2.gz GZXQVBXUBHVPJA-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN O=C(COc1ccc(Br)cc1[N+](=O)[O-])NCc1ccc(F)cc1 ZINC000151151832 564906933 /nfs/dbraw/zinc/90/69/33/564906933.db2.gz CQMLFFXOHMYJCY-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN Cn1c(C2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)n[nH]c1=S ZINC000097552707 564908354 /nfs/dbraw/zinc/90/83/54/564908354.db2.gz OMICMSMUMPYQAY-UHFFFAOYSA-N 0 0 381.845 3.059 20 5 GGBDRN Cc1ccsc1CNC(=O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000151156556 564908397 /nfs/dbraw/zinc/90/83/97/564908397.db2.gz PNTVOEPPEOQITL-UHFFFAOYSA-N 0 0 385.239 3.422 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCC[C@@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000098100440 564912210 /nfs/dbraw/zinc/91/22/10/564912210.db2.gz GFGSXFUBMRBWPJ-CYBMUJFWSA-N 0 0 393.241 3.377 20 5 GGBDRN Cc1nn(C)c(C(=O)NC2(c3cccc(Br)c3)CCC2)c1[N+](=O)[O-] ZINC000098102574 564913020 /nfs/dbraw/zinc/91/30/20/564913020.db2.gz RBGKBMPQYWVGMS-UHFFFAOYSA-N 0 0 393.241 3.208 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@H](C)CCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000098102357 564913281 /nfs/dbraw/zinc/91/32/81/564913281.db2.gz YMDYZTOSAHFCAY-SNVBAGLBSA-N 0 0 395.257 3.150 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H](C)CCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000098102356 564913332 /nfs/dbraw/zinc/91/33/32/564913332.db2.gz YMDYZTOSAHFCAY-JTQLQIEISA-N 0 0 395.257 3.150 20 5 GGBDRN CS(=O)(=O)Cc1cc(F)ccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000151355988 564916100 /nfs/dbraw/zinc/91/61/00/564916100.db2.gz VAZLQRNSUAGMOV-UHFFFAOYSA-N 0 0 386.788 3.184 20 5 GGBDRN Cc1nc(CCNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])sc1C ZINC000151360986 564916314 /nfs/dbraw/zinc/91/63/14/564916314.db2.gz ZRCGDYYEEOBIGM-SNVBAGLBSA-N 0 0 383.857 3.448 20 5 GGBDRN COc1ccc(CNC(=O)CNc2ccccc2[N+](=O)[O-])cc1Br ZINC000101533236 564916326 /nfs/dbraw/zinc/91/63/26/564916326.db2.gz JSOYILSZOVXLLC-UHFFFAOYSA-N 0 0 394.225 3.094 20 5 GGBDRN O=C(Nc1ccn(CC(F)F)n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000151387329 564917734 /nfs/dbraw/zinc/91/77/34/564917734.db2.gz KMXWMNXFISRKPU-UHFFFAOYSA-N 0 0 375.129 3.071 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1C(N)=O ZINC000151400761 564917959 /nfs/dbraw/zinc/91/79/59/564917959.db2.gz XKBZROAMOKQVEL-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN O=[N+]([O-])c1ccc(CCCCNS(=O)(=O)Cc2ccc(Cl)nc2)cc1 ZINC000151412360 564919064 /nfs/dbraw/zinc/91/90/64/564919064.db2.gz SYOPACPKEDTPTH-UHFFFAOYSA-N 0 0 383.857 3.086 20 5 GGBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2I)ccn1 ZINC000101630926 564919349 /nfs/dbraw/zinc/91/93/49/564919349.db2.gz OLZQHSMRPNZJOP-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN CCOc1cc(Br)ccc1NC(=O)c1c([N+](=O)[O-])c(C)nn1C ZINC000151453043 564920435 /nfs/dbraw/zinc/92/04/35/564920435.db2.gz IRGQJJGJALFEMA-UHFFFAOYSA-N 0 0 383.202 3.050 20 5 GGBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1cc(Br)cn1C ZINC000151494394 564922456 /nfs/dbraw/zinc/92/24/56/564922456.db2.gz KSSFNPCNCKVCNO-LLVKDONJSA-N 0 0 395.257 3.155 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCc2nc(C)c(C)s2)cc1SC ZINC000151500976 564923419 /nfs/dbraw/zinc/92/34/19/564923419.db2.gz DPGAFNBGPWJULX-UHFFFAOYSA-N 0 0 381.479 3.371 20 5 GGBDRN CN(Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cc(Br)cn1C ZINC000151514935 564924376 /nfs/dbraw/zinc/92/43/76/564924376.db2.gz AINUXKPGEASFEI-UHFFFAOYSA-N 0 0 379.214 3.469 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)N1CCSc2ccccc21 ZINC000102202617 564926802 /nfs/dbraw/zinc/92/68/02/564926802.db2.gz KALALCOPIHLQBH-UHFFFAOYSA-N 0 0 397.254 3.001 20 5 GGBDRN CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)c1ccc(Br)cn1 ZINC000102254730 564927432 /nfs/dbraw/zinc/92/74/32/564927432.db2.gz XIWJQKRLNBLWMJ-UHFFFAOYSA-N 0 0 380.198 3.428 20 5 GGBDRN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)Oc1ccccc1 ZINC000151581941 564928334 /nfs/dbraw/zinc/92/83/34/564928334.db2.gz RXIMVEKJDIMDFK-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)Cc1cc(Br)cn1C ZINC000151585614 564928374 /nfs/dbraw/zinc/92/83/74/564928374.db2.gz YUEIFJPETUUTRM-NSHDSACASA-N 0 0 395.257 3.155 20 5 GGBDRN CCOC[C@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000151584477 564928393 /nfs/dbraw/zinc/92/83/93/564928393.db2.gz IZRSWQZSLXIAMQ-LBPRGKRZSA-N 0 0 385.258 3.175 20 5 GGBDRN CC(C)c1nc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000102412789 564929388 /nfs/dbraw/zinc/92/93/88/564929388.db2.gz WSFPMPAACYGZPG-UHFFFAOYSA-N 0 0 389.886 3.349 20 5 GGBDRN Cc1nc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)sc1C ZINC000151658336 564931857 /nfs/dbraw/zinc/93/18/57/564931857.db2.gz BPWJLCFCZNYTDV-UHFFFAOYSA-N 0 0 398.282 3.332 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2c3ccccc3C[C@H]2O)cc1[N+](=O)[O-] ZINC000151741008 564934840 /nfs/dbraw/zinc/93/48/40/564934840.db2.gz JNMYUXUHHJOEPG-HZPDHXFCSA-N 0 0 391.221 3.054 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000151797054 564936442 /nfs/dbraw/zinc/93/64/42/564936442.db2.gz MAWDDWYPCLKJOM-GLQYFDAESA-N 0 0 395.253 3.353 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@H]1O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000151876749 564940205 /nfs/dbraw/zinc/94/02/05/564940205.db2.gz WKSLTLWVEFDGQY-MWLCHTKSSA-N 0 0 377.622 3.044 20 5 GGBDRN CCn1c(SCCCS(C)(=O)=O)nc2cc3ccccc3cc2c1=O ZINC000102971913 564940490 /nfs/dbraw/zinc/94/04/90/564940490.db2.gz FLDHAGRBTVBNFX-UHFFFAOYSA-N 0 0 376.503 3.096 20 5 GGBDRN COC[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000151924828 564941060 /nfs/dbraw/zinc/94/10/60/564941060.db2.gz VZDBRJHXPAUTJQ-LLVKDONJSA-N 0 0 378.372 3.247 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000103036787 564941243 /nfs/dbraw/zinc/94/12/43/564941243.db2.gz NGOUGLDBEMKLEM-CQSZACIVSA-N 0 0 390.237 3.366 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1cnn(CC(F)F)c1 ZINC000151990587 564942940 /nfs/dbraw/zinc/94/29/40/564942940.db2.gz DCZFCSIIPBCWON-UHFFFAOYSA-N 0 0 389.156 3.000 20 5 GGBDRN O=C(CNc1cc([N+](=O)[O-])ccc1Sc1cccs1)N1CCOCC1 ZINC000151994958 564943045 /nfs/dbraw/zinc/94/30/45/564943045.db2.gz BPZYRMIFSLSRBI-UHFFFAOYSA-N 0 0 379.463 3.078 20 5 GGBDRN O=C(N[C@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cc([N+](=O)[O-])ccc1Br ZINC000152024404 564943876 /nfs/dbraw/zinc/94/38/76/564943876.db2.gz QBNKGNPFQLCLOR-CQDKDKBSSA-N 0 0 395.253 3.435 20 5 GGBDRN O=C(N[C@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cc([N+](=O)[O-])ccc1Br ZINC000152024549 564944168 /nfs/dbraw/zinc/94/41/68/564944168.db2.gz QBNKGNPFQLCLOR-UGFHNGPFSA-N 0 0 395.253 3.435 20 5 GGBDRN CN(C1CCC(CO)CC1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000152024294 564944256 /nfs/dbraw/zinc/94/42/56/564944256.db2.gz OQWAKMVEWAYKNB-UHFFFAOYSA-N 0 0 397.280 3.073 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000152084286 564946729 /nfs/dbraw/zinc/94/67/29/564946729.db2.gz HIOSTQYUOHDSAK-QMMMGPOBSA-N 0 0 382.214 3.496 20 5 GGBDRN C[C@@]1(c2ccc(Cl)s2)NC(=O)N(Cc2c(F)cccc2[N+](=O)[O-])C1=O ZINC000103463118 564949036 /nfs/dbraw/zinc/94/90/36/564949036.db2.gz DBXISQAZIQJRIS-HNNXBMFYSA-N 0 0 383.788 3.416 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cncc(Br)c1 ZINC000103931118 564952035 /nfs/dbraw/zinc/95/20/35/564952035.db2.gz CHCRMIVYRSIECD-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc(Br)o1 ZINC000103931094 564952042 /nfs/dbraw/zinc/95/20/42/564952042.db2.gz VMNRYVXEMMOIOS-UHFFFAOYSA-N 0 0 377.154 3.388 20 5 GGBDRN O=c1c(Cl)c(NC[C@H]2CSCCS2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000152265109 564952869 /nfs/dbraw/zinc/95/28/69/564952869.db2.gz SCWZCSYBLRDBNF-LBPRGKRZSA-N 0 0 398.897 3.055 20 5 GGBDRN O=[N+]([O-])c1nn(C[C@@H](O)COc2cccc3ccccc32)cc1Br ZINC000152291311 564953657 /nfs/dbraw/zinc/95/36/57/564953657.db2.gz RJWITYUYRVOONB-GFCCVEGCSA-N 0 0 392.209 3.147 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)CC(=O)c2cccs2)c1C ZINC000152303226 564954677 /nfs/dbraw/zinc/95/46/77/564954677.db2.gz GPYXJMAHEYIKIE-NSHDSACASA-N 0 0 382.463 3.213 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2cccc(N(C)C)n2)cc1[N+](=O)[O-] ZINC000152333378 564955399 /nfs/dbraw/zinc/95/53/99/564955399.db2.gz UREGXMZNPNAOSN-UHFFFAOYSA-N 0 0 393.241 3.057 20 5 GGBDRN Cn1c(Sc2ncc([N+](=O)[O-])cc2Br)nnc1-c1ccccn1 ZINC000152376759 564956848 /nfs/dbraw/zinc/95/68/48/564956848.db2.gz QUISAFNLLLPFNF-UHFFFAOYSA-N 0 0 393.226 3.094 20 5 GGBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000152411288 564957674 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O=[N+]([O-])c1cnn(C[C@@H](O)COc2ccc3cc(Br)ccc3c2)c1 ZINC000152853134 564974533 /nfs/dbraw/zinc/97/45/33/564974533.db2.gz BCJNKGJUYZKIJZ-OAHLLOKOSA-N 0 0 392.209 3.147 20 5 GGBDRN CN(CCOc1cccc(Cl)c1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000105936972 564974605 /nfs/dbraw/zinc/97/46/05/564974605.db2.gz MWLZFGSQFUKREE-UHFFFAOYSA-N 0 0 384.841 3.089 20 5 GGBDRN COC(=O)c1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000152908430 564976112 /nfs/dbraw/zinc/97/61/12/564976112.db2.gz PSGCALOATYTUPY-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN CCC(=O)c1cc(Cl)cc(Cl)c1OC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000152963977 564978684 /nfs/dbraw/zinc/97/86/84/564978684.db2.gz DHJRPQUCNCRBQX-NSHDSACASA-N 0 0 388.207 3.131 20 5 GGBDRN CCC(=O)c1cc(Cl)cc(Cl)c1OC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000152963860 564979003 /nfs/dbraw/zinc/97/90/03/564979003.db2.gz DHJRPQUCNCRBQX-LLVKDONJSA-N 0 0 388.207 3.131 20 5 GGBDRN C[C@](CO)(NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CCCCC1 ZINC000152978131 564979955 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CCS(=O)(=O)C[C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000113350361 565069332 /nfs/dbraw/zinc/06/93/32/565069332.db2.gz IMZOTMWPULYLEC-LLVKDONJSA-N 0 0 386.857 3.421 20 5 GGBDRN CN(Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155579506 565069353 /nfs/dbraw/zinc/06/93/53/565069353.db2.gz UIXOMJDNWCXUJO-HNNXBMFYSA-N 0 0 384.816 3.348 20 5 GGBDRN CCS(=O)(=O)C[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000113350363 565069430 /nfs/dbraw/zinc/06/94/30/565069430.db2.gz IMZOTMWPULYLEC-NSHDSACASA-N 0 0 386.857 3.421 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C)Oc3ncccc32)cc1[N+](=O)[O-] ZINC000155593151 565069520 /nfs/dbraw/zinc/06/95/20/565069520.db2.gz NTKZQJIPFSNLON-SECBINFHSA-N 0 0 392.209 3.488 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3ccncc3)no2)c(I)c1 ZINC000113738452 565070970 /nfs/dbraw/zinc/07/09/70/565070970.db2.gz AHKAIMXIDUMPGJ-UHFFFAOYSA-N 0 0 394.128 3.311 20 5 GGBDRN Cc1nn(Cc2nc(-c3ccc(Br)s3)no2)c(C)c1[N+](=O)[O-] ZINC000114058867 565072115 /nfs/dbraw/zinc/07/21/15/565072115.db2.gz MVLQABIMNKUZOS-UHFFFAOYSA-N 0 0 384.215 3.330 20 5 GGBDRN O=[N+]([O-])c1ncccc1OCc1nc(-c2ccc(Br)s2)no1 ZINC000114217983 565072791 /nfs/dbraw/zinc/07/27/91/565072791.db2.gz SQQUYAIKMLVPOM-UHFFFAOYSA-N 0 0 383.183 3.443 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1cc([N+](=O)[O-])ccc1Br ZINC000156078510 565074847 /nfs/dbraw/zinc/07/48/47/565074847.db2.gz GSIPAGIKXZTSOD-GDLCADMTSA-N 0 0 381.226 3.045 20 5 GGBDRN CC(C)(CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cccs1 ZINC000114614594 565075073 /nfs/dbraw/zinc/07/50/73/565075073.db2.gz MLPSORXBONBYBJ-UHFFFAOYSA-N 0 0 381.841 3.342 20 5 GGBDRN O=C(Nc1cncc(Br)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000156100755 565075106 /nfs/dbraw/zinc/07/51/06/565075106.db2.gz IPYKPVYJZHFRBR-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CSc1nsc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000156209852 565075833 /nfs/dbraw/zinc/07/58/33/565075833.db2.gz FPSIVACLVDQBBN-UHFFFAOYSA-N 0 0 389.256 3.491 20 5 GGBDRN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1nccs1 ZINC000183547026 565078474 /nfs/dbraw/zinc/07/84/74/565078474.db2.gz NWEXNZSHIXBMAI-SECBINFHSA-N 0 0 384.255 3.276 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000183575195 565079791 /nfs/dbraw/zinc/07/97/91/565079791.db2.gz PVNYMIFKCBQCLJ-AWEZNQCLSA-N 0 0 378.841 3.156 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@]12CCCO2 ZINC000291883340 565084019 /nfs/dbraw/zinc/08/40/19/565084019.db2.gz WEAQBJKHWQMGHH-ZENOOKHLSA-N 0 0 389.235 3.358 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1cccc(Br)c1 ZINC000183644287 565084538 /nfs/dbraw/zinc/08/45/38/565084538.db2.gz VGHAOPXPLQHJTH-AWEZNQCLSA-N 0 0 391.225 3.312 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000183653580 565085126 /nfs/dbraw/zinc/08/51/26/565085126.db2.gz UAWWEPFURALOSW-GFCCVEGCSA-N 0 0 383.495 3.233 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Br)c(Cl)c1Cl ZINC000183636418 565085161 /nfs/dbraw/zinc/08/51/61/565085161.db2.gz ZJAFKTFEBRTHCJ-UHFFFAOYSA-N 0 0 394.012 3.499 20 5 GGBDRN Cc1sc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1CS(C)(=O)=O ZINC000156404587 565085621 /nfs/dbraw/zinc/08/56/21/565085621.db2.gz YNPTWXNKCTVLKO-UHFFFAOYSA-N 0 0 382.463 3.378 20 5 GGBDRN CSC[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000291966130 565088580 /nfs/dbraw/zinc/08/85/80/565088580.db2.gz PZJWSRQCAIAKHY-SNVBAGLBSA-N 0 0 398.428 3.377 20 5 GGBDRN CN(CC(F)(F)Br)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000291986797 565089491 /nfs/dbraw/zinc/08/94/91/565089491.db2.gz SMUZZWIRFGUJSZ-UHFFFAOYSA-N 0 0 392.200 3.255 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)[C@@H]2CCCO[C@H]21 ZINC000369431660 565092901 /nfs/dbraw/zinc/09/29/01/565092901.db2.gz BFMGKAFEUQXYPS-ZLKJLUDKSA-N 0 0 383.242 3.291 20 5 GGBDRN C[C@H](NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(=O)N1CCCC[C@@H]1C ZINC000292035266 565093446 /nfs/dbraw/zinc/09/34/46/565093446.db2.gz XEOBLIQTJBAXET-UWVGGRQHSA-N 0 0 388.251 3.421 20 5 GGBDRN O=C(Cc1cccc(Br)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156554796 565093809 /nfs/dbraw/zinc/09/38/09/565093809.db2.gz DIXAXNGARSBRCZ-UHFFFAOYSA-N 0 0 375.222 3.485 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(C2CC2)s1 ZINC000266854622 565094137 /nfs/dbraw/zinc/09/41/37/565094137.db2.gz SPAMXKYAOPXYEQ-MRVPVSSYSA-N 0 0 380.451 3.452 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(C2CC2)s1 ZINC000266854624 565094395 /nfs/dbraw/zinc/09/43/95/565094395.db2.gz SPAMXKYAOPXYEQ-QMMMGPOBSA-N 0 0 380.451 3.452 20 5 GGBDRN O=C(NCC1(CCO)CCCCC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000156584392 565096496 /nfs/dbraw/zinc/09/64/96/565096496.db2.gz RQXCIWMKJLSVHC-UHFFFAOYSA-N 0 0 385.258 3.420 20 5 GGBDRN Cc1nc2sccn2c1CN(C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000266973713 565098121 /nfs/dbraw/zinc/09/81/21/565098121.db2.gz MUULFXFHZFVPOO-UHFFFAOYSA-N 0 0 376.463 3.363 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC(c2cn[nH]c2)CC1 ZINC000369552758 565099103 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383.235 3.326 20 5 GGBDRN COc1cc(C)c(Br)cc1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000183952136 565105974 /nfs/dbraw/zinc/10/59/74/565105974.db2.gz DBJOSQWZVXRKIK-UHFFFAOYSA-N 0 0 397.229 3.208 20 5 GGBDRN C[C@@H](c1cccnc1)N1CCN(c2ncc([N+](=O)[O-])cc2Br)CC1 ZINC000267205930 565109632 /nfs/dbraw/zinc/10/96/32/565109632.db2.gz GREQPUIDMMRMRF-LBPRGKRZSA-N 0 0 392.257 3.031 20 5 GGBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCC[C@H]1[C@@H](O)C(F)(F)F ZINC000292349575 565111338 /nfs/dbraw/zinc/11/13/38/565111338.db2.gz YEHZSIKKXLQEAC-GXSJLCMTSA-N 0 0 387.141 3.429 20 5 GGBDRN CCc1nccn1[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000267272369 565112524 /nfs/dbraw/zinc/11/25/24/565112524.db2.gz SOVBIFBNFIKCDU-NSHDSACASA-N 0 0 380.246 3.353 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@](C)(O)C3)cc2[N+](=O)[O-])n1 ZINC000267292152 565112923 /nfs/dbraw/zinc/11/29/23/565112923.db2.gz ZBQDZTZWKFAJGD-MRXNPFEDSA-N 0 0 379.463 3.108 20 5 GGBDRN Cn1ccnc1[C@](O)(CCNc1c(Cl)cccc1[N+](=O)[O-])C(F)(F)F ZINC000292441740 565116594 /nfs/dbraw/zinc/11/65/94/565116594.db2.gz HPHALKMTGPRVMP-CYBMUJFWSA-N 0 0 378.738 3.234 20 5 GGBDRN Cn1nccc1C1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000267462641 565117909 /nfs/dbraw/zinc/11/79/09/565117909.db2.gz KLDBRNHSMHPCLK-UHFFFAOYSA-N 0 0 393.241 3.111 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCOC2)CC1 ZINC000369908544 565117901 /nfs/dbraw/zinc/11/79/01/565117901.db2.gz MYVSPZUWIGDPBR-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@H]1CCSc2c(F)cccc21 ZINC000184196896 565119117 /nfs/dbraw/zinc/11/91/17/565119117.db2.gz PYJMYOXIZUZQPB-AWEZNQCLSA-N 0 0 382.438 3.390 20 5 GGBDRN O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1ccc(Br)cc1[N+](=O)[O-] ZINC000267483275 565119416 /nfs/dbraw/zinc/11/94/16/565119416.db2.gz KHRAEIGGOBOJGB-ZDUSSCGKSA-N 0 0 392.209 3.265 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000184236797 565121259 /nfs/dbraw/zinc/12/12/59/565121259.db2.gz KUTALCRFULTFDB-HNNXBMFYSA-N 0 0 382.825 3.010 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000184237704 565121321 /nfs/dbraw/zinc/12/13/21/565121321.db2.gz ZYIAMGFRVHNWRD-INIZCTEOSA-N 0 0 382.825 3.010 20 5 GGBDRN O=C(Nc1nc2ccc(Cl)cn2n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000157173348 565121486 /nfs/dbraw/zinc/12/14/86/565121486.db2.gz DDOYTSPHKNNSGF-UHFFFAOYSA-N 0 0 396.588 3.306 20 5 GGBDRN CCC(=O)c1cccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000184251239 565122218 /nfs/dbraw/zinc/12/22/18/565122218.db2.gz JINWCUVYTGYSBY-UHFFFAOYSA-N 0 0 382.825 3.319 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2cccc3ncccc32)c(Cl)c1 ZINC000184250479 565122536 /nfs/dbraw/zinc/12/25/36/565122536.db2.gz KZAJDAGCWBIOIZ-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN O=[N+]([O-])c1cc(Cn2cc(CCO)c(C(F)(F)F)n2)ccc1Br ZINC000292644460 565126898 /nfs/dbraw/zinc/12/68/98/565126898.db2.gz GCPWLYIVXOTJEU-UHFFFAOYSA-N 0 0 394.147 3.156 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC(CO)(c3ccccc3)CC2)c(Br)c1 ZINC000292676064 565127438 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CC(C)C[C@H](CCO)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268645844 565161769 /nfs/dbraw/zinc/16/17/69/565161769.db2.gz PDUVUYHKNSMKEC-JTQLQIEISA-N 0 0 391.237 3.271 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000184889059 565163540 /nfs/dbraw/zinc/16/35/40/565163540.db2.gz CAHWRBHDROBWKI-QMMMGPOBSA-N 0 0 382.214 3.496 20 5 GGBDRN CN(C(=O)c1cc(Br)c2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000158303926 565165226 /nfs/dbraw/zinc/16/52/26/565165226.db2.gz ZRZCUFNEXGQKIE-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN Cc1cc(C(=O)Cn2cc(Br)cc([N+](=O)[O-])c2=O)cc(C)c1F ZINC000158338521 565166243 /nfs/dbraw/zinc/16/62/43/565166243.db2.gz NZMRNBXSDMONLP-UHFFFAOYSA-N 0 0 383.173 3.158 20 5 GGBDRN O=C(NC[C@H]1OCCc2ccccc21)c1cc([N+](=O)[O-])ccc1Br ZINC000370906254 565166280 /nfs/dbraw/zinc/16/62/80/565166280.db2.gz UUIPYUGGEHTPKG-MRXNPFEDSA-N 0 0 391.221 3.401 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2cc(F)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000158349069 565167438 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GGBDRN CC1(C)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H]2CCCO[C@@H]21 ZINC000371070998 565176233 /nfs/dbraw/zinc/17/62/33/565176233.db2.gz YOPVYSMCHDNXBX-BNOWGMLFSA-N 0 0 383.242 3.291 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H]2CCCO[C@@H]21 ZINC000371071001 565176734 /nfs/dbraw/zinc/17/67/34/565176734.db2.gz YOPVYSMCHDNXBX-YUTCNCBUSA-N 0 0 383.242 3.291 20 5 GGBDRN CCCCCN(CCO)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000158680797 565177192 /nfs/dbraw/zinc/17/71/92/565177192.db2.gz VULOFVRBPUFBAE-UHFFFAOYSA-N 0 0 385.269 3.075 20 5 GGBDRN CC(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])c1 ZINC000158663485 565177607 /nfs/dbraw/zinc/17/76/07/565177607.db2.gz JUKULWUECQJZMC-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000158665487 565178014 /nfs/dbraw/zinc/17/80/14/565178014.db2.gz ISIXDACRZBGYII-JTQLQIEISA-N 0 0 384.219 3.283 20 5 GGBDRN NS(=O)(=O)c1ccc(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)s1 ZINC000185105759 565178110 /nfs/dbraw/zinc/17/81/10/565178110.db2.gz DFYZYUKYEXUEAP-UHFFFAOYSA-N 0 0 382.250 3.223 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)c2cccnc2O1 ZINC000158702949 565178526 /nfs/dbraw/zinc/17/85/26/565178526.db2.gz CYDHHGUSFPZQGC-SECBINFHSA-N 0 0 378.182 3.180 20 5 GGBDRN O=[N+]([O-])c1ccc(SCc2ccc(S(=O)(=O)N3CCCC3)o2)c(F)c1 ZINC000185147331 565180790 /nfs/dbraw/zinc/18/07/90/565180790.db2.gz GHLKYDZDAVHMRY-UHFFFAOYSA-N 0 0 386.426 3.404 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1COc2ccc(Br)cc21 ZINC000158780530 565181380 /nfs/dbraw/zinc/18/13/80/565181380.db2.gz MRNGDOGNGCTJBU-HNNXBMFYSA-N 0 0 391.221 3.192 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CC[C@H](O)C12CCCC2 ZINC000293778342 565183985 /nfs/dbraw/zinc/18/39/85/565183985.db2.gz AEKANXZLELIQNO-LBPRGKRZSA-N 0 0 387.205 3.016 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000269282807 565184375 /nfs/dbraw/zinc/18/43/75/565184375.db2.gz BAZANOJCIOSNHV-SNVBAGLBSA-N 0 0 379.214 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/nfs/dbraw/zinc/18/85/04/565188504.db2.gz GNFLYZJVUUKFFE-CQSZACIVSA-N 0 0 383.242 3.185 20 5 GGBDRN COc1cccc(NCCNC(=O)c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000185227132 565188706 /nfs/dbraw/zinc/18/87/06/565188706.db2.gz YJAUQUUJZHQAHY-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN CN(CCNC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccccc1 ZINC000159042818 565191957 /nfs/dbraw/zinc/19/19/57/565191957.db2.gz SDVDONXEBZHMJR-UHFFFAOYSA-N 0 0 378.226 3.224 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000294005307 565194318 /nfs/dbraw/zinc/19/43/18/565194318.db2.gz DHQMLUIYHBNOJG-HNNXBMFYSA-N 0 0 395.253 3.389 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1Cc2cccc(Br)c2C1 ZINC000185298025 565194645 /nfs/dbraw/zinc/19/46/45/565194645.db2.gz HMDHHRQXQLMFAS-UHFFFAOYSA-N 0 0 397.250 3.370 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCC[C@H]2c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000371463441 565194844 /nfs/dbraw/zinc/19/48/44/565194844.db2.gz XEXCSTHYEBDSSN-ZDUSSCGKSA-N 0 0 393.241 3.377 20 5 GGBDRN O=C(NCC1(CCO)CCCCC1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000269590718 565195543 /nfs/dbraw/zinc/19/55/43/565195543.db2.gz MRVYOXGWKGXHGI-UHFFFAOYSA-N 0 0 385.258 3.420 20 5 GGBDRN Cc1n[nH]c(C(=O)NCC(C)(C)c2ccccc2Br)c1[N+](=O)[O-] ZINC000269654241 565196989 /nfs/dbraw/zinc/19/69/89/565196989.db2.gz HDAWDNRQCNAUAL-UHFFFAOYSA-N 0 0 381.230 3.096 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1nnc(C2CCOCC2)s1 ZINC000294082715 565197288 /nfs/dbraw/zinc/19/72/88/565197288.db2.gz IJXIFXKTLLHFFM-UHFFFAOYSA-N 0 0 380.451 3.071 20 5 GGBDRN C[C@@H](Cc1cccs1)NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185444106 565201755 /nfs/dbraw/zinc/20/17/55/565201755.db2.gz MKYHLMNOHLRSTL-NSHDSACASA-N 0 0 377.447 3.114 20 5 GGBDRN CCS(=O)(=O)C1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000294183163 565201939 /nfs/dbraw/zinc/20/19/39/565201939.db2.gz QPMWSGSUBFZYMP-UHFFFAOYSA-N 0 0 380.388 3.013 20 5 GGBDRN CC1(C)CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCS1(=O)=O ZINC000294179444 565202297 /nfs/dbraw/zinc/20/22/97/565202297.db2.gz QJYXGJUYQBFNQQ-UHFFFAOYSA-N 0 0 380.388 3.013 20 5 GGBDRN CC[C@@H](Cc1ccccc1Br)N(C)C(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000185455403 565203248 /nfs/dbraw/zinc/20/32/48/565203248.db2.gz SJIGOHGWSWADGG-ZDUSSCGKSA-N 0 0 395.257 3.034 20 5 GGBDRN CC(C)[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCCO1 ZINC000294222538 565204268 /nfs/dbraw/zinc/20/42/68/565204268.db2.gz DDUTZCUMEAFSSB-CYBMUJFWSA-N 0 0 389.221 3.384 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)CC[C@@H]2CCOC2)c(-c2cccs2)c1 ZINC000294268086 565205240 /nfs/dbraw/zinc/20/52/40/565205240.db2.gz XEHXLFSOVCRZGH-LBPRGKRZSA-N 0 0 383.447 3.459 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@H](c3ncc[nH]3)C2)cc1[N+](=O)[O-] ZINC000270002760 565205492 /nfs/dbraw/zinc/20/54/92/565205492.db2.gz XGGABQGSBHPTCF-NSHDSACASA-N 0 0 393.241 3.409 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000270002553 565205623 /nfs/dbraw/zinc/20/56/23/565205623.db2.gz NYHWLQOAWMXMMV-MRVWCRGKSA-N 0 0 381.226 3.045 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCC(n2cccn2)CC1 ZINC000371695536 565205948 /nfs/dbraw/zinc/20/59/48/565205948.db2.gz XUQVNXAVQFDQPH-UHFFFAOYSA-N 0 0 380.857 3.401 20 5 GGBDRN CC(C)(CCC(=O)NC[C@@H]1CCN(c2ccc(Br)cc2)C1)[N+](=O)[O-] ZINC000294297353 565206257 /nfs/dbraw/zinc/20/62/57/565206257.db2.gz CHNJCIDOPRTXPZ-ZDUSSCGKSA-N 0 0 398.301 3.227 20 5 GGBDRN CCOC(=O)[C@H]1CCCc2sc(NC(=O)c3ccc([N+](=O)[O-])s3)nc21 ZINC000294315455 565207795 /nfs/dbraw/zinc/20/77/95/565207795.db2.gz VNVXJJCPAKATIY-QMMMGPOBSA-N 0 0 381.435 3.348 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCOC[C@H]1c1ccco1 ZINC000371773603 565209052 /nfs/dbraw/zinc/20/90/52/565209052.db2.gz SGRARQKVXWTKOO-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN COc1cccc(NC[C@@H](O)COc2ccccc2Br)c1[N+](=O)[O-] ZINC000185582300 565209761 /nfs/dbraw/zinc/20/97/61/565209761.db2.gz NVNBUFRWFUDJGI-LLVKDONJSA-N 0 0 397.225 3.218 20 5 GGBDRN CN(Cc1ccc(O)cc1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000159597479 565211469 /nfs/dbraw/zinc/21/14/69/565211469.db2.gz VABSRHJEALCHQA-UHFFFAOYSA-N 0 0 391.232 3.428 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC2(CCOCC2)[C@H]1C1CC1 ZINC000294436492 565212140 /nfs/dbraw/zinc/21/21/40/565212140.db2.gz ZFCHUJZOCIVYIN-OAHLLOKOSA-N 0 0 395.253 3.389 20 5 GGBDRN CS[C@H]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185654676 565213115 /nfs/dbraw/zinc/21/31/15/565213115.db2.gz BWLHNVNZXRYDGA-NEPJUHHUSA-N 0 0 381.479 3.096 20 5 GGBDRN CN(CCc1nccs1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000159630509 565213655 /nfs/dbraw/zinc/21/36/55/565213655.db2.gz XCZYVGATPWVGGL-UHFFFAOYSA-N 0 0 396.277 3.221 20 5 GGBDRN CS[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185654656 565213728 /nfs/dbraw/zinc/21/37/28/565213728.db2.gz BWLHNVNZXRYDGA-VXGBXAGGSA-N 0 0 381.479 3.096 20 5 GGBDRN CC1(C)CCC[C@@]1(O)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000294515014 565215231 /nfs/dbraw/zinc/21/52/31/565215231.db2.gz UCNLBBIGDWHNHV-OAHLLOKOSA-N 0 0 389.221 3.167 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccncc1Br ZINC000159685489 565215520 /nfs/dbraw/zinc/21/55/20/565215520.db2.gz SCTFMFBMRGXDKY-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN COc1ccc(OC[C@@H](O)COc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000185689238 565215733 /nfs/dbraw/zinc/21/57/33/565215733.db2.gz MECJCYZTFDKEHD-LLVKDONJSA-N 0 0 398.209 3.185 20 5 GGBDRN CC(C)CC(=O)N1CCC(Nc2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000270343170 565215965 /nfs/dbraw/zinc/21/59/65/565215965.db2.gz FLMKTGMLSUYURF-UHFFFAOYSA-N 0 0 385.262 3.201 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCSC[C@@H]2c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000185674961 565216177 /nfs/dbraw/zinc/21/61/77/565216177.db2.gz YQBKDTYOJCYCQR-CYBMUJFWSA-N 0 0 380.857 3.464 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC3(CCOCC3)[C@H]2C)cc1[N+](=O)[O-] ZINC000371989620 565217613 /nfs/dbraw/zinc/21/76/13/565217613.db2.gz CCQHOMFLFWMFLR-GFCCVEGCSA-N 0 0 388.873 3.136 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC3(CCOCC3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000371989621 565219230 /nfs/dbraw/zinc/21/92/30/565219230.db2.gz CCQHOMFLFWMFLR-LBPRGKRZSA-N 0 0 388.873 3.136 20 5 GGBDRN CSc1ccc(C(=O)N2CCC(C(=O)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000185734680 565219588 /nfs/dbraw/zinc/21/95/88/565219588.db2.gz HFWLXPKAHYFPAB-UHFFFAOYSA-N 0 0 376.356 3.300 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000185757593 565220036 /nfs/dbraw/zinc/22/00/36/565220036.db2.gz LJBUHAUAGKHJAC-NSHDSACASA-N 0 0 380.857 3.224 20 5 GGBDRN O=C(NCCOc1ncccc1Cl)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185870260 565226049 /nfs/dbraw/zinc/22/60/49/565226049.db2.gz QPZVUEMZBZGBFJ-UHFFFAOYSA-N 0 0 385.207 3.175 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000294751505 565226251 /nfs/dbraw/zinc/22/62/51/565226251.db2.gz ITOBFQPDDHZUPR-GOEBONIOSA-N 0 0 399.216 3.280 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCc1nccs1 ZINC000270722446 565226483 /nfs/dbraw/zinc/22/64/83/565226483.db2.gz ROBITQYSNXCOQB-UHFFFAOYSA-N 0 0 381.479 3.152 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1c(Br)cnn1C ZINC000294769307 565227279 /nfs/dbraw/zinc/22/72/79/565227279.db2.gz FVUPPKCGFFEKAB-UHFFFAOYSA-N 0 0 381.230 3.142 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000294788857 565228152 /nfs/dbraw/zinc/22/81/52/565228152.db2.gz KKSFWAOUSYBTNM-HOCLYGCPSA-N 0 0 381.226 3.141 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCCCSc1ccccc1 ZINC000160075564 565230047 /nfs/dbraw/zinc/23/00/47/565230047.db2.gz GZYJTGAGWJCORP-UHFFFAOYSA-N 0 0 380.491 3.239 20 5 GGBDRN COc1cc(Br)cc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000270839303 565230159 /nfs/dbraw/zinc/23/01/59/565230159.db2.gz HRRYZVLLBLVUIG-UHFFFAOYSA-N 0 0 397.229 3.208 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCSC2(CCOCC2)C1 ZINC000185948130 565231552 /nfs/dbraw/zinc/23/15/52/565231552.db2.gz LTHTYSRHZQJMLP-UHFFFAOYSA-N 0 0 385.873 3.056 20 5 GGBDRN C[S@@](=O)Cc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000185975415 565232556 /nfs/dbraw/zinc/23/25/56/565232556.db2.gz AOZYESZQDNCUEI-HSZRJFAPSA-N 0 0 397.250 3.488 20 5 GGBDRN CC(C)(C)OC(=O)C1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000270996306 565234533 /nfs/dbraw/zinc/23/45/33/565234533.db2.gz VKUIXSPKDIZCEF-UHFFFAOYSA-N 0 0 386.246 3.310 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000271000780 565235115 /nfs/dbraw/zinc/23/51/15/565235115.db2.gz WAMIIRPHPSXNNN-QMMMGPOBSA-N 0 0 383.168 3.048 20 5 GGBDRN COc1nc(C)c(Br)cc1C(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000186024968 565236162 /nfs/dbraw/zinc/23/61/62/565236162.db2.gz WHLMGNRTHNHCEW-UHFFFAOYSA-N 0 0 392.209 3.272 20 5 GGBDRN CC(C)c1nnc([C@H](C)NC(=O)c2ccc(Br)cc2[N+](=O)[O-])[nH]1 ZINC000271015992 565236518 /nfs/dbraw/zinc/23/65/18/565236518.db2.gz HHGLRBWOVSTDBJ-QMMMGPOBSA-N 0 0 382.218 3.090 20 5 GGBDRN CC(C)C(=O)NC1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000271063943 565237540 /nfs/dbraw/zinc/23/75/40/565237540.db2.gz ZJICNLYCGXJRDS-UHFFFAOYSA-N 0 0 384.274 3.094 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N(CCO)Cc1cc(Br)ccc1F ZINC000160273027 565238528 /nfs/dbraw/zinc/23/85/28/565238528.db2.gz SXQXEQRLYRMTJF-UHFFFAOYSA-N 0 0 397.200 3.131 20 5 GGBDRN CC(C)(CCC(=O)Nc1cnc(Br)c(Br)c1)[N+](=O)[O-] ZINC000294999815 565239709 /nfs/dbraw/zinc/23/97/09/565239709.db2.gz PWLGLKZJZDIEIF-UHFFFAOYSA-N 0 0 395.051 3.381 20 5 GGBDRN CSc1cccc(C(=O)N2CCOC[C@@H]2c2nc(C)cs2)c1[N+](=O)[O-] ZINC000372471520 565240457 /nfs/dbraw/zinc/24/04/57/565240457.db2.gz HBLBROPXCKUHFD-GFCCVEGCSA-N 0 0 379.463 3.295 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000186123543 565241187 /nfs/dbraw/zinc/24/11/87/565241187.db2.gz UTUZDYUPMUFBSN-UHFFFAOYSA-N 0 0 376.722 3.490 20 5 GGBDRN Cc1cccnc1NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000160336814 565241388 /nfs/dbraw/zinc/24/13/88/565241388.db2.gz JPLFNSZAFCSTCB-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN COC(=O)Cc1csc(N(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)n1 ZINC000295049832 565241658 /nfs/dbraw/zinc/24/16/58/565241658.db2.gz JVAFDUJFBNLJFM-UHFFFAOYSA-N 0 0 383.813 3.005 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000295038677 565241956 /nfs/dbraw/zinc/24/19/56/565241956.db2.gz XFERVVJBZFOYOP-GXTWGEPZSA-N 0 0 387.255 3.202 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000295038684 565242029 /nfs/dbraw/zinc/24/20/29/565242029.db2.gz XFERVVJBZFOYOP-TZMCWYRMSA-N 0 0 387.255 3.202 20 5 GGBDRN COC(=O)[C@@H]1CC12CCN(Cc1ccc(Br)c([N+](=O)[O-])c1)CC2 ZINC000271207304 565243007 /nfs/dbraw/zinc/24/30/07/565243007.db2.gz WVKIOAVDPCMENR-LBPRGKRZSA-N 0 0 383.242 3.132 20 5 GGBDRN CC(C)c1nc(CCNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cs1 ZINC000271232398 565243596 /nfs/dbraw/zinc/24/35/96/565243596.db2.gz GCBJZYMEHSMYEJ-UHFFFAOYSA-N 0 0 375.497 3.294 20 5 GGBDRN C[C@H]1C[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCO1 ZINC000271261485 565245258 /nfs/dbraw/zinc/24/52/58/565245258.db2.gz KVUBGHVHKUURGK-CBAPKCEASA-N 0 0 377.622 3.308 20 5 GGBDRN CC[C@@]1(CO)CCCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)C1 ZINC000295113923 565245869 /nfs/dbraw/zinc/24/58/69/565245869.db2.gz IWXLXAHXQLXOFG-CQSZACIVSA-N 0 0 397.280 3.075 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC(OC3CCCCC3)CC2)s1 ZINC000271312405 565247518 /nfs/dbraw/zinc/24/75/18/565247518.db2.gz SSBAKJPVEPAZAY-UHFFFAOYSA-N 0 0 388.511 3.378 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000186236508 565248803 /nfs/dbraw/zinc/24/88/03/565248803.db2.gz RYZBAEKRWONZCC-SECBINFHSA-N 0 0 388.804 3.435 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c1Cl ZINC000295166869 565249042 /nfs/dbraw/zinc/24/90/42/565249042.db2.gz PNQIJGWZNJUKBW-SKDRFNHKSA-N 0 0 395.264 3.138 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c1Cl ZINC000295166851 565249588 /nfs/dbraw/zinc/24/95/88/565249588.db2.gz PNQIJGWZNJUKBW-BXKDBHETSA-N 0 0 395.264 3.138 20 5 GGBDRN CC(C)[C@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000271351164 565249937 /nfs/dbraw/zinc/24/99/37/565249937.db2.gz DXWPKJPAVKYVHH-ZWNOBZJWSA-N 0 0 389.221 3.430 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271382348 565250370 /nfs/dbraw/zinc/25/03/70/565250370.db2.gz KGFBDGZJSUKENP-SCZZXKLOSA-N 0 0 376.481 3.045 20 5 GGBDRN C[S@@](=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000186275669 565250964 /nfs/dbraw/zinc/25/09/64/565250964.db2.gz OYNDLOIJHRLERT-RUZDIDTESA-N 0 0 384.523 3.376 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000186288505 565252288 /nfs/dbraw/zinc/25/22/88/565252288.db2.gz NDAQZZQRROVGQR-AWEZNQCLSA-N 0 0 397.204 3.057 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1cc(Br)ccn1 ZINC000295223558 565252690 /nfs/dbraw/zinc/25/26/90/565252690.db2.gz BLYFIMHNLBFWPL-UHFFFAOYSA-N 0 0 393.241 3.261 20 5 GGBDRN CC(C)(CCCO)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000271448285 565253045 /nfs/dbraw/zinc/25/30/45/565253045.db2.gz VCZZQSYWKIYMAP-UHFFFAOYSA-N 0 0 377.210 3.025 20 5 GGBDRN CC1(C)C[C@@H](Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000160596479 565253364 /nfs/dbraw/zinc/25/33/64/565253364.db2.gz XBYHTBVAJUXCGM-VIFPVBQESA-N 0 0 382.360 3.258 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCC(c3ccsc3)CC2)cc1 ZINC000186334066 565256032 /nfs/dbraw/zinc/25/60/32/565256032.db2.gz FIJIFFCSBDKUSX-UHFFFAOYSA-N 0 0 380.491 3.408 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc(C2CC2)c1Br)c1ccc([N+](=O)[O-])cc1 ZINC000295268626 565256555 /nfs/dbraw/zinc/25/65/55/565256555.db2.gz GQTABBDYKVQJSK-QMMMGPOBSA-N 0 0 379.214 3.449 20 5 GGBDRN CC(C)[C@H]1C[C@H](Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])CCO1 ZINC000271513127 565257080 /nfs/dbraw/zinc/25/70/80/565257080.db2.gz YYZUBNYBKWXWTM-QMTHXVAHSA-N 0 0 378.397 3.207 20 5 GGBDRN CC(C)[C@@H]1C[C@H](Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])CCO1 ZINC000271513134 565257212 /nfs/dbraw/zinc/25/72/12/565257212.db2.gz YYZUBNYBKWXWTM-YGRLFVJLSA-N 0 0 378.397 3.207 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(F)c(Br)cc1F ZINC000160822153 565260715 /nfs/dbraw/zinc/26/07/15/565260715.db2.gz FFTVFKOLDABNFX-UHFFFAOYSA-N 0 0 389.156 3.169 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000271606976 565261604 /nfs/dbraw/zinc/26/16/04/565261604.db2.gz JKCHFUUDUNKNOY-LLVKDONJSA-N 0 0 395.261 3.309 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC([C@@H]2CCOC2)CC1 ZINC000372940401 565261835 /nfs/dbraw/zinc/26/18/35/565261835.db2.gz MAGMQHAAHDZKCL-GFCCVEGCSA-N 0 0 383.242 3.246 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC(c2nncn2C2CC2)CC1 ZINC000271638452 565262552 /nfs/dbraw/zinc/26/25/52/565262552.db2.gz PATGPRIIAGLOFW-UHFFFAOYSA-N 0 0 393.245 3.063 20 5 GGBDRN C[C@H](CCCO)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000295409618 565264921 /nfs/dbraw/zinc/26/49/21/565264921.db2.gz LABJTANURPGXMA-MRVPVSSYSA-N 0 0 379.638 3.149 20 5 GGBDRN C[C@H]1C[C@@H](c2cccnc2)N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000186514713 565264953 /nfs/dbraw/zinc/26/49/53/565264953.db2.gz CQUKJXRQAMPRHJ-NHYWBVRUSA-N 0 0 381.841 3.415 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCOC[C@@H](C2CCC2)C1 ZINC000295420703 565265015 /nfs/dbraw/zinc/26/50/15/565265015.db2.gz UZJQUMBBWPWVLA-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000186514657 565265032 /nfs/dbraw/zinc/26/50/32/565265032.db2.gz CQUKJXRQAMPRHJ-IAQYHMDHSA-N 0 0 381.841 3.415 20 5 GGBDRN Cc1csc([C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(F)(F)F)n1 ZINC000295425298 565265822 /nfs/dbraw/zinc/26/58/22/565265822.db2.gz PVDISOZHSNVALS-GFCCVEGCSA-N 0 0 375.328 3.158 20 5 GGBDRN C[C@H]1C[C@@H](c2cccnc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186525542 565266271 /nfs/dbraw/zinc/26/62/71/565266271.db2.gz LPUPCCYPDPEHAF-NHYWBVRUSA-N 0 0 381.841 3.415 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000186533299 565266321 /nfs/dbraw/zinc/26/63/21/565266321.db2.gz LVGKVOSLJMVMPL-CYBMUJFWSA-N 0 0 397.204 3.057 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000186533314 565266491 /nfs/dbraw/zinc/26/64/91/565266491.db2.gz LVGKVOSLJMVMPL-ZDUSSCGKSA-N 0 0 397.204 3.057 20 5 GGBDRN Cn1ccnc1[C@@H]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000373057595 565267695 /nfs/dbraw/zinc/26/76/95/565267695.db2.gz NEUDTMNHGXKYKN-LLVKDONJSA-N 0 0 393.241 3.111 20 5 GGBDRN C[C@H](CCO)C1(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])CCC1 ZINC000271790915 565268626 /nfs/dbraw/zinc/26/86/26/565268626.db2.gz CLAYENYRCCOXKP-LLVKDONJSA-N 0 0 385.258 3.276 20 5 GGBDRN COC1(C)CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1 ZINC000271784530 565268921 /nfs/dbraw/zinc/26/89/21/565268921.db2.gz SSZODBQVXJBRBN-UHFFFAOYSA-N 0 0 375.194 3.138 20 5 GGBDRN COc1cc(C(=O)N[C@@H](c2nc(C)cs2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000295493827 565269283 /nfs/dbraw/zinc/26/92/83/565269283.db2.gz UYKDSZAHGDRSMI-NSHDSACASA-N 0 0 375.328 3.402 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])[C@H]2CCCO[C@@H]21 ZINC000373095632 565269421 /nfs/dbraw/zinc/26/94/21/565269421.db2.gz TVXPTLXLWPYLGD-HFKOZYHYSA-N 0 0 389.271 3.352 20 5 GGBDRN COC(=O)[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Cl)c(Cl)c1 ZINC000186574201 565269528 /nfs/dbraw/zinc/26/95/28/565269528.db2.gz BGLCMLHDIXNVFX-HNNXBMFYSA-N 0 0 387.175 3.313 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])[C@H]2CCCO[C@H]21 ZINC000373095633 565269547 /nfs/dbraw/zinc/26/95/47/565269547.db2.gz TVXPTLXLWPYLGD-NZXMKCKXSA-N 0 0 389.271 3.352 20 5 GGBDRN CC(C)(C(=O)NCc1cc(Br)ccn1)c1ccc([N+](=O)[O-])cc1F ZINC000295506170 565270213 /nfs/dbraw/zinc/27/02/13/565270213.db2.gz FBZVNPXXMBABQP-UHFFFAOYSA-N 0 0 396.216 3.485 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NCCC(C)(F)F ZINC000295521653 565271080 /nfs/dbraw/zinc/27/10/80/565271080.db2.gz XDHYUEPLQWRXHE-UHFFFAOYSA-N 0 0 398.147 3.283 20 5 GGBDRN C[C@@H](CCO)C1(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)CCC1 ZINC000271911260 565271960 /nfs/dbraw/zinc/27/19/60/565271960.db2.gz RNDPCAUSCIEFEY-NSHDSACASA-N 0 0 385.258 3.276 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@H]1CCc2c1cccc2Cl ZINC000161160211 565275128 /nfs/dbraw/zinc/27/51/28/565275128.db2.gz UGVIRWZCULKMSA-INIZCTEOSA-N 0 0 380.853 3.398 20 5 GGBDRN CN1Cc2ccccc2[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C1 ZINC000373213473 565275737 /nfs/dbraw/zinc/27/57/37/565275737.db2.gz AVRSTPVUVXHBMZ-NSHDSACASA-N 0 0 396.266 3.335 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000186678267 565276896 /nfs/dbraw/zinc/27/68/96/565276896.db2.gz WNFLVSPYWXJNTB-VIFPVBQESA-N 0 0 397.229 3.322 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000186673868 565277173 /nfs/dbraw/zinc/27/71/73/565277173.db2.gz GWFNVVCRNGEOQZ-SECBINFHSA-N 0 0 383.202 3.014 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000186678289 565277341 /nfs/dbraw/zinc/27/73/41/565277341.db2.gz WNFLVSPYWXJNTB-SECBINFHSA-N 0 0 397.229 3.322 20 5 GGBDRN O=C([C@H]1SCCc2sccc21)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373306668 565279223 /nfs/dbraw/zinc/27/92/23/565279223.db2.gz SPYOJEOPIAFMOP-HNNXBMFYSA-N 0 0 378.479 3.047 20 5 GGBDRN COc1cc(CNc2ncc([N+](=O)[O-])c(C)n2)cc(Br)c1OC ZINC000295650152 565279731 /nfs/dbraw/zinc/27/97/31/565279731.db2.gz ZFSYJHMTWRIESY-UHFFFAOYSA-N 0 0 383.202 3.085 20 5 GGBDRN CSc1cccc(C(=O)N(C)Cc2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000186723058 565280935 /nfs/dbraw/zinc/28/09/35/565280935.db2.gz QPRWLPIXYKZPDC-VWLOTQADSA-N 0 0 378.475 3.326 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@H]1CCCC1=O ZINC000272189593 565280993 /nfs/dbraw/zinc/28/09/93/565280993.db2.gz NDSORVYFUHVXGH-TZMCWYRMSA-N 0 0 381.226 3.331 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc(Br)cn1)c1ccc([N+](=O)[O-])s1 ZINC000373374125 565281138 /nfs/dbraw/zinc/28/11/38/565281138.db2.gz APPWMZWSKMNPSS-UHFFFAOYSA-N 0 0 394.210 3.252 20 5 GGBDRN Cc1cnc([C@@H](C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000186734534 565281221 /nfs/dbraw/zinc/28/12/21/565281221.db2.gz OXTPBUGBZJVTRT-QMMMGPOBSA-N 0 0 375.859 3.095 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN1CCC(Oc2cccc(Br)c2)CC1 ZINC000373377135 565281813 /nfs/dbraw/zinc/28/18/13/565281813.db2.gz JZSACDFBGCCFAV-UHFFFAOYSA-N 0 0 395.257 3.134 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CCO1 ZINC000272258683 565283225 /nfs/dbraw/zinc/28/32/25/565283225.db2.gz UUOGLZSVKUQPMZ-YPMHNXCESA-N 0 0 376.500 3.456 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OS(=O)(=O)C2CCC(C(F)(F)F)CC2)c1 ZINC000295730937 565284134 /nfs/dbraw/zinc/28/41/34/565284134.db2.gz OUWITFSVSFHQGS-UHFFFAOYSA-N 0 0 381.328 3.237 20 5 GGBDRN Cc1nn([C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000272323989 565284213 /nfs/dbraw/zinc/28/42/13/565284213.db2.gz BOJWPDJWLZMBIE-LLVKDONJSA-N 0 0 381.230 3.082 20 5 GGBDRN COc1cc(CSCc2nc(C)no2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272511024 565289262 /nfs/dbraw/zinc/28/92/62/565289262.db2.gz VZIYDKRFUWWVFP-UHFFFAOYSA-N 0 0 375.353 3.372 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2cccc(F)c2O1 ZINC000186858658 565291615 /nfs/dbraw/zinc/29/16/15/565291615.db2.gz ZOWIQPKAEIYIRT-SECBINFHSA-N 0 0 386.788 3.364 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2cccc(F)c2O1 ZINC000186858679 565291878 /nfs/dbraw/zinc/29/18/78/565291878.db2.gz ZOWIQPKAEIYIRT-VIFPVBQESA-N 0 0 386.788 3.364 20 5 GGBDRN COc1nc(C)c(Br)cc1C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000186886872 565292562 /nfs/dbraw/zinc/29/25/62/565292562.db2.gz SEAMHVKUJTZNBK-UHFFFAOYSA-N 0 0 380.198 3.346 20 5 GGBDRN COc1cc(C(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c([N+](=O)[O-])cc1F ZINC000295900550 565292669 /nfs/dbraw/zinc/29/26/69/565292669.db2.gz GZHVVUOFNLTNLV-GXTWGEPZSA-N 0 0 377.199 3.398 20 5 GGBDRN COc1cc(C(=O)N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)c([N+](=O)[O-])cc1F ZINC000295900576 565293218 /nfs/dbraw/zinc/29/32/18/565293218.db2.gz GZHVVUOFNLTNLV-OCCSQVGLSA-N 0 0 377.199 3.398 20 5 GGBDRN COCC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccco1 ZINC000272647806 565293421 /nfs/dbraw/zinc/29/34/21/565293421.db2.gz GNMNNFHEZDPVSG-ZDUSSCGKSA-N 0 0 383.198 3.458 20 5 GGBDRN CC[C@H](O)[C@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000161837566 565293637 /nfs/dbraw/zinc/29/36/37/565293637.db2.gz VOGAUYUNUCQWCH-YPMHNXCESA-N 0 0 397.280 3.216 20 5 GGBDRN Cn1ccnc1[C@H]1N(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000295941614 565294662 /nfs/dbraw/zinc/29/46/62/565294662.db2.gz QECCZSLGIJVECN-CYBMUJFWSA-N 0 0 393.241 3.314 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H]2[C@@H]2CCCO2)c1Cl ZINC000295939532 565294827 /nfs/dbraw/zinc/29/48/27/565294827.db2.gz ITZNIRUPRZTZGL-PWSUYJOCSA-N 0 0 395.264 3.234 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N1CCC(CCCO)CC1 ZINC000272827558 565297848 /nfs/dbraw/zinc/29/78/48/565297848.db2.gz MGIJJOBBSJNJAR-UHFFFAOYSA-N 0 0 386.246 3.374 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2ccc3c(c2)CCCC(=O)N3)s1 ZINC000272856357 565299477 /nfs/dbraw/zinc/29/94/77/565299477.db2.gz PQBLXINKCFPFGE-UHFFFAOYSA-N 0 0 382.419 3.127 20 5 GGBDRN CCSc1nnc(Sc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])s1 ZINC000272854911 565299606 /nfs/dbraw/zinc/29/96/06/565299606.db2.gz PIIYHHHDHATIQN-UHFFFAOYSA-N 0 0 383.523 3.175 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2cccc(NC(=O)C3CC3)c2)s1 ZINC000272841639 565299714 /nfs/dbraw/zinc/29/97/14/565299714.db2.gz MYMREVNMDDIXEG-UHFFFAOYSA-N 0 0 381.435 3.152 20 5 GGBDRN CC(C)(C)c1csc(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])n1 ZINC000272860791 565299949 /nfs/dbraw/zinc/29/99/49/565299949.db2.gz QIMBXMNFONPZJZ-UHFFFAOYSA-N 0 0 375.497 3.426 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC/C=C/c1ccc(Br)cc1 ZINC000296051644 565300312 /nfs/dbraw/zinc/30/03/12/565300312.db2.gz XZRMBABQOJXJCJ-NSCUHMNNSA-N 0 0 393.241 3.082 20 5 GGBDRN Cc1ncsc1CCS(=O)(=O)Oc1cc(F)c([N+](=O)[O-])cc1Cl ZINC000296049063 565300384 /nfs/dbraw/zinc/30/03/84/565300384.db2.gz OMUCCKDNKITPCB-UHFFFAOYSA-N 0 0 380.806 3.104 20 5 GGBDRN CN1Cc2ccccc2[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000373778756 565302660 /nfs/dbraw/zinc/30/26/60/565302660.db2.gz CUKXQFWEMJWZIN-CQSZACIVSA-N 0 0 390.237 3.274 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCSC[C@H]1c1nccs1 ZINC000187015736 565302852 /nfs/dbraw/zinc/30/28/52/565302852.db2.gz HXPKACLTJOUKQQ-AWEZNQCLSA-N 0 0 378.479 3.088 20 5 GGBDRN Cc1cc(OCC(=O)N2CCSC[C@H]2c2nccs2)ccc1[N+](=O)[O-] ZINC000373781216 565303374 /nfs/dbraw/zinc/30/33/74/565303374.db2.gz HBDIGHACDPWSJI-AWEZNQCLSA-N 0 0 379.463 3.055 20 5 GGBDRN Cc1cc(OCC(=O)N2CCSC[C@@H]2c2nccs2)ccc1[N+](=O)[O-] ZINC000373781217 565303410 /nfs/dbraw/zinc/30/34/10/565303410.db2.gz HBDIGHACDPWSJI-CQSZACIVSA-N 0 0 379.463 3.055 20 5 GGBDRN CC[C@H](C)[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)OC ZINC000296145811 565304104 /nfs/dbraw/zinc/30/41/04/565304104.db2.gz RHEWLOHOQUSWEL-UFBFGSQYSA-N 0 0 377.210 3.287 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCS[C@H]2COCC[C@H]21 ZINC000272998700 565304333 /nfs/dbraw/zinc/30/43/33/565304333.db2.gz MFOJZSINWZBIFA-RISCZKNCSA-N 0 0 388.898 3.073 20 5 GGBDRN CC[C@@H](C)[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)OC ZINC000296145798 565304493 /nfs/dbraw/zinc/30/44/93/565304493.db2.gz RHEWLOHOQUSWEL-PELKAZGASA-N 0 0 377.210 3.287 20 5 GGBDRN CC(C)OCCCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000273018068 565305023 /nfs/dbraw/zinc/30/50/23/565305023.db2.gz BYALCBNNWPQLKP-UHFFFAOYSA-N 0 0 377.210 3.431 20 5 GGBDRN COc1ccc(OCCN2CCSC[C@@H]2c2nccs2)c([N+](=O)[O-])c1 ZINC000187060032 565306255 /nfs/dbraw/zinc/30/62/55/565306255.db2.gz FSLWUIZHLCNLIL-CQSZACIVSA-N 0 0 381.479 3.229 20 5 GGBDRN Cc1cc(Br)c(NC(=O)C(=O)N(C)[C@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000273122938 565308037 /nfs/dbraw/zinc/30/80/37/565308037.db2.gz ZWKQIQPYBLBDHN-SNVBAGLBSA-N 0 0 386.246 3.107 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N[C@@H]2CCOC3(CCC3)C2)c1Cl ZINC000296221937 565308094 /nfs/dbraw/zinc/30/80/94/565308094.db2.gz KFWFYRQPRCSWTP-SECBINFHSA-N 0 0 395.264 3.282 20 5 GGBDRN Cn1ccnc1[C@@H]1N(C(=O)c2sc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000296310015 565311064 /nfs/dbraw/zinc/31/10/64/565311064.db2.gz RISBDJBIQYWTQB-NSHDSACASA-N 0 0 399.270 3.376 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(n3cc(Br)cn3)CC2)cc1[N+](=O)[O-] ZINC000373962879 565312623 /nfs/dbraw/zinc/31/26/23/565312623.db2.gz FJQANAQLXWIGDE-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN CC(C)(C)c1nc(COC(=O)c2cccc([N+](=O)[O-])c2Br)no1 ZINC000273223794 565313048 /nfs/dbraw/zinc/31/30/48/565313048.db2.gz QTOKJJQNCBTXMU-UHFFFAOYSA-N 0 0 384.186 3.395 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1ccc(Br)cc1 ZINC000162332311 565313382 /nfs/dbraw/zinc/31/33/82/565313382.db2.gz ZLCCWUKDISIILB-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)S(=O)(=O)CCc2ccccc2[N+](=O)[O-])s1 ZINC000162343255 565314158 /nfs/dbraw/zinc/31/41/58/565314158.db2.gz ZTEYVZUBHSZESS-GFCCVEGCSA-N 0 0 383.495 3.233 20 5 GGBDRN Cc1nn(C)c(N2CCC(c3nc(C(F)(F)F)cs3)CC2)c1[N+](=O)[O-] ZINC000296366208 565314561 /nfs/dbraw/zinc/31/45/61/565314561.db2.gz SGZMXVCJPKSXEX-UHFFFAOYSA-N 0 0 375.376 3.496 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000187172390 565314534 /nfs/dbraw/zinc/31/45/34/565314534.db2.gz YYZSWEWYHGMZGJ-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@]2(C)CCCO)cc1[N+](=O)[O-] ZINC000273306598 565316757 /nfs/dbraw/zinc/31/67/57/565316757.db2.gz GWKOCYRRHRZRBG-MRXNPFEDSA-N 0 0 385.258 3.433 20 5 GGBDRN Cc1cc(Br)c(NC(=O)C(=O)N(C)C2CCCC2)cc1[N+](=O)[O-] ZINC000187267920 565320577 /nfs/dbraw/zinc/32/05/77/565320577.db2.gz LRLYYDDYCNJNQC-UHFFFAOYSA-N 0 0 384.230 3.005 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2cccs2)c(C(F)(F)F)c1 ZINC000162714461 565326023 /nfs/dbraw/zinc/32/60/23/565326023.db2.gz FYJIODLZLTWFRF-UHFFFAOYSA-N 0 0 380.369 3.196 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1[C@@H](O)C(F)(F)F ZINC000162703261 565326058 /nfs/dbraw/zinc/32/60/58/565326058.db2.gz GLUOUZDNJREXRL-WCQYABFASA-N 0 0 378.372 3.235 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@H]1c1cccc(Br)c1 ZINC000187356261 565327001 /nfs/dbraw/zinc/32/70/01/565327001.db2.gz ZWLWXHKRBYDBTB-ZDUSSCGKSA-N 0 0 392.209 3.435 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cccc(F)c2)c(C(F)(F)F)c1 ZINC000162775982 565328253 /nfs/dbraw/zinc/32/82/53/565328253.db2.gz OSBOOLMUDYYWBW-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Nc2cccc(C(F)F)c2)cc1[N+](=O)[O-] ZINC000187392797 565329157 /nfs/dbraw/zinc/32/91/57/565329157.db2.gz MQILXNMDTPSCBD-UHFFFAOYSA-N 0 0 376.312 3.481 20 5 GGBDRN CC[C@@H]1[C@@H](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000187408559 565329672 /nfs/dbraw/zinc/32/96/72/565329672.db2.gz BYTHIGMVBYAWIP-TVQRCGJNSA-N 0 0 388.205 3.460 20 5 GGBDRN CC[C@H]1[C@H](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000187408544 565330255 /nfs/dbraw/zinc/33/02/55/565330255.db2.gz BYTHIGMVBYAWIP-RNCFNFMXSA-N 0 0 388.205 3.460 20 5 GGBDRN CN(CCC(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000162949681 565332695 /nfs/dbraw/zinc/33/26/95/565332695.db2.gz DTURMJDWKPNOKL-UHFFFAOYSA-N 0 0 380.266 3.187 20 5 GGBDRN CC(C)(CCc1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1)[N+](=O)[O-] ZINC000296726444 565332727 /nfs/dbraw/zinc/33/27/27/565332727.db2.gz IUHZZNQOLLQZSP-UHFFFAOYSA-N 0 0 399.201 3.319 20 5 GGBDRN O=C(NC[C@@H]1CCCCC1(F)F)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000296748217 565333649 /nfs/dbraw/zinc/33/36/49/565333649.db2.gz GWNMPBOZDFCYQR-VIFPVBQESA-N 0 0 375.759 3.128 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(-c2ccc(Cl)s2)[nH]n1 ZINC000163065656 565336337 /nfs/dbraw/zinc/33/63/37/565336337.db2.gz LQZXMULQEOZVBO-UHFFFAOYSA-N 0 0 380.817 3.234 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCCOCC(F)(F)F)cc1[N+](=O)[O-] ZINC000163120672 565336351 /nfs/dbraw/zinc/33/63/51/565336351.db2.gz JHKBBGALAXLUHY-UHFFFAOYSA-N 0 0 399.163 3.365 20 5 GGBDRN Cn1ccnc1-c1csc(NC(=O)CSc2ccccc2[N+](=O)[O-])n1 ZINC000163132726 565337880 /nfs/dbraw/zinc/33/78/80/565337880.db2.gz QPVKPVVCXULABO-UHFFFAOYSA-N 0 0 375.435 3.183 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CC=C(c3cccc(Br)c3)CC2)c1[N+](=O)[O-] ZINC000273827338 565339264 /nfs/dbraw/zinc/33/92/64/565339264.db2.gz FCEKGISNVLMUTL-UHFFFAOYSA-N 0 0 391.225 3.318 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC([C@@H]2CCCO2)CC1 ZINC000187556449 565340768 /nfs/dbraw/zinc/34/07/68/565340768.db2.gz ACCLLYPIEMPKFG-INIZCTEOSA-N 0 0 397.269 3.317 20 5 GGBDRN CC(=O)N1CCC[C@@H](c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)C1 ZINC000273855425 565340942 /nfs/dbraw/zinc/34/09/42/565340942.db2.gz KQFYFDGHORWNOZ-SNVBAGLBSA-N 0 0 395.213 3.133 20 5 GGBDRN Cc1nnc([C@@H](C)NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)s1 ZINC000273863580 565340954 /nfs/dbraw/zinc/34/09/54/565340954.db2.gz OPLZQNISEULNAV-ZCFIWIBFSA-N 0 0 386.231 3.400 20 5 GGBDRN Cc1nc(C)c(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 ZINC000163388269 565344761 /nfs/dbraw/zinc/34/47/61/565344761.db2.gz FMYYXEYTESQQNN-UHFFFAOYSA-N 0 0 395.384 3.165 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](C)S1 ZINC000163395021 565345306 /nfs/dbraw/zinc/34/53/06/565345306.db2.gz WCQQQLQKLIFLOY-IUCAKERBSA-N 0 0 384.401 3.128 20 5 GGBDRN CC(C)[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCS1 ZINC000163400102 565345425 /nfs/dbraw/zinc/34/54/25/565345425.db2.gz NZRDIIRDODCLKT-GFCCVEGCSA-N 0 0 398.428 3.376 20 5 GGBDRN C[C@]1(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCCS1 ZINC000163460908 565346017 /nfs/dbraw/zinc/34/60/17/565346017.db2.gz VRPFOAPJRZGWAP-GFCCVEGCSA-N 0 0 384.401 3.178 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Nc2c(F)cc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000187621873 565346937 /nfs/dbraw/zinc/34/69/37/565346937.db2.gz NGLKQUBHTHMDOK-UHFFFAOYSA-N 0 0 396.730 3.475 20 5 GGBDRN CSC[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163495436 565347719 /nfs/dbraw/zinc/34/77/19/565347719.db2.gz HCMFRXXZPKVGSD-JTQLQIEISA-N 0 0 384.401 3.130 20 5 GGBDRN Cc1c(CC(=O)NCCOc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000163488741 565347726 /nfs/dbraw/zinc/34/77/26/565347726.db2.gz DOAZMFCJNIQLQA-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000187690473 565349808 /nfs/dbraw/zinc/34/98/08/565349808.db2.gz FJJAQIVKWDPKJK-LKFCYVNXSA-N 0 0 380.750 3.462 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000187709285 565350136 /nfs/dbraw/zinc/35/01/36/565350136.db2.gz VDVRSGOHLMYXIJ-YMTOWFKASA-N 0 0 380.750 3.462 20 5 GGBDRN NC(=O)c1ccc(SCc2nc([C@@H]3CCCCS3)no2)c([N+](=O)[O-])c1 ZINC000274001310 565350412 /nfs/dbraw/zinc/35/04/12/565350412.db2.gz MIUBVBJSOBDBJE-LBPRGKRZSA-N 0 0 380.451 3.327 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000187747203 565352607 /nfs/dbraw/zinc/35/26/07/565352607.db2.gz IUHRFYHTJGSFEV-QMTHXVAHSA-N 0 0 380.750 3.462 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000187804984 565356880 /nfs/dbraw/zinc/35/68/80/565356880.db2.gz XZARZBFYVYSFPO-YMTOWFKASA-N 0 0 380.750 3.462 20 5 GGBDRN O=C(NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000187804947 565357168 /nfs/dbraw/zinc/35/71/68/565357168.db2.gz XZARZBFYVYSFPO-LKFCYVNXSA-N 0 0 380.750 3.462 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C[C@@H]2CCOC2)C2CC2)cc1[N+](=O)[O-] ZINC000164259042 565357858 /nfs/dbraw/zinc/35/78/58/565357858.db2.gz QTSDQAAHVLGXIB-NSHDSACASA-N 0 0 383.242 3.307 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)NCc2ccc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000187833165 565358140 /nfs/dbraw/zinc/35/81/40/565358140.db2.gz SOTMBPQXJXWCLL-UHFFFAOYSA-N 0 0 392.767 3.014 20 5 GGBDRN CN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000374861325 565358161 /nfs/dbraw/zinc/35/81/61/565358161.db2.gz HPFANEAOURPEBJ-HNNXBMFYSA-N 0 0 384.816 3.348 20 5 GGBDRN C[C@@](O)(CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000274205570 565362145 /nfs/dbraw/zinc/36/21/45/565362145.db2.gz VFVNLPVIKNAJCE-CQSZACIVSA-N 0 0 390.870 3.033 20 5 GGBDRN COc1cc(CN[C@@H](CO)c2ccc(Br)cc2)c([N+](=O)[O-])cc1F ZINC000274292227 565364945 /nfs/dbraw/zinc/36/49/45/565364945.db2.gz HAPSBZXNUCCDQF-AWEZNQCLSA-N 0 0 399.216 3.328 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC(O)(c2ccccc2)CC1 ZINC000274274370 565365680 /nfs/dbraw/zinc/36/56/80/565365680.db2.gz SCCDWKOGWHOGMB-UHFFFAOYSA-N 0 0 378.226 3.240 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](c2cc[nH]n2)C1 ZINC000375045530 565366008 /nfs/dbraw/zinc/36/60/08/565366008.db2.gz ZNYJYQOHPXWFPA-NSHDSACASA-N 0 0 393.241 3.409 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000274345176 565367383 /nfs/dbraw/zinc/36/73/83/565367383.db2.gz PQGVTMLEFUKUCN-NSHDSACASA-N 0 0 380.857 3.224 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1ncc[nH]1 ZINC000375082997 565368131 /nfs/dbraw/zinc/36/81/31/565368131.db2.gz YNXFSWJFHACYIZ-CYBMUJFWSA-N 0 0 379.214 3.366 20 5 GGBDRN COc1cc(C(=O)NCc2nc(C(F)(F)F)cs2)cc([N+](=O)[O-])c1C ZINC000187990292 565368947 /nfs/dbraw/zinc/36/89/47/565368947.db2.gz WHLMJCTUNGIWIQ-UHFFFAOYSA-N 0 0 375.328 3.317 20 5 GGBDRN C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)CCO[C@H]1C1CC1 ZINC000375132988 565370652 /nfs/dbraw/zinc/37/06/52/565370652.db2.gz BOKAWVNFKLMHJQ-HOCLYGCPSA-N 0 0 383.242 3.292 20 5 GGBDRN COC[C@H]1CCCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000375139206 565371841 /nfs/dbraw/zinc/37/18/41/565371841.db2.gz HOCWWDZOXLSVAF-LBPRGKRZSA-N 0 0 385.258 3.175 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(c3nc(C)cs3)CC2)c1[N+](=O)[O-] ZINC000188043926 565373690 /nfs/dbraw/zinc/37/36/90/565373690.db2.gz KYBOKRYNMQVFPD-UHFFFAOYSA-N 0 0 378.479 3.044 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC2(CCOCC2)C1 ZINC000274607289 565375111 /nfs/dbraw/zinc/37/51/11/565375111.db2.gz VTKRSQSEFUDUBT-ZDUSSCGKSA-N 0 0 382.507 3.200 20 5 GGBDRN O=C(C1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000274627617 565375972 /nfs/dbraw/zinc/37/59/72/565375972.db2.gz MRXGEKPKYVPEFS-UHFFFAOYSA-N 0 0 382.136 3.100 20 5 GGBDRN O=C(C1CCN(c2ncc([N+](=O)[O-])cc2Br)CC1)C(F)(F)F ZINC000274626423 565376083 /nfs/dbraw/zinc/37/60/83/565376083.db2.gz MKPLKMWHAACDCU-UHFFFAOYSA-N 0 0 382.136 3.100 20 5 GGBDRN CSc1cccc(C(=O)N2CCCN(c3nccs3)CC2)c1[N+](=O)[O-] ZINC000188083720 565376758 /nfs/dbraw/zinc/37/67/58/565376758.db2.gz VYPLNUAVBHUFLE-UHFFFAOYSA-N 0 0 378.479 3.126 20 5 GGBDRN Cc1cc(Cl)c(C(=O)N2CCSC[C@@H]2c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000297582286 565378063 /nfs/dbraw/zinc/37/80/63/565378063.db2.gz BUTOYQJDGKLOLN-OAHLLOKOSA-N 0 0 380.857 3.220 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000167566758 565379317 /nfs/dbraw/zinc/37/93/17/565379317.db2.gz JXJBHQYWGVWFSQ-ZYHUDNBSSA-N 0 0 382.825 3.091 20 5 GGBDRN O=C(Nc1ccc(OC2COC2)cc1)c1ccc([N+](=O)[O-])cc1Br ZINC000188129579 565381399 /nfs/dbraw/zinc/38/13/99/565381399.db2.gz QNKCJPVUTYRMMR-UHFFFAOYSA-N 0 0 393.193 3.387 20 5 GGBDRN O=c1oc(-c2ccc(F)cc2)nn1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000170617575 565383324 /nfs/dbraw/zinc/38/33/24/565383324.db2.gz UZOUVWABXFEMAS-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN CCN(C)C(=O)[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC000297700496 565383279 /nfs/dbraw/zinc/38/32/79/565383279.db2.gz JTRVLUZRXIHQNY-LBPRGKRZSA-N 0 0 376.240 3.134 20 5 GGBDRN CCn1cc([C@H](C)NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cn1 ZINC000297793911 565386409 /nfs/dbraw/zinc/38/64/09/565386409.db2.gz OOIVYLJWXKXQQA-VIFPVBQESA-N 0 0 382.218 3.456 20 5 GGBDRN Cn1ccnc1[C@H]1N(C(=O)c2cc([N+](=O)[O-])ccc2Br)CC1(C)C ZINC000297793299 565387205 /nfs/dbraw/zinc/38/72/05/565387205.db2.gz RNXGTAHOZWHJCF-CYBMUJFWSA-N 0 0 393.241 3.314 20 5 GGBDRN Cc1csc(CCCCNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000170738523 565389139 /nfs/dbraw/zinc/38/91/39/565389139.db2.gz UTPUTITXOBYSNO-UHFFFAOYSA-N 0 0 389.886 3.314 20 5 GGBDRN Cc1cc(N2CCOC3(CCOCC3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000375489049 565390806 /nfs/dbraw/zinc/39/08/06/565390806.db2.gz VMODNDUKYCCYFN-UHFFFAOYSA-N 0 0 385.258 3.442 20 5 GGBDRN CCc1n[nH]c(C(=O)NC2(c3cccc(Br)c3)CCC2)c1[N+](=O)[O-] ZINC000188278925 565391646 /nfs/dbraw/zinc/39/16/46/565391646.db2.gz VGTHGRADHGLRLR-UHFFFAOYSA-N 0 0 393.241 3.452 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCCc2ccccc21 ZINC000170781725 565392510 /nfs/dbraw/zinc/39/25/10/565392510.db2.gz JIBHZFIWCMYFTR-UHFFFAOYSA-N 0 0 397.250 3.499 20 5 GGBDRN CCc1n[nH]c(C(=O)N(CC)Cc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000188336860 565395996 /nfs/dbraw/zinc/39/59/96/565395996.db2.gz QQZIDVGFQZXWGZ-UHFFFAOYSA-N 0 0 399.220 3.444 20 5 GGBDRN CCc1nc([C@@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2Cl)cs1 ZINC000298022240 565396277 /nfs/dbraw/zinc/39/62/77/565396277.db2.gz DIXQHAYZWHUYLD-MRVPVSSYSA-N 0 0 382.829 3.083 20 5 GGBDRN O=C(Nc1ccsc1Cl)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000188550653 565407525 /nfs/dbraw/zinc/40/75/25/565407525.db2.gz XPOASYSRSRGQBX-UHFFFAOYSA-N 0 0 379.825 3.439 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC(=O)CC3)cc2[N+](=O)[O-])n1 ZINC000298297178 565408484 /nfs/dbraw/zinc/40/84/84/565408484.db2.gz IPLWPWRKIVGSST-UHFFFAOYSA-N 0 0 377.447 3.316 20 5 GGBDRN CSc1ccc(C(=O)N2CCOC[C@@H]2c2nc(C)cs2)cc1[N+](=O)[O-] ZINC000188594901 565411955 /nfs/dbraw/zinc/41/19/55/565411955.db2.gz YDUPWJZXPUMKQN-CYBMUJFWSA-N 0 0 379.463 3.295 20 5 GGBDRN CO[C@@H](C)c1noc(COc2cc(F)c(Br)cc2[N+](=O)[O-])n1 ZINC000188658200 565414791 /nfs/dbraw/zinc/41/47/91/565414791.db2.gz CMMBXSOZFSOELA-LURJTMIESA-N 0 0 376.138 3.166 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Br)cc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000171203527 565416766 /nfs/dbraw/zinc/41/67/66/565416766.db2.gz QVIFVGDLEDMITE-NSHDSACASA-N 0 0 396.266 3.428 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(Br)cn1 ZINC000171199892 565416920 /nfs/dbraw/zinc/41/69/20/565416920.db2.gz IGNWZCYRDQJRRV-UHFFFAOYSA-N 0 0 394.181 3.166 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Br)cc2)C1)c1csc([N+](=O)[O-])c1 ZINC000171202731 565417282 /nfs/dbraw/zinc/41/72/82/565417282.db2.gz CJNXWTWOIHXTLH-GFCCVEGCSA-N 0 0 396.266 3.428 20 5 GGBDRN CC(C)CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000171204257 565418422 /nfs/dbraw/zinc/41/84/22/565418422.db2.gz GNZCCEBCZRFMLT-DGCLKSJQSA-N 0 0 385.511 3.112 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC(c2ccncn2)CC1 ZINC000298557609 565419898 /nfs/dbraw/zinc/41/98/98/565419898.db2.gz ZQZGQUFGWMRGQT-UHFFFAOYSA-N 0 0 391.225 3.167 20 5 GGBDRN CCN([C@H](C)Cc1ccsc1)S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-] ZINC000188758910 565422246 /nfs/dbraw/zinc/42/22/46/565422246.db2.gz JKBJKUXTBSCJCR-GFCCVEGCSA-N 0 0 384.479 3.307 20 5 GGBDRN CCN([C@@H](C)Cc1ccsc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000188769420 565423047 /nfs/dbraw/zinc/42/30/47/565423047.db2.gz ANUHOKNMIUOMGY-LBPRGKRZSA-N 0 0 384.479 3.307 20 5 GGBDRN CCN([C@H](C)Cc1ccsc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000188763095 565423199 /nfs/dbraw/zinc/42/31/99/565423199.db2.gz NTKUENWIASGJJV-GFCCVEGCSA-N 0 0 384.479 3.307 20 5 GGBDRN C[C@H]1CN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000171272271 565424119 /nfs/dbraw/zinc/42/41/19/565424119.db2.gz ZKOWHOZMUPUIAD-JTQLQIEISA-N 0 0 378.372 3.343 20 5 GGBDRN C[C@@H]1CN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000171272267 565424253 /nfs/dbraw/zinc/42/42/53/565424253.db2.gz ZKOWHOZMUPUIAD-SNVBAGLBSA-N 0 0 378.372 3.343 20 5 GGBDRN O=C(Nc1nc2c(s1)CSCC2)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000376158345 565425180 /nfs/dbraw/zinc/42/51/80/565425180.db2.gz OXGCTKFUOPWOMW-UHFFFAOYSA-N 0 0 379.448 3.098 20 5 GGBDRN CSc1nnc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)s1 ZINC000275833522 565429287 /nfs/dbraw/zinc/42/92/87/565429287.db2.gz LSEQPOLYRCNQEU-UHFFFAOYSA-N 0 0 391.381 3.091 20 5 GGBDRN CC[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl)C(OC)OC ZINC000298860258 565431729 /nfs/dbraw/zinc/43/17/29/565431729.db2.gz GBSWZNWVQPUPSJ-SECBINFHSA-N 0 0 395.637 3.138 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)NC1(C2CC2)CCOCC1 ZINC000376370192 565432774 /nfs/dbraw/zinc/43/27/74/565432774.db2.gz RSVVOLGXWFBLDW-UHFFFAOYSA-N 0 0 384.230 3.438 20 5 GGBDRN Cc1sc(NC(=O)CN2CCSC2=O)nc1-c1cccc([N+](=O)[O-])c1 ZINC000298880325 565433425 /nfs/dbraw/zinc/43/34/25/565433425.db2.gz WETQTKKMZXCWOB-UHFFFAOYSA-N 0 0 378.435 3.134 20 5 GGBDRN O=C(NCCCO[C@@H]1CCCCO1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000298975167 565435456 /nfs/dbraw/zinc/43/54/56/565435456.db2.gz OYLDJHNHIIVZIL-CQSZACIVSA-N 0 0 387.230 3.020 20 5 GGBDRN Cc1csc(N(CC(F)(F)F)C(=O)COc2ccccc2[N+](=O)[O-])n1 ZINC000298996555 565435603 /nfs/dbraw/zinc/43/56/03/565435603.db2.gz AWMOFGKUXGVMKJ-UHFFFAOYSA-N 0 0 375.328 3.334 20 5 GGBDRN CCOC(CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)OCC ZINC000276140585 565437276 /nfs/dbraw/zinc/43/72/76/565437276.db2.gz BFAHEYSREUQPIH-UHFFFAOYSA-N 0 0 393.209 3.015 20 5 GGBDRN CCOC(CCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)OCC ZINC000276129636 565437288 /nfs/dbraw/zinc/43/72/88/565437288.db2.gz CNQHKYROYMHONO-UHFFFAOYSA-N 0 0 390.234 3.268 20 5 GGBDRN Cc1sc(Br)nc1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000299104896 565440352 /nfs/dbraw/zinc/44/03/52/565440352.db2.gz WBMHGJGESIUDQL-UHFFFAOYSA-N 0 0 384.255 3.437 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@H]1[C@@H]1CCCC1=O ZINC000376526386 565441028 /nfs/dbraw/zinc/44/10/28/565441028.db2.gz HZJMTNQOWVIKNH-KBPBESRZSA-N 0 0 381.226 3.331 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC([C@H]2CCCO2)CC1 ZINC000276255887 565442364 /nfs/dbraw/zinc/44/23/64/565442364.db2.gz MEUPSTPOKWFBIN-OAHLLOKOSA-N 0 0 383.242 3.389 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccc(N3CCOCC3)nc2)c(Br)c1 ZINC000299356756 565448613 /nfs/dbraw/zinc/44/86/13/565448613.db2.gz OKDURKYRINWZAH-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN C[C@H](N[C@H](C(N)=O)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000171758622 565449222 /nfs/dbraw/zinc/44/92/22/565449222.db2.gz RICYSDYHQIHKRV-BONVTDFDSA-N 0 0 378.226 3.235 20 5 GGBDRN CCN(Cc1cccc(Br)c1)C(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000299425809 565450727 /nfs/dbraw/zinc/45/07/27/565450727.db2.gz ZJEFZPQZYQEDKY-UHFFFAOYSA-N 0 0 395.257 3.301 20 5 GGBDRN CCC(O)(CC)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000276513034 565452160 /nfs/dbraw/zinc/45/21/60/565452160.db2.gz WNPMBBOAYGVLFF-UHFFFAOYSA-N 0 0 377.210 3.167 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)CCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000171804173 565452169 /nfs/dbraw/zinc/45/21/69/565452169.db2.gz ZRJGREITTSJIII-JTQLQIEISA-N 0 0 395.257 3.394 20 5 GGBDRN CCc1[nH]nc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1Br ZINC000276598837 565454590 /nfs/dbraw/zinc/45/45/90/565454590.db2.gz AWIYWLDZBOJEKY-UHFFFAOYSA-N 0 0 383.202 3.212 20 5 GGBDRN CCS(=O)(=O)CCCCCSCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000276636951 565455614 /nfs/dbraw/zinc/45/56/14/565455614.db2.gz OVTIOQSWAHMVID-UHFFFAOYSA-N 0 0 389.495 3.300 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000189301117 565457576 /nfs/dbraw/zinc/45/75/76/565457576.db2.gz PTLPTEKBUJIKNJ-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN Cc1cc(N2CCC(N3CCCC3=O)CC2)c(Br)cc1[N+](=O)[O-] ZINC000276709713 565458227 /nfs/dbraw/zinc/45/82/27/565458227.db2.gz YFFMBKCAZPUJSB-UHFFFAOYSA-N 0 0 382.258 3.257 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCCS(=O)(=O)c1cccc(C(F)(F)F)c1 ZINC000189350283 565460612 /nfs/dbraw/zinc/46/06/12/565460612.db2.gz SPPZPAKNDDHJFN-UHFFFAOYSA-N 0 0 375.324 3.466 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(Br)c(F)c1 ZINC000301058537 565461049 /nfs/dbraw/zinc/46/10/49/565461049.db2.gz ATHCEDRERKDTHG-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 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GGBDRN O=C(NCCNc1ccc(F)cc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000301101054 565463427 /nfs/dbraw/zinc/46/34/27/565463427.db2.gz RIRISWKZZICCRX-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CN(C)C(=O)N1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000301084646 565463494 /nfs/dbraw/zinc/46/34/94/565463494.db2.gz LXMXFBBWFDEEEJ-UHFFFAOYSA-N 0 0 380.754 3.071 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1cc(F)ccc1Br ZINC000301086389 565463930 /nfs/dbraw/zinc/46/39/30/565463930.db2.gz HBLNKHWNJJPTCO-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN CS(=O)(=O)c1ccc(NCc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000301104140 565464473 /nfs/dbraw/zinc/46/44/73/565464473.db2.gz PKAFVVVTKMIKCP-UHFFFAOYSA-N 0 0 385.239 3.373 20 5 GGBDRN Cc1nc(CN2CCN(c3ccc([N+](=O)[O-])cc3Br)CC2)cs1 ZINC000301105801 565464761 /nfs/dbraw/zinc/46/47/61/565464761.db2.gz PTIGWXROLKJGRB-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN CN(Cc1ccc(Cl)c(Cl)c1)c1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1 ZINC000301124164 565464773 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O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NCC[C@@H]1CCCCO1 ZINC000302071144 565528005 /nfs/dbraw/zinc/52/80/05/565528005.db2.gz YMPIJBGPHRUQSD-JTQLQIEISA-N 0 0 382.360 3.259 20 5 GGBDRN CN(Cc1ccc(Cl)c(Cl)c1)c1cc([N+](=O)[O-])ccc1S(N)(=O)=O ZINC000302085760 565529104 /nfs/dbraw/zinc/52/91/04/565529104.db2.gz KOHHLOSLZFXSIZ-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCCc1cc(Cl)cc(Cl)c1 ZINC000302109079 565529908 /nfs/dbraw/zinc/52/99/08/565529908.db2.gz SVUKWNNGLDJVSG-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN Cc1nc(Sc2nnnn2-c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000302119955 565531266 /nfs/dbraw/zinc/53/12/66/565531266.db2.gz DESORNVOSGFPIL-UHFFFAOYSA-N 0 0 393.226 3.188 20 5 GGBDRN Cc1cc(Oc2cccc(S(N)(=O)=O)c2[N+](=O)[O-])ccc1Br ZINC000302114554 565531584 /nfs/dbraw/zinc/53/15/84/565531584.db2.gz CCRPILGTUIPKBJ-UHFFFAOYSA-N 0 0 387.211 3.105 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2ccc([N+](=O)[O-])c(Cl)c2)s1 ZINC000302130512 565531599 /nfs/dbraw/zinc/53/15/99/565531599.db2.gz BVZCSJXIUVRFIX-UHFFFAOYSA-N 0 0 378.771 3.414 20 5 GGBDRN CSc1nnc(-c2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)s1 ZINC000277957743 565531662 /nfs/dbraw/zinc/53/16/62/565531662.db2.gz MHUNNPRHYVZHJS-UHFFFAOYSA-N 0 0 376.423 3.460 20 5 GGBDRN NS(=O)(=O)c1cccc(N[C@@H]2CCSc3c(F)cccc32)c1[N+](=O)[O-] ZINC000302119614 565531663 /nfs/dbraw/zinc/53/16/63/565531663.db2.gz FJFPXFFELWWLRT-LLVKDONJSA-N 0 0 383.426 3.030 20 5 GGBDRN NS(=O)(=O)c1cccc(NCCSc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000302119717 565531779 /nfs/dbraw/zinc/53/17/79/565531779.db2.gz FLEHBVOTWSQZJT-UHFFFAOYSA-N 0 0 387.870 3.100 20 5 GGBDRN Cc1ccnc(Sc2nnnn2-c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000302130961 565532498 /nfs/dbraw/zinc/53/24/98/565532498.db2.gz GQUGWTXTSVOVME-UHFFFAOYSA-N 0 0 393.226 3.188 20 5 GGBDRN NS(=O)(=O)c1cccc(NCC2(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000302132686 565532882 /nfs/dbraw/zinc/53/28/82/565532882.db2.gz KXQGEOPQWJYDNQ-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN CC(C)(CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-])c1ccccc1Cl ZINC000302138045 565533125 /nfs/dbraw/zinc/53/31/25/565533125.db2.gz NMXJFOYDRPDIFN-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN Cc1cnc(C2CCN(S(=O)(=O)c3cccc(F)c3[N+](=O)[O-])CC2)s1 ZINC000278008199 565533314 /nfs/dbraw/zinc/53/33/14/565533314.db2.gz VRQXKUZEUVRZFL-UHFFFAOYSA-N 0 0 385.442 3.067 20 5 GGBDRN O=[N+]([O-])c1cnc(Nc2ccc(CCn3cc(Br)cn3)cc2)nc1 ZINC000302164070 565533754 /nfs/dbraw/zinc/53/37/54/565533754.db2.gz QMCPDUQCXHROID-UHFFFAOYSA-N 0 0 389.213 3.330 20 5 GGBDRN COC[C@H](NC(=O)c1sc(Br)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000278011528 565534354 /nfs/dbraw/zinc/53/43/54/565534354.db2.gz PFNKSKGHMBFNDQ-QMMMGPOBSA-N 0 0 389.227 3.438 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1sc(Br)cc1[N+](=O)[O-] ZINC000278009444 565534415 /nfs/dbraw/zinc/53/44/15/565534415.db2.gz IHTBLMLEKHJQER-NZXMKCKXSA-N 0 0 387.255 3.106 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000173191240 565534533 /nfs/dbraw/zinc/53/45/33/565534533.db2.gz VTSPCDAZIGPWOA-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000302175417 565534757 /nfs/dbraw/zinc/53/47/57/565534757.db2.gz BZSIQWFTEAEURI-LLVKDONJSA-N 0 0 386.246 3.310 20 5 GGBDRN C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Br)c2cccnc2O1 ZINC000190489700 565535736 /nfs/dbraw/zinc/53/57/36/565535736.db2.gz UIWHVIOCINCIIM-VIFPVBQESA-N 0 0 378.182 3.180 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-])CCC2 ZINC000302197860 565536040 /nfs/dbraw/zinc/53/60/40/565536040.db2.gz TXRWQRMJIKIPLX-JTQLQIEISA-N 0 0 387.508 3.339 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC(OC[C@@H]2CCOC2)CC1 ZINC000302195250 565536195 /nfs/dbraw/zinc/53/61/95/565536195.db2.gz XFQNRLAYPRNRID-GFCCVEGCSA-N 0 0 385.258 3.379 20 5 GGBDRN CNC(=O)c1ccc(N2Cc3ccc(Br)cc3C2)c([N+](=O)[O-])c1 ZINC000302188163 565536241 /nfs/dbraw/zinc/53/62/41/565536241.db2.gz WYLSCEKGSBWLBU-UHFFFAOYSA-N 0 0 376.210 3.237 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cccc([N+](=O)[O-])c1Br ZINC000190501293 565536739 /nfs/dbraw/zinc/53/67/39/565536739.db2.gz RKRXZVZXAFFZHF-DFBGVHRSSA-N 0 0 395.253 3.435 20 5 GGBDRN O=C(N[C@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cccc([N+](=O)[O-])c1Br ZINC000190501314 565537105 /nfs/dbraw/zinc/53/71/05/565537105.db2.gz RKRXZVZXAFFZHF-UGFHNGPFSA-N 0 0 395.253 3.435 20 5 GGBDRN O=C(NC12CCC(CC1)C2)c1cc([N+](=O)[O-])ccc1I ZINC000378644032 565537243 /nfs/dbraw/zinc/53/72/43/565537243.db2.gz KTNXZBKZMVCBJS-UHFFFAOYSA-N 0 0 386.189 3.262 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCOC2(CCCC2)C1 ZINC000278074886 565537769 /nfs/dbraw/zinc/53/77/69/565537769.db2.gz GNBFDCKFUGZOLU-UHFFFAOYSA-N 0 0 375.244 3.204 20 5 GGBDRN CO[C@@]1(C)C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000173219516 565538138 /nfs/dbraw/zinc/53/81/38/565538138.db2.gz PZFQBDVLFAXBDE-DOMZBBRYSA-N 0 0 376.862 3.072 20 5 GGBDRN Cc1ccc(Br)cc1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000190510101 565538243 /nfs/dbraw/zinc/53/82/43/565538243.db2.gz PFPQJHKRFXMHKS-UHFFFAOYSA-N 0 0 399.266 3.285 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000278074966 565538944 /nfs/dbraw/zinc/53/89/44/565538944.db2.gz OOCZXQSUMLZCKG-PELKAZGASA-N 0 0 381.738 3.415 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)s1 ZINC000173231393 565539291 /nfs/dbraw/zinc/53/92/91/565539291.db2.gz NAVFDGUCBJZVEG-SNVBAGLBSA-N 0 0 387.458 3.443 20 5 GGBDRN CN(CCC1CCOCC1)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000278102293 565539394 /nfs/dbraw/zinc/53/93/94/565539394.db2.gz JONZGGLGUVILMG-UHFFFAOYSA-N 0 0 377.260 3.308 20 5 GGBDRN COc1ccc2c(c1)nc(CNc1c(Br)cncc1[N+](=O)[O-])n2C ZINC000302273731 565539501 /nfs/dbraw/zinc/53/95/01/565539501.db2.gz SPECLBQFAXISBN-UHFFFAOYSA-N 0 0 392.213 3.260 20 5 GGBDRN CS(=O)(=O)N[C@@H]1CCC[C@H]1CNc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000302272464 565540178 /nfs/dbraw/zinc/54/01/78/565540178.db2.gz HMRRKQBFDIHQHQ-QPUJVOFHSA-N 0 0 382.269 3.031 20 5 GGBDRN Cc1cc(C2CCN(c3ncc([N+](=O)[O-])c(N)n3)CC2)ccc1Br ZINC000302408215 565540872 /nfs/dbraw/zinc/54/08/72/565540872.db2.gz GJPSRUWPGYJDCO-UHFFFAOYSA-N 0 0 392.257 3.422 20 5 GGBDRN Nc1nc(N2CCC(c3ccccc3Br)CC2)ncc1[N+](=O)[O-] ZINC000302533162 565544986 /nfs/dbraw/zinc/54/49/86/565544986.db2.gz FWAVJFHLGHWHID-UHFFFAOYSA-N 0 0 378.230 3.114 20 5 GGBDRN Cc1cc(N2CCN(CCOC(C)C)CC2)c(Br)cc1[N+](=O)[O-] ZINC000302627636 565547138 /nfs/dbraw/zinc/54/71/38/565547138.db2.gz BGLDDCQLYIEPRZ-UHFFFAOYSA-N 0 0 386.290 3.213 20 5 GGBDRN COCCN(CC(F)(F)F)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000278238695 565547266 /nfs/dbraw/zinc/54/72/66/565547266.db2.gz VTFGHHRGJZIUMV-UHFFFAOYSA-N 0 0 391.165 3.070 20 5 GGBDRN CCOC(=O)N[C@@H]1CCCN(c2cc(C)c([N+](=O)[O-])cc2Br)C1 ZINC000302627688 565547625 /nfs/dbraw/zinc/54/76/25/565547625.db2.gz BJGKBKYPIHOIJO-LLVKDONJSA-N 0 0 386.246 3.381 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1cc(Br)cs1 ZINC000302647827 565548300 /nfs/dbraw/zinc/54/83/00/565548300.db2.gz MOJXQGINTHMDNA-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN Cc1cc(NCCC(=O)NCc2ccccn2)c(Br)cc1[N+](=O)[O-] ZINC000302636707 565548778 /nfs/dbraw/zinc/54/87/78/565548778.db2.gz DCTRDUHGALOVMY-UHFFFAOYSA-N 0 0 393.241 3.179 20 5 GGBDRN Cc1cc(N2CCN(Cc3ccccn3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000302657055 565549062 /nfs/dbraw/zinc/54/90/62/565549062.db2.gz HOINOCJOHYNFHR-UHFFFAOYSA-N 0 0 391.269 3.383 20 5 GGBDRN Cc1cc(NCCc2nnc3ccccn32)c(Br)cc1[N+](=O)[O-] ZINC000302671997 565549454 /nfs/dbraw/zinc/54/94/54/565549454.db2.gz KWQJCRDRSKGXMZ-UHFFFAOYSA-N 0 0 376.214 3.363 20 5 GGBDRN COC(=O)c1cnc(NC[C@@H](O)c2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000302669872 565549900 /nfs/dbraw/zinc/54/99/00/565549900.db2.gz DHAXEAWSPDQXJQ-CYBMUJFWSA-N 0 0 386.191 3.229 20 5 GGBDRN Cc1cc(N2CCO[C@@](C)(c3cnn(C)c3)C2)c(Br)cc1[N+](=O)[O-] ZINC000302680359 565549913 /nfs/dbraw/zinc/54/99/13/565549913.db2.gz ORYBHDJEBWUNCR-MRXNPFEDSA-N 0 0 395.257 3.151 20 5 GGBDRN COCCNc1nnc(Sc2cc(C(F)(F)F)ncc2[N+](=O)[O-])s1 ZINC000278294486 565549984 /nfs/dbraw/zinc/54/99/84/565549984.db2.gz GIVUPLHAJXCSED-UHFFFAOYSA-N 0 0 381.361 3.070 20 5 GGBDRN Cc1cc(N2CCC[C@H](Cn3ccnn3)C2)c(Br)cc1[N+](=O)[O-] ZINC000302683709 565549981 /nfs/dbraw/zinc/54/99/81/565549981.db2.gz PZBGZEUZMWPBGC-LBPRGKRZSA-N 0 0 380.246 3.174 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCn2cc(Br)cn2)c(Br)c1 ZINC000388282585 565550220 /nfs/dbraw/zinc/55/02/20/565550220.db2.gz RLJMFALHUIMNSL-UHFFFAOYSA-N 0 0 390.035 3.428 20 5 GGBDRN Cc1cnn(C[C@@H]2CN(c3cc(C)c([N+](=O)[O-])cc3Br)CCO2)c1 ZINC000302702122 565551118 /nfs/dbraw/zinc/55/11/18/565551118.db2.gz VFZMJUHHYVWNBB-ZDUSSCGKSA-N 0 0 395.257 3.076 20 5 GGBDRN Cc1cc(N2CCCN(C(=O)C3CC3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000302695038 565551171 /nfs/dbraw/zinc/55/11/71/565551171.db2.gz SMNFFCLJNWOGCK-UHFFFAOYSA-N 0 0 382.258 3.114 20 5 GGBDRN C[C@@](CO)(CNc1ncc([N+](=O)[O-])cc1Br)Cc1ccccc1 ZINC000302724154 565552045 /nfs/dbraw/zinc/55/20/45/565552045.db2.gz NSLSXAJHLSJLSS-INIZCTEOSA-N 0 0 380.242 3.406 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)Cc1ccc(F)cc1Br ZINC000302725171 565552147 /nfs/dbraw/zinc/55/21/47/565552147.db2.gz OLPVTDUKSYXORA-UHFFFAOYSA-N 0 0 396.216 3.492 20 5 GGBDRN C[C@H]1C[C@H](CNc2ccc(I)cc2[N+](=O)[O-])CCO1 ZINC000389018603 565552765 /nfs/dbraw/zinc/55/27/65/565552765.db2.gz LTTXTTYOKOFFEO-VHSXEESVSA-N 0 0 376.194 3.426 20 5 GGBDRN CC(C)c1cnc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000190723522 565554411 /nfs/dbraw/zinc/55/44/11/565554411.db2.gz SVHCOWBUOXWPGF-UHFFFAOYSA-N 0 0 382.829 3.083 20 5 GGBDRN CN(CC(=O)Nc1ccc(Br)cn1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000302742496 565554532 /nfs/dbraw/zinc/55/45/32/565554532.db2.gz DHZWRVRMFDCWNM-UHFFFAOYSA-N 0 0 399.632 3.481 20 5 GGBDRN COC(=O)[C@@](C)(CNc1ncc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000302764486 565555825 /nfs/dbraw/zinc/55/58/25/565555825.db2.gz LDSQZAKFLXTTGW-INIZCTEOSA-N 0 0 394.225 3.295 20 5 GGBDRN C[C@H]1CCN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000302761559 565555862 /nfs/dbraw/zinc/55/58/62/565555862.db2.gz XMKHZQSHSZGHIV-VIFPVBQESA-N 0 0 384.401 3.220 20 5 GGBDRN COC(=O)c1cnc(NCc2ccc(F)cc2Br)c([N+](=O)[O-])c1 ZINC000302772326 565555955 /nfs/dbraw/zinc/55/59/55/565555955.db2.gz NJHNWHUVZHWEBO-UHFFFAOYSA-N 0 0 384.161 3.290 20 5 GGBDRN COC(=O)c1cnc(NC[C@@H](O)c2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000302777827 565555977 /nfs/dbraw/zinc/55/59/77/565555977.db2.gz PQMWMJSWGYFTSA-GFCCVEGCSA-N 0 0 386.191 3.229 20 5 GGBDRN COC(=O)c1cnc(N2CCc3ccc(Br)cc32)c([N+](=O)[O-])c1 ZINC000302784782 565556340 /nfs/dbraw/zinc/55/63/40/565556340.db2.gz VAMMUHTVPYHTNX-UHFFFAOYSA-N 0 0 378.182 3.233 20 5 GGBDRN COC(=O)c1cnc(NCc2cc(F)ccc2Br)c([N+](=O)[O-])c1 ZINC000302787071 565556612 /nfs/dbraw/zinc/55/66/12/565556612.db2.gz WWPQOPCHZNGOGK-UHFFFAOYSA-N 0 0 384.161 3.290 20 5 GGBDRN COC(=O)c1cnc(Sc2nc3cc(Cl)ccc3n2C)c([N+](=O)[O-])c1 ZINC000302791604 565556729 /nfs/dbraw/zinc/55/67/29/565556729.db2.gz YVJOKYJWLGDBSI-UHFFFAOYSA-N 0 0 378.797 3.468 20 5 GGBDRN Cc1nc(N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Br ZINC000302780564 565556828 /nfs/dbraw/zinc/55/68/28/565556828.db2.gz IRCGOCYSNNQGBC-NSHDSACASA-N 0 0 378.230 3.147 20 5 GGBDRN COC(=O)c1cnc(N(C)Cc2cc(Br)ccc2F)c([N+](=O)[O-])c1 ZINC000302790083 565557012 /nfs/dbraw/zinc/55/70/12/565557012.db2.gz YFIOJLKPVDOEDK-UHFFFAOYSA-N 0 0 398.188 3.314 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC(Oc3ncccc3F)CC2)c(Br)c1 ZINC000278454391 565559738 /nfs/dbraw/zinc/55/97/38/565559738.db2.gz LVFCQLGRCTZYGK-UHFFFAOYSA-N 0 0 397.204 3.334 20 5 GGBDRN COC(=O)[C@@H](CNc1ncc(Br)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000302852578 565559956 /nfs/dbraw/zinc/55/99/56/565559956.db2.gz QIZFIXGRAZMNRW-LBPRGKRZSA-N 0 0 398.188 3.260 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000278452978 565560022 /nfs/dbraw/zinc/56/00/22/565560022.db2.gz WLUAHPJMEDUMSH-SSDOTTSWSA-N 0 0 381.357 3.110 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)ccc1Br ZINC000278460984 565560245 /nfs/dbraw/zinc/56/02/45/565560245.db2.gz ZVXKGXMJIKTICG-GWCFXTLKSA-N 0 0 397.191 3.493 20 5 GGBDRN Cc1cnc([C@H](NS(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C2CC2)s1 ZINC000173487133 565560646 /nfs/dbraw/zinc/56/06/46/565560646.db2.gz RFVWBPJYKNGJCK-OAHLLOKOSA-N 0 0 381.479 3.406 20 5 GGBDRN CN1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2cc(Cl)ccc21 ZINC000173479876 565561003 /nfs/dbraw/zinc/56/10/03/565561003.db2.gz WSOGRDVCTNBTFS-UHFFFAOYSA-N 0 0 381.841 3.283 20 5 GGBDRN COc1cccc2c1CCN(c1ncc(Br)cc1[N+](=O)[O-])CC2 ZINC000302867162 565561452 /nfs/dbraw/zinc/56/14/52/565561452.db2.gz WCHBEUWYFMLCMC-UHFFFAOYSA-N 0 0 378.226 3.366 20 5 GGBDRN C[C@@H]1CSCCN(c2ccc([N+](=O)[O-])c(N3CCSC[C@@H](C)C3)n2)C1 ZINC000302864756 565561718 /nfs/dbraw/zinc/56/17/18/565561718.db2.gz XPZQUPFYJDJUCM-KBPBESRZSA-N 0 0 382.555 3.368 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCc1ccc(Br)cc1 ZINC000391772325 565563033 /nfs/dbraw/zinc/56/30/33/565563033.db2.gz GIWOLXHZXQPMRK-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN O=C(Nc1cncnc1N1CCCC1)c1sc(Br)cc1[N+](=O)[O-] ZINC000278508576 565563768 /nfs/dbraw/zinc/56/37/68/565563768.db2.gz LDSBORGESABGDO-UHFFFAOYSA-N 0 0 398.242 3.061 20 5 GGBDRN O=C(NCc1cc(Br)cc2c1OCC2)c1ccc([N+](=O)[O-])cc1F ZINC000392349453 565564040 /nfs/dbraw/zinc/56/40/40/565564040.db2.gz LYINSFIPIFWOBH-UHFFFAOYSA-N 0 0 395.184 3.361 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000173533388 565564898 /nfs/dbraw/zinc/56/48/98/565564898.db2.gz FBOGLOGGWGNZOW-UHFFFAOYSA-N 0 0 399.347 3.030 20 5 GGBDRN C[C@@H]1CCC[C@H](NS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000303182494 565568260 /nfs/dbraw/zinc/56/82/60/565568260.db2.gz KOURQLNJKJLIIK-KOLCDFICSA-N 0 0 377.260 3.214 20 5 GGBDRN C[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000303182495 565568556 /nfs/dbraw/zinc/56/85/56/565568556.db2.gz KOURQLNJKJLIIK-MWLCHTKSSA-N 0 0 377.260 3.214 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCC[C@H]2CCC[C@@H]21 ZINC000173589928 565569727 /nfs/dbraw/zinc/56/97/27/565569727.db2.gz NJWRCNKVULCQIK-PWSUYJOCSA-N 0 0 389.271 3.311 20 5 GGBDRN C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000278658932 565570869 /nfs/dbraw/zinc/57/08/69/565570869.db2.gz GMXDDABAKVXPPC-MRVPVSSYSA-N 0 0 375.328 3.326 20 5 GGBDRN C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000278658937 565570889 /nfs/dbraw/zinc/57/08/89/565570889.db2.gz GMXDDABAKVXPPC-QMMMGPOBSA-N 0 0 375.328 3.326 20 5 GGBDRN Cc1c(Cn2nnnc2Cc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000303566296 565571120 /nfs/dbraw/zinc/57/11/20/565571120.db2.gz ODZXLJIQNBAIGY-UHFFFAOYSA-N 0 0 388.225 3.291 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCc1nnc(C2CC2)o1 ZINC000278742941 565575685 /nfs/dbraw/zinc/57/56/85/565575685.db2.gz LVQVIWDFRHFOQN-UHFFFAOYSA-N 0 0 386.149 3.072 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2nc(C(F)(F)F)cs2)c1 ZINC000173722357 565579396 /nfs/dbraw/zinc/57/93/96/565579396.db2.gz SXDUZTWGZIDJMA-UHFFFAOYSA-N 0 0 375.328 3.351 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)c1[N+](=O)[O-] ZINC000278843003 565581076 /nfs/dbraw/zinc/58/10/76/565581076.db2.gz DIZVDWCEYOMVJV-LURJTMIESA-N 0 0 377.348 3.408 20 5 GGBDRN Cc1ccc(I)cc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000312364691 565582337 /nfs/dbraw/zinc/58/23/37/565582337.db2.gz HNQOZAHJDMMHSB-UHFFFAOYSA-N 0 0 385.161 3.099 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC([C@H]2CCCO2)CC1 ZINC000191096795 565582909 /nfs/dbraw/zinc/58/29/09/565582909.db2.gz DVITUMDPPNNTAD-OAHLLOKOSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)c1ccc([N+](=O)[O-])cc1Br ZINC000173792114 565585795 /nfs/dbraw/zinc/58/57/95/565585795.db2.gz WUYPSXPKCUUBCT-CABCVRRESA-N 0 0 393.241 3.468 20 5 GGBDRN O=C(N[C@H]1CCCC[C@@H]1n1cccn1)c1ccc([N+](=O)[O-])cc1Br ZINC000173792094 565586394 /nfs/dbraw/zinc/58/63/94/565586394.db2.gz WUYPSXPKCUUBCT-GJZGRUSLSA-N 0 0 393.241 3.468 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1cccc(Br)c1 ZINC000314783227 565587298 /nfs/dbraw/zinc/58/72/98/565587298.db2.gz KLKPTHQLGIGACI-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(Br)cc1 ZINC000314603697 565587651 /nfs/dbraw/zinc/58/76/51/565587651.db2.gz DEXXYTUUOBLWCI-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000173807340 565588700 /nfs/dbraw/zinc/58/87/00/565588700.db2.gz HCVRNDMPGBAHKE-CQSZACIVSA-N 0 0 388.804 3.053 20 5 GGBDRN Cc1csc([C@@H]2CCCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000173818546 565589376 /nfs/dbraw/zinc/58/93/76/565589376.db2.gz KANCEXZEGNJGMY-CYBMUJFWSA-N 0 0 381.479 3.236 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C)C1 ZINC000407979359 565589491 /nfs/dbraw/zinc/58/94/91/565589491.db2.gz XQLNERKQCAJWID-SECBINFHSA-N 0 0 388.205 3.380 20 5 GGBDRN O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1sccc1Br ZINC000315460660 565590600 /nfs/dbraw/zinc/59/06/00/565590600.db2.gz RXAKCQOPPQICBB-UHFFFAOYSA-N 0 0 383.179 3.210 20 5 GGBDRN C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000408014113 565590778 /nfs/dbraw/zinc/59/07/78/565590778.db2.gz RVINEWRALOMECN-UWVGGRQHSA-N 0 0 377.260 3.024 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccncc2Br)c1C ZINC000316538451 565591592 /nfs/dbraw/zinc/59/15/92/565591592.db2.gz BGXPCQAPCLZCJF-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC000408050988 565592191 /nfs/dbraw/zinc/59/21/91/565592191.db2.gz HJQIDHQQPHSJSX-VHSXEESVSA-N 0 0 377.260 3.024 20 5 GGBDRN CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000173835967 565592285 /nfs/dbraw/zinc/59/22/85/565592285.db2.gz LNBSMKGPXYCDEM-JTQLQIEISA-N 0 0 395.384 3.500 20 5 GGBDRN CC(=O)N1CCN(c2ncc([N+](=O)[O-])cc2Br)CC12CCCCC2 ZINC000408038514 565592330 /nfs/dbraw/zinc/59/23/30/565592330.db2.gz MKHYPJLTDCYHSA-UHFFFAOYSA-N 0 0 397.273 3.124 20 5 GGBDRN COc1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000316869560 565593027 /nfs/dbraw/zinc/59/30/27/565593027.db2.gz KEYMWJNYJMQWKZ-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](CSc3ccccc3)C2)cc1 ZINC000173862065 565594734 /nfs/dbraw/zinc/59/47/34/565594734.db2.gz NAZDOZBOPZVVKW-CQSZACIVSA-N 0 0 378.475 3.398 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000173876435 565596047 /nfs/dbraw/zinc/59/60/47/565596047.db2.gz KPKVNAUKXKVIHB-RUZDIDTESA-N 0 0 382.825 3.393 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H](C)CC ZINC000173899306 565596385 /nfs/dbraw/zinc/59/63/85/565596385.db2.gz HKSKYVMCZZIYHD-NOZJJQNGSA-N 0 0 387.230 3.065 20 5 GGBDRN COC(=O)c1cccc(NC(=O)Cc2ccccc2[N+](=O)[O-])c1Br ZINC000191333418 565597268 /nfs/dbraw/zinc/59/72/68/565597268.db2.gz WBENNGJDJKQPIK-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)C1CCC(C(F)(F)F)CC1)CC2 ZINC000408191490 565597609 /nfs/dbraw/zinc/59/76/09/565597609.db2.gz IEWZLYCEBHCLJI-UHFFFAOYSA-N 0 0 378.372 3.408 20 5 GGBDRN O=C(NCCCn1cc(Br)cn1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000319287477 565597832 /nfs/dbraw/zinc/59/78/32/565597832.db2.gz GVPZBKAQOQDGPW-UHFFFAOYSA-N 0 0 387.621 3.027 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccc(Br)cc3)o2)c1 ZINC000173922399 565598990 /nfs/dbraw/zinc/59/89/90/565598990.db2.gz RRQMRYMTSAMAHE-UHFFFAOYSA-N 0 0 396.226 3.396 20 5 GGBDRN C[C@@H](N[C@@H](C(N)=O)c1ccc(Br)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000173964401 565602694 /nfs/dbraw/zinc/60/26/94/565602694.db2.gz SHCYRJLYYQDESU-RFAUZJTJSA-N 0 0 396.216 3.374 20 5 GGBDRN CCn1nccc1C1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000279226025 565602667 /nfs/dbraw/zinc/60/26/67/565602667.db2.gz ZLNXNQFAJQFZLV-UHFFFAOYSA-N 0 0 380.246 3.353 20 5 GGBDRN Cc1ccc(NS(C)(=O)=O)c(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000173984668 565604116 /nfs/dbraw/zinc/60/41/16/565604116.db2.gz QXIZORCUEBJZJC-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN Cc1cc(N2C[C@H](C)O[C@@]3(CCCOC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000408336498 565604437 /nfs/dbraw/zinc/60/44/37/565604437.db2.gz AVMZVUZAQFJSGW-LRDDRELGSA-N 0 0 385.258 3.440 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)cccc1[N+](=O)[O-] ZINC000191453232 565605965 /nfs/dbraw/zinc/60/59/65/565605965.db2.gz PJCWLBPXQRZVLI-UHFFFAOYSA-N 0 0 382.825 3.141 20 5 GGBDRN Cc1cccc(C(=O)NCCCCn2cc(Br)cn2)c1[N+](=O)[O-] ZINC000279292370 565606167 /nfs/dbraw/zinc/60/61/67/565606167.db2.gz COMQATROKDRKNT-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nc([C@H](C)OCC(C)C)no1 ZINC000174015657 565606318 /nfs/dbraw/zinc/60/63/18/565606318.db2.gz IHEFFGBBYZNEGP-QMMMGPOBSA-N 0 0 388.222 3.027 20 5 GGBDRN CC(C)C[C@]1(CO)CCCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000191473411 565606833 /nfs/dbraw/zinc/60/68/33/565606833.db2.gz GORMXAATMQGKPA-INIZCTEOSA-N 0 0 385.258 3.371 20 5 GGBDRN C[C@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC[S@](=O)C1 ZINC000408390937 565607149 /nfs/dbraw/zinc/60/71/49/565607149.db2.gz ABGHEYRKTLKCGZ-VCGICTTQSA-N 0 0 398.282 3.110 20 5 GGBDRN CC(C)C[C@@]1(CO)CCCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000191492842 565608344 /nfs/dbraw/zinc/60/83/44/565608344.db2.gz PRINIZNRRHJXEE-MRXNPFEDSA-N 0 0 385.258 3.371 20 5 GGBDRN C[C@@H]1[C@@H](C)CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000408445579 565609524 /nfs/dbraw/zinc/60/95/24/565609524.db2.gz ADWZTDZPVUERBU-VHSXEESVSA-N 0 0 377.260 3.166 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]3CCC[C@H]32)c(Br)c1 ZINC000408446645 565609602 /nfs/dbraw/zinc/60/96/02/565609602.db2.gz OHFQDKYQHKDJKX-GXFFZTMASA-N 0 0 389.271 3.311 20 5 GGBDRN C[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H]1C ZINC000408445581 565609877 /nfs/dbraw/zinc/60/98/77/565609877.db2.gz ADWZTDZPVUERBU-ZJUUUORDSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000408446460 565609937 /nfs/dbraw/zinc/60/99/37/565609937.db2.gz LPMRQJRMYFLGAU-UWVGGRQHSA-N 0 0 377.260 3.024 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]3CCC[C@H]32)c(Br)c1 ZINC000408446647 565609968 /nfs/dbraw/zinc/60/99/68/565609968.db2.gz OHFQDKYQHKDJKX-ZWNOBZJWSA-N 0 0 389.271 3.311 20 5 GGBDRN CC(C)C[C@@]1(CO)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000191515903 565610254 /nfs/dbraw/zinc/61/02/54/565610254.db2.gz YYKSHPWRNNZZOY-QGZVFWFLSA-N 0 0 399.285 3.299 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCc2ccc(O)cc2C1 ZINC000322758226 565610300 /nfs/dbraw/zinc/61/03/00/565610300.db2.gz YZSRFZNIFAGCJF-UHFFFAOYSA-N 0 0 377.194 3.261 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C(C)(C)C1 ZINC000408447544 565610541 /nfs/dbraw/zinc/61/05/41/565610541.db2.gz YHTBBVRFFMSLKM-VIFPVBQESA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1cc(N2C[C@H](C)OC3(CCOCC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000408450824 565611106 /nfs/dbraw/zinc/61/11/06/565611106.db2.gz IYKSMDQSCIKTRM-LBPRGKRZSA-N 0 0 385.258 3.440 20 5 GGBDRN Cc1nc(NC(=O)CCOc2ccccc2[N+](=O)[O-])ccc1Br ZINC000174095271 565612280 /nfs/dbraw/zinc/61/22/80/565612280.db2.gz KEACHIPWPGWCNJ-UHFFFAOYSA-N 0 0 380.198 3.468 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc(Br)c(C)n2)cc([N+](=O)[O-])c1 ZINC000174092506 565612557 /nfs/dbraw/zinc/61/25/57/565612557.db2.gz NFOOLQDLZUIRIN-UHFFFAOYSA-N 0 0 394.181 3.100 20 5 GGBDRN Cc1cc(NC2CCC(S(C)(=O)=O)CC2)c(Br)cc1[N+](=O)[O-] ZINC000191563659 565613403 /nfs/dbraw/zinc/61/34/03/565613403.db2.gz HDPMDIAGTRKMGJ-UHFFFAOYSA-N 0 0 391.287 3.433 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])c2cccc(Cl)c2O1 ZINC000191567659 565613437 /nfs/dbraw/zinc/61/34/37/565613437.db2.gz QDOIPWUADGUDDC-NSHDSACASA-N 0 0 382.825 3.366 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCc2cc(Br)ccc2C1 ZINC000191573949 565614322 /nfs/dbraw/zinc/61/43/22/565614322.db2.gz WSHFPDSCNWJQML-UHFFFAOYSA-N 0 0 375.222 3.485 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCCCCn2cc(Br)cn2)c1 ZINC000279463187 565614597 /nfs/dbraw/zinc/61/45/97/565614597.db2.gz QEFRJSYGJKZPLR-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCCc1ccc2c(c1)OCCO2 ZINC000323798741 565615072 /nfs/dbraw/zinc/61/50/72/565615072.db2.gz FUFHFVRLRQXPER-UHFFFAOYSA-N 0 0 380.198 3.178 20 5 GGBDRN COC(C)(C)CNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000174142528 565616523 /nfs/dbraw/zinc/61/65/23/565616523.db2.gz CNADKJGNKZPIFA-UHFFFAOYSA-N 0 0 387.223 3.242 20 5 GGBDRN COc1ccc(CSCC(=O)Nc2nnc(C(F)F)s2)cc1[N+](=O)[O-] ZINC000409463875 565616938 /nfs/dbraw/zinc/61/69/38/565616938.db2.gz MRAVWVFDJBUFSB-UHFFFAOYSA-N 0 0 390.393 3.264 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCCCCn1cc(Br)cn1 ZINC000279524499 565618136 /nfs/dbraw/zinc/61/81/36/565618136.db2.gz VNALKHZVMVQTPF-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN CCOC1CC(CCNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])C1 ZINC000191623515 565618558 /nfs/dbraw/zinc/61/85/58/565618558.db2.gz XOTQYKGACUKSRD-UHFFFAOYSA-N 0 0 378.397 3.208 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CCSC2(CCOCC2)C1 ZINC000279599020 565622132 /nfs/dbraw/zinc/62/21/32/565622132.db2.gz WWBMZPCEMRMVHT-UHFFFAOYSA-N 0 0 386.857 3.137 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1cc(Br)cc2c1OCC2 ZINC000325713675 565622483 /nfs/dbraw/zinc/62/24/83/565622483.db2.gz VXGVWVCBIXNTJM-UHFFFAOYSA-N 0 0 391.221 3.151 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(Br)c(F)c2)c(C)c1[N+](=O)[O-] ZINC000174240105 565623219 /nfs/dbraw/zinc/62/32/19/565623219.db2.gz LRPHPLZVKWEOSQ-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN CO[C@@H]1[C@@H](C)[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C1(C)C ZINC000409543697 565623351 /nfs/dbraw/zinc/62/33/51/565623351.db2.gz MNXWPGHSBDZLSK-MQOMDTIOSA-N 0 0 377.260 3.208 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000279631864 565624857 /nfs/dbraw/zinc/62/48/57/565624857.db2.gz ZNVMGSQATSIFKI-UHFFFAOYSA-N 0 0 383.451 3.080 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCc3ccc(O)cc3C2)cc1[N+](=O)[O-] ZINC000326709214 565625189 /nfs/dbraw/zinc/62/51/89/565625189.db2.gz WWUFLRYYZJNKNT-UHFFFAOYSA-N 0 0 382.825 3.009 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000279696351 565628393 /nfs/dbraw/zinc/62/83/93/565628393.db2.gz MHFXHNZGGNPBMT-CYBMUJFWSA-N 0 0 395.213 3.195 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1Br ZINC000191753747 565629253 /nfs/dbraw/zinc/62/92/53/565629253.db2.gz RKWMGFKZKMYZRN-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H](C[S@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000174328616 565629904 /nfs/dbraw/zinc/62/99/04/565629904.db2.gz JFQLPKFTACSGPE-SXBQZSJRSA-N 0 0 378.475 3.166 20 5 GGBDRN CN(Cc1cn(-c2cccc(Br)c2)nn1)c1ncc([N+](=O)[O-])s1 ZINC000409641939 565630079 /nfs/dbraw/zinc/63/00/79/565630079.db2.gz YFKXMEWWKAQEBB-UHFFFAOYSA-N 0 0 395.242 3.031 20 5 GGBDRN Cc1cc(N2CCC[C@@H](S(C)(=O)=O)CC2)c(Br)cc1[N+](=O)[O-] ZINC000409673941 565632851 /nfs/dbraw/zinc/63/28/51/565632851.db2.gz XVEPMUAFJPZYPT-LLVKDONJSA-N 0 0 391.287 3.069 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000279765570 565633213 /nfs/dbraw/zinc/63/32/13/565633213.db2.gz UWKDRWYNZMDAAM-CYBMUJFWSA-N 0 0 395.213 3.195 20 5 GGBDRN CO[C@]1(C)CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000279823265 565634859 /nfs/dbraw/zinc/63/48/59/565634859.db2.gz DQPKULWVOVNHFI-CQSZACIVSA-N 0 0 375.194 3.138 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(c2ccccc2)[C@H]2CCOC2)c(Cl)c1 ZINC000191830462 565635534 /nfs/dbraw/zinc/63/55/34/565635534.db2.gz OEHLWCLOYGKSLL-AWEZNQCLSA-N 0 0 382.825 3.232 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000279881176 565638704 /nfs/dbraw/zinc/63/87/04/565638704.db2.gz HFFQKGVMFNOMOX-SECBINFHSA-N 0 0 395.213 3.227 20 5 GGBDRN Cc1c(CC(=O)N[C@@H](C)c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000279973443 565643435 /nfs/dbraw/zinc/64/34/35/565643435.db2.gz KLZNZECWXOLUKH-NSHDSACASA-N 0 0 378.226 3.481 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Oc1c(Br)ccc(C)c1F ZINC000279957799 565643499 /nfs/dbraw/zinc/64/34/99/565643499.db2.gz MKCWOZLLOUTLMW-UHFFFAOYSA-N 0 0 386.177 3.305 20 5 GGBDRN Cc1c(CC(=O)N[C@H](C)c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000279973442 565643735 /nfs/dbraw/zinc/64/37/35/565643735.db2.gz KLZNZECWXOLUKH-LLVKDONJSA-N 0 0 378.226 3.481 20 5 GGBDRN C[C@@H](CCc1cccn1C)NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000174591529 565645462 /nfs/dbraw/zinc/64/54/62/565645462.db2.gz PMNLSGQASVKJPQ-NSHDSACASA-N 0 0 380.242 3.447 20 5 GGBDRN Cc1cnc([C@@H](NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)C2CC2)s1 ZINC000191990781 565648523 /nfs/dbraw/zinc/64/85/23/565648523.db2.gz ZXSXLXDUASSFBI-HNNXBMFYSA-N 0 0 381.479 3.406 20 5 GGBDRN COc1cc(CCNc2cncc(Br)c2)c([N+](=O)[O-])cc1OC ZINC000174674559 565650949 /nfs/dbraw/zinc/65/09/49/565650949.db2.gz WJLRYRIFVIBLQN-UHFFFAOYSA-N 0 0 382.214 3.424 20 5 GGBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000280092233 565651631 /nfs/dbraw/zinc/65/16/31/565651631.db2.gz QVTHJCVWYVOKGH-VIFPVBQESA-N 0 0 395.213 3.227 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000280110905 565652859 /nfs/dbraw/zinc/65/28/59/565652859.db2.gz KLARHPVVHLEIER-FIRCGALFSA-N 0 0 390.864 3.126 20 5 GGBDRN C[C@H]1CCS(=O)(=O)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000192056124 565652945 /nfs/dbraw/zinc/65/29/45/565652945.db2.gz LOBSMRXEGSZHEF-ZDUSSCGKSA-N 0 0 380.491 3.332 20 5 GGBDRN C[C@@H]1CCS(=O)(=O)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000192056117 565653181 /nfs/dbraw/zinc/65/31/81/565653181.db2.gz LOBSMRXEGSZHEF-CYBMUJFWSA-N 0 0 380.491 3.332 20 5 GGBDRN CO[C@]1(C)CCCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])CC1 ZINC000280161764 565655590 /nfs/dbraw/zinc/65/55/90/565655590.db2.gz YOXSANZIKCIBPL-CYBMUJFWSA-N 0 0 377.260 3.450 20 5 GGBDRN CC[C@](C)(O)CNC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000174796777 565659993 /nfs/dbraw/zinc/65/99/93/565659993.db2.gz XSBCZPYHTKCODD-INIZCTEOSA-N 0 0 381.479 3.402 20 5 GGBDRN Cc1cc(CNC(=O)c2cccc([N+](=O)[O-])c2)ccc1I ZINC000410033337 565660330 /nfs/dbraw/zinc/66/03/30/565660330.db2.gz NJWYZYDZQOTHBM-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCSC[C@H]2c2nccs2)cc1[N+](=O)[O-] ZINC000192145847 565662159 /nfs/dbraw/zinc/66/21/59/565662159.db2.gz FSIQUSYWPHTOIF-ZDUSSCGKSA-N 0 0 399.519 3.147 20 5 GGBDRN C[C@@H]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Br)CCS1 ZINC000192175545 565665407 /nfs/dbraw/zinc/66/54/07/565665407.db2.gz PLLWSYLPRBPQHL-SNVBAGLBSA-N 0 0 388.287 3.123 20 5 GGBDRN C[C@H]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Br)CCS1 ZINC000192175552 565665833 /nfs/dbraw/zinc/66/58/33/565665833.db2.gz PLLWSYLPRBPQHL-JTQLQIEISA-N 0 0 388.287 3.123 20 5 GGBDRN C[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000280342340 565666748 /nfs/dbraw/zinc/66/67/48/565666748.db2.gz IKDJOILMAVHXBA-LLVKDONJSA-N 0 0 393.241 3.066 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCCC[C@H]2OC(F)F)c(Cl)c1 ZINC000410167414 565668060 /nfs/dbraw/zinc/66/80/60/565668060.db2.gz ALLWDVUBYJDQET-GHMZBOCLSA-N 0 0 384.788 3.077 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@@H]2CCCC[C@H]2OC(F)F)cc1[N+](=O)[O-] ZINC000410180106 565669409 /nfs/dbraw/zinc/66/94/09/565669409.db2.gz WXQQDKZQMYLIOJ-DGCLKSJQSA-N 0 0 398.815 3.385 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCc3cc(Cl)ccc3C2)cc1 ZINC000192243683 565674385 /nfs/dbraw/zinc/67/43/85/565674385.db2.gz IJQVVVJCJCJYBV-UHFFFAOYSA-N 0 0 380.853 3.080 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC(c2ccncc2)CC1 ZINC000192260951 565675342 /nfs/dbraw/zinc/67/53/42/565675342.db2.gz NIIYVZVZVAFGTQ-UHFFFAOYSA-N 0 0 381.841 3.212 20 5 GGBDRN O=C(CC1CCC1)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000175032865 565676257 /nfs/dbraw/zinc/67/62/57/565676257.db2.gz GHPUSQNUDNVVDJ-UHFFFAOYSA-N 0 0 381.435 3.013 20 5 GGBDRN O=C(CSCC(=O)c1ccc(Cl)cc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000175030547 565676288 /nfs/dbraw/zinc/67/62/88/565676288.db2.gz WKWKWEXQHHAGLW-UHFFFAOYSA-N 0 0 378.837 3.481 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1Cc1c(F)ccc(Br)c1F ZINC000410314048 565676836 /nfs/dbraw/zinc/67/68/36/565676836.db2.gz CGKIJUIOZPWABH-UHFFFAOYSA-N 0 0 379.544 3.499 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](C)c1ccc(Br)cn1 ZINC000280526898 565677248 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O=C(NCc1nc2cc(F)ccc2[nH]1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177351495 565844242 /nfs/dbraw/zinc/84/42/42/565844242.db2.gz TXIDBUCBNFJVSD-UHFFFAOYSA-N 0 0 393.172 3.303 20 5 GGBDRN COc1cc(OCC(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)ccc1[N+](=O)[O-] ZINC000284143154 565844616 /nfs/dbraw/zinc/84/46/16/565844616.db2.gz PWGIJZFXGXOOGZ-DZGCQCFKSA-N 0 0 389.235 3.025 20 5 GGBDRN C[C@H]1C[C@H](C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CCO1 ZINC000284169822 565845417 /nfs/dbraw/zinc/84/54/17/565845417.db2.gz RLHWGEXRCJCUSZ-WDEREUQCSA-N 0 0 383.242 3.057 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc([N+](=O)[O-])c1 ZINC000284208685 565845807 /nfs/dbraw/zinc/84/58/07/565845807.db2.gz UJZBLVOBDAZQDV-SWLSCSKDSA-N 0 0 387.219 3.037 20 5 GGBDRN C[C@@H]1C[C@@H](C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CCO1 ZINC000284169815 565845891 /nfs/dbraw/zinc/84/58/91/565845891.db2.gz RLHWGEXRCJCUSZ-MNOVXSKESA-N 0 0 383.242 3.057 20 5 GGBDRN COCCC[C@@H](C)C(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284255841 565846253 /nfs/dbraw/zinc/84/62/53/565846253.db2.gz XIHOQOWCMGETEZ-LLVKDONJSA-N 0 0 385.258 3.305 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(c2ncc(Br)cc2Cl)CC1 ZINC000413328449 565847238 /nfs/dbraw/zinc/84/72/38/565847238.db2.gz IYCBKBXIRNBUJX-UHFFFAOYSA-N 0 0 398.648 3.127 20 5 GGBDRN COCCC[C@H](C)C(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284255845 565847799 /nfs/dbraw/zinc/84/77/99/565847799.db2.gz XIHOQOWCMGETEZ-NSHDSACASA-N 0 0 385.258 3.305 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC2(C1)CCOCC2 ZINC000284267045 565848186 /nfs/dbraw/zinc/84/81/86/565848186.db2.gz HIDIXNUJJTUABB-UHFFFAOYSA-N 0 0 383.242 3.308 20 5 GGBDRN COC(=O)c1cccc2c1CCN(c1ncc([N+](=O)[O-])cc1Br)C2 ZINC000413372782 565848199 /nfs/dbraw/zinc/84/81/99/565848199.db2.gz XVGHUHIQERYMPD-UHFFFAOYSA-N 0 0 392.209 3.102 20 5 GGBDRN NC(=O)c1cccc(N2CCC[C@H]2c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000413369398 565848214 /nfs/dbraw/zinc/84/82/14/565848214.db2.gz GDKVBQSAVXYXOW-ZDUSSCGKSA-N 0 0 391.225 3.193 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1ccc(F)cc1Br ZINC000194935880 565848988 /nfs/dbraw/zinc/84/89/88/565848988.db2.gz OVOJDTRXPMLAPZ-UHFFFAOYSA-N 0 0 382.189 3.225 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cc(F)ccc2Br)c1 ZINC000194943597 565849186 /nfs/dbraw/zinc/84/91/86/565849186.db2.gz YNNJSVCGJRNEOV-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN NC(=O)c1ccc(N2CCC[C@H]2c2ccc(Br)cn2)c([N+](=O)[O-])c1 ZINC000413374411 565849248 /nfs/dbraw/zinc/84/92/48/565849248.db2.gz LHXQCYXCRMXELH-ZDUSSCGKSA-N 0 0 391.225 3.193 20 5 GGBDRN Cc1ncc(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)s1 ZINC000284380192 565851527 /nfs/dbraw/zinc/85/15/27/565851527.db2.gz FYCFOBDVYIBHBW-UHFFFAOYSA-N 0 0 382.239 3.321 20 5 GGBDRN CCOC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CC1 ZINC000284365305 565851581 /nfs/dbraw/zinc/85/15/81/565851581.db2.gz OUJRUGHLISYZQN-UHFFFAOYSA-N 0 0 399.241 3.081 20 5 GGBDRN C[C@@H]1CN(C(=O)CSc2ccc(Br)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000177453261 565851689 /nfs/dbraw/zinc/85/16/89/565851689.db2.gz 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O=[N+]([O-])c1cnc(NC2CCN(CC(F)(F)F)CC2)c(Br)c1 ZINC000177544676 565858228 /nfs/dbraw/zinc/85/82/28/565858228.db2.gz OOSHIYHBOPGKEC-UHFFFAOYSA-N 0 0 383.168 3.191 20 5 GGBDRN O=C(CN1C[C@@H]2CCCC[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000177537772 565858282 /nfs/dbraw/zinc/85/82/82/565858282.db2.gz AGDAQDXWVSTCBK-TXEJJXNPSA-N 0 0 382.258 3.418 20 5 GGBDRN Cc1noc(C)c1C(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284564723 565858621 /nfs/dbraw/zinc/85/86/21/565858621.db2.gz QSFZUACMGDJXSP-UHFFFAOYSA-N 0 0 380.198 3.161 20 5 GGBDRN CC(C)n1nccc1[C@H]1OCC[C@@H]1Nc1ncc([N+](=O)[O-])cc1Br ZINC000284547055 565858967 /nfs/dbraw/zinc/85/89/67/565858967.db2.gz MGQXZOUDEPTUNX-JSGCOSHPSA-N 0 0 396.245 3.472 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000284593316 565860671 /nfs/dbraw/zinc/86/06/71/565860671.db2.gz SJJMPBCYNMXPLK-GXTWGEPZSA-N 0 0 388.207 3.467 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000177579343 565860874 /nfs/dbraw/zinc/86/08/74/565860874.db2.gz HAEIAUNYZMYTMT-VIFPVBQESA-N 0 0 388.804 3.435 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000284593320 565861561 /nfs/dbraw/zinc/86/15/61/565861561.db2.gz SJJMPBCYNMXPLK-OCCSQVGLSA-N 0 0 388.207 3.467 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCC2(CCOCC2)CC1 ZINC000284618848 565862605 /nfs/dbraw/zinc/86/26/05/565862605.db2.gz UPBHFQXTERRNDP-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN O=C1CCCC[C@H]1[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000177620688 565862927 /nfs/dbraw/zinc/86/29/27/565862927.db2.gz BGXGAKJHXUKMRT-STQMWFEESA-N 0 0 386.857 3.161 20 5 GGBDRN Cc1cccc(I)c1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000177625307 565863219 /nfs/dbraw/zinc/86/32/19/565863219.db2.gz NILSNCVDQBBCSG-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN CCOC(=O)c1csc(N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000177630321 565864499 /nfs/dbraw/zinc/86/44/99/565864499.db2.gz YZKCKTDDTDHVAC-UHFFFAOYSA-N 0 0 383.813 3.087 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc2c(cc1Br)CCC2 ZINC000195208857 565866173 /nfs/dbraw/zinc/86/61/73/565866173.db2.gz DBOITBYJWOMDII-UHFFFAOYSA-N 0 0 393.241 3.380 20 5 GGBDRN CN(Cc1ccc([S@@](C)=O)cc1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000177673886 565866379 /nfs/dbraw/zinc/86/63/79/565866379.db2.gz BOLAEJWGMKOEHH-RUZDIDTESA-N 0 0 378.475 3.083 20 5 GGBDRN COc1ccc(NC(=O)CN2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c([N+](=O)[O-])c1 ZINC000284719598 565867160 /nfs/dbraw/zinc/86/71/60/565867160.db2.gz JMVGOKQMTMRRBS-DZGCQCFKSA-N 0 0 388.251 3.058 20 5 GGBDRN CCCn1c(C)nnc1CN1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284757374 565868610 /nfs/dbraw/zinc/86/86/10/565868610.db2.gz LWDNTXBLXOLZRI-UHFFFAOYSA-N 0 0 394.273 3.226 20 5 GGBDRN COCc1noc([C@@H](C)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)n1 ZINC000284765620 565869304 /nfs/dbraw/zinc/86/93/04/565869304.db2.gz MISPBWIIFNBWDB-SECBINFHSA-N 0 0 397.229 3.006 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCn2c3ccccc3nc21 ZINC000195258290 565869752 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O=[N+]([O-])c1ccn(CCN2CCOc3cc(Br)c(Cl)cc32)n1 ZINC000177861496 565877552 /nfs/dbraw/zinc/87/75/52/565877552.db2.gz CPEXABLIAWHRKL-UHFFFAOYSA-N 0 0 387.621 3.106 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@H](c2cccc(Br)c2)C1 ZINC000195392862 565879169 /nfs/dbraw/zinc/87/91/69/565879169.db2.gz NMLHUCBSOYMUNR-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN Cc1ccc(-c2csc(C[S@](=O)CCn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000284961517 565880635 /nfs/dbraw/zinc/88/06/35/565880635.db2.gz DVZJMEIIZPWBKR-RUZDIDTESA-N 0 0 376.463 3.172 20 5 GGBDRN Cc1noc(C(C)(C)NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000284984057 565881552 /nfs/dbraw/zinc/88/15/52/565881552.db2.gz RQDSEUSTEIKBIC-UHFFFAOYSA-N 0 0 383.202 3.022 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCc2c(Br)cccc2C1 ZINC000195464862 565885978 /nfs/dbraw/zinc/88/59/78/565885978.db2.gz TZWVWRPKJXFPAY-UHFFFAOYSA-N 0 0 375.222 3.485 20 5 GGBDRN O=C(c1cccc(Cl)c1Cl)N1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000195509376 565889009 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C[C@@](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])(C(N)=O)c1cccc(Cl)c1 ZINC000178137299 565900082 /nfs/dbraw/zinc/90/00/82/565900082.db2.gz OCPIAXIVXKYNNE-INIZCTEOSA-N 0 0 382.203 3.032 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@@]1(C)CCCC[C@@H]1O ZINC000333984840 565907325 /nfs/dbraw/zinc/90/73/25/565907325.db2.gz JWODLOAXOIVCNW-GOEBONIOSA-N 0 0 385.258 3.337 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2csc(-c3ccco3)n2)ccc1[N+](=O)[O-] ZINC000178248954 565907937 /nfs/dbraw/zinc/90/79/37/565907937.db2.gz NHHQEPWTHCJPMS-UHFFFAOYSA-N 0 0 379.419 3.098 20 5 GGBDRN Cc1nn(CCc2nc(-c3ccc(Br)o3)no2)c(C)c1[N+](=O)[O-] ZINC000178275410 565909515 /nfs/dbraw/zinc/90/95/15/565909515.db2.gz QITFRCSWAGMXPP-UHFFFAOYSA-N 0 0 382.174 3.056 20 5 GGBDRN Cc1cnc(OCC(=O)N(C)Cc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000178280963 565909654 /nfs/dbraw/zinc/90/96/54/565909654.db2.gz MJRLDMXHTOVTJS-UHFFFAOYSA-N 0 0 394.225 3.098 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000178281106 565909853 /nfs/dbraw/zinc/90/98/53/565909853.db2.gz SHIXCIISJXZFDG-UHFFFAOYSA-N 0 0 392.209 3.246 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000178285890 565911271 /nfs/dbraw/zinc/91/12/71/565911271.db2.gz DXFCSNHHPZMGKB-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN O=C(NCCc1ccc2c(c1)CCO2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178317525 565912467 /nfs/dbraw/zinc/91/24/67/565912467.db2.gz JKILNUAWGNVUQW-UHFFFAOYSA-N 0 0 391.221 3.265 20 5 GGBDRN CCOC1CC2(C1)CCN(S(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C)C2 ZINC000285597644 565916128 /nfs/dbraw/zinc/91/61/28/565916128.db2.gz LWGHWQHXCLNGNP-UHFFFAOYSA-N 0 0 388.873 3.136 20 5 GGBDRN CCC(CC)[C@H](O)CNc1ccc(I)cc1[N+](=O)[O-] ZINC000225749817 565917040 /nfs/dbraw/zinc/91/70/40/565917040.db2.gz MIXSSFYWFBZGFK-CYBMUJFWSA-N 0 0 378.210 3.408 20 5 GGBDRN O=C(Nc1ccc(I)cc1Cl)c1ccc([N+](=O)[O-])[nH]1 ZINC000226386993 565919378 /nfs/dbraw/zinc/91/93/78/565919378.db2.gz SSPQAHKGVLQHSH-UHFFFAOYSA-N 0 0 391.552 3.433 20 5 GGBDRN Cc1cc(S(=O)(=O)N(CCCO)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000414384564 565920840 /nfs/dbraw/zinc/92/08/40/565920840.db2.gz CKHWWZHXLMRASI-UHFFFAOYSA-N 0 0 384.841 3.134 20 5 GGBDRN COc1ccc(Cl)cc1-c1nc(SCCn2ccc([N+](=O)[O-])n2)n[nH]1 ZINC000178468665 565920948 /nfs/dbraw/zinc/92/09/48/565920948.db2.gz FPDPZNHZJFZZHJ-UHFFFAOYSA-N 0 0 380.817 3.031 20 5 GGBDRN COc1cc(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)ccc1O ZINC000178512335 565923082 /nfs/dbraw/zinc/92/30/82/565923082.db2.gz MVYDJQZAIPGSOJ-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN O=C(NC[C@@H](CCO)c1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178556178 565925523 /nfs/dbraw/zinc/92/55/23/565925523.db2.gz KMJCZCHAXYQMSS-CYBMUJFWSA-N 0 0 393.237 3.253 20 5 GGBDRN CCOCCN(c1ccc(Cl)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000414409146 565925613 /nfs/dbraw/zinc/92/56/13/565925613.db2.gz MEYSYRKRDOTNJO-UHFFFAOYSA-N 0 0 384.841 3.480 20 5 GGBDRN O=C(NCCC1(O)CCC1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000285756500 565925915 /nfs/dbraw/zinc/92/59/15/565925915.db2.gz ZWKHXBRTEUMOIR-UHFFFAOYSA-N 0 0 377.622 3.046 20 5 GGBDRN Cc1c(CNC(=O)c2ccccc2I)cccc1[N+](=O)[O-] ZINC000231862760 565930869 /nfs/dbraw/zinc/93/08/69/565930869.db2.gz JVPHRFMHWGTWFE-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)Cc1ccc(Cl)c(OC)c1 ZINC000414429996 565931020 /nfs/dbraw/zinc/93/10/20/565931020.db2.gz VUIGASMQQZGZGI-UHFFFAOYSA-N 0 0 385.825 3.380 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCCC[C@H]1c1cc[nH]n1 ZINC000285894130 565932604 /nfs/dbraw/zinc/93/26/04/565932604.db2.gz DCXILYBGEXSOLB-AWEZNQCLSA-N 0 0 379.214 3.448 20 5 GGBDRN Cc1nccn1C[C@@H](C)CNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000178740407 565935082 /nfs/dbraw/zinc/93/50/82/565935082.db2.gz GGAPRVNTRYJOKC-JTQLQIEISA-N 0 0 395.257 3.237 20 5 GGBDRN COc1ccc(CSCc2nc(Cc3cncs3)no2)cc1[N+](=O)[O-] ZINC000350490270 565937276 /nfs/dbraw/zinc/93/72/76/565937276.db2.gz ONARXWYVPUQOSI-UHFFFAOYSA-N 0 0 378.435 3.467 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCC[C@H]1c1cc[nH]n1 ZINC000286000778 565937521 /nfs/dbraw/zinc/93/75/21/565937521.db2.gz MPNJRXRULKGJNC-AWEZNQCLSA-N 0 0 379.214 3.448 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cc(=O)[nH]c2c(Br)cccc12 ZINC000178849070 565941450 /nfs/dbraw/zinc/94/14/50/565941450.db2.gz WOAAUMWSBBJBOA-UHFFFAOYSA-N 0 0 388.177 3.451 20 5 GGBDRN CCCS(=O)(=O)Cc1noc([C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000350843874 565941780 /nfs/dbraw/zinc/94/17/80/565941780.db2.gz VBCYHPLZNCJIJS-SECBINFHSA-N 0 0 389.817 3.096 20 5 GGBDRN COc1cc(CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)ccc1O ZINC000178848554 565941925 /nfs/dbraw/zinc/94/19/25/565941925.db2.gz RFBGHCBKMXCBHI-UHFFFAOYSA-N 0 0 395.209 3.310 20 5 GGBDRN O=C(CCc1ccncc1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000286108850 565942948 /nfs/dbraw/zinc/94/29/48/565942948.db2.gz GDWLSWHSSDEAKL-UHFFFAOYSA-N 0 0 390.237 3.270 20 5 GGBDRN C[C@@]12CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])C[C@@H]1C2(Cl)Cl ZINC000286157308 565945250 /nfs/dbraw/zinc/94/52/50/565945250.db2.gz BLWOWOSDSSANMC-QWHCGFSZSA-N 0 0 379.265 3.018 20 5 GGBDRN C[C@@H](CN(C)S(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F)c1nccs1 ZINC000286199302 565947205 /nfs/dbraw/zinc/94/72/05/565947205.db2.gz ANERPXYTZCEVFQ-QMMMGPOBSA-N 0 0 393.849 3.268 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CC[C@H](C(F)(F)F)[C@@H](CO)C2)c(Br)c1 ZINC000286223273 565948318 /nfs/dbraw/zinc/94/83/18/565948318.db2.gz DCUJGUMOJDJOJZ-SCZZXKLOSA-N 0 0 383.164 3.354 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC[C@H](C(F)(F)F)[C@@H](CO)C1 ZINC000286211861 565948409 /nfs/dbraw/zinc/94/84/09/565948409.db2.gz CKJZXNDZTDCRQW-SCZZXKLOSA-N 0 0 383.164 3.354 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 ZINC000286211858 565948540 /nfs/dbraw/zinc/94/85/40/565948540.db2.gz CKJZXNDZTDCRQW-PSASIEDQSA-N 0 0 383.164 3.354 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000286234687 565949146 /nfs/dbraw/zinc/94/91/46/565949146.db2.gz CYAZJETVJXEMLH-NSHDSACASA-N 0 0 384.152 3.036 20 5 GGBDRN CCOC1CC2(C1)CCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)C2 ZINC000286243712 565949405 /nfs/dbraw/zinc/94/94/05/565949405.db2.gz MUJPWWPYBIYDEL-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000179028097 565953094 /nfs/dbraw/zinc/95/30/94/565953094.db2.gz DUSAOCQFPCMUGN-UHFFFAOYSA-N 0 0 380.857 3.228 20 5 GGBDRN COc1ccc(OC[C@@H](O)COc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000179048093 565954118 /nfs/dbraw/zinc/95/41/18/565954118.db2.gz CETPAOSKCARIRZ-LBPRGKRZSA-N 0 0 398.209 3.185 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2cccc(Br)c2)c(F)c1 ZINC000179066264 565955495 /nfs/dbraw/zinc/95/54/95/565955495.db2.gz MELNYLIWHFNOGU-GFCCVEGCSA-N 0 0 386.173 3.315 20 5 GGBDRN CO[C@@H](C)CN(C)C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000286378987 565956059 /nfs/dbraw/zinc/95/60/59/565956059.db2.gz LXOSJUJMQMGJBJ-VIFPVBQESA-N 0 0 387.223 3.194 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1N1CC[C@@H](C(F)(F)F)[C@H](CO)C1 ZINC000286426494 565959171 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O=C(COc1ccccc1Br)N1CCc2c1cccc2[N+](=O)[O-] ZINC000179324632 565972431 /nfs/dbraw/zinc/97/24/31/565972431.db2.gz AVWMPNMVPDOIRF-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN Cc1nc(-c2cc3c(s2)CCN(Cc2c([N+](=O)[O-])ncn2C)C3)cs1 ZINC000361999402 565975120 /nfs/dbraw/zinc/97/51/20/565975120.db2.gz XKLFLUQLNLBWFK-UHFFFAOYSA-N 0 0 375.479 3.380 20 5 GGBDRN COC(=O)CN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000179395135 565977794 /nfs/dbraw/zinc/97/77/94/565977794.db2.gz NWISBAYBULGBOI-UHFFFAOYSA-N 0 0 383.198 3.222 20 5 GGBDRN COc1ccc2c(c1)OCC[C@@H]2Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000362336504 565977991 /nfs/dbraw/zinc/97/79/91/565977991.db2.gz PVBGKMHIVZCPSK-NSHDSACASA-N 0 0 384.435 3.004 20 5 GGBDRN Cn1cc([C@H](O)C[C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000362392938 565979101 /nfs/dbraw/zinc/97/91/01/565979101.db2.gz VQPUIYYUZXOANT-BLLLJJGKSA-N 0 0 395.257 3.183 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1cccc(Br)c1 ZINC000179531088 565986720 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395.253 3.435 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1csc(S(C)(=O)=O)c1 ZINC000179765408 566006049 /nfs/dbraw/zinc/00/60/49/566006049.db2.gz FKNMRAQSYWZRBJ-UHFFFAOYSA-N 0 0 382.463 3.111 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cc(Br)cn(C)c1=O ZINC000179765347 566006195 /nfs/dbraw/zinc/00/61/95/566006195.db2.gz PLEJPJRJDAKEAK-UHFFFAOYSA-N 0 0 394.225 3.234 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000245772046 566006628 /nfs/dbraw/zinc/00/66/28/566006628.db2.gz GQTYHTGFMKAEAM-BFHYXJOUSA-N 0 0 381.226 3.045 20 5 GGBDRN Cc1noc([C@H]2CCCN2C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)n1 ZINC000287255449 566006789 /nfs/dbraw/zinc/00/67/89/566006789.db2.gz XOTXAEPRHJNGRE-LLVKDONJSA-N 0 0 396.201 3.418 20 5 GGBDRN C[C@H]1CS(=O)(=O)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000179767988 566007505 /nfs/dbraw/zinc/00/75/05/566007505.db2.gz SHCRDLVNPARWKG-NSHDSACASA-N 0 0 384.841 3.127 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)c1ncon1 ZINC000287285973 566009274 /nfs/dbraw/zinc/00/92/74/566009274.db2.gz ZEACSQRGRYWBHJ-NSHDSACASA-N 0 0 387.165 3.007 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCS[C@H]3CCCC[C@H]32)c(Cl)c1 ZINC000246098733 566016507 /nfs/dbraw/zinc/01/65/07/566016507.db2.gz ICZBONHCVJGAAO-OLZOCXBDSA-N 0 0 376.887 3.297 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1ncc(Cl)cc1Cl ZINC000179983760 566023181 /nfs/dbraw/zinc/02/31/81/566023181.db2.gz OOUVRUOWIOZOMJ-UHFFFAOYSA-N 0 0 378.997 3.269 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000246281794 566024422 /nfs/dbraw/zinc/02/44/22/566024422.db2.gz AYPAJBMPDIWCGK-SWLSCSKDSA-N 0 0 382.463 3.115 20 5 GGBDRN C[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000287542880 566024785 /nfs/dbraw/zinc/02/47/85/566024785.db2.gz BQYCPZJNIOEXJB-IAQYHMDHSA-N 0 0 383.495 3.163 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1CCCOCC1 ZINC000180027529 566027175 /nfs/dbraw/zinc/02/71/75/566027175.db2.gz WAVMRSYMPCHXMJ-LLVKDONJSA-N 0 0 378.372 3.391 20 5 GGBDRN C[C@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c2cc(Cl)ccc2S1 ZINC000246377498 566027299 /nfs/dbraw/zinc/02/72/99/566027299.db2.gz RHLSKTAOFUPVFY-SMDDNHRTSA-N 0 0 382.873 3.197 20 5 GGBDRN C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000246400820 566027924 /nfs/dbraw/zinc/02/79/24/566027924.db2.gz ALDYSCUOIGBHKX-NEPJUHHUSA-N 0 0 384.274 3.208 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)ccc1[N+](=O)[O-] ZINC000246514506 566031442 /nfs/dbraw/zinc/03/14/42/566031442.db2.gz OXZPEXYFGIGEDZ-BLLLJJGKSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)O[C@@H](c3ccsc3)C2)ccc1[N+](=O)[O-] ZINC000246514515 566031469 /nfs/dbraw/zinc/03/14/69/566031469.db2.gz OXZPEXYFGIGEDZ-MLGOLLRUSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000246557441 566032559 /nfs/dbraw/zinc/03/25/59/566032559.db2.gz RBCYOCVCCBUTJX-IUODEOHRSA-N 0 0 382.463 3.115 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000246663308 566035868 /nfs/dbraw/zinc/03/58/68/566035868.db2.gz YBXIAKAJBQUCPI-IUODEOHRSA-N 0 0 382.463 3.115 20 5 GGBDRN O=C(Nc1cncc(Cl)c1Cl)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000180140895 566036883 /nfs/dbraw/zinc/03/68/83/566036883.db2.gz DQCSNZKJDRFYBA-UHFFFAOYSA-N 0 0 379.163 3.130 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000180152764 566037578 /nfs/dbraw/zinc/03/75/78/566037578.db2.gz WYTANNHNQZDMHS-UHFFFAOYSA-N 0 0 394.758 3.486 20 5 GGBDRN CC[C@H](CSC)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000180152968 566037814 /nfs/dbraw/zinc/03/78/14/566037814.db2.gz ARSAAHQVYYOWDA-SECBINFHSA-N 0 0 386.417 3.376 20 5 GGBDRN CSc1ccc(C(=O)N2CCC[C@](O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000287863102 566045082 /nfs/dbraw/zinc/04/50/82/566045082.db2.gz MZBRGOZOOCCBQC-CQSZACIVSA-N 0 0 378.372 3.236 20 5 GGBDRN COc1cc(F)cc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000180249550 566047648 /nfs/dbraw/zinc/04/76/48/566047648.db2.gz IZPSFAWBNYRQEA-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN COC1(C(F)(F)F)CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000416265305 566049617 /nfs/dbraw/zinc/04/96/17/566049617.db2.gz HRZRGHZLHASHDC-UHFFFAOYSA-N 0 0 378.372 3.257 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Br ZINC000180299838 566052437 /nfs/dbraw/zinc/05/24/37/566052437.db2.gz HWQWZJRNVJLSTE-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN O=C(N[C@H](CO)CC1CCCCC1)c1ccc([N+](=O)[O-])cc1Br ZINC000416331626 566053643 /nfs/dbraw/zinc/05/36/43/566053643.db2.gz JSOQMCFWLFYORM-LBPRGKRZSA-N 0 0 385.258 3.418 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2c(F)cc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000180331036 566054842 /nfs/dbraw/zinc/05/48/42/566054842.db2.gz IIQDSUWRNJGAHF-UHFFFAOYSA-N 0 0 390.751 3.182 20 5 GGBDRN O=C(NCCNc1cccc(Br)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000180342693 566056100 /nfs/dbraw/zinc/05/61/00/566056100.db2.gz RNHFCRBDOGKDKE-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CN(CC(F)(F)Br)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000288090641 566056259 /nfs/dbraw/zinc/05/62/59/566056259.db2.gz GHXBABQEVBVQEP-UHFFFAOYSA-N 0 0 392.200 3.255 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180346438 566056878 /nfs/dbraw/zinc/05/68/78/566056878.db2.gz CEEIGJLHXVUQIQ-UHFFFAOYSA-N 0 0 394.225 3.041 20 5 GGBDRN O=C(NCCNc1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1F ZINC000180350479 566056880 /nfs/dbraw/zinc/05/68/80/566056880.db2.gz FPJRTLDVRSSFCP-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN Cc1c(CC(=O)NCCNc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000180359735 566058464 /nfs/dbraw/zinc/05/84/64/566058464.db2.gz WLBMCVXGZJODHZ-UHFFFAOYSA-N 0 0 392.253 3.437 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCNc1cccc(Br)c1 ZINC000180367285 566058995 /nfs/dbraw/zinc/05/89/95/566058995.db2.gz OGNJCTRPNSWPIO-UHFFFAOYSA-N 0 0 378.226 3.128 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCN(Cc2ccccn2)CC1 ZINC000247450524 566060622 /nfs/dbraw/zinc/06/06/22/566060622.db2.gz ZPDZDKDWWIFOTI-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN CC(C)[C@@H]1CN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000416409474 566063556 /nfs/dbraw/zinc/06/35/56/566063556.db2.gz BGALLQXCOWIXEF-LBPRGKRZSA-N 0 0 398.428 3.376 20 5 GGBDRN COC(C)(C)C[C@H](C)NS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416408292 566063869 /nfs/dbraw/zinc/06/38/69/566063869.db2.gz PBLOESOSORSCAF-VIFPVBQESA-N 0 0 384.376 3.096 20 5 GGBDRN CC(C)N(CC(F)F)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416434249 566068512 /nfs/dbraw/zinc/06/85/12/566068512.db2.gz SSDAVLMZIVKRHF-UHFFFAOYSA-N 0 0 376.303 3.278 20 5 GGBDRN COCCN(C(C)=O)c1nc(COc2ccc(Cl)c([N+](=O)[O-])c2)cs1 ZINC000288345600 566069463 /nfs/dbraw/zinc/06/94/63/566069463.db2.gz FZRVYBNTICKSGM-UHFFFAOYSA-N 0 0 385.829 3.283 20 5 GGBDRN CC[C@H](CSC)N(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416451345 566069841 /nfs/dbraw/zinc/06/98/41/566069841.db2.gz NWFPZHUKBZBWSJ-SNVBAGLBSA-N 0 0 386.417 3.376 20 5 GGBDRN CSc1ccc(C(=O)Nc2cn(C)cc(Br)c2=O)cc1[N+](=O)[O-] ZINC000180529439 566070162 /nfs/dbraw/zinc/07/01/62/566070162.db2.gz BMLYOMXARCVNCT-UHFFFAOYSA-N 0 0 398.238 3.030 20 5 GGBDRN CN(CCOc1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000247991111 566070214 /nfs/dbraw/zinc/07/02/14/566070214.db2.gz LKDDJQBSAKYCTL-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN CN([C@H]1CC[C@@H](C(F)(F)F)CC1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000288374098 566070762 /nfs/dbraw/zinc/07/07/62/566070762.db2.gz JZWGXCWZTQQRAI-AOOOYVTPSA-N 0 0 384.351 3.476 20 5 GGBDRN CN(Cc1ccccc1Br)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000248050118 566071147 /nfs/dbraw/zinc/07/11/47/566071147.db2.gz NJEBIHLGAPCDEV-UHFFFAOYSA-N 0 0 399.266 3.319 20 5 GGBDRN C[C@H](CCc1ccc(Br)cc1)NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000180544170 566071419 /nfs/dbraw/zinc/07/14/19/566071419.db2.gz PVHBAEGXVAWSNA-SNVBAGLBSA-N 0 0 393.241 3.086 20 5 GGBDRN CSCCCCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416467106 566071860 /nfs/dbraw/zinc/07/18/60/566071860.db2.gz TVXQBWHEPRJOLJ-UHFFFAOYSA-N 0 0 386.417 3.425 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(F)F ZINC000416471045 566071931 /nfs/dbraw/zinc/07/19/31/566071931.db2.gz OLFISRDNBPYXFP-QMMMGPOBSA-N 0 0 388.314 3.279 20 5 GGBDRN Cc1noc([C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)n1 ZINC000288423577 566073060 /nfs/dbraw/zinc/07/30/60/566073060.db2.gz XMUANPNAXMCTSE-LLVKDONJSA-N 0 0 381.186 3.026 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cncs1 ZINC000416477410 566073281 /nfs/dbraw/zinc/07/32/81/566073281.db2.gz STPMOSNALDSMOM-ZETCQYMHSA-N 0 0 381.357 3.110 20 5 GGBDRN Cc1noc([C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)n1 ZINC000288423583 566073349 /nfs/dbraw/zinc/07/33/49/566073349.db2.gz XMUANPNAXMCTSE-NSHDSACASA-N 0 0 381.186 3.026 20 5 GGBDRN Cc1nccn1CCCCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180572178 566073998 /nfs/dbraw/zinc/07/39/98/566073998.db2.gz XFPBWKRQROQCEU-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1CC2(CCC2(F)F)C1 ZINC000416483004 566074265 /nfs/dbraw/zinc/07/42/65/566074265.db2.gz HZWSAAVUHCFZAN-UHFFFAOYSA-N 0 0 386.298 3.033 20 5 GGBDRN NC(=O)c1ccc(CNc2cc(F)c(Br)c(F)c2)c([N+](=O)[O-])c1 ZINC000180583780 566074711 /nfs/dbraw/zinc/07/47/11/566074711.db2.gz SSIPEZJZHSJCQS-UHFFFAOYSA-N 0 0 386.152 3.347 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@H](CCO)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000288466845 566074916 /nfs/dbraw/zinc/07/49/16/566074916.db2.gz KGRRHQIOONUJMW-CQSZACIVSA-N 0 0 384.841 3.187 20 5 GGBDRN Cc1cc(I)ccc1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180584785 566074965 /nfs/dbraw/zinc/07/49/65/566074965.db2.gz PTOQNVGYYQLYEE-UHFFFAOYSA-N 0 0 397.172 3.342 20 5 GGBDRN COC[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000288460300 566075006 /nfs/dbraw/zinc/07/50/06/566075006.db2.gz SLXUIXBRJJCYTF-HNNXBMFYSA-N 0 0 384.841 3.055 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1CC[C@H](CC2CC2)C1 ZINC000416486164 566075533 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Cn1cc(Br)c(CSCCC(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000419484639 566236450 /nfs/dbraw/zinc/23/64/50/566236450.db2.gz XFZXFXNLSVETIM-UHFFFAOYSA-N 0 0 399.270 3.353 20 5 GGBDRN COc1cc(C(=O)N2CCS[C@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000265385027 566236749 /nfs/dbraw/zinc/23/67/49/566236749.db2.gz KZXCAXTYSNQGAR-DTWKUNHWSA-N 0 0 376.381 3.171 20 5 GGBDRN COc1cc(C(=O)N(C)[C@@H](C)CCSC)c([N+](=O)[O-])cc1OC(F)F ZINC000265432447 566237050 /nfs/dbraw/zinc/23/70/50/566237050.db2.gz GMRPNRMIBJBDTM-VIFPVBQESA-N 0 0 378.397 3.418 20 5 GGBDRN CO[C@H](CSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1)Cc1ccccc1 ZINC000419531278 566237956 /nfs/dbraw/zinc/23/79/56/566237956.db2.gz KQAKNZMQHXRKDQ-AWEZNQCLSA-N 0 0 381.475 3.348 20 5 GGBDRN CS(=O)(=O)c1cc(SCc2ccn(CC(F)(F)F)n2)ccc1[N+](=O)[O-] ZINC000419535420 566238030 /nfs/dbraw/zinc/23/80/30/566238030.db2.gz RXBMAESEERGSOU-UHFFFAOYSA-N 0 0 395.384 3.049 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C(C)(C)O1 ZINC000183097974 566238113 /nfs/dbraw/zinc/23/81/13/566238113.db2.gz YKGWONXGKCLKQJ-CYBMUJFWSA-N 0 0 385.258 3.362 20 5 GGBDRN COc1cccc(N2CCC(n3cc(Br)cn3)CC2)c1[N+](=O)[O-] ZINC000368437765 566238471 /nfs/dbraw/zinc/23/84/71/566238471.db2.gz WGZPWCKATPZCJM-UHFFFAOYSA-N 0 0 381.230 3.404 20 5 GGBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)c1cccc(S(=O)(=O)N(C)C)c1 ZINC000265581779 566239282 /nfs/dbraw/zinc/23/92/82/566239282.db2.gz WPGDIMJOOXNVOZ-SNVBAGLBSA-N 0 0 384.845 3.067 20 5 GGBDRN Cn1nccc1[C@H]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000368484183 566239738 /nfs/dbraw/zinc/23/97/38/566239738.db2.gz RNGOZAVAMMFIKK-NSHDSACASA-N 0 0 393.241 3.111 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)Cc1ncc(Cl)n1C ZINC000183243931 566241621 /nfs/dbraw/zinc/24/16/21/566241621.db2.gz ANCQHUMRPLQQHX-VIFPVBQESA-N 0 0 386.239 3.094 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)Cc1ncc(Cl)n1C ZINC000183254817 566242092 /nfs/dbraw/zinc/24/20/92/566242092.db2.gz PBBATTZHONBINY-VIFPVBQESA-N 0 0 386.239 3.094 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(CSCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000183290008 566243043 /nfs/dbraw/zinc/24/30/43/566243043.db2.gz JHKFTCJKWRISEM-UHFFFAOYSA-N 0 0 380.491 3.321 20 5 GGBDRN C[C@@H](CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000183340588 566244585 /nfs/dbraw/zinc/24/45/85/566244585.db2.gz YDZHTWPTPWTMDK-VIFPVBQESA-N 0 0 375.859 3.129 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C)C[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000183366988 566245472 /nfs/dbraw/zinc/24/54/72/566245472.db2.gz FXTJNHRSYAFYHF-IAQYHMDHSA-N 0 0 385.258 3.289 20 5 GGBDRN C[C@H](c1ccccc1Br)N(C)C(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183421273 566246688 /nfs/dbraw/zinc/24/66/88/566246688.db2.gz BDFUMCALKQGVLB-SECBINFHSA-N 0 0 379.214 3.168 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])s1 ZINC000266208201 566247120 /nfs/dbraw/zinc/24/71/20/566247120.db2.gz PUGYIOFRTCRPCK-JTQLQIEISA-N 0 0 387.458 3.443 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1CCOc2c(Cl)c(Cl)ccc21 ZINC000368897305 566247179 /nfs/dbraw/zinc/24/71/79/566247179.db2.gz QULCWQIYSRVXTF-LBPRGKRZSA-N 0 0 385.207 3.128 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CC[C@H](Nc2ccccc2)C1 ZINC000368944345 566247811 /nfs/dbraw/zinc/24/78/11/566247811.db2.gz ZYEXZFHSZOWYCI-ZDUSSCGKSA-N 0 0 381.841 3.123 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1[N+](=O)[O-] ZINC000444757137 566250341 /nfs/dbraw/zinc/25/03/41/566250341.db2.gz JOZSTAOWHPKEOL-NSHDSACASA-N 0 0 380.685 3.452 20 5 GGBDRN CC(C)(C)c1ncn(Cc2cc(I)cc([N+](=O)[O-])c2)n1 ZINC000575109368 566252167 /nfs/dbraw/zinc/25/21/67/566252167.db2.gz GWFUVVYNAZIGHI-UHFFFAOYSA-N 0 0 386.193 3.137 20 5 GGBDRN CC(C)C[C@H]1COCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462131450 566252910 /nfs/dbraw/zinc/25/29/10/566252910.db2.gz AYHCLAOQMLGLBJ-NSHDSACASA-N 0 0 397.280 3.337 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1COc2ccccc2C1 ZINC000555812585 566252917 /nfs/dbraw/zinc/25/29/17/566252917.db2.gz WJTJIWIVQOTVCT-GFCCVEGCSA-N 0 0 391.221 3.399 20 5 GGBDRN Cc1nc(CCNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cs1 ZINC000555840437 566253785 /nfs/dbraw/zinc/25/37/85/566253785.db2.gz MRKZDLGNKQAKBO-UHFFFAOYSA-N 0 0 384.255 3.403 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)c2sc(Br)cc2[N+](=O)[O-])cc1 ZINC000444826288 566254033 /nfs/dbraw/zinc/25/40/33/566254033.db2.gz LUQXRYJCVFSOTQ-UHFFFAOYSA-N 0 0 398.238 3.307 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCO2)c1sc(Br)cc1[N+](=O)[O-] ZINC000444828481 566254099 /nfs/dbraw/zinc/25/40/99/566254099.db2.gz SIAZODVMFPTCCO-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN O=C(Nc1ccc2c(c1)OCCO2)c1sc(Br)cc1[N+](=O)[O-] ZINC000444825243 566254398 /nfs/dbraw/zinc/25/43/98/566254398.db2.gz JLMFCMYESNBNTC-UHFFFAOYSA-N 0 0 385.195 3.442 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Sc1cccs1)[C@@H]1CCCS1(=O)=O ZINC000575134537 566254990 /nfs/dbraw/zinc/25/49/90/566254990.db2.gz AVUBVDQJHIDNLK-ZDUSSCGKSA-N 0 0 398.487 3.323 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1ccc(CCO)cc1 ZINC000555852313 566255009 /nfs/dbraw/zinc/25/50/09/566255009.db2.gz 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3.167 20 5 GGBDRN CCO[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000444985909 566263000 /nfs/dbraw/zinc/26/30/00/566263000.db2.gz IIAUNTYELGXARS-HNNXBMFYSA-N 0 0 384.841 3.304 20 5 GGBDRN CC[C@@H](Cc1ccccc1Br)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445018877 566265282 /nfs/dbraw/zinc/26/52/82/566265282.db2.gz KLBDEQPYILZEIU-LBPRGKRZSA-N 0 0 394.225 3.209 20 5 GGBDRN CN(Cc1cc(C(C)(C)C)n[nH]1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000445074421 566266060 /nfs/dbraw/zinc/26/60/60/566266060.db2.gz NFJNZMFTGHDBJA-UHFFFAOYSA-N 0 0 386.861 3.090 20 5 GGBDRN C[C@H]1CC(F)(F)CCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000599463491 566266391 /nfs/dbraw/zinc/26/63/91/566266391.db2.gz WYAFQIINQWRNNK-QMMMGPOBSA-N 0 0 399.213 3.166 20 5 GGBDRN O=C(CS(=O)(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(Cl)cc1Cl ZINC000509147495 566267764 /nfs/dbraw/zinc/26/77/64/566267764.db2.gz UQGCYNLYQQRFNK-UHFFFAOYSA-N 0 0 389.216 3.314 20 5 GGBDRN C[C@@H]1CC(F)(F)CCN1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000599468335 566268125 /nfs/dbraw/zinc/26/81/25/566268125.db2.gz DCHONGNAZHSLOF-MRVPVSSYSA-N 0 0 399.213 3.166 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc(Br)cc1 ZINC000509153455 566268498 /nfs/dbraw/zinc/26/84/98/566268498.db2.gz LKLZXWRBCNDTSD-UHFFFAOYSA-N 0 0 399.266 3.221 20 5 GGBDRN CC(C)n1cc2c(n1)C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)CC2 ZINC000481966263 566270358 /nfs/dbraw/zinc/27/03/58/566270358.db2.gz HDCTYKWRDMMIEX-LLVKDONJSA-N 0 0 380.246 3.499 20 5 GGBDRN Cn1c(=O)oc2cc(NC(=O)c3sc(Br)cc3[N+](=O)[O-])ccc21 ZINC000445179775 566271026 /nfs/dbraw/zinc/27/10/26/566271026.db2.gz JOARYSAMISZWJC-UHFFFAOYSA-N 0 0 398.194 3.116 20 5 GGBDRN Cc1nc(CN(C)C(=O)c2sc(Br)cc2[N+](=O)[O-])cs1 ZINC000445177542 566271658 /nfs/dbraw/zinc/27/16/58/566271658.db2.gz WOUDIRQQVGEHHY-UHFFFAOYSA-N 0 0 376.257 3.456 20 5 GGBDRN CC[C@]1(C)CCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000535028607 566272460 /nfs/dbraw/zinc/27/24/60/566272460.db2.gz DTZLKWZDYNMZSF-CQSZACIVSA-N 0 0 388.205 3.462 20 5 GGBDRN CC[C@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1cc(F)cc(Br)c1 ZINC000445211118 566272759 /nfs/dbraw/zinc/27/27/59/566272759.db2.gz JLEVXMQBFXNHMV-LBPRGKRZSA-N 0 0 398.188 3.478 20 5 GGBDRN CC(C)[C@@H]1CCCN1C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000535021987 566272757 /nfs/dbraw/zinc/27/27/57/566272757.db2.gz KCKBVSLCBPXWLY-ZDUSSCGKSA-N 0 0 388.205 3.460 20 5 GGBDRN O=C(Nc1ccc(-c2nc[nH]n2)cc1)c1sc(Br)cc1[N+](=O)[O-] ZINC000445193556 566273505 /nfs/dbraw/zinc/27/35/05/566273505.db2.gz ZXKIFOZPQZYDRN-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN C[N@H+](CC[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000462275731 566273880 /nfs/dbraw/zinc/27/38/80/566273880.db2.gz KRVVZOFDELPMPY-UHFFFAOYSA-N 0 0 396.296 3.054 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C12CCC2 ZINC000599572458 566275506 /nfs/dbraw/zinc/27/55/06/566275506.db2.gz BQPHRVQPWCENOZ-OLZOCXBDSA-N 0 0 383.242 3.435 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H](c2cc(F)cc(Br)c2)C2CC2)c1[N+](=O)[O-] ZINC000482051685 566280019 /nfs/dbraw/zinc/28/00/19/566280019.db2.gz CBLYHBIFZWGNDF-LBPRGKRZSA-N 0 0 397.204 3.409 20 5 GGBDRN C[C@@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H](C(F)(F)F)O1 ZINC000599616452 566280716 /nfs/dbraw/zinc/28/07/16/566280716.db2.gz CJFVUURHLOEHMO-GMSGAONNSA-N 0 0 397.147 3.149 20 5 GGBDRN C[C@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@@H](C(F)(F)F)O1 ZINC000599616470 566280817 /nfs/dbraw/zinc/28/08/17/566280817.db2.gz CJFVUURHLOEHMO-XVKPBYJWSA-N 0 0 397.147 3.149 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2Br)c1)c1ccc([N+](=O)[O-])[nH]1 ZINC000535146406 566281332 /nfs/dbraw/zinc/28/13/32/566281332.db2.gz CYDUSPXWCFCVLQ-UHFFFAOYSA-N 0 0 376.170 3.123 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000599661924 566284336 /nfs/dbraw/zinc/28/43/36/566284336.db2.gz HAPVVQCFHCHNHS-RISCZKNCSA-N 0 0 393.241 3.277 20 5 GGBDRN O=C(Cc1noc(-c2ccc([N+](=O)[O-])[nH]2)n1)Nc1cc(Cl)ccc1Cl ZINC000445332050 566284354 /nfs/dbraw/zinc/28/43/54/566284354.db2.gz NWZDQGOIDAKTAQ-UHFFFAOYSA-N 0 0 382.163 3.461 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1cc(Br)cnc1N ZINC000482116175 566284361 /nfs/dbraw/zinc/28/43/61/566284361.db2.gz XOYBTGZUDGRWHO-UHFFFAOYSA-N 0 0 394.229 3.103 20 5 GGBDRN O=C(Cc1noc(-c2ccc([N+](=O)[O-])[nH]2)n1)Nc1ccc(Cl)cc1Cl ZINC000445364766 566285113 /nfs/dbraw/zinc/28/51/13/566285113.db2.gz AWXQDINSHHSWDM-UHFFFAOYSA-N 0 0 382.163 3.461 20 5 GGBDRN O=C(NCC1(c2ccc(Br)cc2Cl)CC1)c1c[nH]nc1[N+](=O)[O-] ZINC000556321980 566285383 /nfs/dbraw/zinc/28/53/83/566285383.db2.gz PBXUDEAUJVQLGT-UHFFFAOYSA-N 0 0 399.632 3.195 20 5 GGBDRN CCN(CCOc1ccccc1C)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000420622257 566288916 /nfs/dbraw/zinc/28/89/16/566288916.db2.gz SNZJVIZITVSCLQ-UHFFFAOYSA-N 0 0 384.479 3.274 20 5 GGBDRN C[C@@H]1SCCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000462345346 566289194 /nfs/dbraw/zinc/28/91/94/566289194.db2.gz WVJFCKQAORPXCJ-YUMQZZPRSA-N 0 0 385.294 3.416 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1c(Br)cccc1[N+](=O)[O-] ZINC000599715073 566290195 /nfs/dbraw/zinc/29/01/95/566290195.db2.gz VZMSODJDRUOEDS-KMUNFCNLSA-N 0 0 395.253 3.435 20 5 GGBDRN C[C@H]1C[C@@H](CO)CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C1 ZINC000420636647 566290875 /nfs/dbraw/zinc/29/08/75/566290875.db2.gz VLHLMWYRNKANQZ-WDEREUQCSA-N 0 0 380.242 3.360 20 5 GGBDRN CC(C)c1nnc([C@H](C)NC(=O)c2c(Br)cccc2[N+](=O)[O-])[nH]1 ZINC000599734394 566291331 /nfs/dbraw/zinc/29/13/31/566291331.db2.gz VRBOCOJQRPHZJD-QMMMGPOBSA-N 0 0 382.218 3.090 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccsc2Br)ccc1[N+](=O)[O-] ZINC000509334801 566291628 /nfs/dbraw/zinc/29/16/28/566291628.db2.gz BLSBTNTVTCECHF-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN COCC[C@@H](NC(=O)c1c(Br)cccc1[N+](=O)[O-])c1ccco1 ZINC000599748164 566293072 /nfs/dbraw/zinc/29/30/72/566293072.db2.gz PXGDQIJSVSUEKG-LLVKDONJSA-N 0 0 383.198 3.458 20 5 GGBDRN Cc1cc(Br)ccc1-c1noc(CCn2cc([N+](=O)[O-])cn2)n1 ZINC000445466332 566293443 /nfs/dbraw/zinc/29/34/43/566293443.db2.gz ZRQRLDGFEJGKAO-UHFFFAOYSA-N 0 0 378.186 3.155 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1Sc1nnc2ccc(Br)cn21 ZINC000575884540 566293743 /nfs/dbraw/zinc/29/37/43/566293743.db2.gz IZISJEFMVQPTOF-UHFFFAOYSA-N 0 0 383.231 3.076 20 5 GGBDRN CC(C)N1C[C@H](c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)CC1=O ZINC000556389188 566293910 /nfs/dbraw/zinc/29/39/10/566293910.db2.gz ZKDNRZGYMIVQRY-SECBINFHSA-N 0 0 395.213 3.132 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(OC(F)F)cc1F ZINC000509375819 566294555 /nfs/dbraw/zinc/29/45/55/566294555.db2.gz MHZOJZNHSSZZTO-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCC[C@@H]3CCC[C@@H]32)c1 ZINC000462405936 566296473 /nfs/dbraw/zinc/29/64/73/566296473.db2.gz GCLBSEUHSMUJSU-HZMBPMFUSA-N 0 0 389.271 3.311 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C)c1ccc(Cl)cc1 ZINC000462406579 566296498 /nfs/dbraw/zinc/29/64/98/566296498.db2.gz AJMHALMPZFKATC-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCC[C@H]3CCC[C@H]32)c1 ZINC000462405945 566296695 /nfs/dbraw/zinc/29/66/95/566296695.db2.gz GCLBSEUHSMUJSU-QMTHXVAHSA-N 0 0 389.271 3.311 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC([C@H]2CCCO2)CC1 ZINC000599800386 566297202 /nfs/dbraw/zinc/29/72/02/566297202.db2.gz TUPQVWUBBBRYCE-CQSZACIVSA-N 0 0 383.242 3.389 20 5 GGBDRN Cc1cc(-c2noc(Cn3ccc([N+](=O)[O-])n3)n2)cc(C)c1Br ZINC000445570782 566297537 /nfs/dbraw/zinc/29/75/37/566297537.db2.gz IYCXZOZGXLIWTF-UHFFFAOYSA-N 0 0 378.186 3.269 20 5 GGBDRN C[C@@H](Oc1ccccc1Br)c1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000445575334 566297770 /nfs/dbraw/zinc/29/77/70/566297770.db2.gz QGNXPIQIGZGFMO-MRVPVSSYSA-N 0 0 394.185 3.281 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(Cc2cc(Cl)ccc2Br)n1 ZINC000445584223 566297780 /nfs/dbraw/zinc/29/77/80/566297780.db2.gz RCLRTJNTTYAFQP-UHFFFAOYSA-N 0 0 398.604 3.385 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccc(OC(F)F)cc1F ZINC000509396549 566297819 /nfs/dbraw/zinc/29/78/19/566297819.db2.gz LTYXCGXLGCVBAB-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(-c2ccc(Br)c(Cl)c2)n1 ZINC000445578931 566297830 /nfs/dbraw/zinc/29/78/30/566297830.db2.gz JPKPWQAMUZUHKC-UHFFFAOYSA-N 0 0 384.577 3.461 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(/C=C/c2cc(Br)ccc2F)n1 ZINC000445580116 566298149 /nfs/dbraw/zinc/29/81/49/566298149.db2.gz SNKPUEQDTOAUPX-GORDUTHDSA-N 0 0 394.160 3.450 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(CCc2cc(Br)ccc2F)n1 ZINC000445570684 566298225 /nfs/dbraw/zinc/29/82/25/566298225.db2.gz IAZANFMLFCJBLY-UHFFFAOYSA-N 0 0 396.176 3.065 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(/C=C/c2cccc(Br)c2)n1 ZINC000445574768 566298386 /nfs/dbraw/zinc/29/83/86/566298386.db2.gz AJBLXSBBZDJWAK-AATRIKPKSA-N 0 0 376.170 3.311 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(/C=C\c2cc(Br)ccc2F)n1 ZINC000445580115 566298479 /nfs/dbraw/zinc/29/84/79/566298479.db2.gz SNKPUEQDTOAUPX-DJWKRKHSSA-N 0 0 394.160 3.450 20 5 GGBDRN CC1(C)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)[C@@H]1[C@@H]1CCCO1 ZINC000575914652 566298720 /nfs/dbraw/zinc/29/87/20/566298720.db2.gz UTXZDTIICPXGLD-GOEBONIOSA-N 0 0 397.269 3.316 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(OC(F)F)cc2F)cc1[N+](=O)[O-] ZINC000509387579 566298686 /nfs/dbraw/zinc/29/86/86/566298686.db2.gz NRBICLHVHWQQAZ-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN CC[C@@H](C)c1nnc([C@H](C)NC(=O)c2c(Br)cccc2[N+](=O)[O-])[nH]1 ZINC000599828196 566299208 /nfs/dbraw/zinc/29/92/08/566299208.db2.gz OWPHDIPHGJDECB-BDAKNGLRSA-N 0 0 396.245 3.480 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599847714 566299532 /nfs/dbraw/zinc/29/95/32/566299532.db2.gz YGZSEEOEGSTVKG-LBPRGKRZSA-N 0 0 395.213 3.195 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599847713 566299675 /nfs/dbraw/zinc/29/96/75/566299675.db2.gz YGZSEEOEGSTVKG-GFCCVEGCSA-N 0 0 395.213 3.195 20 5 GGBDRN CC[C@H]1CO[C@H](C)CN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462421721 566300889 /nfs/dbraw/zinc/30/08/89/566300889.db2.gz LAADMTNCHBEIED-SCZZXKLOSA-N 0 0 383.253 3.090 20 5 GGBDRN CC(=O)CN(CC(C)C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000420694740 566301424 /nfs/dbraw/zinc/30/14/24/566301424.db2.gz CLEFMAQVTIXYHK-UHFFFAOYSA-N 0 0 383.253 3.137 20 5 GGBDRN O=C(NCCCO[C@@H]1CCCCO1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599860358 566301365 /nfs/dbraw/zinc/30/13/65/566301365.db2.gz IDZVTFFONFOAPR-CYBMUJFWSA-N 0 0 387.230 3.020 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(Cc3ccccc3Br)n2)n1C ZINC000445613121 566301709 /nfs/dbraw/zinc/30/17/09/566301709.db2.gz QXACIJJMKPHKKZ-UHFFFAOYSA-N 0 0 378.186 3.040 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3ccc(Br)cc3F)n2)n1C ZINC000445612473 566301903 /nfs/dbraw/zinc/30/19/03/566301903.db2.gz LMQSRQOHEATCRS-UHFFFAOYSA-N 0 0 382.149 3.255 20 5 GGBDRN COc1cnccc1-c1noc(-c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000445630325 566302668 /nfs/dbraw/zinc/30/26/68/566302668.db2.gz UZDBAOOQUJFMMC-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN COC(=O)[C@H](C)N(C(=O)c1cc([N+](=O)[O-])cc(Br)c1C)C1CCC1 ZINC000556453521 566302986 /nfs/dbraw/zinc/30/29/86/566302986.db2.gz OGCQZBNAHAXFDI-JTQLQIEISA-N 0 0 399.241 3.222 20 5 GGBDRN COCC[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccc(Cl)c(Cl)c1 ZINC000556470531 566305614 /nfs/dbraw/zinc/30/56/14/566305614.db2.gz ZCEDVQSRILNDLC-LBPRGKRZSA-N 0 0 387.223 3.143 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCOC[C@@H](C2CCC2)C1 ZINC000599966150 566306525 /nfs/dbraw/zinc/30/65/25/566306525.db2.gz OJRZIKJYFHLQJC-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN CC(C)[C@@H](CO)[C@@H](NC(=O)c1c(Br)cccc1[N+](=O)[O-])C(C)C ZINC000599989838 566307423 /nfs/dbraw/zinc/30/74/23/566307423.db2.gz YGCBEZCLFDCXPQ-ABAIWWIYSA-N 0 0 387.274 3.376 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CC2(CCOCC2)[C@H]1C1CC1 ZINC000599981753 566307707 /nfs/dbraw/zinc/30/77/07/566307707.db2.gz LKSMCDKQLKXLJC-OAHLLOKOSA-N 0 0 395.253 3.389 20 5 GGBDRN CN(Cc1cccnc1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462464992 566307690 /nfs/dbraw/zinc/30/76/90/566307690.db2.gz LAWHZVBZKDFQNY-UHFFFAOYSA-N 0 0 376.221 3.117 20 5 GGBDRN CC[C@H](COCC(F)(F)F)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599975435 566307973 /nfs/dbraw/zinc/30/79/73/566307973.db2.gz BGEVOKXYVCSJMG-MRVPVSSYSA-N 0 0 399.163 3.445 20 5 GGBDRN CC(C)C[C@H]1CCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000556516999 566308121 /nfs/dbraw/zinc/30/81/21/566308121.db2.gz OSYJGAVKQYBDDG-CYBMUJFWSA-N 0 0 398.257 3.333 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCC(CC(F)(F)F)CC2)cc1 ZINC000556508337 566308271 /nfs/dbraw/zinc/30/82/71/566308271.db2.gz ITUAHKKGRSHEPL-UHFFFAOYSA-N 0 0 380.388 3.033 20 5 GGBDRN C[C@@H]1CCC[C@@H](N(C)C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000556506757 566308583 /nfs/dbraw/zinc/30/85/83/566308583.db2.gz VIHRXWQTBGEXMF-ZWNOBZJWSA-N 0 0 398.257 3.333 20 5 GGBDRN C[C@H](NC(=O)c1c(Br)cccc1[N+](=O)[O-])c1noc(C(F)F)n1 ZINC000600002724 566308680 /nfs/dbraw/zinc/30/86/80/566308680.db2.gz FBWVMQVAOHMAKH-YFKPBYRVSA-N 0 0 391.128 3.169 20 5 GGBDRN CO[C@@H]1C[C@H](N(C)C(=O)c2c(Br)cccc2[N+](=O)[O-])C12CCC2 ZINC000599995528 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0 0 396.241 3.158 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCCc1nc2c(s1)CCCC2 ZINC000535564593 566311863 /nfs/dbraw/zinc/31/18/63/566311863.db2.gz FFYFMWKYAFRVTA-UHFFFAOYSA-N 0 0 377.491 3.381 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC(c2ncco2)CC1 ZINC000600070317 566312595 /nfs/dbraw/zinc/31/25/95/566312595.db2.gz KLYHLJHCCGEJHV-UHFFFAOYSA-N 0 0 380.198 3.365 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000556562063 566312584 /nfs/dbraw/zinc/31/25/84/566312584.db2.gz ZHOAYSBDURYHBX-RULNRJAQSA-N 0 0 398.257 3.237 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCC[C@H](CC(F)(F)F)C1 ZINC000420754180 566314452 /nfs/dbraw/zinc/31/44/52/566314452.db2.gz OEUBNSQCJSVWFG-GFCCVEGCSA-N 0 0 380.388 3.132 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCC[C@@H](CCO)CC1 ZINC000420750131 566314736 /nfs/dbraw/zinc/31/47/36/566314736.db2.gz NGTGXNQXKIFXLJ-SNVBAGLBSA-N 0 0 397.280 3.075 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@@H]1C 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GGBDRN CCOC(=O)CN(CC(C)C)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000446018948 566322594 /nfs/dbraw/zinc/32/25/94/566322594.db2.gz GKYBUNRRSXOBFV-UHFFFAOYSA-N 0 0 393.259 3.080 20 5 GGBDRN COc1nc(C)c(Br)cc1-c1noc(-c2cc([N+](=O)[O-])c[nH]2)n1 ZINC000446000005 566322692 /nfs/dbraw/zinc/32/26/92/566322692.db2.gz ANCSBJLZNRHHGT-UHFFFAOYSA-N 0 0 380.158 3.114 20 5 GGBDRN Cc1ccc(C(N)=O)cc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000446026530 566323918 /nfs/dbraw/zinc/32/39/18/566323918.db2.gz STOPDELQTQHDOE-UHFFFAOYSA-N 0 0 384.211 3.078 20 5 GGBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@H](Sc2ccc(Br)cc2)C1 ZINC000600216302 566324659 /nfs/dbraw/zinc/32/46/59/566324659.db2.gz XQMFXAPJVGPXPI-LLVKDONJSA-N 0 0 397.254 3.087 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000576216585 566324974 /nfs/dbraw/zinc/32/49/74/566324974.db2.gz VIPNCXRRKLRKRF-LLVKDONJSA-N 0 0 379.825 3.360 20 5 GGBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@H](Sc2ccc(Br)cc2)C1 ZINC000600216303 566325317 /nfs/dbraw/zinc/32/53/17/566325317.db2.gz XQMFXAPJVGPXPI-NSHDSACASA-N 0 0 397.254 3.087 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000462573335 566325755 /nfs/dbraw/zinc/32/57/55/566325755.db2.gz LFMQHBQQVRVFIY-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000509656890 566326479 /nfs/dbraw/zinc/32/64/79/566326479.db2.gz WDDOTPNRUBSDKE-CYBMUJFWSA-N 0 0 391.221 3.399 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCN(Cc2ccsc2)CC1 ZINC000556731218 566326586 /nfs/dbraw/zinc/32/65/86/566326586.db2.gz PXLFMHZHPWWGMC-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000462580103 566326934 /nfs/dbraw/zinc/32/69/34/566326934.db2.gz WWKMGNLXPLKTMN-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN O=C(Nc1ccc(-n2ccnn2)cc1)c1sc(Br)cc1[N+](=O)[O-] ZINC000446081968 566327441 /nfs/dbraw/zinc/32/74/41/566327441.db2.gz PTADPAPSBYPMKH-UHFFFAOYSA-N 0 0 394.210 3.252 20 5 GGBDRN COC(=O)CC1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CC1 ZINC000509677460 566328129 /nfs/dbraw/zinc/32/81/29/566328129.db2.gz HJFUVQVZFYIIBV-UHFFFAOYSA-N 0 0 399.241 3.081 20 5 GGBDRN CCCCN1CCCC[C@H]1CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000535798595 566328621 /nfs/dbraw/zinc/32/86/21/566328621.db2.gz QIBTWQUVKLBGQE-LBPRGKRZSA-N 0 0 375.516 3.126 20 5 GGBDRN COc1ccc(S(=O)(=O)NC[C@@H](C)Sc2ccccc2)cc1[N+](=O)[O-] ZINC000462592794 566330187 /nfs/dbraw/zinc/33/01/87/566330187.db2.gz LFXDEMLCYXMPOS-GFCCVEGCSA-N 0 0 382.463 3.063 20 5 GGBDRN CCOc1ncccc1CNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000509692959 566330408 /nfs/dbraw/zinc/33/04/08/566330408.db2.gz LRVRIVMMCXOEJU-UHFFFAOYSA-N 0 0 394.225 3.389 20 5 GGBDRN COC(=O)CCN(CC(C)C)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000446107309 566330798 /nfs/dbraw/zinc/33/07/98/566330798.db2.gz HHCBRVIZAZITCA-UHFFFAOYSA-N 0 0 393.259 3.080 20 5 GGBDRN CO[C@]1(C)C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1(C)C ZINC000446106885 566331023 /nfs/dbraw/zinc/33/10/23/566331023.db2.gz DVINQDSTJANJHJ-CZUORRHYSA-N 0 0 385.258 3.220 20 5 GGBDRN CN(Cc1ccc(F)cc1Br)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000482757977 566332076 /nfs/dbraw/zinc/33/20/76/566332076.db2.gz HOVUFGOKZJULIP-UHFFFAOYSA-N 0 0 382.189 3.351 20 5 GGBDRN CN(CC1(C)COC1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000600306027 566332816 /nfs/dbraw/zinc/33/28/16/566332816.db2.gz KPHUMNQJJGUDBZ-UHFFFAOYSA-N 0 0 378.372 3.201 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N(C1CC1)C1CC1 ZINC000600358022 566335614 /nfs/dbraw/zinc/33/56/14/566335614.db2.gz DDXAMNAVNMSNJD-UHFFFAOYSA-N 0 0 386.189 3.275 20 5 GGBDRN CCO[C@@H]1C[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C12CCCC2 ZINC000462656885 566337240 /nfs/dbraw/zinc/33/72/40/566337240.db2.gz LVNOOUVGOSGWBG-HUUCEWRRSA-N 0 0 388.873 3.264 20 5 GGBDRN CC[C@@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000462672186 566338169 /nfs/dbraw/zinc/33/81/69/566338169.db2.gz CNOYOYOCOJTPAV-SECBINFHSA-N 0 0 385.294 3.418 20 5 GGBDRN CCO[C@@H]1C[C@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C12CCCC2 ZINC000462662821 566338348 /nfs/dbraw/zinc/33/83/48/566338348.db2.gz YLTICDWUWJEULJ-UONOGXRCSA-N 0 0 388.873 3.264 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2Br)c1)c1cc([N+](=O)[O-])c[nH]1 ZINC000535907081 566338386 /nfs/dbraw/zinc/33/83/86/566338386.db2.gz OVXUYGFFNXRJRM-UHFFFAOYSA-N 0 0 376.170 3.123 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000462670312 566338473 /nfs/dbraw/zinc/33/84/73/566338473.db2.gz YEDBNEDPGVZART-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN CC(C)OC(=O)c1ccn(Cc2ccc(Br)cc2[N+](=O)[O-])c(=O)c1 ZINC000576345176 566338517 /nfs/dbraw/zinc/33/85/17/566338517.db2.gz QFTULFMSRMKFKB-UHFFFAOYSA-N 0 0 395.209 3.133 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000462668176 566338656 /nfs/dbraw/zinc/33/86/56/566338656.db2.gz KNWASBXSBNPETM-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN CC[C@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000462672187 566338953 /nfs/dbraw/zinc/33/89/53/566338953.db2.gz CNOYOYOCOJTPAV-VIFPVBQESA-N 0 0 385.294 3.418 20 5 GGBDRN C[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc([S@](C)=O)cc1 ZINC000535955706 566339675 /nfs/dbraw/zinc/33/96/75/566339675.db2.gz VVBRZKGSEPFPMR-YDBLSZJJSA-N 0 0 378.475 3.302 20 5 GGBDRN CCO[C@@H]1C[C@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C12CCCC2 ZINC000462673394 566340127 /nfs/dbraw/zinc/34/01/27/566340127.db2.gz FQSJCHOBIUPUEM-LSDHHAIUSA-N 0 0 388.873 3.264 20 5 GGBDRN CCO[C@H]1C[C@@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C12CCCC2 ZINC000462673391 566340606 /nfs/dbraw/zinc/34/06/06/566340606.db2.gz FQSJCHOBIUPUEM-CABCVRRESA-N 0 0 388.873 3.264 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCC(=O)c2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000600486235 566341957 /nfs/dbraw/zinc/34/19/57/566341957.db2.gz JTZNGNPBHMDXSF-UHFFFAOYSA-N 0 0 385.207 3.361 20 5 GGBDRN Cc1c(Br)c(NC[C@H]2CCc3ccccc3N2)ncc1[N+](=O)[O-] ZINC000576384941 566342034 /nfs/dbraw/zinc/34/20/34/566342034.db2.gz SWPILNLGTXVVQI-GFCCVEGCSA-N 0 0 377.242 3.321 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])Oc1ccccc1F ZINC000462702584 566342564 /nfs/dbraw/zinc/34/25/64/566342564.db2.gz LYZOFKISFHJSJD-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN CC[S@@](=O)c1ccccc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482909285 566342848 /nfs/dbraw/zinc/34/28/48/566342848.db2.gz GMYWANQFWHNKKW-RUZDIDTESA-N 0 0 380.853 3.348 20 5 GGBDRN Cc1ccc(O[C@H](C)CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000462699750 566343012 /nfs/dbraw/zinc/34/30/12/566343012.db2.gz UZENUNGCKJCYRY-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@@H](C)Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000462699514 566343141 /nfs/dbraw/zinc/34/31/41/566343141.db2.gz FJDNNRUFZCORBL-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1cccc(O[C@H](C)CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000462698389 566343333 /nfs/dbraw/zinc/34/33/33/566343333.db2.gz FJWNBXUSAJRIBT-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1cc(C)nc(SCC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000482939607 566343953 /nfs/dbraw/zinc/34/39/53/566343953.db2.gz LHZZHASKQYVOEB-UHFFFAOYSA-N 0 0 380.857 3.106 20 5 GGBDRN CCC[C@](C)(NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)C(=O)OC ZINC000509874194 566343993 /nfs/dbraw/zinc/34/39/93/566343993.db2.gz QVTJLKZTQAHJRU-HNNXBMFYSA-N 0 0 387.230 3.127 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCNS(=O)(=O)c1cc(Cl)sc1Cl ZINC000462708421 566344353 /nfs/dbraw/zinc/34/43/53/566344353.db2.gz YHMPGOXYVLVVTO-UHFFFAOYSA-N 0 0 381.262 3.484 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)Oc1ccccc1F ZINC000462702888 566344417 /nfs/dbraw/zinc/34/44/17/566344417.db2.gz QAIBYHQNXFPJCP-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN Cc1ccccc1O[C@H](C)CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000462702733 566344546 /nfs/dbraw/zinc/34/45/46/566344546.db2.gz IFJSITSWSVYBRK-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H](C)Oc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000462708374 566344778 /nfs/dbraw/zinc/34/47/78/566344778.db2.gz RWYVJJVHIQJSAS-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN CO[C@H](Cn1cc([N+](=O)[O-])c(C)c(Br)c1=O)c1ccc(F)cc1 ZINC000600532073 566344788 /nfs/dbraw/zinc/34/47/88/566344788.db2.gz GIERHMKIWNCNTR-CYBMUJFWSA-N 0 0 385.189 3.354 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H](C)Oc1ccccc1Cl ZINC000462711667 566345709 /nfs/dbraw/zinc/34/57/09/566345709.db2.gz KZVSAUMLHQFCLM-LLVKDONJSA-N 0 0 384.841 3.302 20 5 GGBDRN Cn1ncc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1C(F)(F)F ZINC000446367299 566345832 /nfs/dbraw/zinc/34/58/32/566345832.db2.gz TZKUGVXOFFSFCL-UHFFFAOYSA-N 0 0 393.119 3.362 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])Oc1cccc(F)c1 ZINC000462711431 566346091 /nfs/dbraw/zinc/34/60/91/566346091.db2.gz JKMURLZZGQQCCX-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])Oc1ccccc1F ZINC000462709016 566346108 /nfs/dbraw/zinc/34/61/08/566346108.db2.gz TWBVJEMJCDBARC-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN Cc1cccc(O[C@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000462714627 566346217 /nfs/dbraw/zinc/34/62/17/566346217.db2.gz IDNDJXZCJAXYDI-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN CC[C@H](C)C[C@@H](C)NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000462714385 566346367 /nfs/dbraw/zinc/34/63/67/566346367.db2.gz FNAOMONLGQAWHO-VHSXEESVSA-N 0 0 379.276 3.460 20 5 GGBDRN O=C(CSCCOc1ccc([N+](=O)[O-])cc1)N1CCc2sccc2C1 ZINC000600571479 566347085 /nfs/dbraw/zinc/34/70/85/566347085.db2.gz OPNPEEIFXWYERT-UHFFFAOYSA-N 0 0 378.475 3.353 20 5 GGBDRN COc1cc(C(=O)Nc2cncc(Br)c2)cc([N+](=O)[O-])c1OC ZINC000536066914 566347904 /nfs/dbraw/zinc/34/79/04/566347904.db2.gz UGEPPLFIBRHJOS-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H](C)c1ccc(Br)cn1 ZINC000482978706 566348885 /nfs/dbraw/zinc/34/88/85/566348885.db2.gz KYVCCPQJUUXRHH-LLVKDONJSA-N 0 0 393.241 3.350 20 5 GGBDRN C[C@@H]1c2cccc(Br)c2CCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000509932268 566348913 /nfs/dbraw/zinc/34/89/13/566348913.db2.gz TZADGMVYJUHQCB-SNVBAGLBSA-N 0 0 378.226 3.455 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](C)c1ccc(Br)cn1 ZINC000482978708 566348956 /nfs/dbraw/zinc/34/89/56/566348956.db2.gz KYVCCPQJUUXRHH-NSHDSACASA-N 0 0 393.241 3.350 20 5 GGBDRN Cc1ccc(F)c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1Br ZINC000556953310 566349734 /nfs/dbraw/zinc/34/97/34/566349734.db2.gz IAPBQJRYISAFAO-UHFFFAOYSA-N 0 0 393.172 3.355 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)N(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000556973249 566351181 /nfs/dbraw/zinc/35/11/81/566351181.db2.gz ARVHERHABPRKES-LLVKDONJSA-N 0 0 381.230 3.174 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1ncon1 ZINC000576504789 566352059 /nfs/dbraw/zinc/35/20/59/566352059.db2.gz BOZXBEWNJRAQGR-LBPRGKRZSA-N 0 0 381.186 3.026 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCc3c(Br)cccc3[C@@H]2C)c1[N+](=O)[O-] ZINC000509982343 566354221 /nfs/dbraw/zinc/35/42/21/566354221.db2.gz MHGJSMTWRYSMDQ-VIFPVBQESA-N 0 0 379.214 3.148 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000510060627 566361978 /nfs/dbraw/zinc/36/19/78/566361978.db2.gz KNBNZDLNYBVVOM-JTQLQIEISA-N 0 0 378.226 3.422 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[C@H](C)C1 ZINC000510061636 566362249 /nfs/dbraw/zinc/36/22/49/566362249.db2.gz TVZKKYWAEQJTJM-RKDXNWHRSA-N 0 0 388.205 3.236 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[C@@H](C)C1 ZINC000510061635 566362355 /nfs/dbraw/zinc/36/23/55/566362355.db2.gz TVZKKYWAEQJTJM-IUCAKERBSA-N 0 0 388.205 3.236 20 5 GGBDRN C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000446739233 566363463 /nfs/dbraw/zinc/36/34/63/566363463.db2.gz RVAMZNCKHQHOCL-GXFFZTMASA-N 0 0 385.251 3.078 20 5 GGBDRN CCSCc1cccc(Nc2ccc(S(=O)(=O)NC)cc2[N+](=O)[O-])c1 ZINC000462884621 566364295 /nfs/dbraw/zinc/36/42/95/566364295.db2.gz QGWYWLOVGHHKGX-UHFFFAOYSA-N 0 0 381.479 3.500 20 5 GGBDRN CO[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000462897074 566365521 /nfs/dbraw/zinc/36/55/21/566365521.db2.gz RUBKZDGVESGNJX-INIZCTEOSA-N 0 0 384.841 3.451 20 5 GGBDRN C[C@@]1(CO)CCC[C@H]1Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000462901760 566367052 /nfs/dbraw/zinc/36/70/52/566367052.db2.gz XOZMDYDHYZLTPJ-ZBFHGGJFSA-N 0 0 380.242 3.290 20 5 GGBDRN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000483255923 566367310 /nfs/dbraw/zinc/36/73/10/566367310.db2.gz LMSCLVNGZYEPAJ-VIFPVBQESA-N 0 0 396.216 3.440 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCc3sc(Cl)cc32)c(F)c1 ZINC000576670434 566367227 /nfs/dbraw/zinc/36/72/27/566367227.db2.gz NUFWDQWPISWFCK-SNVBAGLBSA-N 0 0 376.818 3.415 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(Cn3cc(Br)cn3)no2)c1 ZINC000576668780 566367289 /nfs/dbraw/zinc/36/72/89/566367289.db2.gz PQGBYCYUWPPWHL-UHFFFAOYSA-N 0 0 394.185 3.051 20 5 GGBDRN COc1ccc(Cl)cc1N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000510155535 566367545 /nfs/dbraw/zinc/36/75/45/566367545.db2.gz BWNWTNXRBGTASI-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN CNc1c(C(=O)NCc2cc(OC)ccc2Br)cccc1[N+](=O)[O-] ZINC000462933154 566368515 /nfs/dbraw/zinc/36/85/15/566368515.db2.gz YYTBVUDXKGDUSM-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN O=[N+]([O-])c1ccc2[nH]c(CNCc3cc(O)ccc3Br)nc2c1 ZINC000446847137 566368509 /nfs/dbraw/zinc/36/85/09/566368509.db2.gz IYFBTKRNFJSADG-UHFFFAOYSA-N 0 0 377.198 3.229 20 5 GGBDRN C[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])Oc1cccc(Br)c1 ZINC000462923889 566368864 /nfs/dbraw/zinc/36/88/64/566368864.db2.gz FTBCEBCFGMILFO-JTQLQIEISA-N 0 0 394.225 3.336 20 5 GGBDRN O=[N+]([O-])c1c(NC[C@@H](CO)Cc2c(F)cccc2Cl)nc2sccn21 ZINC000462951888 566369977 /nfs/dbraw/zinc/36/99/77/566369977.db2.gz UCHNKTSZAONAJF-VIFPVBQESA-N 0 0 384.820 3.360 20 5 GGBDRN CNc1c(C(=O)NCCNc2ncc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000462941320 566370137 /nfs/dbraw/zinc/37/01/37/566370137.db2.gz QMVUFCMFNJJCJM-UHFFFAOYSA-N 0 0 384.223 3.180 20 5 GGBDRN C[C@H]1CCC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000446940855 566371268 /nfs/dbraw/zinc/37/12/68/566371268.db2.gz HRKXINRKTOPGQZ-UWVGGRQHSA-N 0 0 377.260 3.214 20 5 GGBDRN CCC(CC)[C@H](CCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])OC ZINC000446929832 566371756 /nfs/dbraw/zinc/37/17/56/566371756.db2.gz SIEBUKBLYWVERV-AWEZNQCLSA-N 0 0 378.878 3.368 20 5 GGBDRN C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000510282472 566372985 /nfs/dbraw/zinc/37/29/85/566372985.db2.gz JOAXUVILUCYZMA-FUXBKTLASA-N 0 0 397.254 3.293 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCc3ccccc32)c(Br)c1 ZINC000446951376 566373742 /nfs/dbraw/zinc/37/37/42/566373742.db2.gz VDDASMLWGFZGDJ-UHFFFAOYSA-N 0 0 397.250 3.499 20 5 GGBDRN C[C@@H](C1CC1)N(C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446952045 566373761 /nfs/dbraw/zinc/37/37/61/566373761.db2.gz KUSHEEPWSBLTRJ-VIFPVBQESA-N 0 0 389.271 3.309 20 5 GGBDRN C[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446946077 566373795 /nfs/dbraw/zinc/37/37/95/566373795.db2.gz NACTUPHAQWDHCI-BXKDBHETSA-N 0 0 377.260 3.214 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000446948505 566373826 /nfs/dbraw/zinc/37/38/26/566373826.db2.gz PEHJIJLTHHMWOB-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CC1(C)CN(Cc2ccc(Br)cc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000576746414 566373909 /nfs/dbraw/zinc/37/39/09/566373909.db2.gz JDHJDVCVKBUABP-INIZCTEOSA-N 0 0 385.258 3.127 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2cc3ccccc3s2)cc1[N+](=O)[O-] ZINC000557227298 566374027 /nfs/dbraw/zinc/37/40/27/566374027.db2.gz LLNHYDNEUPNECD-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000446960869 566375746 /nfs/dbraw/zinc/37/57/46/566375746.db2.gz RFBPILZBWXVRMQ-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1nc(Cc2nnc(SCC(=O)c3ccc([N+](=O)[O-])cc3)o2)cs1 ZINC000510321235 566376077 /nfs/dbraw/zinc/37/60/77/566376077.db2.gz HJQMGYPHJBHJEQ-UHFFFAOYSA-N 0 0 376.419 3.309 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000447004447 566378639 /nfs/dbraw/zinc/37/86/39/566378639.db2.gz BAPZSKMBPWTSGH-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc(F)ccc2F)c(Br)c1 ZINC000447004571 566378727 /nfs/dbraw/zinc/37/87/27/566378727.db2.gz CLMMWGFIULIHIS-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN CCCN(CC(C)C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000447035141 566379347 /nfs/dbraw/zinc/37/93/47/566379347.db2.gz BRHHABMFLDOXIC-UHFFFAOYSA-N 0 0 379.276 3.414 20 5 GGBDRN CC(C)C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000447016651 566379628 /nfs/dbraw/zinc/37/96/28/566379628.db2.gz KUTMZKBQZTTYSP-NSHDSACASA-N 0 0 391.287 3.414 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2(c3ccccc3)CC2)c(Br)c1 ZINC000447032693 566379958 /nfs/dbraw/zinc/37/99/58/566379958.db2.gz AAFACEZCXNOPKW-UHFFFAOYSA-N 0 0 397.250 3.325 20 5 GGBDRN CC[C@@H]1CCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000447021863 566380074 /nfs/dbraw/zinc/38/00/74/566380074.db2.gz AVGSKPSGYNWFOB-SKDRFNHKSA-N 0 0 377.260 3.214 20 5 GGBDRN CCCC1(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000447016720 566380087 /nfs/dbraw/zinc/38/00/87/566380087.db2.gz KWLYYRDWAWKIGL-UHFFFAOYSA-N 0 0 377.260 3.216 20 5 GGBDRN CC(C)C[C@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000447016650 566380122 /nfs/dbraw/zinc/38/01/22/566380122.db2.gz KUTMZKBQZTTYSP-LLVKDONJSA-N 0 0 391.287 3.414 20 5 GGBDRN Cc1cccc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000447041465 566381552 /nfs/dbraw/zinc/38/15/52/566381552.db2.gz WIKGVKLOUXRTLX-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN COc1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)ncc1Br ZINC000536527326 566381713 /nfs/dbraw/zinc/38/17/13/566381713.db2.gz CSQLHYXSZCEIQI-UHFFFAOYSA-N 0 0 380.198 3.332 20 5 GGBDRN CC[C@H]1Cc2c(Br)cccc2CN1C(=O)c1c([N+](=O)[O-])cnn1C ZINC000447062278 566381777 /nfs/dbraw/zinc/38/17/77/566381777.db2.gz YRORAAUUJLOGTF-NSHDSACASA-N 0 0 393.241 3.068 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)s1 ZINC000447038624 566381819 /nfs/dbraw/zinc/38/18/19/566381819.db2.gz MBPWEFIIIMXVKQ-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CCCc1nc(CS(=O)(=O)CCCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000600940512 566381931 /nfs/dbraw/zinc/38/19/31/566381931.db2.gz KMTSHMDCSRTJMH-UHFFFAOYSA-N 0 0 384.479 3.388 20 5 GGBDRN Cc1cc(F)c(NC(=O)c2ccc([N+](=O)[O-])o2)c(I)c1 ZINC000536559900 566383503 /nfs/dbraw/zinc/38/35/03/566383503.db2.gz CBQGLZNDAHFMSI-UHFFFAOYSA-N 0 0 390.108 3.492 20 5 GGBDRN CCC(=O)Nc1cccc(CNc2c(Br)cncc2[N+](=O)[O-])c1 ZINC000536574864 566385023 /nfs/dbraw/zinc/38/50/23/566385023.db2.gz INGFGMFBLYTVDG-UHFFFAOYSA-N 0 0 379.214 3.135 20 5 GGBDRN Cn1ccc(-c2noc(-c3ccc([N+](=O)[O-])cc3I)n2)c1 ZINC000576908543 566387639 /nfs/dbraw/zinc/38/76/39/566387639.db2.gz RBJIPGCQSNQIAG-UHFFFAOYSA-N 0 0 396.144 3.255 20 5 GGBDRN CN(CC(=O)NCc1cc(F)ccc1Br)c1ccccc1[N+](=O)[O-] ZINC000463188469 566389940 /nfs/dbraw/zinc/38/99/40/566389940.db2.gz GPRLTTMHVTVXTI-UHFFFAOYSA-N 0 0 396.216 3.249 20 5 GGBDRN O=C(NCCNc1c(F)cccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000557503995 566390801 /nfs/dbraw/zinc/39/08/01/566390801.db2.gz VGQIZXRYSUJLML-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CCCN(CCN1CCCCC1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000510522943 566391003 /nfs/dbraw/zinc/39/10/03/566391003.db2.gz RRDKQYGKPJVIOU-UHFFFAOYSA-N 0 0 389.905 3.135 20 5 GGBDRN Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC1CCN(c2cccs2)CC1 ZINC000601127705 566392010 /nfs/dbraw/zinc/39/20/10/566392010.db2.gz NUOSODFKHODZJH-UHFFFAOYSA-N 0 0 375.376 3.490 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NC[C@H](n1cncn1)C(F)(F)F ZINC000601219390 566396391 /nfs/dbraw/zinc/39/63/91/566396391.db2.gz JSFHKDNNGYIYOM-JTQLQIEISA-N 0 0 380.124 3.164 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NC[C@@H](n1cncn1)C(F)(F)F ZINC000601219391 566396980 /nfs/dbraw/zinc/39/69/80/566396980.db2.gz JSFHKDNNGYIYOM-SNVBAGLBSA-N 0 0 380.124 3.164 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1ccc(Cl)c(F)c1 ZINC000510608084 566397798 /nfs/dbraw/zinc/39/77/98/566397798.db2.gz ZFHBYQBEJRCSDN-UHFFFAOYSA-N 0 0 386.832 3.392 20 5 GGBDRN C[C@H]1c2cc(Cl)c(Cl)cc2CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000536746052 566398475 /nfs/dbraw/zinc/39/84/75/566398475.db2.gz VHEBQFMLLYHZKL-GWCFXTLKSA-N 0 0 385.251 3.078 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1Br ZINC000510625976 566398845 /nfs/dbraw/zinc/39/88/45/566398845.db2.gz BWONTBNYMQWROP-UHFFFAOYSA-N 0 0 399.266 3.221 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1ccc(F)c(Cl)c1 ZINC000510622267 566400023 /nfs/dbraw/zinc/40/00/23/566400023.db2.gz NXFHBZHQQLDGLW-UHFFFAOYSA-N 0 0 386.832 3.392 20 5 GGBDRN COCCSCCCOc1ccc(I)cc1[N+](=O)[O-] ZINC000447302964 566401946 /nfs/dbraw/zinc/40/19/46/566401946.db2.gz CTNMWHLPRZPRLG-UHFFFAOYSA-N 0 0 397.234 3.348 20 5 GGBDRN COC(=O)c1ccc(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000421696822 566402012 /nfs/dbraw/zinc/40/20/12/566402012.db2.gz CJLRFKZDLIMQCP-SNVBAGLBSA-N 0 0 380.447 3.240 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1Cc2cccc(Cl)c2C1 ZINC000510656046 566402569 /nfs/dbraw/zinc/40/25/69/566402569.db2.gz DFBACFNXAKKSMS-UHFFFAOYSA-N 0 0 380.187 3.383 20 5 GGBDRN CSc1cc(CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000536811001 566402993 /nfs/dbraw/zinc/40/29/93/566402993.db2.gz VAUPCNOCMYXGEY-JTQLQIEISA-N 0 0 381.841 3.449 20 5 GGBDRN Cc1c(CNC(=O)C(=O)Nc2cc(Cl)ccc2Cl)cccc1[N+](=O)[O-] ZINC000483820989 566403773 /nfs/dbraw/zinc/40/37/73/566403773.db2.gz PNEHWNFXDPDUIQ-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1c(CNC(=O)C(=O)Nc2cc(Cl)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000483824260 566403936 /nfs/dbraw/zinc/40/39/36/566403936.db2.gz SYNMQEFOVGTSGT-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1c(CNC(=O)C(=O)Nc2ccc(Cl)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000483827188 566404034 /nfs/dbraw/zinc/40/40/34/566404034.db2.gz XSHFEOIYBZTNSZ-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1cc(Br)ccc1CC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000483853819 566404705 /nfs/dbraw/zinc/40/47/05/566404705.db2.gz HXSKVDWGHNSPOF-UHFFFAOYSA-N 0 0 392.253 3.437 20 5 GGBDRN Cc1cc(N2CCOC[C@@H]2[C@@H]2CCCC[C@@H]2O)c(Br)cc1[N+](=O)[O-] ZINC000557701137 566410938 /nfs/dbraw/zinc/41/09/38/566410938.db2.gz KOPOGTYPMTZACG-VUCTXSBTSA-N 0 0 399.285 3.422 20 5 GGBDRN Cc1cc(N2CCOC[C@@H]2[C@H]2CCCC[C@@H]2O)c(Br)cc1[N+](=O)[O-] ZINC000557701133 566411144 /nfs/dbraw/zinc/41/11/44/566411144.db2.gz KOPOGTYPMTZACG-JLZZUVOBSA-N 0 0 399.285 3.422 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1sccc1Br ZINC000463435721 566411127 /nfs/dbraw/zinc/41/11/27/566411127.db2.gz LVXIXNNWSBWYCP-UHFFFAOYSA-N 0 0 394.044 3.391 20 5 GGBDRN Cc1c(Br)c(N2CCOc3cc(O)ccc3C2)ncc1[N+](=O)[O-] ZINC000557715000 566411171 /nfs/dbraw/zinc/41/11/71/566411171.db2.gz NYULTRPHCNGNNU-UHFFFAOYSA-N 0 0 380.198 3.165 20 5 GGBDRN Cc1cc(N2CCOC[C@@H]2[C@@H]2CCCC[C@H]2O)c(Br)cc1[N+](=O)[O-] ZINC000557701129 566411350 /nfs/dbraw/zinc/41/13/50/566411350.db2.gz KOPOGTYPMTZACG-JCURWCKSSA-N 0 0 399.285 3.422 20 5 GGBDRN C[S@](=O)Cc1ccc(CNc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000557728799 566411972 /nfs/dbraw/zinc/41/19/72/566411972.db2.gz ISGZOKGRCILFCB-QFIPXVFZSA-N 0 0 384.255 3.243 20 5 GGBDRN Cc1cc(OCC(=O)NCc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000510802499 566413600 /nfs/dbraw/zinc/41/36/00/566413600.db2.gz FNLZIOQQYLZQIW-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN CCc1nnc(NC(=O)[C@H](C)[C@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])s1 ZINC000557753246 566413910 /nfs/dbraw/zinc/41/39/10/566413910.db2.gz NNJJFGBCWZGRJX-SFYZADRCSA-N 0 0 384.849 3.132 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C(F)(F)F)OC(C)(C)C2)c1 ZINC000557754868 566414074 /nfs/dbraw/zinc/41/40/74/566414074.db2.gz CIYHXZIHFJRNQK-LBPRGKRZSA-N 0 0 378.372 3.499 20 5 GGBDRN NS(=O)(=O)c1cccc(NCC(F)(F)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000557760388 566415757 /nfs/dbraw/zinc/41/57/57/566415757.db2.gz DWFPUNAMGWOMSC-UHFFFAOYSA-N 0 0 391.783 3.100 20 5 GGBDRN NS(=O)(=O)c1ccc(NCC(F)(F)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000557761431 566415832 /nfs/dbraw/zinc/41/58/32/566415832.db2.gz KZWZZJAHQSVWHC-UHFFFAOYSA-N 0 0 391.783 3.100 20 5 GGBDRN O=C(Nc1ccnn1Cc1cccc(Cl)c1Cl)c1cc([N+](=O)[O-])n[nH]1 ZINC000510857451 566416748 /nfs/dbraw/zinc/41/67/48/566416748.db2.gz OLYLXXUEGFOPDY-UHFFFAOYSA-N 0 0 381.179 3.122 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCC[C@H]2Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000421915752 566416992 /nfs/dbraw/zinc/41/69/92/566416992.db2.gz INZIYCMVSTZARP-LBPRGKRZSA-N 0 0 393.241 3.236 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCSc2ccccc21 ZINC000537033314 566419030 /nfs/dbraw/zinc/41/90/30/566419030.db2.gz GCRINKLZAJTDCX-UHFFFAOYSA-N 0 0 380.447 3.295 20 5 GGBDRN CN(CC(=O)NCc1ccc(Br)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000463582798 566419992 /nfs/dbraw/zinc/41/99/92/566419992.db2.gz NDTDZKDHBVMZCX-UHFFFAOYSA-N 0 0 396.216 3.249 20 5 GGBDRN C[C@H](CC[S@](C)=O)Nc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000447676150 566420542 /nfs/dbraw/zinc/42/05/42/566420542.db2.gz PVKROBMSBVLGBR-CTGLIMNLSA-N 0 0 375.319 3.213 20 5 GGBDRN Cc1cnc(N[C@H]2CCN(c3cccc(Br)c3)C2=O)c([N+](=O)[O-])c1 ZINC000447683661 566420551 /nfs/dbraw/zinc/42/05/51/566420551.db2.gz SBJBLGHDUKKCAK-ZDUSSCGKSA-N 0 0 391.225 3.278 20 5 GGBDRN Cc1cc(N[C@H]2CCN(c3cccc(Br)c3)C2=O)ncc1[N+](=O)[O-] ZINC000447673830 566420925 /nfs/dbraw/zinc/42/09/25/566420925.db2.gz WJKGHJQXNQFFTG-ZDUSSCGKSA-N 0 0 391.225 3.278 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000577268999 566421030 /nfs/dbraw/zinc/42/10/30/566421030.db2.gz GVMMBHQNKZIWAQ-TZMCWYRMSA-N 0 0 381.841 3.258 20 5 GGBDRN COc1ccc(C(=O)CNC(=O)CCc2cc(Cl)cs2)cc1[N+](=O)[O-] ZINC000601741686 566422018 /nfs/dbraw/zinc/42/20/18/566422018.db2.gz XQSPDRZBEGFOMN-UHFFFAOYSA-N 0 0 382.825 3.250 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000463629003 566422303 /nfs/dbraw/zinc/42/23/03/566422303.db2.gz ZBEZLAAMAIENGA-AULYBMBSSA-N 0 0 391.225 3.242 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCCC[C@@H]1Cc1ccccc1Br ZINC000577319216 566424743 /nfs/dbraw/zinc/42/47/43/566424743.db2.gz GYBZHBZDLJEUIV-GFCCVEGCSA-N 0 0 393.241 3.318 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCCc2c(Br)ccc(Cl)c21 ZINC000484322594 566425534 /nfs/dbraw/zinc/42/55/34/566425534.db2.gz DIXQNQXNODFLGU-UHFFFAOYSA-N 0 0 399.632 3.337 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCc2c(Br)ccc(Cl)c21 ZINC000484332176 566426031 /nfs/dbraw/zinc/42/60/31/566426031.db2.gz QQMIVTAJQULXSJ-UHFFFAOYSA-N 0 0 399.632 3.187 20 5 GGBDRN COC(=O)c1cc(NC(=O)[C@@H]2SCCc3sccc32)cc([N+](=O)[O-])c1 ZINC000463696955 566427496 /nfs/dbraw/zinc/42/74/96/566427496.db2.gz PJTZNIUMAMTBJT-CQSZACIVSA-N 0 0 378.431 3.412 20 5 GGBDRN COc1cc(Cl)c(S(=O)(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000447778302 566428589 /nfs/dbraw/zinc/42/85/89/566428589.db2.gz PCYFKSOWOGHIGA-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000601885529 566429428 /nfs/dbraw/zinc/42/94/28/566429428.db2.gz FYQXFKLVAVQMJL-ILXRZTDVSA-N 0 0 383.242 3.123 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc2n[nH]cc2c1 ZINC000511032496 566429534 /nfs/dbraw/zinc/42/95/34/566429534.db2.gz RKUUNFWAWUZCNT-SECBINFHSA-N 0 0 380.813 3.164 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)CC(F)(F)F)c([N+](=O)[O-])c1 ZINC000463749007 566429745 /nfs/dbraw/zinc/42/97/45/566429745.db2.gz HHFKROXBXZTGRC-JTQLQIEISA-N 0 0 383.392 3.378 20 5 GGBDRN CN(CC(=O)NCCc1ccc(Br)cc1)c1ccccc1[N+](=O)[O-] ZINC000463732774 566430335 /nfs/dbraw/zinc/43/03/35/566430335.db2.gz KMKQUICJZYBRHX-UHFFFAOYSA-N 0 0 392.253 3.152 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCSc1nnc(-c2cccc(Cl)c2)n1C ZINC000601914017 566430971 /nfs/dbraw/zinc/43/09/71/566430971.db2.gz UCYVCYFXEGFMGJ-UHFFFAOYSA-N 0 0 378.845 3.341 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCSCc1ncc(Br)cc1F ZINC000601917373 566431341 /nfs/dbraw/zinc/43/13/41/566431341.db2.gz ICMANWOVUXWBKE-UHFFFAOYSA-N 0 0 375.223 3.330 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCSCCCS(=O)(=O)c1ccc(C)cc1 ZINC000601917707 566431679 /nfs/dbraw/zinc/43/16/79/566431679.db2.gz KCOWJXIJBAUVEB-UHFFFAOYSA-N 0 0 383.495 3.005 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1nnc(-c2ccccc2)s1 ZINC000463754412 566431746 /nfs/dbraw/zinc/43/17/46/566431746.db2.gz HICLRGYFJLXMSJ-UHFFFAOYSA-N 0 0 393.222 3.086 20 5 GGBDRN CC[C@@H](C)n1[nH]c(=NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1C ZINC000537211623 566431894 /nfs/dbraw/zinc/43/18/94/566431894.db2.gz OHFLRZFCSDLWHT-SNVBAGLBSA-N 0 0 395.257 3.436 20 5 GGBDRN Cc1ccnc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c1 ZINC000511054813 566432757 /nfs/dbraw/zinc/43/27/57/566432757.db2.gz QTPQOYMPEWAGGN-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)n1 ZINC000511091965 566435701 /nfs/dbraw/zinc/43/57/01/566435701.db2.gz RKTNHZBFPSEEIC-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1Br ZINC000511108175 566437284 /nfs/dbraw/zinc/43/72/84/566437284.db2.gz PHUAQCCNZXFUBS-UHFFFAOYSA-N 0 0 392.253 3.470 20 5 GGBDRN CC(C)O[C@@H]1C[C@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000463859420 566438616 /nfs/dbraw/zinc/43/86/16/566438616.db2.gz NTQMTIUQFBSVRR-QWHCGFSZSA-N 0 0 376.862 3.119 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1cccc2c1CNC2=O ZINC000557960074 566438485 /nfs/dbraw/zinc/43/84/85/566438485.db2.gz CNEDQEHZAUPNME-UHFFFAOYSA-N 0 0 377.809 3.222 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC1CC(C(F)(F)F)C1 ZINC000557987307 566439385 /nfs/dbraw/zinc/43/93/85/566439385.db2.gz IQAGANSMMNWEIN-UHFFFAOYSA-N 0 0 381.148 3.357 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@H](c2cccc(Br)c2)C1 ZINC000558007550 566441686 /nfs/dbraw/zinc/44/16/86/566441686.db2.gz VAJGAIHNOMSGGH-AWEZNQCLSA-N 0 0 395.257 3.460 20 5 GGBDRN CCNc1ccc(C(=O)N(C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000511164684 566442269 /nfs/dbraw/zinc/44/22/69/566442269.db2.gz JRNBRIFFDPAUPB-UHFFFAOYSA-N 0 0 379.214 3.461 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CCSc2ccc(Br)cc21 ZINC000511150593 566442455 /nfs/dbraw/zinc/44/24/55/566442455.db2.gz AKEWNCAYJTVJJF-NSHDSACASA-N 0 0 397.254 3.390 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NC[C@H](CO)c1ccccc1Cl ZINC000558028273 566442592 /nfs/dbraw/zinc/44/25/92/566442592.db2.gz CVCGAWDLDPOZSU-SECBINFHSA-N 0 0 386.633 3.016 20 5 GGBDRN Cc1c(C(=O)N[C@H](CO)c2ccc(Br)c(F)c2)cccc1[N+](=O)[O-] ZINC000558036941 566444263 /nfs/dbraw/zinc/44/42/63/566444263.db2.gz VKYCUAXDKXFELM-CQSZACIVSA-N 0 0 397.200 3.268 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](c2cccs2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000577562429 566444836 /nfs/dbraw/zinc/44/48/36/566444836.db2.gz AUFVGLRVUZDCSJ-CYBMUJFWSA-N 0 0 390.508 3.064 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCc1nc(-c2cccs2)c[nH]1 ZINC000558036046 566444940 /nfs/dbraw/zinc/44/49/40/566444940.db2.gz VMVAITKWKFOOJP-UHFFFAOYSA-N 0 0 380.227 3.238 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1cc(F)cc(Br)c1 ZINC000484703558 566447991 /nfs/dbraw/zinc/44/79/91/566447991.db2.gz GORAMQZCXSUQSR-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000511240749 566448071 /nfs/dbraw/zinc/44/80/71/566448071.db2.gz MKUOSDNTMOYFNM-CQSZACIVSA-N 0 0 382.825 3.393 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC(C(F)F)CC1 ZINC000484721167 566449802 /nfs/dbraw/zinc/44/98/02/566449802.db2.gz BNFGACVAOXRJLD-UHFFFAOYSA-N 0 0 377.185 3.404 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000558116031 566450707 /nfs/dbraw/zinc/45/07/07/566450707.db2.gz FYSSLMFNDJFSHU-ZDUSSCGKSA-N 0 0 379.825 3.356 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000558116030 566450986 /nfs/dbraw/zinc/45/09/86/566450986.db2.gz FYSSLMFNDJFSHU-CYBMUJFWSA-N 0 0 379.825 3.356 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1cc(F)cc(Br)c1 ZINC000484756828 566451227 /nfs/dbraw/zinc/45/12/27/566451227.db2.gz LWVOBOKWCZBSCW-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCC(=O)c1ccccc1Cl ZINC000464185776 566451315 /nfs/dbraw/zinc/45/13/15/566451315.db2.gz NIONZDXPUAFXSL-UHFFFAOYSA-N 0 0 382.825 3.026 20 5 GGBDRN Cc1ccnc([C@H](C)NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 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Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)cc1C ZINC000541287456 566710565 /nfs/dbraw/zinc/71/05/65/566710565.db2.gz STTIAGGNESJEGF-UHFFFAOYSA-N 0 0 394.225 3.083 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCOC[C@@H]2c2ccc(F)cc2)c(Br)c1 ZINC000450835153 566710689 /nfs/dbraw/zinc/71/06/89/566710689.db2.gz FVBZWFPIHPASRW-CQSZACIVSA-N 0 0 382.189 3.469 20 5 GGBDRN Cn1nccc1[C@@H]1C[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])CCO1 ZINC000450848338 566711656 /nfs/dbraw/zinc/71/16/56/566711656.db2.gz WWMGHJRHJOKXEH-ABAIWWIYSA-N 0 0 381.230 3.423 20 5 GGBDRN C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000541299105 566712108 /nfs/dbraw/zinc/71/21/08/566712108.db2.gz KQWGBWLIQBFQHC-VDBVYFBLSA-N 0 0 378.475 3.302 20 5 GGBDRN Cn1nccc1[C@H]1C[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])CCO1 ZINC000450848339 566712531 /nfs/dbraw/zinc/71/25/31/566712531.db2.gz WWMGHJRHJOKXEH-IAQYHMDHSA-N 0 0 381.230 3.423 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1CN(CCO)Cc1cccc(Br)c1 ZINC000488195761 566712651 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GGBDRN CS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)s1 ZINC000468613594 566714432 /nfs/dbraw/zinc/71/44/32/566714432.db2.gz WXSUDOCDZZZREC-UHFFFAOYSA-N 0 0 378.378 3.273 20 5 GGBDRN COc1ccc(NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)cc1Cl ZINC000488232871 566715207 /nfs/dbraw/zinc/71/52/07/566715207.db2.gz PWYSPAIAOAWYQM-UHFFFAOYSA-N 0 0 390.776 3.205 20 5 GGBDRN O=[N+]([O-])c1ccc(SCc2cccnc2)c(S(=O)(=O)N2CCCC2)c1 ZINC000450874292 566715524 /nfs/dbraw/zinc/71/55/24/566715524.db2.gz GDMXVTKRLLZWLK-UHFFFAOYSA-N 0 0 379.463 3.067 20 5 GGBDRN COCCN(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCSC1 ZINC000468618110 566716125 /nfs/dbraw/zinc/71/61/25/566716125.db2.gz JXJSSBIKSAMGIC-DZGCQCFKSA-N 0 0 384.523 3.446 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(Cn2cc(-n3cccc3)cn2)c1 ZINC000515505896 566717756 /nfs/dbraw/zinc/71/77/56/566717756.db2.gz XBIZBBYWSLLSLQ-UHFFFAOYSA-N 0 0 394.172 3.235 20 5 GGBDRN Cc1c(CNS(=O)(=O)Cc2ccccc2Br)cccc1[N+](=O)[O-] ZINC000561546404 566718028 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COc1ccc(C(=O)COc2ncc(C)cc2[N+](=O)[O-])cc1Br ZINC000426609308 566720441 /nfs/dbraw/zinc/72/04/41/566720441.db2.gz YEJKEQDOWFJTQS-UHFFFAOYSA-N 0 0 381.182 3.331 20 5 GGBDRN CCC(CC)(CCn1cc([N+](=O)[O-])c(C)c(Br)c1=O)C(=O)OC ZINC000450913881 566720917 /nfs/dbraw/zinc/72/09/17/566720917.db2.gz ZTFMRXODKQYHJH-UHFFFAOYSA-N 0 0 389.246 3.197 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC(C)(C)[C@@H]1c1cccs1 ZINC000561564749 566721010 /nfs/dbraw/zinc/72/10/10/566721010.db2.gz TYMRRKWZHUHXNL-HNNXBMFYSA-N 0 0 382.463 3.437 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCc3c2cccc3Br)cccc1[N+](=O)[O-] ZINC000468693428 566721707 /nfs/dbraw/zinc/72/17/07/566721707.db2.gz JHAUPOQWOXFICG-ZDUSSCGKSA-N 0 0 376.210 3.357 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNc2ncnc3ccc(Br)cc32)cc1 ZINC000515580105 566722570 /nfs/dbraw/zinc/72/25/70/566722570.db2.gz LEKXYFNAPDQVJK-UHFFFAOYSA-N 0 0 388.225 3.246 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCO[C@@H](c3nccn3C)C2)ncc1[N+](=O)[O-] ZINC000450953110 566723776 /nfs/dbraw/zinc/72/37/76/566723776.db2.gz WZFQHVBFVRJKGS-ZYHUDNBSSA-N 0 0 396.245 3.126 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1nc(C(F)(F)F)cs1 ZINC000541426994 566724365 /nfs/dbraw/zinc/72/43/65/566724365.db2.gz GAJIKGLQOLWODA-UHFFFAOYSA-N 0 0 376.316 3.400 20 5 GGBDRN Nc1c(C(=O)Nc2nc3cc(Br)ccc3[nH]2)cccc1[N+](=O)[O-] ZINC000468745584 566725596 /nfs/dbraw/zinc/72/55/96/566725596.db2.gz BWFDYQNCOZQZCX-UHFFFAOYSA-N 0 0 376.170 3.068 20 5 GGBDRN CSc1cccc(C(=O)NC[C@@H](CO)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000561651939 566726572 /nfs/dbraw/zinc/72/65/72/566726572.db2.gz IZZTXARAFMYTSW-NSHDSACASA-N 0 0 380.853 3.476 20 5 GGBDRN C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)Oc1ccc(Br)cc1 ZINC000468747921 566726651 /nfs/dbraw/zinc/72/66/51/566726651.db2.gz ZQAMPOXBFBMNJM-JTQLQIEISA-N 0 0 394.225 3.137 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)NC1(c2ccc(Br)cc2)CCCC1 ZINC000515678468 566726768 /nfs/dbraw/zinc/72/67/68/566726768.db2.gz DXMLUYSMPJOHHV-UHFFFAOYSA-N 0 0 393.241 3.140 20 5 GGBDRN CNS(=O)(=O)c1ccc(NC[C@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC000488439466 566727125 /nfs/dbraw/zinc/72/71/25/566727125.db2.gz HXOISZMXPLRJFE-NSHDSACASA-N 0 0 377.413 3.130 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H](COC(F)F)C1 ZINC000561669803 566726962 /nfs/dbraw/zinc/72/69/62/566726962.db2.gz QJZYUBWASMZFRC-SNVBAGLBSA-N 0 0 377.775 3.061 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1Oc1ncncc1Cl ZINC000468748907 566727093 /nfs/dbraw/zinc/72/70/93/566727093.db2.gz XTMXFMXZDNXHIL-UHFFFAOYSA-N 0 0 377.525 3.435 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCc3c([N+](=O)[O-])cccc32)c(Cl)c1 ZINC000515698390 566727263 /nfs/dbraw/zinc/72/72/63/566727263.db2.gz AXWNAIUMZBCFQB-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@H](CCO)c1ccccc1Br ZINC000561683645 566728923 /nfs/dbraw/zinc/72/89/23/566728923.db2.gz MGOQMGDBNJZUPZ-CYBMUJFWSA-N 0 0 383.246 3.418 20 5 GGBDRN C[C@H](C[S@](C)=O)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000541502688 566728890 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3.219 20 5 GGBDRN Cc1c(Br)c(Oc2ccc3c(c2)CN(C)C3=O)ncc1[N+](=O)[O-] ZINC000541577714 566734350 /nfs/dbraw/zinc/73/43/50/566734350.db2.gz WQFLNSQVFYWGNW-UHFFFAOYSA-N 0 0 378.182 3.439 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H]2CCSc3ccccc32)ccc1[N+](=O)[O-] ZINC000468828916 566734734 /nfs/dbraw/zinc/73/47/34/566734734.db2.gz FHTPQVLKPCUHEG-CYBMUJFWSA-N 0 0 380.447 3.119 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCCC[C@@H]2N2CCOCC2)ncc1[N+](=O)[O-] ZINC000541578932 566735122 /nfs/dbraw/zinc/73/51/22/566735122.db2.gz OUNVPMWGNVLUAR-STQMWFEESA-N 0 0 399.289 3.116 20 5 GGBDRN O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)NCc1cccc([N+](=O)[O-])c1 ZINC000608783627 566736243 /nfs/dbraw/zinc/73/62/43/566736243.db2.gz DUEFFHQAUDGZTR-UHFFFAOYSA-N 0 0 379.203 3.408 20 5 GGBDRN CC(C)(C(=O)NCCOc1cccc(Cl)c1Cl)n1cc([N+](=O)[O-])cn1 ZINC000608805699 566736510 /nfs/dbraw/zinc/73/65/10/566736510.db2.gz AEYIPRVLVHNERA-UHFFFAOYSA-N 0 0 387.223 3.028 20 5 GGBDRN Cc1c(Br)c(Oc2cccc(S(C)(=O)=O)c2)ncc1[N+](=O)[O-] ZINC000541590685 566736727 /nfs/dbraw/zinc/73/67/27/566736727.db2.gz ISAGITIVKVWVAE-UHFFFAOYSA-N 0 0 387.211 3.257 20 5 GGBDRN Cc1c(Br)c(N2CCC([C@@H](O)C(F)(F)F)CC2)ncc1[N+](=O)[O-] ZINC000541579989 566736943 /nfs/dbraw/zinc/73/69/43/566736943.db2.gz MAORBWGVBDVADW-LLVKDONJSA-N 0 0 398.179 3.200 20 5 GGBDRN Cc1c(Br)c(N(C)Cc2nccn2C(F)F)ncc1[N+](=O)[O-] ZINC000541591463 566736974 /nfs/dbraw/zinc/73/69/74/566736974.db2.gz GBLXIIFRUWOKHO-UHFFFAOYSA-N 0 0 376.161 3.289 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCCc2occc2C1 ZINC000561769636 566737362 /nfs/dbraw/zinc/73/73/62/566737362.db2.gz AVPOZHSZEIVROP-UHFFFAOYSA-N 0 0 379.210 3.468 20 5 GGBDRN O=C(Nc1nnc(-c2ccsc2)s1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000515871172 566737686 /nfs/dbraw/zinc/73/76/86/566737686.db2.gz GPIRJIAUANBEFX-UHFFFAOYSA-N 0 0 376.375 3.156 20 5 GGBDRN COc1cc(Br)cc(C)c1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000488657382 566737926 /nfs/dbraw/zinc/73/79/26/566737926.db2.gz RZHKFGGNWFJTQV-UHFFFAOYSA-N 0 0 397.229 3.208 20 5 GGBDRN Cc1cc(C(=O)N[C@H](CO)c2ccc(Br)c(F)c2)ccc1[N+](=O)[O-] ZINC000561774287 566738490 /nfs/dbraw/zinc/73/84/90/566738490.db2.gz NXCRZZMIGDXBRQ-CQSZACIVSA-N 0 0 397.200 3.268 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCCc3cccc(Cl)c32)ccc1[N+](=O)[O-] ZINC000468867329 566738798 /nfs/dbraw/zinc/73/87/98/566738798.db2.gz HHCLIHNIQJEFBU-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NC1(c2c(Cl)cccc2Cl)CC1 ZINC000426968797 566741270 /nfs/dbraw/zinc/74/12/70/566741270.db2.gz OYORNVNQVYVQTQ-UHFFFAOYSA-N 0 0 384.223 3.087 20 5 GGBDRN Cn1c(=O)c(CNc2ncc(Br)cc2[N+](=O)[O-])cc2ccccc21 ZINC000488694068 566741827 /nfs/dbraw/zinc/74/18/27/566741827.db2.gz OADJUTSUNMEZQP-UHFFFAOYSA-N 0 0 389.209 3.216 20 5 GGBDRN COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000608909005 566742292 /nfs/dbraw/zinc/74/22/92/566742292.db2.gz JWSRWLSLKZVGRY-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN O=C1[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)CN1c1ccc(Br)cc1 ZINC000488718961 566742387 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O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)NCCCc1ccccc1 ZINC000609030370 566748046 /nfs/dbraw/zinc/74/80/46/566748046.db2.gz SXLKYRWUYDIWAZ-UHFFFAOYSA-N 0 0 399.266 3.268 20 5 GGBDRN CC1(C)Cc2ccc(Br)cc2[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000561941814 566750239 /nfs/dbraw/zinc/75/02/39/566750239.db2.gz GYFMKRZGHUHZGD-ZDUSSCGKSA-N 0 0 379.214 3.134 20 5 GGBDRN Cc1cnc([C@@H](NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C2CC2)s1 ZINC000541815173 566750571 /nfs/dbraw/zinc/75/05/71/566750571.db2.gz MSUCUFOPQQBPOD-HNNXBMFYSA-N 0 0 381.479 3.406 20 5 GGBDRN CN(Cc1ccsc1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000609134129 566751128 /nfs/dbraw/zinc/75/11/28/566751128.db2.gz PDJOWPPCUMOGOQ-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN CC1(C)Cc2ccc(Br)cc2[C@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000561941813 566751136 /nfs/dbraw/zinc/75/11/36/566751136.db2.gz GYFMKRZGHUHZGD-CYBMUJFWSA-N 0 0 379.214 3.134 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2ccc(Cn3cncn3)cc2)c(Br)c1 ZINC000561953935 566751973 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O=[N+]([O-])c1cc(I)cc(C[NH2+]Cc2ccc(O)cc2)c1 ZINC000581221066 566759013 /nfs/dbraw/zinc/75/90/13/566759013.db2.gz WKJFPOODHYDGND-UHFFFAOYSA-N 0 0 384.173 3.195 20 5 GGBDRN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541925120 566759268 /nfs/dbraw/zinc/75/92/68/566759268.db2.gz UFMHNFLYZMJJBX-VIFPVBQESA-N 0 0 397.204 3.066 20 5 GGBDRN C[C@H](CCc1ccc(Br)cc1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541906755 566760031 /nfs/dbraw/zinc/76/00/31/566760031.db2.gz VATKBTHWYIKCRR-LLVKDONJSA-N 0 0 393.241 3.317 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)NCc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000516363447 566760262 /nfs/dbraw/zinc/76/02/62/566760262.db2.gz PDKLRJRDTDUIKO-UHFFFAOYSA-N 0 0 376.768 3.313 20 5 GGBDRN COc1cc(Cl)ccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000609353623 566761036 /nfs/dbraw/zinc/76/10/36/566761036.db2.gz YLEVJGOITMJPJO-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN NS(=O)(=O)c1ccc(NCc2nc3cc(Cl)ccc3s2)c([N+](=O)[O-])c1 ZINC000516397045 566761711 /nfs/dbraw/zinc/76/17/11/566761711.db2.gz ULFYNWRZTBTDEI-UHFFFAOYSA-N 0 0 398.853 3.117 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N[C@@H](CO)c3ccc(Br)cc3)ccc2c1 ZINC000488993567 566762337 /nfs/dbraw/zinc/76/23/37/566762337.db2.gz CDLCKXHEKXCMDT-INIZCTEOSA-N 0 0 388.221 3.473 20 5 GGBDRN CC1(CNS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CCCC1 ZINC000609419464 566764166 /nfs/dbraw/zinc/76/41/66/566764166.db2.gz BIWNCFLQFQETCO-UHFFFAOYSA-N 0 0 377.260 3.216 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2nc3cc(Cl)ccc3s2)c1[N+](=O)[O-] ZINC000609476753 566765661 /nfs/dbraw/zinc/76/56/61/566765661.db2.gz HGOIIXIGVXEMEB-UHFFFAOYSA-N 0 0 379.829 3.464 20 5 GGBDRN COc1ccc(NC(=O)COc2ccccc2Br)cc1[N+](=O)[O-] ZINC000541999946 566766786 /nfs/dbraw/zinc/76/67/86/566766786.db2.gz DVLWSOHMWDXQJG-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2Br)C1)c1ccccc1[N+](=O)[O-] ZINC000609509157 566768190 /nfs/dbraw/zinc/76/81/90/566768190.db2.gz JMNSNGIFVYMCBM-GFCCVEGCSA-N 0 0 390.237 3.366 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2Br)C1)c1ccc([N+](=O)[O-])s1 ZINC000609509155 566768416 /nfs/dbraw/zinc/76/84/16/566768416.db2.gz JDSHCRIYHDGOOD-JTQLQIEISA-N 0 0 396.266 3.428 20 5 GGBDRN Cc1cc(Br)ccc1CNC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000609505722 566768835 /nfs/dbraw/zinc/76/88/35/566768835.db2.gz HHBBDVYQQVXKNO-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN Cc1cc(Br)ccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000609542384 566769741 /nfs/dbraw/zinc/76/97/41/566769741.db2.gz CVKXSRVBXYXVRN-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@H](C)c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000469209089 566771992 /nfs/dbraw/zinc/77/19/92/566771992.db2.gz QHJWPGAUIDNJDY-SECBINFHSA-N 0 0 388.804 3.435 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000469246432 566774703 /nfs/dbraw/zinc/77/47/03/566774703.db2.gz QKPLDYYWYWWUHK-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Br ZINC000469235366 566775360 /nfs/dbraw/zinc/77/53/60/566775360.db2.gz JGGZHZSLCYSKNB-VIFPVBQESA-N 0 0 381.230 3.442 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(C(N)=O)cs1 ZINC000489250910 566776632 /nfs/dbraw/zinc/77/66/32/566776632.db2.gz JRQMKVSDWISLPE-UHFFFAOYSA-N 0 0 380.451 3.151 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1CCCc1nc2ccccc2[nH]1 ZINC000562291512 566778209 /nfs/dbraw/zinc/77/82/09/566778209.db2.gz KXNPMTPUTFTCCD-UHFFFAOYSA-N 0 0 377.198 3.028 20 5 GGBDRN COc1cc(S(=O)(=O)NCCCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000469291494 566778865 /nfs/dbraw/zinc/77/88/65/566778865.db2.gz QKYORTDFBSBFAJ-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN Cn1c(C(=O)NCC2(c3cccc(Br)c3)CC2)ccc1[N+](=O)[O-] ZINC000609646523 566779149 /nfs/dbraw/zinc/77/91/49/566779149.db2.gz SGMMCERMUKVBST-UHFFFAOYSA-N 0 0 378.226 3.157 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCSCc2ccccc2F)ccc1[N+](=O)[O-] ZINC000609673336 566780714 /nfs/dbraw/zinc/78/07/14/566780714.db2.gz ZIISSUBYHOUSBH-UHFFFAOYSA-N 0 0 384.454 3.254 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000609673290 566780759 /nfs/dbraw/zinc/78/07/59/566780759.db2.gz VCACUWJVBMWTKZ-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN COc1cc(C(=O)NC[C@@H]2CCCCS2)c([N+](=O)[O-])cc1OC(F)F ZINC000542199053 566780933 /nfs/dbraw/zinc/78/09/33/566780933.db2.gz GYEKKMHSITYHQL-VIFPVBQESA-N 0 0 376.381 3.220 20 5 GGBDRN NC(=O)c1ccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])c(F)c1 ZINC000542191327 566781006 /nfs/dbraw/zinc/78/10/06/566781006.db2.gz MCADLINOEXZWSG-UHFFFAOYSA-N 0 0 383.788 3.217 20 5 GGBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc(Br)c[nH]c1=O ZINC000542192291 566781634 /nfs/dbraw/zinc/78/16/34/566781634.db2.gz RGZOEEDRHGDTLS-UHFFFAOYSA-N 0 0 384.211 3.189 20 5 GGBDRN CC[C@@H](Cc1ccc(Cl)cc1)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000609704720 566781808 /nfs/dbraw/zinc/78/18/08/566781808.db2.gz BGYFCQNTYOKWRW-ZDUSSCGKSA-N 0 0 383.857 3.329 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1Br ZINC000469320980 566782067 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C[C@@H](O)C[C@@H](CNc1c(Br)cncc1[N+](=O)[O-])c1ccccc1 ZINC000516824149 566784400 /nfs/dbraw/zinc/78/44/00/566784400.db2.gz LICIGNLIGBTXMJ-YPMHNXCESA-N 0 0 380.242 3.141 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCCc1ccccc1Br ZINC000489380951 566785188 /nfs/dbraw/zinc/78/51/88/566785188.db2.gz UANLJFRSCGOJNJ-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](OCC(F)(F)F)C1 ZINC000609784305 566785271 /nfs/dbraw/zinc/78/52/71/566785271.db2.gz MVQCMIJXTKGGFY-GFCCVEGCSA-N 0 0 380.750 3.361 20 5 GGBDRN CO[C@@H]1CCN(Cc2cc(I)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000581517202 566785235 /nfs/dbraw/zinc/78/52/35/566785235.db2.gz SQQIFKCNDNXDLK-IINYFYTJSA-N 0 0 390.221 3.199 20 5 GGBDRN C[C@H](O)C[C@@H](CNc1c(Br)cncc1[N+](=O)[O-])c1ccccc1 ZINC000516824146 566785597 /nfs/dbraw/zinc/78/55/97/566785597.db2.gz LICIGNLIGBTXMJ-AAEUAGOBSA-N 0 0 380.242 3.141 20 5 GGBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCc1ncnn1CC(F)F ZINC000516846508 566786194 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GGBDRN Cc1sc(S(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1[N+](=O)[O-] ZINC000469392907 566787702 /nfs/dbraw/zinc/78/77/02/566787702.db2.gz IHMBRFQYVJTJNT-JTQLQIEISA-N 0 0 388.417 3.421 20 5 GGBDRN C[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1(F)F ZINC000427669244 566787857 /nfs/dbraw/zinc/78/78/57/566787857.db2.gz XHDPAMJXIKHBTI-SECBINFHSA-N 0 0 377.185 3.404 20 5 GGBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)ncc1Br ZINC000427684522 566788412 /nfs/dbraw/zinc/78/84/12/566788412.db2.gz GPTPHMCZYZVQEU-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN C[C@@H]1SCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000609825433 566788892 /nfs/dbraw/zinc/78/88/92/566788892.db2.gz XGBAEOXYKRJCII-SUMWQHHRSA-N 0 0 378.475 3.462 20 5 GGBDRN C[C@@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)N1CCc2sccc2C1 ZINC000609855631 566789923 /nfs/dbraw/zinc/78/99/23/566789923.db2.gz MYDPDQYOVQIBGH-NSHDSACASA-N 0 0 379.869 3.486 20 5 GGBDRN CN(Cc1ccc([S@@](C)=O)cc1)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000581570748 566790496 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CCCc1n[nH]c(C(=O)N(C)Cc2ccc(Br)c(F)c2)c1[N+](=O)[O-] ZINC000427806802 566800276 /nfs/dbraw/zinc/80/02/76/566800276.db2.gz RPNPHLMXHXDVJA-UHFFFAOYSA-N 0 0 399.220 3.444 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1cccs1 ZINC000610043127 566800373 /nfs/dbraw/zinc/80/03/73/566800373.db2.gz GKYMVWVMRJRUHB-LBPRGKRZSA-N 0 0 399.222 3.063 20 5 GGBDRN CN(C)C(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000610038335 566800381 /nfs/dbraw/zinc/80/03/81/566800381.db2.gz OULRMZFNUILFOU-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN O=C(Nc1ccc2nc[nH]c(=O)c2c1)c1ccc([N+](=O)[O-])cc1Br ZINC000610042882 566800456 /nfs/dbraw/zinc/80/04/56/566800456.db2.gz CPDAONUVDUZCBP-UHFFFAOYSA-N 0 0 389.165 3.258 20 5 GGBDRN CCOC(=O)CCN(CC1CC1)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000610042772 566800730 /nfs/dbraw/zinc/80/07/30/566800730.db2.gz RBFGCETXUKYOSR-UHFFFAOYSA-N 0 0 399.241 3.163 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H](n2ccnc2)C1 ZINC000610063974 566801845 /nfs/dbraw/zinc/80/18/45/566801845.db2.gz OXYVHAVAINGGLU-GFCCVEGCSA-N 0 0 379.214 3.031 20 5 GGBDRN CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)Cc2ccccc21 ZINC000610063849 566802185 /nfs/dbraw/zinc/80/21/85/566802185.db2.gz JGHPGDWFSGXEBQ-UHFFFAOYSA-N 0 0 390.237 3.450 20 5 GGBDRN O=C(NCCN1Cc2ccccc2C1)c1ccc([N+](=O)[O-])cc1Br ZINC000610062426 566802450 /nfs/dbraw/zinc/80/24/50/566802450.db2.gz RKLPWJDTUYEYRG-UHFFFAOYSA-N 0 0 390.237 3.103 20 5 GGBDRN Cn1cc([C@H]2N(C(=O)c3ccc(Br)cc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000517035689 566803037 /nfs/dbraw/zinc/80/30/37/566803037.db2.gz OTCZWGCJRKIBBR-CQSZACIVSA-N 0 0 393.241 3.314 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(-c3ccncc3)cc2)s1 ZINC000610086308 566805018 /nfs/dbraw/zinc/80/50/18/566805018.db2.gz PDJFPINMRFDEND-UHFFFAOYSA-N 0 0 375.431 3.197 20 5 GGBDRN NS(=O)(=O)c1c(NCc2nc3cc(Cl)ccc3s2)cccc1[N+](=O)[O-] ZINC000517096823 566805867 /nfs/dbraw/zinc/80/58/67/566805867.db2.gz NTBWAJKLDMFYAV-UHFFFAOYSA-N 0 0 398.853 3.117 20 5 GGBDRN Cc1c(Br)c(N2CCN(c3ccccc3O)CC2)ncc1[N+](=O)[O-] ZINC000542506598 566806792 /nfs/dbraw/zinc/80/67/92/566806792.db2.gz IZZWHZSZNDJMDQ-UHFFFAOYSA-N 0 0 393.241 3.093 20 5 GGBDRN Cc1c(Br)c(NCCCn2cnc3ccccc32)ncc1[N+](=O)[O-] ZINC000542507667 566806928 /nfs/dbraw/zinc/80/69/28/566806928.db2.gz SYEZQNMSQMETQD-UHFFFAOYSA-N 0 0 390.241 3.335 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCN(c3ncccc3F)C2)ncc1[N+](=O)[O-] ZINC000542506092 566807134 /nfs/dbraw/zinc/80/71/34/566807134.db2.gz IFCVOZWCEDNHSW-SNVBAGLBSA-N 0 0 396.220 3.286 20 5 GGBDRN Cc1c(Br)c(Nc2ccc3c(c2)N(C)C(=O)CO3)ncc1[N+](=O)[O-] ZINC000542506335 566807265 /nfs/dbraw/zinc/80/72/65/566807265.db2.gz OKNJSEHDLSMOIW-UHFFFAOYSA-N 0 0 393.197 3.160 20 5 GGBDRN Cn1ccnc1N1CCC(Nc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000427980613 566807466 /nfs/dbraw/zinc/80/74/66/566807466.db2.gz BQYAVXCHJJAHRS-UHFFFAOYSA-N 0 0 380.246 3.172 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(Br)cn2C)c(C)c([N+](=O)[O-])c1 ZINC000489761706 566808414 /nfs/dbraw/zinc/80/84/14/566808414.db2.gz KYPUUAMCKQKMPS-UHFFFAOYSA-N 0 0 396.197 3.043 20 5 GGBDRN Cc1c(Br)c(NCC(=O)N2CCc3ccccc32)ncc1[N+](=O)[O-] ZINC000542519531 566808829 /nfs/dbraw/zinc/80/88/29/566808829.db2.gz XMZPOGTWWUBFEA-UHFFFAOYSA-N 0 0 391.225 3.062 20 5 GGBDRN Cc1c(Br)c(NCc2ccc(-n3cccn3)cc2)ncc1[N+](=O)[O-] ZINC000542522601 566809103 /nfs/dbraw/zinc/80/91/03/566809103.db2.gz WTZNBLCZKHIKRG-UHFFFAOYSA-N 0 0 388.225 3.280 20 5 GGBDRN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000610158844 566812591 /nfs/dbraw/zinc/81/25/91/566812591.db2.gz QOVZWDXKXYZTII-UHFFFAOYSA-N 0 0 378.226 3.489 20 5 GGBDRN Cc1c(CC(=O)N2CCOc3ncc(Br)cc32)cccc1[N+](=O)[O-] ZINC000542567570 566812541 /nfs/dbraw/zinc/81/25/41/566812541.db2.gz DCGXSPCOOUPTTP-UHFFFAOYSA-N 0 0 392.209 3.029 20 5 GGBDRN CC(C)OC(=O)CSCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000610168857 566812660 /nfs/dbraw/zinc/81/26/60/566812660.db2.gz MSIZEHZXVDIYFQ-UHFFFAOYSA-N 0 0 380.344 3.237 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(Br)cc2O)cc([N+](=O)[O-])c1OC 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20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NC[C@@H]1CCCCC(F)(F)C1 ZINC000489994389 566821467 /nfs/dbraw/zinc/82/14/67/566821467.db2.gz KUJBRRORIFTSMJ-CYBMUJFWSA-N 0 0 376.425 3.272 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCc2ncc(C)s2)c([N+](=O)[O-])c1 ZINC000610281195 566821722 /nfs/dbraw/zinc/82/17/22/566821722.db2.gz SAKKEIHXNRQPDL-UHFFFAOYSA-N 0 0 384.483 3.002 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cn1C ZINC000562774356 566821974 /nfs/dbraw/zinc/82/19/74/566821974.db2.gz DWQLVJMWWMLIJZ-UHFFFAOYSA-N 0 0 396.197 3.043 20 5 GGBDRN C[C@@H](CCO)Sc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000610283099 566822410 /nfs/dbraw/zinc/82/24/10/566822410.db2.gz ZIXANTKYICMFDH-ZDUSSCGKSA-N 0 0 388.511 3.023 20 5 GGBDRN C[C@H]1CN(C(=O)c2sc(Br)cc2[N+](=O)[O-])CC2(CCC2)O1 ZINC000517375128 566822408 /nfs/dbraw/zinc/82/24/08/566822408.db2.gz RKVCOKCVOFIKHO-QMMMGPOBSA-N 0 0 375.244 3.202 20 5 GGBDRN COc1ccc(S(=O)(=O)NC[C@H]2CCCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000489999224 566823277 /nfs/dbraw/zinc/82/32/77/566823277.db2.gz LUMXTPOCMCDKHC-NSHDSACASA-N 0 0 378.397 3.097 20 5 GGBDRN COc1ccc(S(=O)(=O)NC[C@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC000490014729 566824635 /nfs/dbraw/zinc/82/46/35/566824635.db2.gz GTURXJXTLJDHCG-NSHDSACASA-N 0 0 378.397 3.097 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)CCC(C)C)cc1[N+](=O)[O-] ZINC000610338321 566825348 /nfs/dbraw/zinc/82/53/48/566825348.db2.gz XBMYIEZVERYNLX-UHFFFAOYSA-N 0 0 379.276 3.332 20 5 GGBDRN CN(CCN(C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000517410883 566825771 /nfs/dbraw/zinc/82/57/71/566825771.db2.gz NKFMKXRVUHNCTA-UHFFFAOYSA-N 0 0 383.857 3.005 20 5 GGBDRN Cc1cc(NC(=O)NCCCCn2cc(Br)cn2)ccc1[N+](=O)[O-] ZINC000469916956 566826346 /nfs/dbraw/zinc/82/63/46/566826346.db2.gz JUSLBXAZDHHZKD-UHFFFAOYSA-N 0 0 396.245 3.464 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(-c3ccc(Cl)s3)nn2C)c1[N+](=O)[O-] ZINC000428258168 566828203 /nfs/dbraw/zinc/82/82/03/566828203.db2.gz VWRZLIONLHEDTN-UHFFFAOYSA-N 0 0 380.817 3.248 20 5 GGBDRN Cc1nnc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000542801904 566828395 /nfs/dbraw/zinc/82/83/95/566828395.db2.gz CHMGMTIOTIEVJC-UHFFFAOYSA-N 0 0 392.384 3.182 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@H]1[C@@H]1CCCOC1 ZINC000582064960 566828545 /nfs/dbraw/zinc/82/85/45/566828545.db2.gz WCQNWDWZUDOKRW-ABAIWWIYSA-N 0 0 383.242 3.389 20 5 GGBDRN Cc1ccsc1CNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000517496558 566829017 /nfs/dbraw/zinc/82/90/17/566829017.db2.gz KOSMIEDWKCEVNV-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CC2(C1)CCCC2 ZINC000428288408 566830714 /nfs/dbraw/zinc/83/07/14/566830714.db2.gz RTAMEVHQDPKSBL-UHFFFAOYSA-N 0 0 386.189 3.216 20 5 GGBDRN CSc1cccc(F)c1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000517558146 566831287 /nfs/dbraw/zinc/83/12/87/566831287.db2.gz BJALEBTVECVHLQ-UHFFFAOYSA-N 0 0 384.454 3.019 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2nc(-c3ccccn3)no2)c(Br)c1 ZINC000610420628 566831453 /nfs/dbraw/zinc/83/14/53/566831453.db2.gz MDSBRKQNBKDVMO-UHFFFAOYSA-N 0 0 377.154 3.381 20 5 GGBDRN O=[N+]([O-])c1cnn(CCN2CCc3[nH]c4c(cccc4Br)c3C2)c1 ZINC000610447673 566831564 /nfs/dbraw/zinc/83/15/64/566831564.db2.gz NOVXYSXSOPIUOQ-UHFFFAOYSA-N 0 0 390.241 3.093 20 5 GGBDRN NC(=O)c1cc(NC(=O)COc2cccc([N+](=O)[O-])c2)c(Cl)cc1Cl ZINC000582110414 566831606 /nfs/dbraw/zinc/83/16/06/566831606.db2.gz IEXASCOVQHBBAS-UHFFFAOYSA-N 0 0 384.175 3.018 20 5 GGBDRN Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000517595393 566833985 /nfs/dbraw/zinc/83/39/85/566833985.db2.gz RWYXIEOXNZQPDK-UHFFFAOYSA-N 0 0 393.241 3.211 20 5 GGBDRN O=[N+]([O-])c1ccn(CCN2CCc3[nH]c4ccc(Br)cc4c3C2)n1 ZINC000610485084 566835033 /nfs/dbraw/zinc/83/50/33/566835033.db2.gz NYQRFHCEUULKBK-UHFFFAOYSA-N 0 0 390.241 3.093 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(CCO)Cc1cccc(Br)c1 ZINC000490230285 566836942 /nfs/dbraw/zinc/83/69/42/566836942.db2.gz LARVUYBEJKAHOY-UHFFFAOYSA-N 0 0 393.237 3.300 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)[C@@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000428397122 566837952 /nfs/dbraw/zinc/83/79/52/566837952.db2.gz GYYAFDBCGUJADT-GXSJLCMTSA-N 0 0 391.287 3.475 20 5 GGBDRN NS(=O)(=O)c1c(NC[C@@H]2CCCC[C@H]2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000610510571 566838184 /nfs/dbraw/zinc/83/81/84/566838184.db2.gz ADMIIRXZXLSCRD-VHSXEESVSA-N 0 0 381.376 3.023 20 5 GGBDRN CCOC(=O)CC(C)(C)N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000490243780 566838507 /nfs/dbraw/zinc/83/85/07/566838507.db2.gz LMNPGLUFCCBOBH-UHFFFAOYSA-N 0 0 387.230 3.161 20 5 GGBDRN Cc1c2cccc(Br)c2oc1C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000542927231 566839585 /nfs/dbraw/zinc/83/95/85/566839585.db2.gz JLZQONVKNSMJBK-UHFFFAOYSA-N 0 0 393.197 3.038 20 5 GGBDRN C[C@H](c1nc(Cn2cc(Br)cn2)no1)c1cccc([N+](=O)[O-])c1 ZINC000582207187 566840431 /nfs/dbraw/zinc/84/04/31/566840431.db2.gz OJHHFNFAMHVASQ-VIFPVBQESA-N 0 0 378.186 3.137 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC[C@H](n2ccnc2)C1 ZINC000610572266 566844147 /nfs/dbraw/zinc/84/41/47/566844147.db2.gz OPGGZSFMCCLVND-LBPRGKRZSA-N 0 0 379.214 3.031 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)s1 ZINC000610589261 566845376 /nfs/dbraw/zinc/84/53/76/566845376.db2.gz IHHVKDGCLBSYDC-OLQVQODUSA-N 0 0 398.306 3.018 20 5 GGBDRN COc1cccnc1NCc1cc(I)cc([N+](=O)[O-])c1 ZINC000582270701 566846170 /nfs/dbraw/zinc/84/61/70/566846170.db2.gz PLCNHEDQNGWKDG-UHFFFAOYSA-N 0 0 385.161 3.215 20 5 GGBDRN Cc1nc(C)n(CCCC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)n1 ZINC000451594294 566846567 /nfs/dbraw/zinc/84/65/67/566846567.db2.gz DKFRQRCZEASQGC-UHFFFAOYSA-N 0 0 396.245 3.293 20 5 GGBDRN COc1cc(C(C)=O)ccc1Sc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000543048320 566847318 /nfs/dbraw/zinc/84/73/18/566847318.db2.gz ZNCLBTZWTOVTGB-UHFFFAOYSA-N 0 0 387.460 3.422 20 5 GGBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N[C@H](CO)c1cccc(Br)c1 ZINC000470132156 566847954 /nfs/dbraw/zinc/84/79/54/566847954.db2.gz KCFGHNXRKPRIBQ-CQSZACIVSA-N 0 0 398.188 3.352 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](C)C(C)(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000582306660 566848882 /nfs/dbraw/zinc/84/88/82/566848882.db2.gz YCTVALRCBAKWRR-SECBINFHSA-N 0 0 386.246 3.155 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)CSc2ncccc2[N+](=O)[O-])cc1C ZINC000517807061 566849637 /nfs/dbraw/zinc/84/96/37/566849637.db2.gz YYJVMSIKXVUVAN-UHFFFAOYSA-N 0 0 381.435 3.267 20 5 GGBDRN Cc1cc(N2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c(Br)cc1[N+](=O)[O-] ZINC000517847256 566850370 /nfs/dbraw/zinc/85/03/70/566850370.db2.gz ZJNUWCFXENOPRF-HWWQOWPSSA-N 0 0 385.258 3.438 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CC[C@@H]2CCC[C@H]21 ZINC000428513057 566850648 /nfs/dbraw/zinc/85/06/48/566850648.db2.gz CXWAIJJOJWWCHV-TVQRCGJNSA-N 0 0 386.189 3.214 20 5 GGBDRN CCN(C[C@H](O)C(F)(F)F)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000428514120 566850869 /nfs/dbraw/zinc/85/08/69/566850869.db2.gz VLKPPRTWIMEQLZ-NSHDSACASA-N 0 0 386.779 3.112 20 5 GGBDRN C[C@@H](Cc1ccccc1Br)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000470159480 566851025 /nfs/dbraw/zinc/85/10/25/566851025.db2.gz YMQOYERPSZWLEE-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCC[C@@H]2c2ccccc2Br)c1[N+](=O)[O-] ZINC000610672355 566852191 /nfs/dbraw/zinc/85/21/91/566852191.db2.gz FHFMDPOYIMRXBT-GFCCVEGCSA-N 0 0 379.214 3.366 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1Sc1cc(-n2ccnc2)ncn1 ZINC000610661817 566852689 /nfs/dbraw/zinc/85/26/89/566852689.db2.gz PCPSNLUOUJYZTK-UHFFFAOYSA-N 0 0 378.211 3.484 20 5 GGBDRN C[C@H](COc1cccc(F)c1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000517914017 566853795 /nfs/dbraw/zinc/85/37/95/566853795.db2.gz AKNGYPRLKRFYJS-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN CN(CCCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000517912332 566853942 /nfs/dbraw/zinc/85/39/42/566853942.db2.gz AIAVVQAKBNYFKF-UHFFFAOYSA-N 0 0 383.857 3.053 20 5 GGBDRN CCCN(Cc1ccccc1Br)C(=O)c1ccnc(N)c1[N+](=O)[O-] ZINC000582369068 566854080 /nfs/dbraw/zinc/85/40/80/566854080.db2.gz ZXMALHOIFYFSMC-UHFFFAOYSA-N 0 0 393.241 3.217 20 5 GGBDRN C[C@@H](COc1cccc(F)c1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000517914016 566854473 /nfs/dbraw/zinc/85/44/73/566854473.db2.gz AKNGYPRLKRFYJS-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN Nc1c(C(=O)N2CCc3c(F)cc(Br)cc3C2)cccc1[N+](=O)[O-] ZINC000610727859 566855723 /nfs/dbraw/zinc/85/57/23/566855723.db2.gz BOHIRAWFLXGJPT-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000543145636 566856133 /nfs/dbraw/zinc/85/61/33/566856133.db2.gz WOHPYZOPHXTTPC-UHFFFAOYSA-N 0 0 380.223 3.485 20 5 GGBDRN COC[C@@H](CSc1ncc([N+](=O)[O-])c(N)n1)c1ccc(Br)cc1 ZINC000517965805 566856423 /nfs/dbraw/zinc/85/64/23/566856423.db2.gz QVYNFLCKBFUENG-JTQLQIEISA-N 0 0 399.270 3.082 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCc2ccc(F)cc2Br)c1[N+](=O)[O-] ZINC000428544205 566856988 /nfs/dbraw/zinc/85/69/88/566856988.db2.gz GYCYRRAZDZALHL-UHFFFAOYSA-N 0 0 385.193 3.273 20 5 GGBDRN CO[C@@H](C)c1nc(Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)cs1 ZINC000543147848 566857176 /nfs/dbraw/zinc/85/71/76/566857176.db2.gz YAIVNHRBFYPQNQ-QMMMGPOBSA-N 0 0 388.243 3.040 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000543148071 566857360 /nfs/dbraw/zinc/85/73/60/566857360.db2.gz FWGSZWFBHRKCIU-UHFFFAOYSA-N 0 0 389.152 3.477 20 5 GGBDRN CO[C@H](C)c1nc(Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)cs1 ZINC000543147841 566857373 /nfs/dbraw/zinc/85/73/73/566857373.db2.gz YAIVNHRBFYPQNQ-MRVPVSSYSA-N 0 0 388.243 3.040 20 5 GGBDRN Cc1nc(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c(Br)s1 ZINC000563154582 566860710 /nfs/dbraw/zinc/86/07/10/566860710.db2.gz KBOGLULNYNUNOS-UHFFFAOYSA-N 0 0 382.239 3.321 20 5 GGBDRN O=C(c1ccc(F)c(Br)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470292906 566861095 /nfs/dbraw/zinc/86/10/95/566861095.db2.gz LNPIIKFSBBKJFF-UHFFFAOYSA-N 0 0 395.184 3.400 20 5 GGBDRN O=C(c1ccc(Br)cc1F)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470280236 566862237 /nfs/dbraw/zinc/86/22/37/566862237.db2.gz XQCJIMNHKBSODM-UHFFFAOYSA-N 0 0 395.184 3.400 20 5 GGBDRN NC(=O)c1cc(Br)ccc1OCc1c(F)cc([N+](=O)[O-])cc1F ZINC000582438011 566862325 /nfs/dbraw/zinc/86/23/25/566862325.db2.gz QRVMXYBXAOQKJP-UHFFFAOYSA-N 0 0 387.136 3.313 20 5 GGBDRN CN(Cc1nccs1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000470267746 566862416 /nfs/dbraw/zinc/86/24/16/566862416.db2.gz SYSZGSKGLMWWNU-UHFFFAOYSA-N 0 0 375.328 3.265 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1Br ZINC000518048915 566863921 /nfs/dbraw/zinc/86/39/21/566863921.db2.gz ZDZTUJCEFGWDNZ-UHFFFAOYSA-N 0 0 396.245 3.046 20 5 GGBDRN O=C(NCc1ccc(Br)cc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000518053034 566863958 /nfs/dbraw/zinc/86/39/58/566863958.db2.gz LXDJUUIFQQGSRT-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C)c1ccccc1Cl ZINC000610786621 566864188 /nfs/dbraw/zinc/86/41/88/566864188.db2.gz SQWSKXSRWDHAFB-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C)c1ccccc1Cl ZINC000610786622 566864192 /nfs/dbraw/zinc/86/41/92/566864192.db2.gz SQWSKXSRWDHAFB-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NC[C@H](CO)Cc2ccc(Br)cc2)n1 ZINC000428658417 566864390 /nfs/dbraw/zinc/86/43/90/566864390.db2.gz DNMBYIIRCYWNSW-CYBMUJFWSA-N 0 0 380.242 3.324 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NC[C@@H](CO)Cc2cccc(Br)c2)n1 ZINC000428655831 566864526 /nfs/dbraw/zinc/86/45/26/566864526.db2.gz FQSZITXFVGBRRA-ZDUSSCGKSA-N 0 0 380.242 3.324 20 5 GGBDRN NC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000518066017 566865369 /nfs/dbraw/zinc/86/53/69/566865369.db2.gz ULJCKOINPIKEPS-GXTWGEPZSA-N 0 0 376.210 3.424 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCc1cn2ccsc2n1 ZINC000543256231 566867161 /nfs/dbraw/zinc/86/71/61/566867161.db2.gz CWMYCDMRDGWRQT-UHFFFAOYSA-N 0 0 382.854 3.366 20 5 GGBDRN Nc1c(F)c(NC[C@@H](CO)Cc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000428672001 566868055 /nfs/dbraw/zinc/86/80/55/566868055.db2.gz PTYLVCUJRJTQDD-NSHDSACASA-N 0 0 398.232 3.342 20 5 GGBDRN O=[N+]([O-])c1cnc(NC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)c(Br)c1 ZINC000428676660 566868092 /nfs/dbraw/zinc/86/80/92/566868092.db2.gz ZHAMNHCRKVKDED-XJKSGUPXSA-N 0 0 396.216 3.470 20 5 GGBDRN Cc1cnc(NC[C@H](CO)Cc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000428688065 566869147 /nfs/dbraw/zinc/86/91/47/566869147.db2.gz FWSWMYHJRJGWJT-CYBMUJFWSA-N 0 0 380.242 3.324 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000490600307 566869101 /nfs/dbraw/zinc/86/91/01/566869101.db2.gz HLDOBWNEZROBFD-NSHDSACASA-N 0 0 382.825 3.220 20 5 GGBDRN Nc1c(F)c(NC[C@@H](CO)Cc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000428679543 566869638 /nfs/dbraw/zinc/86/96/38/566869638.db2.gz IXGLLZBJBPENEZ-JTQLQIEISA-N 0 0 398.232 3.342 20 5 GGBDRN CN(CCOC(C)(C)C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000610858938 566869950 /nfs/dbraw/zinc/86/99/50/566869950.db2.gz PLXADFHNHXQKDT-UHFFFAOYSA-N 0 0 385.269 3.337 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(c2c(Cl)cccc2Cl)CCC1 ZINC000470421233 566870222 /nfs/dbraw/zinc/87/02/22/566870222.db2.gz YRVRCUCAAHAASL-UHFFFAOYSA-N 0 0 383.235 3.336 20 5 GGBDRN Cc1sc(C(N)=O)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000610887066 566871994 /nfs/dbraw/zinc/87/19/94/566871994.db2.gz NSFPSTOGQDZHRV-UHFFFAOYSA-N 0 0 398.238 3.007 20 5 GGBDRN Cc1sc(C(N)=O)cc1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610887141 566872154 /nfs/dbraw/zinc/87/21/54/566872154.db2.gz SMNYVWMEOKWMNW-UHFFFAOYSA-N 0 0 384.211 3.078 20 5 GGBDRN Cc1sc(C(N)=O)cc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610887041 566872469 /nfs/dbraw/zinc/87/24/69/566872469.db2.gz LPOZQLFBULNGDT-ZETCQYMHSA-N 0 0 383.813 3.123 20 5 GGBDRN O=C(NCCc1ccc2c(c1)OCO2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000610900013 566872663 /nfs/dbraw/zinc/87/26/63/566872663.db2.gz OTXYXPYBSVXDLA-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@](F)(c3cc(F)cc(F)c3)C2)s1 ZINC000563321874 566874822 /nfs/dbraw/zinc/87/48/22/566874822.db2.gz QGRXEAIHQTUPEY-AWEZNQCLSA-N 0 0 392.380 3.194 20 5 GGBDRN Cc1cc(I)cc(NC(=O)c2cccc([N+](=O)[O-])c2N)c1 ZINC000563314737 566875003 /nfs/dbraw/zinc/87/50/03/566875003.db2.gz LIMYXCOQTMFJEV-UHFFFAOYSA-N 0 0 397.172 3.342 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(Cc2cccs2)C(C)C)cc1[N+](=O)[O-] ZINC000490727615 566877864 /nfs/dbraw/zinc/87/78/64/566877864.db2.gz BSQCKPFBWFFQLW-UHFFFAOYSA-N 0 0 388.442 3.403 20 5 GGBDRN CC1(C)CCC[C@@H]1CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000490747121 566878254 /nfs/dbraw/zinc/87/82/54/566878254.db2.gz RBPAZDQLUVHZKH-SNVBAGLBSA-N 0 0 398.257 3.238 20 5 GGBDRN NC(=O)c1ccc(CN2CCc3sc(Br)cc3C2)c([N+](=O)[O-])c1 ZINC000610990127 566878772 /nfs/dbraw/zinc/87/87/72/566878772.db2.gz KWKMCDAFTQGNQH-UHFFFAOYSA-N 0 0 396.266 3.076 20 5 GGBDRN Cc1c(Br)c(N[C@H](CO)c2c(F)cccc2F)ncc1[N+](=O)[O-] ZINC000543436101 566880308 /nfs/dbraw/zinc/88/03/08/566880308.db2.gz GIHJHWSUHUNBBW-SNVBAGLBSA-N 0 0 388.168 3.484 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCOC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000490847954 566882159 /nfs/dbraw/zinc/88/21/59/566882159.db2.gz KQGZJHTWBZRWJB-APHBMKBZSA-N 0 0 385.258 3.114 20 5 GGBDRN Cc1csc(N2CCN(c3ncc([N+](=O)[O-])c(C)c3Br)CC2)n1 ZINC000543437082 566882288 /nfs/dbraw/zinc/88/22/88/566882288.db2.gz DUPMHDQHZICRGC-UHFFFAOYSA-N 0 0 398.286 3.152 20 5 GGBDRN Cc1c(Br)c(NC[C@@H](C[C@@H](C)O)c2ccccc2)ncc1[N+](=O)[O-] ZINC000543436452 566883031 /nfs/dbraw/zinc/88/30/31/566883031.db2.gz ITYZXMJMNQCWBF-BXUZGUMPSA-N 0 0 394.269 3.449 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCOC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000490847955 566883192 /nfs/dbraw/zinc/88/31/92/566883192.db2.gz KQGZJHTWBZRWJB-DAXOMENPSA-N 0 0 385.258 3.114 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(O)c(Br)c2)c1 ZINC000563463478 566885426 /nfs/dbraw/zinc/88/54/26/566885426.db2.gz LQVAGFGUVMJEBB-UHFFFAOYSA-N 0 0 395.209 3.392 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cccc(F)c1Br ZINC000490952724 566885445 /nfs/dbraw/zinc/88/54/45/566885445.db2.gz ADZNPOOYZMAQAY-UHFFFAOYSA-N 0 0 379.145 3.047 20 5 GGBDRN COc1cc(Cl)ccc1S(=O)(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000611082571 566887206 /nfs/dbraw/zinc/88/72/06/566887206.db2.gz KFKDEGPJYYAYCJ-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCC2(F)F)c(Br)c1 ZINC000451821165 566887385 /nfs/dbraw/zinc/88/73/85/566887385.db2.gz GDVKKDDYAHVKIG-MRVPVSSYSA-N 0 0 399.213 3.071 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCO[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000611073283 566887524 /nfs/dbraw/zinc/88/75/24/566887524.db2.gz YHBWUJHKCCRAEQ-NSHDSACASA-N 0 0 397.147 3.069 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCCC2(F)F)c(Br)c1 ZINC000451821166 566887557 /nfs/dbraw/zinc/88/75/57/566887557.db2.gz GDVKKDDYAHVKIG-QMMMGPOBSA-N 0 0 399.213 3.071 20 5 GGBDRN CN(Cc1cccs1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000563480630 566887966 /nfs/dbraw/zinc/88/79/66/566887966.db2.gz HXEPZOCRCBBCQO-UHFFFAOYSA-N 0 0 376.825 3.492 20 5 GGBDRN COC(=O)C[C@@H]1CCCCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000611073072 566888255 /nfs/dbraw/zinc/88/82/55/566888255.db2.gz ZKBSPFJHGMVMER-LBPRGKRZSA-N 0 0 399.241 3.224 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCOCc2ccccc21 ZINC000470620246 566889088 /nfs/dbraw/zinc/88/90/88/566889088.db2.gz PFJIAPVUGLAHQS-UHFFFAOYSA-N 0 0 391.221 3.463 20 5 GGBDRN COc1cc(Cl)c(NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000582747168 566891064 /nfs/dbraw/zinc/89/10/64/566891064.db2.gz HDTUSLFQFNOSMO-UHFFFAOYSA-N 0 0 386.813 3.375 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)NC[C@@H]2CCCC2(F)F)c1 ZINC000451830884 566891279 /nfs/dbraw/zinc/89/12/79/566891279.db2.gz YUINMGVSSNTLFH-QMMMGPOBSA-N 0 0 399.213 3.071 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)COc2cc(F)cc(Br)c2)c1 ZINC000611113111 566891448 /nfs/dbraw/zinc/89/14/48/566891448.db2.gz MEFYJXXHOASWST-ZDUSSCGKSA-N 0 0 386.173 3.315 20 5 GGBDRN O=C(CN1CCN(c2ccc([N+](=O)[O-])s2)CC1)Nc1ccc(Cl)cc1 ZINC000611116572 566891721 /nfs/dbraw/zinc/89/17/21/566891721.db2.gz COBOSNAJNICYBG-UHFFFAOYSA-N 0 0 380.857 3.070 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2CCCN(S(=O)(=O)CCc3cccs3)C2)cc1 ZINC000451838902 566892281 /nfs/dbraw/zinc/89/22/81/566892281.db2.gz DBRBWZPRUIHSAQ-OAHLLOKOSA-N 0 0 380.491 3.408 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2CCCN(S(=O)(=O)CCc3cccs3)C2)cc1 ZINC000451838900 566892334 /nfs/dbraw/zinc/89/23/34/566892334.db2.gz DBRBWZPRUIHSAQ-HNNXBMFYSA-N 0 0 380.491 3.408 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C)O[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000470688493 566894565 /nfs/dbraw/zinc/89/45/65/566894565.db2.gz GKVUOFFXQPXPKM-RFAUZJTJSA-N 0 0 383.242 3.305 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2CCCN(S(=O)(=O)c3cncc(Cl)c3)C2)cc1 ZINC000451852096 566895321 /nfs/dbraw/zinc/89/53/21/566895321.db2.gz NIDSTILIZQBCQG-ZDUSSCGKSA-N 0 0 381.841 3.212 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N[C@H]1CCC[C@H]1CCO ZINC000491121107 566895209 /nfs/dbraw/zinc/89/52/09/566895209.db2.gz FVOUGHLUTNEVHS-GWCFXTLKSA-N 0 0 380.242 3.290 20 5 GGBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)[C@H]1Cc2cc(Br)ccc2O1 ZINC000470698413 566895981 /nfs/dbraw/zinc/89/59/81/566895981.db2.gz FAYUQVFKIJLNOJ-CQSZACIVSA-N 0 0 381.157 3.439 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)NC[C@H]2COc3ccccc32)cc1[N+](=O)[O-] ZINC000582807969 566896253 /nfs/dbraw/zinc/89/62/53/566896253.db2.gz FAATZKPEJNZMDQ-NSHDSACASA-N 0 0 382.825 3.011 20 5 GGBDRN CN(C)c1ncc(Br)cc1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470702782 566897636 /nfs/dbraw/zinc/89/76/36/566897636.db2.gz FWCCEGSPKTWSCD-UHFFFAOYSA-N 0 0 383.177 3.210 20 5 GGBDRN Cc1n[nH]c(C(=O)N(C)C[C@H](C)Oc2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000470733666 566898533 /nfs/dbraw/zinc/89/85/33/566898533.db2.gz SYQMNAVDSBIENL-QMMMGPOBSA-N 0 0 387.223 3.473 20 5 GGBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000611184516 566898728 /nfs/dbraw/zinc/89/87/28/566898728.db2.gz QUSZVOGGHVGYFV-GFCCVEGCSA-N 0 0 384.845 3.114 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCOCC23CCCC3)cc1[N+](=O)[O-] ZINC000611194453 566899213 /nfs/dbraw/zinc/89/92/13/566899213.db2.gz KQSSWMQRUKLIGV-UHFFFAOYSA-N 0 0 383.242 3.451 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000518705431 566899215 /nfs/dbraw/zinc/89/92/15/566899215.db2.gz ZZDCWQBTRSWBRG-NXEZZACHSA-N 0 0 377.260 3.024 20 5 GGBDRN CS[C@@H](CO)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611213515 566899925 /nfs/dbraw/zinc/89/99/25/566899925.db2.gz YHDISLGAGUELOF-BZNIZROVSA-N 0 0 384.523 3.472 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C(F)(F)F)O[C@@H](C)C1 ZINC000611210811 566900736 /nfs/dbraw/zinc/90/07/36/566900736.db2.gz HAQILUNUBPPYCX-TVQRCGJNSA-N 0 0 378.372 3.499 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@H](C(F)(F)F)C1 ZINC000611210810 566900991 /nfs/dbraw/zinc/90/09/91/566900991.db2.gz HAQILUNUBPPYCX-RNCFNFMXSA-N 0 0 378.372 3.499 20 5 GGBDRN O=C(N[C@H]1CCC(F)(F)C1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000611223280 566901749 /nfs/dbraw/zinc/90/17/49/566901749.db2.gz LITGMRPXOFICRV-VIFPVBQESA-N 0 0 396.131 3.117 20 5 GGBDRN C[S@@](=O)c1ccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000611223555 566901794 /nfs/dbraw/zinc/90/17/94/566901794.db2.gz ZBVDRUJLYGZJSA-SSOJOUAXSA-N 0 0 376.459 3.220 20 5 GGBDRN Cc1cccc(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)c1O ZINC000611224045 566901961 /nfs/dbraw/zinc/90/19/61/566901961.db2.gz CALHXGKLGITRDW-UHFFFAOYSA-N 0 0 398.156 3.466 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1nc2ccccc2s1 ZINC000470775811 566903282 /nfs/dbraw/zinc/90/32/82/566903282.db2.gz ZZSWJRKMAWTNQW-UHFFFAOYSA-N 0 0 397.865 3.379 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)Cc1ccc(Br)cc1)CC2 ZINC000470765214 566903753 /nfs/dbraw/zinc/90/37/53/566903753.db2.gz KTSYBKAYUHLRCO-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000518800118 566904217 /nfs/dbraw/zinc/90/42/17/566904217.db2.gz IIQFMSKAXGVAED-UHFFFAOYSA-N 0 0 395.746 3.487 20 5 GGBDRN CC1(C)CCc2ncn(Cc3ccc(Br)cc3[N+](=O)[O-])c(=O)c2C1 ZINC000582904578 566905009 /nfs/dbraw/zinc/90/50/09/566905009.db2.gz AKLAHQGUBWSFIC-UHFFFAOYSA-N 0 0 392.253 3.477 20 5 GGBDRN CS(=O)(=O)C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000611273946 566905670 /nfs/dbraw/zinc/90/56/70/566905670.db2.gz HHKQYVDXPRKOPY-UHFFFAOYSA-N 0 0 380.491 3.332 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000491470780 566906284 /nfs/dbraw/zinc/90/62/84/566906284.db2.gz UIZWOXAYHMHVDB-YGRLFVJLSA-N 0 0 380.447 3.167 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000491470779 566906301 /nfs/dbraw/zinc/90/63/01/566906301.db2.gz UIZWOXAYHMHVDB-QMTHXVAHSA-N 0 0 380.447 3.167 20 5 GGBDRN O=C(Nc1cc(Br)c[nH]c1=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000518839387 566906452 /nfs/dbraw/zinc/90/64/52/566906452.db2.gz KQLHKQJOGSPRGJ-UHFFFAOYSA-N 0 0 377.154 3.192 20 5 GGBDRN COc1ccc(C2(NS(=O)(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 ZINC000518842144 566906611 /nfs/dbraw/zinc/90/66/11/566906611.db2.gz INOCTAWUGLRAAX-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000563680110 566907236 /nfs/dbraw/zinc/90/72/36/566907236.db2.gz NGTIDPHXTAMDIL-YGRLFVJLSA-N 0 0 398.257 3.381 20 5 GGBDRN CCS[C@@H]1CCC[C@@H](NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491533801 566907262 /nfs/dbraw/zinc/90/72/62/566907262.db2.gz SQWRDRKPBNOLIY-GHMZBOCLSA-N 0 0 392.474 3.085 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2noc(-c3cccs3)n2)c(Br)c1 ZINC000582941322 566907294 /nfs/dbraw/zinc/90/72/94/566907294.db2.gz VLTJKNFQJNJKBM-UHFFFAOYSA-N 0 0 382.199 3.476 20 5 GGBDRN Cn1ncc2ccc(CNC(=O)c3sc(Br)cc3[N+](=O)[O-])cc21 ZINC000518853726 566908361 /nfs/dbraw/zinc/90/83/61/566908361.db2.gz RINPDRZYIJWJNC-UHFFFAOYSA-N 0 0 395.238 3.236 20 5 GGBDRN CCS[C@H]1CCC[C@H](NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491533803 566908414 /nfs/dbraw/zinc/90/84/14/566908414.db2.gz SQWRDRKPBNOLIY-QWRGUYRKSA-N 0 0 392.474 3.085 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CC(c3cccc(Cl)c3)C2)cc1 ZINC000451926154 566909813 /nfs/dbraw/zinc/90/98/13/566909813.db2.gz HKMXLGXUJAQXFS-UHFFFAOYSA-N 0 0 380.853 3.220 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC(c2cccc(Cl)c2)C1 ZINC000451926212 566910066 /nfs/dbraw/zinc/91/00/66/566910066.db2.gz HZCVCKBGHSQJJV-UHFFFAOYSA-N 0 0 382.825 3.045 20 5 GGBDRN CC(C)(C)OC(=O)CCCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000611343190 566912605 /nfs/dbraw/zinc/91/26/05/566912605.db2.gz WKJWGOATZMMRRB-UHFFFAOYSA-N 0 0 392.861 3.039 20 5 GGBDRN COC(=O)c1cnc(N(C)Cc2ccc(Br)c(F)c2)c([N+](=O)[O-])c1 ZINC000491663854 566912983 /nfs/dbraw/zinc/91/29/83/566912983.db2.gz KEFYDAFLWGVTBC-UHFFFAOYSA-N 0 0 398.188 3.314 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H](C[C@H]3CCOC3)C2)c(Cl)c1 ZINC000611343575 566913080 /nfs/dbraw/zinc/91/30/80/566913080.db2.gz QLRLPNDEEAAYRF-CHWSQXEVSA-N 0 0 388.873 3.076 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H](C[C@H]3CCOC3)C2)c(Cl)c1 ZINC000611343577 566913282 /nfs/dbraw/zinc/91/32/82/566913282.db2.gz QLRLPNDEEAAYRF-QWHCGFSZSA-N 0 0 388.873 3.076 20 5 GGBDRN O=C(c1ccc(F)cc1Br)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470882821 566913558 /nfs/dbraw/zinc/91/35/58/566913558.db2.gz FVQFIFNCLPXWGV-UHFFFAOYSA-N 0 0 395.184 3.400 20 5 GGBDRN COc1cccc([C@@H]2C[C@H]2NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000451957791 566914124 /nfs/dbraw/zinc/91/41/24/566914124.db2.gz GGHQWJQAVQMAMS-DZGCQCFKSA-N 0 0 382.825 3.091 20 5 GGBDRN O=[N+]([O-])c1cc(CS(=O)(=O)c2ccc(Cl)s2)c2c(c1)COCO2 ZINC000611383723 566914906 /nfs/dbraw/zinc/91/49/06/566914906.db2.gz PQKIHVGASPBYTI-UHFFFAOYSA-N 0 0 375.811 3.150 20 5 GGBDRN CN(C(=O)COCC(F)(F)F)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000611400734 566915033 /nfs/dbraw/zinc/91/50/33/566915033.db2.gz ATPYZDLYSXJVCQ-UHFFFAOYSA-N 0 0 375.328 3.260 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H]2CCc3cc(F)c(F)c(F)c32)cc1[N+](=O)[O-] ZINC000451960781 566915486 /nfs/dbraw/zinc/91/54/86/566915486.db2.gz FLGSNRBCPDEYIV-SECBINFHSA-N 0 0 392.380 3.348 20 5 GGBDRN O=C(CN1CCN(c2sccc2[N+](=O)[O-])CC1)Nc1ccc(Cl)cc1 ZINC000611414743 566916172 /nfs/dbraw/zinc/91/61/72/566916172.db2.gz TXHVNYGOLDCKKD-UHFFFAOYSA-N 0 0 380.857 3.070 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCc2ccc(CO)cc2)cc1[N+](=O)[O-] ZINC000611428533 566916552 /nfs/dbraw/zinc/91/65/52/566916552.db2.gz TUDKVJQHAPKAJJ-UHFFFAOYSA-N 0 0 393.237 3.131 20 5 GGBDRN CC[C@@H](C)N1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000451967041 566916908 /nfs/dbraw/zinc/91/69/08/566916908.db2.gz GKQNTKWSNGJLFV-SNVBAGLBSA-N 0 0 396.296 3.006 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NCCCc1nnc2n1CCCC2 ZINC000491835596 566917427 /nfs/dbraw/zinc/91/74/27/566917427.db2.gz QDMYECVMCRAPDW-UHFFFAOYSA-N 0 0 380.246 3.330 20 5 GGBDRN O=C(Nc1ccncc1Br)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000543854264 566918074 /nfs/dbraw/zinc/91/80/74/566918074.db2.gz WPSHYLRCIGLUIT-UHFFFAOYSA-N 0 0 388.124 3.028 20 5 GGBDRN NC(=O)CCSc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000519085837 566919669 /nfs/dbraw/zinc/91/96/69/566919669.db2.gz BFBBPMUTGJFYFI-UHFFFAOYSA-N 0 0 379.825 3.468 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCc1nc2cc(Cl)ccc2s1 ZINC000543902986 566921144 /nfs/dbraw/zinc/92/11/44/566921144.db2.gz MGEGZCKUYNFUIR-UHFFFAOYSA-N 0 0 398.853 3.117 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCCc1cccc(Cl)c1Cl ZINC000543903166 566922085 /nfs/dbraw/zinc/92/20/85/566922085.db2.gz AOOKNQGCEYLBAJ-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN Cc1ccncc1NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000519137661 566922122 /nfs/dbraw/zinc/92/21/22/566922122.db2.gz HYXDUNKSVJJPSB-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN O=[N+]([O-])c1ccc(CN[C@@H](CO)c2ccc(Br)c(F)c2)c(F)c1 ZINC000492059265 566922440 /nfs/dbraw/zinc/92/24/40/566922440.db2.gz GSIQHBNMTQEXTA-HNNXBMFYSA-N 0 0 387.180 3.459 20 5 GGBDRN Cc1ccccc1OCCCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000519149385 566923407 /nfs/dbraw/zinc/92/34/07/566923407.db2.gz MUDAERZYUIIVEX-UHFFFAOYSA-N 0 0 384.841 3.304 20 5 GGBDRN O=[N+]([O-])c1cccc(OCCOc2ccc(Br)cc2CCO)c1 ZINC000429324673 566923994 /nfs/dbraw/zinc/92/39/94/566923994.db2.gz 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COc1cc(CN(C)c2ncc([N+](=O)[O-])c(C)c2Br)ccc1O ZINC000544393316 566959737 /nfs/dbraw/zinc/95/97/37/566959737.db2.gz HLHBAAKKOLVVMT-UHFFFAOYSA-N 0 0 382.214 3.411 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@@H](C(F)(F)F)C1 ZINC000612295748 566963715 /nfs/dbraw/zinc/96/37/15/566963715.db2.gz PNUPMMAMBJBGQK-LLVKDONJSA-N 0 0 384.763 3.130 20 5 GGBDRN Cn1c(C(=O)N2CCc3c(Br)ccc(F)c3C2)ccc1[N+](=O)[O-] ZINC000544464575 566964843 /nfs/dbraw/zinc/96/48/43/566964843.db2.gz UNRAEUWMCSPMJT-UHFFFAOYSA-N 0 0 382.189 3.033 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCC(F)(F)C2)c(Br)c1 ZINC000429907744 566966070 /nfs/dbraw/zinc/96/60/70/566966070.db2.gz CTYBHTRPPJVBJI-MRVPVSSYSA-N 0 0 399.213 3.071 20 5 GGBDRN CCOc1ccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1Br ZINC000494013733 566966774 /nfs/dbraw/zinc/96/67/74/566966774.db2.gz AKVYXCVAZYWSTO-UHFFFAOYSA-N 0 0 397.229 3.326 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000564358512 566966845 /nfs/dbraw/zinc/96/68/45/566966845.db2.gz SCHWULYYQNZUPH-SNVBAGLBSA-N 0 0 388.854 3.284 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CC[C@H](c3nc(C4CC4)no3)C2)c(Br)c1 ZINC000519773575 566967005 /nfs/dbraw/zinc/96/70/05/566967005.db2.gz UIKNLXHCMWSQSD-VIFPVBQESA-N 0 0 380.202 3.007 20 5 GGBDRN CN(C)C(=O)c1cccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000429926702 566967640 /nfs/dbraw/zinc/96/76/40/566967640.db2.gz QRMKXSKQVTUPON-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN COc1ccccc1CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429939887 566968912 /nfs/dbraw/zinc/96/89/12/566968912.db2.gz WRKOJSNYDBRMQZ-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000471666697 566969456 /nfs/dbraw/zinc/96/94/56/566969456.db2.gz XOMWKWXHAHZHRV-GFCCVEGCSA-N 0 0 382.825 3.214 20 5 GGBDRN CCC(CC)C(=O)N1CCN(c2ncc([N+](=O)[O-])c(C)c2Br)CC1 ZINC000612438142 566972355 /nfs/dbraw/zinc/97/23/55/566972355.db2.gz ZQWXNMJYWZCCDA-UHFFFAOYSA-N 0 0 399.289 3.146 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCC(F)(F)C2)c(C(F)(F)F)c1 ZINC000429981754 566972335 /nfs/dbraw/zinc/97/23/35/566972335.db2.gz ZVSMZZLUXFPYKG-QMMMGPOBSA-N 0 0 388.314 3.327 20 5 GGBDRN Cc1nc([C@@H]2CCCCN2c2ncc([N+](=O)[O-])c(C)c2Br)no1 ZINC000612438640 566972478 /nfs/dbraw/zinc/97/24/78/566972478.db2.gz UBGYFKYBHWGIOQ-JTQLQIEISA-N 0 0 382.218 3.484 20 5 GGBDRN Cc1c(Br)c(N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000612446341 566973861 /nfs/dbraw/zinc/97/38/61/566973861.db2.gz HKQPFIPKEPAJJQ-HZGVNTEJSA-N 0 0 384.152 3.217 20 5 GGBDRN Cc1cc(Br)cn2cc(CCNc3cccnc3[N+](=O)[O-])nc12 ZINC000612453417 566973961 /nfs/dbraw/zinc/97/39/61/566973961.db2.gz HFELOTIEFILWFM-UHFFFAOYSA-N 0 0 376.214 3.363 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1C[C@H]1c1ccccc1Br ZINC000430005064 566974283 /nfs/dbraw/zinc/97/42/83/566974283.db2.gz KRIJHXXBXOYARY-WCQYABFASA-N 0 0 397.250 3.192 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCN(C3CCCCC3)C2=O)ncc1[N+](=O)[O-] ZINC000612449749 566974378 /nfs/dbraw/zinc/97/43/78/566974378.db2.gz NEERDJWLESHSDL-LBPRGKRZSA-N 0 0 397.273 3.406 20 5 GGBDRN O=C(NC1(c2ccc(Br)cc2)CCCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000564430141 566974346 /nfs/dbraw/zinc/97/43/46/566974346.db2.gz RLBWLANXJRFVFD-UHFFFAOYSA-N 0 0 379.214 3.280 20 5 GGBDRN Cc1c(Br)c(N(C)CC(=O)N(C)C2CCCCC2)ncc1[N+](=O)[O-] ZINC000612444150 566974731 /nfs/dbraw/zinc/97/47/31/566974731.db2.gz FEMBDBDMWYMCBT-UHFFFAOYSA-N 0 0 399.289 3.288 20 5 GGBDRN Cc1c(Br)c(N(Cc2ccccc2)C[C@@H](C)O)ncc1[N+](=O)[O-] ZINC000612451977 566975098 /nfs/dbraw/zinc/97/50/98/566975098.db2.gz VHXAGBDNGMPSFV-LLVKDONJSA-N 0 0 380.242 3.448 20 5 GGBDRN Cc1ccc2nc(CNc3ncc([N+](=O)[O-])c(C)c3Br)cn2c1 ZINC000564435072 566976360 /nfs/dbraw/zinc/97/63/60/566976360.db2.gz BSRJXSUYOVXPPN-UHFFFAOYSA-N 0 0 376.214 3.051 20 5 GGBDRN CN(Cc1c(Cl)cccc1Cl)c1cccc([N+](=O)[O-])c1S(N)(=O)=O ZINC000519887885 566977098 /nfs/dbraw/zinc/97/70/98/566977098.db2.gz YVBGROQUTIDNFM-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000430034058 566977865 /nfs/dbraw/zinc/97/78/65/566977865.db2.gz SSDRLKRUOLJNRE-LBPRGKRZSA-N 0 0 384.483 3.097 20 5 GGBDRN O=c1[nH]ccc(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1Br ZINC000583745463 566979753 /nfs/dbraw/zinc/97/97/53/566979753.db2.gz VMWXPJVBSPYGKQ-UHFFFAOYSA-N 0 0 377.154 3.099 20 5 GGBDRN Cc1nc(CSCc2cc(I)cc([N+](=O)[O-])c2)no1 ZINC000583745822 566980212 /nfs/dbraw/zinc/98/02/12/566980212.db2.gz RUIYVBUMZZQQRF-UHFFFAOYSA-N 0 0 391.190 3.324 20 5 GGBDRN NS(=O)(=O)c1cccc(NCc2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000544679486 566980473 /nfs/dbraw/zinc/98/04/73/566980473.db2.gz IATQTBOGVPDTHQ-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000583767162 566981835 /nfs/dbraw/zinc/98/18/35/566981835.db2.gz RCAPNUFZCNGJMB-LERXQTSPSA-N 0 0 383.242 3.209 20 5 GGBDRN CN(Cc1ccncc1)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000564536101 566983131 /nfs/dbraw/zinc/98/31/31/566983131.db2.gz BLJOCNJRJABCJS-UHFFFAOYSA-N 0 0 383.189 3.226 20 5 GGBDRN CNS(=O)(=O)c1ccc(NCc2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000520152538 566985861 /nfs/dbraw/zinc/98/58/61/566985861.db2.gz KFGSERKNKBWQCG-UHFFFAOYSA-N 0 0 390.248 3.422 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCCOc2ccc(F)cc2)c(Cl)c1 ZINC000520154414 566985937 /nfs/dbraw/zinc/98/59/37/566985937.db2.gz XHXZJTPAIGVPCP-UHFFFAOYSA-N 0 0 388.804 3.135 20 5 GGBDRN CO[C@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000544720406 566986482 /nfs/dbraw/zinc/98/64/82/566986482.db2.gz OVLNEMVWEPGUBU-MRXNPFEDSA-N 0 0 384.841 3.055 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000544720403 566986548 /nfs/dbraw/zinc/98/65/48/566986548.db2.gz OVLNEMVWEPGUBU-INIZCTEOSA-N 0 0 384.841 3.055 20 5 GGBDRN Cc1sc2nc(C)nc(Sc3nccc(C(N)=O)c3[N+](=O)[O-])c2c1C ZINC000564557475 566986590 /nfs/dbraw/zinc/98/65/90/566986590.db2.gz FVLGHRBCQYRCAU-UHFFFAOYSA-N 0 0 375.435 3.170 20 5 GGBDRN CC[C@@H](C)NC(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612661119 566986694 /nfs/dbraw/zinc/98/66/94/566986694.db2.gz KUHXSWGYIGWTCN-SECBINFHSA-N 0 0 382.214 3.199 20 5 GGBDRN CC(C)[C@@H](C)NC(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612661131 566986776 /nfs/dbraw/zinc/98/67/76/566986776.db2.gz LPSHXZNFNNTUGK-SNVBAGLBSA-N 0 0 396.241 3.445 20 5 GGBDRN CC[C@H](C)NC(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612661120 566987629 /nfs/dbraw/zinc/98/76/29/566987629.db2.gz KUHXSWGYIGWTCN-VIFPVBQESA-N 0 0 382.214 3.199 20 5 GGBDRN O=C(COc1c2cc(Br)ccc2ncc1[N+](=O)[O-])c1ccc[nH]1 ZINC000612660938 566987755 /nfs/dbraw/zinc/98/77/55/566987755.db2.gz GBFJWHFVZZRIMM-UHFFFAOYSA-N 0 0 376.166 3.495 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)CCCC(F)(F)F)cc1[N+](=O)[O-] ZINC000494325484 566988212 /nfs/dbraw/zinc/98/82/12/566988212.db2.gz COGMGUHBYWROTK-QMMMGPOBSA-N 0 0 388.339 3.142 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000494325135 566988551 /nfs/dbraw/zinc/98/85/51/566988551.db2.gz CTXHXDNQZYOAQB-QMMMGPOBSA-N 0 0 385.294 3.418 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CN=c2[nH]c3ccccc3o2)c1 ZINC000564580802 566989216 /nfs/dbraw/zinc/98/92/16/566989216.db2.gz AANWNUUSSUQMRB-UHFFFAOYSA-N 0 0 395.156 3.375 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000612679764 566989559 /nfs/dbraw/zinc/98/95/59/566989559.db2.gz VSHUPZPLOVVFFZ-INIZCTEOSA-N 0 0 384.841 3.055 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000520227774 566989654 /nfs/dbraw/zinc/98/96/54/566989654.db2.gz RFNUJYQGIYGORA-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cn1cc(Br)c(COc2ccc([N+](=O)[O-])cc2Br)n1 ZINC000564587750 566991053 /nfs/dbraw/zinc/99/10/53/566991053.db2.gz FLABKKMMQBMBOW-UHFFFAOYSA-N 0 0 391.019 3.432 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCc2c(Cl)cccc2Cl)cccc1[N+](=O)[O-] ZINC000520231218 566991239 /nfs/dbraw/zinc/99/12/39/566991239.db2.gz HYSQBFVQYDKYBM-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cn1nc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c2ccccc21 ZINC000612713302 566991392 /nfs/dbraw/zinc/99/13/92/566991392.db2.gz XJNKDESCWJQFJD-UHFFFAOYSA-N 0 0 389.209 3.174 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1ccccc1Br ZINC000520270841 566993795 /nfs/dbraw/zinc/99/37/95/566993795.db2.gz GMKSXRPHQQBLOI-UHFFFAOYSA-N 0 0 394.225 3.236 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c(Cl)cc1F ZINC000520282084 566994233 /nfs/dbraw/zinc/99/42/33/566994233.db2.gz PRLDAXNYIRGVQC-UHFFFAOYSA-N 0 0 386.788 3.352 20 5 GGBDRN CC[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000564626060 566994739 /nfs/dbraw/zinc/99/47/39/566994739.db2.gz BPKNUHXATBDJFF-GFCCVEGCSA-N 0 0 387.230 3.207 20 5 GGBDRN O=C(NCc1cccc(Br)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000520307419 566995425 /nfs/dbraw/zinc/99/54/25/566995425.db2.gz DVOAUPRADWWHAG-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CC2(C1)CCCCC2 ZINC000612799542 566996783 /nfs/dbraw/zinc/99/67/83/566996783.db2.gz HRTRZBAFEGDJCO-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN C[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)c1ccc(Br)cc1F ZINC000564682643 566998319 /nfs/dbraw/zinc/99/83/19/566998319.db2.gz ZINLUIMYJJOVDW-MRVPVSSYSA-N 0 0 380.177 3.134 20 5 GGBDRN COc1c(C(=O)N[C@H](c2nc(C)cs2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000452625420 567000198 /nfs/dbraw/zinc/00/01/98/567000198.db2.gz ZCGVFMXDADEGQT-LLVKDONJSA-N 0 0 375.328 3.402 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000452630051 567000260 /nfs/dbraw/zinc/00/02/60/567000260.db2.gz ZUMSHFUWWNNKDP-UHFFFAOYSA-N 0 0 399.241 3.079 20 5 GGBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCSC[C@@H]1c1nccs1 ZINC000472088859 567000349 /nfs/dbraw/zinc/00/03/49/567000349.db2.gz CKOZATWCMZPCAF-GFCCVEGCSA-N 0 0 381.504 3.460 20 5 GGBDRN COc1ccc(Br)c(CN(C)C(=O)c2c(N)cccc2[N+](=O)[O-])c1 ZINC000430201498 567000459 /nfs/dbraw/zinc/00/04/59/567000459.db2.gz KAKCRWDOYMUQLM-UHFFFAOYSA-N 0 0 394.225 3.220 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000544842351 567000739 /nfs/dbraw/zinc/00/07/39/567000739.db2.gz DAPYVGBLFUSFPD-ZBEGNZNMSA-N 0 0 384.841 3.303 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NC2(c3cccc(Br)c3)CC2)c1 ZINC000544840978 567000897 /nfs/dbraw/zinc/00/08/97/567000897.db2.gz BQHKRMCLZTWYPH-UHFFFAOYSA-N 0 0 397.250 3.325 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(-c2nc(COCC(F)(F)F)no2)c1 ZINC000612874410 567001220 /nfs/dbraw/zinc/00/12/20/567001220.db2.gz OTRNSLBCMSIZPF-UHFFFAOYSA-N 0 0 382.092 3.486 20 5 GGBDRN CCNc1ccc(C(=O)Nc2nnc(CC(F)(F)F)s2)cc1[N+](=O)[O-] ZINC000430240939 567002455 /nfs/dbraw/zinc/00/24/55/567002455.db2.gz PUJUCQJEXICTGT-UHFFFAOYSA-N 0 0 375.332 3.235 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000452662512 567002579 /nfs/dbraw/zinc/00/25/79/567002579.db2.gz NPXVVAJRLONGHL-BPLDGKMQSA-N 0 0 383.242 3.123 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NC[C@@H]2CCCSC2)c([N+](=O)[O-])c1 ZINC000584015596 567003284 /nfs/dbraw/zinc/00/32/84/567003284.db2.gz NPIXMLZKYQVKGW-ZDUSSCGKSA-N 0 0 387.527 3.180 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000452677854 567004183 /nfs/dbraw/zinc/00/41/83/567004183.db2.gz IRXSYUPJLYEQQW-RBSFLKMASA-N 0 0 383.242 3.123 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000452677856 567004207 /nfs/dbraw/zinc/00/42/07/567004207.db2.gz IRXSYUPJLYEQQW-ZNMIVQPWSA-N 0 0 383.242 3.123 20 5 GGBDRN Cn1cc(/C=C\c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)cn1 ZINC000612956159 567004733 /nfs/dbraw/zinc/00/47/33/567004733.db2.gz HZCAQNPSVUMOND-DJWKRKHSSA-N 0 0 390.197 3.235 20 5 GGBDRN CCC(CC)CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430299225 567005803 /nfs/dbraw/zinc/00/58/03/567005803.db2.gz DVBJBTAUOVIVGH-UHFFFAOYSA-N 0 0 386.246 3.157 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1OCc1nc(CC(F)(F)F)no1 ZINC000520469474 567006606 /nfs/dbraw/zinc/00/66/06/567006606.db2.gz PNZRBWXODMUQLR-UHFFFAOYSA-N 0 0 382.092 3.424 20 5 GGBDRN COc1ccc(Br)cc1[C@H]1CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000584041121 567006816 /nfs/dbraw/zinc/00/68/16/567006816.db2.gz VOFABEBHLJRWOZ-GFCCVEGCSA-N 0 0 395.213 3.066 20 5 GGBDRN CC[C@@H]1C[C@H](C)CN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430320696 567008031 /nfs/dbraw/zinc/00/80/31/567008031.db2.gz KQQFMGCZTJSJFY-JOYOIKCWSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](C)C2CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430317349 567008313 /nfs/dbraw/zinc/00/83/13/567008313.db2.gz IEIUCAVKPXWVLP-JTQLQIEISA-N 0 0 398.257 3.299 20 5 GGBDRN CC[C@]1(C)CCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)C1 ZINC000430317842 567008370 /nfs/dbraw/zinc/00/83/70/567008370.db2.gz JNLATHRSZNEAHH-MRXNPFEDSA-N 0 0 398.257 3.253 20 5 GGBDRN CC[C@@H]1[C@@H](C)CCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430318955 567008423 /nfs/dbraw/zinc/00/84/23/567008423.db2.gz LPRXEBPEWYBQIG-TVQRCGJNSA-N 0 0 398.257 3.251 20 5 GGBDRN O=C(NC[C@H]1CCOC2(CCC2)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000452728029 567008729 /nfs/dbraw/zinc/00/87/29/567008729.db2.gz FBFZIJYVJIPSBE-NSHDSACASA-N 0 0 383.242 3.436 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2(C(C)C)CC2)cc(Br)cc1[N+](=O)[O-] ZINC000430314819 567008707 /nfs/dbraw/zinc/00/87/07/567008707.db2.gz CADIYMPSDWXSMP-UHFFFAOYSA-N 0 0 398.257 3.157 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1c[nH]c2ncc(Br)cc12 ZINC000472206727 567009770 /nfs/dbraw/zinc/00/97/70/567009770.db2.gz QFUYCCOLXGICBG-UHFFFAOYSA-N 0 0 389.209 3.206 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCN(C3CC3)c3ccccc32)cc1[N+](=O)[O-] ZINC000494584866 567009904 /nfs/dbraw/zinc/00/99/04/567009904.db2.gz IEIAGVDRSBDKGT-UHFFFAOYSA-N 0 0 379.463 3.142 20 5 GGBDRN CCCN(CCC)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430334987 567009985 /nfs/dbraw/zinc/00/99/85/567009985.db2.gz VZCWIFKUYNGTMX-UHFFFAOYSA-N 0 0 386.246 3.253 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCC[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430330450 567010059 /nfs/dbraw/zinc/01/00/59/567010059.db2.gz JCVFZBUOSVKRTA-CABZTGNLSA-N 0 0 398.257 3.299 20 5 GGBDRN Cn1c(Cn2cc(Br)c([N+](=O)[O-])n2)nnc1-c1ccc(Cl)cc1 ZINC000472209366 567010044 /nfs/dbraw/zinc/01/00/44/567010044.db2.gz POQGYAOIICPNTG-UHFFFAOYSA-N 0 0 397.620 3.051 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@@H](C)[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430329118 567010165 /nfs/dbraw/zinc/01/01/65/567010165.db2.gz PIVGQWXTCGEGMD-ZJUUUORDSA-N 0 0 398.257 3.109 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCC(C)(C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430328185 567010181 /nfs/dbraw/zinc/01/01/81/567010181.db2.gz NJJRQGPEGLYUNX-UHFFFAOYSA-N 0 0 398.257 3.253 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@H](C)C[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430332978 567010271 /nfs/dbraw/zinc/01/02/71/567010271.db2.gz PTGQJDDHIMBRCW-NXEZZACHSA-N 0 0 398.257 3.109 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCC[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430353724 567011353 /nfs/dbraw/zinc/01/13/53/567011353.db2.gz OHPPWUXCDABAGQ-JTQLQIEISA-N 0 0 398.257 3.253 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[S@](=O)CC1 ZINC000430339173 567011432 /nfs/dbraw/zinc/01/14/32/567011432.db2.gz COKCLPDLDJCIST-YMXBGEKHSA-N 0 0 384.523 3.470 20 5 GGBDRN CC[C@H]1CC[C@H](C)N1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430344375 567011470 /nfs/dbraw/zinc/01/14/70/567011470.db2.gz OJQZZWFQBMUHTI-CABZTGNLSA-N 0 0 398.257 3.394 20 5 GGBDRN CC[C@@H]1CC[C@@H](C)N1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430344373 567011541 /nfs/dbraw/zinc/01/15/41/567011541.db2.gz OJQZZWFQBMUHTI-BXKDBHETSA-N 0 0 398.257 3.394 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@@H](C)[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430338382 567011578 /nfs/dbraw/zinc/01/15/78/567011578.db2.gz HQFRQFJGXNGBNU-KOLCDFICSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1ccccc1OCCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000520558202 567011723 /nfs/dbraw/zinc/01/17/23/567011723.db2.gz QABNCDAXAJJTFC-UHFFFAOYSA-N 0 0 384.841 3.304 20 5 GGBDRN CC[C@@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])Cc1cccc(Br)c1 ZINC000520614758 567013410 /nfs/dbraw/zinc/01/34/10/567013410.db2.gz KJBCSYMXWYOTTB-SNVBAGLBSA-N 0 0 381.230 3.079 20 5 GGBDRN Cc1c(Br)ccc(O)c1NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000452760883 567015091 /nfs/dbraw/zinc/01/50/91/567015091.db2.gz WTIZZXQYPHFOOK-UHFFFAOYSA-N 0 0 383.202 3.470 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000494655316 567015116 /nfs/dbraw/zinc/01/51/16/567015116.db2.gz QBMCMALNNPUAON-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=c1[nH]cc(Br)cc1Cc1noc(-c2cc(F)cc([N+](=O)[O-])c2)n1 ZINC000545040742 567015553 /nfs/dbraw/zinc/01/55/53/567015553.db2.gz WVMPPUHPYWVHDU-UHFFFAOYSA-N 0 0 395.144 3.238 20 5 GGBDRN Cc1cc(OCC(=O)NCc2csc(Br)c2)ccc1[N+](=O)[O-] ZINC000430416720 567016398 /nfs/dbraw/zinc/01/63/98/567016398.db2.gz RZSRZEQHUUCFAB-UHFFFAOYSA-N 0 0 385.239 3.422 20 5 GGBDRN Cc1cc(OCC(=O)N(C)c2ccc(Br)cn2)ccc1[N+](=O)[O-] ZINC000430416233 567016492 /nfs/dbraw/zinc/01/64/92/567016492.db2.gz REFLZJXFLRMBTN-UHFFFAOYSA-N 0 0 380.198 3.103 20 5 GGBDRN Cc1cccnc1CCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000452785633 567016607 /nfs/dbraw/zinc/01/66/07/567016607.db2.gz ROESRVHUZFWHJK-UHFFFAOYSA-N 0 0 378.226 3.423 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2OC)cc1Br ZINC000494681807 567016679 /nfs/dbraw/zinc/01/66/79/567016679.db2.gz MNFOZSDCNNRODD-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=c1[nH]cc(Br)cc1Cc1noc(Cc2cccc([N+](=O)[O-])c2)n1 ZINC000545056050 567017077 /nfs/dbraw/zinc/01/70/77/567017077.db2.gz SODNREHHNLUYAG-UHFFFAOYSA-N 0 0 391.181 3.023 20 5 GGBDRN COC(=O)c1c(C)c(NC(=O)c2cc([N+](=O)[O-])cn2C)ccc1Br ZINC000564887835 567017272 /nfs/dbraw/zinc/01/72/72/567017272.db2.gz QOLGXCYHIWKJAS-UHFFFAOYSA-N 0 0 396.197 3.043 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1 ZINC000494680073 567017426 /nfs/dbraw/zinc/01/74/26/567017426.db2.gz HIQHRXVXTHJYGN-VWLOTQADSA-N 0 0 382.825 3.388 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC(C)=C[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430488128 567017697 /nfs/dbraw/zinc/01/76/97/567017697.db2.gz ZBFKMOGOSLIUKZ-SECBINFHSA-N 0 0 396.241 3.029 20 5 GGBDRN CC(C)(C(=O)Nc1ccncc1Br)c1ccc([N+](=O)[O-])cc1F ZINC000545113469 567020547 /nfs/dbraw/zinc/02/05/47/567020547.db2.gz WKKRFOOAOXJQSD-UHFFFAOYSA-N 0 0 382.189 3.230 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCCOc1ccccc1 ZINC000584185690 567020662 /nfs/dbraw/zinc/02/06/62/567020662.db2.gz XAOYAPHELPPNRD-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN Cc1ccsc1-c1nnc(SCc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000520725686 567020951 /nfs/dbraw/zinc/02/09/51/567020951.db2.gz UMTDZXNIFVOJIG-UHFFFAOYSA-N 0 0 376.419 3.406 20 5 GGBDRN CCO[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC000452829296 567021042 /nfs/dbraw/zinc/02/10/42/567021042.db2.gz MWYUNCDDYJUDIT-XHDPSFHLSA-N 0 0 385.258 3.173 20 5 GGBDRN CCO[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC000452829292 567021238 /nfs/dbraw/zinc/02/12/38/567021238.db2.gz MWYUNCDDYJUDIT-IAQYHMDHSA-N 0 0 385.258 3.173 20 5 GGBDRN CCO[C@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC000452829290 567021349 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CCC(CC)(CC(=O)OC)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430592937 567023353 /nfs/dbraw/zinc/02/33/53/567023353.db2.gz NYPXWAUUBLAWJK-UHFFFAOYSA-N 0 0 387.230 3.209 20 5 GGBDRN COc1cc(Cl)ccc1CNS(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000520778019 567023456 /nfs/dbraw/zinc/02/34/56/567023456.db2.gz SWRHQOTXCHOMDZ-UHFFFAOYSA-N 0 0 384.841 3.352 20 5 GGBDRN COc1cccc(OC)c1Sc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000472432780 567024573 /nfs/dbraw/zinc/02/45/73/567024573.db2.gz RBEYPWYUIGZOOB-UHFFFAOYSA-N 0 0 375.449 3.228 20 5 GGBDRN COC[C@@H](Cc1ccccc1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430596202 567024879 /nfs/dbraw/zinc/02/48/79/567024879.db2.gz IZPKBRXFMRFEPB-CQSZACIVSA-N 0 0 393.237 3.345 20 5 GGBDRN CCO[C@H]1CCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000452851981 567025153 /nfs/dbraw/zinc/02/51/53/567025153.db2.gz HTVRUIQGCHHGDL-WPRPVWTQSA-N 0 0 377.260 3.306 20 5 GGBDRN COC[C@H](Cc1ccccc1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430596201 567025705 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CCn1c(C)nc([N+](=O)[O-])c1Sc1nc2sc(C)c(C)c2c(=O)n1C ZINC000521936681 567087822 /nfs/dbraw/zinc/08/78/22/567087822.db2.gz YJQGCMHNYWTQLT-UHFFFAOYSA-N 0 0 379.467 3.196 20 5 GGBDRN CCCCNC(=O)Cc1noc(-c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000565671354 567088028 /nfs/dbraw/zinc/08/80/28/567088028.db2.gz QXUIQSFUOVJODC-UHFFFAOYSA-N 0 0 397.229 3.175 20 5 GGBDRN CCOc1ccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1C ZINC000545929403 567090591 /nfs/dbraw/zinc/09/05/91/567090591.db2.gz KFZZLRFOUKNJGA-UHFFFAOYSA-N 0 0 384.841 3.434 20 5 GGBDRN O=C(Nc1c(F)cccc1Br)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000497350226 567091465 /nfs/dbraw/zinc/09/14/65/567091465.db2.gz NMJHEMFAUKXQPA-UHFFFAOYSA-N 0 0 383.129 3.477 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCCc1cccc(O)c1 ZINC000521984643 567091632 /nfs/dbraw/zinc/09/16/32/567091632.db2.gz BPAISIPMUWKOSW-UHFFFAOYSA-N 0 0 379.210 3.344 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(Cc2c(F)cccc2Br)CC1 ZINC000453581900 567092123 /nfs/dbraw/zinc/09/21/23/567092123.db2.gz VNBOXFILKKEPPT-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN Cc1cc(Br)c(CN2CCN(c3ncccc3[N+](=O)[O-])CC2)s1 ZINC000453578789 567092687 /nfs/dbraw/zinc/09/26/87/567092687.db2.gz RBTWHIPTHQFWPO-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(Cc2ccccc2Br)CC1 ZINC000453578098 567092998 /nfs/dbraw/zinc/09/29/98/567092998.db2.gz PYZKWTGLABMOLB-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN CC1(C)CCCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000497395876 567093140 /nfs/dbraw/zinc/09/31/40/567093140.db2.gz QBZQAQWLTFLDRJ-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN CC(C)OC(=O)CC[C@H](C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000473626712 567093320 /nfs/dbraw/zinc/09/33/20/567093320.db2.gz PWRRBMQZEZVMPW-JTQLQIEISA-N 0 0 387.230 3.207 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCC2(CCC2)CC1 ZINC000586774361 567094715 /nfs/dbraw/zinc/09/47/15/567094715.db2.gz QNPLYSNKSJTYSF-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN CC(C)[C@H]1N(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000431607845 567096350 /nfs/dbraw/zinc/09/63/50/567096350.db2.gz WUGHIRQZOXDKFI-CYBMUJFWSA-N 0 0 391.287 3.412 20 5 GGBDRN COC(=O)[C@@H]1CCCCCN1C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000586805830 567097391 /nfs/dbraw/zinc/09/73/91/567097391.db2.gz HUAVBBKCNGGFAP-AWEZNQCLSA-N 0 0 399.241 3.224 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)c1ncc([N+](=O)[O-])cc1Br ZINC000473722157 567098051 /nfs/dbraw/zinc/09/80/51/567098051.db2.gz LSZUBNUKYDTWPM-CQSZACIVSA-N 0 0 380.242 3.446 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1cc(N(C)C)ccn1 ZINC000586806846 567098192 /nfs/dbraw/zinc/09/81/92/567098192.db2.gz OJGHCDKYXLHMEQ-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)c1ncc([N+](=O)[O-])cc1Br ZINC000473722155 567098343 /nfs/dbraw/zinc/09/83/43/567098343.db2.gz LSZUBNUKYDTWPM-AWEZNQCLSA-N 0 0 380.242 3.446 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000522080755 567098375 /nfs/dbraw/zinc/09/83/75/567098375.db2.gz GJCNALZFGXPVBY-JKSUJKDBSA-N 0 0 391.221 3.408 20 5 GGBDRN COc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1Br ZINC000522126274 567100600 /nfs/dbraw/zinc/10/06/00/567100600.db2.gz FFMWRXJUJKJZMU-UHFFFAOYSA-N 0 0 395.165 3.347 20 5 GGBDRN CN(CCOc1cccc(Cl)c1)c1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497521370 567102806 /nfs/dbraw/zinc/10/28/06/567102806.db2.gz FIUJXQJQZNDVFQ-UHFFFAOYSA-N 0 0 384.841 3.167 20 5 GGBDRN CN(CCOc1ccccc1Cl)c1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497522706 567105227 /nfs/dbraw/zinc/10/52/27/567105227.db2.gz KVNBXJMSNJBYCB-UHFFFAOYSA-N 0 0 384.841 3.167 20 5 GGBDRN Cc1nc(C)n(C[C@H]2CN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CCO2)n1 ZINC000587957554 567106074 /nfs/dbraw/zinc/10/60/74/567106074.db2.gz LVTNFUOTLHEDMY-GFCCVEGCSA-N 0 0 386.239 3.015 20 5 GGBDRN Nc1c(C(=O)N2CCc3c(Br)cccc3C2)cc(F)cc1[N+](=O)[O-] ZINC000522211046 567106818 /nfs/dbraw/zinc/10/68/18/567106818.db2.gz UJEAZRGQFVSYAB-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN CO[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000497541200 567106798 /nfs/dbraw/zinc/10/67/98/567106798.db2.gz CYVSEFMWTSLQDL-CQSZACIVSA-N 0 0 384.841 3.451 20 5 GGBDRN COCCOc1ccc(CNc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000522233535 567107369 /nfs/dbraw/zinc/10/73/69/567107369.db2.gz XDSADUFZFHLRKY-UHFFFAOYSA-N 0 0 382.214 3.390 20 5 GGBDRN COC(=O)C[C@H](NC(=O)c1cccc(SC)c1[N+](=O)[O-])c1cccs1 ZINC000614395239 567108698 /nfs/dbraw/zinc/10/86/98/567108698.db2.gz AHINIVXJBRAPNO-NSHDSACASA-N 0 0 380.447 3.412 20 5 GGBDRN CC(C)S(=O)(=O)c1c(Cl)cccc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000565899971 567109355 /nfs/dbraw/zinc/10/93/55/567109355.db2.gz DXFJEAQWUAKTCX-UHFFFAOYSA-N 0 0 385.829 3.021 20 5 GGBDRN NS(=O)(=O)c1cc(NCCCCc2ccc(Cl)s2)cc([N+](=O)[O-])c1 ZINC000588045415 567111224 /nfs/dbraw/zinc/11/12/24/567111224.db2.gz ARWQIWWDXMBKNK-UHFFFAOYSA-N 0 0 389.886 3.392 20 5 GGBDRN C[C@H](Oc1ccc([N+](=O)[O-])c(CO)c1)C(=O)Nc1ccccc1Br ZINC000431885141 567113747 /nfs/dbraw/zinc/11/37/47/567113747.db2.gz XLGRHSPIMDYKDT-JTQLQIEISA-N 0 0 395.209 3.256 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c(Cl)c1 ZINC000522360675 567114192 /nfs/dbraw/zinc/11/41/92/567114192.db2.gz LYGIYGMDFLFPHX-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN CN(C[C@H]1CCCCO1)c1ccc(I)cc1[N+](=O)[O-] ZINC000497637011 567114627 /nfs/dbraw/zinc/11/46/27/567114627.db2.gz JGCILHAATBBQPM-LLVKDONJSA-N 0 0 376.194 3.205 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O ZINC000473914230 567114603 /nfs/dbraw/zinc/11/46/03/567114603.db2.gz HVOFNDPNHIGQIC-LLVKDONJSA-N 0 0 384.223 3.243 20 5 GGBDRN CC(C)(C)c1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)s1 ZINC000497635643 567114767 /nfs/dbraw/zinc/11/47/67/567114767.db2.gz BJJPRFFNDCMTEM-UHFFFAOYSA-N 0 0 382.467 3.081 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C1CC1)C(F)(F)F ZINC000565976081 567116474 /nfs/dbraw/zinc/11/64/74/567116474.db2.gz PGBOJMLBEMASCN-ZDUSSCGKSA-N 0 0 378.372 3.404 20 5 GGBDRN CN1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000431918321 567116674 /nfs/dbraw/zinc/11/66/74/567116674.db2.gz GZIVINHOQHCNKS-UHFFFAOYSA-N 0 0 390.237 3.450 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)sc1Cl ZINC000473936913 567117353 /nfs/dbraw/zinc/11/73/53/567117353.db2.gz KXGGAEIQKXGEMX-UHFFFAOYSA-N 0 0 388.854 3.070 20 5 GGBDRN Cc1nn(CCC(=O)N(C)Cc2cccc(Br)c2)c(C)c1[N+](=O)[O-] ZINC000522472108 567118273 /nfs/dbraw/zinc/11/82/73/567118273.db2.gz AAQQKEBZXFUARS-UHFFFAOYSA-N 0 0 395.257 3.219 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000522555267 567119870 /nfs/dbraw/zinc/11/98/70/567119870.db2.gz UPZPUYMZAVIPSO-JOYOIKCWSA-N 0 0 388.779 3.361 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H](OCC3CC3)C2)cc1[N+](=O)[O-] ZINC000614558183 567120957 /nfs/dbraw/zinc/12/09/57/567120957.db2.gz COOUFRZEPCEUEQ-ZDUSSCGKSA-N 0 0 388.873 3.136 20 5 GGBDRN CCS[C@@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)C1 ZINC000497741079 567121608 /nfs/dbraw/zinc/12/16/08/567121608.db2.gz YPRUSBHQLODNLD-GXTWGEPZSA-N 0 0 384.523 3.473 20 5 GGBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2SCCO)C1 ZINC000497732668 567121621 /nfs/dbraw/zinc/12/16/21/567121621.db2.gz NYIVTBPKTQQXSC-GXTWGEPZSA-N 0 0 384.523 3.425 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CC[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000614573502 567123010 /nfs/dbraw/zinc/12/30/10/567123010.db2.gz VKYBPIGMOBJFAZ-GWCFXTLKSA-N 0 0 389.271 3.229 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCSC[C@@H]1c1nccs1 ZINC000474003787 567124509 /nfs/dbraw/zinc/12/45/09/567124509.db2.gz YISOPMPWEWDDOV-CQSZACIVSA-N 0 0 378.479 3.094 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000474015316 567125520 /nfs/dbraw/zinc/12/55/20/567125520.db2.gz VKQPJLPOIAOEBV-SNVBAGLBSA-N 0 0 379.214 3.313 20 5 GGBDRN C[C@H](c1nc(Cn2cc(Br)cn2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000546449032 567129138 /nfs/dbraw/zinc/12/91/38/567129138.db2.gz ZULZHJIIQFUDQQ-QMMMGPOBSA-N 0 0 396.176 3.276 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(COc3ccccc3Br)n2)nc1 ZINC000546486469 567131344 /nfs/dbraw/zinc/13/13/44/567131344.db2.gz OHHLRKOAKFOFNV-UHFFFAOYSA-N 0 0 391.181 3.305 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000522800558 567131898 /nfs/dbraw/zinc/13/18/98/567131898.db2.gz CVJBTCQHINDIOI-XHDPSFHLSA-N 0 0 390.889 3.368 20 5 GGBDRN Cc1c(F)cccc1S(=O)(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497933267 567132496 /nfs/dbraw/zinc/13/24/96/567132496.db2.gz GMSRIUYCGSXEIV-MRXNPFEDSA-N 0 0 382.438 3.479 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NCc1cccc(N2CCOCC2)c1 ZINC000432147192 567133899 /nfs/dbraw/zinc/13/38/99/567133899.db2.gz FMRGINRHRNTIKK-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN Cc1ccc(-c2noc(CCn3cc([N+](=O)[O-])cn3)n2)cc1Br ZINC000546501168 567133834 /nfs/dbraw/zinc/13/38/34/567133834.db2.gz MQLABYKVOBFWCL-UHFFFAOYSA-N 0 0 378.186 3.155 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2SCCN2S(=O)(=O)Cc2ccc(F)cc2)cc1 ZINC000497934474 567134273 /nfs/dbraw/zinc/13/42/73/567134273.db2.gz MHYRJSXNFSKWSZ-INIZCTEOSA-N 0 0 382.438 3.311 20 5 GGBDRN COCCS(=O)(=O)c1ccc(CNc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000432172185 567135359 /nfs/dbraw/zinc/13/53/59/567135359.db2.gz KYIFEGBJZVATPG-UHFFFAOYSA-N 0 0 384.841 3.280 20 5 GGBDRN COc1ccsc1S(=O)(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497952821 567135972 /nfs/dbraw/zinc/13/59/72/567135972.db2.gz UKEXNGFHHIVVAI-ZDUSSCGKSA-N 0 0 386.476 3.101 20 5 GGBDRN CO[C@H](c1noc(-c2ccc([N+](=O)[O-])[nH]2)n1)c1ccc(Br)cc1 ZINC000546520761 567136034 /nfs/dbraw/zinc/13/60/34/567136034.db2.gz CWNXZGRSZPHSBP-LBPRGKRZSA-N 0 0 379.170 3.471 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H](CO)c1ccccc1Cl ZINC000588780644 567136964 /nfs/dbraw/zinc/13/69/64/567136964.db2.gz SJAVFSSZXYTZIM-GFCCVEGCSA-N 0 0 380.853 3.233 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)c2cncc(Cl)c2)cc1 ZINC000497955273 567136849 /nfs/dbraw/zinc/13/68/49/567136849.db2.gz XTKGCWKUJQAGGR-CQSZACIVSA-N 0 0 385.854 3.080 20 5 GGBDRN CSc1cccc(C(=O)NC[C@@H](CO)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000588788784 567137887 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3.152 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000546606801 567141073 /nfs/dbraw/zinc/14/10/73/567141073.db2.gz GQPYMJUHSKAPBU-UHFFFAOYSA-N 0 0 388.232 3.264 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2SCCN2S(=O)(=O)c2cc(F)ccc2F)cc1 ZINC000497984162 567141247 /nfs/dbraw/zinc/14/12/47/567141247.db2.gz PFUMHYDAISZUDD-HNNXBMFYSA-N 0 0 386.401 3.309 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NCC(C)(C)c1cccc(Br)c1 ZINC000523073824 567142595 /nfs/dbraw/zinc/14/25/95/567142595.db2.gz RIVUOOCCDFYGHS-UHFFFAOYSA-N 0 0 380.242 3.403 20 5 GGBDRN CC(C)(CC(F)(F)F)NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000614856707 567142660 /nfs/dbraw/zinc/14/26/60/567142660.db2.gz MAKOYOZATVAKDO-UHFFFAOYSA-N 0 0 377.344 3.152 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCN(C)c3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000474168995 567143248 /nfs/dbraw/zinc/14/32/48/567143248.db2.gz AXTCQKXMTCQHTH-UHFFFAOYSA-N 0 0 381.841 3.202 20 5 GGBDRN COC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1C ZINC000546634061 567144274 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COC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccc(SC)cc1 ZINC000524458855 567201290 /nfs/dbraw/zinc/20/12/90/567201290.db2.gz JYOSCTGDKKEGLU-LBPRGKRZSA-N 0 0 380.447 3.412 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cc(Br)cc(OC)c2)c1[N+](=O)[O-] ZINC000498777749 567201240 /nfs/dbraw/zinc/20/12/40/567201240.db2.gz PVPICRSYWBAAQB-UHFFFAOYSA-N 0 0 383.202 3.294 20 5 GGBDRN CC(C)(C(=O)Nc1cc(Br)c[nH]c1=O)c1ccccc1[N+](=O)[O-] ZINC000432892893 567201345 /nfs/dbraw/zinc/20/13/45/567201345.db2.gz KHAUVGCZYYSUPA-UHFFFAOYSA-N 0 0 380.198 3.374 20 5 GGBDRN CC[C@H](COCC(F)(F)F)NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000454801967 567202604 /nfs/dbraw/zinc/20/26/04/567202604.db2.gz RMRJEMIAVDTULZ-SNVBAGLBSA-N 0 0 383.754 3.405 20 5 GGBDRN COC(=O)C[C@@H](C)SCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000524535352 567202978 /nfs/dbraw/zinc/20/29/78/567202978.db2.gz BHZAZDHPABPHNV-MRVPVSSYSA-N 0 0 380.344 3.237 20 5 GGBDRN C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCC1(F)F ZINC000566946618 567204734 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COc1ccccc1CNCc1cc(I)cc([N+](=O)[O-])c1 ZINC000567033717 567212341 /nfs/dbraw/zinc/21/23/41/567212341.db2.gz AFTPPBKSKWFKOV-UHFFFAOYSA-N 0 0 398.200 3.498 20 5 GGBDRN CNc1nc(C(=O)N2CCCc3cc(Br)ccc32)ccc1[N+](=O)[O-] ZINC000454916640 567212716 /nfs/dbraw/zinc/21/27/16/567212716.db2.gz YICSQLMYPWYQBM-UHFFFAOYSA-N 0 0 391.225 3.387 20 5 GGBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])cc1I)C(C)C ZINC000567058928 567214269 /nfs/dbraw/zinc/21/42/69/567214269.db2.gz IXQOIHSMTHPWIV-UHFFFAOYSA-N 0 0 376.194 3.460 20 5 GGBDRN Cc1nc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)ccc1Br ZINC000524793843 567215155 /nfs/dbraw/zinc/21/51/55/567215155.db2.gz MDLAYZRQPSJXLK-UHFFFAOYSA-N 0 0 380.154 3.042 20 5 GGBDRN CC(C)CCc1cc(=NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)[nH][nH]1 ZINC000615934251 567215715 /nfs/dbraw/zinc/21/57/15/567215715.db2.gz QZDTXTKFEOUILO-UHFFFAOYSA-N 0 0 395.257 3.272 20 5 GGBDRN C[C@@H](C(=O)NCCCn1cc(Br)cn1)c1ccc([N+](=O)[O-])cc1F ZINC000567137827 567221960 /nfs/dbraw/zinc/22/19/60/567221960.db2.gz 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O=C(NC[C@@H]1CCCN(CC(F)(F)F)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000590401411 567224521 /nfs/dbraw/zinc/22/45/21/567224521.db2.gz DPMVEPRZNHQYJA-JTQLQIEISA-N 0 0 379.766 3.252 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O)c1ccc([N+](=O)[O-])o1 ZINC000475078861 567224538 /nfs/dbraw/zinc/22/45/38/567224538.db2.gz NTEKMTGOPBEXDR-JTQLQIEISA-N 0 0 384.175 3.030 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1C[C@@H](CO)Cc2ccccc21 ZINC000590406974 567224557 /nfs/dbraw/zinc/22/45/57/567224557.db2.gz MZLOLFYJVXONNN-NSHDSACASA-N 0 0 391.221 3.169 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CC[C@H](c2cccc(Br)c2)C1 ZINC000455039479 567227117 /nfs/dbraw/zinc/22/71/17/567227117.db2.gz LKFNGGWTUVPVPT-LBPRGKRZSA-N 0 0 391.225 3.196 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(Br)cnc2N(C)C)cc1[N+](=O)[O-] ZINC000499165762 567229027 /nfs/dbraw/zinc/22/90/27/567229027.db2.gz BNGMJQJPNHCYJW-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H]1c1cccnc1 ZINC000590538291 567229959 /nfs/dbraw/zinc/22/99/59/567229959.db2.gz OHEOIBUILJZEGC-HIFRSBDPSA-N 0 0 376.210 3.347 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC/C=C/c1cccnc1 ZINC000590564577 567232013 /nfs/dbraw/zinc/23/20/13/567232013.db2.gz FYMUFOIKBSQGMY-DUXPYHPUSA-N 0 0 376.210 3.124 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NCC1CCN(CC(F)F)CC1 ZINC000590567840 567232470 /nfs/dbraw/zinc/23/24/70/567232470.db2.gz UNRQPZBWXTVJPP-UHFFFAOYSA-N 0 0 379.205 3.141 20 5 GGBDRN Cc1cn2c(nc(C)c2CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000590567498 567232525 /nfs/dbraw/zinc/23/25/25/567232525.db2.gz KHJDCXRYLGPDOI-UHFFFAOYSA-N 0 0 378.841 3.433 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCSC3(CCCCC3)C2)c(F)cc1[N+](=O)[O-] ZINC000590591825 567233979 /nfs/dbraw/zinc/23/39/79/567233979.db2.gz YRFXIZRKDYONOH-UHFFFAOYSA-N 0 0 388.486 3.483 20 5 GGBDRN CC(C)OCCCN(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000567316779 567236967 /nfs/dbraw/zinc/23/69/67/567236967.db2.gz VBLZYDWVDFZWTK-UHFFFAOYSA-N 0 0 388.262 3.043 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1nc(-c2ccc(Cl)s2)cs1 ZINC000499321687 567238445 /nfs/dbraw/zinc/23/84/45/567238445.db2.gz AODSLRQIZZZOOL-UHFFFAOYSA-N 0 0 396.837 3.234 20 5 GGBDRN CCN(Cc1cc(Br)ccc1F)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000499361601 567241261 /nfs/dbraw/zinc/24/12/61/567241261.db2.gz JSHPHGIVNTWUFI-UHFFFAOYSA-N 0 0 384.205 3.497 20 5 GGBDRN COC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1)c1cccc(Cl)c1 ZINC000567389975 567241673 /nfs/dbraw/zinc/24/16/73/567241673.db2.gz XGWXPDATAFCCLT-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN CCOc1cc(N2CCN(Cc3ncc(Cl)s3)CC2)ccc1[N+](=O)[O-] ZINC000475511183 567252732 /nfs/dbraw/zinc/25/27/32/567252732.db2.gz SJHRKPDTDIXZGB-UHFFFAOYSA-N 0 0 382.873 3.426 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC(c3nnco3)CC2)cc1[N+](=O)[O-] ZINC000567508285 567253096 /nfs/dbraw/zinc/25/30/96/567253096.db2.gz GCRBSELOJAEMCR-UHFFFAOYSA-N 0 0 395.213 3.069 20 5 GGBDRN CC(=O)Nc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000525595111 567254746 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CCN(CC)S(=O)(=O)c1ccc(NC[C@@H](C)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000475735584 567270959 /nfs/dbraw/zinc/27/09/59/567270959.db2.gz RRKZDYMQQWKGRS-SNVBAGLBSA-N 0 0 383.392 3.236 20 5 GGBDRN COc1cc(Br)cc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000567706568 567271180 /nfs/dbraw/zinc/27/11/80/567271180.db2.gz WJQRBLAOXULUEK-CQSZACIVSA-N 0 0 397.225 3.218 20 5 GGBDRN C[C@H](CNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)C(F)(F)F ZINC000475733081 567271907 /nfs/dbraw/zinc/27/19/07/567271907.db2.gz ZYRWPAXDQHYKCG-MRVPVSSYSA-N 0 0 376.722 3.404 20 5 GGBDRN Cc1cc(F)c(Br)cc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000475749950 567272582 /nfs/dbraw/zinc/27/25/82/567272582.db2.gz SUKSLLZWVWLGIV-UHFFFAOYSA-N 0 0 385.193 3.375 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](C3CCC3)C2)c(C(F)(F)F)c1 ZINC000591333467 567274758 /nfs/dbraw/zinc/27/47/58/567274758.db2.gz FICGARPNMMJQFF-LLVKDONJSA-N 0 0 378.372 3.424 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CC[C@H](C2CCC2)C1 ZINC000591333398 567274905 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CC(C)c1n[nH]c(C(=O)N(C)Cc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000433859284 567278599 /nfs/dbraw/zinc/27/85/99/567278599.db2.gz NVFQFXQQIUDQNY-UHFFFAOYSA-N 0 0 381.230 3.476 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000433870430 567280231 /nfs/dbraw/zinc/28/02/31/567280231.db2.gz YAKCWLRVGAZBCZ-UHFFFAOYSA-N 0 0 381.230 3.476 20 5 GGBDRN CSc1cccc(NC(=O)[C@@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000526019018 567283074 /nfs/dbraw/zinc/28/30/74/567283074.db2.gz RHKSZSCKGLEKLL-LLVKDONJSA-N 0 0 380.447 3.118 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Br)ccn1 ZINC000499923792 567283736 /nfs/dbraw/zinc/28/37/36/567283736.db2.gz VXGGXFXVCOPVCZ-UHFFFAOYSA-N 0 0 379.214 3.459 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1OCc1nnc(C2CC2)o1 ZINC000548149629 567284027 /nfs/dbraw/zinc/28/40/27/567284027.db2.gz QOYHOCGMAHBTQM-UHFFFAOYSA-N 0 0 387.133 3.039 20 5 GGBDRN Cc1c(Br)c(=O)n(CC(=O)C2(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000475885535 567285661 /nfs/dbraw/zinc/28/56/61/567285661.db2.gz CLUHWFMYODEYHD-UHFFFAOYSA-N 0 0 391.221 3.128 20 5 GGBDRN CN(Cc1ccc(Br)cc1Cl)c1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000567882627 567286410 /nfs/dbraw/zinc/28/64/10/567286410.db2.gz IJPPOLIZTXKARF-UHFFFAOYSA-N 0 0 399.632 3.141 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2ccc(F)c(F)c2)c(Cl)c1 ZINC000526049293 567286513 /nfs/dbraw/zinc/28/65/13/567286513.db2.gz DFVGPYKBSFBWCN-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(F)(F)F)c(Br)c1 ZINC000526073381 567289320 /nfs/dbraw/zinc/28/93/20/567289320.db2.gz XPWNQLHUJKDTOZ-UHFFFAOYSA-N 0 0 393.119 3.362 20 5 GGBDRN COc1ccc(CSCC(=O)NCCCc2nccs2)cc1[N+](=O)[O-] ZINC000500011498 567290847 /nfs/dbraw/zinc/29/08/47/567290847.db2.gz VCPYKTZUAUEBBZ-UHFFFAOYSA-N 0 0 381.479 3.042 20 5 GGBDRN CCOc1cc(Br)c(F)cc1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000567977467 567294280 /nfs/dbraw/zinc/29/42/80/567294280.db2.gz ZVNJVLMHURUOTB-UHFFFAOYSA-N 0 0 386.177 3.486 20 5 GGBDRN COc1ccc(S(=O)(=O)N2c3ccccc3SC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000434108203 567294164 /nfs/dbraw/zinc/29/41/64/567294164.db2.gz DRXJAHAPSQXKKY-NSHDSACASA-N 0 0 380.447 3.293 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)CSc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000591752935 567295696 /nfs/dbraw/zinc/29/56/96/567295696.db2.gz MTLCGCWSIGBOKE-LLVKDONJSA-N 0 0 380.447 3.169 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1noc(C(F)F)n1 ZINC000591783618 567296736 /nfs/dbraw/zinc/29/67/36/567296736.db2.gz IIVBZLNQOKOQMK-YFKPBYRVSA-N 0 0 391.128 3.169 20 5 GGBDRN CS(=O)(=O)c1ccc(CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)s1 ZINC000568043616 567298871 /nfs/dbraw/zinc/29/88/71/567298871.db2.gz ONPZKRREUOIVLA-ZDUSSCGKSA-N 0 0 394.396 3.453 20 5 GGBDRN C[C@H]1CCCCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000476125352 567300564 /nfs/dbraw/zinc/30/05/64/567300564.db2.gz AEEDMCATSCDFDG-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2ccc(F)cc2Cl)c(F)c1 ZINC000500119805 567300824 /nfs/dbraw/zinc/30/08/24/567300824.db2.gz GGFMTGJDESWJGQ-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1C[C@H](CO)Oc2ccccc21 ZINC000591845325 567302109 /nfs/dbraw/zinc/30/21/09/567302109.db2.gz MANXEMZKACARLH-CYBMUJFWSA-N 0 0 379.210 3.117 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(Br)cc2[N+](=O)[O-])C[C@]2(CCCOC2)O1 ZINC000591846122 567302411 /nfs/dbraw/zinc/30/24/11/567302411.db2.gz IMFDRKWSLSHYHT-WBMJQRKESA-N 0 0 385.258 3.127 20 5 GGBDRN O=C(Nc1cc(F)c(I)c(F)c1)c1cc([N+](=O)[O-])c[nH]1 ZINC000500155244 567302528 /nfs/dbraw/zinc/30/25/28/567302528.db2.gz OGCAIEYSTQBHJD-UHFFFAOYSA-N 0 0 393.087 3.058 20 5 GGBDRN O=C(NCCOCC(F)(F)C(F)F)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000434326741 567303439 /nfs/dbraw/zinc/30/34/39/567303439.db2.gz NLMSGQLHZPGBLX-UHFFFAOYSA-N 0 0 380.319 3.456 20 5 GGBDRN C[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])Oc1ccc(Br)cc1 ZINC000500166614 567304404 /nfs/dbraw/zinc/30/44/04/567304404.db2.gz WUMVFMRDHQDQOI-JTQLQIEISA-N 0 0 394.225 3.137 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCN(c2c(F)cccc2F)CC1 ZINC000591953979 567305068 /nfs/dbraw/zinc/30/50/68/567305068.db2.gz UJFFLPDDSGOWHX-UHFFFAOYSA-N 0 0 399.195 3.357 20 5 GGBDRN C[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])Oc1cccc(Br)c1 ZINC000500175723 567305352 /nfs/dbraw/zinc/30/53/52/567305352.db2.gz BVSKKXDSXJNBFA-SNVBAGLBSA-N 0 0 394.225 3.137 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCN(c2c(F)cccc2F)CC1 ZINC000591953617 567305448 /nfs/dbraw/zinc/30/54/48/567305448.db2.gz LKDJKVQBVGKWQA-UHFFFAOYSA-N 0 0 399.195 3.357 20 5 GGBDRN C[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])Oc1cccc(Br)c1 ZINC000500175722 567305646 /nfs/dbraw/zinc/30/56/46/567305646.db2.gz BVSKKXDSXJNBFA-JTQLQIEISA-N 0 0 394.225 3.137 20 5 GGBDRN C[C@H](C(=O)NCCCCn1cc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000527073072 567311585 /nfs/dbraw/zinc/31/15/85/567311585.db2.gz KEMKBOSTWUINTC-LBPRGKRZSA-N 0 0 395.257 3.254 20 5 GGBDRN Cn1cc(-c2ccccc2CNc2c(Br)cncc2[N+](=O)[O-])cn1 ZINC000500289915 567312804 /nfs/dbraw/zinc/31/28/04/567312804.db2.gz NDUOHPKEGVADCK-UHFFFAOYSA-N 0 0 388.225 3.187 20 5 GGBDRN CSc1nnc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000527088091 567312881 /nfs/dbraw/zinc/31/28/81/567312881.db2.gz HQYGEOHXTWDSAG-UHFFFAOYSA-N 0 0 393.475 3.222 20 5 GGBDRN O=C(N[C@H]1COc2cc(F)c(Br)cc21)c1cccc([N+](=O)[O-])c1 ZINC000500318382 567313263 /nfs/dbraw/zinc/31/32/63/567313263.db2.gz AJBUCJRPHYBDAA-ZDUSSCGKSA-N 0 0 381.157 3.360 20 5 GGBDRN Nc1nccc(C(=O)Nc2nc(-c3ccccc3Cl)cs2)c1[N+](=O)[O-] ZINC000548414388 567314367 /nfs/dbraw/zinc/31/43/67/567314367.db2.gz FJQTZPSSIFOXDU-UHFFFAOYSA-N 0 0 375.797 3.432 20 5 GGBDRN O=C(N[C@@H]1COc2cc(F)c(Br)cc21)c1ccc(F)cc1[N+](=O)[O-] ZINC000500346972 567314629 /nfs/dbraw/zinc/31/46/29/567314629.db2.gz MUVBPHPYIWDCFJ-GFCCVEGCSA-N 0 0 399.147 3.499 20 5 GGBDRN O=C1NC2(CCCC2)C(=O)N1CCNc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000548446933 567316532 /nfs/dbraw/zinc/31/65/32/567316532.db2.gz RISJTDOCOIRXLI-UHFFFAOYSA-N 0 0 387.223 3.178 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccc(Br)cc1)C1CCC1 ZINC000476381771 567318486 /nfs/dbraw/zinc/31/84/86/567318486.db2.gz XCQMXOZGZBQFJI-HNNXBMFYSA-N 0 0 393.241 3.362 20 5 GGBDRN O=C1c2ccc(Br)cc2C(=O)N1CCOc1ccc([N+](=O)[O-])cc1 ZINC000434652168 567318901 /nfs/dbraw/zinc/31/89/01/567318901.db2.gz ZPXDIMWPFSXXDV-UHFFFAOYSA-N 0 0 391.177 3.032 20 5 GGBDRN Cc1c(CN2C(=O)c3ccc(Br)cc3C2=O)cccc1[N+](=O)[O-] ZINC000434646837 567318963 /nfs/dbraw/zinc/31/89/63/567318963.db2.gz CVSUEUAMCVTONG-UHFFFAOYSA-N 0 0 375.178 3.462 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000476356931 567319097 /nfs/dbraw/zinc/31/90/97/567319097.db2.gz PREYLMJBFBQDFR-LBPRGKRZSA-N 0 0 379.214 3.068 20 5 GGBDRN O=C1c2ccc(Br)cc2C(=O)N1Cc1c(F)cccc1[N+](=O)[O-] ZINC000434649555 567319106 /nfs/dbraw/zinc/31/91/06/567319106.db2.gz ABDYCDDLUMIHQL-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN CSc1ccc(C(=O)Nc2ccccc2SCC(N)=O)cc1[N+](=O)[O-] ZINC000500465559 567323993 /nfs/dbraw/zinc/32/39/93/567323993.db2.gz IOBAGKSGWGEVSB-UHFFFAOYSA-N 0 0 377.447 3.146 20 5 GGBDRN O=[N+]([O-])c1ccc(Cn2nnc(-c3ccc(Br)cc3)n2)c(F)c1 ZINC000476469983 567326033 /nfs/dbraw/zinc/32/60/33/567326033.db2.gz DIOUZBFQXDQUOV-UHFFFAOYSA-N 0 0 378.161 3.198 20 5 GGBDRN COc1ccc(Nc2nnc(SCc3c([N+](=O)[O-])ncn3C)s2)cc1 ZINC000476475680 567326275 /nfs/dbraw/zinc/32/62/75/567326275.db2.gz GVJMCILQNOLIMH-UHFFFAOYSA-N 0 0 378.439 3.224 20 5 GGBDRN COc1cnc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000568443306 567328966 /nfs/dbraw/zinc/32/89/66/567328966.db2.gz BXPHXJCAVUJRLB-UHFFFAOYSA-N 0 0 396.197 3.169 20 5 GGBDRN CN(CCC(C)(C)C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000592297875 567330100 /nfs/dbraw/zinc/33/01/00/567330100.db2.gz GRTYEOUSJFFZML-UHFFFAOYSA-N 0 0 386.246 3.190 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSc1n[nH]c(-c2ccccc2Br)n1 ZINC000476522269 567330691 /nfs/dbraw/zinc/33/06/91/567330691.db2.gz RDPNJUFPNSTGGB-UHFFFAOYSA-N 0 0 395.242 3.168 20 5 GGBDRN CSc1cccc(C(=O)N2CCC([C@@H](O)C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000548581422 567333100 /nfs/dbraw/zinc/33/31/00/567333100.db2.gz OINFFVVIDAMBNZ-CYBMUJFWSA-N 0 0 378.372 3.092 20 5 GGBDRN C[C@@H](C(=O)N[C@H](CO)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000617758654 567333240 /nfs/dbraw/zinc/33/32/40/567333240.db2.gz AROZDFNDBPOCLZ-BDJLRTHQSA-N 0 0 393.237 3.311 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(CC(F)(F)F)[C@H](C)C(C)C ZINC000592384311 567334883 /nfs/dbraw/zinc/33/48/83/567334883.db2.gz PPSFJGNNKLDNLY-SNVBAGLBSA-N 0 0 384.376 3.201 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1CO ZINC000617783476 567334749 /nfs/dbraw/zinc/33/47/49/567334749.db2.gz JWYGBHXPPAKMOH-NSHDSACASA-N 0 0 388.203 3.213 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(CC(F)(F)F)[C@@H](C)C(C)C ZINC000592384310 567335417 /nfs/dbraw/zinc/33/54/17/567335417.db2.gz PPSFJGNNKLDNLY-JTQLQIEISA-N 0 0 384.376 3.201 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1cc2ccccc2s1 ZINC000500647505 567335999 /nfs/dbraw/zinc/33/59/99/567335999.db2.gz BGMLPPYDSRITCJ-UHFFFAOYSA-N 0 0 376.459 3.472 20 5 GGBDRN C[C@H]1SCCN(c2nnc(CSc3ccccc3[N+](=O)[O-])n2C)[C@H]1C ZINC000592402467 567336339 /nfs/dbraw/zinc/33/63/39/567336339.db2.gz HLXUZKHMZHMBHJ-NWDGAFQWSA-N 0 0 379.511 3.346 20 5 GGBDRN CCn1c(CSc2ccccc2[N+](=O)[O-])nnc1N(C)[C@@H]1CCSC1 ZINC000592410407 567336532 /nfs/dbraw/zinc/33/65/32/567336532.db2.gz KVKIHYUZWNFOIV-GFCCVEGCSA-N 0 0 379.511 3.440 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCCCc1cccc(Cl)c1 ZINC000500653570 567337230 /nfs/dbraw/zinc/33/72/30/567337230.db2.gz SIJXSHJBXIHNKR-UHFFFAOYSA-N 0 0 382.869 3.343 20 5 GGBDRN CC[C@H]1[C@@H](C)CCN1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000476598045 567338989 /nfs/dbraw/zinc/33/89/89/567338989.db2.gz HMTNUGCVZDWQPH-ZANVPECISA-N 0 0 377.260 3.166 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(OC[C@@H](O)COc2ccc(Br)cc2)c1 ZINC000592446702 567339271 /nfs/dbraw/zinc/33/92/71/567339271.db2.gz OQWXIOVYYVPPBY-LBPRGKRZSA-N 0 0 398.209 3.185 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3cn4ccc(Br)cc4n3)no2)[nH]1 ZINC000568570841 567339239 /nfs/dbraw/zinc/33/92/39/567339239.db2.gz HMRROGCVSJYWND-UHFFFAOYSA-N 0 0 375.142 3.050 20 5 GGBDRN C[C@H](C(=O)N1CCOc2ncc(Br)cc21)c1cccc([N+](=O)[O-])c1 ZINC000617852747 567341433 /nfs/dbraw/zinc/34/14/33/567341433.db2.gz UGVLJVCCYPWEJM-JTQLQIEISA-N 0 0 392.209 3.281 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccc(Br)c2ccccc12 ZINC000476656519 567343006 /nfs/dbraw/zinc/34/30/06/567343006.db2.gz HLEUNHLFTOVMOW-UHFFFAOYSA-N 0 0 375.182 3.496 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(Cl)c1Cl ZINC000548710187 567344187 /nfs/dbraw/zinc/34/41/87/567344187.db2.gz JDELIMYNJVYSLI-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN CN(C)Cc1cc(NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000500796260 567345907 /nfs/dbraw/zinc/34/59/07/567345907.db2.gz QNACQRRTQOYKFS-UHFFFAOYSA-N 0 0 383.857 3.252 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]([C@@H](CO)C1CC1)C1CC1 ZINC000456150397 567346474 /nfs/dbraw/zinc/34/64/74/567346474.db2.gz NULSGYYNUMLMHB-SUMWQHHRSA-N 0 0 384.885 3.254 20 5 GGBDRN COc1ccc(NC(=O)C[C@H](C)n2cc(Br)cn2)c([N+](=O)[O-])c1 ZINC000592573676 567346624 /nfs/dbraw/zinc/34/66/24/567346624.db2.gz KGXVRVIBWYQMAI-VIFPVBQESA-N 0 0 383.202 3.152 20 5 GGBDRN C[C@@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)n1cc(Br)cn1 ZINC000592576156 567346831 /nfs/dbraw/zinc/34/68/31/567346831.db2.gz OPFVXLBQMROICD-JTQLQIEISA-N 0 0 379.214 3.094 20 5 GGBDRN C[C@@H](CC(=O)N(C)Cc1ccccc1[N+](=O)[O-])n1cc(Br)cn1 ZINC000592578902 567346845 /nfs/dbraw/zinc/34/68/45/567346845.db2.gz GDIPRIWTVFVFRB-NSHDSACASA-N 0 0 381.230 3.164 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c(Cl)c1 ZINC000476742379 567346879 /nfs/dbraw/zinc/34/68/79/567346879.db2.gz SJJRGNBBRPBNKP-UHFFFAOYSA-N 0 0 384.797 3.129 20 5 GGBDRN COc1ccc(C(=O)NCCc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000548746106 567347119 /nfs/dbraw/zinc/34/71/19/567347119.db2.gz MJMCQYBECIWGNE-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCSC[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000456180519 567347390 /nfs/dbraw/zinc/34/73/90/567347390.db2.gz NIITUHBMQNZNQF-OAHLLOKOSA-N 0 0 382.507 3.191 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCSC[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000456180518 567347512 /nfs/dbraw/zinc/34/75/12/567347512.db2.gz NIITUHBMQNZNQF-HNNXBMFYSA-N 0 0 382.507 3.191 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)[C@H](C)O ZINC000456193914 567350110 /nfs/dbraw/zinc/35/01/10/567350110.db2.gz POOQUYVSTAJEND-CMPLNLGQSA-N 0 0 381.479 3.400 20 5 GGBDRN O=C(Cn1c(=O)oc2cc(F)c(Br)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000568716557 567350851 /nfs/dbraw/zinc/35/08/51/567350851.db2.gz CKZCLYZVIRZRMV-UHFFFAOYSA-N 0 0 395.140 3.287 20 5 GGBDRN Cc1c(CC(=O)Nc2nn(CC(F)(F)F)cc2Cl)cccc1[N+](=O)[O-] ZINC000592646566 567352689 /nfs/dbraw/zinc/35/26/89/567352689.db2.gz LHCJXLDPKINFHY-UHFFFAOYSA-N 0 0 376.722 3.497 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)ccn1 ZINC000500929754 567354340 /nfs/dbraw/zinc/35/43/40/567354340.db2.gz VGJCTOYTBIADOL-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN C[C@@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000568770680 567355179 /nfs/dbraw/zinc/35/51/79/567355179.db2.gz LDPDCRGFMMUZEA-KRTXAFLBSA-N 0 0 397.254 3.293 20 5 GGBDRN CSc1ccc(F)cc1CNS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000500967200 567355656 /nfs/dbraw/zinc/35/56/56/567355656.db2.gz RTOPFHFZNBLYDM-UHFFFAOYSA-N 0 0 384.454 3.118 20 5 GGBDRN CCc1nn(C)cc1CNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435329843 567355949 /nfs/dbraw/zinc/35/59/49/567355949.db2.gz QUAHBVIXECSFBB-UHFFFAOYSA-N 0 0 396.245 3.283 20 5 GGBDRN O=C(Nc1ccc(Cl)c(CN2CCOCC2)c1)c1csc([N+](=O)[O-])c1 ZINC000435326686 567356654 /nfs/dbraw/zinc/35/66/54/567356654.db2.gz FETXCKFYIVQDOM-UHFFFAOYSA-N 0 0 381.841 3.394 20 5 GGBDRN Cc1c(NC(=O)N[C@H]2CCO[C@H]2C2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435331356 567356699 /nfs/dbraw/zinc/35/66/99/567356699.db2.gz GGHQKTGUIVTURW-FZMZJTMJSA-N 0 0 384.230 3.355 20 5 GGBDRN C[C@@H]1CC2(CN1C(=O)c1ccc([N+](=O)[O-])cc1Br)CCOCC2 ZINC000592720291 567357082 /nfs/dbraw/zinc/35/70/82/567357082.db2.gz JYVYDXQDGLRKJX-LLVKDONJSA-N 0 0 383.242 3.389 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000456306795 567361432 /nfs/dbraw/zinc/36/14/32/567361432.db2.gz GNRPEQHEUGSILM-YRGRVCCFSA-N 0 0 397.269 3.289 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000435427631 567362534 /nfs/dbraw/zinc/36/25/34/567362534.db2.gz MVVQZCDSEGIRBM-BXUZGUMPSA-N 0 0 384.816 3.363 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)N(C)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000476998334 567363677 /nfs/dbraw/zinc/36/36/77/567363677.db2.gz FMYLBSKDCXQVML-GFCCVEGCSA-N 0 0 395.257 3.184 20 5 GGBDRN C[C@@H]1CC(CCNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000548977170 567363830 /nfs/dbraw/zinc/36/38/30/567363830.db2.gz OPDCQCGRTPIPQS-GHMZBOCLSA-N 0 0 376.862 3.120 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSCc1cc2c(cc1Br)OCO2 ZINC000477015578 567364236 /nfs/dbraw/zinc/36/42/36/567364236.db2.gz HPIUMNONFGNATH-UHFFFAOYSA-N 0 0 386.227 3.253 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)c(Cl)c1 ZINC000435432146 567364555 /nfs/dbraw/zinc/36/45/55/567364555.db2.gz LSGIZXLZQFXWGS-NOZJJQNGSA-N 0 0 388.779 3.361 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CC[C@](F)(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000548977311 567364876 /nfs/dbraw/zinc/36/48/76/567364876.db2.gz ROSHPHPBZFSADL-OAHLLOKOSA-N 0 0 388.417 3.363 20 5 GGBDRN CCOc1ccc([C@@H]2C[C@H]2NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000435433662 567364957 /nfs/dbraw/zinc/36/49/57/567364957.db2.gz OSIXQFFXIALDRL-UONOGXRCSA-N 0 0 382.463 3.198 20 5 GGBDRN CCn1ccnc1[C@@H](C)NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000456356425 567365130 /nfs/dbraw/zinc/36/51/30/567365130.db2.gz OTSGNGYQAJEDOO-SNVBAGLBSA-N 0 0 381.230 3.373 20 5 GGBDRN CCn1ccnc1[C@H](C)NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000456356424 567365176 /nfs/dbraw/zinc/36/51/76/567365176.db2.gz OTSGNGYQAJEDOO-JTQLQIEISA-N 0 0 381.230 3.373 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCOc2ccccc2C(F)(F)F)cc1 ZINC000477028764 567365597 /nfs/dbraw/zinc/36/55/97/567365597.db2.gz GDGZNZNPMWGHKQ-UHFFFAOYSA-N 0 0 375.324 3.466 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)cnn1C ZINC000501108488 567365874 /nfs/dbraw/zinc/36/58/74/567365874.db2.gz SHPRIZUTVUYXMT-MRVPVSSYSA-N 0 0 382.218 3.282 20 5 GGBDRN C[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccc(Cl)cn1 ZINC000548986406 567366060 /nfs/dbraw/zinc/36/60/60/567366060.db2.gz DFQNCIMOLRNDTL-JTQLQIEISA-N 0 0 384.845 3.067 20 5 GGBDRN C[C@H](c1cnn(C)c1)N(C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501121600 567366164 /nfs/dbraw/zinc/36/61/64/567366164.db2.gz XJGZWUXJQCUFJC-SECBINFHSA-N 0 0 382.218 3.316 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCOc2ccccc2Br)cc1 ZINC000477043592 567366711 /nfs/dbraw/zinc/36/67/11/567366711.db2.gz LKKVZEWUECXKGU-UHFFFAOYSA-N 0 0 386.223 3.210 20 5 GGBDRN CC(=O)[C@H](Cc1ccc(Cl)cc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000477039240 567366787 /nfs/dbraw/zinc/36/67/87/567366787.db2.gz HSOROOVROPNUSP-INIZCTEOSA-N 0 0 385.800 3.361 20 5 GGBDRN CC(=O)[C@@H](Cc1ccc(Cl)cc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000477039241 567366870 /nfs/dbraw/zinc/36/68/70/567366870.db2.gz HSOROOVROPNUSP-MRXNPFEDSA-N 0 0 385.800 3.361 20 5 GGBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@](=O)C(C)(C)CC1 ZINC000456369522 567367193 /nfs/dbraw/zinc/36/71/93/567367193.db2.gz QLLIKHURGAFJCB-VWLOTQADSA-N 0 0 384.523 3.470 20 5 GGBDRN CCO[C@H]1C[C@H]1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000618259087 567367302 /nfs/dbraw/zinc/36/73/02/567367302.db2.gz LFYHUPDIVPKRIS-YPMHNXCESA-N 0 0 379.463 3.418 20 5 GGBDRN Cc1nc(CCNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c(C)o1 ZINC000501126944 567367701 /nfs/dbraw/zinc/36/77/01/567367701.db2.gz YFJSLMLAEOTMRV-UHFFFAOYSA-N 0 0 383.202 3.326 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NC1(C2CC2)CC1 ZINC000549022081 567369245 /nfs/dbraw/zinc/36/92/45/567369245.db2.gz YJMPFUDMILNKCI-UHFFFAOYSA-N 0 0 386.189 3.180 20 5 GGBDRN CCS(=O)(=O)CC(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000435443161 567369254 /nfs/dbraw/zinc/36/92/54/567369254.db2.gz PADSBUIUJNRISX-UHFFFAOYSA-N 0 0 386.476 3.181 20 5 GGBDRN CS(=O)(=O)CCC(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000435442906 567369389 /nfs/dbraw/zinc/36/93/89/567369389.db2.gz LAXIGRXAJKKJSE-UHFFFAOYSA-N 0 0 386.476 3.181 20 5 GGBDRN Cc1nc(C2CCC2)nn1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000568966926 567369874 /nfs/dbraw/zinc/36/98/74/567369874.db2.gz RFCLRLUMQFNQQJ-UHFFFAOYSA-N 0 0 398.204 3.415 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000435443011 567370262 /nfs/dbraw/zinc/37/02/62/567370262.db2.gz OFOIDFNHHRXUPJ-UONOGXRCSA-N 0 0 382.825 3.091 20 5 GGBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(Cn2cc(I)cn2)c1 ZINC000549055180 567371138 /nfs/dbraw/zinc/37/11/38/567371138.db2.gz OFJZGTBXNMMHPV-UHFFFAOYSA-N 0 0 397.094 3.463 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCOC2(C1)CCCCCC2 ZINC000477122441 567372908 /nfs/dbraw/zinc/37/29/08/567372908.db2.gz AZXTXJDZZZSIIY-UHFFFAOYSA-N 0 0 388.873 3.362 20 5 GGBDRN CC[C@H]1Cc2c(Br)cccc2CN1C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000569023295 567373702 /nfs/dbraw/zinc/37/37/02/567373702.db2.gz HEEVEISZWLVNQA-JTQLQIEISA-N 0 0 379.214 3.058 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCCCCc1ccc(Cl)s1 ZINC000569014573 567373714 /nfs/dbraw/zinc/37/37/14/567373714.db2.gz WRWHRFLZDPSWMZ-UHFFFAOYSA-N 0 0 389.886 3.392 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1Cc1ccc(I)c(Cl)c1 ZINC000435504532 567373953 /nfs/dbraw/zinc/37/39/53/567373953.db2.gz IHDRXIXOJABYRH-UHFFFAOYSA-N 0 0 377.569 3.406 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000435568543 567375540 /nfs/dbraw/zinc/37/55/40/567375540.db2.gz HMMHRDLZNQHEEN-IINYFYTJSA-N 0 0 385.804 3.003 20 5 GGBDRN CC(C)c1ncsc1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000456459011 567375506 /nfs/dbraw/zinc/37/55/06/567375506.db2.gz QUEZBOFLDFRKRL-UHFFFAOYSA-N 0 0 380.451 3.004 20 5 GGBDRN CCOc1ccc([C@@H]2C[C@H]2Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000435578598 567375856 /nfs/dbraw/zinc/37/58/56/567375856.db2.gz YDWTZUPLSCWJQJ-QWHCGFSZSA-N 0 0 382.463 3.427 20 5 GGBDRN CSc1ccc(CCNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000435581146 567375925 /nfs/dbraw/zinc/37/59/25/567375925.db2.gz UJXLPVKQBJRYGS-UHFFFAOYSA-N 0 0 380.491 3.021 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@@H]23)cc1[N+](=O)[O-] ZINC000477165857 567376690 /nfs/dbraw/zinc/37/66/90/567376690.db2.gz OWQLKDRUBNWQNT-IAOVAPTHSA-N 0 0 378.837 3.173 20 5 GGBDRN O=C(Nc1nc(-c2ccc(Br)cc2)cs1)c1c[nH]nc1[N+](=O)[O-] ZINC000549157156 567376790 /nfs/dbraw/zinc/37/67/90/567376790.db2.gz WVQHTYQKJYXWDH-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN Cn1nccc1N1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000618347289 567376818 /nfs/dbraw/zinc/37/68/18/567376818.db2.gz ABPLLFZUEXVTRN-NSHDSACASA-N 0 0 380.246 3.172 20 5 GGBDRN CSc1ccc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000435588707 567377286 /nfs/dbraw/zinc/37/72/86/567377286.db2.gz NZIMAQUDHBICES-UHFFFAOYSA-N 0 0 386.882 3.491 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000435586922 567377325 /nfs/dbraw/zinc/37/73/25/567377325.db2.gz DEBWJDKYYPHXMT-UONOGXRCSA-N 0 0 382.825 3.091 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)cc1 ZINC000435590637 567377452 /nfs/dbraw/zinc/37/74/52/567377452.db2.gz XLGUYDCXGQAJSA-XJKSGUPXSA-N 0 0 384.816 3.363 20 5 GGBDRN CO[C@@H](C)c1noc(CCC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000501282192 567378069 /nfs/dbraw/zinc/37/80/69/567378069.db2.gz GVZZEZOMWJQZJI-QMMMGPOBSA-N 0 0 399.201 3.019 20 5 GGBDRN CO[C@H](C)c1noc(CCC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000501282190 567378255 /nfs/dbraw/zinc/37/82/55/567378255.db2.gz GVZZEZOMWJQZJI-MRVPVSSYSA-N 0 0 399.201 3.019 20 5 GGBDRN O=C(N[C@H]1COc2cc(F)c(Br)cc21)c1ccccc1[N+](=O)[O-] ZINC000501296382 567379201 /nfs/dbraw/zinc/37/92/01/567379201.db2.gz SMPRXMQXQNLJQI-LBPRGKRZSA-N 0 0 381.157 3.360 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1COc2cc(F)c(Br)cc21 ZINC000501294806 567379336 /nfs/dbraw/zinc/37/93/36/567379336.db2.gz NBSIYFGJNVYORW-AWEZNQCLSA-N 0 0 395.184 3.289 20 5 GGBDRN Cc1c(Br)c(N[C@H](CC(N)=O)c2ccccc2)ncc1[N+](=O)[O-] ZINC000549223724 567379813 /nfs/dbraw/zinc/37/98/13/567379813.db2.gz VYKPGMGGDSGEKI-LLVKDONJSA-N 0 0 379.214 3.089 20 5 GGBDRN C[C@H](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)N1CCCCC1=O ZINC000501317838 567380146 /nfs/dbraw/zinc/38/01/46/567380146.db2.gz PJWWQGQAHQZWNA-SNVBAGLBSA-N 0 0 384.230 3.087 20 5 GGBDRN C[C@@H]1N(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCOC1(C)C ZINC000477210052 567380650 /nfs/dbraw/zinc/38/06/50/567380650.db2.gz VIIWQIUTKLGYCR-QMMMGPOBSA-N 0 0 383.253 3.090 20 5 GGBDRN Cc1c(Br)c(N2CCc3ccccc3[C@@H]2CO)ncc1[N+](=O)[O-] ZINC000569118650 567380798 /nfs/dbraw/zinc/38/07/98/567380798.db2.gz SEHLECOXMFDQES-AWEZNQCLSA-N 0 0 378.226 3.157 20 5 GGBDRN COc1cc(CCNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])ccc1Cl ZINC000549246643 567381166 /nfs/dbraw/zinc/38/11/66/567381166.db2.gz PAMKGRUDDQNIFL-UHFFFAOYSA-N 0 0 384.841 3.315 20 5 GGBDRN O=C(Nc1nc(-c2ccccc2)c(Br)s1)c1cc([N+](=O)[O-])n[nH]1 ZINC000501338503 567381334 /nfs/dbraw/zinc/38/13/34/567381334.db2.gz HMCKPQVZYURWBV-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@@H]1CCC[C@H]1OC(F)F ZINC000501346735 567383239 /nfs/dbraw/zinc/38/32/39/567383239.db2.gz HLJAGXHOXGENDM-VXGBXAGGSA-N 0 0 393.184 3.176 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(Sc2ccncc2C)c([N+](=O)[O-])c1 ZINC000549285855 567383621 /nfs/dbraw/zinc/38/36/21/567383621.db2.gz NFIMMEPJIPEJKP-UHFFFAOYSA-N 0 0 381.479 3.480 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NCCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000549282300 567383858 /nfs/dbraw/zinc/38/38/58/567383858.db2.gz IHBSHDHXBDWAMV-UHFFFAOYSA-N 0 0 386.861 3.049 20 5 GGBDRN CCC1(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])COC1 ZINC000456498438 567384071 /nfs/dbraw/zinc/38/40/71/567384071.db2.gz AFKXPBLXRNJRTD-UHFFFAOYSA-N 0 0 378.372 3.249 20 5 GGBDRN CCCN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCS(=O)(=O)C1 ZINC000549367099 567388098 /nfs/dbraw/zinc/38/80/98/567388098.db2.gz XROCKQMRKSMGDI-ZDUSSCGKSA-N 0 0 380.388 3.013 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H](C)c2nnc(C(C)C)[nH]2)cc1[N+](=O)[O-] ZINC000477328942 567390276 /nfs/dbraw/zinc/39/02/76/567390276.db2.gz ZSXPCHUSAXKMLL-SECBINFHSA-N 0 0 396.245 3.398 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(-c2cc(Br)c(F)cc2F)n1 ZINC000569289661 567393822 /nfs/dbraw/zinc/39/38/22/567393822.db2.gz IEVJUMVYELHZRB-UHFFFAOYSA-N 0 0 386.112 3.086 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ccc(OC(F)F)c(F)c2)cc1[N+](=O)[O-] ZINC000549531594 567396935 /nfs/dbraw/zinc/39/69/35/567396935.db2.gz DNDQFZOCSJNPSR-UHFFFAOYSA-N 0 0 396.368 3.184 20 5 GGBDRN CO[C@@H]1C[C@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C12CCC2 ZINC000456657658 567397892 /nfs/dbraw/zinc/39/78/92/567397892.db2.gz TYTDNBFJDKSSMR-LSDHHAIUSA-N 0 0 397.269 3.316 20 5 GGBDRN CO[C@@H]1C[C@@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C12CCC2 ZINC000456657655 567397952 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GGBDRN COc1cccc(C(=O)N[C@H](C)c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000477771628 567416483 /nfs/dbraw/zinc/41/64/83/567416483.db2.gz VWFYUCIRSJFRPY-SECBINFHSA-N 0 0 380.198 3.252 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2c3ccc(Br)cc3CS2(=O)=O)cc1 ZINC000549903435 567416602 /nfs/dbraw/zinc/41/66/02/567416602.db2.gz NJXZQONJVRKRTP-UHFFFAOYSA-N 0 0 383.223 3.207 20 5 GGBDRN CO[C@@H](C)c1nc(Cn2cnc3c(Cl)cc([N+](=O)[O-])cc3c2=O)cs1 ZINC000569603422 567416842 /nfs/dbraw/zinc/41/68/42/567416842.db2.gz MSTYCDWQKOGFAF-QMMMGPOBSA-N 0 0 380.813 3.170 20 5 GGBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H](C)C(=O)OCC ZINC000436347103 567419626 /nfs/dbraw/zinc/41/96/26/567419626.db2.gz ZAGRCPMQUFZXSO-JTQLQIEISA-N 0 0 387.230 3.161 20 5 GGBDRN CNc1c(C(=O)N[C@@H](C)c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000477805803 567419665 /nfs/dbraw/zinc/41/96/65/567419665.db2.gz ONOSGHRSLVVIRR-VIFPVBQESA-N 0 0 379.214 3.285 20 5 GGBDRN COc1cc(CNc2c3cc(Br)ccc3ncc2[N+](=O)[O-])ccn1 ZINC000502097560 567419696 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O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1Br ZINC000502554046 567442747 /nfs/dbraw/zinc/44/27/47/567442747.db2.gz OBOXXIBYKCEOHF-MRXNPFEDSA-N 0 0 390.237 3.030 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)CC1CCCC1 ZINC000550398754 567444334 /nfs/dbraw/zinc/44/43/34/567444334.db2.gz LVDUOGFZOIRQIU-GFCCVEGCSA-N 0 0 385.258 3.337 20 5 GGBDRN COC(=O)c1cnc(N(C)Cc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000478264473 567444543 /nfs/dbraw/zinc/44/45/43/567444543.db2.gz DFVXJJGXHFUMMT-UHFFFAOYSA-N 0 0 380.198 3.175 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000502658078 567445148 /nfs/dbraw/zinc/44/51/48/567445148.db2.gz DZCIRRLKTAQAHE-INIZCTEOSA-N 0 0 384.841 3.223 20 5 GGBDRN CC1(C)C[C@@H](CNC(=O)c2sc(Br)cc2[N+](=O)[O-])CCO1 ZINC000457189739 567446694 /nfs/dbraw/zinc/44/66/94/567446694.db2.gz QYJNWCGXPXTIAG-QMMMGPOBSA-N 0 0 377.260 3.354 20 5 GGBDRN CSc1ccc(C(=O)Nc2cccc(CS(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000478327851 567448357 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ZINC000552188324 567566149 /nfs/dbraw/zinc/56/61/49/567566149.db2.gz PFPQQBYFCCQKPL-SNVBAGLBSA-N 0 0 384.223 3.024 20 5 GGBDRN COc1cc(S(=O)(=O)N2c3ccccc3SC[C@H]2C)ccc1[N+](=O)[O-] ZINC000439128320 567567220 /nfs/dbraw/zinc/56/72/20/567567220.db2.gz GLCMHIMCBSKPBI-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN COC(=O)[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000552205322 567567832 /nfs/dbraw/zinc/56/78/32/567567832.db2.gz ZESAHJNPEURPDD-MRXNPFEDSA-N 0 0 393.237 3.404 20 5 GGBDRN CCOc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000479914677 567568728 /nfs/dbraw/zinc/56/87/28/567568728.db2.gz JJULNJQVSPEVJW-UHFFFAOYSA-N 0 0 384.841 3.168 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)Cc2ccccc21 ZINC000552214416 567569035 /nfs/dbraw/zinc/56/90/35/567569035.db2.gz NXGDCHHIIAGOGH-CYBMUJFWSA-N 0 0 391.221 3.230 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1cc(F)ccc1F ZINC000479948088 567569891 /nfs/dbraw/zinc/56/98/91/567569891.db2.gz JXPUPHGKNVNCGT-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@@H](c2ccncc2)C1 ZINC000571535637 567570885 /nfs/dbraw/zinc/57/08/85/567570885.db2.gz RZUWIZLUNOGWCV-GFCCVEGCSA-N 0 0 376.210 3.382 20 5 GGBDRN CN(C[C@@H]1CCCC[C@@H]1O)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000479951124 567571654 /nfs/dbraw/zinc/57/16/54/567571654.db2.gz UEATUAXZWOMAKW-ZANVPECISA-N 0 0 397.280 3.073 20 5 GGBDRN CN(C[C@H]1CCCC[C@H]1O)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000479951121 567572049 /nfs/dbraw/zinc/57/20/49/567572049.db2.gz UEATUAXZWOMAKW-NOZJJQNGSA-N 0 0 397.280 3.073 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000439221248 567572162 /nfs/dbraw/zinc/57/21/62/567572162.db2.gz BXSWPXPRJKTJQB-UHFFFAOYSA-N 0 0 379.276 3.332 20 5 GGBDRN CO[C@@H](c1ccccc1Cl)[C@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000479986191 567572667 /nfs/dbraw/zinc/57/26/67/567572667.db2.gz BTQRYINNFZQBNJ-MEDUHNTESA-N 0 0 384.841 3.303 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1cccc(F)c1F ZINC000479982961 567573041 /nfs/dbraw/zinc/57/30/41/567573041.db2.gz OULYNTFGARNIAC-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN CC[C@@H](C)[C@@H](C)NS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000439230343 567573281 /nfs/dbraw/zinc/57/32/81/567573281.db2.gz BADLPQAHGVOADI-PSASIEDQSA-N 0 0 379.276 3.379 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2C[C@@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000439222204 567573630 /nfs/dbraw/zinc/57/36/30/567573630.db2.gz DXVYSDRYZIPANE-IUCAKERBSA-N 0 0 377.260 3.085 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1cnc2ccsc2c1 ZINC000479997554 567574516 /nfs/dbraw/zinc/57/45/16/567574516.db2.gz ZAENZJMTJSOARJ-UHFFFAOYSA-N 0 0 397.865 3.379 20 5 GGBDRN Cc1cccc2c1OC[C@@H](NC(=O)c1sc(Br)cc1[N+](=O)[O-])C2 ZINC000571608052 567574647 /nfs/dbraw/zinc/57/46/47/567574647.db2.gz ZLYUKDIHZJRNNT-JTQLQIEISA-N 0 0 397.250 3.461 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N[C@@H]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000439241542 567574844 /nfs/dbraw/zinc/57/48/44/567574844.db2.gz XOFAODCURNTAKW-PRHODGIISA-N 0 0 377.260 3.133 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000439244868 567574917 /nfs/dbraw/zinc/57/49/17/567574917.db2.gz HYRGRVJFOFDKKJ-UWVGGRQHSA-N 0 0 391.287 3.332 20 5 GGBDRN O=c1c2cc(Br)ccc2ncn1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000505437963 567575841 /nfs/dbraw/zinc/57/58/41/567575841.db2.gz JYMYNEUUPZXULE-UHFFFAOYSA-N 0 0 396.147 3.394 20 5 GGBDRN O=C(NCc1nc2cc(Br)ccc2o1)c1csc([N+](=O)[O-])c1 ZINC000552305374 567576040 /nfs/dbraw/zinc/57/60/40/567576040.db2.gz GIHUWRMRHITXQN-UHFFFAOYSA-N 0 0 382.195 3.490 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000439250716 567576400 /nfs/dbraw/zinc/57/64/00/567576400.db2.gz UUOASDLKEKCLJY-VIFPVBQESA-N 0 0 377.260 3.229 20 5 GGBDRN CCNC(=O)c1cccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000571624411 567578199 /nfs/dbraw/zinc/57/81/99/567578199.db2.gz OGXSQEUTANNMCC-UHFFFAOYSA-N 0 0 398.238 3.421 20 5 GGBDRN Nc1c(C(=O)N2CCc3ccc(Br)cc3C2)cccc1[N+](=O)[O-] ZINC000552347371 567580639 /nfs/dbraw/zinc/58/06/39/567580639.db2.gz XCWREQVGVLVAOK-UHFFFAOYSA-N 0 0 376.210 3.138 20 5 GGBDRN CCc1cnc(CNc2c3cc(Br)ccc3ncc2[N+](=O)[O-])o1 ZINC000480103849 567582225 /nfs/dbraw/zinc/58/22/25/567582225.db2.gz GKTBZKPCDZLPSH-UHFFFAOYSA-N 0 0 377.198 3.490 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000571709814 567583947 /nfs/dbraw/zinc/58/39/47/567583947.db2.gz VFDIBUFIXMZFIK-UHFFFAOYSA-N 0 0 377.813 3.035 20 5 GGBDRN CCc1ccc(S(=O)(=O)N[C@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000571794002 567589302 /nfs/dbraw/zinc/58/93/02/567589302.db2.gz HCBBIAOTQCWTDE-SNVBAGLBSA-N 0 0 381.479 3.142 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC=C(c2cccc(Br)c2)CC1 ZINC000552433914 567590004 /nfs/dbraw/zinc/59/00/04/567590004.db2.gz HTDYIBSZGXKZNY-UHFFFAOYSA-N 0 0 377.198 3.010 20 5 GGBDRN O=C(NCCc1cnc(SC2CCCC2)nc1)c1csc([N+](=O)[O-])c1 ZINC000552448467 567591483 /nfs/dbraw/zinc/59/14/83/567591483.db2.gz ITWSWILWICCYKE-UHFFFAOYSA-N 0 0 378.479 3.454 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2sccc2Cl)cc1[N+](=O)[O-] ZINC000505699173 567593290 /nfs/dbraw/zinc/59/32/90/567593290.db2.gz GKRRTDDXOQMCCO-UHFFFAOYSA-N 0 0 375.859 3.172 20 5 GGBDRN COc1nc(C)cc(Oc2ccc(I)cc2[N+](=O)[O-])n1 ZINC000480311805 567596251 /nfs/dbraw/zinc/59/62/51/567596251.db2.gz SKWGECYAPPFEOA-UHFFFAOYSA-N 0 0 387.133 3.099 20 5 GGBDRN COC(=O)[C@@H]1CC12CCN(c1cc(C)c([N+](=O)[O-])cc1Br)CC2 ZINC000530384118 567598066 /nfs/dbraw/zinc/59/80/66/567598066.db2.gz NGGWJWFIRXZROY-NSHDSACASA-N 0 0 383.242 3.445 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000571912809 567598485 /nfs/dbraw/zinc/59/84/85/567598485.db2.gz UBJXPZIKRKUHCZ-UHFFFAOYSA-N 0 0 385.255 3.148 20 5 GGBDRN C[C@@H](CNc1c2cc(Br)ccc2ncc1[N+](=O)[O-])Cn1cccn1 ZINC000480374077 567600280 /nfs/dbraw/zinc/60/02/80/567600280.db2.gz GHCOURTYNHSCFW-NSHDSACASA-N 0 0 390.241 3.272 20 5 GGBDRN COC(=O)c1ccc(C(F)(F)F)nc1SCc1onc(C)c1[N+](=O)[O-] ZINC000596025430 567600691 /nfs/dbraw/zinc/60/06/91/567600691.db2.gz XBZBZTCJQYMGIH-UHFFFAOYSA-N 0 0 377.300 3.384 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)c1[N+](=O)[O-] ZINC000505886161 567601491 /nfs/dbraw/zinc/60/14/91/567601491.db2.gz ZOHJVCHWOIIHRI-UHFFFAOYSA-N 0 0 378.694 3.473 20 5 GGBDRN O=c1cc(CNc2cc(F)cc([N+](=O)[O-])c2)nc2ccc(Br)cn12 ZINC000530434063 567601733 /nfs/dbraw/zinc/60/17/33/567601733.db2.gz PTQLDGKFITZHHZ-UHFFFAOYSA-N 0 0 393.172 3.116 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2ncsc2Br)cccc1[N+](=O)[O-] ZINC000596038026 567601823 /nfs/dbraw/zinc/60/18/23/567601823.db2.gz HNBVJIWZKJKGLA-UHFFFAOYSA-N 0 0 391.268 3.237 20 5 GGBDRN CC1(C)Cc2ccc(Br)cc2[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000571971916 567602388 /nfs/dbraw/zinc/60/23/88/567602388.db2.gz IXFRZJDSSFWHTM-GFCCVEGCSA-N 0 0 379.214 3.134 20 5 GGBDRN Cc1noc(CNc2cc(N3CCOCC3)ccc2Br)c1[N+](=O)[O-] ZINC000596040373 567602481 /nfs/dbraw/zinc/60/24/81/567602481.db2.gz VXYWUERKXKIRGI-UHFFFAOYSA-N 0 0 397.229 3.102 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(c2ccc(O)cc2)CC1 ZINC000596051036 567605527 /nfs/dbraw/zinc/60/55/27/567605527.db2.gz JYEKPANATVIQHR-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN COc1ccc(CNS(=O)(=O)Cc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000480455117 567606008 /nfs/dbraw/zinc/60/60/08/567606008.db2.gz STHWVPNORNQDIW-UHFFFAOYSA-N 0 0 388.804 3.016 20 5 GGBDRN O=C(NCC1CC1)[C@@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596080859 567606938 /nfs/dbraw/zinc/60/69/38/567606938.db2.gz NSGRZYWBPGPYBZ-GFCCVEGCSA-N 0 0 382.258 3.100 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(Cc2cccnc2)CC1 ZINC000596064229 567607511 /nfs/dbraw/zinc/60/75/11/567607511.db2.gz DTDKQTBGBHKYSU-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN NS(=O)(=O)c1ccc(N2CCC[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000596072758 567607520 /nfs/dbraw/zinc/60/75/20/567607520.db2.gz HLDWNPPVQCJNMW-AWEZNQCLSA-N 0 0 381.841 3.237 20 5 GGBDRN NS(=O)(=O)c1ccc(N2CCC[C@@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000596085097 567607891 /nfs/dbraw/zinc/60/78/91/567607891.db2.gz IPBVJHTYMTWQRW-CQSZACIVSA-N 0 0 381.841 3.237 20 5 GGBDRN O=c1[nH]ccc(NC[C@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000596088998 567608262 /nfs/dbraw/zinc/60/82/62/567608262.db2.gz QNMRDUOCYPYRBV-LLVKDONJSA-N 0 0 393.241 3.396 20 5 GGBDRN O=[N+]([O-])c1cc2ccccc2nc1NCCCCn1cc(Br)cn1 ZINC000480496009 567608243 /nfs/dbraw/zinc/60/82/43/567608243.db2.gz RYDBQKGGYMRLKP-UHFFFAOYSA-N 0 0 390.241 3.416 20 5 GGBDRN NS(=O)(=O)c1ccc(N2CCC[C@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000596085096 567608322 /nfs/dbraw/zinc/60/83/22/567608322.db2.gz IPBVJHTYMTWQRW-AWEZNQCLSA-N 0 0 381.841 3.237 20 5 GGBDRN Cc1ccc(C(=O)NC2CCN(c3c(Cl)cncc3[N+](=O)[O-])CC2)s1 ZINC000596104872 567608491 /nfs/dbraw/zinc/60/84/91/567608491.db2.gz YYEACJXSDSZLLY-UHFFFAOYSA-N 0 0 380.857 3.412 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCC2(C(F)F)CC2)c([N+](=O)[O-])c1 ZINC000480502030 567608676 /nfs/dbraw/zinc/60/86/76/567608676.db2.gz VNHYPBAXSJZJTH-UHFFFAOYSA-N 0 0 377.413 3.083 20 5 GGBDRN CC(C)(CNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000596110035 567610108 /nfs/dbraw/zinc/61/01/08/567610108.db2.gz HZPILWWBQASYIW-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN O=c1[nH]ccc(N[C@@H]2CCN(c3ccccc3Br)C2)c1[N+](=O)[O-] ZINC000596123961 567610569 /nfs/dbraw/zinc/61/05/69/567610569.db2.gz UHEMQWYJHVNNIS-SNVBAGLBSA-N 0 0 379.214 3.149 20 5 GGBDRN O=c1[nH]ccc(N[C@@H]2CCN(c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000596112527 567610595 /nfs/dbraw/zinc/61/05/95/567610595.db2.gz RSMIUYSGAHHPLT-LLVKDONJSA-N 0 0 379.214 3.149 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cccc3cc(Br)cnc32)c1[N+](=O)[O-] ZINC000552807781 567610873 /nfs/dbraw/zinc/61/08/73/567610873.db2.gz UXUNNFWYHAOKQA-UHFFFAOYSA-N 0 0 390.197 3.443 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cccc3cc(Br)cnc32)c1[N+](=O)[O-] ZINC000552805692 567610876 /nfs/dbraw/zinc/61/08/76/567610876.db2.gz BGCBHJXURAVOIY-UHFFFAOYSA-N 0 0 390.197 3.200 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCC[C@@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596144936 567612006 /nfs/dbraw/zinc/61/20/06/567612006.db2.gz JDGCWGUXQOWXQS-NXEZZACHSA-N 0 0 377.260 3.125 20 5 GGBDRN CNC(=O)c1cc2cc(Nc3ncc([N+](=O)[O-])cc3Br)ccc2[nH]1 ZINC000480566249 567612376 /nfs/dbraw/zinc/61/23/76/567612376.db2.gz HZVIFUCRCICERC-UHFFFAOYSA-N 0 0 390.197 3.337 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000596153950 567613297 /nfs/dbraw/zinc/61/32/97/567613297.db2.gz CTPYYLDMKVOMKG-ZJUUUORDSA-N 0 0 381.376 3.023 20 5 GGBDRN CNC(=O)c1cc2cc(Nc3ncc(Br)cc3[N+](=O)[O-])ccc2[nH]1 ZINC000480582804 567613921 /nfs/dbraw/zinc/61/39/21/567613921.db2.gz VEPIUCDUMUKPPG-UHFFFAOYSA-N 0 0 390.197 3.337 20 5 GGBDRN CCOC(=O)c1cccc(Sc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c1 ZINC000480582059 567613957 /nfs/dbraw/zinc/61/39/57/567613957.db2.gz CXGNMXNBYWGFCQ-UHFFFAOYSA-N 0 0 381.431 3.326 20 5 GGBDRN O=c1[nH]ccc(N2CCO[C@H](c3ccc(F)c(Br)c3)C2)c1[N+](=O)[O-] ZINC000596197056 567614530 /nfs/dbraw/zinc/61/45/30/567614530.db2.gz QFHSEAYPBSODCR-ZDUSSCGKSA-N 0 0 398.188 3.175 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000530617762 567615274 /nfs/dbraw/zinc/61/52/74/567615274.db2.gz UWTCENHLMDANDR-RYUDHWBXSA-N 0 0 383.857 3.456 20 5 GGBDRN COC(=O)CC1(NC(=O)c2ccc([N+](=O)[O-])cc2Br)CCCCC1 ZINC000530613300 567615345 /nfs/dbraw/zinc/61/53/45/567615345.db2.gz RTXJLTQHTPBQRY-UHFFFAOYSA-N 0 0 399.241 3.353 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1NC1CCN(c2cccnn2)CC1 ZINC000596210183 567615577 /nfs/dbraw/zinc/61/55/77/567615577.db2.gz LLVCFOBSQDPFJY-UHFFFAOYSA-N 0 0 378.230 3.228 20 5 GGBDRN COc1cc(C(=O)Nc2cc(OC)c(Br)cn2)cc([N+](=O)[O-])c1C ZINC000480612340 567616456 /nfs/dbraw/zinc/61/64/56/567616456.db2.gz RCSLXWPSHLVIRB-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN NC(=O)c1cc(N[C@@H](c2cncc(Br)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000596227338 567617609 /nfs/dbraw/zinc/61/76/09/567617609.db2.gz VJFIHHBUJBKLIU-OAHLLOKOSA-N 0 0 391.225 3.414 20 5 GGBDRN NS(=O)(=O)c1ccc(N[C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000596216318 567617731 /nfs/dbraw/zinc/61/77/31/567617731.db2.gz NKSZUEJUVAWCGC-YEORSEQZSA-N 0 0 381.841 3.254 20 5 GGBDRN O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596250526 567618207 /nfs/dbraw/zinc/61/82/07/567618207.db2.gz YXEHAMAKLQZTHU-NWDGAFQWSA-N 0 0 390.237 3.143 20 5 GGBDRN Cn1nccc1[C@@H]1C[C@@H](Nc2c(Br)cccc2[N+](=O)[O-])CCO1 ZINC000596256486 567618473 /nfs/dbraw/zinc/61/84/73/567618473.db2.gz AXZDTJFPYAEOEW-HZMBPMFUSA-N 0 0 381.230 3.423 20 5 GGBDRN COCCN(C[C@H]1CC=CCC1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000480670397 567619511 /nfs/dbraw/zinc/61/95/11/567619511.db2.gz WDWJVCCGJLPIBH-ZDUSSCGKSA-N 0 0 388.873 3.242 20 5 GGBDRN Cc1ccc(C[C@@H](CO)CNc2cc[nH]c(=O)c2[N+](=O)[O-])cc1Br ZINC000596257647 567619962 /nfs/dbraw/zinc/61/99/62/567619962.db2.gz LWOABWLZCCVONA-GFCCVEGCSA-N 0 0 396.241 3.029 20 5 GGBDRN Cc1ccc(C[C@H](CO)CNc2cc[nH]c(=O)c2[N+](=O)[O-])cc1Br ZINC000596257648 567620020 /nfs/dbraw/zinc/62/00/20/567620020.db2.gz LWOABWLZCCVONA-LBPRGKRZSA-N 0 0 396.241 3.029 20 5 GGBDRN CCS(=O)(=O)N(CCc1cccs1)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000596263137 567620100 /nfs/dbraw/zinc/62/01/00/567620100.db2.gz CBCTXSYJSDIOAN-UHFFFAOYSA-N 0 0 390.433 3.329 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(Br)c(F)c2)n1 ZINC000553008585 567620218 /nfs/dbraw/zinc/62/02/18/567620218.db2.gz MWXHJJQDURNSIR-UHFFFAOYSA-N 0 0 384.161 3.290 20 5 GGBDRN O=C1CCCN1[C@@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596273224 567620355 /nfs/dbraw/zinc/62/03/55/567620355.db2.gz GKIQQFULPMHOTM-GFCCVEGCSA-N 0 0 382.258 3.339 20 5 GGBDRN CCN1CCN(c2cc(C)c([N+](=O)[O-])cc2Br)C[C@H]1c1ncc[nH]1 ZINC000480691845 567621228 /nfs/dbraw/zinc/62/12/28/567621228.db2.gz GOXWRYQYKOJNTR-HNNXBMFYSA-N 0 0 394.273 3.272 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(CCC(F)(F)F)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000572208115 567621726 /nfs/dbraw/zinc/62/17/26/567621726.db2.gz OZXGKMWRQFRDDG-UHFFFAOYSA-N 0 0 394.293 3.409 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H]2COc3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000480707919 567622191 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COc1cccc(Cl)c1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000480742398 567626321 /nfs/dbraw/zinc/62/63/21/567626321.db2.gz WTQKRRPRBLVWOQ-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN NC(=O)c1cccc(N2CCc3cccc(Br)c3C2)c1[N+](=O)[O-] ZINC000553100671 567626924 /nfs/dbraw/zinc/62/69/24/567626924.db2.gz SXSSDPAGYSTVIO-UHFFFAOYSA-N 0 0 376.210 3.019 20 5 GGBDRN Cc1ccc(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000530851104 567627238 /nfs/dbraw/zinc/62/72/38/567627238.db2.gz PFHFNHYDZCPOTF-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN O=[N+]([O-])c1ccc(SCCC(F)(F)F)c(S(=O)(=O)N2CCCC2)c1 ZINC000480773179 567630126 /nfs/dbraw/zinc/63/01/26/567630126.db2.gz IKSWTNDCILSFDI-UHFFFAOYSA-N 0 0 384.401 3.424 20 5 GGBDRN Cc1cc(OCC(=O)NC(=O)NCc2cccs2)c(Cl)cc1[N+](=O)[O-] ZINC000506547599 567631054 /nfs/dbraw/zinc/63/10/54/567631054.db2.gz RQWKYGMXIQLSTL-UHFFFAOYSA-N 0 0 383.813 3.023 20 5 GGBDRN CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCCC1(CSC)CC1 ZINC000596419687 567631697 /nfs/dbraw/zinc/63/16/97/567631697.db2.gz 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CS(=O)(=O)NC[C@H]1CCC[C@H]1Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000553590374 567670155 /nfs/dbraw/zinc/67/01/55/567670155.db2.gz ILNRHFFIOMDJEW-LDYMZIIASA-N 0 0 382.269 3.031 20 5 GGBDRN CC(C)[C@](C)(NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccc(Br)cc1 ZINC000481318120 567670595 /nfs/dbraw/zinc/67/05/95/567670595.db2.gz FURGCMFTFVXBHA-INIZCTEOSA-N 0 0 395.257 3.392 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N(C)Cc2ccc(Cl)s2)c([N+](=O)[O-])c1 ZINC000531655950 567671545 /nfs/dbraw/zinc/67/15/45/567671545.db2.gz YECTYSATISHLKT-UHFFFAOYSA-N 0 0 389.886 3.196 20 5 GGBDRN COC(=O)[C@@H](C)N(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CCC1 ZINC000481321572 567671410 /nfs/dbraw/zinc/67/14/10/567671410.db2.gz PTIVRNJYMJXQMH-SNVBAGLBSA-N 0 0 386.857 3.283 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1[C@@H]1CCCOC1 ZINC000572883956 567672192 /nfs/dbraw/zinc/67/21/92/567672192.db2.gz VPQSQRHOTPUAJT-ABAIWWIYSA-N 0 0 383.242 3.389 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CC[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000481336126 567672431 /nfs/dbraw/zinc/67/24/31/567672431.db2.gz GLZSSFIZQGFCLT-SCZZXKLOSA-N 0 0 377.260 3.085 20 5 GGBDRN CN(C)c1ccccc1CN(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000572877447 567672786 /nfs/dbraw/zinc/67/27/86/567672786.db2.gz ZENIREZBOHPMSN-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)sc1C ZINC000481374744 567674580 /nfs/dbraw/zinc/67/45/80/567674580.db2.gz OFGFBYYOOVAKBE-UHFFFAOYSA-N 0 0 383.495 3.499 20 5 GGBDRN Cc1nc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000481368604 567674606 /nfs/dbraw/zinc/67/46/06/567674606.db2.gz HLGLNFSUGGZUKN-UHFFFAOYSA-N 0 0 379.214 3.425 20 5 GGBDRN COC(=O)[C@@H](CNc1ccc([N+](=O)[O-])cc1)Oc1ccc(Br)cc1 ZINC000553684003 567675034 /nfs/dbraw/zinc/67/50/34/567675034.db2.gz BFOMRLAPCPAAEY-OAHLLOKOSA-N 0 0 395.209 3.390 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCC(=O)N[C@H]2C(C)(C)C)ncc1[N+](=O)[O-] ZINC000553670342 567675187 /nfs/dbraw/zinc/67/51/87/567675187.db2.gz CJIOJLSZNBHIPM-NOZJJQNGSA-N 0 0 385.262 3.166 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1nc2ccc(F)cn2n1 ZINC000572991512 567679267 /nfs/dbraw/zinc/67/92/67/567679267.db2.gz HALQLENQRFNJSX-UHFFFAOYSA-N 0 0 394.160 3.100 20 5 GGBDRN Cc1c(CNC(=O)COc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000481463969 567679924 /nfs/dbraw/zinc/67/99/24/567679924.db2.gz GTPIOWYXXZFSQB-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CC2CC2)C2CCC2)c(Br)c1 ZINC000481491714 567681507 /nfs/dbraw/zinc/68/15/07/567681507.db2.gz MFDKXISITZMESW-UHFFFAOYSA-N 0 0 389.271 3.311 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000531828125 567682352 /nfs/dbraw/zinc/68/23/52/567682352.db2.gz NVBIONBQJRTCIR-UHFFFAOYSA-N 0 0 391.225 3.449 20 5 GGBDRN Cc1cc(NCCS(=O)(=O)NC(C)(C)C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000573053747 567683773 /nfs/dbraw/zinc/68/37/73/567683773.db2.gz PGRXWZAQAIOKEN-UHFFFAOYSA-N 0 0 383.392 3.052 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NC1(Cc2ccccc2Br)CC1 ZINC000553785604 567684593 /nfs/dbraw/zinc/68/45/93/567684593.db2.gz GZVCFVXYYSTVOH-UHFFFAOYSA-N 0 0 378.226 3.201 20 5 GGBDRN CC(C)[C@H]1N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC12CCOCC2 ZINC000573073283 567685141 /nfs/dbraw/zinc/68/51/41/567685141.db2.gz HXABVUHFYMDUPA-OAHLLOKOSA-N 0 0 388.873 3.074 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000507551166 567685528 /nfs/dbraw/zinc/68/55/28/567685528.db2.gz ZPKGSRPKVBNABG-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cc(F)c(OC(F)F)cc2F)c1 ZINC000442219473 567686988 /nfs/dbraw/zinc/68/69/88/567686988.db2.gz HGKUWCQNGYRXKQ-UHFFFAOYSA-N 0 0 380.275 3.275 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCc3cc(Cl)ccc32)cc1[N+](=O)[O-] ZINC000507578807 567687479 /nfs/dbraw/zinc/68/74/79/567687479.db2.gz HYTLKJGAEKDDLD-UHFFFAOYSA-N 0 0 386.788 3.147 20 5 GGBDRN COC(=O)c1ccc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)cc1 ZINC000507592546 567689246 /nfs/dbraw/zinc/68/92/46/567689246.db2.gz WHQYFRKESGIXAM-UHFFFAOYSA-N 0 0 381.431 3.077 20 5 GGBDRN CO[C@@H]1[C@H]2C[C@H]3CN(C(=O)c4cc(Br)c(C)c([N+](=O)[O-])c4)[C@H]1[C@H]3C2 ZINC000573118645 567689930 /nfs/dbraw/zinc/68/99/30/567689930.db2.gz SQYDIVRNWVDRLS-UKXMPADASA-N 0 0 395.253 3.161 20 5 GGBDRN O=C(Cc1ccc(F)c(Br)c1)NCCc1ccccc1[N+](=O)[O-] ZINC000460491318 567690305 /nfs/dbraw/zinc/69/03/05/567690305.db2.gz HWNKWQFICMMTGT-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN O=C(COc1ccc(F)cc1Br)NCCc1ccccc1[N+](=O)[O-] ZINC000460501989 567690627 /nfs/dbraw/zinc/69/06/27/567690627.db2.gz HJUNEQQFJPSEQS-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN COc1ccc(C(=O)NCCc2ccccc2[N+](=O)[O-])cc1Br ZINC000460488411 567690769 /nfs/dbraw/zinc/69/07/69/567690769.db2.gz JCKWUKDMTZFRJH-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN COc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1Br ZINC000442328817 567691137 /nfs/dbraw/zinc/69/11/37/567691137.db2.gz UWNDCDLSNNQDAI-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCNS(=O)(=O)c2ccc(C(F)(F)F)s2)cc1 ZINC000573148856 567691205 /nfs/dbraw/zinc/69/12/05/567691205.db2.gz JGEADVSAYJVSCU-UHFFFAOYSA-N 0 0 396.368 3.032 20 5 GGBDRN O=C(Nc1cncc(Br)c1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000573143605 567691269 /nfs/dbraw/zinc/69/12/69/567691269.db2.gz SCGBYACMFXYUIZ-UHFFFAOYSA-N 0 0 393.197 3.179 20 5 GGBDRN Cc1ccc2c(c1)CN(S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000481611920 567691472 /nfs/dbraw/zinc/69/14/72/567691472.db2.gz LRVWEAKPZZPJMG-UHFFFAOYSA-N 0 0 397.250 3.370 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1cccc2cccc(Br)c21 ZINC000573153009 567692524 /nfs/dbraw/zinc/69/25/24/567692524.db2.gz KWDMJGBWDFBKCD-UHFFFAOYSA-N 0 0 389.209 3.137 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](c1cccs1)C(C)(C)CO ZINC000573168872 567693978 /nfs/dbraw/zinc/69/39/78/567693978.db2.gz JNOTVLRVKYRGTN-OAHLLOKOSA-N 0 0 384.479 3.003 20 5 GGBDRN CSC1(CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CCOCC1 ZINC000460637156 567695342 /nfs/dbraw/zinc/69/53/42/567695342.db2.gz RRASUQKWCAMGBK-NSHDSACASA-N 0 0 388.873 3.044 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CCN2S(=O)(=O)c1cccc(Br)c1 ZINC000460640133 567695983 /nfs/dbraw/zinc/69/59/83/567695983.db2.gz ZTIQXVOYQLWMKT-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN Cc1cc(Br)cc([N+](=O)[O-])c1O[C@H]1CCN(CC(F)(F)F)C1=O ZINC000532106628 567697198 /nfs/dbraw/zinc/69/71/98/567697198.db2.gz HOJWVNYFZZVDJV-JTQLQIEISA-N 0 0 397.147 3.208 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NCCCNC(=O)c2cccc(Br)c2)n1 ZINC000481699700 567697440 /nfs/dbraw/zinc/69/74/40/567697440.db2.gz XJGPDRPJLJZEAC-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN CN(Cc1ccc2c(c1)OCCO2)c1ncc(Br)cc1[N+](=O)[O-] ZINC000532137277 567699187 /nfs/dbraw/zinc/69/91/87/567699187.db2.gz DEGZMZOGOVZYHK-UHFFFAOYSA-N 0 0 380.198 3.160 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NCc1nnc(-c2ccc(F)cc2)[nH]1 ZINC000532137905 567700639 /nfs/dbraw/zinc/70/06/39/567700639.db2.gz ULSZSZPZTULNSC-UHFFFAOYSA-N 0 0 393.176 3.289 20 5 GGBDRN C[C@@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)c1ccc(F)c(Br)c1 ZINC000507715491 567701035 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O=[N+]([O-])c1cc(-c2nc(-c3ccc(Br)cn3)no2)cc2c1OCO2 ZINC000460824521 567703702 /nfs/dbraw/zinc/70/37/02/567703702.db2.gz RSIAOIJFLCLAPC-UHFFFAOYSA-N 0 0 391.137 3.198 20 5 GGBDRN COCC1(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)CC1 ZINC000532237693 567704754 /nfs/dbraw/zinc/70/47/54/567704754.db2.gz MUUHWWXVYCLPIJ-UHFFFAOYSA-N 0 0 379.463 3.420 20 5 GGBDRN O=C(N[C@@H](c1ccc(Br)cc1)C1CCC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000507787365 567705254 /nfs/dbraw/zinc/70/52/54/567705254.db2.gz PRYGBGFECNXUMZ-CQSZACIVSA-N 0 0 379.214 3.352 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1nc2ccc(Br)cc2o1 ZINC000460880007 567708320 /nfs/dbraw/zinc/70/83/20/567708320.db2.gz YPWSFJGYIWOZNQ-UHFFFAOYSA-N 0 0 390.149 3.455 20 5 GGBDRN COc1c(Br)cc(Cl)cc1NCc1c([N+](=O)[O-])ncn1C ZINC000532352414 567711691 /nfs/dbraw/zinc/71/16/91/567711691.db2.gz JJTHXEMSRBQHKM-UHFFFAOYSA-N 0 0 375.610 3.365 20 5 GGBDRN O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1c(Cl)cc(Cl)cc1Cl ZINC000507910253 567714881 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Cc1cccc(Cl)c1NS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000461115521 567722410 /nfs/dbraw/zinc/72/24/10/567722410.db2.gz GRNMJBLYXXXCJF-UHFFFAOYSA-N 0 0 384.797 3.129 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCCCc1ccc(Cl)s1 ZINC000573586991 567724668 /nfs/dbraw/zinc/72/46/68/567724668.db2.gz BFARIQGPCRDACC-UHFFFAOYSA-N 0 0 389.886 3.392 20 5 GGBDRN CCN(CCOc1ccc(Br)cc1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000461194078 567725116 /nfs/dbraw/zinc/72/51/16/567725116.db2.gz ITOMGPNUEFJUOY-UHFFFAOYSA-N 0 0 382.214 3.227 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(F)c1Br ZINC000508067203 567725632 /nfs/dbraw/zinc/72/56/32/567725632.db2.gz IDYMGPAZVXUUMU-UHFFFAOYSA-N 0 0 393.172 3.303 20 5 GGBDRN O=C(NCc1n[nH]cc1Br)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000532623162 567726264 /nfs/dbraw/zinc/72/62/64/567726264.db2.gz PQMXMPDMXJNLQL-UHFFFAOYSA-N 0 0 393.119 3.029 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1c(Cl)cccc1Cl ZINC000532626239 567726586 /nfs/dbraw/zinc/72/65/86/567726586.db2.gz ASYBNFIDKINGAK-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN NC(=O)c1ccc(CN2CCCc3cc(Br)ccc32)c([N+](=O)[O-])c1 ZINC000532659951 567728001 /nfs/dbraw/zinc/72/80/01/567728001.db2.gz PBVSSZVCGZRNSZ-UHFFFAOYSA-N 0 0 390.237 3.409 20 5 GGBDRN Cc1c(F)c(Br)ccc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000597942417 567728433 /nfs/dbraw/zinc/72/84/33/567728433.db2.gz XXHJQYRUDJQACK-UHFFFAOYSA-N 0 0 385.193 3.375 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000532680998 567728754 /nfs/dbraw/zinc/72/87/54/567728754.db2.gz ZUKCNCUDLTVXPH-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN CS(=O)(=O)c1ccc(COc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000573703666 567731208 /nfs/dbraw/zinc/73/12/08/567731208.db2.gz OKKNYWUHROYIDO-UHFFFAOYSA-N 0 0 386.223 3.340 20 5 GGBDRN Cn1c(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)ccc1[N+](=O)[O-] ZINC000597995467 567731850 /nfs/dbraw/zinc/73/18/50/567731850.db2.gz QWUBQZDAGSIEHG-UHFFFAOYSA-N 0 0 383.235 3.203 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H](C)c2ccccc2SC)ccc1[N+](=O)[O-] ZINC000443106745 567732529 /nfs/dbraw/zinc/73/25/29/567732529.db2.gz XHKCHZWPVWDPKW-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCCC[C@H]2[C@@H](C)CO)cc1[N+](=O)[O-] ZINC000598018308 567732796 /nfs/dbraw/zinc/73/27/96/567732796.db2.gz GEWPXWVFBXRZIL-HZMBPMFUSA-N 0 0 385.258 3.289 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCCC[C@@H]2[C@H](C)CO)cc1[N+](=O)[O-] ZINC000598018310 567732847 /nfs/dbraw/zinc/73/28/47/567732847.db2.gz GEWPXWVFBXRZIL-QMTHXVAHSA-N 0 0 385.258 3.289 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCCC[C@@H]2[C@@H](C)CO)cc1[N+](=O)[O-] ZINC000598018309 567733000 /nfs/dbraw/zinc/73/30/00/567733000.db2.gz GEWPXWVFBXRZIL-IINYFYTJSA-N 0 0 385.258 3.289 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1ccc2[nH]ccc2c1 ZINC000443105013 567732980 /nfs/dbraw/zinc/73/29/80/567732980.db2.gz UKQMSKYFNHDDGS-UHFFFAOYSA-N 0 0 379.825 3.251 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCCC[C@H]2[C@H](C)CO)cc1[N+](=O)[O-] ZINC000598018311 567733114 /nfs/dbraw/zinc/73/31/14/567733114.db2.gz GEWPXWVFBXRZIL-YGRLFVJLSA-N 0 0 385.258 3.289 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000532763151 567733164 /nfs/dbraw/zinc/73/31/64/567733164.db2.gz ZVBKSKSTUHGVIM-RYUDHWBXSA-N 0 0 393.241 3.490 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000532763139 567733302 /nfs/dbraw/zinc/73/33/02/567733302.db2.gz ZVBKSKSTUHGVIM-NEPJUHHUSA-N 0 0 393.241 3.490 20 5 GGBDRN CCn1cc(Br)cc1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461397669 567733374 /nfs/dbraw/zinc/73/33/74/567733374.db2.gz CAYSQJFZLMBOJH-UHFFFAOYSA-N 0 0 394.225 3.214 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000532763149 567733666 /nfs/dbraw/zinc/73/36/66/567733666.db2.gz ZVBKSKSTUHGVIM-NWDGAFQWSA-N 0 0 393.241 3.490 20 5 GGBDRN O=c1cc(COc2cc(F)cc([N+](=O)[O-])c2)nc2ccc(Br)cn12 ZINC000532768657 567733675 /nfs/dbraw/zinc/73/36/75/567733675.db2.gz XLDBXWAINGMGEW-UHFFFAOYSA-N 0 0 394.156 3.083 20 5 GGBDRN O=C(COc1c2cc(Br)ccc2ncc1[N+](=O)[O-])NCC1CCC1 ZINC000508162951 567734114 /nfs/dbraw/zinc/73/41/14/567734114.db2.gz LKJCAIBMGUZQMN-UHFFFAOYSA-N 0 0 394.225 3.201 20 5 GGBDRN O=C(COc1c2cc(Br)ccc2ncc1[N+](=O)[O-])NC1CCCC1 ZINC000508165992 567734124 /nfs/dbraw/zinc/73/41/24/567734124.db2.gz TVZLSLPXPBKRBW-UHFFFAOYSA-N 0 0 394.225 3.343 20 5 GGBDRN O=C(c1cccc(Br)c1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461399922 567734103 /nfs/dbraw/zinc/73/41/03/567734103.db2.gz LREASKMYHWOJPF-UHFFFAOYSA-N 0 0 377.194 3.392 20 5 GGBDRN O=C(Cc1ccccc1Br)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461400477 567734670 /nfs/dbraw/zinc/73/46/70/567734670.db2.gz VRUQYFROTWYPMR-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN O=C([C@@H]1SCCc2sccc21)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461411478 567735434 /nfs/dbraw/zinc/73/54/34/567735434.db2.gz ZEILVZGSTGKJQG-MRXNPFEDSA-N 0 0 376.459 3.408 20 5 GGBDRN CCOC(=O)C1(CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CCC1 ZINC000532794273 567735898 /nfs/dbraw/zinc/73/58/98/567735898.db2.gz GKKBYLGEJJLWMF-UHFFFAOYSA-N 0 0 399.241 3.129 20 5 GGBDRN O=C(c1ccc(Br)s1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461412455 567735895 /nfs/dbraw/zinc/73/58/95/567735895.db2.gz CHLOOSNMXLBAOD-UHFFFAOYSA-N 0 0 383.223 3.454 20 5 GGBDRN O=C(Nc1ccc2c(=O)cc[nH]c2c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000508205212 567737086 /nfs/dbraw/zinc/73/70/86/567737086.db2.gz KCKAZZBJOKHKLJ-UHFFFAOYSA-N 0 0 388.177 3.451 20 5 GGBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000573815643 567737293 /nfs/dbraw/zinc/73/72/93/567737293.db2.gz BPTFHNKRWJGFDE-SNVBAGLBSA-N 0 0 385.207 3.308 20 5 GGBDRN Cn1c(=O)[nH]c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)cc21 ZINC000443185095 567737792 /nfs/dbraw/zinc/73/77/92/567737792.db2.gz PWRVEFILKMNVOY-UHFFFAOYSA-N 0 0 391.181 3.202 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F ZINC000508222382 567737921 /nfs/dbraw/zinc/73/79/21/567737921.db2.gz JXNNTAFWPWFKHX-UHFFFAOYSA-N 0 0 395.746 3.487 20 5 GGBDRN O=C1N[C@H](c2ccc(Br)cc2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000554663606 567740935 /nfs/dbraw/zinc/74/09/35/567740935.db2.gz HSUYWBGTZALSAJ-CYBMUJFWSA-N 0 0 376.166 3.155 20 5 GGBDRN CCCN(CC(C)(C)O)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000443222995 567741502 /nfs/dbraw/zinc/74/15/02/567741502.db2.gz LKZXTFAANBCYLW-UHFFFAOYSA-N 0 0 385.269 3.073 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(c2ccc(Br)cc2)CC1 ZINC000598150420 567742130 /nfs/dbraw/zinc/74/21/30/567742130.db2.gz CLVSHQKBYPTIMH-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN CC[C@@]1(C)COCCN1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000573885407 567742325 /nfs/dbraw/zinc/74/23/25/567742325.db2.gz SARRGUHGMBBIHF-AWEZNQCLSA-N 0 0 390.221 3.200 20 5 GGBDRN C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCSCC1 ZINC000532922405 567742652 /nfs/dbraw/zinc/74/26/52/567742652.db2.gz RNKBTWUNFHTMMI-LLVKDONJSA-N 0 0 378.479 3.094 20 5 GGBDRN COC(=O)c1cccc(CCNc2ncc([N+](=O)[O-])cc2Br)c1 ZINC000508340859 567743476 /nfs/dbraw/zinc/74/34/76/567743476.db2.gz SMAOYWDUDPTRPV-UHFFFAOYSA-N 0 0 380.198 3.194 20 5 GGBDRN Cc1cc(NCc2ccc(S(N)(=O)=O)s2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461739795 567746541 /nfs/dbraw/zinc/74/65/41/567746541.db2.gz RRURFUKLSFVLAZ-UHFFFAOYSA-N 0 0 395.384 3.243 20 5 GGBDRN CCN(CCCNc1cc(C)c([N+](=O)[O-])cc1C(F)(F)F)S(C)(=O)=O ZINC000461778725 567747188 /nfs/dbraw/zinc/74/71/88/567747188.db2.gz UDQGPLFLZIQXPA-UHFFFAOYSA-N 0 0 383.392 3.006 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@H](O)C(F)(F)F ZINC000554776544 567748870 /nfs/dbraw/zinc/74/88/70/567748870.db2.gz RATBONSONVEXGS-RNCFNFMXSA-N 0 0 398.790 3.255 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3ccc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000573995629 567748942 /nfs/dbraw/zinc/74/89/42/567748942.db2.gz LDUGUEVMQUPJEB-WHOFXGATSA-N 0 0 382.258 3.416 20 5 GGBDRN CCC[C@H](C)N(C)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000508565069 567755009 /nfs/dbraw/zinc/75/50/09/567755009.db2.gz CPWBXDNFUBWYLR-VIFPVBQESA-N 0 0 376.194 3.460 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2ccc3sccc3c2)c([N+](=O)[O-])c1 ZINC000554912266 567755298 /nfs/dbraw/zinc/75/52/98/567755298.db2.gz FXLQFKYDUBLSHB-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN COc1ccc(CNC(=O)c2sc(C(F)(F)F)nc2C)cc1[N+](=O)[O-] ZINC000461926151 567755520 /nfs/dbraw/zinc/75/55/20/567755520.db2.gz CRCUNDTVNCQGLC-UHFFFAOYSA-N 0 0 375.328 3.317 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000554912857 567756114 /nfs/dbraw/zinc/75/61/14/567756114.db2.gz MVYSGEGCOYEPME-GFCCVEGCSA-N 0 0 386.882 3.459 20 5 GGBDRN COC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(Cl)c1 ZINC000574114462 567756336 /nfs/dbraw/zinc/75/63/36/567756336.db2.gz FYAMELCSDZOLHG-AWEZNQCLSA-N 0 0 388.804 3.053 20 5 GGBDRN Cc1cc(N(C)CC(=O)Nc2ccc(Br)cn2)c(F)cc1[N+](=O)[O-] ZINC000461946596 567756837 /nfs/dbraw/zinc/75/68/37/567756837.db2.gz HHZQHGZYNWVKHR-UHFFFAOYSA-N 0 0 397.204 3.275 20 5 GGBDRN Cc1cc(NCCNS(=O)(=O)c2ccc(Cl)s2)c(F)cc1[N+](=O)[O-] ZINC000461971043 567757909 /nfs/dbraw/zinc/75/79/09/567757909.db2.gz HCRSYXXUCMPXCW-UHFFFAOYSA-N 0 0 393.849 3.148 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCOC(C2CC2)(C2CC2)C1 ZINC000598364204 567758379 /nfs/dbraw/zinc/75/83/79/567758379.db2.gz JPVOOTFNMQZSKY-UHFFFAOYSA-N 0 0 395.253 3.389 20 5 GGBDRN C[C@@H](Nc1c([N+](=O)[O-])ncn1C)c1ccc(Br)cc1OCCCO ZINC000462003507 567758541 /nfs/dbraw/zinc/75/85/41/567758541.db2.gz ZADHRYIGLUKKAW-SNVBAGLBSA-N 0 0 399.245 3.025 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCOc3c(F)ccc(F)c32)s1 ZINC000461997206 567758587 /nfs/dbraw/zinc/75/85/87/567758587.db2.gz XWZCVYQIIWXJMD-SECBINFHSA-N 0 0 390.389 3.274 20 5 GGBDRN C[C@H](Nc1c([N+](=O)[O-])ncn1C)c1ccc(Br)cc1OCCCO ZINC000462003506 567758673 /nfs/dbraw/zinc/75/86/73/567758673.db2.gz ZADHRYIGLUKKAW-JTQLQIEISA-N 0 0 399.245 3.025 20 5 GGBDRN O=C(NCc1ccc2c(c1)CCO2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000533219100 567758855 /nfs/dbraw/zinc/75/88/55/567758855.db2.gz LJRCZXMKXSIRCD-UHFFFAOYSA-N 0 0 377.194 3.222 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NCC1=CCCC1 ZINC000598375412 567760165 /nfs/dbraw/zinc/76/01/65/567760165.db2.gz FZIOYNQGEOWRSF-UHFFFAOYSA-N 0 0 386.189 3.348 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccc(Br)o1)CCC2 ZINC000554973197 567761380 /nfs/dbraw/zinc/76/13/80/567761380.db2.gz HMSLUGLWDPVIAN-UHFFFAOYSA-N 0 0 387.211 3.092 20 5 GGBDRN CO[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CCCC1 ZINC000598393489 567762224 /nfs/dbraw/zinc/76/22/24/567762224.db2.gz IPIRYIOPZDTVQL-HNNXBMFYSA-N 0 0 385.258 3.221 20 5 GGBDRN O=C1[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)CCCN1C1CCCCC1 ZINC000443501770 567762875 /nfs/dbraw/zinc/76/28/75/567762875.db2.gz QDHNBFIKXLUADD-AWEZNQCLSA-N 0 0 397.273 3.488 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H](CO)c2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000598400835 567763404 /nfs/dbraw/zinc/76/34/04/567763404.db2.gz YWHNZFJVRMRADM-SNVBAGLBSA-N 0 0 387.223 3.212 20 5 GGBDRN CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1 ZINC000443511050 567764056 /nfs/dbraw/zinc/76/40/56/567764056.db2.gz RQZUAGUYTIGWIZ-SNVBAGLBSA-N 0 0 380.392 3.069 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CC[C@@H]2c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000598422580 567764948 /nfs/dbraw/zinc/76/49/48/567764948.db2.gz FTTQUAPSXSTYOK-GFCCVEGCSA-N 0 0 379.214 3.230 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1I)c1ccccc1 ZINC000508769617 567765469 /nfs/dbraw/zinc/76/54/69/567765469.db2.gz PNNFFVTZJSMKRN-UHFFFAOYSA-N 0 0 382.157 3.476 20 5 GGBDRN Cc1ccc2nc(CNC(=O)c3ccc([N+](=O)[O-])cc3Br)cn2c1 ZINC000574243836 567766910 /nfs/dbraw/zinc/76/69/10/567766910.db2.gz UCJPCOQDZQQVQE-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCCc1nccs1 ZINC000555076235 567767015 /nfs/dbraw/zinc/76/70/15/567767015.db2.gz IOHYKBNVBYELNI-UHFFFAOYSA-N 0 0 384.255 3.105 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCn2c(nnc2C2CCCC2)C1 ZINC000555134255 567770877 /nfs/dbraw/zinc/77/08/77/567770877.db2.gz MLSBFGJWZWUZFL-UHFFFAOYSA-N 0 0 393.245 3.022 20 5 GGBDRN CNC(=O)c1ccc(N(C)CCc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000462094198 567770862 /nfs/dbraw/zinc/77/08/62/567770862.db2.gz UZCUNQLKDQJQIA-UHFFFAOYSA-N 0 0 392.253 3.396 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(SCc2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000555142398 567772135 /nfs/dbraw/zinc/77/21/35/567772135.db2.gz LHZXKUBFOCWZKT-UHFFFAOYSA-N 0 0 388.417 3.416 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H](C)C1 ZINC000443721258 567772348 /nfs/dbraw/zinc/77/23/48/567772348.db2.gz SFVSZMXMEICVFS-QWRGUYRKSA-N 0 0 391.287 3.414 20 5 GGBDRN CCOc1cc(Br)c(F)cc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000555173553 567773253 /nfs/dbraw/zinc/77/32/53/567773253.db2.gz PPQGDVMNLDNZKT-UHFFFAOYSA-N 0 0 386.177 3.486 20 5 GGBDRN CC[C@@H]1CN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)S1(=O)=O ZINC000555209370 567774173 /nfs/dbraw/zinc/77/41/73/567774173.db2.gz UQZMYMSWIBXZCC-GHMZBOCLSA-N 0 0 380.388 3.324 20 5 GGBDRN CC[C@@H]1CN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)S1(=O)=O ZINC000555209373 567774221 /nfs/dbraw/zinc/77/42/21/567774221.db2.gz UQZMYMSWIBXZCC-WDEREUQCSA-N 0 0 380.388 3.324 20 5 GGBDRN Cc1cnn([C@@H]2CCN(c3ccc(I)cc3[N+](=O)[O-])C2)c1 ZINC000555208956 567774250 /nfs/dbraw/zinc/77/42/50/567774250.db2.gz ZPWLKSJPQDYODO-GFCCVEGCSA-N 0 0 398.204 3.156 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)c1ccc(C(F)(F)F)s1)CC2 ZINC000462114096 567774625 /nfs/dbraw/zinc/77/46/25/567774625.db2.gz UTOBAKMKPFNPMI-UHFFFAOYSA-N 0 0 392.380 3.422 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCCCn2ccnc2)cc1[N+](=O)[O-] ZINC000533575291 567776560 /nfs/dbraw/zinc/77/65/60/567776560.db2.gz KXPDYNYYUAYIBV-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN CCn1nc(C)c(CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c1C ZINC000533576674 567777125 /nfs/dbraw/zinc/77/71/25/567777125.db2.gz WIBGIMCITHUIHG-UHFFFAOYSA-N 0 0 395.257 3.429 20 5 GGBDRN Nc1c(F)c(NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000555263236 567777284 /nfs/dbraw/zinc/77/72/84/567777284.db2.gz GCQBATYAQFXDKQ-UHFFFAOYSA-N 0 0 387.820 3.245 20 5 GGBDRN O=[N+]([O-])c1c(Sc2ccccc2Br)ncnc1N1CCOCC1 ZINC000598585959 567778042 /nfs/dbraw/zinc/77/80/42/567778042.db2.gz MNEJIQZDWYHGRE-UHFFFAOYSA-N 0 0 397.254 3.135 20 5 GGBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000555289248 567778339 /nfs/dbraw/zinc/77/83/39/567778339.db2.gz LPMHTBYLKDARCW-GFCCVEGCSA-N 0 0 383.177 3.197 20 5 GGBDRN Cc1csc([C@H](NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)C2CC2)n1 ZINC000598612403 567778650 /nfs/dbraw/zinc/77/86/50/567778650.db2.gz OJXYVCNXVKCPKG-CQSZACIVSA-N 0 0 381.479 3.406 20 5 GGBDRN CC(C)CN(Cc1cccc(Cl)c1)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000598625134 567780056 /nfs/dbraw/zinc/78/00/56/567780056.db2.gz LHOJGWMPXMUZKL-UHFFFAOYSA-N 0 0 383.857 3.490 20 5 GGBDRN CCc1n[nH]c(C(=O)NC(C)(C)c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000443936713 567780554 /nfs/dbraw/zinc/78/05/54/567780554.db2.gz LHMGOABIBBJMPG-UHFFFAOYSA-N 0 0 381.230 3.308 20 5 GGBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCCN(CC(F)(F)F)C2)c(Br)c1 ZINC000574483884 567780640 /nfs/dbraw/zinc/78/06/40/567780640.db2.gz AWNHWLINEDLCQG-MRVPVSSYSA-N 0 0 383.168 3.191 20 5 GGBDRN Cc1c(Br)c(NCc2ccc3c(n2)CCCC3)ncc1[N+](=O)[O-] ZINC000443946953 567781468 /nfs/dbraw/zinc/78/14/68/567781468.db2.gz NBUZNSSOZWHISB-UHFFFAOYSA-N 0 0 377.242 3.369 20 5 GGBDRN O=[N+]([O-])c1cccc(CN2c3ccc(Br)cc3CS2(=O)=O)c1 ZINC000555407842 567782225 /nfs/dbraw/zinc/78/22/25/567782225.db2.gz QHQCLNJDNQCMHH-UHFFFAOYSA-N 0 0 383.223 3.207 20 5 GGBDRN COc1cc(CCNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)ccc1Cl ZINC000555431097 567784225 /nfs/dbraw/zinc/78/42/25/567784225.db2.gz IYQQPVIEOWYCLP-UHFFFAOYSA-N 0 0 390.870 3.148 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OC[C@H](O)COc2ccc(Br)cc2)c1 ZINC000533708729 567784513 /nfs/dbraw/zinc/78/45/13/567784513.db2.gz YZTCNRPSPJRCRF-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN COCCO[C@H]1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C1 ZINC000443989337 567784967 /nfs/dbraw/zinc/78/49/67/567784967.db2.gz OKNJIKGDAUPCKP-LBPRGKRZSA-N 0 0 396.241 3.147 20 5 GGBDRN CCS(=O)(=O)N(Cc1ncc(Cl)s1)c1ccc([N+](=O)[O-])cc1C ZINC000598730192 567787116 /nfs/dbraw/zinc/78/71/16/567787116.db2.gz LKJGWJQSTCQCSO-UHFFFAOYSA-N 0 0 375.859 3.369 20 5 GGBDRN C[S@](=O)[C@@H]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000598754074 567787929 /nfs/dbraw/zinc/78/79/29/567787929.db2.gz NSHAOUAKHALPIC-MEYYNSMWSA-N 0 0 378.372 3.033 20 5 GGBDRN O=C(N[C@@H](CCO)C1CCCCC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000533836152 567789970 /nfs/dbraw/zinc/78/99/70/567789970.db2.gz YDUWJYREJFRUOP-HNNXBMFYSA-N 0 0 385.258 3.418 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(OC[C@H](O)COc2cccc(Br)c2)c1 ZINC000555582048 567790242 /nfs/dbraw/zinc/79/02/42/567790242.db2.gz ZKRPALXXRAAGNW-CYBMUJFWSA-N 0 0 386.173 3.315 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cc2c(cc1Cl)OCO2 ZINC000533893789 567791968 /nfs/dbraw/zinc/79/19/68/567791968.db2.gz MQEULWPHAGWHTC-UHFFFAOYSA-N 0 0 384.797 3.340 20 5 GGBDRN O=C(CN1CC[C@H](CC2CC2)C1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000555696639 567795712 /nfs/dbraw/zinc/79/57/12/567795712.db2.gz JUBZZKDUBCTLDL-GFCCVEGCSA-N 0 0 382.258 3.418 20 5 GGBDRN O=c1[nH]c(NCc2cc(F)ccc2Br)nc2ccc([N+](=O)[O-])cc12 ZINC000574780683 567797639 /nfs/dbraw/zinc/79/76/39/567797639.db2.gz REUCJZCNXYTQMH-UHFFFAOYSA-N 0 0 393.172 3.179 20 5 GGBDRN CC(C)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000444276075 567800372 /nfs/dbraw/zinc/80/03/72/567800372.db2.gz LJGSZSJHMIHOQS-NSHDSACASA-N 0 0 391.287 3.414 20 5 GGBDRN COc1cccc(C(=O)N=c2cc(-c3ccc(Cl)s3)[nH][nH]2)c1[N+](=O)[O-] ZINC000444324705 567801772 /nfs/dbraw/zinc/80/17/72/567801772.db2.gz DLFWMTVZDOLTQI-UHFFFAOYSA-N 0 0 378.797 3.383 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCc3c(Br)cccc3[C@@H]2C)c1[N+](=O)[O-] ZINC000444338804 567801792 /nfs/dbraw/zinc/80/17/92/567801792.db2.gz GAYKLFFCEYGVQN-VIFPVBQESA-N 0 0 393.241 3.402 20 5 GGBDRN COC(=O)CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccs1 ZINC000534215047 567802867 /nfs/dbraw/zinc/80/28/67/567802867.db2.gz SWNIJDBMCSFUSQ-UHFFFAOYSA-N 0 0 380.447 3.242 20 5 GGBDRN Cc1c(Br)cccc1CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O ZINC000534199871 567803064 /nfs/dbraw/zinc/80/30/64/567803064.db2.gz ZOUXUJBEZCOFCD-UHFFFAOYSA-N 0 0 375.178 3.462 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccncc1Br ZINC000534237764 567803754 /nfs/dbraw/zinc/80/37/54/567803754.db2.gz YWVFTBCHALMMEX-VIFPVBQESA-N 0 0 382.239 3.294 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCOCC12CCCC2 ZINC000534233454 567804081 /nfs/dbraw/zinc/80/40/81/567804081.db2.gz GVNDKTLOXDTPHT-UHFFFAOYSA-N 0 0 383.242 3.071 20 5 GGBDRN O=C(Nc1ccncc1Br)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000534237225 567804401 /nfs/dbraw/zinc/80/44/01/567804401.db2.gz BYGKOBNYYUAGHF-UHFFFAOYSA-N 0 0 391.225 3.027 20 5 GGBDRN CCN(c1ccc(Br)cn1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000574942863 567805515 /nfs/dbraw/zinc/80/55/15/567805515.db2.gz QCRKUEAWGXOJNS-UHFFFAOYSA-N 0 0 392.256 3.029 20 5 GGBDRN Cn1cc([C@@H]2CN(c3ncc(Br)cc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000599107822 567805711 /nfs/dbraw/zinc/80/57/11/567805711.db2.gz MJPPPJIUSPRVFR-LBPRGKRZSA-N 0 0 380.246 3.116 20 5 GGBDRN Cn1cc([C@@H]2C[C@H](Nc3c(Br)cccc3[N+](=O)[O-])CCO2)cn1 ZINC000599106329 567805828 /nfs/dbraw/zinc/80/58/28/567805828.db2.gz FLWZTWGKOAOCPQ-RISCZKNCSA-N 0 0 381.230 3.423 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)NC(C)(C)C2CC2)cc1[N+](=O)[O-] ZINC000534286896 567806379 /nfs/dbraw/zinc/80/63/79/567806379.db2.gz QRAIKDATYGSCLO-UHFFFAOYSA-N 0 0 377.260 3.133 20 5 GGBDRN Cc1noc(C2CCN(C(=O)c3c(Br)cccc3[N+](=O)[O-])CC2)n1 ZINC000599128655 567806927 /nfs/dbraw/zinc/80/69/27/567806927.db2.gz UPBKTPNPVFMOTN-UHFFFAOYSA-N 0 0 395.213 3.069 20 5 GGBDRN O=[N+]([O-])c1cncc(I)c1N1CCCC(F)(F)CC1 ZINC000599135652 567807224 /nfs/dbraw/zinc/80/72/24/567807224.db2.gz REEOLBHSDLHZDR-UHFFFAOYSA-N 0 0 383.136 3.220 20 5 GGBDRN CCOC[C@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CCO1 ZINC000599158005 567807589 /nfs/dbraw/zinc/80/75/89/567807589.db2.gz IQOGHLRPMSLSOI-GFCCVEGCSA-N 0 0 396.241 3.147 20 5 GGBDRN CCOC[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CCO1 ZINC000599158010 567807638 /nfs/dbraw/zinc/80/76/38/567807638.db2.gz IQOGHLRPMSLSOI-LBPRGKRZSA-N 0 0 396.241 3.147 20 5 GGBDRN CCCOc1ncccc1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599167316 567808502 /nfs/dbraw/zinc/80/85/02/567808502.db2.gz ZFQZJYHYRPFJIE-UHFFFAOYSA-N 0 0 394.225 3.471 20 5 GGBDRN O=C(c1cn2ccc(Br)cc2n1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000575033613 567809631 /nfs/dbraw/zinc/80/96/31/567809631.db2.gz YLCUDAYBUNMXFP-UHFFFAOYSA-N 0 0 387.193 3.208 20 5 GGBDRN CC(C)[C@H]1CCCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000575030326 567809816 /nfs/dbraw/zinc/80/98/16/567809816.db2.gz UJWLYZYMPYJULD-NSHDSACASA-N 0 0 398.257 3.190 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCCc2ccc(Cl)cc21 ZINC000599201422 567810065 /nfs/dbraw/zinc/81/00/65/567810065.db2.gz DABIVTJAIZYQKD-CQSZACIVSA-N 0 0 381.841 3.385 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OCc1cc(=O)n2cc(Br)ccc2n1 ZINC000534399524 567810020 /nfs/dbraw/zinc/81/00/20/567810020.db2.gz ONCWQUPESDMLTQ-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN NS(=O)(=O)c1cccc(N[C@@H]2CCCc3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000599204063 567810129 /nfs/dbraw/zinc/81/01/29/567810129.db2.gz ZYUQYKRCDXOXQT-CYBMUJFWSA-N 0 0 381.841 3.385 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NCC[C@@H](O)COCc1ccccc1 ZINC000599197958 567810187 /nfs/dbraw/zinc/81/01/87/567810187.db2.gz DVRLUUAGEVDBHC-CQSZACIVSA-N 0 0 396.241 3.132 20 5 GGBDRN Cc1ncc(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(Cl)c1Cl ZINC000444648959 567810717 /nfs/dbraw/zinc/81/07/17/567810717.db2.gz ZDBAPLXCDGIGMX-UHFFFAOYSA-N 0 0 380.191 3.411 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC(n2ccnc2)CC1 ZINC000599226594 567810871 /nfs/dbraw/zinc/81/08/71/567810871.db2.gz DZZXBYGEJUHXNH-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(C[S@@](C)=O)cc2)c1 ZINC000575080967 567812478 /nfs/dbraw/zinc/81/24/78/567812478.db2.gz FJCGKDMIYOQKQU-RUZDIDTESA-N 0 0 378.475 3.125 20 5 GGBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc([S@@](C)=O)cc1 ZINC000534457212 567812483 /nfs/dbraw/zinc/81/24/83/567812483.db2.gz IPFPPMKNELIGQZ-SSINHNECSA-N 0 0 380.853 3.406 20 5 GGBDRN CCOc1ccc(F)c(NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c1F ZINC000534618286 567815445 /nfs/dbraw/zinc/81/54/45/567815445.db2.gz CGUZISLCWYLICV-UHFFFAOYSA-N 0 0 376.312 3.212 20 5 GGBDRN CN(Cc1ccc2ccccc2c1)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000012817248 570231212 /nfs/dbraw/zinc/23/12/12/570231212.db2.gz WDFYGSDDQOTHKC-UHFFFAOYSA-N 0 0 377.400 3.136 20 5 GGBDRN O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)c1cccc([N+](=O)[O-])c1 ZINC000012879294 570276433 /nfs/dbraw/zinc/27/64/33/570276433.db2.gz PZNSNUYBWLFURS-UHFFFAOYSA-N 0 0 384.417 3.293 20 5 GGBDRN CNc1snc(C)c1C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000014242533 570303577 /nfs/dbraw/zinc/30/35/77/570303577.db2.gz VKNLFMGNJZFROO-QMMMGPOBSA-N 0 0 398.828 3.239 20 5 GGBDRN Cc1cc(NC(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)on1 ZINC000121035850 570400815 /nfs/dbraw/zinc/40/08/15/570400815.db2.gz AQWXFKLGPGIPRB-UHFFFAOYSA-N 0 0 380.429 3.114 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC[C@@H](C(F)(F)F)C1 ZINC000016591614 570452459 /nfs/dbraw/zinc/45/24/59/570452459.db2.gz FXAMDOVJVBRSEN-GHMZBOCLSA-N 0 0 375.347 3.205 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC[C@@H](C(F)(F)F)C1 ZINC000016591615 570452500 /nfs/dbraw/zinc/45/25/00/570452500.db2.gz FXAMDOVJVBRSEN-WDEREUQCSA-N 0 0 375.347 3.205 20 5 GGBDRN O=c1c2c3c(sc2ncn1C[C@H](O)c1cccc([N+](=O)[O-])c1)CCCCC3 ZINC000134596809 570469676 /nfs/dbraw/zinc/46/96/76/570469676.db2.gz PKKJDFSSYRKWIG-HNNXBMFYSA-N 0 0 385.445 3.369 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCc2ccc(F)cc2)c(S(=O)(=O)N2CCCC2)c1 ZINC000033014498 570629684 /nfs/dbraw/zinc/62/96/84/570629684.db2.gz HXSUXOLHVRHCPS-UHFFFAOYSA-N 0 0 393.440 3.173 20 5 GGBDRN C[C@H](OC(=O)c1c(F)cc(N)cc1F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072312510 570648629 /nfs/dbraw/zinc/64/86/29/570648629.db2.gz KZOCFNOIISXZCQ-QMMMGPOBSA-N 0 0 390.302 3.423 20 5 GGBDRN Cc1cc(=O)c(C(=O)NCCC2=CCCCC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000017335125 570704480 /nfs/dbraw/zinc/70/44/80/570704480.db2.gz WDVUHQVQZWDJME-UHFFFAOYSA-N 0 0 382.420 3.069 20 5 GGBDRN O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000025325841 570747358 /nfs/dbraw/zinc/74/73/58/570747358.db2.gz AHLUVCHTHNOLTQ-HNNXBMFYSA-N 0 0 395.868 3.113 20 5 GGBDRN CCN(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)c1ccccc1 ZINC000032721982 570768284 /nfs/dbraw/zinc/76/82/84/570768284.db2.gz UPMYLCWPXYUDPY-UHFFFAOYSA-N 0 0 378.388 3.116 20 5 GGBDRN Cc1ccccc1-c1noc(COC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)n1 ZINC000032724225 570768839 /nfs/dbraw/zinc/76/88/39/570768839.db2.gz XEWTZSUXBZAIRF-UHFFFAOYSA-N 0 0 383.316 3.039 20 5 GGBDRN O=c1c2c3c(sc2ncn1C[C@@H](O)c1cccc([N+](=O)[O-])c1)CCCCC3 ZINC000134596790 570792607 /nfs/dbraw/zinc/79/26/07/570792607.db2.gz PKKJDFSSYRKWIG-OAHLLOKOSA-N 0 0 385.445 3.369 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@H]1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000126463418 570800510 /nfs/dbraw/zinc/80/05/10/570800510.db2.gz UXQXPSYNGVHNMF-RPVQJOFSSA-N 0 0 397.406 3.068 20 5 GGBDRN COc1cc(CCNC(=O)c2cc(C)n(C3CC3)c2C)c([N+](=O)[O-])cc1OC ZINC000032788486 570810325 /nfs/dbraw/zinc/81/03/25/570810325.db2.gz JLWLUKNGQIJNRF-UHFFFAOYSA-N 0 0 387.436 3.338 20 5 GGBDRN COc1cc(CCNC(=O)N[C@H]2CCCc3occc32)c([N+](=O)[O-])cc1OC ZINC000032803518 570821911 /nfs/dbraw/zinc/82/19/11/570821911.db2.gz RFGDKKDXBMRJAT-AWEZNQCLSA-N 0 0 389.408 3.124 20 5 GGBDRN CNc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(OC(F)F)c(OC)c1 ZINC000012534595 570835157 /nfs/dbraw/zinc/83/51/57/570835157.db2.gz XPGLOGYGZAQYEO-UHFFFAOYSA-N 0 0 381.335 3.177 20 5 GGBDRN CCNc1ccc(C(=O)N[C@@H](c2nccn2C)c2ccccc2)cc1[N+](=O)[O-] ZINC000032830645 570844699 /nfs/dbraw/zinc/84/46/99/570844699.db2.gz SKLGJCZVDZHHDV-GOSISDBHSA-N 0 0 379.420 3.280 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CCC3)cc1OC ZINC000032854550 570854825 /nfs/dbraw/zinc/85/48/25/570854825.db2.gz ZXEZTWJULQFXFT-UHFFFAOYSA-N 0 0 386.404 3.370 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-n3cccn3)cc2)cc1OC ZINC000024571568 570900476 /nfs/dbraw/zinc/90/04/76/570900476.db2.gz NUMYXHMDIXLNTJ-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN CC(=O)N1CCc2cc(C(=O)[C@@H](C)OC(=O)c3cccc([N+](=O)[O-])c3C)ccc21 ZINC000016750543 570908613 /nfs/dbraw/zinc/90/86/13/570908613.db2.gz XINDLSQSTDTKJB-CYBMUJFWSA-N 0 0 396.399 3.240 20 5 GGBDRN CC(=O)N1CCc2cc(C(=O)[C@H](C)OC(=O)c3ccc([N+](=O)[O-])c(C)c3)ccc21 ZINC000016745987 570908746 /nfs/dbraw/zinc/90/87/46/570908746.db2.gz XOHGXRNAESTBPW-ZDUSSCGKSA-N 0 0 396.399 3.240 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(C)CCOc2ccccc2C)cc([N+](=O)[O-])c1 ZINC000016147492 570914958 /nfs/dbraw/zinc/91/49/58/570914958.db2.gz FBRBEJPBFWQRHQ-UHFFFAOYSA-N 0 0 386.404 3.231 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(C)CCOc2cccc(C)c2)cc([N+](=O)[O-])c1 ZINC000016148369 570915088 /nfs/dbraw/zinc/91/50/88/570915088.db2.gz BOQSFZWGZSWVKO-UHFFFAOYSA-N 0 0 386.404 3.231 20 5 GGBDRN Cc1cc([C@H]2CCCN2C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)on1 ZINC000047287800 570951125 /nfs/dbraw/zinc/95/11/25/570951125.db2.gz YWICENPFVIZZHU-GOSISDBHSA-N 0 0 384.436 3.471 20 5 GGBDRN Cc1cn(-c2cccc([N+](=O)[O-])c2)c(=O)n1CC(=O)N(c1ccccc1)C(C)C ZINC000252490508 570971115 /nfs/dbraw/zinc/97/11/15/570971115.db2.gz KVPASAVPLAXGOM-UHFFFAOYSA-N 0 0 394.431 3.297 20 5 GGBDRN Cc1cc(C(=O)Nc2nc(CN3C[C@@H](C)O[C@H](C)C3)cs2)ccc1[N+](=O)[O-] ZINC000012730062 570973177 /nfs/dbraw/zinc/97/31/77/570973177.db2.gz DOIPHRKTUJKUCS-CHWSQXEVSA-N 0 0 390.465 3.221 20 5 GGBDRN CC(C)c1noc(CN2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 ZINC000012733270 570976752 /nfs/dbraw/zinc/97/67/52/570976752.db2.gz MZZVXJKNZBPBPN-UHFFFAOYSA-N 0 0 399.373 3.442 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H]1CCCOc2ccc(F)cc21 ZINC000084350770 571014187 /nfs/dbraw/zinc/01/41/87/571014187.db2.gz SXTDPYBDOQYTIQ-HNNXBMFYSA-N 0 0 378.331 3.282 20 5 GGBDRN CCOc1ccc(-c2nn[nH]n2)cc1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000736634313 598830716 /nfs/dbraw/zinc/83/07/16/598830716.db2.gz GKJNVNQNMVPWDO-UHFFFAOYSA-N 0 0 396.407 3.090 20 5 GGBDRN Cc1nn(C)c(Nc2cccc(Oc3ccc(-c4nn[nH]n4)cc3)c2)c1[N+](=O)[O-] ZINC000737510639 598941869 /nfs/dbraw/zinc/94/18/69/598941869.db2.gz JAMXBCASKMHMNV-UHFFFAOYSA-N 0 0 392.379 3.353 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NCc1nc(-c2ccc(Cl)cc2)no1 ZINC000738357889 599059272 /nfs/dbraw/zinc/05/92/72/599059272.db2.gz IODBJPABBWSIFJ-UHFFFAOYSA-N 0 0 398.770 3.090 20 5 GGBDRN O=[N+]([O-])c1cnc(Nc2ccc(OC3CCCC3)c(F)c2)c(-c2nn[nH]n2)c1 ZINC000823651484 599066983 /nfs/dbraw/zinc/06/69/83/599066983.db2.gz LSNDNLDIGQKILZ-UHFFFAOYSA-N 0 0 385.359 3.374 20 5 GGBDRN O=[N+]([O-])c1ccc(Nc2cnn(Cc3ccc(Cl)cc3)c2)c(-c2nn[nH]n2)c1 ZINC000823645581 599088891 /nfs/dbraw/zinc/08/88/91/599088891.db2.gz UFWSTCYOOZLZTH-UHFFFAOYSA-N 0 0 396.798 3.417 20 5 GGBDRN CC(C)(C)OC(=O)Cc1cccc(Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])c1 ZINC000819928682 599094539 /nfs/dbraw/zinc/09/45/39/599094539.db2.gz UWFJVVAXBXTLGL-UHFFFAOYSA-N 0 0 396.407 3.403 20 5 GGBDRN O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000463301166 599131832 /nfs/dbraw/zinc/13/18/32/599131832.db2.gz OLFDEKNAFKGEGU-UHFFFAOYSA-N 0 0 378.270 3.046 20 5 GGBDRN C[C@@H](NC(=O)Nc1cc(-c2nn[nH]n2)cn1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000736115263 598279259 /nfs/dbraw/zinc/27/92/59/598279259.db2.gz GSSGSQOBRAOYOG-LLVKDONJSA-N 0 0 398.427 3.214 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCc2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000735647935 598304705 /nfs/dbraw/zinc/30/47/05/598304705.db2.gz HYMSLBWSPJMZGT-UHFFFAOYSA-N 0 0 398.398 3.142 20 5 GGBDRN O=C(NCc1ccc(-c2nn[nH]n2)cc1F)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000738101559 598305612 /nfs/dbraw/zinc/30/56/12/598305612.db2.gz IKNGGYZDNTYHKD-UHFFFAOYSA-N 0 0 398.379 3.059 20 5 GGBDRN COc1cc(-c2nn[nH]n2)ccc1Oc1ccc(Br)cc1[N+](=O)[O-] ZINC000737032394 598367609 /nfs/dbraw/zinc/36/76/09/598367609.db2.gz LVPMGKTXRFIMAA-UHFFFAOYSA-N 0 0 392.169 3.338 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccnc(N3CCCCCC3)c2)c(-c2nn[nH]n2)c1 ZINC000738368973 598428038 /nfs/dbraw/zinc/42/80/38/598428038.db2.gz GSMNLMUUYWFFIC-UHFFFAOYSA-N 0 0 394.439 3.162 20 5 GGBDRN O=C(OCc1nc2ccccc2c2ccccc12)c1ccc(-c2nn[nH]n2)cn1 ZINC000738245843 598478995 /nfs/dbraw/zinc/47/89/95/598478995.db2.gz YDKVGKFIVSRCHO-UHFFFAOYSA-N 0 0 382.383 3.320 20 5 GGBDRN CCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000736505383 598568282 /nfs/dbraw/zinc/56/82/82/598568282.db2.gz HRRAMUBPXGEQRF-LLVKDONJSA-N 0 0 384.371 3.137 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCCOc1cccc(-c2nn[nH]n2)c1 ZINC000737373259 598648259 /nfs/dbraw/zinc/64/82/59/598648259.db2.gz RLENOPZWBZJUES-UHFFFAOYSA-N 0 0 396.407 3.271 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c(-c2nn[nH]n2)c1 ZINC000738368907 598678796 /nfs/dbraw/zinc/67/87/96/598678796.db2.gz FMSJRFHXUWXWPZ-CQSZACIVSA-N 0 0 395.206 3.227 20 5 GGBDRN CCN(C(=O)c1cc(SC)ccc1[N+](=O)[O-])c1ccc(-c2nn[nH]n2)cc1 ZINC000736505748 599308803 /nfs/dbraw/zinc/30/88/03/599308803.db2.gz MEFRFZMXMDBSKY-UHFFFAOYSA-N 0 0 384.421 3.164 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N(Cc1ccc(-c2nn[nH]n2)cc1)C1CC1 ZINC000738248163 599373285 /nfs/dbraw/zinc/37/32/85/599373285.db2.gz XDYJKWJECCSLLV-UHFFFAOYSA-N 0 0 398.810 3.233 20 5 GGBDRN O=C(OCc1cn2ccccc2c1-c1nn[nH]n1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000738235835 599500609 /nfs/dbraw/zinc/50/06/09/599500609.db2.gz XHDKFCIWTDRHDC-UHFFFAOYSA-N 0 0 398.766 3.038 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2cccc(-c3nn[nH]n3)c2)c(Br)c1 ZINC000738367000 599523426 /nfs/dbraw/zinc/52/34/26/599523426.db2.gz MUIVOINNJXKXJM-UHFFFAOYSA-N 0 0 376.170 3.116 20 5 GGBDRN C[C@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)c1cccc(-c2nn[nH]n2)c1 ZINC000820557009 599526771 /nfs/dbraw/zinc/52/67/71/599526771.db2.gz XELHJCUJPHJCOF-RYUDHWBXSA-N 0 0 398.448 3.133 20 5 GGBDRN CC(C)c1cc(CNc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)on1 ZINC000820187802 599557042 /nfs/dbraw/zinc/55/70/42/599557042.db2.gz SSVJLUVCZCZWLL-UHFFFAOYSA-N 0 0 380.368 3.047 20 5 GGBDRN O=[N+]([O-])c1ccc(CCCCNc2c(-c3nn[nH]n3)cnc3ccccc32)cc1 ZINC000823635492 599567548 /nfs/dbraw/zinc/56/75/48/599567548.db2.gz YAPDBQDZVPWZEJ-UHFFFAOYSA-N 0 0 389.419 3.180 20 5 GGBDRN CC[C@H](Nc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1)c1ccncc1 ZINC000820925121 599573704 /nfs/dbraw/zinc/57/37/04/599573704.db2.gz DRBJSMBKJCZANC-HNNXBMFYSA-N 0 0 376.380 3.281 20 5 GGBDRN O=C(OCc1ccc(-c2nn[nH]n2)cc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000823417857 599623538 /nfs/dbraw/zinc/62/35/38/599623538.db2.gz KQJQAFGLXOTZTO-UHFFFAOYSA-N 0 0 393.281 3.151 20 5 GGBDRN O=C(Nc1ccc(-c2nn[nH]n2)cc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000463613953 599627532 /nfs/dbraw/zinc/62/75/32/599627532.db2.gz MOECKOZYFRDKSN-UHFFFAOYSA-N 0 0 378.270 3.046 20 5 GGBDRN O=C(Nc1ccc(-c2nn[nH]n2)c(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000823303381 599635040 /nfs/dbraw/zinc/63/50/40/599635040.db2.gz HHBSGDZCZFUYCK-UHFFFAOYSA-N 0 0 378.270 3.046 20 5 GGBDRN O=C([O-])c1cc(C(=O)N[C@H](C[NH+]2CCCCC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000738672060 599742358 /nfs/dbraw/zinc/74/23/58/599742358.db2.gz BTVOYCLVNFOZPO-LJQANCHMSA-N 0 0 397.431 3.250 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[nH]n3)c2)cc1[N+](=O)[O-] ZINC000822227488 607399398 /nfs/dbraw/zinc/39/93/98/607399398.db2.gz KYPAUVMNMWPGMA-UHFFFAOYSA-N 0 0 382.380 3.123 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(OC(C)C)c(-c3nn[nH]n3)c2)c1[N+](=O)[O-] ZINC000822284756 607407800 /nfs/dbraw/zinc/40/78/00/607407800.db2.gz YWGABSKKWKCGFS-UHFFFAOYSA-N 0 0 382.380 3.123 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+](C)C[C@H](C)C(=O)[O-])c([N+](=O)[O-])c1 ZINC000263376160 600373794 /nfs/dbraw/zinc/37/37/94/600373794.db2.gz WPZIKNBXOVTVIR-KBXCAEBGSA-N 0 0 385.420 3.236 20 5 GGBDRN C[C@H](C[N@@H+](Cc1ccccc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)[O-] ZINC000736585054 600685734 /nfs/dbraw/zinc/68/57/34/600685734.db2.gz RQMRUAOJGIPCRI-OAHLLOKOSA-N 0 0 395.419 3.034 20 5 GGBDRN O=[N+]([O-])c1ccc(SCc2ccc(-c3nn[nH]n3)cc2OC(F)F)nc1 ZINC000823644746 607466891 /nfs/dbraw/zinc/46/68/91/607466891.db2.gz LLODYGCRZLFBGJ-UHFFFAOYSA-N 0 0 380.336 3.064 20 5 GGBDRN C[C@@H]1C[C@@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000828184380 600817940 /nfs/dbraw/zinc/81/79/40/600817940.db2.gz PSGYVAKVYMQSLO-HIFRSBDPSA-N 0 0 397.431 3.419 20 5 GGBDRN C[C@H]1C[C@@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000828184382 600818144 /nfs/dbraw/zinc/81/81/44/600818144.db2.gz PSGYVAKVYMQSLO-ZFWWWQNUSA-N 0 0 397.431 3.419 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000828284833 600961714 /nfs/dbraw/zinc/96/17/14/600961714.db2.gz ILVZTYNORNSXBE-OAHLLOKOSA-N 0 0 397.431 3.030 20 5 GGBDRN C[C@H]1CC[N@H+](Cc2ccccc2)CCN1C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC000828296001 601108720 /nfs/dbraw/zinc/10/87/20/601108720.db2.gz ROIRKPIJOLIETQ-HNNXBMFYSA-N 0 0 397.431 3.030 20 5 GGBDRN C[C@@H](C(=O)[O-])[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000826055034 601201814 /nfs/dbraw/zinc/20/18/14/601201814.db2.gz UTMYSOAKOKAAHV-PIGZYNQJSA-N 0 0 391.811 3.238 20 5 GGBDRN CCCC[N@H+](C)CC1CCN(c2c(C(=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000829381129 601250166 /nfs/dbraw/zinc/25/01/66/601250166.db2.gz KNUMIAPCRVIZOQ-UHFFFAOYSA-N 0 0 394.428 3.150 20 5 GGBDRN O=C([O-])[C@H]1C[C@H](C2CCCCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000833180396 601431702 /nfs/dbraw/zinc/43/17/02/601431702.db2.gz UROWGDDACCKZNM-KBXCAEBGSA-N 0 0 390.436 3.317 20 5 GGBDRN O=C([O-])CC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCOCC1 ZINC000833206511 601561384 /nfs/dbraw/zinc/56/13/84/601561384.db2.gz SMWHOCQKMMKILW-UHFFFAOYSA-N 0 0 376.434 3.437 20 5 GGBDRN O=C(C=Cc1cccc(F)c1)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000826401025 607525384 /nfs/dbraw/zinc/52/53/84/607525384.db2.gz NGSRZKCFSKQGOW-SNAWJCMRSA-N 0 0 388.746 3.219 20 5 GGBDRN Cc1nccn1-c1ccc(CNc2cc(Cl)c(C(=O)[O-])cc2[N+](=O)[O-])cn1 ZINC000833008880 602253623 /nfs/dbraw/zinc/25/36/23/602253623.db2.gz AUVYLCBNFHKKTG-UHFFFAOYSA-N 0 0 387.783 3.448 20 5 GGBDRN COc1ccc(-c2ccc(C[NH2+]C3CCN(C(=O)[O-])CC3)o2)c([N+](=O)[O-])c1 ZINC000737909992 602648126 /nfs/dbraw/zinc/64/81/26/602648126.db2.gz RYNQHGGGSARWLF-UHFFFAOYSA-N 0 0 375.381 3.095 20 5 GGBDRN O=C(OCc1cccc(-c2nn[nH]n2)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000826465917 607616381 /nfs/dbraw/zinc/61/63/81/607616381.db2.gz IMXUNKBUAYRAPW-UHFFFAOYSA-N 0 0 393.281 3.151 20 5 GGBDRN O=C([O-])N1CC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000833278440 604420729 /nfs/dbraw/zinc/42/07/29/604420729.db2.gz OCBNLKXECUWRIU-UHFFFAOYSA-N 0 0 396.197 3.069 20 5 GGBDRN O=C([O-])CCC[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000833226765 604786806 /nfs/dbraw/zinc/78/68/06/604786806.db2.gz FEUHWUGNVAUFPP-UHFFFAOYSA-N 0 0 386.404 3.328 20 5 GGBDRN O=C([O-])c1cc([N+](=O)[O-])c(N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1Cl ZINC000833308156 604801980 /nfs/dbraw/zinc/80/19/80/604801980.db2.gz XSOSXNAGDZXDPS-NHYWBVRUSA-N 0 0 379.844 3.400 20 5 GGBDRN CC(C)(C(=O)[O-])[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000833421586 604938533 /nfs/dbraw/zinc/93/85/33/604938533.db2.gz SGDRDRGTNPNLHO-NSHDSACASA-N 0 0 383.832 3.010 20 5 GGBDRN C[C@H]1C[N@H+](CCC(=O)[O-])CCN1C(=O)c1cc2ccccc2c2cccnc12 ZINC000833626632 605159874 /nfs/dbraw/zinc/15/98/74/605159874.db2.gz QMUCCNZCBZZVAT-HNNXBMFYSA-N 0 0 377.444 3.009 20 5 GGBDRN COc1cccc(C[NH+]2CCC(Nc3cc(C(=O)[O-])ccc3[N+](=O)[O-])CC2)c1 ZINC000833735784 605179227 /nfs/dbraw/zinc/17/92/27/605179227.db2.gz WDUQZBULNQRDMU-UHFFFAOYSA-N 0 0 385.420 3.378 20 5 GGBDRN O=[N+]([O-])c1cnc(N2Cc3ccccc3[C@@H](c3ccccc3)C2)c(-c2nn[nH]n2)c1 ZINC000823650843 606136988 /nfs/dbraw/zinc/13/69/88/606136988.db2.gz CGSAHOMFARAKLV-LJQANCHMSA-N 0 0 399.414 3.322 20 5 GGBDRN Cc1ccc(N2CCC(Oc3ccc(-c4nn[nH]n4)cc3)CC2)c([N+](=O)[O-])c1 ZINC000822241420 606137563 /nfs/dbraw/zinc/13/75/63/606137563.db2.gz VLYBSGUARJGEGC-UHFFFAOYSA-N 0 0 380.408 3.131 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H]1CCN(c2cccc(Cl)c2)C1 ZINC000823630100 606201020 /nfs/dbraw/zinc/20/10/20/606201020.db2.gz RMNPUNAXWNWDTM-CYBMUJFWSA-N 0 0 385.815 3.119 20 5 GGBDRN C[C@H](OC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(-c2nn[nH]n2)cc1 ZINC000820500678 606396235 /nfs/dbraw/zinc/39/62/35/606396235.db2.gz FYLBGURVDSEKDP-JTQLQIEISA-N 0 0 378.348 3.174 20 5 GGBDRN C[C@@H](OC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)c1ccc(-c2nn[nH]n2)cc1 ZINC000820502794 606397455 /nfs/dbraw/zinc/39/74/55/606397455.db2.gz VVIGGNKHOIQJDF-SNVBAGLBSA-N 0 0 378.348 3.174 20 5 GGBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)c1ccc(-c2nn[nH]n2)cc1 ZINC000820461314 606430026 /nfs/dbraw/zinc/43/00/26/606430026.db2.gz HDAMXASKVHZBKI-QMMMGPOBSA-N 0 0 390.201 3.106 20 5 GGBDRN O=[N+]([O-])c1ccc(OC(F)F)c(NCc2cc(-c3nn[nH]n3)ccc2F)c1 ZINC000823643875 606447778 /nfs/dbraw/zinc/44/77/78/606447778.db2.gz DPKACOIRCCKDTH-UHFFFAOYSA-N 0 0 380.286 3.128 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N3CCC[C@H]3c3ccccn3)cc(-c3nn[nH]n3)c2c1 ZINC000823645174 606460115 /nfs/dbraw/zinc/46/01/15/606460115.db2.gz OYWPVKJXORFAHH-KRWDZBQOSA-N 0 0 388.391 3.060 20 5 GGBDRN Cc1ccc(-c2nn[nH]n2)cc1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000822217760 606575377 /nfs/dbraw/zinc/57/53/77/606575377.db2.gz MVGFFLMTIABHEP-UHFFFAOYSA-N 0 0 381.396 3.140 20 5 GGBDRN CC[C@H](NC(=O)CSc1ccc(-c2nn[nH]n2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000820914001 606588468 /nfs/dbraw/zinc/58/84/68/606588468.db2.gz MEBQYBRPZFEIGD-INIZCTEOSA-N 0 0 398.448 3.135 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000823620990 606700020 /nfs/dbraw/zinc/70/00/20/606700020.db2.gz VHSUIDBLCKEBHU-CYBMUJFWSA-N 0 0 390.407 3.035 20 5 GGBDRN Cc1ccc([C@@H]2OCCC[C@H]2CNc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])cc1 ZINC000822233340 606713995 /nfs/dbraw/zinc/71/39/95/606713995.db2.gz MXHJSOYMAOAVJM-YOEHRIQHSA-N 0 0 395.423 3.058 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(COc3cc(Cl)ccc3-c3nn[nH]n3)o2)cc1 ZINC000823634706 606786052 /nfs/dbraw/zinc/78/60/52/606786052.db2.gz KJLSWGSJSDEJSR-UHFFFAOYSA-N 0 0 399.754 3.057 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(COc3cc(Cl)ccc3-c3nn[nH]n3)n2)cc1 ZINC000823634916 606786391 /nfs/dbraw/zinc/78/63/91/606786391.db2.gz OEDDLZFNBANRAW-UHFFFAOYSA-N 0 0 399.754 3.057 20 5 GGBDRN C[C@@H](Nc1ncc(Br)cc1[N+](=O)[O-])c1ccc(-c2nn[nH]n2)cc1 ZINC000820461539 606786787 /nfs/dbraw/zinc/78/67/87/606786787.db2.gz LTLHXKAWTLSILR-MRVPVSSYSA-N 0 0 390.201 3.106 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N[C@@H]3CCOC4(CCCC4)C3)cc(-c3nn[nH]n3)c2c1 ZINC000823645999 607130878 /nfs/dbraw/zinc/13/08/78/607130878.db2.gz ZGECCCOVVNVHML-GFCCVEGCSA-N 0 0 395.423 3.227 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Oc1ccc(C2SCCS2)cc1 ZINC000823629615 607163881 /nfs/dbraw/zinc/16/38/81/607163881.db2.gz BSLVLSHMJWDJGJ-UHFFFAOYSA-N 0 0 388.434 3.441 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nn[nH]n3)cc2Cl)c1 ZINC000821982737 607243428 /nfs/dbraw/zinc/24/34/28/607243428.db2.gz ACGUMCVDXYFYLJ-UHFFFAOYSA-N 0 0 390.812 3.403 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(-c2nn[nH]n2)cc1Cl ZINC000823082228 607243877 /nfs/dbraw/zinc/24/38/77/607243877.db2.gz DVDMWHMVVDXEBH-UHFFFAOYSA-N 0 0 393.190 3.263 20 5 GGBDRN O=C(Nc1ccc(-c2nn[nH]n2)cc1Cl)c1cccc(Cl)c1[N+](=O)[O-] ZINC000823319816 607244094 /nfs/dbraw/zinc/24/40/94/607244094.db2.gz YUENBACLJLHSKD-UHFFFAOYSA-N 0 0 379.163 3.334 20 5 GGBDRN O=C(Oc1ccc(-c2nn[nH]n2)cc1F)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000823449758 607244600 /nfs/dbraw/zinc/24/46/00/607244600.db2.gz BOBULIROGSMJLZ-UHFFFAOYSA-N 0 0 397.244 3.152 20 5 GGBDRN CCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1ccc(-c2nn[nH]n2)cc1 ZINC000825386156 607798623 /nfs/dbraw/zinc/79/86/23/607798623.db2.gz ZMAYYJRQRBIDTR-UHFFFAOYSA-N 0 0 384.421 3.164 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000826497455 607811365 /nfs/dbraw/zinc/81/13/65/607811365.db2.gz HTQUPOHXCPJZHG-DYVFJYSZSA-N 0 0 380.408 3.355 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000826497454 607811387 /nfs/dbraw/zinc/81/13/87/607811387.db2.gz HTQUPOHXCPJZHG-CXAGYDPISA-N 0 0 380.408 3.355 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000826497818 607849943 /nfs/dbraw/zinc/84/99/43/607849943.db2.gz VWUWPTLYRDLQSR-INIZCTEOSA-N 0 0 398.398 3.100 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OCc1ccc(-c2nn[nH]n2)cc1OC(F)F ZINC000826272756 607863504 /nfs/dbraw/zinc/86/35/04/607863504.db2.gz ZSRMAORASATVFB-UHFFFAOYSA-N 0 0 377.307 3.264 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCN(c1ccc(-c3nn[nH]n3)cc1C(F)(F)F)C2 ZINC000826500340 607937864 /nfs/dbraw/zinc/93/78/64/607937864.db2.gz UQQQTIRDJBXUKJ-UHFFFAOYSA-N 0 0 390.325 3.356 20 5 GGBDRN O=C(Nc1ccc(-c2nn[nH]n2)cc1Cl)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000826453107 607961801 /nfs/dbraw/zinc/96/18/01/607961801.db2.gz VWQYCUIIXDUZSA-UHFFFAOYSA-N 0 0 399.798 3.019 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(NC3CCC(F)(F)CC3)cc(-c3nn[nH]n3)c2c1 ZINC000826499425 608053844 /nfs/dbraw/zinc/05/38/44/608053844.db2.gz IFQJKHNONOMAFF-UHFFFAOYSA-N 0 0 375.339 3.313 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1OCCOc1cccc(-c2nn[nH]n2)c1 ZINC000826497527 608091434 /nfs/dbraw/zinc/09/14/34/608091434.db2.gz JZXBHPXMQZKUSY-UHFFFAOYSA-N 0 0 395.297 3.252 20 5 GGBDRN COc1ccc(C[C@@H](C)CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])cc1OC ZINC000826191789 608099686 /nfs/dbraw/zinc/09/96/86/608099686.db2.gz QDHQLEBSGQFCLY-GFCCVEGCSA-N 0 0 398.423 3.083 20 5 GGBDRN O=C(Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl)[C@@H]1C[C@H]1Cc1ccccc1 ZINC000826450184 608160688 /nfs/dbraw/zinc/16/06/88/608160688.db2.gz ACYXPUPQOKITEI-DGCLKSJQSA-N 0 0 398.810 3.246 20 5 GGBDRN O=C(OCc1cccc(-c2nn[nH]n2)c1F)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000826466477 608440532 /nfs/dbraw/zinc/44/05/32/608440532.db2.gz FFABYVKGLVVEBA-UHFFFAOYSA-N 0 0 399.363 3.486 20 5 GGBDRN Cc1cc(C(=O)N2CC=C(c3ccc(-c4nn[nH]n4)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000826257708 608478455 /nfs/dbraw/zinc/47/84/55/608478455.db2.gz MQGGEEGRIIRQOD-UHFFFAOYSA-N 0 0 390.403 3.013 20 5 GGBDRN Cc1sc(C(=O)N2CC=C(c3ccc(-c4nn[nH]n4)cc3)CC2)cc1[N+](=O)[O-] ZINC000826349405 608480194 /nfs/dbraw/zinc/48/01/94/608480194.db2.gz HAOSMDBUBRJUPG-UHFFFAOYSA-N 0 0 396.432 3.074 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(Cl)c(-c2nn[nH]n2)c1 ZINC000826453340 608574058 /nfs/dbraw/zinc/57/40/58/608574058.db2.gz HSSYHVNTQIHLFO-UHFFFAOYSA-N 0 0 379.163 3.334 20 5 GGBDRN Cc1cc(C)cc(C2=CCN(c3nccc(-c4nn[nH]n4)c3[N+](=O)[O-])CC2)c1 ZINC000826264759 608799009 /nfs/dbraw/zinc/79/90/09/608799009.db2.gz ZGAPSWMGEUBQRO-UHFFFAOYSA-N 0 0 377.408 3.080 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cccc(-c2nn[nH]n2)c1 ZINC000824505916 608808812 /nfs/dbraw/zinc/80/88/12/608808812.db2.gz JWFPLAKUFVSYCL-VIFPVBQESA-N 0 0 387.787 3.311 20 5 GGBDRN O=C(C[C@H]1CCCN1c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1ccccc1 ZINC000826405093 609430578 /nfs/dbraw/zinc/43/05/78/609430578.db2.gz VSFIASWTDYDBRP-OAHLLOKOSA-N 0 0 378.392 3.017 20 5 GGBDRN O=[N+]([O-])c1cccc(CNc2ccn(-c3ccc(Cl)cc3-c3nn[nH]n3)n2)c1 ZINC000826499238 609447872 /nfs/dbraw/zinc/44/78/72/609447872.db2.gz ANFXSLJPWYZABY-UHFFFAOYSA-N 0 0 396.798 3.226 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)OC(=O)[C@@H](C)Oc1ccccc1-c1nn[nH]n1 ZINC000826293608 609465716 /nfs/dbraw/zinc/46/57/16/609465716.db2.gz VYTZUXPGLHCYAY-QWHCGFSZSA-N 0 0 397.391 3.155 20 5 GGBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(-c2nn[nH]n2)c1 ZINC000825342158 609522304 /nfs/dbraw/zinc/52/23/04/609522304.db2.gz OUIAJZNFQADBEU-UHFFFAOYSA-N 0 0 398.448 3.207 20 5 GGBDRN Cc1c(Cl)cnc(NCc2cc([N+](=O)[O-])ccc2Cl)c1-c1nn[nH]n1 ZINC000826240497 609574190 /nfs/dbraw/zinc/57/41/90/609574190.db2.gz WNTVKWQOGAVTCP-UHFFFAOYSA-N 0 0 380.195 3.397 20 5 GGBDRN O=C(OCc1ccc(Cl)cc1-c1nn[nH]n1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000826465180 609617613 /nfs/dbraw/zinc/61/76/13/609617613.db2.gz BKIFAMAPMWDVRG-UHFFFAOYSA-N 0 0 395.709 3.064 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1cc2ccc(Br)cn2n1 ZINC000513738470 650568215 /nfs/dbraw/zinc/56/82/15/650568215.db2.gz UTMLXQRORYVQDL-UHFFFAOYSA-N 0 0 391.181 3.023 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])n1 ZINC000485688669 650699038 /nfs/dbraw/zinc/69/90/38/650699038.db2.gz QFQXORKUXAEQMI-ZETCQYMHSA-N 0 0 389.231 3.075 20 5 GGBDRN Cc1c(Br)c(NCCN2C(=O)Cc3ccccc32)ncc1[N+](=O)[O-] ZINC000541576389 650878009 /nfs/dbraw/zinc/87/80/09/650878009.db2.gz IMOMTDQANGZGGT-UHFFFAOYSA-N 0 0 391.225 3.062 20 5 GGBDRN CC(C)Cc1nnc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000052939455 1406238394 /nfs/dbraw/zinc/23/83/94/1406238394.db2.gz XIHTYXBPGYCQSZ-UHFFFAOYSA-N 0 0 386.437 3.298 20 5 GGBDRN Cn1cc(C(=O)Nc2ccc3c(c2)OCCCO3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052959006 1406243317 /nfs/dbraw/zinc/24/33/17/1406243317.db2.gz BKRWYNOBKTZREH-UHFFFAOYSA-N 0 0 394.387 3.409 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CC[C@H]1c1ccccc1 ZINC000053082256 1406283469 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384.823 3.466 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000053217597 1406328819 /nfs/dbraw/zinc/32/88/19/1406328819.db2.gz RNKNVRZKFNQUCE-SFHVURJKSA-N 0 0 389.839 3.174 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000053216606 1406328298 /nfs/dbraw/zinc/32/82/98/1406328298.db2.gz DKSNICSTXUQDAL-UHFFFAOYSA-N 0 0 397.475 3.371 20 5 GGBDRN Cc1cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c(C)n1Cc1ccccn1 ZINC000053218418 1406329111 /nfs/dbraw/zinc/32/91/11/1406329111.db2.gz VHAFTLINERPERI-UHFFFAOYSA-N 0 0 378.432 3.429 20 5 GGBDRN Cc1cccc(C(=O)N[C@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000053218120 1406329401 /nfs/dbraw/zinc/32/94/01/1406329401.db2.gz YNCYDHAKCYKDEO-IBGZPJMESA-N 0 0 383.448 3.017 20 5 GGBDRN Cc1ccc(C(=O)N[C@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000053218095 1406329414 /nfs/dbraw/zinc/32/94/14/1406329414.db2.gz XPOHECDSDDRSOX-IBGZPJMESA-N 0 0 383.448 3.017 20 5 GGBDRN 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0 0 383.452 3.022 20 5 GGBDRN C[C@@H](NC(=O)NCC(=O)Nc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000054648739 1406796467 /nfs/dbraw/zinc/79/64/67/1406796467.db2.gz DWGCWFLACHXFOI-LLVKDONJSA-N 0 0 376.800 3.247 20 5 GGBDRN Cc1noc(C2CCN(C(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000054665385 1406800016 /nfs/dbraw/zinc/80/00/16/1406800016.db2.gz AYKFAORRQDKLLM-LLVKDONJSA-N 0 0 376.438 3.173 20 5 GGBDRN COc1cc(CN2CCC[C@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000054676499 1406802477 /nfs/dbraw/zinc/80/24/77/1406802477.db2.gz HALNHPZBCDCJCW-NSHDSACASA-N 0 0 398.366 3.276 20 5 GGBDRN COc1cc(CN2CCC(c3nc(C)no3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000054678151 1406803218 /nfs/dbraw/zinc/80/32/18/1406803218.db2.gz VHMCFUQUYJTVSU-UHFFFAOYSA-N 0 0 398.366 3.276 20 5 GGBDRN Cc1noc([C@@H]2CCCN([C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000054677292 1406803279 /nfs/dbraw/zinc/80/32/79/1406803279.db2.gz XJFRRFIFAIDIEK-CMPLNLGQSA-N 0 0 393.831 3.146 20 5 GGBDRN CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000054678168 1406803519 /nfs/dbraw/zinc/80/35/19/1406803519.db2.gz RTNFNHBFYFEIAF-UHFFFAOYSA-N 0 0 397.840 3.187 20 5 GGBDRN Cc1noc(C2CCN([C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)n1 ZINC000054678422 1406804348 /nfs/dbraw/zinc/80/43/48/1406804348.db2.gz JIVLEMAFXFKSGD-LLVKDONJSA-N 0 0 384.396 3.277 20 5 GGBDRN COc1cc([C@H]2Nc3ccc(Cl)cc3C(=O)N2C)c([N+](=O)[O-])cc1OC ZINC000054682506 1406806080 /nfs/dbraw/zinc/80/60/80/1406806080.db2.gz ZJWJUYNFICQPHG-INIZCTEOSA-N 0 0 377.784 3.462 20 5 GGBDRN O=C(NC1CC1)c1ccc(CN(C(=O)c2ccc([N+](=O)[O-])cc2F)C2CC2)cc1 ZINC000054709123 1406811251 /nfs/dbraw/zinc/81/12/51/1406811251.db2.gz DWNBPDWVPSIFJQ-UHFFFAOYSA-N 0 0 397.406 3.431 20 5 GGBDRN COc1cccc([C@H]2CCCN2C(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000054749773 1406818297 /nfs/dbraw/zinc/81/82/97/1406818297.db2.gz XZDBJEZCPBCKSB-LJQANCHMSA-N 0 0 397.431 3.087 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccc(Cl)cc1 ZINC000054758809 1406818918 /nfs/dbraw/zinc/81/89/18/1406818918.db2.gz ZAZHCNAEXFRXOZ-KRWDZBQOSA-N 0 0 387.823 3.405 20 5 GGBDRN CCN1C(=S)N=NC1[C@@H]1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000176269273 1428209499 /nfs/dbraw/zinc/20/94/99/1428209499.db2.gz QYOGALPBQHSZSF-SNVBAGLBSA-N 0 0 395.872 3.168 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])c4cccnc43)CC2)s1 ZINC000054838680 1406834428 /nfs/dbraw/zinc/83/44/28/1406834428.db2.gz MVLYFCDWPUEOQU-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN Cc1cccc(OC[C@@H](C)NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000054893448 1406844647 /nfs/dbraw/zinc/84/46/47/1406844647.db2.gz REQVXHJKCQQYFH-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000054899508 1406846658 /nfs/dbraw/zinc/84/66/58/1406846658.db2.gz RNQYSZXWBYMEKP-UHFFFAOYSA-N 0 0 397.431 3.214 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1OC1CCCC1 ZINC000054900664 1406846741 /nfs/dbraw/zinc/84/67/41/1406846741.db2.gz YPTZMBSIJRQIDH-UHFFFAOYSA-N 0 0 397.431 3.214 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000054903212 1406847242 /nfs/dbraw/zinc/84/72/42/1406847242.db2.gz JNYBUJNWDHOPIF-SFHVURJKSA-N 0 0 397.431 3.050 20 5 GGBDRN O=C(c1cccc(CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1)N1CCCCC1 ZINC000054901684 1406847251 /nfs/dbraw/zinc/84/72/51/1406847251.db2.gz FXYVJWWZHVKZRQ-UHFFFAOYSA-N 0 0 393.399 3.017 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(Cc2ccccc2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000054903210 1406847549 /nfs/dbraw/zinc/84/75/49/1406847549.db2.gz JBGPYPKTNUOUAD-GOSISDBHSA-N 0 0 397.431 3.050 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000054903215 1406847883 /nfs/dbraw/zinc/84/78/83/1406847883.db2.gz JNYBUJNWDHOPIF-GOSISDBHSA-N 0 0 397.431 3.050 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000054903993 1406847996 /nfs/dbraw/zinc/84/79/96/1406847996.db2.gz XDSIKTGHNWESDJ-UHFFFAOYSA-N 0 0 395.337 3.219 20 5 GGBDRN COc1ccc([C@@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000054950990 1406858320 /nfs/dbraw/zinc/85/83/20/1406858320.db2.gz ZFANVDGNLMJNFP-IBGZPJMESA-N 0 0 384.436 3.466 20 5 GGBDRN C[C@@H](OCCCNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1ccccc1 ZINC000054979456 1406863472 /nfs/dbraw/zinc/86/34/72/1406863472.db2.gz LOTXNNVZQYUTCP-CYBMUJFWSA-N 0 0 382.413 3.180 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000054980008 1406863627 /nfs/dbraw/zinc/86/36/27/1406863627.db2.gz KEHSYYRJRXYWTD-ZDUSSCGKSA-N 0 0 395.868 3.053 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCc1ccc(OC)c(OC)c1OC ZINC000055012761 1406870575 /nfs/dbraw/zinc/87/05/75/1406870575.db2.gz HUCYCDZFMSHHPY-UHFFFAOYSA-N 0 0 390.392 3.201 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000055038992 1406875716 /nfs/dbraw/zinc/87/57/16/1406875716.db2.gz TVFALICQYDVIGV-UHFFFAOYSA-N 0 0 388.420 3.430 20 5 GGBDRN C[C@@H](NC(=O)CS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1 ZINC000055082601 1406882399 /nfs/dbraw/zinc/88/23/99/1406882399.db2.gz BGFDANUSRVNEQZ-CQSZACIVSA-N 0 0 398.440 3.399 20 5 GGBDRN CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NCCC1=CCCCC1 ZINC000055093534 1406883825 /nfs/dbraw/zinc/88/38/25/1406883825.db2.gz QCXKBENCTNOJIO-AWEZNQCLSA-N 0 0 395.481 3.046 20 5 GGBDRN CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1cc(C)cc(C)c1 ZINC000055114361 1406888296 /nfs/dbraw/zinc/88/82/96/1406888296.db2.gz PJEPRWJSQNTMSB-CQSZACIVSA-N 0 0 391.449 3.295 20 5 GGBDRN Cc1ccc(-c2noc(CN3CCN(Cc4cccc([N+](=O)[O-])c4)CC3)n2)cc1 ZINC000055121279 1406890206 /nfs/dbraw/zinc/89/02/06/1406890206.db2.gz OBQLWVYSYWBJQF-UHFFFAOYSA-N 0 0 393.447 3.271 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N[C@@H](C)c2cc(F)ccc2OC)c([N+](=O)[O-])c1 ZINC000055152360 1406894600 /nfs/dbraw/zinc/89/46/00/1406894600.db2.gz KANYXQLRHRLYKZ-RYUDHWBXSA-N 0 0 391.399 3.429 20 5 GGBDRN C[C@H](Nc1cccc2c1OCCO2)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000055156670 1406895546 /nfs/dbraw/zinc/89/55/46/1406895546.db2.gz KEGVSTMHMHQSOS-JTQLQIEISA-N 0 0 377.784 3.459 20 5 GGBDRN CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)N(C)CC1CCCCC1 ZINC000055192276 1406900489 /nfs/dbraw/zinc/90/04/89/1406900489.db2.gz MWVJBSMWVAOGAE-AWEZNQCLSA-N 0 0 397.497 3.078 20 5 GGBDRN C[C@H](OCCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000055234996 1406909092 /nfs/dbraw/zinc/90/90/92/1406909092.db2.gz NMQAJKDTGWYYBQ-ZDUSSCGKSA-N 0 0 382.413 3.180 20 5 GGBDRN COCCn1c(C)c(C)nc1S[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000055250734 1406913009 /nfs/dbraw/zinc/91/30/09/1406913009.db2.gz ZRUDDJLTXLAAPB-ZDUSSCGKSA-N 0 0 378.454 3.174 20 5 GGBDRN COCCn1c(C)c(C)nc1S[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000055250731 1406913286 /nfs/dbraw/zinc/91/32/86/1406913286.db2.gz QIHJLRLCCJAMIK-CYBMUJFWSA-N 0 0 378.454 3.174 20 5 GGBDRN O=C(c1ccc(OCC2CC2)cc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000055260305 1406915377 /nfs/dbraw/zinc/91/53/77/1406915377.db2.gz HPWAVQJPEXDUTM-UHFFFAOYSA-N 0 0 381.432 3.346 20 5 GGBDRN 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1398693204 /nfs/dbraw/zinc/69/32/04/1398693204.db2.gz MYUIVCIXFMYCQG-UHFFFAOYSA-N 0 0 378.768 3.442 20 5 GGBDRN C[C@@H](Sc1cccc[n+]1[O-])C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000007507407 1398693490 /nfs/dbraw/zinc/69/34/90/1398693490.db2.gz XJZWCKWHTRWBJH-SECBINFHSA-N 0 0 387.339 3.366 20 5 GGBDRN COc1ccc(Cl)cc1CC(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000007518853 1398695219 /nfs/dbraw/zinc/69/52/19/1398695219.db2.gz XIQMCEMUYIWDOD-NSHDSACASA-N 0 0 392.795 3.370 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1cc(Cl)ccc1F ZINC000007522661 1398695774 /nfs/dbraw/zinc/69/57/74/1398695774.db2.gz NQVFOHUAFBNQKA-UHFFFAOYSA-N 0 0 382.731 3.191 20 5 GGBDRN Cc1cccc(N2C[C@@H](C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CC2=O)c1C ZINC000055464628 1406971125 /nfs/dbraw/zinc/97/11/25/1406971125.db2.gz SKPKACKYVGNPPA-WBVHZDCISA-N 0 0 381.432 3.442 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CC(=O)N([C@@H](C)c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000055465499 1406971249 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397.309 3.016 20 5 GGBDRN COc1cc(COC(=O)COc2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000010388237 1398889401 /nfs/dbraw/zinc/88/94/01/1398889401.db2.gz CBDPUGWLGUMQLC-UHFFFAOYSA-N 0 0 383.303 3.327 20 5 GGBDRN CCOc1ncccc1C(=O)OCc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000010391772 1398889764 /nfs/dbraw/zinc/88/97/64/1398889764.db2.gz JKQFQUHRKIROAH-UHFFFAOYSA-N 0 0 398.318 3.356 20 5 GGBDRN CC[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000010423422 1398891564 /nfs/dbraw/zinc/89/15/64/1398891564.db2.gz PKZXUZDGLILTRA-MRXNPFEDSA-N 0 0 375.812 3.246 20 5 GGBDRN COc1cc(CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000010440943 1398892743 /nfs/dbraw/zinc/89/27/43/1398892743.db2.gz YDYGSMLUBIXPOJ-UHFFFAOYSA-N 0 0 397.290 3.043 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(OC(F)F)c(OC)c1 ZINC000010441651 1398892825 /nfs/dbraw/zinc/89/28/25/1398892825.db2.gz HBUUINIBRMFOOV-UHFFFAOYSA-N 0 0 382.319 3.143 20 5 GGBDRN C[C@@H](OC(=O)[C@@H]1CC1(Cl)Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010456460 1398893371 /nfs/dbraw/zinc/89/33/71/1398893371.db2.gz RRQQOSQPKPLTSN-SVRRBLITSA-N 0 0 381.599 3.312 20 5 GGBDRN CC(C)COc1cccc(C(=O)OCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000010453225 1398893452 /nfs/dbraw/zinc/89/34/52/1398893452.db2.gz QFDFWCGXNCVPNY-UHFFFAOYSA-N 0 0 386.404 3.449 20 5 GGBDRN C[C@H](OC(=O)[C@H]1CC1(Cl)Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000010457739 1398894068 /nfs/dbraw/zinc/89/40/68/1398894068.db2.gz UVUGJQCXEJAVLH-POYBYMJQSA-N 0 0 381.599 3.312 20 5 GGBDRN Cc1cccc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c1[N+](=O)[O-] ZINC000010459930 1398894085 /nfs/dbraw/zinc/89/40/85/1398894085.db2.gz JBNYZBAXLWUONR-UHFFFAOYSA-N 0 0 381.432 3.459 20 5 GGBDRN COc1cc(CCNC(=O)NCC2(c3ccccc3)CC2)c([N+](=O)[O-])cc1OC ZINC000010496572 1398896323 /nfs/dbraw/zinc/89/63/23/1398896323.db2.gz FWJXJGVRJADEIU-UHFFFAOYSA-N 0 0 399.447 3.186 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)CCc1ccc(C)cc1C ZINC000010493691 1398896333 /nfs/dbraw/zinc/89/63/33/1398896333.db2.gz YBULLRFNBARMFM-UHFFFAOYSA-N 0 0 386.404 3.335 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)NCCC2=CCCCC2)cc1[N+](=O)[O-] ZINC000010530812 1398897479 /nfs/dbraw/zinc/89/74/79/1398897479.db2.gz AHEVACMHVNTJPN-UHFFFAOYSA-N 0 0 375.425 3.190 20 5 GGBDRN CCNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc(C(C)=O)c2)cc1[N+](=O)[O-] ZINC000010530752 1398897483 /nfs/dbraw/zinc/89/74/83/1398897483.db2.gz HWYJRYREGIPQEH-ZDUSSCGKSA-N 0 0 399.403 3.413 20 5 GGBDRN CCNc1ccc(C(=O)O[C@@H](C)C(=O)c2ccc(NC(C)=O)cc2)cc1[N+](=O)[O-] ZINC000010530866 1398897501 /nfs/dbraw/zinc/89/75/01/1398897501.db2.gz TVTQIKZTMIQRGD-LBPRGKRZSA-N 0 0 399.403 3.413 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)Nc2ccc(C)cc2F)cc1[N+](=O)[O-] ZINC000010530816 1398897518 /nfs/dbraw/zinc/89/75/18/1398897518.db2.gz LFFBFKPCEOAOJA-UHFFFAOYSA-N 0 0 375.356 3.270 20 5 GGBDRN CCNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc(C(C)=O)cc2)cc1[N+](=O)[O-] ZINC000010530744 1398897548 /nfs/dbraw/zinc/89/75/48/1398897548.db2.gz FAWBZVGTADZGIQ-ZDUSSCGKSA-N 0 0 399.403 3.413 20 5 GGBDRN CCNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000010531049 1398897988 /nfs/dbraw/zinc/89/79/88/1398897988.db2.gz XPTZLEKBQCKFAM-JTQLQIEISA-N 0 0 392.799 3.259 20 5 GGBDRN Nc1ccc(C(=O)OCc2cc(=O)oc3cc4c(cc23)CCC4)cc1[N+](=O)[O-] ZINC000010531924 1398897997 /nfs/dbraw/zinc/89/79/97/1398897997.db2.gz MGELXMQQXVUNNB-UHFFFAOYSA-N 0 0 380.356 3.129 20 5 GGBDRN CCNc1ccc(C(=O)O[C@H](C)C(=O)N2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000010531018 1398898025 /nfs/dbraw/zinc/89/80/25/1398898025.db2.gz WFGXPEPVQANAJA-CYBMUJFWSA-N 0 0 383.404 3.161 20 5 GGBDRN CSc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000010531998 1398898064 /nfs/dbraw/zinc/89/80/64/1398898064.db2.gz GIBDMZJKRURCQR-SNVBAGLBSA-N 0 0 375.406 3.083 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000010531185 1398898068 /nfs/dbraw/zinc/89/80/68/1398898068.db2.gz YXZDDPLIBAQMRY-VNHYZAJKSA-N 0 0 377.441 3.124 20 5 GGBDRN CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000010531852 1398898101 /nfs/dbraw/zinc/89/81/01/1398898101.db2.gz FHBLFPADETWBPH-UHFFFAOYSA-N 0 0 385.420 3.161 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)Nc2cccc(C(C)=O)c2)cc1[N+](=O)[O-] ZINC000010531117 1398898128 /nfs/dbraw/zinc/89/81/28/1398898128.db2.gz WBMHXXXJIGCBCR-UHFFFAOYSA-N 0 0 385.376 3.025 20 5 GGBDRN C[C@H](NC(=O)COC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc2ccccc2c1 ZINC000010531696 1398898134 /nfs/dbraw/zinc/89/81/34/1398898134.db2.gz OMIWQPKJFJEHRY-ZDUSSCGKSA-N 0 0 393.399 3.364 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)NC2CCCCCCC2)cc1[N+](=O)[O-] ZINC000010531189 1398898157 /nfs/dbraw/zinc/89/81/57/1398898157.db2.gz KFEATQVJXCIZKG-UHFFFAOYSA-N 0 0 377.441 3.413 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1ccccc1OC(F)F ZINC000010616862 1398903561 /nfs/dbraw/zinc/90/35/61/1398903561.db2.gz CYOZFIHZYGQAIA-UHFFFAOYSA-N 0 0 380.351 3.108 20 5 GGBDRN C[C@@H](OC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010615517 1398903683 /nfs/dbraw/zinc/90/36/83/1398903683.db2.gz XQSWOCBRWFTWOQ-HWPZZCPQSA-N 0 0 390.779 3.122 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000010621120 1398904189 /nfs/dbraw/zinc/90/41/89/1398904189.db2.gz GITYQQALGJRKNY-CQSZACIVSA-N 0 0 381.388 3.428 20 5 GGBDRN C[C@@H](OC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000010617359 1398904268 /nfs/dbraw/zinc/90/42/68/1398904268.db2.gz UXMYRYXDHBBCQB-HWPZZCPQSA-N 0 0 390.779 3.122 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000010621019 1398904320 /nfs/dbraw/zinc/90/43/20/1398904320.db2.gz OBAZIAZPYQOGCS-UHFFFAOYSA-N 0 0 385.351 3.179 20 5 GGBDRN O=C(COC(=O)Cc1c[nH]c2ccccc12)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000010635223 1398905585 /nfs/dbraw/zinc/90/55/85/1398905585.db2.gz FNXINFZXRARSJP-UHFFFAOYSA-N 0 0 387.779 3.454 20 5 GGBDRN CCc1ccccc1Nc1nc(N)nc(COC(=O)c2ccc([N+](=O)[O-])cc2)n1 ZINC000010647169 1398906767 /nfs/dbraw/zinc/90/67/67/1398906767.db2.gz CQQWJRQSLIDZAG-UHFFFAOYSA-N 0 0 394.391 3.025 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2nc3ccccc3n2CC)cc([N+](=O)[O-])c1 ZINC000010651304 1398907388 /nfs/dbraw/zinc/90/73/88/1398907388.db2.gz ZAJASPYNDUQPJZ-UHFFFAOYSA-N 0 0 382.376 3.393 20 5 GGBDRN CC(=O)Nc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000010666140 1398909220 /nfs/dbraw/zinc/90/92/20/1398909220.db2.gz JSUZNPULRCQDHS-UHFFFAOYSA-N 0 0 376.752 3.246 20 5 GGBDRN C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)NCCc1ccc(F)cc1 ZINC000010666710 1398909245 /nfs/dbraw/zinc/90/92/45/1398909245.db2.gz KSMMQHAWXOTCBF-LLVKDONJSA-N 0 0 394.786 3.292 20 5 GGBDRN COc1ccc(S(=O)(=O)Oc2ccc(C)c3c2C(=O)C[C@@H]3C)cc1[N+](=O)[O-] ZINC000010664114 1398909332 /nfs/dbraw/zinc/90/93/32/1398909332.db2.gz XICMXEJJIQALDM-NSHDSACASA-N 0 0 391.401 3.369 20 5 GGBDRN CC(C)n1nccc1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000010665099 1398909355 /nfs/dbraw/zinc/90/93/55/1398909355.db2.gz NDXJMNYYBUCSTF-JTQLQIEISA-N 0 0 380.788 3.210 20 5 GGBDRN C[C@H](OC(=O)c1ccco1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000010668234 1398909462 /nfs/dbraw/zinc/90/94/62/1398909462.db2.gz NODWYSBBBFLPEQ-JTQLQIEISA-N 0 0 387.373 3.495 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000010682674 1398910879 /nfs/dbraw/zinc/91/08/79/1398910879.db2.gz AKGZAASUZCHRKT-SFHVURJKSA-N 0 0 376.434 3.341 20 5 GGBDRN Cc1ccc(CC(=O)N2CCN(c3nc4ccc([N+](=O)[O-])cc4s3)CC2)cc1 ZINC000010699016 1398911838 /nfs/dbraw/zinc/91/18/38/1398911838.db2.gz BJGGGXXUAXBUHX-UHFFFAOYSA-N 0 0 396.472 3.404 20 5 GGBDRN COc1ccc(CC(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000010716469 1398913806 /nfs/dbraw/zinc/91/38/06/1398913806.db2.gz WNMVOELTLJFXJK-LLVKDONJSA-N 0 0 392.795 3.370 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](Sc2nc(N)n[nH]2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000010715795 1398913905 /nfs/dbraw/zinc/91/39/05/1398913905.db2.gz YPWXCAYLLLNGIX-AWEZNQCLSA-N 0 0 384.421 3.076 20 5 GGBDRN Cc1ccc(C(=O)CCC(=O)OCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000010713761 1398913971 /nfs/dbraw/zinc/91/39/71/1398913971.db2.gz OFOWQWZMFQZWCJ-UHFFFAOYSA-N 0 0 390.417 3.134 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1cccc(N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000010738570 1398916021 /nfs/dbraw/zinc/91/60/21/1398916021.db2.gz DAIATDGKTGJFGC-GOSISDBHSA-N 0 0 399.447 3.474 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000010768266 1398918088 /nfs/dbraw/zinc/91/80/88/1398918088.db2.gz JBUOULQLRNBLIH-LBPRGKRZSA-N 0 0 398.419 3.391 20 5 GGBDRN CC(=O)Nc1ccc(C(=O)[C@@H](C)OC(=O)C=Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000010758394 1398918092 /nfs/dbraw/zinc/91/80/92/1398918092.db2.gz VGLUXCPSDVGGCQ-YQJFHSMKSA-N 0 0 382.372 3.381 20 5 GGBDRN NC(=O)c1ccc(COC(=O)c2ccc(SC(F)F)cc2)c([N+](=O)[O-])c1 ZINC000010769083 1398918846 /nfs/dbraw/zinc/91/88/46/1398918846.db2.gz JDZNASFSZPQGIR-UHFFFAOYSA-N 0 0 382.344 3.365 20 5 GGBDRN Nc1ccc(C(=O)NCC2(c3ccc4c(c3)OCCO4)CCCC2)cc1[N+](=O)[O-] ZINC000010770318 1398918922 /nfs/dbraw/zinc/91/89/22/1398918922.db2.gz VAYSYPKGSXCMGC-UHFFFAOYSA-N 0 0 397.431 3.190 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2csc(-c3ccco3)n2)C1=O ZINC000055527236 1406989849 /nfs/dbraw/zinc/98/98/49/1406989849.db2.gz WCTHFOSRGHXBAU-GOSISDBHSA-N 0 0 398.400 3.279 20 5 GGBDRN C[C@@H](OC(=O)c1cccnc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010801394 1398921691 /nfs/dbraw/zinc/92/16/91/1398921691.db2.gz ZOIJSLPBJMTMKI-MRVPVSSYSA-N 0 0 384.175 3.481 20 5 GGBDRN O=C(COC(=O)Cc1cccc2cccnc21)Nc1cc([N+](=O)[O-])ccc1F ZINC000010829476 1398923116 /nfs/dbraw/zinc/92/31/16/1398923116.db2.gz JNNNHPDSSWYJNK-UHFFFAOYSA-N 0 0 383.335 3.007 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)Cc1cccc2cccnc21 ZINC000010829759 1398923884 /nfs/dbraw/zinc/92/38/84/1398923884.db2.gz IGLZGXHRZFNCGJ-UHFFFAOYSA-N 0 0 379.372 3.176 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(C(=O)c2ccccc2)CC1 ZINC000010832197 1398924103 /nfs/dbraw/zinc/92/41/03/1398924103.db2.gz VBSJHNXRBQQVPP-UHFFFAOYSA-N 0 0 397.431 3.137 20 5 GGBDRN COc1ccc(OC)c(NC(=O)[C@H](C)Oc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000010845643 1398924693 /nfs/dbraw/zinc/92/46/93/1398924693.db2.gz JBVIPRDRPQATSP-NSHDSACASA-N 0 0 376.365 3.027 20 5 GGBDRN CCOC(=O)c1cc(C(=O)OCC(=O)c2ccc(F)c(F)c2)cc([N+](=O)[O-])c1 ZINC000010855592 1398925227 /nfs/dbraw/zinc/92/52/27/1398925227.db2.gz WXXRVRAJWNDUDR-UHFFFAOYSA-N 0 0 393.298 3.089 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1ccc2c(c1)OCCO2 ZINC000010855884 1398925262 /nfs/dbraw/zinc/92/52/62/1398925262.db2.gz DNGBXECXYKBTIX-UHFFFAOYSA-N 0 0 376.796 3.221 20 5 GGBDRN COc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2C=O)c(OC)cc1Cl ZINC000010856916 1398925286 /nfs/dbraw/zinc/92/52/86/1398925286.db2.gz NMDIWJPDSMTSRP-UHFFFAOYSA-N 0 0 394.767 3.095 20 5 GGBDRN Cc1nc2cc(F)ccc2cc1C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000010859687 1398925833 /nfs/dbraw/zinc/92/58/33/1398925833.db2.gz AWWCOPZAZBPLHI-UHFFFAOYSA-N 0 0 383.335 3.386 20 5 GGBDRN CC(=O)Nc1ccc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000010869905 1398926175 /nfs/dbraw/zinc/92/61/75/1398926175.db2.gz QKZGZHXLXWSIJU-UHFFFAOYSA-N 0 0 391.767 3.002 20 5 GGBDRN CN(C(=O)COC(=O)c1cnc(Cl)c(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000010893097 1398928999 /nfs/dbraw/zinc/92/89/99/1398928999.db2.gz IYLQBWUSOYJSKX-UHFFFAOYSA-N 0 0 384.175 3.116 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(CS(C)(=O)=O)cc1 ZINC000010898933 1398929785 /nfs/dbraw/zinc/92/97/85/1398929785.db2.gz RDVAVBZNYVOTSK-UHFFFAOYSA-N 0 0 396.852 3.065 20 5 GGBDRN O=C(COC(=O)[C@H]1Cc2ccccc2S1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000010905634 1398930817 /nfs/dbraw/zinc/93/08/17/1398930817.db2.gz SRGSDVQGSTWSAZ-OAHLLOKOSA-N 0 0 392.820 3.447 20 5 GGBDRN O=C(COC(=O)[C@@H]1Cc2ccccc2S1)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000010904778 1398930849 /nfs/dbraw/zinc/93/08/49/1398930849.db2.gz PZLLMGQJXMRGKR-HNNXBMFYSA-N 0 0 392.820 3.447 20 5 GGBDRN C=C1c2ccccc2C(=O)N1CC(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000010904294 1398930859 /nfs/dbraw/zinc/93/08/59/1398930859.db2.gz 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O=C(COC(=O)c1ccccc1C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022544375 1399473762 /nfs/dbraw/zinc/47/37/62/1399473762.db2.gz WBSLERMZJJHKNU-UHFFFAOYSA-N 0 0 394.305 3.360 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@H](C)OC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000022547648 1399474725 /nfs/dbraw/zinc/47/47/25/1399474725.db2.gz PWKMJWLBSFVNEG-ZDUSSCGKSA-N 0 0 390.823 3.461 20 5 GGBDRN COc1cccc(CNC(=O)[C@@H](C)OC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000022547626 1399474749 /nfs/dbraw/zinc/47/47/49/1399474749.db2.gz GZNAEOFGJIEMHB-LLVKDONJSA-N 0 0 392.795 3.119 20 5 GGBDRN C[C@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccccc1F ZINC000022547937 1399474783 /nfs/dbraw/zinc/47/47/83/1399474783.db2.gz RFIWFQYRAQPVLW-JTQLQIEISA-N 0 0 380.759 3.249 20 5 GGBDRN C[C@H](OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCc2sccc2C1 ZINC000022550385 1399475464 /nfs/dbraw/zinc/47/54/64/1399475464.db2.gz ZOAPPMZLGSSLAH-LVDDQXARSA-N 0 0 386.429 3.186 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccc(Cl)cc2N)cccc1[N+](=O)[O-] ZINC000022555286 1399476556 /nfs/dbraw/zinc/47/65/56/1399476556.db2.gz XSOMNBGZCRMTHT-SNVBAGLBSA-N 0 0 377.784 3.323 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)c2ccc(Cl)cc2N)cccc1[N+](=O)[O-] ZINC000022555287 1399476643 /nfs/dbraw/zinc/47/66/43/1399476643.db2.gz XSOMNBGZCRMTHT-JTQLQIEISA-N 0 0 377.784 3.323 20 5 GGBDRN CCCCCNC(=O)[C@@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559422 1399477224 /nfs/dbraw/zinc/47/72/24/1399477224.db2.gz IWXCUNSBRNUJRN-CQSZACIVSA-N 0 0 377.441 3.047 20 5 GGBDRN CCC(C)(C)NC(=O)[C@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559471 1399477385 /nfs/dbraw/zinc/47/73/85/1399477385.db2.gz GALIZVQUBWPYIK-ZDUSSCGKSA-N 0 0 377.441 3.045 20 5 GGBDRN CC(=O)N1CCN(c2ccc(C(=O)Nc3cc(C)ccc3C)cc2[N+](=O)[O-])CC1 ZINC000022560141 1399477436 /nfs/dbraw/zinc/47/74/36/1399477436.db2.gz KFOIHNFMBYSUBJ-UHFFFAOYSA-N 0 0 396.447 3.132 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)CSCc1ccc(F)cc1 ZINC000022562983 1399477904 /nfs/dbraw/zinc/47/79/04/1399477904.db2.gz QLDLQOYTBYVXSO-UHFFFAOYSA-N 0 0 392.408 3.457 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCNC(=O)c1ccc(F)cc1F ZINC000022590482 1399480462 /nfs/dbraw/zinc/48/04/62/1399480462.db2.gz XBYAYXYURWDYBN-UHFFFAOYSA-N 0 0 377.347 3.330 20 5 GGBDRN O=C(CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1nnsc1Cl ZINC000022651509 1399487091 /nfs/dbraw/zinc/48/70/91/1399487091.db2.gz YQVHORYNRCXGSC-UHFFFAOYSA-N 0 0 396.734 3.274 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)NCCC2=CCCCC2)cc1[N+](=O)[O-] ZINC000022651421 1399487142 /nfs/dbraw/zinc/48/71/42/1399487142.db2.gz XXHVFDLMTHVLQJ-UHFFFAOYSA-N 0 0 387.465 3.495 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCc1ccccc1F ZINC000022669079 1399489021 /nfs/dbraw/zinc/48/90/21/1399489021.db2.gz DJDJHBWAYWSXIW-SNVBAGLBSA-N 0 0 380.759 3.249 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000022668577 1399489162 /nfs/dbraw/zinc/48/91/62/1399489162.db2.gz DAWBVUOLRRZLPF-CYBMUJFWSA-N 0 0 390.823 3.461 20 5 GGBDRN O=C(OCCOC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 ZINC000022701408 1399492904 /nfs/dbraw/zinc/49/29/04/1399492904.db2.gz LBXMEEAQZXEVFW-UHFFFAOYSA-N 0 0 394.177 3.371 20 5 GGBDRN O=C(COC(=O)CSCc1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000022701045 1399492912 /nfs/dbraw/zinc/49/29/12/1399492912.db2.gz ZMYBBCKMJIGSEQ-UHFFFAOYSA-N 0 0 378.381 3.149 20 5 GGBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(C)n1CCc1ccccc1 ZINC000022714811 1399494845 /nfs/dbraw/zinc/49/48/45/1399494845.db2.gz WMJZACHYIBLXTK-UHFFFAOYSA-N 0 0 379.416 3.300 20 5 GGBDRN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000022736525 1399496938 /nfs/dbraw/zinc/49/69/38/1399496938.db2.gz IQWHGBLPOCOYHO-ZIAGYGMSSA-N 0 0 386.404 3.335 20 5 GGBDRN Cc1cc(C(=O)O[C@H](C)C(=O)N[C@H]2CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000022736535 1399497029 /nfs/dbraw/zinc/49/70/29/1399497029.db2.gz NPIKDNNOAINUNV-CJNGLKHVSA-N 0 0 384.388 3.089 20 5 GGBDRN Cc1cc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000022736533 1399497056 /nfs/dbraw/zinc/49/70/56/1399497056.db2.gz NPIKDNNOAINUNV-CZUORRHYSA-N 0 0 384.388 3.089 20 5 GGBDRN COc1cccc(CNC(=O)[C@H](C)OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000022793445 1399504086 /nfs/dbraw/zinc/50/40/86/1399504086.db2.gz IIVWWOMBZAXVEB-NSHDSACASA-N 0 0 392.795 3.119 20 5 GGBDRN C[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)N1CCc2sccc2C1 ZINC000022791932 1399504282 /nfs/dbraw/zinc/50/42/82/1399504282.db2.gz JVOHIJFOTUPSAP-SNVBAGLBSA-N 0 0 394.836 3.440 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@@H](C)OC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000022793508 1399504438 /nfs/dbraw/zinc/50/44/38/1399504438.db2.gz UHHYXBAEWBULHE-CYBMUJFWSA-N 0 0 390.823 3.461 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H](NC(C)=O)c1ccc(Cl)cc1 ZINC000022862609 1399511591 /nfs/dbraw/zinc/51/15/91/1399511591.db2.gz JTPOAWOQODBGFA-OAHLLOKOSA-N 0 0 391.811 3.463 20 5 GGBDRN COc1ccc(C(=O)O[C@H](C)C(=O)N(C)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000022907755 1399516160 /nfs/dbraw/zinc/51/61/60/1399516160.db2.gz PDIJFTVLIGDAAS-CQSZACIVSA-N 0 0 386.404 3.116 20 5 GGBDRN COc1ccc(C(=O)O[C@H](C)C(=O)Nc2cc(F)ccc2C)cc1[N+](=O)[O-] ZINC000022907581 1399516195 /nfs/dbraw/zinc/51/61/95/1399516195.db2.gz ANMQAZQLZUQDQP-LLVKDONJSA-N 0 0 376.340 3.235 20 5 GGBDRN Cc1c(C(=O)O[C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)cccc1[N+](=O)[O-] ZINC000022911245 1399516197 /nfs/dbraw/zinc/51/61/97/1399516197.db2.gz DQDHGWPNJFTZAS-CZUORRHYSA-N 0 0 384.388 3.089 20 5 GGBDRN Cc1c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cccc1[N+](=O)[O-] ZINC000022911561 1399516713 /nfs/dbraw/zinc/51/67/13/1399516713.db2.gz OMFMJDYSZBCNIM-AWEZNQCLSA-N 0 0 395.415 3.289 20 5 GGBDRN Cc1c(C(=O)O[C@@H](C)C(=O)N[C@H]2CCOc3ccccc32)cccc1[N+](=O)[O-] ZINC000022911254 1399516913 /nfs/dbraw/zinc/51/69/13/1399516913.db2.gz DQDHGWPNJFTZAS-BBRMVZONSA-N 0 0 384.388 3.089 20 5 GGBDRN Cc1ccc([C@H](NC(=O)COC(=O)Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000022940614 1399518332 /nfs/dbraw/zinc/51/83/32/1399518332.db2.gz QEEBTPCUOVWAEJ-NRFANRHFSA-N 0 0 382.416 3.256 20 5 GGBDRN C[C@H](OC(=O)Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2ncccc21 ZINC000022941378 1399519411 /nfs/dbraw/zinc/51/94/11/1399519411.db2.gz LPHIKFAGDUNBAI-ZDUSSCGKSA-N 0 0 379.372 3.256 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)N1C[C@@H](C)O[C@@H](C)C1 ZINC000022976580 1399520881 /nfs/dbraw/zinc/52/08/81/1399520881.db2.gz MUBLQZYWCWLTRC-ZNMIVQPWSA-N 0 0 395.525 3.079 20 5 GGBDRN O=C(Nc1ccc(-n2cncn2)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000023056378 1399529442 /nfs/dbraw/zinc/52/94/42/1399529442.db2.gz FURQOSJCMWSYTC-UHFFFAOYSA-N 0 0 378.392 3.028 20 5 GGBDRN CC(C)[C@H](NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000023079330 1399531075 /nfs/dbraw/zinc/53/10/75/1399531075.db2.gz WQTWTVMUHKRBQD-SFHVURJKSA-N 0 0 387.367 3.155 20 5 GGBDRN COc1ccc(-c2nc(CN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)co2)cc1 ZINC000023104355 1399532414 /nfs/dbraw/zinc/53/24/14/1399532414.db2.gz FDMAKDWFCVPECW-UHFFFAOYSA-N 0 0 379.328 3.055 20 5 GGBDRN O=C(NCC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000023112147 1399533143 /nfs/dbraw/zinc/53/31/43/1399533143.db2.gz QJKXHQUFSLJOFS-QGZVFWFLSA-N 0 0 387.823 3.342 20 5 GGBDRN CN(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000023151242 1399535438 /nfs/dbraw/zinc/53/54/38/1399535438.db2.gz FABKZLMNFLWOHP-MRXNPFEDSA-N 0 0 399.472 3.322 20 5 GGBDRN O=C(CCSc1ccccc1)OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000023203590 1399539064 /nfs/dbraw/zinc/53/90/64/1399539064.db2.gz QIHQSQTZNUZTEU-UHFFFAOYSA-N 0 0 386.429 3.210 20 5 GGBDRN CC[C@H](C)NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000023204915 1399539103 /nfs/dbraw/zinc/53/91/03/1399539103.db2.gz SNVCZUQCFNMHOV-LSDHHAIUSA-N 0 0 391.468 3.291 20 5 GGBDRN Cc1nn(C)c2nc(C)c(CCC(=O)OCc3cccc([N+](=O)[O-])c3)c(C)c12 ZINC000023216399 1399541181 /nfs/dbraw/zinc/54/11/81/1399541181.db2.gz FQNZNEMLPMHNIL-UHFFFAOYSA-N 0 0 382.420 3.478 20 5 GGBDRN C[C@@H](OC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)c1ccccc1Cl ZINC000023225225 1399541697 /nfs/dbraw/zinc/54/16/97/1399541697.db2.gz IQCKFAFUFCXDAU-LLVKDONJSA-N 0 0 390.779 3.278 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCCCn3ccnc3)cc2[N+](=O)[O-])C1 ZINC000023238548 1399542872 /nfs/dbraw/zinc/54/28/72/1399542872.db2.gz JQCZYOPJOCMQQU-HZPDHXFCSA-N 0 0 385.468 3.094 20 5 GGBDRN Cc1c(NC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@@H]3C2=O)cccc1[N+](=O)[O-] ZINC000023243944 1399543398 /nfs/dbraw/zinc/54/33/98/1399543398.db2.gz OBAVURXIPLWMPB-DAYGRLMNSA-N 0 0 399.447 3.208 20 5 GGBDRN COc1ccc(CN2CCCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc1 ZINC000023245232 1399543570 /nfs/dbraw/zinc/54/35/70/1399543570.db2.gz ZNHKEDOEENUCBW-UHFFFAOYSA-N 0 0 375.450 3.013 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000023344651 1399550744 /nfs/dbraw/zinc/55/07/44/1399550744.db2.gz LMZWLDJFGFGGFI-LLVKDONJSA-N 0 0 387.417 3.042 20 5 GGBDRN Cc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000023352255 1399551893 /nfs/dbraw/zinc/55/18/93/1399551893.db2.gz DGZQIORBYYSVTG-CYBMUJFWSA-N 0 0 398.448 3.307 20 5 GGBDRN CCCCc1nnc(NC(=O)c2cc(C(=O)OCC)cc([N+](=O)[O-])c2)s1 ZINC000023360670 1399552988 /nfs/dbraw/zinc/55/29/88/1399552988.db2.gz HIFPKLVFRLESIK-UHFFFAOYSA-N 0 0 378.410 3.218 20 5 GGBDRN CCCN(Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000023383959 1399555044 /nfs/dbraw/zinc/55/50/44/1399555044.db2.gz RZKPQPHYZPLXJB-NRFANRHFSA-N 0 0 396.447 3.232 20 5 GGBDRN Cn1c2ccccc2n(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1=S ZINC000023382747 1399555208 /nfs/dbraw/zinc/55/52/08/1399555208.db2.gz JAPXSWDTPGRMFP-UHFFFAOYSA-N 0 0 383.477 3.397 20 5 GGBDRN COc1ccc(S(=O)(=O)Oc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000023390739 1399555848 /nfs/dbraw/zinc/55/58/48/1399555848.db2.gz HAEFFPUMINFNKY-UHFFFAOYSA-N 0 0 377.296 3.390 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000023440312 1399561641 /nfs/dbraw/zinc/56/16/41/1399561641.db2.gz UYIUOIVPEPMFMA-SNVBAGLBSA-N 0 0 386.376 3.263 20 5 GGBDRN COC(=O)c1ccoc1COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000023452133 1399562207 /nfs/dbraw/zinc/56/22/07/1399562207.db2.gz QSOBSBPEQHVSDY-UHFFFAOYSA-N 0 0 388.376 3.322 20 5 GGBDRN Cc1sc2ncn(CCC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)c(=O)c2c1C ZINC000023456128 1399562738 /nfs/dbraw/zinc/56/27/38/1399562738.db2.gz WHSQIIRWTYAICC-UHFFFAOYSA-N 0 0 386.433 3.320 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCN(C/C=C/c2ccccc2)CC1 ZINC000023486821 1399564063 /nfs/dbraw/zinc/56/40/63/1399564063.db2.gz CVKZJPSTFCSWKL-YOCVDRLZSA-N 0 0 394.475 3.253 20 5 GGBDRN CCn1c(SCC(=O)OCc2cccc([N+](=O)[O-])c2)nnc1-c1ccco1 ZINC000023482327 1399564173 /nfs/dbraw/zinc/56/41/73/1399564173.db2.gz GXRPYYHRIWRRAP-UHFFFAOYSA-N 0 0 388.405 3.302 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1OC ZINC000023493659 1399564713 /nfs/dbraw/zinc/56/47/13/1399564713.db2.gz IELPLRHDWUAKNA-UHFFFAOYSA-N 0 0 389.364 3.101 20 5 GGBDRN C[C@H](NC(=O)COC(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000023502582 1399566422 /nfs/dbraw/zinc/56/64/22/1399566422.db2.gz SPIOKFCRVNBPMR-LBPRGKRZSA-N 0 0 376.796 3.211 20 5 GGBDRN COc1ccc(C(=O)NCc2ccc(OCC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000023510199 1399567602 /nfs/dbraw/zinc/56/76/02/1399567602.db2.gz UHVXUNKMXLIWTC-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3cccnc3)n2C)cccc1[N+](=O)[O-] ZINC000023521869 1399568537 /nfs/dbraw/zinc/56/85/37/1399568537.db2.gz QJOIIQUYRRLKAF-GFCCVEGCSA-N 0 0 398.448 3.213 20 5 GGBDRN CCN(C(C)=O)c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1 ZINC000023558381 1399570136 /nfs/dbraw/zinc/57/01/36/1399570136.db2.gz FRVKBYGRBZCPPK-UHFFFAOYSA-N 0 0 383.813 3.435 20 5 GGBDRN COc1ccc(F)cc1C(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000023577862 1399571872 /nfs/dbraw/zinc/57/18/72/1399571872.db2.gz ODHOIDVHRGMHGC-UHFFFAOYSA-N 0 0 382.731 3.191 20 5 GGBDRN 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CCN(CC)C(=O)c1cccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000028063454 1400124572 /nfs/dbraw/zinc/12/45/72/1400124572.db2.gz XMSIGPBQXOXJHK-UHFFFAOYSA-N 0 0 381.392 3.205 20 5 GGBDRN CCn1c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nnc1-c1ccncc1 ZINC000028079882 1400127489 /nfs/dbraw/zinc/12/74/89/1400127489.db2.gz WRMBCPKOSCQMLU-UHFFFAOYSA-N 0 0 399.432 3.427 20 5 GGBDRN Nc1nc(COC(=O)Cc2ccccc2[N+](=O)[O-])nc2sc3c(c21)CCCC3 ZINC000028077338 1400127717 /nfs/dbraw/zinc/12/77/17/1400127717.db2.gz YYLWZNRDXMRTDE-UHFFFAOYSA-N 0 0 398.444 3.346 20 5 GGBDRN O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000028086844 1400128120 /nfs/dbraw/zinc/12/81/20/1400128120.db2.gz RAPATRJFEJZROI-UHFFFAOYSA-N 0 0 387.779 3.150 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)CCc1nnc(-c2ccccc2)o1 ZINC000028145334 1400133552 /nfs/dbraw/zinc/13/35/52/1400133552.db2.gz OPOSBFBACBUAIF-UHFFFAOYSA-N 0 0 383.360 3.329 20 5 GGBDRN O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(Br)c[nH]1 ZINC000028176909 1400136620 /nfs/dbraw/zinc/13/66/20/1400136620.db2.gz XSCDNEQTFUHQPF-UHFFFAOYSA-N 0 0 393.153 3.092 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000028240066 1400142160 /nfs/dbraw/zinc/14/21/60/1400142160.db2.gz NDZIGCDFHRZOBT-UHFFFAOYSA-N 0 0 375.337 3.471 20 5 GGBDRN CCOC(=O)c1cccc(NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])c1 ZINC000028250169 1400143134 /nfs/dbraw/zinc/14/31/34/1400143134.db2.gz FBDLCXNXESEBQW-UHFFFAOYSA-N 0 0 388.376 3.431 20 5 GGBDRN CNC(=O)COc1cccc(CNC(=O)c2cc3ccccc3c3cccnc23)c1 ZINC000055783282 1407083370 /nfs/dbraw/zinc/08/33/70/1407083370.db2.gz AYMKXBQGSBMEMG-UHFFFAOYSA-N 0 0 399.450 3.443 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)N(CC)C2CCCCC2)cc1[N+](=O)[O-] ZINC000028293426 1400147418 /nfs/dbraw/zinc/14/74/18/1400147418.db2.gz ZSNJKXBHXDIFRY-UHFFFAOYSA-N 0 0 377.441 3.365 20 5 GGBDRN COCC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000028301264 1400147874 /nfs/dbraw/zinc/14/78/74/1400147874.db2.gz QQRBWOZPIIDVQK-INIZCTEOSA-N 0 0 378.768 3.118 20 5 GGBDRN O=C(Nc1ccc(CN2CCOC2=O)cc1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000055787537 1407083842 /nfs/dbraw/zinc/08/38/42/1407083842.db2.gz OYFBSMZNWUETNU-UHFFFAOYSA-N 0 0 375.768 3.453 20 5 GGBDRN O=C(Nc1ccc(CN2CCOC2=O)cc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000055787401 1407083947 /nfs/dbraw/zinc/08/39/47/1407083947.db2.gz GXQFHCGCFCRBQF-UHFFFAOYSA-N 0 0 375.768 3.453 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000028347785 1400154824 /nfs/dbraw/zinc/15/48/24/1400154824.db2.gz GOIQXTNDUNQSLL-VXGBXAGGSA-N 0 0 390.367 3.165 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])cn1C)c1cc2ccccc2o1 ZINC000028385536 1400158522 /nfs/dbraw/zinc/15/85/22/1400158522.db2.gz PPMAYGHQPKIMEM-NEPJUHHUSA-N 0 0 385.376 3.102 20 5 GGBDRN Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2cc([N+](=O)[O-])cn2C)c(Cl)c1 ZINC000028384323 1400158531 /nfs/dbraw/zinc/15/85/31/1400158531.db2.gz TZGNLXRURCTACD-NSHDSACASA-N 0 0 379.800 3.388 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])cn1C)c1ccc(Cl)cc1 ZINC000028384715 1400158837 /nfs/dbraw/zinc/15/88/37/1400158837.db2.gz HONBNLROYOBSLZ-MNOVXSKESA-N 0 0 379.800 3.009 20 5 GGBDRN C[C@H](Nc1cccc(CN2CCCC2=O)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000028387394 1400158885 /nfs/dbraw/zinc/15/88/85/1400158885.db2.gz NQCJKKSNFGUONC-AWEZNQCLSA-N 0 0 382.420 3.156 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Nc2cccc(CN3CCCC3=O)c2)cccc1[N+](=O)[O-] ZINC000028388548 1400159004 /nfs/dbraw/zinc/15/90/04/1400159004.db2.gz HQUBJBFIVADAGJ-HNNXBMFYSA-N 0 0 396.447 3.465 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)NCc2ccccc2C)c1 ZINC000028400753 1400160493 /nfs/dbraw/zinc/16/04/93/1400160493.db2.gz DEQVEBIPKYVDNI-ZDUSSCGKSA-N 0 0 388.445 3.487 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000028414747 1400163009 /nfs/dbraw/zinc/16/30/09/1400163009.db2.gz KCCJVALTLCFHGX-UHFFFAOYSA-N 0 0 380.303 3.197 20 5 GGBDRN CC(C)NC(=O)CSc1ccccc1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000055796886 1407085221 /nfs/dbraw/zinc/08/52/21/1407085221.db2.gz QDLZVUJBMQIFEF-UHFFFAOYSA-N 0 0 387.461 3.142 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000055797454 1407085226 /nfs/dbraw/zinc/08/52/26/1407085226.db2.gz HCWHIFHHWHIRHG-KRWDZBQOSA-N 0 0 389.839 3.319 20 5 GGBDRN O=C(/C=C/c1ccccc1)N1CCC(C(=O)NCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000055797135 1407085250 /nfs/dbraw/zinc/08/52/50/1407085250.db2.gz BTMYIIRMBNBHOM-DHZHZOJOSA-N 0 0 393.443 3.163 20 5 GGBDRN CCCCCn1nc(C(=O)NCc2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O ZINC000055796973 1407085262 /nfs/dbraw/zinc/08/52/62/1407085262.db2.gz MGBXRDLCHJLCFR-UHFFFAOYSA-N 0 0 394.431 3.425 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)N1CCc2[nH]c3ccccc3c2C1 ZINC000028423828 1400164610 /nfs/dbraw/zinc/16/46/10/1400164610.db2.gz KNXGIGTXONZVLM-UHFFFAOYSA-N 0 0 393.399 3.126 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@@H](C)C(=O)N[C@H]1CCOc2ccccc21 ZINC000028424147 1400164939 /nfs/dbraw/zinc/16/49/39/1400164939.db2.gz FCENXXURCPEEBO-ZFWWWQNUSA-N 0 0 384.388 3.089 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)OC(=O)c2c(C)cccc2[N+](=O)[O-])c(OC)c1 ZINC000028424039 1400165102 /nfs/dbraw/zinc/16/51/02/1400165102.db2.gz FKCJIDGBZTXOLB-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN CCOc1ccccc1C(=O)N[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000055797369 1407085409 /nfs/dbraw/zinc/08/54/09/1407085409.db2.gz DGGDQEXBXASFSC-LJQANCHMSA-N 0 0 399.447 3.064 20 5 GGBDRN CCN(CC)C(=O)COC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000028442478 1400166240 /nfs/dbraw/zinc/16/62/40/1400166240.db2.gz OOPHZWWVESAFKS-GASCZTMLSA-N 0 0 391.468 3.102 20 5 GGBDRN Cc1ccc(CCC(=O)OCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000028518178 1400174930 /nfs/dbraw/zinc/17/49/30/1400174930.db2.gz SKNWXUIGAICNLY-UHFFFAOYSA-N 0 0 382.416 3.277 20 5 GGBDRN O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)NC1CCCCCC1 ZINC000028612466 1400176707 /nfs/dbraw/zinc/17/67/07/1400176707.db2.gz UZTJIHWTVSATKK-UHFFFAOYSA-N 0 0 389.452 3.191 20 5 GGBDRN COc1cccc(C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1OC ZINC000028614377 1400177780 /nfs/dbraw/zinc/17/77/80/1400177780.db2.gz HSKLUNQNXACWHG-UHFFFAOYSA-N 0 0 385.332 3.019 20 5 GGBDRN O=C(/C=C/c1ccc(O)cc1)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000028613987 1400177827 /nfs/dbraw/zinc/17/78/27/1400177827.db2.gz KVPVVYFWTNFLJZ-FPYGCLRLSA-N 0 0 376.752 3.149 20 5 GGBDRN Cn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1cccnc1 ZINC000028624956 1400177939 /nfs/dbraw/zinc/17/79/39/1400177939.db2.gz DFMSTUHWOLNOCZ-UHFFFAOYSA-N 0 0 395.404 3.128 20 5 GGBDRN Cn1c(=O)c2ccccc2nc1SCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000028624838 1400178049 /nfs/dbraw/zinc/17/80/49/1400178049.db2.gz YXKXCGRTKBONFB-UHFFFAOYSA-N 0 0 395.400 3.184 20 5 GGBDRN COc1cc([C@@H]2Nc3ccccc3C(=O)N2CC(F)(F)F)c([N+](=O)[O-])cc1O ZINC000028660038 1400182015 /nfs/dbraw/zinc/18/20/15/1400182015.db2.gz FMXFTUOICQDTLT-OAHLLOKOSA-N 0 0 397.309 3.438 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1ccnc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000028668944 1400182811 /nfs/dbraw/zinc/18/28/11/1400182811.db2.gz OUBYCISKLYZZAB-CQSZACIVSA-N 0 0 391.811 3.456 20 5 GGBDRN Cc1nnc(NC(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)s1 ZINC000028701326 1400188210 /nfs/dbraw/zinc/18/82/10/1400188210.db2.gz WJUMXEBBUNNGRG-PHIMTYICSA-N 0 0 375.454 3.489 20 5 GGBDRN O=C(NCc1nnc2ccc(C(F)(F)F)cn21)c1cc([N+](=O)[O-])ccc1Cl ZINC000028719286 1400188873 /nfs/dbraw/zinc/18/88/73/1400188873.db2.gz GRYNHGSIIQDIMZ-UHFFFAOYSA-N 0 0 399.716 3.240 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000028733586 1400190457 /nfs/dbraw/zinc/19/04/57/1400190457.db2.gz DJLIOWXZHMJVSS-NSHDSACASA-N 0 0 395.337 3.048 20 5 GGBDRN CC(=O)Nc1c(C)cccc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000028753912 1400192427 /nfs/dbraw/zinc/19/24/27/1400192427.db2.gz XCXQUTBSAKSQEA-CYBMUJFWSA-N 0 0 399.403 3.354 20 5 GGBDRN COc1ccc(N[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c(OC)c1 ZINC000028795644 1400197780 /nfs/dbraw/zinc/19/77/80/1400197780.db2.gz VXULPELCUSTRNG-LLVKDONJSA-N 0 0 375.381 3.060 20 5 GGBDRN Cn1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 ZINC000028803071 1400198460 /nfs/dbraw/zinc/19/84/60/1400198460.db2.gz OWPPUJIDIGUHKG-UHFFFAOYSA-N 0 0 397.357 3.202 20 5 GGBDRN COc1ccc(CCC(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000028803551 1400198664 /nfs/dbraw/zinc/19/86/64/1400198664.db2.gz FSFLCDZRZQYABM-UHFFFAOYSA-N 0 0 383.360 3.329 20 5 GGBDRN Cc1ccc([C@@H](CNC(=O)c2cccc(C)c2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000055807885 1407087892 /nfs/dbraw/zinc/08/78/92/1407087892.db2.gz HCZMZOIDZLKKCC-LJQANCHMSA-N 0 0 383.448 3.015 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)c2ccc(OC)cc2OC)cc1[N+](=O)[O-] ZINC000028832878 1400200415 /nfs/dbraw/zinc/20/04/15/1400200415.db2.gz FXTKIBBVNZGUNJ-UHFFFAOYSA-N 0 0 388.376 3.084 20 5 GGBDRN C[C@H](c1nnc(Sc2ncccc2[N+](=O)[O-])n1-c1ccc(F)cc1)N(C)C ZINC000029001517 1400223900 /nfs/dbraw/zinc/22/39/00/1400223900.db2.gz HBWXJPLSHWUEQH-LLVKDONJSA-N 0 0 388.428 3.483 20 5 GGBDRN CN(C)[C@@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccccc1Cl ZINC000029051838 1400230622 /nfs/dbraw/zinc/23/06/22/1400230622.db2.gz VLEPYOQWBOWXPB-INIZCTEOSA-N 0 0 387.827 3.157 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2cnc3c(cnn3C(C)C)c2)cc1[N+](=O)[O-] ZINC000029066168 1400232088 /nfs/dbraw/zinc/23/20/88/1400232088.db2.gz XACSHPFSIJSFTQ-UHFFFAOYSA-N 0 0 384.352 3.389 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000029067450 1400232405 /nfs/dbraw/zinc/23/24/05/1400232405.db2.gz ZVUXPJHIAJUGMR-LJQANCHMSA-N 0 0 391.431 3.422 20 5 GGBDRN COC(=O)[C@H](C)NC(=O)c1ccc(NCCC2=CCCCC2)c([N+](=O)[O-])c1 ZINC000029067539 1400232907 /nfs/dbraw/zinc/23/29/07/1400232907.db2.gz ASQVVDNXBLHGFU-ZDUSSCGKSA-N 0 0 375.425 3.189 20 5 GGBDRN CC[C@@H](CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000029072595 1400233862 /nfs/dbraw/zinc/23/38/62/1400233862.db2.gz UUAIFLVSPGYIHA-CABCVRRESA-N 0 0 399.447 3.492 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)ccc1-n1cnnn1 ZINC000029104876 1400240174 /nfs/dbraw/zinc/24/01/74/1400240174.db2.gz PIEDPMRJKNNULN-UHFFFAOYSA-N 0 0 380.408 3.429 20 5 GGBDRN CN(C(=O)CN(Cc1cccs1)C[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000029114586 1400243250 /nfs/dbraw/zinc/24/32/50/1400243250.db2.gz VXOKPHQTIQVSMK-KRWDZBQOSA-N 0 0 389.477 3.300 20 5 GGBDRN COCc1ccccc1CNC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000029139345 1400247304 /nfs/dbraw/zinc/24/73/04/1400247304.db2.gz RDYYVTRLNZSMGG-UHFFFAOYSA-N 0 0 396.346 3.281 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCc1ccc(Cl)s1 ZINC000029171355 1400252837 /nfs/dbraw/zinc/25/28/37/1400252837.db2.gz OUOMLPDNZWXRIO-UHFFFAOYSA-N 0 0 395.824 3.314 20 5 GGBDRN CCOc1cc2c(cc1CNc1cc3nc[nH]c(=O)c3cc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000029187487 1400255831 /nfs/dbraw/zinc/25/58/31/1400255831.db2.gz FRBLKLRANLUVNN-NSHDSACASA-N 0 0 396.403 3.166 20 5 GGBDRN Cc1ccc(Cl)cc1N1CCN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC1 ZINC000029187108 1400255845 /nfs/dbraw/zinc/25/58/45/1400255845.db2.gz LKQCAKYQIWHJIV-UHFFFAOYSA-N 0 0 399.838 3.120 20 5 GGBDRN COc1ccc(C)cc1CN1CCN(Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000029188817 1400255985 /nfs/dbraw/zinc/25/59/85/1400255985.db2.gz JFSXMRCBXZHEJV-UHFFFAOYSA-N 0 0 385.464 3.238 20 5 GGBDRN COc1cc(CNC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)ccn1 ZINC000029196208 1400257143 /nfs/dbraw/zinc/25/71/43/1400257143.db2.gz UEWGEUWOOJGLST-UHFFFAOYSA-N 0 0 384.436 3.165 20 5 GGBDRN COc1ccc(CCn2c(C)cc(C(=O)Cn3cnc([N+](=O)[O-])c3)c2C)cc1 ZINC000029210871 1400258976 /nfs/dbraw/zinc/25/89/76/1400258976.db2.gz VQBTVWKXKYYMNZ-UHFFFAOYSA-N 0 0 382.420 3.344 20 5 GGBDRN Cc1ccc2[nH]c3c(c2c1)CN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)CC3 ZINC000029210577 1400259037 /nfs/dbraw/zinc/25/90/37/1400259037.db2.gz RSJQQXBOODCZJW-UHFFFAOYSA-N 0 0 393.399 3.354 20 5 GGBDRN 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C[C@H](c1ccco1)N(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC1 ZINC000056185176 1407245384 /nfs/dbraw/zinc/24/53/84/1407245384.db2.gz IQEMJYUQCJCARO-LLVKDONJSA-N 0 0 389.433 3.131 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000056219148 1407256885 /nfs/dbraw/zinc/25/68/85/1407256885.db2.gz CJDVKMRPZCNZAO-UHFFFAOYSA-N 0 0 376.350 3.080 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc2cc(Br)ccc2o1 ZINC000056219692 1407257267 /nfs/dbraw/zinc/25/72/67/1407257267.db2.gz KBDPTPYZDCMSCK-UHFFFAOYSA-N 0 0 394.181 3.465 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cnn(-c2ccccc2)c1C1CC1 ZINC000056219939 1407257438 /nfs/dbraw/zinc/25/74/38/1407257438.db2.gz IGDAAIVJLMUALE-UHFFFAOYSA-N 0 0 381.392 3.020 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@@H](Oc1ccccc1)c1ccccc1 ZINC000056219886 1407257515 /nfs/dbraw/zinc/25/75/15/1407257515.db2.gz XHGXHGLMCHHEDW-IBGZPJMESA-N 0 0 381.388 3.463 20 5 GGBDRN COC(=O)Cc1sc(NC(=O)c2ccc([N+](=O)[O-])o2)nc1-c1ccccc1 ZINC000056221891 1407258001 /nfs/dbraw/zinc/25/80/01/1407258001.db2.gz NVKRWDHZWWSUGE-UHFFFAOYSA-N 0 0 387.373 3.279 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C(=O)NCc1ccccc1 ZINC000056222860 1407258677 /nfs/dbraw/zinc/25/86/77/1407258677.db2.gz OHESVEHXIGKMNW-CQSZACIVSA-N 0 0 383.448 3.327 20 5 GGBDRN Cc1cc(=O)c(C(=O)NC[C@H]2CCC[C@@H](C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000056266535 1407271626 /nfs/dbraw/zinc/27/16/26/1407271626.db2.gz LGXKXTKPZMNICC-HIFRSBDPSA-N 0 0 384.436 3.005 20 5 GGBDRN C[C@H]1CCC[C@@H](CNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C1 ZINC000056266030 1407271646 /nfs/dbraw/zinc/27/16/46/1407271646.db2.gz BKZFIPGQLXYRDR-QWHCGFSZSA-N 0 0 389.481 3.431 20 5 GGBDRN CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000056253319 1407268724 /nfs/dbraw/zinc/26/87/24/1407268724.db2.gz GIAAJFMMBFEHMX-UHFFFAOYSA-N 0 0 391.449 3.065 20 5 GGBDRN CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000056253724 1407269405 /nfs/dbraw/zinc/26/94/05/1407269405.db2.gz QKQAKVJDVYDTAK-UHFFFAOYSA-N 0 0 391.449 3.065 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCOc2cc(C)cc(C)c2)cc1OC ZINC000056277043 1407277162 /nfs/dbraw/zinc/27/71/62/1407277162.db2.gz NSXRTOPVVWODPG-UHFFFAOYSA-N 0 0 388.420 3.428 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCNC(=O)c1ccsc1 ZINC000056287982 1407280546 /nfs/dbraw/zinc/28/05/46/1407280546.db2.gz NGUGEFPGZXESLO-UHFFFAOYSA-N 0 0 375.450 3.213 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H](C)NC(=O)c1cccs1 ZINC000056288167 1407280815 /nfs/dbraw/zinc/28/08/15/1407280815.db2.gz LIIBIPVCEDLZPG-CYBMUJFWSA-N 0 0 375.450 3.212 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[C@@H](NC(N)=O)c1cccs1 ZINC000056288232 1407280841 /nfs/dbraw/zinc/28/08/41/1407280841.db2.gz VBUNAWRVUXCASJ-OAHLLOKOSA-N 0 0 390.465 3.193 20 5 GGBDRN CCCC(=O)N1CCC[C@@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000056288809 1407280984 /nfs/dbraw/zinc/28/09/84/1407280984.db2.gz GUFIAVMZBLVUIF-QGZVFWFLSA-N 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CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H](C)NC(=O)c1cccs1 ZINC000056288168 1407281286 /nfs/dbraw/zinc/28/12/86/1407281286.db2.gz LIIBIPVCEDLZPG-ZDUSSCGKSA-N 0 0 375.450 3.212 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CN1c2ccccc2O[C@@H](C)C1=O ZINC000056288567 1407281404 /nfs/dbraw/zinc/28/14/04/1407281404.db2.gz HOQQTOLTELWZTL-HNNXBMFYSA-N 0 0 397.431 3.146 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H](C)NC(=O)C1CCCCC1 ZINC000056288826 1407282061 /nfs/dbraw/zinc/28/20/61/1407282061.db2.gz KKTNFYFANGVKRN-OAHLLOKOSA-N 0 0 375.469 3.417 20 5 GGBDRN CC[C@H](C)Oc1ccc(NC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 ZINC000056301886 1407289658 /nfs/dbraw/zinc/28/96/58/1407289658.db2.gz YOVIIVDIJRTJKB-LBPRGKRZSA-N 0 0 397.387 3.007 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc(OC)c3ncccc23)cc([N+](=O)[O-])c1 ZINC000056304666 1407291638 /nfs/dbraw/zinc/29/16/38/1407291638.db2.gz MOKXECODBTWLAC-UHFFFAOYSA-N 0 0 381.344 3.191 20 5 GGBDRN CCOc1ccc(C(=O)N2CCN(CCc3cccs3)CC2)cc1[N+](=O)[O-] ZINC000056304328 1407291862 /nfs/dbraw/zinc/29/18/62/1407291862.db2.gz AWATXXXUOHYBEO-UHFFFAOYSA-N 0 0 389.477 3.056 20 5 GGBDRN COc1ccc(CSCC(=O)N(C)C2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000056300034 1407289032 /nfs/dbraw/zinc/28/90/32/1407289032.db2.gz SLYHLACODIFVER-UHFFFAOYSA-N 0 0 386.473 3.462 20 5 GGBDRN O=C(NCCc1cnn(-c2ccccc2)c1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000056324709 1407298341 /nfs/dbraw/zinc/29/83/41/1407298341.db2.gz YACLHOLPYGFTJA-UHFFFAOYSA-N 0 0 375.388 3.234 20 5 GGBDRN Cc1ccc(CNC(=O)c2cccc(CNC(=O)c3cc([N+](=O)[O-])c[nH]3)c2)cc1 ZINC000056327169 1407299105 /nfs/dbraw/zinc/29/91/05/1407299105.db2.gz HRLVVHZXXCHMAX-UHFFFAOYSA-N 0 0 392.415 3.091 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1cccc(F)c1 ZINC000056327066 1407299289 /nfs/dbraw/zinc/29/92/89/1407299289.db2.gz LMTANFAMKLMJGE-SFHVURJKSA-N 0 0 393.378 3.468 20 5 GGBDRN COc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])c[nH]2)ccc1OCc1ccncc1 ZINC000056329561 1407300149 /nfs/dbraw/zinc/30/01/49/1407300149.db2.gz DSGWFXZKYXAVRP-ZDUSSCGKSA-N 0 0 396.403 3.397 20 5 GGBDRN Cc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c(OCC(=O)N(C)C)c1 ZINC000056339348 1407303783 /nfs/dbraw/zinc/30/37/83/1407303783.db2.gz DFMVWYOEVGJDQJ-UHFFFAOYSA-N 0 0 396.403 3.104 20 5 GGBDRN Cc1ccc([C@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2)N2CCOCC2)cc1 ZINC000056343252 1407305333 /nfs/dbraw/zinc/30/53/33/1407305333.db2.gz BIWUNQBAAKJELM-IBGZPJMESA-N 0 0 384.436 3.098 20 5 GGBDRN CCN(CC)C(=O)c1ccccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000056348038 1407306867 /nfs/dbraw/zinc/30/68/67/1407306867.db2.gz GZUZPTVEAOMAQL-UHFFFAOYSA-N 0 0 381.392 3.205 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccccc1Cn1cccn1)c1cccc([N+](=O)[O-])c1 ZINC000056368204 1407312371 /nfs/dbraw/zinc/31/23/71/1407312371.db2.gz UUIWUEHGTNKWCG-OAHLLOKOSA-N 0 0 379.420 3.400 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCc2cc(Cl)ccc21 ZINC000056350875 1407307950 /nfs/dbraw/zinc/30/79/50/1407307950.db2.gz GPWZVVSECHQJJZ-PIGZYNQJSA-N 0 0 387.823 3.170 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(F)c(Cl)c1 ZINC000056353448 1407308562 /nfs/dbraw/zinc/30/85/62/1407308562.db2.gz PGJHSGITLCRBBL-WDEREUQCSA-N 0 0 393.802 3.383 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCC1(c2ccccc2C)CCOCC1 ZINC000056364577 1407310993 /nfs/dbraw/zinc/31/09/93/1407310993.db2.gz ULOVEPAGJYGSNW-UHFFFAOYSA-N 0 0 384.432 3.390 20 5 GGBDRN Cc1ccccc1C1(CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CCOCC1 ZINC000056365061 1407311002 /nfs/dbraw/zinc/31/10/02/1407311002.db2.gz YFXPDODHTLFHNM-UHFFFAOYSA-N 0 0 394.431 3.258 20 5 GGBDRN Cc1ccccc1C1(CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CCOCC1 ZINC000056364589 1407311123 /nfs/dbraw/zinc/31/11/23/1407311123.db2.gz JZFMCKZNNPNKMP-UHFFFAOYSA-N 0 0 397.475 3.447 20 5 GGBDRN C[C@H](NC(=O)NCc1ccccc1Cn1cccn1)c1cccc([N+](=O)[O-])c1 ZINC000056368202 1407312654 /nfs/dbraw/zinc/31/26/54/1407312654.db2.gz UUIWUEHGTNKWCG-HNNXBMFYSA-N 0 0 379.420 3.400 20 5 GGBDRN C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000056381203 1407315481 /nfs/dbraw/zinc/31/54/81/1407315481.db2.gz CIPLEVYHMBNIRQ-OXJNMPFZSA-N 0 0 398.463 3.029 20 5 GGBDRN COc1cc(C(=O)Nc2ccncc2)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000056389616 1407317861 /nfs/dbraw/zinc/31/78/61/1407317861.db2.gz DELSOKDJVNFTPI-UHFFFAOYSA-N 0 0 386.389 3.286 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc(Cn2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000056387528 1407317928 /nfs/dbraw/zinc/31/79/28/1407317928.db2.gz SVVJPRVWADZUOI-HNNXBMFYSA-N 0 0 379.420 3.400 20 5 GGBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000056395492 1407319040 /nfs/dbraw/zinc/31/90/40/1407319040.db2.gz DVUXOTPQQQEYES-AWEZNQCLSA-N 0 0 390.403 3.139 20 5 GGBDRN COc1cc(C(=O)NC[C@@H]2C[C@H]2C)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000056397367 1407320066 /nfs/dbraw/zinc/32/00/66/1407320066.db2.gz LEUSVIWTMFAGBP-MNOVXSKESA-N 0 0 377.422 3.025 20 5 GGBDRN CC(C)COc1cccc(CNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000056434808 1407328016 /nfs/dbraw/zinc/32/80/16/1407328016.db2.gz YPNHKAXKVMXYHI-UHFFFAOYSA-N 0 0 395.419 3.140 20 5 GGBDRN CNc1ccc(C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000056435896 1407328812 /nfs/dbraw/zinc/32/88/12/1407328812.db2.gz AANWHGYJCKSFHG-UHFFFAOYSA-N 0 0 376.800 3.244 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1Cl ZINC000056436129 1407329468 /nfs/dbraw/zinc/32/94/68/1407329468.db2.gz NICLTLXANBOEHA-UHFFFAOYSA-N 0 0 390.827 3.268 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1Cl ZINC000056436470 1407329493 /nfs/dbraw/zinc/32/94/93/1407329493.db2.gz ZOLVZGRRLRHVDZ-UHFFFAOYSA-N 0 0 390.827 3.391 20 5 GGBDRN O=C(Nc1ccccc1)[C@@H]1CCCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000056460036 1407338531 /nfs/dbraw/zinc/33/85/31/1407338531.db2.gz MUVFDRNKSLTKRO-MRXNPFEDSA-N 0 0 382.420 3.155 20 5 GGBDRN COc1ccc(C)cc1C1(CNC(=O)c2ccc([N+](=O)[O-])cc2)CCOCC1 ZINC000056450864 1407334658 /nfs/dbraw/zinc/33/46/58/1407334658.db2.gz 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COC(=O)c1ccc([N+](=O)[O-])c(OCc2nc(-c3ccc(OC)cc3)no2)c1 ZINC000043927310 1403847736 /nfs/dbraw/zinc/84/77/36/1403847736.db2.gz HPZSJYHVOUKZEV-UHFFFAOYSA-N 0 0 385.332 3.019 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)N[C@H](c2ccccc2)C(C)C)c1 ZINC000043927559 1403847751 /nfs/dbraw/zinc/84/77/51/1403847751.db2.gz DVBYUIDXKRWIBI-IBGZPJMESA-N 0 0 386.404 3.274 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)N[C@@H](c2ccccc2)C(C)C)c1 ZINC000043927562 1403847850 /nfs/dbraw/zinc/84/78/50/1403847850.db2.gz DVBYUIDXKRWIBI-LJQANCHMSA-N 0 0 386.404 3.274 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)N[C@H](C)c2ccc(C)c(C)c2)c1 ZINC000043927462 1403847868 /nfs/dbraw/zinc/84/78/68/1403847868.db2.gz PVQSDQXHVJEJLG-CQSZACIVSA-N 0 0 386.404 3.254 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000044006464 1403858980 /nfs/dbraw/zinc/85/89/80/1403858980.db2.gz COWKHGSANPBSNT-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN CC(C)(C)NC(=O)c1ccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000044016918 1403861120 /nfs/dbraw/zinc/86/11/20/1403861120.db2.gz IEYGNHWWZRQJCB-UHFFFAOYSA-N 0 0 399.451 3.357 20 5 GGBDRN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000044040908 1403866998 /nfs/dbraw/zinc/86/69/98/1403866998.db2.gz QKACRWUAIRGUSN-LBPRGKRZSA-N 0 0 395.371 3.469 20 5 GGBDRN C[C@H](c1cc2ccccc2o1)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000044040912 1403867064 /nfs/dbraw/zinc/86/70/64/1403867064.db2.gz QKACRWUAIRGUSN-GFCCVEGCSA-N 0 0 395.371 3.469 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)C2CC2)c1 ZINC000044087816 1403873588 /nfs/dbraw/zinc/87/35/88/1403873588.db2.gz HBSRYHMMZOISHM-UHFFFAOYSA-N 0 0 383.408 3.177 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000044148651 1403886260 /nfs/dbraw/zinc/88/62/60/1403886260.db2.gz FQDUNTQLIBVJKR-UHFFFAOYSA-N 0 0 384.436 3.326 20 5 GGBDRN C[C@H](Oc1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000044203578 1403898832 /nfs/dbraw/zinc/89/88/32/1403898832.db2.gz GOGXIEPCPQCWLW-JTQLQIEISA-N 0 0 398.824 3.058 20 5 GGBDRN CNc1ccc(C(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-] ZINC000044222083 1403902904 /nfs/dbraw/zinc/90/29/04/1403902904.db2.gz RAUPUGAOWUJCKF-UHFFFAOYSA-N 0 0 377.404 3.442 20 5 GGBDRN COc1cc(F)ccc1NC(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000044235801 1403906405 /nfs/dbraw/zinc/90/64/05/1403906405.db2.gz OKRVPIHAGXBOTG-UHFFFAOYSA-N 0 0 393.371 3.124 20 5 GGBDRN CCOC(=O)c1cc(NC(=O)c2csc([N+](=O)[O-])c2)cc(C(=O)OCC)c1 ZINC000044285168 1403912749 /nfs/dbraw/zinc/91/27/49/1403912749.db2.gz FKIPRRKYRLXJAH-UHFFFAOYSA-N 0 0 392.389 3.262 20 5 GGBDRN CCOC(=O)c1cccnc1SCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000044332768 1403921407 /nfs/dbraw/zinc/92/14/07/1403921407.db2.gz GZYHFUJXBMFJNX-UHFFFAOYSA-N 0 0 375.406 3.206 20 5 GGBDRN CCOc1cc(NC(=O)NCc2cccc(O)c2)c([N+](=O)[O-])cc1OCC ZINC000056573883 1407365624 /nfs/dbraw/zinc/36/56/24/1407365624.db2.gz MIEBLLBHXOZLPJ-UHFFFAOYSA-N 0 0 375.381 3.420 20 5 GGBDRN Cc1cccc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)c1 ZINC000044407038 1403931077 /nfs/dbraw/zinc/93/10/77/1403931077.db2.gz NKSMGSSPDSYGPZ-UHFFFAOYSA-N 0 0 375.450 3.300 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)COC1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000044408552 1403931095 /nfs/dbraw/zinc/93/10/95/1403931095.db2.gz FFVDEWFHNFOVJP-INIZCTEOSA-N 0 0 378.425 3.053 20 5 GGBDRN CCOc1ccc(NC(=O)CN(C)Cc2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000044438031 1403933861 /nfs/dbraw/zinc/93/38/61/1403933861.db2.gz NVLXTYUTKBTFIR-UHFFFAOYSA-N 0 0 379.363 3.342 20 5 GGBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000044572958 1403954072 /nfs/dbraw/zinc/95/40/72/1403954072.db2.gz GEQVXWMGQDJUDT-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN CCOc1cc(C(=O)Nc2ccc(-c3nnco3)cc2)c([N+](=O)[O-])cc1OC ZINC000044575567 1403954911 /nfs/dbraw/zinc/95/49/11/1403954911.db2.gz LMRQVRXERGHROA-UHFFFAOYSA-N 0 0 384.348 3.304 20 5 GGBDRN Cc1ccc(C(=O)N(C)C)cc1OC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000044580924 1403956242 /nfs/dbraw/zinc/95/62/42/1403956242.db2.gz VHQLCJWDZWHMIQ-UHFFFAOYSA-N 0 0 394.387 3.010 20 5 GGBDRN CCCC(=O)Nc1ccc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000044597136 1403959694 /nfs/dbraw/zinc/95/96/94/1403959694.db2.gz OOPAZFREVIFOCL-UHFFFAOYSA-N 0 0 384.436 3.452 20 5 GGBDRN CCCC(=O)Nc1ccc(CNC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1 ZINC000044597654 1403959748 /nfs/dbraw/zinc/95/97/48/1403959748.db2.gz WNTDDJZTYOBJTB-UHFFFAOYSA-N 0 0 399.403 3.050 20 5 GGBDRN Cc1ccc(-n2cnnn2)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000044600522 1403960189 /nfs/dbraw/zinc/96/01/89/1403960189.db2.gz APTGQTZIUCURQF-UHFFFAOYSA-N 0 0 380.389 3.346 20 5 GGBDRN COc1cccc(CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000044607635 1403962178 /nfs/dbraw/zinc/96/21/78/1403962178.db2.gz HYWKUQCXKSGJLS-UHFFFAOYSA-N 0 0 383.448 3.179 20 5 GGBDRN COc1cccc(CCNC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000044607640 1403963089 /nfs/dbraw/zinc/96/30/89/1403963089.db2.gz YJTKZGFEHAEHNP-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN O=C(CSc1nc2ccccc2o1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000044614261 1403963570 /nfs/dbraw/zinc/96/35/70/1403963570.db2.gz DYIXWBVTPQTQIH-UHFFFAOYSA-N 0 0 398.444 3.177 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@H](C)c2ccc(OC(F)F)cc2)cc([N+](=O)[O-])c1 ZINC000044616868 1403963705 /nfs/dbraw/zinc/96/37/05/1403963705.db2.gz WXFIRKRELIVQQE-SNVBAGLBSA-N 0 0 394.330 3.474 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000044621746 1403965112 /nfs/dbraw/zinc/96/51/12/1403965112.db2.gz UFBPWRNSWYQOTH-UHFFFAOYSA-N 0 0 381.432 3.316 20 5 GGBDRN C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(NC(=O)NC2CC2)cc1 ZINC000044628467 1403966625 /nfs/dbraw/zinc/96/66/25/1403966625.db2.gz HKUWZECLKBBCHT-CYBMUJFWSA-N 0 0 382.420 3.299 20 5 GGBDRN C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000044629622 1403967236 /nfs/dbraw/zinc/96/72/36/1403967236.db2.gz LPQHURSNJBOLMU-CYBMUJFWSA-N 0 0 398.419 3.135 20 5 GGBDRN CC(=O)NCC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000044637018 1403969844 /nfs/dbraw/zinc/96/98/44/1403969844.db2.gz DYQFGDQXLNZDRX-UHFFFAOYSA-N 0 0 397.431 3.375 20 5 GGBDRN CCN(CC)c1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cn1 ZINC000044638452 1403971439 /nfs/dbraw/zinc/97/14/39/1403971439.db2.gz WDKMHDFZFJJBTR-UHFFFAOYSA-N 0 0 380.408 3.274 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000044638319 1403971933 /nfs/dbraw/zinc/97/19/33/1403971933.db2.gz ZKUVJECIGBWNDZ-CALCHBBNSA-N 0 0 397.475 3.063 20 5 GGBDRN COCCOc1ccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn1 ZINC000044644685 1403974471 /nfs/dbraw/zinc/97/44/71/1403974471.db2.gz IQQGUMKAIPODOB-UHFFFAOYSA-N 0 0 387.417 3.160 20 5 GGBDRN Cc1csc(CCNC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n1 ZINC000044652413 1403975858 /nfs/dbraw/zinc/97/58/58/1403975858.db2.gz CVQNCBWWXQWFHS-UHFFFAOYSA-N 0 0 399.476 3.194 20 5 GGBDRN O=C(NCc1ccccn1)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000044655976 1403976028 /nfs/dbraw/zinc/97/60/28/1403976028.db2.gz OMHLJBCJACECID-UHFFFAOYSA-N 0 0 376.372 3.172 20 5 GGBDRN Cc1cccc(C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)c1[N+](=O)[O-] ZINC000044655549 1403976189 /nfs/dbraw/zinc/97/61/89/1403976189.db2.gz GKIWAWFEBAAOSH-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN O=C(Nc1cccc(C(=O)NCc2ccccn2)c1)c1csc([N+](=O)[O-])c1 ZINC000044657872 1403976732 /nfs/dbraw/zinc/97/67/32/1403976732.db2.gz NGJZPRHEGLGOFK-UHFFFAOYSA-N 0 0 382.401 3.234 20 5 GGBDRN COC(=O)c1cc2cc(NC(=O)c3cc(C(=O)OC)cc([N+](=O)[O-])c3)ccc2o1 ZINC000044659479 1403977658 /nfs/dbraw/zinc/97/76/58/1403977658.db2.gz BWOVXOMWDNUXGX-UHFFFAOYSA-N 0 0 398.327 3.167 20 5 GGBDRN Cc1cc(C)cc(OCCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000044668456 1403981011 /nfs/dbraw/zinc/98/10/11/1403981011.db2.gz KMRSDEWGORRVSQ-UHFFFAOYSA-N 0 0 383.448 3.329 20 5 GGBDRN Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000044685705 1403983114 /nfs/dbraw/zinc/98/31/14/1403983114.db2.gz IRWCYNNIRCVNLV-QGZVFWFLSA-N 0 0 399.447 3.446 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000044688119 1403984034 /nfs/dbraw/zinc/98/40/34/1403984034.db2.gz ZEWYQEKAHLKOBC-UHFFFAOYSA-N 0 0 393.403 3.091 20 5 GGBDRN CC(C)Oc1ccccc1[C@H](C)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000044693132 1403985411 /nfs/dbraw/zinc/98/54/11/1403985411.db2.gz DAUJKHXMHMUMGL-HNNXBMFYSA-N 0 0 399.447 3.379 20 5 GGBDRN CC(C)Oc1ccccc1[C@@H](C)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000044693747 1403985508 /nfs/dbraw/zinc/98/55/08/1403985508.db2.gz UOJMVJQMBCUKDG-CQSZACIVSA-N 0 0 395.419 3.454 20 5 GGBDRN CN1C(=O)c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2C1=O ZINC000044714906 1403989406 /nfs/dbraw/zinc/98/94/06/1403989406.db2.gz LCFGYNKOSAKMCB-UHFFFAOYSA-N 0 0 381.369 3.288 20 5 GGBDRN C[C@@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000044724777 1403990920 /nfs/dbraw/zinc/99/09/20/1403990920.db2.gz ZQJFYUUEUPRHIT-SECBINFHSA-N 0 0 387.364 3.017 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cn1 ZINC000044739157 1403992523 /nfs/dbraw/zinc/99/25/23/1403992523.db2.gz IOMHPOIPEDHPHG-UHFFFAOYSA-N 0 0 384.436 3.307 20 5 GGBDRN O=C(NCCOc1ccc2c(c1)OCO2)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000044742413 1403993464 /nfs/dbraw/zinc/99/34/64/1403993464.db2.gz IDYHKPBJHQASKJ-UHFFFAOYSA-N 0 0 386.385 3.347 20 5 GGBDRN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000044759793 1403996707 /nfs/dbraw/zinc/99/67/07/1403996707.db2.gz ANWQGAACNQRRNA-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(C(=O)NC2CC2)c1 ZINC000044776865 1403999929 /nfs/dbraw/zinc/99/99/29/1403999929.db2.gz HRVYMXCRKFRVHZ-CYBMUJFWSA-N 0 0 399.472 3.284 20 5 GGBDRN O=C(NCc1nc(-c2ccccc2)no1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000044779032 1404000763 /nfs/dbraw/zinc/00/07/63/1404000763.db2.gz RWIXGTFQJVXHAQ-UHFFFAOYSA-N 0 0 393.403 3.175 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000044787603 1404002098 /nfs/dbraw/zinc/00/20/98/1404002098.db2.gz LFQBIPQRIOSCDO-UHFFFAOYSA-N 0 0 375.812 3.318 20 5 GGBDRN CCCCOc1cccc(CNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000044798850 1404004349 /nfs/dbraw/zinc/00/43/49/1404004349.db2.gz CETZWLTVMQLCLC-UHFFFAOYSA-N 0 0 395.419 3.284 20 5 GGBDRN Cc1sc2nc(SCc3ccc(C(N)=O)cc3[N+](=O)[O-])nc(N)c2c1C ZINC000044870620 1404014830 /nfs/dbraw/zinc/01/48/30/1404014830.db2.gz MYVXLRXTQGNKAN-UHFFFAOYSA-N 0 0 389.462 3.190 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000044948183 1404023988 /nfs/dbraw/zinc/02/39/88/1404023988.db2.gz UZOBRBGXFDIVCK-UHFFFAOYSA-N 0 0 385.811 3.276 20 5 GGBDRN CCCN(Cc1ccc(C)cc1)C(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000045022151 1404038791 /nfs/dbraw/zinc/03/87/91/1404038791.db2.gz XASOPAVPXWMWOF-UHFFFAOYSA-N 0 0 383.404 3.250 20 5 GGBDRN O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)Nc1ccc(N2CCCCC2)cc1 ZINC000045021861 1404039013 /nfs/dbraw/zinc/03/90/13/1404039013.db2.gz FQAZXBOBWQCCND-UHFFFAOYSA-N 0 0 396.403 3.132 20 5 GGBDRN O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)NCC1(c2ccccc2)CCCC1 ZINC000045022499 1404039332 /nfs/dbraw/zinc/03/93/32/1404039332.db2.gz KYBAZFXORDWWMO-UHFFFAOYSA-N 0 0 395.415 3.131 20 5 GGBDRN CC[C@@H](NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1ccc(Cl)cc1 ZINC000045022243 1404039334 /nfs/dbraw/zinc/03/93/34/1404039334.db2.gz UCKSVXDPKBFNJN-CQSZACIVSA-N 0 0 389.795 3.424 20 5 GGBDRN O=C(NCc1ccc(Cn2ccnc2)cc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000056603193 1407376068 /nfs/dbraw/zinc/37/60/68/1407376068.db2.gz PAOGSZHDRWAANP-UHFFFAOYSA-N 0 0 375.388 3.251 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(OC2CCCC2)c1 ZINC000045075330 1404049338 /nfs/dbraw/zinc/04/93/38/1404049338.db2.gz ZTMQSMLJNIHIJG-UHFFFAOYSA-N 0 0 383.404 3.285 20 5 GGBDRN COC(=O)c1cc(NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(F)cc1F ZINC000045096461 1404052314 /nfs/dbraw/zinc/05/23/14/1404052314.db2.gz SIVTUEQRHYUMTI-UHFFFAOYSA-N 0 0 379.319 3.019 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1cccc(S(=O)(=O)NC2CCCC2)c1 ZINC000045198335 1404073206 /nfs/dbraw/zinc/07/32/06/1404073206.db2.gz VEBPUMRNOAKLHQ-UHFFFAOYSA-N 0 0 389.433 3.068 20 5 GGBDRN COc1cc(CCNC(=O)N(C)CCc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000045213061 1404076030 /nfs/dbraw/zinc/07/60/30/1404076030.db2.gz WIRNJRCDPXIZCY-UHFFFAOYSA-N 0 0 387.436 3.039 20 5 GGBDRN COc1cc(CCNC(=O)N(C)CC2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000045213771 1404076513 /nfs/dbraw/zinc/07/65/13/1404076513.db2.gz LFGIYKDRLWOVHJ-UHFFFAOYSA-N 0 0 379.457 3.376 20 5 GGBDRN CC[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000045222568 1404077003 /nfs/dbraw/zinc/07/70/03/1404077003.db2.gz DSLLLJVRJCCWMC-MRXNPFEDSA-N 0 0 375.812 3.246 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](c1nccn1C)c1ccccc1 ZINC000045232383 1404078660 /nfs/dbraw/zinc/07/86/60/1404078660.db2.gz DPYFVLQGAFYQGG-GOSISDBHSA-N 0 0 379.420 3.259 20 5 GGBDRN CC(C)Oc1ccc([C@H](C)NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000045237521 1404079917 /nfs/dbraw/zinc/07/99/17/1404079917.db2.gz CZCSPWIRJQBHCJ-HNNXBMFYSA-N 0 0 399.447 3.379 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cccc(C(N)=O)c3)cc2[N+](=O)[O-])C1 ZINC000045285327 1404091025 /nfs/dbraw/zinc/09/10/25/1404091025.db2.gz QABNYVBDSZUJNC-ZIAGYGMSSA-N 0 0 396.447 3.428 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cccc(C(N)=O)c3)cc2[N+](=O)[O-])C1 ZINC000045285324 1404091230 /nfs/dbraw/zinc/09/12/30/1404091230.db2.gz QABNYVBDSZUJNC-KBPBESRZSA-N 0 0 396.447 3.428 20 5 GGBDRN COc1cc(C(=O)Nc2ccnn2Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000045289550 1404092153 /nfs/dbraw/zinc/09/21/53/1404092153.db2.gz LIEGTUWROWECBA-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000045293295 1404092734 /nfs/dbraw/zinc/09/27/34/1404092734.db2.gz DKMVPWGTNOOOFN-UHFFFAOYSA-N 0 0 391.830 3.274 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000045327099 1404099193 /nfs/dbraw/zinc/09/91/93/1404099193.db2.gz SXPQKUGUQVEAJD-KRWDZBQOSA-N 0 0 385.420 3.471 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccc(NC(=O)C2CC2)cc1 ZINC000045347848 1404103705 /nfs/dbraw/zinc/10/37/05/1404103705.db2.gz GCMXNUSPMDALLO-NSHDSACASA-N 0 0 393.403 3.311 20 5 GGBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000045382616 1404111273 /nfs/dbraw/zinc/11/12/73/1404111273.db2.gz KVNOLKHPJCTJPX-INIZCTEOSA-N 0 0 398.463 3.153 20 5 GGBDRN COc1cccc(CNC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1OC ZINC000045395289 1404112378 /nfs/dbraw/zinc/11/23/78/1404112378.db2.gz PGCRUPLTRVGCFB-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000045397940 1404113062 /nfs/dbraw/zinc/11/30/62/1404113062.db2.gz UKTVPIPSOYCAOV-UHFFFAOYSA-N 0 0 380.404 3.451 20 5 GGBDRN COc1ccc(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)c(OC)c1OC ZINC000045403082 1404114389 /nfs/dbraw/zinc/11/43/89/1404114389.db2.gz FNFWADMKFBPVHR-UHFFFAOYSA-N 0 0 392.433 3.029 20 5 GGBDRN CC(C)N1CCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000045427485 1404120296 /nfs/dbraw/zinc/12/02/96/1404120296.db2.gz KUKJKUHHKRKSAN-UHFFFAOYSA-N 0 0 382.464 3.373 20 5 GGBDRN COC(=O)c1ccc(OCC(=O)N(Cc2ccc(C)cc2)C2CC2)c([N+](=O)[O-])c1 ZINC000045441244 1404122549 /nfs/dbraw/zinc/12/25/49/1404122549.db2.gz DWLJGOPIJZDQTQ-UHFFFAOYSA-N 0 0 398.415 3.260 20 5 GGBDRN CCN(CCc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000045488941 1404130473 /nfs/dbraw/zinc/13/04/73/1404130473.db2.gz ILDHJQHTDUGIQB-UHFFFAOYSA-N 0 0 383.448 3.136 20 5 GGBDRN Cc1cc(=O)c(C(=O)N(C2CC2)C2CCCCC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000045490021 1404131465 /nfs/dbraw/zinc/13/14/65/1404131465.db2.gz MOHJBUOSJCSENS-UHFFFAOYSA-N 0 0 396.447 3.386 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C3CC3)cs2)cc1OC ZINC000045527445 1404138473 /nfs/dbraw/zinc/13/84/73/1404138473.db2.gz VFDPFSBYEYYASA-UHFFFAOYSA-N 0 0 393.421 3.215 20 5 GGBDRN COC(=O)c1oc2ccccc2c1COc1ccc(C(=O)OC)cc1[N+](=O)[O-] ZINC000045528913 1404139566 /nfs/dbraw/zinc/13/95/66/1404139566.db2.gz INPLYABJMPMMIA-UHFFFAOYSA-N 0 0 385.328 3.493 20 5 GGBDRN COc1ccc(CCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1F ZINC000045593534 1404155778 /nfs/dbraw/zinc/15/57/78/1404155778.db2.gz GQOKKVSPKGKMNJ-UHFFFAOYSA-N 0 0 387.411 3.024 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCN(Cc2cccc(Cl)c2)CC1 ZINC000045624582 1404164468 /nfs/dbraw/zinc/16/44/68/1404164468.db2.gz XZFFGSNEEGHEHL-UHFFFAOYSA-N 0 0 388.855 3.276 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000045624647 1404164671 /nfs/dbraw/zinc/16/46/71/1404164671.db2.gz RXHIVNSCVTYUGY-CQSZACIVSA-N 0 0 380.408 3.078 20 5 GGBDRN O=C(NCCCNc1ccc(C(F)(F)F)cn1)NCc1ccccc1[N+](=O)[O-] ZINC000045621812 1404164699 /nfs/dbraw/zinc/16/46/99/1404164699.db2.gz GICBFXCMSNHYON-UHFFFAOYSA-N 0 0 397.357 3.310 20 5 GGBDRN O=C(Nc1ccccc1)[C@H]1CCCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000045621580 1404164728 /nfs/dbraw/zinc/16/47/28/1404164728.db2.gz XQDPFRFMAIFEDX-INIZCTEOSA-N 0 0 382.420 3.155 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1nn(-c2ccccc2)c2c1CCC2 ZINC000045684472 1404176661 /nfs/dbraw/zinc/17/66/61/1404176661.db2.gz PCIZIYCIMBADQD-UHFFFAOYSA-N 0 0 391.431 3.111 20 5 GGBDRN O=C(CNc1cccc(OC(F)(F)F)c1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000045734197 1404189930 /nfs/dbraw/zinc/18/99/30/1404189930.db2.gz SYBGTMILFJMCAF-UHFFFAOYSA-N 0 0 399.281 3.273 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCCO[C@@H](C)c1ccccc1 ZINC000045742379 1404192731 /nfs/dbraw/zinc/19/27/31/1404192731.db2.gz DAZMGRPLOUZVAL-AWEZNQCLSA-N 0 0 394.449 3.050 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)c1cc2ccccc2o1 ZINC000045742269 1404192837 /nfs/dbraw/zinc/19/28/37/1404192837.db2.gz MRDOHLZNSIJKSU-LLVKDONJSA-N 0 0 376.390 3.389 20 5 GGBDRN Cc1ccn2cc(CNC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)nc2c1 ZINC000056636457 1407387757 /nfs/dbraw/zinc/38/77/57/1407387757.db2.gz LSINXVMDNSZRDC-UHFFFAOYSA-N 0 0 391.334 3.474 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCCNc1ccc(C(F)(F)F)cn1 ZINC000045791047 1404205183 /nfs/dbraw/zinc/20/51/83/1404205183.db2.gz MYLOFVYYBFNRRW-UHFFFAOYSA-N 0 0 382.342 3.170 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCc2ccc(C(F)(F)F)cc2)cc1 ZINC000045797267 1404207917 /nfs/dbraw/zinc/20/79/17/1404207917.db2.gz MESPCEZWZBCADK-UHFFFAOYSA-N 0 0 388.367 3.276 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCc2ccc(-n3cncn3)cc2)cc1[N+](=O)[O-] ZINC000045808235 1404210972 /nfs/dbraw/zinc/21/09/72/1404210972.db2.gz UTZGHWFBNYGWBH-UHFFFAOYSA-N 0 0 379.420 3.403 20 5 GGBDRN Cc1ccc2[nH]c3c(c2c1)CN(S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)CC3 ZINC000045811006 1404211759 /nfs/dbraw/zinc/21/17/59/1404211759.db2.gz YJWDAQQZKUMBAG-UHFFFAOYSA-N 0 0 385.445 3.273 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1cc(-c2ccccc2)no1 ZINC000045812389 1404212432 /nfs/dbraw/zinc/21/24/32/1404212432.db2.gz PANGQUUUCAUVQF-UHFFFAOYSA-N 0 0 393.808 3.382 20 5 GGBDRN CCOc1cc(C(=O)Nc2cccc(-n3cccn3)c2)c([N+](=O)[O-])cc1OC ZINC000045836248 1404219802 /nfs/dbraw/zinc/21/98/02/1404219802.db2.gz OXCPAVHXGZWWTA-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN O=C(NCCc1c[nH]c2ccccc12)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000045857273 1404226203 /nfs/dbraw/zinc/22/62/03/1404226203.db2.gz ATRMOHKQDZDFNK-UHFFFAOYSA-N 0 0 375.388 3.234 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)ccc1[N+](=O)[O-] ZINC000045873214 1404230814 /nfs/dbraw/zinc/23/08/14/1404230814.db2.gz CPSFEMVAWITEQP-KRWDZBQOSA-N 0 0 398.419 3.456 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000045899249 1404237839 /nfs/dbraw/zinc/23/78/39/1404237839.db2.gz AIYJKWKBOGSCHB-UHFFFAOYSA-N 0 0 380.404 3.500 20 5 GGBDRN O=[N+]([O-])c1ccccc1N1CCN(S(=O)(=O)C2=Cc3ccccc3CC2)CC1 ZINC000045909173 1404240324 /nfs/dbraw/zinc/24/03/24/1404240324.db2.gz DSVPZXZCUXJQBV-UHFFFAOYSA-N 0 0 399.472 3.034 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1[N+](=O)[O-] ZINC000045934831 1404246308 /nfs/dbraw/zinc/24/63/08/1404246308.db2.gz QMXORIJTOLRWLV-NSHDSACASA-N 0 0 375.331 3.173 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000045960652 1404252984 /nfs/dbraw/zinc/25/29/84/1404252984.db2.gz VKTZVBXLFBDEPP-OAHLLOKOSA-N 0 0 398.463 3.242 20 5 GGBDRN COCCOc1ccc([C@@H](C)NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1OC ZINC000045967759 1404255677 /nfs/dbraw/zinc/25/56/77/1404255677.db2.gz VEGOXQOZILWNIM-CQSZACIVSA-N 0 0 388.420 3.428 20 5 GGBDRN COCCOc1ccc([C@@H](C)NC(=O)c2csc([N+](=O)[O-])c2)cc1OC ZINC000045968024 1404255700 /nfs/dbraw/zinc/25/57/00/1404255700.db2.gz VYDBTUSGISAVER-LLVKDONJSA-N 0 0 380.422 3.181 20 5 GGBDRN COCCOc1ccc([C@H](C)NC(=O)c2csc([N+](=O)[O-])c2)cc1OC ZINC000045968023 1404255841 /nfs/dbraw/zinc/25/58/41/1404255841.db2.gz VYDBTUSGISAVER-NSHDSACASA-N 0 0 380.422 3.181 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1ccc2c(c1)CCC(=O)N2 ZINC000045978550 1404259754 /nfs/dbraw/zinc/25/97/54/1404259754.db2.gz JTOYJYTYRGKKED-GFCCVEGCSA-N 0 0 382.420 3.037 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000045983155 1404262282 /nfs/dbraw/zinc/26/22/82/1404262282.db2.gz FFQBRQLCFNCSNB-NSHDSACASA-N 0 0 398.375 3.187 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1 ZINC000045993113 1404265337 /nfs/dbraw/zinc/26/53/37/1404265337.db2.gz FAPYMEJUCHRERS-UHFFFAOYSA-N 0 0 378.406 3.038 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)CCCNC(=O)c1ccc(F)cc1F ZINC000045998225 1404268242 /nfs/dbraw/zinc/26/82/42/1404268242.db2.gz MWJMGUQLCWFYHP-UHFFFAOYSA-N 0 0 378.331 3.297 20 5 GGBDRN Cc1cc(N(C)C)ccc1NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000046015626 1404272845 /nfs/dbraw/zinc/27/28/45/1404272845.db2.gz VPQCPBWHTXTSBB-UHFFFAOYSA-N 0 0 383.452 3.323 20 5 GGBDRN COCCn1c(C)c(C)nc1SCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000046028945 1404278681 /nfs/dbraw/zinc/27/86/81/1404278681.db2.gz UAOWTGBTDQEEGY-UHFFFAOYSA-N 0 0 379.438 3.213 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N=c1[nH]cc(Cc2ccccc2F)s1 ZINC000046027887 1404278913 /nfs/dbraw/zinc/27/89/13/1404278913.db2.gz CQTKZEFRBNPIMR-UHFFFAOYSA-N 0 0 387.392 3.464 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(C[C@H](O)COc3cccc4ccccc43)n2)cc1 ZINC000046060862 1404286405 /nfs/dbraw/zinc/28/64/05/1404286405.db2.gz RAKQRFBYARXAPV-SFHVURJKSA-N 0 0 390.399 3.446 20 5 GGBDRN CCN(CC)C(=O)COc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1Cl ZINC000046063114 1404286889 /nfs/dbraw/zinc/28/68/89/1404286889.db2.gz VCAHZMGJGKZEIB-UHFFFAOYSA-N 0 0 394.815 3.076 20 5 GGBDRN C[C@@H]1CCCC[C@H]1OCCN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000046065521 1404287678 /nfs/dbraw/zinc/28/76/78/1404287678.db2.gz YPLHSISWQNFDHA-HUUCEWRRSA-N 0 0 381.498 3.009 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3ccc(OC)c([N+](=O)[O-])c3)c2)n1 ZINC000046067244 1404287824 /nfs/dbraw/zinc/28/78/24/1404287824.db2.gz KUUYVHSFIFCMKL-UHFFFAOYSA-N 0 0 394.387 3.168 20 5 GGBDRN CCOC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000046081771 1404292150 /nfs/dbraw/zinc/29/21/50/1404292150.db2.gz HMRBEIRFVGTIPU-HNNXBMFYSA-N 0 0 389.452 3.000 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)N(C)Cc3ccccc3[N+](=O)[O-])cn2)n1 ZINC000046119407 1404303479 /nfs/dbraw/zinc/30/34/79/1404303479.db2.gz KOGOLVZVFAEKNA-UHFFFAOYSA-N 0 0 394.435 3.134 20 5 GGBDRN COCCN(C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1)C1CC1 ZINC000046134030 1404309520 /nfs/dbraw/zinc/30/95/20/1404309520.db2.gz RILMWPAAQYISFV-GJZGRUSLSA-N 0 0 375.469 3.328 20 5 GGBDRN O=C(/C=C/c1ccc(I)o1)NCc1ccccc1[N+](=O)[O-] ZINC000046136742 1404309821 /nfs/dbraw/zinc/30/98/21/1404309821.db2.gz IVCSZLQMFUWEBW-SOFGYWHQSA-N 0 0 398.156 3.122 20 5 GGBDRN Cc1ccc(NC(=O)CS[C@H](C)C(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000046136667 1404309908 /nfs/dbraw/zinc/30/99/08/1404309908.db2.gz VLJJKZKPWBKWIP-CQSZACIVSA-N 0 0 387.461 3.280 20 5 GGBDRN Cc1ccc(NC(=O)CS[C@@H](C)C(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000046136665 1404310113 /nfs/dbraw/zinc/31/01/13/1404310113.db2.gz VLJJKZKPWBKWIP-AWEZNQCLSA-N 0 0 387.461 3.280 20 5 GGBDRN O=C(CCOc1ccccc1Cl)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000046142323 1404310517 /nfs/dbraw/zinc/31/05/17/1404310517.db2.gz JCDQANKYPINGPH-UHFFFAOYSA-N 0 0 389.839 3.366 20 5 GGBDRN O=C(Cc1csc(NC(=O)c2ccccc2)n1)NCc1ccccc1[N+](=O)[O-] ZINC000046148088 1404311250 /nfs/dbraw/zinc/31/12/50/1404311250.db2.gz QYWUIPNTKDYDNV-UHFFFAOYSA-N 0 0 396.428 3.163 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000046148195 1404311445 /nfs/dbraw/zinc/31/14/45/1404311445.db2.gz ASTNROHNWSKEPP-INIZCTEOSA-N 0 0 375.812 3.132 20 5 GGBDRN CCOc1ccccc1C(=O)N[C@@H](C(=O)NCc1ccccc1[N+](=O)[O-])C(C)C ZINC000046147001 1404311733 /nfs/dbraw/zinc/31/17/33/1404311733.db2.gz GXAMPMCTJDKUJS-LJQANCHMSA-N 0 0 399.447 3.064 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1nn(-c2ccccc2F)c2c1CCC2 ZINC000046149929 1404312464 /nfs/dbraw/zinc/31/24/64/1404312464.db2.gz ZTGLVZUDXKGGRS-UHFFFAOYSA-N 0 0 380.379 3.338 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccccc1[N+](=O)[O-] ZINC000046149747 1404312599 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FSMRFEQEZBVBNI-UHFFFAOYSA-N 0 0 393.440 3.247 20 5 GGBDRN CC[C@@H](c1ccccc1)N1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000057860449 1407740574 /nfs/dbraw/zinc/74/05/74/1407740574.db2.gz VQUVAAVEVGUQGE-KRWDZBQOSA-N 0 0 389.477 3.052 20 5 GGBDRN Cc1ccc(CN(C)C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000057885724 1407745718 /nfs/dbraw/zinc/74/57/18/1407745718.db2.gz HJJODVFHDLVELF-UHFFFAOYSA-N 0 0 383.404 3.250 20 5 GGBDRN O=C(NC[C@H]1COc2ccccc2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000057892797 1407748659 /nfs/dbraw/zinc/74/86/59/1407748659.db2.gz IWOJBDXQSZCNRM-HNNXBMFYSA-N 0 0 381.432 3.176 20 5 GGBDRN CCN(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000057896058 1407749624 /nfs/dbraw/zinc/74/96/24/1407749624.db2.gz NQZOPVZFJMOSOV-UHFFFAOYSA-N 0 0 387.367 3.475 20 5 GGBDRN COc1ccc([C@H](NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000057894880 1407749725 /nfs/dbraw/zinc/74/97/25/1407749725.db2.gz BCLNTNWXZJBXQG-AUUYWEPGSA-N 0 0 399.447 3.235 20 5 GGBDRN COc1ccc([C@@H](NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000057894881 1407750050 /nfs/dbraw/zinc/75/00/50/1407750050.db2.gz BCLNTNWXZJBXQG-LIRRHRJNSA-N 0 0 399.447 3.235 20 5 GGBDRN O=C(c1cc(F)c(Cl)nc1Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000057912701 1407754523 /nfs/dbraw/zinc/75/45/23/1407754523.db2.gz XIZSYRKELOKPII-UHFFFAOYSA-N 0 0 399.209 3.398 20 5 GGBDRN O=C(COc1cc(F)ccc1[N+](=O)[O-])N(Cc1ccco1)CC(F)(F)F ZINC000057914023 1407754922 /nfs/dbraw/zinc/75/49/22/1407754922.db2.gz YAFCPASYHJMSHD-UHFFFAOYSA-N 0 0 376.262 3.297 20 5 GGBDRN Cc1c(NCC(=O)NCCc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000058029641 1407771607 /nfs/dbraw/zinc/77/16/07/1407771607.db2.gz QHALMQQIKMMBGU-UHFFFAOYSA-N 0 0 379.363 3.275 20 5 GGBDRN Cc1cc2oc(=O)cc(Cn3cnc4ccc([N+](=O)[O-])cc4c3=O)c2cc1C ZINC000058076278 1407780233 /nfs/dbraw/zinc/78/02/33/1407780233.db2.gz WJDWPTDHGSFVHH-UHFFFAOYSA-N 0 0 377.356 3.076 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000058139232 1407788918 /nfs/dbraw/zinc/78/89/18/1407788918.db2.gz DPOXLCYVTIBHPM-SFHVURJKSA-N 0 0 383.404 3.155 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCCO[C@H](C)c1ccccc1 ZINC000058176364 1407793244 /nfs/dbraw/zinc/79/32/44/1407793244.db2.gz YBQSGLRLOIPSNO-OAHLLOKOSA-N 0 0 378.450 3.349 20 5 GGBDRN CCOc1ccc2c(c1)CN(S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000058211322 1407797662 /nfs/dbraw/zinc/79/76/62/1407797662.db2.gz DRDROJLHIDOCRK-UHFFFAOYSA-N 0 0 376.434 3.049 20 5 GGBDRN CCOc1ccc2c(c1)CN(Cn1cnc(-c3ccc([N+](=O)[O-])cc3)n1)CC2 ZINC000058207114 1407797789 /nfs/dbraw/zinc/79/77/89/1407797789.db2.gz DNOXRAZSZQOBDN-UHFFFAOYSA-N 0 0 379.420 3.268 20 5 GGBDRN Cc1[nH]c2ccccc2c1C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000058231677 1407800757 /nfs/dbraw/zinc/80/07/57/1407800757.db2.gz RNNYRPFUXDVYQQ-UHFFFAOYSA-N 0 0 398.444 3.044 20 5 GGBDRN COc1ccc(CCNC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])c(OC)c1 ZINC000058250416 1407802317 /nfs/dbraw/zinc/80/23/17/1407802317.db2.gz JGZICRYIDWHXPT-UHFFFAOYSA-N 0 0 388.420 3.048 20 5 GGBDRN COc1ccc(N(C)C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cn1 ZINC000058270798 1407804732 /nfs/dbraw/zinc/80/47/32/1407804732.db2.gz NSCKFRWPHLGECM-UHFFFAOYSA-N 0 0 395.419 3.137 20 5 GGBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCN(c2ncccc2Cl)CC1 ZINC000058284511 1407806654 /nfs/dbraw/zinc/80/66/54/1407806654.db2.gz CJNDHYRPSMPENG-UHFFFAOYSA-N 0 0 385.811 3.087 20 5 GGBDRN O=C(Nc1ccc(-c2nnco2)cc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000058292068 1407807729 /nfs/dbraw/zinc/80/77/29/1407807729.db2.gz PJAIBWQNKOBMBB-UHFFFAOYSA-N 0 0 376.332 3.083 20 5 GGBDRN O=C(Nc1ccc(-c2nnco2)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000058291243 1407807840 /nfs/dbraw/zinc/80/78/40/1407807840.db2.gz ADFIEIWZRKAKFM-UHFFFAOYSA-N 0 0 379.376 3.497 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cn1c(CSC)nc2ccccc21 ZINC000058340439 1407814427 /nfs/dbraw/zinc/81/44/27/1407814427.db2.gz XCZDVAVSCNJDIU-UHFFFAOYSA-N 0 0 386.433 3.455 20 5 GGBDRN 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KWTHPIHASXKOLM-OAHLLOKOSA-N 0 0 391.836 3.368 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067329524 1409076920 /nfs/dbraw/zinc/07/69/20/1409076920.db2.gz DSDKDEVUFKSKNU-CQSZACIVSA-N 0 0 383.448 3.327 20 5 GGBDRN CC(=O)NC[C@H]1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000067363854 1409086158 /nfs/dbraw/zinc/08/61/58/1409086158.db2.gz ZNEQSHBRUFYDHA-MRXNPFEDSA-N 0 0 396.447 3.327 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](OCCCc2ccccc2)C1 ZINC000176594175 1428373717 /nfs/dbraw/zinc/37/37/17/1428373717.db2.gz MBMFVNJXDOAECN-HXUWFJFHSA-N 0 0 384.432 3.224 20 5 GGBDRN NC(=O)c1ccc(N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 ZINC000067373849 1409090451 /nfs/dbraw/zinc/09/04/51/1409090451.db2.gz FUAHNXRCEBYQSC-GOSISDBHSA-N 0 0 389.839 3.297 20 5 GGBDRN CN(Cc1nc2ccccc2s1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375257 1409090864 /nfs/dbraw/zinc/09/08/64/1409090864.db2.gz DBBVZTTYXVXWNP-MRXNPFEDSA-N 0 0 382.445 3.442 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374748 1409090984 /nfs/dbraw/zinc/09/09/84/1409090984.db2.gz OSPRMICCTDVVBQ-KRWDZBQOSA-N 0 0 391.374 3.434 20 5 GGBDRN O=C(c1ccccc1)C1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000067376221 1409091592 /nfs/dbraw/zinc/09/15/92/1409091592.db2.gz MXLWPBJFZHXGRS-FQEVSTJZSA-N 0 0 393.443 3.295 20 5 GGBDRN CC[C@H](C)Oc1ccc(NC(=O)C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000067377822 1409092546 /nfs/dbraw/zinc/09/25/46/1409092546.db2.gz SPASJQXCEJWTFT-AWEZNQCLSA-N 0 0 385.420 3.070 20 5 GGBDRN CC[C@@H](C)Oc1cccc(NC(=O)C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000067377841 1409092617 /nfs/dbraw/zinc/09/26/17/1409092617.db2.gz RVHQTGFIMDUVPP-CQSZACIVSA-N 0 0 385.420 3.070 20 5 GGBDRN COc1ccc(CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])c(OC)c1 ZINC000067383047 1409095641 /nfs/dbraw/zinc/09/56/41/1409095641.db2.gz SJBOYBGCZNFAGG-UHFFFAOYSA-N 0 0 396.403 3.189 20 5 GGBDRN COc1ccc(CC[C@H](C)Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000067383526 1409096253 /nfs/dbraw/zinc/09/62/53/1409096253.db2.gz PZRZCTCCFOJIEX-ZDUSSCGKSA-N 0 0 378.450 3.440 20 5 GGBDRN CC(C)OCCOC[C@H](O)CN(C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000176596783 1428374795 /nfs/dbraw/zinc/37/47/95/1428374795.db2.gz SMUVRGKTKLAZSN-GOSISDBHSA-N 0 0 396.487 3.263 20 5 GGBDRN Cc1occc1-c1nnc(S[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)n1C ZINC000067428533 1409115893 /nfs/dbraw/zinc/11/58/93/1409115893.db2.gz XCYCZSJZUCCMMA-HNNXBMFYSA-N 0 0 399.432 3.189 20 5 GGBDRN O=C1[C@H](Sc2nnc(C3CC3)n2C2CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067428803 1409115964 /nfs/dbraw/zinc/11/59/64/1409115964.db2.gz FITBACXHCSPUNU-OAHLLOKOSA-N 0 0 385.449 3.296 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000067429255 1409115986 /nfs/dbraw/zinc/11/59/86/1409115986.db2.gz CCBDILJIARVCQO-QGZVFWFLSA-N 0 0 394.424 3.059 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ncc(-c3cccs3)o2)C1=O ZINC000067429386 1409116127 /nfs/dbraw/zinc/11/61/27/1409116127.db2.gz AKWGAPCYZXLYHE-SFHVURJKSA-N 0 0 398.400 3.279 20 5 GGBDRN O=C1[C@@H](Sc2nnc(C3CC3)n2C2CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067428802 1409116290 /nfs/dbraw/zinc/11/62/90/1409116290.db2.gz FITBACXHCSPUNU-HNNXBMFYSA-N 0 0 385.449 3.296 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1CCC(F)(F)F ZINC000176601641 1428376309 /nfs/dbraw/zinc/37/63/09/1428376309.db2.gz DIYMLMKWICNQED-UHFFFAOYSA-N 0 0 395.337 3.345 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2cccc(OCC(C)C)c2)cc1[N+](=O)[O-] ZINC000067441202 1409118853 /nfs/dbraw/zinc/11/88/53/1409118853.db2.gz AOADAFGNSMSVSF-UHFFFAOYSA-N 0 0 385.420 3.193 20 5 GGBDRN CCOCCOCc1cccc(N[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000067452407 1409122290 /nfs/dbraw/zinc/12/22/90/1409122290.db2.gz VXVBTBRFIKAAAV-FQEVSTJZSA-N 0 0 399.447 3.365 20 5 GGBDRN O=C1[C@@H](Nc2ccc(OC[C@@H]3CCCO3)cc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067452422 1409122407 /nfs/dbraw/zinc/12/24/07/1409122407.db2.gz 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O=C(OCc1coc(-c2ccccc2)n1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067484338 1409133403 /nfs/dbraw/zinc/13/34/03/1409133403.db2.gz DGRSLNRQYAEWIC-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN CCN(CC(C)(C)O)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000176607314 1428377882 /nfs/dbraw/zinc/37/78/82/1428377882.db2.gz OGTQTEKDNYLEFB-CQSZACIVSA-N 0 0 386.452 3.396 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000067493410 1409135487 /nfs/dbraw/zinc/13/54/87/1409135487.db2.gz WJNKOTPGDAAJOA-DNVCBOLYSA-N 0 0 381.432 3.006 20 5 GGBDRN C[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000067493405 1409135657 /nfs/dbraw/zinc/13/56/57/1409135657.db2.gz WJNKOTPGDAAJOA-KXBFYZLASA-N 0 0 381.432 3.006 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000067493408 1409135770 /nfs/dbraw/zinc/13/57/70/1409135770.db2.gz WJNKOTPGDAAJOA-HNAYVOBHSA-N 0 0 381.432 3.006 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(SC(F)F)c1 ZINC000067495955 1409136836 /nfs/dbraw/zinc/13/68/36/1409136836.db2.gz WHQVTCQKZDZJEZ-UHFFFAOYSA-N 0 0 381.360 3.164 20 5 GGBDRN Cc1ccc(C)c2sc(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)nc21 ZINC000067507813 1409140927 /nfs/dbraw/zinc/14/09/27/1409140927.db2.gz MKYULBVRZVJXSQ-UHFFFAOYSA-N 0 0 384.417 3.190 20 5 GGBDRN Cn1ccc(C(=O)OCc2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)cc1=O ZINC000176608988 1428378530 /nfs/dbraw/zinc/37/85/30/1428378530.db2.gz VQWZPXOTCRCWJZ-UHFFFAOYSA-N 0 0 380.356 3.443 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)cc1[N+](=O)[O-] ZINC000067523276 1409143020 /nfs/dbraw/zinc/14/30/20/1409143020.db2.gz JCNRXWFALUSYGC-UHFFFAOYSA-N 0 0 399.338 3.066 20 5 GGBDRN Cc1ccc2cccc(NC(=O)C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)c2n1 ZINC000067532503 1409149034 /nfs/dbraw/zinc/14/90/34/1409149034.db2.gz UFDOPMVEDKKRFW-CYBMUJFWSA-N 0 0 378.388 3.267 20 5 GGBDRN C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000067536635 1409151000 /nfs/dbraw/zinc/15/10/00/1409151000.db2.gz GCKVFTXJUPPFER-ZDUSSCGKSA-N 0 0 397.435 3.439 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000067536535 1409151188 /nfs/dbraw/zinc/15/11/88/1409151188.db2.gz TXJVBNKUBKEIQO-GOSISDBHSA-N 0 0 385.420 3.477 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000067536327 1409151248 /nfs/dbraw/zinc/15/12/48/1409151248.db2.gz ZVABUMKVWQXILJ-LJQANCHMSA-N 0 0 383.404 3.317 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)c1 ZINC000067538747 1409151933 /nfs/dbraw/zinc/15/19/33/1409151933.db2.gz TYOWZESEJLSUCG-UHFFFAOYSA-N 0 0 385.420 3.239 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(Cc2cccs2)C[C@H]2CCCO2)c1 ZINC000067540493 1409152840 /nfs/dbraw/zinc/15/28/40/1409152840.db2.gz ZODKDFXENFIZLR-CQSZACIVSA-N 0 0 376.434 3.486 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccn(-c2cccc(F)c2)n1 ZINC000067543038 1409153618 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394.431 3.378 20 5 GGBDRN Cc1c(NC(=O)NCc2cccc(CN3CCO[C@@H](C)C3)c2)cccc1[N+](=O)[O-] ZINC000067558146 1409161905 /nfs/dbraw/zinc/16/19/05/1409161905.db2.gz VGTVRVLXKPOZOC-HNNXBMFYSA-N 0 0 398.463 3.446 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000067575874 1409173139 /nfs/dbraw/zinc/17/31/39/1409173139.db2.gz UOBRKXOFRQITCY-UHFFFAOYSA-N 0 0 391.815 3.440 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000067593000 1409179177 /nfs/dbraw/zinc/17/91/77/1409179177.db2.gz OXAULWZULBEIRJ-UHFFFAOYSA-N 0 0 383.383 3.327 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@@H](c2ccccc2)CC1 ZINC000067598671 1409182302 /nfs/dbraw/zinc/18/23/02/1409182302.db2.gz HCQXHQBWYFUPQC-MRXNPFEDSA-N 0 0 397.431 3.338 20 5 GGBDRN CCSCCOC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000067623447 1409189534 /nfs/dbraw/zinc/18/95/34/1409189534.db2.gz HAMQNCKJASSAAY-UHFFFAOYSA-N 0 0 381.191 3.109 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000067627535 1409190363 /nfs/dbraw/zinc/19/03/63/1409190363.db2.gz LUAGVUKAQXNFHT-UHFFFAOYSA-N 0 0 383.326 3.394 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)CCc1ccccc1OC(F)(F)F ZINC000067627513 1409190418 /nfs/dbraw/zinc/19/04/18/1409190418.db2.gz OUXURLHBIKBFIC-UHFFFAOYSA-N 0 0 387.314 3.174 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1F ZINC000067646721 1409197278 /nfs/dbraw/zinc/19/72/78/1409197278.db2.gz FVTSUYYXAHIKBV-UHFFFAOYSA-N 0 0 383.383 3.227 20 5 GGBDRN Cc1sc(NC(=O)CCn2cc([N+](=O)[O-])cn2)nc1-c1ccc(F)cc1 ZINC000067658141 1409199506 /nfs/dbraw/zinc/19/95/06/1409199506.db2.gz MVZLZVKQIRLFRO-UHFFFAOYSA-N 0 0 375.385 3.391 20 5 GGBDRN COc1ccc(-c2csc(NC(=O)CCn3cc([N+](=O)[O-])cn3)n2)cc1F ZINC000067658631 1409199779 /nfs/dbraw/zinc/19/97/79/1409199779.db2.gz GEYQAGOHOWHMAO-UHFFFAOYSA-N 0 0 391.384 3.091 20 5 GGBDRN CN(C[C@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C ZINC000067687476 1409207534 /nfs/dbraw/zinc/20/75/34/1409207534.db2.gz RBWFZMOXQTZGOE-MRXNPFEDSA-N 0 0 391.468 3.243 20 5 GGBDRN COc1cccc(CN(C[C@H]2CCCO2)C(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000067722738 1409215169 /nfs/dbraw/zinc/21/51/69/1409215169.db2.gz RWOFSBBUIUPIBM-HXUWFJFHSA-N 0 0 399.447 3.494 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nncn1C(C)(C)C ZINC000067752993 1409221961 /nfs/dbraw/zinc/22/19/61/1409221961.db2.gz XJQKHYPUOACKAY-SNVBAGLBSA-N 0 0 379.442 3.069 20 5 GGBDRN CC[C@@H](C)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000067753782 1409222306 /nfs/dbraw/zinc/22/23/06/1409222306.db2.gz HAMBVTOPBNOHCZ-GFCCVEGCSA-N 0 0 392.433 3.428 20 5 GGBDRN CCOc1cc(NC(=O)C(=O)N(CC)[C@H](C)C(C)C)c([N+](=O)[O-])cc1OCC ZINC000067763219 1409224328 /nfs/dbraw/zinc/22/43/28/1409224328.db2.gz GHTQWARICYPCDM-CYBMUJFWSA-N 0 0 395.456 3.224 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3)c2)oc1C ZINC000067766061 1409225142 /nfs/dbraw/zinc/22/51/42/1409225142.db2.gz WGARDHWDOIWGSU-UHFFFAOYSA-N 0 0 394.387 3.122 20 5 GGBDRN CCN(c1ccc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000067766389 1409225393 /nfs/dbraw/zinc/22/53/93/1409225393.db2.gz ALNARQLMSNTPMR-UHFFFAOYSA-N 0 0 384.436 3.084 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccccc2N2CCCC2=O)cc1[N+](=O)[O-] ZINC000067772899 1409227202 /nfs/dbraw/zinc/22/72/02/1409227202.db2.gz UIGDXANETNEZBZ-UHFFFAOYSA-N 0 0 384.348 3.191 20 5 GGBDRN COc1ccc(Cl)cc1C1(CNC(=O)c2ccc([N+](=O)[O-])o2)CCOCC1 ZINC000067775456 1409227974 /nfs/dbraw/zinc/22/79/74/1409227974.db2.gz JNAUNAZJYCRXJJ-UHFFFAOYSA-N 0 0 394.811 3.328 20 5 GGBDRN COc1ccc([C@H](C)CC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000176628873 1428384861 /nfs/dbraw/zinc/38/48/61/1428384861.db2.gz CGOYHWCSVDCOJY-GDBMZVCRSA-N 0 0 384.436 3.205 20 5 GGBDRN COc1ccc(CC(=O)N2CCN(c3cccc(C)c3C)CC2)cc1[N+](=O)[O-] ZINC000067789078 1409231381 /nfs/dbraw/zinc/23/13/81/1409231381.db2.gz MDHZZNIUYDONNT-UHFFFAOYSA-N 0 0 383.448 3.112 20 5 GGBDRN COC(=O)c1c(C)c(C)sc1NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067790116 1409231858 /nfs/dbraw/zinc/23/18/58/1409231858.db2.gz PNSYSJOAVQDIOC-UHFFFAOYSA-N 0 0 378.406 3.250 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(NC(=O)C(C)C)cc2)cc1[N+](=O)[O-] ZINC000067797323 1409233153 /nfs/dbraw/zinc/23/31/53/1409233153.db2.gz XZQDKLHHCSWNMO-UHFFFAOYSA-N 0 0 385.420 3.057 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1[N+](=O)[O-] ZINC000067800015 1409233589 /nfs/dbraw/zinc/23/35/89/1409233589.db2.gz WPHCOLZLEYFRKV-CYBMUJFWSA-N 0 0 397.431 3.372 20 5 GGBDRN C[S@@](=O)c1ccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000176630714 1428385407 /nfs/dbraw/zinc/38/54/07/1428385407.db2.gz ATYWCFGIVDYTGU-AREMUKBSSA-N 0 0 396.852 3.071 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000176630726 1428385420 /nfs/dbraw/zinc/38/54/20/1428385420.db2.gz ATYWCFGIVDYTGU-SANMLTNESA-N 0 0 396.852 3.071 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(C(=O)N(C)C)ccc2Cl)cc1[N+](=O)[O-] ZINC000067810004 1409236214 /nfs/dbraw/zinc/23/62/14/1409236214.db2.gz GNPDBKGPLROAHX-UHFFFAOYSA-N 0 0 391.811 3.140 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(OCC(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000067814419 1409236842 /nfs/dbraw/zinc/23/68/42/1409236842.db2.gz ZTLWTXHNVCZZCE-UHFFFAOYSA-N 0 0 385.298 3.121 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(NC(=O)C3CC3)ccc2C)cc1[N+](=O)[O-] ZINC000067814375 1409236882 /nfs/dbraw/zinc/23/68/82/1409236882.db2.gz UUATXUNXMRSXRZ-UHFFFAOYSA-N 0 0 383.404 3.442 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(OC3CCCC3)nc2)cc1[N+](=O)[O-] ZINC000067815899 1409237154 /nfs/dbraw/zinc/23/71/54/1409237154.db2.gz TUPAPHQPPHNQEB-UHFFFAOYSA-N 0 0 385.420 3.179 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000067815466 1409237232 /nfs/dbraw/zinc/23/72/32/1409237232.db2.gz CKWCEPCCIGZMCS-AWEZNQCLSA-N 0 0 399.447 3.447 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(OCc3nccn3C)cc2)cc1[N+](=O)[O-] ZINC000067816054 1409237290 /nfs/dbraw/zinc/23/72/90/1409237290.db2.gz IXRGLDXKPBFTTQ-UHFFFAOYSA-N 0 0 396.403 3.097 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](C)COc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000067819297 1409237567 /nfs/dbraw/zinc/23/75/67/1409237567.db2.gz VYSZARGYHKWQGZ-NSHDSACASA-N 0 0 380.347 3.008 20 5 GGBDRN COc1ccc(CC(=O)NCc2cccc(NC(=O)CC(C)C)c2)cc1[N+](=O)[O-] ZINC000067819879 1409237589 /nfs/dbraw/zinc/23/75/89/1409237589.db2.gz GSBHHGUVNAWMEU-UHFFFAOYSA-N 0 0 399.447 3.447 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000067819121 1409237622 /nfs/dbraw/zinc/23/76/22/1409237622.db2.gz SUYIUCWELYDRCD-CQSZACIVSA-N 0 0 376.796 3.439 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](C)c2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000067820057 1409237827 /nfs/dbraw/zinc/23/78/27/1409237827.db2.gz KAKIACYTZFBAMG-AWEZNQCLSA-N 0 0 397.431 3.150 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc3c(c2)CCCN3C(C)=O)cc1[N+](=O)[O-] ZINC000067822929 1409238120 /nfs/dbraw/zinc/23/81/20/1409238120.db2.gz RSZBRLIKTGYEMP-UHFFFAOYSA-N 0 0 383.404 3.084 20 5 GGBDRN CCCN(C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 ZINC000067822775 1409238325 /nfs/dbraw/zinc/23/83/25/1409238325.db2.gz BNVIANGJDUZCHC-OAHLLOKOSA-N 0 0 399.447 3.412 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc2c(c1)NC(=O)CS2 ZINC000067824515 1409238806 /nfs/dbraw/zinc/23/88/06/1409238806.db2.gz HOUMEOZZIWZKET-UHFFFAOYSA-N 0 0 382.401 3.232 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](COCC(C)C)c2ccco2)cc1[N+](=O)[O-] ZINC000067823394 1409238817 /nfs/dbraw/zinc/23/88/17/1409238817.db2.gz SWLGNWGFVDZTRB-OAHLLOKOSA-N 0 0 376.409 3.269 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@H](c2ccccc2)O1 ZINC000067827148 1409239352 /nfs/dbraw/zinc/23/93/52/1409239352.db2.gz UHYCOBGLEWPWGJ-MGPUTAFESA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@H](c2ccccc2)O1 ZINC000067827131 1409239409 /nfs/dbraw/zinc/23/94/09/1409239409.db2.gz CMGNBIZPABLOPC-MGPUTAFESA-N 0 0 392.415 3.383 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCC1(c2ccccc2)CCOCC1 ZINC000067829883 1409240213 /nfs/dbraw/zinc/24/02/13/1409240213.db2.gz CJGCGNZEBCXCAZ-UHFFFAOYSA-N 0 0 393.443 3.414 20 5 GGBDRN COc1ccc(CC(=O)NCc2cccc(OCC(F)F)c2)cc1[N+](=O)[O-] ZINC000067834522 1409241093 /nfs/dbraw/zinc/24/10/93/1409241093.db2.gz UPUPQEMTINOWPX-UHFFFAOYSA-N 0 0 380.347 3.106 20 5 GGBDRN CCOc1ccccc1CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000067845128 1409242745 /nfs/dbraw/zinc/24/27/45/1409242745.db2.gz ZNKDVGRIMARGTH-UHFFFAOYSA-N 0 0 380.404 3.152 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)Oc2cc(F)ccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000176633580 1428386126 /nfs/dbraw/zinc/38/61/26/1428386126.db2.gz NNENWUATSPHENA-UHFFFAOYSA-N 0 0 390.732 3.372 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)COc2c(C)cccc2C)c1 ZINC000067857662 1409245099 /nfs/dbraw/zinc/24/50/99/1409245099.db2.gz FCROIQGEKKCJIU-CQSZACIVSA-N 0 0 390.461 3.103 20 5 GGBDRN Cc1cccc(C)c1OC[C@@H](O)CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000067858164 1409245238 /nfs/dbraw/zinc/24/52/38/1409245238.db2.gz HEQLBBCTPMEKOQ-AWEZNQCLSA-N 0 0 378.812 3.035 20 5 GGBDRN C[C@@H]1CN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](c2ccccc2)O1 ZINC000067873900 1409247824 /nfs/dbraw/zinc/24/78/24/1409247824.db2.gz TUEWGCFNEOZYGK-DNVCBOLYSA-N 0 0 379.420 3.273 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)cc1C ZINC000067878983 1409248110 /nfs/dbraw/zinc/24/81/10/1409248110.db2.gz AGRQDLZLUYREEO-YJBOKZPZSA-N 0 0 390.461 3.362 20 5 GGBDRN C[C@H]1CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000067905077 1409253189 /nfs/dbraw/zinc/25/31/89/1409253189.db2.gz VKOAEFXVJYHNJX-VBKZILBWSA-N 0 0 381.432 3.453 20 5 GGBDRN Cc1c(CO)cc([N+](=O)[O-])c(N2C[C@@H](C)O[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000067905064 1409253211 /nfs/dbraw/zinc/25/32/11/1409253211.db2.gz QCBOULYGGBYFGX-PXAZEXFGSA-N 0 0 387.392 3.270 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1[N+](=O)[O-] ZINC000067904136 1409253306 /nfs/dbraw/zinc/25/33/06/1409253306.db2.gz HDEBKCYXINADOO-UHFFFAOYSA-N 0 0 386.408 3.315 20 5 GGBDRN Cc1c(C(=O)NC2(c3ccc(F)cc3)CCC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000067938019 1409260583 /nfs/dbraw/zinc/26/05/83/1409260583.db2.gz PNSCDXVEGNBEQK-UHFFFAOYSA-N 0 0 395.394 3.432 20 5 GGBDRN O=C(c1ccc(N2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1)N1CCOCC1 ZINC000067948803 1409262036 /nfs/dbraw/zinc/26/20/36/1409262036.db2.gz VBNHIVJKMQLGMO-INIZCTEOSA-N 0 0 387.461 3.470 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1OCc1nnnn1-c1ccccc1Br ZINC000067952388 1409263301 /nfs/dbraw/zinc/26/33/01/1409263301.db2.gz VOCAMLMPBUZKQJ-UHFFFAOYSA-N 0 0 394.160 3.051 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC([C@H](O)c2ccccc2)CC1 ZINC000067962406 1409264844 /nfs/dbraw/zinc/26/48/44/1409264844.db2.gz IRWVUQWLUVIXLW-OAQYLSRUSA-N 0 0 383.448 3.287 20 5 GGBDRN CN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000067963801 1409265522 /nfs/dbraw/zinc/26/55/22/1409265522.db2.gz XBEQVBBWOAWTCA-INIZCTEOSA-N 0 0 375.768 3.216 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H]1c2ccccc2CCN1C(C)=O ZINC000067976545 1409267653 /nfs/dbraw/zinc/26/76/53/1409267653.db2.gz AJOAPJBNRAUUMN-SFHVURJKSA-N 0 0 383.404 3.078 20 5 GGBDRN CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000067973318 1409267859 /nfs/dbraw/zinc/26/78/59/1409267859.db2.gz CZTPAQGBZLCMIV-NSHDSACASA-N 0 0 391.374 3.331 20 5 GGBDRN COCCOc1ccccc1N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000067989624 1409271244 /nfs/dbraw/zinc/27/12/44/1409271244.db2.gz YDDCGOGNOVLFIU-ZDUSSCGKSA-N 0 0 389.408 3.068 20 5 GGBDRN O=C(NC1CCCCC1)C1CCN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])CC1 ZINC000067991375 1409271856 /nfs/dbraw/zinc/27/18/56/1409271856.db2.gz MUOAPKXRYGPWIW-UHFFFAOYSA-N 0 0 395.406 3.174 20 5 GGBDRN Cc1c(C(=O)Nc2nc3c(s2)C(=O)CCC3)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000068003690 1409274223 /nfs/dbraw/zinc/27/42/23/1409274223.db2.gz PULCFZOWOYAETN-UHFFFAOYSA-N 0 0 376.350 3.039 20 5 GGBDRN Cn1c2ccccc2nc1[C@H]1CCCN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000068004788 1409274767 /nfs/dbraw/zinc/27/47/67/1409274767.db2.gz FUXNMQXFKXBEOK-GOSISDBHSA-N 0 0 380.404 3.224 20 5 GGBDRN CC(C)(C(=O)Nc1nnc(-c2cccc(Cl)c2)s1)n1cc([N+](=O)[O-])cn1 ZINC000068010674 1409275630 /nfs/dbraw/zinc/27/56/30/1409275630.db2.gz JLBDDJGBNNSULZ-UHFFFAOYSA-N 0 0 392.828 3.337 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1cc(F)ccc1Oc1ccccc1 ZINC000068029797 1409282826 /nfs/dbraw/zinc/28/28/26/1409282826.db2.gz JZRDDPCOIIUVMJ-UHFFFAOYSA-N 0 0 383.335 3.327 20 5 GGBDRN CC(C)OCc1cccc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000068032603 1409283074 /nfs/dbraw/zinc/28/30/74/1409283074.db2.gz PTDZMGPFNISKLO-CQSZACIVSA-N 0 0 385.420 3.277 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cc1[N+](=O)[O-] ZINC000068041120 1409284535 /nfs/dbraw/zinc/28/45/35/1409284535.db2.gz HBKVHZSLTHKYQD-UHFFFAOYSA-N 0 0 379.372 3.162 20 5 GGBDRN CC(C)[C@@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1nc(C2CC2)no1 ZINC000068046502 1409285763 /nfs/dbraw/zinc/28/57/63/1409285763.db2.gz DYIPCIJDVXCSNA-QGZVFWFLSA-N 0 0 383.408 3.323 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1nc(C2CC2)no1 ZINC000068047542 1409286270 /nfs/dbraw/zinc/28/62/70/1409286270.db2.gz NPTFMKWRPAGSJY-MRXNPFEDSA-N 0 0 396.407 3.168 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1nc(C2CC2)no1 ZINC000068047463 1409286323 /nfs/dbraw/zinc/28/63/23/1409286323.db2.gz YOWZYALMOKRIKB-INIZCTEOSA-N 0 0 396.407 3.168 20 5 GGBDRN Cc1c(C(=O)N[C@H](c2nc(C3CC3)no2)C(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000068049755 1409286750 /nfs/dbraw/zinc/28/67/50/1409286750.db2.gz QUHNQHTXSMYRIZ-AWEZNQCLSA-N 0 0 389.368 3.199 20 5 GGBDRN CC(C)[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nc(C2CC2)no1 ZINC000068050285 1409287059 /nfs/dbraw/zinc/28/70/59/1409287059.db2.gz BLACFTDTYVDMBQ-HNNXBMFYSA-N 0 0 376.438 3.461 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(OCC(F)(F)F)c1C ZINC000068054527 1409288141 /nfs/dbraw/zinc/28/81/41/1409288141.db2.gz KKBQQIXMRWEPML-UHFFFAOYSA-N 0 0 386.330 3.378 20 5 GGBDRN 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COCCN(Cc1cccnc1)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000068159333 1409318399 /nfs/dbraw/zinc/31/83/99/1409318399.db2.gz YGRPFAZVRRHAFM-ZDUSSCGKSA-N 0 0 393.827 3.086 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCOc3ccc(F)cc32)c([N+](=O)[O-])cc1OC ZINC000068165359 1409320647 /nfs/dbraw/zinc/32/06/47/1409320647.db2.gz VEKSOKIJWCFRLJ-ZDUSSCGKSA-N 0 0 376.340 3.005 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000068173980 1409323069 /nfs/dbraw/zinc/32/30/69/1409323069.db2.gz OTVIRPPFFIYPTB-GFCCVEGCSA-N 0 0 396.403 3.227 20 5 GGBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000068174490 1409323678 /nfs/dbraw/zinc/32/36/78/1409323678.db2.gz FYMBKSYPLAKWFF-NSHDSACASA-N 0 0 383.364 3.364 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000068174381 1409323783 /nfs/dbraw/zinc/32/37/83/1409323783.db2.gz DBUABBJDJPALBT-GFCCVEGCSA-N 0 0 398.419 3.473 20 5 GGBDRN Cc1c(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1F 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COCCOc1ncccc1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000068222111 1409334228 /nfs/dbraw/zinc/33/42/28/1409334228.db2.gz HIBWDXDDAFHTFR-UHFFFAOYSA-N 0 0 387.417 3.160 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N1N=C(c2ccc(C)cc2)C[C@@H]1c1ccco1 ZINC000068224668 1409334421 /nfs/dbraw/zinc/33/44/21/1409334421.db2.gz VGJNGSJLNXWKAD-QGZVFWFLSA-N 0 0 393.403 3.379 20 5 GGBDRN C[C@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000068243912 1409338957 /nfs/dbraw/zinc/33/89/57/1409338957.db2.gz IUZPDPQTNWWSLJ-AWEZNQCLSA-N 0 0 382.420 3.011 20 5 GGBDRN O=Cc1ccc(OCC(=O)N[C@@H](c2ccccc2)c2ccccn2)c([N+](=O)[O-])c1 ZINC000068260674 1409344208 /nfs/dbraw/zinc/34/42/08/1409344208.db2.gz OCSHOWWAZVEHQG-NRFANRHFSA-N 0 0 391.383 3.087 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccc2c(c1)OCCO2 ZINC000068265408 1409345079 /nfs/dbraw/zinc/34/50/79/1409345079.db2.gz SLFKYEDRALOKLP-NSHDSACASA-N 0 0 392.795 3.103 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(C(N)=O)c1 ZINC000068265629 1409345684 /nfs/dbraw/zinc/34/56/84/1409345684.db2.gz RAGURBKVFKGDJW-MRVPVSSYSA-N 0 0 398.202 3.407 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCc1cn2ccccc2n1 ZINC000068265809 1409345793 /nfs/dbraw/zinc/34/57/93/1409345793.db2.gz PUUWBGQTMNHDHK-GFCCVEGCSA-N 0 0 388.811 3.022 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000068265651 1409345892 /nfs/dbraw/zinc/34/58/92/1409345892.db2.gz XYOHTMOHXPIOFV-LLVKDONJSA-N 0 0 391.811 3.322 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc2c1OCCO2 ZINC000068266108 1409346203 /nfs/dbraw/zinc/34/62/03/1409346203.db2.gz QKSMQDYEAYSZIM-JTQLQIEISA-N 0 0 378.768 3.425 20 5 GGBDRN CCN(Cc1cnn(C)c1)C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000068268463 1409346330 /nfs/dbraw/zinc/34/63/30/1409346330.db2.gz NICRIINTHJKWIL-HOTGVXAUSA-N 0 0 399.495 3.473 20 5 GGBDRN COc1ccc(CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 ZINC000068266104 1409346415 /nfs/dbraw/zinc/34/64/15/1409346415.db2.gz JMBGRYOTDTYMHM-LLVKDONJSA-N 0 0 394.811 3.349 20 5 GGBDRN COCCN(CCCc1ccccc1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068269998 1409347586 /nfs/dbraw/zinc/34/75/86/1409347586.db2.gz OVRUZSQPHGZUQF-UHFFFAOYSA-N 0 0 382.420 3.193 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCn3c4ccccc4nc32)cc1[N+](=O)[O-] ZINC000176664449 1428396886 /nfs/dbraw/zinc/39/68/86/1428396886.db2.gz HBKUTGYGFNUUMR-UHFFFAOYSA-N 0 0 392.824 3.115 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000068278784 1409350647 /nfs/dbraw/zinc/35/06/47/1409350647.db2.gz SPJZBXVHZVHEOA-HUUCEWRRSA-N 0 0 398.463 3.240 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2ncc(Cc3ccccc3)s2)c([N+](=O)[O-])c1 ZINC000068285237 1409353162 /nfs/dbraw/zinc/35/31/62/1409353162.db2.gz IKUKXQPKIRVXAJ-UHFFFAOYSA-N 0 0 397.412 3.472 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCN2c3ccccc3C[C@H]2C)cc1OC ZINC000068293978 1409355235 /nfs/dbraw/zinc/35/52/35/1409355235.db2.gz XXBALXLHHQZXGM-CQSZACIVSA-N 0 0 399.447 3.183 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2ccccc2NCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000068310624 1409361629 /nfs/dbraw/zinc/36/16/29/1409361629.db2.gz XKMQDYLPKWWTPL-UHFFFAOYSA-N 0 0 397.309 3.399 20 5 GGBDRN O=C(Nc1cc(N2CCCS2(=O)=O)ccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000068315544 1409364247 /nfs/dbraw/zinc/36/42/47/1409364247.db2.gz JAXSFTQUZTWYMZ-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN CC(C)(C)c1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)n(-c2ncccn2)n1 ZINC000068315348 1409364251 /nfs/dbraw/zinc/36/42/51/1409364251.db2.gz BRYCIWSOQNHAGB-UHFFFAOYSA-N 0 0 380.408 3.049 20 5 GGBDRN Cc1ccc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ncccn2)cc1[N+](=O)[O-] ZINC000068315474 1409364308 /nfs/dbraw/zinc/36/43/08/1409364308.db2.gz IXOZUWBLIVMYMM-UHFFFAOYSA-N 0 0 380.408 3.429 20 5 GGBDRN CCc1cc(N[C@H](C)C(=O)NCc2ccco2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068320889 1409365423 /nfs/dbraw/zinc/36/54/23/1409365423.db2.gz MTAMXGDUFSVRIA-CYBMUJFWSA-N 0 0 395.419 3.324 20 5 GGBDRN CCCCN(CC)C(=O)c1ccc(I)c([N+](=O)[O-])c1 ZINC000068318756 1409365617 /nfs/dbraw/zinc/36/56/17/1409365617.db2.gz DQPSWDLIKSDFEH-UHFFFAOYSA-N 0 0 376.194 3.462 20 5 GGBDRN Cc1nccn1C[C@@H](C)CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000068359671 1409378099 /nfs/dbraw/zinc/37/80/99/1409378099.db2.gz YQMBTKNUSCGPCT-INIZCTEOSA-N 0 0 399.495 3.402 20 5 GGBDRN Cc1cc(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2F)ccc1[N+](=O)[O-] ZINC000068362093 1409379025 /nfs/dbraw/zinc/37/90/25/1409379025.db2.gz JDHAPWNEUBSZFY-MRXNPFEDSA-N 0 0 389.408 3.196 20 5 GGBDRN Cc1ccc(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2F)cc1[N+](=O)[O-] ZINC000068362519 1409379607 /nfs/dbraw/zinc/37/96/07/1409379607.db2.gz WQCXLWPAMLDTFC-INIZCTEOSA-N 0 0 389.408 3.196 20 5 GGBDRN C[C@H](NC(=O)N1CCCN(c2nccs2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000068364288 1409380783 /nfs/dbraw/zinc/38/07/83/1409380783.db2.gz GEGSPNABJQUEOU-ZDUSSCGKSA-N 0 0 375.454 3.034 20 5 GGBDRN COc1ccc(NC(=O)c2ccc(I)c([N+](=O)[O-])c2)cc1 ZINC000068369165 1409381872 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Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(Cc2ccccc2)[nH]1 ZINC000071234075 1409823083 /nfs/dbraw/zinc/82/30/83/1409823083.db2.gz YWBVKBPNSKSPEQ-UHFFFAOYSA-N 0 0 383.433 3.343 20 5 GGBDRN C[C@H]1CCc2c(sc3ncn(CC(=O)c4cccc([N+](=O)[O-])c4)c(=O)c32)C1 ZINC000071434055 1409823377 /nfs/dbraw/zinc/82/33/77/1409823377.db2.gz PLZBTJAMNFIAPX-NSHDSACASA-N 0 0 383.429 3.374 20 5 GGBDRN O=C(CCN1CCN(c2ccccc2Cl)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000071829561 1409826232 /nfs/dbraw/zinc/82/62/32/1409826232.db2.gz IWENDBJBIFKUPI-UHFFFAOYSA-N 0 0 388.855 3.399 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N(CCN1CCOCC1)c1ccccc1 ZINC000071835776 1409826576 /nfs/dbraw/zinc/82/65/76/1409826576.db2.gz OPEGBSQRNIQRCQ-UHFFFAOYSA-N 0 0 389.839 3.227 20 5 GGBDRN Cc1csc(=O)n1CCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000071832357 1409826688 /nfs/dbraw/zinc/82/66/88/1409826688.db2.gz UGKWFBIJDWAINO-UHFFFAOYSA-N 0 0 390.446 3.279 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000071872587 1409828458 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399.447 3.465 20 5 GGBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000072005349 1409836019 /nfs/dbraw/zinc/83/60/19/1409836019.db2.gz KJSSPZSJPZNCFE-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)N(C)c1ccccc1 ZINC000072009693 1409836785 /nfs/dbraw/zinc/83/67/85/1409836785.db2.gz LXFYYNQFFKKALF-INIZCTEOSA-N 0 0 382.464 3.450 20 5 GGBDRN COc1ccccc1CN(C[C@H]1CCCO1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000072011675 1409837104 /nfs/dbraw/zinc/83/71/04/1409837104.db2.gz ROCQJYHXSQGOFZ-GOSISDBHSA-N 0 0 384.432 3.354 20 5 GGBDRN COc1ccc(OC)c(CN2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)c1 ZINC000072015151 1409837994 /nfs/dbraw/zinc/83/79/94/1409837994.db2.gz RTELURJPCVPQEL-UHFFFAOYSA-N 0 0 375.400 3.073 20 5 GGBDRN CCc1cc(NCCNC(=O)c2ccco2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000072018805 1409837997 /nfs/dbraw/zinc/83/79/97/1409837997.db2.gz SCIBBHUAGRKICG-UHFFFAOYSA-N 0 0 381.392 3.049 20 5 GGBDRN Cc1ccc(O)c(NC(=O)c2cc([N+](=O)[O-])ccc2I)c1 ZINC000072015692 1409838010 /nfs/dbraw/zinc/83/80/10/1409838010.db2.gz XFMRCCLODDAVNN-UHFFFAOYSA-N 0 0 398.156 3.466 20 5 GGBDRN COc1ccc2c(c1)CN(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)CC2 ZINC000072030321 1409838616 /nfs/dbraw/zinc/83/86/16/1409838616.db2.gz PFNIJKXTSIYXQM-UHFFFAOYSA-N 0 0 381.432 3.402 20 5 GGBDRN C[C@@H]1CN(Cc2cccc(CNC(=O)Nc3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000072033174 1409839208 /nfs/dbraw/zinc/83/92/08/1409839208.db2.gz VBUDSASYKNXLOO-OAHLLOKOSA-N 0 0 384.436 3.137 20 5 GGBDRN O=C(NC[C@H](O)COc1cccc(C(F)(F)F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000072033204 1409839240 /nfs/dbraw/zinc/83/92/40/1409839240.db2.gz SUQLBXSNBFXFRC-AWEZNQCLSA-N 0 0 399.325 3.175 20 5 GGBDRN CC[C@H](c1ccccc1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000072048648 1409841478 /nfs/dbraw/zinc/84/14/78/1409841478.db2.gz PYXGCVWTLYFCGN-LJQANCHMSA-N 0 0 389.477 3.052 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000072051657 1409841954 /nfs/dbraw/zinc/84/19/54/1409841954.db2.gz YYIFFRDLIHLQPE-MRXNPFEDSA-N 0 0 391.468 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1OS(=O)(=O)c1cc(Br)ccc1F ZINC000072054723 1409842093 /nfs/dbraw/zinc/84/20/93/1409842093.db2.gz SHVQCORHCMBPNX-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000176721890 1428434384 /nfs/dbraw/zinc/43/43/84/1428434384.db2.gz NPCWKCAKZIBUSX-CQSZACIVSA-N 0 0 389.481 3.343 20 5 GGBDRN CC(C)COC(=O)N1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000072066897 1409844454 /nfs/dbraw/zinc/84/44/54/1409844454.db2.gz LLYFHYQTOJPQRW-UHFFFAOYSA-N 0 0 383.832 3.189 20 5 GGBDRN COC[C@H](C)n1c(C)cc(C(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)c1C ZINC000072066360 1409844456 /nfs/dbraw/zinc/84/44/56/1409844456.db2.gz UXRWFWYPPOKJET-AWEZNQCLSA-N 0 0 397.435 3.362 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc1[N+](=O)[O-] ZINC000176722820 1428434810 /nfs/dbraw/zinc/43/48/10/1428434810.db2.gz JEOKYDQQQOSYLX-CQSZACIVSA-N 0 0 384.436 3.417 20 5 GGBDRN COCCN(Cc1ccccc1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000072111668 1409849082 /nfs/dbraw/zinc/84/90/82/1409849082.db2.gz KNVLEOVOVZPZJK-UHFFFAOYSA-N 0 0 383.448 3.484 20 5 GGBDRN CO[C@]1(C)C[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1(C)C ZINC000073276016 1409860095 /nfs/dbraw/zinc/86/00/95/1409860095.db2.gz SFHXZCZLOSTCAC-FXAWDEMLSA-N 0 0 375.469 3.131 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)C3CCOCC3)cc2[N+](=O)[O-])C1 ZINC000074448705 1409872647 /nfs/dbraw/zinc/87/26/47/1409872647.db2.gz YRYYSFAZOFRDMN-GJZGRUSLSA-N 0 0 375.469 3.328 20 5 GGBDRN CCCN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000074764349 1409876229 /nfs/dbraw/zinc/87/62/29/1409876229.db2.gz CELQIFFKLATSIH-NXHRZFHOSA-N 0 0 375.469 3.372 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)C[C@@H]3CCCO3)cc2[N+](=O)[O-])C1 ZINC000076967460 1409892324 /nfs/dbraw/zinc/89/23/24/1409892324.db2.gz WTMKFSFVUYCDTR-UXLLHSPISA-N 0 0 375.469 3.328 20 5 GGBDRN CCCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000077786552 1409900839 /nfs/dbraw/zinc/90/08/39/1409900839.db2.gz JJXVOTMNVBRSRR-KURKYZTESA-N 0 0 375.469 3.372 20 5 GGBDRN CCc1cnc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)s1 ZINC000176731530 1428439545 /nfs/dbraw/zinc/43/95/45/1428439545.db2.gz GYRCECSFOWQLSM-UHFFFAOYSA-N 0 0 389.886 3.396 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)c1[N+](=O)[O-] ZINC000176734888 1428441768 /nfs/dbraw/zinc/44/17/68/1428441768.db2.gz NBUHKYXBCVTQCF-UHFFFAOYSA-N 0 0 391.443 3.297 20 5 GGBDRN CC[C@@H](C)[C@@H](C)N(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC1 ZINC000078513533 1409922584 /nfs/dbraw/zinc/92/25/84/1409922584.db2.gz BRHPMEDHVDOPLI-VXGBXAGGSA-N 0 0 379.482 3.211 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@H](O)COc2ccc(F)c(F)c2)c2ncccc12 ZINC000078515457 1409923485 /nfs/dbraw/zinc/92/34/85/1409923485.db2.gz NMDGEPDCTGWRIV-NSHDSACASA-N 0 0 375.331 3.273 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)COc2ccc(F)c(F)c2)c2ncccc12 ZINC000078515462 1409923602 /nfs/dbraw/zinc/92/36/02/1409923602.db2.gz NMDGEPDCTGWRIV-LLVKDONJSA-N 0 0 375.331 3.273 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(=O)Cc1cccc2ccccc21 ZINC000078591304 1409926827 /nfs/dbraw/zinc/92/68/27/1409926827.db2.gz IGGNJNSMTCQCIG-UHFFFAOYSA-N 0 0 377.400 3.354 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1NCc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000078714109 1409933102 /nfs/dbraw/zinc/93/31/02/1409933102.db2.gz UHJZXSRSCWOMRL-HUUCEWRRSA-N 0 0 384.436 3.160 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1NCc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000078714106 1409933219 /nfs/dbraw/zinc/93/32/19/1409933219.db2.gz UHJZXSRSCWOMRL-GASCZTMLSA-N 0 0 384.436 3.160 20 5 GGBDRN CCN(CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1C ZINC000078777490 1409935923 /nfs/dbraw/zinc/93/59/23/1409935923.db2.gz FHRSRMZPOLJCLM-UHFFFAOYSA-N 0 0 394.431 3.001 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCO[C@H](c3nccs3)C2)cc1[N+](=O)[O-] ZINC000176738073 1428442669 /nfs/dbraw/zinc/44/26/69/1428442669.db2.gz JOYHPMQWYCJTNH-DOMZBBRYSA-N 0 0 376.438 3.204 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCN(CC(F)(F)F)CC1 ZINC000078959701 1409946730 /nfs/dbraw/zinc/94/67/30/1409946730.db2.gz FLUHVWVDBLQVHI-GFCCVEGCSA-N 0 0 391.415 3.172 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCc2cccnc2OCC(F)(F)F)c1[N+](=O)[O-] ZINC000176738201 1428443123 /nfs/dbraw/zinc/44/31/23/1428443123.db2.gz FJPLPSUTCVUZAL-UHFFFAOYSA-N 0 0 387.289 3.308 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCO[C@@H](c3nccs3)C2)cc1[N+](=O)[O-] ZINC000176738121 1428443356 /nfs/dbraw/zinc/44/33/56/1428443356.db2.gz JOYHPMQWYCJTNH-SWLSCSKDSA-N 0 0 376.438 3.204 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCCCC(=O)N2CCc3ccccc32)c1[N+](=O)[O-] ZINC000079056563 1409953081 /nfs/dbraw/zinc/95/30/81/1409953081.db2.gz ULARONGPUJYFDD-UHFFFAOYSA-N 0 0 385.395 3.142 20 5 GGBDRN Cc1cc2sc(NC(=O)Cn3c(=O)oc4cc([N+](=O)[O-])ccc43)nc2c(C)c1 ZINC000079068285 1409954987 /nfs/dbraw/zinc/95/49/87/1409954987.db2.gz WCFBQONAVDDPEJ-UHFFFAOYSA-N 0 0 398.400 3.368 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N(C)[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000079089395 1409956169 /nfs/dbraw/zinc/95/61/69/1409956169.db2.gz JPRCRUFIJJQRHG-AWEZNQCLSA-N 0 0 392.481 3.218 20 5 GGBDRN Cc1nn(C)c(Sc2nnc(COc3cc(C)ccc3C)o2)c1[N+](=O)[O-] ZINC000079353675 1409971389 /nfs/dbraw/zinc/97/13/89/1409971389.db2.gz NQBJGCCWHQLVLP-UHFFFAOYSA-N 0 0 375.410 3.367 20 5 GGBDRN C=CC(=O)Nc1cc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)ccc1F ZINC000176743785 1428445221 /nfs/dbraw/zinc/44/52/21/1428445221.db2.gz GONHXHAXLABHHP-UHFFFAOYSA-N 0 0 395.350 3.296 20 5 GGBDRN CCCCC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)OC ZINC000176747189 1428446423 /nfs/dbraw/zinc/44/64/23/1428446423.db2.gz LBDGLFDYLFSGMY-CYBMUJFWSA-N 0 0 387.230 3.209 20 5 GGBDRN CCCCC[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)OC ZINC000176748142 1428447226 /nfs/dbraw/zinc/44/72/26/1428447226.db2.gz FNTIZEMAKCWZSG-OAHLLOKOSA-N 0 0 377.441 3.047 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN([C@H](C)c3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000176748886 1428447392 /nfs/dbraw/zinc/44/73/92/1428447392.db2.gz HLBBVQFOGMELSU-IAGOWNOFSA-N 0 0 397.479 3.448 20 5 GGBDRN CCCCC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)OC ZINC000176750946 1428448297 /nfs/dbraw/zinc/44/82/97/1428448297.db2.gz MXYLUYOPOQBZMN-LBPRGKRZSA-N 0 0 376.331 3.465 20 5 GGBDRN CCCCC[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)OC ZINC000176751061 1428448522 /nfs/dbraw/zinc/44/85/22/1428448522.db2.gz MWAYOBUFUIEKTE-INIZCTEOSA-N 0 0 391.468 3.049 20 5 GGBDRN CCOC[C@@H]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000081428141 1410019476 /nfs/dbraw/zinc/01/94/76/1410019476.db2.gz CMFNBNAVHPHBOE-JKSUJKDBSA-N 0 0 375.469 3.330 20 5 GGBDRN O=C(N[C@H](CO)Cc1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082075202 1410025900 /nfs/dbraw/zinc/02/59/00/1410025900.db2.gz UODPRNINLMLVGR-HNNXBMFYSA-N 0 0 383.429 3.052 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCNC(=O)CC1CCCCC1 ZINC000085620243 1410043320 /nfs/dbraw/zinc/04/33/20/1410043320.db2.gz FJLFKNROBHDWLM-UHFFFAOYSA-N 0 0 376.457 3.420 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000087371776 1410047950 /nfs/dbraw/zinc/04/79/50/1410047950.db2.gz AQPKKYZCPWKJEG-IBGZPJMESA-N 0 0 376.453 3.104 20 5 GGBDRN CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)CCO1 ZINC000089468783 1410054623 /nfs/dbraw/zinc/05/46/23/1410054623.db2.gz ABTALJVYLDANNK-QGZVFWFLSA-N 0 0 375.469 3.472 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000176760909 1428451776 /nfs/dbraw/zinc/45/17/76/1428451776.db2.gz CZXBPKDMLDCCSH-LBPRGKRZSA-N 0 0 397.391 3.460 20 5 GGBDRN CC[C@H](NC(=O)NCCNC(=O)CC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000090554089 1410064948 /nfs/dbraw/zinc/06/49/48/1410064948.db2.gz JYDSTENBHYYXCO-KRWDZBQOSA-N 0 0 376.457 3.042 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC2(CCc3ccccc3O2)CC1 ZINC000090685434 1410066733 /nfs/dbraw/zinc/06/67/33/1410066733.db2.gz 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STKHHFLBCVUOFA-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN C[C@@H]1Cc2cc(S(=O)(=O)Oc3cc(F)ccc3[N+](=O)[O-])cc(Cl)c2O1 ZINC000097590672 1410381325 /nfs/dbraw/zinc/38/13/25/1410381325.db2.gz ODISKFDMHSBGNK-MRVPVSSYSA-N 0 0 387.772 3.478 20 5 GGBDRN O=C(CSc1nnc(-c2ccncc2)o1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000097601531 1410384447 /nfs/dbraw/zinc/38/44/47/1410384447.db2.gz ZZFSCUYKTTZZGI-UHFFFAOYSA-N 0 0 391.796 3.424 20 5 GGBDRN O=C(OCc1nnc(-c2ccccc2)o1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000097603639 1410384690 /nfs/dbraw/zinc/38/46/90/1410384690.db2.gz AOHSOLJTTWKFNT-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000176816740 1428479381 /nfs/dbraw/zinc/47/93/81/1428479381.db2.gz GJPXLABSSQTMJF-INIZCTEOSA-N 0 0 381.432 3.185 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccccc1N1CCC(O)CC1 ZINC000097701275 1410389636 /nfs/dbraw/zinc/38/96/36/1410389636.db2.gz QSBMVLDUJGXQMC-UHFFFAOYSA-N 0 0 387.461 3.287 20 5 GGBDRN 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UCARARIZOATVSM-HNNXBMFYSA-N 0 0 375.400 3.189 20 5 GGBDRN O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000102203781 1410579286 /nfs/dbraw/zinc/57/92/86/1410579286.db2.gz MGJAICITLXDJOR-LJQANCHMSA-N 0 0 397.818 3.316 20 5 GGBDRN CC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000102216148 1410579692 /nfs/dbraw/zinc/57/96/92/1410579692.db2.gz PUDHPAZNKUQJGF-IBGZPJMESA-N 0 0 395.415 3.349 20 5 GGBDRN CCCc1cc(=O)oc2cc(OC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)ccc12 ZINC000102217041 1410580090 /nfs/dbraw/zinc/58/00/90/1410580090.db2.gz OUIQUJCZAFXIEM-UHFFFAOYSA-N 0 0 399.403 3.463 20 5 GGBDRN CN(C(=O)C(C)(C)C)c1ccc(OC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1 ZINC000102216940 1410580099 /nfs/dbraw/zinc/58/00/99/1410580099.db2.gz HCVQRUXBCKIVHJ-UHFFFAOYSA-N 0 0 388.424 3.141 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000102214334 1410580472 /nfs/dbraw/zinc/58/04/72/1410580472.db2.gz GVVUSRHSXDJDLL-SFHVURJKSA-N 0 0 397.431 3.464 20 5 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RSYDZGJFTNQSFC-ZDUSSCGKSA-N 0 0 389.433 3.298 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1F ZINC000110161573 1411834988 /nfs/dbraw/zinc/83/49/88/1411834988.db2.gz PIHPMANXECNERL-ZDUSSCGKSA-N 0 0 377.397 3.347 20 5 GGBDRN Cc1ccc(F)c(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000110163908 1411835094 /nfs/dbraw/zinc/83/50/94/1411835094.db2.gz GZIAXZSKMWEQBG-ZDUSSCGKSA-N 0 0 377.397 3.347 20 5 GGBDRN CCOc1ccccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110163015 1411835158 /nfs/dbraw/zinc/83/51/58/1411835158.db2.gz RSYDZGJFTNQSFC-CYBMUJFWSA-N 0 0 389.433 3.298 20 5 GGBDRN O=C(Nc1cccc2ncccc21)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110168797 1411835248 /nfs/dbraw/zinc/83/52/48/1411835248.db2.gz YKVUEJRLMWCWRV-HNNXBMFYSA-N 0 0 396.428 3.448 20 5 GGBDRN CN(Cc1ccccc1F)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110170782 1411835491 /nfs/dbraw/zinc/83/54/91/1411835491.db2.gz NPOCTYXGPBJJPG-AWEZNQCLSA-N 0 0 391.424 3.059 20 5 GGBDRN O=C(Oc1c(F)cccc1F)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110176597 1411835690 /nfs/dbraw/zinc/83/56/90/1411835690.db2.gz ILFDLPYMONVFPL-LLVKDONJSA-N 0 0 382.344 3.145 20 5 GGBDRN NC(=O)c1cc(-c2csc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])n2)c[nH]1 ZINC000110191374 1411836625 /nfs/dbraw/zinc/83/66/25/1411836625.db2.gz AJEKYPWWDREPRE-UHFFFAOYSA-N 0 0 391.796 3.051 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(F)c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000110189112 1411836660 /nfs/dbraw/zinc/83/66/60/1411836660.db2.gz MLAZARAAJIFUPC-UHFFFAOYSA-N 0 0 392.408 3.119 20 5 GGBDRN Cc1ccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(C)c1 ZINC000110200412 1411837486 /nfs/dbraw/zinc/83/74/86/1411837486.db2.gz WPVUUNCAQUTSIR-OAHLLOKOSA-N 0 0 387.461 3.194 20 5 GGBDRN O=C(Nc1cccc(N2CCCS2(=O)=O)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110215823 1411838042 /nfs/dbraw/zinc/83/80/42/1411838042.db2.gz CZHJMXOXVRIRTL-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN CCc1ccc(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)s1 ZINC000110217706 1411838130 /nfs/dbraw/zinc/83/81/30/1411838130.db2.gz SBEGFBWMZYXJIQ-ZDUSSCGKSA-N 0 0 393.490 3.201 20 5 GGBDRN CCc1ccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)s1 ZINC000110217709 1411838287 /nfs/dbraw/zinc/83/82/87/1411838287.db2.gz SBEGFBWMZYXJIQ-CYBMUJFWSA-N 0 0 393.490 3.201 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000110220940 1411838463 /nfs/dbraw/zinc/83/84/63/1411838463.db2.gz NDDGXUGXMHFQGC-UHFFFAOYSA-N 0 0 390.783 3.119 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1F ZINC000110224087 1411838651 /nfs/dbraw/zinc/83/86/51/1411838651.db2.gz GKTZTZXEIHNSLT-LBPRGKRZSA-N 0 0 393.396 3.047 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(S(=O)(=O)C(C)C)ccc1F ZINC000110224195 1411838775 /nfs/dbraw/zinc/83/87/75/1411838775.db2.gz NFIMWEPVMNOUFA-UHFFFAOYSA-N 0 0 381.381 3.444 20 5 GGBDRN Cc1c(OC(=O)c2cc(S(=O)(=O)C(C)C)ccc2F)cccc1[N+](=O)[O-] ZINC000110232563 1411839178 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XOYNJCRFXBSYPA-UHFFFAOYSA-N 0 0 387.779 3.150 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCN(C(=O)C2CCCCC2)CC1 ZINC000110252312 1411840574 /nfs/dbraw/zinc/84/05/74/1411840574.db2.gz NJDPMDZSSBNINT-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN Cc1cc([C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(C)o1 ZINC000110254060 1411840647 /nfs/dbraw/zinc/84/06/47/1411840647.db2.gz UHVZEZWIDQGSGW-RISCZKNCSA-N 0 0 391.449 3.348 20 5 GGBDRN O=C(Oc1cc(F)cc(F)c1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110264334 1411841117 /nfs/dbraw/zinc/84/11/17/1411841117.db2.gz JMSWIEOGFCTQQC-GFCCVEGCSA-N 0 0 382.344 3.145 20 5 GGBDRN CN(C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1F ZINC000110265073 1411841321 /nfs/dbraw/zinc/84/13/21/1411841321.db2.gz VVKWEKKVDLFDBJ-CYBMUJFWSA-N 0 0 377.397 3.063 20 5 GGBDRN CN(C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1F ZINC000110265072 1411841455 /nfs/dbraw/zinc/84/14/55/1411841455.db2.gz VVKWEKKVDLFDBJ-ZDUSSCGKSA-N 0 0 377.397 3.063 20 5 GGBDRN CCCCNC(=O)C1(NC(=O)CCNc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000110276040 1411842264 /nfs/dbraw/zinc/84/22/64/1411842264.db2.gz WPBZPRIQYRYESN-UHFFFAOYSA-N 0 0 390.484 3.132 20 5 GGBDRN Cc1cccc2c1CC[C@@H]2NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110302162 1411843266 /nfs/dbraw/zinc/84/32/66/1411843266.db2.gz KHMNGRAXKOUAGP-HOTGVXAUSA-N 0 0 399.472 3.373 20 5 GGBDRN O=C(N[C@H]1CCCc2occc21)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110312663 1411843818 /nfs/dbraw/zinc/84/38/18/1411843818.db2.gz ZJMLMKANZVAHHF-QWHCGFSZSA-N 0 0 389.433 3.048 20 5 GGBDRN CSc1ccc(C(=O)NCCCNC(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000110320565 1411844498 /nfs/dbraw/zinc/84/44/98/1411844498.db2.gz WHJVPORLJFUSOZ-UHFFFAOYSA-N 0 0 391.424 3.006 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2Cl)C1=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000110335049 1411845393 /nfs/dbraw/zinc/84/53/93/1411845393.db2.gz YKPYIGXXJWWPQM-CYBMUJFWSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2Cl)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110335057 1411845438 /nfs/dbraw/zinc/84/54/38/1411845438.db2.gz VVCLFTKXRYFHBL-GFCCVEGCSA-N 0 0 394.214 3.437 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000110346791 1411845498 /nfs/dbraw/zinc/84/54/98/1411845498.db2.gz IGZVDAIDBSUQQA-UHFFFAOYSA-N 0 0 396.321 3.218 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000110346942 1411845542 /nfs/dbraw/zinc/84/55/42/1411845542.db2.gz RXQPQTDQZLXSNB-UHFFFAOYSA-N 0 0 392.358 3.007 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000110346718 1411845587 /nfs/dbraw/zinc/84/55/87/1411845587.db2.gz AOHQSQWPWYOVTR-UHFFFAOYSA-N 0 0 396.321 3.218 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000110347269 1411846036 /nfs/dbraw/zinc/84/60/36/1411846036.db2.gz PHPXFJFPNBBOND-UHFFFAOYSA-N 0 0 392.358 3.387 20 5 GGBDRN Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000110355114 1411846517 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394.435 3.132 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)CCn3cccn3)cc2[N+](=O)[O-])C1 ZINC000110433649 1411850649 /nfs/dbraw/zinc/85/06/49/1411850649.db2.gz BXELMPNKQYXZLO-HZPDHXFCSA-N 0 0 385.468 3.046 20 5 GGBDRN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000110456806 1411851078 /nfs/dbraw/zinc/85/10/78/1411851078.db2.gz CUAPUMDWFGPHQF-TXEJJXNPSA-N 0 0 381.404 3.204 20 5 GGBDRN COc1cc(C(=O)N2CCN(C)c3ccccc32)c([N+](=O)[O-])cc1OC(F)F ZINC000110475476 1411851888 /nfs/dbraw/zinc/85/18/88/1411851888.db2.gz PFHKZLTVMLDSTD-UHFFFAOYSA-N 0 0 393.346 3.301 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC[C@@H]1c1ccncc1 ZINC000110480912 1411852195 /nfs/dbraw/zinc/85/21/95/1411852195.db2.gz WXZPLHRXYWGCEA-HNAYVOBHSA-N 0 0 396.447 3.252 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC[C@@H]1c1ccncc1 ZINC000110480916 1411852239 /nfs/dbraw/zinc/85/22/39/1411852239.db2.gz WXZPLHRXYWGCEA-DNVCBOLYSA-N 0 0 396.447 3.252 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000110507083 1411853744 /nfs/dbraw/zinc/85/37/44/1411853744.db2.gz ZVRYKXAHXOEKPB-CYBMUJFWSA-N 0 0 375.375 3.220 20 5 GGBDRN CC(C)c1ccccc1OCCNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000110508346 1411853905 /nfs/dbraw/zinc/85/39/05/1411853905.db2.gz GJULNQWZURECRG-UHFFFAOYSA-N 0 0 395.419 3.108 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000110518613 1411854986 /nfs/dbraw/zinc/85/49/86/1411854986.db2.gz FEUCKWUGHPBFIY-MLGOLLRUSA-N 0 0 392.843 3.168 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000110518382 1411854994 /nfs/dbraw/zinc/85/49/94/1411854994.db2.gz KZZGZJWCSWICCV-WBMJQRKESA-N 0 0 392.843 3.132 20 5 GGBDRN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)CN(C)C(=O)OC(C)(C)C ZINC000110521676 1411855107 /nfs/dbraw/zinc/85/51/07/1411855107.db2.gz FTMIRHWPWZTWLH-LLVKDONJSA-N 0 0 385.848 3.481 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)CN(C)C(=O)OC(C)(C)C 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/nfs/dbraw/zinc/85/80/94/1411858094.db2.gz HCQCDZXUCGACFX-SJORKVTESA-N 0 0 377.404 3.242 20 5 GGBDRN O=C(N[C@H]1CCC[C@H]1c1ccccc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000110576426 1411858128 /nfs/dbraw/zinc/85/81/28/1411858128.db2.gz HCQCDZXUCGACFX-IRXDYDNUSA-N 0 0 377.404 3.242 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000110579240 1411858413 /nfs/dbraw/zinc/85/84/13/1411858413.db2.gz SQKZVKFHTWUHJY-HZPDHXFCSA-N 0 0 399.472 3.238 20 5 GGBDRN CC(C)CC(=O)N[C@@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000110579734 1411858504 /nfs/dbraw/zinc/85/85/04/1411858504.db2.gz IEYYXZYMARENHQ-HXUWFJFHSA-N 0 0 398.463 3.027 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2cc(Br)ccc2F)c([N+](=O)[O-])c1 ZINC000110649074 1411862206 /nfs/dbraw/zinc/86/22/06/1411862206.db2.gz VSGQKEXPZTYJKV-UHFFFAOYSA-N 0 0 397.156 3.326 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000110770418 1411868856 /nfs/dbraw/zinc/86/88/56/1411868856.db2.gz JJFXEVWYDHYVNH-GFCCVEGCSA-N 0 0 377.832 3.440 20 5 GGBDRN Cc1cccn2cc(CNC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)nc12 ZINC000110798055 1411870512 /nfs/dbraw/zinc/87/05/12/1411870512.db2.gz ALKIBWXTAVRTQU-UHFFFAOYSA-N 0 0 383.364 3.006 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC(c2nncn2C2CC2)CC1 ZINC000110810043 1411870934 /nfs/dbraw/zinc/87/09/34/1411870934.db2.gz OJJUZZMGIXLOLM-UHFFFAOYSA-N 0 0 375.816 3.194 20 5 GGBDRN Cn1c(CCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])nc2c1cccc2F ZINC000110823537 1411872130 /nfs/dbraw/zinc/87/21/30/1411872130.db2.gz RSACBXWAQMOAFJ-UHFFFAOYSA-N 0 0 376.775 3.247 20 5 GGBDRN CSc1ccc(C(=O)NCCc2nc3c(cccc3F)n2C)cc1[N+](=O)[O-] ZINC000110825675 1411872173 /nfs/dbraw/zinc/87/21/73/1411872173.db2.gz OJQDGEFLHGHMTA-UHFFFAOYSA-N 0 0 388.424 3.315 20 5 GGBDRN Cc1c(C(=O)Nc2cc(C(N)=O)ccc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000110927220 1411877258 /nfs/dbraw/zinc/87/72/58/1411877258.db2.gz AWBLJEFQNIOLET-UHFFFAOYSA-N 0 0 392.755 3.124 20 5 GGBDRN Cc1c(C(=O)Nc2cccc([S@](C)=O)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000110931557 1411877750 /nfs/dbraw/zinc/87/77/50/1411877750.db2.gz ZYJSPQGCDLYCOZ-AREMUKBSSA-N 0 0 377.378 3.110 20 5 GGBDRN C[S@](=O)c1cccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000110933287 1411877757 /nfs/dbraw/zinc/87/77/57/1411877757.db2.gz DZKFMQJIOZVXEK-HHHXNRCGSA-N 0 0 387.461 3.187 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1ccnc(O[C@@H](C)CC(C)C)c1 ZINC000110948086 1411878141 /nfs/dbraw/zinc/87/81/41/1411878141.db2.gz YBRCXEFCPGJYAK-AWEZNQCLSA-N 0 0 389.456 3.015 20 5 GGBDRN CC(C)C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000110999491 1411881558 /nfs/dbraw/zinc/88/15/58/1411881558.db2.gz VCWHKEXDKQDLFQ-HNNXBMFYSA-N 0 0 379.457 3.193 20 5 GGBDRN CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C[C@@H](C)O1 ZINC000111003972 1411881828 /nfs/dbraw/zinc/88/18/28/1411881828.db2.gz LGUHTERURYHTOQ-WBVHZDCISA-N 0 0 375.469 3.471 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000111018862 1411882331 /nfs/dbraw/zinc/88/23/31/1411882331.db2.gz FBIJFIFAYFCMGJ-WDEREUQCSA-N 0 0 376.331 3.175 20 5 GGBDRN O=C(CNc1cccc(C(F)(F)F)c1)NCCNc1ccccc1[N+](=O)[O-] ZINC000111035402 1411883430 /nfs/dbraw/zinc/88/34/30/1411883430.db2.gz GUCSIXZWCFDIGY-UHFFFAOYSA-N 0 0 382.342 3.254 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCCC(=O)N1Cc2ccccc2C1 ZINC000111114053 1411887831 /nfs/dbraw/zinc/88/78/31/1411887831.db2.gz YDQLHOWZBXSIPA-FMIVXFBMSA-N 0 0 379.416 3.047 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000111120433 1411888498 /nfs/dbraw/zinc/88/84/98/1411888498.db2.gz ILLNVOYLGAFLPV-OAHLLOKOSA-N 0 0 378.432 3.423 20 5 GGBDRN CC(C)c1ccccc1OCCNC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000111121147 1411888602 /nfs/dbraw/zinc/88/86/02/1411888602.db2.gz JNRCOGAMUKEZGE-HNNXBMFYSA-N 0 0 399.447 3.032 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H](C3N=NC(=S)N3C(C)C)C2)cc([N+](=O)[O-])c1 ZINC000111131430 1411889441 /nfs/dbraw/zinc/88/94/41/1411889441.db2.gz AXRJHQNVWNITLS-CYBMUJFWSA-N 0 0 389.481 3.384 20 5 GGBDRN O=C(CCCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])N1CCc2ccccc21 ZINC000111140441 1411891208 /nfs/dbraw/zinc/89/12/08/1411891208.db2.gz YHJGCNRWHNNMMX-UHFFFAOYSA-N 0 0 387.823 3.348 20 5 GGBDRN CN(Cn1ncc2ccc([N+](=O)[O-])cc21)[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000111166993 1411893102 /nfs/dbraw/zinc/89/31/02/1411893102.db2.gz GEBOHTNOOLFHDV-KRWDZBQOSA-N 0 0 399.838 3.293 20 5 GGBDRN CN(Cn1ncc2cc([N+](=O)[O-])ccc21)[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000111167085 1411893206 /nfs/dbraw/zinc/89/32/06/1411893206.db2.gz PMIXWQOVXZPEPA-SFHVURJKSA-N 0 0 399.838 3.293 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)Cn1cc(Br)c([N+](=O)[O-])n1)CCC2 ZINC000111173169 1411893545 /nfs/dbraw/zinc/89/35/45/1411893545.db2.gz IFTUEQUIDNFTAK-NSHDSACASA-N 0 0 386.275 3.286 20 5 GGBDRN CCC(=O)Nc1ccc(Cl)c(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000111189258 1411894439 /nfs/dbraw/zinc/89/44/39/1411894439.db2.gz URJYABFTDAADGT-UHFFFAOYSA-N 0 0 376.800 3.308 20 5 GGBDRN CCc1nnc([C@@H](C)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)o1 ZINC000111217277 1411896293 /nfs/dbraw/zinc/89/62/93/1411896293.db2.gz WPRCUFVSXVERLY-LLVKDONJSA-N 0 0 399.373 3.442 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000111309286 1411906273 /nfs/dbraw/zinc/90/62/73/1411906273.db2.gz GQZWZGSUJBISDN-XIKOKIGWSA-N 0 0 389.839 3.309 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)CC(=O)N1CCc3ccc([N+](=O)[O-])cc31)CCC2 ZINC000111311346 1411908206 /nfs/dbraw/zinc/90/82/06/1411908206.db2.gz WDCQOIKWDXNZFN-MRXNPFEDSA-N 0 0 386.477 3.258 20 5 GGBDRN C[C@H]1CO[C@@H](c2ccccc2Cl)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000111365215 1411925154 /nfs/dbraw/zinc/92/51/54/1411925154.db2.gz ARNLIFCKDHNRGJ-YVEFUNNKSA-N 0 0 396.852 3.399 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)[C@H]1CCCc2nc(C)sc21 ZINC000111366102 1411926474 /nfs/dbraw/zinc/92/64/74/1411926474.db2.gz CSXTZHBKDRIFTQ-ZDUSSCGKSA-N 0 0 397.478 3.066 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@H]2CCCc3nc(C)sc32)c([N+](=O)[O-])c1 ZINC000111366533 1411927388 /nfs/dbraw/zinc/92/73/88/1411927388.db2.gz BVZNRBMGGDSCDE-ZDUSSCGKSA-N 0 0 397.478 3.066 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000111369283 1411928063 /nfs/dbraw/zinc/92/80/63/1411928063.db2.gz OAGFKVRNNLNOFG-HZPDHXFCSA-N 0 0 376.434 3.218 20 5 GGBDRN CC(=O)Nc1cc(F)c(F)cc1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000177177958 1428616348 /nfs/dbraw/zinc/61/63/48/1428616348.db2.gz JGNLDEQWJSJYKO-HNNXBMFYSA-N 0 0 390.346 3.049 20 5 GGBDRN Cc1csc(C2(NCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)CCCC2)n1 ZINC000177173685 1428612871 /nfs/dbraw/zinc/61/28/71/1428612871.db2.gz INJVFLNLAWNFQQ-UHFFFAOYSA-N 0 0 386.477 3.308 20 5 GGBDRN O=C(Nc1cnc(-c2ccccc2)nc1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111556891 1411991090 /nfs/dbraw/zinc/99/10/90/1411991090.db2.gz RTNOULCYHGVCIR-UHFFFAOYSA-N 0 0 387.355 3.146 20 5 GGBDRN O=C(N[C@@H]1CCSc2ccccc21)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111567022 1411992776 /nfs/dbraw/zinc/99/27/76/1411992776.db2.gz IQWGHVONWDUTBG-MRXNPFEDSA-N 0 0 381.413 3.403 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CCC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111591429 1411997997 /nfs/dbraw/zinc/99/79/97/1411997997.db2.gz BVGHWEAQDQGEJR-UHFFFAOYSA-N 0 0 395.390 3.427 20 5 GGBDRN O=C(N[C@H]1CCCOc2ccccc21)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111592042 1411998019 /nfs/dbraw/zinc/99/80/19/1411998019.db2.gz ROHDYPJKRSCQSQ-INIZCTEOSA-N 0 0 379.372 3.080 20 5 GGBDRN COc1ccc([C@@H]2CCN(C(=O)c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)C2)cc1 ZINC000111591976 1411998452 /nfs/dbraw/zinc/99/84/52/1411998452.db2.gz OBSJBCKKCHFCJU-CQSZACIVSA-N 0 0 393.399 3.075 20 5 GGBDRN Cc1cn(-c2ccccc2)nc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111615852 1412002430 /nfs/dbraw/zinc/00/24/30/1412002430.db2.gz PGTQJIAJHYIAPO-UHFFFAOYSA-N 0 0 389.371 3.183 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2ccnc(O[C@@H](C)CC(C)C)c2)c1[N+](=O)[O-] ZINC000111628190 1412002804 /nfs/dbraw/zinc/00/28/04/1412002804.db2.gz SVAVHPMSFNCRQF-ZDUSSCGKSA-N 0 0 389.456 3.409 20 5 GGBDRN COc1cccc([C@@H](O)CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000111638214 1412004881 /nfs/dbraw/zinc/00/48/81/1412004881.db2.gz VRVCTCOHYWNXCD-KRWDZBQOSA-N 0 0 399.428 3.190 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@H](O)c2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000111640269 1412005480 /nfs/dbraw/zinc/00/54/80/1412005480.db2.gz IISCSTPTOCZJPH-LBPRGKRZSA-N 0 0 387.223 3.041 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1ccc(Cl)cc1Cl ZINC000111640487 1412005964 /nfs/dbraw/zinc/00/59/64/1412005964.db2.gz BFNIFDXBDKDMGJ-HNNXBMFYSA-N 0 0 385.203 3.130 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NC[C@H](O)c1ccc(Cl)cc1Cl ZINC000111641131 1412006124 /nfs/dbraw/zinc/00/61/24/1412006124.db2.gz GNEBXLHBTQUYLD-AWEZNQCLSA-N 0 0 385.203 3.130 20 5 GGBDRN O=C(N[C@H](CN1CCOCC1)c1ccccc1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000111665693 1412010372 /nfs/dbraw/zinc/01/03/72/1412010372.db2.gz CJMLSGDMHJHWDA-QGZVFWFLSA-N 0 0 389.839 3.052 20 5 GGBDRN Cc1ccc(NC(=O)NCCCC(=O)N2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000111700446 1412013038 /nfs/dbraw/zinc/01/30/38/1412013038.db2.gz POOVGQBKZIQZCO-UHFFFAOYSA-N 0 0 382.420 3.394 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN3CCn4c(nnc4-c4ccccc4)C3)nc2c1 ZINC000177176199 1428615573 /nfs/dbraw/zinc/61/55/73/1428615573.db2.gz HDVHBIKDBDTSOD-UHFFFAOYSA-N 0 0 376.376 3.010 20 5 GGBDRN CC[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)Oc1ccccc1F ZINC000177176415 1428615769 /nfs/dbraw/zinc/61/57/69/1428615769.db2.gz GDXMFCYHVQQARA-CYBMUJFWSA-N 0 0 399.378 3.163 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000111931582 1412057590 /nfs/dbraw/zinc/05/75/90/1412057590.db2.gz KBEFHDNIKJDUOJ-HNNXBMFYSA-N 0 0 388.449 3.143 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000111931581 1412057679 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DPQYAIFQLWHJJP-ZDUSSCGKSA-N 0 0 378.381 3.143 20 5 GGBDRN O=C(OCCc1cccs1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000111948821 1412061137 /nfs/dbraw/zinc/06/11/37/1412061137.db2.gz HGFVOYKWWMMOEX-GFCCVEGCSA-N 0 0 380.447 3.108 20 5 GGBDRN O=C(OCc1ccnc(Cl)c1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000111950118 1412061268 /nfs/dbraw/zinc/06/12/68/1412061268.db2.gz IAEQNFSCHWYKJI-LLVKDONJSA-N 0 0 395.824 3.053 20 5 GGBDRN O=C(OCCc1ccccc1F)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000111961430 1412061861 /nfs/dbraw/zinc/06/18/61/1412061861.db2.gz FHBHBMNPPJZMAD-AWEZNQCLSA-N 0 0 392.408 3.186 20 5 GGBDRN O=C(OCCc1ccccc1F)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000111961434 1412061996 /nfs/dbraw/zinc/06/19/96/1412061996.db2.gz FHBHBMNPPJZMAD-CQSZACIVSA-N 0 0 392.408 3.186 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1ccccc1 ZINC000112016446 1412067906 /nfs/dbraw/zinc/06/79/06/1412067906.db2.gz HZHWRSMNMDVKRW-HNNXBMFYSA-N 0 0 396.447 3.342 20 5 GGBDRN C[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1 ZINC000112018898 1412068719 /nfs/dbraw/zinc/06/87/19/1412068719.db2.gz YFIMRZXPZXELTI-GFCCVEGCSA-N 0 0 396.428 3.475 20 5 GGBDRN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000112021573 1412069195 /nfs/dbraw/zinc/06/91/95/1412069195.db2.gz BPXJTAGIQBTJRG-UHFFFAOYSA-N 0 0 387.440 3.458 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCCc1cn(-c2ccccc2)nc1C ZINC000112074118 1412073615 /nfs/dbraw/zinc/07/36/15/1412073615.db2.gz GMEFDXXLNCPHEJ-UHFFFAOYSA-N 0 0 393.447 3.493 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(Sc2n[nH]c(C(C)(C)C)n2)c([N+](=O)[O-])c1 ZINC000112073503 1412073737 /nfs/dbraw/zinc/07/37/37/1412073737.db2.gz INYRVQSEQJRKIW-UHFFFAOYSA-N 0 0 386.437 3.126 20 5 GGBDRN CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000112166595 1412085599 /nfs/dbraw/zinc/08/55/99/1412085599.db2.gz PDVVIUAOIYJEBY-OAHLLOKOSA-N 0 0 391.374 3.339 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)c([N+](=O)[O-])c1 ZINC000112164177 1412085732 /nfs/dbraw/zinc/08/57/32/1412085732.db2.gz BZVISRLIZHDBER-INIZCTEOSA-N 0 0 377.303 3.013 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1CC(c2cc(F)ccc2F)=NO1 ZINC000112166604 1412085794 /nfs/dbraw/zinc/08/57/94/1412085794.db2.gz CMNONFFKMJRMDX-HNNXBMFYSA-N 0 0 383.257 3.283 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1)c1cccc([N+](=O)[O-])c1 ZINC000112171309 1412087072 /nfs/dbraw/zinc/08/70/72/1412087072.db2.gz JZBREDWFYMKLJR-BMLIUANNSA-N 0 0 375.331 3.243 20 5 GGBDRN C[C@@H](NC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1)c1cccc([N+](=O)[O-])c1 ZINC000112171307 1412087206 /nfs/dbraw/zinc/08/72/06/1412087206.db2.gz JZBREDWFYMKLJR-QGHHPUGFSA-N 0 0 375.331 3.243 20 5 GGBDRN Cc1c2ccccc2oc1[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(C)C ZINC000112187468 1412090717 /nfs/dbraw/zinc/09/07/17/1412090717.db2.gz NFOJEACJCITACD-IBGZPJMESA-N 0 0 383.404 3.325 20 5 GGBDRN Cc1ccccc1[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)C(C)C ZINC000112190913 1412090795 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Cc1ccccc1[C@H](O)CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000112397073 1412140382 /nfs/dbraw/zinc/14/03/82/1412140382.db2.gz RMJKRXOZNBLXBG-MRXNPFEDSA-N 0 0 398.337 3.308 20 5 GGBDRN Cc1ccccc1[C@@H](O)CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000112398727 1412140888 /nfs/dbraw/zinc/14/08/88/1412140888.db2.gz FVVADAQNJJWTDC-KRWDZBQOSA-N 0 0 383.429 3.490 20 5 GGBDRN Cc1cc(C(=O)N2CCc3ccc(Br)cc32)c(N)c([N+](=O)[O-])c1 ZINC000112403295 1412141406 /nfs/dbraw/zinc/14/14/06/1412141406.db2.gz KHVYQKNUQGTBIQ-UHFFFAOYSA-N 0 0 376.210 3.451 20 5 GGBDRN O=C(Cc1nc2cc3ccccc3cc2c(=O)[nH]1)N(CC(F)(F)F)C1CC1 ZINC000112404500 1412141496 /nfs/dbraw/zinc/14/14/96/1412141496.db2.gz RVGOKFDQJTWERZ-UHFFFAOYSA-N 0 0 375.350 3.172 20 5 GGBDRN Cc1c(NC(=O)CCN(C)Cc2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000177197525 1428626708 /nfs/dbraw/zinc/62/67/08/1428626708.db2.gz SPIKTSZUDDGVJF-UHFFFAOYSA-N 0 0 381.436 3.251 20 5 GGBDRN Cc1ccccc1[C@H](O)CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000112420081 1412143075 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BHIMOPSHHMOOND-OLZOCXBDSA-N 0 0 387.461 3.094 20 5 GGBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1N1C(=O)CCC1=O ZINC000112590046 1412174224 /nfs/dbraw/zinc/17/42/24/1412174224.db2.gz OLRRFOQRCMJWDF-UHFFFAOYSA-N 0 0 387.779 3.462 20 5 GGBDRN CN(Cc1nnc2ccccn21)c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000112616175 1412179194 /nfs/dbraw/zinc/17/91/94/1412179194.db2.gz KKLSROROESKGMM-UHFFFAOYSA-N 0 0 396.285 3.201 20 5 GGBDRN C[C@@H](ONC(=O)Cc1cccc2ccccc21)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000112627818 1412180249 /nfs/dbraw/zinc/18/02/49/1412180249.db2.gz VRHCSJKUHYRULD-CQSZACIVSA-N 0 0 393.399 3.366 20 5 GGBDRN O=C(Cn1ccc2c1cccc2[N+](=O)[O-])Nc1cccc(C(=O)NC2CC2)c1 ZINC000112654053 1412186603 /nfs/dbraw/zinc/18/66/03/1412186603.db2.gz GDOAMQZMBPMFNY-UHFFFAOYSA-N 0 0 378.388 3.080 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000112670356 1412189010 /nfs/dbraw/zinc/18/90/10/1412189010.db2.gz RJDJMETWYKRNKI-QGZVFWFLSA-N 0 0 392.459 3.282 20 5 GGBDRN Cc1csc(C2(NC(=O)COc3ccc(C=O)cc3[N+](=O)[O-])CCCC2)n1 ZINC000112688376 1412193573 /nfs/dbraw/zinc/19/35/73/1412193573.db2.gz HYURSBOPGMPBHJ-UHFFFAOYSA-N 0 0 389.433 3.137 20 5 GGBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1nc2ccccc2n1C ZINC000177207629 1428632395 /nfs/dbraw/zinc/63/23/95/1428632395.db2.gz MPRCSXUGYGLDJB-UHFFFAOYSA-N 0 0 378.392 3.164 20 5 GGBDRN C[C@H]1CCC[C@@H](OCC(=O)OCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)C1 ZINC000112759541 1412213109 /nfs/dbraw/zinc/21/31/09/1412213109.db2.gz UMHQHEVFLBFFRJ-MAUKXSAKSA-N 0 0 391.468 3.345 20 5 GGBDRN C[C@@H]1CCC[C@@H](OCC(=O)OCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)C1 ZINC000112759540 1412213211 /nfs/dbraw/zinc/21/32/11/1412213211.db2.gz UMHQHEVFLBFFRJ-CRAIPNDOSA-N 0 0 391.468 3.345 20 5 GGBDRN Cc1nc2c(s1)[C@@H](OC(=O)c1cn(-c3cccc([N+](=O)[O-])c3)nn1)CCC2 ZINC000112767397 1412214072 /nfs/dbraw/zinc/21/40/72/1412214072.db2.gz AINJMNBAVQUKNG-HNNXBMFYSA-N 0 0 385.405 3.175 20 5 GGBDRN C[C@@H](Sc1nccn1Cc1ccccn1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000112772623 1412215487 /nfs/dbraw/zinc/21/54/87/1412215487.db2.gz WMARGIDPIRMCRO-CYBMUJFWSA-N 0 0 383.433 3.354 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nccn1Cc1ccccn1 ZINC000112772627 1412215540 /nfs/dbraw/zinc/21/55/40/1412215540.db2.gz YHJCNNARJKWXGL-UHFFFAOYSA-N 0 0 383.433 3.274 20 5 GGBDRN O=C([C@H]1C[C@@H]1c1ccc(F)cc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000112791897 1412218127 /nfs/dbraw/zinc/21/81/27/1412218127.db2.gz YJZVERUNPVIKEG-MSOLQXFVSA-N 0 0 387.386 3.325 20 5 GGBDRN COC(=O)CCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)C ZINC000112826573 1412222227 /nfs/dbraw/zinc/22/22/27/1412222227.db2.gz ABDKOHSAYSWQAJ-UHFFFAOYSA-N 0 0 377.422 3.132 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@@H]2CC[C@@H](C)C[C@@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000112838954 1412223078 /nfs/dbraw/zinc/22/30/78/1412223078.db2.gz WDVWNNCYXIJZDW-VNHYZAJKSA-N 0 0 384.436 3.004 20 5 GGBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000177210598 1428633723 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0 0 396.403 3.092 20 5 GGBDRN CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000115087077 1412586592 /nfs/dbraw/zinc/58/65/92/1412586592.db2.gz ZNWAUJIVVSTIQJ-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2)C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000115106112 1412588865 /nfs/dbraw/zinc/58/88/65/1412588865.db2.gz TZNCPWADAVJPDS-INIZCTEOSA-N 0 0 391.431 3.179 20 5 GGBDRN Cc1cccnc1[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)C(C)C ZINC000115108661 1412590400 /nfs/dbraw/zinc/59/04/00/1412590400.db2.gz FDWXCBRQJAPROA-LJQANCHMSA-N 0 0 398.463 3.262 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)C(C)C ZINC000115110164 1412590804 /nfs/dbraw/zinc/59/08/04/1412590804.db2.gz AITUFUSZTVJJRT-KRWDZBQOSA-N 0 0 380.408 3.006 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(-c3nccc(C)n3)cc2)c(C)c1[N+](=O)[O-] ZINC000115129452 1412592630 /nfs/dbraw/zinc/59/26/30/1412592630.db2.gz QMFZTEDIXMSJFU-UHFFFAOYSA-N 0 0 380.408 3.202 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000115138861 1412594018 /nfs/dbraw/zinc/59/40/18/1412594018.db2.gz UGFUZFBBSKUFPA-CZUORRHYSA-N 0 0 388.445 3.017 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000115134913 1412594185 /nfs/dbraw/zinc/59/41/85/1412594185.db2.gz VDHPYKYATRXBJJ-PBHICJAKSA-N 0 0 377.404 3.194 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000115138855 1412594417 /nfs/dbraw/zinc/59/44/17/1412594417.db2.gz UGFUZFBBSKUFPA-CJNGLKHVSA-N 0 0 388.445 3.017 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000115137011 1412594497 /nfs/dbraw/zinc/59/44/97/1412594497.db2.gz FWZZOCRUXUFMIK-GDBMZVCRSA-N 0 0 377.404 3.194 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000115144528 1412596292 /nfs/dbraw/zinc/59/62/92/1412596292.db2.gz GWIDRDIMGQOHDH-CJNGLKHVSA-N 0 0 399.472 3.190 20 5 GGBDRN Cc1cc(=O)c(C(=O)N(C)[C@H](C)c2ccccc2)nn1-c1ccccc1[N+](=O)[O-] ZINC000115157945 1412600599 /nfs/dbraw/zinc/60/05/99/1412600599.db2.gz IPZVMWLPGORFKD-OAHLLOKOSA-N 0 0 392.415 3.282 20 5 GGBDRN CCc1ccc(OCC(=O)Nc2ccc(N3CCOCC3)cc2)c([N+](=O)[O-])c1 ZINC000115200723 1412605860 /nfs/dbraw/zinc/60/58/60/1412605860.db2.gz OLMZLAHXVOURJN-UHFFFAOYSA-N 0 0 385.420 3.011 20 5 GGBDRN CN1C(=O)C[C@H](C(=O)NCc2ccccc2[N+](=O)[O-])[C@H]1c1cccc(Cl)c1 ZINC000115209775 1412609985 /nfs/dbraw/zinc/60/99/85/1412609985.db2.gz VBQLWCBUYOMKLK-MAUKXSAKSA-N 0 0 387.823 3.084 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(OCC(=O)N(C)C)c(Cl)c1 ZINC000115231322 1412614822 /nfs/dbraw/zinc/61/48/22/1412614822.db2.gz VXGZQPOIKNUYEP-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(OCC(=O)N(C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000115231729 1412614991 /nfs/dbraw/zinc/61/49/91/1412614991.db2.gz NFTAVVAMHNJUSR-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(OCC(=O)N(C)C)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000115232207 1412615887 /nfs/dbraw/zinc/61/58/87/1412615887.db2.gz QDFOGXQWZNPONT-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1 ZINC000115257202 1412623530 /nfs/dbraw/zinc/62/35/30/1412623530.db2.gz XZYRLPGDHAIXCH-NDEPHWFRSA-N 0 0 398.444 3.046 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(C[S@](C)=O)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000115259692 1412624468 /nfs/dbraw/zinc/62/44/68/1412624468.db2.gz CRYGZGAFKJOIGR-HHHXNRCGSA-N 0 0 391.405 3.251 20 5 GGBDRN C[S@@](=O)Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)ccc1Cl ZINC000115268101 1412626484 /nfs/dbraw/zinc/62/64/84/1412626484.db2.gz DOWNCONSJJXHJD-SANMLTNESA-N 0 0 397.796 3.287 20 5 GGBDRN Cc1cccc([C@H](C)NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1C ZINC000115288298 1412634525 /nfs/dbraw/zinc/63/45/25/1412634525.db2.gz ZHTOLZSZPHTHBR-ZDUSSCGKSA-N 0 0 387.461 3.280 20 5 GGBDRN Cc1cccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1C ZINC000115286169 1412634879 /nfs/dbraw/zinc/63/48/79/1412634879.db2.gz BFPCCABVUDUNFF-ZDUSSCGKSA-N 0 0 376.434 3.106 20 5 GGBDRN COc1ccc(C(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000177273201 1428666270 /nfs/dbraw/zinc/66/62/70/1428666270.db2.gz BFSBWFIXWCKJRA-MZHQLVBMSA-N 0 0 376.434 3.174 20 5 GGBDRN O=C(C[C@@H]1CCc2ccccc21)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000115333035 1412650870 /nfs/dbraw/zinc/65/08/70/1412650870.db2.gz HJDMIIWTXKBDQP-HNNXBMFYSA-N 0 0 399.472 3.061 20 5 GGBDRN COc1ccc(NC(=O)Cc2cc(Cl)c3c(c2)OCCO3)c([N+](=O)[O-])c1 ZINC000115346587 1412655366 /nfs/dbraw/zinc/65/53/66/1412655366.db2.gz RBRDBJZHLVVSRW-UHFFFAOYSA-N 0 0 378.768 3.209 20 5 GGBDRN COc1cc(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)ccc1[N+](=O)[O-] ZINC000115409882 1412669371 /nfs/dbraw/zinc/66/93/71/1412669371.db2.gz MXXOAQFHCNOLGJ-UHFFFAOYSA-N 0 0 388.767 3.237 20 5 GGBDRN CN(C)[C@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000115412946 1412670041 /nfs/dbraw/zinc/67/00/41/1412670041.db2.gz RMMBFQUNVIQGFA-MRXNPFEDSA-N 0 0 395.431 3.384 20 5 GGBDRN CN(C)[C@@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000115412943 1412670519 /nfs/dbraw/zinc/67/05/19/1412670519.db2.gz RMMBFQUNVIQGFA-INIZCTEOSA-N 0 0 395.431 3.384 20 5 GGBDRN Cc1ccnc(N(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000115516156 1412700240 /nfs/dbraw/zinc/70/02/40/1412700240.db2.gz VYHMFVXKZKDSDZ-ZDUSSCGKSA-N 0 0 385.342 3.193 20 5 GGBDRN CN(C)[C@@H](CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1c(F)cccc1F ZINC000115518795 1412700760 /nfs/dbraw/zinc/70/07/60/1412700760.db2.gz IXQYGPBMQIEVEZ-KRWDZBQOSA-N 0 0 390.390 3.473 20 5 GGBDRN Cc1ccnc(-c2ccc(NCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)cc2)n1 ZINC000115528830 1412701564 /nfs/dbraw/zinc/70/15/64/1412701564.db2.gz XVRAKMQUKWEMNA-UHFFFAOYSA-N 0 0 389.415 3.361 20 5 GGBDRN COc1cc(C(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000177292342 1428674834 /nfs/dbraw/zinc/67/48/34/1428674834.db2.gz JTKGLDJHJLFOLA-MZHQLVBMSA-N 0 0 376.434 3.174 20 5 GGBDRN O=C(CN1CCSC[C@H]1c1ccccc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000115559484 1412710897 /nfs/dbraw/zinc/71/08/97/1412710897.db2.gz RDDVBXMDPZISOP-IBGZPJMESA-N 0 0 383.473 3.274 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCN(c2ccccc2)C1=O ZINC000115571671 1412716317 /nfs/dbraw/zinc/71/63/17/1412716317.db2.gz JVUSLVPPNRNNCG-IBGZPJMESA-N 0 0 397.431 3.089 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000115587467 1412720853 /nfs/dbraw/zinc/72/08/53/1412720853.db2.gz VTMVJOVMGQSIIX-ZFWWWQNUSA-N 0 0 376.434 3.170 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](c2ccccc2)C[C@@H]1C ZINC000115587765 1412721194 /nfs/dbraw/zinc/72/11/94/1412721194.db2.gz NWGIGULEILONLU-DZGCQCFKSA-N 0 0 376.434 3.170 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000115587465 1412721478 /nfs/dbraw/zinc/72/14/78/1412721478.db2.gz VTMVJOVMGQSIIX-HIFRSBDPSA-N 0 0 376.434 3.170 20 5 GGBDRN CN([C@@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000115588047 1412722131 /nfs/dbraw/zinc/72/21/31/1412722131.db2.gz VOIQZKSXQIBRJU-OAHLLOKOSA-N 0 0 393.440 3.023 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N(Cc2ccc(F)cc2)CC2CC2)cc1 ZINC000115590621 1412722535 /nfs/dbraw/zinc/72/25/35/1412722535.db2.gz ZGJYKGOGBJMRKE-UHFFFAOYSA-N 0 0 378.425 3.476 20 5 GGBDRN COc1ccc(S(=O)(=O)N(Cc2ccc(F)cc2)CC2CC2)cc1[N+](=O)[O-] ZINC000115590667 1412722623 /nfs/dbraw/zinc/72/26/23/1412722623.db2.gz UMVRQPUMWIZAJL-UHFFFAOYSA-N 0 0 394.424 3.343 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115590652 1412722637 /nfs/dbraw/zinc/72/26/37/1412722637.db2.gz KJKUGFVJHRTRJM-UHFFFAOYSA-N 0 0 382.388 3.474 20 5 GGBDRN O=C(NCc1ccco1)[C@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000115632891 1412739874 /nfs/dbraw/zinc/73/98/74/1412739874.db2.gz YJPJPTXEJMQNFM-OAHLLOKOSA-N 0 0 392.799 3.154 20 5 GGBDRN O=C(NCc1nc(-c2cccc(Cl)c2)no1)NCc1ccccc1[N+](=O)[O-] ZINC000115656853 1412748305 /nfs/dbraw/zinc/74/83/05/1412748305.db2.gz UJLNNNIAXVQDJB-UHFFFAOYSA-N 0 0 387.783 3.298 20 5 GGBDRN CCN(CC)C(=O)C1(NC(=O)CCOc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000115661888 1412751811 /nfs/dbraw/zinc/75/18/11/1412751811.db2.gz CBMDIDKMWYNPGS-UHFFFAOYSA-N 0 0 391.468 3.051 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCCN(C(=O)CCc2ccccc2)CC1 ZINC000177292198 1428674572 /nfs/dbraw/zinc/67/45/72/1428674572.db2.gz ZZHTWTXDKHAOEB-UHFFFAOYSA-N 0 0 397.475 3.271 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000115721544 1412772746 /nfs/dbraw/zinc/77/27/46/1412772746.db2.gz WKXHIIUNRBTFHB-HIFRSBDPSA-N 0 0 377.400 3.455 20 5 GGBDRN C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000115721546 1412772989 /nfs/dbraw/zinc/77/29/89/1412772989.db2.gz WKXHIIUNRBTFHB-ZFWWWQNUSA-N 0 0 377.400 3.455 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)c1 ZINC000115863924 1412803973 /nfs/dbraw/zinc/80/39/73/1412803973.db2.gz MHJWMGJPWMMHLP-UHFFFAOYSA-N 0 0 378.388 3.409 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000115878612 1412807239 /nfs/dbraw/zinc/80/72/39/1412807239.db2.gz DHCUSWSNUXCLLQ-HNNXBMFYSA-N 0 0 390.827 3.404 20 5 GGBDRN Cc1cccnc1[C@H](NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000115878834 1412807617 /nfs/dbraw/zinc/80/76/17/1412807617.db2.gz DOTJAXFXMPMJHT-OAHLLOKOSA-N 0 0 390.827 3.404 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1c2cccc(F)c2CC[C@@H]1C ZINC000177301420 1428678016 /nfs/dbraw/zinc/67/80/16/1428678016.db2.gz NICSYHXZPHAHTA-KPZWWZAWSA-N 0 0 385.395 3.421 20 5 GGBDRN CCc1ccc(OC(=O)Cn2cnc3sc(C)c(C)c3c2=O)c([N+](=O)[O-])c1 ZINC000115926589 1412816364 /nfs/dbraw/zinc/81/63/64/1412816364.db2.gz JDGKOERIULZVMV-UHFFFAOYSA-N 0 0 387.417 3.151 20 5 GGBDRN CCc1ccc(OC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)c([N+](=O)[O-])c1 ZINC000115925988 1412816369 /nfs/dbraw/zinc/81/63/69/1412816369.db2.gz VMXHGFXRZYMFIM-UHFFFAOYSA-N 0 0 385.344 3.373 20 5 GGBDRN C[C@]1(c2cc(F)ccc2F)NC(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115964652 1412818224 /nfs/dbraw/zinc/81/82/24/1412818224.db2.gz MXZPKDFKIKSXQC-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN COc1ccc([C@@]2(C)NC(=O)N(Cc3ccc(Cl)cc3[N+](=O)[O-])C2=O)cc1 ZINC000115963029 1412818300 /nfs/dbraw/zinc/81/83/00/1412818300.db2.gz MUOHKGMULNCAGV-GOSISDBHSA-N 0 0 389.795 3.224 20 5 GGBDRN CC(C)Cn1c(CCC(N)=O)nnc1SCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000115964751 1412818339 /nfs/dbraw/zinc/81/83/39/1412818339.db2.gz OSRMIJRQOHRXRY-UHFFFAOYSA-N 0 0 397.888 3.206 20 5 GGBDRN Cc1ccc(N2C(=O)C(=O)N(Cc3ccc(Cl)cc3[N+](=O)[O-])C2=O)c(C)c1 ZINC000115965487 1412818499 /nfs/dbraw/zinc/81/84/99/1412818499.db2.gz YWVWGPYHDRXAQG-UHFFFAOYSA-N 0 0 387.779 3.360 20 5 GGBDRN C[C@H](c1ccccc1)N1C(=O)C(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115965499 1412818524 /nfs/dbraw/zinc/81/85/24/1412818524.db2.gz QTPPPPWWDFIMKX-LLVKDONJSA-N 0 0 387.779 3.300 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CSc1nnc(N2CCOCC2)n1C1CC1 ZINC000115965250 1412818534 /nfs/dbraw/zinc/81/85/34/1412818534.db2.gz VUADZRZOLCVGME-UHFFFAOYSA-N 0 0 395.872 3.304 20 5 GGBDRN C[C@@]1(c2ccc(F)cc2)NC(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115965034 1412818578 /nfs/dbraw/zinc/81/85/78/1412818578.db2.gz HIYPIPZGYOAWHT-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@]1(c2ccccc2F)NC(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115965904 1412818721 /nfs/dbraw/zinc/81/87/21/1412818721.db2.gz VQKQGXOTHXPCTE-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN COCCn1ncc2ccc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)cc21 ZINC000115969039 1412818998 /nfs/dbraw/zinc/81/89/98/1412818998.db2.gz WMKDBQGVRDLNAQ-UHFFFAOYSA-N 0 0 386.433 3.322 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 ZINC000116030183 1412823050 /nfs/dbraw/zinc/82/30/50/1412823050.db2.gz JEUXOWJSDMZUAT-MHZLTWQESA-N 0 0 392.481 3.176 20 5 GGBDRN CCNC(=O)c1ccc(OC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000116034752 1412823843 /nfs/dbraw/zinc/82/38/43/1412823843.db2.gz ATQYVXYZKMALES-UHFFFAOYSA-N 0 0 397.431 3.167 20 5 GGBDRN CCOC(=O)c1cc2cc(NC(=O)Cn3cc([N+](=O)[O-])nc3C)ccc2s1 ZINC000116045214 1412824827 /nfs/dbraw/zinc/82/48/27/1412824827.db2.gz ROPWTWIAPJWNNM-UHFFFAOYSA-N 0 0 388.405 3.130 20 5 GGBDRN CS(=O)(=O)Cc1ccc(C(=O)OCc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000116061791 1412826594 /nfs/dbraw/zinc/82/65/94/1412826594.db2.gz IXGHNLVRTPTNAB-UHFFFAOYSA-N 0 0 383.809 3.150 20 5 GGBDRN O=C(CCn1cnc2ccccc2c1=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116061766 1412826607 /nfs/dbraw/zinc/82/66/07/1412826607.db2.gz KCHQXVOPPUKPCU-UHFFFAOYSA-N 0 0 387.779 3.092 20 5 GGBDRN Cc1cccc([C@H](CC(=O)OCc2cc([N+](=O)[O-])ccc2Cl)NC(N)=O)c1 ZINC000116062335 1412826625 /nfs/dbraw/zinc/82/66/25/1412826625.db2.gz FAIMSZWCWXBWKV-INIZCTEOSA-N 0 0 391.811 3.400 20 5 GGBDRN O=C(Cn1cccc(C(F)(F)F)c1=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116061754 1412826632 /nfs/dbraw/zinc/82/66/32/1412826632.db2.gz ZUDVSKPXHWWZEK-UHFFFAOYSA-N 0 0 390.701 3.172 20 5 GGBDRN O=C(CCn1cnc2sccc2c1=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116062605 1412826883 /nfs/dbraw/zinc/82/68/83/1412826883.db2.gz QRRYUPFQODKMTL-UHFFFAOYSA-N 0 0 393.808 3.153 20 5 GGBDRN CCS(=O)(=O)c1ccc(C(=O)OCc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000116062717 1412827014 /nfs/dbraw/zinc/82/70/14/1412827014.db2.gz UCJKVJPHDUUPRV-UHFFFAOYSA-N 0 0 383.809 3.399 20 5 GGBDRN CC(C)(C)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CC1 ZINC000116090304 1412830640 /nfs/dbraw/zinc/83/06/40/1412830640.db2.gz SQHPLXRPFHEZRN-AWEZNQCLSA-N 0 0 382.482 3.287 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000116093641 1412830851 /nfs/dbraw/zinc/83/08/51/1412830851.db2.gz WPPNLBLHJYMHII-GWCFXTLKSA-N 0 0 377.303 3.376 20 5 GGBDRN CC(C)C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1F)N1C(=O)c2ccccc2C1=O ZINC000116094738 1412831359 /nfs/dbraw/zinc/83/13/59/1412831359.db2.gz WYGXLTQVDQPYAP-KRWDZBQOSA-N 0 0 399.378 3.383 20 5 GGBDRN O=C(N[C@H]1C[C@H]1c1c(F)cccc1F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116097116 1412831554 /nfs/dbraw/zinc/83/15/54/1412831554.db2.gz LGORJCRDZXXXLK-DYVFJYSZSA-N 0 0 384.342 3.345 20 5 GGBDRN O=C(NC1(c2nccs2)CCCC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000116104101 1412832257 /nfs/dbraw/zinc/83/22/57/1412832257.db2.gz KMSPHZKUOZQIOG-UHFFFAOYSA-N 0 0 383.433 3.436 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NC2(c3nccs3)CCCC2)cc([N+](=O)[O-])c1 ZINC000116104233 1412832334 /nfs/dbraw/zinc/83/23/34/1412832334.db2.gz RFPRUPPHLIALEH-UHFFFAOYSA-N 0 0 389.433 3.427 20 5 GGBDRN Cc1c(C(=O)NC2(c3nccs3)CCCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000116104333 1412832849 /nfs/dbraw/zinc/83/28/49/1412832849.db2.gz ZJPWJTSHYNQQJX-UHFFFAOYSA-N 0 0 376.394 3.467 20 5 GGBDRN O=C(NCCCNc1ccc(C(F)(F)F)cn1)c1cc(F)ccc1[N+](=O)[O-] ZINC000116108553 1412833090 /nfs/dbraw/zinc/83/30/90/1412833090.db2.gz MIWMBHJJPJHETD-UHFFFAOYSA-N 0 0 386.305 3.380 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H]1CCCN(c2cccc(F)c2)C1 ZINC000116108947 1412833148 /nfs/dbraw/zinc/83/31/48/1412833148.db2.gz YWNXBKKDUSUMDV-AWEZNQCLSA-N 0 0 391.374 3.037 20 5 GGBDRN CCOc1ccc(NC(=O)COC(=O)c2cc(N)ccc2Cl)c([N+](=O)[O-])c1 ZINC000116109536 1412833608 /nfs/dbraw/zinc/83/36/08/1412833608.db2.gz BFTFVLKLDRWDDJ-UHFFFAOYSA-N 0 0 393.783 3.025 20 5 GGBDRN CCCN(C)c1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000116129860 1412834787 /nfs/dbraw/zinc/83/47/87/1412834787.db2.gz GTEPORRTJTYYKP-UHFFFAOYSA-N 0 0 382.464 3.403 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc(CSC2CCOCC2)c1 ZINC000116131669 1412835170 /nfs/dbraw/zinc/83/51/70/1412835170.db2.gz CREAHZLDGNDRBU-UHFFFAOYSA-N 0 0 390.465 3.151 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000116136504 1412835917 /nfs/dbraw/zinc/83/59/17/1412835917.db2.gz LCLBAZYYCLJAKU-HNNXBMFYSA-N 0 0 394.884 3.460 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NCc1cnn(-c2ccccc2)c1 ZINC000116144366 1412836290 /nfs/dbraw/zinc/83/62/90/1412836290.db2.gz BZOHLLVOGPGTPG-UHFFFAOYSA-N 0 0 397.347 3.087 20 5 GGBDRN CCOc1cc(C(=O)NC(C)(C)c2nc(C)cs2)c([N+](=O)[O-])cc1OC ZINC000116147868 1412836861 /nfs/dbraw/zinc/83/68/61/1412836861.db2.gz KPRVVVMNCGFSFC-UHFFFAOYSA-N 0 0 379.438 3.432 20 5 GGBDRN CC(C)(CNC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000116153006 1412837555 /nfs/dbraw/zinc/83/75/55/1412837555.db2.gz QZRSWBZOKQSXPY-UHFFFAOYSA-N 0 0 386.404 3.186 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Sc2nccn2C)cc1 ZINC000116173184 1412839641 /nfs/dbraw/zinc/83/96/41/1412839641.db2.gz RDPNACBTWWMVRJ-UHFFFAOYSA-N 0 0 386.437 3.013 20 5 GGBDRN COC(=O)c1c(CC(C)C)csc1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000116173977 1412839645 /nfs/dbraw/zinc/83/96/45/1412839645.db2.gz NBAPMTJLXVAEEG-UHFFFAOYSA-N 0 0 394.453 3.175 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2ccc(F)c(NC(=O)c3ccoc3C)c2)c1[N+](=O)[O-] ZINC000116206510 1412842384 /nfs/dbraw/zinc/84/23/84/1412842384.db2.gz QWPKZHVBMKTKCI-UHFFFAOYSA-N 0 0 387.327 3.171 20 5 GGBDRN Cc1n[nH]c(C(=O)NCc2ccccc2COCc2ccccc2)c1[N+](=O)[O-] ZINC000116206775 1412842591 /nfs/dbraw/zinc/84/25/91/1412842591.db2.gz REZIIYPREZNLAI-UHFFFAOYSA-N 0 0 380.404 3.273 20 5 GGBDRN O=C(N[C@H]1CCCN(c2cccc(F)c2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000116227439 1412845586 /nfs/dbraw/zinc/84/55/86/1412845586.db2.gz CWIVQHBPHZGBSO-ZDUSSCGKSA-N 0 0 383.383 3.009 20 5 GGBDRN CCOCCCNC(=O)C1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000116272975 1412847083 /nfs/dbraw/zinc/84/70/83/1412847083.db2.gz OITOTHOUVBKDJP-UHFFFAOYSA-N 0 0 383.876 3.003 20 5 GGBDRN COc1ccc(OC)c2c1CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]2O ZINC000116272332 1412847118 /nfs/dbraw/zinc/84/71/18/1412847118.db2.gz DXQDYXZSDSVHFT-OAHLLOKOSA-N 0 0 378.812 3.315 20 5 GGBDRN COc1ccc(OC)c(CN(CCO)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116280011 1412847564 /nfs/dbraw/zinc/84/75/64/1412847564.db2.gz MBRFJBLHPHDYAJ-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN O=C(c1c(F)cccc1F)N1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000116276835 1412847656 /nfs/dbraw/zinc/84/76/56/1412847656.db2.gz CNFUJRMREQVKHS-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN Cc1nn(C)c2nc(C)cc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)c12 ZINC000116303534 1412848426 /nfs/dbraw/zinc/84/84/26/1412848426.db2.gz CCGBHOQOYSUIBY-UHFFFAOYSA-N 0 0 391.391 3.136 20 5 GGBDRN Cc1sc2nc(CCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)[nH]c(=O)c2c1C ZINC000116346134 1412851681 /nfs/dbraw/zinc/85/16/81/1412851681.db2.gz SVQOBLLHIJHOCQ-UHFFFAOYSA-N 0 0 398.444 3.032 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000177309801 1428681240 /nfs/dbraw/zinc/68/12/40/1428681240.db2.gz KKDDLCKBULQFLV-YBOJIHHZSA-N 0 0 386.433 3.042 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000177309788 1428681622 /nfs/dbraw/zinc/68/16/22/1428681622.db2.gz KKDDLCKBULQFLV-LUGWNYHVSA-N 0 0 386.433 3.042 20 5 GGBDRN C[C@@H](OC(=O)c1csc(-c2ccccn2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000116419111 1412856805 /nfs/dbraw/zinc/85/68/05/1412856805.db2.gz RXJBALGRLZBDKV-LLVKDONJSA-N 0 0 398.400 3.297 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000116463755 1412864181 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0 0 394.475 3.466 20 5 GGBDRN COCc1ccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116627024 1412888666 /nfs/dbraw/zinc/88/86/66/1412888666.db2.gz WJECPRQYKMYQLT-UHFFFAOYSA-N 0 0 378.812 3.480 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116628624 1412889023 /nfs/dbraw/zinc/88/90/23/1412889023.db2.gz QGDIDNQDIKTOSC-UHFFFAOYSA-N 0 0 391.811 3.292 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cnn(C[C@@H]2CCCO2)c1 ZINC000116638598 1412889961 /nfs/dbraw/zinc/88/99/61/1412889961.db2.gz OVVMXZHBJHVATK-AWEZNQCLSA-N 0 0 394.815 3.031 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)cc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000116644296 1412890755 /nfs/dbraw/zinc/89/07/55/1412890755.db2.gz XERZQPAVHKMMJF-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN COc1cc(OC)c(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1Cl ZINC000116652025 1412891468 /nfs/dbraw/zinc/89/14/68/1412891468.db2.gz XIBIQPODZYTZNT-UHFFFAOYSA-N 0 0 382.804 3.108 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ncc(Cc3ccccc3)s2)c(C)c1[N+](=O)[O-] ZINC000116654749 1412891912 /nfs/dbraw/zinc/89/19/12/1412891912.db2.gz KOEIWNQORFWXRY-UHFFFAOYSA-N 0 0 385.449 3.484 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)CC2)cc1 ZINC000116653891 1412892086 /nfs/dbraw/zinc/89/20/86/1412892086.db2.gz WNLPNWKCLGBTHA-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(N3CCCC3)c(F)c2)c(C)c1[N+](=O)[O-] ZINC000116656084 1412892403 /nfs/dbraw/zinc/89/24/03/1412892403.db2.gz IHRFMVPJTHZMIY-UHFFFAOYSA-N 0 0 375.404 3.176 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000116659873 1412893437 /nfs/dbraw/zinc/89/34/37/1412893437.db2.gz HJUGFLQELHGIOH-OAHLLOKOSA-N 0 0 389.839 3.194 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc([N+](=O)[O-])s1 ZINC000116661138 1412893982 /nfs/dbraw/zinc/89/39/82/1412893982.db2.gz UITGSXLBMPUKTE-SNVBAGLBSA-N 0 0 383.376 3.266 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1)C(C)C ZINC000116662467 1412894390 /nfs/dbraw/zinc/89/43/90/1412894390.db2.gz LUZNAPQMKVCSCK-UHFFFAOYSA-N 0 0 385.420 3.369 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(CCc1ccc(Cl)cc1)CC1CC1 ZINC000116666389 1412894898 /nfs/dbraw/zinc/89/48/98/1412894898.db2.gz UEJPJAXUDVOKAR-UHFFFAOYSA-N 0 0 376.844 3.234 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2ncc(Cl)n2C)CC1 ZINC000116670201 1412895067 /nfs/dbraw/zinc/89/50/67/1412895067.db2.gz ZCRZWOWCVRVXQQ-UHFFFAOYSA-N 0 0 391.859 3.148 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000116681409 1412896247 /nfs/dbraw/zinc/89/62/47/1412896247.db2.gz MSXBAANLCRMEIV-AREMUKBSSA-N 0 0 376.434 3.051 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000116683751 1412896898 /nfs/dbraw/zinc/89/68/98/1412896898.db2.gz LPYOAGDPLVFJON-AREMUKBSSA-N 0 0 396.852 3.396 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000116684324 1412896983 /nfs/dbraw/zinc/89/69/83/1412896983.db2.gz DPFPAWYJVWTDCT-SANMLTNESA-N 0 0 396.852 3.396 20 5 GGBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000116688941 1412897560 /nfs/dbraw/zinc/89/75/60/1412897560.db2.gz JTLFKMHQKIZLAU-AREMUKBSSA-N 0 0 375.450 3.222 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000116692862 1412898215 /nfs/dbraw/zinc/89/82/15/1412898215.db2.gz XREODBIQDVYSSG-NDEPHWFRSA-N 0 0 398.444 3.220 20 5 GGBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000116695883 1412898515 /nfs/dbraw/zinc/89/85/15/1412898515.db2.gz IJFLEAFDIIEUTN-MUUNZHRXSA-N 0 0 398.444 3.220 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)o1 ZINC000116702139 1412899242 /nfs/dbraw/zinc/89/92/42/1412899242.db2.gz NTHAHCVVNNTUSW-IBGZPJMESA-N 0 0 399.447 3.313 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)cc1 ZINC000116705456 1412899430 /nfs/dbraw/zinc/89/94/30/1412899430.db2.gz WSDPJKUXJKLRFA-HXUWFJFHSA-N 0 0 391.431 3.429 20 5 GGBDRN O=C(Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccc(OC(F)F)cc1 ZINC000116705334 1412899450 /nfs/dbraw/zinc/89/94/50/1412899450.db2.gz YPHLIGQGHPSKQE-UHFFFAOYSA-N 0 0 389.318 3.093 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(C[S@@](C)=O)c1C ZINC000116712046 1412901097 /nfs/dbraw/zinc/90/10/97/1412901097.db2.gz MZUZSWBVPAKNDB-VWLOTQADSA-N 0 0 396.490 3.145 20 5 GGBDRN Cc1cc(C)n(CCCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000116715317 1412903261 /nfs/dbraw/zinc/90/32/61/1412903261.db2.gz IFBNJPLNTGYCGD-UHFFFAOYSA-N 0 0 380.832 3.037 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H](c2cc[nH]n2)C1 ZINC000116736579 1412910965 /nfs/dbraw/zinc/91/09/65/1412910965.db2.gz ZXXSAGJXFAPKNG-LBPRGKRZSA-N 0 0 378.816 3.146 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC(n2cccn2)CC1 ZINC000116738148 1412911690 /nfs/dbraw/zinc/91/16/90/1412911690.db2.gz XMWJRJXATXUALI-UHFFFAOYSA-N 0 0 378.816 3.077 20 5 GGBDRN CC(C)(C)NC(=O)[C@H]1CSCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000116742348 1412913084 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PVICQWSVWWJIFK-UHFFFAOYSA-N 0 0 395.419 3.480 20 5 GGBDRN O=C(Nc1cnn(CC(F)F)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116839420 1412937965 /nfs/dbraw/zinc/93/79/65/1412937965.db2.gz SUDKGNMHAPVRSU-UHFFFAOYSA-N 0 0 379.348 3.432 20 5 GGBDRN Cc1ccc(OC2CCN(CN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)CC2)cc1 ZINC000116868246 1412945437 /nfs/dbraw/zinc/94/54/37/1412945437.db2.gz WGRSTPHCBXLWEL-UHFFFAOYSA-N 0 0 395.415 3.000 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1 ZINC000116873405 1412946339 /nfs/dbraw/zinc/94/63/39/1412946339.db2.gz RBKDVOGQEDQABW-FQEVSTJZSA-N 0 0 399.447 3.420 20 5 GGBDRN Cc1ccc(OC2CCN(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)CC2)cc1 ZINC000116882783 1412948076 /nfs/dbraw/zinc/94/80/76/1412948076.db2.gz WTVWSKOGIGEMLN-UHFFFAOYSA-N 0 0 395.459 3.336 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCCc3cc(F)c(F)cc32)cc([N+](=O)[O-])c1 ZINC000116880408 1412948782 /nfs/dbraw/zinc/94/87/82/1412948782.db2.gz VOMGLNJDTZBBBP-UHFFFAOYSA-N 0 0 376.315 3.253 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000116893828 1412950996 /nfs/dbraw/zinc/95/09/96/1412950996.db2.gz HHEVJGXBUUQQES-HNNXBMFYSA-N 0 0 379.800 3.162 20 5 GGBDRN Cc1ccc([C@H]2COCCN2CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000116897296 1412952497 /nfs/dbraw/zinc/95/24/97/1412952497.db2.gz BPIVGOPEAZAXNS-OAHLLOKOSA-N 0 0 379.800 3.162 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000116903346 1412952890 /nfs/dbraw/zinc/95/28/90/1412952890.db2.gz FSTQMWJFILZGMI-UHFFFAOYSA-N 0 0 390.461 3.276 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000116985310 1412972326 /nfs/dbraw/zinc/97/23/26/1412972326.db2.gz FPEFRYSGUZBDCP-FQEVSTJZSA-N 0 0 399.447 3.420 20 5 GGBDRN CN(C[C@H]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000177327557 1428691871 /nfs/dbraw/zinc/69/18/71/1428691871.db2.gz ZFXXOAMEBPZOHT-GFCCVEGCSA-N 0 0 381.404 3.063 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)Nc1ccc(N2CCOCC2)cc1 ZINC000177328507 1428691917 /nfs/dbraw/zinc/69/19/17/1428691917.db2.gz JNTTWIKRMZNGIR-UHFFFAOYSA-N 0 0 391.811 3.102 20 5 GGBDRN CC(C)C(=O)Nc1cc2ccccc2cc1C(=O)OCCn1cc([N+](=O)[O-])cn1 ZINC000177328594 1428691932 /nfs/dbraw/zinc/69/19/32/1428691932.db2.gz YFFYBCPRPCFOHB-UHFFFAOYSA-N 0 0 396.403 3.396 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000177329087 1428692536 /nfs/dbraw/zinc/69/25/36/1428692536.db2.gz PACQNYMXZNGOAX-JWNZJDHWSA-N 0 0 394.424 3.070 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)OC2CCN(c3ccc(Cl)cn3)CC2)c1 ZINC000117098972 1412999220 /nfs/dbraw/zinc/99/92/20/1412999220.db2.gz YVXLRVQGKYAPAQ-UHFFFAOYSA-N 0 0 391.811 3.478 20 5 GGBDRN COc1cc(C(=O)OC2CCN(c3ccc(Cl)cn3)CC2)ccc1[N+](=O)[O-] ZINC000117099493 1412999543 /nfs/dbraw/zinc/99/95/43/1412999543.db2.gz UQLNURZKOKGYBA-UHFFFAOYSA-N 0 0 391.811 3.478 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCOc1ccc(-c2nnco2)cc1 ZINC000117108735 1413000316 /nfs/dbraw/zinc/00/03/16/1413000316.db2.gz FJOTZDKWKIKBDG-UHFFFAOYSA-N 0 0 382.332 3.022 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCSc1nnc(-c2ccncc2)o1 ZINC000117108451 1413000492 /nfs/dbraw/zinc/00/04/92/1413000492.db2.gz RJCSEFFQGKXBPI-UHFFFAOYSA-N 0 0 399.388 3.130 20 5 GGBDRN CCOC(=O)c1ccc(OCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)cc1 ZINC000117108662 1413000600 /nfs/dbraw/zinc/00/06/00/1413000600.db2.gz DMBJLEGWENQTND-UHFFFAOYSA-N 0 0 386.360 3.149 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2n[nH]c(-c3ccccn3)n2)cccc1[N+](=O)[O-] ZINC000117113515 1413001624 /nfs/dbraw/zinc/00/16/24/1413001624.db2.gz SZCSFDCTLDTQHW-LLVKDONJSA-N 0 0 384.421 3.203 20 5 GGBDRN Cc1cc(OCc2ccccc2)ccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000117150012 1413005779 /nfs/dbraw/zinc/00/57/79/1413005779.db2.gz FGAMJBOYYVMZFH-UHFFFAOYSA-N 0 0 393.399 3.283 20 5 GGBDRN CC[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000117160439 1413007707 /nfs/dbraw/zinc/00/77/07/1413007707.db2.gz AVLMOTIBRZOKCG-KBPBESRZSA-N 0 0 379.482 3.300 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)Nc1cccc(N2CCCC2=O)c1 ZINC000177332377 1428693880 /nfs/dbraw/zinc/69/38/80/1428693880.db2.gz MTHGRWPCSMJHMB-UHFFFAOYSA-N 0 0 389.795 3.393 20 5 GGBDRN CC(C)(CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)Cc1ccccc1 ZINC000117194392 1413010818 /nfs/dbraw/zinc/01/08/18/1413010818.db2.gz MFLYRBNSMWVMRS-UHFFFAOYSA-N 0 0 397.475 3.430 20 5 GGBDRN CCNC(=O)c1cccc(NC(=O)COc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000177332265 1428694258 /nfs/dbraw/zinc/69/42/58/1428694258.db2.gz FKPLHXSHIQCRJQ-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CS[C@@H]1CCC[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000117226920 1413014219 /nfs/dbraw/zinc/01/42/19/1413014219.db2.gz DTRQQRJYYXCIFY-XQQFMLRXSA-N 0 0 397.522 3.051 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccco1)CC(F)(F)F ZINC000117247119 1413018382 /nfs/dbraw/zinc/01/83/82/1413018382.db2.gz RIBXEXQOLWQOQI-UHFFFAOYSA-N 0 0 395.293 3.234 20 5 GGBDRN CCN(C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1C ZINC000117250274 1413019009 /nfs/dbraw/zinc/01/90/09/1413019009.db2.gz SPNNJBWDOJQHAA-JSGCOSHPSA-N 0 0 381.860 3.405 20 5 GGBDRN C[C@@H]1Cc2ccccc2N(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000117253568 1413019683 /nfs/dbraw/zinc/01/96/83/1413019683.db2.gz WLYXQVXQWIRLRA-GFCCVEGCSA-N 0 0 387.823 3.203 20 5 GGBDRN CC[C@H](C)[C@@H](C)N(C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000117253967 1413019797 /nfs/dbraw/zinc/01/97/97/1413019797.db2.gz DARJWKIFHFHTKG-NWDGAFQWSA-N 0 0 381.860 3.404 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N(CCc1cccc(F)c1)C1CC1 ZINC000117260787 1413020332 /nfs/dbraw/zinc/02/03/32/1413020332.db2.gz PAQMJGDMHMNFHQ-UHFFFAOYSA-N 0 0 395.390 3.423 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C(C)C ZINC000117261184 1413020497 /nfs/dbraw/zinc/02/04/97/1413020497.db2.gz MXQQHFUAKSKBQG-SFHVURJKSA-N 0 0 380.404 3.267 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCSC[C@@H]1c1ccccc1 ZINC000117261325 1413020734 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C[C@@H]1Oc2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)cc2NC1=O ZINC000117584229 1413054135 /nfs/dbraw/zinc/05/41/35/1413054135.db2.gz KWEXZISEIFNSDD-VIFPVBQESA-N 0 0 375.768 3.149 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc(-c2nnnn2C2CC2)c1 ZINC000117588047 1413054470 /nfs/dbraw/zinc/05/44/70/1413054470.db2.gz OLHGRHCHNDNUKZ-UHFFFAOYSA-N 0 0 398.810 3.418 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cc(-n2cnnn2)ccc1Cl ZINC000117610870 1413056072 /nfs/dbraw/zinc/05/60/72/1413056072.db2.gz MBXYGMNKDBDGEA-UHFFFAOYSA-N 0 0 393.190 3.059 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccccc1CN1CCOCC1 ZINC000117622648 1413056696 /nfs/dbraw/zinc/05/66/96/1413056696.db2.gz NSMFDNADPZVAMI-UHFFFAOYSA-N 0 0 389.839 3.262 20 5 GGBDRN Cc1sc(NC(=O)COC[C@@H]2CCOC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000117622227 1413056858 /nfs/dbraw/zinc/05/68/58/1413056858.db2.gz ZEQCPFFLMMAEPF-GFCCVEGCSA-N 0 0 377.422 3.018 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccccc1N1CCC(O)CC1 ZINC000117622931 1413057895 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ZINC000117892049 1413087290 /nfs/dbraw/zinc/08/72/90/1413087290.db2.gz NIDMHDOKGRDUQM-LJQANCHMSA-N 0 0 399.447 3.394 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000117951778 1413091955 /nfs/dbraw/zinc/09/19/55/1413091955.db2.gz ZMZDHGHIQHZPOA-LBPRGKRZSA-N 0 0 390.469 3.467 20 5 GGBDRN C[C@@](O)(CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccsc1 ZINC000177352234 1428702518 /nfs/dbraw/zinc/70/25/18/1428702518.db2.gz BNHKCVPHSGWZLF-CQSZACIVSA-N 0 0 385.239 3.056 20 5 GGBDRN C[C@@H](c1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1)N1CCOCC1 ZINC000118031785 1413100602 /nfs/dbraw/zinc/10/06/02/1413100602.db2.gz PIADONDYRBDGSB-INIZCTEOSA-N 0 0 398.463 3.352 20 5 GGBDRN C[C@@](O)(CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1cccs1 ZINC000177352036 1428701904 /nfs/dbraw/zinc/70/19/04/1428701904.db2.gz OCMLDDNTYFIJFI-CQSZACIVSA-N 0 0 385.239 3.056 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000177350528 1428702173 /nfs/dbraw/zinc/70/21/73/1428702173.db2.gz MNLSXNYQHSCYOD-MRXNPFEDSA-N 0 0 386.301 3.497 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCC[C@@H]2c2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000118135644 1413116123 /nfs/dbraw/zinc/11/61/23/1413116123.db2.gz HZVKADRDCWBZGE-GOSISDBHSA-N 0 0 396.447 3.271 20 5 GGBDRN O=C(OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc2c(c1)CCC(=O)N2 ZINC000118158193 1413117033 /nfs/dbraw/zinc/11/70/33/1413117033.db2.gz SVSFVHXOZLDENG-UHFFFAOYSA-N 0 0 393.355 3.492 20 5 GGBDRN C[S@](=O)c1ccc(C(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000118158299 1413117119 /nfs/dbraw/zinc/11/71/19/1413117119.db2.gz UROIWASCUBFWCL-HHHXNRCGSA-N 0 0 386.385 3.344 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(-n2ccnc2)c(F)c1 ZINC000118161390 1413117451 /nfs/dbraw/zinc/11/74/51/1413117451.db2.gz AMQCQEJZBDIEIC-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN CS(=O)(=O)c1ccc(-c2noc(Cc3ccc([N+](=O)[O-])cc3Cl)n2)cc1 ZINC000118167109 1413118180 /nfs/dbraw/zinc/11/81/80/1413118180.db2.gz SMHZMNLWSTXDJA-UHFFFAOYSA-N 0 0 393.808 3.293 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cnn(CC(F)(F)F)c1 ZINC000118235070 1413131399 /nfs/dbraw/zinc/13/13/99/1413131399.db2.gz JNFDSGUOADWWDL-MRVPVSSYSA-N 0 0 392.721 3.413 20 5 GGBDRN O=C(Nc1cnn(CC(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1Br ZINC000118236508 1413132028 /nfs/dbraw/zinc/13/20/28/1413132028.db2.gz JJVHABFKYCPBHT-UHFFFAOYSA-N 0 0 393.119 3.368 20 5 GGBDRN CCOc1cc(C(=O)Nc2cnn(CC(F)(F)F)c2)c([N+](=O)[O-])cc1OC ZINC000118239329 1413133038 /nfs/dbraw/zinc/13/30/38/1413133038.db2.gz KJTUWGPKTLRSDZ-UHFFFAOYSA-N 0 0 388.302 3.013 20 5 GGBDRN COC[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1cccc(C(F)(F)F)c1 ZINC000118240787 1413133252 /nfs/dbraw/zinc/13/32/52/1413133252.db2.gz TXYAFAXISDFDQE-INIZCTEOSA-N 0 0 398.337 3.496 20 5 GGBDRN O=C(Nc1cc(-c2ccco2)nn1-c1cccc([N+](=O)[O-])c1)C1CCOCC1 ZINC000118249808 1413135801 /nfs/dbraw/zinc/13/58/01/1413135801.db2.gz OJRCQIHKDWLIAO-UHFFFAOYSA-N 0 0 382.376 3.406 20 5 GGBDRN O=C(Nc1cc(-c2ccco2)nn1-c1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1 ZINC000118249843 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/nfs/dbraw/zinc/14/09/25/1413140925.db2.gz XRORRKCTSGAWBH-KSSFIOAISA-N 0 0 386.452 3.352 20 5 GGBDRN CCO[C@H](CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCC1 ZINC000177361723 1428704643 /nfs/dbraw/zinc/70/46/43/1428704643.db2.gz RZLGATLLVDXIEQ-LJQANCHMSA-N 0 0 386.452 3.496 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1ccc(N2CCNC2=O)cc1 ZINC000118295808 1413144171 /nfs/dbraw/zinc/14/41/71/1413144171.db2.gz HPLMAHBVOSDWNC-UHFFFAOYSA-N 0 0 375.768 3.305 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1ccc(=O)n(-c2ccccc2)n1 ZINC000118296065 1413144223 /nfs/dbraw/zinc/14/42/23/1413144223.db2.gz RDZAXDYTVPIJMK-UHFFFAOYSA-N 0 0 385.763 3.322 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)CCn1cnc2ccccc2c1=O ZINC000118296750 1413145444 /nfs/dbraw/zinc/14/54/44/1413145444.db2.gz UWAILNZMVRQCDY-UHFFFAOYSA-N 0 0 387.779 3.262 20 5 GGBDRN Cn1cc(C(=O)NCCOC2CCCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000118360455 1413155018 /nfs/dbraw/zinc/15/50/18/1413155018.db2.gz GETHTTSUCZMYKH-UHFFFAOYSA-N 0 0 386.452 3.465 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C ZINC000118470046 1413163255 /nfs/dbraw/zinc/16/32/55/1413163255.db2.gz HMWVFCFVJFLATN-GUYCJALGSA-N 0 0 379.457 3.244 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)c2cc(Cl)cc(Cl)c2)c1 ZINC000118518116 1413170011 /nfs/dbraw/zinc/17/00/11/1413170011.db2.gz WLIPZFMUIJKFQC-HNNXBMFYSA-N 0 0 385.203 3.374 20 5 GGBDRN O=C(NC[C@H](O)c1cc(Cl)cc(Cl)c1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000118517727 1413170080 /nfs/dbraw/zinc/17/00/80/1413170080.db2.gz PVPVEQUTXNECOL-AWEZNQCLSA-N 0 0 395.202 3.241 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118519210 1413170725 /nfs/dbraw/zinc/17/07/25/1413170725.db2.gz HIAINIBVRLLBSJ-OAHLLOKOSA-N 0 0 385.203 3.130 20 5 GGBDRN O=C(NCCOC1CCCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000118593783 1413190520 /nfs/dbraw/zinc/19/05/20/1413190520.db2.gz UQOICAQWQRRYBA-UHFFFAOYSA-N 0 0 383.832 3.042 20 5 GGBDRN CCOC(=O)c1ccccc1N(CC)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000118661623 1413202579 /nfs/dbraw/zinc/20/25/79/1413202579.db2.gz QGJZLTZDGAREPK-UHFFFAOYSA-N 0 0 388.424 3.028 20 5 GGBDRN Cc1cccc(OCCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000118689321 1413204869 /nfs/dbraw/zinc/20/48/69/1413204869.db2.gz DPSBTSGKBDSUIG-MRXNPFEDSA-N 0 0 384.436 3.089 20 5 GGBDRN O=C(c1cccc(-n2cccc2)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689148 1413204939 /nfs/dbraw/zinc/20/49/39/1413204939.db2.gz SJRXMEOUHWMWKU-MRXNPFEDSA-N 0 0 377.404 3.107 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689504 1413205232 /nfs/dbraw/zinc/20/52/32/1413205232.db2.gz AATWXZCQZFEHBA-ZDUSSCGKSA-N 0 0 392.868 3.448 20 5 GGBDRN O=C(c1cnc(-c2ccccc2)s1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690267 1413205583 /nfs/dbraw/zinc/20/55/83/1413205583.db2.gz NNDPBIQNFFAPRH-AWEZNQCLSA-N 0 0 395.444 3.440 20 5 GGBDRN O=C(N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1(c2ccc(Cl)cc2)CC1 ZINC000118690321 1413205640 /nfs/dbraw/zinc/20/56/40/1413205640.db2.gz CZYLUUKQRYPXAF-HNNXBMFYSA-N 0 0 386.839 3.388 20 5 GGBDRN O=C(Cc1ccc2c(c1)CCCC2)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690342 1413205679 /nfs/dbraw/zinc/20/56/79/1413205679.db2.gz RKFJULPEDRSEJG-GOSISDBHSA-N 0 0 380.448 3.124 20 5 GGBDRN CC(C)c1ccc(OCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118690351 1413205719 /nfs/dbraw/zinc/20/57/19/1413205719.db2.gz RKNICUKWDOWISM-INIZCTEOSA-N 0 0 384.436 3.205 20 5 GGBDRN O=C(c1ccc(F)c(C(F)(F)F)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690195 1413205777 /nfs/dbraw/zinc/20/57/77/1413205777.db2.gz QNJLNIKCWQUXCJ-NSHDSACASA-N 0 0 398.316 3.474 20 5 GGBDRN CCOc1ccc2cc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)[nH]c2c1 ZINC000118690147 1413205827 /nfs/dbraw/zinc/20/58/27/1413205827.db2.gz YLJKHJOAXQTOHM-AWEZNQCLSA-N 0 0 395.419 3.196 20 5 GGBDRN O=C(c1csc(-c2ccccc2)n1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691096 1413206147 /nfs/dbraw/zinc/20/61/47/1413206147.db2.gz BZWCAKIIFUZWDW-CQSZACIVSA-N 0 0 395.444 3.440 20 5 GGBDRN Cc1[nH]c2ccc(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1C ZINC000118691065 1413206200 /nfs/dbraw/zinc/20/62/00/1413206200.db2.gz AGLDVOYLJBZOFV-OAHLLOKOSA-N 0 0 379.420 3.415 20 5 GGBDRN O=C(Cc1cccc(C(F)(F)F)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690478 1413206450 /nfs/dbraw/zinc/20/64/50/1413206450.db2.gz QZBGNWUJNBVFCY-CQSZACIVSA-N 0 0 394.353 3.264 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1cccc(Cl)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690692 1413206464 /nfs/dbraw/zinc/20/64/64/1413206464.db2.gz USHDXJQBAVMXSS-BHYGNILZSA-N 0 0 386.839 3.460 20 5 GGBDRN COc1ccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc12 ZINC000118690561 1413206528 /nfs/dbraw/zinc/20/65/28/1413206528.db2.gz MWIXDPJYZNBVLA-CQSZACIVSA-N 0 0 392.415 3.478 20 5 GGBDRN O=C(N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1(c2cccc(F)c2)CCC1 ZINC000118691149 1413206982 /nfs/dbraw/zinc/20/69/82/1413206982.db2.gz YVXKXJJXDWPJGP-INIZCTEOSA-N 0 0 384.411 3.264 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc(F)cc1[N+](=O)[O-] ZINC000118700607 1413208000 /nfs/dbraw/zinc/20/80/00/1413208000.db2.gz ZBFJKEYGGPCGHS-IAGOWNOFSA-N 0 0 389.383 3.251 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cnn(-c3ccccc3C)c2C)cc([N+](=O)[O-])c1 ZINC000118723541 1413209779 /nfs/dbraw/zinc/20/97/79/1413209779.db2.gz HVNRKYRVKQUJHW-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)cc([N+](=O)[O-])c1 ZINC000118723545 1413209857 /nfs/dbraw/zinc/20/98/57/1413209857.db2.gz ATVWHMDMEIGVQQ-UHFFFAOYSA-N 0 0 386.408 3.463 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2coc(-c3ccccc3)n2)cc([N+](=O)[O-])c1 ZINC000118723468 1413209974 /nfs/dbraw/zinc/20/99/74/1413209974.db2.gz QVXZFGHJRGWCLU-UHFFFAOYSA-N 0 0 381.344 3.218 20 5 GGBDRN COc1cc(C(=O)Nc2cccc3[nH]cnc32)c([N+](=O)[O-])cc1OC(F)F ZINC000118728718 1413211284 /nfs/dbraw/zinc/21/12/84/1413211284.db2.gz XAFXANYMWXVGIQ-UHFFFAOYSA-N 0 0 378.291 3.333 20 5 GGBDRN CC(C)n1c(CCNC(=O)COc2cccc([N+](=O)[O-])c2)nc2ccccc21 ZINC000118733882 1413212760 /nfs/dbraw/zinc/21/27/60/1413212760.db2.gz VOMFASKMDAHNNN-UHFFFAOYSA-N 0 0 382.420 3.263 20 5 GGBDRN C[C@@H](NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1nc2ccccc2n1C ZINC000118734182 1413212775 /nfs/dbraw/zinc/21/27/75/1413212775.db2.gz YPAHOMRCRHWPIY-CYBMUJFWSA-N 0 0 390.403 3.158 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000177380836 1428711599 /nfs/dbraw/zinc/71/15/99/1428711599.db2.gz YGWGICBLDVINOI-SRGMZFCMSA-N 0 0 375.450 3.235 20 5 GGBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000118952636 1413272383 /nfs/dbraw/zinc/27/23/83/1413272383.db2.gz ZPDCGMYGUHSHFQ-ZDUSSCGKSA-N 0 0 396.378 3.311 20 5 GGBDRN O=C(c1c(F)cccc1F)N1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000118957604 1413274712 /nfs/dbraw/zinc/27/47/12/1413274712.db2.gz IKWQJACHMIOROA-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN CC(C)C1(CNC(=O)c2cc([N+](=O)[O-])ccc2I)CC1 ZINC000177397965 1428718242 /nfs/dbraw/zinc/71/82/42/1428718242.db2.gz YCDONWGUJOVXES-UHFFFAOYSA-N 0 0 388.205 3.365 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000119004447 1413300768 /nfs/dbraw/zinc/30/07/68/1413300768.db2.gz WFMRZTGYBJEKIF-WMZOPIPTSA-N 0 0 381.432 3.369 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000119004280 1413300991 /nfs/dbraw/zinc/30/09/91/1413300991.db2.gz WFMRZTGYBJEKIF-AEFFLSMTSA-N 0 0 381.432 3.369 20 5 GGBDRN Cc1c(CC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000119004911 1413301180 /nfs/dbraw/zinc/30/11/80/1413301180.db2.gz DOBMIOHKWLIVCM-UHFFFAOYSA-N 0 0 391.468 3.209 20 5 GGBDRN Cc1c(CC(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000119013956 1413304513 /nfs/dbraw/zinc/30/45/13/1413304513.db2.gz IOPGEEPPYSMWCZ-HNNXBMFYSA-N 0 0 391.468 3.209 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC(OC(C)(C)C)CC1 ZINC000119027415 1413309418 /nfs/dbraw/zinc/30/94/18/1413309418.db2.gz LAOUPXNWGINNHV-ZDUSSCGKSA-N 0 0 379.457 3.210 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000119042366 1413314476 /nfs/dbraw/zinc/31/44/76/1413314476.db2.gz WOYDTDHKURGJNM-WMZOPIPTSA-N 0 0 381.432 3.369 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000119042243 1413314632 /nfs/dbraw/zinc/31/46/32/1413314632.db2.gz WOYDTDHKURGJNM-FUHWJXTLSA-N 0 0 381.432 3.369 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc(C(=O)NC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000119053130 1413318151 /nfs/dbraw/zinc/31/81/51/1413318151.db2.gz ORMWLTJZYAWKDU-UHFFFAOYSA-N 0 0 398.463 3.273 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)CC2 ZINC000119057520 1413319447 /nfs/dbraw/zinc/31/94/47/1413319447.db2.gz WKWHUNXSSKOVLI-QZTJIDSGSA-N 0 0 387.436 3.002 20 5 GGBDRN COCCCOC1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000119065725 1413323718 /nfs/dbraw/zinc/32/37/18/1413323718.db2.gz FKQRLQYRNRGWKA-UHFFFAOYSA-N 0 0 375.425 3.267 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)C(=O)CCn1cc([N+](=O)[O-])nc1C)CCC2 ZINC000119076197 1413327317 /nfs/dbraw/zinc/32/73/17/1413327317.db2.gz DHDBPOPPXOITNS-ZDUSSCGKSA-N 0 0 377.470 3.045 20 5 GGBDRN COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000119094682 1413334640 /nfs/dbraw/zinc/33/46/40/1413334640.db2.gz XCYDEYOFFRMXNV-INIZCTEOSA-N 0 0 386.452 3.043 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)Cn3cc(C4CC4)nn3)n2)cc1[N+](=O)[O-] ZINC000119101758 1413337125 /nfs/dbraw/zinc/33/71/25/1413337125.db2.gz WWQFONDNZGIFIK-UHFFFAOYSA-N 0 0 384.421 3.134 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000119128370 1413348781 /nfs/dbraw/zinc/34/87/81/1413348781.db2.gz SIOWLEHQHWWKDF-CQSZACIVSA-N 0 0 375.450 3.235 20 5 GGBDRN Cc1ccc(C(=O)N[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000177402684 1428720032 /nfs/dbraw/zinc/72/00/32/1428720032.db2.gz KEDBRURJYVKNJT-QGZVFWFLSA-N 0 0 395.337 3.053 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1CCCCC(F)(F)F ZINC000119133434 1413350497 /nfs/dbraw/zinc/35/04/97/1413350497.db2.gz ZIMSHQOXBHRYBU-UHFFFAOYSA-N 0 0 381.314 3.223 20 5 GGBDRN Cc1nc(CC(C)C)c(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000119138147 1413351819 /nfs/dbraw/zinc/35/18/19/1413351819.db2.gz BWLJAJXZLXJZSV-ZDUSSCGKSA-N 0 0 389.481 3.280 20 5 GGBDRN Cc1c(CC(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000119149408 1413356263 /nfs/dbraw/zinc/35/62/63/1413356263.db2.gz DZVJZKQUFWHSAD-UHFFFAOYSA-N 0 0 397.431 3.179 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119156801 1413359031 /nfs/dbraw/zinc/35/90/31/1413359031.db2.gz NFKGEYRJRAAWLW-UHFFFAOYSA-N 0 0 384.392 3.420 20 5 GGBDRN Cc1c(CC(=O)N[C@H](c2nc(-c3ccncc3)no2)C(C)C)cccc1[N+](=O)[O-] ZINC000119164001 1413361407 /nfs/dbraw/zinc/36/14/07/1413361407.db2.gz MCANBZUWZARZRF-SFHVURJKSA-N 0 0 395.419 3.404 20 5 GGBDRN Cc1ccccc1NC(=O)[C@@H]1CSCN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000119170288 1413363478 /nfs/dbraw/zinc/36/34/78/1413363478.db2.gz FXFDJCJHKRTGMM-SFHVURJKSA-N 0 0 399.472 3.294 20 5 GGBDRN O=C(NCCOc1ccc(F)c(F)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000119174584 1413364890 /nfs/dbraw/zinc/36/48/90/1413364890.db2.gz WAJNZGGZWCJDEX-UHFFFAOYSA-N 0 0 377.347 3.020 20 5 GGBDRN C[C@H](c1ccco1)N(CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000119192855 1413371209 /nfs/dbraw/zinc/37/12/09/1413371209.db2.gz AFHQTSLPOCXBSV-MRXNPFEDSA-N 0 0 398.463 3.062 20 5 GGBDRN CC[NH+](CC)CCN(Cc1cccs1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000119199726 1413373693 /nfs/dbraw/zinc/37/36/93/1413373693.db2.gz KEEZEEAKTIQJFI-UHFFFAOYSA-N 0 0 377.466 3.346 20 5 GGBDRN CSCC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000119207083 1413375382 /nfs/dbraw/zinc/37/53/82/1413375382.db2.gz CXPYTNNTNJJHKH-OAHLLOKOSA-N 0 0 389.477 3.051 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000119215760 1413377874 /nfs/dbraw/zinc/37/78/74/1413377874.db2.gz OELSIPDDPFVJMQ-UHFFFAOYSA-N 0 0 398.463 3.167 20 5 GGBDRN COc1ccc(OC(=O)COc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000119234541 1413384806 /nfs/dbraw/zinc/38/48/06/1413384806.db2.gz GWKWZQIYXVWYMM-UHFFFAOYSA-N 0 0 382.166 3.350 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C(=O)NC(C)(C)C ZINC000119242881 1413386984 /nfs/dbraw/zinc/38/69/84/1413386984.db2.gz YSKKLRZMVUJVJY-LBPRGKRZSA-N 0 0 381.498 3.376 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(=O)NC(C)(C)C ZINC000119242981 1413387037 /nfs/dbraw/zinc/38/70/37/1413387037.db2.gz YSKKLRZMVUJVJY-GFCCVEGCSA-N 0 0 381.498 3.376 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3ccn(-c4c(F)cccc4F)n3)n2)cc1 ZINC000119248894 1413388799 /nfs/dbraw/zinc/38/87/99/1413388799.db2.gz ZJJBZYBXXSPSQK-UHFFFAOYSA-N 0 0 382.330 3.366 20 5 GGBDRN COc1cc(OCC(=O)Nc2c(C)cnn2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000177411256 1428724643 /nfs/dbraw/zinc/72/46/43/1428724643.db2.gz LUBHCMUMKJGFFX-UHFFFAOYSA-N 0 0 382.376 3.115 20 5 GGBDRN 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O=C(Cc1ccccc1Cl)NCCCOC(=O)c1cccc([N+](=O)[O-])c1 ZINC000119831482 1413585628 /nfs/dbraw/zinc/58/56/28/1413585628.db2.gz UBEFJTYWPZSUFA-UHFFFAOYSA-N 0 0 376.796 3.154 20 5 GGBDRN CCn1c(CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)nc2ccccc21 ZINC000119831103 1413585788 /nfs/dbraw/zinc/58/57/88/1413585788.db2.gz BPIVWBUDHHZQKT-UHFFFAOYSA-N 0 0 391.431 3.347 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(OCC3CC3)c(F)c2)c1[N+](=O)[O-] ZINC000177442463 1428738890 /nfs/dbraw/zinc/73/88/90/1428738890.db2.gz NIOXZCJJEWOCMW-JTQLQIEISA-N 0 0 376.388 3.299 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC(=O)N1CCCc2ccccc21 ZINC000119839882 1413588551 /nfs/dbraw/zinc/58/85/51/1413588551.db2.gz CFALWWCNCIZUPN-UHFFFAOYSA-N 0 0 382.420 3.313 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ncc(-c3cccs3)o2)CC1 ZINC000119844202 1413590581 /nfs/dbraw/zinc/59/05/81/1413590581.db2.gz MFJGEUZXAPDHGM-UHFFFAOYSA-N 0 0 398.444 3.269 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N(Cc1ccc2c(c1)OCO2)C1CCCCC1 ZINC000119867464 1413598532 /nfs/dbraw/zinc/59/85/32/1413598532.db2.gz BBSIDMQNPQDLDF-UHFFFAOYSA-N 0 0 386.408 3.032 20 5 GGBDRN Cc1cccc([C@H](NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)c1 ZINC000119874113 1413601175 /nfs/dbraw/zinc/60/11/75/1413601175.db2.gz UYDBXNUDPKHYIV-INIZCTEOSA-N 0 0 395.337 3.053 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Oc2ccc(OCC(F)(F)F)cc2)cs1 ZINC000119876361 1413601921 /nfs/dbraw/zinc/60/19/21/1413601921.db2.gz CKFOVGLAMDZPQT-UHFFFAOYSA-N 0 0 383.325 3.365 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCN(C)c2ccc(F)cc21 ZINC000119881903 1413603326 /nfs/dbraw/zinc/60/33/26/1413603326.db2.gz DVUKEVBWICYYEW-UHFFFAOYSA-N 0 0 388.399 3.028 20 5 GGBDRN CC[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(F)cc1F ZINC000119889127 1413606666 /nfs/dbraw/zinc/60/66/66/1413606666.db2.gz OZGVXTUVNQGRMK-HNNXBMFYSA-N 0 0 377.347 3.387 20 5 GGBDRN O=C(c1cc(-c2ccc3c(c2)CCO3)no1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000119890152 1413606796 /nfs/dbraw/zinc/60/67/96/1413606796.db2.gz 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ZINC000120016760 1413654828 /nfs/dbraw/zinc/65/48/28/1413654828.db2.gz QKCRWYCFSDBQPM-VIFPVBQESA-N 0 0 383.476 3.176 20 5 GGBDRN C[C@]1(c2ccccc2)CN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CCO1 ZINC000120028711 1413659981 /nfs/dbraw/zinc/65/99/81/1413659981.db2.gz CCRKPPBQLBSYNJ-HXUWFJFHSA-N 0 0 379.420 3.058 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C[S@](C)=O)c1ccccc1 ZINC000120031135 1413661363 /nfs/dbraw/zinc/66/13/63/1413661363.db2.gz SBBHGETURFLOCN-AKJBCIBTSA-N 0 0 375.450 3.453 20 5 GGBDRN O=C(NCCc1cc2ccccc2[nH]1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000120037016 1413663374 /nfs/dbraw/zinc/66/33/74/1413663374.db2.gz MSBHIBJFZBQEMS-UHFFFAOYSA-N 0 0 375.388 3.234 20 5 GGBDRN CCO[C@@H](C)c1nc(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)cs1 ZINC000120045788 1413665960 /nfs/dbraw/zinc/66/59/60/1413665960.db2.gz WHNGIJOYBPBPCN-LBPRGKRZSA-N 0 0 386.433 3.421 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](Cc2nccn2C)C1 ZINC000120046326 1413666509 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399.790 3.383 20 5 GGBDRN CC(C)(C)c1ccc([C@H](O)CNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 ZINC000120090865 1413683832 /nfs/dbraw/zinc/68/38/32/1413683832.db2.gz QFAXDTWUKRHUIU-OAHLLOKOSA-N 0 0 396.440 3.043 20 5 GGBDRN Cc1c(C(=O)Nc2cc(-n3nnnc3C3CC3)ccc2F)cccc1[N+](=O)[O-] ZINC000120095572 1413685677 /nfs/dbraw/zinc/68/56/77/1413685677.db2.gz UYWBXWVKCPDICJ-UHFFFAOYSA-N 0 0 382.355 3.148 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000120107899 1413690546 /nfs/dbraw/zinc/69/05/46/1413690546.db2.gz FRCIUPRUOLPKNT-HUUCEWRRSA-N 0 0 377.441 3.089 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC(OC3CCCC3)CC2)c1C ZINC000120127722 1413698018 /nfs/dbraw/zinc/69/80/18/1413698018.db2.gz MWEWOUIHMYGAEK-UHFFFAOYSA-N 0 0 382.482 3.324 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000120133219 1413700726 /nfs/dbraw/zinc/70/07/26/1413700726.db2.gz ZWAZLFYHVFNRRJ-CHWSQXEVSA-N 0 0 381.404 3.300 20 5 GGBDRN 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ZINC000121579302 1414185295 /nfs/dbraw/zinc/18/52/95/1414185295.db2.gz AAFQLMQIQOPPQN-SFHVURJKSA-N 0 0 388.424 3.204 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Oc1c(Cl)cc(Cl)cc1Cl ZINC000121588186 1414188715 /nfs/dbraw/zinc/18/87/15/1414188715.db2.gz FAAOPLXITXMHGX-UHFFFAOYSA-N 0 0 377.567 3.322 20 5 GGBDRN Cc1cc(S(C)(=O)=O)cc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1C ZINC000121598290 1414194295 /nfs/dbraw/zinc/19/42/95/1414194295.db2.gz UTBYCLHHBHIRMZ-UHFFFAOYSA-N 0 0 376.434 3.484 20 5 GGBDRN O=C([C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CC[C@@H](c2ccccc2)C1 ZINC000121599505 1414194754 /nfs/dbraw/zinc/19/47/54/1414194754.db2.gz DVNIHGQAEWWWOY-CVEARBPZSA-N 0 0 397.406 3.103 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000121608545 1414198228 /nfs/dbraw/zinc/19/82/28/1414198228.db2.gz HLVCVRLSPYYEME-ZDUSSCGKSA-N 0 0 399.447 3.469 20 5 GGBDRN Cn1c(CCCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)nc2ccccc21 ZINC000177546859 1428788397 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ISLQVAPNMGANDI-CQSZACIVSA-N 0 0 399.447 3.183 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NC[C@H](C)Sc1ccccc1 ZINC000121663310 1414216146 /nfs/dbraw/zinc/21/61/46/1414216146.db2.gz AAKAERSFDOPZFM-ZDUSSCGKSA-N 0 0 387.461 3.447 20 5 GGBDRN Cc1ccccc1-c1csc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000121669835 1414218166 /nfs/dbraw/zinc/21/81/66/1414218166.db2.gz PMGYKAJSNGEKHG-UHFFFAOYSA-N 0 0 396.428 3.395 20 5 GGBDRN O=C(NC[C@H](O)c1ccncc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000121689780 1414224576 /nfs/dbraw/zinc/22/45/76/1414224576.db2.gz NFWNPKMVRYBGEU-FQEVSTJZSA-N 0 0 392.415 3.065 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(CCCCO)C3CC3)cc2[N+](=O)[O-])C1 ZINC000121693497 1414226122 /nfs/dbraw/zinc/22/61/22/1414226122.db2.gz IMSGDUCASKJLJM-IYBDPMFKSA-N 0 0 389.496 3.454 20 5 GGBDRN C[C@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C(=O)N1CCCC[C@H]1C ZINC000121695491 1414226814 /nfs/dbraw/zinc/22/68/14/1414226814.db2.gz ZNCNDZPXLFSBAU-CABCVRRESA-N 0 0 388.468 3.058 20 5 GGBDRN 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COc1ccc(S(=O)(=O)N2CCCc3c(F)ccc(F)c32)c([N+](=O)[O-])c1 ZINC000122261761 1414404473 /nfs/dbraw/zinc/40/44/73/1414404473.db2.gz MGVWVTNQYWPAOJ-UHFFFAOYSA-N 0 0 384.360 3.023 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000122262898 1414404759 /nfs/dbraw/zinc/40/47/59/1414404759.db2.gz BNHRVSYMOGJRRD-UHFFFAOYSA-N 0 0 376.457 3.487 20 5 GGBDRN Cc1c(C(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1CCO[C@@H]1CCCCO1 ZINC000122262275 1414404828 /nfs/dbraw/zinc/40/48/28/1414404828.db2.gz LUKMLMJLXWBHQQ-GOSISDBHSA-N 0 0 388.424 3.204 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCc2c(F)ccc(F)c21 ZINC000122266175 1414406193 /nfs/dbraw/zinc/40/61/93/1414406193.db2.gz POZITHAZZIWCTR-UHFFFAOYSA-N 0 0 384.360 3.023 20 5 GGBDRN CCN(C(=O)[C@@H](C)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CCCCC1 ZINC000122276689 1414408906 /nfs/dbraw/zinc/40/89/06/1414408906.db2.gz WHAISLJOJNXBRW-CVEARBPZSA-N 0 0 389.500 3.046 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCCc3c(F)ccc(F)c32)ccc1[N+](=O)[O-] ZINC000122291940 1414414734 /nfs/dbraw/zinc/41/47/34/1414414734.db2.gz MYXKSNVYBNWABA-UHFFFAOYSA-N 0 0 384.360 3.023 20 5 GGBDRN C[C@@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C(=O)N1CCCC[C@@H]1C ZINC000122311028 1414420621 /nfs/dbraw/zinc/42/06/21/1414420621.db2.gz AKPUKJDJSOBALX-LSDHHAIUSA-N 0 0 388.468 3.058 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOC[C@@H]1C[C@H](O)c1cccs1 ZINC000122333471 1414426640 /nfs/dbraw/zinc/42/66/40/1414426640.db2.gz MQLSBPUULNYLHP-HOCLYGCPSA-N 0 0 391.449 3.321 20 5 GGBDRN O=C(Nc1cccc(-n2ccnn2)c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000122344076 1414429626 /nfs/dbraw/zinc/42/96/26/1414429626.db2.gz VSBYGFSCKCEMKX-UHFFFAOYSA-N 0 0 390.306 3.421 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000122389758 1414444060 /nfs/dbraw/zinc/44/40/60/1414444060.db2.gz CNHXINWPFZQLOU-AEFFLSMTSA-N 0 0 397.431 3.187 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1C ZINC000122400902 1414447102 /nfs/dbraw/zinc/44/71/02/1414447102.db2.gz LQCGTQFGKRVGFT-UHFFFAOYSA-N 0 0 386.364 3.040 20 5 GGBDRN COc1ccc(CN2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)cc1F ZINC000122401161 1414447202 /nfs/dbraw/zinc/44/72/02/1414447202.db2.gz YIAULMGSQGUTRT-UHFFFAOYSA-N 0 0 387.411 3.009 20 5 GGBDRN CNC(=O)Cc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000122409758 1414450814 /nfs/dbraw/zinc/45/08/14/1414450814.db2.gz DOZZCBLHILEOLN-UHFFFAOYSA-N 0 0 396.428 3.259 20 5 GGBDRN COc1ccc(-c2ccc(C(=O)NCCn3cc([N+](=O)[O-])cn3)c(F)c2)cc1 ZINC000122415340 1414452465 /nfs/dbraw/zinc/45/24/65/1414452465.db2.gz IQYSFLLOISHNKG-UHFFFAOYSA-N 0 0 384.367 3.036 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](C(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000122421426 1414454006 /nfs/dbraw/zinc/45/40/06/1414454006.db2.gz MSMPSEOCLDYDPJ-LBPRGKRZSA-N 0 0 383.832 3.231 20 5 GGBDRN CCCCn1ncc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1C ZINC000122425462 1414455589 /nfs/dbraw/zinc/45/55/89/1414455589.db2.gz CTMQVVRBWBDEOK-UHFFFAOYSA-N 0 0 383.412 3.041 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(C(=O)c2cccc(F)c2)CC1 ZINC000122426442 1414456515 /nfs/dbraw/zinc/45/65/15/1414456515.db2.gz RRLFPDBIMLFHEE-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)cc([N+](=O)[O-])c1 ZINC000122436711 1414459533 /nfs/dbraw/zinc/45/95/33/1414459533.db2.gz CZXNLCMBOZIPPU-HNNXBMFYSA-N 0 0 383.452 3.241 20 5 GGBDRN O=C(Cc1ccccc1F)N1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000122453693 1414465033 /nfs/dbraw/zinc/46/50/33/1414465033.db2.gz SNFMYXIYTQHBGC-UHFFFAOYSA-N 0 0 391.830 3.274 20 5 GGBDRN C[C@H]1COCCN1c1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000122456482 1414465777 /nfs/dbraw/zinc/46/57/77/1414465777.db2.gz CBWWKSDKJHZKLG-AWEZNQCLSA-N 0 0 394.431 3.482 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(CC)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000122466628 1414470111 /nfs/dbraw/zinc/47/01/11/1414470111.db2.gz LJDLBYIGFZHNMR-MRXNPFEDSA-N 0 0 399.447 3.412 20 5 GGBDRN O=C(OCc1cccc(-n2cccn2)c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000122480646 1414475923 /nfs/dbraw/zinc/47/59/23/1414475923.db2.gz LLPGXJCYMLYEKA-UHFFFAOYSA-N 0 0 389.371 3.323 20 5 GGBDRN COCCCOC1CCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000122482306 1414477018 /nfs/dbraw/zinc/47/70/18/1414477018.db2.gz VIGXMTTZNYGUGR-AWEZNQCLSA-N 0 0 390.440 3.223 20 5 GGBDRN Cc1nc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)sc1-c1n[nH]c(=S)n1C ZINC000122502267 1414483725 /nfs/dbraw/zinc/48/37/25/1414483725.db2.gz VXDMJLJXWIOEHL-UHFFFAOYSA-N 0 0 390.450 3.379 20 5 GGBDRN Cc1cc(NC(=O)C[C@@H]2CSCCS2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122506365 1414484705 /nfs/dbraw/zinc/48/47/05/1414484705.db2.gz LVHWKXNYAUQLJT-CQSZACIVSA-N 0 0 378.479 3.266 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H](Cc1ccccc1)c1ccccc1 ZINC000177618440 1428812558 /nfs/dbraw/zinc/81/25/58/1428812558.db2.gz LHDLJDPOZQOWNZ-LJQANCHMSA-N 0 0 378.432 3.324 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC[C@H]2[C@@H]2CCCCC2=O)c1C ZINC000177619078 1428812706 /nfs/dbraw/zinc/81/27/06/1428812706.db2.gz CPANTYUMOGGKIL-HOTGVXAUSA-N 0 0 380.466 3.124 20 5 GGBDRN CC[C@@]1(c2ccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)cc2)CCC(=O)NC1=O ZINC000122526638 1414490849 /nfs/dbraw/zinc/49/08/49/1414490849.db2.gz GVIHXFBHDZQGQB-NRFANRHFSA-N 0 0 395.415 3.240 20 5 GGBDRN C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000122534044 1414492059 /nfs/dbraw/zinc/49/20/59/1414492059.db2.gz DXTPRYBFGGIQKP-OAHLLOKOSA-N 0 0 380.404 3.042 20 5 GGBDRN CCOCCC1(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)CCC1 ZINC000122533423 1414492149 /nfs/dbraw/zinc/49/21/49/1414492149.db2.gz CVNIMMUNIUPEHJ-UHFFFAOYSA-N 0 0 390.889 3.432 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nnc(C2CC2)n1C1CC1 ZINC000122537470 1414493683 /nfs/dbraw/zinc/49/36/83/1414493683.db2.gz BWUHFUOZCPWOJN-NSHDSACASA-N 0 0 387.465 3.196 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000122544076 1414495709 /nfs/dbraw/zinc/49/57/09/1414495709.db2.gz RZDACQOWOMKTBI-GOSISDBHSA-N 0 0 380.404 3.070 20 5 GGBDRN CCCN(CC(=O)OCC)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000122559533 1414500574 /nfs/dbraw/zinc/50/05/74/1414500574.db2.gz NELIBUPKZGJNHP-UHFFFAOYSA-N 0 0 377.422 3.134 20 5 GGBDRN Cc1ccn(-c2ccccc2CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)n1 ZINC000122565322 1414502721 /nfs/dbraw/zinc/50/27/21/1414502721.db2.gz BSAGUUDTSDMDGZ-UHFFFAOYSA-N 0 0 391.431 3.357 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccc(C(=O)Nc2ccncc2)cc1 ZINC000122573410 1414504962 /nfs/dbraw/zinc/50/49/62/1414504962.db2.gz RRKLCMHEPIRLDL-UHFFFAOYSA-N 0 0 390.399 3.101 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122579843 1414506596 /nfs/dbraw/zinc/50/65/96/1414506596.db2.gz JDUIIGHCAAGDSI-LJQANCHMSA-N 0 0 394.431 3.194 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@H]1Cc1cccc(F)c1 ZINC000122580211 1414507534 /nfs/dbraw/zinc/50/75/34/1414507534.db2.gz TTXRODRUPDNNEA-INIZCTEOSA-N 0 0 385.395 3.215 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCO[C@H](c3ccc(F)c(C)c3)C2)cc1[N+](=O)[O-] ZINC000122583195 1414508274 /nfs/dbraw/zinc/50/82/74/1414508274.db2.gz UFESRHUFVWDFJF-SFHVURJKSA-N 0 0 394.424 3.113 20 5 GGBDRN CCc1ccc(OC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000122585160 1414508822 /nfs/dbraw/zinc/50/88/22/1414508822.db2.gz MXIIWZYGRAEJBO-HNNXBMFYSA-N 0 0 377.441 3.140 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCO[C@@H](c2ccc(F)c(C)c2)C1 ZINC000122589710 1414509508 /nfs/dbraw/zinc/50/95/08/1414509508.db2.gz ODTRDIJIBHNYKE-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1cc(F)ccc1-c1ccc(C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1F ZINC000122588008 1414509522 /nfs/dbraw/zinc/50/95/22/1414509522.db2.gz NIKLPWUNPUKLHT-UHFFFAOYSA-N 0 0 386.358 3.475 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1nn(-c2ccccc2)c2c1CCC2 ZINC000122592003 1414510532 /nfs/dbraw/zinc/51/05/32/1414510532.db2.gz WNNVNSJRGGGRFT-UHFFFAOYSA-N 0 0 388.387 3.398 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000122592284 1414510813 /nfs/dbraw/zinc/51/08/13/1414510813.db2.gz NCSYCLZOMKGHKR-FQEVSTJZSA-N 0 0 394.431 3.194 20 5 GGBDRN COc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1OC(F)F ZINC000122601013 1414512826 /nfs/dbraw/zinc/51/28/26/1414512826.db2.gz SPKIGZYTCYNHIE-UHFFFAOYSA-N 0 0 378.291 3.333 20 5 GGBDRN CCOCc1cccc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000122610278 1414516543 /nfs/dbraw/zinc/51/65/43/1414516543.db2.gz NSRUEFGBUHWGJQ-UHFFFAOYSA-N 0 0 399.447 3.209 20 5 GGBDRN O=C(Cc1cc(Cl)c2c(c1)OCCO2)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122617683 1414518907 /nfs/dbraw/zinc/51/89/07/1414518907.db2.gz FRBMQEJYOSMLCL-UHFFFAOYSA-N 0 0 388.767 3.077 20 5 GGBDRN CC(C)c1nnc(CCC(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)o1 ZINC000177625455 1428814935 /nfs/dbraw/zinc/81/49/35/1428814935.db2.gz LMQWVODBUAUKJD-UHFFFAOYSA-N 0 0 386.364 3.432 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000122621894 1414520391 /nfs/dbraw/zinc/52/03/91/1414520391.db2.gz CCYAIBRGSQXVJU-ZDUSSCGKSA-N 0 0 382.388 3.126 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000122624104 1414521215 /nfs/dbraw/zinc/52/12/15/1414521215.db2.gz HSRSRKQCQKOQLD-UHFFFAOYSA-N 0 0 388.445 3.241 20 5 GGBDRN C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000122626113 1414522351 /nfs/dbraw/zinc/52/23/51/1414522351.db2.gz KKDSKAGGEHFDGZ-CQSZACIVSA-N 0 0 397.435 3.344 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CCc2c(Cl)cccc2C1 ZINC000122628544 1414522904 /nfs/dbraw/zinc/52/29/04/1414522904.db2.gz UPJNYCTWFJBDFI-UHFFFAOYSA-N 0 0 394.214 3.425 20 5 GGBDRN O=C(CCCc1nnc(-c2ccccc2)o1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122634293 1414524206 /nfs/dbraw/zinc/52/42/06/1414524206.db2.gz KGAQBWUJTPMTLW-UHFFFAOYSA-N 0 0 392.375 3.483 20 5 GGBDRN CC(C)=C[C@H]1[C@@H](C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1(C)C ZINC000122635713 1414525076 /nfs/dbraw/zinc/52/50/76/1414525076.db2.gz FZZSXAPWSKPSQM-ROUUACIJSA-N 0 0 385.464 3.118 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000122636871 1414525197 /nfs/dbraw/zinc/52/51/97/1414525197.db2.gz VRTJDZRARGIAEF-OCCSQVGLSA-N 0 0 394.424 3.309 20 5 GGBDRN C[C@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 ZINC000122647767 1414528139 /nfs/dbraw/zinc/52/81/39/1414528139.db2.gz MVVBEMLXLQYTPE-MRXNPFEDSA-N 0 0 387.480 3.486 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000122649581 1414528762 /nfs/dbraw/zinc/52/87/62/1414528762.db2.gz AUMPCNNHJKZYET-APWZRJJASA-N 0 0 387.411 3.261 20 5 GGBDRN CCN(Cc1ccccc1Cl)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000122652815 1414529392 /nfs/dbraw/zinc/52/93/92/1414529392.db2.gz FYFZAYZDHURJSK-UHFFFAOYSA-N 0 0 376.796 3.488 20 5 GGBDRN C[C@@H](c1cc(F)ccc1F)N(C)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000122652283 1414529681 /nfs/dbraw/zinc/52/96/81/1414529681.db2.gz NAOUKKSZUUBPRU-NSHDSACASA-N 0 0 378.331 3.284 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000122657083 1414530769 /nfs/dbraw/zinc/53/07/69/1414530769.db2.gz NKDUXKUKQVXFOL-CJNGLKHVSA-N 0 0 378.425 3.442 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cccc(OC[C@H]2CCCO2)c1 ZINC000122660798 1414531487 /nfs/dbraw/zinc/53/14/87/1414531487.db2.gz HPKVCXWVKRLCEJ-OAHLLOKOSA-N 0 0 382.376 3.281 20 5 GGBDRN C/C(=C/C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1 ZINC000122663487 1414532347 /nfs/dbraw/zinc/53/23/47/1414532347.db2.gz HOQCWYVGPWHEFT-PFONDFGASA-N 0 0 397.406 3.122 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000122667732 1414533381 /nfs/dbraw/zinc/53/33/81/1414533381.db2.gz YLGDIJKGNQITDQ-WCQYABFASA-N 0 0 382.388 3.440 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1Cl ZINC000122674314 1414534759 /nfs/dbraw/zinc/53/47/59/1414534759.db2.gz AGCUPWYGDPDZPX-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000122677583 1414536461 /nfs/dbraw/zinc/53/64/61/1414536461.db2.gz AQRNZAONMNUYMT-NHYWBVRUSA-N 0 0 384.841 3.039 20 5 GGBDRN CC1CCN(c2ccc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)cn2)CC1 ZINC000122677912 1414536627 /nfs/dbraw/zinc/53/66/27/1414536627.db2.gz SKLMUWTTXJTBOZ-UHFFFAOYSA-N 0 0 380.408 3.355 20 5 GGBDRN CCc1nc(-c2ccc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)cc2)n[nH]1 ZINC000122684773 1414537727 /nfs/dbraw/zinc/53/77/27/1414537727.db2.gz YEVDKHGBVFFHJB-UHFFFAOYSA-N 0 0 377.364 3.071 20 5 GGBDRN COc1c(Cl)cccc1NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000122684450 1414538005 /nfs/dbraw/zinc/53/80/05/1414538005.db2.gz WLBHFOHEDTUDTO-UHFFFAOYSA-N 0 0 377.784 3.451 20 5 GGBDRN NC(=O)CCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1 ZINC000122695243 1414540424 /nfs/dbraw/zinc/54/04/24/1414540424.db2.gz HFSAPAGCQISUMR-UHFFFAOYSA-N 0 0 399.450 3.063 20 5 GGBDRN Cc1cc2nc(C)c(CCC(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c(C)n2n1 ZINC000122699498 1414541721 /nfs/dbraw/zinc/54/17/21/1414541721.db2.gz LUKHRIXDCGPZMB-UHFFFAOYSA-N 0 0 393.407 3.010 20 5 GGBDRN CC(C)Cc1ccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000122699002 1414541890 /nfs/dbraw/zinc/54/18/90/1414541890.db2.gz DBZZMSCQAPWPAZ-UHFFFAOYSA-N 0 0 395.459 3.392 20 5 GGBDRN COCCCOC1CCN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000122712655 1414545659 /nfs/dbraw/zinc/54/56/59/1414545659.db2.gz XGWLBZNCJRBJTF-ZDUSSCGKSA-N 0 0 399.875 3.093 20 5 GGBDRN CCc1noc(CC)c1CNC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000122714508 1414546000 /nfs/dbraw/zinc/54/60/00/1414546000.db2.gz XODTXLDEXCDBLG-UHFFFAOYSA-N 0 0 393.465 3.266 20 5 GGBDRN CS(=O)(=O)c1cccc(N2CC[C@@H](Cc3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000122714554 1414546103 /nfs/dbraw/zinc/54/61/03/1414546103.db2.gz QYOAYCQTRMCCJE-AWEZNQCLSA-N 0 0 378.425 3.206 20 5 GGBDRN CN(Cc1cc(Br)cn1C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000122715534 1414546261 /nfs/dbraw/zinc/54/62/61/1414546261.db2.gz XPRZDHLOMLYKGD-UHFFFAOYSA-N 0 0 378.230 3.135 20 5 GGBDRN COc1cccc(-c2cc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)n[nH]2)c1 ZINC000122714229 1414546347 /nfs/dbraw/zinc/54/63/47/1414546347.db2.gz FABXQBGNFQFBOF-UHFFFAOYSA-N 0 0 378.348 3.122 20 5 GGBDRN CCC[C@H](C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000122727529 1414549959 /nfs/dbraw/zinc/54/99/59/1414549959.db2.gz QFOBZWNLKDYUER-FQEVSTJZSA-N 0 0 395.459 3.463 20 5 GGBDRN O=C(Nc1cccc(OCCF)c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000122729721 1414550779 /nfs/dbraw/zinc/55/07/79/1414550779.db2.gz RBTHHZSDYHOGMY-UHFFFAOYSA-N 0 0 388.399 3.297 20 5 GGBDRN CCc1ccc([C@@H](C)C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000122730628 1414551379 /nfs/dbraw/zinc/55/13/79/1414551379.db2.gz IXBVSUOJIRIVDW-MRXNPFEDSA-N 0 0 395.459 3.245 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1cccc(OCCc2ccccc2)c1 ZINC000122735588 1414552286 /nfs/dbraw/zinc/55/22/86/1414552286.db2.gz SIYPZPURAFKLFU-UHFFFAOYSA-N 0 0 393.399 3.017 20 5 GGBDRN C[C@@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1F ZINC000122733449 1414552305 /nfs/dbraw/zinc/55/23/05/1414552305.db2.gz QMPJEDNGAMNNMM-HNNXBMFYSA-N 0 0 399.422 3.212 20 5 GGBDRN O=C(c1csc2ccccc12)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122737325 1414552837 /nfs/dbraw/zinc/55/28/37/1414552837.db2.gz JKGYENMIWZXSEM-UHFFFAOYSA-N 0 0 395.440 3.408 20 5 GGBDRN O=C(NC1CCC(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC1)C1CCCC1 ZINC000122742336 1414553992 /nfs/dbraw/zinc/55/39/92/1414553992.db2.gz FUWJZEMFXZOYPC-UHFFFAOYSA-N 0 0 399.451 3.275 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc(Oc2ccncc2)c(Cl)c1 ZINC000122740686 1414554018 /nfs/dbraw/zinc/55/40/18/1414554018.db2.gz HBOTWFAZHJRHDS-UHFFFAOYSA-N 0 0 387.783 3.062 20 5 GGBDRN COc1ccc(-c2cc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)n[nH]2)cc1 ZINC000122749473 1414555699 /nfs/dbraw/zinc/55/56/99/1414555699.db2.gz FGJQQDPTMXEVKL-UHFFFAOYSA-N 0 0 378.348 3.122 20 5 GGBDRN CC(C)Cn1ccc2cc(NC(=O)C(=O)NCc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000122749459 1414556007 /nfs/dbraw/zinc/55/60/07/1414556007.db2.gz ZRSOWBRLBJYFJC-UHFFFAOYSA-N 0 0 394.431 3.460 20 5 GGBDRN CCOc1cc(Cl)ccc1NC(=O)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000177634257 1428817763 /nfs/dbraw/zinc/81/77/63/1428817763.db2.gz KHBQPVAMJHMGSY-UHFFFAOYSA-N 0 0 391.811 3.244 20 5 GGBDRN CCC[C@@H](C)[C@H]1CCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000122757028 1414557489 /nfs/dbraw/zinc/55/74/89/1414557489.db2.gz ZRWYELRSTCKYPO-GDBMZVCRSA-N 0 0 398.463 3.490 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1cccn(Cc2ccccc2)c1=O ZINC000122761762 1414558377 /nfs/dbraw/zinc/55/83/77/1414558377.db2.gz QORWUDKLFTZKLH-UHFFFAOYSA-N 0 0 393.399 3.212 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)c2)n[nH]1 ZINC000122777953 1414561719 /nfs/dbraw/zinc/56/17/19/1414561719.db2.gz HEWBTMFRRLKXFU-UHFFFAOYSA-N 0 0 396.363 3.466 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000122777010 1414562095 /nfs/dbraw/zinc/56/20/95/1414562095.db2.gz LAEAAWQKDRSQFT-NHYWBVRUSA-N 0 0 384.841 3.039 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000122783412 1414563928 /nfs/dbraw/zinc/56/39/28/1414563928.db2.gz UXRSNDMPOXZBKP-KRWDZBQOSA-N 0 0 393.346 3.487 20 5 GGBDRN CSC1(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCOCC1 ZINC000122794425 1414566284 /nfs/dbraw/zinc/56/62/84/1414566284.db2.gz OXOWVSXDWHDKFU-UHFFFAOYSA-N 0 0 379.482 3.181 20 5 GGBDRN COc1cc(C(=O)Nc2cccn(Cc3ccccc3)c2=O)ccc1[N+](=O)[O-] ZINC000122808518 1414569991 /nfs/dbraw/zinc/56/99/91/1414569991.db2.gz BKLZVEWJGSBBGL-UHFFFAOYSA-N 0 0 379.372 3.066 20 5 GGBDRN O=C(NCC1(c2cccc(F)c2)CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000122818113 1414572503 /nfs/dbraw/zinc/57/25/03/1414572503.db2.gz YVQPPQQAZHRINW-UHFFFAOYSA-N 0 0 391.786 3.174 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(-c2ccccc2)[nH]c1=O ZINC000122821871 1414574055 /nfs/dbraw/zinc/57/40/55/1414574055.db2.gz PJKCGYLKROLRRT-UHFFFAOYSA-N 0 0 375.344 3.079 20 5 GGBDRN CCCN(CCC)C(=O)CCCC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122825840 1414574514 /nfs/dbraw/zinc/57/45/14/1414574514.db2.gz YBINDYXNNPDUMP-UHFFFAOYSA-N 0 0 375.429 3.229 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)Cc1ccc([S@](C)=O)cc1 ZINC000122833056 1414576275 /nfs/dbraw/zinc/57/62/75/1414576275.db2.gz RBTVWQOKZZJLKV-AREMUKBSSA-N 0 0 377.422 3.005 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-] ZINC000122838382 1414577487 /nfs/dbraw/zinc/57/74/87/1414577487.db2.gz QCCNOTVQWSNIFD-KRWDZBQOSA-N 0 0 389.458 3.428 20 5 GGBDRN C[C@H](CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000122840334 1414578120 /nfs/dbraw/zinc/57/81/20/1414578120.db2.gz KAAOJTAYMAMJAR-OAHLLOKOSA-N 0 0 391.493 3.321 20 5 GGBDRN O=C(CCc1cnn(-c2ccccc2)c1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122844835 1414578844 /nfs/dbraw/zinc/57/88/44/1414578844.db2.gz HCNPTYBPLPSOSL-UHFFFAOYSA-N 0 0 376.376 3.228 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000122847461 1414579337 /nfs/dbraw/zinc/57/93/37/1414579337.db2.gz UUIHRZIWGUOXFC-WMZOPIPTSA-N 0 0 388.395 3.471 20 5 GGBDRN CCn1c(SCCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccnc1 ZINC000122856912 1414582072 /nfs/dbraw/zinc/58/20/72/1414582072.db2.gz JVINIVABQKOTEW-UHFFFAOYSA-N 0 0 398.448 3.389 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCN(c3cc(F)ccc3F)CC2)c2c(c1)COCO2 ZINC000177641350 1428820006 /nfs/dbraw/zinc/82/00/06/1428820006.db2.gz QGZWCFBZDBVBIO-UHFFFAOYSA-N 0 0 391.374 3.062 20 5 GGBDRN O=C(Cc1ccc(NC(=O)C2CC2)cc1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122867617 1414584611 /nfs/dbraw/zinc/58/46/11/1414584611.db2.gz LMZMXCUENDHSCO-UHFFFAOYSA-N 0 0 379.376 3.001 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(C(=O)c2cc[nH]c2)cc1 ZINC000122874508 1414586444 /nfs/dbraw/zinc/58/64/44/1414586444.db2.gz VIKFLDHSAJELAB-UHFFFAOYSA-N 0 0 375.344 3.283 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000122874242 1414586577 /nfs/dbraw/zinc/58/65/77/1414586577.db2.gz YZTSBMRNFNXAPE-LBPRGKRZSA-N 0 0 386.412 3.010 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2(c3cccc(Cl)c3)CC2)cccc1[N+](=O)[O-] ZINC000122880866 1414587628 /nfs/dbraw/zinc/58/76/28/1414587628.db2.gz ASINZSHBLPQKQW-UHFFFAOYSA-N 0 0 387.823 3.343 20 5 GGBDRN Cc1n[nH]c(C)c1[C@H](C)CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000122882610 1414588273 /nfs/dbraw/zinc/58/82/73/1414588273.db2.gz JDVGKCFDPLGGTH-CYBMUJFWSA-N 0 0 386.452 3.498 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000122887510 1414589441 /nfs/dbraw/zinc/58/94/41/1414589441.db2.gz BQJXZPQOJQXOCM-IUODEOHRSA-N 0 0 375.381 3.316 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000122900931 1414592674 /nfs/dbraw/zinc/59/26/74/1414592674.db2.gz BBRHTJKLBUYXBQ-KDOFPFPSSA-N 0 0 398.394 3.339 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000122900214 1414592802 /nfs/dbraw/zinc/59/28/02/1414592802.db2.gz RZICPCBLFHFKIZ-INIZCTEOSA-N 0 0 388.811 3.254 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N(Cc1ccccc1)CC(F)F ZINC000122917125 1414596347 /nfs/dbraw/zinc/59/63/47/1414596347.db2.gz GVFDVFIVPIVOAA-UHFFFAOYSA-N 0 0 397.765 3.481 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N(Cc1ccccc1)CC(F)F ZINC000122920753 1414597669 /nfs/dbraw/zinc/59/76/69/1414597669.db2.gz UHOCVTUMRNRYFM-UHFFFAOYSA-N 0 0 397.765 3.481 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N(Cc1ccccc1)CC(F)F ZINC000122933702 1414600143 /nfs/dbraw/zinc/60/01/43/1414600143.db2.gz MJJVYTTVOCQISR-UHFFFAOYSA-N 0 0 397.765 3.481 20 5 GGBDRN CN(Cc1ccc([S@](C)=O)cc1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000177645317 1428821541 /nfs/dbraw/zinc/82/15/41/1428821541.db2.gz FEQFPCHGNGCDEO-MHZLTWQESA-N 0 0 389.477 3.183 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2C[C@@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000122954688 1414604570 /nfs/dbraw/zinc/60/45/70/1414604570.db2.gz MFBGQHMEFPBEQQ-UKRRQHHQSA-N 0 0 376.434 3.393 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C(=O)Nc2cc(C)on2)CC1 ZINC000177645043 1428821686 /nfs/dbraw/zinc/82/16/86/1428821686.db2.gz BBRYLRIDNRNRTN-UHFFFAOYSA-N 0 0 388.424 3.141 20 5 GGBDRN CN(Cc1ccc([S@@](C)=O)cc1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000177645330 1428821704 /nfs/dbraw/zinc/82/17/04/1428821704.db2.gz FEQFPCHGNGCDEO-HHHXNRCGSA-N 0 0 389.477 3.183 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(-n2ccnc2)c(F)c1 ZINC000122964550 1414608325 /nfs/dbraw/zinc/60/83/25/1414608325.db2.gz FMIDSBLAPOWEKL-UHFFFAOYSA-N 0 0 385.355 3.250 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1Cc2ccccc2C[C@@H]1c1nnc(C)o1 ZINC000122983809 1414612017 /nfs/dbraw/zinc/61/20/17/1414612017.db2.gz WQTLRVQCYCFVSW-QGZVFWFLSA-N 0 0 394.387 3.235 20 5 GGBDRN Cc1sc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1CS(C)(=O)=O ZINC000122990279 1414614280 /nfs/dbraw/zinc/61/42/80/1414614280.db2.gz KDQYERCNKBMDHK-LLVKDONJSA-N 0 0 396.490 3.309 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000122998580 1414615959 /nfs/dbraw/zinc/61/59/59/1414615959.db2.gz ARTVPGRXKTXGQA-HHHXNRCGSA-N 0 0 387.461 3.206 20 5 GGBDRN CN1CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2cc(F)ccc21 ZINC000123000758 1414616751 /nfs/dbraw/zinc/61/67/51/1414616751.db2.gz ONJRXRDSQOPSJO-UHFFFAOYSA-N 0 0 395.394 3.406 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 ZINC000123037618 1414624795 /nfs/dbraw/zinc/62/47/95/1414624795.db2.gz QYACNQKTCVPSSB-GFCCVEGCSA-N 0 0 392.362 3.282 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000123051543 1414628311 /nfs/dbraw/zinc/62/83/11/1414628311.db2.gz IQSWAZLZLBKNQH-LBPRGKRZSA-N 0 0 397.391 3.460 20 5 GGBDRN CCc1[nH]n(C)c2nnc(NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)c1-2 ZINC000123057852 1414629608 /nfs/dbraw/zinc/62/96/08/1414629608.db2.gz CQTVGCVGOORWNR-UHFFFAOYSA-N 0 0 382.302 3.038 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000123074779 1414634429 /nfs/dbraw/zinc/63/44/29/1414634429.db2.gz NLLZKMJCMPDWSA-WFASDCNBSA-N 0 0 391.405 3.293 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000123075165 1414634555 /nfs/dbraw/zinc/63/45/55/1414634555.db2.gz NLLZKMJCMPDWSA-DOMZBBRYSA-N 0 0 391.405 3.293 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000123108163 1414643730 /nfs/dbraw/zinc/64/37/30/1414643730.db2.gz WWJLDUMCOBUCPH-HNNXBMFYSA-N 0 0 375.381 3.410 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCOc2c(Cl)cccc21 ZINC000123109744 1414644447 /nfs/dbraw/zinc/64/44/47/1414644447.db2.gz DKDZAMRRNJPEIA-UHFFFAOYSA-N 0 0 389.216 3.489 20 5 GGBDRN CCCC[C@H](COC)Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000123120105 1414646806 /nfs/dbraw/zinc/64/68/06/1414646806.db2.gz FZGKZLJRDNPJMM-GFCCVEGCSA-N 0 0 380.832 3.411 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 ZINC000123121888 1414646918 /nfs/dbraw/zinc/64/69/18/1414646918.db2.gz FZKALOFWFHZEJJ-NDEPHWFRSA-N 0 0 398.444 3.030 20 5 GGBDRN O=C(Nc1ccc(Cl)c(Cl)c1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000123134169 1414650575 /nfs/dbraw/zinc/65/05/75/1414650575.db2.gz QRHAZMIEQYXFOW-UHFFFAOYSA-N 0 0 394.214 3.425 20 5 GGBDRN O=C(Nc1ccccc1C(F)(F)F)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000123138778 1414651912 /nfs/dbraw/zinc/65/19/12/1414651912.db2.gz YMPILJVVJGVOSM-UHFFFAOYSA-N 0 0 393.321 3.137 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000123147489 1414653723 /nfs/dbraw/zinc/65/37/23/1414653723.db2.gz VANIKOLQKMFLSO-GFCCVEGCSA-N 0 0 376.384 3.479 20 5 GGBDRN CC(C)(C)NS(=O)(=O)Cc1cccc(NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000123176283 1414661239 /nfs/dbraw/zinc/66/12/39/1414661239.db2.gz KATXVZODYCIKOX-UHFFFAOYSA-N 0 0 377.466 3.425 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)CCSC)c([N+](=O)[O-])c1 ZINC000123177913 1414661271 /nfs/dbraw/zinc/66/12/71/1414661271.db2.gz HLXRVXMTUZYIRB-GFCCVEGCSA-N 0 0 375.516 3.179 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)CCSC)c([N+](=O)[O-])c1 ZINC000123177722 1414661439 /nfs/dbraw/zinc/66/14/39/1414661439.db2.gz HLXRVXMTUZYIRB-LBPRGKRZSA-N 0 0 375.516 3.179 20 5 GGBDRN CCc1nnc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)[nH]1 ZINC000123209655 1414668741 /nfs/dbraw/zinc/66/87/41/1414668741.db2.gz SLFAKGFDBSDRMB-NSHDSACASA-N 0 0 381.396 3.096 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCCC[C@@H]1c1ncon1 ZINC000123210360 1414668794 /nfs/dbraw/zinc/66/87/94/1414668794.db2.gz BMFNSNIWMCITJN-ZYHUDNBSSA-N 0 0 380.788 3.152 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCCC[C@H]1c1ncon1 ZINC000123210755 1414668986 /nfs/dbraw/zinc/66/89/86/1414668986.db2.gz BMFNSNIWMCITJN-PWSUYJOCSA-N 0 0 380.788 3.152 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC(N(C)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000123231622 1414674173 /nfs/dbraw/zinc/67/41/73/1414674173.db2.gz ZMYQSWUNLXTLLZ-UHFFFAOYSA-N 0 0 395.506 3.254 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000123245138 1414677233 /nfs/dbraw/zinc/67/72/33/1414677233.db2.gz KMRUNJRDUFBTLX-UHFFFAOYSA-N 0 0 394.786 3.360 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000123259234 1414680272 /nfs/dbraw/zinc/68/02/72/1414680272.db2.gz XGENJWHJDAWMRY-MLGOLLRUSA-N 0 0 394.424 3.289 20 5 GGBDRN O=C(NC[C@H]1[C@@H]2c3ccccc3C[C@H]12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000123262255 1414681445 /nfs/dbraw/zinc/68/14/45/1414681445.db2.gz ZZPDWUBZYVCPBS-NJDAHSKKSA-N 0 0 392.459 3.012 20 5 GGBDRN C[C@H](c1ccccc1F)N(C)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000123264797 1414682339 /nfs/dbraw/zinc/68/23/39/1414682339.db2.gz GJSPMHQYYKUWES-LLVKDONJSA-N 0 0 391.424 3.145 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccn(-c2ccc(F)cc2)n1 ZINC000123278790 1414685630 /nfs/dbraw/zinc/68/56/30/1414685630.db2.gz XPOKHUNTZOVDQA-UHFFFAOYSA-N 0 0 398.350 3.333 20 5 GGBDRN Cc1c(C(=O)N(C)[C@@H](C)c2ccccc2F)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000123282763 1414687021 /nfs/dbraw/zinc/68/70/21/1414687021.db2.gz HZUMMADNFWDBLC-LBPRGKRZSA-N 0 0 383.383 3.456 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccnn1CCc1ccccc1 ZINC000123301082 1414691371 /nfs/dbraw/zinc/69/13/71/1414691371.db2.gz DTTABPSKYYMKOB-UHFFFAOYSA-N 0 0 384.367 3.191 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCc2cccc(CN3CCCC3=O)c2)c1[N+](=O)[O-] ZINC000123307555 1414693096 /nfs/dbraw/zinc/69/30/96/1414693096.db2.gz XPEZLYJRUYOHGC-UHFFFAOYSA-N 0 0 385.395 3.095 20 5 GGBDRN CCC1(CC)[C@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1OC ZINC000123316409 1414695154 /nfs/dbraw/zinc/69/51/54/1414695154.db2.gz KBXRBIZLZQMCSM-SJORKVTESA-N 0 0 387.436 3.102 20 5 GGBDRN CN1CCc2ccc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)cc2C1=O ZINC000123329512 1414698268 /nfs/dbraw/zinc/69/82/68/1414698268.db2.gz FSUYHZNKTFSSRD-UHFFFAOYSA-N 0 0 382.420 3.054 20 5 GGBDRN Cc1sc(S(=O)(=O)Oc2ccc([N+](=O)[O-])c(Cl)c2)cc1[N+](=O)[O-] ZINC000123334801 1414699079 /nfs/dbraw/zinc/69/90/79/1414699079.db2.gz HZPIIKXOYVKMIY-UHFFFAOYSA-N 0 0 378.771 3.294 20 5 GGBDRN Cc1ccccc1[C@@H](OC[C@@H](O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000123343530 1414700878 /nfs/dbraw/zinc/70/08/78/1414700878.db2.gz ZGVRKFUYDOTNBP-UGKGYDQZSA-N 0 0 394.427 3.232 20 5 GGBDRN Cc1cc(OC[C@H](O)Cn2cc([N+](=O)[O-])ccc2=O)c(C(C)C)cc1Cl ZINC000123342349 1414701098 /nfs/dbraw/zinc/70/10/98/1414701098.db2.gz HXLSUVYKEXPVTQ-CQSZACIVSA-N 0 0 380.828 3.282 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000123347912 1414702735 /nfs/dbraw/zinc/70/27/35/1414702735.db2.gz AWOZGRNWWUHLKZ-UHFFFAOYSA-N 0 0 398.463 3.302 20 5 GGBDRN O=C(N[C@H]1CCO[C@H](C2CC2)C1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000123356703 1414705126 /nfs/dbraw/zinc/70/51/26/1414705126.db2.gz JJVGTHNOADKNBL-NHYWBVRUSA-N 0 0 388.342 3.223 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N(C)C ZINC000123355183 1414705360 /nfs/dbraw/zinc/70/53/60/1414705360.db2.gz CMEILGZUENZKCM-LJQANCHMSA-N 0 0 396.447 3.046 20 5 GGBDRN Cc1cc(=O)n(C[C@@H](O)COC(c2ccccc2)c2ccccc2)cc1[N+](=O)[O-] ZINC000123379967 1414711446 /nfs/dbraw/zinc/71/14/46/1414711446.db2.gz MESLMKRWPUSKKT-LJQANCHMSA-N 0 0 394.427 3.232 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SCC(C)C ZINC000123385012 1414711953 /nfs/dbraw/zinc/71/19/53/1414711953.db2.gz BNOOYDQTKDIUKO-OLZOCXBDSA-N 0 0 381.498 3.376 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)OC[C@H]1CC(=O)N(c2ccccc2)C1 ZINC000123387562 1414712776 /nfs/dbraw/zinc/71/27/76/1414712776.db2.gz JLPMNSMHQOLLBW-INIZCTEOSA-N 0 0 397.431 3.383 20 5 GGBDRN Cc1cc(=O)n(C[C@H](O)COc2ccc(Oc3ccccc3)cc2)cc1[N+](=O)[O-] ZINC000123389657 1414713314 /nfs/dbraw/zinc/71/33/14/1414713314.db2.gz KQCBYKHZXPEWJC-INIZCTEOSA-N 0 0 396.399 3.297 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)c1ccccc1 ZINC000123404446 1414719356 /nfs/dbraw/zinc/71/93/56/1414719356.db2.gz OGZHNAYIVYIDLA-UHFFFAOYSA-N 0 0 389.477 3.200 20 5 GGBDRN Cc1ccc(-c2ncco2)cc1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000123427619 1414727032 /nfs/dbraw/zinc/72/70/32/1414727032.db2.gz JBHIPDXDDCJBGF-UHFFFAOYSA-N 0 0 381.344 3.388 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1OC ZINC000123442870 1414732391 /nfs/dbraw/zinc/73/23/91/1414732391.db2.gz CGAOIKOEQDBLNU-GFCCVEGCSA-N 0 0 376.384 3.360 20 5 GGBDRN Cc1c(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)cccc1[N+](=O)[O-] ZINC000123451147 1414736148 /nfs/dbraw/zinc/73/61/48/1414736148.db2.gz XHBIETDFBAIUGE-HNNXBMFYSA-N 0 0 379.457 3.111 20 5 GGBDRN O=C(NCc1cn(-c2ccccc2)nn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000123480440 1414747000 /nfs/dbraw/zinc/74/70/00/1414747000.db2.gz VMNYQDCQUSTUQF-UHFFFAOYSA-N 0 0 392.419 3.050 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCc1ccc(Cl)nc1 ZINC000123493039 1414750346 /nfs/dbraw/zinc/75/03/46/1414750346.db2.gz PYCZCQZFXKJKIW-UHFFFAOYSA-N 0 0 384.617 3.265 20 5 GGBDRN Nc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC2CCCC2)cc1[N+](=O)[O-] ZINC000123495807 1414752128 /nfs/dbraw/zinc/75/21/28/1414752128.db2.gz NICSKFBYHSSRQN-SFHVURJKSA-N 0 0 397.431 3.004 20 5 GGBDRN C[C@H](c1ncc(C(C)(C)C)o1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000177687536 1428833676 /nfs/dbraw/zinc/83/36/76/1428833676.db2.gz IIYHYNSUVHMJGD-CQSZACIVSA-N 0 0 386.452 3.399 20 5 GGBDRN C[C@@H](c1ncc(C(C)(C)C)o1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000177687522 1428833725 /nfs/dbraw/zinc/83/37/25/1428833725.db2.gz IIYHYNSUVHMJGD-AWEZNQCLSA-N 0 0 386.452 3.399 20 5 GGBDRN CN(C)c1ccc(-n2ccnc2SCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000123509514 1414756889 /nfs/dbraw/zinc/75/68/89/1414756889.db2.gz XYOUGLGMIXEBAS-UHFFFAOYSA-N 0 0 397.460 3.238 20 5 GGBDRN COC(=O)CCCc1csc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)n1 ZINC000123508808 1414756999 /nfs/dbraw/zinc/75/69/99/1414756999.db2.gz ORULTGFIWPVULX-UHFFFAOYSA-N 0 0 383.813 3.453 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCCc1cc(N)n(-c2ccccc2)n1 ZINC000123520244 1414761245 /nfs/dbraw/zinc/76/12/45/1414761245.db2.gz HWNGKCOMIIUMKK-UHFFFAOYSA-N 0 0 379.420 3.034 20 5 GGBDRN CC(C)C(=O)N1CCCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000123524585 1414762413 /nfs/dbraw/zinc/76/24/13/1414762413.db2.gz HJCSMQNTZIYSAW-UHFFFAOYSA-N 0 0 388.493 3.409 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1(CC)CC ZINC000177692934 1428834803 /nfs/dbraw/zinc/83/48/03/1428834803.db2.gz QTSGUKCRHACSEG-DLBZAZTESA-N 0 0 387.436 3.150 20 5 GGBDRN CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccn1 ZINC000123572298 1414778541 /nfs/dbraw/zinc/77/85/41/1414778541.db2.gz RGQVSEIUEIWYNF-LBPRGKRZSA-N 0 0 398.448 3.388 20 5 GGBDRN Cc1nc(CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C)s1 ZINC000123573943 1414779214 /nfs/dbraw/zinc/77/92/14/1414779214.db2.gz GSRVNCNGQAHWFL-UHFFFAOYSA-N 0 0 375.450 3.281 20 5 GGBDRN O=C(NCc1cnn(Cc2ccccc2)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123577046 1414780525 /nfs/dbraw/zinc/78/05/25/1414780525.db2.gz WUDDOGJFYSZYQM-UHFFFAOYSA-N 0 0 387.399 3.318 20 5 GGBDRN CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000123588895 1414786494 /nfs/dbraw/zinc/78/64/94/1414786494.db2.gz FPCNRDKNDZJKCV-UHFFFAOYSA-N 0 0 389.383 3.395 20 5 GGBDRN C[C@]1(c2ccccc2)CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCO1 ZINC000177699988 1428836799 /nfs/dbraw/zinc/83/67/99/1428836799.db2.gz YYNMZWOWFUZHFO-OAQYLSRUSA-N 0 0 392.415 3.168 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(NCCCNC(=O)c2cccs2)cc1Cl ZINC000123616360 1414796268 /nfs/dbraw/zinc/79/62/68/1414796268.db2.gz WKHKTLOPYGCYKA-UHFFFAOYSA-N 0 0 397.840 3.328 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN(C[C@H]3CCCO3)[C@@H]3CCSC3)n2)c1 ZINC000123628901 1414800274 /nfs/dbraw/zinc/80/02/74/1414800274.db2.gz GVWMKLDLOFGBPH-HZPDHXFCSA-N 0 0 390.465 3.131 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN(C[C@@H]3CCCO3)[C@@H]3CCSC3)n2)c1 ZINC000123628628 1414800314 /nfs/dbraw/zinc/80/03/14/1414800314.db2.gz GVWMKLDLOFGBPH-CVEARBPZSA-N 0 0 390.465 3.131 20 5 GGBDRN CCn1c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccccn1 ZINC000123636417 1414801801 /nfs/dbraw/zinc/80/18/01/1414801801.db2.gz LASBFQZPLRRBLP-GFCCVEGCSA-N 0 0 398.448 3.388 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000123652879 1414804295 /nfs/dbraw/zinc/80/42/95/1414804295.db2.gz NPFXNFIJFZZSID-LBPRGKRZSA-N 0 0 396.852 3.149 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CCC[C@H](O)C2)CC1 ZINC000123652367 1414804303 /nfs/dbraw/zinc/80/43/03/1414804303.db2.gz GXVGXYIUOIUKQC-WBVHZDCISA-N 0 0 375.469 3.112 20 5 GGBDRN COc1ccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 ZINC000123656605 1414804852 /nfs/dbraw/zinc/80/48/52/1414804852.db2.gz FQHUOSJOVQNTPH-FQEVSTJZSA-N 0 0 399.447 3.057 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)Oc1ccc(F)cc1Br ZINC000123657623 1414805048 /nfs/dbraw/zinc/80/50/48/1414805048.db2.gz RCWSNFMBZWSDLN-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN CCn1c(S[C@@H](C(N)=O)c2ccccc2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123669500 1414806685 /nfs/dbraw/zinc/80/66/85/1414806685.db2.gz SLTQLMHRNWCFPT-OAHLLOKOSA-N 0 0 383.433 3.192 20 5 GGBDRN CN(Cc1ccc(C(F)(F)F)cc1)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000123677788 1414807990 /nfs/dbraw/zinc/80/79/90/1414807990.db2.gz CBJBMKPFTUNPLE-UHFFFAOYSA-N 0 0 396.321 3.464 20 5 GGBDRN CCn1c(S[C@@H](C)C(=O)NC2CCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123691284 1414810780 /nfs/dbraw/zinc/81/07/80/1414810780.db2.gz JALRKRAHIWYPBF-LBPRGKRZSA-N 0 0 389.481 3.413 20 5 GGBDRN C[C@H](C(=O)N(C)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000123698787 1414811989 /nfs/dbraw/zinc/81/19/89/1414811989.db2.gz ZSQUXVAGIHGTKH-NSHDSACASA-N 0 0 382.825 3.199 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1cc([N+](=O)[O-])ccc1Cl ZINC000123707025 1414812760 /nfs/dbraw/zinc/81/27/60/1414812760.db2.gz SBDGVAXELVTXMF-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NC[C@@H]3CCC[C@@H](O)C3)cc2[N+](=O)[O-])CC1 ZINC000123715647 1414814576 /nfs/dbraw/zinc/81/45/76/1414814576.db2.gz IXNMKQPJQOGVSM-NVXWUHKLSA-N 0 0 375.469 3.112 20 5 GGBDRN Cc1ccccc1OCCCN(C)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123745302 1414819137 /nfs/dbraw/zinc/81/91/37/1414819137.db2.gz LPLHVSTZNHPWSS-UHFFFAOYSA-N 0 0 382.413 3.132 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000123749983 1414819701 /nfs/dbraw/zinc/81/97/01/1414819701.db2.gz ZYHHPAGWQPUMKT-MJGOQNOKSA-N 0 0 388.395 3.227 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000123749247 1414819820 /nfs/dbraw/zinc/81/98/20/1414819820.db2.gz ZYHHPAGWQPUMKT-PKOBYXMFSA-N 0 0 388.395 3.227 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(CN2CCOCC2)cc1 ZINC000123756003 1414820477 /nfs/dbraw/zinc/82/04/77/1414820477.db2.gz MMPWQKGERDONSZ-UHFFFAOYSA-N 0 0 394.431 3.090 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)cc(F)cc1[N+](=O)[O-] ZINC000123762502 1414821039 /nfs/dbraw/zinc/82/10/39/1414821039.db2.gz DVFPHEBCYYGAAG-YOEHRIQHSA-N 0 0 391.374 3.184 20 5 GGBDRN COCCN(CCCc1ccccc1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123770733 1414822125 /nfs/dbraw/zinc/82/21/25/1414822125.db2.gz BILZXACAKMXBNA-UHFFFAOYSA-N 0 0 396.440 3.004 20 5 GGBDRN CCn1c(COc2ccc(C)cc2)nnc1SCCn1ccc([N+](=O)[O-])n1 ZINC000123809434 1414827531 /nfs/dbraw/zinc/82/75/31/1414827531.db2.gz XEIJSOZAQUTHJG-UHFFFAOYSA-N 0 0 388.453 3.082 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)cc([N+](=O)[O-])c1 ZINC000123812053 1414828182 /nfs/dbraw/zinc/82/81/82/1414828182.db2.gz KYRWAOXQPZQURK-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OC[C@H](O)Cc2ccccc2)c1 ZINC000123859814 1414836915 /nfs/dbraw/zinc/83/69/15/1414836915.db2.gz PJRYEOVXMDCUEZ-CYBMUJFWSA-N 0 0 399.184 3.182 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccco1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000123863510 1414837769 /nfs/dbraw/zinc/83/77/69/1414837769.db2.gz SOGZERSIFMYOQH-ZANVPECISA-N 0 0 383.198 3.192 20 5 GGBDRN C[C@H](C[C@H](O)c1ccco1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000123863721 1414837781 /nfs/dbraw/zinc/83/77/81/1414837781.db2.gz SOGZERSIFMYOQH-RNCFNFMXSA-N 0 0 383.198 3.192 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(F)cc1[N+](=O)[O-] ZINC000123908905 1414847925 /nfs/dbraw/zinc/84/79/25/1414847925.db2.gz JZVYKCVKAUQYCL-UHFFFAOYSA-N 0 0 390.732 3.372 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000123919376 1414849504 /nfs/dbraw/zinc/84/95/04/1414849504.db2.gz RUEUNGJKGBYZQA-UHFFFAOYSA-N 0 0 376.359 3.351 20 5 GGBDRN CN1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])o2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000123922389 1414850430 /nfs/dbraw/zinc/85/04/30/1414850430.db2.gz NPPODXSCPIOPMJ-BZNIZROVSA-N 0 0 381.791 3.403 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000123951520 1414856493 /nfs/dbraw/zinc/85/64/93/1414856493.db2.gz XQGILIGHEGWMBC-UHFFFAOYSA-N 0 0 378.388 3.026 20 5 GGBDRN O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccn(C2CCCC2)n1 ZINC000123954576 1414857133 /nfs/dbraw/zinc/85/71/33/1414857133.db2.gz CVOWJUDYVNALPT-UHFFFAOYSA-N 0 0 399.451 3.375 20 5 GGBDRN Cc1cccc(OCC(=O)NCCc2ccc(OC(F)F)cc2)c1[N+](=O)[O-] ZINC000123970135 1414859271 /nfs/dbraw/zinc/85/92/71/1414859271.db2.gz XAXZCOIDHFDKBD-UHFFFAOYSA-N 0 0 380.347 3.242 20 5 GGBDRN CC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000123976948 1414861414 /nfs/dbraw/zinc/86/14/14/1414861414.db2.gz WBRUKHIZEAXANZ-CYBMUJFWSA-N 0 0 377.828 3.361 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1-n1ccnn1 ZINC000123985988 1414863045 /nfs/dbraw/zinc/86/30/45/1414863045.db2.gz BDEIVSDZXMSJCM-UHFFFAOYSA-N 0 0 395.422 3.374 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)COc2cccc(C)c2[N+](=O)[O-])cc1 ZINC000123992534 1414864453 /nfs/dbraw/zinc/86/44/53/1414864453.db2.gz BHUPSNNRPWSSEZ-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000177725936 1428843253 /nfs/dbraw/zinc/84/32/53/1428843253.db2.gz PYBDIYJDVUWWPS-ASHKIFAZSA-N 0 0 389.477 3.272 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000123998945 1414866354 /nfs/dbraw/zinc/86/63/54/1414866354.db2.gz HKFSCBOVQWMURO-BEFAXECRSA-N 0 0 391.493 3.324 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cnc(-c2ncccn2)s1 ZINC000124000792 1414866390 /nfs/dbraw/zinc/86/63/90/1414866390.db2.gz FLFAKXMFBZVDFX-UHFFFAOYSA-N 0 0 389.824 3.434 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000124002246 1414867030 /nfs/dbraw/zinc/86/70/30/1414867030.db2.gz QRPCGWHJSJWVDF-UHFFFAOYSA-N 0 0 381.344 3.458 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCCC[C@@H]1C[C@H](O)c1ccccc1 ZINC000124005069 1414867488 /nfs/dbraw/zinc/86/74/88/1414867488.db2.gz HBTRGIIGXRYHTL-MJGOQNOKSA-N 0 0 386.452 3.076 20 5 GGBDRN CCN(Cc1ccccc1C)C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000124016353 1414869561 /nfs/dbraw/zinc/86/95/61/1414869561.db2.gz YMHYOFAZUYAFCS-UHFFFAOYSA-N 0 0 379.420 3.455 20 5 GGBDRN CCc1cccc(C)c1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000177733170 1428844472 /nfs/dbraw/zinc/84/44/72/1428844472.db2.gz LPSOCIBSESHKBH-UHFFFAOYSA-N 0 0 375.812 3.488 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000177731530 1428844493 /nfs/dbraw/zinc/84/44/93/1428844493.db2.gz CNTCJJVEIUXSBK-PWFNWSNSSA-N 0 0 389.477 3.272 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)cc2)C[C@@H](C)O1 ZINC000124088744 1414883057 /nfs/dbraw/zinc/88/30/57/1414883057.db2.gz OSMGUYOYNGSAKQ-HZPDHXFCSA-N 0 0 395.459 3.407 20 5 GGBDRN CN(C)C(=O)Nc1cccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000124113948 1414888307 /nfs/dbraw/zinc/88/83/07/1414888307.db2.gz YBQWLWJTVUVHCX-UHFFFAOYSA-N 0 0 384.436 3.441 20 5 GGBDRN O=C(NCC1(Cc2ccccc2)CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000124129614 1414891285 /nfs/dbraw/zinc/89/12/85/1414891285.db2.gz WXSMIRXVBIVOEX-UHFFFAOYSA-N 0 0 377.400 3.189 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 ZINC000124129162 1414891319 /nfs/dbraw/zinc/89/13/19/1414891319.db2.gz PGUMBSFZOMVPRT-UHFFFAOYSA-N 0 0 388.811 3.426 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N3CCC[C@H]3C(C)(C)O)cc2[N+](=O)[O-])CC1 ZINC000124134991 1414892358 /nfs/dbraw/zinc/89/23/58/1414892358.db2.gz PMFFSDWGORFNOY-SFHVURJKSA-N 0 0 375.469 3.207 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000124137774 1414892747 /nfs/dbraw/zinc/89/27/47/1414892747.db2.gz LPKKAXHQXVJMFY-UHFFFAOYSA-N 0 0 396.447 3.252 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NC(C)(C)c1nccs1 ZINC000124153528 1414896532 /nfs/dbraw/zinc/89/65/32/1414896532.db2.gz ZNVCWKQRNKWJNJ-UHFFFAOYSA-N 0 0 375.859 3.227 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000124153771 1414896590 /nfs/dbraw/zinc/89/65/90/1414896590.db2.gz NEGDTHAMVFGJPA-QGZVFWFLSA-N 0 0 375.812 3.088 20 5 GGBDRN Cc1c(NC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000124154918 1414897035 /nfs/dbraw/zinc/89/70/35/1414897035.db2.gz YXFZHSQYHSSPTA-MRXNPFEDSA-N 0 0 397.431 3.159 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000124169834 1414899269 /nfs/dbraw/zinc/89/92/69/1414899269.db2.gz IJMQYKXLGPPPEY-STQMWFEESA-N 0 0 381.860 3.405 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000124169645 1414899321 /nfs/dbraw/zinc/89/93/21/1414899321.db2.gz IJMQYKXLGPPPEY-OLZOCXBDSA-N 0 0 381.860 3.405 20 5 GGBDRN COCCC1(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCC1 ZINC000124196826 1414906317 /nfs/dbraw/zinc/90/63/17/1414906317.db2.gz NSDUWOGANSVRMA-UHFFFAOYSA-N 0 0 391.468 3.354 20 5 GGBDRN Cc1ccc(NC(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000124202192 1414907118 /nfs/dbraw/zinc/90/71/18/1414907118.db2.gz YEKYPWZMNRQDSO-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)N2CCCC2)c1C ZINC000124203186 1414907994 /nfs/dbraw/zinc/90/79/94/1414907994.db2.gz GXRXSVAWRIXZLB-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1sccc1C(=O)NC1CC1 ZINC000124210019 1414909470 /nfs/dbraw/zinc/90/94/70/1414909470.db2.gz QVUGIMNXNBCIBH-UHFFFAOYSA-N 0 0 384.417 3.211 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC([C@@H](O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000124232982 1414915470 /nfs/dbraw/zinc/91/54/70/1414915470.db2.gz VIXVZTWQVPBNBU-KRWDZBQOSA-N 0 0 396.490 3.099 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000124288953 1414929964 /nfs/dbraw/zinc/92/99/64/1414929964.db2.gz DUDWOFWRIGAFDI-JTNHKYCSSA-N 0 0 382.800 3.237 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N1CCCN(Cc2ccccc2)c2ccccc21 ZINC000124290122 1414930899 /nfs/dbraw/zinc/93/08/99/1414930899.db2.gz OLDZPJCSSRIHIU-UHFFFAOYSA-N 0 0 391.431 3.235 20 5 GGBDRN CCOC(=O)CCc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000124299577 1414932870 /nfs/dbraw/zinc/93/28/70/1414932870.db2.gz QIQXAKODSXSNTB-UHFFFAOYSA-N 0 0 375.356 3.064 20 5 GGBDRN Cc1cc(CSc2ccccc2C(=O)OCCn2cc([N+](=O)[O-])cn2)on1 ZINC000177748031 1428848893 /nfs/dbraw/zinc/84/88/93/1428848893.db2.gz PLIDYSJNFQGGGO-UHFFFAOYSA-N 0 0 388.405 3.237 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@H](C)Sc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000177756910 1428850960 /nfs/dbraw/zinc/85/09/60/1428850960.db2.gz BPCBSSZLJDBEPV-NEPJUHHUSA-N 0 0 377.470 3.269 20 5 GGBDRN Cc1c(NC(=O)NCc2ccc(CN3CCCC3=O)cc2)cccc1[N+](=O)[O-] ZINC000124333535 1414942168 /nfs/dbraw/zinc/94/21/68/1414942168.db2.gz XVZDABLCSKLQAX-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN Cc1cccc(C(=O)OCCOc2cncc(Br)c2)c1[N+](=O)[O-] ZINC000124344249 1414945120 /nfs/dbraw/zinc/94/51/20/1414945120.db2.gz XOJDDBZWADJBFD-UHFFFAOYSA-N 0 0 381.182 3.297 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000124349103 1414946595 /nfs/dbraw/zinc/94/65/95/1414946595.db2.gz LKYBLOOIAZTNNP-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN Cc1ccc(C(=O)c2ccccc2C(=O)OCCn2cc([N+](=O)[O-])cn2)cc1C ZINC000177752813 1428849940 /nfs/dbraw/zinc/84/99/40/1428849940.db2.gz GMMOWGPVRANFQC-UHFFFAOYSA-N 0 0 393.399 3.496 20 5 GGBDRN CCn1cc(C(=O)C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cn1 ZINC000124367806 1414950203 /nfs/dbraw/zinc/95/02/03/1414950203.db2.gz OIVAEZYOKLMNSU-UHFFFAOYSA-N 0 0 376.800 3.091 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)OCCOc1cncc(Br)c1 ZINC000124366168 1414950263 /nfs/dbraw/zinc/95/02/63/1414950263.db2.gz IINGGVKQJWNBRA-UHFFFAOYSA-N 0 0 395.209 3.307 20 5 GGBDRN CC[C@H](C)NC(=O)[C@@H](C)Sc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000177756899 1428851041 /nfs/dbraw/zinc/85/10/41/1428851041.db2.gz BPCBSSZLJDBEPV-NWDGAFQWSA-N 0 0 377.470 3.269 20 5 GGBDRN CC(C)Oc1cccc(CN(C)Cn2cc(Br)c([N+](=O)[O-])n2)c1 ZINC000124380469 1414953006 /nfs/dbraw/zinc/95/30/06/1414953006.db2.gz HGDOFYOYTGXEMF-UHFFFAOYSA-N 0 0 383.246 3.431 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000124407821 1414960331 /nfs/dbraw/zinc/96/03/31/1414960331.db2.gz ZHUDTAIQDCHUCF-KRWDZBQOSA-N 0 0 398.337 3.367 20 5 GGBDRN Cc1nc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)sc1C ZINC000124408468 1414960653 /nfs/dbraw/zinc/96/06/53/1414960653.db2.gz GXGXRKXOBKIVDP-UHFFFAOYSA-N 0 0 375.859 3.108 20 5 GGBDRN CN(C[C@H]1CCC[C@@H]1O)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000124414394 1414962616 /nfs/dbraw/zinc/96/26/16/1414962616.db2.gz WLBZLWXHDMTLGG-UZLBHIALSA-N 0 0 383.448 3.440 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)n1 ZINC000124430047 1414965983 /nfs/dbraw/zinc/96/59/83/1414965983.db2.gz WFMBFBTXPZTMEY-CQSZACIVSA-N 0 0 387.415 3.475 20 5 GGBDRN O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)OCCn1cc([N+](=O)[O-])cn1 ZINC000177759133 1428851720 /nfs/dbraw/zinc/85/17/20/1428851720.db2.gz WFWRBCMUFGWZIZ-UHFFFAOYSA-N 0 0 390.783 3.276 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(CC(F)(F)F)[C@@H](C)C1 ZINC000124471529 1414975953 /nfs/dbraw/zinc/97/59/53/1414975953.db2.gz DXVBRUKDIWUTNK-NWDGAFQWSA-N 0 0 391.415 3.170 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc2c(c1)NC(=O)CS2 ZINC000124471802 1414976072 /nfs/dbraw/zinc/97/60/72/1414976072.db2.gz BSZRTHWSOGFOHL-UHFFFAOYSA-N 0 0 382.401 3.302 20 5 GGBDRN Cc1cnc([C@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)s1 ZINC000124520592 1414986349 /nfs/dbraw/zinc/98/63/49/1414986349.db2.gz FIFHNFIOMKVBLY-VIFPVBQESA-N 0 0 375.859 3.361 20 5 GGBDRN O=C1NCCN(Cc2c(F)cccc2[N+](=O)[O-])[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000124520399 1414986436 /nfs/dbraw/zinc/98/64/36/1414986436.db2.gz GECSYYUKQPTQNR-INIZCTEOSA-N 0 0 397.328 3.426 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000124532020 1414988816 /nfs/dbraw/zinc/98/88/16/1414988816.db2.gz JNCMIRRMJSOFFX-INIZCTEOSA-N 0 0 386.456 3.153 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000124532136 1414988879 /nfs/dbraw/zinc/98/88/79/1414988879.db2.gz JNCMIRRMJSOFFX-MRXNPFEDSA-N 0 0 386.456 3.153 20 5 GGBDRN Cc1nc2sccc2c(=O)n1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000124534871 1414989457 /nfs/dbraw/zinc/98/94/57/1414989457.db2.gz LXGWHBXFPLGGQO-UHFFFAOYSA-N 0 0 386.433 3.356 20 5 GGBDRN CC(C)(C(=O)OCCn1cc([N+](=O)[O-])cn1)c1ccc(Br)cc1 ZINC000177766848 1428853606 /nfs/dbraw/zinc/85/36/06/1428853606.db2.gz GFUHHRSOWKXODG-UHFFFAOYSA-N 0 0 382.214 3.075 20 5 GGBDRN CN1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](c2ccccc2)C1 ZINC000124553262 1414992134 /nfs/dbraw/zinc/99/21/34/1414992134.db2.gz YPFUHCPSVRPPNL-SFHVURJKSA-N 0 0 379.420 3.134 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CCC(CO)CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000124564333 1414995613 /nfs/dbraw/zinc/99/56/13/1414995613.db2.gz SODWWDQEKHRGDY-AWEZNQCLSA-N 0 0 384.436 3.007 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(N2CCC(O)CC2)cc1 ZINC000124582663 1414999125 /nfs/dbraw/zinc/99/91/25/1414999125.db2.gz SMWUKQHTNSCRLP-UHFFFAOYSA-N 0 0 394.431 3.218 20 5 GGBDRN CC[C@@H]1CN(C)c2ccccc2CN1C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000124621331 1415007220 /nfs/dbraw/zinc/00/72/20/1415007220.db2.gz LKBHCSDQLYAQDB-QGZVFWFLSA-N 0 0 397.431 3.043 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NC[C@@]2(C)CCCO2)cc1[N+](=O)[O-])c1ccccn1 ZINC000124645408 1415012492 /nfs/dbraw/zinc/01/24/92/1415012492.db2.gz HOSSMSXNKMJZQP-VBKZILBWSA-N 0 0 384.436 3.462 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000124652454 1415013997 /nfs/dbraw/zinc/01/39/97/1415013997.db2.gz FXQKXQSCYFYEAN-MRXNPFEDSA-N 0 0 397.328 3.426 20 5 GGBDRN Cc1c(NC(=O)c2cccc([N+](=O)[O-])c2)cccc1C(=O)N1CCSCC1 ZINC000124654918 1415014894 /nfs/dbraw/zinc/01/48/94/1415014894.db2.gz YYDWCCAABHQVCH-UHFFFAOYSA-N 0 0 385.445 3.345 20 5 GGBDRN C[C@@H](O)C[C@@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000124688013 1415022023 /nfs/dbraw/zinc/02/20/23/1415022023.db2.gz PZMZVQARKJDQCW-OCCSQVGLSA-N 0 0 398.868 3.081 20 5 GGBDRN C[C@H](O)C[C@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000124688204 1415022076 /nfs/dbraw/zinc/02/20/76/1415022076.db2.gz PZMZVQARKJDQCW-GXTWGEPZSA-N 0 0 398.868 3.081 20 5 GGBDRN CN(C(=O)c1ccncc1)c1ccc(CNC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000124701488 1415024829 /nfs/dbraw/zinc/02/48/29/1415024829.db2.gz ZIWBSRVLCQQKJE-UHFFFAOYSA-N 0 0 390.399 3.196 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)c1C ZINC000124707621 1415026373 /nfs/dbraw/zinc/02/63/73/1415026373.db2.gz MDROCLSCMYXOJZ-PBHICJAKSA-N 0 0 392.477 3.045 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000124713400 1415027565 /nfs/dbraw/zinc/02/75/65/1415027565.db2.gz QYXSUXXDUXGQQO-ZDUSSCGKSA-N 0 0 378.816 3.217 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000124713565 1415027867 /nfs/dbraw/zinc/02/78/67/1415027867.db2.gz QYXSUXXDUXGQQO-CYBMUJFWSA-N 0 0 378.816 3.217 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CC1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000124720244 1415029252 /nfs/dbraw/zinc/02/92/52/1415029252.db2.gz SEFJHNMYAHUVIX-UHFFFAOYSA-N 0 0 391.786 3.174 20 5 GGBDRN O=C(CCCc1ccccc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000124723204 1415029548 /nfs/dbraw/zinc/02/95/48/1415029548.db2.gz HTXCZDTUSXFLHO-UHFFFAOYSA-N 0 0 399.422 3.041 20 5 GGBDRN C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000124722759 1415029567 /nfs/dbraw/zinc/02/95/67/1415029567.db2.gz OKTCDQKFFNOLDT-OAHLLOKOSA-N 0 0 392.477 3.460 20 5 GGBDRN CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)OCCn2cc([N+](=O)[O-])cn2)c1 ZINC000177794377 1428859676 /nfs/dbraw/zinc/85/96/76/1428859676.db2.gz JGANDWSPRPDSQV-UHFFFAOYSA-N 0 0 394.815 3.286 20 5 GGBDRN CCc1ccc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1S(C)(=O)=O ZINC000124742219 1415034080 /nfs/dbraw/zinc/03/40/80/1415034080.db2.gz VEYKCJPEOGJXDI-LBPRGKRZSA-N 0 0 376.434 3.052 20 5 GGBDRN Cc1cc(=O)n(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000177796812 1428860586 /nfs/dbraw/zinc/86/05/86/1428860586.db2.gz LXZDYUWPKXGWIK-UHFFFAOYSA-N 0 0 389.717 3.376 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(CC(=O)NC(C)C)cc1 ZINC000124785004 1415043839 /nfs/dbraw/zinc/04/38/39/1415043839.db2.gz LSVSBIXFBPEDQJ-UHFFFAOYSA-N 0 0 384.436 3.021 20 5 GGBDRN Cc1ccccc1[C@H](CC(=O)Oc1cc(Cl)ccc1[N+](=O)[O-])NC(N)=O ZINC000124786079 1415043910 /nfs/dbraw/zinc/04/39/10/1415043910.db2.gz IRRJZGVTGWXPLL-ZDUSSCGKSA-N 0 0 377.784 3.262 20 5 GGBDRN O=C(NCC1(c2cccc(F)c2)CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000124792254 1415044996 /nfs/dbraw/zinc/04/49/96/1415044996.db2.gz CQGMWNAUOZZCOV-UHFFFAOYSA-N 0 0 381.363 3.037 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N[C@H]2CCCc3occc32)cc1[N+](=O)[O-] ZINC000124804176 1415047742 /nfs/dbraw/zinc/04/77/42/1415047742.db2.gz RYYQZAGPAREQPX-ZDUSSCGKSA-N 0 0 399.432 3.275 20 5 GGBDRN Cc1cccc2c(=O)n(CCC(=O)Oc3cc(Cl)ccc3[N+](=O)[O-])cnc12 ZINC000124811337 1415050049 /nfs/dbraw/zinc/05/00/49/1415050049.db2.gz XZEDHPKPRFVRIV-UHFFFAOYSA-N 0 0 387.779 3.262 20 5 GGBDRN CCOc1ccc(C(=O)NCc2cccc(CN3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000124813045 1415050317 /nfs/dbraw/zinc/05/03/17/1415050317.db2.gz FXQJWMNQEQSVSB-UHFFFAOYSA-N 0 0 397.431 3.046 20 5 GGBDRN CC(C)(C)c1ccccc1C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000124817120 1415051510 /nfs/dbraw/zinc/05/15/10/1415051510.db2.gz HVEXTXBGULBOIY-UHFFFAOYSA-N 0 0 395.459 3.491 20 5 GGBDRN CC(C)[C@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1nc(C2CC2)no1 ZINC000124822048 1415052417 /nfs/dbraw/zinc/05/24/17/1415052417.db2.gz FYQUXSHLNZSYEW-INIZCTEOSA-N 0 0 385.424 3.320 20 5 GGBDRN Cn1c(CCCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)nc2ccccc21 ZINC000124824670 1415053361 /nfs/dbraw/zinc/05/33/61/1415053361.db2.gz MLZBGADBBYFIOR-UHFFFAOYSA-N 0 0 393.447 3.418 20 5 GGBDRN O=C(Cn1cnc2c3ccccc3oc2c1=O)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000124832554 1415054384 /nfs/dbraw/zinc/05/43/84/1415054384.db2.gz KSPVREYEJORQCV-UHFFFAOYSA-N 0 0 399.746 3.310 20 5 GGBDRN Cc1nn(CCC(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)c(C)c1[N+](=O)[O-] ZINC000124833932 1415055026 /nfs/dbraw/zinc/05/50/26/1415055026.db2.gz GGTJCELMSVKLQY-MRXNPFEDSA-N 0 0 392.843 3.132 20 5 GGBDRN C[C@@H]1CCC[C@H](CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000124869473 1415063471 /nfs/dbraw/zinc/06/34/71/1415063471.db2.gz DFZXMYYSQDXHNW-MNOVXSKESA-N 0 0 385.367 3.077 20 5 GGBDRN Cc1nc(CCNS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)sc1C ZINC000124875701 1415064486 /nfs/dbraw/zinc/06/44/86/1415064486.db2.gz MECVXTHPKZQNDI-UHFFFAOYSA-N 0 0 389.886 3.151 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](C)c2cccc(-n3cccn3)c2)cc1[N+](=O)[O-] ZINC000124887485 1415067099 /nfs/dbraw/zinc/06/70/99/1415067099.db2.gz DPSDXIQQHROENM-LLVKDONJSA-N 0 0 392.462 3.190 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccco1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000124900864 1415069397 /nfs/dbraw/zinc/06/93/97/1415069397.db2.gz BPDCBMMDRLWZGY-HZMBPMFUSA-N 0 0 397.225 3.121 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)COc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000124916243 1415072565 /nfs/dbraw/zinc/07/25/65/1415072565.db2.gz DKVUHKDLXXAXMU-INIZCTEOSA-N 0 0 386.379 3.377 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(CN(C(C)=O)C2CC2)cc1 ZINC000124917709 1415072574 /nfs/dbraw/zinc/07/25/74/1415072574.db2.gz AUEWEUIZQMBBAC-UHFFFAOYSA-N 0 0 383.404 3.367 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1)C1CC1 ZINC000124923905 1415074100 /nfs/dbraw/zinc/07/41/00/1415074100.db2.gz XCJJDSDUXDTIFR-UHFFFAOYSA-N 0 0 396.447 3.424 20 5 GGBDRN Cc1ccsc1[C@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000124935867 1415076663 /nfs/dbraw/zinc/07/66/63/1415076663.db2.gz XMJPRFOUTLLVPK-IRXDYDNUSA-N 0 0 399.472 3.053 20 5 GGBDRN COc1ccc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000124939124 1415076726 /nfs/dbraw/zinc/07/67/26/1415076726.db2.gz IUKWWXLJGKGVIN-OAHLLOKOSA-N 0 0 384.310 3.086 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(Cl)c1)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000124941371 1415077245 /nfs/dbraw/zinc/07/72/45/1415077245.db2.gz UDZLDNTWHMZKBB-KRWDZBQOSA-N 0 0 394.786 3.366 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1noc(Cc2ccccc2)n1 ZINC000124940885 1415077392 /nfs/dbraw/zinc/07/73/92/1415077392.db2.gz MDSLLHOXQJYMHN-ZDUSSCGKSA-N 0 0 395.419 3.126 20 5 GGBDRN O=C(COc1ccc(N2CCCC2=O)cc1)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000124947905 1415078853 /nfs/dbraw/zinc/07/88/53/1415078853.db2.gz BTIHUIQAHWLLCR-UHFFFAOYSA-N 0 0 391.330 3.017 20 5 GGBDRN CCNC(=O)c1cccc(NC(=O)COc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000124951072 1415079848 /nfs/dbraw/zinc/07/98/48/1415079848.db2.gz YFTPBWGPNJDJHV-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000124952978 1415080418 /nfs/dbraw/zinc/08/04/18/1415080418.db2.gz OGDIIFLCMIPVBZ-LBPRGKRZSA-N 0 0 384.417 3.233 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Oc2cccnc2Cl)ccc1Br ZINC000124971975 1415083958 /nfs/dbraw/zinc/08/39/58/1415083958.db2.gz CPEPVNSWCPLLOS-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)Oc2cccnc2Cl)c1 ZINC000124972499 1415083963 /nfs/dbraw/zinc/08/39/63/1415083963.db2.gz YLCKDELRKINEEQ-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC(C)(O)CC3)cc2[N+](=O)[O-])n1 ZINC000177787743 1428858495 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3.246 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000177835900 1428868921 /nfs/dbraw/zinc/86/89/21/1428868921.db2.gz GMBWYQVKRVQTEP-LPHOPBHVSA-N 0 0 395.459 3.314 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)CC(=O)c2cccs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000125035160 1415096227 /nfs/dbraw/zinc/09/62/27/1415096227.db2.gz HEOGJXFSHRBWNQ-SECBINFHSA-N 0 0 377.378 3.264 20 5 GGBDRN C[C@@H](CC(=O)c1cccs1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000125037267 1415097093 /nfs/dbraw/zinc/09/70/93/1415097093.db2.gz ZDYIPCKKRGKVMT-LBPRGKRZSA-N 0 0 398.444 3.448 20 5 GGBDRN CNC(=O)c1ccc(C)c(NS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)c1 ZINC000177823724 1428865536 /nfs/dbraw/zinc/86/55/36/1428865536.db2.gz OMIVIQKHYACRJJ-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCC[C@@](C)(O)C2)c([N+](=O)[O-])c1 ZINC000125057246 1415101210 /nfs/dbraw/zinc/10/12/10/1415101210.db2.gz SSQYRQTWPCVWPR-TZIWHRDSSA-N 0 0 383.448 3.430 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCC2(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1 ZINC000125069040 1415103206 /nfs/dbraw/zinc/10/32/06/1415103206.db2.gz IMUGBPPTNVEQJE-UHFFFAOYSA-N 0 0 388.807 3.288 20 5 GGBDRN CC(C)CO[C@@H]1C[C@H](OC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C1(C)C ZINC000125087588 1415106618 /nfs/dbraw/zinc/10/66/18/1415106618.db2.gz HDKQOXPONGISOE-SJORKVTESA-N 0 0 388.424 3.172 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000125119569 1415113196 /nfs/dbraw/zinc/11/31/96/1415113196.db2.gz PZWJXMDUXRMHOM-VIFPVBQESA-N 0 0 385.423 3.221 20 5 GGBDRN CCCCCC[C@@H](C)NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125145618 1415118202 /nfs/dbraw/zinc/11/82/02/1415118202.db2.gz QCXRBJOJLRRMCX-MRXNPFEDSA-N 0 0 390.484 3.421 20 5 GGBDRN CCc1nc2c(s1)[C@H](N(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)CCC2 ZINC000125144130 1415118358 /nfs/dbraw/zinc/11/83/58/1415118358.db2.gz OCMCWBRVKFSOMK-CQSZACIVSA-N 0 0 388.449 3.088 20 5 GGBDRN Cc1ccc2cccc(C(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)c2n1 ZINC000125158659 1415120811 /nfs/dbraw/zinc/12/08/11/1415120811.db2.gz VAIPAHHVCZJDBQ-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000177836099 1428869011 /nfs/dbraw/zinc/86/90/11/1428869011.db2.gz MCBANKLHSKYOHS-YJBOKZPZSA-N 0 0 396.447 3.028 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccncc3)o2)cccc1[N+](=O)[O-] ZINC000125182847 1415125327 /nfs/dbraw/zinc/12/53/27/1415125327.db2.gz GJPOGABKEXGKGO-NSHDSACASA-N 0 0 385.405 3.468 20 5 GGBDRN CC(C)C[C@@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000125183657 1415126035 /nfs/dbraw/zinc/12/60/35/1415126035.db2.gz CMSAVSFORNRLQP-OAHLLOKOSA-N 0 0 377.828 3.314 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCN2c3ccccc3O[C@@H](C)C2=O)cc1[N+](=O)[O-] ZINC000177833348 1428868251 /nfs/dbraw/zinc/86/82/51/1428868251.db2.gz IMIBKPDUMTZZAU-GJZGRUSLSA-N 0 0 397.431 3.285 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)Oc1ccc(Br)nc1 ZINC000125213763 1415131994 /nfs/dbraw/zinc/13/19/94/1415131994.db2.gz BOWIBCWNVDDVRX-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000125219098 1415133019 /nfs/dbraw/zinc/13/30/19/1415133019.db2.gz SWQAYOBIWNYAGG-KRWDZBQOSA-N 0 0 396.852 3.319 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)cc1[N+](=O)[O-] ZINC000177834177 1428868549 /nfs/dbraw/zinc/86/85/49/1428868549.db2.gz DVZDGQCVARLLBH-CQSZACIVSA-N 0 0 395.415 3.043 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Oc2ccc(Br)nc2)c1C ZINC000125230673 1415135157 /nfs/dbraw/zinc/13/51/57/1415135157.db2.gz AIUHHXQHHDMIEB-UHFFFAOYSA-N 0 0 387.211 3.137 20 5 GGBDRN Cc1cnn(CCC(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c1 ZINC000125251183 1415141692 /nfs/dbraw/zinc/14/16/92/1415141692.db2.gz LECSIAFGJBAKOV-UHFFFAOYSA-N 0 0 394.387 3.348 20 5 GGBDRN O=C(NCc1ccnc(-n2cccn2)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125255271 1415143535 /nfs/dbraw/zinc/14/35/35/1415143535.db2.gz WQDWGCNSEGSWEW-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN C[C@@H](CCNc1ncc(Br)cc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000177823228 1428865207 /nfs/dbraw/zinc/86/52/07/1428865207.db2.gz BYELSYRERZSCMA-VIFPVBQESA-N 0 0 389.250 3.468 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)Oc1cccnc1[N+](=O)[O-] ZINC000125329519 1415166527 /nfs/dbraw/zinc/16/65/27/1415166527.db2.gz XSMUMVYYZRTWSA-CQSZACIVSA-N 0 0 381.392 3.198 20 5 GGBDRN Cc1ccccc1[C@@H](CC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)NC(N)=O ZINC000177846002 1428871195 /nfs/dbraw/zinc/87/11/95/1428871195.db2.gz WYDRSLPHHXVEOI-WMLDXEAASA-N 0 0 384.436 3.189 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1[N+](=O)[O-] ZINC000177846296 1428871305 /nfs/dbraw/zinc/87/13/05/1428871305.db2.gz CGQQCFKOCODNSN-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000177846668 1428871698 /nfs/dbraw/zinc/87/16/98/1428871698.db2.gz MIRCZCLFGDPISL-UHFFFAOYSA-N 0 0 390.465 3.155 20 5 GGBDRN Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2=O ZINC000177849547 1428872274 /nfs/dbraw/zinc/87/22/74/1428872274.db2.gz RCVNRQNRXMIIKJ-KBPBESRZSA-N 0 0 395.415 3.074 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 ZINC000125405337 1415189124 /nfs/dbraw/zinc/18/91/24/1415189124.db2.gz GXATVESQYHRJNK-LLVKDONJSA-N 0 0 395.412 3.063 20 5 GGBDRN O=C(CCCOc1ccccc1F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125421441 1415193307 /nfs/dbraw/zinc/19/33/07/1415193307.db2.gz FASFEKRXLMHVBB-CQSZACIVSA-N 0 0 388.399 3.001 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1[N+](=O)[O-] ZINC000177851155 1428873222 /nfs/dbraw/zinc/87/32/22/1428873222.db2.gz BHGCNGIPKJZVST-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)c2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000177852269 1428873264 /nfs/dbraw/zinc/87/32/64/1428873264.db2.gz QWDWTQTWTXZJEC-AWEZNQCLSA-N 0 0 378.388 3.149 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@@H](O)c2cc3ccccc3s2)cc1[N+](=O)[O-] ZINC000125435469 1415197572 /nfs/dbraw/zinc/19/75/72/1415197572.db2.gz AGDSFGIMMIXBID-GFCCVEGCSA-N 0 0 398.487 3.191 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC[C@H](Nc2ccccc2)C1 ZINC000177855561 1428873894 /nfs/dbraw/zinc/87/38/94/1428873894.db2.gz NZNMSFKTCLSPRI-KRWDZBQOSA-N 0 0 384.436 3.390 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2nn(-c3ccccc3)c(C)cc2=O)cc1[N+](=O)[O-] ZINC000177854945 1428873963 /nfs/dbraw/zinc/87/39/63/1428873963.db2.gz CMTBLXYEPRAPJO-OAHLLOKOSA-N 0 0 392.415 3.249 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c(F)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125444867 1415200664 /nfs/dbraw/zinc/20/06/64/1415200664.db2.gz NKJBAUUFFYLRKB-OAHLLOKOSA-N 0 0 399.426 3.056 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C2CCN(C(=O)N3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000177856151 1428874441 /nfs/dbraw/zinc/87/44/41/1428874441.db2.gz IDIQTIHWTXWAQH-OAHLLOKOSA-N 0 0 388.468 3.008 20 5 GGBDRN COc1ccc(N2C[C@H](C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)CC2=O)cc1 ZINC000177872872 1428878717 /nfs/dbraw/zinc/87/87/17/1428878717.db2.gz IENAOOXXIVFBLH-GDBMZVCRSA-N 0 0 397.431 3.142 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000125449880 1415202265 /nfs/dbraw/zinc/20/22/65/1415202265.db2.gz JVLBTSAZASMXNU-TZMCWYRMSA-N 0 0 379.482 3.346 20 5 GGBDRN O=C(CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)OCc1ccccc1 ZINC000125455797 1415203629 /nfs/dbraw/zinc/20/36/29/1415203629.db2.gz XETDUSNENXTSEY-UHFFFAOYSA-N 0 0 397.431 3.058 20 5 GGBDRN Cc1cc(OCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl ZINC000125461217 1415205216 /nfs/dbraw/zinc/20/52/16/1415205216.db2.gz OOEPNHLQFBRVOZ-CYBMUJFWSA-N 0 0 390.827 3.043 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000177859650 1428875374 /nfs/dbraw/zinc/87/53/74/1428875374.db2.gz GQIWDCGPSTZHMB-CQSZACIVSA-N 0 0 376.434 3.339 20 5 GGBDRN CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177859433 1428875459 /nfs/dbraw/zinc/87/54/59/1428875459.db2.gz COIZDGSHSZUTMP-VBKZILBWSA-N 0 0 381.432 3.054 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H](NC(=O)Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000177859256 1428875546 /nfs/dbraw/zinc/87/55/46/1428875546.db2.gz BKGXWZUSIHQJCZ-HRAATJIYSA-N 0 0 397.475 3.464 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])s1 ZINC000125462763 1415206075 /nfs/dbraw/zinc/20/60/75/1415206075.db2.gz GNPOEPWRUTYBQE-LBPRGKRZSA-N 0 0 391.449 3.333 20 5 GGBDRN CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177859414 1428875599 /nfs/dbraw/zinc/87/55/99/1428875599.db2.gz COIZDGSHSZUTMP-XOBRGWDASA-N 0 0 381.432 3.054 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000177861284 1428876103 /nfs/dbraw/zinc/87/61/03/1428876103.db2.gz OHYHWBKZSBHTDP-NVXWUHKLSA-N 0 0 388.468 3.008 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)cc1[N+](=O)[O-] ZINC000177862663 1428876374 /nfs/dbraw/zinc/87/63/74/1428876374.db2.gz HZMFKAKCYWAADD-DOMZBBRYSA-N 0 0 379.482 3.028 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000177862574 1428876389 /nfs/dbraw/zinc/87/63/89/1428876389.db2.gz ASEQJFTWBSHJFV-BBRMVZONSA-N 0 0 393.509 3.418 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1ccccc1F ZINC000125521470 1415219453 /nfs/dbraw/zinc/21/94/53/1415219453.db2.gz PICIMPJKNCZSBK-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCCN2C(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000177864070 1428876786 /nfs/dbraw/zinc/87/67/86/1428876786.db2.gz HZRNOYHYILJAHQ-ZFWWWQNUSA-N 0 0 387.461 3.447 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1[N+](=O)[O-] ZINC000177864025 1428876831 /nfs/dbraw/zinc/87/68/31/1428876831.db2.gz AOUPWTGFYWPUAE-OAHLLOKOSA-N 0 0 392.415 3.004 20 5 GGBDRN O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000177865206 1428877257 /nfs/dbraw/zinc/87/72/57/1428877257.db2.gz BHVYGDMSTKNWEE-UEXGIBASSA-N 0 0 392.459 3.012 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)cc1[N+](=O)[O-] ZINC000125497537 1415214673 /nfs/dbraw/zinc/21/46/73/1415214673.db2.gz HNBMUBRLVNLFNU-UIAACRFSSA-N 0 0 384.457 3.291 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCN2C(=O)CCc3ccccc32)cc1[N+](=O)[O-] ZINC000177870017 1428878880 /nfs/dbraw/zinc/87/88/80/1428878880.db2.gz BLXNDVDPQSKZBB-OAHLLOKOSA-N 0 0 381.432 3.450 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)COc2ccc(N3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000177865757 1428877669 /nfs/dbraw/zinc/87/76/69/1428877669.db2.gz QBHDYVABRYMLPF-HNNXBMFYSA-N 0 0 397.431 3.286 20 5 GGBDRN O=C(NCc1ccc(CN2CCCC2=O)cc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000125508202 1415216767 /nfs/dbraw/zinc/21/67/67/1415216767.db2.gz ONLVHSBKHKVDCT-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccc(CN2CCCC2=O)cc1 ZINC000125509988 1415217297 /nfs/dbraw/zinc/21/72/97/1415217297.db2.gz HJROCQMZGQGRJM-UHFFFAOYSA-N 0 0 399.472 3.126 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1cnc2[nH]cccc1-2 ZINC000125512604 1415217820 /nfs/dbraw/zinc/21/78/20/1415217820.db2.gz VTBQXEJGRRHFII-UHFFFAOYSA-N 0 0 398.194 3.001 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCc2c(C)nc3cc(=O)[nH]n3c2C)cc1[N+](=O)[O-] ZINC000177868185 1428878171 /nfs/dbraw/zinc/87/81/71/1428878171.db2.gz AFZZWUHEMGXLAU-LBPRGKRZSA-N 0 0 397.435 3.078 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1ccc(F)cc1 ZINC000125520916 1415219345 /nfs/dbraw/zinc/21/93/45/1415219345.db2.gz VRLLGCKQPVVNNX-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000177835911 1428869136 /nfs/dbraw/zinc/86/91/36/1428869136.db2.gz GMBWYQVKRVQTEP-VQIMIIECSA-N 0 0 395.459 3.314 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)cc1[N+](=O)[O-] ZINC000177840534 1428869929 /nfs/dbraw/zinc/86/99/29/1428869929.db2.gz SCZYAOIYEZSWJD-XHSDSOJGSA-N 0 0 398.463 3.403 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1[N+](=O)[O-] ZINC000177840549 1428869936 /nfs/dbraw/zinc/86/99/36/1428869936.db2.gz SCZYAOIYEZSWJD-OAGGEKHMSA-N 0 0 398.463 3.403 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)Cc2cccc(N(C)C)c2)cc1C ZINC000125559856 1415226339 /nfs/dbraw/zinc/22/63/39/1415226339.db2.gz VSWHKBKUVOAAMH-UHFFFAOYSA-N 0 0 377.466 3.098 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCCNC(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000177841781 1428870434 /nfs/dbraw/zinc/87/04/34/1428870434.db2.gz JBZOMIYVZGFATP-CQSZACIVSA-N 0 0 387.411 3.430 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000125566537 1415228041 /nfs/dbraw/zinc/22/80/41/1415228041.db2.gz XFNHCUDHIWRGKG-ZDUSSCGKSA-N 0 0 391.449 3.232 20 5 GGBDRN Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc(C)c1F ZINC000125606374 1415237018 /nfs/dbraw/zinc/23/70/18/1415237018.db2.gz UZLFOBVAHMKVHH-HXUWFJFHSA-N 0 0 399.378 3.001 20 5 GGBDRN Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000125649312 1415246051 /nfs/dbraw/zinc/24/60/51/1415246051.db2.gz DLOCEVOLZHOXTP-KSSFIOAISA-N 0 0 399.472 3.084 20 5 GGBDRN C[C@H](OC1CCCCCC1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125650109 1415246293 /nfs/dbraw/zinc/24/62/93/1415246293.db2.gz ZBICGGPPLGQDTM-LSDHHAIUSA-N 0 0 376.457 3.131 20 5 GGBDRN CC(=O)NCc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])o3)n2)s1 ZINC000125650269 1415246352 /nfs/dbraw/zinc/24/63/52/1415246352.db2.gz MKGIOAYNZOXKBK-UHFFFAOYSA-N 0 0 392.418 3.261 20 5 GGBDRN C[C@@H](NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)C1CCCCC1 ZINC000125656272 1415247667 /nfs/dbraw/zinc/24/76/67/1415247667.db2.gz FBBRGVVNFSDFAB-CYBMUJFWSA-N 0 0 375.425 3.368 20 5 GGBDRN COc1ccc(OS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])cc1 ZINC000125693823 1415255720 /nfs/dbraw/zinc/25/57/20/1415255720.db2.gz DHSHXRZDPVJEHR-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN Cc1c(CC(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)cccc1[N+](=O)[O-] ZINC000125696076 1415256665 /nfs/dbraw/zinc/25/66/65/1415256665.db2.gz JBQLBPHHNPDCJV-UHFFFAOYSA-N 0 0 396.491 3.297 20 5 GGBDRN O=C(O[C@H](c1ncccn1)C1CCCC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000125707179 1415258417 /nfs/dbraw/zinc/25/84/17/1415258417.db2.gz JLFOFPHADAJUAT-KRWDZBQOSA-N 0 0 394.391 3.054 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)[C@H]1CC1(Cl)Cl)c1ccccc1[N+](=O)[O-] ZINC000125712315 1415259954 /nfs/dbraw/zinc/25/99/54/1415259954.db2.gz VKYJNVAJSGUTQZ-NEPJUHHUSA-N 0 0 389.235 3.288 20 5 GGBDRN Cc1ccnc(Oc2cc(NC(=O)NCCn3cc([N+](=O)[O-])cn3)ccc2C)c1 ZINC000125725058 1415262792 /nfs/dbraw/zinc/26/27/92/1415262792.db2.gz AZHSITNSWZMZJN-UHFFFAOYSA-N 0 0 396.407 3.417 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000125730038 1415264029 /nfs/dbraw/zinc/26/40/29/1415264029.db2.gz WCOGCTOSHNEKAI-HIFRSBDPSA-N 0 0 396.490 3.411 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000125730310 1415264614 /nfs/dbraw/zinc/26/46/14/1415264614.db2.gz WCOGCTOSHNEKAI-UKRRQHHQSA-N 0 0 396.490 3.411 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(OC2CCCC2)c(F)c1 ZINC000125735179 1415265903 /nfs/dbraw/zinc/26/59/03/1415265903.db2.gz VBAYAJIMERZYOF-UHFFFAOYSA-N 0 0 377.376 3.074 20 5 GGBDRN COC(=O)[C@@H]1C[C@@H](OC)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000125741214 1415267504 /nfs/dbraw/zinc/26/75/04/1415267504.db2.gz OVSVSUCSAFJBDQ-ZBFHGGJFSA-N 0 0 376.434 3.086 20 5 GGBDRN CCc1nnc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)[nH]1 ZINC000125744045 1415268169 /nfs/dbraw/zinc/26/81/69/1415268169.db2.gz PFPHBUGIGLSFNQ-UHFFFAOYSA-N 0 0 390.450 3.444 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H]2C[C@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000125756761 1415271634 /nfs/dbraw/zinc/27/16/34/1415271634.db2.gz XZSRZLPUILPAOT-BBRMVZONSA-N 0 0 396.490 3.242 20 5 GGBDRN CC(C)(NC(=O)CSc1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000125758258 1415272158 /nfs/dbraw/zinc/27/21/58/1415272158.db2.gz PNVWMBPKOSUXHF-UHFFFAOYSA-N 0 0 397.460 3.319 20 5 GGBDRN COC(=O)[C@@H]1C[C@H](OC)CN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000125787655 1415280814 /nfs/dbraw/zinc/28/08/14/1415280814.db2.gz ZXFXUWJUKJYYAN-LRDDRELGSA-N 0 0 376.434 3.086 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000125796250 1415283192 /nfs/dbraw/zinc/28/31/92/1415283192.db2.gz NWXJWWLWZBUOIX-ZFWWWQNUSA-N 0 0 396.490 3.242 20 5 GGBDRN Cc1ccc(-c2noc(CCC(=O)NCCc3cccc([N+](=O)[O-])c3)n2)cc1F ZINC000125802106 1415285128 /nfs/dbraw/zinc/28/51/28/1415285128.db2.gz QHMAQVJTNLLUFF-UHFFFAOYSA-N 0 0 398.394 3.384 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1[N+](=O)[O-] ZINC000125806681 1415286052 /nfs/dbraw/zinc/28/60/52/1415286052.db2.gz PMMBCSQGJSORAW-UHFFFAOYSA-N 0 0 397.434 3.226 20 5 GGBDRN CC[C@H]1CCCC[C@H]1NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000125817278 1415288790 /nfs/dbraw/zinc/28/87/90/1415288790.db2.gz QAFUHSOXVNDOET-CMPLNLGQSA-N 0 0 385.367 3.220 20 5 GGBDRN CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000125816873 1415289033 /nfs/dbraw/zinc/28/90/33/1415289033.db2.gz QAFUHSOXVNDOET-JQWIXIFHSA-N 0 0 385.367 3.220 20 5 GGBDRN Cc1nc2ccccc2n1CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000125820679 1415290035 /nfs/dbraw/zinc/29/00/35/1415290035.db2.gz AMCUDZOJEBJODB-UHFFFAOYSA-N 0 0 397.391 3.208 20 5 GGBDRN Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCCN1CCn1cc([N+](=O)[O-])cn1 ZINC000125825512 1415291172 /nfs/dbraw/zinc/29/11/72/1415291172.db2.gz JIWYXXBILBNLQX-HNNXBMFYSA-N 0 0 380.880 3.443 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC(OC2CCCCC2)CC1 ZINC000125839915 1415294721 /nfs/dbraw/zinc/29/47/21/1415294721.db2.gz OCDSPEITFGUOMD-UHFFFAOYSA-N 0 0 382.482 3.406 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC(OC3CCCCC3)CC2)cc1 ZINC000125846152 1415295695 /nfs/dbraw/zinc/29/56/95/1415295695.db2.gz RNZAATXRJICPJC-UHFFFAOYSA-N 0 0 382.482 3.238 20 5 GGBDRN O=C(/C=C\c1ccccc1)N1CCC(C(=O)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000125851255 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397.475 3.407 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000126049078 1415344652 /nfs/dbraw/zinc/34/46/52/1415344652.db2.gz ZGHWPOLTYIWDFW-UHFFFAOYSA-N 0 0 394.181 3.238 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000126049336 1415344684 /nfs/dbraw/zinc/34/46/84/1415344684.db2.gz MNJHBDYZXUMUAJ-UHFFFAOYSA-N 0 0 398.463 3.068 20 5 GGBDRN O=C(c1cc(-c2ccc3c(c2)CCO3)no1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000126051092 1415345177 /nfs/dbraw/zinc/34/51/77/1415345177.db2.gz CTSJCDTZLABHSR-UHFFFAOYSA-N 0 0 391.383 3.383 20 5 GGBDRN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126051858 1415345528 /nfs/dbraw/zinc/34/55/28/1415345528.db2.gz FOZAEUMNGJXDTD-FQEVSTJZSA-N 0 0 379.416 3.218 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CC[C@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000126056102 1415346900 /nfs/dbraw/zinc/34/69/00/1415346900.db2.gz BWQYDERWXBVWCA-MRXNPFEDSA-N 0 0 382.416 3.476 20 5 GGBDRN 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ZINC000126105048 1415359481 /nfs/dbraw/zinc/35/94/81/1415359481.db2.gz ZLYBGVBBEFPDPE-QGZVFWFLSA-N 0 0 396.447 3.198 20 5 GGBDRN CN1CCN(c2ccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2Cl)CC1 ZINC000126136279 1415366545 /nfs/dbraw/zinc/36/65/45/1415366545.db2.gz XMZBXCYKWIKKBN-UHFFFAOYSA-N 0 0 392.818 3.391 20 5 GGBDRN CC1(C)CCC(CNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000126135965 1415367008 /nfs/dbraw/zinc/36/70/08/1415367008.db2.gz QCLBWINNHNBCQJ-UHFFFAOYSA-N 0 0 381.860 3.311 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126138788 1415367647 /nfs/dbraw/zinc/36/76/47/1415367647.db2.gz MULPIHSDLULSBZ-UHFFFAOYSA-N 0 0 388.371 3.454 20 5 GGBDRN Cc1c(Br)cc(C(=O)OCc2ncc(Cl)n2C)cc1[N+](=O)[O-] ZINC000126149663 1415370404 /nfs/dbraw/zinc/37/04/04/1415370404.db2.gz GMHKIFRDNKRMSA-UHFFFAOYSA-N 0 0 388.605 3.410 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1csc(-c3cccc([N+](=O)[O-])c3)n1)CCO2 ZINC000126160947 1415373024 /nfs/dbraw/zinc/37/30/24/1415373024.db2.gz OOPJJBVFRFBVKR-UHFFFAOYSA-N 0 0 382.401 3.461 20 5 GGBDRN CC[C@@H](C)CN(CC)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000177988372 1428917705 /nfs/dbraw/zinc/91/77/05/1428917705.db2.gz OFYLRYMGXKGXQT-GFCCVEGCSA-N 0 0 377.470 3.383 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)c1F ZINC000126190233 1415380726 /nfs/dbraw/zinc/38/07/26/1415380726.db2.gz VDGFTZOEZGKDQP-UHFFFAOYSA-N 0 0 377.353 3.498 20 5 GGBDRN Cc1c(C(=O)NC[C@H]2CCN(c3ccccc3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126197887 1415382650 /nfs/dbraw/zinc/38/26/50/1415382650.db2.gz MNDCFTWHLBZGOM-OAHLLOKOSA-N 0 0 398.419 3.376 20 5 GGBDRN CCc1ccc([C@H]2COCCN2CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)o1 ZINC000126209515 1415385221 /nfs/dbraw/zinc/38/52/21/1415385221.db2.gz ISNWIQGFWXZWNC-GOSISDBHSA-N 0 0 387.436 3.461 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCO[C@H](c2ccccc2C)C1 ZINC000126217106 1415386854 /nfs/dbraw/zinc/38/68/54/1415386854.db2.gz TYZOCDNAQPQYOD-YWZLYKJASA-N 0 0 399.447 3.312 20 5 GGBDRN Cc1c(CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cccc1[N+](=O)[O-] ZINC000126225357 1415388284 /nfs/dbraw/zinc/38/82/84/1415388284.db2.gz RWZIBAMYVOGFME-UHFFFAOYSA-N 0 0 399.403 3.424 20 5 GGBDRN O=C(Nc1ccccc1)C1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000126229931 1415389191 /nfs/dbraw/zinc/38/91/91/1415389191.db2.gz RWYVOJFYSZBSPI-UHFFFAOYSA-N 0 0 396.447 3.198 20 5 GGBDRN Cc1cccc(NCCNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 ZINC000126234299 1415390362 /nfs/dbraw/zinc/39/03/62/1415390362.db2.gz WDXGFTSFLVDPHY-UHFFFAOYSA-N 0 0 386.455 3.086 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCc1ccccc1OCC(F)(F)F ZINC000126245464 1415392801 /nfs/dbraw/zinc/39/28/01/1415392801.db2.gz LWQWUZSCBXDJHP-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000126249642 1415393600 /nfs/dbraw/zinc/39/36/00/1415393600.db2.gz YKJNWTUTGVMXRE-INIZCTEOSA-N 0 0 391.468 3.304 20 5 GGBDRN O=C(NCc1ccccc1OCC(F)(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000126252194 1415394759 /nfs/dbraw/zinc/39/47/59/1415394759.db2.gz LERQAGJCFVXJNN-UHFFFAOYSA-N 0 0 399.281 3.374 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1c1cccc2c1OCCO2 ZINC000126262462 1415397510 /nfs/dbraw/zinc/39/75/10/1415397510.db2.gz NROVZITWWRAZPH-SFHVURJKSA-N 0 0 397.431 3.455 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC[C@H](Cc2ccccc2)C1 ZINC000126307794 1415413519 /nfs/dbraw/zinc/41/35/19/1415413519.db2.gz PFJFWSISCDXYFJ-QGZVFWFLSA-N 0 0 376.416 3.485 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)Cn1c(=O)oc3ccc([N+](=O)[O-])cc31)CCC2 ZINC000126309988 1415413933 /nfs/dbraw/zinc/41/39/33/1415413933.db2.gz WIJAHSZFVQSLLL-ZDUSSCGKSA-N 0 0 388.449 3.489 20 5 GGBDRN Cc1nc(N2CCN(C(=O)c3cc(F)cc(C)c3[N+](=O)[O-])CC2)sc1C ZINC000126316707 1415416793 /nfs/dbraw/zinc/41/67/93/1415416793.db2.gz URGHKJLRRISMIB-UHFFFAOYSA-N 0 0 378.429 3.078 20 5 GGBDRN COc1ccc(CCCN(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000126335951 1415420299 /nfs/dbraw/zinc/42/02/99/1415420299.db2.gz LMFRIJDWBSZYTQ-UHFFFAOYSA-N 0 0 378.450 3.165 20 5 GGBDRN C[C@H](Nc1cnn(CC(F)(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000126343988 1415422466 /nfs/dbraw/zinc/42/24/66/1415422466.db2.gz PTYQQRONYKKYQV-QMMMGPOBSA-N 0 0 391.737 3.446 20 5 GGBDRN Cc1c(C(=O)NC[C@@H]2CCCO[C@@H]2C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000177983044 1428914497 /nfs/dbraw/zinc/91/44/97/1428914497.db2.gz MGVQCZRAUAKJMF-SUMWQHHRSA-N 0 0 379.413 3.301 20 5 GGBDRN COCCOc1ccc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000126351934 1415424076 /nfs/dbraw/zinc/42/40/76/1415424076.db2.gz JUZJKIUKTMRTKL-UHFFFAOYSA-N 0 0 385.420 3.124 20 5 GGBDRN Cc1c(C(=O)NC[C@H]2CCCO[C@@H]2C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000177983052 1428914600 /nfs/dbraw/zinc/91/46/00/1428914600.db2.gz MGVQCZRAUAKJMF-CXAGYDPISA-N 0 0 379.413 3.301 20 5 GGBDRN COc1ccccc1CN(C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000126358558 1415426167 /nfs/dbraw/zinc/42/61/67/1415426167.db2.gz ILQGTYGTOKCFKV-UHFFFAOYSA-N 0 0 383.404 3.042 20 5 GGBDRN COc1ccccc1-c1noc([C@@H](C)NC(=O)Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000126375571 1415430010 /nfs/dbraw/zinc/43/00/10/1415430010.db2.gz JJJMYYCMGVEFCM-CYBMUJFWSA-N 0 0 396.403 3.382 20 5 GGBDRN Cc1ccccc1[C@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCO1 ZINC000126376288 1415430480 /nfs/dbraw/zinc/43/04/80/1415430480.db2.gz YVCHYRYLUONFDZ-WOJBJXKFSA-N 0 0 381.432 3.082 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3C)n2)c1 ZINC000126378812 1415430736 /nfs/dbraw/zinc/43/07/36/1415430736.db2.gz RQRUSHMHTWCUDP-ZDUSSCGKSA-N 0 0 396.403 3.382 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3C)n2)c1 ZINC000126379022 1415431314 /nfs/dbraw/zinc/43/13/14/1415431314.db2.gz RQRUSHMHTWCUDP-CYBMUJFWSA-N 0 0 396.403 3.382 20 5 GGBDRN O=C(CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)OCc1ccccc1 ZINC000126383024 1415431724 /nfs/dbraw/zinc/43/17/24/1415431724.db2.gz NYPRRFJGIFVNBN-UHFFFAOYSA-N 0 0 383.404 3.032 20 5 GGBDRN C[C@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@@H](c2ccsc2)O1 ZINC000126386259 1415433183 /nfs/dbraw/zinc/43/31/83/1415433183.db2.gz XLUPVTKHWHJNIK-GUYCJALGSA-N 0 0 375.450 3.370 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@@H](O)c2cc3ccccc3s2)cc1[N+](=O)[O-] ZINC000126387558 1415433324 /nfs/dbraw/zinc/43/33/24/1415433324.db2.gz ASVBMFYIVZZLIL-OAHLLOKOSA-N 0 0 392.458 3.130 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccccn1 ZINC000126390633 1415435813 /nfs/dbraw/zinc/43/58/13/1415435813.db2.gz VVGQRKOSFWSPTR-IBGZPJMESA-N 0 0 378.388 3.100 20 5 GGBDRN Cc1[nH]nc2ncc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc12 ZINC000126402364 1415439830 /nfs/dbraw/zinc/43/98/30/1415439830.db2.gz FBOFGISLVDTAPL-UHFFFAOYSA-N 0 0 383.411 3.373 20 5 GGBDRN CCCN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CC1 ZINC000126406816 1415442863 /nfs/dbraw/zinc/44/28/63/1415442863.db2.gz DVBSALVLFMLRRI-UHFFFAOYSA-N 0 0 382.464 3.375 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H](O)c1cc2ccccc2s1 ZINC000126416542 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393.469 3.176 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)n1 ZINC000126452839 1415457312 /nfs/dbraw/zinc/45/73/12/1415457312.db2.gz MBHIBFMPHIOCCI-GFCCVEGCSA-N 0 0 393.469 3.176 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1ccc(Cl)cc1Cl ZINC000126468174 1415462421 /nfs/dbraw/zinc/46/24/21/1415462421.db2.gz CJBDABXVYLRIQU-MRXNPFEDSA-N 0 0 398.246 3.477 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000126471701 1415462942 /nfs/dbraw/zinc/46/29/42/1415462942.db2.gz NKOQMZGUWIUKGM-GOSISDBHSA-N 0 0 391.374 3.199 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000126477617 1415465390 /nfs/dbraw/zinc/46/53/90/1415465390.db2.gz KMLUCBQPQGMOAN-CVEARBPZSA-N 0 0 376.457 3.020 20 5 GGBDRN CCN(Cc1cccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1)C(C)=O ZINC000126490881 1415469601 /nfs/dbraw/zinc/46/96/01/1415469601.db2.gz IHORIUKGLAJGBI-UHFFFAOYSA-N 0 0 384.436 3.322 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[C@H]1n1ccnc1 ZINC000126503482 1415472163 /nfs/dbraw/zinc/47/21/63/1415472163.db2.gz QADIGMCZANMONQ-DNVCBOLYSA-N 0 0 383.452 3.115 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCc2nc(-c3ccccc3)c[nH]2)cc1[N+](=O)[O-] ZINC000126514954 1415475742 /nfs/dbraw/zinc/47/57/42/1415475742.db2.gz CCRBNOVKWNULDL-UHFFFAOYSA-N 0 0 381.348 3.132 20 5 GGBDRN CCCn1nc(C)c(/C=C2\N=C(c3ccc(OC)c([N+](=O)[O-])c3)OC2=O)c1C ZINC000178000448 1428925738 /nfs/dbraw/zinc/92/57/38/1428925738.db2.gz UFNIKAQACMMILB-GDNBJRDFSA-N 0 0 384.392 3.171 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000126568501 1415494756 /nfs/dbraw/zinc/49/47/56/1415494756.db2.gz FWAKYQMCJOFINB-CQSZACIVSA-N 0 0 394.424 3.025 20 5 GGBDRN Cc1cc(C(=O)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)cc(C)c1F ZINC000126580031 1415498486 /nfs/dbraw/zinc/49/84/86/1415498486.db2.gz ASKPRRDTVNSTML-UHFFFAOYSA-N 0 0 381.363 3.457 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000126610347 1415505950 /nfs/dbraw/zinc/50/59/50/1415505950.db2.gz BLAQEUYFLUHMRJ-CYBMUJFWSA-N 0 0 396.852 3.231 20 5 GGBDRN Cc1noc(C)c1CN1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000126610767 1415506793 /nfs/dbraw/zinc/50/67/93/1415506793.db2.gz XHOUMPCPYSYGRE-UHFFFAOYSA-N 0 0 393.831 3.203 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCc1nc2c(s1)CCCC2 ZINC000126631830 1415511923 /nfs/dbraw/zinc/51/19/23/1415511923.db2.gz JSDBWTIAORQPHJ-UHFFFAOYSA-N 0 0 384.461 3.313 20 5 GGBDRN CC[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)Oc1cccc(C)c1 ZINC000178017931 1428939108 /nfs/dbraw/zinc/93/91/08/1428939108.db2.gz SCKZSYHXKNHMCU-OAHLLOKOSA-N 0 0 395.415 3.332 20 5 GGBDRN C[C@H]1CC(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000126658681 1415519645 /nfs/dbraw/zinc/51/96/45/1415519645.db2.gz ISMIWTKRPPLRQJ-QWRGUYRKSA-N 0 0 389.374 3.488 20 5 GGBDRN Cc1ccc(C[C@@H](C)NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)s1 ZINC000126659729 1415520317 /nfs/dbraw/zinc/52/03/17/1415520317.db2.gz URLCNULALLPNNX-LLVKDONJSA-N 0 0 385.449 3.215 20 5 GGBDRN CC[C@](C)(CC(=O)OC)NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000126666482 1415521668 /nfs/dbraw/zinc/52/16/68/1415521668.db2.gz KCFLJDCYNGYQEM-OAHLLOKOSA-N 0 0 387.230 3.127 20 5 GGBDRN O=C(Nc1cccc(OCCF)c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000178023666 1428941589 /nfs/dbraw/zinc/94/15/89/1428941589.db2.gz BJTXKYZLJCKELN-UHFFFAOYSA-N 0 0 388.399 3.297 20 5 GGBDRN O=C(NCc1ccnc(N2CCCCC2)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000126708432 1415533706 /nfs/dbraw/zinc/53/37/06/1415533706.db2.gz UQCCWMZIFPKOGU-UHFFFAOYSA-N 0 0 395.463 3.484 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)N(Cc1ccco1)CC(F)(F)F ZINC000126739971 1415543871 /nfs/dbraw/zinc/54/38/71/1415543871.db2.gz KFTMLTMKEZTFGV-UHFFFAOYSA-N 0 0 387.314 3.199 20 5 GGBDRN CC[C@@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Oc1cccc(C)c1 ZINC000178033457 1428947135 /nfs/dbraw/zinc/94/71/35/1428947135.db2.gz YYUHISLHWMVXDW-INIZCTEOSA-N 0 0 395.419 3.071 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CNc1ccc(F)c([N+](=O)[O-])c1 ZINC000126798083 1415562888 /nfs/dbraw/zinc/56/28/88/1415562888.db2.gz ISDMRGQGSMCJBD-UHFFFAOYSA-N 0 0 391.399 3.212 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNC(=O)CNc2cc([N+](=O)[O-])c(C)cc2C)c(C)c1 ZINC000178013904 1428935608 /nfs/dbraw/zinc/93/56/08/1428935608.db2.gz MHFRNHVBGDDNFL-UHFFFAOYSA-N 0 0 398.463 3.304 20 5 GGBDRN CN1CCO[C@H]([C@H](NC(=O)c2ccc([N+](=O)[O-])s2)c2ccc(Cl)cc2)C1 ZINC000126807839 1415566210 /nfs/dbraw/zinc/56/62/10/1415566210.db2.gz YSAPVCPHFBNLFL-XJKSGUPXSA-N 0 0 395.868 3.111 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)C(C)(C)c1ccccc1 ZINC000126812462 1415567721 /nfs/dbraw/zinc/56/77/21/1415567721.db2.gz CQVRCQJHWIEJMI-ZDUSSCGKSA-N 0 0 385.420 3.024 20 5 GGBDRN COC(=O)CCN(CC(C)C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126822496 1415571923 /nfs/dbraw/zinc/57/19/23/1415571923.db2.gz DQCMZPBSUZHCOU-UHFFFAOYSA-N 0 0 376.331 3.275 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)N(C1CC1)C1CCCC1 ZINC000126833337 1415577947 /nfs/dbraw/zinc/57/79/47/1415577947.db2.gz SMLAAKHVGFTCFE-UHFFFAOYSA-N 0 0 389.271 3.453 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1nc(-c2ccc(F)cc2)no1 ZINC000126856995 1415586113 /nfs/dbraw/zinc/58/61/13/1415586113.db2.gz DDNWFCDLXKFSJT-UHFFFAOYSA-N 0 0 393.334 3.056 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000126858099 1415586335 /nfs/dbraw/zinc/58/63/35/1415586335.db2.gz GLEZMHFASOWDFB-UHFFFAOYSA-N 0 0 398.806 3.419 20 5 GGBDRN C[C@]1(c2cc(F)cc(F)c2)NC(=O)N(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1=O ZINC000126867971 1415590200 /nfs/dbraw/zinc/59/02/00/1415590200.db2.gz HIJUWHRZXRGNNS-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000178046508 1428954732 /nfs/dbraw/zinc/95/47/32/1428954732.db2.gz LTGZIYSAMJCJCE-MRXNPFEDSA-N 0 0 383.448 3.245 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3C)ccc2NC1=O ZINC000126889303 1415596526 /nfs/dbraw/zinc/59/65/26/1415596526.db2.gz PJDULFVBTFMSDD-FZKQIMNGSA-N 0 0 397.431 3.433 20 5 GGBDRN COc1cc(OCC(=O)N2CCc3c4ccccc4[nH]c3C2)ccc1[N+](=O)[O-] ZINC000126907389 1415601949 /nfs/dbraw/zinc/60/19/49/1415601949.db2.gz POBYBBOGUUDGLD-UHFFFAOYSA-N 0 0 381.388 3.048 20 5 GGBDRN Cc1nn(C)c(C)c1CCOC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126909637 1415603260 /nfs/dbraw/zinc/60/32/60/1415603260.db2.gz JIZRPOGFFHTYTP-UHFFFAOYSA-N 0 0 386.433 3.468 20 5 GGBDRN COc1ccc(NC(=O)CN2CCc3c4ccccc4[nH]c3C2)c([N+](=O)[O-])c1 ZINC000126915695 1415606748 /nfs/dbraw/zinc/60/67/48/1415606748.db2.gz ASTFXAJWNDYXAL-UHFFFAOYSA-N 0 0 380.404 3.082 20 5 GGBDRN CC(=O)N[C@@H](C)CCc1ccc(C(=O)COc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000126923820 1415610463 /nfs/dbraw/zinc/61/04/63/1415610463.db2.gz LTDGVNPLWNIXGR-ZDUSSCGKSA-N 0 0 388.395 3.453 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000126927582 1415611448 /nfs/dbraw/zinc/61/14/48/1415611448.db2.gz BRAOTQNSLOPTHA-ZDUSSCGKSA-N 0 0 393.509 3.472 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000126942160 1415615295 /nfs/dbraw/zinc/61/52/95/1415615295.db2.gz BPQWRPVMXQECJR-ZDUSSCGKSA-N 0 0 392.818 3.465 20 5 GGBDRN O=C(NC1CC=CC1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000126969749 1415621180 /nfs/dbraw/zinc/62/11/80/1415621180.db2.gz FWYCEDHQRKIUSP-UHFFFAOYSA-N 0 0 384.358 3.164 20 5 GGBDRN O=C(NCC[C@@H](O)c1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000126996827 1415630810 /nfs/dbraw/zinc/63/08/10/1415630810.db2.gz BSVHFKCHXNBKBX-OAHLLOKOSA-N 0 0 379.210 3.211 20 5 GGBDRN CC(C)C(=O)NCCCNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000126998204 1415630955 /nfs/dbraw/zinc/63/09/55/1415630955.db2.gz LZZDDDCZAXODKV-UHFFFAOYSA-N 0 0 398.463 3.099 20 5 GGBDRN COc1c(F)cc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000178065257 1428966233 /nfs/dbraw/zinc/96/62/33/1428966233.db2.gz OAWIORBNXCAWHW-JTQLQIEISA-N 0 0 393.346 3.006 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000178065634 1428966314 /nfs/dbraw/zinc/96/63/14/1428966314.db2.gz JICQZOILSKSIJA-LLVKDONJSA-N 0 0 393.346 3.321 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)s1 ZINC000127016013 1415638409 /nfs/dbraw/zinc/63/84/09/1415638409.db2.gz QYKVIXXHFWKCSS-ZDUSSCGKSA-N 0 0 389.477 3.162 20 5 GGBDRN CCOCc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000178067804 1428967005 /nfs/dbraw/zinc/96/70/05/1428967005.db2.gz NYTFVTXDMDVLSS-AWEZNQCLSA-N 0 0 385.420 3.256 20 5 GGBDRN NC(=O)C[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)C1 ZINC000127037123 1415645485 /nfs/dbraw/zinc/64/54/85/1415645485.db2.gz LGZZAJINGMWEQU-CYBMUJFWSA-N 0 0 391.493 3.357 20 5 GGBDRN O=C(CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)Nc1cccc2cccnc21 ZINC000127041144 1415646125 /nfs/dbraw/zinc/64/61/25/1415646125.db2.gz GXGLRHOVSCIARJ-UHFFFAOYSA-N 0 0 384.779 3.165 20 5 GGBDRN O=C(NCc1ccc(-n2ccnc2)cc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000127045294 1415646823 /nfs/dbraw/zinc/64/68/23/1415646823.db2.gz TUGRECHPJHNQSO-UHFFFAOYSA-N 0 0 391.431 3.311 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NCc3ccn4ccnc4c3)cc2[N+](=O)[O-])CC1 ZINC000178069784 1428968750 /nfs/dbraw/zinc/96/87/50/1428968750.db2.gz LBVRCXNTHJHWMW-UHFFFAOYSA-N 0 0 393.447 3.409 20 5 GGBDRN CCOc1ccccc1[C@@H](CC(C)C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000127064113 1415651180 /nfs/dbraw/zinc/65/11/80/1415651180.db2.gz VPBDZWAMUMCNHS-MRXNPFEDSA-N 0 0 387.436 3.059 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000127112739 1415662807 /nfs/dbraw/zinc/66/28/07/1415662807.db2.gz PDRXKLCWWBGVGW-ZDUSSCGKSA-N 0 0 381.175 3.450 20 5 GGBDRN C[C@@](O)(CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1cccs1 ZINC000127133264 1415667577 /nfs/dbraw/zinc/66/75/77/1415667577.db2.gz RGQMMRAVIQTLQN-CQSZACIVSA-N 0 0 385.239 3.056 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000127135771 1415667962 /nfs/dbraw/zinc/66/79/62/1415667962.db2.gz WDJCUUQGJODXCM-DOTOQJQBSA-N 0 0 375.469 3.071 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000127136235 1415668112 /nfs/dbraw/zinc/66/81/12/1415668112.db2.gz WDJCUUQGJODXCM-NVXWUHKLSA-N 0 0 375.469 3.071 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000127135995 1415668349 /nfs/dbraw/zinc/66/83/49/1415668349.db2.gz WDJCUUQGJODXCM-RDJZCZTQSA-N 0 0 375.469 3.071 20 5 GGBDRN C[C@](O)(CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccsc1 ZINC000127148620 1415672389 /nfs/dbraw/zinc/67/23/89/1415672389.db2.gz PXBJSYVDWZUHOB-AWEZNQCLSA-N 0 0 385.239 3.056 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(CC(F)(F)F)cc1 ZINC000127152548 1415673073 /nfs/dbraw/zinc/67/30/73/1415673073.db2.gz PUBXYXAEEWMGQK-UHFFFAOYSA-N 0 0 395.293 3.246 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@](C)(O)c1ccc(F)cc1 ZINC000127159849 1415674980 /nfs/dbraw/zinc/67/49/80/1415674980.db2.gz BBAMQJWDFKAUDY-SFHVURJKSA-N 0 0 378.425 3.483 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(C)o1 ZINC000127164873 1415676330 /nfs/dbraw/zinc/67/63/30/1415676330.db2.gz FDZDKOYKSGMHLU-MRXNPFEDSA-N 0 0 397.225 3.205 20 5 GGBDRN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)COc1ccc([N+](=O)[O-])cc1C=O ZINC000127188246 1415681834 /nfs/dbraw/zinc/68/18/34/1415681834.db2.gz KGOAPNCTNZYNHJ-LLVKDONJSA-N 0 0 378.331 3.284 20 5 GGBDRN CCCc1csc(NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)n1 ZINC000127189882 1415682570 /nfs/dbraw/zinc/68/25/70/1415682570.db2.gz AYNPUNVTCKAYQI-UHFFFAOYSA-N 0 0 399.432 3.110 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000178060919 1428963208 /nfs/dbraw/zinc/96/32/08/1428963208.db2.gz BZYJMMYAPZTASG-LLVKDONJSA-N 0 0 391.811 3.381 20 5 GGBDRN Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NCc3ccccc3[N+](=O)[O-])c2)n1 ZINC000178062141 1428963576 /nfs/dbraw/zinc/96/35/76/1428963576.db2.gz MMEALBMUYILIFG-UHFFFAOYSA-N 0 0 394.387 3.122 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000127226628 1415694106 /nfs/dbraw/zinc/69/41/06/1415694106.db2.gz VXAGZFJSRHHABX-WBVHZDCISA-N 0 0 388.420 3.462 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC(C)(C)c2ccccc21 ZINC000127226524 1415694304 /nfs/dbraw/zinc/69/43/04/1415694304.db2.gz BQPILNHRNZMEDR-SCLBCKFNSA-N 0 0 381.432 3.252 20 5 GGBDRN CN(CC(=O)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000127228681 1415695168 /nfs/dbraw/zinc/69/51/68/1415695168.db2.gz MOKCWFMPEHZYEO-UHFFFAOYSA-N 0 0 381.388 3.425 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cnc3ccccc3c2)cc1[N+](=O)[O-] ZINC000178064213 1428964685 /nfs/dbraw/zinc/96/46/85/1428964685.db2.gz XMNRTFXTSLBFCZ-CYBMUJFWSA-N 0 0 378.388 3.267 20 5 GGBDRN C[C@@H](CCC(C)(C)C)NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000127232578 1415696435 /nfs/dbraw/zinc/69/64/35/1415696435.db2.gz YWOYTBQVBLSDSV-HNNXBMFYSA-N 0 0 390.484 3.277 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1CCCN1C(=O)OCc1ccccc1 ZINC000178086845 1428976016 /nfs/dbraw/zinc/97/60/16/1428976016.db2.gz FRBPHOPEPHPHSV-SFHVURJKSA-N 0 0 383.404 3.012 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCc2ccccc2[C@H]1CO ZINC000127245001 1415701104 /nfs/dbraw/zinc/70/11/04/1415701104.db2.gz XKTNWBZDRTWZDR-HSZRJFAPSA-N 0 0 398.462 3.273 20 5 GGBDRN CC[C@H](CNC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)Oc1cccc(C)c1 ZINC000178090264 1428977284 /nfs/dbraw/zinc/97/72/84/1428977284.db2.gz GMGBVTNSDCWCOI-MRXNPFEDSA-N 0 0 385.420 3.124 20 5 GGBDRN CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000178090718 1428977526 /nfs/dbraw/zinc/97/75/26/1428977526.db2.gz PUKOEOFOLKUASV-HXUWFJFHSA-N 0 0 394.431 3.285 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1c(F)cccc1N1CCCC1 ZINC000127289493 1415720412 /nfs/dbraw/zinc/72/04/12/1415720412.db2.gz VJFBLEANGMBDEU-UHFFFAOYSA-N 0 0 379.413 3.443 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)[C@H](C)c1ccccc1C(F)(F)F ZINC000127289522 1415721006 /nfs/dbraw/zinc/72/10/06/1415721006.db2.gz KBCDLUCVFAWCBI-QWRGUYRKSA-N 0 0 384.358 3.427 20 5 GGBDRN Cc1c(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000127290492 1415722526 /nfs/dbraw/zinc/72/25/26/1415722526.db2.gz CBELMGKQGVVCIY-UHFFFAOYSA-N 0 0 377.441 3.280 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)s1 ZINC000127300566 1415726181 /nfs/dbraw/zinc/72/61/81/1415726181.db2.gz ILGIQZBCYNRZQI-UHFFFAOYSA-N 0 0 386.437 3.391 20 5 GGBDRN O=c1c(Br)cn(Cc2cc([N+](=O)[O-])ccc2Cl)cc1[N+](=O)[O-] ZINC000178102165 1428982088 /nfs/dbraw/zinc/98/20/88/1428982088.db2.gz FXGYZXMRZVRTDI-UHFFFAOYSA-N 0 0 388.561 3.129 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CCC[C@@H](OC)C2)c1=S ZINC000178112011 1428986860 /nfs/dbraw/zinc/98/68/60/1428986860.db2.gz YYQVYRVVBFLVDJ-OAHLLOKOSA-N 0 0 377.470 3.077 20 5 GGBDRN COc1cc(N[C@H]2CCCN(C(=O)c3csc([N+](=O)[O-])c3)C2)cc(OC)c1 ZINC000178115616 1428988427 /nfs/dbraw/zinc/98/84/27/1428988427.db2.gz KWGFBOICNAIEQS-ZDUSSCGKSA-N 0 0 391.449 3.390 20 5 GGBDRN C[C@@H](c1ccsc1)N1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000127379558 1415759248 /nfs/dbraw/zinc/75/92/48/1415759248.db2.gz DGPBESCZSXCRDJ-HNNXBMFYSA-N 0 0 388.493 3.287 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CNc3ccccc3O[C@@H]3CCOC3)n2)c1 ZINC000127379394 1415759732 /nfs/dbraw/zinc/75/97/32/1415759732.db2.gz PXUXXMBHAQEVDE-OAHLLOKOSA-N 0 0 382.376 3.425 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000127390181 1415762786 /nfs/dbraw/zinc/76/27/86/1415762786.db2.gz DIBUDBAPCNSYKK-KPZWWZAWSA-N 0 0 394.859 3.344 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C1(C)C ZINC000127392958 1415764098 /nfs/dbraw/zinc/76/40/98/1415764098.db2.gz QHTLZGRTZJLZJH-CABCVRRESA-N 0 0 379.413 3.395 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C1(C)C ZINC000127392712 1415764239 /nfs/dbraw/zinc/76/42/39/1415764239.db2.gz QHTLZGRTZJLZJH-HUUCEWRRSA-N 0 0 379.413 3.395 20 5 GGBDRN CC[C@@H](CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)Oc1cccc(C)c1 ZINC000178089409 1428976588 /nfs/dbraw/zinc/97/65/88/1428976588.db2.gz XKDSFNUZLQGCQL-INIZCTEOSA-N 0 0 385.420 3.124 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ccc(CN3CCn4c(nnc4C(F)(F)F)C3)o2)c1 ZINC000127427929 1415774834 /nfs/dbraw/zinc/77/48/34/1415774834.db2.gz XYIBGVSBAYSMQX-UHFFFAOYSA-N 0 0 393.325 3.481 20 5 GGBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000127426525 1415774905 /nfs/dbraw/zinc/77/49/05/1415774905.db2.gz JJHKAPAKWANUOR-ZDUSSCGKSA-N 0 0 396.378 3.311 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(COc3ccc(Br)nc3)n2)c1 ZINC000127428494 1415775757 /nfs/dbraw/zinc/77/57/57/1415775757.db2.gz MIJZYRLIMNUJRB-UHFFFAOYSA-N 0 0 377.154 3.381 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCOc1ccc(Br)nc1 ZINC000127447773 1415782112 /nfs/dbraw/zinc/78/21/12/1415782112.db2.gz BRLPIYKVTVYPQG-UHFFFAOYSA-N 0 0 394.181 3.129 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)NC3C[C@H](C)O[C@@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000127458322 1415786396 /nfs/dbraw/zinc/78/63/96/1415786396.db2.gz MTHGWKVPWFYXQM-STQMWFEESA-N 0 0 386.452 3.142 20 5 GGBDRN COc1cccc2c1N(C(=O)c1nnn(-c3cccc([N+](=O)[O-])c3)c1C)CCC2 ZINC000127468890 1415791179 /nfs/dbraw/zinc/79/11/79/1415791179.db2.gz ABKXXIKMPACXCZ-UHFFFAOYSA-N 0 0 393.403 3.086 20 5 GGBDRN O=C(N[C@@H]1CC(=O)N(C2CC2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000178140525 1428996146 /nfs/dbraw/zinc/99/61/46/1428996146.db2.gz ZVUXTIPGAQBSOP-CYBMUJFWSA-N 0 0 397.456 3.239 20 5 GGBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000127532352 1415805569 /nfs/dbraw/zinc/80/55/69/1415805569.db2.gz NZSKOYYJYCRYRL-CYBMUJFWSA-N 0 0 396.378 3.311 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000127534669 1415806049 /nfs/dbraw/zinc/80/60/49/1415806049.db2.gz ZZWQTRVNEIQOLT-IAQYHMDHSA-N 0 0 380.832 3.072 20 5 GGBDRN Cn1c(Cl)cnc1COC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000127558920 1415809754 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398.463 3.407 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCO[C@H](c3cccc(OC(F)F)c3)C2)c1 ZINC000127601457 1415817438 /nfs/dbraw/zinc/81/74/38/1415817438.db2.gz HFMVCACKUICFIL-ROUUACIJSA-N 0 0 394.374 3.303 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000127606956 1415818592 /nfs/dbraw/zinc/81/85/92/1415818592.db2.gz CNAIFVSJMKKZLL-UHFFFAOYSA-N 0 0 381.310 3.101 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC(OC2CCCCC2)CC1 ZINC000127614291 1415820343 /nfs/dbraw/zinc/82/03/43/1415820343.db2.gz UEEYGPJCIRDQFL-UHFFFAOYSA-N 0 0 389.452 3.182 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1C ZINC000127631617 1415823004 /nfs/dbraw/zinc/82/30/04/1415823004.db2.gz CWIURPKXUYNMJB-UHFFFAOYSA-N 0 0 399.447 3.021 20 5 GGBDRN O=C(CCCOc1ccc2c(c1)CCC(=O)N2)Nc1cc([N+](=O)[O-])ccc1F ZINC000127631154 1415823061 /nfs/dbraw/zinc/82/30/61/1415823061.db2.gz VOUWITACOJVNOC-UHFFFAOYSA-N 0 0 387.367 3.416 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccc([N+](=O)[O-])c(Cl)c2)c(F)c1 ZINC000127635441 1415824417 /nfs/dbraw/zinc/82/44/17/1415824417.db2.gz MLSLTHGITQWYFO-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(Sc3nncn3C)cc2)c(N)c([N+](=O)[O-])c1 ZINC000178158330 1429002451 /nfs/dbraw/zinc/00/24/51/1429002451.db2.gz PXFVWCUTXWXGAS-UHFFFAOYSA-N 0 0 384.421 3.017 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)c2)n1 ZINC000178168706 1429004899 /nfs/dbraw/zinc/00/48/99/1429004899.db2.gz YIPZPSMWCWUPMH-UHFFFAOYSA-N 0 0 393.403 3.050 20 5 GGBDRN Cc1ccc(S(=O)(=O)[N-]c2nc(CN3CCCCC3)cs2)cc1[N+](=O)[O-] ZINC000127657510 1415827517 /nfs/dbraw/zinc/82/75/17/1415827517.db2.gz OUZRZFKJVVADJL-UHFFFAOYSA-N 0 0 396.494 3.146 20 5 GGBDRN CC(C)([C@H](OC(=O)CCn1cccn1)c1ccc(Br)cc1)[N+](=O)[O-] ZINC000127661803 1415828488 /nfs/dbraw/zinc/82/84/88/1415828488.db2.gz BEKZIMJESKDUCK-OAHLLOKOSA-N 0 0 396.241 3.376 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC(=O)N1CCCc2ccccc21 ZINC000127664915 1415829158 /nfs/dbraw/zinc/82/91/58/1415829158.db2.gz XFCIIIXPYWMGLD-UHFFFAOYSA-N 0 0 382.420 3.313 20 5 GGBDRN C[C@H](Nc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)c1ccc(OC(F)F)cc1 ZINC000127682140 1415831944 /nfs/dbraw/zinc/83/19/44/1415831944.db2.gz GOLFGPWWIAHAGO-VIFPVBQESA-N 0 0 387.364 3.017 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000127694872 1415834817 /nfs/dbraw/zinc/83/48/17/1415834817.db2.gz JQTZBBYGFJHBFB-QGZVFWFLSA-N 0 0 378.812 3.499 20 5 GGBDRN CCc1ccc(S(C)(=O)=O)cc1C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000127697088 1415835144 /nfs/dbraw/zinc/83/51/44/1415835144.db2.gz SYPNGNPXZSHPGS-UHFFFAOYSA-N 0 0 390.461 3.226 20 5 GGBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127703568 1415836172 /nfs/dbraw/zinc/83/61/72/1415836172.db2.gz CRKDJVAUWUBLJY-LSDHHAIUSA-N 0 0 393.509 3.178 20 5 GGBDRN COc1ccc(NC(=O)CN(C)Cc2ccc(Cl)c(F)c2)c([N+](=O)[O-])c1 ZINC000127730182 1415840038 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ASXUAUGWIYGGOO-UHFFFAOYSA-N 0 0 399.407 3.064 20 5 GGBDRN CC(C)OC1CCC(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000127793409 1415851673 /nfs/dbraw/zinc/85/16/73/1415851673.db2.gz XDULHQJTYZBJCU-UHFFFAOYSA-N 0 0 383.832 3.039 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCCN(C(=O)c2cccc(F)c2)CC1 ZINC000127798363 1415852724 /nfs/dbraw/zinc/85/27/24/1415852724.db2.gz CHDHTGGXYSXYSC-UHFFFAOYSA-N 0 0 386.383 3.114 20 5 GGBDRN COc1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1OC ZINC000127799515 1415852770 /nfs/dbraw/zinc/85/27/70/1415852770.db2.gz XOCDMNDTJRSDIW-UHFFFAOYSA-N 0 0 385.420 3.486 20 5 GGBDRN Cc1ccc(-n2cnnn2)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000127808316 1415854923 /nfs/dbraw/zinc/85/49/23/1415854923.db2.gz WUAWYFKVUGWZOD-UHFFFAOYSA-N 0 0 393.407 3.075 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)n1 ZINC000178178181 1429008571 /nfs/dbraw/zinc/00/85/71/1429008571.db2.gz BPRHBXCHRJJIMU-LBPRGKRZSA-N 0 0 375.816 3.202 20 5 GGBDRN Nc1c(C(=O)NCC2(c3cccc(Cl)c3)CCOCC2)cccc1[N+](=O)[O-] ZINC000178177241 1429008622 /nfs/dbraw/zinc/00/86/22/1429008622.db2.gz URGJTMFJEMREIY-UHFFFAOYSA-N 0 0 389.839 3.309 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1F ZINC000127815684 1415855928 /nfs/dbraw/zinc/85/59/28/1415855928.db2.gz TTZMWRNTOWJVES-UHFFFAOYSA-N 0 0 388.399 3.211 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[C@@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000127836759 1415860221 /nfs/dbraw/zinc/86/02/21/1415860221.db2.gz IHLRNZZKSZBXRD-HLLBOEOZSA-N 0 0 390.484 3.317 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)c1nnnn1-c1ccccc1 ZINC000127844340 1415861840 /nfs/dbraw/zinc/86/18/40/1415861840.db2.gz MKYJJQOHYLURPX-CYBMUJFWSA-N 0 0 381.396 3.070 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC2)c1 ZINC000127872776 1415867491 /nfs/dbraw/zinc/86/74/91/1415867491.db2.gz VTJGSWQCFKSPRA-UHFFFAOYSA-N 0 0 388.399 3.041 20 5 GGBDRN CC[C@@H](CCO)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000127879046 1415868412 /nfs/dbraw/zinc/86/84/12/1415868412.db2.gz AJQCETQKBHLEDY-GJZGRUSLSA-N 0 0 386.452 3.301 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)C[C@@H](O)COCc1ccccc1 ZINC000127878410 1415868710 /nfs/dbraw/zinc/86/87/10/1415868710.db2.gz LCPUKCJCSGEPSW-QGZVFWFLSA-N 0 0 387.436 3.253 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)CSc1ncccc1[N+](=O)[O-] ZINC000127881207 1415869170 /nfs/dbraw/zinc/86/91/70/1415869170.db2.gz XQCVPXPJBKUZGY-UHFFFAOYSA-N 0 0 383.376 3.342 20 5 GGBDRN O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000127889644 1415870906 /nfs/dbraw/zinc/87/09/06/1415870906.db2.gz JIBFFYQBLOPUES-AWEZNQCLSA-N 0 0 384.314 3.241 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1 ZINC000178185506 1429011817 /nfs/dbraw/zinc/01/18/17/1429011817.db2.gz OAHSXPDWZDXGQH-HUUCEWRRSA-N 0 0 384.436 3.160 20 5 GGBDRN CCN(C[C@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C1)CC(F)(F)F ZINC000127898189 1415872538 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385.420 3.001 20 5 GGBDRN CN(Cc1cccc(Cl)c1)C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000127965034 1415884683 /nfs/dbraw/zinc/88/46/83/1415884683.db2.gz NJKBCBJAUFJHQR-UHFFFAOYSA-N 0 0 382.203 3.499 20 5 GGBDRN CNC(=O)c1ccc(NCc2ccc(COC3CCOCC3)cc2)c([N+](=O)[O-])c1 ZINC000127990208 1415889323 /nfs/dbraw/zinc/88/93/23/1415889323.db2.gz HGLBDPAKTRILCH-UHFFFAOYSA-N 0 0 399.447 3.262 20 5 GGBDRN CN1C(=O)CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc21 ZINC000178192471 1429014861 /nfs/dbraw/zinc/01/48/61/1429014861.db2.gz BPIHVOZQEHCMNR-UHFFFAOYSA-N 0 0 394.412 3.342 20 5 GGBDRN O=C(NCCc1nc2ccccc2s1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000128017029 1415893826 /nfs/dbraw/zinc/89/38/26/1415893826.db2.gz NJSJEXQYMGYCMC-UHFFFAOYSA-N 0 0 393.428 3.363 20 5 GGBDRN Cc1cnn(-c2ccc(S(=O)(=O)Nc3ccc(F)c([N+](=O)[O-])c3)cc2F)c1 ZINC000128029008 1415896558 /nfs/dbraw/zinc/89/65/58/1415896558.db2.gz HZTIOGDKPBUHBY-UHFFFAOYSA-N 0 0 394.359 3.168 20 5 GGBDRN 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/nfs/dbraw/zinc/01/87/96/1429018796.db2.gz UZPLVKOPLMVQNW-CQSZACIVSA-N 0 0 394.214 3.437 20 5 GGBDRN O=C(c1cccc(OCC(F)F)n1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000128167243 1415930002 /nfs/dbraw/zinc/93/00/02/1415930002.db2.gz RUANOACOTJARDJ-UHFFFAOYSA-N 0 0 377.347 3.439 20 5 GGBDRN O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128168390 1415930053 /nfs/dbraw/zinc/93/00/53/1415930053.db2.gz OIFREXFJOHXXOD-HNNXBMFYSA-N 0 0 395.868 3.113 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC(C)(C)c1cn(-c2ccccc2)nn1 ZINC000128170614 1415930885 /nfs/dbraw/zinc/93/08/85/1415930885.db2.gz GQWDDCSNBPMUOF-UHFFFAOYSA-N 0 0 396.407 3.241 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)c1 ZINC000128184323 1415933396 /nfs/dbraw/zinc/93/33/96/1415933396.db2.gz GDYVTUKEQZQPRT-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@H]2OCCC[C@@H]2C1 ZINC000128198639 1415937365 /nfs/dbraw/zinc/93/73/65/1415937365.db2.gz MAINTBHUTIBDHB-IIBYNOLFSA-N 0 0 376.456 3.182 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OCc2nnsc2Cl)c1 ZINC000128217745 1415942446 /nfs/dbraw/zinc/94/24/46/1415942446.db2.gz APODEEZENCXRRK-UHFFFAOYSA-N 0 0 397.581 3.283 20 5 GGBDRN O=C(CNc1cc(F)ccc1OC(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000128222168 1415942874 /nfs/dbraw/zinc/94/28/74/1415942874.db2.gz GUFUJGLPUYUYNG-UHFFFAOYSA-N 0 0 381.310 3.337 20 5 GGBDRN CCCOc1cc(NC(=O)c2cc(C)nn2C)c([N+](=O)[O-])cc1OCCC ZINC000128238243 1415945764 /nfs/dbraw/zinc/94/57/64/1415945764.db2.gz CVCAJRAGDXIOSY-UHFFFAOYSA-N 0 0 376.413 3.467 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(CCCO)Cc1cccc(Cl)c1 ZINC000128281076 1415953514 /nfs/dbraw/zinc/95/35/14/1415953514.db2.gz XQSCQHYSORMCSM-UHFFFAOYSA-N 0 0 398.868 3.130 20 5 GGBDRN CC(C)(C)C(=O)N1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000128283230 1415954358 /nfs/dbraw/zinc/95/43/58/1415954358.db2.gz RWMAMLFTNNDSHO-UHFFFAOYSA-N 0 0 388.493 3.409 20 5 GGBDRN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000128322569 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398.385 3.361 20 5 GGBDRN CC1(C)[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@H]2CCO[C@@H]21 ZINC000128395228 1415977813 /nfs/dbraw/zinc/97/78/13/1415977813.db2.gz CCJUJZDQDDQQIJ-HVETUWLQSA-N 0 0 376.456 3.084 20 5 GGBDRN CC1(C)[C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@H]2CCO[C@@H]21 ZINC000128395445 1415977946 /nfs/dbraw/zinc/97/79/46/1415977946.db2.gz CCJUJZDQDDQQIJ-XGRCMKMKSA-N 0 0 376.456 3.084 20 5 GGBDRN CC[C@@H](c1ccncc1)N(C)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000128397391 1415978462 /nfs/dbraw/zinc/97/84/62/1415978462.db2.gz XVUIESXOOUGDPA-INIZCTEOSA-N 0 0 398.419 3.288 20 5 GGBDRN Cc1cc(NC(=O)c2cc(C(C)(C)C)nn2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000128436182 1415986619 /nfs/dbraw/zinc/98/66/19/1415986619.db2.gz LMSALXGSWLCTPX-UHFFFAOYSA-N 0 0 382.424 3.372 20 5 GGBDRN CC(=O)N(c1nc(Cn2cc([N+](=O)[O-])c(C)cc2=O)cs1)c1ccccc1 ZINC000128442452 1415987951 /nfs/dbraw/zinc/98/79/51/1415987951.db2.gz OXDCKQJAQAHVPN-UHFFFAOYSA-N 0 0 384.417 3.254 20 5 GGBDRN 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ZINC000128464113 1415993648 /nfs/dbraw/zinc/99/36/48/1415993648.db2.gz OTCZZGYVZVLTMP-HZPDHXFCSA-N 0 0 387.480 3.472 20 5 GGBDRN CCOc1ccc([C@H]2CCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000128476892 1415996029 /nfs/dbraw/zinc/99/60/29/1415996029.db2.gz XZWYLHMRJQJWNJ-GOSISDBHSA-N 0 0 383.404 3.296 20 5 GGBDRN O=C(CCN1CCO[C@@H](c2ccccc2F)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000128475644 1415996119 /nfs/dbraw/zinc/99/61/19/1415996119.db2.gz KHKYOCKLVBBHSS-GOSISDBHSA-N 0 0 391.374 3.275 20 5 GGBDRN O=C(CCC(=O)N1CCc2sccc2C1)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000128490004 1415998508 /nfs/dbraw/zinc/99/85/08/1415998508.db2.gz WBAPTIAPKPNSAD-UHFFFAOYSA-N 0 0 395.387 3.238 20 5 GGBDRN C[C@H](O)C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000128509400 1416002874 /nfs/dbraw/zinc/00/28/74/1416002874.db2.gz QDIDAFALCZQXCM-GOEBONIOSA-N 0 0 381.432 3.290 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178294019 1429044313 /nfs/dbraw/zinc/04/43/13/1429044313.db2.gz 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Cc1c(CC(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)cccc1[N+](=O)[O-] ZINC000128597483 1416021259 /nfs/dbraw/zinc/02/12/59/1416021259.db2.gz ZWXBRPCMHLXBQA-CQSZACIVSA-N 0 0 380.404 3.297 20 5 GGBDRN CN(Cc1ccc(F)cc1)C(=O)CNc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000178278399 1429040984 /nfs/dbraw/zinc/04/09/84/1429040984.db2.gz YDRONIJCDDFCNN-UHFFFAOYSA-N 0 0 383.326 3.406 20 5 GGBDRN CC[C@@H]1CCC[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000128608417 1416023998 /nfs/dbraw/zinc/02/39/98/1416023998.db2.gz QWUDNTSKUUGUSX-RDBSUJKOSA-N 0 0 379.482 3.346 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCc2cc(F)cc(C)c21 ZINC000128615005 1416025904 /nfs/dbraw/zinc/02/59/04/1416025904.db2.gz NWWZMWYEYUTTNU-UHFFFAOYSA-N 0 0 380.397 3.192 20 5 GGBDRN CC(C)C[C@H]1CCCN1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000128616511 1416026112 /nfs/dbraw/zinc/02/61/12/1416026112.db2.gz MJFYYEDQGOFGAE-CQSZACIVSA-N 0 0 375.425 3.320 20 5 GGBDRN NC(=O)Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000128629642 1416029588 /nfs/dbraw/zinc/02/95/88/1416029588.db2.gz CZWREMBJBIVLIF-UHFFFAOYSA-N 0 0 382.298 3.034 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)CCOc1cccc(Cl)c1 ZINC000128637126 1416031250 /nfs/dbraw/zinc/03/12/50/1416031250.db2.gz CLDHCIMMCHLYHI-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN Cc1ccc(OCCN(C)C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000128655830 1416035247 /nfs/dbraw/zinc/03/52/47/1416035247.db2.gz JUCONIYZGGNHFN-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1[N+](=O)[O-] ZINC000128670576 1416038390 /nfs/dbraw/zinc/03/83/90/1416038390.db2.gz CBYQFKSQRDZGID-UHFFFAOYSA-N 0 0 377.347 3.270 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000128679886 1416040347 /nfs/dbraw/zinc/04/03/47/1416040347.db2.gz OPRSLNGHWGLNIY-WBVHZDCISA-N 0 0 394.424 3.011 20 5 GGBDRN COc1ccc(C(=O)N2CCN([C@H](C)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000128684909 1416042483 /nfs/dbraw/zinc/04/24/83/1416042483.db2.gz 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ZINC000128910497 1416099202 /nfs/dbraw/zinc/09/92/02/1416099202.db2.gz NTECWEVFIDKVPS-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CCOC[C@H]2C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000128912774 1416099893 /nfs/dbraw/zinc/09/98/93/1416099893.db2.gz JGHLFBFDIWVJIC-XOBRGWDASA-N 0 0 396.447 3.414 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2CCOC[C@H]2C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000128912919 1416100177 /nfs/dbraw/zinc/10/01/77/1416100177.db2.gz JGHLFBFDIWVJIC-VLIAUNLRSA-N 0 0 396.447 3.414 20 5 GGBDRN CC[C@H](CCO)CNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000128922653 1416102600 /nfs/dbraw/zinc/10/26/00/1416102600.db2.gz HFEXTBCZICVIMS-OWCLPIDISA-N 0 0 377.485 3.216 20 5 GGBDRN C[C@@H](O)[C@H]1CCCN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000128927550 1416104818 /nfs/dbraw/zinc/10/48/18/1416104818.db2.gz MOBSZNXUDQPQKD-HPFXQQBRSA-N 0 0 389.496 3.310 20 5 GGBDRN CNC(=O)c1cc(Br)ccc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000128936069 1416108004 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397.250 3.104 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)N1C[C@@H](C)O[C@@H](C)C1 ZINC000129174979 1416162663 /nfs/dbraw/zinc/16/26/63/1416162663.db2.gz HHKLYAWFBCSATF-OKILXGFUSA-N 0 0 395.525 3.324 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 ZINC000129175186 1416162839 /nfs/dbraw/zinc/16/28/39/1416162839.db2.gz HHKLYAWFBCSATF-ZIAGYGMSSA-N 0 0 395.525 3.324 20 5 GGBDRN CC[C@H](NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1c(C)noc1C ZINC000129180324 1416163990 /nfs/dbraw/zinc/16/39/90/1416163990.db2.gz WLRFTTSLXLWHQY-HNNXBMFYSA-N 0 0 387.440 3.183 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000129182294 1416164903 /nfs/dbraw/zinc/16/49/03/1416164903.db2.gz QOLTVUVQCZZMKV-OAQYLSRUSA-N 0 0 393.399 3.283 20 5 GGBDRN CN(C1CCCCC1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000129189033 1416166027 /nfs/dbraw/zinc/16/60/27/1416166027.db2.gz GFZKNLBURRYYNO-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc3c(c2)CCC(=O)N3)c([N+](=O)[O-])c1 ZINC000129191831 1416167129 /nfs/dbraw/zinc/16/71/29/1416167129.db2.gz ILERMQOJGUSWQC-UHFFFAOYSA-N 0 0 382.420 3.020 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)CCc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000129201734 1416169547 /nfs/dbraw/zinc/16/95/47/1416169547.db2.gz MTBQCJFETWACDE-UHFFFAOYSA-N 0 0 375.812 3.244 20 5 GGBDRN Cc1ccc(-c2nc(SCC(=O)N3CCc4c3cccc4[N+](=O)[O-])n[nH]2)cc1 ZINC000178404260 1429071559 /nfs/dbraw/zinc/07/15/59/1429071559.db2.gz QCLYWTUBDYOPGO-UHFFFAOYSA-N 0 0 395.444 3.370 20 5 GGBDRN C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000129232866 1416176264 /nfs/dbraw/zinc/17/62/64/1416176264.db2.gz FTLYIBJCQJXIIY-UWVGGRQHSA-N 0 0 377.260 3.024 20 5 GGBDRN CCOC(=O)c1ccnc(N2CC[C@H](Oc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000129242405 1416177831 /nfs/dbraw/zinc/17/78/31/1416177831.db2.gz SOZQIMAWRMUGHR-AWEZNQCLSA-N 0 0 391.811 3.478 20 5 GGBDRN COc1ccc(OC)c(CCCNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000129258078 1416181032 /nfs/dbraw/zinc/18/10/32/1416181032.db2.gz BBYRJCUUWDKIIW-UHFFFAOYSA-N 0 0 380.347 3.253 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000129281689 1416184832 /nfs/dbraw/zinc/18/48/32/1416184832.db2.gz FEENADYLEPTMOU-QGZVFWFLSA-N 0 0 393.237 3.303 20 5 GGBDRN CC[C@H](NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1c(C)noc1C ZINC000129297594 1416187411 /nfs/dbraw/zinc/18/74/11/1416187411.db2.gz KMWFSWCRFICBJG-KRWDZBQOSA-N 0 0 387.440 3.183 20 5 GGBDRN CC[C@@H](NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1c(C)noc1C ZINC000129297824 1416187473 /nfs/dbraw/zinc/18/74/73/1416187473.db2.gz KMWFSWCRFICBJG-QGZVFWFLSA-N 0 0 387.440 3.183 20 5 GGBDRN Cc1c(Nc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])cnn1CCC(C)C ZINC000129340733 1416193929 /nfs/dbraw/zinc/19/39/29/1416193929.db2.gz UAHULFXJAWMVIE-UHFFFAOYSA-N 0 0 395.485 3.140 20 5 GGBDRN CN(C[C@H]1CCC[C@H]1O)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000129347523 1416194908 /nfs/dbraw/zinc/19/49/08/1416194908.db2.gz NBEQYNCCRLVEMC-YLJYHZDGSA-N 0 0 383.448 3.440 20 5 GGBDRN CN(C[C@H]1CCC[C@@H]1O)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000129347066 1416194946 /nfs/dbraw/zinc/19/49/46/1416194946.db2.gz NBEQYNCCRLVEMC-XLIONFOSSA-N 0 0 383.448 3.440 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(-c3cn[nH]c3)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000129351461 1416195290 /nfs/dbraw/zinc/19/52/90/1416195290.db2.gz WNMGFIVWGOMFSO-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)Nc1cccc(Cn2cccn2)c1 ZINC000129372548 1416198657 /nfs/dbraw/zinc/19/86/57/1416198657.db2.gz BARBMEYTFYMGKY-UHFFFAOYSA-N 0 0 393.403 3.034 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000129380824 1416200082 /nfs/dbraw/zinc/20/00/82/1416200082.db2.gz JNXSQUXIDNRGDU-LBPRGKRZSA-N 0 0 396.852 3.149 20 5 GGBDRN COC(=O)c1cccc(OCc2noc(CCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000129390659 1416202055 /nfs/dbraw/zinc/20/20/55/1416202055.db2.gz RUHQKIKKXZAEBE-UHFFFAOYSA-N 0 0 383.360 3.129 20 5 GGBDRN O=C(CCN1CCO[C@@]2(CCc3ccccc32)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000129397095 1416202853 /nfs/dbraw/zinc/20/28/53/1416202853.db2.gz MCCKWNJWLTXSKL-NRFANRHFSA-N 0 0 399.422 3.236 20 5 GGBDRN CCOC(=O)CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H](C)c1ccccc1 ZINC000129422833 1416206927 /nfs/dbraw/zinc/20/69/27/1416206927.db2.gz POOATSFBXAFKKO-ZDUSSCGKSA-N 0 0 396.403 3.238 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000129424295 1416206977 /nfs/dbraw/zinc/20/69/77/1416206977.db2.gz RMKVMVIREHUEMF-NRFANRHFSA-N 0 0 393.399 3.283 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])s1 ZINC000129432477 1416208577 /nfs/dbraw/zinc/20/85/77/1416208577.db2.gz YJKLHOVIFBOWQX-JTQLQIEISA-N 0 0 395.868 3.095 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc2ccc(=O)oc2c1 ZINC000129433702 1416208783 /nfs/dbraw/zinc/20/87/83/1416208783.db2.gz JFBGTUNHJOKHSS-UHFFFAOYSA-N 0 0 395.776 3.431 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1ccccc1OCCn1ccnc1 ZINC000129438150 1416209681 /nfs/dbraw/zinc/20/96/81/1416209681.db2.gz RXJLIUVFGRGNOK-UHFFFAOYSA-N 0 0 395.419 3.235 20 5 GGBDRN COc1ccccc1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C ZINC000129440615 1416209948 /nfs/dbraw/zinc/20/99/48/1416209948.db2.gz JEJWFPOWYTWCGT-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000129445860 1416211081 /nfs/dbraw/zinc/21/10/81/1416211081.db2.gz JSWOSUFBIACRQB-NRFANRHFSA-N 0 0 393.399 3.283 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CS(=O)(=O)CCCc1ccccc1 ZINC000129461625 1416213161 /nfs/dbraw/zinc/21/31/61/1416213161.db2.gz HJSRMARIPSIJTK-UHFFFAOYSA-N 0 0 390.461 3.198 20 5 GGBDRN COc1ccc(C(=O)NCCCC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000129461151 1416213405 /nfs/dbraw/zinc/21/34/05/1416213405.db2.gz COPRROGVGZVWQS-UHFFFAOYSA-N 0 0 385.420 3.369 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(C(C)(C)C)ccc1O ZINC000129467285 1416214320 /nfs/dbraw/zinc/21/43/20/1416214320.db2.gz QANGREGPVOFGEO-GFCCVEGCSA-N 0 0 385.420 3.355 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000129476761 1416215900 /nfs/dbraw/zinc/21/59/00/1416215900.db2.gz JFOCZVANPRYSOT-LBPRGKRZSA-N 0 0 396.852 3.149 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NC[C@@H](C)c1c(C)noc1C ZINC000129481432 1416216751 /nfs/dbraw/zinc/21/67/51/1416216751.db2.gz UWRHQHWKIHRKGD-MRVPVSSYSA-N 0 0 378.341 3.110 20 5 GGBDRN CCn1cnnc1-c1ccccc1NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000129497914 1416218824 /nfs/dbraw/zinc/21/88/24/1416218824.db2.gz CHZRQRSVLQUMPG-UHFFFAOYSA-N 0 0 380.408 3.237 20 5 GGBDRN CC(C)S(=O)(=O)c1ccccc1NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000129505025 1416219689 /nfs/dbraw/zinc/21/96/89/1416219689.db2.gz PYHDMNGCYGXBKQ-UHFFFAOYSA-N 0 0 391.449 3.141 20 5 GGBDRN O=C(c1cccc(N2CCCNC2=O)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129506587 1416220125 /nfs/dbraw/zinc/22/01/25/1416220125.db2.gz NNIRAZCYHBUTSQ-UHFFFAOYSA-N 0 0 394.431 3.319 20 5 GGBDRN Cc1ccccc1[C@H](CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)NC(N)=O ZINC000129514976 1416221416 /nfs/dbraw/zinc/22/14/16/1416221416.db2.gz PUAPPKSCAUASPA-IBGZPJMESA-N 0 0 396.447 3.194 20 5 GGBDRN O=C(c1cc(=O)[nH]c2cc(F)ccc21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129517336 1416221683 /nfs/dbraw/zinc/22/16/83/1416221683.db2.gz XEBWXOXFACKILP-UHFFFAOYSA-N 0 0 381.363 3.380 20 5 GGBDRN CCC[C@H]1SCCN1S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000129530531 1416223445 /nfs/dbraw/zinc/22/34/45/1416223445.db2.gz QGTUYDXFNGQALY-GFCCVEGCSA-N 0 0 395.300 3.221 20 5 GGBDRN CN1CCC(=O)Nc2cc(C(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)ccc21 ZINC000129536222 1416224397 /nfs/dbraw/zinc/22/43/97/1416224397.db2.gz PHPQGMSAFSUKBJ-UHFFFAOYSA-N 0 0 394.431 3.178 20 5 GGBDRN COc1ccc(-c2nc(Cn3ccc(C)c([N+](=O)[O-])c3=O)cs2)cc1OC ZINC000129545134 1416225440 /nfs/dbraw/zinc/22/54/40/1416225440.db2.gz KRFZRPSGXKYFCD-UHFFFAOYSA-N 0 0 387.417 3.254 20 5 GGBDRN Cc1cccc([C@H](CC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)NC(N)=O)c1 ZINC000129547313 1416225819 /nfs/dbraw/zinc/22/58/19/1416225819.db2.gz NAPJLRZCBMMONS-IBGZPJMESA-N 0 0 396.447 3.194 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)c1[N+](=O)[O-] ZINC000129548496 1416225862 /nfs/dbraw/zinc/22/58/62/1416225862.db2.gz VXCKNFLEGQIBEN-GFCCVEGCSA-N 0 0 391.403 3.253 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(CCN(C)C)c1ccccc1 ZINC000129557603 1416227849 /nfs/dbraw/zinc/22/78/49/1416227849.db2.gz DBGUFKPSKUGFIP-UHFFFAOYSA-N 0 0 397.884 3.314 20 5 GGBDRN COc1ccc(C)cc1C(=O)Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000129556541 1416227876 /nfs/dbraw/zinc/22/78/76/1416227876.db2.gz JXRVVGJQMPJGRM-UHFFFAOYSA-N 0 0 379.372 3.018 20 5 GGBDRN O=C(c1ccc(N2CCOCC2)c(F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129559383 1416228237 /nfs/dbraw/zinc/22/82/37/1416228237.db2.gz HLDFYIPWBJGGPJ-UHFFFAOYSA-N 0 0 399.422 3.375 20 5 GGBDRN C[C@@H](CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)NC(=O)c1ccccc1 ZINC000129561992 1416228699 /nfs/dbraw/zinc/22/86/99/1416228699.db2.gz YVZWJTAWMYOQLP-HNNXBMFYSA-N 0 0 381.432 3.294 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N[C@H]2CCc3c2cccc3Cl)cc([N+](=O)[O-])c1 ZINC000129573761 1416230551 /nfs/dbraw/zinc/23/05/51/1416230551.db2.gz ODLCBUBJGWGZAQ-INIZCTEOSA-N 0 0 394.836 3.069 20 5 GGBDRN CC(C)CC(=O)NCCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000129573094 1416230579 /nfs/dbraw/zinc/23/05/79/1416230579.db2.gz BONCRAVTBKXFLH-UHFFFAOYSA-N 0 0 376.438 3.209 20 5 GGBDRN O=C(CCn1c(=O)oc2ccccc21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129606307 1416235842 /nfs/dbraw/zinc/23/58/42/1416235842.db2.gz LDDUMDBXNLTECL-UHFFFAOYSA-N 0 0 381.388 3.084 20 5 GGBDRN CN(Cc1ccco1)Cc1ccccc1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000129607289 1416236267 /nfs/dbraw/zinc/23/62/67/1416236267.db2.gz MOIJKBAPXAFVBU-UHFFFAOYSA-N 0 0 394.431 3.332 20 5 GGBDRN CCOC(=O)c1ccc(N2CCN(C/C=C/c3ccccc3[N+](=O)[O-])CC2)nc1 ZINC000129613511 1416237269 /nfs/dbraw/zinc/23/72/69/1416237269.db2.gz ZHLHGKMRNJKJDK-FNORWQNLSA-N 0 0 396.447 3.002 20 5 GGBDRN CCc1cc(N[C@@H](C(N)=O)c2ccc(F)cc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129624102 1416239115 /nfs/dbraw/zinc/23/91/15/1416239115.db2.gz HUUYOXVCKDJWDF-GOSISDBHSA-N 0 0 395.394 3.392 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cnn(-c3ccccc3F)c2C)c(C)c1[N+](=O)[O-] ZINC000129628000 1416239572 /nfs/dbraw/zinc/23/95/72/1416239572.db2.gz LUYOBIBQUNRJNP-UHFFFAOYSA-N 0 0 386.387 3.070 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cccc(-c3cn[nH]c3)c2)cc([N+](=O)[O-])c1 ZINC000129630675 1416240199 /nfs/dbraw/zinc/24/01/99/1416240199.db2.gz WOORJYZWHRNQDW-UHFFFAOYSA-N 0 0 380.360 3.414 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000129631212 1416240514 /nfs/dbraw/zinc/24/05/14/1416240514.db2.gz VWJPPHIOCAFACM-LBPRGKRZSA-N 0 0 396.852 3.149 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OCC(=O)NCC2(c3ccccc3)CCCC2)c1 ZINC000129667068 1416245712 /nfs/dbraw/zinc/24/57/12/1416245712.db2.gz VATCRIZRVAGDKI-UHFFFAOYSA-N 0 0 382.416 3.414 20 5 GGBDRN Cc1cc(N2CCCC2)ccc1NC(=O)COc1cc(C=O)ccc1[N+](=O)[O-] ZINC000129683322 1416248242 /nfs/dbraw/zinc/24/82/42/1416248242.db2.gz FRJDJOWBPGHGGN-UHFFFAOYSA-N 0 0 383.404 3.333 20 5 GGBDRN Cc1c(OC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cccc1[N+](=O)[O-] ZINC000129691100 1416249459 /nfs/dbraw/zinc/24/94/59/1416249459.db2.gz DEJBNKFBEITSTP-UHFFFAOYSA-N 0 0 385.344 3.048 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2ccc(Br)cc2F)c1 ZINC000129698098 1416250419 /nfs/dbraw/zinc/25/04/19/1416250419.db2.gz ADLOKYCZEAVAEO-UHFFFAOYSA-N 0 0 397.156 3.326 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000129718586 1416253300 /nfs/dbraw/zinc/25/33/00/1416253300.db2.gz KBUWXDYPIQUCSF-QMMMGPOBSA-N 0 0 376.369 3.086 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)Cn3ccc(C)c([N+](=O)[O-])c3=O)n2)cc1C ZINC000129723260 1416254363 /nfs/dbraw/zinc/25/43/63/1416254363.db2.gz FFDNQUIIAQGSLW-UHFFFAOYSA-N 0 0 398.444 3.444 20 5 GGBDRN O=C(c1cc2c(cc1F)NC(=O)CC2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129744506 1416257402 /nfs/dbraw/zinc/25/74/02/1416257402.db2.gz XICXVLIZCWXDGC-UHFFFAOYSA-N 0 0 383.379 3.423 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000129758574 1416259177 /nfs/dbraw/zinc/25/91/77/1416259177.db2.gz ILGMJFSKEBTCPK-UHFFFAOYSA-N 0 0 376.434 3.098 20 5 GGBDRN CCOc1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)c1OC(F)F ZINC000129756846 1416259194 /nfs/dbraw/zinc/25/91/94/1416259194.db2.gz UQQYSKBAHGJQTQ-UHFFFAOYSA-N 0 0 380.347 3.454 20 5 GGBDRN O=C(Oc1c(F)cccc1Cl)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000129757306 1416259256 /nfs/dbraw/zinc/25/92/56/1416259256.db2.gz LCSLTBMYOAOXJW-VIFPVBQESA-N 0 0 396.733 3.485 20 5 GGBDRN CNC(=O)c1cc(C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000129765738 1416260515 /nfs/dbraw/zinc/26/05/15/1416260515.db2.gz MZDVPDVEYDRCGF-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN Cc1nccn1CCCCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000129781071 1416263078 /nfs/dbraw/zinc/26/30/78/1416263078.db2.gz KNLDMADBOJRLJH-UHFFFAOYSA-N 0 0 385.468 3.300 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1 ZINC000129787635 1416263835 /nfs/dbraw/zinc/26/38/35/1416263835.db2.gz DQTQGUTXJDYWFS-RDJZCZTQSA-N 0 0 387.480 3.371 20 5 GGBDRN COC(=O)c1sc2cccc(F)c2c1Cn1ccc(C)c([N+](=O)[O-])c1=O ZINC000129795040 1416264974 /nfs/dbraw/zinc/26/49/74/1416264974.db2.gz WMVFKNGUKJGCBN-UHFFFAOYSA-N 0 0 376.365 3.254 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000129798023 1416265312 /nfs/dbraw/zinc/26/53/12/1416265312.db2.gz RJKUUJKIVIAONF-UHFFFAOYSA-N 0 0 390.299 3.217 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@H](Cc2ccccc2)c2ccccc2F)c1[N+](=O)[O-] ZINC000129835538 1416271503 /nfs/dbraw/zinc/27/15/03/1416271503.db2.gz OFKWAZIAZXBYGX-QGZVFWFLSA-N 0 0 382.395 3.490 20 5 GGBDRN C[C@@H](OCCCNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000129839814 1416272230 /nfs/dbraw/zinc/27/22/30/1416272230.db2.gz ZMIUIPAZVPALMG-OAHLLOKOSA-N 0 0 378.450 3.182 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 ZINC000129843161 1416272809 /nfs/dbraw/zinc/27/28/09/1416272809.db2.gz BVNPPWBQTGMXFQ-KRWDZBQOSA-N 0 0 387.367 3.033 20 5 GGBDRN O=C(NCCc1nc(-c2ccc(Cl)cc2)no1)c1ccc(F)cc1[N+](=O)[O-] ZINC000129851340 1416274311 /nfs/dbraw/zinc/27/43/11/1416274311.db2.gz HRAWOGXQIHPFPK-UHFFFAOYSA-N 0 0 390.758 3.410 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)c1ccc2ccccc2c1 ZINC000129852838 1416274692 /nfs/dbraw/zinc/27/46/92/1416274692.db2.gz JJXIPNSVVWHHNI-HXUWFJFHSA-N 0 0 379.416 3.277 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)c1ccc2ccccc2c1 ZINC000129852624 1416274762 /nfs/dbraw/zinc/27/47/62/1416274762.db2.gz JJXIPNSVVWHHNI-FQEVSTJZSA-N 0 0 379.416 3.277 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)N(C)C ZINC000129858037 1416275500 /nfs/dbraw/zinc/27/55/00/1416275500.db2.gz GZQNSIWZZJFADL-GOSISDBHSA-N 0 0 382.420 3.117 20 5 GGBDRN Cc1nccn1CCCCNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000129861935 1416275991 /nfs/dbraw/zinc/27/59/91/1416275991.db2.gz CBQQNWOASDIDDC-UHFFFAOYSA-N 0 0 388.471 3.256 20 5 GGBDRN CN(CCOCc1ccccc1)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000129878127 1416278370 /nfs/dbraw/zinc/27/83/70/1416278370.db2.gz CVUYSUGZMQVKSR-UHFFFAOYSA-N 0 0 383.448 3.484 20 5 GGBDRN O=C(Nc1cc(F)c(F)cc1F)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129881210 1416278651 /nfs/dbraw/zinc/27/86/51/1416278651.db2.gz OZJZHGLMTHGRKQ-UHFFFAOYSA-N 0 0 393.321 3.142 20 5 GGBDRN O=C(Nc1ccc2[nH]ccc2c1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129888317 1416280253 /nfs/dbraw/zinc/28/02/53/1416280253.db2.gz PYYYWVBBESYAAU-UHFFFAOYSA-N 0 0 378.388 3.206 20 5 GGBDRN Cc1cc(Cl)ncc1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129890715 1416281017 /nfs/dbraw/zinc/28/10/17/1416281017.db2.gz VMONDHBMHKCOKX-UHFFFAOYSA-N 0 0 388.811 3.081 20 5 GGBDRN CCCCn1ncc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000129895426 1416281248 /nfs/dbraw/zinc/28/12/48/1416281248.db2.gz 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CSc1ccccc1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129910476 1416283548 /nfs/dbraw/zinc/28/35/48/1416283548.db2.gz BIFOMYYXQXHNNM-UHFFFAOYSA-N 0 0 385.445 3.446 20 5 GGBDRN Cc1nc2ccc(NC(=O)C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)cc2o1 ZINC000129911674 1416283752 /nfs/dbraw/zinc/28/37/52/1416283752.db2.gz AMQZVFSLCWOVSF-UHFFFAOYSA-N 0 0 394.387 3.174 20 5 GGBDRN O=C(Nc1ccc2ncccc2c1)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129927275 1416285991 /nfs/dbraw/zinc/28/59/91/1416285991.db2.gz JGYJVFAUVUOFBE-UHFFFAOYSA-N 0 0 390.399 3.273 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1S(=O)(=O)N(C)C ZINC000129925599 1416286012 /nfs/dbraw/zinc/28/60/12/1416286012.db2.gz IJWRKLGJJTZCPD-AWEZNQCLSA-N 0 0 377.466 3.004 20 5 GGBDRN O=C(Nc1c(F)cc(F)cc1F)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129933031 1416287274 /nfs/dbraw/zinc/28/72/74/1416287274.db2.gz NISOBBKKNUZQAG-UHFFFAOYSA-N 0 0 393.321 3.142 20 5 GGBDRN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000129933868 1416287406 /nfs/dbraw/zinc/28/74/06/1416287406.db2.gz BBYCPKHDXPGVLB-MRXNPFEDSA-N 0 0 387.823 3.169 20 5 GGBDRN Cc1cc(Cl)ncc1NC(=O)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129936108 1416287818 /nfs/dbraw/zinc/28/78/18/1416287818.db2.gz CPPXDCLFLWBFIE-UHFFFAOYSA-N 0 0 388.811 3.081 20 5 GGBDRN CN(C(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000129938387 1416288232 /nfs/dbraw/zinc/28/82/32/1416288232.db2.gz ATYRACZAVUKMPL-OAHLLOKOSA-N 0 0 391.786 3.265 20 5 GGBDRN CC[C@H](NCc1ccccc1S(=O)(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000129937991 1416288253 /nfs/dbraw/zinc/28/82/53/1416288253.db2.gz CISKFZXBJDUPHG-KRWDZBQOSA-N 0 0 377.466 3.086 20 5 GGBDRN COCCNc1ccccc1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000129941967 1416288653 /nfs/dbraw/zinc/28/86/53/1416288653.db2.gz BKAKMXPFVOXKBL-UHFFFAOYSA-N 0 0 375.450 3.305 20 5 GGBDRN O=C(Nc1cnc2ccccc2c1)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129949726 1416289604 /nfs/dbraw/zinc/28/96/04/1416289604.db2.gz BYPFZPOEOUNHOF-UHFFFAOYSA-N 0 0 390.399 3.273 20 5 GGBDRN O=C(Nc1ccc(F)cc1F)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129965785 1416292709 /nfs/dbraw/zinc/29/27/09/1416292709.db2.gz DQFQCDKNHPYSKG-UHFFFAOYSA-N 0 0 375.331 3.003 20 5 GGBDRN CCOc1cccc(NC(=O)C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000129966416 1416292895 /nfs/dbraw/zinc/29/28/95/1416292895.db2.gz USVLKKWVCYZARX-UHFFFAOYSA-N 0 0 383.404 3.123 20 5 GGBDRN COc1ccc(N[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1Cl ZINC000129971094 1416293214 /nfs/dbraw/zinc/29/32/14/1416293214.db2.gz SLZUCBWLERTIIJ-CQSZACIVSA-N 0 0 375.768 3.001 20 5 GGBDRN Cc1cc(C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c(N)c([N+](=O)[O-])c1 ZINC000129981147 1416295859 /nfs/dbraw/zinc/29/58/59/1416295859.db2.gz SXVOSFIBCSCAKI-UHFFFAOYSA-N 0 0 396.378 3.087 20 5 GGBDRN CCCCn1ncc(NC(=O)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000129985361 1416296453 /nfs/dbraw/zinc/29/64/53/1416296453.db2.gz MAMCHHINOAMZIN-UHFFFAOYSA-N 0 0 399.451 3.030 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000129987559 1416296862 /nfs/dbraw/zinc/29/68/62/1416296862.db2.gz GWSFCTCRRKKPMV-UHFFFAOYSA-N 0 0 393.321 3.142 20 5 GGBDRN Cc1ccn(CC(=O)Nc2ccc(Oc3ccccc3)cc2)c(=O)c1[N+](=O)[O-] ZINC000129986951 1416296877 /nfs/dbraw/zinc/29/68/77/1416296877.db2.gz DVQGRMUYSMFSSI-UHFFFAOYSA-N 0 0 379.372 3.496 20 5 GGBDRN Cc1cccc(COC(=O)c2ccc([N+](=O)[O-])cc2I)n1 ZINC000129993065 1416298357 /nfs/dbraw/zinc/29/83/57/1416298357.db2.gz RQTZBYVZUUTYHD-UHFFFAOYSA-N 0 0 398.156 3.260 20 5 GGBDRN CCOCc1ccc(NC(=O)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000129997536 1416299599 /nfs/dbraw/zinc/29/95/99/1416299599.db2.gz PVNCNYKOBUULFK-UHFFFAOYSA-N 0 0 397.431 3.261 20 5 GGBDRN COC(=O)c1sccc1NC(=O)CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130000729 1416300062 /nfs/dbraw/zinc/30/00/62/1416300062.db2.gz RRDSYGHWMYKRNF-UHFFFAOYSA-N 0 0 389.433 3.046 20 5 GGBDRN CCOc1ccccc1Oc1ccccc1C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000130013852 1416302750 /nfs/dbraw/zinc/30/27/50/1416302750.db2.gz XNMSTISCBLINCQ-UHFFFAOYSA-N 0 0 396.403 3.412 20 5 GGBDRN CC(C)(C(=O)N[C@@H]1CC2(CCCC2)Oc2ccccc21)n1cc([N+](=O)[O-])cn1 ZINC000130023787 1416304287 /nfs/dbraw/zinc/30/42/87/1416304287.db2.gz NMIGIAWOYZKICD-MRXNPFEDSA-N 0 0 384.436 3.479 20 5 GGBDRN O=C(CCN1CCO[C@@H](Cc2ccccc2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000130042230 1416307174 /nfs/dbraw/zinc/30/71/74/1416307174.db2.gz KNCYDDOYPICROT-KRWDZBQOSA-N 0 0 387.411 3.006 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000130067232 1416311244 /nfs/dbraw/zinc/31/12/44/1416311244.db2.gz LWPOGMKSWAEKEH-UHFFFAOYSA-N 0 0 384.358 3.402 20 5 GGBDRN Cc1ccn(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)c(=O)c1[N+](=O)[O-] ZINC000130064788 1416311270 /nfs/dbraw/zinc/31/12/70/1416311270.db2.gz NJFCQRLTKKUFDS-UHFFFAOYSA-N 0 0 380.282 3.182 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000130067526 1416311497 /nfs/dbraw/zinc/31/14/97/1416311497.db2.gz JYBUCFSLHILLMH-KRWDZBQOSA-N 0 0 376.434 3.270 20 5 GGBDRN CN1C(=O)CCc2cc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)ccc21 ZINC000130078357 1416313134 /nfs/dbraw/zinc/31/31/34/1416313134.db2.gz MOJDMIHTOIEJNI-UHFFFAOYSA-N 0 0 378.388 3.166 20 5 GGBDRN CC[C@@H](C)N(CC(=O)OC(C)(C)C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000130078287 1416313378 /nfs/dbraw/zinc/31/33/78/1416313378.db2.gz RLKSRVBSRBDVRV-LLVKDONJSA-N 0 0 376.413 3.054 20 5 GGBDRN O=C(Nc1cccnc1N1CCOCC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000130087432 1416315491 /nfs/dbraw/zinc/31/54/91/1416315491.db2.gz WWKLJZKQJHNPOP-UHFFFAOYSA-N 0 0 396.325 3.098 20 5 GGBDRN O=C(N[C@H](c1nc[nH]n1)c1cccc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])s1 ZINC000130086506 1416315670 /nfs/dbraw/zinc/31/56/70/1416315670.db2.gz KDKSIMVYEPKPJV-LBPRGKRZSA-N 0 0 397.338 3.313 20 5 GGBDRN CCOCCO[C@H]1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000130089980 1416316190 /nfs/dbraw/zinc/31/61/90/1416316190.db2.gz NCEJBYDQNNVSCF-NSHDSACASA-N 0 0 393.318 3.154 20 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ZINC000130176410 1416332712 /nfs/dbraw/zinc/33/27/12/1416332712.db2.gz FKYYMMRQNSKWOG-NSHDSACASA-N 0 0 386.389 3.041 20 5 GGBDRN CCc1ccc(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000130176119 1416332957 /nfs/dbraw/zinc/33/29/57/1416332957.db2.gz NRGNXTUFQDBWFP-SFHVURJKSA-N 0 0 381.432 3.078 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000130185825 1416334896 /nfs/dbraw/zinc/33/48/96/1416334896.db2.gz UMACWBUHUZMOLS-UHFFFAOYSA-N 0 0 392.481 3.114 20 5 GGBDRN COc1ccc(COCCCNC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1 ZINC000130190774 1416336117 /nfs/dbraw/zinc/33/61/17/1416336117.db2.gz GKVDHLKNVIGSCS-UHFFFAOYSA-N 0 0 376.384 3.388 20 5 GGBDRN CC1(NC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CCOCC1 ZINC000130203680 1416339010 /nfs/dbraw/zinc/33/90/10/1416339010.db2.gz BKIOWJFZZVQZNY-UHFFFAOYSA-N 0 0 399.234 3.386 20 5 GGBDRN O=C(NCCc1ccccn1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000130214740 1416340411 /nfs/dbraw/zinc/34/04/11/1416340411.db2.gz 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390.186 3.405 20 5 GGBDRN O=C(Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O)c1ccc(F)c(Cl)c1 ZINC000130709334 1416431256 /nfs/dbraw/zinc/43/12/56/1416431256.db2.gz UUVVETSBOILMBH-UHFFFAOYSA-N 0 0 377.715 3.087 20 5 GGBDRN CC(C)c1nc(C[S@@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)no1 ZINC000130713753 1416431863 /nfs/dbraw/zinc/43/18/63/1416431863.db2.gz RWUGQJHSFSFAFV-AREMUKBSSA-N 0 0 376.394 3.205 20 5 GGBDRN Cc1nn(C)c(Cl)c1C[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130715411 1416432544 /nfs/dbraw/zinc/43/25/44/1416432544.db2.gz METWOAUBFCGJHN-AREMUKBSSA-N 0 0 394.840 3.394 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCc2ccccc2[C@@H]1CO ZINC000130721639 1416434199 /nfs/dbraw/zinc/43/41/99/1416434199.db2.gz DWQWWEATEMRJNY-FQEVSTJZSA-N 0 0 383.448 3.219 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(C[S@](=O)Cc3cn4ccccc4n3)co2)cc1 ZINC000130723161 1416434975 /nfs/dbraw/zinc/43/49/75/1416434975.db2.gz GVYOITGGERIQSS-MHZLTWQESA-N 0 0 382.401 3.346 20 5 GGBDRN 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CCn1c2nnc(CSCc3ccc([N+](=O)[O-])cc3)n2c2ccccc2c1=O ZINC000131398471 1416551177 /nfs/dbraw/zinc/55/11/77/1416551177.db2.gz QXDSYSZZPDSQIB-UHFFFAOYSA-N 0 0 395.444 3.406 20 5 GGBDRN O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000131410224 1416553180 /nfs/dbraw/zinc/55/31/80/1416553180.db2.gz WAOGIRBKLMSWSR-LBPRGKRZSA-N 0 0 389.477 3.123 20 5 GGBDRN C[C@H](C(=O)Nc1ccc2c(c1)OCCCO2)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000131415240 1416554089 /nfs/dbraw/zinc/55/40/89/1416554089.db2.gz ABCAQVNNQRGOEN-CQSZACIVSA-N 0 0 397.431 3.141 20 5 GGBDRN Cc1ccc2[nH]c([C@@H]3CCCN3C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)nc2c1 ZINC000131430212 1416556549 /nfs/dbraw/zinc/55/65/49/1416556549.db2.gz MYNUSTJUQRDBJM-KRWDZBQOSA-N 0 0 393.403 3.082 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000131436189 1416557940 /nfs/dbraw/zinc/55/79/40/1416557940.db2.gz SCXFTVADMQRNRP-CYBMUJFWSA-N 0 0 388.399 3.145 20 5 GGBDRN CCCOc1cccc(CNC(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000131445897 1416559059 /nfs/dbraw/zinc/55/90/59/1416559059.db2.gz BMIUJCZPGIYNCH-UHFFFAOYSA-N 0 0 383.448 3.058 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OCC(=O)NCCc1ccc(OC(F)F)cc1 ZINC000131444541 1416559164 /nfs/dbraw/zinc/55/91/64/1416559164.db2.gz QOWVNWXCMHCKMB-UHFFFAOYSA-N 0 0 380.347 3.242 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN(c2ccccc2Cl)C1=O ZINC000131462303 1416561565 /nfs/dbraw/zinc/56/15/65/1416561565.db2.gz CTHGGMICYIOBKX-OAHLLOKOSA-N 0 0 387.823 3.103 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000131468053 1416562387 /nfs/dbraw/zinc/56/23/87/1416562387.db2.gz CACNBCQNHIVHPY-GOSISDBHSA-N 0 0 395.371 3.041 20 5 GGBDRN COc1ccc(C(F)(F)C(=O)Nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000131480338 1416563970 /nfs/dbraw/zinc/56/39/70/1416563970.db2.gz MYZAPLOUZCPCKY-UHFFFAOYSA-N 0 0 389.318 3.119 20 5 GGBDRN Cc1cc(C)cc(CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 ZINC000131484492 1416564827 /nfs/dbraw/zinc/56/48/27/1416564827.db2.gz TYROUOZWBVIDCY-UHFFFAOYSA-N 0 0 383.448 3.021 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)cccc1[N+](=O)[O-] ZINC000131483477 1416564886 /nfs/dbraw/zinc/56/48/86/1416564886.db2.gz JKQMDLKHRDDIPQ-OAHLLOKOSA-N 0 0 387.823 3.482 20 5 GGBDRN C[C@](O)(CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccsc1 ZINC000131505571 1416568409 /nfs/dbraw/zinc/56/84/09/1416568409.db2.gz OBGOFKQATQHEBH-QFIPXVFZSA-N 0 0 392.480 3.240 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCc2nccc(N)n2)cc1[N+](=O)[O-] ZINC000131511739 1416569333 /nfs/dbraw/zinc/56/93/33/1416569333.db2.gz HZOAQLGFICAKQK-UHFFFAOYSA-N 0 0 375.454 3.035 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OCc1nnc(C(=O)NCc2ccccc2)s1 ZINC000131513488 1416569650 /nfs/dbraw/zinc/56/96/50/1416569650.db2.gz KIRWWUFNHXUTCX-UHFFFAOYSA-N 0 0 384.417 3.264 20 5 GGBDRN C[C@@H]1c2cc3c(cc2C2(CCCC2)CN1C(=O)c1n[nH]cc1[N+](=O)[O-])OCCO3 ZINC000131524622 1416571195 /nfs/dbraw/zinc/57/11/95/1416571195.db2.gz QGACKPSBFUWPBD-GFCCVEGCSA-N 0 0 398.419 3.118 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2Cl)C1=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000131525772 1416571325 /nfs/dbraw/zinc/57/13/25/1416571325.db2.gz XHCYTBNISMYWCH-AWEZNQCLSA-N 0 0 391.786 3.313 20 5 GGBDRN C[C@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1ccsc1 ZINC000131529876 1416572039 /nfs/dbraw/zinc/57/20/39/1416572039.db2.gz VADUXTIJUMNXKV-IBGZPJMESA-N 0 0 389.477 3.284 20 5 GGBDRN C[C@](O)(CNC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccc(F)cc1 ZINC000131533506 1416572613 /nfs/dbraw/zinc/57/26/13/1416572613.db2.gz VWDQUJLGWKLKMS-INIZCTEOSA-N 0 0 397.200 3.134 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000131582308 1416579694 /nfs/dbraw/zinc/57/96/94/1416579694.db2.gz IWCLGGXXPKBJAG-HNNXBMFYSA-N 0 0 386.379 3.234 20 5 GGBDRN CC(C)C[C@@H](CO)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000131593960 1416581606 /nfs/dbraw/zinc/58/16/06/1416581606.db2.gz DNNMZISNEWTVJL-ZBFHGGJFSA-N 0 0 386.452 3.300 20 5 GGBDRN CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000131609662 1416583952 /nfs/dbraw/zinc/58/39/52/1416583952.db2.gz USUJEUSPWASNDX-JTQLQIEISA-N 0 0 382.825 3.490 20 5 GGBDRN C[C@@](O)(CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000131618377 1416585275 /nfs/dbraw/zinc/58/52/75/1416585275.db2.gz ZYCDMBXOPTXURO-GOSISDBHSA-N 0 0 396.802 3.180 20 5 GGBDRN COc1ccc(C[C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])c2ccccc2)cc1OC ZINC000131620676 1416585805 /nfs/dbraw/zinc/58/58/05/1416585805.db2.gz LMNCEAMEIGEVLK-OAHLLOKOSA-N 0 0 396.403 3.049 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCC(OC[C@@H]4CCOC4)CC3)co2)cc1 ZINC000131624101 1416586054 /nfs/dbraw/zinc/58/60/54/1416586054.db2.gz FBRCOSXYMLKHJV-OAHLLOKOSA-N 0 0 387.436 3.267 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cc(Cl)ccc1N1CCCCC1 ZINC000178571806 1429110088 /nfs/dbraw/zinc/11/00/88/1429110088.db2.gz QNQPKMPBWNTHBP-UHFFFAOYSA-N 0 0 390.827 3.039 20 5 GGBDRN C[C@](O)(CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccc(F)cc1 ZINC000131639809 1416588665 /nfs/dbraw/zinc/58/86/65/1416588665.db2.gz JIQXFHDONJSPHZ-INIZCTEOSA-N 0 0 386.301 3.390 20 5 GGBDRN C[C@@](O)(CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccc(F)cc1 ZINC000131639599 1416588892 /nfs/dbraw/zinc/58/88/92/1416588892.db2.gz JIQXFHDONJSPHZ-MRXNPFEDSA-N 0 0 386.301 3.390 20 5 GGBDRN Cc1cc(OC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)ccc1F ZINC000131645431 1416589711 /nfs/dbraw/zinc/58/97/11/1416589711.db2.gz HQGLSNVIFNUVFI-ZDUSSCGKSA-N 0 0 378.381 3.314 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000131646617 1416589736 /nfs/dbraw/zinc/58/97/36/1416589736.db2.gz ZIYBFLCIPBGXLC-ZYHUDNBSSA-N 0 0 385.873 3.319 20 5 GGBDRN CN(Cc1ccccc1N1CCCC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000131655972 1416591677 /nfs/dbraw/zinc/59/16/77/1416591677.db2.gz MLJSBWPKBCYFRZ-OAQYLSRUSA-N 0 0 394.475 3.432 20 5 GGBDRN CC(C)CC1(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000131670327 1416594107 /nfs/dbraw/zinc/59/41/07/1416594107.db2.gz UKVMLKXINGEKAT-UHFFFAOYSA-N 0 0 385.367 3.077 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000131676261 1416595084 /nfs/dbraw/zinc/59/50/84/1416595084.db2.gz MFJZBEQMMSWTFX-OAHLLOKOSA-N 0 0 386.379 3.234 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000131686953 1416596943 /nfs/dbraw/zinc/59/69/43/1416596943.db2.gz JPOBRPONTWSQJG-HNGIYASMSA-N 0 0 392.399 3.423 20 5 GGBDRN CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000131686761 1416597320 /nfs/dbraw/zinc/59/73/20/1416597320.db2.gz JPOBRPONTWSQJG-WANDFBQESA-N 0 0 392.399 3.423 20 5 GGBDRN Cc1c(CC(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cccc1[N+](=O)[O-] ZINC000178574994 1429111009 /nfs/dbraw/zinc/11/10/09/1429111009.db2.gz YULSKESAFVICNR-CQSZACIVSA-N 0 0 390.461 3.069 20 5 GGBDRN COc1ccc(C=Cc2nccc(=O)[nH]2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000131727661 1416606079 /nfs/dbraw/zinc/60/60/79/1416606079.db2.gz DXXDMZRMRBDRLA-WEVVVXLNSA-N 0 0 379.372 3.436 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000131741423 1416608291 /nfs/dbraw/zinc/60/82/91/1416608291.db2.gz DUACXNBCXRDKQW-AWEZNQCLSA-N 0 0 396.451 3.197 20 5 GGBDRN Cc1cc(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)c(N)c([N+](=O)[O-])c1 ZINC000131740158 1416608368 /nfs/dbraw/zinc/60/83/68/1416608368.db2.gz MWUHWSXBJSLIOV-CYBMUJFWSA-N 0 0 384.219 3.256 20 5 GGBDRN Cc1cc(C)c(OC(=O)c2cc(S(C)(=O)=O)ccc2Cl)c([N+](=O)[O-])c1 ZINC000131744240 1416609480 /nfs/dbraw/zinc/60/94/80/1416609480.db2.gz GLNIVQAQFRETHU-UHFFFAOYSA-N 0 0 383.809 3.488 20 5 GGBDRN O=C(N[C@@H](CCCO)c1ccccc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000131747223 1416610562 /nfs/dbraw/zinc/61/05/62/1416610562.db2.gz XTOCADNITHWVOL-SFHVURJKSA-N 0 0 380.404 3.024 20 5 GGBDRN COc1cc(CN2CCOC[C@H]2c2cccn2C)c([N+](=O)[O-])cc1OC(F)F ZINC000131754161 1416612362 /nfs/dbraw/zinc/61/23/62/1416612362.db2.gz SERAORHRDYVZKG-HNNXBMFYSA-N 0 0 397.378 3.117 20 5 GGBDRN Cn1c(CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)nc2cc(F)ccc21 ZINC000131752820 1416612422 /nfs/dbraw/zinc/61/24/22/1416612422.db2.gz PXHMLGFJOPPJFK-UHFFFAOYSA-N 0 0 395.394 3.003 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000178580908 1429112767 /nfs/dbraw/zinc/11/27/67/1429112767.db2.gz WXLWDTMPMIEAHA-KKSFZXQISA-N 0 0 385.464 3.016 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1C(=O)N(Cc1ccccc1)C1CC1 ZINC000131787163 1416620373 /nfs/dbraw/zinc/62/03/73/1416620373.db2.gz XOGXFLTXUZMKGP-INIZCTEOSA-N 0 0 399.472 3.452 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1C(=O)N(Cc1ccccc1)C1CC1 ZINC000131787396 1416620701 /nfs/dbraw/zinc/62/07/01/1416620701.db2.gz XOGXFLTXUZMKGP-MRXNPFEDSA-N 0 0 399.472 3.452 20 5 GGBDRN COc1cc(F)c(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1OC ZINC000131795725 1416622517 /nfs/dbraw/zinc/62/25/17/1416622517.db2.gz BGWKUXMPNRVXAL-UHFFFAOYSA-N 0 0 391.399 3.292 20 5 GGBDRN O=C(c1ccc(F)cc1)[C@H]1CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000131798693 1416623214 /nfs/dbraw/zinc/62/32/14/1416623214.db2.gz DZSPANQBLYMLLD-ZDUSSCGKSA-N 0 0 396.378 3.345 20 5 GGBDRN COC(=O)CCC1CCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000131801986 1416624292 /nfs/dbraw/zinc/62/42/92/1416624292.db2.gz OIQVWTCQCLCJNQ-UHFFFAOYSA-N 0 0 388.342 3.419 20 5 GGBDRN Cc1ccc(OC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cc1[N+](=O)[O-] ZINC000131803008 1416625091 /nfs/dbraw/zinc/62/50/91/1416625091.db2.gz OECXJWLIAWZMRU-UHFFFAOYSA-N 0 0 375.768 3.305 20 5 GGBDRN CC(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000131811487 1416626737 /nfs/dbraw/zinc/62/67/37/1416626737.db2.gz VCHAWPKLTOWQHH-UHFFFAOYSA-N 0 0 379.482 3.132 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)c1 ZINC000131824932 1416629777 /nfs/dbraw/zinc/62/97/77/1416629777.db2.gz WZQIQDRREINGOO-CQSZACIVSA-N 0 0 385.203 3.374 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000178580950 1429113727 /nfs/dbraw/zinc/11/37/27/1429113727.db2.gz WXLWDTMPMIEAHA-IIBYNOLFSA-N 0 0 385.464 3.016 20 5 GGBDRN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1nc2ccsc2c(=O)[nH]1 ZINC000131850496 1416634560 /nfs/dbraw/zinc/63/45/60/1416634560.db2.gz CUQNIULQIPWHBB-UHFFFAOYSA-N 0 0 397.416 3.180 20 5 GGBDRN Cc1ccc(OC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000131859857 1416636659 /nfs/dbraw/zinc/63/66/59/1416636659.db2.gz FYXXIJBNXVTISD-HNNXBMFYSA-N 0 0 377.441 3.276 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1c(Cl)cccc1Cl ZINC000131876857 1416639854 /nfs/dbraw/zinc/63/98/54/1416639854.db2.gz YLDGOJCTTADFDB-CQSZACIVSA-N 0 0 385.203 3.130 20 5 GGBDRN Cc1c(CC(=O)N2CCN(c3nc4ccccc4s3)CC2)cccc1[N+](=O)[O-] ZINC000178586497 1429114914 /nfs/dbraw/zinc/11/49/14/1429114914.db2.gz VGAQZRNIDYZJEO-UHFFFAOYSA-N 0 0 396.472 3.404 20 5 GGBDRN CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000178587293 1429114982 /nfs/dbraw/zinc/11/49/82/1429114982.db2.gz VSPQRJRASASJCQ-GOSISDBHSA-N 0 0 387.436 3.177 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)ccc1[N+](=O)[O-] ZINC000131911877 1416649768 /nfs/dbraw/zinc/64/97/68/1416649768.db2.gz CYIGJXHKFZDGTF-CYBMUJFWSA-N 0 0 385.203 3.374 20 5 GGBDRN O=C(Nc1ccnn1C[C@H]1CCOC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000131933827 1416654807 /nfs/dbraw/zinc/65/48/07/1416654807.db2.gz CODPYOHGVBFPEL-SNVBAGLBSA-N 0 0 384.314 3.099 20 5 GGBDRN Cc1ccc(OC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000131986219 1416666536 /nfs/dbraw/zinc/66/65/36/1416666536.db2.gz XFQPDJKTNGQDTP-KRWDZBQOSA-N 0 0 382.416 3.290 20 5 GGBDRN O=C(O[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000132011538 1416672764 /nfs/dbraw/zinc/67/27/64/1416672764.db2.gz AOFZMTRBIOHMMH-FHLIZLRMSA-N 0 0 383.404 3.285 20 5 GGBDRN CC(C)NC(=O)c1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000132026210 1416677048 /nfs/dbraw/zinc/67/70/48/1416677048.db2.gz ZBFUQJILOFSQDX-UHFFFAOYSA-N 0 0 382.420 3.323 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1cccc(OC(F)(F)F)c1 ZINC000178602154 1429118583 /nfs/dbraw/zinc/11/85/83/1429118583.db2.gz JXNHSEACWXWNMS-UHFFFAOYSA-N 0 0 384.310 3.361 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2ccccc2-n2nc(C)cc2C)c1[N+](=O)[O-] ZINC000132050335 1416682836 /nfs/dbraw/zinc/68/28/36/1416682836.db2.gz NVRINAKGFVGMLZ-UHFFFAOYSA-N 0 0 382.424 3.003 20 5 GGBDRN COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NCc1ccc([N+](=O)[O-])cc1 ZINC000132055726 1416683662 /nfs/dbraw/zinc/68/36/62/1416683662.db2.gz AYSOONNRVMXPAI-UHFFFAOYSA-N 0 0 393.465 3.292 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000132059103 1416684994 /nfs/dbraw/zinc/68/49/94/1416684994.db2.gz LJJWMBBNJYXOCH-UHFFFAOYSA-N 0 0 382.420 3.190 20 5 GGBDRN CC(C)(C)c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n(-c2ncccn2)n1 ZINC000132064960 1416686373 /nfs/dbraw/zinc/68/63/73/1416686373.db2.gz WMAPCLSYQZWMMH-UHFFFAOYSA-N 0 0 394.435 3.439 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)ccc1[N+](=O)[O-] ZINC000132076126 1416689463 /nfs/dbraw/zinc/68/94/63/1416689463.db2.gz DCRKAFGPOWWDJO-UHFFFAOYSA-N 0 0 396.403 3.385 20 5 GGBDRN Cc1c(CC(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000132099880 1416695532 /nfs/dbraw/zinc/69/55/32/1416695532.db2.gz SWKPTQGMHZHUMZ-INIZCTEOSA-N 0 0 398.337 3.194 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2I)C[C@H]1C ZINC000132104016 1416696808 /nfs/dbraw/zinc/69/68/08/1416696808.db2.gz KIJDLLGAYNNPII-VHSXEESVSA-N 0 0 388.205 3.318 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@H](Oc2ccncc2)C1 ZINC000132110574 1416698442 /nfs/dbraw/zinc/69/84/42/1416698442.db2.gz ACXLJGBTLKIIOH-HNNXBMFYSA-N 0 0 381.310 3.302 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2csc(-c3ccco3)n2)cc([N+](=O)[O-])c1 ZINC000132131362 1416703573 /nfs/dbraw/zinc/70/35/73/1416703573.db2.gz DCIIPYUPKABDKE-UHFFFAOYSA-N 0 0 387.373 3.028 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1Cl ZINC000132138938 1416705972 /nfs/dbraw/zinc/70/59/72/1416705972.db2.gz KUZFBAIHHVOVFQ-UHFFFAOYSA-N 0 0 388.811 3.198 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](c2cccc(F)c2)c2ccccn2)cc1 ZINC000132139970 1416706389 /nfs/dbraw/zinc/70/63/89/1416706389.db2.gz QHQRWKCOQODAIH-GOSISDBHSA-N 0 0 387.392 3.197 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1F ZINC000132177532 1416712327 /nfs/dbraw/zinc/71/23/27/1416712327.db2.gz HSYNZOPPNPJVMF-QGZVFWFLSA-N 0 0 389.358 3.030 20 5 GGBDRN O=C(COC(=O)c1cnc(Cc2ccccc2)s1)Nc1cccc([N+](=O)[O-])c1 ZINC000132223324 1416719735 /nfs/dbraw/zinc/71/97/35/1416719735.db2.gz IZHPEADCLYOSKF-UHFFFAOYSA-N 0 0 397.412 3.438 20 5 GGBDRN Cc1nc(CC(C)C)c(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)s1 ZINC000132223753 1416719897 /nfs/dbraw/zinc/71/98/97/1416719897.db2.gz OUPHPGKRCAIHHQ-UHFFFAOYSA-N 0 0 377.422 3.354 20 5 GGBDRN CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000132226856 1416720302 /nfs/dbraw/zinc/72/03/02/1416720302.db2.gz IZWNWFSAIPEMQT-CQSZACIVSA-N 0 0 385.420 3.335 20 5 GGBDRN O=C(N[C@H]1CCN(C(=O)C2CCCC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000132254592 1416724813 /nfs/dbraw/zinc/72/48/13/1416724813.db2.gz PANRYHMLPFBKMX-AWEZNQCLSA-N 0 0 399.369 3.135 20 5 GGBDRN O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)c1n[nH]cc1[N+](=O)[O-] ZINC000132262302 1416725685 /nfs/dbraw/zinc/72/56/85/1416725685.db2.gz WMSCKTBSFIOSRF-UHFFFAOYSA-N 0 0 381.320 3.295 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N1CCC(Cc2ccccc2)CC1 ZINC000132271116 1416727079 /nfs/dbraw/zinc/72/70/79/1416727079.db2.gz DZDWPVPMWUJKHD-UHFFFAOYSA-N 0 0 384.432 3.464 20 5 GGBDRN CCC(=O)c1cccc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c1 ZINC000132275640 1416727433 /nfs/dbraw/zinc/72/74/33/1416727433.db2.gz DCSCCOTUOJRPKO-CYBMUJFWSA-N 0 0 399.378 3.318 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc([N+](=O)[O-])c1F ZINC000132281802 1416728625 /nfs/dbraw/zinc/72/86/25/1416728625.db2.gz WRPSRJIPLLVICI-UHFFFAOYSA-N 0 0 393.396 3.118 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(-c2cnco2)c1 ZINC000132291622 1416730315 /nfs/dbraw/zinc/73/03/15/1416730315.db2.gz GSXLGJQDTQXIBF-UHFFFAOYSA-N 0 0 377.353 3.498 20 5 GGBDRN CCC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 ZINC000132293648 1416730890 /nfs/dbraw/zinc/73/08/90/1416730890.db2.gz DHOFPSWECRODRE-UHFFFAOYSA-N 0 0 383.404 3.276 20 5 GGBDRN CCOCc1ccccc1CNS(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC000132303066 1416731560 /nfs/dbraw/zinc/73/15/60/1416731560.db2.gz CDXILTKEIMHZMF-UHFFFAOYSA-N 0 0 382.413 3.057 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)cc1 ZINC000132309456 1416733074 /nfs/dbraw/zinc/73/30/74/1416733074.db2.gz GYORGGREYGWOEG-UHFFFAOYSA-N 0 0 394.424 3.404 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(NC(=O)C(C)C)c1 ZINC000132327823 1416737238 /nfs/dbraw/zinc/73/72/38/1416737238.db2.gz OPCWDNMUBZSQJK-UHFFFAOYSA-N 0 0 395.412 3.438 20 5 GGBDRN CC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000132333463 1416738955 /nfs/dbraw/zinc/73/89/55/1416738955.db2.gz GRQYIQGYESMTTL-CYBMUJFWSA-N 0 0 383.404 3.230 20 5 GGBDRN CN(c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2[O-])cc1)C1CC[NH+](C)CC1 ZINC000132339094 1416740521 /nfs/dbraw/zinc/74/05/21/1416740521.db2.gz CXNJYAOJSDLDNJ-UHFFFAOYSA-N 0 0 384.436 3.083 20 5 GGBDRN Cc1cccc(C(C)C)c1NC(=O)Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1 ZINC000132352524 1416742773 /nfs/dbraw/zinc/74/27/73/1416742773.db2.gz GQBAYPKQMPHERZ-UHFFFAOYSA-N 0 0 396.403 3.482 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000132358387 1416744328 /nfs/dbraw/zinc/74/43/28/1416744328.db2.gz TWYHOZPXLAFJPT-UHFFFAOYSA-N 0 0 393.396 3.192 20 5 GGBDRN Cc1ccc(Cn2cccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)c2=O)cc1 ZINC000132363501 1416745331 /nfs/dbraw/zinc/74/53/31/1416745331.db2.gz RPQOHEZCUSKPLO-UHFFFAOYSA-N 0 0 392.415 3.256 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000132370432 1416747218 /nfs/dbraw/zinc/74/72/18/1416747218.db2.gz RNLAPMUEUJWJEV-UHFFFAOYSA-N 0 0 386.427 3.199 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000132381990 1416749406 /nfs/dbraw/zinc/74/94/06/1416749406.db2.gz XIRMINMVJMBBAB-UHFFFAOYSA-N 0 0 376.800 3.272 20 5 GGBDRN COc1ccc(C(C)(C)C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000132381605 1416749660 /nfs/dbraw/zinc/74/96/60/1416749660.db2.gz VSEWHMYOSQONSG-UHFFFAOYSA-N 0 0 387.436 3.118 20 5 GGBDRN COc1ccc(CN(Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)C2CC2)cc1 ZINC000132385868 1416750025 /nfs/dbraw/zinc/75/00/25/1416750025.db2.gz RAMDSRSQQFSOFR-UHFFFAOYSA-N 0 0 396.403 3.042 20 5 GGBDRN O=C(c1c[nH]nc1-c1c(F)cccc1F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000132388667 1416750542 /nfs/dbraw/zinc/75/05/42/1416750542.db2.gz UQEPFWWNYQRDLJ-UHFFFAOYSA-N 0 0 384.342 3.462 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)Oc3cc(F)ccc32)cc([N+](=O)[O-])c1F ZINC000132400022 1416752483 /nfs/dbraw/zinc/75/24/83/1416752483.db2.gz FLBGQUMSYVCUIA-SNVBAGLBSA-N 0 0 384.360 3.158 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000132408797 1416754553 /nfs/dbraw/zinc/75/45/53/1416754553.db2.gz ZUJOXRYFFBFSDG-CYBMUJFWSA-N 0 0 391.449 3.232 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000132440412 1416760736 /nfs/dbraw/zinc/76/07/36/1416760736.db2.gz WABOILLIJJOZFB-ZDUSSCGKSA-N 0 0 391.449 3.232 20 5 GGBDRN Cc1ccc2c(c1)N(S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1)C[C@@H](C)O2 ZINC000132445098 1416761378 /nfs/dbraw/zinc/76/13/78/1416761378.db2.gz QEPFWCZQRFFJRZ-GFCCVEGCSA-N 0 0 380.397 3.327 20 5 GGBDRN O=C(N[C@@H]1C[C@H]1c1cccc(Cl)c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000132453136 1416763867 /nfs/dbraw/zinc/76/38/67/1416763867.db2.gz HFGYAARKSHCWJS-JKSUJKDBSA-N 0 0 383.795 3.115 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC000132485727 1416771327 /nfs/dbraw/zinc/77/13/27/1416771327.db2.gz TXQCJEQPHMAMFR-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CNC1(c2nccs2)CCCC1 ZINC000132487887 1416771947 /nfs/dbraw/zinc/77/19/47/1416771947.db2.gz ZIBYIOQANBRMDX-UHFFFAOYSA-N 0 0 397.460 3.292 20 5 GGBDRN CCS(=O)(=O)c1ccc(Cl)c(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000132493115 1416772721 /nfs/dbraw/zinc/77/27/21/1416772721.db2.gz LAJGQXGMHDMYAJ-UHFFFAOYSA-N 0 0 387.772 3.400 20 5 GGBDRN CC(C)Oc1ccc(C(=O)Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)cc1 ZINC000132502688 1416774542 /nfs/dbraw/zinc/77/45/42/1416774542.db2.gz PVKVHQNILFUOQV-UHFFFAOYSA-N 0 0 395.209 3.189 20 5 GGBDRN O=[N+]([O-])c1ccccc1OS(=O)(=O)c1ccc(Br)cc1F ZINC000132505505 1416774777 /nfs/dbraw/zinc/77/47/77/1416774777.db2.gz BCVJLDSGFNELCF-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN O=C(NCc1ccc(N2CCCC2)nc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000132516880 1416776628 /nfs/dbraw/zinc/77/66/28/1416776628.db2.gz MNUMSQCAOZXXBX-UHFFFAOYSA-N 0 0 395.463 3.464 20 5 GGBDRN Cc1ccc(-n2cnnc2SCC(=O)Oc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000132524549 1416777809 /nfs/dbraw/zinc/77/78/09/1416777809.db2.gz FBPYSFZGJNNMOB-UHFFFAOYSA-N 0 0 388.380 3.321 20 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ZINC000132603073 1416791956 /nfs/dbraw/zinc/79/19/56/1416791956.db2.gz YKMNSJFTNLCIAU-UHFFFAOYSA-N 0 0 390.411 3.362 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCN(C(=O)Oc2ccccc2)CC1 ZINC000132639214 1416798000 /nfs/dbraw/zinc/79/80/00/1416798000.db2.gz MUUFYOOIGBYTNI-UHFFFAOYSA-N 0 0 397.431 3.261 20 5 GGBDRN Cc1ccccc1[C@@H](O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000132645008 1416798948 /nfs/dbraw/zinc/79/89/48/1416798948.db2.gz RQJBEBHEIBRVBJ-INIZCTEOSA-N 0 0 393.237 3.058 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C12CCC2 ZINC000132648282 1416799570 /nfs/dbraw/zinc/79/95/70/1416799570.db2.gz ZACKMCBDPNVLTO-ZWKOTPCHSA-N 0 0 384.436 3.200 20 5 GGBDRN O=C(Oc1cc(F)cc([N+](=O)[O-])c1)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1 ZINC000132647929 1416799711 /nfs/dbraw/zinc/79/97/11/1416799711.db2.gz YLRQUSTUHYLWJE-ZDUSSCGKSA-N 0 0 390.342 3.331 20 5 GGBDRN CC(C)(C)NC(=O)c1cccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000132662863 1416801096 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CC(C)OC(=O)C[C@@H](NC(=O)c1ccc2c(c1)CCN2)c1ccccc1[N+](=O)[O-] ZINC000132746291 1416810416 /nfs/dbraw/zinc/81/04/16/1416810416.db2.gz UPSFKYSGBNITOV-GOSISDBHSA-N 0 0 397.431 3.376 20 5 GGBDRN CC(C)(C)CNC(=O)C(C)(C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178660525 1429130967 /nfs/dbraw/zinc/13/09/67/1429130967.db2.gz ZUDOKNFRKABROW-UHFFFAOYSA-N 0 0 377.466 3.480 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1 ZINC000132813688 1416818341 /nfs/dbraw/zinc/81/83/41/1416818341.db2.gz ZYABDXZHKZMHRG-LBPRGKRZSA-N 0 0 387.392 3.429 20 5 GGBDRN Cn1cc(CNc2ccc3c(c2)NC(=O)CC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000132835789 1416821212 /nfs/dbraw/zinc/82/12/12/1416821212.db2.gz JBXIDYRKQZIART-UHFFFAOYSA-N 0 0 377.404 3.492 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000132838259 1416821607 /nfs/dbraw/zinc/82/16/07/1416821607.db2.gz HDLDRGZKAPZTQC-PKOBYXMFSA-N 0 0 384.436 3.226 20 5 GGBDRN COc1ccc(OCCn2cnc3sc(C)c(C)c3c2=O)c([N+](=O)[O-])c1 ZINC000132841895 1416821825 /nfs/dbraw/zinc/82/18/25/1416821825.db2.gz KMZKBZBBADWRLB-UHFFFAOYSA-N 0 0 375.406 3.071 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000132859819 1416824167 /nfs/dbraw/zinc/82/41/67/1416824167.db2.gz PJDWFRPQVDWPFV-BBRMVZONSA-N 0 0 377.466 3.477 20 5 GGBDRN CNC(=O)c1cc(OC)ccc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000132877617 1416826081 /nfs/dbraw/zinc/82/60/81/1416826081.db2.gz FWLNTNPRRUXKAJ-UHFFFAOYSA-N 0 0 397.309 3.234 20 5 GGBDRN CC[C@](C)(COc1ncccc1Cl)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000132887254 1416827191 /nfs/dbraw/zinc/82/71/91/1416827191.db2.gz YSSLPNRPVRMJQI-GOSISDBHSA-N 0 0 393.827 3.386 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cccc(N(C)C)c1 ZINC000132903245 1416829222 /nfs/dbraw/zinc/82/92/22/1416829222.db2.gz HPUKFGIURWRDJN-LBPRGKRZSA-N 0 0 377.828 3.398 20 5 GGBDRN Nn1c(SCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)nnc1-c1ccco1 ZINC000132912938 1416830133 /nfs/dbraw/zinc/83/01/33/1416830133.db2.gz JOQOHSJJXIXFNA-UHFFFAOYSA-N 0 0 384.377 3.107 20 5 GGBDRN CS(=O)(=O)Cc1ccccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000132955594 1416835634 /nfs/dbraw/zinc/83/56/34/1416835634.db2.gz QHZUTPDHQALNPV-UHFFFAOYSA-N 0 0 387.417 3.407 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)nc1)c1ccc([N+](=O)[O-])cc1Br ZINC000132985535 1416839053 /nfs/dbraw/zinc/83/90/53/1416839053.db2.gz JJXLWMMMSJXBGS-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc2ccccc2[nH]1 ZINC000132990196 1416839346 /nfs/dbraw/zinc/83/93/46/1416839346.db2.gz IAYBYKLNXIISIO-UHFFFAOYSA-N 0 0 386.433 3.140 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133017116 1416842586 /nfs/dbraw/zinc/84/25/86/1416842586.db2.gz UAGLLUHTWWNGBU-KRWDZBQOSA-N 0 0 396.403 3.215 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)OCCCc2nc3ncccn3n2)cc1[N+](=O)[O-] ZINC000133031328 1416843996 /nfs/dbraw/zinc/84/39/96/1416843996.db2.gz XNLWLMYEOFHCEE-UHFFFAOYSA-N 0 0 383.408 3.120 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN(CCc1ccccc1)c1ccc(O)cc1 ZINC000133035843 1416844450 /nfs/dbraw/zinc/84/44/50/1416844450.db2.gz HDMTVXBQIHQDKC-UHFFFAOYSA-N 0 0 379.416 3.211 20 5 GGBDRN CN1CC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(F)c(F)c1 ZINC000133087985 1416850385 /nfs/dbraw/zinc/85/03/85/1416850385.db2.gz NMGZSTHJYLBWRO-HKUYNNGSSA-N 0 0 393.365 3.116 20 5 GGBDRN C[C@H](CO[C@@H]1CCOC1)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000133088937 1416850577 /nfs/dbraw/zinc/85/05/77/1416850577.db2.gz SLPJSHAYPIVULT-CRAIPNDOSA-N 0 0 399.447 3.131 20 5 GGBDRN C[C@@H](CO[C@H]1CCOC1)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000133089138 1416850662 /nfs/dbraw/zinc/85/06/62/1416850662.db2.gz SLPJSHAYPIVULT-YJBOKZPZSA-N 0 0 399.447 3.131 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000133099200 1416851907 /nfs/dbraw/zinc/85/19/07/1416851907.db2.gz KWQYQBKMZKXJDE-UHFFFAOYSA-N 0 0 380.404 3.493 20 5 GGBDRN COc1ccc(OCCSc2nnc(-c3ccco3)n2C)c([N+](=O)[O-])c1 ZINC000133107200 1416852545 /nfs/dbraw/zinc/85/25/45/1416852545.db2.gz RHCKIOWHHZJKLX-UHFFFAOYSA-N 0 0 376.394 3.163 20 5 GGBDRN O=C(CCNC(=O)c1ccc2ccccc2c1)NCCc1cccc([N+](=O)[O-])c1 ZINC000133106359 1416852742 /nfs/dbraw/zinc/85/27/42/1416852742.db2.gz KDFFAHZBHJDHIL-UHFFFAOYSA-N 0 0 391.427 3.227 20 5 GGBDRN C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])c1nc(-c2ccccc2)no1 ZINC000133109373 1416852888 /nfs/dbraw/zinc/85/28/88/1416852888.db2.gz JAUAPSUQOVYNCT-CYBMUJFWSA-N 0 0 381.392 3.248 20 5 GGBDRN CC(C)[C@@H](O)CCNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000133127479 1416854744 /nfs/dbraw/zinc/85/47/44/1416854744.db2.gz OSNLQGQEUZWYAF-LIRRHRJNSA-N 0 0 386.452 3.300 20 5 GGBDRN CCOC(=O)c1ccnc(NCCCn2c(C)nc3ccccc32)c1[N+](=O)[O-] ZINC000133149857 1416857502 /nfs/dbraw/zinc/85/75/02/1416857502.db2.gz NZGPTIRZUAPIBR-UHFFFAOYSA-N 0 0 383.408 3.327 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(C[C@H](O)c3cccc(Br)c3)n2)cc1 ZINC000133157902 1416858890 /nfs/dbraw/zinc/85/88/90/1416858890.db2.gz KYNFZGPXPGRSBS-HNNXBMFYSA-N 0 0 389.209 3.349 20 5 GGBDRN NC(=O)C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCCCC1 ZINC000133195238 1416862838 /nfs/dbraw/zinc/86/28/38/1416862838.db2.gz LTTRBVARRFLZDJ-AWEZNQCLSA-N 0 0 387.358 3.168 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1CN1CCSC[C@@H]1c1ccccc1 ZINC000133199584 1416863540 /nfs/dbraw/zinc/86/35/40/1416863540.db2.gz ZACLRGPKCAFJLJ-QGZVFWFLSA-N 0 0 398.444 3.159 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1CN1CCSC[C@H]1c1ccccc1 ZINC000133199376 1416863574 /nfs/dbraw/zinc/86/35/74/1416863574.db2.gz ZACLRGPKCAFJLJ-KRWDZBQOSA-N 0 0 398.444 3.159 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](c2nccn2C)c2cccc(F)c2)c1[N+](=O)[O-] ZINC000133207952 1416864836 /nfs/dbraw/zinc/86/48/36/1416864836.db2.gz OBBXOTFMJMCPAO-HNNXBMFYSA-N 0 0 399.382 3.241 20 5 GGBDRN COc1ccc(CCCN(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000133215155 1416865351 /nfs/dbraw/zinc/86/53/51/1416865351.db2.gz DSTGBIBUVOELLX-UHFFFAOYSA-N 0 0 394.431 3.494 20 5 GGBDRN Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCCc3cccc([N+](=O)[O-])c3)c12 ZINC000133241302 1416869313 /nfs/dbraw/zinc/86/93/13/1416869313.db2.gz RXWIPBOXSSQHRT-UHFFFAOYSA-N 0 0 379.420 3.035 20 5 GGBDRN CCOC(=O)c1ccnc(NCCc2cnn(-c3ccccc3)c2)c1[N+](=O)[O-] ZINC000133260724 1416871684 /nfs/dbraw/zinc/87/16/84/1416871684.db2.gz SYCYZIDGFLKARD-UHFFFAOYSA-N 0 0 381.392 3.007 20 5 GGBDRN COc1cc(OC)c(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1F ZINC000133265104 1416872082 /nfs/dbraw/zinc/87/20/82/1416872082.db2.gz BISKCIYNDHNCPD-NSHDSACASA-N 0 0 377.372 3.499 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 ZINC000133276760 1416873368 /nfs/dbraw/zinc/87/33/68/1416873368.db2.gz BHQAZBINMZTHAR-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(-c3cnco3)cc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000133290384 1416874821 /nfs/dbraw/zinc/87/48/21/1416874821.db2.gz AEINASOFEFKSOI-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2cccc(Cn3ccnc3)c2)c1[N+](=O)[O-] ZINC000133327258 1416878774 /nfs/dbraw/zinc/87/87/74/1416878774.db2.gz PNGLJAZTYVLAOA-UHFFFAOYSA-N 0 0 381.392 3.023 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1cnn2c1nccc2-c1ccccc1 ZINC000133336658 1416880151 /nfs/dbraw/zinc/88/01/51/1416880151.db2.gz URFSICJUUOQVJA-UHFFFAOYSA-N 0 0 387.399 3.277 20 5 GGBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000133336406 1416880212 /nfs/dbraw/zinc/88/02/12/1416880212.db2.gz QFESKCLIRDBIKS-HNNXBMFYSA-N 0 0 379.756 3.274 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000133350004 1416881198 /nfs/dbraw/zinc/88/11/98/1416881198.db2.gz KMSMQLLXIVLFMQ-UHFFFAOYSA-N 0 0 381.385 3.138 20 5 GGBDRN Cc1ccc(OCCNC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000133385013 1416884823 /nfs/dbraw/zinc/88/48/23/1416884823.db2.gz QBTUHDFKTQZSNJ-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133385438 1416885027 /nfs/dbraw/zinc/88/50/27/1416885027.db2.gz SVXOUAZWWSFJDS-KSSFIOAISA-N 0 0 380.404 3.247 20 5 GGBDRN Cc1nncn1-c1cccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000133398519 1416886067 /nfs/dbraw/zinc/88/60/67/1416886067.db2.gz BATUKDPWNQUZEP-UHFFFAOYSA-N 0 0 376.376 3.146 20 5 GGBDRN CCc1ccc([C@@H](COC)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)o1 ZINC000133398538 1416886078 /nfs/dbraw/zinc/88/60/78/1416886078.db2.gz IQRDIDLGBVNZMI-MRXNPFEDSA-N 0 0 387.436 3.468 20 5 GGBDRN CCc1ccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000133399723 1416886188 /nfs/dbraw/zinc/88/61/88/1416886188.db2.gz PARNDKXSMXMVAI-UHFFFAOYSA-N 0 0 382.420 3.147 20 5 GGBDRN CC[C@H](COC)NC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC000133401079 1416886417 /nfs/dbraw/zinc/88/64/17/1416886417.db2.gz ABPMKEXJSXOCKI-OAHLLOKOSA-N 0 0 399.447 3.047 20 5 GGBDRN CC[C@@H](COC)NC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC000133400862 1416886524 /nfs/dbraw/zinc/88/65/24/1416886524.db2.gz ABPMKEXJSXOCKI-HNNXBMFYSA-N 0 0 399.447 3.047 20 5 GGBDRN CCC[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000133422415 1416888398 /nfs/dbraw/zinc/88/83/98/1416888398.db2.gz DTYYJNYEPDQKMB-OAHLLOKOSA-N 0 0 382.424 3.097 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000178682973 1429140244 /nfs/dbraw/zinc/14/02/44/1429140244.db2.gz NQTFIVSCTZQGCX-KRWDZBQOSA-N 0 0 397.475 3.360 20 5 GGBDRN CCc1cccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000133447483 1416890939 /nfs/dbraw/zinc/89/09/39/1416890939.db2.gz IEFFTPSPTPSALD-UHFFFAOYSA-N 0 0 382.420 3.147 20 5 GGBDRN Cc1nc(N(C)C[C@@H](O)COc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000133457751 1416891584 /nfs/dbraw/zinc/89/15/84/1416891584.db2.gz OXTWZDXTQXMONG-CYBMUJFWSA-N 0 0 385.342 3.193 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2ccc(-n3ccnc3)c(F)c2)c1[N+](=O)[O-] ZINC000133460428 1416891871 /nfs/dbraw/zinc/89/18/71/1416891871.db2.gz BQKACTSAANBQHD-UHFFFAOYSA-N 0 0 385.355 3.103 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCCc2cc(F)cc(F)c21 ZINC000133474860 1416893623 /nfs/dbraw/zinc/89/36/23/1416893623.db2.gz XXWGHEQQTXZNRE-UHFFFAOYSA-N 0 0 382.388 3.198 20 5 GGBDRN CCC[C@H](NC(=O)c1ccc(OCC)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000133490606 1416895116 /nfs/dbraw/zinc/89/51/16/1416895116.db2.gz QDWWZCQMRCRCHD-AWEZNQCLSA-N 0 0 383.408 3.307 20 5 GGBDRN CCc1ccc([C@H](COC)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000133498930 1416895924 /nfs/dbraw/zinc/89/59/24/1416895924.db2.gz DYSYYEFRWXZKSF-KRWDZBQOSA-N 0 0 384.392 3.053 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccc1C(=O)N(C)C ZINC000133513277 1416897142 /nfs/dbraw/zinc/89/71/42/1416897142.db2.gz XYVWBEZSAGGEQI-UHFFFAOYSA-N 0 0 382.420 3.432 20 5 GGBDRN O=C(NC[C@@H]1CCC[C@@H](O)C1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000133513599 1416897236 /nfs/dbraw/zinc/89/72/36/1416897236.db2.gz NQIQIOVBIRTBRL-PSASIEDQSA-N 0 0 391.649 3.292 20 5 GGBDRN O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000133529144 1416898525 /nfs/dbraw/zinc/89/85/25/1416898525.db2.gz PYZFUOSIYIREOS-UHFFFAOYSA-N 0 0 399.794 3.269 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)ccc1C(=O)N(C)C ZINC000133543689 1416900146 /nfs/dbraw/zinc/90/01/46/1416900146.db2.gz XGUATXUVMWIVMK-UHFFFAOYSA-N 0 0 386.364 3.074 20 5 GGBDRN Cc1nc(N(C)C[C@H](O)COc2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000133551546 1416902460 /nfs/dbraw/zinc/90/24/60/1416902460.db2.gz WWBOXOYEVGDWNK-LBPRGKRZSA-N 0 0 385.342 3.193 20 5 GGBDRN CCC[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000133564058 1416905197 /nfs/dbraw/zinc/90/51/97/1416905197.db2.gz CQGSZVZUCTVBDQ-MRXNPFEDSA-N 0 0 394.435 3.483 20 5 GGBDRN C[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccccc2)no1 ZINC000133571966 1416907206 /nfs/dbraw/zinc/90/72/06/1416907206.db2.gz LDAIBNKYKDTOPF-CQSZACIVSA-N 0 0 395.419 3.290 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000133576463 1416909303 /nfs/dbraw/zinc/90/93/03/1416909303.db2.gz FIEBBXLPYNGZBT-UHFFFAOYSA-N 0 0 379.420 3.364 20 5 GGBDRN Cc1nc(NC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000133615593 1416920734 /nfs/dbraw/zinc/92/07/34/1416920734.db2.gz RAARVBHZRKWSPF-SUMWQHHRSA-N 0 0 388.811 3.110 20 5 GGBDRN Cc1nc(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000133615810 1416921113 /nfs/dbraw/zinc/92/11/13/1416921113.db2.gz RAARVBHZRKWSPF-DYVFJYSZSA-N 0 0 388.811 3.110 20 5 GGBDRN CCOCCC1(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCCC1 ZINC000133646333 1416929584 /nfs/dbraw/zinc/92/95/84/1416929584.db2.gz IWCPXOJQHBOAAI-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)o1 ZINC000133643432 1416929921 /nfs/dbraw/zinc/92/99/21/1416929921.db2.gz IBEYDKDFXWAKDC-MRXNPFEDSA-N 0 0 389.364 3.181 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1cccc(Cn2ccnc2)c1 ZINC000133704015 1416946746 /nfs/dbraw/zinc/94/67/46/1416946746.db2.gz XTLGVUJPZSSDSZ-UHFFFAOYSA-N 0 0 389.415 3.180 20 5 GGBDRN COc1ccccc1-c1noc([C@@H](C)NC(=O)c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000133704637 1416947580 /nfs/dbraw/zinc/94/75/80/1416947580.db2.gz KXDXSPAYIQDHNM-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000133715533 1416949544 /nfs/dbraw/zinc/94/95/44/1416949544.db2.gz RYJJWGLOTFSPRX-UHFFFAOYSA-N 0 0 391.374 3.237 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1C(=O)OCc1ccccc1 ZINC000133730681 1416952844 /nfs/dbraw/zinc/95/28/44/1416952844.db2.gz XKEYEMUOJDRFCF-SFHVURJKSA-N 0 0 383.404 3.012 20 5 GGBDRN Cc1ccc(OC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)c([N+](=O)[O-])c1 ZINC000133738227 1416953983 /nfs/dbraw/zinc/95/39/83/1416953983.db2.gz WCPMSTZYBNGHJD-UHFFFAOYSA-N 0 0 393.281 3.117 20 5 GGBDRN C[C@H](CO[C@H]1CCOC1)Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000133752906 1416956621 /nfs/dbraw/zinc/95/66/21/1416956621.db2.gz GFOPHQDNKAJNNT-SCZZXKLOSA-N 0 0 379.291 3.128 20 5 GGBDRN COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)[C@H](C)C2)cc1 ZINC000133766486 1416959875 /nfs/dbraw/zinc/95/98/75/1416959875.db2.gz DQOZVIBODHRWFX-OAHLLOKOSA-N 0 0 397.431 3.041 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2CCC[C@](C)(O)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000133773174 1416960640 /nfs/dbraw/zinc/96/06/40/1416960640.db2.gz UXNDBGXJBKLNSK-VLIAUNLRSA-N 0 0 384.436 3.150 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CCC[C@](C)(O)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000133772986 1416960824 /nfs/dbraw/zinc/96/08/24/1416960824.db2.gz UXNDBGXJBKLNSK-XOBRGWDASA-N 0 0 384.436 3.150 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000133775746 1416961146 /nfs/dbraw/zinc/96/11/46/1416961146.db2.gz JCAHYTPRXMWTTC-KGLIPLIRSA-N 0 0 377.441 3.360 20 5 GGBDRN Cn1c(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)nc2ccccc21 ZINC000133775877 1416961399 /nfs/dbraw/zinc/96/13/99/1416961399.db2.gz TUNFIEJASGULSF-UHFFFAOYSA-N 0 0 389.209 3.174 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000178685486 1429140916 /nfs/dbraw/zinc/14/09/16/1429140916.db2.gz FVEKFYZPHKAFAC-OAHLLOKOSA-N 0 0 391.468 3.161 20 5 GGBDRN CSC[C@@H](CCO)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000133789919 1416964016 /nfs/dbraw/zinc/96/40/16/1416964016.db2.gz XIQAPLPSMPCEJI-MRXNPFEDSA-N 0 0 389.477 3.051 20 5 GGBDRN CSC[C@H](CCO)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000133790110 1416964251 /nfs/dbraw/zinc/96/42/51/1416964251.db2.gz XIQAPLPSMPCEJI-INIZCTEOSA-N 0 0 389.477 3.051 20 5 GGBDRN Cc1csc(N2CCN(Cc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000133811783 1416968172 /nfs/dbraw/zinc/96/81/72/1416968172.db2.gz CRVVQQXWNFLSCE-UHFFFAOYSA-N 0 0 398.492 3.082 20 5 GGBDRN Cc1nc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1[N+](=O)[O-] ZINC000133822533 1416970562 /nfs/dbraw/zinc/97/05/62/1416970562.db2.gz HNHLOAOVMHRVTQ-VIFPVBQESA-N 0 0 380.744 3.266 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)o1 ZINC000133831387 1416972081 /nfs/dbraw/zinc/97/20/81/1416972081.db2.gz JBGHOLFJNTVAPU-MRXNPFEDSA-N 0 0 389.364 3.181 20 5 GGBDRN Cc1nc(NC(=O)Cc2csc(NC(=O)c3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000133837236 1416973457 /nfs/dbraw/zinc/97/34/57/1416973457.db2.gz RVOBUUOJZSOOIN-UHFFFAOYSA-N 0 0 397.416 3.188 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000133848168 1416977317 /nfs/dbraw/zinc/97/73/17/1416977317.db2.gz JRTSCRNQSZZAAS-GOSISDBHSA-N 0 0 396.403 3.150 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000133847981 1416977726 /nfs/dbraw/zinc/97/77/26/1416977726.db2.gz JRTSCRNQSZZAAS-SFHVURJKSA-N 0 0 396.403 3.150 20 5 GGBDRN O=c1oc(-c2ccc(F)cc2)nn1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000133852402 1416978702 /nfs/dbraw/zinc/97/87/02/1416978702.db2.gz WBJZSZWINOUKPX-UHFFFAOYSA-N 0 0 382.307 3.254 20 5 GGBDRN COc1cc(CN2CCc3ccccc3[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000133875530 1416985266 /nfs/dbraw/zinc/98/52/66/1416985266.db2.gz XJGFEDVBUSFVRY-INIZCTEOSA-N 0 0 394.374 3.297 20 5 GGBDRN CN(C)c1nc2cc(NC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)ccc2o1 ZINC000133877046 1416985557 /nfs/dbraw/zinc/98/55/57/1416985557.db2.gz QFFKUCPTKGQEDY-UHFFFAOYSA-N 0 0 392.375 3.240 20 5 GGBDRN Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000133897434 1416990957 /nfs/dbraw/zinc/99/09/57/1416990957.db2.gz OHGHLVSIQXUEFE-UHFFFAOYSA-N 0 0 383.383 3.421 20 5 GGBDRN C[NH+](C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc([N+](=O)[O-])cc1[O-] ZINC000133920432 1416995269 /nfs/dbraw/zinc/99/52/69/1416995269.db2.gz ROSNRQBNDJQOSY-UHFFFAOYSA-N 0 0 377.828 3.158 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@@](C)(O)C3)cc2[N+](=O)[O-])C1 ZINC000133923475 1416995474 /nfs/dbraw/zinc/99/54/74/1416995474.db2.gz HCQMOPOPTPJPKP-STXHMFSFSA-N 0 0 375.469 3.064 20 5 GGBDRN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1N1CCCS1(=O)=O ZINC000133933449 1416997977 /nfs/dbraw/zinc/99/79/77/1416997977.db2.gz WKGUHEFUVKLHHZ-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCO[C@H](c2ccccc2F)C1 ZINC000133960032 1417001740 /nfs/dbraw/zinc/00/17/40/1417001740.db2.gz ADGVOLARWHAEIB-SFHVURJKSA-N 0 0 381.363 3.496 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)CCNc2ccccc2[N+](=O)[O-])n1 ZINC000133964588 1417002800 /nfs/dbraw/zinc/00/28/00/1417002800.db2.gz NRTPZAJCZMCMMI-UHFFFAOYSA-N 0 0 380.408 3.233 20 5 GGBDRN O=C(COc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC(=O)NC1CCCCC1 ZINC000133967803 1417003088 /nfs/dbraw/zinc/00/30/88/1417003088.db2.gz PGLFWCLPMAOALI-UHFFFAOYSA-N 0 0 389.330 3.151 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000133984528 1417005757 /nfs/dbraw/zinc/00/57/57/1417005757.db2.gz OZLFPIQBSBKTIX-STQMWFEESA-N 0 0 395.431 3.499 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000133984175 1417005867 /nfs/dbraw/zinc/00/58/67/1417005867.db2.gz OZLFPIQBSBKTIX-QWHCGFSZSA-N 0 0 395.431 3.499 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)cc1[N+](=O)[O-] ZINC000133987909 1417006102 /nfs/dbraw/zinc/00/61/02/1417006102.db2.gz RTOPEDJPALPMCP-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN CC[C@@H]1Oc2cc([C@@H](C)NC(=O)c3ccc(F)cc3[N+](=O)[O-])ccc2NC1=O ZINC000133993008 1417006959 /nfs/dbraw/zinc/00/69/59/1417006959.db2.gz CGJIOQBQAIDNMC-HWPZZCPQSA-N 0 0 387.367 3.334 20 5 GGBDRN O=C(COc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCO[C@H]2CCCC[C@H]21 ZINC000133997390 1417007798 /nfs/dbraw/zinc/00/77/98/1417007798.db2.gz JFQBKXCOHOGXOX-OCCSQVGLSA-N 0 0 388.342 3.162 20 5 GGBDRN CCc1nnnn1-c1ccccc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000134003314 1417008687 /nfs/dbraw/zinc/00/86/87/1417008687.db2.gz ZWQOBJYMRDQEQC-UHFFFAOYSA-N 0 0 384.421 3.107 20 5 GGBDRN COc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c(C(=O)NC2CC2)c1 ZINC000134003476 1417008708 /nfs/dbraw/zinc/00/87/08/1417008708.db2.gz IHNPRFHLRBFVFD-UHFFFAOYSA-N 0 0 383.404 3.067 20 5 GGBDRN CN(C[C@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000134020417 1417010692 /nfs/dbraw/zinc/01/06/92/1417010692.db2.gz MEJHTBPJMARPOI-CYBMUJFWSA-N 0 0 395.431 3.453 20 5 GGBDRN Cc1cc(-c2noc(CCC(=O)Nc3ccc([N+](=O)[O-])c(C)n3)n2)ccc1F ZINC000134058717 1417016134 /nfs/dbraw/zinc/01/61/34/1417016134.db2.gz VEYQWYYODLPUIA-UHFFFAOYSA-N 0 0 385.355 3.367 20 5 GGBDRN Cc1nc(NC(=O)c2nn(-c3ccccc3F)c3c2CCC3)ccc1[N+](=O)[O-] ZINC000134057890 1417016177 /nfs/dbraw/zinc/01/61/77/1417016177.db2.gz ICYAELFEIXVNSQ-UHFFFAOYSA-N 0 0 381.367 3.364 20 5 GGBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134069011 1417017296 /nfs/dbraw/zinc/01/72/96/1417017296.db2.gz XLYXWJZAUACKKB-KRWDZBQOSA-N 0 0 380.408 3.098 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(Cl)c2N2CCOCC2)ccc1[N+](=O)[O-] ZINC000134068454 1417017502 /nfs/dbraw/zinc/01/75/02/1417017502.db2.gz FQMHAXPAPZGXKI-UHFFFAOYSA-N 0 0 391.811 3.346 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCc1ccc(Sc2ccccc2)cc1 ZINC000134082676 1417019570 /nfs/dbraw/zinc/01/95/70/1417019570.db2.gz MOSPGGWLMNOOQT-UHFFFAOYSA-N 0 0 395.440 3.224 20 5 GGBDRN CSCC[C@H](C)NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000134103624 1417022364 /nfs/dbraw/zinc/02/23/64/1417022364.db2.gz PEFACIDMTMSNKJ-LBPRGKRZSA-N 0 0 376.482 3.328 20 5 GGBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000134107947 1417023354 /nfs/dbraw/zinc/02/33/54/1417023354.db2.gz MTVALQPIKYATQC-LJQANCHMSA-N 0 0 383.404 3.353 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCc3ccsc3C2)ccc1[N+](=O)[O-] ZINC000134108941 1417023411 /nfs/dbraw/zinc/02/34/11/1417023411.db2.gz HYXLMYOQMLITMW-QGZVFWFLSA-N 0 0 399.472 3.154 20 5 GGBDRN Cc1ccc(Cl)cc1C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000134154153 1417030157 /nfs/dbraw/zinc/03/01/57/1417030157.db2.gz MJGAAPVLHLZPEP-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@@H](C)CCC[C@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000134162622 1417031571 /nfs/dbraw/zinc/03/15/71/1417031571.db2.gz AHWXVRLLIOGIBE-UONOGXRCSA-N 0 0 384.436 3.100 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@@H](C)CCC[C@@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000134162252 1417031671 /nfs/dbraw/zinc/03/16/71/1417031671.db2.gz AHWXVRLLIOGIBE-KBPBESRZSA-N 0 0 384.436 3.100 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N(CCC(F)(F)F)CC1CC1 ZINC000134200609 1417037040 /nfs/dbraw/zinc/03/70/40/1417037040.db2.gz ISGLKUWSSYIKTP-UHFFFAOYSA-N 0 0 393.749 3.378 20 5 GGBDRN C[C@@]1(c2ccsc2)NC(=O)N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1=O ZINC000134218372 1417039166 /nfs/dbraw/zinc/03/91/66/1417039166.db2.gz QZCFQKMSPYTORX-SFHVURJKSA-N 0 0 398.400 3.279 20 5 GGBDRN CCCCn1ncc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000134236724 1417041893 /nfs/dbraw/zinc/04/18/93/1417041893.db2.gz YTNCJAQKANBCIC-UHFFFAOYSA-N 0 0 379.804 3.130 20 5 GGBDRN CCOCc1ccc(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134250042 1417044133 /nfs/dbraw/zinc/04/41/33/1417044133.db2.gz MSYPNRZHWXWETI-UHFFFAOYSA-N 0 0 380.404 3.247 20 5 GGBDRN Cc1ccnc([C@@H](NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)n1 ZINC000134254654 1417044599 /nfs/dbraw/zinc/04/45/99/1417044599.db2.gz IRLSUKJTNGBVCF-BZNIZROVSA-N 0 0 390.827 3.381 20 5 GGBDRN CCOc1ccc(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1OC ZINC000134269810 1417047533 /nfs/dbraw/zinc/04/75/33/1417047533.db2.gz PTJNQRKFQAJFIR-UHFFFAOYSA-N 0 0 396.403 3.118 20 5 GGBDRN CN(CC1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC1)C(=O)OC(C)(C)C ZINC000134282521 1417049317 /nfs/dbraw/zinc/04/93/17/1417049317.db2.gz NXCXCAHMPSCJRL-UHFFFAOYSA-N 0 0 395.431 3.453 20 5 GGBDRN O=C(Nc1cnc(-c2ccccc2)nc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134292479 1417050761 /nfs/dbraw/zinc/05/07/61/1417050761.db2.gz YGILBDFOLNPKLZ-UHFFFAOYSA-N 0 0 386.371 3.490 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000134331171 1417056686 /nfs/dbraw/zinc/05/66/86/1417056686.db2.gz NKIBIEHBQFFLIK-JTQLQIEISA-N 0 0 384.358 3.390 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000134331190 1417056750 /nfs/dbraw/zinc/05/67/50/1417056750.db2.gz NKIBIEHBQFFLIK-SNVBAGLBSA-N 0 0 384.358 3.390 20 5 GGBDRN O=C(Nc1ccc(Cn2cccn2)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134348843 1417058708 /nfs/dbraw/zinc/05/87/08/1417058708.db2.gz SHWHOVDHYMRBCE-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN C[C@@H](N1CCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1)C(F)(F)F ZINC000178734302 1429155413 /nfs/dbraw/zinc/15/54/13/1429155413.db2.gz NOOTWUVCWVJIQP-NWDGAFQWSA-N 0 0 399.373 3.274 20 5 GGBDRN CC(=O)N1CCCc2ccc(S(=O)(=O)Nc3cc([N+](=O)[O-])ccc3C)cc21 ZINC000134441727 1417068324 /nfs/dbraw/zinc/06/83/24/1417068324.db2.gz NOEDMPMGOORFHD-UHFFFAOYSA-N 0 0 389.433 3.003 20 5 GGBDRN CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)ccc1C ZINC000134444903 1417068706 /nfs/dbraw/zinc/06/87/06/1417068706.db2.gz PDLPIOGTXNXDKL-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN Cc1cnn(-c2ccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2F)c1 ZINC000134466794 1417072829 /nfs/dbraw/zinc/07/28/29/1417072829.db2.gz NCGRAQIEDJULMZ-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN CC[C@H](O)CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1 ZINC000134480999 1417074955 /nfs/dbraw/zinc/07/49/55/1417074955.db2.gz RTHBQGWUWXMXDK-SFHVURJKSA-N 0 0 382.420 3.418 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC2(C[C@@H]2C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000134518494 1417080485 /nfs/dbraw/zinc/08/04/85/1417080485.db2.gz JSWMHHLLJANDLC-MRXNPFEDSA-N 0 0 389.452 3.248 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)C[C@@H](O)c2ccc(F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000134559377 1417087146 /nfs/dbraw/zinc/08/71/46/1417087146.db2.gz NSUALIVWIQMILI-DYZYQPBXSA-N 0 0 391.355 3.193 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC(OC2CCCC2)CC1 ZINC000134562362 1417087371 /nfs/dbraw/zinc/08/73/71/1417087371.db2.gz ROSKGMDPQCTZGD-UHFFFAOYSA-N 0 0 384.436 3.344 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CCO1 ZINC000134562980 1417087574 /nfs/dbraw/zinc/08/75/74/1417087574.db2.gz WXOSKFSATCQUKO-LLVKDONJSA-N 0 0 399.234 3.338 20 5 GGBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000134563358 1417087584 /nfs/dbraw/zinc/08/75/84/1417087584.db2.gz YVTKTXWVVGDQLG-ACJLOTCBSA-N 0 0 375.400 3.164 20 5 GGBDRN CCC1(CO)CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000134582615 1417091492 /nfs/dbraw/zinc/09/14/92/1417091492.db2.gz OEJAKQMEQZWBKE-UHFFFAOYSA-N 0 0 375.450 3.343 20 5 GGBDRN CCOc1ccccc1CCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134589626 1417092890 /nfs/dbraw/zinc/09/28/90/1417092890.db2.gz PWTJSHULDFMJFP-UHFFFAOYSA-N 0 0 380.404 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc(-c3cc(F)c(F)c(F)c3)no2)cc1 ZINC000134589877 1417093510 /nfs/dbraw/zinc/09/35/10/1417093510.db2.gz LBLZALRLHZWYRD-UHFFFAOYSA-N 0 0 399.306 3.036 20 5 GGBDRN O=C(NCCc1cc(F)cc2c1OCOC2)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134598818 1417094425 /nfs/dbraw/zinc/09/44/25/1417094425.db2.gz WOFQARMNICDLGW-UHFFFAOYSA-N 0 0 380.759 3.226 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1C ZINC000134605577 1417095298 /nfs/dbraw/zinc/09/52/98/1417095298.db2.gz QLQMSEOKQSLLJD-UHFFFAOYSA-N 0 0 380.404 3.370 20 5 GGBDRN CC(C)N(CC(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000134607508 1417096005 /nfs/dbraw/zinc/09/60/05/1417096005.db2.gz VMRGZOPRASTODD-UHFFFAOYSA-N 0 0 387.202 3.022 20 5 GGBDRN CC(C)N(CC(F)F)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000134606765 1417096073 /nfs/dbraw/zinc/09/60/73/1417096073.db2.gz ATAQXCRPTAFGDP-UHFFFAOYSA-N 0 0 387.202 3.022 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1C ZINC000134621480 1417098910 /nfs/dbraw/zinc/09/89/10/1417098910.db2.gz GXWOFIWLEGSCEB-DZGCQCFKSA-N 0 0 379.457 3.481 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C ZINC000134621516 1417099026 /nfs/dbraw/zinc/09/90/26/1417099026.db2.gz GXWOFIWLEGSCEB-ZFWWWQNUSA-N 0 0 379.457 3.481 20 5 GGBDRN COc1ccc(CN2CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000134645325 1417104073 /nfs/dbraw/zinc/10/40/73/1417104073.db2.gz IXSKMUBBXGNFLL-ZFWWWQNUSA-N 0 0 379.457 3.481 20 5 GGBDRN COc1cc(F)c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1OC ZINC000134649408 1417105417 /nfs/dbraw/zinc/10/54/17/1417105417.db2.gz FNTCDONGHPYKSR-UHFFFAOYSA-N 0 0 386.339 3.189 20 5 GGBDRN C[C@H](N1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1)C(F)(F)F ZINC000178742324 1429158875 /nfs/dbraw/zinc/15/88/75/1429158875.db2.gz FKQSHCVGBSZADI-ZDUSSCGKSA-N 0 0 398.385 3.361 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000134658607 1417107636 /nfs/dbraw/zinc/10/76/36/1417107636.db2.gz KBAXPDJBYNWHEX-OAHLLOKOSA-N 0 0 382.482 3.317 20 5 GGBDRN Cc1ccc(Nc2cccc(C(=O)NCCc3ccc([N+](=O)[O-])cc3)c2)nn1 ZINC000134666724 1417110110 /nfs/dbraw/zinc/11/01/10/1417110110.db2.gz QUFOZDSPGXKMAZ-UHFFFAOYSA-N 0 0 377.404 3.409 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H]2CCOC3(CCCCC3)C2)c1C ZINC000134669947 1417110409 /nfs/dbraw/zinc/11/04/09/1417110409.db2.gz FOCVSMZNEIXFTJ-HNNXBMFYSA-N 0 0 382.482 3.372 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134678735 1417111693 /nfs/dbraw/zinc/11/16/93/1417111693.db2.gz VKOHWMBRTMZYSD-STQMWFEESA-N 0 0 381.860 3.405 20 5 GGBDRN C[C@@H](Oc1ccc(OCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1)C(N)=O ZINC000134705757 1417115081 /nfs/dbraw/zinc/11/50/81/1417115081.db2.gz XWPRGAFBSXDEMD-GFCCVEGCSA-N 0 0 383.360 3.081 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000134731713 1417118059 /nfs/dbraw/zinc/11/80/59/1417118059.db2.gz QGDKLDFCGDNBGH-OAHLLOKOSA-N 0 0 392.415 3.419 20 5 GGBDRN O=C(NCC1(c2cccc(F)c2)CC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134733160 1417118317 /nfs/dbraw/zinc/11/83/17/1417118317.db2.gz SBFXNMDTNDRMHK-UHFFFAOYSA-N 0 0 380.379 3.381 20 5 GGBDRN COC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000134745041 1417119598 /nfs/dbraw/zinc/11/95/98/1417119598.db2.gz XZMFSMHHFMJERJ-UHFFFAOYSA-N 0 0 391.811 3.153 20 5 GGBDRN Cc1nnc(-c2cccc(NC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)c2)o1 ZINC000134755035 1417121032 /nfs/dbraw/zinc/12/10/32/1417121032.db2.gz OEJHMKREAIWVLD-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)Oc1cccc(F)c1 ZINC000134759091 1417121435 /nfs/dbraw/zinc/12/14/35/1417121435.db2.gz OVIVDVCZYSPFFY-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN CO[C@H]1CCCN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)C1 ZINC000134792700 1417126484 /nfs/dbraw/zinc/12/64/84/1417126484.db2.gz CAXPOPUEYBGAKU-NSHDSACASA-N 0 0 399.234 3.338 20 5 GGBDRN Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000134807390 1417129354 /nfs/dbraw/zinc/12/93/54/1417129354.db2.gz NXBCBUKLDOGOMX-WEVVVXLNSA-N 0 0 395.415 3.028 20 5 GGBDRN C[C@H]1CN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CCN1CC(F)(F)F ZINC000134825907 1417131910 /nfs/dbraw/zinc/13/19/10/1417131910.db2.gz RKXLXPKUWNYJLC-JTQLQIEISA-N 0 0 390.387 3.398 20 5 GGBDRN COc1cc2c(cc1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000178747643 1429160525 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CC(C)CN(C[C@H](O)c1ccc(F)cc1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000135104170 1417172561 /nfs/dbraw/zinc/17/25/61/1417172561.db2.gz DDCSDGCFGSIYQX-SFHVURJKSA-N 0 0 375.400 3.029 20 5 GGBDRN Cc1cccc(NC(=O)NCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000135185951 1417183421 /nfs/dbraw/zinc/18/34/21/1417183421.db2.gz KKSIWZHEMZUHLC-UHFFFAOYSA-N 0 0 382.420 3.216 20 5 GGBDRN Cc1nc(-c2cccc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)c2)n[nH]1 ZINC000135184899 1417183428 /nfs/dbraw/zinc/18/34/28/1417183428.db2.gz ZGQJVCUBDPSJBC-UHFFFAOYSA-N 0 0 377.404 3.493 20 5 GGBDRN CSc1ccc(NC(=O)C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000135184528 1417183892 /nfs/dbraw/zinc/18/38/92/1417183892.db2.gz XKGTXMYSJOBUMI-UHFFFAOYSA-N 0 0 393.852 3.268 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000135192633 1417184934 /nfs/dbraw/zinc/18/49/34/1417184934.db2.gz XVJMNTXJGWHPAI-CQSZACIVSA-N 0 0 376.359 3.343 20 5 GGBDRN CC(C)Sc1ccccc1NC(=O)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000135192100 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Cc1nn(Cc2ccc(C(=O)N(C)c3cccc(C)n3)cc2)c(C)c1[N+](=O)[O-] ZINC000135238356 1417193635 /nfs/dbraw/zinc/19/36/35/1417193635.db2.gz BNZARNHAIMHPIL-UHFFFAOYSA-N 0 0 379.420 3.436 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000135238689 1417193775 /nfs/dbraw/zinc/19/37/75/1417193775.db2.gz SGYVTYBTTHMYEU-UHFFFAOYSA-N 0 0 382.420 3.156 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c(Br)n1 ZINC000135242683 1417194391 /nfs/dbraw/zinc/19/43/91/1417194391.db2.gz QTPQALUTQXFXSF-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN O=C(CNC(=O)c1ccc2c(c1)CCC2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135274929 1417201001 /nfs/dbraw/zinc/20/10/01/1417201001.db2.gz OWRIPHPXJAQTHJ-UHFFFAOYSA-N 0 0 393.443 3.005 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC000135275350 1417201269 /nfs/dbraw/zinc/20/12/69/1417201269.db2.gz IXCNJAHWRHWKTF-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1cc(S(C)(=O)=O)cc(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1C ZINC000135291297 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COc1ccc2oc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c(C)c2c1 ZINC000135525721 1417233002 /nfs/dbraw/zinc/23/30/02/1417233002.db2.gz HQXPCMFQODWUJL-ZDUSSCGKSA-N 0 0 396.403 3.380 20 5 GGBDRN Cc1nc(CC(C)C)sc1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135531596 1417233841 /nfs/dbraw/zinc/23/38/41/1417233841.db2.gz XJPVLTGZYHWJAV-CYBMUJFWSA-N 0 0 389.481 3.280 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1cccnc1OCC(F)F ZINC000135531820 1417233987 /nfs/dbraw/zinc/23/39/87/1417233987.db2.gz YDAKGSXLJNFWDT-UHFFFAOYSA-N 0 0 383.376 3.042 20 5 GGBDRN O=C(NCc1cccnc1OCC(F)F)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000135534504 1417234513 /nfs/dbraw/zinc/23/45/13/1417234513.db2.gz JQYFJVHUXLRXLI-UHFFFAOYSA-N 0 0 392.362 3.138 20 5 GGBDRN Cc1ccc(SCCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135538393 1417234880 /nfs/dbraw/zinc/23/48/80/1417234880.db2.gz WPMJDMVRDBUWQU-OAHLLOKOSA-N 0 0 386.477 3.493 20 5 GGBDRN COc1ccc(CCCCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135537757 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/nfs/dbraw/zinc/23/58/18/1417235818.db2.gz IOTYYIFQJKYFMR-JEJOPICUSA-N 0 0 389.415 3.264 20 5 GGBDRN Cc1ccc(S[C@H](C)C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135543182 1417235846 /nfs/dbraw/zinc/23/58/46/1417235846.db2.gz VTMRPKPNUQTSPI-HUUCEWRRSA-N 0 0 386.477 3.492 20 5 GGBDRN Cc1ccc(S[C@H](C)C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135543146 1417235965 /nfs/dbraw/zinc/23/59/65/1417235965.db2.gz VTMRPKPNUQTSPI-CABCVRRESA-N 0 0 386.477 3.492 20 5 GGBDRN COc1ccc(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)cc1[N+](=O)[O-] ZINC000135575547 1417238961 /nfs/dbraw/zinc/23/89/61/1417238961.db2.gz UVFYKSCPDHEMOB-LBPRGKRZSA-N 0 0 393.802 3.405 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000135580590 1417239825 /nfs/dbraw/zinc/23/98/25/1417239825.db2.gz SHROSLUZCAHHDJ-LBPRGKRZSA-N 0 0 393.802 3.161 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000135587172 1417240944 /nfs/dbraw/zinc/24/09/44/1417240944.db2.gz 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386.433 3.014 20 5 GGBDRN O=C(NCCc1c[nH]c2ccccc12)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136062390 1417289718 /nfs/dbraw/zinc/28/97/18/1417289718.db2.gz CNLAOGOKINSTPX-UHFFFAOYSA-N 0 0 385.445 3.133 20 5 GGBDRN O=C(OCc1nnc(-c2ccccc2)o1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000136107915 1417292619 /nfs/dbraw/zinc/29/26/19/1417292619.db2.gz XUEBRXXSBSODSM-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN COc1ccccc1[C@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N(C)C ZINC000136117307 1417293718 /nfs/dbraw/zinc/29/37/18/1417293718.db2.gz LUBLFPPVPGZXPG-HNNXBMFYSA-N 0 0 377.828 3.290 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC([C@H](O)c2nccn2C)CC1 ZINC000136210784 1417301333 /nfs/dbraw/zinc/30/13/33/1417301333.db2.gz NHSMNFHVYPWOSN-IBGZPJMESA-N 0 0 388.468 3.061 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N(C)Cc2ccc([S@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000178798484 1429173810 /nfs/dbraw/zinc/17/38/10/1429173810.db2.gz ONUQHTLEFLHKEJ-PWFNWSNSSA-N 0 0 389.477 3.100 20 5 GGBDRN 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ZINC000136834224 1417348898 /nfs/dbraw/zinc/34/88/98/1417348898.db2.gz DIRFMXCEJKAZAM-MRXNPFEDSA-N 0 0 387.417 3.403 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000136848972 1417350233 /nfs/dbraw/zinc/35/02/33/1417350233.db2.gz ANVFCXJTQQXIPI-UHFFFAOYSA-N 0 0 396.325 3.498 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CSc2nnc(NCc3ccco3)s2)c1 ZINC000136853629 1417350706 /nfs/dbraw/zinc/35/07/06/1417350706.db2.gz ZCWJLDWVODYGGN-CYBMUJFWSA-N 0 0 378.435 3.477 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CSc2nnc(-c3ccncc3)n2C2CC2)c1 ZINC000136853753 1417350714 /nfs/dbraw/zinc/35/07/14/1417350714.db2.gz XCPSIGGRMOQJOQ-INIZCTEOSA-N 0 0 383.433 3.409 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CSc2nnc(-c3cccnc3)n2C2CC2)c1 ZINC000136853858 1417350812 /nfs/dbraw/zinc/35/08/12/1417350812.db2.gz ZAVKDGDUOYOTSF-MRXNPFEDSA-N 0 0 383.433 3.409 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(Cc3cccc(Cl)c3)CC2)c1 ZINC000136892303 1417353231 /nfs/dbraw/zinc/35/32/31/1417353231.db2.gz QVXCNSSJELORRD-IBGZPJMESA-N 0 0 375.856 3.099 20 5 GGBDRN COc1ccc(C(=O)C2CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000136898436 1417353602 /nfs/dbraw/zinc/35/36/02/1417353602.db2.gz ZPOUSYDEAZFTTG-FQEVSTJZSA-N 0 0 384.432 3.232 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)Cn2cnc3c2ncnc3NCc2ccccc2)c1 ZINC000136939387 1417356637 /nfs/dbraw/zinc/35/66/37/1417356637.db2.gz HYOQAXCPVLLGNU-QGZVFWFLSA-N 0 0 390.403 3.080 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCC2(Cc3ccccc3)CCC2)c([N+](=O)[O-])c1 ZINC000136945776 1417356794 /nfs/dbraw/zinc/35/67/94/1417356794.db2.gz QWFJKTSVKPACDC-UHFFFAOYSA-N 0 0 382.416 3.315 20 5 GGBDRN CN(Cc1cccc(Cl)c1)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000136999905 1417361485 /nfs/dbraw/zinc/36/14/85/1417361485.db2.gz KZTQFURSRJYPPK-UHFFFAOYSA-N 0 0 375.812 3.027 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)N(C)Cc1ccccc1 ZINC000137029821 1417363396 /nfs/dbraw/zinc/36/33/96/1417363396.db2.gz SEOHPBQNKCLITF-UHFFFAOYSA-N 0 0 387.461 3.095 20 5 GGBDRN C[C@@H](c1ccc(F)cc1F)N1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000137036715 1417363905 /nfs/dbraw/zinc/36/39/05/1417363905.db2.gz DIJOSAQMAMAEIO-VBKZILBWSA-N 0 0 391.418 3.285 20 5 GGBDRN Cn1c(COc2ccccc2)nnc1SC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137075786 1417366762 /nfs/dbraw/zinc/36/67/62/1417366762.db2.gz ZLAWFFCTOCAFGO-MRXNPFEDSA-N 0 0 386.433 3.128 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CS(=O)(=O)Cc2ccccc2C(F)(F)F)c1 ZINC000137131336 1417369961 /nfs/dbraw/zinc/36/99/61/1417369961.db2.gz PFQVZMWCCPXKHY-HNNXBMFYSA-N 0 0 389.351 3.262 20 5 GGBDRN CC(C)CCc1nc(CS(=O)(=O)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cs1 ZINC000137145534 1417370963 /nfs/dbraw/zinc/37/09/63/1417370963.db2.gz FNQPSGOPUVQCBQ-MRXNPFEDSA-N 0 0 398.506 3.288 20 5 GGBDRN CC[C@@H](c1ccc(F)cc1F)S(=O)(=O)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137150172 1417371424 /nfs/dbraw/zinc/37/14/24/1417371424.db2.gz PMBXVVAOXAZTEF-SJORKVTESA-N 0 0 385.388 3.473 20 5 GGBDRN CC[C@@H](c1ccc(F)cc1F)S(=O)(=O)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000137150088 1417371452 /nfs/dbraw/zinc/37/14/52/1417371452.db2.gz PMBXVVAOXAZTEF-IRXDYDNUSA-N 0 0 385.388 3.473 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1SCCO)N1CC[C@@H](Cc2ccccc2)C1 ZINC000137224521 1417376128 /nfs/dbraw/zinc/37/61/28/1417376128.db2.gz HIEUMMGRGZJYFQ-INIZCTEOSA-N 0 0 386.473 3.384 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC[C@@H](c3nc4c(s3)CCCC4)C2)c1[N+](=O)[O-] ZINC000178813411 1429179255 /nfs/dbraw/zinc/17/92/55/1429179255.db2.gz QRFHWERCLIYOMJ-LLVKDONJSA-N 0 0 389.481 3.235 20 5 GGBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000137232355 1417376667 /nfs/dbraw/zinc/37/66/67/1417376667.db2.gz PWCSUVWNUOKSRF-ACJLOTCBSA-N 0 0 375.400 3.088 20 5 GGBDRN Cc1ccc(NS(C)(=O)=O)c(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000137253352 1417377896 /nfs/dbraw/zinc/37/78/96/1417377896.db2.gz NJMIOBOKSHQLHR-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN C[C@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000137374195 1417382494 /nfs/dbraw/zinc/38/24/94/1417382494.db2.gz YRGXLMDVVKYQMF-NSHDSACASA-N 0 0 397.366 3.200 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C1(C(=O)Nc2cccc([N+](=O)[O-])c2)CCC1 ZINC000137416704 1417384355 /nfs/dbraw/zinc/38/43/55/1417384355.db2.gz KYDLHBLCBVSMEB-UHFFFAOYSA-N 0 0 384.348 3.251 20 5 GGBDRN C[C@H](OC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)Nc1ccccc1Cl ZINC000137426684 1417385278 /nfs/dbraw/zinc/38/52/78/1417385278.db2.gz DPZCWLZQBFAXNN-VIFPVBQESA-N 0 0 392.751 3.161 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)o1 ZINC000137490010 1417388936 /nfs/dbraw/zinc/38/89/36/1417388936.db2.gz KYKRKODUYXZPCF-QGZVFWFLSA-N 0 0 397.387 3.153 20 5 GGBDRN Cc1cc(-c2noc(CN3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)n2)ccc1F ZINC000137512033 1417389170 /nfs/dbraw/zinc/38/91/70/1417389170.db2.gz HIWDDYSPFMZDKP-CQSZACIVSA-N 0 0 398.398 3.174 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)CCOc1ccccc1Cl ZINC000137816644 1417396503 /nfs/dbraw/zinc/39/65/03/1417396503.db2.gz KHPJQKQUYGFOBY-UHFFFAOYSA-N 0 0 377.828 3.465 20 5 GGBDRN O=C(NCc1nc2ccccc2[nH]1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000138282355 1417409856 /nfs/dbraw/zinc/40/98/56/1417409856.db2.gz DAEXOSXXZLYRJR-UHFFFAOYSA-N 0 0 379.420 3.004 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000138394329 1417412745 /nfs/dbraw/zinc/41/27/45/1417412745.db2.gz DNZDYLGOBPZLKO-AUUYWEPGSA-N 0 0 385.420 3.004 20 5 GGBDRN CC(C)C[C@@H]1CCCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000138398682 1417412873 /nfs/dbraw/zinc/41/28/73/1417412873.db2.gz CNGQKQOHNWDWCB-ZDUSSCGKSA-N 0 0 381.860 3.405 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000138395602 1417413043 /nfs/dbraw/zinc/41/30/43/1417413043.db2.gz VIMGYIVPUPMJRI-AUSJPIAWSA-N 0 0 399.447 3.392 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N(C)C)cc1 ZINC000138421639 1417413772 /nfs/dbraw/zinc/41/37/72/1417413772.db2.gz QYKREHBBNCHRSV-LLVKDONJSA-N 0 0 391.811 3.356 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C[NH2+][C@](C)(CNC(=O)OC(C)(C)C)C1CC1 ZINC000138499587 1417420577 /nfs/dbraw/zinc/42/05/77/1417420577.db2.gz QGRMVTXOARCANB-LJQANCHMSA-N 0 0 379.457 3.386 20 5 GGBDRN CC(C)CC(=O)Nc1cccc(CNC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000138526562 1417423047 /nfs/dbraw/zinc/42/30/47/1417423047.db2.gz WWTZTXHPEQAEAR-UHFFFAOYSA-N 0 0 385.420 3.275 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)c2cc3cccc(C)c3o2)c([N+](=O)[O-])c1 ZINC000138591410 1417427778 /nfs/dbraw/zinc/42/77/78/1417427778.db2.gz CTOKXHZLIWQWKL-UHFFFAOYSA-N 0 0 384.344 3.454 20 5 GGBDRN O=C(NCCCn1cc(Br)cn1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000138731417 1417436383 /nfs/dbraw/zinc/43/63/83/1417436383.db2.gz FZDFZQISIZLSQK-UHFFFAOYSA-N 0 0 387.621 3.027 20 5 GGBDRN COc1cccc(CN(C)c2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])c1 ZINC000138947294 1417443437 /nfs/dbraw/zinc/44/34/37/1417443437.db2.gz DEFFJEYCNIBQPO-UHFFFAOYSA-N 0 0 380.404 3.204 20 5 GGBDRN COc1cc(OCC(=O)O[C@@H](C)c2cccc(NC(C)=O)c2)ccc1[N+](=O)[O-] ZINC000139018765 1417445163 /nfs/dbraw/zinc/44/51/63/1417445163.db2.gz NAEXZTWTCWFMRY-LBPRGKRZSA-N 0 0 388.376 3.245 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccc(Br)nc1 ZINC000178822833 1429182927 /nfs/dbraw/zinc/18/29/27/1429182927.db2.gz XPHYYECHDRAASD-UHFFFAOYSA-N 0 0 381.186 3.083 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000139304750 1417455502 /nfs/dbraw/zinc/45/55/02/1417455502.db2.gz AGXPTULBDAWQSF-CYBMUJFWSA-N 0 0 377.832 3.440 20 5 GGBDRN CCOc1cc2c(cc1CNC(=O)COc1ccc([N+](=O)[O-])cc1)O[C@H](C)C2 ZINC000139319162 1417456048 /nfs/dbraw/zinc/45/60/48/1417456048.db2.gz JRGUDUBVZMUGKD-CYBMUJFWSA-N 0 0 386.404 3.012 20 5 GGBDRN O=C(OCc1cc(=O)n2cc(Cl)ccc2n1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000139397860 1417458302 /nfs/dbraw/zinc/45/83/02/1417458302.db2.gz UMYRPOTZHGZKEU-UHFFFAOYSA-N 0 0 394.170 3.267 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCOC[C@@H]1C[C@H](O)c1cccs1 ZINC000139480294 1417460633 /nfs/dbraw/zinc/46/06/33/1417460633.db2.gz FORLWRAVGMCSRP-WFASDCNBSA-N 0 0 396.852 3.274 20 5 GGBDRN O=C(Nc1ccccc1)NC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000139585795 1417465048 /nfs/dbraw/zinc/46/50/48/1417465048.db2.gz JFQZEZVTYFQKNS-UHFFFAOYSA-N 0 0 383.408 3.413 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)c2ccncc21 ZINC000139588219 1417465753 /nfs/dbraw/zinc/46/57/53/1417465753.db2.gz BHPFUZDFNBADHR-UHFFFAOYSA-N 0 0 388.431 3.113 20 5 GGBDRN C[C@H](c1ccc(OC(F)F)cc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000139793041 1417473866 /nfs/dbraw/zinc/47/38/66/1417473866.db2.gz WQDRJZRBVJYGEF-CYBMUJFWSA-N 0 0 378.379 3.474 20 5 GGBDRN CN(C)C(=O)COc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000139799751 1417474758 /nfs/dbraw/zinc/47/47/58/1417474758.db2.gz OVAMMUWZVCMWQB-UHFFFAOYSA-N 0 0 392.799 3.359 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCNC(=O)C[C@H]1c1ccccc1 ZINC000139812945 1417476019 /nfs/dbraw/zinc/47/60/19/1417476019.db2.gz BXCVALLFUIFUQL-INIZCTEOSA-N 0 0 388.811 3.343 20 5 GGBDRN Cc1cccc(OC[C@H](O)CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000139826484 1417476344 /nfs/dbraw/zinc/47/63/44/1417476344.db2.gz DDLGJVPEDXGTJR-CYBMUJFWSA-N 0 0 379.800 3.118 20 5 GGBDRN CC(C)NS(=O)(=O)Cc1ccccc1CNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000178833229 1429187125 /nfs/dbraw/zinc/18/71/25/1429187125.db2.gz JVKSJYRVVYPDJD-UHFFFAOYSA-N 0 0 398.872 3.083 20 5 GGBDRN CC(C)(C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1)n1cc([N+](=O)[O-])cn1 ZINC000139924566 1417480960 /nfs/dbraw/zinc/48/09/60/1417480960.db2.gz RBTWQLABEGABQD-UHFFFAOYSA-N 0 0 388.815 3.063 20 5 GGBDRN CC(C)(C)Oc1ccc(CNc2ccc([N+](=O)[O-])cc2S(N)(=O)=O)cc1 ZINC000140031925 1417485902 /nfs/dbraw/zinc/48/59/02/1417485902.db2.gz FUJNGERBMQKGGT-UHFFFAOYSA-N 0 0 379.438 3.032 20 5 GGBDRN CC(=O)NCc1ccc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000140239537 1417494260 /nfs/dbraw/zinc/49/42/60/1417494260.db2.gz MNFVUKQXMJVOEO-UHFFFAOYSA-N 0 0 375.812 3.157 20 5 GGBDRN COC[C@H](C)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000140441443 1417503214 /nfs/dbraw/zinc/50/32/14/1417503214.db2.gz MQORINNQORXIRE-CYBMUJFWSA-N 0 0 379.438 3.090 20 5 GGBDRN COC[C@@H](C)CNc1ccc(C(=O)c2ccccc2C(=O)OC)cc1[N+](=O)[O-] ZINC000140429795 1417503406 /nfs/dbraw/zinc/50/34/06/1417503406.db2.gz JYHJELICWFFNGO-ZDUSSCGKSA-N 0 0 386.404 3.307 20 5 GGBDRN COc1ccc(C2(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)CCOCC2)cc1 ZINC000140718554 1417513108 /nfs/dbraw/zinc/51/31/08/1417513108.db2.gz ZTRXLKDUKQZDEQ-UHFFFAOYSA-N 0 0 382.416 3.241 20 5 GGBDRN COC(=O)c1c(C)[nH]c(C(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000140801311 1417516599 /nfs/dbraw/zinc/51/65/99/1417516599.db2.gz JBEVKAWYCZVVHT-UHFFFAOYSA-N 0 0 387.436 3.420 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NC[C@H]2CCCCO2)cc1[N+](=O)[O-])c1ccccn1 ZINC000140777298 1417516893 /nfs/dbraw/zinc/51/68/93/1417516893.db2.gz WERYZWLYHYXJJZ-GOEBONIOSA-N 0 0 384.436 3.462 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCCO2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178838324 1429189926 /nfs/dbraw/zinc/18/99/26/1429189926.db2.gz HRSYGMCGOZXZCQ-UHFFFAOYSA-N 0 0 383.404 3.240 20 5 GGBDRN CC(C)(C)c1ccc(O)c(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000141392202 1417536426 /nfs/dbraw/zinc/53/64/26/1417536426.db2.gz RPUUXCNNGHJTIX-UHFFFAOYSA-N 0 0 392.433 3.254 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@H]2C[C@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000178846257 1429192788 /nfs/dbraw/zinc/19/27/88/1429192788.db2.gz REUCXMTXWBDGTF-BBRMVZONSA-N 0 0 396.490 3.242 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN(Cc3ccco3)C[C@H]3CCCO3)n2)c1 ZINC000141717105 1417553117 /nfs/dbraw/zinc/55/31/17/1417553117.db2.gz UDNCJEFOKBAVRR-QGZVFWFLSA-N 0 0 384.392 3.419 20 5 GGBDRN O=C(Nc1cnc2ccccc2c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000141817143 1417558455 /nfs/dbraw/zinc/55/84/55/1417558455.db2.gz MTKNWNASUFPYGN-UHFFFAOYSA-N 0 0 378.388 3.232 20 5 GGBDRN COc1ccccc1N1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000178845616 1429193412 /nfs/dbraw/zinc/19/34/12/1429193412.db2.gz YINIPLFIHITHLX-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN CC(=O)CCCC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000178846861 1429193701 /nfs/dbraw/zinc/19/37/01/1429193701.db2.gz SRMJUNBBGORINF-UHFFFAOYSA-N 0 0 387.358 3.022 20 5 GGBDRN COc1ccc([C@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000141986207 1417568632 /nfs/dbraw/zinc/56/86/32/1417568632.db2.gz OLLUTPVPSPYSPG-QGZVFWFLSA-N 0 0 386.404 3.355 20 5 GGBDRN CNc1ccc(C(=O)N[C@@H](C)c2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000142041335 1417570119 /nfs/dbraw/zinc/57/01/19/1417570119.db2.gz UIGCDDNDXPHVQU-ZDUSSCGKSA-N 0 0 382.420 3.254 20 5 GGBDRN Cc1cc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)no1 ZINC000142830699 1417600220 /nfs/dbraw/zinc/60/02/20/1417600220.db2.gz ZYGFUDIXELSPGP-ZDUSSCGKSA-N 0 0 381.392 3.389 20 5 GGBDRN Cc1nc(-c2ccc(CCNC(=O)CCn3cc([N+](=O)[O-])nc3C)cc2)cs1 ZINC000142998165 1417606116 /nfs/dbraw/zinc/60/61/16/1417606116.db2.gz MNEGTGOWIQWNHO-UHFFFAOYSA-N 0 0 399.476 3.281 20 5 GGBDRN C[C@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000143263388 1417623373 /nfs/dbraw/zinc/62/33/73/1417623373.db2.gz QPMWYWFCXUSWQK-AWEZNQCLSA-N 0 0 398.419 3.454 20 5 GGBDRN O=C(NCc1ccc(-n2cnc3ccccc32)nc1)c1csc([N+](=O)[O-])c1 ZINC000143584411 1417640853 /nfs/dbraw/zinc/64/08/53/1417640853.db2.gz JFXHDTWXPZAAMW-UHFFFAOYSA-N 0 0 379.401 3.320 20 5 GGBDRN O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178860651 1429199542 /nfs/dbraw/zinc/19/95/42/1429199542.db2.gz IEEOLMIAMCWRGO-INIZCTEOSA-N 0 0 394.431 3.074 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)COc3ccccc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000144754318 1417671715 /nfs/dbraw/zinc/67/17/15/1417671715.db2.gz VCQJBLPQUUKCCY-GJZGRUSLSA-N 0 0 385.420 3.226 20 5 GGBDRN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000144921279 1417675697 /nfs/dbraw/zinc/67/56/97/1417675697.db2.gz MTXPGZCXXNATKM-KBXCAEBGSA-N 0 0 385.376 3.401 20 5 GGBDRN CC[C@@H](C)Oc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000144978606 1417678268 /nfs/dbraw/zinc/67/82/68/1417678268.db2.gz QQCZNIWGFNPOLK-CQSZACIVSA-N 0 0 385.420 3.369 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NC1(c2ccc(F)cc2)CCC1 ZINC000145154630 1417681376 /nfs/dbraw/zinc/68/13/76/1417681376.db2.gz HVFVCFDXJNVQEK-UHFFFAOYSA-N 0 0 385.395 3.049 20 5 GGBDRN O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000145233999 1417683543 /nfs/dbraw/zinc/68/35/43/1417683543.db2.gz CBDQVGSNTOJMNX-AUUYWEPGSA-N 0 0 384.388 3.221 20 5 GGBDRN O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])NC(=O)NCC(F)(F)F ZINC000145254893 1417683666 /nfs/dbraw/zinc/68/36/66/1417683666.db2.gz PXKUZSYTIVNDKZ-UHFFFAOYSA-N 0 0 397.309 3.029 20 5 GGBDRN COC(=O)C1CCN(C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000145235178 1417683969 /nfs/dbraw/zinc/68/39/69/1417683969.db2.gz FHNDVZIDSHQMMG-UHFFFAOYSA-N 0 0 398.415 3.052 20 5 GGBDRN O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])NC(=O)NCc1ccco1 ZINC000145231147 1417684142 /nfs/dbraw/zinc/68/41/42/1417684142.db2.gz IYHKOBBFEOSARK-UHFFFAOYSA-N 0 0 395.371 3.260 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCCSc3ccccc32)cc([N+](=O)[O-])c1 ZINC000145743857 1417698347 /nfs/dbraw/zinc/69/83/47/1417698347.db2.gz UZPWHTXQMXNCQT-UHFFFAOYSA-N 0 0 392.458 3.141 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)[C@@H]1CCCc2ccccc21 ZINC000145782247 1417700836 /nfs/dbraw/zinc/70/08/36/1417700836.db2.gz DMHRNHLHVXSSIP-GOSISDBHSA-N 0 0 388.445 3.148 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(OC(C)(C)C)cc1 ZINC000146084786 1417710186 /nfs/dbraw/zinc/71/01/86/1417710186.db2.gz XEDOQWKRJLXLTR-CQSZACIVSA-N 0 0 399.447 3.207 20 5 GGBDRN C[C@@H]1CN(C[C@@H]2CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000146243090 1417713427 /nfs/dbraw/zinc/71/34/27/1417713427.db2.gz YFAYVPDAJFDLRV-GUTXKFCHSA-N 0 0 396.875 3.354 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)c(F)c1 ZINC000146246437 1417713528 /nfs/dbraw/zinc/71/35/28/1417713528.db2.gz WWRPOSQPVFDKCF-RDTXWAMCSA-N 0 0 394.424 3.180 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000146252466 1417713556 /nfs/dbraw/zinc/71/35/56/1417713556.db2.gz MAPIIAIEKGELFV-KSSFIOAISA-N 0 0 394.424 3.180 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000146262827 1417714211 /nfs/dbraw/zinc/71/42/11/1417714211.db2.gz OSYZDJHAGLAEKJ-APWZRJJASA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000146297591 1417715186 /nfs/dbraw/zinc/71/51/86/1417715186.db2.gz HWRDNGZTUCOVAN-APWZRJJASA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000146312322 1417715214 /nfs/dbraw/zinc/71/52/14/1417715214.db2.gz KUGKLHLCNKAUMS-LPHOPBHVSA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000146314278 1417715455 /nfs/dbraw/zinc/71/54/55/1417715455.db2.gz CCMYTHLXEUSHAL-MAUKXSAKSA-N 0 0 376.434 3.041 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000146331100 1417716171 /nfs/dbraw/zinc/71/61/71/1417716171.db2.gz ZGNUXACWUZQLTG-QFBILLFUSA-N 0 0 390.461 3.349 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000146376603 1417717489 /nfs/dbraw/zinc/71/74/89/1417717489.db2.gz LKVCUAQMCWBUCH-OAHLLOKOSA-N 0 0 394.474 3.209 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000146438726 1417719925 /nfs/dbraw/zinc/71/99/25/1417719925.db2.gz KJIVMORNULSEHV-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000146438345 1417720396 /nfs/dbraw/zinc/72/03/96/1417720396.db2.gz UTQCVBBUBIEISK-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000146668890 1417727733 /nfs/dbraw/zinc/72/77/33/1417727733.db2.gz VFZQFYXQQNLFGT-HOTGVXAUSA-N 0 0 382.482 3.333 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000146698139 1417728612 /nfs/dbraw/zinc/72/86/12/1417728612.db2.gz LCTHYCKLTVEVTR-UHFFFAOYSA-N 0 0 396.852 3.314 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1cc(-c2ccccc2)no1 ZINC000146791866 1417732289 /nfs/dbraw/zinc/73/22/89/1417732289.db2.gz YGVQCULJSYLCIN-UHFFFAOYSA-N 0 0 393.808 3.382 20 5 GGBDRN CCCOc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000147001532 1417736285 /nfs/dbraw/zinc/73/62/85/1417736285.db2.gz TXRBSHFEBRSJQV-UHFFFAOYSA-N 0 0 378.406 3.039 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCOc2cccc(C(F)(F)F)c2)c1 ZINC000147171628 1417740732 /nfs/dbraw/zinc/74/07/32/1417740732.db2.gz DSJCQSORSHIILV-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN CC(C)COc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000147280963 1417743922 /nfs/dbraw/zinc/74/39/22/1417743922.db2.gz TUALRUUCSDMQGJ-UHFFFAOYSA-N 0 0 392.433 3.285 20 5 GGBDRN C[C@H](CCc1ccco1)NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000147872830 1417755451 /nfs/dbraw/zinc/75/54/51/1417755451.db2.gz PSMTZAGHNPIWTK-CYBMUJFWSA-N 0 0 387.392 3.013 20 5 GGBDRN COc1cc(OCC(=O)Nc2cccc(N3CCCCC3=O)c2)ccc1[N+](=O)[O-] ZINC000148331614 1417763270 /nfs/dbraw/zinc/76/32/70/1417763270.db2.gz CGKJBWPZECMMSK-UHFFFAOYSA-N 0 0 399.403 3.138 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)c1 ZINC000148498522 1417764546 /nfs/dbraw/zinc/76/45/46/1417764546.db2.gz UEHQVMMTLIJTRZ-OKILXGFUSA-N 0 0 385.420 3.469 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1CCN(CC(F)F)CC1 ZINC000148609622 1417766391 /nfs/dbraw/zinc/76/63/91/1417766391.db2.gz WGQNJANEQWBIOQ-UHFFFAOYSA-N 0 0 399.441 3.000 20 5 GGBDRN COCCCN(Cc1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccccc1F ZINC000149098052 1417772042 /nfs/dbraw/zinc/77/20/42/1417772042.db2.gz OWPJVWPFTZDPMR-UHFFFAOYSA-N 0 0 396.440 3.270 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1N1CCOCC1 ZINC000149355669 1417775670 /nfs/dbraw/zinc/77/56/70/1417775670.db2.gz PXLQFZBWMNUGHO-UHFFFAOYSA-N 0 0 393.346 3.285 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccc(COCCc2ccccc2)c1 ZINC000149614981 1417778192 /nfs/dbraw/zinc/77/81/92/1417778192.db2.gz CTKPMZJSBQISBK-UHFFFAOYSA-N 0 0 380.404 3.189 20 5 GGBDRN Cc1cc(-c2csc(NC(=O)CCn3cc([N+](=O)[O-])nc3C)n2)c(C)o1 ZINC000149873383 1417781282 /nfs/dbraw/zinc/78/12/82/1417781282.db2.gz QHXQGPLFGCEWGZ-UHFFFAOYSA-N 0 0 375.410 3.462 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000149921833 1417781961 /nfs/dbraw/zinc/78/19/61/1417781961.db2.gz HPANUCCGHRYZDE-LPHOPBHVSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000149921419 1417781970 /nfs/dbraw/zinc/78/19/70/1417781970.db2.gz HPANUCCGHRYZDE-QFBILLFUSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000149986155 1417782986 /nfs/dbraw/zinc/78/29/86/1417782986.db2.gz BJCSIYMMNXRFPW-VQIMIIECSA-N 0 0 397.431 3.126 20 5 GGBDRN COCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC1 ZINC000150122806 1417785264 /nfs/dbraw/zinc/78/52/64/1417785264.db2.gz KEQGHPMQAZYSEW-CQSZACIVSA-N 0 0 384.436 3.414 20 5 GGBDRN COCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC1 ZINC000150122576 1417785456 /nfs/dbraw/zinc/78/54/56/1417785456.db2.gz KEQGHPMQAZYSEW-AWEZNQCLSA-N 0 0 384.436 3.414 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc3nc(N(C)C)ccc3c2)ccc1[N+](=O)[O-] ZINC000150174883 1417786175 /nfs/dbraw/zinc/78/61/75/1417786175.db2.gz SKBMBCIMEKYARE-UHFFFAOYSA-N 0 0 396.403 3.235 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cn(-c2cccc(C(F)(F)F)c2)nn1 ZINC000150727681 1417792784 /nfs/dbraw/zinc/79/27/84/1417792784.db2.gz JGJJAEBLHLXCES-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN COc1ccc([C@H](C)CCNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000150765491 1417803315 /nfs/dbraw/zinc/80/33/15/1417803315.db2.gz KEFIUFUADDMOJI-CYBMUJFWSA-N 0 0 395.415 3.369 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H](c2ccccc2)c2ccccn2)ccc1[N+](=O)[O-] ZINC000150772272 1417804312 /nfs/dbraw/zinc/80/43/12/1417804312.db2.gz QYRXMDZYAIQIMH-IBGZPJMESA-N 0 0 399.428 3.066 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)Cc2nc3ccccc3s2)ccc1[N+](=O)[O-] ZINC000150778480 1417805332 /nfs/dbraw/zinc/80/53/32/1417805332.db2.gz LNPLIZQBHYUUSC-UHFFFAOYSA-N 0 0 393.446 3.034 20 5 GGBDRN COc1cc(S(=O)(=O)NCc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000150780044 1417805645 /nfs/dbraw/zinc/80/56/45/1417805645.db2.gz YRUUWKBQRNBSGU-UHFFFAOYSA-N 0 0 390.339 3.101 20 5 GGBDRN O=C(NCC1(CO)CC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000150790002 1417806830 /nfs/dbraw/zinc/80/68/30/1417806830.db2.gz APLIQTZHVDKAAI-UHFFFAOYSA-N 0 0 389.839 3.363 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000150801432 1417809635 /nfs/dbraw/zinc/80/96/35/1417809635.db2.gz HLPBBNRMKWICMW-OAHLLOKOSA-N 0 0 399.447 3.381 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c([N+](=O)[O-])c1 ZINC000150814478 1417812534 /nfs/dbraw/zinc/81/25/34/1417812534.db2.gz SFZSTWUMQCGKPT-UHFFFAOYSA-N 0 0 390.371 3.491 20 5 GGBDRN COc1cc(S(=O)(=O)N(Cc2ccc(F)cc2)CC2CC2)ccc1[N+](=O)[O-] ZINC000150815701 1417813041 /nfs/dbraw/zinc/81/30/41/1417813041.db2.gz HEODRICRGACBNE-UHFFFAOYSA-N 0 0 394.424 3.343 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000150817160 1417813382 /nfs/dbraw/zinc/81/33/82/1417813382.db2.gz ZMZNIEIDEHGLKK-OCCSQVGLSA-N 0 0 394.424 3.309 20 5 GGBDRN O=C(NC1(c2cccc(Cl)c2)CC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000150821902 1417814264 /nfs/dbraw/zinc/81/42/64/1417814264.db2.gz UQUYQGOBLCRIKI-UHFFFAOYSA-N 0 0 383.795 3.248 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)Cc2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000150825537 1417814692 /nfs/dbraw/zinc/81/46/92/1417814692.db2.gz FOGGVVDJUQDGOY-UHFFFAOYSA-N 0 0 376.390 3.170 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@H](O)c2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000150837568 1417816985 /nfs/dbraw/zinc/81/69/85/1417816985.db2.gz OGPKNXRJGLOBFV-KRWDZBQOSA-N 0 0 381.388 3.465 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@H](c2c(F)cccc2F)N(C)C)c1[N+](=O)[O-] ZINC000150843236 1417818499 /nfs/dbraw/zinc/81/84/99/1417818499.db2.gz OGCALENRGPGLGM-CQSZACIVSA-N 0 0 394.378 3.160 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(c2ccccn2)C1 ZINC000178891226 1429212593 /nfs/dbraw/zinc/21/25/93/1429212593.db2.gz CLKVKHFEDOBTJZ-QGZVFWFLSA-N 0 0 383.452 3.189 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000150872209 1417824979 /nfs/dbraw/zinc/82/49/79/1417824979.db2.gz HWBOIIAULDGUKQ-QFYYESIMSA-N 0 0 391.405 3.475 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000150871368 1417825119 /nfs/dbraw/zinc/82/51/19/1417825119.db2.gz JPASRJBUMBFQBR-GOEBONIOSA-N 0 0 391.468 3.289 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000150873655 1417825529 /nfs/dbraw/zinc/82/55/29/1417825529.db2.gz LEZVWEOQZKXAKI-STQMWFEESA-N 0 0 395.431 3.499 20 5 GGBDRN Cc1c(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)cccc1C(F)(F)F ZINC000150873464 1417825549 /nfs/dbraw/zinc/82/55/49/1417825549.db2.gz KDUMFQQQAWZZRK-UHFFFAOYSA-N 0 0 381.310 3.291 20 5 GGBDRN CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000150876848 1417826265 /nfs/dbraw/zinc/82/62/65/1417826265.db2.gz NUMYPKPQRUQGKX-SFHVURJKSA-N 0 0 384.432 3.207 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1[N+](=O)[O-] ZINC000150884175 1417827757 /nfs/dbraw/zinc/82/77/57/1417827757.db2.gz FJNRAYMDFALDEI-GFCCVEGCSA-N 0 0 381.404 3.124 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)C[C@@H](O)C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000150887317 1417828531 /nfs/dbraw/zinc/82/85/31/1417828531.db2.gz YBHLJBLBFUAGCC-ORAYPTAESA-N 0 0 384.436 3.006 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N(C)C[C@@H](O)C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000150887366 1417828638 /nfs/dbraw/zinc/82/86/38/1417828638.db2.gz YBHLJBLBFUAGCC-BFUOFWGJSA-N 0 0 384.436 3.006 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000150896235 1417830085 /nfs/dbraw/zinc/83/00/85/1417830085.db2.gz UWDWMLCIFCRWFQ-CQSZACIVSA-N 0 0 385.395 3.193 20 5 GGBDRN CN(Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000178893303 1429213221 /nfs/dbraw/zinc/21/32/21/1429213221.db2.gz UVIIPTSFLSRUNC-HNNXBMFYSA-N 0 0 384.816 3.348 20 5 GGBDRN O=C(NCCCO[C@@H]1CCOC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000150902036 1417831148 /nfs/dbraw/zinc/83/11/48/1417831148.db2.gz IQMHNEIEMFSFRB-GOSISDBHSA-N 0 0 399.447 3.132 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000150911233 1417833237 /nfs/dbraw/zinc/83/32/37/1417833237.db2.gz YOPKAEQWNWWJMN-INIZCTEOSA-N 0 0 377.832 3.285 20 5 GGBDRN CCO[C@@H](C)c1nc(Cn2c(C)nc([N+](=O)[O-])c2Br)cs1 ZINC000150924245 1417836219 /nfs/dbraw/zinc/83/62/19/1417836219.db2.gz FKMQFQUAVOQYLE-ZETCQYMHSA-N 0 0 375.248 3.465 20 5 GGBDRN O=C(NCCc1ccc(Cl)nc1)c1cc([N+](=O)[O-])ccc1Br ZINC000150954024 1417843165 /nfs/dbraw/zinc/84/31/65/1417843165.db2.gz IRCUPQWTGQELLI-UHFFFAOYSA-N 0 0 384.617 3.378 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H](Cc1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000150962760 1417844580 /nfs/dbraw/zinc/84/45/80/1417844580.db2.gz HZUJSMLHNDITME-GOSISDBHSA-N 0 0 384.432 3.207 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C1CC1 ZINC000150983857 1417849180 /nfs/dbraw/zinc/84/91/80/1417849180.db2.gz DOPVZOKZAMZPFQ-AWEZNQCLSA-N 0 0 383.832 3.281 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc3oc(N(C)C)nc3c2)cc1[N+](=O)[O-] ZINC000150991919 1417851287 /nfs/dbraw/zinc/85/12/87/1417851287.db2.gz VCFHSXUOTKWHOL-UHFFFAOYSA-N 0 0 385.336 3.271 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000151005874 1417853891 /nfs/dbraw/zinc/85/38/91/1417853891.db2.gz KHLKXSGTOUIWDT-HNNXBMFYSA-N 0 0 397.859 3.210 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000151024977 1417857626 /nfs/dbraw/zinc/85/76/26/1417857626.db2.gz VZXOKDJNJFEKAY-QGZVFWFLSA-N 0 0 388.395 3.417 20 5 GGBDRN COc1cc(F)c(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000151033372 1417859461 /nfs/dbraw/zinc/85/94/61/1417859461.db2.gz XCFAHZVOMILIJJ-UHFFFAOYSA-N 0 0 386.339 3.189 20 5 GGBDRN Cn1nc(C2CCCCC2)cc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000151039223 1417860572 /nfs/dbraw/zinc/86/05/72/1417860572.db2.gz BSRQFSBGZPHWGG-UHFFFAOYSA-N 0 0 395.419 3.470 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(COc3cc(C)ccc3[N+](=O)[O-])nc2c1 ZINC000151042541 1417860908 /nfs/dbraw/zinc/86/09/08/1417860908.db2.gz QHOVOFPXEGOTGC-UHFFFAOYSA-N 0 0 376.390 3.417 20 5 GGBDRN O=C(Nc1cccn(Cc2ccc(F)cc2)c1=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000151070586 1417866989 /nfs/dbraw/zinc/86/69/89/1417866989.db2.gz NMVUKNKNKGTVCI-UHFFFAOYSA-N 0 0 385.326 3.335 20 5 GGBDRN Cc1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1C(=O)N(C)C ZINC000151079604 1417868691 /nfs/dbraw/zinc/86/86/91/1417868691.db2.gz XRYRPRYWXVVCHW-UHFFFAOYSA-N 0 0 382.420 3.195 20 5 GGBDRN O=C(NCc1nnc(-c2ccccc2)s1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000151084919 1417869414 /nfs/dbraw/zinc/86/94/14/1417869414.db2.gz DRMHVLLZSHEJJE-UHFFFAOYSA-N 0 0 376.344 3.322 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCc1ccc(Cl)nc1 ZINC000151088732 1417870215 /nfs/dbraw/zinc/87/02/15/1417870215.db2.gz LWCDYWBOBLBHEX-UHFFFAOYSA-N 0 0 384.219 3.424 20 5 GGBDRN CCOC(=O)C1CCC(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000151090048 1417870237 /nfs/dbraw/zinc/87/02/37/1417870237.db2.gz HSINTIHMIKABBF-UHFFFAOYSA-N 0 0 389.452 3.391 20 5 GGBDRN CCNC(=O)c1cccc(OC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000151139463 1417880512 /nfs/dbraw/zinc/88/05/12/1417880512.db2.gz MOJKCVDFFJWOJN-UHFFFAOYSA-N 0 0 393.193 3.326 20 5 GGBDRN O=C(CCC(=O)N1CCC(c2ccccc2)=N1)OCCc1ccccc1[N+](=O)[O-] ZINC000151180720 1417889199 /nfs/dbraw/zinc/88/91/99/1417889199.db2.gz VAKWMRFCLYBEEM-UHFFFAOYSA-N 0 0 395.415 3.097 20 5 GGBDRN O=C(OCCc1ccccc1[N+](=O)[O-])[C@H]1CCCCN1C(=O)c1cccs1 ZINC000151180496 1417889222 /nfs/dbraw/zinc/88/92/22/1417889222.db2.gz XYHWXELVMAGEQS-MRXNPFEDSA-N 0 0 388.445 3.437 20 5 GGBDRN CC[C@@](C)(NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000151185625 1417889905 /nfs/dbraw/zinc/88/99/05/1417889905.db2.gz CVRAGWUEBWFWEC-QGZVFWFLSA-N 0 0 377.422 3.202 20 5 GGBDRN Cn1ccnc1C[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000151187473 1417890274 /nfs/dbraw/zinc/89/02/74/1417890274.db2.gz WATDECMTGSPACK-GFCCVEGCSA-N 0 0 396.369 3.442 20 5 GGBDRN O=C([C@H]1C[C@H]1c1cccc(F)c1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000151192211 1417891009 /nfs/dbraw/zinc/89/10/09/1417891009.db2.gz SMLVUPSAQUMILH-IRXDYDNUSA-N 0 0 387.386 3.325 20 5 GGBDRN CC(C)Cn1nc(C(=O)OCCc2ccccc2[N+](=O)[O-])c2ccccc2c1=O ZINC000151193813 1417891548 /nfs/dbraw/zinc/89/15/48/1417891548.db2.gz UNQUNAOUGCSSPF-UHFFFAOYSA-N 0 0 395.415 3.360 20 5 GGBDRN CCOC(=O)C1(N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCCCC1 ZINC000151196544 1417891864 /nfs/dbraw/zinc/89/18/64/1417891864.db2.gz LYSAKBVJZGLXHV-UHFFFAOYSA-N 0 0 388.424 3.343 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2 ZINC000151199191 1417892229 /nfs/dbraw/zinc/89/22/29/1417892229.db2.gz IHMQTXLZLYLNMQ-LBPRGKRZSA-N 0 0 385.445 3.342 20 5 GGBDRN O=C(N[C@H](CCO)C1CCCCC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000151204395 1417893642 /nfs/dbraw/zinc/89/36/42/1417893642.db2.gz JZMYDYOCHNFBBE-QGZVFWFLSA-N 0 0 375.469 3.256 20 5 GGBDRN O=C(N[C@@H]1CCN(C2CCCCC2)C1=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000151206709 1417893862 /nfs/dbraw/zinc/89/38/62/1417893862.db2.gz ADAYJXAOMCPFAC-OAHLLOKOSA-N 0 0 399.369 3.277 20 5 GGBDRN COc1ccc(-c2noc(CCC(=O)OCCc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000151205840 1417893898 /nfs/dbraw/zinc/89/38/98/1417893898.db2.gz HCDFREPYZCQIHD-UHFFFAOYSA-N 0 0 397.387 3.372 20 5 GGBDRN O=C(N[C@H]1CCN(C2CCCCC2)C1=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000151206778 1417893935 /nfs/dbraw/zinc/89/39/35/1417893935.db2.gz ADAYJXAOMCPFAC-HNNXBMFYSA-N 0 0 399.369 3.277 20 5 GGBDRN Cc1nc(COc2ccccc2C(=O)OCCc2ccccc2[N+](=O)[O-])no1 ZINC000151209004 1417894299 /nfs/dbraw/zinc/89/42/99/1417894299.db2.gz UBMGMHWSVVIMSJ-UHFFFAOYSA-N 0 0 383.360 3.265 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(C2CC2)S(=O)(=O)c2cccc3cccnc32)c1 ZINC000178920069 1429220443 /nfs/dbraw/zinc/22/04/43/1429220443.db2.gz YXMBAWAAEKZZDM-UHFFFAOYSA-N 0 0 383.429 3.496 20 5 GGBDRN COC(=O)C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(F)c1 ZINC000151223988 1417896840 /nfs/dbraw/zinc/89/68/40/1417896840.db2.gz QRNPDRDHYLVQNX-INIZCTEOSA-N 0 0 394.786 3.350 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C2CCCCC2)C1=O ZINC000151224528 1417897063 /nfs/dbraw/zinc/89/70/63/1417897063.db2.gz ZLUOJQAILIJNOK-GUYCJALGSA-N 0 0 391.493 3.125 20 5 GGBDRN CSC[C@](C)(O)CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000151233822 1417898834 /nfs/dbraw/zinc/89/88/34/1417898834.db2.gz VTHJBGBRGGRZLS-LJQANCHMSA-N 0 0 389.477 3.051 20 5 GGBDRN Cc1ccccc1[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCO1 ZINC000151239267 1417899938 /nfs/dbraw/zinc/89/99/38/1417899938.db2.gz WJUVFKVHCWZTHW-HXUWFJFHSA-N 0 0 392.415 3.303 20 5 GGBDRN CS[C@@H]1CCCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000151241835 1417901267 /nfs/dbraw/zinc/90/12/67/1417901267.db2.gz VUUOFYQVTWIUHR-OLZOCXBDSA-N 0 0 397.522 3.005 20 5 GGBDRN CS[C@H]1CCCCN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000151242045 1417901338 /nfs/dbraw/zinc/90/13/38/1417901338.db2.gz VUUOFYQVTWIUHR-QWHCGFSZSA-N 0 0 397.522 3.005 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCN1CCN(c2ccccc2)CC1 ZINC000151250864 1417903604 /nfs/dbraw/zinc/90/36/04/1417903604.db2.gz KBLFSFKXPYOBIT-UHFFFAOYSA-N 0 0 397.479 3.189 20 5 GGBDRN COC(=O)C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(F)c1 ZINC000151257497 1417905648 /nfs/dbraw/zinc/90/56/48/1417905648.db2.gz FPXLTWFASQVNJS-INIZCTEOSA-N 0 0 394.786 3.350 20 5 GGBDRN Cc1cccc([C@@H](C)CNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000151259257 1417906263 /nfs/dbraw/zinc/90/62/63/1417906263.db2.gz ADVYTPSPIOMSML-ZDUSSCGKSA-N 0 0 389.839 3.206 20 5 GGBDRN CCN(CC(=O)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1)C1CC1 ZINC000151259798 1417906605 /nfs/dbraw/zinc/90/66/05/1417906605.db2.gz RNQKZWPHBFOFEC-UHFFFAOYSA-N 0 0 383.404 3.237 20 5 GGBDRN Cc1cccc([C@H](C)CNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000151259310 1417906625 /nfs/dbraw/zinc/90/66/25/1417906625.db2.gz ADVYTPSPIOMSML-CYBMUJFWSA-N 0 0 389.839 3.206 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000151260323 1417906967 /nfs/dbraw/zinc/90/69/67/1417906967.db2.gz WWHQGWGWCUXYNM-OAHLLOKOSA-N 0 0 399.422 3.325 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@H]2C(=O)OCCc2ccccc2[N+](=O)[O-])cc1 ZINC000151268184 1417909031 /nfs/dbraw/zinc/90/90/31/1417909031.db2.gz RRSHPXHPBXISNK-IBGZPJMESA-N 0 0 382.416 3.180 20 5 GGBDRN O=C(OCCc1ccccc1[N+](=O)[O-])c1sccc1S(=O)(=O)C(F)F ZINC000151270333 1417909770 /nfs/dbraw/zinc/90/97/70/1417909770.db2.gz RQGDAFDUXGMQET-UHFFFAOYSA-N 0 0 391.373 3.052 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(F)cc1F)OCCc1ccccc1[N+](=O)[O-] ZINC000151274866 1417911215 /nfs/dbraw/zinc/91/12/15/1417911215.db2.gz RTFFHXVHAAZLFO-UHFFFAOYSA-N 0 0 392.358 3.169 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1 ZINC000151297715 1417919036 /nfs/dbraw/zinc/91/90/36/1417919036.db2.gz OJEPASGDKNAUBG-OAHLLOKOSA-N 0 0 394.786 3.350 20 5 GGBDRN COc1ccc(CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1Cl ZINC000151326917 1417927200 /nfs/dbraw/zinc/92/72/00/1417927200.db2.gz GUQWFGJEIINIBU-UHFFFAOYSA-N 0 0 379.756 3.403 20 5 GGBDRN O=C(Nc1ccc2[nH]ccc2c1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000151350682 1417932906 /nfs/dbraw/zinc/93/29/06/1417932906.db2.gz DDMLSIYFHJMRGD-UHFFFAOYSA-N 0 0 393.403 3.066 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)Oc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000178925947 1429221946 /nfs/dbraw/zinc/22/19/46/1429221946.db2.gz KOZAZYGHRMFHNF-UHFFFAOYSA-N 0 0 386.769 3.108 20 5 GGBDRN O=C(NCCOc1ncccc1C(F)(F)F)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000151391872 1417946779 /nfs/dbraw/zinc/94/67/79/1417946779.db2.gz JCFHWLFWEJRNEO-UHFFFAOYSA-N 0 0 389.717 3.471 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C[C@@H](O)c1ccc(F)cc1 ZINC000151395912 1417948210 /nfs/dbraw/zinc/94/82/10/1417948210.db2.gz LENKKPUDWMTADG-MEDUHNTESA-N 0 0 377.372 3.376 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)C[C@@H](O)c1ccc(F)cc1 ZINC000151395986 1417948257 /nfs/dbraw/zinc/94/82/57/1417948257.db2.gz LENKKPUDWMTADG-BDJLRTHQSA-N 0 0 377.372 3.376 20 5 GGBDRN O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)NCC1(Cc2ccccc2)CC1 ZINC000151408292 1417953694 /nfs/dbraw/zinc/95/36/94/1417953694.db2.gz JUCSWTDDSOPIJU-UHFFFAOYSA-N 0 0 382.416 3.048 20 5 GGBDRN COc1ccc([C@@H]2CCCN2S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000178932921 1429223868 /nfs/dbraw/zinc/22/38/68/1429223868.db2.gz YXHZCLSQERYZNR-IBGZPJMESA-N 0 0 390.461 3.313 20 5 GGBDRN Cc1c(NC(=O)N(C)CCN2CCN(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000151460888 1417981330 /nfs/dbraw/zinc/98/13/30/1417981330.db2.gz UIRIJSAWXCENSS-UHFFFAOYSA-N 0 0 397.479 3.189 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000178936851 1429224964 /nfs/dbraw/zinc/22/49/64/1429224964.db2.gz BRCBOCQFIPDPNO-KBPBESRZSA-N 0 0 379.457 3.232 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@H]1CCSc2ccc(F)cc21 ZINC000178936307 1429225118 /nfs/dbraw/zinc/22/51/18/1429225118.db2.gz KXELBFOFHZKAGW-HNNXBMFYSA-N 0 0 396.465 3.433 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCSc3ccc(F)cc32)cc1 ZINC000178936331 1429225193 /nfs/dbraw/zinc/22/51/93/1429225193.db2.gz WJOGDZPCARPPCY-INIZCTEOSA-N 0 0 396.465 3.433 20 5 GGBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000178939107 1429225612 /nfs/dbraw/zinc/22/56/12/1429225612.db2.gz ZQIFCBBSFIDCIV-LBPRGKRZSA-N 0 0 384.404 3.438 20 5 GGBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000151489552 1418000521 /nfs/dbraw/zinc/00/05/21/1418000521.db2.gz HVXYIUCMLKGKNQ-HNNXBMFYSA-N 0 0 379.420 3.328 20 5 GGBDRN O=C(Cn1cc(C2CC2)nn1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000151502818 1418005767 /nfs/dbraw/zinc/00/57/67/1418005767.db2.gz ZJCNLNRJKOIQMX-UHFFFAOYSA-N 0 0 375.816 3.160 20 5 GGBDRN Cc1ccccc1[C@H](O)CNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000151541800 1418019326 /nfs/dbraw/zinc/01/93/26/1418019326.db2.gz BMAGSIDWWUYUKM-MRXNPFEDSA-N 0 0 393.237 3.438 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cc(=O)[nH]c2cc(F)ccc21 ZINC000151545712 1418019915 /nfs/dbraw/zinc/01/99/15/1418019915.db2.gz UQFXBKDCMPETAX-UHFFFAOYSA-N 0 0 393.334 3.013 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ncc(-c2ccccc2)o1 ZINC000151571059 1418028379 /nfs/dbraw/zinc/02/83/79/1418028379.db2.gz MHMXARYFZFIXRJ-LLVKDONJSA-N 0 0 391.380 3.428 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000151574217 1418029551 /nfs/dbraw/zinc/02/95/51/1418029551.db2.gz UHYDORVEVKHSQK-ZDUSSCGKSA-N 0 0 399.230 3.000 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)c1 ZINC000151580693 1418031429 /nfs/dbraw/zinc/03/14/29/1418031429.db2.gz INWVCTHYFMZPEK-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](c1ccccc1F)C1CCCC1 ZINC000151638811 1418047448 /nfs/dbraw/zinc/04/74/48/1418047448.db2.gz PHXFTBIDBVJBIC-QGZVFWFLSA-N 0 0 375.404 3.161 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Oc1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1F ZINC000151663886 1418053697 /nfs/dbraw/zinc/05/36/97/1418053697.db2.gz SHXWNNSCLQOKJH-HNNXBMFYSA-N 0 0 378.331 3.354 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000151667046 1418055209 /nfs/dbraw/zinc/05/52/09/1418055209.db2.gz VXABSBKSMCSFSW-HXUWFJFHSA-N 0 0 391.431 3.149 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000151675772 1418058061 /nfs/dbraw/zinc/05/80/61/1418058061.db2.gz RSQBDMHCQPGDTK-AWEZNQCLSA-N 0 0 377.832 3.157 20 5 GGBDRN COCCC1(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCC1 ZINC000151681044 1418058991 /nfs/dbraw/zinc/05/89/91/1418058991.db2.gz NNFJGDSYQYXPTR-UHFFFAOYSA-N 0 0 375.469 3.134 20 5 GGBDRN CCOc1ccccc1[C@H](CC(C)C)NC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000151692042 1418062867 /nfs/dbraw/zinc/06/28/67/1418062867.db2.gz YIDBUWUIFDMIIS-KRWDZBQOSA-N 0 0 389.456 3.277 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000151698955 1418065475 /nfs/dbraw/zinc/06/54/75/1418065475.db2.gz KJAROLIMLKWJSS-QGZVFWFLSA-N 0 0 375.404 3.161 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cnn(-c2ccc(F)cc2)n1 ZINC000151703716 1418066516 /nfs/dbraw/zinc/06/65/16/1418066516.db2.gz JVVUQXDILJUNFR-UHFFFAOYSA-N 0 0 389.774 3.240 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCn3nc(C(C)C)nc32)c1 ZINC000151708425 1418068049 /nfs/dbraw/zinc/06/80/49/1418068049.db2.gz AJQIPOGYHCRXTA-ZDUSSCGKSA-N 0 0 375.454 3.297 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2nc(-c3ccc(F)c(C)c3)no2)c1 ZINC000151722349 1418071281 /nfs/dbraw/zinc/07/12/81/1418071281.db2.gz VHUJTPBSLUEGHG-UHFFFAOYSA-N 0 0 387.323 3.458 20 5 GGBDRN O=C(C[C@H]1CCCCCN1C(=O)CCn1cc([N+](=O)[O-])cn1)c1ccccc1 ZINC000151725857 1418072095 /nfs/dbraw/zinc/07/20/95/1418072095.db2.gz MSUCFZGYPGEVBU-QGZVFWFLSA-N 0 0 384.436 3.226 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)COc2ccc([N+](=O)[O-])c3ccccc23)cc1 ZINC000151727300 1418072357 /nfs/dbraw/zinc/07/23/57/1418072357.db2.gz NJEAIJGJQDCHAT-UHFFFAOYSA-N 0 0 393.399 3.467 20 5 GGBDRN CC(C)(C)C[C@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccc(F)cc1 ZINC000151730216 1418073287 /nfs/dbraw/zinc/07/32/87/1418073287.db2.gz HSMVCHOUKXMGFW-INIZCTEOSA-N 0 0 377.420 3.407 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000151734105 1418073908 /nfs/dbraw/zinc/07/39/08/1418073908.db2.gz XJAJQZYDQFGNNP-HNNXBMFYSA-N 0 0 379.438 3.160 20 5 GGBDRN CN(C)C(=O)c1cccc(NC(=O)COc2ccc([N+](=O)[O-])c3ccccc23)c1 ZINC000151735842 1418074851 /nfs/dbraw/zinc/07/48/51/1418074851.db2.gz FGAILOFFKWAOBS-UHFFFAOYSA-N 0 0 393.399 3.467 20 5 GGBDRN COc1cccc2c1OC[C@H](NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C2 ZINC000151749335 1418077750 /nfs/dbraw/zinc/07/77/50/1418077750.db2.gz HZCSRYHPLFHVQE-MRXNPFEDSA-N 0 0 397.431 3.281 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000151757662 1418079703 /nfs/dbraw/zinc/07/97/03/1418079703.db2.gz DAADYUJRKIJIOP-HNNXBMFYSA-N 0 0 379.438 3.160 20 5 GGBDRN COc1cc(S(=O)(=O)N2c3ccccc3N(C)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000151763694 1418081164 /nfs/dbraw/zinc/08/11/64/1418081164.db2.gz IOLWJLNZPNYELT-ZDUSSCGKSA-N 0 0 391.449 3.027 20 5 GGBDRN C[C@H]1CCN(C)c2ccccc2N1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000151762490 1418081175 /nfs/dbraw/zinc/08/11/75/1418081175.db2.gz VENRDIVILLETFB-LBPRGKRZSA-N 0 0 379.413 3.158 20 5 GGBDRN O=C(Nc1ccccc1OCC(F)F)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000151771074 1418083233 /nfs/dbraw/zinc/08/32/33/1418083233.db2.gz TXCCJZGCTMUSEC-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H]2CCCn3nc(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000151792249 1418087961 /nfs/dbraw/zinc/08/79/61/1418087961.db2.gz GAOHINRZIGJFKM-GFCCVEGCSA-N 0 0 375.454 3.297 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(C(=O)NCC(C)(C)C)cc1 ZINC000151819555 1418094342 /nfs/dbraw/zinc/09/43/42/1418094342.db2.gz UTNKVWLPRARZLO-UHFFFAOYSA-N 0 0 399.447 3.309 20 5 GGBDRN COc1ccc([C@H](C)CCNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000151825794 1418095335 /nfs/dbraw/zinc/09/53/35/1418095335.db2.gz RWEVKKYUWNZLRH-CQSZACIVSA-N 0 0 395.419 3.108 20 5 GGBDRN COc1ccc([C@H](C)CCNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000151841852 1418099246 /nfs/dbraw/zinc/09/92/46/1418099246.db2.gz LNNORWLAUISIER-CQSZACIVSA-N 0 0 395.419 3.108 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)Cc2cccc(OC(C)C)c2)cccc1[N+](=O)[O-] ZINC000151845508 1418099730 /nfs/dbraw/zinc/09/97/30/1418099730.db2.gz TZUPUSQYUCKMIN-UHFFFAOYSA-N 0 0 385.420 3.288 20 5 GGBDRN C[C@@H](Cc1ccc(O)cc1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000151953198 1418102330 /nfs/dbraw/zinc/10/23/30/1418102330.db2.gz OLCZXWPLGQFFAB-ZDUSSCGKSA-N 0 0 380.404 3.062 20 5 GGBDRN Cc1onc(-c2ccccn2)c1C(=O)OCCN(C)c1ccc([N+](=O)[O-])cc1 ZINC000151954968 1418103360 /nfs/dbraw/zinc/10/33/60/1418103360.db2.gz BAGZAVOCEMDFDN-UHFFFAOYSA-N 0 0 382.376 3.246 20 5 GGBDRN Cc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)c(OC[C@@H]2CCCO2)c1 ZINC000151966224 1418107736 /nfs/dbraw/zinc/10/77/36/1418107736.db2.gz LWOGWAKHLYYNBJ-IBGZPJMESA-N 0 0 384.432 3.320 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[C@@H]3C[C@H](O)c3ccco3)o2)cc1 ZINC000151965081 1418107755 /nfs/dbraw/zinc/10/77/55/1418107755.db2.gz PKMRCADZURPBIO-CVEARBPZSA-N 0 0 384.392 3.326 20 5 GGBDRN CC(C)OC1CCC(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)CC1 ZINC000151979039 1418111546 /nfs/dbraw/zinc/11/15/46/1418111546.db2.gz JMVOWSUHZDHVSB-UHFFFAOYSA-N 0 0 390.484 3.163 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H](O)Cc1ccccc1 ZINC000151981938 1418112097 /nfs/dbraw/zinc/11/20/97/1418112097.db2.gz HUORQZFJJVHYMV-ZBEGNZNMSA-N 0 0 382.338 3.336 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)c2nnc(-c3cccs3)n2C2CC2)c1 ZINC000151981945 1418112103 /nfs/dbraw/zinc/11/21/03/1418112103.db2.gz CLZIYFNFFNPJMY-UHFFFAOYSA-N 0 0 390.446 3.224 20 5 GGBDRN C[C@@H]1COCCN1c1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000152001032 1418116938 /nfs/dbraw/zinc/11/69/38/1418116938.db2.gz LNSKEFAAEQLMNE-OAHLLOKOSA-N 0 0 384.436 3.261 20 5 GGBDRN COc1ccc(CSCC(=O)NC[C@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000152025928 1418124407 /nfs/dbraw/zinc/12/44/07/1418124407.db2.gz VYQCKBVPMOBZMR-NSHDSACASA-N 0 0 393.465 3.361 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@@H](CC(C)C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000152043747 1418128659 /nfs/dbraw/zinc/12/86/59/1418128659.db2.gz NPBRHCZYYHXPCQ-INIZCTEOSA-N 0 0 398.463 3.347 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000152053740 1418131620 /nfs/dbraw/zinc/13/16/20/1418131620.db2.gz IATMWMLMGRVMCM-DOMZBBRYSA-N 0 0 389.481 3.442 20 5 GGBDRN Cc1cnn(-c2ccc(C)cc2NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000152078205 1418138978 /nfs/dbraw/zinc/13/89/78/1418138978.db2.gz MLFSAJBCWAUARN-UHFFFAOYSA-N 0 0 391.431 3.399 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@H](O)Cc1ccccc1 ZINC000152079189 1418139420 /nfs/dbraw/zinc/13/94/20/1418139420.db2.gz MHFSEUMYKXZBSW-IIBYNOLFSA-N 0 0 397.475 3.307 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(Nc2cccc(N3CCCC3)c2)c([N+](=O)[O-])c1 ZINC000152085229 1418140797 /nfs/dbraw/zinc/14/07/97/1418140797.db2.gz IZAJHGRVLHBYFM-UHFFFAOYSA-N 0 0 390.465 3.189 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000152085270 1418141033 /nfs/dbraw/zinc/14/10/33/1418141033.db2.gz VIVHNIYKRJQKQM-UHFFFAOYSA-N 0 0 393.407 3.014 20 5 GGBDRN CCc1nn(C)c(CC)c1S(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000152086654 1418141276 /nfs/dbraw/zinc/14/12/76/1418141276.db2.gz UGOQNIOLQZSTPU-UHFFFAOYSA-N 0 0 394.497 3.052 20 5 GGBDRN CCc1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000152097095 1418145020 /nfs/dbraw/zinc/14/50/20/1418145020.db2.gz RSIUHCQEEMFUER-OAHLLOKOSA-N 0 0 388.445 3.333 20 5 GGBDRN Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])s2)c(OC[C@H]2CCCO2)c1 ZINC000152107235 1418146914 /nfs/dbraw/zinc/14/69/14/1418146914.db2.gz PVFBUYDHSYESKC-CQSZACIVSA-N 0 0 376.434 3.453 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCOCC34CCC4)cc2[N+](=O)[O-])C1 ZINC000152112672 1418148334 /nfs/dbraw/zinc/14/83/34/1418148334.db2.gz UUPWNAWTRNPBTF-HZPDHXFCSA-N 0 0 387.480 3.472 20 5 GGBDRN CC[C@H]1CN(C)c2ccccc2CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000152142494 1418156688 /nfs/dbraw/zinc/15/66/88/1418156688.db2.gz DNVJFHBCKHEHHB-HNNXBMFYSA-N 0 0 384.392 3.374 20 5 GGBDRN C[C@@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](O)Cc1ccccc1 ZINC000152146186 1418157194 /nfs/dbraw/zinc/15/71/94/1418157194.db2.gz CNCCGZIHKTVPFL-DYVFJYSZSA-N 0 0 392.839 3.125 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000152159450 1418160847 /nfs/dbraw/zinc/16/08/47/1418160847.db2.gz XMLAWJJBQBEUKH-CYBMUJFWSA-N 0 0 398.448 3.307 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000152159543 1418161177 /nfs/dbraw/zinc/16/11/77/1418161177.db2.gz XMLAWJJBQBEUKH-ZDUSSCGKSA-N 0 0 398.448 3.307 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@H]2CC[C@H](CO)CC2)CC1 ZINC000152181064 1418166593 /nfs/dbraw/zinc/16/65/93/1418166593.db2.gz ALPJBAGTZUDIOV-IYBDPMFKSA-N 0 0 375.469 3.112 20 5 GGBDRN CSc1ccc(C(=O)Nc2ccnn2-c2nc(C)cc(C)n2)cc1[N+](=O)[O-] ZINC000152180760 1418166689 /nfs/dbraw/zinc/16/66/89/1418166689.db2.gz KGYWNHLJOUUTQE-UHFFFAOYSA-N 0 0 384.421 3.162 20 5 GGBDRN CC(C)(NC(=O)NCc1cccc2c1OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000152188421 1418168558 /nfs/dbraw/zinc/16/85/58/1418168558.db2.gz DANRHBKHYLKMRJ-UHFFFAOYSA-N 0 0 385.420 3.491 20 5 GGBDRN COc1cc(CCNC(=O)CCc2ccc(F)cc2F)c([N+](=O)[O-])cc1OC ZINC000178999466 1429239011 /nfs/dbraw/zinc/23/90/11/1429239011.db2.gz QBLRPKVICYCXTJ-UHFFFAOYSA-N 0 0 394.374 3.182 20 5 GGBDRN COc1ccccc1COC[C@H](O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000152208704 1418173692 /nfs/dbraw/zinc/17/36/92/1418173692.db2.gz CHDILXWKKVBHIO-LJQANCHMSA-N 0 0 383.404 3.045 20 5 GGBDRN O=C(CCc1nc(-c2ccco2)no1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152214043 1418174683 /nfs/dbraw/zinc/17/46/83/1418174683.db2.gz CGLDPBOHNBICMM-UHFFFAOYSA-N 0 0 382.376 3.362 20 5 GGBDRN CC(=O)c1ccc(OC[C@H](O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000152212611 1418174992 /nfs/dbraw/zinc/17/49/92/1418174992.db2.gz MTWMIBFTIRDJGU-LJQANCHMSA-N 0 0 381.388 3.101 20 5 GGBDRN O=C(CCCNC(=O)c1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152216013 1418175362 /nfs/dbraw/zinc/17/53/62/1418175362.db2.gz UHGXLAAHMIZEJH-UHFFFAOYSA-N 0 0 381.432 3.296 20 5 GGBDRN COc1ccc(COC[C@@H](O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000152216517 1418176041 /nfs/dbraw/zinc/17/60/41/1418176041.db2.gz BUFKHQHGFVUERY-IBGZPJMESA-N 0 0 383.404 3.045 20 5 GGBDRN CCc1ccc(S(C)(=O)=O)cc1C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000179001846 1429239843 /nfs/dbraw/zinc/23/98/43/1429239843.db2.gz WOXWQSDJMVSDQQ-LBPRGKRZSA-N 0 0 376.434 3.052 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@H]2CC[C@H](CO)CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000152272786 1418190755 /nfs/dbraw/zinc/19/07/55/1418190755.db2.gz SIJXUWOKFDRXJI-YQQAZPJKSA-N 0 0 398.463 3.444 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1OC)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000152277813 1418192107 /nfs/dbraw/zinc/19/21/07/1418192107.db2.gz ZWEIZTUAYOORJG-UHFFFAOYSA-N 0 0 385.420 3.023 20 5 GGBDRN NC(=O)c1ccc(N2CCC[C@H](c3nc4c(s3)CCCC4)C2)c([N+](=O)[O-])c1 ZINC000152283890 1418194673 /nfs/dbraw/zinc/19/46/73/1418194673.db2.gz WZRRNHVKIMQLLL-ZDUSSCGKSA-N 0 0 386.477 3.413 20 5 GGBDRN CC(C)(C)c1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)n(-c2ncccn2)n1 ZINC000152292535 1418196956 /nfs/dbraw/zinc/19/69/56/1418196956.db2.gz WPUJTLCOEIFIRM-UHFFFAOYSA-N 0 0 398.398 3.188 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000179008688 1429241489 /nfs/dbraw/zinc/24/14/89/1429241489.db2.gz DKVGGSCOBWLLFJ-UHFFFAOYSA-N 0 0 392.799 3.495 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)Oc3cnn(C)c3)cc2[N+](=O)[O-])n1 ZINC000179018282 1429243223 /nfs/dbraw/zinc/24/32/23/1429243223.db2.gz SXBBOBQYIMZSFT-UHFFFAOYSA-N 0 0 376.419 3.464 20 5 GGBDRN CN(C(=O)CCn1c(=O)oc2cc(Cl)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000179024550 1429244940 /nfs/dbraw/zinc/24/49/40/1429244940.db2.gz HAHUDOGKCREHRR-UHFFFAOYSA-N 0 0 375.768 3.209 20 5 GGBDRN O=C(N[C@@H]1CCOC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000179026393 1429245382 /nfs/dbraw/zinc/24/53/82/1429245382.db2.gz IQMSDNTUDMKPCP-CQSZACIVSA-N 0 0 375.812 3.379 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc1Cl ZINC000179027267 1429245396 /nfs/dbraw/zinc/24/53/96/1429245396.db2.gz LULOTAPTJMBSDR-GOSISDBHSA-N 0 0 389.795 3.224 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)OCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000179036439 1429247319 /nfs/dbraw/zinc/24/73/19/1429247319.db2.gz DKFSNCMWNNEHGN-UHFFFAOYSA-N 0 0 391.445 3.107 20 5 GGBDRN COc1ccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000179038087 1429247602 /nfs/dbraw/zinc/24/76/02/1429247602.db2.gz PGUJXOCQLGDYKL-UHFFFAOYSA-N 0 0 385.420 3.486 20 5 GGBDRN CC(=O)Nc1cccc2c1CCN(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000179039676 1429247865 /nfs/dbraw/zinc/24/78/65/1429247865.db2.gz VUFHMWDXIFPPQU-UHFFFAOYSA-N 0 0 392.415 3.162 20 5 GGBDRN CS(=O)(=O)c1cccc(OCc2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000179044803 1429249180 /nfs/dbraw/zinc/24/91/80/1429249180.db2.gz YVTIGVFDSMPFMX-UHFFFAOYSA-N 0 0 386.223 3.340 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@]1(O)CCc2ccccc21 ZINC000179054960 1429251025 /nfs/dbraw/zinc/25/10/25/1429251025.db2.gz PEPPKSXCFVMQCQ-OAQYLSRUSA-N 0 0 383.448 3.051 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2nc(C)c(C)s2)CC1 ZINC000179072239 1429254716 /nfs/dbraw/zinc/25/47/16/1429254716.db2.gz FZZPODAKNYDJHQ-UHFFFAOYSA-N 0 0 391.453 3.031 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1cnc2ccc(F)cc2c1 ZINC000179077610 1429255751 /nfs/dbraw/zinc/25/57/51/1429255751.db2.gz TTYZBFYEMUQDLU-UHFFFAOYSA-N 0 0 378.323 3.320 20 5 GGBDRN CCOC(=O)c1ccc(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000179090911 1429259516 /nfs/dbraw/zinc/25/95/16/1429259516.db2.gz CZWSMUCHCJWQAC-UHFFFAOYSA-N 0 0 381.388 3.112 20 5 GGBDRN C[C@@H]1CN(c2ccc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)cn2)C[C@@H](C)O1 ZINC000179093012 1429260632 /nfs/dbraw/zinc/26/06/32/1429260632.db2.gz OHGMKUYZTGICCO-HUUCEWRRSA-N 0 0 396.447 3.196 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000179120628 1429268316 /nfs/dbraw/zinc/26/83/16/1429268316.db2.gz IIHRIFWKJVWCCO-GOSISDBHSA-N 0 0 394.431 3.194 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cn1cnc(-c2ccccc2)n1 ZINC000179128157 1429271067 /nfs/dbraw/zinc/27/10/67/1429271067.db2.gz HRWGYOARIIPSCZ-UHFFFAOYSA-N 0 0 379.420 3.291 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000179128965 1429271351 /nfs/dbraw/zinc/27/13/51/1429271351.db2.gz DCZDCWHZLPPBQB-UHFFFAOYSA-N 0 0 397.796 3.216 20 5 GGBDRN Cc1ccccc1N1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CC1 ZINC000179132734 1429273282 /nfs/dbraw/zinc/27/32/82/1429273282.db2.gz FURARHKBDRNYGY-UHFFFAOYSA-N 0 0 391.431 3.051 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179161838 1429281941 /nfs/dbraw/zinc/28/19/41/1429281941.db2.gz QBLRXZTZSTVAMP-PMACEKPBSA-N 0 0 392.415 3.431 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179161853 1429281652 /nfs/dbraw/zinc/28/16/52/1429281652.db2.gz QBLRXZTZSTVAMP-UXHICEINSA-N 0 0 392.415 3.431 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC2(CO)CCCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000179179864 1429287500 /nfs/dbraw/zinc/28/75/00/1429287500.db2.gz JAJSHQHGDYVMGE-CQSZACIVSA-N 0 0 384.436 3.198 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC(Oc3ccccc3Cl)CC2)c1[N+](=O)[O-] ZINC000179182361 1429288446 /nfs/dbraw/zinc/28/84/46/1429288446.db2.gz JJWMAVCAXZUNPS-UHFFFAOYSA-N 0 0 378.816 3.217 20 5 GGBDRN Cc1cc(=O)oc2cc(NC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)ccc12 ZINC000179205872 1429294486 /nfs/dbraw/zinc/29/44/86/1429294486.db2.gz HOQFOWYHAZRPAN-UHFFFAOYSA-N 0 0 390.355 3.448 20 5 GGBDRN C[C@@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000179213537 1429296702 /nfs/dbraw/zinc/29/67/02/1429296702.db2.gz GKLZYXDAJXJIGV-DNVCBOLYSA-N 0 0 396.447 3.146 20 5 GGBDRN CCCCN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCS(=O)(=O)C1 ZINC000179231295 1429300564 /nfs/dbraw/zinc/30/05/64/1429300564.db2.gz OECVFVSIHGAWBS-KRWDZBQOSA-N 0 0 393.465 3.039 20 5 GGBDRN CCCCN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCS(=O)(=O)C1 ZINC000179231280 1429300780 /nfs/dbraw/zinc/30/07/80/1429300780.db2.gz OECVFVSIHGAWBS-QGZVFWFLSA-N 0 0 393.465 3.039 20 5 GGBDRN Cn1c(Cl)cnc1C[S@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179234430 1429301340 /nfs/dbraw/zinc/30/13/40/1429301340.db2.gz ZVPUTRGSDQAGRW-RUZDIDTESA-N 0 0 380.813 3.086 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@H]1CCOC1)c1ccccc1 ZINC000179253100 1429305963 /nfs/dbraw/zinc/30/59/63/1429305963.db2.gz GLPHPKMBRVUFQE-GUYCJALGSA-N 0 0 375.812 3.307 20 5 GGBDRN O=C(N[C@@H]1CCOC1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000179265308 1429308415 /nfs/dbraw/zinc/30/84/15/1429308415.db2.gz VOHOUJZWRHUWJS-CYBMUJFWSA-N 0 0 375.812 3.379 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000179282500 1429313033 /nfs/dbraw/zinc/31/30/33/1429313033.db2.gz FZWMSAYSQDCUEO-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2ccc(OC)c(Cl)c2)cc1[N+](=O)[O-] ZINC000179270700 1429309635 /nfs/dbraw/zinc/30/96/35/1429309635.db2.gz YYGGBLJRTMHLSY-UHFFFAOYSA-N 0 0 399.856 3.119 20 5 GGBDRN Cc1cccc(OCCN(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000179283389 1429313653 /nfs/dbraw/zinc/31/36/53/1429313653.db2.gz WGCPNKHCWVCIQR-UHFFFAOYSA-N 0 0 380.404 3.240 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(Br)nc1 ZINC000179315542 1429326107 /nfs/dbraw/zinc/32/61/07/1429326107.db2.gz QSGVLXCEHYVFGC-UHFFFAOYSA-N 0 0 375.182 3.415 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179316940 1429326424 /nfs/dbraw/zinc/32/64/24/1429326424.db2.gz JTPUSSOATHAIRW-HXPMCKFVSA-N 0 0 385.395 3.386 20 5 GGBDRN CCOc1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1OC ZINC000179323407 1429329142 /nfs/dbraw/zinc/32/91/42/1429329142.db2.gz SSFUQNSLJYGMTM-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000179324671 1429329317 /nfs/dbraw/zinc/32/93/17/1429329317.db2.gz BCJDAYUGERWMKR-UHFFFAOYSA-N 0 0 382.342 3.102 20 5 GGBDRN O=C(NCc1ccc(OC(F)F)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179324958 1429329425 /nfs/dbraw/zinc/32/94/25/1429329425.db2.gz NHKAZNPWSDJXOZ-UHFFFAOYSA-N 0 0 388.330 3.312 20 5 GGBDRN 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ZINC000179429117 1429372106 /nfs/dbraw/zinc/37/21/06/1429372106.db2.gz PPDYHVQCUASYFN-UHFFFAOYSA-N 0 0 392.415 3.493 20 5 GGBDRN CNS(=O)(=O)c1ccc(NCCCCc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000179462456 1429384531 /nfs/dbraw/zinc/38/45/31/1429384531.db2.gz OSJKMJYWMFYHNJ-UHFFFAOYSA-N 0 0 381.429 3.077 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)Nc2ncccc2-c2ccccc2)cc([N+](=O)[O-])c1 ZINC000179471779 1429386180 /nfs/dbraw/zinc/38/61/80/1429386180.db2.gz CCCZECQPTKDMLL-UHFFFAOYSA-N 0 0 397.412 3.313 20 5 GGBDRN CCCCNC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC)CC1 ZINC000179494828 1429393869 /nfs/dbraw/zinc/39/38/69/1429393869.db2.gz QJIZWIOQHLVDJW-UHFFFAOYSA-N 0 0 393.509 3.475 20 5 GGBDRN C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2ccccc21 ZINC000179498666 1429396419 /nfs/dbraw/zinc/39/64/19/1429396419.db2.gz GAVTWMNRUNFMTF-AWEZNQCLSA-N 0 0 378.432 3.186 20 5 GGBDRN COCCCNC(=O)C1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000179509639 1429402629 /nfs/dbraw/zinc/40/26/29/1429402629.db2.gz 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ZINC000153292056 1422444542 /nfs/dbraw/zinc/44/45/42/1422444542.db2.gz WUNSQWZUTWWDBA-UHFFFAOYSA-N 0 0 378.381 3.252 20 5 GGBDRN O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)N[C@H]1CCCc2cc(F)ccc21 ZINC000153294382 1422447269 /nfs/dbraw/zinc/44/72/69/1422447269.db2.gz YLBXXPWZAVVWTL-INIZCTEOSA-N 0 0 386.379 3.241 20 5 GGBDRN CCOCc1ccc(Nc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])cc1 ZINC000153305550 1422454525 /nfs/dbraw/zinc/45/45/25/1422454525.db2.gz AEKYJEOYWVLKQB-UHFFFAOYSA-N 0 0 379.438 3.125 20 5 GGBDRN CCN(C[C@@H]1COc2ccccc2O1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000153307907 1422458703 /nfs/dbraw/zinc/45/87/03/1422458703.db2.gz QRFYUOPKSXSSCC-CQSZACIVSA-N 0 0 393.399 3.445 20 5 GGBDRN Cc1ccccc1NC(=O)COC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000153335836 1422477531 /nfs/dbraw/zinc/47/75/31/1422477531.db2.gz YIPGEKXMIFTYFC-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN Cc1cccc(NC(=O)COC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000153343231 1422480447 /nfs/dbraw/zinc/48/04/47/1422480447.db2.gz 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ZINC000153504197 1422574822 /nfs/dbraw/zinc/57/48/22/1422574822.db2.gz PKXXKQANNCKBTG-KRWDZBQOSA-N 0 0 394.786 3.269 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC[C@H](O)COc1cccc(C(F)(F)F)c1 ZINC000153510293 1422577912 /nfs/dbraw/zinc/57/79/12/1422577912.db2.gz WEHVFYJYMSYITP-CYBMUJFWSA-N 0 0 387.310 3.441 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000153510403 1422578129 /nfs/dbraw/zinc/57/81/29/1422578129.db2.gz WEHVFYJYMSYITP-ZDUSSCGKSA-N 0 0 387.310 3.441 20 5 GGBDRN COc1ccc([C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000153515911 1422579694 /nfs/dbraw/zinc/57/96/94/1422579694.db2.gz KIYSNALRJACRPD-QGZVFWFLSA-N 0 0 392.843 3.137 20 5 GGBDRN Cc1nn(CCC(=O)N2CCOc3ccc(C(F)(F)F)cc32)c(C)c1[N+](=O)[O-] ZINC000153516974 1422581467 /nfs/dbraw/zinc/58/14/67/1422581467.db2.gz DBUPETFFVLODEY-UHFFFAOYSA-N 0 0 398.341 3.243 20 5 GGBDRN O=C(NCc1nnc(-c2ccccc2)s1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153520427 1422582646 /nfs/dbraw/zinc/58/26/46/1422582646.db2.gz DYXVDINIAQZZOB-UHFFFAOYSA-N 0 0 395.444 3.381 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153523594 1422584308 /nfs/dbraw/zinc/58/43/08/1422584308.db2.gz DDLGQEKXZDNULE-UHFFFAOYSA-N 0 0 380.807 3.113 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000153529302 1422588236 /nfs/dbraw/zinc/58/82/36/1422588236.db2.gz VWLRGEQNMBOWEG-SPGJAERMSA-N 0 0 380.828 3.089 20 5 GGBDRN C[C@@]1(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCCO1 ZINC000153533962 1422591937 /nfs/dbraw/zinc/59/19/37/1422591937.db2.gz MMNMPGCXAYXSQW-ZDUSSCGKSA-N 0 0 377.622 3.310 20 5 GGBDRN CCC[C@@H](Nc1cccc(C(=O)NCCC(N)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000179797480 1429570960 /nfs/dbraw/zinc/57/09/60/1429570960.db2.gz ZGSLNLIBBHUAQR-GOSISDBHSA-N 0 0 384.436 3.153 20 5 GGBDRN Cc1cccc([C@H](O)CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000153551930 1422607309 /nfs/dbraw/zinc/60/73/09/1422607309.db2.gz ISGZTBJTPCBUHC-QGZVFWFLSA-N 0 0 383.429 3.490 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cccc(-c3ncco3)c2)cc1[N+](=O)[O-] ZINC000153557496 1422612079 /nfs/dbraw/zinc/61/20/79/1422612079.db2.gz NEVRDRUMCWBQFQ-ZDUSSCGKSA-N 0 0 394.387 3.374 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cccc(-c3ncco3)c2)cc1[N+](=O)[O-] ZINC000153557393 1422612251 /nfs/dbraw/zinc/61/22/51/1422612251.db2.gz NEVRDRUMCWBQFQ-CYBMUJFWSA-N 0 0 394.387 3.374 20 5 GGBDRN CC(C)(C(=O)N1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000153564306 1422620089 /nfs/dbraw/zinc/62/00/89/1422620089.db2.gz ONYOOJYDKFSODA-UHFFFAOYSA-N 0 0 388.855 3.270 20 5 GGBDRN O=C(c1cccc(Cn2cc(Cl)cc([N+](=O)[O-])c2=O)c1)N1CCCCC1 ZINC000153575609 1422627340 /nfs/dbraw/zinc/62/73/40/1422627340.db2.gz KLOVKTMCPJBDEE-UHFFFAOYSA-N 0 0 375.812 3.084 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153576982 1422628685 /nfs/dbraw/zinc/62/86/85/1422628685.db2.gz AOTVOPFOMJRFNO-UHFFFAOYSA-N 0 0 385.449 3.386 20 5 GGBDRN C[C@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1ccc2ccccc2c1 ZINC000153590493 1422636161 /nfs/dbraw/zinc/63/61/61/1422636161.db2.gz RBUALOWFYVSVPT-LBPRGKRZSA-N 0 0 385.807 3.441 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cnc1NCc1ccc(S(=O)(=O)N2CCCC2)cc1 ZINC000153593867 1422637164 /nfs/dbraw/zinc/63/71/64/1422637164.db2.gz VHIFDPJTANFTFR-UHFFFAOYSA-N 0 0 396.856 3.040 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc2[nH]c(-c3cccc(F)c3)nc2c1 ZINC000179801014 1429574201 /nfs/dbraw/zinc/57/42/01/1429574201.db2.gz GVMANEKVSKRAHF-UHFFFAOYSA-N 0 0 380.339 3.263 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@@H](COC)c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000179800733 1429574237 /nfs/dbraw/zinc/57/42/37/1429574237.db2.gz RTABJOGPTCIHHV-AWEZNQCLSA-N 0 0 381.335 3.244 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCCc1csc(-c2ccc(Cl)cc2)n1 ZINC000179801244 1429574715 /nfs/dbraw/zinc/57/47/15/1429574715.db2.gz QMJOVRWLVUYTRM-UHFFFAOYSA-N 0 0 391.840 3.078 20 5 GGBDRN Cc1cc(NC(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)ccc1[N+](=O)[O-] ZINC000153612699 1422647560 /nfs/dbraw/zinc/64/75/60/1422647560.db2.gz NBHSWDAMOYUJTH-MRXNPFEDSA-N 0 0 398.463 3.446 20 5 GGBDRN CC(C)C[C@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1ccccc1 ZINC000153613349 1422648935 /nfs/dbraw/zinc/64/89/35/1422648935.db2.gz XIKSZOMDGGEVHT-HNNXBMFYSA-N 0 0 377.828 3.314 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCC[C@H](c4nnc5n4CCC5)C3)co2)cc1 ZINC000153612942 1422649585 /nfs/dbraw/zinc/64/95/85/1422649585.db2.gz QQBJTFRALHDWEC-HNNXBMFYSA-N 0 0 394.435 3.167 20 5 GGBDRN CCN(Cc1ccc2c(c1)OCO2)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000153620923 1422654099 /nfs/dbraw/zinc/65/40/99/1422654099.db2.gz GCQLMDJNXVGVQB-CQSZACIVSA-N 0 0 385.420 3.481 20 5 GGBDRN O=C(NCCOc1ccc(Cl)cn1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000153629749 1422659020 /nfs/dbraw/zinc/65/90/20/1422659020.db2.gz FAHZYKDDMYWOMB-UHFFFAOYSA-N 0 0 390.827 3.052 20 5 GGBDRN C[C@@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1ccc2c(c1)CCCC2 ZINC000153632818 1422661489 /nfs/dbraw/zinc/66/14/89/1422661489.db2.gz ZXKVCQZPTWUWSX-GFCCVEGCSA-N 0 0 389.839 3.166 20 5 GGBDRN COC(=O)c1ccc(OC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000153639753 1422667150 /nfs/dbraw/zinc/66/71/50/1422667150.db2.gz HAOUKLUCVHLZLB-AWEZNQCLSA-N 0 0 399.321 3.383 20 5 GGBDRN CC(C)CCn1c(=O)c2ccccc2nc1SCCn1cc([N+](=O)[O-])cn1 ZINC000153644213 1422671534 /nfs/dbraw/zinc/67/15/34/1422671534.db2.gz YNDPNWIGWBQHFC-UHFFFAOYSA-N 0 0 387.465 3.340 20 5 GGBDRN Cn1c(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)nc2c1cccc2F ZINC000153645654 1422673996 /nfs/dbraw/zinc/67/39/96/1422673996.db2.gz PYYMSADYAAKGHN-UHFFFAOYSA-N 0 0 393.378 3.141 20 5 GGBDRN Cc1cc(NC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1[N+](=O)[O-] ZINC000153649100 1422677891 /nfs/dbraw/zinc/67/78/91/1422677891.db2.gz RVBUPQIUGDHHDG-SFHVURJKSA-N 0 0 396.447 3.258 20 5 GGBDRN Cc1cc(NC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1[N+](=O)[O-] ZINC000153649177 1422677894 /nfs/dbraw/zinc/67/78/94/1422677894.db2.gz RVBUPQIUGDHHDG-GOSISDBHSA-N 0 0 396.447 3.258 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)CC3(O)CCCC3)cc2[N+](=O)[O-])C1 ZINC000153658034 1422683839 /nfs/dbraw/zinc/68/38/39/1422683839.db2.gz FHTSDIGCTXRDEH-HOTGVXAUSA-N 0 0 389.496 3.454 20 5 GGBDRN Cc1cc(NC(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000153662744 1422686845 /nfs/dbraw/zinc/68/68/45/1422686845.db2.gz RZNCEXJUPLOYPS-SFHVURJKSA-N 0 0 396.447 3.258 20 5 GGBDRN O=C(c1cc2ccccc2[nH]1)N1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153664561 1422689717 /nfs/dbraw/zinc/68/97/17/1422689717.db2.gz JLAWWLWTHONVNX-UHFFFAOYSA-N 0 0 385.811 3.087 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@H](c1nc(C2CC2)no1)C(C)C ZINC000179805509 1429578527 /nfs/dbraw/zinc/57/85/27/1429578527.db2.gz JRWMQANJCGFIHE-KRWDZBQOSA-N 0 0 387.440 3.479 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC000153679316 1422699975 /nfs/dbraw/zinc/69/99/75/1422699975.db2.gz HLDUZDZFTGDWON-UHFFFAOYSA-N 0 0 386.799 3.472 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)s1 ZINC000153679323 1422700101 /nfs/dbraw/zinc/70/01/01/1422700101.db2.gz WAZSCEBYXLUNPE-UHFFFAOYSA-N 0 0 388.449 3.263 20 5 GGBDRN COc1cc(NC(C)=O)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000153683634 1422700437 /nfs/dbraw/zinc/70/04/37/1422700437.db2.gz MWRSBIIPTQSHLX-UHFFFAOYSA-N 0 0 377.784 3.396 20 5 GGBDRN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@H](O)COCc1ccccc1 ZINC000153704190 1422710837 /nfs/dbraw/zinc/71/08/37/1422710837.db2.gz XSTWENLAKURORI-FQEVSTJZSA-N 0 0 397.431 3.259 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COC2CCOCC2)c(Cc2ccccc2)c1 ZINC000153708000 1422713646 /nfs/dbraw/zinc/71/36/46/1422713646.db2.gz SMSKBLJNLIQYHK-IBGZPJMESA-N 0 0 387.432 3.121 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000153717094 1422718971 /nfs/dbraw/zinc/71/89/71/1422718971.db2.gz UDCSXUHCOWNGRR-CABCVRRESA-N 0 0 376.457 3.452 20 5 GGBDRN O=C(c1ccc(F)cc1F)N1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153723745 1422722738 /nfs/dbraw/zinc/72/27/38/1422722738.db2.gz FUHDCHPAHPTZRC-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN C[C@H](CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Cn1ccnc1 ZINC000153726969 1422725329 /nfs/dbraw/zinc/72/53/29/1422725329.db2.gz BXVDNJUUAOPTRE-GFCCVEGCSA-N 0 0 399.373 3.065 20 5 GGBDRN O=C(Cc1ccc(F)cc1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000153738770 1422731787 /nfs/dbraw/zinc/73/17/87/1422731787.db2.gz MUVUGMITVIODJE-UHFFFAOYSA-N 0 0 376.359 3.486 20 5 GGBDRN O=[N+]([O-])c1c(NCCS(=O)(=O)c2ccc(F)cc2)ccc2ncccc21 ZINC000153754547 1422739403 /nfs/dbraw/zinc/73/94/03/1422739403.db2.gz XHNDZAQZPUHXCU-UHFFFAOYSA-N 0 0 375.381 3.168 20 5 GGBDRN Cc1cc(NC(=O)N2CCOC[C@H]2C[C@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000153768755 1422745433 /nfs/dbraw/zinc/74/54/33/1422745433.db2.gz SZUQLBDKMWPTRL-ZBFHGGJFSA-N 0 0 391.449 3.321 20 5 GGBDRN Cc1cc(NC(=O)Nc2ccc(CCS(C)(=O)=O)cc2)ccc1[N+](=O)[O-] ZINC000153774374 1422749109 /nfs/dbraw/zinc/74/91/09/1422749109.db2.gz XLWWLDCIMOJNDA-UHFFFAOYSA-N 0 0 377.422 3.134 20 5 GGBDRN CCc1cc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2ccccc2n1 ZINC000153781956 1422754424 /nfs/dbraw/zinc/75/44/24/1422754424.db2.gz ZQZPLCKLIIODDH-UHFFFAOYSA-N 0 0 399.428 3.361 20 5 GGBDRN CCNC(=O)COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000153783935 1422756383 /nfs/dbraw/zinc/75/63/83/1422756383.db2.gz UFCOGSRTESJTJN-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN Cc1cc(NC(=O)N2CCC(OC[C@H]3CCCCO3)CC2)ccc1[N+](=O)[O-] ZINC000153796420 1422762720 /nfs/dbraw/zinc/76/27/20/1422762720.db2.gz SOKBYRVVXTZMQI-QGZVFWFLSA-N 0 0 377.441 3.485 20 5 GGBDRN O=C(NC[C@@H](O)c1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000153796958 1422763397 /nfs/dbraw/zinc/76/33/97/1422763397.db2.gz LYNOAZSJYNKEGC-CYBMUJFWSA-N 0 0 399.628 3.474 20 5 GGBDRN O=C(NC[C@H](O)c1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000153797065 1422763916 /nfs/dbraw/zinc/76/39/16/1422763916.db2.gz LYNOAZSJYNKEGC-ZDUSSCGKSA-N 0 0 399.628 3.474 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2)nc1 ZINC000153811368 1422771293 /nfs/dbraw/zinc/77/12/93/1422771293.db2.gz HSXHCYXEHIDULL-HNNXBMFYSA-N 0 0 397.435 3.489 20 5 GGBDRN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000153810629 1422772242 /nfs/dbraw/zinc/77/22/42/1422772242.db2.gz WDGIZHWKIYHGQV-HNNXBMFYSA-N 0 0 384.436 3.082 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153821932 1422779758 /nfs/dbraw/zinc/77/97/58/1422779758.db2.gz CCHBMEGAOAIJBP-RHSMWYFYSA-N 0 0 375.425 3.322 20 5 GGBDRN CC(=O)c1ccc(OC[C@H](O)Cn2cnc3cc(C)c(C)cc32)c([N+](=O)[O-])c1 ZINC000153838733 1422791509 /nfs/dbraw/zinc/79/15/09/1422791509.db2.gz SHDBKPQCBPVGAR-MRXNPFEDSA-N 0 0 383.404 3.204 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)nc1 ZINC000153839278 1422792756 /nfs/dbraw/zinc/79/27/56/1422792756.db2.gz SNHBYAPLKBBMGA-UHFFFAOYSA-N 0 0 397.435 3.489 20 5 GGBDRN CC(=O)c1ccc(OC[C@H](O)COCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000153841213 1422793781 /nfs/dbraw/zinc/79/37/81/1422793781.db2.gz JNCTWWVEXKDIES-MRXNPFEDSA-N 0 0 379.796 3.407 20 5 GGBDRN COc1ccccc1-c1noc([C@@H](C)NC(=O)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000153849973 1422797393 /nfs/dbraw/zinc/79/73/93/1422797393.db2.gz ADDPCMKXXYVHLA-CYBMUJFWSA-N 0 0 396.403 3.463 20 5 GGBDRN COc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)c1OC ZINC000153852663 1422798383 /nfs/dbraw/zinc/79/83/83/1422798383.db2.gz LAVRXUIMHGIYSF-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=C(Cc1cccc(Cl)c1)N1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153855371 1422799346 /nfs/dbraw/zinc/79/93/46/1422799346.db2.gz MQEQEDKYONGCSM-UHFFFAOYSA-N 0 0 395.246 3.188 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OC[C@H](O)COc1cccc(C(F)(F)F)c1 ZINC000153859863 1422800687 /nfs/dbraw/zinc/80/06/87/1422800687.db2.gz KVQUMAZLXJNUEM-CYBMUJFWSA-N 0 0 387.310 3.441 20 5 GGBDRN COc1ccc([C@@H](CO)N(C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000153878980 1422804252 /nfs/dbraw/zinc/80/42/52/1422804252.db2.gz PDFJGTUBBIWMAS-LJQANCHMSA-N 0 0 383.404 3.424 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCC[C@H](CCCc2ccccc2)C1 ZINC000153881255 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399.513 3.025 20 5 GGBDRN CCOc1cc(NC(=O)CCc2cncc(F)c2)c([N+](=O)[O-])cc1OCC ZINC000153924326 1422811716 /nfs/dbraw/zinc/81/17/16/1422811716.db2.gz HURWZHWCUBGPIS-UHFFFAOYSA-N 0 0 377.372 3.498 20 5 GGBDRN COc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1F ZINC000153930044 1422812678 /nfs/dbraw/zinc/81/26/78/1422812678.db2.gz WYGKTXLGXBOXJC-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N3CCOC[C@@H]3C[C@@H](O)c3ccccc3)ccc2c1 ZINC000153983194 1422820738 /nfs/dbraw/zinc/82/07/38/1422820738.db2.gz HBDYHBKYSZOKSL-AZUAARDMSA-N 0 0 379.416 3.472 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000153983856 1422820919 /nfs/dbraw/zinc/82/09/19/1422820919.db2.gz IJSZDECNSIRAJX-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCN(C(=O)C2CCCCC2)C1 ZINC000179817355 1429589523 /nfs/dbraw/zinc/58/95/23/1429589523.db2.gz ZOLZMUWNSPEXPY-KRWDZBQOSA-N 0 0 387.480 3.431 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC000154002035 1422823819 /nfs/dbraw/zinc/82/38/19/1422823819.db2.gz NJIYXGCAMRJQSF-HOTGVXAUSA-N 0 0 381.860 3.466 20 5 GGBDRN O=C(c1ccc(-c2ccco2)[nH]c1=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154004156 1422823927 /nfs/dbraw/zinc/82/39/27/1422823927.db2.gz CDOSQGHNMRLJSJ-UHFFFAOYSA-N 0 0 379.372 3.348 20 5 GGBDRN CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000154007857 1422824546 /nfs/dbraw/zinc/82/45/46/1422824546.db2.gz SWJZZBUHJRASPS-UHFFFAOYSA-N 0 0 394.836 3.245 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154017178 1422826109 /nfs/dbraw/zinc/82/61/09/1422826109.db2.gz YWUMFPPORCXHJK-UHFFFAOYSA-N 0 0 385.376 3.463 20 5 GGBDRN CS[C@H]1CCCCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000154019048 1422826632 /nfs/dbraw/zinc/82/66/32/1422826632.db2.gz QLCVDUNXPAIXGI-AWEZNQCLSA-N 0 0 393.465 3.027 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(-n2nnnc2C)c1 ZINC000154039198 1422829948 /nfs/dbraw/zinc/82/99/48/1422829948.db2.gz VVLJJAAUPXJRCX-UHFFFAOYSA-N 0 0 384.421 3.243 20 5 GGBDRN C[C@@H](COc1ccc(F)cc1F)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000154057223 1422832992 /nfs/dbraw/zinc/83/29/92/1422832992.db2.gz AEGMOLMONWLZOF-LBPRGKRZSA-N 0 0 391.374 3.408 20 5 GGBDRN CS(=O)(=O)Nc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000154059075 1422833598 /nfs/dbraw/zinc/83/35/98/1422833598.db2.gz XEUOJCDYIUGREE-UHFFFAOYSA-N 0 0 397.840 3.191 20 5 GGBDRN CCc1nsc(N2CCCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)n1 ZINC000154089038 1422838642 /nfs/dbraw/zinc/83/86/42/1422838642.db2.gz WFSPSRNCOGVWEP-UHFFFAOYSA-N 0 0 381.889 3.374 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC000154125474 1422843792 /nfs/dbraw/zinc/84/37/92/1422843792.db2.gz KWYIBFNDAIUHPJ-ZDUSSCGKSA-N 0 0 383.832 3.281 20 5 GGBDRN CC(=O)c1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)cc1C ZINC000154134514 1422844827 /nfs/dbraw/zinc/84/48/27/1422844827.db2.gz PMNSOCMHZQSPDG-ZDUSSCGKSA-N 0 0 399.378 3.237 20 5 GGBDRN CC(C)CO[C@@H]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000154146087 1422846438 /nfs/dbraw/zinc/84/64/38/1422846438.db2.gz SCWCDCNDMYPCFX-QGZVFWFLSA-N 0 0 378.472 3.428 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2ccc(Br)cc2)cc1F ZINC000154183558 1422851751 /nfs/dbraw/zinc/85/17/51/1422851751.db2.gz BDEUQERAKQEGEL-NSHDSACASA-N 0 0 386.173 3.315 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000154184335 1422851922 /nfs/dbraw/zinc/85/19/22/1422851922.db2.gz MMGRIVKHJNSRRH-CQSZACIVSA-N 0 0 387.436 3.461 20 5 GGBDRN Cc1cccc2c(CCC(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)c[nH]c21 ZINC000154195778 1422853463 /nfs/dbraw/zinc/85/34/63/1422853463.db2.gz QYBMXKYWFZPONB-UHFFFAOYSA-N 0 0 381.388 3.499 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cc21 ZINC000154207914 1422855190 /nfs/dbraw/zinc/85/51/90/1422855190.db2.gz INRZXERRJDIEDH-BJMVGYQFSA-N 0 0 380.404 3.339 20 5 GGBDRN CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000154219571 1422857317 /nfs/dbraw/zinc/85/73/17/1422857317.db2.gz GPDVMTYSOIDKTL-QZTJIDSGSA-N 0 0 389.839 3.019 20 5 GGBDRN CCOCc1ccccc1CNS(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000154257494 1422862797 /nfs/dbraw/zinc/86/27/97/1422862797.db2.gz MPDHLOWQIIWHQE-UHFFFAOYSA-N 0 0 382.413 3.057 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)c1cc(F)c([N+](=O)[O-])cc1F)CC2 ZINC000154261435 1422863394 /nfs/dbraw/zinc/86/33/94/1422863394.db2.gz CYEXLBZJUUKMBT-UHFFFAOYSA-N 0 0 378.331 3.089 20 5 GGBDRN CC1(C)CCCC[C@@H]1CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000154283318 1422866615 /nfs/dbraw/zinc/86/66/15/1422866615.db2.gz FPWDPWQZVMXTSM-QGZVFWFLSA-N 0 0 387.480 3.486 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2nc3ccccc3s2)cc([N+](=O)[O-])c1F ZINC000154287227 1422867399 /nfs/dbraw/zinc/86/73/99/1422867399.db2.gz KLBRNASHGACDHM-UHFFFAOYSA-N 0 0 381.410 3.131 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000154294088 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CJGNLKQUCYPDPE-QFIPXVFZSA-N 0 0 395.459 3.487 20 5 GGBDRN C[C@@H]1COCCN1c1ccc(NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)cc1 ZINC000155472376 1423378823 /nfs/dbraw/zinc/37/88/23/1423378823.db2.gz XKGMLQKPPOXVKZ-LLVKDONJSA-N 0 0 377.347 3.350 20 5 GGBDRN CCNc1ccc(C(=O)Nc2cccn(CC(F)(F)F)c2=O)cc1[N+](=O)[O-] ZINC000155475291 1423379506 /nfs/dbraw/zinc/37/95/06/1423379506.db2.gz RDCUHOQVKWKJLN-UHFFFAOYSA-N 0 0 384.314 3.003 20 5 GGBDRN O=C(NC[C@@H]1CCCC[C@H]1O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000155479050 1423381470 /nfs/dbraw/zinc/38/14/70/1423381470.db2.gz WFJNMUABRCZPQX-FXAWDEMLSA-N 0 0 383.448 3.488 20 5 GGBDRN Cc1c(C(=O)NCC2([C@H](O)c3ccccc3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000155492376 1423385805 /nfs/dbraw/zinc/38/58/05/1423385805.db2.gz YXXMIIUJUMOMDB-QGZVFWFLSA-N 0 0 385.376 3.055 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)C)cc1NCc1c(Cl)cccc1[N+](=O)[O-] ZINC000155494324 1423386359 /nfs/dbraw/zinc/38/63/59/1423386359.db2.gz OKRDIOATFFUNIZ-UHFFFAOYSA-N 0 0 399.856 3.119 20 5 GGBDRN CN(CCOc1cccc([N+](=O)[O-])c1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155498471 1423387288 /nfs/dbraw/zinc/38/72/88/1423387288.db2.gz LMPBSURRKOXOJI-INIZCTEOSA-N 0 0 396.852 3.087 20 5 GGBDRN O=C(c1ccccc1NCc1c(Cl)cccc1[N+](=O)[O-])N1CCOCC1 ZINC000155503086 1423390377 /nfs/dbraw/zinc/39/03/77/1423390377.db2.gz HBDGCWIPSFXQQE-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCO[C@]2(CCc3ccccc32)C1 ZINC000155518663 1423396482 /nfs/dbraw/zinc/39/64/82/1423396482.db2.gz VNKBNCFKWAEERV-JOCHJYFZSA-N 0 0 393.443 3.483 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H](O)c2ccsc2)CC1 ZINC000155526189 1423400215 /nfs/dbraw/zinc/40/02/15/1423400215.db2.gz NKSMWQHCZVGFTM-GOSISDBHSA-N 0 0 389.477 3.356 20 5 GGBDRN CN(CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155534633 1423404814 /nfs/dbraw/zinc/40/48/14/1423404814.db2.gz ZRQRCROUXNXXHL-INIZCTEOSA-N 0 0 396.852 3.087 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000155535060 1423404890 /nfs/dbraw/zinc/40/48/90/1423404890.db2.gz YMMOYINXMRVGDH-FQEVSTJZSA-N 0 0 384.457 3.387 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1CCCC[C@H]1O ZINC000155535519 1423405878 /nfs/dbraw/zinc/40/58/78/1423405878.db2.gz KYTVFMJEVMNFER-XHDPSFHLSA-N 0 0 389.374 3.083 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)COc2ccccc2[N+](=O)[O-])n1 ZINC000155536428 1423405943 /nfs/dbraw/zinc/40/59/43/1423405943.db2.gz GSRNDWLMEGKUFK-UHFFFAOYSA-N 0 0 380.404 3.093 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@H](O)COCc2ccccc2Cl)c1 ZINC000155537363 1423406666 /nfs/dbraw/zinc/40/66/66/1423406666.db2.gz UQMXYAQEHWPDTQ-OAHLLOKOSA-N 0 0 380.828 3.271 20 5 GGBDRN CC[C@H](CO)NC(=O)Cc1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000155544070 1423410584 /nfs/dbraw/zinc/41/05/84/1423410584.db2.gz SKDCQXMUTIKGCK-CQSZACIVSA-N 0 0 391.855 3.290 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)n1 ZINC000155550730 1423414212 /nfs/dbraw/zinc/41/42/12/1423414212.db2.gz ZDJWSPIXYAWITE-UHFFFAOYSA-N 0 0 393.447 3.393 20 5 GGBDRN CC1(C)CCCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1 ZINC000155558721 1423417402 /nfs/dbraw/zinc/41/74/02/1423417402.db2.gz OILVSPDTPMZYJC-UHFFFAOYSA-N 0 0 375.425 3.322 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000155567069 1423421825 /nfs/dbraw/zinc/42/18/25/1423421825.db2.gz UDEOYOYCTYLXAH-LBPRGKRZSA-N 0 0 398.419 3.097 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1c(C)noc1C ZINC000155572665 1423425454 /nfs/dbraw/zinc/42/54/54/1423425454.db2.gz DYIREKQLAYDHHV-GFCCVEGCSA-N 0 0 380.788 3.059 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@]2(CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000155602614 1423440163 /nfs/dbraw/zinc/44/01/63/1423440163.db2.gz ZBKIOMYNNUHJJS-LJQANCHMSA-N 0 0 393.415 3.207 20 5 GGBDRN CS(=O)(=O)c1cc(SCc2cc3ccccc3[nH]c2=O)ccc1[N+](=O)[O-] ZINC000155608705 1423444029 /nfs/dbraw/zinc/44/40/29/1423444029.db2.gz XZNXOJYVDZVDHZ-UHFFFAOYSA-N 0 0 390.442 3.132 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@H](c2ccsc2)O1 ZINC000155609813 1423444122 /nfs/dbraw/zinc/44/41/22/1423444122.db2.gz UKMQGBBFPOFEIO-YVEFUNNKSA-N 0 0 375.450 3.325 20 5 GGBDRN O=C(OC[C@@H]1CCN(c2ccccc2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000155614143 1423446052 /nfs/dbraw/zinc/44/60/52/1423446052.db2.gz FXVDJMQWRUWPHJ-MRXNPFEDSA-N 0 0 392.415 3.464 20 5 GGBDRN O=C(COC/C=C/c1ccccc1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000155630362 1423456921 /nfs/dbraw/zinc/45/69/21/1423456921.db2.gz AMKZAIJIUKMDPR-QPJJXVBHSA-N 0 0 378.388 3.449 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000179924023 1429643970 /nfs/dbraw/zinc/64/39/70/1429643970.db2.gz FUGQQHUBODVAAV-AWEZNQCLSA-N 0 0 375.812 3.266 20 5 GGBDRN Cc1onc(-c2ccncc2)c1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000155653988 1423470814 /nfs/dbraw/zinc/47/08/14/1423470814.db2.gz XXLHXSLQKRNAGG-UHFFFAOYSA-N 0 0 395.419 3.494 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000179926829 1429645112 /nfs/dbraw/zinc/64/51/12/1429645112.db2.gz HTCDPEVQBFMFIN-CYBMUJFWSA-N 0 0 375.812 3.266 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000179926847 1429645140 /nfs/dbraw/zinc/64/51/40/1429645140.db2.gz HTCDPEVQBFMFIN-ZDUSSCGKSA-N 0 0 375.812 3.266 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000155665886 1423476389 /nfs/dbraw/zinc/47/63/89/1423476389.db2.gz YZXIWCGGFXEHFA-CRAIPNDOSA-N 0 0 383.448 3.217 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)CC2CCCCC2)CC1 ZINC000155679189 1423483612 /nfs/dbraw/zinc/48/36/12/1423483612.db2.gz GDORTVSWTBHKKG-DHZHZOJOSA-N 0 0 385.464 3.249 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000179927972 1429646213 /nfs/dbraw/zinc/64/62/13/1429646213.db2.gz USUPYKCCCIXVBO-ZDUSSCGKSA-N 0 0 385.811 3.311 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@H](c2ccsc2)O1 ZINC000155757842 1423520602 /nfs/dbraw/zinc/52/06/02/1423520602.db2.gz HXYFFZLSMDIALZ-SCLBCKFNSA-N 0 0 398.444 3.444 20 5 GGBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccc(Cl)nn1 ZINC000155768678 1423525249 /nfs/dbraw/zinc/52/52/49/1423525249.db2.gz KEHJGSWNGWSELZ-UHFFFAOYSA-N 0 0 385.605 3.006 20 5 GGBDRN CC[C@H](N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1c(C)noc1C ZINC000155770089 1423526867 /nfs/dbraw/zinc/52/68/67/1423526867.db2.gz ZFCPUVDKCMRWEV-RISCZKNCSA-N 0 0 376.413 3.276 20 5 GGBDRN C[C@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@H](c2ccsc2)O1 ZINC000155788437 1423534511 /nfs/dbraw/zinc/53/45/11/1423534511.db2.gz YHPQELAVDFFGHY-SUMWQHHRSA-N 0 0 375.450 3.447 20 5 GGBDRN C[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H](c2ccsc2)O1 ZINC000155788543 1423534549 /nfs/dbraw/zinc/53/45/49/1423534549.db2.gz YHPQELAVDFFGHY-DYVFJYSZSA-N 0 0 375.450 3.447 20 5 GGBDRN O=C(Nc1nnc(C(F)(F)F)s1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000155796381 1423537991 /nfs/dbraw/zinc/53/79/91/1423537991.db2.gz VFMRPCMFRBYILY-UHFFFAOYSA-N 0 0 387.343 3.318 20 5 GGBDRN C[C@@H]1Oc2ccc(NCc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)cc2NC1=O ZINC000155801017 1423539999 /nfs/dbraw/zinc/53/99/99/1423539999.db2.gz UIUPWGHMNBOISB-LBPRGKRZSA-N 0 0 393.403 3.327 20 5 GGBDRN CO[C@H](C)COC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000155800244 1423540311 /nfs/dbraw/zinc/54/03/11/1423540311.db2.gz OZRRRAOHHYXWSP-LLVKDONJSA-N 0 0 390.358 3.408 20 5 GGBDRN CCOC(=O)CN(Cc1ccccc1)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000179944473 1429655213 /nfs/dbraw/zinc/65/52/13/1429655213.db2.gz UMXXTLQQBXXPKC-UHFFFAOYSA-N 0 0 383.404 3.049 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000155846171 1423558495 /nfs/dbraw/zinc/55/84/95/1423558495.db2.gz SAKREKYVIDQZMH-QGZVFWFLSA-N 0 0 391.431 3.497 20 5 GGBDRN O=C(NCC1([C@@H](O)c2ccccc2)CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000155853672 1423562737 /nfs/dbraw/zinc/56/27/37/1423562737.db2.gz SLJOQWIODORYOG-FQEVSTJZSA-N 0 0 395.459 3.439 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(Oc3ccc(CO)cc3)cc2)c1[N+](=O)[O-] ZINC000155869544 1423569904 /nfs/dbraw/zinc/56/99/04/1423569904.db2.gz YWEXZDSYYPUIPK-UHFFFAOYSA-N 0 0 382.376 3.174 20 5 GGBDRN CCC[N@H+](Cc1ccc(-c2nnn[n-]2)cc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000825318746 1423571308 /nfs/dbraw/zinc/57/13/08/1423571308.db2.gz RJYLGOYTRSOQMJ-UHFFFAOYSA-N 0 0 382.424 3.196 20 5 GGBDRN Cc1cccc(C(=O)N[C@H](C)C(=O)Nc2cccc(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000155888546 1423578714 /nfs/dbraw/zinc/57/87/14/1423578714.db2.gz FUBRFHNDAOYYKV-OAHLLOKOSA-N 0 0 396.447 3.260 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC[C@H](CCCc2ccccc2)C1 ZINC000155897735 1423583040 /nfs/dbraw/zinc/58/30/40/1423583040.db2.gz RPOLTWCQQVSKHS-SFHVURJKSA-N 0 0 383.448 3.018 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)[C@H](c2ccccc2)C2CC2)CC1 ZINC000155913014 1423592433 /nfs/dbraw/zinc/59/24/33/1423592433.db2.gz MSXQFHQBRQQRMD-HXUWFJFHSA-N 0 0 393.443 3.073 20 5 GGBDRN C[C@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@@H](c2ccsc2)O1 ZINC000155928162 1423597888 /nfs/dbraw/zinc/59/78/88/1423597888.db2.gz CAOOYKKPMJBOTJ-UGSOOPFHSA-N 0 0 398.444 3.444 20 5 GGBDRN O=C(NC1(c2noc([C@@H]3CCOC3)n2)CCCCCC1)c1ccc([N+](=O)[O-])o1 ZINC000155933577 1423599600 /nfs/dbraw/zinc/59/96/00/1423599600.db2.gz YYRTUPALSNUQKW-GFCCVEGCSA-N 0 0 390.396 3.054 20 5 GGBDRN O=C(NC1(c2noc([C@H]3CCOC3)n2)CCCCCC1)c1ccc([N+](=O)[O-])o1 ZINC000155933678 1423599862 /nfs/dbraw/zinc/59/98/62/1423599862.db2.gz YYRTUPALSNUQKW-LBPRGKRZSA-N 0 0 390.396 3.054 20 5 GGBDRN CC[C@@H]1CCC[C@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)C1 ZINC000155976514 1423616182 /nfs/dbraw/zinc/61/61/82/1423616182.db2.gz KMFQEDREQJIRQD-KGLIPLIRSA-N 0 0 394.497 3.093 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN(Cc3ccccc3)[C@@H](CO)C3CC3)n2)cc1 ZINC000155987645 1423621934 /nfs/dbraw/zinc/62/19/34/1423621934.db2.gz QFFZYJUNEJWYRS-IBGZPJMESA-N 0 0 394.431 3.418 20 5 GGBDRN Cn1cc(CNc2ccc3c(c2)CCC(=O)N3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155996610 1423626642 /nfs/dbraw/zinc/62/66/42/1423626642.db2.gz MYGRCQAMLRWKRG-UHFFFAOYSA-N 0 0 377.404 3.492 20 5 GGBDRN CCC[C@H](C)[C@H]1CCCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000156008176 1423631614 /nfs/dbraw/zinc/63/16/14/1423631614.db2.gz CLWYFVOYWDMSBS-GXTWGEPZSA-N 0 0 379.482 3.213 20 5 GGBDRN Cc1cc(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000156036069 1423644791 /nfs/dbraw/zinc/64/47/91/1423644791.db2.gz JDZGRMSZLYXMCR-UHFFFAOYSA-N 0 0 377.441 3.280 20 5 GGBDRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000156039850 1423645609 /nfs/dbraw/zinc/64/56/09/1423645609.db2.gz RHGZGANIECEPED-OCCSQVGLSA-N 0 0 381.860 3.405 20 5 GGBDRN Cc1nc(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Cl)CC2)sc1C ZINC000156051392 1423650856 /nfs/dbraw/zinc/65/08/56/1423650856.db2.gz VSRLVUXGLYFMNG-UHFFFAOYSA-N 0 0 380.857 3.284 20 5 GGBDRN CC(=O)c1cccc(OCc2cc(C(=O)NCc3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000179951939 1429659849 /nfs/dbraw/zinc/65/98/49/1429659849.db2.gz GKWNXANKRURMAC-UHFFFAOYSA-N 0 0 395.371 3.294 20 5 GGBDRN Cc1cccc(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000156059846 1423654878 /nfs/dbraw/zinc/65/48/78/1423654878.db2.gz AYQVRDFUQZOABR-CQSZACIVSA-N 0 0 377.441 3.280 20 5 GGBDRN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000156058837 1423655395 /nfs/dbraw/zinc/65/53/95/1423655395.db2.gz RKGWAQDAGFFBHB-SCLBCKFNSA-N 0 0 380.404 3.369 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000156058500 1423655638 /nfs/dbraw/zinc/65/56/38/1423655638.db2.gz PHWIBUSNPSAZMW-GDLCADMTSA-N 0 0 381.226 3.045 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](c2ccsc2)O1 ZINC000156071087 1423660374 /nfs/dbraw/zinc/66/03/74/1423660374.db2.gz YGQIIPAJBDRACC-UGSOOPFHSA-N 0 0 398.444 3.444 20 5 GGBDRN Cc1cc(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)nc(C(C)C)n1 ZINC000156079761 1423662934 /nfs/dbraw/zinc/66/29/34/1423662934.db2.gz UYYYGQFWKQRBQL-UHFFFAOYSA-N 0 0 398.467 3.479 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000156089781 1423667363 /nfs/dbraw/zinc/66/73/63/1423667363.db2.gz JQDKGJBXSXTHSO-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN COc1ccc(-n2nc(C(=O)NCc3cc([N+](=O)[O-])ccc3OC)cc2C)cc1 ZINC000179956077 1429661384 /nfs/dbraw/zinc/66/13/84/1429661384.db2.gz UIAXXZFJSMCDPN-UHFFFAOYSA-N 0 0 396.403 3.036 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)c(N)c([N+](=O)[O-])c1 ZINC000156098090 1423671875 /nfs/dbraw/zinc/67/18/75/1423671875.db2.gz KFPZFABXDLAOHJ-ZDUSSCGKSA-N 0 0 388.399 3.468 20 5 GGBDRN Cc1c(NC(=O)Nc2ccc(CCS(C)(=O)=O)cc2)cccc1[N+](=O)[O-] ZINC000156098819 1423672398 /nfs/dbraw/zinc/67/23/98/1423672398.db2.gz QQKMJAGILIQTCU-UHFFFAOYSA-N 0 0 377.422 3.134 20 5 GGBDRN CC(=O)c1ccc(OS(=O)(=O)Cc2ccc(F)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000156098791 1423672488 /nfs/dbraw/zinc/67/24/88/1423672488.db2.gz YWRBKXFQGJUETC-UHFFFAOYSA-N 0 0 387.772 3.499 20 5 GGBDRN CN(C)[C@H](CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccccc1Cl ZINC000179959616 1429662681 /nfs/dbraw/zinc/66/26/81/1429662681.db2.gz POIONKLAPBSVII-OAHLLOKOSA-N 0 0 391.811 3.010 20 5 GGBDRN COc1ccc(NC(=O)CN[C@H](C)c2cc(F)ccc2OC)c([N+](=O)[O-])c1 ZINC000179959530 1429662892 /nfs/dbraw/zinc/66/28/92/1429662892.db2.gz GKLKCYYYIOFUKQ-LLVKDONJSA-N 0 0 377.372 3.040 20 5 GGBDRN Cc1cc(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])nn1-c1cc(C)cc(C)c1 ZINC000179960335 1429663626 /nfs/dbraw/zinc/66/36/26/1429663626.db2.gz UYTCWAHRLDMPKU-UHFFFAOYSA-N 0 0 379.420 3.417 20 5 GGBDRN O=C(COc1ccc(Cl)cc1)Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000156175299 1423707469 /nfs/dbraw/zinc/70/74/69/1423707469.db2.gz DVDGGLZSEGHWBW-UHFFFAOYSA-N 0 0 399.790 3.120 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2c(C)cc(N(C)C)cc2C)ccc1[N+](=O)[O-] ZINC000156193210 1423717393 /nfs/dbraw/zinc/71/73/93/1423717393.db2.gz DHELHGSSBOFNHT-UHFFFAOYSA-N 0 0 379.438 3.087 20 5 GGBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000156201440 1423721978 /nfs/dbraw/zinc/72/19/78/1423721978.db2.gz DGOKWZAIZQUMQN-GOSISDBHSA-N 0 0 394.387 3.201 20 5 GGBDRN Cc1cc(C)c(OC(=O)c2ccc(=O)n(-c3ccccc3F)n2)c([N+](=O)[O-])c1 ZINC000156226198 1423734392 /nfs/dbraw/zinc/73/43/92/1423734392.db2.gz ZYCSJGXHRDDYAO-UHFFFAOYSA-N 0 0 383.335 3.116 20 5 GGBDRN CCc1ccc(C(=O)Oc2c(C)cc(C)cc2[N+](=O)[O-])cc1S(C)(=O)=O ZINC000156225798 1423734801 /nfs/dbraw/zinc/73/48/01/1423734801.db2.gz TWXJGVWISFCQFS-UHFFFAOYSA-N 0 0 377.418 3.397 20 5 GGBDRN O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC(O)C1 ZINC000156254379 1423744230 /nfs/dbraw/zinc/74/42/30/1423744230.db2.gz NYLCLKVNNUJGNQ-ZROIWOOFSA-N 0 0 395.440 3.338 20 5 GGBDRN C[C@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@H](c2ccsc2)O1 ZINC000156326727 1423780001 /nfs/dbraw/zinc/78/00/01/1423780001.db2.gz YAELOTUHKHUISU-SUMWQHHRSA-N 0 0 376.434 3.414 20 5 GGBDRN COc1ccc(N(Cc2ccco2)C(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1F ZINC000156343398 1423789878 /nfs/dbraw/zinc/78/98/78/1423789878.db2.gz VTJYEANLRHQIQH-UHFFFAOYSA-N 0 0 388.355 3.224 20 5 GGBDRN CC[C@H](CSc1ccccc1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000156357983 1423796119 /nfs/dbraw/zinc/79/61/19/1423796119.db2.gz GPFMVHJFNUBNNZ-OAHLLOKOSA-N 0 0 397.460 3.476 20 5 GGBDRN O=C(N[C@H]1CCCOCC1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000179979178 1429672235 /nfs/dbraw/zinc/67/22/35/1429672235.db2.gz WJZGCIBUWWASBG-JTQLQIEISA-N 0 0 399.234 3.386 20 5 GGBDRN CC[C@@H]1CCC[C@H]1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000156364569 1423799734 /nfs/dbraw/zinc/79/97/34/1423799734.db2.gz IFNNYKFJYLOEOW-DGCLKSJQSA-N 0 0 375.454 3.183 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N(C)OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000156401317 1423805587 /nfs/dbraw/zinc/80/55/87/1423805587.db2.gz KSNSSJWTRPZXRP-IBGZPJMESA-N 0 0 397.431 3.098 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000156417403 1423807924 /nfs/dbraw/zinc/80/79/24/1423807924.db2.gz GXFPAPLUCRHSOV-UHFFFAOYSA-N 0 0 393.447 3.439 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1CCCc1ccccc1 ZINC000156449184 1423811676 /nfs/dbraw/zinc/81/16/76/1423811676.db2.gz FKPRZHZUHCDANB-IBGZPJMESA-N 0 0 395.459 3.339 20 5 GGBDRN CCN(C(=O)Cc1cccc([N+](=O)[O-])c1C)c1ccccc1S(=O)(=O)CC ZINC000156465860 1423813553 /nfs/dbraw/zinc/81/35/53/1423813553.db2.gz XOOMXBYUBWWRLB-UHFFFAOYSA-N 0 0 390.461 3.292 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000156468201 1423814038 /nfs/dbraw/zinc/81/40/38/1423814038.db2.gz DRFNEDBVOIIORW-OAHLLOKOSA-N 0 0 398.463 3.146 20 5 GGBDRN CC(C)(C)OC(=O)NCC1(C(=O)NCc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000156488455 1423817323 /nfs/dbraw/zinc/81/73/23/1423817323.db2.gz OOAAOIWNBFYKFS-UHFFFAOYSA-N 0 0 377.441 3.296 20 5 GGBDRN O=C(c1cccc(OC[C@H]2CCCO2)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156496329 1423818571 /nfs/dbraw/zinc/81/85/71/1423818571.db2.gz MZULDGSXYKTNCA-HXUWFJFHSA-N 0 0 382.416 3.351 20 5 GGBDRN Cc1ccc(NCCCNC(=O)CSc2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000156521431 1423822543 /nfs/dbraw/zinc/82/25/43/1423822543.db2.gz SHGLTSVTOREHFY-UHFFFAOYSA-N 0 0 375.450 3.319 20 5 GGBDRN CC1(C)Cc2cccc(OCC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)c2O1 ZINC000156522354 1423822547 /nfs/dbraw/zinc/82/25/47/1423822547.db2.gz OYFFSQLSLMMSIN-UHFFFAOYSA-N 0 0 382.416 3.272 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)c1[N+](=O)[O-] ZINC000156526004 1423822959 /nfs/dbraw/zinc/82/29/59/1423822959.db2.gz XOBOIXCAJCVUCZ-UHFFFAOYSA-N 0 0 377.426 3.134 20 5 GGBDRN CC(=O)N1CCCc2cc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3C)ccc21 ZINC000156529557 1423823241 /nfs/dbraw/zinc/82/32/41/1423823241.db2.gz FRFUEMQAARXLRE-UHFFFAOYSA-N 0 0 389.433 3.003 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCc2ccc(O)c(Br)c2)c1[N+](=O)[O-] ZINC000156543371 1423825579 /nfs/dbraw/zinc/82/55/79/1423825579.db2.gz NUBWDTKKICEQNJ-UHFFFAOYSA-N 0 0 383.173 3.440 20 5 GGBDRN C[C@H](NC(=O)c1ccccc1CSc1nc[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000156543412 1423825683 /nfs/dbraw/zinc/82/56/83/1423825683.db2.gz UFUBQNQSBLFKEV-LBPRGKRZSA-N 0 0 383.433 3.496 20 5 GGBDRN CC(C)C(=O)Nc1cccc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000156545681 1423826183 /nfs/dbraw/zinc/82/61/83/1423826183.db2.gz UBJXKXPSAQIUID-UHFFFAOYSA-N 0 0 391.449 3.174 20 5 GGBDRN CN(C)c1nnc(-c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)o1 ZINC000156550301 1423826817 /nfs/dbraw/zinc/82/68/17/1423826817.db2.gz ISAKYDDPWFKHQG-UHFFFAOYSA-N 0 0 399.432 3.442 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)nc2ccccc21 ZINC000156550772 1423827008 /nfs/dbraw/zinc/82/70/08/1423827008.db2.gz FZBNJBWXJGZFGU-UHFFFAOYSA-N 0 0 393.403 3.036 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC1(CCO)CCCCC1 ZINC000156550351 1423827012 /nfs/dbraw/zinc/82/70/12/1423827012.db2.gz ZQTNQPLVESIOGO-ZDUSSCGKSA-N 0 0 384.860 3.465 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1ccc(O)c(Br)c1 ZINC000156553041 1423827529 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389.477 3.284 20 5 GGBDRN CC(C)c1ccc(CC2CCN(C(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)CC2)cc1 ZINC000156602263 1423834735 /nfs/dbraw/zinc/83/47/35/1423834735.db2.gz BEPYODMRUKYJGP-UHFFFAOYSA-N 0 0 397.475 3.361 20 5 GGBDRN O=C(c1ccccc1OC[C@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156602494 1423834846 /nfs/dbraw/zinc/83/48/46/1423834846.db2.gz JBHUHRQTIVBPRH-GOSISDBHSA-N 0 0 382.416 3.351 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@H]3OCCC[C@H]3C2)CC1 ZINC000156619306 1423836790 /nfs/dbraw/zinc/83/67/90/1423836790.db2.gz DIPHITWCEDGYAV-OXJNMPFZSA-N 0 0 387.480 3.472 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000156631870 1423838230 /nfs/dbraw/zinc/83/82/30/1423838230.db2.gz WUMILEGHAQNVFE-UHFFFAOYSA-N 0 0 380.154 3.447 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1cccc2c1OCCO2 ZINC000156631463 1423838366 /nfs/dbraw/zinc/83/83/66/1423838366.db2.gz XLSXOXAGZZHRPD-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN 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ZINC000156714734 1423852894 /nfs/dbraw/zinc/85/28/94/1423852894.db2.gz CZHUDKYHHDVWGC-QGZVFWFLSA-N 0 0 377.466 3.288 20 5 GGBDRN Cc1nc(NC(=O)c2cc(NC(=O)N(C)C)ccc2Cl)ccc1[N+](=O)[O-] ZINC000156730044 1423856049 /nfs/dbraw/zinc/85/60/49/1423856049.db2.gz MQQVCKMDXWOWTC-UHFFFAOYSA-N 0 0 377.788 3.297 20 5 GGBDRN Cc1ccc([C@H](C)[NH2+]CCCOc2cccc(-c3nn[n-]n3)c2)cc1[N+](=O)[O-] ZINC000826283440 1423868595 /nfs/dbraw/zinc/86/85/95/1423868595.db2.gz QZFRBKNAVYJNFO-AWEZNQCLSA-N 0 0 382.424 3.203 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)CCc1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000156824568 1423870938 /nfs/dbraw/zinc/87/09/38/1423870938.db2.gz ONBCCINANAWEQA-QGZVFWFLSA-N 0 0 385.420 3.122 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c1[N+](=O)[O-] ZINC000156830102 1423871966 /nfs/dbraw/zinc/87/19/66/1423871966.db2.gz QOVYSPZHYPSFLY-UHFFFAOYSA-N 0 0 399.451 3.395 20 5 GGBDRN C[C@@H]([NH2+]C[C@H](O)c1cc(Cl)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000156843608 1423873479 /nfs/dbraw/zinc/87/34/79/1423873479.db2.gz JPWRYKHVRCVPIT-BZNIZROVSA-N 0 0 378.812 3.404 20 5 GGBDRN CC1(C)CCCC[C@@H]1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000156847826 1423874829 /nfs/dbraw/zinc/87/48/29/1423874829.db2.gz PZQKTRJZPOJOIN-AWEZNQCLSA-N 0 0 394.497 3.093 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCN(c3cccs3)CC2)cc1OC ZINC000156868136 1423877568 /nfs/dbraw/zinc/87/75/68/1423877568.db2.gz DIOLYRXFVFUFDD-UHFFFAOYSA-N 0 0 391.449 3.026 20 5 GGBDRN Cc1ccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)c(O[C@@H]2CCOC2)c1 ZINC000156871493 1423878152 /nfs/dbraw/zinc/87/81/52/1423878152.db2.gz ZAVGSIGEYOBJJF-LJQANCHMSA-N 0 0 384.432 3.320 20 5 GGBDRN COc1cc(CN(C)[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)ccc1O ZINC000156888793 1423880751 /nfs/dbraw/zinc/88/07/51/1423880751.db2.gz WUEOLCKEUODDNB-NSHDSACASA-N 0 0 393.827 3.421 20 5 GGBDRN Cc1c(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cnn1-c1ccccn1 ZINC000156888229 1423880804 /nfs/dbraw/zinc/88/08/04/1423880804.db2.gz ZIUSDTITZRCBKA-UHFFFAOYSA-N 0 0 394.435 3.024 20 5 GGBDRN Cc1ccc(NCCCNC(=O)C[C@H]2OC(=O)c3ccccc32)c([N+](=O)[O-])c1 ZINC000156890416 1423881417 /nfs/dbraw/zinc/88/14/17/1423881417.db2.gz QOGKCYGKQNGGAZ-GOSISDBHSA-N 0 0 383.404 3.123 20 5 GGBDRN O=C(CSc1nccc2ccccc21)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000156890125 1423881425 /nfs/dbraw/zinc/88/14/25/1423881425.db2.gz MWMZDHAVOPQUAU-UHFFFAOYSA-N 0 0 382.445 3.463 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)OCCc3cnccn3)cc2[N+](=O)[O-])C1 ZINC000179992009 1429679638 /nfs/dbraw/zinc/67/96/38/1429679638.db2.gz GUCWGBPZUZUFKT-GJZGRUSLSA-N 0 0 384.436 3.267 20 5 GGBDRN Cc1cccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1C ZINC000156918243 1423885397 /nfs/dbraw/zinc/88/53/97/1423885397.db2.gz RRSLTDVJPGFHBE-UHFFFAOYSA-N 0 0 379.319 3.390 20 5 GGBDRN Cc1ccc(CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c(O[C@H]2CCOC2)c1 ZINC000156932929 1423889010 /nfs/dbraw/zinc/88/90/10/1423889010.db2.gz JLAMVFKUUNCICN-SQUITACLSA-N 0 0 382.416 3.401 20 5 GGBDRN COc1ccc(CC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1F ZINC000156936197 1423889697 /nfs/dbraw/zinc/88/96/97/1423889697.db2.gz RJXBRQGVOPACQX-UHFFFAOYSA-N 0 0 375.400 3.212 20 5 GGBDRN Cc1ccc(NCCCNC(=O)CCc2nc(-c3ccoc3)no2)c([N+](=O)[O-])c1 ZINC000156938655 1423889718 /nfs/dbraw/zinc/88/97/18/1423889718.db2.gz URVSJRWRPAJASV-UHFFFAOYSA-N 0 0 399.407 3.097 20 5 GGBDRN COc1ccc(NC(=O)CNC2(c3ccc(F)cc3F)CCC2)c([N+](=O)[O-])c1 ZINC000179994482 1429680313 /nfs/dbraw/zinc/68/03/13/1429680313.db2.gz XEAFIAHZAXFIPC-UHFFFAOYSA-N 0 0 391.374 3.489 20 5 GGBDRN Cc1nn2c(nc(C)cc2C)c1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000156940356 1423890151 /nfs/dbraw/zinc/89/01/51/1423890151.db2.gz NVYRAMWIWRZKLP-UHFFFAOYSA-N 0 0 396.451 3.103 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2Cl)C1=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000156944540 1423890803 /nfs/dbraw/zinc/89/08/03/1423890803.db2.gz LSXZABBIGBGUNM-CYBMUJFWSA-N 0 0 394.214 3.437 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000156950015 1423892026 /nfs/dbraw/zinc/89/20/26/1423892026.db2.gz CYQBHEGEGSDDDT-UHFFFAOYSA-N 0 0 388.380 3.052 20 5 GGBDRN CC(C)Oc1cccc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000156955931 1423893047 /nfs/dbraw/zinc/89/30/47/1423893047.db2.gz ADSWGWFQBMFYJO-UHFFFAOYSA-N 0 0 382.413 3.342 20 5 GGBDRN CC(=O)Nc1ccc(CC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000156956592 1423893102 /nfs/dbraw/zinc/89/31/02/1423893102.db2.gz RYHMAQBBGYTAJX-UHFFFAOYSA-N 0 0 384.436 3.023 20 5 GGBDRN CCCOc1cc(C)ccc1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000156958402 1423893187 /nfs/dbraw/zinc/89/31/87/1423893187.db2.gz YEWQQDJUEPTQQV-UHFFFAOYSA-N 0 0 378.450 3.312 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)C1(c2ccc(Cl)cc2)CCCCC1 ZINC000156995679 1423898843 /nfs/dbraw/zinc/89/88/43/1423898843.db2.gz AIWCDQOUQYGJDQ-UHFFFAOYSA-N 0 0 376.844 3.463 20 5 GGBDRN CC(C)(C)Oc1ccc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cn1 ZINC000179995982 1429681176 /nfs/dbraw/zinc/68/11/76/1429681176.db2.gz WLUPJSFTAYKDEW-UHFFFAOYSA-N 0 0 395.419 3.283 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(CN(C3CC3)[C@@H]3CCS(=O)(=O)C3)o2)cc1 ZINC000157023829 1423905163 /nfs/dbraw/zinc/90/51/63/1423905163.db2.gz OZZSRKPPIGAHAQ-MRXNPFEDSA-N 0 0 376.434 3.006 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@H]2CCCCC2(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000157059871 1423914385 /nfs/dbraw/zinc/91/43/85/1423914385.db2.gz GRKKHZWNZWSGDZ-KRWDZBQOSA-N 0 0 384.436 3.148 20 5 GGBDRN CCc1c(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cnn1CC(C)C ZINC000157065763 1423915255 /nfs/dbraw/zinc/91/52/55/1423915255.db2.gz AWTWABCTMSMFNK-UHFFFAOYSA-N 0 0 382.424 3.448 20 5 GGBDRN Cc1c(C(=O)N(C)[C@@H]2CCCc3c2cnn3C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000157073882 1423918193 /nfs/dbraw/zinc/91/81/93/1423918193.db2.gz AITNRIWSXDZCOV-CQSZACIVSA-N 0 0 387.396 3.003 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C)c2ccccc21 ZINC000157085968 1423921729 /nfs/dbraw/zinc/92/17/29/1423921729.db2.gz KCKCXAVUPIOJBE-UHFFFAOYSA-N 0 0 387.461 3.430 20 5 GGBDRN CCn1c(SCC(=O)N2CCC(C)CC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157091798 1423923669 /nfs/dbraw/zinc/92/36/69/1423923669.db2.gz SCWPMMKZTAIDAW-UHFFFAOYSA-N 0 0 389.481 3.224 20 5 GGBDRN Cc1nn(C)c(Cl)c1COC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000157116265 1423929743 /nfs/dbraw/zinc/92/97/43/1423929743.db2.gz MDNQYQXAZRDPSI-UHFFFAOYSA-N 0 0 388.605 3.410 20 5 GGBDRN COc1cc(CNc2nnc3ccccn32)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000157145858 1423936467 /nfs/dbraw/zinc/93/64/67/1423936467.db2.gz PDEYQRWCJMTRGE-UHFFFAOYSA-N 0 0 397.313 3.199 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3cccc(-c4nnn[n-]4)c3)o2)c1 ZINC000738366083 1423941246 /nfs/dbraw/zinc/94/12/46/1423941246.db2.gz BMNBWDJPCYQWSZ-UHFFFAOYSA-N 0 0 376.376 3.325 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000157162264 1423941829 /nfs/dbraw/zinc/94/18/29/1423941829.db2.gz QHNJEDIYBRPZJG-QMTHXVAHSA-N 0 0 391.786 3.307 20 5 GGBDRN CCc1c(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cnn1CC(C)C ZINC000157206013 1423955035 /nfs/dbraw/zinc/95/50/35/1423955035.db2.gz 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CC1(C)CCCC[C@@H]1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000157294810 1423977867 /nfs/dbraw/zinc/97/78/67/1423977867.db2.gz UCOVYMINGAYRLE-KRWDZBQOSA-N 0 0 388.468 3.031 20 5 GGBDRN CN(CCCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1F ZINC000157297701 1423977956 /nfs/dbraw/zinc/97/79/56/1423977956.db2.gz WMVQIYMMKILCSI-UHFFFAOYSA-N 0 0 384.411 3.400 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H]1CCC[C@H](C2CC2)C1 ZINC000157297994 1423978998 /nfs/dbraw/zinc/97/89/98/1423978998.db2.gz ZWUYAQTUXSXUET-LSDHHAIUSA-N 0 0 387.436 3.368 20 5 GGBDRN COc1cc(CN2CCC(n3ccnc3)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180010186 1429688700 /nfs/dbraw/zinc/68/87/00/1429688700.db2.gz UIKOMQKKRQZJHB-UHFFFAOYSA-N 0 0 396.394 3.281 20 5 GGBDRN CCS(=O)(=O)c1cccc(CC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000157365363 1423995585 /nfs/dbraw/zinc/99/55/85/1423995585.db2.gz OHAZMRJTTKFOCE-UHFFFAOYSA-N 0 0 376.434 3.186 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@H](CO)Cc1ccccc1 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CCN(C)C(=O)c1cccc(OC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000157705532 1424069307 /nfs/dbraw/zinc/06/93/07/1424069307.db2.gz HQTFYALXAKYRPU-UHFFFAOYSA-N 0 0 394.387 3.092 20 5 GGBDRN O=C(NCCOc1ncccc1C(F)(F)F)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000157714729 1424071686 /nfs/dbraw/zinc/07/16/86/1424071686.db2.gz WUXVQWPTVHVAEY-UHFFFAOYSA-N 0 0 391.252 3.096 20 5 GGBDRN CC(C)N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)C1=O ZINC000157752213 1424080299 /nfs/dbraw/zinc/08/02/99/1424080299.db2.gz KKHZTKOMMZSYKY-MRXNPFEDSA-N 0 0 391.493 3.369 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCC(n2ccnn2)CC1 ZINC000157763306 1424082657 /nfs/dbraw/zinc/08/26/57/1424082657.db2.gz IFSQYNUGLZJONK-UHFFFAOYSA-N 0 0 384.318 3.074 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000157838107 1424100347 /nfs/dbraw/zinc/10/03/47/1424100347.db2.gz YACSPVHKWPNRDC-UHFFFAOYSA-N 0 0 385.424 3.485 20 5 GGBDRN CCC[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1nnc2ccccn21 ZINC000157840065 1424100500 /nfs/dbraw/zinc/10/05/00/1424100500.db2.gz LYMIUDCWSNXGTD-ZDUSSCGKSA-N 0 0 384.396 3.309 20 5 GGBDRN C[C@@H](NC(=O)NCCc1nnc(-c2ccccc2)o1)c1cccc([N+](=O)[O-])c1 ZINC000157854424 1424104564 /nfs/dbraw/zinc/10/45/64/1424104564.db2.gz NOBWYQJPFDUSHZ-CYBMUJFWSA-N 0 0 381.392 3.248 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCN(c4cnccn4)CC3)s2)cc1 ZINC000157886367 1424112140 /nfs/dbraw/zinc/11/21/40/1424112140.db2.gz QEPSUVQRALVSJI-UHFFFAOYSA-N 0 0 381.461 3.436 20 5 GGBDRN CC(C)NC(=O)c1ccc(N2CCO[C@@]3(CCc4ccccc43)C2)c([N+](=O)[O-])c1 ZINC000157904660 1424116731 /nfs/dbraw/zinc/11/67/31/1424116731.db2.gz LMZZPJFWCFDXDB-QFIPXVFZSA-N 0 0 395.459 3.411 20 5 GGBDRN CCN(C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1C(=O)OC ZINC000157919074 1424120042 /nfs/dbraw/zinc/12/00/42/1424120042.db2.gz QMKRUJIFSKDYOL-UHFFFAOYSA-N 0 0 394.387 3.234 20 5 GGBDRN COc1cc(F)c(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000157922770 1424120912 /nfs/dbraw/zinc/12/09/12/1424120912.db2.gz MRNIFINNXQTADQ-JTQLQIEISA-N 0 0 393.346 3.006 20 5 GGBDRN CCCOc1ccc2c(c1)CCN(S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000157994610 1424136373 /nfs/dbraw/zinc/13/63/73/1424136373.db2.gz OJPDBJAAPARZKG-UHFFFAOYSA-N 0 0 390.461 3.272 20 5 GGBDRN CC(=O)c1cccc(OCc2cc(C(=O)NCc3cccc([N+](=O)[O-])c3)no2)c1 ZINC000180027336 1429701596 /nfs/dbraw/zinc/70/15/96/1429701596.db2.gz XAYZMPKYWNGJOT-UHFFFAOYSA-N 0 0 395.371 3.294 20 5 GGBDRN CCCC(=O)Nc1ccc(C(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000158027688 1424142523 /nfs/dbraw/zinc/14/25/23/1424142523.db2.gz HIAACJWNUDUAOQ-UHFFFAOYSA-N 0 0 393.403 3.475 20 5 GGBDRN Cc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)nnn1-c1cccc2ncccc21 ZINC000158062926 1424154601 /nfs/dbraw/zinc/15/46/01/1424154601.db2.gz MQHONPLGVNDXTP-UHFFFAOYSA-N 0 0 388.387 3.309 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](C(=O)OC(C)(C)C)C(C)C ZINC000180038855 1429707901 /nfs/dbraw/zinc/70/79/01/1429707901.db2.gz YDWAAMSHFMVXJK-QGZVFWFLSA-N 0 0 379.457 3.188 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000158087850 1424163111 /nfs/dbraw/zinc/16/31/11/1424163111.db2.gz APBADXAEILOLJU-JOYOIKCWSA-N 0 0 390.870 3.100 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)Oc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000158086969 1424163520 /nfs/dbraw/zinc/16/35/20/1424163520.db2.gz CQJLQOJXVXANGN-UHFFFAOYSA-N 0 0 377.418 3.235 20 5 GGBDRN CCN1CCN(c2ccc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)cc2F)CC1 ZINC000158105070 1424168043 /nfs/dbraw/zinc/16/80/43/1424168043.db2.gz YUDLBKFKLBCREE-UHFFFAOYSA-N 0 0 386.427 3.152 20 5 GGBDRN CCOc1ccccc1[C@H](CC(=O)N(C)c1cccc([N+](=O)[O-])c1)NC(C)=O ZINC000158110208 1424169251 /nfs/dbraw/zinc/16/92/51/1424169251.db2.gz NLHMSLZDLRMKCP-SFHVURJKSA-N 0 0 385.420 3.224 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H](Nc2ccccc2)C1 ZINC000158149743 1424180039 /nfs/dbraw/zinc/18/00/39/1424180039.db2.gz OUECRLDBTIFJRS-INIZCTEOSA-N 0 0 375.450 3.168 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000158149896 1424180218 /nfs/dbraw/zinc/18/02/18/1424180218.db2.gz OUECRLDBTIFJRS-MRXNPFEDSA-N 0 0 375.450 3.168 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000158156815 1424181482 /nfs/dbraw/zinc/18/14/82/1424181482.db2.gz YFXVCIOGQLKDRD-MRXNPFEDSA-N 0 0 375.450 3.168 20 5 GGBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1nc(-c2cccc(F)c2)no1 ZINC000158172994 1424186067 /nfs/dbraw/zinc/18/60/67/1424186067.db2.gz BLJHTMZAAXRYIJ-SNVBAGLBSA-N 0 0 388.330 3.343 20 5 GGBDRN CN(C)c1ccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(F)c1 ZINC000158171943 1424186260 /nfs/dbraw/zinc/18/62/60/1424186260.db2.gz PAXJLLISTOHYKK-UHFFFAOYSA-N 0 0 387.411 3.484 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000158191124 1424190760 /nfs/dbraw/zinc/19/07/60/1424190760.db2.gz FIGOUFPURZKYDU-JOYOIKCWSA-N 0 0 390.870 3.100 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000158191243 1424190819 /nfs/dbraw/zinc/19/08/19/1424190819.db2.gz FIGOUFPURZKYDU-BXKDBHETSA-N 0 0 390.870 3.100 20 5 GGBDRN Cc1nn(C)c2ncc(NC(=O)NCCCNc3ccc(C)cc3[N+](=O)[O-])cc12 ZINC000158229368 1424201085 /nfs/dbraw/zinc/20/10/85/1424201085.db2.gz FLSOYYJZCXNKTM-UHFFFAOYSA-N 0 0 397.439 3.117 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2ccccc2NC1=O ZINC000158232910 1424202023 /nfs/dbraw/zinc/20/20/23/1424202023.db2.gz WBONUKGULWCSGI-CYBMUJFWSA-N 0 0 391.387 3.016 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H](C)C[C@@H](O)c2cccs2)c1C ZINC000158237020 1424203846 /nfs/dbraw/zinc/20/38/46/1424203846.db2.gz HKCJBPAFVYRZIQ-BXUZGUMPSA-N 0 0 384.479 3.064 20 5 GGBDRN COc1ccccc1C[C@@H](C)N(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000180035876 1429706175 /nfs/dbraw/zinc/70/61/75/1429706175.db2.gz AMQQCMLALLUOKF-OAHLLOKOSA-N 0 0 392.477 3.039 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H](C)C[C@@H](O)c1cccs1 ZINC000158254935 1424209768 /nfs/dbraw/zinc/20/97/68/1424209768.db2.gz OXPBBZRPGRRKNL-GXTWGEPZSA-N 0 0 384.479 3.064 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2ccccc21 ZINC000158259886 1424211536 /nfs/dbraw/zinc/21/15/36/1424211536.db2.gz ZXIFJWZXTXUPFD-QGZVFWFLSA-N 0 0 388.445 3.151 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCOc2c(Cl)cccc21 ZINC000158268740 1424214524 /nfs/dbraw/zinc/21/45/24/1424214524.db2.gz RSAUCXFEFNSUGY-UHFFFAOYSA-N 0 0 384.779 3.473 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)Cc1c(C)noc1C ZINC000158273700 1424214954 /nfs/dbraw/zinc/21/49/54/1424214954.db2.gz XEKYZOVASQTXSM-LLVKDONJSA-N 0 0 393.465 3.299 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000158281357 1424216598 /nfs/dbraw/zinc/21/65/98/1424216598.db2.gz DJLGZCFTKWBUHL-IBGZPJMESA-N 0 0 390.461 3.038 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000158291530 1424218346 /nfs/dbraw/zinc/21/83/46/1424218346.db2.gz WJWBORREOJODCF-SFHVURJKSA-N 0 0 390.461 3.038 20 5 GGBDRN CC(C)S(=O)(=O)CCCSc1nc2cc3ccccc3cc2c(=O)n1C ZINC000158294664 1424219021 /nfs/dbraw/zinc/21/90/21/1424219021.db2.gz IFSKJNBXSZCAHR-UHFFFAOYSA-N 0 0 390.530 3.392 20 5 GGBDRN O=C(NCc1cccc(N2CC=CC2)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000158299076 1424220129 /nfs/dbraw/zinc/22/01/29/1424220129.db2.gz CCSDWESGWRAZPW-UHFFFAOYSA-N 0 0 389.415 3.087 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](C)C[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000158300578 1424221284 /nfs/dbraw/zinc/22/12/84/1424221284.db2.gz YXXYQGRZIMTGKY-BTDLBPIBSA-N 0 0 391.355 3.193 20 5 GGBDRN C[C@H](c1ccsc1)N1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000158324075 1424225878 /nfs/dbraw/zinc/22/58/78/1424225878.db2.gz YDPAISZMXCCUKR-GFCCVEGCSA-N 0 0 385.449 3.052 20 5 GGBDRN CN(C(=O)CSCC(=O)N(C)C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000158331626 1424228668 /nfs/dbraw/zinc/22/86/68/1424228668.db2.gz HVUCLHKRTKJUBJ-UHFFFAOYSA-N 0 0 379.482 3.082 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000158335422 1424229433 /nfs/dbraw/zinc/22/94/33/1424229433.db2.gz UUONMWXLEMZNGC-UHFFFAOYSA-N 0 0 399.451 3.277 20 5 GGBDRN Cc1n[nH]c(C)c1CCOC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000180042032 1429709821 /nfs/dbraw/zinc/70/98/21/1429709821.db2.gz MVBDHINDCDRWDZ-UHFFFAOYSA-N 0 0 375.428 3.281 20 5 GGBDRN CN(CCOc1ccc(F)cc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180041916 1429710003 /nfs/dbraw/zinc/71/00/03/1429710003.db2.gz MIDUGOHSZGSDCO-UHFFFAOYSA-N 0 0 384.310 3.486 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N(C)c1cccc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000158355316 1424234802 /nfs/dbraw/zinc/23/48/02/1424234802.db2.gz VEXRXYSHINZBMD-INIZCTEOSA-N 0 0 377.347 3.103 20 5 GGBDRN COCCN(CC(F)F)C(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000158363757 1424236995 /nfs/dbraw/zinc/23/69/95/1424236995.db2.gz UUYXCYDOBCGHHP-OKILXGFUSA-N 0 0 399.438 3.431 20 5 GGBDRN C[C@H]1CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2cccnc2O1 ZINC000158381003 1424240743 /nfs/dbraw/zinc/24/07/43/1424240743.db2.gz SWMZIKZHMPWYJZ-AWEZNQCLSA-N 0 0 382.420 3.020 20 5 GGBDRN Cc1c(C(=O)NCc2nnc(-c3ccccc3)s2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000158406865 1424246477 /nfs/dbraw/zinc/24/64/77/1424246477.db2.gz AIGMUDQUJVHNKA-UHFFFAOYSA-N 0 0 399.388 3.260 20 5 GGBDRN CN(C(=O)CCCNC(=O)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000158426038 1424251422 /nfs/dbraw/zinc/25/14/22/1424251422.db2.gz HWWRCKUANJOMMZ-UHFFFAOYSA-N 0 0 375.812 3.421 20 5 GGBDRN C[C@@](O)(CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccs1 ZINC000158433891 1424252693 /nfs/dbraw/zinc/25/26/93/1424252693.db2.gz XNUUHEIIKOGHNJ-OAHLLOKOSA-N 0 0 387.364 3.287 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCOc2c(Cl)cccc21 ZINC000158442982 1424256697 /nfs/dbraw/zinc/25/66/97/1424256697.db2.gz JRWGCFXNRIACKS-UHFFFAOYSA-N 0 0 384.779 3.473 20 5 GGBDRN Nc1c(C(=O)Nc2ccn(-c3ccccc3Cl)n2)cc(F)cc1[N+](=O)[O-] ZINC000158458101 1424260493 /nfs/dbraw/zinc/26/04/93/1424260493.db2.gz BGMVBRUQDXJCIV-UHFFFAOYSA-N 0 0 375.747 3.408 20 5 GGBDRN CN(C)c1cc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)c2ccccc2n1 ZINC000158461435 1424262565 /nfs/dbraw/zinc/26/25/65/1424262565.db2.gz GODAVUNTRHGCDU-UHFFFAOYSA-N 0 0 382.395 3.207 20 5 GGBDRN CN(C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000158477923 1424268367 /nfs/dbraw/zinc/26/83/67/1424268367.db2.gz ZKNCEYXOXWPYRZ-SJLPKXTDSA-N 0 0 387.823 3.431 20 5 GGBDRN CN(C(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000158478333 1424268454 /nfs/dbraw/zinc/26/84/54/1424268454.db2.gz ZKNCEYXOXWPYRZ-WMZOPIPTSA-N 0 0 387.823 3.431 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](CC(=O)N(C)c2cccc([N+](=O)[O-])c2)C1 ZINC000158505312 1424274727 /nfs/dbraw/zinc/27/47/27/1424274727.db2.gz RCJXEKVTRTZRGB-OAHLLOKOSA-N 0 0 376.457 3.025 20 5 GGBDRN CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H](CCO)c1ccccc1 ZINC000158517194 1424276606 /nfs/dbraw/zinc/27/66/06/1424276606.db2.gz WMNGVTATMOREQG-IBGZPJMESA-N 0 0 397.475 3.393 20 5 GGBDRN CCN(C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)[C@H](C)c1ccc(F)cc1 ZINC000158521768 1424278220 /nfs/dbraw/zinc/27/82/20/1424278220.db2.gz QXZAMMKFLMPPDX-LLVKDONJSA-N 0 0 381.791 3.159 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000180051224 1429714300 /nfs/dbraw/zinc/71/43/00/1429714300.db2.gz HAMGFJPEQVYWFB-KRWDZBQOSA-N 0 0 398.868 3.098 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000158565632 1424290845 /nfs/dbraw/zinc/29/08/45/1424290845.db2.gz AQVNJMKZPRSAPC-IFXJQAMLSA-N 0 0 393.399 3.086 20 5 GGBDRN Cc1cc(S(=O)(=O)Oc2c(F)c(F)cc(F)c2F)cc([N+](=O)[O-])c1F ZINC000180052492 1429715019 /nfs/dbraw/zinc/71/50/19/1429715019.db2.gz YGHUMUWLGJLNRD-UHFFFAOYSA-N 0 0 383.250 3.366 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@H](C)Oc2ncccc21 ZINC000158616941 1424302562 /nfs/dbraw/zinc/30/25/62/1424302562.db2.gz XQCIAOBPSCOQHS-QWRGUYRKSA-N 0 0 377.784 3.225 20 5 GGBDRN Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)N(C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000158630732 1424305763 /nfs/dbraw/zinc/30/57/63/1424305763.db2.gz NJCSWOGENHDFGC-NSHDSACASA-N 0 0 394.353 3.480 20 5 GGBDRN CC(C)(C)c1ccc(CCNC(=O)Cn2cc(Cl)cc([N+](=O)[O-])c2=O)cc1 ZINC000158638990 1424307304 /nfs/dbraw/zinc/30/73/04/1424307304.db2.gz DWVJHSMFBXYSBQ-UHFFFAOYSA-N 0 0 391.855 3.066 20 5 GGBDRN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000158664494 1424313851 /nfs/dbraw/zinc/31/38/51/1424313851.db2.gz VQXFAPUILDWUGV-NSHDSACASA-N 0 0 389.795 3.376 20 5 GGBDRN Cc1cc(C)cc(OCc2noc(Cn3cc(Cl)cc([N+](=O)[O-])c3=O)n2)c1 ZINC000158674112 1424315462 /nfs/dbraw/zinc/31/54/62/1424315462.db2.gz PCRWEYZYNGFVIW-UHFFFAOYSA-N 0 0 390.783 3.037 20 5 GGBDRN Cc1cc(C(=O)Cn2cc(Cl)cc([N+](=O)[O-])c2=O)c(C)n1-c1nccs1 ZINC000158681579 1424318109 /nfs/dbraw/zinc/31/81/09/1424318109.db2.gz VYZZYBRJCPRLEB-UHFFFAOYSA-N 0 0 392.824 3.157 20 5 GGBDRN COc1cc(-c2nc(Cn3cc(Cl)cc([N+](=O)[O-])c3=O)cs2)ccc1O 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GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H](O)c1ccc2ccccc2c1 ZINC000158795329 1424343895 /nfs/dbraw/zinc/34/38/95/1424343895.db2.gz ZTBULUSDZKWSBU-SFHVURJKSA-N 0 0 386.429 3.068 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccco2)C[C@H]2CCCO2)cc([N+](=O)[O-])c1F ZINC000180060639 1429719071 /nfs/dbraw/zinc/71/90/71/1429719071.db2.gz DFTPCEAJLZPPLW-CQSZACIVSA-N 0 0 398.412 3.005 20 5 GGBDRN C[C@@H](O)C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000158883315 1424363865 /nfs/dbraw/zinc/36/38/65/1424363865.db2.gz GVDRIMAMHSCUBI-QAPCUYQASA-N 0 0 394.431 3.065 20 5 GGBDRN CNC(=O)c1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c(Cl)c1 ZINC000158883436 1424364031 /nfs/dbraw/zinc/36/40/31/1424364031.db2.gz WBJWHCKYERAHGW-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000158930903 1424374716 /nfs/dbraw/zinc/37/47/16/1424374716.db2.gz YQQQDBXBGKDZAZ-NVXWUHKLSA-N 0 0 394.431 3.065 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000158946815 1424379505 /nfs/dbraw/zinc/37/95/05/1424379505.db2.gz RXLRBZXPEPHKGG-WMZOPIPTSA-N 0 0 386.452 3.082 20 5 GGBDRN O=C(O[C@@H]([C@@H]1CCCO1)C(F)(F)F)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000159010352 1424394496 /nfs/dbraw/zinc/39/44/96/1424394496.db2.gz AADAPARRAPPACU-KBPBESRZSA-N 0 0 385.298 3.047 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN(C)C[C@@H]2CCCOC2)c1=S ZINC000159022301 1424398786 /nfs/dbraw/zinc/39/87/86/1424398786.db2.gz YXBVECDDZROVHP-AWEZNQCLSA-N 0 0 391.497 3.325 20 5 GGBDRN CCOc1ccc(-c2nc(Cn3cnc4ccc([N+](=O)[O-])cc4c3=O)co2)cc1 ZINC000159034777 1424400822 /nfs/dbraw/zinc/40/08/22/1424400822.db2.gz HRQVIUNUNFYWJD-UHFFFAOYSA-N 0 0 392.371 3.407 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(C[C@H](O)Cc3ccc(C(F)(F)F)cc3)n2)cc1 ZINC000159041465 1424403084 /nfs/dbraw/zinc/40/30/84/1424403084.db2.gz YBKIWVITYVNKLI-MRXNPFEDSA-N 0 0 392.337 3.476 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1cnn(C)c1 ZINC000159063273 1424408687 /nfs/dbraw/zinc/40/86/87/1424408687.db2.gz GDDNDCOGOMQOKU-AWEZNQCLSA-N 0 0 379.420 3.431 20 5 GGBDRN O=C(O[C@@H]([C@@H]1CCCO1)C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000159067270 1424409639 /nfs/dbraw/zinc/40/96/39/1424409639.db2.gz BRUSBFUPAKEQGM-GJZGRUSLSA-N 0 0 388.342 3.462 20 5 GGBDRN CC(C)C1CCC(CNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CC1 ZINC000159100508 1424417410 /nfs/dbraw/zinc/41/74/10/1424417410.db2.gz AORMFABFLWHOQD-UHFFFAOYSA-N 0 0 382.482 3.191 20 5 GGBDRN O=C(NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1[nH]ncc1[N+](=O)[O-] ZINC000159127280 1424423357 /nfs/dbraw/zinc/42/33/57/1424423357.db2.gz GLPMGPDPYZECQI-UHFFFAOYSA-N 0 0 388.387 3.101 20 5 GGBDRN O=C(COC(=O)c1cc(F)c([N+](=O)[O-])cc1F)N[C@@H]1CCCc2ccccc21 ZINC000159139235 1424426836 /nfs/dbraw/zinc/42/68/36/1424426836.db2.gz KFLPNVQAUNMPCX-MRXNPFEDSA-N 0 0 390.342 3.224 20 5 GGBDRN 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DRAXIIDWAGWHIV-IFXJQAMLSA-N 0 0 382.416 3.500 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCC1([C@H](O)c2ccccc2)CC1 ZINC000159267071 1424465133 /nfs/dbraw/zinc/46/51/33/1424465133.db2.gz VEVYJEMWXVCENU-MRXNPFEDSA-N 0 0 396.852 3.040 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000159271037 1424467185 /nfs/dbraw/zinc/46/71/85/1424467185.db2.gz MJGWOPGAFUNFDC-SJLPKXTDSA-N 0 0 385.464 3.458 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NCC1([C@H](O)c2ccccc2)CC1 ZINC000159288874 1424474390 /nfs/dbraw/zinc/47/43/90/1424474390.db2.gz GCBCJNCJODPXEN-MRXNPFEDSA-N 0 0 396.852 3.040 20 5 GGBDRN C[C@H](O)C[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1 ZINC000159295223 1424475972 /nfs/dbraw/zinc/47/59/72/1424475972.db2.gz XMLNUZZAZKHWJJ-DOTOQJQBSA-N 0 0 394.431 3.065 20 5 GGBDRN COc1ccc(CS(=O)(=O)Cc2noc(C3CCCCC3)n2)cc1[N+](=O)[O-] ZINC000159304942 1424479887 /nfs/dbraw/zinc/47/98/87/1424479887.db2.gz PVCSNIIHDQSOBF-UHFFFAOYSA-N 0 0 395.437 3.149 20 5 GGBDRN 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Cc1ccc(-n2cnnc2SCCn2cc([N+](=O)[O-])ccc2=O)cc1Cl ZINC000159712154 1424526676 /nfs/dbraw/zinc/52/66/76/1424526676.db2.gz ARNOEKBNUSWGJC-UHFFFAOYSA-N 0 0 391.840 3.091 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1ccnc(OC2CCCC2)c1 ZINC000159721226 1424527737 /nfs/dbraw/zinc/52/77/37/1424527737.db2.gz BBVQAVINXKOIED-UHFFFAOYSA-N 0 0 384.436 3.353 20 5 GGBDRN Cc1ccc([C@@]2(C)NC(=O)N(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2=O)o1 ZINC000159720573 1424527972 /nfs/dbraw/zinc/52/79/72/1424527972.db2.gz STUHPVBREQYAOU-MRXNPFEDSA-N 0 0 397.309 3.482 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)[C@H](c2ccccc2)CO1 ZINC000159726016 1424528104 /nfs/dbraw/zinc/52/81/04/1424528104.db2.gz SKYVHMJKBDWUDW-QRWLVFNGSA-N 0 0 392.415 3.383 20 5 GGBDRN Cc1ccc([C@]2(C)NC(=O)N(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2=O)o1 ZINC000159720689 1424528400 /nfs/dbraw/zinc/52/84/00/1424528400.db2.gz STUHPVBREQYAOU-INIZCTEOSA-N 0 0 397.309 3.482 20 5 GGBDRN O=C1NC(C2CC2)(C2CC2)C(=O)N1Cc1ccc([N+](=O)[O-])cc1C(F)(F)F 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CC(=O)N[C@H](C)CCc1ccc(C(=O)CSc2ccc([N+](=O)[O-])cn2)cc1 ZINC000160133402 1424577603 /nfs/dbraw/zinc/57/76/03/1424577603.db2.gz KFEASVHMUNNCER-CYBMUJFWSA-N 0 0 387.461 3.422 20 5 GGBDRN Cc1nn(C)c(C)c1[C@H](OC(=O)COc1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000160132440 1424577713 /nfs/dbraw/zinc/57/77/13/1424577713.db2.gz VIDGOGCEWQVFGA-HNNXBMFYSA-N 0 0 387.314 3.171 20 5 GGBDRN CNC(=O)c1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1 ZINC000160133246 1424577791 /nfs/dbraw/zinc/57/77/91/1424577791.db2.gz CJGJIYXPGYOKKF-UHFFFAOYSA-N 0 0 396.325 3.295 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C1 ZINC000180097161 1429736819 /nfs/dbraw/zinc/73/68/19/1429736819.db2.gz GDDZOWRRYNYVCY-VXGBXAGGSA-N 0 0 376.475 3.337 20 5 GGBDRN CCS[C@@H]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C1 ZINC000180097124 1429736876 /nfs/dbraw/zinc/73/68/76/1429736876.db2.gz GDDZOWRRYNYVCY-NWDGAFQWSA-N 0 0 376.475 3.337 20 5 GGBDRN Cc1noc(C)c1CCSCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000160143514 1424578994 /nfs/dbraw/zinc/57/89/94/1424578994.db2.gz JVDAXAOTIPYZON-UHFFFAOYSA-N 0 0 377.422 3.474 20 5 GGBDRN CC1CCN(c2ccc(CNC(=O)NCCc3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000160162649 1424581708 /nfs/dbraw/zinc/58/17/08/1424581708.db2.gz XFFAAAJAMNMONP-UHFFFAOYSA-N 0 0 397.479 3.268 20 5 GGBDRN CCOC(=O)C[C@H](C)N(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160166182 1424582563 /nfs/dbraw/zinc/58/25/63/1424582563.db2.gz DPTHBDXANIONOG-VIFPVBQESA-N 0 0 377.319 3.419 20 5 GGBDRN O=C(O[C@H](c1ccccn1)C(F)(F)F)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000160164989 1424582763 /nfs/dbraw/zinc/58/27/63/1424582763.db2.gz VHVGAXQYDIAOBP-CQSZACIVSA-N 0 0 393.281 3.031 20 5 GGBDRN O=C(Nc1ccc(CC[NH+]2CCSCC2)cc1)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000160172073 1424582866 /nfs/dbraw/zinc/58/28/66/1424582866.db2.gz VXZUJNSAFGZFKD-UHFFFAOYSA-N 0 0 387.461 3.144 20 5 GGBDRN COc1c(CNCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)c(C)nn1C ZINC000160188188 1424585034 /nfs/dbraw/zinc/58/50/34/1424585034.db2.gz HNRJLFSVIUXRNS-UHFFFAOYSA-N 0 0 386.408 3.204 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000160192534 1424585061 /nfs/dbraw/zinc/58/50/61/1424585061.db2.gz JYPWAMUWFVHSAR-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN O=C(c1ccc(F)cc1)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000160193631 1424586408 /nfs/dbraw/zinc/58/64/08/1424586408.db2.gz IYHDCBQZZBADFN-CQSZACIVSA-N 0 0 392.408 3.018 20 5 GGBDRN CC[NH+](CC)CCn1c2ccccc2nc1NC(=O)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000160214068 1424587277 /nfs/dbraw/zinc/58/72/77/1424587277.db2.gz FZIYNUXTCUYRFR-UHFFFAOYSA-N 0 0 397.435 3.244 20 5 GGBDRN COCCCOCCN(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160216445 1424588368 /nfs/dbraw/zinc/58/83/68/1424588368.db2.gz FHVRFJBQMRQBLM-UHFFFAOYSA-N 0 0 379.335 3.130 20 5 GGBDRN O=C(NCCCOC[C@@H]1CCOC1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160244776 1424590068 /nfs/dbraw/zinc/59/00/68/1424590068.db2.gz 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CC(C)OCc1cccc(CNC(=O)CSc2ccc([N+](=O)[O-])cn2)c1 ZINC000160292351 1424593191 /nfs/dbraw/zinc/59/31/91/1424593191.db2.gz HIYYESGTNDYGBR-UHFFFAOYSA-N 0 0 375.450 3.323 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)C12CCCCC2 ZINC000160299260 1424593624 /nfs/dbraw/zinc/59/36/24/1424593624.db2.gz PHMUHRZKWBBENV-IRXDYDNUSA-N 0 0 389.452 3.086 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)C12CCCCC2 ZINC000160305081 1424593717 /nfs/dbraw/zinc/59/37/17/1424593717.db2.gz ZZXTURAJXVWEFW-IRXDYDNUSA-N 0 0 389.452 3.086 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)C12CCCCC2 ZINC000160303500 1424593749 /nfs/dbraw/zinc/59/37/49/1424593749.db2.gz XZVJMASJUHEYOG-IRXDYDNUSA-N 0 0 389.452 3.086 20 5 GGBDRN Cc1nnc(SCCn2cc([N+](=O)[O-])ccc2=O)n1[C@@H]1CCC[C@@H](C)C1 ZINC000160335934 1424595914 /nfs/dbraw/zinc/59/59/14/1424595914.db2.gz GBQJDQPVZVIBCL-TZMCWYRMSA-N 0 0 377.470 3.200 20 5 GGBDRN O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccccc1N1CCC(CO)CC1 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ZINC000161341134 1424679424 /nfs/dbraw/zinc/67/94/24/1424679424.db2.gz TWYUUNMPLNGURQ-ZDUSSCGKSA-N 0 0 379.420 3.382 20 5 GGBDRN CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000161454181 1424691342 /nfs/dbraw/zinc/69/13/42/1424691342.db2.gz QUBXMFFKGCIELW-INIZCTEOSA-N 0 0 379.848 3.483 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N(CCc1ccc(F)cc1)C1CCCC1 ZINC000161518872 1424699042 /nfs/dbraw/zinc/69/90/42/1424699042.db2.gz HKMGTZGIEPGNLE-UHFFFAOYSA-N 0 0 389.431 3.127 20 5 GGBDRN CC(C)Oc1cc(CN(C2CC2)S(=O)(=O)c2ccccc2[N+](=O)[O-])ccn1 ZINC000161533279 1424702393 /nfs/dbraw/zinc/70/23/93/1424702393.db2.gz WFCTTYBOPGNMBP-UHFFFAOYSA-N 0 0 391.449 3.130 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000180112309 1429742879 /nfs/dbraw/zinc/74/28/79/1429742879.db2.gz HRMIFUQNRXAFRR-HNNXBMFYSA-N 0 0 396.440 3.004 20 5 GGBDRN Cc1ccc(-c2[nH]nc(NC(=O)c3cn(-c4cccc([N+](=O)[O-])c4)nn3)c2C)o1 ZINC000161547324 1424706783 /nfs/dbraw/zinc/70/67/83/1424706783.db2.gz VJGSAFWWVOJMEX-UHFFFAOYSA-N 0 0 393.363 3.028 20 5 GGBDRN CC[N@@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cccc([N+](=O)[O-])c1[O-] ZINC000161564471 1424712363 /nfs/dbraw/zinc/71/23/63/1424712363.db2.gz GKGXWWDGBFJBJW-MRXNPFEDSA-N 0 0 399.447 3.133 20 5 GGBDRN COCc1ccc([C@H]2CCCN2c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])o1 ZINC000161581767 1424717379 /nfs/dbraw/zinc/71/73/79/1424717379.db2.gz BLLFLHKZBIXVKT-OAHLLOKOSA-N 0 0 380.422 3.079 20 5 GGBDRN COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000161586783 1424717964 /nfs/dbraw/zinc/71/79/64/1424717964.db2.gz VVSXZQKIOWSZPS-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)cccc1[N+](=O)[O-] ZINC000161589544 1424718781 /nfs/dbraw/zinc/71/87/81/1424718781.db2.gz FRUPMLBHYRMAFF-UHFFFAOYSA-N 0 0 381.388 3.128 20 5 GGBDRN CN(CCOCc1ccccc1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000161588296 1424718872 /nfs/dbraw/zinc/71/88/72/1424718872.db2.gz OVLBOXFFJGDIIU-UHFFFAOYSA-N 0 0 380.404 3.069 20 5 GGBDRN COCc1ccc([C@H]2CCCN2c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])o1 ZINC000161593120 1424719804 /nfs/dbraw/zinc/71/98/04/1424719804.db2.gz LDHZYVGUUPMJGR-CYBMUJFWSA-N 0 0 380.422 3.079 20 5 GGBDRN CN(CCOCc1ccccc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000161595841 1424720433 /nfs/dbraw/zinc/72/04/33/1424720433.db2.gz IPXKBSMJZCRQJT-UHFFFAOYSA-N 0 0 380.404 3.069 20 5 GGBDRN CC[C@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1c(C)noc1C ZINC000161617746 1424725529 /nfs/dbraw/zinc/72/55/29/1424725529.db2.gz GJTPGNIYKKFEAD-INIZCTEOSA-N 0 0 383.408 3.481 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000161628342 1424728275 /nfs/dbraw/zinc/72/82/75/1424728275.db2.gz QRDVZKIQJWXBST-MRXNPFEDSA-N 0 0 396.321 3.307 20 5 GGBDRN COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000161643189 1424732001 /nfs/dbraw/zinc/73/20/01/1424732001.db2.gz ZAFUXTSXUQSPQD-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000161652358 1424733448 /nfs/dbraw/zinc/73/34/48/1424733448.db2.gz AGKFPGJCKARXRB-FOIQADDNSA-N 0 0 383.448 3.437 20 5 GGBDRN Cc1c(CC(=O)NCc2ccnc(OCC(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000161663832 1424734722 /nfs/dbraw/zinc/73/47/22/1424734722.db2.gz WXGUAYHDWHNRAR-UHFFFAOYSA-N 0 0 383.326 3.098 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000161665968 1424735379 /nfs/dbraw/zinc/73/53/79/1424735379.db2.gz SYGAWONIEGIKJE-QRWLVFNGSA-N 0 0 383.448 3.437 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@H](O)c1ccc(F)cc1 ZINC000161665881 1424735409 /nfs/dbraw/zinc/73/54/09/1424735409.db2.gz PGGYRGLTBZGOEY-PSLIRLAXSA-N 0 0 397.200 3.348 20 5 GGBDRN CCCCNC(=O)c1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000161673936 1424738206 /nfs/dbraw/zinc/73/82/06/1424738206.db2.gz WHJJRNIWTFJEDR-UHFFFAOYSA-N 0 0 383.448 3.292 20 5 GGBDRN O=C(Cn1cccc([N+](=O)[O-])c1=O)NCCC(c1ccccc1)c1ccccc1 ZINC000161685458 1424740328 /nfs/dbraw/zinc/74/03/28/1424740328.db2.gz YVZQSVSQMDSNEL-UHFFFAOYSA-N 0 0 391.427 3.095 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N(Cc1c(F)cccc1F)C1CCCC1 ZINC000161691537 1424741444 /nfs/dbraw/zinc/74/14/44/1424741444.db2.gz FQSWPBHWUFCDOW-UHFFFAOYSA-N 0 0 393.394 3.224 20 5 GGBDRN O=C(Cn1cccc([N+](=O)[O-])c1=O)N1c2ccccc2CCc2ccccc21 ZINC000161701579 1424744571 /nfs/dbraw/zinc/74/45/71/1424744571.db2.gz DFUFIXDPORNRKN-UHFFFAOYSA-N 0 0 375.384 3.220 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000161717132 1424749134 /nfs/dbraw/zinc/74/91/34/1424749134.db2.gz ZNSNOTMOGCFZFU-INIZCTEOSA-N 0 0 396.321 3.307 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCCOc3cc(F)ccc32)cc1 ZINC000180131962 1429751456 /nfs/dbraw/zinc/75/14/56/1429751456.db2.gz MPYXXOZHMIHQTP-INIZCTEOSA-N 0 0 380.397 3.067 20 5 GGBDRN Cn1cnc(-c2cccc(NC(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000161819056 1424772589 /nfs/dbraw/zinc/77/25/89/1424772589.db2.gz KRIQFIOBEJEINO-UHFFFAOYSA-N 0 0 380.408 3.447 20 5 GGBDRN Cc1cc(C[C@@H](C)Nc2ccc(C(N)=O)cc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000161858759 1424780672 /nfs/dbraw/zinc/78/06/72/1424780672.db2.gz WHJOZPZLIRFKAY-CYBMUJFWSA-N 0 0 379.420 3.231 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@@H]3CCC[C@@]3(C)CO)cc2[N+](=O)[O-])CC1 ZINC000161867443 1424782757 /nfs/dbraw/zinc/78/27/57/1424782757.db2.gz WLBFBJVDRMTFFD-QUCCMNQESA-N 0 0 375.469 3.112 20 5 GGBDRN O=C(c1cn(-c2ccccc2Cl)nn1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161886156 1424787674 /nfs/dbraw/zinc/78/76/74/1424787674.db2.gz WKWSYIVDPMJSHB-UHFFFAOYSA-N 0 0 383.795 3.422 20 5 GGBDRN COc1ccc([C@@H]2CCCCCN2C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1 ZINC000161912816 1424794335 /nfs/dbraw/zinc/79/43/35/1424794335.db2.gz XRLJGNYCNRUYLV-SFHVURJKSA-N 0 0 387.440 3.127 20 5 GGBDRN O=C(CCN1C(=O)CCc2ccccc21)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161919231 1424796929 /nfs/dbraw/zinc/79/69/29/1424796929.db2.gz DMGIBHQNIJUMDM-UHFFFAOYSA-N 0 0 379.416 3.244 20 5 GGBDRN CCOC(=O)CC[C@H]1CCCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000161939702 1424801069 /nfs/dbraw/zinc/80/10/69/1424801069.db2.gz WGKCBWWLMBYVGZ-CYBMUJFWSA-N 0 0 397.859 3.242 20 5 GGBDRN CCOC(=O)CC[C@@H]1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000161940992 1424801143 /nfs/dbraw/zinc/80/11/43/1424801143.db2.gz GYBZSAGNQVZXSJ-AWEZNQCLSA-N 0 0 388.424 3.200 20 5 GGBDRN Cc1sc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1CS(C)(=O)=O ZINC000161954781 1424803058 /nfs/dbraw/zinc/80/30/58/1424803058.db2.gz ZRJYEFRILLWAHM-UHFFFAOYSA-N 0 0 394.474 3.102 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)CNc2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000161980870 1424805693 /nfs/dbraw/zinc/80/56/93/1424805693.db2.gz CMNAHUUGEVBJMG-NSHDSACASA-N 0 0 395.362 3.435 20 5 GGBDRN C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161983535 1424806095 /nfs/dbraw/zinc/80/60/95/1424806095.db2.gz ZKEWYDGJZRKQJV-CYBMUJFWSA-N 0 0 377.441 3.377 20 5 GGBDRN CCOC(=O)CC[C@@H]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000162004228 1424807811 /nfs/dbraw/zinc/80/78/11/1424807811.db2.gz BSZKZHDTZNPGCN-AWEZNQCLSA-N 0 0 388.424 3.200 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)o1 ZINC000162014836 1424808666 /nfs/dbraw/zinc/80/86/66/1424808666.db2.gz FCWYGSJCCZOKNE-SFHVURJKSA-N 0 0 396.403 3.497 20 5 GGBDRN CCNC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC(C)C ZINC000162012140 1424808782 /nfs/dbraw/zinc/80/87/82/1424808782.db2.gz LFHDJGYMCIOLAQ-UHFFFAOYSA-N 0 0 381.498 3.235 20 5 GGBDRN C[C@@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](O)c1ccc(F)cc1 ZINC000162019777 1424809144 /nfs/dbraw/zinc/80/91/44/1424809144.db2.gz NZRAUWGSYNSHIJ-ADLMAVQZSA-N 0 0 396.802 3.395 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@H](C)Cc1ccc(Br)cc1 ZINC000162024823 1424809611 /nfs/dbraw/zinc/80/96/11/1424809611.db2.gz OEDHRRMUOAVNLU-LLVKDONJSA-N 0 0 396.241 3.284 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000162031111 1424810610 /nfs/dbraw/zinc/81/06/10/1424810610.db2.gz HFBFVTQVBZWRSV-SFHVURJKSA-N 0 0 396.403 3.497 20 5 GGBDRN COCCN(Cc1ccccc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000162030844 1424810617 /nfs/dbraw/zinc/81/06/17/1424810617.db2.gz FLENHRVLBJEWSE-UHFFFAOYSA-N 0 0 380.404 3.069 20 5 GGBDRN Cc1nc(COc2ccccc2C(=O)N2CCCc3c([N+](=O)[O-])cccc32)no1 ZINC000162048518 1424811852 /nfs/dbraw/zinc/81/18/52/1424811852.db2.gz VQEZGORDJIUTMF-UHFFFAOYSA-N 0 0 394.387 3.458 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)nc1 ZINC000162061274 1424812682 /nfs/dbraw/zinc/81/26/82/1424812682.db2.gz VZZSAIOHQGLYDB-UHFFFAOYSA-N 0 0 396.447 3.026 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCCn1cnnc1C(C)C ZINC000162060145 1424812687 /nfs/dbraw/zinc/81/26/87/1424812687.db2.gz KCNQTWHSXPHUCW-UHFFFAOYSA-N 0 0 391.497 3.488 20 5 GGBDRN COc1cc(CN2CCCC[C@@H]2C(N)=O)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000162100597 1424815910 /nfs/dbraw/zinc/81/59/10/1424815910.db2.gz HPHQTEIRSOARPM-GOSISDBHSA-N 0 0 399.447 3.022 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c(Cl)c1 ZINC000162099522 1424816091 /nfs/dbraw/zinc/81/60/91/1424816091.db2.gz ARYZLCULLVXYIT-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN COc1ccc(CN2CCCC[C@@H]2C(N)=O)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000162109342 1424816828 /nfs/dbraw/zinc/81/68/28/1424816828.db2.gz AHFGFUFDYRLJHE-GOSISDBHSA-N 0 0 399.447 3.022 20 5 GGBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cnn(-c2ncc(Cl)cc2Cl)c1 ZINC000162144440 1424820016 /nfs/dbraw/zinc/82/00/16/1424820016.db2.gz AHVGSMVUMVZCJC-UHFFFAOYSA-N 0 0 393.190 3.438 20 5 GGBDRN C[C@H]1Oc2ccccc2N(CCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)C1=O ZINC000162159389 1424821316 /nfs/dbraw/zinc/82/13/16/1424821316.db2.gz XIBQXAQBOSYEKG-CQSZACIVSA-N 0 0 395.415 3.078 20 5 GGBDRN Cc1c(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)nnn1-c1ccc(C)cc1 ZINC000162163230 1424821835 /nfs/dbraw/zinc/82/18/35/1424821835.db2.gz OYLRIPSOBQAEGD-UHFFFAOYSA-N 0 0 377.404 3.385 20 5 GGBDRN Cn1ncnc1NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000162165390 1424821969 /nfs/dbraw/zinc/82/19/69/1424821969.db2.gz PKHLMJMGMZRGJD-UHFFFAOYSA-N 0 0 375.392 3.188 20 5 GGBDRN Cc1cc(C)n(-c2ccc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)cn2)n1 ZINC000162223759 1424828057 /nfs/dbraw/zinc/82/80/57/1424828057.db2.gz BIARZOXOMCFNLA-UHFFFAOYSA-N 0 0 377.404 3.385 20 5 GGBDRN CCN(CC)C(=O)N1CCC(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)CC1 ZINC000162223894 1424828128 /nfs/dbraw/zinc/82/81/28/1424828128.db2.gz XBUCDALWMOLRDV-UHFFFAOYSA-N 0 0 388.468 3.048 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162226538 1424828873 /nfs/dbraw/zinc/82/88/73/1424828873.db2.gz PRYVDIVWKATAKJ-HXUWFJFHSA-N 0 0 393.443 3.108 20 5 GGBDRN Cc1ccc(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c(OCc2ccccc2)c1 ZINC000162234513 1424829317 /nfs/dbraw/zinc/82/93/17/1424829317.db2.gz MXOWZRQYAZZQIC-UHFFFAOYSA-N 0 0 393.399 3.283 20 5 GGBDRN O=C(Cc1ccn(-c2ccc(F)cc2)n1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162275442 1424833542 /nfs/dbraw/zinc/83/35/42/1424833542.db2.gz OXKHNHURUBGBGI-UHFFFAOYSA-N 0 0 380.379 3.442 20 5 GGBDRN Cc1cccc(Oc2ncccc2NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c1C ZINC000162293258 1424835257 /nfs/dbraw/zinc/83/52/57/1424835257.db2.gz MDUPKQQYBXLXOU-UHFFFAOYSA-N 0 0 394.387 3.199 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1ccc(N2CCCCC2)c(Cl)c1 ZINC000162344333 1424839977 /nfs/dbraw/zinc/83/99/77/1424839977.db2.gz WRQWMJDAWATZIS-UHFFFAOYSA-N 0 0 390.827 3.039 20 5 GGBDRN CCOC(=O)c1ccnc(N2C[C@@H](C)O[C@H](c3ccsc3)C2)c1[N+](=O)[O-] ZINC000162406539 1424847737 /nfs/dbraw/zinc/84/77/37/1424847737.db2.gz JYZXREBGOUQTGW-RISCZKNCSA-N 0 0 377.422 3.194 20 5 GGBDRN CCOC(=O)c1ccnc(N2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000162406397 1424847859 /nfs/dbraw/zinc/84/78/59/1424847859.db2.gz JYZXREBGOUQTGW-FZMZJTMJSA-N 0 0 377.422 3.194 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCS[C@@H]2COCC[C@@H]21 ZINC000162422680 1424849719 /nfs/dbraw/zinc/84/97/19/1424849719.db2.gz 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COc1cc(OCC(=O)N[C@H](c2nccs2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000171495258 1425704501 /nfs/dbraw/zinc/70/45/01/1425704501.db2.gz SKCZURKOGYARGA-SFHVURJKSA-N 0 0 399.428 3.345 20 5 GGBDRN C[C@H]1c2ccccc2CCN1C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000171510426 1425709591 /nfs/dbraw/zinc/70/95/91/1425709591.db2.gz CKYWVJBVOFEPQD-ZFWWWQNUSA-N 0 0 397.406 3.233 20 5 GGBDRN CC(C)[C@@H]1CCC[C@@H](NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000171519277 1425712008 /nfs/dbraw/zinc/71/20/08/1425712008.db2.gz LOTPAKVKZKUJTN-TZMCWYRMSA-N 0 0 379.482 3.117 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000171521346 1425712917 /nfs/dbraw/zinc/71/29/17/1425712917.db2.gz OITUFCKDXXOSJX-CQSZACIVSA-N 0 0 377.441 3.232 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000171521152 1425713070 /nfs/dbraw/zinc/71/30/70/1425713070.db2.gz UTJZWMYVHJEWGI-CQSZACIVSA-N 0 0 377.441 3.232 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000171523270 1425715283 /nfs/dbraw/zinc/71/52/83/1425715283.db2.gz ZWDYFZZETLRTQW-AWEZNQCLSA-N 0 0 377.441 3.232 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCc2ccccc2C1 ZINC000171524861 1425716110 /nfs/dbraw/zinc/71/61/10/1425716110.db2.gz WQDVMFUZCGFPJA-UHFFFAOYSA-N 0 0 395.415 3.258 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 ZINC000171525337 1425716968 /nfs/dbraw/zinc/71/69/68/1425716968.db2.gz NADVUTJCZIWGMD-AWEZNQCLSA-N 0 0 377.441 3.232 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1nnc(Cc2cccc(F)c2)s1 ZINC000171539530 1425723732 /nfs/dbraw/zinc/72/37/32/1425723732.db2.gz GXCRGJPBGWJPMU-UHFFFAOYSA-N 0 0 387.396 3.498 20 5 GGBDRN C[C@H](NC(=O)C[C@H](C)S(=O)(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000171545915 1425728079 /nfs/dbraw/zinc/72/80/79/1425728079.db2.gz JPOGQYDITNFVMM-STQMWFEESA-N 0 0 394.424 3.164 20 5 GGBDRN CN1C(=O)CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)ccc21 ZINC000171554990 1425733287 /nfs/dbraw/zinc/73/32/87/1425733287.db2.gz GYBNOVCBINMKFN-UHFFFAOYSA-N 0 0 394.431 3.356 20 5 GGBDRN O=C(Nc1cc(F)c(F)cc1F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000171556729 1425733728 /nfs/dbraw/zinc/73/37/28/1425733728.db2.gz XMLWDJDTWYUIPI-UHFFFAOYSA-N 0 0 380.326 3.366 20 5 GGBDRN CC(=O)c1ccc(N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000171563593 1425737969 /nfs/dbraw/zinc/73/79/69/1425737969.db2.gz ZQSORZIGSVQSPJ-CQSZACIVSA-N 0 0 377.441 3.491 20 5 GGBDRN CN(C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000171563588 1425738058 /nfs/dbraw/zinc/73/80/58/1425738058.db2.gz ZGRANDQOLIAWEN-GFCCVEGCSA-N 0 0 380.401 3.196 20 5 GGBDRN Cc1ccsc1C(=O)Nc1ccc(OC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000171577875 1425743023 /nfs/dbraw/zinc/74/30/23/1425743023.db2.gz WIQLQPRZAIVWOU-UHFFFAOYSA-N 0 0 386.389 3.019 20 5 GGBDRN C[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000171585313 1425745321 /nfs/dbraw/zinc/74/53/21/1425745321.db2.gz DWLSEELMVYEFQU-NSHDSACASA-N 0 0 381.404 3.454 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000171588950 1425750081 /nfs/dbraw/zinc/75/00/81/1425750081.db2.gz UQZMFXMKBZPEJL-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000171590466 1425750681 /nfs/dbraw/zinc/75/06/81/1425750681.db2.gz PGFMWYSKXMNQSC-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN O=C(N[C@H](c1nccs1)c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000171591499 1425752029 /nfs/dbraw/zinc/75/20/29/1425752029.db2.gz ZPBWOHWEMUAYOH-HNNXBMFYSA-N 0 0 379.401 3.447 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000171629973 1425765053 /nfs/dbraw/zinc/76/50/53/1425765053.db2.gz BXNGFTBTOSUWHY-GFCCVEGCSA-N 0 0 383.832 3.378 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000171629976 1425765212 /nfs/dbraw/zinc/76/52/12/1425765212.db2.gz 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CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H](c1ccccc1)N1CCCCC1=O ZINC000171763619 1425814446 /nfs/dbraw/zinc/81/44/46/1425814446.db2.gz DAUDKCUGQIKCPH-HXUWFJFHSA-N 0 0 381.432 3.307 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](c1ccccc1)c1cccnc1 ZINC000171768883 1425815646 /nfs/dbraw/zinc/81/56/46/1425815646.db2.gz XAGVQGIAUODLQV-IBGZPJMESA-N 0 0 399.428 3.066 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@H](c1ccccc1)c1cccnc1 ZINC000171768429 1425815657 /nfs/dbraw/zinc/81/56/57/1425815657.db2.gz VXEFBYYQDOTHTG-QGZVFWFLSA-N 0 0 387.392 3.197 20 5 GGBDRN O=C(OCCc1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)N1CCCCC1=O ZINC000171770349 1425816002 /nfs/dbraw/zinc/81/60/02/1425816002.db2.gz LRHQXVVPZDDKBK-FQEVSTJZSA-N 0 0 382.416 3.434 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2cnn(-c3ccc(F)cc3)c2C)c1[N+](=O)[O-] ZINC000171774640 1425817350 /nfs/dbraw/zinc/81/73/50/1425817350.db2.gz VFIARSSMBWOZDO-JTQLQIEISA-N 0 0 386.387 3.005 20 5 GGBDRN CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000171774981 1425817804 /nfs/dbraw/zinc/81/78/04/1425817804.db2.gz UJQXDDREMGKZAW-QGZVFWFLSA-N 0 0 390.823 3.495 20 5 GGBDRN C=CC(=O)NCCNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000171782820 1425819441 /nfs/dbraw/zinc/81/94/41/1425819441.db2.gz CPLRUDRISXJNDR-UHFFFAOYSA-N 0 0 389.795 3.073 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2F)C1=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000171786564 1425820361 /nfs/dbraw/zinc/82/03/61/1425820361.db2.gz KNJXMISHAJVFRS-AWEZNQCLSA-N 0 0 399.403 3.484 20 5 GGBDRN COc1ccc(Cn2cc(C(=O)Nc3ccc(OC)cc3[N+](=O)[O-])cn2)cc1 ZINC000171789116 1425821030 /nfs/dbraw/zinc/82/10/30/1425821030.db2.gz OQRHNQSZSWQLED-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2csc([N+](=O)[O-])c2)cc1C ZINC000171795999 1425822859 /nfs/dbraw/zinc/82/28/59/1425822859.db2.gz ZXLZULVIHGLAMH-CQSZACIVSA-N 0 0 391.474 3.427 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC2(c3cccc(Cl)c3)CCOCC2)c1[N+](=O)[O-] ZINC000171804194 1425824842 /nfs/dbraw/zinc/82/48/42/1425824842.db2.gz RDQWLCHHQMDLHE-UHFFFAOYSA-N 0 0 392.843 3.012 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)c1[N+](=O)[O-] ZINC000171804157 1425825016 /nfs/dbraw/zinc/82/50/16/1425825016.db2.gz CSYIGPDVLFMFQI-UHFFFAOYSA-N 0 0 383.364 3.286 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)c1[N+](=O)[O-] ZINC000171803902 1425825047 /nfs/dbraw/zinc/82/50/47/1425825047.db2.gz XEFDVJQWLAGEKN-UHFFFAOYSA-N 0 0 379.376 3.385 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC[C@@H](c3nc4cc(C)ccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000171806709 1425825291 /nfs/dbraw/zinc/82/52/91/1425825291.db2.gz LDFMLHRMPFGQSP-GFCCVEGCSA-N 0 0 382.424 3.085 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cccc(COCCOC(C)C)c2)c1[N+](=O)[O-] ZINC000171805933 1425825391 /nfs/dbraw/zinc/82/53/91/1425825391.db2.gz GRRMZALSCQRMPV-UHFFFAOYSA-N 0 0 376.413 3.074 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)c1[N+](=O)[O-] ZINC000171806325 1425825549 /nfs/dbraw/zinc/82/55/49/1425825549.db2.gz BODISGJEYSARNF-CYBMUJFWSA-N 0 0 380.351 3.289 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(-c3nc4ccccc4[nH]3)cc2)c1[N+](=O)[O-] ZINC000171808608 1425825989 /nfs/dbraw/zinc/82/59/89/1425825989.db2.gz PUPLLIWCJYNBRN-UHFFFAOYSA-N 0 0 390.403 3.354 20 5 GGBDRN CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000171815130 1425827624 /nfs/dbraw/zinc/82/76/24/1425827624.db2.gz FLLUBRZQMWPSFI-FIIODCPWSA-N 0 0 382.416 3.241 20 5 GGBDRN CCN(Cc1cccs1)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171827623 1425830403 /nfs/dbraw/zinc/83/04/03/1425830403.db2.gz OLTNPYDHMVLZLQ-ZDUSSCGKSA-N 0 0 393.490 3.371 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(COc2ccccc2)CC1 ZINC000171829998 1425830877 /nfs/dbraw/zinc/83/08/77/1425830877.db2.gz ZRMDJEBTEJJURH-UHFFFAOYSA-N 0 0 399.447 3.333 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1ccc(Cl)cc1Cl ZINC000171841852 1425833257 /nfs/dbraw/zinc/83/32/57/1425833257.db2.gz INKQWNJAZAFSDK-OAHLLOKOSA-N 0 0 384.219 3.434 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(F)c(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000171851030 1425835056 /nfs/dbraw/zinc/83/50/56/1425835056.db2.gz PGPUWTIAVGUBLH-GFCCVEGCSA-N 0 0 394.424 3.407 20 5 GGBDRN CCc1nc([C@@H](C)NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000171857697 1425836831 /nfs/dbraw/zinc/83/68/31/1425836831.db2.gz VMRRVTFFOFCOSC-CYBMUJFWSA-N 0 0 389.481 3.207 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccnc(O[C@H](C)CC(C)C)c2)c1[N+](=O)[O-] ZINC000171872298 1425839811 /nfs/dbraw/zinc/83/98/11/1425839811.db2.gz HAWVYBWBXFVJHR-GFCCVEGCSA-N 0 0 375.429 3.019 20 5 GGBDRN COc1ccc(CN(C)[C@H]2CCN(c3ccccc3Cl)C2=O)cc1[N+](=O)[O-] ZINC000171923812 1425853773 /nfs/dbraw/zinc/85/37/73/1425853773.db2.gz GAUCWZWLNSIKNW-INIZCTEOSA-N 0 0 389.839 3.494 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccccc1C)C(C)C ZINC000171979693 1425866428 /nfs/dbraw/zinc/86/64/28/1425866428.db2.gz PNZQQLAQOUYYGW-GOSISDBHSA-N 0 0 385.420 3.364 20 5 GGBDRN CCCC[C@@H](NCc1cc([N+](=O)[O-])ccc1OC)C(=O)Nc1cc(C)on1 ZINC000171979381 1425866551 /nfs/dbraw/zinc/86/65/51/1425866551.db2.gz YGHRAGSEPLIUOC-OAHLLOKOSA-N 0 0 376.413 3.187 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCC2CC2)cc1 ZINC000171985204 1425867615 /nfs/dbraw/zinc/86/76/15/1425867615.db2.gz UBOCDQKVRNBMMO-CYBMUJFWSA-N 0 0 383.404 3.141 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)COc1ccc(N2CCCC2=O)cc1 ZINC000171989124 1425868199 /nfs/dbraw/zinc/86/81/99/1425868199.db2.gz HSDOUUPTKLHQFU-UHFFFAOYSA-N 0 0 383.404 3.356 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)CCc1ccc(Cl)cc1 ZINC000172015557 1425874264 /nfs/dbraw/zinc/87/42/64/1425874264.db2.gz ZHELBWLYABIXLL-UHFFFAOYSA-N 0 0 375.812 3.196 20 5 GGBDRN COc1ccc([C@@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000172015370 1425874287 /nfs/dbraw/zinc/87/42/87/1425874287.db2.gz WCVNOVXOXWVRNL-SFHVURJKSA-N 0 0 376.434 3.438 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000172018545 1425875333 /nfs/dbraw/zinc/87/53/33/1425875333.db2.gz OAFPALSVVAQKNP-KRWDZBQOSA-N 0 0 390.461 3.273 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000172019898 1425875684 /nfs/dbraw/zinc/87/56/84/1425875684.db2.gz XKJYWWKHWUVXGM-MSOLQXFVSA-N 0 0 376.434 3.102 20 5 GGBDRN COc1ccc([C@H]2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)C2)cc1 ZINC000172019653 1425875810 /nfs/dbraw/zinc/87/58/10/1425875810.db2.gz AVJGVUSEDCFESK-HNNXBMFYSA-N 0 0 376.434 3.090 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](COCC(C)C)c2ccco2)ccc1[N+](=O)[O-] ZINC000172019711 1425875828 /nfs/dbraw/zinc/87/58/28/1425875828.db2.gz ZQNBETMWGWWJIF-HNNXBMFYSA-N 0 0 382.438 3.188 20 5 GGBDRN C[C@H](c1ccccc1)N1C(=O)C(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000172023844 1425876351 /nfs/dbraw/zinc/87/63/51/1425876351.db2.gz DQJABUJRCGDFMD-LLVKDONJSA-N 0 0 387.779 3.300 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172024329 1425876662 /nfs/dbraw/zinc/87/66/62/1425876662.db2.gz MUUAKXPICVEAMF-UHFFFAOYSA-N 0 0 375.566 3.472 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1ccc(N2CCCC2=O)cc1 ZINC000172039927 1425880303 /nfs/dbraw/zinc/88/03/03/1425880303.db2.gz SGQRWSAENHZTQZ-UHFFFAOYSA-N 0 0 387.823 3.234 20 5 GGBDRN O=C(c1ccc(F)nc1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000172042890 1425880934 /nfs/dbraw/zinc/88/09/34/1425880934.db2.gz BYYPJKCFWYGNOF-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1ccc(Cn2cccn2)cc1 ZINC000172046243 1425881266 /nfs/dbraw/zinc/88/12/66/1425881266.db2.gz JLFIGGWPQBDGPR-UHFFFAOYSA-N 0 0 384.823 3.352 20 5 GGBDRN O=C(Cc1c[nH]c2ccc(F)cc12)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000172049235 1425882484 /nfs/dbraw/zinc/88/24/84/1425882484.db2.gz WMZBCKASYGATGV-UHFFFAOYSA-N 0 0 382.395 3.107 20 5 GGBDRN Cc1ccc(-c2noc(-c3nn(-c4ccccc4[N+](=O)[O-])c(C)cc3=O)n2)cc1 ZINC000172057839 1425885076 /nfs/dbraw/zinc/88/50/76/1425885076.db2.gz OSAGJFGNAJNQRI-UHFFFAOYSA-N 0 0 389.371 3.475 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000172062364 1425886471 /nfs/dbraw/zinc/88/64/71/1425886471.db2.gz IVJQBLBWZFVHBU-IFXJQAMLSA-N 0 0 387.436 3.476 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)NCc3ccccc3[N+](=O)[O-])cc2)no1 ZINC000172062131 1425886492 /nfs/dbraw/zinc/88/64/92/1425886492.db2.gz NMOXSIFZBVPYPM-UHFFFAOYSA-N 0 0 382.376 3.049 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccccc1C(F)(F)F ZINC000172096783 1425895457 /nfs/dbraw/zinc/89/54/57/1425895457.db2.gz UDGLBXFAJBZQMD-CQSZACIVSA-N 0 0 384.354 3.485 20 5 GGBDRN CN(C[C@@H]1COc2ccccc2O1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172098416 1425895631 /nfs/dbraw/zinc/89/56/31/1425895631.db2.gz WZRCXOUBGYLHKS-CQSZACIVSA-N 0 0 376.796 3.089 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2O3)cc1[N+](=O)[O-])c1ccccn1 ZINC000172100402 1425896168 /nfs/dbraw/zinc/89/61/68/1425896168.db2.gz SSPMFYWIACPTIS-SAYTVZCPSA-N 0 0 382.420 3.213 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000172117107 1425902001 /nfs/dbraw/zinc/90/20/01/1425902001.db2.gz XJYJJQGOQOPPKY-KUHUBIRLSA-N 0 0 387.436 3.476 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000172145451 1425917867 /nfs/dbraw/zinc/91/78/67/1425917867.db2.gz HGTYFEUWOSGJAR-GFCCVEGCSA-N 0 0 383.832 3.378 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCCc1ccc(C(C)C)cc1 ZINC000172147203 1425918672 /nfs/dbraw/zinc/91/86/72/1425918672.db2.gz WHDWYAVUGCPHLO-UHFFFAOYSA-N 0 0 399.447 3.414 20 5 GGBDRN Cc1cccc([C@H](C)NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c1C ZINC000172170268 1425930803 /nfs/dbraw/zinc/93/08/03/1425930803.db2.gz DGHMCEFIHISJSZ-ZDUSSCGKSA-N 0 0 376.434 3.106 20 5 GGBDRN C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1nnnn1-c1ccccc1 ZINC000172174671 1425933835 /nfs/dbraw/zinc/93/38/35/1425933835.db2.gz TUCRZWWYZLDWJF-NSHDSACASA-N 0 0 394.416 3.276 20 5 GGBDRN O=C(c1ccc(F)cc1)N1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172174934 1425934245 /nfs/dbraw/zinc/93/42/45/1425934245.db2.gz CZRFPBAVZMZMAG-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN O=C(NCCc1ccc(Br)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000172176462 1425935109 /nfs/dbraw/zinc/93/51/09/1425935109.db2.gz GOCLSIVGLLEEGC-UHFFFAOYSA-N 0 0 394.181 3.238 20 5 GGBDRN O=C(c1ccc(F)cc1F)N1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172178172 1425935147 /nfs/dbraw/zinc/93/51/47/1425935147.db2.gz XQJFLVJTJXAHEQ-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN CC(C)n1c2ccccc2nc1[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000172179014 1425935975 /nfs/dbraw/zinc/93/59/75/1425935975.db2.gz UIKWLHBFNVWFGV-HNNXBMFYSA-N 0 0 396.451 3.128 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc(-n3cccn3)c(F)c2)ccc1[N+](=O)[O-] ZINC000172183021 1425937193 /nfs/dbraw/zinc/93/71/93/1425937193.db2.gz KUDRZSJSFZDNHM-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN CCOC(=O)c1csc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000172193097 1425941150 /nfs/dbraw/zinc/94/11/50/1425941150.db2.gz JNILALSARHGCBV-UHFFFAOYSA-N 0 0 391.430 3.373 20 5 GGBDRN Cc1cc(S(=O)(=O)[N-]c2cccc(OCCC[NH+](C)C)c2)ccc1[N+](=O)[O-] ZINC000172192969 1425941190 /nfs/dbraw/zinc/94/11/90/1425941190.db2.gz OQHOUFNAWUCHCQ-UHFFFAOYSA-N 0 0 393.465 3.035 20 5 GGBDRN CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCc1ccn(C(C)C)n1 ZINC000172219835 1425952568 /nfs/dbraw/zinc/95/25/68/1425952568.db2.gz CCPQRSDSPXHBNN-UHFFFAOYSA-N 0 0 399.407 3.314 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](OCc2ccncc2)C1 ZINC000172247117 1425965028 /nfs/dbraw/zinc/96/50/28/1425965028.db2.gz FOWIDLFDDLZOOX-RHSMWYFYSA-N 0 0 387.461 3.288 20 5 GGBDRN CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000172253628 1425969643 /nfs/dbraw/zinc/96/96/43/1425969643.db2.gz KXBASXYFEQSCJF-CQSZACIVSA-N 0 0 382.482 3.287 20 5 GGBDRN COc1ccc(CN2CC[C@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2=O)cc1 ZINC000172281298 1425978638 /nfs/dbraw/zinc/97/86/38/1425978638.db2.gz FZPGJZOTTBIYGA-IBGZPJMESA-N 0 0 392.415 3.365 20 5 GGBDRN O=C(OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc2ccccc2[nH]c1=O ZINC000172315477 1425992566 /nfs/dbraw/zinc/99/25/66/1425992566.db2.gz FEYXPNPQPPSRDY-UHFFFAOYSA-N 0 0 391.339 3.448 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NC1(c2ccccc2F)CC1 ZINC000172315335 1425992791 /nfs/dbraw/zinc/99/27/91/1425992791.db2.gz SRPIKBNAVWUIRX-UHFFFAOYSA-N 0 0 377.759 3.131 20 5 GGBDRN COc1cc(CCNC(=O)N2CCCC[C@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000172323201 1425998313 /nfs/dbraw/zinc/99/83/13/1425998313.db2.gz ZCNIARJVYXYGOE-HNNXBMFYSA-N 0 0 379.457 3.375 20 5 GGBDRN O=C(Cc1ccccc1OC(F)F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000172323330 1425998658 /nfs/dbraw/zinc/99/86/58/1425998658.db2.gz YPSKXRCKNWMINC-UHFFFAOYSA-N 0 0 391.374 3.088 20 5 GGBDRN CC[C@@H]1CCCN(C(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000172323195 1425998675 /nfs/dbraw/zinc/99/86/75/1425998675.db2.gz RWSXPXNSVSTGEC-CQSZACIVSA-N 0 0 379.457 3.376 20 5 GGBDRN O=C(N[C@@H]1CS(=O)(=O)c2ccccc21)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000172327222 1426000882 /nfs/dbraw/zinc/00/08/82/1426000882.db2.gz KOUUERUEJHHPJO-CYBMUJFWSA-N 0 0 388.426 3.068 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H](C)Cc2ccccc2F)c([N+](=O)[O-])cc1OC ZINC000172328213 1426001343 /nfs/dbraw/zinc/00/13/43/1426001343.db2.gz DZBNJTUCLOIRIT-ZDUSSCGKSA-N 0 0 390.411 3.289 20 5 GGBDRN CCn1cc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000172332094 1426003078 /nfs/dbraw/zinc/00/30/78/1426003078.db2.gz ZNWGDSVUUQAXOM-AWEZNQCLSA-N 0 0 379.420 3.291 20 5 GGBDRN O=C(c1ccc(-c2ccccc2)[nH]1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172333010 1426003690 /nfs/dbraw/zinc/00/36/90/1426003690.db2.gz XLFWXWBYPHPLEW-OAHLLOKOSA-N 0 0 377.404 3.312 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000172337861 1426005964 /nfs/dbraw/zinc/00/59/64/1426005964.db2.gz UPESXFHRIGEZEW-KRWDZBQOSA-N 0 0 390.823 3.495 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)c1[N+](=O)[O-] ZINC000172342981 1426008449 /nfs/dbraw/zinc/00/84/49/1426008449.db2.gz KFFQHBCZKMOYMZ-AWEZNQCLSA-N 0 0 384.396 3.251 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172349587 1426011016 /nfs/dbraw/zinc/01/10/16/1426011016.db2.gz YOSUMVRIPGJCQY-MAUKXSAKSA-N 0 0 386.452 3.352 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172349592 1426011402 /nfs/dbraw/zinc/01/14/02/1426011402.db2.gz YOSUMVRIPGJCQY-CRAIPNDOSA-N 0 0 386.452 3.352 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ccccc1OCC1CC1 ZINC000172394866 1426025171 /nfs/dbraw/zinc/02/51/71/1426025171.db2.gz CRBAYGHFMNJHPL-UHFFFAOYSA-N 0 0 385.420 3.392 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1 ZINC000172407675 1426029294 /nfs/dbraw/zinc/02/92/94/1426029294.db2.gz WEZGKDWTKKAVNT-HNNXBMFYSA-N 0 0 377.303 3.013 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)[C@@H]1Cc2ccccc2O1 ZINC000172410897 1426029719 /nfs/dbraw/zinc/02/97/19/1426029719.db2.gz AKKFDYCTLYFOAZ-HNNXBMFYSA-N 0 0 378.178 3.404 20 5 GGBDRN O=C(N[C@@H](CN1CCOCC1)c1ccccc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000172409249 1426029806 /nfs/dbraw/zinc/02/98/06/1426029806.db2.gz BBVFDNSQUKRWRE-SFHVURJKSA-N 0 0 389.839 3.052 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172409698 1426029879 /nfs/dbraw/zinc/02/98/79/1426029879.db2.gz MLNMZQZEXJGYDH-UHFFFAOYSA-N 0 0 392.165 3.468 20 5 GGBDRN O=C(CN1CCCCCCC1=O)OCc1ccc([N+](=O)[O-])cc1Br ZINC000172411055 1426030573 /nfs/dbraw/zinc/03/05/73/1426030573.db2.gz WHYHFIGJMVAPDY-UHFFFAOYSA-N 0 0 399.241 3.193 20 5 GGBDRN COC(=O)c1cc(Cl)cc(NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000172413837 1426031070 /nfs/dbraw/zinc/03/10/70/1426031070.db2.gz SHFTZFNXXUVCPV-UHFFFAOYSA-N 0 0 389.795 3.036 20 5 GGBDRN COC(=O)c1cc(Cl)cc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000172414268 1426031992 /nfs/dbraw/zinc/03/19/92/1426031992.db2.gz IFSIJCVJMIOPSM-UHFFFAOYSA-N 0 0 377.784 3.394 20 5 GGBDRN Cc1nn(C(F)F)c(C)c1CC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000172414544 1426032247 /nfs/dbraw/zinc/03/22/47/1426032247.db2.gz IAIQMZVWEIMBBT-UHFFFAOYSA-N 0 0 380.395 3.485 20 5 GGBDRN O=C(NC[C@@H]1CCCOC1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000172415560 1426032967 /nfs/dbraw/zinc/03/29/67/1426032967.db2.gz XQQWTTGYUIHARU-JTQLQIEISA-N 0 0 399.234 3.244 20 5 GGBDRN COc1ccc2c(c1)C[C@@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)CO2 ZINC000172415775 1426033320 /nfs/dbraw/zinc/03/33/20/1426033320.db2.gz JXVXYARVHLLHHG-QGZVFWFLSA-N 0 0 384.432 3.294 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172415979 1426033393 /nfs/dbraw/zinc/03/33/93/1426033393.db2.gz DKJVLAZIYPHSTI-QGZVFWFLSA-N 0 0 389.496 3.318 20 5 GGBDRN Cc1ccc(C(=O)N[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C(C)C)cc1 ZINC000172421200 1426035854 /nfs/dbraw/zinc/03/58/54/1426035854.db2.gz TZXXJBRPLFLPPZ-LJQANCHMSA-N 0 0 381.432 3.247 20 5 GGBDRN O=C([C@@H]1CCCN1c1ncnc2sccc21)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172420704 1426036130 /nfs/dbraw/zinc/03/61/30/1426036130.db2.gz ZGTRYFBUZFCZPY-INIZCTEOSA-N 0 0 395.444 3.158 20 5 GGBDRN Cc1ccc(-n2cnnc2SCC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000172421075 1426036269 /nfs/dbraw/zinc/03/62/69/1426036269.db2.gz HXERASFVGZXYBO-UHFFFAOYSA-N 0 0 395.444 3.165 20 5 GGBDRN O=C(Nc1cccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1)c1cccnc1 ZINC000172423317 1426037538 /nfs/dbraw/zinc/03/75/38/1426037538.db2.gz IXIDDHUZLNXFFX-UHFFFAOYSA-N 0 0 388.383 3.445 20 5 GGBDRN Cc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])nnn1-c1ccccc1Cl ZINC000172423972 1426037816 /nfs/dbraw/zinc/03/78/16/1426037816.db2.gz ZMVXTEMWAUATBL-UHFFFAOYSA-N 0 0 383.795 3.340 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)NCc2ccccc2[N+](=O)[O-])cc1)C1CC1 ZINC000172423799 1426037952 /nfs/dbraw/zinc/03/79/52/1426037952.db2.gz HSJKHAVJNJDCMH-UHFFFAOYSA-N 0 0 382.420 3.427 20 5 GGBDRN O=C(c1cccs1)N1CCCC[C@@H]1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424968 1426039356 /nfs/dbraw/zinc/03/93/56/1426039356.db2.gz YUGQQHFEJBMBBS-MRXNPFEDSA-N 0 0 385.445 3.240 20 5 GGBDRN CN1CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2ccccc21 ZINC000172432133 1426042055 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ZINC000172509275 1426064608 /nfs/dbraw/zinc/06/46/08/1426064608.db2.gz UVUVHAKFRVXMFG-UHFFFAOYSA-N 0 0 393.871 3.359 20 5 GGBDRN O=C(NCc1ccccc1N1CCOCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000172509964 1426065302 /nfs/dbraw/zinc/06/53/02/1426065302.db2.gz MSKJPHINMHFXJP-UHFFFAOYSA-N 0 0 375.812 3.015 20 5 GGBDRN CCN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccccc1C(=O)OC ZINC000172514345 1426067226 /nfs/dbraw/zinc/06/72/26/1426067226.db2.gz XAODPOCWRGAGFM-UHFFFAOYSA-N 0 0 394.387 3.234 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2[nH]ccc21 ZINC000172522422 1426069918 /nfs/dbraw/zinc/06/99/18/1426069918.db2.gz UEIHEPYQXWQBIP-UHFFFAOYSA-N 0 0 380.404 3.154 20 5 GGBDRN CSc1ccc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000172522636 1426069944 /nfs/dbraw/zinc/06/99/44/1426069944.db2.gz GWZPZKFDLDPVCE-UHFFFAOYSA-N 0 0 387.461 3.394 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2ncccc2c1 ZINC000172522456 1426069953 /nfs/dbraw/zinc/06/99/53/1426069953.db2.gz ZXWQNENEBATGIZ-UHFFFAOYSA-N 0 0 392.415 3.221 20 5 GGBDRN COc1c(C)ccc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1C ZINC000172522572 1426070052 /nfs/dbraw/zinc/07/00/52/1426070052.db2.gz IRSCNHNODXQNBP-UHFFFAOYSA-N 0 0 399.447 3.298 20 5 GGBDRN CSc1cccc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000172522434 1426070089 /nfs/dbraw/zinc/07/00/89/1426070089.db2.gz JVFMZENBXVONJQ-UHFFFAOYSA-N 0 0 387.461 3.394 20 5 GGBDRN CCOc1ccccc1NC(=O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000172522711 1426070131 /nfs/dbraw/zinc/07/01/31/1426070131.db2.gz RGKIVUIJDYCUKI-UHFFFAOYSA-N 0 0 385.420 3.071 20 5 GGBDRN Cc1nc2ccc(NC(=O)C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)cc2o1 ZINC000172522605 1426070157 /nfs/dbraw/zinc/07/01/57/1426070157.db2.gz LLXKCFOVFORSAK-UHFFFAOYSA-N 0 0 396.403 3.122 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NC1(c2cccc(F)c2)CC1 ZINC000172534386 1426076180 /nfs/dbraw/zinc/07/61/80/1426076180.db2.gz NUMNSLMOZUHNDF-UHFFFAOYSA-N 0 0 377.759 3.131 20 5 GGBDRN 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20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCOc2ccc(Cl)cc21 ZINC000172684669 1426141921 /nfs/dbraw/zinc/14/19/21/1426141921.db2.gz CXORXKKXNYQLDP-UHFFFAOYSA-N 0 0 384.779 3.473 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ncoc1-c1ccc2c(c1)OCCO2 ZINC000172688015 1426143296 /nfs/dbraw/zinc/14/32/96/1426143296.db2.gz XPQPQSWPYZSNSX-UHFFFAOYSA-N 0 0 385.307 3.412 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCN(C(=O)c2ccncc2)C1 ZINC000172688338 1426143668 /nfs/dbraw/zinc/14/36/68/1426143668.db2.gz AGUQCWGYHVNHHC-ZDUSSCGKSA-N 0 0 388.811 3.134 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCN(C(=O)c2ccncc2)C1 ZINC000172688335 1426143691 /nfs/dbraw/zinc/14/36/91/1426143691.db2.gz AGUQCWGYHVNHHC-CYBMUJFWSA-N 0 0 388.811 3.134 20 5 GGBDRN O=C(NCCCC1CCCC1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000172691623 1426144855 /nfs/dbraw/zinc/14/48/55/1426144855.db2.gz MGBYBXRSVMHGHC-UHFFFAOYSA-N 0 0 388.468 3.033 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1c(Cl)cccc1Cl 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C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000172775557 1426182540 /nfs/dbraw/zinc/18/25/40/1426182540.db2.gz FBNHPOUOXLZKPM-PJIJBLCYSA-N 0 0 399.422 3.462 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCCc3ccn(-c4ccc(F)cc4)n3)cc2N1 ZINC000172777475 1426183151 /nfs/dbraw/zinc/18/31/51/1426183151.db2.gz MJVLYMDSWHCPSC-UHFFFAOYSA-N 0 0 395.394 3.459 20 5 GGBDRN CCOC(=O)c1ccnc(N2CC[C@@H](COCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000172776246 1426183223 /nfs/dbraw/zinc/18/32/23/1426183223.db2.gz JRYVEFFCQPQMQR-MRXNPFEDSA-N 0 0 385.420 3.210 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000172779605 1426184530 /nfs/dbraw/zinc/18/45/30/1426184530.db2.gz NBNABLUKOWAKHD-SWLSCSKDSA-N 0 0 385.445 3.241 20 5 GGBDRN CSc1ccc(C(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000172779593 1426184773 /nfs/dbraw/zinc/18/47/73/1426184773.db2.gz NBNABLUKOWAKHD-WFASDCNBSA-N 0 0 385.445 3.241 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000172782308 1426185474 /nfs/dbraw/zinc/18/54/74/1426185474.db2.gz DCFAHVQVRTXLMF-ADLMAVQZSA-N 0 0 391.374 3.318 20 5 GGBDRN CN(Cc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1)C(=O)C(F)(F)F ZINC000172783877 1426186169 /nfs/dbraw/zinc/18/61/69/1426186169.db2.gz OLLHZWFZOLFNOW-UHFFFAOYSA-N 0 0 395.337 3.297 20 5 GGBDRN COCCOC[C@@H]1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000172784223 1426186792 /nfs/dbraw/zinc/18/67/92/1426186792.db2.gz SOFFXRXWQWYBKU-SNVBAGLBSA-N 0 0 393.318 3.011 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1 ZINC000172786703 1426188352 /nfs/dbraw/zinc/18/83/52/1426188352.db2.gz SNDUYGGGXLGKOH-UHFFFAOYSA-N 0 0 383.404 3.157 20 5 GGBDRN COc1ccccc1CN(C[C@H]1CCCO1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172796020 1426192698 /nfs/dbraw/zinc/19/26/98/1426192698.db2.gz LBKRGBVTZPWLJU-LJQANCHMSA-N 0 0 384.432 3.354 20 5 GGBDRN 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ZINC000823630504 1426207449 /nfs/dbraw/zinc/20/74/49/1426207449.db2.gz ZAQZDYNBDPVCLG-UHFFFAOYSA-N 0 0 393.451 3.373 20 5 GGBDRN COc1cc(CCNC(=O)c2c(F)cc(F)cc2F)c([N+](=O)[O-])cc1OC ZINC000172829143 1426207802 /nfs/dbraw/zinc/20/78/02/1426207802.db2.gz KGDDGNDABWEKFA-UHFFFAOYSA-N 0 0 384.310 3.002 20 5 GGBDRN Cc1ccc(N2CCC[C@H](NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])C2=O)cc1 ZINC000172845532 1426217009 /nfs/dbraw/zinc/21/70/09/1426217009.db2.gz ZIVKXMPHGGVLFP-INIZCTEOSA-N 0 0 387.823 3.482 20 5 GGBDRN CCOc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1S(=O)(=O)N(C)C ZINC000172866371 1426229410 /nfs/dbraw/zinc/22/94/10/1426229410.db2.gz FHEORBRBVMXCAL-UHFFFAOYSA-N 0 0 393.465 3.164 20 5 GGBDRN COc1cc(NCc2cccc([N+](=O)[O-])c2)c(C(=O)N2CCCC2)cc1OC ZINC000172872976 1426232845 /nfs/dbraw/zinc/23/28/45/1426232845.db2.gz MMCLIKDNAMOZDP-UHFFFAOYSA-N 0 0 385.420 3.460 20 5 GGBDRN COc1ccc(C2(CNC(=O)c3cc(C)ccc3[N+](=O)[O-])CCOCC2)cc1 ZINC000172883136 1426237845 /nfs/dbraw/zinc/23/78/45/1426237845.db2.gz 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Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C(=O)CCCc3ccccc3)CC2)c1 ZINC000172921083 1426264288 /nfs/dbraw/zinc/26/42/88/1426264288.db2.gz WSFXEBIVRDBPSX-UHFFFAOYSA-N 0 0 395.459 3.211 20 5 GGBDRN C[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)[C@H]1c1cccs1 ZINC000821623547 1426269665 /nfs/dbraw/zinc/26/96/65/1426269665.db2.gz NCZVLAJGKNPUCU-PXAZEXFGSA-N 0 0 399.480 3.331 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccc(F)cc2OC(F)F)c([N+](=O)[O-])c1 ZINC000172932088 1426270537 /nfs/dbraw/zinc/27/05/37/1426270537.db2.gz QVWFQIWGUTZBMU-UHFFFAOYSA-N 0 0 385.298 3.395 20 5 GGBDRN Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172933601 1426271951 /nfs/dbraw/zinc/27/19/51/1426271951.db2.gz HMUXQUNRELJCMT-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN CCOC(=O)[C@@H](C)NC(=O)c1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000172936069 1426274023 /nfs/dbraw/zinc/27/40/23/1426274023.db2.gz PPUSWIJGSJFQSW-CQSZACIVSA-N 0 0 385.420 3.197 20 5 GGBDRN CC(C)COC[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000172966593 1426287145 /nfs/dbraw/zinc/28/71/45/1426287145.db2.gz QOSRIZJRAZGCMT-HNNXBMFYSA-N 0 0 375.425 3.154 20 5 GGBDRN O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(OS(=O)(=O)C3CC3)cc2o1 ZINC000172969478 1426287486 /nfs/dbraw/zinc/28/74/86/1426287486.db2.gz OTXMVTKTSLALEQ-UHFFFAOYSA-N 0 0 387.369 3.239 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@H](C)CN2CCOCC2)c1 ZINC000172968787 1426287733 /nfs/dbraw/zinc/28/77/33/1426287733.db2.gz YHDLLRVETSAKLK-GOSISDBHSA-N 0 0 397.475 3.266 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@@H](C)CN2CCOCC2)c1 ZINC000172968779 1426287950 /nfs/dbraw/zinc/28/79/50/1426287950.db2.gz YHDLLRVETSAKLK-SFHVURJKSA-N 0 0 397.475 3.266 20 5 GGBDRN COCCCOc1cccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000172972618 1426289572 /nfs/dbraw/zinc/28/95/72/1426289572.db2.gz IEQKKHWHJCCSCJ-UHFFFAOYSA-N 0 0 396.403 3.448 20 5 GGBDRN COc1cc(CCNc2ncnc3cc(F)c(F)cc32)c([N+](=O)[O-])cc1OC ZINC000172973172 1426289715 /nfs/dbraw/zinc/28/97/15/1426289715.db2.gz WYVJQKDMSKQNMC-UHFFFAOYSA-N 0 0 390.346 3.488 20 5 GGBDRN CCCN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000172981296 1426292004 /nfs/dbraw/zinc/29/20/04/1426292004.db2.gz OMGUNXUERNRKCV-KRWDZBQOSA-N 0 0 391.468 3.385 20 5 GGBDRN Cc1ccc(C(=O)N2CCc3c(cccc3N3CCOC3=O)C2)cc1[N+](=O)[O-] ZINC000172985633 1426295589 /nfs/dbraw/zinc/29/55/89/1426295589.db2.gz JTORKQSDXRBGCD-UHFFFAOYSA-N 0 0 381.388 3.058 20 5 GGBDRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000172988978 1426297808 /nfs/dbraw/zinc/29/78/08/1426297808.db2.gz FAXSSPJIXIRNNO-GXTWGEPZSA-N 0 0 379.482 3.213 20 5 GGBDRN CCC[C@H]1[C@H](C)CCCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000172988974 1426298125 /nfs/dbraw/zinc/29/81/25/1426298125.db2.gz FAXSSPJIXIRNNO-OCCSQVGLSA-N 0 0 379.482 3.213 20 5 GGBDRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000172992517 1426299479 /nfs/dbraw/zinc/29/94/79/1426299479.db2.gz SIQLGUPULYRNPP-GXTWGEPZSA-N 0 0 381.860 3.405 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)c1 ZINC000172994276 1426300089 /nfs/dbraw/zinc/30/00/89/1426300089.db2.gz CDNXSRUOEVRCKQ-UHFFFAOYSA-N 0 0 380.404 3.024 20 5 GGBDRN Cc1cc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)ccc1-n1cncn1 ZINC000173002982 1426304130 /nfs/dbraw/zinc/30/41/30/1426304130.db2.gz QITUNRUZKLOZQE-UHFFFAOYSA-N 0 0 385.811 3.410 20 5 GGBDRN CC(C)OC(=O)[C@H](C)CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000173003513 1426304672 /nfs/dbraw/zinc/30/46/72/1426304672.db2.gz BEBPBPNSGQKTFQ-LLVKDONJSA-N 0 0 377.422 3.036 20 5 GGBDRN CC(=O)N1CCC(CCC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000173010775 1426306937 /nfs/dbraw/zinc/30/69/37/1426306937.db2.gz BBVBWAPPTADIBX-UHFFFAOYSA-N 0 0 399.451 3.066 20 5 GGBDRN CN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000173011113 1426307626 /nfs/dbraw/zinc/30/76/26/1426307626.db2.gz OHHHUFJEWXBQAQ-KRWDZBQOSA-N 0 0 387.823 3.055 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173012824 1426308159 /nfs/dbraw/zinc/30/81/59/1426308159.db2.gz NSRUZKDDSNUIBT-UHFFFAOYSA-N 0 0 392.358 3.007 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000173012811 1426308213 /nfs/dbraw/zinc/30/82/13/1426308213.db2.gz HOANLHMLVOFDFT-UHFFFAOYSA-N 0 0 392.358 3.387 20 5 GGBDRN CN(CC(=O)N1CCC[C@H]1c1cccc2c1OCCO2)c1ccccc1[N+](=O)[O-] ZINC000173024724 1426312761 /nfs/dbraw/zinc/31/27/61/1426312761.db2.gz XDUKQVUXHWSAGU-INIZCTEOSA-N 0 0 397.431 3.166 20 5 GGBDRN CC(C)[C@](C)(CNC(=O)OC(C)(C)C)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173037532 1426318335 /nfs/dbraw/zinc/31/83/35/1426318335.db2.gz PQYDYDVSEPBRQG-IBGZPJMESA-N 0 0 379.457 3.193 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCc1nc(-c2cccc(Cl)c2)no1 ZINC000173039716 1426318872 /nfs/dbraw/zinc/31/88/72/1426318872.db2.gz JVHRZOOVJFBWOZ-UHFFFAOYSA-N 0 0 386.795 3.200 20 5 GGBDRN CCc1cnc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)s1 ZINC000173054938 1426324562 /nfs/dbraw/zinc/32/45/62/1426324562.db2.gz GQIVYCLQDVIFLQ-UHFFFAOYSA-N 0 0 390.450 3.146 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C12CCCCC2 ZINC000173062765 1426327594 /nfs/dbraw/zinc/32/75/94/1426327594.db2.gz XAKQMQDMVCSCGE-HZPDHXFCSA-N 0 0 378.473 3.042 20 5 GGBDRN O=C(CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1ccccc1 ZINC000173065905 1426329233 /nfs/dbraw/zinc/32/92/33/1426329233.db2.gz PIGDBKQTEVOACR-UHFFFAOYSA-N 0 0 382.294 3.087 20 5 GGBDRN CN(CC(=O)N[C@@H](c1nccs1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000173068492 1426329642 /nfs/dbraw/zinc/32/96/42/1426329642.db2.gz VXQIAMVDSZXFKJ-GOSISDBHSA-N 0 0 382.445 3.393 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000173093180 1426339008 /nfs/dbraw/zinc/33/90/08/1426339008.db2.gz MPKSWDHQLXDTAH-SNVBAGLBSA-N 0 0 384.348 3.046 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2cccnc2c1C ZINC000173116686 1426350472 /nfs/dbraw/zinc/35/04/72/1426350472.db2.gz ILMGJGKCYFHPHJ-UHFFFAOYSA-N 0 0 399.428 3.416 20 5 GGBDRN Cc1csc(N(C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C2CC2)n1 ZINC000173126745 1426352877 /nfs/dbraw/zinc/35/28/77/1426352877.db2.gz AFAFGSISBBTLKT-UHFFFAOYSA-N 0 0 384.421 3.058 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C[S@](C)=O)c1ccccc1 ZINC000173138021 1426360425 /nfs/dbraw/zinc/36/04/25/1426360425.db2.gz NBRONZHPMMCBFI-OEDMPGADSA-N 0 0 392.502 3.311 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@H](C)C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000173140029 1426361477 /nfs/dbraw/zinc/36/14/77/1426361477.db2.gz KEGNLUJLYDFUNY-AWEZNQCLSA-N 0 0 387.484 3.051 20 5 GGBDRN C[C@@H](NC(=O)c1cc(N2CCNC2=O)ccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000173142654 1426362772 /nfs/dbraw/zinc/36/27/72/1426362772.db2.gz SQARROPGEYOJDN-LLVKDONJSA-N 0 0 388.811 3.269 20 5 GGBDRN C[C@H](NC(=O)c1cc(N2CCNC2=O)ccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000173142647 1426362832 /nfs/dbraw/zinc/36/28/32/1426362832.db2.gz SQARROPGEYOJDN-NSHDSACASA-N 0 0 388.811 3.269 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173144812 1426363817 /nfs/dbraw/zinc/36/38/17/1426363817.db2.gz SEIIWBCFVYTFJE-KRWDZBQOSA-N 0 0 378.388 3.001 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-n3nnnc3C3CC3)ccc2F)c1 ZINC000173152838 1426367479 /nfs/dbraw/zinc/36/74/79/1426367479.db2.gz KTTBWUBNCQEYED-UHFFFAOYSA-N 0 0 382.355 3.148 20 5 GGBDRN CCCC[C@@H](COC)NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173154276 1426367928 /nfs/dbraw/zinc/36/79/28/1426367928.db2.gz KJLKEVUBZJGMFA-HNNXBMFYSA-N 0 0 379.457 3.353 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCCC(=O)Nc1ccc(Cl)cc1 ZINC000173158359 1426370299 /nfs/dbraw/zinc/37/02/99/1426370299.db2.gz IXRQAVMDEDYQFF-UHFFFAOYSA-N 0 0 375.812 3.326 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000173168824 1426374753 /nfs/dbraw/zinc/37/47/53/1426374753.db2.gz JNVNJRXOPVWNFT-OAHLLOKOSA-N 0 0 385.420 3.022 20 5 GGBDRN CCOc1cc2c(cc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000173169451 1426375242 /nfs/dbraw/zinc/37/52/42/1426375242.db2.gz HFNUOPYFVGQYMK-ZDUSSCGKSA-N 0 0 385.420 3.392 20 5 GGBDRN CN(CC(=O)N1CCC(OCc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000173173114 1426376837 /nfs/dbraw/zinc/37/68/37/1426376837.db2.gz TXUYGBLUNRLYQM-UHFFFAOYSA-N 0 0 383.448 3.239 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(Oc2cccnn2)c1 ZINC000173173922 1426377467 /nfs/dbraw/zinc/37/74/67/1426377467.db2.gz VIEMXWNSZZTFTE-UHFFFAOYSA-N 0 0 379.376 3.495 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173186908 1426382863 /nfs/dbraw/zinc/38/28/63/1426382863.db2.gz UGCXESXPKMQMNL-UHFFFAOYSA-N 0 0 392.799 3.251 20 5 GGBDRN CN(CC(=O)N1CCC(C(=O)c2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000173200708 1426390026 /nfs/dbraw/zinc/39/00/26/1426390026.db2.gz JCAGJSTZXBHJJN-UHFFFAOYSA-N 0 0 381.432 3.153 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(NC(=O)NC3CCCCC3)CC2)c1 ZINC000173220748 1426402855 /nfs/dbraw/zinc/40/28/55/1426402855.db2.gz MZKFLPNCAMIFLB-UHFFFAOYSA-N 0 0 388.468 3.140 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1F ZINC000173223578 1426407211 /nfs/dbraw/zinc/40/72/11/1426407211.db2.gz APGBJFITPBVNMZ-MHZLTWQESA-N 0 0 391.424 3.324 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCCN(c2ccccc2Cl)C1=O ZINC000173246974 1426427778 /nfs/dbraw/zinc/42/77/78/1426427778.db2.gz KAIPNLHERGMFIL-INIZCTEOSA-N 0 0 387.823 3.103 20 5 GGBDRN C[C@H]1CCN(C)c2ccccc2N1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173251374 1426431046 /nfs/dbraw/zinc/43/10/46/1426431046.db2.gz PNLTZTYARXQOAF-AWEZNQCLSA-N 0 0 392.419 3.051 20 5 GGBDRN COc1cc(C(=O)N2c3ccccc3N(C)CC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000173251435 1426431389 /nfs/dbraw/zinc/43/13/89/1426431389.db2.gz CXMXMHSYCMXADY-CYBMUJFWSA-N 0 0 385.420 3.487 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@H](C)C[C@H]1c1ccco1 ZINC000173255697 1426434816 /nfs/dbraw/zinc/43/48/16/1426434816.db2.gz RKXLOTGUMZLSMB-JSGCOSHPSA-N 0 0 380.422 3.358 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000173256205 1426434831 /nfs/dbraw/zinc/43/48/31/1426434831.db2.gz WPFGHZWGSDTFQN-OCCSQVGLSA-N 0 0 380.422 3.358 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1[N+](=O)[O-] ZINC000173256043 1426434874 /nfs/dbraw/zinc/43/48/74/1426434874.db2.gz DENRAHZPUMKLHN-UHFFFAOYSA-N 0 0 384.392 3.028 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](C)C[C@H]1c1ccco1 ZINC000173256787 1426435750 /nfs/dbraw/zinc/43/57/50/1426435750.db2.gz IQFVOELXNJYJSD-JSGCOSHPSA-N 0 0 380.422 3.358 20 5 GGBDRN CCc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)cc1[N+](=O)[O-] ZINC000173259025 1426437663 /nfs/dbraw/zinc/43/76/63/1426437663.db2.gz OLSYUNBYDNCVAD-KRWDZBQOSA-N 0 0 389.477 3.022 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCCCC[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000173258764 1426437787 /nfs/dbraw/zinc/43/77/87/1426437787.db2.gz QJABSEYABIPFQC-MRXNPFEDSA-N 0 0 391.468 3.151 20 5 GGBDRN COc1cc(OCC(=O)N2c3ccccc3N(C)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000173259699 1426438613 /nfs/dbraw/zinc/43/86/13/1426438613.db2.gz ARJMJXMTZPYDBD-AWEZNQCLSA-N 0 0 385.420 3.244 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cc1[N+](=O)[O-] ZINC000173263535 1426442346 /nfs/dbraw/zinc/44/23/46/1426442346.db2.gz NSLPUBULIJXPQR-UHFFFAOYSA-N 0 0 391.449 3.096 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(Br)nc1 ZINC000173278173 1426455287 /nfs/dbraw/zinc/45/52/87/1426455287.db2.gz NLBMSCBVZSDMBS-UHFFFAOYSA-N 0 0 394.181 3.166 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])cn21 ZINC000173286888 1426465064 /nfs/dbraw/zinc/46/50/64/1426465064.db2.gz AHOJTYKQORRBOL-UHFFFAOYSA-N 0 0 378.310 3.500 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)cc3)CC2)cc1[N+](=O)[O-] ZINC000173306958 1426489302 /nfs/dbraw/zinc/48/93/02/1426489302.db2.gz NDALEHLOVDYISQ-UHFFFAOYSA-N 0 0 381.432 3.064 20 5 GGBDRN CN(CC(=O)N(Cc1ccccc1)CC1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000173317630 1426500417 /nfs/dbraw/zinc/50/04/17/1426500417.db2.gz JQVIIRPAXXJQEK-UHFFFAOYSA-N 0 0 397.475 3.486 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)cc1[N+](=O)[O-] ZINC000173321829 1426504053 /nfs/dbraw/zinc/50/40/53/1426504053.db2.gz WTKAKBRRTYSELW-KRWDZBQOSA-N 0 0 396.447 3.352 20 5 GGBDRN CCC[C@H](C)c1cc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)n[nH]1 ZINC000173327265 1426509634 /nfs/dbraw/zinc/50/96/34/1426509634.db2.gz QHBYFTSCVDSNEE-NSHDSACASA-N 0 0 383.412 3.363 20 5 GGBDRN Cc1cccc(O[C@@H](C)CNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000173330525 1426511344 /nfs/dbraw/zinc/51/13/44/1426511344.db2.gz YBLRTHULQPMMLC-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1cccc(O[C@@H](C)CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000173330631 1426511405 /nfs/dbraw/zinc/51/14/05/1426511405.db2.gz BTTBDQARCXYRLT-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000173334477 1426515831 /nfs/dbraw/zinc/51/58/31/1426515831.db2.gz JUTUYFAYCNNITD-OAHLLOKOSA-N 0 0 377.441 3.287 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cs1 ZINC000173346593 1426524635 /nfs/dbraw/zinc/52/46/35/1426524635.db2.gz QVPMVVYGFMVBHM-UHFFFAOYSA-N 0 0 380.401 3.356 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2coc(-c3ccccc3)n2)c1C ZINC000173348437 1426525702 /nfs/dbraw/zinc/52/57/02/1426525702.db2.gz DARABFVEDLKKRG-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000173353789 1426529794 /nfs/dbraw/zinc/52/97/94/1426529794.db2.gz VRENUELDYRUUHS-UHFFFAOYSA-N 0 0 383.795 3.163 20 5 GGBDRN COc1cc(C(=O)N[C@@H](c2nc(C)cs2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000173376936 1426549950 /nfs/dbraw/zinc/54/99/50/1426549950.db2.gz NXJOTRCGEUBION-OAHLLOKOSA-N 0 0 377.422 3.258 20 5 GGBDRN COc1ccc([C@H](C)CCNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 ZINC000173380561 1426554125 /nfs/dbraw/zinc/55/41/25/1426554125.db2.gz LBNPQEQMXDFPLN-GFCCVEGCSA-N 0 0 382.413 3.215 20 5 GGBDRN CC(C)=CC(=O)NCc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000173400656 1426583087 /nfs/dbraw/zinc/58/30/87/1426583087.db2.gz JMDGVVWGIHEIFZ-UHFFFAOYSA-N 0 0 381.432 3.449 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@H](C)Oc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000173404220 1426588345 /nfs/dbraw/zinc/58/83/45/1426588345.db2.gz AXAQNMKMEOEGNP-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2)CCO1 ZINC000173412100 1426595621 /nfs/dbraw/zinc/59/56/21/1426595621.db2.gz SOTDHVAZWHKEON-OAHLLOKOSA-N 0 0 384.436 3.484 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H](C)Oc1ccccc1Cl ZINC000173414487 1426597677 /nfs/dbraw/zinc/59/76/77/1426597677.db2.gz BETDJLFVZXQMPP-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1ccccc1O[C@H](C)CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000173415230 1426598268 /nfs/dbraw/zinc/59/82/68/1426598268.db2.gz VHRKFMKOGMUMMV-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)n1 ZINC000173415216 1426598379 /nfs/dbraw/zinc/59/83/79/1426598379.db2.gz RJYIWKPMVZBWNL-MRXNPFEDSA-N 0 0 383.433 3.427 20 5 GGBDRN Cc1ccccc1O[C@H](C)CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000173415335 1426598558 /nfs/dbraw/zinc/59/85/58/1426598558.db2.gz AZGNAXKKEKPHBE-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1ccccc1O[C@@H](C)CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000173415138 1426598859 /nfs/dbraw/zinc/59/88/59/1426598859.db2.gz VHRKFMKOGMUMMV-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C2CC2)n1 ZINC000173422820 1426604291 /nfs/dbraw/zinc/60/42/91/1426604291.db2.gz VXPSSFWFMJMLGP-MRXNPFEDSA-N 0 0 383.433 3.427 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C2CC2)n1 ZINC000173422834 1426604392 /nfs/dbraw/zinc/60/43/92/1426604392.db2.gz VXPSSFWFMJMLGP-INIZCTEOSA-N 0 0 383.433 3.427 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000173423637 1426605416 /nfs/dbraw/zinc/60/54/16/1426605416.db2.gz DKCVVMOUGBSOEG-ACJLOTCBSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1 ZINC000173425546 1426608154 /nfs/dbraw/zinc/60/81/54/1426608154.db2.gz JLVDWCCDOJFCBL-SJCJKPOMSA-N 0 0 394.424 3.193 20 5 GGBDRN O=C(NCc1cccnc1-n1cccn1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173433242 1426614030 /nfs/dbraw/zinc/61/40/30/1426614030.db2.gz WOELZIWPUWSVKF-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN CC(C)c1nn(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(=S)n1C ZINC000173434807 1426616080 /nfs/dbraw/zinc/61/60/80/1426616080.db2.gz JESMDGIIXQRDQB-UHFFFAOYSA-N 0 0 391.497 3.484 20 5 GGBDRN Cc1nn(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(=O)c2ccccc12 ZINC000173435686 1426617653 /nfs/dbraw/zinc/61/76/53/1426617653.db2.gz HOGKNYLEKUFYSZ-UHFFFAOYSA-N 0 0 394.431 3.114 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc1[N+](=O)[O-] ZINC000173436530 1426617666 /nfs/dbraw/zinc/61/76/66/1426617666.db2.gz FXJZHVFGRVMCFX-UHFFFAOYSA-N 0 0 376.434 3.263 20 5 GGBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Oc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000736204564 1426627317 /nfs/dbraw/zinc/62/73/17/1426627317.db2.gz RSCNIKAABRWNBZ-AWEZNQCLSA-N 0 0 394.435 3.379 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173451379 1426628976 /nfs/dbraw/zinc/62/89/76/1426628976.db2.gz LQTWEQRITMCPLO-GFCCVEGCSA-N 0 0 381.396 3.151 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173451366 1426629373 /nfs/dbraw/zinc/62/93/73/1426629373.db2.gz LQTWEQRITMCPLO-LBPRGKRZSA-N 0 0 381.396 3.151 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000173457281 1426632892 /nfs/dbraw/zinc/63/28/92/1426632892.db2.gz YSBNQDMGUGUQTL-HNAYVOBHSA-N 0 0 386.452 3.477 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000173462232 1426635810 /nfs/dbraw/zinc/63/58/10/1426635810.db2.gz QONJMKULPXVKRL-INIZCTEOSA-N 0 0 383.452 3.040 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3cc(Cl)c4c(c3)OCCO4)C2)nc1 ZINC000173462496 1426637098 /nfs/dbraw/zinc/63/70/98/1426637098.db2.gz UTHVKAZTLNENIY-ZDUSSCGKSA-N 0 0 390.827 3.101 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173464197 1426638685 /nfs/dbraw/zinc/63/86/85/1426638685.db2.gz MOWMTAYJMMIMCK-AWEZNQCLSA-N 0 0 389.843 3.077 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(c3ncnc4ccsc43)CC2)cc1[N+](=O)[O-] ZINC000173466799 1426642116 /nfs/dbraw/zinc/64/21/16/1426642116.db2.gz ASBPHJAEVKDJDL-UHFFFAOYSA-N 0 0 397.460 3.124 20 5 GGBDRN CCOc1ccc(C(C)=O)cc1CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173470414 1426645202 /nfs/dbraw/zinc/64/52/02/1426645202.db2.gz KRKDCDXMOICCIZ-QGZVFWFLSA-N 0 0 384.436 3.278 20 5 GGBDRN CC[C@@]1(C)CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000173487972 1426660799 /nfs/dbraw/zinc/66/07/99/1426660799.db2.gz RJEBAJIYOLRKBG-UGSOOPFHSA-N 0 0 379.482 3.300 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1CCCO[C@H]1c1ccc(C)cc1 ZINC000173494853 1426666211 /nfs/dbraw/zinc/66/62/11/1426666211.db2.gz VNNOMIPENPVXMI-PXNSSMCTSA-N 0 0 386.452 3.082 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1CCCO[C@@H]1c1ccc(C)cc1 ZINC000173494844 1426666284 /nfs/dbraw/zinc/66/62/84/1426666284.db2.gz VNNOMIPENPVXMI-FXAWDEMLSA-N 0 0 386.452 3.082 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1CCCO[C@H]1c1ccc(C)cc1 ZINC000173494883 1426666483 /nfs/dbraw/zinc/66/64/83/1426666483.db2.gz VNNOMIPENPVXMI-XLIONFOSSA-N 0 0 386.452 3.082 20 5 GGBDRN CCc1ccc(C(=O)N(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000173496569 1426667059 /nfs/dbraw/zinc/66/70/59/1426667059.db2.gz XYNNKWJPUBOZJZ-OAHLLOKOSA-N 0 0 377.441 3.239 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1)c1ccccc1[N+](=O)[O-] ZINC000173499678 1426669095 /nfs/dbraw/zinc/66/90/95/1426669095.db2.gz QCIDGIJOWVJLOL-SANMLTNESA-N 0 0 395.868 3.202 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@@](C)(CC)c2nccs2)c([N+](=O)[O-])c1 ZINC000173506046 1426674433 /nfs/dbraw/zinc/67/44/33/1426674433.db2.gz YFEIIQGBXYKRAO-KRWDZBQOSA-N 0 0 378.454 3.304 20 5 GGBDRN CN(CCCNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC(F)(F)F ZINC000173506395 1426675294 /nfs/dbraw/zinc/67/52/94/1426675294.db2.gz ZCQFNPRVZVNWQT-UHFFFAOYSA-N 0 0 387.280 3.228 20 5 GGBDRN C[C@@H](CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Sc1ccccc1 ZINC000173507184 1426676176 /nfs/dbraw/zinc/67/61/76/1426676176.db2.gz VXXNRBWDNAWYHV-NSHDSACASA-N 0 0 393.852 3.484 20 5 GGBDRN C[C@@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Sc1ccccc1 ZINC000173507281 1426676889 /nfs/dbraw/zinc/67/68/89/1426676889.db2.gz SJMDPYFTTHSDBD-NSHDSACASA-N 0 0 393.852 3.484 20 5 GGBDRN CC(C)Nc1ccc(F)cc1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173509906 1426679170 /nfs/dbraw/zinc/67/91/70/1426679170.db2.gz VACAIUNPUQIGBI-UHFFFAOYSA-N 0 0 384.371 3.387 20 5 GGBDRN CC(C)Nc1ccc(F)cc1NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000173511247 1426681067 /nfs/dbraw/zinc/68/10/67/1426681067.db2.gz YSAPORKAYYSWCD-GFCCVEGCSA-N 0 0 388.399 3.311 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccc(F)cc2O1 ZINC000173523739 1426697861 /nfs/dbraw/zinc/69/78/61/1426697861.db2.gz QVKHFOOQLVBYQU-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)Oc3cc(F)ccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000173527020 1426700414 /nfs/dbraw/zinc/70/04/14/1426700414.db2.gz SALCXTWMJSHEJC-VIFPVBQESA-N 0 0 375.312 3.378 20 5 GGBDRN CCCC(=O)Nc1ccc(CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000173530045 1426704028 /nfs/dbraw/zinc/70/40/28/1426704028.db2.gz ZXMUDEMXZKWPIE-UHFFFAOYSA-N 0 0 384.436 3.086 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)c1 ZINC000173534538 1426710773 /nfs/dbraw/zinc/71/07/73/1426710773.db2.gz JLBPOAKTQGKPJD-MRXNPFEDSA-N 0 0 383.448 3.431 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCCN(C)c2ccc(Cl)cc21 ZINC000173547859 1426721217 /nfs/dbraw/zinc/72/12/17/1426721217.db2.gz GPDJDCILIIVHOC-UHFFFAOYSA-N 0 0 377.832 3.016 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000173551132 1426723921 /nfs/dbraw/zinc/72/39/21/1426723921.db2.gz OOKDIZROHAYYBR-MRXNPFEDSA-N 0 0 390.461 3.092 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000173551114 1426723981 /nfs/dbraw/zinc/72/39/81/1426723981.db2.gz OOKDIZROHAYYBR-INIZCTEOSA-N 0 0 390.461 3.092 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173552687 1426726119 /nfs/dbraw/zinc/72/61/19/1426726119.db2.gz UKXDSYCSHPIPSO-QGZVFWFLSA-N 0 0 379.420 3.269 20 5 GGBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000173556489 1426728489 /nfs/dbraw/zinc/72/84/89/1426728489.db2.gz FPMBOWGQTQWZRX-OAHLLOKOSA-N 0 0 398.463 3.332 20 5 GGBDRN CCCOc1ccc(CCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000173559773 1426730453 /nfs/dbraw/zinc/73/04/53/1426730453.db2.gz AMIMBSDHKNLHKN-QGZVFWFLSA-N 0 0 398.463 3.424 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@H](CSc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000173564053 1426733046 /nfs/dbraw/zinc/73/30/46/1426733046.db2.gz ZYKMNAFTDFOIFG-HNNXBMFYSA-N 0 0 399.472 3.483 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@@H](CSc2ccccc2)C1 ZINC000173565237 1426733774 /nfs/dbraw/zinc/73/37/74/1426733774.db2.gz DOCBLSCSDAVRSC-OAHLLOKOSA-N 0 0 399.472 3.483 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@H](CSc2ccccc2)C1 ZINC000173565224 1426733814 /nfs/dbraw/zinc/73/38/14/1426733814.db2.gz DOCBLSCSDAVRSC-HNNXBMFYSA-N 0 0 399.472 3.483 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000173570025 1426737551 /nfs/dbraw/zinc/73/75/51/1426737551.db2.gz ACORFMBCTYVIED-FQEVSTJZSA-N 0 0 389.452 3.334 20 5 GGBDRN COc1cc(CCNC(=O)N2CCC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000173572584 1426739040 /nfs/dbraw/zinc/73/90/40/1426739040.db2.gz HCKXFKOJGRWLFZ-DZGCQCFKSA-N 0 0 377.441 3.129 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000173572695 1426739519 /nfs/dbraw/zinc/73/95/19/1426739519.db2.gz QKULVOGFQNFFCK-UONOGXRCSA-N 0 0 379.457 3.375 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000173575472 1426743075 /nfs/dbraw/zinc/74/30/75/1426743075.db2.gz YXWIPJVKFKPSLG-INIZCTEOSA-N 0 0 390.461 3.092 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(N2CCCS2(=O)=O)cc1 ZINC000173578112 1426743668 /nfs/dbraw/zinc/74/36/68/1426743668.db2.gz UEZPPWISKFUHBU-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN CCC(CC)(CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1ccccc1 ZINC000173584011 1426747593 /nfs/dbraw/zinc/74/75/93/1426747593.db2.gz NJFALMZZXPTCBY-UHFFFAOYSA-N 0 0 399.447 3.416 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])[C@H](C)CO1 ZINC000173593275 1426756634 /nfs/dbraw/zinc/75/66/34/1426756634.db2.gz LZSRXBNBOCTYKJ-CRAIPNDOSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H](C)CO1 ZINC000173592563 1426757052 /nfs/dbraw/zinc/75/70/52/1426757052.db2.gz QZMGABUTNZCSLH-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000173594255 1426758743 /nfs/dbraw/zinc/75/87/43/1426758743.db2.gz CJYPIRNBNJECHA-DNVCBOLYSA-N 0 0 390.461 3.195 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2cccc([N+](=O)[O-])c2C)[C@H](C)CO1 ZINC000173594326 1426758903 /nfs/dbraw/zinc/75/89/03/1426758903.db2.gz JZIADPJHRZDSSC-KDOFPFPSSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1nn(CCC(=O)N2C[C@H](C)Oc3ccc(Cl)cc32)c(C)c1[N+](=O)[O-] ZINC000173607115 1426782160 /nfs/dbraw/zinc/78/21/60/1426782160.db2.gz UNIHFFDJSYEOLR-JTQLQIEISA-N 0 0 378.816 3.266 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C2CC2)s1 ZINC000173609199 1426784525 /nfs/dbraw/zinc/78/45/25/1426784525.db2.gz BJAXKOIDSNNXQX-AWEZNQCLSA-N 0 0 376.394 3.457 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c2cc(Cl)ccc2O1 ZINC000173611007 1426786876 /nfs/dbraw/zinc/78/68/76/1426786876.db2.gz VJKNPDUSKLBNTL-LLVKDONJSA-N 0 0 399.794 3.257 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@H](C)Oc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000173617959 1426799064 /nfs/dbraw/zinc/79/90/64/1426799064.db2.gz BHKYLUDCIQHESY-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000173619588 1426800520 /nfs/dbraw/zinc/80/05/20/1426800520.db2.gz LCQLLMLADFOEHR-ZDUSSCGKSA-N 0 0 375.425 3.274 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccn(CCc2ccncc2)n1 ZINC000173620715 1426800538 /nfs/dbraw/zinc/80/05/38/1426800538.db2.gz RWPYURFMPHFWHY-UHFFFAOYSA-N 0 0 380.408 3.093 20 5 GGBDRN C[C@H](NC(=O)CN(CC1CC1)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173625626 1426801781 /nfs/dbraw/zinc/80/17/81/1426801781.db2.gz SJLLQYXKYIVXRO-ZDUSSCGKSA-N 0 0 377.441 3.419 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C2CC2)s1 ZINC000173626000 1426802042 /nfs/dbraw/zinc/80/20/42/1426802042.db2.gz YEBQSFFJTHXGOU-INIZCTEOSA-N 0 0 383.433 3.427 20 5 GGBDRN O=C(c1ccc(N2CCCC2)nc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173635107 1426804471 /nfs/dbraw/zinc/80/44/71/1426804471.db2.gz XBXYERZMFPVRLZ-UHFFFAOYSA-N 0 0 396.447 3.274 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1[N+](=O)[O-] ZINC000173636198 1426804742 /nfs/dbraw/zinc/80/47/42/1426804742.db2.gz SDNKQXLNCLDZAV-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN Cc1noc2ncc(C(=O)N3CCC(Oc4ccc([N+](=O)[O-])cc4)CC3)cc12 ZINC000173636706 1426805066 /nfs/dbraw/zinc/80/50/66/1426805066.db2.gz RYFKOTZFTLNZLS-UHFFFAOYSA-N 0 0 382.376 3.123 20 5 GGBDRN COc1cc(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000173637441 1426805583 /nfs/dbraw/zinc/80/55/83/1426805583.db2.gz XWPWIRXHUAHVEY-QGZVFWFLSA-N 0 0 397.431 3.028 20 5 GGBDRN O=C(c1cccc(-n2ccnc2)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173639693 1426806221 /nfs/dbraw/zinc/80/62/21/1426806221.db2.gz IKMYDMXVCUYXEF-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN O=C([C@@H]1CC(=O)Nc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173642117 1426807402 /nfs/dbraw/zinc/80/74/02/1426807402.db2.gz UESPMLHQPMHOMU-GOSISDBHSA-N 0 0 395.415 3.091 20 5 GGBDRN O=C(c1ccc2c(c1)CCC(=O)N2)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173645816 1426808846 /nfs/dbraw/zinc/80/88/46/1426808846.db2.gz IABXNXROVJUHOR-UHFFFAOYSA-N 0 0 395.415 3.163 20 5 GGBDRN O=C(Cc1[nH]nc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173646539 1426808991 /nfs/dbraw/zinc/80/89/91/1426808991.db2.gz NLQAOOCJGDICRC-UHFFFAOYSA-N 0 0 380.404 3.084 20 5 GGBDRN C[C@H]1CN(c2ccccc2NC(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000173648024 1426809472 /nfs/dbraw/zinc/80/94/72/1426809472.db2.gz WVLOFLGUARIGSM-HOTGVXAUSA-N 0 0 398.463 3.283 20 5 GGBDRN C[C@@H]1CN(c2ccccc2NC(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000173648012 1426809516 /nfs/dbraw/zinc/80/95/16/1426809516.db2.gz WVLOFLGUARIGSM-IYBDPMFKSA-N 0 0 398.463 3.283 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H](COCc2ccccc2)C1 ZINC000173649996 1426810174 /nfs/dbraw/zinc/81/01/74/1426810174.db2.gz KQKMUIZLVIKMLZ-AEFFLSMTSA-N 0 0 383.448 3.461 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@@H](c2ccccc2)CO1 ZINC000173673797 1426816985 /nfs/dbraw/zinc/81/69/85/1426816985.db2.gz DAIUGCHYXIWCCY-MGPUTAFESA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@H](c2ccccc2)CO1 ZINC000173673767 1426817024 /nfs/dbraw/zinc/81/70/24/1426817024.db2.gz DAIUGCHYXIWCCY-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@H](c2ccccc2C)C(C)C)cc1[N+](=O)[O-] ZINC000173678560 1426818597 /nfs/dbraw/zinc/81/85/97/1426818597.db2.gz WDCHUFQXDCWPIQ-FQEVSTJZSA-N 0 0 399.447 3.155 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000173679895 1426819299 /nfs/dbraw/zinc/81/92/99/1426819299.db2.gz MYWRGHUWSMVHJG-CQSZACIVSA-N 0 0 389.481 3.005 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C3N=NC(=S)N3C3CC3)C2)c1 ZINC000173679935 1426819421 /nfs/dbraw/zinc/81/94/21/1426819421.db2.gz MWYOEOIHQLJFSN-GFCCVEGCSA-N 0 0 387.465 3.138 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CC[C@@H](COCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000173692591 1426822729 /nfs/dbraw/zinc/82/27/29/1426822729.db2.gz UGMYGWUTGJTTJZ-QGZVFWFLSA-N 0 0 390.461 3.131 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3nc(CCc4ccccc4)no3)n2)c1 ZINC000173692259 1426822860 /nfs/dbraw/zinc/82/28/60/1426822860.db2.gz LSXFQJQTPARGOD-UHFFFAOYSA-N 0 0 376.376 3.070 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@@H](COCc2ccccc2)C1 ZINC000173694832 1426823458 /nfs/dbraw/zinc/82/34/58/1426823458.db2.gz MUACLTIBEVAXLC-QGZVFWFLSA-N 0 0 390.461 3.131 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CC[C@@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000173696954 1426823892 /nfs/dbraw/zinc/82/38/92/1426823892.db2.gz HCLSVDBSJKUINZ-QGZVFWFLSA-N 0 0 390.461 3.131 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](COCc2ccccc2)C1 ZINC000173695927 1426823970 /nfs/dbraw/zinc/82/39/70/1426823970.db2.gz DYYNXEHNMRTQSS-QGZVFWFLSA-N 0 0 390.461 3.131 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)Oc2cccc3c2CCCC3=O)cc1C ZINC000173716444 1426830215 /nfs/dbraw/zinc/83/02/15/1426830215.db2.gz AWJWOXXVJYFLIF-UHFFFAOYSA-N 0 0 375.402 3.498 20 5 GGBDRN COC[C@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000173732149 1426833831 /nfs/dbraw/zinc/83/38/31/1426833831.db2.gz DHALEUUCUCBQQG-ZDUSSCGKSA-N 0 0 382.800 3.422 20 5 GGBDRN COC[C@H](NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000173735370 1426834866 /nfs/dbraw/zinc/83/48/66/1426834866.db2.gz FAGGYWBHCANCAV-LBPRGKRZSA-N 0 0 383.198 3.376 20 5 GGBDRN COCCOc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1Cl ZINC000173737488 1426835224 /nfs/dbraw/zinc/83/52/24/1426835224.db2.gz GZCAUYRILKHCKQ-UHFFFAOYSA-N 0 0 393.827 3.348 20 5 GGBDRN CN(CC(=O)Nc1ccc(N2CCSCC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000173737201 1426835317 /nfs/dbraw/zinc/83/53/17/1426835317.db2.gz IXIORXAGEKNJCS-UHFFFAOYSA-N 0 0 386.477 3.223 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C12CCCC2 ZINC000173740460 1426835849 /nfs/dbraw/zinc/83/58/49/1426835849.db2.gz ACUFNHPGIMTFDS-LSDHHAIUSA-N 0 0 395.843 3.041 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)Oc1ccc(OCC(F)(F)F)cc1 ZINC000173748469 1426838564 /nfs/dbraw/zinc/83/85/64/1426838564.db2.gz ZYSXIZQTQWZSIP-UHFFFAOYSA-N 0 0 377.296 3.304 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000173748450 1426838656 /nfs/dbraw/zinc/83/86/56/1426838656.db2.gz MULSWAGIFPYZCZ-UHFFFAOYSA-N 0 0 377.296 3.304 20 5 GGBDRN COc1ccccc1C[C@@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000173761570 1426843162 /nfs/dbraw/zinc/84/31/62/1426843162.db2.gz UUPULSWHZITNJU-CQSZACIVSA-N 0 0 378.450 3.164 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)NCCCCC2CCCC2)c([N+](=O)[O-])c1 ZINC000173769438 1426845341 /nfs/dbraw/zinc/84/53/41/1426845341.db2.gz HFSSNVJVZKDTMJ-UHFFFAOYSA-N 0 0 379.482 3.263 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC(C(F)(F)F)CC1 ZINC000173773726 1426847046 /nfs/dbraw/zinc/84/70/46/1426847046.db2.gz YHCABPNMJHYPMP-JTQLQIEISA-N 0 0 375.347 3.205 20 5 GGBDRN CN(CC(=O)N[C@H]1CCOc2c(Cl)cccc21)c1ccccc1[N+](=O)[O-] ZINC000173779821 1426849216 /nfs/dbraw/zinc/84/92/16/1426849216.db2.gz DBACRLXOFVSQTJ-AWEZNQCLSA-N 0 0 375.812 3.324 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](Cc1ccc(F)cc1)C(C)C ZINC000173780852 1426849477 /nfs/dbraw/zinc/84/94/77/1426849477.db2.gz ZCVDBEKESHCYFE-QGZVFWFLSA-N 0 0 387.411 3.364 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000173780589 1426849621 /nfs/dbraw/zinc/84/96/21/1426849621.db2.gz SMGZHYWNWVLZSI-QGZVFWFLSA-N 0 0 387.411 3.364 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H](C)n1nnc(-c2ccccc2)n1 ZINC000173782983 1426850113 /nfs/dbraw/zinc/85/01/13/1426850113.db2.gz SNKJMEHJWFXULO-OAHLLOKOSA-N 0 0 394.435 3.247 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCC(C)(C)SC)c([N+](=O)[O-])c1 ZINC000173785729 1426851089 /nfs/dbraw/zinc/85/10/89/1426851089.db2.gz AZGSFQQDUUHEEG-UHFFFAOYSA-N 0 0 375.516 3.179 20 5 GGBDRN O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)Nc1ccc(F)c(F)c1 ZINC000173797996 1426853875 /nfs/dbraw/zinc/85/38/75/1426853875.db2.gz AUTAWTOKGHCXDO-UHFFFAOYSA-N 0 0 391.374 3.355 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000173801254 1426855162 /nfs/dbraw/zinc/85/51/62/1426855162.db2.gz XAZMMGLPMBARMY-MSOLQXFVSA-N 0 0 397.479 3.308 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1noc(C(C)C)n1 ZINC000173821234 1426860230 /nfs/dbraw/zinc/86/02/30/1426860230.db2.gz STNSRBXIVJMSFN-AWEZNQCLSA-N 0 0 394.453 3.189 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000173826889 1426862011 /nfs/dbraw/zinc/86/20/11/1426862011.db2.gz FGCZIGZCWWZYGD-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](C)c2cccc(-n3cccn3)c2)ccc1[N+](=O)[O-] ZINC000173828849 1426862734 /nfs/dbraw/zinc/86/27/34/1426862734.db2.gz ZHJAWYHMJPTZDB-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173850199 1426870525 /nfs/dbraw/zinc/87/05/25/1426870525.db2.gz UNYQLPUDMYJFKD-INIZCTEOSA-N 0 0 398.444 3.092 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@H](n3cccn3)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000173851534 1426871270 /nfs/dbraw/zinc/87/12/70/1426871270.db2.gz CHSLXPLZYDWMJO-MRXNPFEDSA-N 0 0 398.444 3.092 20 5 GGBDRN CC(C)(C)OC(=O)NCc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2)o1 ZINC000173872022 1426877699 /nfs/dbraw/zinc/87/76/99/1426877699.db2.gz BTOKEGMZHAKDOR-UHFFFAOYSA-N 0 0 375.381 3.143 20 5 GGBDRN Cc1c(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cccc1N1CCNC1=O ZINC000173873245 1426878106 /nfs/dbraw/zinc/87/81/06/1426878106.db2.gz DTGZXLWUDOZAOP-UHFFFAOYSA-N 0 0 396.447 3.186 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@H](C)CC ZINC000173892496 1426883381 /nfs/dbraw/zinc/88/33/81/1426883381.db2.gz MPYHLACYIVYWFP-QVKFZJNVSA-N 0 0 394.471 3.249 20 5 GGBDRN CN(Cc1cc2ccccc2o1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173921467 1426892592 /nfs/dbraw/zinc/89/25/92/1426892592.db2.gz LIZGRIYXNAZLRP-UHFFFAOYSA-N 0 0 377.360 3.194 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccco3)n2-c2ccccc2)c1 ZINC000173922926 1426893076 /nfs/dbraw/zinc/89/30/76/1426893076.db2.gz LBERFGWEXOJYRJ-UHFFFAOYSA-N 0 0 382.405 3.424 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccccc3)n2Cc2ccco2)c1 ZINC000173923127 1426893818 /nfs/dbraw/zinc/89/38/18/1426893818.db2.gz RIUDMPWDIASGCW-UHFFFAOYSA-N 0 0 396.432 3.483 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])c2cc(Cl)ccc2O1 ZINC000173926309 1426894939 /nfs/dbraw/zinc/89/49/39/1426894939.db2.gz CBRRDBSCCMTWLV-VIFPVBQESA-N 0 0 386.788 3.364 20 5 GGBDRN Cc1c(C(=O)Nc2ccc([S@@](C)=O)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000173926197 1426895035 /nfs/dbraw/zinc/89/50/35/1426895035.db2.gz MXJMEKAPBJRYGA-AREMUKBSSA-N 0 0 377.378 3.110 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)CC[C@@H]1c1ccccc1 ZINC000173938215 1426900140 /nfs/dbraw/zinc/90/01/40/1426900140.db2.gz DRFVAGXQMUEVJD-YJBOKZPZSA-N 0 0 391.431 3.441 20 5 GGBDRN COc1ccc2c(c1)N(Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C[C@@H](C)O2 ZINC000173946066 1426904277 /nfs/dbraw/zinc/90/42/77/1426904277.db2.gz UPMVENKUPGAZQZ-GFCCVEGCSA-N 0 0 382.376 3.441 20 5 GGBDRN CC[C@](C)(NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000173950427 1426905502 /nfs/dbraw/zinc/90/55/02/1426905502.db2.gz VDDHEGXDNAVEFN-KRWDZBQOSA-N 0 0 378.454 3.222 20 5 GGBDRN C[C@@H]1CN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000173957367 1426908937 /nfs/dbraw/zinc/90/89/37/1426908937.db2.gz VRRNOWZMEDTKIP-KZULUSFZSA-N 0 0 385.445 3.005 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC1(c2cccc(F)c2)CCOCC1 ZINC000173957160 1426909096 /nfs/dbraw/zinc/90/90/96/1426909096.db2.gz VHZSDOJLYRFAFI-UHFFFAOYSA-N 0 0 394.424 3.027 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@H](O)COc2ccc3ccccc3c2)nc1-c1ccncc1 ZINC000173959211 1426910115 /nfs/dbraw/zinc/91/01/15/1426910115.db2.gz NCPMTNKRHWQPEA-SFHVURJKSA-N 0 0 390.399 3.446 20 5 GGBDRN Cc1cc(F)cc(C(=O)N(C)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000173989580 1426930065 /nfs/dbraw/zinc/93/00/65/1426930065.db2.gz DLDIQHZRKNTOSR-UHFFFAOYSA-N 0 0 386.788 3.157 20 5 GGBDRN Cc1ccc(OC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)c([N+](=O)[O-])c1 ZINC000173994159 1426931600 /nfs/dbraw/zinc/93/16/00/1426931600.db2.gz KAUFRTWOSXFJRX-UHFFFAOYSA-N 0 0 375.768 3.305 20 5 GGBDRN Cc1c(OC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000174003350 1426936517 /nfs/dbraw/zinc/93/65/17/1426936517.db2.gz RREIDRBSHFGROX-UHFFFAOYSA-N 0 0 377.422 3.492 20 5 GGBDRN Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)OCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000174023407 1426950376 /nfs/dbraw/zinc/95/03/76/1426950376.db2.gz DSWUISRNKJEEIX-LJQANCHMSA-N 0 0 382.416 3.180 20 5 GGBDRN Cc1cnc([C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C2CC2)s1 ZINC000174029175 1426954191 /nfs/dbraw/zinc/95/41/91/1426954191.db2.gz MODFROULWIDCMB-MRXNPFEDSA-N 0 0 384.417 3.082 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)cc1[N+](=O)[O-] ZINC000174031534 1426955322 /nfs/dbraw/zinc/95/53/22/1426955322.db2.gz XMPSAMDBKQZRMU-UHFFFAOYSA-N 0 0 394.431 3.278 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@H](C)c1ccc(Br)s1 ZINC000174047814 1426969830 /nfs/dbraw/zinc/96/98/30/1426969830.db2.gz QVBWIFLNIJZFIN-MRVPVSSYSA-N 0 0 388.243 3.271 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc2cc(C(F)(F)F)ccc2n1C ZINC000174048747 1426971102 /nfs/dbraw/zinc/97/11/02/1426971102.db2.gz IWIYFACVVKDEQJ-UHFFFAOYSA-N 0 0 396.325 3.467 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1F ZINC000174054292 1426974786 /nfs/dbraw/zinc/97/47/86/1426974786.db2.gz JCGXVFRKLKUSAG-SANMLTNESA-N 0 0 377.397 3.298 20 5 GGBDRN CCOc1cc(C(=O)N[C@H]2CCCC[C@H]2n2cccn2)c([N+](=O)[O-])cc1OC ZINC000174054817 1426975313 /nfs/dbraw/zinc/97/53/13/1426975313.db2.gz IZJWPJQLYHDNRP-LSDHHAIUSA-N 0 0 388.424 3.112 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(c1ccccc1)C1Cc2ccccc2C1 ZINC000174059210 1426978817 /nfs/dbraw/zinc/97/88/17/1426978817.db2.gz YSYUFAHHSZHCTB-UHFFFAOYSA-N 0 0 376.416 3.300 20 5 GGBDRN CN(CC(=O)OCc1nccn1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000174063736 1426981760 /nfs/dbraw/zinc/98/17/60/1426981760.db2.gz MULZYNWBTIIRGV-UHFFFAOYSA-N 0 0 380.404 3.019 20 5 GGBDRN C[C@@H](NC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000174062626 1426981823 /nfs/dbraw/zinc/98/18/23/1426981823.db2.gz UJZPAFSNXAPJKI-GDBMZVCRSA-N 0 0 388.468 3.136 20 5 GGBDRN COc1ccc(CN2CCc3c(cccc3N3CCOC3=O)C2)cc1[N+](=O)[O-] ZINC000174064504 1426982756 /nfs/dbraw/zinc/98/27/56/1426982756.db2.gz UTIDNISQHROQGQ-UHFFFAOYSA-N 0 0 383.404 3.118 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](C)c1nc(C2CCCCC2)no1 ZINC000174066447 1426983551 /nfs/dbraw/zinc/98/35/51/1426983551.db2.gz WRVHMRCMLBMVNJ-LBPRGKRZSA-N 0 0 394.453 3.373 20 5 GGBDRN CN(CC(=O)OCc1csc(-c2ccccn2)n1)c1ccccc1[N+](=O)[O-] ZINC000174065241 1426983618 /nfs/dbraw/zinc/98/36/18/1426983618.db2.gz FFRPABBSQLULRX-UHFFFAOYSA-N 0 0 384.417 3.293 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)ccc1[N+](=O)[O-] ZINC000174065957 1426983729 /nfs/dbraw/zinc/98/37/29/1426983729.db2.gz UBCWHYGEXSRIHE-LBPRGKRZSA-N 0 0 394.453 3.373 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)c1nc(C2CCCCC2)no1 ZINC000174067137 1426984230 /nfs/dbraw/zinc/98/42/30/1426984230.db2.gz LVZBEZKGBZAGKL-GFCCVEGCSA-N 0 0 394.453 3.373 20 5 GGBDRN Cc1nn([C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)c(C)c1[N+](=O)[O-] ZINC000174070371 1426985916 /nfs/dbraw/zinc/98/59/16/1426985916.db2.gz WDUJDYJUSDEIFC-CQSZACIVSA-N 0 0 380.351 3.378 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3ccc(SC)c([N+](=O)[O-])c3)cc21 ZINC000174072100 1426987256 /nfs/dbraw/zinc/98/72/56/1426987256.db2.gz WENOXYGYUGRTSI-UHFFFAOYSA-N 0 0 398.444 3.270 20 5 GGBDRN CCc1ccc(C(=O)N[C@@H](C)c2ccccc2NS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000174090087 1426995811 /nfs/dbraw/zinc/99/58/11/1426995811.db2.gz KNGYRPCHRSWTPM-LBPRGKRZSA-N 0 0 391.449 3.020 20 5 GGBDRN O=C(Nc1cccc(N2CCCNC2=O)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000174090868 1426996734 /nfs/dbraw/zinc/99/67/34/1426996734.db2.gz APJMYZMLSZADIW-UHFFFAOYSA-N 0 0 395.419 3.341 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)OC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000174092696 1426998584 /nfs/dbraw/zinc/99/85/84/1426998584.db2.gz JRUDCNWXXJLIKZ-RDTXWAMCSA-N 0 0 376.434 3.054 20 5 GGBDRN CN(C)CC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000174103348 1427003263 /nfs/dbraw/zinc/00/32/63/1427003263.db2.gz DSJXWGOQSQXJLC-UHFFFAOYSA-N 0 0 376.800 3.001 20 5 GGBDRN C[C@@H](NC(=O)N1CCn2c(nnc2-c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000174104697 1427004165 /nfs/dbraw/zinc/00/41/65/1427004165.db2.gz MQSHWZAZAFBQSW-CQSZACIVSA-N 0 0 392.419 3.140 20 5 GGBDRN Cc1ncccc1NC(=O)c1ccc(I)c([N+](=O)[O-])c1 ZINC000174106753 1427004951 /nfs/dbraw/zinc/00/49/51/1427004951.db2.gz KSBSWDGQFMVZKF-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN O=C(OCc1cc(=O)n2ccsc2n1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000174111543 1427006739 /nfs/dbraw/zinc/00/67/39/1427006739.db2.gz MEDBJNWGHWQPLR-UHFFFAOYSA-N 0 0 399.306 3.040 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000174117252 1427009181 /nfs/dbraw/zinc/00/91/81/1427009181.db2.gz HXGWLCINRVMXKR-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000174124128 1427011426 /nfs/dbraw/zinc/01/14/26/1427011426.db2.gz KCFRPQHRSFAPCY-UHFFFAOYSA-N 0 0 390.343 3.443 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000174123218 1427011878 /nfs/dbraw/zinc/01/18/78/1427011878.db2.gz VYDZQKJIQVARDA-UHFFFAOYSA-N 0 0 399.447 3.468 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000174131041 1427015043 /nfs/dbraw/zinc/01/50/43/1427015043.db2.gz HDZPFQOQAXVOBV-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN CCOc1ccccc1OCCn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000174135027 1427017377 /nfs/dbraw/zinc/01/73/77/1427017377.db2.gz KOBDCXFFKQFVGF-UHFFFAOYSA-N 0 0 381.388 3.296 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)C1 ZINC000174150988 1427022823 /nfs/dbraw/zinc/02/28/23/1427022823.db2.gz PHXRTYAERHIEBP-WMLDXEAASA-N 0 0 375.469 3.314 20 5 GGBDRN CCc1ccc(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)cc1[N+](=O)[O-] ZINC000174160136 1427025733 /nfs/dbraw/zinc/02/57/33/1427025733.db2.gz SYYBBVUKLDLJAP-HNNXBMFYSA-N 0 0 383.448 3.422 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c1[N+](=O)[O-] ZINC000174160676 1427026873 /nfs/dbraw/zinc/02/68/73/1427026873.db2.gz USJDRKSPAQKQFI-UHFFFAOYSA-N 0 0 394.391 3.170 20 5 GGBDRN CSC1(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCOCC1 ZINC000174161309 1427027128 /nfs/dbraw/zinc/02/71/28/1427027128.db2.gz GLGAGNAFEQZJHO-UHFFFAOYSA-N 0 0 393.490 3.360 20 5 GGBDRN COC(C)(C)CNC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC000174163884 1427028330 /nfs/dbraw/zinc/02/83/30/1427028330.db2.gz ZMSMYLFCUYOJJN-UHFFFAOYSA-N 0 0 399.447 3.047 20 5 GGBDRN CCc1ccc(C(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000174162303 1427028337 /nfs/dbraw/zinc/02/83/37/1427028337.db2.gz SWQXBNBXGPTLID-CYBMUJFWSA-N 0 0 377.441 3.144 20 5 GGBDRN CSC1(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CCOCC1 ZINC000174171490 1427032118 /nfs/dbraw/zinc/03/21/18/1427032118.db2.gz KCOUJHAWWWSYMS-UHFFFAOYSA-N 0 0 393.509 3.227 20 5 GGBDRN CCN(CC)C(=O)c1ccc(OCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000174175668 1427033478 /nfs/dbraw/zinc/03/34/78/1427033478.db2.gz KLYBYLPTBKRBFK-UHFFFAOYSA-N 0 0 397.431 3.045 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(N2CCCNC2=O)c1 ZINC000174182593 1427036609 /nfs/dbraw/zinc/03/66/09/1427036609.db2.gz SZQFRHVYLBRACY-UHFFFAOYSA-N 0 0 383.408 3.178 20 5 GGBDRN C[C@H]1CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2NC1=O ZINC000174184258 1427037268 /nfs/dbraw/zinc/03/72/68/1427037268.db2.gz INTSKSVGPZOBLI-NSHDSACASA-N 0 0 388.811 3.282 20 5 GGBDRN C[C@@H]1CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2NC1=O ZINC000174186652 1427039271 /nfs/dbraw/zinc/03/92/71/1427039271.db2.gz FFTUXJYKUWLMHN-GFCCVEGCSA-N 0 0 379.376 3.240 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000174196871 1427044880 /nfs/dbraw/zinc/04/48/80/1427044880.db2.gz MUSCLYPMSHTHAT-UHFFFAOYSA-N 0 0 388.371 3.454 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@H](C3N=NC(=S)N3CC)C2)cc1[N+](=O)[O-] ZINC000174197167 1427045566 /nfs/dbraw/zinc/04/55/66/1427045566.db2.gz NMOOJJPKDDKPIV-AWEZNQCLSA-N 0 0 389.481 3.077 20 5 GGBDRN CCc1ccc(C(=O)NCCCC(=O)N2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000174222026 1427057067 /nfs/dbraw/zinc/05/70/67/1427057067.db2.gz WGTJAIBSDGEGSM-UHFFFAOYSA-N 0 0 381.432 3.210 20 5 GGBDRN C[C@@H]1CN(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000174231323 1427061338 /nfs/dbraw/zinc/06/13/38/1427061338.db2.gz YBKCSSMTHGEHIP-CRAIPNDOSA-N 0 0 382.416 3.438 20 5 GGBDRN C[C@H]1CCC[C@H](C)N1C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242311 1427065451 /nfs/dbraw/zinc/06/54/51/1427065451.db2.gz LWKVWXVEUKNWGF-HOTGVXAUSA-N 0 0 375.469 3.228 20 5 GGBDRN C[C@H](C(=O)NCc1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174245702 1427067816 /nfs/dbraw/zinc/06/78/16/1427067816.db2.gz PWMRWQHSCVBNAQ-MRXNPFEDSA-N 0 0 383.448 3.143 20 5 GGBDRN C[C@@H](NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000174248198 1427068850 /nfs/dbraw/zinc/06/88/50/1427068850.db2.gz XTLIPYUWMWPBKZ-MRXNPFEDSA-N 0 0 383.448 3.315 20 5 GGBDRN C[C@H]1CCCC[C@H]1NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174249389 1427069578 /nfs/dbraw/zinc/06/95/78/1427069578.db2.gz CZWRKPRWIIVOQE-HNAYVOBHSA-N 0 0 375.469 3.133 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000174293016 1427088133 /nfs/dbraw/zinc/08/81/33/1427088133.db2.gz HCAULHQKECZBLG-AYOQOUSVSA-N 0 0 385.464 3.299 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000174300913 1427092197 /nfs/dbraw/zinc/09/21/97/1427092197.db2.gz VDWKLUHKRQQOTC-GXTWGEPZSA-N 0 0 387.465 3.279 20 5 GGBDRN C[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)Oc1ccccc1F ZINC000174309647 1427095592 /nfs/dbraw/zinc/09/55/92/1427095592.db2.gz UJQLXLBQFGGRPQ-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN C[C@@H](CCOc1ccccc1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000174321860 1427101273 /nfs/dbraw/zinc/10/12/73/1427101273.db2.gz SDLDXIRWSYIERD-JKSUJKDBSA-N 0 0 384.436 3.108 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](C)Oc2ccccc2F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000174323208 1427101906 /nfs/dbraw/zinc/10/19/06/1427101906.db2.gz NRQNYPIHHQQJRR-SNVBAGLBSA-N 0 0 377.328 3.148 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)c2cc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000174332500 1427105432 /nfs/dbraw/zinc/10/54/32/1427105432.db2.gz DCRFVPJMOUYKPP-UHFFFAOYSA-N 0 0 385.401 3.177 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](C)Oc2ccccc2F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000174334688 1427106728 /nfs/dbraw/zinc/10/67/28/1427106728.db2.gz ITWIZESLMOLISV-SNVBAGLBSA-N 0 0 391.355 3.456 20 5 GGBDRN C[S@@](=O)C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000174334722 1427106919 /nfs/dbraw/zinc/10/69/19/1427106919.db2.gz GVWTYDCAMIEMJF-CBZJRKILSA-N 0 0 387.461 3.019 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000174343273 1427111476 /nfs/dbraw/zinc/11/14/76/1427111476.db2.gz OQZATGYZPURHPU-DOTOQJQBSA-N 0 0 391.468 3.337 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000174343290 1427111496 /nfs/dbraw/zinc/11/14/96/1427111496.db2.gz OQZATGYZPURHPU-NVXWUHKLSA-N 0 0 391.468 3.337 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000174348500 1427113949 /nfs/dbraw/zinc/11/39/49/1427113949.db2.gz CRQJYPVSAFEWHK-ZFWWWQNUSA-N 0 0 377.441 3.408 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000174357074 1427117990 /nfs/dbraw/zinc/11/79/90/1427117990.db2.gz KPNMAAOTPSAXMF-NSHDSACASA-N 0 0 390.831 3.197 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCc1ccn(-c2ccc(F)cc2)n1 ZINC000174357263 1427118028 /nfs/dbraw/zinc/11/80/28/1427118028.db2.gz ORDRQSHNIJZEAA-XCVCLJGOSA-N 0 0 380.379 3.292 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000174357088 1427118150 /nfs/dbraw/zinc/11/81/50/1427118150.db2.gz KPNMAAOTPSAXMF-LLVKDONJSA-N 0 0 390.831 3.197 20 5 GGBDRN COC(=O)C[C@H](C)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000174362115 1427120006 /nfs/dbraw/zinc/12/00/06/1427120006.db2.gz GHWIAGVJLKDGKQ-INIZCTEOSA-N 0 0 391.471 3.097 20 5 GGBDRN O=C(OC[C@@H]1CCN(c2ccccc2)C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000174383159 1427130777 /nfs/dbraw/zinc/13/07/77/1427130777.db2.gz NNIJOVHYNQEPOX-MRXNPFEDSA-N 0 0 392.415 3.464 20 5 GGBDRN Cc1nnc(-c2cccc(NC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)c2)o1 ZINC000174383675 1427130931 /nfs/dbraw/zinc/13/09/31/1427130931.db2.gz LNNSXWSVJHUOMO-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN O=C(OC[C@@H]1CCN(c2ccccc2)C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174386074 1427132054 /nfs/dbraw/zinc/13/20/54/1427132054.db2.gz RONXBHWGXBEHQS-MRXNPFEDSA-N 0 0 392.415 3.464 20 5 GGBDRN O=C(OC[C@H]1CCN(c2ccccc2)C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174386056 1427132136 /nfs/dbraw/zinc/13/21/36/1427132136.db2.gz RONXBHWGXBEHQS-INIZCTEOSA-N 0 0 392.415 3.464 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(-c3ccc(OC)cc3)cc2)c1[N+](=O)[O-] ZINC000174389297 1427133495 /nfs/dbraw/zinc/13/34/95/1427133495.db2.gz VZKKGEANKYHPBZ-UHFFFAOYSA-N 0 0 380.404 3.486 20 5 GGBDRN Cc1ccccc1[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000174397868 1427138212 /nfs/dbraw/zinc/13/82/12/1427138212.db2.gz DJSKPKYTCGBZRU-SCLBCKFNSA-N 0 0 385.376 3.414 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000174397863 1427138457 /nfs/dbraw/zinc/13/84/57/1427138457.db2.gz DJSKPKYTCGBZRU-UGSOOPFHSA-N 0 0 385.376 3.414 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1CC(F)(F)F ZINC000174402198 1427141025 /nfs/dbraw/zinc/14/10/25/1427141025.db2.gz DTNDKLTVDXGMTM-NSHDSACASA-N 0 0 395.337 3.457 20 5 GGBDRN C[C@@H]1CN=C(N2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)S1 ZINC000174407473 1427144661 /nfs/dbraw/zinc/14/46/61/1427144661.db2.gz XKHUYXYRAZGJBP-LLVKDONJSA-N 0 0 390.490 3.059 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C1 ZINC000174419765 1427149477 /nfs/dbraw/zinc/14/94/77/1427149477.db2.gz LNIKIYIRDVUILQ-CJNGLKHVSA-N 0 0 389.481 3.230 20 5 GGBDRN CCc1nsc(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000174464169 1427168914 /nfs/dbraw/zinc/16/89/14/1427168914.db2.gz QZMAZAXHIXIOEP-UHFFFAOYSA-N 0 0 396.860 3.016 20 5 GGBDRN COc1cccc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000174465661 1427169471 /nfs/dbraw/zinc/16/94/71/1427169471.db2.gz MHGJPGJNKGBVJZ-UHFFFAOYSA-N 0 0 385.420 3.356 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CCC(C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000174491091 1427179348 /nfs/dbraw/zinc/17/93/48/1427179348.db2.gz DAWNNXCLWGGGCV-IBGZPJMESA-N 0 0 387.480 3.402 20 5 GGBDRN CO[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000174495199 1427181907 /nfs/dbraw/zinc/18/19/07/1427181907.db2.gz UMXOKDZCMSSXIY-SFHVURJKSA-N 0 0 384.367 3.037 20 5 GGBDRN C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000174496768 1427182705 /nfs/dbraw/zinc/18/27/05/1427182705.db2.gz ZHRCKSIVJYYKTF-UGSOOPFHSA-N 0 0 385.395 3.073 20 5 GGBDRN CO[C@@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000174503792 1427188489 /nfs/dbraw/zinc/18/84/89/1427188489.db2.gz XKKRDUMOQXVHMV-IBGZPJMESA-N 0 0 387.411 3.452 20 5 GGBDRN O=C(NCCc1nc2cc(F)ccc2[nH]1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000174504902 1427189588 /nfs/dbraw/zinc/18/95/88/1427189588.db2.gz FFBVWFJSDUVGQF-UHFFFAOYSA-N 0 0 397.410 3.183 20 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O=C(NCCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1cccc(O)c1 ZINC000174722187 1427331603 /nfs/dbraw/zinc/33/16/03/1427331603.db2.gz YLRKMRBGWOOGDA-UHFFFAOYSA-N 0 0 381.335 3.134 20 5 GGBDRN CN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174725379 1427332958 /nfs/dbraw/zinc/33/29/58/1427332958.db2.gz MJXROQXXOMPLLK-LBPRGKRZSA-N 0 0 383.832 3.330 20 5 GGBDRN CN1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2cc(F)ccc21 ZINC000174730503 1427336221 /nfs/dbraw/zinc/33/62/21/1427336221.db2.gz LYWWOUITRJLQPO-UHFFFAOYSA-N 0 0 398.438 3.433 20 5 GGBDRN CN1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2cc(F)ccc21 ZINC000174731732 1427336680 /nfs/dbraw/zinc/33/66/80/1427336680.db2.gz YNPBJCNRFQCAHT-UHFFFAOYSA-N 0 0 381.367 3.016 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC000174748087 1427346513 /nfs/dbraw/zinc/34/65/13/1427346513.db2.gz HWQLNORXOMLPTC-GFCCVEGCSA-N 0 0 381.348 3.180 20 5 GGBDRN 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ZINC000175109680 1427551543 /nfs/dbraw/zinc/55/15/43/1427551543.db2.gz TVAANKZHCDXGMD-UHFFFAOYSA-N 0 0 377.485 3.464 20 5 GGBDRN CC1(C)CCC(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000175111300 1427552008 /nfs/dbraw/zinc/55/20/08/1427552008.db2.gz MSEKFSSXMFOYHB-UHFFFAOYSA-N 0 0 385.367 3.220 20 5 GGBDRN Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1[N+](=O)[O-] ZINC000175115031 1427553735 /nfs/dbraw/zinc/55/37/35/1427553735.db2.gz QMJPOQFWZGDLBG-GFCCVEGCSA-N 0 0 388.401 3.049 20 5 GGBDRN COCc1cc([N+](=O)[O-])ccc1NCCCCN1C(=O)c2ccccc2C1=O ZINC000175115005 1427553931 /nfs/dbraw/zinc/55/39/31/1427553931.db2.gz TULPRPZBFSSPAD-UHFFFAOYSA-N 0 0 383.404 3.230 20 5 GGBDRN CC(=O)Nc1cc(S(=O)(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1F ZINC000175116438 1427554464 /nfs/dbraw/zinc/55/44/64/1427554464.db2.gz PZGXZYSZQFODNW-NSHDSACASA-N 0 0 395.412 3.040 20 5 GGBDRN CC(=O)Nc1cc(S(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1F ZINC000175116420 1427554674 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3.357 20 5 GGBDRN COc1ccc(CN2CCCC[C@@H]2CNC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000175166062 1427577559 /nfs/dbraw/zinc/57/75/59/1427577559.db2.gz AGRHIMBJLZHOBL-GOSISDBHSA-N 0 0 383.448 3.388 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCCN(Cc2cscn2)CC1 ZINC000175167063 1427578196 /nfs/dbraw/zinc/57/81/96/1427578196.db2.gz WCXVJQVKRVZFHS-UHFFFAOYSA-N 0 0 376.482 3.158 20 5 GGBDRN C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000175172195 1427581366 /nfs/dbraw/zinc/58/13/66/1427581366.db2.gz QNCGWJFBAOPKOI-NSHDSACASA-N 0 0 385.355 3.344 20 5 GGBDRN C[C@H]([NH2+]CCSCc1ccccc1-c1nn[n-]n1)c1cccc([N+](=O)[O-])c1 ZINC000824604727 1427586691 /nfs/dbraw/zinc/58/66/91/1427586691.db2.gz DJWHEVSTSCGCQX-ZDUSSCGKSA-N 0 0 384.465 3.359 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(N3CCOCC3)nc2)cc1[N+](=O)[O-] ZINC000175189887 1427590968 /nfs/dbraw/zinc/59/09/68/1427590968.db2.gz RJWRGLNRQOEMEN-AWEZNQCLSA-N 0 0 385.424 3.018 20 5 GGBDRN O=C(Nc1ccc(N2CCCS2(=O)=O)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175198827 1427594619 /nfs/dbraw/zinc/59/46/19/1427594619.db2.gz VSKUNYQGXHGWGW-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175201830 1427596611 /nfs/dbraw/zinc/59/66/11/1427596611.db2.gz YZDQCDWUVRLETH-ZDUSSCGKSA-N 0 0 385.420 3.160 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000175202217 1427597124 /nfs/dbraw/zinc/59/71/24/1427597124.db2.gz QQZIHNDEYLFDRT-ZDUSSCGKSA-N 0 0 385.420 3.160 20 5 GGBDRN O=C(NCc1ccc(Cl)nc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000175230024 1427614717 /nfs/dbraw/zinc/61/47/17/1427614717.db2.gz CSYBFFYXISUJQU-UHFFFAOYSA-N 0 0 390.827 3.396 20 5 GGBDRN Cc1ccccc1[C@H](O)CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175231281 1427614760 /nfs/dbraw/zinc/61/47/60/1427614760.db2.gz XJVPGEUEUNFDQP-OAHLLOKOSA-N 0 0 379.210 3.129 20 5 GGBDRN CCN(CC)C(=O)c1cccc(OC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000175236167 1427618094 /nfs/dbraw/zinc/61/80/94/1427618094.db2.gz KECWDPPDMCYQCJ-UHFFFAOYSA-N 0 0 385.420 3.119 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000175239539 1427621248 /nfs/dbraw/zinc/62/12/48/1427621248.db2.gz WTMLMJFFRXFPSA-UHFFFAOYSA-N 0 0 390.871 3.360 20 5 GGBDRN C[C@H]1CN(C)c2ccccc2CN1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000175245947 1427624237 /nfs/dbraw/zinc/62/42/37/1427624237.db2.gz GIDURXYAIYDYSD-HNNXBMFYSA-N 0 0 378.436 3.151 20 5 GGBDRN Cc1cnc2c(cccc2S(=O)(=O)Oc2cc(N(C)C)ccc2[N+](=O)[O-])c1 ZINC000175262325 1427631974 /nfs/dbraw/zinc/63/19/74/1427631974.db2.gz CNZFEYFQRYMAHV-UHFFFAOYSA-N 0 0 387.417 3.285 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OS(=O)(=O)c2ccccc2C(F)(F)F)c1 ZINC000175263343 1427633239 /nfs/dbraw/zinc/63/32/39/1427633239.db2.gz BJTVGZJDHLTXIG-UHFFFAOYSA-N 0 0 390.339 3.447 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000175267755 1427635934 /nfs/dbraw/zinc/63/59/34/1427635934.db2.gz DEAIVQBGEIDAPK-NSHDSACASA-N 0 0 385.355 3.344 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N(CCc1ccccc1)[C@H]1CCOC1 ZINC000175270749 1427638669 /nfs/dbraw/zinc/63/86/69/1427638669.db2.gz QXOPIJQPNNWYGS-SFHVURJKSA-N 0 0 384.432 3.224 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N(CCc2ccccc2)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000175282063 1427645730 /nfs/dbraw/zinc/64/57/30/1427645730.db2.gz UYVBUTSWTGFGHL-KRWDZBQOSA-N 0 0 399.403 3.285 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCN(C)c3ccc(F)cc32)cc1OC ZINC000175284954 1427647530 /nfs/dbraw/zinc/64/75/30/1427647530.db2.gz GUYWWQUMHJZLKE-UHFFFAOYSA-N 0 0 389.383 3.238 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H](c1nc(C)cs1)C1CC1 ZINC000175289961 1427650042 /nfs/dbraw/zinc/65/00/42/1427650042.db2.gz CXBCODHTDCGERZ-HNNXBMFYSA-N 0 0 376.438 3.319 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H](OC)c1cccc(Cl)c1 ZINC000175290114 1427650096 /nfs/dbraw/zinc/65/00/96/1427650096.db2.gz JSDVDAJSEFAWTA-QGZVFWFLSA-N 0 0 393.827 3.444 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](C)Oc1ccccc1F ZINC000175290824 1427650352 /nfs/dbraw/zinc/65/03/52/1427650352.db2.gz KORZJBYANICPFB-LBPRGKRZSA-N 0 0 377.372 3.009 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H](C)Oc1ccccc1F ZINC000175290854 1427650387 /nfs/dbraw/zinc/65/03/87/1427650387.db2.gz KORZJBYANICPFB-GFCCVEGCSA-N 0 0 377.372 3.009 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H](c1ncc(C)s1)C1CC1 ZINC000175291941 1427650808 /nfs/dbraw/zinc/65/08/08/1427650808.db2.gz QZKNYCNYUHJPCN-HNNXBMFYSA-N 0 0 376.438 3.319 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[C@H](COCc2ccccc2)C1 ZINC000175292074 1427650899 /nfs/dbraw/zinc/65/08/99/1427650899.db2.gz DFHLCMJOTYKNCT-KRWDZBQOSA-N 0 0 399.447 3.352 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](C)Oc1cccc(F)c1 ZINC000175292010 1427650920 /nfs/dbraw/zinc/65/09/20/1427650920.db2.gz IIQJEBMODSKMOE-LBPRGKRZSA-N 0 0 377.372 3.009 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cccc(COCCOCC)c2C)c1[N+](=O)[O-] ZINC000175296312 1427654494 /nfs/dbraw/zinc/65/44/94/1427654494.db2.gz YUOBQFZIRGRVIL-UHFFFAOYSA-N 0 0 390.440 3.384 20 5 GGBDRN O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175297845 1427656645 /nfs/dbraw/zinc/65/66/45/1427656645.db2.gz WCZOYTXSFRNYNX-DLBZAZTESA-N 0 0 381.413 3.106 20 5 GGBDRN O=C(Nc1c(F)cc(F)cc1F)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000175299537 1427657839 /nfs/dbraw/zinc/65/78/39/1427657839.db2.gz WREYJBZXUUPOKG-MRVPVSSYSA-N 0 0 397.284 3.143 20 5 GGBDRN Cc1csc([C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000175300506 1427660353 /nfs/dbraw/zinc/66/03/53/1427660353.db2.gz VRKWIFCOAGYHJZ-ZDUSSCGKSA-N 0 0 394.840 3.219 20 5 GGBDRN CCOCCOCc1cccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1C ZINC000175303670 1427663353 /nfs/dbraw/zinc/66/33/53/1427663353.db2.gz ZMIBCGFSSOAPHB-UHFFFAOYSA-N 0 0 391.399 3.430 20 5 GGBDRN COc1ccc(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)cc1[N+](=O)[O-] ZINC000175311130 1427667959 /nfs/dbraw/zinc/66/79/59/1427667959.db2.gz JGCIYVLKAZCWIS-LBPRGKRZSA-N 0 0 382.376 3.068 20 5 GGBDRN O=C(N[C@@H]1c2ccccc2C[C@H]1O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175312602 1427669190 /nfs/dbraw/zinc/66/91/90/1427669190.db2.gz QKVITIWVRZHVNS-IAGOWNOFSA-N 0 0 381.413 3.106 20 5 GGBDRN C[C@@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1nc(Cc2ccccc2)no1 ZINC000175312671 1427669275 /nfs/dbraw/zinc/66/92/75/1427669275.db2.gz NKEFWVRRVVHTOX-BRADTZPFSA-N 0 0 378.388 3.459 20 5 GGBDRN Cc1c(C(=O)NC[C@H](c2cccnc2)C(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000175313597 1427669682 /nfs/dbraw/zinc/66/96/82/1427669682.db2.gz VASWFPVAKRYQCW-SFHVURJKSA-N 0 0 394.435 3.049 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@@H]3c4ccccc4C[C@H]3O)cc2[N+](=O)[O-])CC1 ZINC000175317706 1427673831 /nfs/dbraw/zinc/67/38/31/1427673831.db2.gz KUXMGQKQFHURBW-NHCUHLMSSA-N 0 0 395.459 3.219 20 5 GGBDRN O=C(Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1)c1ccc([N+](=O)[O-])s1 ZINC000175318957 1427674827 /nfs/dbraw/zinc/67/48/27/1427674827.db2.gz DMOVQTOAHDNJTE-UHFFFAOYSA-N 0 0 390.812 3.415 20 5 GGBDRN CCN(CC(=O)NCc1ccc(F)cc1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175325150 1427679895 /nfs/dbraw/zinc/67/98/95/1427679895.db2.gz UICRPLCZISKDGK-UHFFFAOYSA-N 0 0 393.802 3.166 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)c1 ZINC000175327872 1427680538 /nfs/dbraw/zinc/68/05/38/1427680538.db2.gz KFMVQHXGZNOZHC-HNNXBMFYSA-N 0 0 378.388 3.244 20 5 GGBDRN Cc1nc2ccccc2n1CCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175326959 1427680636 /nfs/dbraw/zinc/68/06/36/1427680636.db2.gz HQGFPNWUUNYOGI-UHFFFAOYSA-N 0 0 381.436 3.487 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000175327612 1427680737 /nfs/dbraw/zinc/68/07/37/1427680737.db2.gz CHDWKESBWNWFHC-QGZVFWFLSA-N 0 0 391.431 3.302 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1cc([N+](=O)[O-])ccc1Br)CCO2 ZINC000175335633 1427687392 /nfs/dbraw/zinc/68/73/92/1427687392.db2.gz IPWLFFOUTJZYLM-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC(OCC2CCCC2)CC1 ZINC000175360340 1427705114 /nfs/dbraw/zinc/70/51/14/1427705114.db2.gz OPABRKUVNLYXNV-UHFFFAOYSA-N 0 0 391.468 3.484 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1cc2ccccc2o1 ZINC000175365197 1427709052 /nfs/dbraw/zinc/70/90/52/1427709052.db2.gz CYRNIMRMYOLWHY-UHFFFAOYSA-N 0 0 376.390 3.170 20 5 GGBDRN Cc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1C(=O)N(C)C ZINC000175364986 1427709304 /nfs/dbraw/zinc/70/93/04/1427709304.db2.gz UXRRVHUOVGBDGF-UHFFFAOYSA-N 0 0 375.812 3.440 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1C(=O)N(C)C ZINC000175365669 1427709443 /nfs/dbraw/zinc/70/94/43/1427709443.db2.gz POGPOYZNNWNORL-UHFFFAOYSA-N 0 0 396.447 3.458 20 5 GGBDRN CCc1nnc(-c2cccc(NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)c2)o1 ZINC000175371518 1427714707 /nfs/dbraw/zinc/71/47/07/1427714707.db2.gz YVKZPGWKKNVCMS-UHFFFAOYSA-N 0 0 384.396 3.049 20 5 GGBDRN Cc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1C(=O)N(C)C ZINC000175371692 1427714815 /nfs/dbraw/zinc/71/48/15/1427714815.db2.gz WYIULFPGTOABRE-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1C(=O)N(C)C ZINC000175375041 1427717252 /nfs/dbraw/zinc/71/72/52/1427717252.db2.gz NBBHAZRJNFWMKE-UHFFFAOYSA-N 0 0 382.420 3.432 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H](C)CC ZINC000175382977 1427722159 /nfs/dbraw/zinc/72/21/59/1427722159.db2.gz GLBDWQKVRBTVLS-TVQRCGJNSA-N 0 0 376.331 3.321 20 5 GGBDRN CCNC(=O)COc1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 ZINC000175393292 1427728583 /nfs/dbraw/zinc/72/85/83/1427728583.db2.gz VASHNMSUGSXYAM-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN COC(=O)c1cc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)oc1C ZINC000175403584 1427734899 /nfs/dbraw/zinc/73/48/99/1427734899.db2.gz XTYYMBKYFMFDSL-UHFFFAOYSA-N 0 0 375.381 3.017 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)c([N+](=O)[O-])cc1OC ZINC000175408165 1427737169 /nfs/dbraw/zinc/73/71/69/1427737169.db2.gz KMZSSWMFJKWGTR-CYBMUJFWSA-N 0 0 396.403 3.289 20 5 GGBDRN C[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000175408104 1427737584 /nfs/dbraw/zinc/73/75/84/1427737584.db2.gz INJPACPLUYEFDG-HNNXBMFYSA-N 0 0 379.420 3.460 20 5 GGBDRN O=C(NCCc1nc(C(F)(F)F)cs1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000175409341 1427738361 /nfs/dbraw/zinc/73/83/61/1427738361.db2.gz FWJUWZFRTHQLQY-UHFFFAOYSA-N 0 0 381.282 3.321 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000175421999 1427745795 /nfs/dbraw/zinc/74/57/95/1427745795.db2.gz PHOKSGSHBPQVGA-CANCMXDXSA-N 0 0 396.490 3.022 20 5 GGBDRN COc1cccc([C@@H](C)CC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000175425548 1427747810 /nfs/dbraw/zinc/74/78/10/1427747810.db2.gz OZXZXFRUVHUSGM-GOEBONIOSA-N 0 0 384.436 3.205 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(c2cc(F)ccc2F)CC1 ZINC000175427326 1427749227 /nfs/dbraw/zinc/74/92/27/1427749227.db2.gz LOMIHBVGFYCOLJ-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)cc([N+](=O)[O-])c1 ZINC000175429323 1427749716 /nfs/dbraw/zinc/74/97/16/1427749716.db2.gz VXPWGWRDHYXOPX-CYBMUJFWSA-N 0 0 394.387 3.058 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000175429312 1427749780 /nfs/dbraw/zinc/74/97/80/1427749780.db2.gz KDNOHQLUXXCWNZ-UHFFFAOYSA-N 0 0 394.435 3.218 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccc(-n2cccn2)cc1 ZINC000175434358 1427752839 /nfs/dbraw/zinc/75/28/39/1427752839.db2.gz TUHKAHZMXMOBIV-LBPRGKRZSA-N 0 0 376.376 3.148 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000175438820 1427754937 /nfs/dbraw/zinc/75/49/37/1427754937.db2.gz QZKHQMUTLRWOTQ-QGZVFWFLSA-N 0 0 393.443 3.280 20 5 GGBDRN C[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1noc(Cc2ccccc2)n1 ZINC000175438558 1427755014 /nfs/dbraw/zinc/75/50/14/1427755014.db2.gz VHDPRIDOQHRPLK-AWEZNQCLSA-N 0 0 395.419 3.172 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000175438761 1427755125 /nfs/dbraw/zinc/75/51/25/1427755125.db2.gz GKBCTLGLYIPYCH-SJORKVTESA-N 0 0 389.477 3.497 20 5 GGBDRN CC(C)(NC(=O)NCC(=O)Nc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000175438982 1427755639 /nfs/dbraw/zinc/75/56/39/1427755639.db2.gz RMKNEOAWXLSJMN-UHFFFAOYSA-N 0 0 390.827 3.421 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175438836 1427755871 /nfs/dbraw/zinc/75/58/71/1427755871.db2.gz QZKHQMUTLRWOTQ-KRWDZBQOSA-N 0 0 393.443 3.280 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000175444230 1427757775 /nfs/dbraw/zinc/75/77/75/1427757775.db2.gz CZYWHJHSNAMQBV-CYBMUJFWSA-N 0 0 385.445 3.413 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175445532 1427758503 /nfs/dbraw/zinc/75/85/03/1427758503.db2.gz MWMILLXIIKSDCJ-AWEZNQCLSA-N 0 0 397.406 3.490 20 5 GGBDRN CC(C)(NC(=O)NC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000175459310 1427766597 /nfs/dbraw/zinc/76/65/97/1427766597.db2.gz LKKNGOFXPMFWAG-UHFFFAOYSA-N 0 0 388.390 3.156 20 5 GGBDRN CCSCC[C@@H](C)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000175461993 1427767479 /nfs/dbraw/zinc/76/74/79/1427767479.db2.gz KRDNRNJSMSKVQE-OLZOCXBDSA-N 0 0 397.472 3.077 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC(OC[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000175463174 1427768306 /nfs/dbraw/zinc/76/83/06/1427768306.db2.gz WLJSKYIZMRRACL-QAPCUYQASA-N 0 0 391.468 3.334 20 5 GGBDRN CC(C)[C@@H](CNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccnc1 ZINC000175471802 1427772836 /nfs/dbraw/zinc/77/28/36/1427772836.db2.gz SLBNAFDDOQKPGH-HXUWFJFHSA-N 0 0 397.479 3.261 20 5 GGBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2nc(CCc3ccccc3)no2)CC1 ZINC000175477889 1427776528 /nfs/dbraw/zinc/77/65/28/1427776528.db2.gz ITBKNIFNPQTWOA-UHFFFAOYSA-N 0 0 393.447 3.085 20 5 GGBDRN CCc1cc(N2CCC(NC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)ncn1 ZINC000175478990 1427776938 /nfs/dbraw/zinc/77/69/38/1427776938.db2.gz KPRXIXJDNYSWLA-UHFFFAOYSA-N 0 0 384.440 3.046 20 5 GGBDRN O=C(NCc1cccc(CN2CCCC2=O)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175479771 1427777742 /nfs/dbraw/zinc/77/77/42/1427777742.db2.gz RLCJNJUMKOSKQU-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000175488753 1427783640 /nfs/dbraw/zinc/78/36/40/1427783640.db2.gz XCTKVPMIFRBVOF-UHFFFAOYSA-N 0 0 381.860 3.407 20 5 GGBDRN C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000175495754 1427789393 /nfs/dbraw/zinc/78/93/93/1427789393.db2.gz HZMGQDLIRKQDIG-JTQLQIEISA-N 0 0 379.319 3.126 20 5 GGBDRN C[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000175495771 1427789605 /nfs/dbraw/zinc/78/96/05/1427789605.db2.gz HZMGQDLIRKQDIG-SNVBAGLBSA-N 0 0 379.319 3.126 20 5 GGBDRN COc1cccc2c1OC[C@@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000175499425 1427790967 /nfs/dbraw/zinc/79/09/67/1427790967.db2.gz JRRANUKPGWFQCA-HNNXBMFYSA-N 0 0 385.420 3.141 20 5 GGBDRN Cc1ccccc1Cc1noc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000175522063 1427802432 /nfs/dbraw/zinc/80/24/32/1427802432.db2.gz GTBBLEYUDHQWIF-UHFFFAOYSA-N 0 0 393.447 3.199 20 5 GGBDRN C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000175522347 1427802938 /nfs/dbraw/zinc/80/29/38/1427802938.db2.gz PDVDNIDHFJSNLR-CQSZACIVSA-N 0 0 383.404 3.189 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000175536247 1427807251 /nfs/dbraw/zinc/80/72/51/1427807251.db2.gz DOMZOOCVJPDEMJ-AWEZNQCLSA-N 0 0 385.420 3.277 20 5 GGBDRN Cc1cc(C)c2c(c1)CCCN2C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000175536102 1427807288 /nfs/dbraw/zinc/80/72/88/1427807288.db2.gz PLFPSGBGXCYPIV-UHFFFAOYSA-N 0 0 388.445 3.208 20 5 GGBDRN Cc1cc(C)c2c(c1)CCCN2C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000175535524 1427807294 /nfs/dbraw/zinc/80/72/94/1427807294.db2.gz DYPGGRSXZOZFST-UHFFFAOYSA-N 0 0 381.388 3.099 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000175535321 1427807340 /nfs/dbraw/zinc/80/73/40/1427807340.db2.gz QFVYRVGESKIRHR-UHFFFAOYSA-N 0 0 383.795 3.163 20 5 GGBDRN C[C@H](NC(=O)C[C@H]1CN(Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000175539167 1427808714 /nfs/dbraw/zinc/80/87/14/1427808714.db2.gz BMRKRZDLOOGUBC-JXFKEZNVSA-N 0 0 383.448 3.063 20 5 GGBDRN Cc1cc(C)c2c(c1)CCCN2C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000175540193 1427808814 /nfs/dbraw/zinc/80/88/14/1427808814.db2.gz PSVGYDLZLUEUHO-UHFFFAOYSA-N 0 0 388.445 3.208 20 5 GGBDRN O=C(NC[C@H](O)c1ccccc1F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175543124 1427809481 /nfs/dbraw/zinc/80/94/81/1427809481.db2.gz JZPAOTULRUUZRU-INIZCTEOSA-N 0 0 387.392 3.321 20 5 GGBDRN O=C(NCCOCc1ccccc1)c1cc([N+](=O)[O-])ccc1Br ZINC000175544940 1427810348 /nfs/dbraw/zinc/81/03/48/1427810348.db2.gz XCUCTQJKJYVWSL-UHFFFAOYSA-N 0 0 379.210 3.304 20 5 GGBDRN CSc1ccc(C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000175549533 1427811936 /nfs/dbraw/zinc/81/19/36/1427811936.db2.gz PROUHOSBHYHNNC-UHFFFAOYSA-N 0 0 377.397 3.410 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)c1 ZINC000175550854 1427812023 /nfs/dbraw/zinc/81/20/23/1427812023.db2.gz HWHUINKARXWWBW-GWQKEKGPSA-N 0 0 376.434 3.174 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@@H](O)c1ccccc1F ZINC000175584697 1427822699 /nfs/dbraw/zinc/82/26/99/1427822699.db2.gz PXPGNWQJPWLVFH-OAQYLSRUSA-N 0 0 390.414 3.144 20 5 GGBDRN CN(CC(=O)N1CCC(OCC2CCCC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000175597379 1427826784 /nfs/dbraw/zinc/82/67/84/1427826784.db2.gz ZBCCLAHCBSFSLX-UHFFFAOYSA-N 0 0 375.469 3.229 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000175624509 1427836507 /nfs/dbraw/zinc/83/65/07/1427836507.db2.gz PGXBTDLRCNMSHC-YGCGBWEQSA-N 0 0 381.498 3.209 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCNc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175626358 1427836819 /nfs/dbraw/zinc/83/68/19/1427836819.db2.gz JEGJORCWRGIXEH-ZDUSSCGKSA-N 0 0 387.396 3.284 20 5 GGBDRN CCc1n[nH]c(C(=O)NCCc2nc(C3CCCCC3)cs2)c1[N+](=O)[O-] ZINC000175626675 1427836906 /nfs/dbraw/zinc/83/69/06/1427836906.db2.gz FZDDIXHECHJTTD-UHFFFAOYSA-N 0 0 377.470 3.357 20 5 GGBDRN O=C(NCc1cccc(CN2CCOCC2)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175636456 1427840061 /nfs/dbraw/zinc/84/00/61/1427840061.db2.gz ZFHMWEVJNUIELE-UHFFFAOYSA-N 0 0 389.839 3.010 20 5 GGBDRN O=C(NCC1(CN2CCOCC2)CCCCC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000175648570 1427844108 /nfs/dbraw/zinc/84/41/08/1427844108.db2.gz VQHGTFXTKDJSJC-UHFFFAOYSA-N 0 0 395.887 3.261 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N(CCC(N)=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000175657962 1427847072 /nfs/dbraw/zinc/84/70/72/1427847072.db2.gz NTVLGAISPYMUJA-HNNXBMFYSA-N 0 0 384.436 3.051 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175657942 1427847268 /nfs/dbraw/zinc/84/72/68/1427847268.db2.gz NDMGRQAATHUKIC-UHFFFAOYSA-N 0 0 380.154 3.196 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000175669365 1427851022 /nfs/dbraw/zinc/85/10/22/1427851022.db2.gz CJYZVFBKDQKGHQ-OAGGEKHMSA-N 0 0 392.500 3.151 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])c(C)n1)c1ccc(Cl)cc1 ZINC000175672382 1427852179 /nfs/dbraw/zinc/85/21/79/1427852179.db2.gz XXSKRKYNDAGKQH-AWEZNQCLSA-N 0 0 376.800 3.158 20 5 GGBDRN Cc1nc(NC(=O)C2CCN(C(=O)/C=C/c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000175677494 1427853835 /nfs/dbraw/zinc/85/38/35/1427853835.db2.gz ZLBDVLFTLZJZNO-JXMROGBWSA-N 0 0 394.431 3.189 20 5 GGBDRN CC1CCN(C(=O)C2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)CC1 ZINC000175684752 1427856067 /nfs/dbraw/zinc/85/60/67/1427856067.db2.gz ZCXSGRLNLUKKBX-UHFFFAOYSA-N 0 0 393.871 3.359 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000175689016 1427858157 /nfs/dbraw/zinc/85/81/57/1427858157.db2.gz JMXVTWURWRDTFS-UHFFFAOYSA-N 0 0 381.860 3.359 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccc(C(=O)N(C)C)cc2)cc1[N+](=O)[O-] ZINC000175690169 1427858770 /nfs/dbraw/zinc/85/87/70/1427858770.db2.gz IUWCVGFAYGLFOR-AWEZNQCLSA-N 0 0 384.436 3.165 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@@H](CC(C)C)N2CCOCC2)cc1[N+](=O)[O-] ZINC000175695165 1427861267 /nfs/dbraw/zinc/86/12/67/1427861267.db2.gz QBTAOFCCBWSHKW-SJLPKXTDSA-N 0 0 392.500 3.010 20 5 GGBDRN C[C@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1c(F)cccc1Cl ZINC000175697625 1427862148 /nfs/dbraw/zinc/86/21/48/1427862148.db2.gz ILSIWVQJOWVYED-JTQLQIEISA-N 0 0 380.759 3.456 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175697065 1427862231 /nfs/dbraw/zinc/86/22/31/1427862231.db2.gz SMBMYOAVFKEBTO-UHFFFAOYSA-N 0 0 380.154 3.196 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000175699332 1427862850 /nfs/dbraw/zinc/86/28/50/1427862850.db2.gz LVJYROLXGJPNRT-BBRMVZONSA-N 0 0 388.445 3.017 20 5 GGBDRN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000175699278 1427863022 /nfs/dbraw/zinc/86/30/22/1427863022.db2.gz LVJYROLXGJPNRT-CZUORRHYSA-N 0 0 388.445 3.017 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1Cc2ccccc2N(C)C[C@@H]1C ZINC000175702669 1427864275 /nfs/dbraw/zinc/86/42/75/1427864275.db2.gz XHGSLWQFPLWQNU-AWEZNQCLSA-N 0 0 384.436 3.154 20 5 GGBDRN COC[C@@H](NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccco1 ZINC000175712698 1427867449 /nfs/dbraw/zinc/86/74/49/1427867449.db2.gz ZIZLDCJVIZEUTH-QGZVFWFLSA-N 0 0 389.408 3.128 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1ccccc1)CC(F)F ZINC000175714091 1427867920 /nfs/dbraw/zinc/86/79/20/1427867920.db2.gz DKDAQYWRGINZJY-UHFFFAOYSA-N 0 0 386.376 3.059 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175735715 1427873647 /nfs/dbraw/zinc/87/36/47/1427873647.db2.gz JESNBFWVKQZHQE-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN C[C@H](NC(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000175735680 1427873736 /nfs/dbraw/zinc/87/37/36/1427873736.db2.gz UQAARMDCIFZLDX-GLJUWKHASA-N 0 0 382.420 3.149 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccc(N3CCCC3)nc2)cc1[N+](=O)[O-] ZINC000175736243 1427874192 /nfs/dbraw/zinc/87/41/92/1427874192.db2.gz MCALFBFSDPOQKK-OAHLLOKOSA-N 0 0 383.452 3.459 20 5 GGBDRN NC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)o1 ZINC000175759435 1427881605 /nfs/dbraw/zinc/88/16/05/1427881605.db2.gz CWXCULHUQMAJMR-UHFFFAOYSA-N 0 0 397.412 3.368 20 5 GGBDRN COc1ccc(C(=O)N(C)C)cc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175762105 1427882625 /nfs/dbraw/zinc/88/26/25/1427882625.db2.gz HWBPKWKPGAZCSX-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000175769667 1427886522 /nfs/dbraw/zinc/88/65/22/1427886522.db2.gz CWCWKCMCYWKNAU-AREMUKBSSA-N 0 0 375.450 3.477 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](C)c2noc(Cc3ccccc3)n2)c1[N+](=O)[O-] ZINC000175785336 1427891935 /nfs/dbraw/zinc/89/19/35/1427891935.db2.gz XWQZGVBNKVVRFS-GFCCVEGCSA-N 0 0 397.391 3.313 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@@H](C)c2noc(Cc3ccccc3)n2)c1[N+](=O)[O-] ZINC000175785318 1427892029 /nfs/dbraw/zinc/89/20/29/1427892029.db2.gz XWQZGVBNKVVRFS-LBPRGKRZSA-N 0 0 397.391 3.313 20 5 GGBDRN CC[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1cccc(F)c1 ZINC000175823620 1427912453 /nfs/dbraw/zinc/91/24/53/1427912453.db2.gz ZPGNYOMLOGWQGF-INIZCTEOSA-N 0 0 382.413 3.011 20 5 GGBDRN O=C(Nc1ncn(Cc2ccc(Cl)cc2)n1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000175828624 1427915904 /nfs/dbraw/zinc/91/59/04/1427915904.db2.gz ZKPAWOYKRJAMGZ-UHFFFAOYSA-N 0 0 393.737 3.419 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000175844035 1427925602 /nfs/dbraw/zinc/92/56/02/1427925602.db2.gz NBNQSXCPISILAS-YOEHRIQHSA-N 0 0 389.477 3.491 20 5 GGBDRN CCC1(CNC(=O)[C@@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000175848803 1427930439 /nfs/dbraw/zinc/93/04/39/1427930439.db2.gz MVDSNQYMINRTOO-MRXNPFEDSA-N 0 0 393.509 3.143 20 5 GGBDRN C[C@H]1c2ccccc2CCN1C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000175849410 1427930851 /nfs/dbraw/zinc/93/08/51/1427930851.db2.gz QBUYCUANDVVNQP-BBRMVZONSA-N 0 0 399.472 3.407 20 5 GGBDRN C[C@H]1c2ccccc2CCN1C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000175849442 1427931010 /nfs/dbraw/zinc/93/10/10/1427931010.db2.gz QBUYCUANDVVNQP-XJKSGUPXSA-N 0 0 399.472 3.407 20 5 GGBDRN COC(=O)c1cc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000175873317 1427945332 /nfs/dbraw/zinc/94/53/32/1427945332.db2.gz IWKQOECMYPPFPX-LLVKDONJSA-N 0 0 375.381 3.152 20 5 GGBDRN CCC(=O)Nc1ccc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175891263 1427953906 /nfs/dbraw/zinc/95/39/06/1427953906.db2.gz RLIGOXOQIGBVTR-UHFFFAOYSA-N 0 0 391.449 3.157 20 5 GGBDRN CC(C)(NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC000175892570 1427954587 /nfs/dbraw/zinc/95/45/87/1427954587.db2.gz YINBASSWDQGIOQ-UHFFFAOYSA-N 0 0 399.812 3.370 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175891757 1427954976 /nfs/dbraw/zinc/95/49/76/1427954976.db2.gz WGNYFJAEAPLVLT-UHFFFAOYSA-N 0 0 379.394 3.025 20 5 GGBDRN COc1ccc(S(=O)(=O)NC(C)(C)c2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000175898102 1427958270 /nfs/dbraw/zinc/95/82/70/1427958270.db2.gz RGJDTEDXPCAIJX-UHFFFAOYSA-N 0 0 386.376 3.095 20 5 GGBDRN C[C@H](NC(=O)N(C)Cc1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000175902735 1427961320 /nfs/dbraw/zinc/96/13/20/1427961320.db2.gz KQYWQNPMHAZEGJ-NRRJATNASA-N 0 0 375.450 3.235 20 5 GGBDRN O=C(NC[C@H](CCO)c1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000175920490 1427972706 /nfs/dbraw/zinc/97/27/06/1427972706.db2.gz HAKCFNJYZJSJOI-SFHVURJKSA-N 0 0 383.448 3.091 20 5 GGBDRN O=C(NC[C@@H](CCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000175919878 1427972721 /nfs/dbraw/zinc/97/27/21/1427972721.db2.gz XAQYCMAXMYVHLI-QGZVFWFLSA-N 0 0 383.448 3.091 20 5 GGBDRN CC(C)Oc1ccc(CC[C@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000175924043 1427975153 /nfs/dbraw/zinc/97/51/53/1427975153.db2.gz TVDHFXKQOYIDDF-HNNXBMFYSA-N 0 0 399.447 3.458 20 5 GGBDRN O=C(NC[C@@H](CCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000175926380 1427976937 /nfs/dbraw/zinc/97/69/37/1427976937.db2.gz BVTINFRYLNPVLL-GOSISDBHSA-N 0 0 397.475 3.481 20 5 GGBDRN C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C1(N2CCOCC2)CCCC1 ZINC000175932735 1427981064 /nfs/dbraw/zinc/98/10/64/1427981064.db2.gz DTXDLWMBBWVWCF-ZDUSSCGKSA-N 0 0 381.860 3.012 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175937715 1427984363 /nfs/dbraw/zinc/98/43/63/1427984363.db2.gz SBVZGHYUOOJOBZ-GFCCVEGCSA-N 0 0 388.380 3.380 20 5 GGBDRN COc1cc(OCC(=O)N(CC2CCC2)CC(F)(F)F)ccc1[N+](=O)[O-] ZINC000175941102 1427986562 /nfs/dbraw/zinc/98/65/62/1427986562.db2.gz BVUKRVAIYNORGV-UHFFFAOYSA-N 0 0 376.331 3.173 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc2n(C)c3ccccc3n12 ZINC000175946271 1427989000 /nfs/dbraw/zinc/98/90/00/1427989000.db2.gz QZKAEOXDVWHXFF-UHFFFAOYSA-N 0 0 396.432 3.168 20 5 GGBDRN C[C@H](Sc1nnc2n(C)c3ccccc3n12)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000175955608 1427995674 /nfs/dbraw/zinc/99/56/74/1427995674.db2.gz YPVUXLIJRQIOIP-NSHDSACASA-N 0 0 396.432 3.249 20 5 GGBDRN Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000175956461 1427996562 /nfs/dbraw/zinc/99/65/62/1427996562.db2.gz HOWAOOPQKZIAEZ-UHFFFAOYSA-N 0 0 395.337 3.219 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175957782 1427997104 /nfs/dbraw/zinc/99/71/04/1427997104.db2.gz RGPDIOOFBCZFST-STQMWFEESA-N 0 0 381.860 3.405 20 5 GGBDRN CN(C(=O)CN1CC[C@H](OCCCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175958579 1427997971 /nfs/dbraw/zinc/99/79/71/1427997971.db2.gz FBGFRRUAXWYHIP-NRFANRHFSA-N 0 0 397.475 3.281 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N(CCO)[C@H]1CCCc2ccccc21 ZINC000175960876 1427999778 /nfs/dbraw/zinc/99/97/78/1427999778.db2.gz NKZUPVOEVWQYKN-FQEVSTJZSA-N 0 0 383.448 3.219 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCSC2(CCCCC2)C1 ZINC000175965843 1428002816 /nfs/dbraw/zinc/00/28/16/1428002816.db2.gz WRYSKALZNFEMAQ-UHFFFAOYSA-N 0 0 379.482 3.294 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)NCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000175975959 1428008345 /nfs/dbraw/zinc/00/83/45/1428008345.db2.gz NVDFOUSJCKAUSJ-GFCCVEGCSA-N 0 0 397.391 3.214 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1C[C@H]1c1cccc(F)c1F ZINC000175993958 1428018276 /nfs/dbraw/zinc/01/82/76/1428018276.db2.gz SMCCMKOAPJKCTR-QWHCGFSZSA-N 0 0 385.330 3.400 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OC(F)F)cc1 ZINC000176054866 1428054086 /nfs/dbraw/zinc/05/40/86/1428054086.db2.gz BMKIPNKQJCZAAX-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN O=C(C[C@H]1COCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1cccs1 ZINC000176077888 1428070475 /nfs/dbraw/zinc/07/04/75/1428070475.db2.gz MMDYYXKZKMIQLP-LBPRGKRZSA-N 0 0 394.836 3.424 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1 ZINC000176078735 1428070869 /nfs/dbraw/zinc/07/08/69/1428070869.db2.gz GENQPXHZNYATHK-SFHVURJKSA-N 0 0 387.411 3.023 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OCc2nc(C)c(C)s2)c([N+](=O)[O-])c1 ZINC000176108888 1428087732 /nfs/dbraw/zinc/08/77/32/1428087732.db2.gz YVZCEWLYWCQNDN-UHFFFAOYSA-N 0 0 399.494 3.278 20 5 GGBDRN O=C(c1c[nH]nc1-c1ccccc1F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000176127024 1428100114 /nfs/dbraw/zinc/10/01/14/1428100114.db2.gz FLFNHOZWUKTIFB-UHFFFAOYSA-N 0 0 395.394 3.086 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)c1c(F)cccc1Cl ZINC000176129672 1428102964 /nfs/dbraw/zinc/10/29/64/1428102964.db2.gz DWXUNHICDJMTQQ-SECBINFHSA-N 0 0 395.774 3.212 20 5 GGBDRN Cc1c(C(=O)NCc2nc3cc(F)ccc3[nH]2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000176131346 1428105657 /nfs/dbraw/zinc/10/56/57/1428105657.db2.gz AYINRCFTPOJKMQ-UHFFFAOYSA-N 0 0 387.327 3.065 20 5 GGBDRN O=C(N[C@H](C1CCCC1)C(F)(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000176138332 1428111250 /nfs/dbraw/zinc/11/12/50/1428111250.db2.gz CCUZSPZEJXUCQN-OAHLLOKOSA-N 0 0 383.326 3.287 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC[C@H]1[C@H]1CCCCC1=O ZINC000176157176 1428125842 /nfs/dbraw/zinc/12/58/42/1428125842.db2.gz VLKRPDWOMBSGEQ-CVEARBPZSA-N 0 0 382.420 3.144 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H]1CCCCC1=O ZINC000176157162 1428126021 /nfs/dbraw/zinc/12/60/21/1428126021.db2.gz VLKRPDWOMBSGEQ-HZPDHXFCSA-N 0 0 382.420 3.144 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)[C@@H](C)C1CCCCC1 ZINC000176163596 1428130622 /nfs/dbraw/zinc/13/06/22/1428130622.db2.gz CCEYTBDFRFZEPA-OLZOCXBDSA-N 0 0 377.441 3.263 20 5 GGBDRN CCOc1ccc(C2(CNC(=O)c3cccc([N+](=O)[O-])c3N)CCOCC2)cc1 ZINC000176164885 1428131717 /nfs/dbraw/zinc/13/17/17/1428131717.db2.gz PDQAOVPQPMDFRP-UHFFFAOYSA-N 0 0 399.447 3.054 20 5 GGBDRN O=C(OC1CCN(c2nncc3ccccc32)CC1)c1ccccc1[N+](=O)[O-] ZINC000176166250 1428132399 /nfs/dbraw/zinc/13/23/99/1428132399.db2.gz XSCWFALOGBJMAY-UHFFFAOYSA-N 0 0 378.388 3.364 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000176165985 1428132493 /nfs/dbraw/zinc/13/24/93/1428132493.db2.gz PITZUNYKSXWGPE-IBGZPJMESA-N 0 0 395.415 3.362 20 5 GGBDRN O=C(OC1CCN(c2nncc3ccccc32)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000176167047 1428133287 /nfs/dbraw/zinc/13/32/87/1428133287.db2.gz MRVPNWIIYFPCEY-UHFFFAOYSA-N 0 0 378.388 3.364 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000176168155 1428134421 /nfs/dbraw/zinc/13/44/21/1428134421.db2.gz FWUNXRQKHXHFBS-LJQANCHMSA-N 0 0 380.400 3.493 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000176168633 1428134865 /nfs/dbraw/zinc/13/48/65/1428134865.db2.gz KYQMWBOKQWLBGG-IBGZPJMESA-N 0 0 380.400 3.493 20 5 GGBDRN Cc1cc(C(=O)OC[C@H]2CC(=O)N(CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000176182332 1428146348 /nfs/dbraw/zinc/14/63/48/1428146348.db2.gz YTTXVWQVHXILOT-KRWDZBQOSA-N 0 0 382.416 3.151 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2CC(=O)N(CCc3ccccc3)C2)c1 ZINC000176182396 1428146544 /nfs/dbraw/zinc/14/65/44/1428146544.db2.gz LQFGUYHPKIVHTC-KRWDZBQOSA-N 0 0 382.416 3.151 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000176185075 1428148301 /nfs/dbraw/zinc/14/83/01/1428148301.db2.gz QGNSYFLAUCYNTL-HNNXBMFYSA-N 0 0 384.436 3.002 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)c(C)c1[N+](=O)[O-] ZINC000176198779 1428160000 /nfs/dbraw/zinc/16/00/00/1428160000.db2.gz VGGYFXBIKIGARE-UHFFFAOYSA-N 0 0 396.407 3.364 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC(NC(=O)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000176204885 1428165786 /nfs/dbraw/zinc/16/57/86/1428165786.db2.gz BTLRJMMIYCHTDG-UHFFFAOYSA-N 0 0 391.424 3.138 20 5 GGBDRN O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCN1CCn1ccc([N+](=O)[O-])n1 ZINC000176207081 1428167428 /nfs/dbraw/zinc/16/74/28/1428167428.db2.gz RDDKATVYOXMFQK-CQSZACIVSA-N 0 0 398.250 3.201 20 5 GGBDRN Cc1ccccc1CCCOC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000176213570 1428171491 /nfs/dbraw/zinc/17/14/91/1428171491.db2.gz AXZJDDOOJQZQMR-UHFFFAOYSA-N 0 0 377.418 3.096 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000176230730 1428180635 /nfs/dbraw/zinc/18/06/35/1428180635.db2.gz DMCHROWDUMNBJR-CZUORRHYSA-N 0 0 375.450 3.183 20 5 GGBDRN Cc1cc(F)cc(C(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000176233966 1428182833 /nfs/dbraw/zinc/18/28/33/1428182833.db2.gz DGEFSHKMBXIPPW-NSHDSACASA-N 0 0 383.420 3.275 20 5 GGBDRN Cc1cc(F)cc(C(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000176233947 1428182854 /nfs/dbraw/zinc/18/28/54/1428182854.db2.gz DGEFSHKMBXIPPW-LLVKDONJSA-N 0 0 383.420 3.275 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCCCC(=O)N2Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000176233924 1428182905 /nfs/dbraw/zinc/18/29/05/1428182905.db2.gz XSRRTYVZEZSEJI-UHFFFAOYSA-N 0 0 385.395 3.095 20 5 GGBDRN Cc1cc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])ccc1N1C(=O)CCC1=O ZINC000176235304 1428183828 /nfs/dbraw/zinc/18/38/28/1428183828.db2.gz XZIDSBMEMQVGMS-UHFFFAOYSA-N 0 0 385.351 3.256 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2nnnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000176237402 1428184878 /nfs/dbraw/zinc/18/48/78/1428184878.db2.gz ZPVSCEQYMSYBFY-KGLIPLIRSA-N 0 0 395.423 3.000 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000176242620 1428188623 /nfs/dbraw/zinc/18/86/23/1428188623.db2.gz AEPNUOXAZFPFLO-UHFFFAOYSA-N 0 0 395.412 3.446 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000176240932 1428188961 /nfs/dbraw/zinc/18/89/61/1428188961.db2.gz GLOTYBSIUZIVGV-GDBMZVCRSA-N 0 0 376.434 3.150 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000176240947 1428189058 /nfs/dbraw/zinc/18/90/58/1428189058.db2.gz GLOTYBSIUZIVGV-ZBFHGGJFSA-N 0 0 376.434 3.150 20 5 GGBDRN CN(C)C(=O)c1cc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000176246200 1428192444 /nfs/dbraw/zinc/19/24/44/1428192444.db2.gz PQHLJXPQLUPLOA-UHFFFAOYSA-N 0 0 388.399 3.267 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCC[S@](=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000176248368 1428194340 /nfs/dbraw/zinc/19/43/40/1428194340.db2.gz ICBZRIRDTMJQRV-QZXCRCNTSA-N 0 0 389.477 3.212 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(=O)NCc1ccco1 ZINC000180178065 1429784024 /nfs/dbraw/zinc/78/40/24/1429784024.db2.gz LLNGOPWGQYIWCW-GFCCVEGCSA-N 0 0 391.449 3.123 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@H](C)CCO ZINC000180184204 1429790073 /nfs/dbraw/zinc/79/00/73/1429790073.db2.gz UCYKNBRBWMTYRL-MRXNPFEDSA-N 0 0 392.477 3.173 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)N1CCc2ccccc21 ZINC000180189134 1429791856 /nfs/dbraw/zinc/79/18/56/1429791856.db2.gz FWJLXJXFJJTUIU-UHFFFAOYSA-N 0 0 399.472 3.414 20 5 GGBDRN COc1cccc(C(C)(C)CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000180193635 1429795010 /nfs/dbraw/zinc/79/50/10/1429795010.db2.gz FVJACIIJIHZJAX-UHFFFAOYSA-N 0 0 392.477 3.043 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000180210554 1429802712 /nfs/dbraw/zinc/80/27/12/1429802712.db2.gz CBCUJETZDBYNIW-KRWDZBQOSA-N 0 0 396.447 3.382 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000180210574 1429802821 /nfs/dbraw/zinc/80/28/21/1429802821.db2.gz CBCUJETZDBYNIW-QGZVFWFLSA-N 0 0 396.447 3.382 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc(-c2ccncc2)no1 ZINC000180222191 1429806605 /nfs/dbraw/zinc/80/66/05/1429806605.db2.gz HNEDSIGAHCIZMQ-UHFFFAOYSA-N 0 0 399.432 3.470 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCCNC(=O)C1CCC1 ZINC000180235348 1429810709 /nfs/dbraw/zinc/81/07/09/1429810709.db2.gz MBCHXUUHEAQUNM-UHFFFAOYSA-N 0 0 379.482 3.132 20 5 GGBDRN CCCc1cnc(NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)s1 ZINC000180254499 1429816059 /nfs/dbraw/zinc/81/60/59/1429816059.db2.gz KXBNAJMEJMVOAT-UHFFFAOYSA-N 0 0 399.432 3.110 20 5 GGBDRN O=C(CCc1nc(-c2ccccn2)no1)OCc1ccc([N+](=O)[O-])cc1Cl ZINC000180261462 1429817721 /nfs/dbraw/zinc/81/77/21/1429817721.db2.gz VKNBDWMDTMWFEJ-UHFFFAOYSA-N 0 0 388.767 3.369 20 5 GGBDRN CC(=O)N1CC[C@@H](CN(C)C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000180265673 1429818756 /nfs/dbraw/zinc/81/87/56/1429818756.db2.gz CAYCBLFXHOILBL-AWEZNQCLSA-N 0 0 379.482 3.036 20 5 GGBDRN CN(C(=O)CCOC[C@H]1CCCO1)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180284443 1429824672 /nfs/dbraw/zinc/82/46/72/1429824672.db2.gz NRMZQIQGHOIIEC-CYBMUJFWSA-N 0 0 391.449 3.267 20 5 GGBDRN CN(C(=O)CN1CCCCCC1=O)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180288561 1429825692 /nfs/dbraw/zinc/82/56/92/1429825692.db2.gz DPSWLBXJQFSQCM-UHFFFAOYSA-N 0 0 388.449 3.084 20 5 GGBDRN C[C@H](OC[C@H]1CCCO1)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180292793 1429827118 /nfs/dbraw/zinc/82/71/18/1429827118.db2.gz WUKIRGKGCDURMJ-QWHCGFSZSA-N 0 0 391.449 3.265 20 5 GGBDRN CN(C)c1ccc(C(=O)N(C)c2nc(-c3ccccc3[N+](=O)[O-])cs2)cn1 ZINC000180296445 1429828594 /nfs/dbraw/zinc/82/85/94/1429828594.db2.gz ORCPBECDWQNZBL-UHFFFAOYSA-N 0 0 383.433 3.456 20 5 GGBDRN Cc1cccnc1COC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000180317548 1429834863 /nfs/dbraw/zinc/83/48/63/1429834863.db2.gz MAVFQEYZCIDWHI-UHFFFAOYSA-N 0 0 398.156 3.260 20 5 GGBDRN Cc1c(NC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)cccc1[N+](=O)[O-] ZINC000180328981 1429837212 /nfs/dbraw/zinc/83/72/12/1429837212.db2.gz QTZLHQNJRGHYDJ-UHFFFAOYSA-N 0 0 376.434 3.267 20 5 GGBDRN COc1cc(CNc2cc(C(N)=O)ccc2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000180328734 1429837353 /nfs/dbraw/zinc/83/73/53/1429837353.db2.gz YDVRTZAJINVRRZ-UHFFFAOYSA-N 0 0 395.362 3.267 20 5 GGBDRN Cc1c(CC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)cccc1[N+](=O)[O-] ZINC000180361050 1429846199 /nfs/dbraw/zinc/84/61/99/1429846199.db2.gz KRUKGMDKPCUZTK-CQSZACIVSA-N 0 0 390.465 3.072 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC(n3c(CC)nc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000180361174 1429846245 /nfs/dbraw/zinc/84/62/45/1429846245.db2.gz YZHFBPSLELMGKI-UHFFFAOYSA-N 0 0 396.451 3.270 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1 ZINC000180371301 1429849135 /nfs/dbraw/zinc/84/91/35/1429849135.db2.gz HWHHOEVYFGUMGK-AWEZNQCLSA-N 0 0 376.438 3.143 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)cc([N+](=O)[O-])c1 ZINC000180373539 1429849461 /nfs/dbraw/zinc/84/94/61/1429849461.db2.gz ZZWHQTOHIULFAI-AWEZNQCLSA-N 0 0 376.438 3.143 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)Cc1cc(F)c(F)c(F)c1 ZINC000180380905 1429851705 /nfs/dbraw/zinc/85/17/05/1429851705.db2.gz CETWIAHRYHIBAM-UHFFFAOYSA-N 0 0 383.326 3.362 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180394312 1429855682 /nfs/dbraw/zinc/85/56/82/1429855682.db2.gz BBESMKLNTVHWDQ-HOTGVXAUSA-N 0 0 398.463 3.006 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000180395375 1429856304 /nfs/dbraw/zinc/85/63/04/1429856304.db2.gz ICNXFKZGWZYJJR-ZDUSSCGKSA-N 0 0 389.374 3.116 20 5 GGBDRN Cc1nn(C)c(=O)c(-c2nc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)cs2)c1C ZINC000180398155 1429856619 /nfs/dbraw/zinc/85/66/19/1429856619.db2.gz CQKPQAPCTNKVGZ-ZDUSSCGKSA-N 0 0 399.476 3.280 20 5 GGBDRN CCOC(=O)c1ccsc1NC(=O)CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180401750 1429858155 /nfs/dbraw/zinc/85/81/55/1429858155.db2.gz YWTDJYHLXRDSMI-LLVKDONJSA-N 0 0 377.422 3.122 20 5 GGBDRN Cc1nc(NCc2cccc(O)c2)nc(NCc2cccc(O)c2)c1[N+](=O)[O-] ZINC000180418402 1429863368 /nfs/dbraw/zinc/86/33/68/1429863368.db2.gz GUPFCQMIHAWXFM-UHFFFAOYSA-N 0 0 381.392 3.329 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1ccccc1NCC1CCCCC1 ZINC000180441403 1429870174 /nfs/dbraw/zinc/87/01/74/1429870174.db2.gz OIVMLUGYXOOVDN-UHFFFAOYSA-N 0 0 384.436 3.387 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000180450466 1429872056 /nfs/dbraw/zinc/87/20/56/1429872056.db2.gz BOTOIQDKYWLXDJ-LBPRGKRZSA-N 0 0 391.449 3.431 20 5 GGBDRN C[C@H](NCc1nnnn1-c1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000180453769 1429872962 /nfs/dbraw/zinc/87/29/62/1429872962.db2.gz OLTYCNLUIUHMPZ-NSHDSACASA-N 0 0 392.341 3.440 20 5 GGBDRN C[C@@H](NCc1nnnn1-c1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000180453871 1429873038 /nfs/dbraw/zinc/87/30/38/1429873038.db2.gz RACWTQUVKHFEFJ-LLVKDONJSA-N 0 0 390.350 3.023 20 5 GGBDRN COc1ccc(NC(=O)CN(Cc2ccco2)Cc2cccnc2)c([N+](=O)[O-])c1 ZINC000180463939 1429875218 /nfs/dbraw/zinc/87/52/18/1429875218.db2.gz XHRPSZGUBABSMQ-UHFFFAOYSA-N 0 0 396.403 3.232 20 5 GGBDRN CC(C)C(=O)N1CCC(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000180470604 1429877160 /nfs/dbraw/zinc/87/71/60/1429877160.db2.gz SLIJZCWSZIBFMU-UHFFFAOYSA-N 0 0 387.358 3.447 20 5 GGBDRN Cc1cccc(C2=CCN(C(=O)c3cn(-c4cccc([N+](=O)[O-])c4)nn3)CC2)c1 ZINC000180476684 1429878734 /nfs/dbraw/zinc/87/87/34/1429878734.db2.gz YPYGHVSWBWJICK-UHFFFAOYSA-N 0 0 389.415 3.413 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(CC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000180503909 1429884304 /nfs/dbraw/zinc/88/43/04/1429884304.db2.gz NRTDXHYFBOSKHM-AWEZNQCLSA-N 0 0 390.461 3.197 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(CC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000180503926 1429884327 /nfs/dbraw/zinc/88/43/27/1429884327.db2.gz NRTDXHYFBOSKHM-CQSZACIVSA-N 0 0 390.461 3.197 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccnc(OC2CCC2)c1 ZINC000180503504 1429884381 /nfs/dbraw/zinc/88/43/81/1429884381.db2.gz GAAPTVHMFHGFLX-UHFFFAOYSA-N 0 0 379.376 3.359 20 5 GGBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000180506591 1429885179 /nfs/dbraw/zinc/88/51/79/1429885179.db2.gz ZWCJXFBQXMQOAD-AWEZNQCLSA-N 0 0 377.832 3.364 20 5 GGBDRN CCOc1ccc(NC(=O)CN(C)Cc2cc(F)c(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000180512519 1429886803 /nfs/dbraw/zinc/88/68/03/1429886803.db2.gz OYURHEROVBKEIX-UHFFFAOYSA-N 0 0 397.353 3.481 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000180517647 1429887661 /nfs/dbraw/zinc/88/76/61/1429887661.db2.gz OIQJJYNAAZGWAI-OAQYLSRUSA-N 0 0 381.432 3.252 20 5 GGBDRN CC[C@H](C)N(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)[C@@H](C)CC ZINC000180520347 1429888732 /nfs/dbraw/zinc/88/87/32/1429888732.db2.gz LJXFRQPVVRSUMN-KBPBESRZSA-N 0 0 386.452 3.488 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)c1cccc(OCc2ccccn2)c1 ZINC000180539178 1429893142 /nfs/dbraw/zinc/89/31/42/1429893142.db2.gz XRRMEHJMFVLYFC-CYBMUJFWSA-N 0 0 393.403 3.037 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1 ZINC000180540202 1429893477 /nfs/dbraw/zinc/89/34/77/1429893477.db2.gz YSJHBBQQVZYKIT-UHFFFAOYSA-N 0 0 395.350 3.216 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2cn3c(n2)CCCC3)cc1 ZINC000180542434 1429893980 /nfs/dbraw/zinc/89/39/80/1429893980.db2.gz XYKYZFYXDKTFKD-UHFFFAOYSA-N 0 0 378.392 3.024 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1 ZINC000180552234 1429895960 /nfs/dbraw/zinc/89/59/60/1429895960.db2.gz AQWUNAFVWADSTA-UHFFFAOYSA-N 0 0 394.313 3.025 20 5 GGBDRN COC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(C(F)(F)F)cc1 ZINC000180585618 1429914493 /nfs/dbraw/zinc/91/44/93/1429914493.db2.gz NHYGYBJBRNNFOO-NSHDSACASA-N 0 0 386.282 3.241 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000180590470 1429916178 /nfs/dbraw/zinc/91/61/78/1429916178.db2.gz WQIPLVCHDVHUFV-UHFFFAOYSA-N 0 0 394.353 3.158 20 5 GGBDRN O=C(CNc1c(F)cc(Cl)cc1F)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000180593161 1429919511 /nfs/dbraw/zinc/91/95/11/1429919511.db2.gz VAVTXKGQSKIMBL-UHFFFAOYSA-N 0 0 385.710 3.306 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCN(Cc2cccc3ccccc32)CC1 ZINC000180602372 1429926798 /nfs/dbraw/zinc/92/67/98/1429926798.db2.gz QNTJMJWBLJHVKN-UHFFFAOYSA-N 0 0 390.443 3.288 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2c[nH]nc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000180604451 1429928458 /nfs/dbraw/zinc/92/84/58/1429928458.db2.gz YAIQPKYNZCWGOT-ZDUSSCGKSA-N 0 0 393.403 3.109 20 5 GGBDRN COc1ccccc1CCCN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000180605165 1429928624 /nfs/dbraw/zinc/92/86/24/1429928624.db2.gz YLOJTCUMIJOXJV-FQEVSTJZSA-N 0 0 383.404 3.003 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccn1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000180607176 1429930604 /nfs/dbraw/zinc/93/06/04/1429930604.db2.gz MFSMDRMHGMOFDD-UHFFFAOYSA-N 0 0 378.266 3.102 20 5 GGBDRN Cc1nc([C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)c2ccc(Cl)cc2)no1 ZINC000180616981 1429935587 /nfs/dbraw/zinc/93/55/87/1429935587.db2.gz ZHAZNHRSLUZPNO-QGZVFWFLSA-N 0 0 386.795 3.388 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000180616906 1429935635 /nfs/dbraw/zinc/93/56/35/1429935635.db2.gz XDHBGOWYYOQRIU-QAPCUYQASA-N 0 0 379.457 3.386 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000180621135 1429937183 /nfs/dbraw/zinc/93/71/83/1429937183.db2.gz WGWJDLIMWMOOTA-IAGOWNOFSA-N 0 0 377.347 3.202 20 5 GGBDRN O=C(CCNC(=O)c1cccs1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180621536 1429937815 /nfs/dbraw/zinc/93/78/15/1429937815.db2.gz VJUZTFOWNORDBC-UHFFFAOYSA-N 0 0 398.238 3.177 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1cccc(-n2cccn2)n1 ZINC000180622401 1429937881 /nfs/dbraw/zinc/93/78/81/1429937881.db2.gz AMHOHZNIQJUILY-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000180627168 1429940315 /nfs/dbraw/zinc/94/03/15/1429940315.db2.gz BRLPQSXHYQZRKD-VHSXEESVSA-N 0 0 385.214 3.275 20 5 GGBDRN COC(=O)[C@H]1CCC[C@H](C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000180627183 1429940460 /nfs/dbraw/zinc/94/04/60/1429940460.db2.gz BRLPQSXHYQZRKD-UWVGGRQHSA-N 0 0 385.214 3.275 20 5 GGBDRN COC(=O)[C@H]1CCC[C@@H](C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000180627220 1429941255 /nfs/dbraw/zinc/94/12/55/1429941255.db2.gz BRLPQSXHYQZRKD-ZJUUUORDSA-N 0 0 385.214 3.275 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 ZINC000180628774 1429942582 /nfs/dbraw/zinc/94/25/82/1429942582.db2.gz JEWYLNRBAVNEQG-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000180646261 1429952565 /nfs/dbraw/zinc/95/25/65/1429952565.db2.gz YJRMLZLLNJBNAW-UHFFFAOYSA-N 0 0 397.431 3.190 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N[C@@H]2CC23CCCCC3)ccc1[N+](=O)[O-] ZINC000180652708 1429957352 /nfs/dbraw/zinc/95/73/52/1429957352.db2.gz JLHBKFAQXSQGJR-QZTJIDSGSA-N 0 0 385.464 3.347 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F ZINC000180689931 1429978680 /nfs/dbraw/zinc/97/86/80/1429978680.db2.gz QWUOMJVZDCQSGL-LBPRGKRZSA-N 0 0 375.347 3.325 20 5 GGBDRN Cc1ccc(S(=O)(=O)CCCn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000180693027 1429980257 /nfs/dbraw/zinc/98/02/57/1429980257.db2.gz WRYZQLIIUMXZLK-UHFFFAOYSA-N 0 0 386.433 3.026 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(c2ccc(Cl)cc2)CCOCC1 ZINC000180702833 1429986653 /nfs/dbraw/zinc/98/66/53/1429986653.db2.gz LJQUQMHQNHAJOI-UHFFFAOYSA-N 0 0 389.839 3.309 20 5 GGBDRN Cc1nc(Br)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000180705055 1429988229 /nfs/dbraw/zinc/98/82/29/1429988229.db2.gz MLOZRHAUKCTIEA-UHFFFAOYSA-N 0 0 380.198 3.468 20 5 GGBDRN Cc1cc(S(=O)(=O)[N-]c2cccc3c2CN(C(C)C)C3)ccc1[N+](=O)[O-] ZINC000180715127 1429995685 /nfs/dbraw/zinc/99/56/85/1429995685.db2.gz FPUUDKQLMFEQKY-UHFFFAOYSA-N 0 0 375.450 3.428 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000180718682 1429998019 /nfs/dbraw/zinc/99/80/19/1429998019.db2.gz HPFSPUKXLKPJMG-HNNXBMFYSA-N 0 0 395.337 3.410 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccccc1N1CCCCC1 ZINC000180756877 1430020964 /nfs/dbraw/zinc/02/09/64/1430020964.db2.gz LLERXCCXLDRTAH-UHFFFAOYSA-N 0 0 396.447 3.148 20 5 GGBDRN Cc1cc(F)ccc1-n1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)n1 ZINC000180757454 1430021657 /nfs/dbraw/zinc/02/16/57/1430021657.db2.gz PSYRMRJDPZYOND-UHFFFAOYSA-N 0 0 380.339 3.357 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180762873 1430024964 /nfs/dbraw/zinc/02/49/64/1430024964.db2.gz KRAHLZONBIYARZ-UHFFFAOYSA-N 0 0 393.224 3.156 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000180764773 1430026562 /nfs/dbraw/zinc/02/65/62/1430026562.db2.gz PFRWCFNSCVFDEE-LBPRGKRZSA-N 0 0 397.357 3.086 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(-c2ccc3c(c2)CCO3)cs1 ZINC000180766177 1430027217 /nfs/dbraw/zinc/02/72/17/1430027217.db2.gz RGDYTCSQWHWIHJ-UHFFFAOYSA-N 0 0 382.401 3.488 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180774362 1430031458 /nfs/dbraw/zinc/03/14/58/1430031458.db2.gz UTAADCWKEBODNX-BLLLJJGKSA-N 0 0 397.859 3.287 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCO1 ZINC000180776338 1430032847 /nfs/dbraw/zinc/03/28/47/1430032847.db2.gz HHIIZRHOKCATHK-CZUORRHYSA-N 0 0 397.859 3.287 20 5 GGBDRN CN(CC(=O)Nc1ccc(F)cc1OCC(F)F)c1ccccc1[N+](=O)[O-] ZINC000180790220 1430041627 /nfs/dbraw/zinc/04/16/27/1430041627.db2.gz PKKJCQNMXITRSS-UHFFFAOYSA-N 0 0 383.326 3.453 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 ZINC000180795988 1430045117 /nfs/dbraw/zinc/04/51/17/1430045117.db2.gz IOTUYGUQPPNHGW-SFHVURJKSA-N 0 0 389.839 3.416 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1c2c(nn1-c1ccccc1)CCC2 ZINC000180805272 1430050956 /nfs/dbraw/zinc/05/09/56/1430050956.db2.gz CYBJUUHSZANELN-UHFFFAOYSA-N 0 0 398.444 3.211 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1 ZINC000180815871 1430055957 /nfs/dbraw/zinc/05/59/57/1430055957.db2.gz KMZRNVQLWARZBF-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1cc(CC2CCCCC2)n[nH]1 ZINC000180819382 1430056489 /nfs/dbraw/zinc/05/64/89/1430056489.db2.gz VLUKLTCEIXPIFC-UHFFFAOYSA-N 0 0 378.454 3.383 20 5 GGBDRN CO[C@@H](C)CCC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000180820687 1430057349 /nfs/dbraw/zinc/05/73/49/1430057349.db2.gz CSEFWYNWJVVPEV-LBPRGKRZSA-N 0 0 389.374 3.077 20 5 GGBDRN O=C(CN1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1)Nc1ccccc1F ZINC000180830116 1430061174 /nfs/dbraw/zinc/06/11/74/1430061174.db2.gz MBGPLRARUGAMGT-FNORWQNLSA-N 0 0 398.438 3.003 20 5 GGBDRN C[C@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccc(-n2cccn2)cc1 ZINC000180834813 1430062951 /nfs/dbraw/zinc/06/29/51/1430062951.db2.gz YSUMMUFHYOGHNB-HNNXBMFYSA-N 0 0 391.431 3.020 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(Oc2nncc3ccccc32)cc1 ZINC000180854102 1430071360 /nfs/dbraw/zinc/07/13/60/1430071360.db2.gz ZEFHISWKTNGWMA-UHFFFAOYSA-N 0 0 390.359 3.316 20 5 GGBDRN O=C(c1ccccc1NCc1ccc([N+](=O)[O-])cc1Cl)N1CCOCC1 ZINC000180866989 1430077358 /nfs/dbraw/zinc/07/73/58/1430077358.db2.gz HLADGWZJAUALAL-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCn2cccc2[C@@H]1c1ccccc1 ZINC000180872027 1430080328 /nfs/dbraw/zinc/08/03/28/1430080328.db2.gz NOVLWPIXSSXPLQ-IBGZPJMESA-N 0 0 391.383 3.370 20 5 GGBDRN O=C1N[C@]2(CCc3ccccc3C2)C(=O)N1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000180875674 1430082191 /nfs/dbraw/zinc/08/21/91/1430082191.db2.gz DMWZJTZTSCAWNS-IBGZPJMESA-N 0 0 385.807 3.228 20 5 GGBDRN CC(=O)N(C)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC1 ZINC000180881219 1430086152 /nfs/dbraw/zinc/08/61/52/1430086152.db2.gz MKBMOMMFKLFICF-UHFFFAOYSA-N 0 0 379.482 3.178 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCCOc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000180884332 1430088148 /nfs/dbraw/zinc/08/81/48/1430088148.db2.gz XMMIFARNRRUFKR-HNNXBMFYSA-N 0 0 387.367 3.011 20 5 GGBDRN CC[C@H](C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(OC)cc1 ZINC000180885142 1430088924 /nfs/dbraw/zinc/08/89/24/1430088924.db2.gz ACRQJQOATLXANE-QAPCUYQASA-N 0 0 384.436 3.205 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCCOc2cc(Cl)ccc21 ZINC000180888301 1430091063 /nfs/dbraw/zinc/09/10/63/1430091063.db2.gz FCVUKYDNWULMSO-HNNXBMFYSA-N 0 0 389.795 3.217 20 5 GGBDRN O=C(N[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000180902877 1430099356 /nfs/dbraw/zinc/09/93/56/1430099356.db2.gz AQXUWKXOYMLKTO-VIFPVBQESA-N 0 0 395.749 3.062 20 5 GGBDRN CCn1c2ccc(Cl)cc2nc1NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000180904736 1430099848 /nfs/dbraw/zinc/09/98/48/1430099848.db2.gz ZKFLRWHDYRJZBH-UHFFFAOYSA-N 0 0 390.831 3.460 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(C)n(-c3ccc(F)cc3)n2)cc([N+](=O)[O-])c1 ZINC000180921421 1430116492 /nfs/dbraw/zinc/11/64/92/1430116492.db2.gz QNJJJJYOMDKDBR-UHFFFAOYSA-N 0 0 398.350 3.267 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000180947469 1430129326 /nfs/dbraw/zinc/12/93/26/1430129326.db2.gz PATFKIOLBSISGV-GFCCVEGCSA-N 0 0 385.811 3.133 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)cc1[N+](=O)[O-] ZINC000180954946 1430133486 /nfs/dbraw/zinc/13/34/86/1430133486.db2.gz HZRANIQWDXHSSV-CQSZACIVSA-N 0 0 385.445 3.131 20 5 GGBDRN COc1cccc(C(=O)NCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)c1 ZINC000180971004 1430143426 /nfs/dbraw/zinc/14/34/26/1430143426.db2.gz ONDAJWTVGLXIMR-UHFFFAOYSA-N 0 0 381.335 3.047 20 5 GGBDRN C[C@@H](CCO)N(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000180977527 1430148289 /nfs/dbraw/zinc/14/82/89/1430148289.db2.gz LYEOMJFFVCWIKE-HNNXBMFYSA-N 0 0 382.420 3.418 20 5 GGBDRN C[C@@H](CCO)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000180980135 1430149650 /nfs/dbraw/zinc/14/96/50/1430149650.db2.gz UYOYKVUGLRRKQM-AWEZNQCLSA-N 0 0 391.855 3.460 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000180982098 1430150191 /nfs/dbraw/zinc/15/01/91/1430150191.db2.gz RTUWHOJJVJDLAG-SNVBAGLBSA-N 0 0 384.358 3.390 20 5 GGBDRN C[C@H](CCO)N(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1 ZINC000180984840 1430152497 /nfs/dbraw/zinc/15/24/97/1430152497.db2.gz GMTJTMBRBDJFKJ-OAHLLOKOSA-N 0 0 382.420 3.418 20 5 GGBDRN CCOCc1ccc(CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000180987472 1430153868 /nfs/dbraw/zinc/15/38/68/1430153868.db2.gz HGAHZQAYBRHRCM-UHFFFAOYSA-N 0 0 385.420 3.003 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1N(C)C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000180993064 1430156657 /nfs/dbraw/zinc/15/66/57/1430156657.db2.gz KETNZERMJNWDBP-AWEZNQCLSA-N 0 0 385.342 3.193 20 5 GGBDRN CCOc1cc(N2CC[NH+](CCCOCC(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000180996781 1430158722 /nfs/dbraw/zinc/15/87/22/1430158722.db2.gz TYRBEGBOIUZDEX-UHFFFAOYSA-N 0 0 391.390 3.085 20 5 GGBDRN CCCNC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000180999509 1430159927 /nfs/dbraw/zinc/15/99/27/1430159927.db2.gz ZHRKYCCMZPZQGC-AWEZNQCLSA-N 0 0 393.509 3.474 20 5 GGBDRN C[C@@H](O)[C@H]1CCN(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000181004921 1430162830 /nfs/dbraw/zinc/16/28/30/1430162830.db2.gz NNYFJFIRDZERSM-LZWOXQAQSA-N 0 0 384.436 3.006 20 5 GGBDRN C[C@@H](O)[C@@H]1CCN(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000181004961 1430163151 /nfs/dbraw/zinc/16/31/51/1430163151.db2.gz NNYFJFIRDZERSM-SQWLQELKSA-N 0 0 384.436 3.006 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NC3CCC(CO)CC3)cc2[N+](=O)[O-])C1 ZINC000181008845 1430164083 /nfs/dbraw/zinc/16/40/83/1430164083.db2.gz JTDVLPWQDAVFMB-WMTDPASSSA-N 0 0 389.496 3.358 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)cc2[N+](=O)[O-])n1 ZINC000181012873 1430166365 /nfs/dbraw/zinc/16/63/65/1430166365.db2.gz RFXZGNSMLBVTCI-DGCLKSJQSA-N 0 0 393.490 3.354 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1 ZINC000181022869 1430171994 /nfs/dbraw/zinc/17/19/94/1430171994.db2.gz UUUJMENMQYVPET-HNNXBMFYSA-N 0 0 379.775 3.183 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000181023184 1430172012 /nfs/dbraw/zinc/17/20/12/1430172012.db2.gz CZQHRINHMVQIBY-SNVBAGLBSA-N 0 0 384.358 3.390 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000181025615 1430173573 /nfs/dbraw/zinc/17/35/73/1430173573.db2.gz FAEMUILEUQGQRG-BBRMVZONSA-N 0 0 379.775 3.230 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000181036095 1430179374 /nfs/dbraw/zinc/17/93/74/1430179374.db2.gz DGFRVIQYPOUYSE-CRAIPNDOSA-N 0 0 393.802 3.446 20 5 GGBDRN CCOCCN(C)[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000181039813 1430181672 /nfs/dbraw/zinc/18/16/72/1430181672.db2.gz XTXWLLXIMIBLFD-LBPRGKRZSA-N 0 0 378.454 3.014 20 5 GGBDRN O=C(Cc1cccc(F)c1F)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000181054533 1430188737 /nfs/dbraw/zinc/18/87/37/1430188737.db2.gz FFZHOJVBBLIQDQ-UHFFFAOYSA-N 0 0 398.749 3.042 20 5 GGBDRN CCOC(=O)c1nn(-c2ccccc2)cc1CNCc1ccc([N+](=O)[O-])cc1 ZINC000181063499 1430193988 /nfs/dbraw/zinc/19/39/88/1430193988.db2.gz DJGBUIMJVZASQT-UHFFFAOYSA-N 0 0 380.404 3.247 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nc3c(s2)C[C@@H](C(C)(C)C)CC3)c1[N+](=O)[O-] ZINC000181092733 1430207396 /nfs/dbraw/zinc/20/73/96/1430207396.db2.gz IJZKBJTWGTXDIN-JTQLQIEISA-N 0 0 377.470 3.497 20 5 GGBDRN COC[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181143504 1430225301 /nfs/dbraw/zinc/22/53/01/1430225301.db2.gz GFRUBPQKHGKFDP-MRXNPFEDSA-N 0 0 379.363 3.179 20 5 GGBDRN Cc1cccc(C2=CCN(C(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000181149363 1430227153 /nfs/dbraw/zinc/22/71/53/1430227153.db2.gz UOCPUQWSHCHWFK-UHFFFAOYSA-N 0 0 379.416 3.466 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCO[C@@H](Cc2ccccc2)C1 ZINC000181167705 1430234706 /nfs/dbraw/zinc/23/47/06/1430234706.db2.gz CJIWSECTPYIONU-INIZCTEOSA-N 0 0 377.400 3.227 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCO[C@H](Cc2ccccc2)C1 ZINC000181167689 1430234925 /nfs/dbraw/zinc/23/49/25/1430234925.db2.gz CJIWSECTPYIONU-MRXNPFEDSA-N 0 0 377.400 3.227 20 5 GGBDRN C[C@H](c1nc2ccccc2o1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000181177491 1430239068 /nfs/dbraw/zinc/23/90/68/1430239068.db2.gz FZGTWFRWSBDQOX-CQSZACIVSA-N 0 0 380.404 3.255 20 5 GGBDRN O=C(NCCCc1nc2c(s1)CCCC2)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181188211 1430242282 /nfs/dbraw/zinc/24/22/82/1430242282.db2.gz KPSWZVUIAIXQEY-UHFFFAOYSA-N 0 0 389.433 3.021 20 5 GGBDRN CN(C)C(=O)CC1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000181193867 1430244691 /nfs/dbraw/zinc/24/46/91/1430244691.db2.gz KEZHRCOJQHFABI-UHFFFAOYSA-N 0 0 375.469 3.223 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2)CC1 ZINC000181251587 1430256966 /nfs/dbraw/zinc/25/69/66/1430256966.db2.gz BHVQNIOAPSOQOR-UHFFFAOYSA-N 0 0 394.353 3.158 20 5 GGBDRN Cc1cc(NC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000181272044 1430260607 /nfs/dbraw/zinc/26/06/07/1430260607.db2.gz YUSVUCGXZLHLBI-UHFFFAOYSA-N 0 0 376.434 3.267 20 5 GGBDRN Cc1nc([C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)c2ccc(Cl)cc2)no1 ZINC000181282072 1430262226 /nfs/dbraw/zinc/26/22/26/1430262226.db2.gz RSRVNRZOKNEMRW-OAHLLOKOSA-N 0 0 387.783 3.041 20 5 GGBDRN C[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccc(-n2cccn2)cc1 ZINC000181283252 1430262393 /nfs/dbraw/zinc/26/23/93/1430262393.db2.gz PJUARCUDBOOZED-LBPRGKRZSA-N 0 0 380.360 3.000 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1-n1ccnn1 ZINC000181304542 1430268158 /nfs/dbraw/zinc/26/81/58/1430268158.db2.gz QMGFATRGXZVSJG-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000181311087 1430270020 /nfs/dbraw/zinc/27/00/20/1430270020.db2.gz CWYRUBIMGXIELA-XJKSGUPXSA-N 0 0 379.775 3.230 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000181311125 1430270053 /nfs/dbraw/zinc/27/00/53/1430270053.db2.gz CWYRUBIMGXIELA-BBRMVZONSA-N 0 0 379.775 3.230 20 5 GGBDRN O=C(CN1CCCCCCC1=O)O[C@@H](c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000181332336 1430275151 /nfs/dbraw/zinc/27/51/51/1430275151.db2.gz AUSSJSCARKMEEZ-NRFANRHFSA-N 0 0 397.431 3.415 20 5 GGBDRN CN(CCC1CCCCC1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000181347515 1430279117 /nfs/dbraw/zinc/27/91/17/1430279117.db2.gz VRSJULOKIJQJGB-UHFFFAOYSA-N 0 0 375.469 3.474 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2F)CC1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181369048 1430283026 /nfs/dbraw/zinc/28/30/26/1430283026.db2.gz VSEXXTAPMKZODW-UHFFFAOYSA-N 0 0 376.315 3.063 20 5 GGBDRN O=C(N[C@@H]1CCCOc2cc(F)ccc21)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000181396995 1430288435 /nfs/dbraw/zinc/28/84/35/1430288435.db2.gz MCELKOXYGZOYEG-MRXNPFEDSA-N 0 0 397.362 3.219 20 5 GGBDRN O=C(N[C@H]1CCCOc2cc(F)ccc21)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000181397016 1430288451 /nfs/dbraw/zinc/28/84/51/1430288451.db2.gz MCELKOXYGZOYEG-INIZCTEOSA-N 0 0 397.362 3.219 20 5 GGBDRN O=C(Nc1ccc(-c2ncon2)cc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181410564 1430290752 /nfs/dbraw/zinc/29/07/52/1430290752.db2.gz IUYYJHGZURRMBR-UHFFFAOYSA-N 0 0 376.275 3.499 20 5 GGBDRN Cc1ccc(Cn2nccc2NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1 ZINC000181424297 1430295515 /nfs/dbraw/zinc/29/55/15/1430295515.db2.gz MFKQKDJINWPPGI-UHFFFAOYSA-N 0 0 380.360 3.129 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000181427474 1430296485 /nfs/dbraw/zinc/29/64/85/1430296485.db2.gz RZDSMUCQLVDRIG-UHFFFAOYSA-N 0 0 397.840 3.364 20 5 GGBDRN COC[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc(F)c(F)c1 ZINC000181434926 1430298279 /nfs/dbraw/zinc/29/82/79/1430298279.db2.gz DUJYQLPFHAQKGM-MRXNPFEDSA-N 0 0 390.346 3.400 20 5 GGBDRN O=C(Nc1ncccc1-c1ccccc1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000181434821 1430298284 /nfs/dbraw/zinc/29/82/84/1430298284.db2.gz KMCHMDFVJASBBO-UHFFFAOYSA-N 0 0 386.371 3.490 20 5 GGBDRN C[C@@H]([NH2+][C@H](C)c1cccc(N2CCCC2=O)c1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000181441225 1430299765 /nfs/dbraw/zinc/29/97/65/1430299765.db2.gz MJPSPDKSXHWXGD-HUUCEWRRSA-N 0 0 396.447 3.399 20 5 GGBDRN COC[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(F)c(F)c1 ZINC000181443234 1430300527 /nfs/dbraw/zinc/30/05/27/1430300527.db2.gz OCDRQLKCCUPPHT-GOSISDBHSA-N 0 0 393.390 3.487 20 5 GGBDRN Cc1ccccc1Cn1c(NC(=O)c2n[nH]cc2[N+](=O)[O-])nc2ccccc21 ZINC000181448048 1430301814 /nfs/dbraw/zinc/30/18/14/1430301814.db2.gz JWGIDOQKZKETSM-UHFFFAOYSA-N 0 0 376.376 3.277 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(n3ccc(C(F)(F)F)n3)CC2)c1 ZINC000181450036 1430302413 /nfs/dbraw/zinc/30/24/13/1430302413.db2.gz FHQKEEQNWTZSQW-UHFFFAOYSA-N 0 0 398.341 3.296 20 5 GGBDRN CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000181455049 1430303419 /nfs/dbraw/zinc/30/34/19/1430303419.db2.gz KMDXRRVNMBGFNT-UHFFFAOYSA-N 0 0 384.436 3.074 20 5 GGBDRN CCn1c(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])nc2cc(F)ccc21 ZINC000181483775 1430308394 /nfs/dbraw/zinc/30/83/94/1430308394.db2.gz XAGWXKZHTDHOSI-UHFFFAOYSA-N 0 0 388.355 3.373 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000181488036 1430308978 /nfs/dbraw/zinc/30/89/78/1430308978.db2.gz LWDNLDMRKURMFB-UHFFFAOYSA-N 0 0 382.342 3.216 20 5 GGBDRN COc1ccc(C(=O)N2CCC(n3ccc(C(F)(F)F)n3)CC2)cc1[N+](=O)[O-] ZINC000181487171 1430309151 /nfs/dbraw/zinc/30/91/51/1430309151.db2.gz DEKFCHUOBJCXMW-UHFFFAOYSA-N 0 0 398.341 3.296 20 5 GGBDRN C[C@H](NC(=O)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1)c1cccc([N+](=O)[O-])c1 ZINC000181493945 1430309999 /nfs/dbraw/zinc/30/99/99/1430309999.db2.gz CICKSUMGDISIIC-SWLSCSKDSA-N 0 0 384.440 3.241 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)c1ccncc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181513918 1430313521 /nfs/dbraw/zinc/31/35/21/1430313521.db2.gz HNENZLGDJHCCAR-SFHVURJKSA-N 0 0 377.356 3.238 20 5 GGBDRN CO[C@H](C)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)c(F)c1 ZINC000181544987 1430318027 /nfs/dbraw/zinc/31/80/27/1430318027.db2.gz FNERRXWDGNOWPF-LLVKDONJSA-N 0 0 386.376 3.103 20 5 GGBDRN O=C(CN1CCO[C@@H](Cc2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000181547453 1430318647 /nfs/dbraw/zinc/31/86/47/1430318647.db2.gz LSYPVYDQQXPSRS-INIZCTEOSA-N 0 0 389.839 3.130 20 5 GGBDRN O=C(N[C@@H](c1nccs1)c1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181547812 1430318654 /nfs/dbraw/zinc/31/86/54/1430318654.db2.gz IHXJQLPNDOSDLN-OAHLLOKOSA-N 0 0 383.385 3.299 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@@H](Cc4ccccc4)C3)n2)cc1 ZINC000181564651 1430320998 /nfs/dbraw/zinc/32/09/98/1430320998.db2.gz RCUWTMFTXGPAOV-SFHVURJKSA-N 0 0 380.404 3.088 20 5 GGBDRN O=C(N[C@H]1COc2ccccc2C1=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181569955 1430321568 /nfs/dbraw/zinc/32/15/68/1430321568.db2.gz OEXBSVDGTOBBLT-AWEZNQCLSA-N 0 0 395.396 3.092 20 5 GGBDRN O=C(c1ccc(F)cn1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000181576072 1430322632 /nfs/dbraw/zinc/32/26/32/1430322632.db2.gz AGNCWZIIYRRYBX-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN O=C(NCCCCNc1ccccn1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181583787 1430323502 /nfs/dbraw/zinc/32/35/02/1430323502.db2.gz BWZGGBRQUKXBMZ-UHFFFAOYSA-N 0 0 380.351 3.213 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCCCN1CCCCCC1=O ZINC000181619952 1430329352 /nfs/dbraw/zinc/32/93/52/1430329352.db2.gz BSDLXHPNOBVFPA-UHFFFAOYSA-N 0 0 399.900 3.249 20 5 GGBDRN COc1ccc(NC(=O)CN[C@H](c2nc(C)cs2)C2CC2)c([N+](=O)[O-])c1 ZINC000181625512 1430329955 /nfs/dbraw/zinc/32/99/55/1430329955.db2.gz JKQAQHFZNUSSFK-INIZCTEOSA-N 0 0 376.438 3.048 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCCc1nc(-c2ccc(F)cc2)no1 ZINC000181633235 1430331564 /nfs/dbraw/zinc/33/15/64/1430331564.db2.gz OBNVERDMTXMIGG-UHFFFAOYSA-N 0 0 398.394 3.466 20 5 GGBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181640469 1430333046 /nfs/dbraw/zinc/33/30/46/1430333046.db2.gz HCUUYPLXMBJDNV-NSHDSACASA-N 0 0 382.376 3.184 20 5 GGBDRN Cc1c(CC(=O)NCCCc2nc(-c3ccc(F)cc3)no2)cccc1[N+](=O)[O-] ZINC000181641906 1430333406 /nfs/dbraw/zinc/33/34/06/1430333406.db2.gz JQTQZIKPGNOUQP-UHFFFAOYSA-N 0 0 398.394 3.384 20 5 GGBDRN Cc1cccn2cc(CNC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)nc12 ZINC000181657962 1430336274 /nfs/dbraw/zinc/33/62/74/1430336274.db2.gz VDYMWQCWAMTRQN-UHFFFAOYSA-N 0 0 376.319 3.082 20 5 GGBDRN O=C(NC[C@@H]1CCOc2ccccc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181672541 1430339157 /nfs/dbraw/zinc/33/91/57/1430339157.db2.gz COXIFPBUDMIAKA-NSHDSACASA-N 0 0 378.331 3.492 20 5 GGBDRN CCCc1nnc(NCc2cc(OC)c(OCC(F)(F)F)cc2[N+](=O)[O-])o1 ZINC000181676068 1430340007 /nfs/dbraw/zinc/34/00/07/1430340007.db2.gz ABQHITZARCVIDT-UHFFFAOYSA-N 0 0 390.318 3.492 20 5 GGBDRN COc1cc(C(=O)NCc2cn(-c3ccccc3)nc2C)c([N+](=O)[O-])cc1OC ZINC000181697419 1430343323 /nfs/dbraw/zinc/34/33/23/1430343323.db2.gz OJXWWQBVYQMCMN-UHFFFAOYSA-N 0 0 396.403 3.036 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000181699200 1430343597 /nfs/dbraw/zinc/34/35/97/1430343597.db2.gz LYKLSJMLWLYYTJ-JTQLQIEISA-N 0 0 391.840 3.260 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000181718568 1430346817 /nfs/dbraw/zinc/34/68/17/1430346817.db2.gz SOGUBIBCWUZXFR-UHFFFAOYSA-N 0 0 390.321 3.470 20 5 GGBDRN COc1ccc(OCCn2nc(C(F)(F)F)c3cnccc32)c([N+](=O)[O-])c1 ZINC000181721900 1430347483 /nfs/dbraw/zinc/34/74/83/1430347483.db2.gz CTCRKIKKONEPNL-UHFFFAOYSA-N 0 0 382.298 3.446 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181722559 1430347808 /nfs/dbraw/zinc/34/78/08/1430347808.db2.gz VHDFBCHDTABXFG-SFHVURJKSA-N 0 0 390.461 3.214 20 5 GGBDRN CC(C)S(=O)(=O)N(CCOc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000181724917 1430348302 /nfs/dbraw/zinc/34/83/02/1430348302.db2.gz RRXQYBVZNPUKED-UHFFFAOYSA-N 0 0 382.413 3.358 20 5 GGBDRN Cc1nscc1C(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000181733278 1430349839 /nfs/dbraw/zinc/34/98/39/1430349839.db2.gz XTZZZBPROLQTFR-CQSZACIVSA-N 0 0 377.422 3.173 20 5 GGBDRN CC[C@@H](C)Oc1cc(C)ccc1CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O ZINC000181750300 1430352369 /nfs/dbraw/zinc/35/23/69/1430352369.db2.gz TWTIGTLRRPHOPR-CYBMUJFWSA-N 0 0 393.465 3.340 20 5 GGBDRN CCOC(=O)C[C@@H](C)N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000181750226 1430352375 /nfs/dbraw/zinc/35/23/75/1430352375.db2.gz DRXCYIPYYOZHML-LLVKDONJSA-N 0 0 377.422 3.132 20 5 GGBDRN CCOC(=O)C[C@@H](C)N(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181765247 1430355134 /nfs/dbraw/zinc/35/51/34/1430355134.db2.gz PAGUCUYBHHNQCX-LLVKDONJSA-N 0 0 377.422 3.132 20 5 GGBDRN C[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)c2ccccc2NC1=O ZINC000181766521 1430355399 /nfs/dbraw/zinc/35/53/99/1430355399.db2.gz IZVGTFWABQTIEY-GFCCVEGCSA-N 0 0 386.383 3.157 20 5 GGBDRN C[C@@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1cc2ccccc2o1 ZINC000181770163 1430356137 /nfs/dbraw/zinc/35/61/37/1430356137.db2.gz NSTYJWFVOLDFED-LLVKDONJSA-N 0 0 383.360 3.359 20 5 GGBDRN Cc1ccnn1-c1ccccc1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000181784291 1430359297 /nfs/dbraw/zinc/35/92/97/1430359297.db2.gz MYCVKTSHPRCDRT-UHFFFAOYSA-N 0 0 386.433 3.073 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000181784274 1430359456 /nfs/dbraw/zinc/35/94/56/1430359456.db2.gz XTQJXWSQTBZTGN-RKDXNWHRSA-N 0 0 376.335 3.038 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)C(=O)c1cc3c(c([N+](=O)[O-])c1)OCO3)CCC2 ZINC000181785992 1430359653 /nfs/dbraw/zinc/35/96/53/1430359653.db2.gz MOAQWKWMISCZLD-LBPRGKRZSA-N 0 0 375.406 3.238 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(=O)NC(C)(C)C ZINC000181789817 1430360587 /nfs/dbraw/zinc/36/05/87/1430360587.db2.gz PPPDCWZONLDQLF-QMMMGPOBSA-N 0 0 376.335 3.038 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(=O)NC(C)(C)C ZINC000181789837 1430360802 /nfs/dbraw/zinc/36/08/02/1430360802.db2.gz PPPDCWZONLDQLF-MRVPVSSYSA-N 0 0 376.335 3.038 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000181799095 1430362862 /nfs/dbraw/zinc/36/28/62/1430362862.db2.gz SPVOZTULNXQAAC-AWEZNQCLSA-N 0 0 395.749 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O=[N+]([O-])c1ccccc1OC[C@@H](O)CSc1n[nH]c(-c2ccccc2F)n1 ZINC000182181025 1430425356 /nfs/dbraw/zinc/42/53/56/1430425356.db2.gz ICDZAECYYPGJDA-LLVKDONJSA-N 0 0 390.396 3.051 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CC=C(c3ccc(F)cc3)CC2)cc1 ZINC000182192837 1430427690 /nfs/dbraw/zinc/42/76/90/1430427690.db2.gz KTFCWXJBRTVVDW-UHFFFAOYSA-N 0 0 390.436 3.297 20 5 GGBDRN CN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1nc2ccccc2s1 ZINC000182198661 1430428374 /nfs/dbraw/zinc/42/83/74/1430428374.db2.gz IMJSAPBCAMPMBP-UHFFFAOYSA-N 0 0 391.474 3.110 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN(Cc2ccco2)Cc2ccco2)cc1 ZINC000182198302 1430428387 /nfs/dbraw/zinc/42/83/87/1430428387.db2.gz LEZUFEFQLWWOTI-UHFFFAOYSA-N 0 0 390.417 3.257 20 5 GGBDRN CC(C)(C)OCC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000182216264 1430431203 /nfs/dbraw/zinc/43/12/03/1430431203.db2.gz RINUMYHHAOGJKL-UHFFFAOYSA-N 0 0 389.374 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000182218908 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ZINC000182749274 1430532866 /nfs/dbraw/zinc/53/28/66/1430532866.db2.gz SLMUUEKVTARZJF-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000182759002 1430535066 /nfs/dbraw/zinc/53/50/66/1430535066.db2.gz CPBKEUONGOIFLD-HNNXBMFYSA-N 0 0 390.827 3.404 20 5 GGBDRN COc1ccc(NC(=O)CNc2cc(C)n(-c3cccc(F)c3)n2)c([N+](=O)[O-])c1 ZINC000182762647 1430535616 /nfs/dbraw/zinc/53/56/16/1430535616.db2.gz CAOBWWKZDMNUQU-UHFFFAOYSA-N 0 0 399.382 3.287 20 5 GGBDRN Cc1cc(NC(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000182764176 1430535974 /nfs/dbraw/zinc/53/59/74/1430535974.db2.gz ZQSOFVBMAXMHID-BFYDXBDKSA-N 0 0 376.457 3.009 20 5 GGBDRN CC1([C@@H]2CCCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)C2)OCCO1 ZINC000182766497 1430536006 /nfs/dbraw/zinc/53/60/06/1430536006.db2.gz GCIOBCOOQLYEAO-QGZVFWFLSA-N 0 0 391.468 3.102 20 5 GGBDRN O=C(CN1CCc2ccc([N+](=O)[O-])cc21)N[C@H](c1nccs1)c1ccccc1 ZINC000182769216 1430536324 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ZINC000182854006 1430554065 /nfs/dbraw/zinc/55/40/65/1430554065.db2.gz YURIQYOPESWZEN-UHFFFAOYSA-N 0 0 385.464 3.130 20 5 GGBDRN CC(C)(O)CN(Cc1ccccc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000182858398 1430555238 /nfs/dbraw/zinc/55/52/38/1430555238.db2.gz NJLNNINNKXHAKF-UHFFFAOYSA-N 0 0 394.431 3.194 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCSc2ccc(F)cc2)C1=O ZINC000182860761 1430555628 /nfs/dbraw/zinc/55/56/28/1430555628.db2.gz JBSJBLBAWHSWSC-GOSISDBHSA-N 0 0 389.408 3.293 20 5 GGBDRN O=C(Nc1ccc(O)c(Cl)c1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000182862065 1430556019 /nfs/dbraw/zinc/55/60/19/1430556019.db2.gz SUZUTQNLPJIBHQ-NSHDSACASA-N 0 0 395.824 3.259 20 5 GGBDRN C[C@H](C(=O)N[C@@H](C[S@](C)=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000182870550 1430557675 /nfs/dbraw/zinc/55/76/75/1430557675.db2.gz QBTRQJRSQFBUCN-HSSRKPKSSA-N 0 0 378.425 3.073 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)cc1[N+](=O)[O-] ZINC000182880502 1430561063 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ZINC000183234994 1430655333 /nfs/dbraw/zinc/65/53/33/1430655333.db2.gz YOAUVMTVVYFQBM-INIZCTEOSA-N 0 0 388.445 3.329 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183234236 1430655513 /nfs/dbraw/zinc/65/55/13/1430655513.db2.gz CEXAJOUARCNNFZ-AWEZNQCLSA-N 0 0 387.411 3.002 20 5 GGBDRN C[C@H](C(=O)NCc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183240479 1430657550 /nfs/dbraw/zinc/65/75/50/1430657550.db2.gz OJXVQSFCKXENQA-LBPRGKRZSA-N 0 0 386.358 3.479 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000183240397 1430657772 /nfs/dbraw/zinc/65/77/72/1430657772.db2.gz NZWLDQVTWFSIKG-INIZCTEOSA-N 0 0 388.445 3.329 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1CC(=O)c1cccs1 ZINC000183245940 1430658394 /nfs/dbraw/zinc/65/83/94/1430658394.db2.gz VHHLWBFLSQRCOT-ZDUSSCGKSA-N 0 0 394.474 3.391 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@@H]1CC(=O)c1cccs1 ZINC000183248249 1430659170 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DAMFQGUKZLWGRF-UHFFFAOYSA-N 0 0 399.794 3.094 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCCOc3cc(F)ccc32)cccc1[N+](=O)[O-] ZINC000183355994 1430687312 /nfs/dbraw/zinc/68/73/12/1430687312.db2.gz GXXAUZYXSVVJJN-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN CN(C[C@@H]1CCCC[C@@H]1O)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000183359126 1430688341 /nfs/dbraw/zinc/68/83/41/1430688341.db2.gz GTKZCTQFMADBEX-KKSFZXQISA-N 0 0 378.472 3.164 20 5 GGBDRN CN(C[C@H]1CCCC[C@@H]1O)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000183359148 1430688370 /nfs/dbraw/zinc/68/83/70/1430688370.db2.gz GTKZCTQFMADBEX-IERDGZPVSA-N 0 0 378.472 3.164 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc3cnn(C(C)C)c3c2)ccc1[N+](=O)[O-] ZINC000183366719 1430691463 /nfs/dbraw/zinc/69/14/63/1430691463.db2.gz GOXSAVGETRKHAP-UHFFFAOYSA-N 0 0 395.419 3.202 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@H]3CCCC[C@@H]3O)cc2[N+](=O)[O-])CC1 ZINC000183378860 1430694975 /nfs/dbraw/zinc/69/49/75/1430694975.db2.gz BIIZVRZPOZOARR-XLIONFOSSA-N 0 0 389.496 3.454 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@@H]3CCCC[C@@H]3O)cc2[N+](=O)[O-])CC1 ZINC000183378838 1430695038 /nfs/dbraw/zinc/69/50/38/1430695038.db2.gz BIIZVRZPOZOARR-PXNSSMCTSA-N 0 0 389.496 3.454 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(C)C[C@H]3CCCC[C@H]3O)cc2[N+](=O)[O-])CC1 ZINC000183378901 1430695204 /nfs/dbraw/zinc/69/52/04/1430695204.db2.gz BIIZVRZPOZOARR-YLJYHZDGSA-N 0 0 389.496 3.454 20 5 GGBDRN O=C(CN1CC[C@H](Oc2cccc(F)c2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000183379995 1430695356 /nfs/dbraw/zinc/69/53/56/1430695356.db2.gz IIZPQHOCDZBNLE-HNNXBMFYSA-N 0 0 393.802 3.479 20 5 GGBDRN Cc1cc(N2CCCC2)ccc1NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000183381540 1430696290 /nfs/dbraw/zinc/69/62/90/1430696290.db2.gz GDRUGGVOMIRJKP-UHFFFAOYSA-N 0 0 375.450 3.445 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC[C@@H](c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000183389514 1430697932 /nfs/dbraw/zinc/69/79/32/1430697932.db2.gz BDXCQOPBYWCMMV-GOSISDBHSA-N 0 0 395.459 3.429 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NC(C)(C)CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000183390014 1430698918 /nfs/dbraw/zinc/69/89/18/1430698918.db2.gz FPQHZBHTZAYQGR-UHFFFAOYSA-N 0 0 383.448 3.161 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cc(C(F)(F)F)ccc2F)ccc1[N+](=O)[O-] ZINC000183394910 1430700513 /nfs/dbraw/zinc/70/05/13/1430700513.db2.gz OTQSNULRAIYFSJ-UHFFFAOYSA-N 0 0 399.300 3.430 20 5 GGBDRN CCCN1Cc2cccc(NS(=O)(=O)Cc3ccccc3[N+](=O)[O-])c2C1 ZINC000183404129 1430702582 /nfs/dbraw/zinc/70/25/82/1430702582.db2.gz DATCHZZJDZMCPG-UHFFFAOYSA-N 0 0 375.450 3.262 20 5 GGBDRN COc1ccc([C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000183406018 1430703358 /nfs/dbraw/zinc/70/33/58/1430703358.db2.gz YOJUKUYAEXYXOU-HNNXBMFYSA-N 0 0 383.326 3.096 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(Cc2ccco2)Cc2ccco2)cc1 ZINC000183408022 1430703841 /nfs/dbraw/zinc/70/38/41/1430703841.db2.gz JMWJTVDHOQPCQV-UHFFFAOYSA-N 0 0 390.417 3.356 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1CS(C)(=O)=O)c1ccc([N+](=O)[O-])cc1F ZINC000183412781 1430705260 /nfs/dbraw/zinc/70/52/60/1430705260.db2.gz LOQCSJXBJYFPOY-LLVKDONJSA-N 0 0 380.397 3.021 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H](c2ccccc2)C2CCC2)ccc1[N+](=O)[O-] ZINC000183415405 1430705687 /nfs/dbraw/zinc/70/56/87/1430705687.db2.gz YBHGOBMPCGMMQJ-HXUWFJFHSA-N 0 0 381.432 3.291 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CCO1 ZINC000183443100 1430713149 /nfs/dbraw/zinc/71/31/49/1430713149.db2.gz PQIZENAPMJBSHD-BEFAXECRSA-N 0 0 386.452 3.494 20 5 GGBDRN COc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)c2ccc(F)cc2)cc1 ZINC000183452175 1430715173 /nfs/dbraw/zinc/71/51/73/1430715173.db2.gz SETQTPNOJRFQAY-GOSISDBHSA-N 0 0 396.378 3.239 20 5 GGBDRN CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000183475087 1430720804 /nfs/dbraw/zinc/72/08/04/1430720804.db2.gz BYDABXTXDHYXMZ-BBRMVZONSA-N 0 0 375.450 3.341 20 5 GGBDRN CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000183475129 1430720872 /nfs/dbraw/zinc/72/08/72/1430720872.db2.gz BYDABXTXDHYXMZ-XJKSGUPXSA-N 0 0 375.450 3.341 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC=C(c2c[nH]c3cc(F)ccc32)CC1 ZINC000183479105 1430722325 /nfs/dbraw/zinc/72/23/25/1430722325.db2.gz FPWRCDWJBSDZFR-UHFFFAOYSA-N 0 0 381.367 3.122 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1OC(F)F ZINC000183485333 1430724490 /nfs/dbraw/zinc/72/44/90/1430724490.db2.gz RNIHWQWXMOLNNO-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1nc(C)cs1 ZINC000183510979 1430731557 /nfs/dbraw/zinc/73/15/57/1430731557.db2.gz ZNNYVENDVLIEHE-AWEZNQCLSA-N 0 0 390.465 3.077 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1nc(C)cs1)C1CC1 ZINC000183511815 1430731711 /nfs/dbraw/zinc/73/17/11/1430731711.db2.gz UHVQTOINOOIASX-INIZCTEOSA-N 0 0 376.438 3.048 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000183514917 1430732711 /nfs/dbraw/zinc/73/27/11/1430732711.db2.gz UCVFQNZYYGGJLS-UHFFFAOYSA-N 0 0 396.415 3.410 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183520025 1430734022 /nfs/dbraw/zinc/73/40/22/1430734022.db2.gz BCNHBHZTZCFRHD-UHFFFAOYSA-N 0 0 390.461 3.140 20 5 GGBDRN Cn1cnc(-c2ccc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)cc2)n1 ZINC000183527841 1430735314 /nfs/dbraw/zinc/73/53/14/1430735314.db2.gz IGJFECLWDYFNAA-UHFFFAOYSA-N 0 0 389.375 3.033 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@H](c2nc(C)cs2)C2CC2)c([N+](=O)[O-])c1 ZINC000183552920 1430741096 /nfs/dbraw/zinc/74/10/96/1430741096.db2.gz NGASGHUVFQTNSI-KRWDZBQOSA-N 0 0 390.465 3.438 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](CN1CCOCC1)c1ccccc1C ZINC000183554801 1430741364 /nfs/dbraw/zinc/74/13/64/1430741364.db2.gz MPXCHCOLIFWIOH-HXUWFJFHSA-N 0 0 385.464 3.075 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000183559978 1430742210 /nfs/dbraw/zinc/74/22/10/1430742210.db2.gz HTPRGIUKGHOZGI-UKRRQHHQSA-N 0 0 380.763 3.434 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000183562815 1430742397 /nfs/dbraw/zinc/74/23/97/1430742397.db2.gz 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Cc1cc(C[C@@H](C)NC(=O)Nc2ccncc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000183586559 1430748144 /nfs/dbraw/zinc/74/81/44/1430748144.db2.gz JNPBMGPVJVSODS-CYBMUJFWSA-N 0 0 380.408 3.237 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183600370 1430751860 /nfs/dbraw/zinc/75/18/60/1430751860.db2.gz UJNIFXNODPNKSZ-QMMMGPOBSA-N 0 0 386.334 3.248 20 5 GGBDRN C[C@H](c1ccc(F)cc1F)N1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000183605673 1430753175 /nfs/dbraw/zinc/75/31/75/1430753175.db2.gz WFANGSACULLFOV-GFCCVEGCSA-N 0 0 391.378 3.179 20 5 GGBDRN C[C@H](C(=O)N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000183606935 1430753303 /nfs/dbraw/zinc/75/33/03/1430753303.db2.gz LVYHMCLQDIFCCE-AAEUAGOBSA-N 0 0 387.415 3.239 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(CCOc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000183615321 1430755054 /nfs/dbraw/zinc/75/50/54/1430755054.db2.gz UAQMHEBXCCHEPM-UHFFFAOYSA-N 0 0 384.436 3.132 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000183615506 1430755078 /nfs/dbraw/zinc/75/50/78/1430755078.db2.gz IWRVTFIHOSVSFH-MAUKXSAKSA-N 0 0 381.432 3.038 20 5 GGBDRN O=C(CCC1CCCCC1)N1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000183616898 1430755711 /nfs/dbraw/zinc/75/57/11/1430755711.db2.gz HCGXECITHCYKPV-UHFFFAOYSA-N 0 0 389.456 3.026 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCC(C)(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000183625916 1430757471 /nfs/dbraw/zinc/75/74/71/1430757471.db2.gz IYPBPBWYAAWCQV-UHFFFAOYSA-N 0 0 383.448 3.018 20 5 GGBDRN Cc1nc(NC(=O)c2cc([N+](=O)[O-])cnc2N)sc1Cc1ccc(C)cc1 ZINC000183636087 1430760135 /nfs/dbraw/zinc/76/01/35/1430760135.db2.gz LDBWJTQBHGTBCC-UHFFFAOYSA-N 0 0 383.433 3.488 20 5 GGBDRN CN(C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])cnc2N)c1)c1ccccc1 ZINC000183642003 1430761501 /nfs/dbraw/zinc/76/15/01/1430761501.db2.gz IANWKPQJXKELBL-UHFFFAOYSA-N 0 0 391.387 3.101 20 5 GGBDRN C[C@H](C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1F ZINC000183644152 1430762356 /nfs/dbraw/zinc/76/23/56/1430762356.db2.gz KURLUGWOZWSGQW-JSGCOSHPSA-N 0 0 385.395 3.039 20 5 GGBDRN C[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1F ZINC000183644171 1430762627 /nfs/dbraw/zinc/76/26/27/1430762627.db2.gz KURLUGWOZWSGQW-OCCSQVGLSA-N 0 0 385.395 3.039 20 5 GGBDRN Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183645536 1430762640 /nfs/dbraw/zinc/76/26/40/1430762640.db2.gz DKVPTYXFVWORBV-UHFFFAOYSA-N 0 0 391.387 3.385 20 5 GGBDRN Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000183644924 1430762671 /nfs/dbraw/zinc/76/26/71/1430762671.db2.gz BMWVODYINGPVRF-WMZOPIPTSA-N 0 0 395.459 3.346 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCN(c2ccc(C(F)(F)F)cc2)CC1 ZINC000183649030 1430763391 /nfs/dbraw/zinc/76/33/91/1430763391.db2.gz IWCBLTRTSFEKGY-UHFFFAOYSA-N 0 0 395.341 3.363 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H](c2ccccc2)c2cccnc2)cc1 ZINC000183657748 1430765642 /nfs/dbraw/zinc/76/56/42/1430765642.db2.gz MKXADYJHRMPEMB-HXUWFJFHSA-N 0 0 397.456 3.241 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183681867 1430771197 /nfs/dbraw/zinc/77/11/97/1430771197.db2.gz QUYZKNDWDQOKQS-GOSISDBHSA-N 0 0 383.448 3.113 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000183681851 1430771289 /nfs/dbraw/zinc/77/12/89/1430771289.db2.gz QUYZKNDWDQOKQS-SFHVURJKSA-N 0 0 383.448 3.113 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000183682308 1430771598 /nfs/dbraw/zinc/77/15/98/1430771598.db2.gz CUELMADTPBDBNH-GOSISDBHSA-N 0 0 396.378 3.213 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000183690333 1430773859 /nfs/dbraw/zinc/77/38/59/1430773859.db2.gz BAMQGHDJABKHEW-LJQANCHMSA-N 0 0 396.378 3.213 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@@H](C)C[C@H]2c2ccccc2F)ccc1[N+](=O)[O-] ZINC000183695589 1430774997 /nfs/dbraw/zinc/77/49/97/1430774997.db2.gz 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GGBDRN Cn1cnc(-c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)cc2)n1 ZINC000183731915 1430783013 /nfs/dbraw/zinc/78/30/13/1430783013.db2.gz YLJQPFWIMVFJRN-UHFFFAOYSA-N 0 0 392.419 3.243 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1SCCC(N)=O)c1ccc([N+](=O)[O-])cc1F ZINC000183744270 1430785637 /nfs/dbraw/zinc/78/56/37/1430785637.db2.gz UMRJOYRFVYQLLM-LLVKDONJSA-N 0 0 391.424 3.444 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)c1ccc(OCC(F)(F)F)cc1 ZINC000183752394 1430786812 /nfs/dbraw/zinc/78/68/12/1430786812.db2.gz RBHDZJWGXMDUSB-SECBINFHSA-N 0 0 384.314 3.004 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2CCc3c2cccc3F)cc1[N+](=O)[O-] ZINC000183757612 1430787537 /nfs/dbraw/zinc/78/75/37/1430787537.db2.gz SHDSKWQFZIVKFS-UHFFFAOYSA-N 0 0 399.407 3.217 20 5 GGBDRN Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183769882 1430790499 /nfs/dbraw/zinc/79/04/99/1430790499.db2.gz JAWNBCHIXYBEDG-KRWDZBQOSA-N 0 0 392.419 3.255 20 5 GGBDRN Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183769861 1430790597 /nfs/dbraw/zinc/79/05/97/1430790597.db2.gz JAWNBCHIXYBEDG-QGZVFWFLSA-N 0 0 392.419 3.255 20 5 GGBDRN Cc1ccc(CCN(CC(F)(F)F)C(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000183790462 1430794838 /nfs/dbraw/zinc/79/48/38/1430794838.db2.gz HHQOIRXZVYVPDJ-UHFFFAOYSA-N 0 0 382.342 3.128 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)c(C)c1 ZINC000183816248 1430800400 /nfs/dbraw/zinc/80/04/00/1430800400.db2.gz IOQJYOCLRHLLFQ-DIFFPNOSSA-N 0 0 392.358 3.315 20 5 GGBDRN COC(=O)[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(F)c(C)c1 ZINC000183827131 1430801904 /nfs/dbraw/zinc/80/19/04/1430801904.db2.gz YHEDKUVHALLTTN-IBGZPJMESA-N 0 0 399.378 3.097 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCN([C@@H](C)c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000183836659 1430802978 /nfs/dbraw/zinc/80/29/78/1430802978.db2.gz QIRBBVBGBNHBQA-AWEZNQCLSA-N 0 0 395.506 3.032 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCN([C@@H](C)c2ccsc2)CC1 ZINC000183840684 1430803476 /nfs/dbraw/zinc/80/34/76/1430803476.db2.gz AXZPQXWKHQPHOK-AWEZNQCLSA-N 0 0 395.506 3.032 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN([C@@H](C)c2ccsc2)CC1 ZINC000183839976 1430803540 /nfs/dbraw/zinc/80/35/40/1430803540.db2.gz BQTOUSIVEWUFFL-AWEZNQCLSA-N 0 0 395.506 3.032 20 5 GGBDRN CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000183851597 1430804885 /nfs/dbraw/zinc/80/48/85/1430804885.db2.gz FKUXJJKGGFBBAY-KRWDZBQOSA-N 0 0 377.404 3.153 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)nc1C ZINC000183856105 1430805528 /nfs/dbraw/zinc/80/55/28/1430805528.db2.gz NOPBLBCXTAREPK-VIFPVBQESA-N 0 0 395.412 3.442 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NN3Cc4ccccc4C3=O)cc2[N+](=O)[O-])CC1 ZINC000183858376 1430805679 /nfs/dbraw/zinc/80/56/79/1430805679.db2.gz LRGKXTAJGLGWFH-UHFFFAOYSA-N 0 0 394.431 3.132 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc3nc(C4CC4)oc3c2)ccc1[N+](=O)[O-] ZINC000183872896 1430807340 /nfs/dbraw/zinc/80/73/40/1430807340.db2.gz PXADNRQSHVAKFO-UHFFFAOYSA-N 0 0 394.387 3.290 20 5 GGBDRN CCN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCN(c2ccccc2)C1=O ZINC000183886197 1430808744 /nfs/dbraw/zinc/80/87/44/1430808744.db2.gz LPYVIQSLCQXMPG-LIRRHRJNSA-N 0 0 399.422 3.491 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NN2Cc3ccccc3C2=O)CC1 ZINC000183887752 1430809150 /nfs/dbraw/zinc/80/91/50/1430809150.db2.gz WEHXITWMDKQFHY-UHFFFAOYSA-N 0 0 394.431 3.132 20 5 GGBDRN C[C@H]1CCCc2ccccc2[C@H]1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000183892684 1430809569 /nfs/dbraw/zinc/80/95/69/1430809569.db2.gz CZRFBNQHHPXGID-RBZFPXEDSA-N 0 0 395.415 3.333 20 5 GGBDRN C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000183892625 1430809572 /nfs/dbraw/zinc/80/95/72/1430809572.db2.gz CZRFBNQHHPXGID-ZUOKHONESA-N 0 0 395.415 3.333 20 5 GGBDRN C[NH+](C)[C@@H](CNC(=O)c1ccc([O-])c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000183894561 1430809861 /nfs/dbraw/zinc/80/98/61/1430809861.db2.gz ZCDOHSYMFCKREQ-HNNXBMFYSA-N 0 0 397.353 3.352 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000183926503 1430814231 /nfs/dbraw/zinc/81/42/31/1430814231.db2.gz XTFJZPGQAMBNFK-UHFFFAOYSA-N 0 0 375.469 3.404 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000183931565 1430814804 /nfs/dbraw/zinc/81/48/04/1430814804.db2.gz MWCKCTWJYRFAAD-UHFFFAOYSA-N 0 0 375.469 3.025 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000183942180 1430816032 /nfs/dbraw/zinc/81/60/32/1430816032.db2.gz SSUIPHRCTUDIIQ-UHFFFAOYSA-N 0 0 375.469 3.025 20 5 GGBDRN CC(C)c1ccnc(N2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)n1 ZINC000183945671 1430816369 /nfs/dbraw/zinc/81/63/69/1430816369.db2.gz SSPCVURNANUUAZ-UHFFFAOYSA-N 0 0 389.843 3.124 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000184022967 1430830535 /nfs/dbraw/zinc/83/05/35/1430830535.db2.gz VUZAWMWEUGFDOE-NSHDSACASA-N 0 0 399.353 3.344 20 5 GGBDRN C[C@@H]1CC[C@@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000184029960 1430831687 /nfs/dbraw/zinc/83/16/87/1430831687.db2.gz KILIOYYDDGFQID-MBNYWOFBSA-N 0 0 389.481 3.429 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H]2CC(C)(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000184034529 1430832194 /nfs/dbraw/zinc/83/21/94/1430832194.db2.gz RKMZYWMBYPALLA-QGZVFWFLSA-N 0 0 381.432 3.172 20 5 GGBDRN COc1ccc([C@@H](CO)N(C)C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000184046547 1430833921 /nfs/dbraw/zinc/83/39/21/1430833921.db2.gz MYXBBKDYXBBDEU-KPZWWZAWSA-N 0 0 376.384 3.038 20 5 GGBDRN COc1ccc([C@H](CO)N(C)C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000184046511 1430833931 /nfs/dbraw/zinc/83/39/31/1430833931.db2.gz MYXBBKDYXBBDEU-SGTLLEGYSA-N 0 0 376.384 3.038 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1CN1CCNC1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184047038 1430833950 /nfs/dbraw/zinc/83/39/50/1430833950.db2.gz YWJBCHFLHCWSPU-LBPRGKRZSA-N 0 0 386.383 3.001 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NC3CCC(O)(c4cccnc4)CC3)cc2N1 ZINC000184110807 1430842716 /nfs/dbraw/zinc/84/27/16/1430842716.db2.gz QLBWZAAUEVBPOM-UHFFFAOYSA-N 0 0 382.420 3.117 20 5 GGBDRN COc1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000184118306 1430843607 /nfs/dbraw/zinc/84/36/07/1430843607.db2.gz DLIGMWQUNJZMPP-UHFFFAOYSA-N 0 0 379.800 3.265 20 5 GGBDRN COc1ccc(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000184120228 1430843955 /nfs/dbraw/zinc/84/39/55/1430843955.db2.gz BIIULAPMCLJRLL-UHFFFAOYSA-N 0 0 393.827 3.307 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000184130069 1430845360 /nfs/dbraw/zinc/84/53/60/1430845360.db2.gz JWHHXEXBMVEBDJ-UHFFFAOYSA-N 0 0 396.490 3.155 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ccc(OCc2ccccc2F)cc1 ZINC000184144117 1430846946 /nfs/dbraw/zinc/84/69/46/1430846946.db2.gz NXRCEYPFRBMJOD-UHFFFAOYSA-N 0 0 398.394 3.134 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H]2c3ccccc3CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000184147888 1430847272 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375.425 3.438 20 5 GGBDRN O=[N+]([O-])c1cc(C[NH2+][C@@]2(CO)CCOC2)ccc1Oc1ccccc1Cl ZINC000184189830 1430853708 /nfs/dbraw/zinc/85/37/08/1430853708.db2.gz RVVDNAYQRUOAJX-GOSISDBHSA-N 0 0 378.812 3.282 20 5 GGBDRN COc1cc(CN2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184194322 1430854165 /nfs/dbraw/zinc/85/41/65/1430854165.db2.gz VXVYIPPVWXBMMD-LBPRGKRZSA-N 0 0 383.420 3.089 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000184195312 1430854513 /nfs/dbraw/zinc/85/45/13/1430854513.db2.gz VNJQQHOVUGHXJW-CYBMUJFWSA-N 0 0 375.425 3.038 20 5 GGBDRN CC(C)COC[C@@H](N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccco1 ZINC000184207916 1430856484 /nfs/dbraw/zinc/85/64/84/1430856484.db2.gz VJJXPAHIYGWLHA-QZTJIDSGSA-N 0 0 387.436 3.297 20 5 GGBDRN COc1cc(CN2CCC[C@H](CNC(=O)C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184214644 1430857282 /nfs/dbraw/zinc/85/72/82/1430857282.db2.gz PLQHZRKHTZAEMF-CYBMUJFWSA-N 0 0 381.448 3.117 20 5 GGBDRN COc1cccc(N2CCN(Cc3cc(OC)c(F)cc3[N+](=O)[O-])CC2)c1 ZINC000184227289 1430859114 /nfs/dbraw/zinc/85/91/14/1430859114.db2.gz MFOFTRONWYQNMY-UHFFFAOYSA-N 0 0 375.400 3.073 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184236142 1430860329 /nfs/dbraw/zinc/86/03/29/1430860329.db2.gz XXABDEMLOFWZQY-UHFFFAOYSA-N 0 0 376.434 3.098 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000184237481 1430860641 /nfs/dbraw/zinc/86/06/41/1430860641.db2.gz GJCGHMHLNVKUPF-KRWDZBQOSA-N 0 0 396.852 3.152 20 5 GGBDRN C[C@H](CNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1nccs1 ZINC000184239296 1430860848 /nfs/dbraw/zinc/86/08/48/1430860848.db2.gz LGCTZBLTKSROGF-CYBMUJFWSA-N 0 0 390.465 3.408 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000184243232 1430861232 /nfs/dbraw/zinc/86/12/32/1430861232.db2.gz DRDGSNBGHVHJGK-KRWDZBQOSA-N 0 0 396.852 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000184243246 1430861275 /nfs/dbraw/zinc/86/12/75/1430861275.db2.gz DRDGSNBGHVHJGK-QGZVFWFLSA-N 0 0 396.852 3.152 20 5 GGBDRN CCOc1cc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N)ccc1OC(F)F ZINC000184247601 1430861978 /nfs/dbraw/zinc/86/19/78/1430861978.db2.gz YNSCAVSKUSYCTD-UHFFFAOYSA-N 0 0 395.362 3.449 20 5 GGBDRN COc1cc(CN2CCC(C(=O)N3CCC(C)CC3)CC2)c([N+](=O)[O-])cc1F ZINC000184247644 1430861989 /nfs/dbraw/zinc/86/19/89/1430861989.db2.gz ZWCZVZJFCKNXBM-UHFFFAOYSA-N 0 0 393.459 3.213 20 5 GGBDRN COc1cc(CN2CCC(NC(=O)c3ccsc3)CC2)c([N+](=O)[O-])cc1F ZINC000184251147 1430862508 /nfs/dbraw/zinc/86/25/08/1430862508.db2.gz KYTLRLVLTLWDMR-UHFFFAOYSA-N 0 0 393.440 3.198 20 5 GGBDRN CCC(=O)Nc1ccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000184252150 1430862822 /nfs/dbraw/zinc/86/28/22/1430862822.db2.gz NFWCCQZCDHIAAC-UHFFFAOYSA-N 0 0 397.840 3.075 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184258485 1430863490 /nfs/dbraw/zinc/86/34/90/1430863490.db2.gz UOTUOPPMVMHFNF-KGLIPLIRSA-N 0 0 381.448 3.259 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCCc2cccc(OC(F)F)c21 ZINC000184261486 1430864082 /nfs/dbraw/zinc/86/40/82/1430864082.db2.gz GYHGFKUJJWMXQM-UHFFFAOYSA-N 0 0 398.387 3.479 20 5 GGBDRN CCCC[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)OC ZINC000184261906 1430864191 /nfs/dbraw/zinc/86/41/91/1430864191.db2.gz PMJUFKBSTJRYPA-KRWDZBQOSA-N 0 0 380.444 3.003 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000184267783 1430864992 /nfs/dbraw/zinc/86/49/92/1430864992.db2.gz YQRJSYMKIMYMFZ-APWZRJJASA-N 0 0 390.461 3.182 20 5 GGBDRN C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)c2ccccc21 ZINC000184273797 1430865926 /nfs/dbraw/zinc/86/59/26/1430865926.db2.gz UDGWXDHBLJSTAI-LBPRGKRZSA-N 0 0 385.807 3.441 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000184274514 1430866150 /nfs/dbraw/zinc/86/61/50/1430866150.db2.gz UNPQAWATOKDKJG-AWEZNQCLSA-N 0 0 387.436 3.199 20 5 GGBDRN CCS(=O)(=O)c1cc(F)ccc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000184285754 1430868186 /nfs/dbraw/zinc/86/81/86/1430868186.db2.gz SMQHHYRRBQDRKU-LLVKDONJSA-N 0 0 395.412 3.410 20 5 GGBDRN O=C(C[C@H]1Sc2ccccc2NC1=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184292503 1430869227 /nfs/dbraw/zinc/86/92/27/1430869227.db2.gz IHFZEWAVEAZUEF-OAHLLOKOSA-N 0 0 391.836 3.368 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NC[C@@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000184297774 1430870324 /nfs/dbraw/zinc/87/03/24/1430870324.db2.gz PZULUYYKELTEJN-CYBMUJFWSA-N 0 0 377.470 3.265 20 5 GGBDRN COc1cc(CN[C@@H](CN2CCCC2=O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184301835 1430870791 /nfs/dbraw/zinc/87/07/91/1430870791.db2.gz SQWZAVIKFKLTKJ-KRWDZBQOSA-N 0 0 387.411 3.196 20 5 GGBDRN COc1cc(CN[C@H](CN2CCCC2=O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184301852 1430870841 /nfs/dbraw/zinc/87/08/41/1430870841.db2.gz SQWZAVIKFKLTKJ-QGZVFWFLSA-N 0 0 387.411 3.196 20 5 GGBDRN C[C@H](C(=O)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184306662 1430871239 /nfs/dbraw/zinc/87/12/39/1430871239.db2.gz XTRVLQBKYLXDOH-FHSNZYRGSA-N 0 0 385.395 3.148 20 5 GGBDRN CC(C)[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000184317868 1430872546 /nfs/dbraw/zinc/87/25/46/1430872546.db2.gz HFZZHVJSWYZLKA-HNNXBMFYSA-N 0 0 385.848 3.143 20 5 GGBDRN Cn1ccnc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)c1=O ZINC000184320641 1430872726 /nfs/dbraw/zinc/87/27/26/1430872726.db2.gz OFTDOEFCTXCGKA-UHFFFAOYSA-N 0 0 388.449 3.223 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2-n2nccc2C)c([N+](=O)[O-])cc1OC ZINC000184350404 1430876562 /nfs/dbraw/zinc/87/65/62/1430876562.db2.gz BNVCXXJTZBAUCS-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000184363130 1430878316 /nfs/dbraw/zinc/87/83/16/1430878316.db2.gz RCCDVTZLFCRAMN-AWEZNQCLSA-N 0 0 389.477 3.256 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1[N+](=O)[O-] ZINC000184368656 1430879220 /nfs/dbraw/zinc/87/92/20/1430879220.db2.gz MWMHOVSYUHYXBK-NSHDSACASA-N 0 0 398.387 3.060 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1[N+](=O)[O-] ZINC000184368679 1430879234 /nfs/dbraw/zinc/87/92/34/1430879234.db2.gz MWMHOVSYUHYXBK-LLVKDONJSA-N 0 0 398.387 3.060 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184370392 1430879389 /nfs/dbraw/zinc/87/93/89/1430879389.db2.gz JVRPLUKXAYGOAA-GFCCVEGCSA-N 0 0 382.388 3.360 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000184374349 1430880067 /nfs/dbraw/zinc/88/00/67/1430880067.db2.gz ZUTVUYIDUIKKKW-LLVKDONJSA-N 0 0 398.387 3.060 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1 ZINC000184374837 1430880330 /nfs/dbraw/zinc/88/03/30/1430880330.db2.gz UPLWUFNOYTXIJC-ZDUSSCGKSA-N 0 0 382.388 3.192 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000184377071 1430880649 /nfs/dbraw/zinc/88/06/49/1430880649.db2.gz SVXLXQDNABLGPS-NSHDSACASA-N 0 0 398.387 3.060 20 5 GGBDRN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)Nc1c([N+](=O)[O-])cnn1C ZINC000184396068 1430882675 /nfs/dbraw/zinc/88/26/75/1430882675.db2.gz ARBXDZRQHSESMA-UHFFFAOYSA-N 0 0 375.385 3.075 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184404726 1430884028 /nfs/dbraw/zinc/88/40/28/1430884028.db2.gz PZANQUHLSQVBKK-KRWDZBQOSA-N 0 0 376.434 3.270 20 5 GGBDRN COc1cc(OCC(=O)Nc2nc3c(cccc3Cl)n2C)ccc1[N+](=O)[O-] ZINC000184410566 1430884739 /nfs/dbraw/zinc/88/47/39/1430884739.db2.gz USYPTJQWVCDWJJ-UHFFFAOYSA-N 0 0 390.783 3.161 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000184419313 1430885566 /nfs/dbraw/zinc/88/55/66/1430885566.db2.gz VUXYCFHKAGDFKJ-INIZCTEOSA-N 0 0 389.458 3.260 20 5 GGBDRN O=C(c1ccc(NCCc2ccc([N+](=O)[O-])cc2)cc1Cl)N1CCOCC1 ZINC000184429710 1430886823 /nfs/dbraw/zinc/88/68/23/1430886823.db2.gz BIANKXRAMIOOCL-UHFFFAOYSA-N 0 0 389.839 3.375 20 5 GGBDRN CC(C)COc1ccc(CCNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000184432332 1430887114 /nfs/dbraw/zinc/88/71/14/1430887114.db2.gz DBCDYORKVXWJRV-UHFFFAOYSA-N 0 0 392.477 3.292 20 5 GGBDRN C[C@H](C[S@](C)=O)N(C)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000184430496 1430887150 /nfs/dbraw/zinc/88/71/50/1430887150.db2.gz IDSYMWOFYZIEJX-SRGMZFCMSA-N 0 0 375.450 3.177 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000184442874 1430888512 /nfs/dbraw/zinc/88/85/12/1430888512.db2.gz CIECFHXJLRFGIG-CQSZACIVSA-N 0 0 389.452 3.363 20 5 GGBDRN O=C1NCCN1Cc1ccccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184451354 1430889378 /nfs/dbraw/zinc/88/93/78/1430889378.db2.gz SFGDWVAPYUBOKY-UHFFFAOYSA-N 0 0 393.403 3.387 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(-c2nc[nH]n2)cc1 ZINC000184468269 1430891272 /nfs/dbraw/zinc/89/12/72/1430891272.db2.gz XCJWRNNKTKMPHZ-UHFFFAOYSA-N 0 0 375.348 3.022 20 5 GGBDRN CC(C)c1ccccc1OCCNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184470253 1430891526 /nfs/dbraw/zinc/89/15/26/1430891526.db2.gz CXQCBUGCFISZGQ-UHFFFAOYSA-N 0 0 378.450 3.217 20 5 GGBDRN C[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C(C)(C)C)cs1 ZINC000184479561 1430892474 /nfs/dbraw/zinc/89/24/74/1430892474.db2.gz LSECTCICFHVLOE-GFCCVEGCSA-N 0 0 397.522 3.473 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCC[C@H](CC(=O)OC(C)C)C2)cccc1[N+](=O)[O-] ZINC000184496955 1430894942 /nfs/dbraw/zinc/89/49/42/1430894942.db2.gz PTDZAQDEQANBBZ-JKSUJKDBSA-N 0 0 391.468 3.284 20 5 GGBDRN CC(=O)Nc1cccnc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000184502694 1430895799 /nfs/dbraw/zinc/89/57/99/1430895799.db2.gz JEVPDVFEQBDCHP-UHFFFAOYSA-N 0 0 386.411 3.147 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccc(OC(F)F)cc1 ZINC000184501816 1430895814 /nfs/dbraw/zinc/89/58/14/1430895814.db2.gz GJCWEHLSFDVCCD-UHFFFAOYSA-N 0 0 393.346 3.068 20 5 GGBDRN COc1ccc([C@@H]2CCN(C(=O)C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)C2)cc1 ZINC000184511782 1430896696 /nfs/dbraw/zinc/89/66/96/1430896696.db2.gz XXICHKTXDDDVNB-MRXNPFEDSA-N 0 0 397.431 3.175 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184517861 1430897469 /nfs/dbraw/zinc/89/74/69/1430897469.db2.gz PHEJMSUNHSRZNZ-XJKSGUPXSA-N 0 0 378.425 3.442 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000184526593 1430898589 /nfs/dbraw/zinc/89/85/89/1430898589.db2.gz PMSYVSCDMJLGJZ-UHFFFAOYSA-N 0 0 385.420 3.007 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NCc1cc(F)cc2c1OCOC2 ZINC000184543219 1430901136 /nfs/dbraw/zinc/90/11/36/1430901136.db2.gz REIZBVKEADCKEK-UHFFFAOYSA-N 0 0 395.774 3.253 20 5 GGBDRN C[C@H](C(=O)N(C)Cc1ccc([S@@](C)=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000184559350 1430904674 /nfs/dbraw/zinc/90/46/74/1430904674.db2.gz DNSLCCPEJYTBDQ-GWQKEKGPSA-N 0 0 378.425 3.233 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C)c(-c2nnnn2C2CC2)c1 ZINC000184601889 1430915320 /nfs/dbraw/zinc/91/53/20/1430915320.db2.gz SZMLLHZVVQSAHG-UHFFFAOYSA-N 0 0 378.392 3.452 20 5 GGBDRN Cc1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1-c1nnnn1C1CC1 ZINC000184611962 1430919057 /nfs/dbraw/zinc/91/90/57/1430919057.db2.gz YKQFNXCQGAWYRV-UHFFFAOYSA-N 0 0 378.392 3.452 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(=O)N1CCCCC1 ZINC000184611624 1430919242 /nfs/dbraw/zinc/91/92/42/1430919242.db2.gz UIXLOQSFGFPBTN-SNVBAGLBSA-N 0 0 388.346 3.136 20 5 GGBDRN COc1cc(CN2CCN([C@@H](C)c3nccs3)CC2)c([N+](=O)[O-])cc1F ZINC000184612969 1430919455 /nfs/dbraw/zinc/91/94/55/1430919455.db2.gz DBXBHUXUHRHUAM-LBPRGKRZSA-N 0 0 380.445 3.078 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1 ZINC000184625022 1430922658 /nfs/dbraw/zinc/92/26/58/1430922658.db2.gz NCIUQBHNPJNRJS-MUUNZHRXSA-N 0 0 396.428 3.132 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1-c1nnnn1C1CC1 ZINC000184624329 1430922668 /nfs/dbraw/zinc/92/26/68/1430922668.db2.gz ASELREZKWRHNIF-UHFFFAOYSA-N 0 0 378.392 3.452 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccccc2O)CC1 ZINC000184642722 1430927916 /nfs/dbraw/zinc/92/79/16/1430927916.db2.gz NDUCJZICTXOBTI-KRWDZBQOSA-N 0 0 383.448 3.218 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccccc2O)CC1 ZINC000184642742 1430927953 /nfs/dbraw/zinc/92/79/53/1430927953.db2.gz NDUCJZICTXOBTI-QGZVFWFLSA-N 0 0 383.448 3.218 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)nc1 ZINC000184644382 1430928584 /nfs/dbraw/zinc/92/85/84/1430928584.db2.gz KCZSKQPBHMUKFU-UHFFFAOYSA-N 0 0 377.832 3.253 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](CC(C)C)N1CCOCC1 ZINC000184661395 1430933732 /nfs/dbraw/zinc/93/37/32/1430933732.db2.gz DHQOIPBIOFMVLB-UYAOXDASSA-N 0 0 391.512 3.027 20 5 GGBDRN C[C@H]1CCN(C)c2ccccc2N1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184674841 1430939286 /nfs/dbraw/zinc/93/92/86/1430939286.db2.gz ZSKWMWPVWADKQC-AWEZNQCLSA-N 0 0 375.450 3.160 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccnc1-n1cccn1 ZINC000184683037 1430941332 /nfs/dbraw/zinc/94/13/32/1430941332.db2.gz IXRAZBWGOLRFNI-INIZCTEOSA-N 0 0 379.420 3.061 20 5 GGBDRN 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GGBDRN CCc1ccc([C@@H](COC)NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000184780604 1430975728 /nfs/dbraw/zinc/97/57/28/1430975728.db2.gz RBMBALZKSZCSGC-OAHLLOKOSA-N 0 0 381.816 3.319 20 5 GGBDRN O=C(CN1C[C@H]2CCC(=O)c3cccc1c32)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000184784445 1430976754 /nfs/dbraw/zinc/97/67/54/1430976754.db2.gz ODOKLTQNPRLOFC-CQSZACIVSA-N 0 0 377.400 3.064 20 5 GGBDRN CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184786715 1430977728 /nfs/dbraw/zinc/97/77/28/1430977728.db2.gz RFHQDOLKEPDPDE-QWRGUYRKSA-N 0 0 377.422 3.036 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCSc3ccccc32)c2ncccc12 ZINC000184789879 1430978565 /nfs/dbraw/zinc/97/85/65/1430978565.db2.gz ZPORBEZWOOYISP-UHFFFAOYSA-N 0 0 387.442 3.444 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H]2CCC(=O)c3cccc1c32 ZINC000184803590 1430982979 /nfs/dbraw/zinc/98/29/79/1430982979.db2.gz XJJLHZVLYVTYTK-GFCCVEGCSA-N 0 0 381.388 3.122 20 5 GGBDRN O=C(CN1C[C@H]2CCC(=O)c3cccc1c32)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000184808933 1430984100 /nfs/dbraw/zinc/98/41/00/1430984100.db2.gz KAVLIEKXKJDBBA-CQSZACIVSA-N 0 0 377.400 3.064 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000184815704 1430987145 /nfs/dbraw/zinc/98/71/45/1430987145.db2.gz ROMWGLIUHDPHQQ-NVXWUHKLSA-N 0 0 396.852 3.198 20 5 GGBDRN CC(=O)c1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1C ZINC000184826340 1430992560 /nfs/dbraw/zinc/99/25/60/1430992560.db2.gz AXVYUQBSKUEBKQ-UHFFFAOYSA-N 0 0 389.795 3.014 20 5 GGBDRN CCc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000184827848 1430993108 /nfs/dbraw/zinc/99/31/08/1430993108.db2.gz IJRVDINTNSVPRY-UHFFFAOYSA-N 0 0 379.775 3.205 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc2ncsc2c1 ZINC000184826962 1430993480 /nfs/dbraw/zinc/99/34/80/1430993480.db2.gz DTFXDRNZENJGMZ-UHFFFAOYSA-N 0 0 390.808 3.113 20 5 GGBDRN COc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1Cl ZINC000184830132 1430995109 /nfs/dbraw/zinc/99/51/09/1430995109.db2.gz CTLVAIFBSQKLLO-UHFFFAOYSA-N 0 0 398.202 3.165 20 5 GGBDRN CCc1ccc([C@@H](COC)N[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000184832101 1430995769 /nfs/dbraw/zinc/99/57/69/1430995769.db2.gz QWSNFRWIUXTCAB-BLLLJJGKSA-N 0 0 391.424 3.063 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccccc1N1CCCCC1 ZINC000184832082 1430995897 /nfs/dbraw/zinc/99/58/97/1430995897.db2.gz FBGZGRMAPWUQOW-UHFFFAOYSA-N 0 0 389.477 3.205 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184831804 1430995971 /nfs/dbraw/zinc/99/59/71/1430995971.db2.gz YHQGGCFFUCJDHP-IAQYHMDHSA-N 0 0 375.404 3.204 20 5 GGBDRN Cc1cc2cc(NC(=O)C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)ccc2[nH]1 ZINC000184832416 1430995986 /nfs/dbraw/zinc/99/59/86/1430995986.db2.gz KYYFKODOLYLXEV-UHFFFAOYSA-N 0 0 386.795 3.293 20 5 GGBDRN CCc1ccc([C@H](COC)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)o1 ZINC000184832648 1430996761 /nfs/dbraw/zinc/99/67/61/1430996761.db2.gz PLGSFTPJYBDESX-CJNGLKHVSA-N 0 0 375.425 3.363 20 5 GGBDRN 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CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](O)COc1cccc(C)c1 ZINC000184847837 1431002093 /nfs/dbraw/zinc/00/20/93/1431002093.db2.gz AHLJDUOXSYBSJW-MJGOQNOKSA-N 0 0 386.448 3.028 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](O)COc1cccc(C)c1 ZINC000184847874 1431002415 /nfs/dbraw/zinc/00/24/15/1431002415.db2.gz AHLJDUOXSYBSJW-IEBWSBKVSA-N 0 0 386.448 3.028 20 5 GGBDRN Cc1ccc2c(c1)nc(CNC(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)n2C ZINC000184853746 1431003754 /nfs/dbraw/zinc/00/37/54/1431003754.db2.gz KECGWCANTXFLNO-UHFFFAOYSA-N 0 0 377.404 3.130 20 5 GGBDRN CCc1c(C)sc2[nH]c(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])nc(=O)c12 ZINC000184855510 1431004926 /nfs/dbraw/zinc/00/49/26/1431004926.db2.gz DZEPUBZMFQEGDT-UHFFFAOYSA-N 0 0 389.433 3.372 20 5 GGBDRN C[C@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ncc(-c2ccccc2)o1 ZINC000184859623 1431005246 /nfs/dbraw/zinc/00/52/46/1431005246.db2.gz OVQDZIURFLJUFI-AWEZNQCLSA-N 0 0 392.415 3.490 20 5 GGBDRN 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NC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)C1 ZINC000184909132 1431019065 /nfs/dbraw/zinc/01/90/65/1431019065.db2.gz LWHNGCLPBBICGM-CQSZACIVSA-N 0 0 391.493 3.215 20 5 GGBDRN C[C@@H](C(=O)N1CCC[C@@H](c2nnc3ccccn32)C1)c1ccc([N+](=O)[O-])cc1F ZINC000184932414 1431024796 /nfs/dbraw/zinc/02/47/96/1431024796.db2.gz PFYDKPDHXHFCOX-ZIAGYGMSSA-N 0 0 397.410 3.286 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCC(c2ccc(Cl)cc2)CC1 ZINC000184953187 1431029195 /nfs/dbraw/zinc/02/91/95/1431029195.db2.gz RHRSWULGPUMMQW-UHFFFAOYSA-N 0 0 377.832 3.034 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000184957904 1431030325 /nfs/dbraw/zinc/03/03/25/1431030325.db2.gz MPXYYRMIUASUKV-CYBMUJFWSA-N 0 0 386.429 3.426 20 5 GGBDRN C[C@@H]1Cc2cc(S(=O)(=O)Nc3ccc([N+](=O)[O-])c4ncccc34)ccc2O1 ZINC000184965407 1431032623 /nfs/dbraw/zinc/03/26/23/1431032623.db2.gz NDIHXMOVULZBMF-LLVKDONJSA-N 0 0 385.401 3.267 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2C[C@H]3CCC(=O)c4cccc2c43)cc1C ZINC000184970005 1431033297 /nfs/dbraw/zinc/03/32/97/1431033297.db2.gz RORWXWVMJTXCJY-CYBMUJFWSA-N 0 0 386.429 3.481 20 5 GGBDRN COc1cc(C)c(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000184975055 1431034434 /nfs/dbraw/zinc/03/44/34/1431034434.db2.gz QICRTNNMTSTONO-LBPRGKRZSA-N 0 0 389.383 3.175 20 5 GGBDRN COc1cc(C)c(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000184975036 1431034510 /nfs/dbraw/zinc/03/45/10/1431034510.db2.gz QICRTNNMTSTONO-GFCCVEGCSA-N 0 0 389.383 3.175 20 5 GGBDRN C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O ZINC000184995474 1431037995 /nfs/dbraw/zinc/03/79/95/1431037995.db2.gz UKFQLHUNGFZGSK-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@H](C(=O)N1CCN(Cc2cccc(F)c2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184998958 1431038899 /nfs/dbraw/zinc/03/88/99/1431038899.db2.gz TZUNUEDYLJIOLC-AWEZNQCLSA-N 0 0 389.402 3.321 20 5 GGBDRN C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(Cc2c(F)cccc2[N+](=O)[O-])C1=O ZINC000184998207 1431038925 /nfs/dbraw/zinc/03/89/25/1431038925.db2.gz MCTQPRNAIFMDJW-KRWDZBQOSA-N 0 0 395.749 3.494 20 5 GGBDRN CCOC(=O)c1csc(NC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000185007296 1431040957 /nfs/dbraw/zinc/04/09/57/1431040957.db2.gz MDVJYNQHDVKMRW-LBPRGKRZSA-N 0 0 377.422 3.435 20 5 GGBDRN C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C1=O ZINC000185009140 1431041163 /nfs/dbraw/zinc/04/11/63/1431041163.db2.gz DHQJBNFJSKJWBT-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000185009660 1431041587 /nfs/dbraw/zinc/04/15/87/1431041587.db2.gz WSNNBXZBLYFLJW-UHFFFAOYSA-N 0 0 376.800 3.238 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000185016290 1431042512 /nfs/dbraw/zinc/04/25/12/1431042512.db2.gz KOCIFPRGKRUSTN-KRWDZBQOSA-N 0 0 384.432 3.294 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C(=O)c2ccccc2)CC1 ZINC000185019192 1431042882 /nfs/dbraw/zinc/04/28/82/1431042882.db2.gz ITFGJYZOJDCIBS-SFHVURJKSA-N 0 0 395.459 3.148 20 5 GGBDRN CC(=O)N[C@H](C)CCc1ccc(C(=O)COc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000185036252 1431046339 /nfs/dbraw/zinc/04/63/39/1431046339.db2.gz WXKIYARUOLARFF-CYBMUJFWSA-N 0 0 388.395 3.453 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000185037400 1431046626 /nfs/dbraw/zinc/04/66/26/1431046626.db2.gz RYLCGRSQLIHZQC-GFCCVEGCSA-N 0 0 384.371 3.069 20 5 GGBDRN C[C@@H](C(=O)NC(C)(C)C(=O)NCC1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000185039238 1431047232 /nfs/dbraw/zinc/04/72/32/1431047232.db2.gz RGHMPIWJMSAHRJ-GFCCVEGCSA-N 0 0 379.432 3.039 20 5 GGBDRN COc1ccccc1S(=O)(=O)CCCNc1cc([N+](=O)[O-])c(C)cc1C ZINC000185046241 1431048712 /nfs/dbraw/zinc/04/87/12/1431048712.db2.gz IHARLHPQXTYKRB-UHFFFAOYSA-N 0 0 378.450 3.496 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cn1 ZINC000185048372 1431049028 /nfs/dbraw/zinc/04/90/28/1431049028.db2.gz KXFCAGJGHGKYRB-GFCCVEGCSA-N 0 0 383.383 3.043 20 5 GGBDRN CNC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000185065801 1431052620 /nfs/dbraw/zinc/05/26/20/1431052620.db2.gz PZYMLBBNULJMRR-UHFFFAOYSA-N 0 0 393.509 3.379 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000185097071 1431059966 /nfs/dbraw/zinc/05/99/66/1431059966.db2.gz PSZSACFFDTVZBF-AWEZNQCLSA-N 0 0 376.434 3.206 20 5 GGBDRN CCOC(=O)Cc1csc(NC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000185097749 1431060386 /nfs/dbraw/zinc/06/03/86/1431060386.db2.gz DLZUBLLPMTWXHJ-ZDUSSCGKSA-N 0 0 391.449 3.364 20 5 GGBDRN CCOC(=O)Cc1csc(NC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000185097767 1431060430 /nfs/dbraw/zinc/06/04/30/1431060430.db2.gz DLZUBLLPMTWXHJ-CYBMUJFWSA-N 0 0 391.449 3.364 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1ccc(C(=O)OC)cc1 ZINC000185105136 1431061914 /nfs/dbraw/zinc/06/19/14/1431061914.db2.gz XRQWJAHKAOBFDF-QGZVFWFLSA-N 0 0 384.432 3.309 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1ccc(C(=O)OC)cc1 ZINC000185105120 1431062109 /nfs/dbraw/zinc/06/21/09/1431062109.db2.gz XRQWJAHKAOBFDF-KRWDZBQOSA-N 0 0 384.432 3.309 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@H](O)COc2cc(C)c([N+](=O)[O-])cc2F)cc1 ZINC000185106902 1431062440 /nfs/dbraw/zinc/06/24/40/1431062440.db2.gz OZLQDMHZWAHLPT-INIZCTEOSA-N 0 0 391.395 3.383 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(Cn2cncn2)cc1 ZINC000185123488 1431066086 /nfs/dbraw/zinc/06/60/86/1431066086.db2.gz YHADDWDRRREDQQ-IBGZPJMESA-N 0 0 393.447 3.120 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c(Cl)c1 ZINC000185126583 1431066830 /nfs/dbraw/zinc/06/68/30/1431066830.db2.gz NKHSRCRVECQVIH-VIFPVBQESA-N 0 0 379.775 3.489 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC[C@@H](O)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000185134972 1431069657 /nfs/dbraw/zinc/06/96/57/1431069657.db2.gz QKZFYHPEJOFQKH-SJKOYZFVSA-N 0 0 384.392 3.038 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC[C@H](O)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000185134915 1431069695 /nfs/dbraw/zinc/06/96/95/1431069695.db2.gz QKZFYHPEJOFQKH-SJCJKPOMSA-N 0 0 384.392 3.038 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000185136393 1431070125 /nfs/dbraw/zinc/07/01/25/1431070125.db2.gz ZTVQVFXQLYZSAI-QGZVFWFLSA-N 0 0 394.836 3.068 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC[C@]3(C2)OCc2ccccc23)c1C ZINC000185139981 1431070509 /nfs/dbraw/zinc/07/05/09/1431070509.db2.gz JPPJILINBBWFRJ-LJQANCHMSA-N 0 0 388.445 3.032 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1F)C(=O)NC(=O)NCc1ccccc1 ZINC000185159835 1431074163 /nfs/dbraw/zinc/07/41/63/1431074163.db2.gz QGFLEJAUSRKFTB-NSHDSACASA-N 0 0 377.397 3.241 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1F)Nc1cccc(C(=O)NC2CC2)c1 ZINC000185158058 1431074233 /nfs/dbraw/zinc/07/42/33/1431074233.db2.gz VHCCZKYGGYEERL-UHFFFAOYSA-N 0 0 389.408 3.357 20 5 GGBDRN C[C@H](C(=O)N(Cc1ccncc1)C[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1F ZINC000185161406 1431075164 /nfs/dbraw/zinc/07/51/64/1431075164.db2.gz QUORRTPGUMIDFR-WMLDXEAASA-N 0 0 387.411 3.440 20 5 GGBDRN CC(C)(CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)C(N)=O ZINC000185164663 1431075951 /nfs/dbraw/zinc/07/59/51/1431075951.db2.gz LOGQAPUSZKXHMJ-UHFFFAOYSA-N 0 0 379.482 3.118 20 5 GGBDRN Cc1cc(NC(=O)Cn2cc([N+](=O)[O-])c(C3CC3)n2)n(-c2ccc(C)cc2)n1 ZINC000185166931 1431076058 /nfs/dbraw/zinc/07/60/58/1431076058.db2.gz QJQYEIFRKMHYBH-UHFFFAOYSA-N 0 0 380.408 3.110 20 5 GGBDRN COC(=O)CC1(CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CCCCC1 ZINC000185170559 1431076786 /nfs/dbraw/zinc/07/67/86/1431076786.db2.gz MLZHFKBOYNEVRU-CYBMUJFWSA-N 0 0 380.416 3.467 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N[C@@H](C)c2nc(C(C)(C)C)no2)cccc1[N+](=O)[O-] ZINC000185185357 1431079535 /nfs/dbraw/zinc/07/95/35/1431079535.db2.gz NGMYRHSRRJSHSQ-RYUDHWBXSA-N 0 0 375.429 3.262 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCC2(CCOCc3ccccc3)CC2)c1 ZINC000185185169 1431079693 /nfs/dbraw/zinc/07/96/93/1431079693.db2.gz UOHWPEMLFSOQEX-UHFFFAOYSA-N 0 0 390.461 3.260 20 5 GGBDRN COc1cccc(NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1[N+](=O)[O-] ZINC000185188724 1431080771 /nfs/dbraw/zinc/08/07/71/1431080771.db2.gz ZMOSIILKRYHSIC-UHFFFAOYSA-N 0 0 391.449 3.000 20 5 GGBDRN COc1cccc(N2CCC(C(=O)NCc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000185200050 1431083041 /nfs/dbraw/zinc/08/30/41/1431083041.db2.gz KWLZUFIALNKBDR-UHFFFAOYSA-N 0 0 387.411 3.275 20 5 GGBDRN C[C@@H](C(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185206218 1431084563 /nfs/dbraw/zinc/08/45/63/1431084563.db2.gz FZKGAHXRZPZSLG-ZBFHGGJFSA-N 0 0 399.422 3.002 20 5 GGBDRN CCOC(=O)c1nc(CC)oc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185217548 1431087476 /nfs/dbraw/zinc/08/74/76/1431087476.db2.gz WKGBPBUTTVRHKD-SECBINFHSA-N 0 0 379.344 3.203 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nncn1-c1ccccc1 ZINC000185229058 1431089714 /nfs/dbraw/zinc/08/97/14/1431089714.db2.gz HZJZDMGIOJTPDK-INIZCTEOSA-N 0 0 379.420 3.061 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000185229376 1431089891 /nfs/dbraw/zinc/08/98/91/1431089891.db2.gz RQFUSSHPJKWXEV-KRWDZBQOSA-N 0 0 383.448 3.230 20 5 GGBDRN COC(=O)c1ccc(Cl)c(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])c1C ZINC000185230818 1431090039 /nfs/dbraw/zinc/09/00/39/1431090039.db2.gz YVGSNNXDQFJDMD-UHFFFAOYSA-N 0 0 377.784 3.054 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)Nc1cc(C(F)(F)F)c[nH]c1=O ZINC000185237467 1431091291 /nfs/dbraw/zinc/09/12/91/1431091291.db2.gz JJIIEBNXONJSQF-UHFFFAOYSA-N 0 0 390.705 3.277 20 5 GGBDRN C[C@H](C(=O)NCCCC(=O)N1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1F ZINC000185238818 1431091389 /nfs/dbraw/zinc/09/13/89/1431091389.db2.gz LPUBSHPRXGSQBY-AWEZNQCLSA-N 0 0 399.422 3.323 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 ZINC000185237894 1431091426 /nfs/dbraw/zinc/09/14/26/1431091426.db2.gz ZDBNIVHGMFQNDC-KRWDZBQOSA-N 0 0 383.448 3.433 20 5 GGBDRN C[C@@H](C(=O)NCCCC(=O)N1Cc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000185237665 1431091430 /nfs/dbraw/zinc/09/14/30/1431091430.db2.gz TWZPKZMNUVBDEN-CQSZACIVSA-N 0 0 399.422 3.276 20 5 GGBDRN C[C@@H](C(=O)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185241530 1431092261 /nfs/dbraw/zinc/09/22/61/1431092261.db2.gz PYAXXUNMGCFYIA-KGLIPLIRSA-N 0 0 393.459 3.238 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1OCCC(N)=O ZINC000185246145 1431093032 /nfs/dbraw/zinc/09/30/32/1431093032.db2.gz YVSHCCQOLIBRRV-HNNXBMFYSA-N 0 0 385.420 3.056 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000185260199 1431095889 /nfs/dbraw/zinc/09/58/89/1431095889.db2.gz XVUKYEADYUKSOF-LSDHHAIUSA-N 0 0 387.402 3.164 20 5 GGBDRN C[C@@H](N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nc(C2CCCCC2)no1 ZINC000185261772 1431096171 /nfs/dbraw/zinc/09/61/71/1431096171.db2.gz IXPBUHJGFSJDRZ-CXAGYDPISA-N 0 0 399.451 3.482 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCN(C2CC2)c2ccc(F)cc21 ZINC000185261907 1431096189 /nfs/dbraw/zinc/09/61/89/1431096189.db2.gz UHFWZIZBITWMRE-UHFFFAOYSA-N 0 0 385.351 3.092 20 5 GGBDRN C[C@H](N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nc(C2CCCCC2)no1 ZINC000185261748 1431096233 /nfs/dbraw/zinc/09/62/33/1431096233.db2.gz IXPBUHJGFSJDRZ-SUMWQHHRSA-N 0 0 399.451 3.482 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(=O)N1CCCc2ccccc21 ZINC000185271097 1431097720 /nfs/dbraw/zinc/09/77/20/1431097720.db2.gz RZIBUVAGBQSWPE-QGZVFWFLSA-N 0 0 395.459 3.259 20 5 GGBDRN C[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC000185276196 1431097990 /nfs/dbraw/zinc/09/79/90/1431097990.db2.gz DJQUHIWRVVDDPS-HIFRSBDPSA-N 0 0 390.440 3.116 20 5 GGBDRN CCOC(=O)c1cc(N2CCN([C@@H](C)c3nccs3)CC2)ccc1[N+](=O)[O-] ZINC000185277048 1431098414 /nfs/dbraw/zinc/09/84/14/1431098414.db2.gz JWPIHQARFPCRKA-ZDUSSCGKSA-N 0 0 390.465 3.111 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCNC(=O)c1cccs1 ZINC000185288656 1431100615 /nfs/dbraw/zinc/10/06/15/1431100615.db2.gz VSFRJJPJFWLUPD-HNNXBMFYSA-N 0 0 389.477 3.161 20 5 GGBDRN COCc1c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1 ZINC000185288958 1431100862 /nfs/dbraw/zinc/10/08/62/1431100862.db2.gz ABBSMBRXOHHWMN-UHFFFAOYSA-N 0 0 380.404 3.199 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cc(F)cc2c1OCOC2 ZINC000185301386 1431105789 /nfs/dbraw/zinc/10/57/89/1431105789.db2.gz APSZYWTYVXCAQA-AWEZNQCLSA-N 0 0 388.395 3.486 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1ncc(C)s1)C1CC1 ZINC000185307245 1431107857 /nfs/dbraw/zinc/10/78/57/1431107857.db2.gz KYAMWPZXGGGEBB-INIZCTEOSA-N 0 0 376.438 3.048 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-n2nnnc2C)ccc1F ZINC000185306880 1431107953 /nfs/dbraw/zinc/10/79/53/1431107953.db2.gz OZDLBBOCFDICBI-AWEZNQCLSA-N 0 0 398.398 3.225 20 5 GGBDRN O=C(CN1CC[C@@H](c2c(F)cccc2F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000185314700 1431110587 /nfs/dbraw/zinc/11/05/87/1431110587.db2.gz FFYIVGFQKVKWCP-CQSZACIVSA-N 0 0 387.386 3.252 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c1[N+](=O)[O-] ZINC000185321932 1431113446 /nfs/dbraw/zinc/11/34/46/1431113446.db2.gz HZMINCPPCIZLHF-UHFFFAOYSA-N 0 0 380.404 3.047 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)Nc1ccn(Cc2ccncc2)n1 ZINC000185343967 1431121075 /nfs/dbraw/zinc/12/10/75/1431121075.db2.gz NGEFRWGFCNSYAQ-UHFFFAOYSA-N 0 0 386.799 3.210 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3c(F)cccc3Cl)CC2)c1[N+](=O)[O-] ZINC000185349409 1431122844 /nfs/dbraw/zinc/12/28/44/1431122844.db2.gz SOVXVINQWWPKCO-UHFFFAOYSA-N 0 0 393.802 3.358 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H](C(=O)OC)c2ccccc21 ZINC000185359778 1431125777 /nfs/dbraw/zinc/12/57/77/1431125777.db2.gz MXWVEAIQEYDVLP-MAUKXSAKSA-N 0 0 382.416 3.467 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H](C(=O)OC)c2ccccc21 ZINC000185359758 1431125893 /nfs/dbraw/zinc/12/58/93/1431125893.db2.gz MXWVEAIQEYDVLP-QAPCUYQASA-N 0 0 382.416 3.467 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O ZINC000185362863 1431126469 /nfs/dbraw/zinc/12/64/69/1431126469.db2.gz BEXAVIYPDRZSLA-CRAIPNDOSA-N 0 0 399.422 3.224 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1nnnn1-c1ccccc1 ZINC000185372199 1431128427 /nfs/dbraw/zinc/12/84/27/1431128427.db2.gz DYODLCSHFZJCIH-GDBMZVCRSA-N 0 0 394.435 3.017 20 5 GGBDRN C[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc(Cc2ccccc2)no1 ZINC000185381714 1431131126 /nfs/dbraw/zinc/13/11/26/1431131126.db2.gz MPSTZVHDAOJZII-AWEZNQCLSA-N 0 0 395.419 3.248 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)c2ncccc12 ZINC000185381282 1431131140 /nfs/dbraw/zinc/13/11/40/1431131140.db2.gz UCBAECIKSCROTH-UHFFFAOYSA-N 0 0 396.428 3.145 20 5 GGBDRN CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185392573 1431134511 /nfs/dbraw/zinc/13/45/11/1431134511.db2.gz KDYNHKMZFZEMLU-UHFFFAOYSA-N 0 0 375.381 3.103 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)c2ncccc12 ZINC000185400135 1431136412 /nfs/dbraw/zinc/13/64/12/1431136412.db2.gz FEJTZOSQVQTXOW-HIFRSBDPSA-N 0 0 375.450 3.486 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000185401404 1431136899 /nfs/dbraw/zinc/13/68/99/1431136899.db2.gz FUTWICRYHVFIJX-INIZCTEOSA-N 0 0 391.468 3.367 20 5 GGBDRN C[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1nc(Cc2ccccc2)no1 ZINC000185404385 1431137426 /nfs/dbraw/zinc/13/74/26/1431137426.db2.gz RKJHULWUXVVXKV-UONOGXRCSA-N 0 0 395.419 3.246 20 5 GGBDRN COc1ccccc1-c1nc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)n[nH]1 ZINC000185430349 1431143904 /nfs/dbraw/zinc/14/39/04/1431143904.db2.gz LVUFXDZGYAUNEB-JTQLQIEISA-N 0 0 385.355 3.270 20 5 GGBDRN Cn1cc([C@@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)c2ccc(F)cc2)cn1 ZINC000185431426 1431144161 /nfs/dbraw/zinc/14/41/61/1431144161.db2.gz WHIFGOCWLJBEDJ-IBGZPJMESA-N 0 0 381.367 3.488 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CC(N)=O)C1CCCCC1 ZINC000185434680 1431144951 /nfs/dbraw/zinc/14/49/51/1431144951.db2.gz XICITBWPAGQDIF-CRAIPNDOSA-N 0 0 375.469 3.104 20 5 GGBDRN C[C@H](c1ccsc1)N1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000185442071 1431146457 /nfs/dbraw/zinc/14/64/57/1431146457.db2.gz IPBDBDXZILHOGD-CQSZACIVSA-N 0 0 389.477 3.402 20 5 GGBDRN CC(C)CN(CC(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185451670 1431148374 /nfs/dbraw/zinc/14/83/74/1431148374.db2.gz ZPBLWBHYTPSJMD-UHFFFAOYSA-N 0 0 391.371 3.352 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccco1)C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000185452053 1431148972 /nfs/dbraw/zinc/14/89/72/1431148972.db2.gz GEQOEECQKHMAOS-INIZCTEOSA-N 0 0 382.376 3.129 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)[C@@H]1CC(=O)Nc2cc(F)ccc21 ZINC000185453177 1431149135 /nfs/dbraw/zinc/14/91/35/1431149135.db2.gz IEMHVVDGVDGSKH-CYBMUJFWSA-N 0 0 380.335 3.347 20 5 GGBDRN CCN(CCc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185474108 1431153426 /nfs/dbraw/zinc/15/34/26/1431153426.db2.gz MIWJKFQSEMROFU-UHFFFAOYSA-N 0 0 385.445 3.396 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCN([C@@H](C)c2ccsc2)CC1 ZINC000185483698 1431155048 /nfs/dbraw/zinc/15/50/48/1431155048.db2.gz PIRKDUXMFNXVEH-HNNXBMFYSA-N 0 0 388.493 3.282 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCC[C@@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000185484507 1431155184 /nfs/dbraw/zinc/15/51/84/1431155184.db2.gz KQFYZOVRCYWRTP-CQSZACIVSA-N 0 0 397.431 3.264 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCN([C@@H](C)c2ccsc2)CC1 ZINC000185493737 1431157403 /nfs/dbraw/zinc/15/74/03/1431157403.db2.gz GUOQNFJLBRLLED-HNNXBMFYSA-N 0 0 388.493 3.282 20 5 GGBDRN Cc1cc([C@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)c(C)o1 ZINC000185502848 1431159342 /nfs/dbraw/zinc/15/93/42/1431159342.db2.gz AYKFXWXDSJTGKW-NSHDSACASA-N 0 0 375.406 3.392 20 5 GGBDRN COc1cccc(N2CCC(C(=O)NCc3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC000185512039 1431161652 /nfs/dbraw/zinc/16/16/52/1431161652.db2.gz YILRIEKEHIBQGO-UHFFFAOYSA-N 0 0 383.448 3.445 20 5 GGBDRN C[C@H](C(=O)Nc1cc(CSCCO)ccn1)c1ccc([N+](=O)[O-])cc1F ZINC000185550219 1431169170 /nfs/dbraw/zinc/16/91/70/1431169170.db2.gz WKWBPFXVGMDYPY-NSHDSACASA-N 0 0 379.413 3.097 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccnc(O[C@H]2CCOC2)c1 ZINC000185558561 1431170368 /nfs/dbraw/zinc/17/03/68/1431170368.db2.gz WVJZVTGZUYOUIE-LBPRGKRZSA-N 0 0 397.309 3.429 20 5 GGBDRN CCc1cc(NC(=O)c2ccc(N3CCCC3)nn2)c2cc([N+](=O)[O-])ccc2n1 ZINC000185570590 1431172979 /nfs/dbraw/zinc/17/29/79/1431172979.db2.gz SKJDJKKRZCFWPA-UHFFFAOYSA-N 0 0 392.419 3.348 20 5 GGBDRN C[C@H]1c2ccccc2CCN1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185602382 1431181181 /nfs/dbraw/zinc/18/11/81/1431181181.db2.gz QDQKRSBYOSLBKG-ZDUSSCGKSA-N 0 0 383.429 3.451 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCc3ccccc3C2)c2ncccc12 ZINC000185603390 1431181803 /nfs/dbraw/zinc/18/18/03/1431181803.db2.gz YFRLUBKXKSBHTG-UHFFFAOYSA-N 0 0 383.429 3.280 20 5 GGBDRN CC(C)(C)C(=O)N1CCC(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000185608055 1431182602 /nfs/dbraw/zinc/18/26/02/1431182602.db2.gz RQNFKBJXMDIPAY-UHFFFAOYSA-N 0 0 393.509 3.212 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000185616114 1431184846 /nfs/dbraw/zinc/18/48/46/1431184846.db2.gz BNAJWTDKVYAHCK-GFCCVEGCSA-N 0 0 389.358 3.136 20 5 GGBDRN O=C(CCc1cccc2c1OCO2)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000185622603 1431186988 /nfs/dbraw/zinc/18/69/88/1431186988.db2.gz GPJYWILJZOKEGZ-UHFFFAOYSA-N 0 0 380.360 3.081 20 5 GGBDRN CCS[C@H]1CCCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185628989 1431188669 /nfs/dbraw/zinc/18/86/69/1431188669.db2.gz OZMPFARZHHQXOK-ZDUSSCGKSA-N 0 0 395.506 3.439 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2ccccc2[C@H]1CO ZINC000185636678 1431190865 /nfs/dbraw/zinc/19/08/65/1431190865.db2.gz YPFVSAIWBQQQGH-GOSISDBHSA-N 0 0 395.440 3.450 20 5 GGBDRN CCOCc1ccccc1CNC(=O)COc1cc(C)c([N+](=O)[O-])cc1F ZINC000185650982 1431195714 /nfs/dbraw/zinc/19/57/14/1431195714.db2.gz REGNGKDESQFMHC-UHFFFAOYSA-N 0 0 376.384 3.274 20 5 GGBDRN Cc1csc(C(C)(C)NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)n1 ZINC000185651444 1431196158 /nfs/dbraw/zinc/19/61/58/1431196158.db2.gz RCAMDHNUSJGXIL-UHFFFAOYSA-N 0 0 392.462 3.122 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)c1[N+](=O)[O-] ZINC000185665670 1431200205 /nfs/dbraw/zinc/20/02/05/1431200205.db2.gz FIXMGDVVURIXNA-QGZVFWFLSA-N 0 0 379.420 3.298 20 5 GGBDRN Cc1cc(OCC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)c(F)cc1[N+](=O)[O-] ZINC000185680293 1431203736 /nfs/dbraw/zinc/20/37/36/1431203736.db2.gz STGHDVYPVGQESF-SFHVURJKSA-N 0 0 392.358 3.160 20 5 GGBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2ccccc2[C@@H]1CO ZINC000185685560 1431205574 /nfs/dbraw/zinc/20/55/74/1431205574.db2.gz ZVUZHWIXLMWURW-SFHVURJKSA-N 0 0 395.440 3.450 20 5 GGBDRN C[C@H](C(=O)Nc1cc(F)cc(N2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000185706716 1431211461 /nfs/dbraw/zinc/21/14/61/1431211461.db2.gz RQBSWZJAVBAZFU-LBPRGKRZSA-N 0 0 391.374 3.452 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)Cc1noc2ccccc21 ZINC000185717200 1431214372 /nfs/dbraw/zinc/21/43/72/1431214372.db2.gz CRZQBPBYLYZVCV-UHFFFAOYSA-N 0 0 389.433 3.476 20 5 GGBDRN Cc1c(NC(=O)N2CCN(c3nccc(C(C)C)n3)CC2)cccc1[N+](=O)[O-] ZINC000185716658 1431214550 /nfs/dbraw/zinc/21/45/50/1431214550.db2.gz LUFSBMFRKPOSDW-UHFFFAOYSA-N 0 0 384.440 3.171 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000185729856 1431217376 /nfs/dbraw/zinc/21/73/76/1431217376.db2.gz QEFHQPALAOSOLT-UHFFFAOYSA-N 0 0 399.369 3.179 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC(OCCc3ccccc3)CC2)c1 ZINC000185730214 1431217628 /nfs/dbraw/zinc/21/76/28/1431217628.db2.gz FNWDTQQXZUREFD-UHFFFAOYSA-N 0 0 390.461 3.007 20 5 GGBDRN Cc1cccc2nc(CSc3nc4cc([N+](=O)[O-])ccc4c(=O)n3C)cn21 ZINC000185733005 1431218540 /nfs/dbraw/zinc/21/85/40/1431218540.db2.gz NDPPANIUFVXXEU-UHFFFAOYSA-N 0 0 381.417 3.090 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N(Cc2cccc(F)c2)C[C@H]2CCCO2)c1 ZINC000185741330 1431220305 /nfs/dbraw/zinc/22/03/05/1431220305.db2.gz SDCZFYGWYKCUAG-QGZVFWFLSA-N 0 0 394.424 3.104 20 5 GGBDRN CO[C@@H](C)c1nc(CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)cs1 ZINC000185745722 1431222069 /nfs/dbraw/zinc/22/20/69/1431222069.db2.gz WYYMFTAUIHOMTF-VIFPVBQESA-N 0 0 392.462 3.298 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](Cc3ccccc3)C2)c2ncccc12 ZINC000185757129 1431226238 /nfs/dbraw/zinc/22/62/38/1431226238.db2.gz VAWMABIYRWNBCV-INIZCTEOSA-N 0 0 397.456 3.396 20 5 GGBDRN Cc1cnn(CCCCCSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)c1 ZINC000185760773 1431227375 /nfs/dbraw/zinc/22/73/75/1431227375.db2.gz OIGMARZIUYPACO-UHFFFAOYSA-N 0 0 387.465 3.309 20 5 GGBDRN C[C@H](Sc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C)C(=O)c1ccc(F)cc1 ZINC000185765971 1431229237 /nfs/dbraw/zinc/22/92/37/1431229237.db2.gz UPPCTEWCWGACAB-JTQLQIEISA-N 0 0 387.392 3.344 20 5 GGBDRN Cc1ccccc1NC(=O)[C@@H](C)Sc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C ZINC000185774033 1431231623 /nfs/dbraw/zinc/23/16/23/1431231623.db2.gz ZEQDFJIXVOLYJC-GFCCVEGCSA-N 0 0 398.444 3.269 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N(Cc2ccccc2)CC2CCOCC2)c1 ZINC000185779615 1431233578 /nfs/dbraw/zinc/23/35/78/1431233578.db2.gz PXPVVPHGZRMZSM-UHFFFAOYSA-N 0 0 390.461 3.212 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NC2CCC(O)(c3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000185796291 1431238285 /nfs/dbraw/zinc/23/82/85/1431238285.db2.gz PCRCFQRDDXLURS-SBGRQLAYSA-N 0 0 398.463 3.489 20 5 GGBDRN CN(C)c1cccc([C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000185810547 1431241412 /nfs/dbraw/zinc/24/14/12/1431241412.db2.gz GSSZPTYWKFGOLE-GOSISDBHSA-N 0 0 375.450 3.187 20 5 GGBDRN CN(C)c1cccc([C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000185810531 1431241637 /nfs/dbraw/zinc/24/16/37/1431241637.db2.gz GSSZPTYWKFGOLE-SFHVURJKSA-N 0 0 375.450 3.187 20 5 GGBDRN Cc1cnc(C(C)(C)NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)s1 ZINC000185834278 1431246777 /nfs/dbraw/zinc/24/67/77/1431246777.db2.gz XCKDLOOAOZPRAG-UHFFFAOYSA-N 0 0 392.462 3.122 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCS[C@H]3CCCC[C@@H]32)c2ncccc12 ZINC000185836607 1431247396 /nfs/dbraw/zinc/24/73/96/1431247396.db2.gz JYNLJMLVOBOLEL-GJZGRUSLSA-N 0 0 393.490 3.192 20 5 GGBDRN COc1ccc2c(c1)nc(CNCc1cc([N+](=O)[O-])ccc1OC(F)F)n2C ZINC000185839611 1431247986 /nfs/dbraw/zinc/24/79/86/1431247986.db2.gz LAGRKYGZAVSEGD-UHFFFAOYSA-N 0 0 392.362 3.381 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000185849496 1431251272 /nfs/dbraw/zinc/25/12/72/1431251272.db2.gz JKRDUDLWHHTFNS-KDOFPFPSSA-N 0 0 376.434 3.054 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2cc3ccccc3[nH]2)c2ncccc12 ZINC000185864635 1431255860 /nfs/dbraw/zinc/25/58/60/1431255860.db2.gz GMAXEVCOLJMFJI-UHFFFAOYSA-N 0 0 396.428 3.145 20 5 GGBDRN CN1Cc2cc(NC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)ccc2NC1=O ZINC000185874996 1431259252 /nfs/dbraw/zinc/25/92/52/1431259252.db2.gz CTJGGBGHAJPGAN-UHFFFAOYSA-N 0 0 392.375 3.010 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC(=O)CCC1CCCC1 ZINC000185909761 1431274814 /nfs/dbraw/zinc/27/48/14/1431274814.db2.gz QQTAPMLJMIYSBO-UHFFFAOYSA-N 0 0 375.450 3.473 20 5 GGBDRN O=C(Nc1cccc(-c2cc[nH]n2)c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000185911430 1431275404 /nfs/dbraw/zinc/27/54/04/1431275404.db2.gz YYIMPCFHPRODKU-UHFFFAOYSA-N 0 0 392.419 3.339 20 5 GGBDRN C[C@@H](CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1nccs1 ZINC000185914542 1431277105 /nfs/dbraw/zinc/27/71/05/1431277105.db2.gz XTGOBUQBOFXGNK-NSHDSACASA-N 0 0 392.462 3.024 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185915193 1431277690 /nfs/dbraw/zinc/27/76/90/1431277690.db2.gz YBCGIRXWDVKOBI-SUMWQHHRSA-N 0 0 398.444 3.310 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CCC(O)(c2ccccc2)CC1 ZINC000185921742 1431281143 /nfs/dbraw/zinc/28/11/43/1431281143.db2.gz AUIOHMRLIABXAO-UHFFFAOYSA-N 0 0 395.459 3.319 20 5 GGBDRN COc1ccccc1N1CCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])CC1 ZINC000185923772 1431281371 /nfs/dbraw/zinc/28/13/71/1431281371.db2.gz KXIYHCZOOASNMS-UHFFFAOYSA-N 0 0 387.461 3.288 20 5 GGBDRN COc1ccccc1C1(CNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)CCC1 ZINC000185923368 1431281720 /nfs/dbraw/zinc/28/17/20/1431281720.db2.gz FBCNKXQDNXBKEU-UHFFFAOYSA-N 0 0 386.452 3.045 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000185942530 1431288782 /nfs/dbraw/zinc/28/87/82/1431288782.db2.gz KKXIAQOQQVJHAF-UHFFFAOYSA-N 0 0 375.425 3.418 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C12CCOCC2 ZINC000185948287 1431291185 /nfs/dbraw/zinc/29/11/85/1431291185.db2.gz DSGNJPVDYHDENX-HZPDHXFCSA-N 0 0 397.859 3.022 20 5 GGBDRN CN1Cc2cc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)ccc2NC1=O ZINC000185959706 1431297704 /nfs/dbraw/zinc/29/77/04/1431297704.db2.gz OBRCOBFLDLXRHV-UHFFFAOYSA-N 0 0 381.392 3.399 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cc(F)cc1[N+](=O)[O-] ZINC000185961899 1431298228 /nfs/dbraw/zinc/29/82/28/1431298228.db2.gz LWHHVQRJNJUEAD-HNNXBMFYSA-N 0 0 379.775 3.183 20 5 GGBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000185973617 1431302288 /nfs/dbraw/zinc/30/22/88/1431302288.db2.gz AFIYDWAZVXYBEW-UHFFFAOYSA-N 0 0 398.444 3.216 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000185982931 1431304409 /nfs/dbraw/zinc/30/44/09/1431304409.db2.gz QBEWRGVJJWQNCS-LJQANCHMSA-N 0 0 397.410 3.398 20 5 GGBDRN COC(=O)[C@H](C)Cc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000185983727 1431305024 /nfs/dbraw/zinc/30/50/24/1431305024.db2.gz IUYIWBIQDREXMJ-CQSZACIVSA-N 0 0 385.420 3.021 20 5 GGBDRN CC(C)Oc1cc(CN(C2CC2)S(=O)(=O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000185989244 1431306310 /nfs/dbraw/zinc/30/63/10/1431306310.db2.gz YCBIBSLQXSNHMV-UHFFFAOYSA-N 0 0 391.449 3.130 20 5 GGBDRN Cc1nccn1C[C@@H]1CCCN1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186004413 1431309449 /nfs/dbraw/zinc/30/94/49/1431309449.db2.gz WGBQDYXIMFTICD-HNNXBMFYSA-N 0 0 377.832 3.127 20 5 GGBDRN CN(Cc1ccc([S@@](C)=O)cc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186005164 1431309551 /nfs/dbraw/zinc/30/95/51/1431309551.db2.gz NLVUEGPPGJJKIS-AREMUKBSSA-N 0 0 395.868 3.327 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccccc1 ZINC000186007676 1431309889 /nfs/dbraw/zinc/30/98/89/1431309889.db2.gz YEIYPCHEMHXDQU-NSHDSACASA-N 0 0 376.800 3.075 20 5 GGBDRN Cc1cccc([C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c2ccccn2)c1 ZINC000186014833 1431311482 /nfs/dbraw/zinc/31/14/82/1431311482.db2.gz YVYPZDAVHWGKJX-IBGZPJMESA-N 0 0 383.429 3.366 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)c2nc(C)cs2)cc1OC ZINC000186013592 1431311739 /nfs/dbraw/zinc/31/17/39/1431311739.db2.gz QBPONLQNAMXBOD-JTQLQIEISA-N 0 0 379.438 3.301 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 ZINC000186018059 1431312392 /nfs/dbraw/zinc/31/23/92/1431312392.db2.gz SSOCULQFMXTRTE-JKSUJKDBSA-N 0 0 393.871 3.293 20 5 GGBDRN COC(=O)c1cccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186019145 1431312474 /nfs/dbraw/zinc/31/24/74/1431312474.db2.gz XJYZNUFQFGCQIF-UHFFFAOYSA-N 0 0 377.784 3.034 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)ccn1 ZINC000186017445 1431312535 /nfs/dbraw/zinc/31/25/35/1431312535.db2.gz YYVQTAPSPPEPRA-UHFFFAOYSA-N 0 0 378.816 3.430 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)c(C)c1 ZINC000186026203 1431313746 /nfs/dbraw/zinc/31/37/46/1431313746.db2.gz VOHGFQANHKGCSW-OAHLLOKOSA-N 0 0 380.759 3.340 20 5 GGBDRN O=C(CN1CCC(C(=O)C(F)(F)F)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000186049465 1431319420 /nfs/dbraw/zinc/31/94/20/1431319420.db2.gz LMIBCZVECPEHJX-UHFFFAOYSA-N 0 0 393.749 3.030 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000186049300 1431319426 /nfs/dbraw/zinc/31/94/26/1431319426.db2.gz NLSXITBWXOAWDT-HNNXBMFYSA-N 0 0 392.408 3.160 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCO[C@H](CCc2ccccc2)C1 ZINC000186058304 1431321422 /nfs/dbraw/zinc/32/14/22/1431321422.db2.gz MTFFTSNTYNIXQI-LJQANCHMSA-N 0 0 383.448 3.175 20 5 GGBDRN COc1cc(C)c(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1F ZINC000186071101 1431324250 /nfs/dbraw/zinc/32/42/50/1431324250.db2.gz DESLTKFQALHCCR-UHFFFAOYSA-N 0 0 389.383 3.140 20 5 GGBDRN COCCC1(CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000186072966 1431324845 /nfs/dbraw/zinc/32/48/45/1431324845.db2.gz RDUBNUYOGYURPO-UHFFFAOYSA-N 0 0 384.498 3.044 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nnc(-c3c(F)cccc3Cl)s2)c1[N+](=O)[O-] ZINC000186108314 1431331899 /nfs/dbraw/zinc/33/18/99/1431331899.db2.gz DFHLIBPXJUEHDJ-UHFFFAOYSA-N 0 0 396.791 3.200 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000186118226 1431334307 /nfs/dbraw/zinc/33/43/07/1431334307.db2.gz XRPZVUCGRYFJPN-UHFFFAOYSA-N 0 0 394.313 3.094 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCC[C@@H]2CCCCO2)c(C(F)(F)F)c1 ZINC000186156565 1431343093 /nfs/dbraw/zinc/34/30/93/1431343093.db2.gz DTQXCLZQRRZQIL-LBPRGKRZSA-N 0 0 396.387 3.241 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@@H]1CCO[C@@]2(CCOC2)C1 ZINC000186171831 1431346347 /nfs/dbraw/zinc/34/63/47/1431346347.db2.gz GIQRKNXCPJUGBM-MWTRTKDXSA-N 0 0 393.439 3.036 20 5 GGBDRN Cc1nn(CCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)c(C)c1[N+](=O)[O-] ZINC000186184105 1431348321 /nfs/dbraw/zinc/34/83/21/1431348321.db2.gz DQNKXXIGUURPRT-ZDUSSCGKSA-N 0 0 378.379 3.093 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000186184041 1431348497 /nfs/dbraw/zinc/34/84/97/1431348497.db2.gz IAZAKZAWRGLTPG-KBPBESRZSA-N 0 0 389.431 3.416 20 5 GGBDRN Cn1nc(CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc21 ZINC000186193209 1431350156 /nfs/dbraw/zinc/35/01/56/1431350156.db2.gz IFPZOYDVFNCVQY-UHFFFAOYSA-N 0 0 390.346 3.055 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000186220221 1431355826 /nfs/dbraw/zinc/35/58/26/1431355826.db2.gz RIPNPEBNWGZIQV-QGZVFWFLSA-N 0 0 377.347 3.156 20 5 GGBDRN COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000186242984 1431360901 /nfs/dbraw/zinc/36/09/01/1431360901.db2.gz VDONFHJDKBAKNO-AWEZNQCLSA-N 0 0 385.420 3.387 20 5 GGBDRN O=C1[C@@H](Nc2cnn(Cc3ccccc3)c2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000186247457 1431362076 /nfs/dbraw/zinc/36/20/76/1431362076.db2.gz WUTQEJNUTMTSDF-IBGZPJMESA-N 0 0 377.404 3.057 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000186278071 1431369934 /nfs/dbraw/zinc/36/99/34/1431369934.db2.gz HMDUBISMZJLNGP-MRXNPFEDSA-N 0 0 380.397 3.172 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000186290619 1431372988 /nfs/dbraw/zinc/37/29/88/1431372988.db2.gz WHISZKKCWBWNFF-CQSZACIVSA-N 0 0 394.424 3.138 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cc2c(cc1F)NC(=O)CC2 ZINC000186309039 1431378563 /nfs/dbraw/zinc/37/85/63/1431378563.db2.gz GVFUGVSXGPDFKK-UHFFFAOYSA-N 0 0 377.759 3.202 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000186316816 1431380420 /nfs/dbraw/zinc/38/04/20/1431380420.db2.gz RGDXWJPFWVNQPL-KRWDZBQOSA-N 0 0 394.786 3.366 20 5 GGBDRN O=C(CC[C@H]1Cc2ccccc2NC1=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186319218 1431380978 /nfs/dbraw/zinc/38/09/78/1431380978.db2.gz BAINWWOREYPMAV-ZDUSSCGKSA-N 0 0 387.823 3.456 20 5 GGBDRN CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186320429 1431381287 /nfs/dbraw/zinc/38/12/87/1431381287.db2.gz QIPYZIFPMDUORA-AWEZNQCLSA-N 0 0 399.900 3.202 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC(=O)Nc2cc(F)ccc21 ZINC000186322872 1431382561 /nfs/dbraw/zinc/38/25/61/1431382561.db2.gz MOOUHTPOSNCOCW-ZDUSSCGKSA-N 0 0 377.759 3.130 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)cc(F)cc1[N+](=O)[O-] ZINC000186324944 1431382883 /nfs/dbraw/zinc/38/28/83/1431382883.db2.gz BTXVNHURRLTRLZ-OAHLLOKOSA-N 0 0 397.765 3.322 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCN1C(=O)c1cccs1 ZINC000186328220 1431383687 /nfs/dbraw/zinc/38/36/87/1431383687.db2.gz SFCXNVZLESOCST-AWEZNQCLSA-N 0 0 393.852 3.231 20 5 GGBDRN Cc1cc(C)n(-c2ccc(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)cn2)n1 ZINC000186329113 1431384451 /nfs/dbraw/zinc/38/44/51/1431384451.db2.gz QVDPDLGXCQZPKX-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN Cc1cc(=O)c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)nn1-c1ccccc1 ZINC000186336339 1431386299 /nfs/dbraw/zinc/38/62/99/1431386299.db2.gz JXPAAXPBIBAWEM-UHFFFAOYSA-N 0 0 398.806 3.033 20 5 GGBDRN C[C@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)NC(=O)c1ccccc1 ZINC000186340404 1431387238 /nfs/dbraw/zinc/38/72/38/1431387238.db2.gz CHNGPLRCNIWJHO-GFCCVEGCSA-N 0 0 375.812 3.073 20 5 GGBDRN O=C(CCN1C(=O)CCc2ccccc21)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186345315 1431388307 /nfs/dbraw/zinc/38/83/07/1431388307.db2.gz MBRSWZDNXUPALZ-UHFFFAOYSA-N 0 0 387.823 3.234 20 5 GGBDRN O=C(CCc1nc(-c2ccoc2)no1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186345403 1431388450 /nfs/dbraw/zinc/38/84/50/1431388450.db2.gz NUNQUTQZESWWRU-UHFFFAOYSA-N 0 0 376.756 3.140 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 ZINC000186348317 1431388932 /nfs/dbraw/zinc/38/89/32/1431388932.db2.gz HRTUVEAFISIGDJ-LSDHHAIUSA-N 0 0 388.807 3.439 20 5 GGBDRN CCN(C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)[C@H](C)Cc1ccsc1 ZINC000186350210 1431389140 /nfs/dbraw/zinc/38/91/40/1431389140.db2.gz HFBNZFFTISTNMO-CYBMUJFWSA-N 0 0 385.449 3.330 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](CCc2ccccc2)C1 ZINC000186354331 1431390007 /nfs/dbraw/zinc/39/00/07/1431390007.db2.gz YSHZNWKPXGQHSU-KRWDZBQOSA-N 0 0 385.420 3.469 20 5 GGBDRN Cc1cc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)cc([N+](=O)[O-])c1 ZINC000186381180 1431396617 /nfs/dbraw/zinc/39/66/17/1431396617.db2.gz AOOFCUJNAFGQEX-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000186395140 1431399868 /nfs/dbraw/zinc/39/98/68/1431399868.db2.gz NVJGSZKXUKFPEZ-UHFFFAOYSA-N 0 0 390.386 3.316 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)c1 ZINC000186397587 1431400901 /nfs/dbraw/zinc/40/09/01/1431400901.db2.gz UWZLIGNRNBTTJE-UHFFFAOYSA-N 0 0 392.358 3.005 20 5 GGBDRN CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000186398378 1431401008 /nfs/dbraw/zinc/40/10/08/1431401008.db2.gz KEDPTQUXEFCMSO-RDTXWAMCSA-N 0 0 381.432 3.077 20 5 GGBDRN NC(=O)c1ccc(N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000186401848 1431402708 /nfs/dbraw/zinc/40/27/08/1431402708.db2.gz ZDMNNHMJDNVOHD-GFCCVEGCSA-N 0 0 394.353 3.403 20 5 GGBDRN CCCN(CC(=O)OC(C)(C)C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000186402551 1431403118 /nfs/dbraw/zinc/40/31/18/1431403118.db2.gz CJFNYLUHNABCCF-UHFFFAOYSA-N 0 0 391.468 3.389 20 5 GGBDRN Cn1c2ccccc2nc1C(C)(C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000186406255 1431404857 /nfs/dbraw/zinc/40/48/57/1431404857.db2.gz RSCYZNYWJRSWFL-UHFFFAOYSA-N 0 0 378.392 3.023 20 5 GGBDRN CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CCN1Cc1ccccc1 ZINC000186413037 1431407981 /nfs/dbraw/zinc/40/79/81/1431407981.db2.gz DELFBNDMKZNHIE-SFHVURJKSA-N 0 0 383.448 3.340 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)CCN1Cc1ccccc1 ZINC000186414557 1431409748 /nfs/dbraw/zinc/40/97/48/1431409748.db2.gz SQVMLTAFGFJJMT-GOSISDBHSA-N 0 0 383.448 3.340 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000186414650 1431409949 /nfs/dbraw/zinc/40/99/49/1431409949.db2.gz LJANKOSXSCRRFB-RMKNXTFCSA-N 0 0 388.370 3.396 20 5 GGBDRN Cc1ccc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000186425964 1431415031 /nfs/dbraw/zinc/41/50/31/1431415031.db2.gz FLAOQUQLIJMIFS-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCc1ccc(OCC(F)(F)F)nc1 ZINC000186429450 1431415971 /nfs/dbraw/zinc/41/59/71/1431415971.db2.gz PGKZSSKWMOPBIU-UHFFFAOYSA-N 0 0 397.353 3.222 20 5 GGBDRN O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000186429426 1431416063 /nfs/dbraw/zinc/41/60/63/1431416063.db2.gz IYRKVGNCINGFCR-UHFFFAOYSA-N 0 0 387.289 3.043 20 5 GGBDRN CN(C)C(=O)c1cc(F)ccc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000186428120 1431416187 /nfs/dbraw/zinc/41/61/87/1431416187.db2.gz YCWRVRCYABKDCV-UHFFFAOYSA-N 0 0 386.383 3.262 20 5 GGBDRN CSc1cccc(C(=O)Nc2ccn(CCc3ccncc3)n2)c1[N+](=O)[O-] ZINC000186430128 1431416808 /nfs/dbraw/zinc/41/68/08/1431416808.db2.gz KDIDYJHVNIDKOW-UHFFFAOYSA-N 0 0 383.433 3.403 20 5 GGBDRN CSc1cccc(C(=O)NCCNC(=O)CC2CCCCC2)c1[N+](=O)[O-] ZINC000186435975 1431419487 /nfs/dbraw/zinc/41/94/87/1431419487.db2.gz UOGGZOTXIZTVDW-UHFFFAOYSA-N 0 0 379.482 3.133 20 5 GGBDRN C[C@H]1CCCCN(C(=O)c2cc([N+](=O)[O-])ccc2I)C1 ZINC000186447214 1431422105 /nfs/dbraw/zinc/42/21/05/1431422105.db2.gz OUSSEXKLVZATHV-JTQLQIEISA-N 0 0 388.205 3.462 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC[C@H](C)C1 ZINC000186455357 1431423579 /nfs/dbraw/zinc/42/35/79/1431423579.db2.gz XBBVENWHNNQLLP-WMLDXEAASA-N 0 0 393.509 3.095 20 5 GGBDRN CSc1cccc(C(=O)NCCc2nc3ccc(F)cc3n2C)c1[N+](=O)[O-] ZINC000186476974 1431430037 /nfs/dbraw/zinc/43/00/37/1431430037.db2.gz BLKWFXRGQOOWDQ-UHFFFAOYSA-N 0 0 388.424 3.315 20 5 GGBDRN CSc1cccc(C(=O)NCCCNC(=O)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000186484361 1431432760 /nfs/dbraw/zinc/43/27/60/1431432760.db2.gz MIZZKZROVLBBHT-UHFFFAOYSA-N 0 0 391.424 3.006 20 5 GGBDRN CSc1cccc(C(=O)NCCCNC(=O)c2cccc(F)c2)c1[N+](=O)[O-] ZINC000186485453 1431433708 /nfs/dbraw/zinc/43/37/08/1431433708.db2.gz ILWRNUZVUGZBOK-UHFFFAOYSA-N 0 0 391.424 3.006 20 5 GGBDRN Cn1cc(CNc2ccc(OC3COC3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186504568 1431439981 /nfs/dbraw/zinc/43/99/81/1431439981.db2.gz JXSRCNRKNXBURD-UHFFFAOYSA-N 0 0 380.404 3.385 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)cc1C ZINC000186507012 1431440808 /nfs/dbraw/zinc/44/08/08/1431440808.db2.gz AKNXGNVQUSWDGN-BLLLJJGKSA-N 0 0 375.450 3.378 20 5 GGBDRN COc1ccccc1[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)OC(C)C ZINC000186523622 1431445763 /nfs/dbraw/zinc/44/57/63/1431445763.db2.gz YDYOFWCCCKNCTB-KRWDZBQOSA-N 0 0 391.399 3.221 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000186531607 1431447852 /nfs/dbraw/zinc/44/78/52/1431447852.db2.gz UYMGEZKANMLZMV-LLVKDONJSA-N 0 0 387.421 3.375 20 5 GGBDRN O=C(Nc1ccc(CN2C(=O)CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000186554953 1431452317 /nfs/dbraw/zinc/45/23/17/1431452317.db2.gz CSWMTUYZYBKVCL-UHFFFAOYSA-N 0 0 385.351 3.025 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNC(C)(C)c1nc2ccccc2n1C ZINC000186558952 1431453948 /nfs/dbraw/zinc/45/39/48/1431453948.db2.gz CQIYAGZCTZNVBK-UHFFFAOYSA-N 0 0 381.436 3.253 20 5 GGBDRN CSc1cccc(C(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)c1[N+](=O)[O-] ZINC000186592694 1431462772 /nfs/dbraw/zinc/46/27/72/1431462772.db2.gz LENSHJIQANDFKF-IUODEOHRSA-N 0 0 385.445 3.241 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 ZINC000186603827 1431466303 /nfs/dbraw/zinc/46/63/03/1431466303.db2.gz UNDYZRSYPGGOAJ-HNNXBMFYSA-N 0 0 390.443 3.197 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CC[C@]4(C3)OCc3ccccc34)o2)cc1 ZINC000186616767 1431470091 /nfs/dbraw/zinc/47/00/91/1431470091.db2.gz DVSUHWXNVASROH-HXUWFJFHSA-N 0 0 378.388 3.276 20 5 GGBDRN CCc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1OC ZINC000186654282 1431482151 /nfs/dbraw/zinc/48/21/51/1431482151.db2.gz AQELVJHKRPWSGJ-UHFFFAOYSA-N 0 0 380.404 3.282 20 5 GGBDRN CCc1c(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1OC ZINC000186659636 1431483508 /nfs/dbraw/zinc/48/35/08/1431483508.db2.gz JPSUFBIVTUGZKG-UHFFFAOYSA-N 0 0 394.431 3.324 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])c1 ZINC000186688140 1431492826 /nfs/dbraw/zinc/49/28/26/1431492826.db2.gz GKKDEJKISTZZEO-NRFANRHFSA-N 0 0 397.431 3.063 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000186709464 1431497713 /nfs/dbraw/zinc/49/77/13/1431497713.db2.gz STZXVLKKVGKWJI-CKFHNAJUSA-N 0 0 384.436 3.006 20 5 GGBDRN O=C(CN1CC[C@]2(C1)OCc1ccccc12)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186715495 1431499400 /nfs/dbraw/zinc/49/94/00/1431499400.db2.gz LMDVILBPNWAJHR-LJQANCHMSA-N 0 0 387.823 3.318 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccccc1[N+](=O)[O-] ZINC000186717025 1431499938 /nfs/dbraw/zinc/49/99/38/1431499938.db2.gz YKTMLLSFYIWQDX-CYBMUJFWSA-N 0 0 393.321 3.149 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N2CC[C@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000186716937 1431500367 /nfs/dbraw/zinc/50/03/67/1431500367.db2.gz SPQBPBCFMKCQHH-QVKFZJNVSA-N 0 0 381.432 3.362 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000186734757 1431504628 /nfs/dbraw/zinc/50/46/28/1431504628.db2.gz YISIQOAJORPROG-UHFFFAOYSA-N 0 0 395.337 3.490 20 5 GGBDRN Nc1c(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)cc(F)cc1[N+](=O)[O-] ZINC000186738991 1431506153 /nfs/dbraw/zinc/50/61/53/1431506153.db2.gz BZEDQSDEBJMNFM-UHFFFAOYSA-N 0 0 398.316 3.446 20 5 GGBDRN CCCc1c(NC(=O)c2cc([N+](=O)[O-])cnc2N)cnn1-c1cccc(F)c1 ZINC000186744255 1431506517 /nfs/dbraw/zinc/50/65/17/1431506517.db2.gz BICJVBATOIQIOZ-UHFFFAOYSA-N 0 0 384.371 3.102 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC1CCN(CC(F)(F)F)CC1 ZINC000186753368 1431508637 /nfs/dbraw/zinc/50/86/37/1431508637.db2.gz OVBPCNSLBQBGJV-UHFFFAOYSA-N 0 0 388.390 3.011 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1Cc2ccccc2C2(CC2)C1 ZINC000186758679 1431509410 /nfs/dbraw/zinc/50/94/10/1431509410.db2.gz COBZSEKFEFPKKN-UHFFFAOYSA-N 0 0 385.807 3.261 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1Cc2ccccc2C2(CC2)C1 ZINC000186757345 1431509416 /nfs/dbraw/zinc/50/94/16/1431509416.db2.gz UPRJMOBPIGFCHP-UHFFFAOYSA-N 0 0 379.416 3.224 20 5 GGBDRN CSc1cccc(C(=O)N[C@H]2CCCn3nc(C(C)C)nc32)c1[N+](=O)[O-] ZINC000186784185 1431515904 /nfs/dbraw/zinc/51/59/04/1431515904.db2.gz RPLZHRAFLNKUBL-LBPRGKRZSA-N 0 0 375.454 3.297 20 5 GGBDRN O=C(CSc1nc2cncnc2[nH]1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000186787064 1431516592 /nfs/dbraw/zinc/51/65/92/1431516592.db2.gz KTYGUTUABUTFPM-UHFFFAOYSA-N 0 0 398.326 3.011 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)OCc2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000186790345 1431517520 /nfs/dbraw/zinc/51/75/20/1431517520.db2.gz VCKZKYHBTDCTJT-UHFFFAOYSA-N 0 0 375.358 3.102 20 5 GGBDRN Cn1cc([C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000186801618 1431520644 /nfs/dbraw/zinc/52/06/44/1431520644.db2.gz VXZFRVKHSCJTNL-FQEVSTJZSA-N 0 0 397.410 3.175 20 5 GGBDRN C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCc1cc(COC(C)(C)C)on1 ZINC000186822946 1431528343 /nfs/dbraw/zinc/52/83/43/1431528343.db2.gz AGAGSKVKZJOILJ-CYBMUJFWSA-N 0 0 390.440 3.405 20 5 GGBDRN O=C(Nc1ccc(-c2cn3ccsc3n2)cc1)c1cnc(O)c([N+](=O)[O-])c1 ZINC000186825473 1431529325 /nfs/dbraw/zinc/52/93/25/1431529325.db2.gz SEKSQDDMOBRXDX-UHFFFAOYSA-N 0 0 381.373 3.324 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCN(C3CC3)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000186824338 1431529424 /nfs/dbraw/zinc/52/94/24/1431529424.db2.gz KFNNFCSOYVUTJK-UHFFFAOYSA-N 0 0 395.415 3.401 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCSC4(CCOCC4)C3)co2)cc1 ZINC000186834408 1431532276 /nfs/dbraw/zinc/53/22/76/1431532276.db2.gz DURMULKLFFFVQW-UHFFFAOYSA-N 0 0 375.450 3.348 20 5 GGBDRN Cc1cccc(C(=O)NCC2=CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000186844281 1431536705 /nfs/dbraw/zinc/53/67/05/1431536705.db2.gz BRMWFGBVXBNHEK-UHFFFAOYSA-N 0 0 375.425 3.200 20 5 GGBDRN Cn1cc([C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000186848498 1431539502 /nfs/dbraw/zinc/53/95/02/1431539502.db2.gz PBCDJARDCWTTHH-FQEVSTJZSA-N 0 0 398.394 3.142 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(Cc3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000186856525 1431542491 /nfs/dbraw/zinc/54/24/91/1431542491.db2.gz OKTVDKJGLZSXRA-UHFFFAOYSA-N 0 0 389.452 3.414 20 5 GGBDRN COc1cc(C(=O)N2CCN(C3CC3)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000186863220 1431545056 /nfs/dbraw/zinc/54/50/56/1431545056.db2.gz RNXGICBROKOJHX-UHFFFAOYSA-N 0 0 383.404 3.241 20 5 GGBDRN CSc1cccc(C(=O)N[C@@](C)(C(N)=O)c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000186864138 1431545279 /nfs/dbraw/zinc/54/52/79/1431545279.db2.gz YAQQEYMYMSVIGM-QGZVFWFLSA-N 0 0 393.852 3.101 20 5 GGBDRN C[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@@H+]1Cc1ccccc1 ZINC000186869887 1431548053 /nfs/dbraw/zinc/54/80/53/1431548053.db2.gz JWUUBQQZSKJRTG-NVXWUHKLSA-N 0 0 383.448 3.426 20 5 GGBDRN Cc1cc(CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)ccc1-c1ccccc1 ZINC000186875693 1431549950 /nfs/dbraw/zinc/54/99/50/1431549950.db2.gz SUKMCNUHUQKFNC-UHFFFAOYSA-N 0 0 377.400 3.048 20 5 GGBDRN COc1ccc(C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)cc1[N+](=O)[O-] ZINC000186886426 1431555252 /nfs/dbraw/zinc/55/52/52/1431555252.db2.gz IPORBEUSOMSHGY-QGZVFWFLSA-N 0 0 378.331 3.095 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186897560 1431558215 /nfs/dbraw/zinc/55/82/15/1431558215.db2.gz KBRKRDPVDBRMBI-QFIPXVFZSA-N 0 0 393.443 3.467 20 5 GGBDRN COCCC1(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CCCCC1 ZINC000186925946 1431568007 /nfs/dbraw/zinc/56/80/07/1431568007.db2.gz HJDUXKRGHJNRPV-UHFFFAOYSA-N 0 0 397.859 3.290 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN3CCC(O)(Cc4cccc(F)c4)CC3)nc2c1 ZINC000186928500 1431568716 /nfs/dbraw/zinc/56/87/16/1431568716.db2.gz JAGZMOJQUSGSRI-UHFFFAOYSA-N 0 0 385.395 3.445 20 5 GGBDRN CN(CC1(O)CCCCCC1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000186938615 1431571771 /nfs/dbraw/zinc/57/17/71/1431571771.db2.gz LYRMSZKCOWLJOV-UHFFFAOYSA-N 0 0 389.496 3.355 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NCC2(CO)CCCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000186943483 1431572707 /nfs/dbraw/zinc/57/27/07/1431572707.db2.gz WFRMRZNFVONRIZ-HNNXBMFYSA-N 0 0 398.463 3.445 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000186957392 1431576396 /nfs/dbraw/zinc/57/63/96/1431576396.db2.gz SGUVDTHXKHUPLH-IBGZPJMESA-N 0 0 383.360 3.083 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@H](C)C[C@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000186982371 1431582581 /nfs/dbraw/zinc/58/25/81/1431582581.db2.gz OQJFVRUIDUZHTA-BBRMVZONSA-N 0 0 393.509 3.459 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@H](C)C[C@@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000186982412 1431582801 /nfs/dbraw/zinc/58/28/01/1431582801.db2.gz OQJFVRUIDUZHTA-XJKSGUPXSA-N 0 0 393.509 3.459 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(C)c(C)c1 ZINC000186984881 1431582930 /nfs/dbraw/zinc/58/29/30/1431582930.db2.gz NVMPKGHLADULIQ-ACJLOTCBSA-N 0 0 388.395 3.485 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(C)c(C)c1 ZINC000186984898 1431582943 /nfs/dbraw/zinc/58/29/43/1431582943.db2.gz NVMPKGHLADULIQ-FZKQIMNGSA-N 0 0 388.395 3.485 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cnc(-c2ccccc2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000186997009 1431585948 /nfs/dbraw/zinc/58/59/48/1431585948.db2.gz ZYILDVLBOSLTCF-CYBMUJFWSA-N 0 0 384.417 3.091 20 5 GGBDRN COC(=O)[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(C)c(C)c1 ZINC000186999535 1431586393 /nfs/dbraw/zinc/58/63/93/1431586393.db2.gz ULDONPUNFJMNFN-FQEVSTJZSA-N 0 0 395.415 3.266 20 5 GGBDRN 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CC[C@]1(CO)CCCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000187167433 1431636473 /nfs/dbraw/zinc/63/64/73/1431636473.db2.gz BXYPCWOPHSUJAW-NRFANRHFSA-N 0 0 389.496 3.456 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCc2cn(C)c3cc(Cl)ccc23)c1[N+](=O)[O-] ZINC000187195558 1431643510 /nfs/dbraw/zinc/64/35/10/1431643510.db2.gz RXBNXBHWZQODPF-UHFFFAOYSA-N 0 0 389.843 3.388 20 5 GGBDRN CC[C@]1(CO)CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000187194908 1431643512 /nfs/dbraw/zinc/64/35/12/1431643512.db2.gz YNAXMNHFRJMEBR-FQEVSTJZSA-N 0 0 375.469 3.210 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000187219532 1431652972 /nfs/dbraw/zinc/65/29/72/1431652972.db2.gz LXDPDONGPJUEKF-HXUWFJFHSA-N 0 0 391.431 3.445 20 5 GGBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000187221489 1431653993 /nfs/dbraw/zinc/65/39/93/1431653993.db2.gz LCJFMLRXUZDPKP-UHFFFAOYSA-N 0 0 398.350 3.268 20 5 GGBDRN CC(C)c1ccc(C(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1[N+](=O)[O-] ZINC000187239152 1431660998 /nfs/dbraw/zinc/66/09/98/1431660998.db2.gz AYERHNLSBZBMRJ-HNNXBMFYSA-N 0 0 398.463 3.268 20 5 GGBDRN COC(=O)C[C@@](C)(NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000187264482 1431672956 /nfs/dbraw/zinc/67/29/56/1431672956.db2.gz UWIZZVUCLXOQDS-OAQYLSRUSA-N 0 0 399.447 3.496 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000187279359 1431679422 /nfs/dbraw/zinc/67/94/22/1431679422.db2.gz VFHBMJRBABCDSS-UHFFFAOYSA-N 0 0 375.812 3.203 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000187284152 1431681573 /nfs/dbraw/zinc/68/15/73/1431681573.db2.gz HPIYRXUYPCRYAC-SGTLLEGYSA-N 0 0 391.374 3.274 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000187285514 1431682238 /nfs/dbraw/zinc/68/22/38/1431682238.db2.gz PXINVEPIMNGDGP-UHFFFAOYSA-N 0 0 375.812 3.203 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000187288206 1431682407 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JJRQVRSKFNWCRA-AWEZNQCLSA-N 0 0 387.461 3.447 20 5 GGBDRN O=C(Nc1cc(Cl)ccc1OC[C@H]1CCCCO1)c1n[nH]cc1[N+](=O)[O-] ZINC000187315999 1431694144 /nfs/dbraw/zinc/69/41/44/1431694144.db2.gz OEYFFNPFZSTVKU-LLVKDONJSA-N 0 0 380.788 3.172 20 5 GGBDRN Cc1coc2ccc(NC(=O)CN3C(=O)COc4ccc([N+](=O)[O-])cc43)cc12 ZINC000187337340 1431701500 /nfs/dbraw/zinc/70/15/00/1431701500.db2.gz PPPOIGHDRLOCPG-UHFFFAOYSA-N 0 0 381.344 3.014 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000187358446 1431707937 /nfs/dbraw/zinc/70/79/37/1431707937.db2.gz GHXSHKBUINZDQN-UHFFFAOYSA-N 0 0 391.811 3.290 20 5 GGBDRN O=C(c1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)cc1F)N1CCOCC1 ZINC000187363034 1431708842 /nfs/dbraw/zinc/70/88/42/1431708842.db2.gz OTBIOPRCPBUTEC-UHFFFAOYSA-N 0 0 393.802 3.472 20 5 GGBDRN CC[C@@H]1[C@@H](C)CCN1C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000187405055 1431720300 /nfs/dbraw/zinc/72/03/00/1431720300.db2.gz OSTJABWYMUWLBS-WCQYABFASA-N 0 0 375.454 3.135 20 5 GGBDRN CC[C@H]1[C@@H](C)CCN1C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000187405075 1431720459 /nfs/dbraw/zinc/72/04/59/1431720459.db2.gz OSTJABWYMUWLBS-AAEUAGOBSA-N 0 0 375.454 3.135 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CCCC[C@@H]3O)cc2[N+](=O)[O-])C1 ZINC000187413020 1431723015 /nfs/dbraw/zinc/72/30/15/1431723015.db2.gz NNCKTIDIKWJYQY-MVWRLGRASA-N 0 0 375.469 3.110 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1 ZINC000187427906 1431726926 /nfs/dbraw/zinc/72/69/26/1431726926.db2.gz GLFPELLBDCSCPC-LLVKDONJSA-N 0 0 394.353 3.205 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1 ZINC000187427881 1431726948 /nfs/dbraw/zinc/72/69/48/1431726948.db2.gz GLFPELLBDCSCPC-NSHDSACASA-N 0 0 394.353 3.205 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000187430893 1431727472 /nfs/dbraw/zinc/72/74/72/1431727472.db2.gz LFVDSNWGULYEIC-NSHDSACASA-N 0 0 394.353 3.205 20 5 GGBDRN CCOc1ccc(NC(=O)CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000187446166 1431732436 /nfs/dbraw/zinc/73/24/36/1431732436.db2.gz LQFDXQLVLNDNCN-UHFFFAOYSA-N 0 0 385.420 3.485 20 5 GGBDRN CCOC(=O)CN(CC(F)(F)F)C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187489076 1431747092 /nfs/dbraw/zinc/74/70/92/1431747092.db2.gz SVHBTLTVWDLWIL-UHFFFAOYSA-N 0 0 376.331 3.286 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCN(c2nccc(C(C)C)n2)CC1 ZINC000187501324 1431749714 /nfs/dbraw/zinc/74/97/14/1431749714.db2.gz SONIRYRMQCBPBP-UHFFFAOYSA-N 0 0 398.467 3.479 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCS(=O)(=O)c2ccccc2C1 ZINC000187502032 1431749876 /nfs/dbraw/zinc/74/98/76/1431749876.db2.gz KUROIVQFAWCJKU-UHFFFAOYSA-N 0 0 389.433 3.033 20 5 GGBDRN COc1ccc(Cn2ccc(N[C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000187514915 1431753418 /nfs/dbraw/zinc/75/34/18/1431753418.db2.gz HOZVDDQTNZQREU-AWEZNQCLSA-N 0 0 395.419 3.287 20 5 GGBDRN COc1ccc(Cn2ccc(N[C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000187514937 1431753507 /nfs/dbraw/zinc/75/35/07/1431753507.db2.gz HOZVDDQTNZQREU-CQSZACIVSA-N 0 0 395.419 3.287 20 5 GGBDRN COc1ccc(Cn2ccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000187521264 1431755318 /nfs/dbraw/zinc/75/53/18/1431755318.db2.gz HOHASTRBFJZSFN-CQSZACIVSA-N 0 0 395.419 3.287 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCN(C2CC2)c2ccccc21 ZINC000187535911 1431759932 /nfs/dbraw/zinc/75/99/32/1431759932.db2.gz KADQKTIZMHOQAN-UHFFFAOYSA-N 0 0 390.399 3.066 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC1(Cc2cccc(F)c2)CCC1 ZINC000187546681 1431763258 /nfs/dbraw/zinc/76/32/58/1431763258.db2.gz AQUGZQIQBZYQIP-CQSZACIVSA-N 0 0 399.422 3.134 20 5 GGBDRN Cc1ccccc1CN(Cc1cccnc1)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187558209 1431766595 /nfs/dbraw/zinc/76/65/95/1431766595.db2.gz AVOOZEFJVIZZHJ-UHFFFAOYSA-N 0 0 378.388 3.241 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)c2cccc(F)c2F)cc1[N+](=O)[O-] ZINC000187575944 1431771277 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BGSBSHOXCMCUIM-SFHVURJKSA-N 0 0 383.383 3.056 20 5 GGBDRN CCCCNC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187678140 1431798438 /nfs/dbraw/zinc/79/84/38/1431798438.db2.gz DUMZBJMAVKCXRJ-MRXNPFEDSA-N 0 0 379.482 3.150 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000187686831 1431800116 /nfs/dbraw/zinc/80/01/16/1431800116.db2.gz IIBZVAZAOVCGKY-NHYWBVRUSA-N 0 0 392.399 3.287 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCNC(=O)c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000187711218 1431802724 /nfs/dbraw/zinc/80/27/24/1431802724.db2.gz HZXQEJBNAOJBQT-UHFFFAOYSA-N 0 0 391.374 3.156 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)[C@H]2CCCC[C@@H]2S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000187770738 1431810484 /nfs/dbraw/zinc/81/04/84/1431810484.db2.gz OFFUZJMCOAQPLL-RDJZCZTQSA-N 0 0 382.482 3.146 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)[C@@H]2CCCC[C@@H]2S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000187770713 1431810512 /nfs/dbraw/zinc/81/05/12/1431810512.db2.gz OFFUZJMCOAQPLL-WBVHZDCISA-N 0 0 382.482 3.146 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000187775517 1431810813 /nfs/dbraw/zinc/81/08/13/1431810813.db2.gz YGDZVMSKFGOCLU-WDYCEAGBSA-N 0 0 395.459 3.241 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCCN2C(=O)COc3ccccc32)cc1[N+](=O)[O-] ZINC000187777128 1431811178 /nfs/dbraw/zinc/81/11/78/1431811178.db2.gz WOQUTBKPTQFOTK-UHFFFAOYSA-N 0 0 397.431 3.264 20 5 GGBDRN COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000187819090 1431816140 /nfs/dbraw/zinc/81/61/40/1431816140.db2.gz VUZBLVTXBKVPMF-OCCSQVGLSA-N 0 0 382.376 3.231 20 5 GGBDRN O=C(CCOCC(F)(F)C(F)(F)F)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000187841067 1431818800 /nfs/dbraw/zinc/81/88/00/1431818800.db2.gz AOHLDOOSTQFADP-UHFFFAOYSA-N 0 0 382.285 3.478 20 5 GGBDRN COC(=O)CCN(Cc1ccncc1)C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187865481 1431821510 /nfs/dbraw/zinc/82/15/10/1431821510.db2.gz VBUCJLIINUZBPX-UHFFFAOYSA-N 0 0 385.420 3.319 20 5 GGBDRN Cc1ccc(-c2ncccc2NC(=O)C(=O)NCc2ccccc2[N+](=O)[O-])s1 ZINC000187875340 1431822667 /nfs/dbraw/zinc/82/26/67/1431822667.db2.gz PWHQYMNBFXROEW-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN COc1cc(C(=O)Nc2cc(CN3CCOCC3)ccc2C)cc([N+](=O)[O-])c1C ZINC000187882235 1431823760 /nfs/dbraw/zinc/82/37/60/1431823760.db2.gz JXNRRFDRULZJMU-UHFFFAOYSA-N 0 0 399.447 3.305 20 5 GGBDRN O=C(c1c[nH]c(=O)c2ccccc12)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000187904752 1431826058 /nfs/dbraw/zinc/82/60/58/1431826058.db2.gz WFQVDDPHWVQTJT-UHFFFAOYSA-N 0 0 393.399 3.120 20 5 GGBDRN COCCO[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000187950141 1431830516 /nfs/dbraw/zinc/83/05/16/1431830516.db2.gz SYMHAZZSFBFEQV-QGZVFWFLSA-N 0 0 385.420 3.216 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCC(c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000187999665 1431834985 /nfs/dbraw/zinc/83/49/85/1431834985.db2.gz GNLIQFVHKVCSOP-UHFFFAOYSA-N 0 0 394.474 3.080 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCN1CCc2ccccc2C1=O ZINC000188038168 1431838536 /nfs/dbraw/zinc/83/85/36/1431838536.db2.gz AKEDFLNOXWDBLS-UHFFFAOYSA-N 0 0 382.420 3.032 20 5 GGBDRN CSc1cccc(C(=O)N2CCCN(C(=O)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000188038663 1431838855 /nfs/dbraw/zinc/83/88/55/1431838855.db2.gz XVBHWYQVJWDPLG-UHFFFAOYSA-N 0 0 399.472 3.305 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1 ZINC000188056190 1431840581 /nfs/dbraw/zinc/84/05/81/1431840581.db2.gz IRUMQLPBOCXQAU-NSHDSACASA-N 0 0 398.250 3.034 20 5 GGBDRN CC(C)c1ccc(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1[N+](=O)[O-] ZINC000188060253 1431840982 /nfs/dbraw/zinc/84/09/82/1431840982.db2.gz GSZUANJPCFVCIY-CYBMUJFWSA-N 0 0 387.358 3.001 20 5 GGBDRN CC(C)c1ccc(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1[N+](=O)[O-] ZINC000188060276 1431841137 /nfs/dbraw/zinc/84/11/37/1431841137.db2.gz GSZUANJPCFVCIY-ZDUSSCGKSA-N 0 0 387.358 3.001 20 5 GGBDRN CSc1cccc(C(=O)NC2CCN(C(=O)CC(C)C)CC2)c1[N+](=O)[O-] ZINC000188085441 1431844417 /nfs/dbraw/zinc/84/44/17/1431844417.db2.gz CZVOKGRZPSTTBT-UHFFFAOYSA-N 0 0 379.482 3.084 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1F)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000188084993 1431844546 /nfs/dbraw/zinc/84/45/46/1431844546.db2.gz XYCOZVDEIMZTMD-AWEZNQCLSA-N 0 0 389.452 3.469 20 5 GGBDRN CCn1c(S[C@@H](C)c2nnnn2C2CC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000188091624 1431845310 /nfs/dbraw/zinc/84/53/10/1431845310.db2.gz DQJFAOGXHSWPDB-JTQLQIEISA-N 0 0 386.441 3.048 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000188116879 1431848917 /nfs/dbraw/zinc/84/89/17/1431848917.db2.gz MCMHORQELMOYFB-DLBZAZTESA-N 0 0 381.432 3.369 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188140145 1431852262 /nfs/dbraw/zinc/85/22/62/1431852262.db2.gz HFRKSKCKEQTHCG-IRXDYDNUSA-N 0 0 381.432 3.369 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(COc2cccc(F)c2)no1 ZINC000188151483 1431853476 /nfs/dbraw/zinc/85/34/76/1431853476.db2.gz VKOKDUOLNSGWBN-NSHDSACASA-N 0 0 386.339 3.187 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cc(F)ccc2Cl)C1=O ZINC000188187787 1431858278 /nfs/dbraw/zinc/85/82/78/1431858278.db2.gz OUDXDYRWACPBPB-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN COC(=O)C[C@@](C)(NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000188253642 1431866082 /nfs/dbraw/zinc/86/60/82/1431866082.db2.gz QRZCENJCOMOXHN-HXUWFJFHSA-N 0 0 385.420 3.322 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)c1[N+](=O)[O-] ZINC000188266417 1431867122 /nfs/dbraw/zinc/86/71/22/1431867122.db2.gz IMNGMVFLWOVNAB-SNVBAGLBSA-N 0 0 398.250 3.196 20 5 GGBDRN O=C(Nc1ccc(-n2nccc2C(F)(F)F)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000188265695 1431867163 /nfs/dbraw/zinc/86/71/63/1431867163.db2.gz WZTHAAUEXFVZIY-UHFFFAOYSA-N 0 0 393.281 3.152 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCO2)c1[N+](=O)[O-] ZINC000188270580 1431867888 /nfs/dbraw/zinc/86/78/88/1431867888.db2.gz RMNLWNYXOFZIQL-NSHDSACASA-N 0 0 394.815 3.344 20 5 GGBDRN CCCCOc1ccc(CNC(=O)CCn2cc([N+](=O)[O-])cn2)cc1Cl ZINC000188272220 1431868195 /nfs/dbraw/zinc/86/81/95/1431868195.db2.gz IZZVZLFOPLIFNU-UHFFFAOYSA-N 0 0 380.832 3.330 20 5 GGBDRN CCCOc1ccc(CNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000188304394 1431871251 /nfs/dbraw/zinc/87/12/51/1431871251.db2.gz LZPLNPFNEIMLAL-UHFFFAOYSA-N 0 0 392.477 3.354 20 5 GGBDRN CCCOc1ccc(CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000188305809 1431871524 /nfs/dbraw/zinc/87/15/24/1431871524.db2.gz HFRXDMZNFRNZBF-UHFFFAOYSA-N 0 0 378.450 3.312 20 5 GGBDRN C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000188336701 1431874657 /nfs/dbraw/zinc/87/46/57/1431874657.db2.gz ZJIPAEGFZDJFCN-LRDDRELGSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000188338625 1431874772 /nfs/dbraw/zinc/87/47/72/1431874772.db2.gz LVCSLTRBJKHGNN-SJCJKPOMSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000188338605 1431874836 /nfs/dbraw/zinc/87/48/36/1431874836.db2.gz LVCSLTRBJKHGNN-PXAZEXFGSA-N 0 0 396.852 3.399 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000188350648 1431876110 /nfs/dbraw/zinc/87/61/10/1431876110.db2.gz XLBWFAWUXUODAN-GOSISDBHSA-N 0 0 376.359 3.406 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC[C@@H]2c2nc3ccccc3n2CC)c1[N+](=O)[O-] ZINC000188355439 1431876367 /nfs/dbraw/zinc/87/63/67/1431876367.db2.gz NDVDVPPDOCOIHH-OAHLLOKOSA-N 0 0 382.424 3.227 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3C[C@H]4OCCC[C@H]34)cc2[N+](=O)[O-])C1 ZINC000188362403 1431877190 /nfs/dbraw/zinc/87/71/90/1431877190.db2.gz NSHAHOCZRAXLNR-QUYZETPZSA-N 0 0 387.480 3.374 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(Cl)c2-n2cncn2)cc([N+](=O)[O-])c1C ZINC000188375042 1431878424 /nfs/dbraw/zinc/87/84/24/1431878424.db2.gz KXCKBQSYYGAWDI-UHFFFAOYSA-N 0 0 387.783 3.398 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000188372967 1431878490 /nfs/dbraw/zinc/87/84/90/1431878490.db2.gz LKUQIBVYHZLISV-QGZVFWFLSA-N 0 0 392.477 3.090 20 5 GGBDRN COC[C@H]1CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000188397424 1431880771 /nfs/dbraw/zinc/88/07/71/1431880771.db2.gz CPLUXRDVVAFRLF-WMLDXEAASA-N 0 0 385.420 3.214 20 5 GGBDRN COC[C@H]1CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000188397400 1431880808 /nfs/dbraw/zinc/88/08/08/1431880808.db2.gz CPLUXRDVVAFRLF-RHSMWYFYSA-N 0 0 385.420 3.214 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000188412444 1431882118 /nfs/dbraw/zinc/88/21/18/1431882118.db2.gz XBDQRYBUYCBKOG-QGZVFWFLSA-N 0 0 378.331 3.095 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC=Cc3ccccc32)cc1[N+](=O)[O-] ZINC000188411642 1431882180 /nfs/dbraw/zinc/88/21/80/1431882180.db2.gz AEACLXGZWLDHPA-UHFFFAOYSA-N 0 0 378.381 3.355 20 5 GGBDRN O=C(c1ccc(-c2cncnc2)cc1F)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188450319 1431885059 /nfs/dbraw/zinc/88/50/59/1431885059.db2.gz BINAFLLFCSYIPJ-UHFFFAOYSA-N 0 0 394.362 3.094 20 5 GGBDRN CC(C)(C)C(=O)Nc1ccccc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188460077 1431885985 /nfs/dbraw/zinc/88/59/85/1431885985.db2.gz IMBROALNIMWUPL-UHFFFAOYSA-N 0 0 397.431 3.483 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@@H]1Oc1ccccc1 ZINC000188463036 1431886144 /nfs/dbraw/zinc/88/61/44/1431886144.db2.gz HQIXQLBXYOASJA-QRVBRYPASA-N 0 0 385.420 3.019 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@@H]1Oc1ccccc1 ZINC000188462991 1431886183 /nfs/dbraw/zinc/88/61/83/1431886183.db2.gz HQIXQLBXYOASJA-OTWHNJEPSA-N 0 0 385.420 3.019 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000188477201 1431887397 /nfs/dbraw/zinc/88/73/97/1431887397.db2.gz IZPHVEZRRPQQRQ-XCLFUZPHSA-N 0 0 388.395 3.085 20 5 GGBDRN COc1cc(C(=O)NCc2cccnc2OCC(F)(F)F)cc([N+](=O)[O-])c1C ZINC000188476719 1431887482 /nfs/dbraw/zinc/88/74/82/1431887482.db2.gz AQYYKZMENBXUOM-UHFFFAOYSA-N 0 0 399.325 3.178 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000188488395 1431888627 /nfs/dbraw/zinc/88/86/27/1431888627.db2.gz GTPQYEJCCJUVBI-JLTOFOAXSA-N 0 0 399.447 3.232 20 5 GGBDRN Cc1noc2nc(C(C)C)cc(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)c12 ZINC000188495729 1431889269 /nfs/dbraw/zinc/88/92/69/1431889269.db2.gz ZJFAEUGTRBPPNH-UHFFFAOYSA-N 0 0 396.403 3.466 20 5 GGBDRN Cc1nc(-c2ccco2)ccc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188527077 1431892041 /nfs/dbraw/zinc/89/20/41/1431892041.db2.gz LYINPNFTQGSHEA-UHFFFAOYSA-N 0 0 379.372 3.462 20 5 GGBDRN O=C(c1cnc(-c2ccccn2)s1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188537717 1431893120 /nfs/dbraw/zinc/89/31/20/1431893120.db2.gz GPFYXDIFWKSQFA-UHFFFAOYSA-N 0 0 382.401 3.017 20 5 GGBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188541060 1431893582 /nfs/dbraw/zinc/89/35/82/1431893582.db2.gz JEWSVPKXCBFGEO-AWEZNQCLSA-N 0 0 385.420 3.094 20 5 GGBDRN Cc1cc(OC(F)F)c(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000188546069 1431893901 /nfs/dbraw/zinc/89/39/01/1431893901.db2.gz BJAKRKPIDFRNTP-UHFFFAOYSA-N 0 0 384.360 3.470 20 5 GGBDRN CCCc1c(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)[nH]c(C)c1C(C)=O ZINC000188560711 1431895193 /nfs/dbraw/zinc/89/51/93/1431895193.db2.gz MDZNXANXSZLIAT-UHFFFAOYSA-N 0 0 385.420 3.290 20 5 GGBDRN O=C(CCc1ncc(-c2ccccc2)o1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188565316 1431895683 /nfs/dbraw/zinc/89/56/83/1431895683.db2.gz QQRWQOAVPSOELB-UHFFFAOYSA-N 0 0 393.399 3.472 20 5 GGBDRN CC(C)(C)OCc1cc(CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)no1 ZINC000188579529 1431897055 /nfs/dbraw/zinc/89/70/55/1431897055.db2.gz SBMLFWCVXSKESD-UHFFFAOYSA-N 0 0 390.440 3.406 20 5 GGBDRN CC(C)(C)c1nc(CC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000188583828 1431897523 /nfs/dbraw/zinc/89/75/23/1431897523.db2.gz YAVJDOTYDPPFQB-UHFFFAOYSA-N 0 0 375.450 3.181 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000188591896 1431898159 /nfs/dbraw/zinc/89/81/59/1431898159.db2.gz OJIYWJVEUSCXCX-GFCCVEGCSA-N 0 0 399.375 3.175 20 5 GGBDRN CCOc1cc(OCC(=O)c2cc(C)n(CCOC)c2C)ccc1[N+](=O)[O-] ZINC000188591053 1431898174 /nfs/dbraw/zinc/89/81/74/1431898174.db2.gz IELRFWHVARRJRM-UHFFFAOYSA-N 0 0 376.409 3.320 20 5 GGBDRN COc1ccc(C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)cc1[N+](=O)[O-] ZINC000188590054 1431898198 /nfs/dbraw/zinc/89/81/98/1431898198.db2.gz IIEKRZFGMOWJAX-UHFFFAOYSA-N 0 0 383.404 3.304 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000188597085 1431898716 /nfs/dbraw/zinc/89/87/16/1431898716.db2.gz AFVNSBMCBSAKIH-UHFFFAOYSA-N 0 0 397.431 3.451 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000188622570 1431907196 /nfs/dbraw/zinc/90/71/96/1431907196.db2.gz BLHLHHSESKDORN-IUODEOHRSA-N 0 0 393.490 3.440 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000188630356 1431910114 /nfs/dbraw/zinc/91/01/14/1431910114.db2.gz UHSKHNAMOSYPTH-UHFFFAOYSA-N 0 0 395.337 3.490 20 5 GGBDRN CC1(C)CC[C@H](CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)O1 ZINC000188634131 1431912266 /nfs/dbraw/zinc/91/22/66/1431912266.db2.gz ZXICZNFXSCCUGY-QGZVFWFLSA-N 0 0 377.441 3.105 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCN1CCc2ccccc2C1=O ZINC000188648635 1431918075 /nfs/dbraw/zinc/91/80/75/1431918075.db2.gz AROBXKZDHPPXLI-UHFFFAOYSA-N 0 0 382.420 3.032 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(F)c(Cl)c2)C1=O ZINC000188665170 1431925355 /nfs/dbraw/zinc/92/53/55/1431925355.db2.gz SJNMOZIYDNHRON-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN Cc1ccc(CN2CCN(c3nnc(C(F)(F)F)s3)CC2)cc1[N+](=O)[O-] ZINC000188663975 1431925463 /nfs/dbraw/zinc/92/54/63/1431925463.db2.gz IUWZIWFWDBZPLW-UHFFFAOYSA-N 0 0 387.387 3.096 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CC1 ZINC000188684270 1431932144 /nfs/dbraw/zinc/93/21/44/1431932144.db2.gz VISXZKHGLUPIDN-UHFFFAOYSA-N 0 0 391.468 3.070 20 5 GGBDRN COc1cc(C(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)cc([N+](=O)[O-])c1C ZINC000188710161 1431941035 /nfs/dbraw/zinc/94/10/35/1431941035.db2.gz TUTIMHFRJFSFIH-JGTBNHKDSA-N 0 0 390.461 3.482 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000188755054 1431959272 /nfs/dbraw/zinc/95/92/72/1431959272.db2.gz WMTPQNNINSEUKR-NRFANRHFSA-N 0 0 397.431 3.030 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000188755034 1431959480 /nfs/dbraw/zinc/95/94/80/1431959480.db2.gz WMTPQNNINSEUKR-OAQYLSRUSA-N 0 0 397.431 3.030 20 5 GGBDRN COC(=O)[C@@H]1[C@H](O)CCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000188777246 1431969980 /nfs/dbraw/zinc/96/99/80/1431969980.db2.gz MKRFQNLQSCHWHH-WBVHZDCISA-N 0 0 394.811 3.007 20 5 GGBDRN COC(=O)[C@H]1[C@@H](O)CCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000188777316 1431971374 /nfs/dbraw/zinc/97/13/74/1431971374.db2.gz MKRFQNLQSCHWHH-DOTOQJQBSA-N 0 0 394.811 3.007 20 5 GGBDRN C[C@@H]1CCC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000188796214 1431978317 /nfs/dbraw/zinc/97/83/17/1431978317.db2.gz RNIHBXDAZLVJDC-MCIONIFRSA-N 0 0 379.482 3.346 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000188843039 1431994975 /nfs/dbraw/zinc/99/49/75/1431994975.db2.gz POEGFRIXMHICLB-CYBMUJFWSA-N 0 0 399.447 3.370 20 5 GGBDRN CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000188843064 1431995345 /nfs/dbraw/zinc/99/53/45/1431995345.db2.gz POEGFRIXMHICLB-ZDUSSCGKSA-N 0 0 399.447 3.370 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCN(C2CC2)c2ccccc21 ZINC000188866318 1432001249 /nfs/dbraw/zinc/00/12/49/1432001249.db2.gz ORILNPDZDZMJPD-UHFFFAOYSA-N 0 0 393.852 3.426 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(OCc3nccn3C)cc2)cc([N+](=O)[O-])c1C ZINC000188905893 1432006123 /nfs/dbraw/zinc/00/61/23/1432006123.db2.gz COGNUSOBGRTPCR-UHFFFAOYSA-N 0 0 396.403 3.477 20 5 GGBDRN CCSCC[C@@H](C)N(C)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000188915091 1432008289 /nfs/dbraw/zinc/00/82/89/1432008289.db2.gz VQCCOVJRHQSYPY-OLZOCXBDSA-N 0 0 399.538 3.251 20 5 GGBDRN COc1ccc(CC(C)(C)NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000188931951 1432011291 /nfs/dbraw/zinc/01/12/91/1432011291.db2.gz UIVHBINMBQBFPY-UHFFFAOYSA-N 0 0 392.477 3.087 20 5 GGBDRN COc1ccc(CC(C)(C)NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000188939911 1432013367 /nfs/dbraw/zinc/01/33/67/1432013367.db2.gz TZFKRXGFLWAMPA-UHFFFAOYSA-N 0 0 378.450 3.044 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1ccc(F)c(Cl)c1 ZINC000188953881 1432015651 /nfs/dbraw/zinc/01/56/51/1432015651.db2.gz NUXOIIGAIWNMRY-UHFFFAOYSA-N 0 0 399.769 3.331 20 5 GGBDRN CCC(=O)N1CC[C@@H](C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])C1 ZINC000188955149 1432016245 /nfs/dbraw/zinc/01/62/45/1432016245.db2.gz QAHCQWCFODNMQS-MRXNPFEDSA-N 0 0 397.431 3.371 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cc(Cl)ccc2F)C1=O ZINC000188958870 1432016557 /nfs/dbraw/zinc/01/65/57/1432016557.db2.gz YFBINAWUGMLGBL-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)cc([N+](=O)[O-])c1C ZINC000189036103 1432031929 /nfs/dbraw/zinc/03/19/29/1432031929.db2.gz FRZONLRFAIWDJC-CYBMUJFWSA-N 0 0 396.403 3.377 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)cc([N+](=O)[O-])c1C ZINC000189036080 1432031985 /nfs/dbraw/zinc/03/19/85/1432031985.db2.gz FRZONLRFAIWDJC-ZDUSSCGKSA-N 0 0 396.403 3.377 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Cc1ccccc1 ZINC000189042530 1432032942 /nfs/dbraw/zinc/03/29/42/1432032942.db2.gz RJCYBVCTPBQOTL-GOSISDBHSA-N 0 0 393.447 3.420 20 5 GGBDRN CC(C)[C@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Cc1ccccc1 ZINC000189042511 1432032962 /nfs/dbraw/zinc/03/29/62/1432032962.db2.gz RJCYBVCTPBQOTL-SFHVURJKSA-N 0 0 393.447 3.420 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC([C@@H]2CCCO2)CC1 ZINC000189112748 1432046929 /nfs/dbraw/zinc/04/69/29/1432046929.db2.gz OXZKASJHOCAOSH-SJCJKPOMSA-N 0 0 381.860 3.466 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC([C@@H]2CCCO2)CC1 ZINC000189112767 1432047042 /nfs/dbraw/zinc/04/70/42/1432047042.db2.gz OXZKASJHOCAOSH-PXAZEXFGSA-N 0 0 381.860 3.466 20 5 GGBDRN O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000189129399 1432049614 /nfs/dbraw/zinc/04/96/14/1432049614.db2.gz XKKSFDDEFIHQJV-UHFFFAOYSA-N 0 0 395.337 3.282 20 5 GGBDRN COc1cc(CS(=O)(=O)c2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000189145250 1432051978 /nfs/dbraw/zinc/05/19/78/1432051978.db2.gz HLBUATWESRZYQU-UHFFFAOYSA-N 0 0 387.360 3.221 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccn(-c4ccccc4F)n3)C2)nc1 ZINC000189192829 1432060780 /nfs/dbraw/zinc/06/07/80/1432060780.db2.gz BGMOGPMSNQSKFS-CQSZACIVSA-N 0 0 382.399 3.001 20 5 GGBDRN CCOC(=O)[C@H](CC)N(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000189227008 1432067069 /nfs/dbraw/zinc/06/70/69/1432067069.db2.gz ILLXWBUZLPAYEF-INIZCTEOSA-N 0 0 389.452 3.141 20 5 GGBDRN CC[C@]1(CO)CCCN1C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000189258625 1432073042 /nfs/dbraw/zinc/07/30/42/1432073042.db2.gz RQZDZXKGRAZPAK-HXUWFJFHSA-N 0 0 375.469 3.208 20 5 GGBDRN Cc1csc([C@@H]2COCCN2CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000189302915 1432082121 /nfs/dbraw/zinc/08/21/21/1432082121.db2.gz VZVKDNSBQRWKHB-AWEZNQCLSA-N 0 0 396.856 3.025 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1ccc2c(c1)CCN2C(=O)COC ZINC000189306741 1432082715 /nfs/dbraw/zinc/08/27/15/1432082715.db2.gz BGGQIJVNRCZTBT-UHFFFAOYSA-N 0 0 385.420 3.141 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1OCC1CCC1 ZINC000189339090 1432089462 /nfs/dbraw/zinc/08/94/62/1432089462.db2.gz HYZFLXGAVWMPHG-UHFFFAOYSA-N 0 0 393.831 3.445 20 5 GGBDRN COC(=O)c1cnc(N2CC[C@H](OCCCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000189341928 1432090036 /nfs/dbraw/zinc/09/00/36/1432090036.db2.gz IFXXVCSXNVZMJE-KRWDZBQOSA-N 0 0 385.420 3.005 20 5 GGBDRN COc1cc(C(=O)NCCOc2ccc(C(F)(F)F)cn2)cc([N+](=O)[O-])c1C ZINC000189377854 1432095749 /nfs/dbraw/zinc/09/57/49/1432095749.db2.gz PPOICFRCIVTHTR-UHFFFAOYSA-N 0 0 399.325 3.134 20 5 GGBDRN CCOc1ccc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000189429984 1432107794 /nfs/dbraw/zinc/10/77/94/1432107794.db2.gz ZMKVUAIRJYHSFN-UHFFFAOYSA-N 0 0 381.747 3.363 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000189464910 1432121095 /nfs/dbraw/zinc/12/10/95/1432121095.db2.gz BLSPKLQCPBDOOX-HXUWFJFHSA-N 0 0 382.420 3.275 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000189477555 1432127401 /nfs/dbraw/zinc/12/74/01/1432127401.db2.gz GQMATNZQFHGLID-GOSISDBHSA-N 0 0 394.431 3.110 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@@H](C)[C@@H]2CO)cc1[N+](=O)[O-])c1ccccn1 ZINC000189487319 1432132325 /nfs/dbraw/zinc/13/23/25/1432132325.db2.gz ZQYUHKWCMJZVPI-TYILLQQXSA-N 0 0 384.436 3.006 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@@H](C)[C@H]2CO)cc1[N+](=O)[O-])c1ccccn1 ZINC000189487281 1432132605 /nfs/dbraw/zinc/13/26/05/1432132605.db2.gz ZQYUHKWCMJZVPI-BIENJYKASA-N 0 0 384.436 3.006 20 5 GGBDRN CSCc1cccc(CNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1 ZINC000189491827 1432133947 /nfs/dbraw/zinc/13/39/47/1432133947.db2.gz YXYJXCLWEOJKRG-UHFFFAOYSA-N 0 0 397.460 3.277 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189498448 1432136048 /nfs/dbraw/zinc/13/60/48/1432136048.db2.gz WAEXBQFYFICPHS-MRXNPFEDSA-N 0 0 375.469 3.487 20 5 GGBDRN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189502099 1432137894 /nfs/dbraw/zinc/13/78/94/1432137894.db2.gz SJWCPUOLOANIHV-XIKOKIGWSA-N 0 0 389.839 3.309 20 5 GGBDRN C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189502115 1432138076 /nfs/dbraw/zinc/13/80/76/1432138076.db2.gz SJWCPUOLOANIHV-SGTLLEGYSA-N 0 0 389.839 3.309 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000189505005 1432139361 /nfs/dbraw/zinc/13/93/61/1432139361.db2.gz CRIMCEIJNNTGMR-IBGZPJMESA-N 0 0 394.431 3.110 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000189509005 1432141068 /nfs/dbraw/zinc/14/10/68/1432141068.db2.gz ZIVOJDCUKCAQHW-GOSISDBHSA-N 0 0 383.448 3.499 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(c2cccc(N)c2)C2CCCC2)cc1[N+](=O)[O-] ZINC000189568769 1432162006 /nfs/dbraw/zinc/16/20/06/1432162006.db2.gz BAQHPFKWNACFLH-UHFFFAOYSA-N 0 0 382.420 3.400 20 5 GGBDRN O=C(CCN1CCSC[C@H]1c1nccs1)Nc1cc([N+](=O)[O-])ccc1F ZINC000189588689 1432168717 /nfs/dbraw/zinc/16/87/17/1432168717.db2.gz DUJZRCRQJUCBTH-AWEZNQCLSA-N 0 0 396.469 3.309 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCO[C@H](c3ccc(CC)cc3)C2)c1[N+](=O)[O-] ZINC000189590865 1432169104 /nfs/dbraw/zinc/16/91/04/1432169104.db2.gz VQTMAKWPJIPSAN-KRWDZBQOSA-N 0 0 385.420 3.307 20 5 GGBDRN Cc1nn(C)cc1[C@H](C)Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000189601382 1432172493 /nfs/dbraw/zinc/17/24/93/1432172493.db2.gz LWWNFJGUPBSERI-JTQLQIEISA-N 0 0 388.815 3.009 20 5 GGBDRN COC(=O)[C@H](NCc1ccc(Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)CCO2 ZINC000189609438 1432175830 /nfs/dbraw/zinc/17/58/30/1432175830.db2.gz JVWHSXMMLPMKMQ-QGZVFWFLSA-N 0 0 376.796 3.187 20 5 GGBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000189620934 1432180796 /nfs/dbraw/zinc/18/07/96/1432180796.db2.gz LJDIBGAUYNLHST-HNNXBMFYSA-N 0 0 382.351 3.173 20 5 GGBDRN C[C@H](O)[C@@](C)(CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000189647870 1432189450 /nfs/dbraw/zinc/18/94/50/1432189450.db2.gz QGTKMWZWJYXUOD-IFXJQAMLSA-N 0 0 392.477 3.040 20 5 GGBDRN C[C@@H](O)[C@@](C)(CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000189647454 1432189565 /nfs/dbraw/zinc/18/95/65/1432189565.db2.gz HMKRWJKWCIJWIE-SJKOYZFVSA-N 0 0 398.506 3.102 20 5 GGBDRN C[C@H](O)[C@](C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Cc1ccccc1 ZINC000189650071 1432190836 /nfs/dbraw/zinc/19/08/36/1432190836.db2.gz VGFQKFPXYMGXCK-LIRRHRJNSA-N 0 0 392.477 3.040 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@@](C)(Cc2ccccc2)[C@@H](C)O)c1[N+](=O)[O-] ZINC000189652139 1432191658 /nfs/dbraw/zinc/19/16/58/1432191658.db2.gz MMRMUTDXCYENLS-JLTOFOAXSA-N 0 0 387.436 3.208 20 5 GGBDRN Cc1cccnc1[C@H](NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)C(C)C ZINC000189655890 1432192881 /nfs/dbraw/zinc/19/28/81/1432192881.db2.gz GRCOXYQECBNEAO-GOSISDBHSA-N 0 0 384.436 3.468 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)C(C)C ZINC000189655906 1432193421 /nfs/dbraw/zinc/19/34/21/1432193421.db2.gz GRCOXYQECBNEAO-SFHVURJKSA-N 0 0 384.436 3.468 20 5 GGBDRN CCOC(=O)[C@@H](NCc1ccc(C)c([N+](=O)[O-])c1)c1ccc(OC)c(F)c1 ZINC000189675295 1432199318 /nfs/dbraw/zinc/19/93/18/1432199318.db2.gz XWDLUSZDVQSNIO-SFHVURJKSA-N 0 0 376.384 3.445 20 5 GGBDRN COC(=O)CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000189679143 1432201200 /nfs/dbraw/zinc/20/12/00/1432201200.db2.gz ROBGYECRXYXBIQ-UHFFFAOYSA-N 0 0 396.321 3.429 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000189695520 1432207093 /nfs/dbraw/zinc/20/70/93/1432207093.db2.gz QPOZZSZJAPLWIV-KRWDZBQOSA-N 0 0 394.435 3.244 20 5 GGBDRN Cc1nn(C)c(C(=O)NC(C)(C)Cc2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000189702066 1432208981 /nfs/dbraw/zinc/20/89/81/1432208981.db2.gz BKGMXSJCYVQKJU-UHFFFAOYSA-N 0 0 384.358 3.407 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H](C3N=NC(=S)N3C)C2)cc1[N+](=O)[O-] ZINC000189716483 1432212955 /nfs/dbraw/zinc/21/29/55/1432212955.db2.gz IJCAIWLKEGKFRE-CYBMUJFWSA-N 0 0 389.481 3.155 20 5 GGBDRN COC(=O)CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000189720179 1432214349 /nfs/dbraw/zinc/21/43/49/1432214349.db2.gz GLSHYYQJLLPRDE-UHFFFAOYSA-N 0 0 396.321 3.429 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H](c3nnc4n3CCC4)C2)cc1[N+](=O)[O-] ZINC000189736911 1432219511 /nfs/dbraw/zinc/21/95/11/1432219511.db2.gz QTNOJFNEXWMIIM-OAHLLOKOSA-N 0 0 383.452 3.276 20 5 GGBDRN Cc1cnc([C@H](NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C2CC2)s1 ZINC000189779385 1432233042 /nfs/dbraw/zinc/23/30/42/1432233042.db2.gz MTJSMGPYZPIZJF-MRXNPFEDSA-N 0 0 388.449 3.284 20 5 GGBDRN C[C@@H](C1CC1)n1cc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cn1 ZINC000189811264 1432241843 /nfs/dbraw/zinc/24/18/43/1432241843.db2.gz BUJNDGJTGUIYQM-AWEZNQCLSA-N 0 0 384.440 3.116 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)c(F)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000189828313 1432246366 /nfs/dbraw/zinc/24/63/66/1432246366.db2.gz YOIWMUXMIHFWBO-LLVKDONJSA-N 0 0 398.316 3.474 20 5 GGBDRN O=C(N1CCN(c2ccccc2[N+](=O)[O-])CC1)C1(Cc2ccccc2F)CC1 ZINC000189834667 1432248941 /nfs/dbraw/zinc/24/89/41/1432248941.db2.gz BVUKNBFEBUDHSF-UHFFFAOYSA-N 0 0 383.423 3.405 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000189858081 1432255080 /nfs/dbraw/zinc/25/50/80/1432255080.db2.gz WIKJHGZVIZKCHA-INIZCTEOSA-N 0 0 379.775 3.183 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000189858095 1432255123 /nfs/dbraw/zinc/25/51/23/1432255123.db2.gz WIKJHGZVIZKCHA-MRXNPFEDSA-N 0 0 379.775 3.183 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@H](Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000189861865 1432256198 /nfs/dbraw/zinc/25/61/98/1432256198.db2.gz ZHEYSVRZJWYRFQ-KRWDZBQOSA-N 0 0 383.448 3.473 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H](Cc1ccccc1)C(C)C ZINC000189865775 1432257492 /nfs/dbraw/zinc/25/74/92/1432257492.db2.gz KLPWRPYRCQDJLS-MRXNPFEDSA-N 0 0 399.447 3.173 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCNc2nccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000189870881 1432258654 /nfs/dbraw/zinc/25/86/54/1432258654.db2.gz HOHWMAZWGZWLNM-UHFFFAOYSA-N 0 0 397.357 3.369 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000189876890 1432260053 /nfs/dbraw/zinc/26/00/53/1432260053.db2.gz TZXWGUYEKKAJAZ-UHFFFAOYSA-N 0 0 395.419 3.212 20 5 GGBDRN COc1cc(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c2ccccc2n1 ZINC000189889847 1432264641 /nfs/dbraw/zinc/26/46/41/1432264641.db2.gz DWVKREPESPVLTL-UHFFFAOYSA-N 0 0 387.417 3.167 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)CC2 ZINC000189895361 1432266131 /nfs/dbraw/zinc/26/61/31/1432266131.db2.gz IXQIXFIZNJQJSN-MSOLQXFVSA-N 0 0 376.453 3.110 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000189919494 1432274378 /nfs/dbraw/zinc/27/43/78/1432274378.db2.gz YORXAEUXWXAZSQ-AWEZNQCLSA-N 0 0 375.429 3.143 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000189919513 1432274426 /nfs/dbraw/zinc/27/44/26/1432274426.db2.gz YORXAEUXWXAZSQ-CQSZACIVSA-N 0 0 375.429 3.143 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC(OC3CCCC3)CC2)c1[N+](=O)[O-] ZINC000189925741 1432276506 /nfs/dbraw/zinc/27/65/06/1432276506.db2.gz MHDGOVXDNHVUNL-UHFFFAOYSA-N 0 0 382.482 3.324 20 5 GGBDRN COc1ccc([C@H]2CCN(S(=O)(=O)c3c(C)ccc(C)c3[N+](=O)[O-])C2)cc1 ZINC000189926767 1432276513 /nfs/dbraw/zinc/27/65/13/1432276513.db2.gz URWBRWMDVXIJQP-INIZCTEOSA-N 0 0 390.461 3.398 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCO[C@H](c3cccc(F)c3)C2)c1[N+](=O)[O-] ZINC000189939161 1432281787 /nfs/dbraw/zinc/28/17/87/1432281787.db2.gz LUGRZXIQHDQWEG-INIZCTEOSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H](c2nc(C3CC3)no2)C(C)C)c1[N+](=O)[O-] ZINC000189941589 1432282095 /nfs/dbraw/zinc/28/20/95/1432282095.db2.gz MBUNVBLJCZQZJM-CYBMUJFWSA-N 0 0 394.453 3.148 20 5 GGBDRN COc1cc(C(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)cc([N+](=O)[O-])c1C ZINC000189959587 1432289547 /nfs/dbraw/zinc/28/95/47/1432289547.db2.gz JIIDILJQWXPDTI-IBGZPJMESA-N 0 0 384.432 3.325 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCOc3ccc(F)cc32)c1[N+](=O)[O-] ZINC000189960144 1432290096 /nfs/dbraw/zinc/29/00/96/1432290096.db2.gz IGQUUCJBVQOSIF-CQSZACIVSA-N 0 0 380.397 3.153 20 5 GGBDRN CC(C)(CO)[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1 ZINC000189961839 1432290272 /nfs/dbraw/zinc/29/02/72/1432290272.db2.gz ZJGNIGYBGIBWCG-INIZCTEOSA-N 0 0 392.477 3.213 20 5 GGBDRN Cc1n[nH]cc1CCCNc1ccc([N+](=O)[O-])c(NCCCc2c[nH]nc2C)n1 ZINC000189970762 1432293387 /nfs/dbraw/zinc/29/33/87/1432293387.db2.gz UIPKCYRNGUMESM-UHFFFAOYSA-N 0 0 398.471 3.142 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCC(Cn4cncn4)CC3)cs2)c1 ZINC000189977623 1432296585 /nfs/dbraw/zinc/29/65/85/1432296585.db2.gz LAIPCDZFVSEWTH-UHFFFAOYSA-N 0 0 384.465 3.222 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCN2S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000189981573 1432298069 /nfs/dbraw/zinc/29/80/69/1432298069.db2.gz FFKCEWOVPMJHOS-UHFFFAOYSA-N 0 0 386.351 3.451 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1 ZINC000189990899 1432300807 /nfs/dbraw/zinc/30/08/07/1432300807.db2.gz REKZUIOAJOTWGK-LLVKDONJSA-N 0 0 391.811 3.498 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1 ZINC000189990917 1432300884 /nfs/dbraw/zinc/30/08/84/1432300884.db2.gz REKZUIOAJOTWGK-NSHDSACASA-N 0 0 391.811 3.498 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)C[C@@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000189994216 1432301157 /nfs/dbraw/zinc/30/11/57/1432301157.db2.gz DSJJBSPBFOQVDU-GOSISDBHSA-N 0 0 386.448 3.368 20 5 GGBDRN COc1ccc(C[C@H](C)CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000189992742 1432301258 /nfs/dbraw/zinc/30/12/58/1432301258.db2.gz INJAUZFPIKJXNZ-ZDUSSCGKSA-N 0 0 378.450 3.298 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N(Cc1c(F)cccc1F)C1CC1 ZINC000190002463 1432302348 /nfs/dbraw/zinc/30/23/48/1432302348.db2.gz BQLOVTAHGZVLST-UHFFFAOYSA-N 0 0 399.357 3.259 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC[C@@H]2CCCC2=O)cc1[N+](=O)[O-])c1ccccn1 ZINC000190006328 1432303331 /nfs/dbraw/zinc/30/33/31/1432303331.db2.gz UCVKIGDJYSBULY-HIFRSBDPSA-N 0 0 382.420 3.262 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NC[C@H]2CCCC2=O)cc1[N+](=O)[O-])c1ccccn1 ZINC000190006343 1432303415 /nfs/dbraw/zinc/30/34/15/1432303415.db2.gz UCVKIGDJYSBULY-DZGCQCFKSA-N 0 0 382.420 3.262 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)ccc1[N+](=O)[O-] ZINC000190069446 1432313874 /nfs/dbraw/zinc/31/38/74/1432313874.db2.gz GLUHLKIBIDIDGU-UHFFFAOYSA-N 0 0 377.404 3.284 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(C)CCOCc2ccccc2)c1[N+](=O)[O-] ZINC000190070116 1432314293 /nfs/dbraw/zinc/31/42/93/1432314293.db2.gz FEZOTHWRHIPPBO-UHFFFAOYSA-N 0 0 378.450 3.049 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)c1[N+](=O)[O-] ZINC000190072612 1432314584 /nfs/dbraw/zinc/31/45/84/1432314584.db2.gz GFNBYGJWISJAGU-DOTOQJQBSA-N 0 0 392.477 3.045 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCO[C@](C)(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000190072783 1432314756 /nfs/dbraw/zinc/31/47/56/1432314756.db2.gz HUTRKPDHNOKQEZ-IBGZPJMESA-N 0 0 390.461 3.148 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000190075812 1432314946 /nfs/dbraw/zinc/31/49/46/1432314946.db2.gz YVHUSSZXVVIVDC-HIFRSBDPSA-N 0 0 391.468 3.069 20 5 GGBDRN CCOC(=O)[C@](C)(CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000190077612 1432315152 /nfs/dbraw/zinc/31/51/52/1432315152.db2.gz JJCGTFMCDRMKAZ-OAQYLSRUSA-N 0 0 399.447 3.257 20 5 GGBDRN CC(C)c1ccc(CNc2cccc(C(=O)N3CCC[C@H]3CO)n2)cc1[N+](=O)[O-] ZINC000190077217 1432315174 /nfs/dbraw/zinc/31/51/74/1432315174.db2.gz BAAMWKICAPIIOU-INIZCTEOSA-N 0 0 398.463 3.322 20 5 GGBDRN CCOC(=O)[C@@](C)(CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000190077594 1432315281 /nfs/dbraw/zinc/31/52/81/1432315281.db2.gz JJCGTFMCDRMKAZ-NRFANRHFSA-N 0 0 399.447 3.257 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])n1 ZINC000190078053 1432315439 /nfs/dbraw/zinc/31/54/39/1432315439.db2.gz PJGGLYFNXLXORL-INIZCTEOSA-N 0 0 375.450 3.441 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H](C)CC(=O)c2ccccc2)c1[N+](=O)[O-] ZINC000190079336 1432315590 /nfs/dbraw/zinc/31/55/90/1432315590.db2.gz MOHJHVAABYWZCN-CQSZACIVSA-N 0 0 376.434 3.151 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000190080581 1432316138 /nfs/dbraw/zinc/31/61/38/1432316138.db2.gz VMOCMZJJYXQSLI-DOMZBBRYSA-N 0 0 376.438 3.204 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCc3c4ccccc4[nH]c3C2)c1[N+](=O)[O-] ZINC000190092850 1432318601 /nfs/dbraw/zinc/31/86/01/1432318601.db2.gz UUTQQHVUXZIOFV-UHFFFAOYSA-N 0 0 385.445 3.440 20 5 GGBDRN CCCOc1ccc(CNC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000190096221 1432318770 /nfs/dbraw/zinc/31/87/70/1432318770.db2.gz FMRFSEBKPNUERN-HNNXBMFYSA-N 0 0 399.447 3.127 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(CC(C)(C)O)C3CC3)cc2[N+](=O)[O-])C1 ZINC000190117524 1432322778 /nfs/dbraw/zinc/32/27/78/1432322778.db2.gz SJZMJOFDPAQXOH-HUUCEWRRSA-N 0 0 389.496 3.453 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000190116633 1432322819 /nfs/dbraw/zinc/32/28/19/1432322819.db2.gz WQWTXVFUNGUYIQ-WMZOPIPTSA-N 0 0 399.451 3.036 20 5 GGBDRN CC(C)c1ccc(C(=O)NC[C@@H](O)COc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000190131579 1432325260 /nfs/dbraw/zinc/32/52/60/1432325260.db2.gz CUZIYMOGYMNUOJ-OAHLLOKOSA-N 0 0 376.384 3.027 20 5 GGBDRN CC(C)c1ccc(C(=O)NC[C@H](O)COc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000190134477 1432325886 /nfs/dbraw/zinc/32/58/86/1432325886.db2.gz GCHNBQNTIMZIJS-ZDUSSCGKSA-N 0 0 394.374 3.166 20 5 GGBDRN COc1cc(CN2CCO[C@H](c3ccc(F)cc3F)C2)c([N+](=O)[O-])cc1OC ZINC000190136934 1432326296 /nfs/dbraw/zinc/32/62/96/1432326296.db2.gz GKZHJBWCQIJPDS-IBGZPJMESA-N 0 0 394.374 3.464 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(CCc1cccc(F)c1)C1CC1 ZINC000190161850 1432330837 /nfs/dbraw/zinc/33/08/37/1432330837.db2.gz UBKFLYOUWASHBW-UHFFFAOYSA-N 0 0 385.395 3.215 20 5 GGBDRN COC(=O)c1cnc(NCc2cccc(OCC(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000190167927 1432332276 /nfs/dbraw/zinc/33/22/76/1432332276.db2.gz OILYBGIOFHTKDM-UHFFFAOYSA-N 0 0 385.298 3.330 20 5 GGBDRN CCc1noc(-c2ccc(CCNc3ncc(C(=O)OC)cc3[N+](=O)[O-])cc2)n1 ZINC000190172063 1432333325 /nfs/dbraw/zinc/33/33/25/1432333325.db2.gz NCIFAJYETWFYKF-UHFFFAOYSA-N 0 0 397.391 3.043 20 5 GGBDRN CC1(C)CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@H]1C(F)(F)F ZINC000190176684 1432333976 /nfs/dbraw/zinc/33/39/76/1432333976.db2.gz WOXPUWCSJUDTAW-OAHLLOKOSA-N 0 0 385.386 3.394 20 5 GGBDRN CC1(C)CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@@H]1C(F)(F)F ZINC000190176662 1432334077 /nfs/dbraw/zinc/33/40/77/1432334077.db2.gz WOXPUWCSJUDTAW-HNNXBMFYSA-N 0 0 385.386 3.394 20 5 GGBDRN COc1ccc(OCC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000190179643 1432334734 /nfs/dbraw/zinc/33/47/34/1432334734.db2.gz LYRKXCRPRGSVJP-NSHDSACASA-N 0 0 380.347 3.480 20 5 GGBDRN COc1ccc(OCC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000190179665 1432334772 /nfs/dbraw/zinc/33/47/72/1432334772.db2.gz LYRKXCRPRGSVJP-LLVKDONJSA-N 0 0 380.347 3.480 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc(-n3cccn3)cc2C)cc([N+](=O)[O-])c1 ZINC000190201678 1432339874 /nfs/dbraw/zinc/33/98/74/1432339874.db2.gz OBMWBZIXUIUBTF-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000190205616 1432340914 /nfs/dbraw/zinc/34/09/14/1432340914.db2.gz QZNZONPODUGOLN-CQSZACIVSA-N 0 0 375.406 3.205 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000190238239 1432346815 /nfs/dbraw/zinc/34/68/15/1432346815.db2.gz BJIWPMKTIRGYPI-AWEZNQCLSA-N 0 0 393.396 3.344 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2cc(F)ccc2[N+](=O)[O-])n1 ZINC000190255236 1432349476 /nfs/dbraw/zinc/34/94/76/1432349476.db2.gz KJGLQRALJUWLJK-AWEZNQCLSA-N 0 0 393.396 3.344 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000190257240 1432349713 /nfs/dbraw/zinc/34/97/13/1432349713.db2.gz HNQYAOYJBSBESN-GOSISDBHSA-N 0 0 387.436 3.003 20 5 GGBDRN CCN(Cc1cccs1)C(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000190258883 1432350059 /nfs/dbraw/zinc/35/00/59/1432350059.db2.gz VNZPAUZKRBLVPV-UHFFFAOYSA-N 0 0 393.465 3.448 20 5 GGBDRN CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000190272159 1432351546 /nfs/dbraw/zinc/35/15/46/1432351546.db2.gz ITRBKDTXCVUXGC-UHFFFAOYSA-N 0 0 393.774 3.138 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N(Cc1c(F)cccc1F)C1CC1 ZINC000190289748 1432354338 /nfs/dbraw/zinc/35/43/38/1432354338.db2.gz VGROPDPEQMCGGH-UHFFFAOYSA-N 0 0 396.415 3.410 20 5 GGBDRN CCc1ccc([C@H]2CN(CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CCO2)cc1 ZINC000190291397 1432354484 /nfs/dbraw/zinc/35/44/84/1432354484.db2.gz KZIDEWXPDQOCFI-HXUWFJFHSA-N 0 0 383.448 3.194 20 5 GGBDRN CCc1ccc([C@H]2CN(CC(=O)Nc3ccc([N+](=O)[O-])cc3OC)CCO2)cc1 ZINC000190298349 1432355500 /nfs/dbraw/zinc/35/55/00/1432355500.db2.gz HXSYYSFISKZSFR-HXUWFJFHSA-N 0 0 399.447 3.178 20 5 GGBDRN CCc1ccc([C@@H]2CN(CC(=O)Nc3cc([N+](=O)[O-])ccc3C)CCO2)cc1 ZINC000190298379 1432355533 /nfs/dbraw/zinc/35/55/33/1432355533.db2.gz HWTRPOBOZKFQOA-FQEVSTJZSA-N 0 0 383.448 3.478 20 5 GGBDRN COCCn1c2ccccc2nc1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000190301331 1432356292 /nfs/dbraw/zinc/35/62/92/1432356292.db2.gz GFHIWPGJQVLZKE-UHFFFAOYSA-N 0 0 384.392 3.160 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000190326518 1432362095 /nfs/dbraw/zinc/36/20/95/1432362095.db2.gz WHYDJCWIQJTTIR-CYBMUJFWSA-N 0 0 381.396 3.070 20 5 GGBDRN O=C1[C@@H](Nc2ncc([N+](=O)[O-])s2)CCCN1c1ccc(OC(F)F)cc1 ZINC000190331221 1432362963 /nfs/dbraw/zinc/36/29/63/1432362963.db2.gz NXLGDJACCZPPSX-NSHDSACASA-N 0 0 384.364 3.260 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@](C)(Cc1ccccc1)[C@H](C)O ZINC000190358610 1432366781 /nfs/dbraw/zinc/36/67/81/1432366781.db2.gz MHVWAWVZWOXNCD-XOBRGWDASA-N 0 0 387.436 3.355 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@](C)(Cc1ccccc1)[C@H](C)O ZINC000190358648 1432366807 /nfs/dbraw/zinc/36/68/07/1432366807.db2.gz MHVWAWVZWOXNCD-VBKZILBWSA-N 0 0 387.436 3.355 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCN(c2cncc3ccccc32)CC1 ZINC000190385881 1432371452 /nfs/dbraw/zinc/37/14/52/1432371452.db2.gz JBYKPDUPJYOCTJ-UHFFFAOYSA-N 0 0 390.443 3.424 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)cc1[N+](=O)[O-] ZINC000190395032 1432373187 /nfs/dbraw/zinc/37/31/87/1432373187.db2.gz SPADGIQNIXOZFI-UHFFFAOYSA-N 0 0 391.449 3.221 20 5 GGBDRN CCOC(=O)c1ccnc(N(Cc2ccccc2)C[C@](C)(O)CC)c1[N+](=O)[O-] ZINC000190396729 1432373393 /nfs/dbraw/zinc/37/33/93/1432373393.db2.gz DDHBKGCXNDOHMC-HXUWFJFHSA-N 0 0 387.436 3.334 20 5 GGBDRN Cc1cccc(C(=O)N2CCN(c3cncc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000190397126 1432373454 /nfs/dbraw/zinc/37/34/54/1432373454.db2.gz KBBWWCQOSMJTKT-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCCSc2ccc(F)cc21 ZINC000190423134 1432379218 /nfs/dbraw/zinc/37/92/18/1432379218.db2.gz WPMBBZIBFCPBJC-UHFFFAOYSA-N 0 0 399.407 3.457 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccccc2CN2CCNC2=O)cc1[N+](=O)[O-] ZINC000190428067 1432379766 /nfs/dbraw/zinc/37/97/66/1432379766.db2.gz BVVFWHRXXVQWRM-UHFFFAOYSA-N 0 0 382.420 3.496 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000190431831 1432380772 /nfs/dbraw/zinc/38/07/72/1432380772.db2.gz HPZPWJNLTUOAJX-HOTGVXAUSA-N 0 0 397.214 3.338 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1[O-])[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000190431848 1432380936 /nfs/dbraw/zinc/38/09/36/1432380936.db2.gz HPZPWJNLTUOAJX-HZPDHXFCSA-N 0 0 397.214 3.338 20 5 GGBDRN Cc1ccccc1C[C@@H](CO)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000190521441 1432397257 /nfs/dbraw/zinc/39/72/57/1432397257.db2.gz ZHRMUAZAZRIOMC-HNNXBMFYSA-N 0 0 394.880 3.369 20 5 GGBDRN CC(C)c1cnc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)s1 ZINC000190536129 1432399785 /nfs/dbraw/zinc/39/97/85/1432399785.db2.gz XTZCDSXRJCMHSR-UHFFFAOYSA-N 0 0 390.465 3.252 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)cc([N+](=O)[O-])c1C ZINC000190536453 1432400026 /nfs/dbraw/zinc/40/00/26/1432400026.db2.gz YTVXKLQNAROODW-GOSISDBHSA-N 0 0 392.358 3.404 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000190658125 1432433363 /nfs/dbraw/zinc/43/33/63/1432433363.db2.gz ZAUIYSOKJPUDED-LJQANCHMSA-N 0 0 392.477 3.255 20 5 GGBDRN COc1ccc(OC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000190671301 1432438744 /nfs/dbraw/zinc/43/87/44/1432438744.db2.gz MPLCLQMXBXCSIA-GFCCVEGCSA-N 0 0 387.310 3.441 20 5 GGBDRN Cc1ccc(Cc2nnn(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1 ZINC000190679383 1432440696 /nfs/dbraw/zinc/44/06/96/1432440696.db2.gz RCFOZISXSIASHJ-UHFFFAOYSA-N 0 0 376.376 3.184 20 5 GGBDRN Cc1cc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCC(F)(F)F ZINC000190691316 1432443805 /nfs/dbraw/zinc/44/38/05/1432443805.db2.gz XJWODLUMCTZZAJ-UHFFFAOYSA-N 0 0 397.309 3.422 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cc(Cl)ccc1OCC1CCC1 ZINC000190728841 1432459713 /nfs/dbraw/zinc/45/97/13/1432459713.db2.gz KETOYPBEXVUGMM-UHFFFAOYSA-N 0 0 391.811 3.228 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(Cl)c(S(C)(=O)=O)c1 ZINC000190773897 1432474039 /nfs/dbraw/zinc/47/40/39/1432474039.db2.gz QAASSACXOPKKCH-UHFFFAOYSA-N 0 0 397.840 3.011 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000190776254 1432475472 /nfs/dbraw/zinc/47/54/72/1432475472.db2.gz NJRRCCYZUJMZHW-ZFWWWQNUSA-N 0 0 391.468 3.069 20 5 GGBDRN CC(C)c1ccc(C(=O)NCc2nc(COc3ccccc3)n[nH]2)cc1[N+](=O)[O-] ZINC000190792214 1432481800 /nfs/dbraw/zinc/48/18/00/1432481800.db2.gz PAKFRYGRGUZEON-UHFFFAOYSA-N 0 0 395.419 3.345 20 5 GGBDRN CCCc1cnc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000190806992 1432489174 /nfs/dbraw/zinc/48/91/74/1432489174.db2.gz WHZSEPUQWNDOKJ-UHFFFAOYSA-N 0 0 390.465 3.380 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCS(=O)(=O)c3ccccc3C2)cc1[N+](=O)[O-] ZINC000190821084 1432493955 /nfs/dbraw/zinc/49/39/55/1432493955.db2.gz WIRPBBZYKRRKDT-UHFFFAOYSA-N 0 0 388.445 3.148 20 5 GGBDRN COc1ccc2c(c1NC(=O)c1nnn(-c3cccc([N+](=O)[O-])c3)c1C)CCC2 ZINC000190837168 1432501525 /nfs/dbraw/zinc/50/15/25/1432501525.db2.gz ZWOMLDVRLDYYQO-UHFFFAOYSA-N 0 0 393.403 3.234 20 5 GGBDRN COc1cc(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)cc([N+](=O)[O-])c1C ZINC000190875031 1432515751 /nfs/dbraw/zinc/51/57/51/1432515751.db2.gz LGNMSKXGDKDMLE-HNNXBMFYSA-N 0 0 399.447 3.177 20 5 GGBDRN COc1cc(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)cc([N+](=O)[O-])c1C ZINC000190875051 1432515860 /nfs/dbraw/zinc/51/58/60/1432515860.db2.gz LGNMSKXGDKDMLE-OAHLLOKOSA-N 0 0 399.447 3.177 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccn(CCc2ccncc2)n1 ZINC000190905193 1432525569 /nfs/dbraw/zinc/52/55/69/1432525569.db2.gz RXDLPHGPFCFCDW-UHFFFAOYSA-N 0 0 382.380 3.082 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCc1ccccc1OC(F)F ZINC000190907041 1432526225 /nfs/dbraw/zinc/52/62/25/1432526225.db2.gz CZRSMLWCSDPAEI-UHFFFAOYSA-N 0 0 386.376 3.254 20 5 GGBDRN Cc1ccc(C[C@H](CO)NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000190923094 1432530274 /nfs/dbraw/zinc/53/02/74/1432530274.db2.gz VLHYPWVOASOOFV-MRXNPFEDSA-N 0 0 397.456 3.360 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)C2=O)cc1 ZINC000190934059 1432532511 /nfs/dbraw/zinc/53/25/11/1432532511.db2.gz GCJXRZOSCAHYOT-QGZVFWFLSA-N 0 0 396.447 3.443 20 5 GGBDRN CCc1cc(O)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000191032086 1432553345 /nfs/dbraw/zinc/55/33/45/1432553345.db2.gz ALPRDGBNOMGXMD-CQSZACIVSA-N 0 0 389.433 3.168 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(C(F)(F)F)cc1C ZINC000191057344 1432558938 /nfs/dbraw/zinc/55/89/38/1432558938.db2.gz FGIBFLGUQNBFRK-UHFFFAOYSA-N 0 0 395.337 3.485 20 5 GGBDRN CCC[C@@H](C)c1cc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n[nH]1 ZINC000191068787 1432561049 /nfs/dbraw/zinc/56/10/49/1432561049.db2.gz WVFWAAPEQDAJCU-SECBINFHSA-N 0 0 379.804 3.452 20 5 GGBDRN CCc1cc(O)ccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000191086067 1432564431 /nfs/dbraw/zinc/56/44/31/1432564431.db2.gz JNVFYZAXBYDVHK-UHFFFAOYSA-N 0 0 385.376 3.190 20 5 GGBDRN CCCc1c(NC(=O)Cn2cc([N+](=O)[O-])nc2C)cnn1-c1ccc(F)cc1 ZINC000191096549 1432566811 /nfs/dbraw/zinc/56/68/11/1432566811.db2.gz NIMYWCHUSZTJPI-UHFFFAOYSA-N 0 0 386.387 3.016 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191108716 1432569711 /nfs/dbraw/zinc/56/97/11/1432569711.db2.gz XBXMGYJIZHVBAB-UHFFFAOYSA-N 0 0 391.424 3.291 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191120887 1432572025 /nfs/dbraw/zinc/57/20/25/1432572025.db2.gz CJZIENZEIOJFPU-UHFFFAOYSA-N 0 0 379.775 3.466 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191134805 1432574303 /nfs/dbraw/zinc/57/43/03/1432574303.db2.gz BJHZDYJCTAOVBW-UHFFFAOYSA-N 0 0 396.378 3.361 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191171018 1432582250 /nfs/dbraw/zinc/58/22/50/1432582250.db2.gz MESKQJZJWHFNRM-UHFFFAOYSA-N 0 0 379.775 3.466 20 5 GGBDRN Cn1cc([C@@H]2CSCCN2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000191201618 1432590335 /nfs/dbraw/zinc/59/03/35/1432590335.db2.gz IUZUJZOOHJWOHP-KRWDZBQOSA-N 0 0 385.449 3.273 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000191207087 1432591911 /nfs/dbraw/zinc/59/19/11/1432591911.db2.gz BMEWXQRFKGONTE-UHFFFAOYSA-N 0 0 399.447 3.276 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(c2cccc(Cl)c2F)CCCC1 ZINC000191220039 1432595151 /nfs/dbraw/zinc/59/51/51/1432595151.db2.gz XPLHGLCUWLLUIW-UHFFFAOYSA-N 0 0 380.807 3.212 20 5 GGBDRN Cc1cccc(C[C@H](CO)NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000191242836 1432602388 /nfs/dbraw/zinc/60/23/88/1432602388.db2.gz AAEBYZCORFUKLE-MRXNPFEDSA-N 0 0 392.839 3.045 20 5 GGBDRN Cc1ccc(-n2cc(NC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)cn2)c(C)c1 ZINC000191259153 1432609757 /nfs/dbraw/zinc/60/97/57/1432609757.db2.gz YWDDSDBLDWWIAX-UHFFFAOYSA-N 0 0 393.403 3.283 20 5 GGBDRN O=C(CC1CCC2(CC1)OCCO2)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000191269657 1432615151 /nfs/dbraw/zinc/61/51/51/1432615151.db2.gz PLZRTDXVRYEZCX-UHFFFAOYSA-N 0 0 376.453 3.357 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1c2ccccc2CCC[C@H]1C ZINC000191271334 1432615855 /nfs/dbraw/zinc/61/58/55/1432615855.db2.gz CQZNIHMUVQDGHM-BFUOFWGJSA-N 0 0 397.431 3.372 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@H]3CC[C@@H](O)C3)cc2[N+](=O)[O-])n1 ZINC000191276730 1432618338 /nfs/dbraw/zinc/61/83/38/1432618338.db2.gz XHDLFSORENHFNF-WCQYABFASA-N 0 0 393.490 3.402 20 5 GGBDRN C[C@H](NC(=O)N1CCC(Oc2ccc(F)nc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000191289926 1432621826 /nfs/dbraw/zinc/62/18/26/1432621826.db2.gz YHCBWAHNFXLGCO-ZDUSSCGKSA-N 0 0 388.399 3.443 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000191289756 1432621968 /nfs/dbraw/zinc/62/19/68/1432621968.db2.gz YZKSRMFWIAMRRE-HNAYVOBHSA-N 0 0 396.447 3.065 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cc(CCc3ccccc3C)[nH]n2)c1[N+](=O)[O-] ZINC000191304333 1432625951 /nfs/dbraw/zinc/62/59/51/1432625951.db2.gz HKHZHOQOAHMQGV-UHFFFAOYSA-N 0 0 382.424 3.339 20 5 GGBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000191311795 1432629059 /nfs/dbraw/zinc/62/90/59/1432629059.db2.gz ZJFLDFDZAAUIPM-QGZVFWFLSA-N 0 0 396.447 3.210 20 5 GGBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000191314464 1432630027 /nfs/dbraw/zinc/63/00/27/1432630027.db2.gz CGZNALORSFPENE-UHFFFAOYSA-N 0 0 388.468 3.252 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1CCN(c2ccccc2F)C1=O ZINC000191323201 1432631988 /nfs/dbraw/zinc/63/19/88/1432631988.db2.gz WPBKEXDQJKABFT-AWEZNQCLSA-N 0 0 386.383 3.278 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCNC(=O)CC1CCCCC1 ZINC000191322328 1432632398 /nfs/dbraw/zinc/63/23/98/1432632398.db2.gz INLGKQUVTVSHJI-UHFFFAOYSA-N 0 0 376.457 3.420 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NCC(F)(F)C(F)F)cc2[N+](=O)[O-])CC1 ZINC000191335297 1432634746 /nfs/dbraw/zinc/63/47/46/1432634746.db2.gz XJJKWHZCFLGPET-UHFFFAOYSA-N 0 0 377.338 3.461 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](CS(C)(=O)=O)c1ccccc1 ZINC000191335500 1432635553 /nfs/dbraw/zinc/63/55/53/1432635553.db2.gz CQXPTUAFVLZNIH-MRXNPFEDSA-N 0 0 391.449 3.119 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)CC2)nc(C)n1 ZINC000191359567 1432640976 /nfs/dbraw/zinc/64/09/76/1432640976.db2.gz FYMKMGWMPBPYTA-UHFFFAOYSA-N 0 0 398.467 3.409 20 5 GGBDRN Cc1cnc(COC(=O)C[C@H](C)NC(=O)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000191363830 1432641927 /nfs/dbraw/zinc/64/19/27/1432641927.db2.gz OSMRCATZOGZIBN-ZDUSSCGKSA-N 0 0 377.441 3.125 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12 ZINC000191370116 1432643545 /nfs/dbraw/zinc/64/35/45/1432643545.db2.gz NNTBYZFQGQAQDH-OAHLLOKOSA-N 0 0 382.420 3.418 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC(C)(C)CN1CCOCC1 ZINC000191373597 1432644496 /nfs/dbraw/zinc/64/44/96/1432644496.db2.gz ZULPJEKSZRGHAI-UHFFFAOYSA-N 0 0 378.473 3.034 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](CN1CCOCC1)c1ccccc1 ZINC000191381233 1432646762 /nfs/dbraw/zinc/64/67/62/1432646762.db2.gz NNJUXXLYTOETKK-LJQANCHMSA-N 0 0 398.463 3.407 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCCS(=O)(=O)c1ccccc1 ZINC000191381556 1432646821 /nfs/dbraw/zinc/64/68/21/1432646821.db2.gz GEIVGLSWAQMZOE-UHFFFAOYSA-N 0 0 391.449 3.197 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000191382472 1432647126 /nfs/dbraw/zinc/64/71/26/1432647126.db2.gz YXVNMJSOQFBYHH-OAHLLOKOSA-N 0 0 376.457 3.228 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000191388068 1432648157 /nfs/dbraw/zinc/64/81/57/1432648157.db2.gz BECANTWORQRLHW-KRWDZBQOSA-N 0 0 396.447 3.382 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000191388081 1432648279 /nfs/dbraw/zinc/64/82/79/1432648279.db2.gz BECANTWORQRLHW-QGZVFWFLSA-N 0 0 396.447 3.382 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1ccccc1CN1CCOCC1 ZINC000191391909 1432649524 /nfs/dbraw/zinc/64/95/24/1432649524.db2.gz PXROAQCCWGUMKL-UHFFFAOYSA-N 0 0 398.463 3.366 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](CC(C)C)N1CCOCC1 ZINC000191391837 1432649652 /nfs/dbraw/zinc/64/96/52/1432649652.db2.gz LPTCDUUYDYGPPB-MRXNPFEDSA-N 0 0 378.473 3.080 20 5 GGBDRN Cc1cnc(COC(=O)CCc2nnc(-c3ccccc3)o2)c(C)c1[N+](=O)[O-] ZINC000191391298 1432649933 /nfs/dbraw/zinc/64/99/33/1432649933.db2.gz BSBVCFOOLOUODE-UHFFFAOYSA-N 0 0 382.376 3.333 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCc1ccccc1OC(F)F ZINC000191397947 1432652973 /nfs/dbraw/zinc/65/29/73/1432652973.db2.gz IZVKCCRUAZRTKJ-UHFFFAOYSA-N 0 0 380.347 3.324 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1F ZINC000191403906 1432654358 /nfs/dbraw/zinc/65/43/58/1432654358.db2.gz PDQUAFBWKRDMGK-UHFFFAOYSA-N 0 0 388.399 3.211 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[S@](=O)Cc1ccccc1 ZINC000191408179 1432655483 /nfs/dbraw/zinc/65/54/83/1432655483.db2.gz NWZCSUOUVGMUJH-SANMLTNESA-N 0 0 375.450 3.282 20 5 GGBDRN O=C(Nc1ccc(-c2cc[nH]n2)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191413216 1432657048 /nfs/dbraw/zinc/65/70/48/1432657048.db2.gz BOIFLNFYJJQMAI-UHFFFAOYSA-N 0 0 379.376 3.280 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000191416061 1432657547 /nfs/dbraw/zinc/65/75/47/1432657547.db2.gz AICITJVLAJOKSS-NRFANRHFSA-N 0 0 399.447 3.032 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000191419325 1432658474 /nfs/dbraw/zinc/65/84/74/1432658474.db2.gz PBFMZMWKJJKOLU-NRFANRHFSA-N 0 0 399.447 3.032 20 5 GGBDRN O=C(Nc1cnn(Cc2ccccc2)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191434093 1432661380 /nfs/dbraw/zinc/66/13/80/1432661380.db2.gz WDCFPSFOHPYEBJ-UHFFFAOYSA-N 0 0 393.403 3.135 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@H](c3nncn3C(C)C)C2)cc([N+](=O)[O-])c1C ZINC000191458517 1432665832 /nfs/dbraw/zinc/66/58/32/1432665832.db2.gz NBDPYQFXPRJZEO-AWEZNQCLSA-N 0 0 387.440 3.104 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H](c3nncn3C(C)C)C2)cc([N+](=O)[O-])c1C ZINC000191458528 1432665910 /nfs/dbraw/zinc/66/59/10/1432665910.db2.gz NBDPYQFXPRJZEO-CQSZACIVSA-N 0 0 387.440 3.104 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCCOCC(F)F)cc2[N+](=O)[O-])C1 ZINC000191479063 1432668915 /nfs/dbraw/zinc/66/89/15/1432668915.db2.gz XUVHIIALKQXREI-BETUJISGSA-N 0 0 385.411 3.089 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191491019 1432671294 /nfs/dbraw/zinc/67/12/94/1432671294.db2.gz ABTYLTTUMGSYDM-GOSISDBHSA-N 0 0 382.420 3.334 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCc2cc(Cl)ccc2C1 ZINC000191494001 1432671926 /nfs/dbraw/zinc/67/19/26/1432671926.db2.gz GYEBWHBPVZTPOQ-UHFFFAOYSA-N 0 0 383.795 3.027 20 5 GGBDRN COc1cc(F)c(NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000191517522 1432677487 /nfs/dbraw/zinc/67/74/87/1432677487.db2.gz LRXBXSDYZQZMQC-UHFFFAOYSA-N 0 0 379.319 3.177 20 5 GGBDRN CCN(C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000191557084 1432682606 /nfs/dbraw/zinc/68/26/06/1432682606.db2.gz ZIBCQSIMYBOTCE-QGZVFWFLSA-N 0 0 397.431 3.179 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000191567654 1432684972 /nfs/dbraw/zinc/68/49/72/1432684972.db2.gz ZAHASVUXYZNBQH-DIFFPNOSSA-N 0 0 375.812 3.433 20 5 GGBDRN Cn1ccc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3N3CCOCC3)c21 ZINC000191595853 1432689038 /nfs/dbraw/zinc/68/90/38/1432689038.db2.gz FMXFQDICKWPWAF-UHFFFAOYSA-N 0 0 380.404 3.175 20 5 GGBDRN COc1cc(CN[C@H](C)c2nc(Cc3ccccc3)no2)c([N+](=O)[O-])cc1OC ZINC000191598246 1432689382 /nfs/dbraw/zinc/68/93/82/1432689382.db2.gz JAWQWJPIUPILCJ-CYBMUJFWSA-N 0 0 398.419 3.437 20 5 GGBDRN CCN(C)C(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000191603047 1432690501 /nfs/dbraw/zinc/69/05/01/1432690501.db2.gz JDKXYMYBIGBTIS-CYBMUJFWSA-N 0 0 387.461 3.343 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)C2=O)cc1 ZINC000191619493 1432694089 /nfs/dbraw/zinc/69/40/89/1432694089.db2.gz ALENMAHVYVJFGT-IFXJQAMLSA-N 0 0 399.422 3.063 20 5 GGBDRN CC(C)(C)n1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)nn1 ZINC000191633622 1432696978 /nfs/dbraw/zinc/69/69/78/1432696978.db2.gz DTLFGJVMUGNEEM-UHFFFAOYSA-N 0 0 385.346 3.146 20 5 GGBDRN COc1cc(C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)cc([N+](=O)[O-])c1C ZINC000191634047 1432697040 /nfs/dbraw/zinc/69/70/40/1432697040.db2.gz DADFGTIEUQNQOB-UHFFFAOYSA-N 0 0 396.407 3.263 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)n1 ZINC000191718995 1432712580 /nfs/dbraw/zinc/71/25/80/1432712580.db2.gz HBTQPBSKCATEMX-NHYWBVRUSA-N 0 0 378.816 3.067 20 5 GGBDRN Cn1cc([C@@H]2CSCCN2Cc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000191750319 1432717661 /nfs/dbraw/zinc/71/76/61/1432717661.db2.gz ZQGNVDZWECFVEJ-AWEZNQCLSA-N 0 0 384.408 3.220 20 5 GGBDRN CC(=O)Nc1cc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)ccc1C ZINC000191788988 1432725218 /nfs/dbraw/zinc/72/52/18/1432725218.db2.gz GGYSNOOADXDVMJ-UHFFFAOYSA-N 0 0 377.422 3.279 20 5 GGBDRN CCOC[C@@H](NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C(C)C ZINC000191797649 1432727279 /nfs/dbraw/zinc/72/72/79/1432727279.db2.gz AGZLAPCFPZUOPC-GOSISDBHSA-N 0 0 379.457 3.209 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000191805221 1432729359 /nfs/dbraw/zinc/72/93/59/1432729359.db2.gz XBWYPXRZKGBEAA-NSHDSACASA-N 0 0 395.246 3.493 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cccc(Cl)c2F)C1=O ZINC000191823207 1432732949 /nfs/dbraw/zinc/73/29/49/1432732949.db2.gz YTUHOVMTBFSNCL-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3nc(C(C)C)cs3)C2)n1 ZINC000191826464 1432733388 /nfs/dbraw/zinc/73/33/88/1432733388.db2.gz IDBJBRJAGWLLML-GFCCVEGCSA-N 0 0 377.470 3.411 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(c1ccccc1)[C@H]1CCOC1 ZINC000191831404 1432735126 /nfs/dbraw/zinc/73/51/26/1432735126.db2.gz VNVXCLYYZKOMRB-KRWDZBQOSA-N 0 0 376.434 3.141 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(c2ccccc2)[C@@H]2CCOC2)c1C ZINC000191832960 1432735305 /nfs/dbraw/zinc/73/53/05/1432735305.db2.gz RFDNWIARGBJKTE-MRXNPFEDSA-N 0 0 376.434 3.196 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnc(-c2cc3ccccc3o2)s1 ZINC000191844421 1432738426 /nfs/dbraw/zinc/73/84/26/1432738426.db2.gz WICMTFZXTIRPAO-UHFFFAOYSA-N 0 0 398.404 3.393 20 5 GGBDRN COc1cccc(Cl)c1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000191859080 1432741493 /nfs/dbraw/zinc/74/14/93/1432741493.db2.gz MOZVDXMMPJUXEF-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN COc1cccc(Cl)c1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000191865027 1432742860 /nfs/dbraw/zinc/74/28/60/1432742860.db2.gz ZSGFLHYWLRUNRB-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN Cc1cccc(C[C@H](CO)NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000191881466 1432746110 /nfs/dbraw/zinc/74/61/10/1432746110.db2.gz ZUTYBNZSBVPKCM-CYBMUJFWSA-N 0 0 395.362 3.230 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N(Cc2ccco2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000191895460 1432749668 /nfs/dbraw/zinc/74/96/68/1432749668.db2.gz IKDMOIUOAMRGOA-MRXNPFEDSA-N 0 0 394.449 3.175 20 5 GGBDRN COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000191901198 1432750823 /nfs/dbraw/zinc/75/08/23/1432750823.db2.gz RILDQOWUKQQGDZ-UHFFFAOYSA-N 0 0 398.202 3.165 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCO[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000191917625 1432755243 /nfs/dbraw/zinc/75/52/43/1432755243.db2.gz NEHKVYZFBXHHNC-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN COc1cc(C(=O)Nc2cc(C)nn2-c2cc(C)nc(C)n2)cc([N+](=O)[O-])c1C ZINC000191919233 1432755799 /nfs/dbraw/zinc/75/57/99/1432755799.db2.gz RYCJHFVXQVKRRK-UHFFFAOYSA-N 0 0 396.407 3.065 20 5 GGBDRN CCc1ccc([C@H]2COCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)o1 ZINC000191979253 1432773420 /nfs/dbraw/zinc/77/34/20/1432773420.db2.gz QNOPVHSBMOYMHW-MRXNPFEDSA-N 0 0 394.449 3.129 20 5 GGBDRN Cn1cc([C@H]2CSCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn1 ZINC000191990639 1432775814 /nfs/dbraw/zinc/77/58/14/1432775814.db2.gz PLWICTOMCJGORW-CQSZACIVSA-N 0 0 388.474 3.473 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC[C@@H]1c1cnn(C)c1 ZINC000191998076 1432777047 /nfs/dbraw/zinc/77/70/47/1432777047.db2.gz NUIFNAZWTRYREK-BLLLJJGKSA-N 0 0 392.506 3.126 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC[C@H]1c1cnn(C)c1 ZINC000191998087 1432777161 /nfs/dbraw/zinc/77/71/61/1432777161.db2.gz NUIFNAZWTRYREK-LRDDRELGSA-N 0 0 392.506 3.126 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000192039120 1432784153 /nfs/dbraw/zinc/78/41/53/1432784153.db2.gz VSZKRSBKFNJMTN-WBVHZDCISA-N 0 0 392.477 3.045 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000192039866 1432784576 /nfs/dbraw/zinc/78/45/76/1432784576.db2.gz AUZIQLYBVRWWFN-CJNGLKHVSA-N 0 0 396.490 3.424 20 5 GGBDRN C[C@@H](O)[C@](C)(CNC(=O)CCNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000192056781 1432788930 /nfs/dbraw/zinc/78/89/30/1432788930.db2.gz XSHIWMGLDAGXCD-IERDGZPVSA-N 0 0 385.464 3.143 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCS(=O)(=O)C1 ZINC000192065894 1432791504 /nfs/dbraw/zinc/79/15/04/1432791504.db2.gz XPZUZDVRLVXWEI-GFCCVEGCSA-N 0 0 398.868 3.375 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)NC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000192073088 1432793173 /nfs/dbraw/zinc/79/31/73/1432793173.db2.gz JBMUIPMQDMNFKU-UHFFFAOYSA-N 0 0 388.733 3.269 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)NC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000192073798 1432793212 /nfs/dbraw/zinc/79/32/12/1432793212.db2.gz QIWSMLZABBMFPH-UHFFFAOYSA-N 0 0 388.733 3.269 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N(c1ccccc1)[C@@H]1CCOC1 ZINC000192076985 1432793947 /nfs/dbraw/zinc/79/39/47/1432793947.db2.gz NYHHOJWERGHLTL-MRXNPFEDSA-N 0 0 378.388 3.216 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000192141373 1432805675 /nfs/dbraw/zinc/80/56/75/1432805675.db2.gz YRZYSCMHVDDHLG-YVEFUNNKSA-N 0 0 375.450 3.378 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000192144418 1432806594 /nfs/dbraw/zinc/80/65/94/1432806594.db2.gz HMFIQZVKLSFBKP-UHFFFAOYSA-N 0 0 379.775 3.466 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192145613 1432807058 /nfs/dbraw/zinc/80/70/58/1432807058.db2.gz RPTBHNSUEWHBQT-WMZOPIPTSA-N 0 0 390.461 3.410 20 5 GGBDRN CC(C)c1c(NC(=O)Cn2ccc([N+](=O)[O-])n2)cnn1-c1ccc(Cl)cc1 ZINC000192161308 1432809972 /nfs/dbraw/zinc/80/99/72/1432809972.db2.gz VTPBLAMFYUEROT-UHFFFAOYSA-N 0 0 388.815 3.393 20 5 GGBDRN COCCOc1ccc(CC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000192176252 1432812430 /nfs/dbraw/zinc/81/24/30/1432812430.db2.gz VSOOOEYBKUQLPD-UHFFFAOYSA-N 0 0 378.812 3.132 20 5 GGBDRN CCCc1c(NC(=O)c2cc([N+](=O)[O-])cnc2N)cnn1-c1ccc(F)cc1 ZINC000192232634 1432820445 /nfs/dbraw/zinc/82/04/45/1432820445.db2.gz NHGLQLKSGZSVNO-UHFFFAOYSA-N 0 0 384.371 3.102 20 5 GGBDRN CCCc1c(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1 ZINC000192234703 1432820664 /nfs/dbraw/zinc/82/06/64/1432820664.db2.gz DHRDJSUOGQEOOJ-UHFFFAOYSA-N 0 0 385.355 3.225 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000192257223 1432823382 /nfs/dbraw/zinc/82/33/82/1432823382.db2.gz OTSFKFYKTWHTPF-UHFFFAOYSA-N 0 0 396.451 3.092 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N1CCC(c2ccncc2)CC1 ZINC000192260149 1432823827 /nfs/dbraw/zinc/82/38/27/1432823827.db2.gz TZFCKWKNIACAEQ-UHFFFAOYSA-N 0 0 379.413 3.006 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCC(c3ccncc3)CC2)cc1C ZINC000192262497 1432824106 /nfs/dbraw/zinc/82/41/06/1432824106.db2.gz DPPZCJNSWDHUKA-UHFFFAOYSA-N 0 0 375.450 3.175 20 5 GGBDRN Cc1c([C@@H](C)Nc2ccc([N+](=O)[O-])c(N[C@H](C)c3cnn(C)c3C)n2)cnn1C ZINC000192275859 1432826006 /nfs/dbraw/zinc/82/60/06/1432826006.db2.gz RDSFRDAEXDADEE-VXGBXAGGSA-N 0 0 398.471 3.420 20 5 GGBDRN Cc1c([C@@H](C)Nc2ccc([N+](=O)[O-])c(N[C@@H](C)c3cnn(C)c3C)n2)cnn1C ZINC000192275847 1432826011 /nfs/dbraw/zinc/82/60/11/1432826011.db2.gz RDSFRDAEXDADEE-NEPJUHHUSA-N 0 0 398.471 3.420 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000192289402 1432828047 /nfs/dbraw/zinc/82/80/47/1432828047.db2.gz CPBTVTHBWUCAOR-UHFFFAOYSA-N 0 0 390.461 3.141 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN(Cc1c(F)cccc1F)C1CC1 ZINC000192299832 1432828966 /nfs/dbraw/zinc/82/89/66/1432828966.db2.gz NPNQIQJTJRFLAE-CQSZACIVSA-N 0 0 378.375 3.277 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1c(F)cccc1F)C1CC1 ZINC000192297979 1432829056 /nfs/dbraw/zinc/82/90/56/1432829056.db2.gz CVSNUIMFULBWMH-UHFFFAOYSA-N 0 0 391.374 3.485 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H]1CCCc2c(O)cccc21 ZINC000192326996 1432832395 /nfs/dbraw/zinc/83/23/95/1432832395.db2.gz NNFMTSGXSOOMPS-OAHLLOKOSA-N 0 0 383.404 3.050 20 5 GGBDRN CCNc1ccc(Cl)cc1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000192354564 1432835835 /nfs/dbraw/zinc/83/58/35/1432835835.db2.gz UPQWPWNOYMDRJX-ZDUSSCGKSA-N 0 0 389.843 3.402 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])n1 ZINC000192358100 1432836546 /nfs/dbraw/zinc/83/65/46/1432836546.db2.gz AKIVJNPBOUWTJG-AWEZNQCLSA-N 0 0 375.406 3.205 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC(O)(c2ccccc2Cl)CC1 ZINC000192404246 1432841183 /nfs/dbraw/zinc/84/11/83/1432841183.db2.gz IGEOOXRLELAGJF-UHFFFAOYSA-N 0 0 390.823 3.137 20 5 GGBDRN C[C@@H](c1nc(-c2cccs2)no1)N1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000192454151 1432846567 /nfs/dbraw/zinc/84/65/67/1432846567.db2.gz SWYNJTCBEZHPFT-JTQLQIEISA-N 0 0 392.466 3.046 20 5 GGBDRN O=C1[C@H](Nc2ncc([N+](=O)[O-])s2)CCN1c1cccc(OC(F)(F)F)c1 ZINC000192455654 1432846939 /nfs/dbraw/zinc/84/69/39/1432846939.db2.gz FPLWQKPQLWCKFT-SNVBAGLBSA-N 0 0 388.327 3.167 20 5 GGBDRN CCOCCOc1c(Cl)cccc1NC(=O)c1n[nH]c(CC)c1[N+](=O)[O-] ZINC000192461570 1432847551 /nfs/dbraw/zinc/84/75/51/1432847551.db2.gz OXGQSRYFVAVSRI-UHFFFAOYSA-N 0 0 382.804 3.201 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000192465633 1432848010 /nfs/dbraw/zinc/84/80/10/1432848010.db2.gz BVZWVQTYVLIRTR-GFCCVEGCSA-N 0 0 375.812 3.025 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000192466089 1432848226 /nfs/dbraw/zinc/84/82/26/1432848226.db2.gz WLSNQWXYRLNJBM-UHFFFAOYSA-N 0 0 377.441 3.200 20 5 GGBDRN COc1cccc(C(=O)NCCC(=O)Nc2cccc(Cl)c2C)c1[N+](=O)[O-] ZINC000192479878 1432849646 /nfs/dbraw/zinc/84/96/46/1432849646.db2.gz WCXCJDOWQKCNCC-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000192484316 1432849854 /nfs/dbraw/zinc/84/98/54/1432849854.db2.gz MCAJXKMWRWXBMD-UHFFFAOYSA-N 0 0 386.433 3.005 20 5 GGBDRN CCc1n[nH]c(C(=O)N(CCc2ccccn2)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000192494415 1432850817 /nfs/dbraw/zinc/85/08/17/1432850817.db2.gz BWIZHNUHRBWNPQ-UHFFFAOYSA-N 0 0 397.410 3.300 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(Cc2csc(C(C)(C)C)n2)CC1 ZINC000192507950 1432852715 /nfs/dbraw/zinc/85/27/15/1432852715.db2.gz CGMCIUWRRBBAPP-UHFFFAOYSA-N 0 0 392.529 3.196 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1 ZINC000192511528 1432853300 /nfs/dbraw/zinc/85/33/00/1432853300.db2.gz BUMGRBDCUGRSCX-LBPRGKRZSA-N 0 0 392.847 3.023 20 5 GGBDRN CCc1n[nH]c(C(=O)N(Cc2ccc3c(c2)CCO3)C2CCCC2)c1[N+](=O)[O-] ZINC000192511188 1432853327 /nfs/dbraw/zinc/85/33/27/1432853327.db2.gz ORXGTKXPDLRTJB-UHFFFAOYSA-N 0 0 384.436 3.400 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(NC(=O)c2ccncc2)c1 ZINC000192518941 1432854028 /nfs/dbraw/zinc/85/40/28/1432854028.db2.gz ZMNQNLMXPCANCG-UHFFFAOYSA-N 0 0 380.408 3.379 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@@H](c3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000192521868 1432854422 /nfs/dbraw/zinc/85/44/22/1432854422.db2.gz OXWRFZOCAXFYOA-MRXNPFEDSA-N 0 0 376.796 3.471 20 5 GGBDRN O=C1C[C@H](Nc2ncc([N+](=O)[O-])s2)CN1Cc1ccccc1C(F)(F)F ZINC000192533496 1432856036 /nfs/dbraw/zinc/85/60/36/1432856036.db2.gz WOGLLWPLFPSUSO-JTQLQIEISA-N 0 0 386.355 3.283 20 5 GGBDRN O=C([C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CCC[C@H]1c1ccccc1 ZINC000192535845 1432856249 /nfs/dbraw/zinc/85/62/49/1432856249.db2.gz ZAASQYMVPQUGRT-QAPCUYQASA-N 0 0 397.406 3.451 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000192541339 1432857008 /nfs/dbraw/zinc/85/70/08/1432857008.db2.gz OBAXTBOVAZVYGW-MRXNPFEDSA-N 0 0 393.875 3.258 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCC(=O)Nc1cccc(C(=O)NC2CC2)c1 ZINC000192541450 1432857076 /nfs/dbraw/zinc/85/70/76/1432857076.db2.gz AGAHJORWKDDVCP-UHFFFAOYSA-N 0 0 382.420 3.154 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)c1[N+](=O)[O-] ZINC000192546545 1432857743 /nfs/dbraw/zinc/85/77/43/1432857743.db2.gz ILBMRVWSRCSBMR-UHFFFAOYSA-N 0 0 385.405 3.191 20 5 GGBDRN COc1ccccc1-c1nc(C2CCN(c3ncc([N+](=O)[O-])s3)CC2)no1 ZINC000192549575 1432858225 /nfs/dbraw/zinc/85/82/25/1432858225.db2.gz ZWLMMXRCSJRKRG-UHFFFAOYSA-N 0 0 387.421 3.494 20 5 GGBDRN CCc1n[nH]c(C(=O)N2C[C@@H](c3ccccc3Cl)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000192559429 1432859731 /nfs/dbraw/zinc/85/97/31/1432859731.db2.gz HMTCBHBGILMFJF-HZMBPMFUSA-N 0 0 378.816 3.136 20 5 GGBDRN CCc1n[nH]c(C(=O)N2C[C@H](c3ccccc3Cl)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000192559414 1432859825 /nfs/dbraw/zinc/85/98/25/1432859825.db2.gz HMTCBHBGILMFJF-IINYFYTJSA-N 0 0 378.816 3.136 20 5 GGBDRN C[C@H]1C[C@]2(CC(C)(C)C1)NC(=O)N(CN(C)Cc1ccccc1[N+](=O)[O-])C2=O ZINC000192560422 1432859941 /nfs/dbraw/zinc/85/99/41/1432859941.db2.gz KEFVNFDUPRLTTP-JLTOFOAXSA-N 0 0 388.468 3.121 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN([C@H](C)c2ccc(F)cc2F)CC1 ZINC000192565637 1432860937 /nfs/dbraw/zinc/86/09/37/1432860937.db2.gz CAXZXMZLLNQMLO-CYBMUJFWSA-N 0 0 379.411 3.281 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC(C(=O)N2CCCC2)CC1 ZINC000192565734 1432860985 /nfs/dbraw/zinc/86/09/85/1432860985.db2.gz YDNAGFMEBVOVOJ-UHFFFAOYSA-N 0 0 380.832 3.115 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1 ZINC000192570257 1432861471 /nfs/dbraw/zinc/86/14/71/1432861471.db2.gz SFVXWSNXIIZEGC-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN Nc1c(C(=O)N2CCC(O)(c3ccccc3Cl)CC2)cc(F)cc1[N+](=O)[O-] ZINC000192577218 1432862174 /nfs/dbraw/zinc/86/21/74/1432862174.db2.gz MLGMCFUXWDXWTM-UHFFFAOYSA-N 0 0 393.802 3.093 20 5 GGBDRN COc1ccc(C(=O)N2CCC(O)(c3ccccc3Cl)CC2)cc1[N+](=O)[O-] ZINC000192580652 1432862777 /nfs/dbraw/zinc/86/27/77/1432862777.db2.gz AORBCAXLBZROGW-UHFFFAOYSA-N 0 0 390.823 3.381 20 5 GGBDRN Cc1cc(C(=O)N2CCC(O)(c3ccccc3Cl)CC2)c(N)c([N+](=O)[O-])c1 ZINC000192582883 1432862972 /nfs/dbraw/zinc/86/29/72/1432862972.db2.gz WRJYGDMOBWBLPP-UHFFFAOYSA-N 0 0 389.839 3.263 20 5 GGBDRN COc1cc(C(=O)N2CCC(O)(c3ccccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000192587632 1432863170 /nfs/dbraw/zinc/86/31/70/1432863170.db2.gz SBTVBGFGTMNUAO-UHFFFAOYSA-N 0 0 390.823 3.381 20 5 GGBDRN Cc1c(Cl)cccc1C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000192591026 1432863763 /nfs/dbraw/zinc/86/37/63/1432863763.db2.gz FEPBWCBSRDVTIH-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN COc1cccc(C(=O)N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000192601677 1432864839 /nfs/dbraw/zinc/86/48/39/1432864839.db2.gz DWXJSOCCRAWPDW-AWEZNQCLSA-N 0 0 386.379 3.478 20 5 GGBDRN CCOc1cc(C(=O)N2CCc3c2cc(F)cc3F)c([N+](=O)[O-])cc1OC ZINC000192603868 1432865087 /nfs/dbraw/zinc/86/50/87/1432865087.db2.gz YBWMKXCCXWUKDD-UHFFFAOYSA-N 0 0 378.331 3.483 20 5 GGBDRN CCCCN(CC(F)(F)F)C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000192608340 1432865510 /nfs/dbraw/zinc/86/55/10/1432865510.db2.gz LRFAXRJXNCLOHT-UHFFFAOYSA-N 0 0 385.346 3.289 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000192615365 1432866430 /nfs/dbraw/zinc/86/64/30/1432866430.db2.gz QPMLNIBWHTYPFU-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN O=C(Oc1cccc2ncccc21)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000192625764 1432867932 /nfs/dbraw/zinc/86/79/32/1432867932.db2.gz MDIQGKNEZNFUFY-GFCCVEGCSA-N 0 0 395.346 3.241 20 5 GGBDRN Cc1c(C(=O)Oc2cccc3ncccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000192627360 1432868212 /nfs/dbraw/zinc/86/82/12/1432868212.db2.gz RIXXCCVMQKEKBG-UHFFFAOYSA-N 0 0 375.344 3.251 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 ZINC000192629892 1432868396 /nfs/dbraw/zinc/86/83/96/1432868396.db2.gz DEXCDXBEDCNOSM-UHFFFAOYSA-N 0 0 387.461 3.387 20 5 GGBDRN Cc1cccnc1C(F)(F)C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000192635132 1432869161 /nfs/dbraw/zinc/86/91/61/1432869161.db2.gz KKIAQANQPDWQMV-UHFFFAOYSA-N 0 0 391.374 3.460 20 5 GGBDRN O=C(CCn1cnc2cc([N+](=O)[O-])ccc2c1=O)Nc1ccc(Cl)cc1F ZINC000192637065 1432869773 /nfs/dbraw/zinc/86/97/73/1432869773.db2.gz MHVOZKFWIYQZBW-UHFFFAOYSA-N 0 0 390.758 3.126 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1 ZINC000192642802 1432870374 /nfs/dbraw/zinc/87/03/74/1432870374.db2.gz RIZDXGQNZNYZIV-UHFFFAOYSA-N 0 0 377.404 3.284 20 5 GGBDRN O=C(CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)Nc1ccc(F)c(F)c1F ZINC000192655299 1432871908 /nfs/dbraw/zinc/87/19/08/1432871908.db2.gz PGJZDDVKRHOPKM-UHFFFAOYSA-N 0 0 387.701 3.034 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000192660104 1432872338 /nfs/dbraw/zinc/87/23/38/1432872338.db2.gz YRVWJPBIAFTNGS-DIFFPNOSSA-N 0 0 375.812 3.314 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccccc2N2CCCCC2)ccc1[N+](=O)[O-] ZINC000192664298 1432872770 /nfs/dbraw/zinc/87/27/70/1432872770.db2.gz WZPSPZLHSIXOCO-UHFFFAOYSA-N 0 0 396.447 3.262 20 5 GGBDRN CS(=O)(=O)Nc1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])ccc1F ZINC000192666058 1432873048 /nfs/dbraw/zinc/87/30/48/1432873048.db2.gz UWXOYWIVYJSEPA-UHFFFAOYSA-N 0 0 387.776 3.011 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc([N+](=O)[O-])c1 ZINC000192670343 1432873593 /nfs/dbraw/zinc/87/35/93/1432873593.db2.gz TWBSJKSBCQLEIZ-UHFFFAOYSA-N 0 0 398.350 3.018 20 5 GGBDRN CCc1ccccc1N1C[C@@H](C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)CC1=O ZINC000192677070 1432874512 /nfs/dbraw/zinc/87/45/12/1432874512.db2.gz FLXVXZOTTBRISI-LBPRGKRZSA-N 0 0 389.358 3.427 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1cccc(CN2CCCC2=O)c1 ZINC000192685646 1432875181 /nfs/dbraw/zinc/87/51/81/1432875181.db2.gz SCJJMNOCZCPKMM-DHZHZOJOSA-N 0 0 379.416 3.047 20 5 GGBDRN Cc1c(C(=O)N(C)CCCc2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000192687392 1432875417 /nfs/dbraw/zinc/87/54/17/1432875417.db2.gz UBVIGEPLULFMRB-UHFFFAOYSA-N 0 0 379.420 3.189 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(Cc2nc3ccccc3s2)CC1 ZINC000192710702 1432878283 /nfs/dbraw/zinc/87/82/83/1432878283.db2.gz WZLPPCMNCFHMMP-UHFFFAOYSA-N 0 0 386.481 3.052 20 5 GGBDRN Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1NS(C)(=O)=O ZINC000192718596 1432879488 /nfs/dbraw/zinc/87/94/88/1432879488.db2.gz AVQQGVWHLZBMKT-UHFFFAOYSA-N 0 0 377.422 3.144 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1nc2c(s1)CCCCC2)c1cccc([N+](=O)[O-])c1 ZINC000192721014 1432879760 /nfs/dbraw/zinc/87/97/60/1432879760.db2.gz WQEDRHYXWAEKIZ-LLVKDONJSA-N 0 0 388.449 3.136 20 5 GGBDRN COc1cc(NCCCC(=O)N2Cc3ccccc3C2)c([N+](=O)[O-])cc1OC ZINC000192722074 1432879798 /nfs/dbraw/zinc/87/97/98/1432879798.db2.gz OFZKTFSYVPEAEV-UHFFFAOYSA-N 0 0 385.420 3.347 20 5 GGBDRN COc1cc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000192720942 1432879818 /nfs/dbraw/zinc/87/98/18/1432879818.db2.gz JCYLGPJGYISYDG-SNVBAGLBSA-N 0 0 377.784 3.073 20 5 GGBDRN CCOc1cc2c(cc1OCC)CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC2 ZINC000192724566 1432880141 /nfs/dbraw/zinc/88/01/41/1432880141.db2.gz ZHVOBQBJEMOJTC-UHFFFAOYSA-N 0 0 399.447 3.049 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(=O)n(Cc2ccccc2)n1 ZINC000192729079 1432880961 /nfs/dbraw/zinc/88/09/61/1432880961.db2.gz ZUAGZCBOEFDVDF-UHFFFAOYSA-N 0 0 378.388 3.069 20 5 GGBDRN COc1cc(CCNC(=O)N[C@H](C)Cc2cccs2)c([N+](=O)[O-])cc1OC ZINC000192741255 1432883028 /nfs/dbraw/zinc/88/30/28/1432883028.db2.gz NDOSQSGGPZPAJF-GFCCVEGCSA-N 0 0 393.465 3.146 20 5 GGBDRN COCCN(Cc1ccc(F)cc1Cl)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000192751123 1432884719 /nfs/dbraw/zinc/88/47/19/1432884719.db2.gz LPDLOCIFEZSWSW-UHFFFAOYSA-N 0 0 381.791 3.139 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)C1CCCCC1 ZINC000192755117 1432885271 /nfs/dbraw/zinc/88/52/71/1432885271.db2.gz JYKLFDRYELIWQD-QGZVFWFLSA-N 0 0 393.509 3.237 20 5 GGBDRN CCNC(=O)C(C)(C)CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192764916 1432887052 /nfs/dbraw/zinc/88/70/52/1432887052.db2.gz FAZMHZVJZBKLPV-UHFFFAOYSA-N 0 0 399.447 3.066 20 5 GGBDRN O=C1N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000192768714 1432887570 /nfs/dbraw/zinc/88/75/70/1432887570.db2.gz DXSFOHKBWSBXCD-KRWDZBQOSA-N 0 0 398.806 3.393 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)c1[N+](=O)[O-] ZINC000192852061 1432899001 /nfs/dbraw/zinc/89/90/01/1432899001.db2.gz ORQUCADCYKUJMQ-UHFFFAOYSA-N 0 0 378.348 3.336 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC(OCc3ccccc3)CC2)cc1 ZINC000192855214 1432899382 /nfs/dbraw/zinc/89/93/82/1432899382.db2.gz VKEOUJOFTPDFCY-UHFFFAOYSA-N 0 0 390.461 3.106 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(-c3cc[nH]n3)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000192886393 1432903295 /nfs/dbraw/zinc/90/32/95/1432903295.db2.gz XNBVSDSDSOPJCN-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN CC[C@H]1CN(C(=O)c2cccc(OC)c2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000192897613 1432904357 /nfs/dbraw/zinc/90/43/57/1432904357.db2.gz IHMJXJOBUXDCOD-KRWDZBQOSA-N 0 0 383.448 3.340 20 5 GGBDRN O=C(NCc1ccco1)[C@H]1CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000192906344 1432905565 /nfs/dbraw/zinc/90/55/65/1432905565.db2.gz NQTSNCDEQCVBBU-OAHLLOKOSA-N 0 0 399.428 3.324 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCOC2)c1[N+](=O)[O-] ZINC000192909599 1432905871 /nfs/dbraw/zinc/90/58/71/1432905871.db2.gz SGKCXJYBKKMRAR-SNVBAGLBSA-N 0 0 394.815 3.201 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCOC2)c1[N+](=O)[O-] ZINC000192909614 1432905892 /nfs/dbraw/zinc/90/58/92/1432905892.db2.gz SGKCXJYBKKMRAR-JTQLQIEISA-N 0 0 394.815 3.201 20 5 GGBDRN CCc1n[nH]c(C(=O)N2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)c1[N+](=O)[O-] ZINC000192911462 1432906136 /nfs/dbraw/zinc/90/61/36/1432906136.db2.gz XYPSSUQWYGDCKC-QMTHXVAHSA-N 0 0 378.816 3.136 20 5 GGBDRN CCc1n[nH]c(C(=O)N2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)c1[N+](=O)[O-] ZINC000192911474 1432906161 /nfs/dbraw/zinc/90/61/61/1432906161.db2.gz XYPSSUQWYGDCKC-YGRLFVJLSA-N 0 0 378.816 3.136 20 5 GGBDRN CCc1n[nH]c(C(=O)N2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000192911451 1432906184 /nfs/dbraw/zinc/90/61/84/1432906184.db2.gz XYPSSUQWYGDCKC-HZMBPMFUSA-N 0 0 378.816 3.136 20 5 GGBDRN COC[C@@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000192927563 1432908941 /nfs/dbraw/zinc/90/89/41/1432908941.db2.gz QIKXUUZWWKBLKM-QGZVFWFLSA-N 0 0 398.868 3.098 20 5 GGBDRN COc1cc(CN[C@H](C)c2nnc3ccccn32)c([N+](=O)[O-])cc1OC(F)F ZINC000192937305 1432910270 /nfs/dbraw/zinc/91/02/70/1432910270.db2.gz UQVATXZWODPPIX-SNVBAGLBSA-N 0 0 393.350 3.098 20 5 GGBDRN COc1cccc2c1CCN(S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])CC2 ZINC000192945335 1432911330 /nfs/dbraw/zinc/91/13/30/1432911330.db2.gz YAFIWPYHDIIHCE-UHFFFAOYSA-N 0 0 390.461 3.010 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CSc3n[nH]c(-c4ccccc4O)n3)o2)cc1 ZINC000192945271 1432911394 /nfs/dbraw/zinc/91/13/94/1432911394.db2.gz VFNGEJYZZSUCNF-UHFFFAOYSA-N 0 0 396.388 3.428 20 5 GGBDRN CCOC(=O)[C@@H](C)[C@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000192973532 1432915291 /nfs/dbraw/zinc/91/52/91/1432915291.db2.gz ODAFSQGHGLEESY-IUCAKERBSA-N 0 0 377.319 3.323 20 5 GGBDRN C[C@@H](CCc1ccccc1)NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192976740 1432916054 /nfs/dbraw/zinc/91/60/54/1432916054.db2.gz WUTBGCJIAMPGIK-KRWDZBQOSA-N 0 0 382.464 3.448 20 5 GGBDRN CCCNc1ccc(CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000192982038 1432917005 /nfs/dbraw/zinc/91/70/05/1432917005.db2.gz VIIICJMKCFWZPM-UHFFFAOYSA-N 0 0 384.436 3.288 20 5 GGBDRN Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192988968 1432918181 /nfs/dbraw/zinc/91/81/81/1432918181.db2.gz CDXAOEXFMXGBRW-ZWKOTPCHSA-N 0 0 396.491 3.291 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(Sc3n[nH]c(Cc4ccccc4)n3)cc2N1 ZINC000193044063 1432926866 /nfs/dbraw/zinc/92/68/66/1432926866.db2.gz UDNAYTJOAJUBGZ-UHFFFAOYSA-N 0 0 381.417 3.340 20 5 GGBDRN CC(=O)N1CCC[C@H](C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)C1 ZINC000193046176 1432927536 /nfs/dbraw/zinc/92/75/36/1432927536.db2.gz DYQGLYCOZJXYBM-AWEZNQCLSA-N 0 0 388.449 3.224 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC(C(=O)N2CCCC2)CC1 ZINC000193049147 1432928158 /nfs/dbraw/zinc/92/81/58/1432928158.db2.gz RXDIZCFTJHXDNK-UHFFFAOYSA-N 0 0 387.461 3.284 20 5 GGBDRN O=C(Cc1ccc(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1)N1CCOCC1 ZINC000193077989 1432933028 /nfs/dbraw/zinc/93/30/28/1432933028.db2.gz FKXTVSQVCLIOKJ-OAQYLSRUSA-N 0 0 395.459 3.486 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)C(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000193081075 1432933279 /nfs/dbraw/zinc/93/32/79/1432933279.db2.gz RUANGNHCPOJDRK-UHFFFAOYSA-N 0 0 387.461 3.234 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000193119553 1432939003 /nfs/dbraw/zinc/93/90/03/1432939003.db2.gz TVDVPYHIQNIIAC-NSHDSACASA-N 0 0 388.449 3.054 20 5 GGBDRN COc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1Cl ZINC000193119689 1432939435 /nfs/dbraw/zinc/93/94/35/1432939435.db2.gz IPXWLSXZRYYRLI-LLVKDONJSA-N 0 0 391.811 3.381 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccnc(N2CCCCC2)c1 ZINC000193129048 1432940925 /nfs/dbraw/zinc/94/09/25/1432940925.db2.gz YKQQLUHMANZTPD-UHFFFAOYSA-N 0 0 383.452 3.322 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CS(=O)(=O)CCCc1ccccc1 ZINC000193130806 1432941511 /nfs/dbraw/zinc/94/15/11/1432941511.db2.gz MVCAWQWYGGEPIK-UHFFFAOYSA-N 0 0 390.461 3.198 20 5 GGBDRN O=C(COc1cccc2cccnc21)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000193146977 1432944789 /nfs/dbraw/zinc/94/47/89/1432944789.db2.gz FAUZBWLRFGZQMH-UHFFFAOYSA-N 0 0 389.371 3.346 20 5 GGBDRN COc1cc(C)c(CN(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1OC ZINC000193150342 1432945625 /nfs/dbraw/zinc/94/56/25/1432945625.db2.gz PERXVRPIZWLWEJ-UHFFFAOYSA-N 0 0 384.392 3.069 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCc1cc(Cl)c2c(c1)OCCO2 ZINC000193156641 1432946606 /nfs/dbraw/zinc/94/66/06/1432946606.db2.gz AHGAFEHHAYWKAP-UHFFFAOYSA-N 0 0 391.811 3.138 20 5 GGBDRN O=C(Cc1noc(-c2cc([N+](=O)[O-])ccc2N2CCCC2)n1)Nc1ccccc1 ZINC000193176297 1432951027 /nfs/dbraw/zinc/95/10/27/1432951027.db2.gz FEUUVOQAZXKENP-UHFFFAOYSA-N 0 0 393.403 3.426 20 5 GGBDRN C[C@@H](C(=O)Nc1nc(-c2cccs2)nn1C)c1ccc([N+](=O)[O-])cc1F ZINC000193212363 1432958795 /nfs/dbraw/zinc/95/87/95/1432958795.db2.gz WAKDPRUCMPCEPN-SECBINFHSA-N 0 0 375.385 3.333 20 5 GGBDRN CCCCNC(=O)c1ccc(CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000193227327 1432962429 /nfs/dbraw/zinc/96/24/29/1432962429.db2.gz CPLDQRLXUGZZCO-UHFFFAOYSA-N 0 0 385.420 3.063 20 5 GGBDRN CSCc1nc2ccccc2n1CC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193232588 1432963671 /nfs/dbraw/zinc/96/36/71/1432963671.db2.gz MTZDMQMAFWODEC-UHFFFAOYSA-N 0 0 384.461 3.466 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193232377 1432963813 /nfs/dbraw/zinc/96/38/13/1432963813.db2.gz PIVRAEFAFNDLKZ-UHFFFAOYSA-N 0 0 392.415 3.239 20 5 GGBDRN CCCn1c2ccccc2n(CCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1=O ZINC000193232543 1432963822 /nfs/dbraw/zinc/96/38/22/1432963822.db2.gz AGDJWJNWZODSMT-UHFFFAOYSA-N 0 0 396.447 3.170 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N2CCc3ccccc32)cc1OC ZINC000193271391 1432972111 /nfs/dbraw/zinc/97/21/11/1432972111.db2.gz FXVMSFIOIQGCKR-CQSZACIVSA-N 0 0 399.447 3.183 20 5 GGBDRN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000193272330 1432972370 /nfs/dbraw/zinc/97/23/70/1432972370.db2.gz GTVVXBJEHHZCMO-NSHDSACASA-N 0 0 396.852 3.485 20 5 GGBDRN CCN(Cc1ccc2c(c1)OCCO2)C(=O)CNc1cccc([N+](=O)[O-])c1C ZINC000193273654 1432972723 /nfs/dbraw/zinc/97/27/23/1432972723.db2.gz GZMCHXFDLSMFHE-UHFFFAOYSA-N 0 0 385.420 3.135 20 5 GGBDRN CSc1ccc(C(=O)N2CCC(C(=O)N3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000193282754 1432973823 /nfs/dbraw/zinc/97/38/23/1432973823.db2.gz UMNULGPBHUDIFB-UHFFFAOYSA-N 0 0 391.493 3.181 20 5 GGBDRN CCCOc1ccc(CNC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000193317932 1432978315 /nfs/dbraw/zinc/97/83/15/1432978315.db2.gz CBPKGRMTXNRPSL-UHFFFAOYSA-N 0 0 398.463 3.415 20 5 GGBDRN COC(=O)c1cc(CN(C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)oc1C ZINC000193338927 1432982106 /nfs/dbraw/zinc/98/21/06/1432982106.db2.gz CNNNUFLTFLXMHM-LBPRGKRZSA-N 0 0 389.408 3.050 20 5 GGBDRN CCc1nc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)sc1C ZINC000193370025 1432986495 /nfs/dbraw/zinc/98/64/95/1432986495.db2.gz ZLIWDQWXTSYNRG-UHFFFAOYSA-N 0 0 390.465 3.298 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000193391055 1432989507 /nfs/dbraw/zinc/98/95/07/1432989507.db2.gz ZDHSCUXZSVLCNH-GOSISDBHSA-N 0 0 375.384 3.483 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@H]2CCCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000193391153 1432989800 /nfs/dbraw/zinc/98/98/00/1432989800.db2.gz DVTONDRCCDWWNK-INIZCTEOSA-N 0 0 375.450 3.150 20 5 GGBDRN Cc1cc(C)c(N2C[C@@H](C(=O)NCc3ccc([N+](=O)[O-])cc3)CC2=O)c(C)c1 ZINC000193391648 1432989809 /nfs/dbraw/zinc/98/98/09/1432989809.db2.gz RXVCCHXSILOAII-KRWDZBQOSA-N 0 0 381.432 3.189 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCCc2cc(N)ccc21 ZINC000193391455 1432989823 /nfs/dbraw/zinc/98/98/23/1432989823.db2.gz QXMHKBHNYYHYCJ-KRWDZBQOSA-N 0 0 375.450 3.095 20 5 GGBDRN Nc1ccc2c(c1)CCC[C@H]2NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000193392757 1432990059 /nfs/dbraw/zinc/99/00/59/1432990059.db2.gz JJGGTHVCENDHDD-CQSZACIVSA-N 0 0 381.841 3.186 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC(OCCC(C)C)CC1 ZINC000193399384 1432991276 /nfs/dbraw/zinc/99/12/76/1432991276.db2.gz XIYPOURSZLLWSE-UHFFFAOYSA-N 0 0 379.457 3.340 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC(C(=O)c2ccccc2)CC1 ZINC000193400710 1432991463 /nfs/dbraw/zinc/99/14/63/1432991463.db2.gz OGNNXOROEQWECD-UHFFFAOYSA-N 0 0 397.431 3.408 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)CCOc1cccc(Cl)c1 ZINC000193402641 1432991742 /nfs/dbraw/zinc/99/17/42/1432991742.db2.gz GHCSOFGOXLRAQQ-UHFFFAOYSA-N 0 0 393.827 3.477 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccc(CN2CCCC2=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193403372 1432992133 /nfs/dbraw/zinc/99/21/33/1432992133.db2.gz ZIHKFIUQYGIZJL-OAHLLOKOSA-N 0 0 396.447 3.278 20 5 GGBDRN Cc1ccc([C@H](CNC(=O)c2c(C)cccc2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000193407492 1432992577 /nfs/dbraw/zinc/99/25/77/1432992577.db2.gz JCHVABKLQDHPCK-IBGZPJMESA-N 0 0 383.448 3.015 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1C(=O)N(C)C(C)C ZINC000193410524 1432993144 /nfs/dbraw/zinc/99/31/44/1432993144.db2.gz KELBATPXRQIJKZ-UHFFFAOYSA-N 0 0 398.463 3.459 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(CN3CCCN(c4ccccc4)CC3)n2)c1 ZINC000193435260 1432998588 /nfs/dbraw/zinc/99/85/88/1432998588.db2.gz WJEWDPQJXXUKPB-UHFFFAOYSA-N 0 0 378.436 3.023 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000193434930 1432998633 /nfs/dbraw/zinc/99/86/33/1432998633.db2.gz OKMPPJCQAKPXAL-UHFFFAOYSA-N 0 0 390.484 3.163 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000193451247 1433001316 /nfs/dbraw/zinc/00/13/16/1433001316.db2.gz YMAHWZLJQSPMMQ-LIRRHRJNSA-N 0 0 377.441 3.277 20 5 GGBDRN O=C(COc1c(F)c(F)c(F)c(F)c1F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000193460604 1433003311 /nfs/dbraw/zinc/00/33/11/1433003311.db2.gz ZSKZJDFOYHUCDK-UHFFFAOYSA-N 0 0 388.248 3.258 20 5 GGBDRN O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000193461704 1433003521 /nfs/dbraw/zinc/00/35/21/1433003521.db2.gz DCQOWHXEHUXLAN-UHFFFAOYSA-N 0 0 392.412 3.222 20 5 GGBDRN COc1ccc([C@@H](C)N(C)C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000193480527 1433006147 /nfs/dbraw/zinc/00/61/47/1433006147.db2.gz VFKFGTRKFFAXED-LLVKDONJSA-N 0 0 391.811 3.415 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)cc1[N+](=O)[O-] ZINC000193499222 1433009639 /nfs/dbraw/zinc/00/96/39/1433009639.db2.gz TVHHLBRLXCSARG-JTQLQIEISA-N 0 0 396.325 3.133 20 5 GGBDRN CC(C)c1ccc([C@@H]2Nc3ccc(N4CCOCC4)cc3C(=O)N2)cc1[N+](=O)[O-] ZINC000193506082 1433010951 /nfs/dbraw/zinc/01/09/51/1433010951.db2.gz QZAPEXFDBGWRFR-HXUWFJFHSA-N 0 0 396.447 3.409 20 5 GGBDRN COc1ccc(CN(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000193511459 1433011765 /nfs/dbraw/zinc/01/17/65/1433011765.db2.gz YARGXJCILNMUEB-CYBMUJFWSA-N 0 0 378.450 3.200 20 5 GGBDRN CCOc1ccccc1N1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000193522685 1433013771 /nfs/dbraw/zinc/01/37/71/1433013771.db2.gz GDBJANNIRDGEET-UHFFFAOYSA-N 0 0 396.447 3.205 20 5 GGBDRN O=C(NCC1(c2cccc(C(F)(F)F)c2)CC1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193533299 1433015643 /nfs/dbraw/zinc/01/56/43/1433015643.db2.gz GFBJMQKHQPFDQW-UHFFFAOYSA-N 0 0 381.310 3.176 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000193532429 1433015725 /nfs/dbraw/zinc/01/57/25/1433015725.db2.gz FNTBXUQJOHBWNF-AWEZNQCLSA-N 0 0 398.202 3.216 20 5 GGBDRN Cc1cccc(C2(CNC(=O)Cn3cc([N+](=O)[O-])ccc3=O)CCCCC2)c1 ZINC000193535576 1433016056 /nfs/dbraw/zinc/01/60/56/1433016056.db2.gz ZAUMVVJRNVJCGE-UHFFFAOYSA-N 0 0 383.448 3.083 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(N3CCN(C/C=C/c4ccccc4)CC3)cc2N1 ZINC000193536589 1433016140 /nfs/dbraw/zinc/01/61/40/1433016140.db2.gz DUEMAJKKUSBQQJ-QPJJXVBHSA-N 0 0 392.459 3.315 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H](CCc1ccccc1)c1ccccc1 ZINC000193535661 1433016350 /nfs/dbraw/zinc/01/63/50/1433016350.db2.gz WBEVQFHKVIVBJR-HXUWFJFHSA-N 0 0 391.427 3.247 20 5 GGBDRN CCc1ccc(CN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000193549171 1433018330 /nfs/dbraw/zinc/01/83/30/1433018330.db2.gz KSYLBROESVIIEZ-UHFFFAOYSA-N 0 0 397.431 3.296 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000193551414 1433018619 /nfs/dbraw/zinc/01/86/19/1433018619.db2.gz YGNINEKCJHFWJQ-INIZCTEOSA-N 0 0 399.472 3.410 20 5 GGBDRN Cc1cc(COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)ns1 ZINC000193558151 1433019440 /nfs/dbraw/zinc/01/94/40/1433019440.db2.gz MHESJROAMIKNMH-INIZCTEOSA-N 0 0 389.433 3.016 20 5 GGBDRN O=C(c1cccc(Cl)c1)N1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000193559723 1433019693 /nfs/dbraw/zinc/01/96/93/1433019693.db2.gz VPEFBGBPEYJOMS-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN Cn1ncc2c1nc(C=Cc1ccc(-c3cccc([N+](=O)[O-])c3)s1)[nH]c2=O ZINC000193587148 1433024171 /nfs/dbraw/zinc/02/41/71/1433024171.db2.gz AMNMXOSQCBCTKO-SOFGYWHQSA-N 0 0 379.401 3.464 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C ZINC000193591231 1433025100 /nfs/dbraw/zinc/02/51/00/1433025100.db2.gz FBCUOMGEFZRCFX-UHFFFAOYSA-N 0 0 395.419 3.001 20 5 GGBDRN Cc1cccc(CN(Cc2ccccn2)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)c1 ZINC000193604933 1433027542 /nfs/dbraw/zinc/02/75/42/1433027542.db2.gz FCOYSOUWIQOREF-UHFFFAOYSA-N 0 0 378.388 3.241 20 5 GGBDRN CN(C(=O)CCc1cccs1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000193605374 1433027644 /nfs/dbraw/zinc/02/76/44/1433027644.db2.gz MBUCOMRCKROJJV-UHFFFAOYSA-N 0 0 388.854 3.090 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)c1cc(F)ccc1F ZINC000193605879 1433027682 /nfs/dbraw/zinc/02/76/82/1433027682.db2.gz GIJCJFZAEYDPGD-SNVBAGLBSA-N 0 0 393.346 3.040 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)c1cc(F)ccc1F ZINC000193610056 1433028438 /nfs/dbraw/zinc/02/84/38/1433028438.db2.gz ANRZFPZZOOAQKN-LLVKDONJSA-N 0 0 377.347 3.340 20 5 GGBDRN Cc1nc(CN2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cs1 ZINC000193619299 1433029942 /nfs/dbraw/zinc/02/99/42/1433029942.db2.gz JPHDYYQJPKWUGY-UHFFFAOYSA-N 0 0 375.454 3.018 20 5 GGBDRN Cc1cc(NC(=O)NCCNC(=O)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000193630927 1433031252 /nfs/dbraw/zinc/03/12/52/1433031252.db2.gz RHYSDAZWNRDLMC-UHFFFAOYSA-N 0 0 376.800 3.108 20 5 GGBDRN C[C@@H](NC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193632456 1433031516 /nfs/dbraw/zinc/03/15/16/1433031516.db2.gz QFUXTRUXOJQDTR-LLVKDONJSA-N 0 0 395.337 3.221 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000193646659 1433033729 /nfs/dbraw/zinc/03/37/29/1433033729.db2.gz YEDYCVMQMDDAMA-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCc2csc3ccccc23)cccc1[N+](=O)[O-] ZINC000193654783 1433034977 /nfs/dbraw/zinc/03/49/77/1433034977.db2.gz IVSCRGWIGJPXPG-UHFFFAOYSA-N 0 0 383.429 3.415 20 5 GGBDRN Cc1cc(NC(=O)NCc2ccccc2CN2CCCC2=O)ccc1[N+](=O)[O-] ZINC000193659549 1433035853 /nfs/dbraw/zinc/03/58/53/1433035853.db2.gz FWCORXFSZLXCRF-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000193664545 1433036645 /nfs/dbraw/zinc/03/66/45/1433036645.db2.gz LMCYYKXCOZNRNC-UHFFFAOYSA-N 0 0 391.811 3.244 20 5 GGBDRN COc1ccc(-c2csc(CNC(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)c2)cc1 ZINC000193666637 1433037072 /nfs/dbraw/zinc/03/70/72/1433037072.db2.gz YLAFGYIYHFMAMB-UHFFFAOYSA-N 0 0 385.401 3.363 20 5 GGBDRN COC[C@@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccc(Cl)cc1 ZINC000193669319 1433037318 /nfs/dbraw/zinc/03/73/18/1433037318.db2.gz FEIXPZZKMUTXMH-QGZVFWFLSA-N 0 0 389.839 3.115 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000193670547 1433037630 /nfs/dbraw/zinc/03/76/30/1433037630.db2.gz OEAICFAVCQXITI-UHFFFAOYSA-N 0 0 376.457 3.454 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2CC(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000193701799 1433043211 /nfs/dbraw/zinc/04/32/11/1433043211.db2.gz ZEWZFSHCDQIHFA-SFHVURJKSA-N 0 0 393.403 3.024 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1Br ZINC000193707015 1433044400 /nfs/dbraw/zinc/04/44/00/1433044400.db2.gz YHHTVKXUJLXYEQ-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN COc1ccccc1OS(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193710123 1433044666 /nfs/dbraw/zinc/04/46/66/1433044666.db2.gz PYLPBEUVOMNADF-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)COCc1ccccc1 ZINC000193711311 1433044919 /nfs/dbraw/zinc/04/49/19/1433044919.db2.gz CMHHOUABGROQSH-MRXNPFEDSA-N 0 0 394.431 3.363 20 5 GGBDRN Cc1c(C(=O)NC[C@H](C)COCc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000193713538 1433045510 /nfs/dbraw/zinc/04/55/10/1433045510.db2.gz YZZZAWLHXIPHQR-ZDUSSCGKSA-N 0 0 387.392 3.394 20 5 GGBDRN CS(=O)(=O)Nc1cccc2c1CCN(c1ccc3cc([N+](=O)[O-])ccc3n1)C2 ZINC000193716265 1433045763 /nfs/dbraw/zinc/04/57/63/1433045763.db2.gz QOTVHBTWAPUXQQ-UHFFFAOYSA-N 0 0 398.444 3.077 20 5 GGBDRN CS(=O)(=O)Nc1cccc2c1CCN(c1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000193716284 1433045824 /nfs/dbraw/zinc/04/58/24/1433045824.db2.gz ZOXDSUBQJYSVGU-UHFFFAOYSA-N 0 0 381.841 3.182 20 5 GGBDRN CN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000193729720 1433048700 /nfs/dbraw/zinc/04/87/00/1433048700.db2.gz RIWUCZFHKCRZLC-HUUCEWRRSA-N 0 0 397.218 3.419 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000193734179 1433049161 /nfs/dbraw/zinc/04/91/61/1433049161.db2.gz YCXBMNZLEJZSRT-UHFFFAOYSA-N 0 0 385.420 3.117 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000193751853 1433052215 /nfs/dbraw/zinc/05/22/15/1433052215.db2.gz FBONIEDKBCIQAK-GFCCVEGCSA-N 0 0 391.811 3.280 20 5 GGBDRN COc1cccc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000193786609 1433059303 /nfs/dbraw/zinc/05/93/03/1433059303.db2.gz LGLMMKYBVYPZTD-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN C[C@H](C1CC1)N(C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193793152 1433060720 /nfs/dbraw/zinc/06/07/20/1433060720.db2.gz ZENWSXXZSYXXDM-SECBINFHSA-N 0 0 389.271 3.309 20 5 GGBDRN Cc1c(C(=O)Nc2ccn(Cc3ccccc3)n2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000193797589 1433061749 /nfs/dbraw/zinc/06/17/49/1433061749.db2.gz NDXYRSREAYXFDM-UHFFFAOYSA-N 0 0 381.348 3.309 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000193806321 1433063672 /nfs/dbraw/zinc/06/36/72/1433063672.db2.gz TWLOBLSLMJLOHX-UHFFFAOYSA-N 0 0 396.378 3.047 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NS(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])c1 ZINC000193809710 1433064349 /nfs/dbraw/zinc/06/43/49/1433064349.db2.gz OZWUFHNLMIQEEH-ZDUSSCGKSA-N 0 0 391.449 3.210 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3c(C)cccc3[N+](=O)[O-])C2)nc1 ZINC000193809434 1433064437 /nfs/dbraw/zinc/06/44/37/1433064437.db2.gz AAKOVQHHSWYFCZ-OAHLLOKOSA-N 0 0 382.420 3.098 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193812999 1433065124 /nfs/dbraw/zinc/06/51/24/1433065124.db2.gz WUGXFKDZMSVBFA-UHFFFAOYSA-N 0 0 391.811 3.162 20 5 GGBDRN C[C@H]1CCCC[C@H]1OCCNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000193814495 1433065648 /nfs/dbraw/zinc/06/56/48/1433065648.db2.gz IFFFUBSLXUIAMF-QFBILLFUSA-N 0 0 390.484 3.022 20 5 GGBDRN C[C@H]1CCC[C@H](N(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000193833218 1433068873 /nfs/dbraw/zinc/06/88/73/1433068873.db2.gz CIFZIRQRQLOSHP-QWRGUYRKSA-N 0 0 385.367 3.172 20 5 GGBDRN C[C@@H]1CCC[C@@H](N(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000193833229 1433068906 /nfs/dbraw/zinc/06/89/06/1433068906.db2.gz CIFZIRQRQLOSHP-GHMZBOCLSA-N 0 0 385.367 3.172 20 5 GGBDRN COc1cccc(C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1[N+](=O)[O-] ZINC000193845455 1433071869 /nfs/dbraw/zinc/07/18/69/1433071869.db2.gz JPRSCUASVOUZKI-UHFFFAOYSA-N 0 0 383.404 3.482 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCCC[C@@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000193882637 1433077795 /nfs/dbraw/zinc/07/77/95/1433077795.db2.gz UIIBKEWMRGGOPK-GOSISDBHSA-N 0 0 382.420 3.381 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCCC[C@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000193882652 1433077863 /nfs/dbraw/zinc/07/78/63/1433077863.db2.gz UIIBKEWMRGGOPK-SFHVURJKSA-N 0 0 382.420 3.381 20 5 GGBDRN COc1cccc(C(=O)N(Cc2cccs2)C[C@@H]2CCCO2)c1[N+](=O)[O-] ZINC000193884497 1433078035 /nfs/dbraw/zinc/07/80/35/1433078035.db2.gz RBFMBXJTHHWTDJ-ZDUSSCGKSA-N 0 0 376.434 3.486 20 5 GGBDRN O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193895191 1433079687 /nfs/dbraw/zinc/07/96/87/1433079687.db2.gz NMTNPJLTMUDKQR-LLVKDONJSA-N 0 0 377.225 3.007 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCCc3cccc(OC(F)F)c32)c1 ZINC000193911510 1433083328 /nfs/dbraw/zinc/08/33/28/1433083328.db2.gz DSSXRAPMCHAHCG-UHFFFAOYSA-N 0 0 384.360 3.338 20 5 GGBDRN Cc1cccc2c1N(S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1)CC2 ZINC000193918660 1433084413 /nfs/dbraw/zinc/08/44/13/1433084413.db2.gz WILLHMSTLIHUGL-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN Cc1ccc(CN(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000193923612 1433085504 /nfs/dbraw/zinc/08/55/04/1433085504.db2.gz CGXMEMWPFPDDSD-UHFFFAOYSA-N 0 0 393.346 3.102 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1ccc(C(C)C)cc1 ZINC000193926102 1433085668 /nfs/dbraw/zinc/08/56/68/1433085668.db2.gz SHJQVMRCACAZOT-UHFFFAOYSA-N 0 0 385.420 3.324 20 5 GGBDRN COc1cccc(C(=O)NCc2ccc(NC(=O)c3ccco3)cc2)c1[N+](=O)[O-] ZINC000193931838 1433087546 /nfs/dbraw/zinc/08/75/46/1433087546.db2.gz HLMXTXWWVIPVAF-UHFFFAOYSA-N 0 0 395.371 3.379 20 5 GGBDRN CS(=O)(=O)c1ccc(-c2nc(Cc3ccccc3Cl)no2)cc1[N+](=O)[O-] ZINC000193935762 1433088065 /nfs/dbraw/zinc/08/80/65/1433088065.db2.gz BNBVKLIIRACYKN-UHFFFAOYSA-N 0 0 393.808 3.293 20 5 GGBDRN Cc1ccc(-c2noc(-c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)n2)cc1F ZINC000193935199 1433088079 /nfs/dbraw/zinc/08/80/79/1433088079.db2.gz YZRADCSCCPMZRP-UHFFFAOYSA-N 0 0 377.353 3.163 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3ccc(OCC(F)(F)F)nc3)cc2N1 ZINC000193935694 1433088226 /nfs/dbraw/zinc/08/82/26/1433088226.db2.gz RSPGRQLFZULOSK-UHFFFAOYSA-N 0 0 396.325 3.428 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000193940558 1433089277 /nfs/dbraw/zinc/08/92/77/1433089277.db2.gz PSLZXIWKUVVNPY-SNVBAGLBSA-N 0 0 377.784 3.073 20 5 GGBDRN Cc1ncc(-c2ccc(NC(=O)C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2)o1 ZINC000193943167 1433089546 /nfs/dbraw/zinc/08/95/46/1433089546.db2.gz WUKSBLHJMKFCPH-LBPRGKRZSA-N 0 0 394.387 3.374 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc(OC(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000193943443 1433089566 /nfs/dbraw/zinc/08/95/66/1433089566.db2.gz IZJBNSREBKWSJF-JTQLQIEISA-N 0 0 379.319 3.012 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccccc1N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000193943489 1433089611 /nfs/dbraw/zinc/08/96/11/1433089611.db2.gz ZGANSRVQVKWSPM-CQSZACIVSA-N 0 0 382.420 3.011 20 5 GGBDRN CCOc1cc(C(=O)NCc2ccc3ncccc3c2)c([N+](=O)[O-])cc1OC ZINC000193942548 1433089682 /nfs/dbraw/zinc/08/96/82/1433089682.db2.gz PYVQNHNZCHNMJB-UHFFFAOYSA-N 0 0 381.388 3.480 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1CNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000193946016 1433090109 /nfs/dbraw/zinc/09/01/09/1433090109.db2.gz ACBAWSKNGQAQJE-ZIAGYGMSSA-N 0 0 375.425 3.225 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000193949236 1433090755 /nfs/dbraw/zinc/09/07/55/1433090755.db2.gz HWUUZGHPPIPAAY-SNVBAGLBSA-N 0 0 386.376 3.263 20 5 GGBDRN CCCc1c(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cnn1-c1cccc(F)c1 ZINC000193958007 1433092360 /nfs/dbraw/zinc/09/23/60/1433092360.db2.gz HYMOPZCXPBVTCX-UHFFFAOYSA-N 0 0 385.355 3.225 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000193960158 1433092725 /nfs/dbraw/zinc/09/27/25/1433092725.db2.gz YBFUPHVEGREQDD-UHFFFAOYSA-N 0 0 397.309 3.148 20 5 GGBDRN COC(=O)[C@H]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000193960604 1433092866 /nfs/dbraw/zinc/09/28/66/1433092866.db2.gz SMJHWQIULAUCBC-DTWKUNHWSA-N 0 0 375.303 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1C(F)(F)F ZINC000193982664 1433095859 /nfs/dbraw/zinc/09/58/59/1433095859.db2.gz AZMVJUZSFZEVMO-UHFFFAOYSA-N 0 0 388.323 3.349 20 5 GGBDRN CCN(Cc1ccc(Cl)s1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000193981894 1433095885 /nfs/dbraw/zinc/09/58/85/1433095885.db2.gz IXRRTJWITNQWPV-UHFFFAOYSA-N 0 0 397.840 3.306 20 5 GGBDRN O=C(OCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCCN1C(=O)c1cccs1 ZINC000194029146 1433103857 /nfs/dbraw/zinc/10/38/57/1433103857.db2.gz SWFAAIVCXIJAAM-MRXNPFEDSA-N 0 0 388.445 3.437 20 5 GGBDRN O=C(Nc1nnc(Cc2ccc(Cl)cc2)s1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000194036931 1433105147 /nfs/dbraw/zinc/10/51/47/1433105147.db2.gz VKQLMLWTYIZGSQ-UHFFFAOYSA-N 0 0 391.796 3.043 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)c2ncccc12 ZINC000194036322 1433105154 /nfs/dbraw/zinc/10/51/54/1433105154.db2.gz ZIQIMBZZVINEQT-LSDHHAIUSA-N 0 0 387.392 3.117 20 5 GGBDRN COc1cccc(C)c1NC(=O)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000194037819 1433105501 /nfs/dbraw/zinc/10/55/01/1433105501.db2.gz KYPCXOVKBKLHNV-UHFFFAOYSA-N 0 0 383.404 3.042 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000194054337 1433108550 /nfs/dbraw/zinc/10/85/50/1433108550.db2.gz VKVLTPRRUZBSHH-UHFFFAOYSA-N 0 0 391.811 3.162 20 5 GGBDRN COc1cccc(C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000194056612 1433109314 /nfs/dbraw/zinc/10/93/14/1433109314.db2.gz CCPVJPIHIGJORV-GJZGRUSLSA-N 0 0 399.447 3.465 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(OCc3nccn3C)cc2)c1[N+](=O)[O-] ZINC000194058735 1433109592 /nfs/dbraw/zinc/10/95/92/1433109592.db2.gz YTPFUSDGMCURNA-UHFFFAOYSA-N 0 0 382.376 3.168 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC=C(c2ccc(F)cc2)CC1 ZINC000194069462 1433111061 /nfs/dbraw/zinc/11/10/61/1433111061.db2.gz SAJGWJMAFGYINW-UHFFFAOYSA-N 0 0 383.379 3.297 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC=C(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000194070008 1433111451 /nfs/dbraw/zinc/11/14/51/1433111451.db2.gz LBVRYQKSMPCCPE-UHFFFAOYSA-N 0 0 383.379 3.297 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000194070592 1433111771 /nfs/dbraw/zinc/11/17/71/1433111771.db2.gz ZIEMSADAMHMMNB-YLJYHZDGSA-N 0 0 398.463 3.474 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc3nc(N4CCCC4)sc3c2)c1[N+](=O)[O-] ZINC000194086295 1433114475 /nfs/dbraw/zinc/11/44/75/1433114475.db2.gz MTSKIDCPIVKREW-UHFFFAOYSA-N 0 0 386.437 3.099 20 5 GGBDRN C[C@H](c1cccs1)N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194088822 1433114791 /nfs/dbraw/zinc/11/47/91/1433114791.db2.gz LLALIBRAVFDWTE-SECBINFHSA-N 0 0 399.375 3.416 20 5 GGBDRN C[C@@H](c1cccs1)N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194088808 1433114861 /nfs/dbraw/zinc/11/48/61/1433114861.db2.gz LLALIBRAVFDWTE-VIFPVBQESA-N 0 0 399.375 3.416 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@@H]1C(=O)Nc2ccccc21 ZINC000194098550 1433117212 /nfs/dbraw/zinc/11/72/12/1433117212.db2.gz PJXIWOXCKIYFOL-WBMJQRKESA-N 0 0 385.445 3.318 20 5 GGBDRN CSc1ccc(C(=O)OCCc2c[nH]nc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000194104700 1433118386 /nfs/dbraw/zinc/11/83/86/1433118386.db2.gz ZTNBLBGOMVAXEC-UHFFFAOYSA-N 0 0 375.328 3.458 20 5 GGBDRN CCCN(C(=O)[C@@H]1CN(Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000194125864 1433122123 /nfs/dbraw/zinc/12/21/23/1433122123.db2.gz OEOKSRNDPSGEFT-FQEVSTJZSA-N 0 0 383.448 3.239 20 5 GGBDRN CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1=O ZINC000194184321 1433133880 /nfs/dbraw/zinc/13/38/80/1433133880.db2.gz YOSFIIBOJYOSJZ-CYBMUJFWSA-N 0 0 385.445 3.097 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000194183285 1433133954 /nfs/dbraw/zinc/13/39/54/1433133954.db2.gz OCJHMADSGPYPLN-DZGCQCFKSA-N 0 0 393.509 3.474 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000194183306 1433133985 /nfs/dbraw/zinc/13/39/85/1433133985.db2.gz OCJHMADSGPYPLN-UKRRQHHQSA-N 0 0 393.509 3.474 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1[N+](=O)[O-] ZINC000194192466 1433135531 /nfs/dbraw/zinc/13/55/31/1433135531.db2.gz HSPRSKXYBUVTNA-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN CCCN(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@H](C)C(=O)Nc1ccccc1 ZINC000194198500 1433136901 /nfs/dbraw/zinc/13/69/01/1433136901.db2.gz JNVQFQDPISFYGF-CQSZACIVSA-N 0 0 385.420 3.483 20 5 GGBDRN O=C(Nc1ccccc1S(=O)(=O)N1CCCCC1)c1ccc([N+](=O)[O-])s1 ZINC000194211819 1433139747 /nfs/dbraw/zinc/13/97/47/1433139747.db2.gz NDKAHWIIFXXCIJ-UHFFFAOYSA-N 0 0 395.462 3.083 20 5 GGBDRN C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000194218019 1433140941 /nfs/dbraw/zinc/14/09/41/1433140941.db2.gz WTCMCUBNOWREPT-SJKOYZFVSA-N 0 0 385.445 3.000 20 5 GGBDRN COc1cccc(C(=O)N[C@@H](c2nc(-c3cccnc3)no2)C(C)C)c1[N+](=O)[O-] ZINC000194246852 1433148237 /nfs/dbraw/zinc/14/82/37/1433148237.db2.gz ODMYCRRANWVYGS-OAHLLOKOSA-N 0 0 397.391 3.176 20 5 GGBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1nncn1C ZINC000194250904 1433149086 /nfs/dbraw/zinc/14/90/86/1433149086.db2.gz LUYVIQQFXWOICC-ZDUSSCGKSA-N 0 0 397.460 3.408 20 5 GGBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1nncn1C ZINC000194250917 1433149098 /nfs/dbraw/zinc/14/90/98/1433149098.db2.gz LUYVIQQFXWOICC-CYBMUJFWSA-N 0 0 397.460 3.408 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c1 ZINC000194256538 1433150355 /nfs/dbraw/zinc/15/03/55/1433150355.db2.gz REBFNAVJCMZWEC-UHFFFAOYSA-N 0 0 397.309 3.148 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(c2cncc3ccccc32)CC1 ZINC000194286321 1433155541 /nfs/dbraw/zinc/15/55/41/1433155541.db2.gz LBLJZIROMYBUCY-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN COc1cccc(C(=O)N2CCN(c3cncc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000194289930 1433156108 /nfs/dbraw/zinc/15/61/08/1433156108.db2.gz KZJWXXOEFHEXPI-UHFFFAOYSA-N 0 0 392.415 3.114 20 5 GGBDRN NC(=O)C1(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CCCCC1 ZINC000194305172 1433158587 /nfs/dbraw/zinc/15/85/87/1433158587.db2.gz NSBPFGRPMDYKSE-UHFFFAOYSA-N 0 0 382.420 3.256 20 5 GGBDRN COc1cccc(C(=O)Nc2nnc(Cc3ccc(F)cc3)s2)c1[N+](=O)[O-] ZINC000194309788 1433159398 /nfs/dbraw/zinc/15/93/98/1433159398.db2.gz USZIGNQMCDLXQM-UHFFFAOYSA-N 0 0 388.380 3.437 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c1[N+](=O)[O-] ZINC000194323526 1433161497 /nfs/dbraw/zinc/16/14/97/1433161497.db2.gz XVSHODFTZZQBIN-UHFFFAOYSA-N 0 0 393.403 3.451 20 5 GGBDRN CN(CCOc1ccc(Cl)cc1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194333412 1433162952 /nfs/dbraw/zinc/16/29/52/1433162952.db2.gz ONEVLMBNGXVNRX-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N(Cc1ccco1)Cc1ccco1 ZINC000194334827 1433163333 /nfs/dbraw/zinc/16/33/33/1433163333.db2.gz WCUFETJSZVYCJJ-UHFFFAOYSA-N 0 0 380.353 3.311 20 5 GGBDRN COc1ccc([C@@H](NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C2CC2)cc1 ZINC000194338609 1433163826 /nfs/dbraw/zinc/16/38/26/1433163826.db2.gz ZXDDQEUYXHQRQB-INIZCTEOSA-N 0 0 380.397 3.172 20 5 GGBDRN CC(C)CCOC1CCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000194338584 1433163840 /nfs/dbraw/zinc/16/38/40/1433163840.db2.gz KEYNPQZLAQIOGB-UHFFFAOYSA-N 0 0 375.469 3.011 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CCC(OCCC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000194338048 1433163877 /nfs/dbraw/zinc/16/38/77/1433163877.db2.gz FURFUYKHXDFDHD-OAHLLOKOSA-N 0 0 393.484 3.458 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000194341018 1433164209 /nfs/dbraw/zinc/16/42/09/1433164209.db2.gz MYDYOHSGEWRERH-GFCCVEGCSA-N 0 0 386.401 3.388 20 5 GGBDRN Cc1c(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)nnn1Cc1ccc(F)cc1 ZINC000194346281 1433164717 /nfs/dbraw/zinc/16/47/17/1433164717.db2.gz CNUSBEREFRQKCT-UHFFFAOYSA-N 0 0 395.394 3.275 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000194346163 1433164774 /nfs/dbraw/zinc/16/47/74/1433164774.db2.gz RKTUJPOQULZEBH-SECBINFHSA-N 0 0 390.339 3.375 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C ZINC000194350183 1433165348 /nfs/dbraw/zinc/16/53/48/1433165348.db2.gz DABBPEIMFQWVPV-UGSOOPFHSA-N 0 0 380.466 3.349 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1ccc(Cl)nc1Cl ZINC000194356772 1433166487 /nfs/dbraw/zinc/16/64/87/1433166487.db2.gz MJCVETIFROGUNN-UHFFFAOYSA-N 0 0 378.997 3.269 20 5 GGBDRN O=c1c(Br)cn(Cc2ccc(Cl)nc2Cl)cc1[N+](=O)[O-] ZINC000194357077 1433166574 /nfs/dbraw/zinc/16/65/74/1433166574.db2.gz NZASNVQXBPESHL-UHFFFAOYSA-N 0 0 378.997 3.269 20 5 GGBDRN C[C@H](CN1CCCC1=O)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000194366604 1433167834 /nfs/dbraw/zinc/16/78/34/1433167834.db2.gz SFWDSOOXGYJQAS-CQSZACIVSA-N 0 0 382.420 3.079 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1 ZINC000194384186 1433169962 /nfs/dbraw/zinc/16/99/62/1433169962.db2.gz VHOIEIBSMMZRRC-UHFFFAOYSA-N 0 0 387.411 3.009 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc(-n2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000194399105 1433172304 /nfs/dbraw/zinc/17/23/04/1433172304.db2.gz KMULSPBMKLAICC-OAHLLOKOSA-N 0 0 379.420 3.383 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2 ZINC000194417170 1433174724 /nfs/dbraw/zinc/17/47/24/1433174724.db2.gz TUDVBWCSZNRRSA-UHFFFAOYSA-N 0 0 385.420 3.325 20 5 GGBDRN COc1ccc2cc(C(=O)NCc3cc([N+](=O)[O-])ccc3OC)c(C)nc2c1 ZINC000194417739 1433174732 /nfs/dbraw/zinc/17/47/32/1433174732.db2.gz SFYSKAUEHRADMQ-UHFFFAOYSA-N 0 0 381.388 3.399 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 ZINC000194420252 1433175142 /nfs/dbraw/zinc/17/51/42/1433175142.db2.gz FUZYNKUXVADJEJ-UHFFFAOYSA-N 0 0 380.229 3.201 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(-n2cc[nH]c2=S)cc1 ZINC000194419025 1433175199 /nfs/dbraw/zinc/17/51/99/1433175199.db2.gz FCPVFTCZZFEEOF-UHFFFAOYSA-N 0 0 384.417 3.008 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 ZINC000194421715 1433175308 /nfs/dbraw/zinc/17/53/08/1433175308.db2.gz RPFBFNGDJAKOIY-UHFFFAOYSA-N 0 0 392.240 3.445 20 5 GGBDRN Cc1nn(C)c(C)c1-c1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)[nH]n1 ZINC000194429425 1433176612 /nfs/dbraw/zinc/17/66/12/1433176612.db2.gz RKODJNZMRVJFCQ-UHFFFAOYSA-N 0 0 396.451 3.386 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccc(Cn2ccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000194437064 1433177821 /nfs/dbraw/zinc/17/78/21/1433177821.db2.gz QZIUPOAMYCENCS-OAHLLOKOSA-N 0 0 379.420 3.400 20 5 GGBDRN Cc1ccccc1N1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000194437992 1433178060 /nfs/dbraw/zinc/17/80/60/1433178060.db2.gz QYXNESUIFZBHDW-UHFFFAOYSA-N 0 0 395.868 3.068 20 5 GGBDRN CC(C)OCc1ccc(N[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000194442837 1433179036 /nfs/dbraw/zinc/17/90/36/1433179036.db2.gz YIQJYWZSMACSHB-SFHVURJKSA-N 0 0 383.404 3.264 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(c3ccc(Cl)cn3)CC2)cc1[N+](=O)[O-] ZINC000194453844 1433180722 /nfs/dbraw/zinc/18/07/22/1433180722.db2.gz PUUZFUMHFAWHGD-UHFFFAOYSA-N 0 0 392.868 3.328 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H](c3nc(N(C)C)no3)C2)cc1[N+](=O)[O-] ZINC000194462498 1433182369 /nfs/dbraw/zinc/18/23/69/1433182369.db2.gz QNJPPGZEKLSIGO-CQSZACIVSA-N 0 0 387.440 3.187 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000194480115 1433185148 /nfs/dbraw/zinc/18/51/48/1433185148.db2.gz NBAWYLRLGSZYJV-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(C(=O)Nc2ccncc2)cc1 ZINC000194497673 1433187670 /nfs/dbraw/zinc/18/76/70/1433187670.db2.gz FFYVHNOCPQOIBO-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000194507543 1433189488 /nfs/dbraw/zinc/18/94/88/1433189488.db2.gz JGKMSGUUZWGDGO-UHFFFAOYSA-N 0 0 382.416 3.494 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000194516259 1433191139 /nfs/dbraw/zinc/19/11/39/1433191139.db2.gz YFOAJKIMANJYJE-HNNXBMFYSA-N 0 0 396.447 3.260 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCCc1cc(Cl)c2c(c1)OCCO2 ZINC000194531085 1433193173 /nfs/dbraw/zinc/19/31/73/1433193173.db2.gz YOGDZWDXJMTBFU-UHFFFAOYSA-N 0 0 376.796 3.300 20 5 GGBDRN O=C(NCCc1cccs1)C1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000194534543 1433193840 /nfs/dbraw/zinc/19/38/40/1433193840.db2.gz FIKNWYQWQKISDP-UHFFFAOYSA-N 0 0 391.468 3.366 20 5 GGBDRN COc1cccc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c1[N+](=O)[O-] ZINC000194546386 1433195631 /nfs/dbraw/zinc/19/56/31/1433195631.db2.gz JNHGMFGINWUPED-INIZCTEOSA-N 0 0 397.431 3.028 20 5 GGBDRN C[C@H](NC(=O)N1CCC(CC(=O)N2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194556313 1433196824 /nfs/dbraw/zinc/19/68/24/1433196824.db2.gz ACMVZZKGLHVVPR-HNNXBMFYSA-N 0 0 388.468 3.090 20 5 GGBDRN C[C@H](NC(=O)N1CCCN(C(=O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194557302 1433196981 /nfs/dbraw/zinc/19/69/81/1433196981.db2.gz LRLSZICXAZHEKG-INIZCTEOSA-N 0 0 396.447 3.214 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000194558452 1433197273 /nfs/dbraw/zinc/19/72/73/1433197273.db2.gz WWROXTTVHYVVRH-OAHLLOKOSA-N 0 0 390.484 3.384 20 5 GGBDRN O=C(NCc1nncn1C1CC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194580880 1433201118 /nfs/dbraw/zinc/20/11/18/1433201118.db2.gz NJMYVUGMGQRDHT-UHFFFAOYSA-N 0 0 393.403 3.030 20 5 GGBDRN C[C@@H](Sc1n[nH]c(Cc2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194592430 1433202708 /nfs/dbraw/zinc/20/27/08/1433202708.db2.gz NDQPSLFEXIYOQB-GFCCVEGCSA-N 0 0 383.433 3.423 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 ZINC000194598554 1433203548 /nfs/dbraw/zinc/20/35/48/1433203548.db2.gz LMEJVQOGZXYSQM-AWEZNQCLSA-N 0 0 377.441 3.232 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](CN(C)C(=O)OC(C)(C)C)C1 ZINC000194598539 1433203565 /nfs/dbraw/zinc/20/35/65/1433203565.db2.gz LMEJVQOGZXYSQM-CQSZACIVSA-N 0 0 377.441 3.232 20 5 GGBDRN Cc1c(C[NH+]2CCSCC2)cccc1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000194597581 1433203596 /nfs/dbraw/zinc/20/35/96/1433203596.db2.gz UCOCJCWBJSXWDL-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(C2N=NC(=S)N2C2CC2)CC1 ZINC000194602139 1433204137 /nfs/dbraw/zinc/20/41/37/1433204137.db2.gz HSJPYLYLNOJZFY-UHFFFAOYSA-N 0 0 387.465 3.138 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)nnn1Cc1ccc(F)cc1 ZINC000194606490 1433204749 /nfs/dbraw/zinc/20/47/49/1433204749.db2.gz NMJZHOPKSKRRCF-CYBMUJFWSA-N 0 0 397.410 3.482 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000194614580 1433205474 /nfs/dbraw/zinc/20/54/74/1433205474.db2.gz OCOVEBTZMYDKCZ-CQSZACIVSA-N 0 0 377.441 3.280 20 5 GGBDRN COc1cccc(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000194615265 1433205822 /nfs/dbraw/zinc/20/58/22/1433205822.db2.gz OZLHJEPNVQDUSS-ZDUSSCGKSA-N 0 0 375.812 3.266 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1Br ZINC000194622764 1433206884 /nfs/dbraw/zinc/20/68/84/1433206884.db2.gz JYWXEWQSLLJVSM-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)Nc2cc(-n3cnnn3)ccc2F)cc1[N+](=O)[O-] ZINC000194643317 1433210199 /nfs/dbraw/zinc/21/01/99/1433210199.db2.gz MSCOEQIMZBYENI-UHFFFAOYSA-N 0 0 384.371 3.259 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NCC2CCOCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000194659130 1433212160 /nfs/dbraw/zinc/21/21/60/1433212160.db2.gz FADBZQPYZWCIQJ-CQSZACIVSA-N 0 0 384.436 3.319 20 5 GGBDRN COc1cccc(C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1[N+](=O)[O-] ZINC000194662198 1433212572 /nfs/dbraw/zinc/21/25/72/1433212572.db2.gz SOQLNDJUHCRHQI-UHFFFAOYSA-N 0 0 379.372 3.066 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)ccc21 ZINC000194678014 1433214306 /nfs/dbraw/zinc/21/43/06/1433214306.db2.gz FCBCPRMVQIUQBX-UHFFFAOYSA-N 0 0 379.294 3.385 20 5 GGBDRN C[C@H](CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])Cn1ccnc1 ZINC000194679205 1433214721 /nfs/dbraw/zinc/21/47/21/1433214721.db2.gz AFUXEWMABAUUTE-MRXNPFEDSA-N 0 0 394.431 3.436 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)NC(=O)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000194681441 1433214928 /nfs/dbraw/zinc/21/49/28/1433214928.db2.gz BMRMIQQBPZOWIY-NEPJUHHUSA-N 0 0 375.812 3.244 20 5 GGBDRN O=C(NC[C@@H]1CCCC[C@H]1O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194682894 1433215002 /nfs/dbraw/zinc/21/50/02/1433215002.db2.gz FMUSIMJYAPMHQT-OXJNMPFZSA-N 0 0 384.432 3.455 20 5 GGBDRN CCOC(=O)[C@H]1CCCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000194683101 1433215144 /nfs/dbraw/zinc/21/51/44/1433215144.db2.gz KULXNHZTZZSDOP-OAHLLOKOSA-N 0 0 389.433 3.276 20 5 GGBDRN Nc1c(C(=O)NCCCCOCCc2ccccc2)cc(F)cc1[N+](=O)[O-] ZINC000194690160 1433216021 /nfs/dbraw/zinc/21/60/21/1433216021.db2.gz MJURWVURDYRCBH-UHFFFAOYSA-N 0 0 375.400 3.085 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](C2N=NC(=S)N2C2CC2)C1 ZINC000194694876 1433216369 /nfs/dbraw/zinc/21/63/69/1433216369.db2.gz GSODBRLKZMSREB-LBPRGKRZSA-N 0 0 387.465 3.138 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](C2N=NC(=S)N2C(C)C)C1 ZINC000194694764 1433216372 /nfs/dbraw/zinc/21/63/72/1433216372.db2.gz SVSAVKSZTQKADB-ZDUSSCGKSA-N 0 0 389.481 3.384 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000194722043 1433220038 /nfs/dbraw/zinc/22/00/38/1433220038.db2.gz ICFOXHCEMVJLDY-AREMUKBSSA-N 0 0 376.434 3.051 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Nc1ccc(F)cc1Br ZINC000194723623 1433220292 /nfs/dbraw/zinc/22/02/92/1433220292.db2.gz ULLSOKLIFSTERC-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000194728379 1433221119 /nfs/dbraw/zinc/22/11/19/1433221119.db2.gz MZVCNPXGKGNUJX-SNVBAGLBSA-N 0 0 395.437 3.253 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000194738760 1433222345 /nfs/dbraw/zinc/22/23/45/1433222345.db2.gz ZNQABESMAHPQRD-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN COc1cccc(C(=O)N[C@@H](C)Cc2cc(C)nn2-c2ccccc2)c1[N+](=O)[O-] ZINC000194740442 1433222879 /nfs/dbraw/zinc/22/28/79/1433222879.db2.gz SIOBNJUJMMJUQL-AWEZNQCLSA-N 0 0 394.431 3.459 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cn1cnc2c3ccccc3oc2c1=O ZINC000194756599 1433225610 /nfs/dbraw/zinc/22/56/10/1433225610.db2.gz XCLACMQDMZAOIY-UHFFFAOYSA-N 0 0 392.371 3.306 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1 ZINC000194761985 1433226260 /nfs/dbraw/zinc/22/62/60/1433226260.db2.gz UWEGCOVHZNVONB-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN COc1cccc(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)c1[N+](=O)[O-] ZINC000194795233 1433233997 /nfs/dbraw/zinc/23/39/97/1433233997.db2.gz MJKOZAMEDJDEQU-NSHDSACASA-N 0 0 393.802 3.405 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cc(N3C[C@@H](C)O[C@@H](C)C3)ccn2)cc1[N+](=O)[O-] ZINC000194806189 1433236505 /nfs/dbraw/zinc/23/65/05/1433236505.db2.gz BEVIDJUFQNRKRS-XHSDSOJGSA-N 0 0 398.463 3.403 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(N3C[C@@H](C)O[C@@H](C)C3)ccn2)cc1[N+](=O)[O-] ZINC000194806174 1433236511 /nfs/dbraw/zinc/23/65/11/1433236511.db2.gz BEVIDJUFQNRKRS-OWCLPIDISA-N 0 0 398.463 3.403 20 5 GGBDRN CN(C[C@@H]1CCC[C@@H]1O)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194807024 1433236902 /nfs/dbraw/zinc/23/69/02/1433236902.db2.gz ONZCRWHCLCCZOO-JXFKEZNVSA-N 0 0 384.432 3.407 20 5 GGBDRN CN(C[C@H]1CCC[C@H]1O)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194807060 1433236999 /nfs/dbraw/zinc/23/69/99/1433236999.db2.gz ONZCRWHCLCCZOO-OXQOHEQNSA-N 0 0 384.432 3.407 20 5 GGBDRN O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000194811030 1433237962 /nfs/dbraw/zinc/23/79/62/1433237962.db2.gz DPYPFJDJMNJZQX-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN C[C@@H]1CN(c2ccnc(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)c2)C[C@H](C)O1 ZINC000194813730 1433238798 /nfs/dbraw/zinc/23/87/98/1433238798.db2.gz KJJILYALIMTJFG-GASCZTMLSA-N 0 0 398.463 3.269 20 5 GGBDRN C[C@H]1CN(c2ccnc(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)c2)C[C@H](C)O1 ZINC000194813743 1433238923 /nfs/dbraw/zinc/23/89/23/1433238923.db2.gz KJJILYALIMTJFG-GJZGRUSLSA-N 0 0 398.463 3.269 20 5 GGBDRN COc1cccc(C(=O)N2CCC(n3ccc(C(F)(F)F)n3)CC2)c1[N+](=O)[O-] ZINC000194839788 1433245635 /nfs/dbraw/zinc/24/56/35/1433245635.db2.gz MDUALZXYPOQRSB-UHFFFAOYSA-N 0 0 398.341 3.296 20 5 GGBDRN COC(=O)c1cc(Br)ccc1OC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000194847656 1433248033 /nfs/dbraw/zinc/24/80/33/1433248033.db2.gz DSMUUUBABTVMAO-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)NCCCc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000194848177 1433248078 /nfs/dbraw/zinc/24/80/78/1433248078.db2.gz MZISNCLEALUPEK-UHFFFAOYSA-N 0 0 396.852 3.014 20 5 GGBDRN COc1cccc(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1[N+](=O)[O-] ZINC000194848183 1433248108 /nfs/dbraw/zinc/24/81/08/1433248108.db2.gz JMYXSJYHXVKYDG-NSHDSACASA-N 0 0 398.341 3.296 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000194859040 1433250208 /nfs/dbraw/zinc/25/02/08/1433250208.db2.gz SUJQNCZELYVLRQ-CYBMUJFWSA-N 0 0 391.449 3.232 20 5 GGBDRN COc1cc(CCNC(=O)c2csc(CC(C)C)n2)c([N+](=O)[O-])cc1OC ZINC000194861720 1433250973 /nfs/dbraw/zinc/25/09/73/1433250973.db2.gz HQKDWIDKFPMPCN-UHFFFAOYSA-N 0 0 393.465 3.240 20 5 GGBDRN CCS(=O)(=O)c1ccc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000194862514 1433251299 /nfs/dbraw/zinc/25/12/99/1433251299.db2.gz FCHPSFNLARUPHY-UHFFFAOYSA-N 0 0 396.852 3.314 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCc1ccccc1Br ZINC000194873479 1433253714 /nfs/dbraw/zinc/25/37/14/1433253714.db2.gz LZKPXDJILNBMLF-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000194882160 1433255975 /nfs/dbraw/zinc/25/59/75/1433255975.db2.gz MDIQRNKDIDFWLU-UHFFFAOYSA-N 0 0 377.347 3.282 20 5 GGBDRN COc1cccc(C2CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3OC)CC2)c1 ZINC000194883701 1433256587 /nfs/dbraw/zinc/25/65/87/1433256587.db2.gz ONKDJUVXSTYJHW-UHFFFAOYSA-N 0 0 399.447 3.430 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1 ZINC000194885934 1433256994 /nfs/dbraw/zinc/25/69/94/1433256994.db2.gz MGEUDDJNLJKCFT-UHFFFAOYSA-N 0 0 382.376 3.133 20 5 GGBDRN COc1cccc(C2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000194895964 1433259497 /nfs/dbraw/zinc/25/94/97/1433259497.db2.gz AFFPSHPIZTYECN-UHFFFAOYSA-N 0 0 376.434 3.172 20 5 GGBDRN 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Cc1cc(=O)c(C(=O)N2[C@H](C)C[C@H]3CCCC[C@H]32)nn1-c1ccccc1[N+](=O)[O-] ZINC000246340425 1433597417 /nfs/dbraw/zinc/59/74/17/1433597417.db2.gz JBJNOYVNQVJWGV-FVQBIDKESA-N 0 0 396.447 3.242 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2[C@H](C)C[C@@H]3CCCC[C@H]32)nn1-c1ccccc1[N+](=O)[O-] ZINC000246340439 1433597496 /nfs/dbraw/zinc/59/74/96/1433597496.db2.gz JBJNOYVNQVJWGV-VNQPRFMTSA-N 0 0 396.447 3.242 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC[C@@H](C)c2ccccc21 ZINC000246398279 1433606973 /nfs/dbraw/zinc/60/69/73/1433606973.db2.gz XLSZJVVZDBEPQT-TYILLQQXSA-N 0 0 381.432 3.468 20 5 GGBDRN C[C@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H](c2ccsc2)O1 ZINC000246405545 1433607790 /nfs/dbraw/zinc/60/77/90/1433607790.db2.gz IYMWOTDQLISFDU-UGSOOPFHSA-N 0 0 387.461 3.007 20 5 GGBDRN CCOC(=O)c1ccnc(N2C[C@H](C)O[C@@H](c3ccsc3)C2)c1[N+](=O)[O-] ZINC000246424798 1433610751 /nfs/dbraw/zinc/61/07/51/1433610751.db2.gz JYZXREBGOUQTGW-SMDDNHRTSA-N 0 0 377.422 3.194 20 5 GGBDRN O=C([C@@H]1C[C@@H]1c1cccc(Cl)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246441060 1433613112 /nfs/dbraw/zinc/61/31/12/1433613112.db2.gz USHDXJQBAVMXSS-DJIMGWMZSA-N 0 0 386.839 3.460 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000246467345 1433617275 /nfs/dbraw/zinc/61/72/75/1433617275.db2.gz MLALAXYCNDXYTQ-XJKSGUPXSA-N 0 0 396.490 3.424 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1[N+](=O)[O-] ZINC000246500264 1433621575 /nfs/dbraw/zinc/62/15/75/1433621575.db2.gz SCZYAOIYEZSWJD-JYJNAYRXSA-N 0 0 398.463 3.403 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000246529455 1433625823 /nfs/dbraw/zinc/62/58/23/1433625823.db2.gz POKREZWWTWGYFR-IGCXYCKISA-N 0 0 375.450 3.445 20 5 GGBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000246596476 1433637032 /nfs/dbraw/zinc/63/70/32/1433637032.db2.gz UCZMHBXGCIHMCA-XNJGSVPQSA-N 0 0 375.450 3.445 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@@H](C)C1 ZINC000246599402 1433638045 /nfs/dbraw/zinc/63/80/45/1433638045.db2.gz ALUINAHDGRZQFE-IPYPFGDCSA-N 0 0 375.425 3.224 20 5 GGBDRN C[C@@H]1C[C@H]1[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000246607545 1433638625 /nfs/dbraw/zinc/63/86/25/1433638625.db2.gz JGANTNTUDJKEQB-LYRGGWFBSA-N 0 0 377.832 3.141 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000246607903 1433639020 /nfs/dbraw/zinc/63/90/20/1433639020.db2.gz UTIKMRHMKPUVMM-IGCXYCKISA-N 0 0 375.450 3.445 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000246686351 1433649855 /nfs/dbraw/zinc/64/98/55/1433649855.db2.gz RCMGMDPJAFMIJC-AMAKMLAGSA-N 0 0 381.498 3.343 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000246686368 1433649947 /nfs/dbraw/zinc/64/99/47/1433649947.db2.gz RCMGMDPJAFMIJC-RHVCPTERSA-N 0 0 381.498 3.343 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000246688722 1433650459 /nfs/dbraw/zinc/65/04/59/1433650459.db2.gz YRRJKFDJYCVWPM-CXAGYDPISA-N 0 0 394.424 3.193 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](c2ccccc2)C[C@H]1C ZINC000246701321 1433651797 /nfs/dbraw/zinc/65/17/97/1433651797.db2.gz DTXBTAKPFSRKIT-RVKKMQEKSA-N 0 0 381.432 3.118 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246763522 1433662064 /nfs/dbraw/zinc/66/20/64/1433662064.db2.gz NYRSARUIAHDVKD-DYEKYZERSA-N 0 0 389.481 3.429 20 5 GGBDRN CC[C@H](C)C[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000246776659 1433664312 /nfs/dbraw/zinc/66/43/12/1433664312.db2.gz INZYHDVSPABORH-DHSIGJKJSA-N 0 0 375.469 3.449 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000246798367 1433669395 /nfs/dbraw/zinc/66/93/95/1433669395.db2.gz JRUDCNWXXJLIKZ-KSSFIOAISA-N 0 0 376.434 3.054 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000246826946 1433675037 /nfs/dbraw/zinc/67/50/37/1433675037.db2.gz JZRLDEYFQAMGSO-NEPJUHHUSA-N 0 0 393.469 3.251 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000246853782 1433678466 /nfs/dbraw/zinc/67/84/66/1433678466.db2.gz FBNHPOUOXLZKPM-TYILLQQXSA-N 0 0 399.422 3.462 20 5 GGBDRN CC1(C)[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@@H]2CCO[C@H]21 ZINC000246891247 1433683397 /nfs/dbraw/zinc/68/33/97/1433683397.db2.gz CCJUJZDQDDQQIJ-KNXBSLHKSA-N 0 0 376.456 3.084 20 5 GGBDRN C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCCO[C@H](C)C1 ZINC000246894175 1433683987 /nfs/dbraw/zinc/68/39/87/1433683987.db2.gz FJAKYAUYROHOIG-CHWSQXEVSA-N 0 0 390.465 3.156 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000246906647 1433685455 /nfs/dbraw/zinc/68/54/55/1433685455.db2.gz MMEGAZBZZHHZMX-FHSNZYRGSA-N 0 0 381.860 3.202 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000246906717 1433685606 /nfs/dbraw/zinc/68/56/06/1433685606.db2.gz MMEGAZBZZHHZMX-VFVRVIDISA-N 0 0 381.860 3.202 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 ZINC000246976537 1433689460 /nfs/dbraw/zinc/68/94/60/1433689460.db2.gz GYWUYKAVNFNGEX-KNBMTAEXSA-N 0 0 395.459 3.241 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@@H](c2ccc(F)cc2)C[C@@H]1C ZINC000247202253 1433690206 /nfs/dbraw/zinc/69/02/06/1433690206.db2.gz UYQIRWOYMFTXLL-ZQIUZPCESA-N 0 0 399.422 3.257 20 5 GGBDRN CO[C@@H]1CCCN([C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000247206161 1433691133 /nfs/dbraw/zinc/69/11/33/1433691133.db2.gz XPDIPQCGWQKFDT-IUODEOHRSA-N 0 0 390.465 3.156 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)CC1 ZINC000247211657 1433691323 /nfs/dbraw/zinc/69/13/23/1433691323.db2.gz NOCSZEJXLUWKIZ-KFKAGJAMSA-N 0 0 387.480 3.374 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1c(F)cccc1F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000247232174 1433694277 /nfs/dbraw/zinc/69/42/77/1433694277.db2.gz XWDKTJKBQSIZTJ-MRVWCRGKSA-N 0 0 388.374 3.085 20 5 GGBDRN O=C(CN1CCCCC[C@H]1C[C@@H](O)c1ccco1)Nc1ccccc1[N+](=O)[O-] ZINC000247291416 1433701024 /nfs/dbraw/zinc/70/10/24/1433701024.db2.gz FBXPRABGBVPGKR-MAUKXSAKSA-N 0 0 387.436 3.495 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000247300483 1433702377 /nfs/dbraw/zinc/70/23/77/1433702377.db2.gz DWBSQGDDQGGXFM-CQSZACIVSA-N 0 0 389.839 3.270 20 5 GGBDRN O=C(c1cccn1Cc1ccccc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000247306586 1433702706 /nfs/dbraw/zinc/70/27/06/1433702706.db2.gz GXSZDBYBKUESGY-UHFFFAOYSA-N 0 0 390.443 3.407 20 5 GGBDRN O=C(c1ccc(NCC2(c3ccccc3)CC2)c([N+](=O)[O-])c1)N1CCOCC1 ZINC000247316595 1433704566 /nfs/dbraw/zinc/70/45/66/1433704566.db2.gz KKCDQWGFJMYPFV-UHFFFAOYSA-N 0 0 381.432 3.211 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(OC2CCCC2)cc1 ZINC000247337064 1433709201 /nfs/dbraw/zinc/70/92/01/1433709201.db2.gz QZTFYSHCUCPCRP-UHFFFAOYSA-N 0 0 383.404 3.285 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000247335439 1433709246 /nfs/dbraw/zinc/70/92/46/1433709246.db2.gz VXDBCCHGASECCK-CABCVRRESA-N 0 0 396.451 3.394 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(-n2cnc3ccccc32)nc1 ZINC000247349302 1433711298 /nfs/dbraw/zinc/71/12/98/1433711298.db2.gz VPZFHBGLUCURCH-UHFFFAOYSA-N 0 0 389.371 3.346 20 5 GGBDRN C[C@@H]1CN(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)[C@@H]1c1ccccc1 ZINC000247391359 1433716271 /nfs/dbraw/zinc/71/62/71/1433716271.db2.gz GSGUSBJMLBYIKQ-IBZMOEQTSA-N 0 0 394.431 3.012 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1nnc(-c2ccccc2Cl)o1 ZINC000247412961 1433719130 /nfs/dbraw/zinc/71/91/30/1433719130.db2.gz PQBJTKVOFVYOIJ-UHFFFAOYSA-N 0 0 383.751 3.056 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cccc(OC(F)(F)F)c1 ZINC000247413177 1433719568 /nfs/dbraw/zinc/71/95/68/1433719568.db2.gz PRWZAVGWCTVQSX-UHFFFAOYSA-N 0 0 397.265 3.040 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCc2cccc(F)c21 ZINC000247432684 1433721641 /nfs/dbraw/zinc/72/16/41/1433721641.db2.gz UVPWLUOFDXMEGK-UHFFFAOYSA-N 0 0 399.378 3.401 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000247444966 1433723334 /nfs/dbraw/zinc/72/33/34/1433723334.db2.gz OCDJGECRLHIAJI-TZMCWYRMSA-N 0 0 380.422 3.358 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000247448573 1433723732 /nfs/dbraw/zinc/72/37/32/1433723732.db2.gz ZDGWXHQQZCSFTD-UHFFFAOYSA-N 0 0 383.751 3.056 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@@H](CN2CCCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000247552177 1433736776 /nfs/dbraw/zinc/73/67/76/1433736776.db2.gz WHWCJPIQPBSBOK-SFHVURJKSA-N 0 0 389.477 3.247 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000247580491 1433738735 /nfs/dbraw/zinc/73/87/35/1433738735.db2.gz 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GGBDRN Cc1cc(C)n(-c2ccccc2NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)n1 ZINC000263658006 1434016454 /nfs/dbraw/zinc/01/64/54/1434016454.db2.gz IVKKBJJVDWJEQL-UHFFFAOYSA-N 0 0 382.424 3.239 20 5 GGBDRN COc1ccc(CCC(=O)N2CCCN(Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000263664892 1434017320 /nfs/dbraw/zinc/01/73/20/1434017320.db2.gz FGTXMSKIPPJYQW-UHFFFAOYSA-N 0 0 397.475 3.271 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000263672603 1434018614 /nfs/dbraw/zinc/01/86/14/1434018614.db2.gz FIJQYODATQTILP-GJZGRUSLSA-N 0 0 393.509 3.230 20 5 GGBDRN Cc1ccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000263676884 1434019419 /nfs/dbraw/zinc/01/94/19/1434019419.db2.gz NKNFAEDCTFOVKG-QGZVFWFLSA-N 0 0 387.461 3.194 20 5 GGBDRN CCc1cccc2c1OCC[C@H]2NC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000263678404 1434019442 /nfs/dbraw/zinc/01/94/42/1434019442.db2.gz GREHQKLRLRSGFE-MRXNPFEDSA-N 0 0 383.404 3.044 20 5 GGBDRN 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C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000263697968 1434022334 /nfs/dbraw/zinc/02/23/34/1434022334.db2.gz MDKJOMGKUCSRAL-HNNXBMFYSA-N 0 0 396.447 3.342 20 5 GGBDRN C[C@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(N2CCOC2=O)cc1 ZINC000263705951 1434023484 /nfs/dbraw/zinc/02/34/84/1434023484.db2.gz SINWIIOBKNCBIS-ZDUSSCGKSA-N 0 0 399.403 3.269 20 5 GGBDRN C[C@@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc(N2CCOC2=O)c1 ZINC000263709922 1434023732 /nfs/dbraw/zinc/02/37/32/1434023732.db2.gz UBNCIHYHHABBCX-CYBMUJFWSA-N 0 0 399.403 3.269 20 5 GGBDRN CC(C)c1nc(C2CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)CC2)no1 ZINC000263717606 1434024798 /nfs/dbraw/zinc/02/47/98/1434024798.db2.gz ODPHTAQCPMDEBZ-UHFFFAOYSA-N 0 0 385.424 3.370 20 5 GGBDRN COc1ccc(OC)c([C@@H](C)NC(=O)COc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000263734265 1434026789 /nfs/dbraw/zinc/02/67/89/1434026789.db2.gz IONXQLANZDHWRX-LLVKDONJSA-N 0 0 378.356 3.007 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCCN(C(=O)Oc2ccccc2)CC1 ZINC000263754307 1434029561 /nfs/dbraw/zinc/02/95/61/1434029561.db2.gz XWYPUQZNXXYBFF-UHFFFAOYSA-N 0 0 384.392 3.333 20 5 GGBDRN COc1ccc(NC(=O)C2CCN(C(=O)OCC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000263753954 1434029649 /nfs/dbraw/zinc/02/96/49/1434029649.db2.gz VAFWWUDPFUMSOC-UHFFFAOYSA-N 0 0 379.413 3.047 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1 ZINC000263786123 1434034013 /nfs/dbraw/zinc/03/40/13/1434034013.db2.gz PEWXIGRLYDGOBC-CYBMUJFWSA-N 0 0 389.358 3.364 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1 ZINC000263786127 1434034020 /nfs/dbraw/zinc/03/40/20/1434034020.db2.gz PEWXIGRLYDGOBC-ZDUSSCGKSA-N 0 0 389.358 3.364 20 5 GGBDRN CC(C)C(=O)NC[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000263795849 1434035002 /nfs/dbraw/zinc/03/50/02/1434035002.db2.gz YIJGGWQZYQSAPU-LBPRGKRZSA-N 0 0 382.848 3.264 20 5 GGBDRN COc1cc(C(=O)N[C@H](COCC(C)C)c2ccco2)c([N+](=O)[O-])cc1OC ZINC000263806409 1434036168 /nfs/dbraw/zinc/03/61/68/1434036168.db2.gz XYFRMSYMIWBPBH-CQSZACIVSA-N 0 0 392.408 3.349 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000263812713 1434036747 /nfs/dbraw/zinc/03/67/47/1434036747.db2.gz OKBPKUSWGPKTBF-HUUCEWRRSA-N 0 0 393.509 3.086 20 5 GGBDRN COc1ccc(CCC(=O)Nc2ccc([N+](=O)[O-])cc2F)c(OC)c1OC ZINC000263813788 1434036947 /nfs/dbraw/zinc/03/69/47/1434036947.db2.gz ZHYNBOPPAYEAPC-UHFFFAOYSA-N 0 0 378.356 3.331 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc3[nH]cnc3c2)ccc1[N+](=O)[O-] ZINC000263818739 1434037329 /nfs/dbraw/zinc/03/73/29/1434037329.db2.gz PJLKAENMFKRZND-GOSISDBHSA-N 0 0 393.403 3.023 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc3[nH]cnc3c2)ccc1[N+](=O)[O-] ZINC000263818741 1434037463 /nfs/dbraw/zinc/03/74/63/1434037463.db2.gz PJLKAENMFKRZND-SFHVURJKSA-N 0 0 393.403 3.023 20 5 GGBDRN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000263836731 1434040054 /nfs/dbraw/zinc/04/00/54/1434040054.db2.gz VJSCKIHUCFMCSG-OAHLLOKOSA-N 0 0 396.447 3.342 20 5 GGBDRN Cc1nn(CCC(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)c(C)c1[N+](=O)[O-] ZINC000263863624 1434043035 /nfs/dbraw/zinc/04/30/35/1434043035.db2.gz YCUAVULYUIJEQA-MRXNPFEDSA-N 0 0 392.843 3.052 20 5 GGBDRN CC(C)(C)OC(=O)C1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1 ZINC000263877975 1434044815 /nfs/dbraw/zinc/04/48/15/1434044815.db2.gz MSFNDUJADAENIM-UHFFFAOYSA-N 0 0 389.452 3.045 20 5 GGBDRN CC[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000263897856 1434046973 /nfs/dbraw/zinc/04/69/73/1434046973.db2.gz IIEGOEFJSMWVHX-OAHLLOKOSA-N 0 0 389.481 3.272 20 5 GGBDRN CC(C)(C)OC(=O)C1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000263900790 1434047174 /nfs/dbraw/zinc/04/71/74/1434047174.db2.gz ZRAHAVFVNKZWPO-UHFFFAOYSA-N 0 0 378.425 3.015 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000263923330 1434049102 /nfs/dbraw/zinc/04/91/02/1434049102.db2.gz PVYBKQTXFVCFCG-CYBMUJFWSA-N 0 0 377.832 3.447 20 5 GGBDRN COc1ccc(CCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c(OC)c1OC ZINC000263925830 1434049287 /nfs/dbraw/zinc/04/92/87/1434049287.db2.gz VIQJHSBOWUKDRT-UHFFFAOYSA-N 0 0 399.403 3.074 20 5 GGBDRN CS(=O)(=O)c1ccc(NCc2cccc(OCC(F)F)c2)c([N+](=O)[O-])c1 ZINC000263943005 1434051405 /nfs/dbraw/zinc/05/14/05/1434051405.db2.gz YFPBUFNPKRLJDD-UHFFFAOYSA-N 0 0 386.376 3.254 20 5 GGBDRN CCC[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)C(=O)N1CCc2sccc2C1 ZINC000263943964 1434051674 /nfs/dbraw/zinc/05/16/74/1434051674.db2.gz YFPGHNGYJMBKKQ-LBPRGKRZSA-N 0 0 393.490 3.201 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000263963759 1434054615 /nfs/dbraw/zinc/05/46/15/1434054615.db2.gz ZTAVDQKBQFLXQO-INIZCTEOSA-N 0 0 386.455 3.284 20 5 GGBDRN C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000263975678 1434056324 /nfs/dbraw/zinc/05/63/24/1434056324.db2.gz DEWNQAKWZFVTDI-AWEZNQCLSA-N 0 0 396.447 3.183 20 5 GGBDRN COc1cccc(CCNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c1 ZINC000263978139 1434056802 /nfs/dbraw/zinc/05/68/02/1434056802.db2.gz BAIBHLZSQXJDDN-UHFFFAOYSA-N 0 0 376.434 3.306 20 5 GGBDRN COc1cccc(N2CC[C@H](NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])C2)c1 ZINC000263978762 1434056887 /nfs/dbraw/zinc/05/68/87/1434056887.db2.gz ANXSYDZTRNEELV-ZDUSSCGKSA-N 0 0 375.812 3.266 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000263987427 1434058060 /nfs/dbraw/zinc/05/80/60/1434058060.db2.gz MPIKRECYIWEMNQ-HXUWFJFHSA-N 0 0 393.443 3.093 20 5 GGBDRN COC(=O)c1sc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])nc1C ZINC000263988661 1434058127 /nfs/dbraw/zinc/05/81/27/1434058127.db2.gz GCRUCMCOPVHFSS-UHFFFAOYSA-N 0 0 397.434 3.129 20 5 GGBDRN Cc1nn(CCC(=O)NCc2cccc(COC(C)(C)C)c2)c(C)c1[N+](=O)[O-] ZINC000263989361 1434058461 /nfs/dbraw/zinc/05/84/61/1434058461.db2.gz NIXCWLOQCBIBDJ-UHFFFAOYSA-N 0 0 388.468 3.430 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)c1 ZINC000263991895 1434058653 /nfs/dbraw/zinc/05/86/53/1434058653.db2.gz HWGQRTNARXZEMJ-NSHDSACASA-N 0 0 385.445 3.327 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H]2CCOc3c(Cl)cccc32)c(C)c1[N+](=O)[O-] ZINC000263994324 1434059047 /nfs/dbraw/zinc/05/90/47/1434059047.db2.gz OZQXEQPLQMLCCB-CQSZACIVSA-N 0 0 378.816 3.092 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H]2CCOc3c(Cl)cccc32)c(C)c1[N+](=O)[O-] ZINC000263994323 1434059099 /nfs/dbraw/zinc/05/90/99/1434059099.db2.gz OZQXEQPLQMLCCB-AWEZNQCLSA-N 0 0 378.816 3.092 20 5 GGBDRN Cc1nn(CCC(=O)N(Cc2ccccc2)C[C@H]2CCCO2)c(C)c1[N+](=O)[O-] ZINC000264000568 1434060133 /nfs/dbraw/zinc/06/01/33/1434060133.db2.gz RAVIWCHFBYDTAZ-GOSISDBHSA-N 0 0 386.452 3.006 20 5 GGBDRN C[C@@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000264002405 1434060367 /nfs/dbraw/zinc/06/03/67/1434060367.db2.gz GHNCEKCGSGCJDN-QWHCGFSZSA-N 0 0 382.420 3.235 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@H](O)c2ccc(C)cc2)cc1SC ZINC000264007754 1434061223 /nfs/dbraw/zinc/06/12/23/1434061223.db2.gz DSXSDNDATVDJEK-HNNXBMFYSA-N 0 0 376.434 3.097 20 5 GGBDRN COc1cccc(N2CC[C@H](NC(=O)c3cc(SC)ccc3[N+](=O)[O-])C2)c1 ZINC000264012075 1434061870 /nfs/dbraw/zinc/06/18/70/1434061870.db2.gz XPRKEVIYJDCOOA-ZDUSSCGKSA-N 0 0 387.461 3.334 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3nc(C)no3)C2)cc1SC ZINC000264013077 1434062011 /nfs/dbraw/zinc/06/20/11/1434062011.db2.gz PEBJAUNLDSBNST-LLVKDONJSA-N 0 0 392.437 3.037 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nc(C)no3)C2)cc1SC ZINC000264013078 1434062050 /nfs/dbraw/zinc/06/20/50/1434062050.db2.gz PEBJAUNLDSBNST-NSHDSACASA-N 0 0 392.437 3.037 20 5 GGBDRN COc1ccc(C(=O)N2CCO[C@@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000264028956 1434063995 /nfs/dbraw/zinc/06/39/95/1434063995.db2.gz JXXWFRNISWKDRK-QGZVFWFLSA-N 0 0 376.796 3.471 20 5 GGBDRN CC(=O)c1ccc(OC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(C)c1 ZINC000264042449 1434065394 /nfs/dbraw/zinc/06/53/94/1434065394.db2.gz OHUDECFETACNTB-UHFFFAOYSA-N 0 0 398.371 3.400 20 5 GGBDRN COC(=O)CCCCCCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000264046657 1434066000 /nfs/dbraw/zinc/06/60/00/1434066000.db2.gz ZTMODLHJDSXECR-UHFFFAOYSA-N 0 0 384.454 3.179 20 5 GGBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000264059999 1434067368 /nfs/dbraw/zinc/06/73/68/1434067368.db2.gz LNUKLVDECXAFEC-UHFFFAOYSA-N 0 0 384.436 3.080 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](c2nccs2)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000264058172 1434067496 /nfs/dbraw/zinc/06/74/96/1434067496.db2.gz ZZKCVQILLVURFH-MRXNPFEDSA-N 0 0 385.449 3.161 20 5 GGBDRN Cc1nn(CCC(=O)N(C)c2cccc(OC(F)(F)F)c2)c(C)c1[N+](=O)[O-] ZINC000264068176 1434068751 /nfs/dbraw/zinc/06/87/51/1434068751.db2.gz GFKHZBUNGGZSFR-UHFFFAOYSA-N 0 0 386.330 3.360 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000264073431 1434069170 /nfs/dbraw/zinc/06/91/70/1434069170.db2.gz UHMHPNUHBMWCPA-OLZOCXBDSA-N 0 0 399.472 3.472 20 5 GGBDRN COc1ccc(CCNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1F ZINC000264089687 1434070859 /nfs/dbraw/zinc/07/08/59/1434070859.db2.gz JDKSRMQYMBKZBI-UHFFFAOYSA-N 0 0 394.424 3.446 20 5 GGBDRN CC(=O)Nc1ccc(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000264114167 1434072926 /nfs/dbraw/zinc/07/29/26/1434072926.db2.gz WAKGJJPPGBXISJ-UHFFFAOYSA-N 0 0 384.436 3.104 20 5 GGBDRN CCC(C)(C)NC(=O)c1ccc(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])cc1Cl ZINC000264121022 1434073516 /nfs/dbraw/zinc/07/35/16/1434073516.db2.gz CLFUBHXWSKUPEC-UHFFFAOYSA-N 0 0 393.831 3.450 20 5 GGBDRN Cc1c(C(=O)Oc2ccc(C(=O)N3CCCC3)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000264128271 1434074211 /nfs/dbraw/zinc/07/42/11/1434074211.db2.gz OFWPLDUUVRONSU-UHFFFAOYSA-N 0 0 399.359 3.267 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(C(=O)N(C)C)c1 ZINC000264139935 1434075158 /nfs/dbraw/zinc/07/51/58/1434075158.db2.gz XPQJQDHIPKNMQO-UHFFFAOYSA-N 0 0 398.463 3.417 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)no2)c1[N+](=O)[O-] ZINC000264155384 1434076427 /nfs/dbraw/zinc/07/64/27/1434076427.db2.gz HMEKEXSPMBPPIU-ZDUSSCGKSA-N 0 0 382.380 3.044 20 5 GGBDRN Cc1cc(C(=O)N2CCC(C3N=NC(=S)N3C3CC3)CC2)ccc1[N+](=O)[O-] ZINC000264159989 1434077092 /nfs/dbraw/zinc/07/70/92/1434077092.db2.gz JWVJFISHVSOSII-UHFFFAOYSA-N 0 0 387.465 3.138 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2cnc(CCN3CCO[C@@H](c4nccs4)C3)o2)c1 ZINC000264167925 1434077920 /nfs/dbraw/zinc/07/79/20/1434077920.db2.gz HKMOVVFWMHPUJR-MRXNPFEDSA-N 0 0 386.433 3.322 20 5 GGBDRN COc1cc(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)c([N+](=O)[O-])cc1OC ZINC000264185704 1434079177 /nfs/dbraw/zinc/07/91/77/1434079177.db2.gz ZZNGMIICOWEGIH-UHFFFAOYSA-N 0 0 385.376 3.139 20 5 GGBDRN COc1ccc(CNC(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc1[N+](=O)[O-] ZINC000264189900 1434080035 /nfs/dbraw/zinc/08/00/35/1434080035.db2.gz NZIUYCBIYVEJSF-UHFFFAOYSA-N 0 0 384.392 3.200 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCO[C@H](c3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000264196869 1434081008 /nfs/dbraw/zinc/08/10/08/1434081008.db2.gz HGANGCVZWKUOKM-KRWDZBQOSA-N 0 0 396.852 3.230 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2cccc([N+](=O)[O-])c2)c1C ZINC000264202324 1434081663 /nfs/dbraw/zinc/08/16/63/1434081663.db2.gz SCUOGTXJOFODMT-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN CCCOc1cc(NC(=O)NCc2nccn2C)c([N+](=O)[O-])cc1OCCC ZINC000264215850 1434083405 /nfs/dbraw/zinc/08/34/05/1434083405.db2.gz UQIYQNOLQXTMMF-UHFFFAOYSA-N 0 0 391.428 3.228 20 5 GGBDRN CCOc1ccc(OC)cc1NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000264220975 1434083885 /nfs/dbraw/zinc/08/38/85/1434083885.db2.gz KMHRISBFJWYUMH-UHFFFAOYSA-N 0 0 376.365 3.028 20 5 GGBDRN COc1cc(CN[C@@H](C)c2nncn2C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000264229780 1434084696 /nfs/dbraw/zinc/08/46/96/1434084696.db2.gz ABSNAFVPXGPNFW-AWEZNQCLSA-N 0 0 397.435 3.162 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](OC)c2ccccc2)cc1SC ZINC000264232438 1434085316 /nfs/dbraw/zinc/08/53/16/1434085316.db2.gz YGSGQGJVINSKEX-MRXNPFEDSA-N 0 0 376.434 3.443 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)c1[N+](=O)[O-] ZINC000264235031 1434085815 /nfs/dbraw/zinc/08/58/15/1434085815.db2.gz 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COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000264312624 1434095805 /nfs/dbraw/zinc/09/58/05/1434095805.db2.gz ZESYRCLXFKLWAK-UHFFFAOYSA-N 0 0 394.428 3.124 20 5 GGBDRN C[C@H](NC(=O)N(C)Cc1nccn1CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000264335358 1434098611 /nfs/dbraw/zinc/09/86/11/1434098611.db2.gz YEQWHXUXKPBWTM-NSHDSACASA-N 0 0 385.346 3.256 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)s1 ZINC000264372433 1434104146 /nfs/dbraw/zinc/10/41/46/1434104146.db2.gz BCKWOYKUGXVQLG-NWDGAFQWSA-N 0 0 390.465 3.006 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccccc1NC(=O)C[C@H]1C=CCC1 ZINC000264387495 1434105632 /nfs/dbraw/zinc/10/56/32/1434105632.db2.gz PDYNSIDXKNQWOQ-AWEZNQCLSA-N 0 0 383.408 3.033 20 5 GGBDRN Cc1noc(C)c1CCNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000264400174 1434107888 /nfs/dbraw/zinc/10/78/88/1434107888.db2.gz SMXYYLUIAUATQU-UHFFFAOYSA-N 0 0 386.452 3.408 20 5 GGBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000264411408 1434108933 /nfs/dbraw/zinc/10/89/33/1434108933.db2.gz HKNUILURJLWTCH-LBPRGKRZSA-N 0 0 390.465 3.008 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)s1 ZINC000264441789 1434113144 /nfs/dbraw/zinc/11/31/44/1434113144.db2.gz QZDQAKKQJMPQSU-SNVBAGLBSA-N 0 0 392.437 3.028 20 5 GGBDRN Cc1cc(C)cc([C@@H](C)NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000264443885 1434113466 /nfs/dbraw/zinc/11/34/66/1434113466.db2.gz CLKQWYOTNCDWKR-CYBMUJFWSA-N 0 0 389.839 3.472 20 5 GGBDRN CC[C@H](CNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000264447086 1434114036 /nfs/dbraw/zinc/11/40/36/1434114036.db2.gz CXMUZLJFKDODBP-CYBMUJFWSA-N 0 0 389.839 3.288 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N[C@@H](c1ccccc1)C1CC1 ZINC000264460044 1434115790 /nfs/dbraw/zinc/11/57/90/1434115790.db2.gz GLJBSRCYHDDJGH-SFHVURJKSA-N 0 0 387.823 3.246 20 5 GGBDRN CCN1C(=S)N=NC1[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000264464686 1434116298 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GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000264686433 1434144048 /nfs/dbraw/zinc/14/40/48/1434144048.db2.gz RJSZAPKSNGUDRV-STQMWFEESA-N 0 0 387.440 3.136 20 5 GGBDRN COc1cccc(N2CC[C@@H](NC(=O)c3c(Cl)cccc3[N+](=O)[O-])C2)c1 ZINC000264699815 1434145455 /nfs/dbraw/zinc/14/54/55/1434145455.db2.gz PSOAUWCQKGJDPP-GFCCVEGCSA-N 0 0 375.812 3.266 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000264698022 1434145565 /nfs/dbraw/zinc/14/55/65/1434145565.db2.gz DLCWVIWHTYPVHY-HZPDHXFCSA-N 0 0 388.445 3.064 20 5 GGBDRN Cc1nc(CN2CCC(CNC(=O)c3cccc([N+](=O)[O-])c3C)CC2)oc1C ZINC000264708611 1434146678 /nfs/dbraw/zinc/14/66/78/1434146678.db2.gz FJKGQJNFXQHHLK-UHFFFAOYSA-N 0 0 386.452 3.150 20 5 GGBDRN Cc1nc(CN2CCC(CNc3ccc([N+](=O)[O-])c4nonc43)CC2)oc1C ZINC000264712686 1434147268 /nfs/dbraw/zinc/14/72/68/1434147268.db2.gz GNDVJODUHQURCS-UHFFFAOYSA-N 0 0 386.412 3.060 20 5 GGBDRN 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0 0 393.852 3.344 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000267409580 1434430247 /nfs/dbraw/zinc/43/02/47/1434430247.db2.gz OXAHIEJAFSHOKD-KRWDZBQOSA-N 0 0 394.493 3.264 20 5 GGBDRN CC(C)(C(=O)N1CCC(OC[C@H]2CCCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000267432025 1434432211 /nfs/dbraw/zinc/43/22/11/1434432211.db2.gz VMGXIGXLPJUSSD-LJQANCHMSA-N 0 0 390.480 3.449 20 5 GGBDRN Cc1c(NC(=O)N2CC[C@@H](N(C)C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000267458642 1434435776 /nfs/dbraw/zinc/43/57/76/1434435776.db2.gz PIUFESUTNQAGMS-CYBMUJFWSA-N 0 0 378.429 3.376 20 5 GGBDRN COCCCOc1cccc(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000267502843 1434441652 /nfs/dbraw/zinc/44/16/52/1434441652.db2.gz VALDKGLSUTYXJS-UHFFFAOYSA-N 0 0 390.392 3.036 20 5 GGBDRN O=C(NC[C@H](c1ccccc1)N1CCOCC1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000267504574 1434441820 /nfs/dbraw/zinc/44/18/20/1434441820.db2.gz ZVDSAGOZDRHYKC-QGZVFWFLSA-N 0 0 389.839 3.052 20 5 GGBDRN COCCCOc1cccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000267503903 1434441959 /nfs/dbraw/zinc/44/19/59/1434441959.db2.gz VPRRUHOOAMBIDO-UHFFFAOYSA-N 0 0 390.392 3.280 20 5 GGBDRN CC(C)NC(=O)c1ccc(N(C)Cc2nccn2CC(F)(F)F)c([N+](=O)[O-])c1 ZINC000267522300 1434443092 /nfs/dbraw/zinc/44/30/92/1434443092.db2.gz GTEDTQJGYYPYKE-UHFFFAOYSA-N 0 0 399.373 3.128 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000267528442 1434443965 /nfs/dbraw/zinc/44/39/65/1434443965.db2.gz PCIAGSOUUWJTQV-HNNXBMFYSA-N 0 0 382.844 3.439 20 5 GGBDRN CNC(=O)c1ccc(N2CCC[C@H]2C[C@H](O)c2cccs2)c([N+](=O)[O-])c1 ZINC000267534287 1434444040 /nfs/dbraw/zinc/44/40/40/1434444040.db2.gz XIPIZNLEQGNFDU-BBRMVZONSA-N 0 0 375.450 3.108 20 5 GGBDRN CNC(=O)c1ccc(N2CCC[C@@H]2C[C@H](O)c2cccs2)c([N+](=O)[O-])c1 ZINC000267534290 1434444166 /nfs/dbraw/zinc/44/41/66/1434444166.db2.gz XIPIZNLEQGNFDU-CJNGLKHVSA-N 0 0 375.450 3.108 20 5 GGBDRN CN(Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1N1CCOCC1 ZINC000267563258 1434446038 /nfs/dbraw/zinc/44/60/38/1434446038.db2.gz HSEGHZWFWQENLW-UHFFFAOYSA-N 0 0 382.420 3.205 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000267600272 1434448751 /nfs/dbraw/zinc/44/87/51/1434448751.db2.gz IZVJWMPWHCPFJT-VCQIMIBNSA-N 0 0 392.399 3.423 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000267600266 1434448774 /nfs/dbraw/zinc/44/87/74/1434448774.db2.gz IZVJWMPWHCPFJT-DPCRMLNESA-N 0 0 392.399 3.423 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc([N+](=O)[O-])c1OC ZINC000267630246 1434451431 /nfs/dbraw/zinc/45/14/31/1434451431.db2.gz GQGSNNLKPKMGPV-LLVKDONJSA-N 0 0 389.364 3.320 20 5 GGBDRN CC(C)(C)OC(=O)NCC1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000267642103 1434452379 /nfs/dbraw/zinc/45/23/79/1434452379.db2.gz VVLWNIYHFWHKMH-UHFFFAOYSA-N 0 0 390.440 3.473 20 5 GGBDRN COc1cc(C(=O)N2C[C@H](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000267648842 1434452615 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CZWBSXJRTXJSPC-SNVBAGLBSA-N 0 0 376.438 3.263 20 5 GGBDRN CO[C@H](C)c1nc(CN2CCCN(c3ncc([N+](=O)[O-])cc3C)CC2)cs1 ZINC000267771040 1434462947 /nfs/dbraw/zinc/46/29/47/1434462947.db2.gz LAXXMUYVKPKKSQ-CQSZACIVSA-N 0 0 391.497 3.174 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2cccc(CS(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000267778209 1434463730 /nfs/dbraw/zinc/46/37/30/1434463730.db2.gz UTWFIWJJHLUYJB-ZDUSSCGKSA-N 0 0 391.449 3.331 20 5 GGBDRN CC[C@@H](CNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])Oc1cccc(F)c1 ZINC000267780473 1434463892 /nfs/dbraw/zinc/46/38/92/1434463892.db2.gz ZTKJOLZJRJJGJL-ZDUSSCGKSA-N 0 0 392.383 3.339 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000267782234 1434464254 /nfs/dbraw/zinc/46/42/54/1434464254.db2.gz WEIAECHMHJVFRD-ZDUSSCGKSA-N 0 0 376.434 3.106 20 5 GGBDRN COc1cc(CC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1OC ZINC000267784938 1434464454 /nfs/dbraw/zinc/46/44/54/1434464454.db2.gz WWKMMFWWUQATNE-ZDUSSCGKSA-N 0 0 388.420 3.349 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2cccc(C(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000267790544 1434464928 /nfs/dbraw/zinc/46/49/28/1434464928.db2.gz VAKHFETVZBDSAM-CQSZACIVSA-N 0 0 384.436 3.165 20 5 GGBDRN CO[C@@H](C)c1nc(CN2CCCN(c3ccccc3[N+](=O)[O-])CC2)cs1 ZINC000267807620 1434466650 /nfs/dbraw/zinc/46/66/50/1434466650.db2.gz SCCJRQZRMJNVSG-AWEZNQCLSA-N 0 0 376.482 3.471 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCC[C@H]2[C@@H]2CCCCC2=O)cc([N+](=O)[O-])c1 ZINC000267826371 1434468523 /nfs/dbraw/zinc/46/85/23/1434468523.db2.gz IJAUNOIEJNKDGI-IRXDYDNUSA-N 0 0 388.420 3.135 20 5 GGBDRN CON(C)C(=O)c1ccc(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000267838884 1434469591 /nfs/dbraw/zinc/46/95/91/1434469591.db2.gz ZDOIFENQIJPLFS-CYBMUJFWSA-N 0 0 386.408 3.419 20 5 GGBDRN CNC(=O)c1ccc(N2CCC[C@@H]2c2nc3ccccc3n2C)c([N+](=O)[O-])c1 ZINC000267867452 1434472057 /nfs/dbraw/zinc/47/20/57/1434472057.db2.gz KQBXQMRDBGSSBU-QGZVFWFLSA-N 0 0 379.420 3.183 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCS(=O)(=O)C3(CCCCC3)C2)c2ncccc12 ZINC000267907553 1434475900 /nfs/dbraw/zinc/47/59/00/1434475900.db2.gz YKHRUNJRTMHZGH-UHFFFAOYSA-N 0 0 375.450 3.081 20 5 GGBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1-n1nnnc1C1CC1 ZINC000267916993 1434476858 /nfs/dbraw/zinc/47/68/58/1434476858.db2.gz DJEXUODEDCKBTL-UHFFFAOYSA-N 0 0 394.391 3.017 20 5 GGBDRN Cc1cc(NC(=O)[C@H](C)SCC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)no1 ZINC000267926517 1434477854 /nfs/dbraw/zinc/47/78/54/1434477854.db2.gz UGCISSKQVLFARH-LBPRGKRZSA-N 0 0 392.437 3.207 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O ZINC000267931823 1434478317 /nfs/dbraw/zinc/47/83/17/1434478317.db2.gz FSXWGTAYWUFPFB-INIZCTEOSA-N 0 0 382.420 3.134 20 5 GGBDRN COC(=O)COc1cccc(CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000267933676 1434478491 /nfs/dbraw/zinc/47/84/91/1434478491.db2.gz GBBMYLCIOAJUTQ-UHFFFAOYSA-N 0 0 387.392 3.085 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000267949714 1434480196 /nfs/dbraw/zinc/48/01/96/1434480196.db2.gz BHBBFXPXGZQFOY-QGZVFWFLSA-N 0 0 396.399 3.050 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)Cc1ccc(S(C)(=O)=O)cc1 ZINC000267959012 1434481222 /nfs/dbraw/zinc/48/12/22/1434481222.db2.gz KQGWMSIPOLVDHG-UHFFFAOYSA-N 0 0 391.449 3.279 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H](CO)c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000267989608 1434484548 /nfs/dbraw/zinc/48/45/48/1434484548.db2.gz HHODDJXAFVRGCZ-IAQYHMDHSA-N 0 0 379.363 3.275 20 5 GGBDRN COc1ccc(CNC(=O)N(CCCO)[C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000267996381 1434485395 /nfs/dbraw/zinc/48/53/95/1434485395.db2.gz LSGFGMMTTWFNGX-SFHVURJKSA-N 0 0 399.447 3.185 20 5 GGBDRN CCNC(=O)COc1ccc(NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000267998368 1434485608 /nfs/dbraw/zinc/48/56/08/1434485608.db2.gz SZFJFVMOCIDMSV-UHFFFAOYSA-N 0 0 386.408 3.371 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(F)c(OC)cc2OC)cc1OC ZINC000268061442 1434492021 /nfs/dbraw/zinc/49/20/21/1434492021.db2.gz XLQOUUAGLFFHNR-UHFFFAOYSA-N 0 0 394.355 3.411 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCC[C@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000268062026 1434492083 /nfs/dbraw/zinc/49/20/83/1434492083.db2.gz UAFZYSOYAYQCFC-JKOKRWQUSA-N 0 0 375.347 3.061 20 5 GGBDRN COCCN(Cc1ccccn1)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268090456 1434493881 /nfs/dbraw/zinc/49/38/81/1434493881.db2.gz AYQPXSJURJTEBA-UHFFFAOYSA-N 0 0 378.816 3.001 20 5 GGBDRN Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268098169 1434494432 /nfs/dbraw/zinc/49/44/32/1434494432.db2.gz ACEMVXAKQLJLNO-UHFFFAOYSA-N 0 0 378.816 3.280 20 5 GGBDRN C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000268116862 1434495893 /nfs/dbraw/zinc/49/58/93/1434495893.db2.gz KGTPHXFMPWXLDI-QWHCGFSZSA-N 0 0 395.431 3.499 20 5 GGBDRN CC(C)[C@H](CCO)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000268122308 1434496134 /nfs/dbraw/zinc/49/61/34/1434496134.db2.gz HZHWWPJXXDALSO-HOCLYGCPSA-N 0 0 386.452 3.300 20 5 GGBDRN 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398.387 3.055 20 5 GGBDRN Cc1c(CC(=O)N2CCC(C(=O)Nc3cccc(F)c3)CC2)cccc1[N+](=O)[O-] ZINC000269694339 1434669906 /nfs/dbraw/zinc/66/99/06/1434669906.db2.gz KQGLFQBFTOPQGG-UHFFFAOYSA-N 0 0 399.422 3.462 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000269738831 1434673020 /nfs/dbraw/zinc/67/30/20/1434673020.db2.gz YDBGZEUNDPSTAG-CABCVRRESA-N 0 0 390.415 3.309 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000269739323 1434673084 /nfs/dbraw/zinc/67/30/84/1434673084.db2.gz UYYUPQRLJFHINR-XJKSGUPXSA-N 0 0 391.468 3.207 20 5 GGBDRN CC(C)(C)[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)c1nc(-c2nc[nH]n2)no1 ZINC000269752043 1434673999 /nfs/dbraw/zinc/67/39/99/1434673999.db2.gz VICIEFFRNSSTBJ-VIFPVBQESA-N 0 0 378.780 3.011 20 5 GGBDRN COCCCOc1cccc(CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000269758427 1434674230 /nfs/dbraw/zinc/67/42/30/1434674230.db2.gz WCNBAQAUVNZYCR-UHFFFAOYSA-N 0 0 394.449 3.026 20 5 GGBDRN 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ZINC000269992733 1434692036 /nfs/dbraw/zinc/69/20/36/1434692036.db2.gz GYKJVLDDTAFMIY-UHFFFAOYSA-N 0 0 395.462 3.029 20 5 GGBDRN CCOc1cc(NC(=O)N(C)C[C@H]2CCC[C@H]2O)c([N+](=O)[O-])cc1OCC ZINC000269995353 1434692335 /nfs/dbraw/zinc/69/23/35/1434692335.db2.gz SRTBHWMZLNWRCA-IUODEOHRSA-N 0 0 381.429 3.017 20 5 GGBDRN CCOC(=O)C1CCN(C(=O)[C@@H](C)SCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000270013417 1434693345 /nfs/dbraw/zinc/69/33/45/1434693345.db2.gz MMUAWCWSTBAXEM-CYBMUJFWSA-N 0 0 380.466 3.018 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1N1CCOC1=O)c1ccc([S@](C)=O)cc1 ZINC000270017215 1434693614 /nfs/dbraw/zinc/69/36/14/1434693614.db2.gz CNOFFDRVGWZGBJ-MUDIAHQHSA-N 0 0 389.433 3.462 20 5 GGBDRN Cc1nc2ccccc2n1C[C@@H]1CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000270057969 1434697717 /nfs/dbraw/zinc/69/77/17/1434697717.db2.gz OBVKAXKBOXTNPB-HNNXBMFYSA-N 0 0 379.420 3.021 20 5 GGBDRN CC[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000270085513 1434701094 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391.468 3.291 20 5 GGBDRN C[C@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1cccc(N2CCOC2=O)c1 ZINC000270299651 1434720845 /nfs/dbraw/zinc/72/08/45/1434720845.db2.gz RKRBIALEJRBPFA-AWEZNQCLSA-N 0 0 398.419 3.154 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CN(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000270307473 1434721809 /nfs/dbraw/zinc/72/18/09/1434721809.db2.gz QBHVXXIVEZBRIE-UHFFFAOYSA-N 0 0 384.436 3.034 20 5 GGBDRN C[C@@](O)(CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O)c1ccc(F)cc1 ZINC000270333653 1434724188 /nfs/dbraw/zinc/72/41/88/1434724188.db2.gz XVGFLPFXMQRVLM-GOSISDBHSA-N 0 0 375.356 3.010 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@@H]1[C@@H](O)C(F)(F)F ZINC000270370687 1434727463 /nfs/dbraw/zinc/72/74/63/1434727463.db2.gz DAGDMDVIUIPASS-GHMZBOCLSA-N 0 0 386.248 3.141 20 5 GGBDRN CCOCCCNC(=O)[C@@H](C)SCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000270435205 1434732958 /nfs/dbraw/zinc/73/29/58/1434732958.db2.gz CTJIQMFIWQYIHU-CYBMUJFWSA-N 0 0 393.465 3.414 20 5 GGBDRN 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ZINC000270687972 1434762240 /nfs/dbraw/zinc/76/22/40/1434762240.db2.gz VEWZNIYYTPXUAK-MRXNPFEDSA-N 0 0 389.452 3.248 20 5 GGBDRN Cc1nn(CC(F)(F)F)cc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270706663 1434764426 /nfs/dbraw/zinc/76/44/26/1434764426.db2.gz NFGYHSBASWODCR-UHFFFAOYSA-N 0 0 382.342 3.467 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C1CCCCC1 ZINC000270709371 1434764865 /nfs/dbraw/zinc/76/48/65/1434764865.db2.gz OFZYXWNMTZFWQA-INIZCTEOSA-N 0 0 382.482 3.004 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCc2c1cccc2O ZINC000270718847 1434766140 /nfs/dbraw/zinc/76/61/40/1434766140.db2.gz QLLQKTZGZPJVCD-MRXNPFEDSA-N 0 0 388.445 3.456 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCOC2(CCC2)C1 ZINC000270720085 1434766291 /nfs/dbraw/zinc/76/62/91/1434766291.db2.gz KHVPLWNLWGSTKL-CYBMUJFWSA-N 0 0 380.466 3.165 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCC(=O)OC(C)(C)C ZINC000270726639 1434767128 /nfs/dbraw/zinc/76/71/28/1434767128.db2.gz 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ZINC000271266408 1434811997 /nfs/dbraw/zinc/81/19/97/1434811997.db2.gz LMPMNAJYQPXUOO-UHFFFAOYSA-N 0 0 378.425 3.234 20 5 GGBDRN CCn1c(CCNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])nc2ccccc21 ZINC000271283654 1434812947 /nfs/dbraw/zinc/81/29/47/1434812947.db2.gz OITQPKDIORMEBP-UHFFFAOYSA-N 0 0 394.478 3.084 20 5 GGBDRN CN(CCC1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1)C(=O)OC(C)(C)C ZINC000271292374 1434813654 /nfs/dbraw/zinc/81/36/54/1434813654.db2.gz PPJUYPSHMCETBR-UHFFFAOYSA-N 0 0 381.429 3.297 20 5 GGBDRN C[C@@H]1CCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC12CCC2 ZINC000271311178 1434814971 /nfs/dbraw/zinc/81/49/71/1434814971.db2.gz ISLHTSTXYUGTJI-CQSZACIVSA-N 0 0 387.436 3.322 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)c1 ZINC000271328086 1434816586 /nfs/dbraw/zinc/81/65/86/1434816586.db2.gz VHZLXHKAAWTHSU-UHFFFAOYSA-N 0 0 378.425 3.234 20 5 GGBDRN C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(N[C@H]3CCO[C@H](C)C3)c2[N+](=O)[O-])CCO1 ZINC000271339971 1434817369 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NQOMBLBKNRQHNS-KKSFZXQISA-N 0 0 378.472 3.475 20 5 GGBDRN CCOC(=O)c1cc(N2CCC[C@@H](c3nncn3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000271637044 1434840992 /nfs/dbraw/zinc/84/09/92/1434840992.db2.gz OVSCHZCIXQAICI-CQSZACIVSA-N 0 0 387.440 3.328 20 5 GGBDRN O=C(c1cc(NCc2nncn2-c2ccccc2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000271644005 1434841407 /nfs/dbraw/zinc/84/14/07/1434841407.db2.gz QLFDXIHBAHYQJL-UHFFFAOYSA-N 0 0 392.419 3.024 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(N2CCC[C@H](c3nc(C)no3)C2)cc1Cl ZINC000271655700 1434842283 /nfs/dbraw/zinc/84/22/83/1434842283.db2.gz TWPAZOFPAMNFEN-JTQLQIEISA-N 0 0 380.788 3.110 20 5 GGBDRN CCOC(=O)c1cc(N2CCC(c3nncn3C3CC3)CC2)ccc1[N+](=O)[O-] ZINC000271662828 1434842737 /nfs/dbraw/zinc/84/27/37/1434842737.db2.gz VHSNEPSTPXNPRI-UHFFFAOYSA-N 0 0 385.424 3.082 20 5 GGBDRN CC(C)NC(=O)c1ccc(N2CCC(c3nncn3C3CC3)CC2)c([N+](=O)[O-])c1 ZINC000271674103 1434843435 /nfs/dbraw/zinc/84/34/35/1434843435.db2.gz XPQSRJAPTLUCBS-UHFFFAOYSA-N 0 0 398.467 3.043 20 5 GGBDRN CC[C@H](NC(=O)N1CCC(O)(C(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271753004 1434848063 /nfs/dbraw/zinc/84/80/63/1434848063.db2.gz GESXLSMXSOGYPK-ZDUSSCGKSA-N 0 0 375.347 3.145 20 5 GGBDRN C[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N(C)C)c1 ZINC000271777654 1434849907 /nfs/dbraw/zinc/84/99/07/1434849907.db2.gz FIEHUTIGHRJANX-GFCCVEGCSA-N 0 0 397.884 3.349 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(S(C)(=O)=O)ccc2OC(C)C)cc1[N+](=O)[O-] ZINC000271782350 1434850271 /nfs/dbraw/zinc/85/02/71/1434850271.db2.gz ZKFSDCTULTXERL-UHFFFAOYSA-N 0 0 392.433 3.346 20 5 GGBDRN COC1(C)CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)CC1 ZINC000271804523 1434851694 /nfs/dbraw/zinc/85/16/94/1434851694.db2.gz XEOZNKAZOXHNKR-UHFFFAOYSA-N 0 0 375.469 3.472 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC(O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000271816127 1434852457 /nfs/dbraw/zinc/85/24/57/1434852457.db2.gz RRMAULCUVNYDMW-LLVKDONJSA-N 0 0 375.347 3.063 20 5 GGBDRN CCC(=O)Nc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000271835322 1434853821 /nfs/dbraw/zinc/85/38/21/1434853821.db2.gz FOKHKMGVMWWAFE-UHFFFAOYSA-N 0 0 398.419 3.032 20 5 GGBDRN CCCOc1cc(NC(=O)COCCCOC)c([N+](=O)[O-])cc1OCCC ZINC000271868273 1434856012 /nfs/dbraw/zinc/85/60/12/1434856012.db2.gz WXLLGCSJTPPBNV-UHFFFAOYSA-N 0 0 384.429 3.164 20 5 GGBDRN CNC(=O)c1ccc(N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000271873297 1434856175 /nfs/dbraw/zinc/85/61/75/1434856175.db2.gz SPAHCVHTCQZUJK-NVXWUHKLSA-N 0 0 377.347 3.175 20 5 GGBDRN C[C@H](CCO)C1(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCC1 ZINC000271890954 1434857506 /nfs/dbraw/zinc/85/75/06/1434857506.db2.gz OMGSISSWFTVTEG-MRXNPFEDSA-N 0 0 389.496 3.116 20 5 GGBDRN CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000271891445 1434857531 /nfs/dbraw/zinc/85/75/31/1434857531.db2.gz IFBNGRWURXHUPT-ADLMAVQZSA-N 0 0 390.367 3.011 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000271923328 1434859527 /nfs/dbraw/zinc/85/95/27/1434859527.db2.gz FOIMDUKMOWQPOR-UHFFFAOYSA-N 0 0 380.422 3.018 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000271940288 1434860710 /nfs/dbraw/zinc/86/07/10/1434860710.db2.gz ROGWPDNCHMZGBW-YJBOKZPZSA-N 0 0 396.321 3.037 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000271940283 1434860747 /nfs/dbraw/zinc/86/07/47/1434860747.db2.gz ROGWPDNCHMZGBW-QAPCUYQASA-N 0 0 396.321 3.037 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000271955014 1434861667 /nfs/dbraw/zinc/86/16/67/1434861667.db2.gz DYOXGDRLFJGUNR-GFCCVEGCSA-N 0 0 377.832 3.103 20 5 GGBDRN CC[C@@H](C)Oc1cc(CNC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])ccn1 ZINC000271977957 1434863129 /nfs/dbraw/zinc/86/31/29/1434863129.db2.gz LLNUEHLHAQHCMW-GFCCVEGCSA-N 0 0 389.408 3.114 20 5 GGBDRN C[C@H](CN(C)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccccc1 ZINC000272042204 1434868299 /nfs/dbraw/zinc/86/82/99/1434868299.db2.gz YFFUWPBSQXEEJB-MRXNPFEDSA-N 0 0 383.448 3.307 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)CCO1 ZINC000272086291 1434871138 /nfs/dbraw/zinc/87/11/38/1434871138.db2.gz CCBUSVIHTJQJSB-GDBMZVCRSA-N 0 0 380.441 3.326 20 5 GGBDRN Cc1cc(C2CCN(C(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)CC2)[nH]n1 ZINC000272097012 1434871867 /nfs/dbraw/zinc/87/18/67/1434871867.db2.gz LYYRWQQKDYMTLG-UHFFFAOYSA-N 0 0 397.479 3.249 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000272109066 1434872759 /nfs/dbraw/zinc/87/27/59/1434872759.db2.gz NZFXGOHTPKEBSS-UHFFFAOYSA-N 0 0 391.374 3.367 20 5 GGBDRN COc1cc(CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC ZINC000272131258 1434873979 /nfs/dbraw/zinc/87/39/79/1434873979.db2.gz WNKLKLUXDPRSSK-UHFFFAOYSA-N 0 0 396.346 3.029 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000272147055 1434874850 /nfs/dbraw/zinc/87/48/50/1434874850.db2.gz CONBXGGBSONBCW-HIFRSBDPSA-N 0 0 392.456 3.040 20 5 GGBDRN O=C(N1CCC(OC[C@H]2CCCCO2)CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272148872 1434874948 /nfs/dbraw/zinc/87/49/48/1434874948.db2.gz CAFVMBJCRKKLQQ-QGZVFWFLSA-N 0 0 398.406 3.263 20 5 GGBDRN CCOC(OCC)c1nnc(SCc2cc([N+](=O)[O-])ccc2OC)n1C ZINC000272155047 1434875397 /nfs/dbraw/zinc/87/53/97/1434875397.db2.gz AEQWQIDWDJAIGD-UHFFFAOYSA-N 0 0 382.442 3.096 20 5 GGBDRN O=C(CCCNC(=O)c1ccsc1)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272194462 1434877260 /nfs/dbraw/zinc/87/72/60/1434877260.db2.gz WMYPHHGRNMZEIS-UHFFFAOYSA-N 0 0 395.868 3.179 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(N2CCOCC2)cc1 ZINC000272217129 1434878679 /nfs/dbraw/zinc/87/86/79/1434878679.db2.gz DESSCKWCRQDQLQ-UHFFFAOYSA-N 0 0 389.839 3.057 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000272222974 1434879302 /nfs/dbraw/zinc/87/93/02/1434879302.db2.gz AGCWDQKJCXLNMM-OLZOCXBDSA-N 0 0 390.440 3.471 20 5 GGBDRN COc1cc([C@H]2NC(=O)c3c(C)cccc3N2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272224467 1434879310 /nfs/dbraw/zinc/87/93/10/1434879310.db2.gz QFUOUMWULFVDFJ-QGZVFWFLSA-N 0 0 393.346 3.410 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000272243013 1434881023 /nfs/dbraw/zinc/88/10/23/1434881023.db2.gz KZZHFBVJWDIFGQ-WDEREUQCSA-N 0 0 381.458 3.044 20 5 GGBDRN COc1cc(CNc2ccc(C)c(C(N)=O)c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272252828 1434881789 /nfs/dbraw/zinc/88/17/89/1434881789.db2.gz CFYZYWHTERTTBY-UHFFFAOYSA-N 0 0 395.362 3.267 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272262515 1434882422 /nfs/dbraw/zinc/88/24/22/1434882422.db2.gz BHVWGGNOUVHBRQ-JTQLQIEISA-N 0 0 380.832 3.326 20 5 GGBDRN O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272268455 1434882814 /nfs/dbraw/zinc/88/28/14/1434882814.db2.gz NKKVNWOVCOZANO-ZDUSSCGKSA-N 0 0 379.319 3.104 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)cccc1[N+](=O)[O-] ZINC000272265671 1434882822 /nfs/dbraw/zinc/88/28/22/1434882822.db2.gz REDVSLPGFXZRQD-CQSZACIVSA-N 0 0 398.467 3.363 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000272275873 1434883390 /nfs/dbraw/zinc/88/33/90/1434883390.db2.gz MCOUTSKNGPKPDH-ZIAGYGMSSA-N 0 0 377.441 3.279 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 ZINC000272282985 1434884002 /nfs/dbraw/zinc/88/40/02/1434884002.db2.gz NBUOXRRWKBPYSL-QWRGUYRKSA-N 0 0 399.394 3.248 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(OC(C)(C)C)nc2)c([N+](=O)[O-])cc1OC ZINC000272282889 1434884042 /nfs/dbraw/zinc/88/40/42/1434884042.db2.gz MYZCAZMLQBKACS-UHFFFAOYSA-N 0 0 389.408 3.114 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)cc([N+](=O)[O-])c1 ZINC000272281903 1434884051 /nfs/dbraw/zinc/88/40/51/1434884051.db2.gz IOGQPTFMCOOBMX-ZIAGYGMSSA-N 0 0 377.441 3.279 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 ZINC000272282983 1434884076 /nfs/dbraw/zinc/88/40/76/1434884076.db2.gz NBUOXRRWKBPYSL-MNOVXSKESA-N 0 0 399.394 3.248 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1cccs1 ZINC000272287772 1434884440 /nfs/dbraw/zinc/88/44/40/1434884440.db2.gz GTGKJABWWSNAGQ-LBPRGKRZSA-N 0 0 388.401 3.263 20 5 GGBDRN O=C(Nc1cccc(CN2CCCCC2=O)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272290680 1434884811 /nfs/dbraw/zinc/88/48/11/1434884811.db2.gz FQEHYTMDGBNNIG-UHFFFAOYSA-N 0 0 397.387 3.088 20 5 GGBDRN O=C(Nc1ccc(N2CCC(O)CC2)cc1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272291674 1434884838 /nfs/dbraw/zinc/88/48/38/1434884838.db2.gz FSZBJNNGTSBFOB-UHFFFAOYSA-N 0 0 391.374 3.286 20 5 GGBDRN O=[N+]([O-])c1c(N2CCC(n3ccc(C(F)(F)F)n3)CC2)nc2sccn21 ZINC000272296379 1434885202 /nfs/dbraw/zinc/88/52/02/1434885202.db2.gz PYAMANKGSLDECX-UHFFFAOYSA-N 0 0 386.359 3.361 20 5 GGBDRN Cc1ccc(C(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000272334359 1434887892 /nfs/dbraw/zinc/88/78/92/1434887892.db2.gz OIAGMDXOUCJWTH-HIFRSBDPSA-N 0 0 377.441 3.279 20 5 GGBDRN CN(Cc1nccn1C(F)F)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272334223 1434887896 /nfs/dbraw/zinc/88/78/96/1434887896.db2.gz OFODJMXKVHFNKU-UHFFFAOYSA-N 0 0 387.774 3.224 20 5 GGBDRN Cc1ccc(C(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000272334363 1434887979 /nfs/dbraw/zinc/88/79/79/1434887979.db2.gz OIAGMDXOUCJWTH-UKRRQHHQSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000272345304 1434889116 /nfs/dbraw/zinc/88/91/16/1434889116.db2.gz QBMYDRNYDXOEGA-ZFWWWQNUSA-N 0 0 377.441 3.279 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC[C@@H]2CC(=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000272349478 1434889409 /nfs/dbraw/zinc/88/94/09/1434889409.db2.gz YAAVUHHRGMSRPD-OAHLLOKOSA-N 0 0 388.445 3.240 20 5 GGBDRN O=C(Nc1nnc(CC(F)(F)F)s1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272354724 1434889716 /nfs/dbraw/zinc/88/97/16/1434889716.db2.gz RHMMARDMFMPWNQ-UHFFFAOYSA-N 0 0 398.269 3.405 20 5 GGBDRN COCC[C@H](NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000272353656 1434889781 /nfs/dbraw/zinc/88/97/81/1434889781.db2.gz VHAVOIQQFPLACK-ZDUSSCGKSA-N 0 0 378.381 3.021 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000272362282 1434890460 /nfs/dbraw/zinc/89/04/60/1434890460.db2.gz SHIKIDCZRGDXJN-GDBMZVCRSA-N 0 0 391.468 3.207 20 5 GGBDRN CC(C)(C)c1nnc(CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000272404791 1434894258 /nfs/dbraw/zinc/89/42/58/1434894258.db2.gz YLOVIVYJPUVTJW-UHFFFAOYSA-N 0 0 397.888 3.439 20 5 GGBDRN COc1cc(CN(C)C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)ccc1SC ZINC000272420286 1434895086 /nfs/dbraw/zinc/89/50/86/1434895086.db2.gz MNPSDHLIUGRZST-UHFFFAOYSA-N 0 0 390.417 3.326 20 5 GGBDRN COCC[C@@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000272425002 1434895429 /nfs/dbraw/zinc/89/54/29/1434895429.db2.gz FZGVXSYWZDRRDS-MRXNPFEDSA-N 0 0 385.376 3.258 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC[C@@H]1c1ncc[nH]1 ZINC000272443263 1434896555 /nfs/dbraw/zinc/89/65/55/1434896555.db2.gz FDBYQNZCXSVEQK-CQSZACIVSA-N 0 0 377.832 3.451 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@@H](c2ccccc2OC(F)F)C(F)(F)F)c1[N+](=O)[O-] ZINC000272451145 1434897185 /nfs/dbraw/zinc/89/71/85/1434897185.db2.gz POSPPRGMGWCPQK-NSHDSACASA-N 0 0 394.256 3.261 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H](c2ccccc2OC(F)F)C(F)(F)F)c1[N+](=O)[O-] ZINC000272451144 1434897269 /nfs/dbraw/zinc/89/72/69/1434897269.db2.gz POSPPRGMGWCPQK-LLVKDONJSA-N 0 0 394.256 3.261 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCCOc3c(F)cccc32)c([N+](=O)[O-])cc1OC ZINC000272468371 1434898554 /nfs/dbraw/zinc/89/85/54/1434898554.db2.gz FFOCELIDMABDJZ-CQSZACIVSA-N 0 0 390.367 3.395 20 5 GGBDRN Cn1ccnc1[C@@H](NCc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000272477377 1434898969 /nfs/dbraw/zinc/89/89/69/1434898969.db2.gz BKVBFVAOPHCGCZ-FQEVSTJZSA-N 0 0 394.431 3.369 20 5 GGBDRN Cn1ccnc1[C@@H](NCCCCNc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000272484989 1434899646 /nfs/dbraw/zinc/89/96/46/1434899646.db2.gz CUUXFMWOHZDTQL-IBGZPJMESA-N 0 0 380.452 3.295 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272486547 1434899793 /nfs/dbraw/zinc/89/97/93/1434899793.db2.gz DCHVMAMXIGMKID-QUCCMNQESA-N 0 0 380.448 3.174 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000272516798 1434902996 /nfs/dbraw/zinc/90/29/96/1434902996.db2.gz PLPCTAHUBDMCGI-NEPJUHHUSA-N 0 0 381.404 3.109 20 5 GGBDRN COc1cccc(O[C@@H](C)CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272537905 1434905401 /nfs/dbraw/zinc/90/54/01/1434905401.db2.gz OKBZJHKSODAMKZ-MGPUTAFESA-N 0 0 396.447 3.483 20 5 GGBDRN CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000272543608 1434906091 /nfs/dbraw/zinc/90/60/91/1434906091.db2.gz KYTCWGPILIQWKQ-UHFFFAOYSA-N 0 0 384.436 3.074 20 5 GGBDRN CN(c1ccc(NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)cc1)C1CC[NH+](C)CC1 ZINC000272548089 1434906742 /nfs/dbraw/zinc/90/67/42/1434906742.db2.gz KHPKHTYFJQGBRO-UHFFFAOYSA-N 0 0 384.436 3.083 20 5 GGBDRN COc1cccc(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1OC ZINC000272552800 1434907152 /nfs/dbraw/zinc/90/71/52/1434907152.db2.gz RPIMOJOUANNKCX-SFHVURJKSA-N 0 0 382.420 3.225 20 5 GGBDRN COc1ccc(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000272559646 1434907610 /nfs/dbraw/zinc/90/76/10/1434907610.db2.gz SVMJVQVKPYUFQL-IBGZPJMESA-N 0 0 382.420 3.225 20 5 GGBDRN CCOc1ccc(N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1CO ZINC000272565285 1434908329 /nfs/dbraw/zinc/90/83/29/1434908329.db2.gz UUFMOGMZEIIVEQ-LJQANCHMSA-N 0 0 382.420 3.421 20 5 GGBDRN CCOc1ccc(N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1CO ZINC000272565280 1434908363 /nfs/dbraw/zinc/90/83/63/1434908363.db2.gz UUFMOGMZEIIVEQ-IBGZPJMESA-N 0 0 382.420 3.421 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1-c1nc([C@@H]2CN(Cc3ccccc3)CCO2)no1 ZINC000272568310 1434908723 /nfs/dbraw/zinc/90/87/23/1434908723.db2.gz CSZOALSLMJMFGE-KRWDZBQOSA-N 0 0 384.367 3.357 20 5 GGBDRN COCCOc1ccc(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272572111 1434909074 /nfs/dbraw/zinc/90/90/74/1434909074.db2.gz WFINRYGIRFOWIE-FQEVSTJZSA-N 0 0 396.447 3.233 20 5 GGBDRN COc1ccc(COCCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272580505 1434910211 /nfs/dbraw/zinc/91/02/11/1434910211.db2.gz XXYRAGXDOIQQOH-HXUWFJFHSA-N 0 0 396.447 3.233 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@](C)(O)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000272585856 1434910923 /nfs/dbraw/zinc/91/09/23/1434910923.db2.gz ZCRRKQJXCYZQJR-QUCCMNQESA-N 0 0 384.411 3.054 20 5 GGBDRN COc1ccc2c(c1)OC[C@H](N[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000272586756 1434911330 /nfs/dbraw/zinc/91/13/30/1434911330.db2.gz ZEYHNLFJAGEZNN-OXQOHEQNSA-N 0 0 394.431 3.020 20 5 GGBDRN COc1ccc2c(c1)OC[C@H](N[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000272586758 1434911398 /nfs/dbraw/zinc/91/13/98/1434911398.db2.gz ZEYHNLFJAGEZNN-UZLBHIALSA-N 0 0 394.431 3.020 20 5 GGBDRN O=C(c1cc2nsnc2c([N+](=O)[O-])c1)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000272603106 1434913788 /nfs/dbraw/zinc/91/37/88/1434913788.db2.gz VGVZPEMHURPLRD-SFHVURJKSA-N 0 0 398.444 3.185 20 5 GGBDRN O=[N+]([O-])c1cccc(CCc2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)c1 ZINC000272621369 1434916240 /nfs/dbraw/zinc/91/62/40/1434916240.db2.gz IWFAENGVZWDUFO-IBGZPJMESA-N 0 0 394.431 3.337 20 5 GGBDRN COc1ccc(-c2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)cc1[N+](=O)[O-] ZINC000272637273 1434918224 /nfs/dbraw/zinc/91/82/24/1434918224.db2.gz LFJPBBAAGNWFAL-GOSISDBHSA-N 0 0 396.403 3.227 20 5 GGBDRN CN(C[C@@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000272641443 1434918554 /nfs/dbraw/zinc/91/85/54/1434918554.db2.gz CGTJIWSMSOETGF-ZDUSSCGKSA-N 0 0 393.444 3.101 20 5 GGBDRN Cc1c(Cc2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)cccc1[N+](=O)[O-] ZINC000272650130 1434919415 /nfs/dbraw/zinc/91/94/15/1434919415.db2.gz MUIVARKSFSIDPF-LJQANCHMSA-N 0 0 394.431 3.451 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000272652998 1434919833 /nfs/dbraw/zinc/91/98/33/1434919833.db2.gz FOFIEJPMKWIQKN-LBPRGKRZSA-N 0 0 393.444 3.147 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cnc(N2CCCC[C@@H]2C)c(C)c1 ZINC000272665030 1434920935 /nfs/dbraw/zinc/92/09/35/1434920935.db2.gz JFXZHCJRDSPKRW-AWEZNQCLSA-N 0 0 386.456 3.211 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000272673542 1434921598 /nfs/dbraw/zinc/92/15/98/1434921598.db2.gz KQXUOKRGUSOENW-AWEZNQCLSA-N 0 0 385.376 3.353 20 5 GGBDRN CC(C)c1[nH]nc(-c2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)c1[N+](=O)[O-] ZINC000272681263 1434922228 /nfs/dbraw/zinc/92/22/28/1434922228.db2.gz RZGWFAQPLDBXCR-CQSZACIVSA-N 0 0 398.423 3.065 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCCCCCC(=O)OCc1ccccc1 ZINC000272690881 1434923095 /nfs/dbraw/zinc/92/30/95/1434923095.db2.gz ULDSASGQORPXCA-UHFFFAOYSA-N 0 0 385.420 3.211 20 5 GGBDRN COc1ccc(C(=O)C2CCN(C(=O)Nc3ccncc3[N+](=O)[O-])CC2)cc1 ZINC000272712134 1434925165 /nfs/dbraw/zinc/92/51/65/1434925165.db2.gz KWELKPMYUHARKP-UHFFFAOYSA-N 0 0 384.392 3.125 20 5 GGBDRN CC(=O)NC1(c2noc([C@@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)n2)CCCCC1 ZINC000272713586 1434925334 /nfs/dbraw/zinc/92/53/34/1434925334.db2.gz IQPQGTRJBPHLHY-INIZCTEOSA-N 0 0 399.407 3.139 20 5 GGBDRN CC(C)N1CCO[C@@H](c2noc(-c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)C1 ZINC000272717047 1434925625 /nfs/dbraw/zinc/92/56/25/1434925625.db2.gz YVMJNMALLRTPHW-QGZVFWFLSA-N 0 0 387.440 3.027 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCc3c(ncn3-c3ccc(F)cc3)C2)c1 ZINC000272724913 1434926352 /nfs/dbraw/zinc/92/63/52/1434926352.db2.gz JRHDSUHDYWELKB-FQEVSTJZSA-N 0 0 382.395 3.011 20 5 GGBDRN Cc1cc(N2CCC(CC(=O)N(C)C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272738731 1434927099 /nfs/dbraw/zinc/92/70/99/1434927099.db2.gz CMAGVHWZVIFKKH-UHFFFAOYSA-N 0 0 383.452 3.055 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000272752177 1434928122 /nfs/dbraw/zinc/92/81/22/1434928122.db2.gz FAEQAFYXYICSTF-UHFFFAOYSA-N 0 0 378.429 3.196 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000272759992 1434928876 /nfs/dbraw/zinc/92/88/76/1434928876.db2.gz ACKNUNDBPBHLFA-CQSZACIVSA-N 0 0 398.419 3.486 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCCNC(=O)OC(C)(C)C ZINC000272765588 1434929338 /nfs/dbraw/zinc/92/93/38/1434929338.db2.gz PKLWHPALRSEZSK-CYBMUJFWSA-N 0 0 397.497 3.497 20 5 GGBDRN COc1ccc(NC(=O)CCc2c(C)nc3cc(C)nn3c2C)cc1[N+](=O)[O-] ZINC000272773284 1434929953 /nfs/dbraw/zinc/92/99/53/1434929953.db2.gz FUSNCHCZHBQJJD-UHFFFAOYSA-N 0 0 383.408 3.143 20 5 GGBDRN COc1ccc(NC(=O)N(C)CC(=O)Nc2cccc(C)c2C)cc1[N+](=O)[O-] ZINC000272779684 1434930543 /nfs/dbraw/zinc/93/05/43/1434930543.db2.gz DRGPRBYJRPWFBZ-UHFFFAOYSA-N 0 0 386.408 3.323 20 5 GGBDRN C[C@H](NC(=O)NCCCCNC(=O)OC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000272782708 1434930728 /nfs/dbraw/zinc/93/07/28/1434930728.db2.gz RQTFIPLCQWIFCW-ZDUSSCGKSA-N 0 0 380.445 3.260 20 5 GGBDRN C[C@@H](NC(=O)NCCCCNC(=O)OC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000272782702 1434930732 /nfs/dbraw/zinc/93/07/32/1434930732.db2.gz RQTFIPLCQWIFCW-CYBMUJFWSA-N 0 0 380.445 3.260 20 5 GGBDRN COc1ccc(NC(=O)N(Cc2ccco2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000272795844 1434931667 /nfs/dbraw/zinc/93/16/67/1434931667.db2.gz GVZOALLYJCZGAL-HNNXBMFYSA-N 0 0 375.381 3.410 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000272806084 1434932191 /nfs/dbraw/zinc/93/21/91/1434932191.db2.gz MDQYQEJVWGLMQC-ZDUSSCGKSA-N 0 0 389.433 3.298 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC(CCCO)CC1 ZINC000272805699 1434932291 /nfs/dbraw/zinc/93/22/91/1434932291.db2.gz GWRQZMLNDVEPSM-UHFFFAOYSA-N 0 0 375.469 3.210 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H](c2ccccc2C)C(C)C)cc1[N+](=O)[O-] ZINC000272810831 1434932582 /nfs/dbraw/zinc/93/25/82/1434932582.db2.gz BSIMJUFPWSKREL-SFHVURJKSA-N 0 0 385.420 3.364 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272813107 1434932766 /nfs/dbraw/zinc/93/27/66/1434932766.db2.gz JRWWWJLODAZKLA-KBPBESRZSA-N 0 0 392.456 3.152 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272813115 1434932908 /nfs/dbraw/zinc/93/29/08/1434932908.db2.gz JRWWWJLODAZKLA-UONOGXRCSA-N 0 0 392.456 3.152 20 5 GGBDRN O=C(Nc1cccc(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)c1)C1CC1 ZINC000272815225 1434933130 /nfs/dbraw/zinc/93/31/30/1434933130.db2.gz VTUGAPWBWPFZFC-SFHVURJKSA-N 0 0 394.387 3.075 20 5 GGBDRN Cc1ccnc(OC2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)CC2)c1 ZINC000272825313 1434934122 /nfs/dbraw/zinc/93/41/22/1434934122.db2.gz DMTKJCJJKDZVDD-UHFFFAOYSA-N 0 0 380.404 3.463 20 5 GGBDRN COc1cc(C(=O)OCc2ccc([N+](=O)[O-])c(C)c2)cc(NC(C)=O)c1OC ZINC000272839660 1434935142 /nfs/dbraw/zinc/93/51/42/1434935142.db2.gz ZOJQUGLKMVMGOI-UHFFFAOYSA-N 0 0 388.376 3.236 20 5 GGBDRN COc1ccc(NC(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)cc1[N+](=O)[O-] ZINC000272842440 1434935224 /nfs/dbraw/zinc/93/52/24/1434935224.db2.gz OVPHIAUTYFSDLS-SFHVURJKSA-N 0 0 385.420 3.408 20 5 GGBDRN COc1ccc(NC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000272843168 1434935489 /nfs/dbraw/zinc/93/54/89/1434935489.db2.gz UCYCBRJQMZNZGD-AWEZNQCLSA-N 0 0 392.456 3.010 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000272847804 1434935625 /nfs/dbraw/zinc/93/56/25/1434935625.db2.gz UWLLUWVSXAFMSD-OAHLLOKOSA-N 0 0 383.404 3.094 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCCCNC(=O)OC(C)(C)C ZINC000272849057 1434935949 /nfs/dbraw/zinc/93/59/49/1434935949.db2.gz HCZCHULZEHRHIG-UHFFFAOYSA-N 0 0 380.445 3.041 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000272854319 1434936314 /nfs/dbraw/zinc/93/63/14/1434936314.db2.gz IEVSZAUFAHRTTG-GOSISDBHSA-N 0 0 383.404 3.118 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000272858194 1434936493 /nfs/dbraw/zinc/93/64/93/1434936493.db2.gz WWKKTPRKRCWKDC-OCCSQVGLSA-N 0 0 393.415 3.348 20 5 GGBDRN COc1ccc(NC(=O)NCc2ccccc2CN2CCCC2=O)cc1[N+](=O)[O-] ZINC000272870433 1434937405 /nfs/dbraw/zinc/93/74/05/1434937405.db2.gz UNWYEQJPWNDNIC-UHFFFAOYSA-N 0 0 398.419 3.048 20 5 GGBDRN C[C@@H]1COCCN1c1ccc(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000272874694 1434937810 /nfs/dbraw/zinc/93/78/10/1434937810.db2.gz UDIHXFHCQFVJOA-LLVKDONJSA-N 0 0 397.478 3.029 20 5 GGBDRN CC[C@H](C)NC(=O)c1ccc(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000272874630 1434937920 /nfs/dbraw/zinc/93/79/20/1434937920.db2.gz UAYPKOLMPSTELL-JTQLQIEISA-N 0 0 397.478 3.332 20 5 GGBDRN Cc1cc(C2CCN([C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)CC2)n[nH]1 ZINC000272875094 1434938051 /nfs/dbraw/zinc/93/80/51/1434938051.db2.gz BFVAVAQXINSPDF-LBPRGKRZSA-N 0 0 391.859 3.486 20 5 GGBDRN COc1ccc(NC(=O)N(C)CC(=O)Nc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000272889951 1434939016 /nfs/dbraw/zinc/93/90/16/1434939016.db2.gz YHVAHCQUOMESII-UHFFFAOYSA-N 0 0 386.408 3.323 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000272892415 1434939245 /nfs/dbraw/zinc/93/92/45/1434939245.db2.gz ZPBUIHMKHMJFRF-UHFFFAOYSA-N 0 0 394.472 3.208 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N2CCCCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000272907610 1434940176 /nfs/dbraw/zinc/94/01/76/1434940176.db2.gz LDIZLXNDGIVIAY-INIZCTEOSA-N 0 0 398.419 3.081 20 5 GGBDRN CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000272930866 1434942040 /nfs/dbraw/zinc/94/20/40/1434942040.db2.gz NWWPHBDUKRUFEX-HNNXBMFYSA-N 0 0 385.420 3.070 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N(C)[C@@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000272966877 1434945085 /nfs/dbraw/zinc/94/50/85/1434945085.db2.gz SLMIKJVULCRJMH-GOSISDBHSA-N 0 0 385.420 3.398 20 5 GGBDRN COc1cc(CCNC(=O)C[C@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000272983902 1434946820 /nfs/dbraw/zinc/94/68/20/1434946820.db2.gz RUUJCPHQILZTAG-WMLDXEAASA-N 0 0 394.468 3.112 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000272990647 1434947464 /nfs/dbraw/zinc/94/74/64/1434947464.db2.gz SCIYTSCNVBQTKC-GFCCVEGCSA-N 0 0 395.843 3.185 20 5 GGBDRN O=C(NCc1ccc(N2CCOC2=O)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000272995760 1434948109 /nfs/dbraw/zinc/94/81/09/1434948109.db2.gz RNHZUZPVIQSEBV-UHFFFAOYSA-N 0 0 396.403 3.056 20 5 GGBDRN O=C(c1cc2nsnc2c([N+](=O)[O-])c1)N1CC[C@H](COc2ccccc2)C1 ZINC000273041219 1434953893 /nfs/dbraw/zinc/95/38/93/1434953893.db2.gz VILSRATVVGFIGP-LBPRGKRZSA-N 0 0 384.417 3.141 20 5 GGBDRN Cc1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)ccc1N1CCOCC1 ZINC000273040705 1434953903 /nfs/dbraw/zinc/95/39/03/1434953903.db2.gz GDZSBBLVJULOHN-UHFFFAOYSA-N 0 0 380.404 3.473 20 5 GGBDRN COCc1nsc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)n1 ZINC000273048618 1434954878 /nfs/dbraw/zinc/95/48/78/1434954878.db2.gz GAJHDVBZHYBRIX-UHFFFAOYSA-N 0 0 391.453 3.081 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCCC(=O)N2)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000273064984 1434956728 /nfs/dbraw/zinc/95/67/28/1434956728.db2.gz DPSXIWUAYHRPHG-SFHVURJKSA-N 0 0 394.387 3.001 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCC(OC3CCCCC3)CC2)cc1 ZINC000273068792 1434957024 /nfs/dbraw/zinc/95/70/24/1434957024.db2.gz VACSWIBVRKGVAH-UHFFFAOYSA-N 0 0 396.509 3.182 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)CN(C(C)C)CC3)c1 ZINC000273077699 1434958063 /nfs/dbraw/zinc/95/80/63/1434958063.db2.gz XAUMTNQGMMRDGA-UHFFFAOYSA-N 0 0 376.438 3.079 20 5 GGBDRN COc1cc(C(=O)Nc2nc3c(s2)CN(C(C)C)CC3)ccc1[N+](=O)[O-] ZINC000273077713 1434958265 /nfs/dbraw/zinc/95/82/65/1434958265.db2.gz XBKXHYKNIVFBTA-UHFFFAOYSA-N 0 0 376.438 3.079 20 5 GGBDRN O=C1[C@H](Nc2ccc3cc([N+](=O)[O-])ccc3n2)CCCN1Cc1ccccn1 ZINC000273092579 1434959973 /nfs/dbraw/zinc/95/99/73/1434959973.db2.gz CRPCSVDWKPAGAF-GOSISDBHSA-N 0 0 377.404 3.141 20 5 GGBDRN Cc1nn(C)cc1CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000273130949 1434964847 /nfs/dbraw/zinc/96/48/47/1434964847.db2.gz BAZPJHZSLYMIHB-AWEZNQCLSA-N 0 0 394.435 3.135 20 5 GGBDRN Cc1nn(C)cc1CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000273130951 1434964970 /nfs/dbraw/zinc/96/49/70/1434964970.db2.gz BAZPJHZSLYMIHB-CQSZACIVSA-N 0 0 394.435 3.135 20 5 GGBDRN COc1cc(OC(=O)CCNc2ccccc2[N+](=O)[O-])cc(OC)c1OC ZINC000273156011 1434967300 /nfs/dbraw/zinc/96/73/00/1434967300.db2.gz SIHCAGIUHUQDHT-UHFFFAOYSA-N 0 0 376.365 3.028 20 5 GGBDRN COC(=O)C1(CNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])CCCCC1 ZINC000273158283 1434967443 /nfs/dbraw/zinc/96/74/43/1434967443.db2.gz SSMXHWAQMMSKMF-UHFFFAOYSA-N 0 0 396.465 3.179 20 5 GGBDRN CC1([C@H]2CCCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])C2)OCCO1 ZINC000273160900 1434967860 /nfs/dbraw/zinc/96/78/60/1434967860.db2.gz YZVSKCIYWJYXAH-ZDUSSCGKSA-N 0 0 398.843 3.019 20 5 GGBDRN Cc1nc(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])ccc1[C@@H](C)O ZINC000273168047 1434968325 /nfs/dbraw/zinc/96/83/25/1434968325.db2.gz CEQHPEYSXSDBMR-LLVKDONJSA-N 0 0 395.868 3.413 20 5 GGBDRN Cc1nc(C2(NCCC(=O)Nc3cc([N+](=O)[O-])ccc3F)CCCCC2)no1 ZINC000273182758 1434970032 /nfs/dbraw/zinc/97/00/32/1434970032.db2.gz JUTAMCHUVMSADP-UHFFFAOYSA-N 0 0 391.403 3.203 20 5 GGBDRN C[C@H](CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)c1nccs1 ZINC000273191593 1434970989 /nfs/dbraw/zinc/97/09/89/1434970989.db2.gz CXTPVSBLTNIBCJ-GFCCVEGCSA-N 0 0 396.494 3.051 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccnc(O[C@H]2CCOC2)c1 ZINC000273210306 1434972677 /nfs/dbraw/zinc/97/26/77/1434972677.db2.gz GMYLUCGAEHOVIH-LBPRGKRZSA-N 0 0 395.318 3.011 20 5 GGBDRN C[C@@]1(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCO[C@@H]1C1CC1 ZINC000273239060 1434974588 /nfs/dbraw/zinc/97/45/88/1434974588.db2.gz FWDWCNMXSDKBBG-DHIUTWEWSA-N 0 0 376.456 3.229 20 5 GGBDRN CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273257613 1434976147 /nfs/dbraw/zinc/97/61/47/1434976147.db2.gz FFMMHOIJIADBTI-APWZRJJASA-N 0 0 388.395 3.491 20 5 GGBDRN Cc1cc(-c2noc([C@@H](C)NC[C@H](O)c3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000273273724 1434977279 /nfs/dbraw/zinc/97/72/79/1434977279.db2.gz FDVXPJVOZYVCBG-PXAZEXFGSA-N 0 0 386.383 3.477 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273275650 1434977451 /nfs/dbraw/zinc/97/74/51/1434977451.db2.gz KJENZSQSPLTEFO-HKUYNNGSSA-N 0 0 387.411 3.496 20 5 GGBDRN COC[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273291445 1434978595 /nfs/dbraw/zinc/97/85/95/1434978595.db2.gz CLKDDCAVBAAUEJ-HNNXBMFYSA-N 0 0 382.482 3.004 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000273304085 1434979525 /nfs/dbraw/zinc/97/95/25/1434979525.db2.gz CIJWTBRMXMDPTE-CZUORRHYSA-N 0 0 377.347 3.105 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000273304075 1434979534 /nfs/dbraw/zinc/97/95/34/1434979534.db2.gz CIJWTBRMXMDPTE-BBRMVZONSA-N 0 0 377.347 3.105 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](O)CCc2ccccc2)cc1SC ZINC000273314575 1434980091 /nfs/dbraw/zinc/98/00/91/1434980091.db2.gz WEVCTWNPLYXPJY-AWEZNQCLSA-N 0 0 390.461 3.049 20 5 GGBDRN CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273328049 1434981160 /nfs/dbraw/zinc/98/11/60/1434981160.db2.gz SOIJJNLUOYBCJC-QFBILLFUSA-N 0 0 388.395 3.491 20 5 GGBDRN C[C@@]1(CCCO)CCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000273329707 1434981275 /nfs/dbraw/zinc/98/12/75/1434981275.db2.gz NHUONPIGPLJIIQ-SFHVURJKSA-N 0 0 375.450 3.486 20 5 GGBDRN C[C@]1(CCCO)CCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000273329704 1434981296 /nfs/dbraw/zinc/98/12/96/1434981296.db2.gz NHUONPIGPLJIIQ-GOSISDBHSA-N 0 0 375.450 3.486 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273358051 1434983052 /nfs/dbraw/zinc/98/30/52/1434983052.db2.gz DSBWUYUKKVNLRV-UHFFFAOYSA-N 0 0 375.282 3.157 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 ZINC000273376979 1434984341 /nfs/dbraw/zinc/98/43/41/1434984341.db2.gz QPVPJEUQGQGZJU-OAHLLOKOSA-N 0 0 392.437 3.161 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000273384096 1434985133 /nfs/dbraw/zinc/98/51/33/1434985133.db2.gz ZHDXCMDYSFRRGG-KSSFIOAISA-N 0 0 394.424 3.470 20 5 GGBDRN Cc1nnc(CCNC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)[nH]1 ZINC000273385591 1434985408 /nfs/dbraw/zinc/98/54/08/1434985408.db2.gz DGMFXAZFYSCUTN-UHFFFAOYSA-N 0 0 389.481 3.276 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCN(c2ccc(Cl)cn2)CC1 ZINC000273388583 1434985558 /nfs/dbraw/zinc/98/55/58/1434985558.db2.gz JMMBABHJGDCKOI-UHFFFAOYSA-N 0 0 379.779 3.136 20 5 GGBDRN CCn1cnnc1CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273407358 1434986815 /nfs/dbraw/zinc/98/68/15/1434986815.db2.gz SBTSZUJXBWBYPN-UHFFFAOYSA-N 0 0 389.481 3.419 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000273411904 1434987248 /nfs/dbraw/zinc/98/72/48/1434987248.db2.gz PWHVTTPZBWHOFW-DZGCQCFKSA-N 0 0 376.388 3.060 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000273411907 1434987302 /nfs/dbraw/zinc/98/73/02/1434987302.db2.gz PWHVTTPZBWHOFW-HIFRSBDPSA-N 0 0 376.388 3.060 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273431978 1434988397 /nfs/dbraw/zinc/98/83/97/1434988397.db2.gz UYGUOTADCRZAIH-KBXCAEBGSA-N 0 0 392.358 3.288 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000273435203 1434988710 /nfs/dbraw/zinc/98/87/10/1434988710.db2.gz WUDZTKQXFLBQDT-CXAGYDPISA-N 0 0 384.367 3.260 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000273449893 1434989616 /nfs/dbraw/zinc/98/96/16/1434989616.db2.gz XAOXTDZXUMIFAE-RHSMWYFYSA-N 0 0 389.339 3.292 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1cc(F)cc2c1OCOC2 ZINC000273451909 1434989652 /nfs/dbraw/zinc/98/96/52/1434989652.db2.gz GCQSYYHCKSNSJE-UHFFFAOYSA-N 0 0 394.786 3.455 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(NC(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273465051 1434990525 /nfs/dbraw/zinc/99/05/25/1434990525.db2.gz NMVYQEHZPQOTGG-UHFFFAOYSA-N 0 0 382.392 3.255 20 5 GGBDRN CCN1C(=S)N=NC1[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273471104 1434990913 /nfs/dbraw/zinc/99/09/13/1434990913.db2.gz OMHKFZXBGYEKCT-JTQLQIEISA-N 0 0 394.432 3.046 20 5 GGBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000273490308 1434991995 /nfs/dbraw/zinc/99/19/95/1434991995.db2.gz MGKCURMIAIWIHS-NSHDSACASA-N 0 0 386.376 3.377 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCCC[C@H]1c1nnc2n1CCCC2 ZINC000273492157 1434992007 /nfs/dbraw/zinc/99/20/07/1434992007.db2.gz STPPHYOSFOZWBA-HNNXBMFYSA-N 0 0 388.403 3.421 20 5 GGBDRN O=C(CNc1ccccc1[C@H](O)C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000273498723 1434992526 /nfs/dbraw/zinc/99/25/26/1434992526.db2.gz OXIUZDOHMZWDPH-KRWDZBQOSA-N 0 0 395.337 3.192 20 5 GGBDRN COc1ccc(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2F)c(OC)c1OC ZINC000273512175 1434993796 /nfs/dbraw/zinc/99/37/96/1434993796.db2.gz XATIOHKSPNOYGW-UHFFFAOYSA-N 0 0 393.371 3.124 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@]12CCCO2 ZINC000273513981 1434993919 /nfs/dbraw/zinc/99/39/19/1434993919.db2.gz CWYXHRSCGHTSHC-SQWLQELKSA-N 0 0 388.342 3.070 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273532534 1434994895 /nfs/dbraw/zinc/99/48/95/1434994895.db2.gz RDLUMPQHGJMEIA-ZFWWWQNUSA-N 0 0 398.387 3.072 20 5 GGBDRN CN([C@H]1CCO[C@@H](c2ccc(F)cc2)C1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000273540298 1434995467 /nfs/dbraw/zinc/99/54/67/1434995467.db2.gz SZDUAWJLCPTGCY-DOTOQJQBSA-N 0 0 394.424 3.275 20 5 GGBDRN CC(C)C[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000273576659 1434997784 /nfs/dbraw/zinc/99/77/84/1434997784.db2.gz OWSKCZFXQLDIPF-SFHVURJKSA-N 0 0 377.466 3.141 20 5 GGBDRN O=C(NC1CCC(O)(c2ccccc2)CC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000273598282 1434999060 /nfs/dbraw/zinc/99/90/60/1434999060.db2.gz FCSMSAHMFCVSMD-UHFFFAOYSA-N 0 0 385.376 3.063 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(Cc2ccc(OC(F)(F)F)cc2)no1 ZINC000273668129 1435003693 /nfs/dbraw/zinc/00/36/93/1435003693.db2.gz GPHNKMXDAUGIIA-UHFFFAOYSA-N 0 0 383.286 3.020 20 5 GGBDRN CC(C)(C)OC(=O)NCCc1noc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000273666909 1435003703 /nfs/dbraw/zinc/00/37/03/1435003703.db2.gz GMUINWCUCKSGTI-UHFFFAOYSA-N 0 0 387.396 3.117 20 5 GGBDRN O=C(Nc1ccc(F)c(Cl)c1)C1CCN(c2ncc([N+](=O)[O-])cn2)CC1 ZINC000273676561 1435004393 /nfs/dbraw/zinc/00/43/93/1435004393.db2.gz YLFWDBAAGYRKFZ-UHFFFAOYSA-N 0 0 379.779 3.032 20 5 GGBDRN Cc1nnc([C@H](C)NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000273724613 1435008089 /nfs/dbraw/zinc/00/80/89/1435008089.db2.gz RZFYCOXFPQNMPV-NSHDSACASA-N 0 0 391.453 3.069 20 5 GGBDRN CCOCc1ccc(-c2noc(CCNC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000273724472 1435008156 /nfs/dbraw/zinc/00/81/56/1435008156.db2.gz JYJOYRRYRATVGQ-UHFFFAOYSA-N 0 0 396.403 3.154 20 5 GGBDRN CCOc1c(Cl)cc(-c2noc(-c3c([N+](=O)[O-])c(C)nn3C)n2)cc1OC ZINC000273730018 1435008761 /nfs/dbraw/zinc/00/87/61/1435008761.db2.gz NKQCTVVAKAGPIN-UHFFFAOYSA-N 0 0 393.787 3.414 20 5 GGBDRN O=C1C[C@@H](c2noc(CCNc3ccccc3[N+](=O)[O-])n2)CN1c1ccccc1 ZINC000273749461 1435010493 /nfs/dbraw/zinc/01/04/93/1435010493.db2.gz AFBHXXLFUZZTBW-CQSZACIVSA-N 0 0 393.403 3.153 20 5 GGBDRN CC(C)(C)OC(=O)NCC(C)(C)c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000273775034 1435012950 /nfs/dbraw/zinc/01/29/50/1435012950.db2.gz YFTAWMXDXSNOKW-UHFFFAOYSA-N 0 0 377.401 3.029 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1noc(C[C@H]2OCCc3ccccc32)n1 ZINC000273775690 1435013209 /nfs/dbraw/zinc/01/32/09/1435013209.db2.gz FKUCJGYRLNDRNQ-GOSISDBHSA-N 0 0 380.404 3.489 20 5 GGBDRN O=c1ccn(Cc2nc(-c3ccccc3OCC3CCCC3)no2)cc1[N+](=O)[O-] ZINC000273793457 1435014897 /nfs/dbraw/zinc/01/48/97/1435014897.db2.gz BAHOHXKIZXVYST-UHFFFAOYSA-N 0 0 396.403 3.424 20 5 GGBDRN Cc1nn(C)c(-c2nc(-c3ccc(COCC(F)(F)F)cc3)no2)c1[N+](=O)[O-] ZINC000273792894 1435014901 /nfs/dbraw/zinc/01/49/01/1435014901.db2.gz VFRZLDVCUYNLRK-UHFFFAOYSA-N 0 0 397.313 3.433 20 5 GGBDRN CC(C)(C(=O)NCCc1nc2cc(F)ccc2[nH]1)c1ccc([N+](=O)[O-])cc1F ZINC000273806030 1435016192 /nfs/dbraw/zinc/01/61/92/1435016192.db2.gz BZLZWKVAMHEOEL-UHFFFAOYSA-N 0 0 388.374 3.386 20 5 GGBDRN Cc1cccc(Cc2noc(CCCn3c4ccc([N+](=O)[O-])cc4oc3=O)n2)c1 ZINC000273806266 1435016401 /nfs/dbraw/zinc/01/64/01/1435016401.db2.gz YWCWICNYGPJHHY-UHFFFAOYSA-N 0 0 394.387 3.418 20 5 GGBDRN CC(C)(C(=O)NCc1ccnc(N2CCCC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000273820638 1435018038 /nfs/dbraw/zinc/01/80/38/1435018038.db2.gz CNTBAAXZYNAONF-UHFFFAOYSA-N 0 0 386.427 3.323 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc([C@H]2CN(C3CC3)CCO2)no1 ZINC000273825134 1435018563 /nfs/dbraw/zinc/01/85/63/1435018563.db2.gz JHUBMBGTISUFMJ-IAQYHMDHSA-N 0 0 376.438 3.367 20 5 GGBDRN COc1ccc(-c2nc(-c3ccc(CN4CCCC4=O)cc3)no2)cc1[N+](=O)[O-] ZINC000273827444 1435018740 /nfs/dbraw/zinc/01/87/40/1435018740.db2.gz JLPCQKDRSNWYAW-UHFFFAOYSA-N 0 0 394.387 3.443 20 5 GGBDRN CCOc1cccc(N2CCC(NC(=O)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000273827423 1435018785 /nfs/dbraw/zinc/01/87/85/1435018785.db2.gz FFSXGARJSXLMJO-UHFFFAOYSA-N 0 0 375.450 3.454 20 5 GGBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@H](O)c1cccc(F)c1 ZINC000273831070 1435019176 /nfs/dbraw/zinc/01/91/76/1435019176.db2.gz HHQMIBUDBZQPEK-GTNSWQLSSA-N 0 0 378.375 3.389 20 5 GGBDRN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@H](O)c1cccc(F)c1 ZINC000273831069 1435019188 /nfs/dbraw/zinc/01/91/88/1435019188.db2.gz HHQMIBUDBZQPEK-DIFFPNOSSA-N 0 0 378.375 3.389 20 5 GGBDRN Cc1ccc(CCC(=O)NCc2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)cc1 ZINC000273833493 1435019466 /nfs/dbraw/zinc/01/94/66/1435019466.db2.gz DRGPUPNYQVSWNZ-UHFFFAOYSA-N 0 0 394.431 3.434 20 5 GGBDRN CC(C)(C(=O)N[C@H]1CCO[C@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273835805 1435019766 /nfs/dbraw/zinc/01/97/66/1435019766.db2.gz FLUZKFFAPZPACE-KPZWWZAWSA-N 0 0 382.457 3.182 20 5 GGBDRN CC(C)(C(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273835818 1435019775 /nfs/dbraw/zinc/01/97/75/1435019775.db2.gz FLUZKFFAPZPACE-XIKOKIGWSA-N 0 0 382.457 3.182 20 5 GGBDRN Cc1ccc(-c2noc([C@H]3CCCN(C(=O)NCC(C)C)C3)n2)cc1[N+](=O)[O-] ZINC000273846273 1435020819 /nfs/dbraw/zinc/02/08/19/1435020819.db2.gz QCJVUIRALIQACT-HNNXBMFYSA-N 0 0 387.440 3.498 20 5 GGBDRN CO[C@@H](C)c1nc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cs1 ZINC000273845745 1435020872 /nfs/dbraw/zinc/02/08/72/1435020872.db2.gz KLJFOMSDSGTHIF-JTQLQIEISA-N 0 0 381.429 3.492 20 5 GGBDRN CCc1nc(Cc2noc([C@@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)n2)cs1 ZINC000273849484 1435021435 /nfs/dbraw/zinc/02/14/35/1435021435.db2.gz LVHIMAGFZRSOTC-AWEZNQCLSA-N 0 0 385.405 3.453 20 5 GGBDRN O=C1C[C@@H](c2noc(Cc3ccc([N+](=O)[O-])cc3Cl)n2)CN1CC1CCC1 ZINC000273859697 1435022448 /nfs/dbraw/zinc/02/24/48/1435022448.db2.gz GUORRAINTKJPAY-CYBMUJFWSA-N 0 0 390.827 3.338 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1 ZINC000273861452 1435022703 /nfs/dbraw/zinc/02/27/03/1435022703.db2.gz 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OLGBQDOYWQKFGO-UHFFFAOYSA-N 0 0 399.403 3.107 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H](C)c1ccccc1C ZINC000276067754 1435189040 /nfs/dbraw/zinc/18/90/40/1435189040.db2.gz CWYQUAORNGUMSV-ZDUSSCGKSA-N 0 0 392.433 3.072 20 5 GGBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000276145194 1435193608 /nfs/dbraw/zinc/19/36/08/1435193608.db2.gz FLQGAZUBZFNVMR-GOSISDBHSA-N 0 0 399.403 3.058 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000276151020 1435194117 /nfs/dbraw/zinc/19/41/17/1435194117.db2.gz DVOGFYKXWUOUMR-CYBMUJFWSA-N 0 0 376.434 3.001 20 5 GGBDRN COc1ccc([C@@H]2CCN(c3ccc([N+](=O)[O-])cc3S(C)(=O)=O)C2)cc1 ZINC000276170789 1435195350 /nfs/dbraw/zinc/19/53/50/1435195350.db2.gz HCJIGBIQTMNAKC-CQSZACIVSA-N 0 0 376.434 3.001 20 5 GGBDRN O=C(c1ccc(OC2CCOCC2)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000276179486 1435195974 /nfs/dbraw/zinc/19/59/74/1435195974.db2.gz ITBUIUPVOZNXOO-UHFFFAOYSA-N 0 0 398.415 3.056 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H](Nc2ccccc2)C1 ZINC000276214501 1435198035 /nfs/dbraw/zinc/19/80/35/1435198035.db2.gz KLFVFTSSFUONEK-OAHLLOKOSA-N 0 0 375.450 3.079 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000276231752 1435199115 /nfs/dbraw/zinc/19/91/15/1435199115.db2.gz OAEZIHNOSMYVDG-CYBMUJFWSA-N 0 0 388.424 3.205 20 5 GGBDRN CCN(c1cccc(C)c1C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C(=O)OC ZINC000276249104 1435200111 /nfs/dbraw/zinc/20/01/11/1435200111.db2.gz RSBOKYFQKKHABG-UHFFFAOYSA-N 0 0 392.433 3.213 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c(C)cc1C ZINC000276289729 1435202564 /nfs/dbraw/zinc/20/25/64/1435202564.db2.gz HORXBAZICZYZBK-UHFFFAOYSA-N 0 0 388.376 3.268 20 5 GGBDRN COc1cc(C(=O)NCCc2ccccc2OC(F)F)cc([N+](=O)[O-])c1OC ZINC000276330378 1435205206 /nfs/dbraw/zinc/20/52/06/1435205206.db2.gz ZVOCRKHPPNWDEF-UHFFFAOYSA-N 0 0 396.346 3.186 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCC(OC2CCCCC2)CC1 ZINC000276357638 1435206869 /nfs/dbraw/zinc/20/68/69/1435206869.db2.gz VIFDJLUFMHCMOJ-UHFFFAOYSA-N 0 0 382.482 3.316 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000276359073 1435206929 /nfs/dbraw/zinc/20/69/29/1435206929.db2.gz VNYHIUQXHPDFOZ-WBVHZDCISA-N 0 0 398.387 3.219 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000276361977 1435207030 /nfs/dbraw/zinc/20/70/30/1435207030.db2.gz MSFMAQDGCJTQLF-CQSZACIVSA-N 0 0 398.467 3.363 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1cccc(C(=O)NC2CC2)c1 ZINC000276361162 1435207069 /nfs/dbraw/zinc/20/70/69/1435207069.db2.gz APHYZDSPCZOQAE-UHFFFAOYSA-N 0 0 382.420 3.426 20 5 GGBDRN COc1cc(C(=O)N2CC[C@H](C(F)(F)F)C2(C)C)cc([N+](=O)[O-])c1OC ZINC000276387461 1435208564 /nfs/dbraw/zinc/20/85/64/1435208564.db2.gz UCCCKVQKWXHIAU-LBPRGKRZSA-N 0 0 376.331 3.415 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276389543 1435208764 /nfs/dbraw/zinc/20/87/64/1435208764.db2.gz ZXMBRVMTDOFDSO-BDJLRTHQSA-N 0 0 382.413 3.062 20 5 GGBDRN COC(=O)[C@@H](CC(F)(F)F)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000276400441 1435209287 /nfs/dbraw/zinc/20/92/87/1435209287.db2.gz DAKZQURCGIKOGR-GFCCVEGCSA-N 0 0 389.355 3.302 20 5 GGBDRN CCCCN(C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)[C@@H]1CCS(=O)(=O)C1 ZINC000276439602 1435211649 /nfs/dbraw/zinc/21/16/49/1435211649.db2.gz RBGRSBBDLJDJTK-CQSZACIVSA-N 0 0 383.470 3.033 20 5 GGBDRN COC(=O)[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@@H](C)O ZINC000276448506 1435211943 /nfs/dbraw/zinc/21/19/43/1435211943.db2.gz JOAPGOWSPBSQTO-PIGZYNQJSA-N 0 0 394.811 3.053 20 5 GGBDRN COC(=O)[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@H](C)O ZINC000276448502 1435211964 /nfs/dbraw/zinc/21/19/64/1435211964.db2.gz JOAPGOWSPBSQTO-APPDUMDISA-N 0 0 394.811 3.053 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@H]1c1cccnc1 ZINC000276487030 1435214021 /nfs/dbraw/zinc/21/40/21/1435214021.db2.gz AWCGDSPHYCSGEC-RBUKOAKNSA-N 0 0 384.436 3.142 20 5 GGBDRN COCCOc1cc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)ccc1OC ZINC000276498403 1435214539 /nfs/dbraw/zinc/21/45/39/1435214539.db2.gz AOCGGHPVOLPHND-UHFFFAOYSA-N 0 0 390.392 3.198 20 5 GGBDRN CCN1C(=S)N=NC1C1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000276533441 1435216132 /nfs/dbraw/zinc/21/61/32/1435216132.db2.gz CDCVSXYTNWOKBH-UHFFFAOYSA-N 0 0 384.465 3.427 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)nc1C ZINC000276569845 1435218049 /nfs/dbraw/zinc/21/80/49/1435218049.db2.gz BBWOSHFCKRMGAP-UHFFFAOYSA-N 0 0 393.421 3.130 20 5 GGBDRN O=C(Nc1ccccc1F)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000276569402 1435218103 /nfs/dbraw/zinc/21/81/03/1435218103.db2.gz HITYGKGJUVHAQP-UHFFFAOYSA-N 0 0 398.398 3.354 20 5 GGBDRN O=C1[C@@H](Nc2nc3ccccc3cc2[N+](=O)[O-])CCCN1Cc1ccccn1 ZINC000276577452 1435218349 /nfs/dbraw/zinc/21/83/49/1435218349.db2.gz IDBMTVCZKFUWPX-KRWDZBQOSA-N 0 0 377.404 3.141 20 5 GGBDRN COc1cc(C(=O)N2CCC(C(=O)OC(C)(C)C)CC2)cc([N+](=O)[O-])c1C ZINC000276669762 1435224072 /nfs/dbraw/zinc/22/40/72/1435224072.db2.gz QYORQQXMCZUMML-UHFFFAOYSA-N 0 0 378.425 3.106 20 5 GGBDRN COc1ccc(OC(=O)C2CCC(NC(=O)C3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000276698059 1435225947 /nfs/dbraw/zinc/22/59/47/1435225947.db2.gz ATYKRSHEJNZDPN-UHFFFAOYSA-N 0 0 390.436 3.374 20 5 GGBDRN COc1cc(C(=O)N(C)c2cc(OC)c(OC)c(OC)c2)cc([N+](=O)[O-])c1C ZINC000276700013 1435226019 /nfs/dbraw/zinc/22/60/19/1435226019.db2.gz WUBXMHOSIHGYBO-UHFFFAOYSA-N 0 0 390.392 3.214 20 5 GGBDRN CC(C)(C)OC(=O)Nc1ccc(OC(=O)Cn2ccc([N+](=O)[O-])n2)c(Cl)c1 ZINC000276706943 1435226784 /nfs/dbraw/zinc/22/67/84/1435226784.db2.gz CAMSGFPLQPGRHC-UHFFFAOYSA-N 0 0 396.787 3.397 20 5 GGBDRN COC(=O)c1cnc(N2CCO[C@@H](c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1 ZINC000276731234 1435228645 /nfs/dbraw/zinc/22/86/45/1435228645.db2.gz LNHCBHFDUZJJQY-OAHLLOKOSA-N 0 0 377.784 3.008 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)cc([N+](=O)[O-])c1C ZINC000276737900 1435228945 /nfs/dbraw/zinc/22/89/45/1435228945.db2.gz GEJCCMTUDJRTFU-UHFFFAOYSA-N 0 0 385.376 3.429 20 5 GGBDRN CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2O1 ZINC000276739381 1435229126 /nfs/dbraw/zinc/22/91/26/1435229126.db2.gz KHNLFNJWKAAYQR-FQEVSTJZSA-N 0 0 399.403 3.089 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCCC[C@H]1c1nnc(C2CCOCC2)o1 ZINC000276744697 1435229320 /nfs/dbraw/zinc/22/93/20/1435229320.db2.gz AEFAUFILZXPXGL-ZDUSSCGKSA-N 0 0 392.437 3.301 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCCC[C@@H]1c1nnc(C2CCOCC2)o1 ZINC000276744692 1435229413 /nfs/dbraw/zinc/22/94/13/1435229413.db2.gz AEFAUFILZXPXGL-CYBMUJFWSA-N 0 0 392.437 3.301 20 5 GGBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000276782481 1435232239 /nfs/dbraw/zinc/23/22/39/1435232239.db2.gz IOSSRTPZRPAQBP-UHFFFAOYSA-N 0 0 398.394 3.154 20 5 GGBDRN CCOc1cc(O)ccc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] ZINC000276782479 1435232265 /nfs/dbraw/zinc/23/22/65/1435232265.db2.gz IOSDVTPUQNSEPP-UHFFFAOYSA-N 0 0 376.365 3.359 20 5 GGBDRN CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2O1 ZINC000276803212 1435233681 /nfs/dbraw/zinc/23/36/81/1435233681.db2.gz SWAAFJHFZYBSHR-ODXCJYRJSA-N 0 0 399.403 3.308 20 5 GGBDRN CCc1ccc([C@@H]2CN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CCO2)cc1 ZINC000276808034 1435234087 /nfs/dbraw/zinc/23/40/87/1435234087.db2.gz RTKWLZUOGADGCA-IBGZPJMESA-N 0 0 390.461 3.139 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CC[C@@H](N2CCCC2=O)C1 ZINC000276829519 1435235736 /nfs/dbraw/zinc/23/57/36/1435235736.db2.gz WBDSZISKYVDSCW-MRXNPFEDSA-N 0 0 395.415 3.224 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CC[C@H](N2CCCC2=O)C1 ZINC000276829516 1435235855 /nfs/dbraw/zinc/23/58/55/1435235855.db2.gz WBDSZISKYVDSCW-INIZCTEOSA-N 0 0 395.415 3.224 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)S(=O)(=O)c1ccc(C)c(C)c1 ZINC000276830275 1435235887 /nfs/dbraw/zinc/23/58/87/1435235887.db2.gz AUWNLOYZEPRHOI-CYBMUJFWSA-N 0 0 392.433 3.021 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cccc(N3CCCC3=O)c2)c(C)c([N+](=O)[O-])c1 ZINC000276867763 1435238660 /nfs/dbraw/zinc/23/86/60/1435238660.db2.gz JTHHYFUUGAKTCM-UHFFFAOYSA-N 0 0 397.387 3.069 20 5 GGBDRN CCOc1cc(CSc2nnc(-c3cnccn3)n2CC)ccc1[N+](=O)[O-] ZINC000276867982 1435238688 /nfs/dbraw/zinc/23/86/88/1435238688.db2.gz HEYMVQKDDJDBNG-UHFFFAOYSA-N 0 0 386.437 3.354 20 5 GGBDRN CCOc1cc(CN[C@H](CN2CCCC2=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000276870494 1435238841 /nfs/dbraw/zinc/23/88/41/1435238841.db2.gz HNJKGISNYASNJB-GOSISDBHSA-N 0 0 383.448 3.447 20 5 GGBDRN CCOc1cc(CN[C@@H](CN2CCCC2=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000276870499 1435238889 /nfs/dbraw/zinc/23/88/89/1435238889.db2.gz HNJKGISNYASNJB-SFHVURJKSA-N 0 0 383.448 3.447 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NC[C@H]2CC[C@H](O)C2)cc1 ZINC000276872320 1435239090 /nfs/dbraw/zinc/23/90/90/1435239090.db2.gz LLZYGKGTOQFLMU-ZFWWWQNUSA-N 0 0 386.404 3.287 20 5 GGBDRN Cc1cc2n[nH]cc2cc1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000276890184 1435240683 /nfs/dbraw/zinc/24/06/83/1435240683.db2.gz BYFTYXVENHVELI-UHFFFAOYSA-N 0 0 395.419 3.155 20 5 GGBDRN CCOc1cc(CN[C@](C)(C(N)=O)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000276894187 1435240861 /nfs/dbraw/zinc/24/08/61/1435240861.db2.gz KRBMSPPFJDVZHY-SFHVURJKSA-N 0 0 377.828 3.137 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(CN2CCCCC2=O)c1 ZINC000276895055 1435240905 /nfs/dbraw/zinc/24/09/05/1435240905.db2.gz CYLJSYHWYGQOKQ-UHFFFAOYSA-N 0 0 383.404 3.368 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2c2ccc([N+](=O)[O-])c3nonc32)n1 ZINC000276898434 1435241243 /nfs/dbraw/zinc/24/12/43/1435241243.db2.gz VLHUWFVTRUTJML-GFCCVEGCSA-N 0 0 389.393 3.106 20 5 GGBDRN COc1ccc(CCC(C)=O)cc1OS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000276913949 1435242421 /nfs/dbraw/zinc/24/24/21/1435242421.db2.gz JTCALVMZLHCCBG-UHFFFAOYSA-N 0 0 393.417 3.201 20 5 GGBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000276917218 1435242651 /nfs/dbraw/zinc/24/26/51/1435242651.db2.gz PENAGKRTEMGLOV-UHFFFAOYSA-N 0 0 384.367 3.294 20 5 GGBDRN COc1ccc(CNC(=O)N[C@H]2CCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000276922647 1435243250 /nfs/dbraw/zinc/24/32/50/1435243250.db2.gz MSBQWAODYIHZJR-AWEZNQCLSA-N 0 0 375.356 3.066 20 5 GGBDRN CC(C)(C)S(=O)(=O)N1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000276950853 1435246277 /nfs/dbraw/zinc/24/62/77/1435246277.db2.gz UKGPTMKXGFDVJK-UHFFFAOYSA-N 0 0 392.481 3.148 20 5 GGBDRN COc1cc(C[NH2+]CC(C)(C)C(=O)[O-])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000276955653 1435246638 /nfs/dbraw/zinc/24/66/38/1435246638.db2.gz FKRWHCHERVSTGZ-UHFFFAOYSA-N 0 0 388.420 3.383 20 5 GGBDRN CCc1c(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1CCC(C)C ZINC000276975628 1435248820 /nfs/dbraw/zinc/24/88/20/1435248820.db2.gz HPFMTVMHVVSPFU-UHFFFAOYSA-N 0 0 387.440 3.285 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@@H](Cc2nc(C)no2)c2ccccc2)c1[N+](=O)[O-] ZINC000276994990 1435250792 /nfs/dbraw/zinc/25/07/92/1435250792.db2.gz HCKYKMNXXSHUDY-HNNXBMFYSA-N 0 0 397.391 3.254 20 5 GGBDRN 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CC(=O)c1cccc(OCCCC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000277927039 1435342941 /nfs/dbraw/zinc/34/29/41/1435342941.db2.gz HTUXTGGJJGAXFJ-UHFFFAOYSA-N 0 0 396.403 3.149 20 5 GGBDRN CC[C@@H](C)c1nnc([C@H](C)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])[nH]1 ZINC000277935911 1435343790 /nfs/dbraw/zinc/34/37/90/1435343790.db2.gz SFBLYSALUODXAW-ZJUUUORDSA-N 0 0 393.469 3.448 20 5 GGBDRN CC[C@@H](C)c1nnc([C@@H](C)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])[nH]1 ZINC000277935903 1435343847 /nfs/dbraw/zinc/34/38/47/1435343847.db2.gz SFBLYSALUODXAW-NXEZZACHSA-N 0 0 393.469 3.448 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(Cc3cc(C(C)=O)ccc3OC)n2)c1 ZINC000277943606 1435344374 /nfs/dbraw/zinc/34/43/74/1435344374.db2.gz PUVRIBHCIAKUHS-UHFFFAOYSA-N 0 0 397.387 3.379 20 5 GGBDRN CCOC(=O)c1cnc(C)c(-c2nc(Cc3cc(OC)ccc3[N+](=O)[O-])no2)c1 ZINC000277954096 1435345393 /nfs/dbraw/zinc/34/53/93/1435345393.db2.gz RASMAHRHLQXUTH-UHFFFAOYSA-N 0 0 398.375 3.124 20 5 GGBDRN 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COc1ccc([N+](=O)[O-])c(Cc2noc([C@H](C)OC[C@@H]3CCCCO3)n2)c1 ZINC000278014202 1435350167 /nfs/dbraw/zinc/35/01/67/1435350167.db2.gz XTXMWKVYYYVRHH-WFASDCNBSA-N 0 0 377.397 3.224 20 5 GGBDRN C[C@H]1C[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])CCN1C(=O)OC(C)(C)C ZINC000278020227 1435350804 /nfs/dbraw/zinc/35/08/04/1435350804.db2.gz PXXYUJALFRGERB-ZFWWWQNUSA-N 0 0 392.456 3.182 20 5 GGBDRN CC[C@H]1C[C@H](c2nc(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])no2)CCO1 ZINC000278031752 1435352007 /nfs/dbraw/zinc/35/20/07/1435352007.db2.gz KLRRNIMJUNFOGU-YPMHNXCESA-N 0 0 377.397 3.258 20 5 GGBDRN COc1cc(Cc2noc(Cc3ccc(C)c(O)c3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000278034159 1435352240 /nfs/dbraw/zinc/35/22/40/1435352240.db2.gz KRQUGCMASZRZCR-UHFFFAOYSA-N 0 0 385.376 3.191 20 5 GGBDRN Cc1nn(CCc2nc([C@@H]3CSc4ccccc4O3)no2)c(C)c1[N+](=O)[O-] ZINC000278038059 1435352763 /nfs/dbraw/zinc/35/27/63/1435352763.db2.gz KYKBPUKQSJNEFV-ZDUSSCGKSA-N 0 0 387.421 3.260 20 5 GGBDRN Cc1nn(CCc2nc([C@H]3CSc4ccccc4O3)no2)c(C)c1[N+](=O)[O-] ZINC000278038057 1435352787 /nfs/dbraw/zinc/35/27/87/1435352787.db2.gz KYKBPUKQSJNEFV-CYBMUJFWSA-N 0 0 387.421 3.260 20 5 GGBDRN CC[C@H](NC(=O)Cc1noc(-c2n[nH]c(C(C)C)c2[N+](=O)[O-])n1)c1ccccc1 ZINC000278050350 1435353904 /nfs/dbraw/zinc/35/39/04/1435353904.db2.gz UVMSCLYBXJVBLR-ZDUSSCGKSA-N 0 0 398.423 3.301 20 5 GGBDRN CC[C@H](NC(=O)Cc1noc(COc2ccccc2[N+](=O)[O-])n1)c1ccccc1 ZINC000278050386 1435353920 /nfs/dbraw/zinc/35/39/20/1435353920.db2.gz UVTPYWVFBJUNHP-HNNXBMFYSA-N 0 0 396.403 3.367 20 5 GGBDRN O=[N+]([O-])c1ccc(C(F)(F)c2nc([C@H]3CN4CCCC[C@H]4CO3)no2)cc1 ZINC000278053712 1435354360 /nfs/dbraw/zinc/35/43/60/1435354360.db2.gz MBLSNHVVZULXKV-UONOGXRCSA-N 0 0 380.351 3.044 20 5 GGBDRN CCCCCCc1nc(CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCO3)no1 ZINC000278054841 1435354478 /nfs/dbraw/zinc/35/44/78/1435354478.db2.gz LOCOIIQPIRSABK-UHFFFAOYSA-N 0 0 390.396 3.053 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC(Oc4ncccc4F)CC3)n2)c1 ZINC000278063166 1435355417 /nfs/dbraw/zinc/35/54/17/1435355417.db2.gz FNTRUNPNDBUCQL-UHFFFAOYSA-N 0 0 399.382 3.222 20 5 GGBDRN CC[C@H](C)c1ccc(NC(=O)Cc2noc(CCn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000278065484 1435355613 /nfs/dbraw/zinc/35/56/13/1435355613.db2.gz MNDWBWJNIVDOAY-ZDUSSCGKSA-N 0 0 398.423 3.112 20 5 GGBDRN Cc1cnccc1OC1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000278091118 1435358247 /nfs/dbraw/zinc/35/82/47/1435358247.db2.gz NHVBLVHPFQQKJI-UHFFFAOYSA-N 0 0 387.461 3.460 20 5 GGBDRN Cc1cc(C(=O)CCC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)s1 ZINC000278113537 1435360885 /nfs/dbraw/zinc/36/08/85/1435360885.db2.gz LCNPPLJFHYLWBT-UHFFFAOYSA-N 0 0 386.433 3.429 20 5 GGBDRN CC[C@H](NC(=O)C[C@@H](CNC(=O)OC(C)(C)C)OC)c1cccc([N+](=O)[O-])c1 ZINC000278117089 1435361338 /nfs/dbraw/zinc/36/13/38/1435361338.db2.gz AKBGAAZUMYQFKP-HOTGVXAUSA-N 0 0 395.456 3.092 20 5 GGBDRN Cc1cc(N(C)C)cc(C)c1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000278121764 1435361883 /nfs/dbraw/zinc/36/18/83/1435361883.db2.gz LQKHDTDBKQKRDF-UHFFFAOYSA-N 0 0 382.424 3.476 20 5 GGBDRN COc1ccc(COCCCC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000278128960 1435362455 /nfs/dbraw/zinc/36/24/55/1435362455.db2.gz MJFNGMKXPKRJDT-UHFFFAOYSA-N 0 0 398.419 3.093 20 5 GGBDRN CC[C@H]1C[C@@H](Cc2nc(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])no2)CCO1 ZINC000278143368 1435363785 /nfs/dbraw/zinc/36/37/85/1435363785.db2.gz SAQWIQLDDYVSNL-JSGCOSHPSA-N 0 0 391.424 3.334 20 5 GGBDRN O=C(N1CCCC1)N1CCC[C@@H](c2nc(-c3ccc([N+](=O)[O-])s3)no2)C1 ZINC000278145750 1435364057 /nfs/dbraw/zinc/36/40/57/1435364057.db2.gz LQOPKJDTJOZNIT-LLVKDONJSA-N 0 0 377.426 3.102 20 5 GGBDRN COc1ccc(C(=O)CCCC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000278165169 1435365538 /nfs/dbraw/zinc/36/55/38/1435365538.db2.gz PNAWWLTXRDAENS-UHFFFAOYSA-N 0 0 396.403 3.149 20 5 GGBDRN O=C(N[C@]1(CCO)CCOC1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000278180747 1435367191 /nfs/dbraw/zinc/36/71/91/1435367191.db2.gz SVCSOSBEIKJGFL-LJQANCHMSA-N 0 0 388.445 3.017 20 5 GGBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(COCC(F)(F)C(F)F)no3)c2c1 ZINC000278183637 1435367419 /nfs/dbraw/zinc/36/74/19/1435367419.db2.gz LSOGDBCFUMGRIS-UHFFFAOYSA-N 0 0 388.277 3.467 20 5 GGBDRN CSc1ccc(-c2nc([C@H]3CN4CCCC[C@@H]4CO3)no2)cc1[N+](=O)[O-] ZINC000278188091 1435367806 /nfs/dbraw/zinc/36/78/06/1435367806.db2.gz VRIYPHBJHUGJLI-TZMCWYRMSA-N 0 0 376.438 3.293 20 5 GGBDRN C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C ZINC000278189692 1435367873 /nfs/dbraw/zinc/36/78/73/1435367873.db2.gz HUSYLEPPJOPTGY-IUODEOHRSA-N 0 0 394.428 3.238 20 5 GGBDRN Cc1cnccc1OC1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000278212271 1435369863 /nfs/dbraw/zinc/36/98/63/1435369863.db2.gz DIHPWTFNUOXDQQ-UHFFFAOYSA-N 0 0 394.431 3.392 20 5 GGBDRN CC(C)(C)OC(=O)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000278223428 1435371187 /nfs/dbraw/zinc/37/11/87/1435371187.db2.gz LTUIADQDTULHFW-UHFFFAOYSA-N 0 0 394.428 3.240 20 5 GGBDRN 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ZINC000278386238 1435386249 /nfs/dbraw/zinc/38/62/49/1435386249.db2.gz ZNACQNJQXFEMOX-KRWDZBQOSA-N 0 0 384.367 3.206 20 5 GGBDRN CC(C)(CCCO)CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278385595 1435386260 /nfs/dbraw/zinc/38/62/60/1435386260.db2.gz ACDRZKCDIHUYFF-UHFFFAOYSA-N 0 0 377.363 3.212 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1 ZINC000278392890 1435386893 /nfs/dbraw/zinc/38/68/93/1435386893.db2.gz QBYXMFPURQYMQU-OLZOCXBDSA-N 0 0 393.440 3.121 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000278394854 1435387153 /nfs/dbraw/zinc/38/71/53/1435387153.db2.gz QDBDKDSKCCFGBL-OCCSQVGLSA-N 0 0 393.440 3.121 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])CCN1C(=O)OC(C)(C)C ZINC000278417172 1435389426 /nfs/dbraw/zinc/38/94/26/1435389426.db2.gz SMLOZKLMVCQSIW-WCQYABFASA-N 0 0 381.404 3.252 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1 ZINC000278418939 1435389570 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GGBDRN C[C@H]1OCC[C@@]12CN(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000279270965 1435479952 /nfs/dbraw/zinc/47/99/52/1435479952.db2.gz JLUFJOPQPMXHSW-GLKRBJQHSA-N 0 0 388.342 3.022 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])c(C)o1 ZINC000279276040 1435480533 /nfs/dbraw/zinc/48/05/33/1435480533.db2.gz KZXFORKPLOAVOE-QGZVFWFLSA-N 0 0 384.791 3.164 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)[C@H](CCS(C)(=O)=O)c1ccccc1 ZINC000279290107 1435482393 /nfs/dbraw/zinc/48/23/93/1435482393.db2.gz MGHUCQVOMMVHEO-MRXNPFEDSA-N 0 0 377.418 3.027 20 5 GGBDRN COC(=O)[C@H]1CC[C@@H](NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])C1 ZINC000279299402 1435483635 /nfs/dbraw/zinc/48/36/35/1435483635.db2.gz VVYDOLKZUWBGGE-JKSUJKDBSA-N 0 0 398.415 3.245 20 5 GGBDRN Cc1cc(N2C[C@H](C)OC3(CCOCC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279309494 1435484721 /nfs/dbraw/zinc/48/47/21/1435484721.db2.gz BOKONAYQGASXKH-HNNXBMFYSA-N 0 0 384.436 3.135 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])sc1C ZINC000279319208 1435486011 /nfs/dbraw/zinc/48/60/11/1435486011.db2.gz AYDOBKQJPDGPKY-ZDUSSCGKSA-N 0 0 375.406 3.124 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])sc1C ZINC000279331069 1435487297 /nfs/dbraw/zinc/48/72/97/1435487297.db2.gz BVHHSRCAOBNSMD-CQSZACIVSA-N 0 0 389.433 3.053 20 5 GGBDRN C[C@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@H](C2CC2)O1 ZINC000279347721 1435489458 /nfs/dbraw/zinc/48/94/58/1435489458.db2.gz HXFNWZFKDHHCNB-YCRPNKLZSA-N 0 0 376.456 3.181 20 5 GGBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000279350366 1435489934 /nfs/dbraw/zinc/48/99/34/1435489934.db2.gz BVMSAVJLTQKTSH-UHFFFAOYSA-N 0 0 390.390 3.426 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2C)sc1C ZINC000279361270 1435491134 /nfs/dbraw/zinc/49/11/34/1435491134.db2.gz DTDBOYYBMDZEIB-CQSZACIVSA-N 0 0 389.433 3.432 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@H](OCc2ccccn2)C1 ZINC000279370664 1435492060 /nfs/dbraw/zinc/49/20/60/1435492060.db2.gz UCKNFPMBPAQTLR-AWEZNQCLSA-N 0 0 393.802 3.143 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(C(=O)N[C@H](C)CC)c1 ZINC000279373625 1435492525 /nfs/dbraw/zinc/49/25/25/1435492525.db2.gz SCQHDGCPSQVCOC-CQSZACIVSA-N 0 0 399.447 3.452 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(C(=O)N[C@@H](C)CC)c1 ZINC000279373614 1435492558 /nfs/dbraw/zinc/49/25/58/1435492558.db2.gz SCQHDGCPSQVCOC-AWEZNQCLSA-N 0 0 399.447 3.452 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)c1nc2ccccc2n1C ZINC000279377658 1435492781 /nfs/dbraw/zinc/49/27/81/1435492781.db2.gz HPMUWYYMFXZLTE-LLVKDONJSA-N 0 0 385.399 3.178 20 5 GGBDRN CN(CCN1CCOC(C)(C)C1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000279376544 1435492845 /nfs/dbraw/zinc/49/28/45/1435492845.db2.gz TWLDDLODJVUMIS-UHFFFAOYSA-N 0 0 393.487 3.276 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000279380766 1435493186 /nfs/dbraw/zinc/49/31/86/1435493186.db2.gz QQKXRENBVJMPPY-SNVBAGLBSA-N 0 0 396.350 3.076 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000279380764 1435493288 /nfs/dbraw/zinc/49/32/88/1435493288.db2.gz QQKXRENBVJMPPY-JTQLQIEISA-N 0 0 396.350 3.076 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000279385885 1435493822 /nfs/dbraw/zinc/49/38/22/1435493822.db2.gz QYGSGSZLKNEMIQ-CYBMUJFWSA-N 0 0 385.424 3.049 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000279393171 1435494441 /nfs/dbraw/zinc/49/44/41/1435494441.db2.gz RHNBEYMZZSTZLK-SNVBAGLBSA-N 0 0 398.341 3.493 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2C ZINC000279397010 1435494707 /nfs/dbraw/zinc/49/47/07/1435494707.db2.gz UVTCYDGWSIWJMW-GFCCVEGCSA-N 0 0 383.404 3.003 20 5 GGBDRN Cn1ncc2c1CCC[C@@H]2NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279398884 1435494938 /nfs/dbraw/zinc/49/49/38/1435494938.db2.gz CSUPBKJVQAVILC-AWEZNQCLSA-N 0 0 397.357 3.224 20 5 GGBDRN C[C@H]1OCC[C@@]12CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C[C@@H](C)O2 ZINC000279424487 1435497880 /nfs/dbraw/zinc/49/78/80/1435497880.db2.gz UAKVIQXPOWKJFJ-GLKRBJQHSA-N 0 0 388.342 3.022 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(CCN2CCOCC2)cc1 ZINC000279430658 1435498383 /nfs/dbraw/zinc/49/83/83/1435498383.db2.gz XSBCQQFTYDQALB-UHFFFAOYSA-N 0 0 399.447 3.121 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)c([N+](=O)[O-])c1 ZINC000279441904 1435500021 /nfs/dbraw/zinc/50/00/21/1435500021.db2.gz PJKQFDRUDPFEQF-UHFFFAOYSA-N 0 0 385.424 3.415 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N2CCC[C@@H]2[C@@H]2CCCCC2=O)cc1[N+](=O)[O-] ZINC000279446311 1435500306 /nfs/dbraw/zinc/50/03/06/1435500306.db2.gz NPHUCTGDQIYZOF-SWLSCSKDSA-N 0 0 377.416 3.164 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N2CCC[C@H]2[C@@H]2CCCCC2=O)cc1[N+](=O)[O-] ZINC000279446317 1435500372 /nfs/dbraw/zinc/50/03/72/1435500372.db2.gz NPHUCTGDQIYZOF-WFASDCNBSA-N 0 0 377.416 3.164 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)c2c(OCC)cccc2[N+](=O)[O-])c1 ZINC000279447653 1435500649 /nfs/dbraw/zinc/50/06/49/1435500649.db2.gz ZBSQEFQATYDCGC-UHFFFAOYSA-N 0 0 385.420 3.063 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N(C)CCCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000279460604 1435501848 /nfs/dbraw/zinc/50/18/48/1435501848.db2.gz OXCQWYIUNLPHKH-UHFFFAOYSA-N 0 0 399.426 3.381 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000279470540 1435502759 /nfs/dbraw/zinc/50/27/59/1435502759.db2.gz MXXORKOKRLPAFT-LIRRHRJNSA-N 0 0 387.411 3.308 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000279471870 1435503045 /nfs/dbraw/zinc/50/30/45/1435503045.db2.gz PWSIAKLCCGPPPF-GFCCVEGCSA-N 0 0 389.358 3.190 20 5 GGBDRN C[C@H](CC(=O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279493367 1435505700 /nfs/dbraw/zinc/50/57/00/1435505700.db2.gz PMIUVXWVFSLQPO-SNVBAGLBSA-N 0 0 379.413 3.253 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cccc(C)n1 ZINC000279522762 1435509331 /nfs/dbraw/zinc/50/93/31/1435509331.db2.gz VILZLKVDXILCAP-UHFFFAOYSA-N 0 0 375.450 3.009 20 5 GGBDRN C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@@H+]1Cc1ccccc1 ZINC000279531139 1435510313 /nfs/dbraw/zinc/51/03/13/1435510313.db2.gz VYNBHOIAFXHXKX-AWEZNQCLSA-N 0 0 386.427 3.053 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279544510 1435511644 /nfs/dbraw/zinc/51/16/44/1435511644.db2.gz VXFMRKKFMRAKPS-BMIGLBTASA-N 0 0 381.429 3.103 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCCN(CC(F)(F)F)CC1 ZINC000279555812 1435512778 /nfs/dbraw/zinc/51/27/78/1435512778.db2.gz MZHUJJNEZVYBKX-UHFFFAOYSA-N 0 0 397.756 3.026 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CCC[C@@H](CNC(=O)C(C)C)C1 ZINC000279569050 1435514409 /nfs/dbraw/zinc/51/44/09/1435514409.db2.gz UQPAGOBNERIDOP-LBPRGKRZSA-N 0 0 397.859 3.023 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000279605723 1435518367 /nfs/dbraw/zinc/51/83/67/1435518367.db2.gz QDBWNCGFSACUBY-LBPRGKRZSA-N 0 0 378.816 3.057 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000279605720 1435518482 /nfs/dbraw/zinc/51/84/82/1435518482.db2.gz QDBWNCGFSACUBY-GFCCVEGCSA-N 0 0 378.816 3.057 20 5 GGBDRN C[C@H]1OCC[C@@]12CN(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CCO2 ZINC000279609201 1435518594 /nfs/dbraw/zinc/51/85/94/1435518594.db2.gz XWCXAJPKGOGCLU-MEBBXXQBSA-N 0 0 389.330 3.025 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000279611930 1435518769 /nfs/dbraw/zinc/51/87/69/1435518769.db2.gz WWNYUOAYNIYXOW-UHFFFAOYSA-N 0 0 388.399 3.316 20 5 GGBDRN Cc1cc(N2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279623127 1435520104 /nfs/dbraw/zinc/52/01/04/1435520104.db2.gz YQFFVQXUXLXWFU-MDOVXXIYSA-N 0 0 384.436 3.133 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CC1 ZINC000279623586 1435520355 /nfs/dbraw/zinc/52/03/55/1435520355.db2.gz XNDPLPQQMHQNGL-UHFFFAOYSA-N 0 0 394.435 3.017 20 5 GGBDRN C[C@@H]1OCC[C@@]12CN(Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)CCO2 ZINC000279641488 1435522497 /nfs/dbraw/zinc/52/24/97/1435522497.db2.gz JGPBENVGZNAEHN-SCLBCKFNSA-N 0 0 375.450 3.098 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279666817 1435526048 /nfs/dbraw/zinc/52/60/48/1435526048.db2.gz JEPSZUGGVCFZEB-AWEZNQCLSA-N 0 0 382.779 3.154 20 5 GGBDRN COc1cc(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc(OC)c1O ZINC000279676669 1435528180 /nfs/dbraw/zinc/52/81/80/1435528180.db2.gz HCEDNNQJNBPZGH-UHFFFAOYSA-N 0 0 386.404 3.051 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2C)sc1C ZINC000279719359 1435534682 /nfs/dbraw/zinc/53/46/82/1435534682.db2.gz QTEATOCFQXZKTE-CQSZACIVSA-N 0 0 389.433 3.432 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(C(=O)N(CC)CC)cc1 ZINC000279737683 1435536669 /nfs/dbraw/zinc/53/66/69/1435536669.db2.gz OLSRMIYHJFCGHJ-UHFFFAOYSA-N 0 0 399.447 3.406 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN(CCC(F)(F)F)CC(F)(F)F ZINC000279737802 1435536675 /nfs/dbraw/zinc/53/66/75/1435536675.db2.gz KGTHNCSJLFAELF-JTQLQIEISA-N 0 0 390.280 3.151 20 5 GGBDRN Cc1ccc([C@H]2CCN(C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)C2)c(C)c1 ZINC000279765959 1435540232 /nfs/dbraw/zinc/54/02/32/1435540232.db2.gz WBIMIGFZUKWYQF-KRWDZBQOSA-N 0 0 391.431 3.422 20 5 GGBDRN O=C(O[C@H]([C@@H]1CCCOC1)C(F)(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000279788196 1435543243 /nfs/dbraw/zinc/54/32/43/1435543243.db2.gz WTOUYHWQEMLFSZ-PRHODGIISA-N 0 0 378.259 3.017 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@H](C)c1ccc(-n2cncn2)cc1 ZINC000279827343 1435547956 /nfs/dbraw/zinc/54/79/56/1435547956.db2.gz YTOLXXMGXMOQSN-CQSZACIVSA-N 0 0 395.419 3.407 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000279841964 1435549753 /nfs/dbraw/zinc/54/97/53/1435549753.db2.gz DNOCAUOBAYVBBW-JTQLQIEISA-N 0 0 382.779 3.027 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2ccccc2n1CCOC ZINC000279851625 1435551807 /nfs/dbraw/zinc/55/18/07/1435551807.db2.gz AZBQCFDJABPSDR-UHFFFAOYSA-N 0 0 384.392 3.242 20 5 GGBDRN COc1ccc([C@H](CO)N(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cc1 ZINC000279867906 1435555390 /nfs/dbraw/zinc/55/53/90/1435555390.db2.gz SQYYCBGVZMZRTB-KRWDZBQOSA-N 0 0 396.802 3.130 20 5 GGBDRN CC(C)(C)[C@H]1CCCN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000279901569 1435560084 /nfs/dbraw/zinc/56/00/84/1435560084.db2.gz AWCGVMFZXSTSRU-LBPRGKRZSA-N 0 0 381.860 3.263 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCCCC[C@H]1c1ncon1 ZINC000279919473 1435563209 /nfs/dbraw/zinc/56/32/09/1435563209.db2.gz VWPVHSGTHXGZIK-ZDUSSCGKSA-N 0 0 382.779 3.457 20 5 GGBDRN CN(C)Cc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1Cl ZINC000279922219 1435563474 /nfs/dbraw/zinc/56/34/74/1435563474.db2.gz GPJHJLRNCUHBKQ-UHFFFAOYSA-N 0 0 391.811 3.333 20 5 GGBDRN C[C@@H](O)C[C@@H]1CCCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000279926712 1435564322 /nfs/dbraw/zinc/56/43/22/1435564322.db2.gz WJKIYFUERHIHIF-SJORKVTESA-N 0 0 378.472 3.307 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(CC)c(C(=O)OC)s1 ZINC000279931462 1435565612 /nfs/dbraw/zinc/56/56/12/1435565612.db2.gz FXBKOHGSEZLXCZ-UHFFFAOYSA-N 0 0 379.394 3.051 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000279934692 1435565821 /nfs/dbraw/zinc/56/58/21/1435565821.db2.gz GTEMVNNDYPBJOL-UHFFFAOYSA-N 0 0 385.424 3.068 20 5 GGBDRN Cc1cc(=O)c(C(=O)N(CC2CC2)CC2CCC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000279942760 1435567359 /nfs/dbraw/zinc/56/73/59/1435567359.db2.gz GDCSNLAUNFUYCB-UHFFFAOYSA-N 0 0 396.447 3.101 20 5 GGBDRN C[C@H](O)C[C@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279951920 1435568390 /nfs/dbraw/zinc/56/83/90/1435568390.db2.gz XSPVQNHTZCSUMX-SWLSCSKDSA-N 0 0 375.450 3.484 20 5 GGBDRN COc1cc(C(=O)Nc2cnc(C(C)C)nc2)c([N+](=O)[O-])cc1OC(F)F ZINC000279967866 1435570682 /nfs/dbraw/zinc/57/06/82/1435570682.db2.gz OIFGSDZPFLNAOP-UHFFFAOYSA-N 0 0 382.323 3.371 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2c(s1)CN(C(C)C)CC2 ZINC000280001829 1435575188 /nfs/dbraw/zinc/57/51/88/1435575188.db2.gz LDZINNBLWCMLOP-UHFFFAOYSA-N 0 0 390.465 3.469 20 5 GGBDRN O=C(Cc1ccc2n[nH]cc2c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000280006742 1435575450 /nfs/dbraw/zinc/57/54/50/1435575450.db2.gz DOHDTZCYCOEOJY-UHFFFAOYSA-N 0 0 380.404 3.084 20 5 GGBDRN Cc1nc(CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])ccc1[C@H](C)O ZINC000280014294 1435576840 /nfs/dbraw/zinc/57/68/40/1435576840.db2.gz WLZBMFKAYGGBGE-JTQLQIEISA-N 0 0 381.791 3.003 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cnc(C(C)C)nc2)ccc1[N+](=O)[O-] ZINC000280034220 1435580442 /nfs/dbraw/zinc/58/04/42/1435580442.db2.gz VWOGAUQNBJPXRZ-QGZVFWFLSA-N 0 0 397.435 3.060 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC(Oc2ncccc2F)CC1 ZINC000280071621 1435587138 /nfs/dbraw/zinc/58/71/38/1435587138.db2.gz QLFWMFXWULHQEB-UHFFFAOYSA-N 0 0 389.383 3.211 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN(C2CCCCC2)C1=O ZINC000280119994 1435595566 /nfs/dbraw/zinc/59/55/66/1435595566.db2.gz UNDJUMOTNYDJAG-HNNXBMFYSA-N 0 0 389.452 3.047 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O ZINC000280119999 1435595639 /nfs/dbraw/zinc/59/56/39/1435595639.db2.gz UNDJUMOTNYDJAG-OAHLLOKOSA-N 0 0 389.452 3.047 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000280122655 1435595836 /nfs/dbraw/zinc/59/58/36/1435595836.db2.gz PQBGVOWHQPBPSI-NSHDSACASA-N 0 0 382.367 3.436 20 5 GGBDRN CCC(=O)c1ccc(N2Cc3c(OC)ccc(OC)c3[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000280142342 1435598721 /nfs/dbraw/zinc/59/87/21/1435598721.db2.gz ZFZIGVNFHGDUPC-KRWDZBQOSA-N 0 0 386.404 3.258 20 5 GGBDRN C[C@@]1(O)CCCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000280185299 1435605142 /nfs/dbraw/zinc/60/51/42/1435605142.db2.gz DCBYGMGAEKECQX-OAHLLOKOSA-N 0 0 375.347 3.060 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c(OC)c2)sc1C ZINC000280218441 1435610774 /nfs/dbraw/zinc/61/07/74/1435610774.db2.gz GYGFSYUOOBFGSN-ZDUSSCGKSA-N 0 0 377.422 3.496 20 5 GGBDRN CS(=O)(=O)C1(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CCC1 ZINC000280219582 1435611594 /nfs/dbraw/zinc/61/15/94/1435611594.db2.gz RSJSVBVBNGVOGF-UHFFFAOYSA-N 0 0 390.417 3.293 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1 ZINC000280222213 1435612258 /nfs/dbraw/zinc/61/22/58/1435612258.db2.gz AOXDPHUOPXTYTO-AWEZNQCLSA-N 0 0 385.420 3.471 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H](CC(N)=O)c1ccccc1 ZINC000280244214 1435616876 /nfs/dbraw/zinc/61/68/76/1435616876.db2.gz PCQORCPXTBSSSB-CXAGYDPISA-N 0 0 387.461 3.151 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H](CC(N)=O)c1ccccc1 ZINC000280244221 1435616943 /nfs/dbraw/zinc/61/69/43/1435616943.db2.gz PCQORCPXTBSSSB-GUYCJALGSA-N 0 0 387.461 3.151 20 5 GGBDRN CO[C@@]1(C)CCCN(c2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)CC1 ZINC000280275054 1435623971 /nfs/dbraw/zinc/62/39/71/1435623971.db2.gz PFWSMYGYEXEFCQ-SFHVURJKSA-N 0 0 392.843 3.190 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC(C)=C(C)C1 ZINC000280279361 1435624379 /nfs/dbraw/zinc/62/43/79/1435624379.db2.gz SABPKDULCQBSAV-QGZVFWFLSA-N 0 0 391.493 3.015 20 5 GGBDRN C[C@H]1CN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000280285509 1435626054 /nfs/dbraw/zinc/62/60/54/1435626054.db2.gz QCILNIQAWMLSQZ-TVQRCGJNSA-N 0 0 397.300 3.028 20 5 GGBDRN C[C@H]1CN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000280285515 1435626255 /nfs/dbraw/zinc/62/62/55/1435626255.db2.gz QCILNIQAWMLSQZ-ZANVPECISA-N 0 0 397.300 3.028 20 5 GGBDRN Cn1nc(-c2ccccc2)nc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000280310437 1435632306 /nfs/dbraw/zinc/63/23/06/1435632306.db2.gz OKEDGXBVLRGUAW-UHFFFAOYSA-N 0 0 392.419 3.243 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc1[N+](=O)[O-] ZINC000280312901 1435632643 /nfs/dbraw/zinc/63/26/43/1435632643.db2.gz XWAAINPJPZMHFI-DZGCQCFKSA-N 0 0 387.440 3.413 20 5 GGBDRN Cc1cc(NC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000280358266 1435643612 /nfs/dbraw/zinc/64/36/12/1435643612.db2.gz CMJVLXFGZISLFZ-MRXNPFEDSA-N 0 0 376.434 3.060 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(NC(=O)C2CC2)cc1 ZINC000280362134 1435644695 /nfs/dbraw/zinc/64/46/95/1435644695.db2.gz BUVNVDWZXTZESG-UHFFFAOYSA-N 0 0 397.387 3.357 20 5 GGBDRN CC1(C)CN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[C@H]1O ZINC000280380291 1435648886 /nfs/dbraw/zinc/64/88/86/1435648886.db2.gz WVACDQNOJOLHIQ-LJQANCHMSA-N 0 0 384.432 3.407 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])sc1C ZINC000280422549 1435658280 /nfs/dbraw/zinc/65/82/80/1435658280.db2.gz LZRUATUCJXYYHG-CQSZACIVSA-N 0 0 391.449 3.362 20 5 GGBDRN Cc1noc(C)c1CSCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000280426685 1435658559 /nfs/dbraw/zinc/65/85/59/1435658559.db2.gz IPFBEDJNXIHIIR-UHFFFAOYSA-N 0 0 393.421 3.233 20 5 GGBDRN C[C@@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@]2(CCOC2)O1 ZINC000280430342 1435659916 /nfs/dbraw/zinc/65/99/16/1435659916.db2.gz ZZGKCVMYSHJKDY-FZKQIMNGSA-N 0 0 375.450 3.098 20 5 GGBDRN Cc1cc(OCC(=O)Nc2ccccc2N2CCC(CO)CC2)ccc1[N+](=O)[O-] ZINC000280437516 1435661015 /nfs/dbraw/zinc/66/10/15/1435661015.db2.gz APYZYUCBRPIWSK-UHFFFAOYSA-N 0 0 399.447 3.129 20 5 GGBDRN C[C@@H](C(=O)OC(C)(C)C)c1noc(-c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1 ZINC000280447393 1435662614 /nfs/dbraw/zinc/66/26/14/1435662614.db2.gz DBTDNJPSKNGMOK-LLVKDONJSA-N 0 0 385.380 3.276 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2Cc2ccc(OC)c([N+](=O)[O-])c2)sc1C ZINC000280453430 1435663413 /nfs/dbraw/zinc/66/34/13/1435663413.db2.gz NUQPMEDWGUORTJ-ZDUSSCGKSA-N 0 0 391.449 3.492 20 5 GGBDRN Cn1nc(C(F)F)c2cc(C(=O)NCCc3ccccc3[N+](=O)[O-])sc21 ZINC000280463881 1435665048 /nfs/dbraw/zinc/66/50/48/1435665048.db2.gz ONBFFABKGJLXNR-UHFFFAOYSA-N 0 0 380.376 3.453 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)c3c(OCC)cccc3[N+](=O)[O-])cc21 ZINC000280488874 1435668322 /nfs/dbraw/zinc/66/83/22/1435668322.db2.gz QELPQJUBDOQJJK-UHFFFAOYSA-N 0 0 398.419 3.338 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000280493314 1435669230 /nfs/dbraw/zinc/66/92/30/1435669230.db2.gz IHRYVJPBLMIKPU-CQSZACIVSA-N 0 0 398.419 3.120 20 5 GGBDRN CCC[C@@H](NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000280498073 1435669865 /nfs/dbraw/zinc/66/98/65/1435669865.db2.gz HMYYFJWOURZDDM-QAPCUYQASA-N 0 0 388.420 3.244 20 5 GGBDRN CCC[C@H](NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000280498070 1435669905 /nfs/dbraw/zinc/66/99/05/1435669905.db2.gz HMYYFJWOURZDDM-MAUKXSAKSA-N 0 0 388.420 3.244 20 5 GGBDRN CCc1cc(NC[C@@H]2CCCN(C(C)=O)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000280526654 1435673506 /nfs/dbraw/zinc/67/35/06/1435673506.db2.gz RGTZMYAUGXPUFW-HNNXBMFYSA-N 0 0 383.452 3.285 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)NC[C@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000280558640 1435679659 /nfs/dbraw/zinc/67/96/59/1435679659.db2.gz JKCBYSKRCACFEC-JTQLQIEISA-N 0 0 397.407 3.040 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c3nonc32)sc1C ZINC000280578085 1435682512 /nfs/dbraw/zinc/68/25/12/1435682512.db2.gz VZMGIDXWBXLQNV-NSHDSACASA-N 0 0 389.393 3.024 20 5 GGBDRN CN(CCCn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O)C(=O)OC(C)(C)C ZINC000280577150 1435682608 /nfs/dbraw/zinc/68/26/08/1435682608.db2.gz MIMGCYHFUHUPCO-UHFFFAOYSA-N 0 0 388.424 3.076 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])n1 ZINC000280579765 1435682928 /nfs/dbraw/zinc/68/29/28/1435682928.db2.gz WOIMZULGGCODRQ-CQSZACIVSA-N 0 0 399.831 3.295 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC[C@](C)(O)CC3)cc2[N+](=O)[O-])C1 ZINC000280602111 1435687074 /nfs/dbraw/zinc/68/70/74/1435687074.db2.gz OPTYMZQIXMIICA-MRUHUIDDSA-N 0 0 389.496 3.454 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@](C)(O)CC3)cc2[N+](=O)[O-])C1 ZINC000280602118 1435687212 /nfs/dbraw/zinc/68/72/12/1435687212.db2.gz OPTYMZQIXMIICA-ZOCZFRKYSA-N 0 0 389.496 3.454 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC(Oc2c(OC)cccc2OC)CC1 ZINC000280637897 1435694769 /nfs/dbraw/zinc/69/47/69/1435694769.db2.gz CZQFFSBRSTVVJH-UHFFFAOYSA-N 0 0 390.440 3.185 20 5 GGBDRN CCOc1cc(NC(=O)[C@H]2CC[C@H](C(=O)OC)CC2)c([N+](=O)[O-])cc1OCC ZINC000280673202 1435701982 /nfs/dbraw/zinc/70/19/82/1435701982.db2.gz COXPLOFUQUSXMP-JOCQHMNTSA-N 0 0 394.424 3.310 20 5 GGBDRN O=C(N[C@H]1C[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000280691696 1435704496 /nfs/dbraw/zinc/70/44/96/1435704496.db2.gz NJAPVKSTPXWMIU-QAQDUYKDSA-N 0 0 381.432 3.107 20 5 GGBDRN Cc1ccc([C@@H](NCc2ccc([N+](=O)[O-])cc2F)[C@@H](C)S(C)(=O)=O)cc1 ZINC000280729812 1435710588 /nfs/dbraw/zinc/71/05/88/1435710588.db2.gz GQPKAWQZKDXKTP-ACJLOTCBSA-N 0 0 380.441 3.306 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@]2(CCOC2)O1 ZINC000280739651 1435712444 /nfs/dbraw/zinc/71/24/44/1435712444.db2.gz ZMZVZXBSRYPSSN-PEBXRYMYSA-N 0 0 378.428 3.114 20 5 GGBDRN COCCc1nc2cc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)ccc2o1 ZINC000280770414 1435717374 /nfs/dbraw/zinc/71/73/74/1435717374.db2.gz JACDSQAJFUBKOZ-UHFFFAOYSA-N 0 0 385.376 3.251 20 5 GGBDRN CCC(=O)c1ccc(N2CCn3c(nnc3-c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000280812379 1435724795 /nfs/dbraw/zinc/72/47/95/1435724795.db2.gz XERDBNLKIDHTCA-UHFFFAOYSA-N 0 0 377.404 3.466 20 5 GGBDRN CCC(=O)c1ccc(N[C@@H](C)c2cccc(S(=O)(=O)NC)c2)c([N+](=O)[O-])c1 ZINC000280818429 1435725780 /nfs/dbraw/zinc/72/57/80/1435725780.db2.gz XSZPUUOEKPRAAE-LBPRGKRZSA-N 0 0 391.449 3.269 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](c1ccc(C)cc1)[C@@H](C)S(C)(=O)=O ZINC000280820703 1435726074 /nfs/dbraw/zinc/72/60/74/1435726074.db2.gz NGPYSRIVXBRJLS-AUUYWEPGSA-N 0 0 392.477 3.176 20 5 GGBDRN CCC(=O)c1ccc(N2CCC(C(=O)NCc3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC000280835786 1435728153 /nfs/dbraw/zinc/72/81/53/1435728153.db2.gz ZPNQAVGANKNAGO-UHFFFAOYSA-N 0 0 396.447 3.115 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)S[C@H](C)C(=O)OC(C)(C)C ZINC000280841997 1435729098 /nfs/dbraw/zinc/72/90/98/1435729098.db2.gz ATQUPDOCXVWEJN-GHMZBOCLSA-N 0 0 384.454 3.394 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)S[C@H](C)C(=O)OC(C)(C)C ZINC000280843087 1435729454 /nfs/dbraw/zinc/72/94/54/1435729454.db2.gz ATQUPDOCXVWEJN-WDEREUQCSA-N 0 0 384.454 3.394 20 5 GGBDRN Cc1cc(OCC(=O)Nc2cc(C(C)C)nn2-c2ncccn2)ccc1[N+](=O)[O-] ZINC000280845528 1435730131 /nfs/dbraw/zinc/73/01/31/1435730131.db2.gz CFFFFNCFHFSRKN-UHFFFAOYSA-N 0 0 396.407 3.020 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@](C)(O)c1ccccc1Cl ZINC000280888913 1435736800 /nfs/dbraw/zinc/73/68/00/1435736800.db2.gz CXWDZCAGRUFLRE-SFHVURJKSA-N 0 0 378.812 3.284 20 5 GGBDRN COc1cc(C(=O)N2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000280898051 1435738405 /nfs/dbraw/zinc/73/84/05/1435738405.db2.gz FCRDVRHJZUQUSH-OAHLLOKOSA-N 0 0 397.431 3.037 20 5 GGBDRN Cc1ccc([C@@H](NCc2cccc([N+](=O)[O-])c2C)[C@H](C)S(C)(=O)=O)cc1 ZINC000280943252 1435745381 /nfs/dbraw/zinc/74/53/81/1435745381.db2.gz WHULVCJJBZUMDC-KXBFYZLASA-N 0 0 376.478 3.476 20 5 GGBDRN O=c1[nH]c(NCc2ccnc(N3CCCCC3)c2)nc2ccc([N+](=O)[O-])cc21 ZINC000280954320 1435747159 /nfs/dbraw/zinc/74/71/59/1435747159.db2.gz KDJHMIRPIABGIN-UHFFFAOYSA-N 0 0 380.408 3.241 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CC[C@@H](OCc4ccncc4)C3)co2)cc1 ZINC000280985987 1435751903 /nfs/dbraw/zinc/75/19/03/1435751903.db2.gz LLMLEOAWNSWGMA-LJQANCHMSA-N 0 0 380.404 3.436 20 5 GGBDRN CC(C)n1nccc1[C@H]1OCC[C@@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000281012184 1435756213 /nfs/dbraw/zinc/75/62/13/1435756213.db2.gz RABBNERWLYGHSV-KXBFYZLASA-N 0 0 384.436 3.429 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](OCc2ccncc2)C1 ZINC000281024796 1435758402 /nfs/dbraw/zinc/75/84/02/1435758402.db2.gz OPZGWHSQHNKVKC-RDTXWAMCSA-N 0 0 395.419 3.392 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)c2cccc([N+](=O)[O-])c2C)[C@H](C)S(C)(=O)=O)cc1 ZINC000281040613 1435761540 /nfs/dbraw/zinc/76/15/40/1435761540.db2.gz RDOJEUSPJAODPB-KSSFIOAISA-N 0 0 390.461 3.116 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2cccc([N+](=O)[O-])c2C)[C@@H](C)S(C)(=O)=O)cc1 ZINC000281040616 1435761917 /nfs/dbraw/zinc/76/19/17/1435761917.db2.gz RDOJEUSPJAODPB-RDTXWAMCSA-N 0 0 390.461 3.116 20 5 GGBDRN C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@]2(CCOC2)O1 ZINC000281048220 1435762673 /nfs/dbraw/zinc/76/26/73/1435762673.db2.gz ONKUQAWETQPPBV-BONVTDFDSA-N 0 0 389.330 3.025 20 5 GGBDRN C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@]2(CCOC2)O1 ZINC000281048214 1435763012 /nfs/dbraw/zinc/76/30/12/1435763012.db2.gz ONKUQAWETQPPBV-BMIGLBTASA-N 0 0 389.330 3.025 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000281050901 1435763368 /nfs/dbraw/zinc/76/33/68/1435763368.db2.gz HVGOOZLXMZIVRY-UHFFFAOYSA-N 0 0 394.431 3.333 20 5 GGBDRN CC(C)C(=O)NC1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC1 ZINC000281050969 1435763517 /nfs/dbraw/zinc/76/35/17/1435763517.db2.gz XNYJICYXGNUNFY-UHFFFAOYSA-N 0 0 396.447 3.034 20 5 GGBDRN O=C(NC1CCN(c2nccs2)CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000281052310 1435763893 /nfs/dbraw/zinc/76/38/93/1435763893.db2.gz GPSMDADJRQFOKA-UHFFFAOYSA-N 0 0 387.465 3.024 20 5 GGBDRN O=c1[nH]c(NC[C@H]2CCN(c3ccc(F)cc3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000281067399 1435767401 /nfs/dbraw/zinc/76/74/01/1435767401.db2.gz ZYONLINDVPZEOE-GFCCVEGCSA-N 0 0 383.383 3.321 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](c1cccc(F)c1)[NH+](C)C ZINC000281077060 1435768791 /nfs/dbraw/zinc/76/87/91/1435768791.db2.gz CFFBYFFCGTYIOE-MRXNPFEDSA-N 0 0 375.400 3.165 20 5 GGBDRN NC(=O)C[C@H](NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CCCCC1 ZINC000281083026 1435770937 /nfs/dbraw/zinc/77/09/37/1435770937.db2.gz CWGYEZYZCXDTIZ-KRWDZBQOSA-N 0 0 396.447 3.211 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)c1 ZINC000281087939 1435771301 /nfs/dbraw/zinc/77/13/01/1435771301.db2.gz JXZVSEAXUGGABW-AWEZNQCLSA-N 0 0 399.472 3.442 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])[C@H](C)S(C)(=O)=O)cc1 ZINC000281089059 1435772381 /nfs/dbraw/zinc/77/23/81/1435772381.db2.gz CXBXUVQOTHDCSV-KBXCAEBGSA-N 0 0 390.461 3.116 20 5 GGBDRN Cn1ncc2c1C[C@H](C(=O)Nc1nc(-c3cccc([N+](=O)[O-])c3)cs1)CC2 ZINC000281093589 1435772464 /nfs/dbraw/zinc/77/24/64/1435772464.db2.gz VNIJNUTXSPSTEP-GFCCVEGCSA-N 0 0 383.433 3.195 20 5 GGBDRN COC(=O)[C@H](C)N(C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CCC1 ZINC000281097196 1435773329 /nfs/dbraw/zinc/77/33/29/1435773329.db2.gz FMRGTUAPDIOJPB-ZDUSSCGKSA-N 0 0 383.404 3.213 20 5 GGBDRN Cc1cc(OCC(=O)O[C@@H]([C@H]2CCCOC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000281101208 1435774835 /nfs/dbraw/zinc/77/48/35/1435774835.db2.gz MMBHZMGQTXSVOO-NHYWBVRUSA-N 0 0 377.315 3.183 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)[C@H](C)S(C)(=O)=O)cc1 ZINC000281123605 1435779072 /nfs/dbraw/zinc/77/90/72/1435779072.db2.gz XBJCGHNGYHDOOI-KSSFIOAISA-N 0 0 390.461 3.116 20 5 GGBDRN Cc1nc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)cn2n1 ZINC000281123778 1435779196 /nfs/dbraw/zinc/77/91/96/1435779196.db2.gz IJXUIFXRZLCPPP-UHFFFAOYSA-N 0 0 380.408 3.189 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C1CCN(CC(F)(F)F)CC1 ZINC000281122861 1435779604 /nfs/dbraw/zinc/77/96/04/1435779604.db2.gz BKNCGUXLQKILJX-UHFFFAOYSA-N 0 0 375.347 3.206 20 5 GGBDRN O=c1[nH]c(N2CCC[C@@H]2c2cccc3c2OCCO3)nc2ccc([N+](=O)[O-])cc21 ZINC000281134308 1435781589 /nfs/dbraw/zinc/78/15/89/1435781589.db2.gz JBJDNEZFVWKDDW-MRXNPFEDSA-N 0 0 394.387 3.356 20 5 GGBDRN COc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cc1[N+](=O)[O-] ZINC000281167527 1435788111 /nfs/dbraw/zinc/78/81/11/1435788111.db2.gz KXNNNLUKHJYVJJ-SCNOPHJPSA-N 0 0 391.468 3.075 20 5 GGBDRN COCC[C@@H](CO)NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000281171000 1435788703 /nfs/dbraw/zinc/78/87/03/1435788703.db2.gz BOVGITJAVZNXDU-AWEZNQCLSA-N 0 0 394.811 3.168 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)Nc3ccncc3C)CC2)ccc1[N+](=O)[O-] ZINC000281177697 1435790281 /nfs/dbraw/zinc/79/02/81/1435790281.db2.gz XUBWHCWIZXVUJY-UHFFFAOYSA-N 0 0 385.424 3.051 20 5 GGBDRN Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000281180723 1435790675 /nfs/dbraw/zinc/79/06/75/1435790675.db2.gz IPPGLTNLRANCDR-UHFFFAOYSA-N 0 0 398.419 3.128 20 5 GGBDRN CC(C)(C)Nc1ccccc1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000281194541 1435794013 /nfs/dbraw/zinc/79/40/13/1435794013.db2.gz BSQJLYYXDDZOFS-UHFFFAOYSA-N 0 0 384.392 3.352 20 5 GGBDRN Cc1cc(OCC(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000281205193 1435795513 /nfs/dbraw/zinc/79/55/13/1435795513.db2.gz SBSNPANEKNALQG-APWZRJJASA-N 0 0 388.395 3.458 20 5 GGBDRN CN(C(=O)[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000281205086 1435795698 /nfs/dbraw/zinc/79/56/98/1435795698.db2.gz TUXIWWPLGFGHAY-CYBMUJFWSA-N 0 0 387.823 3.373 20 5 GGBDRN Cc1cc(OCC(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000281205208 1435795750 /nfs/dbraw/zinc/79/57/50/1435795750.db2.gz SBSNPANEKNALQG-QFBILLFUSA-N 0 0 388.395 3.458 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@@H](c3nc4cc(C)ccc4[nH]3)C2)n1 ZINC000281218236 1435798523 /nfs/dbraw/zinc/79/85/23/1435798523.db2.gz QXDVZVAZLBUFCZ-CYBMUJFWSA-N 0 0 395.419 3.345 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cc1[N+](=O)[O-] ZINC000281247363 1435800747 /nfs/dbraw/zinc/80/07/47/1435800747.db2.gz DJPSXUBNPFRCGY-DQADVMEASA-N 0 0 391.424 3.213 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](O)c1cccc(OC(C)C)c1 ZINC000281252055 1435800847 /nfs/dbraw/zinc/80/08/47/1435800847.db2.gz OJNUJOCGKHDOSP-KRWDZBQOSA-N 0 0 388.420 3.244 20 5 GGBDRN COc1ccc2c(C)c(CCC(=O)N(C)c3ccc([N+](=O)[O-])nc3)c(=O)oc2c1 ZINC000281250825 1435800875 /nfs/dbraw/zinc/80/08/75/1435800875.db2.gz ULLRXLIGUMXJDU-UHFFFAOYSA-N 0 0 397.387 3.009 20 5 GGBDRN O=C(NC1CCN(c2nccs2)CC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000281269524 1435801643 /nfs/dbraw/zinc/80/16/43/1435801643.db2.gz MRCOOSDIHJDOOI-UHFFFAOYSA-N 0 0 398.391 3.052 20 5 GGBDRN O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N1CCS[C@H]2COCC[C@@H]21 ZINC000281283900 1435802349 /nfs/dbraw/zinc/80/23/49/1435802349.db2.gz XFKCUVVPPBTIIK-HOTGVXAUSA-N 0 0 385.445 3.003 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O ZINC000281286987 1435802533 /nfs/dbraw/zinc/80/25/33/1435802533.db2.gz CFCIJDZLIVYAOR-SDNTUTLCSA-N 0 0 377.441 3.397 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OCCCOC)nc1 ZINC000281309086 1435803339 /nfs/dbraw/zinc/80/33/39/1435803339.db2.gz JMJKKJKFOFIRAA-UHFFFAOYSA-N 0 0 375.381 3.056 20 5 GGBDRN CCCOc1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)cc1 ZINC000281327211 1435803994 /nfs/dbraw/zinc/80/39/94/1435803994.db2.gz BOGMXDHPKHPTQI-UHFFFAOYSA-N 0 0 387.392 3.360 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCCc2sccc21 ZINC000281335878 1435804301 /nfs/dbraw/zinc/80/43/01/1435804301.db2.gz CILHQDKKOQZYLG-CYBMUJFWSA-N 0 0 389.433 3.187 20 5 GGBDRN Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000281347287 1435804895 /nfs/dbraw/zinc/80/48/95/1435804895.db2.gz LVLICELDUVECII-GOSISDBHSA-N 0 0 383.404 3.073 20 5 GGBDRN CCOC(=O)[C@]1(COC)CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000281382042 1435806462 /nfs/dbraw/zinc/80/64/62/1435806462.db2.gz PELMFVAXJRWMRM-QGZVFWFLSA-N 0 0 399.831 3.072 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccc(N2CCCC2=O)cc1 ZINC000281385498 1435806551 /nfs/dbraw/zinc/80/65/51/1435806551.db2.gz NXQLZTYMZDHOIM-UHFFFAOYSA-N 0 0 399.403 3.138 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1CN1CCOCC1 ZINC000281385503 1435806617 /nfs/dbraw/zinc/80/66/17/1435806617.db2.gz NXTBFPZKFGGPRX-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN C[C@]1(C(N)=O)CCN(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000281389129 1435806839 /nfs/dbraw/zinc/80/68/39/1435806839.db2.gz NCPNKOHUOVEIHX-IBGZPJMESA-N 0 0 384.392 3.116 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)cc1[N+](=O)[O-] ZINC000281456862 1435809640 /nfs/dbraw/zinc/80/96/40/1435809640.db2.gz SKIBXKLGFZSCAI-LJQANCHMSA-N 0 0 397.431 3.327 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCSC[C@@H]2c2nccs2)c1 ZINC000281485077 1435810854 /nfs/dbraw/zinc/81/08/54/1435810854.db2.gz HDSHUTDOXZEPAJ-CQSZACIVSA-N 0 0 393.490 3.445 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)N2C ZINC000281496479 1435811221 /nfs/dbraw/zinc/81/12/21/1435811221.db2.gz VPKWIIYBEIIEGR-LLVKDONJSA-N 0 0 384.392 3.023 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000281498065 1435811271 /nfs/dbraw/zinc/81/12/71/1435811271.db2.gz HRGCCWIPKQRYCF-OAHLLOKOSA-N 0 0 399.451 3.074 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000281498051 1435811327 /nfs/dbraw/zinc/81/13/27/1435811327.db2.gz HRGCCWIPKQRYCF-HNNXBMFYSA-N 0 0 399.451 3.074 20 5 GGBDRN CCC(=O)c1ccc(N2CCC(c3nnc4n3CCCC4)CC2)c([N+](=O)[O-])c1 ZINC000281552933 1435813293 /nfs/dbraw/zinc/81/32/93/1435813293.db2.gz TWZDQWAXFJWMNT-UHFFFAOYSA-N 0 0 383.452 3.499 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1cccs1)C1CC1 ZINC000281661260 1435817529 /nfs/dbraw/zinc/81/75/29/1435817529.db2.gz KADNRBYSUBBTDW-UHFFFAOYSA-N 0 0 389.433 3.185 20 5 GGBDRN CCCN(C(=O)c1ccc(OC)c(N2CCNC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000281665649 1435817581 /nfs/dbraw/zinc/81/75/81/1435817581.db2.gz DGZRQQVBQACDFZ-UHFFFAOYSA-N 0 0 398.419 3.190 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)c1 ZINC000281668364 1435817761 /nfs/dbraw/zinc/81/77/61/1435817761.db2.gz SZQXVHMSFDZNSI-SJLPKXTDSA-N 0 0 386.448 3.343 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1 ZINC000281671912 1435817900 /nfs/dbraw/zinc/81/79/00/1435817900.db2.gz TZKWQYUJQCGEOU-UHFFFAOYSA-N 0 0 389.383 3.152 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccccc1)C1CC1 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DQENVTWEPVUZCY-HOTGVXAUSA-N 0 0 378.473 3.000 20 5 GGBDRN O=C(NCC1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1)C(F)(F)F ZINC000281757567 1435820932 /nfs/dbraw/zinc/82/09/32/1435820932.db2.gz FZHKYIDAOIZFFX-UHFFFAOYSA-N 0 0 382.342 3.038 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000281772591 1435821505 /nfs/dbraw/zinc/82/15/05/1435821505.db2.gz TXKRGPWSDPCECT-CQSZACIVSA-N 0 0 398.872 3.381 20 5 GGBDRN CCn1ncc2cc(C(=O)Nc3cc(C(=O)OC)cc([N+](=O)[O-])c3C)c(C)nc21 ZINC000281835479 1435823648 /nfs/dbraw/zinc/82/36/48/1435823648.db2.gz MOGSUCMIOANFRD-UHFFFAOYSA-N 0 0 397.391 3.015 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(CCc2ccccn2)Cc2ccncc2)c1[N+](=O)[O-] ZINC000281845540 1435824054 /nfs/dbraw/zinc/82/40/54/1435824054.db2.gz RLYXJDXUXMPPNT-UHFFFAOYSA-N 0 0 394.435 3.116 20 5 GGBDRN Cc1cc(NC(=O)[C@@H](C)SCC(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)no1 ZINC000281872944 1435825030 /nfs/dbraw/zinc/82/50/30/1435825030.db2.gz CQUNNBFKIQFNEM-SNVBAGLBSA-N 0 0 396.400 3.038 20 5 GGBDRN 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CC(C)c1n[nH]c(C(=O)N2CCC(N3CCc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000281952115 1435828289 /nfs/dbraw/zinc/82/82/89/1435828289.db2.gz ANJXQLJBTNYEHE-UHFFFAOYSA-N 0 0 383.452 3.109 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[S@@](=O)Cc1ccccc1 ZINC000281966101 1435828758 /nfs/dbraw/zinc/82/87/58/1435828758.db2.gz NLOXAKZEISAVJX-HHHXNRCGSA-N 0 0 391.449 3.064 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[S@](=O)Cc1ccccc1 ZINC000281966104 1435828784 /nfs/dbraw/zinc/82/87/84/1435828784.db2.gz NLOXAKZEISAVJX-MHZLTWQESA-N 0 0 391.449 3.064 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOC[C@H]1c1nc(C)cs1 ZINC000281976263 1435829305 /nfs/dbraw/zinc/82/93/05/1435829305.db2.gz OJYYFLKDGKSTMQ-AWEZNQCLSA-N 0 0 392.437 3.364 20 5 GGBDRN CN(C(=O)[C@H]1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1)c1ccccc1 ZINC000281988272 1435829830 /nfs/dbraw/zinc/82/98/30/1435829830.db2.gz ZNHOKXITAPIHJK-ZDUSSCGKSA-N 0 0 387.823 3.373 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)NCCc2ccccc2[N+](=O)[O-])C1 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399.403 3.147 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(CC)c(C(=O)OC)s2)c1 ZINC000282850953 1435863029 /nfs/dbraw/zinc/86/30/29/1435863029.db2.gz NVLNCMZZAXBSIR-UHFFFAOYSA-N 0 0 379.394 3.051 20 5 GGBDRN COc1ccc([C@@H](C)N(C)C(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)cc1 ZINC000282856083 1435863148 /nfs/dbraw/zinc/86/31/48/1435863148.db2.gz SMMDMOPOWLAASS-GFCCVEGCSA-N 0 0 389.383 3.209 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3CCCC4(CC4)C3)n2C[C@H]2CCOC2)c1 ZINC000282885732 1435864685 /nfs/dbraw/zinc/86/46/85/1435864685.db2.gz BIEFVWNWSLDPFJ-OAHLLOKOSA-N 0 0 383.452 3.270 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(c2ncc(C(=O)OC)s2)C2CC2)c1 ZINC000282892988 1435864909 /nfs/dbraw/zinc/86/49/09/1435864909.db2.gz SQDNIKSIWBHDQG-UHFFFAOYSA-N 0 0 391.405 3.046 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CN3CCOCC3)cc2)c1 ZINC000282903699 1435865405 /nfs/dbraw/zinc/86/54/05/1435865405.db2.gz UOFRAMZSGCGNNM-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN 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ZINC000283074952 1435873221 /nfs/dbraw/zinc/87/32/21/1435873221.db2.gz DFCFTYNOUDKLKG-KPKJPENVSA-N 0 0 393.443 3.201 20 5 GGBDRN O=C(NCCc1cccs1)C1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283095344 1435874307 /nfs/dbraw/zinc/87/43/07/1435874307.db2.gz LMOHLMOXTWMTLP-UHFFFAOYSA-N 0 0 391.468 3.366 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000283125658 1435875794 /nfs/dbraw/zinc/87/57/94/1435875794.db2.gz NGTGEWMRKHJWNQ-UHFFFAOYSA-N 0 0 398.394 3.258 20 5 GGBDRN CC(=O)N1CCN(c2cccc(NC(=O)c3cccc([N+](=O)[O-])c3C)c2C)C1=O ZINC000283133953 1435876087 /nfs/dbraw/zinc/87/60/87/1435876087.db2.gz UDVKOOFYHVPASB-UHFFFAOYSA-N 0 0 396.403 3.252 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(N3C(=O)CCNC3=O)c2C)cc1[N+](=O)[O-] ZINC000283194093 1435878673 /nfs/dbraw/zinc/87/86/73/1435878673.db2.gz FXLQWJQEROXUAX-UHFFFAOYSA-N 0 0 396.403 3.164 20 5 GGBDRN O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283227288 1435880158 /nfs/dbraw/zinc/88/01/58/1435880158.db2.gz 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GGBDRN CCOCCOCc1cccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c1 ZINC000283359170 1435885980 /nfs/dbraw/zinc/88/59/80/1435885980.db2.gz DAHUMDMZDPWTDL-UHFFFAOYSA-N 0 0 377.372 3.122 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(N3C[C@@H]4CCC[C@@H]4C3)n2C[C@H]2CCOC2)cc1 ZINC000283372316 1435886579 /nfs/dbraw/zinc/88/65/79/1435886579.db2.gz MERAZAYTCGJAEK-OIISXLGYSA-N 0 0 383.452 3.126 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1 ZINC000283377721 1435886844 /nfs/dbraw/zinc/88/68/44/1435886844.db2.gz FLWOLSJZSRIRDL-UHFFFAOYSA-N 0 0 389.383 3.222 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000283379661 1435887013 /nfs/dbraw/zinc/88/70/13/1435887013.db2.gz KBCHJMOMSKIBJK-IPELMVKDSA-N 0 0 379.416 3.344 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(C(F)(F)F)(C(F)(F)F)C2)n1 ZINC000283434090 1435889574 /nfs/dbraw/zinc/88/95/74/1435889574.db2.gz BTVABMIBMMMZPN-UHFFFAOYSA-N 0 0 387.236 3.098 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3CCC4(CCC4)C3)n2C[C@@H]2CCOC2)c1 ZINC000283455196 1435890625 /nfs/dbraw/zinc/89/06/25/1435890625.db2.gz RIIJKPRBMUIYDS-HNNXBMFYSA-N 0 0 383.452 3.270 20 5 GGBDRN O=C(c1cccc(F)c1)N1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000283486191 1435892097 /nfs/dbraw/zinc/89/20/97/1435892097.db2.gz JLNMAUIHCXDLEV-UHFFFAOYSA-N 0 0 375.375 3.221 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3C[C@@H]4CCC[C@@H]4C3)n2C[C@H]2CCCO2)c1 ZINC000283497065 1435892592 /nfs/dbraw/zinc/89/25/92/1435892592.db2.gz QPQYFQABJYJXOS-SOLBZPMBSA-N 0 0 383.452 3.269 20 5 GGBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000283521359 1435893713 /nfs/dbraw/zinc/89/37/13/1435893713.db2.gz NNVUSLBGMZTSIG-QGZVFWFLSA-N 0 0 383.383 3.107 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCCCCOCCc1ccccc1 ZINC000283549640 1435894999 /nfs/dbraw/zinc/89/49/99/1435894999.db2.gz TVBREHHNQCMQCV-UHFFFAOYSA-N 0 0 375.400 3.085 20 5 GGBDRN COCCOCc1cc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)ccc1F ZINC000283549984 1435895001 /nfs/dbraw/zinc/89/50/01/1435895001.db2.gz IWRUPCJHKZRDDX-UHFFFAOYSA-N 0 0 390.411 3.212 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3C[C@@H]4CCC[C@@H]4C3)n2C[C@H]2CCOC2)c1 ZINC000283565375 1435895763 /nfs/dbraw/zinc/89/57/63/1435895763.db2.gz ZLAUTGYGEJFZGU-OIISXLGYSA-N 0 0 383.452 3.126 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)c1 ZINC000283565728 1435895826 /nfs/dbraw/zinc/89/58/26/1435895826.db2.gz VFTLFIRINGPBLC-HNNXBMFYSA-N 0 0 399.447 3.258 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)c1 ZINC000283569472 1435895930 /nfs/dbraw/zinc/89/59/30/1435895930.db2.gz VNNGAAAFGVBLGD-AWEZNQCLSA-N 0 0 387.411 3.389 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1nc(CN2CCCCC2)cs1 ZINC000283597761 1435897207 /nfs/dbraw/zinc/89/72/07/1435897207.db2.gz XZBIBHKVVPPGOE-UHFFFAOYSA-N 0 0 379.417 3.011 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nnc4ccccn43)C2)c1 ZINC000283613698 1435897909 /nfs/dbraw/zinc/89/79/09/1435897909.db2.gz ZOLJBDRNKYNWIH-AWEZNQCLSA-N 0 0 395.419 3.056 20 5 GGBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000283641964 1435899144 /nfs/dbraw/zinc/89/91/44/1435899144.db2.gz XLENTWIEBDQXMO-QGZVFWFLSA-N 0 0 383.383 3.107 20 5 GGBDRN Cc1ccc(CS(=O)(=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000283746133 1435915152 /nfs/dbraw/zinc/91/51/52/1435915152.db2.gz FGNGCJGVTCZRNC-UHFFFAOYSA-N 0 0 376.434 3.155 20 5 GGBDRN CC(C)c1[nH]nc(-c2nc(C(C)(C)NC(=O)OC(C)(C)C)no2)c1[N+](=O)[O-] ZINC000283757460 1435917902 /nfs/dbraw/zinc/91/79/02/1435917902.db2.gz AXRQJWLPUZUFLK-UHFFFAOYSA-N 0 0 380.405 3.251 20 5 GGBDRN Cc1cc(=O)c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cn1C1CC1 ZINC000283764611 1435919019 /nfs/dbraw/zinc/91/90/19/1435919019.db2.gz QMFFWAJQZWEGMY-UHFFFAOYSA-N 0 0 375.812 3.325 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000283778974 1435922423 /nfs/dbraw/zinc/92/24/23/1435922423.db2.gz QWUSNOIZUVHMLM-SJORKVTESA-N 0 0 382.420 3.015 20 5 GGBDRN CCOC(=O)[C@H](C)NC(=O)c1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1F ZINC000283789074 1435924431 /nfs/dbraw/zinc/92/44/31/1435924431.db2.gz FKLVYQICQMIZJB-LBPRGKRZSA-N 0 0 389.383 3.027 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCN([C@@H](C)c3nccs3)CC2)c1F ZINC000283807245 1435927700 /nfs/dbraw/zinc/92/77/00/1435927700.db2.gz BUGJPWJIHRMLJO-LBPRGKRZSA-N 0 0 378.429 3.018 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC12CCCCC2 ZINC000283813920 1435929164 /nfs/dbraw/zinc/92/91/64/1435929164.db2.gz RZOWZSKQBUQEQB-AWEZNQCLSA-N 0 0 394.493 3.431 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1nc(C2(c3ccccc3F)CCCC2)no1 ZINC000283813514 1435929234 /nfs/dbraw/zinc/92/92/34/1435929234.db2.gz JFELNKBSPACJQO-UHFFFAOYSA-N 0 0 384.367 3.187 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nncn3C(C)C)C2)c1 ZINC000283874958 1435941575 /nfs/dbraw/zinc/94/15/75/1435941575.db2.gz HYSVXHYXORFCLT-AWEZNQCLSA-N 0 0 387.440 3.186 20 5 GGBDRN COc1cc([C@H](C)NCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc(OC)c1OC ZINC000283875234 1435941866 /nfs/dbraw/zinc/94/18/66/1435941866.db2.gz ALDCRSDWKMPYJM-NSHDSACASA-N 0 0 391.380 3.380 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC2(CCOCC2)CC1 ZINC000283983235 1435967182 /nfs/dbraw/zinc/96/71/82/1435967182.db2.gz CWDHRVNXEQCUSG-CYBMUJFWSA-N 0 0 381.860 3.468 20 5 GGBDRN Cc1cc(F)c(NC(=O)NCCc2cccc(C(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000283998670 1435970716 /nfs/dbraw/zinc/97/07/16/1435970716.db2.gz NDGSUVNWBAUHQK-UHFFFAOYSA-N 0 0 388.399 3.108 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2c2nc(Cc3cccnc3)no2)ccc1[N+](=O)[O-] ZINC000284000048 1435970887 /nfs/dbraw/zinc/97/08/87/1435970887.db2.gz QDLJIIAWGXIOQH-KRWDZBQOSA-N 0 0 393.403 3.249 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCC(=O)N2CCc3ccccc32)c1 ZINC000284015180 1435973370 /nfs/dbraw/zinc/97/33/70/1435973370.db2.gz OHEIKYYZNPFWQT-UHFFFAOYSA-N 0 0 397.431 3.093 20 5 GGBDRN CCC(CC)n1ccc(C[S@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000284016466 1435973400 /nfs/dbraw/zinc/97/34/00/1435973400.db2.gz ZPXFPNAHWWODDD-HHHXNRCGSA-N 0 0 392.481 3.430 20 5 GGBDRN CC[C@H](c1ccccc1)S(=O)(=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000284021667 1435973962 /nfs/dbraw/zinc/97/39/62/1435973962.db2.gz ZYIKWQCITNJRFG-QGZVFWFLSA-N 0 0 376.434 3.490 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284067716 1435984433 /nfs/dbraw/zinc/98/44/33/1435984433.db2.gz KMRKCVCFJVQQRD-GWQKEKGPSA-N 0 0 377.422 3.433 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(C(=O)Nc1cccc([N+](=O)[O-])c1Cl)CC2 ZINC000284067823 1435984508 /nfs/dbraw/zinc/98/45/08/1435984508.db2.gz QSZHSIKERNCKBX-KBPBESRZSA-N 0 0 383.832 3.032 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)Nc1cccc([N+](=O)[O-])c1Cl)CC2 ZINC000284067844 1435984724 /nfs/dbraw/zinc/98/47/24/1435984724.db2.gz QSZHSIKERNCKBX-ZIAGYGMSSA-N 0 0 383.832 3.032 20 5 GGBDRN Cc1cc(F)c(NC(=O)N2CCO[C@@H](c3nnc(C(C)C)o3)C2)cc1[N+](=O)[O-] ZINC000284074524 1435985817 /nfs/dbraw/zinc/98/58/17/1435985817.db2.gz RBQNEIBJFRFISG-CQSZACIVSA-N 0 0 393.375 3.154 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NCCC2(O)CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000284087087 1435988225 /nfs/dbraw/zinc/98/82/25/1435988225.db2.gz LSEYNAWHOVCWDG-AWEZNQCLSA-N 0 0 384.436 3.198 20 5 GGBDRN CC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])cc(C)c2F)CC12CCCCC2 ZINC000284206979 1436003889 /nfs/dbraw/zinc/00/38/89/1436003889.db2.gz MUUPMWXCEATOLQ-UHFFFAOYSA-N 0 0 377.416 3.050 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[C@@H](O)c2ccc(F)cc2)c1 ZINC000284225764 1436005387 /nfs/dbraw/zinc/00/53/87/1436005387.db2.gz BFSXIHFHYHVPSR-KPZWWZAWSA-N 0 0 376.384 3.375 20 5 GGBDRN O=C(C[C@@H]1COCCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccs1 ZINC000284237503 1436006043 /nfs/dbraw/zinc/00/60/43/1436006043.db2.gz VKLWWEKCLFPPKY-CQSZACIVSA-N 0 0 391.405 3.038 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000284325343 1436013425 /nfs/dbraw/zinc/01/34/25/1436013425.db2.gz IHAWWDNAUPRHOV-UGSOOPFHSA-N 0 0 391.374 3.184 20 5 GGBDRN O=[N+]([O-])c1ccc(CSc2nnc(NC[C@H]3CCCO3)s2)c([N+](=O)[O-])c1 ZINC000284333879 1436013899 /nfs/dbraw/zinc/01/38/99/1436013899.db2.gz UTVYOTZWGYJCOI-LLVKDONJSA-N 0 0 397.438 3.238 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)NCc2cccc(CN3CCCC3=O)c2)c1F ZINC000284347009 1436014999 /nfs/dbraw/zinc/01/49/99/1436014999.db2.gz PVJGRXSVTUHNLH-UHFFFAOYSA-N 0 0 385.395 3.095 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1 ZINC000284363031 1436016084 /nfs/dbraw/zinc/01/60/84/1436016084.db2.gz KURIZYZXOWNLTM-UHFFFAOYSA-N 0 0 385.420 3.207 20 5 GGBDRN CCn1c(-c2ccccn2)nnc1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000284424674 1436020715 /nfs/dbraw/zinc/02/07/15/1436020715.db2.gz OXFQLKXZZLFJMD-UHFFFAOYSA-N 0 0 394.435 3.316 20 5 GGBDRN O=c1cc(O)nc(SCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1C1CCCC1 ZINC000284425492 1436020833 /nfs/dbraw/zinc/02/08/33/1436020833.db2.gz OLRXNWNAYKOSPB-UHFFFAOYSA-N 0 0 392.393 3.173 20 5 GGBDRN CC(C)n1nccc1[C@H]1OCC[C@@H]1Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000284430065 1436021352 /nfs/dbraw/zinc/02/13/52/1436021352.db2.gz AMODJRIQTDRRAD-DJJJIMSYSA-N 0 0 385.424 3.199 20 5 GGBDRN CCC[C@H](Nc1cccc(C(=O)N(C)CC(N)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000284437097 1436021670 /nfs/dbraw/zinc/02/16/70/1436021670.db2.gz SLRHRXSRKRSAOX-SFHVURJKSA-N 0 0 384.436 3.105 20 5 GGBDRN CCn1c(-c2cccnc2)nnc1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000284529745 1436028278 /nfs/dbraw/zinc/02/82/78/1436028278.db2.gz WSSMERYHZJWDFD-UHFFFAOYSA-N 0 0 394.435 3.316 20 5 GGBDRN Cc1nc(C)n(C2CN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])C2)n1 ZINC000284539136 1436028817 /nfs/dbraw/zinc/02/88/17/1436028817.db2.gz AWADFRLYCOPDTD-UHFFFAOYSA-N 0 0 377.404 3.095 20 5 GGBDRN C[C@@]12CCN(C(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)C[C@@H]1C2(Cl)Cl ZINC000284536243 1436028831 /nfs/dbraw/zinc/02/88/31/1436028831.db2.gz PGEGLUPKRGLPQL-GOEBONIOSA-N 0 0 395.246 3.436 20 5 GGBDRN C[C@]1(C2CC2)NC(=O)N(c2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2)C1=O ZINC000284643870 1436036849 /nfs/dbraw/zinc/03/68/49/1436036849.db2.gz VWFAAYODCADDFH-HXUWFJFHSA-N 0 0 394.387 3.072 20 5 GGBDRN CC(C)n1nccc1[C@H]1OCC[C@@H]1NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000284696728 1436040953 /nfs/dbraw/zinc/04/09/53/1436040953.db2.gz BJUUWXAIHUQOKY-HOCLYGCPSA-N 0 0 394.378 3.110 20 5 GGBDRN COCC1(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)CCC1 ZINC000284724421 1436043748 /nfs/dbraw/zinc/04/37/48/1436043748.db2.gz BECBTZGEQXFOFS-AWEZNQCLSA-N 0 0 384.436 3.462 20 5 GGBDRN C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC000820761582 1441683367 /nfs/dbraw/zinc/68/33/67/1441683367.db2.gz XZMWROBTNWSFRN-RHSMWYFYSA-N 0 0 393.451 3.097 20 5 GGBDRN C[C@@H](c1ccc(-c2nnn[n-]2)cc1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000820555774 1442367424 /nfs/dbraw/zinc/36/74/24/1442367424.db2.gz PMZMSEWSGAUYBH-AWEZNQCLSA-N 0 0 394.435 3.379 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1Nc1ccc(CC[NH+]2CCCC2)cc1 ZINC000738360561 1443558208 /nfs/dbraw/zinc/55/82/08/1443558208.db2.gz YEXUCIYQGLJIRK-UHFFFAOYSA-N 0 0 379.424 3.157 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNC1(c2cccc(-c3nn[n-]n3)c2)CC1 ZINC000824334510 1446719471 /nfs/dbraw/zinc/71/94/71/1446719471.db2.gz WOOZPVOBUCBXDB-UHFFFAOYSA-N 0 0 394.435 3.341 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000823629696 1446970675 /nfs/dbraw/zinc/97/06/75/1446970675.db2.gz FDYOEEKZKCZOHV-UHFFFAOYSA-N 0 0 393.451 3.373 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1Cc1ccc(Nc2ncc([N+](=O)[O-])cc2-c2nnn[n-]2)cc1 ZINC000824941633 1447040607 /nfs/dbraw/zinc/04/06/07/1447040607.db2.gz ZHVSNLCMQXNTRU-CYBMUJFWSA-N 0 0 394.439 3.288 20 5 GGBDRN Cc1ccc([C@H](C)[NH2+]CCCOc2ccc(-c3nn[n-]n3)cc2)cc1[N+](=O)[O-] ZINC000826283110 1450460760 /nfs/dbraw/zinc/46/07/60/1450460760.db2.gz KNZBZCCLYNYTSN-AWEZNQCLSA-N 0 0 382.424 3.203 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC3(CC2)CN(Cc2cccs2)CCO3)c(F)c1 ZINC001164695259 719890817 /nfs/dbraw/zinc/89/08/17/719890817.db2.gz KDRANTXBXRDDQJ-UHFFFAOYSA-N 0 0 392.456 3.062 20 5 GGBDRN O=[N+]([O-])c1cnc(Cl)c(C(F)(F)N2CC[C@H](O)[C@@H]2Cc2ccccc2)c1 ZINC001164835545 720487746 /nfs/dbraw/zinc/48/77/46/720487746.db2.gz ZHZQWZZMHGBBNT-GJZGRUSLSA-N 0 0 383.782 3.370 20 5 GGBDRN COC[C@]12CCCO[C@H]1CCN(C(F)(F)c1ccc([N+](=O)[O-])c(Cl)n1)C2 ZINC001164852083 720825337 /nfs/dbraw/zinc/82/53/37/720825337.db2.gz YTJLLLMBQIWDCH-DZGCQCFKSA-N 0 0 391.802 3.210 20 5 GGBDRN CN(Cc1ccco1)Cc1cncc2c1CCN(c1ncc([N+](=O)[O-])cc1F)C2 ZINC001164907784 721750816 /nfs/dbraw/zinc/75/08/16/721750816.db2.gz ANIGTGRFDXWFQW-UHFFFAOYSA-N 0 0 397.410 3.312 20 5 GGBDRN Cc1cnc2n1CCN(C)C21CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC001164919025 721817346 /nfs/dbraw/zinc/81/73/46/721817346.db2.gz YTOIXPXARMDDCX-UHFFFAOYSA-N 0 0 392.463 3.089 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2cc(C(F)(F)N3CC[C@@H](CO)C3)c(Cl)nn2)cc1 ZINC001165033898 721879473 /nfs/dbraw/zinc/87/94/73/721879473.db2.gz XUMOEGIMQAQBHF-SNVBAGLBSA-N 0 0 384.770 3.069 20 5 GGBDRN O=[N+]([O-])c1c(Cl)c2ccccc2nc1N1CCN(C[C@H]2CCCO2)CC1 ZINC001165037469 721907400 /nfs/dbraw/zinc/90/74/00/721907400.db2.gz HKMLCNKOYDLPFC-CYBMUJFWSA-N 0 0 376.844 3.097 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])c(N2CCN(CCOc3ccccc3)CC2)n1 ZINC001165043830 721955010 /nfs/dbraw/zinc/95/50/10/721955010.db2.gz DJRNXMPUDZIGQP-UHFFFAOYSA-N 0 0 376.844 3.153 20 5 GGBDRN O=[N+]([O-])c1c(Cl)cc(Cl)nc1N1CCN(CCc2ccccn2)CC1 ZINC001165053454 722012073 /nfs/dbraw/zinc/01/20/73/722012073.db2.gz GNBJKIVSEYGVOB-UHFFFAOYSA-N 0 0 382.251 3.056 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001601660531 971040404 /nfs/dbraw/zinc/04/04/04/971040404.db2.gz SXMFOZMKEUIYTR-CQSZACIVSA-N 0 0 379.210 3.143 20 5 GGBDRN C[C@@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1cccc(-c2nn[nH]n2)c1 ZINC000820351637 945425582 /nfs/dbraw/zinc/42/55/82/945425582.db2.gz QKUHIQRKALHEEK-GFCCVEGCSA-N 0 0 395.423 3.070 20 5 GGBDRN CCCN(Cc1ccc(-c2nn[nH]n2)cc1)C(=O)c1ccc(CC)c([N+](=O)[O-])c1 ZINC000821105229 945635842 /nfs/dbraw/zinc/63/58/42/945635842.db2.gz ZWTBDOWIHBMQOL-UHFFFAOYSA-N 0 0 394.435 3.390 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(NC[C@H]3[C@@H]4c5ccccc5C[C@H]34)cc(-c3nn[nH]n3)c2c1 ZINC000823645228 946459639 /nfs/dbraw/zinc/45/96/39/946459639.db2.gz PZDZOSYKVWAIOO-WRWLIDTKSA-N 0 0 399.414 3.321 20 5 GGBDRN Cc1c(Cl)cnc(N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1-c1nn[nH]n1 ZINC000826237188 947695230 /nfs/dbraw/zinc/69/52/30/947695230.db2.gz RBYZDBRWQLUTAM-UHFFFAOYSA-N 0 0 385.815 3.301 20 5 GGBDRN Cc1cc(-c2nn[nH]n2)ccc1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000826250090 947726342 /nfs/dbraw/zinc/72/63/42/947726342.db2.gz KPXOTRBRAAGANY-UHFFFAOYSA-N 0 0 392.297 3.354 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CCO[C@@H](c2cccc(-c3nn[nH]n3)c2)C1 ZINC000826497956 948410979 /nfs/dbraw/zinc/41/09/79/948410979.db2.gz ALINPOLJFSDVFX-MRXNPFEDSA-N 0 0 386.799 3.006 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3cccc(-c4nn[nH]n4)c3)C2)c(Cl)c1 ZINC000826498762 948413776 /nfs/dbraw/zinc/41/37/76/948413776.db2.gz ITOSKMIVHLUULC-INIZCTEOSA-N 0 0 386.799 3.006 20 5 GGBDRN C[C@H](c1cccc(-c2nn[nH]n2)c1)N(C)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001575508971 949106825 /nfs/dbraw/zinc/10/68/25/949106825.db2.gz AIAVHYPTKDTAKU-SNVBAGLBSA-N 0 0 386.799 3.262 20 5 GGBDRN CC(C)(C)O[C@@H]1C[C@H](Nc2cc(F)c(-c3nn[nH]n3)cc2[N+](=O)[O-])C12CCC2 ZINC001573863369 950477775 /nfs/dbraw/zinc/47/77/75/950477775.db2.gz FJHAISKXIZTJKU-LSDHHAIUSA-N 0 0 390.419 3.452 20 5 GGBDRN CCCN(CC(=O)[O-])[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000263581537 950515628 /nfs/dbraw/zinc/51/56/28/950515628.db2.gz XHNOBXNLSFXBFZ-IBGZPJMESA-N 0 0 385.420 3.380 20 5 GGBDRN CC1(C)C(C)(C)C1(C)C(=O)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC001575623808 950658255 /nfs/dbraw/zinc/65/82/55/950658255.db2.gz JYWAVEPGZAWYNU-UHFFFAOYSA-N 0 0 378.820 3.439 20 5 GGBDRN 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ZINC001575133625 952105913 /nfs/dbraw/zinc/10/59/13/952105913.db2.gz FQIGNCZLALBZKK-SECBINFHSA-N 0 0 396.436 3.182 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1Br ZINC001595159110 952186688 /nfs/dbraw/zinc/18/66/88/952186688.db2.gz HWXSNMUZCXPBNN-CYBMUJFWSA-N 0 0 379.210 3.143 20 5 GGBDRN C[C@@H](Cc1ccc(-c2nn[nH]n2)cc1)C(=O)O[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001575189677 952457136 /nfs/dbraw/zinc/45/71/36/952457136.db2.gz PKPHTXJQXPRDDG-STQMWFEESA-N 0 0 381.392 3.258 20 5 GGBDRN C[C@H](Cc1cn(C)c2ccc(F)cc12)Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001575202444 952512720 /nfs/dbraw/zinc/51/27/20/952512720.db2.gz NZDRBKQEQCGGBA-LLVKDONJSA-N 0 0 395.398 3.449 20 5 GGBDRN C[C@@H](Cc1cn(C)c2ccc(F)cc12)Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001575202453 952513644 /nfs/dbraw/zinc/51/36/44/952513644.db2.gz NZDRBKQEQCGGBA-NSHDSACASA-N 0 0 395.398 3.449 20 5 GGBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@@H]2C(=O)[O-])cc1OC ZINC000566354202 953625629 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UUFKRPDCDBLKHT-UHFFFAOYSA-N 0 0 383.448 3.243 20 5 GGBDRN COc1cc(C[NH2+]CCC(C)(C)C(=O)[O-])c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000263099244 962248347 /nfs/dbraw/zinc/24/83/47/962248347.db2.gz WIIVQMIUWNHMBQ-UHFFFAOYSA-N 0 0 394.346 3.135 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1)[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001595192836 970324483 /nfs/dbraw/zinc/32/44/83/970324483.db2.gz VERXPHLYZOENQW-AWEZNQCLSA-N 0 0 379.210 3.143 20 5 GGBDRN COC[C@@H]([NH2+]Cc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000417630800 973967247 /nfs/dbraw/zinc/96/72/47/973967247.db2.gz ROUZRNSBAOGYEZ-OAHLLOKOSA-N 0 0 376.434 3.244 20 5 GGBDRN C[C@H](c1ccncc1)[NH+]1CCC(Nc2ccc(CC(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000515302530 974297214 /nfs/dbraw/zinc/29/72/14/974297214.db2.gz XCMAYVYHZHGFJB-CQSZACIVSA-N 0 0 384.436 3.254 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC2CC[NH+](Cc3ccccc3C)CC2)n1 ZINC000515655860 974300700 /nfs/dbraw/zinc/30/07/00/974300700.db2.gz SRMMLVBWUVYVFY-UHFFFAOYSA-N 0 0 384.436 3.381 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000518381467 974321964 /nfs/dbraw/zinc/32/19/64/974321964.db2.gz SDIHVQHOCZNCLI-GUYCJALGSA-N 0 0 384.436 3.319 20 5 GGBDRN O=C([O-])c1cnc(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000563205018 974519565 /nfs/dbraw/zinc/51/95/65/974519565.db2.gz CYVIIPVIEPRXAK-GFCCVEGCSA-N 0 0 376.438 3.074 20 5 GGBDRN C[NH+](C)[C@@H](CNc1ncc(C(=O)[O-])cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000563536697 974535062 /nfs/dbraw/zinc/53/50/62/974535062.db2.gz DIOTZWRNEAVVHM-AWEZNQCLSA-N 0 0 398.341 3.422 20 5 GGBDRN C[NH+](C)[C@H](CNc1ncc(C(=O)[O-])cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000563536698 974535069 /nfs/dbraw/zinc/53/50/69/974535069.db2.gz DIOTZWRNEAVVHM-CQSZACIVSA-N 0 0 398.341 3.422 20 5 GGBDRN Cc1cc(NCc2cccc(CN3CCO[C@@H](C)C3)c2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000565038729 974564531 /nfs/dbraw/zinc/56/45/31/974564531.db2.gz VVADOUGYAQUOTI-HNNXBMFYSA-N 0 0 399.447 3.434 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000566292231 974603209 /nfs/dbraw/zinc/60/32/09/974603209.db2.gz ZTMBKUHELKXCBN-GDBMZVCRSA-N 0 0 384.436 3.319 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)n1 ZINC000568397864 974670386 /nfs/dbraw/zinc/67/03/86/974670386.db2.gz DPDIQOQMFQIQOO-QGZVFWFLSA-N 0 0 398.463 3.133 20 5 GGBDRN CSc1ccc([C@@H](CNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000568516931 974672196 /nfs/dbraw/zinc/67/21/96/974672196.db2.gz TXIIEJXSEDXRFR-OAHLLOKOSA-N 0 0 376.438 3.125 20 5 GGBDRN Cc1cc(NC[C@H]2C[N@H+](Cc3ccccc3)CCCO2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000568986932 974681507 /nfs/dbraw/zinc/68/15/07/974681507.db2.gz RSRHYJJIHYLIIF-KRWDZBQOSA-N 0 0 399.447 3.304 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccccc2C[NH+]2CCC(C)CC2)n1 ZINC000573567779 974767149 /nfs/dbraw/zinc/76/71/49/974767149.db2.gz NYTFKYSBLNBYNL-UHFFFAOYSA-N 0 0 398.463 3.262 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CCCC[C@H]2C)n1 ZINC000577734118 974841354 /nfs/dbraw/zinc/84/13/54/974841354.db2.gz RVPSZWTXUKBZFP-OAHLLOKOSA-N 0 0 398.463 3.405 20 5 GGBDRN COc1cc(C[N@H+]([C@H](C)C(=O)[O-])C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000578339739 974853033 /nfs/dbraw/zinc/85/30/33/974853033.db2.gz ONXPPSJCTKPWDR-SNVBAGLBSA-N 0 0 388.367 3.075 20 5 GGBDRN C[C@@H](CNc1ccc(CC(=O)[O-])cc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000582005816 974919085 /nfs/dbraw/zinc/91/90/85/974919085.db2.gz MODTYTVCKLVFGF-LBPRGKRZSA-N 0 0 375.450 3.142 20 5 GGBDRN O=C([O-])CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCO1 ZINC000584356500 974954452 /nfs/dbraw/zinc/95/44/52/974954452.db2.gz PPPVZSWMCNRXRW-CYBMUJFWSA-N 0 0 376.331 3.069 20 5 GGBDRN O=C([O-])c1cnc(N[C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c([N+](=O)[O-])c1 ZINC000592976834 974978543 /nfs/dbraw/zinc/97/85/43/974978543.db2.gz AWBLNPIWUHULJS-RYQLBKOJSA-N 0 0 396.447 3.401 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c1 ZINC000593741921 974986398 /nfs/dbraw/zinc/98/63/98/974986398.db2.gz SUQMHZLMUAGKQR-WSTZPKSXSA-N 0 0 382.416 3.298 20 5 GGBDRN O=C([O-])c1cnc(C2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)s1 ZINC000600675184 975005975 /nfs/dbraw/zinc/00/59/75/975005975.db2.gz JSRSELIWXKMWIK-UHFFFAOYSA-N 0 0 377.422 3.008 20 5 GGBDRN O=C([O-])c1cnc(C2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000600675789 975006225 /nfs/dbraw/zinc/00/62/25/975006225.db2.gz NXJIWQGASVCNJI-UHFFFAOYSA-N 0 0 391.449 3.398 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCOc2ccccc2[C@@H]1C(=O)[O-] ZINC001591791277 975981838 /nfs/dbraw/zinc/98/18/38/975981838.db2.gz PLQPXXYNSHECAX-LJQANCHMSA-N 0 0 386.404 3.402 20 5 GGBDRN O=C([O-])c1cc([N+](=O)[O-])cc(Cl)c1N1CC2(C1)C[NH+](Cc1ccccc1)C2 ZINC000706170234 977310198 /nfs/dbraw/zinc/31/01/98/977310198.db2.gz MECFRFUDNHYTMK-UHFFFAOYSA-N 0 0 387.823 3.269 20 5 GGBDRN C[C@H](CC(=O)Nc1cccc(C(=O)[O-])c1)[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001592269340 977527438 /nfs/dbraw/zinc/52/74/38/977527438.db2.gz QIYXADGLGGYULI-UONOGXRCSA-N 0 0 385.420 3.403 20 5 GGBDRN C[C@@](CC(=O)[O-])([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1cccnc1 ZINC001592327815 977742413 /nfs/dbraw/zinc/74/24/13/977742413.db2.gz FIPJCHSZWZOQTO-INIZCTEOSA-N 0 0 383.326 3.488 20 5 GGBDRN C[C@H](CCNc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-])[NH+](C)C ZINC001592519073 978360571 /nfs/dbraw/zinc/36/05/71/978360571.db2.gz APIFEFOIBZMXMK-CYBMUJFWSA-N 0 0 385.420 3.276 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2ccc(CC(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000844207199 979355816 /nfs/dbraw/zinc/35/58/16/979355816.db2.gz CBFRXJLHVMAJHE-NVXWUHKLSA-N 0 0 375.469 3.313 20 5 GGBDRN O=C([O-])/C=C/c1ccc(NCC2CCN(c3cc[nH+]cc3)CC2)c([N+](=O)[O-])c1 ZINC000844212070 979368227 /nfs/dbraw/zinc/36/82/27/979368227.db2.gz QFPWCULFUHMKSA-DUXPYHPUSA-N 0 0 382.420 3.416 20 5 GGBDRN CC[C@]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)(C(=O)[O-])c1ccccc1 ZINC001595291863 980395377 /nfs/dbraw/zinc/39/53/77/980395377.db2.gz PSRHIXZQNXEOCL-LJQANCHMSA-N 0 0 389.383 3.042 20 5 GGBDRN O=C([O-])[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cc(F)ccc1F ZINC000901637661 980418456 /nfs/dbraw/zinc/41/84/56/980418456.db2.gz UVBZTTFCDZNAFF-SFHVURJKSA-N 0 0 391.374 3.257 20 5 GGBDRN CC[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1cc(F)ccc1OC ZINC001595300418 980434123 /nfs/dbraw/zinc/43/41/23/980434123.db2.gz PXQQQQQULQUEOE-HNNXBMFYSA-N 0 0 392.383 3.447 20 5 GGBDRN CN(c1ccccc1)c1ccc(C[N@H+](CC(=O)[O-])C2CCOCC2)cc1[N+](=O)[O-] ZINC000901984898 980665816 /nfs/dbraw/zinc/66/58/16/980665816.db2.gz WYUUNGQBNVYLCF-UHFFFAOYSA-N 0 0 399.447 3.428 20 5 GGBDRN CO[C@H]1CC[N@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[C@H](C(=O)[O-])C1 ZINC000902031712 980703368 /nfs/dbraw/zinc/70/33/68/980703368.db2.gz LFBQMHRQBZTIOE-PXNSSMCTSA-N 0 0 399.447 3.427 20 5 GGBDRN CCC1([NH+]2CCCCC2)CCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC001595387448 980940112 /nfs/dbraw/zinc/94/01/12/980940112.db2.gz BUVNFJLMESUCRZ-UHFFFAOYSA-N 0 0 389.452 3.164 20 5 GGBDRN CC[C@@H]1CCC[N@@H+](C(C)(C)CNCc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)C1 ZINC001595458187 981130573 /nfs/dbraw/zinc/13/05/73/981130573.db2.gz CHOLIIVKSUAFIH-OAHLLOKOSA-N 0 0 393.484 3.048 20 5 GGBDRN CC[C@H]1CCC[N@@H+](C(C)(C)CNCc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)C1 ZINC001595458185 981130730 /nfs/dbraw/zinc/13/07/30/981130730.db2.gz CHOLIIVKSUAFIH-HNNXBMFYSA-N 0 0 393.484 3.048 20 5 GGBDRN CC[C@@](C)(C(=O)[O-])[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CC1 ZINC001594778208 981773869 /nfs/dbraw/zinc/77/38/69/981773869.db2.gz KYAGDJWZEYXJGV-KRWDZBQOSA-N 0 0 383.832 3.152 20 5 GGBDRN CC[C@](C)(C(=O)[O-])[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC1CC1 ZINC001594787606 981824150 /nfs/dbraw/zinc/82/41/50/981824150.db2.gz IYNWPVBVEFYALJ-LJQANCHMSA-N 0 0 377.441 3.197 20 5 GGBDRN CC[C@@](C)(C(=O)[O-])[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC1CC1 ZINC001594787605 981824332 /nfs/dbraw/zinc/82/43/32/981824332.db2.gz IYNWPVBVEFYALJ-IBGZPJMESA-N 0 0 377.441 3.197 20 5 GGBDRN CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1nc(C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000910373797 981902508 /nfs/dbraw/zinc/90/25/08/981902508.db2.gz JLQRIDXAUGTUBJ-QGZVFWFLSA-N 0 0 398.463 3.345 20 5 GGBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](C)[C@H](C(=O)[O-])C2)cc1OC ZINC001594965358 982721616 /nfs/dbraw/zinc/72/16/16/982721616.db2.gz VKPLKLNSLBDGFM-GZBFAFLISA-N 0 0 380.441 3.181 20 5 GGBDRN CCOCCC[N@@H+]1CC[C@H](Nc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1 ZINC001596917457 985960283 /nfs/dbraw/zinc/96/02/83/985960283.db2.gz WYLFPHURNKTHBS-LKEBIXNSSA-N 0 0 391.468 3.242 20 5 GGBDRN C[C@@H]1C[N@H+](Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC001594533131 986134603 /nfs/dbraw/zinc/13/46/03/986134603.db2.gz APACIELFIRSMTE-DOMZBBRYSA-N 0 0 393.440 3.028 20 5 GGBDRN C[C@H]1C[N@H+](Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC001594533135 986134834 /nfs/dbraw/zinc/13/48/34/986134834.db2.gz APACIELFIRSMTE-WFASDCNBSA-N 0 0 393.440 3.028 20 5 GGBDRN C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594545971 986211888 /nfs/dbraw/zinc/21/18/88/986211888.db2.gz WQDGMFRWHDTAOO-MRXNPFEDSA-N 0 0 383.448 3.389 20 5 GGBDRN C[C@@H]1CN(c2ccc(C(=O)[O-])cc2)CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001594569334 986379880 /nfs/dbraw/zinc/37/98/80/986379880.db2.gz LUBCKEDVKQICNA-MRXNPFEDSA-N 0 0 399.447 3.273 20 5 GGBDRN CCOc1cc(N2CC[NH+](C[C@H]3CCCC[C@@H]3C(=O)[O-])CC2)ccc1[N+](=O)[O-] ZINC001597041740 986488372 /nfs/dbraw/zinc/48/83/72/986488372.db2.gz AOZFNUVNFHNGMX-WBVHZDCISA-N 0 0 391.468 3.007 20 5 GGBDRN CCOc1cc(N2CC[NH+](C[C@@H]3CCCC[C@H]3C(=O)[O-])CC2)ccc1[N+](=O)[O-] ZINC001597041737 986488702 /nfs/dbraw/zinc/48/87/02/986488702.db2.gz AOZFNUVNFHNGMX-DOTOQJQBSA-N 0 0 391.468 3.007 20 5 GGBDRN C[C@@H](C(=O)[O-])[C@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 ZINC001589469880 986949000 /nfs/dbraw/zinc/94/90/00/986949000.db2.gz QBHXXJVNSYJKEZ-XIKOKIGWSA-N 0 0 389.383 3.114 20 5 GGBDRN CCc1ccc(C[NH+]2CCN(c3ccc(CC(=O)[O-])cc3[N+](=O)[O-])CC2)cc1 ZINC001597527958 988177610 /nfs/dbraw/zinc/17/76/10/988177610.db2.gz UFKPLLSKHCHTFZ-UHFFFAOYSA-N 0 0 383.448 3.107 20 5 GGBDRN C[N@H+](CCOc1cccc(Cl)c1)Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001598499225 992408971 /nfs/dbraw/zinc/40/89/71/992408971.db2.gz FLXCIPNPTORFAV-UHFFFAOYSA-N 0 0 394.811 3.222 20 5 GGBDRN C[N@H+](CCc1ccccc1)[C@@H]1CCN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001598502440 992451927 /nfs/dbraw/zinc/45/19/27/992451927.db2.gz VDMIRBAIBNSVJM-LJQANCHMSA-N 0 0 383.448 3.042 20 5 GGBDRN CN(C[C@H]1CCCC[N@@H+]1Cc1ccccc1)c1nccc(C(=O)[O-])c1[N+](=O)[O-] ZINC001598503807 992472488 /nfs/dbraw/zinc/47/24/88/992472488.db2.gz XKPNPFQWBCYRJT-MRXNPFEDSA-N 0 0 384.436 3.179 20 5 GGBDRN C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H](COC1CCC1)C(=O)[O-] ZINC001598508356 992534226 /nfs/dbraw/zinc/53/42/26/992534226.db2.gz DAWMRTLNMVTSAK-AWEZNQCLSA-N 0 0 376.331 3.068 20 5 GGBDRN C[C@]([NH2+]CCc1cccc2c1OC(F)(F)O2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593275914 994630726 /nfs/dbraw/zinc/63/07/26/994630726.db2.gz WGOIKBBJHISEOB-QGZVFWFLSA-N 0 0 394.330 3.048 20 5 GGBDRN C[C@@H]([NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-])c1ccc(N2CCCNC2=O)cc1 ZINC001593289358 994662489 /nfs/dbraw/zinc/66/24/89/994662489.db2.gz QZNVANLCRGTBAJ-CYBMUJFWSA-N 0 0 398.419 3.064 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)[C@H]1Oc2ccccc2[C@@H]1C ZINC001593298213 994711129 /nfs/dbraw/zinc/71/11/29/994711129.db2.gz FQTZKPZIADHYPY-QAJFTPDKSA-N 0 0 386.404 3.101 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC001593299300 994721695 /nfs/dbraw/zinc/72/16/95/994721695.db2.gz RCIGNLSPXYKKIT-ZDUSSCGKSA-N 0 0 386.404 3.234 20 5 GGBDRN C[C@]([NH2+]Cc1cccc2c1OC(F)(F)O2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593303525 994734852 /nfs/dbraw/zinc/73/48/52/994734852.db2.gz FPSQMHXISVDSNF-MRXNPFEDSA-N 0 0 380.303 3.006 20 5 GGBDRN C[C@]([NH2+]Cc1ccc2c(c1)OC(F)(F)O2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593304714 994752868 /nfs/dbraw/zinc/75/28/68/994752868.db2.gz PYJIUTRHYXKRQH-MRXNPFEDSA-N 0 0 380.303 3.006 20 5 GGBDRN C[C@@]([NH2+]Cc1cnc(-c2ccccc2)nc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593310290 994771153 /nfs/dbraw/zinc/77/11/53/994771153.db2.gz HDWYXQPZAKOAMR-FQEVSTJZSA-N 0 0 378.388 3.141 20 5 GGBDRN C[C@@]([NH2+]Cc1ccnn1CCc1ccccc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593311766 994787062 /nfs/dbraw/zinc/78/70/62/994787062.db2.gz UIIQGJVSISMJSA-NRFANRHFSA-N 0 0 394.431 3.124 20 5 GGBDRN C[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](Cc1ccccc1)C(=O)[O-] ZINC001593312194 994795400 /nfs/dbraw/zinc/79/54/00/994795400.db2.gz PXOHRBMBAXJBOV-SUMWQHHRSA-N 0 0 396.403 3.066 20 5 GGBDRN COC(=O)[C@H](C)C[N@H+](Cc1ccccc1)Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001598689754 995045777 /nfs/dbraw/zinc/04/57/77/995045777.db2.gz QIMAVDKQBRVCAK-CQSZACIVSA-N 0 0 386.404 3.104 20 5 GGBDRN C[C@H](Oc1ccc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)[O-] ZINC001593617942 995855308 /nfs/dbraw/zinc/85/53/08/995855308.db2.gz RICPINUOFCVFHM-LBPRGKRZSA-N 0 0 378.812 3.432 20 5 GGBDRN CC1(C)CCC[C@]([NH2+]CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)(C(=O)[O-])C1 ZINC001593895076 996748544 /nfs/dbraw/zinc/74/85/44/996748544.db2.gz IUVNMWCLDFFTKL-QGZVFWFLSA-N 0 0 383.832 3.200 20 5 GGBDRN COc1cc(C[NH2+][C@H](C(=O)[O-])c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC001599414564 997483025 /nfs/dbraw/zinc/48/30/25/997483025.db2.gz IFQPILAZVJIGLM-HNNXBMFYSA-N 0 0 395.209 3.281 20 5 GGBDRN CO[C@@H]1CCC[C@@H]([C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C(=O)[O-])C1 ZINC001599108717 997527834 /nfs/dbraw/zinc/52/78/34/997527834.db2.gz LRPDPGMMRUWWDG-QBIMZIAESA-N 0 0 380.441 3.130 20 5 GGBDRN COc1ccc([C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C(=O)[O-])c(OC)c1 ZINC001599532591 997684522 /nfs/dbraw/zinc/68/45/22/997684522.db2.gz SICAFCBPWGINGN-INIZCTEOSA-N 0 0 380.784 3.181 20 5 GGBDRN C[C@@H]1CCC[N@H+](CCCCNc2c(C(=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001594382319 999440853 /nfs/dbraw/zinc/44/08/53/999440853.db2.gz AEJPRTOQZOPSKJ-GFCCVEGCSA-N 0 0 380.401 3.125 20 5 GGBDRN CCCOc1cc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])ccc1OC ZINC000277157011 1126078213 /nfs/dbraw/zinc/07/82/13/1126078213.db2.gz CYEBHMZZLRMGET-KRWDZBQOSA-N 0 0 388.420 3.178 20 5 GGBDRN CC(C)c1ncc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])s1 ZINC000417563363 1126080435 /nfs/dbraw/zinc/08/04/35/1126080435.db2.gz NMCPQNYYPLUMNR-MRXNPFEDSA-N 0 0 388.449 3.442 20 5 GGBDRN COc1cc(C)ccc1C[NH2+][C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)[O-] ZINC000417559530 1126080491 /nfs/dbraw/zinc/08/04/91/1126080491.db2.gz IOWSGEJCBOZSBG-SFHVURJKSA-N 0 0 383.404 3.179 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000426645283 1126081103 /nfs/dbraw/zinc/08/11/03/1126081103.db2.gz GGVWSMJQWWCGEL-GOSISDBHSA-N 0 0 382.372 3.346 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426655998 1126081319 /nfs/dbraw/zinc/08/13/19/1126081319.db2.gz VNNOJMKDZQKQQD-GOSISDBHSA-N 0 0 382.372 3.346 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc2[nH]ccc21 ZINC000426723519 1126082679 /nfs/dbraw/zinc/08/26/79/1126082679.db2.gz ZJDWGVIUTFSQGC-IBGZPJMESA-N 0 0 378.388 3.343 20 5 GGBDRN COc1ccc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cc1F ZINC000426726372 1126083403 /nfs/dbraw/zinc/08/34/03/1126083403.db2.gz JCGNYXJICQBWJW-QGZVFWFLSA-N 0 0 387.367 3.009 20 5 GGBDRN CC(C)c1ccc(C[NH2+][C@H](Cc2ccc3c(c2)OCO3)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426774748 1126089823 /nfs/dbraw/zinc/08/98/23/1126089823.db2.gz WDEQCZFKWGTZLH-MRXNPFEDSA-N 0 0 386.404 3.232 20 5 GGBDRN COc1cc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cc(Cl)c1OC ZINC000426787211 1126090469 /nfs/dbraw/zinc/09/04/69/1126090469.db2.gz BWRZAPPOCSWQOO-HNNXBMFYSA-N 0 0 394.811 3.051 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(-c2ccccn2)c1 ZINC000426806867 1126091430 /nfs/dbraw/zinc/09/14/30/1126091430.db2.gz LLYHXLLJODFCSQ-IBGZPJMESA-N 0 0 377.400 3.442 20 5 GGBDRN Cc1ccc(-c2ncc(C[NH2+][C@@H](Cc3ccccc3[N+](=O)[O-])C(=O)[O-])s2)o1 ZINC000426812249 1126092094 /nfs/dbraw/zinc/09/20/94/1126092094.db2.gz XLDWETAVXJBTMS-AWEZNQCLSA-N 0 0 387.417 3.405 20 5 GGBDRN Cc1ccc(C[NH2+][C@H](Cc2ccc(OC(F)F)cc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426821564 1126092819 /nfs/dbraw/zinc/09/28/19/1126092819.db2.gz UOXSQUOYHCPMNR-OAHLLOKOSA-N 0 0 380.347 3.290 20 5 GGBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc(F)cc1F ZINC000567560552 1126097983 /nfs/dbraw/zinc/09/79/83/1126097983.db2.gz RQBVQBDQQBGJJS-QGZVFWFLSA-N 0 0 375.331 3.140 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000756362339 1126107708 /nfs/dbraw/zinc/10/77/08/1126107708.db2.gz LSPFZYXAPBNKHC-ZDUSSCGKSA-N 0 0 386.376 3.429 20 5 GGBDRN Cc1ccc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cc1[N+](=O)[O-] ZINC000756379871 1126107987 /nfs/dbraw/zinc/10/79/87/1126107987.db2.gz PDRMYCXGBQCGQH-QGZVFWFLSA-N 0 0 398.375 3.078 20 5 GGBDRN Cc1ccc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cc1[N+](=O)[O-] ZINC000756379869 1126108046 /nfs/dbraw/zinc/10/80/46/1126108046.db2.gz PDRMYCXGBQCGQH-KRWDZBQOSA-N 0 0 398.375 3.078 20 5 GGBDRN CC(C)c1nc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cs1 ZINC001255794881 1126160844 /nfs/dbraw/zinc/16/08/44/1126160844.db2.gz YLOZXQWGSZUIKQ-MRXNPFEDSA-N 0 0 388.449 3.442 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc(O)cc1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001324574677 1126172194 /nfs/dbraw/zinc/17/21/94/1126172194.db2.gz FRDCQMHHUKNXND-KRWDZBQOSA-N 0 0 399.428 3.209 20 5 GGBDRN 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O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1cccc(Cl)c1Cl ZINC000003598679 209118971 /nfs/dbraw/zinc/11/89/71/209118971.db2.gz NNODSJSRSUXOMK-UHFFFAOYSA-N 0 0 394.170 3.136 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000005199706 209122164 /nfs/dbraw/zinc/12/21/64/209122164.db2.gz NWPVPIIABNSQDQ-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN O=C(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)Nc1cc(Cl)ccc1Cl ZINC000003602297 209118007 /nfs/dbraw/zinc/11/80/07/209118007.db2.gz ANZLDSOLANYMPO-UHFFFAOYSA-N 0 0 394.170 3.136 20 5 GGBDRN CCc1cc(N2CCN(c3ccccn3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053548808 209110758 /nfs/dbraw/zinc/11/07/58/209110758.db2.gz DULMERQPOQNANW-UHFFFAOYSA-N 0 0 390.447 3.336 20 5 GGBDRN Cn1ncc(-c2nc3ccccc3[nH]2)c1NC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000328596573 206232479 /nfs/dbraw/zinc/23/24/79/206232479.db2.gz DHFMJCQGZDJUDR-UHFFFAOYSA-N 0 0 398.329 3.402 20 5 GGBDRN O=C(CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O)Nc1cccc([N+](=O)[O-])c1 ZINC000003605405 206249913 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GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1c2cccc3cccc(c23)S1(=O)=O ZINC000005702030 206624953 /nfs/dbraw/zinc/62/49/53/206624953.db2.gz MTTFUVZXRMJJIG-UHFFFAOYSA-N 0 0 397.412 3.204 20 5 GGBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(C)n1Cc1ccc(F)cc1 ZINC000005823109 206629714 /nfs/dbraw/zinc/62/97/14/206629714.db2.gz OYDYQFJAUBWIPB-UHFFFAOYSA-N 0 0 383.379 3.245 20 5 GGBDRN CC[C@@H](C)c1ccc(NC(=O)Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)cc1 ZINC000006224231 206644747 /nfs/dbraw/zinc/64/47/47/206644747.db2.gz ZXOREGRIQDUPSF-CYBMUJFWSA-N 0 0 380.404 3.457 20 5 GGBDRN O=C(Nc1c2ccccc2oc1C(=O)N1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000007466763 206714339 /nfs/dbraw/zinc/71/43/39/206714339.db2.gz FXDKESBVAOEQEL-UHFFFAOYSA-N 0 0 395.371 3.066 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)CNc1cc([N+](=O)[O-])ccc1NCCO ZINC000007976876 206730949 /nfs/dbraw/zinc/73/09/49/206730949.db2.gz SRZPDXJSUIPJNN-UHFFFAOYSA-N 0 0 378.816 3.011 20 5 GGBDRN CCNc1ccc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)cc1[N+](=O)[O-] ZINC000008710758 206760296 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O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N1CCSC[C@@H]1c1ccccc1 ZINC000115590398 564196303 /nfs/dbraw/zinc/19/63/03/564196303.db2.gz HUKHVFSLJNGXNT-OAHLLOKOSA-N 0 0 382.438 3.213 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCSC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000115590473 564196719 /nfs/dbraw/zinc/19/67/19/564196719.db2.gz RGWTYPXRIJEQNE-INIZCTEOSA-N 0 0 378.475 3.382 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N1CCSC[C@H]1c1ccccc1 ZINC000115590396 564196785 /nfs/dbraw/zinc/19/67/85/564196785.db2.gz HUKHVFSLJNGXNT-HNNXBMFYSA-N 0 0 382.438 3.213 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(I)cn2)c1[N+](=O)[O-] ZINC000115630630 564197548 /nfs/dbraw/zinc/19/75/48/564197548.db2.gz DPFOGJOMHGTLDQ-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(I)cn1 ZINC000115630662 564197790 /nfs/dbraw/zinc/19/77/90/564197790.db2.gz YKFXXMMUTDSIRX-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c1[N+](=O)[O-] ZINC000115724857 564198637 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Nc1ccc(C(=O)OCc2cc3c(cc2Br)OCO3)cc1[N+](=O)[O-] ZINC000005228816 564213384 /nfs/dbraw/zinc/21/33/84/564213384.db2.gz SWTOVNXLHQPWTE-UHFFFAOYSA-N 0 0 395.165 3.025 20 5 GGBDRN C[C@H](Sc1nnc2ccccn21)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000005212863 564213436 /nfs/dbraw/zinc/21/34/36/564213436.db2.gz BTECPBIJDJGZRO-VIFPVBQESA-N 0 0 377.813 3.410 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000116679115 564214268 /nfs/dbraw/zinc/21/42/68/564214268.db2.gz MLWBEUFQYIXBBZ-UHFFFAOYSA-N 0 0 382.825 3.354 20 5 GGBDRN O=C(CN1CCc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Br ZINC000005897129 564219472 /nfs/dbraw/zinc/21/94/72/564219472.db2.gz SWESZJFPXCZURK-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN COc1ccc(NC(=O)CNc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000006507861 564224414 /nfs/dbraw/zinc/22/44/14/564224414.db2.gz LZZXAMPFZZRYSI-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000117373233 564226467 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O=C(CSc1nnc(NC2CC2)s1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000007577426 564238046 /nfs/dbraw/zinc/23/80/46/564238046.db2.gz GWWBYWLLUAZVGO-UHFFFAOYSA-N 0 0 385.858 3.405 20 5 GGBDRN CCn1c(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)nnc1C1CC1 ZINC000007618143 564238855 /nfs/dbraw/zinc/23/88/55/564238855.db2.gz ZULSFCUAAURMCF-UHFFFAOYSA-N 0 0 381.845 3.468 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)Cc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000007814490 564241955 /nfs/dbraw/zinc/24/19/55/564241955.db2.gz OUPSUFIDHTUTAV-UHFFFAOYSA-N 0 0 381.841 3.007 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(I)cc1 ZINC000007919496 564242388 /nfs/dbraw/zinc/24/23/88/564242388.db2.gz WJTUJBCEECSLIH-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000007907863 564242568 /nfs/dbraw/zinc/24/25/68/564242568.db2.gz JJDGFJWFALMANQ-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(S(C)(=O)=O)c1 ZINC000007944605 564243817 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O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2cccs2)C[C@@H]2CCCO2)cc1 ZINC000008059646 564245067 /nfs/dbraw/zinc/24/50/67/564245067.db2.gz FYZAEXLBKILNIN-AWEZNQCLSA-N 0 0 382.463 3.026 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cccc(Br)c2)cc([N+](=O)[O-])c1 ZINC000118723694 564245366 /nfs/dbraw/zinc/24/53/66/564245366.db2.gz VBKPIJNVDMMJNZ-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc(Br)ccc1F ZINC000008175570 564247086 /nfs/dbraw/zinc/24/70/86/564247086.db2.gz XSYJYQWATGSYPH-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc(Br)cc3)C2)nc1 ZINC000118866509 564247050 /nfs/dbraw/zinc/24/70/50/564247050.db2.gz UNSONDYQFYOBKO-CQSZACIVSA-N 0 0 377.242 3.439 20 5 GGBDRN O=C(NCC(F)F)C(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000119034106 564251105 /nfs/dbraw/zinc/25/11/05/564251105.db2.gz ZFUYLHWNIVEAJU-UHFFFAOYSA-N 0 0 387.389 3.127 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCO[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000119109747 564254843 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COc1ccc([N+](=O)[O-])cc1OCC(=O)Nc1ccccc1Br ZINC000010846764 564260248 /nfs/dbraw/zinc/26/02/48/564260248.db2.gz AQWIUWXGLWIDTE-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN Cc1csc2nc(CN(C)Cc3cc([N+](=O)[O-])ccc3Cl)cc(=O)n12 ZINC000011012311 564262018 /nfs/dbraw/zinc/26/20/18/564262018.db2.gz IIRCNYXJTDBHEQ-UHFFFAOYSA-N 0 0 378.841 3.258 20 5 GGBDRN CC(C)CNc1nnc(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000011389752 564263056 /nfs/dbraw/zinc/26/30/56/564263056.db2.gz KAQBXWWKXAOVTG-UHFFFAOYSA-N 0 0 381.483 3.269 20 5 GGBDRN O=C(CSc1nncn1C1CC1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000011718244 564265085 /nfs/dbraw/zinc/26/50/85/564265085.db2.gz OHQJITOJCJQSEW-UHFFFAOYSA-N 0 0 398.242 3.015 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(c2ccc(Cl)cn2)CC1 ZINC000119406550 564269180 /nfs/dbraw/zinc/26/91/80/564269180.db2.gz NSBUVCAOACKVII-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119418228 564270061 /nfs/dbraw/zinc/27/00/61/564270061.db2.gz PJWDQVWIQDOUKC-NSHDSACASA-N 0 0 383.857 3.089 20 5 GGBDRN Cc1ccc(Br)cc1S(=O)(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000014099096 564279837 /nfs/dbraw/zinc/27/98/37/564279837.db2.gz XSBTXVGAHYQBNC-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CSc1cccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000014428175 564282895 /nfs/dbraw/zinc/28/28/95/564282895.db2.gz OSCHRMQICFHYLT-UHFFFAOYSA-N 0 0 377.447 3.146 20 5 GGBDRN CNS(=O)(=O)c1ccc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000119688106 564283056 /nfs/dbraw/zinc/28/30/56/564283056.db2.gz GIUCRNOTVIZKSJ-LLVKDONJSA-N 0 0 383.857 3.007 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000015350719 564286413 /nfs/dbraw/zinc/28/64/13/564286413.db2.gz DZFRULJPWDADLS-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN Cc1cc(=O)n(Cc2cccc(Br)c2OC(F)F)cc1[N+](=O)[O-] ZINC000119766984 564286742 /nfs/dbraw/zinc/28/67/42/564286742.db2.gz RFPWTLMHFHEJNI-UHFFFAOYSA-N 0 0 389.152 3.477 20 5 GGBDRN CSc1ccc(-c2csc(NC(=O)c3c([N+](=O)[O-])cnn3C)n2)cc1 ZINC000119751835 564286874 /nfs/dbraw/zinc/28/68/74/564286874.db2.gz BOUSIZQXIBBGLP-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN CSc1ccc(C(=O)NCC(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000015417505 564287283 /nfs/dbraw/zinc/28/72/83/564287283.db2.gz GEUXXAQHAVGSGS-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN(c1nccs1)S(=O)(=O)c1ccccc1 ZINC000015395319 564287432 /nfs/dbraw/zinc/28/74/32/564287432.db2.gz FKFMKSDEAWAQDZ-UHFFFAOYSA-N 0 0 375.431 3.447 20 5 GGBDRN COCC[C@H](C)NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000119775150 564287892 /nfs/dbraw/zinc/28/78/92/564287892.db2.gz WUHXURNZKLGXKS-VIFPVBQESA-N 0 0 387.223 3.242 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(S(C)(=O)=O)ccc2C)cc1[N+](=O)[O-] ZINC000015815949 564290200 /nfs/dbraw/zinc/29/02/00/564290200.db2.gz UPTZLKJNLWRUSZ-UHFFFAOYSA-N 0 0 380.447 3.281 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000119817538 564290146 /nfs/dbraw/zinc/29/01/46/564290146.db2.gz BZNCJWLQLPZSLB-UHFFFAOYSA-N 0 0 395.257 3.080 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000016027757 564290867 /nfs/dbraw/zinc/29/08/67/564290867.db2.gz SIWNVPXGVZMQQF-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000016028106 564290904 /nfs/dbraw/zinc/29/09/04/564290904.db2.gz MCFGZROLVVNIIG-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000016086714 564291234 /nfs/dbraw/zinc/29/12/34/564291234.db2.gz MYDUPBSFXLLVPZ-SNVBAGLBSA-N 0 0 385.239 3.397 20 5 GGBDRN O=C(CSc1nnnn1C1CCCC1)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000016371598 564294044 /nfs/dbraw/zinc/29/40/44/564294044.db2.gz IOXFXIKPVKLDMQ-UHFFFAOYSA-N 0 0 382.833 3.081 20 5 GGBDRN O=C(COc1ccc(Br)cc1F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000016810861 564296232 /nfs/dbraw/zinc/29/62/32/564296232.db2.gz ALWIHTNONPCKMH-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2cc(Cl)ccc2Cl)cc1 ZINC000017333914 564298128 /nfs/dbraw/zinc/29/81/28/564298128.db2.gz CGMGYEVQSGTORP-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000017333113 564298593 /nfs/dbraw/zinc/29/85/93/564298593.db2.gz HZLQSHHNAJIGLQ-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN CCCNc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)s1 ZINC000017886003 564299280 /nfs/dbraw/zinc/29/92/80/564299280.db2.gz RPAGKACZLXWSJE-UHFFFAOYSA-N 0 0 383.455 3.008 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(c2nccs2)S(=O)(=O)c2ccccc2)cc1 ZINC000018030470 564300257 /nfs/dbraw/zinc/30/02/57/564300257.db2.gz KNLKUKURTQERSD-UHFFFAOYSA-N 0 0 375.431 3.447 20 5 GGBDRN CNS(=O)(=O)c1ccc(NCCSc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000018055448 564300304 /nfs/dbraw/zinc/30/03/04/564300304.db2.gz ZVNSLODBUBAJJV-UHFFFAOYSA-N 0 0 381.479 3.016 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC(n2cccn2)CC1 ZINC000120035668 564301205 /nfs/dbraw/zinc/30/12/05/564301205.db2.gz GSMRVCIQCZOPPR-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN CCNc1nnc(S[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000018663587 564301968 /nfs/dbraw/zinc/30/19/68/564301968.db2.gz USUBFLFQQTYWMN-QMMMGPOBSA-N 0 0 383.455 3.006 20 5 GGBDRN Cc1occc1-c1nnc(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])o1 ZINC000020667368 564308115 /nfs/dbraw/zinc/30/81/15/564308115.db2.gz UEIHAILGFISVJJ-UHFFFAOYSA-N 0 0 381.391 3.101 20 5 GGBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])cc(Br)c2=O)c(C)n1C1CC1 ZINC000120171752 564308108 /nfs/dbraw/zinc/30/81/08/564308108.db2.gz WIOIUIZBGWQQPK-UHFFFAOYSA-N 0 0 394.225 3.155 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cc(Br)c1=O)C12CC3CC(CC(C3)C1)C2 ZINC000120178581 564308173 /nfs/dbraw/zinc/30/81/73/564308173.db2.gz JWFGTGXKJABSDB-UHFFFAOYSA-N 0 0 395.253 3.305 20 5 GGBDRN O=C(NCc1cccs1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000120184609 564308229 /nfs/dbraw/zinc/30/82/29/564308229.db2.gz WRSVEZDRUWHZLL-UHFFFAOYSA-N 0 0 388.186 3.191 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCCC(=O)OC(C)C)cc1[N+](=O)[O-] ZINC000120219340 564310080 /nfs/dbraw/zinc/31/00/80/564310080.db2.gz WGJVUCYICSYMOZ-UHFFFAOYSA-N 0 0 387.230 3.127 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)Cc2ccccc2Br)cc1[N+](=O)[O-] ZINC000021325495 564310216 /nfs/dbraw/zinc/31/02/16/564310216.db2.gz GRVKRUYJFULBLD-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CN(CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1Br ZINC000021917637 564312815 /nfs/dbraw/zinc/31/28/15/564312815.db2.gz LPVLJVYBMRHRIK-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ncnc2ccsc21 ZINC000022004578 564313947 /nfs/dbraw/zinc/31/39/47/564313947.db2.gz NXIAEFZDZCAJBS-UHFFFAOYSA-N 0 0 376.419 3.339 20 5 GGBDRN O=C(CSc1nnc(NC2CC2)s1)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000022172893 564314034 /nfs/dbraw/zinc/31/40/34/564314034.db2.gz ACKMSKDCENLXSE-UHFFFAOYSA-N 0 0 385.858 3.405 20 5 GGBDRN CCSc1nnc(SCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000022041790 564314229 /nfs/dbraw/zinc/31/42/29/564314229.db2.gz AVSMOFUQQPJRIG-UHFFFAOYSA-N 0 0 386.480 3.298 20 5 GGBDRN CCSc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)s1 ZINC000022041829 564314251 /nfs/dbraw/zinc/31/42/51/564314251.db2.gz VYUWBUBWLXABJO-UHFFFAOYSA-N 0 0 386.480 3.298 20 5 GGBDRN C[C@H](Sc1nnc(NC2CC2)s1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000022173932 564314932 /nfs/dbraw/zinc/31/49/32/564314932.db2.gz KPZVAHWKANYRGZ-ZETCQYMHSA-N 0 0 383.430 3.279 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2CCSc3ccccc32)cc1[N+](=O)[O-] ZINC000022276506 564315014 /nfs/dbraw/zinc/31/50/14/564315014.db2.gz SIGDYWCJNFRWBW-CYBMUJFWSA-N 0 0 380.447 3.119 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H]2CCSc3ccccc32)cc1[N+](=O)[O-] ZINC000022276510 564315528 /nfs/dbraw/zinc/31/55/28/564315528.db2.gz SIGDYWCJNFRWBW-ZDUSSCGKSA-N 0 0 380.447 3.119 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(Sc2nc(C)c(C)o2)c([N+](=O)[O-])c1 ZINC000022406265 564316575 /nfs/dbraw/zinc/31/65/75/564316575.db2.gz PHVVRKGBCZWRAB-UHFFFAOYSA-N 0 0 385.467 3.381 20 5 GGBDRN CN(Cc1ccc(Br)cc1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000022512210 564317168 /nfs/dbraw/zinc/31/71/68/564317168.db2.gz RIFABXRHYRLJAD-UHFFFAOYSA-N 0 0 379.210 3.395 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccc(Br)cc1 ZINC000022458152 564317413 /nfs/dbraw/zinc/31/74/13/564317413.db2.gz AZMXFVMAKMGSCE-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CN(Cc1ccccc1Br)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000022456676 564317692 /nfs/dbraw/zinc/31/76/92/564317692.db2.gz UWCQFBHUMOZVHI-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cccs2)CC1 ZINC000022662459 564319565 /nfs/dbraw/zinc/31/95/65/564319565.db2.gz DTXIZGOLTGARJN-UHFFFAOYSA-N 0 0 377.491 3.093 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC[C@H](O)C3)cc2[N+](=O)[O-])n1 ZINC000120537716 564324910 /nfs/dbraw/zinc/32/49/10/564324910.db2.gz ACFCRAFCZKEHCW-LBPRGKRZSA-N 0 0 379.463 3.108 20 5 GGBDRN Cc1nc(C)c(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)s1 ZINC000120547341 564325824 /nfs/dbraw/zinc/32/58/24/564325824.db2.gz OPYJRDIVHBFUDQ-UHFFFAOYSA-N 0 0 384.255 3.290 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000120604762 564328348 /nfs/dbraw/zinc/32/83/48/564328348.db2.gz FRFONWHBKHFJSV-CHWSQXEVSA-N 0 0 380.388 3.178 20 5 GGBDRN O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cc(Cl)c[nH]1 ZINC000024073226 564328787 /nfs/dbraw/zinc/32/87/87/564328787.db2.gz LJDWDAQEOBGWDY-UHFFFAOYSA-N 0 0 376.722 3.437 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000024434741 564330889 /nfs/dbraw/zinc/33/08/89/564330889.db2.gz LYOBWRRBKOIWSJ-HNNXBMFYSA-N 0 0 381.841 3.477 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2noc(-c3ccc(Cl)cc3)n2)cc1 ZINC000120698493 564333528 /nfs/dbraw/zinc/33/35/28/564333528.db2.gz WAHFSNVXKDUDTA-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC[C@@H](Oc2ccncc2)C1 ZINC000120745787 564334911 /nfs/dbraw/zinc/33/49/11/564334911.db2.gz AZMNVUSETOLQOI-CYBMUJFWSA-N 0 0 392.209 3.046 20 5 GGBDRN C[C@@H](NC(=O)c1cc(I)cc([N+](=O)[O-])c1)c1cccnc1 ZINC000120809686 564338154 /nfs/dbraw/zinc/33/81/54/564338154.db2.gz LJMMXUPMFUZTFF-SECBINFHSA-N 0 0 397.172 3.085 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC(n2ccnc2)CC1 ZINC000120825808 564338788 /nfs/dbraw/zinc/33/87/88/564338788.db2.gz ZPPFBDMYWBJFSQ-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN Cc1ccc(C(=O)NCC(=O)Nc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000025396707 564338882 /nfs/dbraw/zinc/33/88/82/564338882.db2.gz WOUGWHRZQGMSTF-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCc2nc(C(F)(F)F)cs2)c1C ZINC000120875655 564340789 /nfs/dbraw/zinc/34/07/89/564340789.db2.gz QLXDQENIJIAQEB-UHFFFAOYSA-N 0 0 395.384 3.165 20 5 GGBDRN CCn1nc(C)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1C ZINC000120920725 564343300 /nfs/dbraw/zinc/34/33/00/564343300.db2.gz MWXUUNYZDUNJFX-UHFFFAOYSA-N 0 0 381.230 3.372 20 5 GGBDRN Cc1csc([C@H](NS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C2CC2)n1 ZINC000120965768 564346278 /nfs/dbraw/zinc/34/62/78/564346278.db2.gz COLWDKUQDIONIE-CQSZACIVSA-N 0 0 381.479 3.406 20 5 GGBDRN CN(Cc1ccccc1Br)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000026711970 564349065 /nfs/dbraw/zinc/34/90/65/564349065.db2.gz DYPWMLPLXDFIDV-OAHLLOKOSA-N 0 0 395.253 3.229 20 5 GGBDRN CNS(=O)(=O)c1ccc(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)s1 ZINC000121052123 564350282 /nfs/dbraw/zinc/35/02/82/564350282.db2.gz DMUOIEKEXWIWNW-UHFFFAOYSA-N 0 0 396.277 3.483 20 5 GGBDRN CN(Cc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Br)s1 ZINC000026979668 564351728 /nfs/dbraw/zinc/35/17/28/564351728.db2.gz YPGBVBRTJWJJQM-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN CN(Cc1ccccc1Br)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027348312 564353540 /nfs/dbraw/zinc/35/35/40/564353540.db2.gz QLSGIALQKICYNW-UHFFFAOYSA-N 0 0 378.226 3.088 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1c1ccccc1Br ZINC000121114895 564354294 /nfs/dbraw/zinc/35/42/94/564354294.db2.gz BGFPKXWVANGJSS-HNNXBMFYSA-N 0 0 393.241 3.308 20 5 GGBDRN CCS(=O)(=O)N1CCC(Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000121162341 564357162 /nfs/dbraw/zinc/35/71/62/564357162.db2.gz RJQFYUQTLKRYFO-UHFFFAOYSA-N 0 0 382.269 3.128 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)CCOc1ccccc1Cl ZINC000027963833 564357650 /nfs/dbraw/zinc/35/76/50/564357650.db2.gz GTOBXLXNYFMUFL-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000028060278 564359596 /nfs/dbraw/zinc/35/95/96/564359596.db2.gz JUEBIYXTWAZVBM-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)NCCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000028333068 564362490 /nfs/dbraw/zinc/36/24/90/564362490.db2.gz NSWIBQIEVOXNKK-UHFFFAOYSA-N 0 0 388.804 3.053 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)NC(=O)CS2 ZINC000028718115 564363319 /nfs/dbraw/zinc/36/33/19/564363319.db2.gz DIAUINPJFJRIRZ-UHFFFAOYSA-N 0 0 375.431 3.370 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(C(N)=O)c1 ZINC000029019527 564366039 /nfs/dbraw/zinc/36/60/39/564366039.db2.gz XXWVFCGDBJRADG-VIFPVBQESA-N 0 0 379.825 3.466 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](CCCO)c2ccccc2)c(Cl)c1 ZINC000121393494 564366914 /nfs/dbraw/zinc/36/69/14/564366914.db2.gz RMSQSDYWJKJXES-OAHLLOKOSA-N 0 0 384.841 3.040 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](CCCO)c2ccccc2)c(Cl)c1 ZINC000121393652 564367013 /nfs/dbraw/zinc/36/70/13/564367013.db2.gz RMSQSDYWJKJXES-HNNXBMFYSA-N 0 0 384.841 3.040 20 5 GGBDRN COCCN(CC(F)F)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000121412080 564367612 /nfs/dbraw/zinc/36/76/12/564367612.db2.gz KCGCALGYFUHFCQ-UHFFFAOYSA-N 0 0 381.173 3.019 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H](CCCO)c1ccccc1 ZINC000121407334 564367760 /nfs/dbraw/zinc/36/77/60/564367760.db2.gz UGOINHXJLCEEOG-CQSZACIVSA-N 0 0 384.841 3.040 20 5 GGBDRN CC(C)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000121442344 564369675 /nfs/dbraw/zinc/36/96/75/564369675.db2.gz KIFSSVHYNTYBAK-SECBINFHSA-N 0 0 376.194 3.364 20 5 GGBDRN O=C(Cc1noc(-c2cc(Br)cc([N+](=O)[O-])c2)n1)NC1CCCC1 ZINC000121525987 564372955 /nfs/dbraw/zinc/37/29/55/564372955.db2.gz FEHBACGTHYBLDJ-UHFFFAOYSA-N 0 0 395.213 3.009 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OCc2nc(C3CC3)no2)c1 ZINC000121520823 564372992 /nfs/dbraw/zinc/37/29/92/564372992.db2.gz RBGRJHYIYWAASK-UHFFFAOYSA-N 0 0 387.133 3.039 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2nc(C(F)(F)F)cs2)cc1C ZINC000121560145 564374863 /nfs/dbraw/zinc/37/48/63/564374863.db2.gz KGYHPJIHEDETAO-UHFFFAOYSA-N 0 0 395.384 3.165 20 5 GGBDRN O=C(c1cccc(I)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000029891750 564374887 /nfs/dbraw/zinc/37/48/87/564374887.db2.gz YEXWISXZZUKAPH-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN O=C(NC(C1CC1)C1CC1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000121576239 564375712 /nfs/dbraw/zinc/37/57/12/564375712.db2.gz RBBSBXCAIBBIKR-UHFFFAOYSA-N 0 0 386.189 3.118 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)cc1 ZINC000121600588 564376645 /nfs/dbraw/zinc/37/66/45/564376645.db2.gz LNSCZQFIVWOPPC-WFASDCNBSA-N 0 0 384.816 3.363 20 5 GGBDRN CN(Cc1ccc(Br)o1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000030214110 564377174 /nfs/dbraw/zinc/37/71/74/564377174.db2.gz UNJBBOTVKRUYBX-UHFFFAOYSA-N 0 0 383.198 3.449 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)Cc1ccc(Br)o1 ZINC000030213658 564377246 /nfs/dbraw/zinc/37/72/46/564377246.db2.gz GVLAGNOVTPEVIR-UHFFFAOYSA-N 0 0 382.214 3.329 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)Cc1ccc(Br)o1 ZINC000030213679 564377258 /nfs/dbraw/zinc/37/72/58/564377258.db2.gz VRWZNDLBEDIVSK-UHFFFAOYSA-N 0 0 382.214 3.329 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)Cc1ccc(Br)o1 ZINC000030214750 564378277 /nfs/dbraw/zinc/37/82/77/564378277.db2.gz UYMBYOIGOBAJOF-SNVBAGLBSA-N 0 0 382.214 3.409 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(SC)cc2)c([N+](=O)[O-])c1 ZINC000030366108 564379913 /nfs/dbraw/zinc/37/99/13/564379913.db2.gz UYXQPEHAUISMEZ-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN CC(C)N(C1CCC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000121681805 564381821 /nfs/dbraw/zinc/38/18/21/564381821.db2.gz 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ZINC000032004800 564395846 /nfs/dbraw/zinc/39/58/46/564395846.db2.gz DQBLBYPBSUKIGN-UHFFFAOYSA-N 0 0 387.248 3.321 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCCSc1ccccc1 ZINC000032414290 564398373 /nfs/dbraw/zinc/39/83/73/564398373.db2.gz GJZBDXCTSRZCRX-UHFFFAOYSA-N 0 0 382.463 3.064 20 5 GGBDRN CN(Cc1cc(Br)cs1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000122045282 564398507 /nfs/dbraw/zinc/39/85/07/564398507.db2.gz DMZWVOICUYFQAV-UHFFFAOYSA-N 0 0 398.238 3.016 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)c1ccc(SC)cc1 ZINC000032435602 564399209 /nfs/dbraw/zinc/39/92/09/564399209.db2.gz VRRHZLPSYYPXNG-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2CCSc3ccccc32)c([N+](=O)[O-])c1 ZINC000032444904 564400706 /nfs/dbraw/zinc/40/07/06/564400706.db2.gz DSWYEYWGUOAMEB-CYBMUJFWSA-N 0 0 380.447 3.119 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000032436137 564400853 /nfs/dbraw/zinc/40/08/53/564400853.db2.gz CRJGIQSESBNDPI-CYBMUJFWSA-N 0 0 382.463 3.363 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cc2c(cc1Cl)OCCO2 ZINC000032632603 564403270 /nfs/dbraw/zinc/40/32/70/564403270.db2.gz UXEXMQLPBGWPJB-UHFFFAOYSA-N 0 0 384.797 3.129 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cc2c(cc1Cl)OCCO2 ZINC000032632633 564403504 /nfs/dbraw/zinc/40/35/04/564403504.db2.gz LXQVZRBZJCIXII-UHFFFAOYSA-N 0 0 384.797 3.129 20 5 GGBDRN CCS(=O)(=O)c1ccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 ZINC000032619272 564403697 /nfs/dbraw/zinc/40/36/97/564403697.db2.gz IEURRLDKAGCBKS-UHFFFAOYSA-N 0 0 380.447 3.363 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(-c2nc(-c3ccccn3)no2)c1 ZINC000122224798 564405083 /nfs/dbraw/zinc/40/50/83/564405083.db2.gz RHBJANNCZUWQQK-UHFFFAOYSA-N 0 0 394.128 3.311 20 5 GGBDRN COc1cccc2c1N(S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CCC2 ZINC000122308844 564408756 /nfs/dbraw/zinc/40/87/56/564408756.db2.gz BGZWLUGXSLPZOY-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)c1cccc(Br)n1 ZINC000122524969 564417010 /nfs/dbraw/zinc/41/70/10/564417010.db2.gz QUIHAMMQXDTROI-UHFFFAOYSA-N 0 0 394.225 3.354 20 5 GGBDRN COCCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(Br)n1 ZINC000122556304 564418850 /nfs/dbraw/zinc/41/88/50/564418850.db2.gz DCSYGUYFGNLXFC-UHFFFAOYSA-N 0 0 394.225 3.354 20 5 GGBDRN COCCN(C(=O)c1cc([N+](=O)[O-])ccc1C)c1cccc(Br)n1 ZINC000122563061 564419186 /nfs/dbraw/zinc/41/91/86/564419186.db2.gz YHMJUKICBZDEAN-UHFFFAOYSA-N 0 0 394.225 3.354 20 5 GGBDRN O=C(CCCc1cc(Cl)sc1Cl)NCCn1cc([N+](=O)[O-])cn1 ZINC000122624213 564420962 /nfs/dbraw/zinc/42/09/62/564420962.db2.gz PFVPSXMXJHRLTD-UHFFFAOYSA-N 0 0 377.253 3.299 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCSc3ccccc32)c([N+](=O)[O-])c1 ZINC000040039881 564425205 /nfs/dbraw/zinc/42/52/05/564425205.db2.gz BVRWIZNEHHQOIW-UHFFFAOYSA-N 0 0 380.447 3.295 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(O)c(Br)c1 ZINC000122762362 564427030 /nfs/dbraw/zinc/42/70/30/564427030.db2.gz FGEWNGDUQKMOJC-UHFFFAOYSA-N 0 0 396.197 3.393 20 5 GGBDRN COc1cccc(NC(=O)COc2c(Br)cccc2[N+](=O)[O-])c1 ZINC000122793868 564427837 /nfs/dbraw/zinc/42/78/37/564427837.db2.gz XEXSPQDGYMKNMN-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN COc1ccc(Cl)cc1S(=O)(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000040631181 564428375 /nfs/dbraw/zinc/42/83/75/564428375.db2.gz WWSQDUUZYFCNMA-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN COc1ccc(NC(=O)COc2c(Br)cccc2[N+](=O)[O-])cc1 ZINC000122833662 564428662 /nfs/dbraw/zinc/42/86/62/564428662.db2.gz ZGYKCSTVODQXTF-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN CN(Cc1ccc(Br)o1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000041382042 564431955 /nfs/dbraw/zinc/43/19/55/564431955.db2.gz DKBVBMBLFBRUCJ-UHFFFAOYSA-N 0 0 379.170 3.099 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1csc(C)n1 ZINC000122997229 564435727 /nfs/dbraw/zinc/43/57/27/564435727.db2.gz ZYVKQMYIFFRZCA-UHFFFAOYSA-N 0 0 381.479 3.370 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1nc(C(F)(F)F)cs1 ZINC000123148424 564440097 /nfs/dbraw/zinc/44/00/97/564440097.db2.gz 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ZINC000043531543 564459656 /nfs/dbraw/zinc/45/96/56/564459656.db2.gz NFPLQXXIJDAOOD-UHFFFAOYSA-N 0 0 377.447 3.166 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2nc(C(C)(C)C)cs2)cc1[N+](=O)[O-] ZINC000123760428 564460083 /nfs/dbraw/zinc/46/00/83/564460083.db2.gz VSVXSWNAJUMQMT-UHFFFAOYSA-N 0 0 375.497 3.197 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1cc(Br)cs1 ZINC000043884474 564463082 /nfs/dbraw/zinc/46/30/82/564463082.db2.gz NCGXEUBUHPVASN-UHFFFAOYSA-N 0 0 399.270 3.330 20 5 GGBDRN Cc1ccnc(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)c1 ZINC000123843688 564463319 /nfs/dbraw/zinc/46/33/19/564463319.db2.gz MRLLRWISDMOXNH-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN COc1ccc(Cn2cnc3c(Br)cccc3c2=O)cc1[N+](=O)[O-] ZINC000044041116 564464252 /nfs/dbraw/zinc/46/42/52/564464252.db2.gz IUFDEQJTKBQBOX-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccco2)C1 ZINC000123876740 564464345 /nfs/dbraw/zinc/46/43/45/564464345.db2.gz RPSKWHCYQJKPHZ-CQSZACIVSA-N 0 0 381.182 3.164 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCO[C@H](c2ccco2)C1 ZINC000123876516 564464390 /nfs/dbraw/zinc/46/43/90/564464390.db2.gz RPSKWHCYQJKPHZ-AWEZNQCLSA-N 0 0 381.182 3.164 20 5 GGBDRN Cc1cc(Br)oc1C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000044292664 564465701 /nfs/dbraw/zinc/46/57/01/564465701.db2.gz IZAIFZRXQNFTIL-UHFFFAOYSA-N 0 0 394.225 3.221 20 5 GGBDRN Cc1cc(Br)oc1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000044614894 564470346 /nfs/dbraw/zinc/47/03/46/564470346.db2.gz LXIBAMWNGAPWHS-UHFFFAOYSA-N 0 0 394.225 3.221 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000124121990 564472226 /nfs/dbraw/zinc/47/22/26/564472226.db2.gz MFDUOUMPNSVPGA-ABAIWWIYSA-N 0 0 393.241 3.277 20 5 GGBDRN CN(CCOc1ccccc1F)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000044770829 564472512 /nfs/dbraw/zinc/47/25/12/564472512.db2.gz VGJKIAPRZYBPAN-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2cccc(Br)c2)cc([N+](=O)[O-])c1 ZINC000045173211 564478692 /nfs/dbraw/zinc/47/86/92/564478692.db2.gz SHJCXWPDWCIBFH-UHFFFAOYSA-N 0 0 393.193 3.074 20 5 GGBDRN CN(Cc1ccccc1Br)C(=O)CNc1cccc([N+](=O)[O-])c1 ZINC000124334174 564478868 /nfs/dbraw/zinc/47/88/68/564478868.db2.gz CQZWBEXEVYKSOF-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN COc1cc(C(=O)NCc2cccc(Br)c2)c([N+](=O)[O-])cc1OC ZINC000045172925 564479051 /nfs/dbraw/zinc/47/90/51/564479051.db2.gz GTLIPENTDGLLES-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=C(NCCc1ccc(Br)s1)NCc1ccccc1[N+](=O)[O-] ZINC000045393900 564483459 /nfs/dbraw/zinc/48/34/59/564483459.db2.gz KBFQTANMTCCQBZ-UHFFFAOYSA-N 0 0 384.255 3.461 20 5 GGBDRN COc1ccc(C(=O)NCc2cc(Br)ccc2F)cc1[N+](=O)[O-] ZINC000045399145 564483880 /nfs/dbraw/zinc/48/38/80/564483880.db2.gz ODILRCZEWXKRJZ-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCCC[C@H]1c1ncc[nH]1 ZINC000124575836 564487024 /nfs/dbraw/zinc/48/70/24/564487024.db2.gz GADRZCMDACGGEV-LBPRGKRZSA-N 0 0 384.845 3.196 20 5 GGBDRN Cc1ccsc1CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000045733662 564488486 /nfs/dbraw/zinc/48/84/86/564488486.db2.gz VMKSAHWQLDDXJR-UHFFFAOYSA-N 0 0 381.479 3.361 20 5 GGBDRN Cc1csc(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)n1 ZINC000124626210 564488794 /nfs/dbraw/zinc/48/87/94/564488794.db2.gz CYZCNOKVZZGPLG-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCSCc2ccccc2F)cc1 ZINC000045798019 564490063 /nfs/dbraw/zinc/49/00/63/564490063.db2.gz HBVMEENHDZPTCX-UHFFFAOYSA-N 0 0 384.454 3.087 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2ccc(Cl)c(F)c2)c([N+](=O)[O-])c1 ZINC000045999587 564492681 /nfs/dbraw/zinc/49/26/81/564492681.db2.gz OIUCDNPPUNLEOI-UHFFFAOYSA-N 0 0 383.788 3.217 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)Cc1ccc(Br)o1 ZINC000046034114 564493804 /nfs/dbraw/zinc/49/38/04/564493804.db2.gz ZCSMJWJVHBYTEF-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN COc1cc(C(=O)NCc2ccccc2[N+](=O)[O-])cc(OC)c1Br ZINC000046147413 564496071 /nfs/dbraw/zinc/49/60/71/564496071.db2.gz JMQKNHXOGBHVJM-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000124868836 564496326 /nfs/dbraw/zinc/49/63/26/564496326.db2.gz BGPYOXWEVZYMOM-XHDPSFHLSA-N 0 0 382.463 3.115 20 5 GGBDRN O=C(CCOc1cccc(Br)c1)NCc1ccccc1[N+](=O)[O-] ZINC000046135876 564496631 /nfs/dbraw/zinc/49/66/31/564496631.db2.gz SQVPFADQABFZIM-UHFFFAOYSA-N 0 0 379.210 3.443 20 5 GGBDRN O=C(NCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cccs1 ZINC000046202085 564498557 /nfs/dbraw/zinc/49/85/57/564498557.db2.gz MBYRHAZGUAFZTR-UHFFFAOYSA-N 0 0 375.431 3.031 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCOC[C@@H]3C)cc2[N+](=O)[O-])n1 ZINC000046258632 564500824 /nfs/dbraw/zinc/50/08/24/564500824.db2.gz VYOGHLLJVOAKMT-NSHDSACASA-N 0 0 379.463 3.372 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2ccccc2)CC(F)F)cc1[N+](=O)[O-] ZINC000125026061 564501128 /nfs/dbraw/zinc/50/11/28/564501128.db2.gz NVWRJTKSLJFTOS-UHFFFAOYSA-N 0 0 376.406 3.421 20 5 GGBDRN CN(CC(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cccs1 ZINC000046326083 564501514 /nfs/dbraw/zinc/50/15/14/564501514.db2.gz FXEJKXCCKMWYBK-UHFFFAOYSA-N 0 0 381.841 3.040 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H](C)c1ccc(Cl)s1 ZINC000046388581 564502606 /nfs/dbraw/zinc/50/26/06/564502606.db2.gz ZPPIMYGPDHJQGZ-NXEZZACHSA-N 0 0 381.841 3.305 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000046646456 564505312 /nfs/dbraw/zinc/50/53/12/564505312.db2.gz LFBJQJZPENQEPU-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000046737840 564506573 /nfs/dbraw/zinc/50/65/73/564506573.db2.gz QKXIMLYYHPCYGG-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=C(NC[C@H]1CCN(CC(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000046954440 564511024 /nfs/dbraw/zinc/51/10/24/564511024.db2.gz PRCLHWAFZQWWIV-SECBINFHSA-N 0 0 380.754 3.254 20 5 GGBDRN O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000046956428 564511206 /nfs/dbraw/zinc/51/12/06/564511206.db2.gz GVOWOWQIYVPODR-VIFPVBQESA-N 0 0 380.754 3.254 20 5 GGBDRN O=c1cc(COc2ccc([N+](=O)[O-])cc2F)nc2ccc(Br)cn12 ZINC000047355184 564518682 /nfs/dbraw/zinc/51/86/82/564518682.db2.gz XLNRKRVYGXUFCP-UHFFFAOYSA-N 0 0 394.156 3.083 20 5 GGBDRN COc1ccc(Cn2cnc3ccc(Br)cc3c2=O)cc1[N+](=O)[O-] ZINC000047368638 564518908 /nfs/dbraw/zinc/51/89/08/564518908.db2.gz WFJMBIXCYMVWMP-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1cc(Br)ccc1F ZINC000047368383 564519239 /nfs/dbraw/zinc/51/92/39/564519239.db2.gz VPSZHQYXRLDDPY-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2OC(F)F)c(Cl)c1 ZINC000047543720 564522380 /nfs/dbraw/zinc/52/23/80/564522380.db2.gz PUSLIJCRDUSQCV-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1(c2cccc(Br)c2)CC1 ZINC000125733190 564524757 /nfs/dbraw/zinc/52/47/57/564524757.db2.gz DQCYCRICVRYMSU-UHFFFAOYSA-N 0 0 393.241 3.058 20 5 GGBDRN O=C(CCOc1cccc(Br)c1)NCCc1cccc([N+](=O)[O-])c1 ZINC000125838337 564528730 /nfs/dbraw/zinc/52/87/30/564528730.db2.gz USYALHGYULWXHU-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN COc1cc(CN(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)ccc1O ZINC000125846167 564529350 /nfs/dbraw/zinc/52/93/50/564529350.db2.gz ZHCWFKRLFGUJQI-UHFFFAOYSA-N 0 0 395.209 3.344 20 5 GGBDRN O=C(Nc1ccc(Br)cc1O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000126026025 564534026 /nfs/dbraw/zinc/53/40/26/564534026.db2.gz LTEJDESGOAYPDC-UHFFFAOYSA-N 0 0 377.154 3.192 20 5 GGBDRN C[C@@H](Oc1ccc(Br)cc1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126026123 564534170 /nfs/dbraw/zinc/53/41/70/564534170.db2.gz VPHARLIVBMXFGE-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1COc2ccc(Br)cc21 ZINC000126041198 564534811 /nfs/dbraw/zinc/53/48/11/564534811.db2.gz ZMMKRPXTQDHJIA-OAHLLOKOSA-N 0 0 391.221 3.192 20 5 GGBDRN C[C@H]1CSc2ccccc2N1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000126032652 564535086 /nfs/dbraw/zinc/53/50/86/564535086.db2.gz AOUWOBJNGABCPP-ZDUSSCGKSA-N 0 0 378.475 3.468 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(c2ncccc2Cl)CC1 ZINC000048293687 564535752 /nfs/dbraw/zinc/53/57/52/564535752.db2.gz XLHHEWYZZQZFSZ-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN O=C(Cn1cc(Br)c([N+](=O)[O-])n1)c1sccc1Br ZINC000048439681 564539442 /nfs/dbraw/zinc/53/94/42/564539442.db2.gz RTMATJRLRMQKRN-UHFFFAOYSA-N 0 0 395.032 3.261 20 5 GGBDRN O=[N+]([O-])c1nn(CCOc2ccc(Br)cc2)cc1Br ZINC000048439686 564539477 /nfs/dbraw/zinc/53/94/77/564539477.db2.gz BDGSSHOHNNAHNO-UHFFFAOYSA-N 0 0 391.019 3.395 20 5 GGBDRN COc1ncccc1CNc1ccc(I)cc1[N+](=O)[O-] ZINC000048557356 564542983 /nfs/dbraw/zinc/54/29/83/564542983.db2.gz QPHWWDHLKSUFMO-UHFFFAOYSA-N 0 0 385.161 3.215 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2cc3c(c(Cl)c2)OCO3)cccc1[N+](=O)[O-] ZINC000048717195 564544401 /nfs/dbraw/zinc/54/44/01/564544401.db2.gz OUIHWJHRHATFLS-UHFFFAOYSA-N 0 0 383.809 3.400 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2noc(-c3ccsc3)n2)cccc1[N+](=O)[O-] ZINC000048717528 564544562 /nfs/dbraw/zinc/54/45/62/564544562.db2.gz RTNDOPXKKXRUNJ-UHFFFAOYSA-N 0 0 379.419 3.130 20 5 GGBDRN COC[C@H](NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)c1ccco1 ZINC000126394565 564547902 /nfs/dbraw/zinc/54/79/02/564547902.db2.gz DMYVAPQAGHUTTD-LBPRGKRZSA-N 0 0 383.198 3.376 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccccc1I ZINC000049379773 564551133 /nfs/dbraw/zinc/55/11/33/564551133.db2.gz YLIITKXRJMPUNW-UHFFFAOYSA-N 0 0 382.157 3.129 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000126629183 564556195 /nfs/dbraw/zinc/55/61/95/564556195.db2.gz ORAUJKVGOKSHOD-UHFFFAOYSA-N 0 0 383.223 3.340 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)CCO2 ZINC000126676067 564557939 /nfs/dbraw/zinc/55/79/39/564557939.db2.gz JFIVPOMTEHQEPM-UHFFFAOYSA-N 0 0 392.209 3.029 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCCc1nccs1 ZINC000050953595 564561322 /nfs/dbraw/zinc/56/13/22/564561322.db2.gz ULDFMNJZGRMRFT-UHFFFAOYSA-N 0 0 375.191 3.311 20 5 GGBDRN COc1cc(CNc2ccc(I)cc2[N+](=O)[O-])ccn1 ZINC000051650814 564565870 /nfs/dbraw/zinc/56/58/70/564565870.db2.gz XWAXWVWDFPGJPJ-UHFFFAOYSA-N 0 0 385.161 3.215 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1Br ZINC000126858087 564565985 /nfs/dbraw/zinc/56/59/85/564565985.db2.gz CKBCOXXIVVGSRD-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN O=C(Nc1cc(Br)ccc1-n1cncn1)c1cccc([N+](=O)[O-])c1 ZINC000051987141 564568218 /nfs/dbraw/zinc/56/82/18/564568218.db2.gz GBXMAXHVOIBTLB-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CN(Cc1csc2ccccc12)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000052241004 564570541 /nfs/dbraw/zinc/57/05/41/564570541.db2.gz HMYPEEYDNWCFMS-UHFFFAOYSA-N 0 0 377.447 3.093 20 5 GGBDRN O=C(CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])Nc1ccc(Br)cc1 ZINC000052464242 564572263 /nfs/dbraw/zinc/57/22/63/564572263.db2.gz GEFPHUPGISKTHA-UHFFFAOYSA-N 0 0 395.169 3.316 20 5 GGBDRN CN(Cc1cc(Cl)cn1C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000127057761 564572483 /nfs/dbraw/zinc/57/24/83/564572483.db2.gz GBZCTNZNJMPGME-UHFFFAOYSA-N 0 0 378.237 3.061 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCO[C@@H](c3ccco3)C2)cc1[N+](=O)[O-] ZINC000127101036 564572908 /nfs/dbraw/zinc/57/29/08/564572908.db2.gz GTACDMBPZPJZRQ-OAHLLOKOSA-N 0 0 395.209 3.472 20 5 GGBDRN O=C(NCc1nc2cc(F)ccc2[nH]1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000127119053 564573995 /nfs/dbraw/zinc/57/39/95/564573995.db2.gz XREPJCQTYJIRQN-UHFFFAOYSA-N 0 0 393.172 3.303 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(N2CCCC2)s1 ZINC000052911712 564578221 /nfs/dbraw/zinc/57/82/21/564578221.db2.gz KXIAGORXUQYHKY-UHFFFAOYSA-N 0 0 379.467 3.086 20 5 GGBDRN C[C@H](Sc1nnc(N2CCCC2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000052911886 564578447 /nfs/dbraw/zinc/57/84/47/564578447.db2.gz YBBQFKGAAPUUAV-JTQLQIEISA-N 0 0 379.467 3.166 20 5 GGBDRN O=C(NCCc1ccc(Br)s1)NCc1cccc([N+](=O)[O-])c1 ZINC000127280840 564578890 /nfs/dbraw/zinc/57/88/90/564578890.db2.gz BMFZIPYORCDVFE-UHFFFAOYSA-N 0 0 384.255 3.461 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ccc(Br)cn1 ZINC000052914953 564579245 /nfs/dbraw/zinc/57/92/45/564579245.db2.gz KNRVQKFKKHCALF-UHFFFAOYSA-N 0 0 398.238 3.492 20 5 GGBDRN O=C(CSc1ccc(Br)cn1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000052915553 564579285 /nfs/dbraw/zinc/57/92/85/564579285.db2.gz FHVVQCCKCITARP-UHFFFAOYSA-N 0 0 394.250 3.434 20 5 GGBDRN COc1ccc(NC(=O)CSc2ccc(Br)cn2)c([N+](=O)[O-])c1 ZINC000052914942 564579362 /nfs/dbraw/zinc/57/93/62/564579362.db2.gz RWHVFBNJOZPMIL-UHFFFAOYSA-N 0 0 398.238 3.492 20 5 GGBDRN O=c1c(Br)cn(-c2nc(-c3ccccc3)ns2)cc1[N+](=O)[O-] ZINC000127375804 564582109 /nfs/dbraw/zinc/58/21/09/564582109.db2.gz GCHWKPAZGGCCMW-UHFFFAOYSA-N 0 0 379.195 3.027 20 5 GGBDRN O=C(Cc1ccc(F)c(Br)c1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053219063 564582875 /nfs/dbraw/zinc/58/28/75/564582875.db2.gz QWYDXZSQNKCDDU-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCc3sccc3C2)c1 ZINC000053267577 564583917 /nfs/dbraw/zinc/58/39/17/564583917.db2.gz FDEVQXOXUWDODM-UHFFFAOYSA-N 0 0 377.491 3.166 20 5 GGBDRN C[C@@H]1CO[C@@H](C)CN1C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000127583041 564588820 /nfs/dbraw/zinc/58/88/20/564588820.db2.gz FZYQXZLDMRYVBY-ZJUUUORDSA-N 0 0 378.372 3.342 20 5 GGBDRN CNC(=O)c1ccc(NCc2cc(Br)ccc2F)c([N+](=O)[O-])c1 ZINC000053559765 564590553 /nfs/dbraw/zinc/59/05/53/564590553.db2.gz XBJJBAPRKMVPAF-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN NS(=O)(=O)c1ccc(NCCc2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000053578788 564591264 /nfs/dbraw/zinc/59/12/64/564591264.db2.gz UOTBJSNMRFVUHB-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN CNC(=O)c1ccc(NCc2cc(OC)ccc2Br)c([N+](=O)[O-])c1 ZINC000053573665 564591498 /nfs/dbraw/zinc/59/14/98/564591498.db2.gz PYWFTZGWKCBKFD-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NCc1ncccc1F ZINC000127670216 564591772 /nfs/dbraw/zinc/59/17/72/564591772.db2.gz TYORGDOVYJHMKV-UHFFFAOYSA-N 0 0 379.291 3.035 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCCSc1nnc(NC[C@@H]2CCCO2)s1 ZINC000053631221 564592356 /nfs/dbraw/zinc/59/23/56/564592356.db2.gz SICULDLZPSJFMN-NSHDSACASA-N 0 0 382.467 3.208 20 5 GGBDRN CCc1nc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)sc1C(=O)OC ZINC000127697061 564592468 /nfs/dbraw/zinc/59/24/68/564592468.db2.gz WDJYIBZSGSASRE-UHFFFAOYSA-N 0 0 383.813 3.235 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CSc2ccc(Br)cn2)c1 ZINC000053723982 564594152 /nfs/dbraw/zinc/59/41/52/564594152.db2.gz WFAZABLOAKSZCK-LBPRGKRZSA-N 0 0 385.239 3.284 20 5 GGBDRN CC(C)(C)n1nccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000127839097 564598029 /nfs/dbraw/zinc/59/80/29/564598029.db2.gz VXVCIWMFCSNFAT-UHFFFAOYSA-N 0 0 381.230 3.490 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccc(F)c(Br)c3)CC2)cn1 ZINC000054174692 564600343 /nfs/dbraw/zinc/60/03/43/564600343.db2.gz XNBSBSJSHYEJAR-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN O=C(NCc1ccc(F)cc1Br)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000054263635 564602531 /nfs/dbraw/zinc/60/25/31/564602531.db2.gz IJIJJXHURQUSOJ-UHFFFAOYSA-N 0 0 393.172 3.303 20 5 GGBDRN CN(Cc1cccc(Cl)c1)C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000127965520 564602964 /nfs/dbraw/zinc/60/29/64/564602964.db2.gz SYXIBIFGBAULTE-UHFFFAOYSA-N 0 0 382.203 3.499 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000054900235 564611881 /nfs/dbraw/zinc/61/18/81/564611881.db2.gz YRUKKZDVHFSHBG-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN CC(C)[C@@H](NC(=O)Cn1cc(Br)c([N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000054919249 564612445 /nfs/dbraw/zinc/61/24/45/564612445.db2.gz XOGDEZQPCQSAFE-CQSZACIVSA-N 0 0 399.220 3.206 20 5 GGBDRN COC[C@H](C)n1c(C)cc(C(=O)Cn2cc(Br)c([N+](=O)[O-])n2)c1C ZINC000054919233 564612805 /nfs/dbraw/zinc/61/28/05/564612805.db2.gz XHUJJTMNFVOPFL-JTQLQIEISA-N 0 0 399.245 3.062 20 5 GGBDRN Cc1cc(C)c(NC(=O)Cn2cc(Br)c([N+](=O)[O-])n2)c(Cl)c1 ZINC000054919761 564612882 /nfs/dbraw/zinc/61/28/82/564612882.db2.gz WYLCESFDAMBQLL-UHFFFAOYSA-N 0 0 387.621 3.463 20 5 GGBDRN COC[C@@H](C)n1c(C)cc(C(=O)Cn2cc(Br)c([N+](=O)[O-])n2)c1C ZINC000054919235 564612978 /nfs/dbraw/zinc/61/29/78/564612978.db2.gz XHUJJTMNFVOPFL-SNVBAGLBSA-N 0 0 399.245 3.062 20 5 GGBDRN CCOC(=O)CC[C@@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000128303080 564614319 /nfs/dbraw/zinc/61/43/19/564614319.db2.gz BPYHWPXXFHWAJJ-NSHDSACASA-N 0 0 386.246 3.312 20 5 GGBDRN CSCCNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000128333884 564615403 /nfs/dbraw/zinc/61/54/03/564615403.db2.gz NSOYRZNPPYVLEA-UHFFFAOYSA-N 0 0 375.237 3.180 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)c1cc(Br)sc1Br ZINC000055386927 564620633 /nfs/dbraw/zinc/62/06/33/564620633.db2.gz RKDYINVLAFXWLZ-UHFFFAOYSA-N 0 0 395.032 3.261 20 5 GGBDRN CC(C)Oc1ccc(Br)cc1NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000128537802 564621980 /nfs/dbraw/zinc/62/19/80/564621980.db2.gz VEPXYJJVZDOFRT-UHFFFAOYSA-N 0 0 397.229 3.370 20 5 GGBDRN Cc1c(C(=O)NCC(=O)Nc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000055548649 564623282 /nfs/dbraw/zinc/62/32/82/564623282.db2.gz GKCCXTFKNBJKSM-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=C(NCCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000128904188 564633257 /nfs/dbraw/zinc/63/32/57/564633257.db2.gz CTRAAERUDYFWQC-UHFFFAOYSA-N 0 0 382.203 3.061 20 5 GGBDRN CN(Cc1c(F)cccc1Cl)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000055961721 564636023 /nfs/dbraw/zinc/63/60/23/564636023.db2.gz YEXXJBMRQGALQV-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN Cc1cccc(OCCN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000055991011 564636805 /nfs/dbraw/zinc/63/68/05/564636805.db2.gz NCNIRQVCVGUSRG-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCSc3ccc(F)cc32)c(F)c1 ZINC000055991260 564636949 /nfs/dbraw/zinc/63/69/49/564636949.db2.gz KRLRFINUSHIOIP-ZDUSSCGKSA-N 0 0 386.401 3.388 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1ccc(Br)s1 ZINC000056039907 564637935 /nfs/dbraw/zinc/63/79/35/564637935.db2.gz IBUZNVWSNQIASZ-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1cccc(I)c1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000129190614 564640929 /nfs/dbraw/zinc/64/09/29/564640929.db2.gz LTAHFLHYTMQTNS-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000056108801 564641261 /nfs/dbraw/zinc/64/12/61/564641261.db2.gz VVRXKFVMHGKZDT-JTQLQIEISA-N 0 0 385.239 3.397 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1(CC)CC ZINC000129219920 564641590 /nfs/dbraw/zinc/64/15/90/564641590.db2.gz PCAJJPVWKYAYET-QWHCGFSZSA-N 0 0 390.527 3.480 20 5 GGBDRN CCOc1ccccc1CN(C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000056119673 564641960 /nfs/dbraw/zinc/64/19/60/564641960.db2.gz LVYYMHVSIGHTTP-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000056126804 564642140 /nfs/dbraw/zinc/64/21/40/564642140.db2.gz VJSKDOPMYNZHTL-MRXNPFEDSA-N 0 0 382.825 3.010 20 5 GGBDRN CSCC[C@@H](C)N(C)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000129304817 564644561 /nfs/dbraw/zinc/64/45/61/564644561.db2.gz AZCRXHXCRDFIDO-SECBINFHSA-N 0 0 397.316 3.119 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CN(Cc1csc(Br)c1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000057311484 564665377 /nfs/dbraw/zinc/66/53/77/564665377.db2.gz NLMMPYKOFVZITP-UHFFFAOYSA-N 0 0 388.218 3.412 20 5 GGBDRN O=C(NC1(c2cccc(Br)c2)CCOCC1)c1ccc([N+](=O)[O-])o1 ZINC000057375968 564666988 /nfs/dbraw/zinc/66/69/88/564666988.db2.gz SLCPWWXJKUDBIF-UHFFFAOYSA-N 0 0 395.209 3.386 20 5 GGBDRN O=[N+]([O-])c1ccccc1CNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000057482523 564668931 /nfs/dbraw/zinc/66/89/31/564668931.db2.gz XUOOKTWKKROLKD-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCc1csc(C(C)(C)C)n1 ZINC000130102078 564669797 /nfs/dbraw/zinc/66/97/97/564669797.db2.gz WMCDFZBALMUQEW-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cncc(Br)c1 ZINC000057683746 564671669 /nfs/dbraw/zinc/67/16/69/564671669.db2.gz FQKIMQGIPZONEE-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN O=C(Cc1csc(N2CCCC2=O)n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000057882280 564676045 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O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1ccc(Br)cc1 ZINC000130538553 564685109 /nfs/dbraw/zinc/68/51/09/564685109.db2.gz NATLWRFVOBYFGE-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1sccc1Br ZINC000058510987 564685645 /nfs/dbraw/zinc/68/56/45/564685645.db2.gz VJGYKMSLCAKDDS-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CN(CC1CCCC1)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000130557987 564685817 /nfs/dbraw/zinc/68/58/17/564685817.db2.gz UTNXLMNEPSMVMP-UHFFFAOYSA-N 0 0 388.205 3.462 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1ccc(Br)cc1F ZINC000130576034 564685983 /nfs/dbraw/zinc/68/59/83/564685983.db2.gz KDXKFYVEHQTFIF-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN CN1C(=O)CCc2cc(Nc3ncc(Br)cc3[N+](=O)[O-])ccc21 ZINC000130579739 564686150 /nfs/dbraw/zinc/68/61/50/564686150.db2.gz YRUJKEDOEHJTBQ-UHFFFAOYSA-N 0 0 377.198 3.405 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000058840983 564689545 /nfs/dbraw/zinc/68/95/45/564689545.db2.gz BGAHQMFMTIRBEY-UHFFFAOYSA-N 0 0 398.238 3.096 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000130762554 564691425 /nfs/dbraw/zinc/69/14/25/564691425.db2.gz BEEBONPYYPQOLF-NHYWBVRUSA-N 0 0 382.463 3.115 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000130770767 564691640 /nfs/dbraw/zinc/69/16/40/564691640.db2.gz CFKNDOOQXOMSKK-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CS(=O)(=O)c3ccc(Cl)cn3)co2)cc1 ZINC000130840823 564693944 /nfs/dbraw/zinc/69/39/44/564693944.db2.gz NDSYGYSTQNPWIF-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN Cc1c[nH]c(NC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)n1 ZINC000130930235 564696928 /nfs/dbraw/zinc/69/69/28/564696928.db2.gz PSIIQHBINROMPG-UHFFFAOYSA-N 0 0 381.179 3.371 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000131064979 564699258 /nfs/dbraw/zinc/69/92/58/564699258.db2.gz WGPXPYGHXQPJGA-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN 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Cc1ccnc([C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C2CC2)n1 ZINC000134259283 564798316 /nfs/dbraw/zinc/79/83/16/564798316.db2.gz VILRZZQTHHFOPR-CQSZACIVSA-N 0 0 391.225 3.337 20 5 GGBDRN CSc1ccc(Cl)cc1NC(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067766009 564798709 /nfs/dbraw/zinc/79/87/09/564798709.db2.gz CQOWBCFTUXSUCR-UHFFFAOYSA-N 0 0 379.825 3.225 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000067801719 564799617 /nfs/dbraw/zinc/79/96/17/564799617.db2.gz LXHLTFYBUFIMSI-UHFFFAOYSA-N 0 0 385.239 3.286 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(Br)c[nH]c1=O ZINC000067941250 564803150 /nfs/dbraw/zinc/80/31/50/564803150.db2.gz YVWNLMBJAWFJRB-MRVPVSSYSA-N 0 0 398.238 3.165 20 5 GGBDRN Cc1ccc(OCc2nnnn2-c2ccccc2Br)c([N+](=O)[O-])c1 ZINC000067952417 564803875 /nfs/dbraw/zinc/80/38/75/564803875.db2.gz HLKVVRCQQJMIPA-UHFFFAOYSA-N 0 0 390.197 3.220 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OCc1nnnn1-c1ccccc1Br ZINC000067952538 564804292 /nfs/dbraw/zinc/80/42/92/564804292.db2.gz JGYJLQWIXHMXSS-UHFFFAOYSA-N 0 0 390.197 3.220 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2nnnn2-c2ccccc2Br)c(F)c1 ZINC000067952536 564804369 /nfs/dbraw/zinc/80/43/69/564804369.db2.gz QZTDDPMOWXWVJE-UHFFFAOYSA-N 0 0 394.160 3.051 20 5 GGBDRN CC(C)N(CC(F)F)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000134607409 564809131 /nfs/dbraw/zinc/80/91/31/564809131.db2.gz FBAISDRLNQYFJU-UHFFFAOYSA-N 0 0 387.202 3.022 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000134638836 564809994 /nfs/dbraw/zinc/80/99/94/564809994.db2.gz JNGLZMLAISOVDC-UHFFFAOYSA-N 0 0 383.813 3.262 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(I)c1 ZINC000134749670 564814469 /nfs/dbraw/zinc/81/44/69/564814469.db2.gz PQQXCRAUKPZSSK-UHFFFAOYSA-N 0 0 382.157 3.381 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(I)cc1 ZINC000134749576 564814786 /nfs/dbraw/zinc/81/47/86/564814786.db2.gz FPKUJLMLUDYNDE-UHFFFAOYSA-N 0 0 382.157 3.381 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nnc(C(F)F)s1 ZINC000068361544 564815709 /nfs/dbraw/zinc/81/57/09/564815709.db2.gz ZEPDNRYWLYPYCV-RXMQYKEDSA-N 0 0 378.744 3.443 20 5 GGBDRN Cc1c(CN(C)CC(=O)Nc2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000068451597 564818631 /nfs/dbraw/zinc/81/86/31/564818631.db2.gz UWNLTTGEDHNREX-UHFFFAOYSA-N 0 0 393.241 3.131 20 5 GGBDRN O=C(Nc1cncc(Br)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134958988 564820600 /nfs/dbraw/zinc/82/06/00/564820600.db2.gz ZLAYPKUWOFVPTI-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN Cc1n[nH]c(C(=O)NC[C@H](C)Sc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000068568185 564822399 /nfs/dbraw/zinc/82/23/99/564822399.db2.gz LMBYZKHBSATHNN-QMMMGPOBSA-N 0 0 399.270 3.299 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1ccc(Cl)c(F)c1 ZINC000135051999 564823212 /nfs/dbraw/zinc/82/32/12/564823212.db2.gz MZOYAOHSAKTPTB-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NCc1n[nH]cc1Br ZINC000068703980 564824427 /nfs/dbraw/zinc/82/44/27/564824427.db2.gz JRYHLPZAYVTZBM-UHFFFAOYSA-N 0 0 376.008 3.455 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000135187541 564825259 /nfs/dbraw/zinc/82/52/59/564825259.db2.gz UDGCSAVMIMLUSC-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN CC(C)CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000068827123 564827247 /nfs/dbraw/zinc/82/72/47/564827247.db2.gz HHKMNGHHZOXVPJ-NWDGAFQWSA-N 0 0 385.511 3.112 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc(Br)cc2O)ccc1[N+](=O)[O-] ZINC000068858641 564828806 /nfs/dbraw/zinc/82/88/06/564828806.db2.gz PJTPVCXDJNIGHU-UHFFFAOYSA-N 0 0 397.181 3.089 20 5 GGBDRN O=C(c1cc(Br)cs1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135529765 564833942 /nfs/dbraw/zinc/83/39/42/564833942.db2.gz MWAQVCYPSFYYNM-SNVBAGLBSA-N 0 0 397.254 3.140 20 5 GGBDRN C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCN1CC(F)(F)F ZINC000135536332 564834055 /nfs/dbraw/zinc/83/40/55/564834055.db2.gz UPPXVXRJIZVDDR-SECBINFHSA-N 0 0 380.754 3.349 20 5 GGBDRN O=C(CCc1cc(Cl)cs1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135551910 564834447 /nfs/dbraw/zinc/83/44/47/564834447.db2.gz KKUKRQJZZSYEON-GFCCVEGCSA-N 0 0 380.857 3.350 20 5 GGBDRN O=C(NCCc1cc(Cl)cc(Cl)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000069278994 564836858 /nfs/dbraw/zinc/83/68/58/564836858.db2.gz LNEZYVOFAQWOER-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(c2ccc(Cl)cn2)CC1 ZINC000069404649 564839511 /nfs/dbraw/zinc/83/95/11/564839511.db2.gz FPGPUYDRMMWOFK-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN COc1ccc(C(=O)NCCOc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000135839314 564841192 /nfs/dbraw/zinc/84/11/92/564841192.db2.gz XIHWMYLZDPOEKO-UHFFFAOYSA-N 0 0 386.191 3.114 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1ncc(Cl)cc1Cl ZINC000135851421 564842287 /nfs/dbraw/zinc/84/22/87/564842287.db2.gz VZOCFXZSWHWQLR-UHFFFAOYSA-N 0 0 386.191 3.114 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCN(C)CC(F)(F)F ZINC000136016928 564843532 /nfs/dbraw/zinc/84/35/32/564843532.db2.gz VNNLFJJBZXDIEG-UHFFFAOYSA-N 0 0 379.404 3.321 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2cccc(Br)c2)cc([N+](=O)[O-])c1 ZINC000136150128 564846194 /nfs/dbraw/zinc/84/61/94/564846194.db2.gz GEFMNSFXDGIEJZ-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN CC(C)(CNC(=O)c1cc([N+](=O)[O-])ccc1SCCO)c1cccs1 ZINC000137088453 564858459 /nfs/dbraw/zinc/85/84/59/564858459.db2.gz CLSRPBSSNOPQSG-UHFFFAOYSA-N 0 0 380.491 3.448 20 5 GGBDRN Cc1ccc(Br)cc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])o1 ZINC000071933075 564859271 /nfs/dbraw/zinc/85/92/71/564859271.db2.gz WRUYTZJMXOIDJW-UHFFFAOYSA-N 0 0 396.197 3.017 20 5 GGBDRN CCCCc1nc(CS(=O)(=O)C[C@H](O)c2cccc([N+](=O)[O-])c2)cs1 ZINC000137141633 564859716 /nfs/dbraw/zinc/85/97/16/564859716.db2.gz VLCOZHMYUOJWFV-HNNXBMFYSA-N 0 0 384.479 3.042 20 5 GGBDRN COc1cc(Br)c(CNC(=O)c2ccccc2[N+](=O)[O-])cc1OC ZINC000072088728 564862187 /nfs/dbraw/zinc/86/21/87/564862187.db2.gz ZLUJIAPZVHVZKT-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CS(=O)(=O)c1cccc(NCc2sccc2Br)c1[N+](=O)[O-] ZINC000137977046 564864811 /nfs/dbraw/zinc/86/48/11/564864811.db2.gz XJZYQNPFTAIQHV-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN CNc1ccc(C(=O)NCc2cc(Br)ccc2OC)cc1[N+](=O)[O-] ZINC000138465730 564866715 /nfs/dbraw/zinc/86/67/15/564866715.db2.gz YXWCUNCLTIHFTE-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(Cc2ccc(Cl)c(F)c2)CC1 ZINC000091978524 564873575 /nfs/dbraw/zinc/87/35/75/564873575.db2.gz BWMYEQNSJVTKOV-UHFFFAOYSA-N 0 0 383.832 3.407 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(Cc2cccc(Cl)c2F)CC1 ZINC000091978479 564873582 /nfs/dbraw/zinc/87/35/82/564873582.db2.gz XDBXAIDRQULBAZ-UHFFFAOYSA-N 0 0 383.832 3.407 20 5 GGBDRN CC(C)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccncc1 ZINC000091865345 564873588 /nfs/dbraw/zinc/87/35/88/564873588.db2.gz WTVCUAUEICDTTG-UHFFFAOYSA-N 0 0 392.253 3.389 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000145379491 564878471 /nfs/dbraw/zinc/87/84/71/564878471.db2.gz CZMUMAUGLSLLSF-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN C[C@@H](Cc1cccc(Br)c1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000145379295 564878663 /nfs/dbraw/zinc/87/86/63/564878663.db2.gz CZMUMAUGLSLLSF-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN CCOc1ccc(CN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000146453392 564880802 /nfs/dbraw/zinc/88/08/02/564880802.db2.gz ROHQRQIPTWEKHV-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1c(F)cccc1F ZINC000146883246 564881480 /nfs/dbraw/zinc/88/14/80/564881480.db2.gz IILIQRZJMJEIFH-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN Cc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c(C)s1 ZINC000146909049 564882089 /nfs/dbraw/zinc/88/20/89/564882089.db2.gz WSQHOSSDFCYYRL-JTQLQIEISA-N 0 0 382.463 3.168 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccc(F)c(Br)c2)c1 ZINC000147515288 564882885 /nfs/dbraw/zinc/88/28/85/564882885.db2.gz UQDGTKRAXLGOOY-UHFFFAOYSA-N 0 0 397.200 3.478 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000147244861 564883041 /nfs/dbraw/zinc/88/30/41/564883041.db2.gz GBFTYECJMKNUCO-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCOc2cccc(Br)c2)c1 ZINC000147629197 564883057 /nfs/dbraw/zinc/88/30/57/564883057.db2.gz LZLIESHUSPRLDZ-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN Cc1ccc(CN(C)CC(=O)Nc2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000093004892 564883775 /nfs/dbraw/zinc/88/37/75/564883775.db2.gz UDTXTRRFNWRMAE-UHFFFAOYSA-N 0 0 393.241 3.131 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(Br)ccc2OC)c1 ZINC000149003143 564884971 /nfs/dbraw/zinc/88/49/71/564884971.db2.gz JVDMQACNSGHNPL-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000150712451 564887962 /nfs/dbraw/zinc/88/79/62/564887962.db2.gz SNAPLXQXLDXCQH-UHFFFAOYSA-N 0 0 392.209 3.246 20 5 GGBDRN Cc1ccccc1OCCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000150793665 564891313 /nfs/dbraw/zinc/89/13/13/564891313.db2.gz CDEJDHDTYAKURR-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1CCOc1ccc(F)cc1Cl ZINC000093904469 564891697 /nfs/dbraw/zinc/89/16/97/564891697.db2.gz YFRGTURLYIYYEF-UHFFFAOYSA-N 0 0 391.580 3.391 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC[C@@H]2c2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000150815170 564891995 /nfs/dbraw/zinc/89/19/95/564891995.db2.gz YUOSTNHEGCWOEQ-CQSZACIVSA-N 0 0 382.463 3.499 20 5 GGBDRN O=C(NCc1cccc2c1OCO2)c1ccc([N+](=O)[O-])cc1Br ZINC000150822604 564892413 /nfs/dbraw/zinc/89/24/13/564892413.db2.gz BVEKKNGQWHKBKX-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1NC[C@H](O)COc1ccccc1Br ZINC000150919908 564897427 /nfs/dbraw/zinc/89/74/27/564897427.db2.gz GSGTZIXWWRGTFB-JTQLQIEISA-N 0 0 385.189 3.348 20 5 GGBDRN COc1ccccc1N1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000096573026 564901873 /nfs/dbraw/zinc/90/18/73/564901873.db2.gz REHIHGMALVPDIH-UHFFFAOYSA-N 0 0 393.241 3.088 20 5 GGBDRN COc1ccc(CCNc2ncc(Br)cc2[N+](=O)[O-])cc1OC ZINC000096566783 564902225 /nfs/dbraw/zinc/90/22/25/564902225.db2.gz NNJTWKYRIRNIFR-UHFFFAOYSA-N 0 0 382.214 3.424 20 5 GGBDRN COc1ccc(NC(=O)c2ccc(I)cc2)cc1[N+](=O)[O-] ZINC000096506105 564902267 /nfs/dbraw/zinc/90/22/67/564902267.db2.gz BLYJRZKOLGRUSA-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCN(Cc2ccccc2)CC1 ZINC000096573034 564902925 /nfs/dbraw/zinc/90/29/25/564902925.db2.gz YHWSMHHHOSXGKX-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN CC(C)C[C@H](CCO)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000151081548 564904716 /nfs/dbraw/zinc/90/47/16/564904716.db2.gz KIBKOYDEJOCSNR-LBPRGKRZSA-N 0 0 387.274 3.061 20 5 GGBDRN O=C(COc1ccc(Br)cc1[N+](=O)[O-])NCc1ccccc1F ZINC000151150784 564907074 /nfs/dbraw/zinc/90/70/74/564907074.db2.gz UENQCSRRXGSAGP-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN Cn1c(C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)n[nH]c1=S ZINC000097552613 564908576 /nfs/dbraw/zinc/90/85/76/564908576.db2.gz QNHLRJMZNHGJFM-UHFFFAOYSA-N 0 0 381.845 3.059 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000097548749 564908622 /nfs/dbraw/zinc/90/86/22/564908622.db2.gz SYKJKHAKTCFZTG-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN CCc1nc(CCNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cs1 ZINC000097548877 564908719 /nfs/dbraw/zinc/90/87/19/564908719.db2.gz QWKUVLUMRSNWRS-UHFFFAOYSA-N 0 0 381.479 3.317 20 5 GGBDRN O=C(NCCCc1ccc(Cl)cc1Cl)NCCn1cc([N+](=O)[O-])cn1 ZINC000151207185 564910206 /nfs/dbraw/zinc/91/02/06/564910206.db2.gz JSGHXVOZMHLGSY-UHFFFAOYSA-N 0 0 386.239 3.030 20 5 GGBDRN O=C(CNc1ccc([N+](=O)[O-])cc1Br)N1CCc2ccccc21 ZINC000098071967 564912763 /nfs/dbraw/zinc/91/27/63/564912763.db2.gz DBFHCFGDJUFUCB-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCc1ccccc1F ZINC000151322688 564914909 /nfs/dbraw/zinc/91/49/09/564914909.db2.gz JCVVOJKTYIGZAJ-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(O)c(Br)c1 ZINC000151396150 564918027 /nfs/dbraw/zinc/91/80/27/564918027.db2.gz JUTPLHJABYNOOJ-UHFFFAOYSA-N 0 0 396.197 3.393 20 5 GGBDRN COC[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C)C ZINC000151457638 564920715 /nfs/dbraw/zinc/92/07/15/564920715.db2.gz LZOMSEHVXQPDPT-NSHDSACASA-N 0 0 380.388 3.493 20 5 GGBDRN CC(C)(NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)c(Cl)c1 ZINC000151464064 564921613 /nfs/dbraw/zinc/92/16/13/564921613.db2.gz HBFRJMFZGDPDEQ-UHFFFAOYSA-N 0 0 386.239 3.333 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)Cc1cc(Br)cn1C ZINC000151494657 564922157 /nfs/dbraw/zinc/92/21/57/564922157.db2.gz PHNKLWZVNZDMBU-UHFFFAOYSA-N 0 0 395.257 3.075 20 5 GGBDRN CC[C@@](C)(NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nccs1 ZINC000151479283 564922358 /nfs/dbraw/zinc/92/23/58/564922358.db2.gz HZNRELMTKCXTIX-CYBMUJFWSA-N 0 0 375.859 3.308 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H](O)Cc1ccccc1 ZINC000151512839 564923424 /nfs/dbraw/zinc/92/34/24/564923424.db2.gz JIFCPVFHSPKGQR-MEDUHNTESA-N 0 0 393.237 3.079 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)Cc1cc(Br)cn1C ZINC000151541852 564925474 /nfs/dbraw/zinc/92/54/74/564925474.db2.gz HJGXLHSJINJTKH-NSHDSACASA-N 0 0 395.257 3.155 20 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C[C@H](CCc1cccn1C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000154029091 565022834 /nfs/dbraw/zinc/02/28/34/565022834.db2.gz BRDXCZKRKARNEU-LLVKDONJSA-N 0 0 380.242 3.447 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCc2cc(Br)ccc21 ZINC000109237014 565022983 /nfs/dbraw/zinc/02/29/83/565022983.db2.gz YEZLLIMEPVQKDC-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN C[C@@H](CCc1cccn1C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000154028994 565023020 /nfs/dbraw/zinc/02/30/20/565023020.db2.gz BRDXCZKRKARNEU-NSHDSACASA-N 0 0 380.242 3.447 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000109551668 565026877 /nfs/dbraw/zinc/02/68/77/565026877.db2.gz JEGWWVJZUGIZHF-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000109552008 565027119 /nfs/dbraw/zinc/02/71/19/565027119.db2.gz LOFLGNPKFXVNPH-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CCOc1ncccc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000154243363 565031129 /nfs/dbraw/zinc/03/11/29/565031129.db2.gz IORMVUFEVOEFES-UHFFFAOYSA-N 0 0 394.225 3.010 20 5 GGBDRN COC(=O)c1sccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000154276855 565032844 /nfs/dbraw/zinc/03/28/44/565032844.db2.gz KAGVCFRJOLICRR-UHFFFAOYSA-N 0 0 399.222 3.387 20 5 GGBDRN O=[N+]([O-])c1cccc(CCNS(=O)(=O)Cc2ccc(Br)cc2)c1 ZINC000154297423 565033440 /nfs/dbraw/zinc/03/34/40/565033440.db2.gz RNLXPJPUAHFUOS-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN Cc1nn(Cc2noc(Cc3ccc(Br)cc3)n2)c(C)c1[N+](=O)[O-] ZINC000110130888 565035758 /nfs/dbraw/zinc/03/57/58/565035758.db2.gz WOADJFJANRYVRE-UHFFFAOYSA-N 0 0 392.213 3.193 20 5 GGBDRN C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000154397855 565036584 /nfs/dbraw/zinc/03/65/84/565036584.db2.gz VYYGYZIQERPFPD-JMCQJSRRSA-N 0 0 397.254 3.293 20 5 GGBDRN O=[N+]([O-])c1ncccc1OCc1noc(Cc2ccc(Br)cc2)n1 ZINC000110136340 565037019 /nfs/dbraw/zinc/03/70/19/565037019.db2.gz KEMRIRWOWMEWIE-UHFFFAOYSA-N 0 0 391.181 3.305 20 5 GGBDRN C[C@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000154397982 565037505 /nfs/dbraw/zinc/03/75/05/565037505.db2.gz VYYGYZIQERPFPD-JVXZTZIISA-N 0 0 397.254 3.293 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110209621 565037743 /nfs/dbraw/zinc/03/77/43/565037743.db2.gz HYHFBMJICFTVCD-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN C[C@@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000154398089 565037777 /nfs/dbraw/zinc/03/77/77/565037777.db2.gz VYYGYZIQERPFPD-KRTXAFLBSA-N 0 0 397.254 3.293 20 5 GGBDRN CNC(=O)c1ccc(Oc2ccc(Br)c(C=O)c2)c([N+](=O)[O-])c1 ZINC000154445406 565039158 /nfs/dbraw/zinc/03/91/58/565039158.db2.gz ZBFPUGFIXAXHCY-UHFFFAOYSA-N 0 0 379.166 3.322 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCc2csc(-c3ccccc3)n2)c1 ZINC000110472871 565040842 /nfs/dbraw/zinc/04/08/42/565040842.db2.gz BOLFMBLMOZYGMH-UHFFFAOYSA-N 0 0 375.431 3.197 20 5 GGBDRN O=C(CNc1ccc(Br)cc1[N+](=O)[O-])NCCc1ccccc1 ZINC000110455295 565040912 /nfs/dbraw/zinc/04/09/12/565040912.db2.gz SQMPPDUALGYUCS-UHFFFAOYSA-N 0 0 378.226 3.128 20 5 GGBDRN CCC[C@@H](O)CNC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000154528607 565042882 /nfs/dbraw/zinc/04/28/82/565042882.db2.gz HOGQXOMIDYTOJV-GFCCVEGCSA-N 0 0 381.479 3.402 20 5 GGBDRN CC(C)(COc1ncccc1Br)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000154548348 565043294 /nfs/dbraw/zinc/04/32/94/565043294.db2.gz REKSIUYZFBSYDU-UHFFFAOYSA-N 0 0 394.225 3.340 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3Br)C2)n1 ZINC000154573462 565045174 /nfs/dbraw/zinc/04/51/74/565045174.db2.gz SLLLZDUAWVVTLI-SNVBAGLBSA-N 0 0 395.213 3.069 20 5 GGBDRN COc1cc(C(=O)NCCOc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000154604145 565046467 /nfs/dbraw/zinc/04/64/67/565046467.db2.gz WLUHMYSFPCLBIL-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN C[C@H](O)C[C@H]1CCCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000154698702 565049667 /nfs/dbraw/zinc/04/96/67/565049667.db2.gz LWCBWLWVLWQMKI-WCBMZHEXSA-N 0 0 391.649 3.386 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nc(-c2ccc(F)c(C)c2)no1 ZINC000154735050 565050894 /nfs/dbraw/zinc/05/08/94/565050894.db2.gz HCONLTSYUBWYLC-UHFFFAOYSA-N 0 0 396.176 3.408 20 5 GGBDRN CCc1nc([C@H](C)NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000111363886 565053438 /nfs/dbraw/zinc/05/34/38/565053438.db2.gz QJNFSKQIYZRWSV-QMMMGPOBSA-N 0 0 375.859 3.307 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000111366179 565054360 /nfs/dbraw/zinc/05/43/60/565054360.db2.gz GSYBZMIXSAURRA-AWEZNQCLSA-N 0 0 381.479 3.366 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000154919121 565056800 /nfs/dbraw/zinc/05/68/00/565056800.db2.gz POTDLNXHQAUZON-JTQLQIEISA-N 0 0 395.257 3.394 20 5 GGBDRN Cc1ccc(NC(=O)c2cncc(I)c2)cc1[N+](=O)[O-] ZINC000154949431 565057692 /nfs/dbraw/zinc/05/76/92/565057692.db2.gz PLURUXWRTQHYAW-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN C[C@@H](CC(=O)c1ccco1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000154992230 565059194 /nfs/dbraw/zinc/05/91/94/565059194.db2.gz SULAGBQOQOYWAJ-VIFPVBQESA-N 0 0 381.182 3.342 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCCN(Cc2cscn2)CC1 ZINC000112115135 565059494 /nfs/dbraw/zinc/05/94/94/565059494.db2.gz INAHLFIAFAYRMT-UHFFFAOYSA-N 0 0 380.857 3.053 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COCc2cccs2)c(Br)c1 ZINC000155047840 565060280 /nfs/dbraw/zinc/06/02/80/565060280.db2.gz OPKJJBDIGHMZKN-NSHDSACASA-N 0 0 388.239 3.375 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COCc2ccccc2)c(Br)c1 ZINC000155049883 565060333 /nfs/dbraw/zinc/06/03/33/565060333.db2.gz FSJVVUPNCYBPHO-AWEZNQCLSA-N 0 0 382.210 3.314 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N1CC[C@@H]2OCCC[C@H]2C1 ZINC000155155610 565062937 /nfs/dbraw/zinc/06/29/37/565062937.db2.gz OVTLKPAENFLDCU-HZMBPMFUSA-N 0 0 384.230 3.390 20 5 GGBDRN Cc1nccn1CCCCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000155220139 565064768 /nfs/dbraw/zinc/06/47/68/565064768.db2.gz WFPJTBYXHFWUCS-UHFFFAOYSA-N 0 0 396.245 3.464 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CS(=O)(=O)[C@H]2CCc3c2cccc3Cl)c1 ZINC000155290486 565065781 /nfs/dbraw/zinc/06/57/81/565065781.db2.gz RKHVMOUVLDCIJZ-IRXDYDNUSA-N 0 0 381.837 3.384 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1CCCOc2ccccc21 ZINC000155408895 565067224 /nfs/dbraw/zinc/06/72/24/565067224.db2.gz ABTDKXWXEOFOOH-CYBMUJFWSA-N 0 0 382.825 3.440 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(Br)cnc1N(C)C ZINC000113015925 565067544 /nfs/dbraw/zinc/06/75/44/565067544.db2.gz DAOWWLJCERGORM-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN O=C(CN1Cc2ccccc2C1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000155508116 565068380 /nfs/dbraw/zinc/06/83/80/565068380.db2.gz UYUVPGSVEMYNHP-UHFFFAOYSA-N 0 0 376.210 3.312 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@H](C)Oc3ncccc32)cc1[N+](=O)[O-] ZINC000155593038 565069465 /nfs/dbraw/zinc/06/94/65/565069465.db2.gz NTKZQJIPFSNLON-VIFPVBQESA-N 0 0 392.209 3.488 20 5 GGBDRN CCN(C(=O)c1cc(I)cc([N+](=O)[O-])c1)c1ccncc1 ZINC000155591258 565069502 /nfs/dbraw/zinc/06/95/02/565069502.db2.gz BLIHDKBOALAQOR-UHFFFAOYSA-N 0 0 397.172 3.261 20 5 GGBDRN Cc1cccc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2)c1Br ZINC000155588020 565069574 /nfs/dbraw/zinc/06/95/74/565069574.db2.gz NMISKPPZRZOBRY-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1csc(I)c1 ZINC000113422903 565069862 /nfs/dbraw/zinc/06/98/62/565069862.db2.gz DNBHXEHTLDIBPI-UHFFFAOYSA-N 0 0 388.186 3.191 20 5 GGBDRN Cc1noc(C)c1[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000155689707 565070869 /nfs/dbraw/zinc/07/08/69/565070869.db2.gz YPFLJPPITNSTLQ-MRVPVSSYSA-N 0 0 382.214 3.496 20 5 GGBDRN COCCN(C(C)=O)c1nc(COc2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000113772513 565071233 /nfs/dbraw/zinc/07/12/33/565071233.db2.gz WUAULQWGZYNWNF-UHFFFAOYSA-N 0 0 385.829 3.283 20 5 GGBDRN CC[C@H]1CN(C(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CCS1 ZINC000266416649 565079183 /nfs/dbraw/zinc/07/91/83/565079183.db2.gz OTTJNTXSDYASNX-VIFPVBQESA-N 0 0 376.381 3.172 20 5 GGBDRN COc1ccc(OC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c(Br)c1 ZINC000183587639 565080639 /nfs/dbraw/zinc/08/06/39/565080639.db2.gz JCHBLRPBHVLSNM-UHFFFAOYSA-N 0 0 398.213 3.175 20 5 GGBDRN Cc1ccc(Br)cc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000156348296 565081657 /nfs/dbraw/zinc/08/16/57/565081657.db2.gz QPKJTGMIZKSNLZ-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000183619047 565081969 /nfs/dbraw/zinc/08/19/69/565081969.db2.gz XVVDSEBHUPOKFN-SJCJKPOMSA-N 0 0 384.885 3.494 20 5 GGBDRN COc1cc(OCC(=O)Nc2ncc(Br)cc2C)ccc1[N+](=O)[O-] ZINC000156361034 565082989 /nfs/dbraw/zinc/08/29/89/565082989.db2.gz ROQAHXLXEINOSI-UHFFFAOYSA-N 0 0 396.197 3.087 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Br)c(Cl)c1Cl ZINC000183633535 565083320 /nfs/dbraw/zinc/08/33/20/565083320.db2.gz CSALVBCGVKNRBI-UHFFFAOYSA-N 0 0 394.012 3.499 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1nc(C2CC2)ncc1Br ZINC000291889738 565083479 /nfs/dbraw/zinc/08/34/79/565083479.db2.gz YIELZXUVRMPQQA-UHFFFAOYSA-N 0 0 391.225 3.297 20 5 GGBDRN COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291887005 565083652 /nfs/dbraw/zinc/08/36/52/565083652.db2.gz WKHYXMPDTQEERO-MRVPVSSYSA-N 0 0 389.113 3.125 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000183649648 565084733 /nfs/dbraw/zinc/08/47/33/565084733.db2.gz IFFGRLLHFUICIH-UHFFFAOYSA-N 0 0 385.207 3.323 20 5 GGBDRN Cc1ccoc1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000292003916 565090895 /nfs/dbraw/zinc/09/08/95/565090895.db2.gz LSYRNSJMAUBHBP-UHFFFAOYSA-N 0 0 378.328 3.336 20 5 GGBDRN CC[C@](C)(NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000183735220 565092501 /nfs/dbraw/zinc/09/25/01/565092501.db2.gz SEMQMXVHZKGWKH-INIZCTEOSA-N 0 0 383.495 3.147 20 5 GGBDRN Cc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)CO2 ZINC000156556354 565093469 /nfs/dbraw/zinc/09/34/69/565093469.db2.gz KWGALUBTOMFTMA-HNNXBMFYSA-N 0 0 391.221 3.458 20 5 GGBDRN COc1cc(C(=O)Nc2ncc(Br)cc2C)c([N+](=O)[O-])cc1OC ZINC000156603174 565096675 /nfs/dbraw/zinc/09/66/75/565096675.db2.gz CBWSCVCQLMTDCN-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN CCNc1ccc(C(=O)N(C)Cc2cc(Br)cn2C)cc1[N+](=O)[O-] ZINC000156663140 565099570 /nfs/dbraw/zinc/09/95/70/565099570.db2.gz VMDOQYINOMNISQ-UHFFFAOYSA-N 0 0 395.257 3.400 20 5 GGBDRN NS(=O)(=O)c1cc(N[C@@H]2C[C@H]2c2c(F)cccc2Cl)cc([N+](=O)[O-])c1 ZINC000156674028 565100742 /nfs/dbraw/zinc/10/07/42/565100742.db2.gz TWWJBLXDTGSKGI-BXUZGUMPSA-N 0 0 385.804 3.003 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000156679251 565100881 /nfs/dbraw/zinc/10/08/81/565100881.db2.gz UAYXGQPMKPVSHU-RNCFNFMXSA-N 0 0 385.804 3.003 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000156679531 565100964 /nfs/dbraw/zinc/10/09/64/565100964.db2.gz UAYXGQPMKPVSHU-NOZJJQNGSA-N 0 0 385.804 3.003 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(CNCC(F)(F)CO)o2)c(Br)c1 ZINC000183889744 565101160 /nfs/dbraw/zinc/10/11/60/565101160.db2.gz YFCGJZYTWYBBDL-UHFFFAOYSA-N 0 0 391.168 3.335 20 5 GGBDRN CCOC(=O)c1csc(N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)n1 ZINC000267132610 565106619 /nfs/dbraw/zinc/10/66/19/565106619.db2.gz DYPULHMTQOQSRI-UHFFFAOYSA-N 0 0 381.435 3.227 20 5 GGBDRN COCc1ncc(COC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])s1 ZINC000292254234 565107768 /nfs/dbraw/zinc/10/77/68/565107768.db2.gz PKHXQDYPLGEAJO-UHFFFAOYSA-N 0 0 384.435 3.285 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCC(O)(c3scnc3Br)CC2)cc1 ZINC000369704250 565108043 /nfs/dbraw/zinc/10/80/43/565108043.db2.gz PNEQBVXXIDIFQS-UHFFFAOYSA-N 0 0 398.282 3.297 20 5 GGBDRN NC(=O)c1ccnc(N2CC[C@@H](Sc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000292298227 565108767 /nfs/dbraw/zinc/10/87/67/565108767.db2.gz NNSLLBUTOVYLOJ-GFCCVEGCSA-N 0 0 378.841 3.113 20 5 GGBDRN NC(=O)c1ccnc(N2CC[C@H](Sc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000292298233 565108821 /nfs/dbraw/zinc/10/88/21/565108821.db2.gz NNSLLBUTOVYLOJ-LBPRGKRZSA-N 0 0 378.841 3.113 20 5 GGBDRN CNC(=O)CC[C@@H]1CCCCN1C(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000292302006 565109374 /nfs/dbraw/zinc/10/93/74/565109374.db2.gz MYMQGPCRKLBREG-NSHDSACASA-N 0 0 388.251 3.423 20 5 GGBDRN Cc1csc([C@H]2CN(c3ncc([N+](=O)[O-])cc3Br)CCO2)n1 ZINC000267220692 565110199 /nfs/dbraw/zinc/11/01/99/565110199.db2.gz JBCPLRHZQFTVRN-LLVKDONJSA-N 0 0 385.243 3.095 20 5 GGBDRN CC(C)c1nc2c(n1C)CCN(c1ncc([N+](=O)[O-])cc1Br)C2 ZINC000267213391 565110677 /nfs/dbraw/zinc/11/06/77/565110677.db2.gz HRPVONMRBPQLHY-UHFFFAOYSA-N 0 0 380.246 3.172 20 5 GGBDRN NC(=O)c1ccnc(NC2(Cc3ccccc3Br)CC2)c1[N+](=O)[O-] ZINC000292356774 565111111 /nfs/dbraw/zinc/11/11/11/565111111.db2.gz RAQVTMYKOODQTC-UHFFFAOYSA-N 0 0 391.225 3.038 20 5 GGBDRN O=C(c1ccoc1)N1CCC(Nc2ncc([N+](=O)[O-])cc2Br)CC1 ZINC000267240776 565111591 /nfs/dbraw/zinc/11/15/91/565111591.db2.gz MPAWWQZZSWWZGQ-UHFFFAOYSA-N 0 0 395.213 3.062 20 5 GGBDRN CCCN(CCc1cccs1)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000184053283 565112021 /nfs/dbraw/zinc/11/20/21/565112021.db2.gz CVLIQAJFFBWXPE-UHFFFAOYSA-N 0 0 382.507 3.483 20 5 GGBDRN CCCN(CCc1cccs1)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000184052760 565112498 /nfs/dbraw/zinc/11/24/98/565112498.db2.gz VMBURMMALKMPLM-UHFFFAOYSA-N 0 0 384.479 3.308 20 5 GGBDRN Cc1cc(CNc2ncc([N+](=O)[O-])cc2Br)nc(N2CCCC2)n1 ZINC000292407463 565113483 /nfs/dbraw/zinc/11/34/83/565113483.db2.gz VJVOIINBGKQBPO-UHFFFAOYSA-N 0 0 393.245 3.063 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCC(OCC2CC2)CC1 ZINC000369830149 565114314 /nfs/dbraw/zinc/11/43/14/565114314.db2.gz OBMWFSSDMDAFHO-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(NC[C@H]1CCCSC1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000292451485 565116124 /nfs/dbraw/zinc/11/61/24/565116124.db2.gz XYRFPRIEOIHQFV-MRVPVSSYSA-N 0 0 377.235 3.369 20 5 GGBDRN CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000292445246 565116359 /nfs/dbraw/zinc/11/63/59/565116359.db2.gz VRXIYRITWPPQNA-BXUZGUMPSA-N 0 0 388.251 3.325 20 5 GGBDRN Cc1cc(Br)c(NC(=O)C(=O)NC2CCCCC2)cc1[N+](=O)[O-] ZINC000184133555 565116543 /nfs/dbraw/zinc/11/65/43/565116543.db2.gz XGIFHZJWPIZUEK-UHFFFAOYSA-N 0 0 384.230 3.053 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCCC[C@H]1c1ncon1 ZINC000267430767 565116612 /nfs/dbraw/zinc/11/66/12/565116612.db2.gz CWGQHABTSVIKJC-NSHDSACASA-N 0 0 381.186 3.108 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000184196876 565118753 /nfs/dbraw/zinc/11/87/53/565118753.db2.gz PYJMYOXIZUZQPB-CQSZACIVSA-N 0 0 382.438 3.390 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC(OC[C@H]3CCOC3)CC2)ccc1Br ZINC000369958444 565119386 /nfs/dbraw/zinc/11/93/86/565119386.db2.gz GGZJQBRAMUYSSY-AWEZNQCLSA-N 0 0 399.285 3.375 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC(OC[C@@H]3CCOC3)CC2)ccc1Br ZINC000369958445 565119676 /nfs/dbraw/zinc/11/96/76/565119676.db2.gz GGZJQBRAMUYSSY-CQSZACIVSA-N 0 0 399.285 3.375 20 5 GGBDRN COc1cc(CN(C)Cc2cc(Br)cn2C)c([N+](=O)[O-])cc1F ZINC000184235794 565121299 /nfs/dbraw/zinc/12/12/99/565121299.db2.gz WMWVEGHIOMFUNZ-UHFFFAOYSA-N 0 0 386.221 3.476 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000184237721 565121522 /nfs/dbraw/zinc/12/15/22/565121522.db2.gz ZYIAMGFRVHNWRD-MRXNPFEDSA-N 0 0 382.825 3.010 20 5 GGBDRN CS(=O)(=O)N1CCc2c1cccc2NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184231836 565121530 /nfs/dbraw/zinc/12/15/30/565121530.db2.gz YLQZLWHJROXBTI-UHFFFAOYSA-N 0 0 381.841 3.182 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000184236815 565121665 /nfs/dbraw/zinc/12/16/65/565121665.db2.gz KUTALCRFULTFDB-OAHLLOKOSA-N 0 0 382.825 3.010 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)Cc2c(F)cccc2F)c(Cl)c1 ZINC000184251861 565122856 /nfs/dbraw/zinc/12/28/56/565122856.db2.gz SDSJINSGCWEHRQ-UHFFFAOYSA-N 0 0 376.768 3.146 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)c1nccs1 ZINC000184286762 565125336 /nfs/dbraw/zinc/12/53/36/565125336.db2.gz ZFKIDZNPQZNQDR-NSHDSACASA-N 0 0 381.479 3.323 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)c1nccs1 ZINC000184286778 565125580 /nfs/dbraw/zinc/12/55/80/565125580.db2.gz ZFKIDZNPQZNQDR-LLVKDONJSA-N 0 0 381.479 3.323 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc2ccc(Cl)cn2n1 ZINC000157273735 565126848 /nfs/dbraw/zinc/12/68/48/565126848.db2.gz QYTRZTJMUYRBGN-VIFPVBQESA-N 0 0 377.813 3.410 20 5 GGBDRN O=C(c1ccc(Br)cc1F)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000370095430 565127430 /nfs/dbraw/zinc/12/74/30/565127430.db2.gz UZLWZCRJLFBAHS-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCC1(c2ccccn2)CC1 ZINC000184346090 565129464 /nfs/dbraw/zinc/12/94/64/565129464.db2.gz NBMOMXGHXBJWKR-UHFFFAOYSA-N 0 0 390.237 3.143 20 5 GGBDRN COc1cc(C(=O)N2CCSC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000267769516 565129956 /nfs/dbraw/zinc/12/99/56/565129956.db2.gz YVUXAXQVPSPWKI-UHFFFAOYSA-N 0 0 376.381 3.172 20 5 GGBDRN C[C@@H](CS(C)(=O)=O)N(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000292709397 565130086 /nfs/dbraw/zinc/13/00/86/565130086.db2.gz BCBKCODMJIMUCP-JTQLQIEISA-N 0 0 380.388 3.011 20 5 GGBDRN COC(=O)[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@H]1C ZINC000292766782 565133238 /nfs/dbraw/zinc/13/32/38/565133238.db2.gz GHDCAKFGDPUWTR-SCZZXKLOSA-N 0 0 375.208 3.173 20 5 GGBDRN CCOC[C@H]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000267932909 565134799 /nfs/dbraw/zinc/13/47/99/565134799.db2.gz OWKNOFGZQSBWQY-JTQLQIEISA-N 0 0 389.221 3.385 20 5 GGBDRN O=C(NCCSC(F)(F)F)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267908176 565134892 /nfs/dbraw/zinc/13/48/92/565134892.db2.gz CDOKBWHPSHCPQC-UHFFFAOYSA-N 0 0 391.140 3.479 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1cccnc1 ZINC000292780980 565135016 /nfs/dbraw/zinc/13/50/16/565135016.db2.gz WHWRGCCUOLWEMX-OAHLLOKOSA-N 0 0 381.841 3.415 20 5 GGBDRN CC(C)OCCCN(C)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267918168 565135276 /nfs/dbraw/zinc/13/52/76/565135276.db2.gz IHUZXZKAKDGMLQ-UHFFFAOYSA-N 0 0 377.210 3.384 20 5 GGBDRN Cc1cc(C)n(CCCNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)n1 ZINC000267913694 565135279 /nfs/dbraw/zinc/13/52/79/565135279.db2.gz GSNCVMVUNQMUTC-UHFFFAOYSA-N 0 0 399.220 3.130 20 5 GGBDRN CNC(=O)c1cc(Br)ccc1NCCc1ccc([N+](=O)[O-])cc1 ZINC000184439255 565135801 /nfs/dbraw/zinc/13/58/01/565135801.db2.gz PTCWXEOAMNUMPL-UHFFFAOYSA-N 0 0 378.226 3.372 20 5 GGBDRN C[C@H](c1ccc(OC(F)(F)F)cc1)[S@](=O)CCn1cc([N+](=O)[O-])cn1 ZINC000157570688 565137613 /nfs/dbraw/zinc/13/76/13/565137613.db2.gz JMZVAGZGDBHWJB-JUTIIYIPSA-N 0 0 377.344 3.200 20 5 GGBDRN O=C(NC[C@@H]1CSCCS1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268032673 565137935 /nfs/dbraw/zinc/13/79/35/565137935.db2.gz LHSFOZJPWDVKFV-MRVPVSSYSA-N 0 0 395.275 3.075 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@@H]1c1ccncc1 ZINC000292882229 565139320 /nfs/dbraw/zinc/13/93/20/565139320.db2.gz CUQFRLODDQDBQJ-OAHLLOKOSA-N 0 0 381.841 3.415 20 5 GGBDRN O=C(Nc1cccnc1-n1cccn1)c1sc(Br)cc1[N+](=O)[O-] ZINC000370493187 565145462 /nfs/dbraw/zinc/14/54/62/565145462.db2.gz VLZBKICTJLXABT-UHFFFAOYSA-N 0 0 394.210 3.252 20 5 GGBDRN C[C@@H]1CN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C[C@@H](c2ccsc2)O1 ZINC000268332857 565147871 /nfs/dbraw/zinc/14/78/71/565147871.db2.gz QDKAGUMISGMZON-BZNIZROVSA-N 0 0 382.463 3.026 20 5 GGBDRN C[C@H]1CN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C[C@H](c2ccsc2)O1 ZINC000268332858 565148679 /nfs/dbraw/zinc/14/86/79/565148679.db2.gz QDKAGUMISGMZON-MEDUHNTESA-N 0 0 382.463 3.026 20 5 GGBDRN Cc1cnc(OCc2nnc(-c3ccc(Br)o3)o2)c([N+](=O)[O-])c1 ZINC000157953190 565149976 /nfs/dbraw/zinc/14/99/76/565149976.db2.gz CILSVRDYYHQDIB-UHFFFAOYSA-N 0 0 381.142 3.283 20 5 GGBDRN COC(=O)C1(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)CCCCC1 ZINC000184659684 565151344 /nfs/dbraw/zinc/15/13/44/565151344.db2.gz POGNNHSQCFYYTC-UHFFFAOYSA-N 0 0 399.241 3.211 20 5 GGBDRN C[C@@H](OC[C@@H](O)Cn1cc([N+](=O)[O-])cc(Cl)c1=O)c1ccc(Cl)cc1 ZINC000268475483 565153281 /nfs/dbraw/zinc/15/32/81/565153281.db2.gz HLDYIYZKIYDSRG-YGRLFVJLSA-N 0 0 387.219 3.202 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184716881 565154000 /nfs/dbraw/zinc/15/40/00/565154000.db2.gz LORFWRWEGHNYJY-CAVMCXFUSA-N 0 0 387.889 3.127 20 5 GGBDRN C[C@H](c1cccnc1)N1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000268502688 565156400 /nfs/dbraw/zinc/15/64/00/565156400.db2.gz SSYAFDAIXPYKKW-GFCCVEGCSA-N 0 0 392.257 3.031 20 5 GGBDRN CC(C)CN(Cc1ccccc1Br)C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000158131674 565156905 /nfs/dbraw/zinc/15/69/05/565156905.db2.gz JSPYSLWNHBQKHY-UHFFFAOYSA-N 0 0 381.230 3.379 20 5 GGBDRN O=C(NC[C@H](O)C1CCCCC1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268530082 565157779 /nfs/dbraw/zinc/15/77/79/565157779.db2.gz IOUPUHXCEAKWOW-ZDUSSCGKSA-N 0 0 389.221 3.167 20 5 GGBDRN O=C(NC[C@@H](O)C1CCCCC1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268530079 565158011 /nfs/dbraw/zinc/15/80/11/565158011.db2.gz IOUPUHXCEAKWOW-CYBMUJFWSA-N 0 0 389.221 3.167 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(F)cc1Cl ZINC000184830085 565158609 /nfs/dbraw/zinc/15/86/09/565158609.db2.gz OCEYOTLCSPAFOB-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC(n2cccn2)CC1 ZINC000370753847 565159517 /nfs/dbraw/zinc/15/95/17/565159517.db2.gz MLXPPFQVGLDVER-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN Cc1nc([C@@H]2CCCCN2C(=O)c2cc(Br)cc([N+](=O)[O-])c2)no1 ZINC000370742417 565159807 /nfs/dbraw/zinc/15/98/07/565159807.db2.gz VUVVFRRPSWFEMZ-ZDUSSCGKSA-N 0 0 395.213 3.416 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Br)c2cccnc2O1 ZINC000158227833 565161734 /nfs/dbraw/zinc/16/17/34/565161734.db2.gz ICQWDNYFBRMJIG-SECBINFHSA-N 0 0 378.182 3.180 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1nc(C(F)(F)F)cs1 ZINC000158276934 565163677 /nfs/dbraw/zinc/16/36/77/565163677.db2.gz BRKGKOQDPSYBTR-UHFFFAOYSA-N 0 0 384.133 3.043 20 5 GGBDRN CC(C)c1ccccc1NC(=O)Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000158301176 565164736 /nfs/dbraw/zinc/16/47/36/565164736.db2.gz KUTNQJYBCJXOON-UHFFFAOYSA-N 0 0 394.225 3.281 20 5 GGBDRN CCS[C@@H](C)c1noc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])n1 ZINC000268750531 565166763 /nfs/dbraw/zinc/16/67/63/565166763.db2.gz VFSXUCHJCMFPLR-VIFPVBQESA-N 0 0 382.467 3.324 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCOC[C@H]1c1ccco1 ZINC000370904687 565167107 /nfs/dbraw/zinc/16/71/07/565167107.db2.gz KWZQBSGQYNWGOZ-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN O=C1CCCCN1C1CCN(c2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000268778956 565167478 /nfs/dbraw/zinc/16/74/78/565167478.db2.gz BPNPUBLIYPXLKS-UHFFFAOYSA-N 0 0 382.258 3.339 20 5 GGBDRN Cc1nn(C)c(C(=O)NCC(C)(C)c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000158417093 565168770 /nfs/dbraw/zinc/16/87/70/565168770.db2.gz BSCBURIKEDHBGE-UHFFFAOYSA-N 0 0 395.257 3.107 20 5 GGBDRN O=C(N[C@@H]1CCc2c[nH]nc2C1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000371024710 565172391 /nfs/dbraw/zinc/17/23/91/565172391.db2.gz ICPFVWOWTWMBCM-SECBINFHSA-N 0 0 399.632 3.021 20 5 GGBDRN COC(=O)c1sc2ccccc2c1Cn1cc(Cl)cc([N+](=O)[O-])c1=O ZINC000158528291 565172407 /nfs/dbraw/zinc/17/24/07/565172407.db2.gz IXSSMEWGHXEPOG-UHFFFAOYSA-N 0 0 378.793 3.460 20 5 GGBDRN NC(=O)[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1cccc(Br)c1 ZINC000185035913 565172859 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CC(C)N(CC(F)F)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000158571711 565174310 /nfs/dbraw/zinc/17/43/10/565174310.db2.gz JGQKVTFDFBFHDB-UHFFFAOYSA-N 0 0 398.147 3.315 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000269018596 565175365 /nfs/dbraw/zinc/17/53/65/565175365.db2.gz DICWKMLBAAWMBU-WBMJQRKESA-N 0 0 385.873 3.102 20 5 GGBDRN Cn1ccnc1[C@@H]1CCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000371055306 565175386 /nfs/dbraw/zinc/17/53/86/565175386.db2.gz QRJPJRRXBZSMJT-SNVBAGLBSA-N 0 0 394.229 3.112 20 5 GGBDRN CCC[C@H](C)C(=O)NCCNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000293728536 565181195 /nfs/dbraw/zinc/18/11/95/565181195.db2.gz CNOUUYKKXWHCDG-VIFPVBQESA-N 0 0 376.240 3.184 20 5 GGBDRN CCC[C@@H](C)C(=O)NCCNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000293728529 565181477 /nfs/dbraw/zinc/18/14/77/565181477.db2.gz CNOUUYKKXWHCDG-SECBINFHSA-N 0 0 376.240 3.184 20 5 GGBDRN C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)c2cccnc2O1 ZINC000158827031 565183183 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O=[N+]([O-])c1ccc(SC[C@@H](O)COc2ccc(Br)cc2)nc1 ZINC000159193187 565198275 /nfs/dbraw/zinc/19/82/75/565198275.db2.gz LMPNIGPWRAGXIH-LBPRGKRZSA-N 0 0 385.239 3.284 20 5 GGBDRN CC(C)CSCCCOc1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000269743632 565199119 /nfs/dbraw/zinc/19/91/19/565199119.db2.gz LYVDVBQPKYXHTI-UHFFFAOYSA-N 0 0 392.455 3.065 20 5 GGBDRN O=C(C[C@@H]1CSCCS1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000269790812 565200148 /nfs/dbraw/zinc/20/01/48/565200148.db2.gz ZDUTWLHLISPGJQ-MRXNPFEDSA-N 0 0 382.507 3.203 20 5 GGBDRN O=C(Nc1cccn(CC(F)(F)F)c1=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000159290980 565200467 /nfs/dbraw/zinc/20/04/67/565200467.db2.gz AOFUCKLWOIGUJR-UHFFFAOYSA-N 0 0 375.690 3.225 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCSC[C@@H]1c1nccs1 ZINC000185411526 565200706 /nfs/dbraw/zinc/20/07/06/565200706.db2.gz ATEFBTSNNVVTNX-CYBMUJFWSA-N 0 0 399.519 3.093 20 5 GGBDRN CO[C@@H](C)c1nc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)cs1 ZINC000269826858 565201274 /nfs/dbraw/zinc/20/12/74/565201274.db2.gz KQJWHPXEKDSWPB-VIFPVBQESA-N 0 0 388.492 3.455 20 5 GGBDRN C[C@H](Cc1cccs1)NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185444127 565201626 /nfs/dbraw/zinc/20/16/26/565201626.db2.gz MKYHLMNOHLRSTL-LLVKDONJSA-N 0 0 377.447 3.114 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(Cl)s2)c2ncccc12 ZINC000185438042 565201727 /nfs/dbraw/zinc/20/17/27/565201727.db2.gz FENMLKXUGXFQGQ-UHFFFAOYSA-N 0 0 383.838 3.336 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)N(C)C(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000185455425 565202990 /nfs/dbraw/zinc/20/29/90/565202990.db2.gz SJIGOHGWSWADGG-CYBMUJFWSA-N 0 0 395.257 3.034 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2c3c(nn2C)CCC3)cc1[N+](=O)[O-] ZINC000269927888 565203198 /nfs/dbraw/zinc/20/31/98/565203198.db2.gz IAGADZCJFILAFM-UHFFFAOYSA-N 0 0 379.214 3.140 20 5 GGBDRN CC(C)OC1CCC(NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000159387507 565203726 /nfs/dbraw/zinc/20/37/26/565203726.db2.gz FHKOMFUYGQXXTR-UHFFFAOYSA-N 0 0 376.862 3.263 20 5 GGBDRN COC(=O)C(C)(C)c1csc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)n1 ZINC000294233070 565204194 /nfs/dbraw/zinc/20/41/94/565204194.db2.gz ZGLDLBZMYYLDJQ-UHFFFAOYSA-N 0 0 383.813 3.408 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N1CCC2(C1)CCOCC2 ZINC000269969899 565204431 /nfs/dbraw/zinc/20/44/31/565204431.db2.gz LCIUESZAMKIARL-UHFFFAOYSA-N 0 0 384.230 3.392 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000269975596 565204601 /nfs/dbraw/zinc/20/46/01/565204601.db2.gz MPXPOKMWLHTQIQ-JTQLQIEISA-N 0 0 394.229 3.492 20 5 GGBDRN CSc1nc(C)c(CCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(=O)[nH]1 ZINC000294253915 565205008 /nfs/dbraw/zinc/20/50/08/565205008.db2.gz FWQRQNWXXJFKJZ-UHFFFAOYSA-N 0 0 382.829 3.345 20 5 GGBDRN CC(C)[C@@H](O)C(C)(C)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000269991925 565205744 /nfs/dbraw/zinc/20/57/44/565205744.db2.gz LNWPCUAUXXSXMC-CYBMUJFWSA-N 0 0 391.237 3.269 20 5 GGBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000269991928 565205996 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386.298 3.290 20 5 GGBDRN COc1cc(CCNc2nnc(C(F)(F)F)s2)c([N+](=O)[O-])cc1OC ZINC000185662623 565214768 /nfs/dbraw/zinc/21/47/68/565214768.db2.gz FSHJTVIQGPZEKL-UHFFFAOYSA-N 0 0 378.332 3.137 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCc2ccccc2[C@H]1CO ZINC000185677236 565216163 /nfs/dbraw/zinc/21/61/63/565216163.db2.gz OGOQBPVARZYQTL-MRXNPFEDSA-N 0 0 391.221 3.089 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000185688637 565216239 /nfs/dbraw/zinc/21/62/39/565216239.db2.gz FHQLPWRTUWUIFG-UHFFFAOYSA-N 0 0 387.278 3.147 20 5 GGBDRN COc1ccc(OC[C@H](O)COc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000185690037 565216458 /nfs/dbraw/zinc/21/64/58/565216458.db2.gz MTTUTGUHAGLDBY-GFCCVEGCSA-N 0 0 398.209 3.185 20 5 GGBDRN C[C@@H](CO)CCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000270412409 565218532 /nfs/dbraw/zinc/21/85/32/565218532.db2.gz DTDJWNCHBVEVER-MRVPVSSYSA-N 0 0 379.638 3.149 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000159832848 565219950 /nfs/dbraw/zinc/21/99/50/565219950.db2.gz UBPNVYFFLZYACG-MRXNPFEDSA-N 0 0 379.869 3.200 20 5 GGBDRN Cc1ccc(C(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)s1 ZINC000185750349 565219806 /nfs/dbraw/zinc/21/98/06/565219806.db2.gz MDLCBUBFQNJLQX-UHFFFAOYSA-N 0 0 375.431 3.187 20 5 GGBDRN CN(CCc1cccs1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185797630 565221598 /nfs/dbraw/zinc/22/15/98/565221598.db2.gz WSRPEZJRWSJUGK-UHFFFAOYSA-N 0 0 377.447 3.068 20 5 GGBDRN CCSCC[C@@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185807479 565222626 /nfs/dbraw/zinc/22/26/26/565222626.db2.gz JJQOGJVKCIVOFZ-GFCCVEGCSA-N 0 0 383.495 3.295 20 5 GGBDRN CCc1nc(C)c(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)o1 ZINC000294685537 565223363 /nfs/dbraw/zinc/22/33/63/565223363.db2.gz NDPFSMBCSYSJAX-UHFFFAOYSA-N 0 0 394.225 3.415 20 5 GGBDRN CCS[C@H]1CCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185822828 565223623 /nfs/dbraw/zinc/22/36/23/565223623.db2.gz DQZCDRHQPIJBDH-JSGCOSHPSA-N 0 0 381.479 3.096 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@@H](CSc3ccccc3)C2)c1 ZINC000185858157 565225072 /nfs/dbraw/zinc/22/50/72/565225072.db2.gz XSEUWDGHHDJTJM-CQSZACIVSA-N 0 0 378.475 3.398 20 5 GGBDRN CS[C@@H]1CCCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185866084 565225796 /nfs/dbraw/zinc/22/57/96/565225796.db2.gz IEXWFBHMQIBQPA-GFCCVEGCSA-N 0 0 381.479 3.049 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000185877407 565226004 /nfs/dbraw/zinc/22/60/04/565226004.db2.gz JWPKJIKPUBIBOI-SNVBAGLBSA-N 0 0 395.384 3.500 20 5 GGBDRN CS[C@H]1CCCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185866101 565226245 /nfs/dbraw/zinc/22/62/45/565226245.db2.gz IEXWFBHMQIBQPA-LBPRGKRZSA-N 0 0 381.479 3.049 20 5 GGBDRN CCC1(CO)CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1 ZINC000270724961 565226570 /nfs/dbraw/zinc/22/65/70/565226570.db2.gz CPFLODSJVSNZFT-UHFFFAOYSA-N 0 0 389.221 3.121 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCOCC12CCCC2 ZINC000270733189 565227114 /nfs/dbraw/zinc/22/71/14/565227114.db2.gz JYZNXYSHAJJXPJ-UHFFFAOYSA-N 0 0 387.205 3.282 20 5 GGBDRN CSc1nnc(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)s1 ZINC000294771396 565227181 /nfs/dbraw/zinc/22/71/81/565227181.db2.gz AYOQSDOYBMDETA-UHFFFAOYSA-N 0 0 378.357 3.117 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000294788840 565228012 /nfs/dbraw/zinc/22/80/12/565228012.db2.gz KKSFWAOUSYBTNM-GDBMZVCRSA-N 0 0 381.226 3.141 20 5 GGBDRN O=C1N[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N2CCSC[C@@H]12 ZINC000270821418 565229505 /nfs/dbraw/zinc/22/95/05/565229505.db2.gz RWMWIHOLBZPXAV-WFASDCNBSA-N 0 0 379.825 3.054 20 5 GGBDRN CCCn1c(CO)nnc1SCc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000160085062 565229736 /nfs/dbraw/zinc/22/97/36/565229736.db2.gz WOPCEEPMWVINCZ-UHFFFAOYSA-N 0 0 376.360 3.400 20 5 GGBDRN CC[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000160076543 565230123 /nfs/dbraw/zinc/23/01/23/565230123.db2.gz FVFFRLNLKJRTCN-JTQLQIEISA-N 0 0 388.205 3.462 20 5 GGBDRN CC[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000160076415 565230147 /nfs/dbraw/zinc/23/01/47/565230147.db2.gz FVFFRLNLKJRTCN-SNVBAGLBSA-N 0 0 388.205 3.462 20 5 GGBDRN C[C@](O)(CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000160157633 565233506 /nfs/dbraw/zinc/23/35/06/565233506.db2.gz CFGLWPPAPIXHLS-AWEZNQCLSA-N 0 0 390.870 3.033 20 5 GGBDRN CSCCCCCNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000185978119 565234161 /nfs/dbraw/zinc/23/41/61/565234161.db2.gz YYOAJUMAMJHCEV-UHFFFAOYSA-N 0 0 397.316 3.169 20 5 GGBDRN C[C@@H](c1cccnc1)N1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000270931855 565234270 /nfs/dbraw/zinc/23/42/70/565234270.db2.gz HYSXGIXHYWRMFP-LBPRGKRZSA-N 0 0 392.257 3.031 20 5 GGBDRN O=C(CSCC(=O)c1ccccc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186016406 565234587 /nfs/dbraw/zinc/23/45/87/565234587.db2.gz GGHPHDGNTYUGIC-UHFFFAOYSA-N 0 0 378.837 3.481 20 5 GGBDRN Cc1ccc(-c2nc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)n[nH]2)o1 ZINC000160190724 565235068 /nfs/dbraw/zinc/23/50/68/565235068.db2.gz BTTOKBRGFZQJRM-UHFFFAOYSA-N 0 0 392.169 3.296 20 5 GGBDRN Cc1cc(Cl)c(C(=O)N2CCCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000294934146 565236729 /nfs/dbraw/zinc/23/67/29/565236729.db2.gz URZCGEHBJOZZTL-UHFFFAOYSA-N 0 0 380.857 3.366 20 5 GGBDRN CCCNC(=O)C1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000271051300 565237615 /nfs/dbraw/zinc/23/76/15/565237615.db2.gz VWGBNQDKTMQWHV-UHFFFAOYSA-N 0 0 384.274 3.096 20 5 GGBDRN NC(=O)[C@H](Sc1ccc([N+](=O)[O-])cn1)c1ccc(Br)cc1F ZINC000160346408 565241310 /nfs/dbraw/zinc/24/13/10/565241310.db2.gz ASKZBFQLKNJDCC-GFCCVEGCSA-N 0 0 386.202 3.210 20 5 GGBDRN Cc1c(Nc2ncc(Br)cc2[N+](=O)[O-])cnn1C1CCOCC1 ZINC000295049438 565241896 /nfs/dbraw/zinc/24/18/96/565241896.db2.gz XWTCRRHTNKFJDD-UHFFFAOYSA-N 0 0 382.218 3.352 20 5 GGBDRN CC(=O)c1ccc(OS(=O)(=O)C[C@H]2CCCCC2(F)F)c([N+](=O)[O-])c1 ZINC000295045906 565241938 /nfs/dbraw/zinc/24/19/38/565241938.db2.gz ASEIWQNBSDSNMI-GFCCVEGCSA-N 0 0 377.365 3.332 20 5 GGBDRN CCc1noc(C)c1CS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000160394614 565242446 /nfs/dbraw/zinc/24/24/46/565242446.db2.gz UWKQCPHFYNMRIP-UHFFFAOYSA-N 0 0 389.227 3.190 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCO1 ZINC000271261486 565245416 /nfs/dbraw/zinc/24/54/16/565245416.db2.gz KVUBGHVHKUURGK-IONNQARKSA-N 0 0 377.622 3.308 20 5 GGBDRN CO[C@@H](c1ccc(F)cc1)[C@@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271303587 565247275 /nfs/dbraw/zinc/24/72/75/565247275.db2.gz HEBDRBSHTWDVJU-YMTOWFKASA-N 0 0 388.442 3.387 20 5 GGBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271303585 565247599 /nfs/dbraw/zinc/24/75/99/565247599.db2.gz HEBDRBSHTWDVJU-XPTSAGLGSA-N 0 0 388.442 3.387 20 5 GGBDRN CO[C@@H]1CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)[C@@H](C)C1 ZINC000295157737 565247642 /nfs/dbraw/zinc/24/76/42/565247642.db2.gz ASTFAQXVCYWZNV-DTWKUNHWSA-N 0 0 383.253 3.090 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccc2c(c1)OCO2 ZINC000160486741 565247992 /nfs/dbraw/zinc/24/79/92/565247992.db2.gz BNRUVPWDQXVJOW-UHFFFAOYSA-N 0 0 379.166 3.363 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c1Cl ZINC000295166863 565249140 /nfs/dbraw/zinc/24/91/40/565249140.db2.gz PNQIJGWZNJUKBW-JOYOIKCWSA-N 0 0 395.264 3.138 20 5 GGBDRN CC1(C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)[C@H]2CCCO[C@H]21 ZINC000372695569 565249711 /nfs/dbraw/zinc/24/97/11/565249711.db2.gz RQWRHGOOKBOSSH-DAXOMENPSA-N 0 0 397.269 3.220 20 5 GGBDRN C[C@@H]1C[C@@H](NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000271351299 565249897 /nfs/dbraw/zinc/24/98/97/565249897.db2.gz XLLMPMUBBNTMRE-KOLCDFICSA-N 0 0 378.372 3.389 20 5 GGBDRN O=C(Cc1ccc(F)cc1Br)NCCc1ccc([N+](=O)[O-])cc1 ZINC000186243009 565250039 /nfs/dbraw/zinc/25/00/39/565250039.db2.gz DYOXIWYWBBVWRS-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN CCCc1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)n(C)n1 ZINC000271383350 565250344 /nfs/dbraw/zinc/25/03/44/565250344.db2.gz JZVCGKQDQHQOBO-UHFFFAOYSA-N 0 0 385.193 3.435 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271381182 565250650 /nfs/dbraw/zinc/25/06/50/565250650.db2.gz KGFBDGZJSUKENP-PSASIEDQSA-N 0 0 376.481 3.045 20 5 GGBDRN O=C(Cc1ccc(Br)c(F)c1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000160585827 565251344 /nfs/dbraw/zinc/25/13/44/565251344.db2.gz SGEAKERNDVGXRJ-UHFFFAOYSA-N 0 0 381.201 3.398 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N2CCC(CCCO)CC2)c1Cl ZINC000295201864 565251795 /nfs/dbraw/zinc/25/17/95/565251795.db2.gz VLNWLYOTANMKLW-UHFFFAOYSA-N 0 0 397.280 3.075 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc(OCCO)cc2)cc1[N+](=O)[O-] ZINC000160627207 565252885 /nfs/dbraw/zinc/25/28/85/565252885.db2.gz OMTAGTZNJNXUFP-UHFFFAOYSA-N 0 0 395.209 3.289 20 5 GGBDRN CC1(C)C[C@@H](O)CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2Cl)C1 ZINC000295245622 565253972 /nfs/dbraw/zinc/25/39/72/565253972.db2.gz FDTZPNZYPDLYNC-VIFPVBQESA-N 0 0 397.280 3.073 20 5 GGBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271456640 565254630 /nfs/dbraw/zinc/25/46/30/565254630.db2.gz YCCSVOPVARXWIO-RNCFNFMXSA-N 0 0 388.442 3.123 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](C)c2cc(C)sc2C)cc1[N+](=O)[O-] ZINC000186327140 565255646 /nfs/dbraw/zinc/25/56/46/565255646.db2.gz CZSSJMSPTKCVRV-SECBINFHSA-N 0 0 388.442 3.460 20 5 GGBDRN CC1(C)C[C@H](O)CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)C1 ZINC000295256365 565255516 /nfs/dbraw/zinc/25/55/16/565255516.db2.gz GLHHTDQEWOSCER-SECBINFHSA-N 0 0 397.280 3.073 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCC(c2ccsc2)CC1 ZINC000186341303 565256169 /nfs/dbraw/zinc/25/61/69/565256169.db2.gz UGSCPHCIBVKLFM-UHFFFAOYSA-N 0 0 380.491 3.408 20 5 GGBDRN CC(C)[C@@H]1C[C@@H](Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])CCO1 ZINC000271513115 565256550 /nfs/dbraw/zinc/25/65/50/565256550.db2.gz YYZUBNYBKWXWTM-HZMBPMFUSA-N 0 0 378.397 3.207 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1ccccc1Br ZINC000160710695 565256770 /nfs/dbraw/zinc/25/67/70/565256770.db2.gz ZFLVQTAMEYBJGZ-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cnn(CCC(F)(F)F)c1 ZINC000186354558 565257466 /nfs/dbraw/zinc/25/74/66/565257466.db2.gz PYQHQWIOGFKRMA-UHFFFAOYSA-N 0 0 376.722 3.327 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCCN(c2ccccc2)CC1 ZINC000160734285 565257770 /nfs/dbraw/zinc/25/77/70/565257770.db2.gz YKMGUZDGHOLBDT-UHFFFAOYSA-N 0 0 377.242 3.469 20 5 GGBDRN CC[C@H](COCC(F)(F)F)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000295292447 565257950 /nfs/dbraw/zinc/25/79/50/565257950.db2.gz AUJDHORBDZJQJJ-SECBINFHSA-N 0 0 399.163 3.445 20 5 GGBDRN CC[C@@H](COCC(F)(F)F)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000295292449 565257958 /nfs/dbraw/zinc/25/79/58/565257958.db2.gz AUJDHORBDZJQJJ-VIFPVBQESA-N 0 0 399.163 3.445 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C(F)(F)F)n1 ZINC000295379117 565262489 /nfs/dbraw/zinc/26/24/89/565262489.db2.gz MDXPLBOFRUEMHJ-JTQLQIEISA-N 0 0 377.348 3.240 20 5 GGBDRN Cc1csc([C@H](C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000186482500 565263100 /nfs/dbraw/zinc/26/31/00/565263100.db2.gz JJHZPBFXYHNANQ-MRVPVSSYSA-N 0 0 375.859 3.095 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186525503 565266501 /nfs/dbraw/zinc/26/65/01/565266501.db2.gz LPUPCCYPDPEHAF-XHDPSFHLSA-N 0 0 381.841 3.415 20 5 GGBDRN C[C@H]1C[C@@H](c2cccnc2)N(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000186531251 565266554 /nfs/dbraw/zinc/26/65/54/565266554.db2.gz GTJKGJYYZOEVAJ-FZMZJTMJSA-N 0 0 381.841 3.415 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000186564536 565268367 /nfs/dbraw/zinc/26/83/67/565268367.db2.gz KXURIKZEGBQZIN-VIFPVBQESA-N 0 0 383.202 3.014 20 5 GGBDRN CSc1cccc(C(=O)Nc2nc(-c3cnn(C)c3)cs2)c1[N+](=O)[O-] ZINC000186577148 565269790 /nfs/dbraw/zinc/26/97/90/565269790.db2.gz AMWMSEYFCWGDPU-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN O=C(Nc1ccc2c(c1)OCCO2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000161092801 565272957 /nfs/dbraw/zinc/27/29/57/565272957.db2.gz LULMLQWKUQQNOL-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[C@@H]1CCCCO1 ZINC000272011840 565274320 /nfs/dbraw/zinc/27/43/20/565274320.db2.gz ATTMEFISRHTRRJ-UFBFGSQYSA-N 0 0 375.194 3.184 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCSC[C@@H]2c2nccs2)c2c(c1)COCO2 ZINC000186644626 565274770 /nfs/dbraw/zinc/27/47/70/565274770.db2.gz XZDBCMQDGDODFE-CQSZACIVSA-N 0 0 379.463 3.208 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1CCc2c1cccc2Cl ZINC000161160108 565274727 /nfs/dbraw/zinc/27/47/27/565274727.db2.gz UGVIRWZCULKMSA-MRXNPFEDSA-N 0 0 380.853 3.398 20 5 GGBDRN COc1cc(CN2CCSC[C@H]2c2nccs2)c([N+](=O)[O-])cc1OC ZINC000186657193 565275863 /nfs/dbraw/zinc/27/58/63/565275863.db2.gz OWXFKGROTWZFLA-ZDUSSCGKSA-N 0 0 381.479 3.359 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000186673849 565277114 /nfs/dbraw/zinc/27/71/14/565277114.db2.gz GWFNVVCRNGEOQZ-VIFPVBQESA-N 0 0 383.202 3.014 20 5 GGBDRN O=C(c1c(F)cccc1Br)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373308308 565278758 /nfs/dbraw/zinc/27/87/58/565278758.db2.gz XVPXLDMYYAPGKG-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN CO[C@@H](CNC(=O)c1sc(Br)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000295675521 565280199 /nfs/dbraw/zinc/28/01/99/565280199.db2.gz IDFSBUYWWIENOH-LLVKDONJSA-N 0 0 399.266 3.406 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC2(CCOCC2)[C@H]1C1CC1 ZINC000295674736 565280444 /nfs/dbraw/zinc/28/04/44/565280444.db2.gz UVLARUFAESNYQH-OAHLLOKOSA-N 0 0 395.253 3.389 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@H]1[C@@H]1CCCC1=O ZINC000272216171 565282108 /nfs/dbraw/zinc/28/21/08/565282108.db2.gz SLDGVZHNSRAJGE-JQWIXIFHSA-N 0 0 399.216 3.470 20 5 GGBDRN COC(=O)CCN(Cc1ccncc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000161361341 565282482 /nfs/dbraw/zinc/28/24/82/565282482.db2.gz LVVCXFXHZDUDPA-UHFFFAOYSA-N 0 0 394.225 3.322 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(Br)c(Cl)c1 ZINC000161383019 565282594 /nfs/dbraw/zinc/28/25/94/565282594.db2.gz LIDWHPJOAMBVSJ-UHFFFAOYSA-N 0 0 388.609 3.029 20 5 GGBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[C@H]1OCCc2sccc21 ZINC000295707250 565283012 /nfs/dbraw/zinc/28/30/12/565283012.db2.gz RABYNWXSVDFJJV-MGPLVRAMSA-N 0 0 382.463 3.174 20 5 GGBDRN CC(C)N1CCO[C@H](c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)C1 ZINC000272351006 565284852 /nfs/dbraw/zinc/28/48/52/565284852.db2.gz AFAOBDHDLFDAFS-ZDUSSCGKSA-N 0 0 397.229 3.189 20 5 GGBDRN CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000272459720 565287378 /nfs/dbraw/zinc/28/73/78/565287378.db2.gz KPWPNAFNCHUQGD-ZANVPECISA-N 0 0 389.221 3.120 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000161713404 565291160 /nfs/dbraw/zinc/29/11/60/565291160.db2.gz NFNGXQGBUXYFOV-UHFFFAOYSA-N 0 0 377.809 3.494 20 5 GGBDRN O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000161709225 565291339 /nfs/dbraw/zinc/29/13/39/565291339.db2.gz DBIBWWBVGRKJOX-UHFFFAOYSA-N 0 0 376.583 3.355 20 5 GGBDRN CC(C)N1CCO[C@@H](c2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)C1 ZINC000272702785 565294027 /nfs/dbraw/zinc/29/40/27/565294027.db2.gz WNZOPHYQRJUDNJ-CYBMUJFWSA-N 0 0 397.229 3.189 20 5 GGBDRN CC[C@H](O)[C@@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000161837299 565294456 /nfs/dbraw/zinc/29/44/56/565294456.db2.gz VOGAUYUNUCQWCH-AAEUAGOBSA-N 0 0 397.280 3.216 20 5 GGBDRN Cc1c(CC(=O)NCCNc2ncc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000161846302 565295467 /nfs/dbraw/zinc/29/54/67/565295467.db2.gz QECRFIDXUSZPRB-UHFFFAOYSA-N 0 0 383.235 3.376 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCC(c3ccsc3)CC2)cc1 ZINC000186929255 565295655 /nfs/dbraw/zinc/29/56/55/565295655.db2.gz XMTMTYKXVMGMJN-UHFFFAOYSA-N 0 0 380.491 3.310 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccsc1 ZINC000186958295 565297631 /nfs/dbraw/zinc/29/76/31/565297631.db2.gz NQONYXFEBFDROM-GFCCVEGCSA-N 0 0 399.222 3.063 20 5 GGBDRN Cn1ccnc1[C@@H]1N(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1(C)C ZINC000296015204 565298340 /nfs/dbraw/zinc/29/83/40/565298340.db2.gz WQJSIBPGIAVQSP-ZDUSSCGKSA-N 0 0 393.241 3.314 20 5 GGBDRN CC[C@H](CNC(=O)c1[nH]ncc1[N+](=O)[O-])Cc1cccc(Br)c1 ZINC000161959923 565298571 /nfs/dbraw/zinc/29/85/71/565298571.db2.gz UPSXMQGUDHOKRI-JTQLQIEISA-N 0 0 381.230 3.079 20 5 GGBDRN COCCOc1ccc(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c(C)c1 ZINC000272890574 565300637 /nfs/dbraw/zinc/30/06/37/565300637.db2.gz XUFMUPHENNRRLS-UHFFFAOYSA-N 0 0 386.451 3.137 20 5 GGBDRN CO[C@]1(C)CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000373759585 565301980 /nfs/dbraw/zinc/30/19/80/565301980.db2.gz SRMIKBORAWTKQN-MRXNPFEDSA-N 0 0 385.258 3.317 20 5 GGBDRN Cc1ccnc(N2CCC(O)(c3scnc3Br)CC2)c1[N+](=O)[O-] ZINC000373769130 565302165 /nfs/dbraw/zinc/30/21/65/565302165.db2.gz UEQFXTWBIZHFDX-UHFFFAOYSA-N 0 0 399.270 3.005 20 5 GGBDRN COCCCn1ccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000272920543 565302411 /nfs/dbraw/zinc/30/24/11/565302411.db2.gz FUBHEJRGRMDRJH-UHFFFAOYSA-N 0 0 384.845 3.212 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[C@@H](C2CCOCC2)C1 ZINC000373776222 565303047 /nfs/dbraw/zinc/30/30/47/565303047.db2.gz SPLIJHIBSHAVSC-GFCCVEGCSA-N 0 0 383.242 3.246 20 5 GGBDRN O=C(Nc1cnc2c(c1)COCC2)c1cccc([N+](=O)[O-])c1Br ZINC000373776715 565303225 /nfs/dbraw/zinc/30/32/25/565303225.db2.gz WTFNWDJBDSCGLS-UHFFFAOYSA-N 0 0 378.182 3.077 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N(Cc1cccc(Br)c1)C1CC1 ZINC000187034818 565303421 /nfs/dbraw/zinc/30/34/21/565303421.db2.gz IIMMFJOXLFEDFD-UHFFFAOYSA-N 0 0 392.209 3.263 20 5 GGBDRN Cc1nc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)ccc1[C@H](C)O ZINC000272990193 565303705 /nfs/dbraw/zinc/30/37/05/565303705.db2.gz MWMVMRHDAMYDDF-JTQLQIEISA-N 0 0 394.225 3.044 20 5 GGBDRN O=C(CSC(F)F)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000296140064 565304426 /nfs/dbraw/zinc/30/44/26/565304426.db2.gz SRZGKEPUTNAZRH-UHFFFAOYSA-N 0 0 381.198 3.198 20 5 GGBDRN CC[C@H](C)[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)OC ZINC000296145807 565304811 /nfs/dbraw/zinc/30/48/11/565304811.db2.gz RHEWLOHOQUSWEL-QPUJVOFHSA-N 0 0 377.210 3.287 20 5 GGBDRN O=C(CN1CCSC[C@@H]1c1nccs1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000187044716 565304924 /nfs/dbraw/zinc/30/49/24/565304924.db2.gz ZVGVQVJILFLANG-CYBMUJFWSA-N 0 0 398.897 3.433 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2C[C@H]3OCCC[C@@H]23)cc(Br)cc1[N+](=O)[O-] ZINC000373851063 565306436 /nfs/dbraw/zinc/30/64/36/565306436.db2.gz VTFZWHJOUNCIRK-ZKYQVNSYSA-N 0 0 384.230 3.355 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2C[C@@H]3OCCC[C@H]23)cc(Br)cc1[N+](=O)[O-] ZINC000373851061 565306688 /nfs/dbraw/zinc/30/66/88/565306688.db2.gz VTFZWHJOUNCIRK-QKCSRTOESA-N 0 0 384.230 3.355 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2C[C@@H]3OCCC[C@@H]23)cc(Br)cc1[N+](=O)[O-] ZINC000373851062 565306826 /nfs/dbraw/zinc/30/68/26/565306826.db2.gz VTFZWHJOUNCIRK-SUHUHFCYSA-N 0 0 384.230 3.355 20 5 GGBDRN CC[C@]1(CO)CCCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000187077881 565307561 /nfs/dbraw/zinc/30/75/61/565307561.db2.gz SORHKSIWSATVCJ-INIZCTEOSA-N 0 0 385.258 3.290 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC(c2cn[nH]c2)CC1 ZINC000373879757 565307756 /nfs/dbraw/zinc/30/77/56/565307756.db2.gz DPSFKJOAORHICX-UHFFFAOYSA-N 0 0 379.214 3.100 20 5 GGBDRN O=C(CSc1nnc(NC[C@@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC000273154677 565310625 /nfs/dbraw/zinc/31/06/25/565310625.db2.gz IUXLVMGAGHJKRU-LBPRGKRZSA-N 0 0 380.451 3.012 20 5 GGBDRN CC(C)c1nnc([C@@H](C)NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000273166479 565310803 /nfs/dbraw/zinc/31/08/03/565310803.db2.gz BYLOMEYUTFFYJY-SECBINFHSA-N 0 0 383.861 3.459 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](C)Cc2ccc(C)s2)cc1[N+](=O)[O-] ZINC000187132080 565312154 /nfs/dbraw/zinc/31/21/54/565312154.db2.gz XSBCDVKANLFRFP-SECBINFHSA-N 0 0 388.442 3.022 20 5 GGBDRN O=[N+]([O-])c1cc(CNc2ccc(-c3cncnc3)cn2)ccc1Br ZINC000373994195 565314628 /nfs/dbraw/zinc/31/46/28/565314628.db2.gz FPEDARACEZNVTI-UHFFFAOYSA-N 0 0 386.209 3.243 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Nc2ccc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000187173549 565314989 /nfs/dbraw/zinc/31/49/89/565314989.db2.gz KDSGLZSSYCXKFF-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN CCC1(NC(=O)C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CCCC1 ZINC000296397334 565315820 /nfs/dbraw/zinc/31/58/20/565315820.db2.gz OZDHNUIXAXDDGL-UHFFFAOYSA-N 0 0 384.230 3.135 20 5 GGBDRN C[C@]1(CCCO)CCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000273378209 565319089 /nfs/dbraw/zinc/31/90/89/565319089.db2.gz ZGYZUPUGDDEEOW-OAHLLOKOSA-N 0 0 389.221 3.264 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCO[C@H](c3ccc(Cl)s3)C2)c1[N+](=O)[O-] ZINC000374103812 565319840 /nfs/dbraw/zinc/31/98/40/565319840.db2.gz BNOVGXMWFGBXEW-JTQLQIEISA-N 0 0 384.845 3.199 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCO[C@@H](c3ccc(Cl)s3)C2)c1[N+](=O)[O-] ZINC000374103813 565320009 /nfs/dbraw/zinc/32/00/09/565320009.db2.gz BNOVGXMWFGBXEW-SNVBAGLBSA-N 0 0 384.845 3.199 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCOC[C@H]1c1ccccc1 ZINC000374121356 565321931 /nfs/dbraw/zinc/32/19/31/565321931.db2.gz NEWPUAWIYCACCJ-HNNXBMFYSA-N 0 0 382.825 3.010 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(F)c(Br)cc1C ZINC000187338842 565323850 /nfs/dbraw/zinc/32/38/50/565323850.db2.gz QLGWFWCOXWBCGG-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN CSc1cccc(C(=O)NC2CCN(c3nccs3)CC2)c1[N+](=O)[O-] ZINC000374185101 565324650 /nfs/dbraw/zinc/32/46/50/565324650.db2.gz VXBCLIKJUAPTNF-UHFFFAOYSA-N 0 0 378.479 3.172 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000374205289 565325206 /nfs/dbraw/zinc/32/52/06/565325206.db2.gz NTSXGVGRLQCXJT-LLVKDONJSA-N 0 0 375.431 3.480 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccn1 ZINC000162710430 565325341 /nfs/dbraw/zinc/32/53/41/565325341.db2.gz LRPXMNPNBURTJB-VIFPVBQESA-N 0 0 375.328 3.048 20 5 GGBDRN C[C@H]1[C@@H](c2ccc(Br)cc2)OCCN1c1ncc([N+](=O)[O-])cn1 ZINC000273573289 565326110 /nfs/dbraw/zinc/32/61/10/565326110.db2.gz AOPMSFSXLQWGJI-HZMBPMFUSA-N 0 0 379.214 3.114 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1cccc(Br)c1 ZINC000187356280 565326530 /nfs/dbraw/zinc/32/65/30/565326530.db2.gz ZWLWXHKRBYDBTB-CYBMUJFWSA-N 0 0 392.209 3.435 20 5 GGBDRN Cc1noc(C)c1CCNS(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC000296610350 565326641 /nfs/dbraw/zinc/32/66/41/565326641.db2.gz GOSAQVBVPKGQOQ-UHFFFAOYSA-N 0 0 394.236 3.027 20 5 GGBDRN CC(C)N1C(=S)N=NC1CCNC(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000296641657 565327581 /nfs/dbraw/zinc/32/75/81/565327581.db2.gz DKIFVIOOIDOIBV-UHFFFAOYSA-N 0 0 384.849 3.074 20 5 GGBDRN Cc1cc(C2CCN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])CC2)[nH]n1 ZINC000273619182 565327867 /nfs/dbraw/zinc/32/78/67/565327867.db2.gz OEZHMOXLZWOKJI-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1Cc2cccc(Br)c2C1 ZINC000187396556 565329692 /nfs/dbraw/zinc/32/96/92/565329692.db2.gz JCBDAVOYOPWFLF-UHFFFAOYSA-N 0 0 387.193 3.390 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@@H]1CCCC12CCOCC2 ZINC000374290252 565330144 /nfs/dbraw/zinc/33/01/44/565330144.db2.gz AHBPQCORMACPLZ-OAHLLOKOSA-N 0 0 397.269 3.365 20 5 GGBDRN CCOc1ccc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1Br ZINC000187427246 565330786 /nfs/dbraw/zinc/33/07/86/565330786.db2.gz CXCDJZMTSOFZCL-UHFFFAOYSA-N 0 0 383.202 3.050 20 5 GGBDRN C[C@H]1COCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)C1 ZINC000374340745 565332499 /nfs/dbraw/zinc/33/24/99/565332499.db2.gz LNRWYTTXUHHDTA-MRVPVSSYSA-N 0 0 377.622 3.119 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@H]1c1cccc(Br)c1 ZINC000163046770 565334735 /nfs/dbraw/zinc/33/47/35/565334735.db2.gz XSNMHYYDQKMBFJ-LBPRGKRZSA-N 0 0 379.214 3.068 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C)CCc2ccccn2)cc1[N+](=O)[O-] ZINC000163039955 565335356 /nfs/dbraw/zinc/33/53/56/565335356.db2.gz CZESNWNUPLWIJB-UHFFFAOYSA-N 0 0 378.226 3.375 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)C2CCC(C(F)(F)F)CC2)cc1 ZINC000296803182 565337420 /nfs/dbraw/zinc/33/74/20/565337420.db2.gz UKUFSUYVWXJHMM-UHFFFAOYSA-N 0 0 380.388 3.178 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Nc2cc(F)c(F)cc2Cl)cc1[N+](=O)[O-] ZINC000187520838 565338205 /nfs/dbraw/zinc/33/82/05/565338205.db2.gz OHVALSLPISYCQQ-UHFFFAOYSA-N 0 0 396.730 3.475 20 5 GGBDRN CCOC(=O)Cc1cnc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)s1 ZINC000296833752 565339826 /nfs/dbraw/zinc/33/98/26/565339826.db2.gz FCQRABXYGNCPIU-UHFFFAOYSA-N 0 0 381.435 3.131 20 5 GGBDRN COCCC1(c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)CC1 ZINC000273838647 565340547 /nfs/dbraw/zinc/34/05/47/565340547.db2.gz MRDITKGPIYTWJR-UHFFFAOYSA-N 0 0 382.214 3.399 20 5 GGBDRN CC(=O)N1CCC[C@H](c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)C1 ZINC000273855423 565340869 /nfs/dbraw/zinc/34/08/69/565340869.db2.gz KQFYFDGHORWNOZ-JTQLQIEISA-N 0 0 395.213 3.133 20 5 GGBDRN CCn1cc([C@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)cn1 ZINC000296857139 565340958 /nfs/dbraw/zinc/34/09/58/565340958.db2.gz GLZHNALORSVZOV-QMMMGPOBSA-N 0 0 385.193 3.204 20 5 GGBDRN Cc1nnc([C@H](C)NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)s1 ZINC000273863578 565341325 /nfs/dbraw/zinc/34/13/25/565341325.db2.gz OPLZQNISEULNAV-LURJTMIESA-N 0 0 386.231 3.400 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(CC[C@@H]3CCCO3)n2)c(Br)c1 ZINC000273858093 565341490 /nfs/dbraw/zinc/34/14/90/565341490.db2.gz OPFXIDRAOHRQDU-LBPRGKRZSA-N 0 0 382.214 3.443 20 5 GGBDRN CC(C)OC(=O)c1ccc(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)cc1 ZINC000163303229 565342306 /nfs/dbraw/zinc/34/23/06/565342306.db2.gz YCSYBAWBFIVVEB-UHFFFAOYSA-N 0 0 395.209 3.133 20 5 GGBDRN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000163294330 565342668 /nfs/dbraw/zinc/34/26/68/565342668.db2.gz CJASVZFMASYERQ-NSHDSACASA-N 0 0 383.857 3.089 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1nccs1 ZINC000163330869 565344133 /nfs/dbraw/zinc/34/41/33/565344133.db2.gz ULFWKUINOIRKMZ-ZETCQYMHSA-N 0 0 381.357 3.110 20 5 GGBDRN COC(C)(C)C[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163389379 565344539 /nfs/dbraw/zinc/34/45/39/565344539.db2.gz AKDVROZXPWKACU-SECBINFHSA-N 0 0 384.376 3.096 20 5 GGBDRN CSCC[C@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163371365 565344922 /nfs/dbraw/zinc/34/49/22/565344922.db2.gz RYRBORNTSSPIEM-VIFPVBQESA-N 0 0 386.417 3.376 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C[C@@H](C)S1 ZINC000163395137 565344995 /nfs/dbraw/zinc/34/49/95/565344995.db2.gz WCQQQLQKLIFLOY-RKDXNWHRSA-N 0 0 384.401 3.128 20 5 GGBDRN CC1(C)C[C@H](O)CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000296918181 565345461 /nfs/dbraw/zinc/34/54/61/565345461.db2.gz LNCSLOWUKVQYJC-SNVBAGLBSA-N 0 0 389.221 3.120 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCS1 ZINC000163429851 565346610 /nfs/dbraw/zinc/34/66/10/565346610.db2.gz AEPGMRITUYDWGB-UHFFFAOYSA-N 0 0 384.401 3.130 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC(=O)Nc2c(F)cccc21 ZINC000374679793 565350437 /nfs/dbraw/zinc/35/04/37/565350437.db2.gz OECGSPJPFCOGEU-UHFFFAOYSA-N 0 0 394.156 3.095 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000163738832 565351265 /nfs/dbraw/zinc/35/12/65/565351265.db2.gz HVNKUWYEIJGQEM-AWEZNQCLSA-N 0 0 396.241 3.291 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)c1ccc([N+](=O)[O-])cc1S(C)(=O)=O)CCC2 ZINC000297066051 565353766 /nfs/dbraw/zinc/35/37/66/565353766.db2.gz JFZOZUNYINGKHR-AWEZNQCLSA-N 0 0 381.479 3.277 20 5 GGBDRN C[C@H]1OCC[C@@H]1SCC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000164052642 565354645 /nfs/dbraw/zinc/35/46/45/565354645.db2.gz GLOITZCNUKZYHZ-PELKAZGASA-N 0 0 375.244 3.206 20 5 GGBDRN CCOC1(C)CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CC1 ZINC000297083423 565355169 /nfs/dbraw/zinc/35/51/69/565355169.db2.gz NPEGTBKNBCCXBI-UHFFFAOYSA-N 0 0 397.280 3.481 20 5 GGBDRN C[C@H](NC(=O)Nc1nnc(CC(F)(F)F)s1)c1ccc([N+](=O)[O-])cc1 ZINC000297101925 565355757 /nfs/dbraw/zinc/35/57/57/565355757.db2.gz NXRDIHCPYLDLNC-ZETCQYMHSA-N 0 0 375.332 3.434 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H](CCO)c2ccco2)cc1[N+](=O)[O-] ZINC000187806226 565357113 /nfs/dbraw/zinc/35/71/13/565357113.db2.gz DOPDGMAXRSACNU-GFCCVEGCSA-N 0 0 383.198 3.112 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](CCO)c2ccco2)cc1[N+](=O)[O-] ZINC000187806208 565357267 /nfs/dbraw/zinc/35/72/67/565357267.db2.gz DOPDGMAXRSACNU-LBPRGKRZSA-N 0 0 383.198 3.112 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nc(-c2ccccc2F)no1 ZINC000187831444 565358191 /nfs/dbraw/zinc/35/81/91/565358191.db2.gz WCWDMEQKWWAWFP-UHFFFAOYSA-N 0 0 382.149 3.100 20 5 GGBDRN COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000274154228 565358917 /nfs/dbraw/zinc/35/89/17/565358917.db2.gz DIZHAHLDSKEXHJ-SECBINFHSA-N 0 0 376.312 3.033 20 5 GGBDRN O=C(N[C@@H]1CCO[C@H](C2CC2)C1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000274188825 565360443 /nfs/dbraw/zinc/36/04/43/565360443.db2.gz FMTCLGLBLICDOY-MFKMUULPSA-N 0 0 387.205 3.184 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000274188828 565360966 /nfs/dbraw/zinc/36/09/66/565360966.db2.gz FMTCLGLBLICDOY-ZWNOBZJWSA-N 0 0 387.205 3.184 20 5 GGBDRN O=C(N[C@H]1CCC[C@H]1CCO)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000187913549 565363128 /nfs/dbraw/zinc/36/31/28/565363128.db2.gz OZANSJYKRJLAST-KWQFWETISA-N 0 0 391.649 3.292 20 5 GGBDRN CC(F)(F)CCNC(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000297245298 565363251 /nfs/dbraw/zinc/36/32/51/565363251.db2.gz RLFVBIKZHOCDLZ-UHFFFAOYSA-N 0 0 392.200 3.470 20 5 GGBDRN O=C(N[C@@H]1CCC[C@@H]1CCO)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000187913465 565363381 /nfs/dbraw/zinc/36/33/81/565363381.db2.gz OZANSJYKRJLAST-LDYMZIIASA-N 0 0 391.649 3.292 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000375041221 565365324 /nfs/dbraw/zinc/36/53/24/565365324.db2.gz HXCSCTQEMLYXTH-VXGBXAGGSA-N 0 0 383.242 3.164 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000165762848 565370930 /nfs/dbraw/zinc/37/09/30/565370930.db2.gz ZLQZZKBRSFFGTN-UHFFFAOYSA-N 0 0 386.832 3.392 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCSC2(CCOCC2)C1 ZINC000274540327 565373611 /nfs/dbraw/zinc/37/36/11/565373611.db2.gz GDDLPWODYDBGCJ-UHFFFAOYSA-N 0 0 385.873 3.056 20 5 GGBDRN C[C@H]1OCCN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000166118143 565373643 /nfs/dbraw/zinc/37/36/43/565373643.db2.gz GNACUMHDFLXWCT-VHSXEESVSA-N 0 0 378.372 3.342 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC3(CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000375190789 565373946 /nfs/dbraw/zinc/37/39/46/565373946.db2.gz CASILWADWNKTHY-UHFFFAOYSA-N 0 0 388.873 3.138 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[C@@H]1C ZINC000166237700 565374680 /nfs/dbraw/zinc/37/46/80/565374680.db2.gz GUZAMGZLFSOSCL-UWVGGRQHSA-N 0 0 377.260 3.024 20 5 GGBDRN Cc1cc(Cl)c(C(=O)N2CCSC[C@H]2c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000297582281 565377525 /nfs/dbraw/zinc/37/75/25/565377525.db2.gz BUTOYQJDGKLOLN-HNNXBMFYSA-N 0 0 380.857 3.220 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1COc2ccccc21 ZINC000167531822 565378429 /nfs/dbraw/zinc/37/84/29/565378429.db2.gz DMTYOMQGTYYTMH-MFKMUULPSA-N 0 0 382.825 3.091 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000167566549 565379331 /nfs/dbraw/zinc/37/93/31/565379331.db2.gz JXJBHQYWGVWFSQ-PWSUYJOCSA-N 0 0 382.825 3.091 20 5 GGBDRN CC(C)(C)OC(=O)[C@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000167721043 565380064 /nfs/dbraw/zinc/38/00/64/565380064.db2.gz NFHSJVIMEALMGX-JTQLQIEISA-N 0 0 386.246 3.310 20 5 GGBDRN CCn1nc(C)c(CC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1C ZINC000297633130 565380237 /nfs/dbraw/zinc/38/02/37/565380237.db2.gz FMNMJBDYQDPSIK-UHFFFAOYSA-N 0 0 381.230 3.372 20 5 GGBDRN C[C@@H]1CCSCCN1c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000170611254 565383286 /nfs/dbraw/zinc/38/32/86/565383286.db2.gz QAZSPOJACWEEFP-SECBINFHSA-N 0 0 384.401 3.220 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Br)c(C2CC2)n1 ZINC000297733784 565384422 /nfs/dbraw/zinc/38/44/22/565384422.db2.gz HPMJQSDHKUJURN-UHFFFAOYSA-N 0 0 394.229 3.163 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)C1CCN(CC(F)F)CC1 ZINC000297732593 565384431 /nfs/dbraw/zinc/38/44/31/565384431.db2.gz KGXZKJSZSTXZPS-UHFFFAOYSA-N 0 0 392.200 3.273 20 5 GGBDRN O=C(CSCC(=O)c1ccc(Cl)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000170694898 565386809 /nfs/dbraw/zinc/38/68/09/565386809.db2.gz YDSQWWLDLYOLQM-UHFFFAOYSA-N 0 0 378.837 3.481 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000297905419 565391662 /nfs/dbraw/zinc/39/16/62/565391662.db2.gz XACCLJDXICUQGG-ZBFHGGJFSA-N 0 0 381.226 3.141 20 5 GGBDRN COc1cc(C(=O)N2CCSC[C@@H]2c2nccs2)c([N+](=O)[O-])cc1F ZINC000298045585 565397365 /nfs/dbraw/zinc/39/73/65/565397365.db2.gz PNZRHMCFSBWFCE-GFCCVEGCSA-N 0 0 383.426 3.129 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)C1(Cc2ccccc2Br)CC1 ZINC000298112483 565399392 /nfs/dbraw/zinc/39/93/92/565399392.db2.gz VSWZRNQCGMNMNI-UHFFFAOYSA-N 0 0 379.214 3.052 20 5 GGBDRN COc1cc(Cl)c(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000170939954 565399428 /nfs/dbraw/zinc/39/94/28/565399428.db2.gz XNWYCZKVPDNURO-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN Cc1cc(N2CCC([C@H](O)c3ncc[nH]3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000375658820 565399829 /nfs/dbraw/zinc/39/98/29/565399829.db2.gz TTWITAYYICPOKC-HNNXBMFYSA-N 0 0 395.257 3.339 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCCN(Cc2cscn2)CC1 ZINC000171023604 565404047 /nfs/dbraw/zinc/40/40/47/565404047.db2.gz JKSXGSSTJIJHNN-UHFFFAOYSA-N 0 0 380.857 3.053 20 5 GGBDRN O=C(c1sccc1Br)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188486494 565404845 /nfs/dbraw/zinc/40/48/45/565404845.db2.gz SNOQKKWIXMSSPA-UHFFFAOYSA-N 0 0 383.223 3.322 20 5 GGBDRN O=C(c1ccccc1Br)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188536090 565407072 /nfs/dbraw/zinc/40/70/72/565407072.db2.gz BGBOUUQEJGGDDB-UHFFFAOYSA-N 0 0 377.194 3.261 20 5 GGBDRN Cc1n[nH]cc1C1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000375833701 565407526 /nfs/dbraw/zinc/40/75/26/565407526.db2.gz IZKTYVHMHSLGCS-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN CC[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1Cl)c1nc(C)cs1 ZINC000298274599 565407575 /nfs/dbraw/zinc/40/75/75/565407575.db2.gz WVGFZKHPSTYSLY-VIFPVBQESA-N 0 0 382.829 3.219 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@@H]2c2nc(C)cs2)c1 ZINC000188610263 565412740 /nfs/dbraw/zinc/41/27/40/565412740.db2.gz VXYQJEJKAHNALA-CQSZACIVSA-N 0 0 379.463 3.295 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000275484771 565414028 /nfs/dbraw/zinc/41/40/28/565414028.db2.gz UYZSOJGHXBTXDB-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000188657630 565414979 /nfs/dbraw/zinc/41/49/79/565414979.db2.gz MERLJXHPCCFDMK-CQSZACIVSA-N 0 0 381.841 3.156 20 5 GGBDRN CCSc1cc(CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000188646266 565415702 /nfs/dbraw/zinc/41/57/02/565415702.db2.gz XLSQVDGYXAORME-UHFFFAOYSA-N 0 0 387.870 3.234 20 5 GGBDRN CCS(=O)(=O)CCCCCOc1cc(F)c(Br)cc1[N+](=O)[O-] ZINC000188661472 565416133 /nfs/dbraw/zinc/41/61/33/565416133.db2.gz INAGOBCJQYNXLX-UHFFFAOYSA-N 0 0 398.250 3.480 20 5 GGBDRN COc1ccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])cc1Br ZINC000171232820 565420921 /nfs/dbraw/zinc/42/09/21/565420921.db2.gz FKKVUEMLTZJBMB-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN CCn1cc(Br)cc1C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000171265042 565422475 /nfs/dbraw/zinc/42/24/75/565422475.db2.gz BKUKCKJRAVUMNB-UHFFFAOYSA-N 0 0 382.214 3.117 20 5 GGBDRN Cn1ccnc1[C@](O)(CCNc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000298705646 565425929 /nfs/dbraw/zinc/42/59/29/565425929.db2.gz GEXTWFMXSXLWQR-CYBMUJFWSA-N 0 0 378.738 3.234 20 5 GGBDRN O=[N+]([O-])c1ccccc1CNS(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000171419941 565430454 /nfs/dbraw/zinc/43/04/54/565430454.db2.gz BSRBAHFTSMSNIL-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN C[C@@H](C1CC1)N(C1CC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000171417959 565430743 /nfs/dbraw/zinc/43/07/43/565430743.db2.gz NBSXZIQGUSSQRE-VIFPVBQESA-N 0 0 389.271 3.309 20 5 GGBDRN O=[N+]([O-])c1cccc(CNS(=O)(=O)c2ccc(F)cc2C(F)(F)F)c1 ZINC000171423343 565430802 /nfs/dbraw/zinc/43/08/02/565430802.db2.gz PMKNLJJPPOAKBM-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC([C@H]2CCOC2)CC1 ZINC000376350378 565432070 /nfs/dbraw/zinc/43/20/70/565432070.db2.gz IHMQKOJRXHSXQP-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC3CCOCC3)cc2[N+](=O)[O-])n1 ZINC000298871023 565432289 /nfs/dbraw/zinc/43/22/89/565432289.db2.gz RCDUHDFECKQQJB-UHFFFAOYSA-N 0 0 379.463 3.420 20 5 GGBDRN CC(C)n1ncc2c1[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])CCC2 ZINC000376365402 565433551 /nfs/dbraw/zinc/43/35/51/565433551.db2.gz FWKLUFXSZLNABG-LLVKDONJSA-N 0 0 384.483 3.327 20 5 GGBDRN O=C(NCCCO[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1Br ZINC000298923532 565434083 /nfs/dbraw/zinc/43/40/83/565434083.db2.gz MMQWHLGVRLZVSZ-ZDUSSCGKSA-N 0 0 387.230 3.020 20 5 GGBDRN CSc1cccc(C(=O)N2CCC[C@](O)(C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000376397398 565434095 /nfs/dbraw/zinc/43/40/95/565434095.db2.gz ROEDPPQKBFCQGY-CQSZACIVSA-N 0 0 378.372 3.236 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CCOCC(F)(F)C(F)(F)F ZINC000188978698 565436778 /nfs/dbraw/zinc/43/67/78/565436778.db2.gz LQKDWEUARZVATM-UHFFFAOYSA-N 0 0 382.083 3.076 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1Br ZINC000171608306 565439445 /nfs/dbraw/zinc/43/94/45/565439445.db2.gz DARWRZXMXRLHLT-UHFFFAOYSA-N 0 0 381.230 3.476 20 5 GGBDRN CSCc1cccc(CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000189040995 565439695 /nfs/dbraw/zinc/43/96/95/565439695.db2.gz BCYRTRWJNGVTRX-UHFFFAOYSA-N 0 0 380.491 3.120 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H]1CCCC1=O ZINC000376526389 565440735 /nfs/dbraw/zinc/44/07/35/565440735.db2.gz HZJMTNQOWVIKNH-ZIAGYGMSSA-N 0 0 381.226 3.331 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCc2cnc(C)s2)c([N+](=O)[O-])c1 ZINC000299134970 565440909 /nfs/dbraw/zinc/44/09/09/565440909.db2.gz GKKLPJWHVOVYBU-UHFFFAOYSA-N 0 0 384.483 3.002 20 5 GGBDRN Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000276244181 565441117 /nfs/dbraw/zinc/44/11/17/565441117.db2.gz PWSWLJOHSXUVIB-GFCCVEGCSA-N 0 0 384.845 3.165 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCc3c(Br)cc(C)cc3C2)c1[N+](=O)[O-] ZINC000189061632 565441195 /nfs/dbraw/zinc/44/11/95/565441195.db2.gz HRHMIJILRVLTCK-UHFFFAOYSA-N 0 0 393.241 3.150 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC([C@@H]2CCCO2)CC1 ZINC000276255885 565442462 /nfs/dbraw/zinc/44/24/62/565442462.db2.gz MEUPSTPOKWFBIN-HNNXBMFYSA-N 0 0 383.242 3.389 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)c1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276333269 565445177 /nfs/dbraw/zinc/44/51/77/565445177.db2.gz RMTWIMCOVJTSGJ-UHFFFAOYSA-N 0 0 395.384 3.110 20 5 GGBDRN Cc1cc(N2CCC[C@@H](c3nncn3C)C2)c(Br)cc1[N+](=O)[O-] ZINC000276410577 565448223 /nfs/dbraw/zinc/44/82/23/565448223.db2.gz AUZRNCOMMJJQLP-LLVKDONJSA-N 0 0 380.246 3.178 20 5 GGBDRN C[C@@H](N[C@@H](C(N)=O)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000171758632 565449716 /nfs/dbraw/zinc/44/97/16/565449716.db2.gz RICYSDYHQIHKRV-MEBBXXQBSA-N 0 0 378.226 3.235 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)CCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000171804174 565451482 /nfs/dbraw/zinc/45/14/82/565451482.db2.gz ZRJGREITTSJIII-SNVBAGLBSA-N 0 0 395.257 3.394 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H]2CCc3c2cccc3Br)c1[N+](=O)[O-] ZINC000171808575 565451935 /nfs/dbraw/zinc/45/19/35/565451935.db2.gz NBWRWGODVCJPRI-LBPRGKRZSA-N 0 0 379.214 3.060 20 5 GGBDRN CN(Cc1nccs1)c1ccc(I)cc1[N+](=O)[O-] ZINC000301431559 565485760 /nfs/dbraw/zinc/48/57/60/565485760.db2.gz JXLVPDPMTPXIOD-UHFFFAOYSA-N 0 0 375.191 3.292 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H](C)Cc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000171805367 565452269 /nfs/dbraw/zinc/45/22/69/565452269.db2.gz XPKZAXVQPGFKAH-SNVBAGLBSA-N 0 0 395.257 3.394 20 5 GGBDRN Cc1cc(NC(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)no1 ZINC000299601559 565455885 /nfs/dbraw/zinc/45/58/85/565455885.db2.gz FKPXIRBGJQJEJI-UHFFFAOYSA-N 0 0 381.186 3.244 20 5 GGBDRN O=C(CC[C@H]1CCCO1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000299615523 565457085 /nfs/dbraw/zinc/45/70/85/565457085.db2.gz HAPZUGMBESSQFV-LLVKDONJSA-N 0 0 383.242 3.201 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000171967195 565460571 /nfs/dbraw/zinc/46/05/71/565460571.db2.gz UMUHAWFHJCVGKD-LBPRGKRZSA-N 0 0 386.788 3.189 20 5 GGBDRN C[C@@]1(CNC(=O)c2cccc([N+](=O)[O-])c2Br)CCO[C@@H]1C1CC1 ZINC000376983604 565461877 /nfs/dbraw/zinc/46/18/77/565461877.db2.gz VRPOWCGENFOPMR-ZBFHGGJFSA-N 0 0 383.242 3.292 20 5 GGBDRN C[C@@H](Oc1ccccc1Br)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000171992709 565461958 /nfs/dbraw/zinc/46/19/58/565461958.db2.gz ADCHYIDWOURAHS-LLVKDONJSA-N 0 0 379.210 3.441 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCOc1ccc(Br)cc1 ZINC000301080572 565462301 /nfs/dbraw/zinc/46/23/01/565462301.db2.gz HUWKVBKFDGQUCQ-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccc(O)cc3)CC2)c(Br)c1 ZINC000301063020 565462335 /nfs/dbraw/zinc/46/23/35/565462335.db2.gz CBFRHZLQTCQOOW-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN CNS(=O)(=O)c1ccc(Nc2cc(Cl)c(N)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000301066273 565462403 /nfs/dbraw/zinc/46/24/03/565462403.db2.gz QHZWOEWVZYBONI-UHFFFAOYSA-N 0 0 391.236 3.136 20 5 GGBDRN NS(=O)(=O)c1ccc(NCCc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000301101857 565463671 /nfs/dbraw/zinc/46/36/71/565463671.db2.gz ICDKVPMDIVZLDA-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN CNS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)s1 ZINC000301098890 565463719 /nfs/dbraw/zinc/46/37/19/565463719.db2.gz XHPNKYPOBAPSBT-UHFFFAOYSA-N 0 0 395.384 3.195 20 5 GGBDRN CC(C)(CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1)c1ccc(Cl)cc1 ZINC000301095523 565463779 /nfs/dbraw/zinc/46/37/79/565463779.db2.gz PIXQUKQXCDNBSI-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCSc2c(F)cccc21 ZINC000301086273 565463875 /nfs/dbraw/zinc/46/38/75/565463875.db2.gz MVOUQEITZFPIBB-GFCCVEGCSA-N 0 0 383.426 3.030 20 5 GGBDRN CN(CCc1ccccn1)c1ccc(I)cc1[N+](=O)[O-] ZINC000301095653 565463921 /nfs/dbraw/zinc/46/39/21/565463921.db2.gz NEGJZAXYVNUUDN-UHFFFAOYSA-N 0 0 383.189 3.273 20 5 GGBDRN CCOC1CC(CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000276856969 565464327 /nfs/dbraw/zinc/46/43/27/565464327.db2.gz JLGJCABUWVPYTP-UHFFFAOYSA-N 0 0 389.221 3.431 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC2(c3cccc(Br)c3)CC2)c1[N+](=O)[O-] ZINC000172084099 565464448 /nfs/dbraw/zinc/46/44/48/565464448.db2.gz SHUURVHYBPGMLC-UHFFFAOYSA-N 0 0 393.241 3.104 20 5 GGBDRN CS(=O)(=O)c1ccc(CNc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000301115827 565464856 /nfs/dbraw/zinc/46/48/56/565464856.db2.gz QPBXJFNIWAEXLR-UHFFFAOYSA-N 0 0 385.239 3.373 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(F)cc1Br ZINC000301104302 565464870 /nfs/dbraw/zinc/46/48/70/565464870.db2.gz SRHDSWMWNCADJC-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN CNc1ccc(Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000301106763 565464995 /nfs/dbraw/zinc/46/49/95/565464995.db2.gz RLTRBWOSUWCZIQ-UHFFFAOYSA-N 0 0 376.316 3.069 20 5 GGBDRN O=C(NCCNc1ccc(F)cc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000301116502 565465189 /nfs/dbraw/zinc/46/51/89/565465189.db2.gz KZWCFGPIDHZPGJ-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(OC)c(Br)c1 ZINC000301137974 565466233 /nfs/dbraw/zinc/46/62/33/565466233.db2.gz DVAPFDDTEXWPAW-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN CCn1c(Sc2ncc([N+](=O)[O-])c(N)n2)nnc1-c1ccc(Cl)cc1 ZINC000301142666 565466997 /nfs/dbraw/zinc/46/69/97/565466997.db2.gz CTBVHISTMPRRGZ-UHFFFAOYSA-N 0 0 377.817 3.050 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCOC[C@@H]1c1nc2ccccc2s1 ZINC000377121473 565467298 /nfs/dbraw/zinc/46/72/98/565467298.db2.gz VBGVBEBETWMIDP-GFCCVEGCSA-N 0 0 375.431 3.480 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NC1CCN(c2cccnn2)CC1 ZINC000276937580 565467949 /nfs/dbraw/zinc/46/79/49/565467949.db2.gz AKIJBZYNLSNWLK-UHFFFAOYSA-N 0 0 378.230 3.228 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CN(C)c1ncc([N+](=O)[O-])cc1C ZINC000301158050 565468333 /nfs/dbraw/zinc/46/83/33/565468333.db2.gz NYDMDNCXQJLWAD-UHFFFAOYSA-N 0 0 393.241 3.444 20 5 GGBDRN Cc1cc(N2CCn3c(Br)cnc3C2)c2cccc([N+](=O)[O-])c2n1 ZINC000377180686 565469078 /nfs/dbraw/zinc/46/90/78/565469078.db2.gz WLZGTUQGVFWTQE-UHFFFAOYSA-N 0 0 388.225 3.431 20 5 GGBDRN Cc1cccc(Nc2nnc(Sc3ncc([N+](=O)[O-])c(N)n3)s2)c1C ZINC000301172671 565469435 /nfs/dbraw/zinc/46/94/35/565469435.db2.gz VGDMFZWKVVXZHE-UHFFFAOYSA-N 0 0 375.439 3.330 20 5 GGBDRN COc1ccc(C(=O)NCCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000172177767 565470243 /nfs/dbraw/zinc/47/02/43/565470243.db2.gz KUSHABFEAJTXBJ-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCCN(CC(F)(F)F)CC1 ZINC000301192062 565470296 /nfs/dbraw/zinc/47/02/96/565470296.db2.gz SFPNNDPHTKMAGB-UHFFFAOYSA-N 0 0 382.180 3.432 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301188632 565470770 /nfs/dbraw/zinc/47/07/70/565470770.db2.gz LDVCWUJIPCZKLS-LLVKDONJSA-N 0 0 386.246 3.461 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1NC1CCN(c2cccnn2)CC1 ZINC000277003153 565471473 /nfs/dbraw/zinc/47/14/73/565471473.db2.gz IERACTAJIZCLDY-UHFFFAOYSA-N 0 0 378.230 3.228 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1NCCCNC(=O)c1ccc(Br)cc1 ZINC000301206979 565471806 /nfs/dbraw/zinc/47/18/06/565471806.db2.gz TWQVVZYOBCBEIG-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN CNC(=O)c1ccc(N(C)CCc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000301198931 565471980 /nfs/dbraw/zinc/47/19/80/565471980.db2.gz PGOXCCOKEYILCX-UHFFFAOYSA-N 0 0 392.253 3.396 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301205979 565472064 /nfs/dbraw/zinc/47/20/64/565472064.db2.gz ZAHTWZWUYPUZKX-GFCCVEGCSA-N 0 0 384.274 3.490 20 5 GGBDRN CNC(=O)c1ccc(NCc2ccc(Br)cc2F)c([N+](=O)[O-])c1 ZINC000301227121 565473281 /nfs/dbraw/zinc/47/32/81/565473281.db2.gz CGRJMXCTGHRFHM-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCc2ccc(Br)cc2)cc1 ZINC000172260768 565474617 /nfs/dbraw/zinc/47/46/17/565474617.db2.gz OKIMRPVWFPGSPC-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN C[C@H](O)CNC(=O)c1cccc(Oc2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000301265276 565475495 /nfs/dbraw/zinc/47/54/95/565475495.db2.gz FCKRFJOGRSNFGL-JTQLQIEISA-N 0 0 395.209 3.260 20 5 GGBDRN C[C@@H]1CSCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000277110987 565476495 /nfs/dbraw/zinc/47/64/95/565476495.db2.gz RLLQHBLYBNOWNE-QMMMGPOBSA-N 0 0 377.235 3.322 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC(c2ccccc2Br)CC1 ZINC000189580760 565476648 /nfs/dbraw/zinc/47/66/48/565476648.db2.gz ZRXFBYNHDIBOHL-UHFFFAOYSA-N 0 0 393.241 3.111 20 5 GGBDRN C[C@H]1SCCN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000301275538 565476922 /nfs/dbraw/zinc/47/69/22/565476922.db2.gz IOVYVVXDUDONHQ-DTWKUNHWSA-N 0 0 384.401 3.219 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000277118032 565476970 /nfs/dbraw/zinc/47/69/70/565476970.db2.gz FFZSYOMGWGMKDA-JTQLQIEISA-N 0 0 379.214 3.100 20 5 GGBDRN CNC(=O)c1ccc(NC[C@@H](O)c2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000301304415 565477673 /nfs/dbraw/zinc/47/76/73/565477673.db2.gz XHBJHOACQDOBKA-OAHLLOKOSA-N 0 0 384.219 3.407 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCCC[C@@H]1c1ncon1 ZINC000189610972 565477780 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O=C(NCCNc1ccc([N+](=O)[O-])cc1Br)c1ccccc1F ZINC000301351470 565480741 /nfs/dbraw/zinc/48/07/41/565480741.db2.gz IZDFOUBZLHGDGW-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NC[C@@H](O)c1ccsc1 ZINC000301345779 565480839 /nfs/dbraw/zinc/48/08/39/565480839.db2.gz GULBMMWOFFCUTJ-GFCCVEGCSA-N 0 0 396.368 3.095 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(c1ccc([N+](=O)[O-])cc1Br)CC2 ZINC000301391748 565482530 /nfs/dbraw/zinc/48/25/30/565482530.db2.gz HOPRQNXODKOEPQ-CABCVRRESA-N 0 0 385.258 3.114 20 5 GGBDRN O=C(NCCOc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1Br ZINC000172378745 565482761 /nfs/dbraw/zinc/48/27/61/565482761.db2.gz OBORXUXJWVAJFL-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN CCCCNC(=O)C1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000301378884 565482879 /nfs/dbraw/zinc/48/28/79/565482879.db2.gz ZCFSHWABUQMHIS-UHFFFAOYSA-N 0 0 384.274 3.490 20 5 GGBDRN CS(=O)(=O)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301396756 565483604 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CO[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000301643691 565502419 /nfs/dbraw/zinc/50/24/19/565502419.db2.gz CAFMCHPFXURYFV-MRXNPFEDSA-N 0 0 384.841 3.451 20 5 GGBDRN O=C(c1ccccn1)N1CC[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301672344 565503261 /nfs/dbraw/zinc/50/32/61/565503261.db2.gz OTGDOWNCHKRLFL-LBPRGKRZSA-N 0 0 391.225 3.079 20 5 GGBDRN CCc1ccccc1NC(=O)CN(C)c1ncc(Br)cc1[N+](=O)[O-] ZINC000301677888 565503280 /nfs/dbraw/zinc/50/32/80/565503280.db2.gz IGEGFYBIWVEFDR-UHFFFAOYSA-N 0 0 393.241 3.390 20 5 GGBDRN Cc1nc(CCNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])sc1C ZINC000301674973 565503298 /nfs/dbraw/zinc/50/32/98/565503298.db2.gz PSRHPBAZJNBYNU-UHFFFAOYSA-N 0 0 391.421 3.319 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNc1ncc(Br)cc1[N+](=O)[O-] ZINC000301666357 565503447 /nfs/dbraw/zinc/50/34/47/565503447.db2.gz CFWKXAKGJGSWQV-UHFFFAOYSA-N 0 0 379.214 3.420 20 5 GGBDRN O=C(c1ccccn1)N1CC[C@@H](Nc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301672343 565503474 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O=[N+]([O-])c1cc(Br)cnc1N1CCN(c2ccc(Cl)cn2)CC1 ZINC000301681686 565504932 /nfs/dbraw/zinc/50/49/32/565504932.db2.gz JVLVEAOGGLIXQY-UHFFFAOYSA-N 0 0 398.648 3.127 20 5 GGBDRN C[C@@H]1CN(C(C)(C)CNc2ncc(Br)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000301694736 565506102 /nfs/dbraw/zinc/50/61/02/565506102.db2.gz PBNQCEJOAPMZMB-GHMZBOCLSA-N 0 0 387.278 3.052 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cc(F)cc(F)c1Br ZINC000190077611 565506330 /nfs/dbraw/zinc/50/63/30/565506330.db2.gz PSKIOMADICBHPY-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN CC(C)(C)C(=O)NC[C@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000301714617 565506499 /nfs/dbraw/zinc/50/64/99/565506499.db2.gz ZKVHRJVILWDRMR-LLVKDONJSA-N 0 0 399.289 3.131 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1N1CCC([C@H](O)C(F)(F)F)CC1 ZINC000301721907 565506939 /nfs/dbraw/zinc/50/69/39/565506939.db2.gz QYJLQGJBZDKMKQ-LBPRGKRZSA-N 0 0 383.164 3.497 20 5 GGBDRN Nn1c(Sc2ccc(Br)cc2[N+](=O)[O-])nnc1-c1ccco1 ZINC000301717551 565507204 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Cc1cccc([N+](=O)[O-])c1NCCNS(=O)(=O)c1ccc(Cl)s1 ZINC000301804904 565510508 /nfs/dbraw/zinc/51/05/08/565510508.db2.gz VDICNPUKCHFQML-UHFFFAOYSA-N 0 0 375.859 3.009 20 5 GGBDRN O=C1CC[C@@H]2CN(c3ccc(Br)cc3[N+](=O)[O-])CC[C@@H]2N1C1CC1 ZINC000301808986 565510584 /nfs/dbraw/zinc/51/05/84/565510584.db2.gz GJFMOWWHJDQNLS-RISCZKNCSA-N 0 0 394.269 3.337 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccc(F)cc2O1 ZINC000172897871 565511050 /nfs/dbraw/zinc/51/10/50/565511050.db2.gz MEEBKRLUJZXDKQ-SECBINFHSA-N 0 0 386.788 3.364 20 5 GGBDRN CN(C)c1cccc(CNc2ccc(I)cc2[N+](=O)[O-])n1 ZINC000301826371 565511753 /nfs/dbraw/zinc/51/17/53/565511753.db2.gz JEDQOTLDRNRTKE-UHFFFAOYSA-N 0 0 398.204 3.273 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCc1ccc(N2CCCC2)nc1 ZINC000301829820 565511892 /nfs/dbraw/zinc/51/18/92/565511892.db2.gz HBBFONKDKPJSTB-UHFFFAOYSA-N 0 0 378.230 3.360 20 5 GGBDRN CN(C)C(=O)c1ccc(CNc2c(Br)cncc2[N+](=O)[O-])cc1 ZINC000301846271 565513253 /nfs/dbraw/zinc/51/32/53/565513253.db2.gz 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O=[N+]([O-])c1ncccc1Oc1ncnc2ccc(I)cc21 ZINC000172972309 565517105 /nfs/dbraw/zinc/51/71/05/565517105.db2.gz VUSAAXGHFMMNMO-UHFFFAOYSA-N 0 0 394.128 3.330 20 5 GGBDRN CS(=O)(=O)c1cccc(Sc2nnc(-c3ccccc3)o2)c1[N+](=O)[O-] ZINC000301884620 565517013 /nfs/dbraw/zinc/51/70/13/565517013.db2.gz JNKZROAREDEJHQ-UHFFFAOYSA-N 0 0 377.403 3.200 20 5 GGBDRN CC(C)(C)c1nc(CCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cs1 ZINC000301892897 565517052 /nfs/dbraw/zinc/51/70/52/565517052.db2.gz OSDQOZRSYSQQTK-UHFFFAOYSA-N 0 0 383.495 3.407 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)n1 ZINC000190236490 565517391 /nfs/dbraw/zinc/51/73/91/565517391.db2.gz LFIHFIKOBYIAID-SNVBAGLBSA-N 0 0 381.435 3.267 20 5 GGBDRN CCNC(=O)c1ccc(CNc2c(Br)cncc2[N+](=O)[O-])cc1 ZINC000301900900 565517390 /nfs/dbraw/zinc/51/73/90/565517390.db2.gz VDEAKRYUEUSCKH-UHFFFAOYSA-N 0 0 379.214 3.114 20 5 GGBDRN CS(=O)(=O)c1cccc(N2CCc3ccc(Br)cc32)c1[N+](=O)[O-] ZINC000301906762 565517477 /nfs/dbraw/zinc/51/74/77/565517477.db2.gz ZIHRZPIPQFSFQV-UHFFFAOYSA-N 0 0 397.250 3.455 20 5 GGBDRN NS(=O)(=O)c1cc(NCC2(c3ccccc3Cl)CC2)cc([N+](=O)[O-])c1 ZINC000301915621 565517697 /nfs/dbraw/zinc/51/76/97/565517697.db2.gz VLRNKSXEAJMUAF-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN Cc1cn2c(n1)[C@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)CCC2 ZINC000378244458 565517831 /nfs/dbraw/zinc/51/78/31/565517831.db2.gz PXDCDXNGGKRCGL-NSHDSACASA-N 0 0 393.241 3.170 20 5 GGBDRN Cn1cc(C(=O)C[C@@H]2CCCN2c2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000301915706 565517951 /nfs/dbraw/zinc/51/79/51/565517951.db2.gz GMZZGQQWUGOUQL-ZDUSSCGKSA-N 0 0 393.241 3.333 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000301932624 565518538 /nfs/dbraw/zinc/51/85/38/565518538.db2.gz PLIMMMZLFXQVNY-KRWDZBQOSA-N 0 0 390.237 3.431 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301931456 565519158 /nfs/dbraw/zinc/51/91/58/565519158.db2.gz LOYKOVAQPJREKS-GWCFXTLKSA-N 0 0 376.500 3.313 20 5 GGBDRN NS(=O)(=O)c1ccc(NCC2(c3ccccc3Cl)CC2)c([N+](=O)[O-])c1 ZINC000301924469 565519175 /nfs/dbraw/zinc/51/91/75/565519175.db2.gz YLCODPHCPWUTTH-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN CCOC[C@H]1CCCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])C1 ZINC000277788543 565519538 /nfs/dbraw/zinc/51/95/38/565519538.db2.gz UYPYACJCWUKIDR-VIFPVBQESA-N 0 0 377.260 3.308 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@@H](O)c2cc3ccccc3s2)s1 ZINC000301933870 565519751 /nfs/dbraw/zinc/51/97/51/565519751.db2.gz NSKBPWYJUACPIC-LLVKDONJSA-N 0 0 398.487 3.420 20 5 GGBDRN Cc1ncsc1CN(C)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000277776754 565519820 /nfs/dbraw/zinc/51/98/20/565519820.db2.gz SYIROJKIFGTADT-UHFFFAOYSA-N 0 0 376.257 3.456 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(C)c(Br)c2)no1 ZINC000277777743 565519861 /nfs/dbraw/zinc/51/98/61/565519861.db2.gz FAYHXIHZNNGMBG-UHFFFAOYSA-N 0 0 392.213 3.463 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CC[C@@H](C2CCOCC2)C1 ZINC000378293243 565519936 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O=C(CCOCC(F)(F)C(F)(F)F)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000190315874 565522091 /nfs/dbraw/zinc/52/20/91/565522091.db2.gz ANTGCPVVPHLVCL-UHFFFAOYSA-N 0 0 390.692 3.469 20 5 GGBDRN CC(C)[C@@](C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Br)cc1 ZINC000190330215 565522244 /nfs/dbraw/zinc/52/22/44/565522244.db2.gz GMXCLCYOELVPAH-MRXNPFEDSA-N 0 0 395.257 3.241 20 5 GGBDRN O=C(CNc1sccc1[N+](=O)[O-])N1CCN(c2ccc(Cl)cc2)CC1 ZINC000301987598 565522781 /nfs/dbraw/zinc/52/27/81/565522781.db2.gz KVXBCWVZIGZFQY-UHFFFAOYSA-N 0 0 380.857 3.070 20 5 GGBDRN C[C@@H]1CC(Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000301981268 565523128 /nfs/dbraw/zinc/52/31/28/565523128.db2.gz XYDKSWFAOPFTIP-RKDXNWHRSA-N 0 0 382.360 3.256 20 5 GGBDRN CC(C)[C@@](C)(NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000190334940 565523168 /nfs/dbraw/zinc/52/31/68/565523168.db2.gz SRFNPOPUGMARAW-OAHLLOKOSA-N 0 0 381.230 3.382 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCO[C@H](Cc2ccccc2)C1 ZINC000301992631 565524053 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Cc1nn(CCC(=O)NCc2cccc(C)c2Br)c(C)c1[N+](=O)[O-] ZINC000191731161 565626737 /nfs/dbraw/zinc/62/67/37/565626737.db2.gz LDMDNBMIYNADPS-UHFFFAOYSA-N 0 0 395.257 3.186 20 5 GGBDRN Cc1csc(NC(=O)CSc2ncc([N+](=O)[O-])cc2Br)n1 ZINC000409647316 565630130 /nfs/dbraw/zinc/63/01/30/565630130.db2.gz IFMZHNOAAFGVJA-UHFFFAOYSA-N 0 0 389.256 3.248 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2ccc(Cl)cc2I)s1 ZINC000409650845 565630355 /nfs/dbraw/zinc/63/03/55/565630355.db2.gz IHGKRHJCIFVYLY-UHFFFAOYSA-N 0 0 395.609 3.343 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2cnn(-c3ccc(Br)cc3)c2)s1 ZINC000409653086 565630555 /nfs/dbraw/zinc/63/05/55/565630555.db2.gz PBIWCNYABGIQIE-UHFFFAOYSA-N 0 0 380.227 3.034 20 5 GGBDRN C[S@@](=O)C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000174368734 565632515 /nfs/dbraw/zinc/63/25/15/565632515.db2.gz LGQQIEHSPLZPPZ-SGANQWHYSA-N 0 0 381.841 3.490 20 5 GGBDRN CC(C)(C)c1nnc(CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])s1 ZINC000279857973 565637264 /nfs/dbraw/zinc/63/72/64/565637264.db2.gz FLQQIYBZUQLCNG-UHFFFAOYSA-N 0 0 386.836 3.395 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(CCC(F)(F)F)CC(F)(F)F)c1[N+](=O)[O-] ZINC000279868007 565637281 /nfs/dbraw/zinc/63/72/81/565637281.db2.gz SSLSTIYMJDUFAL-UHFFFAOYSA-N 0 0 376.257 3.398 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000279885930 565638509 /nfs/dbraw/zinc/63/85/09/565638509.db2.gz FLYIQSLFJSUGEP-NSHDSACASA-N 0 0 394.225 3.399 20 5 GGBDRN COc1ccc(C)cc1CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000409856747 565644152 /nfs/dbraw/zinc/64/41/52/565644152.db2.gz XKFYZZCIKAAJRB-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(Br)c(OC)c2)c1[N+](=O)[O-] ZINC000174604833 565647047 /nfs/dbraw/zinc/64/70/47/565647047.db2.gz YYDAAKUBIXLLSJ-UHFFFAOYSA-N 0 0 383.202 3.294 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)sc1C ZINC000191979625 565647283 /nfs/dbraw/zinc/64/72/83/565647283.db2.gz RUQJMTNNVQIXNM-UHFFFAOYSA-N 0 0 383.495 3.499 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCC[C@@H](c3nccs3)C2)cc1[N+](=O)[O-] ZINC000191974511 565647812 /nfs/dbraw/zinc/64/78/12/565647812.db2.gz HLXSJDIOIJAJHW-CYBMUJFWSA-N 0 0 381.479 3.236 20 5 GGBDRN Cc1c(NC(=O)NCCCCn2cc(Br)cn2)cccc1[N+](=O)[O-] ZINC000280029119 565648271 /nfs/dbraw/zinc/64/82/71/565648271.db2.gz NBJLKPDYHUIQNS-UHFFFAOYSA-N 0 0 396.245 3.464 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000280092229 565651619 /nfs/dbraw/zinc/65/16/19/565651619.db2.gz QVTHJCVWYVOKGH-SECBINFHSA-N 0 0 395.213 3.227 20 5 GGBDRN C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCS1(=O)=O ZINC000192051595 565653268 /nfs/dbraw/zinc/65/32/68/565653268.db2.gz XQFIQSZOUUHOCZ-ZDUSSCGKSA-N 0 0 380.491 3.332 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000174739052 565654937 /nfs/dbraw/zinc/65/49/37/565654937.db2.gz HYDJNYZSBFIYBK-XJKSGUPXSA-N 0 0 385.251 3.296 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc(Br)c1F ZINC000192084869 565656284 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O=C(Cn1c(=O)oc2cc(F)c(Br)cc21)c1cccc([N+](=O)[O-])c1 ZINC000192498506 565696433 /nfs/dbraw/zinc/69/64/33/565696433.db2.gz XEILEFKOZJHQOM-UHFFFAOYSA-N 0 0 395.140 3.287 20 5 GGBDRN C[S@@](=O)C1(CNc2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000280806782 565696638 /nfs/dbraw/zinc/69/66/38/565696638.db2.gz SOJCEBQKCYIZSH-RUZDIDTESA-N 0 0 381.332 3.235 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000192530430 565698407 /nfs/dbraw/zinc/69/84/07/565698407.db2.gz VKBIQFKSBPAZOX-JTQLQIEISA-N 0 0 389.239 3.278 20 5 GGBDRN NC(=O)c1ccc(COc2cc(Br)cc(F)c2F)c([N+](=O)[O-])c1 ZINC000192563479 565699612 /nfs/dbraw/zinc/69/96/12/565699612.db2.gz HXXGZNSXVKVJIU-UHFFFAOYSA-N 0 0 387.136 3.313 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000192548915 565699645 /nfs/dbraw/zinc/69/96/45/565699645.db2.gz NQADQVDBZHUVGI-CQSZACIVSA-N 0 0 395.257 3.460 20 5 GGBDRN Cc1[nH]nc2ncc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)cc12 ZINC000175434618 565699946 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379.214 3.100 20 5 GGBDRN CCCc1nc(C[S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 ZINC000283985833 565838876 /nfs/dbraw/zinc/83/88/76/565838876.db2.gz YDIVBGVPLAZDEZ-VWLOTQADSA-N 0 0 381.479 3.281 20 5 GGBDRN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1ccccc1Br ZINC000177256174 565838958 /nfs/dbraw/zinc/83/89/58/565838958.db2.gz WESNQWVRQQGFKO-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN C[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])Oc1ccccc1Br ZINC000177264946 565839846 /nfs/dbraw/zinc/83/98/46/565839846.db2.gz JHQNLKKHJHHJSP-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN COc1ccc2c(c1)[nH]nc2NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000194825351 565840624 /nfs/dbraw/zinc/84/06/24/565840624.db2.gz ZCUIFRAMTXQQNS-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN CC[C@@H]1C[C@H](C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CCO1 ZINC000284068548 565841039 /nfs/dbraw/zinc/84/10/39/565841039.db2.gz LTDBHAVRYVFRRX-VXGBXAGGSA-N 0 0 397.269 3.447 20 5 GGBDRN CC[C@H](Cc1cccc(Br)c1)C(=O)Nc1c([N+](=O)[O-])cnn1C ZINC000194834883 565841584 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CON1CCC(N(C)c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC1 ZINC000413364208 565848207 /nfs/dbraw/zinc/84/82/07/565848207.db2.gz NVHIXEYQZIRIEG-UHFFFAOYSA-N 0 0 395.257 3.368 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cc2c(c(Br)c1)OCO2 ZINC000194952456 565849060 /nfs/dbraw/zinc/84/90/60/565849060.db2.gz ZAYCKHXNNDFGPH-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN COc1cc(C(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)c([N+](=O)[O-])cc1OC ZINC000284328311 565849369 /nfs/dbraw/zinc/84/93/69/565849369.db2.gz BPKCFAQSKXIOLH-DZGCQCFKSA-N 0 0 389.235 3.268 20 5 GGBDRN Cc1c(Br)c(N(Cc2cnn(C)c2)CC(C)C)ncc1[N+](=O)[O-] ZINC000413382044 565849485 /nfs/dbraw/zinc/84/94/85/565849485.db2.gz VMKUBVACVCNMDO-UHFFFAOYSA-N 0 0 382.262 3.457 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)c(OS(=O)(=O)CCC(F)(F)F)c1 ZINC000284338621 565850326 /nfs/dbraw/zinc/85/03/26/565850326.db2.gz PJGBSKGXLBVWPQ-UHFFFAOYSA-N 0 0 378.122 3.018 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000284360499 565850333 /nfs/dbraw/zinc/85/03/33/565850333.db2.gz DJLXJUDKBZQSHZ-DZGCQCFKSA-N 0 0 388.251 3.058 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCN(c2nccs2)CC1 ZINC000194974973 565850888 /nfs/dbraw/zinc/85/08/88/565850888.db2.gz DPIDKXQEIGBXGM-UHFFFAOYSA-N 0 0 381.845 3.449 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284422480 565852679 /nfs/dbraw/zinc/85/26/79/565852679.db2.gz ISWUVXURXZHXOC-OCCSQVGLSA-N 0 0 388.207 3.467 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC2(CCOCC2)CC1 ZINC000284424338 565853775 /nfs/dbraw/zinc/85/37/75/565853775.db2.gz IVTPXWRDWMBUSC-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN COCC1(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CCC1 ZINC000284469108 565855066 /nfs/dbraw/zinc/85/50/66/565855066.db2.gz LUEZANJANGYQIC-UHFFFAOYSA-N 0 0 383.242 3.059 20 5 GGBDRN Cc1c(Br)c(N2C[C@@H](O)C[C@H]2c2ccccc2)ncc1[N+](=O)[O-] ZINC000413501964 565855599 /nfs/dbraw/zinc/85/55/99/565855599.db2.gz MLADXWQFJCZEKM-STQMWFEESA-N 0 0 378.226 3.373 20 5 GGBDRN O=[N+]([O-])c1cn(Cc2nnc(-c3ccc(Br)o3)o2)nc1C1CC1 ZINC000195049809 565855919 /nfs/dbraw/zinc/85/59/19/565855919.db2.gz YPLMTEXVRGQKNF-UHFFFAOYSA-N 0 0 380.158 3.123 20 5 GGBDRN C[C@@H](NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1csnn1 ZINC000413508319 565857070 /nfs/dbraw/zinc/85/70/70/565857070.db2.gz XJGLOKPFKLPXAI-SSDOTTSWSA-N 0 0 375.332 3.026 20 5 GGBDRN CSc1ccc(C(=O)N2CCCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000195100982 565857892 /nfs/dbraw/zinc/85/78/92/565857892.db2.gz RZCMFRPBHGYMNZ-UHFFFAOYSA-N 0 0 378.479 3.126 20 5 GGBDRN C[C@H]1C[C@@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])CS1 ZINC000413525691 565858274 /nfs/dbraw/zinc/85/82/74/565858274.db2.gz YVMNJOMFAZGRMH-QWHCGFSZSA-N 0 0 385.511 3.075 20 5 GGBDRN O=C1CCCC[C@H]1[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000177620671 565863091 /nfs/dbraw/zinc/86/30/91/565863091.db2.gz BGXGAKJHXUKMRT-QWHCGFSZSA-N 0 0 386.857 3.161 20 5 GGBDRN CN(Cc1ccc([S@](C)=O)cc1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000177649353 565864338 /nfs/dbraw/zinc/86/43/38/565864338.db2.gz FQTPKKHHJNWIII-VWLOTQADSA-N 0 0 380.853 3.187 20 5 GGBDRN O=C(Nc1ncc(F)cc1I)c1csc([N+](=O)[O-])c1 ZINC000177662762 565865247 /nfs/dbraw/zinc/86/52/47/565865247.db2.gz RACGEEXNMYRNQK-UHFFFAOYSA-N 0 0 393.137 3.047 20 5 GGBDRN O=C(CCc1cscn1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284681026 565866072 /nfs/dbraw/zinc/86/60/72/565866072.db2.gz XXZCVONQPRXEML-UHFFFAOYSA-N 0 0 396.266 3.331 20 5 GGBDRN CSc1ccc(C(=O)N(C)Cc2ccc([S@@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000177682589 565866651 /nfs/dbraw/zinc/86/66/51/565866651.db2.gz GFCFDPOMRYMVNQ-RUZDIDTESA-N 0 0 378.475 3.326 20 5 GGBDRN Cc1c(Cl)cc(NC(=O)C(=O)NCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000195248742 565869660 /nfs/dbraw/zinc/86/96/60/565869660.db2.gz KCGSKQYQXBSHQR-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000284808861 565871600 /nfs/dbraw/zinc/87/16/00/565871600.db2.gz WSTUUBPAQVBQQE-ZFWWWQNUSA-N 0 0 383.242 3.449 20 5 GGBDRN Cc1noc(C(C)(C)NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000284828903 565872507 /nfs/dbraw/zinc/87/25/07/565872507.db2.gz JCPLKGWERNWKPH-UHFFFAOYSA-N 0 0 383.202 3.022 20 5 GGBDRN Cc1nc(C)c(-c2csc(NC(=O)CCn3cc([N+](=O)[O-])cn3)n2)s1 ZINC000195303197 565874031 /nfs/dbraw/zinc/87/40/31/565874031.db2.gz IOGGCIOEZUZTNI-UHFFFAOYSA-N 0 0 378.439 3.017 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000177829743 565875383 /nfs/dbraw/zinc/87/53/83/565875383.db2.gz NTSWINLMYQBCLA-VIFPVBQESA-N 0 0 381.841 3.304 20 5 GGBDRN COc1c(C)cnc(CN(C)c2ncc(Br)cc2[N+](=O)[O-])c1C ZINC000177821992 565875582 /nfs/dbraw/zinc/87/55/82/565875582.db2.gz FNPLICCXZSJASW-UHFFFAOYSA-N 0 0 381.230 3.409 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1Nc1cnn(Cc2ccccn2)c1 ZINC000177823154 565875709 /nfs/dbraw/zinc/87/57/09/565875709.db2.gz JDACPBRLFVNLFP-UHFFFAOYSA-N 0 0 375.186 3.136 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccoc1Br ZINC000195318908 565875792 /nfs/dbraw/zinc/87/57/92/565875792.db2.gz BOPVUHCUQXQMRI-UHFFFAOYSA-N 0 0 383.154 3.364 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cc(I)c[nH]2)cc1[N+](=O)[O-] ZINC000177847359 565876105 /nfs/dbraw/zinc/87/61/05/565876105.db2.gz YUGDNXAPDTUSTH-VIFPVBQESA-N 0 0 399.188 3.327 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ncccc1Br ZINC000195329834 565876856 /nfs/dbraw/zinc/87/68/56/565876856.db2.gz UHWCRRZTQKTSAB-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H](C)c1ccccc1Br ZINC000195350416 565877633 /nfs/dbraw/zinc/87/76/33/565877633.db2.gz BSGMDMMANPPYTF-LLVKDONJSA-N 0 0 395.257 3.472 20 5 GGBDRN CCc1n[nH]c(C(=O)N(C)[C@H](C)c2ccccc2Br)c1[N+](=O)[O-] ZINC000195413270 565881505 /nfs/dbraw/zinc/88/15/05/565881505.db2.gz ZEKQLJLGLXNNIA-SECBINFHSA-N 0 0 381.230 3.476 20 5 GGBDRN CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000177943519 565882241 /nfs/dbraw/zinc/88/22/41/565882241.db2.gz IXPWZBHAMAAYFI-UHFFFAOYSA-N 0 0 386.239 3.330 20 5 GGBDRN CO[C@@](C)([C@H](C)NC(=O)c1sc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000413960749 565883335 /nfs/dbraw/zinc/88/33/35/565883335.db2.gz QXIHBLVCYJOWHU-CPFSXVBKSA-N 0 0 377.260 3.352 20 5 GGBDRN CCOc1cc(Br)c(NC(=O)c2cc([N+](=O)[O-])n[nH]2)cc1OCC ZINC000285054866 565885899 /nfs/dbraw/zinc/88/58/99/565885899.db2.gz HXSWLLBRQRRKQV-UHFFFAOYSA-N 0 0 399.201 3.130 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC(OC2CCCC2)CC1 ZINC000195481297 565886778 /nfs/dbraw/zinc/88/67/78/565886778.db2.gz DVGKIFBMDNOHOL-UHFFFAOYSA-N 0 0 388.873 3.361 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCc2c(Br)cccc2C1 ZINC000195481722 565887481 /nfs/dbraw/zinc/88/74/81/565887481.db2.gz XQEXPZCXJJWCHD-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN O=[N+]([O-])c1cnc(NCCc2ccc(I)s2)s1 ZINC000195512790 565888780 /nfs/dbraw/zinc/88/87/80/565888780.db2.gz GMCMSZRHRFTPBZ-UHFFFAOYSA-N 0 0 381.220 3.372 20 5 GGBDRN O=C(Nc1cc(Cl)ccc1O)C1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000195509605 565889096 /nfs/dbraw/zinc/88/90/96/565889096.db2.gz 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CC(C)(C)OC(=O)N[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000199803684 565894195 /nfs/dbraw/zinc/89/41/95/565894195.db2.gz HTTDOKLQNHIHTC-SNVBAGLBSA-N 0 0 386.246 3.461 20 5 GGBDRN O=C(NCc1nccs1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000285232177 565896216 /nfs/dbraw/zinc/89/62/16/565896216.db2.gz CPNXHLBWYLGERK-UHFFFAOYSA-N 0 0 397.254 3.082 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)c2nccn2-c2cccc(Cl)c2)c1 ZINC000178113346 565897484 /nfs/dbraw/zinc/89/74/84/565897484.db2.gz STZYBAISIBIZEI-UHFFFAOYSA-N 0 0 377.809 3.408 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NC[C@@H](O)c1ccsc1 ZINC000218906453 565902260 /nfs/dbraw/zinc/90/22/60/565902260.db2.gz MMXBCZOGJOBBRQ-GFCCVEGCSA-N 0 0 390.202 3.406 20 5 GGBDRN CCCN1CC(=O)N[C@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000414214626 565904232 /nfs/dbraw/zinc/90/42/32/565904232.db2.gz SQKASGCRNYPFEN-MRXNPFEDSA-N 0 0 394.225 3.458 20 5 GGBDRN Cc1cnc(OCC(=O)Nc2ccc(Br)cc2C)c([N+](=O)[O-])c1 ZINC000178280108 565909607 /nfs/dbraw/zinc/90/96/07/565909607.db2.gz HCWFDJVKGZFUDV-UHFFFAOYSA-N 0 0 380.198 3.387 20 5 GGBDRN Cc1nnc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1C1CC1 ZINC000285506326 565911400 /nfs/dbraw/zinc/91/14/00/565911400.db2.gz VBTLAEXTOWKKDQ-UHFFFAOYSA-N 0 0 380.202 3.153 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@]1(C)CCCO ZINC000285531616 565912867 /nfs/dbraw/zinc/91/28/67/565912867.db2.gz HIEWAEVPCWVXJK-INIZCTEOSA-N 0 0 385.258 3.433 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@@H](O)C(C)C)cc2[N+](=O)[O-])n1 ZINC000178366309 565914949 /nfs/dbraw/zinc/91/49/49/565914949.db2.gz OBMNEEQQBLNFNP-CYBMUJFWSA-N 0 0 381.479 3.258 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@H](O)C(C)C)cc2[N+](=O)[O-])n1 ZINC000178366294 565915004 /nfs/dbraw/zinc/91/50/04/565915004.db2.gz OBMNEEQQBLNFNP-ZDUSSCGKSA-N 0 0 381.479 3.258 20 5 GGBDRN C[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1cc(F)c(Cl)cc1Cl ZINC000178419050 565916823 /nfs/dbraw/zinc/91/68/23/565916823.db2.gz RNQKTBZMOPSGOU-MRVPVSSYSA-N 0 0 390.202 3.298 20 5 GGBDRN CCC(CC)[C@@H](O)CNc1ccc(I)cc1[N+](=O)[O-] ZINC000225749793 565916979 /nfs/dbraw/zinc/91/69/79/565916979.db2.gz MIXSSFYWFBZGFK-ZDUSSCGKSA-N 0 0 378.210 3.408 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1cncc(Br)c1)C1CC1 ZINC000285636081 565917698 /nfs/dbraw/zinc/91/76/98/565917698.db2.gz FNNXYQRTCCTWFY-HNNXBMFYSA-N 0 0 391.225 3.216 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000285636084 565918204 /nfs/dbraw/zinc/91/82/04/565918204.db2.gz FNNXYQRTCCTWFY-OAHLLOKOSA-N 0 0 391.225 3.216 20 5 GGBDRN CCOC1CC2(C1)CCN(S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)C2 ZINC000285665734 565920697 /nfs/dbraw/zinc/92/06/97/565920697.db2.gz QBHQSJLBOFQZRS-UHFFFAOYSA-N 0 0 388.873 3.136 20 5 GGBDRN COCCn1c2ccc(Cl)cc2nc1SCCn1ccc([N+](=O)[O-])n1 ZINC000178475291 565920689 /nfs/dbraw/zinc/92/06/89/565920689.db2.gz FZDMIKVDQDHTRS-UHFFFAOYSA-N 0 0 381.845 3.233 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(CCCO)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000414390308 565922086 /nfs/dbraw/zinc/92/20/86/565922086.db2.gz WQWJFMIFUXELSR-UHFFFAOYSA-N 0 0 384.841 3.134 20 5 GGBDRN Cc1cccc(CCCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000285788220 565926785 /nfs/dbraw/zinc/92/67/85/565926785.db2.gz CYNJLXZYRRYIRN-UHFFFAOYSA-N 0 0 378.226 3.423 20 5 GGBDRN COc1cc(CS(=O)(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)ccc1Cl ZINC000414415605 565926991 /nfs/dbraw/zinc/92/69/91/565926991.db2.gz OXJQIMSXWAPZGK-UHFFFAOYSA-N 0 0 385.825 3.380 20 5 GGBDRN CCOc1cc(CS(=O)(=O)Cc2nnc(C(C)C)s2)ccc1[N+](=O)[O-] ZINC000414423416 565928930 /nfs/dbraw/zinc/92/89/30/565928930.db2.gz CZLZNKSJQRYDKK-UHFFFAOYSA-N 0 0 385.467 3.083 20 5 GGBDRN O=[N+]([O-])c1cc(CS(=O)(=O)Cc2sccc2Cl)c2c(c1)COCO2 ZINC000414424398 565928974 /nfs/dbraw/zinc/92/89/74/565928974.db2.gz LAJDJPOFCHEQGW-UHFFFAOYSA-N 0 0 389.838 3.291 20 5 GGBDRN CCC[C@H](CCO)CNc1ccc(I)cc1[N+](=O)[O-] ZINC000231149675 565931539 /nfs/dbraw/zinc/93/15/39/565931539.db2.gz ZRKCIDDINZPFEB-SNVBAGLBSA-N 0 0 378.210 3.410 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC(C)(C)c2ccccc2Br)c1[N+](=O)[O-] ZINC000178678717 565933095 /nfs/dbraw/zinc/93/30/95/565933095.db2.gz WLQIDBCFBMINNO-UHFFFAOYSA-N 0 0 395.257 3.350 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cnn1C ZINC000178710730 565933734 /nfs/dbraw/zinc/93/37/34/565933734.db2.gz HRQPHEXXMNMVPJ-SECBINFHSA-N 0 0 381.230 3.199 20 5 GGBDRN COCC[C@@H](NC(=O)c1[nH]nc(C)c1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000285932726 565933964 /nfs/dbraw/zinc/93/39/64/565933964.db2.gz VKQYFWZEDHKEIP-GFCCVEGCSA-N 0 0 387.223 3.441 20 5 GGBDRN O=[N+]([O-])c1ccc(SC[C@@H](O)COc2cccc(Br)c2)nc1 ZINC000178748176 565934828 /nfs/dbraw/zinc/93/48/28/565934828.db2.gz FZAUCBCPDANSFS-LBPRGKRZSA-N 0 0 385.239 3.284 20 5 GGBDRN Cc1nccn1C[C@H](C)CNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000178740399 565935655 /nfs/dbraw/zinc/93/56/55/565935655.db2.gz GGAPRVNTRYJOKC-SNVBAGLBSA-N 0 0 395.257 3.237 20 5 GGBDRN Cc1cc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1C[NH+](C)C ZINC000414464779 565937899 /nfs/dbraw/zinc/93/78/99/565937899.db2.gz OKYHZGBNXCRMNZ-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cc(C(N)=O)ccc2F)cc1[N+](=O)[O-] ZINC000178813264 565939051 /nfs/dbraw/zinc/93/90/51/565939051.db2.gz KAYGTILARNPYIH-UHFFFAOYSA-N 0 0 396.172 3.156 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3cnc4cnccn43)no2)c(Br)c1 ZINC000350852726 565941605 /nfs/dbraw/zinc/94/16/05/565941605.db2.gz PRVIWSDEBKWDRY-UHFFFAOYSA-N 0 0 387.153 3.117 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2ccn3ccnc3c2)cc1[N+](=O)[O-] ZINC000178849415 565941676 /nfs/dbraw/zinc/94/16/76/565941676.db2.gz FCHHZFPTPIYOSI-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN CCCS(=O)(=O)Cc1noc([C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000350843875 565941971 /nfs/dbraw/zinc/94/19/71/565941971.db2.gz VBCYHPLZNCJIJS-VIFPVBQESA-N 0 0 389.817 3.096 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(CSCc3cscn3)n2)c1 ZINC000350887580 565942682 /nfs/dbraw/zinc/94/26/82/565942682.db2.gz IEMNPMLLDLSHAB-UHFFFAOYSA-N 0 0 378.435 3.467 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2nc3c(s2)COCC3)cc1[N+](=O)[O-] ZINC000178888451 565944088 /nfs/dbraw/zinc/94/40/88/565944088.db2.gz UDIDFFAPAJJVGO-UHFFFAOYSA-N 0 0 398.238 3.447 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)N2CCCC[C@H]2c2ncc[nH]2)c1 ZINC000286164975 565945711 /nfs/dbraw/zinc/94/57/11/565945711.db2.gz YDZYKSROZRJOFM-NSHDSACASA-N 0 0 388.808 3.026 20 5 GGBDRN CC[C@@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H](C)[S@@]1=O ZINC000286166679 565945773 /nfs/dbraw/zinc/94/57/73/565945773.db2.gz WPNRFGSJMNKQIF-VPOQAHPWSA-N 0 0 375.288 3.089 20 5 GGBDRN CC[C@@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H](C)[S@]1=O ZINC000286166676 565945868 /nfs/dbraw/zinc/94/58/68/565945868.db2.gz WPNRFGSJMNKQIF-WOOQEGAKSA-N 0 0 375.288 3.089 20 5 GGBDRN O=C(C[C@H]1CCCC[C@@H]1O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000286173155 565945877 /nfs/dbraw/zinc/94/58/77/565945877.db2.gz JJCRFFBZPYRLPH-BZNIZROVSA-N 0 0 397.269 3.183 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)c(Br)c1 ZINC000286223272 565948096 /nfs/dbraw/zinc/94/80/96/565948096.db2.gz DCUJGUMOJDJOJZ-PSASIEDQSA-N 0 0 383.164 3.354 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC(C)(C)c1ccccc1Br ZINC000179007018 565952552 /nfs/dbraw/zinc/95/25/52/565952552.db2.gz IOINENVZMVXNBA-UHFFFAOYSA-N 0 0 395.257 3.304 20 5 GGBDRN O=[N+]([O-])c1cc2c(ncnc2Sc2nnc(NC[C@@H]3CCCO3)s2)s1 ZINC000286307769 565952854 /nfs/dbraw/zinc/95/28/54/565952854.db2.gz YVNNUIMFUGHRQZ-ZETCQYMHSA-N 0 0 396.479 3.193 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1COc2ccc(Br)cc21 ZINC000179025458 565953050 /nfs/dbraw/zinc/95/30/50/565953050.db2.gz CDJQMVUKBIGQJS-AWEZNQCLSA-N 0 0 377.194 3.150 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@H](C)c2ccc(Br)cc2F)c1[N+](=O)[O-] ZINC000286333003 565953805 /nfs/dbraw/zinc/95/38/05/565953805.db2.gz AOUGXFXREVMCNV-SSDOTTSWSA-N 0 0 385.193 3.029 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2cccc(Br)c2)c(F)c1 ZINC000179066254 565955044 /nfs/dbraw/zinc/95/50/44/565955044.db2.gz MELNYLIWHFNOGU-LBPRGKRZSA-N 0 0 386.173 3.315 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OC[C@@H](O)COc1cccc(Br)c1 ZINC000179065193 565955736 /nfs/dbraw/zinc/95/57/36/565955736.db2.gz XBTNRKIHSPSXEI-ZDUSSCGKSA-N 0 0 398.209 3.185 20 5 GGBDRN COCc1nc(C)cc(N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)n1 ZINC000286371638 565956188 /nfs/dbraw/zinc/95/61/88/565956188.db2.gz IGWVGWRYXSXJPF-UHFFFAOYSA-N 0 0 393.241 3.165 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OC[C@@H](O)COc1ccccc1F ZINC000179067746 565956527 /nfs/dbraw/zinc/95/65/27/565956527.db2.gz YSLUUCFEAIJTML-JTQLQIEISA-N 0 0 386.173 3.315 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)Cc1cc(Cl)ccc1F ZINC000179125918 565958890 /nfs/dbraw/zinc/95/88/90/565958890.db2.gz MXFNLIXJYPGJLQ-UHFFFAOYSA-N 0 0 388.804 3.016 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1N1CC[C@H](C(F)(F)F)[C@H](CO)C1 ZINC000286426495 565958905 /nfs/dbraw/zinc/95/89/05/565958905.db2.gz RLOSWKUJGRARFK-WPRPVWTQSA-N 0 0 383.164 3.354 20 5 GGBDRN Cc1cnc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c(Br)c1 ZINC000179133285 565959774 /nfs/dbraw/zinc/95/97/74/565959774.db2.gz OJXZQXRYFVDROD-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCCO1 ZINC000179166519 565963085 /nfs/dbraw/zinc/96/30/85/565963085.db2.gz ZQMYFPPZVANSKA-MRVPVSSYSA-N 0 0 377.622 3.262 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@H](C(N)=O)c1cccc(Br)c1 ZINC000179187596 565963127 /nfs/dbraw/zinc/96/31/27/565963127.db2.gz APBIYMMLBQJGMI-HNNXBMFYSA-N 0 0 378.226 3.016 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)c1ccc(Br)cc1F ZINC000286508270 565964766 /nfs/dbraw/zinc/96/47/66/565964766.db2.gz KUHUIIQWQPTGLE-SECBINFHSA-N 0 0 399.220 3.269 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)c1ccc(Br)cc1F ZINC000286508274 565965114 /nfs/dbraw/zinc/96/51/14/565965114.db2.gz KUHUIIQWQPTGLE-VIFPVBQESA-N 0 0 399.220 3.269 20 5 GGBDRN C[C@@H](N[C@@H](C(N)=O)c1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000179218410 565967002 /nfs/dbraw/zinc/96/70/02/565967002.db2.gz IYYWLAKPQITKSO-MEBBXXQBSA-N 0 0 378.226 3.235 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1scnc1C ZINC000179251563 565968203 /nfs/dbraw/zinc/96/82/03/565968203.db2.gz SMWMMWJLQGHWIR-UHFFFAOYSA-N 0 0 381.479 3.370 20 5 GGBDRN C[C@H]1CCCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)[C@H]1C ZINC000179248949 565968406 /nfs/dbraw/zinc/96/84/06/565968406.db2.gz XPMMXGJRUZKBID-UWVGGRQHSA-N 0 0 388.205 3.460 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NCC(F)(F)Br ZINC000286620125 565970744 /nfs/dbraw/zinc/97/07/44/565970744.db2.gz GLOHIYQJRWVYQR-UHFFFAOYSA-N 0 0 375.528 3.034 20 5 GGBDRN O=C(NCCc1ccc(Cl)s1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179385938 565977757 /nfs/dbraw/zinc/97/77/57/565977757.db2.gz FHFSKUZODOTVRP-UHFFFAOYSA-N 0 0 376.825 3.468 20 5 GGBDRN Cn1cc([C@H](O)C[C@H]2CCCN2c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000362392940 565978926 /nfs/dbraw/zinc/97/89/26/565978926.db2.gz VQPUIYYUZXOANT-MLGOLLRUSA-N 0 0 395.257 3.183 20 5 GGBDRN Cc1c([C@H](C)NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cnn1C ZINC000179421585 565979842 /nfs/dbraw/zinc/97/98/42/565979842.db2.gz HSWUSSVELCFYHZ-QMMMGPOBSA-N 0 0 382.218 3.282 20 5 GGBDRN Cc1cn2c(n1)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)CCC2 ZINC000362441936 565981209 /nfs/dbraw/zinc/98/12/09/565981209.db2.gz MYPNXIKDQGMGLZ-LLVKDONJSA-N 0 0 393.241 3.170 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCC(F)(F)Br)cc1SC ZINC000286821527 565981678 /nfs/dbraw/zinc/98/16/78/565981678.db2.gz VDAPTYKFNBQTQM-UHFFFAOYSA-N 0 0 385.186 3.043 20 5 GGBDRN CC(C)SCCNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000286842519 565982578 /nfs/dbraw/zinc/98/25/78/565982578.db2.gz XFNSFABKNDGRPP-UHFFFAOYSA-N 0 0 394.234 3.071 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H](c2ncon2)C(C)C)cc1[N+](=O)[O-] ZINC000286932784 565987101 /nfs/dbraw/zinc/98/71/01/565987101.db2.gz DKAYDDDKFXYRQN-LBPRGKRZSA-N 0 0 383.202 3.176 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1cnc(C)s1 ZINC000179548063 565988460 /nfs/dbraw/zinc/98/84/60/565988460.db2.gz RSSUUUXRHUWUMY-UHFFFAOYSA-N 0 0 381.479 3.370 20 5 GGBDRN CCN(CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(C)c1 ZINC000179563439 565988662 /nfs/dbraw/zinc/98/86/62/565988662.db2.gz 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566454421 /nfs/dbraw/zinc/45/44/21/566454421.db2.gz KZZOKPBLGRRXLJ-LLVKDONJSA-N 0 0 390.221 3.058 20 5 GGBDRN Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000464198527 566454765 /nfs/dbraw/zinc/45/47/65/566454765.db2.gz KSBKQVCQCHPLGN-UHFFFAOYSA-N 0 0 376.722 3.435 20 5 GGBDRN O=C1c2ccccc2C(=O)N1CCNc1ccc([N+](=O)[O-])cc1Br ZINC000484792196 566455078 /nfs/dbraw/zinc/45/50/78/566455078.db2.gz ORGMLALXEBNOAY-UHFFFAOYSA-N 0 0 390.193 3.065 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)c(F)c1 ZINC000484783203 566455166 /nfs/dbraw/zinc/45/51/66/566455166.db2.gz AZQAKHGBBWKZFM-MWLCHTKSSA-N 0 0 384.351 3.381 20 5 GGBDRN CCOC[C@H]1CCN(Cc2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000577664283 566455587 /nfs/dbraw/zinc/45/55/87/566455587.db2.gz KZZOKPBLGRRXLJ-NSHDSACASA-N 0 0 390.221 3.058 20 5 GGBDRN Cc1ccc(NC(=O)N(C)CCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000558179014 566456559 /nfs/dbraw/zinc/45/65/59/566456559.db2.gz CIVRCDUHZRDJTR-UHFFFAOYSA-N 0 0 382.218 3.026 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000484829361 566458646 /nfs/dbraw/zinc/45/86/46/566458646.db2.gz NGXSVWDRPGXTKU-KOLCDFICSA-N 0 0 381.376 3.023 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000484829363 566458711 /nfs/dbraw/zinc/45/87/11/566458711.db2.gz NGXSVWDRPGXTKU-ONGXEEELSA-N 0 0 381.376 3.023 20 5 GGBDRN O=C(N[C@@H]1CCSC1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000464238858 566459255 /nfs/dbraw/zinc/45/92/55/566459255.db2.gz CGQKARCXBCUOEW-MRVPVSSYSA-N 0 0 387.248 3.323 20 5 GGBDRN NS(=O)(=O)c1cc(NC[C@H]2CCCC[C@H]2C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000484835368 566459842 /nfs/dbraw/zinc/45/98/42/566459842.db2.gz ZLEIKDAIJNDTQY-NOZJJQNGSA-N 0 0 381.376 3.023 20 5 GGBDRN NS(=O)(=O)c1cc(NC[C@H]2CCCC[C@@H]2C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000484835370 566460054 /nfs/dbraw/zinc/46/00/54/566460054.db2.gz ZLEIKDAIJNDTQY-RNCFNFMXSA-N 0 0 381.376 3.023 20 5 GGBDRN CCc1ccc(C(=O)N=c2cc3ccc(Br)cn3[nH]2)cc1[N+](=O)[O-] ZINC000511390478 566460595 /nfs/dbraw/zinc/46/05/95/566460595.db2.gz IWJSBLPSYSRQIF-UHFFFAOYSA-N 0 0 389.209 3.242 20 5 GGBDRN CNC(=O)COc1cccc(CNc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000484862707 566461103 /nfs/dbraw/zinc/46/11/03/566461103.db2.gz HYXFBYBTOSPVPV-UHFFFAOYSA-N 0 0 394.225 3.094 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCSCC(F)(F)F ZINC000537702101 566464040 /nfs/dbraw/zinc/46/40/40/566464040.db2.gz FJWKDHABSKUBFY-QMMMGPOBSA-N 0 0 386.779 3.427 20 5 GGBDRN Cc1csc(NC(=O)c2ccc([N+](=O)[O-])cc2I)n1 ZINC000511473558 566466818 /nfs/dbraw/zinc/46/68/18/566466818.db2.gz GYFQFRAIIINJRO-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN O=C(Nc1ccnn1Cc1ccc(Cl)cc1Cl)c1cc([N+](=O)[O-])n[nH]1 ZINC000511505450 566468330 /nfs/dbraw/zinc/46/83/30/566468330.db2.gz LFSKWAMFUBVMPI-UHFFFAOYSA-N 0 0 381.179 3.122 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2n[nH]c3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000511496891 566468630 /nfs/dbraw/zinc/46/86/30/566468630.db2.gz FITONJJBHWAPRB-UHFFFAOYSA-N 0 0 393.172 3.355 20 5 GGBDRN CN(Cc1ccc(F)cc1Br)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000485024701 566469726 /nfs/dbraw/zinc/46/97/26/566469726.db2.gz IZBDYBCQJLKVHT-UHFFFAOYSA-N 0 0 396.216 3.227 20 5 GGBDRN CN(c1cccc(OC(F)(F)F)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000485027757 566470935 /nfs/dbraw/zinc/47/09/35/566470935.db2.gz VREZHXBDNQQWIR-UHFFFAOYSA-N 0 0 376.312 3.319 20 5 GGBDRN Cc1noc([C@H]2CCCN(Cc3cc(Br)c([N+](=O)[O-])s3)C2)n1 ZINC000602445286 566471869 /nfs/dbraw/zinc/47/18/69/566471869.db2.gz OLXCHIGTPSCCMB-VIFPVBQESA-N 0 0 387.259 3.490 20 5 GGBDRN CN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000511562526 566472044 /nfs/dbraw/zinc/47/20/44/566472044.db2.gz WBERWEVBSZRRDY-UHFFFAOYSA-N 0 0 396.184 3.472 20 5 GGBDRN O=[N+]([O-])c1sc(CN2CCC(O[C@H]3CCOC3)CC2)cc1Br ZINC000602482195 566473735 /nfs/dbraw/zinc/47/37/35/566473735.db2.gz NWVDPNJVMZSIOO-NSHDSACASA-N 0 0 391.287 3.189 20 5 GGBDRN C[C@H](NCc1cc(Br)c([N+](=O)[O-])s1)C(=O)N1CCCC[C@H]1C ZINC000602525443 566475185 /nfs/dbraw/zinc/47/51/85/566475185.db2.gz AXAVLZOGVAQOKE-ZJUUUORDSA-N 0 0 390.303 3.298 20 5 GGBDRN C[C@@H](NCc1cc(Br)c([N+](=O)[O-])s1)C(=O)N1CCCC[C@@H]1C ZINC000602525442 566475628 /nfs/dbraw/zinc/47/56/28/566475628.db2.gz AXAVLZOGVAQOKE-VHSXEESVSA-N 0 0 390.303 3.298 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3c(F)cccc3Br)CC2)cn1 ZINC000537866118 566477609 /nfs/dbraw/zinc/47/76/09/566477609.db2.gz NGGVQFBBCLGYMX-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN COc1ccccc1[C@@H](CO)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602554015 566478169 /nfs/dbraw/zinc/47/81/69/566478169.db2.gz YKXWBNLCJAJQNQ-GFCCVEGCSA-N 0 0 387.255 3.251 20 5 GGBDRN O=[N+]([O-])c1sc(CN[C@@]2(CO)CCc3ccccc32)cc1Br ZINC000602581341 566479322 /nfs/dbraw/zinc/47/93/22/566479322.db2.gz ICSMHFTYZPXKHY-OAHLLOKOSA-N 0 0 383.267 3.342 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCN(c3cccc(F)c3F)CC2)c(Br)c1 ZINC000485156914 566479763 /nfs/dbraw/zinc/47/97/63/566479763.db2.gz HDUDWAIKOPGEJQ-UHFFFAOYSA-N 0 0 399.195 3.357 20 5 GGBDRN CSc1cc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000537922674 566480493 /nfs/dbraw/zinc/48/04/93/566480493.db2.gz RTQXVLBUYAPVHL-UHFFFAOYSA-N 0 0 381.841 3.450 20 5 GGBDRN O=C(NCc1csc(Br)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000485168543 566480650 /nfs/dbraw/zinc/48/06/50/566480650.db2.gz PQZGBPFSTKKANP-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNc1ncc([N+](=O)[O-])cc1Br ZINC000485174493 566480713 /nfs/dbraw/zinc/48/07/13/566480713.db2.gz GZLSKMZEDMGSCE-UHFFFAOYSA-N 0 0 393.241 3.213 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c(Cl)c1 ZINC000485171553 566481002 /nfs/dbraw/zinc/48/10/02/566481002.db2.gz HZOBQEKXQHSFBM-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN CC(C)OC[C@@H]1CN(Cc2cc(Br)c([N+](=O)[O-])s2)CCO1 ZINC000602615219 566481515 /nfs/dbraw/zinc/48/15/15/566481515.db2.gz IWSDOBKMBIJIHR-JTQLQIEISA-N 0 0 379.276 3.045 20 5 GGBDRN C[C@@H](C(=O)NC(C)(C)C)N(C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602624004 566482180 /nfs/dbraw/zinc/48/21/80/566482180.db2.gz NRQXYMIWHQVQLB-QMMMGPOBSA-N 0 0 378.292 3.154 20 5 GGBDRN COC(=O)[C@@H](CC(F)(F)F)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602631403 566482321 /nfs/dbraw/zinc/48/23/21/566482321.db2.gz DBTVPRPNDJJRFA-SSDOTTSWSA-N 0 0 391.165 3.002 20 5 GGBDRN CN(C)C(=O)C[C@@H](Nc1ncc([N+](=O)[O-])cc1Br)c1ccccc1 ZINC000485214700 566483875 /nfs/dbraw/zinc/48/38/75/566483875.db2.gz VTQAGQVXGIZVEK-CQSZACIVSA-N 0 0 393.241 3.384 20 5 GGBDRN O=[N+]([O-])c1cccc(CCNS(=O)(=O)Cc2cccc(Br)c2)c1 ZINC000578021522 566484260 /nfs/dbraw/zinc/48/42/60/566484260.db2.gz XHPATWCLGNOFDV-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nc2cc(Br)ccc2[nH]1 ZINC000464548355 566484698 /nfs/dbraw/zinc/48/46/98/566484698.db2.gz AFTGDUJAAZKIPO-UHFFFAOYSA-N 0 0 375.182 3.415 20 5 GGBDRN COCc1nc(CNCc2cc(Br)c([N+](=O)[O-])s2)cs1 ZINC000602667219 566484841 /nfs/dbraw/zinc/48/48/41/566484841.db2.gz NYKNYPRNDKDGBE-UHFFFAOYSA-N 0 0 378.273 3.312 20 5 GGBDRN CCn1cc(Br)cc1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000511743297 566486625 /nfs/dbraw/zinc/48/66/25/566486625.db2.gz MKKIPBCQYRMGTM-UHFFFAOYSA-N 0 0 381.230 3.021 20 5 GGBDRN CS(=O)(=O)C[C@H]1CCCCN1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602682592 566486997 /nfs/dbraw/zinc/48/69/97/566486997.db2.gz MPOJEBMCAKYHKS-CYBMUJFWSA-N 0 0 380.388 3.013 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN1CCc2c(Br)ccc(Cl)c2C1 ZINC000464578186 566487840 /nfs/dbraw/zinc/48/78/40/566487840.db2.gz MMPNWOIJXCOCTQ-UHFFFAOYSA-N 0 0 385.649 3.303 20 5 GGBDRN Cc1cc2c(cc1[N+](=O)[O-])N(S(=O)(=O)c1cccc(Br)c1)CC2 ZINC000538014742 566487900 /nfs/dbraw/zinc/48/79/00/566487900.db2.gz DWCJSJXSNXVNEV-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN COc1ccc(CNC(=O)Cc2ccccc2Br)cc1[N+](=O)[O-] ZINC000511823849 566489651 /nfs/dbraw/zinc/48/96/51/566489651.db2.gz KPGDXGDDOHPYQP-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@]2(C)CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000511819328 566489683 /nfs/dbraw/zinc/48/96/83/566489683.db2.gz ADMPYKNZWBREBY-HOCLYGCPSA-N 0 0 385.258 3.337 20 5 GGBDRN O=C(Nc1nc(-c2cccc(Br)c2)cs1)c1cc([N+](=O)[O-])n[nH]1 ZINC000511814214 566489693 /nfs/dbraw/zinc/48/96/93/566489693.db2.gz MIRNJIGGIBBQSS-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN C[C@@H](Cc1ccc(Br)cc1)Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000558592175 566489768 /nfs/dbraw/zinc/48/97/68/566489768.db2.gz BCUTWYOZXQKHQZ-JTQLQIEISA-N 0 0 378.226 3.499 20 5 GGBDRN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000538057482 566490737 /nfs/dbraw/zinc/49/07/37/566490737.db2.gz VXXPGXSEZBZHAJ-OTYXRUKQSA-N 0 0 382.214 3.191 20 5 GGBDRN CC[C@H]1CN(Cc2cc(I)cc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000578100881 566491789 /nfs/dbraw/zinc/49/17/89/566491789.db2.gz HLNKIZWRLARZDD-YGRLFVJLSA-N 0 0 390.221 3.199 20 5 GGBDRN Cn1ncc(Br)c1CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602735805 566491898 /nfs/dbraw/zinc/49/18/98/566491898.db2.gz YIEIUXXXSAAAMQ-UHFFFAOYSA-N 0 0 393.163 3.399 20 5 GGBDRN C[C@H](c1noc(-c2c([N+](=O)[O-])cnn2C)n1)c1ccc(Br)cc1 ZINC000558602127 566492213 /nfs/dbraw/zinc/49/22/13/566492213.db2.gz PHVSTLMDMVWGDN-QMMMGPOBSA-N 0 0 378.186 3.293 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1Cn1c(=O)oc2cc(F)c(Br)cc21 ZINC000485382411 566492372 /nfs/dbraw/zinc/49/23/72/566492372.db2.gz WPSZDIBEDWKUDW-UHFFFAOYSA-N 0 0 397.156 3.461 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1Cn1cnc2ccc(Br)cc2c1=O ZINC000485371109 566492446 /nfs/dbraw/zinc/49/24/46/566492446.db2.gz OPCUVMFLQBMWGE-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN O=C1N[C@@H](c2ccc(Br)cc2[N+](=O)[O-])N2CCc3ccccc3[C@H]12 ZINC000602757791 566493051 /nfs/dbraw/zinc/49/30/51/566493051.db2.gz OSEFLIZTQBBZBX-HZPDHXFCSA-N 0 0 388.221 3.085 20 5 GGBDRN O=C1N[C@@H](c2ccc(Br)cc2[N+](=O)[O-])N2CCc3ccccc3[C@@H]12 ZINC000602757792 566493662 /nfs/dbraw/zinc/49/36/62/566493662.db2.gz OSEFLIZTQBBZBX-JKSUJKDBSA-N 0 0 388.221 3.085 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000511876653 566494168 /nfs/dbraw/zinc/49/41/68/566494168.db2.gz SLWPMVSIPZRIGG-AWEZNQCLSA-N 0 0 382.825 3.359 20 5 GGBDRN Nc1nc(N2CCC[C@H]2c2ccc(Br)c(F)c2)ncc1[N+](=O)[O-] ZINC000485401617 566495194 /nfs/dbraw/zinc/49/51/94/566495194.db2.gz GABOOJBNFZVPJU-NSHDSACASA-N 0 0 382.193 3.040 20 5 GGBDRN Cn1c(C(=O)Nc2ccc(Br)c3cccnc23)ccc1[N+](=O)[O-] ZINC000511905121 566495911 /nfs/dbraw/zinc/49/59/11/566495911.db2.gz ONZAPSXNNMVHFJ-UHFFFAOYSA-N 0 0 375.182 3.496 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H]2CCc3c2cccc3Cl)c([N+](=O)[O-])c1 ZINC000511905741 566496057 /nfs/dbraw/zinc/49/60/57/566496057.db2.gz HCWIFKYVEQQCEA-CQSZACIVSA-N 0 0 382.825 3.223 20 5 GGBDRN Nc1nc(N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)ncc1[N+](=O)[O-] ZINC000485419888 566496630 /nfs/dbraw/zinc/49/66/30/566496630.db2.gz AEWFMAGEKWCXEJ-KYZUINATSA-N 0 0 382.193 3.057 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H](COC(F)F)C1 ZINC000485431595 566496875 /nfs/dbraw/zinc/49/68/75/566496875.db2.gz OIJUMBGTYFETHV-MRVPVSSYSA-N 0 0 394.172 3.450 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NC(C)(C)C1CC1 ZINC000558682371 566499110 /nfs/dbraw/zinc/49/91/10/566499110.db2.gz GBPSTWLCFVDTDI-UHFFFAOYSA-N 0 0 388.205 3.426 20 5 GGBDRN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1cccc(Br)c1 ZINC000464686575 566499055 /nfs/dbraw/zinc/49/90/55/566499055.db2.gz DDOBZJUUZSYUIS-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(Br)c2cccnc12 ZINC000511960558 566500503 /nfs/dbraw/zinc/50/05/03/566500503.db2.gz MRAXKMJQHSVDIA-UHFFFAOYSA-N 0 0 390.197 3.049 20 5 GGBDRN CCSc1cccc(Br)c1NC(=O)c1cc([N+](=O)[O-])nn1C ZINC000464714821 566501180 /nfs/dbraw/zinc/50/11/80/566501180.db2.gz VQJBSAZBQSIYEG-UHFFFAOYSA-N 0 0 385.243 3.455 20 5 GGBDRN CC(C)c1nnc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000464736299 566501294 /nfs/dbraw/zinc/50/12/94/566501294.db2.gz RQATTXKALNMYDI-UHFFFAOYSA-N 0 0 384.845 3.308 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)CCn1cc(Br)ccc1=O ZINC000464721679 566501443 /nfs/dbraw/zinc/50/14/43/566501443.db2.gz YWIATFYBNUEJKP-UHFFFAOYSA-N 0 0 394.225 3.110 20 5 GGBDRN COc1ccc(Cn2c(=O)oc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000485469994 566501426 /nfs/dbraw/zinc/50/14/26/566501426.db2.gz QJRYDTJJVXMJEW-UHFFFAOYSA-N 0 0 397.156 3.461 20 5 GGBDRN CC(C)c1nnc(CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000464733430 566501715 /nfs/dbraw/zinc/50/17/15/566501715.db2.gz HQCJRSNOSKWXHC-VIFPVBQESA-N 0 0 384.845 3.307 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(Br)c(O)c1 ZINC000558728207 566501608 /nfs/dbraw/zinc/50/16/08/566501608.db2.gz VFLQQWWRBVGWLP-UHFFFAOYSA-N 0 0 379.210 3.378 20 5 GGBDRN CC(C)c1nnc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000464749316 566502434 /nfs/dbraw/zinc/50/24/34/566502434.db2.gz YSWBKCYSDDNBRG-UHFFFAOYSA-N 0 0 385.243 3.262 20 5 GGBDRN COc1ccccc1[C@H](CO)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000578233452 566503532 /nfs/dbraw/zinc/50/35/32/566503532.db2.gz RBUDZMDRBRRNEC-AWEZNQCLSA-N 0 0 381.226 3.189 20 5 GGBDRN Nc1c(C(=O)NCc2nc3cc(Br)ccc3o2)cccc1[N+](=O)[O-] ZINC000578259049 566506987 /nfs/dbraw/zinc/50/69/87/566506987.db2.gz NZCHYZJYOICLJV-UHFFFAOYSA-N 0 0 391.181 3.011 20 5 GGBDRN O=C(Nc1cnn(CC(F)(F)F)c1)c1sc(Br)cc1[N+](=O)[O-] ZINC000485504577 566506994 /nfs/dbraw/zinc/50/69/94/566506994.db2.gz SPHFFBUBCGZOQD-UHFFFAOYSA-N 0 0 399.148 3.430 20 5 GGBDRN COC(=O)c1ccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])nc1 ZINC000558811283 566508176 /nfs/dbraw/zinc/50/81/76/566508176.db2.gz IRFMUBIBVBUNOV-UHFFFAOYSA-N 0 0 381.797 3.161 20 5 GGBDRN C[C@@]1(C2CCCC2)NC(=O)N(Cc2ccc(Br)cc2[N+](=O)[O-])C1=O ZINC000424096624 566511531 /nfs/dbraw/zinc/51/15/31/566511531.db2.gz CMPMDUMHNTXTJB-INIZCTEOSA-N 0 0 396.241 3.358 20 5 GGBDRN CC[C@@]1(C(C)C)NC(=O)N(Cc2ccc(Br)cc2[N+](=O)[O-])C1=O ZINC000424085469 566511576 /nfs/dbraw/zinc/51/15/76/566511576.db2.gz AYXOUERLOGXLMV-HNNXBMFYSA-N 0 0 384.230 3.214 20 5 GGBDRN CCC[C@]1(C2CC2)NC(=O)N(Cc2ccc(Br)cc2[N+](=O)[O-])C1=O ZINC000424107265 566512283 /nfs/dbraw/zinc/51/22/83/566512283.db2.gz ZAUMUKXDFWOIIS-MRXNPFEDSA-N 0 0 396.241 3.358 20 5 GGBDRN CSc1cccc(C(=O)NCc2noc(-c3cccs3)n2)c1[N+](=O)[O-] ZINC000558926203 566515267 /nfs/dbraw/zinc/51/52/67/566515267.db2.gz FLVIRIUFCKMTGU-UHFFFAOYSA-N 0 0 376.419 3.358 20 5 GGBDRN CC[C@@H](NC(=O)c1[nH]nc(C)c1[N+](=O)[O-])c1cc(F)cc(Br)c1 ZINC000485666195 566516522 /nfs/dbraw/zinc/51/65/22/566516522.db2.gz FNSRFALAIOCSMG-LLVKDONJSA-N 0 0 385.193 3.409 20 5 GGBDRN CC[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1cc(F)cc(Br)c1 ZINC000485670857 566516728 /nfs/dbraw/zinc/51/67/28/566516728.db2.gz RQZZARUFKQENGB-LLVKDONJSA-N 0 0 385.193 3.111 20 5 GGBDRN NS(=O)(=O)c1c(NCCc2cc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000558972468 566517945 /nfs/dbraw/zinc/51/79/45/566517945.db2.gz MCSKGYUFHQHZCF-UHFFFAOYSA-N 0 0 377.447 3.112 20 5 GGBDRN Cc1nn(CC(=O)N(C)Cc2ccc(Cl)s2)c2ncc([N+](=O)[O-])cc12 ZINC000603328671 566519952 /nfs/dbraw/zinc/51/99/52/566519952.db2.gz UHDRLOMIJKQDRP-UHFFFAOYSA-N 0 0 379.829 3.021 20 5 GGBDRN CN([C@H]1CCc2ccccc2C1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000512200286 566520320 /nfs/dbraw/zinc/52/03/20/566520320.db2.gz VHMAIRMNUWNOJF-AWEZNQCLSA-N 0 0 380.853 3.426 20 5 GGBDRN O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)Nc1nc2ccsc2s1 ZINC000465122696 566521176 /nfs/dbraw/zinc/52/11/76/566521176.db2.gz QRWUQNWLRYXFKI-UHFFFAOYSA-N 0 0 377.403 3.218 20 5 GGBDRN CCc1nnc(SCc2cc(I)cc([N+](=O)[O-])c2)o1 ZINC000603370126 566522015 /nfs/dbraw/zinc/52/20/15/566522015.db2.gz JQZWAUWOKLEOOJ-UHFFFAOYSA-N 0 0 391.190 3.437 20 5 GGBDRN CCOC(=O)[C@@H]1CSCCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000559048950 566522453 /nfs/dbraw/zinc/52/24/53/566522453.db2.gz AALTWPOHQGHKBH-ZDUSSCGKSA-N 0 0 378.372 3.094 20 5 GGBDRN CC(C)[C@H]1CN(c2ccc(I)cc2[N+](=O)[O-])CCO1 ZINC000538670154 566526109 /nfs/dbraw/zinc/52/61/09/566526109.db2.gz QFHHQHLDMIFGFS-CYBMUJFWSA-N 0 0 376.194 3.061 20 5 GGBDRN CSCCNc1ccc(S(=O)(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000603472556 566528549 /nfs/dbraw/zinc/52/85/49/566528549.db2.gz AAXZBRIAHXIPTR-UHFFFAOYSA-N 0 0 387.527 3.227 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCc2cc3ccccc3s2)cc1 ZINC000559141138 566528565 /nfs/dbraw/zinc/52/85/65/566528565.db2.gz KNFAXJGJFXDCKE-UHFFFAOYSA-N 0 0 376.459 3.472 20 5 GGBDRN CN(Cc1c(F)cccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000559146180 566529858 /nfs/dbraw/zinc/52/98/58/566529858.db2.gz SLTIQMFUUYEVLI-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2nnc(C(C)C)s2)cc1SC ZINC000465377119 566529928 /nfs/dbraw/zinc/52/99/28/566529928.db2.gz BXAAZHCLHXYQLG-UHFFFAOYSA-N 0 0 382.467 3.230 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000603514985 566533045 /nfs/dbraw/zinc/53/30/45/566533045.db2.gz NWDLJXBCWCLMSA-UHFFFAOYSA-N 0 0 389.209 3.365 20 5 GGBDRN COC[C@@H](NS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)c1cccc(Cl)c1 ZINC000578573658 566533761 /nfs/dbraw/zinc/53/37/61/566533761.db2.gz FGNVMJLGGMLOKB-GFCCVEGCSA-N 0 0 390.870 3.284 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccc(Br)cc3F)CC2)cn1 ZINC000603582113 566534142 /nfs/dbraw/zinc/53/41/42/566534142.db2.gz MMXMTENKTJPUEI-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2ccc(C)cc2SC)c([N+](=O)[O-])c1 ZINC000465504931 566534805 /nfs/dbraw/zinc/53/48/05/566534805.db2.gz ZWIHCQUXMHLREJ-UHFFFAOYSA-N 0 0 382.463 3.112 20 5 GGBDRN NC(=O)c1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c(Cl)cc1Cl ZINC000559237349 566535015 /nfs/dbraw/zinc/53/50/15/566535015.db2.gz IAWVSIFHPZBJIM-UHFFFAOYSA-N 0 0 384.175 3.018 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])cc1 ZINC000485910086 566538986 /nfs/dbraw/zinc/53/89/86/566538986.db2.gz ZVSUBAFBMCVLAF-OAQYLSRUSA-N 0 0 389.252 3.409 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCN(c2cccc(Br)c2)CC1 ZINC000603756405 566539021 /nfs/dbraw/zinc/53/90/21/566539021.db2.gz MVIQSDJMYCRQMG-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN C[C@H](Cc1ccc(Br)cc1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000603759798 566539137 /nfs/dbraw/zinc/53/91/37/566539137.db2.gz QFRRUBHDGVDQNE-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN Cc1cc(OC[C@H](O)COc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000559284433 566539432 /nfs/dbraw/zinc/53/94/32/566539432.db2.gz NTBQPKWDTAJBGL-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN Cc1ccc(NC(=O)CS(=O)(=O)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000603820143 566540506 /nfs/dbraw/zinc/54/05/06/566540506.db2.gz SMJVOFAKTNYIOP-UHFFFAOYSA-N 0 0 388.854 3.172 20 5 GGBDRN CO[C@@]1(C)C[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C1(C)C ZINC000485925644 566540443 /nfs/dbraw/zinc/54/04/43/566540443.db2.gz OCWWYLCGABFODO-OQPBUACISA-N 0 0 377.260 3.352 20 5 GGBDRN Cc1nn(C)c(N2CCc3[nH]c4ccc(Br)cc4c3C2)c1[N+](=O)[O-] ZINC000603849897 566541813 /nfs/dbraw/zinc/54/18/13/566541813.db2.gz ISWVKBPPLAOEDH-UHFFFAOYSA-N 0 0 390.241 3.443 20 5 GGBDRN O=C(c1cccc(Cl)c1Cl)N1CCN(c2cccnc2[N+](=O)[O-])CC1 ZINC000603863686 566542762 /nfs/dbraw/zinc/54/27/62/566542762.db2.gz YJJCFMVQDHKKOT-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2occc2Br)c(C)c([N+](=O)[O-])c1 ZINC000485953599 566542972 /nfs/dbraw/zinc/54/29/72/566542972.db2.gz RSJNHYALCMDEEC-UHFFFAOYSA-N 0 0 383.154 3.298 20 5 GGBDRN CNS(=O)(=O)c1ccc(NCc2cc3c(s2)CCCC3)c([N+](=O)[O-])c1 ZINC000603867362 566543586 /nfs/dbraw/zinc/54/35/86/566543586.db2.gz OURYVFQBOZRBML-UHFFFAOYSA-N 0 0 381.479 3.055 20 5 GGBDRN Cc1ccc(C(=O)N[C@H](CO)c2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000538886347 566545158 /nfs/dbraw/zinc/54/51/58/566545158.db2.gz OBWLEQZHNXPJJJ-CQSZACIVSA-N 0 0 379.210 3.129 20 5 GGBDRN C[C@@H](C[S@](C)=O)N(C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000485971333 566545981 /nfs/dbraw/zinc/54/59/81/566545981.db2.gz YDPLVSBJRKDAMC-AUADJRAKSA-N 0 0 386.271 3.109 20 5 GGBDRN NS(=O)(=O)c1c(N[C@H]2CCSc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000603929986 566546093 /nfs/dbraw/zinc/54/60/93/566546093.db2.gz YCKCWJJKSPKWBP-NSHDSACASA-N 0 0 383.426 3.030 20 5 GGBDRN CN(Cc1ccc(Br)cc1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000603941339 566546946 /nfs/dbraw/zinc/54/69/46/566546946.db2.gz WYPWAPKKXSRPJX-UHFFFAOYSA-N 0 0 393.193 3.358 20 5 GGBDRN CCc1nn(C)c(N[C@@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000486002922 566547022 /nfs/dbraw/zinc/54/70/22/566547022.db2.gz KJTCFRYHTCOTJB-GFCCVEGCSA-N 0 0 394.273 3.344 20 5 GGBDRN CCc1nn(C)c(N[C@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000486002923 566547258 /nfs/dbraw/zinc/54/72/58/566547258.db2.gz KJTCFRYHTCOTJB-LBPRGKRZSA-N 0 0 394.273 3.344 20 5 GGBDRN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(Br)s1 ZINC000603949813 566547350 /nfs/dbraw/zinc/54/73/50/566547350.db2.gz FGZKLZPTILXHAV-UHFFFAOYSA-N 0 0 398.238 3.130 20 5 GGBDRN CC(C)N(Cc1cc(Br)ccc1F)C(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000603956828 566547695 /nfs/dbraw/zinc/54/76/95/566547695.db2.gz GYSBCLHJTFVDLK-UHFFFAOYSA-N 0 0 399.220 3.130 20 5 GGBDRN CSc1ccc(NC(=O)[C@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000512634044 566547799 /nfs/dbraw/zinc/54/77/99/566547799.db2.gz QHNLASRGAAFBNM-NSHDSACASA-N 0 0 380.447 3.118 20 5 GGBDRN Cc1cscc1CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000486010101 566548115 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Cn1nccc1[C@H]1C[C@@H](Nc2ccc(Br)cc2[N+](=O)[O-])CCO1 ZINC000450848343 566712805 /nfs/dbraw/zinc/71/28/05/566712805.db2.gz WWMGHJRHJOKXEH-XHDPSFHLSA-N 0 0 381.230 3.423 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](OCC(F)(F)F)C1 ZINC000515438420 566713008 /nfs/dbraw/zinc/71/30/08/566713008.db2.gz DZIUCKIYQYZVAK-GFCCVEGCSA-N 0 0 378.372 3.257 20 5 GGBDRN CS(=O)(=O)c1ccc(CNc2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000468602226 566713079 /nfs/dbraw/zinc/71/30/79/566713079.db2.gz XFDGSQCQUAORTG-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN CN(C(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000515450854 566713220 /nfs/dbraw/zinc/71/32/20/566713220.db2.gz YYTBAKSFHKTMLF-UHFFFAOYSA-N 0 0 380.198 3.184 20 5 GGBDRN CS(=O)(=O)c1cccc(N[C@H]2CCO[C@H](c3cccs3)C2)c1[N+](=O)[O-] ZINC000450864015 566714077 /nfs/dbraw/zinc/71/40/77/566714077.db2.gz QUBUFYXSBVVEJS-AAEUAGOBSA-N 0 0 382.463 3.392 20 5 GGBDRN CCOCCOCCN(C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000468607550 566714517 /nfs/dbraw/zinc/71/45/17/566714517.db2.gz KKQOOPKVQJDXNL-UHFFFAOYSA-N 0 0 398.257 3.395 20 5 GGBDRN COCCN(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H]1CCCSC1 ZINC000468618113 566716182 /nfs/dbraw/zinc/71/61/82/566716182.db2.gz JXJSSBIKSAMGIC-ZFWWWQNUSA-N 0 0 384.523 3.446 20 5 GGBDRN CCNc1ccc(C(=O)Nc2ncc(OC)cc2Br)cc1[N+](=O)[O-] ZINC000515478611 566716325 /nfs/dbraw/zinc/71/63/25/566716325.db2.gz WGRYCIRJRGGXII-UHFFFAOYSA-N 0 0 395.213 3.445 20 5 GGBDRN CCn1nnc(C)c1COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000450896518 566717098 /nfs/dbraw/zinc/71/70/98/566717098.db2.gz NJCTUAAUTZRZGY-UHFFFAOYSA-N 0 0 392.213 3.404 20 5 GGBDRN CC(C)(C)[C@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000541323948 566717264 /nfs/dbraw/zinc/71/72/64/566717264.db2.gz IRKUXSRPXZGOHI-JTQLQIEISA-N 0 0 391.287 3.414 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)c2ccc(SC)cc2)cc1[N+](=O)[O-] ZINC000488282566 566719341 /nfs/dbraw/zinc/71/93/41/566719341.db2.gz RBHZQINQHKUGLV-UHFFFAOYSA-N 0 0 386.426 3.290 20 5 GGBDRN C[C@H]1CCC(=O)[C@H](Oc2ccc(I)cc2[N+](=O)[O-])C1 ZINC000450916150 566720839 /nfs/dbraw/zinc/72/08/39/566720839.db2.gz UXBIXXYTPJIEQF-ISVAXAHUSA-N 0 0 375.162 3.336 20 5 GGBDRN C[C@@H]1CCC(=O)[C@@H](Oc2ccc(I)cc2[N+](=O)[O-])C1 ZINC000450916152 566720350 /nfs/dbraw/zinc/72/03/50/566720350.db2.gz UXBIXXYTPJIEQF-OQPBUACISA-N 0 0 375.162 3.336 20 5 GGBDRN Cc1ccc(OC(F)F)c(Cn2cc([N+](=O)[O-])cc(Br)c2=O)c1 ZINC000488299642 566720331 /nfs/dbraw/zinc/72/03/31/566720331.db2.gz XSZMILGXFJLLJZ-UHFFFAOYSA-N 0 0 389.152 3.477 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC(C)(C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000561559232 566720525 /nfs/dbraw/zinc/72/05/25/566720525.db2.gz HYLHNYHTPCHXMY-OAHLLOKOSA-N 0 0 382.463 3.437 20 5 GGBDRN CCc1nn(C)cc1-c1noc(-c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000426623645 566720816 /nfs/dbraw/zinc/72/08/16/566720816.db2.gz PZKLXFSSIQOHLV-UHFFFAOYSA-N 0 0 378.186 3.370 20 5 GGBDRN CO[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccc(Cl)cc1 ZINC000468706328 566721364 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GGBDRN Cc1c(Br)c(N[C@H]2CCO[C@@H](c3nccn3C)C2)ncc1[N+](=O)[O-] ZINC000450953104 566723499 /nfs/dbraw/zinc/72/34/99/566723499.db2.gz WZFQHVBFVRJKGS-CMPLNLGQSA-N 0 0 396.245 3.126 20 5 GGBDRN Cc1cc(C)n(-c2ccc(Cn3cc(Br)c([N+](=O)[O-])n3)cc2)n1 ZINC000515605662 566723624 /nfs/dbraw/zinc/72/36/24/566723624.db2.gz MLNSGYLUIQOESW-UHFFFAOYSA-N 0 0 376.214 3.405 20 5 GGBDRN COc1cc(F)cc(C[C@H](C)Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000450953697 566723825 /nfs/dbraw/zinc/72/38/25/566723825.db2.gz ZHDHCIJFYIGKRL-VIFPVBQESA-N 0 0 388.442 3.251 20 5 GGBDRN CCc1nn(C)c(NCc2nc3c(cccc3Br)[nH]2)c1[N+](=O)[O-] ZINC000450947416 566724044 /nfs/dbraw/zinc/72/40/44/566724044.db2.gz NJGQHNIHPSBANB-UHFFFAOYSA-N 0 0 379.218 3.142 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ncc(C(N)=O)s1 ZINC000488436167 566726604 /nfs/dbraw/zinc/72/66/04/566726604.db2.gz SALUQIOHNBIJEU-UHFFFAOYSA-N 0 0 380.451 3.151 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCC2CC(F)(F)C2)c([N+](=O)[O-])c1 ZINC000488455440 566726942 /nfs/dbraw/zinc/72/69/42/566726942.db2.gz FJEHRROHIRYWGH-UHFFFAOYSA-N 0 0 377.413 3.083 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H](COC(F)F)C1 ZINC000561669802 566727857 /nfs/dbraw/zinc/72/78/57/566727857.db2.gz QJZYUBWASMZFRC-JTQLQIEISA-N 0 0 377.775 3.061 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC(Oc3ccccn3)CC2)c(Br)c1 ZINC000468768399 566728408 /nfs/dbraw/zinc/72/84/08/566728408.db2.gz AZZAEOOAARFOGQ-UHFFFAOYSA-N 0 0 379.214 3.195 20 5 GGBDRN CN(CCc1ccccc1O)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000541503814 566729177 /nfs/dbraw/zinc/72/91/77/566729177.db2.gz LJDBNVHQOPYVNR-UHFFFAOYSA-N 0 0 379.210 3.378 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccccc1Br ZINC000426787222 566730935 /nfs/dbraw/zinc/73/09/35/566730935.db2.gz BZVJIXLFRHWDDR-HNNXBMFYSA-N 0 0 379.210 3.143 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1OCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000515758845 566732292 /nfs/dbraw/zinc/73/22/92/566732292.db2.gz RKPHBCMMTIWMTG-RISCZKNCSA-N 0 0 376.862 3.122 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1csc2ccccc12 ZINC000515762959 566732860 /nfs/dbraw/zinc/73/28/60/566732860.db2.gz ZCUJJHWIJIHZPW-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN C[C@H]1CC(C)(C)CN1C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000515798681 566734258 /nfs/dbraw/zinc/73/42/58/566734258.db2.gz AOTQAFINKSBKRD-VIFPVBQESA-N 0 0 388.205 3.460 20 5 GGBDRN COc1cc(S(=O)(=O)NCc2csc3ccccc23)ccc1[N+](=O)[O-] ZINC000468825021 566734520 /nfs/dbraw/zinc/73/45/20/566734520.db2.gz DZQDSEGRBRRGDK-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN CC(=O)c1ccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)nc1C ZINC000541575855 566734658 /nfs/dbraw/zinc/73/46/58/566734658.db2.gz GWGIRCBUSUEJQP-UHFFFAOYSA-N 0 0 379.214 3.001 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCCC[C@H]2N2CCOCC2)ncc1[N+](=O)[O-] ZINC000541578917 566734800 /nfs/dbraw/zinc/73/48/00/566734800.db2.gz OUNVPMWGNVLUAR-CHWSQXEVSA-N 0 0 399.289 3.116 20 5 GGBDRN Cc1c(Br)c(Oc2ccc(O[C@@H](C)C(N)=O)cc2)ncc1[N+](=O)[O-] ZINC000541576475 566735132 /nfs/dbraw/zinc/73/51/32/566735132.db2.gz KFGMTSGCBNOUHI-VIFPVBQESA-N 0 0 396.197 3.106 20 5 GGBDRN Cc1c(Br)c(N[C@@H](C)[C@@H](O)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000541578851 566735187 /nfs/dbraw/zinc/73/51/87/566735187.db2.gz QUIMQAODRREUFT-FZMZJTMJSA-N 0 0 380.242 3.465 20 5 GGBDRN COCCCN(Cc1ccncc1)c1ncc([N+](=O)[O-])c(C)c1Br ZINC000541576083 566735393 /nfs/dbraw/zinc/73/53/93/566735393.db2.gz UQVYPYIXEOYPGC-UHFFFAOYSA-N 0 0 395.257 3.499 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000608809693 566735475 /nfs/dbraw/zinc/73/54/75/566735475.db2.gz MYFLPPXERAATQE-LLVKDONJSA-N 0 0 381.841 3.327 20 5 GGBDRN Cc1c(Br)c(N[C@@H](C)C(=O)NCc2ccccc2)ncc1[N+](=O)[O-] ZINC000541590922 566735853 /nfs/dbraw/zinc/73/58/53/566735853.db2.gz AUFBLHNKHBIFFU-NSHDSACASA-N 0 0 393.241 3.178 20 5 GGBDRN O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1c(Cl)cccc1C(F)(F)F ZINC000608801419 566736018 /nfs/dbraw/zinc/73/60/18/566736018.db2.gz MNJPWHSIWCXXOE-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN CCC(=O)Nc1cccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)c1 ZINC000541589633 566736424 /nfs/dbraw/zinc/73/64/24/566736424.db2.gz BKQDEFTUVMKUPJ-UHFFFAOYSA-N 0 0 393.241 3.443 20 5 GGBDRN Cc1c(Br)c(N[C@H](C)c2nnc3ccccn32)ncc1[N+](=O)[O-] ZINC000541589596 566736894 /nfs/dbraw/zinc/73/68/94/566736894.db2.gz GDWQUNQKAGAXRP-SECBINFHSA-N 0 0 377.202 3.277 20 5 GGBDRN CCNC(=O)[C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000608835430 566737186 /nfs/dbraw/zinc/73/71/86/566737186.db2.gz CBGBYMAEQSPGPG-SNVBAGLBSA-N 0 0 396.241 3.232 20 5 GGBDRN CC1(C)CN(c2ncc([N+](=O)[O-])cc2Br)C[C@H](C(F)(F)F)O1 ZINC000488678546 566739584 /nfs/dbraw/zinc/73/95/84/566739584.db2.gz VPGUBLNHGNUPGR-SECBINFHSA-N 0 0 384.152 3.298 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cc2c(c(Br)c1)OCO2 ZINC000608870291 566739720 /nfs/dbraw/zinc/73/97/20/566739720.db2.gz IPAWXGVOYQBBEV-UHFFFAOYSA-N 0 0 383.129 3.477 20 5 GGBDRN COc1ccccc1C(C)(C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000488666605 566739741 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COc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000608908914 566742109 /nfs/dbraw/zinc/74/21/09/566742109.db2.gz BBFJLECFVHIGBY-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@@H](C)Sc3ccccc32)cc1[N+](=O)[O-] ZINC000468914455 566742856 /nfs/dbraw/zinc/74/28/56/566742856.db2.gz LCTAIFYNXHSZAL-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN Cc1c(Br)c(NC2CCN(CC(F)(F)F)CC2)ncc1[N+](=O)[O-] ZINC000561847126 566743342 /nfs/dbraw/zinc/74/33/42/566743342.db2.gz XGWCLSDWYGHDJE-UHFFFAOYSA-N 0 0 397.195 3.499 20 5 GGBDRN COc1ccc(CN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1C ZINC000488732072 566744063 /nfs/dbraw/zinc/74/40/63/566744063.db2.gz YZWQHCMEJFPIKA-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCC2(c3ccc(Cl)cc3)CC2)c(F)c1 ZINC000608982080 566744290 /nfs/dbraw/zinc/74/42/90/566744290.db2.gz ZBFOIINQTIZNKT-UHFFFAOYSA-N 0 0 384.816 3.397 20 5 GGBDRN Cc1cccc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1I ZINC000581035020 566744702 /nfs/dbraw/zinc/74/47/02/566744702.db2.gz ISNIWIBTZXSGIA-UHFFFAOYSA-N 0 0 397.172 3.179 20 5 GGBDRN O=C(N[C@H]1CC[S@](=O)C1)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000541728900 566745084 /nfs/dbraw/zinc/74/50/84/566745084.db2.gz VXNQAXLPQVOTKS-CANCMXDXSA-N 0 0 382.507 3.128 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCc1nccc(C(F)F)n1 ZINC000561874840 566745050 /nfs/dbraw/zinc/74/50/50/566745050.db2.gz OQPKPNCNYKVZIZ-UHFFFAOYSA-N 0 0 388.783 3.384 20 5 GGBDRN O=C(Nc1ccc(Br)cc1O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000608958098 566745154 /nfs/dbraw/zinc/74/51/54/566745154.db2.gz IWORATWRNXIVLY-UHFFFAOYSA-N 0 0 395.165 3.086 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCc3c2cccc3Br)cc(F)cc1[N+](=O)[O-] ZINC000609025778 566746020 /nfs/dbraw/zinc/74/60/20/566746020.db2.gz SJDAECZPWJVKPY-CYBMUJFWSA-N 0 0 394.200 3.496 20 5 GGBDRN CC1(C)CCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000488766608 566747658 /nfs/dbraw/zinc/74/76/58/566747658.db2.gz VDHGVZIIWVTDCQ-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N[C@@H]1CCN(c2ccccc2F)C1 ZINC000488776992 566747746 /nfs/dbraw/zinc/74/77/46/566747746.db2.gz PLTZFDZXHGURBP-SNVBAGLBSA-N 0 0 381.205 3.004 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCc2ccccc2C1 ZINC000609030172 566747907 /nfs/dbraw/zinc/74/79/07/566747907.db2.gz KGNAEMTWPFMIBU-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN COc1cc(Cl)c(NS(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1C ZINC000581095465 566749345 /nfs/dbraw/zinc/74/93/45/566749345.db2.gz PGMIVVQFRVMBEI-UHFFFAOYSA-N 0 0 386.813 3.375 20 5 GGBDRN O=[N+]([O-])c1cccc(CNS(=O)(=O)c2cc(C(F)(F)F)ccc2F)c1 ZINC000609134412 566750100 /nfs/dbraw/zinc/75/01/00/566750100.db2.gz JKTQHQMDLUCYAE-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CCC[C@H]1C1CC1 ZINC000609130358 566750302 /nfs/dbraw/zinc/75/03/02/566750302.db2.gz XZXWLBBLWWOOLK-ZDUSSCGKSA-N 0 0 386.189 3.214 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000516173167 566750928 /nfs/dbraw/zinc/75/09/28/566750928.db2.gz XALFFSUUKCUKQT-QWHCGFSZSA-N 0 0 376.210 3.225 20 5 GGBDRN Cc1cc(C(=O)N2CCOc3ncc(Br)cc32)ccc1[N+](=O)[O-] ZINC000561959533 566752489 /nfs/dbraw/zinc/75/24/89/566752489.db2.gz CZYSBSIUEPSDCP-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CCNc2ccsc2[N+](=O)[O-])s1 ZINC000609150134 566752770 /nfs/dbraw/zinc/75/27/70/566752770.db2.gz PUEIGNBJKGSSAD-UHFFFAOYSA-N 0 0 389.524 3.403 20 5 GGBDRN C[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488850007 566752823 /nfs/dbraw/zinc/75/28/23/566752823.db2.gz FDVYLGHPXRMIMF-MWLCHTKSSA-N 0 0 377.260 3.214 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCn1cc(Br)cn1 ZINC000516211366 566753532 /nfs/dbraw/zinc/75/35/32/566753532.db2.gz SJXXMIKDGLHHGW-UHFFFAOYSA-N 0 0 396.245 3.382 20 5 GGBDRN CNS(=O)(=O)c1ccc(N2CC(C)(C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000581153476 566753658 /nfs/dbraw/zinc/75/36/58/566753658.db2.gz UMACHBWBDGWFIR-HNNXBMFYSA-N 0 0 381.479 3.152 20 5 GGBDRN CN(Cc1cc(I)cc([N+](=O)[O-])c1)Cc1ccccn1 ZINC000516221423 566753636 /nfs/dbraw/zinc/75/36/36/566753636.db2.gz WXSOKLCZRZBWQZ-UHFFFAOYSA-N 0 0 383.189 3.226 20 5 GGBDRN CCCN(CC1CC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488864490 566754166 /nfs/dbraw/zinc/75/41/66/566754166.db2.gz WZEDUSLGTUHJSL-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@@H](C)Sc3ccccc32)ccc1[N+](=O)[O-] ZINC000469030491 566754960 /nfs/dbraw/zinc/75/49/60/566754960.db2.gz RDAVEPRWUSHXQN-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN CCCCN(C1CC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488886375 566755465 /nfs/dbraw/zinc/75/54/65/566755465.db2.gz PPPVAMPEKJAIJC-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000581187281 566757107 /nfs/dbraw/zinc/75/71/07/566757107.db2.gz RGJJFABIMDOKLQ-VIFPVBQESA-N 0 0 380.202 3.007 20 5 GGBDRN COC(=O)[C@@H](C)CSCc1cc(I)cc([N+](=O)[O-])c1 ZINC000562038214 566758994 /nfs/dbraw/zinc/75/89/94/566758994.db2.gz CKXYXUJADOJVBJ-QMMMGPOBSA-N 0 0 395.218 3.242 20 5 GGBDRN COC(=O)[C@H](C)CSCc1cc(I)cc([N+](=O)[O-])c1 ZINC000562038213 566759520 /nfs/dbraw/zinc/75/95/20/566759520.db2.gz CKXYXUJADOJVBJ-MRVPVSSYSA-N 0 0 395.218 3.242 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(Br)cc2)c([N+](=O)[O-])cc1OC ZINC000609322227 566759685 /nfs/dbraw/zinc/75/96/85/566759685.db2.gz TZYBXSQVBRHAQZ-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1c[nH]c2ccccc12 ZINC000516343649 566759812 /nfs/dbraw/zinc/75/98/12/566759812.db2.gz OVOVXCGRHKZTGW-UHFFFAOYSA-N 0 0 379.825 3.251 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N[C@H]1CCc2ccccc21 ZINC000488964904 566760065 /nfs/dbraw/zinc/76/00/65/566760065.db2.gz BEWHCIBIPZIKKP-ZDUSSCGKSA-N 0 0 397.250 3.323 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c(Cl)c1 ZINC000469125893 566763240 /nfs/dbraw/zinc/76/32/40/566763240.db2.gz YXASEQSOZZTCLL-UHFFFAOYSA-N 0 0 382.825 3.009 20 5 GGBDRN CC1(NS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CCCCC1 ZINC000609418516 566763454 /nfs/dbraw/zinc/76/34/54/566763454.db2.gz TYOGYCBUCHQLID-UHFFFAOYSA-N 0 0 377.260 3.358 20 5 GGBDRN Cc1ccc2c(c1)N(S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)CC2 ZINC000609411264 566763558 /nfs/dbraw/zinc/76/35/58/566763558.db2.gz PRQBNVLPUHPULO-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN COC(=O)CCc1csc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])n1 ZINC000489020249 566763728 /nfs/dbraw/zinc/76/37/28/566763728.db2.gz RPBNCEYSERYXKZ-UHFFFAOYSA-N 0 0 381.435 3.131 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCCCc1cccc(Br)c1 ZINC000609419682 566763977 /nfs/dbraw/zinc/76/39/77/566763977.db2.gz LURKIMHCBJALJJ-UHFFFAOYSA-N 0 0 399.266 3.268 20 5 GGBDRN Nc1c(C(=O)NCCCc2cccc(Br)c2)cc(F)cc1[N+](=O)[O-] ZINC000609416046 566764041 /nfs/dbraw/zinc/76/40/41/566764041.db2.gz QPWYZMQUFMCGCO-UHFFFAOYSA-N 0 0 396.216 3.441 20 5 GGBDRN C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000609410871 566764100 /nfs/dbraw/zinc/76/41/00/566764100.db2.gz BXKHGKLZISVGKG-SNVBAGLBSA-N 0 0 397.250 3.497 20 5 GGBDRN O=C(CCc1ccccc1Br)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000609455122 566765081 /nfs/dbraw/zinc/76/50/81/566765081.db2.gz KHJIWEWNJPLJOE-UHFFFAOYSA-N 0 0 393.237 3.485 20 5 GGBDRN O=C(COc1c(Cl)cccc1Cl)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000609455269 566765200 /nfs/dbraw/zinc/76/52/00/566765200.db2.gz LQXGUHDQKYONEM-UHFFFAOYSA-N 0 0 385.203 3.476 20 5 GGBDRN O=[N+]([O-])c1ccc(NS(=O)(=O)c2ccc(OCC(F)(F)F)cc2)cc1 ZINC000542000743 566766950 /nfs/dbraw/zinc/76/69/50/566766950.db2.gz NHSBLYXRRFUYER-UHFFFAOYSA-N 0 0 376.312 3.337 20 5 GGBDRN COc1ccc(NC(=O)c2cc3c(c(Br)c2)OCO3)cc1[N+](=O)[O-] ZINC000541995315 566767036 /nfs/dbraw/zinc/76/70/36/566767036.db2.gz NFPHFKQXXIRXJF-UHFFFAOYSA-N 0 0 395.165 3.347 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N(CCO)Cc1cccc(Br)c1 ZINC000489088263 566768120 /nfs/dbraw/zinc/76/81/20/566768120.db2.gz MJXRPAZEKWNJBG-UHFFFAOYSA-N 0 0 385.239 3.054 20 5 GGBDRN Cc1cc(C(=O)N(CCO)Cc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000489085947 566768524 /nfs/dbraw/zinc/76/85/24/566768524.db2.gz VNJKYQUSRDYIKP-UHFFFAOYSA-N 0 0 393.237 3.300 20 5 GGBDRN Cc1cc(Br)ccc1CNC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000609528144 566768567 /nfs/dbraw/zinc/76/85/67/566768567.db2.gz HOBFCGIEDFONQA-UHFFFAOYSA-N 0 0 378.226 3.394 20 5 GGBDRN Cc1cc(C(=O)N(CCO)Cc2cccc(Br)c2)cc([N+](=O)[O-])c1 ZINC000489094993 566769652 /nfs/dbraw/zinc/76/96/52/566769652.db2.gz ABOXVSLDBNQBEK-UHFFFAOYSA-N 0 0 393.237 3.300 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCc3c(Br)cccc3[C@H]2C)n1 ZINC000427372510 566770554 /nfs/dbraw/zinc/77/05/54/566770554.db2.gz NZAOACNOYKPIJI-SNVBAGLBSA-N 0 0 393.241 3.333 20 5 GGBDRN COc1ccc(NC(=O)NCc2ccc(O)c(Br)c2)cc1[N+](=O)[O-] ZINC000542028185 566770816 /nfs/dbraw/zinc/77/08/16/566770816.db2.gz CQACXERTKFHHMM-UHFFFAOYSA-N 0 0 396.197 3.393 20 5 GGBDRN CCc1n[nH]c(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1Br ZINC000469210705 566771841 /nfs/dbraw/zinc/77/18/41/566771841.db2.gz XIMOTWWZAVXNRZ-UHFFFAOYSA-N 0 0 395.257 3.396 20 5 GGBDRN C[C@@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccc(Br)cc1F ZINC000562222903 566771842 /nfs/dbraw/zinc/77/18/42/566771842.db2.gz CNSHFGSGJACWHB-SSDOTTSWSA-N 0 0 384.161 3.088 20 5 GGBDRN CC[N@H+](CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)CCC(F)(F)F ZINC000427414455 566772008 /nfs/dbraw/zinc/77/20/08/566772008.db2.gz PHHTZTIVUHJWNN-UHFFFAOYSA-N 0 0 381.782 3.181 20 5 GGBDRN Cc1cccc2c1OC[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C2 ZINC000516608821 566772354 /nfs/dbraw/zinc/77/23/54/566772354.db2.gz UOHGWSZMGGEBMF-AWEZNQCLSA-N 0 0 391.221 3.399 20 5 GGBDRN O=C(NCc1sccc1Br)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000562241284 566772916 /nfs/dbraw/zinc/77/29/16/566772916.db2.gz YJCSHPJASILWPN-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN O=C(Nc1cc(Br)ccc1O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000489178143 566773820 /nfs/dbraw/zinc/77/38/20/566773820.db2.gz UTTGZFFAKUCDSV-UHFFFAOYSA-N 0 0 381.138 3.044 20 5 GGBDRN COc1ccc(NC(=O)c2n[nH]c(C(C)C)c2Br)cc1[N+](=O)[O-] ZINC000542073272 566773797 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Cc1cc(S(=O)(=O)N(C)CCOc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000609673218 566780313 /nfs/dbraw/zinc/78/03/13/566780313.db2.gz NCMUDMLMUGZZEQ-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN O=C(c1ccsc1Br)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000451235992 566780656 /nfs/dbraw/zinc/78/06/56/566780656.db2.gz MDGIEGVPLVMSOW-UHFFFAOYSA-N 0 0 385.243 3.093 20 5 GGBDRN O=[N+]([O-])c1cncc(I)c1N1CCC[C@@H]1c1ccccn1 ZINC000581478623 566781411 /nfs/dbraw/zinc/78/14/11/566781411.db2.gz ITGWTJFDBOIRPV-GFCCVEGCSA-N 0 0 396.188 3.331 20 5 GGBDRN CC(C)N(Cc1cc(Br)ccc1F)C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000581477287 566782026 /nfs/dbraw/zinc/78/20/26/566782026.db2.gz MTUKVFSBNAFWSQ-UHFFFAOYSA-N 0 0 385.193 3.270 20 5 GGBDRN CC1(C)[C@@H](C(F)(F)F)CCN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000469332206 566782198 /nfs/dbraw/zinc/78/21/98/566782198.db2.gz LRROHFNUAUMKQU-ZDUSSCGKSA-N 0 0 380.388 3.130 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000609708447 566782286 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Cc1noc(C)c1N(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000610413920 566829682 /nfs/dbraw/zinc/82/96/82/566829682.db2.gz NECRIMHZNUGARD-UHFFFAOYSA-N 0 0 380.209 3.332 20 5 GGBDRN Cc1nc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)ccc1Br ZINC000610412254 566829833 /nfs/dbraw/zinc/82/98/33/566829833.db2.gz KGDQIFLPJYEPDN-UHFFFAOYSA-N 0 0 394.181 3.084 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000490132788 566832503 /nfs/dbraw/zinc/83/25/03/566832503.db2.gz LMZDYQJEBQZGER-VHSXEESVSA-N 0 0 381.376 3.023 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCNS(=O)(=O)c2cccc(Cl)c2Cl)cc1 ZINC000517601453 566833543 /nfs/dbraw/zinc/83/35/43/566833543.db2.gz GQSIDHBPLZNHOR-UHFFFAOYSA-N 0 0 391.232 3.259 20 5 GGBDRN O=C(N[C@@H](CCO)c1ccccc1Br)c1csc([N+](=O)[O-])c1 ZINC000542906332 566836366 /nfs/dbraw/zinc/83/63/66/566836366.db2.gz VFWPZXPRKCSFKS-LBPRGKRZSA-N 0 0 385.239 3.272 20 5 GGBDRN C[C@@H]1CC[C@H](N(C)S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000428392783 566837339 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GGBDRN COC(=O)[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccsc1 ZINC000470122269 566848163 /nfs/dbraw/zinc/84/81/63/566848163.db2.gz SPNIOGZBUDZATQ-GFCCVEGCSA-N 0 0 399.222 3.063 20 5 GGBDRN CCOC(=O)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000610622260 566848166 /nfs/dbraw/zinc/84/81/66/566848166.db2.gz VCHCATLCDJXZEU-UHFFFAOYSA-N 0 0 397.181 3.057 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccsc1 ZINC000470122276 566848271 /nfs/dbraw/zinc/84/82/71/566848271.db2.gz SPNIOGZBUDZATQ-LBPRGKRZSA-N 0 0 399.222 3.063 20 5 GGBDRN CCSc1cccc(CNS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000490424442 566849369 /nfs/dbraw/zinc/84/93/69/566849369.db2.gz ISQWOACCOCXNPW-UHFFFAOYSA-N 0 0 382.463 3.194 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470149850 566849800 /nfs/dbraw/zinc/84/98/00/566849800.db2.gz DRPOCXYSPRYZCI-UHFFFAOYSA-N 0 0 385.193 3.499 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@H](C)c2ccc(SC)cc2)c([N+](=O)[O-])c1 ZINC000543091912 566850438 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C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000490600306 566869199 /nfs/dbraw/zinc/86/91/99/566869199.db2.gz HLDOBWNEZROBFD-LLVKDONJSA-N 0 0 382.825 3.220 20 5 GGBDRN Cc1cnc(NC[C@@H](CO)Cc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000428679400 566869599 /nfs/dbraw/zinc/86/95/99/566869599.db2.gz KRDGYKOACFCFJX-ZDUSSCGKSA-N 0 0 380.242 3.324 20 5 GGBDRN Cc1sc(C(=O)N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000518185667 566870694 /nfs/dbraw/zinc/87/06/94/566870694.db2.gz YGXSJXVLNPEZTM-SNVBAGLBSA-N 0 0 379.825 3.153 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCn2c(nnc2C2CCCC2)C1 ZINC000428693620 566871301 /nfs/dbraw/zinc/87/13/01/566871301.db2.gz QOBCECLKXMELDY-UHFFFAOYSA-N 0 0 393.245 3.022 20 5 GGBDRN CC[C@H](NS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(C)(C)C ZINC000518211873 566872049 /nfs/dbraw/zinc/87/20/49/566872049.db2.gz KEJDRZSZXSFYKO-LBPRGKRZSA-N 0 0 379.276 3.460 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(C2CCC2)C2CCC2)c(Br)c1 ZINC000490633212 566872781 /nfs/dbraw/zinc/87/27/81/566872781.db2.gz UTIPAQNDAPLPDU-UHFFFAOYSA-N 0 0 389.271 3.453 20 5 GGBDRN C[C@@H](CN(C)C(=O)c1cc([N+](=O)[O-])ccc1SCCO)c1nccs1 ZINC000543375816 566873773 /nfs/dbraw/zinc/87/37/73/566873773.db2.gz NNQLSIJMZGHPQI-NSHDSACASA-N 0 0 381.479 3.011 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H](C(F)(F)F)O1 ZINC000610906198 566873920 /nfs/dbraw/zinc/87/39/20/566873920.db2.gz XMANYDUYVAQADU-HQJQHLMTSA-N 0 0 397.147 3.149 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N(CCCO)Cc1ccccc1 ZINC000610913891 566874117 /nfs/dbraw/zinc/87/41/17/566874117.db2.gz GVQOFTILSDPOBE-UHFFFAOYSA-N 0 0 393.237 3.382 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCOc2ccccc2C1 ZINC000610903953 566874673 /nfs/dbraw/zinc/87/46/73/566874673.db2.gz UMDSDTABZCSUNC-UHFFFAOYSA-N 0 0 377.194 3.392 20 5 GGBDRN O=[N+]([O-])c1ncccc1NCc1ccc(Br)cc1N1CCOCC1 ZINC000610909534 566874720 /nfs/dbraw/zinc/87/47/20/566874720.db2.gz IRKQZRDODNTDDQ-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCc2sc(Br)cc2C1 ZINC000610934111 566875119 /nfs/dbraw/zinc/87/51/19/566875119.db2.gz JIKDKLNKUKOVSA-UHFFFAOYSA-N 0 0 397.250 3.383 20 5 GGBDRN CSCCNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000610937865 566876210 /nfs/dbraw/zinc/87/62/10/566876210.db2.gz HAUDNIUIPCQEFO-UHFFFAOYSA-N 0 0 397.503 3.225 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1cccc(Br)c1 ZINC000518319381 566877192 /nfs/dbraw/zinc/87/71/92/566877192.db2.gz IFKWUOSYXMKQGB-UHFFFAOYSA-N 0 0 394.225 3.236 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2C3CCCC2CCC3)c(Br)c1 ZINC000610957785 566877392 /nfs/dbraw/zinc/87/73/92/566877392.db2.gz LMYQLWDUIFAZQF-UHFFFAOYSA-N 0 0 389.271 3.453 20 5 GGBDRN Cc1cccc2c1CCN2S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000610954027 566877613 /nfs/dbraw/zinc/87/76/13/566877613.db2.gz YLNNDZGALAAAFX-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCNS(=O)(=O)c2cc(Cl)ccc2Cl)cc1 ZINC000518318542 566877848 /nfs/dbraw/zinc/87/78/48/566877848.db2.gz HZGPZSNYMSMOHJ-UHFFFAOYSA-N 0 0 391.232 3.259 20 5 GGBDRN O=[N+]([O-])c1ccc2[nH]c(CN[C@H](CO)c3ccc(Br)cc3)nc2c1 ZINC000428791865 566879455 /nfs/dbraw/zinc/87/94/55/566879455.db2.gz UUFYMUWCOXDTOI-OAHLLOKOSA-N 0 0 391.225 3.057 20 5 GGBDRN COc1ccc(CN(C)c2ncc([N+](=O)[O-])c(C)c2Br)cc1O ZINC000543435394 566880168 /nfs/dbraw/zinc/88/01/68/566880168.db2.gz GDZYKVCYTYUFPO-UHFFFAOYSA-N 0 0 382.214 3.411 20 5 GGBDRN Cc1c(Br)c(NCc2cc(F)cc3c2OCOC3)ncc1[N+](=O)[O-] ZINC000543434556 566880196 /nfs/dbraw/zinc/88/01/96/566880196.db2.gz XSFOHTKMPPDCFE-UHFFFAOYSA-N 0 0 398.188 3.100 20 5 GGBDRN Cc1cnc(N2CCN(c3ncc([N+](=O)[O-])c(C)c3Br)CC2)s1 ZINC000543435204 566880466 /nfs/dbraw/zinc/88/04/66/566880466.db2.gz LDIKKBUBDQQTKD-UHFFFAOYSA-N 0 0 398.286 3.152 20 5 GGBDRN Cc1nn(C)c(Oc2cccc(F)c2I)c1[N+](=O)[O-] ZINC000611001752 566881216 /nfs/dbraw/zinc/88/12/16/566881216.db2.gz MTAWIBLPBSLTBB-UHFFFAOYSA-N 0 0 377.113 3.173 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCOC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000490847956 566882245 /nfs/dbraw/zinc/88/22/45/566882245.db2.gz KQGZJHTWBZRWJB-MAZHCROVSA-N 0 0 385.258 3.114 20 5 GGBDRN CC(=O)Nc1ccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000543437518 566882406 /nfs/dbraw/zinc/88/24/06/566882406.db2.gz WAFQUWGYCIHXDB-UHFFFAOYSA-N 0 0 379.214 3.053 20 5 GGBDRN CCN(CC)c1ccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)cn1 ZINC000543450881 566882669 /nfs/dbraw/zinc/88/26/69/566882669.db2.gz DKVILMVOXUYUFU-UHFFFAOYSA-N 0 0 394.273 3.336 20 5 GGBDRN Cc1c(Br)c(N(C)Cc2ccc([S@](C)=O)cc2)ncc1[N+](=O)[O-] ZINC000543437197 566883065 /nfs/dbraw/zinc/88/30/65/566883065.db2.gz VASNCQLODNLXFH-QHCPKHFHSA-N 0 0 398.282 3.435 20 5 GGBDRN CN(Cc1cccc(O)c1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000611019093 566883447 /nfs/dbraw/zinc/88/34/47/566883447.db2.gz QSFCUTYOWLMAFP-UHFFFAOYSA-N 0 0 391.232 3.428 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCOC[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000611072790 566885213 /nfs/dbraw/zinc/88/52/13/566885213.db2.gz NLMXSGURMRCKFN-AWEZNQCLSA-N 0 0 395.209 3.472 20 5 GGBDRN C[C@H](Cc1ccc(F)c(Br)c1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000582697912 566885319 /nfs/dbraw/zinc/88/53/19/566885319.db2.gz UXBAPAFTNCSZIV-MRVPVSSYSA-N 0 0 397.204 3.033 20 5 GGBDRN O=C(CN1CCc2ccc([N+](=O)[O-])cc21)Nc1ccc(Br)cc1F ZINC000543516053 566887805 /nfs/dbraw/zinc/88/78/05/566887805.db2.gz GCJAHCAINDMFGH-UHFFFAOYSA-N 0 0 394.200 3.498 20 5 GGBDRN C[C@@H]1OCC[C@@H]1Sc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000611086095 566887959 /nfs/dbraw/zinc/88/79/59/566887959.db2.gz NZSABXIFNRHHAZ-WFASDCNBSA-N 0 0 386.495 3.039 20 5 GGBDRN COc1ccc(CC(=O)Nc2ncc(C)cc2Br)cc1[N+](=O)[O-] ZINC000611094711 566888891 /nfs/dbraw/zinc/88/88/91/566888891.db2.gz VXDYQWRUDQCDQP-UHFFFAOYSA-N 0 0 380.198 3.251 20 5 GGBDRN Cc1cnc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c(Br)c1 ZINC000611094589 566888958 /nfs/dbraw/zinc/88/89/58/566888958.db2.gz RJARXOGGTSDJKK-UHFFFAOYSA-N 0 0 380.154 3.042 20 5 GGBDRN Cc1ccccc1OC[C@H](O)COc1ccc([N+](=O)[O-])cc1Br ZINC000611113125 566890990 /nfs/dbraw/zinc/89/09/90/566890990.db2.gz UQFLHXAWDLIGOP-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN Cc1ccccc1OC[C@@H](O)COc1ccc([N+](=O)[O-])cc1Br ZINC000611113124 566891678 /nfs/dbraw/zinc/89/16/78/566891678.db2.gz UQFLHXAWDLIGOP-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN CCO[C@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000451836021 566892525 /nfs/dbraw/zinc/89/25/25/566892525.db2.gz GNOOPXPTETYCQZ-RNCFNFMXSA-N 0 0 397.280 3.337 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)C(=O)N1CC[C@@H]2CCCC[C@@H]21 ZINC000582784209 566892934 /nfs/dbraw/zinc/89/29/34/566892934.db2.gz MZTONRFUVMBDKO-HZMBPMFUSA-N 0 0 396.241 3.087 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@@H](c2cccnc2)C1 ZINC000563536909 566893784 /nfs/dbraw/zinc/89/37/84/566893784.db2.gz IOKONBXNRSQAKX-GFCCVEGCSA-N 0 0 376.210 3.382 20 5 GGBDRN Cc1nc(C)c(S(=O)(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451852157 566895048 /nfs/dbraw/zinc/89/50/48/566895048.db2.gz NQRHXJXYJIVILV-AWEZNQCLSA-N 0 0 381.479 3.236 20 5 GGBDRN O=C(CCS(=O)(=O)c1ccc(Cl)cc1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470698449 566895985 /nfs/dbraw/zinc/89/59/85/566895985.db2.gz FJRWRQATFOKRJR-UHFFFAOYSA-N 0 0 386.788 3.190 20 5 GGBDRN CSc1ccc(C(=O)NC[C@H](CO)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000563567581 566896592 /nfs/dbraw/zinc/89/65/92/566896592.db2.gz ZDLHMPAHIDGWDS-GFCCVEGCSA-N 0 0 380.853 3.476 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000563583611 566898187 /nfs/dbraw/zinc/89/81/87/566898187.db2.gz UFKMYTURMSIMBO-JTQLQIEISA-N 0 0 382.825 3.394 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000563583612 566898347 /nfs/dbraw/zinc/89/83/47/566898347.db2.gz UFKMYTURMSIMBO-SNVBAGLBSA-N 0 0 382.825 3.394 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H](O)C(F)(F)F ZINC000543679226 566899720 /nfs/dbraw/zinc/89/97/20/566899720.db2.gz BWULAQYEAWKWKI-CYBMUJFWSA-N 0 0 380.388 3.482 20 5 GGBDRN Cc1occc1CNC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000611222420 566900123 /nfs/dbraw/zinc/90/01/23/566900123.db2.gz LPQAIFMTRJYYCF-UHFFFAOYSA-N 0 0 386.145 3.031 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1cc(Br)ccc1-n1cccn1 ZINC000518730939 566900125 /nfs/dbraw/zinc/90/01/25/566900125.db2.gz HXZLZXJLQGHUSY-UHFFFAOYSA-N 0 0 390.197 3.134 20 5 GGBDRN O=C(NC[C@H](O)COc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])s1 ZINC000518726975 566900258 /nfs/dbraw/zinc/90/02/58/566900258.db2.gz FADXDQSSBUUUGL-QMMMGPOBSA-N 0 0 391.232 3.133 20 5 GGBDRN C[S@](=O)c1ccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000611223553 566901759 /nfs/dbraw/zinc/90/17/59/566901759.db2.gz ZBVDRUJLYGZJSA-GKVSMKOHSA-N 0 0 376.459 3.220 20 5 GGBDRN CC[C@@H](Cc1ccccc1Br)NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000470751580 566901862 /nfs/dbraw/zinc/90/18/62/566901862.db2.gz NKFGTTJDCJDBFR-ZDUSSCGKSA-N 0 0 395.257 3.081 20 5 GGBDRN C[NH+](C)CCCC(C)(C)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000451893480 566903248 /nfs/dbraw/zinc/90/32/48/566903248.db2.gz QQSSOXAGQCVLTH-UHFFFAOYSA-N 0 0 398.312 3.300 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000470777325 566903435 /nfs/dbraw/zinc/90/34/35/566903435.db2.gz UILXZNCOFBHIHR-UHFFFAOYSA-N 0 0 377.447 3.034 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1nc2ccccc2s1 ZINC000470773192 566903609 /nfs/dbraw/zinc/90/36/09/566903609.db2.gz NOFXRLCVXFTUIN-UHFFFAOYSA-N 0 0 397.865 3.379 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NC1(c2cccc(Br)c2)CCC1 ZINC000543700948 566904470 /nfs/dbraw/zinc/90/44/70/566904470.db2.gz TWFKFJMBSUHZSG-UHFFFAOYSA-N 0 0 391.225 3.144 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCCO[C@H](c3ccccc3)C2)s1 ZINC000611281066 566905168 /nfs/dbraw/zinc/90/51/68/566905168.db2.gz HJOQFAKAPXFORU-AWEZNQCLSA-N 0 0 382.463 3.028 20 5 GGBDRN CN(Cc1cc(Br)cn1C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611286009 566905852 /nfs/dbraw/zinc/90/58/52/566905852.db2.gz VOXMYOQCKZTHCH-UHFFFAOYSA-N 0 0 396.241 3.099 20 5 GGBDRN CCc1nn(C)c(N2CCc3c(F)cc(Br)cc3C2)c1[N+](=O)[O-] ZINC000611281580 566906518 /nfs/dbraw/zinc/90/65/18/566906518.db2.gz YTXGCXPNRJEVAR-UHFFFAOYSA-N 0 0 383.221 3.355 20 5 GGBDRN Cc1ccncc1[C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000611299546 566907454 /nfs/dbraw/zinc/90/74/54/566907454.db2.gz FAADMLXDDGDJCE-LLVKDONJSA-N 0 0 378.226 3.481 20 5 GGBDRN O=C(Cc1cn2ccsc2n1)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000563680162 566907450 /nfs/dbraw/zinc/90/74/50/566907450.db2.gz OIYWAYOYEARUIL-UHFFFAOYSA-N 0 0 381.211 3.248 20 5 GGBDRN CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000563680104 566908058 /nfs/dbraw/zinc/90/80/58/566908058.db2.gz NGTIDPHXTAMDIL-HZMBPMFUSA-N 0 0 398.257 3.381 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000451922468 566908430 /nfs/dbraw/zinc/90/84/30/566908430.db2.gz LAKMOWUWWXIJOQ-LBPRGKRZSA-N 0 0 377.260 3.085 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCc2ccc(Br)cc2C1 ZINC000563703745 566908725 /nfs/dbraw/zinc/90/87/25/566908725.db2.gz SZIGKESHFHVPGY-UHFFFAOYSA-N 0 0 390.237 3.354 20 5 GGBDRN CCC1(O)CCC(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000611315590 566908956 /nfs/dbraw/zinc/90/89/56/566908956.db2.gz KIVMTMDFTBVABZ-UHFFFAOYSA-N 0 0 385.258 3.100 20 5 GGBDRN O=c1nc(SCCn2cc([N+](=O)[O-])cn2)[nH]c2sc3c(c21)CCCC3 ZINC000470842436 566909626 /nfs/dbraw/zinc/90/96/26/566909626.db2.gz ZERSCWOTUYVVRT-UHFFFAOYSA-N 0 0 377.451 3.173 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])NC1(c2cccc(Br)c2)CCC1 ZINC000543766154 566910034 /nfs/dbraw/zinc/91/00/34/566910034.db2.gz HVCOIBPSGUBIGT-UHFFFAOYSA-N 0 0 391.225 3.375 20 5 GGBDRN CC(C)(C)S(=O)(=O)N1CCC(Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000491550815 566910176 /nfs/dbraw/zinc/91/01/76/566910176.db2.gz ZBDHLEHEAUPQBQ-UHFFFAOYSA-N 0 0 375.878 3.253 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CC(c2cccc(Cl)c2)C1 ZINC000451925798 566910132 /nfs/dbraw/zinc/91/01/32/566910132.db2.gz GQRKLYARZPLDRT-UHFFFAOYSA-N 0 0 380.853 3.220 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2cc3c(cc2Cl)OCO3)cc1[N+](=O)[O-] ZINC000491571544 566910245 /nfs/dbraw/zinc/91/02/45/566910245.db2.gz FLUQKAKTAFHZCF-UHFFFAOYSA-N 0 0 384.797 3.395 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](CC)Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000470875946 566911159 /nfs/dbraw/zinc/91/11/59/566911159.db2.gz MMVRZTFCQSESOB-NSHDSACASA-N 0 0 395.257 3.394 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC(c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1 ZINC000451935780 566911209 /nfs/dbraw/zinc/91/12/09/566911209.db2.gz XUPVFLXBOVSILU-UHFFFAOYSA-N 0 0 382.825 3.045 20 5 GGBDRN CN([C@H]1CC[C@@H](C(F)(F)F)CC1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000582986833 566911706 /nfs/dbraw/zinc/91/17/06/566911706.db2.gz GABCWHVQHBLAHS-BETUJISGSA-N 0 0 380.388 3.478 20 5 GGBDRN O=C([C@@H]1SCCc2sccc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470891394 566912659 /nfs/dbraw/zinc/91/26/59/566912659.db2.gz YGGCRWRJQQDTDV-MRXNPFEDSA-N 0 0 376.459 3.277 20 5 GGBDRN O=C([C@H]1SCCc2sccc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470891393 566912848 /nfs/dbraw/zinc/91/28/48/566912848.db2.gz YGGCRWRJQQDTDV-INIZCTEOSA-N 0 0 376.459 3.277 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000611370603 566913065 /nfs/dbraw/zinc/91/30/65/566913065.db2.gz YHRBHIBJOOIQTD-SNVBAGLBSA-N 0 0 398.204 3.307 20 5 GGBDRN Cc1c(Br)c(N(CCO)Cc2cccc(F)c2)ncc1[N+](=O)[O-] ZINC000491598352 566913028 /nfs/dbraw/zinc/91/30/28/566913028.db2.gz FPNMSJZMHVQOLT-UHFFFAOYSA-N 0 0 384.205 3.199 20 5 GGBDRN CN([C@H](CO)CC(C)(C)C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000451945049 566912939 /nfs/dbraw/zinc/91/29/39/566912939.db2.gz IGCFWSBKVVIOBP-JTQLQIEISA-N 0 0 399.296 3.319 20 5 GGBDRN CN([C@@H](CO)CC(C)(C)C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000451945052 566913208 /nfs/dbraw/zinc/91/32/08/566913208.db2.gz IGCFWSBKVVIOBP-SNVBAGLBSA-N 0 0 399.296 3.319 20 5 GGBDRN CCS[C@H]1CCCC[C@@H]1NS(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1 ZINC000491613442 566913785 /nfs/dbraw/zinc/91/37/85/566913785.db2.gz REMYLOUOVBDBSL-JSGCOSHPSA-N 0 0 392.474 3.085 20 5 GGBDRN O=C(N[C@@H](CCO)c1ccccc1Br)c1ccc([N+](=O)[O-])s1 ZINC000543833700 566914208 /nfs/dbraw/zinc/91/42/08/566914208.db2.gz SCLZRBLUZQDMIQ-NSHDSACASA-N 0 0 385.239 3.272 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC(c2ccnn2CCO)CC1 ZINC000429205674 566914786 /nfs/dbraw/zinc/91/47/86/566914786.db2.gz RXWANZGHALNYCM-UHFFFAOYSA-N 0 0 385.251 3.474 20 5 GGBDRN O=C(N[C@H](CCO)c1ccccc1Br)c1ccc([N+](=O)[O-])s1 ZINC000543833699 566915097 /nfs/dbraw/zinc/91/50/97/566915097.db2.gz SCLZRBLUZQDMIQ-LLVKDONJSA-N 0 0 385.239 3.272 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H](CCO)c1ccccc1Br ZINC000543845226 566916539 /nfs/dbraw/zinc/91/65/39/566916539.db2.gz HJOSQOFOQJZWMX-OAHLLOKOSA-N 0 0 393.237 3.140 20 5 GGBDRN C[C@@H]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000429252887 566917021 /nfs/dbraw/zinc/91/70/21/566917021.db2.gz IQYZEBSYSXAVND-NXEZZACHSA-N 0 0 388.205 3.460 20 5 GGBDRN CN1C(=O)COc2cc(Nc3ccc(Br)cc3[N+](=O)[O-])ccc21 ZINC000543864832 566918230 /nfs/dbraw/zinc/91/82/30/566918230.db2.gz ZJNVWXLNGPUMOL-UHFFFAOYSA-N 0 0 378.182 3.456 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nn2cnnc2s1 ZINC000611480345 566919935 /nfs/dbraw/zinc/91/99/35/566919935.db2.gz RDBBFYLEROWJTB-UHFFFAOYSA-N 0 0 378.439 3.239 20 5 GGBDRN Cn1cc([C@@H]2N(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)CC2(C)C)cn1 ZINC000583089201 566920690 /nfs/dbraw/zinc/92/06/90/566920690.db2.gz MUDVLGHWVYGXEM-AWEZNQCLSA-N 0 0 393.241 3.314 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)S(C)(=O)=O ZINC000611472943 566920800 /nfs/dbraw/zinc/92/08/00/566920800.db2.gz PNWQRBCCVLDTML-UHFFFAOYSA-N 0 0 388.511 3.040 20 5 GGBDRN O=C(NC[C@@H]1COc2ccccc21)c1ccc(Br)cc1[N+](=O)[O-] ZINC000563840844 566921098 /nfs/dbraw/zinc/92/10/98/566921098.db2.gz GQLPBVWQSAHSFT-SNVBAGLBSA-N 0 0 377.194 3.263 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1Cc2cc(Br)ccc2O1 ZINC000470987526 566921694 /nfs/dbraw/zinc/92/16/94/566921694.db2.gz ZXZVFRJOEQAWKM-INIZCTEOSA-N 0 0 391.221 3.020 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2cnn(S(=O)(=O)c3ccc(F)c(Cl)c3)c2)c1 ZINC000611496320 566922020 /nfs/dbraw/zinc/92/20/20/566922020.db2.gz HOMUPFCQCNUKFY-UHFFFAOYSA-N 0 0 381.772 3.488 20 5 GGBDRN C[C@@H]1COc2ccccc2CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000543907548 566922117 /nfs/dbraw/zinc/92/21/17/566922117.db2.gz XQQMIUKHDRZHHO-LLVKDONJSA-N 0 0 382.825 3.220 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCOc2ccc(Br)cc2CCO)cc1 ZINC000429323212 566922704 /nfs/dbraw/zinc/92/27/04/566922704.db2.gz UAEGCCFZGMNTEQ-UHFFFAOYSA-N 0 0 382.210 3.350 20 5 GGBDRN CCOC(=O)c1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cn1 ZINC000543935345 566922845 /nfs/dbraw/zinc/92/28/45/566922845.db2.gz NZWAZGGWLUKOPF-UHFFFAOYSA-N 0 0 394.181 3.181 20 5 GGBDRN O=[N+]([O-])c1ccc(CN[C@H](CO)c2ccc(Br)c(F)c2)c(F)c1 ZINC000492059266 566923349 /nfs/dbraw/zinc/92/33/49/566923349.db2.gz GSIQHBNMTQEXTA-OAHLLOKOSA-N 0 0 387.180 3.459 20 5 GGBDRN C[C@@H](c1ccccc1)[C@H](CO)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000611508960 566923993 /nfs/dbraw/zinc/92/39/93/566923993.db2.gz VOKMTGNGJAEFPS-ZBEGNZNMSA-N 0 0 393.237 3.252 20 5 GGBDRN C[C@@H]1CC[C@H](N(CCO)S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000452019172 566924970 /nfs/dbraw/zinc/92/49/70/566924970.db2.gz YPLPXFCURZQCIE-KOLCDFICSA-N 0 0 397.280 3.073 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H]3CCCC[C@@H]32)c(Br)c1 ZINC000583142292 566924979 /nfs/dbraw/zinc/92/49/79/566924979.db2.gz LXYUKZJNMRBLOZ-GWCFXTLKSA-N 0 0 389.271 3.311 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2sc(Br)cc2C1 ZINC000611528855 566925291 /nfs/dbraw/zinc/92/52/91/566925291.db2.gz OMUHSHTZTUXMKV-UHFFFAOYSA-N 0 0 382.239 3.200 20 5 GGBDRN C[C@@H]1CC[C@@H](C(F)(F)F)CN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000611542419 566925324 /nfs/dbraw/zinc/92/53/24/566925324.db2.gz KGKUFMPBTOUWNK-DGCLKSJQSA-N 0 0 380.388 3.130 20 5 GGBDRN C[C@@H]1CC[C@@H](C(F)(F)F)CN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000611542572 566925650 /nfs/dbraw/zinc/92/56/50/566925650.db2.gz QQXWRMRLYHQEOB-DGCLKSJQSA-N 0 0 380.388 3.130 20 5 GGBDRN CN1CCOC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000611566300 566927321 /nfs/dbraw/zinc/92/73/21/566927321.db2.gz MWZJSDLTIGJYJX-CYBMUJFWSA-N 0 0 379.463 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc2ncnc(NCc3ccc(F)cc3Br)c2c1 ZINC000611708124 566933212 /nfs/dbraw/zinc/93/32/12/566933212.db2.gz JNYZRXDVTQHRLL-UHFFFAOYSA-N 0 0 377.173 3.474 20 5 GGBDRN CC(C)(C(=O)NCCCn1cc(Br)cn1)c1ccccc1[N+](=O)[O-] ZINC000583255028 566934051 /nfs/dbraw/zinc/93/40/51/566934051.db2.gz MBGJIEIRKBQBIS-UHFFFAOYSA-N 0 0 395.257 3.038 20 5 GGBDRN COCC[C@@H](Cc1ccco1)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000544068433 566934598 /nfs/dbraw/zinc/93/45/98/566934598.db2.gz MRDUXSARNIPAOZ-NSHDSACASA-N 0 0 397.225 3.328 20 5 GGBDRN Cc1ccccc1NC(=O)CCn1cc([N+](=O)[O-])c(C)c(Br)c1=O ZINC000544077574 566935383 /nfs/dbraw/zinc/93/53/83/566935383.db2.gz GUMRNECIKCMHEB-UHFFFAOYSA-N 0 0 394.225 3.165 20 5 GGBDRN O=[N+]([O-])c1ccc2ncnc(NCCNc3cccc(Br)c3)c2c1 ZINC000611714510 566935936 /nfs/dbraw/zinc/93/59/36/566935936.db2.gz URBJJMYMTCRAEO-UHFFFAOYSA-N 0 0 388.225 3.246 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOc2c(Cl)cccc21 ZINC000471207949 566936326 /nfs/dbraw/zinc/93/63/26/566936326.db2.gz PXSDHUCACYNAEZ-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCOc3c(Cl)cccc32)cc1C ZINC000471212374 566937720 /nfs/dbraw/zinc/93/77/20/566937720.db2.gz LFVGSQJJKWKISC-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000611755555 566937856 /nfs/dbraw/zinc/93/78/56/566937856.db2.gz CALLJRKERUNKGB-GXSJLCMTSA-N 0 0 381.376 3.023 20 5 GGBDRN CC(=O)N[C@H]1CC[C@H](C(F)(F)F)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000492669947 566937951 /nfs/dbraw/zinc/93/79/51/566937951.db2.gz QGAOENPCLAPMCG-SMDDNHRTSA-N 0 0 379.766 3.280 20 5 GGBDRN NS(=O)(=O)c1cccc(NC[C@H]2CCCC[C@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000564061013 566940208 /nfs/dbraw/zinc/94/02/08/566940208.db2.gz FIEPXIMVPCRKIQ-NXEZZACHSA-N 0 0 381.376 3.023 20 5 GGBDRN C[C@@H]1OCC[C@@]1(C)NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000544122720 566940875 /nfs/dbraw/zinc/94/08/75/566940875.db2.gz CRCWBDOKOPKNKM-LKFCYVNXSA-N 0 0 378.372 3.389 20 5 GGBDRN Nc1nc(Oc2cc(Br)cc(C(F)(F)F)c2)ncc1[N+](=O)[O-] ZINC000564065014 566941727 /nfs/dbraw/zinc/94/17/27/566941727.db2.gz XLZLDCWWXTXQLH-UHFFFAOYSA-N 0 0 379.092 3.371 20 5 GGBDRN COCCN(Cc1cc(Br)cs1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000492938775 566941846 /nfs/dbraw/zinc/94/18/46/566941846.db2.gz WIDVHGVVUSRYDB-UHFFFAOYSA-N 0 0 388.243 3.036 20 5 GGBDRN Cc1cc(C(=O)NCCCCn2cc(Br)cn2)cc([N+](=O)[O-])c1 ZINC000471277634 566942150 /nfs/dbraw/zinc/94/21/50/566942150.db2.gz NMNDCAOYSCDQII-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN CC(C)(C(=O)NCc1cc(Br)ccn1)c1ccccc1[N+](=O)[O-] ZINC000452144280 566942925 /nfs/dbraw/zinc/94/29/25/566942925.db2.gz FSJIXYKKFZPIGU-UHFFFAOYSA-N 0 0 378.226 3.346 20 5 GGBDRN O=C(NCCc1c[nH]c2cccc(Br)c12)c1cc([N+](=O)[O-])c[nH]1 ZINC000519491380 566943158 /nfs/dbraw/zinc/94/31/58/566943158.db2.gz QFQAKHZLQQNRHP-UHFFFAOYSA-N 0 0 377.198 3.139 20 5 GGBDRN CO[C@H]1CCCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000611933731 566944567 /nfs/dbraw/zinc/94/45/67/566944567.db2.gz ZBSGLCQQRAHZAM-JTQLQIEISA-N 0 0 383.253 3.091 20 5 GGBDRN COC[C@@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000564102723 566944752 /nfs/dbraw/zinc/94/47/52/566944752.db2.gz UHBVTSNZNJUHOI-MRXNPFEDSA-N 0 0 384.841 3.055 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@H]2CCC3(CCOCC3)[C@@H]2O)c(Br)c1 ZINC000519529602 566945054 /nfs/dbraw/zinc/94/50/54/566945054.db2.gz VNKWBCVQQASYSE-IAQYHMDHSA-N 0 0 385.258 3.337 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000452164714 566945197 /nfs/dbraw/zinc/94/51/97/566945197.db2.gz VWFXSLWJZZVQCT-CYBMUJFWSA-N 0 0 379.825 3.356 20 5 GGBDRN O=[N+]([O-])c1ccc(CCn2nnc(Cc3cccc(Br)c3)n2)cc1 ZINC000564096446 566945355 /nfs/dbraw/zinc/94/53/55/566945355.db2.gz DOJLJXMLXLNXER-UHFFFAOYSA-N 0 0 388.225 3.177 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NCCc2csc(C(C)C)n2)cc1[N+](=O)[O-] ZINC000493161364 566945445 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382.463 3.000 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1n[nH]c2ccc(F)cc21 ZINC000519589511 566949758 /nfs/dbraw/zinc/94/97/58/566949758.db2.gz UHPQYAUAZQPGIO-UHFFFAOYSA-N 0 0 393.172 3.355 20 5 GGBDRN CNC(=O)c1cc(Br)ccc1NCc1ccc([N+](=O)[O-])cc1OC ZINC000429812829 566951125 /nfs/dbraw/zinc/95/11/25/566951125.db2.gz ZQGNWSJKLBIBKL-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN CCCCCNS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC ZINC000493635074 566952501 /nfs/dbraw/zinc/95/25/01/566952501.db2.gz LPGPLVHUZQFQHE-UHFFFAOYSA-N 0 0 395.275 3.143 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1C[C@@H]2CC[C@H](O)[C@H]2C1 ZINC000612099801 566953536 /nfs/dbraw/zinc/95/35/36/566953536.db2.gz KTWKXGGBCMASDZ-FMSQNYNMSA-N 0 0 378.226 3.113 20 5 GGBDRN C[C@@H](Cc1ccccc1Br)Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000519618514 566953669 /nfs/dbraw/zinc/95/36/69/566953669.db2.gz ZEKVRBLERKJQAY-JTQLQIEISA-N 0 0 378.226 3.499 20 5 GGBDRN O=C(NC[C@@H](O)CCc1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000544336745 566954638 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ZINC000430316244 567007920 /nfs/dbraw/zinc/00/79/20/567007920.db2.gz PCVOVENPIJXOJZ-LLVKDONJSA-N 0 0 398.257 3.253 20 5 GGBDRN CC[C@@H](C)CN(C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430312484 567007982 /nfs/dbraw/zinc/00/79/82/567007982.db2.gz BOVWQAGAGZFUDZ-SECBINFHSA-N 0 0 386.246 3.109 20 5 GGBDRN NC(=O)CCSc1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000520496962 567008099 /nfs/dbraw/zinc/00/80/99/567008099.db2.gz CGHXYFNQHKNWGR-UHFFFAOYSA-N 0 0 379.825 3.468 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCC[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430330451 567009738 /nfs/dbraw/zinc/00/97/38/567009738.db2.gz JCVFZBUOSVKRTA-JOYOIKCWSA-N 0 0 398.257 3.299 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@H](C)[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430329117 567009837 /nfs/dbraw/zinc/00/98/37/567009837.db2.gz PIVGQWXTCGEGMD-VHSXEESVSA-N 0 0 398.257 3.109 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2[C@H](C)CC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430333093 567009919 /nfs/dbraw/zinc/00/99/19/567009919.db2.gz RKOQNMXEYGOCQH-RKDXNWHRSA-N 0 0 384.230 3.004 20 5 GGBDRN CCN(CC1CCC1)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430336435 567009970 /nfs/dbraw/zinc/00/99/70/567009970.db2.gz YRTMIQADGMGYIG-UHFFFAOYSA-N 0 0 398.257 3.253 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCC[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430330449 567010024 /nfs/dbraw/zinc/01/00/24/567010024.db2.gz JCVFZBUOSVKRTA-BXKDBHETSA-N 0 0 398.257 3.299 20 5 GGBDRN O=C(NC[C@H]1CCOC2(CCC2)C1)c1sc(Br)cc1[N+](=O)[O-] ZINC000452735317 567010950 /nfs/dbraw/zinc/01/09/50/567010950.db2.gz SQUXWZXEUDEGCP-VIFPVBQESA-N 0 0 389.271 3.498 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCC3(CC3)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430348489 567011022 /nfs/dbraw/zinc/01/10/22/567011022.db2.gz SKJRBOUMRCAOTG-UHFFFAOYSA-N 0 0 396.241 3.007 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC2CCCCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430351606 567011091 /nfs/dbraw/zinc/01/10/91/567011091.db2.gz CDIPXAVMTGTDFC-UHFFFAOYSA-N 0 0 398.257 3.443 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)[C@@H]2CC[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430347164 567011169 /nfs/dbraw/zinc/01/11/69/567011169.db2.gz WGOPXTAMAVYSMP-JOYOIKCWSA-N 0 0 398.257 3.251 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCCOc1cccc(Br)c1 ZINC000494609065 567011712 /nfs/dbraw/zinc/01/17/12/567011712.db2.gz NHJFCCZQZXMUKJ-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN NS(=O)(=O)c1c(NCCc2cc(Cl)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000520565894 567012637 /nfs/dbraw/zinc/01/26/37/567012637.db2.gz QMYFFVTXJLBUAR-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN C[C@@H]1CC2(CCC2)CN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000584128738 567013308 /nfs/dbraw/zinc/01/33/08/567013308.db2.gz UFPYZTKMBOZMDA-SNVBAGLBSA-N 0 0 396.241 3.087 20 5 GGBDRN Cc1cc(-c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)ncn1 ZINC000545016398 567014188 /nfs/dbraw/zinc/01/41/88/567014188.db2.gz SSKURRDRHLITAR-UHFFFAOYSA-N 0 0 376.170 3.097 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CC[C@@H](c2ccncc2)C1 ZINC000584140515 567015237 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CO[C@@H](c1noc(-c2cc([N+](=O)[O-])cn2C)n1)c1ccc(Br)cc1 ZINC000545102595 567020384 /nfs/dbraw/zinc/02/03/84/567020384.db2.gz LOPOBNGQOXAQDT-CYBMUJFWSA-N 0 0 393.197 3.482 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@@H]1CCCC1(F)F ZINC000452827549 567021076 /nfs/dbraw/zinc/02/10/76/567021076.db2.gz ZEYADAYTTXRACO-JTQLQIEISA-N 0 0 377.185 3.451 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1NCCNS(=O)(=O)c1cccc(Cl)c1 ZINC000520747992 567022161 /nfs/dbraw/zinc/02/21/61/567022161.db2.gz VRNJTKOJDAUCCG-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC[C@H](c2cccc(Br)c2)C1 ZINC000452839787 567022264 /nfs/dbraw/zinc/02/22/64/567022264.db2.gz FKXQFJKOPIXTDW-NSHDSACASA-N 0 0 392.209 3.088 20 5 GGBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)c1ccc(Br)cn1 ZINC000430574477 567023386 /nfs/dbraw/zinc/02/33/86/567023386.db2.gz SMTLBYLXZOZFEC-UHFFFAOYSA-N 0 0 394.225 3.493 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CC[C@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000452844541 567023998 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Cc1cc(OCC(=O)Nc2ccc(Br)c(C)n2)ccc1[N+](=O)[O-] ZINC000430681060 567028515 /nfs/dbraw/zinc/02/85/15/567028515.db2.gz DGHBMUKJGDYZBR-UHFFFAOYSA-N 0 0 380.198 3.387 20 5 GGBDRN COC[C@@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000520878254 567029280 /nfs/dbraw/zinc/02/92/80/567029280.db2.gz RNYHXPRNZIYONJ-MRXNPFEDSA-N 0 0 384.841 3.055 20 5 GGBDRN C[C@@H](Cc1ccsc1)NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000545208071 567029693 /nfs/dbraw/zinc/02/96/93/567029693.db2.gz ASOITQPUCYVLCR-NSHDSACASA-N 0 0 377.447 3.114 20 5 GGBDRN COC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1C ZINC000545219313 567030975 /nfs/dbraw/zinc/03/09/75/567030975.db2.gz VXPHYECSZSSSEJ-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN CCN([C@H]1CCOC(C)(C)C1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000584319892 567031097 /nfs/dbraw/zinc/03/10/97/567031097.db2.gz TXAOYOBSWHOAFU-LBPRGKRZSA-N 0 0 376.862 3.216 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)CSc2ccccc2[N+](=O)[O-])n1 ZINC000430749152 567032294 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Cc1c(Br)cc(C(=O)NC(C)(C)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000545291650 567036811 /nfs/dbraw/zinc/03/68/11/567036811.db2.gz ISJNQDDDFNTYOR-UHFFFAOYSA-N 0 0 381.230 3.064 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCc2ccc(Br)s2)c1[N+](=O)[O-] ZINC000521040911 567037805 /nfs/dbraw/zinc/03/78/05/567037805.db2.gz NOKPHFLGJRYWJH-UHFFFAOYSA-N 0 0 387.259 3.067 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NCCc1c[nH]c2cccc(Br)c12 ZINC000584382130 567037917 /nfs/dbraw/zinc/03/79/17/567037917.db2.gz FHLSZUFIIXCWKK-UHFFFAOYSA-N 0 0 391.225 3.150 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc1[N+](=O)[O-] ZINC000613455616 567038445 /nfs/dbraw/zinc/03/84/45/567038445.db2.gz OGSMRUWVUOTIME-JTQLQIEISA-N 0 0 378.431 3.234 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H](CO)C(C)C ZINC000452977130 567038437 /nfs/dbraw/zinc/03/84/37/567038437.db2.gz GREYKUXNMZDRIV-DZGCQCFKSA-N 0 0 387.274 3.376 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCN(c2cccc(Br)c2)CC1 ZINC000565094760 567038597 /nfs/dbraw/zinc/03/85/97/567038597.db2.gz VQFXKIKNHGFREJ-UHFFFAOYSA-N 0 0 394.273 3.209 20 5 GGBDRN Cc1cc(Br)ccc1S(=O)(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000472585067 567038883 /nfs/dbraw/zinc/03/88/83/567038883.db2.gz WBNHCHQNJRZADM-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@H]3CCC(=O)c4cccc2c43)cc1[N+](=O)[O-] ZINC000613455617 567038871 /nfs/dbraw/zinc/03/88/71/567038871.db2.gz OGSMRUWVUOTIME-SNVBAGLBSA-N 0 0 378.431 3.234 20 5 GGBDRN O=C(Nc1ccc(-c2nc[nH]n2)cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430926752 567040893 /nfs/dbraw/zinc/04/08/93/567040893.db2.gz HAPLCEVMOJEWMM-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN CC(C)(NS(=O)(=O)c1ccc(Br)o1)c1ccc([N+](=O)[O-])cc1 ZINC000545364732 567043209 /nfs/dbraw/zinc/04/32/09/567043209.db2.gz SDJMWNGOIALSHE-UHFFFAOYSA-N 0 0 389.227 3.164 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCCN3c4ccccc4C[C@H]3C2)c(Br)c1 ZINC000521130539 567043426 /nfs/dbraw/zinc/04/34/26/567043426.db2.gz HAJBMMOHQISUMN-AWEZNQCLSA-N 0 0 389.253 3.394 20 5 GGBDRN CN(Cc1c(Cl)cccc1Cl)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] ZINC000521147989 567043814 /nfs/dbraw/zinc/04/38/14/567043814.db2.gz LQFFKABLKOFMFD-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN COc1nc2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3C)cc2s1 ZINC000430981068 567044245 /nfs/dbraw/zinc/04/42/45/567044245.db2.gz VLPJHJVMEQXDEW-UHFFFAOYSA-N 0 0 379.419 3.322 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(Br)cc2)CCC1 ZINC000545373971 567045337 /nfs/dbraw/zinc/04/53/37/567045337.db2.gz CKRQLTSATAIQFO-UHFFFAOYSA-N 0 0 391.225 3.144 20 5 GGBDRN Cc1ccc(Br)c(OC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000453030311 567045737 /nfs/dbraw/zinc/04/57/37/567045737.db2.gz GXDWCEMVOBQIAT-LBPRGKRZSA-N 0 0 382.210 3.484 20 5 GGBDRN Nc1c(C(=O)NCc2cc(F)c(F)cc2Br)cccc1[N+](=O)[O-] ZINC000584461270 567045842 /nfs/dbraw/zinc/04/58/42/567045842.db2.gz OJCWJPHRPCUODI-UHFFFAOYSA-N 0 0 386.152 3.148 20 5 GGBDRN O=C(N[C@@H]1COc2ccccc2C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000431025972 567046960 /nfs/dbraw/zinc/04/69/60/567046960.db2.gz VHRJAWARJLKQKF-LBPRGKRZSA-N 0 0 377.194 3.091 20 5 GGBDRN O=C(NCCn1cnc2ccccc21)c1ccc(Br)cc1[N+](=O)[O-] ZINC000431017880 567047007 /nfs/dbraw/zinc/04/70/07/567047007.db2.gz CMHLVMWIHXJVPE-UHFFFAOYSA-N 0 0 389.209 3.137 20 5 GGBDRN Cc1ccc(Br)cc1NC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472690122 567046994 /nfs/dbraw/zinc/04/69/94/567046994.db2.gz ZJNULOGCZQDINR-UHFFFAOYSA-N 0 0 396.172 3.382 20 5 GGBDRN CC(C)(O)CCSc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000565226444 567050261 /nfs/dbraw/zinc/05/02/61/567050261.db2.gz LEVGFDNZBSJBGI-UHFFFAOYSA-N 0 0 388.511 3.023 20 5 GGBDRN Nc1ncc(Br)cc1CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000584518279 567050155 /nfs/dbraw/zinc/05/01/55/567050155.db2.gz DFKFFCZXXQQBLE-UHFFFAOYSA-N 0 0 392.135 3.191 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@H](O)Cc1ccccc1 ZINC000495193893 567051082 /nfs/dbraw/zinc/05/10/82/567051082.db2.gz ZKXCVLDIHKAFAL-MEDUHNTESA-N 0 0 393.237 3.079 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc2cccc(Br)c2n1 ZINC000545443717 567051127 /nfs/dbraw/zinc/05/11/27/567051127.db2.gz VULHDPSLWHAELU-UHFFFAOYSA-N 0 0 388.181 3.135 20 5 GGBDRN Cc1ncsc1NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000472817793 567052836 /nfs/dbraw/zinc/05/28/36/567052836.db2.gz IKLSGJIQCBRGLP-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN CO[C@H](c1ccccc1Cl)[C@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000545467182 567054147 /nfs/dbraw/zinc/05/41/47/567054147.db2.gz UAPHRPOUZZLWEF-ZBEGNZNMSA-N 0 0 384.841 3.303 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(/C=C\[C@H]3CCOC3)n2)c(Br)c1 ZINC000453151213 567057599 /nfs/dbraw/zinc/05/75/99/567057599.db2.gz STNGKWXSFVVOPP-GZXOQBQISA-N 0 0 380.198 3.381 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(/C=C/[C@@H]3CCOC3)n2)c(Br)c1 ZINC000453151215 567058087 /nfs/dbraw/zinc/05/80/87/567058087.db2.gz STNGKWXSFVVOPP-YEQXMLPJSA-N 0 0 380.198 3.381 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(/C=C/[C@H]3CCOC3)n2)c(Br)c1 ZINC000453151209 567058108 /nfs/dbraw/zinc/05/81/08/567058108.db2.gz STNGKWXSFVVOPP-DTWDLQQISA-N 0 0 380.198 3.381 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1nc(Cc2ccc(Cl)c(Cl)c2)no1 ZINC000545529130 567059444 /nfs/dbraw/zinc/05/94/44/567059444.db2.gz OIUCKJHQHJZISI-UHFFFAOYSA-N 0 0 381.175 3.085 20 5 GGBDRN O=C(C1CCC(Nc2ncc([N+](=O)[O-])cc2Cl)CC1)N1CCSCC1 ZINC000565356574 567059892 /nfs/dbraw/zinc/05/98/92/567059892.db2.gz QPGWRTXHTICCJM-UHFFFAOYSA-N 0 0 384.889 3.189 20 5 GGBDRN Cc1cc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])nn2C)ccc1Br ZINC000431151145 567060438 /nfs/dbraw/zinc/06/04/38/567060438.db2.gz NNQXPXJSBDOYIJ-ZDUSSCGKSA-N 0 0 393.241 3.377 20 5 GGBDRN Cc1sc(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1CS(C)(=O)=O ZINC000545552766 567061427 /nfs/dbraw/zinc/06/14/27/567061427.db2.gz LYYUVTIUTSIMBN-UHFFFAOYSA-N 0 0 379.419 3.226 20 5 GGBDRN Cc1nnc2ccc(C(=O)Nc3cc(Br)cc([N+](=O)[O-])c3C)cn12 ZINC000431178991 567064028 /nfs/dbraw/zinc/06/40/28/567064028.db2.gz KSXYYXSZTVWUEV-UHFFFAOYSA-N 0 0 390.197 3.269 20 5 GGBDRN Cc1cc(N2CC[S@](=O)C(C)(C)CC2)c(Br)cc1[N+](=O)[O-] ZINC000565403458 567066027 /nfs/dbraw/zinc/06/60/27/567066027.db2.gz KNANAVWWKSPFNZ-NRFANRHFSA-N 0 0 375.288 3.403 20 5 GGBDRN O=[N+]([O-])c1c[nH]c(-c2nc(-c3ccc(I)cc3)no2)c1 ZINC000545638968 567066704 /nfs/dbraw/zinc/06/67/04/567066704.db2.gz PTFYGTRQYWCCQU-UHFFFAOYSA-N 0 0 382.117 3.245 20 5 GGBDRN Cc1noc([C@H](C)N2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000584756828 567069481 /nfs/dbraw/zinc/06/94/81/567069481.db2.gz CFXPPKZMBMFVRL-VIFPVBQESA-N 0 0 386.239 3.476 20 5 GGBDRN Cc1ccc(-c2noc(CCn3cc([N+](=O)[O-])cn3)n2)c(Br)c1 ZINC000545692015 567069960 /nfs/dbraw/zinc/06/99/60/567069960.db2.gz XSJILHZJMXTSQZ-UHFFFAOYSA-N 0 0 378.186 3.155 20 5 GGBDRN Cc1ccc(Br)cc1Cc1noc(CCn2cc([N+](=O)[O-])cn2)n1 ZINC000453287187 567072552 /nfs/dbraw/zinc/07/25/52/567072552.db2.gz JCFKYRQYPKOSFF-UHFFFAOYSA-N 0 0 392.213 3.079 20 5 GGBDRN C[C@@H](c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1)n1cccn1 ZINC000545743453 567072502 /nfs/dbraw/zinc/07/25/02/567072502.db2.gz YQPTZDQJZQWVNC-VIFPVBQESA-N 0 0 378.186 3.137 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3cc(Br)ccc3C)no2)c1[N+](=O)[O-] ZINC000453288158 567072812 /nfs/dbraw/zinc/07/28/12/567072812.db2.gz JYYREQZQULDOGV-UHFFFAOYSA-N 0 0 392.213 3.348 20 5 GGBDRN COc1cc(Cl)ccc1CNS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000521688712 567074387 /nfs/dbraw/zinc/07/43/87/567074387.db2.gz GWMMNFDWYJYJRL-UHFFFAOYSA-N 0 0 384.841 3.352 20 5 GGBDRN CSc1cccc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000521725119 567075632 /nfs/dbraw/zinc/07/56/32/567075632.db2.gz DOXRPMTWPQHJHU-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(Cc3cc(F)ccc3Br)n2)nc1 ZINC000545779572 567076036 /nfs/dbraw/zinc/07/60/36/567076036.db2.gz VKKMAJHNUUBQCZ-UHFFFAOYSA-N 0 0 393.172 3.456 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCc3sc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000584870371 567077714 /nfs/dbraw/zinc/07/77/14/567077714.db2.gz LRCPTJFGJICWRX-NSHDSACASA-N 0 0 379.825 3.360 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccccc1Br ZINC000521771930 567078875 /nfs/dbraw/zinc/07/88/75/567078875.db2.gz ARAQWEPBDWIDDF-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@@H]1CCOc2ccccc21 ZINC000521775045 567079405 /nfs/dbraw/zinc/07/94/05/567079405.db2.gz PZVGDGZKDSMJCS-NSHDSACASA-N 0 0 382.825 3.093 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@](C)(O)C(F)(F)F ZINC000496739448 567079680 /nfs/dbraw/zinc/07/96/80/567079680.db2.gz QHEPFSTUCVJTKS-AWEZNQCLSA-N 0 0 380.388 3.386 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cn1 ZINC000585701199 567080568 /nfs/dbraw/zinc/08/05/68/567080568.db2.gz MKDASLQRZXKUKV-UHFFFAOYSA-N 0 0 394.225 3.342 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)C(=O)OC(C)C ZINC000585700984 567080940 /nfs/dbraw/zinc/08/09/40/567080940.db2.gz FXVJADDRIRCVGQ-JTQLQIEISA-N 0 0 387.230 3.078 20 5 GGBDRN CCC1(O)CCC(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CC1 ZINC000585701630 567080968 /nfs/dbraw/zinc/08/09/68/567080968.db2.gz XBNNHANSMORYIF-UHFFFAOYSA-N 0 0 385.258 3.479 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C12CCC2 ZINC000431442634 567081529 /nfs/dbraw/zinc/08/15/29/567081529.db2.gz BFMHTUVWJGXBAA-KGLIPLIRSA-N 0 0 383.242 3.435 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N=c1cc(CC(C)C)[nH][nH]1 ZINC000497001976 567081998 /nfs/dbraw/zinc/08/19/98/567081998.db2.gz NGRXYHPPHPIVKV-UHFFFAOYSA-N 0 0 381.230 3.262 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ncc(Cl)cc1Cl ZINC000585715493 567082751 /nfs/dbraw/zinc/08/27/51/567082751.db2.gz RJWFLJRTDAIYLC-UHFFFAOYSA-N 0 0 383.191 3.055 20 5 GGBDRN COC(=O)Cc1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000431453712 567082951 /nfs/dbraw/zinc/08/29/51/567082951.db2.gz XGTIBPUCGJQKTO-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN CN(CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000431513116 567085968 /nfs/dbraw/zinc/08/59/68/567085968.db2.gz RWMYFVPPSDIGQG-UHFFFAOYSA-N 0 0 378.226 3.224 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCc2cccc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000521920036 567086916 /nfs/dbraw/zinc/08/69/16/567086916.db2.gz WMCCNZMNSDQMSR-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN NS(=O)(=O)c1cccc(Oc2cnc3ccc(Cl)cc3c2)c1[N+](=O)[O-] ZINC000565673148 567087620 /nfs/dbraw/zinc/08/76/20/567087620.db2.gz AWNABYFVZUPTBO-UHFFFAOYSA-N 0 0 379.781 3.236 20 5 GGBDRN O=[N+]([O-])c1cccc(N2CCN(c3ncc(Br)cc3F)CC2)c1 ZINC000614122130 567088550 /nfs/dbraw/zinc/08/85/50/567088550.db2.gz WQUVJWFWTXDIPZ-UHFFFAOYSA-N 0 0 381.205 3.218 20 5 GGBDRN Cc1ccncc1N(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000545920438 567088931 /nfs/dbraw/zinc/08/89/31/567088931.db2.gz OQDCYVFSCDGBCN-UHFFFAOYSA-N 0 0 376.221 3.430 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(Cc2ccc(Br)cc2F)CC1 ZINC000453578744 567092033 /nfs/dbraw/zinc/09/20/33/567092033.db2.gz QLUGMEUYOPGISQ-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCN(Cc2cccc(F)c2Br)CC1 ZINC000453570518 567092100 /nfs/dbraw/zinc/09/21/00/567092100.db2.gz AJXZNOOBUPUFHJ-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN CC(C)OC(=O)CC[C@@H](C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000473626714 567093087 /nfs/dbraw/zinc/09/30/87/567093087.db2.gz PWRRBMQZEZVMPW-SNVBAGLBSA-N 0 0 387.230 3.207 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC3(CCC3)CC2)c(Br)c1 ZINC000586774369 567094842 /nfs/dbraw/zinc/09/48/42/567094842.db2.gz VCGXISZQCOEDLK-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN CC(C)[C@H]1N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000431606013 567095739 /nfs/dbraw/zinc/09/57/39/567095739.db2.gz BUXBHHUYMBSOOZ-CYBMUJFWSA-N 0 0 391.287 3.412 20 5 GGBDRN CC(C)[C@@H]1N(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000431607847 567096309 /nfs/dbraw/zinc/09/63/09/567096309.db2.gz WUGHIRQZOXDKFI-ZDUSSCGKSA-N 0 0 391.287 3.412 20 5 GGBDRN COc1cc(COc2ccc(Br)cc2C(N)=O)c([N+](=O)[O-])cc1F ZINC000565781363 567098194 /nfs/dbraw/zinc/09/81/94/567098194.db2.gz JLCIVOQEMJMHDK-UHFFFAOYSA-N 0 0 399.172 3.183 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000522080752 567098473 /nfs/dbraw/zinc/09/84/73/567098473.db2.gz GJCNALZFGXPVBY-CVEARBPZSA-N 0 0 391.221 3.408 20 5 GGBDRN CN(C)C(=O)c1cccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000431643279 567098919 /nfs/dbraw/zinc/09/89/19/567098919.db2.gz ABOLIOOPWWCBST-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN CC(=O)c1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])nc1C ZINC000497470292 567100500 /nfs/dbraw/zinc/10/05/00/567100500.db2.gz GCMBFQDJHCSVRZ-UHFFFAOYSA-N 0 0 392.209 3.193 20 5 GGBDRN COCc1cnc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)s1 ZINC000586916602 567103337 /nfs/dbraw/zinc/10/33/37/567103337.db2.gz YRVUUPMYIGVUEE-UHFFFAOYSA-N 0 0 386.227 3.141 20 5 GGBDRN CN(CCOc1ccccc1Cl)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000546092438 567103435 /nfs/dbraw/zinc/10/34/35/567103435.db2.gz NHSJJRRUFMLIHT-UHFFFAOYSA-N 0 0 384.841 3.089 20 5 GGBDRN CCS(=O)(=O)N1CCC(Nc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000587105450 567103442 /nfs/dbraw/zinc/10/34/42/567103442.db2.gz USGAOIUWMLKFOE-UHFFFAOYSA-N 0 0 382.269 3.128 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000546074486 567103794 /nfs/dbraw/zinc/10/37/94/567103794.db2.gz VHFCOXATOZPUDN-YPMHNXCESA-N 0 0 380.388 3.383 20 5 GGBDRN Cc1n[nH]c(C(=O)NCC2(c3cccc(Br)c3)CCC2)c1[N+](=O)[O-] ZINC000522201376 567104460 /nfs/dbraw/zinc/10/44/60/567104460.db2.gz MHXQBEQYSCORNM-UHFFFAOYSA-N 0 0 393.241 3.241 20 5 GGBDRN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000587520097 567104517 /nfs/dbraw/zinc/10/45/17/567104517.db2.gz VRLPHGDJBCTCCL-RLTXXFFMSA-N 0 0 395.253 3.161 20 5 GGBDRN Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NCc3csc(Br)c3)cc21 ZINC000587197493 567104639 /nfs/dbraw/zinc/10/46/39/567104639.db2.gz YWNVVMFJQGLWON-UHFFFAOYSA-N 0 0 397.254 3.221 20 5 GGBDRN CNC(=O)c1ccc(Nc2cc(Br)cc(OC)c2)c([N+](=O)[O-])c1 ZINC000497523200 567104835 /nfs/dbraw/zinc/10/48/35/567104835.db2.gz PUCTZNGPUNPLRO-UHFFFAOYSA-N 0 0 380.198 3.469 20 5 GGBDRN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000587520184 567104859 /nfs/dbraw/zinc/10/48/59/567104859.db2.gz FUWQVVKXKBMUOM-OORQEUNZSA-N 0 0 382.869 3.222 20 5 GGBDRN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000587520182 567104868 /nfs/dbraw/zinc/10/48/68/567104868.db2.gz FUWQVVKXKBMUOM-CPTIBSQESA-N 0 0 382.869 3.222 20 5 GGBDRN Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NCc3sccc3Br)cc21 ZINC000587586334 567104952 /nfs/dbraw/zinc/10/49/52/567104952.db2.gz LKNONLIBQULWIH-UHFFFAOYSA-N 0 0 397.254 3.221 20 5 GGBDRN CS(=O)(=O)c1cccc(NCCSCc2ccccc2F)c1[N+](=O)[O-] ZINC000497536268 567106580 /nfs/dbraw/zinc/10/65/80/567106580.db2.gz YJRMHHBRDWQQJA-UHFFFAOYSA-N 0 0 384.454 3.483 20 5 GGBDRN Cc1nc(C)n(C[C@@H]2CN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CCO2)n1 ZINC000587957561 567106700 /nfs/dbraw/zinc/10/67/00/567106700.db2.gz LVTNFUOTLHEDMY-LBPRGKRZSA-N 0 0 386.239 3.015 20 5 GGBDRN Cc1ccc(Br)c(S(=O)(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000497533231 567106645 /nfs/dbraw/zinc/10/66/45/567106645.db2.gz MKQKSXHIHCIHAL-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CCSc1nnc(Sc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])s1 ZINC000497542772 567107641 /nfs/dbraw/zinc/10/76/41/567107641.db2.gz IAQUQGQJTDGQRX-UHFFFAOYSA-N 0 0 377.494 3.113 20 5 GGBDRN COc1ccc(C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c(Br)c1 ZINC000522249458 567108237 /nfs/dbraw/zinc/10/82/37/567108237.db2.gz DFMCMQLZQLJBEW-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CCN(CCC1CC1)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000546161811 567110425 /nfs/dbraw/zinc/11/04/25/567110425.db2.gz KCPNGUDZZKJIAC-UHFFFAOYSA-N 0 0 388.205 3.462 20 5 GGBDRN CC(C)[C@H]1CN(Cc2cc(I)cc([N+](=O)[O-])c2)CCO1 ZINC000565920647 567111685 /nfs/dbraw/zinc/11/16/85/567111685.db2.gz ZQPXZVUQOOLTCR-CQSZACIVSA-N 0 0 390.221 3.056 20 5 GGBDRN C[C@@H](Oc1ccc([N+](=O)[O-])c(CO)c1)C(=O)Nc1ccccc1Br ZINC000431885142 567113951 /nfs/dbraw/zinc/11/39/51/567113951.db2.gz XLGRHSPIMDYKDT-SNVBAGLBSA-N 0 0 395.209 3.256 20 5 GGBDRN 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O=[N+]([O-])c1cccc2c1CCN2S(=O)(=O)c1cccc(Br)c1 ZINC000523416810 567157656 /nfs/dbraw/zinc/15/76/56/567157656.db2.gz DNDGKFOQBOJLDJ-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCc3c2cccc3[N+](=O)[O-])ccc1Br ZINC000523417198 567157918 /nfs/dbraw/zinc/15/79/18/567157918.db2.gz USGFUHPVJHIUKY-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000546777073 567158247 /nfs/dbraw/zinc/15/82/47/567158247.db2.gz MVVQZCDSEGIRBM-FZMZJTMJSA-N 0 0 384.816 3.363 20 5 GGBDRN CCCOc1ccc(OCCn2cc([N+](=O)[O-])cc(Br)c2=O)cc1 ZINC000474331206 567158859 /nfs/dbraw/zinc/15/88/59/567158859.db2.gz RRCXAHFOQPSMEK-UHFFFAOYSA-N 0 0 397.225 3.387 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1cnc3ccsc3c1)CCC2 ZINC000546793811 567159383 /nfs/dbraw/zinc/15/93/83/567159383.db2.gz IYGRPLBIYDJHLY-UHFFFAOYSA-N 0 0 375.431 3.346 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1cc(-c2cccs2)on1 ZINC000474339005 567160436 /nfs/dbraw/zinc/16/04/36/567160436.db2.gz UFEOOIYVPZHYAJ-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ncc(-c2cccs2)o1 ZINC000474336919 567160794 /nfs/dbraw/zinc/16/07/94/567160794.db2.gz KEAVFZRQPBZATQ-UHFFFAOYSA-N 0 0 382.195 3.284 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cc(Cl)c1=O)Nc1ccc(Cl)c(Cl)c1 ZINC000474338213 567161198 /nfs/dbraw/zinc/16/11/98/567161198.db2.gz RCODGVHZIXCUSN-UHFFFAOYSA-N 0 0 376.583 3.355 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1coc(-c2ccccc2)n1 ZINC000474350457 567161947 /nfs/dbraw/zinc/16/19/47/567161947.db2.gz KHMJAUWSNLPPJM-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=[N+]([O-])c1cnc(NCCOc2ccc3cc(Br)ccc3c2)nc1 ZINC000546857396 567165158 /nfs/dbraw/zinc/16/51/58/567165158.db2.gz CWMJDPJWUJVIGM-UHFFFAOYSA-N 0 0 389.209 3.213 20 5 GGBDRN COc1cc(Br)cc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000498303483 567166248 /nfs/dbraw/zinc/16/62/48/567166248.db2.gz KTELOZNGHCVMLJ-UHFFFAOYSA-N 0 0 394.225 3.441 20 5 GGBDRN COc1cc(Br)cc(NC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000498310366 567166632 /nfs/dbraw/zinc/16/66/32/567166632.db2.gz SEUYPHVTQMKNAD-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](CO)c2ccccc21 ZINC000498308004 567166699 /nfs/dbraw/zinc/16/66/99/567166699.db2.gz CPUIMJLHISPGCH-NSHDSACASA-N 0 0 391.221 3.402 20 5 GGBDRN Cc1n[nH]c(C(=O)NC2(c3cccc(Br)c3)CCC2)c1[N+](=O)[O-] ZINC000523685301 567168138 /nfs/dbraw/zinc/16/81/38/567168138.db2.gz LRVMRLVTXRHUKE-UHFFFAOYSA-N 0 0 379.214 3.198 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](c2ccccc2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000589230143 567168250 /nfs/dbraw/zinc/16/82/50/567168250.db2.gz SOXDIACNHCEZAA-OAHLLOKOSA-N 0 0 384.479 3.003 20 5 GGBDRN CC(C)c1noc(OCc2cc(I)cc([N+](=O)[O-])c2)n1 ZINC000589255982 567169980 /nfs/dbraw/zinc/16/99/80/567169980.db2.gz UEINFFMBCLOPSI-UHFFFAOYSA-N 0 0 389.149 3.285 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc2sccc2c1 ZINC000589235161 567170069 /nfs/dbraw/zinc/17/00/69/567170069.db2.gz NHKFMCOCMSAJGK-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@](=O)C[C@@H](C)C1 ZINC000432588686 567170601 /nfs/dbraw/zinc/17/06/01/567170601.db2.gz QHOOLAJQSKGJEM-CANCMXDXSA-N 0 0 384.523 3.328 20 5 GGBDRN CN(C)c1ccccc1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000474434435 567171623 /nfs/dbraw/zinc/17/16/23/567171623.db2.gz LJLFDMQWAIBBKF-UHFFFAOYSA-N 0 0 378.226 3.353 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2ncc(Br)s2)cccc1[N+](=O)[O-] ZINC000432632084 567174436 /nfs/dbraw/zinc/17/44/36/567174436.db2.gz JDSWJMDAYLEIGZ-UHFFFAOYSA-N 0 0 391.268 3.237 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)c(Cl)c1 ZINC000523864292 567174573 /nfs/dbraw/zinc/17/45/73/567174573.db2.gz LSGIZXLZQFXWGS-TVQRCGJNSA-N 0 0 388.779 3.361 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CNCc2ccc(F)cn2)c1 ZINC000589315673 567175501 /nfs/dbraw/zinc/17/55/01/567175501.db2.gz PGPZPALWYODYMY-UHFFFAOYSA-N 0 0 387.152 3.023 20 5 GGBDRN CCn1cc(Br)cc1-c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000546963263 567175589 /nfs/dbraw/zinc/17/55/89/567175589.db2.gz YGOPHKCMHRHTKY-UHFFFAOYSA-N 0 0 378.186 3.478 20 5 GGBDRN CN1C(=O)COc2ccc(Nc3ccc([N+](=O)[O-])cc3Br)cc21 ZINC000498423120 567176685 /nfs/dbraw/zinc/17/66/85/567176685.db2.gz ONBBYSAZZNUEEK-UHFFFAOYSA-N 0 0 378.182 3.456 20 5 GGBDRN COc1ccc(-c2nc(-c3cncc(Br)c3)no2)cc1[N+](=O)[O-] ZINC000547019612 567178321 /nfs/dbraw/zinc/17/83/21/567178321.db2.gz CEFBMNLSWSAKSQ-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2nnnn2-c2ccc3c(c2)OCO3)c(Cl)c1 ZINC000523969368 567178699 /nfs/dbraw/zinc/17/86/99/567178699.db2.gz KOJABYSXCQEWDL-UHFFFAOYSA-N 0 0 377.769 3.104 20 5 GGBDRN Cc1nn(CCC(=O)NCCc2cccc(Cl)c2Cl)c(C)c1[N+](=O)[O-] ZINC000523944295 567178751 /nfs/dbraw/zinc/17/87/51/567178751.db2.gz IFKSJMIKCOHOGD-UHFFFAOYSA-N 0 0 385.251 3.464 20 5 GGBDRN O=C(Nc1ccc2nc[nH]c(=O)c2c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000432681146 567180586 /nfs/dbraw/zinc/18/05/86/567180586.db2.gz XFTBVCFXEMBZSE-UHFFFAOYSA-N 0 0 389.165 3.258 20 5 GGBDRN O=C(NCc1ccc2c(c1)COC2)c1ccc([N+](=O)[O-])cc1Br ZINC000432718769 567182088 /nfs/dbraw/zinc/18/20/88/567182088.db2.gz QMXWNPIGHKNYAK-UHFFFAOYSA-N 0 0 377.194 3.318 20 5 GGBDRN CCCCCS(=O)(=O)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000589551222 567183118 /nfs/dbraw/zinc/18/31/18/567183118.db2.gz HFPRDDZSVNJXKZ-UHFFFAOYSA-N 0 0 397.234 3.304 20 5 GGBDRN O=[N+]([O-])c1c[nH]c(-c2nc(Cc3cc4c(cc3Br)OCO4)no2)c1 ZINC000547100619 567183190 /nfs/dbraw/zinc/18/31/90/567183190.db2.gz UIOXNGXGEFWKPR-UHFFFAOYSA-N 0 0 393.153 3.055 20 5 GGBDRN C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(F)c(Br)c1 ZINC000589573783 567184533 /nfs/dbraw/zinc/18/45/33/567184533.db2.gz DHMYUEISZLLRFA-SSDOTTSWSA-N 0 0 383.177 3.163 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000474657801 567187283 /nfs/dbraw/zinc/18/72/83/567187283.db2.gz GUZWLTBTYAVFMK-JTQLQIEISA-N 0 0 393.610 3.157 20 5 GGBDRN O=[N+]([O-])c1cnc(NC[C@@]2(CO)C[C@@H]2c2ccccc2)c(Br)c1 ZINC000589603275 567187484 /nfs/dbraw/zinc/18/74/84/567187484.db2.gz RRZJFIRSQAHCMX-CZUORRHYSA-N 0 0 378.226 3.330 20 5 GGBDRN CCc1cc(-c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)n[nH]1 ZINC000547176762 567188264 /nfs/dbraw/zinc/18/82/64/567188264.db2.gz VGYYQVAQGOCJHX-UHFFFAOYSA-N 0 0 378.186 3.284 20 5 GGBDRN O=c1[nH]cc(Br)cc1Cc1noc(-c2ccc([N+](=O)[O-])s2)n1 ZINC000547174473 567188480 /nfs/dbraw/zinc/18/84/80/567188480.db2.gz GUUWUUGHOIWVCI-UHFFFAOYSA-N 0 0 383.183 3.160 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(Cc3ccc(F)cc3Br)n2)n1C ZINC000566764768 567188949 /nfs/dbraw/zinc/18/89/49/567188949.db2.gz YTBMOSGUPCTJAV-UHFFFAOYSA-N 0 0 396.176 3.179 20 5 GGBDRN COc1cc(Cc2noc(-c3ccc(Br)cn3)n2)ccc1[N+](=O)[O-] ZINC000547199138 567189802 /nfs/dbraw/zinc/18/98/02/567189802.db2.gz VFVCTAYWTBEURG-UHFFFAOYSA-N 0 0 391.181 3.402 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(Cc2ccc(Br)cc2C)no1 ZINC000547179092 567189827 /nfs/dbraw/zinc/18/98/27/567189827.db2.gz LHRCKMMUBIMDMR-UHFFFAOYSA-N 0 0 392.213 3.193 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(-c3cncc(I)c3)n2)c1 ZINC000566811235 567192214 /nfs/dbraw/zinc/19/22/14/567192214.db2.gz XPKPGNSYNPZCIT-UHFFFAOYSA-N 0 0 394.128 3.311 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3ccc4n[nH]nc4c3)no2)c(Br)c1 ZINC000589820926 567193414 /nfs/dbraw/zinc/19/34/14/567193414.db2.gz HCGIWUKSHJKRBY-UHFFFAOYSA-N 0 0 387.153 3.346 20 5 GGBDRN COc1cccc(N2CC[C@H](Nc3ncc(Br)cc3[N+](=O)[O-])C2)c1 ZINC000474769967 567197869 /nfs/dbraw/zinc/19/78/69/567197869.db2.gz DQNUPHYFFDKNGJ-LBPRGKRZSA-N 0 0 393.241 3.452 20 5 GGBDRN COCCOc1ccc(CNc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000474778662 567198666 /nfs/dbraw/zinc/19/86/66/567198666.db2.gz CSPTUKYGMNKARY-UHFFFAOYSA-N 0 0 382.214 3.390 20 5 GGBDRN COC(=O)c1ccc(CCNc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000474790068 567199031 /nfs/dbraw/zinc/19/90/31/567199031.db2.gz XZBVYLCJWHJJJH-UHFFFAOYSA-N 0 0 380.198 3.194 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1NC1CCN(Cc2ccc(Br)cc2)CC1 ZINC000474790279 567199114 /nfs/dbraw/zinc/19/91/14/567199114.db2.gz MEGLVVPUGVXLOT-UHFFFAOYSA-N 0 0 394.273 3.167 20 5 GGBDRN CC[C@@H](COCC(F)(F)F)NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000454801959 567202962 /nfs/dbraw/zinc/20/29/62/567202962.db2.gz RMRJEMIAVDTULZ-JTQLQIEISA-N 0 0 383.754 3.405 20 5 GGBDRN COC(=O)C[C@H](C)SCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000524535354 567203107 /nfs/dbraw/zinc/20/31/07/567203107.db2.gz BHZAZDHPABPHNV-QMMMGPOBSA-N 0 0 380.344 3.237 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000524576675 567204659 /nfs/dbraw/zinc/20/46/59/567204659.db2.gz RJUYEORVCOQCHP-SNVBAGLBSA-N 0 0 385.239 3.397 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)Nc2ccc3c(c2)CCO3)c1 ZINC000524568459 567204866 /nfs/dbraw/zinc/20/48/66/567204866.db2.gz NQEUQTGESOSOHZ-UHFFFAOYSA-N 0 0 399.222 3.093 20 5 GGBDRN C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCC1(F)F ZINC000566946619 567204875 /nfs/dbraw/zinc/20/48/75/567204875.db2.gz MWGCSAHFEXRTES-VIFPVBQESA-N 0 0 377.185 3.404 20 5 GGBDRN O=C(Nc1ccn(-c2ccc(Br)cc2)n1)c1ccc([N+](=O)[O-])s1 ZINC000498869082 567205536 /nfs/dbraw/zinc/20/55/36/567205536.db2.gz WAJOANPZIFSFCG-UHFFFAOYSA-N 0 0 393.222 3.279 20 5 GGBDRN CC[C@H]1Cc2c(Br)cccc2CN1CCn1cc([N+](=O)[O-])cn1 ZINC000566954079 567206711 /nfs/dbraw/zinc/20/67/11/567206711.db2.gz ZVZYXJCYGLNJMN-ZDUSSCGKSA-N 0 0 379.258 3.391 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NC[C@]2(O)CCSC2)cc1[N+](=O)[O-] ZINC000474883776 567206889 /nfs/dbraw/zinc/20/68/89/567206889.db2.gz XQVJZJYOHJMPDB-QGZVFWFLSA-N 0 0 384.523 3.331 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H]1Cc2ccccc2O1 ZINC000566975997 567207429 /nfs/dbraw/zinc/20/74/29/567207429.db2.gz HOYQLCFKBHHSCQ-CYBMUJFWSA-N 0 0 378.837 3.460 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H]1Cc2ccccc2O1 ZINC000566975998 567207467 /nfs/dbraw/zinc/20/74/67/567207467.db2.gz HOYQLCFKBHHSCQ-ZDUSSCGKSA-N 0 0 378.837 3.460 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(Br)c1 ZINC000498904783 567209961 /nfs/dbraw/zinc/20/99/61/567209961.db2.gz KTPCZTVQBWAROF-MRXNPFEDSA-N 0 0 390.237 3.030 20 5 GGBDRN CCCN(CC(F)F)c1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-] ZINC000498931453 567213924 /nfs/dbraw/zinc/21/39/24/567213924.db2.gz URBPDZKSENFXDR-UHFFFAOYSA-N 0 0 379.429 3.107 20 5 GGBDRN C[C@@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])Oc1ccc(Br)cc1 ZINC000567070307 567214858 /nfs/dbraw/zinc/21/48/58/567214858.db2.gz PHPUYCBZYWUPLG-JTQLQIEISA-N 0 0 394.225 3.336 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N(Cc1cccc(Br)c1)CC1CC1 ZINC000474971556 567215225 /nfs/dbraw/zinc/21/52/25/567215225.db2.gz TUOYBTTUJITHGY-UHFFFAOYSA-N 0 0 393.241 3.143 20 5 GGBDRN COc1c(C(=O)NCc2cc(F)ccc2Br)cccc1[N+](=O)[O-] ZINC000475014041 567219528 /nfs/dbraw/zinc/21/95/28/567219528.db2.gz GOMXAEUSIDBALN-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN CCC(O)(CC)C(C)(C)CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000567124504 567220225 /nfs/dbraw/zinc/22/02/25/567220225.db2.gz JCPWNJMDRMNBKA-UHFFFAOYSA-N 0 0 378.878 3.104 20 5 GGBDRN COc1c(C(=O)NCCOc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000475034471 567221604 /nfs/dbraw/zinc/22/16/04/567221604.db2.gz RXQRQQQAXNJROI-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1C[C@H](CO)Cc2ccccc21 ZINC000590406131 567224206 /nfs/dbraw/zinc/22/42/06/567224206.db2.gz IYYCNSJAHXIORH-LLVKDONJSA-N 0 0 391.221 3.169 20 5 GGBDRN Cc1cc(N[C@H]2CCCc3c2cnn3CCO)c(Br)cc1[N+](=O)[O-] ZINC000616055640 567224282 /nfs/dbraw/zinc/22/42/82/567224282.db2.gz GGPMDLQYLDRRFQ-ZDUSSCGKSA-N 0 0 395.257 3.344 20 5 GGBDRN O=C(NC[C@H]1CCCN(CC(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000590401588 567224390 /nfs/dbraw/zinc/22/43/90/567224390.db2.gz HSHMNVMOXDEKLJ-SNVBAGLBSA-N 0 0 379.766 3.252 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC[C@@](O)(C(F)(F)F)C1 ZINC000590424495 567225479 /nfs/dbraw/zinc/22/54/79/567225479.db2.gz ATYQORVOKPNNDW-BHDSKKPTSA-N 0 0 378.372 3.038 20 5 GGBDRN Cc1ccc(CN(C)S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])nc1 ZINC000616085380 567226411 /nfs/dbraw/zinc/22/64/11/567226411.db2.gz KOZOWFVBLZHNNY-UHFFFAOYSA-N 0 0 390.248 3.426 20 5 GGBDRN Cc1ccc(Cc2noc(-c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)n2)s1 ZINC000567199857 567226538 /nfs/dbraw/zinc/22/65/38/567226538.db2.gz FXCHXTNSDNIRGJ-UHFFFAOYSA-N 0 0 379.419 3.009 20 5 GGBDRN Cc1cc(C(=O)N[C@H](CO)c2ccc(Br)c(F)c2)cc([N+](=O)[O-])c1 ZINC000590456581 567226711 /nfs/dbraw/zinc/22/67/11/567226711.db2.gz KTZGNCFEIICXFT-OAHLLOKOSA-N 0 0 397.200 3.268 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000455045918 567227467 /nfs/dbraw/zinc/22/74/67/567227467.db2.gz SIXFKAFFBBWOQH-CYBMUJFWSA-N 0 0 378.841 3.464 20 5 GGBDRN COC(=O)c1sc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)nc1C ZINC000499165347 567228932 /nfs/dbraw/zinc/22/89/32/567228932.db2.gz CSNIEGRNAHCYLQ-SECBINFHSA-N 0 0 381.435 3.266 20 5 GGBDRN O=C(NC[C@@H]1CCCN(CC(F)(F)F)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000590566563 567232463 /nfs/dbraw/zinc/23/24/63/567232463.db2.gz DFTAEGBDHDDQKW-JTQLQIEISA-N 0 0 379.766 3.252 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC/C=C\c1cccnc1 ZINC000590564579 567232593 /nfs/dbraw/zinc/23/25/93/567232593.db2.gz FYMUFOIKBSQGMY-RQOWECAXSA-N 0 0 376.210 3.124 20 5 GGBDRN O=c1[nH]c(CNc2ncc(Br)cc2[N+](=O)[O-])nc2ccccc12 ZINC000590567973 567232659 /nfs/dbraw/zinc/23/26/59/567232659.db2.gz ROGSNCFXZHRNMS-UHFFFAOYSA-N 0 0 376.170 3.013 20 5 GGBDRN CCCN(Cc1ccccc1Br)C(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000499243033 567232706 /nfs/dbraw/zinc/23/27/06/567232706.db2.gz CZLVJPPBJQOSSD-UHFFFAOYSA-N 0 0 395.257 3.301 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1cccnc1[N+](=O)[O-])c1c(Cl)cccc1Cl ZINC000525176038 567232852 /nfs/dbraw/zinc/23/28/52/567232852.db2.gz GHMRTMSNHJKHFA-VIFPVBQESA-N 0 0 390.248 3.379 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)COc2c(Cl)cc(Cl)c3cccnc32)c1 ZINC000567291081 567234682 /nfs/dbraw/zinc/23/46/82/567234682.db2.gz VGGIDLHWIOUEHQ-SNVBAGLBSA-N 0 0 383.191 3.086 20 5 GGBDRN COc1cc(C(F)(F)F)ncc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000616252588 567235163 /nfs/dbraw/zinc/23/51/63/567235163.db2.gz CDPIHGBREQCNSZ-UHFFFAOYSA-N 0 0 397.356 3.188 20 5 GGBDRN O=[N+]([O-])c1ncccc1NC[C@H](CO)Cc1ccc(F)c(Br)c1 ZINC000590733180 567241134 /nfs/dbraw/zinc/24/11/34/567241134.db2.gz HXOVGZQLYPKVQB-LLVKDONJSA-N 0 0 384.205 3.155 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCC(c2nnco2)CC1 ZINC000567387877 567242042 /nfs/dbraw/zinc/24/20/42/567242042.db2.gz AVGNIFHDBCISQS-UHFFFAOYSA-N 0 0 382.829 3.130 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@]2(CCS(=O)(=O)C2)C1 ZINC000590723243 567242011 /nfs/dbraw/zinc/24/20/11/567242011.db2.gz APRBGGDKXIVFEG-CQSZACIVSA-N 0 0 378.372 3.019 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1cc(Cl)ccc1OC(F)F ZINC000525307542 567242224 /nfs/dbraw/zinc/24/22/24/567242224.db2.gz RXDXENWDCHJGCK-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN C[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@@H](C)S1=O ZINC000616395810 567243092 /nfs/dbraw/zinc/24/30/92/567243092.db2.gz APYHTSIGLSTCKU-NXEZZACHSA-N 0 0 398.282 3.251 20 5 GGBDRN CN(Cc1c([N+](=O)[O-])ncn1C)CC1(c2ccc(Br)cc2)CC1 ZINC000475366331 567243886 /nfs/dbraw/zinc/24/38/86/567243886.db2.gz UGWPLNRJTDMTSK-UHFFFAOYSA-N 0 0 379.258 3.254 20 5 GGBDRN COc1cccc2c1CN(S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000590763198 567245059 /nfs/dbraw/zinc/24/50/59/567245059.db2.gz SVWXLLHXKSINHO-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN COc1cccc2c1CN(S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000590763136 567245336 /nfs/dbraw/zinc/24/53/36/567245336.db2.gz LFOPWJVYEDJVHH-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN CSCC[C@H](C)N(C)c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000433431623 567248840 /nfs/dbraw/zinc/24/88/40/567248840.db2.gz WUDXMFIIPRCEIH-NSHDSACASA-N 0 0 382.873 3.372 20 5 GGBDRN O=C(NC[C@@H](O)C(F)(F)F)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000616565120 567250365 /nfs/dbraw/zinc/25/03/65/567250365.db2.gz NGSDOZCCSNWPFO-CYBMUJFWSA-N 0 0 378.372 3.283 20 5 GGBDRN O=C(N1CCCCC1)N1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000590840790 567251577 /nfs/dbraw/zinc/25/15/77/567251577.db2.gz GRLBEMODQNBMCZ-UHFFFAOYSA-N 0 0 397.273 3.085 20 5 GGBDRN CC[C@@]1(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCOC1 ZINC000616689914 567252232 /nfs/dbraw/zinc/25/22/32/567252232.db2.gz JQKNMJWFZOUBFA-CQSZACIVSA-N 0 0 378.372 3.391 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC(C)(C)[C@@H]2COC[C@@H]21 ZINC000590889252 567254562 /nfs/dbraw/zinc/25/45/62/567254562.db2.gz CWUXKBNDQJSXCI-OCCSQVGLSA-N 0 0 383.242 3.163 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@H](O)[C@H]3C)cc2[N+](=O)[O-])n1 ZINC000590881051 567254909 /nfs/dbraw/zinc/25/49/09/567254909.db2.gz ITIYECUMUKJQFI-ZWNOBZJWSA-N 0 0 379.463 3.106 20 5 GGBDRN COc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2OC)cc1Br ZINC000475532278 567255826 /nfs/dbraw/zinc/25/58/26/567255826.db2.gz YIOBESAAXVVIHR-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000590914250 567256163 /nfs/dbraw/zinc/25/61/63/567256163.db2.gz PVWZXXGCYNUKIW-LLVKDONJSA-N 0 0 378.372 3.478 20 5 GGBDRN O=C(COc1ccc(Br)cc1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000525626603 567256541 /nfs/dbraw/zinc/25/65/41/567256541.db2.gz BFEPKTJWMHKBIM-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN CCC[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)C(=O)OCC ZINC000567569189 567258585 /nfs/dbraw/zinc/25/85/85/567258585.db2.gz LYNTZZHVEIEVMJ-JTQLQIEISA-N 0 0 387.230 3.067 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCCCc3sccc32)c([N+](=O)[O-])c1 ZINC000590992188 567260223 /nfs/dbraw/zinc/26/02/23/567260223.db2.gz JEWMJYPIXLPTCP-UHFFFAOYSA-N 0 0 380.447 3.043 20 5 GGBDRN CN(C)c1ncc(Br)cc1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000499594830 567260377 /nfs/dbraw/zinc/26/03/77/567260377.db2.gz RRPLCNCXZIWWNT-UHFFFAOYSA-N 0 0 383.177 3.210 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2SC)cc1[N+](=O)[O-] ZINC000499655084 567263634 /nfs/dbraw/zinc/26/36/34/567263634.db2.gz CSSMETPKHQUFLG-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN COc1cc(CCNC(=O)c2sccc2SC)c([N+](=O)[O-])cc1OC ZINC000499660515 567264955 /nfs/dbraw/zinc/26/49/55/567264955.db2.gz OWBNUAUMXXVHKA-UHFFFAOYSA-N 0 0 382.463 3.368 20 5 GGBDRN COC(=O)c1ccc(Br)c(C)c1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000525798519 567266399 /nfs/dbraw/zinc/26/63/99/567266399.db2.gz BGACWWSXZPDQMJ-UHFFFAOYSA-N 0 0 396.197 3.043 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(Cc2cc(F)ccc2Cl)CC1 ZINC000525832988 567267553 /nfs/dbraw/zinc/26/75/53/567267553.db2.gz WETNLAXJQYHSEV-UHFFFAOYSA-N 0 0 383.832 3.407 20 5 GGBDRN COc1ccc(CNC(=O)Cc2cc(Br)ccc2F)cc1[N+](=O)[O-] ZINC000433729729 567268888 /nfs/dbraw/zinc/26/88/88/567268888.db2.gz QFZDTPJUHKNAJZ-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN COc1ccc(CNC(=O)Cc2cc(F)ccc2Br)cc1[N+](=O)[O-] ZINC000433728883 567268901 /nfs/dbraw/zinc/26/89/01/567268901.db2.gz OAAQIPHRHGNDJJ-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CC2(CCC2)c2cc(Br)ccc21 ZINC000433734443 567269081 /nfs/dbraw/zinc/26/90/81/567269081.db2.gz ZYDIVGUNQSCOKO-UHFFFAOYSA-N 0 0 391.225 3.173 20 5 GGBDRN COc1cc(Br)cc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000567706567 567270283 /nfs/dbraw/zinc/27/02/83/567270283.db2.gz WJQRBLAOXULUEK-AWEZNQCLSA-N 0 0 397.225 3.218 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000433792787 567272039 /nfs/dbraw/zinc/27/20/39/567272039.db2.gz PFHBSFYMTHXZDN-PELKAZGASA-N 0 0 383.164 3.497 20 5 GGBDRN O=[N+]([O-])c1cncc(I)c1N1CC[C@@H](c2ccco2)C1 ZINC000591365337 567278668 /nfs/dbraw/zinc/27/86/68/567278668.db2.gz SUTVHVCJRFNSTA-SECBINFHSA-N 0 0 385.161 3.181 20 5 GGBDRN COc1cc(C(=O)Nc2ncc(C(F)(F)F)s2)cc([N+](=O)[O-])c1OC ZINC000475869589 567283139 /nfs/dbraw/zinc/28/31/39/567283139.db2.gz HXJIUMAACZXEQZ-UHFFFAOYSA-N 0 0 377.300 3.340 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(F)cc1Cl)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000526019139 567283163 /nfs/dbraw/zinc/28/31/63/567283163.db2.gz PNONOBJNCVJXQQ-SECBINFHSA-N 0 0 386.788 3.188 20 5 GGBDRN CSc1cccc(NC(=O)[C@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000526019019 567283696 /nfs/dbraw/zinc/28/36/96/567283696.db2.gz RHKSZSCKGLEKLL-NSHDSACASA-N 0 0 380.447 3.118 20 5 GGBDRN Cc1c(Br)c(=O)n(CC(=O)C(C)(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000475884907 567285695 /nfs/dbraw/zinc/28/56/95/567285695.db2.gz BEMZZAMGTBKZRZ-UHFFFAOYSA-N 0 0 393.237 3.374 20 5 GGBDRN Cc1cccc(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1Br ZINC000526062698 567287750 /nfs/dbraw/zinc/28/77/50/567287750.db2.gz JHXNKVRGRJRLAB-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1cccs1 ZINC000591750359 567295001 /nfs/dbraw/zinc/29/50/01/567295001.db2.gz OWSYVMOBHBWSHT-LLVKDONJSA-N 0 0 380.447 3.412 20 5 GGBDRN COC(=O)C[C@H](NC(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1cccs1 ZINC000591750360 567295739 /nfs/dbraw/zinc/29/57/39/567295739.db2.gz OWSYVMOBHBWSHT-NSHDSACASA-N 0 0 380.447 3.412 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1noc(C(F)F)n1 ZINC000591784341 567296484 /nfs/dbraw/zinc/29/64/84/567296484.db2.gz QNNKEKYZKWBCSC-YFKPBYRVSA-N 0 0 391.128 3.169 20 5 GGBDRN O=[N+]([O-])c1cccc(CNS(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)c1 ZINC000568021694 567298088 /nfs/dbraw/zinc/29/80/88/567298088.db2.gz HZOGLHOVGXLODB-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN C[C@@H](C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)N(C)CC(F)(F)F ZINC000476116939 567298357 /nfs/dbraw/zinc/29/83/57/567298357.db2.gz GAEWUPNZKBXKIB-HZMBPMFUSA-N 0 0 377.388 3.051 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434193797 567298651 /nfs/dbraw/zinc/29/86/51/567298651.db2.gz NAJARYKLELTBOC-UHFFFAOYSA-N 0 0 397.229 3.142 20 5 GGBDRN C[C@@H](C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)N(C)CC(F)(F)F ZINC000476116941 567298620 /nfs/dbraw/zinc/29/86/20/567298620.db2.gz GAEWUPNZKBXKIB-IINYFYTJSA-N 0 0 377.388 3.051 20 5 GGBDRN C[C@H]1CCCCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000476141387 567300122 /nfs/dbraw/zinc/30/01/22/567300122.db2.gz IXAWKKAABDVFEN-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN Cn1cc([C@H]2N(C(=O)c3ccc([N+](=O)[O-])cc3Br)CC2(C)C)cn1 ZINC000568053709 567300947 /nfs/dbraw/zinc/30/09/47/567300947.db2.gz FEVYDIHYIQEKMB-CQSZACIVSA-N 0 0 393.241 3.314 20 5 GGBDRN COc1ccc(C[NH2+][C@H](C(=O)[O-])c2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000617345470 567301588 /nfs/dbraw/zinc/30/15/88/567301588.db2.gz WPDGIJBNLVJKRD-HNNXBMFYSA-N 0 0 395.209 3.281 20 5 GGBDRN CCOC(=O)c1cnc(Sc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000548287695 567304527 /nfs/dbraw/zinc/30/45/27/567304527.db2.gz HEELCBUQRBTCNQ-UHFFFAOYSA-N 0 0 384.211 3.475 20 5 GGBDRN Cc1nc2ccc(Br)cn2c1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000526998251 567305361 /nfs/dbraw/zinc/30/53/61/567305361.db2.gz GNQSHZJVNGDSBV-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCOc2ccc(Br)cc2C1 ZINC000568106883 567305656 /nfs/dbraw/zinc/30/56/56/567305656.db2.gz TWJXENPBBVZXQC-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN C[C@H]1SCC[C@@H]1Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000592002740 567308008 /nfs/dbraw/zinc/30/80/08/567308008.db2.gz VRCKVFOZTWXMAA-OCCSQVGLSA-N 0 0 385.511 3.075 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1cc(OC)c(O)cc1Br ZINC000591997603 567308027 /nfs/dbraw/zinc/30/80/27/567308027.db2.gz BOIQDUORZBMIJD-UHFFFAOYSA-N 0 0 385.218 3.208 20 5 GGBDRN CCC(C)(C)N(C)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000527153245 567317843 /nfs/dbraw/zinc/31/78/43/567317843.db2.gz NJYGQACZFIVDKS-UHFFFAOYSA-N 0 0 376.194 3.460 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1Nc1ccc(N2CCCCC2)nc1 ZINC000500271045 567310660 /nfs/dbraw/zinc/31/06/60/567310660.db2.gz HZABIYPGUYBANP-UHFFFAOYSA-N 0 0 378.230 3.303 20 5 GGBDRN CN(C[C@@H]1COc2ccccc2O1)c1c(Br)cncc1[N+](=O)[O-] ZINC000500272043 567311176 /nfs/dbraw/zinc/31/11/76/567311176.db2.gz MGIXKOWHRWVGCT-SNVBAGLBSA-N 0 0 380.198 3.029 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1COc2cc(F)c(Br)cc21 ZINC000500271745 567311289 /nfs/dbraw/zinc/31/12/89/567311289.db2.gz YPMMXNCQNKEMIL-CYBMUJFWSA-N 0 0 395.184 3.289 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1COc2cc(F)c(Br)cc21 ZINC000500271746 567311353 /nfs/dbraw/zinc/31/13/53/567311353.db2.gz YPMMXNCQNKEMIL-ZDUSSCGKSA-N 0 0 395.184 3.289 20 5 GGBDRN COc1ccc(COCCCNc2c(Br)cncc2[N+](=O)[O-])cc1 ZINC000500288869 567312233 /nfs/dbraw/zinc/31/22/33/567312233.db2.gz GPLRXOAOGCYQFQ-UHFFFAOYSA-N 0 0 396.241 3.202 20 5 GGBDRN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000500327927 567313692 /nfs/dbraw/zinc/31/36/92/567313692.db2.gz JEDIIYBNFZBTGK-VIFPVBQESA-N 0 0 396.216 3.440 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(S(C)(=O)=O)c(C)c2)c1 ZINC000500313847 567313763 /nfs/dbraw/zinc/31/37/63/567313763.db2.gz AEXCJYLVNGDOGZ-UHFFFAOYSA-N 0 0 380.447 3.281 20 5 GGBDRN C[C@H](Cc1cc(Br)ccc1F)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000500327925 567313911 /nfs/dbraw/zinc/31/39/11/567313911.db2.gz JEDIIYBNFZBTGK-SECBINFHSA-N 0 0 396.216 3.440 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCc2cccc(Br)c21 ZINC000500345664 567315339 /nfs/dbraw/zinc/31/53/39/567315339.db2.gz IZLHOODXHOYEDI-UHFFFAOYSA-N 0 0 397.250 3.499 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)COc2ccc(F)c(Br)c2)c1 ZINC000568308478 567318639 /nfs/dbraw/zinc/31/86/39/567318639.db2.gz DHVKGWCRKQXFFV-LLVKDONJSA-N 0 0 386.173 3.315 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000476356930 567318633 /nfs/dbraw/zinc/31/86/33/567318633.db2.gz PREYLMJBFBQDFR-GFCCVEGCSA-N 0 0 379.214 3.068 20 5 GGBDRN O=C1c2ccc(Br)cc2C(=O)N1CCOc1ccccc1[N+](=O)[O-] ZINC000434649691 567318860 /nfs/dbraw/zinc/31/88/60/567318860.db2.gz CALPCNLQFZYSKF-UHFFFAOYSA-N 0 0 391.177 3.032 20 5 GGBDRN COc1c(C(=O)NCc2ccc(O)c(Br)c2)cccc1[N+](=O)[O-] ZINC000476379361 567319085 /nfs/dbraw/zinc/31/90/85/567319085.db2.gz XLYCPMHSGSVCPN-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN COc1c(Br)cc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])nn1C ZINC000548489593 567320528 /nfs/dbraw/zinc/32/05/28/567320528.db2.gz NHUAMWXSNXAPBS-UHFFFAOYSA-N 0 0 389.593 3.005 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN(C)CC(F)F ZINC000527256005 567322916 /nfs/dbraw/zinc/32/29/16/567322916.db2.gz FOFVJCQKJTWCJZ-UHFFFAOYSA-N 0 0 375.441 3.364 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)[C@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000527261016 567325120 /nfs/dbraw/zinc/32/51/20/567325120.db2.gz BFYBFUMIDQMBGA-NSHDSACASA-N 0 0 382.825 3.358 20 5 GGBDRN O=C(NC[C@H](CO)CC1CCCC1)c1ccc([N+](=O)[O-])cc1Br ZINC000500494704 567325697 /nfs/dbraw/zinc/32/56/97/567325697.db2.gz FDKIIWMKPGWSNL-GFCCVEGCSA-N 0 0 385.258 3.276 20 5 GGBDRN CCn1c(=O)c2c(C)c(C)sc2nc1SCc1c([N+](=O)[O-])ncn1C ZINC000476457114 567325755 /nfs/dbraw/zinc/32/57/55/567325755.db2.gz HQFOKTVQTWONLM-UHFFFAOYSA-N 0 0 379.467 3.029 20 5 GGBDRN COCCn1c2ccc(Cl)cc2nc1SCc1c([N+](=O)[O-])ncn1C ZINC000476472848 567326318 /nfs/dbraw/zinc/32/63/18/567326318.db2.gz RFUHRWPILXDPHU-UHFFFAOYSA-N 0 0 381.845 3.270 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCc2cc(Br)cc(F)c2C1 ZINC000527278825 567326446 /nfs/dbraw/zinc/32/64/46/567326446.db2.gz FWTZNEFEUXKRJQ-UHFFFAOYSA-N 0 0 382.189 3.033 20 5 GGBDRN O=[N+]([O-])c1ccc(Cn2nnnc2Cc2ccc(Br)cc2)c(F)c1 ZINC000476480282 567327263 /nfs/dbraw/zinc/32/72/63/567327263.db2.gz IULPTSDNWOHOQQ-UHFFFAOYSA-N 0 0 392.188 3.122 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSc1nnc(-c2ccccc2Br)o1 ZINC000476516467 567330720 /nfs/dbraw/zinc/33/07/20/567330720.db2.gz YCVPORMVYUIOAX-UHFFFAOYSA-N 0 0 396.226 3.433 20 5 GGBDRN CNc1nc(C(=O)N[C@@H]2C[C@H]2c2ccc(Br)s2)ccc1[N+](=O)[O-] ZINC000456029032 567332097 /nfs/dbraw/zinc/33/20/97/567332097.db2.gz DULZVIUGNIEXJX-VXNVDRBHSA-N 0 0 397.254 3.141 20 5 GGBDRN C[C@H](C(=O)N[C@H](CO)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000617758656 567333398 /nfs/dbraw/zinc/33/33/98/567333398.db2.gz AROZDFNDBPOCLZ-MEDUHNTESA-N 0 0 393.237 3.311 20 5 GGBDRN CNc1nc(C(=O)N(C)CCc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000456054160 567334622 /nfs/dbraw/zinc/33/46/22/567334622.db2.gz CMTIOAJBKQUOGK-UHFFFAOYSA-N 0 0 393.241 3.109 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)C(F)(F)F ZINC000476574629 567336491 /nfs/dbraw/zinc/33/64/91/567336491.db2.gz NDWLHHSJJHEOSG-LURJTMIESA-N 0 0 380.266 3.090 20 5 GGBDRN C[C@H]1SCCN(c2nnc(CSc3ccccc3[N+](=O)[O-])n2C)[C@@H]1C ZINC000592402470 567336623 /nfs/dbraw/zinc/33/66/23/567336623.db2.gz HLXUZKHMZHMBHJ-VXGBXAGGSA-N 0 0 379.511 3.346 20 5 GGBDRN C[C@@H]1CN(c2nnc(CSc3ccccc3[N+](=O)[O-])n2C)C[C@H](C)S1 ZINC000592402823 567336844 /nfs/dbraw/zinc/33/68/44/567336844.db2.gz KNWPLYKDFSLBJI-TXEJJXNPSA-N 0 0 379.511 3.346 20 5 GGBDRN CN(Cc1nccs1)c1nnc(CSc2ccccc2[N+](=O)[O-])n1C ZINC000592403949 567336867 /nfs/dbraw/zinc/33/68/67/567336867.db2.gz RXHGFUSLZRWDTG-UHFFFAOYSA-N 0 0 376.467 3.109 20 5 GGBDRN CCn1c(CSc2ccccc2[N+](=O)[O-])nnc1N1CCS[C@H](C)C1 ZINC000592408885 567336982 /nfs/dbraw/zinc/33/69/82/567336982.db2.gz DSEGFTQIBAEMSI-GFCCVEGCSA-N 0 0 379.511 3.440 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCc3sc(Cl)cc32)cc1 ZINC000568567030 567339371 /nfs/dbraw/zinc/33/93/71/567339371.db2.gz LBZGZODTYOAWJC-ZDUSSCGKSA-N 0 0 386.882 3.459 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(Br)cc2F)c1[N+](=O)[O-] ZINC000568594790 567341572 /nfs/dbraw/zinc/34/15/72/567341572.db2.gz HGAUGWOCFAFWMT-ZETCQYMHSA-N 0 0 385.193 3.273 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000476659423 567342849 /nfs/dbraw/zinc/34/28/49/567342849.db2.gz OFVSXENRTKEZCY-LBPRGKRZSA-N 0 0 397.204 3.207 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)NCCSCc1ccc(Cl)cc1Cl ZINC000476656216 567342981 /nfs/dbraw/zinc/34/29/81/567342981.db2.gz FWNGMCQIXWNEGP-UHFFFAOYSA-N 0 0 389.264 3.298 20 5 GGBDRN CC(C)CN(Cc1ccccc1Br)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000476668444 567344291 /nfs/dbraw/zinc/34/42/91/567344291.db2.gz LKOSMFUFGNQETA-UHFFFAOYSA-N 0 0 395.257 3.389 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]([C@H](CO)C1CC1)C1CC1 ZINC000456150394 567346249 /nfs/dbraw/zinc/34/62/49/567346249.db2.gz NULSGYYNUMLMHB-DYVFJYSZSA-N 0 0 384.885 3.254 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]([C@H](CO)C1CC1)C1CC1 ZINC000456150392 567346554 /nfs/dbraw/zinc/34/65/54/567346554.db2.gz NULSGYYNUMLMHB-CXAGYDPISA-N 0 0 384.885 3.254 20 5 GGBDRN COc1ccc(NC(=O)C[C@@H](C)n2cc(Br)cn2)c([N+](=O)[O-])c1 ZINC000592573675 567346865 /nfs/dbraw/zinc/34/68/65/567346865.db2.gz KGXVRVIBWYQMAI-SECBINFHSA-N 0 0 383.202 3.152 20 5 GGBDRN NS(=O)(=O)c1c(NC[C@H]2CCCC[C@H]2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000568686687 567347451 /nfs/dbraw/zinc/34/74/51/567347451.db2.gz ADMIIRXZXLSCRD-NXEZZACHSA-N 0 0 381.376 3.023 20 5 GGBDRN C[C@H](CC(=O)N1CCCc2ccc([N+](=O)[O-])cc21)n1cc(Br)cn1 ZINC000592593511 567347629 /nfs/dbraw/zinc/34/76/29/567347629.db2.gz RBIWVHBVEWJUAH-LLVKDONJSA-N 0 0 393.241 3.484 20 5 GGBDRN Cn1ccnc1SCc1cc(I)cc([N+](=O)[O-])c1 ZINC000568684282 567347704 /nfs/dbraw/zinc/34/77/04/567347704.db2.gz QDCAVNCYCYVPEO-UHFFFAOYSA-N 0 0 375.191 3.225 20 5 GGBDRN CN([C@H]1CC[C@@H](C(F)(F)F)CC1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000568677768 567348245 /nfs/dbraw/zinc/34/82/45/567348245.db2.gz RPUCJSBICWXGPP-BETUJISGSA-N 0 0 380.388 3.478 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCC[C@@]3(CCS(=O)(=O)C3)C2)cc1C(F)(F)F ZINC000568719506 567351143 /nfs/dbraw/zinc/35/11/43/567351143.db2.gz NRCPKCNFKAZWJT-CQSZACIVSA-N 0 0 378.372 3.019 20 5 GGBDRN C[C@H](CC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)n1cc(Br)cn1 ZINC000592630208 567351781 /nfs/dbraw/zinc/35/17/81/567351781.db2.gz IZWJCGBNLDQNIR-GFCCVEGCSA-N 0 0 395.257 3.206 20 5 GGBDRN CN1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 ZINC000435242729 567352328 /nfs/dbraw/zinc/35/23/28/567352328.db2.gz NMJAACWQUJELEU-UHFFFAOYSA-N 0 0 380.242 3.365 20 5 GGBDRN C[C@H](C(=O)N=c1[nH]n(CC(F)(F)F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000592646854 567352808 /nfs/dbraw/zinc/35/28/08/567352808.db2.gz OZCHBEFXKSPVOP-QMMMGPOBSA-N 0 0 376.722 3.171 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000568743184 567353708 /nfs/dbraw/zinc/35/37/08/567353708.db2.gz AJGNJJVGCSCJKJ-CYBMUJFWSA-N 0 0 397.191 3.493 20 5 GGBDRN CC[C@@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)NCc1cccs1 ZINC000592692230 567355456 /nfs/dbraw/zinc/35/54/56/567355456.db2.gz PORJOHVYDUNFIU-GFCCVEGCSA-N 0 0 381.841 3.135 20 5 GGBDRN Cc1c(NC(=O)N(C)Cc2ccnn2C)cc(Br)cc1[N+](=O)[O-] ZINC000435330744 567356118 /nfs/dbraw/zinc/35/61/18/567356118.db2.gz VVUZRFAXHSSMGO-UHFFFAOYSA-N 0 0 382.218 3.063 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1C2CCC1CC2 ZINC000548862680 567356552 /nfs/dbraw/zinc/35/65/52/567356552.db2.gz WSTOCKVTHFTKFW-UHFFFAOYSA-N 0 0 386.189 3.275 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCSC2(CCCCC2)C1 ZINC000500999368 567356819 /nfs/dbraw/zinc/35/68/19/567356819.db2.gz OBERWGFFFHASCS-UHFFFAOYSA-N 0 0 384.523 3.219 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC2(c3nccs3)CCCC2)cc1C ZINC000568807937 567357435 /nfs/dbraw/zinc/35/74/35/567357435.db2.gz UIGJVDOGSMPZQF-UHFFFAOYSA-N 0 0 381.479 3.416 20 5 GGBDRN C[C@@H]1CC2(CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-])CCOCC2 ZINC000592722722 567358186 /nfs/dbraw/zinc/35/81/86/567358186.db2.gz WQVDMUDFVJBJMR-LLVKDONJSA-N 0 0 383.242 3.389 20 5 GGBDRN CCN(CCSC)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000592739891 567359288 /nfs/dbraw/zinc/35/92/88/567359288.db2.gz WXGZMMVYMRMRDB-UHFFFAOYSA-N 0 0 394.234 3.025 20 5 GGBDRN C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC2(CCCC2)O1 ZINC000592738131 567359725 /nfs/dbraw/zinc/35/97/25/567359725.db2.gz YWQNXPZYRXVCNT-LBPRGKRZSA-N 0 0 397.269 3.460 20 5 GGBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)ncc1Br ZINC000476978562 567362290 /nfs/dbraw/zinc/36/22/90/567362290.db2.gz FVWUNFHPSVOJTG-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN CCOc1cccc([C@@H]2C[C@H]2NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000435427029 567362655 /nfs/dbraw/zinc/36/26/55/567362655.db2.gz KUJKSUCGBOYEKW-UONOGXRCSA-N 0 0 382.463 3.198 20 5 GGBDRN COc1cc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c32)ncc1Br ZINC000477005026 567364022 /nfs/dbraw/zinc/36/40/22/567364022.db2.gz HFXKHRMFKHMIOA-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CC[C@@](F)(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000548977302 567364036 /nfs/dbraw/zinc/36/40/36/567364036.db2.gz ROSHPHPBZFSADL-HNNXBMFYSA-N 0 0 388.417 3.363 20 5 GGBDRN CC[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)Cc1cccc(Br)c1 ZINC000477021752 567365255 /nfs/dbraw/zinc/36/52/55/567365255.db2.gz MYECHPSMWOVUDL-NSHDSACASA-N 0 0 395.257 3.090 20 5 GGBDRN O=C(N[C@H]1CCc2cc(O)ccc2C1)c1ccc([N+](=O)[O-])cc1Br ZINC000618250078 567365434 /nfs/dbraw/zinc/36/54/34/567365434.db2.gz NMWAKOXZZANPPV-LBPRGKRZSA-N 0 0 391.221 3.350 20 5 GGBDRN O=C(N[C@H]1CCc2cc(O)ccc2C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000618250376 567365510 /nfs/dbraw/zinc/36/55/10/567365510.db2.gz YFFAOLATQBTYPU-AWEZNQCLSA-N 0 0 391.221 3.350 20 5 GGBDRN CCO[C@H]1C[C@@H]1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000618259084 567366867 /nfs/dbraw/zinc/36/68/67/567366867.db2.gz LFYHUPDIVPKRIS-AAEUAGOBSA-N 0 0 379.463 3.418 20 5 GGBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@@](=O)C(C)(C)CC1 ZINC000456369509 567367095 /nfs/dbraw/zinc/36/70/95/567367095.db2.gz QLLIKHURGAFJCB-RUZDIDTESA-N 0 0 384.523 3.470 20 5 GGBDRN O=C(CCn1ccnn1)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000549007455 567367514 /nfs/dbraw/zinc/36/75/14/567367514.db2.gz SELCRIUWIXUAJG-UHFFFAOYSA-N 0 0 375.435 3.428 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NC1(c2ccc(Br)cc2)CCCC1 ZINC000501125309 567367547 /nfs/dbraw/zinc/36/75/47/567367547.db2.gz ONSMVSVIISLFER-UHFFFAOYSA-N 0 0 393.241 3.290 20 5 GGBDRN Cn1cc2c(n1)CCC[C@H]2NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501125619 567367571 /nfs/dbraw/zinc/36/75/71/567367571.db2.gz QPFKQSVCIXMHMJ-CYBMUJFWSA-N 0 0 394.229 3.290 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000435440207 567367986 /nfs/dbraw/zinc/36/79/86/567367986.db2.gz UPZPUYMZAVIPSO-BXKDBHETSA-N 0 0 388.779 3.361 20 5 GGBDRN O=C(CN1CSCC1=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000435442411 567368061 /nfs/dbraw/zinc/36/80/61/567368061.db2.gz IJMZJUPEXYMLDL-UHFFFAOYSA-N 0 0 395.487 3.279 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cccs1 ZINC000592866828 567369590 /nfs/dbraw/zinc/36/95/90/567369590.db2.gz LWISKYIMJIVUCC-ZDUSSCGKSA-N 0 0 381.841 3.135 20 5 GGBDRN Cc1ccc(C[C@H](C)Nc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])s1 ZINC000477092211 567370271 /nfs/dbraw/zinc/37/02/71/567370271.db2.gz CFHVEPZCVGOAOW-NSHDSACASA-N 0 0 383.495 3.258 20 5 GGBDRN CCS[C@@H]1CCC[C@H](Nc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])C1 ZINC000477100140 567371678 /nfs/dbraw/zinc/37/16/78/567371678.db2.gz LGJRLKOOWSIIBR-QWHCGFSZSA-N 0 0 387.527 3.321 20 5 GGBDRN CNS(=O)(=O)c1ccc(CNc2c(C)cc([N+](=O)[O-])cc2Cl)s1 ZINC000618339307 567373248 /nfs/dbraw/zinc/37/32/48/567373248.db2.gz WXVGYNRQKGAZGS-UHFFFAOYSA-N 0 0 375.859 3.138 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2C[C@H](C)n3ccnc32)cc1[N+](=O)[O-] ZINC000456420964 567373324 /nfs/dbraw/zinc/37/33/24/567373324.db2.gz MWOSEGYNGZJUDI-QPUJVOFHSA-N 0 0 379.214 3.298 20 5 GGBDRN Cc1cnc(OCC(=O)Nc2ccc(Br)cc2F)c([N+](=O)[O-])c1 ZINC000477135837 567373413 /nfs/dbraw/zinc/37/34/13/567373413.db2.gz KCQSSEJHXFXZMP-UHFFFAOYSA-N 0 0 384.161 3.217 20 5 GGBDRN NS(=O)(=O)c1cccc(N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000435571375 567375070 /nfs/dbraw/zinc/37/50/70/567375070.db2.gz USOGMEAKXAUCFZ-TVQRCGJNSA-N 0 0 385.804 3.003 20 5 GGBDRN NS(=O)(=O)c1cc(N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)cc([N+](=O)[O-])c1 ZINC000435571007 567375216 /nfs/dbraw/zinc/37/52/16/567375216.db2.gz QGPQEKWYPAQVKS-SWLSCSKDSA-N 0 0 385.804 3.003 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)cc1[N+](=O)[O-] ZINC000435583684 567375315 /nfs/dbraw/zinc/37/53/15/567375315.db2.gz HQBMRXZVNDLAAU-MJHDQNEOSA-N 0 0 388.417 3.467 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CC[C@@H]([C@H]2CCOC2)C1 ZINC000549142261 567375531 /nfs/dbraw/zinc/37/55/31/567375531.db2.gz IEBLGJYCIBLDKL-MNOVXSKESA-N 0 0 388.205 3.062 20 5 GGBDRN CCOc1cccc([C@@H]2C[C@H]2Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000435567782 567375824 /nfs/dbraw/zinc/37/58/24/567375824.db2.gz MKYMIJMOZBAOFT-QWHCGFSZSA-N 0 0 382.463 3.427 20 5 GGBDRN CN(CCNc1ccc([N+](=O)[O-])cc1Cl)S(=O)(=O)c1ccc(F)cc1 ZINC000435582033 567376032 /nfs/dbraw/zinc/37/60/32/567376032.db2.gz AAABZNOIIGKIHB-UHFFFAOYSA-N 0 0 387.820 3.120 20 5 GGBDRN Cn1nccc1N1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000618347288 567376277 /nfs/dbraw/zinc/37/62/77/567376277.db2.gz ABPLLFZUEXVTRN-LLVKDONJSA-N 0 0 380.246 3.172 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCc1cnc2n1CCCC2 ZINC000549171263 567376520 /nfs/dbraw/zinc/37/65/20/567376520.db2.gz BQSQSWVHRQWDLE-UHFFFAOYSA-N 0 0 398.204 3.344 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)cc1 ZINC000435586826 567377342 /nfs/dbraw/zinc/37/73/42/567377342.db2.gz CNTWQXRLBIOZHM-DLBZAZTESA-N 0 0 380.853 3.266 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CC[C@@H](COC(F)F)C1 ZINC000549195009 567378176 /nfs/dbraw/zinc/37/81/76/567378176.db2.gz VULJDNZQSAYGMQ-MRVPVSSYSA-N 0 0 398.147 3.265 20 5 GGBDRN O=C(Nc1nc(-c2ccccc2)c(Br)s1)c1c[nH]nc1[N+](=O)[O-] ZINC000549216712 567379561 /nfs/dbraw/zinc/37/95/61/567379561.db2.gz OLJUYGNUNUWFEF-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN Cc1c(Br)c(N2CC3(CCOCC3)[C@H]2C2CC2)ncc1[N+](=O)[O-] ZINC000549253430 567383037 /nfs/dbraw/zinc/38/30/37/567383037.db2.gz VKQAEGZNPDURHC-CQSZACIVSA-N 0 0 382.258 3.456 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCC[C@H]1OC(F)F ZINC000501350409 567383247 /nfs/dbraw/zinc/38/32/47/567383247.db2.gz KZRMQXWPJKHUQR-ZYHUDNBSSA-N 0 0 378.759 3.294 20 5 GGBDRN O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCCc1nc(C(F)(F)F)cs1 ZINC000593075145 567384377 /nfs/dbraw/zinc/38/43/77/567384377.db2.gz BKTHLCPCQZMNNB-UHFFFAOYSA-N 0 0 377.319 3.111 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000477260915 567384443 /nfs/dbraw/zinc/38/44/43/567384443.db2.gz TXZFRUSVHLKSRG-CQSZACIVSA-N 0 0 397.204 3.111 20 5 GGBDRN Cc1cc(Br)cc(C)c1CNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000477266381 567384633 /nfs/dbraw/zinc/38/46/33/567384633.db2.gz NPMQSCTYHWGFGR-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cn1nc(CNC(=O)c2sc(Br)cc2[N+](=O)[O-])c2ccccc21 ZINC000618392034 567386337 /nfs/dbraw/zinc/38/63/37/567386337.db2.gz LCZYEGZTZPTTHE-UHFFFAOYSA-N 0 0 395.238 3.236 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)N(C)C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000549326979 567386388 /nfs/dbraw/zinc/38/63/88/567386388.db2.gz IKAZYFYICUWHJE-LLVKDONJSA-N 0 0 381.230 3.174 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccccc1Br ZINC000618382374 567386860 /nfs/dbraw/zinc/38/68/60/567386860.db2.gz WYCDNVYXVZISHB-CYBMUJFWSA-N 0 0 392.209 3.435 20 5 GGBDRN C[C@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)c1ccc(S(C)(=O)=O)cc1 ZINC000618410248 567387739 /nfs/dbraw/zinc/38/77/39/567387739.db2.gz ZWUKOWKMHRCYJT-VIFPVBQESA-N 0 0 379.419 3.262 20 5 GGBDRN CC(C)c1nnc([C@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000477325994 567388165 /nfs/dbraw/zinc/38/81/65/567388165.db2.gz VFZVZFYAWRYERN-VIFPVBQESA-N 0 0 396.245 3.019 20 5 GGBDRN COCCN(C(=O)c1sc(Br)cc1[N+](=O)[O-])C1CCCC1 ZINC000618445444 567389107 /nfs/dbraw/zinc/38/91/07/567389107.db2.gz MGTUNQZIQYRKSZ-UHFFFAOYSA-N 0 0 377.260 3.450 20 5 GGBDRN O=C(COc1cc(F)cc(Br)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000477346776 567390504 /nfs/dbraw/zinc/39/05/04/567390504.db2.gz HAHIIQIYMAWMEK-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](O)Cc1ccccc1Cl ZINC000477471403 567396244 /nfs/dbraw/zinc/39/62/44/567396244.db2.gz QDLKBUZVACYCFT-INIZCTEOSA-N 0 0 383.231 3.164 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1 ZINC000549544355 567396806 /nfs/dbraw/zinc/39/68/06/567396806.db2.gz LQIHDCIMKWCBPU-OAHLLOKOSA-N 0 0 382.825 3.090 20 5 GGBDRN Cc1cc([C@@H]2CCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])ccc1Br ZINC000435977110 567397630 /nfs/dbraw/zinc/39/76/30/567397630.db2.gz ZDNSXZDKXQOCSR-LBPRGKRZSA-N 0 0 379.214 3.366 20 5 GGBDRN CO[C@H]1C[C@H](N(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C12CCC2 ZINC000456662566 567399199 /nfs/dbraw/zinc/39/91/99/567399199.db2.gz VNPNOLYDLFEASM-KBPBESRZSA-N 0 0 383.242 3.387 20 5 GGBDRN CO[C@@H]1C[C@@H](N(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])C12CCC2 ZINC000456670465 567400193 /nfs/dbraw/zinc/40/01/93/567400193.db2.gz YCVAMCYPOBFTRE-ZIAGYGMSSA-N 0 0 383.242 3.387 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000477528846 567400458 /nfs/dbraw/zinc/40/04/58/567400458.db2.gz ILQJPHICLRFQEY-VWLOTQADSA-N 0 0 381.841 3.350 20 5 GGBDRN NS(=O)(=O)c1c(NCCCCc2ccc(Cl)s2)cccc1[N+](=O)[O-] ZINC000569394121 567400567 /nfs/dbraw/zinc/40/05/67/567400567.db2.gz GWQAAKDCHBVPRS-UHFFFAOYSA-N 0 0 389.886 3.392 20 5 GGBDRN CC(C)O[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000593241775 567401216 /nfs/dbraw/zinc/40/12/16/567401216.db2.gz XHGJBXSQMZTMJP-CQSZACIVSA-N 0 0 385.258 3.316 20 5 GGBDRN COc1cccc(C(=O)N2CCOc3ccc(Br)cc32)c1[N+](=O)[O-] ZINC000436013801 567401242 /nfs/dbraw/zinc/40/12/42/567401242.db2.gz OJHYYOMVZISZGA-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN Cn1c2ccc(Cl)cc2nc1Cn1cc([N+](=O)[O-])cc(Br)c1=O ZINC000477531178 567401431 /nfs/dbraw/zinc/40/14/31/567401431.db2.gz ZEGKZEFYVAQTDO-UHFFFAOYSA-N 0 0 397.616 3.107 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc(Br)cc2OC)cc1[N+](=O)[O-] ZINC000501675199 567402424 /nfs/dbraw/zinc/40/24/24/567402424.db2.gz PBMBWMMLJVPAJI-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CC[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)[C@H](CC)CO1 ZINC000593257553 567402560 /nfs/dbraw/zinc/40/25/60/567402560.db2.gz SQXXCQZUUQXCBO-TZMCWYRMSA-N 0 0 385.258 3.316 20 5 GGBDRN C[C@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(Br)cc1 ZINC000501762206 567404177 /nfs/dbraw/zinc/40/41/77/567404177.db2.gz MCQFGQXDFSBRLO-VIFPVBQESA-N 0 0 389.209 3.398 20 5 GGBDRN CC(C)[C@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCCO1 ZINC000549695094 567404383 /nfs/dbraw/zinc/40/43/83/567404383.db2.gz SRGOVFOXGWTYBJ-CYBMUJFWSA-N 0 0 397.280 3.337 20 5 GGBDRN C[C@@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(Br)cc1 ZINC000501762205 567404832 /nfs/dbraw/zinc/40/48/32/567404832.db2.gz MCQFGQXDFSBRLO-SECBINFHSA-N 0 0 389.209 3.398 20 5 GGBDRN Cc1cc([C@@H]2CCCN2C(=O)c2c[nH]nc2[N+](=O)[O-])ccc1Br ZINC000549773980 567410979 /nfs/dbraw/zinc/41/09/79/567410979.db2.gz SJTINLZUIYBLLY-ZDUSSCGKSA-N 0 0 379.214 3.366 20 5 GGBDRN COC(=O)c1cnc(NCCc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000477749959 567414305 /nfs/dbraw/zinc/41/43/05/567414305.db2.gz LLGVWMGJYSSKJH-UHFFFAOYSA-N 0 0 380.198 3.194 20 5 GGBDRN COc1ccc(C(=O)Cn2cc([N+](=O)[O-])c(C3CC3)n2)cc1Br ZINC000436213306 567415373 /nfs/dbraw/zinc/41/53/73/567415373.db2.gz XOOWEBHMWZBQCB-UHFFFAOYSA-N 0 0 380.198 3.323 20 5 GGBDRN C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccc(Br)cn1 ZINC000477773311 567416493 /nfs/dbraw/zinc/41/64/93/567416493.db2.gz ZCFQSTDZUSFQIM-MRVPVSSYSA-N 0 0 390.197 3.120 20 5 GGBDRN COc1c(C(=O)N[C@H](C)c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000477780256 567417589 /nfs/dbraw/zinc/41/75/89/567417589.db2.gz UUPCMPNUSZHUNW-SECBINFHSA-N 0 0 380.198 3.252 20 5 GGBDRN C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000477786979 567418525 /nfs/dbraw/zinc/41/85/25/567418525.db2.gz DDLJZONDJZCGOO-JTQLQIEISA-N 0 0 380.198 3.009 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccc(Br)cn1 ZINC000477796596 567418595 /nfs/dbraw/zinc/41/85/95/567418595.db2.gz RSAXTPMABBYGJK-VIFPVBQESA-N 0 0 380.198 3.252 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](Oc3ccc(Cl)cc3)C2)cc1 ZINC000549932881 567419329 /nfs/dbraw/zinc/41/93/29/567419329.db2.gz QZROBSWKRQGGLJ-OAHLLOKOSA-N 0 0 382.825 3.090 20 5 GGBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)cn1 ZINC000477805890 567419296 /nfs/dbraw/zinc/41/92/96/567419296.db2.gz PFZCLTPOTBIULF-SECBINFHSA-N 0 0 382.189 3.311 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1NCCNc1ccccn1 ZINC000502088061 567419212 /nfs/dbraw/zinc/41/92/12/567419212.db2.gz KOMWYXUSSZOVTA-UHFFFAOYSA-N 0 0 388.225 3.246 20 5 GGBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)cn1 ZINC000477805891 567419700 /nfs/dbraw/zinc/41/97/00/567419700.db2.gz PFZCLTPOTBIULF-VIFPVBQESA-N 0 0 382.189 3.311 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCc2ccc(Cl)s2)c([N+](=O)[O-])c1 ZINC000502114214 567420238 /nfs/dbraw/zinc/42/02/38/567420238.db2.gz QPGNIAGSMZVANV-UHFFFAOYSA-N 0 0 375.859 3.172 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1NCCCn1ccnc1 ZINC000502098171 567420280 /nfs/dbraw/zinc/42/02/80/567420280.db2.gz MSTVDKJRZSNONI-UHFFFAOYSA-N 0 0 376.214 3.026 20 5 GGBDRN COc1cc(CCNS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)ccc1Cl ZINC000549947926 567420917 /nfs/dbraw/zinc/42/09/17/567420917.db2.gz HOCZMFPXPCJCBM-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](CC3CC3)C2)c(Br)c1 ZINC000549941140 567421216 /nfs/dbraw/zinc/42/12/16/567421216.db2.gz LTHAKRVEHALINT-NSHDSACASA-N 0 0 389.271 3.168 20 5 GGBDRN C[S@@](=O)C1(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCC1 ZINC000436379608 567421627 /nfs/dbraw/zinc/42/16/27/567421627.db2.gz ZAKHHKJBXOSLGZ-RUZDIDTESA-N 0 0 379.360 3.036 20 5 GGBDRN CCCS(=O)(=O)NC1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000618897286 567422197 /nfs/dbraw/zinc/42/21/97/567422197.db2.gz KWYVCFUJTUMKQZ-UHFFFAOYSA-N 0 0 396.296 3.200 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000502192459 567422579 /nfs/dbraw/zinc/42/25/79/567422579.db2.gz DWAPAJRKDUWENQ-SECBINFHSA-N 0 0 380.198 3.257 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cnc1NC[C@H](CO)Cc1cc(F)c(F)c(F)c1 ZINC000436424286 567422991 /nfs/dbraw/zinc/42/29/91/567422991.db2.gz YPBFYEJBIJWTCJ-SECBINFHSA-N 0 0 375.734 3.324 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CC(F)F)c2ccc(F)cc2)c(F)c1 ZINC000549994624 567422938 /nfs/dbraw/zinc/42/29/38/567422938.db2.gz POABDNVWBXGWIY-UHFFFAOYSA-N 0 0 378.303 3.333 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000436447845 567425163 /nfs/dbraw/zinc/42/51/63/567425163.db2.gz CCGNJGXBZIDODK-NSHDSACASA-N 0 0 380.685 3.154 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000436473352 567426282 /nfs/dbraw/zinc/42/62/82/567426282.db2.gz HIDLNKYDWSMONY-VIFPVBQESA-N 0 0 384.219 3.249 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CC2(CCC2(F)F)C1 ZINC000569746394 567428485 /nfs/dbraw/zinc/42/84/85/567428485.db2.gz LWYANFCKCWFVRQ-UHFFFAOYSA-N 0 0 387.191 3.321 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(Cl)c1 ZINC000477990016 567429842 /nfs/dbraw/zinc/42/98/42/567429842.db2.gz DGCREOASGKYXRL-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@@H](OC(C)C)C2)cc1[N+](=O)[O-] ZINC000593625415 567430273 /nfs/dbraw/zinc/43/02/73/567430273.db2.gz SWGKNLWCLLSJBU-GFCCVEGCSA-N 0 0 376.862 3.135 20 5 GGBDRN CC[C@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])[C@H](C)CO1 ZINC000593643690 567431441 /nfs/dbraw/zinc/43/14/41/567431441.db2.gz ZFZIJKXYAUZPKN-SCZZXKLOSA-N 0 0 383.253 3.090 20 5 GGBDRN CCn1cc(CN(C(C)C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000593646028 567431734 /nfs/dbraw/zinc/43/17/34/567431734.db2.gz KXAJHYRIDZNQKP-UHFFFAOYSA-N 0 0 386.861 3.064 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)CC(=O)OC(C)(C)C ZINC000550187281 567432318 /nfs/dbraw/zinc/43/23/18/567432318.db2.gz AQNWQSQZGRQBOW-UHFFFAOYSA-N 0 0 387.230 3.079 20 5 GGBDRN CS(=O)(=O)CC1(CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CCC1 ZINC000593712884 567435795 /nfs/dbraw/zinc/43/57/95/567435795.db2.gz QNITURPXLYNPBV-ZDUSSCGKSA-N 0 0 380.388 3.003 20 5 GGBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)Sc1ccc(Br)cc1 ZINC000478121841 567438668 /nfs/dbraw/zinc/43/86/68/567438668.db2.gz XAEKLPSDWWHUKU-VIFPVBQESA-N 0 0 399.270 3.001 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cnc1N(CCO)Cc1ccc(Br)s1 ZINC000478164942 567439191 /nfs/dbraw/zinc/43/91/91/567439191.db2.gz CMUSMXUAOAZUEW-UHFFFAOYSA-N 0 0 392.662 3.466 20 5 GGBDRN COc1ccc(CSc2cccc(S(N)(=O)=O)c2[N+](=O)[O-])cc1Cl ZINC000478168340 567439480 /nfs/dbraw/zinc/43/94/80/567439480.db2.gz OUBHSMHZDLTPJL-UHFFFAOYSA-N 0 0 388.854 3.197 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1Br ZINC000502509342 567439570 /nfs/dbraw/zinc/43/95/70/567439570.db2.gz VFDRUYHBJOTKAI-INIZCTEOSA-N 0 0 390.237 3.030 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCc1noc(C(F)(F)F)n1 ZINC000619253974 567441088 /nfs/dbraw/zinc/44/10/88/567441088.db2.gz AMXWKBNXMCKOID-UHFFFAOYSA-N 0 0 396.734 3.059 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC([C@@H](C)CO)CC1 ZINC000593827037 567441681 /nfs/dbraw/zinc/44/16/81/567441681.db2.gz BZMXKYRDLCRFCX-JTQLQIEISA-N 0 0 385.258 3.146 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1Br ZINC000502554045 567442754 /nfs/dbraw/zinc/44/27/54/567442754.db2.gz OBOXXIBYKCEOHF-INIZCTEOSA-N 0 0 390.237 3.030 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](CO)CC1CCCC1 ZINC000550398755 567444176 /nfs/dbraw/zinc/44/41/76/567444176.db2.gz LVDUOGFZOIRQIU-LBPRGKRZSA-N 0 0 385.258 3.337 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1Br ZINC000569964841 567447728 /nfs/dbraw/zinc/44/77/28/567447728.db2.gz WYZWMTLKNWXJCH-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN Cn1c(C(=O)N2CCCc3cc(Br)cc(F)c32)ccc1[N+](=O)[O-] ZINC000502766467 567450239 /nfs/dbraw/zinc/45/02/39/567450239.db2.gz RHAISZQCHDNFDR-UHFFFAOYSA-N 0 0 382.189 3.428 20 5 GGBDRN O=C(c1scc2c1OCCO2)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000593984597 567451094 /nfs/dbraw/zinc/45/10/94/567451094.db2.gz VKMHMSBPMUCFNX-INIZCTEOSA-N 0 0 378.431 3.315 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCOc2c(Br)cccc2C1 ZINC000619419275 567451620 /nfs/dbraw/zinc/45/16/20/567451620.db2.gz ICJXOUGNXVDHBM-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(N)=O)cc1 ZINC000550571193 567453032 /nfs/dbraw/zinc/45/30/32/567453032.db2.gz RCIVAPHTXZJDKO-UHFFFAOYSA-N 0 0 393.197 3.409 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1O ZINC000436800047 567453029 /nfs/dbraw/zinc/45/30/29/567453029.db2.gz HJDRWPFBOAWLMF-UHFFFAOYSA-N 0 0 395.165 3.102 20 5 GGBDRN O=C(CN1CCCC[C@H]1C(F)F)Nc1ccc([N+](=O)[O-])cc1Br ZINC000502804346 567453098 /nfs/dbraw/zinc/45/30/98/567453098.db2.gz SVRBCWZQPSZVSE-LBPRGKRZSA-N 0 0 392.200 3.415 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nc(CN(C)C)cs1 ZINC000457289443 567453455 /nfs/dbraw/zinc/45/34/55/567453455.db2.gz KUXODVXWFFPJEZ-SECBINFHSA-N 0 0 384.845 3.172 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1O ZINC000436806493 567454166 /nfs/dbraw/zinc/45/41/66/567454166.db2.gz VXZJUOPAKNTTKN-UHFFFAOYSA-N 0 0 395.165 3.102 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000478428095 567454699 /nfs/dbraw/zinc/45/46/99/567454699.db2.gz CBGKEQDNDQQHCW-AWEZNQCLSA-N 0 0 387.194 3.433 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1CCC(F)(F)CC1 ZINC000619457482 567454767 /nfs/dbraw/zinc/45/47/67/567454767.db2.gz PQSWBAPBRWZMLS-UHFFFAOYSA-N 0 0 396.131 3.071 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000478428920 567454914 /nfs/dbraw/zinc/45/49/14/567454914.db2.gz DRXXJVLDFONHTB-LBPRGKRZSA-N 0 0 385.203 3.130 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cc(F)c(F)cc1Cl ZINC000619467411 567455602 /nfs/dbraw/zinc/45/56/02/567455602.db2.gz GKXUTELHJITZNC-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCc2cc(Br)cc(F)c21 ZINC000478435277 567455925 /nfs/dbraw/zinc/45/59/25/567455925.db2.gz YZPHREATEDLAQJ-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2c(F)cc(F)cc2Br)c1 ZINC000550642157 567455976 /nfs/dbraw/zinc/45/59/76/567455976.db2.gz PHQAJIDSKLJCGB-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN COc1c(C(=O)N[C@H](CO)c2c(Cl)cccc2Cl)cccc1[N+](=O)[O-] ZINC000478448755 567457181 /nfs/dbraw/zinc/45/71/81/567457181.db2.gz LYKQWHZTVUPFSF-GFCCVEGCSA-N 0 0 385.203 3.374 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1ccc(Cl)s1 ZINC000619473494 567457318 /nfs/dbraw/zinc/45/73/18/567457318.db2.gz BMTQZNCIMSRNGK-UHFFFAOYSA-N 0 0 376.843 3.139 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCc2cc(Br)cc(F)c21 ZINC000478444874 567457706 /nfs/dbraw/zinc/45/77/06/567457706.db2.gz NDESNHPYYPDLNE-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN CN(Cc1ccc(F)cc1Br)c1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000570101170 567458585 /nfs/dbraw/zinc/45/85/85/567458585.db2.gz DKCPWFDAKFGGPO-UHFFFAOYSA-N 0 0 382.189 3.232 20 5 GGBDRN O=C(NCc1n[nH]cc1Br)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550710689 567458612 /nfs/dbraw/zinc/45/86/12/567458612.db2.gz WXFWQWIGIUINEM-UHFFFAOYSA-N 0 0 393.119 3.029 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccc(C)cc1SC ZINC000619490485 567459104 /nfs/dbraw/zinc/45/91/04/567459104.db2.gz JGMAYJASMJSDAC-UHFFFAOYSA-N 0 0 382.463 3.112 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000619487355 567459384 /nfs/dbraw/zinc/45/93/84/567459384.db2.gz YCMUOXHVZQOGIA-ZDUSSCGKSA-N 0 0 382.825 3.393 20 5 GGBDRN O=C(N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1ccc([N+](=O)[O-])o1 ZINC000478460716 567459625 /nfs/dbraw/zinc/45/96/25/567459625.db2.gz JMFOKOLOAUOMKI-JTQLQIEISA-N 0 0 378.690 3.323 20 5 GGBDRN O=C(N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1ccc([N+](=O)[O-])[nH]1 ZINC000478469037 567459829 /nfs/dbraw/zinc/45/98/29/567459829.db2.gz KRIGMBFHOZXYDI-NSHDSACASA-N 0 0 377.706 3.059 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H](CO)c1c(Cl)cccc1Cl ZINC000478462438 567459897 /nfs/dbraw/zinc/45/98/97/567459897.db2.gz TWKBLRBKXLVJNH-CQSZACIVSA-N 0 0 385.203 3.130 20 5 GGBDRN Cc1cnc(CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)c(C)c1 ZINC000594103380 567460048 /nfs/dbraw/zinc/46/00/48/567460048.db2.gz JVPFAQWKUNARMG-UHFFFAOYSA-N 0 0 378.226 3.342 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1c2ccccc2SC[C@H]1C ZINC000619507829 567460502 /nfs/dbraw/zinc/46/05/02/567460502.db2.gz ZJHFUDGXLPTJOT-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000594114446 567460624 /nfs/dbraw/zinc/46/06/24/567460624.db2.gz GJXMISCSXRLARF-SECBINFHSA-N 0 0 387.230 3.065 20 5 GGBDRN NS(=O)(=O)c1c(N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)cccc1[N+](=O)[O-] ZINC000619504634 567460731 /nfs/dbraw/zinc/46/07/31/567460731.db2.gz JVELLIUEPULNAC-AULYBMBSSA-N 0 0 381.841 3.254 20 5 GGBDRN COc1cc(C(=O)N[C@H](CO)c2c(Cl)cccc2Cl)ccc1[N+](=O)[O-] ZINC000478474065 567460995 /nfs/dbraw/zinc/46/09/95/567460995.db2.gz FPQOLAWHIGQOJJ-GFCCVEGCSA-N 0 0 385.203 3.374 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H](CO)c1c(Cl)cccc1Cl ZINC000478479171 567461249 /nfs/dbraw/zinc/46/12/49/567461249.db2.gz IQGFZUSPICKTBU-CYBMUJFWSA-N 0 0 384.219 3.163 20 5 GGBDRN C[C@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000594119526 567461757 /nfs/dbraw/zinc/46/17/57/567461757.db2.gz ZWDSAEDEEDFTNQ-SECBINFHSA-N 0 0 387.230 3.065 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)CCC(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000619532397 567461847 /nfs/dbraw/zinc/46/18/47/567461847.db2.gz FZDDDBSEFTWJSQ-UHFFFAOYSA-N 0 0 386.246 3.109 20 5 GGBDRN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)C(=O)OC(C)(C)C ZINC000594120734 567462026 /nfs/dbraw/zinc/46/20/26/567462026.db2.gz AXGGIPSRNBYBPS-SECBINFHSA-N 0 0 387.230 3.065 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](C)Cc1ccccn1 ZINC000594145753 567462032 /nfs/dbraw/zinc/46/20/32/567462032.db2.gz ZABJRNHYTRHZAC-JTQLQIEISA-N 0 0 378.226 3.422 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@@H]2C2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000619532643 567462439 /nfs/dbraw/zinc/46/24/39/567462439.db2.gz SBTNLZHSQLRNDF-CYBMUJFWSA-N 0 0 396.241 3.005 20 5 GGBDRN Cc1cnc(N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(Br)c1 ZINC000619547565 567463966 /nfs/dbraw/zinc/46/39/66/567463966.db2.gz YJNHMSCRFDUZLB-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN O=[N+]([O-])c1cccc2ncnc(NCc3ccc(O)c(Br)c3)c21 ZINC000436889692 567464633 /nfs/dbraw/zinc/46/46/33/567464633.db2.gz YZDDSEGHOVOLLH-UHFFFAOYSA-N 0 0 375.182 3.040 20 5 GGBDRN CCOC(=O)CCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(C)C ZINC000594191594 567464943 /nfs/dbraw/zinc/46/49/43/567464943.db2.gz UCXRNNMGQSSODW-UHFFFAOYSA-N 0 0 387.230 3.161 20 5 GGBDRN NC(=O)Nc1cc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])ccc1F ZINC000478546896 567465631 /nfs/dbraw/zinc/46/56/31/567465631.db2.gz WOMAYZKIWVAIGP-UHFFFAOYSA-N 0 0 397.160 3.239 20 5 GGBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ncccc1F ZINC000619574242 567466888 /nfs/dbraw/zinc/46/68/88/567466888.db2.gz JUAIQQHAIFVAKK-SECBINFHSA-N 0 0 382.189 3.311 20 5 GGBDRN O=C(NCCCc1c(Cl)cccc1Cl)NCCn1cc([N+](=O)[O-])cn1 ZINC000594230181 567467071 /nfs/dbraw/zinc/46/70/71/567467071.db2.gz OJSGEMLFXDWDCN-UHFFFAOYSA-N 0 0 386.239 3.030 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C1(c2cncc(Br)c2)CC1 ZINC000619589368 567467574 /nfs/dbraw/zinc/46/75/74/567467574.db2.gz GRGLFZLTIBILOK-UHFFFAOYSA-N 0 0 376.210 3.100 20 5 GGBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)CC(F)(F)F ZINC000503108557 567469925 /nfs/dbraw/zinc/46/99/25/567469925.db2.gz SWJFLPDOXOLBAM-UHFFFAOYSA-N 0 0 379.404 3.321 20 5 GGBDRN CCCn1c(=O)c2ccc(Cl)cc2nc1Sc1c([N+](=O)[O-])ncn1C ZINC000619721967 567475898 /nfs/dbraw/zinc/47/58/98/567475898.db2.gz HZLQUQHQQGBIFB-UHFFFAOYSA-N 0 0 379.829 3.253 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1Sc1nnc(-c2cccc(Br)c2)o1 ZINC000619715644 567476120 /nfs/dbraw/zinc/47/61/20/567476120.db2.gz 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GGBDRN COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])n2C)c(C)cc1Br ZINC000552408173 567587770 /nfs/dbraw/zinc/58/77/70/567587770.db2.gz ATLVLPJLPYIVIL-UHFFFAOYSA-N 0 0 396.197 3.043 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1 ZINC000530284352 567589327 /nfs/dbraw/zinc/58/93/27/567589327.db2.gz BGYMCAUFYSMFHZ-UHFFFAOYSA-N 0 0 380.275 3.433 20 5 GGBDRN Cc1cscc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000439485312 567589363 /nfs/dbraw/zinc/58/93/63/567589363.db2.gz HWVQITOQWGLYJK-UHFFFAOYSA-N 0 0 380.451 3.016 20 5 GGBDRN CC(C)(C)c1nnc2n1CCN(Cc1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000595894333 567589553 /nfs/dbraw/zinc/58/95/53/567589553.db2.gz UEMNLZGTKQNHCA-UHFFFAOYSA-N 0 0 394.273 3.262 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000530304002 567590489 /nfs/dbraw/zinc/59/04/89/567590489.db2.gz VYLFRMLGUXJFJF-JTQLQIEISA-N 0 0 394.225 3.181 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1nc2cc(Br)ccc2o1 ZINC000505693003 567591460 /nfs/dbraw/zinc/59/14/60/567591460.db2.gz BRKPVMGNDKLQRL-UHFFFAOYSA-N 0 0 390.149 3.455 20 5 GGBDRN COCC[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccco1 ZINC000505684007 567591956 /nfs/dbraw/zinc/59/19/56/567591956.db2.gz ZZMLIVIBPPOKBH-CQSZACIVSA-N 0 0 397.225 3.387 20 5 GGBDRN NS(=O)(=O)c1cc(NC[C@H]2CCC[C@@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000439601030 567594415 /nfs/dbraw/zinc/59/44/15/567594415.db2.gz ZOFVPHAPLPKBSZ-VHSXEESVSA-N 0 0 381.376 3.023 20 5 GGBDRN NS(=O)(=O)c1cc(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000439601028 567594872 /nfs/dbraw/zinc/59/48/72/567594872.db2.gz ZOFVPHAPLPKBSZ-NXEZZACHSA-N 0 0 381.376 3.023 20 5 GGBDRN O=C(Cc1ccc(NCc2csc([N+](=O)[O-])c2)cc1)N1CCSCC1 ZINC000480324172 567595440 /nfs/dbraw/zinc/59/54/40/567595440.db2.gz FNQGRMZMHYANBV-UHFFFAOYSA-N 0 0 377.491 3.386 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000552576540 567598324 /nfs/dbraw/zinc/59/83/24/567598324.db2.gz BHJMVASANIXWNX-LBPRGKRZSA-N 0 0 383.177 3.197 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCCCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000439696094 567598541 /nfs/dbraw/zinc/59/85/41/567598541.db2.gz MDPLABVZTVOTPK-UHFFFAOYSA-N 0 0 383.392 3.380 20 5 GGBDRN CCCCNC(=O)C1CCN(c2ncc([N+](=O)[O-])c(C)c2Br)CC1 ZINC000571922721 567599603 /nfs/dbraw/zinc/59/96/03/567599603.db2.gz BKOXQOOEMPVKHT-UHFFFAOYSA-N 0 0 399.289 3.193 20 5 GGBDRN COC(=O)c1cc(NCc2onc(C)c2[N+](=O)[O-])c(C)cc1Br ZINC000596031906 567600417 /nfs/dbraw/zinc/60/04/17/567600417.db2.gz GIJGJWQYTOKKIX-UHFFFAOYSA-N 0 0 384.186 3.361 20 5 GGBDRN CO[C@@]1(C)CCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000530426501 567600698 /nfs/dbraw/zinc/60/06/98/567600698.db2.gz DPCANCKQWGFDMW-ZDUSSCGKSA-N 0 0 376.194 3.205 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(Cl)c(Cl)cc1F ZINC000439759000 567601032 /nfs/dbraw/zinc/60/10/32/567601032.db2.gz UGGZPLFXDCSOLG-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN Cc1noc(CS(=O)(=O)[C@H](C)c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000596038156 567601526 /nfs/dbraw/zinc/60/15/26/567601526.db2.gz MLVJVZNDBXIFBT-SECBINFHSA-N 0 0 389.227 3.330 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000552676233 567602594 /nfs/dbraw/zinc/60/25/94/567602594.db2.gz HQDPIMNMUSSEMD-AWEZNQCLSA-N 0 0 397.200 3.268 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(c2ccccc2O)CC1 ZINC000596055044 567605334 /nfs/dbraw/zinc/60/53/34/567605334.db2.gz COXAJPLLWBGGFW-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN Cc1cc(N2CC[C@H](Cc3cnn(C)c3)C2)c(Br)cc1[N+](=O)[O-] ZINC000530489988 567606055 /nfs/dbraw/zinc/60/60/55/567606055.db2.gz IGWZXWQIWNLBSS-GFCCVEGCSA-N 0 0 379.258 3.468 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@H](C2CC2)O1 ZINC000480442973 567606134 /nfs/dbraw/zinc/60/61/34/567606134.db2.gz RTEAQLMKFSCRFM-OQPBUACISA-N 0 0 395.264 3.090 20 5 GGBDRN CC(C)(CNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000596084680 567606582 /nfs/dbraw/zinc/60/65/82/567606582.db2.gz KHWLAHXJKNTXDS-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN Cc1n[nH]cc1C1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000552741280 567606906 /nfs/dbraw/zinc/60/69/06/567606906.db2.gz FGEMKISRRXXLBP-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596109196 567609923 /nfs/dbraw/zinc/60/99/23/567609923.db2.gz GSGBJNPHUHNDOJ-GFCCVEGCSA-N 0 0 384.274 3.490 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](c1cccs1)C(C)(C)CO ZINC000572049503 567609908 /nfs/dbraw/zinc/60/99/08/567609908.db2.gz QHUBQGKJZUOUDE-OAHLLOKOSA-N 0 0 384.479 3.003 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596110090 567610021 /nfs/dbraw/zinc/61/00/21/567610021.db2.gz LPOJTBNEEHIAAT-GFCCVEGCSA-N 0 0 384.274 3.346 20 5 GGBDRN CC(C)C(=O)NC[C@@H]1CCCN(c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596110091 567610051 /nfs/dbraw/zinc/61/00/51/567610051.db2.gz LPOJTBNEEHIAAT-LBPRGKRZSA-N 0 0 384.274 3.346 20 5 GGBDRN O=[N+]([O-])c1cncc(Cl)c1N1CCC(n2cc(Br)cn2)CC1 ZINC000596121995 567610143 /nfs/dbraw/zinc/61/01/43/567610143.db2.gz QYKZBEWXGAGYDJ-UHFFFAOYSA-N 0 0 386.637 3.444 20 5 GGBDRN C[C@@H]1CN(c2ccc(I)cc2[N+](=O)[O-])C[C@H](C2CC2)O1 ZINC000530531593 567610093 /nfs/dbraw/zinc/61/00/93/567610093.db2.gz ATXROEDTMKOZOR-YMTOWFKASA-N 0 0 388.205 3.203 20 5 GGBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C)[C@@H](O)C(F)(F)F ZINC000572064011 567610133 /nfs/dbraw/zinc/61/01/33/567610133.db2.gz XPLYDBZXDIONFE-GHMZBOCLSA-N 0 0 399.163 3.097 20 5 GGBDRN CC(C)(C(=O)Nc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000572072639 567610923 /nfs/dbraw/zinc/61/09/23/567610923.db2.gz CXULJCGXQWCKSW-UHFFFAOYSA-N 0 0 382.825 3.439 20 5 GGBDRN CS(=O)(=O)[C@H]1CCC[C@@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596144939 567611112 /nfs/dbraw/zinc/61/11/12/567611112.db2.gz JDGCWGUXQOWXQS-ZJUUUORDSA-N 0 0 377.260 3.125 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@@H]2CCCC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000596150175 567611146 /nfs/dbraw/zinc/61/11/46/567611146.db2.gz HBUCITARXOXBOT-GXSJLCMTSA-N 0 0 381.376 3.023 20 5 GGBDRN CC[C@@H](Cc1ccc(Cl)cc1)Nc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 ZINC000596133734 567611174 /nfs/dbraw/zinc/61/11/74/567611174.db2.gz ZKBLMPVFWDHIKR-ZDUSSCGKSA-N 0 0 383.857 3.329 20 5 GGBDRN CS(=O)(=O)[C@H]1CCC[C@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596144937 567611259 /nfs/dbraw/zinc/61/12/59/567611259.db2.gz JDGCWGUXQOWXQS-UWVGGRQHSA-N 0 0 377.260 3.125 20 5 GGBDRN Cc1ccoc1C(=O)NCCCNc1c(Br)cccc1[N+](=O)[O-] ZINC000596133640 567611775 /nfs/dbraw/zinc/61/17/75/567611775.db2.gz JPECSRVMIRUZTH-UHFFFAOYSA-N 0 0 382.214 3.491 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCC[C@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596144938 567612048 /nfs/dbraw/zinc/61/20/48/567612048.db2.gz JDGCWGUXQOWXQS-VHSXEESVSA-N 0 0 377.260 3.125 20 5 GGBDRN CN(CC(=O)NCc1cc(Br)ccc1F)c1ccccc1[N+](=O)[O-] ZINC000506141778 567612106 /nfs/dbraw/zinc/61/21/06/567612106.db2.gz BPEJWCYYSZYITH-UHFFFAOYSA-N 0 0 396.216 3.249 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000596153949 567612496 /nfs/dbraw/zinc/61/24/96/567612496.db2.gz CTPYYLDMKVOMKG-VHSXEESVSA-N 0 0 381.376 3.023 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCC([C@H](O)C(F)(F)F)CC1 ZINC000596169200 567612653 /nfs/dbraw/zinc/61/26/53/567612653.db2.gz SJCOLZCPYJMXBM-LBPRGKRZSA-N 0 0 383.164 3.497 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000596153947 567613225 /nfs/dbraw/zinc/61/32/25/567613225.db2.gz CTPYYLDMKVOMKG-NXEZZACHSA-N 0 0 381.376 3.023 20 5 GGBDRN O=C1CCCCN1C1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596161484 567613345 /nfs/dbraw/zinc/61/33/45/567613345.db2.gz FCCTUVHIEDFLCI-UHFFFAOYSA-N 0 0 382.258 3.339 20 5 GGBDRN COC(=O)[C@H](Cc1ccc(C)cc1)Sc1nc2sccn2c1[N+](=O)[O-] ZINC000480583877 567613794 /nfs/dbraw/zinc/61/37/94/567613794.db2.gz SXZAWCZQGIZBPX-LBPRGKRZSA-N 0 0 377.447 3.489 20 5 GGBDRN Nc1nc(Sc2nc3c(cccc3Br)s2)ncc1[N+](=O)[O-] ZINC000480584862 567613973 /nfs/dbraw/zinc/61/39/73/567613973.db2.gz VCKYGGYGEFOQSO-UHFFFAOYSA-N 0 0 384.240 3.321 20 5 GGBDRN Cc1cc(N2CCC[C@@H](S(=O)(=O)Nc3ccccc3)C2)c([N+](=O)[O-])s1 ZINC000596190133 567614038 /nfs/dbraw/zinc/61/40/38/567614038.db2.gz ODNSLGYJJAPPIK-CQSZACIVSA-N 0 0 381.479 3.375 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](CO)Cc1cccc(Br)c1 ZINC000572108212 567614550 /nfs/dbraw/zinc/61/45/50/567614550.db2.gz LSUOOYKIYGBFQT-CYBMUJFWSA-N 0 0 397.273 3.145 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] ZINC000530617761 567615310 /nfs/dbraw/zinc/61/53/10/567615310.db2.gz UWTCENHLMDANDR-NWDGAFQWSA-N 0 0 383.857 3.456 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(CCc2cccc(Cl)c2)CC1 ZINC000459317290 567615445 /nfs/dbraw/zinc/61/54/45/567615445.db2.gz BSFCIIKQTNKGRT-UHFFFAOYSA-N 0 0 379.869 3.310 20 5 GGBDRN Cc1cc(N2CCN(c3nnc(C(F)(F)F)s3)CC2)c([N+](=O)[O-])s1 ZINC000596200728 567615806 /nfs/dbraw/zinc/61/58/06/567615806.db2.gz SAXXXGWPGGGVIS-UHFFFAOYSA-N 0 0 379.389 3.162 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000596210373 567615817 /nfs/dbraw/zinc/61/58/17/567615817.db2.gz HVKCXXKOYADPFU-PRHODGIISA-N 0 0 383.164 3.497 20 5 GGBDRN CCOC(=O)c1cnc(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)s1 ZINC000596213854 567615940 /nfs/dbraw/zinc/61/59/40/567615940.db2.gz IEDFFGRVVFIYIK-UHFFFAOYSA-N 0 0 375.328 3.281 20 5 GGBDRN CCC(C)(C)N(C)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000480611832 567616095 /nfs/dbraw/zinc/61/60/95/567616095.db2.gz PEODYRYPBJMYIH-UHFFFAOYSA-N 0 0 379.276 3.475 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3cccc(O)c3Br)C2)nc1 ZINC000459337612 567616656 /nfs/dbraw/zinc/61/66/56/567616656.db2.gz FKPFKJGSAHPTSE-GFCCVEGCSA-N 0 0 393.241 3.144 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3cccc(O)c3Br)C2)nc1 ZINC000459337614 567617045 /nfs/dbraw/zinc/61/70/45/567617045.db2.gz FKPFKJGSAHPTSE-LBPRGKRZSA-N 0 0 393.241 3.144 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H]2CCC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000440125632 567617027 /nfs/dbraw/zinc/61/70/27/567617027.db2.gz ZJUXTTPZCPMQBB-KOLCDFICSA-N 0 0 398.257 3.157 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1NC[C@H]1CCC2(CCOCC2)[C@@H]1O ZINC000596227952 567617174 /nfs/dbraw/zinc/61/71/74/567617174.db2.gz VAJSZXGIHPMPLK-IAQYHMDHSA-N 0 0 385.258 3.337 20 5 GGBDRN NC(=O)c1cccc(NCCc2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000552953585 567617369 /nfs/dbraw/zinc/61/73/69/567617369.db2.gz XPKQHSPLVMUKNN-UHFFFAOYSA-N 0 0 382.189 3.250 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CC[C@H](C(F)(F)F)[C@@H](CO)C1 ZINC000596232830 567617569 /nfs/dbraw/zinc/61/75/69/567617569.db2.gz ZJZGMXCCHHACMY-BDAKNGLRSA-N 0 0 383.164 3.354 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](c1nccn1C)C1CC1 ZINC000552942177 567617771 /nfs/dbraw/zinc/61/77/71/567617771.db2.gz GAUQHKYGHKJSHB-AWEZNQCLSA-N 0 0 393.241 3.280 20 5 GGBDRN CC1(C)C(=O)N[C@H]1C1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596248275 567618328 /nfs/dbraw/zinc/61/83/28/567618328.db2.gz WDCBWVPGBBJBAB-AWEZNQCLSA-N 0 0 382.258 3.098 20 5 GGBDRN C[C@H]1CCSCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000480647061 567618771 /nfs/dbraw/zinc/61/87/71/567618771.db2.gz NGERSUJCWWUCKT-QMMMGPOBSA-N 0 0 385.294 3.418 20 5 GGBDRN NS(=O)(=O)c1ccc(N[C@H]2C[C@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000596246567 567618791 /nfs/dbraw/zinc/61/87/91/567618791.db2.gz DXZNGENAHMXOSE-UMSPYCQHSA-N 0 0 381.841 3.254 20 5 GGBDRN CC1(C)C(=O)N[C@@H]1C1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596248276 567618819 /nfs/dbraw/zinc/61/88/19/567618819.db2.gz WDCBWVPGBBJBAB-CQSZACIVSA-N 0 0 382.258 3.098 20 5 GGBDRN COc1ccccc1OCCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000530710239 567619470 /nfs/dbraw/zinc/61/94/70/567619470.db2.gz KUTWATVNUMRPKP-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN COc1cc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])ccc1O ZINC000530713160 567619653 /nfs/dbraw/zinc/61/96/53/567619653.db2.gz DKHVKRJPOVVOBQ-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN C[C@@H](C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccc(Cl)s1 ZINC000530687146 567619778 /nfs/dbraw/zinc/61/97/78/567619778.db2.gz FJZJOCWUNLTTQP-LLVKDONJSA-N 0 0 380.857 3.157 20 5 GGBDRN CN1CC[NH+](CC2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000553001456 567620481 /nfs/dbraw/zinc/62/04/81/567620481.db2.gz AGAJFHPDBQSQGA-UHFFFAOYSA-N 0 0 387.311 3.365 20 5 GGBDRN COc1cccc(Cl)c1CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000480690612 567621047 /nfs/dbraw/zinc/62/10/47/567621047.db2.gz AHAPGGMOKFMCCR-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN Cc1cc(NCC2(S(C)(=O)=O)CCC2)c(Br)cc1[N+](=O)[O-] ZINC000480692443 567621544 /nfs/dbraw/zinc/62/15/44/567621544.db2.gz GOMKEUWSLMHVRA-UHFFFAOYSA-N 0 0 377.260 3.045 20 5 GGBDRN CCOC1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCCC1 ZINC000506388896 567623735 /nfs/dbraw/zinc/62/37/35/567623735.db2.gz OMVGBTLPKUOBDP-UHFFFAOYSA-N 0 0 385.258 3.365 20 5 GGBDRN CC(C)OC1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000530791328 567623971 /nfs/dbraw/zinc/62/39/71/567623971.db2.gz VWSCWEHDVBBSDH-UHFFFAOYSA-N 0 0 385.258 3.316 20 5 GGBDRN CS(=O)(=O)c1cccc(OCCSCc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000596342421 567625318 /nfs/dbraw/zinc/62/53/18/567625318.db2.gz LFDWWWHOYUVMHZ-UHFFFAOYSA-N 0 0 385.438 3.450 20 5 GGBDRN COCCN([C@H]1CC[C@@H](C)C1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000480756001 567627366 /nfs/dbraw/zinc/62/73/66/567627366.db2.gz IWQNSNHXKYVYJA-NEPJUHHUSA-N 0 0 376.862 3.074 20 5 GGBDRN Cc1cc(F)c(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000459473165 567627424 /nfs/dbraw/zinc/62/74/24/567627424.db2.gz BAPULCKYGNLJPO-UHFFFAOYSA-N 0 0 386.832 3.259 20 5 GGBDRN COC(=O)c1cc([N-]S(=O)(=O)c2cccc(C)c2Cl)cc([N+](=O)[O-])c1 ZINC000553149596 567631060 /nfs/dbraw/zinc/63/10/60/567631060.db2.gz GQYSKZVWFZTOKL-UHFFFAOYSA-N 0 0 384.797 3.144 20 5 GGBDRN COc1ccc([C@@H](C)Nc2nccc(C(N)=O)c2[N+](=O)[O-])cc1Br ZINC000572352190 567632359 /nfs/dbraw/zinc/63/23/59/567632359.db2.gz WSWKPIPOPBHSIQ-MRVPVSSYSA-N 0 0 395.213 3.033 20 5 GGBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3cccc(O)c3Br)CC2)n1 ZINC000459518734 567632436 /nfs/dbraw/zinc/63/24/36/567632436.db2.gz PBUFPLAVVCHOCU-UHFFFAOYSA-N 0 0 381.230 3.097 20 5 GGBDRN Cn1cnc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)ccc21 ZINC000440528351 567632610 /nfs/dbraw/zinc/63/26/10/567632610.db2.gz VLDJAEUAZLCWAO-UHFFFAOYSA-N 0 0 375.182 3.496 20 5 GGBDRN COc1ccc([C@H](C)Nc2nccc(C(N)=O)c2[N+](=O)[O-])cc1Br ZINC000572352191 567632684 /nfs/dbraw/zinc/63/26/84/567632684.db2.gz WSWKPIPOPBHSIQ-QMMMGPOBSA-N 0 0 395.213 3.033 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)Cc1ccc(Cl)c(F)c1)CC2 ZINC000480804908 567632913 /nfs/dbraw/zinc/63/29/13/567632913.db2.gz OWWZUOORYKAMHG-UHFFFAOYSA-N 0 0 384.816 3.275 20 5 GGBDRN C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1c1ccc(N)c([N+](=O)[O-])n1 ZINC000596441487 567633054 /nfs/dbraw/zinc/63/30/54/567633054.db2.gz OVHBUGZIWVLRBX-BMIGLBTASA-N 0 0 393.241 3.301 20 5 GGBDRN CCNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000530949270 567633120 /nfs/dbraw/zinc/63/31/20/567633120.db2.gz VOMXVWLYZRGCAL-UHFFFAOYSA-N 0 0 392.209 3.359 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCOC[C@H]2c2ccc(Br)cc2)c(F)c1 ZINC000596467540 567634232 /nfs/dbraw/zinc/63/42/32/567634232.db2.gz RQDRXGWPHWNYBT-AWEZNQCLSA-N 0 0 382.189 3.469 20 5 GGBDRN NC(=O)[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(Br)c1 ZINC000440592545 567634236 /nfs/dbraw/zinc/63/42/36/567634236.db2.gz GWJNAEQJDZTWIG-LBPRGKRZSA-N 0 0 386.152 3.274 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2ccc(Br)cc2)CC1 ZINC000596456941 567634819 /nfs/dbraw/zinc/63/48/19/567634819.db2.gz VRSROUAMLRMTFT-UHFFFAOYSA-N 0 0 394.273 3.209 20 5 GGBDRN CCn1nc(C)c(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1C ZINC000531027194 567636898 /nfs/dbraw/zinc/63/68/98/567636898.db2.gz VXGJNEPJDDKKQJ-UHFFFAOYSA-N 0 0 395.257 3.049 20 5 GGBDRN CNC(=O)CC1(CNc2ncc(Br)cc2[N+](=O)[O-])CCCCC1 ZINC000596523003 567636922 /nfs/dbraw/zinc/63/69/22/567636922.db2.gz FBYSSMYVCUUDLF-UHFFFAOYSA-N 0 0 385.262 3.251 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2ccncc2OCC(F)F)c(Br)c1 ZINC000440676771 567639924 /nfs/dbraw/zinc/63/99/24/567639924.db2.gz WOAWWKQJRPWMNT-UHFFFAOYSA-N 0 0 389.156 3.403 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1CCC[C@@H]1C(F)F ZINC000553286781 567640853 /nfs/dbraw/zinc/64/08/53/567640853.db2.gz FSFDFEKXHLOEFK-SNVBAGLBSA-N 0 0 396.131 3.069 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CC[C@H](Oc2ccccc2)C1 ZINC000572479103 567642279 /nfs/dbraw/zinc/64/22/79/567642279.db2.gz DLFMWYUKXHAMPJ-AWEZNQCLSA-N 0 0 382.825 3.090 20 5 GGBDRN COCCc1ccnc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000553347401 567646216 /nfs/dbraw/zinc/64/62/16/567646216.db2.gz XPRHBEJLBIDQDY-UHFFFAOYSA-N 0 0 380.198 3.194 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2ccc(O)cc2)c(S(=O)(=O)N2CCCC2)c1 ZINC000506874620 567646997 /nfs/dbraw/zinc/64/69/97/567646997.db2.gz OOQGKAGFBKPBQY-UHFFFAOYSA-N 0 0 380.447 3.236 20 5 GGBDRN NC(=O)c1cccc(N[C@@H]2C[C@@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000553375369 567647319 /nfs/dbraw/zinc/64/73/19/567647319.db2.gz PDZVQLQCMDGQFS-TZMCWYRMSA-N 0 0 376.210 3.424 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CCCN(S(=O)(=O)C3CC3)C2)c(Cl)c1 ZINC000553366665 567647508 /nfs/dbraw/zinc/64/75/08/567647508.db2.gz AQCQVJYARLFINF-SECBINFHSA-N 0 0 394.280 3.270 20 5 GGBDRN CC(C)SCCNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000553366792 567647654 /nfs/dbraw/zinc/64/76/54/567647654.db2.gz IIVLWMINCVFBKY-UHFFFAOYSA-N 0 0 387.527 3.323 20 5 GGBDRN CCN(CC(=O)N1CCCCCC1)c1ncc([N+](=O)[O-])c(C)c1Br ZINC000553390312 567649756 /nfs/dbraw/zinc/64/97/56/567649756.db2.gz YFTGNNNQTGSPNG-UHFFFAOYSA-N 0 0 399.289 3.290 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2nc3c(cccc3Br)s2)c1[N+](=O)[O-] ZINC000553408679 567651119 /nfs/dbraw/zinc/65/11/19/567651119.db2.gz QNCNGCGYVLMWIS-UHFFFAOYSA-N 0 0 382.199 3.251 20 5 GGBDRN COc1ccc(CNC(=O)COc2cccc([N+](=O)[O-])c2)cc1Br ZINC000506987193 567652429 /nfs/dbraw/zinc/65/24/29/567652429.db2.gz FZVPJVQKCFCITJ-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN NS(=O)(=O)c1cc(N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)cc([N+](=O)[O-])c1 ZINC000481045494 567654823 /nfs/dbraw/zinc/65/48/23/567654823.db2.gz XUXAAPAOMITPGN-AULYBMBSSA-N 0 0 381.841 3.254 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])cc1Cl ZINC000481078455 567657133 /nfs/dbraw/zinc/65/71/33/567657133.db2.gz GQLWDIWWESAFBJ-UHFFFAOYSA-N 0 0 384.841 3.352 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCC(C(F)F)CC1 ZINC000481081018 567657227 /nfs/dbraw/zinc/65/72/27/567657227.db2.gz YPJYFAVKASDLOO-UHFFFAOYSA-N 0 0 399.213 3.023 20 5 GGBDRN CN(C[C@H](O)Cc1ccccc1)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000481148454 567660808 /nfs/dbraw/zinc/66/08/08/567660808.db2.gz WWPDQHSUWZXYET-CQSZACIVSA-N 0 0 393.237 3.033 20 5 GGBDRN CN(C[C@H](O)Cc1ccccc1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000481137910 567660972 /nfs/dbraw/zinc/66/09/72/567660972.db2.gz ILXQDXQUGRHEJP-MRXNPFEDSA-N 0 0 393.237 3.033 20 5 GGBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCC(=O)N(C)CC(F)(F)F ZINC000531482078 567661938 /nfs/dbraw/zinc/66/19/38/567661938.db2.gz ANELPJGOURNYSY-UHFFFAOYSA-N 0 0 385.136 3.065 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1nc2c(s1)CCC2 ZINC000531503833 567662426 /nfs/dbraw/zinc/66/24/26/567662426.db2.gz UOKDQGGBHNIPHR-UHFFFAOYSA-N 0 0 382.239 3.484 20 5 GGBDRN COc1cc(C(=O)Nc2cc(Br)ccc2O)cc([N+](=O)[O-])c1OC ZINC000531492549 567663424 /nfs/dbraw/zinc/66/34/24/567663424.db2.gz GYYAIZAZQKJFSD-UHFFFAOYSA-N 0 0 397.181 3.332 20 5 GGBDRN CCN([C@@H](C)C(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000481217824 567663345 /nfs/dbraw/zinc/66/33/45/567663345.db2.gz IOGQLJKPYGVOSU-VIFPVBQESA-N 0 0 377.344 3.104 20 5 GGBDRN CC(C)(CNS(=O)(=O)c1cccnc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000531549919 567664834 /nfs/dbraw/zinc/66/48/34/567664834.db2.gz RMTITUVSXGBVNV-UHFFFAOYSA-N 0 0 383.857 3.190 20 5 GGBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N(C)CC(=O)Nc1ccc(Br)cn1 ZINC000441493402 567665293 /nfs/dbraw/zinc/66/52/93/567665293.db2.gz SWKCCUAYDYIYHP-NSHDSACASA-N 0 0 393.241 3.384 20 5 GGBDRN CO[C@@]1(C)CCCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000481245601 567666152 /nfs/dbraw/zinc/66/61/52/567666152.db2.gz HOBBSUGCTRCICR-AWEZNQCLSA-N 0 0 397.280 3.481 20 5 GGBDRN COc1c(C(=O)N2CCOc3c(Br)cccc32)cccc1[N+](=O)[O-] ZINC000441516321 567666719 /nfs/dbraw/zinc/66/67/19/567666719.db2.gz XBYAAJWUPZVYMF-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCSC2)c(C(F)(F)F)c1 ZINC000553569716 567666979 /nfs/dbraw/zinc/66/69/79/567666979.db2.gz AKMAPBGJUVWYQX-SECBINFHSA-N 0 0 384.401 3.035 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])c1ncccc1I ZINC000553577949 567668469 /nfs/dbraw/zinc/66/84/69/567668469.db2.gz FMIFKUCQSOQNMT-UHFFFAOYSA-N 0 0 383.189 3.273 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCn1cc(Br)cn1 ZINC000553585549 567670148 /nfs/dbraw/zinc/67/01/48/567670148.db2.gz DBQHZLISKYHVQJ-UHFFFAOYSA-N 0 0 399.270 3.096 20 5 GGBDRN COCC1(Cc2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)CC1 ZINC000572878406 567672143 /nfs/dbraw/zinc/67/21/43/567672143.db2.gz DYLCLGUVYYGHSC-UHFFFAOYSA-N 0 0 382.214 3.300 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CC[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000481336124 567672423 /nfs/dbraw/zinc/67/24/23/567672423.db2.gz GLZSSFIZQGFCLT-PSASIEDQSA-N 0 0 377.260 3.085 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1[C@H]1CCCOC1 ZINC000572883958 567672670 /nfs/dbraw/zinc/67/26/70/567672670.db2.gz VPQSQRHOTPUAJT-NHYWBVRUSA-N 0 0 383.242 3.389 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000572907974 567673893 /nfs/dbraw/zinc/67/38/93/567673893.db2.gz KYCJPGMKRMQCBE-SNVBAGLBSA-N 0 0 378.226 3.499 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H](F)C1 ZINC000553663035 567674297 /nfs/dbraw/zinc/67/42/97/567674297.db2.gz WYSCABAUHUNFHO-RKDXNWHRSA-N 0 0 392.168 3.128 20 5 GGBDRN COc1ccc(CNC(=O)Nc2ccc(Br)c(C)n2)cc1[N+](=O)[O-] ZINC000481370843 567675041 /nfs/dbraw/zinc/67/50/41/567675041.db2.gz JMNIYFFPLFQINT-UHFFFAOYSA-N 0 0 395.213 3.391 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1OCCO[C@H]1CCCCO1 ZINC000441822627 567675697 /nfs/dbraw/zinc/67/56/97/567675697.db2.gz MTGVQLLJEISZQU-ZDUSSCGKSA-N 0 0 393.177 3.121 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCSCc2ccccc2F)c([N+](=O)[O-])c1 ZINC000507436211 567678905 /nfs/dbraw/zinc/67/89/05/567678905.db2.gz NSSIERYWDXVMSF-UHFFFAOYSA-N 0 0 384.454 3.254 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N(CC2CC2)C2CCC2)c1 ZINC000481465297 567679336 /nfs/dbraw/zinc/67/93/36/567679336.db2.gz NZUYRJSVLFFMOU-UHFFFAOYSA-N 0 0 389.271 3.311 20 5 GGBDRN CS(=O)(=O)C1(CNc2ccc(Br)cc2[N+](=O)[O-])CCCC1 ZINC000553728290 567679373 /nfs/dbraw/zinc/67/93/73/567679373.db2.gz LSISRXAFVTWDGL-UHFFFAOYSA-N 0 0 377.260 3.127 20 5 GGBDRN Cc1c(CNC(=O)COc2ccccc2Br)cccc1[N+](=O)[O-] ZINC000481476811 567680517 /nfs/dbraw/zinc/68/05/17/567680517.db2.gz FZZMGLDCKUPCLC-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN CCc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1Cl ZINC000573032677 567682413 /nfs/dbraw/zinc/68/24/13/567682413.db2.gz ZVQCCMXUKQWEDR-UHFFFAOYSA-N 0 0 382.825 3.466 20 5 GGBDRN CCN(CCOc1ccc(Br)cc1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000460273977 567682421 /nfs/dbraw/zinc/68/24/21/567682421.db2.gz GNCOTQCFPQRJOI-UHFFFAOYSA-N 0 0 396.241 3.237 20 5 GGBDRN CC(C)[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCCO1 ZINC000573040264 567683363 /nfs/dbraw/zinc/68/33/63/567683363.db2.gz YQGKDXNPUWVAJG-OAHLLOKOSA-N 0 0 385.258 3.173 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)[C@H](C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000553783754 567684029 /nfs/dbraw/zinc/68/40/29/567684029.db2.gz RVBHIZRDDWVGFI-NSHDSACASA-N 0 0 382.825 3.358 20 5 GGBDRN CC(C)[C@@H]1N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC12CCOCC2 ZINC000573073282 567684512 /nfs/dbraw/zinc/68/45/12/567684512.db2.gz HXABVUHFYMDUPA-HNNXBMFYSA-N 0 0 388.873 3.074 20 5 GGBDRN O=C(CSCc1cccnc1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000460359880 567685745 /nfs/dbraw/zinc/68/57/45/567685745.db2.gz CIAABWAUJFGHND-KRWDZBQOSA-N 0 0 375.475 3.497 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cc(Cl)c1=O)c1sccc1Br ZINC000531908763 567686079 /nfs/dbraw/zinc/68/60/79/567686079.db2.gz CEKCRKQDFVMDIV-UHFFFAOYSA-N 0 0 377.603 3.117 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N(C)Cc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000531909732 567686827 /nfs/dbraw/zinc/68/68/27/567686827.db2.gz JHFNJNOQQLLNTA-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2cc(Cl)cc(F)c2F)ccc1[N+](=O)[O-] ZINC000442245940 567688107 /nfs/dbraw/zinc/68/81/07/567688107.db2.gz CEPHYBFKKIONCK-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cc(Cl)cc(F)c1F ZINC000442251615 567688346 /nfs/dbraw/zinc/68/83/46/567688346.db2.gz QRWRPSVFNMGJJI-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN COC(=O)c1cccc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)c1 ZINC000507597048 567688964 /nfs/dbraw/zinc/68/89/64/567688964.db2.gz FQEDSPHGCRLJKA-UHFFFAOYSA-N 0 0 381.431 3.077 20 5 GGBDRN Cc1c(Br)c(N2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ncc1[N+](=O)[O-] ZINC000573118364 567689148 /nfs/dbraw/zinc/68/91/48/567689148.db2.gz RUAPIJRRLVCRCV-BDAKNGLRSA-N 0 0 398.179 3.058 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000531956719 567689332 /nfs/dbraw/zinc/68/93/32/567689332.db2.gz DIPJEOBMPOLDAO-UHFFFAOYSA-N 0 0 388.232 3.044 20 5 GGBDRN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000573118643 567689649 /nfs/dbraw/zinc/68/96/49/567689649.db2.gz SQYDIVRNWVDRLS-PCSJOYPTSA-N 0 0 395.253 3.161 20 5 GGBDRN COc1ccccc1OCCSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1 ZINC000507592669 567689620 /nfs/dbraw/zinc/68/96/20/567689620.db2.gz XDEGVHRJYVOQMY-UHFFFAOYSA-N 0 0 383.447 3.178 20 5 GGBDRN Cn1ncc(Cl)c1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000597215554 567690107 /nfs/dbraw/zinc/69/01/07/567690107.db2.gz FXLNKBHDDRVRME-UHFFFAOYSA-N 0 0 376.722 3.186 20 5 GGBDRN CN(c1cccc(OC(F)(F)F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000442354401 567690469 /nfs/dbraw/zinc/69/04/69/567690469.db2.gz DRKUUQQFRVTEDK-UHFFFAOYSA-N 0 0 376.312 3.319 20 5 GGBDRN Cc1cccc(OC[C@H](O)COc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000573148641 567691232 /nfs/dbraw/zinc/69/12/32/567691232.db2.gz UBJREUXYJRWIQM-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN O=C(COc1cccc(Br)c1)NCCc1ccccc1[N+](=O)[O-] ZINC000460506090 567691435 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Cc1ccc(S(=O)(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(Br)c1 ZINC000460632345 567695282 /nfs/dbraw/zinc/69/52/82/567695282.db2.gz AVFWDQWWQPQRDV-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN O=C(NCCCOc1ccc(C(F)(F)F)cn1)c1ccc([N+](=O)[O-])s1 ZINC000481688369 567695330 /nfs/dbraw/zinc/69/53/30/567695330.db2.gz BDFIKLJOXGYBFI-UHFFFAOYSA-N 0 0 375.328 3.269 20 5 GGBDRN COc1cc(OC[C@H](O)COc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000481706578 567696892 /nfs/dbraw/zinc/69/68/92/567696892.db2.gz KBYVWRXQVNYZDE-GFCCVEGCSA-N 0 0 398.209 3.185 20 5 GGBDRN C[C@@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccc(F)c(Br)c1 ZINC000507679369 567697079 /nfs/dbraw/zinc/69/70/79/567697079.db2.gz TVAQUWCDDWJPID-SSDOTTSWSA-N 0 0 384.161 3.088 20 5 GGBDRN C[C@H](Cc1ccccc1Br)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000532107645 567697219 /nfs/dbraw/zinc/69/72/19/567697219.db2.gz QQPZQZBPYAVLCG-LLVKDONJSA-N 0 0 399.266 3.267 20 5 GGBDRN C[C@H](NC(=O)c1cn2ccc(Br)cc2n1)c1cccc([N+](=O)[O-])c1 ZINC000507685573 567697254 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C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000532224993 567703976 /nfs/dbraw/zinc/70/39/76/567703976.db2.gz HDNDPNRFYSANNQ-VIFPVBQESA-N 0 0 384.205 3.196 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(NC[C@@H](O)COc2ccccc2Br)c1 ZINC000532217538 567704576 /nfs/dbraw/zinc/70/45/76/567704576.db2.gz WXNPYJMDKMWQTE-LLVKDONJSA-N 0 0 397.225 3.218 20 5 GGBDRN CCOC(=O)C(CC)(CC)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000554022498 567705914 /nfs/dbraw/zinc/70/59/14/567705914.db2.gz ADVVFVMFIPULJY-UHFFFAOYSA-N 0 0 387.230 3.209 20 5 GGBDRN CCc1n[nH]c(C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])c1Br ZINC000554064066 567707572 /nfs/dbraw/zinc/70/75/72/567707572.db2.gz YXENGTWJGNTKPT-UHFFFAOYSA-N 0 0 381.230 3.308 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC(C)(C)O1 ZINC000442774993 567708252 /nfs/dbraw/zinc/70/82/52/567708252.db2.gz BGOJEAORNNUXEV-UHFFFAOYSA-N 0 0 397.280 3.480 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2cnccc2C(F)(F)F)c(Cl)c1 ZINC000442768806 567708531 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C[C@@H](C[S@@](C)=O)NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000442890338 567715477 /nfs/dbraw/zinc/71/54/77/567715477.db2.gz JUMUBQUJAYFBBJ-UOXLDJKESA-N 0 0 378.475 3.243 20 5 GGBDRN C[C@H](C[S@@](C)=O)NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000442890341 567716349 /nfs/dbraw/zinc/71/63/49/567716349.db2.gz JUMUBQUJAYFBBJ-XELLLNAOSA-N 0 0 378.475 3.243 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCCC1CSC1 ZINC000597794316 567718175 /nfs/dbraw/zinc/71/81/75/567718175.db2.gz MYCIQUOTFSSCAC-UHFFFAOYSA-N 0 0 377.388 3.285 20 5 GGBDRN CSc1ccc2ncnc(-n3cc(Br)c(=O)c([N+](=O)[O-])c3)c2c1 ZINC000573519855 567719075 /nfs/dbraw/zinc/71/90/75/567719075.db2.gz JYRQNXQNRLNKPV-UHFFFAOYSA-N 0 0 393.222 3.173 20 5 GGBDRN CC[C@@H](C)N(CC)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000597856910 567719276 /nfs/dbraw/zinc/71/92/76/567719276.db2.gz QLTVEABTBFDEBT-SECBINFHSA-N 0 0 376.194 3.460 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000507976918 567719546 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O=C(c1cc(Br)c[nH]c1=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000598696671 567783317 /nfs/dbraw/zinc/78/33/17/567783317.db2.gz SSTKZFMNBPQBPN-UHFFFAOYSA-N 0 0 392.209 3.263 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CC[C@H](CC3CC3)C2)c1 ZINC000555429430 567783844 /nfs/dbraw/zinc/78/38/44/567783844.db2.gz PVZMZPFELVVGBN-LLVKDONJSA-N 0 0 389.271 3.168 20 5 GGBDRN COc1ccc(/C=C/c2nc(N(C)C)ncc2Br)cc1[N+](=O)[O-] ZINC000555467787 567784907 /nfs/dbraw/zinc/78/49/07/567784907.db2.gz PFCAGBSMLZTKRW-GQCTYLIASA-N 0 0 379.214 3.392 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](c2cccs2)C(C)(C)CO)ccc1[N+](=O)[O-] ZINC000574558338 567785116 /nfs/dbraw/zinc/78/51/16/567785116.db2.gz HHDROWAQRQHKBX-HNNXBMFYSA-N 0 0 384.479 3.003 20 5 GGBDRN Cc1cc(C(=O)N2CC(=O)Nc3ccc(Br)cc32)ccc1[N+](=O)[O-] ZINC000533760088 567785987 /nfs/dbraw/zinc/78/59/87/567785987.db2.gz XPEOEKNNNPCVSU-UHFFFAOYSA-N 0 0 390.193 3.265 20 5 GGBDRN Cc1sc(S(=O)(=O)N2Cc3ccccc3OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000574580650 567786280 /nfs/dbraw/zinc/78/62/80/567786280.db2.gz GILISLAQAVFCEN-UHFFFAOYSA-N 0 0 382.463 3.327 20 5 GGBDRN CC[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H](C)S1(=O)=O ZINC000555527594 567786689 /nfs/dbraw/zinc/78/66/89/567786689.db2.gz IMQBKOQHHKJGMW-GWCFXTLKSA-N 0 0 380.388 3.011 20 5 GGBDRN Cc1cc(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)ccc1Br ZINC000533849288 567789670 /nfs/dbraw/zinc/78/96/70/567789670.db2.gz PCDFPLWFDUNTQD-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N=c1cc(-c2ccc(Cl)s2)[nH][nH]1 ZINC000533841398 567789957 /nfs/dbraw/zinc/78/99/57/567789957.db2.gz YTHOIURUHYKPNN-UHFFFAOYSA-N 0 0 378.797 3.383 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(OC[C@@H](O)COc2cccc(Br)c2)c1 ZINC000555582049 567790127 /nfs/dbraw/zinc/79/01/27/567790127.db2.gz ZKRPALXXRAAGNW-ZDUSSCGKSA-N 0 0 386.173 3.315 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)c2ccc([N+](=O)[O-])nc2)c(Cl)c1Cl ZINC000574664297 567790369 /nfs/dbraw/zinc/79/03/69/567790369.db2.gz SLQNIMMNJFMPMG-UHFFFAOYSA-N 0 0 392.220 3.130 20 5 GGBDRN C[C@H]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000533880889 567791858 /nfs/dbraw/zinc/79/18/58/567791858.db2.gz LZMXWLLSEBERJH-UWVGGRQHSA-N 0 0 388.205 3.365 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCNS(=O)(=O)c2ccc(Cl)cc2Cl)cc1 ZINC000555677347 567794326 /nfs/dbraw/zinc/79/43/26/567794326.db2.gz KPLVABLDXNPNSV-UHFFFAOYSA-N 0 0 391.232 3.259 20 5 GGBDRN COCC1(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000574730150 567794348 /nfs/dbraw/zinc/79/43/48/567794348.db2.gz YDQMMVKVKDQHTN-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN CC(C)CCS(=O)(=O)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000574732678 567794376 /nfs/dbraw/zinc/79/43/76/567794376.db2.gz PQELJVVLEVRXGA-UHFFFAOYSA-N 0 0 397.234 3.160 20 5 GGBDRN CS(=O)(=O)C1(CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CCCC1 ZINC000574761945 567795210 /nfs/dbraw/zinc/79/52/10/567795210.db2.gz PTLMIUDYIRQAPE-ZDUSSCGKSA-N 0 0 380.388 3.145 20 5 GGBDRN CCc1cc(Br)c(C)nc1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000598862748 567795498 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O=C([O-])/C=C/c1ccc(NCC2([NH+]3CCCCC3)CCOCC2)c([N+](=O)[O-])c1 ZINC000739623459 600260652 /nfs/dbraw/zinc/26/06/52/600260652.db2.gz FMRPKBCOLQIOOV-FNORWQNLSA-N 0 0 389.452 3.140 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)C[C@H](C)C(=O)[O-])c([N+](=O)[O-])c1 ZINC000263376162 600374190 /nfs/dbraw/zinc/37/41/90/600374190.db2.gz WPZIKNBXOVTVIR-KSSFIOAISA-N 0 0 385.420 3.236 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)C[C@@H](C)C(=O)[O-])c([N+](=O)[O-])c1 ZINC000263376161 600374316 /nfs/dbraw/zinc/37/43/16/600374316.db2.gz WPZIKNBXOVTVIR-KDOFPFPSSA-N 0 0 385.420 3.236 20 5 GGBDRN Cc1nccn1-c1ccc(CNc2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)cc1F ZINC000826330674 607452418 /nfs/dbraw/zinc/45/24/18/607452418.db2.gz CVKIUJWRJTVVGX-UHFFFAOYSA-N 0 0 394.370 3.020 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNc2ncc(Cl)cc2Cl)cc1-c1nn[nH]n1 ZINC000826498984 607452884 /nfs/dbraw/zinc/45/28/84/607452884.db2.gz QXSGVGTWVGOUFS-UHFFFAOYSA-N 0 0 395.210 3.001 20 5 GGBDRN C[NH+](C)CCn1ccc2ccc(NC(=O)c3cc(C(=O)[O-])cc([N+](=O)[O-])c3)cc21 ZINC000737368812 600674950 /nfs/dbraw/zinc/67/49/50/600674950.db2.gz VMXYPZTVGBXIQV-UHFFFAOYSA-N 0 0 396.403 3.062 20 5 GGBDRN O=C1Nc2cc(Cl)c([N+](=O)[O-])cc2C1=Cc1ccc(-c2nn[nH]n2)cc1F ZINC000823546670 607458786 /nfs/dbraw/zinc/45/87/86/607458786.db2.gz CYYKFKFNFQONSV-KMKOMSMNSA-N 0 0 386.730 3.060 20 5 GGBDRN C[C@H](C[N@@H+](Cc1ccccc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)[O-] ZINC000736581750 600685317 /nfs/dbraw/zinc/68/53/17/600685317.db2.gz DAGSWEFQULZBTD-OAHLLOKOSA-N 0 0 395.419 3.034 20 5 GGBDRN O=C(Cn1ccc2ccccc21)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000826424450 607466949 /nfs/dbraw/zinc/46/69/49/607466949.db2.gz MRRUHGVIKFFHNP-UHFFFAOYSA-N 0 0 397.782 3.022 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000823629972 607468364 /nfs/dbraw/zinc/46/83/64/607468364.db2.gz OLRXCJQSQKDWJG-YJBOKZPZSA-N 0 0 398.398 3.007 20 5 GGBDRN C[C@H](CC[NH+](C)C)Nc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-] ZINC000827412798 600811158 /nfs/dbraw/zinc/81/11/58/600811158.db2.gz SJTHUYHPXNVPPY-CYBMUJFWSA-N 0 0 385.420 3.276 20 5 GGBDRN C[C@H](C[N@@H+](Cc1ccccc1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C(=O)[O-] ZINC000736584807 601089911 /nfs/dbraw/zinc/08/99/11/601089911.db2.gz QECPCDSJFAFDDA-OAHLLOKOSA-N 0 0 395.419 3.034 20 5 GGBDRN C[C@H]1C[C@@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000828177399 601173012 /nfs/dbraw/zinc/17/30/12/601173012.db2.gz PTSSFBKACHWZRK-KSSFIOAISA-N 0 0 397.431 3.076 20 5 GGBDRN C[C@@H]1C[C@@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000828177398 601173173 /nfs/dbraw/zinc/17/31/73/601173173.db2.gz PTSSFBKACHWZRK-KDOFPFPSSA-N 0 0 397.431 3.076 20 5 GGBDRN C[C@H](C(=O)[O-])[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000826053094 601202602 /nfs/dbraw/zinc/20/26/02/601202602.db2.gz IERLVTIITGFQIM-APPDUMDISA-N 0 0 391.811 3.238 20 5 GGBDRN C[C@H](C(=O)[O-])[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000826055091 601203718 /nfs/dbraw/zinc/20/37/18/601203718.db2.gz VPAZCYNXQSCKHZ-APPDUMDISA-N 0 0 391.811 3.238 20 5 GGBDRN C[C@@H](C(=O)[O-])[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000826055092 601203815 /nfs/dbraw/zinc/20/38/15/601203815.db2.gz VPAZCYNXQSCKHZ-DIFFPNOSSA-N 0 0 391.811 3.238 20 5 GGBDRN C[C@@H](C(=O)[O-])[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000826055094 601203888 /nfs/dbraw/zinc/20/38/88/601203888.db2.gz VPAZCYNXQSCKHZ-PIGZYNQJSA-N 0 0 391.811 3.238 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000832905409 601206335 /nfs/dbraw/zinc/20/63/35/601206335.db2.gz IRALPGYRPNKIPH-KUHUBIRLSA-N 0 0 385.420 3.283 20 5 GGBDRN Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(c3sccc3C(=O)[O-])C2=O)cc1[N+](=O)[O-] ZINC000832920813 601368993 /nfs/dbraw/zinc/36/89/93/601368993.db2.gz HXFNOXUGOHADGD-RISCZKNCSA-N 0 0 389.433 3.119 20 5 GGBDRN Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(c3sccc3C(=O)[O-])C2=O)cc1[N+](=O)[O-] ZINC000832920815 601369185 /nfs/dbraw/zinc/36/91/85/601369185.db2.gz HXFNOXUGOHADGD-SMDDNHRTSA-N 0 0 389.433 3.119 20 5 GGBDRN CC[C@H]([NH2+][C@H](C)C(=O)NCc1ccc(C(=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000828982950 601380381 /nfs/dbraw/zinc/38/03/81/601380381.db2.gz KGJYRUBUWBJXJQ-ACJLOTCBSA-N 0 0 385.420 3.039 20 5 GGBDRN CC[C@H]([NH2+][C@@H]1CCN(c2sccc2C(=O)[O-])C1=O)c1cccc([N+](=O)[O-])c1 ZINC000828983024 601380437 /nfs/dbraw/zinc/38/04/37/601380437.db2.gz MSFQPSWRGBMGCB-LSDHHAIUSA-N 0 0 389.433 3.201 20 5 GGBDRN CC[C@H]([NH2+][C@H]1CCN(c2sccc2C(=O)[O-])C1=O)c1cccc([N+](=O)[O-])c1 ZINC000828983020 601380567 /nfs/dbraw/zinc/38/05/67/601380567.db2.gz MSFQPSWRGBMGCB-GJZGRUSLSA-N 0 0 389.433 3.201 20 5 GGBDRN CCC1CCC([NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)(C(=O)[O-])CC1 ZINC000829107978 601497583 /nfs/dbraw/zinc/49/75/83/601497583.db2.gz VAKLXUFUYUNWIX-UHFFFAOYSA-N 0 0 377.441 3.245 20 5 GGBDRN O=C(CCc1ccsc1)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000826409399 607525117 /nfs/dbraw/zinc/52/51/17/607525117.db2.gz XDAXGBUZUZCCEZ-UHFFFAOYSA-N 0 0 378.801 3.061 20 5 GGBDRN COc1cc(C[NH+]2CCC(CCC(=O)[O-])CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000563273236 601841330 /nfs/dbraw/zinc/84/13/30/601841330.db2.gz MYVYLZCXZIAJPI-UHFFFAOYSA-N 0 0 388.367 3.282 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2CC[C@](C)(C(=O)[O-])C2)c([N+](=O)[O-])c1 ZINC000263577298 601947548 /nfs/dbraw/zinc/94/75/48/601947548.db2.gz RJXKUCJVIQLCQD-RXVVDRJESA-N 0 0 397.431 3.380 20 5 GGBDRN O=C([O-])c1cc([N+](=O)[O-])c(NC2CC[NH+](C[C@H]3CCCO3)CC2)cc1Cl ZINC000833307508 602252638 /nfs/dbraw/zinc/25/26/38/602252638.db2.gz PGCJVPYMZQXDFC-GFCCVEGCSA-N 0 0 383.832 3.002 20 5 GGBDRN O=C([O-])c1cc([N+](=O)[O-])c(NCCN2CCc3sccc3C2)cc1Cl ZINC000833307057 602253670 /nfs/dbraw/zinc/25/36/70/602253670.db2.gz KBUMYBBWDQIPPE-UHFFFAOYSA-N 0 0 381.841 3.478 20 5 GGBDRN O=C([O-])N1CC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000833278343 604420802 /nfs/dbraw/zinc/42/08/02/604420802.db2.gz LCTYJIPBOGNIOU-UHFFFAOYSA-N 0 0 377.784 3.492 20 5 GGBDRN CC(C)(C(=O)[O-])[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000833421585 604938581 /nfs/dbraw/zinc/93/85/81/604938581.db2.gz SGDRDRGTNPNLHO-LLVKDONJSA-N 0 0 383.832 3.010 20 5 GGBDRN CC(C)(C(=O)[O-])[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000833421537 604949082 /nfs/dbraw/zinc/94/90/82/604949082.db2.gz QZEXZLBKXHJOLP-LLVKDONJSA-N 0 0 383.832 3.010 20 5 GGBDRN C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(c2c(C(=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000833603081 605036287 /nfs/dbraw/zinc/03/62/87/605036287.db2.gz LZLYZTZHDYAMHW-JHJVBQTASA-N 0 0 392.412 3.043 20 5 GGBDRN CC(C)(C(=O)[O-])[C@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000833419882 605042506 /nfs/dbraw/zinc/04/25/06/605042506.db2.gz XSTGFPXUNNJTDO-LBPRGKRZSA-N 0 0 380.832 3.378 20 5 GGBDRN COc1cc(C)cc(CNc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)c1 ZINC000826178046 607731225 /nfs/dbraw/zinc/73/12/25/607731225.db2.gz HSNALOKNRFKBPW-UHFFFAOYSA-N 0 0 391.391 3.252 20 5 GGBDRN C[C@@H]1C[N@H+](CCC(=O)[O-])CCN1C(=O)c1cc2ccccc2c2cccnc12 ZINC000833626637 605159642 /nfs/dbraw/zinc/15/96/42/605159642.db2.gz QMUCCNZCBZZVAT-OAHLLOKOSA-N 0 0 377.444 3.009 20 5 GGBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)c(-c2nn[nH]n2)c1 ZINC000823070736 606109047 /nfs/dbraw/zinc/10/90/47/606109047.db2.gz LPHPQPJVHZOKBY-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN O=C(Nc1ccc(-c2nn[nH]n2)c(Cl)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000823308784 606123603 /nfs/dbraw/zinc/12/36/03/606123603.db2.gz JKXQNDLQGRZVMB-UHFFFAOYSA-N 0 0 379.163 3.334 20 5 GGBDRN CC(C)(C)n1cc(-c2nn[nH]n2)cc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000819975787 606125976 /nfs/dbraw/zinc/12/59/76/606125976.db2.gz CVAVZKCYIWUFBR-UHFFFAOYSA-N 0 0 389.803 3.237 20 5 GGBDRN CC[C@H](NC(=O)Nc1cc(-c2nn[nH]n2)ccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000820921035 606151950 /nfs/dbraw/zinc/15/19/50/606151950.db2.gz VBBGIFDFXBNXIF-AWEZNQCLSA-N 0 0 397.395 3.056 20 5 GGBDRN Cc1nn(C)c(Oc2ccc(Oc3ccc(-c4nn[nH]n4)cc3)cc2)c1[N+](=O)[O-] ZINC000822496763 606242048 /nfs/dbraw/zinc/24/20/48/606242048.db2.gz UISXKGMWMBKTGH-UHFFFAOYSA-N 0 0 393.363 3.401 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CSc3cccc(-c4nn[nH]n4)c3)n2)c1 ZINC000823647997 606326930 /nfs/dbraw/zinc/32/69/30/606326930.db2.gz RPDDJBCAQYPWNQ-UHFFFAOYSA-N 0 0 381.377 3.117 20 5 GGBDRN C[C@H](OC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[nH]n2)cc1 ZINC000820481100 606347048 /nfs/dbraw/zinc/34/70/48/606347048.db2.gz SQBRENFRFWIGKF-LBPRGKRZSA-N 0 0 381.392 3.357 20 5 GGBDRN C[C@H](OC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccc(-c2nn[nH]n2)cc1 ZINC000820508542 606398095 /nfs/dbraw/zinc/39/80/95/606398095.db2.gz RDAXBIVSMIMQPV-JTQLQIEISA-N 0 0 378.348 3.174 20 5 GGBDRN CC(=O)c1ccc2cc(Oc3ncc([N+](=O)[O-])cc3-c3nn[nH]n3)ccc2c1 ZINC000819835230 606402318 /nfs/dbraw/zinc/40/23/18/606402318.db2.gz UERCTOXTZWIYQR-UHFFFAOYSA-N 0 0 376.332 3.318 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[C@H](O)c1c(F)cccc1Cl ZINC000820456561 606418981 /nfs/dbraw/zinc/41/89/81/606418981.db2.gz VHPMRCRVOYZSHL-GLEZIHRCSA-N 0 0 392.778 3.101 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N3CCC[C@H]3c3cccnc3)cc(-c3nn[nH]n3)c2c1 ZINC000823643813 606445698 /nfs/dbraw/zinc/44/56/98/606445698.db2.gz BULFDMDCJJWESK-KRWDZBQOSA-N 0 0 388.391 3.060 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CSc2ccc(-c3nn[nH]n3)cc2)cc1[N+](=O)[O-] ZINC000822228614 606448258 /nfs/dbraw/zinc/44/82/58/606448258.db2.gz AJHPXTKSKARKDF-LBPRGKRZSA-N 0 0 398.448 3.053 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(F)cc2-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000822229386 606580199 /nfs/dbraw/zinc/58/01/99/606580199.db2.gz SZAVVCAWTFCRPM-JTQLQIEISA-N 0 0 385.359 3.105 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OCc1ccc(-c2nn[nH]n2)cc1OC(F)F ZINC000822271031 606590878 /nfs/dbraw/zinc/59/08/78/606590878.db2.gz JEFXKKDIWTUHDY-UHFFFAOYSA-N 0 0 377.307 3.264 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1OCc1ccc(-c2nn[nH]n2)cc1OC(F)F ZINC000823634195 606591420 /nfs/dbraw/zinc/59/14/20/606591420.db2.gz CKXZEVCLRCCFLY-UHFFFAOYSA-N 0 0 381.270 3.094 20 5 GGBDRN O=C(OCc1ccc(Cl)c([N+](=O)[O-])c1)c1c(F)cc(-c2nn[nH]n2)cc1F ZINC000823422323 606680243 /nfs/dbraw/zinc/68/02/43/606680243.db2.gz QGJCXEOPFMULAH-UHFFFAOYSA-N 0 0 395.709 3.064 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000823620991 606700132 /nfs/dbraw/zinc/70/01/32/606700132.db2.gz VHSUIDBLCKEBHU-ZDUSSCGKSA-N 0 0 390.407 3.035 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000823620221 606704090 /nfs/dbraw/zinc/70/40/90/606704090.db2.gz IIJYGBOEDNKZOH-UHFFFAOYSA-N 0 0 390.407 3.035 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Sc1cccc(Br)c1 ZINC000823630537 606707145 /nfs/dbraw/zinc/70/71/45/606707145.db2.gz ZQWBLYFSFRXHSW-UHFFFAOYSA-N 0 0 379.199 3.084 20 5 GGBDRN CC[C@@H]1CN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000820995232 606714866 /nfs/dbraw/zinc/71/48/66/606714866.db2.gz 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Cc1c(NCC(=O)Nc2ccccc2C(=O)NCC(C)C)cccc1[N+](=O)[O-] ZINC000011260843 1398964882 /nfs/dbraw/zinc/96/48/82/1398964882.db2.gz MSMGJBWEBPUQLM-UHFFFAOYSA-N 0 0 384.436 3.340 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@H]1[C@@H](C=C(C)C)C1(C)C ZINC000011260354 1398964929 /nfs/dbraw/zinc/96/49/29/1398964929.db2.gz UIYMVESGVCNDGT-CXAGYDPISA-N 0 0 376.409 3.324 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@@H]1[C@H](C=C(C)C)C1(C)C ZINC000011260372 1398964936 /nfs/dbraw/zinc/96/49/36/1398964936.db2.gz UIYMVESGVCNDGT-GUYCJALGSA-N 0 0 376.409 3.324 20 5 GGBDRN CC(C)N(C(=O)COC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000011310757 1398968811 /nfs/dbraw/zinc/96/88/11/1398968811.db2.gz MIWIGQKTBBQDKQ-UHFFFAOYSA-N 0 0 385.420 3.382 20 5 GGBDRN CC[C@@H]1CCCCN1C(=O)[C@@H](C)OC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000011313484 1398969012 /nfs/dbraw/zinc/96/90/12/1398969012.db2.gz UNDVKRVMXPCCMY-HUUCEWRRSA-N 0 0 377.441 3.120 20 5 GGBDRN Cc1ccc(NC(=O)COC(=O)CCNc2ccccc2[N+](=O)[O-])c(F)c1 ZINC000011311859 1398969025 /nfs/dbraw/zinc/96/90/25/1398969025.db2.gz XBAHZWHIUXORLR-UHFFFAOYSA-N 0 0 375.356 3.026 20 5 GGBDRN CCN(C(=O)[C@H](C)OC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000011313775 1398969450 /nfs/dbraw/zinc/96/94/50/1398969450.db2.gz SOPPAKVGZPUMFW-HNNXBMFYSA-N 0 0 385.420 3.382 20 5 GGBDRN C[C@H](c1ccccc1)N(C)C(=O)COC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000011315763 1398969893 /nfs/dbraw/zinc/96/98/93/1398969893.db2.gz FVMGKXZBNYWTJK-OAHLLOKOSA-N 0 0 385.420 3.160 20 5 GGBDRN C[C@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(F)cc1F ZINC000011364344 1398973030 /nfs/dbraw/zinc/97/30/30/1398973030.db2.gz WADGHHHBUVFEJM-NSHDSACASA-N 0 0 393.346 3.245 20 5 GGBDRN C[C@@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(F)cc1F ZINC000011364350 1398973155 /nfs/dbraw/zinc/97/31/55/1398973155.db2.gz WADGHHHBUVFEJM-LLVKDONJSA-N 0 0 393.346 3.245 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1C)c1cccc(OC)c1 ZINC000055536947 1406993643 /nfs/dbraw/zinc/99/36/43/1406993643.db2.gz KCZONNFHLXWGFX-QGZVFWFLSA-N 0 0 386.404 3.336 20 5 GGBDRN CCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)c(OC)c1 ZINC000011367067 1398974384 /nfs/dbraw/zinc/97/43/84/1398974384.db2.gz MDXSGUKCBLXQAU-UHFFFAOYSA-N 0 0 387.436 3.097 20 5 GGBDRN C[C@H]1CCc2ccccc2N1C(=O)COC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000011366195 1398974580 /nfs/dbraw/zinc/97/45/80/1398974580.db2.gz UKELAWOWDULTOT-HNNXBMFYSA-N 0 0 397.431 3.308 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](OC(=O)[C@@H]2CCCO2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000011392905 1398976693 /nfs/dbraw/zinc/97/66/93/1398976693.db2.gz SMJGAGUBQYMPTI-ROUUACIJSA-N 0 0 384.388 3.305 20 5 GGBDRN CCOc1ccc(NC(=O)CSc2nncn2-c2ccccc2)c([N+](=O)[O-])c1 ZINC000011428007 1398979864 /nfs/dbraw/zinc/97/98/64/1398979864.db2.gz OGLPHABNTODHCX-UHFFFAOYSA-N 0 0 399.432 3.305 20 5 GGBDRN CN(C(=O)COC(=O)c1cc(F)c(F)cc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000011433023 1398980651 /nfs/dbraw/zinc/98/06/51/1398980651.db2.gz PRSLDWAJHFEISE-UHFFFAOYSA-N 0 0 384.722 3.346 20 5 GGBDRN COc1cc(NC(=O)COc2cc(F)ccc2[N+](=O)[O-])c(OC)cc1Cl ZINC000011453503 1398982161 /nfs/dbraw/zinc/98/21/61/1398982161.db2.gz GVMOZQVAFZSYJJ-UHFFFAOYSA-N 0 0 384.747 3.422 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1cccc(OC(F)F)c1 ZINC000011463914 1398982661 /nfs/dbraw/zinc/98/26/61/1398982661.db2.gz WAWAGCMAHPIUMP-UHFFFAOYSA-N 0 0 396.302 3.000 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCCc2nc3ccccc3[nH]2)cc1OC ZINC000011486398 1398985539 /nfs/dbraw/zinc/98/55/39/1398985539.db2.gz VFTNSIOBVOSIIX-UHFFFAOYSA-N 0 0 398.419 3.241 20 5 GGBDRN O=C(NC1CCN(C(=O)c2ccco2)CC1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000011529448 1398989281 /nfs/dbraw/zinc/98/92/81/1398989281.db2.gz ZNIRWBKGIJHISI-UHFFFAOYSA-N 0 0 399.428 3.437 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)ccc1[N+](=O)[O-] ZINC000011546963 1398991743 /nfs/dbraw/zinc/99/17/43/1398991743.db2.gz UQDDPZJNDNQBON-MRXNPFEDSA-N 0 0 383.452 3.241 20 5 GGBDRN COc1cc(C(=O)Nc2nc3ccccc3[nH]2)c([N+](=O)[O-])cc1OC(F)F ZINC000011543836 1398991750 /nfs/dbraw/zinc/99/17/50/1398991750.db2.gz CANJUNWWQCTWBK-UHFFFAOYSA-N 0 0 378.291 3.333 20 5 GGBDRN COc1cc(C(=O)NCCc2ccccc2F)c([N+](=O)[O-])cc1OC(F)F ZINC000011545035 1398991876 /nfs/dbraw/zinc/99/18/76/1398991876.db2.gz YILJQDIQCMMUIZ-UHFFFAOYSA-N 0 0 384.310 3.316 20 5 GGBDRN COc1cc(NC(=O)CNc2ccc(F)c([N+](=O)[O-])c2)c(OC)cc1Cl ZINC000011549556 1398992580 /nfs/dbraw/zinc/99/25/80/1398992580.db2.gz MCTCSBBPFGZAJC-UHFFFAOYSA-N 0 0 383.763 3.455 20 5 GGBDRN O=C(CNc1ccc(Cl)c([N+](=O)[O-])c1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000011550056 1398992770 /nfs/dbraw/zinc/99/27/70/1398992770.db2.gz FNSJNTQDTDNMNB-UHFFFAOYSA-N 0 0 388.811 3.191 20 5 GGBDRN CC[NH+](CC)CCn1c2ccccc2nc1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000011559983 1398993538 /nfs/dbraw/zinc/99/35/38/1398993538.db2.gz YXTQHMOALUYFKZ-UHFFFAOYSA-N 0 0 397.435 3.244 20 5 GGBDRN C[C@@H](Sc1n[nH]c(Cc2cccs2)n1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000011601586 1398998791 /nfs/dbraw/zinc/99/87/91/1398998791.db2.gz ATEFLBWLVRTHEU-SNVBAGLBSA-N 0 0 389.462 3.485 20 5 GGBDRN NC(=O)c1ccc(NCc2ccc(NC(=O)c3ccco3)cc2)c([N+](=O)[O-])c1 ZINC000011607711 1398999471 /nfs/dbraw/zinc/99/94/71/1398999471.db2.gz KFSYFCGMMYEOLI-UHFFFAOYSA-N 0 0 380.360 3.151 20 5 GGBDRN COc1ccc([C@@H](NC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])C(C)C)cc1 ZINC000011642362 1399000901 /nfs/dbraw/zinc/00/09/01/1399000901.db2.gz LOPJVCGJNLUYFW-FQEVSTJZSA-N 0 0 386.404 3.308 20 5 GGBDRN C[C@H](Sc1ncnc2c1cnn2C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000011677233 1399004445 /nfs/dbraw/zinc/00/44/45/1399004445.db2.gz DPHOFIVSTXXKII-QMMMGPOBSA-N 0 0 392.828 3.044 20 5 GGBDRN Cc1cccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1O ZINC000011710920 1399006721 /nfs/dbraw/zinc/00/67/21/1399006721.db2.gz KFFXDKNCKOJTFO-JTQLQIEISA-N 0 0 378.768 3.446 20 5 GGBDRN COc1cc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000011712464 1399007794 /nfs/dbraw/zinc/00/77/94/1399007794.db2.gz ZERSAWATLSUZAV-UHFFFAOYSA-N 0 0 395.362 3.323 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2cc3c(cc2s1)OCCO3 ZINC000011751990 1399010306 /nfs/dbraw/zinc/01/03/06/1399010306.db2.gz WSIIVRCHVXDNHV-UHFFFAOYSA-N 0 0 387.373 3.237 20 5 GGBDRN C[C@@H](OC(=O)Cc1ccc2c(c1)CCO2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000011806869 1399012403 /nfs/dbraw/zinc/01/24/03/1399012403.db2.gz DQNREZQWLPZRJQ-GFCCVEGCSA-N 0 0 395.371 3.427 20 5 GGBDRN C[C@H](OC(=O)Cc1ccc2c(c1)CCO2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000011806863 1399012407 /nfs/dbraw/zinc/01/24/07/1399012407.db2.gz DQNREZQWLPZRJQ-LBPRGKRZSA-N 0 0 395.371 3.427 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)c2cc(Cl)c(Cl)[nH]2)c([N+](=O)[O-])c1 ZINC000011808976 1399013045 /nfs/dbraw/zinc/01/30/45/1399013045.db2.gz AZFNZYKSVPZVRT-UHFFFAOYSA-N 0 0 388.163 3.034 20 5 GGBDRN CC(=O)Nc1c(C)cccc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000011812246 1399013732 /nfs/dbraw/zinc/01/37/32/1399013732.db2.gz BXTDMLHZGARGGR-LBPRGKRZSA-N 0 0 385.376 3.046 20 5 GGBDRN CC(=O)Nc1c(C)cccc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000011812247 1399013771 /nfs/dbraw/zinc/01/37/71/1399013771.db2.gz BXTDMLHZGARGGR-GFCCVEGCSA-N 0 0 385.376 3.046 20 5 GGBDRN CC(=O)Nc1c(C)cccc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000011811470 1399013780 /nfs/dbraw/zinc/01/37/80/1399013780.db2.gz PGMHQJWAXYFMTG-GFCCVEGCSA-N 0 0 385.376 3.046 20 5 GGBDRN CC(=O)Nc1c(C)cccc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000011811469 1399013785 /nfs/dbraw/zinc/01/37/85/1399013785.db2.gz PGMHQJWAXYFMTG-LBPRGKRZSA-N 0 0 385.376 3.046 20 5 GGBDRN Cc1ccc2c(CC(=O)OCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)coc2c1 ZINC000011954089 1399020512 /nfs/dbraw/zinc/02/05/12/1399020512.db2.gz GHXPDSQCEIHCJF-UHFFFAOYSA-N 0 0 382.372 3.398 20 5 GGBDRN Cc1nn(C)c2sc(C(=O)O[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)cc12 ZINC000011968649 1399021131 /nfs/dbraw/zinc/02/11/31/1399021131.db2.gz LFAYQKKPJJQURW-JTQLQIEISA-N 0 0 388.405 3.035 20 5 GGBDRN Cc1nn(C)c2sc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)cc12 ZINC000011971927 1399021605 /nfs/dbraw/zinc/02/16/05/1399021605.db2.gz UGJNUWQYVLBICE-JTQLQIEISA-N 0 0 388.405 3.035 20 5 GGBDRN CCCC(=O)Nc1cccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000055549716 1406997620 /nfs/dbraw/zinc/99/76/20/1406997620.db2.gz GHTLNLGRGQDIIH-UHFFFAOYSA-N 0 0 398.419 3.092 20 5 GGBDRN CN(C(=O)COC(=O)/C=C/c1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1 ZINC000012035631 1399024671 /nfs/dbraw/zinc/02/46/71/1399024671.db2.gz FGLMGMVPLXSODX-ZHACJKMWSA-N 0 0 397.412 3.424 20 5 GGBDRN CCc1ccccc1N1C[C@@H](C(=O)OCc2cc([N+](=O)[O-])ccc2OC)CC1=O ZINC000012095101 1399028707 /nfs/dbraw/zinc/02/87/07/1399028707.db2.gz VDFBWABBKNGKFQ-HNNXBMFYSA-N 0 0 398.415 3.262 20 5 GGBDRN COCC(=O)N1CCc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc21 ZINC000012134406 1399030730 /nfs/dbraw/zinc/03/07/30/1399030730.db2.gz FZQZCLLVKLROGQ-UHFFFAOYSA-N 0 0 389.795 3.036 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)O[C@H](C(=O)NC1CC1)c1ccc(F)cc1 ZINC000012257503 1399035314 /nfs/dbraw/zinc/03/53/14/1399035314.db2.gz DTIYPJSWWYMJEY-AEKHXQSKSA-N 0 0 384.363 3.310 20 5 GGBDRN Cc1c(C(=O)NCCCOc2ccccc2F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000012392067 1399040773 /nfs/dbraw/zinc/04/07/73/1399040773.db2.gz ICEYPPHSQRBAHS-UHFFFAOYSA-N 0 0 377.328 3.149 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NC1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000012488463 1399045980 /nfs/dbraw/zinc/04/59/80/1399045980.db2.gz CLAWYVQNLHGALW-UHFFFAOYSA-N 0 0 398.415 3.331 20 5 GGBDRN CCc1ccc(C(=O)[C@H](C)OC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000012511761 1399046709 /nfs/dbraw/zinc/04/67/09/1399046709.db2.gz JWAHHUGQRSWRAX-AWEZNQCLSA-N 0 0 398.415 3.010 20 5 GGBDRN Cc1c(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1 ZINC000012581398 1399048644 /nfs/dbraw/zinc/04/86/44/1399048644.db2.gz OCSJMUOIZCYFGN-CQSZACIVSA-N 0 0 394.387 3.273 20 5 GGBDRN O=C(CSc1nccn1C1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000012647136 1399052114 /nfs/dbraw/zinc/05/21/14/1399052114.db2.gz RKYRVUYTFCRHNH-UHFFFAOYSA-N 0 0 390.421 3.018 20 5 GGBDRN Cc1ccc(C(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)cc1[N+](=O)[O-] 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CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000015409542 1399162244 /nfs/dbraw/zinc/16/22/44/1399162244.db2.gz JCRZBDYVSLIEQS-ZDUSSCGKSA-N 0 0 391.449 3.232 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000015418876 1399162647 /nfs/dbraw/zinc/16/26/47/1399162647.db2.gz UDNWBKTYELGBPY-UHFFFAOYSA-N 0 0 388.323 3.269 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1S(=O)(=O)N(C)C ZINC000015425319 1399163481 /nfs/dbraw/zinc/16/34/81/1399163481.db2.gz HTJDRIHBJRCZRO-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)Nc2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000015421246 1399163490 /nfs/dbraw/zinc/16/34/90/1399163490.db2.gz MBHZBHJVUSRXTN-UHFFFAOYSA-N 0 0 385.420 3.269 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCN(c2ccccc2F)CC1 ZINC000015433343 1399163872 /nfs/dbraw/zinc/16/38/72/1399163872.db2.gz XUNIKGGQTATBGS-UHFFFAOYSA-N 0 0 384.411 3.271 20 5 GGBDRN Cc1c(NC(=O)Cc2csc(NC(=O)c3ccco3)n2)cccc1[N+](=O)[O-] ZINC000015426410 1399164030 /nfs/dbraw/zinc/16/40/30/1399164030.db2.gz QSZAHVZCGYKAIF-UHFFFAOYSA-N 0 0 386.389 3.386 20 5 GGBDRN COc1ccc(CN(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000015440223 1399164561 /nfs/dbraw/zinc/16/45/61/1399164561.db2.gz WCTWHOXFEZSXGP-UHFFFAOYSA-N 0 0 376.434 3.363 20 5 GGBDRN COC(=O)c1cc(C(=O)NCCCSc2ccc(F)cc2)cc([N+](=O)[O-])c1 ZINC000015497436 1399167059 /nfs/dbraw/zinc/16/70/59/1399167059.db2.gz RZBMEKHOGRXLGE-UHFFFAOYSA-N 0 0 392.408 3.433 20 5 GGBDRN COCCOc1cccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000055572352 1407007828 /nfs/dbraw/zinc/00/78/28/1407007828.db2.gz LOLXUMAETFYYND-UHFFFAOYSA-N 0 0 382.376 3.058 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000015507831 1399167858 /nfs/dbraw/zinc/16/78/58/1399167858.db2.gz JKXKCSVJEHHURD-OAHLLOKOSA-N 0 0 396.447 3.273 20 5 GGBDRN O=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000015512288 1399168371 /nfs/dbraw/zinc/16/83/71/1399168371.db2.gz IUOJLFLVPGHXGD-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000015538740 1399170123 /nfs/dbraw/zinc/17/01/23/1399170123.db2.gz QNOZFFAIZARYTM-HNNXBMFYSA-N 0 0 384.388 3.109 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)Nc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000015543546 1399170892 /nfs/dbraw/zinc/17/08/92/1399170892.db2.gz BOZGTLFVZWWPTL-UHFFFAOYSA-N 0 0 379.372 3.125 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC(C(=O)Nc2ccccc2)CC1 ZINC000015550749 1399171443 /nfs/dbraw/zinc/17/14/43/1399171443.db2.gz NKVVJEMASVJUAW-UHFFFAOYSA-N 0 0 396.447 3.192 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000015568237 1399172122 /nfs/dbraw/zinc/17/21/22/1399172122.db2.gz KVSCJEBFRVBHTP-IBGZPJMESA-N 0 0 397.431 3.005 20 5 GGBDRN NC(=O)c1cccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000015566880 1399172228 /nfs/dbraw/zinc/17/22/28/1399172228.db2.gz SYVPCNGLILQYHP-UHFFFAOYSA-N 0 0 399.350 3.443 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000015569039 1399172655 /nfs/dbraw/zinc/17/26/55/1399172655.db2.gz DBTKUTUBYVYZST-UHFFFAOYSA-N 0 0 388.323 3.269 20 5 GGBDRN Cc1cc(C)c(OC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)c([N+](=O)[O-])c1 ZINC000015587417 1399174840 /nfs/dbraw/zinc/17/48/40/1399174840.db2.gz DYFZGAUACIFREJ-UHFFFAOYSA-N 0 0 397.362 3.424 20 5 GGBDRN COc1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])cc(OC)c1OC ZINC000015598859 1399176070 /nfs/dbraw/zinc/17/60/70/1399176070.db2.gz RLSFNKMHRHMZOU-UHFFFAOYSA-N 0 0 378.406 3.351 20 5 GGBDRN Cc1nn(CC(=O)N2CCC(c3nc4ccccc4s3)CC2)c(C)c1[N+](=O)[O-] ZINC000015620086 1399178126 /nfs/dbraw/zinc/17/81/26/1399178126.db2.gz ZFQLYXBWOKXYES-UHFFFAOYSA-N 0 0 399.476 3.424 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNC(=O)CSc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000015620887 1399178953 /nfs/dbraw/zinc/17/89/53/1399178953.db2.gz HFOZNFVJRGHQEX-UHFFFAOYSA-N 0 0 387.461 3.367 20 5 GGBDRN CCOc1cc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c([N+](=O)[O-])cc1OC ZINC000015633093 1399179322 /nfs/dbraw/zinc/17/93/22/1399179322.db2.gz LMGTWBHTLDPLJO-UHFFFAOYSA-N 0 0 379.300 3.302 20 5 GGBDRN Cc1ccc(NC(=O)CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c(Cl)c1 ZINC000015632657 1399179368 /nfs/dbraw/zinc/17/93/68/1399179368.db2.gz XVVYHTDSYOEOLL-UHFFFAOYSA-N 0 0 397.840 3.011 20 5 GGBDRN CCOC(=O)c1ccc(NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])cc1 ZINC000015632607 1399179486 /nfs/dbraw/zinc/17/94/86/1399179486.db2.gz UGODMCYGYMARDH-UHFFFAOYSA-N 0 0 388.376 3.431 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCCc1ccccc1 ZINC000015644055 1399180622 /nfs/dbraw/zinc/18/06/22/1399180622.db2.gz MLKJXGDRCDZDBV-GFCCVEGCSA-N 0 0 376.796 3.152 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])o1 ZINC000015642650 1399180645 /nfs/dbraw/zinc/18/06/45/1399180645.db2.gz BPMARGWVVPRUBC-VIFPVBQESA-N 0 0 382.756 3.342 20 5 GGBDRN C[C@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1OC(F)F ZINC000015644498 1399180656 /nfs/dbraw/zinc/18/06/56/1399180656.db2.gz VQQQCRVWSLUODK-JTQLQIEISA-N 0 0 380.303 3.380 20 5 GGBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1cccc(Br)c1 ZINC000015642509 1399180800 /nfs/dbraw/zinc/18/08/00/1399180800.db2.gz YGDORSLXEUERHH-QMMMGPOBSA-N 0 0 383.154 3.134 20 5 GGBDRN CCNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000015648802 1399181429 /nfs/dbraw/zinc/18/14/29/1399181429.db2.gz UTIVIXHZEBOPTR-NSHDSACASA-N 0 0 375.356 3.350 20 5 GGBDRN CN(Cc1ccccc1Cl)C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000015649993 1399181725 /nfs/dbraw/zinc/18/17/25/1399181725.db2.gz PUAKADYUPSOVNL-UHFFFAOYSA-N 0 0 389.839 3.357 20 5 GGBDRN CCNc1ccc(C(=O)O[C@H](C)C(=O)NCc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000015648943 1399181879 /nfs/dbraw/zinc/18/18/79/1399181879.db2.gz WKJKNNUOBGCIOJ-CQSZACIVSA-N 0 0 385.420 3.197 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)[C@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000015649391 1399182021 /nfs/dbraw/zinc/18/20/21/1399182021.db2.gz RNISOAYVIMXGQE-JTQLQIEISA-N 0 0 377.784 3.323 20 5 GGBDRN CCC[C@H](C)NC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000015652547 1399182493 /nfs/dbraw/zinc/18/24/93/1399182493.db2.gz QMNVILPGKDIZHG-ZDUSSCGKSA-N 0 0 392.433 3.281 20 5 GGBDRN C[C@@H](OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)ccc1F ZINC000015655103 1399182504 /nfs/dbraw/zinc/18/25/04/1399182504.db2.gz MESUMCXFIMRQNO-VCFDLTMXSA-N 0 0 376.315 3.457 20 5 GGBDRN CC(=O)c1ccccc1NC(=O)[C@H](C)OC(=O)C=Cc1ccc([N+](=O)[O-])cc1 ZINC000015655200 1399182915 /nfs/dbraw/zinc/18/29/15/1399182915.db2.gz FQHWGCWCIJPFQB-TZIYXEQSSA-N 0 0 382.372 3.381 20 5 GGBDRN Cc1cc(Cl)ccc1OC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000015655249 1399183179 /nfs/dbraw/zinc/18/31/79/1399183179.db2.gz ZNEDZAXQHMKTBS-UHFFFAOYSA-N 0 0 380.809 3.353 20 5 GGBDRN C[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)N1CCCCCC1 ZINC000015683346 1399183661 /nfs/dbraw/zinc/18/36/61/1399183661.db2.gz LGRJHMZGFRVBQO-HNNXBMFYSA-N 0 0 389.452 3.143 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)N1CCCCCC1 ZINC000015683345 1399183672 /nfs/dbraw/zinc/18/36/72/1399183672.db2.gz LGRJHMZGFRVBQO-OAHLLOKOSA-N 0 0 389.452 3.143 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)N(C)C ZINC000015690641 1399184752 /nfs/dbraw/zinc/18/47/52/1399184752.db2.gz VYGKCGRUCLMDHI-QGZVFWFLSA-N 0 0 389.477 3.115 20 5 GGBDRN C[C@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000015694496 1399184803 /nfs/dbraw/zinc/18/48/03/1399184803.db2.gz AAWGLOFTDHEGRY-NSHDSACASA-N 0 0 395.337 3.221 20 5 GGBDRN Cc1cc(C(=O)O[C@@H](C)C(=O)NCc2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000015699010 1399185316 /nfs/dbraw/zinc/18/53/16/1399185316.db2.gz DRXHCORIERXLHO-LBPRGKRZSA-N 0 0 376.796 3.418 20 5 GGBDRN Cc1cc(C(=O)O[C@H](C)C(=O)NCc2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000015699008 1399185542 /nfs/dbraw/zinc/18/55/42/1399185542.db2.gz DRXHCORIERXLHO-GFCCVEGCSA-N 0 0 376.796 3.418 20 5 GGBDRN Cc1cc(C(=O)OCC(=O)Nc2ccc(N3CCCC3)cc2)ccc1[N+](=O)[O-] ZINC000015698885 1399185612 /nfs/dbraw/zinc/18/56/12/1399185612.db2.gz JAZTXJUJFJTTHF-UHFFFAOYSA-N 0 0 383.404 3.299 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1OC ZINC000015700626 1399186184 /nfs/dbraw/zinc/18/61/84/1399186184.db2.gz LHUWACYEDSUCIK-UHFFFAOYSA-N 0 0 385.420 3.142 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCc1ccc(F)cc1 ZINC000015710071 1399188102 /nfs/dbraw/zinc/18/81/02/1399188102.db2.gz GXOLWGPZHICOIG-SNVBAGLBSA-N 0 0 380.759 3.249 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)OC(=O)/C=C/c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000015718433 1399189162 /nfs/dbraw/zinc/18/91/62/1399189162.db2.gz BMSZKYLYDPBJLH-UVMWJGKXSA-N 0 0 388.351 3.326 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1S(=O)(=O)N(C)C ZINC000015736536 1399189534 /nfs/dbraw/zinc/18/95/34/1399189534.db2.gz FBABPYJOSSKCDB-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000015741863 1399190255 /nfs/dbraw/zinc/19/02/55/1399190255.db2.gz PFNAAOGMHKVHOP-HNNXBMFYSA-N 0 0 376.434 3.188 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000015744303 1399190736 /nfs/dbraw/zinc/19/07/36/1399190736.db2.gz TYBXNBZTSNGFBU-ZDUSSCGKSA-N 0 0 397.460 3.408 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000015798207 1399192335 /nfs/dbraw/zinc/19/23/35/1399192335.db2.gz VFZDMHMZIRJPLO-SNVBAGLBSA-N 0 0 378.768 3.441 20 5 GGBDRN CCOc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000015801543 1399192702 /nfs/dbraw/zinc/19/27/02/1399192702.db2.gz QOXADHQIQHHATR-LBPRGKRZSA-N 0 0 388.376 3.186 20 5 GGBDRN COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000015801524 1399192756 /nfs/dbraw/zinc/19/27/56/1399192756.db2.gz PTMTVOANJPQZQX-JTQLQIEISA-N 0 0 378.768 3.441 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2C)cc1OC ZINC000015800727 1399192789 /nfs/dbraw/zinc/19/27/89/1399192789.db2.gz QBHHXCYGZIDGJS-GFCCVEGCSA-N 0 0 388.376 3.104 20 5 GGBDRN CCOc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000015801542 1399192856 /nfs/dbraw/zinc/19/28/56/1399192856.db2.gz QOXADHQIQHHATR-GFCCVEGCSA-N 0 0 388.376 3.186 20 5 GGBDRN COc1ccccc1CNC(=O)[C@@H](C)OC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000015798262 1399192872 /nfs/dbraw/zinc/19/28/72/1399192872.db2.gz NOESVCNZBJFYLZ-LLVKDONJSA-N 0 0 392.795 3.119 20 5 GGBDRN Cc1c(C(=O)OCC(=O)c2cccc(N3CCCC3=O)c2)cccc1[N+](=O)[O-] ZINC000015800635 1399192886 /nfs/dbraw/zinc/19/28/86/1399192886.db2.gz VZOWQGFSQAWVHD-UHFFFAOYSA-N 0 0 382.372 3.070 20 5 GGBDRN Cc1ccc(CNC(=O)[C@H](C)OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000015798281 1399192908 /nfs/dbraw/zinc/19/29/08/1399192908.db2.gz SNRZBKFYSKGOAV-LBPRGKRZSA-N 0 0 376.796 3.418 20 5 GGBDRN COc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(C)c(F)c2)cc1[N+](=O)[O-] ZINC000015801600 1399193466 /nfs/dbraw/zinc/19/34/66/1399193466.db2.gz WSCXRFNEJPYEDA-LLVKDONJSA-N 0 0 376.340 3.235 20 5 GGBDRN CSCc1nc2ccccc2n1CC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000015824287 1399196444 /nfs/dbraw/zinc/19/64/44/1399196444.db2.gz 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O=C(COC(=O)Cc1cccc(C(F)(F)F)c1)Nc1ccccc1[N+](=O)[O-] ZINC000020751640 1399353195 /nfs/dbraw/zinc/35/31/95/1399353195.db2.gz RHFFRHXIWKKTRS-UHFFFAOYSA-N 0 0 382.294 3.338 20 5 GGBDRN COc1ccccc1[C@@H](C)NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000020822474 1399354510 /nfs/dbraw/zinc/35/45/10/1399354510.db2.gz UWEUKHYQZRLCBO-LLVKDONJSA-N 0 0 392.795 3.291 20 5 GGBDRN COC(=O)c1cc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)oc1C ZINC000020884839 1399355723 /nfs/dbraw/zinc/35/57/23/1399355723.db2.gz NVDJOBOQQACXOI-UHFFFAOYSA-N 0 0 388.376 3.240 20 5 GGBDRN C[C@@H](CC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000055606350 1407022688 /nfs/dbraw/zinc/02/26/88/1407022688.db2.gz VCUFAWALBLKFIS-INIZCTEOSA-N 0 0 381.432 3.073 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)N1CCCCC1 ZINC000020935907 1399358380 /nfs/dbraw/zinc/35/83/80/1399358380.db2.gz KXFINDSATINSRH-SFHVURJKSA-N 0 0 386.452 3.211 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)OC(=O)c2cc(C)sc2C)c([N+](=O)[O-])c1 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CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)n2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000021549783 1399388578 /nfs/dbraw/zinc/38/85/78/1399388578.db2.gz DDNPNFLSYMRMDK-CQSZACIVSA-N 0 0 387.440 3.090 20 5 GGBDRN Cc1cc(OCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)ccc1[N+](=O)[O-] ZINC000021588340 1399392343 /nfs/dbraw/zinc/39/23/43/1399392343.db2.gz KOVITKAMEDWOQK-UHFFFAOYSA-N 0 0 387.436 3.077 20 5 GGBDRN CCNC(=O)COC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000021606086 1399394157 /nfs/dbraw/zinc/39/41/57/1399394157.db2.gz JLAXTSVYPDSIQI-UHFFFAOYSA-N 0 0 391.811 3.153 20 5 GGBDRN C[C@H](Sc1nc2sccc2c(=O)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000021683919 1399400474 /nfs/dbraw/zinc/40/04/74/1399400474.db2.gz AJTTWQKVRUANRY-VIFPVBQESA-N 0 0 390.446 3.023 20 5 GGBDRN CCc1ccc(OCC(=O)O[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC000021680339 1399400628 /nfs/dbraw/zinc/40/06/28/1399400628.db2.gz RDTQNQQKIGYPDG-GFCCVEGCSA-N 0 0 390.367 3.246 20 5 GGBDRN C[C@H](OC(=O)CCOc1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000021680002 1399400635 /nfs/dbraw/zinc/40/06/35/1399400635.db2.gz XXVWPQKTNATOPS-LBPRGKRZSA-N 0 0 376.340 3.073 20 5 GGBDRN COc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc(OC)c1C ZINC000021688083 1399400651 /nfs/dbraw/zinc/40/06/51/1399400651.db2.gz OFZKTVOBUMXMHZ-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN COc1ccccc1CCC(=O)O[C@H](C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000021688763 1399401140 /nfs/dbraw/zinc/40/11/40/1399401140.db2.gz SLOVZADRGGTTBT-GFCCVEGCSA-N 0 0 390.367 3.246 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC1(c2ccccc2)CCCC1 ZINC000021691109 1399401188 /nfs/dbraw/zinc/40/11/88/1399401188.db2.gz SRYOSUQYYONFLZ-UHFFFAOYSA-N 0 0 381.432 3.470 20 5 GGBDRN COc1ccc(CN(C)C(=O)COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000021735380 1399404887 /nfs/dbraw/zinc/40/48/87/1399404887.db2.gz STEYGLIZQRBCFT-UHFFFAOYSA-N 0 0 392.795 3.072 20 5 GGBDRN CCOC(=O)CS[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000021735152 1399404904 /nfs/dbraw/zinc/40/49/04/1399404904.db2.gz OKDYQQABATULRJ-SNVBAGLBSA-N 0 0 395.462 3.342 20 5 GGBDRN C[C@H](Sc1nc2sccc2c(=O)n1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000021742651 1399405485 /nfs/dbraw/zinc/40/54/85/1399405485.db2.gz GLZHSWSLSZKTBH-VIFPVBQESA-N 0 0 390.446 3.023 20 5 GGBDRN C[C@@H](Sc1nc2sccc2c(=O)n1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000021742650 1399405570 /nfs/dbraw/zinc/40/55/70/1399405570.db2.gz GLZHSWSLSZKTBH-SECBINFHSA-N 0 0 390.446 3.023 20 5 GGBDRN C[C@H](Sc1ncn(-c2ccccc2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000021756351 1399406700 /nfs/dbraw/zinc/40/67/00/1399406700.db2.gz TXCIUFLVYDZQCV-NSHDSACASA-N 0 0 387.396 3.434 20 5 GGBDRN CC(C)Oc1ccc(C(=O)OCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000021762724 1399407044 /nfs/dbraw/zinc/40/70/44/1399407044.db2.gz OMXKFTBEUMIXDO-UHFFFAOYSA-N 0 0 384.388 3.128 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1N)c1ccc(Cl)cc1 ZINC000021765320 1399407778 /nfs/dbraw/zinc/40/77/78/1399407778.db2.gz JITFEGYSUJMXPB-MNOVXSKESA-N 0 0 391.811 3.253 20 5 GGBDRN CSc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2N)c1 ZINC000021765163 1399407863 /nfs/dbraw/zinc/40/78/63/1399407863.db2.gz CIRCKLNAHKCJIG-SNVBAGLBSA-N 0 0 375.406 3.083 20 5 GGBDRN COC(=O)c1cc(C(=O)OCC(=O)c2ccc(SC)cc2)cc([N+](=O)[O-])c1 ZINC000021783541 1399409054 /nfs/dbraw/zinc/40/90/54/1399409054.db2.gz IDOASLFVVARJCK-UHFFFAOYSA-N 0 0 389.385 3.143 20 5 GGBDRN Cc1cccc(OCCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000021786014 1399409403 /nfs/dbraw/zinc/40/94/03/1399409403.db2.gz AODBWYITDSOHAS-UHFFFAOYSA-N 0 0 383.448 3.315 20 5 GGBDRN COc1cc(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc(OC)c1OC ZINC000021819109 1399410655 /nfs/dbraw/zinc/41/06/55/1399410655.db2.gz HXCYCKMNAGTJPA-NSHDSACASA-N 0 0 375.381 3.060 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)Oc1ccc(Br)cc1F ZINC000021821422 1399411559 /nfs/dbraw/zinc/41/15/59/1399411559.db2.gz YIHICQLSFOXMDP-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN CCCOc1cc(C)ccc1NC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 ZINC000055620024 1407027252 /nfs/dbraw/zinc/02/72/52/1407027252.db2.gz FKHSBNSVNIJNGY-UHFFFAOYSA-N 0 0 399.403 3.056 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc(OC)cc1 ZINC000021837059 1399413301 /nfs/dbraw/zinc/41/33/01/1399413301.db2.gz NXDQZXGCYXUMPQ-IBGZPJMESA-N 0 0 399.447 3.321 20 5 GGBDRN Cc1ccc(F)c(NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c1 ZINC000021890576 1399419632 /nfs/dbraw/zinc/41/96/32/1399419632.db2.gz ILLVUQYXYRIZCV-UHFFFAOYSA-N 0 0 382.351 3.149 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCCc3ccccc32)nn1-c1ccccc1[N+](=O)[O-] ZINC000021887199 1399419704 /nfs/dbraw/zinc/41/97/04/1399419704.db2.gz MDHOPOVGSACFDT-UHFFFAOYSA-N 0 0 390.399 3.042 20 5 GGBDRN CSc1ccccc1NC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000021889578 1399419816 /nfs/dbraw/zinc/41/98/16/1399419816.db2.gz FNANNIIXVZKQSR-UHFFFAOYSA-N 0 0 396.428 3.423 20 5 GGBDRN Cc1cccc(CN2CCN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)CC2)c1 ZINC000021926434 1399424490 /nfs/dbraw/zinc/42/44/90/1399424490.db2.gz JDHOKYGDCFPPGE-UHFFFAOYSA-N 0 0 394.475 3.436 20 5 GGBDRN CN(Cc1ccsc1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000021935797 1399425199 /nfs/dbraw/zinc/42/51/99/1399425199.db2.gz UURZCNYGCCSSJA-UHFFFAOYSA-N 0 0 375.406 3.003 20 5 GGBDRN COC(=O)c1cc(C(=O)O[C@H](C)C(=O)c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000021976601 1399428361 /nfs/dbraw/zinc/42/83/61/1399428361.db2.gz CDMPJZJEJQQOII-SNVBAGLBSA-N 0 0 391.763 3.463 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)c2ccc3nccnc3c2)cccc1[N+](=O)[O-] ZINC000021978039 1399429076 /nfs/dbraw/zinc/42/90/76/1399429076.db2.gz WNLMLVGAMGPZJE-LBPRGKRZSA-N 0 0 380.360 3.030 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)CSc1ccc(F)cc1 ZINC000021993212 1399429392 /nfs/dbraw/zinc/42/93/92/1399429392.db2.gz CRNNLWPYKRYGOV-UHFFFAOYSA-N 0 0 378.381 3.316 20 5 GGBDRN CCOc1cc(C(=O)O[C@H](C)C(=O)N(C(C)C)C(C)C)c([N+](=O)[O-])cc1OC ZINC000022006412 1399430889 /nfs/dbraw/zinc/43/08/89/1399430889.db2.gz IOXXMPOQIUMWEG-CYBMUJFWSA-N 0 0 396.440 3.193 20 5 GGBDRN O=C(COC(=O)CSc1ccc(F)cc1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000022014954 1399431617 /nfs/dbraw/zinc/43/16/17/1399431617.db2.gz WZADBAAMARFBHF-UHFFFAOYSA-N 0 0 382.344 3.147 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1c2c(nn1-c1ccccc1)CCC2 ZINC000022087897 1399435738 /nfs/dbraw/zinc/43/57/38/1399435738.db2.gz GXTIAJRPNKFIHS-UHFFFAOYSA-N 0 0 378.388 3.287 20 5 GGBDRN CSc1cccc(NC(=O)[C@@H](C)OC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000022094668 1399436138 /nfs/dbraw/zinc/43/61/38/1399436138.db2.gz BBAXMWIJKZQWRM-GFCCVEGCSA-N 0 0 390.417 3.266 20 5 GGBDRN C[C@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2ncccc21 ZINC000022096055 1399436269 /nfs/dbraw/zinc/43/62/69/1399436269.db2.gz XQLMUGVCKPHSSG-ZDUSSCGKSA-N 0 0 395.371 3.092 20 5 GGBDRN Cc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000022095404 1399436392 /nfs/dbraw/zinc/43/63/92/1399436392.db2.gz RCMXKOYXGDVWNT-GJZGRUSLSA-N 0 0 386.404 3.091 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(NC2CC2)s1 ZINC000022172993 1399441732 /nfs/dbraw/zinc/44/17/32/1399441732.db2.gz IOIBRELTBKMEKX-QMMMGPOBSA-N 0 0 395.466 3.149 20 5 GGBDRN CCCCCNC(=O)[C@H](C)OC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000022184130 1399442479 /nfs/dbraw/zinc/44/24/79/1399442479.db2.gz JYMLQXDYSCQDJK-JTQLQIEISA-N 0 0 387.230 3.209 20 5 GGBDRN CCOc1ccc(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1OCC ZINC000022202994 1399444595 /nfs/dbraw/zinc/44/45/95/1399444595.db2.gz ZHCHEWYIRWLAFT-UHFFFAOYSA-N 0 0 392.433 3.144 20 5 GGBDRN CC(C)N(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000022197245 1399444734 /nfs/dbraw/zinc/44/47/34/1399444734.db2.gz MAQIWEHVFKWATF-UHFFFAOYSA-N 0 0 383.448 3.482 20 5 GGBDRN COC(=O)c1ccc(OCC(=O)Nc2cccc(SC)c2)c([N+](=O)[O-])c1 ZINC000022222877 1399445925 /nfs/dbraw/zinc/44/59/25/1399445925.db2.gz CRXHKSYSJVVUPM-UHFFFAOYSA-N 0 0 376.390 3.121 20 5 GGBDRN CNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc3ncccc32)cc1[N+](=O)[O-] ZINC000022273449 1399449519 /nfs/dbraw/zinc/44/95/19/1399449519.db2.gz QIQZLCFIKVLKCX-LBPRGKRZSA-N 0 0 394.387 3.369 20 5 GGBDRN COc1ccc(C(=O)Nc2nc(CN3CCCCC3)cs2)cc1[N+](=O)[O-] ZINC000022289469 1399450898 /nfs/dbraw/zinc/45/08/98/1399450898.db2.gz BBXBSWJUDDKVQA-UHFFFAOYSA-N 0 0 376.438 3.298 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)Nc3ccnn3C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000022290046 1399451071 /nfs/dbraw/zinc/45/10/71/1399451071.db2.gz ICNHRFZLCOWRRN-UHFFFAOYSA-N 0 0 382.424 3.486 20 5 GGBDRN NC(=O)c1ccc(N2CCCC2)c(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000022329022 1399455113 /nfs/dbraw/zinc/45/51/13/1399455113.db2.gz FCQHNDQTXMKUQE-UHFFFAOYSA-N 0 0 388.811 3.200 20 5 GGBDRN Cc1cc(C)c(OC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)c([N+](=O)[O-])c1 ZINC000022388538 1399460194 /nfs/dbraw/zinc/46/01/94/1399460194.db2.gz HCQXSBGUHSCIGT-UHFFFAOYSA-N 0 0 385.344 3.427 20 5 GGBDRN COC(=O)c1ccoc1COC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000022417739 1399462198 /nfs/dbraw/zinc/46/21/98/1399462198.db2.gz OQJYEOJJTURBIQ-UHFFFAOYSA-N 0 0 391.379 3.278 20 5 GGBDRN O=C(COC(=O)c1ccccc1[N+](=O)[O-])NCC1(c2ccccc2)CCCC1 ZINC000022443448 1399464308 /nfs/dbraw/zinc/46/43/08/1399464308.db2.gz LCMAFBAMLIYGIA-UHFFFAOYSA-N 0 0 382.416 3.380 20 5 GGBDRN Cc1cc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])o2)ccc1Br ZINC000022445933 1399464759 /nfs/dbraw/zinc/46/47/59/1399464759.db2.gz RRDIZDRUPRCBCX-SECBINFHSA-N 0 0 397.181 3.443 20 5 GGBDRN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])o1 ZINC000022445438 1399464779 /nfs/dbraw/zinc/46/47/79/1399464779.db2.gz ARHHHQPRKRYLAZ-SNVBAGLBSA-N 0 0 386.316 3.321 20 5 GGBDRN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])o1 ZINC000022445443 1399465021 /nfs/dbraw/zinc/46/50/21/1399465021.db2.gz ARHHHQPRKRYLAZ-JTQLQIEISA-N 0 0 386.316 3.321 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1[N+](=O)[O-] ZINC000055631641 1407030662 /nfs/dbraw/zinc/03/06/62/1407030662.db2.gz KDBULPVJOMGQCE-INIZCTEOSA-N 0 0 392.433 3.262 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000055631650 1407030811 /nfs/dbraw/zinc/03/08/11/1407030811.db2.gz CDNULIOFZFANSR-QGZVFWFLSA-N 0 0 392.433 3.262 20 5 GGBDRN C[C@@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000022471854 1399466827 /nfs/dbraw/zinc/46/68/27/1399466827.db2.gz HUWIJQJVYAPJPD-GFCCVEGCSA-N 0 0 399.428 3.408 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000022476814 1399467348 /nfs/dbraw/zinc/46/73/48/1399467348.db2.gz NZFMGRQEAWWXIB-OAHLLOKOSA-N 0 0 394.435 3.197 20 5 GGBDRN Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)COc1ccccc1[N+](=O)[O-] ZINC000022478105 1399467365 /nfs/dbraw/zinc/46/73/65/1399467365.db2.gz NJYUQIBQQWOJOF-LSDHHAIUSA-N 0 0 386.404 3.091 20 5 GGBDRN C[C@H](OC(=O)COc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2ncccc21 ZINC000022478266 1399467997 /nfs/dbraw/zinc/46/79/97/1399467997.db2.gz BQGWTWGNPNJOMQ-ZDUSSCGKSA-N 0 0 395.371 3.092 20 5 GGBDRN CCNc1ccc(C(=O)OCC(=O)N[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000022486378 1399468744 /nfs/dbraw/zinc/46/87/44/1399468744.db2.gz ZDABQPAEMSVJDA-FQEVSTJZSA-N 0 0 397.431 3.451 20 5 GGBDRN CSc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000022488432 1399468885 /nfs/dbraw/zinc/46/88/85/1399468885.db2.gz UDWNDPJIYRVGGD-JTQLQIEISA-N 0 0 375.406 3.083 20 5 GGBDRN C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N1CCC[C@H]1c1cccs1 ZINC000022489095 1399469421 /nfs/dbraw/zinc/46/94/21/1399469421.db2.gz BTHOOIGBUSXCIP-FZMZJTMJSA-N 0 0 389.433 3.148 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2CC[C@H]1C ZINC000022489121 1399469485 /nfs/dbraw/zinc/46/94/85/1399469485.db2.gz KKVQADRTWZJSIJ-CHWSQXEVSA-N 0 0 383.404 3.090 20 5 GGBDRN C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)NCc1ccccc1F ZINC000022496136 1399470155 /nfs/dbraw/zinc/47/01/55/1399470155.db2.gz OLIMOAGSGBUDJV-JTQLQIEISA-N 0 0 380.759 3.249 20 5 GGBDRN O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)NCC1(c2ccccc2)CCCC1 ZINC000022500479 1399470652 /nfs/dbraw/zinc/47/06/52/1399470652.db2.gz DGBKWHUUFLKTAW-UHFFFAOYSA-N 0 0 382.416 3.380 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000022502172 1399470792 /nfs/dbraw/zinc/47/07/92/1399470792.db2.gz FBDXUTHWMQXCCC-SECBINFHSA-N 0 0 394.286 3.100 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 ZINC000055632372 1407031625 /nfs/dbraw/zinc/03/16/25/1407031625.db2.gz HFGFNQFUADOEKK-UHFFFAOYSA-N 0 0 391.449 3.232 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559462 1399477408 /nfs/dbraw/zinc/47/74/08/1399477408.db2.gz BSDPMUYQJHRLHQ-KGLIPLIRSA-N 0 0 377.441 3.045 20 5 GGBDRN CCc1ccccc1NC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1 ZINC000022572188 1399478591 /nfs/dbraw/zinc/47/85/91/1399478591.db2.gz KVCMABFADSLARA-UHFFFAOYSA-N 0 0 396.447 3.078 20 5 GGBDRN CC(=O)Nc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000022570521 1399478597 /nfs/dbraw/zinc/47/85/97/1399478597.db2.gz OREPLQBOFPXWCZ-LBPRGKRZSA-N 0 0 385.376 3.046 20 5 GGBDRN COc1cccc(CN(C)C(=O)COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000022569447 1399478609 /nfs/dbraw/zinc/47/86/09/1399478609.db2.gz BBPHSWKHIMIGMN-UHFFFAOYSA-N 0 0 392.795 3.072 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)Cc2c[nH]c3ccccc23)cccc1[N+](=O)[O-] ZINC000022580127 1399479850 /nfs/dbraw/zinc/47/98/50/1399479850.db2.gz AZOIKGJYNSMLRB-ZDUSSCGKSA-N 0 0 381.388 3.497 20 5 GGBDRN CN(Cc1c(F)cccc1Cl)C(=O)COC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000022615592 1399482873 /nfs/dbraw/zinc/48/28/73/1399482873.db2.gz MLEVQZKLSPGAOM-UHFFFAOYSA-N 0 0 394.786 3.132 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)CSCc1ccc(F)cc1 ZINC000022621726 1399483387 /nfs/dbraw/zinc/48/33/87/1399483387.db2.gz HTUAKITUNWDTAS-UHFFFAOYSA-N 0 0 392.408 3.457 20 5 GGBDRN Cc1noc(C)c1CSCC(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000022670049 1399488813 /nfs/dbraw/zinc/48/88/13/1399488813.db2.gz JNKWFMSGMMXCDA-LBPRGKRZSA-N 0 0 393.421 3.003 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000022668589 1399489077 /nfs/dbraw/zinc/48/90/77/1399489077.db2.gz XJEIGOMXIJWNDX-LBPRGKRZSA-N 0 0 376.796 3.418 20 5 GGBDRN Cc1noc(C)c1CSCC(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000022670045 1399489110 /nfs/dbraw/zinc/48/91/10/1399489110.db2.gz JNKWFMSGMMXCDA-GFCCVEGCSA-N 0 0 393.421 3.003 20 5 GGBDRN COc1cccc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1OC ZINC000022677699 1399489775 /nfs/dbraw/zinc/48/97/75/1399489775.db2.gz XVMVRGXYPDHAFK-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN COc1cccc(OC)c1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000022680818 1399490393 /nfs/dbraw/zinc/49/03/93/1399490393.db2.gz RZPIHJDZWJASRE-LBPRGKRZSA-N 0 0 388.376 3.104 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccccc1C(=O)NCC(C)C ZINC000022690981 1399492527 /nfs/dbraw/zinc/49/25/27/1399492527.db2.gz GBSYPZOKUFBODC-UHFFFAOYSA-N 0 0 384.436 3.340 20 5 GGBDRN CC[NH+](CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)c1cccc(OC)c1 ZINC000022700950 1399493209 /nfs/dbraw/zinc/49/32/09/1399493209.db2.gz KHRNLGNTXVCFRN-GOSISDBHSA-N 0 0 387.436 3.122 20 5 GGBDRN O=C(COC(=O)CSCc1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000022719870 1399495629 /nfs/dbraw/zinc/49/56/29/1399495629.db2.gz PUQBILGARIGMQH-UHFFFAOYSA-N 0 0 378.381 3.149 20 5 GGBDRN Cc1cc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)ccc1[N+](=O)[O-] ZINC000022736635 1399496953 /nfs/dbraw/zinc/49/69/53/1399496953.db2.gz YTVCEIUMNVIPGW-CQSZACIVSA-N 0 0 395.415 3.289 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000022736474 1399496961 /nfs/dbraw/zinc/49/69/61/1399496961.db2.gz HJKQOSMTHIIQCC-LBPRGKRZSA-N 0 0 385.376 3.046 20 5 GGBDRN COc1ccc([C@H](NC(=O)COC(=O)c2ccc([N+](=O)[O-])c(C)c2)C2CC2)cc1 ZINC000022736359 1399496980 /nfs/dbraw/zinc/49/69/80/1399496980.db2.gz LKMZSHKLHQOUDW-HXUWFJFHSA-N 0 0 398.415 3.336 20 5 GGBDRN COc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000022736528 1399496990 /nfs/dbraw/zinc/49/69/90/1399496990.db2.gz IQWHGBLPOCOYHO-KBPBESRZSA-N 0 0 386.404 3.335 20 5 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ZINC000055760526 1407076747 /nfs/dbraw/zinc/07/67/47/1407076747.db2.gz GTWCDRLZWHSECG-UHFFFAOYSA-N 0 0 384.432 3.147 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCN(c3cccc(C)c3)CC2)c([N+](=O)[O-])c1 ZINC000027381905 1400029021 /nfs/dbraw/zinc/02/90/21/1400029021.db2.gz ZERISWMRZDRCJI-UHFFFAOYSA-N 0 0 398.463 3.063 20 5 GGBDRN CCOCC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000027387063 1400030174 /nfs/dbraw/zinc/03/01/74/1400030174.db2.gz UFKBSRUKGPYWFC-UHFFFAOYSA-N 0 0 378.768 3.442 20 5 GGBDRN Cc1c(C(=O)Nc2ccccc2C(=O)NCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000027403240 1400034852 /nfs/dbraw/zinc/03/48/52/1400034852.db2.gz BTCHIDBVUZIBIE-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)Cc2noc3ccccc23)cccc1[N+](=O)[O-] ZINC000027411298 1400035183 /nfs/dbraw/zinc/03/51/83/1400035183.db2.gz DJZNLJTYYLZUGT-LBPRGKRZSA-N 0 0 383.360 3.157 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000027415931 1400035952 /nfs/dbraw/zinc/03/59/52/1400035952.db2.gz 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Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)Cc1cnn(-c2ccccc2)c1 ZINC000027550814 1400054267 /nfs/dbraw/zinc/05/42/67/1400054267.db2.gz QCKNFLSPXFADFD-UHFFFAOYSA-N 0 0 379.420 3.159 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000027569492 1400057969 /nfs/dbraw/zinc/05/79/69/1400057969.db2.gz RGDHBRYCFRRZTI-MRXNPFEDSA-N 0 0 396.447 3.192 20 5 GGBDRN CC(C)[C@H](CNC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000027625404 1400068311 /nfs/dbraw/zinc/06/83/11/1400068311.db2.gz OWKYAERCVYIRAL-KXBFYZLASA-N 0 0 383.448 3.269 20 5 GGBDRN CC(C)[C@H](CNC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000027625391 1400068437 /nfs/dbraw/zinc/06/84/37/1400068437.db2.gz OWKYAERCVYIRAL-BEFAXECRSA-N 0 0 383.448 3.269 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCc1ccc2ccccc2c1 ZINC000027646368 1400071385 /nfs/dbraw/zinc/07/13/85/1400071385.db2.gz KFYSHZPEJJHYHC-HNNXBMFYSA-N 0 0 391.427 3.225 20 5 GGBDRN COc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])c([O-])c2)[NH+]2CCCCC2)cc1 ZINC000027669033 1400073699 /nfs/dbraw/zinc/07/36/99/1400073699.db2.gz DNWZSIQLFKSZRH-LJQANCHMSA-N 0 0 399.447 3.266 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N(C)CCOc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000027681477 1400076294 /nfs/dbraw/zinc/07/62/94/1400076294.db2.gz AQNXOBNHXKKUID-CQSZACIVSA-N 0 0 375.400 3.380 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N(C)CCOc2ccccc2F)cccc1[N+](=O)[O-] ZINC000027698525 1400079304 /nfs/dbraw/zinc/07/93/04/1400079304.db2.gz SQQKBDUJZBKQOL-AWEZNQCLSA-N 0 0 375.400 3.380 20 5 GGBDRN COc1ccc(CSCC(=O)NCCOc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000027720629 1400082649 /nfs/dbraw/zinc/08/26/49/1400082649.db2.gz SALZHOVZYXGDRT-UHFFFAOYSA-N 0 0 394.424 3.171 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000027737860 1400084648 /nfs/dbraw/zinc/08/46/48/1400084648.db2.gz VKMISXCSNMXWLY-UHFFFAOYSA-N 0 0 389.839 3.278 20 5 GGBDRN CCc1ccc(N2C[C@@H](C(=O)OCc3cc([N+](=O)[O-])ccc3OC)CC2=O)cc1 ZINC000027745551 1400085453 /nfs/dbraw/zinc/08/54/53/1400085453.db2.gz OKGPTXPLEVWERE-HNNXBMFYSA-N 0 0 398.415 3.262 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(C(N)=O)cc3)cc2[N+](=O)[O-])C1 ZINC000027748699 1400086240 /nfs/dbraw/zinc/08/62/40/1400086240.db2.gz WFOJYSAVYOFSJI-KBPBESRZSA-N 0 0 396.447 3.428 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C)c1 ZINC000055765215 1407079349 /nfs/dbraw/zinc/07/93/49/1407079349.db2.gz ODCMSKDLIZLJDH-UHFFFAOYSA-N 0 0 393.403 3.091 20 5 GGBDRN CCOC(=O)/C=C/c1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000027810338 1400095607 /nfs/dbraw/zinc/09/56/07/1400095607.db2.gz KBESHNAHBPWLGG-VMPITWQZSA-N 0 0 384.344 3.152 20 5 GGBDRN COc1ccc2cc(CNC(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)ccc2c1 ZINC000027811261 1400095977 /nfs/dbraw/zinc/09/59/77/1400095977.db2.gz DUCUKNMLAXZOOI-UHFFFAOYSA-N 0 0 380.356 3.415 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1OC(F)(F)F ZINC000027823602 1400097223 /nfs/dbraw/zinc/09/72/23/1400097223.db2.gz FBXDKYNKADBQOI-UHFFFAOYSA-N 0 0 397.309 3.252 20 5 GGBDRN O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000027847338 1400099346 /nfs/dbraw/zinc/09/93/46/1400099346.db2.gz UEYSWEUARCCOSW-QGZVFWFLSA-N 0 0 384.392 3.148 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)cc1[N+](=O)[O-] ZINC000027851691 1400100293 /nfs/dbraw/zinc/10/02/93/1400100293.db2.gz ZAUFHBYXSNAKBZ-QGZVFWFLSA-N 0 0 398.419 3.456 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1 ZINC000027936889 1400108019 /nfs/dbraw/zinc/10/80/19/1400108019.db2.gz VSPGOPMEEABUFJ-UHFFFAOYSA-N 0 0 395.868 3.068 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3C)ccc12 ZINC000027944948 1400108674 /nfs/dbraw/zinc/10/86/74/1400108674.db2.gz MQZFZDYNVSUJTI-UHFFFAOYSA-N 0 0 389.385 3.340 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCN(c2ccccc2Cl)CC1 ZINC000027973393 1400113615 /nfs/dbraw/zinc/11/36/15/1400113615.db2.gz HFJSJYPWEVMDEO-UHFFFAOYSA-N 0 0 395.868 3.068 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000027977923 1400114197 /nfs/dbraw/zinc/11/41/97/1400114197.db2.gz QYCMZVQLPFIEEF-GOSISDBHSA-N 0 0 376.434 3.341 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000027998743 1400116432 /nfs/dbraw/zinc/11/64/32/1400116432.db2.gz QNPHJDPVPDDRCC-UHFFFAOYSA-N 0 0 380.404 3.256 20 5 GGBDRN C[C@@H](NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1ccc2c(c1)CCCC2 ZINC000028005650 1400117226 /nfs/dbraw/zinc/11/72/26/1400117226.db2.gz PVINKPQNRCSDMG-CYBMUJFWSA-N 0 0 395.415 3.259 20 5 GGBDRN C[C@H](NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1ccccc1Cl ZINC000028005392 1400117300 /nfs/dbraw/zinc/11/73/00/1400117300.db2.gz NWORIQCZRPONEF-JTQLQIEISA-N 0 0 375.768 3.034 20 5 GGBDRN C[C@@H](NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1ccccc1Cl ZINC000028005388 1400117412 /nfs/dbraw/zinc/11/74/12/1400117412.db2.gz NWORIQCZRPONEF-SNVBAGLBSA-N 0 0 375.768 3.034 20 5 GGBDRN O=C(Nc1ccccc1N1CCCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000028009533 1400118285 /nfs/dbraw/zinc/11/82/85/1400118285.db2.gz FVSAWVCGUSSWCE-UHFFFAOYSA-N 0 0 378.392 3.028 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000028040004 1400120660 /nfs/dbraw/zinc/12/06/60/1400120660.db2.gz LXWLQMIAZWWPLV-SNVBAGLBSA-N 0 0 397.840 3.246 20 5 GGBDRN O=C(NCCOc1cccc2ccccc21)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000055775601 1407081511 /nfs/dbraw/zinc/08/15/11/1407081511.db2.gz TUTFMCPGYBVXKR-UHFFFAOYSA-N 0 0 380.356 3.286 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N(C)Cc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000028037686 1400120815 /nfs/dbraw/zinc/12/08/15/1400120815.db2.gz BJBBMBDMUFYHNX-UHFFFAOYSA-N 0 0 394.840 3.254 20 5 GGBDRN CN(Cc1ccc(OC(F)(F)F)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000028042379 1400121608 /nfs/dbraw/zinc/12/16/08/1400121608.db2.gz BCPKHMNDAHYHNR-UHFFFAOYSA-N 0 0 390.339 3.314 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000028064984 1400124616 /nfs/dbraw/zinc/12/46/16/1400124616.db2.gz SNPPPBZTCDPPLT-INIZCTEOSA-N 0 0 394.387 3.220 20 5 GGBDRN COc1cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c(OC)cc1Cl ZINC000028063364 1400124851 /nfs/dbraw/zinc/12/48/51/1400124851.db2.gz GLDGTTFPRABSMY-UHFFFAOYSA-N 0 0 376.756 3.394 20 5 GGBDRN CCNc1ccc(C(=O)OCc2cc([N+](=O)[O-])ccc2OC)cc1[N+](=O)[O-] ZINC000028136682 1400132524 /nfs/dbraw/zinc/13/25/24/1400132524.db2.gz BKKYDIOFIHBTID-UHFFFAOYSA-N 0 0 375.337 3.300 20 5 GGBDRN CCNc1ccc(C(=O)OCc2nnc(-c3ccc(OC)cc3)o2)cc1[N+](=O)[O-] ZINC000028136966 1400132970 /nfs/dbraw/zinc/13/29/70/1400132970.db2.gz CYYRRSPRPORHEF-UHFFFAOYSA-N 0 0 398.375 3.442 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(N)c([N+](=O)[O-])c2)c(Br)c1 ZINC000028239951 1400142219 /nfs/dbraw/zinc/14/22/19/1400142219.db2.gz BCSIWGKDESXOEB-UHFFFAOYSA-N 0 0 386.227 3.049 20 5 GGBDRN CCCCc1nnc(NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])s1 ZINC000028244160 1400142563 /nfs/dbraw/zinc/14/25/63/1400142563.db2.gz YGZFKVYQXOPVGF-UHFFFAOYSA-N 0 0 380.426 3.449 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N=c2[nH]c3c(s2)C[C@@H](C)CC3)cc1OC ZINC000028249902 1400143050 /nfs/dbraw/zinc/14/30/50/1400143050.db2.gz SHPWZEIYNGGQRQ-JTQLQIEISA-N 0 0 391.449 3.258 20 5 GGBDRN COCC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000028301263 1400147841 /nfs/dbraw/zinc/14/78/41/1400147841.db2.gz QQRBWOZPIIDVQK-MRXNPFEDSA-N 0 0 378.768 3.118 20 5 GGBDRN O=C(NCCCOCCc1ccccc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000055783620 1407083478 /nfs/dbraw/zinc/08/34/78/1407083478.db2.gz KAEIMWMVKYMRAM-UHFFFAOYSA-N 0 0 394.431 3.160 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000028310570 1400149531 /nfs/dbraw/zinc/14/95/31/1400149531.db2.gz VMCRFRLLSDCQTR-IBGZPJMESA-N 0 0 397.431 3.087 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)CC1 ZINC000028317397 1400149827 /nfs/dbraw/zinc/14/98/27/1400149827.db2.gz RIZQNNFDRATKGW-UHFFFAOYSA-N 0 0 395.419 3.253 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000028347771 1400154712 /nfs/dbraw/zinc/15/47/12/1400154712.db2.gz GOIQXTNDUNQSLL-NWDGAFQWSA-N 0 0 390.367 3.165 20 5 GGBDRN Cc1cc([C@@H](C)NC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C)s1 ZINC000028359500 1400155324 /nfs/dbraw/zinc/15/53/24/1400155324.db2.gz YQVRCPAZEJWOTP-CYBMUJFWSA-N 0 0 389.481 3.261 20 5 GGBDRN C[C@H](OC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)N[C@@H](C)c1ccc(Cl)cc1 ZINC000028384720 1400158701 /nfs/dbraw/zinc/15/87/01/1400158701.db2.gz HONBNLROYOBSLZ-QWRGUYRKSA-N 0 0 379.800 3.009 20 5 GGBDRN C[C@H](Nc1cccc(CN2CCCC2=O)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000028386845 1400158895 /nfs/dbraw/zinc/15/88/95/1400158895.db2.gz PFKDUUHNSUXWCI-AWEZNQCLSA-N 0 0 382.420 3.156 20 5 GGBDRN CC(C)(CNC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000028393644 1400159289 /nfs/dbraw/zinc/15/92/89/1400159289.db2.gz GMBYYTIJZCUPMJ-UHFFFAOYSA-N 0 0 382.464 3.404 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000055796865 1407085111 /nfs/dbraw/zinc/08/51/11/1407085111.db2.gz GMDJHWSTFVDWGA-UHFFFAOYSA-N 0 0 383.448 3.329 20 5 GGBDRN Cc1ccc(NC(=O)CS[C@@H](C)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000055797016 1407085133 /nfs/dbraw/zinc/08/51/33/1407085133.db2.gz BFPOXNSLMQDTFM-AWEZNQCLSA-N 0 0 387.461 3.280 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(Cl)cc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000055797475 1407085258 /nfs/dbraw/zinc/08/52/58/1407085258.db2.gz IJDNEMAOARRFEN-UHFFFAOYSA-N 0 0 375.812 3.075 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000028424136 1400164716 /nfs/dbraw/zinc/16/47/16/1400164716.db2.gz FCENXXURCPEEBO-UKRRQHHQSA-N 0 0 384.388 3.089 20 5 GGBDRN COc1ccc([C@H](NC(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])C2CC2)cc1 ZINC000028423409 1400164848 /nfs/dbraw/zinc/16/48/48/1400164848.db2.gz BZLJVOYSOKHGGP-HXUWFJFHSA-N 0 0 398.415 3.336 20 5 GGBDRN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000028424102 1400164952 /nfs/dbraw/zinc/16/49/52/1400164952.db2.gz CKFCDYLFGLDVOY-UONOGXRCSA-N 0 0 386.404 3.335 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000028423882 1400165000 /nfs/dbraw/zinc/16/50/00/1400165000.db2.gz SPVHYOFTSSSQQZ-LBPRGKRZSA-N 0 0 385.376 3.046 20 5 GGBDRN Cc1ccc(-n2cnnc2SCC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000055798162 1407085695 /nfs/dbraw/zinc/08/56/95/1407085695.db2.gz PHOXBYQRVGYXKS-UHFFFAOYSA-N 0 0 397.460 3.201 20 5 GGBDRN CCOc1ccc(-c2noc(CCC(=O)NCc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000055798398 1407085754 /nfs/dbraw/zinc/08/57/54/1407085754.db2.gz YGKFTBPTNFLHMY-UHFFFAOYSA-N 0 0 396.403 3.293 20 5 GGBDRN COc1ccc(CSCC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000055798438 1407085764 /nfs/dbraw/zinc/08/57/64/1407085764.db2.gz CXFQJDOZMPVYDP-UHFFFAOYSA-N 0 0 391.405 3.061 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000028490298 1400170361 /nfs/dbraw/zinc/17/03/61/1400170361.db2.gz FXGCVDUADHDLBB-YHUYYLMFSA-N 0 0 375.469 3.327 20 5 GGBDRN Cc1cc2[nH]c(C(=O)OCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)cc2c(C)c1 ZINC000028499932 1400171570 /nfs/dbraw/zinc/17/15/70/1400171570.db2.gz ZOUOPUBGNPJKLM-UHFFFAOYSA-N 0 0 393.399 3.439 20 5 GGBDRN Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NCc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000055798843 1407085789 /nfs/dbraw/zinc/08/57/89/1407085789.db2.gz ALBMCCQGBKIFSF-SFHVURJKSA-N 0 0 395.459 3.380 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](c1cc2ccccc2o1)c1ccccc1 ZINC000028504798 1400172459 /nfs/dbraw/zinc/17/24/59/1400172459.db2.gz CBMJBJDKLHSYRA-HXUWFJFHSA-N 0 0 376.372 3.443 20 5 GGBDRN COc1ccc(-c2noc(CCCC(=O)NCc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000055798576 1407085943 /nfs/dbraw/zinc/08/59/43/1407085943.db2.gz CBFPXRMFRBEFAC-UHFFFAOYSA-N 0 0 396.403 3.293 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1nn(-c2ccc(F)cc2)c2c1CCC2 ZINC000055798189 1407085976 /nfs/dbraw/zinc/08/59/76/1407085976.db2.gz PMIZDIFIGLGTPF-UHFFFAOYSA-N 0 0 380.379 3.338 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1cccnc1)C1CC1 ZINC000028515542 1400173949 /nfs/dbraw/zinc/17/39/49/1400173949.db2.gz XDHNQMYZDGHRSQ-UHFFFAOYSA-N 0 0 380.448 3.397 20 5 GGBDRN CCn1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nc2ccccc2c1=O ZINC000028606567 1400176500 /nfs/dbraw/zinc/17/65/00/1400176500.db2.gz IJLSOCZQDZMKFR-GFCCVEGCSA-N 0 0 398.444 3.444 20 5 GGBDRN Cc1ccccc1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000028612440 1400176756 /nfs/dbraw/zinc/17/67/56/1400176756.db2.gz LHLOPJRHXFMHAO-UHFFFAOYSA-N 0 0 383.404 3.299 20 5 GGBDRN COc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c(O)c1 ZINC000028611109 1400176814 /nfs/dbraw/zinc/17/68/14/1400176814.db2.gz BANZXBZXBAEGQE-SECBINFHSA-N 0 0 394.767 3.146 20 5 GGBDRN Cc1cc(C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1[N+](=O)[O-] ZINC000028614382 1400177761 /nfs/dbraw/zinc/17/77/61/1400177761.db2.gz UGDQQBHZQWRBJR-UHFFFAOYSA-N 0 0 384.304 3.218 20 5 GGBDRN CCNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2OC)cc1[N+](=O)[O-] ZINC000028631430 1400178965 /nfs/dbraw/zinc/17/89/65/1400178965.db2.gz AUMUCFJRKHEAFR-LBPRGKRZSA-N 0 0 387.392 3.219 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCN(Cc2ccncc2)CC1 ZINC000028693406 1400186780 /nfs/dbraw/zinc/18/67/80/1400186780.db2.gz BYZQVAQYGSKEHS-UHFFFAOYSA-N 0 0 382.445 3.163 20 5 GGBDRN O=C(c1ccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1)N1CCCC1 ZINC000028707590 1400188271 /nfs/dbraw/zinc/18/82/71/1400188271.db2.gz QXKUUOAXQQYKAW-UHFFFAOYSA-N 0 0 394.475 3.153 20 5 GGBDRN O=C(c1ccc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1)N1CCCC1 ZINC000028707849 1400188325 /nfs/dbraw/zinc/18/83/25/1400188325.db2.gz NXYNCUICZOYRSF-UHFFFAOYSA-N 0 0 394.475 3.153 20 5 GGBDRN Cc1nc2ccccc2n1CCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000028743028 1400190994 /nfs/dbraw/zinc/19/09/94/1400190994.db2.gz UAHVHSJDNQUBOF-UHFFFAOYSA-N 0 0 379.420 3.257 20 5 GGBDRN CCC(C)(C)NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775211 1400194501 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ZINC000028953565 1400215690 /nfs/dbraw/zinc/21/56/90/1400215690.db2.gz FEDDQOQBWLEHDC-LLVKDONJSA-N 0 0 376.340 3.235 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000028967663 1400217641 /nfs/dbraw/zinc/21/76/41/1400217641.db2.gz KLOTVWJQWKYTSQ-UHFFFAOYSA-N 0 0 398.463 3.053 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1Sc1nnc(CN2CCCCC2)n1-c1ccccc1 ZINC000029003438 1400223949 /nfs/dbraw/zinc/22/39/49/1400223949.db2.gz KRSGFFFSXZOKPO-UHFFFAOYSA-N 0 0 399.480 3.046 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)OCc1ccccc1OC(F)F ZINC000029035976 1400227262 /nfs/dbraw/zinc/22/72/62/1400227262.db2.gz WSHUWCOQVVWTHY-UHFFFAOYSA-N 0 0 394.330 3.060 20 5 GGBDRN CN(C)[C@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccccc1Cl ZINC000029051842 1400230645 /nfs/dbraw/zinc/23/06/45/1400230645.db2.gz VLEPYOQWBOWXPB-MRXNPFEDSA-N 0 0 387.827 3.157 20 5 GGBDRN O=C(CCCc1nc2ccccc2[nH]1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000029054128 1400231620 /nfs/dbraw/zinc/23/16/20/1400231620.db2.gz 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ZINC000029162574 1400251261 /nfs/dbraw/zinc/25/12/61/1400251261.db2.gz CDSUXFUVHGZGBG-UHFFFAOYSA-N 0 0 381.432 3.064 20 5 GGBDRN Cc1ccc(C2=NN(C(=O)Cn3cnc([N+](=O)[O-])c3)[C@@H](c3ccco3)C2)cc1 ZINC000029211206 1400258996 /nfs/dbraw/zinc/25/89/96/1400258996.db2.gz KEPYEUPFMJUZJP-MRXNPFEDSA-N 0 0 379.376 3.071 20 5 GGBDRN COc1ccc(C)cc1CNC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000029216592 1400259777 /nfs/dbraw/zinc/25/97/77/1400259777.db2.gz GJCHPASYNYPGTH-UHFFFAOYSA-N 0 0 396.346 3.452 20 5 GGBDRN CSc1ccc(C(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000029264262 1400269636 /nfs/dbraw/zinc/26/96/36/1400269636.db2.gz PVPQNJGZEDAMFI-UHFFFAOYSA-N 0 0 385.445 3.220 20 5 GGBDRN Cc1ccc(CNC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000029274578 1400272705 /nfs/dbraw/zinc/27/27/05/1400272705.db2.gz DNOIOMQGVGHDLC-UHFFFAOYSA-N 0 0 380.759 3.169 20 5 GGBDRN CCOCc1ccc(CNC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])cc1 ZINC000029282397 1400274765 /nfs/dbraw/zinc/27/47/65/1400274765.db2.gz 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COc1cccc([C@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000056006929 1407169712 /nfs/dbraw/zinc/16/97/12/1407169712.db2.gz UXXSXAUYXDVQGQ-MRXNPFEDSA-N 0 0 380.397 3.268 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000056006938 1407169925 /nfs/dbraw/zinc/16/99/25/1407169925.db2.gz WEVAHGZOBZURJY-INIZCTEOSA-N 0 0 376.434 3.438 20 5 GGBDRN Cc1cccc([C@H]2CCCN2C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000056001011 1407168365 /nfs/dbraw/zinc/16/83/65/1407168365.db2.gz VYGQIXRBHRECGE-QGZVFWFLSA-N 0 0 377.404 3.461 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(OC(F)F)cc1 ZINC000056030960 1407176028 /nfs/dbraw/zinc/17/60/28/1407176028.db2.gz QRAJCPQJZDSWEG-SECBINFHSA-N 0 0 390.339 3.375 20 5 GGBDRN O=C(Nc1ccc(CCN2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000056039384 1407178504 /nfs/dbraw/zinc/17/85/04/1407178504.db2.gz XIXJCDOOILHZLC-UHFFFAOYSA-N 0 0 389.839 3.375 20 5 GGBDRN CCCCOc1ccc(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1OC ZINC000056058281 1407183640 /nfs/dbraw/zinc/18/36/40/1407183640.db2.gz KIRFCOGNDBXLJH-UHFFFAOYSA-N 0 0 394.449 3.261 20 5 GGBDRN COc1cc(C)c([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)cc1OC ZINC000056058603 1407184485 /nfs/dbraw/zinc/18/44/85/1407184485.db2.gz NXQTVTLIBLYJOT-CYBMUJFWSA-N 0 0 394.449 3.268 20 5 GGBDRN COc1cc(C)c([C@H](C)NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000056058692 1407185022 /nfs/dbraw/zinc/18/50/22/1407185022.db2.gz SIHLGSRZRAXBOW-ZDUSSCGKSA-N 0 0 394.449 3.101 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc(F)cc2Br)c(F)c1 ZINC000056065512 1407187811 /nfs/dbraw/zinc/18/78/11/1407187811.db2.gz IEQRGICMYGXXSQ-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN CC(C)c1ccc(OCCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056073822 1407191935 /nfs/dbraw/zinc/19/19/35/1407191935.db2.gz CFZRINGPRJQWGO-UHFFFAOYSA-N 0 0 378.450 3.217 20 5 GGBDRN CCCC(=O)Nc1ccc(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000056068414 1407189636 /nfs/dbraw/zinc/18/96/36/1407189636.db2.gz GEJFCMHMYXWPEC-UHFFFAOYSA-N 0 0 391.449 3.120 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(-n2cncn2)c(F)c1 ZINC000056085120 1407196902 /nfs/dbraw/zinc/19/69/02/1407196902.db2.gz BFGSCFPDTVWSHY-UHFFFAOYSA-N 0 0 384.371 3.145 20 5 GGBDRN CC1(C)Cc2nc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)sc2C(=O)C1 ZINC000056080750 1407195940 /nfs/dbraw/zinc/19/59/40/1407195940.db2.gz VUDBFRKRSPVONK-UHFFFAOYSA-N 0 0 385.405 3.335 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)cc1 ZINC000056105786 1407206703 /nfs/dbraw/zinc/20/67/03/1407206703.db2.gz AXDQPKNFYKXSMR-UHFFFAOYSA-N 0 0 391.836 3.477 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000056108609 1407208536 /nfs/dbraw/zinc/20/85/36/1407208536.db2.gz YTLVRORETHSUCO-SECBINFHSA-N 0 0 385.785 3.196 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)CCCCc1ccccc1 ZINC000056103696 1407204791 /nfs/dbraw/zinc/20/47/91/1407204791.db2.gz RUGWEMQILLUENQ-UHFFFAOYSA-N 0 0 378.450 3.247 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000056120060 1407212989 /nfs/dbraw/zinc/21/29/89/1407212989.db2.gz MHQMUJYZFSPEOQ-UHFFFAOYSA-N 0 0 376.434 3.265 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000056126806 1407216212 /nfs/dbraw/zinc/21/62/12/1407216212.db2.gz BMGMIYFYUKHGNC-MRXNPFEDSA-N 0 0 396.852 3.319 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1 ZINC000056137725 1407221507 /nfs/dbraw/zinc/22/15/07/1407221507.db2.gz ZEYOHEIOCGTZLR-ZWKOTPCHSA-N 0 0 394.424 3.074 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000056137599 1407221558 /nfs/dbraw/zinc/22/15/58/1407221558.db2.gz FTWCLNJTWVJNHT-IRXDYDNUSA-N 0 0 394.424 3.241 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000056138130 1407222493 /nfs/dbraw/zinc/22/24/93/1407222493.db2.gz OMXWTBDXFBYLGN-AEFFLSMTSA-N 0 0 394.424 3.241 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000056138047 1407222501 /nfs/dbraw/zinc/22/25/01/1407222501.db2.gz YCUJUEVUHYWIMN-MSOLQXFVSA-N 0 0 394.424 3.241 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)c(F)c1 ZINC000056137552 1407221329 /nfs/dbraw/zinc/22/13/29/1407221329.db2.gz LEUNSJLLSAKYCX-RDJZCZTQSA-N 0 0 398.387 3.072 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@@H]1c1cccc(C)c1 ZINC000056140564 1407224162 /nfs/dbraw/zinc/22/41/62/1407224162.db2.gz LGQUBLXKIKLKPY-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN CCCNC(=O)c1ccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1Cl ZINC000056150614 1407229010 /nfs/dbraw/zinc/22/90/10/1407229010.db2.gz DSDNFOUXZRXMEP-UHFFFAOYSA-N 0 0 376.800 3.223 20 5 GGBDRN C[C@H](Nc1ccc(N2C(=O)CCCC2=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000056144951 1407225957 /nfs/dbraw/zinc/22/59/57/1407225957.db2.gz OORUTCNGHPSGDL-ZDUSSCGKSA-N 0 0 396.403 3.077 20 5 GGBDRN CCCCOc1cccc(NC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 ZINC000056148299 1407226488 /nfs/dbraw/zinc/22/64/88/1407226488.db2.gz LJXLGQOHOJKHLL-UHFFFAOYSA-N 0 0 397.387 3.008 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000056149973 1407228101 /nfs/dbraw/zinc/22/81/01/1407228101.db2.gz IAWLJKXRAPZPHQ-MRXNPFEDSA-N 0 0 380.404 3.293 20 5 GGBDRN CCCNC(=O)c1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1Cl ZINC000056150746 1407228846 /nfs/dbraw/zinc/22/88/46/1407228846.db2.gz QQTVWDLALMPCQJ-UHFFFAOYSA-N 0 0 394.790 3.362 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccccc2C(=O)NC(C)(C)C)cc([N+](=O)[O-])c1 ZINC000056172941 1407239801 /nfs/dbraw/zinc/23/98/01/1407239801.db2.gz PZTNLHMMDWRPMG-UHFFFAOYSA-N 0 0 399.403 3.162 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@@H](C)Oc1ccc(Cl)c(Cl)c1 ZINC000056219832 1407257164 /nfs/dbraw/zinc/25/71/64/1407257164.db2.gz BQUMNEZUUMRLIT-SECBINFHSA-N 0 0 388.207 3.417 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@@H](C)Oc1cccc(Cl)c1Cl ZINC000056219948 1407257180 /nfs/dbraw/zinc/25/71/80/1407257180.db2.gz KMDJAXGSNMRMKK-SECBINFHSA-N 0 0 388.207 3.417 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(Br)cc1Cl ZINC000056219674 1407257341 /nfs/dbraw/zinc/25/73/41/1407257341.db2.gz LJUGQAPVIXICLI-UHFFFAOYSA-N 0 0 388.605 3.373 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000056219663 1407257594 /nfs/dbraw/zinc/25/75/94/1407257594.db2.gz FTLAKNJWSYXDQH-UHFFFAOYSA-N 0 0 375.772 3.000 20 5 GGBDRN COC(=O)Cc1sc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)nc1-c1ccccc1 ZINC000056221932 1407258267 /nfs/dbraw/zinc/25/82/67/1407258267.db2.gz HMUPQHGYIDVYCH-UHFFFAOYSA-N 0 0 386.389 3.014 20 5 GGBDRN Nc1ccc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)cc1[N+](=O)[O-] ZINC000056223851 1407258532 /nfs/dbraw/zinc/25/85/32/1407258532.db2.gz XOUMHPRHOYDMEK-UHFFFAOYSA-N 0 0 382.420 3.492 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N(C)c2ccc(F)c(F)c2)cc1OC ZINC000056226923 1407260060 /nfs/dbraw/zinc/26/00/60/1407260060.db2.gz SHVJNADCUVAYMQ-UHFFFAOYSA-N 0 0 396.346 3.183 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)OCc1c(Cl)nc(Cl)n1-c1ccccc1 ZINC000056240963 1407264327 /nfs/dbraw/zinc/26/43/27/1407264327.db2.gz OSYJXENWVDSKPA-UHFFFAOYSA-N 0 0 396.190 3.027 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCC(NC(=O)Nc2ccccc2)CC1 ZINC000056248060 1407266440 /nfs/dbraw/zinc/26/64/40/1407266440.db2.gz MHCOXKSKALUHGR-FLIBITNWSA-N 0 0 394.431 3.421 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[C@@H](C)C2)cc1OC ZINC000056267038 1407271944 /nfs/dbraw/zinc/27/19/44/1407271944.db2.gz LJKBCGAKPVUUMI-ZIAGYGMSSA-N 0 0 380.441 3.185 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@H](C)C2)cc1OC ZINC000056267036 1407271868 /nfs/dbraw/zinc/27/18/68/1407271868.db2.gz LJKBCGAKPVUUMI-KBPBESRZSA-N 0 0 380.441 3.185 20 5 GGBDRN O=C(N[C@@H]1CCOc2c(Cl)cccc21)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000056251885 1407268207 /nfs/dbraw/zinc/26/82/07/1407268207.db2.gz FAYXCQRCZXRGKH-GFCCVEGCSA-N 0 0 376.752 3.231 20 5 GGBDRN O=C(N[C@H]1CCOc2c(Cl)cccc21)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000056251884 1407268476 /nfs/dbraw/zinc/26/84/76/1407268476.db2.gz FAYXCQRCZXRGKH-LBPRGKRZSA-N 0 0 376.752 3.231 20 5 GGBDRN COc1c(Cl)cccc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000056286091 1407280448 /nfs/dbraw/zinc/28/04/48/1407280448.db2.gz SSLCEAVKRNHEKB-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000056288595 1407280881 /nfs/dbraw/zinc/28/08/81/1407280881.db2.gz VHJPASIGTBOZLU-UHFFFAOYSA-N 0 0 383.364 3.430 20 5 GGBDRN Cc1cccc([C@H](CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)NC(N)=O)c1 ZINC000056288696 1407280914 /nfs/dbraw/zinc/28/09/14/1407280914.db2.gz XRYSSBXCMIRJKF-IBGZPJMESA-N 0 0 398.463 3.440 20 5 GGBDRN CCn1c2ccccc2n(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1=O ZINC000056288194 1407281106 /nfs/dbraw/zinc/28/11/06/1407281106.db2.gz ZSMWNKLGQLHLIF-UHFFFAOYSA-N 0 0 396.447 3.168 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCN1C(=O)c2ccccc2C1=O ZINC000056288585 1407281124 /nfs/dbraw/zinc/28/11/24/1407281124.db2.gz BCOZGUAUEPSYIS-UHFFFAOYSA-N 0 0 395.415 3.018 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(NS(C)(=O)=O)cc1 ZINC000056288185 1407281150 /nfs/dbraw/zinc/28/11/50/1407281150.db2.gz AWICTAJLNDSISI-UHFFFAOYSA-N 0 0 391.449 3.017 20 5 GGBDRN Cc1cccc2c1ncn(CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)c2=O ZINC000056288178 1407281193 /nfs/dbraw/zinc/28/11/93/1407281193.db2.gz DMFDNAFQVGRFKD-UHFFFAOYSA-N 0 0 394.431 3.050 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[C@@H](NC(N)=O)c1ccccc1 ZINC000056288165 1407281377 /nfs/dbraw/zinc/28/13/77/1407281377.db2.gz RNRFCTCJTMUWNJ-GOSISDBHSA-N 0 0 384.436 3.132 20 5 GGBDRN CCCC(=O)N1CCC[C@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000056288808 1407281394 /nfs/dbraw/zinc/28/13/94/1407281394.db2.gz GUFIAVMZBLVUIF-KRWDZBQOSA-N 0 0 375.469 3.371 20 5 GGBDRN CC[C@@H](C)Oc1ccc(NC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 ZINC000056301885 1407289591 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ZINC000046616569 1404513763 /nfs/dbraw/zinc/51/37/63/1404513763.db2.gz YCEGXJXFJKLOQE-UHFFFAOYSA-N 0 0 376.434 3.489 20 5 GGBDRN O=C(c1occc1-c1ccccc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000046619628 1404515174 /nfs/dbraw/zinc/51/51/74/1404515174.db2.gz GQRBTFDODSRBKK-UHFFFAOYSA-N 0 0 378.388 3.212 20 5 GGBDRN COCCOCc1cccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000046625284 1404517164 /nfs/dbraw/zinc/51/71/64/1404517164.db2.gz CPGDAGWNQLYWFB-UHFFFAOYSA-N 0 0 396.403 3.196 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000046631164 1404519915 /nfs/dbraw/zinc/51/99/15/1404519915.db2.gz VVQCURRKFGONRN-GOSISDBHSA-N 0 0 388.786 3.490 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@@H](C)c2cccc(OC(F)F)c2)cc([N+](=O)[O-])c1 ZINC000046640246 1404524539 /nfs/dbraw/zinc/52/45/39/1404524539.db2.gz KKECEEPPGIOPIZ-JTQLQIEISA-N 0 0 394.330 3.474 20 5 GGBDRN CN(CCCc1ccccc1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000046639654 1404525270 /nfs/dbraw/zinc/52/52/70/1404525270.db2.gz FYJDHPUNSUHKMC-UHFFFAOYSA-N 0 0 397.431 3.374 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000046646542 1404529346 /nfs/dbraw/zinc/52/93/46/1404529346.db2.gz FDFKUZFWFDKLTO-UHFFFAOYSA-N 0 0 395.246 3.188 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000046646529 1404529977 /nfs/dbraw/zinc/52/99/77/1404529977.db2.gz FRJFOIMEWUKHSA-UHFFFAOYSA-N 0 0 395.246 3.188 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCc1ccnc(Oc2ccccc2)c1 ZINC000046659829 1404537612 /nfs/dbraw/zinc/53/76/12/1404537612.db2.gz AFZWWJKCTMLXMR-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN COc1ccc(C(=O)N[C@@H](C)c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-] ZINC000046677263 1404546715 /nfs/dbraw/zinc/54/67/15/1404546715.db2.gz VDNGUDVETMWGPB-NSHDSACASA-N 0 0 390.392 3.120 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCc1cccnc1OC1CCCC1 ZINC000046688335 1404553156 /nfs/dbraw/zinc/55/31/56/1404553156.db2.gz UHGYDCCUHBQPAN-UHFFFAOYSA-N 0 0 384.436 3.430 20 5 GGBDRN O=C(NCc1cnn(Cc2ccccc2)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000046700602 1404557815 /nfs/dbraw/zinc/55/78/15/1404557815.db2.gz TWQGDDSFOUFDGL-UHFFFAOYSA-N 0 0 391.431 3.344 20 5 GGBDRN CN(CC(=O)Nc1cccc(Cl)c1)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000046707899 1404559351 /nfs/dbraw/zinc/55/93/51/1404559351.db2.gz DUGAQKDVZWVJLI-UHFFFAOYSA-N 0 0 390.827 3.147 20 5 GGBDRN CCOc1ccc([C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)c2ccccc2)cc1 ZINC000046710305 1404560328 /nfs/dbraw/zinc/56/03/28/1404560328.db2.gz ZIDDYQHDUKDFCZ-FQEVSTJZSA-N 0 0 380.404 3.096 20 5 GGBDRN CC(C)(C)c1nnc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000056737300 1407414930 /nfs/dbraw/zinc/41/49/30/1407414930.db2.gz DOMMMUFABPWXHV-UHFFFAOYSA-N 0 0 390.469 3.098 20 5 GGBDRN CC[C@H]1CCc2nc(NC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)sc2C1 ZINC000046784792 1404588237 /nfs/dbraw/zinc/58/82/37/1404588237.db2.gz HSRWTCNLPUKEOC-NSHDSACASA-N 0 0 398.448 3.399 20 5 GGBDRN O=C(Nc1ccn(Cc2ccccc2)n1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000046797018 1404593377 /nfs/dbraw/zinc/59/33/77/1404593377.db2.gz XTHCUQGRNDCIEA-UHFFFAOYSA-N 0 0 388.387 3.278 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cccc(OC(F)(F)F)c1 ZINC000046801091 1404594242 /nfs/dbraw/zinc/59/42/42/1404594242.db2.gz GITNWYMAJLCHOM-UHFFFAOYSA-N 0 0 390.339 3.314 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)nc1 ZINC000046807971 1404596553 /nfs/dbraw/zinc/59/65/53/1404596553.db2.gz CGBGHSJNXFLPHS-UHFFFAOYSA-N 0 0 382.420 3.098 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)C2)nc1 ZINC000046817989 1404601484 /nfs/dbraw/zinc/60/14/84/1404601484.db2.gz GBSRCGYIXPDLCM-MRXNPFEDSA-N 0 0 382.420 3.098 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCO[C@@H]2CCCC[C@H]2C)cc1OC ZINC000047005812 1404671928 /nfs/dbraw/zinc/67/19/28/1404671928.db2.gz YXDACXHYDXHXHK-CZUORRHYSA-N 0 0 380.441 3.327 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCOc2c(C)cccc2C)cc1OC ZINC000047024579 1404678731 /nfs/dbraw/zinc/67/87/31/1404678731.db2.gz LVLWIQOYXNVAJO-UHFFFAOYSA-N 0 0 388.420 3.428 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@H](c2ccco2)N2CCCCC2)cc1[N+](=O)[O-] ZINC000047031366 1404680485 /nfs/dbraw/zinc/68/04/85/1404680485.db2.gz JAFYOPGYARGOAD-QGZVFWFLSA-N 0 0 393.465 3.002 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(N2CCC(O)CC2)cc1 ZINC000047103471 1404707315 /nfs/dbraw/zinc/70/73/15/1404707315.db2.gz XNYVVDCRLMBXNH-UHFFFAOYSA-N 0 0 387.461 3.287 20 5 GGBDRN O=C(Cn1nccc1[N+](=O)[O-])N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000047169081 1404729714 /nfs/dbraw/zinc/72/97/14/1404729714.db2.gz HCTKTVRBPJGAGV-LBPRGKRZSA-N 0 0 387.446 3.292 20 5 GGBDRN O=C(Cn1nccc1[N+](=O)[O-])N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 ZINC000047169802 1404729726 /nfs/dbraw/zinc/72/97/26/1404729726.db2.gz NEHUKTHFHQCQIV-HNNXBMFYSA-N 0 0 399.794 3.416 20 5 GGBDRN Cc1ccc(C2=NN(C(=O)Cn3nccc3[N+](=O)[O-])[C@@H](c3ccco3)C2)cc1 ZINC000047169617 1404729850 /nfs/dbraw/zinc/72/98/50/1404729850.db2.gz VMECNBWPCRPNEY-MRXNPFEDSA-N 0 0 379.376 3.071 20 5 GGBDRN Cc1ccc(C2=NN(C(=O)Cn3nccc3[N+](=O)[O-])[C@H](c3ccco3)C2)cc1 ZINC000047169615 1404730081 /nfs/dbraw/zinc/73/00/81/1404730081.db2.gz VMECNBWPCRPNEY-INIZCTEOSA-N 0 0 379.376 3.071 20 5 GGBDRN CCOc1cc(C(=O)Nc2ccc(Cn3cccn3)cc2)c([N+](=O)[O-])cc1OC ZINC000047176894 1404734361 /nfs/dbraw/zinc/73/43/61/1404734361.db2.gz WYSNYWYXYCAZHE-UHFFFAOYSA-N 0 0 396.403 3.499 20 5 GGBDRN O=C(Nc1ccc(OCC(F)(F)F)nc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000047184826 1404737251 /nfs/dbraw/zinc/73/72/51/1404737251.db2.gz RAJSUVLDZSTKGA-UHFFFAOYSA-N 0 0 381.270 3.060 20 5 GGBDRN O=C(NCCOc1cccc(Cl)c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000047201138 1404744538 /nfs/dbraw/zinc/74/45/38/1404744538.db2.gz XRPVROZJZGYFRJ-UHFFFAOYSA-N 0 0 386.795 3.243 20 5 GGBDRN COc1cc(C(=O)NCCOc2cccc(Cl)c2)c([N+](=O)[O-])cc1OC ZINC000047201183 1404744638 /nfs/dbraw/zinc/74/46/38/1404744638.db2.gz ATXXUWZRRLRWKL-UHFFFAOYSA-N 0 0 380.784 3.074 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(N2CCNC2=O)c1 ZINC000047235745 1404760914 /nfs/dbraw/zinc/76/09/14/1404760914.db2.gz ALCMQUVLPCXBIQ-GFCCVEGCSA-N 0 0 386.433 3.244 20 5 GGBDRN O=C(Nc1ccccn1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000047238362 1404761605 /nfs/dbraw/zinc/76/16/05/1404761605.db2.gz NVLJRCAJQYWCQE-GFCCVEGCSA-N 0 0 388.811 3.134 20 5 GGBDRN O=C(Nc1ccccn1)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000047237562 1404761856 /nfs/dbraw/zinc/76/18/56/1404761856.db2.gz RFZYCDLVMATRDZ-GFCCVEGCSA-N 0 0 388.811 3.134 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccc(OCC(F)(F)F)cc3)CC2)cn1 ZINC000047266043 1404776247 /nfs/dbraw/zinc/77/62/47/1404776247.db2.gz GVMQZQJGVXCIBB-UHFFFAOYSA-N 0 0 396.369 3.253 20 5 GGBDRN Cc1cccc(NC(=O)CN2CCN(Cc3csc([N+](=O)[O-])c3)CC2)c1C ZINC000047265204 1404776696 /nfs/dbraw/zinc/77/66/96/1404776696.db2.gz KWHWRCPTOUSZJN-UHFFFAOYSA-N 0 0 388.493 3.029 20 5 GGBDRN O=C(Nc1cccc(Cn2cncn2)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000047290556 1404789491 /nfs/dbraw/zinc/78/94/91/1404789491.db2.gz VBDSOGHACADESY-UHFFFAOYSA-N 0 0 378.392 3.061 20 5 GGBDRN O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000047292572 1404790862 /nfs/dbraw/zinc/79/08/62/1404790862.db2.gz GKAHIQSSVDQQLG-ZDUSSCGKSA-N 0 0 388.811 3.134 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000047322868 1404805834 /nfs/dbraw/zinc/80/58/34/1404805834.db2.gz ZODKMDNDGOUZCY-UHFFFAOYSA-N 0 0 383.408 3.181 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)C2)nc1 ZINC000047323208 1404805945 /nfs/dbraw/zinc/80/59/45/1404805945.db2.gz CAVBBOGZAFZBAF-HNNXBMFYSA-N 0 0 397.435 3.489 20 5 GGBDRN CCOC(=O)Cc1csc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000047333213 1404808847 /nfs/dbraw/zinc/80/88/47/1404808847.db2.gz NTDPLRIGVGENBK-JTQLQIEISA-N 0 0 378.410 3.040 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)nc1 ZINC000047345918 1404812428 /nfs/dbraw/zinc/81/24/28/1404812428.db2.gz NJGUPAUXESSNCV-OAHLLOKOSA-N 0 0 397.435 3.489 20 5 GGBDRN CCC[C@]1(c2ccccc2)NC(=O)N(CCOc2cccc([N+](=O)[O-])c2)C1=O ZINC000047348406 1404813054 /nfs/dbraw/zinc/81/30/54/1404813054.db2.gz JKZHPXJEOSYBFU-HXUWFJFHSA-N 0 0 383.404 3.221 20 5 GGBDRN C[C@@]1(c2cc3ccccc3o2)NC(=O)N(CCOc2ccccc2[N+](=O)[O-])C1=O ZINC000047354299 1404814197 /nfs/dbraw/zinc/81/41/97/1404814197.db2.gz CVLJKUDFFUPKPF-FQEVSTJZSA-N 0 0 395.371 3.187 20 5 GGBDRN Cc1c(OCC(=O)Nc2cc(Cl)ccc2-n2cncn2)cccc1[N+](=O)[O-] ZINC000047355555 1404815057 /nfs/dbraw/zinc/81/50/57/1404815057.db2.gz XBPJJEBRKZKFSJ-UHFFFAOYSA-N 0 0 387.783 3.155 20 5 GGBDRN Cc1c(OCC(=O)NCCc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000047355459 1404815168 /nfs/dbraw/zinc/81/51/68/1404815168.db2.gz MOOWZLTUPZKVCC-UHFFFAOYSA-N 0 0 380.347 3.242 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cc(-c3ccccc3)on2)C1=O ZINC000047357352 1404815233 /nfs/dbraw/zinc/81/52/33/1404815233.db2.gz JFGPKJARJBTDBE-FQEVSTJZSA-N 0 0 392.371 3.217 20 5 GGBDRN CC(C)c1nc(Cn2cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c2=O)cs1 ZINC000047369172 1404818385 /nfs/dbraw/zinc/81/83/85/1404818385.db2.gz ZVAPNHFOWVGYCN-UHFFFAOYSA-N 0 0 396.432 3.119 20 5 GGBDRN CCN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H]1COc2ccccc2O1 ZINC000047406745 1404828255 /nfs/dbraw/zinc/82/82/55/1404828255.db2.gz OVRFKSWGFOYPNU-INIZCTEOSA-N 0 0 396.403 3.307 20 5 GGBDRN Cc1c(NC(=O)C2CCN(C(=O)COc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000047442659 1404837639 /nfs/dbraw/zinc/83/76/39/1404837639.db2.gz IRAKZUYFNIMKEL-UHFFFAOYSA-N 0 0 397.431 3.159 20 5 GGBDRN COc1cc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1O ZINC000047513329 1404856103 /nfs/dbraw/zinc/85/61/03/1404856103.db2.gz YSDLQMGRQNFOJC-UHFFFAOYSA-N 0 0 388.423 3.185 20 5 GGBDRN COc1ccc(CN2CCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1F ZINC000047540600 1404863261 /nfs/dbraw/zinc/86/32/61/1404863261.db2.gz IQZUWKXRADOGJF-UHFFFAOYSA-N 0 0 377.391 3.199 20 5 GGBDRN C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000047557775 1404867058 /nfs/dbraw/zinc/86/70/58/1404867058.db2.gz XDEAWAXDLPMKEA-SECBINFHSA-N 0 0 382.401 3.470 20 5 GGBDRN COCCn1c(C)c(C)nc1SCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000047560611 1404867732 /nfs/dbraw/zinc/86/77/32/1404867732.db2.gz GBKOALVKDHRNMD-UHFFFAOYSA-N 0 0 389.437 3.397 20 5 GGBDRN CCOc1ccc([C@H](C)NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000047608011 1404878579 /nfs/dbraw/zinc/87/85/79/1404878579.db2.gz WODIXYLWVDYAJE-ZDUSSCGKSA-N 0 0 394.449 3.183 20 5 GGBDRN CCN(CC)C(=O)c1cccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000047609084 1404879039 /nfs/dbraw/zinc/87/90/39/1404879039.db2.gz KQFXGCDHJRCJBA-UHFFFAOYSA-N 0 0 385.420 3.484 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000047624099 1404881226 /nfs/dbraw/zinc/88/12/26/1404881226.db2.gz HNFTUKDTBXMSGF-UHFFFAOYSA-N 0 0 383.404 3.238 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000047623852 1404881254 /nfs/dbraw/zinc/88/12/54/1404881254.db2.gz MPZULTASZUBKGZ-IBGZPJMESA-N 0 0 380.404 3.003 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000047623615 1404881272 /nfs/dbraw/zinc/88/12/72/1404881272.db2.gz AYKHWDYCWTWEJS-INIZCTEOSA-N 0 0 397.431 3.241 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 ZINC000047625203 1404881638 /nfs/dbraw/zinc/88/16/38/1404881638.db2.gz WAVDRGFYXVQVAA-SFHVURJKSA-N 0 0 399.403 3.120 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)CCOc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000047624839 1404881969 /nfs/dbraw/zinc/88/19/69/1404881969.db2.gz QHDWKVACWWVBHC-UHFFFAOYSA-N 0 0 399.447 3.386 20 5 GGBDRN COc1cccc([C@H]2CCCN2S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c1 ZINC000047671451 1404890774 /nfs/dbraw/zinc/89/07/74/1404890774.db2.gz FGSLKPJERTYFHS-OAHLLOKOSA-N 0 0 380.397 3.268 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCCn1c(C)nc2ccccc21 ZINC000047687674 1404893566 /nfs/dbraw/zinc/89/35/66/1404893566.db2.gz WDUHIXVJKQQDKL-UHFFFAOYSA-N 0 0 383.408 3.473 20 5 GGBDRN COc1ccccc1CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000047740127 1404913704 /nfs/dbraw/zinc/91/37/04/1404913704.db2.gz LQQZETTYPGGJBR-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN CCc1ccc([C@H](C)NC(=O)CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000047742887 1404914850 /nfs/dbraw/zinc/91/48/50/1404914850.db2.gz RSPDQJQZOHERQQ-KRWDZBQOSA-N 0 0 396.491 3.157 20 5 GGBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3cc(Cl)c4c(c3)OCCO4)CC2)c1 ZINC000047742895 1404915307 /nfs/dbraw/zinc/91/53/07/1404915307.db2.gz LLHREVPHKCURAN-UHFFFAOYSA-N 0 0 389.839 3.342 20 5 GGBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3nc(-c4ccc(F)cc4)no3)CC2)c1 ZINC000047743735 1404916518 /nfs/dbraw/zinc/91/65/18/1404916518.db2.gz CAWHSKFBBWXMGK-UHFFFAOYSA-N 0 0 383.383 3.106 20 5 GGBDRN Cc1cccc(NC(=O)[C@H](C)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1C ZINC000047745033 1404916765 /nfs/dbraw/zinc/91/67/65/1404916765.db2.gz JHTWZWCDGHRIRQ-KRWDZBQOSA-N 0 0 382.464 3.361 20 5 GGBDRN CCc1ccccc1NC(=O)[C@@H](C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745252 1404916919 /nfs/dbraw/zinc/91/69/19/1404916919.db2.gz DJRRBVZOIOXAHK-MRXNPFEDSA-N 0 0 382.464 3.306 20 5 GGBDRN C[C@H](C(=O)Nc1cc(F)ccc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745564 1404917795 /nfs/dbraw/zinc/91/77/95/1404917795.db2.gz APEMOYBFZBMQNP-CYBMUJFWSA-N 0 0 390.390 3.022 20 5 GGBDRN CNC(=O)c1cc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000047815021 1404960596 /nfs/dbraw/zinc/96/05/96/1404960596.db2.gz XCHHBHWHCPZEMT-UHFFFAOYSA-N 0 0 376.800 3.272 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 ZINC000047837686 1404968322 /nfs/dbraw/zinc/96/83/22/1404968322.db2.gz LIYQKBYOJGLCTD-QGZVFWFLSA-N 0 0 384.392 3.034 20 5 GGBDRN COc1ccc(NC(=O)NCc2ccccc2[N+](=O)[O-])cc1N1CCCC1=O ZINC000047854246 1404972744 /nfs/dbraw/zinc/97/27/44/1404972744.db2.gz KAMQUHVNVUTPGE-UHFFFAOYSA-N 0 0 384.392 3.052 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000047865962 1404978276 /nfs/dbraw/zinc/97/82/76/1404978276.db2.gz OFUBCFZTPZSAHA-UHFFFAOYSA-N 0 0 394.334 3.476 20 5 GGBDRN CCOc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)NC)c2)cc1[N+](=O)[O-] ZINC000047899199 1404988868 /nfs/dbraw/zinc/98/88/68/1404988868.db2.gz SDSVWFWJBCQQJJ-UHFFFAOYSA-N 0 0 377.784 3.259 20 5 GGBDRN CC(C)(C)[C@@H](NC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000047900705 1404989767 /nfs/dbraw/zinc/98/97/67/1404989767.db2.gz MHBDYRAMNCEGIM-FQEVSTJZSA-N 0 0 397.431 3.224 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CCCNC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000047909584 1404992018 /nfs/dbraw/zinc/99/20/18/1404992018.db2.gz FLTOJPMWHAAZDP-UHFFFAOYSA-N 0 0 394.431 3.217 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)N2CCCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000047975795 1405014503 /nfs/dbraw/zinc/01/45/03/1405014503.db2.gz PCRUQSSEHLCQEH-UHFFFAOYSA-N 0 0 385.445 3.155 20 5 GGBDRN COc1ccc(NC(C)=O)cc1NC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000047988821 1405019678 /nfs/dbraw/zinc/01/96/78/1405019678.db2.gz CAXSYQZAGUBROT-UHFFFAOYSA-N 0 0 387.392 3.278 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000048038895 1405030520 /nfs/dbraw/zinc/03/05/20/1405030520.db2.gz CACFSFMYEYDFGA-UHFFFAOYSA-N 0 0 380.154 3.196 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCN(C(=O)c2ccsc2)CC1 ZINC000048052808 1405035581 /nfs/dbraw/zinc/03/55/81/1405035581.db2.gz LXYANVLPOBFGTQ-UHFFFAOYSA-N 0 0 394.840 3.300 20 5 GGBDRN CC(C)Cn1nc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c2ccccc2c1=O ZINC000048090257 1405049776 /nfs/dbraw/zinc/04/97/76/1405049776.db2.gz HEOLPZQHSBDDCL-UHFFFAOYSA-N 0 0 384.367 3.352 20 5 GGBDRN O=C(NC[C@H]1Cc2ccccc2O1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000048188209 1405092537 /nfs/dbraw/zinc/09/25/37/1405092537.db2.gz GEFUHEBESBQVJV-CYBMUJFWSA-N 0 0 396.321 3.269 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2cccc(-c3cnco3)c2)c([N+](=O)[O-])c1 ZINC000048205615 1405097121 /nfs/dbraw/zinc/09/71/21/1405097121.db2.gz KDVIBBIATKNTDR-UHFFFAOYSA-N 0 0 398.400 3.080 20 5 GGBDRN CCOc1ccc(Oc2ccc(NC(=O)Cn3cnc([N+](=O)[O-])n3)cc2)cc1 ZINC000048222654 1405103066 /nfs/dbraw/zinc/10/30/66/1405103066.db2.gz VDTBVYWGJZTFEP-UHFFFAOYSA-N 0 0 383.364 3.016 20 5 GGBDRN CCOc1ccc(CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1OCC ZINC000048244683 1405111028 /nfs/dbraw/zinc/11/10/28/1405111028.db2.gz XQZABUTYDISBOF-UHFFFAOYSA-N 0 0 391.399 3.086 20 5 GGBDRN COc1ccc(S[C@H](C)C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000048268247 1405120424 /nfs/dbraw/zinc/12/04/24/1405120424.db2.gz YZOMCMXMXJLZSZ-CYBMUJFWSA-N 0 0 375.450 3.312 20 5 GGBDRN CC(=O)Nc1ccc(C)c(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000048272161 1405123395 /nfs/dbraw/zinc/12/33/95/1405123395.db2.gz HZHKDHTYTUNLQV-UHFFFAOYSA-N 0 0 397.435 3.216 20 5 GGBDRN Cc1c(C(=O)N2CCCN(C(=O)CCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000176273210 1428214178 /nfs/dbraw/zinc/21/41/78/1428214178.db2.gz SQKPYXXFFVUTCR-UHFFFAOYSA-N 0 0 395.459 3.211 20 5 GGBDRN COc1cccc(CCNC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c1 ZINC000048300327 1405133849 /nfs/dbraw/zinc/13/38/49/1405133849.db2.gz QSMZZTYMMDOUIF-UHFFFAOYSA-N 0 0 396.346 3.186 20 5 GGBDRN O=C(c1cccc(OC(F)F)c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048305841 1405136111 /nfs/dbraw/zinc/13/61/11/1405136111.db2.gz XCOQGMLFTHDTNA-UHFFFAOYSA-N 0 0 377.347 3.159 20 5 GGBDRN Cc1ccnn1-c1ccc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000048305622 1405136788 /nfs/dbraw/zinc/13/67/88/1405136788.db2.gz IJVDGJKYKYWBKK-UHFFFAOYSA-N 0 0 391.431 3.051 20 5 GGBDRN Cc1ccn(-c2ccc(C(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2)n1 ZINC000048306233 1405137494 /nfs/dbraw/zinc/13/74/94/1405137494.db2.gz TZDQVADSYYMUTM-UHFFFAOYSA-N 0 0 391.431 3.051 20 5 GGBDRN O=C(NCc1ccccc1Cn1cccn1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000048315380 1405140679 /nfs/dbraw/zinc/14/06/79/1405140679.db2.gz OZGXVMIKHRYWIA-UHFFFAOYSA-N 0 0 375.388 3.251 20 5 GGBDRN CN(Cc1ccccc1N1CCOCC1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000048314636 1405141613 /nfs/dbraw/zinc/14/16/13/1405141613.db2.gz PVWVLCSENPLNQW-UHFFFAOYSA-N 0 0 394.431 3.185 20 5 GGBDRN COc1cc(CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc(OC)c1OC ZINC000048314460 1405141720 /nfs/dbraw/zinc/14/17/20/1405141720.db2.gz UUMMOCCBWYHMQB-UHFFFAOYSA-N 0 0 385.376 3.032 20 5 GGBDRN Cc1cccc(CN2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)CC2)c1 ZINC000048313683 1405141746 /nfs/dbraw/zinc/14/17/46/1405141746.db2.gz XIUHCHUZXCEMEQ-UHFFFAOYSA-N 0 0 378.432 3.343 20 5 GGBDRN CN(Cc1ccccc1OC(F)(F)F)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000048317835 1405142545 /nfs/dbraw/zinc/14/25/45/1405142545.db2.gz UYOSYCNXWXRXFW-UHFFFAOYSA-N 0 0 387.289 3.487 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1 ZINC000048317406 1405142645 /nfs/dbraw/zinc/14/26/45/1405142645.db2.gz LRTYYFFOHRBHKP-GOSISDBHSA-N 0 0 375.388 3.329 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)CC2)c1 ZINC000048318928 1405143494 /nfs/dbraw/zinc/14/34/94/1405143494.db2.gz WCPNHIWBPGMQCJ-UHFFFAOYSA-N 0 0 380.404 3.047 20 5 GGBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)c1ccc(NC(=O)C2CC2)cc1 ZINC000048320249 1405144078 /nfs/dbraw/zinc/14/40/78/1405144078.db2.gz YSXJHAIUBLXVNT-JTQLQIEISA-N 0 0 386.383 3.156 20 5 GGBDRN Cc1c(C(=O)NCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000048358448 1405159788 /nfs/dbraw/zinc/15/97/88/1405159788.db2.gz QYYXEDNCMYUPBX-HOTGVXAUSA-N 0 0 397.475 3.442 20 5 GGBDRN Cc1c(C(=O)NCc2ccccc2CN2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000048358444 1405160647 /nfs/dbraw/zinc/16/06/47/1405160647.db2.gz QYYXEDNCMYUPBX-IYBDPMFKSA-N 0 0 397.475 3.442 20 5 GGBDRN Cc1ccc(C(=O)NCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000048361071 1405163594 /nfs/dbraw/zinc/16/35/94/1405163594.db2.gz UQCNMYBGMQDZIW-IAGOWNOFSA-N 0 0 397.475 3.442 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2CNC(=O)Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000048361271 1405163676 /nfs/dbraw/zinc/16/36/76/1405163676.db2.gz QEFBCVXTUNTDRB-CALCHBBNSA-N 0 0 397.475 3.063 20 5 GGBDRN O=C(CCC(=O)c1ccc(F)cc1F)NCCNc1ccccc1[N+](=O)[O-] ZINC000048398507 1405179478 /nfs/dbraw/zinc/17/94/78/1405179478.db2.gz UGASXKWPLJEECZ-UHFFFAOYSA-N 0 0 377.347 3.064 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000048435173 1405189078 /nfs/dbraw/zinc/18/90/78/1405189078.db2.gz HVTAXABNPYINEB-UHFFFAOYSA-N 0 0 395.459 3.491 20 5 GGBDRN O=C(Cn1cc(Br)c([N+](=O)[O-])n1)c1ccc(Br)s1 ZINC000048439713 1405191114 /nfs/dbraw/zinc/19/11/14/1405191114.db2.gz HFIHCUOQBVAPSY-UHFFFAOYSA-N 0 0 395.032 3.261 20 5 GGBDRN CCOc1cc(C(=O)NCc2ccc(OC(C)C)nc2)c([N+](=O)[O-])cc1OC ZINC000048514659 1405212978 /nfs/dbraw/zinc/21/29/78/1405212978.db2.gz HEHMBQHWWSMRMU-UHFFFAOYSA-N 0 0 389.408 3.114 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCCNc1ccccn1 ZINC000048545988 1405221086 /nfs/dbraw/zinc/22/10/86/1405221086.db2.gz ZTIXFADXUZDVJW-UHFFFAOYSA-N 0 0 384.177 3.118 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCN(C/C=C/c2ccccc2)CC1 ZINC000048615977 1405239822 /nfs/dbraw/zinc/23/98/22/1405239822.db2.gz CKCVRVHZETUARL-UXBLZVDNSA-N 0 0 394.475 3.173 20 5 GGBDRN C[C@@H](CCc1ccccc1)NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000048621557 1405241613 /nfs/dbraw/zinc/24/16/13/1405241613.db2.gz MSPQANWCVHMSAN-LBPRGKRZSA-N 0 0 375.812 3.324 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000048702873 1405263048 /nfs/dbraw/zinc/26/30/48/1405263048.db2.gz ZXBNPRBXPJAEAA-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN Cc1ccccc1-c1noc(CS(=O)(=O)Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000048717140 1405266778 /nfs/dbraw/zinc/26/67/78/1405266778.db2.gz KOQNJWUOCZXMJA-UHFFFAOYSA-N 0 0 387.417 3.377 20 5 GGBDRN Cc1c(CS(=O)(=O)[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000048716992 1405266820 /nfs/dbraw/zinc/26/68/20/1405266820.db2.gz WCBKTNQCNIRSCE-YOKBYHGQSA-N 0 0 396.509 3.147 20 5 GGBDRN Cc1c(CS(=O)(=O)CC(=O)N[C@H](C)CCCC(C)C)cccc1[N+](=O)[O-] ZINC000048717048 1405267300 /nfs/dbraw/zinc/26/73/00/1405267300.db2.gz PSEKEQPAUIZBKE-CQSZACIVSA-N 0 0 384.498 3.149 20 5 GGBDRN CCc1ccccc1NC(=O)[C@@H](C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000048717352 1405267359 /nfs/dbraw/zinc/26/73/59/1405267359.db2.gz FYMZGXGNKBACLH-CQSZACIVSA-N 0 0 390.461 3.408 20 5 GGBDRN Cc1c(CS(=O)(=O)[C@H](C)C(=O)Nc2c(F)cccc2F)cccc1[N+](=O)[O-] ZINC000048718051 1405267920 /nfs/dbraw/zinc/26/79/20/1405267920.db2.gz DBNAAJSLDJDLKD-LLVKDONJSA-N 0 0 398.387 3.123 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)CS(=O)(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000048717838 1405267943 /nfs/dbraw/zinc/26/79/43/1405267943.db2.gz JAVDAHRYMPRBEW-UHFFFAOYSA-N 0 0 396.852 3.419 20 5 GGBDRN Cc1c(CS(=O)(=O)[C@H](C)C(=O)Nc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000048717931 1405268325 /nfs/dbraw/zinc/26/83/25/1405268325.db2.gz KQJGVLKMTIFZFQ-GFCCVEGCSA-N 0 0 396.852 3.499 20 5 GGBDRN COc1ccc(CS(=O)(=O)Cc2cc(-c3ccccc3)no2)cc1[N+](=O)[O-] ZINC000048720718 1405269819 /nfs/dbraw/zinc/26/98/19/1405269819.db2.gz HHRJGNVAOBOXGE-UHFFFAOYSA-N 0 0 388.401 3.373 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc2[nH]c(-c3ccc(Cl)c([N+](=O)[O-])c3)nc2c1 ZINC000048877795 1405313102 /nfs/dbraw/zinc/31/31/02/1405313102.db2.gz VIOXRGJJHIQTOY-UHFFFAOYSA-N 0 0 380.813 3.042 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000048885930 1405316241 /nfs/dbraw/zinc/31/62/41/1405316241.db2.gz AULNCKBOKSWBIK-IBGZPJMESA-N 0 0 390.399 3.143 20 5 GGBDRN O=C(NCc1ccc(OC(F)F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000048994682 1405331926 /nfs/dbraw/zinc/33/19/26/1405331926.db2.gz FRQHJWZCUOHDMG-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC)c1 ZINC000049118455 1405341529 /nfs/dbraw/zinc/34/15/29/1405341529.db2.gz SHVDFWCNIKIPLA-CYBMUJFWSA-N 0 0 385.420 3.062 20 5 GGBDRN CCOc1ccc(C(=O)NCc2cccc(C(=O)N[C@@H](C)CC)c2)cc1[N+](=O)[O-] ZINC000049120705 1405342572 /nfs/dbraw/zinc/34/25/72/1405342572.db2.gz XSEWYNLPPHRVEW-AWEZNQCLSA-N 0 0 399.447 3.452 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000049132161 1405344383 /nfs/dbraw/zinc/34/43/83/1405344383.db2.gz XKLCAJNTCISIDU-CYBMUJFWSA-N 0 0 397.431 3.298 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCSc1ccc(Cl)cc1 ZINC000049132823 1405345338 /nfs/dbraw/zinc/34/53/38/1405345338.db2.gz 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1408909840 /nfs/dbraw/zinc/90/98/40/1408909840.db2.gz GXGOJILCTBKQJX-KRWDZBQOSA-N 0 0 384.388 3.109 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000066771967 1408909847 /nfs/dbraw/zinc/90/98/47/1408909847.db2.gz CDNFLDGWRDVHPK-OAHLLOKOSA-N 0 0 384.388 3.109 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC(C)(C)c1ccc(Cl)cc1 ZINC000066773004 1408910244 /nfs/dbraw/zinc/91/02/44/1408910244.db2.gz BUYIMPJEUDFREQ-LBPRGKRZSA-N 0 0 389.839 3.418 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@H]1c1ccc(F)cc1 ZINC000066776441 1408911543 /nfs/dbraw/zinc/91/15/43/1408911543.db2.gz WWLXOCKPGSYVQV-ACJLOTCBSA-N 0 0 385.395 3.216 20 5 GGBDRN Cc1ccc(F)c2c1N(C(=O)c1ccc(-n3cncn3)c([N+](=O)[O-])c1)CCC2 ZINC000066786967 1408914180 /nfs/dbraw/zinc/91/41/80/1408914180.db2.gz LOEGGAPNQHYNIL-UHFFFAOYSA-N 0 0 381.367 3.216 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)CCc1ccc(Br)cc1 ZINC000176547080 1428359505 /nfs/dbraw/zinc/35/95/05/1428359505.db2.gz MTMXYBAZNRNJDD-UHFFFAOYSA-N 0 0 382.214 3.038 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(CN3CCO[C@@H](c4cccc(F)c4)C3)n2)cc1 ZINC000066794376 1408916495 /nfs/dbraw/zinc/91/64/95/1408916495.db2.gz GITMTBNMCAHJMD-GOSISDBHSA-N 0 0 383.383 3.023 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(CN3CCO[C@@H](c4cccc(F)c4)C3)n2)c1 ZINC000066794388 1408916525 /nfs/dbraw/zinc/91/65/25/1408916525.db2.gz PIPRIZZPFMPUHF-GOSISDBHSA-N 0 0 383.383 3.023 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 ZINC000066798080 1408918004 /nfs/dbraw/zinc/91/80/04/1408918004.db2.gz NGNXXDWWXGOCJL-LLVKDONJSA-N 0 0 386.433 3.458 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(Nc3nc4sccn4c3[N+](=O)[O-])CC2)cc1 ZINC000066813087 1408919512 /nfs/dbraw/zinc/91/95/12/1408919512.db2.gz IMBYEQNRNUKKNS-UHFFFAOYSA-N 0 0 385.449 3.329 20 5 GGBDRN Cc1c(CO)cc([N+](=O)[O-])c(N2CCO[C@@H](c3ccccc3F)C2)c1[N+](=O)[O-] ZINC000066814488 1408920070 /nfs/dbraw/zinc/92/00/70/1408920070.db2.gz KDZTVUKZDCSEKB-MRXNPFEDSA-N 0 0 391.355 3.021 20 5 GGBDRN Cc1c(CO)cc([N+](=O)[O-])c(N2CCO[C@H](c3cccc(F)c3)C2)c1[N+](=O)[O-] ZINC000066815003 1408920138 /nfs/dbraw/zinc/92/01/38/1408920138.db2.gz KQKDOSOZLFJQHX-INIZCTEOSA-N 0 0 391.355 3.021 20 5 GGBDRN O=C(NC1CC1)c1ccc(N2CCO[C@@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000066814419 1408920168 /nfs/dbraw/zinc/92/01/68/1408920168.db2.gz PQKYHLSCTFGBJZ-LJQANCHMSA-N 0 0 385.395 3.204 20 5 GGBDRN CNC(=O)c1ccc(N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)c([N+](=O)[O-])c1 ZINC000066813829 1408920191 /nfs/dbraw/zinc/92/01/91/1408920191.db2.gz YSIUCADICFZODU-QGZVFWFLSA-N 0 0 393.802 3.325 20 5 GGBDRN CNS(=O)(=O)c1cccc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)c1 ZINC000066818339 1408920554 /nfs/dbraw/zinc/92/05/54/1408920554.db2.gz ZFXHMKMHVOBRAQ-GFCCVEGCSA-N 0 0 386.433 3.224 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3ncccc3[N+](=O)[O-])CC2)c(C(F)(F)F)c1 ZINC000066816013 1408920618 /nfs/dbraw/zinc/92/06/18/1408920618.db2.gz WNUKVMDAXBQVMM-UHFFFAOYSA-N 0 0 397.313 3.243 20 5 GGBDRN C[C@@H](CN(C)c1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1 ZINC000066815971 1408920635 /nfs/dbraw/zinc/92/06/35/1408920635.db2.gz NJGOGGHOHXBBFU-INIZCTEOSA-N 0 0 383.448 3.307 20 5 GGBDRN Cc1cc(N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)nc(C)n1 ZINC000066816020 1408920678 /nfs/dbraw/zinc/92/06/78/1408920678.db2.gz WAGHBMLMLZUCNT-UHFFFAOYSA-N 0 0 381.358 3.347 20 5 GGBDRN CC(=O)c1ccc(N[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c([N+](=O)[O-])c1 ZINC000066818413 1408920956 /nfs/dbraw/zinc/92/09/56/1408920956.db2.gz VHHXEDSJQOKTJY-GFCCVEGCSA-N 0 0 391.449 3.221 20 5 GGBDRN COc1nc(C)cc(C)c1CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000066818962 1408920977 /nfs/dbraw/zinc/92/09/77/1408920977.db2.gz YOMQXGKVEGLJRF-UHFFFAOYSA-N 0 0 395.419 3.192 20 5 GGBDRN NS(=O)(=O)c1ccc(N2CCC[C@H](c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000066818537 1408921283 /nfs/dbraw/zinc/92/12/83/1408921283.db2.gz DHZUYRZZTXLGAR-HNNXBMFYSA-N 0 0 375.450 3.016 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCO[C@@H](c4ccccc4F)C3)o2)cc1 ZINC000066847247 1408929192 /nfs/dbraw/zinc/92/91/92/1408929192.db2.gz AMXCLOJAOASFLY-QGZVFWFLSA-N 0 0 384.367 3.357 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCO[C@H](c4cccc(F)c4)C3)n2)c1 ZINC000066847998 1408929752 /nfs/dbraw/zinc/92/97/52/1408929752.db2.gz KBRGLYQVKCLXRN-KRWDZBQOSA-N 0 0 384.367 3.357 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCO[C@@H](c4cccc(F)c4)C3)n2)c1 ZINC000066847999 1408929838 /nfs/dbraw/zinc/92/98/38/1408929838.db2.gz KBRGLYQVKCLXRN-QGZVFWFLSA-N 0 0 384.367 3.357 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000066850520 1408931488 /nfs/dbraw/zinc/93/14/88/1408931488.db2.gz YMOBTIXZVNBXKH-SFHVURJKSA-N 0 0 391.374 3.193 20 5 GGBDRN CCn1ccnc1CN1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000066854678 1408932881 /nfs/dbraw/zinc/93/28/81/1408932881.db2.gz OBUCCYFNRDUWID-UHFFFAOYSA-N 0 0 383.374 3.152 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nnc3n2CCCC3)cc1 ZINC000066856602 1408933449 /nfs/dbraw/zinc/93/34/49/1408933449.db2.gz WYDGDOYWVBDVGU-UHFFFAOYSA-N 0 0 392.419 3.240 20 5 GGBDRN O=C(NC1CC1)c1ccc(NC[C@@]2(O)CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000066859853 1408934020 /nfs/dbraw/zinc/93/40/20/1408934020.db2.gz SJUITBRLEBHUNC-NRFANRHFSA-N 0 0 381.432 3.123 20 5 GGBDRN Nc1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)cc1[N+](=O)[O-] ZINC000066856695 1408934033 /nfs/dbraw/zinc/93/40/33/1408934033.db2.gz LPXGXECKKOBRGV-UHFFFAOYSA-N 0 0 378.392 3.024 20 5 GGBDRN CCN(C(=O)[C@@H](C)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000066864746 1408935267 /nfs/dbraw/zinc/93/52/67/1408935267.db2.gz CUMIJAVJXRIUBQ-QGZVFWFLSA-N 0 0 382.464 3.158 20 5 GGBDRN Cc1ccc(F)cc1C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000066869326 1408936994 /nfs/dbraw/zinc/93/69/94/1408936994.db2.gz FPLCLBPJKJQRJI-UHFFFAOYSA-N 0 0 380.759 3.283 20 5 GGBDRN CN(C(=O)CN1CCC[C@H]1c1cccc2c1OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000066899424 1408945569 /nfs/dbraw/zinc/94/55/69/1408945569.db2.gz FHCLTPDVCAAVHD-SFHVURJKSA-N 0 0 397.431 3.166 20 5 GGBDRN CN(C(=O)CN1CCC[C@@H]1c1cccc2c1OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000066899422 1408945776 /nfs/dbraw/zinc/94/57/76/1408945776.db2.gz FHCLTPDVCAAVHD-GOSISDBHSA-N 0 0 397.431 3.166 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCO[C@@H](c3ccccc3F)C2)cc1C ZINC000066933589 1408956137 /nfs/dbraw/zinc/95/61/37/1408956137.db2.gz BAXZFQIDDUGGDZ-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](c2ccccc2)OC[C@@H]1C ZINC000066934735 1408956543 /nfs/dbraw/zinc/95/65/43/1408956543.db2.gz WJKPONOQFBJOIM-YOEHRIQHSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)OC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000066934414 1408956681 /nfs/dbraw/zinc/95/66/81/1408956681.db2.gz VATOIARBIUOYIA-YOEHRIQHSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](c2ccccc2)OC[C@@H]1C ZINC000066934445 1408956734 /nfs/dbraw/zinc/95/67/34/1408956734.db2.gz NCXBSNTYFOJJEH-WMLDXEAASA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2C[C@H](c3ccccc3)OC[C@@H]2C)cc1C ZINC000066934365 1408956763 /nfs/dbraw/zinc/95/67/63/1408956763.db2.gz KIPAWIUIBCMJKZ-MAUKXSAKSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)OCC2(C)C)c([N+](=O)[O-])c1 ZINC000066937372 1408957084 /nfs/dbraw/zinc/95/70/84/1408957084.db2.gz NMEJJSVTEJRURA-QGZVFWFLSA-N 0 0 390.461 3.444 20 5 GGBDRN CS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1 ZINC000066960958 1408963409 /nfs/dbraw/zinc/96/34/09/1408963409.db2.gz OHTBIBRYIAAORY-UHFFFAOYSA-N 0 0 390.751 3.182 20 5 GGBDRN CN(C[C@@H](O)COc1ccccc1C(F)(F)F)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000176559067 1428363667 /nfs/dbraw/zinc/36/36/67/1428363667.db2.gz QYAOZXPFIQCVTO-CQSZACIVSA-N 0 0 398.337 3.126 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2ccc(Cl)cn2)CC1 ZINC000066962173 1408964166 /nfs/dbraw/zinc/96/41/66/1408964166.db2.gz CUZRNLQHLZPOHB-UHFFFAOYSA-N 0 0 391.815 3.006 20 5 GGBDRN Cc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1C(N)=O ZINC000066964010 1408965890 /nfs/dbraw/zinc/96/58/90/1408965890.db2.gz OVZIPLGVVBRNKS-SNVBAGLBSA-N 0 0 376.800 3.095 20 5 GGBDRN COCCOc1ccc(F)cc1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000066966440 1408967784 /nfs/dbraw/zinc/96/77/84/1408967784.db2.gz SMFDLRRMNYQIIA-GFCCVEGCSA-N 0 0 377.372 3.198 20 5 GGBDRN COc1cc(CNCc2cc(Cl)c3c(c2)OCCCO3)c([N+](=O)[O-])cc1O ZINC000066989661 1408973916 /nfs/dbraw/zinc/97/39/16/1408973916.db2.gz OKPFHQSXCZCXIJ-UHFFFAOYSA-N 0 0 394.811 3.414 20 5 GGBDRN CC(=O)Nc1cccc(-n2cnnc2SCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000067006988 1408978694 /nfs/dbraw/zinc/97/86/94/1408978694.db2.gz VLERWSGYMAFPOV-UHFFFAOYSA-N 0 0 399.432 3.305 20 5 GGBDRN CC(C)C(=O)Nc1ccc(CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000067014961 1408981520 /nfs/dbraw/zinc/98/15/20/1408981520.db2.gz JHKGMYCCJWOKJE-UHFFFAOYSA-N 0 0 389.383 3.024 20 5 GGBDRN C[C@H](OCCCNC(=O)COc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000067014621 1408981578 /nfs/dbraw/zinc/98/15/78/1408981578.db2.gz CFOGLEYGSOYCLK-AWEZNQCLSA-N 0 0 376.384 3.397 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000067014625 1408981720 /nfs/dbraw/zinc/98/17/20/1408981720.db2.gz DSLFRDAEXPUDPM-UHFFFAOYSA-N 0 0 398.394 3.232 20 5 GGBDRN O=C(Nc1ccccn1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000067014511 1408981760 /nfs/dbraw/zinc/98/17/60/1408981760.db2.gz LPDCAUJDWVOJQF-UHFFFAOYSA-N 0 0 395.341 3.363 20 5 GGBDRN COc1ccc(-c2noc(COc3ccc([N+](=O)[O-])c(F)c3)n2)cc1OC ZINC000067015125 1408981795 /nfs/dbraw/zinc/98/17/95/1408981795.db2.gz MCFCNYFJRKPBHG-UHFFFAOYSA-N 0 0 375.312 3.380 20 5 GGBDRN COc1ccc2nc(NC(=O)COc3ccc([N+](=O)[O-])c(F)c3)sc2c1 ZINC000067015803 1408982347 /nfs/dbraw/zinc/98/23/47/1408982347.db2.gz AIYSIKVUHCVPSV-UHFFFAOYSA-N 0 0 377.353 3.370 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1nc2ccccc2c(=O)[nH]1)C(C)C ZINC000067026041 1408984768 /nfs/dbraw/zinc/98/47/68/1408984768.db2.gz NREAIGBWBBQBDE-UHFFFAOYSA-N 0 0 380.404 3.191 20 5 GGBDRN CCCCN1C(=O)N[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)C(C(=O)OC)=C1C ZINC000067027812 1408985128 /nfs/dbraw/zinc/98/51/28/1408985128.db2.gz BSOQSPROTMETDX-HNNXBMFYSA-N 0 0 383.351 3.186 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(Cc2nc3ccccc3s2)CC1 ZINC000067026756 1408985336 /nfs/dbraw/zinc/98/53/36/1408985336.db2.gz PSBKYNXQMLBRBT-UHFFFAOYSA-N 0 0 396.472 3.471 20 5 GGBDRN CCOc1cc(NC(=O)c2cccc3c2OCCO3)c([N+](=O)[O-])cc1OCC ZINC000067031988 1408987857 /nfs/dbraw/zinc/98/78/57/1408987857.db2.gz CPVUMCXQOBAMDC-UHFFFAOYSA-N 0 0 388.376 3.416 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000067034858 1408988250 /nfs/dbraw/zinc/98/82/50/1408988250.db2.gz ZHMGESSDPCAOOW-CYBMUJFWSA-N 0 0 376.434 3.140 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000067053758 1408993460 /nfs/dbraw/zinc/99/34/60/1408993460.db2.gz NYBAZIUIFBJOBC-CALCHBBNSA-N 0 0 397.475 3.442 20 5 GGBDRN Cc1cccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2C)N2CCOCC2)c1 ZINC000067052432 1408993504 /nfs/dbraw/zinc/99/35/04/1408993504.db2.gz FDRPCPKTOUZNGP-HXUWFJFHSA-N 0 0 383.448 3.015 20 5 GGBDRN COCCOCc1cccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000067055127 1408993665 /nfs/dbraw/zinc/99/36/65/1408993665.db2.gz DSLGGZMLWXQDCJ-UHFFFAOYSA-N 0 0 396.403 3.196 20 5 GGBDRN CC(=O)Nc1cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)ccc1C ZINC000067054027 1408993775 /nfs/dbraw/zinc/99/37/75/1408993775.db2.gz GODHXRFHTPDGAK-UHFFFAOYSA-N 0 0 379.376 3.300 20 5 GGBDRN CCC(=O)Nc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000067054140 1408993835 /nfs/dbraw/zinc/99/38/35/1408993835.db2.gz VABJQIJLQXULOO-UHFFFAOYSA-N 0 0 379.376 3.381 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000067055496 1408993956 /nfs/dbraw/zinc/99/39/56/1408993956.db2.gz RJNYHQARXXWNNU-HNNXBMFYSA-N 0 0 382.420 3.098 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1Cl ZINC000067056766 1408994407 /nfs/dbraw/zinc/99/44/07/1408994407.db2.gz AKEVHLCYPNOUIO-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000067057183 1408994417 /nfs/dbraw/zinc/99/44/17/1408994417.db2.gz XOSKPIGKUDKZKJ-GJZGRUSLSA-N 0 0 397.431 3.405 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1C)c1cccc(OC)c1 ZINC000067055659 1408994422 /nfs/dbraw/zinc/99/44/22/1408994422.db2.gz AJUQJVUUWNGXOH-SFHVURJKSA-N 0 0 386.404 3.336 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000067057182 1408994531 /nfs/dbraw/zinc/99/45/31/1408994531.db2.gz XOSKPIGKUDKZKJ-HUUCEWRRSA-N 0 0 397.431 3.405 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1S(=O)(=O)NC(C)(C)C ZINC000067058887 1408994840 /nfs/dbraw/zinc/99/48/40/1408994840.db2.gz CNXQYMBLUQXOCL-UHFFFAOYSA-N 0 0 391.449 3.232 20 5 GGBDRN COCCCOc1ccccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067057728 1408994875 /nfs/dbraw/zinc/99/48/75/1408994875.db2.gz 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CCN1CCc2nc3ccccc3c(C(=O)NCc3cccc([N+](=O)[O-])c3)c2C1 ZINC000067071191 1409001146 /nfs/dbraw/zinc/00/11/46/1409001146.db2.gz JABFBVZZFSQKGI-UHFFFAOYSA-N 0 0 390.443 3.451 20 5 GGBDRN Cc1cc(-c2noc(CCC(=O)NCc3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000067072874 1409001674 /nfs/dbraw/zinc/00/16/74/1409001674.db2.gz MBRFHBZCFQXDRI-UHFFFAOYSA-N 0 0 384.367 3.341 20 5 GGBDRN Cn1cc(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067095404 1409008791 /nfs/dbraw/zinc/00/87/91/1409008791.db2.gz UIYINOTZJPZNHP-SJLPKXTDSA-N 0 0 380.379 3.420 20 5 GGBDRN CCN(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000067113695 1409011911 /nfs/dbraw/zinc/01/19/11/1409011911.db2.gz KYPCKNUTUKLDRV-GFCCVEGCSA-N 0 0 377.470 3.381 20 5 GGBDRN CC[C@H](NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)c1ccc(OC)cc1 ZINC000067133796 1409016698 /nfs/dbraw/zinc/01/66/98/1409016698.db2.gz DCCNRQJLFBZRMR-KRWDZBQOSA-N 0 0 381.392 3.065 20 5 GGBDRN Cc1cccc2sc(NC(=O)c3cn(-c4cccc([N+](=O)[O-])c4)nn3)nc21 ZINC000067134461 1409016709 /nfs/dbraw/zinc/01/67/09/1409016709.db2.gz WPZVNAOKZPWVSX-UHFFFAOYSA-N 0 0 380.389 3.346 20 5 GGBDRN Cc1ccc(SCCNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000067133948 1409016752 /nfs/dbraw/zinc/01/67/52/1409016752.db2.gz FAONXSFINSJBKA-UHFFFAOYSA-N 0 0 383.433 3.006 20 5 GGBDRN O=C(NCc1cccc(C(F)(F)F)c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067133518 1409016759 /nfs/dbraw/zinc/01/67/59/1409016759.db2.gz DDLUNVNBZBEEHN-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN CC(C)Oc1ccc([C@H](C)NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000067135951 1409018386 /nfs/dbraw/zinc/01/83/86/1409018386.db2.gz UICANRAOOSULCP-AWEZNQCLSA-N 0 0 395.419 3.454 20 5 GGBDRN CCc1c(C(=O)NCc2ccccc2[N+](=O)[O-])nnn1-c1cccc(Cl)c1 ZINC000067137737 1409018964 /nfs/dbraw/zinc/01/89/64/1409018964.db2.gz ODBVWXCFZNEFHZ-UHFFFAOYSA-N 0 0 385.811 3.321 20 5 GGBDRN C[C@H](NC(=O)CCNC(=O)N(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000067138066 1409018996 /nfs/dbraw/zinc/01/89/96/1409018996.db2.gz 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O=C(N[C@@H]1CCOc2c(Cl)cccc21)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067145854 1409021821 /nfs/dbraw/zinc/02/18/21/1409021821.db2.gz RQRJJHJUWPUULM-OAHLLOKOSA-N 0 0 399.794 3.083 20 5 GGBDRN CCOc1cccc([C@@H](C)NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1 ZINC000067149056 1409022463 /nfs/dbraw/zinc/02/24/63/1409022463.db2.gz UNGJGTWBNORYID-CYBMUJFWSA-N 0 0 381.392 3.065 20 5 GGBDRN CCS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc([N+](=O)[O-])ccc2F)c1 ZINC000067154104 1409024307 /nfs/dbraw/zinc/02/43/07/1409024307.db2.gz GELLZAWDKZKTTL-UHFFFAOYSA-N 0 0 386.788 3.433 20 5 GGBDRN C[C@@H](CC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)NC(=O)C1CCCCC1 ZINC000067157748 1409025923 /nfs/dbraw/zinc/02/59/23/1409025923.db2.gz WWZGQXNURHNXPN-ZDUSSCGKSA-N 0 0 399.451 3.399 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCCCC[C@@H]1c1ccncc1 ZINC000067165714 1409029941 /nfs/dbraw/zinc/02/99/41/1409029941.db2.gz TYTTWGWHJUEBIX-LJQANCHMSA-N 0 0 392.419 3.328 20 5 GGBDRN CCN(CC)c1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000067166025 1409030216 /nfs/dbraw/zinc/03/02/16/1409030216.db2.gz GFRZJKIGAJYIMB-UHFFFAOYSA-N 0 0 380.408 3.274 20 5 GGBDRN Cc1cccc(OC(F)F)c1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067167231 1409030937 /nfs/dbraw/zinc/03/09/37/1409030937.db2.gz WSDDHSCQLUNNEG-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCCC[C@@H]1Cc1ccccc1 ZINC000067167214 1409030971 /nfs/dbraw/zinc/03/09/71/1409030971.db2.gz FHCIAWKDSKFDJT-QGZVFWFLSA-N 0 0 391.431 3.413 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)s1 ZINC000067170589 1409031248 /nfs/dbraw/zinc/03/12/48/1409031248.db2.gz BATFEBZVQFCQRW-LLVKDONJSA-N 0 0 386.437 3.082 20 5 GGBDRN O=C(Oc1ccc(NC(=O)C2CC2)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067201968 1409039810 /nfs/dbraw/zinc/03/98/10/1409039810.db2.gz UDUXQXXOLJVMLM-UHFFFAOYSA-N 0 0 392.371 3.348 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1C ZINC000067210500 1409044487 /nfs/dbraw/zinc/04/44/87/1409044487.db2.gz SAKWPLTVPJNJBK-UHFFFAOYSA-N 0 0 377.422 3.226 20 5 GGBDRN CC(C)c1nnc(CN2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)o1 ZINC000067229141 1409048134 /nfs/dbraw/zinc/04/81/34/1409048134.db2.gz NAEAWGONDDHAFS-UHFFFAOYSA-N 0 0 399.373 3.442 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(CC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000067231810 1409048950 /nfs/dbraw/zinc/04/89/50/1409048950.db2.gz SOWQFSNTBVWNNB-UHFFFAOYSA-N 0 0 391.468 3.291 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](c2ccccc2)O1 ZINC000067234409 1409049750 /nfs/dbraw/zinc/04/97/50/1409049750.db2.gz QGCZHDWFDULFDV-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](c2ccccc2)O1 ZINC000067234406 1409050091 /nfs/dbraw/zinc/05/00/91/1409050091.db2.gz QGCZHDWFDULFDV-FOIQADDNSA-N 0 0 392.415 3.383 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000067237935 1409050555 /nfs/dbraw/zinc/05/05/55/1409050555.db2.gz BNTFERWFTFPVCM-CYBMUJFWSA-N 0 0 375.375 3.438 20 5 GGBDRN Cn1cccc1[C@H]1CCCCCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000067246742 1409051250 /nfs/dbraw/zinc/05/12/50/1409051250.db2.gz PFWPXNUTMYFQII-LJQANCHMSA-N 0 0 394.435 3.272 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccco2)cc1 ZINC000067288304 1409065071 /nfs/dbraw/zinc/06/50/71/1409065071.db2.gz JPGTULMZHMWKDT-UHFFFAOYSA-N 0 0 380.360 3.491 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)CNc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000067288268 1409065166 /nfs/dbraw/zinc/06/51/66/1409065166.db2.gz HBUROLYPYLDEGI-KRWDZBQOSA-N 0 0 385.420 3.388 20 5 GGBDRN O=C(c1cnc(-c2ccccc2)nc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000067289717 1409065211 /nfs/dbraw/zinc/06/52/11/1409065211.db2.gz MOVFXTIRGBVSST-UHFFFAOYSA-N 0 0 389.415 3.014 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1ccc(N2CCCCCC2)nc1 ZINC000067293976 1409066123 /nfs/dbraw/zinc/06/61/23/1409066123.db2.gz HDCXAYRLZIUIRJ-UHFFFAOYSA-N 0 0 383.452 3.099 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)Nc2cccc(C(F)(F)F)c2)cc([N+](=O)[O-])c1 ZINC000067295224 1409066725 /nfs/dbraw/zinc/06/67/25/1409066725.db2.gz AOWREWLZXYZKRO-UHFFFAOYSA-N 0 0 388.323 3.269 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2ccc(OC(F)F)c(OC)c2)c1 ZINC000067299526 1409067206 /nfs/dbraw/zinc/06/72/06/1409067206.db2.gz RRFLSARJVZSYQP-UHFFFAOYSA-N 0 0 396.346 3.486 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 ZINC000176590661 1428372677 /nfs/dbraw/zinc/37/26/77/1428372677.db2.gz AWFUCBLUCJZZKR-CQSZACIVSA-N 0 0 375.812 3.022 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(c2cccc(Cl)c2)C1 ZINC000176591830 1428373447 /nfs/dbraw/zinc/37/34/47/1428373447.db2.gz GCSRFSBJFAPAEL-OAHLLOKOSA-N 0 0 389.839 3.412 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)c1 ZINC000176593075 1428373627 /nfs/dbraw/zinc/37/36/27/1428373627.db2.gz ZPZQHNDYIZBAFD-CYBMUJFWSA-N 0 0 375.812 3.266 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)c1 ZINC000176593093 1428373852 /nfs/dbraw/zinc/37/38/52/1428373852.db2.gz ZPZQHNDYIZBAFD-ZDUSSCGKSA-N 0 0 375.812 3.266 20 5 GGBDRN O=C(c1ccccc1)C1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000067376219 1409091562 /nfs/dbraw/zinc/09/15/62/1409091562.db2.gz MXLWPBJFZHXGRS-HXUWFJFHSA-N 0 0 393.443 3.295 20 5 GGBDRN CC[C@H](C)Oc1cccc(NC(=O)C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000067377842 1409092698 /nfs/dbraw/zinc/09/26/98/1409092698.db2.gz RVHQTGFIMDUVPP-AWEZNQCLSA-N 0 0 385.420 3.070 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC(COc2ccccc2)CC1 ZINC000067398476 1409101665 /nfs/dbraw/zinc/10/16/65/1409101665.db2.gz SYFIXXVVSNBRGP-UHFFFAOYSA-N 0 0 397.431 3.159 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(NC(=O)NCc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000067411883 1409107900 /nfs/dbraw/zinc/10/79/00/1409107900.db2.gz HEEBNLYDUYQRSH-UHFFFAOYSA-N 0 0 396.447 3.007 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000067414749 1409108811 /nfs/dbraw/zinc/10/88/11/1409108811.db2.gz ICZUPSYXGRFTSM-AWEZNQCLSA-N 0 0 389.795 3.135 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000067414741 1409109336 /nfs/dbraw/zinc/10/93/36/1409109336.db2.gz NXSREXIZIQUEFA-CQSZACIVSA-N 0 0 389.795 3.135 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccccc1)CC1CCC1 ZINC000067443310 1409120053 /nfs/dbraw/zinc/12/00/53/1409120053.db2.gz IDBSGQOQFWETKH-UHFFFAOYSA-N 0 0 397.431 3.371 20 5 GGBDRN O=C1[C@@H](Nc2ccc3c(c2)CCCC(=O)N3)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067452523 1409122867 /nfs/dbraw/zinc/12/28/67/1409122867.db2.gz ULBQOSKDIAAQSV-SFHVURJKSA-N 0 0 380.404 3.087 20 5 GGBDRN CCN(CC(C)(C)O)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000176607297 1428378057 /nfs/dbraw/zinc/37/80/57/1428378057.db2.gz OGTQTEKDNYLEFB-AWEZNQCLSA-N 0 0 386.452 3.396 20 5 GGBDRN CCNc1ccc(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)cc1[N+](=O)[O-] ZINC000067523206 1409143232 /nfs/dbraw/zinc/14/32/32/1409143232.db2.gz QFTXIODVLPKNEV-UHFFFAOYSA-N 0 0 383.383 3.281 20 5 GGBDRN Cn1cc(C(=O)OCc2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)ccc1=O ZINC000176609100 1428378713 /nfs/dbraw/zinc/37/87/13/1428378713.db2.gz ZTTDTHOYVIFDIL-UHFFFAOYSA-N 0 0 380.356 3.443 20 5 GGBDRN O=C(NCc1ccc(NC(=O)c2ccco2)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000067527788 1409146973 /nfs/dbraw/zinc/14/69/73/1409146973.db2.gz CQUVCYPRJUPHFM-UHFFFAOYSA-N 0 0 394.387 3.440 20 5 GGBDRN CCCN1Cc2cccc(NC(=O)C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000067532490 1409148381 /nfs/dbraw/zinc/14/83/81/1409148381.db2.gz OBRCQAFYYVYLLT-CQSZACIVSA-N 0 0 396.447 3.136 20 5 GGBDRN COc1cc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000067536303 1409150765 /nfs/dbraw/zinc/15/07/65/1409150765.db2.gz VNMASYCVJOKQDF-UHFFFAOYSA-N 0 0 381.335 3.204 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000067536537 1409150778 /nfs/dbraw/zinc/15/07/78/1409150778.db2.gz KNPIFELMNMDWFO-KRWDZBQOSA-N 0 0 383.383 3.056 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000067536536 1409151035 /nfs/dbraw/zinc/15/10/35/1409151035.db2.gz KNPIFELMNMDWFO-QGZVFWFLSA-N 0 0 383.383 3.056 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000067536670 1409151043 /nfs/dbraw/zinc/15/10/43/1409151043.db2.gz HGNBYHOKRADCBL-UHFFFAOYSA-N 0 0 398.463 3.021 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NCc1cc(Cl)c2c(c1)OCCO2 ZINC000067536154 1409151256 /nfs/dbraw/zinc/15/12/56/1409151256.db2.gz RWNQVOIZRCAEQE-UHFFFAOYSA-N 0 0 377.784 3.019 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccc(C)cc1 ZINC000067538828 1409152158 /nfs/dbraw/zinc/15/21/58/1409152158.db2.gz KCXILCYCDFBGJZ-KRWDZBQOSA-N 0 0 376.434 3.188 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccc(F)cc1 ZINC000067540657 1409152757 /nfs/dbraw/zinc/15/27/57/1409152757.db2.gz NQMMTUWJQSUAKE-QGZVFWFLSA-N 0 0 394.424 3.265 20 5 GGBDRN CN(Cc1cccc2ccccc21)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000067545625 1409155022 /nfs/dbraw/zinc/15/50/22/1409155022.db2.gz DKAFBYDYVRIWHS-UHFFFAOYSA-N 0 0 398.440 3.424 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2ccc(OC)c(OC(F)F)c2)c1 ZINC000067547945 1409156118 /nfs/dbraw/zinc/15/61/18/1409156118.db2.gz QJSQEJNPVWSFEQ-UHFFFAOYSA-N 0 0 396.346 3.486 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCOc2ccc(C(F)(F)F)cc2)c1 ZINC000067549555 1409156572 /nfs/dbraw/zinc/15/65/72/1409156572.db2.gz CRHVQBOSPVDZGB-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c1 ZINC000067548680 1409156621 /nfs/dbraw/zinc/15/66/21/1409156621.db2.gz PTAJANMQCFWPNN-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)NCc2csc3ccccc23)cc([N+](=O)[O-])c1 ZINC000067549310 1409156840 /nfs/dbraw/zinc/15/68/40/1409156840.db2.gz QSGZZVJKFSQZHO-UHFFFAOYSA-N 0 0 390.442 3.143 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c1 ZINC000067549501 1409157032 /nfs/dbraw/zinc/15/70/32/1409157032.db2.gz DAONNVXHBBQZOP-GJZGRUSLSA-N 0 0 399.447 3.465 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c1 ZINC000067548926 1409157083 /nfs/dbraw/zinc/15/70/83/1409157083.db2.gz NCOZRUJDJZAOQA-GFCCVEGCSA-N 0 0 398.419 3.378 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1 ZINC000067556371 1409160339 /nfs/dbraw/zinc/16/03/39/1409160339.db2.gz WYLIZFFJICQDQS-MRXNPFEDSA-N 0 0 398.463 3.446 20 5 GGBDRN Cc1c(NC(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cccc1[N+](=O)[O-] ZINC000067558137 1409161629 /nfs/dbraw/zinc/16/16/29/1409161629.db2.gz FFBPQDSCUOWBKZ-SFHVURJKSA-N 0 0 398.419 3.342 20 5 GGBDRN CCOc1cc(NC(=O)N2CCC[C@H](OCC)C2)c([N+](=O)[O-])cc1OCC ZINC000067561555 1409163619 /nfs/dbraw/zinc/16/36/19/1409163619.db2.gz XLLJRAPDKFSNCW-ZDUSSCGKSA-N 0 0 381.429 3.425 20 5 GGBDRN COc1cc(NC(=O)NCc2cccc([N+](=O)[O-])c2)ccc1N1CCCC1=O ZINC000067663514 1409201432 /nfs/dbraw/zinc/20/14/32/1409201432.db2.gz PLVBWPOGSZPZEZ-UHFFFAOYSA-N 0 0 384.392 3.052 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1nnc2n1CCC2 ZINC000067677364 1409204549 /nfs/dbraw/zinc/20/45/49/1409204549.db2.gz JFSPQWVISXGRPP-ZDUSSCGKSA-N 0 0 392.419 3.367 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc(CCC(=O)N2CCCC2)cc1 ZINC000067680134 1409205382 /nfs/dbraw/zinc/20/53/82/1409205382.db2.gz KZJKBMRNIHKDHS-UHFFFAOYSA-N 0 0 396.447 3.472 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)CNc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000067708823 1409211971 /nfs/dbraw/zinc/21/19/71/1409211971.db2.gz QXVSCSNLXNZJEI-UHFFFAOYSA-N 0 0 384.436 3.029 20 5 GGBDRN Cc1cc(C(=O)NCCc2nc3ccccc3n2C(C)C)c(N)c([N+](=O)[O-])c1 ZINC000176624455 1428383514 /nfs/dbraw/zinc/38/35/14/1428383514.db2.gz UNXGGZZABFLWES-UHFFFAOYSA-N 0 0 381.436 3.389 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176624866 1428383582 /nfs/dbraw/zinc/38/35/82/1428383582.db2.gz ATKZVWHPLUSHJA-BZNIZROVSA-N 0 0 375.812 3.433 20 5 GGBDRN Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067723941 1409215364 /nfs/dbraw/zinc/21/53/64/1409215364.db2.gz GQADZPSXEQHKCP-UHFFFAOYSA-N 0 0 393.447 3.456 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000067725030 1409215588 /nfs/dbraw/zinc/21/55/88/1409215588.db2.gz OBOSJHNODSZUBB-QGZVFWFLSA-N 0 0 383.404 3.413 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)Sc2nncn2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000067751254 1409221462 /nfs/dbraw/zinc/22/14/62/1409221462.db2.gz SIFQVJAKJGUMMZ-JTQLQIEISA-N 0 0 379.442 3.069 20 5 GGBDRN CC(C)COc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000067752288 1409221738 /nfs/dbraw/zinc/22/17/38/1409221738.db2.gz DBULVQKKBOHYEZ-UHFFFAOYSA-N 0 0 392.433 3.285 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2N2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000067752647 1409221995 /nfs/dbraw/zinc/22/19/95/1409221995.db2.gz RMPKKYHBUXQQRK-OKILXGFUSA-N 0 0 385.420 3.469 20 5 GGBDRN Cc1cccc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000067753276 1409222542 /nfs/dbraw/zinc/22/25/42/1409222542.db2.gz FEEHMTJVIPRPDC-GOSISDBHSA-N 0 0 388.445 3.284 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1SC(F)(F)F ZINC000067766130 1409225164 /nfs/dbraw/zinc/22/51/64/1409225164.db2.gz FFWNQWVCXULCGH-UHFFFAOYSA-N 0 0 399.350 3.462 20 5 GGBDRN Cc1nc(-c2ccc(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3)cc2)cs1 ZINC000067766497 1409225261 /nfs/dbraw/zinc/22/52/61/1409225261.db2.gz YORHIPQLNPQWBT-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN CCCOc1ccc(Cl)cc1NC(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067766148 1409225407 /nfs/dbraw/zinc/22/54/07/1409225407.db2.gz HJEDLMKQDHKDHE-UHFFFAOYSA-N 0 0 391.811 3.292 20 5 GGBDRN CC[C@@H](C)Oc1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000176629109 1428384630 /nfs/dbraw/zinc/38/46/30/1428384630.db2.gz KCJRFOZSKGDCAZ-ZBFHGGJFSA-N 0 0 384.436 3.494 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000176628733 1428384835 /nfs/dbraw/zinc/38/48/35/1428384835.db2.gz CFOSVQWSKKDTKK-QHCPKHFHSA-N 0 0 397.250 3.025 20 5 GGBDRN C[S@@](=O)c1ccc(CNC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000176629333 1428384927 /nfs/dbraw/zinc/38/49/27/1428384927.db2.gz IVTUQGISQUQPEY-HSZRJFAPSA-N 0 0 397.250 3.025 20 5 GGBDRN CN(C)[C@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000067785763 1409231458 /nfs/dbraw/zinc/23/14/58/1409231458.db2.gz PQNSYQNQLOVACV-QGZVFWFLSA-N 0 0 391.855 3.436 20 5 GGBDRN COc1ccc([C@H](C)CC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000176628847 1428385098 /nfs/dbraw/zinc/38/50/98/1428385098.db2.gz CGOYHWCSVDCOJY-ZBFHGGJFSA-N 0 0 384.436 3.205 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(Cl)ccc2-n2cncn2)cc1[N+](=O)[O-] ZINC000067792956 1409232434 /nfs/dbraw/zinc/23/24/34/1409232434.db2.gz ILAMUXBZJKTMDX-UHFFFAOYSA-N 0 0 387.783 3.019 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-] ZINC000067793113 1409232501 /nfs/dbraw/zinc/23/25/01/1409232501.db2.gz OFNAKYXNGRSGHO-OAQYLSRUSA-N 0 0 377.400 3.447 20 5 GGBDRN COc1ccc(OC)c([C@@H](C)NC(=O)[C@@H](C)Sc2ncccc2[N+](=O)[O-])c1 ZINC000067807358 1409234768 /nfs/dbraw/zinc/23/47/68/1409234768.db2.gz FCRBPHOLNDFEDM-VXGBXAGGSA-N 0 0 391.449 3.365 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCc2sccc2[C@H]1c1ccccc1 ZINC000067807600 1409235204 /nfs/dbraw/zinc/23/52/04/1409235204.db2.gz URSOHCSEOSMBIJ-LJQANCHMSA-N 0 0 382.445 3.336 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(Cl)c2-n2cncn2)cc1[N+](=O)[O-] ZINC000067809537 1409236279 /nfs/dbraw/zinc/23/62/79/1409236279.db2.gz BCTPHXDUVDKHCZ-UHFFFAOYSA-N 0 0 387.783 3.019 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(C)nn2-c2ccccc2F)cc1[N+](=O)[O-] ZINC000067810998 1409236414 /nfs/dbraw/zinc/23/64/14/1409236414.db2.gz USXKWNMJSALKLR-UHFFFAOYSA-N 0 0 384.367 3.418 20 5 GGBDRN CCN(Cc1cccc(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1)C(C)=O ZINC000067811795 1409236588 /nfs/dbraw/zinc/23/65/88/1409236588.db2.gz ZQSLCXTVSRNCNU-UHFFFAOYSA-N 0 0 385.420 3.153 20 5 GGBDRN COc1ccc(Cn2nccc2NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000067812204 1409236654 /nfs/dbraw/zinc/23/66/54/1409236654.db2.gz GCMSKDXXQUIGGW-UHFFFAOYSA-N 0 0 396.403 3.038 20 5 GGBDRN COc1ccc(CC(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)cc1[N+](=O)[O-] ZINC000067815152 1409236677 /nfs/dbraw/zinc/23/66/77/1409236677.db2.gz PUDGVXNDYFAORN-UHFFFAOYSA-N 0 0 389.433 3.396 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(C)c2C(=O)N2CCCC2)cc1[N+](=O)[O-] ZINC000067814194 1409236759 /nfs/dbraw/zinc/23/67/59/1409236759.db2.gz HWDNGOSIFUIACA-UHFFFAOYSA-N 0 0 397.431 3.329 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000067812558 1409236839 /nfs/dbraw/zinc/23/68/39/1409236839.db2.gz IYBMIAAERIXOSX-UHFFFAOYSA-N 0 0 391.811 3.140 20 5 GGBDRN COc1ccc(CC(=O)NCCOc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000067817089 1409237146 /nfs/dbraw/zinc/23/71/46/1409237146.db2.gz XRFYEQIZSBSSOT-UHFFFAOYSA-N 0 0 380.400 3.494 20 5 GGBDRN COc1ccc(CC(=O)NCCOc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000067816139 1409237394 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ZINC000068264317 1409345037 /nfs/dbraw/zinc/34/50/37/1409345037.db2.gz LQJGZDYHCLTSII-UHFFFAOYSA-N 0 0 394.387 3.227 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(NC(N)=O)c1 ZINC000068265813 1409345714 /nfs/dbraw/zinc/34/57/14/1409345714.db2.gz IKJDHGYIHWBOJS-SECBINFHSA-N 0 0 378.772 3.145 20 5 GGBDRN COc1ccccc1OCCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000068265583 1409345929 /nfs/dbraw/zinc/34/59/29/1409345929.db2.gz CFRNIFPWWDTIRX-LBPRGKRZSA-N 0 0 394.811 3.219 20 5 GGBDRN Cc1nn(C)c2ncc(NC(=O)[C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])cc12 ZINC000068265977 1409346322 /nfs/dbraw/zinc/34/63/22/1409346322.db2.gz WTLTXJGDORDAHG-SNVBAGLBSA-N 0 0 389.799 3.244 20 5 GGBDRN Cn1c2ccccc2nc1[C@@H]1CCCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068269534 1409346989 /nfs/dbraw/zinc/34/69/89/1409346989.db2.gz FTMWDMJOVGCUHR-KRWDZBQOSA-N 0 0 390.403 3.335 20 5 GGBDRN CN(C)c1c(Cl)cccc1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000068285176 1409352521 /nfs/dbraw/zinc/35/25/21/1409352521.db2.gz PDYKWRLYABFHLJ-UHFFFAOYSA-N 0 0 377.784 3.144 20 5 GGBDRN Nc1ccc(C(=O)O[C@@H](Cn2cncn2)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000068284935 1409352643 /nfs/dbraw/zinc/35/26/43/1409352643.db2.gz WFBPQZFFBMDBLM-INIZCTEOSA-N 0 0 387.783 3.020 20 5 GGBDRN Cc1nc(CN2CCC(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cs1 ZINC000068288158 1409353896 /nfs/dbraw/zinc/35/38/96/1409353896.db2.gz JFCWVQVPCFHYIG-CYBMUJFWSA-N 0 0 388.493 3.449 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2nc3c(s2)CCCCC3)c([N+](=O)[O-])c1 ZINC000068291999 1409354640 /nfs/dbraw/zinc/35/46/40/1409354640.db2.gz VLHMZVYCUXRGBP-UHFFFAOYSA-N 0 0 375.406 3.150 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2c(F)cccc2N2CCCC2)cc([N+](=O)[O-])c1 ZINC000068299631 1409357012 /nfs/dbraw/zinc/35/70/12/1409357012.db2.gz SGWXXSAZQSLTDF-UHFFFAOYSA-N 0 0 387.367 3.373 20 5 GGBDRN Nc1c(Cl)cc(NC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])cc1Cl ZINC000068302677 1409357374 /nfs/dbraw/zinc/35/73/74/1409357374.db2.gz BMICXNLTLKEYDN-UHFFFAOYSA-N 0 0 384.175 3.314 20 5 GGBDRN COc1ccc(Cl)c(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000068331058 1409368912 /nfs/dbraw/zinc/36/89/12/1409368912.db2.gz YVXYFBCCDFIRLG-JTQLQIEISA-N 0 0 377.784 3.073 20 5 GGBDRN O=C(Nc1c(F)cccc1N1CCCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000068339607 1409372977 /nfs/dbraw/zinc/37/29/77/1409372977.db2.gz OGARLENLMYNBSF-UHFFFAOYSA-N 0 0 396.382 3.167 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000068343022 1409373550 /nfs/dbraw/zinc/37/35/50/1409373550.db2.gz UNXFTFLDOLIQHQ-GOSISDBHSA-N 0 0 399.472 3.294 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000068343021 1409373636 /nfs/dbraw/zinc/37/36/36/1409373636.db2.gz UNXFTFLDOLIQHQ-SFHVURJKSA-N 0 0 399.472 3.294 20 5 GGBDRN COc1cc(CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1O ZINC000068352726 1409376367 /nfs/dbraw/zinc/37/63/67/1409376367.db2.gz BNAVMEDJOQKMLA-JTQLQIEISA-N 0 0 380.784 3.046 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCOc2ccccc2C1 ZINC000068360577 1409378380 /nfs/dbraw/zinc/37/83/80/1409378380.db2.gz UNMOWTDEHCYKAK-LBPRGKRZSA-N 0 0 376.796 3.437 20 5 GGBDRN O=C(CCCc1ccc2c(c1)-c1ccccc1C2)OCCn1cnc([N+](=O)[O-])n1 ZINC000176673848 1428400233 /nfs/dbraw/zinc/40/02/33/1428400233.db2.gz TWNLWCVNSZHLPB-UHFFFAOYSA-N 0 0 392.415 3.324 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000068397088 1409390607 /nfs/dbraw/zinc/39/06/07/1409390607.db2.gz AXIQMVMZRYKAIP-UHFFFAOYSA-N 0 0 375.335 3.251 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000068412290 1409395031 /nfs/dbraw/zinc/39/50/31/1409395031.db2.gz PSGGRVARCWCCPI-GOSISDBHSA-N 0 0 385.420 3.131 20 5 GGBDRN O=C(NCc1ccsc1)c1ccc(I)c([N+](=O)[O-])c1 ZINC000068414818 1409395741 /nfs/dbraw/zinc/39/57/41/1409395741.db2.gz KDNIEFQHZHCQKV-UHFFFAOYSA-N 0 0 388.186 3.191 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCCCNc1ccccn1 ZINC000068422329 1409397421 /nfs/dbraw/zinc/39/74/21/1409397421.db2.gz XDKKTDNFNJHAFR-CYBMUJFWSA-N 0 0 392.843 3.419 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2cccc(OCc3cn4ccccc4n3)c2)c1[N+](=O)[O-] ZINC000068423652 1409398417 /nfs/dbraw/zinc/39/84/17/1409398417.db2.gz TVPLXZVEXUJQLS-UHFFFAOYSA-N 0 0 392.375 3.105 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000068429643 1409399917 /nfs/dbraw/zinc/39/99/17/1409399917.db2.gz AGRRJSLTMGSBQL-LBPRGKRZSA-N 0 0 398.419 3.395 20 5 GGBDRN C[C@@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1nc(C(C)(C)C)cs1 ZINC000068432170 1409401327 /nfs/dbraw/zinc/40/13/27/1409401327.db2.gz WOGHXIACXUZZRB-LLVKDONJSA-N 0 0 391.449 3.418 20 5 GGBDRN CCn1c(CCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)nc2ccccc21 ZINC000068467721 1409411642 /nfs/dbraw/zinc/41/16/42/1409411642.db2.gz ABYVYZVMPMUEFJ-UHFFFAOYSA-N 0 0 397.391 3.154 20 5 GGBDRN CC(C)N(C)c1cccc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000068479586 1409413012 /nfs/dbraw/zinc/41/30/12/1409413012.db2.gz YXNKPIAITFFTSY-CQSZACIVSA-N 0 0 384.436 3.196 20 5 GGBDRN COc1ccc2c(c1)CN(S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)CC2 ZINC000176678841 1428402771 /nfs/dbraw/zinc/40/27/71/1428402771.db2.gz IQUIKJXXRMHSPD-UHFFFAOYSA-N 0 0 396.852 3.312 20 5 GGBDRN Cc1nnc([C@H](C)OC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])o1 ZINC000068507793 1409421499 /nfs/dbraw/zinc/42/14/99/1409421499.db2.gz NQHRLYGLTGGZLI-QMMMGPOBSA-N 0 0 388.302 3.411 20 5 GGBDRN Cc1cc(C(=O)Nc2nc(CN3CCC(C)CC3)cs2)c(N)c([N+](=O)[O-])c1 ZINC000068511784 1409422822 /nfs/dbraw/zinc/42/28/22/1409422822.db2.gz BMOCKCCJXVQLAI-UHFFFAOYSA-N 0 0 389.481 3.426 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c(N)c([N+](=O)[O-])c1 ZINC000068513884 1409423399 /nfs/dbraw/zinc/42/33/99/1409423399.db2.gz UGSSDMUQRDBSEL-UHFFFAOYSA-N 0 0 391.387 3.385 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)c1cc(OC)ccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000068515703 1409424616 /nfs/dbraw/zinc/42/46/16/1409424616.db2.gz VRBREFONJCDDGV-INIZCTEOSA-N 0 0 390.367 3.167 20 5 GGBDRN COc1cccc(-c2c[nH]cc2C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000068519285 1409425185 /nfs/dbraw/zinc/42/51/85/1409425185.db2.gz NIGQIDOAKQLCHB-UHFFFAOYSA-N 0 0 381.388 3.407 20 5 GGBDRN COc1ccc2cc(C(=O)NCCOc3ccc([N+](=O)[O-])cc3)c(C)nc2c1 ZINC000068520036 1409425287 /nfs/dbraw/zinc/42/52/87/1409425287.db2.gz GRZGLGJXKJUWHA-UHFFFAOYSA-N 0 0 381.388 3.269 20 5 GGBDRN O=C(CCC(=O)c1ccc(F)cc1F)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068519963 1409425311 /nfs/dbraw/zinc/42/53/11/1409425311.db2.gz WZLOFZHJRFWXAK-UHFFFAOYSA-N 0 0 378.331 3.031 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21 ZINC000068534488 1409430057 /nfs/dbraw/zinc/43/00/57/1409430057.db2.gz VONHGNDJLKCATO-LJQANCHMSA-N 0 0 395.415 3.015 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)OC(C)(C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000068538166 1409431663 /nfs/dbraw/zinc/43/16/63/1409431663.db2.gz CYOUWHASOAMCCJ-ZDUSSCGKSA-N 0 0 386.452 3.096 20 5 GGBDRN Cc1cc(F)ccc1-c1ccc(C(=O)OCCn2cnc([N+](=O)[O-])n2)cc1F ZINC000176682953 1428405203 /nfs/dbraw/zinc/40/52/03/1428405203.db2.gz WFSQSWPPXWCMTA-UHFFFAOYSA-N 0 0 388.330 3.297 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(N3CCCCCC3)nc2)c(N)c([N+](=O)[O-])c1 ZINC000068548798 1409435528 /nfs/dbraw/zinc/43/55/28/1409435528.db2.gz RZGKGNWBUGWVLP-UHFFFAOYSA-N 0 0 383.452 3.191 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000176682427 1428403957 /nfs/dbraw/zinc/40/39/57/1428403957.db2.gz GDPKXXZXSAWVER-SFHVURJKSA-N 0 0 398.394 3.210 20 5 GGBDRN CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000176682411 1428403988 /nfs/dbraw/zinc/40/39/88/1428403988.db2.gz GDPKXXZXSAWVER-GOSISDBHSA-N 0 0 398.394 3.210 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)cn21 ZINC000068570430 1409442033 /nfs/dbraw/zinc/44/20/33/1409442033.db2.gz OGPISHRFLIQRJQ-UHFFFAOYSA-N 0 0 379.420 3.081 20 5 GGBDRN Cc1noc([C@H](OC(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000176681261 1428404427 /nfs/dbraw/zinc/40/44/27/1428404427.db2.gz AKPVKPQXNXOALW-GOSISDBHSA-N 0 0 382.376 3.421 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@H]2CSCCS2)CC1 ZINC000176672098 1428399663 /nfs/dbraw/zinc/39/96/63/1428399663.db2.gz ULJAUTZOVXEXAO-HNNXBMFYSA-N 0 0 395.550 3.410 20 5 GGBDRN COc1ccc(C(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000068653852 1409456607 /nfs/dbraw/zinc/45/66/07/1409456607.db2.gz ZKDMAJLPQJMVQU-CYBMUJFWSA-N 0 0 383.404 3.221 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000068656579 1409458289 /nfs/dbraw/zinc/45/82/89/1409458289.db2.gz WAPRQDWUOWMPKJ-HNNXBMFYSA-N 0 0 397.431 3.368 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Oc2cccc(F)c2F)ccc1[N+](=O)[O-] ZINC000068679911 1409467312 /nfs/dbraw/zinc/46/73/12/1409467312.db2.gz OFYRZFSNISZZFH-OAHLLOKOSA-N 0 0 390.342 3.392 20 5 GGBDRN CCC[C@@H](Cc1ccccc1)NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000068707650 1409472561 /nfs/dbraw/zinc/47/25/61/1409472561.db2.gz OULVSHXXPOHWHF-HNNXBMFYSA-N 0 0 383.404 3.030 20 5 GGBDRN CCCC[C@H]1CCC[C@@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000068712657 1409474207 /nfs/dbraw/zinc/47/42/07/1409474207.db2.gz LBJCVIZTCDHXBB-JSGCOSHPSA-N 0 0 379.482 3.261 20 5 GGBDRN CCCC[C@@H]1CCC[C@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000068712660 1409474284 /nfs/dbraw/zinc/47/42/84/1409474284.db2.gz LBJCVIZTCDHXBB-TZMCWYRMSA-N 0 0 379.482 3.261 20 5 GGBDRN CC(C)CC[C@@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000068713215 1409474801 /nfs/dbraw/zinc/47/48/01/1409474801.db2.gz XBMFPKZZKCIKTA-SUMWQHHRSA-N 0 0 382.482 3.333 20 5 GGBDRN CC(C)CC[C@H]1CCC[C@@H]1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000068715725 1409475911 /nfs/dbraw/zinc/47/59/11/1409475911.db2.gz UQHVAEABKDVBPT-HIFRSBDPSA-N 0 0 382.482 3.333 20 5 GGBDRN CC(C)CC[C@H]1CCC[C@H]1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000068715729 1409476045 /nfs/dbraw/zinc/47/60/45/1409476045.db2.gz UQHVAEABKDVBPT-UKRRQHHQSA-N 0 0 382.482 3.333 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1cccc(N2CCOC2=O)c1 ZINC000068721081 1409478799 /nfs/dbraw/zinc/47/87/99/1409478799.db2.gz NGEYCGLEXFTGLO-ZDUSSCGKSA-N 0 0 384.392 3.112 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)CCc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000068732165 1409481515 /nfs/dbraw/zinc/48/15/15/1409481515.db2.gz MYXJWLGEBJZYST-KRWDZBQOSA-N 0 0 385.420 3.122 20 5 GGBDRN C[C@H](OC[C@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000068765308 1409487994 /nfs/dbraw/zinc/48/79/94/1409487994.db2.gz BOMORPLADKCOCT-WMLDXEAASA-N 0 0 398.415 3.348 20 5 GGBDRN Cc1cccc2nc(CNc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)cn21 ZINC000068772551 1409488622 /nfs/dbraw/zinc/48/86/22/1409488622.db2.gz OIKHPTAEXSWVEK-UHFFFAOYSA-N 0 0 379.420 3.399 20 5 GGBDRN COc1cc(OCC(=O)N(C)[C@@H](C)c2cc(F)ccc2F)ccc1[N+](=O)[O-] ZINC000068788311 1409492994 /nfs/dbraw/zinc/49/29/94/1409492994.db2.gz HNSTWDVTTNCAKF-NSHDSACASA-N 0 0 380.347 3.480 20 5 GGBDRN COc1cc(OCC(=O)Nc2cccc(-n3nc(C)cc3C)c2)ccc1[N+](=O)[O-] ZINC000068789980 1409493087 /nfs/dbraw/zinc/49/30/87/1409493087.db2.gz AXRUUQYAHNNOSY-UHFFFAOYSA-N 0 0 396.403 3.423 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)Nc3ccc(N(C)C)cn3)cc2)c(C)c1[N+](=O)[O-] ZINC000068805661 1409496129 /nfs/dbraw/zinc/49/61/29/1409496129.db2.gz IGAXEOGZCSKMQV-UHFFFAOYSA-N 0 0 394.435 3.170 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000068815385 1409497861 /nfs/dbraw/zinc/49/78/61/1409497861.db2.gz PNZNOKPMUPFGBK-KSSFIOAISA-N 0 0 397.431 3.085 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@@H](C)CC1 ZINC000068822425 1409500288 /nfs/dbraw/zinc/50/02/88/1409500288.db2.gz VSKSASJTBMUESR-PBHICJAKSA-N 0 0 393.509 3.095 20 5 GGBDRN CCOc1cccc([C@@H](C)Nc2ccc(S(=O)(=O)NC)cc2[N+](=O)[O-])c1 ZINC000068824070 1409500932 /nfs/dbraw/zinc/50/09/32/1409500932.db2.gz QSTUOHADPAZJGU-GFCCVEGCSA-N 0 0 379.438 3.075 20 5 GGBDRN C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000176689240 1428408996 /nfs/dbraw/zinc/40/89/96/1428408996.db2.gz KZQUQJDTIHKTFX-DGCLKSJQSA-N 0 0 379.482 3.117 20 5 GGBDRN COc1cc(OCC(=O)N2CCCCC[C@@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000068847635 1409507253 /nfs/dbraw/zinc/50/72/53/1409507253.db2.gz JUHKPGXLKCIJDT-QGZVFWFLSA-N 0 0 387.436 3.465 20 5 GGBDRN COc1cc(OCC(=O)N(Cc2ccco2)Cc2ccco2)ccc1[N+](=O)[O-] ZINC000068852972 1409507832 /nfs/dbraw/zinc/50/78/32/1409507832.db2.gz VRFQYGHHVUOCQB-UHFFFAOYSA-N 0 0 386.360 3.397 20 5 GGBDRN CCOc1cc(C(=O)N2CCN(C)c3ccccc3C2)c([N+](=O)[O-])cc1OC ZINC000068862211 1409509727 /nfs/dbraw/zinc/50/97/27/1409509727.db2.gz NZVBINBKKQVIQP-UHFFFAOYSA-N 0 0 385.420 3.094 20 5 GGBDRN CC(C)c1ccc(-c2nc(C(=O)OCCn3cnc([N+](=O)[O-])n3)cs2)cc1 ZINC000176691187 1428410472 /nfs/dbraw/zinc/41/04/72/1428410472.db2.gz MJRFJZYCKONSRW-UHFFFAOYSA-N 0 0 387.421 3.290 20 5 GGBDRN CCc1nc(CCNS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)cs1 ZINC000176690338 1428410534 /nfs/dbraw/zinc/41/05/34/1428410534.db2.gz WNNCROIFFLSVEB-UHFFFAOYSA-N 0 0 389.886 3.097 20 5 GGBDRN Cc1ccc(N(C(C)C)S(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000068919756 1409524682 /nfs/dbraw/zinc/52/46/82/1409524682.db2.gz DXXRIVAFBDZKHK-UHFFFAOYSA-N 0 0 392.433 3.278 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccc(NC(C)=O)cc2Cl)c([N+](=O)[O-])c1 ZINC000068923802 1409525070 /nfs/dbraw/zinc/52/50/70/1409525070.db2.gz ZRANOVHNHTZSSV-UHFFFAOYSA-N 0 0 392.799 3.266 20 5 GGBDRN O=[N+]([O-])c1cc(NCc2nnnn2-c2ccccc2Br)ccc1F ZINC000068923329 1409525122 /nfs/dbraw/zinc/52/51/22/1409525122.db2.gz PGHJMRXBGYTLOS-UHFFFAOYSA-N 0 0 393.176 3.084 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)c1 ZINC000068928366 1409526308 /nfs/dbraw/zinc/52/63/08/1409526308.db2.gz PFARTKJOWSRZIT-LBPRGKRZSA-N 0 0 391.374 3.138 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000068927405 1409526319 /nfs/dbraw/zinc/52/63/19/1409526319.db2.gz BWOABQYEFYPPBJ-UHFFFAOYSA-N 0 0 388.355 3.497 20 5 GGBDRN O=C(NC[C@H]1CCN(c2ccc(F)c(F)c2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000068928440 1409526444 /nfs/dbraw/zinc/52/64/44/1409526444.db2.gz UNYJKLJUNMNLLB-LLVKDONJSA-N 0 0 379.338 3.268 20 5 GGBDRN COc1ccc(C(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)cc1[N+](=O)[O-] ZINC000068929175 1409527381 /nfs/dbraw/zinc/52/73/81/1409527381.db2.gz VWJWJCRCTQYSDK-GFCCVEGCSA-N 0 0 391.374 3.138 20 5 GGBDRN O=C(Nc1ccc(Cl)cc1)N1CCCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 ZINC000068935993 1409529579 /nfs/dbraw/zinc/52/95/79/1409529579.db2.gz WNNSYGXZPQSKNL-UHFFFAOYSA-N 0 0 392.799 3.221 20 5 GGBDRN Cc1noc([C@H]2CCCN(Cn3c4cc([N+](=O)[O-])ccc4oc3=S)C2)n1 ZINC000068962357 1409533229 /nfs/dbraw/zinc/53/32/29/1409533229.db2.gz RUZLESWJXZEEOQ-NSHDSACASA-N 0 0 375.410 3.401 20 5 GGBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000068996943 1409540062 /nfs/dbraw/zinc/54/00/62/1409540062.db2.gz SQMGFICFCNKCHA-LBPRGKRZSA-N 0 0 386.383 3.360 20 5 GGBDRN COc1cc(NC(=O)CNc2cc([N+](=O)[O-])ccc2F)c(OC)cc1Cl ZINC000069002071 1409541136 /nfs/dbraw/zinc/54/11/36/1409541136.db2.gz QWKCYDKLGGEHFM-UHFFFAOYSA-N 0 0 383.763 3.455 20 5 GGBDRN CCN(C[C@@H]1COc2ccccc2O1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000069009764 1409543514 /nfs/dbraw/zinc/54/35/14/1409543514.db2.gz NNTFEJCFFTUBCE-OAHLLOKOSA-N 0 0 388.445 3.375 20 5 GGBDRN Cc1c(CN2CCN(C(=O)c3c(F)cccc3F)CC2)cccc1[N+](=O)[O-] ZINC000069025552 1409546105 /nfs/dbraw/zinc/54/61/05/1409546105.db2.gz PELXPLIWJWFAJI-UHFFFAOYSA-N 0 0 375.375 3.139 20 5 GGBDRN O=C(OCc1coc(-c2ccccc2)n1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000069041558 1409551331 /nfs/dbraw/zinc/55/13/31/1409551331.db2.gz DVHGSYTWWUDKJD-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN COc1ccc([C@H](NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000069042501 1409551393 /nfs/dbraw/zinc/55/13/93/1409551393.db2.gz JPHLHDQHGGOAOY-LJQANCHMSA-N 0 0 385.420 3.433 20 5 GGBDRN O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1Cl)Nc1ccc(F)c(F)c1F ZINC000069083932 1409559870 /nfs/dbraw/zinc/55/98/70/1409559870.db2.gz FNVIUVTYGGFNRF-UHFFFAOYSA-N 0 0 387.701 3.034 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000069085214 1409560508 /nfs/dbraw/zinc/56/05/08/1409560508.db2.gz OWGDHVMXIJCNED-SFHVURJKSA-N 0 0 381.432 3.330 20 5 GGBDRN C[C@H]1Sc2ccccc2N(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@@H]1C ZINC000176694460 1428413457 /nfs/dbraw/zinc/41/34/57/1428413457.db2.gz RBHDJZCUOBGGBK-VXGBXAGGSA-N 0 0 399.428 3.419 20 5 GGBDRN Cc1csc(CCCCNC(=O)NCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000069108065 1409566778 /nfs/dbraw/zinc/56/67/78/1409566778.db2.gz LMHXMCSPIVRNTP-UHFFFAOYSA-N 0 0 378.454 3.061 20 5 GGBDRN CC(C)(C)c1csc(CNC(=O)NCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000069111482 1409568665 /nfs/dbraw/zinc/56/86/65/1409568665.db2.gz ORMFGIJWOPMLSV-UHFFFAOYSA-N 0 0 378.454 3.227 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](Nc2ccccc2)C1 ZINC000069122299 1409572390 /nfs/dbraw/zinc/57/23/90/1409572390.db2.gz RUDAXARQJVAOKG-INIZCTEOSA-N 0 0 375.450 3.032 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[C@H](Nc3ccccc3)C2)cc1C ZINC000069122255 1409572446 /nfs/dbraw/zinc/57/24/46/1409572446.db2.gz WYDIEQXZVFBBOD-INIZCTEOSA-N 0 0 375.450 3.087 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](c1nc(C2CC2)no1)C(C)C ZINC000069128315 1409573009 /nfs/dbraw/zinc/57/30/09/1409573009.db2.gz URRYRZKPOCOONJ-OAHLLOKOSA-N 0 0 394.453 3.093 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000069130518 1409573807 /nfs/dbraw/zinc/57/38/07/1409573807.db2.gz OFEPPHNYDLIURZ-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)N1CC=C(c2ccc(O)cc2)CC1 ZINC000069149461 1409575705 /nfs/dbraw/zinc/57/57/05/1409575705.db2.gz KWXVMCWVCGWTBQ-UHFFFAOYSA-N 0 0 383.404 3.178 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CS(C)(=O)=O)cc1 ZINC000069190839 1409584007 /nfs/dbraw/zinc/58/40/07/1409584007.db2.gz SMKIIGQFUPETPR-GFCCVEGCSA-N 0 0 394.474 3.259 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000069197456 1409584078 /nfs/dbraw/zinc/58/40/78/1409584078.db2.gz UOLSLVIZZNODQP-SNVBAGLBSA-N 0 0 377.784 3.014 20 5 GGBDRN 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1409625637 /nfs/dbraw/zinc/62/56/37/1409625637.db2.gz KRVOVEOYILDPGC-UHFFFAOYSA-N 0 0 377.404 3.285 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCN(C(=O)C2CCCCC2)CC1 ZINC000069395711 1409627253 /nfs/dbraw/zinc/62/72/53/1409627253.db2.gz HAKJBAZDBXKXCR-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCCn1cnc([N+](=O)[O-])n1 ZINC000176699516 1428417480 /nfs/dbraw/zinc/41/74/80/1428417480.db2.gz VAJCTJRXKSMUIH-UHFFFAOYSA-N 0 0 393.812 3.129 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2nc(CN3CCC(C)CC3)cs2)c1[N+](=O)[O-] ZINC000069443376 1409635570 /nfs/dbraw/zinc/63/55/70/1409635570.db2.gz VFNBXXXSMYAFRC-UHFFFAOYSA-N 0 0 392.485 3.211 20 5 GGBDRN O=C(OCCn1cnc([N+](=O)[O-])n1)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000176699301 1428418153 /nfs/dbraw/zinc/41/81/53/1428418153.db2.gz BRLBBCJPKLUVDS-OLZOCXBDSA-N 0 0 399.432 3.089 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000069524584 1409649103 /nfs/dbraw/zinc/64/91/03/1409649103.db2.gz HKCXUCMTUZTXAX-UHFFFAOYSA-N 0 0 391.449 3.232 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000069551952 1409652505 /nfs/dbraw/zinc/65/25/05/1409652505.db2.gz GESCOVVNVGUQEC-UHFFFAOYSA-N 0 0 398.202 3.035 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cccc(CN3CCOCC3)c2)c1 ZINC000069585144 1409657201 /nfs/dbraw/zinc/65/72/01/1409657201.db2.gz YHFQBVWMBZCZJU-UHFFFAOYSA-N 0 0 399.447 3.143 20 5 GGBDRN COCCn1ncc2ccc(NC(=O)CCOc3cc(C)ccc3[N+](=O)[O-])cc21 ZINC000069585165 1409657231 /nfs/dbraw/zinc/65/72/31/1409657231.db2.gz JSKREZAAJJYDPF-UHFFFAOYSA-N 0 0 398.419 3.307 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@@H]1CCCN1C(=O)c1cccs1 ZINC000176702996 1428420353 /nfs/dbraw/zinc/42/03/53/1428420353.db2.gz FBHFQVJVJJKBLM-HNNXBMFYSA-N 0 0 396.428 3.448 20 5 GGBDRN CN(C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc2ccccc2c1 ZINC000069612385 1409662506 /nfs/dbraw/zinc/66/25/06/1409662506.db2.gz OWWSUEMPJPZSHL-UHFFFAOYSA-N 0 0 377.356 3.319 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc(CS(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000069617879 1409664357 /nfs/dbraw/zinc/66/43/57/1409664357.db2.gz FRWCDTIYUSPQAS-GFCCVEGCSA-N 0 0 377.422 3.022 20 5 GGBDRN CCOc1cc(NC(=O)N[C@@H](C)c2cn(C)nc2C)c([N+](=O)[O-])cc1OCC ZINC000069621185 1409665111 /nfs/dbraw/zinc/66/51/11/1409665111.db2.gz LVWCAINGKWNAKZ-NSHDSACASA-N 0 0 391.428 3.317 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(-c2nccs2)cc1 ZINC000069640382 1409666573 /nfs/dbraw/zinc/66/65/73/1409666573.db2.gz RVJQQHSXACELGP-UHFFFAOYSA-N 0 0 396.384 3.265 20 5 GGBDRN CCOc1ccc([C@H]2CCCN2C(=O)COc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000176704252 1428421041 /nfs/dbraw/zinc/42/10/41/1428421041.db2.gz IJVUINYXHKUIOM-QGZVFWFLSA-N 0 0 385.420 3.439 20 5 GGBDRN CC(=O)N[C@@H](C)CCc1ccc(C(=O)COc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000176703085 1428421512 /nfs/dbraw/zinc/42/15/12/1428421512.db2.gz ACITVGVARFJEAC-AWEZNQCLSA-N 0 0 385.420 3.017 20 5 GGBDRN C[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1cc(Cl)ccc1OC(F)F 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PFKBWMNKRVPHNS-CYBMUJFWSA-N 0 0 387.461 3.316 20 5 GGBDRN CC(=O)N1CCc2cc(C(=O)Nc3ccc4cc([N+](=O)[O-])ccc4n3)ccc21 ZINC000176710932 1428425596 /nfs/dbraw/zinc/42/55/96/1428425596.db2.gz RQYFCXDLEAJITR-UHFFFAOYSA-N 0 0 376.372 3.304 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccccc2S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000176711823 1428426379 /nfs/dbraw/zinc/42/63/79/1428426379.db2.gz MFJGJDLJHHWYEM-LBPRGKRZSA-N 0 0 377.422 3.189 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccccc2S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000176711806 1428426745 /nfs/dbraw/zinc/42/67/45/1428426745.db2.gz MFJGJDLJHHWYEM-GFCCVEGCSA-N 0 0 377.422 3.189 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@H]1CC(c2cccc(F)c2)=NO1 ZINC000176711542 1428426774 /nfs/dbraw/zinc/42/67/74/1428426774.db2.gz JTNVWVCBHSQLSR-QGZVFWFLSA-N 0 0 380.335 3.414 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000176711841 1428426803 /nfs/dbraw/zinc/42/68/03/1428426803.db2.gz ZVOTUOHQSTWDHE-HIFRSBDPSA-N 0 0 384.436 3.366 20 5 GGBDRN CC1(C)CCCN(S(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])C1 ZINC000070259910 1409745951 /nfs/dbraw/zinc/74/59/51/1409745951.db2.gz MBOADFMHKLBOKR-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN COc1ccc2c(c1)OC[C@H](C(=O)Nc1ccc3cc([N+](=O)[O-])ccc3n1)C2 ZINC000176711771 1428426941 /nfs/dbraw/zinc/42/69/41/1428426941.db2.gz BDFZHTRTIYBIKU-CQSZACIVSA-N 0 0 379.372 3.341 20 5 GGBDRN O=C(NCC1(N2CCOCC2)CCCCC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000070670890 1409748786 /nfs/dbraw/zinc/74/87/86/1409748786.db2.gz VAJVDFACFVYFHM-UHFFFAOYSA-N 0 0 381.860 3.013 20 5 GGBDRN CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000070688176 1409751512 /nfs/dbraw/zinc/75/15/12/1409751512.db2.gz JGVIUTDEIZAVOR-HNNXBMFYSA-N 0 0 386.404 3.296 20 5 GGBDRN CCOc1ccc(NC(=O)CN2C[C@@H](c3ccccc3)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000070695088 1409752980 /nfs/dbraw/zinc/75/29/80/1409752980.db2.gz POERGRRBINCQKV-YWZLYKJASA-N 0 0 399.447 3.394 20 5 GGBDRN CCc1nc(CN(C)[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cs1 ZINC000070697150 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CS(=O)(=O)c1cc(C(=O)NC2(c3ccccc3)CCCC2)cc([N+](=O)[O-])c1 ZINC000070955345 1409805992 /nfs/dbraw/zinc/80/59/92/1409805992.db2.gz PVUYXNCKBJAVAP-UHFFFAOYSA-N 0 0 388.445 3.198 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(CCc1cccc(F)c1)C1CC1 ZINC000070958352 1409806256 /nfs/dbraw/zinc/80/62/56/1409806256.db2.gz UEOHJKTWGKORES-UHFFFAOYSA-N 0 0 395.394 3.162 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N(CCc1cccc(F)c1)C1CC1 ZINC000070957678 1409806439 /nfs/dbraw/zinc/80/64/39/1409806439.db2.gz UGEXFGLTNXFJSP-UHFFFAOYSA-N 0 0 386.379 3.352 20 5 GGBDRN CC(C)C[C@H]1COCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000071042923 1409815438 /nfs/dbraw/zinc/81/54/38/1409815438.db2.gz HVDPEROXPFCVCN-KRWDZBQOSA-N 0 0 378.472 3.428 20 5 GGBDRN CC(C)C[C@@H]1COCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000071042917 1409815554 /nfs/dbraw/zinc/81/55/54/1409815554.db2.gz HVDPEROXPFCVCN-QGZVFWFLSA-N 0 0 378.472 3.428 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(OC)cc1 ZINC000071049918 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380.404 3.011 20 5 GGBDRN Cc1cccc(OC[C@@H](O)CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000176721844 1428433801 /nfs/dbraw/zinc/43/38/01/1428433801.db2.gz JBMMVFANWNEZSB-RDJZCZTQSA-N 0 0 387.436 3.012 20 5 GGBDRN Cc1nnnn1-c1cccc(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000176722185 1428433862 /nfs/dbraw/zinc/43/38/62/1428433862.db2.gz YLUOJKGJZCJWOB-GFCCVEGCSA-N 0 0 381.396 3.070 20 5 GGBDRN CC(C)NC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1 ZINC000072009261 1409836771 /nfs/dbraw/zinc/83/67/71/1409836771.db2.gz LYJYYPORALVGAN-UHFFFAOYSA-N 0 0 399.451 3.121 20 5 GGBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)N(C)c1ccccc1 ZINC000072009694 1409836780 /nfs/dbraw/zinc/83/67/80/1409836780.db2.gz LXFYYNQFFKKALF-MRXNPFEDSA-N 0 0 382.464 3.450 20 5 GGBDRN Cc1cccc(OC[C@@H](O)CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000176721871 1428433933 /nfs/dbraw/zinc/43/39/33/1428433933.db2.gz JBMMVFANWNEZSB-WBVHZDCISA-N 0 0 387.436 3.012 20 5 GGBDRN Cc1cccc(CCCOC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n1 ZINC000072016483 1409837866 /nfs/dbraw/zinc/83/78/66/1409837866.db2.gz VCOBQXTVDGGSCF-UHFFFAOYSA-N 0 0 380.404 3.488 20 5 GGBDRN Cc1c(NC(=O)[C@H](C(C)C)n2nnc(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000072016729 1409837958 /nfs/dbraw/zinc/83/79/58/1409837958.db2.gz AWOLSUGBUKZZJI-KRWDZBQOSA-N 0 0 380.408 3.393 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCc1cccc([N+](=O)[O-])c1 ZINC000176721455 1428434048 /nfs/dbraw/zinc/43/40/48/1428434048.db2.gz KLTKSBZSZRMJAI-IBGZPJMESA-N 0 0 399.378 3.006 20 5 GGBDRN O=C(Nc1cccc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1)[C@H]1CCCO1 ZINC000072036896 1409839660 /nfs/dbraw/zinc/83/96/60/1409839660.db2.gz SLTACQBRQMIGDV-QGZVFWFLSA-N 0 0 386.364 3.233 20 5 GGBDRN C[C@H]1Cc2ccccc2N1CCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000072045599 1409841155 /nfs/dbraw/zinc/84/11/55/1409841155.db2.gz OUEAENOLKJWYRB-INIZCTEOSA-N 0 0 382.464 3.354 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1 ZINC000072052887 1409841878 /nfs/dbraw/zinc/84/18/78/1409841878.db2.gz UULCHGVWVPCKEF-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN CCCCCCNC(=O)[C@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000072051650 1409841959 /nfs/dbraw/zinc/84/19/59/1409841959.db2.gz ZRHFLSNGEFECCB-KRWDZBQOSA-N 0 0 375.469 3.072 20 5 GGBDRN CC(C)COC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000072066913 1409844407 /nfs/dbraw/zinc/84/44/07/1409844407.db2.gz SSULKYHTXCMLQP-UHFFFAOYSA-N 0 0 383.832 3.189 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000072069788 1409844796 /nfs/dbraw/zinc/84/47/96/1409844796.db2.gz LCFQFFBSQLYHPU-YCABEKBOSA-N 0 0 389.452 3.371 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1OS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000072074204 1409846097 /nfs/dbraw/zinc/84/60/97/1409846097.db2.gz FMIIDNYZMFSDRM-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)Oc1ccc(F)c(F)c1 ZINC000072097442 1409848543 /nfs/dbraw/zinc/84/85/43/1409848543.db2.gz FNUPWQQNGASETP-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)C1=NN(Cc2ccccc2)C(=O)CC1 ZINC000072094286 1409848547 /nfs/dbraw/zinc/84/85/47/1409848547.db2.gz XXPMZVHCZLOMOR-UHFFFAOYSA-N 0 0 386.795 3.365 20 5 GGBDRN O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)Nc1cc(Cl)ccc1Cl ZINC000072105684 1409849002 /nfs/dbraw/zinc/84/90/02/1409849002.db2.gz KXFLOLAXPNXYCL-UHFFFAOYSA-N 0 0 393.186 3.250 20 5 GGBDRN O=C(Cn1cnc2ccc([N+](=O)[O-])cc2c1=O)Nc1ccc(Cl)c(Cl)c1 ZINC000072205209 1409849389 /nfs/dbraw/zinc/84/93/89/1409849389.db2.gz OOQBUAFSBHNLLB-UHFFFAOYSA-N 0 0 393.186 3.250 20 5 GGBDRN NC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c[nH]1 ZINC000176723980 1428435243 /nfs/dbraw/zinc/43/52/43/1428435243.db2.gz ASMBDTIACWDMPG-UHFFFAOYSA-N 0 0 382.401 3.425 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NC[C@](C)(O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000176725640 1428437104 /nfs/dbraw/zinc/43/71/04/1428437104.db2.gz YUIQBMDXSYZCOX-BUXKBTBVSA-N 0 0 393.390 3.449 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC(C(=O)N2CCC(C)CC2)CC1 ZINC000076750564 1409891586 /nfs/dbraw/zinc/89/15/86/1409891586.db2.gz ZKRZXQCTTWJENC-UHFFFAOYSA-N 0 0 375.469 3.074 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CCCC[C@H]2O)CC1 ZINC000077156107 1409893781 /nfs/dbraw/zinc/89/37/81/1409893781.db2.gz VGLWMVQNWILTBE-HNAYVOBHSA-N 0 0 375.469 3.112 20 5 GGBDRN CCCCC[C@@H](C)NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000077526164 1409896971 /nfs/dbraw/zinc/89/69/71/1409896971.db2.gz FIGSNIGEAGMHFA-OAHLLOKOSA-N 0 0 376.457 3.031 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 ZINC000077687073 1409899061 /nfs/dbraw/zinc/89/90/61/1409899061.db2.gz ZPKCLMYLBMTPKN-OAHLLOKOSA-N 0 0 375.469 3.074 20 5 GGBDRN COCCCOc1cccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1 ZINC000176734641 1428441708 /nfs/dbraw/zinc/44/17/08/1428441708.db2.gz FSFGJAHVVAOCEX-UHFFFAOYSA-N 0 0 396.403 3.448 20 5 GGBDRN CC(C)CCO[C@@H]1CCN(c2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])C1 ZINC000176736108 1428441724 /nfs/dbraw/zinc/44/17/24/1428441724.db2.gz OUMZRHVONUURMW-GFCCVEGCSA-N 0 0 392.424 3.233 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000176730955 1428439597 /nfs/dbraw/zinc/43/95/97/1428439597.db2.gz HDRLSRJYLMVKEE-MRXNPFEDSA-N 0 0 396.447 3.132 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCN([C@H](C)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000176731474 1428439887 /nfs/dbraw/zinc/43/98/87/1428439887.db2.gz DUVCWQAJSNVERA-QWHCGFSZSA-N 0 0 388.390 3.242 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H](c2nc3ccccc3n2C)c2ccccc2)c1[N+](=O)[O-] ZINC000078406490 1409915717 /nfs/dbraw/zinc/91/57/17/1409915717.db2.gz IOZPJIOHDNHWTG-INIZCTEOSA-N 0 0 390.403 3.032 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@@H](c2nc3ccccc3n2C)c2ccccc2)c1[N+](=O)[O-] ZINC000078406492 1409916319 /nfs/dbraw/zinc/91/63/19/1409916319.db2.gz IOZPJIOHDNHWTG-MRXNPFEDSA-N 0 0 390.403 3.032 20 5 GGBDRN CN(CC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)C(=O)OC(C)(C)C ZINC000078440705 1409917347 /nfs/dbraw/zinc/91/73/47/1409917347.db2.gz KMORPUUXQFPBQE-UHFFFAOYSA-N 0 0 377.441 3.314 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000078608239 1409929151 /nfs/dbraw/zinc/92/91/51/1409929151.db2.gz VBUZCWCCGKXDCM-UHFFFAOYSA-N 0 0 398.463 3.269 20 5 GGBDRN Cc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1C(=O)NC(C)C ZINC000078717798 1409934022 /nfs/dbraw/zinc/93/40/22/1409934022.db2.gz ZADYPXPXSFMXSE-UHFFFAOYSA-N 0 0 384.436 3.482 20 5 GGBDRN Cn1c(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)nc2ccc(F)cc21 ZINC000078779121 1409936592 /nfs/dbraw/zinc/93/65/92/1409936592.db2.gz OPUJXJFBYFCRQR-UHFFFAOYSA-N 0 0 399.426 3.172 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1[N+](=O)[O-] ZINC000176737203 1428442387 /nfs/dbraw/zinc/44/23/87/1428442387.db2.gz UQLIGEZUVOPCET-INIZCTEOSA-N 0 0 387.367 3.412 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCOc1ccccc1C(C)C ZINC000078923746 1409944077 /nfs/dbraw/zinc/94/40/77/1409944077.db2.gz VLSHQSJMGOHMBC-UHFFFAOYSA-N 0 0 378.450 3.384 20 5 GGBDRN CN(C[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC(C)(C)C ZINC000078935094 1409944536 /nfs/dbraw/zinc/94/45/36/1409944536.db2.gz NSHLTDBYWYDMOR-ZDUSSCGKSA-N 0 0 381.404 3.205 20 5 GGBDRN C[C@@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)N1CCc2ccccc2C1 ZINC000078928055 1409944774 /nfs/dbraw/zinc/94/47/74/1409944774.db2.gz ISZNZXGKKURFPY-AWEZNQCLSA-N 0 0 391.431 3.370 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CC(=O)N(c2ccccc2Cl)C1 ZINC000078942415 1409946051 /nfs/dbraw/zinc/94/60/51/1409946051.db2.gz SCRPQPIJVBGVAT-JTQLQIEISA-N 0 0 377.759 3.379 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(Oc2ccc3c[nH]nc3c2)c([N+](=O)[O-])c1 ZINC000079016328 1409950080 /nfs/dbraw/zinc/95/00/80/1409950080.db2.gz IGAIKIRFBMGFTG-UHFFFAOYSA-N 0 0 390.421 3.294 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000176739135 1428443341 /nfs/dbraw/zinc/44/33/41/1428443341.db2.gz HMHRPBNLLDLDGN-ZDUSSCGKSA-N 0 0 390.783 3.165 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC1(c2nc(C)cs2)CCCC1 ZINC000079035847 1409952077 /nfs/dbraw/zinc/95/20/77/1409952077.db2.gz QOHGIIVDRYLBBY-UHFFFAOYSA-N 0 0 397.478 3.116 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)c2cc(F)cc(C)c2[N+](=O)[O-])CC1 ZINC000079056522 1409953289 /nfs/dbraw/zinc/95/32/89/1409953289.db2.gz SRNGNDNZECVVGJ-UHFFFAOYSA-N 0 0 379.432 3.153 20 5 GGBDRN CC(C)CC[C@@H](NC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)C(C)(C)C ZINC000079360430 1409972877 /nfs/dbraw/zinc/97/28/77/1409972877.db2.gz LFHUIIUZSWTNGJ-QGZVFWFLSA-N 0 0 391.468 3.287 20 5 GGBDRN C[C@H](CC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)NC(=O)C1CCCCC1 ZINC000079630536 1409983692 /nfs/dbraw/zinc/98/36/92/1409983692.db2.gz LPIBXZSGNTXQDW-CQSZACIVSA-N 0 0 375.469 3.421 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000079631355 1409984162 /nfs/dbraw/zinc/98/41/62/1409984162.db2.gz QKMWUZKLTSAHKQ-GJZGRUSLSA-N 0 0 375.469 3.231 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)cc1[N+](=O)[O-] ZINC000176747025 1428446359 /nfs/dbraw/zinc/44/63/59/1428446359.db2.gz PURFOASWFUOIRI-RHSMWYFYSA-N 0 0 396.447 3.348 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)cc1[N+](=O)[O-] ZINC000176747008 1428446641 /nfs/dbraw/zinc/44/66/41/1428446641.db2.gz PURFOASWFUOIRI-YOEHRIQHSA-N 0 0 396.447 3.348 20 5 GGBDRN CCCCC[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)OC ZINC000176749233 1428447545 /nfs/dbraw/zinc/44/75/45/1428447545.db2.gz ZIWLEDDJUUJLCM-SFHVURJKSA-N 0 0 394.471 3.393 20 5 GGBDRN CCCCC[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)OC ZINC000176751073 1428448062 /nfs/dbraw/zinc/44/80/62/1428448062.db2.gz MWAYOBUFUIEKTE-MRXNPFEDSA-N 0 0 391.468 3.049 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCO[C@H](c2ccco2)C1 ZINC000176750563 1428448397 /nfs/dbraw/zinc/44/83/97/1428448397.db2.gz GBRFXEKISKAEFM-NRFANRHFSA-N 0 0 388.423 3.348 20 5 GGBDRN CCC[C@H](CCO)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000081801036 1410024545 /nfs/dbraw/zinc/02/45/45/1410024545.db2.gz RZMRXPWIQXVNGE-MRXNPFEDSA-N 0 0 377.485 3.360 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)Nc2c[nH]c(C(N)=O)c2)cc1[N+](=O)[O-] ZINC000176755021 1428449168 /nfs/dbraw/zinc/44/91/68/1428449168.db2.gz NCTAEMSBYSSTQE-UHFFFAOYSA-N 0 0 376.438 3.412 20 5 GGBDRN CCCCCC(C)(C)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000084550823 1410037149 /nfs/dbraw/zinc/03/71/49/1410037149.db2.gz RICRIOVXTLRLQV-UHFFFAOYSA-N 0 0 375.469 3.486 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000085621039 1410043611 /nfs/dbraw/zinc/04/36/11/1410043611.db2.gz ORLQTKPNSYRGEP-OAHLLOKOSA-N 0 0 376.457 3.228 20 5 GGBDRN CCN(CC)C(=O)C1(NC(=O)CCc2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000087167344 1410046264 /nfs/dbraw/zinc/04/62/64/1410046264.db2.gz FIFFZISHCFZBKZ-UHFFFAOYSA-N 0 0 375.469 3.215 20 5 GGBDRN CCC[C@@H]1CN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CCO1 ZINC000089475979 1410054652 /nfs/dbraw/zinc/05/46/52/1410054652.db2.gz 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C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000103042227 1410822099 /nfs/dbraw/zinc/82/20/99/1410822099.db2.gz LEMDEPKHUWWEIH-CQSZACIVSA-N 0 0 398.394 3.387 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Oc1ccc(C(=O)N2CCCC2)cc1 ZINC000103045323 1410822457 /nfs/dbraw/zinc/82/24/57/1410822457.db2.gz WXZXCWQTPSSYII-UHFFFAOYSA-N 0 0 383.404 3.238 20 5 GGBDRN Cc1cc(C(=O)N2CSC[C@@H]2C(=O)Nc2cccc(F)c2)cc([N+](=O)[O-])c1 ZINC000103087072 1410826853 /nfs/dbraw/zinc/82/68/53/1410826853.db2.gz ZAMUXZVUELTVEC-MRXNPFEDSA-N 0 0 389.408 3.196 20 5 GGBDRN O=C(Nc1cccc(F)c1)[C@@H]1CSCN1C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000103087118 1410827151 /nfs/dbraw/zinc/82/71/51/1410827151.db2.gz XCPJAVULSFJTFP-HNNXBMFYSA-N 0 0 393.371 3.027 20 5 GGBDRN O=C(Nc1cccc(F)c1)[C@H]1CSCN1C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000103087121 1410827303 /nfs/dbraw/zinc/82/73/03/1410827303.db2.gz XCPJAVULSFJTFP-OAHLLOKOSA-N 0 0 393.371 3.027 20 5 GGBDRN COc1ccc(CN(C)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)cc1C 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ZINC000177327407 1428691454 /nfs/dbraw/zinc/69/14/54/1428691454.db2.gz HKWJLJDDDMTJGC-JTQLQIEISA-N 0 0 386.330 3.266 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000177328098 1428692170 /nfs/dbraw/zinc/69/21/70/1428692170.db2.gz PROFRZBLFIZNKE-UHFFFAOYSA-N 0 0 377.740 3.125 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000177329113 1428692555 /nfs/dbraw/zinc/69/25/55/1428692555.db2.gz PACQNYMXZNGOAX-BIXPNRAVSA-N 0 0 394.424 3.070 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000117071518 1412992552 /nfs/dbraw/zinc/99/25/52/1412992552.db2.gz XQASAASYNOFKHT-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN CCc1ccc(CNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)s1 ZINC000117093035 1412997958 /nfs/dbraw/zinc/99/79/58/1412997958.db2.gz RVJSZSCEXCAONK-UHFFFAOYSA-N 0 0 389.433 3.223 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000177330390 1428693074 /nfs/dbraw/zinc/69/30/74/1428693074.db2.gz AOEYDHQPIYDSLR-AWEZNQCLSA-N 0 0 389.839 3.270 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)NC[C@H]1CCN(c2ccccc2)C1 ZINC000177330366 1428693282 /nfs/dbraw/zinc/69/32/82/1428693282.db2.gz AOEYDHQPIYDSLR-CQSZACIVSA-N 0 0 389.839 3.270 20 5 GGBDRN CCc1ccc(OCCCn2c3cc([N+](=O)[O-])ccc3oc2=O)c([N+](=O)[O-])c1 ZINC000117112114 1413000382 /nfs/dbraw/zinc/00/03/82/1413000382.db2.gz SXQIKFPGURDAIX-UHFFFAOYSA-N 0 0 387.348 3.442 20 5 GGBDRN CCOc1ccc(OCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)c(C=O)c1 ZINC000117109437 1413000609 /nfs/dbraw/zinc/00/06/09/1413000609.db2.gz FQMBLPFVDLQHLU-UHFFFAOYSA-N 0 0 386.360 3.183 20 5 GGBDRN C[C@@H](Sc1n[nH]c(-c2ccccn2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000117115383 1413001679 /nfs/dbraw/zinc/00/16/79/1413001679.db2.gz DWOCHPAIUOKVPI-SECBINFHSA-N 0 0 388.384 3.033 20 5 GGBDRN O=C(CSc1n[nH]c(-c2ccccn2)n1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000117116044 1413002454 /nfs/dbraw/zinc/00/24/54/1413002454.db2.gz MFYQBLBTHRRSFL-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN Cc1c(Cn2nnc([C@@H](NC(=O)c3ccccc3)C(C)C)n2)cccc1[N+](=O)[O-] ZINC000117118348 1413002504 /nfs/dbraw/zinc/00/25/04/1413002504.db2.gz UYGKWZWLCCAALB-SFHVURJKSA-N 0 0 394.435 3.065 20 5 GGBDRN COC(=O)N(C)Cc1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1 ZINC000117160692 1413007410 /nfs/dbraw/zinc/00/74/10/1413007410.db2.gz RSNIDWUFBXNBPB-UHFFFAOYSA-N 0 0 379.319 3.324 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCCC[C@H]2C(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000117200322 1413011350 /nfs/dbraw/zinc/01/13/50/1413011350.db2.gz SRTDSMGCBIVOMC-HNNXBMFYSA-N 0 0 384.436 3.100 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000117203891 1413012212 /nfs/dbraw/zinc/01/22/12/1413012212.db2.gz FUWDQLCPGWXKCV-UHFFFAOYSA-N 0 0 386.248 3.317 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000117205535 1413012272 /nfs/dbraw/zinc/01/22/72/1413012272.db2.gz WSWFSCLLWWODTC-UHFFFAOYSA-N 0 0 386.248 3.317 20 5 GGBDRN CS[C@@H]1CCC[C@@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000117224010 1413013884 /nfs/dbraw/zinc/01/38/84/1413013884.db2.gz AQNWUVJWZBWHGK-TZMCWYRMSA-N 0 0 393.465 3.073 20 5 GGBDRN CCOCc1ccccc1CNC(=O)COc1cc([N+](=O)[O-])ccc1Cl ZINC000177331414 1428694291 /nfs/dbraw/zinc/69/42/91/1428694291.db2.gz LNUVBMNEOVKQOB-UHFFFAOYSA-N 0 0 378.812 3.480 20 5 GGBDRN CC(C)[C@@H](NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000117234452 1413017207 /nfs/dbraw/zinc/01/72/07/1413017207.db2.gz OEHCWGGUYHDBPE-GOSISDBHSA-N 0 0 389.839 3.492 20 5 GGBDRN CCOc1cc(C)ccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000117240433 1413018088 /nfs/dbraw/zinc/01/80/88/1413018088.db2.gz GIYVJHLMVWRCCT-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN CSc1cccc(N(C)C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000117248816 1413018863 /nfs/dbraw/zinc/01/88/63/1413018863.db2.gz PNUOFBALWOLDHW-UHFFFAOYSA-N 0 0 393.852 3.363 20 5 GGBDRN CCN(C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C ZINC000117250280 1413019125 /nfs/dbraw/zinc/01/91/25/1413019125.db2.gz SPNNJBWDOJQHAA-OCCSQVGLSA-N 0 0 381.860 3.405 20 5 GGBDRN CC[C@H](C)[C@H](C)N(C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000117253971 1413019962 /nfs/dbraw/zinc/01/99/62/1413019962.db2.gz DARJWKIFHFHTKG-RYUDHWBXSA-N 0 0 381.860 3.404 20 5 GGBDRN Cc1ccc2c(c1)N(C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])CCC2 ZINC000117257608 1413020289 /nfs/dbraw/zinc/02/02/89/1413020289.db2.gz SFFFGFPNRGFZSK-UHFFFAOYSA-N 0 0 387.823 3.266 20 5 GGBDRN CCNc1ccc(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1[N+](=O)[O-] ZINC000117268435 1413021738 /nfs/dbraw/zinc/02/17/38/1413021738.db2.gz NLDSSPDMEOGTMP-ZIAGYGMSSA-N 0 0 399.451 3.288 20 5 GGBDRN CNC(=O)c1ccc(N2CCC(C(F)(F)F)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000117327365 1413025659 /nfs/dbraw/zinc/02/56/59/1413025659.db2.gz WDWVUVVKSBUEDY-UHFFFAOYSA-N 0 0 385.264 3.276 20 5 GGBDRN CCOCc1ccc(CNC(=O)COc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000177333490 1428695140 /nfs/dbraw/zinc/69/51/40/1428695140.db2.gz PZQTYHYBPYIREL-UHFFFAOYSA-N 0 0 378.812 3.480 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1cc(C[S@](C)=O)ccc1Cl ZINC000117331454 1413026953 /nfs/dbraw/zinc/02/69/53/1413026953.db2.gz GVGJCMVMSWCGEE-AREMUKBSSA-N 0 0 395.868 3.486 20 5 GGBDRN O=C(CN1CCC(C(F)(F)F)(C(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000117352948 1413028914 /nfs/dbraw/zinc/02/89/14/1413028914.db2.gz JFVULDJKRPKHSE-UHFFFAOYSA-N 0 0 385.264 3.350 20 5 GGBDRN Cc1nc(-c2ccc(S(=O)(=O)Oc3ccc([N+](=O)[O-])cc3F)cc2)co1 ZINC000117360214 1413030118 /nfs/dbraw/zinc/03/01/18/1413030118.db2.gz JLRMGBOYKFFVJZ-UHFFFAOYSA-N 0 0 378.337 3.465 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC(c2nncn2C2CC2)CC1 ZINC000117413825 1413034190 /nfs/dbraw/zinc/03/41/90/1413034190.db2.gz AEIILJUSPVIFSQ-UHFFFAOYSA-N 0 0 375.816 3.194 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2CCCN(c3ccc(F)cc3C)C2)c1[N+](=O)[O-] ZINC000117424140 1413034893 /nfs/dbraw/zinc/03/48/93/1413034893.db2.gz LITKQVTYPUYIAG-CQSZACIVSA-N 0 0 389.431 3.117 20 5 GGBDRN Cc1cc(C(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)c(N)c([N+](=O)[O-])c1 ZINC000117426443 1413035529 /nfs/dbraw/zinc/03/55/29/1413035529.db2.gz JEIUNXJVUKREHY-UHFFFAOYSA-N 0 0 385.264 3.442 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)c2)oc1C ZINC000117490861 1413042322 /nfs/dbraw/zinc/04/23/22/1413042322.db2.gz QNFLRGQHUYYKLW-UHFFFAOYSA-N 0 0 394.387 3.235 20 5 GGBDRN O=C(c1cc(NCCc2ccc3c(c2)OCO3)ccc1[N+](=O)[O-])N1CCCC1 ZINC000117500074 1413043465 /nfs/dbraw/zinc/04/34/65/1413043465.db2.gz NWWFRBOENDBZST-UHFFFAOYSA-N 0 0 383.404 3.214 20 5 GGBDRN Cc1ccc(N2CCC[C@@H](NC(=O)c3cccc(Cl)c3[N+](=O)[O-])C2=O)cc1 ZINC000177336928 1428697285 /nfs/dbraw/zinc/69/72/85/1428697285.db2.gz HCDPKNFCHMLMKB-MRXNPFEDSA-N 0 0 387.823 3.482 20 5 GGBDRN COc1ccc(NC(C)=O)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117571529 1413052915 /nfs/dbraw/zinc/05/29/15/1413052915.db2.gz BSSYBWYMKLARHJ-UHFFFAOYSA-N 0 0 377.784 3.396 20 5 GGBDRN COc1ccc(CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000117573218 1413053760 /nfs/dbraw/zinc/05/37/60/1413053760.db2.gz UAADMBAKQWCRGF-UHFFFAOYSA-N 0 0 378.812 3.467 20 5 GGBDRN COc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1NC(C)=O ZINC000117592869 1413054837 /nfs/dbraw/zinc/05/48/37/1413054837.db2.gz PYYAHESNIPSXHB-UHFFFAOYSA-N 0 0 377.784 3.396 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc(N2CCOC2=O)c1 ZINC000117601480 1413055499 /nfs/dbraw/zinc/05/54/99/1413055499.db2.gz SGFUZAFOYPGFNK-UHFFFAOYSA-N 0 0 375.768 3.386 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1cccc(N2CCCC2=O)c1 ZINC000117608436 1413056236 /nfs/dbraw/zinc/05/62/36/1413056236.db2.gz SNNXFVVRYUZFQU-UHFFFAOYSA-N 0 0 387.823 3.234 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000117611982 1413056458 /nfs/dbraw/zinc/05/64/58/1413056458.db2.gz ZKHVRJMFQHJATQ-UHFFFAOYSA-N 0 0 375.812 3.488 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c(C)c1 ZINC000117621846 1413057023 /nfs/dbraw/zinc/05/70/23/1413057023.db2.gz GBDUDMJPNAISQO-UHFFFAOYSA-N 0 0 375.812 3.488 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000117625897 1413057647 /nfs/dbraw/zinc/05/76/47/1413057647.db2.gz FIHFRVKKJDZILW-CYBMUJFWSA-N 0 0 397.859 3.306 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000117631205 1413058034 /nfs/dbraw/zinc/05/80/34/1413058034.db2.gz PVTNQBKLRDPFCE-LLVKDONJSA-N 0 0 391.811 3.403 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1ccc(-n2ccnc2)c(F)c1 ZINC000117629978 1413058409 /nfs/dbraw/zinc/05/84/09/1413058409.db2.gz GXQLFCNUXPNVDW-UHFFFAOYSA-N 0 0 388.786 3.432 20 5 GGBDRN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)CN(C)C(=O)OC(C)(C)C ZINC000117662075 1413062785 /nfs/dbraw/zinc/06/27/85/1413062785.db2.gz UKKSMMMYFKCYJN-GFCCVEGCSA-N 0 0 399.875 3.410 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000117708067 1413068562 /nfs/dbraw/zinc/06/85/62/1413068562.db2.gz DHSZTBONLJNNJY-SFHVURJKSA-N 0 0 397.431 3.464 20 5 GGBDRN 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ZINC000177352290 1428702585 /nfs/dbraw/zinc/70/25/85/1428702585.db2.gz RISLRTLSERAKHP-UHFFFAOYSA-N 0 0 392.362 3.236 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@H]2c2cccc(N(C)C)c2)cccc1[N+](=O)[O-] ZINC000118135545 1413115752 /nfs/dbraw/zinc/11/57/52/1413115752.db2.gz YEBLKVYKPVSQHK-IBGZPJMESA-N 0 0 396.447 3.271 20 5 GGBDRN Cn1ncc(C(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)c1-n1cccc1 ZINC000118158157 1413116889 /nfs/dbraw/zinc/11/68/89/1413116889.db2.gz RZYGXKPTMPQQMK-UHFFFAOYSA-N 0 0 393.359 3.131 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1csc(Cc2ccccc2F)n1 ZINC000118143968 1413117173 /nfs/dbraw/zinc/11/71/73/1413117173.db2.gz XKRKOTSCMBHGJK-UHFFFAOYSA-N 0 0 390.396 3.143 20 5 GGBDRN CCn1c(SCCS(=O)(=O)CC)nc2cc3ccccc3cc2c1=O ZINC000118173790 1413118846 /nfs/dbraw/zinc/11/88/46/1413118846.db2.gz NWYHOEAFUFLACB-UHFFFAOYSA-N 0 0 376.503 3.096 20 5 GGBDRN O=C(Cc1ccccc1OC(F)F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000118210638 1413124204 /nfs/dbraw/zinc/12/42/04/1413124204.db2.gz BONLSSQTDPEIRE-UHFFFAOYSA-N 0 0 391.374 3.088 20 5 GGBDRN Cn1cc(C(=O)Nc2cnn(CC(F)(F)F)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000118239610 1413132916 /nfs/dbraw/zinc/13/29/16/1413132916.db2.gz SQGQKNXPACZQSA-UHFFFAOYSA-N 0 0 394.313 3.006 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](c2ccc(F)cc2)C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000118245772 1413134935 /nfs/dbraw/zinc/13/49/35/1413134935.db2.gz DZSQSTLRUNDEQP-HNNXBMFYSA-N 0 0 388.321 3.357 20 5 GGBDRN COc1cc(OCC(=O)NCC(C)(C)c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000118249996 1413135779 /nfs/dbraw/zinc/13/57/79/1413135779.db2.gz VOUVXOBKWJQSDY-UHFFFAOYSA-N 0 0 376.384 3.215 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)C1CCN(c2cnccn2)CC1 ZINC000118296514 1413144390 /nfs/dbraw/zinc/14/43/90/1413144390.db2.gz JDESPFNLIQSZAZ-UHFFFAOYSA-N 0 0 376.800 3.169 20 5 GGBDRN O=C(CN(Cc1cccnc1)c1ccccc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000118318902 1413149767 /nfs/dbraw/zinc/14/97/67/1413149767.db2.gz JBCYWIBWDYFNPD-UHFFFAOYSA-N 0 0 390.443 3.355 20 5 GGBDRN O=C(Nc1cnn(CC(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000118347240 1413153438 /nfs/dbraw/zinc/15/34/38/1413153438.db2.gz KYDKWTKUPCVJFA-UHFFFAOYSA-N 0 0 383.330 3.206 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)c2cc(Cl)cc(Cl)c2)c1 ZINC000118518120 1413170086 /nfs/dbraw/zinc/17/00/86/1413170086.db2.gz WLIPZFMUIJKFQC-OAHLLOKOSA-N 0 0 385.203 3.374 20 5 GGBDRN Cc1cc(C(=O)NC[C@H](O)c2cc(Cl)cc(Cl)c2)c(N)c([N+](=O)[O-])c1 ZINC000118519429 1413170754 /nfs/dbraw/zinc/17/07/54/1413170754.db2.gz FPWJDAFIYPIGTN-AWEZNQCLSA-N 0 0 384.219 3.256 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@@H](O)c2cc(Cl)cc(Cl)c2)c1[N+](=O)[O-] ZINC000118520965 1413171321 /nfs/dbraw/zinc/17/13/21/1413171321.db2.gz VBMHWXCBUVKCGL-GFCCVEGCSA-N 0 0 387.223 3.041 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](O)c2cc(Cl)cc(Cl)c2)ccc1[N+](=O)[O-] ZINC000118522178 1413171942 /nfs/dbraw/zinc/17/19/42/1413171942.db2.gz QKLZOBZZFFZECG-CQSZACIVSA-N 0 0 385.203 3.374 20 5 GGBDRN COc1ccc(-c2csc(CNC(=O)CCn3cc([N+](=O)[O-])cn3)c2)cc1 ZINC000177369053 1428707026 /nfs/dbraw/zinc/70/70/26/1428707026.db2.gz LOGMHYJAJXKGCV-UHFFFAOYSA-N 0 0 386.433 3.235 20 5 GGBDRN CC(C)C1(CNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)CC1 ZINC000177370362 1428707264 /nfs/dbraw/zinc/70/72/64/1428707264.db2.gz JIDXMPKTMNCYDC-UHFFFAOYSA-N 0 0 375.454 3.041 20 5 GGBDRN CC(C)(CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccc(F)c1 ZINC000118592382 1413189715 /nfs/dbraw/zinc/18/97/15/1413189715.db2.gz UWDXQJOFMLHMIG-UHFFFAOYSA-N 0 0 393.802 3.420 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000118595687 1413192680 /nfs/dbraw/zinc/19/26/80/1413192680.db2.gz GZMQVCDPBBZVOH-NHYWBVRUSA-N 0 0 397.859 3.144 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cc(-c2ccccc2)ns1 ZINC000118617475 1413198187 /nfs/dbraw/zinc/19/81/87/1413198187.db2.gz UAQCBTAQRYYGHS-UHFFFAOYSA-N 0 0 396.384 3.265 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCn1cnc2ccccc2c1=O ZINC000118634103 1413199908 /nfs/dbraw/zinc/19/99/08/1413199908.db2.gz NJOFSWMWNJCKCD-UHFFFAOYSA-N 0 0 386.795 3.295 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCn1cnc2sccc2c1=O ZINC000118634657 1413199942 /nfs/dbraw/zinc/19/99/42/1413199942.db2.gz FBIGXAAKQLAKLT-UHFFFAOYSA-N 0 0 392.824 3.357 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccc(=O)n(-c2ccccc2)n1 ZINC000118634330 1413200040 /nfs/dbraw/zinc/20/00/40/1413200040.db2.gz JZPAWSUWSJYZIN-UHFFFAOYSA-N 0 0 384.779 3.355 20 5 GGBDRN COc1ccc(-c2ccc(CNC(=O)c3c([N+](=O)[O-])c(C)nn3C)s2)cc1 ZINC000177374437 1428709477 /nfs/dbraw/zinc/70/94/77/1428709477.db2.gz JTNJMAKNKLMRDT-UHFFFAOYSA-N 0 0 386.433 3.304 20 5 GGBDRN C[C@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000118664327 1413202972 /nfs/dbraw/zinc/20/29/72/1413202972.db2.gz KBOPVIFGZAPYBG-SCRDCRAPSA-N 0 0 379.844 3.158 20 5 GGBDRN CSc1nc(C)c(CCC(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c(=O)[nH]1 ZINC000118687376 1413204415 /nfs/dbraw/zinc/20/44/15/1413204415.db2.gz YFSKAWUAVJGZKY-UHFFFAOYSA-N 0 0 396.856 3.242 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c(C)c1[N+](=O)[O-] ZINC000118687473 1413204430 /nfs/dbraw/zinc/20/44/30/1413204430.db2.gz HNCWQRSTWCLZBO-UHFFFAOYSA-N 0 0 381.776 3.307 20 5 GGBDRN CC(C)COc1cccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689145 1413205000 /nfs/dbraw/zinc/20/50/00/1413205000.db2.gz INYFQSQYWQUCJB-MRXNPFEDSA-N 0 0 384.436 3.351 20 5 GGBDRN O=C(c1cccc(-n2cccc2)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689147 1413205049 /nfs/dbraw/zinc/20/50/49/1413205049.db2.gz SJRXMEOUHWMWKU-INIZCTEOSA-N 0 0 377.404 3.107 20 5 GGBDRN Cc1ccc(C)c(SCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689166 1413205078 /nfs/dbraw/zinc/20/50/78/1413205078.db2.gz UARUJRJPCQZPKH-HNNXBMFYSA-N 0 0 386.477 3.412 20 5 GGBDRN O=C(c1cc(F)c(F)cc1Cl)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689215 1413205088 /nfs/dbraw/zinc/20/50/88/1413205088.db2.gz IRHQOZPSPMWIQM-SECBINFHSA-N 0 0 382.754 3.248 20 5 GGBDRN Cc1cccc(OCCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000118689320 1413205128 /nfs/dbraw/zinc/20/51/28/1413205128.db2.gz DPSBTSGKBDSUIG-INIZCTEOSA-N 0 0 384.436 3.089 20 5 GGBDRN O=C(c1cc(-c2ccccc2F)on1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689337 1413205164 /nfs/dbraw/zinc/20/51/64/1413205164.db2.gz WIGMXCMVBOSHKB-GFCCVEGCSA-N 0 0 397.366 3.111 20 5 GGBDRN Cc1ccc2nc(C)c(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1 ZINC000118690290 1413205531 /nfs/dbraw/zinc/20/55/31/1413205531.db2.gz QEDRJYFVIXFJHD-INIZCTEOSA-N 0 0 391.431 3.481 20 5 GGBDRN Cn1c2ccccc2c(Cl)c1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689916 1413205609 /nfs/dbraw/zinc/20/56/09/1413205609.db2.gz JOEJOVNOBJLPSJ-GFCCVEGCSA-N 0 0 399.838 3.462 20 5 GGBDRN O=C(CCCOCCc1ccccc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689957 1413205658 /nfs/dbraw/zinc/20/56/58/1413205658.db2.gz QSSBOQKEMGHGCH-GOSISDBHSA-N 0 0 398.463 3.042 20 5 GGBDRN C[C@@H](SCc1ccccc1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689943 1413205674 /nfs/dbraw/zinc/20/56/74/1413205674.db2.gz FNBIVSFPCHLKHY-GDBMZVCRSA-N 0 0 386.477 3.325 20 5 GGBDRN C[C@H](SCc1ccccc1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689941 1413205748 /nfs/dbraw/zinc/20/57/48/1413205748.db2.gz FNBIVSFPCHLKHY-GOEBONIOSA-N 0 0 386.477 3.325 20 5 GGBDRN Cn1c2ccccc2c(Cl)c1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689914 1413205803 /nfs/dbraw/zinc/20/58/03/1413205803.db2.gz JOEJOVNOBJLPSJ-LBPRGKRZSA-N 0 0 399.838 3.462 20 5 GGBDRN Cc1cccc(OCCCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689819 1413205813 /nfs/dbraw/zinc/20/58/13/1413205813.db2.gz FIEDDMIEHUORSC-INIZCTEOSA-N 0 0 384.436 3.170 20 5 GGBDRN C[C@@H](SCc1ccccc1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689938 1413205843 /nfs/dbraw/zinc/20/58/43/1413205843.db2.gz FNBIVSFPCHLKHY-ZBFHGGJFSA-N 0 0 386.477 3.325 20 5 GGBDRN C[C@H](Oc1cccc(Cl)c1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690783 1413206140 /nfs/dbraw/zinc/20/61/40/1413206140.db2.gz VPIIIUCVBHNSGZ-GXTWGEPZSA-N 0 0 390.827 3.124 20 5 GGBDRN CCCCOc1ccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118690490 1413206216 /nfs/dbraw/zinc/20/62/16/1413206216.db2.gz DTFGQIGUONYKCU-MRXNPFEDSA-N 0 0 384.436 3.495 20 5 GGBDRN O=C(CCSc1ccccc1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691101 1413206272 /nfs/dbraw/zinc/20/62/72/1413206272.db2.gz LWGFVIYAZGBEDO-ZDUSSCGKSA-N 0 0 390.440 3.324 20 5 GGBDRN Cc1onc(-c2ccccc2)c1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690546 1413206340 /nfs/dbraw/zinc/20/63/40/1413206340.db2.gz IUAGUWMFZAFCNM-HNNXBMFYSA-N 0 0 393.403 3.280 20 5 GGBDRN C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690782 1413206444 /nfs/dbraw/zinc/20/64/44/1413206444.db2.gz VPIIIUCVBHNSGZ-OCCSQVGLSA-N 0 0 390.827 3.124 20 5 GGBDRN O=C(CCc1c[nH]c2ccccc12)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690762 1413206482 /nfs/dbraw/zinc/20/64/82/1413206482.db2.gz LXBUROOVXOMFQI-HNNXBMFYSA-N 0 0 379.420 3.117 20 5 GGBDRN O=C(CCOc1cccc(Cl)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691162 1413207003 /nfs/dbraw/zinc/20/70/03/1413207003.db2.gz AYHRUNGOGIGSMU-AWEZNQCLSA-N 0 0 390.827 3.125 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(O[C@H]3CCCC[C@@H]3O)cc2)cc(F)cc1[N+](=O)[O-] ZINC000118700605 1413207672 /nfs/dbraw/zinc/20/76/72/1413207672.db2.gz ZBFJKEYGGPCGHS-IRXDYDNUSA-N 0 0 389.383 3.251 20 5 GGBDRN Cc1c(C(=O)Nc2cc(C3CCCC3)[nH]n2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000118702649 1413208676 /nfs/dbraw/zinc/20/86/76/1413208676.db2.gz OIPDFBQAIIDQEA-UHFFFAOYSA-N 0 0 381.396 3.117 20 5 GGBDRN COc1ccc(-c2ccc(CNC(=O)CCn3cc([N+](=O)[O-])cn3)s2)cc1 ZINC000177375024 1428709920 /nfs/dbraw/zinc/70/99/20/1428709920.db2.gz JOCQWIXKLHKVDI-UHFFFAOYSA-N 0 0 386.433 3.235 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2csc(C(C)(C)C)n2)cc([N+](=O)[O-])c1 ZINC000118723858 1413209925 /nfs/dbraw/zinc/20/99/25/1413209925.db2.gz OBQPQRRGHPZCJM-UHFFFAOYSA-N 0 0 377.422 3.317 20 5 GGBDRN CC(C)n1c(CCNC(=O)COc2ccc([N+](=O)[O-])cc2)nc2ccccc21 ZINC000118733659 1413212690 /nfs/dbraw/zinc/21/26/90/1413212690.db2.gz LWZMOBXUXYWIRN-UHFFFAOYSA-N 0 0 382.420 3.263 20 5 GGBDRN C[C@@](NCc1cc(F)ccc1[N+](=O)[O-])(C(N)=O)c1cccc(C(F)(F)F)c1 ZINC000177376683 1428710253 /nfs/dbraw/zinc/71/02/53/1428710253.db2.gz KJYRSNXLGUNWNO-INIZCTEOSA-N 0 0 385.317 3.243 20 5 GGBDRN C[C@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C ZINC000118735358 1413213364 /nfs/dbraw/zinc/21/33/64/1413213364.db2.gz JRXBJKLZWXWWFF-ZDUSSCGKSA-N 0 0 390.403 3.158 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CC[C@@H](OCCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000177379250 1428710812 /nfs/dbraw/zinc/71/08/12/1428710812.db2.gz APCZZBHLISTBAP-GOEBONIOSA-N 0 0 379.457 3.067 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CC[C@@H](OCCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000177380593 1428711495 /nfs/dbraw/zinc/71/14/95/1428711495.db2.gz OINWRBSPNQEOMY-MRXNPFEDSA-N 0 0 379.457 3.069 20 5 GGBDRN COc1cc(Cn2cnc3cccc(F)c3c2=O)c([N+](=O)[O-])cc1OC(F)F ZINC000177380753 1428711624 /nfs/dbraw/zinc/71/16/24/1428711624.db2.gz KQQDGPOYKRNWLZ-UHFFFAOYSA-N 0 0 395.293 3.102 20 5 GGBDRN C[C@](NCc1c(F)cccc1[N+](=O)[O-])(C(N)=O)c1cccc(C(F)(F)F)c1 ZINC000177380004 1428711635 /nfs/dbraw/zinc/71/16/35/1428711635.db2.gz JLJJUKMSSYNLIX-MRXNPFEDSA-N 0 0 385.317 3.243 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000118860157 1413249133 /nfs/dbraw/zinc/24/91/33/1413249133.db2.gz QDCACUZVKYSJRG-OAHLLOKOSA-N 0 0 397.439 3.197 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000118860499 1413249467 /nfs/dbraw/zinc/24/94/67/1413249467.db2.gz XOQZFYMXOMNLBE-OAHLLOKOSA-N 0 0 397.439 3.197 20 5 GGBDRN COc1ccc(-c2nc(CN3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)co2)cc1 ZINC000118865952 1413250918 /nfs/dbraw/zinc/25/09/18/1413250918.db2.gz NANOSTXASNISCI-HNNXBMFYSA-N 0 0 395.419 3.340 20 5 GGBDRN COc1ccc(NC(=O)CN2CCC[C@H]2c2cccc(N(C)C)c2)c([N+](=O)[O-])c1 ZINC000118867273 1413252703 /nfs/dbraw/zinc/25/27/03/1413252703.db2.gz KBKAFQZOAHRKQF-IBGZPJMESA-N 0 0 398.463 3.445 20 5 GGBDRN O=C(CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1cccc2ccccc21 ZINC000118866511 1413252812 /nfs/dbraw/zinc/25/28/12/1413252812.db2.gz QYLSEXSZBXQMPR-INIZCTEOSA-N 0 0 391.431 3.268 20 5 GGBDRN Cc1ccc(C)c(NC(=O)[C@@H](C)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118866751 1413253767 /nfs/dbraw/zinc/25/37/67/1413253767.db2.gz ALWXAKOITAQGQN-CVEARBPZSA-N 0 0 383.452 3.120 20 5 GGBDRN CCn1c(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2c1cccc2F ZINC000118866253 1413253845 /nfs/dbraw/zinc/25/38/45/1413253845.db2.gz WMMLVHMITHQAKU-ZDUSSCGKSA-N 0 0 384.415 3.185 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000118867526 1413255107 /nfs/dbraw/zinc/25/51/07/1413255107.db2.gz BGVAORNXAPRQRL-LJQANCHMSA-N 0 0 398.463 3.445 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)c2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000118907448 1413265888 /nfs/dbraw/zinc/26/58/88/1413265888.db2.gz PVWSGJWODAXRRG-UHFFFAOYSA-N 0 0 379.372 3.116 20 5 GGBDRN O=C(Nc1n[nH]c(Cc2cccc(F)c2)n1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000118952062 1413271526 /nfs/dbraw/zinc/27/15/26/1413271526.db2.gz SWCJYSGEQQVVLC-UHFFFAOYSA-N 0 0 375.747 3.349 20 5 GGBDRN O=C(Nc1ccccc1O[C@@H]1CCOC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000118953038 1413272317 /nfs/dbraw/zinc/27/23/17/1413272317.db2.gz VBHVZAFHFXGXRT-QGZVFWFLSA-N 0 0 394.387 3.201 20 5 GGBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000118952744 1413272344 /nfs/dbraw/zinc/27/23/44/1413272344.db2.gz ZPDCGMYGUHSHFQ-CYBMUJFWSA-N 0 0 396.378 3.311 20 5 GGBDRN Cc1c(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cnn1C ZINC000118972572 1413282815 /nfs/dbraw/zinc/28/28/15/1413282815.db2.gz GOZMMNMGQSPPDV-CYBMUJFWSA-N 0 0 394.435 3.135 20 5 GGBDRN Cc1c(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cnn1C ZINC000118972464 1413283062 /nfs/dbraw/zinc/28/30/62/1413283062.db2.gz GOZMMNMGQSPPDV-ZDUSSCGKSA-N 0 0 394.435 3.135 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000118994046 1413295489 /nfs/dbraw/zinc/29/54/89/1413295489.db2.gz PUWDDZCYCHNRHL-IBGZPJMESA-N 0 0 377.404 3.461 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(-c2nc3ccccc3n2C)cc1 ZINC000118995660 1413297329 /nfs/dbraw/zinc/29/73/29/1413297329.db2.gz BMMZOCWDSZYTHT-UHFFFAOYSA-N 0 0 376.376 3.134 20 5 GGBDRN O=C(CCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)NC1CCCCC1 ZINC000118997456 1413298237 /nfs/dbraw/zinc/29/82/37/1413298237.db2.gz HWDGEYFUUXTNGE-UHFFFAOYSA-N 0 0 388.468 3.108 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000119004371 1413301358 /nfs/dbraw/zinc/30/13/58/1413301358.db2.gz WFMRZTGYBJEKIF-FUHWJXTLSA-N 0 0 381.432 3.369 20 5 GGBDRN COC(=O)c1sc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])nc1C1CC1 ZINC000119014398 1413303935 /nfs/dbraw/zinc/30/39/35/1413303935.db2.gz DFMMKPNTVPYFKX-UHFFFAOYSA-N 0 0 383.332 3.246 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 ZINC000119031766 1413311398 /nfs/dbraw/zinc/31/13/98/1413311398.db2.gz RBGDPVYAYFVBKR-FUHWJXTLSA-N 0 0 381.432 3.369 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCCc2c(F)ccc(F)c21 ZINC000119035916 1413311874 /nfs/dbraw/zinc/31/18/74/1413311874.db2.gz OFLZZQFIIGZHOO-UHFFFAOYSA-N 0 0 385.330 3.047 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000119042607 1413314531 /nfs/dbraw/zinc/31/45/31/1413314531.db2.gz YCOCURRAOZHTEJ-VQIMIIECSA-N 0 0 385.420 3.323 20 5 GGBDRN Cn1ccnc1-c1csc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000119060406 1413321244 /nfs/dbraw/zinc/32/12/44/1413321244.db2.gz FLPPPSIIZBYYBU-UHFFFAOYSA-N 0 0 384.421 3.278 20 5 GGBDRN CC(C)Cc1ccc([C@@H](NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C2CC2)cc1 ZINC000119061173 1413321396 /nfs/dbraw/zinc/32/13/96/1413321396.db2.gz DFXNQLSJJUFQSJ-OAQYLSRUSA-N 0 0 383.448 3.223 20 5 GGBDRN CN(Cc1ccccc1-c1ccccc1)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000119065653 1413322454 /nfs/dbraw/zinc/32/24/54/1413322454.db2.gz GDVBTJAMPXYLAC-UHFFFAOYSA-N 0 0 377.400 3.082 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000119063918 1413323052 /nfs/dbraw/zinc/32/30/52/1413323052.db2.gz ZCHRRAKNXZDGKR-LLVKDONJSA-N 0 0 383.832 3.330 20 5 GGBDRN O=C(NC[C@@H]1CCC[C@H](O)C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000119083227 1413329423 /nfs/dbraw/zinc/32/94/23/1413329423.db2.gz ZMUKCHDSNIVWKE-AEFFLSMTSA-N 0 0 383.448 3.488 20 5 GGBDRN CCS[C@H](C)c1noc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000119083525 1413330177 /nfs/dbraw/zinc/33/01/77/1413330177.db2.gz DURQLJPWBRKBMD-CYBMUJFWSA-N 0 0 377.470 3.114 20 5 GGBDRN COc1ccc(CN(CCO)Cc2c(Cl)cccc2[N+](=O)[O-])c(OC)c1 ZINC000119104541 1413338038 /nfs/dbraw/zinc/33/80/38/1413338038.db2.gz IDGPZISOKIDEDL-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN C[C@@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccccc1Oc1ccccc1 ZINC000119107682 1413339174 /nfs/dbraw/zinc/33/91/74/1413339174.db2.gz VIADBCPPYAYDNO-OAHLLOKOSA-N 0 0 393.399 3.426 20 5 GGBDRN Cc1nc(CCS(=O)(=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 ZINC000119111947 1413341206 /nfs/dbraw/zinc/34/12/06/1413341206.db2.gz DHYYTILTUPALJO-UHFFFAOYSA-N 0 0 393.446 3.172 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000119119901 1413344362 /nfs/dbraw/zinc/34/43/62/1413344362.db2.gz ZZZAPBFZSFSJAF-INIZCTEOSA-N 0 0 391.468 3.304 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(-n2cccn2)cc1 ZINC000119123789 1413345983 /nfs/dbraw/zinc/34/59/83/1413345983.db2.gz MBKUTFXAKOXDAN-UHFFFAOYSA-N 0 0 380.360 3.194 20 5 GGBDRN O=C(NCC1(C2CC2)CC1)c1cc([N+](=O)[O-])ccc1I ZINC000119125921 1413347098 /nfs/dbraw/zinc/34/70/98/1413347098.db2.gz ZEXPFKSXVIIFJQ-UHFFFAOYSA-N 0 0 386.189 3.119 20 5 GGBDRN C[C@H](NC(=O)NC(C)(C)c1cn(-c2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000119127021 1413347926 /nfs/dbraw/zinc/34/79/26/1413347926.db2.gz MZESFBLFLIQNAN-AWEZNQCLSA-N 0 0 394.435 3.471 20 5 GGBDRN C[C@@H](NC(=O)NC(C)(C)c1cn(-c2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000119127136 1413348043 /nfs/dbraw/zinc/34/80/43/1413348043.db2.gz MZESFBLFLIQNAN-CQSZACIVSA-N 0 0 394.435 3.471 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000119128252 1413348921 /nfs/dbraw/zinc/34/89/21/1413348921.db2.gz SIOWLEHQHWWKDF-AWEZNQCLSA-N 0 0 375.450 3.235 20 5 GGBDRN Cc1ccc(C(=O)N[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000177402671 1428719985 /nfs/dbraw/zinc/71/99/85/1428719985.db2.gz KEDBRURJYVKNJT-KRWDZBQOSA-N 0 0 395.337 3.053 20 5 GGBDRN CC(C)(C)c1ccc(C(C)(C)CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000119129580 1413349300 /nfs/dbraw/zinc/34/93/00/1413349300.db2.gz VXVWWZUJJFQOBX-UHFFFAOYSA-N 0 0 385.464 3.148 20 5 GGBDRN Cn1cc(CCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000119142276 1413353247 /nfs/dbraw/zinc/35/32/47/1413353247.db2.gz GGAZHJCXXFBMLL-MRXNPFEDSA-N 0 0 393.447 3.127 20 5 GGBDRN C[C@H](c1ccccc1)N(CC(N)=O)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000119141319 1413353595 /nfs/dbraw/zinc/35/35/95/1413353595.db2.gz XJIIJOCFYQVPCA-KGLIPLIRSA-N 0 0 387.461 3.151 20 5 GGBDRN COC(=O)c1sc(NC(=O)CCc2cccc([N+](=O)[O-])c2)nc1C1CC1 ZINC000119145256 1413355058 /nfs/dbraw/zinc/35/50/58/1413355058.db2.gz PLXVCJZAHJPDFN-UHFFFAOYSA-N 0 0 375.406 3.287 20 5 GGBDRN C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1nc(Cc2ccccc2)no1 ZINC000119151994 1413357060 /nfs/dbraw/zinc/35/70/60/1413357060.db2.gz MPUPWHZUCXPGSX-AWEZNQCLSA-N 0 0 380.404 3.379 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2)c1 ZINC000119155124 1413358039 /nfs/dbraw/zinc/35/80/39/1413358039.db2.gz PUKORAGQTSBFGQ-CQSZACIVSA-N 0 0 375.450 3.235 20 5 GGBDRN COC(=O)[C@H](C)[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000177409946 1428723420 /nfs/dbraw/zinc/72/34/20/1428723420.db2.gz QYLJELSGPLAWMH-ACJLOTCBSA-N 0 0 396.403 3.285 20 5 GGBDRN Cc1c(CC(=O)N[C@@H](c2nc(-c3cccnc3)no2)C(C)C)cccc1[N+](=O)[O-] ZINC000119162004 1413360738 /nfs/dbraw/zinc/36/07/38/1413360738.db2.gz MAUMVABDVWKMGZ-GOSISDBHSA-N 0 0 395.419 3.404 20 5 GGBDRN Cc1noc(C)c1CN(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000119164218 1413361336 /nfs/dbraw/zinc/36/13/36/1413361336.db2.gz AJZDKTOPUOYTLB-UHFFFAOYSA-N 0 0 382.214 3.163 20 5 GGBDRN Cn1ccnc1C[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000119179251 1413366994 /nfs/dbraw/zinc/36/69/94/1413366994.db2.gz VCFNPJNCCFZCLY-GFCCVEGCSA-N 0 0 396.369 3.442 20 5 GGBDRN CC1(C)COCCN1C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000119182625 1413368177 /nfs/dbraw/zinc/36/81/77/1413368177.db2.gz AUCVXVMMNJYYFY-UHFFFAOYSA-N 0 0 399.234 3.338 20 5 GGBDRN CC(C)Oc1cccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000119182266 1413368262 /nfs/dbraw/zinc/36/82/62/1413368262.db2.gz RTSCHSLZXBPCKK-UHFFFAOYSA-N 0 0 385.420 3.461 20 5 GGBDRN C[C@@H](c1ccco1)N(CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000119192738 1413371388 /nfs/dbraw/zinc/37/13/88/1413371388.db2.gz AFHQTSLPOCXBSV-INIZCTEOSA-N 0 0 398.463 3.062 20 5 GGBDRN Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000119207304 1413375444 /nfs/dbraw/zinc/37/54/44/1413375444.db2.gz SLZGTJBLFVQKBH-HNNXBMFYSA-N 0 0 380.408 3.011 20 5 GGBDRN CN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CCCc2c1cnn2C ZINC000119219960 1413378998 /nfs/dbraw/zinc/37/89/98/1413378998.db2.gz HRNUIXKYPVXIOC-ZDUSSCGKSA-N 0 0 395.366 3.471 20 5 GGBDRN Cc1cc(=O)oc2cc(OCCn3cnc(-c4cccc([N+](=O)[O-])c4)n3)ccc12 ZINC000119230064 1413382729 /nfs/dbraw/zinc/38/27/29/1413382729.db2.gz BVPAFRAHKWJFOY-UHFFFAOYSA-N 0 0 392.371 3.347 20 5 GGBDRN CCNC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000119281829 1413398225 /nfs/dbraw/zinc/39/82/25/1413398225.db2.gz RZKGNDUMYKKUGR-UHFFFAOYSA-N 0 0 381.392 3.399 20 5 GGBDRN CC(C)[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000119287771 1413399924 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RFRKMCDVSNIHLC-UHFFFAOYSA-N 0 0 398.444 3.409 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC2CCN(c3cccs3)CC2)c1C ZINC000119344091 1413418362 /nfs/dbraw/zinc/41/83/62/1413418362.db2.gz BJEHIOUFPUANKG-UHFFFAOYSA-N 0 0 395.506 3.220 20 5 GGBDRN CCc1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000119345856 1413418515 /nfs/dbraw/zinc/41/85/15/1413418515.db2.gz LIAWWVKMANXUMM-KRWDZBQOSA-N 0 0 394.493 3.119 20 5 GGBDRN O=C(Nc1ccc(N2CCSCC2)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000119355963 1413422225 /nfs/dbraw/zinc/42/22/25/1413422225.db2.gz ZFXNIZXFDPWUPD-UHFFFAOYSA-N 0 0 388.405 3.309 20 5 GGBDRN CCOC(=O)CCN(Cc1cccnc1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119358926 1413422955 /nfs/dbraw/zinc/42/29/55/1413422955.db2.gz VFDWLOBCEBNPJM-UHFFFAOYSA-N 0 0 391.811 3.239 20 5 GGBDRN C[C@H](O)CNC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000119361287 1413423540 /nfs/dbraw/zinc/42/35/40/1413423540.db2.gz SFNZFMDPYHRFMG-JTQLQIEISA-N 0 0 389.458 3.466 20 5 GGBDRN 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CC(C)(C)OC(=O)N1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000119471493 1413458165 /nfs/dbraw/zinc/45/81/65/1413458165.db2.gz PXMFVPHCXRDLOB-UHFFFAOYSA-N 0 0 388.424 3.303 20 5 GGBDRN NC(=O)CCN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1ccccc1 ZINC000119470099 1413458627 /nfs/dbraw/zinc/45/86/27/1413458627.db2.gz PBBAWEOBHRPYRX-UHFFFAOYSA-N 0 0 380.404 3.127 20 5 GGBDRN O=C(NCc1ccccc1COc1ccccc1Cl)c1[nH]ncc1[N+](=O)[O-] ZINC000119479865 1413461436 /nfs/dbraw/zinc/46/14/36/1413461436.db2.gz YJYZQBLKYICMGP-UHFFFAOYSA-N 0 0 386.795 3.480 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000119482634 1413461847 /nfs/dbraw/zinc/46/18/47/1413461847.db2.gz ZHSDIVLBPJXOBW-ZDUSSCGKSA-N 0 0 391.449 3.065 20 5 GGBDRN NC(=O)c1cccc2c1CCCN2Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119483922 1413462659 /nfs/dbraw/zinc/46/26/59/1413462659.db2.gz PJHUTILIGBETRU-UHFFFAOYSA-N 0 0 378.388 3.302 20 5 GGBDRN CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000119485479 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Cc1cn2c(nc(C)c2CN(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)s1 ZINC000120613700 1413854925 /nfs/dbraw/zinc/85/49/25/1413854925.db2.gz FREQOPKETSKGJL-UHFFFAOYSA-N 0 0 389.393 3.101 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)Cc1cccc(OC(C)C)c1 ZINC000120617181 1413856693 /nfs/dbraw/zinc/85/66/93/1413856693.db2.gz JEYIWWIHGRLAAZ-UHFFFAOYSA-N 0 0 387.436 3.461 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000120622033 1413857843 /nfs/dbraw/zinc/85/78/43/1413857843.db2.gz SXJIWXSHXUXGNC-CYBMUJFWSA-N 0 0 394.387 3.081 20 5 GGBDRN COc1cc(OCC(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000120629979 1413859890 /nfs/dbraw/zinc/85/98/90/1413859890.db2.gz FWLKITLCMIASIQ-RISCZKNCSA-N 0 0 394.786 3.447 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000120629535 1413859963 /nfs/dbraw/zinc/85/99/63/1413859963.db2.gz FWLKITLCMIASIQ-SMDDNHRTSA-N 0 0 394.786 3.447 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(OCC2CCCC2)CC1 ZINC000177481436 1428760931 /nfs/dbraw/zinc/76/09/31/1428760931.db2.gz BMVLCKMUJHLAPN-UHFFFAOYSA-N 0 0 391.468 3.213 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(Cc1ccccc1Cl)C1CCCC1 ZINC000120643440 1413863598 /nfs/dbraw/zinc/86/35/98/1413863598.db2.gz GPHKOPDOKMXPPT-UHFFFAOYSA-N 0 0 389.839 3.381 20 5 GGBDRN Cc1cc(N2CCOCC2)ccc1NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000120649711 1413865873 /nfs/dbraw/zinc/86/58/73/1413865873.db2.gz PZXCBDYVPLHGKL-UHFFFAOYSA-N 0 0 377.347 3.270 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N(CC2CC2)CC2CC2)ccc1Br ZINC000120651447 1413866444 /nfs/dbraw/zinc/86/64/44/1413866444.db2.gz BDJJHVIDVBZJTP-UHFFFAOYSA-N 0 0 389.271 3.168 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)c(C)c1[N+](=O)[O-] ZINC000120675697 1413872301 /nfs/dbraw/zinc/87/23/01/1413872301.db2.gz VGXIJFCIPGSYQN-FZMZJTMJSA-N 0 0 380.807 3.263 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1cccc(N2CCCCC2)c1 ZINC000120708467 1413880801 /nfs/dbraw/zinc/88/08/01/1413880801.db2.gz ILYGPDUJUOJXBV-UHFFFAOYSA-N 0 0 382.420 3.471 20 5 GGBDRN O=C(Cc1ccc(F)c(F)c1)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000120723060 1413885201 /nfs/dbraw/zinc/88/52/01/1413885201.db2.gz DGSIJFWOGQLFSF-UHFFFAOYSA-N 0 0 398.749 3.042 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2cccc(N3CCCCC3)c2)cccc1[N+](=O)[O-] ZINC000120746688 1413891096 /nfs/dbraw/zinc/89/10/96/1413891096.db2.gz UJDIAZUBSANJAQ-UHFFFAOYSA-N 0 0 382.420 3.471 20 5 GGBDRN Cc1c(NC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)cccc1[N+](=O)[O-] ZINC000120755273 1413893670 /nfs/dbraw/zinc/89/36/70/1413893670.db2.gz NKECWWBOAIVOMM-HNNXBMFYSA-N 0 0 386.383 3.359 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000120760373 1413895210 /nfs/dbraw/zinc/89/52/10/1413895210.db2.gz AIHIDSLEKPBZNQ-LLVKDONJSA-N 0 0 375.816 3.264 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000120770491 1413897745 /nfs/dbraw/zinc/89/77/45/1413897745.db2.gz GYWUYKAVNFNGEX-XAUMDUMWSA-N 0 0 395.459 3.241 20 5 GGBDRN CCc1cccc(OCCN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000120774938 1413898980 /nfs/dbraw/zinc/89/89/80/1413898980.db2.gz LMNWNDNUEUZBSZ-FQEVSTJZSA-N 0 0 383.404 3.003 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccccc2-c2nncn2C(C)C)c(C)c1[N+](=O)[O-] ZINC000177492914 1428767405 /nfs/dbraw/zinc/76/74/05/1428767405.db2.gz SHWPDIXNSZFJSM-UHFFFAOYSA-N 0 0 397.439 3.276 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2F)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000120798046 1413906664 /nfs/dbraw/zinc/90/66/64/1413906664.db2.gz OPXSWOIEKWJHIR-CYBMUJFWSA-N 0 0 388.355 3.041 20 5 GGBDRN O=C1[C@H](N2CCC(OCC3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000177489750 1428764930 /nfs/dbraw/zinc/76/49/30/1428764930.db2.gz RFPXJUWSRFAADZ-HXUWFJFHSA-N 0 0 387.480 3.371 20 5 GGBDRN C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000177489764 1428765106 /nfs/dbraw/zinc/76/51/06/1428765106.db2.gz PYPCURDGGGVIRI-MPBGBICISA-N 0 0 386.379 3.365 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)c1[N+](=O)[O-] ZINC000120811567 1413911149 /nfs/dbraw/zinc/91/11/49/1413911149.db2.gz LYNURXHWXWFEAY-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2(Cc3ccccc3)CCC2)cccc1[N+](=O)[O-] ZINC000120819215 1413913915 /nfs/dbraw/zinc/91/39/15/1413913915.db2.gz LTBFQTZDFZMOGG-UHFFFAOYSA-N 0 0 381.432 3.371 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)ccc1[N+](=O)[O-] ZINC000120820187 1413914255 /nfs/dbraw/zinc/91/42/55/1413914255.db2.gz PWSRNZUQUOLLOY-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN C[C@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](c2ccsc2)O1 ZINC000120822114 1413915327 /nfs/dbraw/zinc/91/53/27/1413915327.db2.gz IYMWOTDQLISFDU-SCLBCKFNSA-N 0 0 387.461 3.007 20 5 GGBDRN CC(=O)N1CCc2cc(NC(=O)c3ccc([N+](=O)[O-])c4cccnc34)ccc21 ZINC000120823948 1413916098 /nfs/dbraw/zinc/91/60/98/1413916098.db2.gz XQLUQIGZJZJVQN-UHFFFAOYSA-N 0 0 376.372 3.304 20 5 GGBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000177489814 1428765618 /nfs/dbraw/zinc/76/56/18/1428765618.db2.gz PYPCURDGGGVIRI-YUNKPMOVSA-N 0 0 386.379 3.365 20 5 GGBDRN C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000177489795 1428765742 /nfs/dbraw/zinc/76/57/42/1428765742.db2.gz PYPCURDGGGVIRI-ODXCJYRJSA-N 0 0 386.379 3.365 20 5 GGBDRN COc1ccc(OC(F)F)c(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000120846677 1413924663 /nfs/dbraw/zinc/92/46/63/1413924663.db2.gz IZRAMTRHVBSEPN-UHFFFAOYSA-N 0 0 395.362 3.247 20 5 GGBDRN NC(=O)c1oc2ccccc2c1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000120854969 1413927668 /nfs/dbraw/zinc/92/76/68/1413927668.db2.gz LIELHMWKSDUJSR-UHFFFAOYSA-N 0 0 378.344 3.102 20 5 GGBDRN O=C(Cc1ccc(F)c(F)c1)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000120858856 1413929150 /nfs/dbraw/zinc/92/91/50/1413929150.db2.gz NBQURRQRWLFGNM-UHFFFAOYSA-N 0 0 391.374 3.270 20 5 GGBDRN C[C@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H](c2ccsc2)O1 ZINC000120865881 1413931279 /nfs/dbraw/zinc/93/12/79/1413931279.db2.gz ZYSVDQOVRLAZBE-YVEFUNNKSA-N 0 0 376.434 3.485 20 5 GGBDRN Cc1ccc(SCCNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000120877257 1413934766 /nfs/dbraw/zinc/93/47/66/1413934766.db2.gz OJQCJBTZNMLHGY-UHFFFAOYSA-N 0 0 387.461 3.367 20 5 GGBDRN CCN(CCCNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000120886884 1413937949 /nfs/dbraw/zinc/93/79/49/1413937949.db2.gz JTWZZPLHDSBERP-UHFFFAOYSA-N 0 0 398.463 3.183 20 5 GGBDRN O=C(NC[C@@H](O)c1ccncc1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000120904030 1413942907 /nfs/dbraw/zinc/94/29/07/1413942907.db2.gz FUPYURNMCHPEHG-LJQANCHMSA-N 0 0 378.388 3.197 20 5 GGBDRN O=C(NC[C@H](O)c1ccncc1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000120903893 1413943015 /nfs/dbraw/zinc/94/30/15/1413943015.db2.gz FUPYURNMCHPEHG-IBGZPJMESA-N 0 0 378.388 3.197 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCCc1cccc2cccnc21 ZINC000120909604 1413944955 /nfs/dbraw/zinc/94/49/55/1413944955.db2.gz MDIVRPLOOYJUAT-UHFFFAOYSA-N 0 0 392.415 3.057 20 5 GGBDRN CC[C@H](Cc1ccccc1)NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000177493382 1428768021 /nfs/dbraw/zinc/76/80/21/1428768021.db2.gz GQEHROZMBJJYLH-CYBMUJFWSA-N 0 0 375.812 3.324 20 5 GGBDRN Cc1nc2ccccc2n1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000120925533 1413950352 /nfs/dbraw/zinc/95/03/52/1413950352.db2.gz GFUVOSNMBWFBJR-UHFFFAOYSA-N 0 0 375.388 3.231 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000120927899 1413951057 /nfs/dbraw/zinc/95/10/57/1413951057.db2.gz IWSIVZKBPKCYLW-GFCCVEGCSA-N 0 0 389.839 3.418 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCc2coc(-c3ccccc3)n2)c1C ZINC000120935283 1413952825 /nfs/dbraw/zinc/95/28/25/1413952825.db2.gz LEQQUFUKBZTXNZ-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN NC(=O)C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1cccc(Cl)c1 ZINC000177494717 1428768729 /nfs/dbraw/zinc/76/87/29/1428768729.db2.gz QCGLPJRGFWJMDT-OAHLLOKOSA-N 0 0 396.230 3.177 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCO[C@H](c3ccccc3C)C2)c1C ZINC000120948020 1413956717 /nfs/dbraw/zinc/95/67/17/1413956717.db2.gz OLUBZOWIDQFWOT-SFHVURJKSA-N 0 0 390.461 3.282 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000120957118 1413959906 /nfs/dbraw/zinc/95/99/06/1413959906.db2.gz YKARBNDMPWVBNJ-LBPRGKRZSA-N 0 0 387.465 3.332 20 5 GGBDRN O=C([C@@H]1CC(=O)N(c2ccccc2F)C1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000120974544 1413965274 /nfs/dbraw/zinc/96/52/74/1413965274.db2.gz OPAKEBORVBULPS-CQSZACIVSA-N 0 0 383.379 3.066 20 5 GGBDRN Cc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000120983108 1413967766 /nfs/dbraw/zinc/96/77/66/1413967766.db2.gz CLCJJKMAYPTHJN-HNNXBMFYSA-N 0 0 389.477 3.076 20 5 GGBDRN CCN(CC)C(=O)N1CCC(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000120985939 1413969189 /nfs/dbraw/zinc/96/91/89/1413969189.db2.gz NPBKJFSEYCIKJI-UHFFFAOYSA-N 0 0 388.468 3.048 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@H]1[C@H]1CCCCC1=O ZINC000120991569 1413970370 /nfs/dbraw/zinc/97/03/70/1413970370.db2.gz PBACYLDLZZPJBL-ZBFHGGJFSA-N 0 0 382.420 3.144 20 5 GGBDRN O=C(Cc1csc(-c2cnccn2)n1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000120993093 1413971053 /nfs/dbraw/zinc/97/10/53/1413971053.db2.gz ONFLPKJFDRWVMZ-UHFFFAOYSA-N 0 0 381.417 3.030 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120999615 1413972859 /nfs/dbraw/zinc/97/28/59/1413972859.db2.gz FTAXBGLLHDDDQZ-UHFFFAOYSA-N 0 0 384.392 3.420 20 5 GGBDRN Cc1nc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2-c2cccs2)cn1C ZINC000121008682 1413975555 /nfs/dbraw/zinc/97/55/55/1413975555.db2.gz JKFRERGYZGHCMM-UHFFFAOYSA-N 0 0 379.419 3.133 20 5 GGBDRN CN(C(=O)CCCNC(=O)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000121016759 1413977876 /nfs/dbraw/zinc/97/78/76/1413977876.db2.gz PZLNGZQRMVFSLG-UHFFFAOYSA-N 0 0 375.812 3.421 20 5 GGBDRN CN(C(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000121027491 1413981668 /nfs/dbraw/zinc/98/16/68/1413981668.db2.gz VHLBSKIEOHCRNF-OAHLLOKOSA-N 0 0 385.395 3.249 20 5 GGBDRN CN(C(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000121027661 1413981705 /nfs/dbraw/zinc/98/17/05/1413981705.db2.gz VHLBSKIEOHCRNF-HNNXBMFYSA-N 0 0 385.395 3.249 20 5 GGBDRN Cc1c(C(=O)N2CCCc3cccc(C)c32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000121044384 1413987683 /nfs/dbraw/zinc/98/76/83/1413987683.db2.gz AQJDWSBAKBZVMD-UHFFFAOYSA-N 0 0 377.404 3.385 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000121054116 1413990204 /nfs/dbraw/zinc/99/02/04/1413990204.db2.gz VTXFBPBVWXPTCS-NSHDSACASA-N 0 0 375.816 3.264 20 5 GGBDRN CC(C)CC[C@@H]1CCCCN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000177501128 1428771412 /nfs/dbraw/zinc/77/14/12/1428771412.db2.gz NUACCWNTIJUWRJ-HNNXBMFYSA-N 0 0 382.482 3.429 20 5 GGBDRN C[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H](c2ccsc2)O1 ZINC000121068998 1413995834 /nfs/dbraw/zinc/99/58/34/1413995834.db2.gz LVUAWHYZFRTNIE-CXAGYDPISA-N 0 0 375.450 3.081 20 5 GGBDRN CCCCOc1ncccc1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121074984 1413998304 /nfs/dbraw/zinc/99/83/04/1413998304.db2.gz GZHUDMZHTJZLSQ-UHFFFAOYSA-N 0 0 384.436 3.437 20 5 GGBDRN Cc1nn2cc(CCCOC(=O)CCc3cccc([N+](=O)[O-])c3)cnc2c1C ZINC000121079085 1413999566 /nfs/dbraw/zinc/99/95/66/1413999566.db2.gz RDGSZSOVQMYBRD-UHFFFAOYSA-N 0 0 382.420 3.363 20 5 GGBDRN Cc1nn(CN2CCCN(C(=O)c3ccccc3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121087314 1414002871 /nfs/dbraw/zinc/00/28/71/1414002871.db2.gz KANOPXFHXHKSIB-UHFFFAOYSA-N 0 0 393.447 3.059 20 5 GGBDRN CCCCCNC(=O)C1CCN(Cn2nc(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000121100726 1414007793 /nfs/dbraw/zinc/00/77/93/1414007793.db2.gz WDRLUFSWXICZBN-UHFFFAOYSA-N 0 0 387.484 3.229 20 5 GGBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1c(C)nn(C)c1OC ZINC000121101286 1414007963 /nfs/dbraw/zinc/00/79/63/1414007963.db2.gz KIHJPLUBLXNTCB-UHFFFAOYSA-N 0 0 378.454 3.077 20 5 GGBDRN Cc1nn(CN2CCC(NC(=O)OC(C)(C)C)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121110663 1414011081 /nfs/dbraw/zinc/01/10/81/1414011081.db2.gz UWGLEPZFYKQCOR-UHFFFAOYSA-N 0 0 389.456 3.200 20 5 GGBDRN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])C1 ZINC000121115915 1414012989 /nfs/dbraw/zinc/01/29/89/1414012989.db2.gz FOILDOSTLFKRDW-WBVHZDCISA-N 0 0 382.416 3.499 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)COc2ccc(C=O)cc2[N+](=O)[O-])C1 ZINC000121115446 1414013275 /nfs/dbraw/zinc/01/32/75/1414013275.db2.gz FOILDOSTLFKRDW-DOTOQJQBSA-N 0 0 382.416 3.499 20 5 GGBDRN COc1cccc2sc(NC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)nc21 ZINC000121123587 1414015720 /nfs/dbraw/zinc/01/57/20/1414015720.db2.gz DWNZTOCSHPWYJY-UHFFFAOYSA-N 0 0 396.388 3.046 20 5 GGBDRN COC(=O)c1ccccc1N(C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000121126742 1414017357 /nfs/dbraw/zinc/01/73/57/1414017357.db2.gz QTVRPWNZNBOOTL-UHFFFAOYSA-N 0 0 383.404 3.258 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000121144653 1414023521 /nfs/dbraw/zinc/02/35/21/1414023521.db2.gz XFHCBXLNERMKSC-UHFFFAOYSA-N 0 0 399.447 3.393 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)c(C)c1[N+](=O)[O-] ZINC000121148871 1414025390 /nfs/dbraw/zinc/02/53/90/1414025390.db2.gz YKZABCQVBTWJDC-LJQANCHMSA-N 0 0 397.410 3.238 20 5 GGBDRN CCn1cc(C(=O)C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cn1 ZINC000121163525 1414029387 /nfs/dbraw/zinc/02/93/87/1414029387.db2.gz NYJAZWUTAWIYOA-UHFFFAOYSA-N 0 0 385.405 3.065 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)Nc3cccc(N(C)C)n3)cc2)c(C)c1[N+](=O)[O-] ZINC000121180261 1414035062 /nfs/dbraw/zinc/03/50/62/1414035062.db2.gz DRSXPUKXTFFSKT-UHFFFAOYSA-N 0 0 394.435 3.170 20 5 GGBDRN O=C(Oc1cccc(-n2cccn2)c1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000121182718 1414036346 /nfs/dbraw/zinc/03/63/46/1414036346.db2.gz IMDPJUFVYNMRMK-UHFFFAOYSA-N 0 0 375.344 3.185 20 5 GGBDRN Cc1cccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)CC2)c1 ZINC000121185363 1414037440 /nfs/dbraw/zinc/03/74/40/1414037440.db2.gz UKTBIXJSVRWAAK-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN Cc1cccc(OC[C@@H](C)NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000121189320 1414038924 /nfs/dbraw/zinc/03/89/24/1414038924.db2.gz ACUJMNFOYMBFIW-CQSZACIVSA-N 0 0 385.420 3.042 20 5 GGBDRN COc1ccccc1[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000121194816 1414040108 /nfs/dbraw/zinc/04/01/08/1414040108.db2.gz PKXITTYRCKSKTD-LJQANCHMSA-N 0 0 399.428 3.066 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NC[C@H](C)COCc1ccccc1 ZINC000121198214 1414041564 /nfs/dbraw/zinc/04/15/64/1414041564.db2.gz PPHZBLFRBJXOMZ-AWEZNQCLSA-N 0 0 399.447 3.119 20 5 GGBDRN Cc1c(NC(=O)CCN2CCO[C@@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000121221570 1414048705 /nfs/dbraw/zinc/04/87/05/1414048705.db2.gz KTGOCSMZIGWVCO-OAQYLSRUSA-N 0 0 383.448 3.479 20 5 GGBDRN O=C(COc1cc(Cl)ccc1[N+](=O)[O-])NC[C@H]1CCN(c2ccccc2)C1 ZINC000121249725 1414058665 /nfs/dbraw/zinc/05/86/65/1414058665.db2.gz YSEFPZCZSPVHSN-CQSZACIVSA-N 0 0 389.839 3.270 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3ccc(OCC(F)(F)F)nc3)n2)c1 ZINC000121253988 1414059974 /nfs/dbraw/zinc/05/99/74/1414059974.db2.gz LYSXWNIJFXJPOD-UHFFFAOYSA-N 0 0 379.298 3.238 20 5 GGBDRN Cc1ccc2c(c1)c(=O)n(C)c1nnc(COc3cc(Cl)ccc3[N+](=O)[O-])n12 ZINC000121259963 1414062553 /nfs/dbraw/zinc/06/25/53/1414062553.db2.gz YZTHELYOTIELDO-UHFFFAOYSA-N 0 0 399.794 3.030 20 5 GGBDRN O=C(COc1cc(Cl)ccc1[N+](=O)[O-])Nc1ccc(N2CCOCC2)cc1 ZINC000121260842 1414063522 /nfs/dbraw/zinc/06/35/22/1414063522.db2.gz GBINXZOPTDJTNZ-UHFFFAOYSA-N 0 0 391.811 3.102 20 5 GGBDRN CCn1c2nnc(COc3cc(Cl)ccc3[N+](=O)[O-])n2c2ccccc2c1=O ZINC000121267723 1414065348 /nfs/dbraw/zinc/06/53/48/1414065348.db2.gz JLLWYSTUJRXDAT-UHFFFAOYSA-N 0 0 399.794 3.205 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000121276495 1414068886 /nfs/dbraw/zinc/06/88/86/1414068886.db2.gz GBQVQFSASQKVCJ-UHFFFAOYSA-N 0 0 398.394 3.129 20 5 GGBDRN Cc1nn(CN2CCO[C@@]3(CCc4ccccc43)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121278035 1414068902 /nfs/dbraw/zinc/06/89/02/1414068902.db2.gz AOXRCKRWTHKTPY-NRFANRHFSA-N 0 0 378.432 3.384 20 5 GGBDRN Cc1cc(N2CCC[C@H](OC(=O)CCc3cccc([N+](=O)[O-])c3)C2)nc(C)n1 ZINC000121284164 1414071311 /nfs/dbraw/zinc/07/13/11/1414071311.db2.gz OKMYOMXMWNBSEW-SFHVURJKSA-N 0 0 384.436 3.146 20 5 GGBDRN Cc1cc(N2CCC[C@@H](OC(=O)CCc3cccc([N+](=O)[O-])c3)C2)nc(C)n1 ZINC000121284310 1414071409 /nfs/dbraw/zinc/07/14/09/1414071409.db2.gz OKMYOMXMWNBSEW-GOSISDBHSA-N 0 0 384.436 3.146 20 5 GGBDRN Cc1nn(C)c2ncc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc12 ZINC000121283918 1414071542 /nfs/dbraw/zinc/07/15/42/1414071542.db2.gz AGLGLUUGVNCDSD-UHFFFAOYSA-N 0 0 377.307 3.039 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H]1CCCOc2ccccc21 ZINC000121288125 1414072514 /nfs/dbraw/zinc/07/25/14/1414072514.db2.gz BBEDGICCGXVVOR-OAHLLOKOSA-N 0 0 383.404 3.180 20 5 GGBDRN COc1ccc(NC(=O)CN2CC[C@@H](Cc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000121288023 1414072760 /nfs/dbraw/zinc/07/27/60/1414072760.db2.gz JCTRPKUDLQTISN-HNNXBMFYSA-N 0 0 387.411 3.246 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccc(F)c(Cl)c1 ZINC000121296568 1414075299 /nfs/dbraw/zinc/07/52/99/1414075299.db2.gz PPGNMMDZCDTVLV-UHFFFAOYSA-N 0 0 379.775 3.259 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCC[C@H](O)c1ccccc1 ZINC000121333772 1414086279 /nfs/dbraw/zinc/08/62/79/1414086279.db2.gz ISVYHGXWYRVINT-INIZCTEOSA-N 0 0 393.237 3.140 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N(C[C@H]1CCCO1)C1CCCC1 ZINC000121333663 1414086350 /nfs/dbraw/zinc/08/63/50/1414086350.db2.gz HFRSNFFGKJPWDW-CQSZACIVSA-N 0 0 395.843 3.137 20 5 GGBDRN COc1cc(CN2CCO[C@@H](c3ccco3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000121337011 1414087418 /nfs/dbraw/zinc/08/74/18/1414087418.db2.gz DJESAHZLLKZUSV-MRXNPFEDSA-N 0 0 384.335 3.371 20 5 GGBDRN COc1cccnc1N(C)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000121360646 1414094758 /nfs/dbraw/zinc/09/47/58/1414094758.db2.gz VKFREDIPIAAINH-UHFFFAOYSA-N 0 0 398.341 3.482 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H]1CCC[C@H]1Cc1ccccc1 ZINC000121365037 1414095997 /nfs/dbraw/zinc/09/59/97/1414095997.db2.gz QRFSSPCIUULCKB-RDJZCZTQSA-N 0 0 395.415 3.030 20 5 GGBDRN Cc1ccccc1Oc1ccccc1CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000121378727 1414100449 /nfs/dbraw/zinc/10/04/49/1414100449.db2.gz VYHIRHBZJLSZCF-UHFFFAOYSA-N 0 0 393.399 3.174 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)Nc2cccnc2Br)cc1C ZINC000121381282 1414102026 /nfs/dbraw/zinc/10/20/26/1414102026.db2.gz QOZKLRTUICVUGU-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN CC(=O)c1ccc(OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c([N+](=O)[O-])c1 ZINC000121385104 1414103251 /nfs/dbraw/zinc/10/32/51/1414103251.db2.gz MSTTULSSMIRFNX-UHFFFAOYSA-N 0 0 384.304 3.335 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N[C@H](CCCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000121388823 1414104542 /nfs/dbraw/zinc/10/45/42/1414104542.db2.gz SIZWJUJBRIRDJB-OAHLLOKOSA-N 0 0 398.868 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N[C@H](CCCO)c1ccccc1 ZINC000121392265 1414105781 /nfs/dbraw/zinc/10/57/81/1414105781.db2.gz OMTGQVXCPUHTIC-CQSZACIVSA-N 0 0 384.841 3.040 20 5 GGBDRN CCOC(=O)c1cc2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)ccc2[nH]1 ZINC000121391464 1414105796 /nfs/dbraw/zinc/10/57/96/1414105796.db2.gz AKFRNAOYBIXVBI-UHFFFAOYSA-N 0 0 393.399 3.451 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](CCCO)c2ccccc2)cc1C ZINC000121400530 1414109137 /nfs/dbraw/zinc/10/91/37/1414109137.db2.gz ZZMSFXQSJAWYKL-INIZCTEOSA-N 0 0 378.450 3.004 20 5 GGBDRN CCOC[C@@H]1CCCN(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])C1 ZINC000121404159 1414110235 /nfs/dbraw/zinc/11/02/35/1414110235.db2.gz LCZQKXPNTIPFKJ-MRXNPFEDSA-N 0 0 378.473 3.163 20 5 GGBDRN CC(C)c1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cnn1-c1ccccn1 ZINC000121405526 1414110821 /nfs/dbraw/zinc/11/08/21/1414110821.db2.gz RRVDKRFVKHKUBS-UHFFFAOYSA-N 0 0 391.431 3.497 20 5 GGBDRN O=C(OCCn1ccccc1=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000121407901 1414111719 /nfs/dbraw/zinc/11/17/19/1414111719.db2.gz YHXITTRNJZBRIS-UHFFFAOYSA-N 0 0 380.356 3.406 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N2CCCC[C@H]2c2ncc[nH]2)c([N+](=O)[O-])c1 ZINC000121413304 1414113663 /nfs/dbraw/zinc/11/36/63/1414113663.db2.gz GYYLFJITQCQZSJ-INIZCTEOSA-N 0 0 386.456 3.365 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N2CCCC[C@@H]2c2ncc[nH]2)c([N+](=O)[O-])c1 ZINC000121413120 1414113853 /nfs/dbraw/zinc/11/38/53/1414113853.db2.gz GYYLFJITQCQZSJ-MRXNPFEDSA-N 0 0 386.456 3.365 20 5 GGBDRN Cc1sc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1CS(C)(=O)=O ZINC000121416408 1414115328 /nfs/dbraw/zinc/11/53/28/1414115328.db2.gz IXFHZHGLDUWGGW-SNVBAGLBSA-N 0 0 394.474 3.101 20 5 GGBDRN COCCCNC(=O)CN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000121418403 1414115850 /nfs/dbraw/zinc/11/58/50/1414115850.db2.gz IJMBOSMKCKQETI-UHFFFAOYSA-N 0 0 395.843 3.093 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccccc1OCCc1ccccc1 ZINC000121434383 1414121042 /nfs/dbraw/zinc/12/10/42/1414121042.db2.gz SDCIZTICGOJCSB-UHFFFAOYSA-N 0 0 395.419 3.235 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H](Oc2ccncc2)C1 ZINC000121436791 1414122502 /nfs/dbraw/zinc/12/25/02/1414122502.db2.gz SZPAQAFBXICTOB-OAHLLOKOSA-N 0 0 391.811 3.092 20 5 GGBDRN CN(C[C@@H]1CCCN1C(=O)CCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000121439769 1414123001 /nfs/dbraw/zinc/12/30/01/1414123001.db2.gz BECGUHZOSCQBLJ-KRWDZBQOSA-N 0 0 391.468 3.385 20 5 GGBDRN COc1cc(OCc2nc(COc3ccc(F)cc3)no2)ccc1[N+](=O)[O-] ZINC000121442770 1414124117 /nfs/dbraw/zinc/12/41/17/1414124117.db2.gz IEHLWDGPCWGRIO-UHFFFAOYSA-N 0 0 375.312 3.284 20 5 GGBDRN Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)c12 ZINC000121445786 1414125086 /nfs/dbraw/zinc/12/50/86/1414125086.db2.gz VWQBDYFCTSKRGE-UHFFFAOYSA-N 0 0 391.431 3.261 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2F)c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000121447642 1414125707 /nfs/dbraw/zinc/12/57/07/1414125707.db2.gz KUIQNRSUDIYLQG-UHFFFAOYSA-N 0 0 392.350 3.358 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)Cn2cc(Br)c([N+](=O)[O-])n2)cc1 ZINC000121459290 1414133228 /nfs/dbraw/zinc/13/32/28/1414133228.db2.gz LPVWAZAYQUTBRH-GFCCVEGCSA-N 0 0 397.273 3.331 20 5 GGBDRN COc1cc(C(=O)Nc2cnn(-c3ccccc3F)c2)c([N+](=O)[O-])cc1OC ZINC000121459889 1414133997 /nfs/dbraw/zinc/13/39/97/1414133997.db2.gz OAOVVPVRKZIYAZ-UHFFFAOYSA-N 0 0 386.339 3.189 20 5 GGBDRN O=C([C@@H]1C[C@@H]1c1cccc(F)c1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000121471583 1414139637 /nfs/dbraw/zinc/13/96/37/1414139637.db2.gz VYIRKVOPXJYIFF-NILFDRSVSA-N 0 0 388.374 3.085 20 5 GGBDRN COc1ccc(-c2ccc(CN3CCC[C@@H]3C(=O)NC3CC3)o2)c([N+](=O)[O-])c1 ZINC000121477516 1414142040 /nfs/dbraw/zinc/14/20/40/1414142040.db2.gz QQGMDLCOTMHMTN-QGZVFWFLSA-N 0 0 385.420 3.106 20 5 GGBDRN COc1ccc(-c2ccc(CN3CCC[C@H]3C(=O)NC3CC3)o2)c([N+](=O)[O-])c1 ZINC000121477667 1414142187 /nfs/dbraw/zinc/14/21/87/1414142187.db2.gz QQGMDLCOTMHMTN-KRWDZBQOSA-N 0 0 385.420 3.106 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@H](c2ccco2)C1 ZINC000121481620 1414143785 /nfs/dbraw/zinc/14/37/85/1414143785.db2.gz CAODIWHKPOWGPB-ZBEGNZNMSA-N 0 0 379.800 3.242 20 5 GGBDRN CC[C@@H]1COCCN1C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000121486748 1414145532 /nfs/dbraw/zinc/14/55/32/1414145532.db2.gz RDMXFQXJXLYTNQ-SNVBAGLBSA-N 0 0 399.234 3.338 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2F)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000121493308 1414148688 /nfs/dbraw/zinc/14/86/88/1414148688.db2.gz KZDVIIBEACVVFR-UHFFFAOYSA-N 0 0 392.350 3.358 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OCc2nnc(C3CC3)o2)c1 ZINC000121527805 1414163596 /nfs/dbraw/zinc/16/35/96/1414163596.db2.gz WCRRUHLGSYZONK-UHFFFAOYSA-N 0 0 387.133 3.039 20 5 GGBDRN COc1cccnc1N(C)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000121543250 1414170139 /nfs/dbraw/zinc/17/01/39/1414170139.db2.gz AOGFTUNDQPOVJQ-UHFFFAOYSA-N 0 0 395.419 3.137 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)c1[N+](=O)[O-] ZINC000121542451 1414170249 /nfs/dbraw/zinc/17/02/49/1414170249.db2.gz SYPGKZCJBBIQOD-GFCCVEGCSA-N 0 0 399.451 3.070 20 5 GGBDRN COCCN(C(=O)c1ncoc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000121547128 1414171977 /nfs/dbraw/zinc/17/19/77/1414171977.db2.gz XKQBASXKVJFYCF-UHFFFAOYSA-N 0 0 388.405 3.308 20 5 GGBDRN Cc1ccc(CNc2nc(C)c([N+](=O)[O-])c(NCc3ccc(C)nc3)n2)cn1 ZINC000121548076 1414172346 /nfs/dbraw/zinc/17/23/46/1414172346.db2.gz KUTNJPONPVCOSF-UHFFFAOYSA-N 0 0 379.424 3.324 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000121550930 1414173777 /nfs/dbraw/zinc/17/37/77/1414173777.db2.gz QJYCJASMBUCEJG-AREMUKBSSA-N 0 0 396.852 3.396 20 5 GGBDRN C[C@@H](CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000121564900 1414178982 /nfs/dbraw/zinc/17/89/82/1414178982.db2.gz QMDVXNLMTVMDDU-NSHDSACASA-N 0 0 379.869 3.486 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccccc1OCC1CC1 ZINC000121564677 1414179431 /nfs/dbraw/zinc/17/94/31/1414179431.db2.gz YCVMDJDIWHBEBP-UHFFFAOYSA-N 0 0 397.431 3.255 20 5 GGBDRN C[C@H](CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000121565063 1414179792 /nfs/dbraw/zinc/17/97/92/1414179792.db2.gz QMDVXNLMTVMDDU-LLVKDONJSA-N 0 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CC(C)(C)OC(=O)N1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000177545605 1428787895 /nfs/dbraw/zinc/78/78/95/1428787895.db2.gz HDOLHAVIIHQMGG-SECBINFHSA-N 0 0 387.234 3.174 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)c1C ZINC000121602770 1414195589 /nfs/dbraw/zinc/19/55/89/1414195589.db2.gz UHMIRIUALHCYNX-LRDDRELGSA-N 0 0 396.490 3.424 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)c1C ZINC000121602950 1414195760 /nfs/dbraw/zinc/19/57/60/1414195760.db2.gz UHMIRIUALHCYNX-WBMJQRKESA-N 0 0 396.490 3.424 20 5 GGBDRN COc1cccc2c1OC[C@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000121603194 1414196801 /nfs/dbraw/zinc/19/68/01/1414196801.db2.gz GXFMIUWGXXVUQR-MRXNPFEDSA-N 0 0 397.431 3.281 20 5 GGBDRN Cc1cccc(O[C@H](C)CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000121641277 1414209449 /nfs/dbraw/zinc/20/94/49/1414209449.db2.gz DRCRNSITWFCHSF-CQSZACIVSA-N 0 0 385.420 3.042 20 5 GGBDRN 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MEHXNFOXJLGPIL-UHFFFAOYSA-N 0 0 399.831 3.423 20 5 GGBDRN O=C(CN1C(=S)N=NC1c1ccc(Cl)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000121724012 1414237088 /nfs/dbraw/zinc/23/70/88/1414237088.db2.gz FUSVDNOBFWGMMC-UHFFFAOYSA-N 0 0 389.824 3.434 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(NCC(=O)N(C)Cc2ccccc2)cc1Cl ZINC000121729459 1414238684 /nfs/dbraw/zinc/23/86/84/1414238684.db2.gz XSJKHZKSFAJENA-UHFFFAOYSA-N 0 0 391.811 3.105 20 5 GGBDRN CCO[C@H](CCNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)C1CCCC1 ZINC000121732697 1414240084 /nfs/dbraw/zinc/24/00/84/1414240084.db2.gz ZQDPYKPZZVXECR-QGZVFWFLSA-N 0 0 391.468 3.252 20 5 GGBDRN Cc1c(OCc2nnc(C(=O)NCc3ccccc3)s2)cccc1[N+](=O)[O-] ZINC000121741678 1414242678 /nfs/dbraw/zinc/24/26/78/1414242678.db2.gz VUSJPJWMSKWTOR-UHFFFAOYSA-N 0 0 384.417 3.264 20 5 GGBDRN CCS[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000121747946 1414244701 /nfs/dbraw/zinc/24/47/01/1414244701.db2.gz XDBLOBDKPDTTIA-ZIAGYGMSSA-N 0 0 379.482 3.331 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N[C@@H]3CCO[C@@H](C4CC4)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000121764688 1414249544 /nfs/dbraw/zinc/24/95/44/1414249544.db2.gz IDGNFORZFQCCMT-RTBURBONSA-N 0 0 398.463 3.144 20 5 GGBDRN O=C(NCCc1cc(Cl)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1F ZINC000121777934 1414254419 /nfs/dbraw/zinc/25/44/19/1414254419.db2.gz MKPUZYOLOSRSGI-UHFFFAOYSA-N 0 0 380.759 3.131 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000121800831 1414261845 /nfs/dbraw/zinc/26/18/45/1414261845.db2.gz BIIRPTXLOAXYMN-ZDUSSCGKSA-N 0 0 387.415 3.072 20 5 GGBDRN Cc1nn(C)c2ncc(NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)cc12 ZINC000121811783 1414265783 /nfs/dbraw/zinc/26/57/83/1414265783.db2.gz IWTFUXUFJKBURZ-UHFFFAOYSA-N 0 0 380.408 3.381 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)nc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000121831153 1414271828 /nfs/dbraw/zinc/27/18/28/1414271828.db2.gz YVHJUKSEDUVPGA-UHFFFAOYSA-N 0 0 378.392 3.372 20 5 GGBDRN CC1(C)C(=O)Nc2ccc(S(=O)(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc21 ZINC000121835896 1414273694 /nfs/dbraw/zinc/27/36/94/1414273694.db2.gz ZTFAINLPGJYMEW-UHFFFAOYSA-N 0 0 395.824 3.279 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000121838906 1414275070 /nfs/dbraw/zinc/27/50/70/1414275070.db2.gz QTTPRQVTCKPNTI-UHFFFAOYSA-N 0 0 378.272 3.419 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCSc1nnc(C2CC2)n1-c1ccccc1 ZINC000121843424 1414275383 /nfs/dbraw/zinc/27/53/83/1414275383.db2.gz PDAAKXQDRSSVPB-UHFFFAOYSA-N 0 0 383.433 3.007 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCCOCCc2ccccc2)C1=O ZINC000121847134 1414276834 /nfs/dbraw/zinc/27/68/34/1414276834.db2.gz OFQLLQTUVBAUKS-OAQYLSRUSA-N 0 0 397.431 3.011 20 5 GGBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000121848202 1414277710 /nfs/dbraw/zinc/27/77/10/1414277710.db2.gz VUMUYVZHSQKROE-UKRRQHHQSA-N 0 0 379.482 3.331 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](c2ccccc2)c2cccnc2)cccc1[N+](=O)[O-] ZINC000177562929 1428794552 /nfs/dbraw/zinc/79/45/52/1428794552.db2.gz BGJOIJNMIILFLY-IBGZPJMESA-N 0 0 390.399 3.143 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCc2c(F)ccc(F)c2C1 ZINC000121860239 1414281758 /nfs/dbraw/zinc/28/17/58/1414281758.db2.gz YPVBWWBBHHPHRO-UHFFFAOYSA-N 0 0 389.358 3.013 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccccc1)c1cccnc1 ZINC000177563526 1428795458 /nfs/dbraw/zinc/79/54/58/1428795458.db2.gz YXDCLMWJMZBPLO-IBGZPJMESA-N 0 0 390.399 3.143 20 5 GGBDRN COC(=O)CCn1nc(C)c(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1C ZINC000121873827 1414286106 /nfs/dbraw/zinc/28/61/06/1414286106.db2.gz CBUAILXTDCVQPW-UHFFFAOYSA-N 0 0 394.859 3.257 20 5 GGBDRN CCOc1cc(C)ccc1CNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000121886046 1414291063 /nfs/dbraw/zinc/29/10/63/1414291063.db2.gz QPTBBTRUTVHNPT-UHFFFAOYSA-N 0 0 385.420 3.174 20 5 GGBDRN Cc1nc(NC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)ccc1[N+](=O)[O-] ZINC000121899115 1414297790 /nfs/dbraw/zinc/29/77/90/1414297790.db2.gz GVFDHAWZLNPVCX-SNVBAGLBSA-N 0 0 392.774 3.082 20 5 GGBDRN COC(=O)c1cc(C(=O)N(C)[C@H](C)c2cc(F)ccc2F)cc([N+](=O)[O-])c1 ZINC000121904104 1414300530 /nfs/dbraw/zinc/30/05/30/1414300530.db2.gz ABKZAFDRXZFAKU-SNVBAGLBSA-N 0 0 378.331 3.493 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)CC2CCOCC2)CC1 ZINC000121909354 1414302952 /nfs/dbraw/zinc/30/29/52/1414302952.db2.gz ZQHLNWURKDXZSD-UHFFFAOYSA-N 0 0 375.469 3.330 20 5 GGBDRN Cc1c(C(=O)N(C)CCOc2ccccc2F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000121916222 1414306061 /nfs/dbraw/zinc/30/60/61/1414306061.db2.gz LYXDPDIRZFVSPX-UHFFFAOYSA-N 0 0 391.355 3.410 20 5 GGBDRN Cc1cc(C(=O)NCc2cccc(COCC(F)(F)F)c2)c(N)c([N+](=O)[O-])c1 ZINC000121923858 1414308624 /nfs/dbraw/zinc/30/86/24/1414308624.db2.gz OXRVOEJASBNXRJ-UHFFFAOYSA-N 0 0 397.353 3.494 20 5 GGBDRN CN(c1ccc(F)cc1)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000121926087 1414309581 /nfs/dbraw/zinc/30/95/81/1414309581.db2.gz LXRWSUZWPOGAFR-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC[C@@H](c3nnc4ccccn43)C2)c1[N+](=O)[O-] ZINC000121932438 1414312308 /nfs/dbraw/zinc/31/23/08/1414312308.db2.gz WIACQMSWVVFERR-CYBMUJFWSA-N 0 0 383.383 3.105 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc1[N+](=O)[O-] ZINC000121932947 1414313008 /nfs/dbraw/zinc/31/30/08/1414313008.db2.gz YYFLVYQUGGJCSK-UKRRQHHQSA-N 0 0 387.415 3.076 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000121934970 1414313713 /nfs/dbraw/zinc/31/37/13/1414313713.db2.gz TUHGHNRFNBJQKC-UHFFFAOYSA-N 0 0 396.403 3.309 20 5 GGBDRN Cc1sc(C(=O)OCCn2cnc([N+](=O)[O-])n2)cc1-c1ccc(F)cc1 ZINC000121937639 1414314894 /nfs/dbraw/zinc/31/48/94/1414314894.db2.gz RSRSYHGGXQLQTM-UHFFFAOYSA-N 0 0 376.369 3.219 20 5 GGBDRN CCc1cccc(Oc2ccc(NC(=O)NCCn3cc([N+](=O)[O-])cn3)cn2)c1 ZINC000121940169 1414315800 /nfs/dbraw/zinc/31/58/00/1414315800.db2.gz JOTMMSROFPAZEF-UHFFFAOYSA-N 0 0 396.407 3.363 20 5 GGBDRN CCN(C(=O)c1cccc([N+](=O)[O-])c1C)c1ccccc1S(=O)(=O)CC ZINC000177575788 1428800647 /nfs/dbraw/zinc/80/06/47/1428800647.db2.gz DSAYFQKPPJQPMS-UHFFFAOYSA-N 0 0 376.434 3.364 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1nc(C(C)C)cs1 ZINC000121956164 1414323038 /nfs/dbraw/zinc/32/30/38/1414323038.db2.gz RRQHVZLUWPTPGQ-UHFFFAOYSA-N 0 0 376.438 3.046 20 5 GGBDRN CCNC(=O)c1cc(Cl)ccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000121976251 1414329016 /nfs/dbraw/zinc/32/90/16/1414329016.db2.gz SFPOAEYIWZHDSM-UHFFFAOYSA-N 0 0 375.812 3.488 20 5 GGBDRN O=C(Nc1cnn(CC(F)F)c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000121981815 1414331316 /nfs/dbraw/zinc/33/13/16/1414331316.db2.gz IDENERQJTDMFNC-UHFFFAOYSA-N 0 0 377.254 3.302 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@H]1CCOC2(CCCCC2)C1 ZINC000121999322 1414336400 /nfs/dbraw/zinc/33/64/00/1414336400.db2.gz OCMDAJRDZWSOPB-HNNXBMFYSA-N 0 0 389.452 3.148 20 5 GGBDRN Cn1ccnc1COc1ccc(COC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000122008735 1414339119 /nfs/dbraw/zinc/33/91/19/1414339119.db2.gz TXDZRVSFIMZBMU-UHFFFAOYSA-N 0 0 385.351 3.403 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCC1(Cc2ccccc2)CC1 ZINC000122022890 1414342245 /nfs/dbraw/zinc/34/22/45/1414342245.db2.gz SBSUDTQNKKGECX-UHFFFAOYSA-N 0 0 381.432 3.289 20 5 GGBDRN Cc1cccc([C@H](CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)N2CCOCC2)c1 ZINC000122023655 1414342787 /nfs/dbraw/zinc/34/27/87/1414342787.db2.gz OMVHQCJCGZZEQM-FQEVSTJZSA-N 0 0 383.448 3.015 20 5 GGBDRN COc1cc(F)c(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2F)cc1F ZINC000122027977 1414343141 /nfs/dbraw/zinc/34/31/41/1414343141.db2.gz AKBJDYHXOOFEGN-UHFFFAOYSA-N 0 0 376.312 3.130 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000122038206 1414345242 /nfs/dbraw/zinc/34/52/42/1414345242.db2.gz FIELLDKRVUHBOU-LJQANCHMSA-N 0 0 382.416 3.180 20 5 GGBDRN CCC(C)(C)[C@@H]1CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000122043559 1414346864 /nfs/dbraw/zinc/34/68/64/1414346864.db2.gz JJLXKSLIOPGNMF-AWEZNQCLSA-N 0 0 381.860 3.405 20 5 GGBDRN CC(C)(C)OC(=O)NC1(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000177577770 1428801067 /nfs/dbraw/zinc/80/10/67/1428801067.db2.gz AEGQSJUAOLFWHI-UHFFFAOYSA-N 0 0 377.441 3.091 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cc2c(cc1F)NC(=O)CC2 ZINC000122070134 1414354685 /nfs/dbraw/zinc/35/46/85/1414354685.db2.gz MLLBHOILDMRUNN-UHFFFAOYSA-N 0 0 377.759 3.453 20 5 GGBDRN Cc1c(C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000122081820 1414357828 /nfs/dbraw/zinc/35/78/28/1414357828.db2.gz CSZMUUIDHFTMMY-UHFFFAOYSA-N 0 0 388.311 3.088 20 5 GGBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OS(=O)(=O)CC1CCOCC1 ZINC000177578389 1428801551 /nfs/dbraw/zinc/80/15/51/1428801551.db2.gz LBVOVOBSFFSPEY-UHFFFAOYSA-N 0 0 391.445 3.321 20 5 GGBDRN COc1cccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1OC ZINC000122091813 1414360948 /nfs/dbraw/zinc/36/09/48/1414360948.db2.gz DLPDPKMWGYLBFD-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN Cc1ccc([C@@H](CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)N2CCOCC2)cc1 ZINC000122107506 1414364592 /nfs/dbraw/zinc/36/45/92/1414364592.db2.gz RFQDAKOBKAYXSJ-HXUWFJFHSA-N 0 0 383.448 3.015 20 5 GGBDRN CCC1(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CCCC1 ZINC000122113362 1414365262 /nfs/dbraw/zinc/36/52/62/1414365262.db2.gz WIUXUXSBBOOWHO-UHFFFAOYSA-N 0 0 385.367 3.221 20 5 GGBDRN COc1cc(CCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1O ZINC000122117371 1414366500 /nfs/dbraw/zinc/36/65/00/1414366500.db2.gz UJTBTYKEZQVCAK-UHFFFAOYSA-N 0 0 385.420 3.226 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)cc([N+](=O)[O-])c1 ZINC000122120194 1414367221 /nfs/dbraw/zinc/36/72/21/1414367221.db2.gz XZLRDKOQOHYIJN-GASCZTMLSA-N 0 0 397.431 3.405 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000122140511 1414371550 /nfs/dbraw/zinc/37/15/50/1414371550.db2.gz ONDDROVGNYSOGE-GFCCVEGCSA-N 0 0 396.852 3.231 20 5 GGBDRN C[C@@H]1CN(c2ccccc2NC(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000122141647 1414372250 /nfs/dbraw/zinc/37/22/50/1414372250.db2.gz HLIMBSCYCJUPKG-HUUCEWRRSA-N 0 0 385.420 3.226 20 5 GGBDRN NC(=O)CCN(Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000122142366 1414372259 /nfs/dbraw/zinc/37/22/59/1414372259.db2.gz DZWXOIRJCSQVMQ-UHFFFAOYSA-N 0 0 379.363 3.074 20 5 GGBDRN CC1(C)CCCC[C@H]1NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000122153994 1414375008 /nfs/dbraw/zinc/37/50/08/1414375008.db2.gz POVHBHXSJCNCHB-CYBMUJFWSA-N 0 0 385.367 3.220 20 5 GGBDRN COc1ccc(C2(CNC(=O)c3cc(C)cc([N+](=O)[O-])c3)CCOCC2)cc1 ZINC000122154888 1414375369 /nfs/dbraw/zinc/37/53/69/1414375369.db2.gz QZCUWICPOURVKD-UHFFFAOYSA-N 0 0 384.432 3.390 20 5 GGBDRN O=C(NCCc1nc2ccccc2s1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000122158711 1414376078 /nfs/dbraw/zinc/37/60/78/1414376078.db2.gz JLZCIPUPDHITGC-UHFFFAOYSA-N 0 0 393.428 3.363 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CC(=O)NC(C)(C)C ZINC000122163848 1414377977 /nfs/dbraw/zinc/37/79/77/1414377977.db2.gz IZSPXRURYVMZBD-UHFFFAOYSA-N 0 0 381.498 3.330 20 5 GGBDRN COC(=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 ZINC000122175044 1414379823 /nfs/dbraw/zinc/37/98/23/1414379823.db2.gz KUEOPQCIMUHASY-UHFFFAOYSA-N 0 0 383.404 3.163 20 5 GGBDRN O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)NCCn1cc([N+](=O)[O-])cn1 ZINC000122174347 1414379873 /nfs/dbraw/zinc/37/98/73/1414379873.db2.gz VXTCWCWLBLQUOV-DAFODLJHSA-N 0 0 388.733 3.293 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@H](C)c1cccc(F)c1F ZINC000122176843 1414380813 /nfs/dbraw/zinc/38/08/13/1414380813.db2.gz WTKIRUOKPPKYCM-LLVKDONJSA-N 0 0 377.347 3.306 20 5 GGBDRN COc1cc(C)nc(COC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000122184546 1414382796 /nfs/dbraw/zinc/38/27/96/1414382796.db2.gz IQIJTTWSKDZVHS-UHFFFAOYSA-N 0 0 381.182 3.426 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)CCc3cccc([N+](=O)[O-])c3)cn2)n1 ZINC000122197128 1414386006 /nfs/dbraw/zinc/38/60/06/1414386006.db2.gz UAOAVXWWGVGNHN-UHFFFAOYSA-N 0 0 379.420 3.041 20 5 GGBDRN Cc1c(CC(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)cccc1[N+](=O)[O-] ZINC000122207464 1414388337 /nfs/dbraw/zinc/38/83/37/1414388337.db2.gz FCDNBOWIJBGHEW-HNNXBMFYSA-N 0 0 387.823 3.021 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 ZINC000122214671 1414391047 /nfs/dbraw/zinc/39/10/47/1414391047.db2.gz CXGGACVTWOOBGE-CYBMUJFWSA-N 0 0 396.440 3.242 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(Cn3cncn3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122218026 1414392051 /nfs/dbraw/zinc/39/20/51/1414392051.db2.gz FSJQXCJGIZOVJL-UHFFFAOYSA-N 0 0 396.363 3.012 20 5 GGBDRN Cc1c(C(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1CCO[C@H]1CCCCO1 ZINC000122262477 1414404812 /nfs/dbraw/zinc/40/48/12/1414404812.db2.gz LUKMLMJLXWBHQQ-SFHVURJKSA-N 0 0 388.424 3.204 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3c(c2)CCC(=O)N3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122274414 1414408437 /nfs/dbraw/zinc/40/84/37/1414408437.db2.gz MNHOYYYRXQYEAZ-UHFFFAOYSA-N 0 0 384.348 3.257 20 5 GGBDRN CCN(C(=O)[C@H](C)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CCCCC1 ZINC000122276881 1414408860 /nfs/dbraw/zinc/40/88/60/1414408860.db2.gz WHAISLJOJNXBRW-HOTGVXAUSA-N 0 0 389.500 3.046 20 5 GGBDRN COc1ccccc1C[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000177593160 1428805877 /nfs/dbraw/zinc/80/58/77/1428805877.db2.gz ZEVCOOLBYZMVRE-SFHVURJKSA-N 0 0 392.477 3.290 20 5 GGBDRN COCCN(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000122310022 1414419917 /nfs/dbraw/zinc/41/99/17/1414419917.db2.gz HETQLBITJFPGRV-UHFFFAOYSA-N 0 0 377.353 3.002 20 5 GGBDRN Cc1nn(CCC(=O)Nc2c(-c3ccco3)nc3ccccn32)c(C)c1[N+](=O)[O-] ZINC000177617548 1428812065 /nfs/dbraw/zinc/81/20/65/1428812065.db2.gz QVTJFFZCLYDKGI-UHFFFAOYSA-N 0 0 394.391 3.345 20 5 GGBDRN C[C@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C(=O)N1CCCC[C@@H]1C ZINC000122311461 1414420797 /nfs/dbraw/zinc/42/07/97/1414420797.db2.gz AKPUKJDJSOBALX-GJZGRUSLSA-N 0 0 388.468 3.058 20 5 GGBDRN CCc1noc(C)c1COc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-] ZINC000122319672 1414422385 /nfs/dbraw/zinc/42/23/85/1414422385.db2.gz MKNQISVSCHISFU-UHFFFAOYSA-N 0 0 397.453 3.063 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)c1cc(F)ccc1F ZINC000122327605 1414425099 /nfs/dbraw/zinc/42/50/99/1414425099.db2.gz UYRQTUWUZFCJCO-CQSZACIVSA-N 0 0 386.376 3.311 20 5 GGBDRN Cc1ccc(NC(=O)N2CCOC[C@H]2C[C@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000122330899 1414425726 /nfs/dbraw/zinc/42/57/26/1414425726.db2.gz WRVJDMBJEONXIB-ZBFHGGJFSA-N 0 0 391.449 3.321 20 5 GGBDRN Cc1ccc(NC(=O)N2CCOC[C@@H]2C[C@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000122330676 1414425772 /nfs/dbraw/zinc/42/57/72/1414425772.db2.gz WRVJDMBJEONXIB-HOCLYGCPSA-N 0 0 391.449 3.321 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOC[C@H]1C[C@H](O)c1cccs1 ZINC000122333723 1414426671 /nfs/dbraw/zinc/42/66/71/1414426671.db2.gz MQLSBPUULNYLHP-ZBFHGGJFSA-N 0 0 391.449 3.321 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122351731 1414432021 /nfs/dbraw/zinc/43/20/21/1414432021.db2.gz CRWJOMZEICEXSD-UHFFFAOYSA-N 0 0 398.438 3.297 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cnn(-c3ccccc3)c2)cc1OC ZINC000122355718 1414432739 /nfs/dbraw/zinc/43/27/39/1414432739.db2.gz GVOMGUCHMYDUAB-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccc(Cl)c(C)c1 ZINC000122354574 1414432961 /nfs/dbraw/zinc/43/29/61/1414432961.db2.gz PBKKIWLBTRQGCP-UHFFFAOYSA-N 0 0 375.812 3.428 20 5 GGBDRN O=C(COc1ccc(Oc2ccccn2)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000122355604 1414433033 /nfs/dbraw/zinc/43/30/33/1414433033.db2.gz NCNBTFVYDVSWMP-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN Cc1cc(S(C)(=O)=O)cc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1C ZINC000122361333 1414434568 /nfs/dbraw/zinc/43/45/68/1414434568.db2.gz DKIVGHKIUOINOD-UHFFFAOYSA-N 0 0 376.434 3.484 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1cccc(COCC2CC2)c1 ZINC000122364305 1414435134 /nfs/dbraw/zinc/43/51/34/1414435134.db2.gz LBVNZTRPSCBALF-UHFFFAOYSA-N 0 0 383.404 3.407 20 5 GGBDRN C[C@H](CCC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000122377424 1414439521 /nfs/dbraw/zinc/43/95/21/1414439521.db2.gz OSYONQTXPBFUJI-QGZVFWFLSA-N 0 0 395.459 3.463 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCC[C@H](COc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000122384183 1414442359 /nfs/dbraw/zinc/44/23/59/1414442359.db2.gz OBEFTHZBKSDPNR-ZDUSSCGKSA-N 0 0 392.843 3.221 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCC[C@@H](COc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000122384399 1414442441 /nfs/dbraw/zinc/44/24/41/1414442441.db2.gz OBEFTHZBKSDPNR-CYBMUJFWSA-N 0 0 392.843 3.221 20 5 GGBDRN CC[C@H](NC(=O)c1csc([N+](=O)[O-])c1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000177606582 1428808974 /nfs/dbraw/zinc/80/89/74/1428808974.db2.gz ZFDQPDQQIHPRKP-IRXDYDNUSA-N 0 0 389.477 3.066 20 5 GGBDRN Cc1cccc(COc2cccc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)c2)c1 ZINC000122392276 1414444957 /nfs/dbraw/zinc/44/49/57/1414444957.db2.gz ILBLQCCCZKFZAK-UHFFFAOYSA-N 0 0 393.399 3.283 20 5 GGBDRN Cc1c(CC(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000122406440 1414448743 /nfs/dbraw/zinc/44/87/43/1414448743.db2.gz JBBCTEAIZITFMP-ZDUSSCGKSA-N 0 0 379.457 3.065 20 5 GGBDRN COc1cccc2c1CC[C@H]2NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000122410832 1414450828 /nfs/dbraw/zinc/45/08/28/1414450828.db2.gz QRKSDUJQZGVHHF-GOSISDBHSA-N 0 0 392.415 3.421 20 5 GGBDRN COCCNC(=O)c1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1Cl ZINC000122412090 1414451574 /nfs/dbraw/zinc/45/15/74/1414451574.db2.gz POKANFCEYIKHKR-UHFFFAOYSA-N 0 0 395.774 3.016 20 5 GGBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000122423238 1414454968 /nfs/dbraw/zinc/45/49/68/1414454968.db2.gz ANFKRULROSTRBH-UHFFFAOYSA-N 0 0 381.392 3.194 20 5 GGBDRN Cc1nn(CCC(=O)NCc2ccc(C)cc2OCC2CC2)c(C)c1[N+](=O)[O-] ZINC000122450105 1414464249 /nfs/dbraw/zinc/46/42/49/1414464249.db2.gz IEADOAKBSOLPAY-UHFFFAOYSA-N 0 0 386.452 3.212 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000122450169 1414464333 /nfs/dbraw/zinc/46/43/33/1414464333.db2.gz BJIDTGFKEDGFNG-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN CCNC(=O)c1cccc(OC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000122462646 1414468712 /nfs/dbraw/zinc/46/87/12/1414468712.db2.gz UODYFQIZGCJPNU-UHFFFAOYSA-N 0 0 383.404 3.164 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)cc([N+](=O)[O-])c1 ZINC000122474924 1414473334 /nfs/dbraw/zinc/47/33/34/1414473334.db2.gz LVYJJMDLSFYOTE-UHFFFAOYSA-N 0 0 385.395 3.077 20 5 GGBDRN Cc1c(NC(=O)N2CCOC[C@@H]2C[C@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000122499443 1414483113 /nfs/dbraw/zinc/48/31/13/1414483113.db2.gz QPJZCCMDLCBJTG-BBRMVZONSA-N 0 0 391.449 3.321 20 5 GGBDRN Cc1c(NC(=O)N2CCOC[C@H]2C[C@@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000122500066 1414483118 /nfs/dbraw/zinc/48/31/18/1414483118.db2.gz QPJZCCMDLCBJTG-CZUORRHYSA-N 0 0 391.449 3.321 20 5 GGBDRN Cc1cc(NC(=O)C[C@H]2CSCCS2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122506590 1414484752 /nfs/dbraw/zinc/48/47/52/1414484752.db2.gz LVHWKXNYAUQLJT-AWEZNQCLSA-N 0 0 378.479 3.266 20 5 GGBDRN O=C(NC[C@H]1CCC[C@H](O)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000122511699 1414486144 /nfs/dbraw/zinc/48/61/44/1414486144.db2.gz RJJOVCLNHQIHPP-WMZOPIPTSA-N 0 0 383.448 3.488 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1C ZINC000122511288 1414486148 /nfs/dbraw/zinc/48/61/48/1414486148.db2.gz CCBPZNZGYMSKEN-UHFFFAOYSA-N 0 0 377.422 3.226 20 5 GGBDRN Cc1cscc1CNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000122533951 1414492314 /nfs/dbraw/zinc/49/23/14/1414492314.db2.gz WGGAOFPKBVBTNK-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1nnc([C@H]2Cc3ccccc3CN2C(=O)CNc2ccccc2[N+](=O)[O-])o1 ZINC000122535970 1414492921 /nfs/dbraw/zinc/49/29/21/1414492921.db2.gz OULMAZWUEHABPX-GOSISDBHSA-N 0 0 393.403 3.024 20 5 GGBDRN O=C(NCCc1cc2ccccc2o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000122551739 1414498151 /nfs/dbraw/zinc/49/81/51/1414498151.db2.gz RIYVEMOUMQSBNO-UHFFFAOYSA-N 0 0 387.779 3.292 20 5 GGBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000122568492 1414503707 /nfs/dbraw/zinc/50/37/07/1414503707.db2.gz AAIRAYWWJJDDDG-CQSZACIVSA-N 0 0 380.404 3.237 20 5 GGBDRN O=C(NCc1ccc(C(=O)Nc2ccncc2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000122580667 1414507573 /nfs/dbraw/zinc/50/75/73/1414507573.db2.gz QPDFYSKZXGAGBQ-UHFFFAOYSA-N 0 0 376.372 3.172 20 5 GGBDRN Cc1cc([C@H]2CN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3C)CCO2)ccc1F ZINC000122592141 1414510547 /nfs/dbraw/zinc/51/05/47/1414510547.db2.gz QGTOKDGWUKHOGL-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN CCN(CC)C(=O)c1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122607136 1414515437 /nfs/dbraw/zinc/51/54/37/1414515437.db2.gz AUWFZGXGBQUWBF-UHFFFAOYSA-N 0 0 381.392 3.205 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2cnccc21 ZINC000122612385 1414517041 /nfs/dbraw/zinc/51/70/41/1414517041.db2.gz RXBLSJBKGNRRSM-UHFFFAOYSA-N 0 0 392.415 3.221 20 5 GGBDRN CSc1ccccc1NC(=O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000122612651 1414517062 /nfs/dbraw/zinc/51/70/62/1414517062.db2.gz OKHZEPVVKIGAHG-UHFFFAOYSA-N 0 0 387.461 3.394 20 5 GGBDRN COc1cc(C(=O)N[C@H](C2CCCC2)C(F)(F)F)c([N+](=O)[O-])cc1OC ZINC000177625808 1428814888 /nfs/dbraw/zinc/81/48/88/1428814888.db2.gz RMFQSDJOGOBXPO-CQSZACIVSA-N 0 0 376.331 3.463 20 5 GGBDRN C[C@@H](c1ccccc1)N1C[C@@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC1=O ZINC000122618460 1414520012 /nfs/dbraw/zinc/52/00/12/1414520012.db2.gz DQMAWQOXIFHGKC-JSGCOSHPSA-N 0 0 393.403 3.019 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000122623168 1414520630 /nfs/dbraw/zinc/52/06/30/1414520630.db2.gz DLZGXOYAVCPMKU-INIZCTEOSA-N 0 0 387.392 3.225 20 5 GGBDRN Cc1ccc2nc(CSCC(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)cn2c1 ZINC000122627341 1414522338 /nfs/dbraw/zinc/52/23/38/1414522338.db2.gz IRBLOELQVAZWNM-UHFFFAOYSA-N 0 0 396.432 3.299 20 5 GGBDRN Cc1ccc(NC(=O)NCC(=O)Nc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000122631219 1414523796 /nfs/dbraw/zinc/52/37/96/1414523796.db2.gz OALOBESVBQNKOW-UHFFFAOYSA-N 0 0 379.376 3.212 20 5 GGBDRN Cc1cc([C@@H]2CN(S(=O)(=O)c3c(C)cccc3[N+](=O)[O-])CCO2)ccc1F ZINC000122636916 1414525050 /nfs/dbraw/zinc/52/50/50/1414525050.db2.gz ZBWIWBLCIYPTBG-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN CC(C)=C[C@@H]1[C@H](C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1(C)C ZINC000122635120 1414525126 /nfs/dbraw/zinc/52/51/26/1414525126.db2.gz FZZSXAPWSKPSQM-QZTJIDSGSA-N 0 0 385.464 3.118 20 5 GGBDRN COc1nn(C)c2nc(C)c(CCC(=O)Oc3cccc([N+](=O)[O-])c3)c(C)c12 ZINC000122640339 1414526268 /nfs/dbraw/zinc/52/62/68/1414526268.db2.gz ABJPLVLGGJXUMR-UHFFFAOYSA-N 0 0 384.392 3.040 20 5 GGBDRN COc1cccc2c1CC[C@H]2NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000177627197 1428815418 /nfs/dbraw/zinc/81/54/18/1428815418.db2.gz GXQXTBCKRPJODZ-QGZVFWFLSA-N 0 0 396.447 3.123 20 5 GGBDRN C[C@@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 ZINC000122647520 1414528367 /nfs/dbraw/zinc/52/83/67/1414528367.db2.gz MVVBEMLXLQYTPE-INIZCTEOSA-N 0 0 387.480 3.486 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000122648123 1414528382 /nfs/dbraw/zinc/52/83/82/1414528382.db2.gz IYYKNUPYNUZIGV-ZDUSSCGKSA-N 0 0 399.794 3.116 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000122653054 1414529381 /nfs/dbraw/zinc/52/93/81/1414529381.db2.gz ZIUVVZQYJMPPAY-UHFFFAOYSA-N 0 0 376.796 3.488 20 5 GGBDRN CC(C)NC(=O)Nc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122654902 1414530284 /nfs/dbraw/zinc/53/02/84/1414530284.db2.gz HSRDNZJWTITEPF-UHFFFAOYSA-N 0 0 382.380 3.253 20 5 GGBDRN Cc1cc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc23)c2cnn(C(C)C)c2n1 ZINC000122659252 1414531533 /nfs/dbraw/zinc/53/15/33/1414531533.db2.gz ZGDGFTPRMUWYAP-UHFFFAOYSA-N 0 0 379.380 3.357 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122662590 1414532257 /nfs/dbraw/zinc/53/22/57/1414532257.db2.gz CWPMOMUEUKJUNH-UHFFFAOYSA-N 0 0 384.352 3.210 20 5 GGBDRN C[C@H]1C[C@H](c2ccc(F)cc2)CN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000122664933 1414532904 /nfs/dbraw/zinc/53/29/04/1414532904.db2.gz SUSKNYRODVHGHY-AAEUAGOBSA-N 0 0 382.388 3.440 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000122665361 1414532971 /nfs/dbraw/zinc/53/29/71/1414532971.db2.gz SUSKNYRODVHGHY-WCQYABFASA-N 0 0 382.388 3.440 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccccc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000122678163 1414536555 /nfs/dbraw/zinc/53/65/55/1414536555.db2.gz AQRNZAONMNUYMT-XHDPSFHLSA-N 0 0 384.841 3.039 20 5 GGBDRN CC(C)(CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000122680955 1414537293 /nfs/dbraw/zinc/53/72/93/1414537293.db2.gz NNVMJWFVACPKSW-UHFFFAOYSA-N 0 0 395.459 3.247 20 5 GGBDRN C[C@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1 ZINC000122694106 1414540513 /nfs/dbraw/zinc/54/05/13/1414540513.db2.gz MZLMKRCVJXMPTH-OAHLLOKOSA-N 0 0 399.422 3.212 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(Cn2cccn2)cc1 ZINC000122700948 1414542232 /nfs/dbraw/zinc/54/22/32/1414542232.db2.gz AJQPTAHRAMCWLD-UHFFFAOYSA-N 0 0 394.387 3.253 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@H]2CCC(C)C)nn1-c1ccccc1[N+](=O)[O-] ZINC000122701385 1414542638 /nfs/dbraw/zinc/54/26/38/1414542638.db2.gz XXYFRKDHQXFFSU-INIZCTEOSA-N 0 0 398.463 3.490 20 5 GGBDRN COc1ccc(NC(=O)CNC(=O)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000122709447 1414544925 /nfs/dbraw/zinc/54/49/25/1414544925.db2.gz ZHAKNZCBSJMHDZ-UHFFFAOYSA-N 0 0 398.202 3.279 20 5 GGBDRN O=C(N[C@@H](C1CCCC1)C(F)(F)F)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000177629892 1428816700 /nfs/dbraw/zinc/81/67/00/1428816700.db2.gz CNSYAIZMJHOKNY-AWEZNQCLSA-N 0 0 383.330 3.026 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1CCC[C@@H](O)C1 ZINC000122715596 1414546130 /nfs/dbraw/zinc/54/61/30/1414546130.db2.gz LUTPTAUDDPUNSV-DGCLKSJQSA-N 0 0 389.374 3.083 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000122715646 1414546428 /nfs/dbraw/zinc/54/64/28/1414546428.db2.gz WHUSTHQWRNLMQF-XHDPSFHLSA-N 0 0 384.841 3.039 20 5 GGBDRN CCOC(=O)CN(CC(F)(F)F)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000122721592 1414548395 /nfs/dbraw/zinc/54/83/95/1414548395.db2.gz LURBWRYIFAIAHI-UHFFFAOYSA-N 0 0 390.358 3.460 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])n1 ZINC000122727179 1414550021 /nfs/dbraw/zinc/55/00/21/1414550021.db2.gz BVPHSBVUYDCJKQ-AWEZNQCLSA-N 0 0 381.841 3.477 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000122733520 1414552279 /nfs/dbraw/zinc/55/22/79/1414552279.db2.gz AIWBKRAUHBKLJC-SJLPKXTDSA-N 0 0 388.395 3.471 20 5 GGBDRN O=C(CC[C@H]1Cc2ccccc2NC1=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122738063 1414552607 /nfs/dbraw/zinc/55/26/07/1414552607.db2.gz ZCGGYDFQJOHRFG-LBPRGKRZSA-N 0 0 379.376 3.001 20 5 GGBDRN COc1cccc(C(C)(C)CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000122742065 1414554165 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1414808601 /nfs/dbraw/zinc/80/86/01/1414808601.db2.gz GKIUQVLGLKLFHY-UHFFFAOYSA-N 0 0 376.800 3.108 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1ccc(OCC(F)(F)F)cc1 ZINC000123680531 1414808885 /nfs/dbraw/zinc/80/88/85/1414808885.db2.gz GMAJLWSFRAXUKL-UHFFFAOYSA-N 0 0 383.326 3.264 20 5 GGBDRN CCn1c(SCc2cn3cccnc3n2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123690235 1414810089 /nfs/dbraw/zinc/81/00/89/1414810089.db2.gz SRSCZFRPWGHHKK-UHFFFAOYSA-N 0 0 381.421 3.208 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCc2c(F)cc(F)cc2C1 ZINC000123703845 1414812203 /nfs/dbraw/zinc/81/22/03/1414812203.db2.gz WZMGWRQDWDURQH-UHFFFAOYSA-N 0 0 388.779 3.273 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NC[C@@H]3CCC[C@H](O)C3)cc2[N+](=O)[O-])CC1 ZINC000123715232 1414814049 /nfs/dbraw/zinc/81/40/49/1414814049.db2.gz IXNMKQPJQOGVSM-WBVHZDCISA-N 0 0 375.469 3.112 20 5 GGBDRN CCCn1ncc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1C1CC1 ZINC000123719188 1414814927 /nfs/dbraw/zinc/81/49/27/1414814927.db2.gz PTMYLHTUDDJEMP-UHFFFAOYSA-N 0 0 383.452 3.041 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc2oc(C3CC3)nc2c1 ZINC000123725771 1414816244 /nfs/dbraw/zinc/81/62/44/1414816244.db2.gz LXAZIMFMQILCKO-UHFFFAOYSA-N 0 0 394.343 3.160 20 5 GGBDRN CCC[C@@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1nnc2ccccn21 ZINC000123748042 1414819675 /nfs/dbraw/zinc/81/96/75/1414819675.db2.gz WSCNBFHBDGUTOR-QGZVFWFLSA-N 0 0 394.435 3.247 20 5 GGBDRN O=C(NCCOc1ncccc1Cl)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000123751717 1414820257 /nfs/dbraw/zinc/82/02/57/1414820257.db2.gz UIVKFHDAIRVOKQ-UHFFFAOYSA-N 0 0 390.827 3.396 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])OCc1noc(-c2cccc(Cl)c2)n1 ZINC000123753726 1414820562 /nfs/dbraw/zinc/82/05/62/1414820562.db2.gz WFDLQZRYZAXMBO-UHFFFAOYSA-N 0 0 389.751 3.420 20 5 GGBDRN COCc1cc(N2CCN(c3cccc([N+](=O)[O-])c3)CC2)nc(C(C)(C)C)n1 ZINC000123761265 1414820823 /nfs/dbraw/zinc/82/08/23/1414820823.db2.gz FMMNLPCMRVVPKZ-UHFFFAOYSA-N 0 0 385.468 3.155 20 5 GGBDRN COCCCCN(Cc1ccccc1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123763567 1414821287 /nfs/dbraw/zinc/82/12/87/1414821287.db2.gz TXPDFSFZQDBPCB-UHFFFAOYSA-N 0 0 396.440 3.351 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000123764619 1414821383 /nfs/dbraw/zinc/82/13/83/1414821383.db2.gz HNPDKWBVGDRJEO-UHFFFAOYSA-N 0 0 379.420 3.397 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)cc(F)cc1[N+](=O)[O-] ZINC000123762755 1414821429 /nfs/dbraw/zinc/82/14/29/1414821429.db2.gz DVFPHEBCYYGAAG-RHSMWYFYSA-N 0 0 391.374 3.184 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc([N+](=O)[O-])c(F)c1 ZINC000123783423 1414824086 /nfs/dbraw/zinc/82/40/86/1414824086.db2.gz ZVSULIFGIBSFBM-UHFFFAOYSA-N 0 0 390.732 3.372 20 5 GGBDRN CCn1c(COc2ccc(C)cc2)nnc1SCCn1cc([N+](=O)[O-])cn1 ZINC000123791392 1414825076 /nfs/dbraw/zinc/82/50/76/1414825076.db2.gz AKZVVXXEJLLLPT-UHFFFAOYSA-N 0 0 388.453 3.082 20 5 GGBDRN O=C(NCCCOCC(F)(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000123813711 1414828037 /nfs/dbraw/zinc/82/80/37/1414828037.db2.gz OIZKUAWLVPPGAY-UHFFFAOYSA-N 0 0 389.355 3.417 20 5 GGBDRN CC(C)Oc1cccc(CN(C)C(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000123818989 1414829226 /nfs/dbraw/zinc/82/92/26/1414829226.db2.gz NJBPQJRZKRPLJH-OAHLLOKOSA-N 0 0 399.447 3.159 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[C@@H](O)c2ccc(F)cc2)cc1C ZINC000123845606 1414833579 /nfs/dbraw/zinc/83/35/79/1414833579.db2.gz HNTHZILSRGGZGP-SUMWQHHRSA-N 0 0 396.440 3.141 20 5 GGBDRN O=[N+]([O-])c1ccc(I)c(OC[C@@H](O)Cc2ccccc2)c1 ZINC000123859605 1414836910 /nfs/dbraw/zinc/83/69/10/1414836910.db2.gz PJRYEOVXMDCUEZ-ZDUSSCGKSA-N 0 0 399.184 3.182 20 5 GGBDRN Cc1cccc2c(CC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)c[nH]c21 ZINC000123868686 1414838960 /nfs/dbraw/zinc/83/89/60/1414838960.db2.gz BEOFXPROCCMPRI-UHFFFAOYSA-N 0 0 378.432 3.276 20 5 GGBDRN Cc1csc(CCCNS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)n1 ZINC000123899541 1414846431 /nfs/dbraw/zinc/84/64/31/1414846431.db2.gz SUYOYTADRRXVOZ-UHFFFAOYSA-N 0 0 389.886 3.233 20 5 GGBDRN Cc1cccc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c1Br ZINC000123910737 1414847853 /nfs/dbraw/zinc/84/78/53/1414847853.db2.gz BNQUZDROADLISJ-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN COc1cc(C(=O)OCC2CCN(c3ncccc3[N+](=O)[O-])CC2)ccc1F ZINC000123955087 1414857061 /nfs/dbraw/zinc/85/70/61/1414857061.db2.gz YPZVPIPDPKWAML-UHFFFAOYSA-N 0 0 389.383 3.211 20 5 GGBDRN O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000123998544 1414866262 /nfs/dbraw/zinc/86/62/62/1414866262.db2.gz HKFSCBOVQWMURO-DNVCBOLYSA-N 0 0 391.493 3.324 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCCC[C@H]1C[C@@H](O)c1ccccc1 ZINC000124004438 1414867233 /nfs/dbraw/zinc/86/72/33/1414867233.db2.gz HBTRGIIGXRYHTL-PKOBYXMFSA-N 0 0 386.452 3.076 20 5 GGBDRN O=[N+]([O-])c1cnn(CC[S@@](=O)Cc2nc(-c3c(F)cccc3F)cs2)c1 ZINC000124004805 1414867339 /nfs/dbraw/zinc/86/73/39/1414867339.db2.gz RTBLDJFAABXGMP-SANMLTNESA-N 0 0 398.416 3.142 20 5 GGBDRN Cc1cccn2cc(CNCc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)nc12 ZINC000124021551 1414871547 /nfs/dbraw/zinc/87/15/47/1414871547.db2.gz MBOSNTWDLZXCEN-UHFFFAOYSA-N 0 0 376.420 3.241 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000124027985 1414871864 /nfs/dbraw/zinc/87/18/64/1414871864.db2.gz BDNHZHLQOJJBQM-KRWDZBQOSA-N 0 0 383.404 3.419 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1 ZINC000177728904 1428844096 /nfs/dbraw/zinc/84/40/96/1428844096.db2.gz MKZMRPJCRPLDLE-UHFFFAOYSA-N 0 0 393.852 3.392 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000124053422 1414877098 /nfs/dbraw/zinc/87/70/98/1414877098.db2.gz SELJPDBTSZWVSO-OAHLLOKOSA-N 0 0 395.506 3.254 20 5 GGBDRN CCN1C[C@H](COC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1=O ZINC000124069624 1414879659 /nfs/dbraw/zinc/87/96/59/1414879659.db2.gz ARZTXYKZBQYNKE-MRXNPFEDSA-N 0 0 397.431 3.232 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 ZINC000124068666 1414879703 /nfs/dbraw/zinc/87/97/03/1414879703.db2.gz BARFOSWZIKBCIE-HNNXBMFYSA-N 0 0 383.360 3.381 20 5 GGBDRN CCCNC(=O)[C@@H]1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000124086078 1414882557 /nfs/dbraw/zinc/88/25/57/1414882557.db2.gz NNIMEAOHKBMODT-OAHLLOKOSA-N 0 0 375.469 3.271 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)cc2)C[C@H](C)O1 ZINC000124088177 1414883021 /nfs/dbraw/zinc/88/30/21/1414883021.db2.gz OSMGUYOYNGSAKQ-IYBDPMFKSA-N 0 0 395.459 3.407 20 5 GGBDRN C[C@@H](c1cc(F)ccc1F)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000124093602 1414884269 /nfs/dbraw/zinc/88/42/69/1414884269.db2.gz CEGGNZOBDWFEMF-JTQLQIEISA-N 0 0 391.330 3.001 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccc2c(c1)CC(=O)N2 ZINC000124096476 1414884981 /nfs/dbraw/zinc/88/49/81/1414884981.db2.gz NSVKLDWFCITXFA-NSHDSACASA-N 0 0 376.372 3.129 20 5 GGBDRN Cc1nn(-c2ccc(C(=O)OCCn3cc([N+](=O)[O-])cn3)cc2)c(C)c1Cl ZINC000177736274 1428845627 /nfs/dbraw/zinc/84/56/27/1428845627.db2.gz NLCWTNFJAYBHRQ-UHFFFAOYSA-N 0 0 389.799 3.104 20 5 GGBDRN C[C@H](NC(=O)C1CCCCC1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000124106731 1414886538 /nfs/dbraw/zinc/88/65/38/1414886538.db2.gz PFCFDXVSHDLORK-HNNXBMFYSA-N 0 0 375.469 3.119 20 5 GGBDRN Cc1ccc(NC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000124149054 1414895663 /nfs/dbraw/zinc/89/56/63/1414895663.db2.gz RFVKOKAVHDOFOV-OAHLLOKOSA-N 0 0 376.457 3.309 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000124153019 1414896641 /nfs/dbraw/zinc/89/66/41/1414896641.db2.gz SHHAGRMEWVJNAZ-LBPRGKRZSA-N 0 0 382.848 3.264 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1N1CCC(CO)CC1 ZINC000124155229 1414897128 /nfs/dbraw/zinc/89/71/28/1414897128.db2.gz IBVRLVLEQMQVNZ-UHFFFAOYSA-N 0 0 398.463 3.163 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)Cc2cccc([N+](=O)[O-])c2C)nc1C ZINC000124169064 1414899118 /nfs/dbraw/zinc/89/91/18/1414899118.db2.gz YENOURDUCWKVOP-UHFFFAOYSA-N 0 0 377.422 3.050 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(OCCF)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000124195596 1414905970 /nfs/dbraw/zinc/90/59/70/1414905970.db2.gz CSYXHUQPRROVEM-UHFFFAOYSA-N 0 0 385.355 3.085 20 5 GGBDRN Cc1cc(C)c(OC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000124201873 1414907302 /nfs/dbraw/zinc/90/73/02/1414907302.db2.gz CJSOXGLKESVJOM-HNNXBMFYSA-N 0 0 377.441 3.195 20 5 GGBDRN O=C(CSc1cc(Cl)ccc1Cl)OCCn1cc([N+](=O)[O-])cn1 ZINC000177740115 1428847228 /nfs/dbraw/zinc/84/72/28/1428847228.db2.gz OQTUDGJYGHPYTR-UHFFFAOYSA-N 0 0 376.221 3.434 20 5 GGBDRN Cc1ccc(C(=O)c2ccccc2C(=O)OCCn2cc([N+](=O)[O-])cn2)cc1 ZINC000177740895 1428847294 /nfs/dbraw/zinc/84/72/94/1428847294.db2.gz SJXQOBIMIWXLDP-UHFFFAOYSA-N 0 0 379.372 3.188 20 5 GGBDRN CC[C@H](C)NC(=O)[C@H](C)Sc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000177756924 1428851105 /nfs/dbraw/zinc/85/11/05/1428851105.db2.gz BPCBSSZLJDBEPV-RYUDHWBXSA-N 0 0 377.470 3.269 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCc2ccc(Cl)cc2C1 ZINC000124235945 1414916684 /nfs/dbraw/zinc/91/66/84/1414916684.db2.gz BLJPBWKZUIDOKP-UHFFFAOYSA-N 0 0 383.791 3.288 20 5 GGBDRN Cc1ccc(C(=O)OCCOc2cncc(Br)c2)cc1[N+](=O)[O-] ZINC000124242021 1414918239 /nfs/dbraw/zinc/91/82/39/1414918239.db2.gz HNTVZSZJXBFNAY-UHFFFAOYSA-N 0 0 381.182 3.297 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H](O)c2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000124246835 1414918723 /nfs/dbraw/zinc/91/87/23/1414918723.db2.gz NVDSJAPGYJASMM-INIZCTEOSA-N 0 0 392.458 3.130 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCCOc1cncc(Br)c1 ZINC000124250903 1414920572 /nfs/dbraw/zinc/92/05/72/1414920572.db2.gz FAQQDMFRQWBFAP-ZZXKWVIFSA-N 0 0 393.193 3.388 20 5 GGBDRN CNC(=O)c1ccc(Cl)cc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000124268790 1414924948 /nfs/dbraw/zinc/92/49/48/1414924948.db2.gz JULWDDQLIORKQL-UHFFFAOYSA-N 0 0 387.783 3.270 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000124270355 1414925846 /nfs/dbraw/zinc/92/58/46/1414925846.db2.gz VBVOERXSHJVOIA-IAGOWNOFSA-N 0 0 391.468 3.480 20 5 GGBDRN CC(C)(NC(=O)CCc1cccc([N+](=O)[O-])c1)C(=O)NCC1CCCCC1 ZINC000124282093 1414928441 /nfs/dbraw/zinc/92/84/41/1414928441.db2.gz MPMFCKPHTWCQLB-UHFFFAOYSA-N 0 0 375.469 3.119 20 5 GGBDRN O=C(N[C@H]1CCO[C@]2(CCSC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000124291282 1414930824 /nfs/dbraw/zinc/93/08/24/1414930824.db2.gz VXRNZZFMHWESGK-HNAYVOBHSA-N 0 0 391.493 3.324 20 5 GGBDRN O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000124291702 1414930990 /nfs/dbraw/zinc/93/09/90/1414930990.db2.gz VXRNZZFMHWESGK-KXBFYZLASA-N 0 0 391.493 3.324 20 5 GGBDRN Cc1nc(-c2ccc(F)cc2)sc1C(=O)OCCn1cc([N+](=O)[O-])cn1 ZINC000177757402 1428850952 /nfs/dbraw/zinc/85/09/52/1428850952.db2.gz WPAYDMKXICDDQL-UHFFFAOYSA-N 0 0 376.369 3.219 20 5 GGBDRN CC(C)(NC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)NCC1CCCCC1 ZINC000124307418 1414935225 /nfs/dbraw/zinc/93/52/25/1414935225.db2.gz MOFKZZYGKJDLRM-UHFFFAOYSA-N 0 0 393.509 3.278 20 5 GGBDRN CCn1c(SCc2nc3cc([N+](=O)[O-])ccc3o2)nnc1-c1cnccn1 ZINC000124321968 1414938817 /nfs/dbraw/zinc/93/88/17/1414938817.db2.gz FRUWOXDQYKBZEG-UHFFFAOYSA-N 0 0 383.393 3.097 20 5 GGBDRN O=C(N[C@H](c1ccccc1)C(F)(F)F)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000124321635 1414938850 /nfs/dbraw/zinc/93/88/50/1414938850.db2.gz QPIZOBLLWUKDNX-OAHLLOKOSA-N 0 0 391.309 3.209 20 5 GGBDRN CCOC(=O)c1csc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000124331434 1414941356 /nfs/dbraw/zinc/94/13/56/1414941356.db2.gz BXMRYPAROKWDTK-UHFFFAOYSA-N 0 0 389.311 3.499 20 5 GGBDRN CC(C)c1ccc(-c2noc(CCC(=O)OCCn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000177749743 1428849508 /nfs/dbraw/zinc/84/95/08/1428849508.db2.gz VKOITQZZQOUVQZ-UHFFFAOYSA-N 0 0 399.407 3.141 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000124351183 1414946516 /nfs/dbraw/zinc/94/65/16/1414946516.db2.gz YGPPQHISWTZGDC-CQSZACIVSA-N 0 0 389.408 3.334 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCSc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000124350937 1414946671 /nfs/dbraw/zinc/94/66/71/1414946671.db2.gz AAFNRMAKSPHHNA-CQSZACIVSA-N 0 0 389.408 3.334 20 5 GGBDRN CC(C)(C)OC(=O)CCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000124396171 1414957064 /nfs/dbraw/zinc/95/70/64/1414957064.db2.gz ATVGCNYHZXHOLL-UHFFFAOYSA-N 0 0 377.422 3.180 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000124408055 1414960812 /nfs/dbraw/zinc/96/08/12/1414960812.db2.gz ZHUDTAIQDCHUCF-QGZVFWFLSA-N 0 0 398.337 3.367 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000124410042 1414961172 /nfs/dbraw/zinc/96/11/72/1414961172.db2.gz VAQNYRGBXJWWHR-KRWDZBQOSA-N 0 0 382.338 3.401 20 5 GGBDRN CN(C[C@H]1CCC[C@H]1O)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000124414832 1414962547 /nfs/dbraw/zinc/96/25/47/1414962547.db2.gz WLBZLWXHDMTLGG-OXQOHEQNSA-N 0 0 383.448 3.440 20 5 GGBDRN CCC(CC)n1ncc(C(=O)Nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)c1C ZINC000124424875 1414965477 /nfs/dbraw/zinc/96/54/77/1414965477.db2.gz GLHLRFHSHDKWAP-UHFFFAOYSA-N 0 0 383.412 3.498 20 5 GGBDRN O=C(CCc1ncc(-c2ccccc2Cl)o1)OCCn1cc([N+](=O)[O-])cn1 ZINC000177759084 1428851664 /nfs/dbraw/zinc/85/16/64/1428851664.db2.gz FGYDTLMUJXAIJE-UHFFFAOYSA-N 0 0 390.783 3.276 20 5 GGBDRN COc1ccc(NC(=O)CNc2ccccc2OCC(F)F)c([N+](=O)[O-])c1 ZINC000124435976 1414968303 /nfs/dbraw/zinc/96/83/03/1414968303.db2.gz WPIILOWHEXONNO-UHFFFAOYSA-N 0 0 381.335 3.298 20 5 GGBDRN COc1ccc2c(c1)C[C@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)CO2 ZINC000124438796 1414968955 /nfs/dbraw/zinc/96/89/55/1414968955.db2.gz ZTSFTYZZOINUAE-AWEZNQCLSA-N 0 0 390.823 3.467 20 5 GGBDRN Cc1nnc([C@H]2Cc3ccccc3CN2C(=O)Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000124442952 1414970046 /nfs/dbraw/zinc/97/00/46/1414970046.db2.gz JHXGDELHDXPZOD-LJQANCHMSA-N 0 0 392.415 3.463 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(CC(F)(F)F)[C@H](C)C1 ZINC000124471355 1414975943 /nfs/dbraw/zinc/97/59/43/1414975943.db2.gz DXVBRUKDIWUTNK-VXGBXAGGSA-N 0 0 391.415 3.170 20 5 GGBDRN Cc1nc(Cc2ccc(F)cc2)sc1C(=O)OCCn1cc([N+](=O)[O-])cn1 ZINC000177763739 1428852711 /nfs/dbraw/zinc/85/27/11/1428852711.db2.gz LWPYMESGDCNAJK-UHFFFAOYSA-N 0 0 390.396 3.143 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000124486619 1414979511 /nfs/dbraw/zinc/97/95/11/1414979511.db2.gz SBIGZNHNGPMTPT-INIZCTEOSA-N 0 0 379.338 3.287 20 5 GGBDRN O=C(NCc1cccc(Cl)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000124497747 1414982184 /nfs/dbraw/zinc/98/21/84/1414982184.db2.gz FDDVIHXSQLHTGD-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN Cn1c(COc2ccccc2)nnc1SCCOc1ccc([N+](=O)[O-])cc1 ZINC000124501144 1414982418 /nfs/dbraw/zinc/98/24/18/1414982418.db2.gz BWIBTQRDPYHFLJ-UHFFFAOYSA-N 0 0 386.433 3.473 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)CCOc1ccccc1[N+](=O)[O-] ZINC000124516819 1414985084 /nfs/dbraw/zinc/98/50/84/1414985084.db2.gz KZLAKZZLAGBEIQ-KRWDZBQOSA-N 0 0 398.337 3.237 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)CCOc1ccccc1[N+](=O)[O-] ZINC000124517066 1414985254 /nfs/dbraw/zinc/98/52/54/1414985254.db2.gz KZLAKZZLAGBEIQ-QGZVFWFLSA-N 0 0 398.337 3.237 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)Oc1c(F)cc(C=O)cc1F ZINC000124518645 1414985738 /nfs/dbraw/zinc/98/57/38/1414985738.db2.gz NXPGGVCLORSYST-UHFFFAOYSA-N 0 0 391.735 3.415 20 5 GGBDRN CCc1cnc(CN(C)[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000177765664 1428853283 /nfs/dbraw/zinc/85/32/83/1428853283.db2.gz WRTQLWPUGVDIFE-LLVKDONJSA-N 0 0 378.454 3.081 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)ccc1[N+](=O)[O-] ZINC000124544754 1414991110 /nfs/dbraw/zinc/99/11/10/1414991110.db2.gz WEWJHPRMWFHOHH-UHFFFAOYSA-N 0 0 382.376 3.133 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1 ZINC000124561370 1414994254 /nfs/dbraw/zinc/99/42/54/1414994254.db2.gz AJIYOPFBRWAOIR-UHFFFAOYSA-N 0 0 382.376 3.133 20 5 GGBDRN CCOc1ccc(NC(=O)CN(C)Cc2ncc(CC)s2)c([N+](=O)[O-])c1 ZINC000177769239 1428854189 /nfs/dbraw/zinc/85/41/89/1428854189.db2.gz BXUINDZQHQTVIP-UHFFFAOYSA-N 0 0 378.454 3.083 20 5 GGBDRN COc1cc(NC2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc(OC)c1 ZINC000124586596 1414999733 /nfs/dbraw/zinc/99/97/33/1414999733.db2.gz NJWMSRPLRMXYGB-UHFFFAOYSA-N 0 0 391.449 3.390 20 5 GGBDRN CCN(CCCOc1ccc([N+](=O)[O-])cc1)Cc1nc2ccccc2c(=O)[nH]1 ZINC000124586382 1414999954 /nfs/dbraw/zinc/99/99/54/1414999954.db2.gz FEQBXKGMIURBHO-UHFFFAOYSA-N 0 0 382.420 3.122 20 5 GGBDRN Cc1cncc(CNC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000124602384 1415003227 /nfs/dbraw/zinc/00/32/27/1415003227.db2.gz BOUDQFCDRNDHMI-UHFFFAOYSA-N 0 0 382.342 3.435 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)cc([N+](=O)[O-])c1 ZINC000124613414 1415005944 /nfs/dbraw/zinc/00/59/44/1415005944.db2.gz GOKYDXHVADGNMV-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccccc1OCC(C)C ZINC000124627732 1415008703 /nfs/dbraw/zinc/00/87/03/1415008703.db2.gz OVSFXSJWOKJQES-UHFFFAOYSA-N 0 0 385.420 3.193 20 5 GGBDRN O=C(Cc1csc(-c2ccc(Cl)s2)n1)OCCn1cc([N+](=O)[O-])cn1 ZINC000177773420 1428855227 /nfs/dbraw/zinc/85/52/27/1428855227.db2.gz LVCMIVVCCWGJHJ-UHFFFAOYSA-N 0 0 398.853 3.416 20 5 GGBDRN Cc1c(NC(=O)Cc2ccccc2[N+](=O)[O-])cccc1C(=O)N1CCSCC1 ZINC000124674107 1415018902 /nfs/dbraw/zinc/01/89/02/1415018902.db2.gz IIJZMTZEZOZTSC-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN Cc1c(NC(=O)c2ccccc2[N+](=O)[O-])cccc1C(=O)N1CCSCC1 ZINC000124677045 1415019215 /nfs/dbraw/zinc/01/92/15/1415019215.db2.gz NMMBDFRBXOHWNI-UHFFFAOYSA-N 0 0 385.445 3.345 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000177776616 1428856012 /nfs/dbraw/zinc/85/60/12/1428856012.db2.gz LPLBRVZZFYHVLU-MRXNPFEDSA-N 0 0 375.450 3.168 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000124681977 1415020186 /nfs/dbraw/zinc/02/01/86/1415020186.db2.gz YCHSAINOOXNYKX-INIZCTEOSA-N 0 0 398.868 3.301 20 5 GGBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])cc2)cccc1C(=O)N1CCSCC1 ZINC000124687436 1415022091 /nfs/dbraw/zinc/02/20/91/1415022091.db2.gz SBXZRVDQAUHQDN-UHFFFAOYSA-N 0 0 385.445 3.345 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)c1C ZINC000124707470 1415026476 /nfs/dbraw/zinc/02/64/76/1415026476.db2.gz MDROCLSCMYXOJZ-RHSMWYFYSA-N 0 0 392.477 3.045 20 5 GGBDRN COc1cc(F)c(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1F ZINC000124711522 1415027269 /nfs/dbraw/zinc/02/72/69/1415027269.db2.gz QRVVBLUXMHNSFP-UHFFFAOYSA-N 0 0 389.318 3.023 20 5 GGBDRN Cc1nc2ccc(NC(=O)c3nnn(-c4cccc([N+](=O)[O-])c4)c3C)cc2o1 ZINC000124722708 1415029614 /nfs/dbraw/zinc/02/96/14/1415029614.db2.gz KAPRCQIPXWKLKT-UHFFFAOYSA-N 0 0 378.348 3.186 20 5 GGBDRN CC[C@H](NC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000177792433 1428859588 /nfs/dbraw/zinc/85/95/88/1428859588.db2.gz IOXHZNDRMRXOEP-RDJZCZTQSA-N 0 0 375.469 3.447 20 5 GGBDRN Cc1ccccc1NC(=O)Cc1nc(Cn2cc([N+](=O)[O-])c(C)cc2=O)cs1 ZINC000177792788 1428859616 /nfs/dbraw/zinc/85/96/16/1428859616.db2.gz KOYXROAEXTWNTO-UHFFFAOYSA-N 0 0 398.444 3.059 20 5 GGBDRN Cc1cccc(C(=O)N2CCN(C(=O)CCCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000124739052 1415032711 /nfs/dbraw/zinc/03/27/11/1415032711.db2.gz NDSBANVJFUHLDA-UHFFFAOYSA-N 0 0 395.459 3.211 20 5 GGBDRN C[C@@H](C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000124739825 1415033396 /nfs/dbraw/zinc/03/33/96/1415033396.db2.gz PSWIKYCMRSFTNC-GFCCVEGCSA-N 0 0 376.796 3.325 20 5 GGBDRN C[C@@H](O)C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000124750337 1415035853 /nfs/dbraw/zinc/03/58/53/1415035853.db2.gz PFIVYGRTZMRPOH-OCCSQVGLSA-N 0 0 398.868 3.081 20 5 GGBDRN O=C(CCCc1ccccn1)OC[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000124758003 1415037538 /nfs/dbraw/zinc/03/75/38/1415037538.db2.gz GFERBUCEZQUBFF-QGZVFWFLSA-N 0 0 397.431 3.161 20 5 GGBDRN Cc1c(CC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cccc1[N+](=O)[O-] ZINC000124775813 1415042066 /nfs/dbraw/zinc/04/20/66/1415042066.db2.gz AACJUOOOZRFVFR-INIZCTEOSA-N 0 0 387.823 3.021 20 5 GGBDRN Cc1cccc(OC[C@H](O)CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000124785835 1415043920 /nfs/dbraw/zinc/04/39/20/1415043920.db2.gz ZCEWAQDXNUKZAA-OAHLLOKOSA-N 0 0 398.337 3.092 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(C2N=NC(=S)O2)cc1 ZINC000124796959 1415046054 /nfs/dbraw/zinc/04/60/54/1415046054.db2.gz OCZVBGQOUWNCIB-UHFFFAOYSA-N 0 0 382.361 3.062 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1ccc(Cl)c(F)c1 ZINC000124798790 1415046700 /nfs/dbraw/zinc/04/67/00/1415046700.db2.gz ARVRISBZRKZJBM-LLVKDONJSA-N 0 0 393.802 3.164 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N[C@@H]2CCCc3occc32)cc1[N+](=O)[O-] ZINC000124803936 1415047601 /nfs/dbraw/zinc/04/76/01/1415047601.db2.gz RYYQZAGPAREQPX-CYBMUJFWSA-N 0 0 399.432 3.275 20 5 GGBDRN CCCOc1ccc(C(=O)CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1 ZINC000124803105 1415047647 /nfs/dbraw/zinc/04/76/47/1415047647.db2.gz SFSKADDMSZYAPC-UHFFFAOYSA-N 0 0 385.420 3.062 20 5 GGBDRN O=C(NCc1cccc(CN2CCCC2=O)c1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000124807216 1415048572 /nfs/dbraw/zinc/04/85/72/1415048572.db2.gz YZPDIOOFVVLLMV-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN COc1ccccc1-c1cccc(NC(=O)NCCn2cc([N+](=O)[O-])cn2)c1 ZINC000124807570 1415049323 /nfs/dbraw/zinc/04/93/23/1415049323.db2.gz QMZYYVGQFDLSBS-UHFFFAOYSA-N 0 0 381.392 3.289 20 5 GGBDRN O=C(COc1ccc2ccc(=O)oc2c1)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000124813042 1415050224 /nfs/dbraw/zinc/05/02/24/1415050224.db2.gz LZNLBBBAUHIOPR-UHFFFAOYSA-N 0 0 375.720 3.339 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)[C@H]2CCCc3sccc32)CC1 ZINC000124817616 1415051666 /nfs/dbraw/zinc/05/16/66/1415051666.db2.gz FDLFVUGAYUGENV-KRWDZBQOSA-N 0 0 399.472 3.061 20 5 GGBDRN CC(=O)c1cccc(OCC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000124835342 1415054950 /nfs/dbraw/zinc/05/49/50/1415054950.db2.gz SPGPBRVWGCXKEM-UHFFFAOYSA-N 0 0 376.796 3.488 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cc1[N+](=O)[O-] ZINC000124839290 1415056109 /nfs/dbraw/zinc/05/61/09/1415056109.db2.gz WQZHZRDKYVOWQN-UHFFFAOYSA-N 0 0 396.403 3.387 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1Cl ZINC000124851225 1415059067 /nfs/dbraw/zinc/05/90/67/1415059067.db2.gz OOUJAWMIVYGQKD-UHFFFAOYSA-N 0 0 392.755 3.077 20 5 GGBDRN COc1ccc(C[C@H](C)CN(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000124852761 1415059533 /nfs/dbraw/zinc/05/95/33/1415059533.db2.gz GCGLLLZFMPTHMA-ZDUSSCGKSA-N 0 0 382.420 3.431 20 5 GGBDRN C[C@H](C[C@H](O)c1ccco1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000124901080 1415069290 /nfs/dbraw/zinc/06/92/90/1415069290.db2.gz BPDCBMMDRLWZGY-YGRLFVJLSA-N 0 0 397.225 3.121 20 5 GGBDRN O=C(C[C@H]1CCCN1C(=O)COc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000124916045 1415072290 /nfs/dbraw/zinc/07/22/90/1415072290.db2.gz DKVUHKDLXXAXMU-MRXNPFEDSA-N 0 0 386.379 3.377 20 5 GGBDRN O=C(CCCc1nc2ccccc2c(=O)[nH]1)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000124928539 1415075041 /nfs/dbraw/zinc/07/50/41/1415075041.db2.gz DLXSRGSQLMIOON-UHFFFAOYSA-N 0 0 388.330 3.071 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c1 ZINC000124929878 1415075099 /nfs/dbraw/zinc/07/50/99/1415075099.db2.gz XTWVFSNJGBLNBT-UHFFFAOYSA-N 0 0 382.376 3.133 20 5 GGBDRN CCOCc1ccc(CNC(=O)COc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000124939025 1415076580 /nfs/dbraw/zinc/07/65/80/1415076580.db2.gz DXPPPGWVJYOQMZ-UHFFFAOYSA-N 0 0 378.812 3.480 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC(C)(O)CC3)cc2[N+](=O)[O-])C1 ZINC000177784926 1428857799 /nfs/dbraw/zinc/85/77/99/1428857799.db2.gz SWFXGIXDUAHEIR-GASCZTMLSA-N 0 0 375.469 3.064 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(CCN2CCOCC2)cc1 ZINC000124946102 1415078445 /nfs/dbraw/zinc/07/84/45/1415078445.db2.gz WQPQYESPVSKVLS-UHFFFAOYSA-N 0 0 383.448 3.041 20 5 GGBDRN COc1ccc(C[C@H](C)CN(C)C(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000124954111 1415080388 /nfs/dbraw/zinc/08/03/88/1415080388.db2.gz PVOZEECABWIWFN-LBPRGKRZSA-N 0 0 375.400 3.276 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cccc(NC(=O)[C@H]2CCCO2)c1 ZINC000124962687 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CC(C)CO[C@H]1C[C@H](OC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C1(C)C ZINC000125087802 1415106450 /nfs/dbraw/zinc/10/64/50/1415106450.db2.gz HDKQOXPONGISOE-IRXDYDNUSA-N 0 0 388.424 3.172 20 5 GGBDRN COc1cc(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)ccc1O ZINC000125094261 1415107349 /nfs/dbraw/zinc/10/73/49/1415107349.db2.gz CLOMSAZGXFDFGG-UHFFFAOYSA-N 0 0 384.310 3.300 20 5 GGBDRN Cc1cccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c1C(N)=O ZINC000125119806 1415113188 /nfs/dbraw/zinc/11/31/88/1415113188.db2.gz DCZHZLRVNBNEKN-UHFFFAOYSA-N 0 0 392.209 3.325 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000125119401 1415113368 /nfs/dbraw/zinc/11/33/68/1415113368.db2.gz PZWJXMDUXRMHOM-SECBINFHSA-N 0 0 385.423 3.221 20 5 GGBDRN COCCN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1ccc(C)o1 ZINC000125141830 1415117669 /nfs/dbraw/zinc/11/76/69/1415117669.db2.gz ZASNSRBEQUJSPL-UHFFFAOYSA-N 0 0 381.816 3.237 20 5 GGBDRN Cc1cccc2c(CC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)c[nH]c21 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O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccc(Br)nc2)c(Cl)c1 ZINC000125235230 1415136268 /nfs/dbraw/zinc/13/62/68/1415136268.db2.gz GSRKBIQPAYDFFY-UHFFFAOYSA-N 0 0 393.602 3.173 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)c1 ZINC000125239765 1415137596 /nfs/dbraw/zinc/13/75/96/1415137596.db2.gz DVMITJXDWJNDEH-GFCCVEGCSA-N 0 0 382.376 3.187 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)c1 ZINC000125239530 1415137701 /nfs/dbraw/zinc/13/77/01/1415137701.db2.gz DVMITJXDWJNDEH-LBPRGKRZSA-N 0 0 382.376 3.187 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1cc(F)ccc1SCC(F)F ZINC000125246208 1415140373 /nfs/dbraw/zinc/14/03/73/1415140373.db2.gz VHVIVEJBWGIFTN-UHFFFAOYSA-N 0 0 389.359 3.109 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000125269123 1415147940 /nfs/dbraw/zinc/14/79/40/1415147940.db2.gz DKSVVOZWUIVIFV-NSHDSACASA-N 0 0 397.478 3.127 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000125273444 1415148738 /nfs/dbraw/zinc/14/87/38/1415148738.db2.gz UJSWFJGCQZQHRX-CYBMUJFWSA-N 0 0 391.449 3.232 20 5 GGBDRN C[C@H](CC(=O)c1cccs1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000125275586 1415149329 /nfs/dbraw/zinc/14/93/29/1415149329.db2.gz GYMNZPPONWUFQA-GFCCVEGCSA-N 0 0 384.417 3.233 20 5 GGBDRN COc1cc(Cl)c(C(=O)NCCNc2ccccc2[N+](=O)[O-])cc1OC ZINC000125288831 1415153626 /nfs/dbraw/zinc/15/36/26/1415153626.db2.gz UUEFEGJHEWFTQW-UHFFFAOYSA-N 0 0 379.800 3.107 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000125298734 1415156791 /nfs/dbraw/zinc/15/67/91/1415156791.db2.gz LSLHGPXBAHUXQH-LBPRGKRZSA-N 0 0 391.449 3.232 20 5 GGBDRN C[C@H](NC(=O)COc1ccc([N+](=O)[O-])c(F)c1)c1noc(-c2ccccc2)n1 ZINC000125302874 1415157625 /nfs/dbraw/zinc/15/76/25/1415157625.db2.gz OOFXBESVEKDPFS-NSHDSACASA-N 0 0 386.339 3.040 20 5 GGBDRN C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c(F)c1)c1noc(-c2ccccc2)n1 ZINC000125303070 1415158131 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NAJLJIBBZJLWAP-IWOGNZMSSA-N 0 0 391.493 3.338 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)COc2ccc3ccc(=O)oc3c2)cc1[N+](=O)[O-] ZINC000177853560 1428873486 /nfs/dbraw/zinc/87/34/86/1428873486.db2.gz NPIRZOJLSHWTDM-CYBMUJFWSA-N 0 0 382.372 3.266 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)COc2ccc3ccc(=O)oc3c2)cc1[N+](=O)[O-] ZINC000177853571 1428873609 /nfs/dbraw/zinc/87/36/09/1428873609.db2.gz NPIRZOJLSHWTDM-ZDUSSCGKSA-N 0 0 382.372 3.266 20 5 GGBDRN CC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000177853468 1428873631 /nfs/dbraw/zinc/87/36/31/1428873631.db2.gz AZXNEACDLMFMMR-UHFFFAOYSA-N 0 0 380.809 3.202 20 5 GGBDRN Cc1nc2sccc2c(=O)n1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125435084 1415197004 /nfs/dbraw/zinc/19/70/04/1415197004.db2.gz UAMKDXBEYKGRLZ-UHFFFAOYSA-N 0 0 398.322 3.077 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Cc2csc(NC(=O)C(C)C)n2)cc1[N+](=O)[O-] ZINC000177855197 1428873958 /nfs/dbraw/zinc/87/39/58/1428873958.db2.gz QHWPIOVHEONVQA-GFCCVEGCSA-N 0 0 390.465 3.374 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1[N+](=O)[O-] ZINC000177855096 1428874109 /nfs/dbraw/zinc/87/41/09/1428874109.db2.gz QMHWRPMWSIIUBD-LLVKDONJSA-N 0 0 396.852 3.451 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCCc2ccc3[nH]c(=O)[nH]c3c2)cc1[N+](=O)[O-] ZINC000177857305 1428874562 /nfs/dbraw/zinc/87/45/62/1428874562.db2.gz BUISPNJNCFNXDT-CYBMUJFWSA-N 0 0 382.420 3.273 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1c1ccncc1 ZINC000125458019 1415204615 /nfs/dbraw/zinc/20/46/15/1415204615.db2.gz LWHVFZXJOIVAFE-CQSZACIVSA-N 0 0 381.841 3.477 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H](NC(=O)Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000177859266 1428875565 /nfs/dbraw/zinc/87/55/65/1428875565.db2.gz BKGXWZUSIHQJCZ-IERDGZPVSA-N 0 0 397.475 3.464 20 5 GGBDRN C[C@@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc(-c2ccccc2)no1 ZINC000125468175 1415207628 /nfs/dbraw/zinc/20/76/28/1415207628.db2.gz CRFVIYIBVJQQJL-AWEZNQCLSA-N 0 0 395.419 3.001 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)cc1[N+](=O)[O-] ZINC000177862673 1428876416 /nfs/dbraw/zinc/87/64/16/1428876416.db2.gz HZMFKAKCYWAADD-WFASDCNBSA-N 0 0 379.482 3.028 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc(-n3cc(C)cn3)c(F)c2)cc([N+](=O)[O-])c1 ZINC000125478403 1415210478 /nfs/dbraw/zinc/21/04/78/1415210478.db2.gz DXYOLYDMYOPUNJ-UHFFFAOYSA-N 0 0 398.350 3.267 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000177862602 1428876522 /nfs/dbraw/zinc/87/65/22/1428876522.db2.gz ASEQJFTWBSHJFV-XJKSGUPXSA-N 0 0 393.509 3.418 20 5 GGBDRN Cc1cnn(-c2ccc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)cc2F)c1 ZINC000125482949 1415211911 /nfs/dbraw/zinc/21/19/11/1415211911.db2.gz CTAVYBTXGPXBIR-UHFFFAOYSA-N 0 0 385.311 3.389 20 5 GGBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1 ZINC000125484460 1415212306 /nfs/dbraw/zinc/21/23/06/1415212306.db2.gz UMGFQIHYPAOLMO-LLVKDONJSA-N 0 0 397.347 3.087 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1nc(C(C)(C)C)cs1 ZINC000125484328 1415212443 /nfs/dbraw/zinc/21/24/43/1415212443.db2.gz GCOWDPDPKLZHLL-JTQLQIEISA-N 0 0 376.438 3.106 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000125488590 1415212687 /nfs/dbraw/zinc/21/26/87/1415212687.db2.gz WDMKHEWREPFBEB-NSHDSACASA-N 0 0 397.347 3.352 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CNC(=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000177864170 1428877449 /nfs/dbraw/zinc/87/74/49/1428877449.db2.gz IYHAFWRXIXSEPN-LBPRGKRZSA-N 0 0 375.812 3.164 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1cc(F)ccc1F ZINC000125510620 1415217332 /nfs/dbraw/zinc/21/73/32/1415217332.db2.gz GLJRFGOXXZVPKO-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1ccc(F)c(F)c1 ZINC000125515992 1415218539 /nfs/dbraw/zinc/21/85/39/1415218539.db2.gz XMYGDGIIVNJRLH-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)C1Cc2ccccc2C1 ZINC000125519089 1415219567 /nfs/dbraw/zinc/21/95/67/1415219567.db2.gz FMDJASOYNKALQE-UHFFFAOYSA-N 0 0 398.234 3.233 20 5 GGBDRN CN(Cc1nccn1C(F)F)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125531389 1415221280 /nfs/dbraw/zinc/22/12/80/1415221280.db2.gz GOSGLQQKRHTGSW-UHFFFAOYSA-N 0 0 378.257 3.477 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1noc(-c2ccccc2)n1 ZINC000125536034 1415222029 /nfs/dbraw/zinc/22/20/29/1415222029.db2.gz NYAKRXUMECSFSG-ZDUSSCGKSA-N 0 0 382.376 3.291 20 5 GGBDRN Cc1cc(C(C)(C)C)cc(C)c1S(=O)(=O)NN=c1[nH]cccc1[N+](=O)[O-] ZINC000125544705 1415223129 /nfs/dbraw/zinc/22/31/29/1415223129.db2.gz JVMFYWWNGQZFCM-UHFFFAOYSA-N 0 0 378.454 3.210 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@@H](C)C2CCCCC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000125548031 1415223921 /nfs/dbraw/zinc/22/39/21/1415223921.db2.gz AESRCUTWTIRHNU-AWEZNQCLSA-N 0 0 384.436 3.148 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000125566273 1415228021 /nfs/dbraw/zinc/22/80/21/1415228021.db2.gz XFNHCUDHIWRGKG-CYBMUJFWSA-N 0 0 391.449 3.232 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NCc2ccccc2[N+](=O)[O-])c1 ZINC000125573576 1415229351 /nfs/dbraw/zinc/22/93/51/1415229351.db2.gz WTFFVLHCZKRUBE-AWEZNQCLSA-N 0 0 377.466 3.425 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000125578271 1415230355 /nfs/dbraw/zinc/23/03/55/1415230355.db2.gz RRONSYZEHCRTFK-VIFPVBQESA-N 0 0 394.434 3.054 20 5 GGBDRN Cc1ccc(CCC(=O)NCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177875616 1428879656 /nfs/dbraw/zinc/87/96/56/1428879656.db2.gz SZSAHSRJZGQBEF-MRXNPFEDSA-N 0 0 383.448 3.138 20 5 GGBDRN COc1ccc(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)cc1[N+](=O)[O-] ZINC000125583949 1415231805 /nfs/dbraw/zinc/23/18/05/1415231805.db2.gz VBDZTWANPUZQMU-GFCCVEGCSA-N 0 0 382.376 3.187 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000125591812 1415233528 /nfs/dbraw/zinc/23/35/28/1415233528.db2.gz FHBHEFZCGZQQSP-UHFFFAOYSA-N 0 0 388.342 3.419 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ncccc1OCc1cccc(Cl)c1 ZINC000125595037 1415234373 /nfs/dbraw/zinc/23/43/73/1415234373.db2.gz ZILAYQJNQVTRFE-UHFFFAOYSA-N 0 0 387.783 3.208 20 5 GGBDRN Nc1cc(CCCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])nn1-c1ccccc1 ZINC000125594843 1415234388 /nfs/dbraw/zinc/23/43/88/1415234388.db2.gz QWCLVYLAHLKTJS-UHFFFAOYSA-N 0 0 399.838 3.379 20 5 GGBDRN C[C@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1nc(-c2ccccc2)no1 ZINC000125629460 1415240951 /nfs/dbraw/zinc/24/09/51/1415240951.db2.gz ZIIDQGNNBUPTMK-LLVKDONJSA-N 0 0 392.375 3.055 20 5 GGBDRN Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000125648951 1415245810 /nfs/dbraw/zinc/24/58/10/1415245810.db2.gz DLOCEVOLZHOXTP-KDOFPFPSSA-N 0 0 399.472 3.084 20 5 GGBDRN C[C@@H](OC1CCCCCC1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125650306 1415246543 /nfs/dbraw/zinc/24/65/43/1415246543.db2.gz ZBICGGPPLGQDTM-HUUCEWRRSA-N 0 0 376.457 3.131 20 5 GGBDRN C[C@H](NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)C1CCCCC1 ZINC000125656085 1415247600 /nfs/dbraw/zinc/24/76/00/1415247600.db2.gz FBBRGVVNFSDFAB-ZDUSSCGKSA-N 0 0 375.425 3.368 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2C)c1[N+](=O)[O-] ZINC000125664595 1415248991 /nfs/dbraw/zinc/24/89/91/1415248991.db2.gz DZQFAZIAEODABO-CYBMUJFWSA-N 0 0 399.451 3.212 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000125674495 1415251605 /nfs/dbraw/zinc/25/16/05/1415251605.db2.gz GYNONQUUBFPBPI-YJBOKZPZSA-N 0 0 397.431 3.126 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000125698039 1415256923 /nfs/dbraw/zinc/25/69/23/1415256923.db2.gz WLCDBZIVJFUGMH-AWEZNQCLSA-N 0 0 398.506 3.045 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000125712074 1415259728 /nfs/dbraw/zinc/25/97/28/1415259728.db2.gz KGHRIPFVDGZOCW-MAUKXSAKSA-N 0 0 397.431 3.126 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)[C@@H]1CC1(Cl)Cl)c1ccccc1[N+](=O)[O-] ZINC000125711878 1415259832 /nfs/dbraw/zinc/25/98/32/1415259832.db2.gz VKYJNVAJSGUTQZ-RYUDHWBXSA-N 0 0 389.235 3.288 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000125713890 1415260276 /nfs/dbraw/zinc/26/02/76/1415260276.db2.gz SWWRVUWASRIMRT-HNNXBMFYSA-N 0 0 394.431 3.398 20 5 GGBDRN COC(=O)[C@@H]1C[C@@H](OC)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000125716918 1415260888 /nfs/dbraw/zinc/26/08/88/1415260888.db2.gz RVYOQUZYRCQBTD-CJNGLKHVSA-N 0 0 394.811 3.271 20 5 GGBDRN Nc1ccc(C(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)cc1[N+](=O)[O-] ZINC000125777219 1415278464 /nfs/dbraw/zinc/27/84/64/1415278464.db2.gz ZSQROPHSBDIFBY-UHFFFAOYSA-N 0 0 382.401 3.488 20 5 GGBDRN O=C(CN1CCC(OCCc2ccccc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000125777592 1415278501 /nfs/dbraw/zinc/27/85/01/1415278501.db2.gz DRYOHZGAPIQRKN-UHFFFAOYSA-N 0 0 383.448 3.257 20 5 GGBDRN COC(=O)[C@H]1C[C@H](OC)CN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000125787253 1415280884 /nfs/dbraw/zinc/28/08/84/1415280884.db2.gz ZXFXUWJUKJYYAN-BLLLJJGKSA-N 0 0 376.434 3.086 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000125793192 1415282185 /nfs/dbraw/zinc/28/21/85/1415282185.db2.gz DUFZBGBTKBEFLK-ZFWWWQNUSA-N 0 0 396.490 3.242 20 5 GGBDRN CC(C)[C@H]1OCCC[C@@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000177912538 1428890098 /nfs/dbraw/zinc/89/00/98/1428890098.db2.gz HNFJFVSDJRQPFB-VQIMIIECSA-N 0 0 375.469 3.376 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@H]2C[C@H](O)c2cccs2)cc1 ZINC000125813922 1415288431 /nfs/dbraw/zinc/28/84/31/1415288431.db2.gz PNBNUWYWJVTRGW-HOTGVXAUSA-N 0 0 396.490 3.074 20 5 GGBDRN CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000125817079 1415288855 /nfs/dbraw/zinc/28/88/55/1415288855.db2.gz QAFUHSOXVNDOET-ZYHUDNBSSA-N 0 0 385.367 3.220 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@]2(CCSC2)C1 ZINC000177917646 1428891156 /nfs/dbraw/zinc/89/11/56/1428891156.db2.gz HPTXYXWDICVIPR-VQIMIIECSA-N 0 0 393.509 3.271 20 5 GGBDRN O=C(NCCCOCC(F)(F)F)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000125827924 1415292080 /nfs/dbraw/zinc/29/20/80/1415292080.db2.gz ZFTAQYPORAAHPW-UHFFFAOYSA-N 0 0 387.261 3.287 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000125830646 1415292576 /nfs/dbraw/zinc/29/25/76/1415292576.db2.gz CVHMMBRLFXLTIC-UHFFFAOYSA-N 0 0 394.181 3.238 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1cnn(Cc2ccccc2Cl)c1 ZINC000125843520 1415295369 /nfs/dbraw/zinc/29/53/69/1415295369.db2.gz IVZMJIVWXMQAGY-UHFFFAOYSA-N 0 0 384.823 3.466 20 5 GGBDRN Cc1c(CC(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)cccc1[N+](=O)[O-] ZINC000125845198 1415295817 /nfs/dbraw/zinc/29/58/17/1415295817.db2.gz PMTVJNUGEKFKJW-CYBMUJFWSA-N 0 0 380.404 3.416 20 5 GGBDRN COc1ccc(OS(=O)(=O)c2sccc2Br)c([N+](=O)[O-])c1 ZINC000125855972 1415298104 /nfs/dbraw/zinc/29/81/04/1415298104.db2.gz ZWUFJKJWEOOCTA-UHFFFAOYSA-N 0 0 394.224 3.195 20 5 GGBDRN O=C(CCCc1nc(-c2ccc(F)cc2)no1)NCCc1cccc([N+](=O)[O-])c1 ZINC000125870464 1415301434 /nfs/dbraw/zinc/30/14/34/1415301434.db2.gz OSZQPEMNDMKIAP-UHFFFAOYSA-N 0 0 398.394 3.466 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125878829 1415303003 /nfs/dbraw/zinc/30/30/03/1415303003.db2.gz SQSJAFIICRTHGH-NSHDSACASA-N 0 0 393.783 3.283 20 5 GGBDRN NC(=O)CCN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125878622 1415303086 /nfs/dbraw/zinc/30/30/86/1415303086.db2.gz FMQDKIUDLRYHGN-UHFFFAOYSA-N 0 0 395.337 3.131 20 5 GGBDRN Cc1cc(-c2csc(NC(=O)c3c([N+](=O)[O-])cnn3C)n2)c(F)cc1F ZINC000125884447 1415304130 /nfs/dbraw/zinc/30/41/30/1415304130.db2.gz RVUNFPIMPXUTKW-UHFFFAOYSA-N 0 0 379.348 3.291 20 5 GGBDRN CCCN(CC)C(=O)c1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000125883698 1415304320 /nfs/dbraw/zinc/30/43/20/1415304320.db2.gz IHHJLGMZBURKQY-UHFFFAOYSA-N 0 0 383.448 3.439 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000125886224 1415304624 /nfs/dbraw/zinc/30/46/24/1415304624.db2.gz WPGYLSFMEDTAJF-LLVKDONJSA-N 0 0 397.347 3.352 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000125885982 1415304741 /nfs/dbraw/zinc/30/47/41/1415304741.db2.gz WPGYLSFMEDTAJF-NSHDSACASA-N 0 0 397.347 3.352 20 5 GGBDRN Cc1ccc(N2CCN(CC(=O)Nc3c(C)cccc3[N+](=O)[O-])CC2)cc1C ZINC000125897349 1415307374 /nfs/dbraw/zinc/30/73/74/1415307374.db2.gz QSLHBDFKXNIFPK-UHFFFAOYSA-N 0 0 382.464 3.281 20 5 GGBDRN Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCCN1CCn1ccc([N+](=O)[O-])n1 ZINC000125899102 1415307748 /nfs/dbraw/zinc/30/77/48/1415307748.db2.gz DUDGRVCKYWTOII-CQSZACIVSA-N 0 0 380.880 3.443 20 5 GGBDRN CC(=O)N1c2ccc(S(=O)(=O)Nc3ccc(C)c([N+](=O)[O-])c3)cc2C[C@@H]1C ZINC000125921279 1415313576 /nfs/dbraw/zinc/31/35/76/1415313576.db2.gz DNWYAQYUBWVYNP-LBPRGKRZSA-N 0 0 389.433 3.002 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1 ZINC000826499946 1428900276 /nfs/dbraw/zinc/90/02/76/1428900276.db2.gz FPVRUOIUSYHCQJ-SJLPKXTDSA-N 0 0 378.436 3.276 20 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ZINC000126030026 1415340634 /nfs/dbraw/zinc/34/06/34/1415340634.db2.gz JEIRCNQFNUQSJS-UHFFFAOYSA-N 0 0 386.433 3.302 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1cnn(-c2ccccc2)c1 ZINC000126049583 1415344535 /nfs/dbraw/zinc/34/45/35/1415344535.db2.gz JFYAHDWAZRIRJK-CYBMUJFWSA-N 0 0 381.392 3.228 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CC[C@@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000126056320 1415346960 /nfs/dbraw/zinc/34/69/60/1415346960.db2.gz BWQYDERWXBVWCA-INIZCTEOSA-N 0 0 382.416 3.476 20 5 GGBDRN O=C(COc1ccccc1OCC(F)(F)F)NCCc1cccc([N+](=O)[O-])c1 ZINC000126064334 1415348547 /nfs/dbraw/zinc/34/85/47/1415348547.db2.gz XFEQFAKPPXBKID-UHFFFAOYSA-N 0 0 398.337 3.274 20 5 GGBDRN CC(C)(C)C(=O)NCc1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000126066840 1415349464 /nfs/dbraw/zinc/34/94/64/1415349464.db2.gz XVLHEZHRYFJFJT-UHFFFAOYSA-N 0 0 383.448 3.230 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCO[C@H](c3ccccc3C)C2)c([N+](=O)[O-])c1 ZINC000126067962 1415349793 /nfs/dbraw/zinc/34/97/93/1415349793.db2.gz 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O=C(c1ccc([N+](=O)[O-])o1)N1CCN(C(=O)c2ccc(Cl)cc2Cl)CC1 ZINC000126098393 1415357227 /nfs/dbraw/zinc/35/72/27/1415357227.db2.gz KZFCFQWVPCTVRL-UHFFFAOYSA-N 0 0 398.202 3.093 20 5 GGBDRN Cn1c2ccccc2nc1[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccccc1 ZINC000126101613 1415358642 /nfs/dbraw/zinc/35/86/42/1415358642.db2.gz RHOGIGQKQRFXMB-LJQANCHMSA-N 0 0 376.420 3.057 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126110683 1415360590 /nfs/dbraw/zinc/36/05/90/1415360590.db2.gz YCMOCKFNLGEBMS-UHFFFAOYSA-N 0 0 381.348 3.184 20 5 GGBDRN O=C(Cc1cc2ccccc2[nH]c1=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126117782 1415362004 /nfs/dbraw/zinc/36/20/04/1415362004.db2.gz IMKSPHDAOTXARF-UHFFFAOYSA-N 0 0 377.400 3.170 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@H](c2ccccc2)C(C)(C)C)cc1[N+](=O)[O-] ZINC000126126040 1415364638 /nfs/dbraw/zinc/36/46/38/1415364638.db2.gz TURZUTLAZWZFDM-LJQANCHMSA-N 0 0 399.447 3.237 20 5 GGBDRN CC1(C)CCC(CNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000126151518 1415371339 /nfs/dbraw/zinc/37/13/39/1415371339.db2.gz BCCYWQFBZDVDHB-UHFFFAOYSA-N 0 0 379.482 3.118 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](C)[C@H](n3ccnc3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126161569 1415372920 /nfs/dbraw/zinc/37/29/20/1415372920.db2.gz RRFWJAGTCNXOSR-MEDUHNTESA-N 0 0 387.396 3.040 20 5 GGBDRN CC[C@H](C)CN(CC)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000177988387 1428917801 /nfs/dbraw/zinc/91/78/01/1428917801.db2.gz OFYLRYMGXKGXQT-LBPRGKRZSA-N 0 0 377.470 3.383 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000177987240 1428918121 /nfs/dbraw/zinc/91/81/21/1428918121.db2.gz IKPGTFQELARIGJ-NSHDSACASA-N 0 0 395.412 3.161 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1cnn(-c2ccccc2F)c1 ZINC000126168988 1415375117 /nfs/dbraw/zinc/37/51/17/1415375117.db2.gz LTXKHCPFOLKXEB-GFCCVEGCSA-N 0 0 399.382 3.367 20 5 GGBDRN CC(C)(C(=O)N1CCC(Oc2ccccc2Cl)CC1)n1cc([N+](=O)[O-])cn1 ZINC000126166807 1415375238 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O=C(COc1cccc([N+](=O)[O-])c1)OCc1nc(-c2cccc(Cl)c2)no1 ZINC000126307462 1415413661 /nfs/dbraw/zinc/41/36/61/1415413661.db2.gz WYXQZKBQJTYEGY-UHFFFAOYSA-N 0 0 389.751 3.420 20 5 GGBDRN CCc1nc2c(s1)[C@H](N(C)Cn1c(=O)oc3ccc([N+](=O)[O-])cc31)CCC2 ZINC000126309728 1415413829 /nfs/dbraw/zinc/41/38/29/1415413829.db2.gz WIJAHSZFVQSLLL-CYBMUJFWSA-N 0 0 388.449 3.489 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126315401 1415415833 /nfs/dbraw/zinc/41/58/33/1415415833.db2.gz TVUXPABAHUDYGH-UHFFFAOYSA-N 0 0 387.436 3.386 20 5 GGBDRN Cc1nc(N2CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)CC2)sc1C ZINC000126323020 1415417747 /nfs/dbraw/zinc/41/77/47/1415417747.db2.gz FEDGRTBUHVZOSS-UHFFFAOYSA-N 0 0 392.506 3.109 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000126372156 1415429361 /nfs/dbraw/zinc/42/93/61/1415429361.db2.gz ULICKPYXOFPCCL-GFCCVEGCSA-N 0 0 396.852 3.231 20 5 GGBDRN CCN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H](C)CS(=O)(=O)CC ZINC000126374269 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Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](CC(C)C)N1CCOCC1 ZINC000127709181 1415837431 /nfs/dbraw/zinc/83/74/31/1415837431.db2.gz ZHOQCZHKWKDAEW-INIZCTEOSA-N 0 0 378.473 3.080 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(Sc3nc(C)cc(C)n3)cc2)c1[N+](=O)[O-] ZINC000127714679 1415837954 /nfs/dbraw/zinc/83/79/54/1415837954.db2.gz RHLMVXOEBPDWCT-UHFFFAOYSA-N 0 0 398.448 3.447 20 5 GGBDRN Cc1nc(-c2ccc(NC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)cc2)n[nH]1 ZINC000127713528 1415837993 /nfs/dbraw/zinc/83/79/93/1415837993.db2.gz DFKLZQJIVNGKJK-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127732943 1415840584 /nfs/dbraw/zinc/84/05/84/1415840584.db2.gz JOFUARQWKPGMQP-WMZOPIPTSA-N 0 0 395.459 3.450 20 5 GGBDRN COc1cc([C@H](C)NC(=O)c2c([N+](=O)[O-])c(C)nn2C)ccc1OCC(C)C ZINC000127759263 1415845228 /nfs/dbraw/zinc/84/52/28/1415845228.db2.gz SVVQDVUBLJULHD-LBPRGKRZSA-N 0 0 390.440 3.171 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCOC2(CCC2)C1 ZINC000127758124 1415845380 /nfs/dbraw/zinc/84/53/80/1415845380.db2.gz UROONACALXMUKX-UHFFFAOYSA-N 0 0 390.383 3.487 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1Cl ZINC000127761708 1415845856 /nfs/dbraw/zinc/84/58/56/1415845856.db2.gz AOIWTRLSRSTRPA-UHFFFAOYSA-N 0 0 393.831 3.024 20 5 GGBDRN CS(=O)(=O)c1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000127778878 1415848865 /nfs/dbraw/zinc/84/88/65/1415848865.db2.gz ISBFWKJDKDVJIE-UHFFFAOYSA-N 0 0 389.433 3.195 20 5 GGBDRN CCC(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000127777259 1415849000 /nfs/dbraw/zinc/84/90/00/1415849000.db2.gz QICACYJTCRRFGC-UHFFFAOYSA-N 0 0 383.404 3.276 20 5 GGBDRN O=C(NCc1ccncc1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000127799387 1415852692 /nfs/dbraw/zinc/85/26/92/1415852692.db2.gz ISHDTBIGGDXCMR-UHFFFAOYSA-N 0 0 392.202 3.412 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccccc1N1CCOCC1 ZINC000127830041 1415858512 /nfs/dbraw/zinc/85/85/12/1415858512.db2.gz VYNUJHKQMUKIFJ-UHFFFAOYSA-N 0 0 384.436 3.370 20 5 GGBDRN COc1cccc(CN(C[C@H]2CCCO2)C(=O)c2cccc([N+](=O)[O-])c2N)c1 ZINC000178179220 1429009099 /nfs/dbraw/zinc/00/90/99/1429009099.db2.gz GWCFHXPBKNVDBC-MRXNPFEDSA-N 0 0 385.420 3.007 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](Cc1ccccc1)C(=O)NC1CC1 ZINC000127840154 1415860979 /nfs/dbraw/zinc/86/09/79/1415860979.db2.gz VKSDCXVIIKWWBB-KRWDZBQOSA-N 0 0 396.447 3.223 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCN(c2ccccc2F)C1=O ZINC000127842770 1415861513 /nfs/dbraw/zinc/86/15/13/1415861513.db2.gz VERXMAJNYVRLRS-AWEZNQCLSA-N 0 0 386.383 3.278 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](C)c1nnnn1-c1ccccc1 ZINC000127844115 1415861836 /nfs/dbraw/zinc/86/18/36/1415861836.db2.gz MKYJJQOHYLURPX-ZDUSSCGKSA-N 0 0 381.396 3.070 20 5 GGBDRN C[C@@H](O)[C@@H]1CCCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000127848637 1415862434 /nfs/dbraw/zinc/86/24/34/1415862434.db2.gz HYMFRKLPOSPMMY-VXGBXAGGSA-N 0 0 389.374 3.035 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[S@](=O)Cc1ccccc1 ZINC000127847055 1415862526 /nfs/dbraw/zinc/86/25/26/1415862526.db2.gz ODWKLGQURLUONA-AREMUKBSSA-N 0 0 375.450 3.282 20 5 GGBDRN CCCc1csc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)n1 ZINC000127854749 1415863430 /nfs/dbraw/zinc/86/34/30/1415863430.db2.gz APTZMQZKPWFXTI-UHFFFAOYSA-N 0 0 376.438 3.093 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](C[S@](C)=O)c1ccccc1 ZINC000127860633 1415864552 /nfs/dbraw/zinc/86/45/52/1415864552.db2.gz RLPOZRQFFBWJTJ-QWXGXRTQSA-N 0 0 375.450 3.453 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C[S@](C)=O)c1ccccc1 ZINC000127860836 1415864579 /nfs/dbraw/zinc/86/45/79/1415864579.db2.gz RLPOZRQFFBWJTJ-PVPMGCCUSA-N 0 0 375.450 3.453 20 5 GGBDRN O=C(NCc1ccn2ccnc2c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000178181708 1429010271 /nfs/dbraw/zinc/01/02/71/1429010271.db2.gz XCQZHGZAXIVASD-UHFFFAOYSA-N 0 0 377.307 3.166 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](C[S@@](C)=O)c1ccccc1 ZINC000127861044 1415865089 /nfs/dbraw/zinc/86/50/89/1415865089.db2.gz RLPOZRQFFBWJTJ-HAWMADMCSA-N 0 0 375.450 3.453 20 5 GGBDRN CC[C@H](CCO)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000127879257 1415868599 /nfs/dbraw/zinc/86/85/99/1415868599.db2.gz AJQCETQKBHLEDY-LSDHHAIUSA-N 0 0 386.452 3.301 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c(N)c([N+](=O)[O-])c1 ZINC000178183127 1429011328 /nfs/dbraw/zinc/01/13/28/1429011328.db2.gz CXGMAOBHPJGZLD-UHFFFAOYSA-N 0 0 384.436 3.432 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC)CC2)c1 ZINC000127885730 1415870149 /nfs/dbraw/zinc/87/01/49/1415870149.db2.gz YZSDCXPKCNFLGX-UHFFFAOYSA-N 0 0 385.420 3.329 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(F)c1 ZINC000127886194 1415870223 /nfs/dbraw/zinc/87/02/23/1415870223.db2.gz HOVQPJXONGWXNH-UHFFFAOYSA-N 0 0 389.339 3.068 20 5 GGBDRN Nc1c(C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)cccc1[N+](=O)[O-] ZINC000178184799 1429011912 /nfs/dbraw/zinc/01/19/12/1429011912.db2.gz JHOPFKMEOJHBTL-UHFFFAOYSA-N 0 0 382.351 3.433 20 5 GGBDRN Cc1cc(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc([N+](=O)[O-])c1 ZINC000127904167 1415873159 /nfs/dbraw/zinc/87/31/59/1415873159.db2.gz GPIBBULBMSVNCN-CQSZACIVSA-N 0 0 377.441 3.280 20 5 GGBDRN Nc1c(C(=O)NCc2ccc(Oc3cccc(F)c3)nc2)cccc1[N+](=O)[O-] ZINC000178184514 1429012088 /nfs/dbraw/zinc/01/20/88/1429012088.db2.gz CFCXIOMVJPPDJW-UHFFFAOYSA-N 0 0 382.351 3.433 20 5 GGBDRN COc1cc(CCNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccc1C ZINC000127908102 1415873560 /nfs/dbraw/zinc/87/35/60/1415873560.db2.gz YCCNGDFFYPEVSS-UHFFFAOYSA-N 0 0 380.404 3.070 20 5 GGBDRN CCC1(CNC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CCCC1 ZINC000127910984 1415874208 /nfs/dbraw/zinc/87/42/08/1415874208.db2.gz VEZHNDGIFWWUOX-UHFFFAOYSA-N 0 0 388.468 3.033 20 5 GGBDRN CCOc1cccc(N2CCN(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2)n1 ZINC000127917872 1415875321 /nfs/dbraw/zinc/87/53/21/1415875321.db2.gz DNRYRJSOBSDQQG-UHFFFAOYSA-N 0 0 399.451 3.359 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000127924968 1415876364 /nfs/dbraw/zinc/87/63/64/1415876364.db2.gz HMPDSONUSIBLBA-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN CC(C)CC[C@@H]1CCCCN1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000127937480 1415878715 /nfs/dbraw/zinc/87/87/15/1415878715.db2.gz BJNDMEPCTQBSMI-AWEZNQCLSA-N 0 0 375.425 3.320 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccccc2C(=O)N2C[C@H](C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000127943290 1415879841 /nfs/dbraw/zinc/87/98/41/1415879841.db2.gz SLRONZSROMFUER-CHWSQXEVSA-N 0 0 399.451 3.007 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccccc2C(=O)N2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000127942835 1415879933 /nfs/dbraw/zinc/87/99/33/1415879933.db2.gz SLRONZSROMFUER-BETUJISGSA-N 0 0 399.451 3.007 20 5 GGBDRN CN(CCOC(=O)c1cnc([C@@H]2CCCO2)s1)c1ccc([N+](=O)[O-])cc1 ZINC000127978300 1415887488 /nfs/dbraw/zinc/88/74/88/1415887488.db2.gz QCBCBOVRKJTXHA-AWEZNQCLSA-N 0 0 377.422 3.196 20 5 GGBDRN Cn1cc(CNc2ccc(-n3nccn3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000178192993 1429014777 /nfs/dbraw/zinc/01/47/77/1429014777.db2.gz QDCXEGNAOBXQGR-UHFFFAOYSA-N 0 0 375.392 3.188 20 5 GGBDRN COCCN(Cc1ccc(F)cc1Cl)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000178195126 1429015267 /nfs/dbraw/zinc/01/52/67/1429015267.db2.gz ALWMPRRMXHAJHX-UHFFFAOYSA-N 0 0 381.791 3.258 20 5 GGBDRN O=C(c1cccc(OCC(F)F)n1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000128022349 1415894940 /nfs/dbraw/zinc/89/49/40/1415894940.db2.gz HUAJUHIWRLKXBN-UHFFFAOYSA-N 0 0 377.347 3.439 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)cccc1[N+](=O)[O-] ZINC000178197311 1429016009 /nfs/dbraw/zinc/01/60/09/1429016009.db2.gz NBRVRNHTLUXECK-UHFFFAOYSA-N 0 0 378.392 3.024 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)COc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000128036276 1415898252 /nfs/dbraw/zinc/89/82/52/1415898252.db2.gz XBQUKWIXTKXJTD-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN O=c1nc(Cn2nccc2[N+](=O)[O-])[nH]c2scc(-c3ccccc3Cl)c21 ZINC000128040789 1415899246 /nfs/dbraw/zinc/89/92/46/1415899246.db2.gz GALXLSCTQOMSNW-UHFFFAOYSA-N 0 0 387.808 3.458 20 5 GGBDRN CC[C@H](C)n1ncc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C1CC1 ZINC000128045284 1415900569 /nfs/dbraw/zinc/90/05/69/1415900569.db2.gz WARHYSKBQOKGBD-DZGCQCFKSA-N 0 0 398.467 3.361 20 5 GGBDRN Cc1sc2[nH]c(Cn3nccc3[N+](=O)[O-])nc(=O)c2c1-c1ccc(C)cc1 ZINC000128057532 1415902461 /nfs/dbraw/zinc/90/24/61/1415902461.db2.gz HHFGDYYBFUYRDC-UHFFFAOYSA-N 0 0 381.417 3.421 20 5 GGBDRN NC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c1 ZINC000128057362 1415902474 /nfs/dbraw/zinc/90/24/74/1415902474.db2.gz RCLBWZPFNCRRJW-UHFFFAOYSA-N 0 0 398.600 3.362 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000128077216 1415906491 /nfs/dbraw/zinc/90/64/91/1415906491.db2.gz BXGIFRKUNCOVTP-HNNXBMFYSA-N 0 0 391.405 3.386 20 5 GGBDRN O=C(CNc1cc2c(cc1Cl)OCCO2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178235787 1429026860 /nfs/dbraw/zinc/02/68/60/1429026860.db2.gz HQIHQWAIBHSKBJ-UHFFFAOYSA-N 0 0 389.795 3.021 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1csc(-c2ccccn2)n1 ZINC000128093558 1415910776 /nfs/dbraw/zinc/91/07/76/1415910776.db2.gz FDDLTUXKAQQRCL-UHFFFAOYSA-N 0 0 391.412 3.385 20 5 GGBDRN Cc1cc(NC(=O)[C@@H]2Cc3cc(F)ccc3O2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000128095082 1415911323 /nfs/dbraw/zinc/91/13/23/1415911323.db2.gz SJKGXXLLHQZEEC-KRWDZBQOSA-N 0 0 382.351 3.170 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000128101526 1415912703 /nfs/dbraw/zinc/91/27/03/1415912703.db2.gz VWUWZRHEARPVFJ-SFHVURJKSA-N 0 0 383.404 3.214 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCNC(=O)C(C)C ZINC000128121314 1415917792 /nfs/dbraw/zinc/91/77/92/1415917792.db2.gz YIKIUEZARBEYDQ-UHFFFAOYSA-N 0 0 381.498 3.187 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC(=O)N1CCCCCC1 ZINC000128123468 1415918445 /nfs/dbraw/zinc/91/84/45/1415918445.db2.gz JYWXXZWIIQWJNH-UHFFFAOYSA-N 0 0 379.482 3.229 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(CN(C(C)=O)C3CC3)cc2)c1[N+](=O)[O-] ZINC000128124804 1415918458 /nfs/dbraw/zinc/91/84/58/1415918458.db2.gz LRVJGELNZVOLJD-UHFFFAOYSA-N 0 0 385.424 3.034 20 5 GGBDRN CC[C@@H](c1ccncc1)N(C)C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000128129489 1415920035 /nfs/dbraw/zinc/92/00/35/1415920035.db2.gz DJSXNSZSVLZKLX-KRWDZBQOSA-N 0 0 380.408 3.102 20 5 GGBDRN CC[C@H](c1ccncc1)N(C)C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000128129723 1415920422 /nfs/dbraw/zinc/92/04/22/1415920422.db2.gz DJSXNSZSVLZKLX-QGZVFWFLSA-N 0 0 380.408 3.102 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000178205511 1429018392 /nfs/dbraw/zinc/01/83/92/1429018392.db2.gz VKFGGHNJDFOPHS-AWEZNQCLSA-N 0 0 394.214 3.437 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)n1 ZINC000178208168 1429018717 /nfs/dbraw/zinc/01/87/17/1429018717.db2.gz YUMZNXHQLNIUDB-UHFFFAOYSA-N 0 0 378.791 3.053 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1I)c1ccccc1 ZINC000128179366 1415932113 /nfs/dbraw/zinc/93/21/13/1415932113.db2.gz GVVTTWBVGOZYOI-UHFFFAOYSA-N 0 0 383.141 3.461 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1I)Cc1ccccc1 ZINC000128182390 1415932704 /nfs/dbraw/zinc/93/27/04/1415932704.db2.gz TWQQLTBQCCQLTI-UHFFFAOYSA-N 0 0 397.168 3.390 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H](C)[C@@H](OC)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000128190836 1415935350 /nfs/dbraw/zinc/93/53/50/1415935350.db2.gz MGLNPULXAZZATD-QLJPJBMISA-N 0 0 380.832 3.430 20 5 GGBDRN O=C(Cn1cnc([N+](=O)[O-])c1)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000128190199 1415935378 /nfs/dbraw/zinc/93/53/78/1415935378.db2.gz HQCRCVOLHMPFAV-QGZVFWFLSA-N 0 0 389.415 3.221 20 5 GGBDRN O=C(Cn1cnc([N+](=O)[O-])c1)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1 ZINC000128190410 1415935588 /nfs/dbraw/zinc/93/55/88/1415935588.db2.gz HQCRCVOLHMPFAV-KRWDZBQOSA-N 0 0 389.415 3.221 20 5 GGBDRN O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128217268 1415942230 /nfs/dbraw/zinc/94/22/30/1415942230.db2.gz LRCODXVGJRVJGL-UHFFFAOYSA-N 0 0 390.751 3.497 20 5 GGBDRN CCC(=O)N[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000128223156 1415943451 /nfs/dbraw/zinc/94/34/51/1415943451.db2.gz CSVIBQRYBJUNQZ-AWEZNQCLSA-N 0 0 393.509 3.474 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])[C@H]2CCO[C@@H]21 ZINC000128255666 1415949338 /nfs/dbraw/zinc/94/93/38/1415949338.db2.gz SZWIGURRPPXALV-HONMWMINSA-N 0 0 388.342 3.079 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CCCO)Cc1cccc(Cl)c1 ZINC000128275894 1415952199 /nfs/dbraw/zinc/95/21/99/1415952199.db2.gz SMEBTIQVNPXYGZ-UHFFFAOYSA-N 0 0 398.868 3.130 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1cc2ccccc2s1 ZINC000128275481 1415952205 /nfs/dbraw/zinc/95/22/05/1415952205.db2.gz OPLMOQOOZVSMIJ-INIZCTEOSA-N 0 0 385.445 3.385 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(CCCO)Cc1cccc(Cl)c1 ZINC000128282536 1415954382 /nfs/dbraw/zinc/95/43/82/1415954382.db2.gz HIXBJXVRMUWJNU-UHFFFAOYSA-N 0 0 398.868 3.130 20 5 GGBDRN 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ZINC000128684675 1416041771 /nfs/dbraw/zinc/04/17/71/1416041771.db2.gz KHEFIMYGDFWYRW-ZDUSSCGKSA-N 0 0 375.450 3.184 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2F)c(C)c1 ZINC000128684254 1416042368 /nfs/dbraw/zinc/04/23/68/1416042368.db2.gz XGZHFWJNYDDIMC-UHFFFAOYSA-N 0 0 387.411 3.299 20 5 GGBDRN C[C@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CCCC[C@H]1O ZINC000178314021 1429049781 /nfs/dbraw/zinc/04/97/81/1429049781.db2.gz DWXRDTYUEDHDQH-UYAOXDASSA-N 0 0 375.469 3.256 20 5 GGBDRN COCCOc1cc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)nc2ccccc21 ZINC000128691771 1416044058 /nfs/dbraw/zinc/04/40/58/1416044058.db2.gz XLFGYFQGLSFRNO-UHFFFAOYSA-N 0 0 381.388 3.445 20 5 GGBDRN C[C@@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CCCC[C@H]1O ZINC000178314037 1429050149 /nfs/dbraw/zinc/05/01/49/1429050149.db2.gz DWXRDTYUEDHDQH-QUCCMNQESA-N 0 0 375.469 3.256 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)cc1 ZINC000128697279 1416045513 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Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000129631007 1416240266 /nfs/dbraw/zinc/24/02/66/1416240266.db2.gz VWJPPHIOCAFACM-GFCCVEGCSA-N 0 0 396.852 3.149 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OCC(=O)NCCc2cccc(Cl)c2Cl)c1 ZINC000129643886 1416242434 /nfs/dbraw/zinc/24/24/34/1416242434.db2.gz LLGXOABTDLDELN-UHFFFAOYSA-N 0 0 397.214 3.452 20 5 GGBDRN O=C(c1cnn(-c2ccc(F)cc2)n1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129647863 1416242805 /nfs/dbraw/zinc/24/28/05/1416242805.db2.gz JUNSZNIDBMFQHY-UHFFFAOYSA-N 0 0 381.367 3.119 20 5 GGBDRN Cc1cc(NC(=O)COc2cc(C=O)ccc2[N+](=O)[O-])n(-c2ccc(C)cc2)n1 ZINC000129661284 1416244847 /nfs/dbraw/zinc/24/48/47/1416244847.db2.gz OFKAOUBRVZJTIV-UHFFFAOYSA-N 0 0 394.387 3.227 20 5 GGBDRN O=C(N[C@@H](CO)Cc1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129662111 1416245030 /nfs/dbraw/zinc/24/50/30/1416245030.db2.gz HNXQWHKYADDWKN-OAHLLOKOSA-N 0 0 383.429 3.052 20 5 GGBDRN O=C(Nc1nc2ccc(F)cn2n1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129683879 1416248221 /nfs/dbraw/zinc/24/82/21/1416248221.db2.gz CJCFCHPOSOMDMN-UHFFFAOYSA-N 0 0 384.352 3.152 20 5 GGBDRN Cc1ccc(NC(=O)COc2cc(C=O)ccc2[N+](=O)[O-])c(Br)c1 ZINC000129711077 1416252148 /nfs/dbraw/zinc/25/21/48/1416252148.db2.gz QWYDGTMGHUSBLG-UHFFFAOYSA-N 0 0 393.193 3.496 20 5 GGBDRN Cc1noc(C)c1C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000129718787 1416253394 /nfs/dbraw/zinc/25/33/94/1416253394.db2.gz KBUWXDYPIQUCSF-MRVPVSSYSA-N 0 0 376.369 3.086 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)COc1cc(C=O)ccc1[N+](=O)[O-] ZINC000129718490 1416253409 /nfs/dbraw/zinc/25/34/09/1416253409.db2.gz CAMMHLPCODDNHW-UHFFFAOYSA-N 0 0 394.387 3.227 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@@H](C)Cc2c(C)noc2C)cc1[N+](=O)[O-] ZINC000129744171 1416257168 /nfs/dbraw/zinc/25/71/68/1416257168.db2.gz QYQOQPOZYOFSMV-NSHDSACASA-N 0 0 393.465 3.189 20 5 GGBDRN O=C(C1CCN(CC(F)(F)F)CC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129771049 1416261248 /nfs/dbraw/zinc/26/12/48/1416261248.db2.gz 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COc1cccc(COc2cccc(NC(=O)c3c([N+](=O)[O-])cnn3C)c2C)c1 ZINC000129807192 1416267082 /nfs/dbraw/zinc/26/70/82/1416267082.db2.gz GLXLPTTVHQLXFX-UHFFFAOYSA-N 0 0 396.403 3.477 20 5 GGBDRN C[C@H]1Cc2cc(-c3ccc(CNC(=O)c4c([N+](=O)[O-])cnn4C)cc3)ccc2O1 ZINC000129837885 1416271860 /nfs/dbraw/zinc/27/18/60/1416271860.db2.gz WLKROZDKKOBTFY-ZDUSSCGKSA-N 0 0 392.415 3.249 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 ZINC000129843354 1416272887 /nfs/dbraw/zinc/27/28/87/1416272887.db2.gz BVNPPWBQTGMXFQ-QGZVFWFLSA-N 0 0 387.367 3.033 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H](C)[C@@H](n3ccnc3)C2)cc1Cl ZINC000129867782 1416276985 /nfs/dbraw/zinc/27/69/85/1416276985.db2.gz NZUUXLVAIXTBAR-BZNIZROVSA-N 0 0 378.816 3.319 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCOc1ncccc1C(F)(F)F ZINC000178460362 1429082410 /nfs/dbraw/zinc/08/24/10/1429082410.db2.gz JWTXHZPQGJABOU-UHFFFAOYSA-N 0 0 398.341 3.229 20 5 GGBDRN Cc1ccn(Cc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)c(=O)c1[N+](=O)[O-] ZINC000129876950 1416278202 /nfs/dbraw/zinc/27/82/02/1416278202.db2.gz HGESULKSWFMDOS-UHFFFAOYSA-N 0 0 394.412 3.078 20 5 GGBDRN Cc1cc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnc1Cl ZINC000129883661 1416279737 /nfs/dbraw/zinc/27/97/37/1416279737.db2.gz XWKMDEOHIRJZPS-UHFFFAOYSA-N 0 0 388.811 3.081 20 5 GGBDRN O=C(Nc1ccc(F)c(F)c1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129886735 1416279896 /nfs/dbraw/zinc/27/98/96/1416279896.db2.gz YQBWKQZCBGJADZ-UHFFFAOYSA-N 0 0 375.331 3.003 20 5 GGBDRN O=C(Nc1cccc2cnccc21)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129896312 1416281285 /nfs/dbraw/zinc/28/12/85/1416281285.db2.gz COKSQAQHHVKCSC-UHFFFAOYSA-N 0 0 390.399 3.273 20 5 GGBDRN CCOc1ccccc1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129897358 1416281718 /nfs/dbraw/zinc/28/17/18/1416281718.db2.gz LUEHNGRQTKMIDD-UHFFFAOYSA-N 0 0 383.404 3.123 20 5 GGBDRN C[C@@H](O)[C@@H]1CCCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000129905908 1416282647 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378.331 3.184 20 5 GGBDRN CCOc1cccc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000129921785 1416285133 /nfs/dbraw/zinc/28/51/33/1416285133.db2.gz CYOUPWXSFYXZPY-UHFFFAOYSA-N 0 0 383.404 3.123 20 5 GGBDRN O=C(NC1CC1)c1ccc(NCC2([C@@H](O)c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000129924429 1416285612 /nfs/dbraw/zinc/28/56/12/1416285612.db2.gz DWIUMPUVLSHQBP-IBGZPJMESA-N 0 0 381.432 3.413 20 5 GGBDRN CCOc1ccc(NC(=O)C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000129925120 1416285955 /nfs/dbraw/zinc/28/59/55/1416285955.db2.gz QYIIXKOQQYBABS-UHFFFAOYSA-N 0 0 383.404 3.123 20 5 GGBDRN Cc1ccn(CC(=O)N(Cc2ccccc2)c2ccccc2)c(=O)c1[N+](=O)[O-] ZINC000129925019 1416286112 /nfs/dbraw/zinc/28/61/12/1416286112.db2.gz CZOPIPLOYFNLDI-UHFFFAOYSA-N 0 0 377.400 3.298 20 5 GGBDRN O=C(Nc1cc(F)c(F)cc1F)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129926672 1416286214 /nfs/dbraw/zinc/28/62/14/1416286214.db2.gz UNZFPUDVJOEYEC-UHFFFAOYSA-N 0 0 393.321 3.142 20 5 GGBDRN 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CCNC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000178514584 1429094766 /nfs/dbraw/zinc/09/47/66/1429094766.db2.gz ZGJVGWYZZZKSEK-UHFFFAOYSA-N 0 0 395.337 3.293 20 5 GGBDRN CCc1ccc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1S(C)(=O)=O ZINC000130650899 1416417452 /nfs/dbraw/zinc/41/74/52/1416417452.db2.gz ZCDLGCAJDAOKAE-UHFFFAOYSA-N 0 0 388.445 3.154 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000130654863 1416418730 /nfs/dbraw/zinc/41/87/30/1416418730.db2.gz QUKWCMUXOOEUGK-SNVBAGLBSA-N 0 0 387.234 3.174 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc([S@](C)=O)c1 ZINC000130662792 1416420320 /nfs/dbraw/zinc/42/03/20/1416420320.db2.gz BFUDUOPRBARKIF-HSZRJFAPSA-N 0 0 388.854 3.095 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1 ZINC000130664656 1416420551 /nfs/dbraw/zinc/42/05/51/1416420551.db2.gz STNWYULPNKREQB-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000130682701 1416424149 /nfs/dbraw/zinc/42/41/49/1416424149.db2.gz ICJOCEKKKMMNED-NSHDSACASA-N 0 0 386.376 3.377 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc2c(c1)NC(=O)CC2 ZINC000130694260 1416426684 /nfs/dbraw/zinc/42/66/84/1416426684.db2.gz LPEIUTGJVOCEDC-UHFFFAOYSA-N 0 0 395.824 3.242 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)ccc12 ZINC000130703182 1416429082 /nfs/dbraw/zinc/42/90/82/1416429082.db2.gz ILFHVBLBBRBYEW-UHFFFAOYSA-N 0 0 389.385 3.172 20 5 GGBDRN CC(C)Cc1noc(C[S@@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000130702594 1416429191 /nfs/dbraw/zinc/42/91/91/1416429191.db2.gz SZBWUPKDLLJURJ-HHHXNRCGSA-N 0 0 390.421 3.280 20 5 GGBDRN Cc1ccc2c(Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)cc(=O)oc2c1C ZINC000130705280 1416429793 /nfs/dbraw/zinc/42/97/93/1416429793.db2.gz UAELBUFMSLNZGH-UHFFFAOYSA-N 0 0 393.355 3.183 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000130707573 1416430801 /nfs/dbraw/zinc/43/08/01/1416430801.db2.gz PTCRPWBSUNJTQF-UHFFFAOYSA-N 0 0 395.423 3.099 20 5 GGBDRN CC(C)c1nc(C[S@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)no1 ZINC000130713975 1416432043 /nfs/dbraw/zinc/43/20/43/1416432043.db2.gz RWUGQJHSFSFAFV-SANMLTNESA-N 0 0 376.394 3.205 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000178521290 1429096052 /nfs/dbraw/zinc/09/60/52/1429096052.db2.gz GSERJLGCXQFDQT-UHFFFAOYSA-N 0 0 399.281 3.460 20 5 GGBDRN O=C(COc1c(Cl)cccc1[N+](=O)[O-])N1CCN(c2ccccc2F)CC1 ZINC000130719781 1416434097 /nfs/dbraw/zinc/43/40/97/1416434097.db2.gz ZJQDMVXDRWGKPL-UHFFFAOYSA-N 0 0 393.802 3.115 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(C[S@@](=O)Cc3cn4ccccc4n3)co2)cc1 ZINC000130723361 1416435023 /nfs/dbraw/zinc/43/50/23/1416435023.db2.gz GVYOITGGERIQSS-HHHXNRCGSA-N 0 0 382.401 3.346 20 5 GGBDRN CCC(C)(C)NC(=O)[C@@H](C)[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130727915 1416435638 /nfs/dbraw/zinc/43/56/38/1416435638.db2.gz YPBMUKHOTBDAJF-KHXSAUHESA-N 0 0 393.465 3.192 20 5 GGBDRN Cc1ccc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1-c1ncco1 ZINC000130732726 1416437821 /nfs/dbraw/zinc/43/78/21/1416437821.db2.gz AMFHJRGXGQVXLP-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN Cc1noc(C)c1CC[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130736994 1416438456 /nfs/dbraw/zinc/43/84/56/1416438456.db2.gz HSDCRDCLZOENFA-SANMLTNESA-N 0 0 375.406 3.346 20 5 GGBDRN CCc1noc([C@@H](C)[S@@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000130738401 1416438761 /nfs/dbraw/zinc/43/87/61/1416438761.db2.gz CATLPNGTDMRNHS-AFNXNYLOSA-N 0 0 376.394 3.205 20 5 GGBDRN Cc1ccc(-c2cnc(Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)o2)cc1 ZINC000130760652 1416444730 /nfs/dbraw/zinc/44/47/30/1416444730.db2.gz LKBSAMFVSNPNAI-UHFFFAOYSA-N 0 0 378.344 3.423 20 5 GGBDRN CC(C)(C)CCNC(=O)C[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130767429 1416445886 /nfs/dbraw/zinc/44/58/86/1416445886.db2.gz WMACJOCGARIOMI-HHHXNRCGSA-N 0 0 393.465 3.051 20 5 GGBDRN COC(=O)Cc1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000130766650 1416445905 /nfs/dbraw/zinc/44/59/05/1416445905.db2.gz PDMSXPAOGVLDLB-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2F)C1=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000130765798 1416445912 /nfs/dbraw/zinc/44/59/12/1416445912.db2.gz JKRVWTUAXLOUIY-OAHLLOKOSA-N 0 0 391.786 3.313 20 5 GGBDRN CCCN(C(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1Br)C1CC1 ZINC000130769711 1416446527 /nfs/dbraw/zinc/44/65/27/1416446527.db2.gz FJZPUBOAJRLUTI-UHFFFAOYSA-N 0 0 384.230 3.005 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000130772324 1416447378 /nfs/dbraw/zinc/44/73/78/1416447378.db2.gz BVNYTODSOSPNNR-UHFFFAOYSA-N 0 0 385.468 3.252 20 5 GGBDRN CCCCCNC(=O)[C@H](C)[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130771686 1416447649 /nfs/dbraw/zinc/44/76/49/1416447649.db2.gz JEWRTLGGFBFHHO-JGTBNHKDSA-N 0 0 393.465 3.193 20 5 GGBDRN CCC(CC)NC(=O)[C@@H](C)[S@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130786402 1416450786 /nfs/dbraw/zinc/45/07/86/1416450786.db2.gz MOWCEZOWMSPFJZ-MUDIAHQHSA-N 0 0 393.465 3.192 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1noc(-c2ccc(Cl)cc2)n1 ZINC000130790689 1416451389 /nfs/dbraw/zinc/45/13/89/1416451389.db2.gz YSSZDLUWPWGDER-UHFFFAOYSA-N 0 0 399.750 3.163 20 5 GGBDRN CCc1ccc([C@@H](NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c2cccs2)cc1 ZINC000130809960 1416455990 /nfs/dbraw/zinc/45/59/90/1416455990.db2.gz PAVJYIWJJLHVRY-HXUWFJFHSA-N 0 0 397.456 3.286 20 5 GGBDRN COc1ccccc1CS(=O)(=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130815266 1416457489 /nfs/dbraw/zinc/45/74/89/1416457489.db2.gz BSTNLDRVIDCMAP-UHFFFAOYSA-N 0 0 388.401 3.373 20 5 GGBDRN C[C@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@@H]1CNC(=O)OC(C)(C)C ZINC000178530727 1429098554 /nfs/dbraw/zinc/09/85/54/1429098554.db2.gz WGQTUEJSYCZXOB-WMLDXEAASA-N 0 0 391.468 3.289 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000130831456 1416462933 /nfs/dbraw/zinc/46/29/33/1416462933.db2.gz QKURQTZFIRTBJX-HNNXBMFYSA-N 0 0 385.395 3.072 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(C)cc1O[C@@H]1CCOC1 ZINC000130849128 1416467066 /nfs/dbraw/zinc/46/70/66/1416467066.db2.gz KGUYPCSLTIZNFF-MRXNPFEDSA-N 0 0 385.420 3.043 20 5 GGBDRN C[C@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H]1CNC(=O)OC(C)(C)C ZINC000178532761 1429099228 /nfs/dbraw/zinc/09/92/28/1429099228.db2.gz NBPURAABZFSTRB-BLLLJJGKSA-N 0 0 395.431 3.499 20 5 GGBDRN Cc1cc(C)c(-c2csc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)n2)cc1C ZINC000130854523 1416468408 /nfs/dbraw/zinc/46/84/08/1416468408.db2.gz PXJWEERMGAVCFU-UHFFFAOYSA-N 0 0 398.444 3.444 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000178534799 1429099473 /nfs/dbraw/zinc/09/94/73/1429099473.db2.gz SUHSKXFUNHRSIM-UHFFFAOYSA-N 0 0 383.448 3.193 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000130866021 1416471133 /nfs/dbraw/zinc/47/11/33/1416471133.db2.gz UWEFLRMXXMVOGV-UHFFFAOYSA-N 0 0 376.712 3.021 20 5 GGBDRN Cc1ccc(NC(=O)N2CCOC[C@H]2C[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000130872708 1416472583 /nfs/dbraw/zinc/47/25/83/1416472583.db2.gz PBPVSSOTFYZMGC-MJGOQNOKSA-N 0 0 385.420 3.260 20 5 GGBDRN Cc1ccc(NC(=O)N2CCOC[C@H]2C[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000130873149 1416472602 /nfs/dbraw/zinc/47/26/02/1416472602.db2.gz PBPVSSOTFYZMGC-IEBWSBKVSA-N 0 0 385.420 3.260 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)[C@H](C)CO1 ZINC000130874745 1416473494 /nfs/dbraw/zinc/47/34/94/1416473494.db2.gz CNTOZXALTSMJKI-HTQZYQBOSA-N 0 0 377.622 3.260 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000130876276 1416473557 /nfs/dbraw/zinc/47/35/57/1416473557.db2.gz AEZRRHVYCHDWDA-UHFFFAOYSA-N 0 0 382.420 3.156 20 5 GGBDRN COC(=O)c1ccc(C)c(NC(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000130877664 1416474213 /nfs/dbraw/zinc/47/42/13/1416474213.db2.gz KFIILQAHPFNYQE-UHFFFAOYSA-N 0 0 397.431 3.293 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCCC[C@H]1c1cccn1C ZINC000130884512 1416475471 /nfs/dbraw/zinc/47/54/71/1416475471.db2.gz TWOQNVPEDTYIQB-KRWDZBQOSA-N 0 0 384.436 3.242 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C ZINC000130891537 1416476470 /nfs/dbraw/zinc/47/64/70/1416476470.db2.gz GKRXURCJOHRGFU-OLZOCXBDSA-N 0 0 379.482 3.226 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C ZINC000130891743 1416476480 /nfs/dbraw/zinc/47/64/80/1416476480.db2.gz GKRXURCJOHRGFU-CHWSQXEVSA-N 0 0 379.482 3.226 20 5 GGBDRN COc1cccc(CN(C)C(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000130896816 1416477399 /nfs/dbraw/zinc/47/73/99/1416477399.db2.gz NTKYLYUMNSFSAO-UHFFFAOYSA-N 0 0 383.448 3.226 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000130907625 1416479377 /nfs/dbraw/zinc/47/93/77/1416479377.db2.gz QSSDLUSOVRKARP-IUODEOHRSA-N 0 0 385.395 3.385 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000130909261 1416479439 /nfs/dbraw/zinc/47/94/39/1416479439.db2.gz YVIDYBPQJGVPGK-GFCCVEGCSA-N 0 0 395.337 3.344 20 5 GGBDRN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000130915154 1416480393 /nfs/dbraw/zinc/48/03/93/1416480393.db2.gz TXKJEALDGBOPHV-UHFFFAOYSA-N 0 0 398.375 3.264 20 5 GGBDRN CC(C)[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1nc(-c2ccncc2)no1 ZINC000130963638 1416488198 /nfs/dbraw/zinc/48/81/98/1416488198.db2.gz OAANRRMJOAZAAK-GOSISDBHSA-N 0 0 395.419 3.486 20 5 GGBDRN O=C(N[C@H]1CC[C@@H](CO)CC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000130961809 1416488411 /nfs/dbraw/zinc/48/84/11/1416488411.db2.gz FDTWYJFMINTVQS-SAABIXHNSA-N 0 0 383.448 3.488 20 5 GGBDRN O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000130968755 1416489199 /nfs/dbraw/zinc/48/91/99/1416489199.db2.gz PZKOLKAUGXKRQC-IAQYHMDHSA-N 0 0 390.383 3.398 20 5 GGBDRN COc1ccc(NC(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(OC)c1 ZINC000130970311 1416489295 /nfs/dbraw/zinc/48/92/95/1416489295.db2.gz WFYIXKFAXWBUNF-UHFFFAOYSA-N 0 0 385.420 3.215 20 5 GGBDRN COCc1cccc(CNC(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000130989786 1416492270 /nfs/dbraw/zinc/49/22/70/1416492270.db2.gz ALOZHHGECZHWBY-UHFFFAOYSA-N 0 0 383.448 3.022 20 5 GGBDRN CCOC(=O)c1sc2cccc(F)c2c1Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000131016443 1416496538 /nfs/dbraw/zinc/49/65/38/1416496538.db2.gz VFWIPDOZZQQILC-UHFFFAOYSA-N 0 0 376.365 3.335 20 5 GGBDRN O=[N+]([O-])c1cc(C[S@@](=O)Cc2cc(-c3ccco3)on2)c2c(c1)COCO2 ZINC000131020472 1416497007 /nfs/dbraw/zinc/49/70/07/1416497007.db2.gz XEEPKGZHISRPFK-MHZLTWQESA-N 0 0 390.373 3.158 20 5 GGBDRN C[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]1CNC(=O)OC(C)(C)C ZINC000178539884 1429101651 /nfs/dbraw/zinc/10/16/51/1429101651.db2.gz LFYJBFYYUBOAGN-LRDDRELGSA-N 0 0 395.431 3.499 20 5 GGBDRN C[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]1CNC(=O)OC(C)(C)C ZINC000178539873 1429101658 /nfs/dbraw/zinc/10/16/58/1429101658.db2.gz LFYJBFYYUBOAGN-WBMJQRKESA-N 0 0 395.431 3.499 20 5 GGBDRN C[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])[C@H]1CNC(=O)OC(C)(C)C ZINC000178538918 1429101913 /nfs/dbraw/zinc/10/19/13/1429101913.db2.gz OQPRHKJDSLNINH-BBRMVZONSA-N 0 0 377.441 3.360 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000131048875 1416501036 /nfs/dbraw/zinc/50/10/36/1416501036.db2.gz IKJDAFQTBJBWFD-UHFFFAOYSA-N 0 0 396.447 3.254 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cccc(OCCF)c2)cc1[N+](=O)[O-] ZINC000131049622 1416501627 /nfs/dbraw/zinc/50/16/27/1416501627.db2.gz ZGERSGWWLUVBRO-ZDUSSCGKSA-N 0 0 389.383 3.067 20 5 GGBDRN O=C(CSCc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccsc2)CC1 ZINC000131084129 1416506196 /nfs/dbraw/zinc/50/61/96/1416506196.db2.gz LEWZENHMKIJGHA-UHFFFAOYSA-N 0 0 391.518 3.234 20 5 GGBDRN C[C@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H]1CNC(=O)OC(C)(C)C ZINC000178540977 1429102336 /nfs/dbraw/zinc/10/23/36/1429102336.db2.gz RCOWABRVTQRBAY-WMLDXEAASA-N 0 0 391.468 3.289 20 5 GGBDRN Cc1cc(C)n2nc(CCCOC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)nc2n1 ZINC000131087221 1416506646 /nfs/dbraw/zinc/50/66/46/1416506646.db2.gz YOTHZQIQAQEWFQ-UHFFFAOYSA-N 0 0 389.799 3.092 20 5 GGBDRN CC(=O)c1ccc(N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000131088961 1416507360 /nfs/dbraw/zinc/50/73/60/1416507360.db2.gz ONRVLWOBAYQWIG-CYBMUJFWSA-N 0 0 376.434 3.380 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)o1 ZINC000131098739 1416508548 /nfs/dbraw/zinc/50/85/48/1416508548.db2.gz PCOCOFMEETUQHP-INIZCTEOSA-N 0 0 389.408 3.118 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(N2CCCS2(=O)=O)cc1C ZINC000131104334 1416509600 /nfs/dbraw/zinc/50/96/00/1416509600.db2.gz UBBYMZBWGJGRGA-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccc(F)cc1F ZINC000131117708 1416511475 /nfs/dbraw/zinc/51/14/75/1416511475.db2.gz IKUGTKZFWULWSC-HNNXBMFYSA-N 0 0 381.310 3.218 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000131128154 1416513158 /nfs/dbraw/zinc/51/31/58/1416513158.db2.gz QWIOVNGQZSYWTG-HNNXBMFYSA-N 0 0 381.310 3.218 20 5 GGBDRN Cc1ccc(OC(F)F)c(CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000131130233 1416513263 /nfs/dbraw/zinc/51/32/63/1416513263.db2.gz WOUARQVJKOFAOP-UHFFFAOYSA-N 0 0 393.346 3.068 20 5 GGBDRN CCCOc1cc(F)ccc1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000131157658 1416517625 /nfs/dbraw/zinc/51/76/25/1416517625.db2.gz STKAZRHSUOXVJD-UHFFFAOYSA-N 0 0 385.355 3.356 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)o1 ZINC000131175628 1416519687 /nfs/dbraw/zinc/51/96/87/1416519687.db2.gz NCSOJKWVMSEHGG-SFHVURJKSA-N 0 0 385.420 3.060 20 5 GGBDRN O=C(NCc1ccccc1OC(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000131201826 1416523117 /nfs/dbraw/zinc/52/31/17/1416523117.db2.gz OGRQGGFYACDYDY-UHFFFAOYSA-N 0 0 388.330 3.312 20 5 GGBDRN C[C@](O)(CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccsc1 ZINC000131242440 1416528704 /nfs/dbraw/zinc/52/87/04/1416528704.db2.gz HWUGFHRUYCEKRO-KRWDZBQOSA-N 0 0 389.458 3.417 20 5 GGBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000131245887 1416529314 /nfs/dbraw/zinc/52/93/14/1416529314.db2.gz VLTCORZCVCXEOI-UHFFFAOYSA-N 0 0 376.376 3.133 20 5 GGBDRN Cc1cccc(OCC(=O)N(C)CC(=O)Nc2ccccc2Cl)c1[N+](=O)[O-] ZINC000131250159 1416530089 /nfs/dbraw/zinc/53/00/89/1416530089.db2.gz DTEWZIIJWJPUNH-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000131300864 1416536896 /nfs/dbraw/zinc/53/68/96/1416536896.db2.gz YPXNQQSECZDIET-ZDUSSCGKSA-N 0 0 391.435 3.225 20 5 GGBDRN CC(C)OCc1ccccc1CNC(=O)CN1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000131309619 1416538174 /nfs/dbraw/zinc/53/81/74/1416538174.db2.gz NUMBDZWQCCSQNC-UHFFFAOYSA-N 0 0 397.475 3.194 20 5 GGBDRN C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@@H+]1CCc2ccccc2C1 ZINC000131323661 1416540044 /nfs/dbraw/zinc/54/00/44/1416540044.db2.gz XKPBHANMAKQKRZ-HNNXBMFYSA-N 0 0 392.459 3.182 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccccc1N1CCC(CO)CC1 ZINC000131328083 1416540939 /nfs/dbraw/zinc/54/09/39/1416540939.db2.gz HVEDVILLCHYEGX-UHFFFAOYSA-N 0 0 383.448 3.375 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@](C)(O)c1ccc(F)cc1 ZINC000131330212 1416541130 /nfs/dbraw/zinc/54/11/30/1416541130.db2.gz JHPBJUZOVBZZLG-VOJFVSQTSA-N 0 0 396.802 3.179 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@](C)(O)c1ccc(F)cc1 ZINC000131330549 1416541239 /nfs/dbraw/zinc/54/12/39/1416541239.db2.gz JHPBJUZOVBZZLG-BBATYDOGSA-N 0 0 396.802 3.179 20 5 GGBDRN C[C@@](O)(CNC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccsc1 ZINC000131341761 1416542765 /nfs/dbraw/zinc/54/27/65/1416542765.db2.gz NEQHNAJIYWOGOH-CQSZACIVSA-N 0 0 385.239 3.056 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000131359018 1416544990 /nfs/dbraw/zinc/54/49/90/1416544990.db2.gz KPQQRDGGFDJVNE-VBKZILBWSA-N 0 0 399.447 3.232 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000131359743 1416545075 /nfs/dbraw/zinc/54/50/75/1416545075.db2.gz QNDHPQSQMJITKL-OXQOHEQNSA-N 0 0 392.415 3.431 20 5 GGBDRN CO[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000131380674 1416548131 /nfs/dbraw/zinc/54/81/31/1416548131.db2.gz VHUQDKLSYYPWAJ-QGZVFWFLSA-N 0 0 377.828 3.478 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1 ZINC000131385337 1416548852 /nfs/dbraw/zinc/54/88/52/1416548852.db2.gz WHYVJZLLIDMCLK-ZWKOTPCHSA-N 0 0 385.420 3.277 20 5 GGBDRN COCCCn1cnnc1SCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000131392280 1416549970 /nfs/dbraw/zinc/54/99/70/1416549970.db2.gz RXYOYNDXEQKHCV-UHFFFAOYSA-N 0 0 375.410 3.170 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H]2C[C@H]2c2sccc2C)c([N+](=O)[O-])cc1OC ZINC000178561251 1429106693 /nfs/dbraw/zinc/10/66/93/1429106693.db2.gz IBKRDRBFBLOGCF-ZIAGYGMSSA-N 0 0 390.461 3.444 20 5 GGBDRN CC(C)(C(=O)N1CCC[C@H](Oc2ccccc2Cl)C1)n1cc([N+](=O)[O-])cn1 ZINC000131407870 1416552640 /nfs/dbraw/zinc/55/26/40/1416552640.db2.gz CAUMUWSLODEXSF-AWEZNQCLSA-N 0 0 392.843 3.250 20 5 GGBDRN CC(C)(C(=O)N1CCC[C@@H](Oc2ccccc2Cl)C1)n1cc([N+](=O)[O-])cn1 ZINC000131408079 1416552799 /nfs/dbraw/zinc/55/27/99/1416552799.db2.gz CAUMUWSLODEXSF-CQSZACIVSA-N 0 0 392.843 3.250 20 5 GGBDRN COc1ccncc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000131423220 1416555172 /nfs/dbraw/zinc/55/51/72/1416555172.db2.gz DIYSRYRFAGBQKW-UHFFFAOYSA-N 0 0 381.392 3.112 20 5 GGBDRN C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000131440633 1416558418 /nfs/dbraw/zinc/55/84/18/1416558418.db2.gz BJUCRGSPPNKWKR-HNNXBMFYSA-N 0 0 392.459 3.182 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1csc(Cc2ccc(C)cc2)n1 ZINC000131448691 1416559535 /nfs/dbraw/zinc/55/95/35/1416559535.db2.gz YCGFLSOOELAXGO-UHFFFAOYSA-N 0 0 386.433 3.312 20 5 GGBDRN COc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1cnn(C)c1 ZINC000131455795 1416560732 /nfs/dbraw/zinc/56/07/32/1416560732.db2.gz WFOMCGDTSARTIA-UHFFFAOYSA-N 0 0 382.376 3.168 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000131457888 1416561145 /nfs/dbraw/zinc/56/11/45/1416561145.db2.gz ZAQNZXBZNKYYDZ-UHFFFAOYSA-N 0 0 397.431 3.159 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)ccc1OCc1cnn(C)c1 ZINC000131460320 1416561312 /nfs/dbraw/zinc/56/13/12/1416561312.db2.gz JCEDBKCFRLYEHC-UHFFFAOYSA-N 0 0 396.403 3.477 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H](O)c1ccc(F)cc1 ZINC000131480152 1416563928 /nfs/dbraw/zinc/56/39/28/1416563928.db2.gz LPTFOAQHNFFHLD-HNNXBMFYSA-N 0 0 382.775 3.006 20 5 GGBDRN CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000131481072 1416564393 /nfs/dbraw/zinc/56/43/93/1416564393.db2.gz PMMAKBJGSZIVOS-OAHLLOKOSA-N 0 0 376.482 3.485 20 5 GGBDRN C[C@H]1c2cc3c(cc2C2(CCCC2)CN1C(=O)c1n[nH]cc1[N+](=O)[O-])OCCO3 ZINC000131524817 1416571226 /nfs/dbraw/zinc/57/12/26/1416571226.db2.gz QGACKPSBFUWPBD-LBPRGKRZSA-N 0 0 398.419 3.118 20 5 GGBDRN C[C@@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1ccsc1 ZINC000131529665 1416572018 /nfs/dbraw/zinc/57/20/18/1416572018.db2.gz VADUXTIJUMNXKV-LJQANCHMSA-N 0 0 389.477 3.284 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000131537649 1416572818 /nfs/dbraw/zinc/57/28/18/1416572818.db2.gz GBXSQOMUMPKDCR-VBKZILBWSA-N 0 0 399.447 3.232 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H](OC1CCOCC1)c1ccccc1 ZINC000131537449 1416572915 /nfs/dbraw/zinc/57/29/15/1416572915.db2.gz GBXSQOMUMPKDCR-VLIAUNLRSA-N 0 0 399.447 3.232 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](OC1CCOCC1)c1ccccc1 ZINC000131537870 1416572973 /nfs/dbraw/zinc/57/29/73/1416572973.db2.gz GBXSQOMUMPKDCR-JLTOFOAXSA-N 0 0 399.447 3.232 20 5 GGBDRN COC(=O)[C@H](CNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-])Cc1cccc(C)c1 ZINC000131544874 1416573932 /nfs/dbraw/zinc/57/39/32/1416573932.db2.gz RIPVSKBYQOGISJ-HNNXBMFYSA-N 0 0 388.395 3.112 20 5 GGBDRN O=C(c1cccc(F)n1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000131582971 1416579642 /nfs/dbraw/zinc/57/96/42/1416579642.db2.gz MCOPFLTXBHOWHY-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000131595224 1416581900 /nfs/dbraw/zinc/58/19/00/1416581900.db2.gz UPFHKKPHDKNMAU-KGLIPLIRSA-N 0 0 379.482 3.283 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000131599745 1416582280 /nfs/dbraw/zinc/58/22/80/1416582280.db2.gz VJONCLNJAONECF-HNNXBMFYSA-N 0 0 385.395 3.267 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000131599917 1416582431 /nfs/dbraw/zinc/58/24/31/1416582431.db2.gz VJONCLNJAONECF-OAHLLOKOSA-N 0 0 385.395 3.267 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)n1 ZINC000131596275 1416582456 /nfs/dbraw/zinc/58/24/56/1416582456.db2.gz CQDVFGWWGIYBSW-UHFFFAOYSA-N 0 0 392.419 3.383 20 5 GGBDRN C[C@](O)(CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000131618567 1416585361 /nfs/dbraw/zinc/58/53/61/1416585361.db2.gz ZYCDMBXOPTXURO-SFHVURJKSA-N 0 0 396.802 3.180 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)c1[N+](=O)[O-] ZINC000131629020 1416586744 /nfs/dbraw/zinc/58/67/44/1416586744.db2.gz FXRJUSKHYMTALA-CYBMUJFWSA-N 0 0 379.338 3.329 20 5 GGBDRN COc1ccc(NC(=O)CN(C)Cc2ccccc2N2CCCC2)c([N+](=O)[O-])c1 ZINC000131638457 1416588288 /nfs/dbraw/zinc/58/82/88/1416588288.db2.gz WMCNOMDMNAHRGH-UHFFFAOYSA-N 0 0 398.463 3.274 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)Cc1ccccc1N1CCCC1 ZINC000131638959 1416588368 /nfs/dbraw/zinc/58/83/68/1416588368.db2.gz GEXGYIMQEHESNN-UHFFFAOYSA-N 0 0 398.463 3.274 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)n1 ZINC000131639973 1416588678 /nfs/dbraw/zinc/58/86/78/1416588678.db2.gz GTZNBJCNHQSOHE-PMDBQALLSA-N 0 0 376.438 3.464 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)n1 ZINC000131640197 1416588751 /nfs/dbraw/zinc/58/87/51/1416588751.db2.gz GTZNBJCNHQSOHE-OFFHKIPUSA-N 0 0 376.438 3.464 20 5 GGBDRN Cc1ccc(OCC(=O)Nc2cc(Cl)ccc2-n2cncn2)cc1[N+](=O)[O-] ZINC000131652283 1416591064 /nfs/dbraw/zinc/59/10/64/1416591064.db2.gz MIQSDVZEOAFPGT-UHFFFAOYSA-N 0 0 387.783 3.155 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000131659580 1416592247 /nfs/dbraw/zinc/59/22/47/1416592247.db2.gz IZBHATVIZFYMSJ-VXGBXAGGSA-N 0 0 385.873 3.319 20 5 GGBDRN Cc1cnccc1CCNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000131666156 1416593357 /nfs/dbraw/zinc/59/33/57/1416593357.db2.gz GIFMMBYXWACJAS-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@H](C)c2nc(-c3ccccc3)no2)c1[N+](=O)[O-] ZINC000131675827 1416595161 /nfs/dbraw/zinc/59/51/61/1416595161.db2.gz SFNLADCYEJDTSR-LBPRGKRZSA-N 0 0 397.391 3.432 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000131683652 1416596821 /nfs/dbraw/zinc/59/68/21/1416596821.db2.gz QVZPQIHUUHVDSD-DYVFJYSZSA-N 0 0 389.477 3.499 20 5 GGBDRN Cc1ccccc1-c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n(CCO)n1 ZINC000131707145 1416601039 /nfs/dbraw/zinc/60/10/39/1416601039.db2.gz DFPJZJYFUJYMKA-UHFFFAOYSA-N 0 0 394.431 3.330 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)c1c(Cl)cccc1Cl ZINC000131726087 1416605411 /nfs/dbraw/zinc/60/54/11/1416605411.db2.gz FSGJKMHZHNYGMS-ZDUSSCGKSA-N 0 0 385.203 3.374 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000131727676 1416606118 /nfs/dbraw/zinc/60/61/18/1416606118.db2.gz CWMMGZLIHYTVEC-DOTOQJQBSA-N 0 0 381.432 3.038 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCC[C@@H]1OCc1ccccc1 ZINC000131742080 1416609117 /nfs/dbraw/zinc/60/91/17/1416609117.db2.gz WBDJJUYQMBVVPA-MJGOQNOKSA-N 0 0 397.431 3.096 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCC[C@H]1OCc1ccccc1 ZINC000131742754 1416609171 /nfs/dbraw/zinc/60/91/71/1416609171.db2.gz WBDJJUYQMBVVPA-PKOBYXMFSA-N 0 0 397.431 3.096 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)NCC(C)(C)C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000131744920 1416610172 /nfs/dbraw/zinc/61/01/72/1416610172.db2.gz ISUGHHONQODITB-UHFFFAOYSA-N 0 0 387.461 3.296 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc1[N+](=O)[O-] ZINC000131756794 1416613702 /nfs/dbraw/zinc/61/37/02/1416613702.db2.gz FSCGLGGCJSBTAK-IEBWSBKVSA-N 0 0 397.431 3.096 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1c(Cl)cccc1Cl ZINC000131771646 1416616642 /nfs/dbraw/zinc/61/66/42/1416616642.db2.gz DVFKRKHJPFRAHD-CYBMUJFWSA-N 0 0 385.203 3.130 20 5 GGBDRN O=C(NCc1csc(-c2ccco2)n1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000131776793 1416617974 /nfs/dbraw/zinc/61/79/74/1416617974.db2.gz NDFPDTKYWMOFLK-UHFFFAOYSA-N 0 0 395.400 3.427 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000131780403 1416618721 /nfs/dbraw/zinc/61/87/21/1416618721.db2.gz PUIJHFQECNFVFY-UHFFFAOYSA-N 0 0 397.884 3.131 20 5 GGBDRN O=C(NCc1csc(-c2ccco2)n1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000131805524 1416625609 /nfs/dbraw/zinc/62/56/09/1416625609.db2.gz HVIITVNTVJKBOV-UHFFFAOYSA-N 0 0 396.384 3.083 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)n1 ZINC000131810668 1416626530 /nfs/dbraw/zinc/62/65/30/1416626530.db2.gz NJRNXOZBEAYXNW-UHFFFAOYSA-N 0 0 379.420 3.218 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 ZINC000131846103 1416633449 /nfs/dbraw/zinc/63/34/49/1416633449.db2.gz JHOPFGQDALBKER-UHFFFAOYSA-N 0 0 384.421 3.242 20 5 GGBDRN CCn1c(SCC(=O)Oc2ccc(C)c([N+](=O)[O-])c2)nnc1-c1ccco1 ZINC000131846253 1416633686 /nfs/dbraw/zinc/63/36/86/1416633686.db2.gz UOOYKDXTBPRKST-UHFFFAOYSA-N 0 0 388.405 3.472 20 5 GGBDRN O=C(CCCc1ccccc1)N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000131850999 1416634416 /nfs/dbraw/zinc/63/44/16/1416634416.db2.gz MYBGQCXZLMJYSC-UHFFFAOYSA-N 0 0 396.447 3.294 20 5 GGBDRN Cc1ccc(OC(=O)[C@H](C)CS(=O)(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000131861106 1416637067 /nfs/dbraw/zinc/63/70/67/1416637067.db2.gz YTAIFKVHSOGZBN-GFCCVEGCSA-N 0 0 381.381 3.058 20 5 GGBDRN Cc1ccc(OC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000131860883 1416637191 /nfs/dbraw/zinc/63/71/91/1416637191.db2.gz YTAIFKVHSOGZBN-LBPRGKRZSA-N 0 0 381.381 3.058 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1c(Cl)cccc1Cl ZINC000131876643 1416639936 /nfs/dbraw/zinc/63/99/36/1416639936.db2.gz YLDGOJCTTADFDB-AWEZNQCLSA-N 0 0 385.203 3.130 20 5 GGBDRN Cc1nn(C)c(C)c1OCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000131877326 1416640016 /nfs/dbraw/zinc/64/00/16/1416640016.db2.gz GOMFHCAODWIPSG-UHFFFAOYSA-N 0 0 387.421 3.086 20 5 GGBDRN Nc1c(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)cc(F)cc1[N+](=O)[O-] ZINC000131914467 1416650263 /nfs/dbraw/zinc/65/02/63/1416650263.db2.gz KOLSQPDPKPVPBQ-LBPRGKRZSA-N 0 0 388.182 3.086 20 5 GGBDRN Cc1ccc(OC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)cc1[N+](=O)[O-] ZINC000131918283 1416651106 /nfs/dbraw/zinc/65/11/06/1416651106.db2.gz MTIAYSHGGIAGDM-UHFFFAOYSA-N 0 0 381.388 3.225 20 5 GGBDRN CCn1ncc2ccc(NS(=O)(=O)c3cc(C)c(F)c([N+](=O)[O-])c3)cc21 ZINC000131931661 1416654462 /nfs/dbraw/zinc/65/44/62/1416654462.db2.gz ZKHBYMODPPRCGE-UHFFFAOYSA-N 0 0 378.385 3.213 20 5 GGBDRN Cc1ccc(OC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cc1[N+](=O)[O-] ZINC000131942355 1416656608 /nfs/dbraw/zinc/65/66/08/1416656608.db2.gz HECIXIHEOAHPIY-UHFFFAOYSA-N 0 0 393.281 3.117 20 5 GGBDRN CC(C)C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nccs1 ZINC000131952987 1416658699 /nfs/dbraw/zinc/65/86/99/1416658699.db2.gz DWGFJXKNVRFSLY-ZDUSSCGKSA-N 0 0 377.426 3.226 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)Oc1ccc(C)c([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000131992623 1416668056 /nfs/dbraw/zinc/66/80/56/1416668056.db2.gz MXZFQSPZFLUUHG-HNNXBMFYSA-N 0 0 378.331 3.354 20 5 GGBDRN COCCOc1cc(C)ccc1CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000131996415 1416669192 /nfs/dbraw/zinc/66/91/92/1416669192.db2.gz MOSRFHROYUWAGX-UHFFFAOYSA-N 0 0 380.347 3.137 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)C[C@H](O)c2cccs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000132013387 1416673524 /nfs/dbraw/zinc/67/35/24/1416673524.db2.gz KLULDDHCGYAEPD-XPTSAGLGSA-N 0 0 379.394 3.115 20 5 GGBDRN O=C(O[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000132024660 1416675968 /nfs/dbraw/zinc/67/59/68/1416675968.db2.gz POMYHFZMIMBMMZ-BPQIPLTHSA-N 0 0 383.404 3.285 20 5 GGBDRN COC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000132029628 1416678198 /nfs/dbraw/zinc/67/81/98/1416678198.db2.gz IPCIZVXSPOYBEW-UHFFFAOYSA-N 0 0 382.294 3.330 20 5 GGBDRN COc1cc(OCC(=O)NCc2csc(-c3ccco3)n2)ccc1[N+](=O)[O-] ZINC000132090164 1416693227 /nfs/dbraw/zinc/69/32/27/1416693227.db2.gz ZORCYRIQLNHLBF-UHFFFAOYSA-N 0 0 389.389 3.015 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@@H](Oc2ccncc2)C1 ZINC000132110344 1416698494 /nfs/dbraw/zinc/69/84/94/1416698494.db2.gz ACXLJGBTLKIIOH-OAHLLOKOSA-N 0 0 381.310 3.302 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)C(=O)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000132111215 1416698521 /nfs/dbraw/zinc/69/85/21/1416698521.db2.gz CFRSCJXWPZMCMC-GFCCVEGCSA-N 0 0 378.454 3.383 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)n1 ZINC000132124431 1416701414 /nfs/dbraw/zinc/70/14/14/1416701414.db2.gz QKERHWATRHUEGP-UHFFFAOYSA-N 0 0 383.383 3.049 20 5 GGBDRN O=C(Nc1ccn(CCc2ccncc2)n1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000132129603 1416703102 /nfs/dbraw/zinc/70/31/02/1416703102.db2.gz YBIPMDSCFRRDOY-UHFFFAOYSA-N 0 0 388.387 3.230 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)c1 ZINC000132133560 1416704470 /nfs/dbraw/zinc/70/44/70/1416704470.db2.gz FBRUZIOBRKXKEI-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN CC[C@@H](CS(=O)(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000132141698 1416706638 /nfs/dbraw/zinc/70/66/38/1416706638.db2.gz XUKJYDZWTJSHPI-LBPRGKRZSA-N 0 0 379.394 3.167 20 5 GGBDRN O=C(NCCc1cn2ccccc2n1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000132148350 1416707438 /nfs/dbraw/zinc/70/74/38/1416707438.db2.gz ZYMBJUPPWJHZSO-UHFFFAOYSA-N 0 0 379.420 3.159 20 5 GGBDRN CC(=O)NC[C@H](OC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000132157928 1416709210 /nfs/dbraw/zinc/70/92/10/1416709210.db2.gz GCFPIEPODGIMAH-IBGZPJMESA-N 0 0 381.388 3.039 20 5 GGBDRN CC(=O)NC[C@@H](OC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000132158126 1416709451 /nfs/dbraw/zinc/70/94/51/1416709451.db2.gz GCFPIEPODGIMAH-LJQANCHMSA-N 0 0 381.388 3.039 20 5 GGBDRN O=C(NCCOc1ncccc1Cl)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000132171658 1416711267 /nfs/dbraw/zinc/71/12/67/1416711267.db2.gz VRWRLQIDSIPAGG-UHFFFAOYSA-N 0 0 389.717 3.471 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000132195926 1416715609 /nfs/dbraw/zinc/71/56/09/1416715609.db2.gz DQOFRLZSQQMOAJ-UHFFFAOYSA-N 0 0 387.411 3.091 20 5 GGBDRN COC(=O)CCN(C(=O)CCc1cccc([N+](=O)[O-])c1)c1nc2ccccc2o1 ZINC000132221012 1416719219 /nfs/dbraw/zinc/71/92/19/1416719219.db2.gz LFUYXQJURCVULH-UHFFFAOYSA-N 0 0 397.387 3.265 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000132223758 1416719662 /nfs/dbraw/zinc/71/96/62/1416719662.db2.gz PLTKAXUUZDUGRW-KRWDZBQOSA-N 0 0 377.347 3.103 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N[C@@H](C)Cc1c(F)cccc1F ZINC000132232267 1416721232 /nfs/dbraw/zinc/72/12/32/1416721232.db2.gz UDEYKVWWCTURDV-NSHDSACASA-N 0 0 380.347 3.008 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000132253135 1416724480 /nfs/dbraw/zinc/72/44/80/1416724480.db2.gz KSFDAPMBLFYKMO-LPHOPBHVSA-N 0 0 384.436 3.226 20 5 GGBDRN CN(Cc1cccc(OC(F)(F)F)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000132262711 1416725938 /nfs/dbraw/zinc/72/59/38/1416725938.db2.gz FVEXEQALQLCKCA-UHFFFAOYSA-N 0 0 390.339 3.314 20 5 GGBDRN O=C(N[C@H](CCCO)c1ccccc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000132261495 1416725944 /nfs/dbraw/zinc/72/59/44/1416725944.db2.gz ZNGYOWDVYTZJMR-LJQANCHMSA-N 0 0 380.404 3.024 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)cc([N+](=O)[O-])c1 ZINC000132265813 1416726350 /nfs/dbraw/zinc/72/63/50/1416726350.db2.gz OLUXLGILTLSNQW-UHFFFAOYSA-N 0 0 394.387 3.398 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccn(Cc2ccc(C)cc2)c1=O ZINC000132276730 1416727506 /nfs/dbraw/zinc/72/75/06/1416727506.db2.gz FPTXBADCJMNRCN-UHFFFAOYSA-N 0 0 393.399 3.374 20 5 GGBDRN CCOc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1CO ZINC000132295822 1416730828 /nfs/dbraw/zinc/73/08/28/1416730828.db2.gz JMLFKTZWCURPCB-UHFFFAOYSA-N 0 0 396.403 3.139 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cccn(Cc3ccc(C)cc3)c2=O)c1[N+](=O)[O-] ZINC000132299981 1416731775 /nfs/dbraw/zinc/73/17/75/1416731775.db2.gz TVRADMCASYQPFJ-UHFFFAOYSA-N 0 0 395.419 3.041 20 5 GGBDRN CC(C)c1cccc(NC(=O)Cn2c(=O)onc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000132306625 1416732062 /nfs/dbraw/zinc/73/20/62/1416732062.db2.gz HDEWZDAAGWEKBB-UHFFFAOYSA-N 0 0 382.376 3.174 20 5 GGBDRN Cc1c(CC(=O)N[C@H](C)c2ccc(N3CCOC3=O)cc2)cccc1[N+](=O)[O-] ZINC000178625980 1429124091 /nfs/dbraw/zinc/12/40/91/1429124091.db2.gz PPVKGBJISGFITO-CQSZACIVSA-N 0 0 383.404 3.280 20 5 GGBDRN C[NH+](C)CC1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c([O-])c3)cc2)CC1 ZINC000132318697 1416734998 /nfs/dbraw/zinc/73/49/98/1416734998.db2.gz QPUXAJAELPXHKI-UHFFFAOYSA-N 0 0 398.463 3.331 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(CC[NH+]2CCCC2)cc1 ZINC000132321778 1416735759 /nfs/dbraw/zinc/73/57/59/1416735759.db2.gz KMHYMOHVPRAZKL-UHFFFAOYSA-N 0 0 393.440 3.173 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000132329267 1416737680 /nfs/dbraw/zinc/73/76/80/1416737680.db2.gz RNQSYGDFDZPSSK-LSDHHAIUSA-N 0 0 375.425 3.177 20 5 GGBDRN O=C(Nc1ccc(C(F)(F)F)nc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000132328878 1416737862 /nfs/dbraw/zinc/73/78/62/1416737862.db2.gz RJFLHZNQKKSDCW-UHFFFAOYSA-N 0 0 395.341 3.363 20 5 GGBDRN Cc1cc2oc(=O)cc(Cn3c(=O)onc3-c3ccc([N+](=O)[O-])cc3)c2cc1C ZINC000132332632 1416738347 /nfs/dbraw/zinc/73/83/47/1416738347.db2.gz FKGYNLLAWPULMA-UHFFFAOYSA-N 0 0 393.355 3.183 20 5 GGBDRN CCc1ccc2c(Cn3c(=O)onc3-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 ZINC000132333813 1416739347 /nfs/dbraw/zinc/73/93/47/1416739347.db2.gz FHIRWQXQGISNMT-UHFFFAOYSA-N 0 0 393.355 3.129 20 5 GGBDRN CC(=O)Nc1cccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000132346883 1416742100 /nfs/dbraw/zinc/74/21/00/1416742100.db2.gz LCDOZSZOFFESEX-UHFFFAOYSA-N 0 0 382.420 3.427 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc2c3c(cccc31)C(=O)N2 ZINC000132359502 1416744204 /nfs/dbraw/zinc/74/42/04/1416744204.db2.gz XWKHNJVZRSUTLY-UHFFFAOYSA-N 0 0 383.385 3.139 20 5 GGBDRN CC(=O)N[C@H](CC(=O)Oc1cc(F)cc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000132363803 1416745489 /nfs/dbraw/zinc/74/54/89/1416745489.db2.gz JLXXNCZCPAFJIQ-OAHLLOKOSA-N 0 0 382.294 3.185 20 5 GGBDRN COc1ccc([C@@H]2CCCN2Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)cc1 ZINC000132369437 1416747016 /nfs/dbraw/zinc/74/70/16/1416747016.db2.gz HJYPAXCUDRGPCI-SFHVURJKSA-N 0 0 396.403 3.215 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCCN(Cc2ccc(F)cc2)CC1 ZINC000132371012 1416747405 /nfs/dbraw/zinc/74/74/05/1416747405.db2.gz 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C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134501328 1417078000 /nfs/dbraw/zinc/07/80/00/1417078000.db2.gz AJAVWQSVGFMCRM-BFUOFWGJSA-N 0 0 398.394 3.162 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC2(C[C@H]2C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000134518512 1417080520 /nfs/dbraw/zinc/08/05/20/1417080520.db2.gz JSWMHHLLJANDLC-INIZCTEOSA-N 0 0 389.452 3.248 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C)[C@@H](C)[C@@H]1Cc2ccccc2O1 ZINC000134520673 1417080920 /nfs/dbraw/zinc/08/09/20/1417080920.db2.gz NSELWPGRXBEMIE-KSSFIOAISA-N 0 0 397.431 3.001 20 5 GGBDRN CC[C@H]1CN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CCO1 ZINC000134563007 1417087630 /nfs/dbraw/zinc/08/76/30/1417087630.db2.gz WXOSKFSATCQUKO-NSHDSACASA-N 0 0 399.234 3.338 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000134580744 1417090867 /nfs/dbraw/zinc/09/08/67/1417090867.db2.gz WQDMFHXVRGJGEO-KZULUSFZSA-N 0 0 375.400 3.042 20 5 GGBDRN 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COc1ccccc1[C@H]1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000134731733 1417118204 /nfs/dbraw/zinc/11/82/04/1417118204.db2.gz QGDKLDFCGDNBGH-HNNXBMFYSA-N 0 0 392.415 3.419 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CC[C@H](Cc2ccccc2)C1 ZINC000134743439 1417119489 /nfs/dbraw/zinc/11/94/89/1417119489.db2.gz JURCYZIONLYFSF-QGZVFWFLSA-N 0 0 376.416 3.485 20 5 GGBDRN O=C(CN1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000134776761 1417124242 /nfs/dbraw/zinc/12/42/42/1417124242.db2.gz ATBZNNAOWQYOIS-APWZRJJASA-N 0 0 387.411 3.261 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1[N+](=O)[O-] ZINC000134822671 1417131534 /nfs/dbraw/zinc/13/15/34/1417131534.db2.gz YYTFXIPCJZTKQP-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN CCN1C(=S)N=NC1[C@@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134857030 1417134626 /nfs/dbraw/zinc/13/46/26/1417134626.db2.gz BNJWEZKBNMEWQE-SNVBAGLBSA-N 0 0 395.872 3.168 20 5 GGBDRN 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ZINC000135024924 1417164349 /nfs/dbraw/zinc/16/43/49/1417164349.db2.gz QHPSAAIYQSPDBR-UHFFFAOYSA-N 0 0 397.431 3.027 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135043934 1417166691 /nfs/dbraw/zinc/16/66/91/1417166691.db2.gz BYOZXKZAOKPCIW-MHZLTWQESA-N 0 0 385.445 3.444 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)(C)C ZINC000135069419 1417169742 /nfs/dbraw/zinc/16/97/42/1417169742.db2.gz UJPRKEYCVHAOQS-CYBMUJFWSA-N 0 0 377.422 3.036 20 5 GGBDRN CC(C)CN(C[C@@H](O)c1ccc(F)cc1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000135104194 1417172570 /nfs/dbraw/zinc/17/25/70/1417172570.db2.gz DDCSDGCFGSIYQX-GOSISDBHSA-N 0 0 375.400 3.029 20 5 GGBDRN O=C(c1cc(C2CCCCC2)n[nH]1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135116489 1417173600 /nfs/dbraw/zinc/17/36/00/1417173600.db2.gz UBFJLEFZDVYJOD-CQSZACIVSA-N 0 0 384.440 3.087 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCCCC[C@H]2c2ccco2)cc([N+](=O)[O-])c1 ZINC000135136251 1417176280 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HZMJMXXUEYUMAH-HNNXBMFYSA-N 0 0 395.394 3.019 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCc2cccc([N+](=O)[O-])c2)cccc1C(F)(F)F ZINC000135183943 1417183274 /nfs/dbraw/zinc/18/32/74/1417183274.db2.gz JZNRRUBIDDVAJU-UHFFFAOYSA-N 0 0 395.337 3.219 20 5 GGBDRN CN1CCC(=O)Nc2cc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)ccc21 ZINC000135189611 1417184433 /nfs/dbraw/zinc/18/44/33/1417184433.db2.gz KNWRMCRFMLJLGG-UHFFFAOYSA-N 0 0 394.431 3.178 20 5 GGBDRN O=C(c1ccc(N2CCC(O)CC2)cc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135191631 1417185008 /nfs/dbraw/zinc/18/50/08/1417185008.db2.gz OYZCMTANYNYURA-UHFFFAOYSA-N 0 0 395.459 3.361 20 5 GGBDRN Cc1cc(F)cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C2CC2)c1[N+](=O)[O-] ZINC000135196488 1417185521 /nfs/dbraw/zinc/18/55/21/1417185521.db2.gz KRUFWMZAUOTTRP-CQSZACIVSA-N 0 0 381.404 3.075 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCc1nnc(-c2ccccc2)o1 ZINC000178770258 1429165101 /nfs/dbraw/zinc/16/51/01/1429165101.db2.gz WYKZFRPYOIYWQX-UHFFFAOYSA-N 0 0 381.392 3.029 20 5 GGBDRN COc1cccc(CN(C)C(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135218199 1417190028 /nfs/dbraw/zinc/19/00/28/1417190028.db2.gz FIXLNGWEMKVQTG-UHFFFAOYSA-N 0 0 383.448 3.226 20 5 GGBDRN COc1ccc(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000135232712 1417192628 /nfs/dbraw/zinc/19/26/28/1417192628.db2.gz NVURUPKAIOJUMG-UHFFFAOYSA-N 0 0 385.420 3.215 20 5 GGBDRN COC(=O)c1sccc1NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135237050 1417193190 /nfs/dbraw/zinc/19/31/90/1417193190.db2.gz BRSBBWNORAOZML-UHFFFAOYSA-N 0 0 389.433 3.046 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c(Br)n1 ZINC000135239596 1417193663 /nfs/dbraw/zinc/19/36/63/1417193663.db2.gz NBILSCVOTLWTTD-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN O=C(CN(Cc1ccccc1[N+](=O)[O-])C1CC1)N[C@@H]1CCOc2ccccc21 ZINC000135237787 1417193767 /nfs/dbraw/zinc/19/37/67/1417193767.db2.gz CNNXHMWCDKFUIE-GOSISDBHSA-N 0 0 381.432 3.199 20 5 GGBDRN COCc1cccc(CNC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135238599 1417193829 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3.083 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)C(C)(C)C)CC1 ZINC000135476589 1417225008 /nfs/dbraw/zinc/22/50/08/1417225008.db2.gz XQHKJDSPMGUERI-UHFFFAOYSA-N 0 0 379.482 3.037 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000178780875 1429168262 /nfs/dbraw/zinc/16/82/62/1429168262.db2.gz BCWMWOYUOAPEOF-VQIMIIECSA-N 0 0 398.463 3.474 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)cccc1[N+](=O)[O-] ZINC000135502108 1417229601 /nfs/dbraw/zinc/22/96/01/1417229601.db2.gz OFRTVNSGCNDTTO-UHFFFAOYSA-N 0 0 381.392 3.200 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)n1 ZINC000135509358 1417231182 /nfs/dbraw/zinc/23/11/82/1417231182.db2.gz KNZWYMGSNKLCNR-LLVKDONJSA-N 0 0 393.469 3.130 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc12 ZINC000135525155 1417232750 /nfs/dbraw/zinc/23/27/50/1417232750.db2.gz JUAOBYFXFHDKMI-CQSZACIVSA-N 0 0 377.404 3.173 20 5 GGBDRN Cc1c(Cl)cccc1OCC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135528706 1417233599 /nfs/dbraw/zinc/23/35/99/1417233599.db2.gz HXMNIQOTXXSTFD-CYBMUJFWSA-N 0 0 390.827 3.043 20 5 GGBDRN O=C(CCOc1ccccc1Cl)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135527428 1417233634 /nfs/dbraw/zinc/23/36/34/1417233634.db2.gz NAODYGQPTHRINB-ZDUSSCGKSA-N 0 0 390.827 3.125 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1c(F)cccc1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135533942 1417234276 /nfs/dbraw/zinc/23/42/76/1417234276.db2.gz XWDKTJKBQSIZTJ-IACUBPJLSA-N 0 0 388.374 3.085 20 5 GGBDRN Cc1ccc(SCCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135538374 1417234801 /nfs/dbraw/zinc/23/48/01/1417234801.db2.gz WPMJDMVRDBUWQU-HNNXBMFYSA-N 0 0 386.477 3.493 20 5 GGBDRN COc1ccc(CCCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135537020 1417234818 /nfs/dbraw/zinc/23/48/18/1417234818.db2.gz HYZDSNXWZKPNIP-INIZCTEOSA-N 0 0 384.436 3.034 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCc2c3ccccc3[nH]c2C1 ZINC000135553238 1417236843 /nfs/dbraw/zinc/23/68/43/1417236843.db2.gz BENPFLXXZYGMIW-UHFFFAOYSA-N 0 0 398.806 3.253 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000135580567 1417239799 /nfs/dbraw/zinc/23/97/99/1417239799.db2.gz SHROSLUZCAHHDJ-GFCCVEGCSA-N 0 0 393.802 3.161 20 5 GGBDRN O=C(NCCSCCCO)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000135584999 1417240560 /nfs/dbraw/zinc/24/05/60/1417240560.db2.gz LRYXYZJZRAQZPK-UHFFFAOYSA-N 0 0 375.450 3.184 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)Oc2cc(F)cc([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000135590946 1417241396 /nfs/dbraw/zinc/24/13/96/1417241396.db2.gz OMZMDBIKEXUJNO-UHFFFAOYSA-N 0 0 390.732 3.372 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2cc(F)cc([N+](=O)[O-])c2)c(Cl)c1 ZINC000135599116 1417243429 /nfs/dbraw/zinc/24/34/29/1417243429.db2.gz VADWLNXLQKPNJW-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)c1 ZINC000135597779 1417243654 /nfs/dbraw/zinc/24/36/54/1417243654.db2.gz UIXBCOWNYKZXLK-NSHDSACASA-N 0 0 393.802 3.405 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(Cl)c1 ZINC000135601489 1417244517 /nfs/dbraw/zinc/24/45/17/1417244517.db2.gz FNQQNPUYBFIALD-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN O=C(NCC1(O)CCCCCC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000135643043 1417252683 /nfs/dbraw/zinc/25/26/83/1417252683.db2.gz XDOYZYIUFVGMAW-UHFFFAOYSA-N 0 0 375.469 3.013 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(OCC3CCOCC3)cc2)cc(F)cc1[N+](=O)[O-] ZINC000135648020 1417253478 /nfs/dbraw/zinc/25/34/78/1417253478.db2.gz MGYLMWJOSUEGMG-UHFFFAOYSA-N 0 0 389.383 3.374 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1 ZINC000135655522 1417254323 /nfs/dbraw/zinc/25/43/23/1417254323.db2.gz FTRNWMMQZBGYKC-RTBURBONSA-N 0 0 385.420 3.328 20 5 GGBDRN O=C(NC[C@H]1CCN(c2ccccc2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000135727173 1417262407 /nfs/dbraw/zinc/26/24/07/1417262407.db2.gz KPZYBTHRKHKWNA-MRXNPFEDSA-N 0 0 391.431 3.037 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000135747776 1417264519 /nfs/dbraw/zinc/26/45/19/1417264519.db2.gz BHYMRGFYNLBFRH-UHFFFAOYSA-N 0 0 392.755 3.077 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H](CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135743313 1417264593 /nfs/dbraw/zinc/26/45/93/1417264593.db2.gz PKPHSERRYIMTKG-RFKZRZAASA-N 0 0 375.425 3.028 20 5 GGBDRN O=C(NC[C@H](O)c1ccco1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000135798149 1417269113 /nfs/dbraw/zinc/26/91/13/1417269113.db2.gz IJKNOUBZRTWSSP-SFHVURJKSA-N 0 0 381.388 3.263 20 5 GGBDRN O=C(NCc1nnc(C2CC2)n1C1CC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000135813320 1417270928 /nfs/dbraw/zinc/27/09/28/1417270928.db2.gz XCSBLHAGLFHAEC-UHFFFAOYSA-N 0 0 395.341 3.347 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000135905943 1417277220 /nfs/dbraw/zinc/27/72/20/1417277220.db2.gz NROQITMRULHPGB-OAHLLOKOSA-N 0 0 375.469 3.376 20 5 GGBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccc([S@](C)=O)cc1 ZINC000178794111 1429172020 /nfs/dbraw/zinc/17/20/20/1429172020.db2.gz IMNMLSVVPVLQDR-MHZLTWQESA-N 0 0 386.433 3.014 20 5 GGBDRN O=C(NC[C@H](O)c1ccco1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000135951334 1417280686 /nfs/dbraw/zinc/28/06/86/1417280686.db2.gz GJNZCGHVAKXURD-JTQLQIEISA-N 0 0 389.589 3.067 20 5 GGBDRN C[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C1CCOCC1 ZINC000136098558 1417291676 /nfs/dbraw/zinc/29/16/76/1417291676.db2.gz KQQRUDNNELNPIF-JTQLQIEISA-N 0 0 376.331 3.081 20 5 GGBDRN Cc1cc(C)nc(N2CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)CC2)n1 ZINC000136099285 1417291714 /nfs/dbraw/zinc/29/17/14/1417291714.db2.gz UOXMEMYQBPJZDH-UHFFFAOYSA-N 0 0 385.468 3.111 20 5 GGBDRN COc1cccc(O[C@H](C)CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000136145568 1417295424 /nfs/dbraw/zinc/29/54/24/1417295424.db2.gz GFWDAOOUHXGNEP-CYBMUJFWSA-N 0 0 383.404 3.211 20 5 GGBDRN O=C(Nc1ccc(N2CCCCC2)cn1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000136146782 1417295462 /nfs/dbraw/zinc/29/54/62/1417295462.db2.gz FUBGPGDANGRZGW-UHFFFAOYSA-N 0 0 392.419 3.418 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2coc(-c3cccs3)n2)cc([N+](=O)[O-])c1 ZINC000136146340 1417295620 /nfs/dbraw/zinc/29/56/20/1417295620.db2.gz AEBBVJJIURWIDA-UHFFFAOYSA-N 0 0 387.373 3.279 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCCNc1ccccn1 ZINC000136176445 1417298682 /nfs/dbraw/zinc/29/86/82/1417298682.db2.gz CYBULMCKAQDELB-UHFFFAOYSA-N 0 0 378.816 3.031 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1ccc([S@@](C)=O)cc1 ZINC000178800489 1429173648 /nfs/dbraw/zinc/17/36/48/1429173648.db2.gz GGQXRWPNMONNQA-AREMUKBSSA-N 0 0 395.868 3.056 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H](O)c2nccn2C)CC1 ZINC000136210834 1417301314 /nfs/dbraw/zinc/30/13/14/1417301314.db2.gz NHSMNFHVYPWOSN-LJQANCHMSA-N 0 0 388.468 3.061 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc3[nH]cnc32)ccc1[N+](=O)[O-] ZINC000136256031 1417305209 /nfs/dbraw/zinc/30/52/09/1417305209.db2.gz XQGMIAJOJSWHMA-QGZVFWFLSA-N 0 0 393.403 3.023 20 5 GGBDRN CC(C)c1nnc(NC(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000136318472 1417309365 /nfs/dbraw/zinc/30/93/65/1417309365.db2.gz FEJLRJHXSZZNJK-UHFFFAOYSA-N 0 0 383.861 3.294 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cccc(N2CCCNC2=O)c1 ZINC000136326034 1417309794 /nfs/dbraw/zinc/30/97/94/1417309794.db2.gz YMKGIDFUSUTINV-UHFFFAOYSA-N 0 0 393.403 3.177 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000136442913 1417316871 /nfs/dbraw/zinc/31/68/71/1417316871.db2.gz ATWFGFHLVKZDQF-FQEVSTJZSA-N 0 0 387.411 3.118 20 5 GGBDRN O=C(NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000136517327 1417323059 /nfs/dbraw/zinc/32/30/59/1417323059.db2.gz OMFFYONCYBTKLZ-CQSZACIVSA-N 0 0 388.273 3.096 20 5 GGBDRN C[C@H](Cc1ccccc1F)NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136593487 1417330862 /nfs/dbraw/zinc/33/08/62/1417330862.db2.gz WCAKCWFWEPUKDZ-GFCCVEGCSA-N 0 0 378.425 3.179 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(C[C@@H]2CCCO2)c1 ZINC000136598297 1417331417 /nfs/dbraw/zinc/33/14/17/1417331417.db2.gz YCDVVDKUIPWZJG-AWEZNQCLSA-N 0 0 376.438 3.335 20 5 GGBDRN C=CC(=O)Nc1cc(NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)ccc1F ZINC000136607509 1417332096 /nfs/dbraw/zinc/33/20/96/1417332096.db2.gz KKQFJOFSLNGVKI-UHFFFAOYSA-N 0 0 377.303 3.015 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])n2)cc1 ZINC000136622297 1417333075 /nfs/dbraw/zinc/33/30/75/1417333075.db2.gz ZLNKURJVAJAEHJ-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN CCc1nc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])c(Cl)c3)CC2)cs1 ZINC000136638207 1417334020 /nfs/dbraw/zinc/33/40/20/1417334020.db2.gz MVJXLPCFLHTANE-UHFFFAOYSA-N 0 0 394.884 3.225 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000136643600 1417334763 /nfs/dbraw/zinc/33/47/63/1417334763.db2.gz KPQCJUJKIHFUFA-OCCSQVGLSA-N 0 0 381.860 3.405 20 5 GGBDRN O=C(NCc1cc(-c2ccccc2)on1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136814540 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ZINC000142713827 1417595866 /nfs/dbraw/zinc/59/58/66/1417595866.db2.gz IQTXSIGMPBWWRT-OKILXGFUSA-N 0 0 384.436 3.312 20 5 GGBDRN O=C(Nc1cccc(CN2CCOCC2)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000142961724 1417604878 /nfs/dbraw/zinc/60/48/78/1417604878.db2.gz BROUPVUELKWTFS-UHFFFAOYSA-N 0 0 396.447 3.254 20 5 GGBDRN CC[C@H](NC(=O)CCn1cc([N+](=O)[O-])nc1C)c1ccccc1OC(F)F ZINC000143023287 1417607626 /nfs/dbraw/zinc/60/76/26/1417607626.db2.gz YIVALKMYAYZVJW-ZDUSSCGKSA-N 0 0 382.367 3.359 20 5 GGBDRN C[C@@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000143263597 1417623226 /nfs/dbraw/zinc/62/32/26/1417623226.db2.gz QPMWYWFCXUSWQK-CQSZACIVSA-N 0 0 398.419 3.454 20 5 GGBDRN C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000143510414 1417638459 /nfs/dbraw/zinc/63/84/59/1417638459.db2.gz NOTPQNSXSOUBOG-ZDUSSCGKSA-N 0 0 384.392 3.112 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(-n2cnc3ccccc32)nc1 ZINC000143691274 1417645008 /nfs/dbraw/zinc/64/50/08/1417645008.db2.gz 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COC(=O)c1cc(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000144914739 1417676232 /nfs/dbraw/zinc/67/62/32/1417676232.db2.gz XULUQUCTZYHFKS-HNAYVOBHSA-N 0 0 398.415 3.279 20 5 GGBDRN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000144921497 1417676307 /nfs/dbraw/zinc/67/63/07/1417676307.db2.gz MTXPGZCXXNATKM-KSSFIOAISA-N 0 0 385.376 3.401 20 5 GGBDRN COC(=O)c1cc(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000144915284 1417676401 /nfs/dbraw/zinc/67/64/01/1417676401.db2.gz XULUQUCTZYHFKS-BEFAXECRSA-N 0 0 398.415 3.279 20 5 GGBDRN CN(Cc1cnn(C)c1)C(=O)COc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000145266526 1417683334 /nfs/dbraw/zinc/68/33/34/1417683334.db2.gz XNMSOQBZRJOKNJ-UHFFFAOYSA-N 0 0 380.404 3.033 20 5 GGBDRN O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000145234203 1417683691 /nfs/dbraw/zinc/68/36/91/1417683691.db2.gz CBDQVGSNTOJMNX-KUHUBIRLSA-N 0 0 384.388 3.221 20 5 GGBDRN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000145233799 1417683955 /nfs/dbraw/zinc/68/39/55/1417683955.db2.gz CBDQVGSNTOJMNX-LIRRHRJNSA-N 0 0 384.388 3.221 20 5 GGBDRN CCC(CC)c1nnc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)s1 ZINC000145529345 1417690845 /nfs/dbraw/zinc/69/08/45/1417690845.db2.gz JMNUDQYBVHFNBV-UHFFFAOYSA-N 0 0 398.466 3.006 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000145566635 1417691714 /nfs/dbraw/zinc/69/17/14/1417691714.db2.gz LZAFUBOKSULDBS-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN O=[N+]([O-])c1cc(CNc2ccc(N3CCC(CO)CC3)cn2)ccc1Cl ZINC000178867475 1429202611 /nfs/dbraw/zinc/20/26/11/1429202611.db2.gz UVLNXVKCNSQSGD-UHFFFAOYSA-N 0 0 376.844 3.464 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(OC(C)(C)C)cc1 ZINC000146084578 1417710216 /nfs/dbraw/zinc/71/02/16/1417710216.db2.gz XEDOQWKRJLXLTR-AWEZNQCLSA-N 0 0 399.447 3.207 20 5 GGBDRN Cc1cccc(C)c1OC[C@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000146108331 1417710600 /nfs/dbraw/zinc/71/06/00/1417710600.db2.gz TYIHNBPBKUGTQA-CQSZACIVSA-N 0 0 393.827 3.426 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000146252645 1417712948 /nfs/dbraw/zinc/71/29/48/1417712948.db2.gz MAPIIAIEKGELFV-RDTXWAMCSA-N 0 0 394.424 3.180 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000146240953 1417713295 /nfs/dbraw/zinc/71/32/95/1417713295.db2.gz PBVXUQNDFRCLME-WMZOPIPTSA-N 0 0 390.461 3.349 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1ccc2c(c1)COC2)c1ccccc1[N+](=O)[O-] ZINC000146301423 1417715166 /nfs/dbraw/zinc/71/51/66/1417715166.db2.gz MAZRSHFPRBBQJG-GOSISDBHSA-N 0 0 398.415 3.438 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000146297407 1417715540 /nfs/dbraw/zinc/71/55/40/1417715540.db2.gz HWRDNGZTUCOVAN-LPHOPBHVSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000146331708 1417716475 /nfs/dbraw/zinc/71/64/75/1417716475.db2.gz ZGNUXACWUZQLTG-APWZRJJASA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cc1 ZINC000146337552 1417716598 /nfs/dbraw/zinc/71/65/98/1417716598.db2.gz HIQRUMIGBVAWRM-YJBOKZPZSA-N 0 0 376.434 3.041 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccc(F)cc2)cc([N+](=O)[O-])c1 ZINC000146423002 1417719135 /nfs/dbraw/zinc/71/91/35/1417719135.db2.gz OVWWRYQMRNFMTN-QGZVFWFLSA-N 0 0 392.408 3.115 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCCOc2ccc(F)cc21 ZINC000146438926 1417720480 /nfs/dbraw/zinc/72/04/80/1417720480.db2.gz KJIVMORNULSEHV-HNNXBMFYSA-N 0 0 387.367 3.011 20 5 GGBDRN O=C(NCc1cccc(-n2cncn2)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178873159 1429204434 /nfs/dbraw/zinc/20/44/34/1429204434.db2.gz NCZBVTACBJKLRD-UHFFFAOYSA-N 0 0 392.419 3.050 20 5 GGBDRN COc1ccc2c(c1)OC[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000146844088 1417733107 /nfs/dbraw/zinc/73/31/07/1417733107.db2.gz KAZNLDZYQHBHFS-LLVKDONJSA-N 0 0 394.330 3.395 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1OC)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000147209059 1417741538 /nfs/dbraw/zinc/74/15/38/1417741538.db2.gz USEDNSGRSFXUPQ-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)cc([N+](=O)[O-])c1 ZINC000147450142 1417746697 /nfs/dbraw/zinc/74/66/97/1417746697.db2.gz XAPLTCOWQBIYJN-UHFFFAOYSA-N 0 0 381.432 3.459 20 5 GGBDRN Cn1c2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2n(C)c1=O ZINC000147423053 1417746797 /nfs/dbraw/zinc/74/67/97/1417746797.db2.gz JPMGXDXCLJNJHS-UHFFFAOYSA-N 0 0 375.772 3.083 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cc1 ZINC000147461948 1417747958 /nfs/dbraw/zinc/74/79/58/1417747958.db2.gz GVBJPJWQFXQNAH-IEBWSBKVSA-N 0 0 390.461 3.182 20 5 GGBDRN CCOc1c(OC)cc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000147833588 1417754173 /nfs/dbraw/zinc/75/41/73/1417754173.db2.gz ZYDNJAKMPQQGHF-UHFFFAOYSA-N 0 0 375.381 3.332 20 5 GGBDRN Cc1cc(C(=O)NCc2cccc(NC(=O)c3ccccn3)c2)cc([N+](=O)[O-])c1 ZINC000148220999 1417761098 /nfs/dbraw/zinc/76/10/98/1417761098.db2.gz GOBGZTIOBFRSQK-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN C[C@H](CC(=O)OCc1ccccc1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000178877039 1429208248 /nfs/dbraw/zinc/20/82/48/1429208248.db2.gz PPULZNOUOIDRDZ-OAHLLOKOSA-N 0 0 385.420 3.258 20 5 GGBDRN Cc1nc(C(C)(C)C)sc1C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000149168274 1417772629 /nfs/dbraw/zinc/77/26/29/1417772629.db2.gz SAKKWGLOTCSFJV-UHFFFAOYSA-N 0 0 389.481 3.015 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)CCc1ccc(OC(C)C)cc1 ZINC000149723139 1417779282 /nfs/dbraw/zinc/77/92/82/1417779282.db2.gz LFPSAIICHCIVHP-OAHLLOKOSA-N 0 0 388.468 3.415 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000149987425 1417782951 /nfs/dbraw/zinc/78/29/51/1417782951.db2.gz ZVWURVMYULBBRU-APWZRJJASA-N 0 0 397.431 3.126 20 5 GGBDRN CCc1c(C(=O)CN2CCN(c3ccccc3[N+](=O)[O-])CC2)[nH]c(C)c1C(C)=O ZINC000150106098 1417784507 /nfs/dbraw/zinc/78/45/07/1417784507.db2.gz GDKHRKGELNSPBY-UHFFFAOYSA-N 0 0 398.463 3.001 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(NC(=O)OCC(C)C)c1 ZINC000150068107 1417784533 /nfs/dbraw/zinc/78/45/33/1417784533.db2.gz SGUKXIFWCRGJSJ-UHFFFAOYSA-N 0 0 389.412 3.333 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(C)nn2-c2cc(C)nc(C)n2)cc1[N+](=O)[O-] ZINC000150694861 1417789499 /nfs/dbraw/zinc/78/94/99/1417789499.db2.gz ZZVASWKGXXZAGZ-UHFFFAOYSA-N 0 0 398.448 3.470 20 5 GGBDRN O=C(Nc1ccc(-n2nccn2)cc1)c1ccc([N+](=O)[O-])cc1Br ZINC000150712711 1417790625 /nfs/dbraw/zinc/79/06/25/1417790625.db2.gz UXKFCVIRFMOHKB-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN Cc1ccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000150722026 1417792216 /nfs/dbraw/zinc/79/22/16/1417792216.db2.gz ZJKKGJADRZZOAY-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c2ccccc2NC1=O ZINC000150751275 1417798811 /nfs/dbraw/zinc/79/88/11/1417798811.db2.gz IPCCANVLQHTNQI-LBPRGKRZSA-N 0 0 380.404 3.404 20 5 GGBDRN COc1ccc([C@@H](C)CCNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000150765473 1417803187 /nfs/dbraw/zinc/80/31/87/1417803187.db2.gz KEFIUFUADDMOJI-ZDUSSCGKSA-N 0 0 395.415 3.369 20 5 GGBDRN CCCOc1cc(C)ccc1CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000150781973 1417805560 /nfs/dbraw/zinc/80/55/60/1417805560.db2.gz ZQTQUVHLRYMPKR-UHFFFAOYSA-N 0 0 395.419 3.203 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000150782134 1417805686 /nfs/dbraw/zinc/80/56/86/1417805686.db2.gz BXONWPBQMBYUJS-SNVBAGLBSA-N 0 0 386.376 3.263 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000150795216 1417808192 /nfs/dbraw/zinc/80/81/92/1417808192.db2.gz AXNJCDROHIMTMT-INIZCTEOSA-N 0 0 377.441 3.120 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC[C@@H]2c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000150798232 1417808715 /nfs/dbraw/zinc/80/87/15/1417808715.db2.gz FBDOWTGJNDDUMU-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC(N3CCCCC3=O)CC2)cc1[N+](=O)[O-] ZINC000150805495 1417810306 /nfs/dbraw/zinc/81/03/06/1417810306.db2.gz DGUGUZQUIGSCFP-OAHLLOKOSA-N 0 0 388.468 3.151 20 5 GGBDRN C[C@@H]1CCC[C@H](C)CN1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000150804584 1417810504 /nfs/dbraw/zinc/81/05/04/1417810504.db2.gz NOQJOLBWCQBBQT-UONOGXRCSA-N 0 0 375.425 3.320 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000150810748 1417811292 /nfs/dbraw/zinc/81/12/92/1417811292.db2.gz RQUXLMQKPNQUST-OAHLLOKOSA-N 0 0 399.447 3.381 20 5 GGBDRN COc1cc(S(=O)(=O)NC2(c3nc(C)cs3)CCCC2)ccc1[N+](=O)[O-] ZINC000150814145 1417812525 /nfs/dbraw/zinc/81/25/25/1417812525.db2.gz RIRDPXIYUJOVBA-UHFFFAOYSA-N 0 0 397.478 3.116 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)NC2(c3cccc(Cl)c3)CC2)cc([N+](=O)[O-])c1 ZINC000150816232 1417812969 /nfs/dbraw/zinc/81/29/69/1417812969.db2.gz PEBVGGGEDATCTC-UHFFFAOYSA-N 0 0 394.836 3.071 20 5 GGBDRN CC[C@@H](c1ccncc1)N(CC)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000150818400 1417813402 /nfs/dbraw/zinc/81/34/02/1417813402.db2.gz FJFTXEAKVXFJIF-HNNXBMFYSA-N 0 0 379.438 3.160 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000150832648 1417815863 /nfs/dbraw/zinc/81/58/63/1417815863.db2.gz CPCXKTVLQWZGMB-ZDUSSCGKSA-N 0 0 375.375 3.058 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000150832626 1417815877 /nfs/dbraw/zinc/81/58/77/1417815877.db2.gz CPCXKTVLQWZGMB-CYBMUJFWSA-N 0 0 375.375 3.058 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000150833263 1417816268 /nfs/dbraw/zinc/81/62/68/1417816268.db2.gz LBEPVTWBBCGYGX-BBRMVZONSA-N 0 0 376.434 3.170 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000150835396 1417816485 /nfs/dbraw/zinc/81/64/85/1417816485.db2.gz DYHPAGLBRHZLPY-OLZOCXBDSA-N 0 0 395.431 3.499 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000150835560 1417816519 /nfs/dbraw/zinc/81/65/19/1417816519.db2.gz IUVXCIWHQVSODX-ZDUSSCGKSA-N 0 0 399.325 3.331 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000150835320 1417816554 /nfs/dbraw/zinc/81/65/54/1417816554.db2.gz DYHPAGLBRHZLPY-QWHCGFSZSA-N 0 0 395.431 3.499 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CC2)c1[N+](=O)[O-] ZINC000150836433 1417816996 /nfs/dbraw/zinc/81/69/96/1417816996.db2.gz OAABRMJDJPXHHP-AWEZNQCLSA-N 0 0 381.404 3.075 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@@](O)(c2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000150837895 1417817237 /nfs/dbraw/zinc/81/72/37/1417817237.db2.gz IGWFVBWGYISKSK-MRXNPFEDSA-N 0 0 399.325 3.029 20 5 GGBDRN O=C(Nc1ccc(-c2ccccc2)nn1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000150845853 1417819254 /nfs/dbraw/zinc/81/92/54/1417819254.db2.gz RQEIFEGTFKYAPX-UHFFFAOYSA-N 0 0 386.371 3.490 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc(COCc2ccccc2)cc1 ZINC000150871447 1417824919 /nfs/dbraw/zinc/82/49/19/1417824919.db2.gz FVFFEMDTESGTAW-UHFFFAOYSA-N 0 0 393.399 3.112 20 5 GGBDRN Cc1cccc(-c2cccc(CNC(=O)NCCn3cc([N+](=O)[O-])cn3)c2)c1 ZINC000150882354 1417827253 /nfs/dbraw/zinc/82/72/53/1417827253.db2.gz VQYGQEZHNLCBCI-UHFFFAOYSA-N 0 0 379.420 3.266 20 5 GGBDRN Cc1nc(COc2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000150904751 1417832132 /nfs/dbraw/zinc/83/21/32/1417832132.db2.gz GTAYZQGBHCCMHK-UHFFFAOYSA-N 0 0 382.376 3.437 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000150911186 1417833282 /nfs/dbraw/zinc/83/32/82/1417833282.db2.gz YOPKAEQWNWWJMN-MRXNPFEDSA-N 0 0 377.832 3.285 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CC=C(c2ccc(F)cc2)CC1 ZINC000178893957 1429213468 /nfs/dbraw/zinc/21/34/68/1429213468.db2.gz AFGYBLKBCKZDEV-UHFFFAOYSA-N 0 0 393.378 3.244 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CCC(=O)OC(C)(C)C ZINC000150942258 1417840600 /nfs/dbraw/zinc/84/06/00/1417840600.db2.gz ZJMIRILEDZLTCL-LBPRGKRZSA-N 0 0 376.413 3.369 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccccc2OC(F)(F)F)c1 ZINC000150941667 1417840646 /nfs/dbraw/zinc/84/06/46/1417840646.db2.gz FQAROHQFKXEXPL-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCc2ccccc2OC(F)(F)F)c1[N+](=O)[O-] ZINC000150949869 1417842293 /nfs/dbraw/zinc/84/22/93/1417842293.db2.gz WYBVMHOQFARWOK-UHFFFAOYSA-N 0 0 386.330 3.142 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)c1[N+](=O)[O-] ZINC000150954801 1417843154 /nfs/dbraw/zinc/84/31/54/1417843154.db2.gz WIKQCLFLJXLJPP-UHFFFAOYSA-N 0 0 386.358 3.340 20 5 GGBDRN COc1cc(C(=O)NCCc2ccccc2OC(F)(F)F)ccc1[N+](=O)[O-] ZINC000150960268 1417844577 /nfs/dbraw/zinc/84/45/77/1417844577.db2.gz BTHMDKULIBHLMT-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN CCOc1cc(C(=O)NCCc2ccc(Cl)nc2)c([N+](=O)[O-])cc1OC ZINC000150982836 1417849112 /nfs/dbraw/zinc/84/91/12/1417849112.db2.gz RQAPWRCFGVTUCM-UHFFFAOYSA-N 0 0 379.800 3.023 20 5 GGBDRN COc1cccc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000178897125 1429214494 /nfs/dbraw/zinc/21/44/94/1429214494.db2.gz WCDRTZPHKBGRSH-OAHLLOKOSA-N 0 0 384.310 3.086 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(C2CCCCC2)nn1C ZINC000151003945 1417853595 /nfs/dbraw/zinc/85/35/95/1417853595.db2.gz DWMIBUQBSBEIPB-ZDUSSCGKSA-N 0 0 399.451 3.133 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1nnc(-c2ccccc2)s1 ZINC000151051190 1417862411 /nfs/dbraw/zinc/86/24/11/1417862411.db2.gz HLFHDRGCAQTLCJ-UHFFFAOYSA-N 0 0 384.417 3.199 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000151050753 1417862418 /nfs/dbraw/zinc/86/24/18/1417862418.db2.gz IKEYLOGLEDBCKW-ZDUSSCGKSA-N 0 0 383.832 3.281 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000151050791 1417862431 /nfs/dbraw/zinc/86/24/31/1417862431.db2.gz IKEYLOGLEDBCKW-CYBMUJFWSA-N 0 0 383.832 3.281 20 5 GGBDRN CCOc1cc(C)ccc1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000151066098 1417865715 /nfs/dbraw/zinc/86/57/15/1417865715.db2.gz PGWPXUWTYYHDJU-UHFFFAOYSA-N 0 0 381.388 3.073 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000151066559 1417865805 /nfs/dbraw/zinc/86/58/05/1417865805.db2.gz DORUVNGYWUBDNL-CQSZACIVSA-N 0 0 383.832 3.281 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000151068943 1417866645 /nfs/dbraw/zinc/86/66/45/1417866645.db2.gz YNBHCIXNNOIZMJ-HKUPYCBJSA-N 0 0 375.425 3.028 20 5 GGBDRN Cc1cc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)n(Cc2ccccn2)n1 ZINC000151073439 1417867355 /nfs/dbraw/zinc/86/73/55/1417867355.db2.gz XDQOKVNJRSJXHR-UHFFFAOYSA-N 0 0 392.419 3.133 20 5 GGBDRN CC[C@@](C)(NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1)c1nc(C)cs1 ZINC000151082665 1417869089 /nfs/dbraw/zinc/86/90/89/1417869089.db2.gz YXXGLDCPYHMJCD-QGZVFWFLSA-N 0 0 379.438 3.189 20 5 GGBDRN C[C@@H](NC(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178906149 1429216266 /nfs/dbraw/zinc/21/62/66/1429216266.db2.gz ORJSBMLCZIIYFZ-YSGRDPCXSA-N 0 0 399.447 3.190 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000151087583 1417869966 /nfs/dbraw/zinc/86/99/66/1417869966.db2.gz KGCHLOVBDZVVIF-GOSISDBHSA-N 0 0 376.359 3.406 20 5 GGBDRN O=C(NCc1cccc(N2CC=CC2)c1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000151121133 1417876611 /nfs/dbraw/zinc/87/66/11/1417876611.db2.gz DQRPVBLOYKVDPJ-UHFFFAOYSA-N 0 0 389.415 3.087 20 5 GGBDRN O=C(OCCc1ccccc1[N+](=O)[O-])c1cc(N2CCNC2=O)ccc1Cl ZINC000151186448 1417890305 /nfs/dbraw/zinc/89/03/05/1417890305.db2.gz SXFJVASXJQVFLE-UHFFFAOYSA-N 0 0 389.795 3.177 20 5 GGBDRN CC(C)(C)OC(=O)NCC1(NC(=O)CCc2cccc([N+](=O)[O-])c2)CCCC1 ZINC000151193830 1417891379 /nfs/dbraw/zinc/89/13/79/1417891379.db2.gz TZGMWPZWQSULGX-UHFFFAOYSA-N 0 0 391.468 3.481 20 5 GGBDRN O=C(OCCc1ccccc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)c2ccccc2)C1 ZINC000151201215 1417892593 /nfs/dbraw/zinc/89/25/93/1417892593.db2.gz WQIMCDOMQITPET-GOSISDBHSA-N 0 0 382.416 3.233 20 5 GGBDRN C[C@H](CCNC(=O)NCCn1cc([N+](=O)[O-])cn1)c1cccc(C(F)(F)F)c1 ZINC000151201267 1417892802 /nfs/dbraw/zinc/89/28/02/1417892802.db2.gz DYXNXRNPDQONNL-GFCCVEGCSA-N 0 0 399.373 3.303 20 5 GGBDRN COc1ccccc1-c1nn(C)cc1C(=O)OCCc1ccccc1[N+](=O)[O-] ZINC000151202444 1417893071 /nfs/dbraw/zinc/89/30/71/1417893071.db2.gz NCPVOCQOSLTIOT-UHFFFAOYSA-N 0 0 381.388 3.403 20 5 GGBDRN O=C(N[C@@H](CCO)C1CCCCC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000151204328 1417893598 /nfs/dbraw/zinc/89/35/98/1417893598.db2.gz JZMYDYOCHNFBBE-KRWDZBQOSA-N 0 0 375.469 3.256 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cccs1)C(=O)OCCc1ccccc1[N+](=O)[O-] ZINC000151208849 1417894429 /nfs/dbraw/zinc/89/44/29/1417894429.db2.gz MYVZDFRQHMGROS-MRXNPFEDSA-N 0 0 376.434 3.197 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000151219059 1417895889 /nfs/dbraw/zinc/89/58/89/1417895889.db2.gz YDTZKBWFJSPSHR-UHFFFAOYSA-N 0 0 398.375 3.000 20 5 GGBDRN CCOC(=O)C1(N(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CCCCC1 ZINC000151222381 1417896798 /nfs/dbraw/zinc/89/67/98/1417896798.db2.gz HKINUOMDHZKISK-UHFFFAOYSA-N 0 0 377.441 3.040 20 5 GGBDRN COC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(F)c1 ZINC000151222923 1417896820 /nfs/dbraw/zinc/89/68/20/1417896820.db2.gz CHLOLOTZLKLDQT-HNNXBMFYSA-N 0 0 380.759 3.422 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C2CCCCC2)C1=O ZINC000151224566 1417897206 /nfs/dbraw/zinc/89/72/06/1417897206.db2.gz ZLUOJQAILIJNOK-DYVFJYSZSA-N 0 0 391.493 3.125 20 5 GGBDRN CSC[C@@](C)(O)CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000151233876 1417898817 /nfs/dbraw/zinc/89/88/17/1417898817.db2.gz VTHJBGBRGGRZLS-IBGZPJMESA-N 0 0 389.477 3.051 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(COc3ccc(C)cc3[N+](=O)[O-])nc2c1 ZINC000151243645 1417901721 /nfs/dbraw/zinc/90/17/21/1417901721.db2.gz HLMXWTSPDSAVKB-UHFFFAOYSA-N 0 0 376.390 3.417 20 5 GGBDRN CC(=O)N[C@H](CC(=O)OCCc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000151245432 1417902346 /nfs/dbraw/zinc/90/23/46/1417902346.db2.gz ATIOHDBAUMUUFC-MRXNPFEDSA-N 0 0 392.358 3.226 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)OCCc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000151245369 1417902573 /nfs/dbraw/zinc/90/25/73/1417902573.db2.gz ATIOHDBAUMUUFC-INIZCTEOSA-N 0 0 392.358 3.226 20 5 GGBDRN CC[C@H](C)Oc1cc(C)ccc1CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000151248312 1417902933 /nfs/dbraw/zinc/90/29/33/1417902933.db2.gz UULOPAIWPSVHBK-HNNXBMFYSA-N 0 0 399.447 3.127 20 5 GGBDRN Cc1ccc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1-c1ncco1 ZINC000151290672 1417917062 /nfs/dbraw/zinc/91/70/62/1417917062.db2.gz PQICIDNUHGJWIC-UHFFFAOYSA-N 0 0 394.343 3.105 20 5 GGBDRN Cc1c(C(=O)N2c3ccccc3CC[C@@H]2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000151297172 1417918824 /nfs/dbraw/zinc/91/88/24/1417918824.db2.gz JESZCKSOPZSHKN-ZDUSSCGKSA-N 0 0 377.404 3.465 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](C)Cc1nc2ccccc2s1 ZINC000178909351 1429217352 /nfs/dbraw/zinc/21/73/52/1429217352.db2.gz WBPUUENDJXYRRT-GFCCVEGCSA-N 0 0 391.474 3.422 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)C[C@H](O)c2cccs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000151314338 1417923770 /nfs/dbraw/zinc/92/37/70/1417923770.db2.gz CEMWHNZKKUDJAE-XPTSAGLGSA-N 0 0 393.421 3.423 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1sc2c(c1C(=O)c1ccccc1)CCC2 ZINC000178912197 1429217736 /nfs/dbraw/zinc/21/77/36/1429217736.db2.gz NZUXDTHEXLHYTP-UHFFFAOYSA-N 0 0 396.428 3.211 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)CCO1 ZINC000151336746 1417929297 /nfs/dbraw/zinc/92/92/97/1417929297.db2.gz UPKJOTYGCJROTC-SFHVURJKSA-N 0 0 385.376 3.334 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(F)cc2CS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000151350355 1417932937 /nfs/dbraw/zinc/93/29/37/1417932937.db2.gz MKUBFHVUSGNBSI-UHFFFAOYSA-N 0 0 380.397 3.093 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000151380018 1417942379 /nfs/dbraw/zinc/94/23/79/1417942379.db2.gz GVFXGHRZWMUMLT-WOJBJXKFSA-N 0 0 383.448 3.004 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151379883 1417942468 /nfs/dbraw/zinc/94/24/68/1417942468.db2.gz GVFXGHRZWMUMLT-UXHICEINSA-N 0 0 383.448 3.004 20 5 GGBDRN COCCN(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000151391804 1417946503 /nfs/dbraw/zinc/94/65/03/1417946503.db2.gz AFHSTBNOZVFQQP-UHFFFAOYSA-N 0 0 377.353 3.002 20 5 GGBDRN CC(=O)CCc1ccc(OS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000178929130 1429223217 /nfs/dbraw/zinc/22/32/17/1429223217.db2.gz DBZVJUNOXQURSO-UHFFFAOYSA-N 0 0 377.418 3.068 20 5 GGBDRN COc1ccc([C@@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000178935552 1429224523 /nfs/dbraw/zinc/22/45/23/1429224523.db2.gz OWSBVDCKKAEMOV-IBGZPJMESA-N 0 0 392.477 3.463 20 5 GGBDRN Cc1nc(-c2ccc(CNS(=O)(=O)Cc3cccc([N+](=O)[O-])c3)o2)cs1 ZINC000151450600 1417976700 /nfs/dbraw/zinc/97/67/00/1417976700.db2.gz MHUNTFQFROXERP-UHFFFAOYSA-N 0 0 393.446 3.239 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000178938263 1429224765 /nfs/dbraw/zinc/22/47/65/1429224765.db2.gz VGTJNBPCURVDAG-SFHVURJKSA-N 0 0 390.461 3.313 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1nnc(-c2ccccc2)s1 ZINC000151460003 1417982422 /nfs/dbraw/zinc/98/24/22/1417982422.db2.gz ZKHBVVHMCLEVLZ-UHFFFAOYSA-N 0 0 383.433 3.155 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000178936825 1429225167 /nfs/dbraw/zinc/22/51/67/1429225167.db2.gz BRCBOCQFIPDPNO-UONOGXRCSA-N 0 0 379.457 3.232 20 5 GGBDRN O=C(Nc1ccc(F)nc1)c1ccc(C(=O)Nc2ccc(F)nc2)c([N+](=O)[O-])c1 ZINC000151465500 1417984172 /nfs/dbraw/zinc/98/41/72/1417984172.db2.gz RBVQPDUJFRTTNQ-UHFFFAOYSA-N 0 0 399.313 3.168 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000178936841 1429225216 /nfs/dbraw/zinc/22/52/16/1429225216.db2.gz BRCBOCQFIPDPNO-KGLIPLIRSA-N 0 0 379.457 3.232 20 5 GGBDRN C[C@H](c1ccc(F)c(F)c1)N(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000178939149 1429225784 /nfs/dbraw/zinc/22/57/84/1429225784.db2.gz VXSDCZQYFRVILK-GFCCVEGCSA-N 0 0 384.404 3.438 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc(C)c1[N+](=O)[O-])[C@H]1CN(Cc2ccccc2)CCO1 ZINC000151479358 1417993623 /nfs/dbraw/zinc/99/36/23/1417993623.db2.gz MXIZXESFVGQEEE-WOJBJXKFSA-N 0 0 397.475 3.313 20 5 GGBDRN CCO[C@@H]1C[C@H](O)C12CCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CC2 ZINC000151480370 1417994567 /nfs/dbraw/zinc/99/45/67/1417994567.db2.gz ZINQMMUHKGWUER-ZWKOTPCHSA-N 0 0 390.480 3.284 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)c1[N+](=O)[O-] ZINC000151481479 1417995427 /nfs/dbraw/zinc/99/54/27/1417995427.db2.gz PBPBTVKITFBFRU-INIZCTEOSA-N 0 0 380.416 3.233 20 5 GGBDRN CC[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@H]1CN(Cc2ccccc2)CCO1 ZINC000151494921 1418002613 /nfs/dbraw/zinc/00/26/13/1418002613.db2.gz SKQAEZJHACNACW-UYAOXDASSA-N 0 0 383.448 3.004 20 5 GGBDRN O=c1ccc(-c2ccccc2F)nn1CN1CCCc2ccc([N+](=O)[O-])cc21 ZINC000151509735 1418008714 /nfs/dbraw/zinc/00/87/14/1418008714.db2.gz 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COc1cc(NC(C)=O)ccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000152024047 1418123247 /nfs/dbraw/zinc/12/32/47/1418123247.db2.gz QZBRUXGTEKVOEK-UHFFFAOYSA-N 0 0 383.364 3.224 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCN(C2CCCCC2)C1=O ZINC000152029685 1418125465 /nfs/dbraw/zinc/12/54/65/1418125465.db2.gz CWCMZACUTMEMGD-OAHLLOKOSA-N 0 0 380.832 3.303 20 5 GGBDRN C[C@@H]1COCCN1c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1 ZINC000152033626 1418126229 /nfs/dbraw/zinc/12/62/29/1418126229.db2.gz TVVLXLSLSQZXMK-CQSZACIVSA-N 0 0 384.436 3.138 20 5 GGBDRN CC(C)(C)[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000152073773 1418137925 /nfs/dbraw/zinc/13/79/25/1418137925.db2.gz YEWSSALNFIQWNE-SFHVURJKSA-N 0 0 387.411 3.367 20 5 GGBDRN O=C(N[C@H]1[C@@H]2CCO[C@@H]2C12CCCC2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000152073285 1418137987 /nfs/dbraw/zinc/13/79/87/1418137987.db2.gz UCDNIAPSSDRVDV-VDGAXYAQSA-N 0 0 399.491 3.275 20 5 GGBDRN CCn1c(Sc2ccc3nccnc3n2)nnc1-c1ccc([N+](=O)[O-])cc1 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377.441 3.265 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CNc3ccc4c(c3)S(=O)(=O)CC4)co2)cc1 ZINC000179286154 1429314556 /nfs/dbraw/zinc/31/45/56/1429314556.db2.gz OXIRGKSQWWEPAJ-UHFFFAOYSA-N 0 0 385.401 3.192 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000179303949 1429321323 /nfs/dbraw/zinc/32/13/23/1429321323.db2.gz JGUSBJQCZFZGFQ-CYBMUJFWSA-N 0 0 392.818 3.465 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccnc1OCC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000179312007 1429324842 /nfs/dbraw/zinc/32/48/42/1429324842.db2.gz VDVZGQAFGAULFZ-LLVKDONJSA-N 0 0 380.351 3.194 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(Cn2cncn2)cc1 ZINC000179315405 1429325905 /nfs/dbraw/zinc/32/59/05/1429325905.db2.gz YKPYBFLDMVDEGU-UHFFFAOYSA-N 0 0 397.460 3.277 20 5 GGBDRN CN(Cc1ccccc1OCC(=O)NCC1CC1)Cc1ccccc1[N+](=O)[O-] ZINC000179316094 1429325961 /nfs/dbraw/zinc/32/59/61/1429325961.db2.gz DZZRRXJSIKNXBS-UHFFFAOYSA-N 0 0 383.448 3.132 20 5 GGBDRN Cc1ccnc(-n2nccc2NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000179320092 1429327769 /nfs/dbraw/zinc/32/77/69/1429327769.db2.gz IMDKZGIIGPHPGP-UHFFFAOYSA-N 0 0 376.376 3.146 20 5 GGBDRN CN1CCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2ccccc21 ZINC000179324744 1429329322 /nfs/dbraw/zinc/32/93/22/1429329322.db2.gz YUZWINCMZBBFKN-UHFFFAOYSA-N 0 0 377.404 3.267 20 5 GGBDRN C[C@H](NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000179329754 1429330376 /nfs/dbraw/zinc/33/03/76/1429330376.db2.gz BNIZTHKZLPHDKO-QFYYESIMSA-N 0 0 381.791 3.481 20 5 GGBDRN COc1ccc(C[C@@H](C)C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000179331441 1429331282 /nfs/dbraw/zinc/33/12/82/1429331282.db2.gz ZGSCVFMCJFEZQG-MRXNPFEDSA-N 0 0 383.448 3.131 20 5 GGBDRN COc1cccc(-c2nc(C)c(C(=O)NCc3cc([N+](=O)[O-])ccc3OC)[nH]2)c1 ZINC000179333005 1429331576 /nfs/dbraw/zinc/33/15/76/1429331576.db2.gz NWEUBNSRHAYZLZ-UHFFFAOYSA-N 0 0 396.403 3.241 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cc3ncn(-c4ccccc4)n3)CC2)cc1 ZINC000179356155 1429341662 /nfs/dbraw/zinc/34/16/62/1429341662.db2.gz SVMNXMMRRAEXLJ-UHFFFAOYSA-N 0 0 379.420 3.219 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179357940 1429342312 /nfs/dbraw/zinc/34/23/12/1429342312.db2.gz QECJXQNSSXXROF-CYBMUJFWSA-N 0 0 392.419 3.158 20 5 GGBDRN COc1cccc(CNC(=O)[C@H](C)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000179374076 1429348767 /nfs/dbraw/zinc/34/87/67/1429348767.db2.gz XZSWTJMFOSQXAR-ZDUSSCGKSA-N 0 0 391.855 3.394 20 5 GGBDRN CCCNC(=O)c1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000179390294 1429355537 /nfs/dbraw/zinc/35/55/37/1429355537.db2.gz XFNUYEQNDZUCAX-UHFFFAOYSA-N 0 0 393.403 3.173 20 5 GGBDRN Cn1c(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc2ccccc21 ZINC000179395599 1429357540 /nfs/dbraw/zinc/35/75/40/1429357540.db2.gz CKRLTBMICXSSPY-UHFFFAOYSA-N 0 0 379.420 3.356 20 5 GGBDRN COC(=O)CCc1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000179408432 1429362928 /nfs/dbraw/zinc/36/29/28/1429362928.db2.gz GWPSBMAIVNCFJA-UHFFFAOYSA-N 0 0 394.387 3.138 20 5 GGBDRN Cc1c(CCC(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cnn1C ZINC000179408148 1429363224 /nfs/dbraw/zinc/36/32/24/1429363224.db2.gz JBADJTDKUAYNEG-UHFFFAOYSA-N 0 0 384.358 3.160 20 5 GGBDRN O=C(CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)Nc1ccccc1 ZINC000179419575 1429367775 /nfs/dbraw/zinc/36/77/75/1429367775.db2.gz SXTHEKJTOVFOBK-UHFFFAOYSA-N 0 0 393.197 3.118 20 5 GGBDRN CCOC(=O)c1cc(NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000179439127 1429376193 /nfs/dbraw/zinc/37/61/93/1429376193.db2.gz KKJPHSDQQZHAML-INIZCTEOSA-N 0 0 397.431 3.232 20 5 GGBDRN O=C(Nc1cccnc1OCC(F)F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000179438826 1429376380 /nfs/dbraw/zinc/37/63/80/1429376380.db2.gz VKXWNTXQQDPDLM-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN Cc1ccc(CN2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-] ZINC000179445827 1429379218 /nfs/dbraw/zinc/37/92/18/1429379218.db2.gz ZCBMQLRBSQEHNL-UHFFFAOYSA-N 0 0 392.459 3.271 20 5 GGBDRN C[C@@H]1CCc2ccccc2[C@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000179446661 1429379768 /nfs/dbraw/zinc/37/97/68/1429379768.db2.gz YGAFGHRYRFBWCG-BLVKFPJESA-N 0 0 399.472 3.226 20 5 GGBDRN C[C@@H]1CCc2ccccc2[C@H]1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000179446536 1429379890 /nfs/dbraw/zinc/37/98/90/1429379890.db2.gz LYJANOMLEKLBON-XIKOKIGWSA-N 0 0 388.445 3.052 20 5 GGBDRN COc1cc2c(cc1CNC(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)O[C@H](C)C2 ZINC000179450069 1429381151 /nfs/dbraw/zinc/38/11/51/1429381151.db2.gz NJFZOWKMAZUGHC-GFCCVEGCSA-N 0 0 395.415 3.267 20 5 GGBDRN O=C(NC[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000179463576 1429384375 /nfs/dbraw/zinc/38/43/75/1429384375.db2.gz KREYYTHIBOCBMI-CYBMUJFWSA-N 0 0 375.450 3.004 20 5 GGBDRN O=C(c1cc2ccccc2c2cccnc12)N(CCO)CCOCC(F)(F)F ZINC000179463150 1429384450 /nfs/dbraw/zinc/38/44/50/1429384450.db2.gz JEQIVDHUDROVGY-UHFFFAOYSA-N 0 0 392.377 3.401 20 5 GGBDRN O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000179463587 1429384513 /nfs/dbraw/zinc/38/45/13/1429384513.db2.gz KREYYTHIBOCBMI-ZDUSSCGKSA-N 0 0 375.450 3.004 20 5 GGBDRN CC1CCN(c2ccc(C(=O)Nc3ccc4nncn4c3)cc2[N+](=O)[O-])CC1 ZINC000179486335 1429390065 /nfs/dbraw/zinc/39/00/65/1429390065.db2.gz BNEUTXGFXXSCCS-UHFFFAOYSA-N 0 0 380.408 3.126 20 5 GGBDRN C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2sccc2C1 ZINC000179496595 1429394922 /nfs/dbraw/zinc/39/49/22/1429394922.db2.gz XHXCHYQIKILHFT-ZDUSSCGKSA-N 0 0 398.488 3.243 20 5 GGBDRN C[C@@H]1Cc2cc(-c3ccc(CNC(=O)Cn4cc([N+](=O)[O-])cn4)cc3)ccc2O1 ZINC000179489373 1429391766 /nfs/dbraw/zinc/39/17/66/1429391766.db2.gz FUECCRSHKWEJTA-CQSZACIVSA-N 0 0 392.415 3.098 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000179496690 1429394514 /nfs/dbraw/zinc/39/45/14/1429394514.db2.gz FEIULKWYADMMCD-UHFFFAOYSA-N 0 0 398.868 3.261 20 5 GGBDRN O=C(c1ccccn1)N1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000179504082 1429399997 /nfs/dbraw/zinc/39/99/97/1429399997.db2.gz FNWYBXSLTDFFLB-UHFFFAOYSA-N 0 0 389.415 3.014 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@@H](c4nnc(C5CC5)[nH]4)C3)n2)cc1 ZINC000179508685 1429401405 /nfs/dbraw/zinc/40/14/05/1429401405.db2.gz NHQNXSJBNLTVEV-CQSZACIVSA-N 0 0 395.423 3.020 20 5 GGBDRN CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])ccc1[O-] ZINC000179529569 1429411341 /nfs/dbraw/zinc/41/13/41/1429411341.db2.gz LDLVSIVDEKISAT-KRWDZBQOSA-N 0 0 383.448 3.285 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000179537978 1429417461 /nfs/dbraw/zinc/41/74/61/1429417461.db2.gz DFRWSCLHFKUSAN-UHFFFAOYSA-N 0 0 382.420 3.459 20 5 GGBDRN Cc1nn(CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000179543631 1429420891 /nfs/dbraw/zinc/42/08/91/1429420891.db2.gz CNQGUJAPBVJJGJ-HNNXBMFYSA-N 0 0 399.495 3.181 20 5 GGBDRN Cc1nn(CN(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000179548304 1429424189 /nfs/dbraw/zinc/42/41/89/1429424189.db2.gz YEKGUWSBTDISLB-OAHLLOKOSA-N 0 0 389.456 3.152 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c(C)c1 ZINC000179545033 1429421974 /nfs/dbraw/zinc/42/19/74/1429421974.db2.gz WANGQKSWMLLEBY-UHFFFAOYSA-N 0 0 392.415 3.437 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](COc1ccccc1F)c1ccccc1 ZINC000179551387 1429426854 /nfs/dbraw/zinc/42/68/54/1429426854.db2.gz PYRSXEQHHOPDOI-OAHLLOKOSA-N 0 0 384.367 3.018 20 5 GGBDRN O=C(NOCc1ccccc1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000179553249 1429427504 /nfs/dbraw/zinc/42/75/04/1429427504.db2.gz VBAKYMYEZMFLIH-UHFFFAOYSA-N 0 0 398.156 3.061 20 5 GGBDRN COc1cc(CCNC(=O)[C@H](c2ccccc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000179556318 1429429338 /nfs/dbraw/zinc/42/93/38/1429429338.db2.gz XVWRUCLZQGFIBI-HXUWFJFHSA-N 0 0 384.432 3.465 20 5 GGBDRN Cc1ncc(CN2CCN(C(=O)c3c(C)cc(C)c([N+](=O)[O-])c3C)CC2)s1 ZINC000179559686 1429432220 /nfs/dbraw/zinc/43/22/20/1429432220.db2.gz WDUOSGWOXNHXJZ-UHFFFAOYSA-N 0 0 388.493 3.243 20 5 GGBDRN COCCn1nc(C)c(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1C ZINC000179558690 1429432375 /nfs/dbraw/zinc/43/23/75/1429432375.db2.gz GQKAVSCEQHKVMU-UHFFFAOYSA-N 0 0 389.456 3.199 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccnc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000179561385 1429434166 /nfs/dbraw/zinc/43/41/66/1429434166.db2.gz SEFCEIVRZGGDHL-CQSZACIVSA-N 0 0 390.399 3.473 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccnc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000179561373 1429434578 /nfs/dbraw/zinc/43/45/78/1429434578.db2.gz SEFCEIVRZGGDHL-AWEZNQCLSA-N 0 0 390.399 3.473 20 5 GGBDRN CCCc1cc(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)n(C)n1 ZINC000179567627 1429438992 /nfs/dbraw/zinc/43/89/92/1429438992.db2.gz HUKATWCDBFICAE-UHFFFAOYSA-N 0 0 378.454 3.161 20 5 GGBDRN CCc1cc(N2CCC[C@@H](NC(=O)c3c(C)cc(C)c([N+](=O)[O-])c3C)C2)ncn1 ZINC000179564214 1429436437 /nfs/dbraw/zinc/43/64/37/1429436437.db2.gz YREYFUKSKPVZKW-QGZVFWFLSA-N 0 0 397.479 3.271 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000179570078 1429440723 /nfs/dbraw/zinc/44/07/23/1429440723.db2.gz FXXCKAIQDGKFRX-SFHVURJKSA-N 0 0 381.363 3.496 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](c2nc(C)no2)C1 ZINC000179579727 1429449511 /nfs/dbraw/zinc/44/95/11/1429449511.db2.gz BQVXGKVYZXTXIF-GFCCVEGCSA-N 0 0 376.438 3.418 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCNC(=O)c1ccc(C)cc1 ZINC000179584219 1429452826 /nfs/dbraw/zinc/45/28/26/1429452826.db2.gz FJRVJXPVSUPKPC-UHFFFAOYSA-N 0 0 387.461 3.175 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2nc(C)no2)CC1 ZINC000179580006 1429450532 /nfs/dbraw/zinc/45/05/32/1429450532.db2.gz MXTYNCXWJDVCDZ-UHFFFAOYSA-N 0 0 376.438 3.418 20 5 GGBDRN Cc1ccc(NC(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000179583332 1429451790 /nfs/dbraw/zinc/45/17/90/1429451790.db2.gz OVGKQKKDWGQAGQ-MRXNPFEDSA-N 0 0 382.420 3.073 20 5 GGBDRN COc1ccc(-c2n[nH]cc2CN2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000179590506 1429457212 /nfs/dbraw/zinc/45/72/12/1429457212.db2.gz MPTZDKYVFNOUJQ-UHFFFAOYSA-N 0 0 393.447 3.316 20 5 GGBDRN Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)CCC2 ZINC000179595304 1429460833 /nfs/dbraw/zinc/46/08/33/1429460833.db2.gz KEAPDSYNXPBAKC-INIZCTEOSA-N 0 0 388.445 3.114 20 5 GGBDRN COc1cc(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c2ccccc2n1 ZINC000179598334 1429463951 /nfs/dbraw/zinc/46/39/51/1429463951.db2.gz HAFBJUJGFQAGOF-UHFFFAOYSA-N 0 0 393.446 3.229 20 5 GGBDRN O=C(C[C@@H](O)c1ccc(Cl)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000179604665 1429467323 /nfs/dbraw/zinc/46/73/23/1429467323.db2.gz UEAMVSIYUVVPEU-GOSISDBHSA-N 0 0 389.839 3.021 20 5 GGBDRN Cc1nnc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1C1CC1 ZINC000179608302 1429468682 /nfs/dbraw/zinc/46/86/82/1429468682.db2.gz BLZOORQKXCRDJF-UHFFFAOYSA-N 0 0 385.405 3.310 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000179609938 1429469587 /nfs/dbraw/zinc/46/95/87/1429469587.db2.gz KDPLRYYKOICLGY-UHFFFAOYSA-N 0 0 397.434 3.137 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000179618909 1429473632 /nfs/dbraw/zinc/47/36/32/1429473632.db2.gz JYFZVHBUQUKDSJ-UHFFFAOYSA-N 0 0 397.434 3.137 20 5 GGBDRN CCCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCS(=O)(=O)C1 ZINC000179641151 1429485634 /nfs/dbraw/zinc/48/56/34/1429485634.db2.gz BWRDMURFQVGGIC-AWEZNQCLSA-N 0 0 378.450 3.254 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC(=O)N(c2ccccc2)C1 ZINC000179647717 1429488499 /nfs/dbraw/zinc/48/84/99/1429488499.db2.gz IEGQUPZLERLZLC-ZDUSSCGKSA-N 0 0 385.445 3.242 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCCc2cc(F)c(F)cc21 ZINC000179654582 1429492405 /nfs/dbraw/zinc/49/24/05/1429492405.db2.gz OMZZDSIBBTYDPX-UHFFFAOYSA-N 0 0 382.388 3.198 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1ccc(OCC2CC2)cc1 ZINC000179663020 1429496335 /nfs/dbraw/zinc/49/63/35/1429496335.db2.gz YERBLIAEYCEFCM-UHFFFAOYSA-N 0 0 376.434 3.368 20 5 GGBDRN C[C@@H]1c2ccccc2CCN1C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179705874 1429515217 /nfs/dbraw/zinc/51/52/17/1429515217.db2.gz DSPMWXCNMPYHNT-OAHLLOKOSA-N 0 0 381.432 3.191 20 5 GGBDRN CCc1nn(C)c(OC)c1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000179707334 1429515838 /nfs/dbraw/zinc/51/58/38/1429515838.db2.gz AHLZHWKYAJBBKY-UHFFFAOYSA-N 0 0 389.456 3.020 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cccc(C(=O)NCc3ccccc3)c2)c1[N+](=O)[O-] ZINC000179707974 1429516214 /nfs/dbraw/zinc/51/62/14/1429516214.db2.gz CDBKSZSENTUDLV-UHFFFAOYSA-N 0 0 393.403 3.063 20 5 GGBDRN COCc1nnc(-c2cccc(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000179714308 1429518439 /nfs/dbraw/zinc/51/84/39/1429518439.db2.gz IIAFPJPDHDDYQL-UHFFFAOYSA-N 0 0 396.403 3.456 20 5 GGBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)C1CCC(C)(C)CC1 ZINC000179721913 1429521698 /nfs/dbraw/zinc/52/16/98/1429521698.db2.gz DRDVBZZIWHPLOG-UHFFFAOYSA-N 0 0 375.469 3.472 20 5 GGBDRN O=C(c1cc2c(cc1F)NC(=O)CC2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152300363 1422066791 /nfs/dbraw/zinc/06/67/91/1422066791.db2.gz ZZVHVOHSELQHTP-UHFFFAOYSA-N 0 0 383.379 3.423 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N(CCO)Cc1cccnc1 ZINC000152306196 1422067801 /nfs/dbraw/zinc/06/78/01/1422067801.db2.gz RZPHZIYJTQWBKG-UHFFFAOYSA-N 0 0 393.399 3.417 20 5 GGBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCCC2(C1)OCCO2 ZINC000152306839 1422068491 /nfs/dbraw/zinc/06/84/91/1422068491.db2.gz BZBSALORRFSBJW-UHFFFAOYSA-N 0 0 383.404 3.318 20 5 GGBDRN O=C([C@H]1CC(=O)N(c2ccccc2F)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152313184 1422070015 /nfs/dbraw/zinc/07/00/15/1422070015.db2.gz QJCWUEKQZKUGCP-HNNXBMFYSA-N 0 0 397.406 3.278 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO ZINC000152324293 1422072852 /nfs/dbraw/zinc/07/28/52/1422072852.db2.gz DSKQFGIONLEECS-SFHVURJKSA-N 0 0 385.464 3.193 20 5 GGBDRN O=C(c1cnn(-c2ccc(F)cc2)n1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152333106 1422074966 /nfs/dbraw/zinc/07/49/66/1422074966.db2.gz UAMWZVAAMZZLBC-UHFFFAOYSA-N 0 0 381.367 3.119 20 5 GGBDRN Cn1ccnc1C[C@@H]1CCCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000152332942 1422075080 /nfs/dbraw/zinc/07/50/80/1422075080.db2.gz BSZWBMRAQSFJKO-LBPRGKRZSA-N 0 0 377.832 3.468 20 5 GGBDRN O=C(Oc1ccccc1)N1CCCN(Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000152339473 1422077522 /nfs/dbraw/zinc/07/75/22/1422077522.db2.gz LTCMVSHQLNXDJY-UHFFFAOYSA-N 0 0 395.419 3.109 20 5 GGBDRN CC[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C ZINC000179729422 1429526371 /nfs/dbraw/zinc/52/63/71/1429526371.db2.gz JLYDPUDJSBEKPR-KRWDZBQOSA-N 0 0 389.427 3.442 20 5 GGBDRN CN(C)c1cccc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000152352216 1422081276 /nfs/dbraw/zinc/08/12/76/1422081276.db2.gz OPDCYKTYFYBYQN-UHFFFAOYSA-N 0 0 383.433 3.109 20 5 GGBDRN O=C(COc1ccc2ccc(=O)oc2c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152368121 1422085437 /nfs/dbraw/zinc/08/54/37/1422085437.db2.gz HYQHMNJGMRQLDQ-UHFFFAOYSA-N 0 0 394.383 3.271 20 5 GGBDRN O=C(c1cn(Cc2cccs2)nn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152373446 1422086023 /nfs/dbraw/zinc/08/60/23/1422086023.db2.gz QRPIFQDLNAWAQK-UHFFFAOYSA-N 0 0 383.433 3.101 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000152374679 1422086606 /nfs/dbraw/zinc/08/66/06/1422086606.db2.gz CYUWBSYWNHDKEP-INIZCTEOSA-N 0 0 387.480 3.371 20 5 GGBDRN C[C@@H](CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)NC(=O)c1ccccc1 ZINC000152395097 1422091862 /nfs/dbraw/zinc/09/18/62/1422091862.db2.gz GSKUJKMJSOFITG-HNNXBMFYSA-N 0 0 381.432 3.294 20 5 GGBDRN C[C@H](CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)NC(=O)c1ccccc1 ZINC000152395193 1422091924 /nfs/dbraw/zinc/09/19/24/1422091924.db2.gz GSKUJKMJSOFITG-OAHLLOKOSA-N 0 0 381.432 3.294 20 5 GGBDRN CC(C)(CO)[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 ZINC000152400748 1422092931 /nfs/dbraw/zinc/09/29/31/1422092931.db2.gz KTVUZQJIMPXNEJ-KRWDZBQOSA-N 0 0 387.392 3.035 20 5 GGBDRN COc1cccc(C(C)(C)CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000152416097 1422097375 /nfs/dbraw/zinc/09/73/75/1422097375.db2.gz PQVRUNQNOFRKQR-UHFFFAOYSA-N 0 0 378.450 3.001 20 5 GGBDRN CCN(CC)C(=O)CCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000152420687 1422098924 /nfs/dbraw/zinc/09/89/24/1422098924.db2.gz DLWPFJLOCCJABV-UHFFFAOYSA-N 0 0 376.438 3.305 20 5 GGBDRN CC(C)(C)CC(C)(C)c1ccc(OC[C@H](O)Cn2cnc([N+](=O)[O-])n2)cc1 ZINC000152445496 1422105871 /nfs/dbraw/zinc/10/58/71/1422105871.db2.gz IXLQXDQFYRFZHI-OAHLLOKOSA-N 0 0 376.457 3.340 20 5 GGBDRN CC(C)(CO)[C@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000152496925 1422121496 /nfs/dbraw/zinc/12/14/96/1422121496.db2.gz RDOGSZOZXXEZQK-QGZVFWFLSA-N 0 0 386.448 3.282 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)nc2ccccc21 ZINC000152499945 1422122151 /nfs/dbraw/zinc/12/21/51/1422122151.db2.gz GIWOFCCAMJKUKG-UHFFFAOYSA-N 0 0 378.388 3.453 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)Cc1c(C)nn(CC(F)(F)F)c1C ZINC000152530608 1422133245 /nfs/dbraw/zinc/13/32/45/1422133245.db2.gz WJPLALMVPLNXFL-UHFFFAOYSA-N 0 0 387.314 3.127 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCC(=O)NCC1(c2ccccc2)CCOCC1 ZINC000152543923 1422137393 /nfs/dbraw/zinc/13/73/93/1422137393.db2.gz IKSCMFPMVPQIFZ-UHFFFAOYSA-N 0 0 397.475 3.488 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)nc2ccccc21 ZINC000152572680 1422148585 /nfs/dbraw/zinc/14/85/85/1422148585.db2.gz BUMRZLRHYAVBQD-UHFFFAOYSA-N 0 0 378.388 3.453 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1cccn(Cc2ccccc2)c1=O ZINC000152578380 1422151023 /nfs/dbraw/zinc/15/10/23/1422151023.db2.gz SAHKVXPFLUGLOP-UHFFFAOYSA-N 0 0 392.415 3.169 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000152588131 1422153932 /nfs/dbraw/zinc/15/39/32/1422153932.db2.gz XQJXVAKXKUSCQP-IBGZPJMESA-N 0 0 393.415 3.207 20 5 GGBDRN COc1cccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])c(Cl)c3)CC2)c1 ZINC000152590703 1422154278 /nfs/dbraw/zinc/15/42/78/1422154278.db2.gz FSSHPLZVJNKLHK-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN CS[C@@H](CO)[C@@H](C)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000152591098 1422154416 /nfs/dbraw/zinc/15/44/16/1422154416.db2.gz LYKFGWQLYACWCO-PXAZEXFGSA-N 0 0 375.450 3.181 20 5 GGBDRN CC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000152606007 1422161145 /nfs/dbraw/zinc/16/11/45/1422161145.db2.gz SZSHSEUPDBNFFS-UHFFFAOYSA-N 0 0 397.840 3.187 20 5 GGBDRN NC(=O)c1ccc(NCc2nccn2CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC000152607571 1422161758 /nfs/dbraw/zinc/16/17/58/1422161758.db2.gz BVMXSEPADPLTGI-UHFFFAOYSA-N 0 0 379.420 3.135 20 5 GGBDRN CCOC(=O)N1CCCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000179745970 1429534722 /nfs/dbraw/zinc/53/47/22/1429534722.db2.gz OGBRETQHFSXDQB-UHFFFAOYSA-N 0 0 390.465 3.383 20 5 GGBDRN Cc1c(C(=O)OCc2ccc(Cl)nc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000152617672 1422169001 /nfs/dbraw/zinc/16/90/01/1422169001.db2.gz VFBLXEFEEBNBKC-UHFFFAOYSA-N 0 0 387.783 3.198 20 5 GGBDRN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000152639344 1422183362 /nfs/dbraw/zinc/18/33/62/1422183362.db2.gz FCZJNWDYKULFOA-QMMMGPOBSA-N 0 0 375.385 3.380 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000152640835 1422184798 /nfs/dbraw/zinc/18/47/98/1422184798.db2.gz REQHAFKYWHSEDG-IBGZPJMESA-N 0 0 382.395 3.306 20 5 GGBDRN COc1cccc(OCCN2CCN(c3ccc(C(C)=O)cc3[N+](=O)[O-])CC2)c1 ZINC000152653786 1422190227 /nfs/dbraw/zinc/19/02/27/1422190227.db2.gz UKKHHEMRIOOOCE-UHFFFAOYSA-N 0 0 399.447 3.007 20 5 GGBDRN O=C(Nc1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179749606 1429536871 /nfs/dbraw/zinc/53/68/71/1429536871.db2.gz ONONRCYJOZCAEZ-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000152656925 1422193417 /nfs/dbraw/zinc/19/34/17/1422193417.db2.gz IPUBAVJWTSZCCH-CQSZACIVSA-N 0 0 394.431 3.452 20 5 GGBDRN CC(C)n1cnnc1CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000152693684 1422212931 /nfs/dbraw/zinc/21/29/31/1422212931.db2.gz XVQRJPPCEPPTGS-UHFFFAOYSA-N 0 0 394.435 3.309 20 5 GGBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000152717900 1422223110 /nfs/dbraw/zinc/22/31/10/1422223110.db2.gz VFLNAUVWXXVLKA-CQSZACIVSA-N 0 0 380.404 3.237 20 5 GGBDRN Cn1cnc(-c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)cc2)n1 ZINC000152725101 1422225361 /nfs/dbraw/zinc/22/53/61/1422225361.db2.gz JQKPZJBABTXCGH-UHFFFAOYSA-N 0 0 389.318 3.244 20 5 GGBDRN COc1ccccc1[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000152735419 1422229745 /nfs/dbraw/zinc/22/97/45/1422229745.db2.gz DDGAGQZBSMOCTO-GOSISDBHSA-N 0 0 388.401 3.264 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(C2CC2)S(=O)(=O)c2cccc3cnccc32)c1 ZINC000152739969 1422232010 /nfs/dbraw/zinc/23/20/10/1422232010.db2.gz NGIVITFBEXVENA-UHFFFAOYSA-N 0 0 383.429 3.496 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000152741199 1422232803 /nfs/dbraw/zinc/23/28/03/1422232803.db2.gz RNLUDSOFQFFJGP-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000152743718 1422233321 /nfs/dbraw/zinc/23/33/21/1422233321.db2.gz DOTREEFDAYGJLV-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N[C@H]2CCc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000152752307 1422236680 /nfs/dbraw/zinc/23/66/80/1422236680.db2.gz SXRGVODKZJJBDY-HNNXBMFYSA-N 0 0 379.413 3.084 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(C2CC2)S(=O)(=O)c2cc(F)c(F)cc2F)c1 ZINC000152753021 1422236944 /nfs/dbraw/zinc/23/69/44/1422236944.db2.gz BGWKOYMNRRFVFP-UHFFFAOYSA-N 0 0 386.351 3.365 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1[N+](=O)[O-] ZINC000152754471 1422237333 /nfs/dbraw/zinc/23/73/33/1422237333.db2.gz IZHPNLPQGYFJOB-UHFFFAOYSA-N 0 0 391.405 3.165 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1C[C@H]1C1CCCCC1 ZINC000152760810 1422239774 /nfs/dbraw/zinc/23/97/74/1422239774.db2.gz YJXFAFNPTBVJIW-GXTWGEPZSA-N 0 0 379.844 3.063 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N[C@H]1C[C@H]1C1CCCCC1 ZINC000152760914 1422239883 /nfs/dbraw/zinc/23/98/83/1422239883.db2.gz YJXFAFNPTBVJIW-JSGCOSHPSA-N 0 0 379.844 3.063 20 5 GGBDRN O=C(Oc1ccc(N2CCCC2=O)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000152773269 1422243692 /nfs/dbraw/zinc/24/36/92/1422243692.db2.gz PWKPZMKLGLRUAU-UHFFFAOYSA-N 0 0 392.371 3.127 20 5 GGBDRN CCNC(=O)c1cccc(OC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000152801533 1422253806 /nfs/dbraw/zinc/25/38/06/1422253806.db2.gz BLLSLZIFWJHENZ-UHFFFAOYSA-N 0 0 393.193 3.326 20 5 GGBDRN CCCC(=O)N1CCC[C@H]1C(=O)OCc1ccc([N+](=O)[O-])cc1Br ZINC000152803671 1422254810 /nfs/dbraw/zinc/25/48/10/1422254810.db2.gz WLPIQUPFJKBPNR-AWEZNQCLSA-N 0 0 399.241 3.192 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000152805079 1422255605 /nfs/dbraw/zinc/25/56/05/1422255605.db2.gz KRGCPFFQCDUOSI-CYBMUJFWSA-N 0 0 385.449 3.443 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000179757655 1429543521 /nfs/dbraw/zinc/54/35/21/1429543521.db2.gz BTZFWOAZKVOIPB-AUUYWEPGSA-N 0 0 381.432 3.215 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000152869373 1422277095 /nfs/dbraw/zinc/27/70/95/1422277095.db2.gz CPZKLTJBGGXGQT-UHFFFAOYSA-N 0 0 394.859 3.192 20 5 GGBDRN O=C(c1ccccc1)N1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000152867240 1422277142 /nfs/dbraw/zinc/27/71/42/1422277142.db2.gz IBLQDTUGFDJUFU-UHFFFAOYSA-N 0 0 392.415 3.208 20 5 GGBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000152873153 1422279212 /nfs/dbraw/zinc/27/92/12/1422279212.db2.gz NUNFIMAVQOLEHE-CQSZACIVSA-N 0 0 380.404 3.237 20 5 GGBDRN O=C(CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1)Nc1ccccc1F ZINC000152878097 1422280508 /nfs/dbraw/zinc/28/05/08/1422280508.db2.gz UFQWWNDFJQWTQH-UHFFFAOYSA-N 0 0 392.818 3.148 20 5 GGBDRN CC(C)(C)Oc1cc(NCCNS(=O)(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000152892524 1422285454 /nfs/dbraw/zinc/28/54/54/1422285454.db2.gz TWNNSQAQUFOTNG-UHFFFAOYSA-N 0 0 399.494 3.224 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCN(c4cccc(O)c4)CC3)co2)cc1 ZINC000152945297 1422304431 /nfs/dbraw/zinc/30/44/31/1422304431.db2.gz OSBPKZHNNNKNPB-UHFFFAOYSA-N 0 0 380.404 3.278 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1 ZINC000152947609 1422305069 /nfs/dbraw/zinc/30/50/69/1422305069.db2.gz XLKRORIPPDNQRN-MOPGFXCFSA-N 0 0 390.461 3.152 20 5 GGBDRN COC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)c2ccccc21 ZINC000179762493 1429546580 /nfs/dbraw/zinc/54/65/80/1429546580.db2.gz YPMJCJJFCGAWKK-OAHLLOKOSA-N 0 0 377.356 3.060 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2csc([C@@H]3CCCO3)n2)c([N+](=O)[O-])c1 ZINC000152960983 1422309058 /nfs/dbraw/zinc/30/90/58/1422309058.db2.gz RHOHKIKNIUJIMO-INIZCTEOSA-N 0 0 390.465 3.443 20 5 GGBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000152973603 1422312852 /nfs/dbraw/zinc/31/28/52/1422312852.db2.gz GVUBBDNVYSAVFI-CYBMUJFWSA-N 0 0 380.470 3.203 20 5 GGBDRN 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1422325990 /nfs/dbraw/zinc/32/59/90/1422325990.db2.gz QWHFJBWVRKESTM-UHFFFAOYSA-N 0 0 384.358 3.320 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@H]2c2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000153019741 1422328535 /nfs/dbraw/zinc/32/85/35/1422328535.db2.gz NZGYJHGSIWMHDZ-IAQYHMDHSA-N 0 0 397.403 3.091 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@@H]2c2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000153019639 1422329118 /nfs/dbraw/zinc/32/91/18/1422329118.db2.gz NZGYJHGSIWMHDZ-NHYWBVRUSA-N 0 0 397.403 3.091 20 5 GGBDRN CN(C)c1cccc(NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000153022647 1422330011 /nfs/dbraw/zinc/33/00/11/1422330011.db2.gz CTGNXSMPTJGGAR-UHFFFAOYSA-N 0 0 385.424 3.131 20 5 GGBDRN Cc1cccc(NC2CCN(CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000153045038 1422337156 /nfs/dbraw/zinc/33/71/56/1422337156.db2.gz UOLWSMNUSOSYIQ-UHFFFAOYSA-N 0 0 382.464 3.443 20 5 GGBDRN CC(C)N(C)C(=O)C1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000153043367 1422337304 /nfs/dbraw/zinc/33/73/04/1422337304.db2.gz 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CCc1ccc([C@@H]2COCCN2C(=O)Nc2cc([N+](=O)[O-])ccc2OC)o1 ZINC000153100402 1422357317 /nfs/dbraw/zinc/35/73/17/1422357317.db2.gz CTBWSOHBCCOFIJ-HNNXBMFYSA-N 0 0 375.381 3.364 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)Cc2cc(C)nn2-c2ccccc2)c1 ZINC000153119106 1422363049 /nfs/dbraw/zinc/36/30/49/1422363049.db2.gz CYWJQXRADOZSKL-CQSZACIVSA-N 0 0 394.431 3.459 20 5 GGBDRN O=C(c1cc(F)cc2cccnc21)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000153119805 1422363084 /nfs/dbraw/zinc/36/30/84/1422363084.db2.gz RZAMGMTVCXBXCF-CQSZACIVSA-N 0 0 381.367 3.004 20 5 GGBDRN O=C(c1cc(F)cc2cccnc21)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000153119727 1422363339 /nfs/dbraw/zinc/36/33/39/1422363339.db2.gz RZAMGMTVCXBXCF-AWEZNQCLSA-N 0 0 381.367 3.004 20 5 GGBDRN COc1ccc(OC[C@@H](O)COc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000153153881 1422373484 /nfs/dbraw/zinc/37/34/84/1422373484.db2.gz GFSBMSAVKHVPCN-LBPRGKRZSA-N 0 0 387.310 3.441 20 5 GGBDRN COc1ccc(OC[C@H](O)COc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000153153798 1422374015 /nfs/dbraw/zinc/37/40/15/1422374015.db2.gz GFSBMSAVKHVPCN-GFCCVEGCSA-N 0 0 387.310 3.441 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000153192155 1422387336 /nfs/dbraw/zinc/38/73/36/1422387336.db2.gz PKEGAMRRRYBGQU-UHFFFAOYSA-N 0 0 392.284 3.430 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000153199341 1422390605 /nfs/dbraw/zinc/39/06/05/1422390605.db2.gz BHHCVSQLRCZEMI-UHFFFAOYSA-N 0 0 395.419 3.137 20 5 GGBDRN O=C(NCc1ccnc(N2CCCCC2)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153215276 1422396105 /nfs/dbraw/zinc/39/61/05/1422396105.db2.gz MAGCMQVDEURSFU-UHFFFAOYSA-N 0 0 395.463 3.248 20 5 GGBDRN C[C@@H](CCNc1c(Br)cncc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000179771016 1429551775 /nfs/dbraw/zinc/55/17/75/1429551775.db2.gz WFVXAXWRMXCPGB-VIFPVBQESA-N 0 0 389.250 3.468 20 5 GGBDRN O=C(Cc1csc(-c2cnccn2)n1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153224186 1422399643 /nfs/dbraw/zinc/39/96/43/1422399643.db2.gz 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ZINC000153435321 1422534582 /nfs/dbraw/zinc/53/45/82/1422534582.db2.gz VIFDUPJKPPAJCV-UHFFFAOYSA-N 0 0 384.360 3.009 20 5 GGBDRN CCS[C@@H](C)c1noc(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)n1 ZINC000153448496 1422542783 /nfs/dbraw/zinc/54/27/83/1422542783.db2.gz SHUPZWKHHPYEOZ-NSHDSACASA-N 0 0 387.421 3.064 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1c1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] ZINC000153465821 1422552446 /nfs/dbraw/zinc/55/24/46/1422552446.db2.gz WFBYSLQHIVBYJL-YOEHRIQHSA-N 0 0 389.477 3.228 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(CCO)CCc1ccccc1 ZINC000153468171 1422552742 /nfs/dbraw/zinc/55/27/42/1422552742.db2.gz AIBDIHHCRVURAN-UHFFFAOYSA-N 0 0 382.338 3.291 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CN2CCN(c3ccc(F)cc3Cl)CC2)c1 ZINC000153469095 1422554256 /nfs/dbraw/zinc/55/42/56/1422554256.db2.gz LILWZEYXDUPNNB-GOSISDBHSA-N 0 0 379.819 3.243 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-n2cnnn2)c(C)c1 ZINC000153468885 1422554451 /nfs/dbraw/zinc/55/44/51/1422554451.db2.gz RXWASVBPCQASQR-UHFFFAOYSA-N 0 0 384.421 3.243 20 5 GGBDRN O=C(Oc1ccc(NC(=O)C2CC2)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000153470231 1422555247 /nfs/dbraw/zinc/55/52/47/1422555247.db2.gz FUVPQBDLVJTIHQ-UHFFFAOYSA-N 0 0 392.371 3.348 20 5 GGBDRN O=C(Nc1cccc(-c2ncco2)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179790983 1429566858 /nfs/dbraw/zinc/56/68/58/1429566858.db2.gz TZKSRALUGGAFEW-UHFFFAOYSA-N 0 0 394.387 3.339 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1C)c1ccc(Cl)c(F)c1 ZINC000153472357 1422556146 /nfs/dbraw/zinc/55/61/46/1422556146.db2.gz CJEFQSIDRCISRJ-HNNXBMFYSA-N 0 0 380.759 3.340 20 5 GGBDRN O=C(c1ccc(F)cc1)[C@@H]1CCCN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000153479091 1422560001 /nfs/dbraw/zinc/56/00/01/1422560001.db2.gz UHNLJOXWAVPBCY-CQSZACIVSA-N 0 0 399.378 3.194 20 5 GGBDRN COc1ccccc1CN(CCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153481756 1422561722 /nfs/dbraw/zinc/56/17/22/1422561722.db2.gz KZOBKCNSMFUCAD-UHFFFAOYSA-N 0 0 383.404 3.253 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)c3ccc(C)cc3[N+](=O)[O-])CC2)c1 ZINC000153490930 1422566602 /nfs/dbraw/zinc/56/66/02/1422566602.db2.gz LTZKSLQYZRTRBG-UHFFFAOYSA-N 0 0 389.477 3.477 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)c3c(C)cccc3[N+](=O)[O-])CC2)c1 ZINC000153490155 1422567466 /nfs/dbraw/zinc/56/74/66/1422567466.db2.gz VENRPUBJEBWKIV-UHFFFAOYSA-N 0 0 389.477 3.477 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)c3c(F)cccc3[N+](=O)[O-])CC2)c1 ZINC000153492658 1422568290 /nfs/dbraw/zinc/56/82/90/1422568290.db2.gz SNZJHOQNJUGIKT-UHFFFAOYSA-N 0 0 393.440 3.308 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000153494077 1422569168 /nfs/dbraw/zinc/56/91/68/1422569168.db2.gz CJLFKBRKGKLBDK-UHFFFAOYSA-N 0 0 389.477 3.310 20 5 GGBDRN COc1ccccc1N1CC[C@H](NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C1=O ZINC000179792563 1429568433 /nfs/dbraw/zinc/56/84/33/1429568433.db2.gz VTQCLWWMJQZMEP-HNNXBMFYSA-N 0 0 397.431 3.064 20 5 GGBDRN Cc1nc(CN2CCN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)oc1C ZINC000153507182 1422575579 /nfs/dbraw/zinc/57/55/79/1422575579.db2.gz YLYCNKJRYRTINR-UHFFFAOYSA-N 0 0 397.435 3.172 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC000153515715 1422580216 /nfs/dbraw/zinc/58/02/16/1422580216.db2.gz CDYDWRKUWYTRTK-HUUCEWRRSA-N 0 0 383.832 3.032 20 5 GGBDRN C[C@]1(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCCO1 ZINC000153533873 1422591008 /nfs/dbraw/zinc/59/10/08/1422591008.db2.gz MMNMPGCXAYXSQW-CYBMUJFWSA-N 0 0 377.622 3.310 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCOc2ccc(C(F)(F)F)cc21 ZINC000153538279 1422594046 /nfs/dbraw/zinc/59/40/46/1422594046.db2.gz ORXXRZZIKNKEIJ-UHFFFAOYSA-N 0 0 382.294 3.418 20 5 GGBDRN CN(CC(=O)Oc1ccc(NC(=O)c2ccco2)cc1)c1ccccc1[N+](=O)[O-] ZINC000179796519 1429570541 /nfs/dbraw/zinc/57/05/41/1429570541.db2.gz GDGNKVNGQVNXKV-UHFFFAOYSA-N 0 0 395.371 3.482 20 5 GGBDRN Cc1c(C)n(C[C@H]2CCCO2)c2ncnc(NC(=O)c3ccccc3[N+](=O)[O-])c12 ZINC000153542743 1422598673 /nfs/dbraw/zinc/59/86/73/1422598673.db2.gz YOWMDLXSJIKARP-CQSZACIVSA-N 0 0 395.419 3.388 20 5 GGBDRN Cc1cccc([C@@H](O)CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000153552017 1422607539 /nfs/dbraw/zinc/60/75/39/1422607539.db2.gz ISGZTBJTPCBUHC-KRWDZBQOSA-N 0 0 383.429 3.490 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCc1ccn(-c2ccc(F)cc2)n1 ZINC000153554926 1422610874 /nfs/dbraw/zinc/61/08/74/1422610874.db2.gz IJVDMHRIVCIRFT-UHFFFAOYSA-N 0 0 382.395 3.211 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000153561591 1422616739 /nfs/dbraw/zinc/61/67/39/1422616739.db2.gz ZDOQYTHQTWKMPV-INIZCTEOSA-N 0 0 397.353 3.143 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000153580260 1422631538 /nfs/dbraw/zinc/63/15/38/1422631538.db2.gz NNXVJWXZJPFIPR-UHFFFAOYSA-N 0 0 386.433 3.114 20 5 GGBDRN CN(Cc1nccn1Cc1ccccc1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000153592578 1422637302 /nfs/dbraw/zinc/63/73/02/1422637302.db2.gz ITGJBTRVMXWBGM-UHFFFAOYSA-N 0 0 378.432 3.431 20 5 GGBDRN C[C@@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1cccc2ccccc21 ZINC000153601837 1422641720 /nfs/dbraw/zinc/64/17/20/1422641720.db2.gz OQDPIBIPMRDKSG-GFCCVEGCSA-N 0 0 385.807 3.441 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000153610722 1422646351 /nfs/dbraw/zinc/64/63/51/1422646351.db2.gz VRIPFUVUJZHHOT-UHFFFAOYSA-N 0 0 376.457 3.406 20 5 GGBDRN CC(C)(C)C(=O)Nc1ccc(C(=O)Cn2cc(Cl)cc([N+](=O)[O-])c2=O)cc1 ZINC000153612756 1422647479 /nfs/dbraw/zinc/64/74/79/1422647479.db2.gz LSUCHUAZRXBPKL-UHFFFAOYSA-N 0 0 391.811 3.277 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000153614421 1422648654 /nfs/dbraw/zinc/64/86/54/1422648654.db2.gz BJUJBOTVMBHXTL-GJZGRUSLSA-N 0 0 376.457 3.452 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)Cc2nn(-c3ccccc3)c3c2CCC3)c1 ZINC000179801701 1429575195 /nfs/dbraw/zinc/57/51/95/1429575195.db2.gz LPNRQKFVXALUKG-UHFFFAOYSA-N 0 0 397.456 3.384 20 5 GGBDRN Cc1c(C)n(C[C@H]2CCCO2)c2ncnc(NC(=O)c3cccc([N+](=O)[O-])c3)c12 ZINC000153626490 1422656821 /nfs/dbraw/zinc/65/68/21/1422656821.db2.gz BUXLXCKWHVUGIU-MRXNPFEDSA-N 0 0 395.419 3.388 20 5 GGBDRN Cc1cccn2cc(CCNC(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)nc12 ZINC000153631106 1422660516 /nfs/dbraw/zinc/66/05/16/1422660516.db2.gz AFBNPHBPSCEORL-UHFFFAOYSA-N 0 0 393.447 3.468 20 5 GGBDRN O=C(c1ccc(F)cc1Cl)N1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153652964 1422679625 /nfs/dbraw/zinc/67/96/25/1422679625.db2.gz BDALADWISKUXQM-UHFFFAOYSA-N 0 0 399.209 3.398 20 5 GGBDRN Cc1cc(Cl)cc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1O ZINC000179804263 1429577458 /nfs/dbraw/zinc/57/74/58/1429577458.db2.gz RNHHBAUFZUPBRA-SNVBAGLBSA-N 0 0 377.784 3.019 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)CC3(O)CCCC3)cc2[N+](=O)[O-])C1 ZINC000153658147 1422684264 /nfs/dbraw/zinc/68/42/64/1422684264.db2.gz FHTSDIGCTXRDEH-HZPDHXFCSA-N 0 0 389.496 3.454 20 5 GGBDRN Cc1cc(NC(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000153662639 1422686981 /nfs/dbraw/zinc/68/69/81/1422686981.db2.gz RZNCEXJUPLOYPS-GOSISDBHSA-N 0 0 396.447 3.258 20 5 GGBDRN Cc1cccc([C@@H](O)CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000153671661 1422695981 /nfs/dbraw/zinc/69/59/81/1422695981.db2.gz XATOQVVVCLKHQG-HNNXBMFYSA-N 0 0 379.210 3.129 20 5 GGBDRN CCc1nn(C)c(Cl)c1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000153684405 1422701766 /nfs/dbraw/zinc/70/17/66/1422701766.db2.gz CGZMDTHNZTXLIE-UHFFFAOYSA-N 0 0 379.848 3.085 20 5 GGBDRN Cn1c(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)nc2ccc(F)cc21 ZINC000153691134 1422705342 /nfs/dbraw/zinc/70/53/42/1422705342.db2.gz POHJUAGHWFFQEI-UHFFFAOYSA-N 0 0 393.378 3.141 20 5 GGBDRN Cc1ccc(CC(=O)N2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 ZINC000153714893 1422717140 /nfs/dbraw/zinc/71/71/40/1422717140.db2.gz VMIKBSBUWHINGI-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN COc1cccc2c1CC[C@@H]2NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153719191 1422719540 /nfs/dbraw/zinc/71/95/40/1422719540.db2.gz KLZNSYXNISNMLX-KRWDZBQOSA-N 0 0 378.388 3.206 20 5 GGBDRN CCc1cc(N2CCC(NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)ncn1 ZINC000153729006 1422726159 /nfs/dbraw/zinc/72/61/59/1422726159.db2.gz VVXKTZQINNSODF-UHFFFAOYSA-N 0 0 384.440 3.046 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C12CCC2 ZINC000153736877 1422730605 /nfs/dbraw/zinc/73/06/05/1422730605.db2.gz MWOCBYPMLOPGMO-CABCVRRESA-N 0 0 388.873 3.216 20 5 GGBDRN O=C(c1c(F)cccc1F)N1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153738523 1422731542 /nfs/dbraw/zinc/73/15/42/1422731542.db2.gz JJONDCPPQILOMB-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN O=C(Cc1cccc(F)c1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000153738509 1422731800 /nfs/dbraw/zinc/73/18/00/1422731800.db2.gz NKEQNKWSJNGKMX-UHFFFAOYSA-N 0 0 376.359 3.486 20 5 GGBDRN Cc1ccc(-n2c(SCCn3cc([N+](=O)[O-])cn3)nnc2N2CCCC2)cc1 ZINC000153748005 1422736312 /nfs/dbraw/zinc/73/63/12/1422736312.db2.gz CWILTZMNYWOWCN-UHFFFAOYSA-N 0 0 399.480 3.073 20 5 GGBDRN CNC(=O)C(C)(C)CNC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000153754988 1422738844 /nfs/dbraw/zinc/73/88/44/1422738844.db2.gz RHYCXYBMFATHIE-UHFFFAOYSA-N 0 0 381.498 3.235 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000153766212 1422744320 /nfs/dbraw/zinc/74/43/20/1422744320.db2.gz DOWPETJMBSFLMP-AWEZNQCLSA-N 0 0 399.321 3.383 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000153766114 1422744494 /nfs/dbraw/zinc/74/44/94/1422744494.db2.gz DOWPETJMBSFLMP-CQSZACIVSA-N 0 0 399.321 3.383 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)Cn1ccnc1 ZINC000153766110 1422744606 /nfs/dbraw/zinc/74/46/06/1422744606.db2.gz YZYWCWJQTJDRCI-INIZCTEOSA-N 0 0 393.447 3.470 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OC[C@@H](O)c2ccccc2Br)c1 ZINC000153769336 1422747272 /nfs/dbraw/zinc/74/72/72/1422747272.db2.gz PGRKRZOUMSXBTK-CQSZACIVSA-N 0 0 396.193 3.256 20 5 GGBDRN COc1ccccc1CN1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000153785518 1422757086 /nfs/dbraw/zinc/75/70/86/1422757086.db2.gz AOGKWWSQBZWCCH-UHFFFAOYSA-N 0 0 384.436 3.262 20 5 GGBDRN C[C@@H]1CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C[C@@H]1n1ccnc1 ZINC000153822167 1422779860 /nfs/dbraw/zinc/77/98/60/1422779860.db2.gz YAVSASCHQASRTO-APWZRJJASA-N 0 0 385.468 3.407 20 5 GGBDRN C[C@H](C[C@H](O)c1ccco1)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153821743 1422780093 /nfs/dbraw/zinc/78/00/93/1422780093.db2.gz CCHBMEGAOAIJBP-PBHICJAKSA-N 0 0 375.425 3.322 20 5 GGBDRN CC[C@H](NC(=O)N[C@@H]1CCO[C@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000153833407 1422787805 /nfs/dbraw/zinc/78/78/05/1422787805.db2.gz NKEKDVQQDZTDDW-UWWQBHOKSA-N 0 0 379.482 3.400 20 5 GGBDRN O=C(Nc1ccc(N2CCC(O)CC2)cc1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000153832671 1422788073 /nfs/dbraw/zinc/78/80/73/1422788073.db2.gz QBCNOIYKNGZBBI-UHFFFAOYSA-N 0 0 392.415 3.356 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1ccc(Cl)cc1Cl ZINC000153850481 1422797849 /nfs/dbraw/zinc/79/78/49/1422797849.db2.gz YCBCJGSOPCTCJJ-OAHLLOKOSA-N 0 0 384.219 3.163 20 5 GGBDRN O=C(NCc1ccco1)[C@H]1CCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153858255 1422800344 /nfs/dbraw/zinc/80/03/44/1422800344.db2.gz TXLZUYDISRPVNU-GOSISDBHSA-N 0 0 396.403 3.124 20 5 GGBDRN O=C(NC[C@@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1ccccc1[N+](=O)[O-] ZINC000153867417 1422802019 /nfs/dbraw/zinc/80/20/19/1422802019.db2.gz KLCSLEDWSPGBAL-ZDUSSCGKSA-N 0 0 398.337 3.074 20 5 GGBDRN C[C@H]1OCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)[C@@H]1C ZINC000153893743 1422806661 /nfs/dbraw/zinc/80/66/61/1422806661.db2.gz NHPVRKHHESWEJD-HTQZYQBOSA-N 0 0 377.622 3.260 20 5 GGBDRN COc1cc(C(=O)OCCNc2ccc(C(F)(F)F)cn2)ccc1[N+](=O)[O-] ZINC000153897465 1422807489 /nfs/dbraw/zinc/80/74/89/1422807489.db2.gz ITNJZIWCDKJLCY-UHFFFAOYSA-N 0 0 385.298 3.286 20 5 GGBDRN CC[S@@](=O)[C@H]1CCC[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000153901818 1422808113 /nfs/dbraw/zinc/80/81/13/1422808113.db2.gz VZGQMPNBRZERTC-AQZOLHLPSA-N 0 0 393.509 3.349 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000153901937 1422808159 /nfs/dbraw/zinc/80/81/59/1422808159.db2.gz VZGQMPNBRZERTC-PMOSDDBASA-N 0 0 393.509 3.349 20 5 GGBDRN O=C(NC[C@@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000153910072 1422809123 /nfs/dbraw/zinc/80/91/23/1422809123.db2.gz MJBOZRXSLMWYPH-ZDUSSCGKSA-N 0 0 398.337 3.074 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N(C)Cc2nc3ccccc3o2)c([N+](=O)[O-])c1 ZINC000153914018 1422810081 /nfs/dbraw/zinc/81/00/81/1422810081.db2.gz VLUZFGFGGLVMFZ-LBPRGKRZSA-N 0 0 384.392 3.204 20 5 GGBDRN C[C@@H](CCCO)Nc1ccc(S(=O)(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000153916438 1422810245 /nfs/dbraw/zinc/81/02/45/1422810245.db2.gz BCTIVIYWJHECQD-SLTAFYQDSA-N 0 0 399.513 3.025 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)OCCNc1ccc(C(F)(F)F)cn1 ZINC000153940934 1422814333 /nfs/dbraw/zinc/81/43/33/1422814333.db2.gz FPTKSRUOYNOZOP-UHFFFAOYSA-N 0 0 385.298 3.043 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)cc2)c(C)c1[N+](=O)[O-] ZINC000153940695 1422814464 /nfs/dbraw/zinc/81/44/64/1422814464.db2.gz VQBYDPVGTLNHGW-QRVBRYPASA-N 0 0 398.463 3.144 20 5 GGBDRN Cc1cccc([C@@H](CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)NC(N)=O)c1 ZINC000153943270 1422814689 /nfs/dbraw/zinc/81/46/89/1422814689.db2.gz CWQVSFSZZZCBCN-LJQANCHMSA-N 0 0 396.447 3.194 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCOC[C@H]2C[C@@H](O)c2ccccc2)c2ccncc21 ZINC000153948705 1422815587 /nfs/dbraw/zinc/81/55/87/1422815587.db2.gz NXMFSUSQVGEGHR-IIBYNOLFSA-N 0 0 379.416 3.472 20 5 GGBDRN CCc1onc(C)c1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000153950902 1422815967 /nfs/dbraw/zinc/81/59/67/1422815967.db2.gz IRLDUHLUDBDKGA-OAHLLOKOSA-N 0 0 386.408 3.005 20 5 GGBDRN CC(C)c1ccc([C@]2(C)NC(=O)N(CC(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000153966719 1422818229 /nfs/dbraw/zinc/81/82/29/1422818229.db2.gz STZVRSWSIHRPSH-NRFANRHFSA-N 0 0 395.415 3.368 20 5 GGBDRN CC(C)c1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000153966606 1422818388 /nfs/dbraw/zinc/81/83/88/1422818388.db2.gz STZVRSWSIHRPSH-OAQYLSRUSA-N 0 0 395.415 3.368 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000153975005 1422819732 /nfs/dbraw/zinc/81/97/32/1422819732.db2.gz FIGUTYMCRDQPLH-HHHXNRCGSA-N 0 0 387.461 3.206 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OS(=O)(=O)Cc1ccc(F)c(Cl)c1 ZINC000153990459 1422821739 /nfs/dbraw/zinc/82/17/39/1422821739.db2.gz CHMWFLZIBAPPEU-UHFFFAOYSA-N 0 0 375.761 3.305 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccccc1OC1CCCC1 ZINC000153991332 1422821819 /nfs/dbraw/zinc/82/18/19/1422821819.db2.gz PCHNLQLEVYBMPM-UHFFFAOYSA-N 0 0 383.404 3.285 20 5 GGBDRN Cc1cc(-n2cncn2)ccc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154000715 1422823422 /nfs/dbraw/zinc/82/34/22/1422823422.db2.gz AXQFSGCBWXWPCQ-UHFFFAOYSA-N 0 0 377.404 3.289 20 5 GGBDRN O=C(c1ccc(N2CCOCC2)c(F)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154002504 1422823993 /nfs/dbraw/zinc/82/39/93/1422823993.db2.gz PNSMAMFVEIDEGP-UHFFFAOYSA-N 0 0 399.422 3.375 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC000154002150 1422824025 /nfs/dbraw/zinc/82/40/25/1422824025.db2.gz NJIYXGCAMRJQSF-HZPDHXFCSA-N 0 0 381.860 3.466 20 5 GGBDRN Cc1ccccc1[C@@H](CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)NC(N)=O ZINC000154005783 1422824222 /nfs/dbraw/zinc/82/42/22/1422824222.db2.gz SYNZXLXQRLRNNH-LJQANCHMSA-N 0 0 396.447 3.194 20 5 GGBDRN CCCCC(=O)N1CSC[C@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154011993 1422825295 /nfs/dbraw/zinc/82/52/95/1422825295.db2.gz AVVBSJLBCOHRML-KRWDZBQOSA-N 0 0 391.493 3.178 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccc(O)cc1)CC1CC1 ZINC000154015145 1422825927 /nfs/dbraw/zinc/82/59/27/1422825927.db2.gz BJEYVIAXMQMEKZ-UHFFFAOYSA-N 0 0 393.399 3.194 20 5 GGBDRN CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000154023179 1422827220 /nfs/dbraw/zinc/82/72/20/1422827220.db2.gz VQJOIRCXWRPCTQ-AWEZNQCLSA-N 0 0 391.449 3.277 20 5 GGBDRN COCCN(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000154047534 1422831470 /nfs/dbraw/zinc/83/14/70/1422831470.db2.gz NQQMHXJFWBLBQM-UHFFFAOYSA-N 0 0 383.198 3.239 20 5 GGBDRN CCCc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000154050636 1422831823 /nfs/dbraw/zinc/83/18/23/1422831823.db2.gz LRRODODHDQPWIS-NRFANRHFSA-N 0 0 395.415 3.197 20 5 GGBDRN CNC(=O)c1cc(Cl)ccc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000154060363 1422833708 /nfs/dbraw/zinc/83/37/08/1422833708.db2.gz XULYXLSLNWZFAX-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN C[C@@H]1CN(C[C@H](O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000154077237 1422836900 /nfs/dbraw/zinc/83/69/00/1422836900.db2.gz OXEXOOAKGPCNNX-MDZRGWNJSA-N 0 0 386.448 3.111 20 5 GGBDRN O=C(NC[C@H]1CCN(c2ccc(F)cc2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000154109764 1422841652 /nfs/dbraw/zinc/84/16/52/1422841652.db2.gz PXULQVOJHGZLPU-OAHLLOKOSA-N 0 0 398.438 3.328 20 5 GGBDRN CC(=O)c1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)cc1C ZINC000154134442 1422844857 /nfs/dbraw/zinc/84/48/57/1422844857.db2.gz PMNSOCMHZQSPDG-CYBMUJFWSA-N 0 0 399.378 3.237 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2C[C@@H](C)OC(C)(C)C2)c1=S ZINC000154137108 1422845234 /nfs/dbraw/zinc/84/52/34/1422845234.db2.gz MGNZCYXUDGNWQG-CYBMUJFWSA-N 0 0 391.497 3.466 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCN(C(=O)c2ccc(F)cc2)CC1 ZINC000154198669 1422853860 /nfs/dbraw/zinc/85/38/60/1422853860.db2.gz YAXCNIFGTAXDPP-UHFFFAOYSA-N 0 0 399.422 3.041 20 5 GGBDRN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000154216396 1422856892 /nfs/dbraw/zinc/85/68/92/1422856892.db2.gz VLEYSOZWINPPST-UHFFFAOYSA-N 0 0 393.403 3.350 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)cc([N+](=O)[O-])c1F ZINC000154258151 1422863079 /nfs/dbraw/zinc/86/30/79/1422863079.db2.gz DYZYTENAVZBVTF-UHFFFAOYSA-N 0 0 393.396 3.192 20 5 GGBDRN CN(C)C(=O)COc1ccccc1CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154262591 1422863616 /nfs/dbraw/zinc/86/36/16/1422863616.db2.gz MOCCZDLTGDVBLG-UHFFFAOYSA-N 0 0 383.448 3.226 20 5 GGBDRN Cc1sc(Br)cc1S(=O)(=O)Oc1ccccc1[N+](=O)[O-] ZINC000154272359 1422865281 /nfs/dbraw/zinc/86/52/81/1422865281.db2.gz ICSDITLKKWZFRB-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(NCc3nccc(N)n3)c([N+](=O)[O-])c2)cc1 ZINC000154288949 1422867665 /nfs/dbraw/zinc/86/76/65/1422867665.db2.gz HFCCIGJOLWAKKA-UHFFFAOYSA-N 0 0 378.392 3.140 20 5 GGBDRN CCOc1cc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)ccc1OC ZINC000154296125 1422868554 /nfs/dbraw/zinc/86/85/54/1422868554.db2.gz WAAXBYJVGRFSAQ-UHFFFAOYSA-N 0 0 381.388 3.480 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NCC(=O)NCC1(c2ccccc2)CCOCC1 ZINC000154302612 1422869598 /nfs/dbraw/zinc/86/95/98/1422869598.db2.gz BHARJILTYIDGRN-UHFFFAOYSA-N 0 0 397.475 3.488 20 5 GGBDRN O=C(NCCOc1ccc(C(F)(F)F)cn1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000154311609 1422871044 /nfs/dbraw/zinc/87/10/44/1422871044.db2.gz YWDKAIYJPWDGFG-UHFFFAOYSA-N 0 0 389.717 3.471 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N(C1CC1)[C@@H]1CCc2ccccc21 ZINC000154316434 1422871603 /nfs/dbraw/zinc/87/16/03/1422871603.db2.gz OIYVRMCASRZHOA-LJQANCHMSA-N 0 0 379.416 3.003 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000154358763 1422877942 /nfs/dbraw/zinc/87/79/42/1422877942.db2.gz QURIAGCOVQIADS-HUUCEWRRSA-N 0 0 399.447 3.465 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCOC[C@H]1CC(=O)c1cccs1 ZINC000154370482 1422879748 /nfs/dbraw/zinc/87/97/48/1422879748.db2.gz YCZWOIYAXHUVHL-OAHLLOKOSA-N 0 0 376.434 3.139 20 5 GGBDRN COc1ccc(-c2nnc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)s2)cc1 ZINC000154372619 1422880128 /nfs/dbraw/zinc/88/01/28/1422880128.db2.gz XAGHOSBLOICWCD-UHFFFAOYSA-N 0 0 385.405 3.265 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000154414185 1422886057 /nfs/dbraw/zinc/88/60/57/1422886057.db2.gz XXPGMOQGQHICPV-FQEVSTJZSA-N 0 0 393.443 3.393 20 5 GGBDRN CCCn1c(CO)nnc1Sc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000154439796 1422888847 /nfs/dbraw/zinc/88/88/47/1422888847.db2.gz ZQVYVPTXPRJUHQ-UHFFFAOYSA-N 0 0 398.444 3.471 20 5 GGBDRN C[C@H](CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)CC1(C)OCCO1 ZINC000154445838 1422889472 /nfs/dbraw/zinc/88/94/72/1422889472.db2.gz ZLMDMNANJPCWBP-AWEZNQCLSA-N 0 0 377.441 3.058 20 5 GGBDRN CC(C)CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000154447883 1422889787 /nfs/dbraw/zinc/88/97/87/1422889787.db2.gz AQCJYUVZMTXFKY-KRWDZBQOSA-N 0 0 375.469 3.472 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)NC[C@]3(C)CCCS3)cc2)c(C)c1[N+](=O)[O-] ZINC000154449931 1422890120 /nfs/dbraw/zinc/89/01/20/1422890120.db2.gz QVKWPJVXWQGNOP-IBGZPJMESA-N 0 0 388.493 3.472 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCCCNC(=O)c2cccc(O)c2)cc1[N+](=O)[O-] ZINC000154451698 1422890403 /nfs/dbraw/zinc/89/04/03/1422890403.db2.gz PYMPNKGPVPFROX-UHFFFAOYSA-N 0 0 399.447 3.148 20 5 GGBDRN CC(C)(C)[C@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccc(F)cc1F ZINC000154472674 1422893337 /nfs/dbraw/zinc/89/33/37/1422893337.db2.gz MXTBPXDQGYCXNF-OAHLLOKOSA-N 0 0 381.383 3.156 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CCCc2c1cnn2C ZINC000154475018 1422893872 /nfs/dbraw/zinc/89/38/72/1422893872.db2.gz SMQWXNAVWMLCDW-RISCZKNCSA-N 0 0 392.843 3.285 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000154482703 1422894928 /nfs/dbraw/zinc/89/49/28/1422894928.db2.gz MAAMGKUWEFNAIT-GTNSWQLSSA-N 0 0 382.413 3.062 20 5 GGBDRN CC(C)Oc1cc(CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C2CC2)ccn1 ZINC000154483557 1422895114 /nfs/dbraw/zinc/89/51/14/1422895114.db2.gz AMDIAFPSTOLKMK-UHFFFAOYSA-N 0 0 395.419 3.458 20 5 GGBDRN CNC(=O)c1ccc(Cl)cc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000154486433 1422895171 /nfs/dbraw/zinc/89/51/71/1422895171.db2.gz VLZKXMGKXAXRPV-UHFFFAOYSA-N 0 0 399.794 3.046 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1 ZINC000154494922 1422896822 /nfs/dbraw/zinc/89/68/22/1422896822.db2.gz JMVJMJKUWCCLCT-NVXWUHKLSA-N 0 0 394.431 3.065 20 5 GGBDRN CCN(CC)c1ccc(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cn1 ZINC000154494751 1422896935 /nfs/dbraw/zinc/89/69/35/1422896935.db2.gz CCBKTVXTZSTUQA-UHFFFAOYSA-N 0 0 381.436 3.176 20 5 GGBDRN COc1cccc(O[C@@H](C)CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000154515358 1422899190 /nfs/dbraw/zinc/89/91/90/1422899190.db2.gz WRIHJDHFZSTSJU-ZDUSSCGKSA-N 0 0 381.388 3.349 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1c(F)cc(Cl)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000179831860 1429601054 /nfs/dbraw/zinc/60/10/54/1429601054.db2.gz MWOONOHUJGAKFR-QMMMGPOBSA-N 0 0 383.738 3.342 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000154538399 1422912384 /nfs/dbraw/zinc/91/23/84/1422912384.db2.gz XOIGDKBJVGTUSY-OAHLLOKOSA-N 0 0 394.214 3.437 20 5 GGBDRN CC[C@@H](C)N(Cc1nc2ccccc2c(=O)[nH]1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154550695 1422921421 /nfs/dbraw/zinc/92/14/21/1422921421.db2.gz PVLGKAMCEYDMJC-KUHUBIRLSA-N 0 0 396.447 3.165 20 5 GGBDRN Nc1ccc(C(=O)NC2(c3cccc(Br)c3)CC2)cc1[N+](=O)[O-] ZINC000154553008 1422923483 /nfs/dbraw/zinc/92/34/83/1422923483.db2.gz RTFJXVKWFOWBTQ-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN CC(C)(CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc2c(c1)OCO2 ZINC000154564245 1422933571 /nfs/dbraw/zinc/93/35/71/1422933571.db2.gz DMZGTXXJTVDQTH-UHFFFAOYSA-N 0 0 397.431 3.369 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000154586985 1422945090 /nfs/dbraw/zinc/94/50/90/1422945090.db2.gz NUEMJDQFIOKYJG-UHFFFAOYSA-N 0 0 392.165 3.468 20 5 GGBDRN O=C(NCCOc1ncccc1Cl)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154586580 1422945219 /nfs/dbraw/zinc/94/52/19/1422945219.db2.gz SDPDQELLRZODRA-UHFFFAOYSA-N 0 0 390.827 3.396 20 5 GGBDRN Cc1coc(-c2cccc(NC(=O)[C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)c2)n1 ZINC000154587742 1422946196 /nfs/dbraw/zinc/94/61/96/1422946196.db2.gz JRPSWTGAZSUPQA-ZDUSSCGKSA-N 0 0 394.387 3.315 20 5 GGBDRN Cc1coc(-c2cccc(NC(=O)[C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)c2)n1 ZINC000154587629 1422946786 /nfs/dbraw/zinc/94/67/86/1422946786.db2.gz JRPSWTGAZSUPQA-CYBMUJFWSA-N 0 0 394.387 3.315 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000154596332 1422952431 /nfs/dbraw/zinc/95/24/31/1422952431.db2.gz HWOOTMCAJINZDU-CQSZACIVSA-N 0 0 394.214 3.437 20 5 GGBDRN Cc1c(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cccc1N1CCNC1=O ZINC000154601132 1422956263 /nfs/dbraw/zinc/95/62/63/1422956263.db2.gz FNEDPBXBTOWQAV-UHFFFAOYSA-N 0 0 394.431 3.238 20 5 GGBDRN C[C@@]1(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)Cc2ccccc2C(=O)O1 ZINC000154625564 1422968778 /nfs/dbraw/zinc/96/87/78/1422968778.db2.gz GVSSLUGQZDBRDG-NRFANRHFSA-N 0 0 380.400 3.258 20 5 GGBDRN COc1cc(C(=O)N(CCCO)Cc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000154634001 1422974843 /nfs/dbraw/zinc/97/48/43/1422974843.db2.gz AQEDAAKFJONRCY-UHFFFAOYSA-N 0 0 378.812 3.282 20 5 GGBDRN C[C@@]1(c2cc(F)cc(F)c2)NC(=O)N(Cc2c(Cl)cccc2[N+](=O)[O-])C1=O ZINC000154645824 1422981184 /nfs/dbraw/zinc/98/11/84/1422981184.db2.gz QKOBZFPVRAPMPG-KRWDZBQOSA-N 0 0 395.749 3.494 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N(CC(F)(F)F)c1ccccn1 ZINC000154652984 1422984866 /nfs/dbraw/zinc/98/48/66/1422984866.db2.gz LGGYAFAUQNCGAZ-UHFFFAOYSA-N 0 0 391.309 3.385 20 5 GGBDRN Cc1cc(-n2cncn2)ccc1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154654366 1422985436 /nfs/dbraw/zinc/98/54/36/1422985436.db2.gz IKRKTIALLCBPNU-UHFFFAOYSA-N 0 0 377.404 3.289 20 5 GGBDRN CS[C@H]1CCCCN(c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1 ZINC000154662087 1422991537 /nfs/dbraw/zinc/99/15/37/1422991537.db2.gz OVSPGNDABJVIEF-HNNXBMFYSA-N 0 0 399.538 3.101 20 5 GGBDRN CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cc(F)c([N+](=O)[O-])cc2F)c1 ZINC000154667593 1422993199 /nfs/dbraw/zinc/99/31/99/1422993199.db2.gz 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NHWICHAMBDRVOF-GOEBONIOSA-N 0 0 379.416 3.428 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158044311 1424147720 /nfs/dbraw/zinc/14/77/20/1424147720.db2.gz UNJGVLHDVABBRW-UHFFFAOYSA-N 0 0 378.388 3.243 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[C@@H](O)c2cccs2)cc1C ZINC000158055107 1424150553 /nfs/dbraw/zinc/15/05/53/1424150553.db2.gz LABYKXIBBKWYFY-GXTWGEPZSA-N 0 0 384.479 3.064 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[C@H](O)c2cccs2)cc1C ZINC000158054824 1424150772 /nfs/dbraw/zinc/15/07/72/1424150772.db2.gz LABYKXIBBKWYFY-JSGCOSHPSA-N 0 0 384.479 3.064 20 5 GGBDRN CCOC(=O)C1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000158069986 1424156266 /nfs/dbraw/zinc/15/62/66/1424156266.db2.gz OFUQVALMQJOYFX-UHFFFAOYSA-N 0 0 375.450 3.493 20 5 GGBDRN Cc1nc(CCNC(=O)c2ccc(Br)c([N+](=O)[O-])c2)sc1C ZINC000158071138 1424156538 /nfs/dbraw/zinc/15/65/38/1424156538.db2.gz YHRQZXQBDTUAGZ-UHFFFAOYSA-N 0 0 384.255 3.403 20 5 GGBDRN 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CCc1ccc([C@H]2COCCN2C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)o1 ZINC000158137104 1424176134 /nfs/dbraw/zinc/17/61/34/1424176134.db2.gz RMYQITMUYIXDIR-GOSISDBHSA-N 0 0 396.403 3.150 20 5 GGBDRN CC[C@@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])c1ccncc1 ZINC000158136236 1424176238 /nfs/dbraw/zinc/17/62/38/1424176238.db2.gz QIYKVEUOXUUXKG-GFCCVEGCSA-N 0 0 381.335 3.481 20 5 GGBDRN CN1CCc2ccc(NC(=O)c3ccc([N+](=O)[O-])c4cccnc34)cc2C1=O ZINC000158146729 1424178606 /nfs/dbraw/zinc/17/86/06/1424178606.db2.gz QEXWNBFXIUXNKM-UHFFFAOYSA-N 0 0 376.372 3.023 20 5 GGBDRN Cc1nnnn1-c1cccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000158156006 1424181286 /nfs/dbraw/zinc/18/12/86/1424181286.db2.gz ILCNXUDPYSQKLR-UHFFFAOYSA-N 0 0 395.423 3.023 20 5 GGBDRN COc1ccc([C@H]2[C@@H](C(=O)N(C)c3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1 ZINC000158159009 1424182310 /nfs/dbraw/zinc/18/23/10/1424182310.db2.gz DDCHQVLHIYAKDK-ICSRJNTNSA-N 0 0 397.431 3.176 20 5 GGBDRN COc1ccc([C@H]2[C@H](C(=O)N(C)c3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1 ZINC000158158711 1424182319 /nfs/dbraw/zinc/18/23/19/1424182319.db2.gz DDCHQVLHIYAKDK-QUCCMNQESA-N 0 0 397.431 3.176 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1[N+](=O)[O-] ZINC000158172778 1424186094 /nfs/dbraw/zinc/18/60/94/1424186094.db2.gz RFMZYMKJRLGJDQ-UHFFFAOYSA-N 0 0 381.396 3.185 20 5 GGBDRN COc1ccc(CNC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1Br ZINC000158192017 1424191020 /nfs/dbraw/zinc/19/10/20/1424191020.db2.gz WXUKYMSONWKBQO-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1ccc(-n2cnnn2)cc1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000158201261 1424193200 /nfs/dbraw/zinc/19/32/00/1424193200.db2.gz SEERDWUKTYWTIE-UHFFFAOYSA-N 0 0 395.423 3.023 20 5 GGBDRN O=C(Oc1cccc(-n2cccn2)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000158204513 1424194503 /nfs/dbraw/zinc/19/45/03/1424194503.db2.gz BDFGCFJWBFRYBG-UHFFFAOYSA-N 0 0 375.344 3.185 20 5 GGBDRN Cc1cc(C)cc(CCNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000158216118 1424197688 /nfs/dbraw/zinc/19/76/88/1424197688.db2.gz GBAHOEUPYMSNHB-UHFFFAOYSA-N 0 0 375.812 3.162 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[C@H](O)c2cccs2)c1C ZINC000158256309 1424209616 /nfs/dbraw/zinc/20/96/16/1424209616.db2.gz NYZIQARWXQJGQD-FZMZJTMJSA-N 0 0 384.479 3.064 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000158253795 1424209784 /nfs/dbraw/zinc/20/97/84/1424209784.db2.gz GWBJCHLLQANIRD-IBGZPJMESA-N 0 0 395.415 3.394 20 5 GGBDRN CS[C@@H]1CCCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C1 ZINC000158276926 1424215203 /nfs/dbraw/zinc/21/52/03/1424215203.db2.gz CVCPNZNRWRWSDI-LLVKDONJSA-N 0 0 378.903 3.463 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC([C@H](O)c2ccccc2)CC1 ZINC000158276087 1424215332 /nfs/dbraw/zinc/21/53/32/1424215332.db2.gz BSWASIPXAVZZRM-LJQANCHMSA-N 0 0 390.461 3.038 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000158313127 1424224249 /nfs/dbraw/zinc/22/42/49/1424224249.db2.gz HPUDENRIVDAZLZ-UHFFFAOYSA-N 0 0 382.376 3.396 20 5 GGBDRN C[C@@H](c1ccsc1)N1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000158323929 1424225830 /nfs/dbraw/zinc/22/58/30/1424225830.db2.gz YDPAISZMXCCUKR-LBPRGKRZSA-N 0 0 385.449 3.052 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(Cc2ccccc2Cl)CC1 ZINC000158329049 1424227702 /nfs/dbraw/zinc/22/77/02/1424227702.db2.gz ROYICRRLZAPNMQ-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN Cn1cc(CNc2cccc(C(=O)NC3CC3)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000158341807 1424231571 /nfs/dbraw/zinc/23/15/71/1424231571.db2.gz YUEAUPVMMQJQQN-UHFFFAOYSA-N 0 0 391.431 3.500 20 5 GGBDRN CC(C)[C@H](C(=O)N(C)c1cccc([N+](=O)[O-])c1)n1nnc(-c2ccccc2)n1 ZINC000158348718 1424233076 /nfs/dbraw/zinc/23/30/76/1424233076.db2.gz QIDFHPHRGFFCQF-QGZVFWFLSA-N 0 0 380.408 3.108 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCN(Cc2ccccc2Cl)CC1 ZINC000158393102 1424243782 /nfs/dbraw/zinc/24/37/82/1424243782.db2.gz MDKADVRDNGMUCR-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N(C)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000158433605 1424253066 /nfs/dbraw/zinc/25/30/66/1424253066.db2.gz DUUNIFGMRIXOHI-QGZVFWFLSA-N 0 0 375.812 3.479 20 5 GGBDRN CC[C@@]1(C)C[C@@H]1C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000158440137 1424254959 /nfs/dbraw/zinc/25/49/59/1424254959.db2.gz SSWAJQLHMWHXGU-WBMJQRKESA-N 0 0 395.462 3.259 20 5 GGBDRN O=C(c1ccco1)N1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000158466299 1424263722 /nfs/dbraw/zinc/26/37/22/1424263722.db2.gz TVOKPOVTOWRBSI-UHFFFAOYSA-N 0 0 381.388 3.406 20 5 GGBDRN C[C@@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2cccnc2O1 ZINC000158466389 1424264783 /nfs/dbraw/zinc/26/47/83/1424264783.db2.gz FUZUQXUBPWDARR-OAHLLOKOSA-N 0 0 385.423 3.364 20 5 GGBDRN CC(C)[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)OC(C)(C)C ZINC000180047968 1429713051 /nfs/dbraw/zinc/71/30/51/1429713051.db2.gz DZYYZCOARUHZNP-OAHLLOKOSA-N 0 0 376.413 3.101 20 5 GGBDRN Cc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)nnn1-c1cccc2cnccc21 ZINC000158502249 1424273768 /nfs/dbraw/zinc/27/37/68/1424273768.db2.gz XACJPSUQDPRMCU-UHFFFAOYSA-N 0 0 388.387 3.309 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](CC(=O)N(C)c2cccc([N+](=O)[O-])c2)C1 ZINC000158505445 1424274747 /nfs/dbraw/zinc/27/47/47/1424274747.db2.gz RCJXEKVTRTZRGB-HNNXBMFYSA-N 0 0 376.457 3.025 20 5 GGBDRN CN(C(=O)CCC(=O)N1CCSc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000158508721 1424275489 /nfs/dbraw/zinc/27/54/89/1424275489.db2.gz QTVGDAJWQWJTSG-UHFFFAOYSA-N 0 0 385.445 3.477 20 5 GGBDRN Cn1cc(CN2CCN(c3ccccc3O)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000158519408 1424278278 /nfs/dbraw/zinc/27/82/78/1424278278.db2.gz ARYVXQMNTIZKTA-UHFFFAOYSA-N 0 0 393.447 3.023 20 5 GGBDRN COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000158575726 1424293728 /nfs/dbraw/zinc/29/37/28/1424293728.db2.gz CQCXNYOEBOIKPF-UHFFFAOYSA-N 0 0 399.447 3.400 20 5 GGBDRN COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000158642312 1424307859 /nfs/dbraw/zinc/30/78/59/1424307859.db2.gz WDUBDVKBISOJHB-UHFFFAOYSA-N 0 0 385.420 3.471 20 5 GGBDRN C[C@@H]1C[C@H](C)CCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C1 ZINC000158680711 1424317346 /nfs/dbraw/zinc/31/73/46/1424317346.db2.gz MVZDUJVEHYHDQJ-CHWSQXEVSA-N 0 0 389.481 3.383 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)cc([N+](=O)[O-])c1F ZINC000180063393 1429720601 /nfs/dbraw/zinc/72/06/01/1429720601.db2.gz SEPRBBYEBUOJCZ-AEFFLSMTSA-N 0 0 394.424 3.241 20 5 GGBDRN COc1ccc([C@H](C)N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)cc1 ZINC000180056803 1429717250 /nfs/dbraw/zinc/71/72/50/1429717250.db2.gz IENXDQRSJYRSJI-LBPRGKRZSA-N 0 0 382.413 3.433 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCO[C@]3(CCc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000158697872 1424322149 /nfs/dbraw/zinc/32/21/49/1424322149.db2.gz NNUKOWZQKXQAIC-KSFYIVLOSA-N 0 0 395.459 3.404 20 5 GGBDRN O=C(NC[C@]1(O)CCc2ccccc21)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000158731727 1424329012 /nfs/dbraw/zinc/32/90/12/1424329012.db2.gz MHOMASAKLUNLLM-HXUWFJFHSA-N 0 0 395.440 3.282 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCO[C@]2(CCc3ccccc32)C1 ZINC000158779243 1424340239 /nfs/dbraw/zinc/34/02/39/1424340239.db2.gz DNOVHOJDBPEWSR-QVKFZJNVSA-N 0 0 381.432 3.096 20 5 GGBDRN COCCOc1cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)nc2ccccc21 ZINC000158781457 1424341098 /nfs/dbraw/zinc/34/10/98/1424341098.db2.gz ARPDTGPPSQQYEW-UHFFFAOYSA-N 0 0 395.415 3.141 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[N@H+]2CCC[C@@H](O)C2)cc1 ZINC000158792275 1424343161 /nfs/dbraw/zinc/34/31/61/1424343161.db2.gz ZXTZFRGBAMTLNS-HXUWFJFHSA-N 0 0 378.432 3.404 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H](O)c1ccc2ccccc2c1 ZINC000158796990 1424344709 /nfs/dbraw/zinc/34/47/09/1424344709.db2.gz CLNMAEHFSPCGBJ-GOSISDBHSA-N 0 0 386.429 3.068 20 5 GGBDRN CCOc1ccc2c(c1)CN(S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1)CC2 ZINC000180062116 1429719542 /nfs/dbraw/zinc/71/95/42/1429719542.db2.gz PDBMOLPWNXPPPH-UHFFFAOYSA-N 0 0 394.424 3.188 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1 ZINC000158824489 1424350943 /nfs/dbraw/zinc/35/09/43/1424350943.db2.gz KJTYSOMLMTUYKA-UHFFFAOYSA-N 0 0 385.344 3.260 20 5 GGBDRN Cn1c(=O)oc2cc(NC(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)ccc21 ZINC000158841559 1424355114 /nfs/dbraw/zinc/35/51/14/1424355114.db2.gz BTTXBAVIQLSVRU-UHFFFAOYSA-N 0 0 382.376 3.236 20 5 GGBDRN O=C(CSc1nnc(Cc2cccc(F)c2)o1)Nc1ccccc1[N+](=O)[O-] ZINC000158909426 1424369356 /nfs/dbraw/zinc/36/93/56/1424369356.db2.gz NMGSRTJVJJOXPE-UHFFFAOYSA-N 0 0 388.380 3.439 20 5 GGBDRN COc1cc(C(=O)N2CCN(c3ccccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000158913934 1424371551 /nfs/dbraw/zinc/37/15/51/1424371551.db2.gz BFLPONNQBKAYQL-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN CC[C@@H](C(=O)N1CCC(NC(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 ZINC000158948461 1424379585 /nfs/dbraw/zinc/37/95/85/1424379585.db2.gz CDCKNJVTOHFBNW-MRXNPFEDSA-N 0 0 385.420 3.102 20 5 GGBDRN COC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c1 ZINC000158965603 1424383150 /nfs/dbraw/zinc/38/31/50/1424383150.db2.gz VYXYEPYGFUCPDF-UHFFFAOYSA-N 0 0 397.431 3.302 20 5 GGBDRN Cc1csc(C2(NS(=O)(=O)CCc3ccccc3[N+](=O)[O-])CCCC2)n1 ZINC000158966008 1424383203 /nfs/dbraw/zinc/38/32/03/1424383203.db2.gz QBCBVMNMEGHMIG-UHFFFAOYSA-N 0 0 395.506 3.291 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2ccc(F)cc2O1 ZINC000158977528 1424385971 /nfs/dbraw/zinc/38/59/71/1424385971.db2.gz JWJSXILAKPRXEI-GFCCVEGCSA-N 0 0 382.351 3.347 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)Oc1cccc(-n2ccnc2)c1 ZINC000159004466 1424392908 /nfs/dbraw/zinc/39/29/08/1424392908.db2.gz BELVEIYUHSSXNC-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN O=C(O[C@H]([C@H]1CCCO1)C(F)(F)F)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000159010758 1424394470 /nfs/dbraw/zinc/39/44/70/1424394470.db2.gz AADAPARRAPPACU-ZIAGYGMSSA-N 0 0 385.298 3.047 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2cccc(-n3ccnc3)c2)c(Cl)c1 ZINC000159012671 1424395064 /nfs/dbraw/zinc/39/50/64/1424395064.db2.gz ASBPBMXUQKRFEV-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2cccc(-n3cccn3)c2)c(Cl)c1 ZINC000159031926 1424400167 /nfs/dbraw/zinc/40/01/67/1424400167.db2.gz NRQOZYIUBUSCRT-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN O=C(C[C@H](O)c1cccc(F)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000180069207 1429723435 /nfs/dbraw/zinc/72/34/35/1429723435.db2.gz UGUSJMHNRUVJSV-IBGZPJMESA-N 0 0 388.395 3.227 20 5 GGBDRN CCOc1ccc(-c2nc(CN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)co2)cc1 ZINC000159039516 1424402047 /nfs/dbraw/zinc/40/20/47/1424402047.db2.gz XJRLCNMIXAMBDI-UHFFFAOYSA-N 0 0 393.355 3.445 20 5 GGBDRN C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cnn(C)c1 ZINC000159057423 1424407116 /nfs/dbraw/zinc/40/71/16/1424407116.db2.gz IEHLRWMNTZILTM-SECBINFHSA-N 0 0 388.371 3.317 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)C(=O)NCc3ccc([N+](=O)[O-])cc3)c2)cs1 ZINC000159073361 1424411308 /nfs/dbraw/zinc/41/13/08/1424411308.db2.gz MUTDZMSKMRTJNY-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN 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ZINC000159194233 1424440412 /nfs/dbraw/zinc/44/04/12/1424440412.db2.gz PRXHXQFYJNRUDO-QGZVFWFLSA-N 0 0 380.322 3.177 20 5 GGBDRN CC(C)OC1CCC(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000159218582 1424445979 /nfs/dbraw/zinc/44/59/79/1424445979.db2.gz NASSIBIRAWZIHM-UHFFFAOYSA-N 0 0 386.452 3.461 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)cc([N+](=O)[O-])c1F ZINC000180078081 1429727236 /nfs/dbraw/zinc/72/72/36/1429727236.db2.gz SDPJVFXRHLGJCB-WBMJQRKESA-N 0 0 388.461 3.162 20 5 GGBDRN COC(=O)c1csc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1C ZINC000180078165 1429727247 /nfs/dbraw/zinc/72/72/47/1429727247.db2.gz YGHSMHSEXAYREU-UHFFFAOYSA-N 0 0 386.389 3.189 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCC2([C@H](O)c3ccccc3)CC2)cc1C ZINC000159228961 1424452558 /nfs/dbraw/zinc/45/25/58/1424452558.db2.gz GNZZFPGTJKFIQI-GOSISDBHSA-N 0 0 390.461 3.004 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCC2([C@H](O)c3ccccc3)CC2)c(Cl)c1 ZINC000159239164 1424454960 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ZINC000160848524 1424638879 /nfs/dbraw/zinc/63/88/79/1424638879.db2.gz WIJIAYJZMOUINB-UHFFFAOYSA-N 0 0 397.840 3.109 20 5 GGBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000160851016 1424638919 /nfs/dbraw/zinc/63/89/19/1424638919.db2.gz FEZYYFIMOSHWSW-ZDUSSCGKSA-N 0 0 384.379 3.063 20 5 GGBDRN CC[C@]1(c2ccc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)CCC(=O)NC1=O ZINC000160930319 1424644909 /nfs/dbraw/zinc/64/49/09/1424644909.db2.gz ONGZQJGHXZGAMT-HXUWFJFHSA-N 0 0 399.378 3.071 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(C[C@H](C)O)C1CCCCC1 ZINC000160942696 1424647023 /nfs/dbraw/zinc/64/70/23/1424647023.db2.gz NNEGFOXSZZNDTD-LBPRGKRZSA-N 0 0 390.889 3.261 20 5 GGBDRN CC1CC[NH+](C2CCC([N-]S(=O)(=O)c3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000160947025 1424647086 /nfs/dbraw/zinc/64/70/86/1424647086.db2.gz SIZBZNGPKNSFIA-UHFFFAOYSA-N 0 0 399.488 3.055 20 5 GGBDRN CC[C@H]1CCCC[C@H]1N(C)C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000160961583 1424647900 /nfs/dbraw/zinc/64/79/00/1424647900.db2.gz PMAJZGBWXFKZNX-JKSUJKDBSA-N 0 0 398.463 3.490 20 5 GGBDRN O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000161018034 1424653486 /nfs/dbraw/zinc/65/34/86/1424653486.db2.gz YVOVTRVDCJFQTC-OAHLLOKOSA-N 0 0 384.436 3.392 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@@H]2CCCc3sccc32)c([N+](=O)[O-])c1 ZINC000161063216 1424655733 /nfs/dbraw/zinc/65/57/33/1424655733.db2.gz DGUFDHKNJPZHMT-CYBMUJFWSA-N 0 0 389.433 3.049 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@H]2CCCc3sccc32)c([N+](=O)[O-])c1 ZINC000161063331 1424656013 /nfs/dbraw/zinc/65/60/13/1424656013.db2.gz DGUFDHKNJPZHMT-ZDUSSCGKSA-N 0 0 389.433 3.049 20 5 GGBDRN Cc1nc(N[C@H]2CCOC(C)(C)C2)nc(N[C@H]2CCOC(C)(C)C2)c1[N+](=O)[O-] ZINC000161143559 1424661290 /nfs/dbraw/zinc/66/12/90/1424661290.db2.gz JKWLBAOAJYHZFB-KBPBESRZSA-N 0 0 393.488 3.432 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000161146042 1424661599 /nfs/dbraw/zinc/66/15/99/1424661599.db2.gz KFWSQCOTRPRUSQ-HNNXBMFYSA-N 0 0 396.852 3.234 20 5 GGBDRN Cc1nc(N[C@@H]2CCOC(C)(C)C2)nc(N[C@H]2CCOC(C)(C)C2)c1[N+](=O)[O-] ZINC000161143417 1424661758 /nfs/dbraw/zinc/66/17/58/1424661758.db2.gz JKWLBAOAJYHZFB-UONOGXRCSA-N 0 0 393.488 3.432 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000161145920 1424661788 /nfs/dbraw/zinc/66/17/88/1424661788.db2.gz KFWSQCOTRPRUSQ-OAHLLOKOSA-N 0 0 396.852 3.234 20 5 GGBDRN CCN(CC)C(=O)C1(NCn2nc(C)c3ccc([N+](=O)[O-])cc32)CCCCC1 ZINC000161172979 1424664707 /nfs/dbraw/zinc/66/47/07/1424664707.db2.gz RNXNDFLSXCTWDW-UHFFFAOYSA-N 0 0 387.484 3.371 20 5 GGBDRN CCc1nc(-c2ccccc2NC(=O)CCOc2ccccc2[N+](=O)[O-])n[nH]1 ZINC000161189527 1424665515 /nfs/dbraw/zinc/66/55/15/1424665515.db2.gz VHCILYZYUQINNB-UHFFFAOYSA-N 0 0 381.392 3.350 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)CC1(O)CCCC1 ZINC000161194691 1424665531 /nfs/dbraw/zinc/66/55/31/1424665531.db2.gz CRVCVIZFFNGJMO-UHFFFAOYSA-N 0 0 384.432 3.308 20 5 GGBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000161200348 1424666486 /nfs/dbraw/zinc/66/64/86/1424666486.db2.gz OUMGCMLXAIJAJR-CYBMUJFWSA-N 0 0 396.378 3.311 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCN(Cc2cccc(F)c2)CC1 ZINC000161237931 1424668679 /nfs/dbraw/zinc/66/86/79/1424668679.db2.gz FVOCAKRHCPYGQX-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN CCc1nc(-c2ccccc2NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000161231018 1424668848 /nfs/dbraw/zinc/66/88/48/1424668848.db2.gz KJCUZOQVJOQRPF-UHFFFAOYSA-N 0 0 377.364 3.071 20 5 GGBDRN CCN(CC)C(=O)Cc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000161269852 1424671895 /nfs/dbraw/zinc/67/18/95/1424671895.db2.gz YPTIRLSUIQHRKZ-UHFFFAOYSA-N 0 0 383.448 3.495 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2ccc(N3CCCCC3)cc2)cccc1[N+](=O)[O-] ZINC000161288068 1424672935 /nfs/dbraw/zinc/67/29/35/1424672935.db2.gz KVQUANYVLYNGFN-UHFFFAOYSA-N 0 0 382.420 3.471 20 5 GGBDRN COc1cc(C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)ccc1[N+](=O)[O-] ZINC000161305977 1424674924 /nfs/dbraw/zinc/67/49/24/1424674924.db2.gz BZYYLIMTJOTWMT-LBPRGKRZSA-N 0 0 391.374 3.138 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCCC[C@@H]1CCCc1ccccc1 ZINC000161323086 1424677222 /nfs/dbraw/zinc/67/72/22/1424677222.db2.gz OYYNJMCZSZPFQY-GOSISDBHSA-N 0 0 383.448 3.161 20 5 GGBDRN CCNC(=O)C(C)(C)CNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000161368467 1424683006 /nfs/dbraw/zinc/68/30/06/1424683006.db2.gz NECLLBYUYWSRGB-UHFFFAOYSA-N 0 0 378.307 3.096 20 5 GGBDRN O=C(Cc1cccc(OCC(F)(F)F)c1)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000161383739 1424683957 /nfs/dbraw/zinc/68/39/57/1424683957.db2.gz GDRQFGWTHKERCX-UHFFFAOYSA-N 0 0 397.353 3.307 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H](Nc2c(Br)cncc2[N+](=O)[O-])C1 ZINC000161392728 1424684763 /nfs/dbraw/zinc/68/47/63/1424684763.db2.gz FJRQCZCJHUVPAI-VIFPVBQESA-N 0 0 387.234 3.174 20 5 GGBDRN COc1cc(CCC(=O)NCCNc2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000161410457 1424686304 /nfs/dbraw/zinc/68/63/04/1424686304.db2.gz HTPKGTBDMXABIW-UHFFFAOYSA-N 0 0 377.828 3.418 20 5 GGBDRN CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000161454310 1424691896 /nfs/dbraw/zinc/69/18/96/1424691896.db2.gz QUBXMFFKGCIELW-MRXNPFEDSA-N 0 0 379.848 3.483 20 5 GGBDRN O=C(Nc1cccc(C(F)(F)F)n1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000161472977 1424693174 /nfs/dbraw/zinc/69/31/74/1424693174.db2.gz SAEOFRUYHSCSGO-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN COc1cc(Cl)c(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1OC ZINC000161483218 1424694778 /nfs/dbraw/zinc/69/47/78/1424694778.db2.gz KFLKJHPMZHAKCP-UHFFFAOYSA-N 0 0 376.796 3.464 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2n[nH]c(-c3ccc(C)o3)c2C)cc([N+](=O)[O-])c1 ZINC000161500860 1424697053 /nfs/dbraw/zinc/69/70/53/1424697053.db2.gz FBSUSAMSYDBNHL-UHFFFAOYSA-N 0 0 384.348 3.234 20 5 GGBDRN O=C(NCc1ccc(COC2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000161500222 1424697114 /nfs/dbraw/zinc/69/71/14/1424697114.db2.gz NFHXCIAKXSDKCH-UHFFFAOYSA-N 0 0 388.395 3.360 20 5 GGBDRN CC[N@@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cccc([N+](=O)[O-])c1[O-] ZINC000161564596 1424712618 /nfs/dbraw/zinc/71/26/18/1424712618.db2.gz GKGXWWDGBFJBJW-INIZCTEOSA-N 0 0 399.447 3.133 20 5 GGBDRN COc1ccc(CNC(=O)NCc2cc([N+](=O)[O-])ccc2OC)cc1Cl ZINC000161595548 1424720655 /nfs/dbraw/zinc/72/06/55/1424720655.db2.gz WWUJKWPJEWYGLI-UHFFFAOYSA-N 0 0 379.800 3.265 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCc2c(F)cc(F)cc2C1 ZINC000161598958 1424721335 /nfs/dbraw/zinc/72/13/35/1424721335.db2.gz NOWZYKVBXVTIAC-UHFFFAOYSA-N 0 0 377.347 3.150 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000161622010 1424726634 /nfs/dbraw/zinc/72/66/34/1424726634.db2.gz OYFPECPEMKNFFC-CYBMUJFWSA-N 0 0 388.323 3.060 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000161628230 1424728230 /nfs/dbraw/zinc/72/82/30/1424728230.db2.gz QRDVZKIQJWXBST-INIZCTEOSA-N 0 0 396.321 3.307 20 5 GGBDRN C[C@H]1CCN(C)c2ccccc2N1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000180135703 1429752671 /nfs/dbraw/zinc/75/26/71/1429752671.db2.gz OFLCORYEKDDYOB-HNNXBMFYSA-N 0 0 389.477 3.202 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000161652127 1424733280 /nfs/dbraw/zinc/73/32/80/1424733280.db2.gz AGKFPGJCKARXRB-QRWLVFNGSA-N 0 0 383.448 3.437 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000161653280 1424733507 /nfs/dbraw/zinc/73/35/07/1424733507.db2.gz OLNFGVNLTHXWTL-MRXNPFEDSA-N 0 0 396.321 3.307 20 5 GGBDRN COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1cccc([N+](=O)[O-])c1C ZINC000161662735 1424734913 /nfs/dbraw/zinc/73/49/13/1424734913.db2.gz NZAGQRCKGBIHIH-MRXNPFEDSA-N 0 0 396.321 3.307 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@@H](O)c1ccc(F)cc1 ZINC000161666039 1424735548 /nfs/dbraw/zinc/73/55/48/1424735548.db2.gz PGGYRGLTBZGOEY-BJOHPYRUSA-N 0 0 397.200 3.348 20 5 GGBDRN COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000161690884 1424741489 /nfs/dbraw/zinc/74/14/89/1424741489.db2.gz QRQKSZDLXAAEFC-UHFFFAOYSA-N 0 0 394.387 3.436 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1coc(-c2c(F)cccc2F)n1 ZINC000161705224 1424746070 /nfs/dbraw/zinc/74/60/70/1424746070.db2.gz KLMLEXYXRGRKDM-UHFFFAOYSA-N 0 0 384.298 3.286 20 5 GGBDRN Cc1nc(N2CCOCC2)ccc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000161712683 1424748399 /nfs/dbraw/zinc/74/83/99/1424748399.db2.gz IGBPYRVTTOVWNL-UHFFFAOYSA-N 0 0 376.800 3.041 20 5 GGBDRN O=C(Nc1cncc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000180130529 1429750621 /nfs/dbraw/zinc/75/06/21/1429750621.db2.gz PWSDZKCIWHSIPY-UHFFFAOYSA-N 0 0 397.218 3.386 20 5 GGBDRN Cc1cc(NC(=O)CCn2c(=O)oc3ccccc32)c2cc([N+](=O)[O-])ccc2n1 ZINC000161803214 1424768776 /nfs/dbraw/zinc/76/87/76/1424768776.db2.gz JCFCUQZPVSFMOR-UHFFFAOYSA-N 0 0 392.371 3.388 20 5 GGBDRN Cc1cc(NC(=O)c2cccc(S(C)(=O)=O)c2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161848272 1424778664 /nfs/dbraw/zinc/77/86/64/1424778664.db2.gz RORSXHQCCJFLNF-UHFFFAOYSA-N 0 0 385.401 3.107 20 5 GGBDRN Cc1cc(NC(=O)CCCNC(=O)c2ccco2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161848598 1424779210 /nfs/dbraw/zinc/77/92/10/1424779210.db2.gz RELNBZADQBWMQH-UHFFFAOYSA-N 0 0 382.376 3.193 20 5 GGBDRN C[C@@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1nc2ccccc2n1C ZINC000161854370 1424779785 /nfs/dbraw/zinc/77/97/85/1424779785.db2.gz ZGOSQEPKABXZSH-CYBMUJFWSA-N 0 0 390.403 3.158 20 5 GGBDRN Cc1c(CC(=O)NCc2ccc(N3CCC(C)CC3)nc2)cccc1[N+](=O)[O-] ZINC000161856909 1424781133 /nfs/dbraw/zinc/78/11/33/1424781133.db2.gz NJCTTXNLTVCTBA-UHFFFAOYSA-N 0 0 382.464 3.393 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccc(F)cc2Cl)CC1 ZINC000161878412 1424785660 /nfs/dbraw/zinc/78/56/60/1424785660.db2.gz ULQTVODNXQDPOP-UHFFFAOYSA-N 0 0 393.802 3.358 20 5 GGBDRN CC[C@H](C)NC(=O)c1cccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000161883074 1424787171 /nfs/dbraw/zinc/78/71/71/1424787171.db2.gz CXKQPHXXTHPOJB-AWEZNQCLSA-N 0 0 383.448 3.290 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000161899648 1424790807 /nfs/dbraw/zinc/79/08/07/1424790807.db2.gz FATYSTXCTZXGSP-SFHVURJKSA-N 0 0 396.403 3.497 20 5 GGBDRN CCN(Cc1c(F)cccc1F)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000161908189 1424793450 /nfs/dbraw/zinc/79/34/50/1424793450.db2.gz ZCBPSUSDQDZOOX-UHFFFAOYSA-N 0 0 384.404 3.267 20 5 GGBDRN CCOCCCNC(=O)c1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000161949597 1424801909 /nfs/dbraw/zinc/80/19/09/1424801909.db2.gz AESREKKGEXZJDF-UHFFFAOYSA-N 0 0 399.447 3.241 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2ccc(F)cc2Cl)CC1 ZINC000161948464 1424802014 /nfs/dbraw/zinc/80/20/14/1424802014.db2.gz MOXSSQFVCDJMIX-UHFFFAOYSA-N 0 0 377.803 3.279 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)o1 ZINC000161964392 1424803730 /nfs/dbraw/zinc/80/37/30/1424803730.db2.gz HGXUCGCWGZHLLA-QGZVFWFLSA-N 0 0 396.403 3.497 20 5 GGBDRN C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161983462 1424805919 /nfs/dbraw/zinc/80/59/19/1424805919.db2.gz ZKEWYDGJZRKQJV-ZDUSSCGKSA-N 0 0 377.441 3.377 20 5 GGBDRN CCOC(=O)CC[C@H]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000162004372 1424807917 /nfs/dbraw/zinc/80/79/17/1424807917.db2.gz BSZKZHDTZNPGCN-CQSZACIVSA-N 0 0 388.424 3.200 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)o1 ZINC000162014937 1424808822 /nfs/dbraw/zinc/80/88/22/1424808822.db2.gz FCWYGSJCCZOKNE-GOSISDBHSA-N 0 0 396.403 3.497 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](O)c1ccc(F)cc1 ZINC000162019655 1424809318 /nfs/dbraw/zinc/80/93/18/1424809318.db2.gz NZRAUWGSYNSHIJ-BBATYDOGSA-N 0 0 396.802 3.395 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000162031233 1424810613 /nfs/dbraw/zinc/81/06/13/1424810613.db2.gz HFBFVTQVBZWRSV-GOSISDBHSA-N 0 0 396.403 3.497 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000162089639 1424815135 /nfs/dbraw/zinc/81/51/35/1424815135.db2.gz FHXDEVQJWXZKNX-GOSISDBHSA-N 0 0 390.461 3.313 20 5 GGBDRN COc1ccc(Cn2cc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)cn2)cc1 ZINC000162146847 1424819885 /nfs/dbraw/zinc/81/98/85/1424819885.db2.gz GBWPNRQYYXLVBR-UHFFFAOYSA-N 0 0 392.415 3.441 20 5 GGBDRN CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162145932 1424820159 /nfs/dbraw/zinc/82/01/59/1424820159.db2.gz QAAMWTMMVOZDQT-LBWZGELYSA-N 0 0 389.477 3.132 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnc(N(C)C)nc1 ZINC000162151421 1424820426 /nfs/dbraw/zinc/82/04/26/1424820426.db2.gz GDHOXBWUBMWJBX-UHFFFAOYSA-N 0 0 375.454 3.451 20 5 GGBDRN O=C(COc1ccc(N2CCCC2=O)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162158710 1424820913 /nfs/dbraw/zinc/82/09/13/1424820913.db2.gz BBQLKVQPJGAAQD-UHFFFAOYSA-N 0 0 395.415 3.080 20 5 GGBDRN COc1ccc(N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c(OC)c1 ZINC000162165607 1424821778 /nfs/dbraw/zinc/82/17/78/1424821778.db2.gz WENZMIWOEGWENT-UHFFFAOYSA-N 0 0 382.376 3.074 20 5 GGBDRN CC[C@H](OC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(OC)c1 ZINC000162205341 1424826335 /nfs/dbraw/zinc/82/63/35/1424826335.db2.gz FVKCVYFQURCCQU-INIZCTEOSA-N 0 0 386.360 3.206 20 5 GGBDRN CCOc1ccc(-c2noc(CSCCn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000162222536 1424827564 /nfs/dbraw/zinc/82/75/64/1424827564.db2.gz GVSDFJYECOAEPA-UHFFFAOYSA-N 0 0 375.410 3.173 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C(C)C)N1CCOCC1 ZINC000180142254 1429756373 /nfs/dbraw/zinc/75/63/73/1429756373.db2.gz JSTILOGKUDKBAE-KRWDZBQOSA-N 0 0 395.525 3.182 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162226686 1424828586 /nfs/dbraw/zinc/82/85/86/1424828586.db2.gz PRYVDIVWKATAKJ-FQEVSTJZSA-N 0 0 393.443 3.108 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1[N+](=O)[O-] ZINC000162244182 1424830184 /nfs/dbraw/zinc/83/01/84/1424830184.db2.gz JVDBCENNKXBVAX-UHFFFAOYSA-N 0 0 386.320 3.313 20 5 GGBDRN O=C(c1cccc(CN2CCCC2=O)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162251935 1424831052 /nfs/dbraw/zinc/83/10/52/1424831052.db2.gz VUIBDZCIZUXMQD-UHFFFAOYSA-N 0 0 379.416 3.310 20 5 GGBDRN C=C1c2ccccc2C(=O)N1CCC(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162254803 1424831589 /nfs/dbraw/zinc/83/15/89/1424831589.db2.gz NAGRIQNVVQZLLU-UHFFFAOYSA-N 0 0 377.400 3.391 20 5 GGBDRN CC(C)(C)c1csc(CCNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])n1 ZINC000162261062 1424832202 /nfs/dbraw/zinc/83/22/02/1424832202.db2.gz BITTZYWEYVLEPT-UHFFFAOYSA-N 0 0 397.522 3.053 20 5 GGBDRN CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162271480 1424832985 /nfs/dbraw/zinc/83/29/85/1424832985.db2.gz IGPGUAUHGZXICS-SFHVURJKSA-N 0 0 395.459 3.402 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(OCC(F)F)nc1 ZINC000162287011 1424834675 /nfs/dbraw/zinc/83/46/75/1424834675.db2.gz FHHUPWOERDRCTM-UHFFFAOYSA-N 0 0 389.318 3.276 20 5 GGBDRN Cc1c(CC(=O)NCc2cccc(NC(=O)N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000162312973 1424836765 /nfs/dbraw/zinc/83/67/65/1424836765.db2.gz YODIVSIWVIJCOY-UHFFFAOYSA-N 0 0 396.447 3.390 20 5 GGBDRN CN(C)c1nnc(-c2ccc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)cc2)o1 ZINC000162370787 1424843393 /nfs/dbraw/zinc/84/33/93/1424843393.db2.gz SCLVRIWJZTUZPJ-UHFFFAOYSA-N 0 0 396.407 3.075 20 5 GGBDRN COc1ccc(-c2noc([C@@H](C)SCCn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000162394516 1424845958 /nfs/dbraw/zinc/84/59/58/1424845958.db2.gz PHLIQEGQVYJJAD-LLVKDONJSA-N 0 0 375.410 3.344 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(N3CCOCC3)nc2C)cc1[N+](=O)[O-] ZINC000162413604 1424848241 /nfs/dbraw/zinc/84/82/41/1424848241.db2.gz UXKQDHJDDZKCPW-AWEZNQCLSA-N 0 0 399.451 3.326 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCS[C@@H]2COCC[C@H]21 ZINC000162422896 1424849750 /nfs/dbraw/zinc/84/97/50/1424849750.db2.gz JWQNPOZZMAEPCP-HUUCEWRRSA-N 0 0 391.474 3.065 20 5 GGBDRN COc1cc(CNc2nc(C)nn2C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000162438371 1424851732 /nfs/dbraw/zinc/85/17/32/1424851732.db2.gz BOOSXTVSWIVOSU-UHFFFAOYSA-N 0 0 383.408 3.231 20 5 GGBDRN CC1CCN(c2ccc(C(=O)Nc3nnc4n3CCCC4)cc2[N+](=O)[O-])CC1 ZINC000162463693 1424855745 /nfs/dbraw/zinc/85/57/45/1424855745.db2.gz JMMRMRZVZABHSL-UHFFFAOYSA-N 0 0 384.440 3.011 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NCCc1cccc(OCc2ccccc2)c1 ZINC000162470861 1424856152 /nfs/dbraw/zinc/85/61/52/1424856152.db2.gz JFYKZAUHDMFNSQ-UHFFFAOYSA-N 0 0 394.431 3.119 20 5 GGBDRN CC(C)OC(=O)[C@@H](C)N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000162519283 1424861369 /nfs/dbraw/zinc/86/13/69/1424861369.db2.gz SEGBLJUYXMUKBH-LLVKDONJSA-N 0 0 377.422 3.130 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000162530589 1424862938 /nfs/dbraw/zinc/86/29/38/1424862938.db2.gz SJBXAYOVQBTSFE-HUUCEWRRSA-N 0 0 376.457 3.452 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)o1 ZINC000162530530 1424863109 /nfs/dbraw/zinc/86/31/09/1424863109.db2.gz IUHVXDVCKJXYJX-INIZCTEOSA-N 0 0 394.449 3.477 20 5 GGBDRN Cc1cccc(C(=O)N(C)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1F ZINC000162539537 1424864089 /nfs/dbraw/zinc/86/40/89/1424864089.db2.gz LVHSGALPENMQCU-UHFFFAOYSA-N 0 0 386.788 3.157 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])o1 ZINC000162550096 1424865004 /nfs/dbraw/zinc/86/50/04/1424865004.db2.gz CYAQFHBKWQOZNA-AWEZNQCLSA-N 0 0 380.422 3.168 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)CCc2ccccc2[N+](=O)[O-])o1 ZINC000162574053 1424867582 /nfs/dbraw/zinc/86/75/82/1424867582.db2.gz GDYBDAXOORFNBX-KRWDZBQOSA-N 0 0 394.449 3.044 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2nnc(-c3ccccc3)s2)c1[N+](=O)[O-] ZINC000162578079 1424868180 /nfs/dbraw/zinc/86/81/80/1424868180.db2.gz IKVOMGQSRAOJCW-UHFFFAOYSA-N 0 0 385.405 3.297 20 5 GGBDRN O=C(O[C@H]([C@H]1CCCO1)C(F)(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000162582248 1424868638 /nfs/dbraw/zinc/86/86/38/1424868638.db2.gz OSXFNDMAHDSMJP-ZIAGYGMSSA-N 0 0 385.298 3.047 20 5 GGBDRN O=C(O[C@@H]([C@@H]1CCCO1)C(F)(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000162581870 1424868651 /nfs/dbraw/zinc/86/86/51/1424868651.db2.gz OSXFNDMAHDSMJP-KBPBESRZSA-N 0 0 385.298 3.047 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)cccc1C(F)(F)F ZINC000162589228 1424869788 /nfs/dbraw/zinc/86/97/88/1424869788.db2.gz OMSWQBOCKPUNHF-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN CNC(=O)Cc1noc(-c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n1 ZINC000162640078 1424874368 /nfs/dbraw/zinc/87/43/68/1424874368.db2.gz AZIFVWFHIHFMKY-UHFFFAOYSA-N 0 0 388.767 3.379 20 5 GGBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCS[C@H]2COCC[C@H]21 ZINC000162649501 1424874924 /nfs/dbraw/zinc/87/49/24/1424874924.db2.gz RRCSHVOSVROZEC-CABCVRRESA-N 0 0 391.474 3.065 20 5 GGBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCS[C@@H]2COCC[C@@H]21 ZINC000162649389 1424874980 /nfs/dbraw/zinc/87/49/80/1424874980.db2.gz RRCSHVOSVROZEC-LSDHHAIUSA-N 0 0 391.474 3.065 20 5 GGBDRN COc1ccccc1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000162673715 1424877985 /nfs/dbraw/zinc/87/79/85/1424877985.db2.gz FGIROTSBXYQKNB-UHFFFAOYSA-N 0 0 377.296 3.390 20 5 GGBDRN COc1cccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000162691135 1424881066 /nfs/dbraw/zinc/88/10/66/1424881066.db2.gz NVBLSFXFGDSLGW-UHFFFAOYSA-N 0 0 377.296 3.390 20 5 GGBDRN O=C(Nc1ccc(C(F)(F)F)nc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000162713342 1424884195 /nfs/dbraw/zinc/88/41/95/1424884195.db2.gz XQAFIBQPIRSIAY-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(CC(F)(F)F)[C@@H](C)C1 ZINC000162739101 1424886935 /nfs/dbraw/zinc/88/69/35/1424886935.db2.gz HJVZBFBWJAKGKZ-NSHDSACASA-N 0 0 391.415 3.415 20 5 GGBDRN CS[C@H](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000162779774 1424889717 /nfs/dbraw/zinc/88/97/17/1424889717.db2.gz JQLKUIZIGRMIRX-LLVKDONJSA-N 0 0 391.415 3.404 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)n1ccc(=NCC(F)(F)F)cc1 ZINC000162805352 1424891963 /nfs/dbraw/zinc/89/19/63/1424891963.db2.gz KZYBCJGCNZZSAB-UHFFFAOYSA-N 0 0 378.310 3.224 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1ccc(OC2CCCC2)c(Cl)c1 ZINC000162806107 1424891972 /nfs/dbraw/zinc/89/19/72/1424891972.db2.gz BCTISBYMVNXYNV-UHFFFAOYSA-N 0 0 391.811 3.370 20 5 GGBDRN CC(C)C[C@H]1CCCCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000162809895 1424892453 /nfs/dbraw/zinc/89/24/53/1424892453.db2.gz LPFIUAJMDWBIDT-CQSZACIVSA-N 0 0 379.482 3.213 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)CN1CCOCC1 ZINC000162812010 1424893024 /nfs/dbraw/zinc/89/30/24/1424893024.db2.gz JNYDPPZZLOILLM-HNNXBMFYSA-N 0 0 395.525 3.041 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(C(=O)c2cccc(F)c2)CC1 ZINC000162813856 1424893033 /nfs/dbraw/zinc/89/30/33/1424893033.db2.gz OPCSJHIJUYBFLQ-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCNC(=O)c1ccccc1Cl ZINC000162840096 1424895710 /nfs/dbraw/zinc/89/57/10/1424895710.db2.gz FDUBVIJGAHMXPT-UHFFFAOYSA-N 0 0 376.800 3.108 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000162848654 1424896050 /nfs/dbraw/zinc/89/60/50/1424896050.db2.gz JGACMIZYWQZNLJ-GOSISDBHSA-N 0 0 377.400 3.273 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(CN2CCCC2=O)cc1 ZINC000162851717 1424896588 /nfs/dbraw/zinc/89/65/88/1424896588.db2.gz GABDRXZQUMVDDP-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN Cc1nc(NC(=O)c2c([N+](=O)[O-])cnn2C)sc1Cc1ccc(F)cc1 ZINC000162879658 1424898582 /nfs/dbraw/zinc/89/85/82/1424898582.db2.gz WQWQCSAMODEDSM-UHFFFAOYSA-N 0 0 375.385 3.075 20 5 GGBDRN Cc1cc(C)cc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000162885860 1424899584 /nfs/dbraw/zinc/89/95/84/1424899584.db2.gz UBYYLTJLXIIWOI-UHFFFAOYSA-N 0 0 379.319 3.390 20 5 GGBDRN Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000162896043 1424901476 /nfs/dbraw/zinc/90/14/76/1424901476.db2.gz SVDGTJSXTRTTEC-CHWSQXEVSA-N 0 0 399.451 3.007 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCOC[C@H]1C[C@@H](O)c1cccs1 ZINC000162923680 1424906681 /nfs/dbraw/zinc/90/66/81/1424906681.db2.gz WMCJJGKUFRCIRO-GDBMZVCRSA-N 0 0 391.449 3.321 20 5 GGBDRN CCCNC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC1 ZINC000180143452 1429758215 /nfs/dbraw/zinc/75/82/15/1429758215.db2.gz MQPCVCCSOPOEMZ-UHFFFAOYSA-N 0 0 393.509 3.474 20 5 GGBDRN CCC(C)(C)NC(=O)c1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1Cl ZINC000162954812 1424912820 /nfs/dbraw/zinc/91/28/20/1424912820.db2.gz WAWPGPYVQLYGSF-UHFFFAOYSA-N 0 0 393.831 3.152 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](c1ccccc1)N1CCOCC1 ZINC000162972585 1424916113 /nfs/dbraw/zinc/91/61/13/1424916113.db2.gz VKGNSKKWDBBMJT-IBGZPJMESA-N 0 0 384.436 3.098 20 5 GGBDRN CCCS(=O)(=O)Nc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000162999983 1424921023 /nfs/dbraw/zinc/92/10/23/1424921023.db2.gz DQFWPNHBOWWTAK-UHFFFAOYSA-N 0 0 391.449 3.236 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)S(=O)(=O)Cc1ncn(-c2ccccc2)n1 ZINC000180153011 1429765103 /nfs/dbraw/zinc/76/51/03/1429765103.db2.gz BDLGTFMUYRXOKB-AWEZNQCLSA-N 0 0 386.433 3.160 20 5 GGBDRN C[C@@H](c1ccncc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163068235 1424934579 /nfs/dbraw/zinc/93/45/79/1424934579.db2.gz JWSOSNUVUHJSFX-JTQLQIEISA-N 0 0 389.355 3.390 20 5 GGBDRN Cc1ccc(CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c(O[C@@H]2CCOC2)c1 ZINC000163081069 1424935941 /nfs/dbraw/zinc/93/59/41/1424935941.db2.gz BOXOLHGKDFFUPV-CYBMUJFWSA-N 0 0 392.358 3.279 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 ZINC000163138820 1424949338 /nfs/dbraw/zinc/94/93/38/1424949338.db2.gz VHTBEJLNMPOCDC-HKUYNNGSSA-N 0 0 385.420 3.260 20 5 GGBDRN C[C@](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)(C(N)=O)c1cccc(Cl)c1 ZINC000163150845 1424950104 /nfs/dbraw/zinc/95/01/04/1424950104.db2.gz ZKSPCFRVJQDBND-MRXNPFEDSA-N 0 0 382.203 3.032 20 5 GGBDRN Cc1c(CC(=O)N[C@@H](C)c2cccc(N3CCOC3=O)c2)cccc1[N+](=O)[O-] ZINC000163156736 1424950807 /nfs/dbraw/zinc/95/08/07/1424950807.db2.gz PIVYPOGSROSIHC-AWEZNQCLSA-N 0 0 383.404 3.280 20 5 GGBDRN 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ZINC000163187143 1424956115 /nfs/dbraw/zinc/95/61/15/1424956115.db2.gz DJJJLAUDIOACTF-UHFFFAOYSA-N 0 0 380.335 3.419 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000163192464 1424956594 /nfs/dbraw/zinc/95/65/94/1424956594.db2.gz QNGSRTCYXHURCW-LSDHHAIUSA-N 0 0 376.457 3.452 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 ZINC000163195792 1424957037 /nfs/dbraw/zinc/95/70/37/1424957037.db2.gz PJJYBSNRMOYRHN-LJQANCHMSA-N 0 0 396.447 3.258 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(CCc1ccccc1)c1ccccc1 ZINC000163198167 1424957564 /nfs/dbraw/zinc/95/75/64/1424957564.db2.gz OROWUJCFCBIASG-UHFFFAOYSA-N 0 0 377.400 3.032 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@](C)(C(N)=O)c2cccc(Cl)c2)c1 ZINC000163223334 1424962221 /nfs/dbraw/zinc/96/22/21/1424962221.db2.gz HBRNRIVQIJNDIN-QGZVFWFLSA-N 0 0 393.852 3.101 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000163236372 1424964618 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ZINC000163674372 1425032339 /nfs/dbraw/zinc/03/23/39/1425032339.db2.gz LSEGUXVSZBMFSQ-SANMLTNESA-N 0 0 375.450 3.304 20 5 GGBDRN O=C([C@H]1CC(=O)N(Cc2ccccc2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163748809 1425040234 /nfs/dbraw/zinc/04/02/34/1425040234.db2.gz KYEHJWAZYDRCLS-SFHVURJKSA-N 0 0 393.443 3.135 20 5 GGBDRN O=C([C@@H]1CC(=O)N(Cc2ccccc2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163748713 1425040442 /nfs/dbraw/zinc/04/04/42/1425040442.db2.gz KYEHJWAZYDRCLS-GOSISDBHSA-N 0 0 393.443 3.135 20 5 GGBDRN Cc1sc(=O)n(CCC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000163759664 1425041100 /nfs/dbraw/zinc/04/11/00/1425041100.db2.gz RUFSDEYFCNSVPD-UHFFFAOYSA-N 0 0 375.450 3.016 20 5 GGBDRN O=C(CCCNC(=O)c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163764375 1425041825 /nfs/dbraw/zinc/04/18/25/1425041825.db2.gz HJRMORUPCNOIAN-UHFFFAOYSA-N 0 0 381.432 3.296 20 5 GGBDRN O=C(c1cnn(-c2ccc(F)cc2)n1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163760062 1425041943 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SFDPXFFRTPUGLY-DYVFJYSZSA-N 0 0 378.450 3.002 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000163829091 1425049002 /nfs/dbraw/zinc/04/90/02/1425049002.db2.gz IQYWQNDPPSRXJD-UHFFFAOYSA-N 0 0 385.710 3.427 20 5 GGBDRN Cc1cnc([C@@H](NS(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)C2CC2)s1 ZINC000163867859 1425052220 /nfs/dbraw/zinc/05/22/20/1425052220.db2.gz SJBJAMPUTVGWSS-AWEZNQCLSA-N 0 0 385.442 3.237 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)sc1C ZINC000163866131 1425052581 /nfs/dbraw/zinc/05/25/81/1425052581.db2.gz GSDDSRIJJPFGJM-UHFFFAOYSA-N 0 0 387.458 3.329 20 5 GGBDRN C[C@H](CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)NC(=O)c1ccccc1 ZINC000163871498 1425052876 /nfs/dbraw/zinc/05/28/76/1425052876.db2.gz DQEPLOJOSUBIDP-OAHLLOKOSA-N 0 0 381.432 3.294 20 5 GGBDRN O=C(CNC(=O)OCc1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163875602 1425053047 /nfs/dbraw/zinc/05/30/47/1425053047.db2.gz CFHKXBZZWDWXCD-UHFFFAOYSA-N 0 0 383.404 3.012 20 5 GGBDRN 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O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F ZINC000171257625 1425576632 /nfs/dbraw/zinc/57/66/32/1425576632.db2.gz HZTSPCNENXLIAO-UHFFFAOYSA-N 0 0 385.273 3.008 20 5 GGBDRN COCCOc1ccc(F)cc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000171265528 1425582678 /nfs/dbraw/zinc/58/26/78/1425582678.db2.gz XKOFGQQGEKROEM-UHFFFAOYSA-N 0 0 377.372 3.423 20 5 GGBDRN COc1cc(CCNC(=O)c2cc(F)c(F)c(F)c2)c([N+](=O)[O-])cc1OC ZINC000171272099 1425587289 /nfs/dbraw/zinc/58/72/89/1425587289.db2.gz VIPKEBLQMBUEGN-UHFFFAOYSA-N 0 0 384.310 3.002 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)c(C)o1 ZINC000171291714 1425597885 /nfs/dbraw/zinc/59/78/85/1425597885.db2.gz BMBLFKBIDCCLOF-UHFFFAOYSA-N 0 0 385.420 3.148 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC2)c(C)o1 ZINC000171292391 1425598518 /nfs/dbraw/zinc/59/85/18/1425598518.db2.gz KBPBWYFEOSWVQQ-VMPITWQZSA-N 0 0 397.431 3.239 20 5 GGBDRN Cc1cc(C(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)cc([N+](=O)[O-])c1 ZINC000171298897 1425602279 /nfs/dbraw/zinc/60/22/79/1425602279.db2.gz QKNXHWNRLGTZKK-UHFFFAOYSA-N 0 0 383.404 3.296 20 5 GGBDRN Cc1cccc(N(C)C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000171299971 1425603250 /nfs/dbraw/zinc/60/32/50/1425603250.db2.gz FCIWOYPGLFSLCC-IBGZPJMESA-N 0 0 381.432 3.479 20 5 GGBDRN COc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(C)c1 ZINC000171305995 1425606719 /nfs/dbraw/zinc/60/67/19/1425606719.db2.gz VJTXLVOZLUNLAX-UHFFFAOYSA-N 0 0 385.376 3.239 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(C)c1 ZINC000171307855 1425606857 /nfs/dbraw/zinc/60/68/57/1425606857.db2.gz RBCPTAZEECFOJK-LBPRGKRZSA-N 0 0 387.367 3.043 20 5 GGBDRN CC(C)(C)c1ncc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cn1 ZINC000171317187 1425614444 /nfs/dbraw/zinc/61/44/44/1425614444.db2.gz KXUBUZVMKLOSTJ-UHFFFAOYSA-N 0 0 384.440 3.036 20 5 GGBDRN C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000171328074 1425619094 /nfs/dbraw/zinc/61/90/94/1425619094.db2.gz HUKMQMADDLTUOC-SNVBAGLBSA-N 0 0 376.315 3.008 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000171326524 1425619411 /nfs/dbraw/zinc/61/94/11/1425619411.db2.gz VEDHCNPVVLQCRI-LLVKDONJSA-N 0 0 383.832 3.235 20 5 GGBDRN Cc1nc2n(n1)C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)CC2 ZINC000171340342 1425626547 /nfs/dbraw/zinc/62/65/47/1425626547.db2.gz IPIOEZQPZURZCZ-CQSZACIVSA-N 0 0 393.403 3.032 20 5 GGBDRN COc1cc(C(=O)NCCCc2nc3c(s2)CCCC3)ccc1[N+](=O)[O-] ZINC000171347016 1425629749 /nfs/dbraw/zinc/62/97/49/1425629749.db2.gz MTQBQIWTSXWNAF-UHFFFAOYSA-N 0 0 375.450 3.301 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000171366192 1425643431 /nfs/dbraw/zinc/64/34/31/1425643431.db2.gz BLHHWGNQSKSTIN-UHFFFAOYSA-N 0 0 391.449 3.441 20 5 GGBDRN O=C(NCC(=O)Oc1cc(Cl)ccc1[N+](=O)[O-])NCc1ccc(Cl)cc1 ZINC000171372500 1425645983 /nfs/dbraw/zinc/64/59/83/1425645983.db2.gz YGGKSNKQBMGGED-UHFFFAOYSA-N 0 0 398.202 3.306 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@@H](c2ccccc2)[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000171372790 1425647036 /nfs/dbraw/zinc/64/70/36/1425647036.db2.gz SSBSLFNHRGOGAB-MSOLQXFVSA-N 0 0 376.434 3.331 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCCO2)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000171386843 1425654982 /nfs/dbraw/zinc/65/49/82/1425654982.db2.gz KOOFWMAOESUIOK-UHFFFAOYSA-N 0 0 382.420 3.274 20 5 GGBDRN O=C(NC[C@](O)(c1ccccc1)C(F)(F)F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000171395560 1425660793 /nfs/dbraw/zinc/66/07/93/1425660793.db2.gz VAYKSSOBWKISEO-HNNXBMFYSA-N 0 0 388.729 3.428 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cn2ccccc2n1 ZINC000171418495 1425670670 /nfs/dbraw/zinc/67/06/70/1425670670.db2.gz CYQUTBFRIRXLCH-UHFFFAOYSA-N 0 0 381.436 3.405 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)c2ccc(F)cc2C(F)(F)F)cc1 ZINC000171422006 1425671465 /nfs/dbraw/zinc/67/14/65/1425671465.db2.gz MMBGJJGWRMMRLZ-UHFFFAOYSA-N 0 0 392.330 3.274 20 5 GGBDRN COc1ccc(CN2C[C@@H](C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)CC2=O)cc1 ZINC000171423470 1425672050 /nfs/dbraw/zinc/67/20/50/1425672050.db2.gz LVWXQRLDXVBZMP-INIZCTEOSA-N 0 0 397.431 3.207 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](c2ccccc2)c2ccncc2)c(C)c1[N+](=O)[O-] ZINC000171423802 1425672142 /nfs/dbraw/zinc/67/21/42/1425672142.db2.gz ZXPMLQRXUZKZNF-IBGZPJMESA-N 0 0 379.420 3.099 20 5 GGBDRN Cc1cc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)n(-c2ccc(F)cc2)n1 ZINC000171426099 1425672929 /nfs/dbraw/zinc/67/29/29/1425672929.db2.gz MIBUYJNWGNDYOX-UHFFFAOYSA-N 0 0 386.387 3.070 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc3c(c2)CCO3)ccc1[N+](=O)[O-] ZINC000171429348 1425674549 /nfs/dbraw/zinc/67/45/49/1425674549.db2.gz NTGLCLBNULXSIE-SFHVURJKSA-N 0 0 395.415 3.081 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1 ZINC000171430589 1425675434 /nfs/dbraw/zinc/67/54/34/1425675434.db2.gz WCTBZVLUZZIASU-SFHVURJKSA-N 0 0 382.420 3.250 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000171434197 1425676989 /nfs/dbraw/zinc/67/69/89/1425676989.db2.gz VCUWDQRXHNBHFS-INIZCTEOSA-N 0 0 398.463 3.192 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(=O)N1CCc2ccccc21 ZINC000171438441 1425678945 /nfs/dbraw/zinc/67/89/45/1425678945.db2.gz MFMUEXXPNXFQDA-UHFFFAOYSA-N 0 0 396.447 3.104 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000171473368 1425694890 /nfs/dbraw/zinc/69/48/90/1425694890.db2.gz QOSWXPZSTJIMGG-MRXNPFEDSA-N 0 0 396.428 3.204 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](c2nccs2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000171472938 1425695128 /nfs/dbraw/zinc/69/51/28/1425695128.db2.gz IMHFURKWLGULPX-INIZCTEOSA-N 0 0 396.428 3.204 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](c2nccs2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000171472942 1425695207 /nfs/dbraw/zinc/69/52/07/1425695207.db2.gz IMHFURKWLGULPX-MRXNPFEDSA-N 0 0 396.428 3.204 20 5 GGBDRN O=C(CCC(=O)c1ccc(F)cc1)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000171484792 1425701010 /nfs/dbraw/zinc/70/10/10/1425701010.db2.gz CRTNTEBFOCAFCF-UHFFFAOYSA-N 0 0 383.339 3.121 20 5 GGBDRN O=C(CCCc1nc2ccccc2[nH]1)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000171484534 1425701232 /nfs/dbraw/zinc/70/12/32/1425701232.db2.gz NFMVSRMXBODKQK-UHFFFAOYSA-N 0 0 391.391 3.218 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(CC(=O)Nc1ccc(F)cc1)C(C)C ZINC000171489678 1425703116 /nfs/dbraw/zinc/70/31/16/1425703116.db2.gz LGRQDZQYMXPBIB-UHFFFAOYSA-N 0 0 389.383 3.232 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](c2nccs2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000171495262 1425704436 /nfs/dbraw/zinc/70/44/36/1425704436.db2.gz SKCZURKOGYARGA-GOSISDBHSA-N 0 0 399.428 3.345 20 5 GGBDRN C[C@@H]1c2ccccc2CCN1C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000171510410 1425709523 /nfs/dbraw/zinc/70/95/23/1425709523.db2.gz CKYWVJBVOFEPQD-UKRRQHHQSA-N 0 0 397.406 3.233 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000171521350 1425712809 /nfs/dbraw/zinc/71/28/09/1425712809.db2.gz OITUFCKDXXOSJX-AWEZNQCLSA-N 0 0 377.441 3.232 20 5 GGBDRN COc1cc(CCNC(=O)Cc2c[nH]c3cccc(C)c23)c([N+](=O)[O-])cc1OC ZINC000171523578 1425715162 /nfs/dbraw/zinc/71/51/62/1425715162.db2.gz KJVQKDIAKAHFSC-UHFFFAOYSA-N 0 0 397.431 3.303 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000171523266 1425715345 /nfs/dbraw/zinc/71/53/45/1425715345.db2.gz ZWDYFZZETLRTQW-CQSZACIVSA-N 0 0 377.441 3.232 20 5 GGBDRN O=C(NC[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])s1)Nc1ccccc1 ZINC000171535473 1425721778 /nfs/dbraw/zinc/72/17/78/1425721778.db2.gz NXVAGRNIIMYVOK-AWEZNQCLSA-N 0 0 388.449 3.473 20 5 GGBDRN CN(C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000171563585 1425738026 /nfs/dbraw/zinc/73/80/26/1425738026.db2.gz ZGRANDQOLIAWEN-LBPRGKRZSA-N 0 0 380.401 3.196 20 5 GGBDRN CC(C)(C)c1csc(CCNC(=O)CCOc2ccccc2[N+](=O)[O-])n1 ZINC000171578522 1425743688 /nfs/dbraw/zinc/74/36/88/1425743688.db2.gz VRDHHEMLVXRMTI-UHFFFAOYSA-N 0 0 377.466 3.477 20 5 GGBDRN O=C(NC[C@H](O)c1cccc(F)c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000171583910 1425744635 /nfs/dbraw/zinc/74/46/35/1425744635.db2.gz RTXOBYNUXAHBRI-ZDUSSCGKSA-N 0 0 385.298 3.190 20 5 GGBDRN C[C@H](c1ccc(F)cc1F)N1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000171585317 1425745141 /nfs/dbraw/zinc/74/51/41/1425745141.db2.gz DWLSEELMVYEFQU-LLVKDONJSA-N 0 0 381.404 3.454 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)c1 ZINC000171586002 1425746122 /nfs/dbraw/zinc/74/61/22/1425746122.db2.gz NVWAKOQMMWUVDO-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000171590125 1425750886 /nfs/dbraw/zinc/75/08/86/1425750886.db2.gz YMPBHLBZZUYPFY-MRXNPFEDSA-N 0 0 383.448 3.051 20 5 GGBDRN COc1ccc([C@H]2Nc3ccccc3C(=O)N2C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000171603754 1425756661 /nfs/dbraw/zinc/75/66/61/1425756661.db2.gz SEXUXRSBHYMWFR-KUHUBIRLSA-N 0 0 383.404 3.349 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000171630029 1425765069 /nfs/dbraw/zinc/76/50/69/1425765069.db2.gz YCBYJJREQLDZDC-GFCCVEGCSA-N 0 0 383.832 3.378 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1CSCN1C(=O)C(C)(C)C ZINC000171629914 1425765091 /nfs/dbraw/zinc/76/50/91/1425765091.db2.gz YOZXXPOXRUANIR-CQSZACIVSA-N 0 0 399.900 3.154 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCCO2 ZINC000171635129 1425767236 /nfs/dbraw/zinc/76/72/36/1425767236.db2.gz PNRODCQEZDHTOS-UHFFFAOYSA-N 0 0 380.360 3.194 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)Oc1cc(F)ccc1F ZINC000171634529 1425767538 /nfs/dbraw/zinc/76/75/38/1425767538.db2.gz PUQKEPUURJKTMT-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000171657893 1425777875 /nfs/dbraw/zinc/77/78/75/1425777875.db2.gz WAIAAXLELJZUTM-OAHLLOKOSA-N 0 0 383.326 3.146 20 5 GGBDRN CCc1n[nH]c(C(=O)N(Cc2cccnc2)Cc2ccccc2C)c1[N+](=O)[O-] ZINC000171677336 1425786632 /nfs/dbraw/zinc/78/66/32/1425786632.db2.gz OWTFSBKSRDGGCN-UHFFFAOYSA-N 0 0 379.420 3.426 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)C1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000171677440 1425786653 /nfs/dbraw/zinc/78/66/53/1425786653.db2.gz GCKZPFZFAYWHKQ-LLVKDONJSA-N 0 0 395.485 3.434 20 5 GGBDRN COc1cc(CCNc2cc(N3CCCCC3)ncn2)c([N+](=O)[O-])cc1OC ZINC000171684007 1425788446 /nfs/dbraw/zinc/78/84/46/1425788446.db2.gz WKFKDFRRMRQABE-UHFFFAOYSA-N 0 0 387.440 3.047 20 5 GGBDRN O=C(NC(C1CC1)C1CC1)c1ccc(I)c([N+](=O)[O-])c1 ZINC000171693964 1425791699 /nfs/dbraw/zinc/79/16/99/1425791699.db2.gz OWZSCBYURIJIEL-UHFFFAOYSA-N 0 0 386.189 3.118 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Oc1c(Cl)cc(Br)cc1Cl ZINC000171701686 1425793596 /nfs/dbraw/zinc/79/35/96/1425793596.db2.gz XOMUGLSMWYGPGH-UHFFFAOYSA-N 0 0 394.996 3.466 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000171713338 1425800406 /nfs/dbraw/zinc/80/04/06/1425800406.db2.gz AXYYYMMXQVCZGK-MRXNPFEDSA-N 0 0 389.458 3.428 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000171713608 1425800467 /nfs/dbraw/zinc/80/04/67/1425800467.db2.gz AUSYTOCEROGGHK-MRXNPFEDSA-N 0 0 389.458 3.428 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2nccs2)c2ccccc2)cc1[N+](=O)[O-] ZINC000171713478 1425800574 /nfs/dbraw/zinc/80/05/74/1425800574.db2.gz OWBOSHDMTDALDI-MRXNPFEDSA-N 0 0 389.458 3.428 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](c2nccs2)c2ccccc2)cc1[N+](=O)[O-] ZINC000171713477 1425800649 /nfs/dbraw/zinc/80/06/49/1425800649.db2.gz OWBOSHDMTDALDI-INIZCTEOSA-N 0 0 389.458 3.428 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(Cc1ccccc1F)C1CCCCC1 ZINC000171747574 1425810345 /nfs/dbraw/zinc/81/03/45/1425810345.db2.gz RLBJVNFJIJVKOW-UHFFFAOYSA-N 0 0 387.411 3.257 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](c2ccccc2)c2cccnc2)c(F)c1 ZINC000171768913 1425815723 /nfs/dbraw/zinc/81/57/23/1425815723.db2.gz YZFTVPBABZSCHD-GOSISDBHSA-N 0 0 387.392 3.197 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCC(c2ccccc2)CC1 ZINC000171771995 1425816468 /nfs/dbraw/zinc/81/64/68/1425816468.db2.gz GGFFYSUHEYUQMV-UHFFFAOYSA-N 0 0 377.400 3.456 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000171774972 1425817703 /nfs/dbraw/zinc/81/77/03/1425817703.db2.gz KZNVEWHNNBUVJG-KRWDZBQOSA-N 0 0 390.823 3.495 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cc2c([nH]c1=O)CCCC2 ZINC000171790065 1425821510 /nfs/dbraw/zinc/82/15/10/1425821510.db2.gz OQNCCAHDSORAIK-UHFFFAOYSA-N 0 0 375.812 3.088 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ncc(Cc3ccccc3F)s2)c1[N+](=O)[O-] ZINC000171803905 1425825088 /nfs/dbraw/zinc/82/50/88/1425825088.db2.gz YHYXEYVBEJWWJV-UHFFFAOYSA-N 0 0 375.385 3.319 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)c1[N+](=O)[O-] ZINC000171806726 1425825429 /nfs/dbraw/zinc/82/54/29/1425825429.db2.gz JMIDMAUNVYHABG-UHFFFAOYSA-N 0 0 385.405 3.446 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000171807802 1425825897 /nfs/dbraw/zinc/82/58/97/1425825897.db2.gz QIKWBLKSHZHOSY-ZDUSSCGKSA-N 0 0 399.234 3.401 20 5 GGBDRN CC(=O)Nc1ccc(CNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])cc1 ZINC000171813322 1425827263 /nfs/dbraw/zinc/82/72/63/1425827263.db2.gz VDMLBEJIIKLOIM-UHFFFAOYSA-N 0 0 399.375 3.162 20 5 GGBDRN O=C(N[C@H]1CCN(CC(F)(F)F)C1=O)c1cc2ccccc2c2cccnc12 ZINC000171816361 1425827869 /nfs/dbraw/zinc/82/78/69/1425827869.db2.gz FPMVTXHCSOOJPT-INIZCTEOSA-N 0 0 387.361 3.281 20 5 GGBDRN O=C(NCC[S@@](=O)Cc1ccccc1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000171827646 1425830288 /nfs/dbraw/zinc/83/02/88/1425830288.db2.gz FFAROWQGQCQODL-AREMUKBSSA-N 0 0 388.470 3.488 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000171826678 1425830410 /nfs/dbraw/zinc/83/04/10/1425830410.db2.gz COSCIOSRJRJFIX-KRWDZBQOSA-N 0 0 392.843 3.120 20 5 GGBDRN CN(C(=O)CN1CCC(COc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000171830254 1425830698 /nfs/dbraw/zinc/83/06/98/1425830698.db2.gz GNMQUYBWJLDOAF-UHFFFAOYSA-N 0 0 383.448 3.349 20 5 GGBDRN O=C(Nc1ccc(N2CCCS2(=O)=O)cc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000171832617 1425831110 /nfs/dbraw/zinc/83/11/10/1425831110.db2.gz UTDZIROFMCACPW-UHFFFAOYSA-N 0 0 395.824 3.040 20 5 GGBDRN O=C(NCCCC1CCCC1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171835573 1425832211 /nfs/dbraw/zinc/83/22/11/1425832211.db2.gz FYJNJFPBSYSEBU-AWEZNQCLSA-N 0 0 379.482 3.348 20 5 GGBDRN C[C@H](NC(=O)NCCCC(=O)N1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000171838356 1425832304 /nfs/dbraw/zinc/83/23/04/1425832304.db2.gz IRCJGLOTDDJFPU-HNNXBMFYSA-N 0 0 396.447 3.278 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1ccc(Cl)cc1Cl ZINC000171841849 1425833355 /nfs/dbraw/zinc/83/33/55/1425833355.db2.gz INKQWNJAZAFSDK-HNNXBMFYSA-N 0 0 384.219 3.434 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C1(c2ccc(C)cc2)CCOCC1 ZINC000171852645 1425835551 /nfs/dbraw/zinc/83/55/51/1425835551.db2.gz XYWFGXJPISYEQA-UHFFFAOYSA-N 0 0 384.432 3.276 20 5 GGBDRN O=C(NC1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1)c1ccsc1 ZINC000171855674 1425836247 /nfs/dbraw/zinc/83/62/47/1425836247.db2.gz YEBWOBYSTILUMK-UHFFFAOYSA-N 0 0 393.852 3.344 20 5 GGBDRN Cc1cccc(C)c1OC[C@H](C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171866301 1425838529 /nfs/dbraw/zinc/83/85/29/1425838529.db2.gz FNDYDQZWBOCXTH-AWEZNQCLSA-N 0 0 395.415 3.250 20 5 GGBDRN C[C@@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)COCc1ccccc1 ZINC000171865767 1425838565 /nfs/dbraw/zinc/83/85/65/1425838565.db2.gz TVKMGNKVRPJUOH-AWEZNQCLSA-N 0 0 395.415 3.019 20 5 GGBDRN Cc1cccc(C)c1OC[C@@H](C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171866299 1425838648 /nfs/dbraw/zinc/83/86/48/1425838648.db2.gz FNDYDQZWBOCXTH-CQSZACIVSA-N 0 0 395.415 3.250 20 5 GGBDRN O=C(NCCCc1cccc(Cl)c1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171867679 1425839176 /nfs/dbraw/zinc/83/91/76/1425839176.db2.gz OONYAOGXQCKNPO-UHFFFAOYSA-N 0 0 385.807 3.452 20 5 GGBDRN COCc1cccc(OC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1 ZINC000171877881 1425841239 /nfs/dbraw/zinc/84/12/39/1425841239.db2.gz NQDACFNTYFYZJE-UHFFFAOYSA-N 0 0 386.360 3.035 20 5 GGBDRN CC(C)S(=O)(=O)Cc1cccc(NC(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000171921003 1425853283 /nfs/dbraw/zinc/85/32/83/1425853283.db2.gz OICXQDXGAWTMGM-UHFFFAOYSA-N 0 0 391.449 3.240 20 5 GGBDRN COc1ccc(CN(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)cc1[N+](=O)[O-] ZINC000171923808 1425853822 /nfs/dbraw/zinc/85/38/22/1425853822.db2.gz GAUCWZWLNSIKNW-MRXNPFEDSA-N 0 0 389.839 3.494 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NC[C@@](O)(c3ccccc3)C(F)(F)F)cc2N1 ZINC000171940983 1425857544 /nfs/dbraw/zinc/85/75/44/1425857544.db2.gz RRBDDLXGWQRVON-QGZVFWFLSA-N 0 0 395.337 3.342 20 5 GGBDRN COC(=O)[C@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c2ccccc21 ZINC000171938660 1425857550 /nfs/dbraw/zinc/85/75/50/1425857550.db2.gz IMAHVSCLEXURHK-HNNXBMFYSA-N 0 0 381.388 3.086 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(-n2nc(C)cc2C)c(F)c1 ZINC000171939822 1425857648 /nfs/dbraw/zinc/85/76/48/1425857648.db2.gz RKELAZCHJVHGLX-UHFFFAOYSA-N 0 0 398.394 3.475 20 5 GGBDRN Cc1ccccc1[C@@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C(C)C ZINC000171949199 1425859897 /nfs/dbraw/zinc/85/98/97/1425859897.db2.gz RQFMEDQGGDLIEE-SFHVURJKSA-N 0 0 390.461 3.434 20 5 GGBDRN CCCC[C@H](NCc1cc([N+](=O)[O-])ccc1OC)C(=O)Nc1cc(C)on1 ZINC000171979380 1425866618 /nfs/dbraw/zinc/86/66/18/1425866618.db2.gz YGHRAGSEPLIUOC-HNNXBMFYSA-N 0 0 376.413 3.187 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCC2CC2)cc1 ZINC000171985203 1425867657 /nfs/dbraw/zinc/86/76/57/1425867657.db2.gz UBOCDQKVRNBMMO-ZDUSSCGKSA-N 0 0 383.404 3.141 20 5 GGBDRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000171995501 1425869068 /nfs/dbraw/zinc/86/90/68/1425869068.db2.gz KGXUOVIAADHZAT-SFHVURJKSA-N 0 0 390.461 3.468 20 5 GGBDRN Cc1ccc(N(C)C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1Cl ZINC000172004689 1425871503 /nfs/dbraw/zinc/87/15/03/1425871503.db2.gz LKEQBYZSBNHMCR-UHFFFAOYSA-N 0 0 382.825 3.237 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)Cc2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-] ZINC000172015062 1425874112 /nfs/dbraw/zinc/87/41/12/1425874112.db2.gz ZXCKJWJTPWKJEU-UHFFFAOYSA-N 0 0 386.376 3.325 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2cccs2)C[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000172015755 1425874120 /nfs/dbraw/zinc/87/41/20/1425874120.db2.gz ZIYRTZKZCOMMCK-AWEZNQCLSA-N 0 0 396.490 3.335 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccco2)Cc2cccnc2)ccc1[N+](=O)[O-] ZINC000172016550 1425874767 /nfs/dbraw/zinc/87/47/67/1425874767.db2.gz VRFPMACNNWEDGG-UHFFFAOYSA-N 0 0 387.417 3.282 20 5 GGBDRN COc1cccc([C@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000172016290 1425874783 /nfs/dbraw/zinc/87/47/83/1425874783.db2.gz NZTDSFQKAUZHGY-GOSISDBHSA-N 0 0 376.434 3.438 20 5 GGBDRN COc1ccc(CCCN(C)S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000172018496 1425875081 /nfs/dbraw/zinc/87/50/81/1425875081.db2.gz HFPHHPIASXWROU-UHFFFAOYSA-N 0 0 378.450 3.165 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000172018886 1425875288 /nfs/dbraw/zinc/87/52/88/1425875288.db2.gz BNZDOVMNWPPBTJ-QFBILLFUSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCO[C@@H](c3ccccc3Cl)C2)ccc1[N+](=O)[O-] ZINC000172020474 1425875585 /nfs/dbraw/zinc/87/55/85/1425875585.db2.gz LEZPPCCIGVHDPE-QGZVFWFLSA-N 0 0 396.852 3.319 20 5 GGBDRN COc1ccc([C@@H]2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)C2)cc1 ZINC000172019660 1425875662 /nfs/dbraw/zinc/87/56/62/1425875662.db2.gz AVJGVUSEDCFESK-OAHLLOKOSA-N 0 0 376.434 3.090 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCO[C@H](c3ccccc3Cl)C2)ccc1[N+](=O)[O-] ZINC000172020469 1425875690 /nfs/dbraw/zinc/87/56/90/1425875690.db2.gz LEZPPCCIGVHDPE-KRWDZBQOSA-N 0 0 396.852 3.319 20 5 GGBDRN C[C@H](NC(=O)NC[C@@](C)(O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000172027896 1425877768 /nfs/dbraw/zinc/87/77/68/1425877768.db2.gz QBGDFBDGHRCEAW-BBATYDOGSA-N 0 0 379.363 3.141 20 5 GGBDRN COC(=O)c1ccc(CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000172049450 1425882533 /nfs/dbraw/zinc/88/25/33/1425882533.db2.gz ONOBNWFGUSMPTJ-UHFFFAOYSA-N 0 0 376.796 3.236 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000172062377 1425886481 /nfs/dbraw/zinc/88/64/81/1425886481.db2.gz IVJQBLBWZFVHBU-KUHUBIRLSA-N 0 0 387.436 3.476 20 5 GGBDRN CC(C)Oc1cccc([C@@H](O)CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000172062368 1425886574 /nfs/dbraw/zinc/88/65/74/1425886574.db2.gz IVJQBLBWZFVHBU-LIRRHRJNSA-N 0 0 387.436 3.476 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)CCc1ccc(Cl)cc1 ZINC000172078836 1425890713 /nfs/dbraw/zinc/89/07/13/1425890713.db2.gz NRQHGBGUAXPEHA-UHFFFAOYSA-N 0 0 377.828 3.370 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](c1c(F)cccc1F)N(C)C ZINC000172104469 1425896630 /nfs/dbraw/zinc/89/66/30/1425896630.db2.gz QDZXJFVRZURNSM-HNNXBMFYSA-N 0 0 394.378 3.306 20 5 GGBDRN CC(=O)Nc1cccc2c1CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000172110581 1425898638 /nfs/dbraw/zinc/89/86/38/1425898638.db2.gz GMOSWJSNLCFTEQ-UHFFFAOYSA-N 0 0 387.823 3.334 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](OCc2ccncc2)C1 ZINC000172124708 1425906333 /nfs/dbraw/zinc/90/63/33/1425906333.db2.gz YFVBYUWGMOYJRZ-MRXNPFEDSA-N 0 0 375.812 3.003 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cccc(C[S@](=O)C(C)(C)C)c2)c1[N+](=O)[O-] ZINC000172130226 1425909586 /nfs/dbraw/zinc/90/95/86/1425909586.db2.gz LNRNWSNPQOLRRX-SANMLTNESA-N 0 0 378.454 3.180 20 5 GGBDRN C[C@H](NC(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000172139003 1425912959 /nfs/dbraw/zinc/91/29/59/1425912959.db2.gz SZMHVROBJVOKAH-HNAYVOBHSA-N 0 0 396.447 3.493 20 5 GGBDRN C[C@@H](NC(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000172139018 1425913079 /nfs/dbraw/zinc/91/30/79/1425913079.db2.gz SZMHVROBJVOKAH-BEFAXECRSA-N 0 0 396.447 3.493 20 5 GGBDRN O=C(NCCc1ccc2c(c1)CCO2)c1cc([N+](=O)[O-])ccc1Br ZINC000172147678 1425920261 /nfs/dbraw/zinc/92/02/61/1425920261.db2.gz HQGRTWMFFQWRBE-UHFFFAOYSA-N 0 0 391.221 3.265 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2cccc(OC)c2OC2CCCC2)c1[N+](=O)[O-] ZINC000172165154 1425928171 /nfs/dbraw/zinc/92/81/71/1425928171.db2.gz XMXHYORQBSDSJH-UHFFFAOYSA-N 0 0 388.424 3.140 20 5 GGBDRN Cc1cccc([C@@H](C)NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c1C ZINC000172170265 1425930997 /nfs/dbraw/zinc/93/09/97/1425930997.db2.gz DGHMCEFIHISJSZ-CYBMUJFWSA-N 0 0 376.434 3.106 20 5 GGBDRN COc1cc(CCNC(=O)NCCc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000172171959 1425931777 /nfs/dbraw/zinc/93/17/77/1425931777.db2.gz KRZVQMRPBLWQNL-UHFFFAOYSA-N 0 0 387.436 3.005 20 5 GGBDRN COc1ccc(C(=O)N2CCN(Cc3cc([N+](=O)[O-])ccc3Cl)CC2)cc1 ZINC000172174856 1425934066 /nfs/dbraw/zinc/93/40/66/1425934066.db2.gz LQTLIDSWQMFYOQ-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172178269 1425934777 /nfs/dbraw/zinc/93/47/77/1425934777.db2.gz OUMVXFMLTRKCCF-NSHDSACASA-N 0 0 383.857 3.089 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)CCC1CCCCC1 ZINC000172178605 1425935896 /nfs/dbraw/zinc/93/58/96/1425935896.db2.gz DMUDAVYDBJEROD-ZDUSSCGKSA-N 0 0 377.441 3.407 20 5 GGBDRN Cc1cc(C)cc(N(C)C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000172208013 1425948520 /nfs/dbraw/zinc/94/85/20/1425948520.db2.gz RSUUIKAXOBLVOB-UHFFFAOYSA-N 0 0 375.812 3.258 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1c(F)cccc1F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000172217569 1425951669 /nfs/dbraw/zinc/95/16/69/1425951669.db2.gz YIQUSVKTWPGVSU-HZPDHXFCSA-N 0 0 387.386 3.325 20 5 GGBDRN O=C([C@@H]1C[C@@H]1c1c(F)cccc1F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000172217573 1425951859 /nfs/dbraw/zinc/95/18/59/1425951859.db2.gz YIQUSVKTWPGVSU-JKSUJKDBSA-N 0 0 387.386 3.325 20 5 GGBDRN CC(=O)Nc1cccc(CS(=O)(=O)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000172237672 1425960429 /nfs/dbraw/zinc/96/04/29/1425960429.db2.gz CRIVMUSEFSPEDN-UHFFFAOYSA-N 0 0 382.825 3.322 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CC[C@H](OCc2ccncc2)C1 ZINC000172249361 1425966658 /nfs/dbraw/zinc/96/66/58/1425966658.db2.gz ARTZHNCIBJSPME-SFHVURJKSA-N 0 0 396.447 3.021 20 5 GGBDRN C[C@@H](c1ccc(NC(=O)NCc2ccccc2[N+](=O)[O-])cc1)N1CCOCC1 ZINC000172250464 1425967484 /nfs/dbraw/zinc/96/74/84/1425967484.db2.gz NRUOFCZVWPVJAZ-HNNXBMFYSA-N 0 0 384.436 3.310 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172259200 1425971703 /nfs/dbraw/zinc/97/17/03/1425971703.db2.gz KBOOKXQKJKRHOK-MUUNZHRXSA-N 0 0 398.444 3.220 20 5 GGBDRN COc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000172281239 1425978660 /nfs/dbraw/zinc/97/86/60/1425978660.db2.gz FEKPNODTCGGAGP-QGZVFWFLSA-N 0 0 375.812 3.470 20 5 GGBDRN COc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])c4cnccc34)C2=O)cc1 ZINC000172280851 1425978821 /nfs/dbraw/zinc/97/88/21/1425978821.db2.gz YMCLERFUGMJUKR-LJQANCHMSA-N 0 0 392.415 3.365 20 5 GGBDRN COc1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000172281235 1425978843 /nfs/dbraw/zinc/97/88/43/1425978843.db2.gz FEKPNODTCGGAGP-KRWDZBQOSA-N 0 0 375.812 3.470 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cc3c(cc2Cl)OCCCO3)c1[N+](=O)[O-] ZINC000172329100 1426001550 /nfs/dbraw/zinc/00/15/50/1426001550.db2.gz OAKBMJXMNDAQTH-UHFFFAOYSA-N 0 0 380.788 3.337 20 5 GGBDRN CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000172337859 1426005988 /nfs/dbraw/zinc/00/59/88/1426005988.db2.gz UPESXFHRIGEZEW-QGZVFWFLSA-N 0 0 390.823 3.495 20 5 GGBDRN Cc1nc(CN2CCC(C(=O)N3CCc4c3cccc4[N+](=O)[O-])CC2)cs1 ZINC000172361333 1426014869 /nfs/dbraw/zinc/01/48/69/1426014869.db2.gz YKLZJJHXGCBRLR-UHFFFAOYSA-N 0 0 386.477 3.161 20 5 GGBDRN C[C@H]1CSCCN1c1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000172373644 1426018115 /nfs/dbraw/zinc/01/81/15/1426018115.db2.gz SDARPYVXZBMEKZ-ZDUSSCGKSA-N 0 0 393.490 3.337 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(OCCc3ccccc3)nc2)c1[N+](=O)[O-] ZINC000172376981 1426018877 /nfs/dbraw/zinc/01/88/77/1426018877.db2.gz YBFXUITZOTYQOA-UHFFFAOYSA-N 0 0 381.392 3.149 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1Br ZINC000172385618 1426022549 /nfs/dbraw/zinc/02/25/49/1426022549.db2.gz FHJNIXMQRINFFM-UHFFFAOYSA-N 0 0 380.154 3.196 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000172402694 1426027240 /nfs/dbraw/zinc/02/72/40/1426027240.db2.gz JEMPRIGBXDYYGA-LLVKDONJSA-N 0 0 383.832 3.378 20 5 GGBDRN CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000172406702 1426028691 /nfs/dbraw/zinc/02/86/91/1426028691.db2.gz OKVKMCXHUCUIDW-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172409650 1426029839 /nfs/dbraw/zinc/02/98/39/1426029839.db2.gz NNTWWJCBNDSCEY-TZMCWYRMSA-N 0 0 375.425 3.177 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172409647 1426029941 /nfs/dbraw/zinc/02/99/41/1426029941.db2.gz NNTWWJCBNDSCEY-JSGCOSHPSA-N 0 0 375.425 3.177 20 5 GGBDRN O=C(CCc1nc(-c2ccco2)no1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000172413901 1426031234 /nfs/dbraw/zinc/03/12/34/1426031234.db2.gz WBMPPURXXRPLSD-UHFFFAOYSA-N 0 0 384.392 3.310 20 5 GGBDRN CC(=O)N1CCc2cc(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000172413967 1426031450 /nfs/dbraw/zinc/03/14/50/1426031450.db2.gz ZEZGGOYSVUPUJP-UHFFFAOYSA-N 0 0 381.432 3.257 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)Nc2cc(F)ccc21 ZINC000172414645 1426031692 /nfs/dbraw/zinc/03/16/92/1426031692.db2.gz GADHMWFCEZPLBC-QGZVFWFLSA-N 0 0 385.395 3.299 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CC(c2c(F)cccc2F)=NO1)c1cccc([N+](=O)[O-])c1 ZINC000172414816 1426031769 /nfs/dbraw/zinc/03/17/69/1426031769.db2.gz CMSBVHPASZASFZ-QLJPJBMISA-N 0 0 375.331 3.243 20 5 GGBDRN O=C(NC[C@H]1CCCOC1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000172415565 1426032465 /nfs/dbraw/zinc/03/24/65/1426032465.db2.gz XQQWTTGYUIHARU-SNVBAGLBSA-N 0 0 399.234 3.244 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172420546 1426035178 /nfs/dbraw/zinc/03/51/78/1426035178.db2.gz IREBJJQZDJKJOK-UHFFFAOYSA-N 0 0 396.403 3.309 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CCCO1 ZINC000172420342 1426035587 /nfs/dbraw/zinc/03/55/87/1426035587.db2.gz RREGBJHSLLDOOW-SNVBAGLBSA-N 0 0 399.234 3.338 20 5 GGBDRN O=C([C@H]1CCCN1c1ncnc2sccc21)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172420710 1426036277 /nfs/dbraw/zinc/03/62/77/1426036277.db2.gz ZGTRYFBUZFCZPY-MRXNPFEDSA-N 0 0 395.444 3.158 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000172421068 1426036320 /nfs/dbraw/zinc/03/63/20/1426036320.db2.gz XPKGIKYOFXLSMD-MRXNPFEDSA-N 0 0 387.823 3.405 20 5 GGBDRN Cc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])nnn1-c1cccc(Cl)c1 ZINC000172421609 1426037155 /nfs/dbraw/zinc/03/71/55/1426037155.db2.gz AEOUGCBJHZTLRP-UHFFFAOYSA-N 0 0 383.795 3.340 20 5 GGBDRN CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000172421892 1426037237 /nfs/dbraw/zinc/03/72/37/1426037237.db2.gz PZNWLQGOQNESDS-QGZVFWFLSA-N 0 0 390.823 3.495 20 5 GGBDRN Cc1ccc(NC(=O)CSCC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000172423661 1426037591 /nfs/dbraw/zinc/03/75/91/1426037591.db2.gz BEVKFXBWWRCJKP-UHFFFAOYSA-N 0 0 385.445 3.164 20 5 GGBDRN CCS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000172423140 1426038142 /nfs/dbraw/zinc/03/81/42/1426038142.db2.gz YVYYJURBMUGDRC-UHFFFAOYSA-N 0 0 394.836 3.245 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@@H](C(=O)N3CCc4c3cccc4[N+](=O)[O-])C2)cc1 ZINC000172424890 1426038353 /nfs/dbraw/zinc/03/83/53/1426038353.db2.gz YVFXJEVGVXNLGY-QGZVFWFLSA-N 0 0 393.443 3.345 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@H](C(=O)N3CCc4c3cccc4[N+](=O)[O-])C2)cc1 ZINC000172424886 1426038673 /nfs/dbraw/zinc/03/86/73/1426038673.db2.gz YVFXJEVGVXNLGY-KRWDZBQOSA-N 0 0 393.443 3.345 20 5 GGBDRN O=C(c1cccs1)N1CCCC[C@H]1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172424965 1426039317 /nfs/dbraw/zinc/03/93/17/1426039317.db2.gz YUGQQHFEJBMBBS-INIZCTEOSA-N 0 0 385.445 3.240 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000172427784 1426040582 /nfs/dbraw/zinc/04/05/82/1426040582.db2.gz AEIFHFYDODSXEM-OAHLLOKOSA-N 0 0 384.219 3.434 20 5 GGBDRN CN1CCCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc21 ZINC000172431447 1426041649 /nfs/dbraw/zinc/04/16/49/1426041649.db2.gz AUOAHRVTRLPKMV-UHFFFAOYSA-N 0 0 377.404 3.267 20 5 GGBDRN C[C@@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2 ZINC000172441064 1426043762 /nfs/dbraw/zinc/04/37/62/1426043762.db2.gz CIYNCYVNZLYHAJ-CQSZACIVSA-N 0 0 396.447 3.473 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCN(Cc2ccccc2)c2ccccc21 ZINC000172451945 1426045981 /nfs/dbraw/zinc/04/59/81/1426045981.db2.gz RGKGONQWNTXDET-UHFFFAOYSA-N 0 0 391.431 3.235 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC(C)(C)c1nc(C)c(C)s1 ZINC000172450994 1426046105 /nfs/dbraw/zinc/04/61/05/1426046105.db2.gz BLDVMNVKXGLECJ-UHFFFAOYSA-N 0 0 378.454 3.411 20 5 GGBDRN O=C(Nc1ccc(O[C@H]2CCOC2)cc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172460588 1426049557 /nfs/dbraw/zinc/04/95/57/1426049557.db2.gz KHSGTIXLBZSHKU-KRWDZBQOSA-N 0 0 394.387 3.201 20 5 GGBDRN Cc1cc(=O)c(C(=O)NC2C[C@@H](C)C[C@H](C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000172470641 1426053255 /nfs/dbraw/zinc/05/32/55/1426053255.db2.gz SOPXTQXTQIQVQJ-STQMWFEESA-N 0 0 384.436 3.004 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)NCc2cc([N+](=O)[O-])ccc2OC)o1 ZINC000172489563 1426057808 /nfs/dbraw/zinc/05/78/08/1426057808.db2.gz NPZCZAUKFALFAQ-MRXNPFEDSA-N 0 0 389.408 3.042 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000172512082 1426065608 /nfs/dbraw/zinc/06/56/08/1426065608.db2.gz RGTIZXQTEGAIIQ-NSHDSACASA-N 0 0 383.832 3.235 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000172511762 1426065918 /nfs/dbraw/zinc/06/59/18/1426065918.db2.gz ZTDWFAIXKKGDDR-KRWDZBQOSA-N 0 0 375.812 3.465 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(F)c1F ZINC000172522628 1426069960 /nfs/dbraw/zinc/06/99/60/1426069960.db2.gz PVXPFJPHGUPZEM-UHFFFAOYSA-N 0 0 395.337 3.090 20 5 GGBDRN Cc1nc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172534667 1426076188 /nfs/dbraw/zinc/07/61/88/1426076188.db2.gz URWYRDLWQWUQBZ-LLVKDONJSA-N 0 0 395.341 3.039 20 5 GGBDRN C[C@@H]1CC(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H](C)C1 ZINC000172539248 1426078936 /nfs/dbraw/zinc/07/89/36/1426078936.db2.gz UHBGBTGLVZAVNE-UWVGGRQHSA-N 0 0 385.367 3.076 20 5 GGBDRN CN1CC[C@@H](NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1=O ZINC000172545623 1426081663 /nfs/dbraw/zinc/08/16/63/1426081663.db2.gz LXAIMUAGTABQJL-CQSZACIVSA-N 0 0 389.795 3.001 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCCN(C)c3ccccc32)c([N+](=O)[O-])c1 ZINC000172548935 1426082242 /nfs/dbraw/zinc/08/22/42/1426082242.db2.gz QEPWZVTTZDVGKR-UHFFFAOYSA-N 0 0 384.436 3.279 20 5 GGBDRN Cc1ccccc1C(C)(C)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000172559831 1426087629 /nfs/dbraw/zinc/08/76/29/1426087629.db2.gz AJSVMEVUJSVDGS-UHFFFAOYSA-N 0 0 395.459 3.165 20 5 GGBDRN O=C(Nc1ccc(-c2cc[nH]n2)cc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 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/nfs/dbraw/zinc/16/98/87/1426169887.db2.gz NIMNMWSKURAOQO-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](C)Oc2cccc(F)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000172743904 1426170783 /nfs/dbraw/zinc/17/07/83/1426170783.db2.gz ODCBCELXVGNCKA-SNVBAGLBSA-N 0 0 377.328 3.148 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000172755029 1426174326 /nfs/dbraw/zinc/17/43/26/1426174326.db2.gz GNMJWOBFDPYDPW-KRWDZBQOSA-N 0 0 391.374 3.099 20 5 GGBDRN CC(C)C(=O)N(C)Cc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000172755107 1426174664 /nfs/dbraw/zinc/17/46/64/1426174664.db2.gz QANMCSOLMJVQBG-UHFFFAOYSA-N 0 0 383.448 3.481 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000172755035 1426174671 /nfs/dbraw/zinc/17/46/71/1426174671.db2.gz GNMJWOBFDPYDPW-QGZVFWFLSA-N 0 0 391.374 3.099 20 5 GGBDRN COc1cc(CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c2ccccc2n1 ZINC000172765724 1426177554 /nfs/dbraw/zinc/17/75/54/1426177554.db2.gz 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C[C@H]1C[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C(=O)N1c1ccccc1 ZINC000172775937 1426182627 /nfs/dbraw/zinc/18/26/27/1426182627.db2.gz AQGPYUYPLBVYHB-YVEFUNNKSA-N 0 0 380.404 3.085 20 5 GGBDRN COc1cccc(O[C@@H](C)CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1 ZINC000172776534 1426183070 /nfs/dbraw/zinc/18/30/70/1426183070.db2.gz WDEXUDJQAPOJIU-ZDUSSCGKSA-N 0 0 385.420 3.375 20 5 GGBDRN COCCOC[C@H]1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000172784229 1426186800 /nfs/dbraw/zinc/18/68/00/1426186800.db2.gz SOFFXRXWQWYBKU-JTQLQIEISA-N 0 0 393.318 3.011 20 5 GGBDRN C[C@H](C(=O)Nc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1)n1cccn1 ZINC000172785090 1426187618 /nfs/dbraw/zinc/18/76/18/1426187618.db2.gz QGXBEVKMFSDZGF-CQSZACIVSA-N 0 0 393.403 3.172 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)cc1 ZINC000172787153 1426188339 /nfs/dbraw/zinc/18/83/39/1426188339.db2.gz CORFUSWGISPIKW-UHFFFAOYSA-N 0 0 388.336 3.459 20 5 GGBDRN C[C@H]1Cc2ccccc2CN1C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000172788428 1426188956 /nfs/dbraw/zinc/18/89/56/1426188956.db2.gz RFXCAHGLXHIBDB-BBRMVZONSA-N 0 0 397.406 3.060 20 5 GGBDRN C[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C(=O)N1c1ccccc1 ZINC000172790188 1426189822 /nfs/dbraw/zinc/18/98/22/1426189822.db2.gz XLEKKZOZCBVIEX-SJKOYZFVSA-N 0 0 387.823 3.101 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000172802029 1426195471 /nfs/dbraw/zinc/19/54/71/1426195471.db2.gz UHEYOMWDVRGCTB-UHFFFAOYSA-N 0 0 382.342 3.314 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000172806285 1426197816 /nfs/dbraw/zinc/19/78/16/1426197816.db2.gz HCLWXFGYDNIEHV-MRXNPFEDSA-N 0 0 399.403 3.490 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CCNc2ncc(C)cc2[N+](=O)[O-])s1 ZINC000172808053 1426198329 /nfs/dbraw/zinc/19/83/29/1426198329.db2.gz LXUSNCGUGZITRR-UHFFFAOYSA-N 0 0 398.510 3.045 20 5 GGBDRN C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000172808313 1426198594 /nfs/dbraw/zinc/19/85/94/1426198594.db2.gz BDRYISNAQZEGHG-ZDUSSCGKSA-N 0 0 382.420 3.299 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](COCc2ccccc2)C1 ZINC000172809651 1426199132 /nfs/dbraw/zinc/19/91/32/1426199132.db2.gz DAGTZAONCYMSAN-KRWDZBQOSA-N 0 0 383.448 3.340 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](COCc3ccccc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000172812114 1426199896 /nfs/dbraw/zinc/19/98/96/1426199896.db2.gz CIXYYGBHMYDCCF-MRXNPFEDSA-N 0 0 399.403 3.490 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[C@@H](COCc2ccccc2)C1 ZINC000172815114 1426201269 /nfs/dbraw/zinc/20/12/69/1426201269.db2.gz OXZNDIKUIQQSOY-GOSISDBHSA-N 0 0 383.448 3.462 20 5 GGBDRN CC(C)c1nc(C(=O)NCc2ccccc2[N+](=O)[O-])nn1-c1ccccc1F ZINC000172820303 1426204368 /nfs/dbraw/zinc/20/43/68/1426204368.db2.gz AMTREFYWEJSTPV-UHFFFAOYSA-N 0 0 383.383 3.368 20 5 GGBDRN COc1cccc(O[C@H](C)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000172824601 1426206165 /nfs/dbraw/zinc/20/61/65/1426206165.db2.gz VWUMYDSFCWWPIX-GFCCVEGCSA-N 0 0 378.812 3.383 20 5 GGBDRN COc1cccc(O[C@@H](C)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000172824598 1426206247 /nfs/dbraw/zinc/20/62/47/1426206247.db2.gz VWUMYDSFCWWPIX-LBPRGKRZSA-N 0 0 378.812 3.383 20 5 GGBDRN CN(C(=O)COC(=O)Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCc2ccccc21 ZINC000172833355 1426209595 /nfs/dbraw/zinc/20/95/95/1426209595.db2.gz BKBKERAIYAKKTP-IBGZPJMESA-N 0 0 382.416 3.217 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])C2)nc1 ZINC000172834837 1426210444 /nfs/dbraw/zinc/21/04/44/1426210444.db2.gz XLNHSMAOXCEWMG-HNNXBMFYSA-N 0 0 382.420 3.098 20 5 GGBDRN C[C@]1(C(=O)NCc2ccc([N+](=O)[O-])cc2)CCCN(C(=O)c2ccccc2)C1 ZINC000172846506 1426217287 /nfs/dbraw/zinc/21/72/87/1426217287.db2.gz XQOMGWGRVCZPCW-NRFANRHFSA-N 0 0 381.432 3.154 20 5 GGBDRN Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000172851080 1426219474 /nfs/dbraw/zinc/21/94/74/1426219474.db2.gz BUXGFDGUDQJUOC-HZPDHXFCSA-N 0 0 383.448 3.077 20 5 GGBDRN CC(C)N(C)S(=O)(=O)c1ccc(NCc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000172861369 1426225749 /nfs/dbraw/zinc/22/57/49/1426225749.db2.gz GADXQRUXSJSBOM-UHFFFAOYSA-N 0 0 381.429 3.375 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1F ZINC000172862429 1426226802 /nfs/dbraw/zinc/22/68/02/1426226802.db2.gz KASDHZRFBKBKBJ-MRXNPFEDSA-N 0 0 389.358 3.030 20 5 GGBDRN COc1cc(OCC(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000172862189 1426226958 /nfs/dbraw/zinc/22/69/58/1426226958.db2.gz JANUSAHKWRUQAX-INIZCTEOSA-N 0 0 399.447 3.076 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)C[C@H](C)O1 ZINC000172862783 1426227398 /nfs/dbraw/zinc/22/73/98/1426227398.db2.gz KAAAPMBSWOKCLN-GJZGRUSLSA-N 0 0 397.431 3.025 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)c1 ZINC000172862739 1426227653 /nfs/dbraw/zinc/22/76/53/1426227653.db2.gz 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ZINC000172905377 1426251775 /nfs/dbraw/zinc/25/17/75/1426251775.db2.gz BWMNEWOCDMILJX-AWEZNQCLSA-N 0 0 379.319 3.166 20 5 GGBDRN COCCCOC1CCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000172914249 1426259173 /nfs/dbraw/zinc/25/91/73/1426259173.db2.gz WXONWXAFVSKEIY-UHFFFAOYSA-N 0 0 381.454 3.347 20 5 GGBDRN Cc1c(CNc2cccc(S(=O)(=O)NC3CC3)c2C)cccc1[N+](=O)[O-] ZINC000172915995 1426260373 /nfs/dbraw/zinc/26/03/73/1426260373.db2.gz GHWJYZJAEVWROX-UHFFFAOYSA-N 0 0 375.450 3.264 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](C)Sc2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000172920522 1426263082 /nfs/dbraw/zinc/26/30/82/1426263082.db2.gz PEOCGJXUKSDYOO-CYBMUJFWSA-N 0 0 397.460 3.395 20 5 GGBDRN O=c1ccc(-c2ccccc2F)nn1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172922901 1426265366 /nfs/dbraw/zinc/26/53/66/1426265366.db2.gz PNAUEDHNCJJWMM-UHFFFAOYSA-N 0 0 393.334 3.056 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(C(=O)Nc2ccncc2)c1 ZINC000172930686 1426269367 /nfs/dbraw/zinc/26/93/67/1426269367.db2.gz FLKZWYHAYPMGQL-UHFFFAOYSA-N 0 0 376.372 3.423 20 5 GGBDRN CCOC(=O)[C@H](C)NC(=O)c1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000172936076 1426274208 /nfs/dbraw/zinc/27/42/08/1426274208.db2.gz PPUSWIJGSJFQSW-AWEZNQCLSA-N 0 0 385.420 3.197 20 5 GGBDRN CC(C)[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1nc(-c2cccnc2)no1 ZINC000172939124 1426274688 /nfs/dbraw/zinc/27/46/88/1426274688.db2.gz CUPLMVBNHRBTGA-KRWDZBQOSA-N 0 0 381.392 3.096 20 5 GGBDRN CC(C)[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1nc(-c2cccnc2)no1 ZINC000172939128 1426274987 /nfs/dbraw/zinc/27/49/87/1426274987.db2.gz CUPLMVBNHRBTGA-QGZVFWFLSA-N 0 0 381.392 3.096 20 5 GGBDRN CCCCc1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1N ZINC000172940149 1426275637 /nfs/dbraw/zinc/27/56/37/1426275637.db2.gz QVHHXEUTSNHZSH-SNVBAGLBSA-N 0 0 389.441 3.146 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC(C(=O)Nc2ccc(F)cc2)CC1 ZINC000172941296 1426276625 /nfs/dbraw/zinc/27/66/25/1426276625.db2.gz IYZLPRDCTJFHBS-UHFFFAOYSA-N 0 0 385.395 3.154 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(c3nc(-c4ccccn4)no3)CC2)c1 ZINC000172944631 1426279071 /nfs/dbraw/zinc/27/90/71/1426279071.db2.gz IUEJTXRXHDEVSX-UHFFFAOYSA-N 0 0 393.403 3.368 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCCCc2cc(N)n(-c3ccccc3)n2)c1 ZINC000172952391 1426281878 /nfs/dbraw/zinc/28/18/78/1426281878.db2.gz APWWMOXKNHCCGC-UHFFFAOYSA-N 0 0 379.420 3.034 20 5 GGBDRN O=[N+]([O-])c1cn(CN2CC[C@@H](COCc3ccccc3)C2)nc1-c1ccncc1 ZINC000172971381 1426288354 /nfs/dbraw/zinc/28/83/54/1426288354.db2.gz FLVPYEXAAAMKNC-GOSISDBHSA-N 0 0 393.447 3.350 20 5 GGBDRN CC(C)(C)OC(=O)CCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000172970941 1426289006 /nfs/dbraw/zinc/28/90/06/1426289006.db2.gz ONLPGVBGLGLPRD-UHFFFAOYSA-N 0 0 377.422 3.180 20 5 GGBDRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000172992885 1426299425 /nfs/dbraw/zinc/29/94/25/1426299425.db2.gz QIBQOZBRCQNHHS-GOEBONIOSA-N 0 0 398.463 3.490 20 5 GGBDRN COc1cc(CCNC(=O)[C@H](C)c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000172993173 1426300263 /nfs/dbraw/zinc/30/02/63/1426300263.db2.gz HONSMVVZSFDNCV-GFCCVEGCSA-N 0 0 376.384 3.214 20 5 GGBDRN CC(C)Nc1cc(F)ccc1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173001743 1426303477 /nfs/dbraw/zinc/30/34/77/1426303477.db2.gz REJPOLOXRFRKEO-UHFFFAOYSA-N 0 0 384.371 3.387 20 5 GGBDRN Cc1cc(-n2cncn2)ccc1C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000173002997 1426304288 /nfs/dbraw/zinc/30/42/88/1426304288.db2.gz POUCVNXZCSDZOW-UHFFFAOYSA-N 0 0 385.811 3.410 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)Cc2cccc([N+](=O)[O-])c2)c1C ZINC000173005273 1426304826 /nfs/dbraw/zinc/30/48/26/1426304826.db2.gz CLZPIGPDDZKELH-SFHVURJKSA-N 0 0 399.472 3.294 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2C)c1 ZINC000173005293 1426304926 /nfs/dbraw/zinc/30/49/26/1426304926.db2.gz YIVKCUQNTDVNJC-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)Cc2cccc([N+](=O)[O-])c2)cc1C ZINC000173005979 1426305382 /nfs/dbraw/zinc/30/53/82/1426305382.db2.gz INPRASYZISCXTI-GOSISDBHSA-N 0 0 399.472 3.294 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000173005716 1426305505 /nfs/dbraw/zinc/30/55/05/1426305505.db2.gz YKNTUYKRTDGANG-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN COCCOCc1cc(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)ccc1F ZINC000173022387 1426311285 /nfs/dbraw/zinc/31/12/85/1426311285.db2.gz WBFVYFMSDJZVJE-UHFFFAOYSA-N 0 0 388.395 3.490 20 5 GGBDRN Cc1sc(CCNC(=O)CCn2cc([N+](=O)[O-])nc2C)nc1-c1ccccc1 ZINC000173024218 1426312527 /nfs/dbraw/zinc/31/25/27/1426312527.db2.gz HPZOPFHMXSICMF-UHFFFAOYSA-N 0 0 399.476 3.281 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)c1 ZINC000173028713 1426315357 /nfs/dbraw/zinc/31/53/57/1426315357.db2.gz IJYCFDQYWACICK-HNNXBMFYSA-N 0 0 383.452 3.241 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000173031118 1426316029 /nfs/dbraw/zinc/31/60/29/1426316029.db2.gz RODHIGMPSZCGFY-SNVBAGLBSA-N 0 0 389.250 3.119 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173033717 1426316994 /nfs/dbraw/zinc/31/69/94/1426316994.db2.gz GJWZECSFTDJOIE-UHFFFAOYSA-N 0 0 383.326 3.297 20 5 GGBDRN O=C([C@@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000173036925 1426317993 /nfs/dbraw/zinc/31/79/93/1426317993.db2.gz SCCJVAPCZSJQCK-MRXNPFEDSA-N 0 0 385.807 3.190 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)c1 ZINC000173048276 1426322080 /nfs/dbraw/zinc/32/20/80/1426322080.db2.gz RJIXMYCHEGPKGI-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN CN(C(N)=O)c1ccc(OC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173048842 1426322814 /nfs/dbraw/zinc/32/28/14/1426322814.db2.gz IRDGWPKMOZGKRL-UHFFFAOYSA-N 0 0 383.282 3.348 20 5 GGBDRN CN(CC(=O)Nc1ccnn1Cc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000173051903 1426323651 /nfs/dbraw/zinc/32/36/51/1426323651.db2.gz WOCWKDFQMXOBRS-UHFFFAOYSA-N 0 0 383.383 3.054 20 5 GGBDRN CCc1cnc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000173055892 1426325510 /nfs/dbraw/zinc/32/55/10/1426325510.db2.gz QAEHFMCLSCNVEH-HNNXBMFYSA-N 0 0 388.449 3.165 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C12CCCCC2 ZINC000173062760 1426327213 /nfs/dbraw/zinc/32/72/13/1426327213.db2.gz XAKQMQDMVCSCGE-HOTGVXAUSA-N 0 0 378.473 3.042 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C12CCCCC2 ZINC000173062771 1426327447 /nfs/dbraw/zinc/32/74/47/1426327447.db2.gz XAKQMQDMVCSCGE-CVEARBPZSA-N 0 0 378.473 3.042 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173063883 1426327891 /nfs/dbraw/zinc/32/78/91/1426327891.db2.gz QSBYNHRVTMXPOK-SFHVURJKSA-N 0 0 397.431 3.084 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(N2CCNC2=O)ccc1Cl ZINC000173064214 1426328713 /nfs/dbraw/zinc/32/87/13/1426328713.db2.gz OOJYLDXQVFUXEH-UHFFFAOYSA-N 0 0 388.811 3.050 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3nc4ccccc4s3)CC2)c1 ZINC000173079174 1426333633 /nfs/dbraw/zinc/33/36/33/1426333633.db2.gz OQHMQRKKCAIDEH-UHFFFAOYSA-N 0 0 382.445 3.475 20 5 GGBDRN O=C([C@@H](c1ccccc1)N1CCCCC1=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000173080857 1426334067 /nfs/dbraw/zinc/33/40/67/1426334067.db2.gz MPEFYXSZWCPPPX-HXUWFJFHSA-N 0 0 379.416 3.238 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3cc(SC)ccc3[N+](=O)[O-])cc21 ZINC000173113967 1426349085 /nfs/dbraw/zinc/34/90/85/1426349085.db2.gz OBCUQAHHYHZCNC-UHFFFAOYSA-N 0 0 398.444 3.270 20 5 GGBDRN CN(C(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC000173114147 1426349483 /nfs/dbraw/zinc/34/94/83/1426349483.db2.gz CJAQELKYPILYKJ-UHFFFAOYSA-N 0 0 380.198 3.184 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173117091 1426350863 /nfs/dbraw/zinc/35/08/63/1426350863.db2.gz PZTZNXCCUAWPHL-CQSZACIVSA-N 0 0 381.436 3.278 20 5 GGBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173117096 1426350871 /nfs/dbraw/zinc/35/08/71/1426350871.db2.gz PZTZNXCCUAWPHL-AWEZNQCLSA-N 0 0 381.436 3.278 20 5 GGBDRN CNC(=O)c1cccc(C(=O)OCc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000173119626 1426351315 /nfs/dbraw/zinc/35/13/15/1426351315.db2.gz ASWIYFDVDRAQSC-UHFFFAOYSA-N 0 0 393.193 3.074 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(CC(F)(F)F)c1 ZINC000173127301 1426353461 /nfs/dbraw/zinc/35/34/61/1426353461.db2.gz FAFZBWHJMBLLMI-LLVKDONJSA-N 0 0 395.337 3.457 20 5 GGBDRN O=C(NCCc1nc2ccccc2[nH]1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173133767 1426356488 /nfs/dbraw/zinc/35/64/88/1426356488.db2.gz USTYBPHMIBPWFV-UHFFFAOYSA-N 0 0 378.310 3.462 20 5 GGBDRN COc1ccc(C(=O)N2C[C@H](n3cccn3)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000173140028 1426361295 /nfs/dbraw/zinc/36/12/95/1426361295.db2.gz ZXBCATDDZZNGAW-MRXNPFEDSA-N 0 0 378.388 3.244 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173144007 1426363380 /nfs/dbraw/zinc/36/33/80/1426363380.db2.gz SNETYXNSWPPLLN-INIZCTEOSA-N 0 0 378.388 3.001 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173144388 1426363666 /nfs/dbraw/zinc/36/36/66/1426363666.db2.gz ZUDMWQGRQMWRCA-QGZVFWFLSA-N 0 0 378.388 3.001 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173144636 1426363728 /nfs/dbraw/zinc/36/37/28/1426363728.db2.gz GFPPXGSZSDMJMS-QGZVFWFLSA-N 0 0 391.431 3.424 20 5 GGBDRN COCCOC[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000173152701 1426367315 /nfs/dbraw/zinc/36/73/15/1426367315.db2.gz JRAKWHFOEPDTHT-MRXNPFEDSA-N 0 0 399.447 3.464 20 5 GGBDRN COc1cc(CCNC(=O)c2cccc(F)c2Cl)c([N+](=O)[O-])cc1OC ZINC000173158713 1426370306 /nfs/dbraw/zinc/37/03/06/1426370306.db2.gz ACDJHGQDFKOQAZ-UHFFFAOYSA-N 0 0 382.775 3.377 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1C ZINC000173165155 1426372756 /nfs/dbraw/zinc/37/27/56/1426372756.db2.gz BGSRLIBCXRFHGN-UHFFFAOYSA-N 0 0 377.422 3.226 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(NC(=O)N3CCCC3)c2)c1 ZINC000173169021 1426374655 /nfs/dbraw/zinc/37/46/55/1426374655.db2.gz HITDHNYQRHUKQJ-UHFFFAOYSA-N 0 0 382.420 3.461 20 5 GGBDRN CCOc1cc2c(cc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-])O[C@H](C)C2 ZINC000173169439 1426375062 /nfs/dbraw/zinc/37/50/62/1426375062.db2.gz HFNUOPYFVGQYMK-CYBMUJFWSA-N 0 0 385.420 3.392 20 5 GGBDRN Cc1oncc1C(=O)Nc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000173170838 1426376116 /nfs/dbraw/zinc/37/61/16/1426376116.db2.gz PGTZWDANPONOEB-UHFFFAOYSA-N 0 0 380.360 3.325 20 5 GGBDRN Cc1cnc([C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C2CC2)s1 ZINC000173173183 1426376824 /nfs/dbraw/zinc/37/68/24/1426376824.db2.gz LXQDUZNGOUWTQT-CYBMUJFWSA-N 0 0 394.840 3.219 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1(N2CCOCC2)CCCC1 ZINC000173181366 1426380914 /nfs/dbraw/zinc/38/09/14/1426380914.db2.gz WDFQGIZINCWYCU-ZDUSSCGKSA-N 0 0 381.860 3.012 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)c2cnn(C)c2)cc1 ZINC000173188805 1426383516 /nfs/dbraw/zinc/38/35/16/1426383516.db2.gz WSTLYKPMKXEJCU-UHFFFAOYSA-N 0 0 382.376 3.406 20 5 GGBDRN Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)CCn3cc([N+](=O)[O-])nc3C)cc2)n1 ZINC000173197720 1426387975 /nfs/dbraw/zinc/38/79/75/1426387975.db2.gz FWXOHXQSRVQTAT-HNNXBMFYSA-N 0 0 396.451 3.170 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)c1 ZINC000173220887 1426403062 /nfs/dbraw/zinc/40/30/62/1426403062.db2.gz CMJUNTWXQJSBAX-UHFFFAOYSA-N 0 0 382.420 3.330 20 5 GGBDRN COC(=O)c1cccc2c1CCCN2Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173224548 1426408228 /nfs/dbraw/zinc/40/82/28/1426408228.db2.gz QPDLZKBMDRRSFW-UHFFFAOYSA-N 0 0 394.387 3.384 20 5 GGBDRN Cc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cccc1N1CCNC1=O ZINC000173224479 1426408253 /nfs/dbraw/zinc/40/82/53/1426408253.db2.gz ZYJDDZILOSESFO-UHFFFAOYSA-N 0 0 396.447 3.484 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000173230154 1426414530 /nfs/dbraw/zinc/41/45/30/1426414530.db2.gz PSFVFXBAPGHJFJ-LLVKDONJSA-N 0 0 399.494 3.312 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000173230167 1426414853 /nfs/dbraw/zinc/41/48/53/1426414853.db2.gz PSFVFXBAPGHJFJ-NSHDSACASA-N 0 0 399.494 3.312 20 5 GGBDRN CCC(O)(CC)CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173248075 1426429039 /nfs/dbraw/zinc/42/90/39/1426429039.db2.gz MUNJLKPZJMVLDB-UHFFFAOYSA-N 0 0 377.363 3.083 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000173254466 1426433674 /nfs/dbraw/zinc/43/36/74/1426433674.db2.gz OCDJGECRLHIAJI-JSGCOSHPSA-N 0 0 380.422 3.358 20 5 GGBDRN CCc1ccc(C(=O)N(CC)Cc2nc3ccccc3c(=O)[nH]2)cc1[N+](=O)[O-] ZINC000173258154 1426436895 /nfs/dbraw/zinc/43/68/95/1426436895.db2.gz JBVYXWNJSYAMTL-UHFFFAOYSA-N 0 0 380.404 3.056 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCCCC[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000173258747 1426437778 /nfs/dbraw/zinc/43/77/78/1426437778.db2.gz QJABSEYABIPFQC-INIZCTEOSA-N 0 0 391.468 3.151 20 5 GGBDRN CCc1ccc(C(=O)N(CC)CC(=O)Nc2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000173259494 1426438069 /nfs/dbraw/zinc/43/80/69/1426438069.db2.gz JJVIALWQVIPRMM-UHFFFAOYSA-N 0 0 385.420 3.267 20 5 GGBDRN CCc1ccc(C(=O)N(CC)CC(=O)Nc2ccccc2OC)cc1[N+](=O)[O-] ZINC000173259588 1426438807 /nfs/dbraw/zinc/43/88/07/1426438807.db2.gz KRVPUHXWNIKVIK-UHFFFAOYSA-N 0 0 385.420 3.267 20 5 GGBDRN C[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC000173260761 1426439809 /nfs/dbraw/zinc/43/98/09/1426439809.db2.gz HYKKMQRGLYCIAN-ZDUSSCGKSA-N 0 0 387.440 3.339 20 5 GGBDRN O=C(Nc1ccc(-n2cncn2)cc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173279620 1426456709 /nfs/dbraw/zinc/45/67/09/1426456709.db2.gz MEBSEUPBYSJJFK-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN CCSCC[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000173283077 1426461221 /nfs/dbraw/zinc/46/12/21/1426461221.db2.gz WHAQTSVSNSWJEO-RHSMWYFYSA-N 0 0 393.509 3.156 20 5 GGBDRN CCc1ccc(C(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000173288391 1426467480 /nfs/dbraw/zinc/46/74/80/1426467480.db2.gz YTUPXGMENWEYDV-CYBMUJFWSA-N 0 0 390.461 3.394 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(-n3nnnc3SC)c2)cc1[N+](=O)[O-] ZINC000173291182 1426470653 /nfs/dbraw/zinc/47/06/53/1426470653.db2.gz LOWTXDDDFFMVDK-UHFFFAOYSA-N 0 0 384.421 3.107 20 5 GGBDRN CC(C)(C)OC(=O)NCc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)o1 ZINC000173295738 1426476158 /nfs/dbraw/zinc/47/61/58/1426476158.db2.gz YAGQBIDOYLGWPR-UHFFFAOYSA-N 0 0 387.392 3.415 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCC[C@@H]1c1ccc(C)o1 ZINC000173301908 1426484087 /nfs/dbraw/zinc/48/40/87/1426484087.db2.gz CKRWOASFGWPGHH-CQSZACIVSA-N 0 0 380.422 3.421 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)cc1[N+](=O)[O-] ZINC000173302547 1426484695 /nfs/dbraw/zinc/48/46/95/1426484695.db2.gz PZLSYEAUSZGYNN-UHFFFAOYSA-N 0 0 397.431 3.411 20 5 GGBDRN CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(C(=O)N(C)C)cc1 ZINC000173305875 1426487359 /nfs/dbraw/zinc/48/73/59/1426487359.db2.gz XPPWROXQEYJBPZ-UHFFFAOYSA-N 0 0 398.463 3.066 20 5 GGBDRN CC(C)[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000173312906 1426496762 /nfs/dbraw/zinc/49/67/62/1426496762.db2.gz AXNIJZXIKINYMB-LJQANCHMSA-N 0 0 381.436 3.421 20 5 GGBDRN COc1cccc([C@@H](O)CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000173317004 1426500427 /nfs/dbraw/zinc/50/04/27/1426500427.db2.gz JYSWLWRHXOLCJJ-HNNXBMFYSA-N 0 0 384.310 3.086 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1[N+](=O)[O-] ZINC000173321760 1426504193 /nfs/dbraw/zinc/50/41/93/1426504193.db2.gz ZRRFMOZLSCYOCW-UHFFFAOYSA-N 0 0 396.447 3.352 20 5 GGBDRN CCC[C@@H](C)c1cc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])n[nH]1 ZINC000173325145 1426507211 /nfs/dbraw/zinc/50/72/11/1426507211.db2.gz BYBIKLNMMGHMRR-SNVBAGLBSA-N 0 0 393.831 3.243 20 5 GGBDRN CCc1ccc(C(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000173330540 1426511568 /nfs/dbraw/zinc/51/15/68/1426511568.db2.gz OCXXJRHHILHGAM-UHFFFAOYSA-N 0 0 381.432 3.210 20 5 GGBDRN COc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OCC(=O)NC1CC1 ZINC000173338383 1426518988 /nfs/dbraw/zinc/51/89/88/1426518988.db2.gz YRBGSWVSTXWIQQ-CYBMUJFWSA-N 0 0 385.420 3.434 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccccc2CN2C(=O)CCC2=O)cc1[N+](=O)[O-] ZINC000173345186 1426523872 /nfs/dbraw/zinc/52/38/72/1426523872.db2.gz NFRIIZHPRQXFJY-UHFFFAOYSA-N 0 0 381.388 3.059 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1coc(-c2ccccc2)n1 ZINC000173346636 1426524606 /nfs/dbraw/zinc/52/46/06/1426524606.db2.gz OBZHGGZMFRGAFZ-UHFFFAOYSA-N 0 0 393.808 3.382 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1coc(-c2ccccc2)n1 ZINC000173350241 1426527853 /nfs/dbraw/zinc/52/78/53/1426527853.db2.gz VJGQUSSRQITPNN-UHFFFAOYSA-N 0 0 393.808 3.382 20 5 GGBDRN Cc1cc(C(=O)NCc2cc(N(C)C)nc3ccccc23)c(N)c([N+](=O)[O-])c1 ZINC000173354418 1426530800 /nfs/dbraw/zinc/53/08/00/1426530800.db2.gz ATNVTFQILBZZIU-UHFFFAOYSA-N 0 0 379.420 3.030 20 5 GGBDRN CS(=O)(=O)N1CCC(CNC(=O)c2c3ccccc3cc3ccccc32)CC1 ZINC000173359649 1426534081 /nfs/dbraw/zinc/53/40/81/1426534081.db2.gz JFHDMUAKAQZFGN-UHFFFAOYSA-N 0 0 396.512 3.394 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000173358819 1426534323 /nfs/dbraw/zinc/53/43/23/1426534323.db2.gz YGBGECOBVXPNDV-QGZVFWFLSA-N 0 0 375.469 3.072 20 5 GGBDRN CCc1ccc(C(=O)NCC(=O)Nc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000173363511 1426537092 /nfs/dbraw/zinc/53/70/92/1426537092.db2.gz XWSWHCMIDLCBCE-UHFFFAOYSA-N 0 0 378.388 3.074 20 5 GGBDRN Cc1c(CSC(C)C)cccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000173369996 1426543699 /nfs/dbraw/zinc/54/36/99/1426543699.db2.gz UHRBKUQGZRFLLB-UHFFFAOYSA-N 0 0 375.450 3.345 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(NC(=O)c3cc(C)oc3C)CC2)cc1[N+](=O)[O-] ZINC000173374064 1426547763 /nfs/dbraw/zinc/54/77/63/1426547763.db2.gz NVNOCOFKDFFXBY-UHFFFAOYSA-N 0 0 399.447 3.402 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN(CCO)[C@@H]3CCc4ccccc43)o2)cc1 ZINC000173387357 1426565403 /nfs/dbraw/zinc/56/54/03/1426565403.db2.gz AMLHPWXLEYKICZ-GOSISDBHSA-N 0 0 380.404 3.127 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@H](c2nc(C)cs2)C2CC2)cc([N+](=O)[O-])c1 ZINC000173395192 1426573633 /nfs/dbraw/zinc/57/36/33/1426573633.db2.gz MKOBKCZCDXOYIJ-HNNXBMFYSA-N 0 0 389.433 3.418 20 5 GGBDRN C[C@H]1CN(c2ccc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)cc2)CCO1 ZINC000173397749 1426578562 /nfs/dbraw/zinc/57/85/62/1426578562.db2.gz VAZKYUBMOBBLGC-HNNXBMFYSA-N 0 0 384.436 3.184 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C2CC2)n1 ZINC000173403927 1426588092 /nfs/dbraw/zinc/58/80/92/1426588092.db2.gz DDGOOUXBFGOIMY-AWEZNQCLSA-N 0 0 376.394 3.457 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C2CC2)n1 ZINC000173407740 1426590355 /nfs/dbraw/zinc/59/03/55/1426590355.db2.gz WRTRXQRYKHXPAO-MRXNPFEDSA-N 0 0 398.448 3.130 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H](C)Oc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000173412589 1426595158 /nfs/dbraw/zinc/59/51/58/1426595158.db2.gz GFYXQMSSQASMSS-LLVKDONJSA-N 0 0 391.811 3.079 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)N1CCCC[C@@H]1C ZINC000173413833 1426596302 /nfs/dbraw/zinc/59/63/02/1426596302.db2.gz XXTVHBSAIBNZDK-WDEREUQCSA-N 0 0 387.358 3.133 20 5 GGBDRN Cc1ccccc1O[C@@H](C)CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000173415319 1426598434 /nfs/dbraw/zinc/59/84/34/1426598434.db2.gz AZGNAXKKEKPHBE-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1ccc(O[C@@H](C)CNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000173422609 1426604275 /nfs/dbraw/zinc/60/42/75/1426604275.db2.gz LMNZETXXYKHUOV-LBPRGKRZSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1 ZINC000173425874 1426607788 /nfs/dbraw/zinc/60/77/88/1426607788.db2.gz XONPVONTBBNSOU-GUYCJALGSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000173426450 1426608527 /nfs/dbraw/zinc/60/85/27/1426608527.db2.gz DRIUYBGZAXAALB-ACJLOTCBSA-N 0 0 394.424 3.193 20 5 GGBDRN CN(CC(=O)Nc1cccc(N2CCCCC2=O)c1)c1ccccc1[N+](=O)[O-] ZINC000173434587 1426615675 /nfs/dbraw/zinc/61/56/75/1426615675.db2.gz CTFQAONCXGOBEF-UHFFFAOYSA-N 0 0 382.420 3.187 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cn3ncc4ccc([N+](=O)[O-])cc43)CC2)cc1 ZINC000173435099 1426616254 /nfs/dbraw/zinc/61/62/54/1426616254.db2.gz FVRDMOJBBPRRIP-UHFFFAOYSA-N 0 0 397.391 3.354 20 5 GGBDRN CSCc1nn(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(=S)o1 ZINC000173435452 1426616716 /nfs/dbraw/zinc/61/67/16/1426616716.db2.gz YGWNTZGAPXXNAV-UHFFFAOYSA-N 0 0 396.494 3.478 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(C[S@](=O)CCOC)c2)cc1[N+](=O)[O-] ZINC000173436633 1426617642 /nfs/dbraw/zinc/61/76/42/1426617642.db2.gz HFWJWJGQVRJAAA-HHHXNRCGSA-N 0 0 390.461 3.305 20 5 GGBDRN Cn1cc(N2CC[C@H](NC(=O)c3c4ccccc4cc4ccccc43)C2=O)cn1 ZINC000173440192 1426620751 /nfs/dbraw/zinc/62/07/51/1426620751.db2.gz NVDZGSNUCOJLPW-FQEVSTJZSA-N 0 0 384.439 3.262 20 5 GGBDRN CCc1ccc(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000173443285 1426623511 /nfs/dbraw/zinc/62/35/11/1426623511.db2.gz QEBTVRVTQQDOPD-UHFFFAOYSA-N 0 0 396.852 3.014 20 5 GGBDRN C[C@@H]1CN(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)[C@@H]1c1ccccc1 ZINC000173457824 1426633799 /nfs/dbraw/zinc/63/37/99/1426633799.db2.gz GSGUSBJMLBYIKQ-YMTYPPQLSA-N 0 0 394.431 3.012 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(-n3nnnc3C3CC3)ccc2F)cc1[N+](=O)[O-] ZINC000173459875 1426635047 /nfs/dbraw/zinc/63/50/47/1426635047.db2.gz ZANLFWDPJRSXKS-UHFFFAOYSA-N 0 0 396.382 3.402 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173464212 1426639044 /nfs/dbraw/zinc/63/90/44/1426639044.db2.gz MOWMTAYJMMIMCK-CQSZACIVSA-N 0 0 389.843 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3nc4ccccc4n3C(F)F)C2)nc1 ZINC000173472296 1426646202 /nfs/dbraw/zinc/64/62/02/1426646202.db2.gz GQZBBQUDFGSWGE-LBPRGKRZSA-N 0 0 388.378 3.421 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3nc4ccccc4n3C(F)F)C2)nc1 ZINC000173472319 1426646448 /nfs/dbraw/zinc/64/64/48/1426646448.db2.gz GQZBBQUDFGSWGE-GFCCVEGCSA-N 0 0 388.378 3.421 20 5 GGBDRN CC[C@@]1(C)CCCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000173485857 1426658930 /nfs/dbraw/zinc/65/89/30/1426658930.db2.gz OZRJZKIREBMGEG-IBGZPJMESA-N 0 0 375.425 3.322 20 5 GGBDRN CCS[C@@H]1CC[C@H](N(C)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C1 ZINC000173486237 1426659491 /nfs/dbraw/zinc/65/94/91/1426659491.db2.gz FQZKYTANQBVOGM-DOTOQJQBSA-N 0 0 388.493 3.382 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1)c1ccccc1[N+](=O)[O-] ZINC000173499697 1426668766 /nfs/dbraw/zinc/66/87/66/1426668766.db2.gz QCIDGIJOWVJLOL-AREMUKBSSA-N 0 0 395.868 3.202 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)CN(C)c2ccccc21 ZINC000173506248 1426675682 /nfs/dbraw/zinc/67/56/82/1426675682.db2.gz JFFYAPJKWIPPCH-ZDUSSCGKSA-N 0 0 375.450 3.184 20 5 GGBDRN CC(C)Nc1ccc(F)cc1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000173510937 1426680167 /nfs/dbraw/zinc/68/01/67/1426680167.db2.gz KIRPKZZOCLLUJN-UHFFFAOYSA-N 0 0 384.371 3.387 20 5 GGBDRN NC(=O)CCOc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173514032 1426684185 /nfs/dbraw/zinc/68/41/85/1426684185.db2.gz SGMHUBSJJZBVNL-UHFFFAOYSA-N 0 0 397.309 3.120 20 5 GGBDRN C[C@@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000173522076 1426695766 /nfs/dbraw/zinc/69/57/66/1426695766.db2.gz XTAPSIBWSVBNQP-OAHLLOKOSA-N 0 0 394.435 3.253 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)Oc3cc(F)ccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000173527033 1426700390 /nfs/dbraw/zinc/70/03/90/1426700390.db2.gz SALCXTWMJSHEJC-SECBINFHSA-N 0 0 375.312 3.378 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)Oc3cc(F)ccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000173528923 1426702938 /nfs/dbraw/zinc/70/29/38/1426702938.db2.gz GZYNDUQLHNZJTC-NSHDSACASA-N 0 0 397.366 3.051 20 5 GGBDRN Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000173551522 1426724155 /nfs/dbraw/zinc/72/41/55/1426724155.db2.gz FNUFUZWERYFNBY-GOSISDBHSA-N 0 0 383.448 3.349 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CC[C@@H](CSc2ccccc2)C1 ZINC000173563656 1426733149 /nfs/dbraw/zinc/73/31/49/1426733149.db2.gz CVISFHZFWADGBH-CQSZACIVSA-N 0 0 385.445 3.174 20 5 GGBDRN CN(CC(=O)Nc1ccccc1NC(=O)N1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000173569585 1426736912 /nfs/dbraw/zinc/73/69/12/1426736912.db2.gz XFJFRZCBQSOXDH-UHFFFAOYSA-N 0 0 397.435 3.297 20 5 GGBDRN COc1cc(CCNC(=O)N([C@H](C)C2CC2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000173572219 1426738234 /nfs/dbraw/zinc/73/82/34/1426738234.db2.gz XXKCJXWYGDNPIH-GFCCVEGCSA-N 0 0 377.441 3.127 20 5 GGBDRN COc1cc(CCNC(=O)N2CCC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000173572542 1426739198 /nfs/dbraw/zinc/73/91/98/1426739198.db2.gz HCKXFKOJGRWLFZ-HIFRSBDPSA-N 0 0 377.441 3.129 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](c2ccccc2C)OC[C@H]1C ZINC000173574638 1426741833 /nfs/dbraw/zinc/74/18/33/1426741833.db2.gz ISWZSRJWFAJNSX-FOIQADDNSA-N 0 0 399.447 3.312 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@H](C)CO1 ZINC000173575399 1426743277 /nfs/dbraw/zinc/74/32/77/1426743277.db2.gz PWIRHFIVQGOWPC-IERDGZPVSA-N 0 0 395.459 3.254 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]3CCC[C@@H]32)cc1Br ZINC000173584627 1426748579 /nfs/dbraw/zinc/74/85/79/1426748579.db2.gz RYCAOBJVNOLNPD-MFKMUULPSA-N 0 0 389.271 3.311 20 5 GGBDRN Cc1cnc([C@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C2CC2)s1 ZINC000173590117 1426753969 /nfs/dbraw/zinc/75/39/69/1426753969.db2.gz APJBGOWZMGSOQL-CQSZACIVSA-N 0 0 376.394 3.457 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(-c2nnn[n-]2)c1 ZINC000826499847 1426754131 /nfs/dbraw/zinc/75/41/31/1426754131.db2.gz AKRGXFUJSNYZPW-MAUKXSAKSA-N 0 0 378.436 3.276 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000173595004 1426758926 /nfs/dbraw/zinc/75/89/26/1426758926.db2.gz OPLCSANJYIBSBI-DNVCBOLYSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](C)CO1 ZINC000173594362 1426759565 /nfs/dbraw/zinc/75/95/65/1426759565.db2.gz CVMIHYPPDUBEDK-DYVFJYSZSA-N 0 0 394.424 3.193 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1)C1CC1 ZINC000173600778 1426769839 /nfs/dbraw/zinc/76/98/39/1426769839.db2.gz OWBZWQPJPJMDEH-UHFFFAOYSA-N 0 0 396.447 3.181 20 5 GGBDRN Cc1cnc([C@H](NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C2CC2)s1 ZINC000173612464 1426789135 /nfs/dbraw/zinc/78/91/35/1426789135.db2.gz HIQYVKPOYZTXKE-MRXNPFEDSA-N 0 0 398.448 3.130 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C2CC2)s1 ZINC000173612476 1426789558 /nfs/dbraw/zinc/78/95/58/1426789558.db2.gz HIQYVKPOYZTXKE-INIZCTEOSA-N 0 0 398.448 3.130 20 5 GGBDRN Cc1ccc(C)c(NC(=O)C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000173614214 1426791979 /nfs/dbraw/zinc/79/19/79/1426791979.db2.gz MPKOJTKSOIHPDH-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN CCc1ccc(NC(=O)C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173614251 1426792026 /nfs/dbraw/zinc/79/20/26/1426792026.db2.gz UEYADSVDSJGMQT-UHFFFAOYSA-N 0 0 397.431 3.166 20 5 GGBDRN Cc1cccc(NC(=O)C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000173614325 1426792514 /nfs/dbraw/zinc/79/25/14/1426792514.db2.gz YWWXVMXDQLIGAE-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN CCc1ccccc1NC(=O)C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173614288 1426793039 /nfs/dbraw/zinc/79/30/39/1426793039.db2.gz VKQLNHNZWFNUHV-UHFFFAOYSA-N 0 0 397.431 3.166 20 5 GGBDRN Cc1c(COc2ccccc2)cccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000173622568 1426801045 /nfs/dbraw/zinc/80/10/45/1426801045.db2.gz RSVJEECSTANJKY-UHFFFAOYSA-N 0 0 393.399 3.283 20 5 GGBDRN COc1ccc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000173630707 1426803016 /nfs/dbraw/zinc/80/30/16/1426803016.db2.gz CNRBXQLQJJKINQ-KRWDZBQOSA-N 0 0 397.431 3.028 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173632229 1426803447 /nfs/dbraw/zinc/80/34/47/1426803447.db2.gz AALFXMOIXHNZQU-UHFFFAOYSA-N 0 0 385.376 3.116 20 5 GGBDRN O=C(COc1ccc(F)cc1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173634696 1426804423 /nfs/dbraw/zinc/80/44/23/1426804423.db2.gz LWFVPAVAYADCIT-UHFFFAOYSA-N 0 0 392.358 3.322 20 5 GGBDRN COc1ccccc1NCC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173635088 1426804506 /nfs/dbraw/zinc/80/45/06/1426804506.db2.gz WMTCMMXTJPQSOZ-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN CCn1nc(C)c(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1Cl ZINC000173635743 1426804838 /nfs/dbraw/zinc/80/48/38/1426804838.db2.gz OHZNPHHZCVVBMQ-UHFFFAOYSA-N 0 0 392.843 3.457 20 5 GGBDRN COc1ccc(CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1F ZINC000173636288 1426805151 /nfs/dbraw/zinc/80/51/51/1426805151.db2.gz LQSAWIJQSNLWBM-UHFFFAOYSA-N 0 0 388.395 3.355 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCCC[C@H]1CNC(=O)c1ccccc1 ZINC000173638169 1426805781 /nfs/dbraw/zinc/80/57/81/1426805781.db2.gz OVRLQURQOFMMIQ-IXDOJHRFSA-N 0 0 393.443 3.419 20 5 GGBDRN O=C([C@H]1CC(c2ccccc2)=NO1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173638905 1426805892 /nfs/dbraw/zinc/80/58/92/1426805892.db2.gz LCYMVHINIPIQGZ-HXUWFJFHSA-N 0 0 395.415 3.158 20 5 GGBDRN CN(C)[C@@H](C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000173641086 1426806879 /nfs/dbraw/zinc/80/68/79/1426806879.db2.gz KGCBAKNDHHVYEF-HXUWFJFHSA-N 0 0 383.448 3.268 20 5 GGBDRN C[C@H](C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N1CCc2ccccc21 ZINC000173642798 1426807510 /nfs/dbraw/zinc/80/75/10/1426807510.db2.gz JZYQTBAYWGJCHV-MRXNPFEDSA-N 0 0 395.459 3.416 20 5 GGBDRN Cc1noc(Cl)c1CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173642916 1426807651 /nfs/dbraw/zinc/80/76/51/1426807651.db2.gz CUAVLJDMAUFLPF-UHFFFAOYSA-N 0 0 379.800 3.157 20 5 GGBDRN Cc1cc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc([N+](=O)[O-])c1 ZINC000173642865 1426807697 /nfs/dbraw/zinc/80/76/97/1426807697.db2.gz WKLLKJNHLHSVQI-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN Cc1ccc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000173643574 1426808029 /nfs/dbraw/zinc/80/80/29/1426808029.db2.gz XZYCAGVJQABFDX-SFHVURJKSA-N 0 0 381.432 3.328 20 5 GGBDRN O=C(CSCc1ccncc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173644402 1426808246 /nfs/dbraw/zinc/80/82/46/1426808246.db2.gz DGFSVSLHOVSXTF-UHFFFAOYSA-N 0 0 387.461 3.293 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1CNC(=O)c1ccccc1 ZINC000173650128 1426810145 /nfs/dbraw/zinc/81/01/45/1426810145.db2.gz XPMWLLLABMGMAT-SFHVURJKSA-N 0 0 381.432 3.328 20 5 GGBDRN COc1ccc(NC(=O)CN2CC[C@@H](COCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000173656433 1426811858 /nfs/dbraw/zinc/81/18/58/1426811858.db2.gz PSTXKDCDVQADJX-QGZVFWFLSA-N 0 0 399.447 3.081 20 5 GGBDRN COc1cc(C(=O)N2CCN(C)c3ccc(Cl)cc32)c([N+](=O)[O-])cc1OC ZINC000173669172 1426815516 /nfs/dbraw/zinc/81/55/16/1426815516.db2.gz JLPKZUVALUAECK-UHFFFAOYSA-N 0 0 391.811 3.362 20 5 GGBDRN COC[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(C)o1 ZINC000173689263 1426821648 /nfs/dbraw/zinc/82/16/48/1426821648.db2.gz MDELDWQQLXALQK-INIZCTEOSA-N 0 0 387.436 3.217 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@@H](COCc2ccccc2)C1 ZINC000173693158 1426822833 /nfs/dbraw/zinc/82/28/33/1426822833.db2.gz WOYZCOGYTILKGC-QGZVFWFLSA-N 0 0 390.461 3.131 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](c2ccccc2)CO1 ZINC000173693911 1426823092 /nfs/dbraw/zinc/82/30/92/1426823092.db2.gz ASIWKSXTFDLJLK-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN COc1ccc(NC(=O)CN(C)[C@@H](C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC000173695336 1426823508 /nfs/dbraw/zinc/82/35/08/1426823508.db2.gz CTGHXOFIRXDGCA-AWEZNQCLSA-N 0 0 387.436 3.114 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@H](COCc2ccccc2)C1 ZINC000173694812 1426823593 /nfs/dbraw/zinc/82/35/93/1426823593.db2.gz MUACLTIBEVAXLC-KRWDZBQOSA-N 0 0 390.461 3.131 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](COCc2ccccc2)C1 ZINC000173695907 1426823836 /nfs/dbraw/zinc/82/38/36/1426823836.db2.gz DYYNXEHNMRTQSS-KRWDZBQOSA-N 0 0 390.461 3.131 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CC[C@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000173696940 1426823877 /nfs/dbraw/zinc/82/38/77/1426823877.db2.gz HCLSVDBSJKUINZ-KRWDZBQOSA-N 0 0 390.461 3.131 20 5 GGBDRN Cc1noc(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 ZINC000173703525 1426826324 /nfs/dbraw/zinc/82/63/24/1426826324.db2.gz CQGIWYKYCHLBLR-UHFFFAOYSA-N 0 0 384.314 3.325 20 5 GGBDRN O=C(NCCCOCC1CCOCC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173705902 1426827286 /nfs/dbraw/zinc/82/72/86/1426827286.db2.gz DZRZOICISHWAFU-UHFFFAOYSA-N 0 0 390.358 3.177 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1nc(C(F)(F)F)cs1 ZINC000173720786 1426830944 /nfs/dbraw/zinc/83/09/44/1426830944.db2.gz VYTXVENUSDOKRW-UHFFFAOYSA-N 0 0 388.371 3.408 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000173728446 1426832854 /nfs/dbraw/zinc/83/28/54/1426832854.db2.gz IESOHOJZYHGLSN-UHFFFAOYSA-N 0 0 385.327 3.219 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@H](c2ccccc2)CO1 ZINC000173731416 1426833746 /nfs/dbraw/zinc/83/37/46/1426833746.db2.gz DMBRONLTLKGYGK-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN COc1cc(C(=O)N2C[C@@H](C)CN(C)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000173731152 1426833769 /nfs/dbraw/zinc/83/37/69/1426833769.db2.gz VWJYDIRCGLGESC-ZDUSSCGKSA-N 0 0 385.420 3.345 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](c2ccccc2)CO1 ZINC000173731431 1426833908 /nfs/dbraw/zinc/83/39/08/1426833908.db2.gz DMBRONLTLKGYGK-FOIQADDNSA-N 0 0 392.415 3.383 20 5 GGBDRN COC[C@@H](NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000173735353 1426834985 /nfs/dbraw/zinc/83/49/85/1426834985.db2.gz FAGGYWBHCANCAV-GFCCVEGCSA-N 0 0 383.198 3.376 20 5 GGBDRN COC(=O)c1cc(C(=O)N2C[C@@H](C)CN(C)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000173743347 1426837055 /nfs/dbraw/zinc/83/70/55/1426837055.db2.gz OGJISJZABKAQBD-ZDUSSCGKSA-N 0 0 383.404 3.114 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Oc1ccc(OCC(F)(F)F)cc1 ZINC000173749337 1426838910 /nfs/dbraw/zinc/83/89/10/1426838910.db2.gz SROVNOVRBJPJOC-UHFFFAOYSA-N 0 0 395.286 3.443 20 5 GGBDRN Cc1cc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])n(Cc2ccccc2)n1 ZINC000173749777 1426839406 /nfs/dbraw/zinc/83/94/06/1426839406.db2.gz BZXVDJXWLCCGSO-UHFFFAOYSA-N 0 0 379.420 3.223 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000173760472 1426842734 /nfs/dbraw/zinc/84/27/34/1426842734.db2.gz VZRXGUXKEHTSHU-AWEZNQCLSA-N 0 0 378.450 3.164 20 5 GGBDRN O=C(N[C@H]1CCCC[C@H]1n1cccn1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000173760481 1426842765 /nfs/dbraw/zinc/84/27/65/1426842765.db2.gz PGMLSHDRWPJMDR-DLBZAZTESA-N 0 0 383.452 3.305 20 5 GGBDRN O=C(NCCN1CCc2sccc2C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173761485 1426843110 /nfs/dbraw/zinc/84/31/10/1426843110.db2.gz XGLDRAIIQFJNCS-UHFFFAOYSA-N 0 0 399.394 3.463 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCC(C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000173770089 1426845597 /nfs/dbraw/zinc/84/55/97/1426845597.db2.gz DUSZLFRVPSQYRF-UHFFFAOYSA-N 0 0 375.347 3.206 20 5 GGBDRN C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)NCc1ccccc1 ZINC000173775351 1426847723 /nfs/dbraw/zinc/84/77/23/1426847723.db2.gz KRZXSWITHUAFJW-NSHDSACASA-N 0 0 395.337 3.048 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)cccc1[N+](=O)[O-] ZINC000173778807 1426848771 /nfs/dbraw/zinc/84/87/71/1426848771.db2.gz ZFPCWYVWVGCGHK-QGZVFWFLSA-N 0 0 387.411 3.364 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)cccc1[N+](=O)[O-] ZINC000173778792 1426848821 /nfs/dbraw/zinc/84/88/21/1426848821.db2.gz ZFPCWYVWVGCGHK-KRWDZBQOSA-N 0 0 387.411 3.364 20 5 GGBDRN CN(CC(=O)N[C@@H]1CCOc2c(Cl)cccc21)c1ccccc1[N+](=O)[O-] ZINC000173779806 1426849081 /nfs/dbraw/zinc/84/90/81/1426849081.db2.gz DBACRLXOFVSQTJ-CQSZACIVSA-N 0 0 375.812 3.324 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CNC(=O)c1cc2ccccc2[nH]1 ZINC000173782925 1426850180 /nfs/dbraw/zinc/85/01/80/1426850180.db2.gz GZKGQYXWHRNZQM-UHFFFAOYSA-N 0 0 394.431 3.243 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H](C)n1nnc(-c2ccccc2)n1 ZINC000173782994 1426850209 /nfs/dbraw/zinc/85/02/09/1426850209.db2.gz SNKJMEHJWFXULO-HNNXBMFYSA-N 0 0 394.435 3.247 20 5 GGBDRN COC(C)(C)C[C@H](C)NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173785051 1426850941 /nfs/dbraw/zinc/85/09/41/1426850941.db2.gz GHUUFHUDGIRPEK-AWEZNQCLSA-N 0 0 379.457 3.351 20 5 GGBDRN O=C(Nc1ccc2c(c1)C(=O)N(c1ccc(F)cc1)C2=O)c1ccc([N+](=O)[O-])o1 ZINC000173787162 1426851368 /nfs/dbraw/zinc/85/13/68/1426851368.db2.gz VEPUKIKYTPXLHO-UHFFFAOYSA-N 0 0 395.302 3.380 20 5 GGBDRN CC(=O)c1ccc(NC(=O)CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173798398 1426853941 /nfs/dbraw/zinc/85/39/41/1426853941.db2.gz CDDJGATYKOFHBY-UHFFFAOYSA-N 0 0 397.431 3.279 20 5 GGBDRN O=C(NC1CC1)[C@H](c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173799672 1426854275 /nfs/dbraw/zinc/85/42/75/1426854275.db2.gz QSZUFZYWIAHURK-NRFANRHFSA-N 0 0 395.459 3.458 20 5 GGBDRN Nc1nc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)nc2ccccc12 ZINC000173799196 1426854347 /nfs/dbraw/zinc/85/43/47/1426854347.db2.gz ALIDOBCBVSCSLD-UHFFFAOYSA-N 0 0 379.420 3.164 20 5 GGBDRN C[C@@H](C1CC1)N(C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000173799545 1426854370 /nfs/dbraw/zinc/85/43/70/1426854370.db2.gz NKMYXOIHVYCHCU-HNNXBMFYSA-N 0 0 387.480 3.228 20 5 GGBDRN O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)Nc1cccnc1Cl ZINC000173799656 1426854403 /nfs/dbraw/zinc/85/44/03/1426854403.db2.gz CTSHIDLBJBTTTB-UHFFFAOYSA-N 0 0 390.827 3.125 20 5 GGBDRN CS(=O)(=O)c1c(Cl)cccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000173804879 1426855889 /nfs/dbraw/zinc/85/58/89/1426855889.db2.gz PORUKVCAVZOMBN-UHFFFAOYSA-N 0 0 397.840 3.092 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000173807272 1426856526 /nfs/dbraw/zinc/85/65/26/1426856526.db2.gz CRLLFMIRKFHCOZ-AWEZNQCLSA-N 0 0 388.804 3.053 20 5 GGBDRN O=C(c1c[nH]cc1-c1ccc(F)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173812773 1426858291 /nfs/dbraw/zinc/85/82/91/1426858291.db2.gz AKQPASIJNWNXTA-OAHLLOKOSA-N 0 0 395.394 3.451 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000173823841 1426860874 /nfs/dbraw/zinc/86/08/74/1426860874.db2.gz PDKYVLRAAYMBIU-OAHLLOKOSA-N 0 0 377.441 3.375 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1CN(C)C(=O)OC(C)(C)C ZINC000173827291 1426861931 /nfs/dbraw/zinc/86/19/31/1426861931.db2.gz XLUVGBRXSQTKHS-HNNXBMFYSA-N 0 0 377.441 3.375 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1CN(C)C(=O)OC(C)(C)C ZINC000173827281 1426861985 /nfs/dbraw/zinc/86/19/85/1426861985.db2.gz XLUVGBRXSQTKHS-OAHLLOKOSA-N 0 0 377.441 3.375 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](C)c1cccc(-n2cccn2)c1 ZINC000173826903 1426862065 /nfs/dbraw/zinc/86/20/65/1426862065.db2.gz FGCZIGZCWWZYGD-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000173827595 1426862424 /nfs/dbraw/zinc/86/24/24/1426862424.db2.gz BIKMGOBBRPQFPS-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173832557 1426863981 /nfs/dbraw/zinc/86/39/81/1426863981.db2.gz DNPBSKNPNQTGGZ-UHFFFAOYSA-N 0 0 398.463 3.135 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC1(c2cccc(F)c2)CCOCC1 ZINC000173845768 1426868697 /nfs/dbraw/zinc/86/86/97/1426868697.db2.gz VZBGMZQWYMDBPC-UHFFFAOYSA-N 0 0 387.411 3.358 20 5 GGBDRN O=C([C@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000173847082 1426869006 /nfs/dbraw/zinc/86/90/06/1426869006.db2.gz CQDLKYAYNPSMLK-HNNXBMFYSA-N 0 0 385.807 3.190 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173849922 1426870457 /nfs/dbraw/zinc/87/04/57/1426870457.db2.gz WOYHAAHEHRDKLO-KRWDZBQOSA-N 0 0 398.444 3.092 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000173851548 1426871134 /nfs/dbraw/zinc/87/11/34/1426871134.db2.gz CHSLXPLZYDWMJO-INIZCTEOSA-N 0 0 398.444 3.092 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CCN(CC2CC2)c2ccccc21 ZINC000173851550 1426871282 /nfs/dbraw/zinc/87/12/82/1426871282.db2.gz PETPSHRIEZNTHB-UHFFFAOYSA-N 0 0 391.424 3.159 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000173859287 1426873154 /nfs/dbraw/zinc/87/31/54/1426873154.db2.gz DKUUVLSNQARGDK-OAHLLOKOSA-N 0 0 389.456 3.034 20 5 GGBDRN COCCOc1c(Cl)cccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173859075 1426873275 /nfs/dbraw/zinc/87/32/75/1426873275.db2.gz LKXDATHXLHJHEG-UHFFFAOYSA-N 0 0 393.827 3.348 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(C)cc1-c1nc(C2CC2)no1 ZINC000173863724 1426874648 /nfs/dbraw/zinc/87/46/48/1426874648.db2.gz FYOQDZNJTUBBOY-UHFFFAOYSA-N 0 0 396.407 3.364 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc(-n3cncn3)cc2C)c([N+](=O)[O-])c1 ZINC000173880124 1426879909 /nfs/dbraw/zinc/87/99/09/1426879909.db2.gz JGFZYOXMKATBAV-UHFFFAOYSA-N 0 0 394.435 3.024 20 5 GGBDRN CCCCS(=O)(=O)Nc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000173888678 1426882413 /nfs/dbraw/zinc/88/24/13/1426882413.db2.gz YXPYOGBUWNMVIM-UHFFFAOYSA-N 0 0 391.449 3.318 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCN1C(=O)OC(C)(C)C ZINC000173919530 1426891938 /nfs/dbraw/zinc/89/19/38/1426891938.db2.gz JAZIFMVBGQPSEW-NSHDSACASA-N 0 0 383.832 3.330 20 5 GGBDRN C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccc(Cl)cc1 ZINC000821581184 1426893680 /nfs/dbraw/zinc/89/36/80/1426893680.db2.gz FBPOVJGEDGADHV-MRXNPFEDSA-N 0 0 387.831 3.143 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])c2cc(Cl)ccc2O1 ZINC000173926296 1426894815 /nfs/dbraw/zinc/89/48/15/1426894815.db2.gz CBRRDBSCCMTWLV-SECBINFHSA-N 0 0 386.788 3.364 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)Cc3ccc(F)cc3)CC2)cc1 ZINC000173930409 1426896536 /nfs/dbraw/zinc/89/65/36/1426896536.db2.gz KVMOHRFFPCJEIO-UHFFFAOYSA-N 0 0 394.424 3.107 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)cc1 ZINC000173930164 1426896680 /nfs/dbraw/zinc/89/66/80/1426896680.db2.gz GMSLQVXTMMTYCT-UHFFFAOYSA-N 0 0 398.387 3.105 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)Cc3ccccc3F)CC2)cc1 ZINC000173930360 1426896698 /nfs/dbraw/zinc/89/66/98/1426896698.db2.gz VCOAIOZXAUCSGC-UHFFFAOYSA-N 0 0 394.424 3.107 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)c3cccc(F)c3F)CC2)cc1 ZINC000173930549 1426896798 /nfs/dbraw/zinc/89/67/98/1426896798.db2.gz CLWWMPLTXHMKEV-UHFFFAOYSA-N 0 0 398.387 3.105 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1F ZINC000173930880 1426897189 /nfs/dbraw/zinc/89/71/89/1426897189.db2.gz YXYQFSRQZWMVTB-UHFFFAOYSA-N 0 0 394.424 3.274 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)ccc1F ZINC000173930797 1426897267 /nfs/dbraw/zinc/89/72/67/1426897267.db2.gz YSILKWBVHCAXTN-UHFFFAOYSA-N 0 0 394.424 3.274 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173930658 1426897311 /nfs/dbraw/zinc/89/73/11/1426897311.db2.gz IUSRCXJGZSUUEF-UHFFFAOYSA-N 0 0 376.434 3.135 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CCN1C(=O)OC(C)(C)C ZINC000173930811 1426897335 /nfs/dbraw/zinc/89/73/35/1426897335.db2.gz VBGKTUCZZWUSGQ-NSHDSACASA-N 0 0 383.832 3.330 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)CC[C@@H]1c1ccccc1 ZINC000173938202 1426900200 /nfs/dbraw/zinc/90/02/00/1426900200.db2.gz DRFVAGXQMUEVJD-QAPCUYQASA-N 0 0 391.431 3.441 20 5 GGBDRN COc1ccc2c(c1)N(Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C[C@H](C)O2 ZINC000173946078 1426904157 /nfs/dbraw/zinc/90/41/57/1426904157.db2.gz UPMVENKUPGAZQZ-LBPRGKRZSA-N 0 0 382.376 3.441 20 5 GGBDRN C[C@@H]1CN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000173957340 1426909200 /nfs/dbraw/zinc/90/92/00/1426909200.db2.gz VRRNOWZMEDTKIP-XIKOKIGWSA-N 0 0 385.445 3.005 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@@H](O)c2cccc(Br)c2)nc1-c1ccncc1 ZINC000173959640 1426909945 /nfs/dbraw/zinc/90/99/45/1426909945.db2.gz KTNGFCHTDLFIQL-OAHLLOKOSA-N 0 0 389.209 3.349 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNC(C)(C)c1nc(C)c(C)s1 ZINC000173959066 1426910123 /nfs/dbraw/zinc/91/01/23/1426910123.db2.gz INUSLUHVQLXRAJ-UHFFFAOYSA-N 0 0 378.454 3.140 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@@H](O)COCc2ccccc2Cl)nc1-c1ccncc1 ZINC000173959837 1426910909 /nfs/dbraw/zinc/91/09/09/1426910909.db2.gz FQFYHSGDUXKNSQ-OAHLLOKOSA-N 0 0 388.811 3.084 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@@H](O)COCc2ccc(Cl)cc2)nc1-c1ccncc1 ZINC000173959971 1426911321 /nfs/dbraw/zinc/91/13/21/1426911321.db2.gz QCMBLPLPGTUIQZ-MRXNPFEDSA-N 0 0 388.811 3.084 20 5 GGBDRN Cc1cccc([C@@H](C)S(=O)(=O)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1 ZINC000173975578 1426920655 /nfs/dbraw/zinc/92/06/55/1426920655.db2.gz DYVHPGKFIVABKY-CYBMUJFWSA-N 0 0 377.418 3.446 20 5 GGBDRN COC(=O)c1sc(NC(=O)Cc2cccc([N+](=O)[O-])c2)nc1C(C)(C)C ZINC000173985116 1426926800 /nfs/dbraw/zinc/92/68/00/1426926800.db2.gz BITUNAMMAUHVSU-UHFFFAOYSA-N 0 0 377.422 3.317 20 5 GGBDRN COC(=O)c1sc(NC(=O)Cc2ccccc2[N+](=O)[O-])nc1C(C)(C)C ZINC000173984353 1426927089 /nfs/dbraw/zinc/92/70/89/1426927089.db2.gz KLYIYRCLMHODFR-UHFFFAOYSA-N 0 0 377.422 3.317 20 5 GGBDRN CC(=O)N1CCCN(C(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000173988272 1426928642 /nfs/dbraw/zinc/92/86/42/1426928642.db2.gz UMIQKECJSQLQOR-UHFFFAOYSA-N 0 0 382.420 3.187 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1 ZINC000173992244 1426930670 /nfs/dbraw/zinc/93/06/70/1426930670.db2.gz ODULJTGQEKPUDN-LLVKDONJSA-N 0 0 379.373 3.256 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1 ZINC000173992231 1426930704 /nfs/dbraw/zinc/93/07/04/1426930704.db2.gz ODULJTGQEKPUDN-NSHDSACASA-N 0 0 379.373 3.256 20 5 GGBDRN CCC(CC)(CCO)CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000173993814 1426931759 /nfs/dbraw/zinc/93/17/59/1426931759.db2.gz IVOKLCFBNUVSSK-UHFFFAOYSA-N 0 0 380.413 3.192 20 5 GGBDRN CCO[C@H](C)c1nc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000173998881 1426934322 /nfs/dbraw/zinc/93/43/22/1426934322.db2.gz GUAOGXNFMGQPRL-OAHLLOKOSA-N 0 0 390.509 3.467 20 5 GGBDRN CCO[C@@H](C)c1nc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000173998869 1426934657 /nfs/dbraw/zinc/93/46/57/1426934657.db2.gz GUAOGXNFMGQPRL-HNNXBMFYSA-N 0 0 390.509 3.467 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H](C)OC[C@H]1c1ccccc1 ZINC000174006391 1426938943 /nfs/dbraw/zinc/93/89/43/1426938943.db2.gz FXZPNWFKEBMXQH-KXBFYZLASA-N 0 0 399.447 3.394 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)OC[C@H]1c1ccccc1 ZINC000174006630 1426939114 /nfs/dbraw/zinc/93/91/14/1426939114.db2.gz VAMZUUGFDOVMLK-KDOFPFPSSA-N 0 0 385.420 3.004 20 5 GGBDRN CCOc1ccc(NC(=O)CN2C[C@@H](C)OC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000174006121 1426939157 /nfs/dbraw/zinc/93/91/57/1426939157.db2.gz UUXMBCKHZNNFAJ-FOIQADDNSA-N 0 0 399.447 3.394 20 5 GGBDRN COc1ccc(NC(=O)CN2C[C@@H](C)OC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000174007547 1426939615 /nfs/dbraw/zinc/93/96/15/1426939615.db2.gz OOUWQHNKGPLJJJ-KUHUBIRLSA-N 0 0 385.420 3.004 20 5 GGBDRN COc1ccc(NC(=O)CN2C[C@H](C)OC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000174007561 1426939676 /nfs/dbraw/zinc/93/96/76/1426939676.db2.gz OOUWQHNKGPLJJJ-LIRRHRJNSA-N 0 0 385.420 3.004 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)cc1[N+](=O)[O-] ZINC000174031373 1426955111 /nfs/dbraw/zinc/95/51/11/1426955111.db2.gz JCRLRRYKUYEVSQ-UHFFFAOYSA-N 0 0 399.422 3.461 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(N2CCNC2=O)c1 ZINC000174047300 1426969793 /nfs/dbraw/zinc/96/97/93/1426969793.db2.gz DAJARPQFYCDGQN-UHFFFAOYSA-N 0 0 375.768 3.135 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000174046755 1426970222 /nfs/dbraw/zinc/97/02/22/1426970222.db2.gz HQHNQAMGSXSGFE-MHZLTWQESA-N 0 0 387.461 3.187 20 5 GGBDRN CN(CC(=O)N1CC[C@H](COCc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000174050214 1426972119 /nfs/dbraw/zinc/97/21/19/1426972119.db2.gz ASRQADUAJNUCOU-SFHVURJKSA-N 0 0 383.448 3.096 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)c1[N+](=O)[O-] ZINC000174055278 1426975748 /nfs/dbraw/zinc/97/57/48/1426975748.db2.gz DAZXURWWXUZPNS-UHFFFAOYSA-N 0 0 375.816 3.378 20 5 GGBDRN Cc1ccc(CCN(Cc2ccco2)C(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000174058573 1426978278 /nfs/dbraw/zinc/97/82/78/1426978278.db2.gz TVPWHAOTOREBIU-UHFFFAOYSA-N 0 0 382.420 3.354 20 5 GGBDRN Cc1nn(C)c(C)c1CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000174061156 1426981054 /nfs/dbraw/zinc/98/10/54/1426981054.db2.gz PGJAKTAXQRPPQH-UHFFFAOYSA-N 0 0 385.468 3.111 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)c1nc(C2CCCCC2)no1 ZINC000174067123 1426984297 /nfs/dbraw/zinc/98/42/97/1426984297.db2.gz LVZBEZKGBZAGKL-LBPRGKRZSA-N 0 0 394.453 3.373 20 5 GGBDRN CCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(CC)c([N+](=O)[O-])c2)cc1 ZINC000174067644 1426984369 /nfs/dbraw/zinc/98/43/69/1426984369.db2.gz CUFKQBWAJMTELE-UHFFFAOYSA-N 0 0 391.449 3.098 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCCCc2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000174074196 1426988526 /nfs/dbraw/zinc/98/85/26/1426988526.db2.gz IPLAADGVIYAOLA-UHFFFAOYSA-N 0 0 397.391 3.061 20 5 GGBDRN Cc1nn(C)c(C)c1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000174076601 1426989264 /nfs/dbraw/zinc/98/92/64/1426989264.db2.gz HIFRRSOPBALIFU-UHFFFAOYSA-N 0 0 385.468 3.111 20 5 GGBDRN Cc1ccc([C@H]2OCCC[C@@H]2CNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000174078447 1426991243 /nfs/dbraw/zinc/99/12/43/1426991243.db2.gz KCVPINOZTWKDQV-VQIMIIECSA-N 0 0 390.461 3.349 20 5 GGBDRN CCc1ccc(O)c(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1 ZINC000174083346 1426993536 /nfs/dbraw/zinc/99/35/36/1426993536.db2.gz CEBLWEYUZXCVGG-UHFFFAOYSA-N 0 0 385.376 3.190 20 5 GGBDRN CCc1ccc(O)c(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000174084202 1426994057 /nfs/dbraw/zinc/99/40/57/1426994057.db2.gz YVWIARQROJNFSM-SFHVURJKSA-N 0 0 397.431 3.415 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])n1 ZINC000174088140 1426995516 /nfs/dbraw/zinc/99/55/16/1426995516.db2.gz OOIVYTINFUKWTN-JTQLQIEISA-N 0 0 398.366 3.262 20 5 GGBDRN CCc1ccc(C(=O)N[C@H](C)c2ccccc2NS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000174090100 1426995841 /nfs/dbraw/zinc/99/58/41/1426995841.db2.gz KNGYRPCHRSWTPM-GFCCVEGCSA-N 0 0 391.449 3.020 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)OC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000174096222 1427000731 /nfs/dbraw/zinc/00/07/31/1427000731.db2.gz KIGOEMPOVGKEKR-RDTXWAMCSA-N 0 0 376.434 3.054 20 5 GGBDRN O=C(NCCOC(=O)c1cccc2cc[nH]c21)c1ccc([N+](=O)[O-])cc1Cl ZINC000174105132 1427003952 /nfs/dbraw/zinc/00/39/52/1427003952.db2.gz BAPORBJMWITPST-UHFFFAOYSA-N 0 0 387.779 3.316 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000174110472 1427006693 /nfs/dbraw/zinc/00/66/93/1427006693.db2.gz DFZNCYJBKOFJSG-HNNXBMFYSA-N 0 0 389.456 3.034 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)CC1 ZINC000174113635 1427008002 /nfs/dbraw/zinc/00/80/02/1427008002.db2.gz RDIJPVQCLDRYCT-UHFFFAOYSA-N 0 0 375.469 3.268 20 5 GGBDRN COC(=O)c1cc(O[C@@H](C)c2nc(Cc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000174119062 1427009737 /nfs/dbraw/zinc/00/97/37/1427009737.db2.gz RZYBIRSINLIKMZ-LBPRGKRZSA-N 0 0 383.360 3.495 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)OCC[C@H]2CCCCN2C(=O)c2cccn2C)c1 ZINC000174156358 1427024588 /nfs/dbraw/zinc/02/45/88/1427024588.db2.gz VPDMJTKQDCISHF-MRXNPFEDSA-N 0 0 399.447 3.484 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)N(C)Cc3nc[nH]n3)cc2[N+](=O)[O-])cc1 ZINC000174158780 1427025108 /nfs/dbraw/zinc/02/51/08/1427025108.db2.gz WMBIQFPQKJQDSU-UHFFFAOYSA-N 0 0 383.433 3.445 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000174169447 1427030440 /nfs/dbraw/zinc/03/04/40/1427030440.db2.gz KLAPRZXTHJHQGS-GFCCVEGCSA-N 0 0 377.401 3.375 20 5 GGBDRN CCc1cnc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000174175266 1427033197 /nfs/dbraw/zinc/03/31/97/1427033197.db2.gz HBTNPUKGSXJRLQ-UHFFFAOYSA-N 0 0 390.465 3.367 20 5 GGBDRN C[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2ccccc2NC1=O ZINC000174175823 1427033965 /nfs/dbraw/zinc/03/39/65/1427033965.db2.gz NCCJIMSIYDQEGM-GFCCVEGCSA-N 0 0 379.376 3.240 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000174181157 1427035697 /nfs/dbraw/zinc/03/56/97/1427035697.db2.gz FIFQYVQMGVHGDU-UHFFFAOYSA-N 0 0 383.452 3.451 20 5 GGBDRN C[C@@H]1CN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2NC1=O ZINC000174182366 1427036401 /nfs/dbraw/zinc/03/64/01/1427036401.db2.gz HKLFEYPPYUOEKQ-LLVKDONJSA-N 0 0 388.811 3.282 20 5 GGBDRN CC[C@@H](C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1)N1CCCC1=O ZINC000174186123 1427038844 /nfs/dbraw/zinc/03/88/44/1427038844.db2.gz NBCFFXCGGGSOTA-AWEZNQCLSA-N 0 0 388.449 3.366 20 5 GGBDRN C[C@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccc2NC1=O ZINC000174185957 1427038852 /nfs/dbraw/zinc/03/88/52/1427038852.db2.gz BKFWQUNJEFIUKM-LBPRGKRZSA-N 0 0 379.376 3.240 20 5 GGBDRN Cc1ccc(NC(=O)N2CCn3c(nnc3-c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000174186790 1427039414 /nfs/dbraw/zinc/03/94/14/1427039414.db2.gz ITYITQWUQORASQ-UHFFFAOYSA-N 0 0 378.392 3.209 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(c3ncnc4ccsc43)CC2)cc1[N+](=O)[O-] ZINC000174187171 1427039530 /nfs/dbraw/zinc/03/95/30/1427039530.db2.gz DVNICTYRHGPQHS-UHFFFAOYSA-N 0 0 398.448 3.262 20 5 GGBDRN COc1cc(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)ccc1[N+](=O)[O-] ZINC000174196542 1427044850 /nfs/dbraw/zinc/04/48/50/1427044850.db2.gz ATVUEEYJCLLUQL-UHFFFAOYSA-N 0 0 398.463 3.068 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@@H](C3N=NC(=S)N3CC)C2)cc1[N+](=O)[O-] ZINC000174197179 1427045492 /nfs/dbraw/zinc/04/54/92/1427045492.db2.gz NMOOJJPKDDKPIV-CQSZACIVSA-N 0 0 389.481 3.077 20 5 GGBDRN C[C@@H]1CCC[C@@H](C)N1C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242324 1427065405 /nfs/dbraw/zinc/06/54/05/1427065405.db2.gz LWKVWXVEUKNWGF-HZPDHXFCSA-N 0 0 375.469 3.228 20 5 GGBDRN O=C(Nc1c(F)cc(F)cc1F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000174241310 1427065762 /nfs/dbraw/zinc/06/57/62/1427065762.db2.gz FTOZAXQTFNABNT-UHFFFAOYSA-N 0 0 380.326 3.366 20 5 GGBDRN O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N1CCc2ccccc21 ZINC000174244863 1427066874 /nfs/dbraw/zinc/06/68/74/1427066874.db2.gz HMTGRIKBWGCGRM-UHFFFAOYSA-N 0 0 381.432 3.027 20 5 GGBDRN CN(C)C(=O)[C@H](c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174244813 1427066919 /nfs/dbraw/zinc/06/69/19/1427066919.db2.gz HQEOQHPOCRFVRR-FQEVSTJZSA-N 0 0 383.448 3.268 20 5 GGBDRN CN(C)C(=O)[C@@H](c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174244802 1427067009 /nfs/dbraw/zinc/06/70/09/1427067009.db2.gz HQEOQHPOCRFVRR-HXUWFJFHSA-N 0 0 383.448 3.268 20 5 GGBDRN Cc1cccc(CNC(=O)CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000174247169 1427068337 /nfs/dbraw/zinc/06/83/37/1427068337.db2.gz TWNXSHCBJHWQLM-UHFFFAOYSA-N 0 0 383.448 3.063 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1cccc(-n2cccn2)c1 ZINC000174254766 1427071369 /nfs/dbraw/zinc/07/13/69/1427071369.db2.gz CJIWWGKZXXZXGO-OAHLLOKOSA-N 0 0 379.420 3.383 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000174267121 1427076416 /nfs/dbraw/zinc/07/64/16/1427076416.db2.gz SKWRGBYTMXDRPT-UHFFFAOYSA-N 0 0 388.371 3.454 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2c3nsnc3ccc2Cl)cc1[N+](=O)[O-] ZINC000174266439 1427076447 /nfs/dbraw/zinc/07/64/47/1427076447.db2.gz 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CC(C)[C@@H](C(=O)OCCNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000174334156 1427106329 /nfs/dbraw/zinc/10/63/29/1427106329.db2.gz SJNLPTZILXIRPT-GOSISDBHSA-N 0 0 385.420 3.089 20 5 GGBDRN C[C@@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000174337468 1427109055 /nfs/dbraw/zinc/10/90/55/1427109055.db2.gz LOHWTXFVTHFOAW-OAHLLOKOSA-N 0 0 394.435 3.253 20 5 GGBDRN C[C@H](N[C@@H](C)c1nc(-c2cccc(F)c2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000174338744 1427109624 /nfs/dbraw/zinc/10/96/24/1427109624.db2.gz MUUVVHFZKSJJEK-RYUDHWBXSA-N 0 0 399.382 3.462 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000174344074 1427112076 /nfs/dbraw/zinc/11/20/76/1427112076.db2.gz BOBRTKQHOBQSEC-NEPJUHHUSA-N 0 0 383.470 3.470 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000174347468 1427113261 /nfs/dbraw/zinc/11/32/61/1427113261.db2.gz VTQOEIDSCJDCDK-WBVHZDCISA-N 0 0 391.468 3.337 20 5 GGBDRN 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Cc1cc([C@@](C)(O)CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(C)o1 ZINC000174623053 1427269818 /nfs/dbraw/zinc/26/98/18/1427269818.db2.gz TUBSUQPOMLMOHB-FQEVSTJZSA-N 0 0 387.436 3.042 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(Cc1ccccc1)CC(F)F ZINC000174623568 1427270160 /nfs/dbraw/zinc/27/01/60/1427270160.db2.gz SOLNDZHQOZBQOG-CYBMUJFWSA-N 0 0 391.374 3.007 20 5 GGBDRN COc1ccc(CN(C)[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1O ZINC000174626749 1427272616 /nfs/dbraw/zinc/27/26/16/1427272616.db2.gz YAPOUYDACHGFPX-NSHDSACASA-N 0 0 393.827 3.421 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3cc(C)ccc3[N+](=O)[O-])n2)c1 ZINC000174637073 1427280412 /nfs/dbraw/zinc/28/04/12/1427280412.db2.gz XQIPGEADPIPCPI-LBPRGKRZSA-N 0 0 382.376 3.453 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000174654578 1427290394 /nfs/dbraw/zinc/29/03/94/1427290394.db2.gz PCEDIMYWPBEAHZ-GFCCVEGCSA-N 0 0 382.376 3.073 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCN(C(=O)c2cccc(O)c2)CC1 ZINC000174672389 1427300886 /nfs/dbraw/zinc/30/08/86/1427300886.db2.gz VRJKTUBEEROQRR-UHFFFAOYSA-N 0 0 399.447 3.046 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000174673142 1427301250 /nfs/dbraw/zinc/30/12/50/1427301250.db2.gz JKAXGJNYRZNWQW-FZKQIMNGSA-N 0 0 378.450 3.309 20 5 GGBDRN COc1cc(CCNc2ncccc2-c2nc(C)no2)c([N+](=O)[O-])cc1OC ZINC000174674590 1427302582 /nfs/dbraw/zinc/30/25/82/1427302582.db2.gz HHXPTZQGGPWZNO-UHFFFAOYSA-N 0 0 385.380 3.020 20 5 GGBDRN COc1cc(NCc2ccccc2CS(=O)(=O)NC(C)C)ccc1[N+](=O)[O-] ZINC000174675032 1427302866 /nfs/dbraw/zinc/30/28/66/1427302866.db2.gz ZCNDNMZUJWOQJA-UHFFFAOYSA-N 0 0 393.465 3.043 20 5 GGBDRN O=C(Cc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000174687207 1427310248 /nfs/dbraw/zinc/31/02/48/1427310248.db2.gz IXNNKWDWJDGFCE-UHFFFAOYSA-N 0 0 391.374 3.088 20 5 GGBDRN COc1ccc(-c2ccc(CNC(=O)Cn3cc([N+](=O)[O-])nc3C)cc2)cc1 ZINC000174692354 1427313088 /nfs/dbraw/zinc/31/30/88/1427313088.db2.gz OOEPXRXNRUZZGE-UHFFFAOYSA-N 0 0 380.404 3.092 20 5 GGBDRN Cc1nc(COC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)sc1C ZINC000174693839 1427314005 /nfs/dbraw/zinc/31/40/05/1427314005.db2.gz PPOABWQQMJLSAJ-LLVKDONJSA-N 0 0 395.462 3.078 20 5 GGBDRN COc1cc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000174699144 1427316853 /nfs/dbraw/zinc/31/68/53/1427316853.db2.gz QGXSMHLQWBAPMO-CYBMUJFWSA-N 0 0 386.326 3.474 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](C)C[C@H]1c1ccccc1F ZINC000174702149 1427318320 /nfs/dbraw/zinc/31/83/20/1427318320.db2.gz NMPQATQFSULDAM-LPMFXHHGSA-N 0 0 399.422 3.462 20 5 GGBDRN C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1nc(C(C)(C)C)no1 ZINC000174707549 1427321373 /nfs/dbraw/zinc/32/13/73/1427321373.db2.gz LDBVTULDKLUBHM-GFCCVEGCSA-N 0 0 375.429 3.345 20 5 GGBDRN C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1nc(C(C)(C)C)no1 ZINC000174707540 1427321561 /nfs/dbraw/zinc/32/15/61/1427321561.db2.gz LDBVTULDKLUBHM-LBPRGKRZSA-N 0 0 375.429 3.345 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1cccc(-n2cccn2)c1 ZINC000174738188 1427341143 /nfs/dbraw/zinc/34/11/43/1427341143.db2.gz AGLICYKXPSBDIX-CQSZACIVSA-N 0 0 379.420 3.338 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2c3nsnc3ccc2Cl)ccc1[N+](=O)[O-] ZINC000174742190 1427343223 /nfs/dbraw/zinc/34/32/23/1427343223.db2.gz SCILZSHSNKZBGH-UHFFFAOYSA-N 0 0 384.826 3.362 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000174745393 1427345305 /nfs/dbraw/zinc/34/53/05/1427345305.db2.gz TUVKMYRIIKOPSU-UHFFFAOYSA-N 0 0 385.420 3.369 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC000174748077 1427346376 /nfs/dbraw/zinc/34/63/76/1427346376.db2.gz HWQLNORXOMLPTC-LBPRGKRZSA-N 0 0 381.348 3.180 20 5 GGBDRN C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174749214 1427347039 /nfs/dbraw/zinc/34/70/39/1427347039.db2.gz QQDZOIUJTIXSOI-LLVKDONJSA-N 0 0 385.355 3.073 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000174749253 1427347049 /nfs/dbraw/zinc/34/70/49/1427347049.db2.gz ARULJHUULLGORD-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000174753115 1427348699 /nfs/dbraw/zinc/34/86/99/1427348699.db2.gz SZUMAVDBIGCVLR-OAHLLOKOSA-N 0 0 379.420 3.094 20 5 GGBDRN C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1cccc(-n2cccn2)c1 ZINC000174754644 1427349414 /nfs/dbraw/zinc/34/94/14/1427349414.db2.gz ZYFPUMAIHKVRRQ-GFCCVEGCSA-N 0 0 376.376 3.148 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1nc(-c2cccc(F)c2)no1 ZINC000174755236 1427350060 /nfs/dbraw/zinc/35/00/60/1427350060.db2.gz KOFBCCUDVVDRNT-VIFPVBQESA-N 0 0 396.338 3.151 20 5 GGBDRN C[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000174755146 1427350165 /nfs/dbraw/zinc/35/01/65/1427350165.db2.gz RJQSTHODWFJEBT-OAHLLOKOSA-N 0 0 380.404 3.427 20 5 GGBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174760256 1427353309 /nfs/dbraw/zinc/35/33/09/1427353309.db2.gz WRUPGBIFDHKCRJ-GFCCVEGCSA-N 0 0 399.382 3.098 20 5 GGBDRN NC(=O)C[C@H]1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000174765084 1427354534 /nfs/dbraw/zinc/35/45/34/1427354534.db2.gz FGQFUSSFRQUJGY-CQSZACIVSA-N 0 0 382.420 3.066 20 5 GGBDRN O=C(NCCOC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1ccccc1 ZINC000174774180 1427360055 /nfs/dbraw/zinc/36/00/55/1427360055.db2.gz LDIXTIVGHUAQIA-UHFFFAOYSA-N 0 0 397.431 3.172 20 5 GGBDRN Cc1cc(NC(=O)C(=O)NCCc2ccc([N+](=O)[O-])cc2)ccc1C(F)(F)F ZINC000174780297 1427362875 /nfs/dbraw/zinc/36/28/75/1427362875.db2.gz ISNDUESVKLVSOO-UHFFFAOYSA-N 0 0 395.337 3.219 20 5 GGBDRN CC(C)C[C@H](CCO)CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000174786251 1427366873 /nfs/dbraw/zinc/36/68/73/1427366873.db2.gz BIPWXVNQKKWXLY-NSHDSACASA-N 0 0 375.372 3.362 20 5 GGBDRN COc1ccc(NC(=O)CN2c3ccccc3N(C)CC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000174796159 1427373254 /nfs/dbraw/zinc/37/32/54/1427373254.db2.gz JDEMPIQPCMRUNC-AWEZNQCLSA-N 0 0 384.436 3.277 20 5 GGBDRN CCCn1ccc2ccc(NC(=O)C(=O)NCc3ccc([N+](=O)[O-])cc3)cc21 ZINC000174796017 1427373514 /nfs/dbraw/zinc/37/35/14/1427373514.db2.gz BOOJUTLSXJFDAB-UHFFFAOYSA-N 0 0 380.404 3.214 20 5 GGBDRN Cc1cc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)ccc1C(F)(F)F ZINC000174795994 1427373633 /nfs/dbraw/zinc/37/36/33/1427373633.db2.gz ASFKMWJHQILZGX-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN Cc1c(C(=O)N(C)Cc2nc([C@H](C)OCC(C)C)no2)cccc1[N+](=O)[O-] ZINC000174797161 1427374068 /nfs/dbraw/zinc/37/40/68/1427374068.db2.gz GNEKLKRQQGILKF-ZDUSSCGKSA-N 0 0 376.413 3.292 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2ccccc2N(C)CC[C@@H]1C ZINC000174797258 1427374296 /nfs/dbraw/zinc/37/42/96/1427374296.db2.gz VXROUXDZKNULST-AWEZNQCLSA-N 0 0 384.436 3.277 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@@H](O)COCc3ccc(Cl)cc3)n2)c1 ZINC000174797786 1427374301 /nfs/dbraw/zinc/37/43/01/1427374301.db2.gz SMCLHGFHLUAUGR-QGZVFWFLSA-N 0 0 388.811 3.084 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@H](O)COc3cccc4ccccc43)n2)c1 ZINC000174797964 1427375002 /nfs/dbraw/zinc/37/50/02/1427375002.db2.gz UFHFMPCAUBUUOC-SFHVURJKSA-N 0 0 390.399 3.446 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(C[C@@H](O)c3ccc(F)cc3F)CC2)cc1 ZINC000174802687 1427377842 /nfs/dbraw/zinc/37/78/42/1427377842.db2.gz QMIJYKGUHRRNKI-LJQANCHMSA-N 0 0 378.375 3.450 20 5 GGBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)Nc1n[nH]cc1-c1ccc2c(c1)OCO2 ZINC000174816489 1427383922 /nfs/dbraw/zinc/38/39/22/1427383922.db2.gz YNEBIFJPQFOPKJ-FPYGCLRLSA-N 0 0 378.344 3.366 20 5 GGBDRN CO[C@@]1(C)C[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1(C)C ZINC000174826061 1427389645 /nfs/dbraw/zinc/38/96/45/1427389645.db2.gz FMDBUIXTDMUNSW-CVDCTZTESA-N 0 0 378.472 3.475 20 5 GGBDRN CC(C)(O)CNC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000174842746 1427400916 /nfs/dbraw/zinc/40/09/16/1427400916.db2.gz LYKFPBFOAQRCFH-UHFFFAOYSA-N 0 0 377.828 3.361 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCCc1nc(C(F)(F)F)cs1 ZINC000174843131 1427401590 /nfs/dbraw/zinc/40/15/90/1427401590.db2.gz SILVKTZZCKAYRW-UHFFFAOYSA-N 0 0 388.371 3.231 20 5 GGBDRN COc1cccc(-c2noc(CCCn3c4ccc([N+](=O)[O-])cc4oc3=O)n2)c1 ZINC000174855752 1427410045 /nfs/dbraw/zinc/41/00/45/1427410045.db2.gz QMSXBFBPQIDSQS-UHFFFAOYSA-N 0 0 396.359 3.194 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc21 ZINC000174856580 1427410075 /nfs/dbraw/zinc/41/00/75/1427410075.db2.gz ORKFQRXBKLHZAZ-UHFFFAOYSA-N 0 0 397.435 3.351 20 5 GGBDRN COc1ccc(CN(CCO)Cc2cc(Cl)ccc2[N+](=O)[O-])c(OC)c1 ZINC000174858302 1427410762 /nfs/dbraw/zinc/41/07/62/1427410762.db2.gz ZGUZRGMJKAKDPX-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(CCOc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000174860057 1427412615 /nfs/dbraw/zinc/41/26/15/1427412615.db2.gz FDNDBOXJVWAZHA-UHFFFAOYSA-N 0 0 384.436 3.132 20 5 GGBDRN CC(=O)N1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c2ccccc21 ZINC000174870399 1427419826 /nfs/dbraw/zinc/41/98/26/1427419826.db2.gz GRILHWRHVPSLAK-UHFFFAOYSA-N 0 0 382.420 3.105 20 5 GGBDRN COC(=O)c1cccc(-c2noc(-c3ccn(-c4cccc([N+](=O)[O-])c4)n3)n2)c1 ZINC000174882173 1427425557 /nfs/dbraw/zinc/42/55/57/1427425557.db2.gz AIJRRQIYRUNVRK-UHFFFAOYSA-N 0 0 391.343 3.284 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000174899687 1427435375 /nfs/dbraw/zinc/43/53/75/1427435375.db2.gz QNQZFNZNYFNEQF-UHFFFAOYSA-N 0 0 398.463 3.377 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000174906023 1427438706 /nfs/dbraw/zinc/43/87/06/1427438706.db2.gz SUQNWJLYBPXLNV-UHFFFAOYSA-N 0 0 397.479 3.167 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000174913118 1427443525 /nfs/dbraw/zinc/44/35/25/1427443525.db2.gz LSIFGVSVTAILHA-UHFFFAOYSA-N 0 0 398.463 3.134 20 5 GGBDRN CC[C@@H]1Oc2cc([C@@H](C)NC(=O)c3cc(F)ccc3[N+](=O)[O-])ccc2NC1=O ZINC000174916781 1427445121 /nfs/dbraw/zinc/44/51/21/1427445121.db2.gz VQPIFZOBOCFZRG-HWPZZCPQSA-N 0 0 387.367 3.334 20 5 GGBDRN Cc1cc(NC(=O)COc2ccc(Cc3ccccc3)cc2[N+](=O)[O-])n(C)n1 ZINC000174919129 1427445790 /nfs/dbraw/zinc/44/57/90/1427445790.db2.gz NAWZQERRFZKTLI-UHFFFAOYSA-N 0 0 380.404 3.245 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)Cc3ccccc3[N+](=O)[O-])ccc2NC1=O ZINC000174926663 1427449179 /nfs/dbraw/zinc/44/91/79/1427449179.db2.gz HDNSJVWWSWIWSD-SJCJKPOMSA-N 0 0 383.404 3.124 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)Cc3ccccc3[N+](=O)[O-])ccc2NC1=O ZINC000174926619 1427449213 /nfs/dbraw/zinc/44/92/13/1427449213.db2.gz HDNSJVWWSWIWSD-SJKOYZFVSA-N 0 0 383.404 3.124 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)NC(=O)Cc3ccc([N+](=O)[O-])cc3)ccc2NC1=O ZINC000174935100 1427453588 /nfs/dbraw/zinc/45/35/88/1427453588.db2.gz SDJRSMCHZYUPMP-YVEFUNNKSA-N 0 0 383.404 3.124 20 5 GGBDRN CC[C@@H]1Oc2cc([C@@H](C)NC(=O)Cc3ccc([N+](=O)[O-])cc3)ccc2NC1=O ZINC000174935082 1427453864 /nfs/dbraw/zinc/45/38/64/1427453864.db2.gz SDJRSMCHZYUPMP-PXAZEXFGSA-N 0 0 383.404 3.124 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)c3ccc([N+](=O)[O-])s3)ccc2NC1=O ZINC000174949064 1427461695 /nfs/dbraw/zinc/46/16/95/1427461695.db2.gz MHEPMFGRXJWLBC-BXKDBHETSA-N 0 0 375.406 3.257 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3F)ccc2NC1=O ZINC000174963828 1427469345 /nfs/dbraw/zinc/46/93/45/1427469345.db2.gz GHRCQJFXQHZVHB-QLJPJBMISA-N 0 0 387.367 3.334 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3)ccc2NC1=O ZINC000174965684 1427470482 /nfs/dbraw/zinc/47/04/82/1427470482.db2.gz CXQUXBGKRWLZHJ-SJKOYZFVSA-N 0 0 383.404 3.124 20 5 GGBDRN O=C([C@H]1C[C@@]12CCc1ccccc12)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174974837 1427474871 /nfs/dbraw/zinc/47/48/71/1427474871.db2.gz AUCGMOZAEQNJRZ-XMSQKQJNSA-N 0 0 377.444 3.148 20 5 GGBDRN O=C(CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])Nc1ccc(F)c(F)c1F ZINC000174995654 1427485696 /nfs/dbraw/zinc/48/56/96/1427485696.db2.gz ARLCCCRXWMHPJL-UHFFFAOYSA-N 0 0 387.701 3.034 20 5 GGBDRN 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CC(C)Nc1cc(F)ccc1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000175146860 1427567733 /nfs/dbraw/zinc/56/77/33/1427567733.db2.gz KAZCFJXLVDUALS-UHFFFAOYSA-N 0 0 375.356 3.384 20 5 GGBDRN CC(C)(NC(=O)c1cc2c([nH]c1=O)CC(C)(C)CC2=O)c1ccc([N+](=O)[O-])cc1 ZINC000175150634 1427570335 /nfs/dbraw/zinc/57/03/35/1427570335.db2.gz WJAFIDCPCCMSFY-UHFFFAOYSA-N 0 0 397.431 3.103 20 5 GGBDRN Cc1csc(N(CC(F)(F)F)C(=O)CN(C)c2ccccc2[N+](=O)[O-])n1 ZINC000175154222 1427571810 /nfs/dbraw/zinc/57/18/10/1427571810.db2.gz WSDIROXQBHBAST-UHFFFAOYSA-N 0 0 388.371 3.391 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC(C)(C)c1ccc(F)c(F)c1 ZINC000175164833 1427576732 /nfs/dbraw/zinc/57/67/32/1427576732.db2.gz QDNNJBHNSWWJMF-LLVKDONJSA-N 0 0 391.374 3.043 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1NCCOCc1ccccc1 ZINC000175168418 1427579013 /nfs/dbraw/zinc/57/90/13/1427579013.db2.gz KOJZFEHJULXONA-UHFFFAOYSA-N 0 0 386.376 3.220 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@H](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000175169356 1427579027 /nfs/dbraw/zinc/57/90/27/1427579027.db2.gz OAGKWKMUQYXTND-UONOGXRCSA-N 0 0 385.420 3.102 20 5 GGBDRN COCCn1nc(C)c(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1C ZINC000175173922 1427582067 /nfs/dbraw/zinc/58/20/67/1427582067.db2.gz OPLKHWZOMJVTKX-ZDUSSCGKSA-N 0 0 378.454 3.174 20 5 GGBDRN COc1ccc(Br)c(S(=O)(=O)Oc2ccccc2[N+](=O)[O-])c1 ZINC000175177774 1427583934 /nfs/dbraw/zinc/58/39/34/1427583934.db2.gz VMHOHWRZIOGLFL-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](OCCC(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000175182245 1427586139 /nfs/dbraw/zinc/58/61/39/1427586139.db2.gz OBQVOWOAKNAQCC-CQSZACIVSA-N 0 0 379.413 3.397 20 5 GGBDRN Cc1cc2c(cc1C)O[C@H](C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)C2 ZINC000175188960 1427589617 /nfs/dbraw/zinc/58/96/17/1427589617.db2.gz GKXFTGFSFIDAGS-SFHVURJKSA-N 0 0 378.388 3.340 20 5 GGBDRN C[C@H](NC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000175194973 1427592338 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CCC(CC)c1cc(CNC(=O)NCc2cc([N+](=O)[O-])ccc2OC)on1 ZINC000175291623 1427650914 /nfs/dbraw/zinc/65/09/14/1427650914.db2.gz WTMIMPWBYHKMCX-UHFFFAOYSA-N 0 0 376.413 3.494 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1cccnc1 ZINC000175301133 1427659907 /nfs/dbraw/zinc/65/99/07/1427659907.db2.gz LQCRTTVFSLOGNU-GOSISDBHSA-N 0 0 379.420 3.345 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](c2cccnc2)C(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000175313582 1427669977 /nfs/dbraw/zinc/66/99/77/1427669977.db2.gz VASWFPVAKRYQCW-GOSISDBHSA-N 0 0 394.435 3.049 20 5 GGBDRN Cc1c(C(=O)N(C)c2ccc(Br)nc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175320563 1427675521 /nfs/dbraw/zinc/67/55/21/1427675521.db2.gz BKWNMVAQWMWQLC-UHFFFAOYSA-N 0 0 395.169 3.246 20 5 GGBDRN C[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc(Cc2ccccc2)no1 ZINC000175321745 1427676230 /nfs/dbraw/zinc/67/62/30/1427676230.db2.gz SQJRRPZBZUIQKB-AWEZNQCLSA-N 0 0 395.419 3.248 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000175327629 1427680898 /nfs/dbraw/zinc/68/08/98/1427680898.db2.gz CHDWKESBWNWFHC-KRWDZBQOSA-N 0 0 391.431 3.302 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC(C(=O)NCc2ccc(C)cc2)CC1 ZINC000175329789 1427683048 /nfs/dbraw/zinc/68/30/48/1427683048.db2.gz NOBXSZBGRMIBKV-UHFFFAOYSA-N 0 0 397.475 3.440 20 5 GGBDRN CC(C)(NC(=O)NCc1ccc(N2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000175331710 1427685021 /nfs/dbraw/zinc/68/50/21/1427685021.db2.gz HPDNCJBLNNNJGJ-UHFFFAOYSA-N 0 0 396.447 3.456 20 5 GGBDRN NC(=O)c1c(Cl)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000175333715 1427686764 /nfs/dbraw/zinc/68/67/64/1427686764.db2.gz JRFFDDKGURTTBU-UHFFFAOYSA-N 0 0 398.600 3.362 20 5 GGBDRN Cc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1C(=O)N(C)C ZINC000175360594 1427705101 /nfs/dbraw/zinc/70/51/01/1427705101.db2.gz YIUVKYPXHVFQRV-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN O=C(NCc1nccn1CCCc1ccccc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000175359938 1427705205 /nfs/dbraw/zinc/70/52/05/1427705205.db2.gz APNUEKPQGGPDJP-UHFFFAOYSA-N 0 0 393.447 3.424 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175360755 1427706180 /nfs/dbraw/zinc/70/61/80/1427706180.db2.gz MHVLWATXEYUJMR-UHFFFAOYSA-N 0 0 384.436 3.079 20 5 GGBDRN C[C@@H](NC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000175362481 1427706705 /nfs/dbraw/zinc/70/67/05/1427706705.db2.gz GZFMHNNJSGOMMI-XIKOKIGWSA-N 0 0 381.404 3.121 20 5 GGBDRN Cc1c(C(=O)N(CCC(F)(F)F)CC2CC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000175367115 1427710984 /nfs/dbraw/zinc/71/09/84/1427710984.db2.gz DFOKFXIGZZKYAU-UHFFFAOYSA-N 0 0 397.357 3.289 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000175378093 1427718843 /nfs/dbraw/zinc/71/88/43/1427718843.db2.gz ZTJLJGKBAAXJQX-UHFFFAOYSA-N 0 0 398.463 3.469 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1C(=O)N(C)C ZINC000175379345 1427719644 /nfs/dbraw/zinc/71/96/44/1427719644.db2.gz PEHLROZMDVBNJL-UHFFFAOYSA-N 0 0 386.364 3.074 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccnn2-c2ccccc2)cc1OC ZINC000175389184 1427725903 /nfs/dbraw/zinc/72/59/03/1427725903.db2.gz PKFLYJCUSRHHQZ-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N(CC2CCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000175393923 1427728481 /nfs/dbraw/zinc/72/84/81/1427728481.db2.gz DWHRUBMOFIDOIM-UHFFFAOYSA-N 0 0 388.445 3.445 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCN(c2cc(F)ccc2F)CC1 ZINC000175401174 1427732865 /nfs/dbraw/zinc/73/28/65/1427732865.db2.gz NZDBYASWVJHDKK-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN CCc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000175405865 1427736768 /nfs/dbraw/zinc/73/67/68/1427736768.db2.gz DZVVACOOSARFHN-UHFFFAOYSA-N 0 0 398.419 3.336 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175421629 1427745791 /nfs/dbraw/zinc/74/57/91/1427745791.db2.gz GHRKZBQAIWEJQZ-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000175425464 1427747841 /nfs/dbraw/zinc/74/78/41/1427747841.db2.gz UHMZKDBABQIVSD-CANCMXDXSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000175428718 1427749988 /nfs/dbraw/zinc/74/99/88/1427749988.db2.gz RWHYXJXBRVEMJL-CANCMXDXSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)OC[C@@H]2c2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175433392 1427753104 /nfs/dbraw/zinc/75/31/04/1427753104.db2.gz IIZXCLMHGXRSRQ-KZULUSFZSA-N 0 0 385.376 3.414 20 5 GGBDRN C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccc(-n2cccn2)cc1 ZINC000175434381 1427753852 /nfs/dbraw/zinc/75/38/52/1427753852.db2.gz TUHKAHZMXMOBIV-GFCCVEGCSA-N 0 0 376.376 3.148 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000175438704 1427754953 /nfs/dbraw/zinc/75/49/53/1427754953.db2.gz GKBCTLGLYIPYCH-DLBZAZTESA-N 0 0 389.477 3.497 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000175438169 1427755280 /nfs/dbraw/zinc/75/52/80/1427755280.db2.gz AXHGLQRHMMTHHO-OAHLLOKOSA-N 0 0 379.416 3.351 20 5 GGBDRN CSC(C)(C)CNC(=O)c1ccc(I)c([N+](=O)[O-])c1 ZINC000175460611 1427766531 /nfs/dbraw/zinc/76/65/31/1427766531.db2.gz RZRJPJUTGNBZFU-UHFFFAOYSA-N 0 0 394.234 3.071 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC(OC[C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000175463208 1427768340 /nfs/dbraw/zinc/76/83/40/1427768340.db2.gz WLJSKYIZMRRACL-CRAIPNDOSA-N 0 0 391.468 3.334 20 5 GGBDRN CN(C)c1cc(CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c2ccccc2n1 ZINC000175464376 1427768982 /nfs/dbraw/zinc/76/89/82/1427768982.db2.gz MDKDEHJAEBACSK-UHFFFAOYSA-N 0 0 386.358 3.417 20 5 GGBDRN CC[C@@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)Oc1cccc(F)c1 ZINC000175472004 1427773300 /nfs/dbraw/zinc/77/33/00/1427773300.db2.gz HQFLKLGZCOKUKQ-AWEZNQCLSA-N 0 0 399.378 3.163 20 5 GGBDRN Cn1c2ccc(Nc3ccc([N+](=O)[O-])cc3-c3nn[n-]n3)cc2nc1C1CC1 ZINC000826354936 1427791320 /nfs/dbraw/zinc/79/13/20/1427791320.db2.gz CCVWBKCZDLAXAE-UHFFFAOYSA-N 0 0 376.380 3.283 20 5 GGBDRN CC(C)CC(C)(C)CNC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000175504872 1427793401 /nfs/dbraw/zinc/79/34/01/1427793401.db2.gz QREUKOGZHPUJNU-UHFFFAOYSA-N 0 0 390.484 3.135 20 5 GGBDRN CCOC[C@@H]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000175511967 1427798770 /nfs/dbraw/zinc/79/87/70/1427798770.db2.gz NMKYCRYNPTYLNQ-MRXNPFEDSA-N 0 0 375.469 3.330 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000175529591 1427805273 /nfs/dbraw/zinc/80/52/73/1427805273.db2.gz GVDJOOFUFBTXSZ-JOCHJYFZSA-N 0 0 383.223 3.347 20 5 GGBDRN C[C@@H](NC(=O)C[C@H]1CN(Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000175539182 1427808795 /nfs/dbraw/zinc/80/87/95/1427808795.db2.gz BMRKRZDLOOGUBC-UZLBHIALSA-N 0 0 383.448 3.063 20 5 GGBDRN O=C(NC[C@@H](O)c1ccccc1F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175543104 1427809672 /nfs/dbraw/zinc/80/96/72/1427809672.db2.gz JZPAOTULRUUZRU-MRXNPFEDSA-N 0 0 387.392 3.321 20 5 GGBDRN CCOC[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000175545950 1427810678 /nfs/dbraw/zinc/81/06/78/1427810678.db2.gz PDAWEXDDHIMGFJ-MRXNPFEDSA-N 0 0 375.469 3.330 20 5 GGBDRN Cc1cccc2[nH]c(CCC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)nc21 ZINC000175547656 1427811148 /nfs/dbraw/zinc/81/11/48/1427811148.db2.gz FMXFAAHPMUZQHD-UHFFFAOYSA-N 0 0 393.447 3.061 20 5 GGBDRN C[C@H](NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)[C@@H](C)c1ccccc1 ZINC000175547396 1427811167 /nfs/dbraw/zinc/81/11/67/1427811167.db2.gz DRNWNWRKYCOAQB-IJEWVQPXSA-N 0 0 399.422 3.395 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000175555307 1427813685 /nfs/dbraw/zinc/81/36/85/1427813685.db2.gz OXGQGXWUOMDRKI-UHFFFAOYSA-N 0 0 397.822 3.092 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1 ZINC000175561873 1427815623 /nfs/dbraw/zinc/81/56/23/1427815623.db2.gz IRBWYJCYYURGLG-UHFFFAOYSA-N 0 0 377.397 3.410 20 5 GGBDRN COc1ccc(C(=O)CCC(=O)OCCc2ccc([N+](=O)[O-])cc2)cc1F ZINC000175564761 1427816577 /nfs/dbraw/zinc/81/65/77/1427816577.db2.gz NGWZNGBJVWXILN-UHFFFAOYSA-N 0 0 375.352 3.491 20 5 GGBDRN O=C(NCCSC(F)(F)F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000175581287 1427821739 /nfs/dbraw/zinc/82/17/39/1427821739.db2.gz QBRTUENHSSXZGT-UHFFFAOYSA-N 0 0 393.387 3.401 20 5 GGBDRN Cc1ccccc1Cc1noc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000175583548 1427822188 /nfs/dbraw/zinc/82/21/88/1427822188.db2.gz IGQPMKUDBGMLHP-UHFFFAOYSA-N 0 0 393.447 3.199 20 5 GGBDRN CN(C)c1cc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc2n1 ZINC000175605632 1427829131 /nfs/dbraw/zinc/82/91/31/1427829131.db2.gz ZCTYNAXKHWUBOZ-UHFFFAOYSA-N 0 0 393.447 3.327 20 5 GGBDRN O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)Nc1cccc([N+](=O)[O-])c1 ZINC000175611753 1427831672 /nfs/dbraw/zinc/83/16/72/1427831672.db2.gz QAORGJPSFATVAN-UHFFFAOYSA-N 0 0 396.447 3.198 20 5 GGBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000175623426 1427835962 /nfs/dbraw/zinc/83/59/62/1427835962.db2.gz WVOUFCCAEHVOEJ-CQSZACIVSA-N 0 0 384.436 3.198 20 5 GGBDRN O=C(OCc1cn2ccccc2n1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175640730 1427841121 /nfs/dbraw/zinc/84/11/21/1427841121.db2.gz UTLGCKRAGWTNHW-UHFFFAOYSA-N 0 0 376.166 3.362 20 5 GGBDRN O=C(NCC1(CN2CCOCC2)CCCCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000175652191 1427845427 /nfs/dbraw/zinc/84/54/27/1427845427.db2.gz PMTHUXWJMFQJCW-UHFFFAOYSA-N 0 0 395.887 3.261 20 5 GGBDRN Cc1nc(NC(=O)CCCNC(=O)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000175666009 1427850109 /nfs/dbraw/zinc/85/01/09/1427850109.db2.gz FESQAWYULDNOLS-UHFFFAOYSA-N 0 0 376.800 3.100 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCC(C)(C)N2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000175669330 1427851177 /nfs/dbraw/zinc/85/11/77/1427851177.db2.gz CJYZVFBKDQKGHQ-XHSDSOJGSA-N 0 0 392.500 3.151 20 5 GGBDRN Cc1ccc(C)c(N2N=C(C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)CCC2=O)c1 ZINC000175673956 1427852442 /nfs/dbraw/zinc/85/24/42/1427852442.db2.gz ASSKCXICHOJUDZ-UHFFFAOYSA-N 0 0 381.392 3.037 20 5 GGBDRN COC(=O)c1ccc(CCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175687082 1427857183 /nfs/dbraw/zinc/85/71/83/1427857183.db2.gz VHHYWUBCJLUEAO-AWEZNQCLSA-N 0 0 385.420 3.293 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175686396 1427857268 /nfs/dbraw/zinc/85/72/68/1427857268.db2.gz ICIOCAPPTDGBSF-BBRMVZONSA-N 0 0 399.472 3.190 20 5 GGBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175686379 1427857364 /nfs/dbraw/zinc/85/73/64/1427857364.db2.gz ICIOCAPPTDGBSF-CJNGLKHVSA-N 0 0 399.472 3.190 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000175688651 1427858262 /nfs/dbraw/zinc/85/82/62/1427858262.db2.gz XNIXDOLKLQYTQV-UHFFFAOYSA-N 0 0 381.860 3.405 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])CC2)n1 ZINC000175691233 1427859951 /nfs/dbraw/zinc/85/99/51/1427859951.db2.gz BWAYQECUOHJEBQ-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1 ZINC000175692352 1427860285 /nfs/dbraw/zinc/86/02/85/1427860285.db2.gz HEUXRRQTJREWAN-CYBMUJFWSA-N 0 0 398.337 3.092 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H](C)c1c(F)cccc1Cl ZINC000175697141 1427861994 /nfs/dbraw/zinc/86/19/94/1427861994.db2.gz GMHKMOKZKPYAIF-GHMZBOCLSA-N 0 0 393.802 3.383 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000175697177 1427862010 /nfs/dbraw/zinc/86/20/10/1427862010.db2.gz GMHKMOKZKPYAIF-MNOVXSKESA-N 0 0 393.802 3.383 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccccc2CN(C)Cc2ccco2)c1[N+](=O)[O-] ZINC000175706760 1427865680 /nfs/dbraw/zinc/86/56/80/1427865680.db2.gz CUXLOLNMRLVOKO-UHFFFAOYSA-N 0 0 397.435 3.035 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000175708686 1427866179 /nfs/dbraw/zinc/86/61/79/1427866179.db2.gz JTFODRCQWHTYEQ-OLZOCXBDSA-N 0 0 377.828 3.061 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)COc2cccc(Cl)c2Cl)c1 ZINC000175707738 1427866213 /nfs/dbraw/zinc/86/62/13/1427866213.db2.gz YTRHCDHHZSDFCU-NSHDSACASA-N 0 0 399.230 3.380 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc([S@@](C)=O)cc1 ZINC000175708920 1427866579 /nfs/dbraw/zinc/86/65/79/1427866579.db2.gz ZCVFBRHBMORWSN-HHHXNRCGSA-N 0 0 389.477 3.452 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc([S@](C)=O)cc1 ZINC000175708901 1427866607 /nfs/dbraw/zinc/86/66/07/1427866607.db2.gz ZCVFBRHBMORWSN-MHZLTWQESA-N 0 0 389.477 3.452 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCSc2ccncc21 ZINC000175714163 1427867894 /nfs/dbraw/zinc/86/78/94/1427867894.db2.gz VYIOAUHULYGUEA-UHFFFAOYSA-N 0 0 384.461 3.345 20 5 GGBDRN O=C(NCc1ccc(CN2CCCC2=O)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175721877 1427869771 /nfs/dbraw/zinc/86/97/71/1427869771.db2.gz VFAASGUFSDKASK-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN C[S@@](=O)c1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175724674 1427870754 /nfs/dbraw/zinc/87/07/54/1427870754.db2.gz WGSFECUPJBKZIF-AREMUKBSSA-N 0 0 375.450 3.067 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1[N+](=O)[O-] ZINC000175731845 1427872414 /nfs/dbraw/zinc/87/24/14/1427872414.db2.gz WCICXUGXRLQJRF-UHFFFAOYSA-N 0 0 382.355 3.283 20 5 GGBDRN Cc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000175734469 1427873243 /nfs/dbraw/zinc/87/32/43/1427873243.db2.gz WGBMGDIHYQXGNJ-KDOFPFPSSA-N 0 0 382.420 3.069 20 5 GGBDRN Cc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000175734434 1427873302 /nfs/dbraw/zinc/87/33/02/1427873302.db2.gz WGBMGDIHYQXGNJ-KSSFIOAISA-N 0 0 382.420 3.069 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175734914 1427873548 /nfs/dbraw/zinc/87/35/48/1427873548.db2.gz IEJMCVYRYRGQLM-CQSZACIVSA-N 0 0 384.436 3.213 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1[N+](=O)[O-] ZINC000175736044 1427874096 /nfs/dbraw/zinc/87/40/96/1427874096.db2.gz ZTCWYAFSTSKMQB-SFHVURJKSA-N 0 0 399.422 3.006 20 5 GGBDRN Cc1ccc(N2CCC(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000175736987 1427874272 /nfs/dbraw/zinc/87/42/72/1427874272.db2.gz FZUATDROBMUBSC-HNNXBMFYSA-N 0 0 383.452 3.327 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)s1 ZINC000175741599 1427875953 /nfs/dbraw/zinc/87/59/53/1427875953.db2.gz RZGHWORRCAAROQ-UHFFFAOYSA-N 0 0 393.852 3.216 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000175767467 1427885450 /nfs/dbraw/zinc/88/54/50/1427885450.db2.gz CNFHOBWNQNDCOK-UHFFFAOYSA-N 0 0 395.337 3.345 20 5 GGBDRN CCOc1cc2c(cc1OCC)CN(C(=O)c1cccc([N+](=O)[O-])c1N)CC2 ZINC000175778400 1427889626 /nfs/dbraw/zinc/88/96/26/1427889626.db2.gz YJJMZOKBZZTFSI-UHFFFAOYSA-N 0 0 385.420 3.173 20 5 GGBDRN CCOC(=O)c1ccnc(N2CC[C@@H](OCCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000175783172 1427891400 /nfs/dbraw/zinc/89/14/00/1427891400.db2.gz WAIGBFPVKVESGR-QGZVFWFLSA-N 0 0 399.447 3.395 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)c3cccc(Cl)c3[N+](=O)[O-])n2)cc1 ZINC000175785217 1427891888 /nfs/dbraw/zinc/89/18/88/1427891888.db2.gz WMLHEWZYAXARIB-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN O=C(Nc1cccc(CN2CCOCC2)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175794956 1427896133 /nfs/dbraw/zinc/89/61/33/1427896133.db2.gz VYPWNNHQRJPTBZ-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN COc1cc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)c2ccccc2n1 ZINC000175801114 1427898251 /nfs/dbraw/zinc/89/82/51/1427898251.db2.gz QAWQNLBLALZQAA-UHFFFAOYSA-N 0 0 380.404 3.194 20 5 GGBDRN Cc1cc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)n(-c2ccc(C)nn2)n1 ZINC000175808832 1427902135 /nfs/dbraw/zinc/90/21/35/1427902135.db2.gz SZZDBDAKXJBNLD-ZDUSSCGKSA-N 0 0 398.448 3.307 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000175815076 1427907033 /nfs/dbraw/zinc/90/70/33/1427907033.db2.gz YJOQCVVLJBQDLD-PBHICJAKSA-N 0 0 389.477 3.491 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1nc(-c2cccs2)cs1 ZINC000175832789 1427917405 /nfs/dbraw/zinc/91/74/05/1427917405.db2.gz OKBIOZOHRVMHRG-UHFFFAOYSA-N 0 0 388.430 3.035 20 5 GGBDRN CN1C(=O)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c2ccccc21 ZINC000175837868 1427921019 /nfs/dbraw/zinc/92/10/19/1427921019.db2.gz GBTSFKOQSAAWEL-UHFFFAOYSA-N 0 0 379.294 3.237 20 5 GGBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCN(c2ccc(Cl)cn2)CC1 ZINC000175845132 1427926984 /nfs/dbraw/zinc/92/69/84/1427926984.db2.gz HKPJQMACHGETPO-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN CCC1(CNC(=O)[C@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000175848821 1427930613 /nfs/dbraw/zinc/93/06/13/1427930613.db2.gz MVDSNQYMINRTOO-INIZCTEOSA-N 0 0 393.509 3.143 20 5 GGBDRN COc1ccc(-c2nc(COC(=O)c3cc(F)cc(C)c3[N+](=O)[O-])no2)cc1 ZINC000175850328 1427931601 /nfs/dbraw/zinc/93/16/01/1427931601.db2.gz CZGJAPUBBVFZFX-UHFFFAOYSA-N 0 0 387.323 3.458 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(CCc1ccccc1)[C@@H]1CCOC1 ZINC000175859789 1427936845 /nfs/dbraw/zinc/93/68/45/1427936845.db2.gz CRCUOQGWMGVDEX-QGZVFWFLSA-N 0 0 385.420 3.469 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](OCCCc3ccccc3)C2)cc1 ZINC000175864088 1427940171 /nfs/dbraw/zinc/94/01/71/1427940171.db2.gz XXKPRWUGWKRHOR-SFHVURJKSA-N 0 0 390.461 3.007 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2ccc(OC)cc2OC2CCCC2)c1[N+](=O)[O-] ZINC000175864874 1427941053 /nfs/dbraw/zinc/94/10/53/1427941053.db2.gz YMLSPRLUECNMCC-UHFFFAOYSA-N 0 0 388.424 3.140 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175892836 1427955778 /nfs/dbraw/zinc/95/57/78/1427955778.db2.gz LHQQEDIGXVMHQG-UHFFFAOYSA-N 0 0 379.394 3.025 20 5 GGBDRN COc1ccc(S(=O)(=O)NC(C)(C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000175897294 1427958306 /nfs/dbraw/zinc/95/83/06/1427958306.db2.gz BLKPOVGNLUHTGQ-UHFFFAOYSA-N 0 0 386.376 3.095 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c(N)c([N+](=O)[O-])c1 ZINC000175923920 1427974202 /nfs/dbraw/zinc/97/42/02/1427974202.db2.gz XHBYSFQGYBAADM-UHFFFAOYSA-N 0 0 396.325 3.030 20 5 GGBDRN CSc1ccc(C(=O)N[C@H](C)C2(N3CCOCC3)CCCC2)cc1[N+](=O)[O-] ZINC000175923043 1427974478 /nfs/dbraw/zinc/97/44/78/1427974478.db2.gz ZVUOVCHDTGVWLP-CQSZACIVSA-N 0 0 393.509 3.080 20 5 GGBDRN CC(C)Oc1ccc(CC[C@@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000175924025 1427974694 /nfs/dbraw/zinc/97/46/94/1427974694.db2.gz TVDHFXKQOYIDDF-OAHLLOKOSA-N 0 0 399.447 3.458 20 5 GGBDRN COC(=O)c1ccc(OCc2nc(Cc3ccccc3C)no2)c([N+](=O)[O-])c1 ZINC000175934559 1427982377 /nfs/dbraw/zinc/98/23/77/1427982377.db2.gz ZWLOZRONSRLPKE-UHFFFAOYSA-N 0 0 383.360 3.243 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000175936511 1427983170 /nfs/dbraw/zinc/98/31/70/1427983170.db2.gz YPSHYPDURHXPFH-CQSZACIVSA-N 0 0 394.435 3.353 20 5 GGBDRN Cc1ccccc1Cc1noc(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000175939416 1427984873 /nfs/dbraw/zinc/98/48/73/1427984873.db2.gz FCTDTEZGCWHUNZ-UHFFFAOYSA-N 0 0 376.376 3.184 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000175941294 1427986188 /nfs/dbraw/zinc/98/61/88/1427986188.db2.gz RLFBHSMAPGHOKU-UHFFFAOYSA-N 0 0 391.387 3.385 20 5 GGBDRN CCOc1cc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2N)ccc1OC(F)F ZINC000175947920 1427989565 /nfs/dbraw/zinc/98/95/65/1427989565.db2.gz ANZDEKBTWSQHRC-UHFFFAOYSA-N 0 0 395.362 3.449 20 5 GGBDRN C[C@H](Sc1nnc2n(C)c3ccccc3n12)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000175947654 1427989776 /nfs/dbraw/zinc/98/97/76/1427989776.db2.gz XHGRFBYIBHFWSE-NSHDSACASA-N 0 0 396.432 3.249 20 5 GGBDRN CN(C(=O)CN1CC[C@@H](OCCCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175958600 1427998072 /nfs/dbraw/zinc/99/80/72/1427998072.db2.gz FBGFRRUAXWYHIP-OAQYLSRUSA-N 0 0 397.475 3.281 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cnc1Cl ZINC000175968834 1428004646 /nfs/dbraw/zinc/00/46/46/1428004646.db2.gz WYDQEQZNJMYIOZ-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2ccc3nc(C4CC4)oc3c2)cc1[N+](=O)[O-] ZINC000175973902 1428006623 /nfs/dbraw/zinc/00/66/23/1428006623.db2.gz BLHXTRDSPBETPG-UHFFFAOYSA-N 0 0 389.389 3.423 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1nc(-c2cccs2)cs1 ZINC000175973511 1428006926 /nfs/dbraw/zinc/00/69/26/1428006926.db2.gz IMZLTUARBSTKOL-UHFFFAOYSA-N 0 0 388.430 3.035 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)NCc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000175976133 1428008255 /nfs/dbraw/zinc/00/82/55/1428008255.db2.gz VUWQAMFNHZWERK-UHFFFAOYSA-N 0 0 397.479 3.129 20 5 GGBDRN CN(C)c1cc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)c2ccccc2n1 ZINC000175975397 1428008693 /nfs/dbraw/zinc/00/86/93/1428008693.db2.gz CSOKFVKNHSHITM-UHFFFAOYSA-N 0 0 379.420 3.208 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1nc(-c2cccc(F)c2)no1 ZINC000175977023 1428009424 /nfs/dbraw/zinc/00/94/24/1428009424.db2.gz NLKKUPFFVCOGBZ-LLVKDONJSA-N 0 0 385.355 3.344 20 5 GGBDRN C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1nc(-c2cccc(F)c2)no1 ZINC000175977008 1428009504 /nfs/dbraw/zinc/00/95/04/1428009504.db2.gz NLKKUPFFVCOGBZ-NSHDSACASA-N 0 0 385.355 3.344 20 5 GGBDRN CC(C)CCOCCNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000175980382 1428011070 /nfs/dbraw/zinc/01/10/70/1428011070.db2.gz QAXVZAOEEYDKPU-UHFFFAOYSA-N 0 0 379.457 3.210 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)nc(C)n1 ZINC000175981765 1428011363 /nfs/dbraw/zinc/01/13/63/1428011363.db2.gz XGUPDVYAIHUOOK-UHFFFAOYSA-N 0 0 389.843 3.054 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 ZINC000175986745 1428013614 /nfs/dbraw/zinc/01/36/14/1428013614.db2.gz WUACQUUBUUERSM-ZIAGYGMSSA-N 0 0 384.436 3.473 20 5 GGBDRN O=C(CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])Nc1cccc2cccnc21 ZINC000176008190 1428024639 /nfs/dbraw/zinc/02/46/39/1428024639.db2.gz FJOMRONTPGWDDL-UHFFFAOYSA-N 0 0 384.779 3.165 20 5 GGBDRN NC(=O)c1c(Cl)cccc1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176019849 1428030187 /nfs/dbraw/zinc/03/01/87/1428030187.db2.gz MESMGFLFXGQNRL-UHFFFAOYSA-N 0 0 398.600 3.362 20 5 GGBDRN COc1cc(CNC(=O)c2cccc([N+](=O)[O-])c2N)ccc1OCC(F)(F)F ZINC000176027006 1428034069 /nfs/dbraw/zinc/03/40/69/1428034069.db2.gz BMHFJQGXNMSOLO-UHFFFAOYSA-N 0 0 399.325 3.057 20 5 GGBDRN C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)c1nc2ccc(Cl)cc2n1C ZINC000176029931 1428035381 /nfs/dbraw/zinc/03/53/81/1428035381.db2.gz HEVXQHZBCUXSCR-JTQLQIEISA-N 0 0 377.788 3.026 20 5 GGBDRN CC(C)[C@H](CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cccnc1 ZINC000176036681 1428039099 /nfs/dbraw/zinc/03/90/99/1428039099.db2.gz BCFOAVGFDHDRHD-AWEZNQCLSA-N 0 0 390.827 3.138 20 5 GGBDRN C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)c1nc2cc(Cl)ccc2n1C ZINC000176048554 1428049259 /nfs/dbraw/zinc/04/92/59/1428049259.db2.gz LPJDGJDUYKOTNS-JTQLQIEISA-N 0 0 377.788 3.026 20 5 GGBDRN C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)c1nc2cc(Cl)ccc2n1C ZINC000176048572 1428049335 /nfs/dbraw/zinc/04/93/35/1428049335.db2.gz LPJDGJDUYKOTNS-SNVBAGLBSA-N 0 0 377.788 3.026 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(CCCO)[C@H]1CCc2ccccc21 ZINC000176050870 1428050733 /nfs/dbraw/zinc/05/07/33/1428050733.db2.gz HEGKAKGASLQIJF-IBGZPJMESA-N 0 0 399.447 3.185 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(-c2cc[nH]n2)c1 ZINC000176056815 1428055619 /nfs/dbraw/zinc/05/56/19/1428055619.db2.gz ALVYFEMQJWUKPT-UHFFFAOYSA-N 0 0 376.369 3.233 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)ncc1Br ZINC000176066528 1428063822 /nfs/dbraw/zinc/06/38/22/1428063822.db2.gz XLLVALQUZBOILT-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN C[C@H](N1CCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1)C(F)(F)F ZINC000176068488 1428065607 /nfs/dbraw/zinc/06/56/07/1428065607.db2.gz MLXSUMYRMBBWEC-JTQLQIEISA-N 0 0 390.387 3.398 20 5 GGBDRN O=C(C[C@@H]1COCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1cccs1 ZINC000176077871 1428070395 /nfs/dbraw/zinc/07/03/95/1428070395.db2.gz MMDYYXKZKMIQLP-GFCCVEGCSA-N 0 0 394.836 3.424 20 5 GGBDRN CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000176087575 1428074892 /nfs/dbraw/zinc/07/48/92/1428074892.db2.gz SSDCBPQVVMWIMA-UHFFFAOYSA-N 0 0 393.346 3.226 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000176089703 1428076237 /nfs/dbraw/zinc/07/62/37/1428076237.db2.gz QWMGZRWKPRNATB-AWEZNQCLSA-N 0 0 395.749 3.062 20 5 GGBDRN COc1cc(OCC(=O)N2C[C@@H](C(C)C)Nc3ccccc32)ccc1[N+](=O)[O-] ZINC000176093993 1428078769 /nfs/dbraw/zinc/07/87/69/1428078769.db2.gz VDNOISHESSFDCC-INIZCTEOSA-N 0 0 385.420 3.466 20 5 GGBDRN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176097005 1428081463 /nfs/dbraw/zinc/08/14/63/1428081463.db2.gz XTOBWTDLIYSEHF-UHFFFAOYSA-N 0 0 397.410 3.411 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000176109556 1428087858 /nfs/dbraw/zinc/08/78/58/1428087858.db2.gz YQZMRFBEOWMDIK-CQSZACIVSA-N 0 0 382.844 3.439 20 5 GGBDRN COc1cccc2c1OC[C@@H](NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000176122742 1428096648 /nfs/dbraw/zinc/09/66/48/1428096648.db2.gz OAQNRUDGLKSIBX-CJNGLKHVSA-N 0 0 385.420 3.276 20 5 GGBDRN C[C@H](O)CC(C)(C)CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000176122660 1428096825 /nfs/dbraw/zinc/09/68/25/1428096825.db2.gz GEEOIXWJMWTFAZ-HNNXBMFYSA-N 0 0 377.485 3.358 20 5 GGBDRN Cn1cc(CCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c2ccccc21 ZINC000176127057 1428099809 /nfs/dbraw/zinc/09/98/09/1428099809.db2.gz UWRITJVOBLBAHB-UHFFFAOYSA-N 0 0 392.459 3.368 20 5 GGBDRN COc1ccccc1C[C@@H](NC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000176134591 1428108006 /nfs/dbraw/zinc/10/80/06/1428108006.db2.gz NSPSFJLLGISUCQ-QGZVFWFLSA-N 0 0 399.447 3.234 20 5 GGBDRN COc1ccccc1C[C@H](NC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000176134577 1428108461 /nfs/dbraw/zinc/10/84/61/1428108461.db2.gz NSPSFJLLGISUCQ-KRWDZBQOSA-N 0 0 399.447 3.234 20 5 GGBDRN COCCOc1ccc(Cl)cc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000176157595 1428125587 /nfs/dbraw/zinc/12/55/87/1428125587.db2.gz UUDBWWRMYRNKGP-UHFFFAOYSA-N 0 0 378.812 3.246 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000176166000 1428132290 /nfs/dbraw/zinc/13/22/90/1428132290.db2.gz PITZUNYKSXWGPE-LJQANCHMSA-N 0 0 395.415 3.362 20 5 GGBDRN COc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000176169490 1428135712 /nfs/dbraw/zinc/13/57/12/1428135712.db2.gz OEIDNQHKANGVCA-QGZVFWFLSA-N 0 0 385.420 3.446 20 5 GGBDRN Cc1c(C(=O)OC[C@@H]2CC(=O)N(CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000176172484 1428137937 /nfs/dbraw/zinc/13/79/37/1428137937.db2.gz FRBSAIDJBRPJRD-QGZVFWFLSA-N 0 0 382.416 3.151 20 5 GGBDRN Cc1cc(=O)n(C)cc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000176182733 1428146130 /nfs/dbraw/zinc/14/61/30/1428146130.db2.gz UAYWHYXVLHAFTP-UHFFFAOYSA-N 0 0 398.341 3.061 20 5 GGBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000176182148 1428146169 /nfs/dbraw/zinc/14/61/69/1428146169.db2.gz KCJRZTKWAHOXDL-JEOXALJRSA-N 0 0 399.378 3.082 20 5 GGBDRN COc1ccccc1CN1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000176182136 1428146400 /nfs/dbraw/zinc/14/64/00/1428146400.db2.gz WPWVCFHPJRBJPZ-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000176185092 1428148603 /nfs/dbraw/zinc/14/86/03/1428148603.db2.gz QGNSYFLAUCYNTL-OAHLLOKOSA-N 0 0 384.436 3.002 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000176190998 1428155142 /nfs/dbraw/zinc/15/51/42/1428155142.db2.gz FQLSHKYCGJCUER-UHFFFAOYSA-N 0 0 381.432 3.405 20 5 GGBDRN Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000176204154 1428166032 /nfs/dbraw/zinc/16/60/32/1428166032.db2.gz UXNVFLJCLYJNQD-UHFFFAOYSA-N 0 0 382.420 3.410 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000176205098 1428166661 /nfs/dbraw/zinc/16/66/61/1428166661.db2.gz KLQPVDSBYQIPCU-UHFFFAOYSA-N 0 0 382.380 3.056 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000176208638 1428168596 /nfs/dbraw/zinc/16/85/96/1428168596.db2.gz FYDSEHZKUXYBGR-INIZCTEOSA-N 0 0 377.441 3.043 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC[C@H]2CC(=O)c2cccs2)c(C)c1[N+](=O)[O-] ZINC000176217743 1428173808 /nfs/dbraw/zinc/17/38/08/1428173808.db2.gz RLUFDSHVTCOPEM-AWEZNQCLSA-N 0 0 390.465 3.124 20 5 GGBDRN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)cc1NC(=O)c1ccncc1 ZINC000176224232 1428177152 /nfs/dbraw/zinc/17/71/52/1428177152.db2.gz XFEIITWLEHEXLH-UHFFFAOYSA-N 0 0 391.387 3.385 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000176228415 1428179697 /nfs/dbraw/zinc/17/96/97/1428179697.db2.gz XOQJWUMQOIOXQS-CZUORRHYSA-N 0 0 376.434 3.150 20 5 GGBDRN CC[C@H](NC(=O)N[C@H](C)c1nnnn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000176238855 1428186983 /nfs/dbraw/zinc/18/69/83/1428186983.db2.gz SMNOSKVPRKVVLM-DYVFJYSZSA-N 0 0 395.423 3.082 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000176248924 1428194515 /nfs/dbraw/zinc/19/45/15/1428194515.db2.gz XKDQOHTVGBUAQP-NHYWBVRUSA-N 0 0 386.433 3.261 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@H]2C[C@@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000176250668 1428195252 /nfs/dbraw/zinc/19/52/52/1428195252.db2.gz FHWQCBWWBJGQHP-DZGCQCFKSA-N 0 0 376.434 3.393 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@H]2C[C@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000176250635 1428195766 /nfs/dbraw/zinc/19/57/66/1428195766.db2.gz FHWQCBWWBJGQHP-ZFWWWQNUSA-N 0 0 376.434 3.393 20 5 GGBDRN O=C(NC1CCN(c2cccs2)CC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000176260142 1428203559 /nfs/dbraw/zinc/20/35/59/1428203559.db2.gz HDDIXHHQXFCNSB-UHFFFAOYSA-N 0 0 397.460 3.241 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C(=O)NCc1ccco1 ZINC000180178050 1429783831 /nfs/dbraw/zinc/78/38/31/1429783831.db2.gz LLNGOPWGQYIWCW-LBPRGKRZSA-N 0 0 391.449 3.123 20 5 GGBDRN Cc1ccccc1CNc1ccccc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000180181434 1429786797 /nfs/dbraw/zinc/78/67/97/1429786797.db2.gz RHPIVPIKRYVPAZ-UHFFFAOYSA-N 0 0 392.415 3.316 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CCO)cc1C ZINC000180181695 1429786850 /nfs/dbraw/zinc/78/68/50/1429786850.db2.gz TVBRZLNXOWCDOR-INIZCTEOSA-N 0 0 392.477 3.173 20 5 GGBDRN C[C@@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000180181781 1429786912 /nfs/dbraw/zinc/78/69/12/1429786912.db2.gz PTCAWCMNYVRPPG-ZDUSSCGKSA-N 0 0 398.868 3.210 20 5 GGBDRN CC[N@@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000180192465 1429794467 /nfs/dbraw/zinc/79/44/67/1429794467.db2.gz OXCMYXQTSDTTFG-QGZVFWFLSA-N 0 0 399.447 3.133 20 5 GGBDRN CC[N@@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000180192945 1429794498 /nfs/dbraw/zinc/79/44/98/1429794498.db2.gz SNRLKXMVAQPSGY-QGZVFWFLSA-N 0 0 399.447 3.133 20 5 GGBDRN CC(=O)N1CCC(CNC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC1 ZINC000180198765 1429799481 /nfs/dbraw/zinc/79/94/81/1429799481.db2.gz NHMQOMJIOXOKHW-UHFFFAOYSA-N 0 0 379.482 3.084 20 5 GGBDRN Cc1ccc([C@@](O)(CC(=O)N2CCc3c2cccc3[N+](=O)[O-])C(F)(F)F)o1 ZINC000180208631 1429802411 /nfs/dbraw/zinc/80/24/11/1429802411.db2.gz BRSWUIGXZIPHDO-INIZCTEOSA-N 0 0 384.310 3.226 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)nc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180211800 1429803199 /nfs/dbraw/zinc/80/31/99/1429803199.db2.gz ZIPWTEDFYHZSLF-UHFFFAOYSA-N 0 0 375.291 3.029 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1nc2ccccc2[nH]1 ZINC000180239766 1429811985 /nfs/dbraw/zinc/81/19/85/1429811985.db2.gz BRPYXCREPOJIHU-MRXNPFEDSA-N 0 0 382.376 3.327 20 5 GGBDRN CC(C)(O)CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000180241228 1429812376 /nfs/dbraw/zinc/81/23/76/1429812376.db2.gz VPONOUYLJINEAL-UHFFFAOYSA-N 0 0 382.420 3.418 20 5 GGBDRN CN(Cc1nccn1C(F)F)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180241844 1429812915 /nfs/dbraw/zinc/81/29/15/1429812915.db2.gz ZTIITBGLNXOIMX-UHFFFAOYSA-N 0 0 376.266 3.060 20 5 GGBDRN CC(C)(O)CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000180244643 1429813300 /nfs/dbraw/zinc/81/33/00/1429813300.db2.gz MXPNHOBQQAIXSP-UHFFFAOYSA-N 0 0 391.855 3.460 20 5 GGBDRN COc1cc(F)cc(CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1 ZINC000180248363 1429814301 /nfs/dbraw/zinc/81/43/01/1429814301.db2.gz YRKKUWAGSNMKCR-UHFFFAOYSA-N 0 0 377.328 3.198 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180256241 1429816438 /nfs/dbraw/zinc/81/64/38/1429816438.db2.gz UHQUQEVXKWLESP-FUHWJXTLSA-N 0 0 394.786 3.413 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Cn2ccnn2)CC1 ZINC000180263919 1429818320 /nfs/dbraw/zinc/81/83/20/1429818320.db2.gz NWHYCXPQJQJREO-UHFFFAOYSA-N 0 0 389.481 3.239 20 5 GGBDRN CCC[C@](C)(CO)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000180264973 1429818632 /nfs/dbraw/zinc/81/86/32/1429818632.db2.gz YAYFLKAOUSPQBJ-VBKZILBWSA-N 0 0 386.452 3.444 20 5 GGBDRN CCC[C@](C)(CO)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000180265008 1429818738 /nfs/dbraw/zinc/81/87/38/1429818738.db2.gz YAYFLKAOUSPQBJ-JLTOFOAXSA-N 0 0 386.452 3.444 20 5 GGBDRN COc1cc(CN2CC[C@@H](OCC(C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180273818 1429821110 /nfs/dbraw/zinc/82/11/10/1429821110.db2.gz VWCJFNYZLGAOTJ-CQSZACIVSA-N 0 0 388.411 3.494 20 5 GGBDRN CC(=O)NCCCCCC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180283677 1429824367 /nfs/dbraw/zinc/82/43/67/1429824367.db2.gz UTYHXWOTUOLHJY-UHFFFAOYSA-N 0 0 390.465 3.378 20 5 GGBDRN CCOCCO[C@@H](C)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180288823 1429826085 /nfs/dbraw/zinc/82/60/85/1429826085.db2.gz WRZZZNKVTJLQDJ-LBPRGKRZSA-N 0 0 379.438 3.123 20 5 GGBDRN C[C@H](OC[C@@H]1CCCO1)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180292756 1429827110 /nfs/dbraw/zinc/82/71/10/1429827110.db2.gz WUKIRGKGCDURMJ-STQMWFEESA-N 0 0 391.449 3.265 20 5 GGBDRN CC(C)CC(=O)NCCC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180298997 1429829225 /nfs/dbraw/zinc/82/92/25/1429829225.db2.gz PMFKPSFXKQLPKW-UHFFFAOYSA-N 0 0 390.465 3.234 20 5 GGBDRN COc1ccc(CN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](CO)C(C)C)cc1 ZINC000180305217 1429831077 /nfs/dbraw/zinc/83/10/77/1429831077.db2.gz RJBUGCSPOIWSTN-LJQANCHMSA-N 0 0 390.411 3.402 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC[C@@H]2CC(=O)c2ccccc2)c1[N+](=O)[O-] ZINC000180332620 1429838173 /nfs/dbraw/zinc/83/81/73/1429838173.db2.gz UMQXDODXDPKIRA-OAHLLOKOSA-N 0 0 383.404 3.408 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)cc1O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000180333959 1429838279 /nfs/dbraw/zinc/83/82/79/1429838279.db2.gz IBJBHBFCUCMBGL-UHFFFAOYSA-N 0 0 395.337 3.282 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000180335481 1429838532 /nfs/dbraw/zinc/83/85/32/1429838532.db2.gz OORUTTPIZJNYSD-WMZOPIPTSA-N 0 0 384.498 3.041 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2CCCOc3c(F)cccc32)cc1 ZINC000180336301 1429838759 /nfs/dbraw/zinc/83/87/59/1429838759.db2.gz WNSXWUXUCIXJSG-QGZVFWFLSA-N 0 0 394.424 3.110 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCCOc3c(F)cccc32)cc1 ZINC000180336283 1429838924 /nfs/dbraw/zinc/83/89/24/1429838924.db2.gz WNSXWUXUCIXJSG-KRWDZBQOSA-N 0 0 394.424 3.110 20 5 GGBDRN COc1ccc(C[C@@H](C)C(=O)NCCNc2ccccc2[N+](=O)[O-])cc1OC ZINC000180339161 1429839528 /nfs/dbraw/zinc/83/95/28/1429839528.db2.gz IYMXGQVWYHNLNZ-CQSZACIVSA-N 0 0 387.436 3.019 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000180347039 1429841791 /nfs/dbraw/zinc/84/17/91/1429841791.db2.gz ATILFKYLNDNPSP-QGZVFWFLSA-N 0 0 395.337 3.043 20 5 GGBDRN CC(C)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1nccs1 ZINC000180355057 1429844306 /nfs/dbraw/zinc/84/43/06/1429844306.db2.gz DDOQGCOGXRCHKC-CYBMUJFWSA-N 0 0 396.856 3.488 20 5 GGBDRN CCc1nc2ccccc2n1C1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1 ZINC000180361291 1429846191 /nfs/dbraw/zinc/84/61/91/1429846191.db2.gz YQHLURIJKVRGOR-UHFFFAOYSA-N 0 0 395.419 3.085 20 5 GGBDRN CC(C)C[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1nccs1 ZINC000180360887 1429846235 /nfs/dbraw/zinc/84/62/35/1429846235.db2.gz VRISZKVYXQZQJJ-OAHLLOKOSA-N 0 0 390.465 3.154 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180394349 1429855710 /nfs/dbraw/zinc/85/57/10/1429855710.db2.gz BBESMKLNTVHWDQ-CVEARBPZSA-N 0 0 398.463 3.006 20 5 GGBDRN O=C(c1cc(NCCCOCC(F)(F)F)ccc1[N+](=O)[O-])N1CCCC1 ZINC000180407760 1429860101 /nfs/dbraw/zinc/86/01/01/1429860101.db2.gz OETIFCNUJXZDPU-UHFFFAOYSA-N 0 0 375.347 3.212 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)nc2c1 ZINC000180423400 1429865011 /nfs/dbraw/zinc/86/50/11/1429865011.db2.gz QYHJYOGLKXQWCS-LBPRGKRZSA-N 0 0 389.433 3.380 20 5 GGBDRN C[C@H](NCc1nnnn1-c1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000180453855 1429872847 /nfs/dbraw/zinc/87/28/47/1429872847.db2.gz RACWTQUVKHFEFJ-NSHDSACASA-N 0 0 390.350 3.023 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CCCN(C(=O)C2CC2)C1 ZINC000180469704 1429876573 /nfs/dbraw/zinc/87/65/73/1429876573.db2.gz QYDGRTSTVHECRS-NSHDSACASA-N 0 0 385.342 3.201 20 5 GGBDRN C[C@@]12CCC(=O)N1[C@@H](C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CS2 ZINC000180469368 1429876598 /nfs/dbraw/zinc/87/65/98/1429876598.db2.gz UMKMLGLLLDCQGO-BXUZGUMPSA-N 0 0 389.355 3.006 20 5 GGBDRN C[C@]12CCC(=O)N1[C@@H](C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CS2 ZINC000180469383 1429876654 /nfs/dbraw/zinc/87/66/54/1429876654.db2.gz UMKMLGLLLDCQGO-RISCZKNCSA-N 0 0 389.355 3.006 20 5 GGBDRN Cc1nn(C)c2ncc(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)cc12 ZINC000180470581 1429876990 /nfs/dbraw/zinc/87/69/90/1429876990.db2.gz RCIAOJQERBQURU-UHFFFAOYSA-N 0 0 379.298 3.456 20 5 GGBDRN CCc1cc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccccc2n1 ZINC000180473802 1429877866 /nfs/dbraw/zinc/87/78/66/1429877866.db2.gz AVMHKZFLNBKLIR-UHFFFAOYSA-N 0 0 392.371 3.252 20 5 GGBDRN COc1ccc(NC(=O)CN(C)Cc2cc(F)c(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000180483670 1429879957 /nfs/dbraw/zinc/87/99/57/1429879957.db2.gz VYNXJXHRDXOUAN-UHFFFAOYSA-N 0 0 383.326 3.091 20 5 GGBDRN CC(C)(C)C[C@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C(F)(F)F ZINC000180490895 1429881347 /nfs/dbraw/zinc/88/13/47/1429881347.db2.gz FEIIPUWWPAAUFP-LBPRGKRZSA-N 0 0 396.387 3.095 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCC(c2nc3ccccc3s2)CC1 ZINC000180494611 1429882380 /nfs/dbraw/zinc/88/23/80/1429882380.db2.gz KZJWFBHLJLIMRF-UHFFFAOYSA-N 0 0 383.433 3.202 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000180502447 1429884052 /nfs/dbraw/zinc/88/40/52/1429884052.db2.gz AOUUJCFVWCOZEG-RDJZCZTQSA-N 0 0 377.347 3.202 20 5 GGBDRN CCc1cc(NC(=O)CCn2c(C)csc2=O)c2cc([N+](=O)[O-])ccc2n1 ZINC000180503744 1429884313 /nfs/dbraw/zinc/88/43/13/1429884313.db2.gz UOJLVMLFUNZSSZ-UHFFFAOYSA-N 0 0 386.433 3.266 20 5 GGBDRN CCc1cc(NC(=O)C2CCN(C(=O)N(C)C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000180503432 1429884447 /nfs/dbraw/zinc/88/44/47/1429884447.db2.gz DFOYAFOIZZQIHJ-UHFFFAOYSA-N 0 0 399.451 3.038 20 5 GGBDRN CCc1cc(NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000180505610 1429884836 /nfs/dbraw/zinc/88/48/36/1429884836.db2.gz UWHRIMMOHPNWDW-AWEZNQCLSA-N 0 0 396.447 3.293 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1 ZINC000180516449 1429887380 /nfs/dbraw/zinc/88/73/80/1429887380.db2.gz SPAPVJBAGLTVNR-UHFFFAOYSA-N 0 0 391.359 3.150 20 5 GGBDRN Cc1ccc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])cnc3N)s2)cc1F ZINC000180523886 1429889322 /nfs/dbraw/zinc/88/93/22/1429889322.db2.gz RIOHDSVIMUECBG-UHFFFAOYSA-N 0 0 387.396 3.319 20 5 GGBDRN Cc1cc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])ccc1N1CCOCC1 ZINC000180529383 1429891008 /nfs/dbraw/zinc/89/10/08/1429891008.db2.gz QGVJLEXCXIFDBJ-UHFFFAOYSA-N 0 0 377.347 3.270 20 5 GGBDRN COc1ccc2[nH]cc(C3CCN(C(=O)c4cc([N+](=O)[O-])cnc4N)CC3)c2c1 ZINC000180546199 1429894699 /nfs/dbraw/zinc/89/46/99/1429894699.db2.gz GLUHCAPSHOGQRS-UHFFFAOYSA-N 0 0 395.419 3.082 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)c1[N+](=O)[O-] ZINC000180549737 1429895776 /nfs/dbraw/zinc/89/57/76/1429895776.db2.gz TXRMMBKHKHBLBQ-UHFFFAOYSA-N 0 0 394.313 3.094 20 5 GGBDRN CCC(CC)n1nc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000180560147 1429897852 /nfs/dbraw/zinc/89/78/52/1429897852.db2.gz ALOQISMHEDINIQ-CQSZACIVSA-N 0 0 386.456 3.182 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000180591324 1429917522 /nfs/dbraw/zinc/91/75/22/1429917522.db2.gz IBNFQPPAEYAVMP-ZDUSSCGKSA-N 0 0 392.818 3.465 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000180612683 1429932777 /nfs/dbraw/zinc/93/27/77/1429932777.db2.gz GODDZBUDRSUMJD-CYBMUJFWSA-N 0 0 392.818 3.465 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000180612700 1429933107 /nfs/dbraw/zinc/93/31/07/1429933107.db2.gz GODDZBUDRSUMJD-ZDUSSCGKSA-N 0 0 392.818 3.465 20 5 GGBDRN Cc1nc([C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)c2ccc(Cl)cc2)no1 ZINC000180617003 1429935423 /nfs/dbraw/zinc/93/54/23/1429935423.db2.gz ZHAZNHRSLUZPNO-KRWDZBQOSA-N 0 0 386.795 3.388 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000180616958 1429935477 /nfs/dbraw/zinc/93/54/77/1429935477.db2.gz XDHBGOWYYOQRIU-MAUKXSAKSA-N 0 0 379.457 3.386 20 5 GGBDRN COc1cccc(OCC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000180623267 1429938806 /nfs/dbraw/zinc/93/88/06/1429938806.db2.gz SAOACOMUJHJXSQ-UHFFFAOYSA-N 0 0 381.182 3.383 20 5 GGBDRN C[C@@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180624414 1429939242 /nfs/dbraw/zinc/93/92/42/1429939242.db2.gz YYTULOCUDKTDCW-PWSUYJOCSA-N 0 0 387.230 3.270 20 5 GGBDRN Cc1nc([C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])c2ccc(Cl)cc2)no1 ZINC000180628080 1429941206 /nfs/dbraw/zinc/94/12/06/1429941206.db2.gz AWXPZFMWFCEJBM-KRWDZBQOSA-N 0 0 386.795 3.388 20 5 GGBDRN COc1ccccc1CCCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000180642905 1429951117 /nfs/dbraw/zinc/95/11/17/1429951117.db2.gz NUEPJOYLLGINFB-HXUWFJFHSA-N 0 0 383.404 3.003 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180647723 1429953575 /nfs/dbraw/zinc/95/35/75/1429953575.db2.gz ZIKQTIRROBYTBF-UHFFFAOYSA-N 0 0 379.420 3.034 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N[C@H]2CC23CCCCC3)cc1[N+](=O)[O-] ZINC000180673524 1429967889 /nfs/dbraw/zinc/96/78/89/1429967889.db2.gz NOUZMYCPIGBAIU-HNNXBMFYSA-N 0 0 387.465 3.327 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 ZINC000180680113 1429972429 /nfs/dbraw/zinc/97/24/29/1429972429.db2.gz VAGPOEPKLRAJEO-UHFFFAOYSA-N 0 0 382.420 3.446 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(NC(=O)C2CCCC2)c1 ZINC000180683068 1429973719 /nfs/dbraw/zinc/97/37/19/1429973719.db2.gz GLQVRGPFHWFCBR-UHFFFAOYSA-N 0 0 382.420 3.236 20 5 GGBDRN Cc1ccc(S(=O)(=O)CCCn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000180691918 1429979351 /nfs/dbraw/zinc/97/93/51/1429979351.db2.gz MXSJSBXTLMUDMC-UHFFFAOYSA-N 0 0 386.433 3.026 20 5 GGBDRN CC1CC[NH+]([C@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])c2ccccc2)CC1 ZINC000180690820 1429979412 /nfs/dbraw/zinc/97/94/12/1429979412.db2.gz VKALMCAVOKCPTC-LJQANCHMSA-N 0 0 382.464 3.380 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000180702818 1429986575 /nfs/dbraw/zinc/98/65/75/1429986575.db2.gz SDOSVMPLAGJWKI-LBPRGKRZSA-N 0 0 375.347 3.325 20 5 GGBDRN O=C(N[C@@H]1CC12CCCCC2)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000180712391 1429993828 /nfs/dbraw/zinc/99/38/28/1429993828.db2.gz VEMVOFJBGOCAMX-TZMCWYRMSA-N 0 0 377.466 3.100 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCc2ccccc2N2CCCCC2)cccc1[N+](=O)[O-] ZINC000180761405 1430024280 /nfs/dbraw/zinc/02/42/80/1430024280.db2.gz REXBHCCLKPYXBQ-UHFFFAOYSA-N 0 0 396.447 3.148 20 5 GGBDRN CC(C)(O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000180770020 1430029526 /nfs/dbraw/zinc/02/95/26/1430029526.db2.gz PKXNDSLQUPAPMJ-UHFFFAOYSA-N 0 0 398.868 3.210 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180774343 1430031527 /nfs/dbraw/zinc/03/15/27/1430031527.db2.gz UTAADCWKEBODNX-LRDDRELGSA-N 0 0 397.859 3.287 20 5 GGBDRN CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])c1 ZINC000180774989 1430032256 /nfs/dbraw/zinc/03/22/56/1430032256.db2.gz JZXGRZYECQGVBX-UHFFFAOYSA-N 0 0 391.449 3.143 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCO1 ZINC000180776322 1430032963 /nfs/dbraw/zinc/03/29/63/1430032963.db2.gz HHIIZRHOKCATHK-CJNGLKHVSA-N 0 0 397.859 3.287 20 5 GGBDRN O=C(Nc1ccc(-n2cncn2)c(F)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180786855 1430039672 /nfs/dbraw/zinc/03/96/72/1430039672.db2.gz UHIMCBKSQYLDAL-UHFFFAOYSA-N 0 0 393.281 3.168 20 5 GGBDRN CC(C)(C)[S@](=O)Cc1cccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])c1 ZINC000180787729 1430040383 /nfs/dbraw/zinc/04/03/83/1430040383.db2.gz KNCRBIHOPAVCDF-AREMUKBSSA-N 0 0 375.450 3.477 20 5 GGBDRN CN(C[C@H](O)C(F)(F)F)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000180790199 1430041548 /nfs/dbraw/zinc/04/15/48/1430041548.db2.gz JMVVJCLQNJURLN-HNNXBMFYSA-N 0 0 383.326 3.334 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1 ZINC000180795969 1430045313 /nfs/dbraw/zinc/04/53/13/1430045313.db2.gz IOTUYGUQPPNHGW-GOSISDBHSA-N 0 0 389.839 3.416 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(CC(F)(F)F)c2ccncc2)c1C ZINC000180797510 1430046060 /nfs/dbraw/zinc/04/60/60/1430046060.db2.gz HUTAQNVYVJHYJR-UHFFFAOYSA-N 0 0 389.355 3.364 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1c(F)cccc1N1CCCC1 ZINC000180812222 1430053562 /nfs/dbraw/zinc/05/35/62/1430053562.db2.gz TUBAUQPIABQROI-UHFFFAOYSA-N 0 0 379.413 3.276 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000180811737 1430053832 /nfs/dbraw/zinc/05/38/32/1430053832.db2.gz WGXGILLEKHGGQP-QFBILLFUSA-N 0 0 386.452 3.494 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)OCc2nccn2C)cc1[N+](=O)[O-])c1ccccn1 ZINC000180819250 1430056344 /nfs/dbraw/zinc/05/63/44/1430056344.db2.gz YWEHZGPZCPXNNS-CYBMUJFWSA-N 0 0 381.392 3.253 20 5 GGBDRN O=C(N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000180836990 1430063585 /nfs/dbraw/zinc/06/35/85/1430063585.db2.gz FHXHMMHCOKVBFZ-SNVBAGLBSA-N 0 0 395.749 3.062 20 5 GGBDRN C[C@H]([NH2+]C(C)(C)CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)c1ccccc1 ZINC000736135399 1430068261 /nfs/dbraw/zinc/06/82/61/1430068261.db2.gz XZYPYJIIHOIDBI-ZDUSSCGKSA-N 0 0 381.440 3.316 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCO1 ZINC000180852593 1430070646 /nfs/dbraw/zinc/07/06/46/1430070646.db2.gz RMOGGNQRRRVLND-QFBILLFUSA-N 0 0 386.452 3.494 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)C)cc1NCc1ccc([N+](=O)[O-])cc1Cl ZINC000180859108 1430073066 /nfs/dbraw/zinc/07/30/66/1430073066.db2.gz PZWRDYUDAAXUHT-UHFFFAOYSA-N 0 0 399.856 3.119 20 5 GGBDRN COC1(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)CCC1 ZINC000180879356 1430084700 /nfs/dbraw/zinc/08/47/00/1430084700.db2.gz IRQHRAJJYGVVEZ-AWEZNQCLSA-N 0 0 384.436 3.462 20 5 GGBDRN CC[C@H](CO)NC(=O)c1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000180880327 1430085311 /nfs/dbraw/zinc/08/53/11/1430085311.db2.gz KNVCGHHBCJAJFQ-CQSZACIVSA-N 0 0 377.828 3.361 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1 ZINC000180884069 1430088015 /nfs/dbraw/zinc/08/80/15/1430088015.db2.gz HQXQQNCFPPARCW-UHFFFAOYSA-N 0 0 392.419 3.414 20 5 GGBDRN O=C(CCc1ccc2[nH]ccc2c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000180885359 1430088548 /nfs/dbraw/zinc/08/85/48/1430088548.db2.gz AJOMBHXHORGRRY-MRXNPFEDSA-N 0 0 379.420 3.117 20 5 GGBDRN CCC(CC)n1nc(C)cc1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000180885207 1430088782 /nfs/dbraw/zinc/08/87/82/1430088782.db2.gz QWSFJYJHQSYLOY-CQSZACIVSA-N 0 0 386.456 3.182 20 5 GGBDRN COCCc1nc(C)c([C@@H](C)OC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)s1 ZINC000180886049 1430089128 /nfs/dbraw/zinc/08/91/28/1430089128.db2.gz AFQNGHCKWBDLSZ-CYBMUJFWSA-N 0 0 396.469 3.056 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)c1[N+](=O)[O-] ZINC000180885766 1430089482 /nfs/dbraw/zinc/08/94/82/1430089482.db2.gz LKHHMUUOCWMQSN-ZDUSSCGKSA-N 0 0 398.341 3.113 20 5 GGBDRN O=C(N[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180895334 1430095719 /nfs/dbraw/zinc/09/57/19/1430095719.db2.gz CPZLHRWYOODOGX-JTQLQIEISA-N 0 0 395.749 3.062 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)c2c(N)cccc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000180919712 1430115514 /nfs/dbraw/zinc/11/55/14/1430115514.db2.gz DJBNNAYRRQCVEZ-LLVKDONJSA-N 0 0 383.383 3.301 20 5 GGBDRN CC(C)Cn1c(CCC(N)=O)nnc1SCc1ccc([N+](=O)[O-])cc1Cl ZINC000180939965 1430125908 /nfs/dbraw/zinc/12/59/08/1430125908.db2.gz UYDNRTSXEIUNLX-UHFFFAOYSA-N 0 0 397.888 3.206 20 5 GGBDRN CC(=O)NC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000180944960 1430127893 /nfs/dbraw/zinc/12/78/93/1430127893.db2.gz PEWCMOVBOSNJKZ-CQSZACIVSA-N 0 0 379.482 3.084 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000180947447 1430129464 /nfs/dbraw/zinc/12/94/64/1430129464.db2.gz PATFKIOLBSISGV-LBPRGKRZSA-N 0 0 385.811 3.133 20 5 GGBDRN COc1ccc2c(c1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)CC2 ZINC000180948850 1430130725 /nfs/dbraw/zinc/13/07/25/1430130725.db2.gz VPJKOAXDEMKGGJ-UHFFFAOYSA-N 0 0 378.331 3.403 20 5 GGBDRN CCOc1c(Cl)cc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])cc1OC ZINC000180952559 1430132126 /nfs/dbraw/zinc/13/21/26/1430132126.db2.gz QYLGTMOGNRGGRA-UHFFFAOYSA-N 0 0 379.800 3.168 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(F)c(N3CCCCC3)c(F)c2)c1[N+](=O)[O-] ZINC000180954318 1430133693 /nfs/dbraw/zinc/13/36/93/1430133693.db2.gz GZLBMMKTPDVSHP-UHFFFAOYSA-N 0 0 379.367 3.158 20 5 GGBDRN CC(C)CNC(=O)c1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1Cl ZINC000180956177 1430134822 /nfs/dbraw/zinc/13/48/22/1430134822.db2.gz SDEAMAWSUYSPAE-UHFFFAOYSA-N 0 0 390.827 3.469 20 5 GGBDRN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180961004 1430137398 /nfs/dbraw/zinc/13/73/98/1430137398.db2.gz RAUGCOPBWHARJK-UHFFFAOYSA-N 0 0 397.410 3.411 20 5 GGBDRN C[C@]1(c2ccc(F)cc2F)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000180964691 1430140082 /nfs/dbraw/zinc/14/00/82/1430140082.db2.gz FEOJYPBCXDOOBA-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN C[C@@H](CCO)N(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1 ZINC000180984819 1430152547 /nfs/dbraw/zinc/15/25/47/1430152547.db2.gz GMTJTMBRBDJFKJ-HNNXBMFYSA-N 0 0 382.420 3.418 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1N(C)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000180993085 1430156321 /nfs/dbraw/zinc/15/63/21/1430156321.db2.gz KETNZERMJNWDBP-CQSZACIVSA-N 0 0 385.342 3.193 20 5 GGBDRN CN1CCCN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2cc(F)ccc21 ZINC000181004322 1430162871 /nfs/dbraw/zinc/16/28/71/1430162871.db2.gz FUPKLNYBYLNGQB-UHFFFAOYSA-N 0 0 399.831 3.423 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cc(F)cc1[N+](=O)[O-] ZINC000181026836 1430174374 /nfs/dbraw/zinc/17/43/74/1430174374.db2.gz WBZARUIUXBQYCH-XJKSGUPXSA-N 0 0 397.765 3.369 20 5 GGBDRN CCOC(=O)c1nc(CC)oc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000181032069 1430176114 /nfs/dbraw/zinc/17/61/14/1430176114.db2.gz JUFFUNNLYDAVJU-UHFFFAOYSA-N 0 0 381.772 3.157 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000181036121 1430179810 /nfs/dbraw/zinc/17/98/10/1430179810.db2.gz DGFRVIQYPOUYSE-MAUKXSAKSA-N 0 0 393.802 3.446 20 5 GGBDRN COc1ccccc1SC[C@H](C)CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181043024 1430182803 /nfs/dbraw/zinc/18/28/03/1430182803.db2.gz LPOVFZHNFLOQDK-GFCCVEGCSA-N 0 0 375.450 3.344 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc2nncn2c1 ZINC000181049579 1430185684 /nfs/dbraw/zinc/18/56/84/1430185684.db2.gz OFZLHUBPTYKAHH-UHFFFAOYSA-N 0 0 394.313 3.097 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] ZINC000181112594 1430214999 /nfs/dbraw/zinc/21/49/99/1430214999.db2.gz SPIXFSWAOYKHBG-QAPCUYQASA-N 0 0 392.843 3.098 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000181130600 1430220272 /nfs/dbraw/zinc/22/02/72/1430220272.db2.gz ISHUMJNZAWDXRT-ZDUSSCGKSA-N 0 0 388.855 3.349 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCc2c(ncn2CCc2ccccc2)C1 ZINC000181136196 1430222275 /nfs/dbraw/zinc/22/22/75/1430222275.db2.gz ASGSZEFKPYZEIK-UHFFFAOYSA-N 0 0 376.416 3.233 20 5 GGBDRN Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000181137739 1430222856 /nfs/dbraw/zinc/22/28/56/1430222856.db2.gz DIKYRCAKTKLALD-QGZVFWFLSA-N 0 0 383.448 3.349 20 5 GGBDRN Cn1cnc(-c2ccc(C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)cc2)n1 ZINC000181150940 1430228473 /nfs/dbraw/zinc/22/84/73/1430228473.db2.gz HZXDXFNXKBKLDQ-UHFFFAOYSA-N 0 0 377.404 3.195 20 5 GGBDRN COc1ccc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])c(OC2CCCC2)c1 ZINC000181156933 1430230870 /nfs/dbraw/zinc/23/08/70/1430230870.db2.gz QSQVOUNGNWRUDY-UHFFFAOYSA-N 0 0 385.420 3.437 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccnn2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000181157980 1430231039 /nfs/dbraw/zinc/23/10/39/1430231039.db2.gz DEECPYWWVWFOMU-CQSZACIVSA-N 0 0 380.408 3.426 20 5 GGBDRN O=C(NC[C@H]1CC(=O)N(C2CC2)C1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000181189665 1430242839 /nfs/dbraw/zinc/24/28/39/1430242839.db2.gz FJVBLTTXYQSMLJ-CQSZACIVSA-N 0 0 395.415 3.128 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@H](Cc2ccccc2)C1 ZINC000181204888 1430247395 /nfs/dbraw/zinc/24/73/95/1430247395.db2.gz BNBUZHZSENPLBP-GOSISDBHSA-N 0 0 379.416 3.089 20 5 GGBDRN Cc1sc2ncc(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)c(=O)n2c1C ZINC000181206761 1430247605 /nfs/dbraw/zinc/24/76/05/1430247605.db2.gz XAUJUDWTEUEMEF-SNVBAGLBSA-N 0 0 386.433 3.080 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)c2c(N)cccc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000181237014 1430254026 /nfs/dbraw/zinc/25/40/26/1430254026.db2.gz XOBOHJRIRLWNLX-ZDUSSCGKSA-N 0 0 379.420 3.032 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)c2c(N)cccc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000181236998 1430254110 /nfs/dbraw/zinc/25/41/10/1430254110.db2.gz XOBOHJRIRLWNLX-CYBMUJFWSA-N 0 0 379.420 3.032 20 5 GGBDRN CN(CCC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1cccc([N+](=O)[O-])c1[O-] ZINC000181246082 1430255819 /nfs/dbraw/zinc/25/58/19/1430255819.db2.gz MWAKGPNMRNBGOE-UHFFFAOYSA-N 0 0 384.436 3.074 20 5 GGBDRN O=C(NCc1ccc(OCC2CC2)nc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181244984 1430255994 /nfs/dbraw/zinc/25/59/94/1430255994.db2.gz BZJIJOLTRCVRMM-UHFFFAOYSA-N 0 0 393.346 3.310 20 5 GGBDRN Cc1nc([C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)c2ccc(Cl)cc2)no1 ZINC000181285345 1430262665 /nfs/dbraw/zinc/26/26/65/1430262665.db2.gz JMTZDPQTOWUQSC-HNNXBMFYSA-N 0 0 387.783 3.041 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)S(=O)(=O)Cc1nnc(C2CC2)n1C1CC1 ZINC000181293854 1430264999 /nfs/dbraw/zinc/26/49/99/1430264999.db2.gz HQBUTOMQQFECTC-LBPRGKRZSA-N 0 0 390.465 3.383 20 5 GGBDRN O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1[nH]ncc1[N+](=O)[O-] ZINC000181323853 1430272688 /nfs/dbraw/zinc/27/26/88/1430272688.db2.gz AJVYGGMMHXFHBB-SNVBAGLBSA-N 0 0 382.220 3.370 20 5 GGBDRN O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1[nH]ncc1[N+](=O)[O-] ZINC000181323831 1430272810 /nfs/dbraw/zinc/27/28/10/1430272810.db2.gz AJVYGGMMHXFHBB-JTQLQIEISA-N 0 0 382.220 3.370 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)n1 ZINC000181329782 1430274153 /nfs/dbraw/zinc/27/41/53/1430274153.db2.gz YPABPOHSNOUHSW-UHFFFAOYSA-N 0 0 394.387 3.056 20 5 GGBDRN Cn1c(COC(=O)CSc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 ZINC000181344029 1430278475 /nfs/dbraw/zinc/27/84/75/1430278475.db2.gz MKAMLRWLICQSGV-UHFFFAOYSA-N 0 0 384.417 3.226 20 5 GGBDRN CC1([C@H]2CCCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)OCCO1 ZINC000181368657 1430283031 /nfs/dbraw/zinc/28/30/31/1430283031.db2.gz PYEGZEVDCKVALW-ZDUSSCGKSA-N 0 0 376.434 3.425 20 5 GGBDRN CC(C)(C)c1nc(CCNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cs1 ZINC000181372365 1430283843 /nfs/dbraw/zinc/28/38/43/1430283843.db2.gz WUJZKUKUXUPBJA-UHFFFAOYSA-N 0 0 377.422 3.050 20 5 GGBDRN Cc1ccc(-c2nc(CCNC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)co2)cc1 ZINC000181375086 1430284189 /nfs/dbraw/zinc/28/41/89/1430284189.db2.gz QTONAHVAXWTBRA-UHFFFAOYSA-N 0 0 395.371 3.259 20 5 GGBDRN O=C(c1ccccc1OC(F)(F)F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000181389523 1430287291 /nfs/dbraw/zinc/28/72/91/1430287291.db2.gz AHELIATVUULGLR-NSHDSACASA-N 0 0 396.325 3.215 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCn1cnnc1C(C)C ZINC000181407523 1430290405 /nfs/dbraw/zinc/29/04/05/1430290405.db2.gz YRZZPTPOLDOLLX-UHFFFAOYSA-N 0 0 377.470 3.240 20 5 GGBDRN CCCCOc1cccc(CNc2cc([N+](=O)[O-])ccc2S(N)(=O)=O)c1 ZINC000181412629 1430291622 /nfs/dbraw/zinc/29/16/22/1430291622.db2.gz LJAIPFNIAGSVQV-UHFFFAOYSA-N 0 0 379.438 3.033 20 5 GGBDRN COc1cc(OCC(=O)Nc2cn(-c3ccccc3)nc2C)ccc1[N+](=O)[O-] ZINC000181417090 1430293269 /nfs/dbraw/zinc/29/32/69/1430293269.db2.gz QTNUYTNIFKFWGM-UHFFFAOYSA-N 0 0 382.376 3.115 20 5 GGBDRN CC[C@@H](C)Oc1cc(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)ccn1 ZINC000181427941 1430296301 /nfs/dbraw/zinc/29/63/01/1430296301.db2.gz MTPKYBANFVRJRR-CQSZACIVSA-N 0 0 395.419 3.283 20 5 GGBDRN COC[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(F)c(F)c1 ZINC000181438025 1430299086 /nfs/dbraw/zinc/29/90/86/1430299086.db2.gz 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ZINC000182794244 1430541545 /nfs/dbraw/zinc/54/15/45/1430541545.db2.gz NGDWNSUGBPXXLR-LIRRHRJNSA-N 0 0 377.404 3.399 20 5 GGBDRN COc1cccc2c1CCN(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)C2 ZINC000182797521 1430541888 /nfs/dbraw/zinc/54/18/88/1430541888.db2.gz MYFQNMMBGUWOJB-UHFFFAOYSA-N 0 0 381.432 3.402 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(CN2CCOCC2)c(Cl)c1 ZINC000182800025 1430542254 /nfs/dbraw/zinc/54/22/54/1430542254.db2.gz VRTBGFHJRHEMKN-UHFFFAOYSA-N 0 0 389.839 3.262 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1 ZINC000182839300 1430551150 /nfs/dbraw/zinc/55/11/50/1430551150.db2.gz COZLEKZOTBHAOX-INIZCTEOSA-N 0 0 388.811 3.254 20 5 GGBDRN CC(C)(O)CN(Cc1ccccc1)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182841854 1430551940 /nfs/dbraw/zinc/55/19/40/1430551940.db2.gz OOLLNIIMHBDNBC-UHFFFAOYSA-N 0 0 394.431 3.194 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000182858872 1430555174 /nfs/dbraw/zinc/55/51/74/1430555174.db2.gz BVXHELJXFGAODU-MLGOLLRUSA-N 0 0 397.859 3.287 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCSc2ccc(F)cc2)C1=O ZINC000182860739 1430555581 /nfs/dbraw/zinc/55/55/81/1430555581.db2.gz JBSJBLBAWHSWSC-SFHVURJKSA-N 0 0 389.408 3.293 20 5 GGBDRN O=C(Nc1ccc(O)c(Cl)c1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000182862084 1430555751 /nfs/dbraw/zinc/55/57/51/1430555751.db2.gz SUZUTQNLPJIBHQ-LLVKDONJSA-N 0 0 395.824 3.259 20 5 GGBDRN O=C(Nc1ccc(F)c(F)c1F)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182878873 1430560531 /nfs/dbraw/zinc/56/05/31/1430560531.db2.gz OBYUECDCGWOCKH-UHFFFAOYSA-N 0 0 381.310 3.101 20 5 GGBDRN C[C@@H](CCc1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182878724 1430560599 /nfs/dbraw/zinc/56/05/99/1430560599.db2.gz CRSNXSYBYQTHHH-INIZCTEOSA-N 0 0 383.448 3.183 20 5 GGBDRN COc1ccc(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000182891677 1430563496 /nfs/dbraw/zinc/56/34/96/1430563496.db2.gz AKRAXZFALTVLHZ-LBPRGKRZSA-N 0 0 393.802 3.405 20 5 GGBDRN COc1cc(Cn2cnc(C3CCC3)cc2=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000182890665 1430563643 /nfs/dbraw/zinc/56/36/43/1430563643.db2.gz PJALBBNPTNFNDR-UHFFFAOYSA-N 0 0 395.362 3.120 20 5 GGBDRN O=C(Nc1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182898042 1430565664 /nfs/dbraw/zinc/56/56/64/1430565664.db2.gz WOPLLSOZKQYRTL-UHFFFAOYSA-N 0 0 393.346 3.285 20 5 GGBDRN C[C@H](C(=O)Nc1cccc(OCCn2cncn2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182898275 1430565828 /nfs/dbraw/zinc/56/58/28/1430565828.db2.gz PPARVBPPPARTJT-ZDUSSCGKSA-N 0 0 399.382 3.147 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccc(F)cc1F ZINC000182924727 1430573178 /nfs/dbraw/zinc/57/31/78/1430573178.db2.gz VPWFBOBAQWJMPR-LBPRGKRZSA-N 0 0 391.374 3.201 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000182927918 1430573866 /nfs/dbraw/zinc/57/38/66/1430573866.db2.gz HGSPMEOITCQMJA-ZDUSSCGKSA-N 0 0 377.803 3.325 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)c1nc[nH]n1 ZINC000182937509 1430576092 /nfs/dbraw/zinc/57/60/92/1430576092.db2.gz TVINYYXZZNXTKT-LLVKDONJSA-N 0 0 375.454 3.486 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)o1 ZINC000182965947 1430582337 /nfs/dbraw/zinc/58/23/37/1430582337.db2.gz VRAHOPVQXRPUMJ-CYBMUJFWSA-N 0 0 382.319 3.311 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000182980846 1430584980 /nfs/dbraw/zinc/58/49/80/1430584980.db2.gz AFXUQFBQQORGAD-UHFFFAOYSA-N 0 0 379.420 3.431 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1CN1CCOCC1)c1ccc([N+](=O)[O-])cc1F ZINC000182985045 1430585573 /nfs/dbraw/zinc/58/55/73/1430585573.db2.gz DZHOUQCJNJBGGC-CQSZACIVSA-N 0 0 387.411 3.308 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1cc(Cl)cc2c1OCC2 ZINC000182991891 1430587075 /nfs/dbraw/zinc/58/70/75/1430587075.db2.gz HJANMCIFBRSRLB-UHFFFAOYSA-N 0 0 391.811 3.191 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N[C@H]1CCCOCC1 ZINC000182993684 1430587948 /nfs/dbraw/zinc/58/79/48/1430587948.db2.gz BSXIPVSJVWDVCX-AWEZNQCLSA-N 0 0 391.449 3.377 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000182995173 1430588257 /nfs/dbraw/zinc/58/82/57/1430588257.db2.gz STCZZEVCPHLBLF-MEDUHNTESA-N 0 0 388.811 3.191 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1Cl ZINC000183000576 1430589251 /nfs/dbraw/zinc/58/92/51/1430589251.db2.gz UHIPZWOVMMFPTL-VIFPVBQESA-N 0 0 379.775 3.489 20 5 GGBDRN Cc1c(NC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000183020004 1430593875 /nfs/dbraw/zinc/59/38/75/1430593875.db2.gz XNEXDEMBLSEEMU-MRXNPFEDSA-N 0 0 388.811 3.262 20 5 GGBDRN O=C(NC[C@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183024917 1430595325 /nfs/dbraw/zinc/59/53/25/1430595325.db2.gz NJOZUTWJEWXLCB-QGZVFWFLSA-N 0 0 395.459 3.281 20 5 GGBDRN Cc1ncc(-c2ccc(NC(=O)CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)cc2)o1 ZINC000183024307 1430595367 /nfs/dbraw/zinc/59/53/67/1430595367.db2.gz KGIAZMZULAARAY-UHFFFAOYSA-N 0 0 394.387 3.235 20 5 GGBDRN O=C(N[C@H]1CCCC[C@@H]1n1cccn1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183062909 1430602843 /nfs/dbraw/zinc/60/28/43/1430602843.db2.gz OUWVWOXIVODRTC-KBPBESRZSA-N 0 0 380.351 3.306 20 5 GGBDRN CCN(C(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1)c1cc(C)cc(C)c1 ZINC000183071606 1430605754 /nfs/dbraw/zinc/60/57/54/1430605754.db2.gz WOAOWBPJYONWNZ-UHFFFAOYSA-N 0 0 385.420 3.003 20 5 GGBDRN CC[C@@H](C)Oc1cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccn1 ZINC000183074417 1430606235 /nfs/dbraw/zinc/60/62/35/1430606235.db2.gz KXCXQJGYIZHTAE-OAHLLOKOSA-N 0 0 384.436 3.130 20 5 GGBDRN Cc1cc([C@@H](C)NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)s1 ZINC000183074616 1430606427 /nfs/dbraw/zinc/60/64/27/1430606427.db2.gz SHXRKSCWPVZACN-GFCCVEGCSA-N 0 0 375.450 3.189 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000183079853 1430608258 /nfs/dbraw/zinc/60/82/58/1430608258.db2.gz DENOJUUSOVETNW-GXFFZTMASA-N 0 0 389.374 3.196 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cn(-c2cccc(Cl)c2F)nn1 ZINC000183093847 1430611197 /nfs/dbraw/zinc/61/11/97/1430611197.db2.gz YQWIMCHKYGPZIT-UHFFFAOYSA-N 0 0 389.774 3.240 20 5 GGBDRN O=C(NC[C@H]1COC2(CCOCC2)O1)c1cc2ccccc2c2cccnc12 ZINC000183095877 1430611288 /nfs/dbraw/zinc/61/12/88/1430611288.db2.gz JUXOUNMGSCIYKD-INIZCTEOSA-N 0 0 378.428 3.040 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)n1 ZINC000183142099 1430626894 /nfs/dbraw/zinc/62/68/94/1430626894.db2.gz GOFVERTYOXLFRI-HNNXBMFYSA-N 0 0 379.413 3.272 20 5 GGBDRN CCOc1cccc(NCCCS(=O)(=O)Cc2ccccc2)c1[N+](=O)[O-] ZINC000183143219 1430627749 /nfs/dbraw/zinc/62/77/49/1430627749.db2.gz QYJZJKSNCKPLNI-UHFFFAOYSA-N 0 0 378.450 3.411 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ncc(-c3ccccc3)s2)ccc1[N+](=O)[O-] ZINC000183162226 1430634508 /nfs/dbraw/zinc/63/45/08/1430634508.db2.gz KTHYDUPHLFWGMY-UHFFFAOYSA-N 0 0 396.428 3.395 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ncc(Cl)cc2Cl)C1=O ZINC000183164024 1430635337 /nfs/dbraw/zinc/63/53/37/1430635337.db2.gz ZTNQERRXYVGGCL-MRXNPFEDSA-N 0 0 395.202 3.264 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1C ZINC000183171877 1430638432 /nfs/dbraw/zinc/63/84/32/1430638432.db2.gz KSJPDZHZHPAZEI-VWYCJHECSA-N 0 0 385.367 3.076 20 5 GGBDRN O=C(Nc1ccc(-c2cnco2)cc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183175496 1430639391 /nfs/dbraw/zinc/63/93/91/1430639391.db2.gz SGIPVZOAGXTESS-UHFFFAOYSA-N 0 0 394.387 3.339 20 5 GGBDRN COCc1nnc(-c2cccc(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)c2)o1 ZINC000183175961 1430639569 /nfs/dbraw/zinc/63/95/69/1430639569.db2.gz KIFACAUUOQLGQH-LBPRGKRZSA-N 0 0 382.376 3.282 20 5 GGBDRN C[C@@H](NC(=O)c1cn(-c2cccc(Cl)c2F)nn1)c1cccc([N+](=O)[O-])c1 ZINC000183175896 1430639597 /nfs/dbraw/zinc/63/95/97/1430639597.db2.gz AMROBVODKPKDNA-SNVBAGLBSA-N 0 0 389.774 3.459 20 5 GGBDRN CCOc1cc(C)ccc1NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183181426 1430640985 /nfs/dbraw/zinc/64/09/85/1430640985.db2.gz KNUWYRZCLNVYOU-UHFFFAOYSA-N 0 0 385.420 3.391 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1cc(Cl)cc2c1OCC2 ZINC000183180523 1430641191 /nfs/dbraw/zinc/64/11/91/1430641191.db2.gz BJBAJLMUXPCHQH-UHFFFAOYSA-N 0 0 375.812 3.225 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC[C@@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000183188514 1430642559 /nfs/dbraw/zinc/64/25/59/1430642559.db2.gz PYZGOMWVQNCFBW-GOSISDBHSA-N 0 0 385.395 3.136 20 5 GGBDRN C[C@@H]1CCCN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccccc21 ZINC000183191564 1430643723 /nfs/dbraw/zinc/64/37/23/1430643723.db2.gz OWTNISQZWDMZDR-CYBMUJFWSA-N 0 0 381.388 3.433 20 5 GGBDRN O=C(Nc1cccnc1OCC(F)F)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183219212 1430651030 /nfs/dbraw/zinc/65/10/30/1430651030.db2.gz HLQPHTHUPBXRJL-UHFFFAOYSA-N 0 0 389.261 3.487 20 5 GGBDRN C[C@H](C(=O)Nc1cccc(CN2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183222756 1430651674 /nfs/dbraw/zinc/65/16/74/1430651674.db2.gz OBXSSAAKWCCXJT-AWEZNQCLSA-N 0 0 387.411 3.308 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183236824 1430655744 /nfs/dbraw/zinc/65/57/44/1430655744.db2.gz NJIWTCANBQVKOW-GOSISDBHSA-N 0 0 388.445 3.162 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H]2CCc3c2cccc3Cl)ccc1[N+](=O)[O-] ZINC000183239436 1430657147 /nfs/dbraw/zinc/65/71/47/1430657147.db2.gz XGCUEFDRTSKNOB-MRXNPFEDSA-N 0 0 387.823 3.090 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1CN1C(=O)CCC1=O)c1ccc([N+](=O)[O-])cc1F ZINC000183244298 1430658356 /nfs/dbraw/zinc/65/83/56/1430658356.db2.gz IRACSPPBBOQNAW-GFCCVEGCSA-N 0 0 399.378 3.125 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccs1 ZINC000183248392 1430659152 /nfs/dbraw/zinc/65/91/52/1430659152.db2.gz HNYDHEZOQPZVPF-NSHDSACASA-N 0 0 398.437 3.222 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000183249533 1430659708 /nfs/dbraw/zinc/65/97/08/1430659708.db2.gz LJOMNBSCVMDXRO-ZDUSSCGKSA-N 0 0 394.474 3.391 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000183254066 1430660740 /nfs/dbraw/zinc/66/07/40/1430660740.db2.gz GXEDDTIRRZAWNB-MRXNPFEDSA-N 0 0 392.408 3.160 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1 ZINC000183255600 1430661198 /nfs/dbraw/zinc/66/11/98/1430661198.db2.gz AMCIGTXMDXRIMH-UHFFFAOYSA-N 0 0 381.417 3.437 20 5 GGBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)Cc1ncc(Cl)n1C ZINC000183280735 1430668558 /nfs/dbraw/zinc/66/85/58/1430668558.db2.gz FPSAZASHEAMDOI-SNVBAGLBSA-N 0 0 376.804 3.225 20 5 GGBDRN C[C@H](C(=O)N1CCN(c2ccc(Cl)cn2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000183291666 1430670802 /nfs/dbraw/zinc/67/08/02/1430670802.db2.gz LUSHLIPXTGKTTD-LBPRGKRZSA-N 0 0 392.818 3.235 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C2CC2)[C@@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000183302414 1430673804 /nfs/dbraw/zinc/67/38/04/1430673804.db2.gz QZODIUFHQTWZRB-HXUWFJFHSA-N 0 0 393.443 3.312 20 5 GGBDRN CCc1cc(=O)c2cc(NC(=O)CN(C)c3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000183313077 1430675647 /nfs/dbraw/zinc/67/56/47/1430675647.db2.gz XECAYVOEMFOODJ-UHFFFAOYSA-N 0 0 380.404 3.074 20 5 GGBDRN Cc1nc(CN(C)C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)no1 ZINC000183336498 1430682508 /nfs/dbraw/zinc/68/25/08/1430682508.db2.gz QZOJWVFXSSOBPI-STQMWFEESA-N 0 0 387.440 3.041 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)cc1[N+](=O)[O-] ZINC000183340134 1430682854 /nfs/dbraw/zinc/68/28/54/1430682854.db2.gz HDVBIXNHSLPCBC-UHFFFAOYSA-N 0 0 393.403 3.003 20 5 GGBDRN CN(C[C@@H]1CCCC[C@H]1O)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000183359168 1430688530 /nfs/dbraw/zinc/68/85/30/1430688530.db2.gz GTKZCTQFMADBEX-HRAATJIYSA-N 0 0 378.472 3.164 20 5 GGBDRN COc1ccccc1C1(CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)CCC1 ZINC000183367367 1430691583 /nfs/dbraw/zinc/69/15/83/1430691583.db2.gz MFDMKWOPHMCQKG-UHFFFAOYSA-N 0 0 397.431 3.088 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CCO1 ZINC000183368254 1430691989 /nfs/dbraw/zinc/69/19/89/1430691989.db2.gz BLWPALQVONUSAW-BEFAXECRSA-N 0 0 386.452 3.494 20 5 GGBDRN Cc1noc(-c2ccccc2)c1NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000183382960 1430696684 /nfs/dbraw/zinc/69/66/84/1430696684.db2.gz ZOBQVTJOSVRPDH-CYBMUJFWSA-N 0 0 394.387 3.315 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1c(-c2ccco2)nc2ccccn21 ZINC000183384890 1430697244 /nfs/dbraw/zinc/69/72/44/1430697244.db2.gz LFTCNSPOZMQVIO-UHFFFAOYSA-N 0 0 398.400 3.444 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2scnc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000183395039 1430700292 /nfs/dbraw/zinc/70/02/92/1430700292.db2.gz SEGDLOUCJKWPNL-UHFFFAOYSA-N 0 0 396.428 3.395 20 5 GGBDRN O=C(N[C@H]1CCCOc2ccccc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183414512 1430705616 /nfs/dbraw/zinc/70/56/16/1430705616.db2.gz RMIHSFPZTKCMLJ-KRWDZBQOSA-N 0 0 397.431 3.075 20 5 GGBDRN COc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)c2ccc(F)cc2)cc1 ZINC000183452194 1430715115 /nfs/dbraw/zinc/71/51/15/1430715115.db2.gz SETQTPNOJRFQAY-SFHVURJKSA-N 0 0 396.378 3.239 20 5 GGBDRN COc1ccc([C@@H](C)N(C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000183459595 1430717266 /nfs/dbraw/zinc/71/72/66/1430717266.db2.gz BWGAFQRIVQMVGF-CQSZACIVSA-N 0 0 378.450 3.169 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000183472150 1430720008 /nfs/dbraw/zinc/72/00/08/1430720008.db2.gz DSMNLHOMSVVLJC-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN O=C(Nc1cc(F)ccc1Cl)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183481632 1430723365 /nfs/dbraw/zinc/72/33/65/1430723365.db2.gz QCIFAKGWXCJTFW-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN CN(C)c1ccc(COC(=O)CCc2nnc(C3CCCC3)o2)cc1[N+](=O)[O-] ZINC000183489556 1430725655 /nfs/dbraw/zinc/72/56/55/1430725655.db2.gz MSCZUXGGAKJNKZ-UHFFFAOYSA-N 0 0 388.424 3.377 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000183509766 1430731284 /nfs/dbraw/zinc/73/12/84/1430731284.db2.gz LTIIHSZXXOBWDZ-UHFFFAOYSA-N 0 0 394.431 3.483 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000183524065 1430734608 /nfs/dbraw/zinc/73/46/08/1430734608.db2.gz AIDPRNHLUGARTM-SFHVURJKSA-N 0 0 378.425 3.443 20 5 GGBDRN C[C@@H](C(=O)Nc1ccn(CCc2ccncc2)n1)c1ccc([N+](=O)[O-])cc1F ZINC000183527188 1430734915 /nfs/dbraw/zinc/73/49/15/1430734915.db2.gz JTJSXMSLJYDOCB-CYBMUJFWSA-N 0 0 383.383 3.310 20 5 GGBDRN C[C@H](C(=O)Nc1ccn(CCc2ccncc2)n1)c1ccc([N+](=O)[O-])cc1F ZINC000183527170 1430735125 /nfs/dbraw/zinc/73/51/25/1430735125.db2.gz JTJSXMSLJYDOCB-ZDUSSCGKSA-N 0 0 383.383 3.310 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N[C@@H](c2nc(C)cs2)C2CC2)c([N+](=O)[O-])c1 ZINC000183535732 1430737125 /nfs/dbraw/zinc/73/71/25/1430737125.db2.gz WYIBJICOJORBKQ-BDJLRTHQSA-N 0 0 390.465 3.436 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N[C@@H](c2nc(C)cs2)C2CC2)c([N+](=O)[O-])c1 ZINC000183535699 1430737197 /nfs/dbraw/zinc/73/71/97/1430737197.db2.gz WYIBJICOJORBKQ-MEDUHNTESA-N 0 0 390.465 3.436 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183549882 1430740626 /nfs/dbraw/zinc/74/06/26/1430740626.db2.gz UBJTVSUWORQEPW-UHFFFAOYSA-N 0 0 380.408 3.476 20 5 GGBDRN CCc1ccc([C@@H](CN2CCOCC2)NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000183554843 1430741379 /nfs/dbraw/zinc/74/13/79/1430741379.db2.gz CPIGBMOZCZVGRY-OAQYLSRUSA-N 0 0 399.491 3.329 20 5 GGBDRN COc1ccc([C@@H](CCO)NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000183570654 1430743870 /nfs/dbraw/zinc/74/38/70/1430743870.db2.gz AXGOZACVUWZKJZ-KPZWWZAWSA-N 0 0 376.384 3.086 20 5 GGBDRN O=C(Nc1ccc(OCC2CC2)cc1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183574066 1430744469 /nfs/dbraw/zinc/74/44/69/1430744469.db2.gz QVUOCJKCNWCTJC-UHFFFAOYSA-N 0 0 397.431 3.473 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000183574297 1430744808 /nfs/dbraw/zinc/74/48/08/1430744808.db2.gz WHOOFYQJLQTOPD-SNVBAGLBSA-N 0 0 379.779 3.183 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)Nc2ccncc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000183586580 1430748063 /nfs/dbraw/zinc/74/80/63/1430748063.db2.gz JNPBMGPVJVSODS-ZDUSSCGKSA-N 0 0 380.408 3.237 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)CN2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000183625071 1430757484 /nfs/dbraw/zinc/75/74/84/1430757484.db2.gz BLFFORJRBQCVOF-AWEZNQCLSA-N 0 0 399.447 3.242 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)CN2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000183625400 1430757494 /nfs/dbraw/zinc/75/74/94/1430757494.db2.gz VRRJAKOECRZJPD-UHFFFAOYSA-N 0 0 396.447 3.078 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000183638285 1430760483 /nfs/dbraw/zinc/76/04/83/1430760483.db2.gz WWBVZFQHOXCFDI-UHFFFAOYSA-N 0 0 384.318 3.074 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCCCC[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000183643790 1430761722 /nfs/dbraw/zinc/76/17/22/1430761722.db2.gz PAXIJLBDHRRBGJ-KRWDZBQOSA-N 0 0 385.420 3.370 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000183643950 1430761738 /nfs/dbraw/zinc/76/17/38/1430761738.db2.gz QLDBPYUCVMILRL-YOEHRIQHSA-N 0 0 399.422 3.177 20 5 GGBDRN O=C(NCCc1nc(-c2ccc(Cl)cc2)no1)Nc1ccncc1[N+](=O)[O-] ZINC000183642845 1430761981 /nfs/dbraw/zinc/76/19/81/1430761981.db2.gz MZNQGGCUCKTQBE-UHFFFAOYSA-N 0 0 388.771 3.057 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NC(C)(C)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000183644856 1430762232 /nfs/dbraw/zinc/76/22/32/1430762232.db2.gz CJULXBCKUXUPHW-UHFFFAOYSA-N 0 0 389.839 3.338 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000183644944 1430762556 /nfs/dbraw/zinc/76/25/56/1430762556.db2.gz BMWVODYINGPVRF-SJLPKXTDSA-N 0 0 395.459 3.346 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NCC2(Sc3ccccc3)CC2)cc1 ZINC000183657593 1430765510 /nfs/dbraw/zinc/76/55/10/1430765510.db2.gz WDMXXBFFCFOJLA-UHFFFAOYSA-N 0 0 392.502 3.382 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCSC[C@H]2c2ccccc2)cc1 ZINC000183664947 1430766702 /nfs/dbraw/zinc/76/67/02/1430766702.db2.gz DIPDSULSOOOJSJ-SFHVURJKSA-N 0 0 392.502 3.257 20 5 GGBDRN Cc1cccnc1[C@@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000183664403 1430766715 /nfs/dbraw/zinc/76/67/15/1430766715.db2.gz GEKORAZGYBNPEJ-KRWDZBQOSA-N 0 0 377.466 3.157 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)cc1 ZINC000183672191 1430768603 /nfs/dbraw/zinc/76/86/03/1430768603.db2.gz YTMFSFKXTAQFSF-QGZVFWFLSA-N 0 0 392.452 3.171 20 5 GGBDRN Cn1cnc(-c2cccc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)c2)n1 ZINC000183678742 1430770473 /nfs/dbraw/zinc/77/04/73/1430770473.db2.gz OPXFVMNJBQMFNB-UHFFFAOYSA-N 0 0 378.392 3.217 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC[C@H](c3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000183684635 1430772169 /nfs/dbraw/zinc/77/21/69/1430772169.db2.gz HKMFPSINOKTPOD-APWZRJJASA-N 0 0 395.459 3.285 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC[C@@H](c3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000183684704 1430772239 /nfs/dbraw/zinc/77/22/39/1430772239.db2.gz HKMFPSINOKTPOD-QFBILLFUSA-N 0 0 395.459 3.285 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000183693580 1430774634 /nfs/dbraw/zinc/77/46/34/1430774634.db2.gz QMBRBHGIGAOKAH-QGZVFWFLSA-N 0 0 383.379 3.438 20 5 GGBDRN Cc1cc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c2cccnc2c1C ZINC000183699936 1430776326 /nfs/dbraw/zinc/77/63/26/1430776326.db2.gz GODMWZRIXIMCNT-UHFFFAOYSA-N 0 0 392.415 3.437 20 5 GGBDRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@H](O)Cc1ccccc1 ZINC000183700695 1430776666 /nfs/dbraw/zinc/77/66/66/1430776666.db2.gz RMHNQBSLQGHQQI-MLGOLLRUSA-N 0 0 394.880 3.449 20 5 GGBDRN CCCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1C[C@H](OCC)C12CCCC2 ZINC000183704431 1430777404 /nfs/dbraw/zinc/77/74/04/1430777404.db2.gz HYTGEQOMTQDIRK-HOTGVXAUSA-N 0 0 376.457 3.162 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183703540 1430777556 /nfs/dbraw/zinc/77/75/56/1430777556.db2.gz OAZSSKFIXCVTQG-JTQLQIEISA-N 0 0 383.433 3.495 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000183706409 1430777970 /nfs/dbraw/zinc/77/79/70/1430777970.db2.gz GPYIVXVYLWEVBS-SFHVURJKSA-N 0 0 396.378 3.213 20 5 GGBDRN Cn1cnc(-c2cccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)c2)n1 ZINC000183711449 1430778886 /nfs/dbraw/zinc/77/88/86/1430778886.db2.gz CTAUHLUYXYRONV-UHFFFAOYSA-N 0 0 392.419 3.243 20 5 GGBDRN CC[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000183719853 1430780335 /nfs/dbraw/zinc/78/03/35/1430780335.db2.gz RQDHIWGPODBDBF-KRWDZBQOSA-N 0 0 384.404 3.486 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cc(=O)[nH]c2cc(F)ccc21 ZINC000183741469 1430784707 /nfs/dbraw/zinc/78/47/07/1430784707.db2.gz ZZNXRUVRFGGVJS-UHFFFAOYSA-N 0 0 375.743 3.159 20 5 GGBDRN CCc1[nH]c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(C)c1C(=O)OC ZINC000183741877 1430785107 /nfs/dbraw/zinc/78/51/07/1430785107.db2.gz PUKVFSFKRPLHCH-UHFFFAOYSA-N 0 0 379.800 3.164 20 5 GGBDRN CCCNC(=O)c1cccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000183744906 1430785438 /nfs/dbraw/zinc/78/54/38/1430785438.db2.gz LUBMEEFDEZVFII-UHFFFAOYSA-N 0 0 375.812 3.318 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)Cc2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000183749200 1430786419 /nfs/dbraw/zinc/78/64/19/1430786419.db2.gz SAHBQWHAFSTNQH-UHFFFAOYSA-N 0 0 381.388 3.038 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCc3c2cccc3F)ccc1[N+](=O)[O-] ZINC000183773222 1430791032 /nfs/dbraw/zinc/79/10/32/1430791032.db2.gz FMAXTKJJQQSMCG-LJQANCHMSA-N 0 0 397.406 3.236 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN([C@H](C)c2ccsc2)CC1 ZINC000183839992 1430803545 /nfs/dbraw/zinc/80/35/45/1430803545.db2.gz BQTOUSIVEWUFFL-CQSZACIVSA-N 0 0 395.506 3.032 20 5 GGBDRN Cc1cc(F)cc2c(O)c(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)cnc12 ZINC000183851109 1430804845 /nfs/dbraw/zinc/80/48/45/1430804845.db2.gz RNPSKHXPIAKHKK-UHFFFAOYSA-N 0 0 389.770 3.467 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000183876632 1430807828 /nfs/dbraw/zinc/80/78/28/1430807828.db2.gz FSJBENCESDEYOC-QAPCUYQASA-N 0 0 381.432 3.038 20 5 GGBDRN O=C(Nc1ccnn1-c1cccc(F)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000183895611 1430810026 /nfs/dbraw/zinc/81/00/26/1430810026.db2.gz IBYFTYDPRMNAFO-UHFFFAOYSA-N 0 0 392.350 3.358 20 5 GGBDRN CCC[C@@H]1CCCCN1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000183897943 1430810344 /nfs/dbraw/zinc/81/03/44/1430810344.db2.gz MTUTZXJPZVQEPL-CQSZACIVSA-N 0 0 375.425 3.464 20 5 GGBDRN CCC[C@H]1CCCCN1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000183897964 1430810402 /nfs/dbraw/zinc/81/04/02/1430810402.db2.gz MTUTZXJPZVQEPL-AWEZNQCLSA-N 0 0 375.425 3.464 20 5 GGBDRN COc1cc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)ccc1OC(C)C ZINC000183904236 1430811205 /nfs/dbraw/zinc/81/12/05/1430811205.db2.gz CXARTPPYOIQYPL-UHFFFAOYSA-N 0 0 376.413 3.233 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000183923946 1430813854 /nfs/dbraw/zinc/81/38/54/1430813854.db2.gz VFPUIGDQQCTSOV-UHFFFAOYSA-N 0 0 389.496 3.333 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC[C@H]2[C@@H]2CCCCC2=O)c1C ZINC000183957439 1430818501 /nfs/dbraw/zinc/81/85/01/1430818501.db2.gz QLFHTTISHRLXAM-GJZGRUSLSA-N 0 0 380.466 3.124 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@H]1[C@@H]1CCCCC1=O ZINC000183959795 1430818758 /nfs/dbraw/zinc/81/87/58/1430818758.db2.gz BDXDRSBRXNURAW-HOTGVXAUSA-N 0 0 380.466 3.124 20 5 GGBDRN CC(C)Oc1ccc2ccccc2c1CNC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000183987226 1430823975 /nfs/dbraw/zinc/82/39/75/1430823975.db2.gz IQAPQVSHXZEQGG-UHFFFAOYSA-N 0 0 397.435 3.231 20 5 GGBDRN C[C@@]1(Cc2ccccc2)CCCN1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000183992505 1430825221 /nfs/dbraw/zinc/82/52/21/1430825221.db2.gz WSAJSRPHRPDGHV-NRFANRHFSA-N 0 0 395.415 3.127 20 5 GGBDRN COc1cc(CNc2ccc(S(=O)(=O)NC(C)C)cc2)c([N+](=O)[O-])cc1F ZINC000184001715 1430826972 /nfs/dbraw/zinc/82/69/72/1430826972.db2.gz FPPBGGQWOQTOKJ-UHFFFAOYSA-N 0 0 397.428 3.041 20 5 GGBDRN C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000184009771 1430828283 /nfs/dbraw/zinc/82/82/83/1430828283.db2.gz YSPGLBXHZNLPBM-NRFANRHFSA-N 0 0 391.431 3.413 20 5 GGBDRN C[C@@H]1CC[C@@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000184011104 1430828420 /nfs/dbraw/zinc/82/84/20/1430828420.db2.gz SENDTKNQQQBKAS-HZSPNIEDSA-N 0 0 375.425 3.224 20 5 GGBDRN COc1cc(CNc2cccc(CS(C)(=O)=O)c2C)c([N+](=O)[O-])cc1F ZINC000184013678 1430828841 /nfs/dbraw/zinc/82/88/41/1430828841.db2.gz BHNIDIQRJFXRNP-UHFFFAOYSA-N 0 0 382.413 3.208 20 5 GGBDRN C[C@@H](C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184016649 1430829176 /nfs/dbraw/zinc/82/91/76/1430829176.db2.gz MVBUSDDAERVLFF-AUUYWEPGSA-N 0 0 399.422 3.491 20 5 GGBDRN COc1cc(CNc2ccc(CS(C)(=O)=O)c(F)c2)c([N+](=O)[O-])cc1F ZINC000184018593 1430829734 /nfs/dbraw/zinc/82/97/34/1430829734.db2.gz LBGBAEDNRWYLFJ-UHFFFAOYSA-N 0 0 386.376 3.038 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000184024144 1430830792 /nfs/dbraw/zinc/83/07/92/1430830792.db2.gz SBHLCNBMPFGUQU-ZDUSSCGKSA-N 0 0 390.342 3.080 20 5 GGBDRN CCOC(=O)c1cc(N2CCN(c3nccc(C(C)C)n3)CC2)ccc1[N+](=O)[O-] ZINC000184037645 1430832458 /nfs/dbraw/zinc/83/24/58/1430832458.db2.gz DIZQAJXJLTWSGG-UHFFFAOYSA-N 0 0 399.451 3.012 20 5 GGBDRN COCCn1c2ccccc2nc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000184052194 1430834746 /nfs/dbraw/zinc/83/47/46/1430834746.db2.gz KCCVDRFGWHYVAM-UHFFFAOYSA-N 0 0 386.433 3.322 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cccc3ccc(O)cc32)ccc1[N+](=O)[O-] ZINC000184056638 1430835460 /nfs/dbraw/zinc/83/54/60/1430835460.db2.gz UJQCKASWLBKYSQ-UHFFFAOYSA-N 0 0 379.372 3.131 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCOC[C@@H]1[C@@H]1CCCCC1=O ZINC000184059400 1430835818 /nfs/dbraw/zinc/83/58/18/1430835818.db2.gz VZAAMEUTHPGPDK-LSDHHAIUSA-N 0 0 388.445 3.410 20 5 GGBDRN CCOc1ccccc1C(=O)N1CCN(c2cccc(OCC)c2[N+](=O)[O-])CC1 ZINC000184062528 1430836365 /nfs/dbraw/zinc/83/63/65/1430836365.db2.gz YPRXFSXFXNAHMI-UHFFFAOYSA-N 0 0 399.447 3.355 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1I)N1CCCC2(CC2)C1 ZINC000184095131 1430840383 /nfs/dbraw/zinc/84/03/83/1430840383.db2.gz GQLONSZVDYVKDP-UHFFFAOYSA-N 0 0 386.189 3.216 20 5 GGBDRN CCOc1cc(C(=O)NC[C@@H](C)c2ncc(C)s2)c([N+](=O)[O-])cc1OC ZINC000184102485 1430841406 /nfs/dbraw/zinc/84/14/06/1430841406.db2.gz KLXZCWMKYIFFCC-SNVBAGLBSA-N 0 0 379.438 3.301 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000184103898 1430841682 /nfs/dbraw/zinc/84/16/82/1430841682.db2.gz DLIMGGJLNKFFLU-CABCVRRESA-N 0 0 377.441 3.419 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000184103869 1430841747 /nfs/dbraw/zinc/84/17/47/1430841747.db2.gz DLIMGGJLNKFFLU-GJZGRUSLSA-N 0 0 377.441 3.419 20 5 GGBDRN COc1cccc(OCCCNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000184105050 1430841970 /nfs/dbraw/zinc/84/19/70/1430841970.db2.gz IBEAMQYQGLCAGW-CYBMUJFWSA-N 0 0 376.384 3.431 20 5 GGBDRN COC(=O)c1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000184118283 1430843757 /nfs/dbraw/zinc/84/37/57/1430843757.db2.gz QPUMGLHJRLOSLM-UHFFFAOYSA-N 0 0 377.784 3.034 20 5 GGBDRN COc1ccccc1[C@H](CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])OC(C)C ZINC000184122497 1430844158 /nfs/dbraw/zinc/84/41/58/1430844158.db2.gz SBJROFIVZCZASM-IBGZPJMESA-N 0 0 398.419 3.418 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC(C)(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000184125604 1430844746 /nfs/dbraw/zinc/84/47/46/1430844746.db2.gz OHEZGGZMIJWZSS-UHFFFAOYSA-N 0 0 395.459 3.213 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000184133601 1430845774 /nfs/dbraw/zinc/84/57/74/1430845774.db2.gz KMEJUJKWZHCEQP-UHFFFAOYSA-N 0 0 385.449 3.332 20 5 GGBDRN COc1ccc(CN(C(=O)c2csc([N+](=O)[O-])c2)[C@H](CO)C(C)C)cc1 ZINC000184133941 1430845785 /nfs/dbraw/zinc/84/57/85/1430845785.db2.gz XGZFGRDZHDWNLW-MRXNPFEDSA-N 0 0 378.450 3.324 20 5 GGBDRN COc1ccc(CN(C(=O)c2ccc([N+](=O)[O-])s2)[C@H](CO)C(C)C)cc1 ZINC000184135338 1430845986 /nfs/dbraw/zinc/84/59/86/1430845986.db2.gz MCDWSNLQTPPZDD-OAHLLOKOSA-N 0 0 378.450 3.324 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCCCC[C@H]1c1ncon1 ZINC000184141772 1430846594 /nfs/dbraw/zinc/84/65/94/1430846594.db2.gz XIQLTTVYDMVGFA-INIZCTEOSA-N 0 0 385.424 3.336 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H]2c3ccccc3CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000184147870 1430847387 /nfs/dbraw/zinc/84/73/87/1430847387.db2.gz GMQUHCAXVMYNIJ-RNODOKPDSA-N 0 0 381.432 3.073 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](COCC(C)C)c1ccco1 ZINC000184161314 1430849154 /nfs/dbraw/zinc/84/91/54/1430849154.db2.gz JJGMVTDTIDSEBI-KRWDZBQOSA-N 0 0 375.425 3.438 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000184183192 1430852345 /nfs/dbraw/zinc/85/23/45/1430852345.db2.gz PSKUHEMGUQYHNI-LBPRGKRZSA-N 0 0 394.884 3.153 20 5 GGBDRN CC(C)COC[C@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000184187571 1430853341 /nfs/dbraw/zinc/85/33/41/1430853341.db2.gz LVLAYICAXCHCOP-KRWDZBQOSA-N 0 0 387.436 3.080 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000184187674 1430853456 /nfs/dbraw/zinc/85/34/56/1430853456.db2.gz CGEIBIZLVSKIIY-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN CC(C)NC(=O)c1ccc(N2CCC[C@H](CC(=O)OC(C)C)C2)c([N+](=O)[O-])c1 ZINC000184196295 1430854536 /nfs/dbraw/zinc/85/45/36/1430854536.db2.gz CKYRJYIHCBZHPY-OAHLLOKOSA-N 0 0 391.468 3.291 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000184194711 1430854582 /nfs/dbraw/zinc/85/45/82/1430854582.db2.gz YOLCRRJAUUQGET-AWEZNQCLSA-N 0 0 389.452 3.045 20 5 GGBDRN CC(C)COC[C@@H](N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccco1 ZINC000184207969 1430856752 /nfs/dbraw/zinc/85/67/52/1430856752.db2.gz VJJXPAHIYGWLHA-ZWKOTPCHSA-N 0 0 387.436 3.297 20 5 GGBDRN COc1cc(CN2CCn3c(nnc3-c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000184227600 1430859340 /nfs/dbraw/zinc/85/93/40/1430859340.db2.gz VSQJVMRDURSKQQ-UHFFFAOYSA-N 0 0 383.383 3.017 20 5 GGBDRN CCN(CC(=O)Nc1ccccc1OC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184227869 1430859401 /nfs/dbraw/zinc/85/94/01/1430859401.db2.gz PTIKDDCQVSWXHW-UHFFFAOYSA-N 0 0 391.399 3.212 20 5 GGBDRN CCN(C[C@H]1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1)CC(F)(F)F ZINC000184229490 1430859434 /nfs/dbraw/zinc/85/94/34/1430859434.db2.gz ZBQGMDGGUIMNBY-GFCCVEGCSA-N 0 0 393.381 3.449 20 5 GGBDRN COc1cc(CN(C)CC(=O)Nc2cccc(Cl)c2)c([N+](=O)[O-])cc1F ZINC000184231784 1430859869 /nfs/dbraw/zinc/85/98/69/1430859869.db2.gz CNFMZOLPLSXUHY-UHFFFAOYSA-N 0 0 381.791 3.466 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184233035 1430860172 /nfs/dbraw/zinc/86/01/72/1430860172.db2.gz UALVCSSXOJEOQX-UHFFFAOYSA-N 0 0 397.353 3.481 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000184237372 1430860534 /nfs/dbraw/zinc/86/05/34/1430860534.db2.gz DDQSUBRDFVEFNV-MRXNPFEDSA-N 0 0 396.852 3.319 20 5 GGBDRN COc1cc(CN2CCOC[C@H]2C[C@H](O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184237188 1430860567 /nfs/dbraw/zinc/86/05/67/1430860567.db2.gz GBBGUXMODPQECF-APWZRJJASA-N 0 0 390.411 3.067 20 5 GGBDRN COc1cc(CN2CCC(NC(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000184240981 1430861035 /nfs/dbraw/zinc/86/10/35/1430861035.db2.gz VGGPVONNYWEUSJ-UHFFFAOYSA-N 0 0 383.420 3.232 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000184241199 1430861117 /nfs/dbraw/zinc/86/11/17/1430861117.db2.gz REAWISRPYQKFOU-KRWDZBQOSA-N 0 0 396.852 3.319 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184251795 1430862534 /nfs/dbraw/zinc/86/25/34/1430862534.db2.gz GJXLMQSTMBOAFL-KGLIPLIRSA-N 0 0 381.448 3.259 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184251744 1430862546 /nfs/dbraw/zinc/86/25/46/1430862546.db2.gz GJXLMQSTMBOAFL-UONOGXRCSA-N 0 0 381.448 3.259 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)Cc2cccc3cccnc32)c(Cl)c1 ZINC000184251313 1430862597 /nfs/dbraw/zinc/86/25/97/1430862597.db2.gz XJZZCZQGUPRDIL-UHFFFAOYSA-N 0 0 391.836 3.416 20 5 GGBDRN COc1cc(CN2CCN(c3ccc(Cl)cn3)CC2)c([N+](=O)[O-])cc1F ZINC000184252000 1430862729 /nfs/dbraw/zinc/86/27/29/1430862729.db2.gz NEZJCNGVTOMPIH-UHFFFAOYSA-N 0 0 380.807 3.113 20 5 GGBDRN COc1cc(CN(C)CC(=O)Nc2cc(F)cc(F)c2)c([N+](=O)[O-])cc1F ZINC000184253922 1430863068 /nfs/dbraw/zinc/86/30/68/1430863068.db2.gz HFONKMHPFXIQMO-UHFFFAOYSA-N 0 0 383.326 3.091 20 5 GGBDRN COc1cc(CN2CCN(c3ncccc3Cl)CC2)c([N+](=O)[O-])cc1F ZINC000184261492 1430864050 /nfs/dbraw/zinc/86/40/50/1430864050.db2.gz ZMVDMZJRHKHLLZ-UHFFFAOYSA-N 0 0 380.807 3.113 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000184267766 1430865037 /nfs/dbraw/zinc/86/50/37/1430865037.db2.gz YQRJSYMKIMYMFZ-VQIMIIECSA-N 0 0 390.461 3.182 20 5 GGBDRN CCS(=O)(=O)c1cc(F)ccc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000184276669 1430866435 /nfs/dbraw/zinc/86/64/35/1430866435.db2.gz WSQDISKCJPBHRU-UHFFFAOYSA-N 0 0 395.412 3.191 20 5 GGBDRN C[C@H](C(=O)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184306681 1430871214 /nfs/dbraw/zinc/87/12/14/1430871214.db2.gz XTRVLQBKYLXDOH-ZJNRKIDTSA-N 0 0 385.395 3.148 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccccc2-n2nccc2C)cc([N+](=O)[O-])c1 ZINC000184306521 1430871365 /nfs/dbraw/zinc/87/13/65/1430871365.db2.gz FSYFAXLGKXKFGZ-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2c(C)oc3ccccc32)cc1[N+](=O)[O-] ZINC000184326873 1430873472 /nfs/dbraw/zinc/87/34/72/1430873472.db2.gz LCQATDQKLCMSFS-UHFFFAOYSA-N 0 0 376.390 3.137 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000184330006 1430873918 /nfs/dbraw/zinc/87/39/18/1430873918.db2.gz CMIVEUXDYSKVIF-KGLIPLIRSA-N 0 0 380.416 3.418 20 5 GGBDRN COC(=O)[C@@H](C)Cc1ccc(NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000184365431 1430878884 /nfs/dbraw/zinc/87/88/84/1430878884.db2.gz SNNRUYXEPZZIDP-AWEZNQCLSA-N 0 0 385.420 3.305 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1[N+](=O)[O-] ZINC000184369957 1430879465 /nfs/dbraw/zinc/87/94/65/1430879465.db2.gz MMNHXQLWMFBJKH-LBPRGKRZSA-N 0 0 382.388 3.360 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000184380815 1430881032 /nfs/dbraw/zinc/88/10/32/1430881032.db2.gz OGTDPEIUWDYRGW-UHFFFAOYSA-N 0 0 389.433 3.046 20 5 GGBDRN CC[C@H](N[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000184394952 1430882584 /nfs/dbraw/zinc/88/25/84/1430882584.db2.gz NSNHNDNMAGBLBV-AAEUAGOBSA-N 0 0 378.454 3.436 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O ZINC000184401202 1430883326 /nfs/dbraw/zinc/88/33/26/1430883326.db2.gz LYWGKXVJCPYVAC-QGZVFWFLSA-N 0 0 392.371 3.035 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000184415921 1430885390 /nfs/dbraw/zinc/88/53/90/1430885390.db2.gz YJWYMSWWGBJCGM-QGZVFWFLSA-N 0 0 396.852 3.152 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H](c1nccs1)c1ccccc1 ZINC000184419336 1430885541 /nfs/dbraw/zinc/88/55/41/1430885541.db2.gz VUXYCFHKAGDFKJ-MRXNPFEDSA-N 0 0 389.458 3.260 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(NCCc3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1 ZINC000184430368 1430887031 /nfs/dbraw/zinc/88/70/31/1430887031.db2.gz JFAFIMWZZKPVKT-HOTGVXAUSA-N 0 0 383.448 3.499 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NCCc3ccc([N+](=O)[O-])cc3)cc2)C[C@@H](C)O1 ZINC000184430386 1430887038 /nfs/dbraw/zinc/88/70/38/1430887038.db2.gz JFAFIMWZZKPVKT-HZPDHXFCSA-N 0 0 383.448 3.499 20 5 GGBDRN C[C@@H](c1cnccn1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000184432504 1430887068 /nfs/dbraw/zinc/88/70/68/1430887068.db2.gz PJFARNZVUSPUMH-LBPRGKRZSA-N 0 0 381.358 3.287 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)c1ccccc1 ZINC000184440347 1430887915 /nfs/dbraw/zinc/88/79/15/1430887915.db2.gz KBTIJIQYXVANPP-SFHVURJKSA-N 0 0 378.388 3.100 20 5 GGBDRN O=C(NCc1cccc(Cn2ccnc2)c1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184443609 1430888385 /nfs/dbraw/zinc/88/83/85/1430888385.db2.gz VVWBQIAMCFHUKA-UHFFFAOYSA-N 0 0 399.838 3.492 20 5 GGBDRN Cc1cc2c(cc1C)[C@@H](C(=O)Nc1n[nH]c(-c3cccc([N+](=O)[O-])c3)n1)CO2 ZINC000184470909 1430891459 /nfs/dbraw/zinc/89/14/59/1430891459.db2.gz AQDBYDIBNMKKTK-HNNXBMFYSA-N 0 0 379.376 3.111 20 5 GGBDRN Cc1cc2c(cc1C)[C@H](C(=O)Nc1n[nH]c(-c3cccc([N+](=O)[O-])c3)n1)CO2 ZINC000184470927 1430891492 /nfs/dbraw/zinc/89/14/92/1430891492.db2.gz AQDBYDIBNMKKTK-OAHLLOKOSA-N 0 0 379.376 3.111 20 5 GGBDRN O=C(NCc1cccc(Cn2cccn2)c1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184478152 1430892329 /nfs/dbraw/zinc/89/23/29/1430892329.db2.gz PPVJMYWREUMNCT-UHFFFAOYSA-N 0 0 399.838 3.492 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000184479803 1430892507 /nfs/dbraw/zinc/89/25/07/1430892507.db2.gz SVVRVAIYISEFNE-CQSZACIVSA-N 0 0 388.424 3.199 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCCN(c2nccs2)CC1 ZINC000184486922 1430893235 /nfs/dbraw/zinc/89/32/35/1430893235.db2.gz XSKMTUJYSYBOHK-UHFFFAOYSA-N 0 0 375.454 3.412 20 5 GGBDRN C[C@H](NC(=O)N1CCN([C@@H](C)c2nccs2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000184497838 1430895213 /nfs/dbraw/zinc/89/52/13/1430895213.db2.gz PUIMVTSYLCMJKP-KBPBESRZSA-N 0 0 389.481 3.201 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000184497879 1430895230 /nfs/dbraw/zinc/89/52/30/1430895230.db2.gz PUIMVTSYLCMJKP-UONOGXRCSA-N 0 0 389.481 3.201 20 5 GGBDRN C[C@@H](NC(=O)N1CCN([C@@H](C)c2nccs2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000184497857 1430895293 /nfs/dbraw/zinc/89/52/93/1430895293.db2.gz PUIMVTSYLCMJKP-KGLIPLIRSA-N 0 0 389.481 3.201 20 5 GGBDRN C[C@@H](NC(=O)N1CCN([C@H](C)c2nccs2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000184497896 1430895367 /nfs/dbraw/zinc/89/53/67/1430895367.db2.gz PUIMVTSYLCMJKP-ZIAGYGMSSA-N 0 0 389.481 3.201 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184515319 1430897333 /nfs/dbraw/zinc/89/73/33/1430897333.db2.gz QYHNVGAKXFEBKX-SJCJKPOMSA-N 0 0 398.868 3.444 20 5 GGBDRN C[C@H]1C[C@H](c2ccc(F)cc2)CN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184517823 1430897462 /nfs/dbraw/zinc/89/74/62/1430897462.db2.gz PHEJMSUNHSRZNZ-BBRMVZONSA-N 0 0 378.425 3.442 20 5 GGBDRN O=C(NCc1ccc(OCC2CC2)nc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184526317 1430898736 /nfs/dbraw/zinc/89/87/36/1430898736.db2.gz PKJNESVGMHOHNM-UHFFFAOYSA-N 0 0 390.827 3.431 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCSC[C@@H]1c1nccs1 ZINC000184544033 1430901563 /nfs/dbraw/zinc/90/15/63/1430901563.db2.gz DOFXINNMYMHQPM-OAHLLOKOSA-N 0 0 388.474 3.392 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCCCO2)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184551132 1430902804 /nfs/dbraw/zinc/90/28/04/1430902804.db2.gz JQINKYYXEMQVRB-UHFFFAOYSA-N 0 0 391.811 3.409 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2-c2nnnn2C(C)C)ccc1[N+](=O)[O-] ZINC000184554399 1430903821 /nfs/dbraw/zinc/90/38/21/1430903821.db2.gz PRQIHBRJLZIFHL-UHFFFAOYSA-N 0 0 382.380 3.090 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccccc1OCC1CC1 ZINC000184558697 1430904664 /nfs/dbraw/zinc/90/46/64/1430904664.db2.gz HSPQTVSVHKOJOO-UHFFFAOYSA-N 0 0 376.434 3.003 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184566751 1430906361 /nfs/dbraw/zinc/90/63/61/1430906361.db2.gz XYZZMPYWLCZDNT-LLVKDONJSA-N 0 0 389.383 3.187 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 ZINC000184575992 1430907736 /nfs/dbraw/zinc/90/77/36/1430907736.db2.gz SEHLDWAOYZAOKC-UHFFFAOYSA-N 0 0 381.432 3.459 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2-c2nnnn2C(C)C)c1 ZINC000184581846 1430909644 /nfs/dbraw/zinc/90/96/44/1430909644.db2.gz FZMJWSPISOFYCI-UHFFFAOYSA-N 0 0 382.380 3.090 20 5 GGBDRN CSCC[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000184602819 1430915843 /nfs/dbraw/zinc/91/58/43/1430915843.db2.gz DGHOMDXFMRUOAZ-AWEZNQCLSA-N 0 0 375.429 3.361 20 5 GGBDRN Cn1cc([C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)c2ccc(F)cc2)cn1 ZINC000184605732 1430917518 /nfs/dbraw/zinc/91/75/18/1430917518.db2.gz KBCYIRBESXOXAN-LJQANCHMSA-N 0 0 398.394 3.213 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCN([C@H](C)c2nccs2)CC1 ZINC000184609434 1430918445 /nfs/dbraw/zinc/91/84/45/1430918445.db2.gz CUOCDUJAFIRHSC-CQSZACIVSA-N 0 0 376.482 3.329 20 5 GGBDRN Cc1cc(NC(=O)N2CCN([C@@H](C)c3nccs3)CC2)ccc1[N+](=O)[O-] ZINC000184611774 1430918982 /nfs/dbraw/zinc/91/89/82/1430918982.db2.gz GTVNLPRJGBJCMW-ZDUSSCGKSA-N 0 0 375.454 3.270 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000184612356 1430919517 /nfs/dbraw/zinc/91/95/17/1430919517.db2.gz FFWGDHBHYPLGPE-HNNXBMFYSA-N 0 0 376.482 3.199 20 5 GGBDRN Cc1cc(NC(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000184612889 1430919588 /nfs/dbraw/zinc/91/95/88/1430919588.db2.gz XPSKLBWOSRGPDI-MRXNPFEDSA-N 0 0 382.420 3.073 20 5 GGBDRN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1-c1nnnn1C1CC1 ZINC000184614781 1430920168 /nfs/dbraw/zinc/92/01/68/1430920168.db2.gz MCVLYDQBSGEXAY-UHFFFAOYSA-N 0 0 378.392 3.452 20 5 GGBDRN NC(=O)c1cccc(CCNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1 ZINC000184620622 1430921577 /nfs/dbraw/zinc/92/15/77/1430921577.db2.gz PIXXALPNZLIINW-UHFFFAOYSA-N 0 0 396.325 3.077 20 5 GGBDRN COC(=O)[C@@]1(C)CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000184623200 1430922481 /nfs/dbraw/zinc/92/24/81/1430922481.db2.gz QXPRAYWXQVKOBM-AWEZNQCLSA-N 0 0 375.303 3.031 20 5 GGBDRN COC(=O)[C@]1(C)CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000184623223 1430922739 /nfs/dbraw/zinc/92/27/39/1430922739.db2.gz QXPRAYWXQVKOBM-CQSZACIVSA-N 0 0 375.303 3.031 20 5 GGBDRN CC(C)n1nnnc1-c1ccccc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000184633592 1430924784 /nfs/dbraw/zinc/92/47/84/1430924784.db2.gz OIGRPBXNFUTALN-UHFFFAOYSA-N 0 0 395.423 3.493 20 5 GGBDRN CCCOc1ncccc1CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184639726 1430927048 /nfs/dbraw/zinc/92/70/48/1430927048.db2.gz MRUOLLOQRDKGQL-UHFFFAOYSA-N 0 0 378.816 3.431 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccc(O)cc2)CC1 ZINC000184641253 1430927533 /nfs/dbraw/zinc/92/75/33/1430927533.db2.gz GZSYUGWLUGSKEW-KRWDZBQOSA-N 0 0 383.448 3.218 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000184644818 1430928469 /nfs/dbraw/zinc/92/84/69/1430928469.db2.gz KGZKURRQQFMIDY-ZBFHGGJFSA-N 0 0 396.490 3.074 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2cccc(O)c2)CC1 ZINC000184657581 1430932077 /nfs/dbraw/zinc/93/20/77/1430932077.db2.gz SCNOCJGFFAAJBF-KRWDZBQOSA-N 0 0 383.448 3.218 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NS(C)(=O)=O)cc1 ZINC000184660668 1430933110 /nfs/dbraw/zinc/93/31/10/1430933110.db2.gz HPCGGIYQUHMZTA-CQSZACIVSA-N 0 0 391.449 3.174 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](CC(C)C)N1CCOCC1 ZINC000184661376 1430933845 /nfs/dbraw/zinc/93/38/45/1430933845.db2.gz DHQOIPBIOFMVLB-AZUAARDMSA-N 0 0 391.512 3.027 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C(=O)c2ccoc2)CC1 ZINC000184663960 1430934587 /nfs/dbraw/zinc/93/45/87/1430934587.db2.gz NMOZLCSVINLRAL-MRXNPFEDSA-N 0 0 399.447 3.178 20 5 GGBDRN C[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000184667493 1430936433 /nfs/dbraw/zinc/93/64/33/1430936433.db2.gz BMUGKNJTMGQCDE-OAHLLOKOSA-N 0 0 389.477 3.376 20 5 GGBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000184667473 1430936555 /nfs/dbraw/zinc/93/65/55/1430936555.db2.gz BMUGKNJTMGQCDE-HNNXBMFYSA-N 0 0 389.477 3.376 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(NS(C)(=O)=O)c1 ZINC000184671045 1430937977 /nfs/dbraw/zinc/93/79/77/1430937977.db2.gz VAAZXOSMGNSYIT-CQSZACIVSA-N 0 0 391.449 3.174 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(N2CCCC2)nc1 ZINC000184673284 1430938644 /nfs/dbraw/zinc/93/86/44/1430938644.db2.gz OWBDXOCSVNHGGY-SFHVURJKSA-N 0 0 382.464 3.475 20 5 GGBDRN Cn1cnc(-c2cccc(NC(=O)NCc3ccc([N+](=O)[O-])cc3Cl)c2)n1 ZINC000184678043 1430939992 /nfs/dbraw/zinc/93/99/92/1430939992.db2.gz LNROWPWLFWJJOY-UHFFFAOYSA-N 0 0 386.799 3.365 20 5 GGBDRN Cc1cc(CNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])ccc1Cl ZINC000184685968 1430942727 /nfs/dbraw/zinc/94/27/27/1430942727.db2.gz IRKFYJJATJFANJ-UHFFFAOYSA-N 0 0 393.852 3.064 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(-n2ccnc2C)nc1 ZINC000184702072 1430946731 /nfs/dbraw/zinc/94/67/31/1430946731.db2.gz RRUBXHJXMXVUMV-GOSISDBHSA-N 0 0 393.447 3.369 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1N1CCOCC1 ZINC000184705215 1430947362 /nfs/dbraw/zinc/94/73/62/1430947362.db2.gz ARJODXGOLPUSLB-GOSISDBHSA-N 0 0 397.475 3.317 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000184722820 1430954162 /nfs/dbraw/zinc/95/41/62/1430954162.db2.gz SHOVZVXAXJJATA-QZTJIDSGSA-N 0 0 389.496 3.174 20 5 GGBDRN COc1cccc(C(C)(C)CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000184726983 1430955444 /nfs/dbraw/zinc/95/54/44/1430955444.db2.gz CZBDKXZGUGATEM-UHFFFAOYSA-N 0 0 378.450 3.001 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000184731967 1430957239 /nfs/dbraw/zinc/95/72/39/1430957239.db2.gz MCDNVHANUXXKFL-CQSZACIVSA-N 0 0 396.852 3.231 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1)c1ccc([N+](=O)[O-])cc1F ZINC000184735899 1430958880 /nfs/dbraw/zinc/95/88/80/1430958880.db2.gz XKVQAOGIQMPMES-SNVBAGLBSA-N 0 0 377.347 3.317 20 5 GGBDRN COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1OC[C@@H](O)CCc1ccccc1 ZINC000184737172 1430959137 /nfs/dbraw/zinc/95/91/37/1430959137.db2.gz XSCPAANJFVHSIM-AWEZNQCLSA-N 0 0 379.796 3.407 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@H](C)c2csc(CC)n2)c([N+](=O)[O-])c1 ZINC000184738335 1430959960 /nfs/dbraw/zinc/95/99/60/1430959960.db2.gz JWBHHXYCDUMNMO-LLVKDONJSA-N 0 0 378.454 3.302 20 5 GGBDRN COC[C@@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccc(C)o1 ZINC000184752553 1430966243 /nfs/dbraw/zinc/96/62/43/1430966243.db2.gz LYCLHZXWYWQVNX-XHDPSFHLSA-N 0 0 381.816 3.454 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 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ZINC000185006969 1431040725 /nfs/dbraw/zinc/04/07/25/1431040725.db2.gz UHZYZXMSBDQINM-SECBINFHSA-N 0 0 378.410 3.452 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1 ZINC000185013986 1431042193 /nfs/dbraw/zinc/04/21/93/1431042193.db2.gz YIOCRPVSWMWPDR-CQSZACIVSA-N 0 0 376.434 3.206 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)COc1c(F)cccc1[N+](=O)[O-] ZINC000185019715 1431043036 /nfs/dbraw/zinc/04/30/36/1431043036.db2.gz MXPXVLWHJWQLKZ-UHFFFAOYSA-N 0 0 376.384 3.356 20 5 GGBDRN O=C(COc1c(F)cccc1[N+](=O)[O-])N(Cc1ccco1)CC(F)(F)F ZINC000185036164 1431046309 /nfs/dbraw/zinc/04/63/09/1431046309.db2.gz FLSBHWMPOQEYEJ-UHFFFAOYSA-N 0 0 376.262 3.297 20 5 GGBDRN C[C@H](C(=O)NC(C)(C)C(=O)NCC1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000185039221 1431047196 /nfs/dbraw/zinc/04/71/96/1431047196.db2.gz RGHMPIWJMSAHRJ-LBPRGKRZSA-N 0 0 379.432 3.039 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(S(C)(=O)=O)ccc1F ZINC000185041710 1431047663 /nfs/dbraw/zinc/04/76/63/1431047663.db2.gz QYJTZBRWFLUFMW-ZDUSSCGKSA-N 0 0 394.424 3.345 20 5 GGBDRN O=C(COc1c(F)cccc1[N+](=O)[O-])NCc1ccc(OC(F)(F)F)cc1 ZINC000185043999 1431047988 /nfs/dbraw/zinc/04/79/88/1431047988.db2.gz FUDMSCJYAAUBBJ-UHFFFAOYSA-N 0 0 388.273 3.328 20 5 GGBDRN CCN(CC)C(=O)c1cccc(NC(=O)COc2c(F)cccc2[N+](=O)[O-])c1 ZINC000185044164 1431048221 /nfs/dbraw/zinc/04/82/21/1431048221.db2.gz JLEWOQBTWOVYAD-UHFFFAOYSA-N 0 0 389.383 3.233 20 5 GGBDRN COC(=O)c1ccc(F)c(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000185051671 1431049382 /nfs/dbraw/zinc/04/93/82/1431049382.db2.gz YZVPLAMJCAYBDT-UHFFFAOYSA-N 0 0 381.747 3.496 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SCC(N)=O ZINC000185049824 1431049401 /nfs/dbraw/zinc/04/94/01/1431049401.db2.gz IYGCLBJYFPAMLA-CQSZACIVSA-N 0 0 387.461 3.380 20 5 GGBDRN CC(=O)Nc1cccc2c1CCN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)C2 ZINC000185058825 1431051408 /nfs/dbraw/zinc/05/14/08/1431051408.db2.gz WMDJNJLQKSDZNM-GFCCVEGCSA-N 0 0 385.395 3.381 20 5 GGBDRN COC(=O)c1cccc2[nH]c(NC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)nc21 ZINC000185065000 1431052699 /nfs/dbraw/zinc/05/26/99/1431052699.db2.gz YCHYFZQQZNKQGO-VIFPVBQESA-N 0 0 386.339 3.139 20 5 GGBDRN COc1cc2c(cc1CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)O[C@@H](C)C2 ZINC000185076913 1431054957 /nfs/dbraw/zinc/05/49/57/1431054957.db2.gz PREIAHPWSNRPDQ-RYUDHWBXSA-N 0 0 388.395 3.486 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000185089611 1431058203 /nfs/dbraw/zinc/05/82/03/1431058203.db2.gz LUJSOMUXPHFDEM-GFCCVEGCSA-N 0 0 394.424 3.063 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)N1C[C@@H](C)O[C@@H](C)C1 ZINC000185099594 1431061048 /nfs/dbraw/zinc/06/10/48/1431061048.db2.gz YCBPREUIYTWGLC-SOLBZPMBSA-N 0 0 391.512 3.168 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 ZINC000185099630 1431061294 /nfs/dbraw/zinc/06/12/94/1431061294.db2.gz YCBPREUIYTWGLC-JFIYKMOQSA-N 0 0 391.512 3.168 20 5 GGBDRN COc1ccccc1C1(CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000185102194 1431061620 /nfs/dbraw/zinc/06/16/20/1431061620.db2.gz QULSUEFYLSTIHH-UHFFFAOYSA-N 0 0 390.461 3.145 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@@H](O)COc2cc(C)c([N+](=O)[O-])cc2F)cc1 ZINC000185106883 1431062314 /nfs/dbraw/zinc/06/23/14/1431062314.db2.gz OZLQDMHZWAHLPT-MRXNPFEDSA-N 0 0 391.395 3.383 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(C(=O)N(C)C)cc1 ZINC000185108652 1431062670 /nfs/dbraw/zinc/06/26/70/1431062670.db2.gz GYHMGTBCYODSGU-QGZVFWFLSA-N 0 0 383.448 3.182 20 5 GGBDRN C[C@@H](C(=O)N1CCCN(c2nccs2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185121409 1431065336 /nfs/dbraw/zinc/06/53/36/1431065336.db2.gz PFDGGSXOTNXKMW-GFCCVEGCSA-N 0 0 378.429 3.033 20 5 GGBDRN Cc1cc(S(=O)(=O)NC(C)(C)c2nc3ccccc3n2C)ccc1[N+](=O)[O-] ZINC000185128561 1431067495 /nfs/dbraw/zinc/06/74/95/1431067495.db2.gz UBBLZJRWSDUHCC-UHFFFAOYSA-N 0 0 388.449 3.004 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NCCOc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000185127925 1431067646 /nfs/dbraw/zinc/06/76/46/1431067646.db2.gz SIFFIJKUUWTQHY-ZDUSSCGKSA-N 0 0 384.392 3.383 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC(C)(C)c1nc2ccccc2n1C ZINC000185127870 1431067755 /nfs/dbraw/zinc/06/77/55/1431067755.db2.gz ZITZNPGORQDALU-UHFFFAOYSA-N 0 0 388.449 3.004 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000185138093 1431070323 /nfs/dbraw/zinc/07/03/23/1431070323.db2.gz WARXHFKYCCOMOC-KRWDZBQOSA-N 0 0 394.836 3.068 20 5 GGBDRN CNC(=O)CCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000185140916 1431070724 /nfs/dbraw/zinc/07/07/24/1431070724.db2.gz RZDCKAQJIWIMRX-UHFFFAOYSA-N 0 0 393.509 3.475 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1F)N1CCN(Cc2cccs2)CC1 ZINC000185147284 1431072334 /nfs/dbraw/zinc/07/23/34/1431072334.db2.gz HFDQGTIGQNRNGE-UHFFFAOYSA-N 0 0 395.481 3.232 20 5 GGBDRN COC(=O)CC1(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCCCC1 ZINC000185171860 1431076824 /nfs/dbraw/zinc/07/68/24/1431076824.db2.gz TZFALJSHJUGVSJ-UHFFFAOYSA-N 0 0 385.420 3.386 20 5 GGBDRN COc1ccccc1NC(=O)C1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1 ZINC000185171962 1431076994 /nfs/dbraw/zinc/07/69/94/1431076994.db2.gz YMYLOTMCQFXRAF-UHFFFAOYSA-N 0 0 385.420 3.467 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCC2(CCOCc3ccccc3)CC2)cc1 ZINC000185186699 1431079916 /nfs/dbraw/zinc/07/99/16/1431079916.db2.gz RVJKKMCZAHXEOW-UHFFFAOYSA-N 0 0 390.461 3.260 20 5 GGBDRN COc1cccc(N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000185191678 1431081375 /nfs/dbraw/zinc/08/13/75/1431081375.db2.gz UWWGIBWKBQROGR-UHFFFAOYSA-N 0 0 389.839 3.148 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cn2cncn2)cc1 ZINC000185194415 1431081550 /nfs/dbraw/zinc/08/15/50/1431081550.db2.gz PHOBTVBUILXKNK-KRWDZBQOSA-N 0 0 379.420 3.442 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1 ZINC000185194865 1431081763 /nfs/dbraw/zinc/08/17/63/1431081763.db2.gz WZNLJHRWROMGDY-VQIMIIECSA-N 0 0 399.447 3.064 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 ZINC000185198043 1431082509 /nfs/dbraw/zinc/08/25/09/1431082509.db2.gz AAVJSCGFWANJFA-ZFWWWQNUSA-N 0 0 397.431 3.372 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000185204733 1431084577 /nfs/dbraw/zinc/08/45/77/1431084577.db2.gz ZBUGIDJBEILGJA-LBPRGKRZSA-N 0 0 375.429 3.263 20 5 GGBDRN C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1nc(C2CCCCC2)no1 ZINC000185215059 1431086524 /nfs/dbraw/zinc/08/65/24/1431086524.db2.gz VYIIHIUQZBZFPM-CZUORRHYSA-N 0 0 390.440 3.116 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-n2nnnc2C)c1 ZINC000185221147 1431088188 /nfs/dbraw/zinc/08/81/88/1431088188.db2.gz CWFYONLCXZKZIB-OAHLLOKOSA-N 0 0 380.408 3.086 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-n2cnnn2)ccc1C ZINC000185231864 1431090183 /nfs/dbraw/zinc/09/01/83/1431090183.db2.gz BODOKKFFLMOJEL-HNNXBMFYSA-N 0 0 380.408 3.086 20 5 GGBDRN C[C@@H](C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000185233332 1431090665 /nfs/dbraw/zinc/09/06/65/1431090665.db2.gz RLXQGPKFGDWLJE-AUUYWEPGSA-N 0 0 399.422 3.145 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nnc(C2CC2)n1C1CC1 ZINC000185235500 1431090816 /nfs/dbraw/zinc/09/08/16/1431090816.db2.gz ZDOLLILQICZFJB-AWEZNQCLSA-N 0 0 383.452 3.284 20 5 GGBDRN C[C@@H](C(=O)NCCCC(=O)N1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1F ZINC000185238830 1431091439 /nfs/dbraw/zinc/09/14/39/1431091439.db2.gz LPUBSHPRXGSQBY-CQSZACIVSA-N 0 0 399.422 3.323 20 5 GGBDRN C[C@@H](C(=O)N1CCC[C@H](CNC(=O)C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185241499 1431092204 /nfs/dbraw/zinc/09/22/04/1431092204.db2.gz PYAXXUNMGCFYIA-ZIAGYGMSSA-N 0 0 393.459 3.238 20 5 GGBDRN COc1cccc(NCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000185243515 1431092635 /nfs/dbraw/zinc/09/26/35/1431092635.db2.gz JQXMANLOUMDZBW-GJZGRUSLSA-N 0 0 399.447 3.465 20 5 GGBDRN C[C@H](C(=O)N1CCN([C@@H](C)c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185245033 1431092823 /nfs/dbraw/zinc/09/28/23/1431092823.db2.gz SJMXDCZCSGGZNX-GJZGRUSLSA-N 0 0 386.427 3.138 20 5 GGBDRN C[C@H](C(=O)NCc1cccnc1OCC(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000185247398 1431093162 /nfs/dbraw/zinc/09/31/62/1431093162.db2.gz DVYKCHKYLXRKGM-JTQLQIEISA-N 0 0 383.326 3.193 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc(COc2ccccc2F)on1 ZINC000185251987 1431094116 /nfs/dbraw/zinc/09/41/16/1431094116.db2.gz QLQNYKKRXVDPOW-UHFFFAOYSA-N 0 0 385.351 3.273 20 5 GGBDRN C[C@H](N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nc(C2CCCCC2)no1 ZINC000185261795 1431096082 /nfs/dbraw/zinc/09/60/82/1431096082.db2.gz IXPBUHJGFSJDRZ-GUYCJALGSA-N 0 0 399.451 3.482 20 5 GGBDRN C[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1nc(C2CCCCC2)no1 ZINC000185274960 1431098105 /nfs/dbraw/zinc/09/81/05/1431098105.db2.gz CJEJVSGWSULNMB-ZDUSSCGKSA-N 0 0 387.440 3.339 20 5 GGBDRN COc1cccc(N2CCC(C(=O)NCCc3cccs3)CC2)c1[N+](=O)[O-] ZINC000185275987 1431098176 /nfs/dbraw/zinc/09/81/76/1431098176.db2.gz QSVQNPQGBBTXDW-UHFFFAOYSA-N 0 0 389.477 3.240 20 5 GGBDRN CCOC(=O)c1cc(N2CCN([C@H](C)c3nccs3)CC2)ccc1[N+](=O)[O-] ZINC000185277068 1431098642 /nfs/dbraw/zinc/09/86/42/1431098642.db2.gz JWPIHQARFPCRKA-CYBMUJFWSA-N 0 0 390.465 3.111 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000185287904 1431100155 /nfs/dbraw/zinc/10/01/55/1431100155.db2.gz SZIMMVLDNQXBRE-KRWDZBQOSA-N 0 0 383.448 3.481 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccn(Cc2ccncc2)n1 ZINC000185289719 1431100471 /nfs/dbraw/zinc/10/04/71/1431100471.db2.gz YFMVWQDCIZICPJ-QGZVFWFLSA-N 0 0 379.420 3.442 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CCC(N)=O)c1cccc(C)c1 ZINC000185298756 1431104193 /nfs/dbraw/zinc/10/41/93/1431104193.db2.gz XRHDHYLZSYCIJK-KRWDZBQOSA-N 0 0 383.448 3.381 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCOCC2)cn1 ZINC000185322809 1431114127 /nfs/dbraw/zinc/11/41/27/1431114127.db2.gz IRGQJSGCLGZDMV-INIZCTEOSA-N 0 0 384.436 3.034 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H](c2c(F)cccc2F)C1 ZINC000185335382 1431118839 /nfs/dbraw/zinc/11/88/39/1431118839.db2.gz ZSVFUYLOXPDLQQ-LBPRGKRZSA-N 0 0 391.374 3.310 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000185351082 1431123312 /nfs/dbraw/zinc/12/33/12/1431123312.db2.gz NQCBKQWNHJMOBK-LLVKDONJSA-N 0 0 397.218 3.172 20 5 GGBDRN COCCOc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000185357278 1431125419 /nfs/dbraw/zinc/12/54/19/1431125419.db2.gz GZRXQSHCPBWOQS-UHFFFAOYSA-N 0 0 378.812 3.246 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H](C(=O)OC)c2ccccc21 ZINC000185359797 1431125887 /nfs/dbraw/zinc/12/58/87/1431125887.db2.gz MXWVEAIQEYDVLP-CRAIPNDOSA-N 0 0 382.416 3.467 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])c1 ZINC000185359050 1431125988 /nfs/dbraw/zinc/12/59/88/1431125988.db2.gz 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C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCN([C@@H](C)c2ccsc2)CC1 ZINC000185439610 1431145927 /nfs/dbraw/zinc/14/59/27/1431145927.db2.gz YFKDHZDKIIJKIF-GJZGRUSLSA-N 0 0 388.493 3.362 20 5 GGBDRN C[C@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000185447625 1431148075 /nfs/dbraw/zinc/14/80/75/1431148075.db2.gz BEWWUIOULCQAMR-ORAYPTAESA-N 0 0 397.410 3.174 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000185456751 1431149333 /nfs/dbraw/zinc/14/93/33/1431149333.db2.gz HXDCMZDYXIQWSY-CQSZACIVSA-N 0 0 399.451 3.159 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(OC[C@@H]2CCCO2)CC1 ZINC000185466527 1431151574 /nfs/dbraw/zinc/15/15/74/1431151574.db2.gz VJMIXZVNCRLAHI-XLIONFOSSA-N 0 0 390.480 3.350 20 5 GGBDRN COc1cc(CCNc2nnc(-c3ccccn3)s2)c([N+](=O)[O-])cc1OC ZINC000185468485 1431151958 /nfs/dbraw/zinc/15/19/58/1431151958.db2.gz WGDOUAPLQGVHRY-UHFFFAOYSA-N 0 0 387.421 3.180 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(CSCCO)ccn1 ZINC000185469095 1431152078 /nfs/dbraw/zinc/15/20/78/1431152078.db2.gz KANFGUUQWJFLOA-INIZCTEOSA-N 0 0 389.477 3.423 20 5 GGBDRN CCOc1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c2ncccc12 ZINC000185471063 1431152285 /nfs/dbraw/zinc/15/22/85/1431152285.db2.gz MWGUCQBTDOGTAK-UHFFFAOYSA-N 0 0 383.408 3.384 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCC(O)(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000185476664 1431153863 /nfs/dbraw/zinc/15/38/63/1431153863.db2.gz RSXCDYAVTBWKMH-INIZCTEOSA-N 0 0 383.448 3.214 20 5 GGBDRN CCOc1ccccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185493042 1431157498 /nfs/dbraw/zinc/15/74/98/1431157498.db2.gz KLXBEFQMJHCVNX-UHFFFAOYSA-N 0 0 387.417 3.020 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(c2ncccc2F)C1 ZINC000185498768 1431158278 /nfs/dbraw/zinc/15/82/78/1431158278.db2.gz VWVPLWQADMGVIA-JKSUJKDBSA-N 0 0 386.427 3.093 20 5 GGBDRN C[C@@H](C(=O)NCCc1nnc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1F 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ZINC000185749712 1431223286 /nfs/dbraw/zinc/22/32/86/1431223286.db2.gz NQVQWMFOEXJCGS-UHFFFAOYSA-N 0 0 383.429 3.434 20 5 GGBDRN COC(=O)COc1ccc(CN(C)c2ccc3ncccc3c2[N+](=O)[O-])cc1 ZINC000185756491 1431226091 /nfs/dbraw/zinc/22/60/91/1431226091.db2.gz DWJAMOCACSVBCK-UHFFFAOYSA-N 0 0 381.388 3.331 20 5 GGBDRN COC(=O)COc1ccc(CN(C)c2ccc([N+](=O)[O-])c3cccnc32)cc1 ZINC000185756355 1431226137 /nfs/dbraw/zinc/22/61/37/1431226137.db2.gz SETLNALICLNWGX-UHFFFAOYSA-N 0 0 381.388 3.331 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(C(F)F)cc2)C1=O ZINC000185775587 1431232063 /nfs/dbraw/zinc/23/20/63/1431232063.db2.gz DORGLOYYOGJCDV-SFHVURJKSA-N 0 0 375.331 3.500 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NC2CCC(O)(c3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000185796269 1431238520 /nfs/dbraw/zinc/23/85/20/1431238520.db2.gz PCRCFQRDDXLURS-AZOSJMHDSA-N 0 0 398.463 3.489 20 5 GGBDRN CCS[C@@H]1CC[C@H](N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000185801965 1431239430 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OLUZHZLNMTVCSU-UHFFFAOYSA-N 0 0 392.375 3.010 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(C)(C)C)c1O ZINC000185846344 1431250340 /nfs/dbraw/zinc/25/03/40/1431250340.db2.gz MBMREDLQIRWPNN-LBPRGKRZSA-N 0 0 385.420 3.355 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC(O)(c2ccccc2)CC1 ZINC000185853887 1431252658 /nfs/dbraw/zinc/25/26/58/1431252658.db2.gz QZJAQIRAZNCWCZ-UHFFFAOYSA-N 0 0 383.448 3.297 20 5 GGBDRN C[C@H](CC(=O)c1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185862620 1431255368 /nfs/dbraw/zinc/25/53/68/1431255368.db2.gz YCAARVAUYDEVJU-CYBMUJFWSA-N 0 0 399.428 3.083 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cccc(C(C)(C)C)c2O)ccc1[N+](=O)[O-] ZINC000185867487 1431256750 /nfs/dbraw/zinc/25/67/50/1431256750.db2.gz DFTRVCIPZPDABE-UHFFFAOYSA-N 0 0 385.420 3.275 20 5 GGBDRN CN1Cc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)ccc2NC1=O ZINC000185869352 1431257161 /nfs/dbraw/zinc/25/71/61/1431257161.db2.gz OFRFGAPLVCPJLY-UHFFFAOYSA-N 0 0 395.419 3.425 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1cccc(F)c1F ZINC000185884737 1431263036 /nfs/dbraw/zinc/26/30/36/1431263036.db2.gz WZQAJPOKMOVKOK-JTQLQIEISA-N 0 0 393.371 3.461 20 5 GGBDRN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185893688 1431266793 /nfs/dbraw/zinc/26/67/93/1431266793.db2.gz ZVVQLZVUMAFLHA-IPYPFGDCSA-N 0 0 375.450 3.485 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)[C@H]2CCCC[C@H]12 ZINC000185913343 1431276462 /nfs/dbraw/zinc/27/64/62/1431276462.db2.gz PUYGIJUXVIQAAD-NFAWXSAZSA-N 0 0 375.450 3.342 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC(O)(c2ccccc2)CC1 ZINC000185931352 1431284779 /nfs/dbraw/zinc/28/47/79/1431284779.db2.gz JYECGLLXYUHUER-UHFFFAOYSA-N 0 0 381.432 3.293 20 5 GGBDRN CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000185937953 1431287503 /nfs/dbraw/zinc/28/75/03/1431287503.db2.gz SYNOIKMWNRIMFE-GFCCVEGCSA-N 0 0 394.371 3.136 20 5 GGBDRN 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ZINC000185981218 1431304095 /nfs/dbraw/zinc/30/40/95/1431304095.db2.gz ZGDOXDSESPXMSV-UHFFFAOYSA-N 0 0 397.435 3.225 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000185994295 1431307104 /nfs/dbraw/zinc/30/71/04/1431307104.db2.gz JSXMGHYDOWBMRY-KSSFIOAISA-N 0 0 376.434 3.041 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000185994335 1431307342 /nfs/dbraw/zinc/30/73/42/1431307342.db2.gz JSXMGHYDOWBMRY-KDOFPFPSSA-N 0 0 376.434 3.041 20 5 GGBDRN CN(Cc1ccc([S@](C)=O)cc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186005145 1431309523 /nfs/dbraw/zinc/30/95/23/1431309523.db2.gz NLVUEGPPGJJKIS-SANMLTNESA-N 0 0 395.868 3.327 20 5 GGBDRN O=C(CCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)Nc1ccccc1 ZINC000186005856 1431309587 /nfs/dbraw/zinc/30/95/87/1431309587.db2.gz IOMFMZJJQXKEIP-UHFFFAOYSA-N 0 0 376.800 3.076 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186007836 1431309836 /nfs/dbraw/zinc/30/98/36/1431309836.db2.gz PZNJTFRJLSYMGD-UHFFFAOYSA-N 0 0 390.827 3.249 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186005953 1431310015 /nfs/dbraw/zinc/31/00/15/1431310015.db2.gz MFMSSOTUPQCXLX-CQSZACIVSA-N 0 0 396.875 3.086 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCCN(c2nccs2)CC1 ZINC000186008040 1431310449 /nfs/dbraw/zinc/31/04/49/1431310449.db2.gz ISGRQGLBRUEKNR-UHFFFAOYSA-N 0 0 395.872 3.127 20 5 GGBDRN COC(=O)c1cccc(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186012191 1431311170 /nfs/dbraw/zinc/31/11/70/1431311170.db2.gz OSZWBEJQCQKBOP-UHFFFAOYSA-N 0 0 391.811 3.077 20 5 GGBDRN COc1ccc(C[C@H](C)CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000186011457 1431311225 /nfs/dbraw/zinc/31/12/25/1431311225.db2.gz VXZCKWGVTZZZEJ-AWEZNQCLSA-N 0 0 378.450 3.103 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2cc(COC(C)(C)C)on2)c([N+](=O)[O-])c1 ZINC000186014214 1431311664 /nfs/dbraw/zinc/31/16/64/1431311664.db2.gz SOZHJYDJIBVQMA-UHFFFAOYSA-N 0 0 390.440 3.438 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186015606 1431312112 /nfs/dbraw/zinc/31/21/12/1431312112.db2.gz NKNSBBQWHVXNTK-UHFFFAOYSA-N 0 0 390.827 3.303 20 5 GGBDRN CCOC(=O)c1cnc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1 ZINC000186018558 1431312319 /nfs/dbraw/zinc/31/23/19/1431312319.db2.gz XBLTVSFUGNTDSV-UHFFFAOYSA-N 0 0 398.202 3.403 20 5 GGBDRN CC(C)(NC(=O)Nc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186022911 1431313278 /nfs/dbraw/zinc/31/32/78/1431313278.db2.gz BDNSXYUICXFOHI-UHFFFAOYSA-N 0 0 390.827 3.465 20 5 GGBDRN CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000186038759 1431317476 /nfs/dbraw/zinc/31/74/76/1431317476.db2.gz ROVZHSHSZUNITA-HNNXBMFYSA-N 0 0 377.400 3.413 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000186042939 1431318164 /nfs/dbraw/zinc/31/81/64/1431318164.db2.gz MXDGVYHDSVKIED-UHFFFAOYSA-N 0 0 387.461 3.378 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCC(C(=O)C(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000186050291 1431319591 /nfs/dbraw/zinc/31/95/91/1431319591.db2.gz YVBCBHJZLIYCEY-NSHDSACASA-N 0 0 387.358 3.074 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCO[C@H](CCc2ccccc2)C1 ZINC000186071000 1431324427 /nfs/dbraw/zinc/32/44/27/1431324427.db2.gz PWISBXFDMORDDK-LJQANCHMSA-N 0 0 383.448 3.175 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCO[C@H](CCc4ccccc4)C3)o2)cc1 ZINC000186074452 1431325098 /nfs/dbraw/zinc/32/50/98/1431325098.db2.gz QQXVKGXTQZEJNF-LJQANCHMSA-N 0 0 394.431 3.478 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCC[C@@H]2CCCCO2)c(S(=O)(=O)N2CCCC2)c1 ZINC000186079110 1431325846 /nfs/dbraw/zinc/32/58/46/1431325846.db2.gz SRJQXUYCHYQVGI-INIZCTEOSA-N 0 0 397.497 3.141 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCCC[C@H]2CCCCO2)c([N+](=O)[O-])c1 ZINC000186077348 1431325938 /nfs/dbraw/zinc/32/59/38/1431325938.db2.gz VROKRHFLSHYWRK-OAHLLOKOSA-N 0 0 399.513 3.387 20 5 GGBDRN COCCC1(CNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000186078806 1431326010 /nfs/dbraw/zinc/32/60/10/1431326010.db2.gz UUEASXSGQRZDSH-UHFFFAOYSA-N 0 0 384.498 3.044 20 5 GGBDRN Cn1nc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1OC(F)F ZINC000186124246 1431335603 /nfs/dbraw/zinc/33/56/03/1431335603.db2.gz MWYBPJNQIKFENH-UHFFFAOYSA-N 0 0 380.229 3.201 20 5 GGBDRN CSc1cccc(C(=O)Nc2cc(-n3cnnn3)ccc2Cl)c1[N+](=O)[O-] ZINC000186149648 1431341906 /nfs/dbraw/zinc/34/19/06/1431341906.db2.gz QIXIYUBRRNDVHM-UHFFFAOYSA-N 0 0 390.812 3.198 20 5 GGBDRN CSc1cccc(C(=O)N2CCC(CC(=O)N3CCCC3)CC2)c1[N+](=O)[O-] ZINC000186150463 1431342198 /nfs/dbraw/zinc/34/21/98/1431342198.db2.gz QGFZQQSPXYFRPT-UHFFFAOYSA-N 0 0 391.493 3.181 20 5 GGBDRN O=C(Nc1nnc(-c2c(F)cccc2Cl)s1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000186157558 1431343496 /nfs/dbraw/zinc/34/34/96/1431343496.db2.gz MEYVNICMCFBBGX-UHFFFAOYSA-N 0 0 395.759 3.259 20 5 GGBDRN CC(C)n1cnnc1C1CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000186171205 1431346254 /nfs/dbraw/zinc/34/62/54/1431346254.db2.gz ALLZBBKYHWYJPT-ZDUSSCGKSA-N 0 0 389.431 3.416 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000186180532 1431347925 /nfs/dbraw/zinc/34/79/25/1431347925.db2.gz QNDIPHWPLUOQAN-LBPRGKRZSA-N 0 0 382.413 3.042 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000186208975 1431352889 /nfs/dbraw/zinc/35/28/89/1431352889.db2.gz HXQAZSGEKOEYLY-UHFFFAOYSA-N 0 0 395.246 3.446 20 5 GGBDRN C[C@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000186224235 1431356667 /nfs/dbraw/zinc/35/66/67/1431356667.db2.gz TXMPBZVSPJTJDQ-OAQYLSRUSA-N 0 0 391.431 3.413 20 5 GGBDRN O=C(Nc1cncnc1N1CCCC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186229100 1431357634 /nfs/dbraw/zinc/35/76/34/1431357634.db2.gz WHGVXFPEFLOXPN-UHFFFAOYSA-N 0 0 396.432 3.361 20 5 GGBDRN Cc1oc2ccccc2c1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000186233058 1431358244 /nfs/dbraw/zinc/35/82/44/1431358244.db2.gz WPDJVLKPNQYOON-UHFFFAOYSA-N 0 0 377.356 3.421 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cncnc1N1CCCC1 ZINC000186236196 1431359172 /nfs/dbraw/zinc/35/91/72/1431359172.db2.gz BKKJSCYTWZQKPG-UHFFFAOYSA-N 0 0 391.815 3.046 20 5 GGBDRN C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1csc([N+](=O)[O-])c1 ZINC000186301324 1431376102 /nfs/dbraw/zinc/37/61/02/1431376102.db2.gz AEVVSUJWZKTKBO-CYBMUJFWSA-N 0 0 395.506 3.389 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(C(=O)C3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000186314722 1431379779 /nfs/dbraw/zinc/37/97/79/1431379779.db2.gz KFSLIBMQYGAHFV-UHFFFAOYSA-N 0 0 391.493 3.181 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000186316603 1431380214 /nfs/dbraw/zinc/38/02/14/1431380214.db2.gz LLRSHGNUBNDQDX-KRWDZBQOSA-N 0 0 394.786 3.366 20 5 GGBDRN CCCN(CC(=O)OC(C)(C)C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000186320652 1431381472 /nfs/dbraw/zinc/38/14/72/1431381472.db2.gz CGQCGNRVNQLIQC-UHFFFAOYSA-N 0 0 376.413 3.199 20 5 GGBDRN CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186323511 1431382324 /nfs/dbraw/zinc/38/23/24/1431382324.db2.gz FROWKVOVBJEKCK-OAHLLOKOSA-N 0 0 381.860 3.292 20 5 GGBDRN CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186323532 1431382467 /nfs/dbraw/zinc/38/24/67/1431382467.db2.gz FROWKVOVBJEKCK-HNNXBMFYSA-N 0 0 381.860 3.292 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000186328001 1431383770 /nfs/dbraw/zinc/38/37/70/1431383770.db2.gz SXIWSUZQPGTARE-OAHLLOKOSA-N 0 0 379.775 3.183 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(F)cc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186331156 1431384759 /nfs/dbraw/zinc/38/47/59/1431384759.db2.gz WIXIPRHWTXFAQD-UHFFFAOYSA-N 0 0 393.802 3.214 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)C(=O)N(C)C ZINC000186337454 1431386653 /nfs/dbraw/zinc/38/66/53/1431386653.db2.gz YOUBJVMLAKPCNS-LBPRGKRZSA-N 0 0 379.482 3.084 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186343870 1431388005 /nfs/dbraw/zinc/38/80/05/1431388005.db2.gz QQOPQZYLGMPZQZ-OAHLLOKOSA-N 0 0 395.868 3.381 20 5 GGBDRN CCN(C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@H](C)Cc1ccsc1 ZINC000186343509 1431388142 /nfs/dbraw/zinc/38/81/42/1431388142.db2.gz XDUGWTMJGZHWRJ-GFCCVEGCSA-N 0 0 389.433 3.044 20 5 GGBDRN COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)CO2 ZINC000186345167 1431388547 /nfs/dbraw/zinc/38/85/47/1431388547.db2.gz IYXQLEXCKCABIS-ZDUSSCGKSA-N 0 0 376.796 3.124 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186350335 1431389248 /nfs/dbraw/zinc/38/92/48/1431389248.db2.gz RCNKXDPZHXRWHC-JSGCOSHPSA-N 0 0 381.860 3.149 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCCN1C(=O)c1ccco1 ZINC000186349941 1431389356 /nfs/dbraw/zinc/38/93/56/1431389356.db2.gz MNPYKXQEWCCRKR-OAHLLOKOSA-N 0 0 391.811 3.152 20 5 GGBDRN COc1cccc(CO[C@H](C)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186349864 1431389433 /nfs/dbraw/zinc/38/94/33/1431389433.db2.gz YVAXNNDUNAFVTC-GFCCVEGCSA-N 0 0 378.812 3.478 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)[C@@H]1Oc1ccccc1 ZINC000186357040 1431390939 /nfs/dbraw/zinc/39/09/39/1431390939.db2.gz ZKIWXEBCDROPKT-DSKINZAPSA-N 0 0 384.432 3.187 20 5 GGBDRN CS(=O)(=O)CCCCCNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000186402377 1431402658 /nfs/dbraw/zinc/40/26/58/1431402658.db2.gz SZNHIXIGYGQOSQ-UHFFFAOYSA-N 0 0 399.347 3.149 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000186405598 1431405164 /nfs/dbraw/zinc/40/51/64/1431405164.db2.gz YOCTXWNNUNUSOC-UHFFFAOYSA-N 0 0 380.322 3.136 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)cc1[N+](=O)[O-] ZINC000186414026 1431409002 /nfs/dbraw/zinc/40/90/02/1431409002.db2.gz YOYDHMFVAMBDQW-UHFFFAOYSA-N 0 0 376.359 3.305 20 5 GGBDRN C[C@@H](C(=O)NCCCc1nc2ccccc2n1C)c1ccc([N+](=O)[O-])cc1F ZINC000186419102 1431412449 /nfs/dbraw/zinc/41/24/49/1431412449.db2.gz CBDFLRNPVVJLAP-CYBMUJFWSA-N 0 0 384.411 3.473 20 5 GGBDRN COc1cc(CN2CCOC[C@H]2CC(=O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000186427618 1431415388 /nfs/dbraw/zinc/41/53/88/1431415388.db2.gz INRMZCCWOSONPP-MRXNPFEDSA-N 0 0 388.395 3.216 20 5 GGBDRN C[C@@H](C1CC1)n1cc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cn1 ZINC000186452431 1431423607 /nfs/dbraw/zinc/42/36/07/1431423607.db2.gz RNWYFXAKECKQGM-LBPRGKRZSA-N 0 0 399.407 3.089 20 5 GGBDRN CSc1cccc(C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)c1[N+](=O)[O-] ZINC000186475125 1431429560 /nfs/dbraw/zinc/42/95/60/1431429560.db2.gz CEUHFPXELSTJSV-UHFFFAOYSA-N 0 0 396.432 3.422 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(CN3CCC(O)(c4c(F)cccc4F)CC3)nc2c1 ZINC000186507875 1431440847 /nfs/dbraw/zinc/44/08/47/1431440847.db2.gz SEJIRMRUHNCTAS-UHFFFAOYSA-N 0 0 389.358 3.498 20 5 GGBDRN CC(C)c1ccnc(N2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)n1 ZINC000186515013 1431443437 /nfs/dbraw/zinc/44/34/37/1431443437.db2.gz AVUZQLGOYUXZKK-UHFFFAOYSA-N 0 0 389.843 3.124 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)cc([N+](=O)[O-])c1F ZINC000186519974 1431444842 /nfs/dbraw/zinc/44/48/42/1431444842.db2.gz CHBUMIJAMBHMHK-XHDPSFHLSA-N 0 0 379.413 3.209 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)c1C ZINC000186523034 1431445836 /nfs/dbraw/zinc/44/58/36/1431445836.db2.gz WHVVIQIVVQPGCX-SJKOYZFVSA-N 0 0 375.450 3.378 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCS(=O)(=O)c2ccccc2C1 ZINC000186550509 1431451476 /nfs/dbraw/zinc/45/14/76/1431451476.db2.gz IYKHZJVGOMXCGR-UHFFFAOYSA-N 0 0 390.461 3.172 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000186557182 1431453414 /nfs/dbraw/zinc/45/34/14/1431453414.db2.gz LHJUDSSPYTUZNR-LLVKDONJSA-N 0 0 387.421 3.375 20 5 GGBDRN O=C(Nc1ccc(CN2C(=O)CCCC2=O)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000186559495 1431454015 /nfs/dbraw/zinc/45/40/15/1431454015.db2.gz PIRKRJCWIBSQLY-UHFFFAOYSA-N 0 0 385.351 3.025 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(CN2C(=O)CCCC2=O)cc1 ZINC000186592651 1431462785 /nfs/dbraw/zinc/46/27/85/1431462785.db2.gz HHJVLEDOQPEYFG-UHFFFAOYSA-N 0 0 395.415 3.205 20 5 GGBDRN COc1ccc(F)cc1CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000186646334 1431479310 /nfs/dbraw/zinc/47/93/10/1431479310.db2.gz CQOBXJNBRANQOE-UHFFFAOYSA-N 0 0 388.395 3.355 20 5 GGBDRN COc1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1OC(C)C ZINC000186664315 1431484647 /nfs/dbraw/zinc/48/46/47/1431484647.db2.gz TUOPVPNWELRZBW-UHFFFAOYSA-N 0 0 376.413 3.233 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@]4(C3)OCc3ccccc34)n2)c1 ZINC000186698625 1431494546 /nfs/dbraw/zinc/49/45/46/1431494546.db2.gz AZZMDHWALPVZEG-HXUWFJFHSA-N 0 0 378.388 3.276 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)c1ccc([N+](=O)[O-])cc1 ZINC000186717218 1431500281 /nfs/dbraw/zinc/50/02/81/1431500281.db2.gz OOOBQUPVPXFZHM-CQSZACIVSA-N 0 0 393.321 3.149 20 5 GGBDRN C[C@@H](NC(=O)NCc1cc(COC(C)(C)C)on1)c1cccc([N+](=O)[O-])c1 ZINC000186719604 1431501057 /nfs/dbraw/zinc/50/10/57/1431501057.db2.gz ZUSXVHPYAXBXTA-GFCCVEGCSA-N 0 0 376.413 3.458 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000186724466 1431502223 /nfs/dbraw/zinc/50/22/23/1431502223.db2.gz LBWLEHYBKUCERW-ZUZCIYMTSA-N 0 0 391.346 3.062 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000186724446 1431502461 /nfs/dbraw/zinc/50/24/61/1431502461.db2.gz LBWLEHYBKUCERW-BONVTDFDSA-N 0 0 391.346 3.062 20 5 GGBDRN CC(=O)N1CCc2sc(C(=O)COc3cc(C)c([N+](=O)[O-])cc3F)cc2C1 ZINC000186732592 1431504405 /nfs/dbraw/zinc/50/44/05/1431504405.db2.gz WODPHSDBNBJOFB-UHFFFAOYSA-N 0 0 392.408 3.270 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC(c2nc3ccccc3s2)CC1 ZINC000186746159 1431507216 /nfs/dbraw/zinc/50/72/16/1431507216.db2.gz JJDKWTUVNUEWRU-UHFFFAOYSA-N 0 0 384.417 3.325 20 5 GGBDRN Cc1c(C(=O)N(C)CC2(c3ccccc3)CC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000186767804 1431511653 /nfs/dbraw/zinc/51/16/53/1431511653.db2.gz KMZNZQGUAYNLLR-UHFFFAOYSA-N 0 0 391.431 3.288 20 5 GGBDRN Cc1c(CN2CCN(c3nnc(C(F)(F)F)s3)CC2)cccc1[N+](=O)[O-] ZINC000186779253 1431514994 /nfs/dbraw/zinc/51/49/94/1431514994.db2.gz VJHOBLWCWPWYMF-UHFFFAOYSA-N 0 0 387.387 3.096 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000186787218 1431516893 /nfs/dbraw/zinc/51/68/93/1431516893.db2.gz DUUHNYPBDFKMPL-OAHLLOKOSA-N 0 0 375.356 3.428 20 5 GGBDRN Cn1cc([C@@H](NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)cn1 ZINC000186797609 1431519457 /nfs/dbraw/zinc/51/94/57/1431519457.db2.gz CVNJIADUPQONRE-FZBXERKRSA-N 0 0 380.379 3.386 20 5 GGBDRN Cn1cc([C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000186801597 1431520362 /nfs/dbraw/zinc/52/03/62/1431520362.db2.gz VXZFRVKHSCJTNL-HXUWFJFHSA-N 0 0 397.410 3.175 20 5 GGBDRN Cc1oc2ccc(NC(=O)CN3C(=O)COc4ccc([N+](=O)[O-])cc43)cc2c1C ZINC000186814546 1431525254 /nfs/dbraw/zinc/52/52/54/1431525254.db2.gz SKGGRLQGPZFYIU-UHFFFAOYSA-N 0 0 395.371 3.322 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCSC2(CCOCC2)C1 ZINC000186824829 1431529266 /nfs/dbraw/zinc/52/92/66/1431529266.db2.gz JSQQHXYVLSBQNQ-LBPRGKRZSA-N 0 0 399.900 3.173 20 5 GGBDRN Cc1ccc(NCCCNC(=O)C(=O)Nc2ccsc2Cl)c([N+](=O)[O-])c1 ZINC000186850523 1431539992 /nfs/dbraw/zinc/53/99/92/1431539992.db2.gz OEWWJCUTMOOFDK-UHFFFAOYSA-N 0 0 396.856 3.175 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)c1nc(-c2ccccc2)c(C)[nH]1 ZINC000186852101 1431540970 /nfs/dbraw/zinc/54/09/70/1431540970.db2.gz HKMMKHDOEMCGLZ-UHFFFAOYSA-N 0 0 387.417 3.276 20 5 GGBDRN C[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@@H+]1Cc1ccccc1 ZINC000186869927 1431547723 /nfs/dbraw/zinc/54/77/23/1431547723.db2.gz JWUUBQQZSKJRTG-WBVHZDCISA-N 0 0 383.448 3.426 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCN(C2CC2)c2ccccc21 ZINC000186871107 1431548375 /nfs/dbraw/zinc/54/83/75/1431548375.db2.gz UPLLCRVBWAKWCH-UHFFFAOYSA-N 0 0 389.415 3.410 20 5 GGBDRN CSc1cccc(C(=O)NC(C)(C)C(=O)NCC2CCCC2)c1[N+](=O)[O-] ZINC000186871359 1431548619 /nfs/dbraw/zinc/54/86/19/1431548619.db2.gz UKQWEIGNBKYGEI-UHFFFAOYSA-N 0 0 379.482 3.132 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)c1 ZINC000186874058 1431549823 /nfs/dbraw/zinc/54/98/23/1431549823.db2.gz CCTFZAHEIWDIJJ-QGZVFWFLSA-N 0 0 378.331 3.095 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)c1 ZINC000186874039 1431549970 /nfs/dbraw/zinc/54/99/70/1431549970.db2.gz CCTFZAHEIWDIJJ-KRWDZBQOSA-N 0 0 378.331 3.095 20 5 GGBDRN COC(=O)c1scc(C)c1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000186883016 1431553553 /nfs/dbraw/zinc/55/35/53/1431553553.db2.gz FGGQXZLUIABSQR-UHFFFAOYSA-N 0 0 386.389 3.189 20 5 GGBDRN CCc1ccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)cc1[N+](=O)[O-] ZINC000186886226 1431555022 /nfs/dbraw/zinc/55/50/22/1431555022.db2.gz SAWDAGULTQPQTQ-SFHVURJKSA-N 0 0 395.415 3.153 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCSC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000186915904 1431564488 /nfs/dbraw/zinc/56/44/88/1431564488.db2.gz YNJCBVQBXSLCBB-GFCCVEGCSA-N 0 0 386.355 3.267 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186916475 1431564493 /nfs/dbraw/zinc/56/44/93/1431564493.db2.gz STHWOMMNFCLHED-OAQYLSRUSA-N 0 0 379.416 3.441 20 5 GGBDRN COCCC1(CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CCCCC1 ZINC000186925719 1431567863 /nfs/dbraw/zinc/56/78/63/1431567863.db2.gz BGONFHHUYUPUNS-UHFFFAOYSA-N 0 0 391.468 3.253 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000186926019 1431568070 /nfs/dbraw/zinc/56/80/70/1431568070.db2.gz LAWGJPAFDBAWJW-LLVKDONJSA-N 0 0 380.397 3.051 20 5 GGBDRN O=C(CN1CCC(c2ccsc2)CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000186930885 1431568883 /nfs/dbraw/zinc/56/88/83/1431568883.db2.gz DJSSZAOHMWOQQS-UHFFFAOYSA-N 0 0 389.433 3.203 20 5 GGBDRN O=C(NCc1ccc(-c2nc3ccccc3s2)o1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000186931640 1431569452 /nfs/dbraw/zinc/56/94/52/1431569452.db2.gz XPHCSSIEXAEUNB-UHFFFAOYSA-N 0 0 396.384 3.495 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186980187 1431581667 /nfs/dbraw/zinc/58/16/67/1431581667.db2.gz AGEVLKLRMXFVPJ-OAQYLSRUSA-N 0 0 390.399 3.052 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186980208 1431581831 /nfs/dbraw/zinc/58/18/31/1431581831.db2.gz AGEVLKLRMXFVPJ-NRFANRHFSA-N 0 0 390.399 3.052 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(C)c(C)c1 ZINC000186984846 1431583260 /nfs/dbraw/zinc/58/32/60/1431583260.db2.gz NVMPKGHLADULIQ-UGSOOPFHSA-N 0 0 388.395 3.485 20 5 GGBDRN O=C(Nc1ccc(-c2cn3c(n2)CCCC3)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000186993209 1431584698 /nfs/dbraw/zinc/58/46/98/1431584698.db2.gz MZVQAONVEIGTIU-UHFFFAOYSA-N 0 0 379.376 3.148 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nn(C)c2ccccc12 ZINC000187004688 1431587484 /nfs/dbraw/zinc/58/74/84/1431587484.db2.gz VMPOLDCNURQPRM-ZDUSSCGKSA-N 0 0 384.461 3.321 20 5 GGBDRN Cn1nc(CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c2ccccc21 ZINC000187006265 1431587636 /nfs/dbraw/zinc/58/76/36/1431587636.db2.gz LLSFYFFHEBROEO-UHFFFAOYSA-N 0 0 393.447 3.054 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@H](C(N)=O)C1 ZINC000187006134 1431587683 /nfs/dbraw/zinc/58/76/83/1431587683.db2.gz LGULVAOQCNBFCM-ACJLOTCBSA-N 0 0 382.420 3.064 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000187013085 1431589856 /nfs/dbraw/zinc/58/98/56/1431589856.db2.gz CQKOVSSSPLZCGF-TZMCWYRMSA-N 0 0 394.424 3.309 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000187013049 1431589924 /nfs/dbraw/zinc/58/99/24/1431589924.db2.gz CQKOVSSSPLZCGF-OCCSQVGLSA-N 0 0 394.424 3.309 20 5 GGBDRN O=C(Nc1ncc(Cc2ccc(F)cc2F)s1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187015462 1431590651 /nfs/dbraw/zinc/59/06/51/1431590651.db2.gz AIQGPNWQSOGQCL-UHFFFAOYSA-N 0 0 392.343 3.273 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1OC(F)F ZINC000187017055 1431590660 /nfs/dbraw/zinc/59/06/60/1431590660.db2.gz DLPSJTHAJSMFEL-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN COC(=O)[C@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1cc(C)cc(C)c1 ZINC000187026034 1431593662 /nfs/dbraw/zinc/59/36/62/1431593662.db2.gz XMWBRCVPXOWWCY-SCLBCKFNSA-N 0 0 388.395 3.485 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCC1(CO)CCCC1 ZINC000187040038 1431597868 /nfs/dbraw/zinc/59/78/68/1431597868.db2.gz HOEWTRCEIPBHRQ-UHFFFAOYSA-N 0 0 389.374 3.085 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1cnc(-c3ccccc3)nc1)CCC2 ZINC000187051063 1431599919 /nfs/dbraw/zinc/59/99/19/1431599919.db2.gz BZIFOANVPBZTDW-UHFFFAOYSA-N 0 0 396.428 3.193 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCSC[C@@H]3c3nccs3)n2)cc1 ZINC000187053141 1431600545 /nfs/dbraw/zinc/60/05/45/1431600545.db2.gz ASCMYKRQYVPSCY-CYBMUJFWSA-N 0 0 389.462 3.391 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000187148668 1431630785 /nfs/dbraw/zinc/63/07/85/1431630785.db2.gz KPKVSZZOIVZRLK-UHFFFAOYSA-N 0 0 380.404 3.119 20 5 GGBDRN CC[C@@]1(CO)CCCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000187181310 1431639516 /nfs/dbraw/zinc/63/95/16/1431639516.db2.gz WRXBZHKDDWSVFE-GOSISDBHSA-N 0 0 375.450 3.343 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NC1(Cc2ccccc2)CC1 ZINC000187186788 1431640895 /nfs/dbraw/zinc/64/08/95/1431640895.db2.gz IKFRYFUETRGTHH-UHFFFAOYSA-N 0 0 395.415 3.174 20 5 GGBDRN O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187189738 1431641750 /nfs/dbraw/zinc/64/17/50/1431641750.db2.gz VQMDHQBNBSGTRJ-MRXNPFEDSA-N 0 0 384.779 3.263 20 5 GGBDRN O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187189761 1431641879 /nfs/dbraw/zinc/64/18/79/1431641879.db2.gz VQMDHQBNBSGTRJ-INIZCTEOSA-N 0 0 384.779 3.263 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@](C)(CC(=O)OC)c1ccccn1 ZINC000187212723 1431650321 /nfs/dbraw/zinc/65/03/21/1431650321.db2.gz IHBBDUHHAXOYCI-IERDGZPVSA-N 0 0 399.447 3.153 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc2nnc(C3CCC3)n2c1 ZINC000187219586 1431653420 /nfs/dbraw/zinc/65/34/20/1431653420.db2.gz PQBLCLUDDNNKRF-UHFFFAOYSA-N 0 0 380.408 3.346 20 5 GGBDRN CC(C)c1ccc(C(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1[N+](=O)[O-] ZINC000187239132 1431660923 /nfs/dbraw/zinc/66/09/23/1431660923.db2.gz AYERHNLSBZBMRJ-OAHLLOKOSA-N 0 0 398.463 3.268 20 5 GGBDRN CC(C)[C@H]1CCC[C@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000187271935 1431676538 /nfs/dbraw/zinc/67/65/38/1431676538.db2.gz CBTKCTQZFXLPJV-ZFWWWQNUSA-N 0 0 382.482 3.333 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000187275025 1431677610 /nfs/dbraw/zinc/67/76/10/1431677610.db2.gz CTJIWZOOMXNWRX-UHFFFAOYSA-N 0 0 375.812 3.203 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000187304091 1431688813 /nfs/dbraw/zinc/68/88/13/1431688813.db2.gz FWEVELCETSNQDN-UHFFFAOYSA-N 0 0 392.415 3.098 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)Nc2ccc3occ(C)c3c2)cc1[N+](=O)[O-] ZINC000187308086 1431690294 /nfs/dbraw/zinc/69/02/94/1431690294.db2.gz CAEXFYXDKHGBOG-UHFFFAOYSA-N 0 0 383.360 3.027 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cc(Cl)ccc1OC1CCCC1 ZINC000187309095 1431690965 /nfs/dbraw/zinc/69/09/65/1431690965.db2.gz APIRIEBKVXTFBM-UHFFFAOYSA-N 0 0 391.811 3.370 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@](C)(CC(=O)OC)c1ccncc1 ZINC000187340182 1431702517 /nfs/dbraw/zinc/70/25/17/1431702517.db2.gz PNQYLXJTWJPNDE-KKSFZXQISA-N 0 0 399.447 3.153 20 5 GGBDRN CC[C@H]1[C@H](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1I ZINC000187426739 1431726506 /nfs/dbraw/zinc/72/65/06/1431726506.db2.gz JIQKINXJBSVCLY-RNCFNFMXSA-N 0 0 388.205 3.460 20 5 GGBDRN COC(=O)C[C@@](C)(NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccncc1 ZINC000187348507 1431704798 /nfs/dbraw/zinc/70/47/98/1431704798.db2.gz JBDKXEFNGUWTCC-LJQANCHMSA-N 0 0 399.428 3.413 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000187369178 1431711093 /nfs/dbraw/zinc/71/10/93/1431711093.db2.gz BANNNPGUVURUGT-UHFFFAOYSA-N 0 0 391.811 3.290 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccccn1 ZINC000187390131 1431716874 /nfs/dbraw/zinc/71/68/74/1431716874.db2.gz IXPCNLXTNFYHAU-LJQANCHMSA-N 0 0 378.388 3.100 20 5 GGBDRN Cn1cc([C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000187394410 1431717937 /nfs/dbraw/zinc/71/79/37/1431717937.db2.gz QXKRLLMUQVDKAI-GOSISDBHSA-N 0 0 383.383 3.056 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000187402699 1431719932 /nfs/dbraw/zinc/71/99/32/1431719932.db2.gz UFWAKYYQIUELMB-IUODEOHRSA-N 0 0 394.424 3.309 20 5 GGBDRN CC[C@@H]1[C@@H](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1I ZINC000187426754 1431726462 /nfs/dbraw/zinc/72/64/62/1431726462.db2.gz JIQKINXJBSVCLY-TVQRCGJNSA-N 0 0 388.205 3.460 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000187430913 1431727434 /nfs/dbraw/zinc/72/74/34/1431727434.db2.gz LFVDSNWGULYEIC-LLVKDONJSA-N 0 0 394.353 3.205 20 5 GGBDRN Cn1cc([C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)cn1 ZINC000187451364 1431734035 /nfs/dbraw/zinc/73/40/35/1431734035.db2.gz GFDYVYSOOBYSLG-SFHVURJKSA-N 0 0 383.383 3.056 20 5 GGBDRN COCCC1(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CCCCC1 ZINC000187496409 1431748277 /nfs/dbraw/zinc/74/82/77/1431748277.db2.gz OFAJKBIOOXJNGA-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN COc1ccc(Cn2ccc(N[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000187519103 1431755028 /nfs/dbraw/zinc/75/50/28/1431755028.db2.gz NHZRWUHFQSUIFP-CQSZACIVSA-N 0 0 395.419 3.287 20 5 GGBDRN CN(CC1(c2ccccc2)CC1)C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000187531134 1431758351 /nfs/dbraw/zinc/75/83/51/1431758351.db2.gz VPOFHOGKHLPMPJ-UHFFFAOYSA-N 0 0 387.823 3.377 20 5 GGBDRN CCOc1ccc2c(c1)[C@@H](NC(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)CCO2 ZINC000187535281 1431759248 /nfs/dbraw/zinc/75/92/48/1431759248.db2.gz XMLVBTHPFOBTJA-HNNXBMFYSA-N 0 0 382.376 3.123 20 5 GGBDRN O=C(NC1(Cc2cccc(F)c2)CCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000187556011 1431765906 /nfs/dbraw/zinc/76/59/06/1431765906.db2.gz BBKQLNGXENNGPD-UHFFFAOYSA-N 0 0 395.394 3.210 20 5 GGBDRN CC[C@]1(CO)CCCN(Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000187569929 1431770310 /nfs/dbraw/zinc/77/03/10/1431770310.db2.gz XNSQASLOVIUZKY-SFHVURJKSA-N 0 0 388.411 3.232 20 5 GGBDRN CC[C@@]1(CO)CCCN(Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000187569943 1431770336 /nfs/dbraw/zinc/77/03/36/1431770336.db2.gz XNSQASLOVIUZKY-GOSISDBHSA-N 0 0 388.411 3.232 20 5 GGBDRN Cc1ccc2c(c1)nc(CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)n2C ZINC000187586746 1431773452 /nfs/dbraw/zinc/77/34/52/1431773452.db2.gz OFORXBHUKJDFIA-UHFFFAOYSA-N 0 0 390.447 3.480 20 5 GGBDRN CCOC(=O)C[C@](C)(NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(C)C ZINC000187591960 1431774691 /nfs/dbraw/zinc/77/46/91/1431774691.db2.gz QKCPGMNWHLDKJW-FQEVSTJZSA-N 0 0 391.468 3.293 20 5 GGBDRN CCOC(=O)C[C@@](C)(NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(C)C ZINC000187591978 1431774854 /nfs/dbraw/zinc/77/48/54/1431774854.db2.gz QKCPGMNWHLDKJW-HXUWFJFHSA-N 0 0 391.468 3.293 20 5 GGBDRN Cn1cc([C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)cn1 ZINC000187595053 1431775652 /nfs/dbraw/zinc/77/56/52/1431775652.db2.gz XVTSQTJWEBPGKZ-IBGZPJMESA-N 0 0 397.410 3.099 20 5 GGBDRN Cc1noc(-c2ccccc2)c1NC(=O)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000187616404 1431779712 /nfs/dbraw/zinc/77/97/12/1431779712.db2.gz DOHKIQXQVYZERR-UHFFFAOYSA-N 0 0 394.387 3.155 20 5 GGBDRN Cc1ccc2c(CCNC(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)cn(C)c2c1 ZINC000187619982 1431780560 /nfs/dbraw/zinc/78/05/60/1431780560.db2.gz LFIXBZOQNWOAGJ-UHFFFAOYSA-N 0 0 394.431 3.001 20 5 GGBDRN CC(C)C(C)(C)CNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000187625823 1431781405 /nfs/dbraw/zinc/78/14/05/1431781405.db2.gz LOJFGXKJFNMVJD-UHFFFAOYSA-N 0 0 377.470 3.287 20 5 GGBDRN CC(C)(C)OCc1cc(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)no1 ZINC000187629926 1431782872 /nfs/dbraw/zinc/78/28/72/1431782872.db2.gz MBJDBRRCMNLGOY-UHFFFAOYSA-N 0 0 399.407 3.014 20 5 GGBDRN CC(C)(C)OCc1cc(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000187641094 1431786011 /nfs/dbraw/zinc/78/60/11/1431786011.db2.gz GIIIPPGERFTZFZ-UHFFFAOYSA-N 0 0 386.408 3.238 20 5 GGBDRN CC(C)(C)OCc1cc(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)no1 ZINC000187646126 1431787011 /nfs/dbraw/zinc/78/70/11/1431787011.db2.gz VVVUGMWENZPETF-UHFFFAOYSA-N 0 0 399.407 3.014 20 5 GGBDRN CC(C)(C)OCc1cc(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)no1 ZINC000187650836 1431788097 /nfs/dbraw/zinc/78/80/97/1431788097.db2.gz UCZKYYPZEIZIER-UHFFFAOYSA-N 0 0 379.438 3.306 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1 ZINC000187668314 1431795129 /nfs/dbraw/zinc/79/51/29/1431795129.db2.gz MBDSUDLQCQPLGU-LLVKDONJSA-N 0 0 395.341 3.409 20 5 GGBDRN Cn1cc([C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)c2ccc(F)cc2)cn1 ZINC000187674569 1431797207 /nfs/dbraw/zinc/79/72/07/1431797207.db2.gz BGSBSHOXCMCUIM-GOSISDBHSA-N 0 0 383.383 3.056 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187677991 1431797586 /nfs/dbraw/zinc/79/75/86/1431797586.db2.gz BUWJPLKCBQQLNK-MLGOLLRUSA-N 0 0 379.482 3.148 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CSC[C@@H]2C(=O)NC(C)(C)C)cc1[N+](=O)[O-] ZINC000187680417 1431798585 /nfs/dbraw/zinc/79/85/85/1431798585.db2.gz FDMKZEXQWVSTKL-OAHLLOKOSA-N 0 0 379.482 3.148 20 5 GGBDRN CCCCNC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187678122 1431798682 /nfs/dbraw/zinc/79/86/82/1431798682.db2.gz DUMZBJMAVKCXRJ-INIZCTEOSA-N 0 0 379.482 3.150 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000187686894 1431800155 /nfs/dbraw/zinc/80/01/55/1431800155.db2.gz IIBZVAZAOVCGKY-IAQYHMDHSA-N 0 0 392.399 3.287 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1[N+](=O)[O-] ZINC000187759902 1431809232 /nfs/dbraw/zinc/80/92/32/1431809232.db2.gz OPUOBFSTIAFAKF-OAHLLOKOSA-N 0 0 395.415 3.176 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCc2cccc(C(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000187773301 1431810563 /nfs/dbraw/zinc/81/05/63/1431810563.db2.gz QRJHTJWUFFOHJL-UHFFFAOYSA-N 0 0 383.448 3.393 20 5 GGBDRN COC(=O)c1ccc(OCc2noc(-c3ccc(F)cc3F)n2)c([N+](=O)[O-])c1 ZINC000187784978 1431812020 /nfs/dbraw/zinc/81/20/20/1431812020.db2.gz VDRBBDIMHWOZNU-UHFFFAOYSA-N 0 0 391.286 3.289 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)c2ccccc2S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000187812999 1431815464 /nfs/dbraw/zinc/81/54/64/1431815464.db2.gz UHHJXPZXDFWORL-UHFFFAOYSA-N 0 0 376.434 3.398 20 5 GGBDRN COc1ccc(OC)c([C@H]2C[C@H]2C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000187819137 1431816185 /nfs/dbraw/zinc/81/61/85/1431816185.db2.gz VUZBLVTXBKVPMF-TZMCWYRMSA-N 0 0 382.376 3.231 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])[C@@H]1Oc1ccccc1 ZINC000187851683 1431820086 /nfs/dbraw/zinc/82/00/86/1431820086.db2.gz QAQODZFUZBBQPC-RLLQIKCJSA-N 0 0 399.447 3.361 20 5 GGBDRN CC(=O)Nc1cccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1C ZINC000187898252 1431825247 /nfs/dbraw/zinc/82/52/47/1431825247.db2.gz GMISLINKEBRECP-UHFFFAOYSA-N 0 0 379.376 3.300 20 5 GGBDRN COc1cc(C)c(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1F ZINC000187899442 1431825491 /nfs/dbraw/zinc/82/54/91/1431825491.db2.gz SYRTZJGLYASDNM-UHFFFAOYSA-N 0 0 375.356 3.245 20 5 GGBDRN COC(=O)c1cc(NC(=O)CCc2ncc(C(C)(C)C)o2)cc([N+](=O)[O-])c1 ZINC000187998628 1431835058 /nfs/dbraw/zinc/83/50/58/1431835058.db2.gz RCEBVIIRRYOJIT-UHFFFAOYSA-N 0 0 375.381 3.238 20 5 GGBDRN CCC(CC)[C@@H](CNC(=O)c1cccc(SC)c1[N+](=O)[O-])N1CCOCC1 ZINC000188032056 1431838205 /nfs/dbraw/zinc/83/82/05/1431838205.db2.gz SSBXPVOALFAURJ-MRXNPFEDSA-N 0 0 395.525 3.184 20 5 GGBDRN O=C(NCCc1ccccc1OC(F)F)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000188035753 1431838306 /nfs/dbraw/zinc/83/83/06/1431838306.db2.gz JWGWPYWINAPLNM-UHFFFAOYSA-N 0 0 376.319 3.045 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1 ZINC000188056165 1431840721 /nfs/dbraw/zinc/84/07/21/1431840721.db2.gz IRUMQLPBOCXQAU-LLVKDONJSA-N 0 0 398.250 3.034 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1F)NC[C@H]1CCN(c2ccccc2)C1 ZINC000188084967 1431844530 /nfs/dbraw/zinc/84/45/30/1431844530.db2.gz XYCOZVDEIMZTMD-CQSZACIVSA-N 0 0 389.452 3.469 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000188087038 1431844828 /nfs/dbraw/zinc/84/48/28/1431844828.db2.gz GISDJLJSVBMZJN-UHFFFAOYSA-N 0 0 377.422 3.342 20 5 GGBDRN CCn1c(S[C@H](C)c2nnnn2C2CC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000188091647 1431845322 /nfs/dbraw/zinc/84/53/22/1431845322.db2.gz DQJFAOGXHSWPDB-SNVBAGLBSA-N 0 0 386.441 3.048 20 5 GGBDRN CC(C)c1ccc(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc1[N+](=O)[O-] ZINC000188095036 1431845868 /nfs/dbraw/zinc/84/58/68/1431845868.db2.gz KNHRRQLOQPJCHQ-UHFFFAOYSA-N 0 0 385.420 3.346 20 5 GGBDRN COC(=O)[C@H]1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000188105464 1431847250 /nfs/dbraw/zinc/84/72/50/1431847250.db2.gz NYHATMAHQRFMKY-LRDDRELGSA-N 0 0 375.450 3.349 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000188120259 1431849518 /nfs/dbraw/zinc/84/95/18/1431849518.db2.gz RHDFGTRCEISNEB-SJORKVTESA-N 0 0 381.432 3.369 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000188125022 1431850056 /nfs/dbraw/zinc/85/00/56/1431850056.db2.gz UGGKERRQHVHSGM-UHFFFAOYSA-N 0 0 391.449 3.020 20 5 GGBDRN CCCN1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC1=O ZINC000188141365 1431852150 /nfs/dbraw/zinc/85/21/50/1431852150.db2.gz PUBAHEJRFJGJPB-UHFFFAOYSA-N 0 0 379.482 3.180 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188140121 1431852242 /nfs/dbraw/zinc/85/22/42/1431852242.db2.gz HFRKSKCKEQTHCG-DLBZAZTESA-N 0 0 381.432 3.369 20 5 GGBDRN CSc1cccc(C(=O)NCCc2nc3cc(F)ccc3n2C)c1[N+](=O)[O-] ZINC000188146839 1431852963 /nfs/dbraw/zinc/85/29/63/1431852963.db2.gz XHZHYLQZTWRLBP-UHFFFAOYSA-N 0 0 388.424 3.315 20 5 GGBDRN O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000188158413 1431854375 /nfs/dbraw/zinc/85/43/75/1431854375.db2.gz ANGWAONTNFWXKQ-UHFFFAOYSA-N 0 0 381.310 3.176 20 5 GGBDRN CCCOc1ccc(CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000188161740 1431854913 /nfs/dbraw/zinc/85/49/13/1431854913.db2.gz WWVLSHZGGTUWJI-UHFFFAOYSA-N 0 0 385.420 3.255 20 5 GGBDRN Cn1nc(CCNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000188166277 1431855382 /nfs/dbraw/zinc/85/53/82/1431855382.db2.gz ZFTOBMNTWGGBNX-UHFFFAOYSA-N 0 0 395.463 3.346 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1ccn(-c2ccccc2F)n1 ZINC000188196231 1431859517 /nfs/dbraw/zinc/85/95/17/1431859517.db2.gz CAFLQXCRFGDJMP-UHFFFAOYSA-N 0 0 391.362 3.192 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@H](c2ccccc2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000188219444 1431862381 /nfs/dbraw/zinc/86/23/81/1431862381.db2.gz JWZUTVGNKXETSF-CQSZACIVSA-N 0 0 395.337 3.304 20 5 GGBDRN COC(=O)C[C@](C)(NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000188253623 1431865894 /nfs/dbraw/zinc/86/58/94/1431865894.db2.gz QRZCENJCOMOXHN-FQEVSTJZSA-N 0 0 385.420 3.322 20 5 GGBDRN O=C(c1c[nH]nc1-c1ccsc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000188273400 1431868158 /nfs/dbraw/zinc/86/81/58/1431868158.db2.gz ZBUYREFRDWQHPI-UHFFFAOYSA-N 0 0 383.433 3.009 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000188292734 1431870162 /nfs/dbraw/zinc/87/01/62/1431870162.db2.gz HQJQOXWUEOQMFM-UHFFFAOYSA-N 0 0 380.326 3.307 20 5 GGBDRN CSc1cccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c1[N+](=O)[O-] ZINC000188297362 1431870783 /nfs/dbraw/zinc/87/07/83/1431870783.db2.gz UVOQFPSRUUJOLI-ZDUSSCGKSA-N 0 0 385.445 3.131 20 5 GGBDRN COc1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c(OC(C)C)c1 ZINC000188301385 1431871082 /nfs/dbraw/zinc/87/10/82/1431871082.db2.gz ISCKVGYOIGJEDV-UHFFFAOYSA-N 0 0 399.447 3.353 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1Oc1ccccc1 ZINC000188313188 1431872098 /nfs/dbraw/zinc/87/20/98/1431872098.db2.gz AQYPCTHQMXMJGX-QRQLOZEOSA-N 0 0 385.420 3.019 20 5 GGBDRN CCOc1cccc2[nH]cc(CC(=O)NCc3cc([N+](=O)[O-])ccc3OC)c21 ZINC000188329271 1431873842 /nfs/dbraw/zinc/87/38/42/1431873842.db2.gz SJLNXSRHWGOQQP-UHFFFAOYSA-N 0 0 383.404 3.342 20 5 GGBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000188335652 1431874264 /nfs/dbraw/zinc/87/42/64/1431874264.db2.gz JUDVLZRKXIPWEI-YVEFUNNKSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000188335579 1431874280 /nfs/dbraw/zinc/87/42/80/1431874280.db2.gz JUDVLZRKXIPWEI-PXAZEXFGSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000188336723 1431874609 /nfs/dbraw/zinc/87/46/09/1431874609.db2.gz ZJIPAEGFZDJFCN-MLGOLLRUSA-N 0 0 396.852 3.399 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CNC(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000188349732 1431875914 /nfs/dbraw/zinc/87/59/14/1431875914.db2.gz GJVBGXGWICSXFW-UHFFFAOYSA-N 0 0 379.388 3.031 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC[C@H]2c2nc3ccccc3n2CC)c1[N+](=O)[O-] ZINC000188355462 1431876355 /nfs/dbraw/zinc/87/63/55/1431876355.db2.gz NDVDVPPDOCOIHH-HNNXBMFYSA-N 0 0 382.424 3.227 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(COc2ccccc2F)no1 ZINC000188356489 1431876508 /nfs/dbraw/zinc/87/65/08/1431876508.db2.gz UCOHKOFDAXLNLO-LLVKDONJSA-N 0 0 386.339 3.187 20 5 GGBDRN COc1ccc(F)c(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)c1OC ZINC000188367280 1431877650 /nfs/dbraw/zinc/87/76/50/1431877650.db2.gz RKJIBILKSTZLHF-UHFFFAOYSA-N 0 0 386.339 3.394 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000188412420 1431882137 /nfs/dbraw/zinc/88/21/37/1431882137.db2.gz XBDQRYBUYCBKOG-KRWDZBQOSA-N 0 0 378.331 3.095 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccccc2NC(=O)Cc2cccs2)c1[N+](=O)[O-] ZINC000188437860 1431884175 /nfs/dbraw/zinc/88/41/75/1431884175.db2.gz LQXXYSJOUVRLAV-UHFFFAOYSA-N 0 0 399.432 3.375 20 5 GGBDRN C[C@@H](NC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000188442581 1431884293 /nfs/dbraw/zinc/88/42/93/1431884293.db2.gz UGGGROVWJVUJCH-BDJLRTHQSA-N 0 0 382.338 3.394 20 5 GGBDRN C[C@H](NC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000188442603 1431884406 /nfs/dbraw/zinc/88/44/06/1431884406.db2.gz UGGGROVWJVUJCH-ZBEGNZNMSA-N 0 0 382.338 3.394 20 5 GGBDRN Cc1ccc(-c2ocnc2C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000188449748 1431885074 /nfs/dbraw/zinc/88/50/74/1431885074.db2.gz KUONQNORGNTQQK-UHFFFAOYSA-N 0 0 379.372 3.462 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1C[C@H]2OCCC[C@H]12 ZINC000188460235 1431886044 /nfs/dbraw/zinc/88/60/44/1431886044.db2.gz ZDZYSPBKHUVLDA-UXIGCNINSA-N 0 0 387.358 3.099 20 5 GGBDRN O=C(c1cccn1Cc1cccs1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188462704 1431886195 /nfs/dbraw/zinc/88/61/95/1431886195.db2.gz KICADAVUAOLKPH-UHFFFAOYSA-N 0 0 383.429 3.410 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCCN2S(=O)(=O)c1cnc(-c2ccccc2)nc1 ZINC000188486638 1431888493 /nfs/dbraw/zinc/88/84/93/1431888493.db2.gz PSKKHOXCWMPNTJ-UHFFFAOYSA-N 0 0 396.428 3.193 20 5 GGBDRN O=C(NCc1ccc(OC(F)F)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188502294 1431889730 /nfs/dbraw/zinc/88/97/30/1431889730.db2.gz OWZNEPXQPFDBBB-UHFFFAOYSA-N 0 0 393.346 3.169 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@](C)(C(=O)OC)c1ccccc1 ZINC000188505072 1431889883 /nfs/dbraw/zinc/88/98/83/1431889883.db2.gz GNMFWXNVZTUYMR-HTAPYJJXSA-N 0 0 398.459 3.411 20 5 GGBDRN Cc1ccc(-c2nc(CC(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)cs2)o1 ZINC000188517756 1431891261 /nfs/dbraw/zinc/89/12/61/1431891261.db2.gz PNJKQSQPNOXJCR-UHFFFAOYSA-N 0 0 399.428 3.452 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2OCCC[C@H]12 ZINC000188529024 1431892193 /nfs/dbraw/zinc/89/21/93/1431892193.db2.gz LXFMLSPEQFRXML-WZRBSPASSA-N 0 0 390.383 3.389 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1Oc1ccccc1 ZINC000188537068 1431893090 /nfs/dbraw/zinc/89/30/90/1431893090.db2.gz YGBOAOZAJIQLMV-QRVBRYPASA-N 0 0 385.420 3.019 20 5 GGBDRN COc1cc(C(=O)N(C)CC(=O)Nc2cccc(Cl)c2)cc([N+](=O)[O-])c1C ZINC000188548572 1431894063 /nfs/dbraw/zinc/89/40/63/1431894063.db2.gz AKCUAFSHOUOOEN-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN O=C(c1csc(-c2ccccn2)n1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188548481 1431894101 /nfs/dbraw/zinc/89/41/01/1431894101.db2.gz UMFLLQVSDZMULZ-UHFFFAOYSA-N 0 0 382.401 3.017 20 5 GGBDRN CCOc1cc(OCC(=O)NC[C@H]2CCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000188583168 1431897236 /nfs/dbraw/zinc/89/72/36/1431897236.db2.gz UAIMIYPIBVLWLX-MRXNPFEDSA-N 0 0 399.447 3.015 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000188605463 1431899344 /nfs/dbraw/zinc/89/93/44/1431899344.db2.gz LIDIUJKOLPXTER-UHFFFAOYSA-N 0 0 396.447 3.484 20 5 GGBDRN CCC1(CC)CCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)CC1 ZINC000188608549 1431899637 /nfs/dbraw/zinc/89/96/37/1431899637.db2.gz DEHPEAARVLLZKX-UHFFFAOYSA-N 0 0 375.469 3.474 20 5 GGBDRN CCC1(CC)CCN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000188616898 1431903185 /nfs/dbraw/zinc/90/31/85/1431903185.db2.gz XSIZGGIZXQDZJZ-UHFFFAOYSA-N 0 0 379.482 3.215 20 5 GGBDRN COc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c(OCc2ccccc2)c1 ZINC000188618139 1431903789 /nfs/dbraw/zinc/90/37/89/1431903789.db2.gz YNWFVVXCHAOCBV-UHFFFAOYSA-N 0 0 382.376 3.018 20 5 GGBDRN COc1ccc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)c(OCc2ccccc2)c1 ZINC000188622123 1431905492 /nfs/dbraw/zinc/90/54/92/1431905492.db2.gz PQTWQGZPLCDLHA-UHFFFAOYSA-N 0 0 396.403 3.477 20 5 GGBDRN COc1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)c(OCc2ccccc2)c1 ZINC000188621958 1431905777 /nfs/dbraw/zinc/90/57/77/1431905777.db2.gz HJMGPNRRVGGTOI-UHFFFAOYSA-N 0 0 382.376 3.018 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cc(Cl)ccc2F)C1=O ZINC000188665136 1431925157 /nfs/dbraw/zinc/92/51/57/1431925157.db2.gz OBSSNEWGKPGWEK-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000188686621 1431933630 /nfs/dbraw/zinc/93/36/30/1431933630.db2.gz CHGDGAJPRMWCAR-UHFFFAOYSA-N 0 0 398.329 3.496 20 5 GGBDRN COc1cc(C(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)cc([N+](=O)[O-])c1C ZINC000188710135 1431941647 /nfs/dbraw/zinc/94/16/47/1431941647.db2.gz TUTIMHFRJFSFIH-QWVSSGJLSA-N 0 0 390.461 3.482 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000188761743 1431963376 /nfs/dbraw/zinc/96/33/76/1431963376.db2.gz JNUBHOJLZATDCA-GOSISDBHSA-N 0 0 376.796 3.109 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000188766512 1431965289 /nfs/dbraw/zinc/96/52/89/1431965289.db2.gz FIMRUJLGUZLXDE-SFHVURJKSA-N 0 0 376.796 3.109 20 5 GGBDRN CCn1cnnc1-c1ccccc1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000188773577 1431968331 /nfs/dbraw/zinc/96/83/31/1431968331.db2.gz IAUNMSQYJLVBLH-UHFFFAOYSA-N 0 0 381.392 3.443 20 5 GGBDRN C[C@@H]1CCC[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000188796180 1431978016 /nfs/dbraw/zinc/97/80/16/1431978016.db2.gz RNIHBXDAZLVJDC-RDBSUJKOSA-N 0 0 379.482 3.346 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](CC(N)=O)c1cccc(Cl)c1 ZINC000188842342 1431995424 /nfs/dbraw/zinc/99/54/24/1431995424.db2.gz RXGWLWZHVWYNQZ-OAHLLOKOSA-N 0 0 376.800 3.295 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc([N+](=O)[O-])c1C ZINC000188847846 1431996653 /nfs/dbraw/zinc/99/66/53/1431996653.db2.gz OZHQSURGBOITSR-LBPRGKRZSA-N 0 0 383.404 3.288 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCN(C2CC2)c2ccccc21 ZINC000188869293 1432001626 /nfs/dbraw/zinc/00/16/26/1432001626.db2.gz IIPRBFZWDHSMAC-UHFFFAOYSA-N 0 0 393.852 3.426 20 5 GGBDRN CSc1cccc(C(=O)NCCc2nc3c(cccc3F)n2C)c1[N+](=O)[O-] ZINC000188905509 1432005746 /nfs/dbraw/zinc/00/57/46/1432005746.db2.gz AFIRZAQKCAUERE-UHFFFAOYSA-N 0 0 388.424 3.315 20 5 GGBDRN Cc1ccc(-c2ncccc2NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)s1 ZINC000188943824 1432013535 /nfs/dbraw/zinc/01/35/35/1432013535.db2.gz DIYXODITUNRDFQ-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1cc(Cl)ccc1F ZINC000188953852 1432015773 /nfs/dbraw/zinc/01/57/73/1432015773.db2.gz SXTYANVVINEKQE-UHFFFAOYSA-N 0 0 399.769 3.331 20 5 GGBDRN CCCCNC(=O)C1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000189012606 1432026695 /nfs/dbraw/zinc/02/66/95/1432026695.db2.gz DSNVVFPEINZAJO-UHFFFAOYSA-N 0 0 375.469 3.487 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NC(C)(C)Cc1ccc(C(F)(F)F)cc1 ZINC000189029058 1432029885 /nfs/dbraw/zinc/02/98/85/1432029885.db2.gz BEDOWPUGLVBCAP-UHFFFAOYSA-N 0 0 384.358 3.256 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2nc(CN3CCOCC3)cs2)cc1[N+](=O)[O-] ZINC000189060813 1432037294 /nfs/dbraw/zinc/03/72/94/1432037294.db2.gz VGYAVOTUYNJHCZ-UHFFFAOYSA-N 0 0 390.465 3.259 20 5 GGBDRN O=C(NCc1cccc2cccnc21)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000189132177 1432049948 /nfs/dbraw/zinc/04/99/48/1432049948.db2.gz CSTPQCIKMOPBMA-UHFFFAOYSA-N 0 0 378.388 3.116 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)cc([N+](=O)[O-])c1C ZINC000189148583 1432052430 /nfs/dbraw/zinc/05/24/30/1432052430.db2.gz MJHZYKHQJICKHM-UHFFFAOYSA-N 0 0 375.356 3.005 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1Cl ZINC000189155262 1432053691 /nfs/dbraw/zinc/05/36/91/1432053691.db2.gz VEEWKEMJNFQTND-UHFFFAOYSA-N 0 0 377.784 3.177 20 5 GGBDRN CCOC(=O)[C@](C)(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000189155711 1432053980 /nfs/dbraw/zinc/05/39/80/1432053980.db2.gz WWOMKKQAGZJBAZ-LJQANCHMSA-N 0 0 390.823 3.499 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000189162642 1432055549 /nfs/dbraw/zinc/05/55/49/1432055549.db2.gz OQVZXZTVXPTOPD-LLVKDONJSA-N 0 0 384.358 3.429 20 5 GGBDRN CCOC(=O)[C@](C)(CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000189161967 1432055826 /nfs/dbraw/zinc/05/58/26/1432055826.db2.gz URVRQWPMAMEUPV-LJQANCHMSA-N 0 0 390.823 3.499 20 5 GGBDRN CCC1(CC)CCN(C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)CC1 ZINC000189235716 1432068847 /nfs/dbraw/zinc/06/88/47/1432068847.db2.gz CAJUNWJKIMXBBQ-UHFFFAOYSA-N 0 0 398.463 3.492 20 5 GGBDRN C[C@@H]1CCC[C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1 ZINC000189252542 1432072231 /nfs/dbraw/zinc/07/22/31/1432072231.db2.gz UQMBZMHSTGZFAD-KGLIPLIRSA-N 0 0 375.425 3.368 20 5 GGBDRN Cc1cc2nc(C)c(CCC(=O)OCc3ncc(C)c([N+](=O)[O-])c3C)c(C)n2n1 ZINC000189257536 1432072498 /nfs/dbraw/zinc/07/24/98/1432072498.db2.gz DEJVQHVQRNDMDK-UHFFFAOYSA-N 0 0 397.435 3.251 20 5 GGBDRN C[C@H](CCNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])CC(C)(C)C ZINC000189257641 1432072589 /nfs/dbraw/zinc/07/25/89/1432072589.db2.gz UUKKNVWZDNRTOA-GFCCVEGCSA-N 0 0 381.498 3.364 20 5 GGBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000189263021 1432073869 /nfs/dbraw/zinc/07/38/69/1432073869.db2.gz JLRMWODTEDPKPK-INIZCTEOSA-N 0 0 382.351 3.173 20 5 GGBDRN COc1ccc(Cn2ccc(NCc3cc(OC)c(O)cc3[N+](=O)[O-])n2)cc1 ZINC000189266107 1432074339 /nfs/dbraw/zinc/07/43/39/1432074339.db2.gz YHQYLBSRSROTIG-UHFFFAOYSA-N 0 0 384.392 3.175 20 5 GGBDRN CC(C)c1nnc2ccc(NC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)cn21 ZINC000189270272 1432075168 /nfs/dbraw/zinc/07/51/68/1432075168.db2.gz ZMSUBSKUGKDTFL-UHFFFAOYSA-N 0 0 391.391 3.199 20 5 GGBDRN COc1cc(CNc2nnc(C(F)F)o2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000189275503 1432076326 /nfs/dbraw/zinc/07/63/26/1432076326.db2.gz HYFFRHVQKYAKOC-UHFFFAOYSA-N 0 0 398.244 3.477 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCC1CCN(CC(F)(F)F)CC1 ZINC000189296906 1432080793 /nfs/dbraw/zinc/08/07/93/1432080793.db2.gz FARYIRITBAZMSK-UHFFFAOYSA-N 0 0 398.385 3.009 20 5 GGBDRN Cc1csc([C@H]2COCCN2CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000189302942 1432081987 /nfs/dbraw/zinc/08/19/87/1432081987.db2.gz VZVKDNSBQRWKHB-CQSZACIVSA-N 0 0 396.856 3.025 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@H]3CCC(=O)c4cccc2c43)c1[N+](=O)[O-] ZINC000189328684 1432087311 /nfs/dbraw/zinc/08/73/11/1432087311.db2.gz JIJWWHJUDTZSDU-CYBMUJFWSA-N 0 0 386.429 3.481 20 5 GGBDRN O=C(NCc1ccc(Cl)cc1F)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000189379185 1432096175 /nfs/dbraw/zinc/09/61/75/1432096175.db2.gz DOMUUERCZGNSJC-UHFFFAOYSA-N 0 0 393.802 3.154 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)cc([N+](=O)[O-])c1C ZINC000189386324 1432097280 /nfs/dbraw/zinc/09/72/80/1432097280.db2.gz PLXMXLHKNLZTEZ-GFCCVEGCSA-N 0 0 382.376 3.453 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000189404390 1432099685 /nfs/dbraw/zinc/09/96/85/1432099685.db2.gz CMCYQZDKOZBEGJ-LLVKDONJSA-N 0 0 377.347 3.464 20 5 GGBDRN O=C(Nc1ccsc1Cl)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000189410815 1432101400 /nfs/dbraw/zinc/10/14/00/1432101400.db2.gz WQBUSRBRXAYJED-UHFFFAOYSA-N 0 0 394.840 3.300 20 5 GGBDRN CC(=O)N1CCN(Cc2ccccc2NCc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000189450506 1432115189 /nfs/dbraw/zinc/11/51/89/1432115189.db2.gz IRZXIGYNYTYKGI-UHFFFAOYSA-N 0 0 382.464 3.179 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCSC[C@@H]2c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000189465759 1432121617 /nfs/dbraw/zinc/12/16/17/1432121617.db2.gz WMNDXMVWOSLUTR-SUMWQHHRSA-N 0 0 389.481 3.197 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000189465708 1432121741 /nfs/dbraw/zinc/12/17/41/1432121741.db2.gz QLXKEOJTCLKRFQ-SFHVURJKSA-N 0 0 381.432 3.335 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000189477481 1432127464 /nfs/dbraw/zinc/12/74/64/1432127464.db2.gz WWMDTIWPUDHUON-FQEVSTJZSA-N 0 0 394.431 3.110 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@H](C)[C@@H]2CO)cc1[N+](=O)[O-])c1ccccn1 ZINC000189487338 1432132202 /nfs/dbraw/zinc/13/22/02/1432132202.db2.gz ZQYUHKWCMJZVPI-NJSLBKSFSA-N 0 0 384.436 3.006 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@H](C)[C@H]2CO)cc1[N+](=O)[O-])c1ccccn1 ZINC000189487298 1432132600 /nfs/dbraw/zinc/13/26/00/1432132600.db2.gz ZQYUHKWCMJZVPI-CKFHNAJUSA-N 0 0 384.436 3.006 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)cc([N+](=O)[O-])c1C ZINC000189515667 1432144710 /nfs/dbraw/zinc/14/47/10/1432144710.db2.gz LDUJEMQEZDFSDX-UHFFFAOYSA-N 0 0 397.391 3.280 20 5 GGBDRN O=C(CSCC(=O)c1ccccc1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000189535994 1432152237 /nfs/dbraw/zinc/15/22/37/1432152237.db2.gz QKAOUPSKTGIAKY-UHFFFAOYSA-N 0 0 396.428 3.335 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCC1(c2ccc(F)cc2Cl)CCCC1 ZINC000189550605 1432156030 /nfs/dbraw/zinc/15/60/30/1432156030.db2.gz YYYSLPKSGGWHAS-UHFFFAOYSA-N 0 0 380.807 3.363 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(c1cccc(N)c1)C1CCCC1 ZINC000189567470 1432161394 /nfs/dbraw/zinc/16/13/94/1432161394.db2.gz BPTHIDFQRUTOJH-UHFFFAOYSA-N 0 0 382.420 3.400 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(c2cccc(N)c2)C2CCCC2)cccc1[N+](=O)[O-] ZINC000189575967 1432164380 /nfs/dbraw/zinc/16/43/80/1432164380.db2.gz AGWWBGJWCHTGOZ-UHFFFAOYSA-N 0 0 382.420 3.400 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCO[C@@H](c3ccc(CC)cc3)C2)c1[N+](=O)[O-] ZINC000189590889 1432169646 /nfs/dbraw/zinc/16/96/46/1432169646.db2.gz VQTMAKWPJIPSAN-QGZVFWFLSA-N 0 0 385.420 3.307 20 5 GGBDRN CCOC(=O)[C@@](C)(CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000189594975 1432170171 /nfs/dbraw/zinc/17/01/71/1432170171.db2.gz GLTATDCPFZJYKF-BTYIYWSLSA-N 0 0 399.447 3.476 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189599196 1432171964 /nfs/dbraw/zinc/17/19/64/1432171964.db2.gz NJIILWMUPTYVPV-OAHLLOKOSA-N 0 0 375.469 3.343 20 5 GGBDRN COC[C@@H](C)Oc1ccc(Cl)cc1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189693155 1432206927 /nfs/dbraw/zinc/20/69/27/1432206927.db2.gz ZBPWCZMSIKVZFG-LLVKDONJSA-N 0 0 393.827 3.373 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@H](C3N=NC(=S)N3C)C2)cc1[N+](=O)[O-] ZINC000189716467 1432212951 /nfs/dbraw/zinc/21/29/51/1432212951.db2.gz IJCAIWLKEGKFRE-ZDUSSCGKSA-N 0 0 389.481 3.155 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000189718405 1432213435 /nfs/dbraw/zinc/21/34/35/1432213435.db2.gz VJJGEHGZESWKET-VFNWGFHPSA-N 0 0 399.447 3.394 20 5 GGBDRN C[C@H](C1CC1)n1cc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000189722408 1432214599 /nfs/dbraw/zinc/21/45/99/1432214599.db2.gz HOTNJVDJTQXODE-CQSZACIVSA-N 0 0 384.440 3.116 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@@]3(CCc4ccccc43)C2)cc([N+](=O)[O-])c1C ZINC000189738024 1432219896 /nfs/dbraw/zinc/21/98/96/1432219896.db2.gz AQADUQGKQUPGHB-NRFANRHFSA-N 0 0 382.416 3.226 20 5 GGBDRN COc1ccc(CC[C@H](C)Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000189750079 1432223235 /nfs/dbraw/zinc/22/32/35/1432223235.db2.gz RCSLTRUMAHITBG-ZDUSSCGKSA-N 0 0 378.450 3.440 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(Cl)c(F)c2)C1=O ZINC000189751201 1432223845 /nfs/dbraw/zinc/22/38/45/1432223845.db2.gz HQFITSRJEMARDJ-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN CCOC(=O)c1csc(CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)n1 ZINC000189791248 1432236240 /nfs/dbraw/zinc/23/62/40/1432236240.db2.gz CTZLDKGZTDIAJM-UHFFFAOYSA-N 0 0 377.422 3.281 20 5 GGBDRN C[C@H](C1CC1)n1cc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cn1 ZINC000189811285 1432241484 /nfs/dbraw/zinc/24/14/84/1432241484.db2.gz BUJNDGJTGUIYQM-CQSZACIVSA-N 0 0 384.440 3.116 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(C)CCOc2ccccc2F)c1[N+](=O)[O-] ZINC000189813287 1432242072 /nfs/dbraw/zinc/24/20/72/1432242072.db2.gz CHTNZQXQOSTRBK-UHFFFAOYSA-N 0 0 382.413 3.050 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CC=C(c3ccc(O)cc3)CC2)c1[N+](=O)[O-] ZINC000189815062 1432242533 /nfs/dbraw/zinc/24/25/33/1432242533.db2.gz USRGRQNFKZEDKN-UHFFFAOYSA-N 0 0 388.445 3.395 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c1 ZINC000189830940 1432247820 /nfs/dbraw/zinc/24/78/20/1432247820.db2.gz XKDHZPLFNHSBCV-CYBMUJFWSA-N 0 0 391.449 3.210 20 5 GGBDRN Cc1ccnc(-n2nccc2NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000189837706 1432249607 /nfs/dbraw/zinc/24/96/07/1432249607.db2.gz QYMQKDHYEHAESO-UHFFFAOYSA-N 0 0 386.799 3.459 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2cccc(Cl)c2O1 ZINC000189839309 1432250060 /nfs/dbraw/zinc/25/00/60/1432250060.db2.gz HKDWCIQOTZVLQO-NSHDSACASA-N 0 0 399.794 3.257 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@@H]2CCN(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000189881155 1432261001 /nfs/dbraw/zinc/26/10/01/1432261001.db2.gz SCRKPVPVMJUSCE-INIZCTEOSA-N 0 0 389.477 3.016 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1OCC1CC1 ZINC000189880090 1432261035 /nfs/dbraw/zinc/26/10/35/1432261035.db2.gz SHXDDGJQRRVWFW-UHFFFAOYSA-N 0 0 376.434 3.399 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000189888706 1432264152 /nfs/dbraw/zinc/26/41/52/1432264152.db2.gz LICQOROXTKOHHB-RDJZCZTQSA-N 0 0 390.461 3.362 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)N1CCc2c1cccc2F ZINC000189919736 1432274364 /nfs/dbraw/zinc/27/43/64/1432274364.db2.gz SKLYGHGJXGXFEH-UHFFFAOYSA-N 0 0 385.395 3.060 20 5 GGBDRN CC(C)c1csc(CNC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000189955648 1432288412 /nfs/dbraw/zinc/28/84/12/1432288412.db2.gz FBMKPAWRWDKXEY-UHFFFAOYSA-N 0 0 376.438 3.148 20 5 GGBDRN COc1cc(C(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)cc([N+](=O)[O-])c1C ZINC000189959604 1432289632 /nfs/dbraw/zinc/28/96/32/1432289632.db2.gz JIIDILJQWXPDTI-LJQANCHMSA-N 0 0 384.432 3.325 20 5 GGBDRN CC(C)c1cc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])n(-c2ncccn2)n1 ZINC000189991408 1432300934 /nfs/dbraw/zinc/30/09/34/1432300934.db2.gz URHUARUQXRLLRR-UHFFFAOYSA-N 0 0 395.423 3.358 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc([N+](=O)[O-])c1C ZINC000190010571 1432304399 /nfs/dbraw/zinc/30/43/99/1432304399.db2.gz FENPPUYVLHHHKR-YJBOKZPZSA-N 0 0 392.358 3.450 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NCc2coc(-c3ccccc3)n2)c1[N+](=O)[O-] ZINC000190009957 1432304425 /nfs/dbraw/zinc/30/44/25/1432304425.db2.gz RVMBXVXHGAMCJZ-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cc1[N+](=O)[O-] ZINC000190037150 1432308868 /nfs/dbraw/zinc/30/88/68/1432308868.db2.gz PFZWKBDKVHUZCI-UHFFFAOYSA-N 0 0 377.404 3.284 20 5 GGBDRN Cn1ccc2cccc(NC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)c21 ZINC000190042157 1432309537 /nfs/dbraw/zinc/30/95/37/1432309537.db2.gz HGWGPSMVCPOUIN-UHFFFAOYSA-N 0 0 379.420 3.441 20 5 GGBDRN O=C(Nc1ccc(Cc2nnc3n2CCC3)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000190064852 1432313318 /nfs/dbraw/zinc/31/33/18/1432313318.db2.gz HMZBAWQYRBDKTM-UHFFFAOYSA-N 0 0 381.367 3.115 20 5 GGBDRN COc1cc(C(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)cc([N+](=O)[O-])c1C ZINC000190070388 1432314415 /nfs/dbraw/zinc/31/44/15/1432314415.db2.gz KVZWQYDUIJZTBQ-CQSZACIVSA-N 0 0 387.411 3.307 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000190080696 1432316188 /nfs/dbraw/zinc/31/61/88/1432316188.db2.gz ATLBCFHNHFHDNQ-KRWDZBQOSA-N 0 0 392.477 3.173 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000190080548 1432316301 /nfs/dbraw/zinc/31/63/01/1432316301.db2.gz VMOCMZJJYXQSLI-WFASDCNBSA-N 0 0 376.438 3.204 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H](C)[C@H]2COc3ccccc32)c1[N+](=O)[O-] ZINC000190087378 1432317654 /nfs/dbraw/zinc/31/76/54/1432317654.db2.gz NUNVLFDBKRSZIW-UKRRQHHQSA-N 0 0 376.434 3.055 20 5 GGBDRN CC(C)c1cc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)n(-c2ncccn2)n1 ZINC000190098050 1432319111 /nfs/dbraw/zinc/31/91/11/1432319111.db2.gz GDDKCPBBZIDJNU-UHFFFAOYSA-N 0 0 395.423 3.058 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(Cc2ccccc2)CC(C)(C)O)c1[N+](=O)[O-] ZINC000190111516 1432321738 /nfs/dbraw/zinc/32/17/38/1432321738.db2.gz MZZKJWPOSXAQOD-UHFFFAOYSA-N 0 0 392.477 3.173 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000190113361 1432322082 /nfs/dbraw/zinc/32/20/82/1432322082.db2.gz SOJGQTHHUCCWLB-UHFFFAOYSA-N 0 0 397.431 3.022 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(CC(C)(C)O)C3CC3)cc2[N+](=O)[O-])C1 ZINC000190117486 1432322942 /nfs/dbraw/zinc/32/29/42/1432322942.db2.gz SJZMJOFDPAQXOH-GASCZTMLSA-N 0 0 389.496 3.453 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2=O)cc1 ZINC000190146188 1432327515 /nfs/dbraw/zinc/32/75/15/1432327515.db2.gz DYTVVKFIRRYXDC-QGZVFWFLSA-N 0 0 382.420 3.134 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2=O)cc1 ZINC000190146170 1432327792 /nfs/dbraw/zinc/32/77/92/1432327792.db2.gz DYTVVKFIRRYXDC-KRWDZBQOSA-N 0 0 382.420 3.134 20 5 GGBDRN CC(C)(C)c1cc(NC(=O)NCc2cccc([N+](=O)[O-])c2)n(-c2ncccn2)n1 ZINC000190146600 1432327886 /nfs/dbraw/zinc/32/78/86/1432327886.db2.gz IFIVDRYFOSANLA-UHFFFAOYSA-N 0 0 395.423 3.190 20 5 GGBDRN COC(=O)c1cnc(NC[C@@H](c2ccccc2Cl)N(C)C)c([N+](=O)[O-])c1 ZINC000190164640 1432331524 /nfs/dbraw/zinc/33/15/24/1432331524.db2.gz FGGYBIIWATVYHN-HNNXBMFYSA-N 0 0 378.816 3.145 20 5 GGBDRN COC(=O)c1cnc(NCCCc2cn(-c3ccccc3)nc2C)c([N+](=O)[O-])c1 ZINC000190167123 1432331983 /nfs/dbraw/zinc/33/19/83/1432331983.db2.gz FXPYURSXHCTOKT-UHFFFAOYSA-N 0 0 395.419 3.315 20 5 GGBDRN COC(=O)c1cnc(NCCCc2nc3c(s2)CCCC3)c([N+](=O)[O-])c1 ZINC000190171706 1432332757 /nfs/dbraw/zinc/33/27/57/1432332757.db2.gz UEMBSMXXTGTQIV-UHFFFAOYSA-N 0 0 376.438 3.156 20 5 GGBDRN COC(=O)c1cnc(N2CCC(OCCc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000190170394 1432332877 /nfs/dbraw/zinc/33/28/77/1432332877.db2.gz IXHRDRBIJNLQIV-UHFFFAOYSA-N 0 0 385.420 3.005 20 5 GGBDRN CCCc1[nH]nc(-c2nc(-c3ccc(-n4nc(C)cc4C)nc3)no2)c1[N+](=O)[O-] ZINC000190182319 1432335099 /nfs/dbraw/zinc/33/50/99/1432335099.db2.gz URVTXPAWKPRNNR-UHFFFAOYSA-N 0 0 394.395 3.185 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1nncn1C ZINC000190190543 1432337521 /nfs/dbraw/zinc/33/75/21/1432337521.db2.gz VWEHRQSGOQBTBL-ZDUSSCGKSA-N 0 0 380.408 3.000 20 5 GGBDRN COc1ccc(OCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)cc1[N+](=O)[O-] ZINC000190198244 1432339152 /nfs/dbraw/zinc/33/91/52/1432339152.db2.gz XVFHPDWQSQGZIF-UHFFFAOYSA-N 0 0 396.403 3.423 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)n1 ZINC000190201927 1432340070 /nfs/dbraw/zinc/34/00/70/1432340070.db2.gz RDMZLJQKLHOVPJ-OAHLLOKOSA-N 0 0 389.433 3.134 20 5 GGBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000190207942 1432341365 /nfs/dbraw/zinc/34/13/65/1432341365.db2.gz IYZTVHHAUWQPSK-GOSISDBHSA-N 0 0 378.388 3.294 20 5 GGBDRN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000190228702 1432344831 /nfs/dbraw/zinc/34/48/31/1432344831.db2.gz ODJVUPFUQKAIAJ-JXFKEZNVSA-N 0 0 392.415 3.288 20 5 GGBDRN O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000190237890 1432346715 /nfs/dbraw/zinc/34/67/15/1432346715.db2.gz UTMROKRSOXHALS-UZLBHIALSA-N 0 0 397.431 3.288 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)n1 ZINC000190247400 1432348560 /nfs/dbraw/zinc/34/85/60/1432348560.db2.gz JWTPDEDKWBOWCV-AWEZNQCLSA-N 0 0 375.406 3.205 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cnn(-c3ccc(C)cc3C)c2)c(C)c1[N+](=O)[O-] ZINC000190278280 1432352661 /nfs/dbraw/zinc/35/26/61/1432352661.db2.gz SQDGFYJVWMCFGX-UHFFFAOYSA-N 0 0 382.424 3.239 20 5 GGBDRN O=C(Nc1ccc2nnc(C3CCC3)n2c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000190281689 1432352745 /nfs/dbraw/zinc/35/27/45/1432352745.db2.gz JVULDALIPYAXCV-UHFFFAOYSA-N 0 0 377.364 3.034 20 5 GGBDRN COc1ccc(S(=O)(=O)N(Cc2c(F)cccc2F)C2CC2)cc1[N+](=O)[O-] ZINC000190284483 1432353102 /nfs/dbraw/zinc/35/31/02/1432353102.db2.gz JSOACSPAFLBHDF-UHFFFAOYSA-N 0 0 398.387 3.235 20 5 GGBDRN CCc1ccc([C@H]2CN(CC(=O)Nc3ccc([N+](=O)[O-])cc3C)CCO2)cc1 ZINC000190283142 1432353312 /nfs/dbraw/zinc/35/33/12/1432353312.db2.gz RQJFQJOGHPWKOM-HXUWFJFHSA-N 0 0 383.448 3.478 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCc2ccc(F)c(F)c2)cc1OC ZINC000190300512 1432355910 /nfs/dbraw/zinc/35/59/10/1432355910.db2.gz FJMHNAXCBMQAMJ-UHFFFAOYSA-N 0 0 380.347 3.253 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CC1 ZINC000190318304 1432360112 /nfs/dbraw/zinc/36/01/12/1432360112.db2.gz YBQWCNRVJNIXBP-UHFFFAOYSA-N 0 0 399.447 3.273 20 5 GGBDRN Cc1ccc(NC(=O)NC[C@H]2CCCN(c3ncc([N+](=O)[O-])s3)C2)cc1 ZINC000190323951 1432361363 /nfs/dbraw/zinc/36/13/63/1432361363.db2.gz KBLYNIXCOMSIQC-CYBMUJFWSA-N 0 0 375.454 3.398 20 5 GGBDRN Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c(-n2cc(Cl)cn2)n1 ZINC000190324572 1432361843 /nfs/dbraw/zinc/36/18/43/1432361843.db2.gz BBQOBATVFOXQOF-UHFFFAOYSA-N 0 0 389.774 3.206 20 5 GGBDRN O=C1[C@H](Nc2ncc([N+](=O)[O-])s2)CCCN1c1ccc(OC(F)F)cc1 ZINC000190331241 1432362988 /nfs/dbraw/zinc/36/29/88/1432362988.db2.gz NXLGDJACCZPPSX-LLVKDONJSA-N 0 0 384.364 3.260 20 5 GGBDRN CN(CCOc1ccc(C(F)(F)F)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000190376889 1432369745 /nfs/dbraw/zinc/36/97/45/1432369745.db2.gz IKRWSSORFRPUOJ-UHFFFAOYSA-N 0 0 397.353 3.223 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(c2cncc3ccccc32)CC1 ZINC000190382381 1432370797 /nfs/dbraw/zinc/37/07/97/1432370797.db2.gz ZXLBMQFTGNRVHU-UHFFFAOYSA-N 0 0 376.416 3.034 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000190392360 1432372414 /nfs/dbraw/zinc/37/24/14/1432372414.db2.gz WZYJBJKYTQWPJL-ZDUSSCGKSA-N 0 0 396.387 3.203 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000190396615 1432373212 /nfs/dbraw/zinc/37/32/12/1432373212.db2.gz JRXOCGKRKWFJEB-KRWDZBQOSA-N 0 0 398.506 3.227 20 5 GGBDRN Cc1ccc([C@@H]2CSCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000190400557 1432374205 /nfs/dbraw/zinc/37/42/05/1432374205.db2.gz VFIQQHXXZLCFEE-KRWDZBQOSA-N 0 0 385.445 3.158 20 5 GGBDRN Cc1ccc([C@@H]2CSCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000190400606 1432374232 /nfs/dbraw/zinc/37/42/32/1432374232.db2.gz VXXYGWJJTZRQDN-SFHVURJKSA-N 0 0 399.472 3.467 20 5 GGBDRN CCc1ccc([C@@H]2CN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CCO2)cc1 ZINC000190409490 1432375805 /nfs/dbraw/zinc/37/58/05/1432375805.db2.gz BDPRYMVGLMAWFH-IBGZPJMESA-N 0 0 390.461 3.061 20 5 GGBDRN Cc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)c(-n2cc(Cl)cn2)n1 ZINC000190429328 1432380301 /nfs/dbraw/zinc/38/03/01/1432380301.db2.gz HXRGBCFHAQSVJU-UHFFFAOYSA-N 0 0 386.799 3.459 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCCSc2ccc(F)cc21 ZINC000190435490 1432381219 /nfs/dbraw/zinc/38/12/19/1432381219.db2.gz DSXJSFFQPZOAPT-UHFFFAOYSA-N 0 0 399.407 3.457 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)cc([N+](=O)[O-])c1C ZINC000190574445 1432410655 /nfs/dbraw/zinc/41/06/55/1432410655.db2.gz ZIARARBDILLAFS-KRWDZBQOSA-N 0 0 387.436 3.462 20 5 GGBDRN Cn1ccc2cccc(NC(=O)C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)c21 ZINC000190605208 1432418038 /nfs/dbraw/zinc/41/80/38/1432418038.db2.gz LFCUUJGWZRFQAV-UHFFFAOYSA-N 0 0 392.415 3.216 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@H]2C[C@H](O)C2(C)C)cc1[N+](=O)[O-])c1ccccn1 ZINC000190605795 1432418599 /nfs/dbraw/zinc/41/85/99/1432418599.db2.gz KWNOBKUODAYKIE-UUWFMWQGSA-N 0 0 384.436 3.052 20 5 GGBDRN CCS(=O)(=O)CCCCCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000190609499 1432419482 /nfs/dbraw/zinc/41/94/82/1432419482.db2.gz ZWNZZIGHSDLPQF-UHFFFAOYSA-N 0 0 384.498 3.043 20 5 GGBDRN CCc1n[nH]c(C(=O)N(C)CCOc2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000190622215 1432423475 /nfs/dbraw/zinc/42/34/75/1432423475.db2.gz SXJGYQJSCBXGJX-UHFFFAOYSA-N 0 0 386.330 3.050 20 5 GGBDRN CC[C@@H]1CCCCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000190663554 1432436231 /nfs/dbraw/zinc/43/62/31/1432436231.db2.gz XRIUPZWTLGIBMM-LLVKDONJSA-N 0 0 385.367 3.316 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Oc1ccc([C@H]2CCOC2)cc1 ZINC000190665017 1432437217 /nfs/dbraw/zinc/43/72/17/1432437217.db2.gz GVUJETBCCWMDTC-INIZCTEOSA-N 0 0 377.418 3.050 20 5 GGBDRN COc1ccc(OC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000190671319 1432439144 /nfs/dbraw/zinc/43/91/44/1432439144.db2.gz MPLCLQMXBXCSIA-LBPRGKRZSA-N 0 0 387.310 3.441 20 5 GGBDRN CC1(C)CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CC[C@H]1C(F)(F)F ZINC000190717300 1432453768 /nfs/dbraw/zinc/45/37/68/1432453768.db2.gz IVYUVBBOSRMBLY-CQSZACIVSA-N 0 0 397.353 3.487 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Cn2cncn2)CC1 ZINC000190727352 1432457995 /nfs/dbraw/zinc/45/79/95/1432457995.db2.gz OZYRBDZXYSGFJK-UHFFFAOYSA-N 0 0 389.481 3.239 20 5 GGBDRN COc1cc(C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1C ZINC000190727225 1432458199 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BTXUKIDOMWDAQO-UHFFFAOYSA-N 0 0 385.424 3.326 20 5 GGBDRN Cc1ccc(C[C@H](CO)NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000190943441 1432534638 /nfs/dbraw/zinc/53/46/38/1432534638.db2.gz YDWLFHSIKAJODP-OAHLLOKOSA-N 0 0 394.880 3.369 20 5 GGBDRN COCCc1ccccc1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000190972458 1432540812 /nfs/dbraw/zinc/54/08/12/1432540812.db2.gz AYRMDLBMBJZRGI-UHFFFAOYSA-N 0 0 399.447 3.159 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC2(CCCC2)OC(C)(C)C1 ZINC000190987152 1432544114 /nfs/dbraw/zinc/54/41/14/1432544114.db2.gz VPOMPWXKSDVDCB-AWEZNQCLSA-N 0 0 391.468 3.354 20 5 GGBDRN COc1ccc(OC(=O)CCc2nnc(-c3ccsc3)o2)cc1[N+](=O)[O-] ZINC000191022466 1432551323 /nfs/dbraw/zinc/55/13/23/1432551323.db2.gz PRLWDNNJYBYZJS-UHFFFAOYSA-N 0 0 375.362 3.253 20 5 GGBDRN CC(C)(C)Cc1cc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n[nH]1 ZINC000191028854 1432552698 /nfs/dbraw/zinc/55/26/98/1432552698.db2.gz PPUCXVPWLAWRGR-UHFFFAOYSA-N 0 0 379.804 3.137 20 5 GGBDRN COc1cc(C(=O)NCCc2nc3c(s2)CCCC3)cc([N+](=O)[O-])c1C ZINC000191044330 1432556127 /nfs/dbraw/zinc/55/61/27/1432556127.db2.gz IYTIZYMQQWTODA-UHFFFAOYSA-N 0 0 375.450 3.220 20 5 GGBDRN Cc1ccc(C[C@H](CO)NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000191045682 1432556376 /nfs/dbraw/zinc/55/63/76/1432556376.db2.gz DBYUGNCXXMJTKS-MRXNPFEDSA-N 0 0 392.839 3.045 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(N2C[C@H]3CC[C@@H]2C3)cc1 ZINC000191102427 1432568696 /nfs/dbraw/zinc/56/86/96/1432568696.db2.gz RPGLEAISONMVAY-WMLDXEAASA-N 0 0 394.431 3.469 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2ccc(N3C[C@H]4CC[C@@H]3C4)cc2)cccc1[N+](=O)[O-] ZINC000191106427 1432569249 /nfs/dbraw/zinc/56/92/49/1432569249.db2.gz KCBQKATYHPPKFS-WMLDXEAASA-N 0 0 394.431 3.469 20 5 GGBDRN Cc1cccc(C[C@@H](CO)NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000191120370 1432571927 /nfs/dbraw/zinc/57/19/27/1432571927.db2.gz FMLKLBQGSDCMFH-HNNXBMFYSA-N 0 0 394.880 3.369 20 5 GGBDRN COc1cc(C(=O)N2CCC(Oc3ccc(F)nc3)CC2)cc([N+](=O)[O-])c1C ZINC000191121807 1432572030 /nfs/dbraw/zinc/57/20/30/1432572030.db2.gz HZXXCRUNQBTCOS-UHFFFAOYSA-N 0 0 389.383 3.130 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000191166950 1432581171 /nfs/dbraw/zinc/58/11/71/1432581171.db2.gz DZJPXSNBSHARRY-UHFFFAOYSA-N 0 0 379.775 3.466 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCSC[C@H]1c1cnn(C)c1 ZINC000191190932 1432587367 /nfs/dbraw/zinc/58/73/67/1432587367.db2.gz YBTAZFDVACTTPI-KRWDZBQOSA-N 0 0 376.482 3.406 20 5 GGBDRN C[C@H](Oc1ccc(C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1)c1ccccc1 ZINC000191201261 1432589632 /nfs/dbraw/zinc/58/96/32/1432589632.db2.gz MBMOYWBVIHUVKS-HNNXBMFYSA-N 0 0 380.404 3.361 20 5 GGBDRN COCCNc1ccccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000191218398 1432594344 /nfs/dbraw/zinc/59/43/44/1432594344.db2.gz OWEFLHHWBYOMRZ-UHFFFAOYSA-N 0 0 381.392 3.091 20 5 GGBDRN Cc1ccc(-n2cc(NC(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)cn2)c(C)c1 ZINC000191261139 1432611386 /nfs/dbraw/zinc/61/13/86/1432611386.db2.gz 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ZINC000191336273 1432635670 /nfs/dbraw/zinc/63/56/70/1432635670.db2.gz KQSIRSQGPBENBU-UHFFFAOYSA-N 0 0 382.420 3.313 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCN(C(=O)Cc2ccccc2)CC1 ZINC000191340179 1432636287 /nfs/dbraw/zinc/63/62/87/1432636287.db2.gz PFRDUMXUOCCVLD-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN Cc1nn(C)c2nc(C3CC3)cc(C(=O)OCc3ncc(C)c([N+](=O)[O-])c3C)c12 ZINC000191342761 1432637216 /nfs/dbraw/zinc/63/72/16/1432637216.db2.gz AZSMLHOLPUYWOS-UHFFFAOYSA-N 0 0 395.419 3.431 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1nc(COc2ccccc2)n[nH]1 ZINC000191349495 1432638441 /nfs/dbraw/zinc/63/84/41/1432638441.db2.gz GYGFBXUFBXZIDH-UHFFFAOYSA-N 0 0 396.407 3.230 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCCN(c2nccs2)CC1 ZINC000191354776 1432639459 /nfs/dbraw/zinc/63/94/59/1432639459.db2.gz FRGJTSOILZBYJC-UHFFFAOYSA-N 0 0 375.454 3.412 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC(CC(=O)N2CCCC2)CC1 ZINC000191355372 1432639758 /nfs/dbraw/zinc/63/97/58/1432639758.db2.gz 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CCOC1CC(CCNc2ccc(S(=O)(=O)N(CC)CC)cc2[N+](=O)[O-])C1 ZINC000191628081 1432695617 /nfs/dbraw/zinc/69/56/17/1432695617.db2.gz UWTWRROAFUAYHY-UHFFFAOYSA-N 0 0 399.513 3.242 20 5 GGBDRN C[C@H]1CN(c2ccccc2F)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191627218 1432695869 /nfs/dbraw/zinc/69/58/69/1432695869.db2.gz FLRCBDJVIVUAGA-AWEZNQCLSA-N 0 0 397.410 3.495 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(Cl)c1 ZINC000191630343 1432696201 /nfs/dbraw/zinc/69/62/01/1432696201.db2.gz PHDNGPBGWHVVHK-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3)C2=O)c1 ZINC000191632158 1432696486 /nfs/dbraw/zinc/69/64/86/1432696486.db2.gz DWEVTSPXGVMCSA-KRWDZBQOSA-N 0 0 399.472 3.156 20 5 GGBDRN CCOC[C@@H](Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)C(C)C ZINC000191670964 1432703065 /nfs/dbraw/zinc/70/30/65/1432703065.db2.gz KAMCHZYXUQBAIN-OAHLLOKOSA-N 0 0 380.832 3.267 20 5 GGBDRN COc1cc(C(=O)NCCc2nccn2Cc2ccccc2)cc([N+](=O)[O-])c1C ZINC000191701646 1432709770 /nfs/dbraw/zinc/70/97/70/1432709770.db2.gz SMKWZZHNLDLBDZ-UHFFFAOYSA-N 0 0 394.431 3.129 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)n1 ZINC000191719028 1432712539 /nfs/dbraw/zinc/71/25/39/1432712539.db2.gz HBTQPBSKCATEMX-ABAIWWIYSA-N 0 0 378.816 3.067 20 5 GGBDRN CCO[C@H]1C[C@](O)(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1(C)C ZINC000191738771 1432715378 /nfs/dbraw/zinc/71/53/78/1432715378.db2.gz XEYNZEONSPJREN-YJBOKZPZSA-N 0 0 378.450 3.105 20 5 GGBDRN CNC(=O)c1ccc(NS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c(Cl)c1 ZINC000191785046 1432724901 /nfs/dbraw/zinc/72/49/01/1432724901.db2.gz XBVAHPKZKXYBNE-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN CCCNC(=O)c1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000191788760 1432725351 /nfs/dbraw/zinc/72/53/51/1432725351.db2.gz OJYSEBAECWYLTR-UHFFFAOYSA-N 0 0 391.449 3.152 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2ccc(C(=O)NC(C)C)cc2)cc1[N+](=O)[O-] ZINC000191790706 1432725609 /nfs/dbraw/zinc/72/56/09/1432725609.db2.gz 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3.244 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000191807370 1432729865 /nfs/dbraw/zinc/72/98/65/1432729865.db2.gz YQQUSLDKTUQWQS-NSHDSACASA-N 0 0 397.218 3.011 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(c2ccccc2)[C@H]2CCOC2)c2ncccc12 ZINC000191827740 1432733632 /nfs/dbraw/zinc/73/36/32/1432733632.db2.gz VXHGOJHEXHFRHS-HNNXBMFYSA-N 0 0 399.428 3.127 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(c2ccccc2)[C@@H]2CCOC2)c1C ZINC000191831351 1432734335 /nfs/dbraw/zinc/73/43/35/1432734335.db2.gz WFUFNIZMKXDLHU-MRXNPFEDSA-N 0 0 376.434 3.196 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(c1ccccc1)[C@H]1CCOC1 ZINC000191831654 1432734949 /nfs/dbraw/zinc/73/49/49/1432734949.db2.gz XACWSBAMVQCFFU-INIZCTEOSA-N 0 0 376.434 3.196 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(c2ccccc2)[C@H]2CCOC2)c1C ZINC000191832975 1432735575 /nfs/dbraw/zinc/73/55/75/1432735575.db2.gz RFDNWIARGBJKTE-INIZCTEOSA-N 0 0 376.434 3.196 20 5 GGBDRN 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ZINC000191895374 1432749892 /nfs/dbraw/zinc/74/98/92/1432749892.db2.gz WHEFZMLRMNJUIN-MRXNPFEDSA-N 0 0 389.477 3.016 20 5 GGBDRN COc1c(C)cnc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1C ZINC000191902559 1432751550 /nfs/dbraw/zinc/75/15/50/1432751550.db2.gz YPPDUYMIDYNAFK-UHFFFAOYSA-N 0 0 393.465 3.053 20 5 GGBDRN CNC(=O)c1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(Cl)c1 ZINC000191908601 1432752881 /nfs/dbraw/zinc/75/28/81/1432752881.db2.gz MYLGQUDCWCUPEU-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CC[C@@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000191915412 1432754847 /nfs/dbraw/zinc/75/48/47/1432754847.db2.gz HZEWAVOSEVHTIK-MRXNPFEDSA-N 0 0 375.450 3.087 20 5 GGBDRN O=C(CCOCC(F)(F)C(F)(F)F)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000191934039 1432759112 /nfs/dbraw/zinc/75/91/12/1432759112.db2.gz NQWOOEZJFIESES-UHFFFAOYSA-N 0 0 382.285 3.478 20 5 GGBDRN O=C(CCOCC(F)(F)C(F)F)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000191951091 1432765215 /nfs/dbraw/zinc/76/52/15/1432765215.db2.gz 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Cc1cccc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000192543683 1432857491 /nfs/dbraw/zinc/85/74/91/1432857491.db2.gz JCIGGYRFTAZCES-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1C(=O)N(C)C(C)C ZINC000192549333 1432858184 /nfs/dbraw/zinc/85/81/84/1432858184.db2.gz CPPXZENPURSRBW-UHFFFAOYSA-N 0 0 388.399 3.357 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@@H](c2nc(C(C)(C)C)cs2)C1 ZINC000192550848 1432858464 /nfs/dbraw/zinc/85/84/64/1432858464.db2.gz GEJWGGSDKDRUKT-GFCCVEGCSA-N 0 0 379.486 3.452 20 5 GGBDRN CC(C)N(CCS(=O)(=O)c1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000192552571 1432858633 /nfs/dbraw/zinc/85/86/33/1432858633.db2.gz BBWKIRSBVYODQI-UHFFFAOYSA-N 0 0 380.441 3.418 20 5 GGBDRN Cc1ccc(Sc2ccc(C(=O)N3CCC[C@H]3C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000192551250 1432858707 /nfs/dbraw/zinc/85/87/07/1432858707.db2.gz KXMGQBMJCJHXSP-HNNXBMFYSA-N 0 0 385.445 3.144 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](c1cccc(Cl)c1)N1CCOCC1 ZINC000192558746 1432859830 /nfs/dbraw/zinc/85/98/30/1432859830.db2.gz QCHJNEGIOFTKOR-MRXNPFEDSA-N 0 0 393.875 3.258 20 5 GGBDRN C[C@@H]1C[C@]2(CC(C)(C)C1)NC(=O)N(CN(C)Cc1ccccc1[N+](=O)[O-])C2=O ZINC000192560433 1432860024 /nfs/dbraw/zinc/86/00/24/1432860024.db2.gz KEFVNFDUPRLTTP-VBKZILBWSA-N 0 0 388.468 3.121 20 5 GGBDRN COc1ccccc1-n1ncc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1C ZINC000192562571 1432860539 /nfs/dbraw/zinc/86/05/39/1432860539.db2.gz OZEWPLOWOFEVTK-UHFFFAOYSA-N 0 0 392.375 3.226 20 5 GGBDRN Cc1cc(C(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000192564529 1432860685 /nfs/dbraw/zinc/86/06/85/1432860685.db2.gz KJEOSLPITYRPRT-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCCN(C(=O)c2ccccc2F)CC1 ZINC000192566905 1432861050 /nfs/dbraw/zinc/86/10/50/1432861050.db2.gz FHLLAIUERUAXIK-DHZHZOJOSA-N 0 0 397.406 3.122 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC(O)(c3ccccc3Cl)CC2)c1[N+](=O)[O-] ZINC000192572219 1432861697 /nfs/dbraw/zinc/86/16/97/1432861697.db2.gz UPACUARINQAXFP-UHFFFAOYSA-N 0 0 392.843 3.048 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000192575257 1432861975 /nfs/dbraw/zinc/86/19/75/1432861975.db2.gz ZOGQSUHCWNDGKK-UHFFFAOYSA-N 0 0 376.359 3.305 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N(C)C[C@@H]2COc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000192575399 1432862032 /nfs/dbraw/zinc/86/20/32/1432862032.db2.gz ZRHOGNDBUZTCRF-HUUCEWRRSA-N 0 0 385.420 3.002 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCC1CCN(Cc2nc(C)c(C)o2)CC1 ZINC000192589388 1432863439 /nfs/dbraw/zinc/86/34/39/1432863439.db2.gz MQRLWWHTAKBXNU-UHFFFAOYSA-N 0 0 376.461 3.049 20 5 GGBDRN CCN(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1cc(C)ccc1C ZINC000192607568 1432865488 /nfs/dbraw/zinc/86/54/88/1432865488.db2.gz PQFOXTKDLZNXKM-UHFFFAOYSA-N 0 0 376.434 3.282 20 5 GGBDRN COc1ccccc1NC(=O)C1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1 ZINC000192610032 1432865686 /nfs/dbraw/zinc/86/56/86/1432865686.db2.gz QSEMYAODXCFZOS-UHFFFAOYSA-N 0 0 397.431 3.403 20 5 GGBDRN CCCCS(=O)(=O)Nc1ccc(Nc2c([N+](=O)[O-])c(C)nn2CC)cc1 ZINC000192618588 1432866878 /nfs/dbraw/zinc/86/68/78/1432866878.db2.gz NINOQYFYOHRVGF-UHFFFAOYSA-N 0 0 381.458 3.405 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N(C)Cc1cc(OC)c(OC)cc1SC ZINC000192619609 1432867000 /nfs/dbraw/zinc/86/70/00/1432867000.db2.gz TWNLVZLEEHCLRV-UHFFFAOYSA-N 0 0 380.470 3.495 20 5 GGBDRN COC(=O)c1c(C)c(C)sc1NC(=O)CN(C)Cc1ccccc1[N+](=O)[O-] ZINC000192633795 1432869126 /nfs/dbraw/zinc/86/91/26/1432869126.db2.gz SEWAMDSCKHUWQL-UHFFFAOYSA-N 0 0 391.449 3.130 20 5 GGBDRN CCN(CC)C(=O)c1cccc(NC(=O)CN(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000192637292 1432869752 /nfs/dbraw/zinc/86/97/52/1432869752.db2.gz DPXVKNPFWJJTEO-UHFFFAOYSA-N 0 0 398.463 3.147 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000192642690 1432870386 /nfs/dbraw/zinc/87/03/86/1432870386.db2.gz HERLHTGNXOQMJN-QGZVFWFLSA-N 0 0 376.796 3.211 20 5 GGBDRN CN(CC(=O)Nc1ccc(N2CCCCC2)nc1)Cc1ccccc1[N+](=O)[O-] ZINC000192642331 1432870404 /nfs/dbraw/zinc/87/04/04/1432870404.db2.gz BEBMXQBSSKVSHS-UHFFFAOYSA-N 0 0 383.452 3.051 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCC(=O)Nc1cc(Cl)ccc1OC ZINC000192644793 1432870692 /nfs/dbraw/zinc/87/06/92/1432870692.db2.gz NQKOYLFWVDCBEG-UHFFFAOYSA-N 0 0 381.820 3.222 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000192656412 1432872099 /nfs/dbraw/zinc/87/20/99/1432872099.db2.gz YZYVFCCJRTZYMX-GOSISDBHSA-N 0 0 383.404 3.203 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccccc1 ZINC000192659041 1432872315 /nfs/dbraw/zinc/87/23/15/1432872315.db2.gz SOXGNLFOWMBFKB-MRXNPFEDSA-N 0 0 390.461 3.168 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000192660131 1432872333 /nfs/dbraw/zinc/87/23/33/1432872333.db2.gz YRVWJPBIAFTNGS-PIGZYNQJSA-N 0 0 375.812 3.314 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nc2ccccc12 ZINC000192666760 1432873371 /nfs/dbraw/zinc/87/33/71/1432873371.db2.gz HTISXDQHLXJBNT-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N(C)CCCOc1cc(OC)cc(OC)c1 ZINC000192674388 1432874065 /nfs/dbraw/zinc/87/40/65/1432874065.db2.gz KYOINBKWBJDGJU-UHFFFAOYSA-N 0 0 378.429 3.042 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc12 ZINC000192675604 1432874299 /nfs/dbraw/zinc/87/42/99/1432874299.db2.gz GKZCUSOQCZOZPI-UHFFFAOYSA-N 0 0 375.358 3.031 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccnn1Cc1ccc(F)cc1 ZINC000192678368 1432874559 /nfs/dbraw/zinc/87/45/59/1432874559.db2.gz KJJHBNBLQMOMQO-UHFFFAOYSA-N 0 0 383.383 3.419 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC[C@H](Nc2cc(OC)cc(OC)c2)C1 ZINC000192687074 1432875460 /nfs/dbraw/zinc/87/54/60/1432875460.db2.gz QTBDLUHKTTUWHJ-AWEZNQCLSA-N 0 0 389.456 3.218 20 5 GGBDRN Cc1cccc([C@@H](CNC(=O)c2c(C)cccc2[N+](=O)[O-])N2CCOCC2)c1 ZINC000192688795 1432875742 /nfs/dbraw/zinc/87/57/42/1432875742.db2.gz IPQRKKUNNKWWJT-LJQANCHMSA-N 0 0 383.448 3.015 20 5 GGBDRN CCC(CC)c1nnc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000192693557 1432876240 /nfs/dbraw/zinc/87/62/40/1432876240.db2.gz IDHPAVLWVYMEQP-UHFFFAOYSA-N 0 0 391.453 3.027 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N3CCCC[C@H]3CCO)cc2[N+](=O)[O-])CC1 ZINC000192698614 1432876605 /nfs/dbraw/zinc/87/66/05/1432876605.db2.gz OZLOYVOVXMLSDH-KRWDZBQOSA-N 0 0 375.469 3.208 20 5 GGBDRN CC[C@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])[C@H]1CN(Cc2ccccc2)CCO1 ZINC000192720971 1432879921 /nfs/dbraw/zinc/87/99/21/1432879921.db2.gz UKJUFLOWFIRHHF-AZUAARDMSA-N 0 0 397.475 3.313 20 5 GGBDRN O=[N+]([O-])c1ccc(F)c(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000192726728 1432880788 /nfs/dbraw/zinc/88/07/88/1432880788.db2.gz INRHUAFHFJXCTB-UHFFFAOYSA-N 0 0 375.721 3.096 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCc2c(ncn2CCc2ccccc2)C1 ZINC000192743562 1432883565 /nfs/dbraw/zinc/88/35/65/1432883565.db2.gz QOOFXIPEHPJZRH-UHFFFAOYSA-N 0 0 380.452 3.122 20 5 GGBDRN COC(=O)[C@H](CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000192747923 1432884157 /nfs/dbraw/zinc/88/41/57/1432884157.db2.gz PVMUBJWVUZAEKG-BDJLRTHQSA-N 0 0 392.358 3.050 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCCN(C(=O)c2ccc(F)cc2)CC1 ZINC000192758246 1432885527 /nfs/dbraw/zinc/88/55/27/1432885527.db2.gz MUFINAZAWSLWAN-UHFFFAOYSA-N 0 0 386.383 3.114 20 5 GGBDRN O=C1N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000192768697 1432887593 /nfs/dbraw/zinc/88/75/93/1432887593.db2.gz DXSFOHKBWSBXCD-QGZVFWFLSA-N 0 0 398.806 3.393 20 5 GGBDRN CCO[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000192770840 1432888173 /nfs/dbraw/zinc/88/81/73/1432888173.db2.gz UMDKLBTXBWRSTO-LJQANCHMSA-N 0 0 380.404 3.288 20 5 GGBDRN CCO[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000192770822 1432888257 /nfs/dbraw/zinc/88/82/57/1432888257.db2.gz UMDKLBTXBWRSTO-IBGZPJMESA-N 0 0 380.404 3.288 20 5 GGBDRN CCO[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000192778144 1432889374 /nfs/dbraw/zinc/88/93/74/1432889374.db2.gz RHDLUUZYHORIRL-LJQANCHMSA-N 0 0 380.404 3.288 20 5 GGBDRN CCCCOc1ccc(C(=O)NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192777967 1432889387 /nfs/dbraw/zinc/88/93/87/1432889387.db2.gz HKLGKLMHLPTZPZ-UHFFFAOYSA-N 0 0 397.431 3.093 20 5 GGBDRN CCO[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1 ZINC000192788137 1432890985 /nfs/dbraw/zinc/89/09/85/1432890985.db2.gz HPPJTNFUIKHKLX-LJQANCHMSA-N 0 0 380.404 3.288 20 5 GGBDRN O=C(Nc1ccc2nncn2c1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192800563 1432892872 /nfs/dbraw/zinc/89/28/72/1432892872.db2.gz GOVNQQPURFZXTD-UHFFFAOYSA-N 0 0 389.371 3.469 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(N[C@@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000192828597 1432896074 /nfs/dbraw/zinc/89/60/74/1432896074.db2.gz XYLHTBOCMDZGJK-IBGZPJMESA-N 0 0 383.404 3.061 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(CN2CCCCC2)cs1 ZINC000192830938 1432896270 /nfs/dbraw/zinc/89/62/70/1432896270.db2.gz HBRHCFLQNLRFOY-UHFFFAOYSA-N 0 0 389.481 3.356 20 5 GGBDRN Cc1ccc(N(CCCO)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 ZINC000192837261 1432896996 /nfs/dbraw/zinc/89/69/96/1432896996.db2.gz VYXLROKREVOGHU-UHFFFAOYSA-N 0 0 398.868 3.443 20 5 GGBDRN CCN(CC)c1ccc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000192838417 1432897331 /nfs/dbraw/zinc/89/73/31/1432897331.db2.gz IVKDEVPZFABMGH-UHFFFAOYSA-N 0 0 391.815 3.067 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)CN3CCCCCC3=O)n2)cc1[N+](=O)[O-] ZINC000192842156 1432897790 /nfs/dbraw/zinc/89/77/90/1432897790.db2.gz ZDXXOCOQKZQLJL-UHFFFAOYSA-N 0 0 388.449 3.368 20 5 GGBDRN Cc1cccc2c1CCN2C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000192872902 1432901549 /nfs/dbraw/zinc/90/15/49/1432901549.db2.gz CGXIMLQCHNAJBJ-UHFFFAOYSA-N 0 0 391.330 3.032 20 5 GGBDRN O=C(N[C@@H]1C[C@H]2OCCC[C@H]12)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192870768 1432901621 /nfs/dbraw/zinc/90/16/21/1432901621.db2.gz PFSVRGKHQZJTII-YVWKXTFCSA-N 0 0 382.416 3.471 20 5 GGBDRN COCCNC(=O)/C(=C/c1ccc(C)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000192878062 1432902058 /nfs/dbraw/zinc/90/20/58/1432902058.db2.gz SSHQVFAOINIUNL-RVDMUPIBSA-N 0 0 380.404 3.083 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1ccc(C)nc1-n1cc(Cl)cn1 ZINC000192882776 1432902684 /nfs/dbraw/zinc/90/26/84/1432902684.db2.gz OCJUWTAFSPFHEN-UHFFFAOYSA-N 0 0 375.820 3.274 20 5 GGBDRN O=C(NCCOCC(F)F)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192887103 1432903309 /nfs/dbraw/zinc/90/33/09/1432903309.db2.gz ATNYFGJVHPYNFU-UHFFFAOYSA-N 0 0 380.347 3.185 20 5 GGBDRN Cc1ccc([C@](O)(CC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C(F)(F)F)o1 ZINC000192892912 1432904130 /nfs/dbraw/zinc/90/41/30/1432904130.db2.gz RDBMYOWNMQQLQB-MRXNPFEDSA-N 0 0 386.326 3.295 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCC(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000192896636 1432904366 /nfs/dbraw/zinc/90/43/66/1432904366.db2.gz QZGAVFRJGRDXEV-UHFFFAOYSA-N 0 0 384.436 3.099 20 5 GGBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@@H](OCc2ccncc2)C1 ZINC000192900760 1432904923 /nfs/dbraw/zinc/90/49/23/1432904923.db2.gz QVCZNEPQGUXOBT-OAHLLOKOSA-N 0 0 389.383 3.101 20 5 GGBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@H](OCc2ccncc2)C1 ZINC000192900738 1432905019 /nfs/dbraw/zinc/90/50/19/1432905019.db2.gz QVCZNEPQGUXOBT-HNNXBMFYSA-N 0 0 389.383 3.101 20 5 GGBDRN O=C(c1cc(N2CC[C@H](OCc3ccncc3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000192904131 1432905288 /nfs/dbraw/zinc/90/52/88/1432905288.db2.gz OZNKQFDCAUXQQP-SFHVURJKSA-N 0 0 396.447 3.021 20 5 GGBDRN COC[C@@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000192925750 1432908711 /nfs/dbraw/zinc/90/87/11/1432908711.db2.gz FMDOSNONXJTILO-MRXNPFEDSA-N 0 0 398.868 3.098 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(-c2nnc3n2CCC3)c1 ZINC000192925803 1432908717 /nfs/dbraw/zinc/90/87/17/1432908717.db2.gz UOWDZSTVPVXRPR-UHFFFAOYSA-N 0 0 392.419 3.463 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000192942968 1432911132 /nfs/dbraw/zinc/91/11/32/1432911132.db2.gz 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ZINC000193255358 1432968194 /nfs/dbraw/zinc/96/81/94/1432968194.db2.gz KMSHLZFXVIPEPI-JTQLQIEISA-N 0 0 392.774 3.082 20 5 GGBDRN CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000193255826 1432968366 /nfs/dbraw/zinc/96/83/66/1432968366.db2.gz VNSWTNKXBOHCRG-KGLIPLIRSA-N 0 0 382.482 3.333 20 5 GGBDRN Cc1cc(=O)c(C(=O)NC2[C@@H](C)CCC[C@@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000193262919 1432970627 /nfs/dbraw/zinc/97/06/27/1432970627.db2.gz LYKQCUDOXQBSHL-STQMWFEESA-N 0 0 384.436 3.004 20 5 GGBDRN O=C(c1sccc1-n1cccc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000193264012 1432970817 /nfs/dbraw/zinc/97/08/17/1432970817.db2.gz MIAKVQHVCYZHMX-UHFFFAOYSA-N 0 0 382.445 3.409 20 5 GGBDRN O=C(CCCOc1ccc(F)cc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000193264412 1432970993 /nfs/dbraw/zinc/97/09/93/1432970993.db2.gz SQHFHBMUYDYGTF-UHFFFAOYSA-N 0 0 387.411 3.242 20 5 GGBDRN COc1ccc(CN(C(=O)CNc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000193265188 1432971217 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/nfs/dbraw/zinc/04/43/06/1433044306.db2.gz LBTNDWCYJRPLCX-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)C1 ZINC000193710480 1433044842 /nfs/dbraw/zinc/04/48/42/1433044842.db2.gz VGKPVTYQGJZDPN-AOOOYVTPSA-N 0 0 377.260 3.024 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2cccc(F)c2)cc1Br ZINC000193710320 1433044849 /nfs/dbraw/zinc/04/48/49/1433044849.db2.gz IDFFEJKTZDNRKB-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)COCc1ccccc1 ZINC000193711302 1433044903 /nfs/dbraw/zinc/04/49/03/1433044903.db2.gz CMHHOUABGROQSH-INIZCTEOSA-N 0 0 394.431 3.363 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](C)COCc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000193713527 1433045460 /nfs/dbraw/zinc/04/54/60/1433045460.db2.gz YZZZAWLHXIPHQR-CYBMUJFWSA-N 0 0 387.392 3.394 20 5 GGBDRN CS(=O)(=O)Nc1cccc2c1CCN(c1ccc([N+](=O)[O-])c3cccnc31)C2 ZINC000193716319 1433045911 /nfs/dbraw/zinc/04/59/11/1433045911.db2.gz LECFSJXABRNQNW-UHFFFAOYSA-N 0 0 398.444 3.077 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1OC1CCCC1 ZINC000193716232 1433045926 /nfs/dbraw/zinc/04/59/26/1433045926.db2.gz JTHOVZCXGXXFAE-UHFFFAOYSA-N 0 0 397.387 3.463 20 5 GGBDRN COc1cccc(OS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)c1 ZINC000193717723 1433046423 /nfs/dbraw/zinc/04/64/23/1433046423.db2.gz VZXGGYWPYIBHRW-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)nc1 ZINC000193719304 1433046832 /nfs/dbraw/zinc/04/68/32/1433046832.db2.gz BPDLPNAMMREWAI-UHFFFAOYSA-N 0 0 399.407 3.057 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccc(F)cc2F)cc1Br ZINC000193739866 1433050092 /nfs/dbraw/zinc/05/00/92/1433050092.db2.gz KGRZEQBXMVYBQL-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2c(F)cccc2F)cc1Br ZINC000193740032 1433050393 /nfs/dbraw/zinc/05/03/93/1433050393.db2.gz JMOSMEJFTNTYQO-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000193757994 1433053796 /nfs/dbraw/zinc/05/37/96/1433053796.db2.gz QVNWWAJZKFSNQV-HUUCEWRRSA-N 0 0 397.431 3.405 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N2CCCN(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000193778828 1433057349 /nfs/dbraw/zinc/05/73/49/1433057349.db2.gz BMWDPEYOSWVYEM-QGZVFWFLSA-N 0 0 382.464 3.443 20 5 GGBDRN CN(C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)[C@@H]1CCc2ccccc21 ZINC000193786199 1433059215 /nfs/dbraw/zinc/05/92/15/1433059215.db2.gz DXYRKYNDTDHXRR-RDTXWAMCSA-N 0 0 397.406 3.233 20 5 GGBDRN Cc1nnc([C@H]2Cc3ccccc3CN2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])o1 ZINC000193786618 1433059218 /nfs/dbraw/zinc/05/92/18/1433059218.db2.gz AQVGWAUUYMKXLA-GOSISDBHSA-N 0 0 395.375 3.494 20 5 GGBDRN CC(C)CN(C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193787050 1433059576 /nfs/dbraw/zinc/05/95/76/1433059576.db2.gz WNKBOCUUUXHYKO-UHFFFAOYSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@@H](C1CC1)N(C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193793133 1433060682 /nfs/dbraw/zinc/06/06/82/1433060682.db2.gz ZENWSXXZSYXXDM-VIFPVBQESA-N 0 0 389.271 3.309 20 5 GGBDRN O=C(Nc1ccccc1)NC1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000193799006 1433061946 /nfs/dbraw/zinc/06/19/46/1433061946.db2.gz RNTVVZHMFLZKPS-UHFFFAOYSA-N 0 0 399.407 3.289 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCn3c4ccccc4nc32)cc1OC ZINC000193800251 1433062294 /nfs/dbraw/zinc/06/22/94/1433062294.db2.gz PNVUTHHKUXUETJ-UHFFFAOYSA-N 0 0 382.376 3.012 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCn3c4ccccc4nc32)cc1[N+](=O)[O-] ZINC000193803132 1433063176 /nfs/dbraw/zinc/06/31/76/1433063176.db2.gz PUTOXILCEWAYDJ-UHFFFAOYSA-N 0 0 398.444 3.233 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)nc1 ZINC000193808598 1433064463 /nfs/dbraw/zinc/06/44/63/1433064463.db2.gz KVSHRCKAPGXYDU-UHFFFAOYSA-N 0 0 382.420 3.098 20 5 GGBDRN CCCCOc1ccccc1NC(=O)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193813849 1433065369 /nfs/dbraw/zinc/06/53/69/1433065369.db2.gz OMZAKILVNJZPCC-UHFFFAOYSA-N 0 0 385.420 3.371 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000193814443 1433065391 /nfs/dbraw/zinc/06/53/91/1433065391.db2.gz IFFFUBSLXUIAMF-APWZRJJASA-N 0 0 390.484 3.022 20 5 GGBDRN CCCOc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000193813287 1433065418 /nfs/dbraw/zinc/06/54/18/1433065418.db2.gz XETLJTSEPIMZHL-UHFFFAOYSA-N 0 0 385.420 3.289 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000193814697 1433065592 /nfs/dbraw/zinc/06/55/92/1433065592.db2.gz YDBWKUUFUNXBNK-LBPRGKRZSA-N 0 0 379.394 3.159 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC=C(c2ccc(O)cc2)CC1 ZINC000193817230 1433066349 /nfs/dbraw/zinc/06/63/49/1433066349.db2.gz RCDLIGRDVRZLGW-UHFFFAOYSA-N 0 0 390.399 3.416 20 5 GGBDRN O=C1CCCc2cc(S(=O)(=O)Nc3cc([N+](=O)[O-])ccc3Cl)ccc2N1 ZINC000193826325 1433067489 /nfs/dbraw/zinc/06/74/89/1433067489.db2.gz RQUDRXMARJGBNM-UHFFFAOYSA-N 0 0 395.824 3.324 20 5 GGBDRN CCOc1ccccc1N1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000193825794 1433067621 /nfs/dbraw/zinc/06/76/21/1433067621.db2.gz AYRIHLFBRBKOAN-UHFFFAOYSA-N 0 0 398.463 3.068 20 5 GGBDRN O=C(c1cccc(F)c1)N1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000193832019 1433068719 /nfs/dbraw/zinc/06/87/19/1433068719.db2.gz XFDYRSOMZYXNCG-UHFFFAOYSA-N 0 0 380.379 3.245 20 5 GGBDRN CC(C)CN(CC(C)C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000193829961 1433068749 /nfs/dbraw/zinc/06/87/49/1433068749.db2.gz UPQPNTZJTGDCAO-UHFFFAOYSA-N 0 0 387.383 3.275 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000193855351 1433074044 /nfs/dbraw/zinc/07/40/44/1433074044.db2.gz XWNTVWDSLMKAMJ-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN CCOC(=O)c1cc2cc(NC(=O)c3c([N+](=O)[O-])c(C)nn3C)ccc2s1 ZINC000193883298 1433077831 /nfs/dbraw/zinc/07/78/31/1433077831.db2.gz LWCPWUOGLSDJQQ-UHFFFAOYSA-N 0 0 388.405 3.280 20 5 GGBDRN O=C(NCCCn1ccnc1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000193887513 1433078504 /nfs/dbraw/zinc/07/85/04/1433078504.db2.gz BTHYYTQJZDZIDO-UHFFFAOYSA-N 0 0 380.404 3.190 20 5 GGBDRN CCN(CCc1ccccc1)C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000193890910 1433079061 /nfs/dbraw/zinc/07/90/61/1433079061.db2.gz DZTLHKZUOBJRDF-UHFFFAOYSA-N 0 0 375.812 3.278 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@@H]2Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000193902417 1433081346 /nfs/dbraw/zinc/08/13/46/1433081346.db2.gz UIXGGOZQGIZQCE-MRXNPFEDSA-N 0 0 385.395 3.215 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCC[C@@H]2Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000193902115 1433081376 /nfs/dbraw/zinc/08/13/76/1433081376.db2.gz ZMKNHVVERUKHJN-QGZVFWFLSA-N 0 0 385.395 3.215 20 5 GGBDRN COc1cccc(C(=O)N2CCC[C@H](C(=O)Nc3ccccc3)C2)c1[N+](=O)[O-] ZINC000193912798 1433083232 /nfs/dbraw/zinc/08/32/32/1433083232.db2.gz FHHZTDKDPAGULX-AWEZNQCLSA-N 0 0 383.404 3.094 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000193913624 1433083510 /nfs/dbraw/zinc/08/35/10/1433083510.db2.gz TZLFAROPHYYOIF-ZDUSSCGKSA-N 0 0 391.449 3.058 20 5 GGBDRN C[C@H]1CCCC[C@H]1CNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000193935332 1433088028 /nfs/dbraw/zinc/08/80/28/1433088028.db2.gz DJVVCIGBCDQQPN-JSGCOSHPSA-N 0 0 389.481 3.431 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@H]1CCc1ccccc1 ZINC000193936561 1433088421 /nfs/dbraw/zinc/08/84/21/1433088421.db2.gz BSFVMDCGCZGASA-INIZCTEOSA-N 0 0 397.431 3.166 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3ccnc(OCC(F)(F)F)c3)cc2N1 ZINC000193938095 1433088699 /nfs/dbraw/zinc/08/86/99/1433088699.db2.gz FUJBKILDUGWKRT-UHFFFAOYSA-N 0 0 396.325 3.428 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000193940031 1433089366 /nfs/dbraw/zinc/08/93/66/1433089366.db2.gz SFJGWBWKXDTAGU-JTQLQIEISA-N 0 0 381.310 3.430 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000193942937 1433089653 /nfs/dbraw/zinc/08/96/53/1433089653.db2.gz XCQYNHHSGYOFIU-SNVBAGLBSA-N 0 0 379.319 3.012 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccc2oc(C3CC3)nc2c1)c1cccc([N+](=O)[O-])c1 ZINC000193944973 1433089788 /nfs/dbraw/zinc/08/97/88/1433089788.db2.gz GFVYMTUXWXPXGC-LLVKDONJSA-N 0 0 394.387 3.429 20 5 GGBDRN Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000193943565 1433089810 /nfs/dbraw/zinc/08/98/10/1433089810.db2.gz BLNHZGRERKBNJW-OAHLLOKOSA-N 0 0 396.447 3.319 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cnn(Cc2ccccc2)c1 ZINC000193944590 1433089977 /nfs/dbraw/zinc/08/99/77/1433089977.db2.gz YDSOBZLUYLGVNI-UHFFFAOYSA-N 0 0 381.392 3.170 20 5 GGBDRN C[C@H]1CCCC[C@@H]1CNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000193946032 1433090143 /nfs/dbraw/zinc/09/01/43/1433090143.db2.gz ACBAWSKNGQAQJE-UONOGXRCSA-N 0 0 375.425 3.225 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000193946655 1433090428 /nfs/dbraw/zinc/09/04/28/1433090428.db2.gz QXAULLDMOJHFOK-SFHVURJKSA-N 0 0 389.383 3.026 20 5 GGBDRN Cc1ccccc1C[C@@H](C)NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000193947903 1433090461 /nfs/dbraw/zinc/09/04/61/1433090461.db2.gz OARBZCSDSNSGGT-GFCCVEGCSA-N 0 0 375.812 3.243 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCCCOc1ccc(F)cc1 ZINC000193946740 1433090487 /nfs/dbraw/zinc/09/04/87/1433090487.db2.gz TXRSHXNIYIVART-UHFFFAOYSA-N 0 0 391.399 3.401 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NCc2ccc3ncccc3c2)cc([N+](=O)[O-])c1 ZINC000193958731 1433092330 /nfs/dbraw/zinc/09/23/30/1433092330.db2.gz BTAGFFZCVMSISF-UHFFFAOYSA-N 0 0 379.372 3.250 20 5 GGBDRN COc1cccc(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c1[N+](=O)[O-] ZINC000193963683 1433093225 /nfs/dbraw/zinc/09/32/25/1433093225.db2.gz AUKVVQBRYWRHAU-LBPRGKRZSA-N 0 0 383.404 3.443 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(Cc2ccco2)Cc2ccco2)cc1[N+](=O)[O-] ZINC000193969873 1433093983 /nfs/dbraw/zinc/09/39/83/1433093983.db2.gz HJNYNPNWOQDBQH-UHFFFAOYSA-N 0 0 383.360 3.257 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccco1)Cc1ccco1 ZINC000193969894 1433094027 /nfs/dbraw/zinc/09/40/27/1433094027.db2.gz SFWJJNCZNZXFRN-UHFFFAOYSA-N 0 0 383.360 3.257 20 5 GGBDRN CN(c1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193969598 1433094041 /nfs/dbraw/zinc/09/40/41/1433094041.db2.gz VJLRACMNAYGATG-UHFFFAOYSA-N 0 0 389.202 3.322 20 5 GGBDRN COc1cccc(C(=O)NCc2cccc(NC(=O)C3CCC3)c2)c1[N+](=O)[O-] ZINC000193983023 1433095844 /nfs/dbraw/zinc/09/58/44/1433095844.db2.gz AACVGDZIWXXMME-UHFFFAOYSA-N 0 0 383.404 3.272 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCc3nnc(C4CC4)o3)cc2[N+](=O)[O-])C1 ZINC000193992499 1433097350 /nfs/dbraw/zinc/09/73/50/1433097350.db2.gz KNHJNWNCRZHJAB-BETUJISGSA-N 0 0 399.451 3.268 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccc(C)c2)cc1[N+](=O)[O-] ZINC000193994856 1433098008 /nfs/dbraw/zinc/09/80/08/1433098008.db2.gz CTFQJDGVCOKGDG-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@H]1c1cccc(F)c1 ZINC000194007364 1433099735 /nfs/dbraw/zinc/09/97/35/1433099735.db2.gz IKGXYTXIAZKEPE-INIZCTEOSA-N 0 0 387.367 3.045 20 5 GGBDRN CCN(CC)C(=O)c1ccc(CNC(=O)c2cccc(OC)c2[N+](=O)[O-])cc1 ZINC000194006978 1433099861 /nfs/dbraw/zinc/09/98/61/1433099861.db2.gz IACXTFTZTFPDPK-UHFFFAOYSA-N 0 0 385.420 3.015 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c1[N+](=O)[O-] ZINC000194009494 1433100039 /nfs/dbraw/zinc/10/00/39/1433100039.db2.gz LMGBEZVFYATJFN-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN C[C@@H](c1nc2ccccc2s1)N(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000194021850 1433102218 /nfs/dbraw/zinc/10/22/18/1433102218.db2.gz ZQEWICHXTKVEMB-NSHDSACASA-N 0 0 384.417 3.363 20 5 GGBDRN O=C1OCCN1c1cccc2c1CCN(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2 ZINC000194021113 1433102295 /nfs/dbraw/zinc/10/22/95/1433102295.db2.gz LTBLPEFZWLSYGX-UHFFFAOYSA-N 0 0 398.375 3.018 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000194023023 1433102568 /nfs/dbraw/zinc/10/25/68/1433102568.db2.gz BPKYTSKUIPDIGM-AUUYWEPGSA-N 0 0 385.420 3.275 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000194023050 1433102578 /nfs/dbraw/zinc/10/25/78/1433102578.db2.gz BPKYTSKUIPDIGM-KUHUBIRLSA-N 0 0 385.420 3.275 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(=O)Nc1cccc2ccccc21 ZINC000194026883 1433103479 /nfs/dbraw/zinc/10/34/79/1433103479.db2.gz ANZKSDUTCRSNAR-UHFFFAOYSA-N 0 0 379.372 3.012 20 5 GGBDRN O=C(OCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCN1C(=O)c1cccs1 ZINC000194029158 1433103830 /nfs/dbraw/zinc/10/38/30/1433103830.db2.gz SWFAAIVCXIJAAM-INIZCTEOSA-N 0 0 388.445 3.437 20 5 GGBDRN O=C(c1ccc(F)cc1)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000194031512 1433104079 /nfs/dbraw/zinc/10/40/79/1433104079.db2.gz KURNXTCHPHXYQS-UHFFFAOYSA-N 0 0 392.408 3.018 20 5 GGBDRN COc1ccc(CN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)C2CC2)cc1 ZINC000194030501 1433104081 /nfs/dbraw/zinc/10/40/81/1433104081.db2.gz RUPNRHJKSAJWRL-UHFFFAOYSA-N 0 0 383.404 3.042 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3cccc(OC)c3[N+](=O)[O-])c2)n1 ZINC000194049262 1433107258 /nfs/dbraw/zinc/10/72/58/1433107258.db2.gz IRTGOGLCOTUIHS-UHFFFAOYSA-N 0 0 394.387 3.168 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000194054361 1433108527 /nfs/dbraw/zinc/10/85/27/1433108527.db2.gz ZYNVVOJMGAMDNA-UHFFFAOYSA-N 0 0 391.811 3.162 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000194057746 1433109217 /nfs/dbraw/zinc/10/92/17/1433109217.db2.gz ONZCLOUKROPWGQ-INIZCTEOSA-N 0 0 393.403 3.453 20 5 GGBDRN CN(C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCCCCC1 ZINC000194077026 1433112953 /nfs/dbraw/zinc/11/29/53/1433112953.db2.gz SNGOETFRKRZYIL-UHFFFAOYSA-N 0 0 385.367 3.316 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](C(=O)N1CCCCC1)c1ccccc1 ZINC000194077051 1433112955 /nfs/dbraw/zinc/11/29/55/1433112955.db2.gz FMISCHJVXMWLJP-FQEVSTJZSA-N 0 0 383.448 3.447 20 5 GGBDRN Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c(-c2nc3ccccc3[nH]2)c1 ZINC000194109864 1433119057 /nfs/dbraw/zinc/11/90/57/1433119057.db2.gz SZLZUJJGMYXXEY-UHFFFAOYSA-N 0 0 376.376 3.282 20 5 GGBDRN CCCCOc1ccc([C@@H](C)NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1OC ZINC000194110672 1433119240 /nfs/dbraw/zinc/11/92/40/1433119240.db2.gz OGXNTMBCQHKBJD-GFCCVEGCSA-N 0 0 390.440 3.315 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@H]2CCCC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000194117093 1433120263 /nfs/dbraw/zinc/12/02/63/1433120263.db2.gz MSMGOIMHCLVZNK-GJZGRUSLSA-N 0 0 391.468 3.054 20 5 GGBDRN CCCN(C(=O)c1cccc(CS(C)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000194120400 1433121002 /nfs/dbraw/zinc/12/10/02/1433121002.db2.gz JADQEJPQFXNMLC-UHFFFAOYSA-N 0 0 376.434 3.196 20 5 GGBDRN CCCN(C(=O)CN1c2ccccc2O[C@@H](C)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000194132171 1433122932 /nfs/dbraw/zinc/12/29/32/1433122932.db2.gz QUCKEROARHNUKZ-AWEZNQCLSA-N 0 0 383.404 3.152 20 5 GGBDRN CCCN(C(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000194135368 1433123530 /nfs/dbraw/zinc/12/35/30/1433123530.db2.gz KGQYBUCCSGHJEU-UHFFFAOYSA-N 0 0 396.378 3.337 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)ccc21 ZINC000194142073 1433124818 /nfs/dbraw/zinc/12/48/18/1433124818.db2.gz ORFPCYBNCJVWPT-UHFFFAOYSA-N 0 0 380.404 3.310 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc2[nH]c(Cc3ccccc3F)nc2c1 ZINC000194143844 1433125577 /nfs/dbraw/zinc/12/55/77/1433125577.db2.gz KRQQLPBUAYWPHG-UHFFFAOYSA-N 0 0 394.366 3.036 20 5 GGBDRN CCCN(C(=O)c1cccc(N2CCNC2=O)c1C)c1cccc([N+](=O)[O-])c1 ZINC000194147283 1433126474 /nfs/dbraw/zinc/12/64/74/1433126474.db2.gz RPGKSIBOYKJNHO-UHFFFAOYSA-N 0 0 382.420 3.490 20 5 GGBDRN COc1cccc(C(=O)N[C@@H](C)c2cccc(N3CCCC3=O)c2)c1[N+](=O)[O-] ZINC000194154465 1433127778 /nfs/dbraw/zinc/12/77/78/1433127778.db2.gz NDJGWUAYGNTLGR-ZDUSSCGKSA-N 0 0 383.404 3.221 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000194159598 1433128646 /nfs/dbraw/zinc/12/86/46/1433128646.db2.gz MXCOFRCCQOMAQG-UHFFFAOYSA-N 0 0 381.392 3.353 20 5 GGBDRN O=C(NC[C@@H]1CCCC1=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000194160766 1433128659 /nfs/dbraw/zinc/12/86/59/1433128659.db2.gz FQOUBOBPSPDCHP-VIFPVBQESA-N 0 0 397.218 3.186 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3ccc(-n4ccnc4)c(F)c3)cc2N1 ZINC000194185131 1433133882 /nfs/dbraw/zinc/13/38/82/1433133882.db2.gz YJTCGZRUGZFLTR-UHFFFAOYSA-N 0 0 381.367 3.416 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000194183318 1433134109 /nfs/dbraw/zinc/13/41/09/1433134109.db2.gz OCJHMADSGPYPLN-HIFRSBDPSA-N 0 0 393.509 3.474 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2ccc(-c3cnco3)cc2)cc1[N+](=O)[O-] ZINC000194194952 1433136040 /nfs/dbraw/zinc/13/60/40/1433136040.db2.gz CZYNGFGXUVWCKN-UHFFFAOYSA-N 0 0 375.362 3.059 20 5 GGBDRN CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)CC1=O ZINC000194211055 1433139696 /nfs/dbraw/zinc/13/96/96/1433139696.db2.gz DKBDPIUHTPMDQB-AWEZNQCLSA-N 0 0 391.493 3.228 20 5 GGBDRN Cc1c(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cnn1C1CCCC1 ZINC000194221368 1433141373 /nfs/dbraw/zinc/14/13/73/1433141373.db2.gz JNQUPYXPCLQMHB-UHFFFAOYSA-N 0 0 378.454 3.199 20 5 GGBDRN COc1cccc(C(=O)NCC(=O)Nc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000194234205 1433145016 /nfs/dbraw/zinc/14/50/16/1433145016.db2.gz PDXUKUDCPNXJEO-UHFFFAOYSA-N 0 0 379.372 3.125 20 5 GGBDRN CN(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1cccc2ccccc21 ZINC000194236544 1433145570 /nfs/dbraw/zinc/14/55/70/1433145570.db2.gz UIGNRGWURAYOEA-UHFFFAOYSA-N 0 0 384.413 3.428 20 5 GGBDRN COC[C@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccc(Cl)cc1 ZINC000194277254 1433154045 /nfs/dbraw/zinc/15/40/45/1433154045.db2.gz SJLOFKBVDCKLSL-INIZCTEOSA-N 0 0 393.827 3.444 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000194290868 1433156511 /nfs/dbraw/zinc/15/65/11/1433156511.db2.gz STLZTYDXMKABCT-GFCCVEGCSA-N 0 0 397.460 3.367 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NC3(c4nc[nH]n4)CCC3)cc2[N+](=O)[O-])C1 ZINC000194292856 1433156781 /nfs/dbraw/zinc/15/67/81/1433156781.db2.gz ALEAKRCSDWYQSH-KBPBESRZSA-N 0 0 398.467 3.004 20 5 GGBDRN CCCn1c(C)nnc1C[S@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194298321 1433157811 /nfs/dbraw/zinc/15/78/11/1433157811.db2.gz XEXCTGPNASDAND-HHHXNRCGSA-N 0 0 389.437 3.009 20 5 GGBDRN Cc1c2cc(F)ccc2oc1CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000194301734 1433158052 /nfs/dbraw/zinc/15/80/52/1433158052.db2.gz PHUUODHDHNJFHT-UHFFFAOYSA-N 0 0 395.350 3.299 20 5 GGBDRN COc1cccc(C(=O)NCCOc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000194305483 1433158566 /nfs/dbraw/zinc/15/85/66/1433158566.db2.gz KUCMQVVTHJDNMZ-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN COc1cccc(C(=O)Nc2nnc(Cc3cccc(F)c3)s2)c1[N+](=O)[O-] ZINC000194312021 1433159444 /nfs/dbraw/zinc/15/94/44/1433159444.db2.gz NHVKKFABPNUOPG-UHFFFAOYSA-N 0 0 388.380 3.437 20 5 GGBDRN CCn1cnc2c(c1=O)CCN(C(=O)c1cc3ccccc3c3cccnc13)C2 ZINC000194325889 1433161766 /nfs/dbraw/zinc/16/17/66/1433161766.db2.gz BBTPGRKDZPSDRL-UHFFFAOYSA-N 0 0 384.439 3.163 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C2CC2)cc1 ZINC000194338592 1433163855 /nfs/dbraw/zinc/16/38/55/1433163855.db2.gz ZXDDQEUYXHQRQB-MRXNPFEDSA-N 0 0 380.397 3.172 20 5 GGBDRN COc1ccc2cc(CNS(=O)(=O)c3cccc(F)c3[N+](=O)[O-])ccc2c1 ZINC000194338974 1433163892 /nfs/dbraw/zinc/16/38/92/1433163892.db2.gz RTFBLLAEXIYNQU-UHFFFAOYSA-N 0 0 390.392 3.374 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCc1csc(-c2ccccc2)n1 ZINC000194340010 1433164154 /nfs/dbraw/zinc/16/41/54/1433164154.db2.gz RJSIVUOEEZXDFS-UHFFFAOYSA-N 0 0 393.421 3.336 20 5 GGBDRN C[C@H](NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000194341167 1433164167 /nfs/dbraw/zinc/16/41/67/1433164167.db2.gz JHUMDZZMTMTLNY-VIFPVBQESA-N 0 0 390.339 3.375 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(N2C[C@@H](C)O[C@H](C)C2)ccn1 ZINC000194362791 1433167230 /nfs/dbraw/zinc/16/72/30/1433167230.db2.gz CVJXSTSKZDFYCF-HUUCEWRRSA-N 0 0 384.436 3.473 20 5 GGBDRN COc1cccc(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)c1[N+](=O)[O-] ZINC000194371353 1433168349 /nfs/dbraw/zinc/16/83/49/1433168349.db2.gz WXDZURPHCPRMEX-UHFFFAOYSA-N 0 0 388.767 3.237 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)c1 ZINC000194388780 1433170853 /nfs/dbraw/zinc/17/08/53/1433170853.db2.gz ZWZZAWXDDVHOKC-UHFFFAOYSA-N 0 0 381.432 3.200 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(C(=O)c2ccccc2F)CC1 ZINC000194389303 1433170939 /nfs/dbraw/zinc/17/09/39/1433170939.db2.gz SYAKRDDIRLJYOO-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN Cn1cc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1=O ZINC000194396188 1433171742 /nfs/dbraw/zinc/17/17/42/1433171742.db2.gz IPOGRWHDTCSLTP-UHFFFAOYSA-N 0 0 387.339 3.043 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(CN(C(C)=O)C3CC3)cc2)c1[N+](=O)[O-] ZINC000194397347 1433172010 /nfs/dbraw/zinc/17/20/10/1433172010.db2.gz ABNDFRDURXEVQW-UHFFFAOYSA-N 0 0 383.404 3.367 20 5 GGBDRN C[C@H](NC(=O)NCCc1nccn1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000194407729 1433173217 /nfs/dbraw/zinc/17/32/17/1433173217.db2.gz CGXXUSHFAVRJPO-INIZCTEOSA-N 0 0 393.447 3.443 20 5 GGBDRN C[C@@H](NC(=O)NCCc1nccn1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000194407738 1433173254 /nfs/dbraw/zinc/17/32/54/1433173254.db2.gz CGXXUSHFAVRJPO-MRXNPFEDSA-N 0 0 393.447 3.443 20 5 GGBDRN COCCCCN(Cc1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000194413836 1433174072 /nfs/dbraw/zinc/17/40/72/1433174072.db2.gz XBCJVFVKTMCGTA-UHFFFAOYSA-N 0 0 378.450 3.212 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(O)(c1ccccc1)c1ccccc1 ZINC000194417078 1433174862 /nfs/dbraw/zinc/17/48/62/1433174862.db2.gz TUJUKYDMFFQNRB-UHFFFAOYSA-N 0 0 392.411 3.156 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCC(=O)c1ccc(F)cc1F ZINC000194419251 1433175168 /nfs/dbraw/zinc/17/51/68/1433175168.db2.gz SQRHBOJXLVVBRM-UHFFFAOYSA-N 0 0 378.331 3.161 20 5 GGBDRN Cc1cc(C(=O)NCCCc2cc(N)n(-c3ccccc3)n2)cc([N+](=O)[O-])c1 ZINC000194421546 1433175420 /nfs/dbraw/zinc/17/54/20/1433175420.db2.gz HFJNEOCODSQZTF-UHFFFAOYSA-N 0 0 379.420 3.034 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 ZINC000194425365 1433176047 /nfs/dbraw/zinc/17/60/47/1433176047.db2.gz KPFBYNUVLFEKDF-UHFFFAOYSA-N 0 0 394.256 3.440 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000194427767 1433176334 /nfs/dbraw/zinc/17/63/34/1433176334.db2.gz KEBZQOPZEAEKRA-NSHDSACASA-N 0 0 391.811 3.436 20 5 GGBDRN CN(CC(=O)N(C)Cc1ccc(F)cc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000194428473 1433176629 /nfs/dbraw/zinc/17/66/29/1433176629.db2.gz JYSRBUUBTDWYRS-UHFFFAOYSA-N 0 0 379.819 3.478 20 5 GGBDRN COc1cccc(CN(C)C(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000194428451 1433176656 /nfs/dbraw/zinc/17/66/56/1433176656.db2.gz QRWOVRQRCARKSV-UHFFFAOYSA-N 0 0 391.855 3.347 20 5 GGBDRN O=C(c1ccsc1)N1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000194439242 1433178052 /nfs/dbraw/zinc/17/80/52/1433178052.db2.gz LRIRIXOFMWLMSK-UHFFFAOYSA-N 0 0 393.852 3.298 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(C(=O)C3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000194447382 1433179528 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ZINC000194551852 1433196069 /nfs/dbraw/zinc/19/60/69/1433196069.db2.gz UKMGSXHFUAHYGP-MRXNPFEDSA-N 0 0 398.463 3.334 20 5 GGBDRN COc1cccc(C(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000194554612 1433196361 /nfs/dbraw/zinc/19/63/61/1433196361.db2.gz ZEXJGMFITWCHFC-QDXKXIGTSA-N 0 0 376.434 3.174 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000194559127 1433197261 /nfs/dbraw/zinc/19/72/61/1433197261.db2.gz MCFRWJPLJBEGKG-OAHLLOKOSA-N 0 0 390.484 3.336 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194558570 1433197299 /nfs/dbraw/zinc/19/72/99/1433197299.db2.gz JAOZPYVGWYGNDZ-CQSZACIVSA-N 0 0 399.407 3.096 20 5 GGBDRN CCOC1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC1 ZINC000194578290 1433200490 /nfs/dbraw/zinc/20/04/90/1433200490.db2.gz INKCGNBNCGHXIQ-UHFFFAOYSA-N 0 0 375.469 3.472 20 5 GGBDRN C[C@H](Sc1n[nH]c(Cc2ccccc2)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000194589221 1433202510 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384.436 3.319 20 5 GGBDRN COc1ccc(CN(C)C(=O)[C@@H](C)Sc2ncccc2[N+](=O)[O-])cc1F ZINC000194659491 1433212259 /nfs/dbraw/zinc/21/22/59/1433212259.db2.gz HCSPBWZWVHQVQI-LLVKDONJSA-N 0 0 379.413 3.277 20 5 GGBDRN CC(C)c1ncc(Cl)c(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000194670221 1433213524 /nfs/dbraw/zinc/21/35/24/1433213524.db2.gz BSWPOCGQUFBCJR-UHFFFAOYSA-N 0 0 389.843 3.124 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(NC(C)=O)cc1 ZINC000194675286 1433214079 /nfs/dbraw/zinc/21/40/79/1433214079.db2.gz FLSAWCCGQKUPDV-UHFFFAOYSA-N 0 0 377.422 3.159 20 5 GGBDRN COc1ccc(-c2noc(-c3cccc([N+](=O)[O-])c3N3CCOCC3)n2)cc1 ZINC000194713167 1433218904 /nfs/dbraw/zinc/21/89/04/1433218904.db2.gz SHPKCLISSVPWIQ-UHFFFAOYSA-N 0 0 382.376 3.157 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CCc3ccccc3)no2)c1N1CCOCC1 ZINC000194718152 1433219355 /nfs/dbraw/zinc/21/93/55/1433219355.db2.gz HEQLMQHQMQTERY-UHFFFAOYSA-N 0 0 380.404 3.267 20 5 GGBDRN COc1cccc(C(=O)N[C@H](C)Cc2cc(C)nn2-c2ccccc2)c1[N+](=O)[O-] ZINC000194740427 1433222762 /nfs/dbraw/zinc/22/27/62/1433222762.db2.gz SIOBNJUJMMJUQL-CQSZACIVSA-N 0 0 394.431 3.459 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 ZINC000194742524 1433223013 /nfs/dbraw/zinc/22/30/13/1433223013.db2.gz KKEIGGADLNDXNY-UHFFFAOYSA-N 0 0 387.823 3.041 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(OCc2ccccn2)c(Cl)c1 ZINC000194747752 1433224121 /nfs/dbraw/zinc/22/41/21/1433224121.db2.gz CLNMGFWEXXNWSW-UHFFFAOYSA-N 0 0 387.783 3.057 20 5 GGBDRN CCn1ncc2ccc(NC(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)cc21 ZINC000194767338 1433227822 /nfs/dbraw/zinc/22/78/22/1433227822.db2.gz BWXOVKSPJGECSU-UHFFFAOYSA-N 0 0 394.435 3.319 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000194772794 1433228724 /nfs/dbraw/zinc/22/87/24/1433228724.db2.gz ZNCNFNSLRQJJMD-UHFFFAOYSA-N 0 0 385.376 3.495 20 5 GGBDRN COc1cc(CCNC(=O)NCCc2cccc(C)c2)c([N+](=O)[O-])cc1OC ZINC000194790336 1433233065 /nfs/dbraw/zinc/23/30/65/1433233065.db2.gz 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O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000194818941 1433239732 /nfs/dbraw/zinc/23/97/32/1433239732.db2.gz RRIMJHKPABZKJL-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1 ZINC000194823061 1433240753 /nfs/dbraw/zinc/24/07/53/1433240753.db2.gz QIPSTUUDBXXQPS-UHFFFAOYSA-N 0 0 383.404 3.064 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cnn1C1CCCC1 ZINC000194845071 1433246955 /nfs/dbraw/zinc/24/69/55/1433246955.db2.gz DVWUGLVSGYGGTL-UHFFFAOYSA-N 0 0 391.815 3.445 20 5 GGBDRN COc1cccc(C(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)c1[N+](=O)[O-] ZINC000194857046 1433249385 /nfs/dbraw/zinc/24/93/85/1433249385.db2.gz WHFPTDUMIYPLIK-UHFFFAOYSA-N 0 0 394.391 3.153 20 5 GGBDRN COc1cccc(C(=O)Nc2ccccc2-c2nnnn2C(C)C)c1[N+](=O)[O-] ZINC000194856918 1433249629 /nfs/dbraw/zinc/24/96/29/1433249629.db2.gz UEFGIABOQMPKCU-UHFFFAOYSA-N 0 0 382.380 3.090 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NCc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])n2)c1 ZINC000194858511 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COc1ccc(Cn2ccc(NC(=O)c3cccc(OC)c3[N+](=O)[O-])n2)cc1 ZINC000194920096 1433264319 /nfs/dbraw/zinc/26/43/19/1433264319.db2.gz ROIULPMMJAMQJR-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN COCCOc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(C)c1 ZINC000194920564 1433264870 /nfs/dbraw/zinc/26/48/70/1433264870.db2.gz ZDPFUPBOTVSFPT-UHFFFAOYSA-N 0 0 396.403 3.366 20 5 GGBDRN COc1ccc(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000194926431 1433265895 /nfs/dbraw/zinc/26/58/95/1433265895.db2.gz BWYZWXBHGKFFNA-UHFFFAOYSA-N 0 0 386.379 3.478 20 5 GGBDRN CN(C)c1noc([C@@H]2CCCN(Cc3cc([N+](=O)[O-])ccc3OC(F)F)C2)n1 ZINC000194930819 1433266854 /nfs/dbraw/zinc/26/68/54/1433266854.db2.gz OSXQANURNSTKPS-LLVKDONJSA-N 0 0 397.382 3.025 20 5 GGBDRN COc1cccc(C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c1[N+](=O)[O-] ZINC000194936155 1433268024 /nfs/dbraw/zinc/26/80/24/1433268024.db2.gz YCGCCWXUDWMZOS-UHFFFAOYSA-N 0 0 383.404 3.304 20 5 GGBDRN O=C(Nc1cnn(Cc2ccccn2)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000194935823 1433268101 /nfs/dbraw/zinc/26/81/01/1433268101.db2.gz OZWOMIWFZPTDDJ-UHFFFAOYSA-N 0 0 378.392 3.061 20 5 GGBDRN O=C(Nc1cnn(Cc2ccccn2)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000194942229 1433269416 /nfs/dbraw/zinc/26/94/16/1433269416.db2.gz ANMIMOLUMVGEML-UHFFFAOYSA-N 0 0 392.419 3.087 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC(OCCc2ccccc2)CC1 ZINC000194942161 1433269492 /nfs/dbraw/zinc/26/94/92/1433269492.db2.gz XSGZNJKILKCGFQ-UHFFFAOYSA-N 0 0 399.403 3.367 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1sc2c(c1C(N)=O)CCCCC2 ZINC000194950701 1433271374 /nfs/dbraw/zinc/27/13/74/1433271374.db2.gz UCFYCWIIZWGXKY-UHFFFAOYSA-N 0 0 389.433 3.285 20 5 GGBDRN CC(C)CC(=O)Nc1cccc(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000194972430 1433274728 /nfs/dbraw/zinc/27/47/28/1433274728.db2.gz IDXROWONAFUFRE-UHFFFAOYSA-N 0 0 391.449 3.058 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000194971348 1433274784 /nfs/dbraw/zinc/27/47/84/1433274784.db2.gz SLLLRWUQCRBWSV-UHFFFAOYSA-N 0 0 382.420 3.461 20 5 GGBDRN O=C(Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000194971340 1433274788 /nfs/dbraw/zinc/27/47/88/1433274788.db2.gz NNHUBMXSBWGIKJ-MRXNPFEDSA-N 0 0 392.375 3.451 20 5 GGBDRN COc1ccccc1N1CC[C@@H](CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000194977055 1433275867 /nfs/dbraw/zinc/27/58/67/1433275867.db2.gz AOLAZTDXVFBHDE-AWEZNQCLSA-N 0 0 396.447 3.427 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O ZINC000194992652 1433277885 /nfs/dbraw/zinc/27/78/85/1433277885.db2.gz LOSBMMSSGNAHDZ-CQSZACIVSA-N 0 0 391.786 3.231 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O ZINC000194992668 1433277954 /nfs/dbraw/zinc/27/79/54/1433277954.db2.gz LOSBMMSSGNAHDZ-AWEZNQCLSA-N 0 0 391.786 3.231 20 5 GGBDRN CCO[C@@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000195008389 1433280072 /nfs/dbraw/zinc/28/00/72/1433280072.db2.gz WZXMJDBDRJWCCG-INIZCTEOSA-N 0 0 391.811 3.081 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C ZINC000195037628 1433284083 /nfs/dbraw/zinc/28/40/83/1433284083.db2.gz CNTBBEQFIXDAEM-HZPDHXFCSA-N 0 0 377.441 3.469 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000195044778 1433284786 /nfs/dbraw/zinc/28/47/86/1433284786.db2.gz RADFYFFBSGOPPN-UHFFFAOYSA-N 0 0 384.392 3.349 20 5 GGBDRN CCOc1ccc([C@H]2CCCN2C(=O)Cn2cc([N+](=O)[O-])c(C3CC3)n2)cc1 ZINC000195053169 1433285767 /nfs/dbraw/zinc/28/57/67/1433285767.db2.gz YEMWGSIDFMGYFD-QGZVFWFLSA-N 0 0 384.436 3.431 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H](c2nccs2)c2ccccc2)c1 ZINC000195061449 1433286939 /nfs/dbraw/zinc/28/69/39/1433286939.db2.gz NAGJKSYXQYVSAW-FUHWJXTLSA-N 0 0 385.445 3.170 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H](c2nccs2)c2ccccc2)c1 ZINC000195061437 1433286984 /nfs/dbraw/zinc/28/69/84/1433286984.db2.gz NAGJKSYXQYVSAW-WMZOPIPTSA-N 0 0 385.445 3.170 20 5 GGBDRN O=C(CN[C@@H](c1nccs1)c1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000195064160 1433287624 /nfs/dbraw/zinc/28/76/24/1433287624.db2.gz JRLMXUKTBIFBGS-LJQANCHMSA-N 0 0 394.456 3.320 20 5 GGBDRN C[C@H]1CCc2ccccc2N1C(=O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000195066726 1433287892 /nfs/dbraw/zinc/28/78/92/1433287892.db2.gz UIUIJBQWYRSHIR-AWEZNQCLSA-N 0 0 377.404 3.221 20 5 GGBDRN CN(C)c1ccc2cc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)ccc2n1 ZINC000195071972 1433288859 /nfs/dbraw/zinc/28/88/59/1433288859.db2.gz PQGSJKIKEUCQGX-UHFFFAOYSA-N 0 0 376.376 3.338 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1CCOc1ccccc1C(F)(F)F ZINC000195090572 1433291045 /nfs/dbraw/zinc/29/10/45/1433291045.db2.gz ITLXEWCGBKMOFC-UHFFFAOYSA-N 0 0 379.294 3.403 20 5 GGBDRN CSc1ccc(C(=O)N2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000195095936 1433291636 /nfs/dbraw/zinc/29/16/36/1433291636.db2.gz BCDSYRBZQJLZLT-LZWOXQAQSA-N 0 0 393.509 3.031 20 5 GGBDRN CC[C@H](C)[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)OC ZINC000195094554 1433291653 /nfs/dbraw/zinc/29/16/53/1433291653.db2.gz FBBUEWZZVLBWBX-IINYFYTJSA-N 0 0 377.422 3.036 20 5 GGBDRN Nc1cccc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 ZINC000195129071 1433296642 /nfs/dbraw/zinc/29/66/42/1433296642.db2.gz ROOZFTQWLUSQAF-UHFFFAOYSA-N 0 0 394.353 3.158 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000195128421 1433296769 /nfs/dbraw/zinc/29/67/69/1433296769.db2.gz STGNLORDYUTYGX-UHFFFAOYSA-N 0 0 397.218 3.195 20 5 GGBDRN CC(C)N(CC1CCC1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000195132748 1433297121 /nfs/dbraw/zinc/29/71/21/1433297121.db2.gz HCSWAKIIVBAATM-UHFFFAOYSA-N 0 0 375.425 3.320 20 5 GGBDRN CC(C)c1ccc(CN2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC2)cc1 ZINC000195134182 1433297252 /nfs/dbraw/zinc/29/72/52/1433297252.db2.gz CANJXYWYIVRKCC-UHFFFAOYSA-N 0 0 382.464 3.258 20 5 GGBDRN O=C(Nc1nc(-c2ccc[nH]2)cs1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000195148878 1433299538 /nfs/dbraw/zinc/29/95/38/1433299538.db2.gz AYPSKJUQGPMTHY-UHFFFAOYSA-N 0 0 380.389 3.484 20 5 GGBDRN CCOC(=O)[C@H](C)NC(=O)c1ccc(NCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000195154566 1433300437 /nfs/dbraw/zinc/30/04/37/1433300437.db2.gz MXPIFYZMJLNLAN-AWEZNQCLSA-N 0 0 385.420 3.197 20 5 GGBDRN CCS(=O)(=O)C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000195156851 1433300802 /nfs/dbraw/zinc/30/08/02/1433300802.db2.gz OKHIXFHHYSXDNK-UHFFFAOYSA-N 0 0 378.450 3.254 20 5 GGBDRN COc1ccccc1N1CC[C@H](CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000195169431 1433302194 /nfs/dbraw/zinc/30/21/94/1433302194.db2.gz RBTDXBJJXWAOEC-HZPDHXFCSA-N 0 0 398.463 3.490 20 5 GGBDRN O=C(N[C@@H]1CCCOc2ccccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000195176033 1433302993 /nfs/dbraw/zinc/30/29/93/1433302993.db2.gz XITYMHVERUXIBR-LJQANCHMSA-N 0 0 396.447 3.340 20 5 GGBDRN O=C(N[C@@H]1CCCOc2ccccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000195176644 1433303294 /nfs/dbraw/zinc/30/32/94/1433303294.db2.gz SVYBCYSGINGYPV-QGZVFWFLSA-N 0 0 396.447 3.340 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n(C)n1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000195176881 1433303360 /nfs/dbraw/zinc/30/33/60/1433303360.db2.gz YGZAKZIOWLYKDZ-UHFFFAOYSA-N 0 0 393.447 3.282 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000195176216 1433303400 /nfs/dbraw/zinc/30/34/00/1433303400.db2.gz KAVACOSDNNHODE-UHFFFAOYSA-N 0 0 379.420 3.272 20 5 GGBDRN C[C@H]1CCCN(Cc2csc(NC(=O)c3cc([N+](=O)[O-])ccc3N)n2)C1 ZINC000195180430 1433303705 /nfs/dbraw/zinc/30/37/05/1433303705.db2.gz SNINBRHGVKMCSZ-NSHDSACASA-N 0 0 375.454 3.118 20 5 GGBDRN O=C(NCc1nccn1C(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000195186316 1433304509 /nfs/dbraw/zinc/30/45/09/1433304509.db2.gz GKVSSHJBXIVIJJ-UHFFFAOYSA-N 0 0 379.348 3.240 20 5 GGBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2CCOc2ccc([N+](=O)[O-])cc2)o1 ZINC000195198953 1433306212 /nfs/dbraw/zinc/30/62/12/1433306212.db2.gz XNZZVJXFNDYDKP-IBGZPJMESA-N 0 0 380.404 3.465 20 5 GGBDRN CCn1c(-c2ccc(C)cc2)nnc1S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000195219610 1433308331 /nfs/dbraw/zinc/30/83/31/1433308331.db2.gz RSGWIWNAJVKTKH-UHFFFAOYSA-N 0 0 386.433 3.156 20 5 GGBDRN Cc1c(C(=O)N2CCN(C)C[C@@H]2c2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195220330 1433308634 /nfs/dbraw/zinc/30/86/34/1433308634.db2.gz QGVGZNXDXGGNGZ-GOSISDBHSA-N 0 0 398.419 3.249 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1 ZINC000195227150 1433309564 /nfs/dbraw/zinc/30/95/64/1433309564.db2.gz QPHHMWGEIJLBBO-UHFFFAOYSA-N 0 0 386.364 3.008 20 5 GGBDRN O=C(CCCc1ccccc1)N1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000195229967 1433309877 /nfs/dbraw/zinc/30/98/77/1433309877.db2.gz HIWGDHKQDOXNCU-UHFFFAOYSA-N 0 0 394.475 3.234 20 5 GGBDRN Cc1c(C(=O)N2CCn3c4ccccc4nc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195229009 1433309935 /nfs/dbraw/zinc/30/99/35/1433309935.db2.gz CJUQDYNJYCLDSO-UHFFFAOYSA-N 0 0 381.348 3.130 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(OCCc3ccccc3)CC2)cc1 ZINC000195233991 1433310424 /nfs/dbraw/zinc/31/04/24/1433310424.db2.gz CQFBZOFULBEAQU-UHFFFAOYSA-N 0 0 390.461 3.007 20 5 GGBDRN CN(C(C1CC1)C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000195257604 1433312441 /nfs/dbraw/zinc/31/24/41/1433312441.db2.gz IDPSCSQYVNBQJR-UHFFFAOYSA-N 0 0 389.271 3.166 20 5 GGBDRN COc1cc(OCC(=O)Oc2c(F)c(F)cc(F)c2F)ccc1[N+](=O)[O-] ZINC000195261145 1433312920 /nfs/dbraw/zinc/31/29/20/1433312920.db2.gz CLEFLJRPNXILDW-UHFFFAOYSA-N 0 0 375.230 3.144 20 5 GGBDRN O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCCN(C(=O)N2CCCC2)C1 ZINC000195263092 1433313184 /nfs/dbraw/zinc/31/31/84/1433313184.db2.gz NSHNJHBLPJECMP-LBPRGKRZSA-N 0 0 381.816 3.081 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195266332 1433313335 /nfs/dbraw/zinc/31/33/35/1433313335.db2.gz LLDLBGQRKXYIFD-NSHDSACASA-N 0 0 398.375 3.105 20 5 GGBDRN CCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000195279665 1433314553 /nfs/dbraw/zinc/31/45/53/1433314553.db2.gz UQPRSIVLPQFHOR-UHFFFAOYSA-N 0 0 392.209 3.359 20 5 GGBDRN CSc1ccc(C(=O)NC2CCN(C(=O)CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000195297317 1433316467 /nfs/dbraw/zinc/31/64/67/1433316467.db2.gz SDZRMFCZJWKBHK-UHFFFAOYSA-N 0 0 379.482 3.084 20 5 GGBDRN CCOc1ccc(C(C)=O)cc1Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000195298968 1433316541 /nfs/dbraw/zinc/31/65/41/1433316541.db2.gz UPIMUZUVYIYHHW-UHFFFAOYSA-N 0 0 393.399 3.468 20 5 GGBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])s2)cccc1C(=O)N1CCSCC1 ZINC000195305235 1433317122 /nfs/dbraw/zinc/31/71/22/1433317122.db2.gz DSEOZIXLHGWQPL-UHFFFAOYSA-N 0 0 391.474 3.406 20 5 GGBDRN CN(CCCOc1cccc(S(C)(=O)=O)c1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000195317265 1433318419 /nfs/dbraw/zinc/31/84/19/1433318419.db2.gz GISJSMLPTFIITN-UHFFFAOYSA-N 0 0 396.440 3.038 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000195322172 1433318970 /nfs/dbraw/zinc/31/89/70/1433318970.db2.gz BGDWECNLYIVAPT-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccnn2[C@@H]2CCCc3ccccc32)c1[N+](=O)[O-] ZINC000195326378 1433319627 /nfs/dbraw/zinc/31/96/27/1433319627.db2.gz SDDMXZJGDTZUQY-OAHLLOKOSA-N 0 0 380.408 3.011 20 5 GGBDRN CCn1c(CCNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)nc2ccccc21 ZINC000195331144 1433320055 /nfs/dbraw/zinc/32/00/55/1433320055.db2.gz PZLZCQLLSUAOOY-UHFFFAOYSA-N 0 0 397.391 3.154 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2nc(-c3ccccc3)c(C(C)=O)s2)c1[N+](=O)[O-] ZINC000195339605 1433320475 /nfs/dbraw/zinc/32/04/75/1433320475.db2.gz AKZSPDXLHPRSGJ-UHFFFAOYSA-N 0 0 385.405 3.459 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000195341938 1433320830 /nfs/dbraw/zinc/32/08/30/1433320830.db2.gz LWRNMAOTWRKWEG-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN COc1cc(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(OC)cc1Cl ZINC000195344540 1433321047 /nfs/dbraw/zinc/32/10/47/1433321047.db2.gz DNXTYEOFTSUQPV-UHFFFAOYSA-N 0 0 391.811 3.267 20 5 GGBDRN O=C(COC(=O)c1cc(Br)cs1)Nc1cccc([N+](=O)[O-])c1 ZINC000195346499 1433321384 /nfs/dbraw/zinc/32/13/84/1433321384.db2.gz PONZKHKICQWULK-UHFFFAOYSA-N 0 0 385.195 3.214 20 5 GGBDRN COCCN(C(=O)C[C@H](C)OC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000195347102 1433321404 /nfs/dbraw/zinc/32/14/04/1433321404.db2.gz XMTKBFMWXMGYEA-LBPRGKRZSA-N 0 0 379.438 3.123 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CCC[C@H](c3nccs3)C2)c([N+](=O)[O-])c1 ZINC000195347123 1433321416 /nfs/dbraw/zinc/32/14/16/1433321416.db2.gz PYQXOVHTZFUFLD-OLZOCXBDSA-N 0 0 390.465 3.267 20 5 GGBDRN Cc1ccc(N(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)C(C)C)cc1 ZINC000195349480 1433321695 /nfs/dbraw/zinc/32/16/95/1433321695.db2.gz KCRTUGJDUFCDRH-UHFFFAOYSA-N 0 0 376.434 3.362 20 5 GGBDRN NC(=O)C1(NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CCCCC1 ZINC000195356872 1433322377 /nfs/dbraw/zinc/32/23/77/1433322377.db2.gz PRWJQTXYNPTXAL-UHFFFAOYSA-N 0 0 397.431 3.092 20 5 GGBDRN CCn1ncc2ccc(NC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)cc21 ZINC000195357303 1433322497 /nfs/dbraw/zinc/32/24/97/1433322497.db2.gz BSHQGMLQDGWMIQ-UHFFFAOYSA-N 0 0 376.376 3.402 20 5 GGBDRN 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O=C(CNCc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCCc2ccccc21 ZINC000237817859 1433425699 /nfs/dbraw/zinc/42/56/99/1433425699.db2.gz YRZVXDCOZIVPLW-UHFFFAOYSA-N 0 0 391.374 3.265 20 5 GGBDRN O=[N+]([O-])c1cc(CNCc2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1 ZINC000237977204 1433437727 /nfs/dbraw/zinc/43/77/27/1433437727.db2.gz DVXCFALFKCBDKS-UHFFFAOYSA-N 0 0 395.506 3.121 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H](c2ccccc2)OC[C@H]1C ZINC000245406204 1433461771 /nfs/dbraw/zinc/46/17/71/1433461771.db2.gz WJKPONOQFBJOIM-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)c1[N+](=O)[O-] ZINC000245414133 1433463016 /nfs/dbraw/zinc/46/30/16/1433463016.db2.gz CSDWPXFMMCUCFP-KHXSAUHESA-N 0 0 391.449 3.101 20 5 GGBDRN Cc1cccc(NC(=O)[C@H](C)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000245432047 1433466541 /nfs/dbraw/zinc/46/65/41/1433466541.db2.gz BBYYBOYVWAGNTM-JKSUJKDBSA-N 0 0 383.452 3.120 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H](COCc2ccccc2)C1 ZINC000245445776 1433469207 /nfs/dbraw/zinc/46/92/07/1433469207.db2.gz KQKMUIZLVIKMLZ-SJLPKXTDSA-N 0 0 383.448 3.461 20 5 GGBDRN COc1ccc(NC(=O)CN2C[C@@H](C)OC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000245450425 1433470007 /nfs/dbraw/zinc/47/00/07/1433470007.db2.gz OOUWQHNKGPLJJJ-AUUYWEPGSA-N 0 0 385.420 3.004 20 5 GGBDRN Cc1ccccc1[C@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@@H](C)CO1 ZINC000245449925 1433470008 /nfs/dbraw/zinc/47/00/08/1433470008.db2.gz OECSYNSYLBDEHY-HRAATJIYSA-N 0 0 395.459 3.254 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@@H](C)CO1 ZINC000245449927 1433470009 /nfs/dbraw/zinc/47/00/09/1433470009.db2.gz OECSYNSYLBDEHY-KKSFZXQISA-N 0 0 395.459 3.254 20 5 GGBDRN O=C1[C@@H]([N@@H+]2CC[C@H](COCc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000245449635 1433470249 /nfs/dbraw/zinc/47/02/49/1433470249.db2.gz NWKXGVFKDMBYHM-RXVVDRJESA-N 0 0 395.459 3.239 20 5 GGBDRN CCOc1ccc(NC(=O)CN2C[C@H](C)OC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000245458363 1433471904 /nfs/dbraw/zinc/47/19/04/1433471904.db2.gz UUXMBCKHZNNFAJ-YWZLYKJASA-N 0 0 399.447 3.394 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N2CCO[C@@]3(CCc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000245512415 1433479471 /nfs/dbraw/zinc/47/94/71/1433479471.db2.gz NNUKOWZQKXQAIC-ZHRRBRCNSA-N 0 0 395.459 3.404 20 5 GGBDRN O=C(O[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000245520326 1433480712 /nfs/dbraw/zinc/48/07/12/1433480712.db2.gz BRANVQVLHIDWTR-CGTJXYLNSA-N 0 0 383.404 3.285 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000245522766 1433480713 /nfs/dbraw/zinc/48/07/13/1433480713.db2.gz UNJABSODDGAGFE-BTYIYWSLSA-N 0 0 381.432 3.096 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000245522771 1433480734 /nfs/dbraw/zinc/48/07/34/1433480734.db2.gz UNJABSODDGAGFE-VFNWGFHPSA-N 0 0 381.432 3.096 20 5 GGBDRN Cc1cc(S(=O)(=O)N2c3ccccc3N(C)CC[C@H]2C)cc([N+](=O)[O-])c1F ZINC000245543178 1433483119 /nfs/dbraw/zinc/48/31/19/1433483119.db2.gz SIWJGRNBZRZHIX-CYBMUJFWSA-N 0 0 393.440 3.466 20 5 GGBDRN C[C@@H]1C[C@@H](NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C[C@H](C)O1 ZINC000245599399 1433489417 /nfs/dbraw/zinc/48/94/17/1433489417.db2.gz MCKKAMPKFTWTHH-QDMKHBRRSA-N 0 0 377.441 3.104 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccc(OC[C@H]4CCCO4)cc3)C2)nc1 ZINC000245640111 1433494112 /nfs/dbraw/zinc/49/41/12/1433494112.db2.gz SCYXPPOBODYQQZ-FXAWDEMLSA-N 0 0 398.463 3.234 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc(OC[C@H]4CCCO4)cc3)C2)nc1 ZINC000245640120 1433494144 /nfs/dbraw/zinc/49/41/44/1433494144.db2.gz SCYXPPOBODYQQZ-YLJYHZDGSA-N 0 0 398.463 3.234 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CC[C@H](CO)CC3)cc2[N+](=O)[O-])C1 ZINC000245650116 1433495584 /nfs/dbraw/zinc/49/55/84/1433495584.db2.gz JTDVLPWQDAVFMB-CMIRHGDUSA-N 0 0 389.496 3.358 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)C[C@@H]3CCC[C@H]3O)cc2[N+](=O)[O-])C1 ZINC000245714442 1433504946 /nfs/dbraw/zinc/50/49/46/1433504946.db2.gz OBHAKALBQNVNJC-NVALYEJGSA-N 0 0 389.496 3.310 20 5 GGBDRN CN1CCO[C@H]([C@@H](NC(=O)c2csc([N+](=O)[O-])c2)c2ccc(Cl)cc2)C1 ZINC000245800229 1433519588 /nfs/dbraw/zinc/51/95/88/1433519588.db2.gz ZDKWLCCBADUYJV-HOCLYGCPSA-N 0 0 395.868 3.111 20 5 GGBDRN CN1CCO[C@H]([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(Cl)cc2)C1 ZINC000245800260 1433519846 /nfs/dbraw/zinc/51/98/46/1433519846.db2.gz ZDXFKBLFGMGAPP-ROUUACIJSA-N 0 0 389.839 3.050 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCS[C@H]2CCCC[C@H]21 ZINC000245857797 1433528413 /nfs/dbraw/zinc/52/84/13/1433528413.db2.gz AWQGXBPQQXPZGJ-MSOLQXFVSA-N 0 0 386.477 3.136 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCS[C@@H]2CCCC[C@H]21 ZINC000245857807 1433528614 /nfs/dbraw/zinc/52/86/14/1433528614.db2.gz AWQGXBPQQXPZGJ-QZTJIDSGSA-N 0 0 386.477 3.136 20 5 GGBDRN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245896824 1433536389 /nfs/dbraw/zinc/53/63/89/1433536389.db2.gz PIRMNGJEQVQSOX-IAGOWNOFSA-N 0 0 393.465 3.037 20 5 GGBDRN O=C(O[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000245909044 1433540100 /nfs/dbraw/zinc/54/01/00/1433540100.db2.gz VENNHCRMSQMQQZ-FSPWUOQZSA-N 0 0 383.404 3.285 20 5 GGBDRN O=C(CN(C[C@@H]1CCCO1)[C@H]1CCSC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000245929099 1433545852 /nfs/dbraw/zinc/54/58/52/1433545852.db2.gz UPNIVVNRLCMPRJ-KBPBESRZSA-N 0 0 399.900 3.173 20 5 GGBDRN CN(CC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000245960089 1433550490 /nfs/dbraw/zinc/55/04/90/1433550490.db2.gz DDHANYSTMUBVRX-KXBFYZLASA-N 0 0 389.839 3.331 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)C[C@H]1C ZINC000245965148 1433551309 /nfs/dbraw/zinc/55/13/09/1433551309.db2.gz VLAVYLIYFNYJFA-VHSXEESVSA-N 0 0 377.260 3.024 20 5 GGBDRN C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000246024811 1433558991 /nfs/dbraw/zinc/55/89/91/1433558991.db2.gz KRCHYAGLCQXYFI-ZWOKBUDYSA-N 0 0 396.491 3.025 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C[C@H]3CCCO3)cc2[N+](=O)[O-])C1 ZINC000246038416 1433560203 /nfs/dbraw/zinc/56/02/03/1433560203.db2.gz WTMKFSFVUYCDTR-BFYDXBDKSA-N 0 0 375.469 3.328 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H](C)CO1 ZINC000246060747 1433562875 /nfs/dbraw/zinc/56/28/75/1433562875.db2.gz DGRBVRCSTOIBNH-BBRMVZONSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H](C)CO1 ZINC000246060756 1433563032 /nfs/dbraw/zinc/56/30/32/1433563032.db2.gz DGRBVRCSTOIBNH-XJKSGUPXSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000246065484 1433563872 /nfs/dbraw/zinc/56/38/72/1433563872.db2.gz DRIUYBGZAXAALB-FZKQIMNGSA-N 0 0 394.424 3.193 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246103967 1433569205 /nfs/dbraw/zinc/56/92/05/1433569205.db2.gz CJINUNPQNSJZBB-SWLSCSKDSA-N 0 0 389.843 3.157 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246103957 1433569241 /nfs/dbraw/zinc/56/92/41/1433569241.db2.gz CJINUNPQNSJZBB-IUODEOHRSA-N 0 0 389.843 3.157 20 5 GGBDRN C[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)[C@H]1C ZINC000246116325 1433570938 /nfs/dbraw/zinc/57/09/38/1433570938.db2.gz ISOKOKAXHCTMIB-ZJUUUORDSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1Cl)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246120107 1433571566 /nfs/dbraw/zinc/57/15/66/1433571566.db2.gz HDQWQDGWWOHEPI-QWHCGFSZSA-N 0 0 389.843 3.157 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)CO1 ZINC000246133123 1433572953 /nfs/dbraw/zinc/57/29/53/1433572953.db2.gz JUNQFKRUHVMNKA-HNAYVOBHSA-N 0 0 390.461 3.362 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000246136574 1433573269 /nfs/dbraw/zinc/57/32/69/1433573269.db2.gz PHWIBUSNPSAZMW-ZLKJLUDKSA-N 0 0 381.226 3.045 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000246186396 1433579469 /nfs/dbraw/zinc/57/94/69/1433579469.db2.gz HWXUMEKCOXYKTM-NVGCLXPQSA-N 0 0 378.425 3.453 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000246200116 1433581117 /nfs/dbraw/zinc/58/11/17/1433581117.db2.gz OPLCSANJYIBSBI-HNAYVOBHSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000246226675 1433584069 /nfs/dbraw/zinc/58/40/69/1433584069.db2.gz WJOCHQCJKIEQKQ-UKRRQHHQSA-N 0 0 396.490 3.242 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1 ZINC000246246358 1433585816 /nfs/dbraw/zinc/58/58/16/1433585816.db2.gz VLQJXFJMHMWFQZ-WDNDVIMCSA-N 0 0 375.425 3.224 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CC[C@@H](CO)C1 ZINC000246260471 1433587339 /nfs/dbraw/zinc/58/73/39/1433587339.db2.gz GFMHYBZXABMEJT-ACJLOTCBSA-N 0 0 389.839 3.242 20 5 GGBDRN O=C(CN1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000246278716 1433588957 /nfs/dbraw/zinc/58/89/57/1433588957.db2.gz ATBZNNAOWQYOIS-VQIMIIECSA-N 0 0 387.411 3.261 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CC[C@@H](OCCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000246283637 1433589708 /nfs/dbraw/zinc/58/97/08/1433589708.db2.gz APCZZBHLISTBAP-GDBMZVCRSA-N 0 0 379.457 3.067 20 5 GGBDRN C[C@@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H](c2ccsc2)O1 ZINC000246292939 1433590831 /nfs/dbraw/zinc/59/08/31/1433590831.db2.gz BNEWBIZGNVTSDM-XWIAVFTESA-N 0 0 387.461 3.224 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2C[C@@H](C)O[C@@H](c3ccsc3)C2)c1C ZINC000246310190 1433592882 /nfs/dbraw/zinc/59/28/82/1433592882.db2.gz COOZJBKAXNSJNK-MLGOLLRUSA-N 0 0 396.490 3.424 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000246317979 1433594385 /nfs/dbraw/zinc/59/43/85/1433594385.db2.gz XYCBMDPGAVUAAY-DZGCQCFKSA-N 0 0 396.490 3.242 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000246389452 1433605407 /nfs/dbraw/zinc/60/54/07/1433605407.db2.gz IBXWIJMARQZIET-MLGOLLRUSA-N 0 0 396.490 3.369 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2c3ccccc3N(C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000246396584 1433606629 /nfs/dbraw/zinc/60/66/29/1433606629.db2.gz BEUOJDYFIYLJFY-CQSZACIVSA-N 0 0 375.450 3.327 20 5 GGBDRN CCOC(=O)c1ccnc(N2C[C@@H](C)O[C@@H](c3ccsc3)C2)c1[N+](=O)[O-] ZINC000246424787 1433610853 /nfs/dbraw/zinc/61/08/53/1433610853.db2.gz JYZXREBGOUQTGW-BXUZGUMPSA-N 0 0 377.422 3.194 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1cccc(Cl)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246441065 1433613187 /nfs/dbraw/zinc/61/31/87/1433613187.db2.gz USHDXJQBAVMXSS-HYVNUMGLSA-N 0 0 386.839 3.460 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000246453433 1433614854 /nfs/dbraw/zinc/61/48/54/1433614854.db2.gz IZFIUPWPHDZTQW-LERXQTSPSA-N 0 0 396.241 3.436 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1[O-])N1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000246507253 1433622874 /nfs/dbraw/zinc/62/28/74/1433622874.db2.gz BXNUFNPGEQVOEP-PKOBYXMFSA-N 0 0 395.459 3.427 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000246518083 1433624190 /nfs/dbraw/zinc/62/41/90/1433624190.db2.gz UYDSAHFQGLZISB-YSVLISHTSA-N 0 0 375.469 3.365 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000246596448 1433636875 /nfs/dbraw/zinc/63/68/75/1433636875.db2.gz UCZMHBXGCIHMCA-IGCXYCKISA-N 0 0 375.450 3.445 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)[C@@H](C)C1 ZINC000246602687 1433638289 /nfs/dbraw/zinc/63/82/89/1433638289.db2.gz ARAWUWGWYVQPDW-ZOBORPQBSA-N 0 0 379.482 3.202 20 5 GGBDRN C[C@@H]1C[C@@H]1[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000246607555 1433638560 /nfs/dbraw/zinc/63/85/60/1433638560.db2.gz JGANTNTUDJKEQB-RLCCDNCMSA-N 0 0 377.832 3.141 20 5 GGBDRN 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388.489 3.400 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCC[C@H]2[C@H]2CCCCC2=O)cc1[N+](=O)[O-] ZINC000249094693 1433835016 /nfs/dbraw/zinc/83/50/16/1433835016.db2.gz TWVIMESCBUJULF-CABCVRRESA-N 0 0 380.466 3.124 20 5 GGBDRN CC[C@]1(CO)CCCN1C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000249145567 1433837389 /nfs/dbraw/zinc/83/73/89/1433837389.db2.gz GHMQCYUYRUIRNU-WHSLLNHNSA-N 0 0 389.496 3.454 20 5 GGBDRN C[C@H]1CCCN(S(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])[C@H]1C ZINC000250570223 1433856748 /nfs/dbraw/zinc/85/67/48/1433856748.db2.gz WIWRMXVMFJNJJR-UWVGGRQHSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000249201304 1433838750 /nfs/dbraw/zinc/83/87/50/1433838750.db2.gz QXLALKOSZQVYLY-JTNHKYCSSA-N 0 0 397.378 3.314 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N(C)C[C@H]2COc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000249253169 1433839713 /nfs/dbraw/zinc/83/97/13/1433839713.db2.gz ZRHOGNDBUZTCRF-GJZGRUSLSA-N 0 0 385.420 3.002 20 5 GGBDRN C[C@H](C(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000249344473 1433841514 /nfs/dbraw/zinc/84/15/14/1433841514.db2.gz JJWHPXCEPHEJJN-USBNGQNGSA-N 0 0 392.349 3.437 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@H]1Oc1ccccc1 ZINC000249394235 1433842559 /nfs/dbraw/zinc/84/25/59/1433842559.db2.gz AQYPCTHQMXMJGX-QXAKKESOSA-N 0 0 385.420 3.019 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2C[C@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000249487457 1433844872 /nfs/dbraw/zinc/84/48/72/1433844872.db2.gz XJCNYDNGKBYCHJ-MEDUHNTESA-N 0 0 380.397 3.124 20 5 GGBDRN CCN(C[C@H]1COc2ccccc2O1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000249501592 1433845173 /nfs/dbraw/zinc/84/51/73/1433845173.db2.gz ASXJTGAFJFOZIN-CABCVRRESA-N 0 0 385.420 3.084 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000249584640 1433847404 /nfs/dbraw/zinc/84/74/04/1433847404.db2.gz SMRHGKHVHDIWNJ-KZULUSFZSA-N 0 0 391.374 3.274 20 5 GGBDRN CCn1c(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])nnc1-c1ccco1 ZINC000249694664 1433849178 /nfs/dbraw/zinc/84/91/78/1433849178.db2.gz PMIJOAMMRXPZQR-UHFFFAOYSA-N 0 0 394.434 3.021 20 5 GGBDRN Cc1noc([C@H]2CCCN([C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000249711655 1433849494 /nfs/dbraw/zinc/84/94/94/1433849494.db2.gz XJFRRFIFAIDIEK-PWSUYJOCSA-N 0 0 393.831 3.146 20 5 GGBDRN COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000249742787 1433850680 /nfs/dbraw/zinc/85/06/80/1433850680.db2.gz JXFSXRVEXHVKBH-WBAXXEDZSA-N 0 0 389.452 3.038 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@H]3CCCOC3)cc2[N+](=O)[O-])C1 ZINC000249760465 1433851399 /nfs/dbraw/zinc/85/13/99/1433851399.db2.gz MNOFTTAJKFILME-OWCLPIDISA-N 0 0 375.469 3.234 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CCC[C@@H](c3nccs3)C2)c([N+](=O)[O-])c1 ZINC000249889013 1433853552 /nfs/dbraw/zinc/85/35/52/1433853552.db2.gz PYQXOVHTZFUFLD-CHWSQXEVSA-N 0 0 390.465 3.267 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000250082621 1433854306 /nfs/dbraw/zinc/85/43/06/1433854306.db2.gz CKXDRHKNOCFRIS-RHSMWYFYSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000250226743 1433855119 /nfs/dbraw/zinc/85/51/19/1433855119.db2.gz GWWRSMURXBSBJT-WMLDXEAASA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000250586250 1433856936 /nfs/dbraw/zinc/85/69/36/1433856936.db2.gz QKWYCZALGQKEQL-SUMWQHHRSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000250641236 1433857121 /nfs/dbraw/zinc/85/71/21/1433857121.db2.gz UGDJRUXXHJLSPT-RDTXWAMCSA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](c2ccccc2)O1 ZINC000250671662 1433857152 /nfs/dbraw/zinc/85/71/52/1433857152.db2.gz XQPJROSBKQOFRS-LRDDRELGSA-N 0 0 396.852 3.399 20 5 GGBDRN Cc1c(NC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cccc1[N+](=O)[O-] ZINC000250891059 1433857471 /nfs/dbraw/zinc/85/74/71/1433857471.db2.gz OBAVURXIPLWMPB-RKVPGOIHSA-N 0 0 399.447 3.208 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](CC(C)C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O ZINC000251161897 1433857765 /nfs/dbraw/zinc/85/77/65/1433857765.db2.gz RTISLNBBFMZMMS-NUJGCVRESA-N 0 0 399.447 3.208 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])[C@H]1Oc1ccccc1 ZINC000251739081 1433860142 /nfs/dbraw/zinc/86/01/42/1433860142.db2.gz QAQODZFUZBBQPC-MISYRCLQSA-N 0 0 399.447 3.361 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000251924984 1433861493 /nfs/dbraw/zinc/86/14/93/1433861493.db2.gz SQBAJJHWZTXRSM-JFIYKMOQSA-N 0 0 389.496 3.432 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@@H]3OCCC[C@H]23)cc1[N+](=O)[O-])c1ccccn1 ZINC000251947881 1433861703 /nfs/dbraw/zinc/86/17/03/1433861703.db2.gz VERPFGFRPOSWRA-FSPMTTQMSA-N 0 0 396.447 3.460 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[C@H](C)C1 ZINC000251973849 1433861850 /nfs/dbraw/zinc/86/18/50/1433861850.db2.gz YHUOJVQGUAWDHB-LXZKKBNFSA-N 0 0 393.509 3.141 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2OCCC[C@@H]12 ZINC000252039431 1433862411 /nfs/dbraw/zinc/86/24/11/1433862411.db2.gz ZDZYSPBKHUVLDA-LNSITVRQSA-N 0 0 387.358 3.099 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCCC[C@H]1C ZINC000252134276 1433862875 /nfs/dbraw/zinc/86/28/75/1433862875.db2.gz LGLSHFDLNPRORR-COXVUDFISA-N 0 0 393.509 3.141 20 5 GGBDRN CCOc1ncccc1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000253381156 1433866558 /nfs/dbraw/zinc/86/65/58/1433866558.db2.gz CTZMZLXLUHUTJP-UHFFFAOYSA-N 0 0 380.198 3.081 20 5 GGBDRN CC(C)Oc1cccc(CC(=O)OCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000253377183 1433866607 /nfs/dbraw/zinc/86/66/07/1433866607.db2.gz WGQAXRLVBFXEHQ-UHFFFAOYSA-N 0 0 398.415 3.057 20 5 GGBDRN COc1ccccc1OCC(=O)Nc1cc(C)nn1-c1ccc([N+](=O)[O-])cc1 ZINC000253477256 1433867812 /nfs/dbraw/zinc/86/78/12/1433867812.db2.gz DTGVPZCSFIMUEQ-UHFFFAOYSA-N 0 0 382.376 3.115 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000253599743 1433869931 /nfs/dbraw/zinc/86/99/31/1433869931.db2.gz SMDDKLIUYKVKBZ-UHFFFAOYSA-N 0 0 395.419 3.155 20 5 GGBDRN Cc1c(C(=O)N2CCC[C@H]2Cc2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000253599628 1433869968 /nfs/dbraw/zinc/86/99/68/1433869968.db2.gz QBYUMWBJIIDSGS-KRWDZBQOSA-N 0 0 391.431 3.331 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000253611979 1433870609 /nfs/dbraw/zinc/87/06/09/1433870609.db2.gz YATSIOMIPCEVJA-HNNXBMFYSA-N 0 0 376.796 3.152 20 5 GGBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000254964448 1433873158 /nfs/dbraw/zinc/87/31/58/1433873158.db2.gz WBBCHNUGIBHNCN-ZROIWOOFSA-N 0 0 381.432 3.359 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NC[C@](O)(c1ccccc1)C(F)(F)F ZINC000255017501 1433874314 /nfs/dbraw/zinc/87/43/14/1433874314.db2.gz IIJFCZGCWSWFJD-NLZINVLXSA-N 0 0 380.322 3.174 20 5 GGBDRN CN(C)[C@@H](CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000255050523 1433874988 /nfs/dbraw/zinc/87/49/88/1433874988.db2.gz BYKULADNEGTVCV-NLZINVLXSA-N 0 0 375.375 3.305 20 5 GGBDRN CN(C)c1nnc(-c2ccc(NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)cc2)o1 ZINC000255059088 1433875256 /nfs/dbraw/zinc/87/52/56/1433875256.db2.gz KZAXDTNWFWIPRY-XGICHPGQSA-N 0 0 379.376 3.363 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCN(c2ccccc2F)C1=O ZINC000255080213 1433875914 /nfs/dbraw/zinc/87/59/14/1433875914.db2.gz YFLJLHLWMMZZNJ-QJWNTBNXSA-N 0 0 383.379 3.059 20 5 GGBDRN O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)NCCn1cc([N+](=O)[O-])cn1 ZINC000255105659 1433876325 /nfs/dbraw/zinc/87/63/25/1433876325.db2.gz VXTCWCWLBLQUOV-RJRFIUFISA-N 0 0 388.733 3.293 20 5 GGBDRN CN(C[C@@H]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C ZINC000255122552 1433876897 /nfs/dbraw/zinc/87/68/97/1433876897.db2.gz DAJIMDPCGDXWQI-BJIFSAINSA-N 0 0 389.452 3.323 20 5 GGBDRN Cn1cc(C(=O)Nc2cccc(OC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)c2)cn1 ZINC000255180290 1433878048 /nfs/dbraw/zinc/87/80/48/1433878048.db2.gz WTXWKJRSFLYHPC-YFHOEESVSA-N 0 0 392.371 3.199 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cc(-n2nnnc2C2CC2)ccc1F ZINC000255300539 1433879579 /nfs/dbraw/zinc/87/95/79/1433879579.db2.gz MAVMXQYCZMAODN-KMKOMSMNSA-N 0 0 394.366 3.239 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000255299478 1433879589 /nfs/dbraw/zinc/87/95/89/1433879589.db2.gz JCQZOSVUOPSSBZ-NJHFGQCCSA-N 0 0 388.445 3.142 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000255299476 1433879621 /nfs/dbraw/zinc/87/96/21/1433879621.db2.gz JCQZOSVUOPSSBZ-NCBQWRQHSA-N 0 0 388.445 3.142 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255305914 1433879728 /nfs/dbraw/zinc/87/97/28/1433879728.db2.gz FLLUBRZQMWPSFI-RNUYOQPASA-N 0 0 382.416 3.241 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H](CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255344716 1433880926 /nfs/dbraw/zinc/88/09/26/1433880926.db2.gz PKPHSERRYIMTKG-BCTQVIJGSA-N 0 0 375.425 3.028 20 5 GGBDRN O=C(/C=C\c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000255379030 1433881795 /nfs/dbraw/zinc/88/17/95/1433881795.db2.gz SQZFBIWHVNVNMC-KMKOMSMNSA-N 0 0 399.834 3.246 20 5 GGBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@@H]1CC(=O)c1ccccc1 ZINC000255397274 1433882197 /nfs/dbraw/zinc/88/21/97/1433882197.db2.gz NNTKXAGAGZNLRD-POGDKVGISA-N 0 0 380.400 3.108 20 5 GGBDRN CC(C)(NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1cn(-c2ccccc2)nn1 ZINC000255422896 1433882600 /nfs/dbraw/zinc/88/26/00/1433882600.db2.gz WYJKCGICAKXLIK-RAXLEYEMSA-N 0 0 377.404 3.240 20 5 GGBDRN COc1ccccc1/C(C)=C\C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000255429585 1433882761 /nfs/dbraw/zinc/88/27/61/1433882761.db2.gz FJJMSUBFCDFODP-QKXCFHHRSA-N 0 0 382.420 3.115 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCCOc1cncc(Br)c1 ZINC000255537641 1433884432 /nfs/dbraw/zinc/88/44/32/1433884432.db2.gz FAQQDMFRQWBFAP-UTCJRWHESA-N 0 0 393.193 3.388 20 5 GGBDRN C[C@@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1noc(Cc2ccccc2)n1 ZINC000255548860 1433884895 /nfs/dbraw/zinc/88/48/95/1433884895.db2.gz ICUPMNSOBXKLAC-FWLQQBITSA-N 0 0 378.388 3.459 20 5 GGBDRN NC(=O)c1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1N1CCCCC1 ZINC000255560149 1433885260 /nfs/dbraw/zinc/88/52/60/1433885260.db2.gz DRTCRCMKELYGLM-WDZFZDKYSA-N 0 0 394.431 3.336 20 5 GGBDRN CN(C(=O)/C=C\c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000255562773 1433885317 /nfs/dbraw/zinc/88/53/17/1433885317.db2.gz YYAGILOQMTZUFO-BJIFSAINSA-N 0 0 375.425 3.076 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255587237 1433885989 /nfs/dbraw/zinc/88/59/89/1433885989.db2.gz AROOZVCHPDKJOU-CLOOOTJHSA-N 0 0 375.425 3.124 20 5 GGBDRN CC(C)(C)OC(=O)N1CCCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1 ZINC000255640255 1433887244 /nfs/dbraw/zinc/88/72/44/1433887244.db2.gz SXZIICYNGQYIMR-YFHOEESVSA-N 0 0 375.425 3.077 20 5 GGBDRN CS(=O)(=O)c1c(Cl)cccc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255661616 1433887467 /nfs/dbraw/zinc/88/74/67/1433887467.db2.gz RYYGDLDNVKTHDD-YFHOEESVSA-N 0 0 380.809 3.304 20 5 GGBDRN CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000255683439 1433887856 /nfs/dbraw/zinc/88/78/56/1433887856.db2.gz NAJLJIBBZJLWAP-SIRUQFCQSA-N 0 0 391.493 3.338 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1 ZINC000255697888 1433888201 /nfs/dbraw/zinc/88/82/01/1433888201.db2.gz WQDMRXYMOIFZCX-TWGQIWQCSA-N 0 0 389.452 3.371 20 5 GGBDRN CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000255724037 1433888666 /nfs/dbraw/zinc/88/86/66/1433888666.db2.gz QMAJYSGMENZSQU-BILDBKGDSA-N 0 0 377.466 3.030 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000255768599 1433889257 /nfs/dbraw/zinc/88/92/57/1433889257.db2.gz IHXNIZYOQKVQNO-CXOKCQFOSA-N 0 0 389.452 3.371 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCCN(C(=O)Oc2ccccc2)CC1 ZINC000255842723 1433890110 /nfs/dbraw/zinc/89/01/10/1433890110.db2.gz IHFCHXAKMGDKGO-XFXZXTDPSA-N 0 0 395.415 3.341 20 5 GGBDRN COc1ccc(-c2nc(COC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000255868936 1433890516 /nfs/dbraw/zinc/89/05/16/1433890516.db2.gz QUVHWRQIEJHGLX-WCIBSUBMSA-N 0 0 381.344 3.410 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000255866921 1433890546 /nfs/dbraw/zinc/89/05/46/1433890546.db2.gz XRKXCAXTOVXHEI-HJLMUGLJSA-N 0 0 397.456 3.457 20 5 GGBDRN O=C(/C=C\c1ccc(Cl)s1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000255865984 1433890575 /nfs/dbraw/zinc/89/05/75/1433890575.db2.gz ZNFYORXQIJGTAB-UUSYTGMJSA-N 0 0 378.841 3.431 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000255866922 1433890584 /nfs/dbraw/zinc/89/05/84/1433890584.db2.gz XRKXCAXTOVXHEI-SNMSSPIJSA-N 0 0 397.456 3.457 20 5 GGBDRN Cc1nn(CCC(=O)Nc2nnc(/C=C\c3ccco3)s2)c(C)c1[N+](=O)[O-] ZINC000255891259 1433891194 /nfs/dbraw/zinc/89/11/94/1433891194.db2.gz IYQCXCRGZUDVHZ-WAYWQWQTSA-N 0 0 388.409 3.052 20 5 GGBDRN COc1cc(C(=O)N2CCNC[C@@H]2c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000261928325 1433913877 /nfs/dbraw/zinc/91/38/77/1433913877.db2.gz JGUWGRHBFJPZFW-MRXNPFEDSA-N 0 0 375.812 3.044 20 5 GGBDRN COc1ccc(C(=O)N2CCNC[C@@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000261997935 1433920467 /nfs/dbraw/zinc/92/04/67/1433920467.db2.gz POVBYXDDSNWMFM-MRXNPFEDSA-N 0 0 375.812 3.044 20 5 GGBDRN Nc1ccc(C(=O)N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] ZINC000262068295 1433925701 /nfs/dbraw/zinc/92/57/01/1433925701.db2.gz COWVUGIJJVCLLX-GOSISDBHSA-N 0 0 389.839 3.416 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCNC[C@H]1c1cccc(F)c1 ZINC000262079592 1433926379 /nfs/dbraw/zinc/92/63/79/1433926379.db2.gz XLVYDXJCISSQRF-IBGZPJMESA-N 0 0 386.427 3.099 20 5 GGBDRN Nc1ccc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 ZINC000262198995 1433930590 /nfs/dbraw/zinc/93/05/90/1433930590.db2.gz IWUXDNSNQCKOSI-UHFFFAOYSA-N 0 0 394.353 3.158 20 5 GGBDRN COc1cc(C[N@@H+]2CCC[C@@H]2C(=O)[O-])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000263382047 1434004856 /nfs/dbraw/zinc/00/48/56/1434004856.db2.gz BWOAGYDTUDXYQT-QGZVFWFLSA-N 0 0 386.404 3.231 20 5 GGBDRN C[N@H+](CC(=O)[O-])[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000263517225 1434010762 /nfs/dbraw/zinc/01/07/62/1434010762.db2.gz PEZMSVUEWIBYEI-MRXNPFEDSA-N 0 0 387.436 3.226 20 5 GGBDRN O=C([O-])C[N@H+](CC1CC1)C1CC(Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000263550634 1434013022 /nfs/dbraw/zinc/01/30/22/1434013022.db2.gz KNLASIOVQOUCQJ-UHFFFAOYSA-N 0 0 387.358 3.353 20 5 GGBDRN CC(=O)c1ccc(OC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000263642639 1434014442 /nfs/dbraw/zinc/01/44/42/1434014442.db2.gz DBIPAMKVFWNBGE-IBGZPJMESA-N 0 0 396.399 3.316 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](C)c2ccc(OC(F)F)cc2)c(C)c1[N+](=O)[O-] ZINC000263642632 1434014595 /nfs/dbraw/zinc/01/45/95/1434014595.db2.gz DANZXSKLFDODPR-SNVBAGLBSA-N 0 0 382.367 3.277 20 5 GGBDRN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000263644575 1434014688 /nfs/dbraw/zinc/01/46/88/1434014688.db2.gz AWFPIWAZRHRRBH-HNNXBMFYSA-N 0 0 396.447 3.342 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCCN(C(=O)Oc2ccccc2)CC1 ZINC000263669108 1434018097 /nfs/dbraw/zinc/01/80/97/1434018097.db2.gz HTXFFNZJJPMUNF-UHFFFAOYSA-N 0 0 384.392 3.333 20 5 GGBDRN COc1cc(NC(=O)CCSc2ncccc2[N+](=O)[O-])cc(OC)c1OC ZINC000263668100 1434018229 /nfs/dbraw/zinc/01/82/29/1434018229.db2.gz LNTXQWIIKUKIMT-UHFFFAOYSA-N 0 0 393.421 3.137 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N(C)Cc2cccs2)ccc1[N+](=O)[O-] ZINC000263686693 1434021037 /nfs/dbraw/zinc/02/10/37/1434021037.db2.gz QGOAWTAWRBXOKA-KRWDZBQOSA-N 0 0 387.461 3.228 20 5 GGBDRN C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000263697969 1434022381 /nfs/dbraw/zinc/02/23/81/1434022381.db2.gz MDKJOMGKUCSRAL-OAHLLOKOSA-N 0 0 396.447 3.342 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(NC(=O)C3CC3)ccc2C)c(C)c1[N+](=O)[O-] ZINC000263704935 1434023405 /nfs/dbraw/zinc/02/34/05/1434023405.db2.gz VAOYKGCQLOZBHC-UHFFFAOYSA-N 0 0 385.424 3.094 20 5 GGBDRN COC(=O)c1c(C)c(C(C)=O)[nH]c1CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000263706723 1434023504 /nfs/dbraw/zinc/02/35/04/1434023504.db2.gz PTYIMIWVBBRVAH-UHFFFAOYSA-N 0 0 387.392 3.019 20 5 GGBDRN COc1ccc2cc(CNC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)ccc2c1 ZINC000263708827 1434023946 /nfs/dbraw/zinc/02/39/46/1434023946.db2.gz VZIDVACPBRUWEN-UHFFFAOYSA-N 0 0 382.420 3.276 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000263714428 1434024579 /nfs/dbraw/zinc/02/45/79/1434024579.db2.gz KWLLYZPQXBPYMI-HNNXBMFYSA-N 0 0 386.383 3.079 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H]2CCSc3ccc(F)cc32)c(C)c1[N+](=O)[O-] ZINC000263716511 1434024776 /nfs/dbraw/zinc/02/47/76/1434024776.db2.gz XIQOZSHXSQIHTD-CQSZACIVSA-N 0 0 378.429 3.291 20 5 GGBDRN COCCOc1ccccc1C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000263743008 1434027794 /nfs/dbraw/zinc/02/77/94/1434027794.db2.gz HGVREHYYJCEYMK-UHFFFAOYSA-N 0 0 388.376 3.034 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)C2)n1 ZINC000263758923 1434030092 /nfs/dbraw/zinc/03/00/92/1434030092.db2.gz HCIDCGRIJSWJGJ-SNVBAGLBSA-N 0 0 397.338 3.299 20 5 GGBDRN Cc1ccc(C)n1C1CCN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000263783982 1434033496 /nfs/dbraw/zinc/03/34/96/1434033496.db2.gz GDICTLYVMCOGMW-UHFFFAOYSA-N 0 0 381.429 3.178 20 5 GGBDRN CC(C)(C)OC(=O)NCC1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000263796188 1434035009 /nfs/dbraw/zinc/03/50/09/1434035009.db2.gz KYNGZVCBACBFAS-UHFFFAOYSA-N 0 0 381.404 3.111 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000263795848 1434035104 /nfs/dbraw/zinc/03/51/04/1434035104.db2.gz YIJGGWQZYQSAPU-GFCCVEGCSA-N 0 0 382.848 3.264 20 5 GGBDRN COc1ccc(CNC(=O)N2CCO[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000263834117 1434039454 /nfs/dbraw/zinc/03/94/54/1434039454.db2.gz APBYCBONGJHOAK-SFHVURJKSA-N 0 0 389.383 3.026 20 5 GGBDRN CCC[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)C(=O)N1CCc2sccc2C1 ZINC000263862348 1434042984 /nfs/dbraw/zinc/04/29/84/1434042984.db2.gz IRLXIVWTMQZVTF-CYBMUJFWSA-N 0 0 393.490 3.201 20 5 GGBDRN CC(C)(C)OC(=O)C1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000263879215 1434044945 /nfs/dbraw/zinc/04/49/45/1434044945.db2.gz ROHGUQZEAWBYGU-UHFFFAOYSA-N 0 0 380.466 3.267 20 5 GGBDRN CCN(Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)c1)C(=O)C(F)(F)F ZINC000263925502 1434049412 /nfs/dbraw/zinc/04/94/12/1434049412.db2.gz YVSYHMYNXNCBIU-UHFFFAOYSA-N 0 0 384.314 3.086 20 5 GGBDRN COc1cccc(N2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3Cl)C2)c1 ZINC000263979178 1434056791 /nfs/dbraw/zinc/05/67/91/1434056791.db2.gz IEGBRXXJFIWKAX-LBPRGKRZSA-N 0 0 375.812 3.266 20 5 GGBDRN CCOCc1cccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1 ZINC000263993301 1434058894 /nfs/dbraw/zinc/05/88/94/1434058894.db2.gz OUAAVRLUMIPKNT-UHFFFAOYSA-N 0 0 399.403 3.458 20 5 GGBDRN CCOC(=O)N(C)c1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000263998607 1434059684 /nfs/dbraw/zinc/05/96/84/1434059684.db2.gz QNMSIMLUBOSEGY-UHFFFAOYSA-N 0 0 389.412 3.030 20 5 GGBDRN Cc1nn(CCC(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)c(C)c1[N+](=O)[O-] ZINC000264000570 1434060032 /nfs/dbraw/zinc/06/00/32/1434060032.db2.gz RAVIWCHFBYDTAZ-SFHVURJKSA-N 0 0 386.452 3.006 20 5 GGBDRN COc1cc(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)c([N+](=O)[O-])cc1OC ZINC000264000616 1434060129 /nfs/dbraw/zinc/06/01/29/1434060129.db2.gz RBTGKTKJQNINME-QFBILLFUSA-N 0 0 386.404 3.262 20 5 GGBDRN COc1cc(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)c([N+](=O)[O-])cc1OC ZINC000264000612 1434060152 /nfs/dbraw/zinc/06/01/52/1434060152.db2.gz RBTGKTKJQNINME-LPHOPBHVSA-N 0 0 386.404 3.262 20 5 GGBDRN C[C@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000264003087 1434060619 /nfs/dbraw/zinc/06/06/19/1434060619.db2.gz GHNCEKCGSGCJDN-STQMWFEESA-N 0 0 382.420 3.235 20 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ZINC000264043965 1434065659 /nfs/dbraw/zinc/06/56/59/1434065659.db2.gz OSMFACGJFNGYHS-LBPRGKRZSA-N 0 0 394.431 3.179 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3ncc[nH]3)C2)cc1SC ZINC000264055087 1434066961 /nfs/dbraw/zinc/06/69/61/1434066961.db2.gz BRQYHOCDJKDPLN-LLVKDONJSA-N 0 0 376.438 3.068 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3ncc[nH]3)C2)cc1SC ZINC000264055093 1434066990 /nfs/dbraw/zinc/06/69/90/1434066990.db2.gz BRQYHOCDJKDPLN-NSHDSACASA-N 0 0 376.438 3.068 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000264084547 1434070327 /nfs/dbraw/zinc/07/03/27/1434070327.db2.gz OVRBLHAOXCKULC-LBPRGKRZSA-N 0 0 398.419 3.317 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2nccn2C(F)F)cc1SC ZINC000264144487 1434075470 /nfs/dbraw/zinc/07/54/70/1434075470.db2.gz MBJRLWWSPKYBCB-UHFFFAOYSA-N 0 0 386.380 3.189 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000264162603 1434077160 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ZINC000267285865 1434419340 /nfs/dbraw/zinc/41/93/40/1434419340.db2.gz QBOLEHPUOKDSGB-UHFFFAOYSA-N 0 0 386.376 3.353 20 5 GGBDRN Cn1c2ccccc2nc1[C@@H]1CCCN1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000267322260 1434422525 /nfs/dbraw/zinc/42/25/25/1434422525.db2.gz CGVUBDXSEROECG-SFHVURJKSA-N 0 0 379.420 3.257 20 5 GGBDRN COc1ccc(OCC[NH+]2CCC(OC[C@@H]3CCCCO3)CC2)c([N+](=O)[O-])c1 ZINC000267339339 1434424001 /nfs/dbraw/zinc/42/40/01/1434424001.db2.gz BYKKENOEMMNHDA-SFHVURJKSA-N 0 0 394.468 3.032 20 5 GGBDRN CC[C@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1nnc2n1CCCCC2 ZINC000267355992 1434425353 /nfs/dbraw/zinc/42/53/53/1434425353.db2.gz QHQWKQFYOOSBOT-BBRMVZONSA-N 0 0 386.456 3.424 20 5 GGBDRN O=C(CC1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1)N1CCCC1 ZINC000267361801 1434425843 /nfs/dbraw/zinc/42/58/43/1434425843.db2.gz NXVSPJIIECGGPY-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCC(c2nncn2C2CC2)CC1 ZINC000267412206 1434430356 /nfs/dbraw/zinc/43/03/56/1434430356.db2.gz QKGIGQVQICFFBJ-UHFFFAOYSA-N 0 0 375.816 3.194 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000267475090 1434437955 /nfs/dbraw/zinc/43/79/55/1434437955.db2.gz AAKAXWUXYANCMG-DOTOQJQBSA-N 0 0 389.477 3.497 20 5 GGBDRN COCCCOc1cccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1 ZINC000267489591 1434440179 /nfs/dbraw/zinc/44/01/79/1434440179.db2.gz MYIBNOXFTIWZRY-UHFFFAOYSA-N 0 0 388.376 3.034 20 5 GGBDRN CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000267496297 1434440840 /nfs/dbraw/zinc/44/08/40/1434440840.db2.gz XNLVKNVOTSDESU-UHFFFAOYSA-N 0 0 386.408 3.017 20 5 GGBDRN COCCCOc1cccc(NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000267507266 1434442196 /nfs/dbraw/zinc/44/21/96/1434442196.db2.gz XTDOGONLGIPRMX-UHFFFAOYSA-N 0 0 378.356 3.167 20 5 GGBDRN CNC(=O)c1ccc(N2CCC[C@@H]2C[C@@H](O)c2cccs2)c([N+](=O)[O-])c1 ZINC000267534292 1434444209 /nfs/dbraw/zinc/44/42/09/1434444209.db2.gz XIPIZNLEQGNFDU-CZUORRHYSA-N 0 0 375.450 3.108 20 5 GGBDRN COc1cc(N2CCCN(C(=O)CCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000267532037 1434444238 /nfs/dbraw/zinc/44/42/38/1434444238.db2.gz LBBXMJOZMFMQPR-UHFFFAOYSA-N 0 0 383.448 3.275 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC[C@H]2C[C@@H](O)c2cccs2)c([N+](=O)[O-])c1 ZINC000267537135 1434444337 /nfs/dbraw/zinc/44/43/37/1434444337.db2.gz ZDNVKZZHCVHISN-BLLLJJGKSA-N 0 0 396.490 3.152 20 5 GGBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCCC[C@@H]1c1nnc2n1CCCC2 ZINC000267556259 1434445567 /nfs/dbraw/zinc/44/55/67/1434445567.db2.gz CFOOZLRSCILUIQ-MRXNPFEDSA-N 0 0 394.435 3.371 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc(Cl)n2)ccc1[N+](=O)[O-] ZINC000267609123 1434449501 /nfs/dbraw/zinc/44/95/01/1434449501.db2.gz ZQHUIJBXDPFYJX-CQSZACIVSA-N 0 0 388.811 3.195 20 5 GGBDRN COc1ccc(C(=O)CCC(=O)NCc2cc([N+](=O)[O-])ccc2OC)cc1F ZINC000267609734 1434449753 /nfs/dbraw/zinc/44/97/53/1434449753.db2.gz ROKWGJDQCGLOJL-UHFFFAOYSA-N 0 0 390.367 3.030 20 5 GGBDRN CC(C)CCO[C@@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000267630011 1434451318 /nfs/dbraw/zinc/45/13/18/1434451318.db2.gz GKYSLFSZMFGDCX-GOSISDBHSA-N 0 0 389.496 3.475 20 5 GGBDRN CO[C@H](C)c1nc(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000267637410 1434452055 /nfs/dbraw/zinc/45/20/55/1434452055.db2.gz PVVZJEXYULTEIH-GFCCVEGCSA-N 0 0 387.465 3.449 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NC2CCN(C(=O)CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000267643215 1434452467 /nfs/dbraw/zinc/45/24/67/1434452467.db2.gz AXYKNURESCHTLF-OAHLLOKOSA-N 0 0 390.484 3.301 20 5 GGBDRN CCOC(=O)Cc1csc(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000267659912 1434453529 /nfs/dbraw/zinc/45/35/29/1434453529.db2.gz BEOBIDMMONVUMJ-LLVKDONJSA-N 0 0 392.437 3.348 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1[N+](=O)[O-] ZINC000267691229 1434455824 /nfs/dbraw/zinc/45/58/24/1434455824.db2.gz DNLRDDKDWHGQPC-NSHDSACASA-N 0 0 387.348 3.074 20 5 GGBDRN Cc1c(CC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)nnn1-c1ccccc1 ZINC000267709173 1434457319 /nfs/dbraw/zinc/45/73/19/1434457319.db2.gz HXJDPIIOXDSHTJ-CQSZACIVSA-N 0 0 379.420 3.212 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1nc(Cc2ccccc2)no1 ZINC000267725756 1434458909 /nfs/dbraw/zinc/45/89/09/1434458909.db2.gz RARFGDJRTPTVNQ-CYBMUJFWSA-N 0 0 395.419 3.126 20 5 GGBDRN CCC(=O)Nc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000267746907 1434460760 /nfs/dbraw/zinc/46/07/60/1434460760.db2.gz RLBHDKQKOUXDAD-CYBMUJFWSA-N 0 0 398.419 3.068 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000267753953 1434461557 /nfs/dbraw/zinc/46/15/57/1434461557.db2.gz PRBUZOVDEUIMJZ-STQMWFEESA-N 0 0 388.390 3.148 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccccc2Cn2cncn2)cc1[N+](=O)[O-] ZINC000267756568 1434461680 /nfs/dbraw/zinc/46/16/80/1434461680.db2.gz PXAALGCGQIIVBO-HNNXBMFYSA-N 0 0 394.435 3.103 20 5 GGBDRN CO[C@H](C)c1nc(CNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)cs1 ZINC000267772337 1434463156 /nfs/dbraw/zinc/46/31/56/1434463156.db2.gz LGCSKBZSBBATPG-SNVBAGLBSA-N 0 0 378.410 3.327 20 5 GGBDRN COCCc1nc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)ccc2o1 ZINC000267782190 1434464172 /nfs/dbraw/zinc/46/41/72/1434464172.db2.gz JLBGOBVOURAPNO-UHFFFAOYSA-N 0 0 384.392 3.243 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc3c(c2)OC(C)(C)O3)cc1[N+](=O)[O-] ZINC000267785961 1434464475 /nfs/dbraw/zinc/46/44/75/1434464475.db2.gz WXYOYWORMCIXIZ-GFCCVEGCSA-N 0 0 399.403 3.226 20 5 GGBDRN COc1ccc(CNC(=O)N(CCC(F)(F)F)CC2CC2)cc1[N+](=O)[O-] ZINC000267799535 1434465971 /nfs/dbraw/zinc/46/59/71/1434465971.db2.gz XVKYOPUAHAMZIE-UHFFFAOYSA-N 0 0 375.347 3.477 20 5 GGBDRN CO[C@H](C)c1nc(CN2CCCN(c3ccccc3[N+](=O)[O-])CC2)cs1 ZINC000267807623 1434466680 /nfs/dbraw/zinc/46/66/80/1434466680.db2.gz SCCJRQZRMJNVSG-CQSZACIVSA-N 0 0 376.482 3.471 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cccc(N3CCNC3=O)c2)cc1[N+](=O)[O-] ZINC000267808159 1434466959 /nfs/dbraw/zinc/46/69/59/1434466959.db2.gz VBYSGGDGAOELLS-CYBMUJFWSA-N 0 0 383.408 3.316 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(OCCC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000267811299 1434467154 /nfs/dbraw/zinc/46/71/54/1434467154.db2.gz RJNKTLAGCVWUOF-CYBMUJFWSA-N 0 0 386.408 3.040 20 5 GGBDRN CC(=O)c1ccc(N2CCOC[C@H]2C[C@@H](O)c2cccs2)c([N+](=O)[O-])c1 ZINC000267857000 1434470852 /nfs/dbraw/zinc/47/08/52/1434470852.db2.gz HKKBEARANSNEIA-RHSMWYFYSA-N 0 0 376.434 3.188 20 5 GGBDRN CC(=O)c1ccc(N2CCOC[C@@H]2C[C@H](O)c2cccs2)c([N+](=O)[O-])c1 ZINC000267857008 1434470972 /nfs/dbraw/zinc/47/09/72/1434470972.db2.gz HKKBEARANSNEIA-YOEHRIQHSA-N 0 0 376.434 3.188 20 5 GGBDRN CO[C@@H](C)c1nc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000267889570 1434474541 /nfs/dbraw/zinc/47/45/41/1434474541.db2.gz YIFXGJNELHRXIM-JTQLQIEISA-N 0 0 399.856 3.497 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCS(=O)(=O)C3(CCCCC3)C2)cc1OC(F)F ZINC000267906345 1434475878 /nfs/dbraw/zinc/47/58/78/1434475878.db2.gz XWTDASURXZBXCM-UHFFFAOYSA-N 0 0 390.408 3.134 20 5 GGBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1-n1nnnc1C1CC1 ZINC000267920317 1434477159 /nfs/dbraw/zinc/47/71/59/1434477159.db2.gz FFGDNUXVUZBEGD-UHFFFAOYSA-N 0 0 394.391 3.017 20 5 GGBDRN COc1cc([C@@H](C)NC(=O)CCc2cccc([N+](=O)[O-])c2)cc(OC)c1OC ZINC000267938394 1434479184 /nfs/dbraw/zinc/47/91/84/1434479184.db2.gz IAXMUUPVWVUNSD-CYBMUJFWSA-N 0 0 388.420 3.431 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000267938463 1434479258 /nfs/dbraw/zinc/47/92/58/1434479258.db2.gz IDWPTFPDKFTDBY-OAHLLOKOSA-N 0 0 383.448 3.372 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CCC[C@H]2CC(=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000267949710 1434480154 /nfs/dbraw/zinc/48/01/54/1434480154.db2.gz BHBBFXPXGZQFOY-KRWDZBQOSA-N 0 0 396.399 3.050 20 5 GGBDRN CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000267954910 1434480884 /nfs/dbraw/zinc/48/08/84/1434480884.db2.gz ALBPLAVSBNWYPE-UHFFFAOYSA-N 0 0 395.459 3.291 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](CO)Cc1ccc(F)cc1 ZINC000267971276 1434482457 /nfs/dbraw/zinc/48/24/57/1434482457.db2.gz NDHVEXGBHUSNJV-HNNXBMFYSA-N 0 0 375.400 3.323 20 5 GGBDRN CCCCNC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000268028823 1434488673 /nfs/dbraw/zinc/48/86/73/1434488673.db2.gz MCJDRYZZUYVDBP-HNNXBMFYSA-N 0 0 390.484 3.302 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1CCN(CC(F)(F)F)CC1 ZINC000268036357 1434489625 /nfs/dbraw/zinc/48/96/25/1434489625.db2.gz WORISVZONOGZJR-UHFFFAOYSA-N 0 0 382.342 3.356 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(N[C@H](C)CCCO)c([N+](=O)[O-])c1 ZINC000268035302 1434489644 /nfs/dbraw/zinc/48/96/44/1434489644.db2.gz MDOZUBFBONITPU-CYBMUJFWSA-N 0 0 386.404 3.185 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000268062028 1434492069 /nfs/dbraw/zinc/49/20/69/1434492069.db2.gz UAFZYSOYAYQCFC-SUHUHFCYSA-N 0 0 375.347 3.061 20 5 GGBDRN C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000268116864 1434495836 /nfs/dbraw/zinc/49/58/36/1434495836.db2.gz 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C[C@@H]1CCN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])CC12CCC2 ZINC000271312957 1434815168 /nfs/dbraw/zinc/81/51/68/1434815168.db2.gz IZRIXUNWTCUPGV-GFCCVEGCSA-N 0 0 379.844 3.017 20 5 GGBDRN COc1ccc(C[C@H](CO)CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1O ZINC000271323303 1434816120 /nfs/dbraw/zinc/81/61/20/1434816120.db2.gz OXCBYXYVMMPQCU-LBPRGKRZSA-N 0 0 398.362 3.174 20 5 GGBDRN O=C(c1ccccc1)C1CCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC1 ZINC000271349190 1434818235 /nfs/dbraw/zinc/81/82/35/1434818235.db2.gz VVVMDTKCGIXWDP-UHFFFAOYSA-N 0 0 396.428 3.335 20 5 GGBDRN COC[C@H](NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000271438214 1434824804 /nfs/dbraw/zinc/82/48/04/1434824804.db2.gz BBLPMQZFMZBTQN-HNNXBMFYSA-N 0 0 395.362 3.069 20 5 GGBDRN COC[C@@H](NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000271438219 1434824826 /nfs/dbraw/zinc/82/48/26/1434824826.db2.gz BBLPMQZFMZBTQN-OAHLLOKOSA-N 0 0 395.362 3.069 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(F)cc(OC)c1 ZINC000271441760 1434825060 /nfs/dbraw/zinc/82/50/60/1434825060.db2.gz PVOUWDHYFCTBJX-UHFFFAOYSA-N 0 0 394.424 3.411 20 5 GGBDRN COc1ccc([C@@H](OC)[C@@H](C)Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000271448093 1434825587 /nfs/dbraw/zinc/82/55/87/1434825587.db2.gz PDBOWPQOEWTQNU-XIKOKIGWSA-N 0 0 394.449 3.195 20 5 GGBDRN CC(C)[C@H]1C[C@H](NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000271452684 1434826006 /nfs/dbraw/zinc/82/60/06/1434826006.db2.gz DZVBTUJYZXPFPS-DNVCBOLYSA-N 0 0 391.468 3.351 20 5 GGBDRN CN(CCC1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1)C(=O)OC(C)(C)C ZINC000271481808 1434828417 /nfs/dbraw/zinc/82/84/17/1434828417.db2.gz WIJGRMPBIAOVTO-UHFFFAOYSA-N 0 0 380.445 3.032 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000271532993 1434832608 /nfs/dbraw/zinc/83/26/08/1434832608.db2.gz TYSJLITWMZGERA-LRDDRELGSA-N 0 0 396.806 3.494 20 5 GGBDRN COC[C@@H](NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000271553837 1434834413 /nfs/dbraw/zinc/83/44/13/1434834413.db2.gz PCBFMKIWPREECT-CQSZACIVSA-N 0 0 396.346 3.008 20 5 GGBDRN COc1ccc([C@H](OC)[C@@H](C)NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1 ZINC000271564646 1434835232 /nfs/dbraw/zinc/83/52/32/1434835232.db2.gz OQOWYWIIXHMVEF-BMLIUANNSA-N 0 0 380.347 3.388 20 5 GGBDRN CCc1nn(C)cc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000271584819 1434837016 /nfs/dbraw/zinc/83/70/16/1434837016.db2.gz VYRIABZAURVDQM-UHFFFAOYSA-N 0 0 385.346 3.350 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](C(C)C)C1 ZINC000271592030 1434837528 /nfs/dbraw/zinc/83/75/28/1434837528.db2.gz TYRMZGKOVXPKBN-CZUORRHYSA-N 0 0 382.482 3.267 20 5 GGBDRN COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000271604812 1434838469 /nfs/dbraw/zinc/83/84/69/1434838469.db2.gz VRGCTDIBGNCRLG-KPZWWZAWSA-N 0 0 396.465 3.177 20 5 GGBDRN COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000271604824 1434838530 /nfs/dbraw/zinc/83/85/30/1434838530.db2.gz VRGCTDIBGNCRLG-SGTLLEGYSA-N 0 0 396.465 3.177 20 5 GGBDRN Cc1cc(C2CCN(CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC2)n[nH]1 ZINC000271633484 1434840531 /nfs/dbraw/zinc/84/05/31/1434840531.db2.gz PPNGAWAVZLLVPU-UHFFFAOYSA-N 0 0 377.832 3.098 20 5 GGBDRN Cc1cc(C2CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)n[nH]1 ZINC000271650900 1434841903 /nfs/dbraw/zinc/84/19/03/1434841903.db2.gz VCXPIIRLFXPXPK-UHFFFAOYSA-N 0 0 377.832 3.098 20 5 GGBDRN COc1cc(N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c(F)cc1[N+](=O)[O-] ZINC000271669132 1434843007 /nfs/dbraw/zinc/84/30/07/1434843007.db2.gz WMZQNYGMVHLPQE-LLVKDONJSA-N 0 0 382.413 3.343 20 5 GGBDRN O=C(NCc1cccnc1)C1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000271669239 1434843053 /nfs/dbraw/zinc/84/30/53/1434843053.db2.gz WRINATVLSOKXQC-UHFFFAOYSA-N 0 0 391.431 3.071 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2ccc(OC[C@@H]3CCCO3)cc2)s1 ZINC000271678403 1434843602 /nfs/dbraw/zinc/84/36/02/1434843602.db2.gz BJIJSOUDEXIETN-ZDUSSCGKSA-N 0 0 398.462 3.361 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(S(C)(=O)=O)ccc1OC(C)C ZINC000271711195 1434845793 /nfs/dbraw/zinc/84/57/93/1434845793.db2.gz JNFIDIXWZUPSJH-UHFFFAOYSA-N 0 0 392.433 3.346 20 5 GGBDRN CC(C)Oc1ccc(S(C)(=O)=O)cc1C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000271717020 1434845918 /nfs/dbraw/zinc/84/59/18/1434845918.db2.gz KSPCYZIPMIDBLV-UHFFFAOYSA-N 0 0 392.433 3.062 20 5 GGBDRN COc1ccc([C@@H](OC)[C@H](C)NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)cc1 ZINC000271787438 1434850629 /nfs/dbraw/zinc/85/06/29/1434850629.db2.gz KWWVZAGTIWGQSG-BTDLBPIBSA-N 0 0 380.347 3.388 20 5 GGBDRN CCN(CCc1cccs1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000271829177 1434853256 /nfs/dbraw/zinc/85/32/56/1434853256.db2.gz DTRBDAVZKBIHNV-UHFFFAOYSA-N 0 0 389.477 3.198 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)[C@@H](OC)c2ccccc2F)cc([N+](=O)[O-])c1OC ZINC000271881757 1434856929 /nfs/dbraw/zinc/85/69/29/1434856929.db2.gz GITOMEXRLWBMRL-APPDUMDISA-N 0 0 392.383 3.257 20 5 GGBDRN CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000271892650 1434857419 /nfs/dbraw/zinc/85/74/19/1434857419.db2.gz IFBNGRWURXHUPT-BBATYDOGSA-N 0 0 390.367 3.011 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCCOCC2)c([N+](=O)[O-])c1N[C@@H]1CCCOCC1 ZINC000271935504 1434860356 /nfs/dbraw/zinc/86/03/56/1434860356.db2.gz XUHSMXQQDKNEJG-ZIAGYGMSSA-N 0 0 394.428 3.465 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000271940278 1434860696 /nfs/dbraw/zinc/86/06/96/1434860696.db2.gz ROGWPDNCHMZGBW-CRAIPNDOSA-N 0 0 396.321 3.037 20 5 GGBDRN C[C@@H](Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)[C@H]1CCCCO1 ZINC000272053583 1434869108 /nfs/dbraw/zinc/86/91/08/1434869108.db2.gz XZOGXWPCZWXGMA-IAQYHMDHSA-N 0 0 378.816 3.164 20 5 GGBDRN CC(C)(C)[C@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@@H]1O ZINC000272081378 1434870780 /nfs/dbraw/zinc/87/07/80/1434870780.db2.gz JKGPUWYZWRXFEO-LPHOPBHVSA-N 0 0 389.496 3.067 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000272090108 1434871534 /nfs/dbraw/zinc/87/15/34/1434871534.db2.gz DAQJNIVNMUCGBC-CJNGLKHVSA-N 0 0 378.425 3.080 20 5 GGBDRN Cc1cc(N2CCOCC2)ccc1NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272137110 1434874126 /nfs/dbraw/zinc/87/41/26/1434874126.db2.gz YKGVBNRETKYSOE-UHFFFAOYSA-N 0 0 391.374 3.470 20 5 GGBDRN C[C@H](NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000272144561 1434874647 /nfs/dbraw/zinc/87/46/47/1434874647.db2.gz BIIWHUONAMBOKL-NSHDSACASA-N 0 0 389.358 3.083 20 5 GGBDRN CC(C)[C@@H](NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1nc(C2CC2)no1 ZINC000272147575 1434874806 /nfs/dbraw/zinc/87/48/06/1434874806.db2.gz BVFISKAUIHPEBZ-CYBMUJFWSA-N 0 0 380.351 3.461 20 5 GGBDRN O=C(c1ccccc1)C1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1 ZINC000272151158 1434874969 /nfs/dbraw/zinc/87/49/69/1434874969.db2.gz BUIUYWQAZJDOHD-UHFFFAOYSA-N 0 0 382.372 3.059 20 5 GGBDRN COCC[C@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccc(C)o1 ZINC000272156282 1434875371 /nfs/dbraw/zinc/87/53/71/1434875371.db2.gz FCNXBWZAFMPSFL-HNNXBMFYSA-N 0 0 377.397 3.082 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@H](C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272167936 1434875884 /nfs/dbraw/zinc/87/58/84/1434875884.db2.gz PIGHQVXOCSQFHF-NSHDSACASA-N 0 0 378.860 3.136 20 5 GGBDRN Cc1noc(C)c1[C@H](C)CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272193808 1434877291 /nfs/dbraw/zinc/87/72/91/1434877291.db2.gz BXVNXENSBFSQLO-SNVBAGLBSA-N 0 0 380.832 3.498 20 5 GGBDRN O=C(Nc1ccccc1O[C@@H]1CCOC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272205069 1434877839 /nfs/dbraw/zinc/87/78/39/1434877839.db2.gz YXTKVIWZPKVMFJ-CQSZACIVSA-N 0 0 378.331 3.493 20 5 GGBDRN O=C(Nc1ccccc1O[C@H]1CCOC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272205066 1434877919 /nfs/dbraw/zinc/87/79/19/1434877919.db2.gz YXTKVIWZPKVMFJ-AWEZNQCLSA-N 0 0 378.331 3.493 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 ZINC000272208796 1434878157 /nfs/dbraw/zinc/87/81/57/1434878157.db2.gz CETJPBMZRAGLRG-BBRMVZONSA-N 0 0 380.441 3.326 20 5 GGBDRN Cc1nn(CC(F)(F)F)cc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272208182 1434878228 /nfs/dbraw/zinc/87/82/28/1434878228.db2.gz ZWCVLCOBGWOXEA-UHFFFAOYSA-N 0 0 390.749 3.288 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000272222969 1434879007 /nfs/dbraw/zinc/87/90/07/1434879007.db2.gz AGCWDQKJCXLNMM-CHWSQXEVSA-N 0 0 390.440 3.471 20 5 GGBDRN COc1cc([C@@H]2NC(=O)c3c(C)cccc3N2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272224462 1434879265 /nfs/dbraw/zinc/87/92/65/1434879265.db2.gz QFUOUMWULFVDFJ-KRWDZBQOSA-N 0 0 393.346 3.410 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000272229635 1434879894 /nfs/dbraw/zinc/87/98/94/1434879894.db2.gz UHRJKIUEFCZFPV-ZFWWWQNUSA-N 0 0 392.456 3.040 20 5 GGBDRN CCCCCC(=O)NC1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272241728 1434880994 /nfs/dbraw/zinc/88/09/94/1434880994.db2.gz RADJRYZUTNACOJ-UHFFFAOYSA-N 0 0 397.422 3.374 20 5 GGBDRN O=C(N[C@@H]1CCCOc2c(F)cccc21)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000272249436 1434881590 /nfs/dbraw/zinc/88/15/90/1434881590.db2.gz HVGHTUCLEAAYAK-CQSZACIVSA-N 0 0 388.351 3.149 20 5 GGBDRN Cc1c(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cccc1C(=O)N1CCCC1 ZINC000272260827 1434882352 /nfs/dbraw/zinc/88/23/52/1434882352.db2.gz BDNDTXIYPNUQAV-UHFFFAOYSA-N 0 0 397.387 3.120 20 5 GGBDRN O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272268450 1434882759 /nfs/dbraw/zinc/88/27/59/1434882759.db2.gz NKKVNWOVCOZANO-CYBMUJFWSA-N 0 0 379.319 3.104 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000272275867 1434883404 /nfs/dbraw/zinc/88/34/04/1434883404.db2.gz MCOUTSKNGPKPDH-KBPBESRZSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1cccc(N2C(=O)N[C@H](CCC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2=O)c1 ZINC000272308838 1434886235 /nfs/dbraw/zinc/88/62/35/1434886235.db2.gz SQYJVOGWCINTOM-MRXNPFEDSA-N 0 0 396.403 3.055 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1 ZINC000272340711 1434888530 /nfs/dbraw/zinc/88/85/30/1434888530.db2.gz NETLKXDDSSNCOX-LLVKDONJSA-N 0 0 384.417 3.238 20 5 GGBDRN CC(C)(C)Oc1ccc(CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cn1 ZINC000272346834 1434889207 /nfs/dbraw/zinc/88/92/07/1434889207.db2.gz XSTNPPMQJJAWQQ-UHFFFAOYSA-N 0 0 379.438 3.183 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000272356162 1434889963 /nfs/dbraw/zinc/88/99/63/1434889963.db2.gz RMKKYDPNWPBBJG-UFXRLHEYSA-N 0 0 389.452 3.370 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000272356156 1434890016 /nfs/dbraw/zinc/89/00/16/1434890016.db2.gz RMKKYDPNWPBBJG-KTMLPXRHSA-N 0 0 389.452 3.370 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000272362283 1434890393 /nfs/dbraw/zinc/89/03/93/1434890393.db2.gz SHIKIDCZRGDXJN-GOEBONIOSA-N 0 0 391.468 3.207 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000272362285 1434890465 /nfs/dbraw/zinc/89/04/65/1434890465.db2.gz SHIKIDCZRGDXJN-HOCLYGCPSA-N 0 0 391.468 3.207 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@@H](OCc2ccccn2)C1 ZINC000272373753 1434891211 /nfs/dbraw/zinc/89/12/11/1434891211.db2.gz UZBBYLNIRGIEIP-CQSZACIVSA-N 0 0 393.346 3.023 20 5 GGBDRN COc1cc(CNCc2cn3ccccc3n2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272376412 1434891775 /nfs/dbraw/zinc/89/17/75/1434891775.db2.gz HEWBMSJJXMHBLB-UHFFFAOYSA-N 0 0 392.362 3.185 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272387749 1434892858 /nfs/dbraw/zinc/89/28/58/1434892858.db2.gz ITOGLUJVZZVZTJ-UHFFFAOYSA-N 0 0 397.387 3.120 20 5 GGBDRN Cc1c(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cnn1C1CCOCC1 ZINC000272396831 1434893812 /nfs/dbraw/zinc/89/38/12/1434893812.db2.gz BNZAZTRLIUGOIS-UHFFFAOYSA-N 0 0 392.843 3.077 20 5 GGBDRN COc1cc(COc2ccccc2OCCO)c([N+](=O)[O-])cc1OCC(F)F ZINC000272400667 1434893905 /nfs/dbraw/zinc/89/39/05/1434893905.db2.gz JVWGJZZFJHXVLP-UHFFFAOYSA-N 0 0 399.346 3.197 20 5 GGBDRN COc1ccc(OC)c2c1CN(C(=O)Nc1ccc([N+](=O)[O-])c(C)c1)C[C@@H]2O ZINC000272400331 1434894007 /nfs/dbraw/zinc/89/40/07/1434894007.db2.gz XILGERVNZDEFDQ-HNNXBMFYSA-N 0 0 387.392 3.002 20 5 GGBDRN O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272409627 1434894496 /nfs/dbraw/zinc/89/44/96/1434894496.db2.gz KXNGHXDVGRTVDD-KDOFPFPSSA-N 0 0 384.388 3.221 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000272423217 1434895266 /nfs/dbraw/zinc/89/52/66/1434895266.db2.gz OKOCIHWGAKECET-QWRGUYRKSA-N 0 0 399.394 3.248 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000272426175 1434895422 /nfs/dbraw/zinc/89/54/22/1434895422.db2.gz NKHQWZOFDNZXCC-QWHCGFSZSA-N 0 0 378.429 3.362 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000272426173 1434895457 /nfs/dbraw/zinc/89/54/57/1434895457.db2.gz NKHQWZOFDNZXCC-OLZOCXBDSA-N 0 0 378.429 3.362 20 5 GGBDRN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272427515 1434895458 /nfs/dbraw/zinc/89/54/58/1434895458.db2.gz NOCWYHATPFSWAL-UHFFFAOYSA-N 0 0 399.403 3.270 20 5 GGBDRN COc1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000272461766 1434898038 /nfs/dbraw/zinc/89/80/38/1434898038.db2.gz CPOKTASBMKSBBH-CQSZACIVSA-N 0 0 386.404 3.153 20 5 GGBDRN CCc1cc(NCc2nnc(C(C)C)n2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272463864 1434898094 /nfs/dbraw/zinc/89/80/94/1434898094.db2.gz HNTPFSVHRRMENE-UHFFFAOYSA-N 0 0 381.440 3.478 20 5 GGBDRN COc1ccc(CNCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])cc1O ZINC000272465621 1434898114 /nfs/dbraw/zinc/89/81/14/1434898114.db2.gz REKJMKKNHYNRMN-UHFFFAOYSA-N 0 0 398.362 3.251 20 5 GGBDRN COc1cc(COc2cccnc2[N+](=O)[O-])c([N+](=O)[O-])cc1OCC(F)F ZINC000272477621 1434899179 /nfs/dbraw/zinc/89/91/79/1434899179.db2.gz QFXSQHDIELAYIA-UHFFFAOYSA-N 0 0 385.279 3.130 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272486539 1434899744 /nfs/dbraw/zinc/89/97/44/1434899744.db2.gz DCHVMAMXIGMKID-AZUAARDMSA-N 0 0 380.448 3.174 20 5 GGBDRN Cn1ccnc1[C@@H](NC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000272487915 1434899813 /nfs/dbraw/zinc/89/98/13/1434899813.db2.gz DHCGPMLHVRRZAD-INIZCTEOSA-N 0 0 397.401 3.034 20 5 GGBDRN COc1cccc(OCCCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272492172 1434900111 /nfs/dbraw/zinc/90/01/11/1434900111.db2.gz DZWKTQRQJFLJJL-HXUWFJFHSA-N 0 0 396.447 3.485 20 5 GGBDRN CN(C)[C@H](CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000272496112 1434900485 /nfs/dbraw/zinc/90/04/85/1434900485.db2.gz FYKOWRMNCATXFA-QZTJIDSGSA-N 0 0 385.493 3.372 20 5 GGBDRN CCCOc1ccc(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000272495998 1434900502 /nfs/dbraw/zinc/90/05/02/1434900502.db2.gz FWJVAWMMTYRMAF-IBGZPJMESA-N 0 0 381.436 3.391 20 5 GGBDRN Cn1ccnc1[C@@H](NCCc1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000272497539 1434900985 /nfs/dbraw/zinc/90/09/85/1434900985.db2.gz GGFOOZHQHDLJCU-FQEVSTJZSA-N 0 0 394.431 3.021 20 5 GGBDRN CC(C)Oc1ccc(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000272501342 1434901135 /nfs/dbraw/zinc/90/11/35/1434901135.db2.gz HAMXALKAOQXGLO-IBGZPJMESA-N 0 0 381.436 3.390 20 5 GGBDRN CC(C)Oc1ccc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000272501343 1434901266 /nfs/dbraw/zinc/90/12/66/1434901266.db2.gz HAMXALKAOQXGLO-LJQANCHMSA-N 0 0 381.436 3.390 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272533066 1434904985 /nfs/dbraw/zinc/90/49/85/1434904985.db2.gz MOXYHIGDXPRCOD-UHFFFAOYSA-N 0 0 397.422 3.230 20 5 GGBDRN O=C(NCc1ccccc1N1CCCCC1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000272534941 1434905511 /nfs/dbraw/zinc/90/55/11/1434905511.db2.gz UHPBYTZVWLRWBM-UHFFFAOYSA-N 0 0 397.431 3.286 20 5 GGBDRN COCCN(Cc1ccccn1)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272556897 1434907514 /nfs/dbraw/zinc/90/75/14/1434907514.db2.gz RSTNCMXWRCNOKT-UHFFFAOYSA-N 0 0 392.843 3.044 20 5 GGBDRN COc1ccc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000272559650 1434907619 /nfs/dbraw/zinc/90/76/19/1434907619.db2.gz SVMJVQVKPYUFQL-LJQANCHMSA-N 0 0 382.420 3.225 20 5 GGBDRN C[NH+]1CCC2(CC1)C[C@@H](NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)c1ccccc1O2 ZINC000272572576 1434909019 /nfs/dbraw/zinc/90/90/19/1434909019.db2.gz NFJCCSZLIQDPSG-GOSISDBHSA-N 0 0 397.431 3.018 20 5 GGBDRN Cn1ccnc1[C@H](NCc1ccc(OCC2CC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000272575015 1434909299 /nfs/dbraw/zinc/90/92/99/1434909299.db2.gz WXMILOLHOIWUQQ-HXUWFJFHSA-N 0 0 393.447 3.391 20 5 GGBDRN COc1ccc(OCCCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272578043 1434910092 /nfs/dbraw/zinc/91/00/92/1434910092.db2.gz XMWYQBWJZUGQFK-HXUWFJFHSA-N 0 0 396.447 3.485 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@@](C)(O)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000272585858 1434911026 /nfs/dbraw/zinc/91/10/26/1434911026.db2.gz ZCRRKQJXCYZQJR-UYAOXDASSA-N 0 0 384.411 3.054 20 5 GGBDRN O=[N+]([O-])c1cccc(OCc2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)c1 ZINC000272586260 1434911163 /nfs/dbraw/zinc/91/11/63/1434911163.db2.gz FNQIFPSSHVDFCH-SFHVURJKSA-N 0 0 396.403 3.130 20 5 GGBDRN COc1ccc2c(c1)OC[C@@H](N[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000272586752 1434911388 /nfs/dbraw/zinc/91/13/88/1434911388.db2.gz ZEYHNLFJAGEZNN-JXFKEZNVSA-N 0 0 394.431 3.020 20 5 GGBDRN Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000272597045 1434912730 /nfs/dbraw/zinc/91/27/30/1434912730.db2.gz WWUMFKYMKIYQOD-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN COc1ccc(C[C@H](C)C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000272605680 1434914026 /nfs/dbraw/zinc/91/40/26/1434914026.db2.gz GCYXQIVGGOMGDF-ZDUSSCGKSA-N 0 0 388.420 3.116 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000272652027 1434919804 /nfs/dbraw/zinc/91/98/04/1434919804.db2.gz FIQPOIXTUFHQRS-STQMWFEESA-N 0 0 393.444 3.147 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000272652024 1434919858 /nfs/dbraw/zinc/91/98/58/1434919858.db2.gz FIQPOIXTUFHQRS-CHWSQXEVSA-N 0 0 393.444 3.147 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000272662159 1434920792 /nfs/dbraw/zinc/92/07/92/1434920792.db2.gz IAJRIYHRJHFQFE-UHFFFAOYSA-N 0 0 393.407 3.186 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCc1nc([C@@H]2CN(Cc3ccccc3)CCO2)no1 ZINC000272669906 1434921198 /nfs/dbraw/zinc/92/11/98/1434921198.db2.gz QCOLZLSZXYJIEG-SFHVURJKSA-N 0 0 396.403 3.130 20 5 GGBDRN CC(C)Oc1cc(F)ccc1NC(=O)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000272684596 1434922503 /nfs/dbraw/zinc/92/25/03/1434922503.db2.gz VZUUURYKEBENSJ-GFCCVEGCSA-N 0 0 389.383 3.337 20 5 GGBDRN CC(C)[C@H]1C[C@H](CC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)CCO1 ZINC000272691118 1434923018 /nfs/dbraw/zinc/92/30/18/1434923018.db2.gz DFKSNVSZDKWUND-VQIMIIECSA-N 0 0 375.469 3.085 20 5 GGBDRN COc1cc(CN(C)C(=O)c2c(N)cccc2[N+](=O)[O-])c(SC)cc1OC ZINC000272693723 1434923306 /nfs/dbraw/zinc/92/33/06/1434923306.db2.gz UWWRCJGQTMQWCW-UHFFFAOYSA-N 0 0 391.449 3.188 20 5 GGBDRN COCCOc1ccc(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)c(C)c1 ZINC000272705030 1434924517 /nfs/dbraw/zinc/92/45/17/1434924517.db2.gz HBMQNMXAGNTEHH-IBGZPJMESA-N 0 0 399.403 3.060 20 5 GGBDRN COCC[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)c1ccco1 ZINC000272710106 1434924989 /nfs/dbraw/zinc/92/49/89/1434924989.db2.gz RITSJZGCFXPLOJ-CYBMUJFWSA-N 0 0 377.353 3.220 20 5 GGBDRN CCOc1cc2c(cc1OCC)CN(C(=O)Nc1ccncc1[N+](=O)[O-])CC2 ZINC000272760880 1434928791 /nfs/dbraw/zinc/92/87/91/1434928791.db2.gz VQLKGOYWZMJAQI-UHFFFAOYSA-N 0 0 386.408 3.377 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1[N+](=O)[O-] ZINC000272771915 1434929970 /nfs/dbraw/zinc/92/99/70/1434929970.db2.gz FPRLJGAMHQWEKE-KGLIPLIRSA-N 0 0 375.425 3.209 20 5 GGBDRN COc1ccc(NC(=O)NCCc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000272792084 1434931440 /nfs/dbraw/zinc/93/14/40/1434931440.db2.gz GKFOBNYZTVYSLT-UHFFFAOYSA-N 0 0 390.343 3.443 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000272806080 1434932197 /nfs/dbraw/zinc/93/21/97/1434932197.db2.gz MDQYQEJVWGLMQC-CYBMUJFWSA-N 0 0 389.433 3.298 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc([N+](=O)[O-])c1 ZINC000272821972 1434933882 /nfs/dbraw/zinc/93/38/82/1434933882.db2.gz PEAWZTWPHISVJJ-ZBFHGGJFSA-N 0 0 375.425 3.209 20 5 GGBDRN COc1ccc(NC(=O)C(=O)NC2CCC(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000272826857 1434934215 /nfs/dbraw/zinc/93/42/15/1434934215.db2.gz DQEGCUYWUDJEJH-UHFFFAOYSA-N 0 0 397.431 3.385 20 5 GGBDRN CCN(Cc1ccc(Cl)s1)C(=O)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000272830075 1434934242 /nfs/dbraw/zinc/93/42/42/1434934242.db2.gz FCVLAPFSTORPBM-UHFFFAOYSA-N 0 0 397.840 3.306 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000272831541 1434934492 /nfs/dbraw/zinc/93/44/92/1434934492.db2.gz FHVLXGYYDXRFRF-MRXNPFEDSA-N 0 0 385.420 3.022 20 5 GGBDRN COCCCOc1ccccc1NC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000272850041 1434935889 /nfs/dbraw/zinc/93/58/89/1434935889.db2.gz ZXCBKQUEQPFMQY-IBGZPJMESA-N 0 0 399.403 3.142 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000272852538 1434936048 /nfs/dbraw/zinc/93/60/48/1434936048.db2.gz VTTZTYSUELATBL-KGLIPLIRSA-N 0 0 393.415 3.348 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2cccc(OC[C@H]3CCCO3)c2)s1 ZINC000272851795 1434936098 /nfs/dbraw/zinc/93/60/98/1434936098.db2.gz OUYDSGBXJOHMDB-CYBMUJFWSA-N 0 0 398.462 3.361 20 5 GGBDRN COc1ccc(NC(=O)N2CCO[C@@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000272854636 1434936245 /nfs/dbraw/zinc/93/62/45/1434936245.db2.gz RAXRWUYBNJBBRT-QGZVFWFLSA-N 0 0 375.356 3.348 20 5 GGBDRN COc1ccc(NC(=O)CCc2ccc(OC)c(OC)c2OC)cc1[N+](=O)[O-] ZINC000272866615 1434937224 /nfs/dbraw/zinc/93/72/24/1434937224.db2.gz YUSBTYCJUCBAIK-UHFFFAOYSA-N 0 0 390.392 3.201 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@@H]2C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000272868376 1434937402 /nfs/dbraw/zinc/93/74/02/1434937402.db2.gz UATJTROOTYVGKE-HIFRSBDPSA-N 0 0 375.381 3.316 20 5 GGBDRN COc1cc(C(=O)NCCCCOC(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000272870557 1434937710 /nfs/dbraw/zinc/93/77/10/1434937710.db2.gz RUXVCGPWVHZCMZ-UHFFFAOYSA-N 0 0 376.356 3.140 20 5 GGBDRN COc1ccc(NC(=O)Cc2c(C)nn(CC(F)(F)F)c2C)cc1[N+](=O)[O-] ZINC000272872339 1434937803 /nfs/dbraw/zinc/93/78/03/1434937803.db2.gz ZWNCVRQCEKEDBP-UHFFFAOYSA-N 0 0 386.330 3.160 20 5 GGBDRN COc1ccc(NC(=O)N(CC[NH+](C)C)Cc2cccs2)cc1[N+](=O)[O-] ZINC000272879406 1434938245 /nfs/dbraw/zinc/93/82/45/1434938245.db2.gz WMUROEPMNLXAHY-UHFFFAOYSA-N 0 0 378.454 3.261 20 5 GGBDRN C[C@@H]1CN(c2ccc(Nc3sc(S(C)(=O)=O)cc3[N+](=O)[O-])cc2)CCO1 ZINC000272881245 1434938460 /nfs/dbraw/zinc/93/84/60/1434938460.db2.gz VKLMAAOFSSWMSQ-LLVKDONJSA-N 0 0 397.478 3.029 20 5 GGBDRN COc1ccc(NC(=O)N2CCN(c3ccc(Cl)cn3)CC2)cc1[N+](=O)[O-] ZINC000272892919 1434939279 /nfs/dbraw/zinc/93/92/79/1434939279.db2.gz ZBAKXVKIVNRZAN-UHFFFAOYSA-N 0 0 391.815 3.006 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000272900692 1434939759 /nfs/dbraw/zinc/93/97/59/1434939759.db2.gz IQZMHXAFGRFQGB-UHFFFAOYSA-N 0 0 394.428 3.268 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000272951886 1434943756 /nfs/dbraw/zinc/94/37/56/1434943756.db2.gz QKSBBJQKULSKLE-NVXWUHKLSA-N 0 0 397.431 3.070 20 5 GGBDRN COc1cc(C(C)=O)ccc1SC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000272966273 1434945145 /nfs/dbraw/zinc/94/51/45/1434945145.db2.gz UJBAPNKBBVGSFZ-CQSZACIVSA-N 0 0 377.418 3.338 20 5 GGBDRN COc1ccc(OCCOc2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])c1 ZINC000272992058 1434947413 /nfs/dbraw/zinc/94/74/13/1434947413.db2.gz XGXCESGXQAUBIK-UHFFFAOYSA-N 0 0 379.365 3.087 20 5 GGBDRN CC(C)N1CCc2nc(NC(=O)CCOc3ccccc3[N+](=O)[O-])sc2C1 ZINC000273000903 1434948493 /nfs/dbraw/zinc/94/84/93/1434948493.db2.gz HLROHJZMGCSUCW-UHFFFAOYSA-N 0 0 390.465 3.225 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccc(N3CCOC3=O)cc2)cc1[N+](=O)[O-] ZINC000273009392 1434949723 /nfs/dbraw/zinc/94/97/23/1434949723.db2.gz UWIDMFBPJPWIHE-CQSZACIVSA-N 0 0 398.419 3.420 20 5 GGBDRN Cc1cc(C2CCN([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)n[nH]1 ZINC000273018177 1434950697 /nfs/dbraw/zinc/95/06/97/1434950697.db2.gz RPGSQGMPDUBXMH-LBPRGKRZSA-N 0 0 391.859 3.486 20 5 GGBDRN CCOc1cc(NC(=O)N[C@@H](C)C2=CC[N@H+](C)CC2)c([N+](=O)[O-])cc1OCC ZINC000273060373 1434956320 /nfs/dbraw/zinc/95/63/20/1434956320.db2.gz YJLPYUFQGKPDRS-ZDUSSCGKSA-N 0 0 392.456 3.164 20 5 GGBDRN O=C1[C@@H](Nc2ccc3cc([N+](=O)[O-])ccc3n2)CCCN1Cc1ccccn1 ZINC000273092582 1434959850 /nfs/dbraw/zinc/95/98/50/1434959850.db2.gz CRPCSVDWKPAGAF-SFHVURJKSA-N 0 0 377.404 3.141 20 5 GGBDRN CCc1cc(N2CCOCC3(CCOCC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000273121039 1434963815 /nfs/dbraw/zinc/96/38/15/1434963815.db2.gz HLUALORCVNXSNX-UHFFFAOYSA-N 0 0 398.463 3.248 20 5 GGBDRN COc1cc(CN[C@@H](CO)c2ccc(F)cc2)c([N+](=O)[O-])cc1OC(F)F ZINC000273130462 1434964544 /nfs/dbraw/zinc/96/45/44/1434964544.db2.gz RHMMUPBCNCRMEF-ZDUSSCGKSA-N 0 0 386.326 3.167 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@@H](O)CCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000273134795 1434965109 /nfs/dbraw/zinc/96/51/09/1434965109.db2.gz COCSYCLODXNZEX-VQTJNVASSA-N 0 0 380.448 3.001 20 5 GGBDRN Cn1ccnc1[C@@H](NC[C@@H](O)CCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000273134789 1434965180 /nfs/dbraw/zinc/96/51/80/1434965180.db2.gz COCSYCLODXNZEX-PMACEKPBSA-N 0 0 380.448 3.001 20 5 GGBDRN Cc1cccc([C@H]2CCN(C(=O)CSc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000273158504 1434967577 /nfs/dbraw/zinc/96/75/77/1434967577.db2.gz ZEPWPCYQLXMFMF-INIZCTEOSA-N 0 0 399.472 3.110 20 5 GGBDRN COC(=O)[C@@H]1CC12CCN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000273166615 1434968359 /nfs/dbraw/zinc/96/83/59/1434968359.db2.gz GQVLLABDJCAWIE-LBPRGKRZSA-N 0 0 398.868 3.142 20 5 GGBDRN CCOc1cccc(N2CCCN(C(=O)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000273180048 1434969615 /nfs/dbraw/zinc/96/96/15/1434969615.db2.gz ODQUNPVCLSGLSJ-UHFFFAOYSA-N 0 0 375.450 3.408 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273218037 1434973189 /nfs/dbraw/zinc/97/31/89/1434973189.db2.gz BLSUFCNOMJMMBS-PKOBYXMFSA-N 0 0 387.411 3.496 20 5 GGBDRN C[C@]1(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCO[C@@H]1C1CC1 ZINC000273239067 1434974577 /nfs/dbraw/zinc/97/45/77/1434974577.db2.gz FWDWCNMXSDKBBG-PKTZIBPZSA-N 0 0 376.456 3.229 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273265197 1434976562 /nfs/dbraw/zinc/97/65/62/1434976562.db2.gz AFXAHCALUARGTG-BEFAXECRSA-N 0 0 387.411 3.450 20 5 GGBDRN CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273268533 1434976822 /nfs/dbraw/zinc/97/68/22/1434976822.db2.gz HANDBIHLZMUCNF-IEBWSBKVSA-N 0 0 388.395 3.491 20 5 GGBDRN COC[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273291449 1434978650 /nfs/dbraw/zinc/97/86/50/1434978650.db2.gz CLKDDCAVBAAUEJ-OAHLLOKOSA-N 0 0 382.482 3.004 20 5 GGBDRN CN(CC(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000273320559 1434980637 /nfs/dbraw/zinc/98/06/37/1434980637.db2.gz RTYDZXAMHSMDSP-VQIMIIECSA-N 0 0 387.411 3.207 20 5 GGBDRN CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273328045 1434981199 /nfs/dbraw/zinc/98/11/99/1434981199.db2.gz SOIJJNLUOYBCJC-LPHOPBHVSA-N 0 0 388.395 3.491 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273330680 1434981333 /nfs/dbraw/zinc/98/13/33/1434981333.db2.gz UEIUGOSJPUWVKV-IRXDYDNUSA-N 0 0 390.415 3.008 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H](CN1CCCC1=O)c1ccccc1 ZINC000273343534 1434981979 /nfs/dbraw/zinc/98/19/79/1434981979.db2.gz BCQHQPUQFNGKEK-KRWDZBQOSA-N 0 0 386.383 3.219 20 5 GGBDRN CNC(=O)c1ccc(N(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000273351159 1434982609 /nfs/dbraw/zinc/98/26/09/1434982609.db2.gz VFSJGYVHRUIZNA-LPHOPBHVSA-N 0 0 387.411 3.450 20 5 GGBDRN CNC(=O)c1ccc(N(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000273351162 1434982641 /nfs/dbraw/zinc/98/26/41/1434982641.db2.gz VFSJGYVHRUIZNA-QFBILLFUSA-N 0 0 387.411 3.450 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 ZINC000273367508 1434983830 /nfs/dbraw/zinc/98/38/30/1434983830.db2.gz GEKZFIJJDCBPNC-UHFFFAOYSA-N 0 0 399.382 3.246 20 5 GGBDRN CCCN(CC(=O)OC(C)(C)C)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000273405900 1434986641 /nfs/dbraw/zinc/98/66/41/1434986641.db2.gz GZVVYXJBHAICBF-UHFFFAOYSA-N 0 0 389.408 3.043 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000273411913 1434987279 /nfs/dbraw/zinc/98/72/79/1434987279.db2.gz PWHVTTPZBWHOFW-ZFWWWQNUSA-N 0 0 376.388 3.060 20 5 GGBDRN C[C@@H](C(=O)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1)c1cccs1 ZINC000273419571 1434987613 /nfs/dbraw/zinc/98/76/13/1434987613.db2.gz GQOFYRXYHMMGHB-CYBMUJFWSA-N 0 0 399.476 3.375 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273431990 1434988458 /nfs/dbraw/zinc/98/84/58/1434988458.db2.gz UYGUOTADCRZAIH-RDTXWAMCSA-N 0 0 392.358 3.288 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273440235 1434988886 /nfs/dbraw/zinc/98/88/86/1434988886.db2.gz WCCNLKFHKWRJHO-IEBWSBKVSA-N 0 0 387.411 3.496 20 5 GGBDRN CCc1nc(CN2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)CC2)cs1 ZINC000273455645 1434989752 /nfs/dbraw/zinc/98/97/52/1434989752.db2.gz LYXVVRBDVDMVFC-UHFFFAOYSA-N 0 0 393.444 3.103 20 5 GGBDRN CCN(C[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1)CC(F)(F)F ZINC000273458300 1434990017 /nfs/dbraw/zinc/99/00/17/1434990017.db2.gz MHSKOXOPZIHMKH-LLVKDONJSA-N 0 0 392.353 3.472 20 5 GGBDRN COC(=O)CCSc1ncccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000273462433 1434990192 /nfs/dbraw/zinc/99/01/92/1434990192.db2.gz IROWSJBVDDJYRK-UHFFFAOYSA-N 0 0 389.433 3.135 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCOC[C@@H]1C[C@H](O)c1cccs1 ZINC000273493485 1434992124 /nfs/dbraw/zinc/99/21/24/1434992124.db2.gz SYCMOUYAIWFUPS-WFASDCNBSA-N 0 0 395.412 3.152 20 5 GGBDRN C[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCCC2 ZINC000273506079 1434993220 /nfs/dbraw/zinc/99/32/20/1434993220.db2.gz ZOKFUHBRYTUQPS-LBPRGKRZSA-N 0 0 395.506 3.055 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCOC[C@H]1C[C@H](O)c1ccccc1 ZINC000273513612 1434993783 /nfs/dbraw/zinc/99/37/83/1434993783.db2.gz XJKGWKYAYFRRDU-QAPCUYQASA-N 0 0 389.383 3.090 20 5 GGBDRN COC[C@@H](NCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])c1ccco1 ZINC000273530487 1434994672 /nfs/dbraw/zinc/99/46/72/1434994672.db2.gz SPDJQZSPLDWJQD-GFCCVEGCSA-N 0 0 386.351 3.318 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCCCOCCc1ccccc1 ZINC000273532826 1434994894 /nfs/dbraw/zinc/99/48/94/1434994894.db2.gz UXDVKOLIXZISIY-UHFFFAOYSA-N 0 0 392.477 3.054 20 5 GGBDRN CCc1nnc(C)cc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000273534189 1434994968 /nfs/dbraw/zinc/99/49/68/1434994968.db2.gz VGYCXNWABNXMPC-UHFFFAOYSA-N 0 0 382.342 3.460 20 5 GGBDRN Cc1ccc(N2CCN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)cc1 ZINC000273542952 1434995667 /nfs/dbraw/zinc/99/56/67/1434995667.db2.gz LOTHCUGXUYXRIS-UHFFFAOYSA-N 0 0 379.420 3.275 20 5 GGBDRN Cc1cc(C2CCN(C(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)CC2)[nH]n1 ZINC000273563199 1434997007 /nfs/dbraw/zinc/99/70/07/1434997007.db2.gz BYSIAPXSGYKSLY-UHFFFAOYSA-N 0 0 387.396 3.171 20 5 GGBDRN C[C@H]1C[C@@H](CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000273572299 1434997561 /nfs/dbraw/zinc/99/75/61/1434997561.db2.gz OMBAJFNTONGAEW-HOTGVXAUSA-N 0 0 375.469 3.133 20 5 GGBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1CCCCS1(=O)=O ZINC000273575089 1434997800 /nfs/dbraw/zinc/99/78/00/1434997800.db2.gz YLBAQLFZDLWXKG-KRWDZBQOSA-N 0 0 390.417 3.293 20 5 GGBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCCCS1(=O)=O ZINC000273575093 1434997841 /nfs/dbraw/zinc/99/78/41/1434997841.db2.gz YLBAQLFZDLWXKG-QGZVFWFLSA-N 0 0 390.417 3.293 20 5 GGBDRN Cc1cc(C(=O)N2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c(C)o1 ZINC000273582130 1434998181 /nfs/dbraw/zinc/99/81/81/1434998181.db2.gz OYDMWWFMLDVGGA-UHFFFAOYSA-N 0 0 383.408 3.033 20 5 GGBDRN Cc1c(C(=O)NC2CCC(O)(c3ccccc3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000273582843 1434998191 /nfs/dbraw/zinc/99/81/91/1434998191.db2.gz BBURFQXICUTNFJ-UHFFFAOYSA-N 0 0 399.403 3.372 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273586433 1434998550 /nfs/dbraw/zinc/99/85/50/1434998550.db2.gz HZDZNWXCHQYLNR-FUHWJXTLSA-N 0 0 394.424 3.074 20 5 GGBDRN COc1cc(C(=O)NCC[C@H]2CCO[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000273599676 1434999130 /nfs/dbraw/zinc/99/91/30/1434999130.db2.gz RMARLMVIHWPOKH-MNOVXSKESA-N 0 0 388.367 3.140 20 5 GGBDRN O=C(CCc1ccccc1)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000273603106 1434999541 /nfs/dbraw/zinc/99/95/41/1434999541.db2.gz ZMCYKTAKEPEYHJ-UHFFFAOYSA-N 0 0 393.447 3.143 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@H]1CCO[C@H](C)C1 ZINC000273614042 1434999790 /nfs/dbraw/zinc/99/97/90/1434999790.db2.gz URBQLRNUHACXIF-KGLIPLIRSA-N 0 0 382.482 3.268 20 5 GGBDRN O=[N+]([O-])c1cnc(Sc2nnc(-c3cccs3)n2C[C@@H]2CCCO2)nc1 ZINC000273641944 1435001776 /nfs/dbraw/zinc/00/17/76/1435001776.db2.gz SIWOPVYIZBYBLR-NSHDSACASA-N 0 0 390.450 3.035 20 5 GGBDRN Cc1ccc(-c2noc([C@@H]3CCCN(C(=O)N4CCCC4)C3)n2)cc1[N+](=O)[O-] ZINC000273659175 1435002946 /nfs/dbraw/zinc/00/29/46/1435002946.db2.gz AHSDFZWPBIVDIE-OAHLLOKOSA-N 0 0 385.424 3.348 20 5 GGBDRN O=C(NC1CC1)c1ccc(-c2noc(CCNc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000273666599 1435003628 /nfs/dbraw/zinc/00/36/28/1435003628.db2.gz FNTDTORPHGQRQC-UHFFFAOYSA-N 0 0 393.403 3.192 20 5 GGBDRN COC(=O)c1cc(-c2nc(-c3cccnc3N3CCCC3)no2)cc([N+](=O)[O-])c1 ZINC000273678189 1435004556 /nfs/dbraw/zinc/00/45/56/1435004556.db2.gz BJNXRNIDSNEBBO-UHFFFAOYSA-N 0 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CC(C)c1[nH]nc(-c2nc(-c3cccc(N4CCOC4=O)c3)no2)c1[N+](=O)[O-] ZINC000273760579 1435011666 /nfs/dbraw/zinc/01/16/66/1435011666.db2.gz BSRKRLKHEYCFIC-UHFFFAOYSA-N 0 0 384.352 3.115 20 5 GGBDRN Cc1ccc(CN2C[C@@H](c3nc(-c4ccc(N)c([N+](=O)[O-])c4)no3)CC2=O)cc1 ZINC000273766129 1435012146 /nfs/dbraw/zinc/01/21/46/1435012146.db2.gz WXHBEMAIPLVLLT-HNNXBMFYSA-N 0 0 393.403 3.052 20 5 GGBDRN COc1cc(-c2nc(-c3cccc(CN4CCCC4=O)c3)no2)ccc1[N+](=O)[O-] ZINC000273775465 1435013131 /nfs/dbraw/zinc/01/31/31/1435013131.db2.gz FDAGCLPOFVBIAL-UHFFFAOYSA-N 0 0 394.387 3.443 20 5 GGBDRN CC(=O)N1CCc2cc(-c3nc(CCNc4ccccc4[N+](=O)[O-])no3)ccc21 ZINC000273777426 1435013317 /nfs/dbraw/zinc/01/33/17/1435013317.db2.gz FPMWBEWBVQWCAF-UHFFFAOYSA-N 0 0 393.403 3.208 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nc([C@H]3CN(C4CC4)CCO3)no2)cc(C(F)(F)F)c1 ZINC000273778746 1435013504 /nfs/dbraw/zinc/01/35/04/1435013504.db2.gz FJYCHDSZYBFZAL-CYBMUJFWSA-N 0 0 384.314 3.199 20 5 GGBDRN CN(C)C(=O)c1cccc(-c2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000273781992 1435013712 /nfs/dbraw/zinc/01/37/12/1435013712.db2.gz RHVLRWKMQQYWSI-UHFFFAOYSA-N 0 0 395.419 3.391 20 5 GGBDRN Cc1nn(CCc2nc(Cc3csc(C(C)C)n3)no2)c(C)c1[N+](=O)[O-] ZINC000273783335 1435013929 /nfs/dbraw/zinc/01/39/29/1435013929.db2.gz GKLIDWNUIGYTIA-UHFFFAOYSA-N 0 0 376.442 3.205 20 5 GGBDRN CC1CCC(N2C[C@@H](c3nc(-c4ccc(N)c([N+](=O)[O-])c4)no3)CC2=O)CC1 ZINC000273787512 1435014468 /nfs/dbraw/zinc/01/44/68/1435014468.db2.gz ZUFDWQBCFGFELI-QRMWWUJWSA-N 0 0 385.424 3.122 20 5 GGBDRN COCCOc1ccc(Cl)cc1-c1noc(-c2c([N+](=O)[O-])c(C)nn2C)n1 ZINC000273791335 1435014837 /nfs/dbraw/zinc/01/48/37/1435014837.db2.gz HVDIRVFFJRTNCI-UHFFFAOYSA-N 0 0 393.787 3.032 20 5 GGBDRN Cc1cc(Cc2noc([C@@H](C)Sc3nnnn3C3CC3)n2)ccc1[N+](=O)[O-] ZINC000273799735 1435015674 /nfs/dbraw/zinc/01/56/74/1435015674.db2.gz BMQWVZBLSNHHDB-SNVBAGLBSA-N 0 0 387.425 3.052 20 5 GGBDRN COc1ccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cc1[N+](=O)[O-] ZINC000273805196 1435016219 /nfs/dbraw/zinc/01/62/19/1435016219.db2.gz APGWHMUFENHVCO-UHFFFAOYSA-N 0 0 391.355 3.245 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)nc1 ZINC000273810953 1435016922 /nfs/dbraw/zinc/01/69/22/1435016922.db2.gz CFPQXMWJKLJUQI-UHFFFAOYSA-N 0 0 396.363 3.139 20 5 GGBDRN CN(C)C(=O)c1cccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000273818941 1435018126 /nfs/dbraw/zinc/01/81/26/1435018126.db2.gz CITWMIWXFLKQIE-UHFFFAOYSA-N 0 0 387.411 3.030 20 5 GGBDRN CCOc1cccc(NCc2cccc(C(=O)N3CCOCC3)c2)c1[N+](=O)[O-] ZINC000273823563 1435018434 /nfs/dbraw/zinc/01/84/34/1435018434.db2.gz DFWIFDNVVMFNSW-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc([C@H]2CN(C3CC3)CCO2)no1 ZINC000273825138 1435018595 /nfs/dbraw/zinc/01/85/95/1435018595.db2.gz JHUBMBGTISUFMJ-XHDPSFHLSA-N 0 0 376.438 3.367 20 5 GGBDRN CC(C)(C(=O)NCCCNC(=O)c1cccs1)c1ccc([N+](=O)[O-])cc1F ZINC000273837579 1435019857 /nfs/dbraw/zinc/01/98/57/1435019857.db2.gz FRVDAFMHXDBAPH-UHFFFAOYSA-N 0 0 393.440 3.009 20 5 GGBDRN CN(Cc1noc(CCCNc2ccc([N+](=O)[O-])cc2)n1)C(=O)OC(C)(C)C ZINC000273842737 1435020444 /nfs/dbraw/zinc/02/04/44/1435020444.db2.gz KUEZHAFEYVORSX-UHFFFAOYSA-N 0 0 391.428 3.389 20 5 GGBDRN Cc1ccc(-c2nc([C@@H]3CC(=O)N(Cc4ccccc4)C3)no2)cc1[N+](=O)[O-] ZINC000273843587 1435020628 /nfs/dbraw/zinc/02/06/28/1435020628.db2.gz BRPPBBXDVCLOFI-MRXNPFEDSA-N 0 0 378.388 3.469 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273847536 1435021052 /nfs/dbraw/zinc/02/10/52/1435021052.db2.gz KVOWVDXGWVRNAQ-UHFFFAOYSA-N 0 0 397.447 3.433 20 5 GGBDRN COC(=O)c1c(C)c(C(C)=O)[nH]c1Cc1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000273849033 1435021236 /nfs/dbraw/zinc/02/12/36/1435021236.db2.gz QLMQZHOOZDHXDJ-UHFFFAOYSA-N 0 0 398.375 3.170 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(COc3ccc([N+](=O)[O-])c(F)c3)n2)cs1 ZINC000273848588 1435021267 /nfs/dbraw/zinc/02/12/67/1435021267.db2.gz BKGCDXJQCDYQMV-SECBINFHSA-N 0 0 394.384 3.451 20 5 GGBDRN CC(C)(C(=O)Nc1ccc2c(c1)CCN2C(N)=O)c1ccc([N+](=O)[O-])cc1F ZINC000273849035 1435021274 /nfs/dbraw/zinc/02/12/74/1435021274.db2.gz KZLASVUJOOMTGB-UHFFFAOYSA-N 0 0 386.383 3.091 20 5 GGBDRN CC(C)(C)OC(=O)NCCCc1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000273856796 1435022246 /nfs/dbraw/zinc/02/22/46/1435022246.db2.gz MAOGOLDWQRUBHD-UHFFFAOYSA-N 0 0 391.428 3.090 20 5 GGBDRN CC(C)(C(=O)N1CC[C@H](OCc2ccccn2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273872384 1435023971 /nfs/dbraw/zinc/02/39/71/1435023971.db2.gz QJKAGDDBCJXTSA-INIZCTEOSA-N 0 0 387.411 3.224 20 5 GGBDRN Cc1cc(C)nc(SCc2nc(CCNc3ccccc3[N+](=O)[O-])no2)n1 ZINC000273874911 1435024193 /nfs/dbraw/zinc/02/41/93/1435024193.db2.gz NUEAGOULLSLQQZ-UHFFFAOYSA-N 0 0 386.437 3.332 20 5 GGBDRN O=c1oc2cc([N+](=O)[O-])ccc2n1CCCc1nc([C@@H]2CCCCS2)no1 ZINC000273874023 1435024258 /nfs/dbraw/zinc/02/42/58/1435024258.db2.gz CZXROKUNKGKMDW-AWEZNQCLSA-N 0 0 390.421 3.477 20 5 GGBDRN Cc1ccc(-c2noc([C@H]3CCCN(C(=O)c4ccncc4)C3)n2)cc1[N+](=O)[O-] ZINC000273876124 1435024409 /nfs/dbraw/zinc/02/44/09/1435024409.db2.gz UGLQOFGGMZUWNF-INIZCTEOSA-N 0 0 393.403 3.368 20 5 GGBDRN Cc1c(Cc2nc([C@H]3CC(=O)N(Cc4ccccc4)C3)no2)cccc1[N+](=O)[O-] ZINC000273881026 1435024721 /nfs/dbraw/zinc/02/47/21/1435024721.db2.gz FLDZFQZSOJZMOH-KRWDZBQOSA-N 0 0 392.415 3.393 20 5 GGBDRN Cc1c(Cc2nc([C@@H]3CC(=O)N(Cc4ccccc4)C3)no2)cccc1[N+](=O)[O-] ZINC000273881030 1435024733 /nfs/dbraw/zinc/02/47/33/1435024733.db2.gz FLDZFQZSOJZMOH-QGZVFWFLSA-N 0 0 392.415 3.393 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCCC[C@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000273881765 1435024825 /nfs/dbraw/zinc/02/48/25/1435024825.db2.gz LUHHTUKPZABQNJ-SFHVURJKSA-N 0 0 388.445 3.366 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(CCNc3ccccc3[N+](=O)[O-])n2)cs1 ZINC000273893147 1435025909 /nfs/dbraw/zinc/02/59/09/1435025909.db2.gz FIWSQPVFXANCHT-LLVKDONJSA-N 0 0 389.437 3.387 20 5 GGBDRN Cc1cc(Cc2noc(-c3cc4c([nH]c3=O)CCCC4=O)n2)ccc1[N+](=O)[O-] ZINC000273894093 1435026060 /nfs/dbraw/zinc/02/60/60/1435026060.db2.gz JKCZZKYPHXQSDI-UHFFFAOYSA-N 0 0 380.360 3.164 20 5 GGBDRN O=C1C[C@H](c2noc(-c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)CN1C1CC1 ZINC000273893640 1435026065 /nfs/dbraw/zinc/02/60/65/1435026065.db2.gz LTCCBLRQMGZZBT-NSHDSACASA-N 0 0 397.416 3.247 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273897399 1435026416 /nfs/dbraw/zinc/02/64/16/1435026416.db2.gz NRTMFPSPDYBLHQ-UHFFFAOYSA-N 0 0 375.400 3.082 20 5 GGBDRN CNC(=O)c1ccc(OC)c(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000273897421 1435026471 /nfs/dbraw/zinc/02/64/71/1435026471.db2.gz NSBKBEGCPVAPMU-UHFFFAOYSA-N 0 0 389.383 3.018 20 5 GGBDRN CC(=O)N(CCc1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1)Cc1ccccc1 ZINC000273900641 1435026719 /nfs/dbraw/zinc/02/67/19/1435026719.db2.gz JXHHZBRJFWADKV-UHFFFAOYSA-N 0 0 394.431 3.468 20 5 GGBDRN CCOc1ccc(CN(CCCn2ccnc2)c2ncc([N+](=O)[O-])cn2)cc1 ZINC000273908397 1435027658 /nfs/dbraw/zinc/02/76/58/1435027658.db2.gz IOBIAMYBTPOSJH-UHFFFAOYSA-N 0 0 382.424 3.077 20 5 GGBDRN CC(C)(C(=O)Nc1cccc(N2CCNC2=O)c1)c1ccc([N+](=O)[O-])cc1F ZINC000273915771 1435028446 /nfs/dbraw/zinc/02/84/46/1435028446.db2.gz PYEQAKCBJJJCQX-UHFFFAOYSA-N 0 0 386.383 3.180 20 5 GGBDRN O=[N+]([O-])c1ccc2[nH]c(N3CCCN(Cc4cnc(Cl)s4)CC3)nc2c1 ZINC000273918172 1435028614 /nfs/dbraw/zinc/02/86/14/1435028614.db2.gz BDHKPWXYWCUNKL-UHFFFAOYSA-N 0 0 392.872 3.293 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC[C@H]2CC(=O)c2ccco2)cc([N+](=O)[O-])c1F ZINC000273923445 1435028975 /nfs/dbraw/zinc/02/89/75/1435028975.db2.gz JUDCLYWHFLSFHG-LBPRGKRZSA-N 0 0 396.396 3.061 20 5 GGBDRN O=C1[C@H](Nc2ncc([N+](=O)[O-])cn2)CCCN1Cc1cccc(C(F)(F)F)c1 ZINC000273931058 1435029707 /nfs/dbraw/zinc/02/97/07/1435029707.db2.gz KNHGWYMUNZTEGM-CQSZACIVSA-N 0 0 395.341 3.007 20 5 GGBDRN COCc1ncc(-c2noc([C@@H](C)Sc3ccc([N+](=O)[O-])cc3)n2)c(N)n1 ZINC000273950780 1435031496 /nfs/dbraw/zinc/03/14/96/1435031496.db2.gz HPEXRBBMDIAEMY-SECBINFHSA-N 0 0 388.409 3.017 20 5 GGBDRN Cc1cc(=O)c(-c2nc([C@@H]3CCCCS3)no2)nn1-c1ccccc1[N+](=O)[O-] ZINC000273955192 1435031894 /nfs/dbraw/zinc/03/18/94/1435031894.db2.gz JEDMCYZTSDHWCE-HNNXBMFYSA-N 0 0 399.432 3.457 20 5 GGBDRN CC(C)(C(=O)N1CC[C@H](OCc2ccncc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273959611 1435032266 /nfs/dbraw/zinc/03/22/66/1435032266.db2.gz ONXDBETWILJUGB-INIZCTEOSA-N 0 0 387.411 3.224 20 5 GGBDRN CCc1nc(Cc2noc(-c3cc(OC)c(OC)c([N+](=O)[O-])c3)n2)cs1 ZINC000273989283 1435034961 /nfs/dbraw/zinc/03/49/61/1435034961.db2.gz YMOCUUOXNSPREG-UHFFFAOYSA-N 0 0 376.394 3.272 20 5 GGBDRN COc1cccc2[nH]cc(Cc3noc(CCn4nc(C)c([N+](=O)[O-])c4C)n3)c21 ZINC000274005217 1435036463 /nfs/dbraw/zinc/03/64/63/1435036463.db2.gz UDNHTALVDXNKOC-UHFFFAOYSA-N 0 0 396.407 3.115 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(COc3ccc([N+](=O)[O-])cc3)n2)cs1 ZINC000274023223 1435037715 /nfs/dbraw/zinc/03/77/15/1435037715.db2.gz NVOSNFQQJXZEPR-SNVBAGLBSA-N 0 0 376.394 3.312 20 5 GGBDRN Cc1cc(Cc2noc([C@H]3CC(=O)N(Cc4ccccc4)C3)n2)ccc1[N+](=O)[O-] ZINC000274023655 1435037893 /nfs/dbraw/zinc/03/78/93/1435037893.db2.gz SXZUEHJUFHTJLR-KRWDZBQOSA-N 0 0 392.415 3.393 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)c2cc(F)c([N+](=O)[O-])cc2F)n1 ZINC000274028924 1435038262 /nfs/dbraw/zinc/03/82/62/1435038262.db2.gz GOMIXYJHHJAQNG-SNVBAGLBSA-N 0 0 398.366 3.262 20 5 GGBDRN Cc1noc2nc(C3CC3)cc(-c3nc(Cc4ccc([N+](=O)[O-])cn4)no3)c12 ZINC000274050537 1435039778 /nfs/dbraw/zinc/03/97/78/1435039778.db2.gz VFFDZYOALFBAAH-UHFFFAOYSA-N 0 0 378.348 3.353 20 5 GGBDRN O=C1C[C@H](c2noc(-c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)n2)CN1C1CC1 ZINC000274056917 1435040114 /nfs/dbraw/zinc/04/01/14/1435040114.db2.gz XNVLQIDHQHGLEX-VIFPVBQESA-N 0 0 382.298 3.142 20 5 GGBDRN CN([C@H]1CCO[C@@H](c2ccc(F)cc2)C1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000274055561 1435040117 /nfs/dbraw/zinc/04/01/17/1435040117.db2.gz ZIDZMKDMTHYJPU-MAUKXSAKSA-N 0 0 394.424 3.275 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1noc(CSC[C@H]2CCCCO2)n1 ZINC000274073203 1435041388 /nfs/dbraw/zinc/04/13/88/1435041388.db2.gz WYFCGYFUXBBHDB-CYBMUJFWSA-N 0 0 378.454 3.435 20 5 GGBDRN CC(C)(C)OC(=O)N(Cc1nc(Cc2ccc([N+](=O)[O-])cn2)no1)CC1CC1 ZINC000274077375 1435041781 /nfs/dbraw/zinc/04/17/81/1435041781.db2.gz WZRJXHKINWRYEB-UHFFFAOYSA-N 0 0 389.412 3.111 20 5 GGBDRN COCCOCc1noc(-c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 ZINC000274077822 1435041860 /nfs/dbraw/zinc/04/18/60/1435041860.db2.gz GCWBJHSJVHUTGI-ZDUSSCGKSA-N 0 0 399.407 3.376 20 5 GGBDRN CCc1ccc(N2C[C@@H](c3nc(Cc4ccc([N+](=O)[O-])cn4)no3)CC2=O)cc1 ZINC000274081162 1435042092 /nfs/dbraw/zinc/04/20/92/1435042092.db2.gz XEJJCCPGCNWLTP-AWEZNQCLSA-N 0 0 393.403 3.047 20 5 GGBDRN CCc1ccc(N2C[C@H](c3nc(Cc4ccc([N+](=O)[O-])cn4)no3)CC2=O)cc1 ZINC000274081165 1435042099 /nfs/dbraw/zinc/04/20/99/1435042099.db2.gz XEJJCCPGCNWLTP-CQSZACIVSA-N 0 0 393.403 3.047 20 5 GGBDRN Cc1ccccc1[C@@H](Cc1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1)NC(N)=O ZINC000274087591 1435042436 /nfs/dbraw/zinc/04/24/36/1435042436.db2.gz XRNRVTUXSBVTBR-MRXNPFEDSA-N 0 0 395.419 3.138 20 5 GGBDRN O=C(NC1(CO)CCOCC1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000274086687 1435042505 /nfs/dbraw/zinc/04/25/05/1435042505.db2.gz WSONJRJYQAETKV-UHFFFAOYSA-N 0 0 388.445 3.017 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000274088669 1435042655 /nfs/dbraw/zinc/04/26/55/1435042655.db2.gz SSRNERGLGPXJGB-UHFFFAOYSA-N 0 0 381.314 3.249 20 5 GGBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(N3CCOCC3)cn2)no1 ZINC000274099011 1435043558 /nfs/dbraw/zinc/04/35/58/1435043558.db2.gz HURPEXGZDKBUIC-OWBHPGMISA-N 0 0 393.403 3.437 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@@H]1COC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000274110930 1435044577 /nfs/dbraw/zinc/04/45/77/1435044577.db2.gz QWRNUNHVIUHJAA-QZTJIDSGSA-N 0 0 386.452 3.083 20 5 GGBDRN CN(C)C(=O)c1ccc(-c2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000274181939 1435049285 /nfs/dbraw/zinc/04/92/85/1435049285.db2.gz PRLYVABBDKWFAR-UHFFFAOYSA-N 0 0 381.392 3.068 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000274185364 1435049378 /nfs/dbraw/zinc/04/93/78/1435049378.db2.gz FBWYYVJFYAZEHA-CZUORRHYSA-N 0 0 384.417 3.250 20 5 GGBDRN Cc1nn(CCc2nc(CCn3ccc4ccccc43)no2)c(C)c1[N+](=O)[O-] ZINC000274212061 1435051677 /nfs/dbraw/zinc/05/16/77/1435051677.db2.gz OZHWPIYFZYRLKO-UHFFFAOYSA-N 0 0 380.408 3.231 20 5 GGBDRN COc1ccc(CNC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000274211721 1435051694 /nfs/dbraw/zinc/05/16/94/1435051694.db2.gz QPUAYNXRSIEWFU-QFBILLFUSA-N 0 0 385.420 3.323 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000274215432 1435052021 /nfs/dbraw/zinc/05/20/21/1435052021.db2.gz MBIGZVWUAYXCBE-AWEZNQCLSA-N 0 0 391.424 3.110 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Nc1ccc(OCC(=O)N(C)C)cc1 ZINC000274225447 1435052801 /nfs/dbraw/zinc/05/28/01/1435052801.db2.gz DDAOEXPNHXESAP-UHFFFAOYSA-N 0 0 386.408 3.323 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H](C2CC2)C1 ZINC000274235219 1435053566 /nfs/dbraw/zinc/05/35/66/1435053566.db2.gz ZBRJIIKLJWTHQN-XJKSGUPXSA-N 0 0 380.466 3.021 20 5 GGBDRN COc1ccc2c(c1)[C@@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)CCO2 ZINC000274240608 1435053913 /nfs/dbraw/zinc/05/39/13/1435053913.db2.gz HIUWZHNWSZUBAU-HNNXBMFYSA-N 0 0 387.348 3.074 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000274243670 1435054300 /nfs/dbraw/zinc/05/43/00/1435054300.db2.gz SLKDXVYLJKQKKY-HKUYNNGSSA-N 0 0 398.415 3.422 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)o1 ZINC000274252012 1435054943 /nfs/dbraw/zinc/05/49/43/1435054943.db2.gz HJFKULORKGYBLX-MRXNPFEDSA-N 0 0 388.376 3.098 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000274263320 1435056045 /nfs/dbraw/zinc/05/60/45/1435056045.db2.gz XNLWFTSACHVGSD-AEFFLSMTSA-N 0 0 384.388 3.032 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000274270710 1435056567 /nfs/dbraw/zinc/05/65/67/1435056567.db2.gz ZVPJBNUAVFEDKY-RHSMWYFYSA-N 0 0 384.388 3.016 20 5 GGBDRN O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000274270708 1435056584 /nfs/dbraw/zinc/05/65/84/1435056584.db2.gz ZVPJBNUAVFEDKY-PBHICJAKSA-N 0 0 384.388 3.016 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000274288356 1435058096 /nfs/dbraw/zinc/05/80/96/1435058096.db2.gz DNADTIRTGADFQG-GFCCVEGCSA-N 0 0 396.419 3.049 20 5 GGBDRN COc1cc2c(cc1NC(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)NC(=O)CC2 ZINC000274293945 1435058733 /nfs/dbraw/zinc/05/87/33/1435058733.db2.gz DDEOTTJFLVHXAI-UHFFFAOYSA-N 0 0 396.403 3.315 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000274294034 1435058802 /nfs/dbraw/zinc/05/88/02/1435058802.db2.gz DEXBFTOKEDRPIS-LBPRGKRZSA-N 0 0 386.433 3.317 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2C[C@H]3CCC(=O)c4cccc2c43)cc([N+](=O)[O-])c1 ZINC000274297018 1435058988 /nfs/dbraw/zinc/05/89/88/1435058988.db2.gz IRDWDGWYZRPVSN-GFCCVEGCSA-N 0 0 394.383 3.492 20 5 GGBDRN COC(=O)c1cc(C(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc([N+](=O)[O-])c1 ZINC000274328844 1435062255 /nfs/dbraw/zinc/06/22/55/1435062255.db2.gz QQBTUQPTOJXUOC-NSHDSACASA-N 0 0 380.356 3.102 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2cn(C(C)(C)C)nc2C)cc([N+](=O)[O-])c1OC ZINC000274341457 1435063235 /nfs/dbraw/zinc/06/32/35/1435063235.db2.gz OTPDJJWWLZHQNA-NSHDSACASA-N 0 0 390.440 3.363 20 5 GGBDRN Cc1c(C(=O)N2CCC[C@@H](CC(=O)OC(C)C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000274397003 1435067930 /nfs/dbraw/zinc/06/79/30/1435067930.db2.gz WZHWFUKTNWTKRM-ZDUSSCGKSA-N 0 0 393.396 3.005 20 5 GGBDRN C[C@H](CNC(=O)OC(C)(C)C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000274411486 1435068850 /nfs/dbraw/zinc/06/88/50/1435068850.db2.gz OOIWHYFNICXMKG-CYBMUJFWSA-N 0 0 392.456 3.156 20 5 GGBDRN CCC1(CC)CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])CCS1 ZINC000274420158 1435069550 /nfs/dbraw/zinc/06/95/50/1435069550.db2.gz OEPZSAVWSSKMGU-UHFFFAOYSA-N 0 0 399.900 3.112 20 5 GGBDRN COC(=O)COc1ccc([C@@H](C)NCc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000274497366 1435074964 /nfs/dbraw/zinc/07/49/64/1435074964.db2.gz UMWBOQGZZKQTLY-GFCCVEGCSA-N 0 0 392.383 3.145 20 5 GGBDRN CC(C)(C(=O)NCc1nnc(C2CC2)n1C1CC1)c1ccc([N+](=O)[O-])cc1F ZINC000274500815 1435075156 /nfs/dbraw/zinc/07/51/56/1435075156.db2.gz LRHZMGXZNCMHAG-UHFFFAOYSA-N 0 0 387.415 3.132 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCC[C@@H](CC(=O)OC(C)C)C2)cc1[N+](=O)[O-] ZINC000274513740 1435076064 /nfs/dbraw/zinc/07/60/64/1435076064.db2.gz VRKRCZSJGAGGTJ-ZDUSSCGKSA-N 0 0 393.396 3.005 20 5 GGBDRN COc1cc2c(cc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])NC(=O)CC2 ZINC000274526238 1435076787 /nfs/dbraw/zinc/07/67/87/1435076787.db2.gz XOMVSEPZKKLSAM-UHFFFAOYSA-N 0 0 384.392 3.152 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCSC[C@H]1c1nccs1 ZINC000274546471 1435077913 /nfs/dbraw/zinc/07/79/13/1435077913.db2.gz VYCJSDXFZOXBLB-ZDUSSCGKSA-N 0 0 394.478 3.060 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCSC2(CCOCC2)C1 ZINC000274580017 1435079105 /nfs/dbraw/zinc/07/91/05/1435079105.db2.gz NJMZYWAUTYYYRV-UHFFFAOYSA-N 0 0 399.900 3.098 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000274659153 1435083869 /nfs/dbraw/zinc/08/38/69/1435083869.db2.gz VHCXAZVGOTZSPX-UHFFFAOYSA-N 0 0 375.812 3.203 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ncc(C2(O)CCCCC2)s1 ZINC000274662669 1435083982 /nfs/dbraw/zinc/08/39/82/1435083982.db2.gz FOLWUHRYJCUTSZ-UHFFFAOYSA-N 0 0 377.422 3.221 20 5 GGBDRN C[C@@H](NC(=O)N1CCC(c2nnc3n2CCCC3)CC1)c1cccc([N+](=O)[O-])c1 ZINC000274702976 1435086301 /nfs/dbraw/zinc/08/63/01/1435086301.db2.gz QVYCFFDMPZREAR-CQSZACIVSA-N 0 0 398.467 3.173 20 5 GGBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC(c2nnc3n2CCCC3)CC1 ZINC000274701576 1435086373 /nfs/dbraw/zinc/08/63/73/1435086373.db2.gz VSOAWWUKMFSSAM-UHFFFAOYSA-N 0 0 394.435 3.024 20 5 GGBDRN COC(CCCC(C)(C)CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])OC ZINC000274702582 1435086384 /nfs/dbraw/zinc/08/63/84/1435086384.db2.gz VGQNIJULVUUTKN-UHFFFAOYSA-N 0 0 388.486 3.226 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000274742124 1435088922 /nfs/dbraw/zinc/08/89/22/1435088922.db2.gz VSMFCBPWGODOMT-UHFFFAOYSA-N 0 0 392.456 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCC(c3nnc4n3CCCC4)CC2)c2ncccc12 ZINC000274787147 1435092458 /nfs/dbraw/zinc/09/24/58/1435092458.db2.gz XNSJHRNTPGPELD-UHFFFAOYSA-N 0 0 378.436 3.455 20 5 GGBDRN COc1cc(N2CCC(c3nnc4n3CCCC4)CC2)c(F)cc1[N+](=O)[O-] ZINC000274787242 1435092574 /nfs/dbraw/zinc/09/25/74/1435092574.db2.gz XPWQRAFRKUYFKV-UHFFFAOYSA-N 0 0 375.404 3.054 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC(c2nnc3n2CCCC3)CC1 ZINC000274815571 1435094961 /nfs/dbraw/zinc/09/49/61/1435094961.db2.gz WMWYIGRMVBFWMO-UHFFFAOYSA-N 0 0 389.843 3.196 20 5 GGBDRN COc1ccc(F)cc1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000274874881 1435100163 /nfs/dbraw/zinc/10/01/63/1435100163.db2.gz GBFBQWSQAHKFMI-UHFFFAOYSA-N 0 0 376.340 3.085 20 5 GGBDRN CCOC(=O)[C@@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(OC)c(F)c1 ZINC000274917964 1435103393 /nfs/dbraw/zinc/10/33/93/1435103393.db2.gz YBMDCHMPQJCTEU-SFHVURJKSA-N 0 0 392.383 3.145 20 5 GGBDRN COc1ccc(NC(=O)NC2(c3noc(C)n3)CCCCC2)cc1[N+](=O)[O-] ZINC000274920063 1435103615 /nfs/dbraw/zinc/10/36/15/1435103615.db2.gz XILZIZLGIJLTCN-UHFFFAOYSA-N 0 0 375.385 3.276 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])c1ccc(OC)c(F)c1 ZINC000274933224 1435104244 /nfs/dbraw/zinc/10/42/44/1435104244.db2.gz BYHBEQPEYJDNNN-QGZVFWFLSA-N 0 0 390.367 3.085 20 5 GGBDRN Cc1c(C(=O)NCc2cc(COC(C)(C)C)on2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000274947745 1435105318 /nfs/dbraw/zinc/10/53/18/1435105318.db2.gz CMRYPSXBIVSFJW-UHFFFAOYSA-N 0 0 392.368 3.045 20 5 GGBDRN C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1 ZINC000274956559 1435105999 /nfs/dbraw/zinc/10/59/99/1435105999.db2.gz JSAOVSPCOWENIV-STQMWFEESA-N 0 0 398.419 3.066 20 5 GGBDRN 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5 GGBDRN CC[C@@H](NC(=O)N[C@H]1CCO[C@@H]1c1nccn1CC)c1cccc([N+](=O)[O-])c1 ZINC000276773825 1435231477 /nfs/dbraw/zinc/23/14/77/1435231477.db2.gz UJGRAOAIUPTVDF-IKGGRYGDSA-N 0 0 387.440 3.092 20 5 GGBDRN COC(=O)[C@H](N[C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(OC)c(O)c1 ZINC000276778411 1435231804 /nfs/dbraw/zinc/23/18/04/1435231804.db2.gz QBLLLOZGDQSVDX-BFUOFWGJSA-N 0 0 388.420 3.134 20 5 GGBDRN COC(=O)[C@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(OC)c(O)c1 ZINC000276778414 1435231840 /nfs/dbraw/zinc/23/18/40/1435231840.db2.gz QBLLLOZGDQSVDX-ORAYPTAESA-N 0 0 388.420 3.134 20 5 GGBDRN COc1ccc(OC(=O)[C@@H](C)Oc2ccc(CCC(C)=O)cc2)cc1[N+](=O)[O-] ZINC000276791604 1435232754 /nfs/dbraw/zinc/23/27/54/1435232754.db2.gz SZVUSSCVQBSHCV-CQSZACIVSA-N 0 0 387.388 3.498 20 5 GGBDRN COc1ccc(OC(=O)CCc2ccc(OC)c(OC)c2OC)cc1[N+](=O)[O-] ZINC000276802352 1435233814 /nfs/dbraw/zinc/23/38/14/1435233814.db2.gz VUFLOCTZFMXBGK-UHFFFAOYSA-N 0 0 391.376 3.167 20 5 GGBDRN COc1cc(C(=O)Nc2cc(OC)c(OC)cc2OC)cc([N+](=O)[O-])c1C ZINC000276806617 1435233886 /nfs/dbraw/zinc/23/38/86/1435233886.db2.gz RNNFBMHIMXPPCX-UHFFFAOYSA-N 0 0 376.365 3.190 20 5 GGBDRN COc1ccc(OC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000276814046 1435234561 /nfs/dbraw/zinc/23/45/61/1435234561.db2.gz YKMICSDFBDRYFN-ZDUSSCGKSA-N 0 0 390.417 3.265 20 5 GGBDRN COc1ccc(OC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000276816201 1435234903 /nfs/dbraw/zinc/23/49/03/1435234903.db2.gz YPOHKBVVXOGCRL-OAHLLOKOSA-N 0 0 384.388 3.061 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC2(CC1)CCN(c1ncc([N+](=O)[O-])cn1)CC2 ZINC000276845882 1435237140 /nfs/dbraw/zinc/23/71/40/1435237140.db2.gz XCBBTBDGEXRMHX-UHFFFAOYSA-N 0 0 377.445 3.002 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc(CN3CCOCC3)cc2)no1 ZINC000276854818 1435237884 /nfs/dbraw/zinc/23/78/84/1435237884.db2.gz FKAVQLRLDBMXIV-UHFFFAOYSA-N 0 0 396.403 3.153 20 5 GGBDRN CCCn1ncc(C(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2C)c1C1CC1 ZINC000276867568 1435238636 /nfs/dbraw/zinc/23/86/36/1435238636.db2.gz GXEFMTBIUSZSOL-UHFFFAOYSA-N 0 0 386.408 3.426 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CC[C@H](O)C2)cc1 ZINC000276872314 1435239181 /nfs/dbraw/zinc/23/91/81/1435239181.db2.gz LLZYGKGTOQFLMU-HIFRSBDPSA-N 0 0 386.404 3.287 20 5 GGBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCC(Oc2ccc(F)nc2)CC1 ZINC000276877284 1435239560 /nfs/dbraw/zinc/23/95/60/1435239560.db2.gz LSIXYEOJHUIAIG-UHFFFAOYSA-N 0 0 381.310 3.091 20 5 GGBDRN CCOc1cc(CNc2cccc(C(=O)N3CCOCC3)c2C)ccc1[N+](=O)[O-] ZINC000276890457 1435240687 /nfs/dbraw/zinc/24/06/87/1435240687.db2.gz KAKCCDUKQLYGCE-UHFFFAOYSA-N 0 0 399.447 3.386 20 5 GGBDRN CCOc1cc(CN[C@@](C)(C(N)=O)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000276894184 1435240917 /nfs/dbraw/zinc/24/09/17/1435240917.db2.gz KRBMSPPFJDVZHY-GOSISDBHSA-N 0 0 377.828 3.137 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cc(Cl)c(F)c(C(=O)OC)c2)c1[N+](=O)[O-] ZINC000276896742 1435241032 /nfs/dbraw/zinc/24/10/32/1435241032.db2.gz RORDXNVNFXUHKZ-UHFFFAOYSA-N 0 0 384.751 3.102 20 5 GGBDRN CCOc1cc(CN2CCOC[C@H]2C[C@H](O)c2cccs2)ccc1[N+](=O)[O-] ZINC000276910252 1435242252 /nfs/dbraw/zinc/24/22/52/1435242252.db2.gz NCZIATIXDYFNOQ-WBVHZDCISA-N 0 0 392.477 3.380 20 5 GGBDRN C[C@@H](CNC(=O)OC(C)(C)C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000276917599 1435242864 /nfs/dbraw/zinc/24/28/64/1435242864.db2.gz OOIWHYFNICXMKG-ZDUSSCGKSA-N 0 0 392.456 3.156 20 5 GGBDRN COC(=O)c1cnc(N2CCO[C@H](c3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000276919892 1435243046 /nfs/dbraw/zinc/24/30/46/1435243046.db2.gz QSXOMBUUWUMVHY-HNNXBMFYSA-N 0 0 377.784 3.008 20 5 GGBDRN COC(=O)c1cnc(N2CCO[C@@H](c3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000276919898 1435243047 /nfs/dbraw/zinc/24/30/47/1435243047.db2.gz QSXOMBUUWUMVHY-OAHLLOKOSA-N 0 0 377.784 3.008 20 5 GGBDRN CCc1c(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cnn1CCC(C)C ZINC000276938570 1435244909 /nfs/dbraw/zinc/24/49/09/1435244909.db2.gz CILGTBCWLCMLNB-UHFFFAOYSA-N 0 0 387.440 3.285 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccccc2NCCOC)cc([N+](=O)[O-])c1 ZINC000276936962 1435244985 /nfs/dbraw/zinc/24/49/85/1435244985.db2.gz FNCJEUWDVYQNAQ-UHFFFAOYSA-N 0 0 387.392 3.082 20 5 GGBDRN CCOc1cc(CNc2ccc(C(=O)N[C@@H](CC)CO)cc2)ccc1[N+](=O)[O-] ZINC000276989273 1435250076 /nfs/dbraw/zinc/25/00/76/1435250076.db2.gz ZTRLPXNUOAONCJ-INIZCTEOSA-N 0 0 387.436 3.106 20 5 GGBDRN CCOc1cc(CNc2ccc(C(=O)N[C@H](CC)CO)cc2)ccc1[N+](=O)[O-] ZINC000276989277 1435250080 /nfs/dbraw/zinc/25/00/80/1435250080.db2.gz ZTRLPXNUOAONCJ-MRXNPFEDSA-N 0 0 387.436 3.106 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](Cc2nc(C)no2)c2ccccc2)c1[N+](=O)[O-] ZINC000276994993 1435250749 /nfs/dbraw/zinc/25/07/49/1435250749.db2.gz HCKYKMNXXSHUDY-OAHLLOKOSA-N 0 0 397.391 3.254 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCCC[C@H]1c1nnc(C2CCOCC2)o1 ZINC000277006133 1435251391 /nfs/dbraw/zinc/25/13/91/1435251391.db2.gz UZRCSPDMVOWMEB-INIZCTEOSA-N 0 0 386.408 3.239 20 5 GGBDRN COC(=O)c1cc(NCc2nc([C@H](C)OCC(C)C)no2)c(C)c([N+](=O)[O-])c1 ZINC000277041160 1435255217 /nfs/dbraw/zinc/25/52/17/1435255217.db2.gz YWFCLCZQGCWHJB-LBPRGKRZSA-N 0 0 392.412 3.419 20 5 GGBDRN Cc1ccc(NC[C@@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000277043222 1435255483 /nfs/dbraw/zinc/25/54/83/1435255483.db2.gz YYGMUSYNCFWMST-IFXJQAMLSA-N 0 0 385.468 3.437 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(NCCCc2nnc3n2CCCC3)cc1Cl ZINC000277050848 1435256635 /nfs/dbraw/zinc/25/66/35/1435256635.db2.gz QGFHFPAWMNMVIQ-UHFFFAOYSA-N 0 0 393.831 3.007 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(C)Cc2cnc(C)s2)c(C)c([N+](=O)[O-])c1 ZINC000277069051 1435258802 /nfs/dbraw/zinc/25/88/02/1435258802.db2.gz BIAICXVXWFXLRX-UHFFFAOYSA-N 0 0 378.410 3.119 20 5 GGBDRN O=C([C@@H]1CC(=O)c2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000277085894 1435260534 /nfs/dbraw/zinc/26/05/34/1435260534.db2.gz FYXQDHNYMQSPOA-LJQANCHMSA-N 0 0 380.400 3.335 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1 ZINC000277088967 1435260748 /nfs/dbraw/zinc/26/07/48/1435260748.db2.gz NJUWIUBOPXMONK-UHFFFAOYSA-N 0 0 383.404 3.482 20 5 GGBDRN COC(=O)c1cc(NC(=O)NC[C@H](C)c2nccs2)c(C)c([N+](=O)[O-])c1 ZINC000277095563 1435261500 /nfs/dbraw/zinc/26/15/00/1435261500.db2.gz DNSPAZFKXZZYAL-VIFPVBQESA-N 0 0 378.410 3.072 20 5 GGBDRN COC(=O)c1cc(NC(=O)NC[C@@H](C)c2nccs2)c(C)c([N+](=O)[O-])c1 ZINC000277095560 1435261532 /nfs/dbraw/zinc/26/15/32/1435261532.db2.gz DNSPAZFKXZZYAL-SECBINFHSA-N 0 0 378.410 3.072 20 5 GGBDRN CC(C)c1cnc(NC(=O)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000277100828 1435261851 /nfs/dbraw/zinc/26/18/51/1435261851.db2.gz VFLUTRSEGOECQO-UHFFFAOYSA-N 0 0 396.856 3.126 20 5 GGBDRN Cc1cccc2c1CN(C(=O)CCCn1c(=O)oc3cc([N+](=O)[O-])ccc31)CC2 ZINC000277098435 1435261858 /nfs/dbraw/zinc/26/18/58/1435261858.db2.gz VXQTZWQYQUDNMK-UHFFFAOYSA-N 0 0 395.415 3.176 20 5 GGBDRN O=C(N[C@@H]1CCCN(C2CCCCC2)C1=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000277099080 1435261917 /nfs/dbraw/zinc/26/19/17/1435261917.db2.gz LRGXIGWWPDOYIK-OAHLLOKOSA-N 0 0 379.844 3.302 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CSCCOc1ccccc1)C(=O)[O-] ZINC000277123116 1435264732 /nfs/dbraw/zinc/26/47/32/1435264732.db2.gz BAQDMWUJFFXJTQ-GOSISDBHSA-N 0 0 390.461 3.258 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCC[C@@H]2CCO[C@H](C)C2)c(C)c([N+](=O)[O-])c1 ZINC000277129552 1435265636 /nfs/dbraw/zinc/26/56/36/1435265636.db2.gz FXBPSNOGYKQNGH-DGCLKSJQSA-N 0 0 379.413 3.017 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCC[C@H]2CCO[C@H](C)C2)c(C)c([N+](=O)[O-])c1 ZINC000277129561 1435265753 /nfs/dbraw/zinc/26/57/53/1435265753.db2.gz FXBPSNOGYKQNGH-YPMHNXCESA-N 0 0 379.413 3.017 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)Oc2ccc([C@@H]3CCOC3)cc2)cc1[N+](=O)[O-] ZINC000277134868 1435266635 /nfs/dbraw/zinc/26/66/35/1435266635.db2.gz WXSIDZOLVFEYGQ-GFCCVEGCSA-N 0 0 397.380 3.014 20 5 GGBDRN COCC[C@H](NC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C)c1ccco1 ZINC000277144847 1435268551 /nfs/dbraw/zinc/26/85/51/1435268551.db2.gz HBBDWMQUDSIIKX-ZDUSSCGKSA-N 0 0 391.380 3.182 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nnc([C@@H](C)CC)[nH]2)cc1OC ZINC000277147694 1435268735 /nfs/dbraw/zinc/26/87/35/1435268735.db2.gz VZWQLVSJVGQGLR-QWRGUYRKSA-N 0 0 391.428 3.125 20 5 GGBDRN CC(C)n1nccc1[C@H]1OCC[C@@H]1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000277150038 1435269254 /nfs/dbraw/zinc/26/92/54/1435269254.db2.gz HMEQMBAZUUMPOI-YOEHRIQHSA-N 0 0 392.843 3.420 20 5 GGBDRN O=C([O-])[C@H](CN1CCCCC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000277154527 1435269806 /nfs/dbraw/zinc/26/98/06/1435269806.db2.gz CVFHJTWIYPELQE-INIZCTEOSA-N 0 0 389.477 3.352 20 5 GGBDRN CCCc1c(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cnn1-c1ccccc1C ZINC000277157911 1435270605 /nfs/dbraw/zinc/27/06/05/1435270605.db2.gz WOLKNCWKQFULPB-UHFFFAOYSA-N 0 0 382.424 3.336 20 5 GGBDRN COc1cc(C(=O)N[C@@H](Cc2nc(C)no2)c2ccccc2)cc([N+](=O)[O-])c1C ZINC000277164315 1435271815 /nfs/dbraw/zinc/27/18/15/1435271815.db2.gz KKGFWJAUGGFQDZ-INIZCTEOSA-N 0 0 396.403 3.317 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@@H]2CCO[C@H](C(C)C)C2)c(C)c([N+](=O)[O-])c1 ZINC000277169274 1435272294 /nfs/dbraw/zinc/27/22/94/1435272294.db2.gz IZGRFDYRPXHDJY-CJNGLKHVSA-N 0 0 379.413 3.015 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@@H]2CCO[C@@H](C(C)C)C2)c(C)c([N+](=O)[O-])c1 ZINC000277169281 1435272570 /nfs/dbraw/zinc/27/25/70/1435272570.db2.gz IZGRFDYRPXHDJY-CZUORRHYSA-N 0 0 379.413 3.015 20 5 GGBDRN Cc1noc(C[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000277171168 1435272848 /nfs/dbraw/zinc/27/28/48/1435272848.db2.gz KSEYTECQNAYHLJ-MRXNPFEDSA-N 0 0 396.403 3.155 20 5 GGBDRN CCOC1CC(CCNC(=O)c2cc([N+](=O)[O-])ccc2SCCOC)C1 ZINC000277171591 1435273172 /nfs/dbraw/zinc/27/31/72/1435273172.db2.gz LVFPGJDEOGELJJ-UHFFFAOYSA-N 0 0 382.482 3.268 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@H](C)Cc2c(C)noc2C)c(C)c([N+](=O)[O-])c1 ZINC000277184985 1435275418 /nfs/dbraw/zinc/27/54/18/1435275418.db2.gz KFZWFMMBZGTELH-SECBINFHSA-N 0 0 390.396 3.047 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(Cc2ccccn2)C2CC2)c(C)c([N+](=O)[O-])c1 ZINC000277204735 1435278098 /nfs/dbraw/zinc/27/80/98/1435278098.db2.gz LUXFNQHCUDYDRI-UHFFFAOYSA-N 0 0 384.392 3.281 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000277244714 1435284179 /nfs/dbraw/zinc/28/41/79/1435284179.db2.gz VAOZBIVQFUSZKI-KSSFIOAISA-N 0 0 376.434 3.188 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCc2ccc([C@H](C)O)cc2)c(C)c([N+](=O)[O-])c1 ZINC000277263658 1435286500 /nfs/dbraw/zinc/28/65/00/1435286500.db2.gz QZGONRCJVWWXKQ-LBPRGKRZSA-N 0 0 387.392 3.065 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(C)c2F)c1 ZINC000277304111 1435291618 /nfs/dbraw/zinc/29/16/18/1435291618.db2.gz BCYUINHKFQDUFS-MHZLTWQESA-N 0 0 394.424 3.190 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1(c2cccc(F)c2F)CCCC1 ZINC000277325974 1435294100 /nfs/dbraw/zinc/29/41/00/1435294100.db2.gz WYPMMNMJIMGRNQ-UHFFFAOYSA-N 0 0 378.379 3.006 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC[S@](=O)C1 ZINC000277360775 1435298358 /nfs/dbraw/zinc/29/83/58/1435298358.db2.gz BURNYWDBYVHQEO-PWFNWSNSSA-N 0 0 388.445 3.228 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000277405986 1435302217 /nfs/dbraw/zinc/30/22/17/1435302217.db2.gz HMCYZDWGZPJGPT-GASCZTMLSA-N 0 0 399.447 3.465 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 ZINC000277405993 1435302461 /nfs/dbraw/zinc/30/24/61/1435302461.db2.gz HMCYZDWGZPJGPT-HUUCEWRRSA-N 0 0 399.447 3.465 20 5 GGBDRN CCOc1cc(CS(=O)(=O)Cc2ccn(C3CCCC3)n2)ccc1[N+](=O)[O-] ZINC000277410508 1435302544 /nfs/dbraw/zinc/30/25/44/1435302544.db2.gz DOEBILRZYCJDJO-UHFFFAOYSA-N 0 0 393.465 3.420 20 5 GGBDRN C[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC[S@]1=O ZINC000277420129 1435303510 /nfs/dbraw/zinc/30/35/10/1435303510.db2.gz DHKCQUFXRSLCCF-PGGUUEOZSA-N 0 0 387.461 3.322 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC[S@@]1=O ZINC000277420119 1435303590 /nfs/dbraw/zinc/30/35/90/1435303590.db2.gz DHKCQUFXRSLCCF-ASHKIFAZSA-N 0 0 387.461 3.322 20 5 GGBDRN CCOc1cc(CS(=O)(=O)Cc2ccc(OC)c(F)c2)ccc1[N+](=O)[O-] ZINC000277434058 1435304416 /nfs/dbraw/zinc/30/44/16/1435304416.db2.gz GLYCWIJILFEZLI-UHFFFAOYSA-N 0 0 383.397 3.256 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(c2ncc(C)s2)CC1 ZINC000277440307 1435304766 /nfs/dbraw/zinc/30/47/66/1435304766.db2.gz NMJPAVRLLZWPSS-UHFFFAOYSA-N 0 0 390.465 3.186 20 5 GGBDRN COc1cccc(CSC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C(=O)[O-])c1 ZINC000277495223 1435308393 /nfs/dbraw/zinc/30/83/93/1435308393.db2.gz XIWDVIYUVOAGMK-QGZVFWFLSA-N 0 0 376.434 3.080 20 5 GGBDRN COc1ccc(C[NH2+]C2CCN(c3ccc(C(=O)[O-])cc3)CC2)cc1[N+](=O)[O-] ZINC000277512540 1435309422 /nfs/dbraw/zinc/30/94/22/1435309422.db2.gz YFNLOHCZFRDVPJ-UHFFFAOYSA-N 0 0 385.420 3.060 20 5 GGBDRN COc1ccc(C(=O)N2CCC(CO)(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000277585688 1435314513 /nfs/dbraw/zinc/31/45/13/1435314513.db2.gz CSAKRFLBUJDTQK-UHFFFAOYSA-N 0 0 384.432 3.061 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1 ZINC000277601269 1435315680 /nfs/dbraw/zinc/31/56/80/1435315680.db2.gz OPVSYCGBERYKIY-LBPRGKRZSA-N 0 0 383.404 3.443 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(CO)(Cc3ccccc3)CC2)c1 ZINC000277610758 1435316217 /nfs/dbraw/zinc/31/62/17/1435316217.db2.gz FSAHWXTWDCPVBQ-UHFFFAOYSA-N 0 0 384.432 3.061 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nnc([C@H]3CCCc4ccccc43)s2)c1[N+](=O)[O-] ZINC000277632854 1435317842 /nfs/dbraw/zinc/31/78/42/1435317842.db2.gz RNPFWCNJQFBOCR-ZDUSSCGKSA-N 0 0 398.448 3.209 20 5 GGBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)N[C@]1(CCO)CCOC1 ZINC000277645031 1435318669 /nfs/dbraw/zinc/31/86/69/1435318669.db2.gz DIQZQDVAHQQVJF-LJQANCHMSA-N 0 0 387.392 3.050 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc2c(s1)CN(C(C)C)CC2 ZINC000277656615 1435319565 /nfs/dbraw/zinc/31/95/65/1435319565.db2.gz VUTVSOXYSPFXEX-UHFFFAOYSA-N 0 0 376.438 3.079 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000277658703 1435319805 /nfs/dbraw/zinc/31/98/05/1435319805.db2.gz WCNRCLOWFNBGHK-MZHQLVBMSA-N 0 0 376.434 3.174 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1c1nc2ccccc2n1C ZINC000277662685 1435320116 /nfs/dbraw/zinc/32/01/16/1435320116.db2.gz WNHRDEUPJRHAIQ-KRWDZBQOSA-N 0 0 380.404 3.467 20 5 GGBDRN O=[N+]([O-])c1ccc(Nc2cnn(Cc3nnc4n3CCCC4)c2)c2ncccc12 ZINC000277676233 1435321182 /nfs/dbraw/zinc/32/11/82/1435321182.db2.gz FCHWNLLNIOEQMO-UHFFFAOYSA-N 0 0 390.407 3.059 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc([C@@H](C)N2CCOCC2)cc1 ZINC000277687571 1435321937 /nfs/dbraw/zinc/32/19/37/1435321937.db2.gz ZDZSMEXJKQRSML-CQSZACIVSA-N 0 0 385.420 3.249 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N[C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC000277706174 1435323270 /nfs/dbraw/zinc/32/32/70/1435323270.db2.gz LKESZQJIPFSYSE-HKUYNNGSSA-N 0 0 395.419 3.191 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N[C@H](c1ccccc1)[C@@H]1CCCO1 ZINC000277706192 1435323278 /nfs/dbraw/zinc/32/32/78/1435323278.db2.gz LKESZQJIPFSYSE-PKOBYXMFSA-N 0 0 395.419 3.191 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)c1[N+](=O)[O-] ZINC000277715888 1435324097 /nfs/dbraw/zinc/32/40/97/1435324097.db2.gz NWYXEMDQCUJSEI-UHFFFAOYSA-N 0 0 380.408 3.089 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCCCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000277758018 1435327713 /nfs/dbraw/zinc/32/77/13/1435327713.db2.gz QBEOQQNIFHESPA-OAHLLOKOSA-N 0 0 398.484 3.133 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1F ZINC000277764442 1435328301 /nfs/dbraw/zinc/32/83/01/1435328301.db2.gz SLBKKEIOYZICNY-SFHVURJKSA-N 0 0 399.422 3.006 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCC[C@H]([C@H](O)C(F)(F)F)C3)co2)cc1 ZINC000277770391 1435328786 /nfs/dbraw/zinc/32/87/86/1435328786.db2.gz MXQNFFSLRWJBRX-WFASDCNBSA-N 0 0 385.342 3.385 20 5 GGBDRN CO[C@@H](c1noc(CCn2cc([N+](=O)[O-])nc2C)n1)c1ccccc1Cl ZINC000277782371 1435329720 /nfs/dbraw/zinc/32/97/20/1435329720.db2.gz FGMUKDXCESZACJ-OAHLLOKOSA-N 0 0 377.788 3.115 20 5 GGBDRN CCOc1cccc([C@@H](C)NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000277790404 1435330685 /nfs/dbraw/zinc/33/06/85/1435330685.db2.gz VDGUUKPLFPOWGT-GFCCVEGCSA-N 0 0 383.408 3.430 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000277792971 1435330885 /nfs/dbraw/zinc/33/08/85/1435330885.db2.gz MXHUVVOJDDQMIB-UHFFFAOYSA-N 0 0 392.433 3.430 20 5 GGBDRN C[C@@H](c1nc(CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCO3)no1)C(C)(C)C ZINC000277796974 1435331342 /nfs/dbraw/zinc/33/13/42/1435331342.db2.gz FOLYNZHDSAJORA-JTQLQIEISA-N 0 0 390.396 3.080 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3ccc4c(c3)CCN4C(C)=O)n2)c1 ZINC000277834198 1435334600 /nfs/dbraw/zinc/33/46/00/1435334600.db2.gz FBNDLJUGFRTARO-UHFFFAOYSA-N 0 0 394.387 3.153 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccc2c(c1)OC(=O)C[C@H]2C ZINC000277863599 1435337314 /nfs/dbraw/zinc/33/73/14/1435337314.db2.gz BDXAYTDFVKYYCF-LLVKDONJSA-N 0 0 386.360 3.034 20 5 GGBDRN CCCCc1ccc(NC(=O)Cc2noc(Cn3cc([N+](=O)[O-])nc3C)n2)cc1 ZINC000277864845 1435337339 /nfs/dbraw/zinc/33/73/39/1435337339.db2.gz MOZRBHBCPOAWRZ-UHFFFAOYSA-N 0 0 398.423 3.055 20 5 GGBDRN COc1ccc(Cc2nc(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])no2)cc1 ZINC000277882886 1435338927 /nfs/dbraw/zinc/33/89/27/1435338927.db2.gz AKWUZBFKVKAYKR-UHFFFAOYSA-N 0 0 385.376 3.185 20 5 GGBDRN COCCOc1cc(C)ccc1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000277892707 1435339893 /nfs/dbraw/zinc/33/98/93/1435339893.db2.gz NKRAZSJTYHJMCR-UHFFFAOYSA-N 0 0 399.407 3.126 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3ccc4c(c3)CCC(=O)N4C)n2)c1 ZINC000277893660 1435339901 /nfs/dbraw/zinc/33/99/01/1435339901.db2.gz KQMQKIURVOUGNA-UHFFFAOYSA-N 0 0 394.387 3.153 20 5 GGBDRN CCC1(c2nc(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])no2)CCOCC1 ZINC000277893421 1435339913 /nfs/dbraw/zinc/33/99/13/1435339913.db2.gz BDCNTBTZHFLEGC-UHFFFAOYSA-N 0 0 377.397 3.044 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277903224 1435340992 /nfs/dbraw/zinc/34/09/92/1435340992.db2.gz RLUWZWQEZJAHGU-UHFFFAOYSA-N 0 0 398.394 3.432 20 5 GGBDRN COc1cc(C(=O)N2CCC(c3ncc(C)s3)CC2)cc([N+](=O)[O-])c1OC ZINC000277907202 1435341419 /nfs/dbraw/zinc/34/14/19/1435341419.db2.gz GDWNZKTVLVZIAJ-UHFFFAOYSA-N 0 0 391.449 3.397 20 5 GGBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1ccccc1N1CCCC1 ZINC000277907944 1435341438 /nfs/dbraw/zinc/34/14/38/1435341438.db2.gz YJJIBFGDHFWNCE-UHFFFAOYSA-N 0 0 380.408 3.393 20 5 GGBDRN COc1cc(Cc2noc(Cc3nc(C)sc3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000277917694 1435342143 /nfs/dbraw/zinc/34/21/43/1435342143.db2.gz CNXLMLGEXJTDNJ-UHFFFAOYSA-N 0 0 390.421 3.250 20 5 GGBDRN COc1ccc2cccc(Cc3noc(CCn4cc([N+](=O)[O-])nc4C)n3)c2c1 ZINC000277921395 1435342552 /nfs/dbraw/zinc/34/25/52/1435342552.db2.gz MXUIPQPUGHZAKQ-UHFFFAOYSA-N 0 0 393.403 3.478 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(CCSCc3ccccn3)n2)c1 ZINC000277923148 1435342665 /nfs/dbraw/zinc/34/26/65/1435342665.db2.gz NPZWOAVYYKCCGG-UHFFFAOYSA-N 0 0 386.433 3.448 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(CCc3nnc(C4CCCC4)o3)n2)c1 ZINC000277943333 1435344457 /nfs/dbraw/zinc/34/44/57/1435344457.db2.gz PRBPHFDHLOYSEC-UHFFFAOYSA-N 0 0 399.407 3.403 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2cccnc2OC2CCCC2)no1 ZINC000277941149 1435344464 /nfs/dbraw/zinc/34/44/64/1435344464.db2.gz ODOWCJULCBHWLH-UHFFFAOYSA-N 0 0 384.396 3.109 20 5 GGBDRN COC1(C)CCN(c2ccc([N+](=O)[O-])c(N3CCC(C)(OC)CC3)n2)CC1 ZINC000277959020 1435345776 /nfs/dbraw/zinc/34/57/76/1435345776.db2.gz YFFVZHQNBDDHKC-UHFFFAOYSA-N 0 0 378.473 3.000 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C1 ZINC000277957851 1435345803 /nfs/dbraw/zinc/34/58/03/1435345803.db2.gz KGTXYOOXACUJCS-UONOGXRCSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1cnc(C2CCN(S(=O)(=O)c3cc([N+](=O)[O-])c(F)cc3C)CC2)s1 ZINC000277959031 1435345868 /nfs/dbraw/zinc/34/58/68/1435345868.db2.gz RYQIYKHSIAECLR-UHFFFAOYSA-N 0 0 399.469 3.376 20 5 GGBDRN CC(C)(C)OC(=O)CCC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000277984607 1435347807 /nfs/dbraw/zinc/34/78/07/1435347807.db2.gz ZUYPXSPLZROVOY-UHFFFAOYSA-N 0 0 378.425 3.087 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(CSc3nc(C)cc(C)n3)n2)c1 ZINC000277990650 1435348445 /nfs/dbraw/zinc/34/84/45/1435348445.db2.gz VIQKIKFWBWFWJP-UHFFFAOYSA-N 0 0 387.421 3.276 20 5 GGBDRN Cc1cnc(C2CCN(S(=O)(=O)CCc3ccccc3[N+](=O)[O-])CC2)s1 ZINC000277993043 1435348653 /nfs/dbraw/zinc/34/86/53/1435348653.db2.gz UQBSSHLQNLURLK-UHFFFAOYSA-N 0 0 395.506 3.112 20 5 GGBDRN CCCCCCNC(=O)Cc1noc(-c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000277998269 1435348838 /nfs/dbraw/zinc/34/88/38/1435348838.db2.gz TVTMJJUYGQXKSL-UHFFFAOYSA-N 0 0 398.423 3.070 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H](C)OC[C@@H]3CCCCO3)n2)c1 ZINC000278014192 1435350163 /nfs/dbraw/zinc/35/01/63/1435350163.db2.gz XTXMWKVYYYVRHH-DOMZBBRYSA-N 0 0 377.397 3.224 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(CSC[C@H]3CCCCO3)n2)c1 ZINC000278020865 1435350835 /nfs/dbraw/zinc/35/08/35/1435350835.db2.gz YKOHQULEXTYTPC-CQSZACIVSA-N 0 0 379.438 3.380 20 5 GGBDRN CC[C@H]1C[C@@H](c2nc(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])no2)CCO1 ZINC000278031746 1435352025 /nfs/dbraw/zinc/35/20/25/1435352025.db2.gz KLRRNIMJUNFOGU-AAEUAGOBSA-N 0 0 377.397 3.258 20 5 GGBDRN CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000278034114 1435352281 /nfs/dbraw/zinc/35/22/81/1435352281.db2.gz PZZVAGPPEXUEOF-ZDUSSCGKSA-N 0 0 381.429 3.080 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000278039521 1435352773 /nfs/dbraw/zinc/35/27/73/1435352773.db2.gz QJYFKCYVQHYCBB-CYBMUJFWSA-N 0 0 394.712 3.312 20 5 GGBDRN COc1cc(Cc2noc([C@@H]3CCC(=O)C[C@@H]3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000278040207 1435352869 /nfs/dbraw/zinc/35/28/69/1435352869.db2.gz LDOBXTUDHKSTFF-IINYFYTJSA-N 0 0 375.381 3.059 20 5 GGBDRN COc1cc(Cc2noc([C@H]3CCC(=O)C[C@H]3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000278040212 1435352959 /nfs/dbraw/zinc/35/29/59/1435352959.db2.gz LDOBXTUDHKSTFF-YGRLFVJLSA-N 0 0 375.381 3.059 20 5 GGBDRN CC(C)(C(=O)NCCOCC(F)(F)C(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000278041071 1435352996 /nfs/dbraw/zinc/35/29/96/1435352996.db2.gz VBBYMBBBSVFELD-UHFFFAOYSA-N 0 0 384.301 3.045 20 5 GGBDRN CCc1n[nH]c(C(=O)N(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000278055995 1435354455 /nfs/dbraw/zinc/35/44/55/1435354455.db2.gz XNKRGYVNHYZXFU-ZFWWWQNUSA-N 0 0 376.388 3.012 20 5 GGBDRN CCc1n[nH]c(C(=O)N(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000278055992 1435354464 /nfs/dbraw/zinc/35/44/64/1435354464.db2.gz XNKRGYVNHYZXFU-UKRRQHHQSA-N 0 0 376.388 3.012 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC(Oc3ccncc3C)CC2)c1 ZINC000278060022 1435355210 /nfs/dbraw/zinc/35/52/10/1435355210.db2.gz KCBJDYHZZKNWTP-UHFFFAOYSA-N 0 0 399.447 3.446 20 5 GGBDRN COc1cccc(Cc2nc(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])no2)c1 ZINC000278082973 1435357590 /nfs/dbraw/zinc/35/75/90/1435357590.db2.gz OAHMMCYYYZBWBJ-UHFFFAOYSA-N 0 0 385.376 3.185 20 5 GGBDRN Cc1cccnc1[C@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000278090788 1435358125 /nfs/dbraw/zinc/35/81/25/1435358125.db2.gz IEECGIUUKKQWMA-QGZVFWFLSA-N 0 0 382.424 3.371 20 5 GGBDRN CC[C@@H](C)[C@H](NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(F)(F)F ZINC000278102638 1435359455 /nfs/dbraw/zinc/35/94/55/1435359455.db2.gz KKWHHJORDIILPY-OQPBUACISA-N 0 0 395.765 3.071 20 5 GGBDRN CC[C@@H](NC(=O)C[C@H](CNC(=O)OC(C)(C)C)OC)c1cccc([N+](=O)[O-])c1 ZINC000278117092 1435361348 /nfs/dbraw/zinc/36/13/48/1435361348.db2.gz AKBGAAZUMYQFKP-HZPDHXFCSA-N 0 0 395.456 3.092 20 5 GGBDRN O=C(NCc1ccc2c(n1)CCCC2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000278139376 1435363476 /nfs/dbraw/zinc/36/34/76/1435363476.db2.gz NGXIASUQVADZTK-UHFFFAOYSA-N 0 0 394.475 3.401 20 5 GGBDRN COc1ccc(NC(=O)N2CCC(CO)(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000278163028 1435365356 /nfs/dbraw/zinc/36/53/56/1435365356.db2.gz YFWSQVRTGPCSRN-UHFFFAOYSA-N 0 0 399.447 3.453 20 5 GGBDRN COc1cc(Cc2noc(-c3cnn(CC(C)C)c3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000278167675 1435365779 /nfs/dbraw/zinc/36/57/79/1435365779.db2.gz UOHVJDVSQJRESP-UHFFFAOYSA-N 0 0 387.396 3.105 20 5 GGBDRN CC(=O)c1ccc(OCCCC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000278176544 1435366632 /nfs/dbraw/zinc/36/66/32/1435366632.db2.gz QMNRSNGGZBHRJN-UHFFFAOYSA-N 0 0 396.403 3.149 20 5 GGBDRN CSc1ccc(-c2nc([C@H]3CN4CCCC[C@H]4CO3)no2)cc1[N+](=O)[O-] ZINC000278188088 1435367822 /nfs/dbraw/zinc/36/78/22/1435367822.db2.gz VRIYPHBJHUGJLI-GXTWGEPZSA-N 0 0 376.438 3.293 20 5 GGBDRN C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC000278189706 1435367880 /nfs/dbraw/zinc/36/78/80/1435367880.db2.gz HUSYLEPPJOPTGY-WFASDCNBSA-N 0 0 394.428 3.238 20 5 GGBDRN O=C(Nc1ccc(O)cc1)C1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000278208596 1435369727 /nfs/dbraw/zinc/36/97/27/1435369727.db2.gz 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/nfs/dbraw/zinc/38/40/36/1435384036.db2.gz BPGPYMYSWLZJMF-UHFFFAOYSA-N 0 0 389.462 3.384 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@H](C)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278366562 1435384319 /nfs/dbraw/zinc/38/43/19/1435384319.db2.gz JYGBYPSEQIOEKZ-JTQLQIEISA-N 0 0 398.385 3.459 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)c1ccc(C)cc1 ZINC000278367696 1435384496 /nfs/dbraw/zinc/38/44/96/1435384496.db2.gz QXLSAACLFCUVSI-KRWDZBQOSA-N 0 0 390.461 3.105 20 5 GGBDRN CN(Cc1ncnn1CC(F)F)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000278374146 1435385086 /nfs/dbraw/zinc/38/50/86/1435385086.db2.gz AEZBWRURHZPSCL-UHFFFAOYSA-N 0 0 381.383 3.021 20 5 GGBDRN CCCc1c(NC(=O)CCn2cc([N+](=O)[O-])cn2)cnn1-c1ccc(C)cc1 ZINC000278379884 1435385807 /nfs/dbraw/zinc/38/58/07/1435385807.db2.gz CJEOUOHLGJRNKB-UHFFFAOYSA-N 0 0 382.424 3.267 20 5 GGBDRN O=C(c1cccc(F)c1)N1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278392770 1435386823 /nfs/dbraw/zinc/38/68/23/1435386823.db2.gz MJNWEDFGYMRLFA-UHFFFAOYSA-N 0 0 398.316 3.110 20 5 GGBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N1CCC[C@@H](C2OCCO2)C1 ZINC000278393364 1435386970 /nfs/dbraw/zinc/38/69/70/1435386970.db2.gz GBFDZESADKFLFM-SECBINFHSA-N 0 0 397.300 3.233 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC(Oc2ncccc2F)CC1 ZINC000278397467 1435387333 /nfs/dbraw/zinc/38/73/33/1435387333.db2.gz QIQQVVBHVASBBV-UHFFFAOYSA-N 0 0 393.802 3.395 20 5 GGBDRN COC(=O)[C@H]1CCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C[C@H]1C ZINC000278408460 1435388212 /nfs/dbraw/zinc/38/82/12/1435388212.db2.gz HJKBWLCSAHCNMH-BDAKNGLRSA-N 0 0 397.300 3.279 20 5 GGBDRN COC(=O)[C@H]1CCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C[C@@H]1C ZINC000278408465 1435388300 /nfs/dbraw/zinc/38/83/00/1435388300.db2.gz HJKBWLCSAHCNMH-IUCAKERBSA-N 0 0 397.300 3.279 20 5 GGBDRN Cc1cccc(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000278411785 1435388660 /nfs/dbraw/zinc/38/86/60/1435388660.db2.gz RXVZSIPASWRMHA-KBPBESRZSA-N 0 0 377.441 3.421 20 5 GGBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)c1 ZINC000278418123 1435389332 /nfs/dbraw/zinc/38/93/32/1435389332.db2.gz REFXIBSCYUGZQC-NOZJJQNGSA-N 0 0 384.301 3.331 20 5 GGBDRN C[C@@H]1C[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])CCN1C(=O)OC(C)(C)C ZINC000278417168 1435389364 /nfs/dbraw/zinc/38/93/64/1435389364.db2.gz SMLOZKLMVCQSIW-DGCLKSJQSA-N 0 0 381.404 3.252 20 5 GGBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)c1 ZINC000278419250 1435389547 /nfs/dbraw/zinc/38/95/47/1435389547.db2.gz REFXIBSCYUGZQC-ZANVPECISA-N 0 0 384.301 3.331 20 5 GGBDRN O=C1C[C@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000278423493 1435389763 /nfs/dbraw/zinc/38/97/63/1435389763.db2.gz OWFUQMBMFWHRBO-CYBMUJFWSA-N 0 0 394.353 3.469 20 5 GGBDRN C[C@@H]1CN(c2ccc(CNc3cc(C(F)(F)F)ncc3[N+](=O)[O-])cn2)CCO1 ZINC000278429812 1435390379 /nfs/dbraw/zinc/39/03/79/1435390379.db2.gz PLAGXNJCGXOJNK-LLVKDONJSA-N 0 0 397.357 3.241 20 5 GGBDRN 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KKCRUDBPYFVPMQ-GFCCVEGCSA-N 0 0 387.392 3.219 20 5 GGBDRN CC(C)(C)[C@H]1CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000279298874 1435483626 /nfs/dbraw/zinc/48/36/26/1435483626.db2.gz LKWYGSZUXBGSAX-GOSISDBHSA-N 0 0 375.469 3.085 20 5 GGBDRN O=C(O[C@H]([C@@H]1CCCOC1)C(F)(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000279307395 1435484277 /nfs/dbraw/zinc/48/42/77/1435484277.db2.gz YOAFCTTWDULWEO-IAQYHMDHSA-N 0 0 399.325 3.295 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)sc1C ZINC000279309958 1435485024 /nfs/dbraw/zinc/48/50/24/1435485024.db2.gz AEWASJIYWUZKEX-AWEZNQCLSA-N 0 0 389.433 3.053 20 5 GGBDRN Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cccc1NC(=O)N(C)C ZINC000279313703 1435485508 /nfs/dbraw/zinc/48/55/08/1435485508.db2.gz ANRKQNTURYLAHZ-UHFFFAOYSA-N 0 0 385.424 3.315 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)NC2(c3nccs3)CCCC2)cc1[N+](=O)[O-] ZINC000279324513 1435486726 /nfs/dbraw/zinc/48/67/26/1435486726.db2.gz CBWCBOVFTJYUKE-UHFFFAOYSA-N 0 0 378.429 3.456 20 5 GGBDRN COc1ccc(NC(=O)C(=O)Nc2ccc(C)c(OC(C)C)c2)cc1[N+](=O)[O-] ZINC000279329313 1435487032 /nfs/dbraw/zinc/48/70/32/1435487032.db2.gz QBCICNURMDPEKB-UHFFFAOYSA-N 0 0 387.392 3.276 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(N2CCCC2=O)c1 ZINC000279364984 1435491452 /nfs/dbraw/zinc/49/14/52/1435491452.db2.gz RIFOFSWEULMVEU-UHFFFAOYSA-N 0 0 383.404 3.050 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NC[C@@H](CCO)c1ccccc1 ZINC000279384989 1435493541 /nfs/dbraw/zinc/49/35/41/1435493541.db2.gz VGWUGEFEWAMFKV-CYBMUJFWSA-N 0 0 380.803 3.212 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000279393166 1435494433 /nfs/dbraw/zinc/49/44/33/1435494433.db2.gz RHNBEYMZZSTZLK-JTQLQIEISA-N 0 0 398.341 3.493 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCc1nnc(C2CC2)n1C1CC1 ZINC000279399929 1435495243 /nfs/dbraw/zinc/49/52/43/1435495243.db2.gz INJDDWFLDITHRN-UHFFFAOYSA-N 0 0 391.815 3.451 20 5 GGBDRN COc1cc(C(=O)NCC2CCN(c3ccccc3)CC2)cc([N+](=O)[O-])c1OC ZINC000279461188 1435501887 /nfs/dbraw/zinc/50/18/87/1435501887.db2.gz PZQHQLRKDCETCO-UHFFFAOYSA-N 0 0 399.447 3.258 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(OC)c(OC)c(OC)c1 ZINC000279463052 1435502078 /nfs/dbraw/zinc/50/20/78/1435502078.db2.gz MEFXIOBEKVDLSX-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)NCCCc2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000279466823 1435502645 /nfs/dbraw/zinc/50/26/45/1435502645.db2.gz PLBRJMBWRCJIHR-UHFFFAOYSA-N 0 0 399.426 3.049 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCOCc2ccccc21 ZINC000279476975 1435503463 /nfs/dbraw/zinc/50/34/63/1435503463.db2.gz OBXSENYBCLSRJW-UHFFFAOYSA-N 0 0 381.432 3.375 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000279477804 1435503550 /nfs/dbraw/zinc/50/35/50/1435503550.db2.gz GRZDUKVFEXXTRQ-CQSZACIVSA-N 0 0 379.775 3.224 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)Nc2ccccc2O[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000279494006 1435505538 /nfs/dbraw/zinc/50/55/38/1435505538.db2.gz RWLYHRVQZNQMTN-LBPRGKRZSA-N 0 0 389.383 3.220 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000279495503 1435505542 /nfs/dbraw/zinc/50/55/42/1435505542.db2.gz RZZUNCCRMGUVOD-MEBBXXQBSA-N 0 0 379.413 3.106 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000279495504 1435505560 /nfs/dbraw/zinc/50/55/60/1435505560.db2.gz RZZUNCCRMGUVOD-ZUZCIYMTSA-N 0 0 379.413 3.106 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000279495502 1435505676 /nfs/dbraw/zinc/50/56/76/1435505676.db2.gz RZZUNCCRMGUVOD-BONVTDFDSA-N 0 0 379.413 3.106 20 5 GGBDRN CCC[C@@H](CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])C(=O)OCC ZINC000279497753 1435506185 /nfs/dbraw/zinc/50/61/85/1435506185.db2.gz NQJGHJXDKFUKSI-NSHDSACASA-N 0 0 384.454 3.035 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CCC(N2CCCCC2=O)CC1 ZINC000279547365 1435511973 /nfs/dbraw/zinc/51/19/73/1435511973.db2.gz SLIYRKCKKRPDSZ-UHFFFAOYSA-N 0 0 395.843 3.016 20 5 GGBDRN O=c1[nH]c(CN2CCN(c3cc(Cl)ccc3[N+](=O)[O-])CC2)nc2ccccc12 ZINC000279562429 1435513423 /nfs/dbraw/zinc/51/34/23/1435513423.db2.gz XTTXZXLEUDTRBS-UHFFFAOYSA-N 0 0 399.838 3.219 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)CCCCCO)cc1[N+](=O)[O-])c1ccccn1 ZINC000279564232 1435513567 /nfs/dbraw/zinc/51/35/67/1435513567.db2.gz QNLPDRNCRYFNIU-HNNXBMFYSA-N 0 0 386.452 3.398 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N(C)CCCCCO)cc1[N+](=O)[O-])c1ccccn1 ZINC000279564235 1435513601 /nfs/dbraw/zinc/51/36/01/1435513601.db2.gz QNLPDRNCRYFNIU-OAHLLOKOSA-N 0 0 386.452 3.398 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cnn1C ZINC000279586238 1435516194 /nfs/dbraw/zinc/51/61/94/1435516194.db2.gz VAECECYUSQLVFX-SECBINFHSA-N 0 0 385.346 3.216 20 5 GGBDRN C[C@H]1OCC[C@]12CN(C(=O)c1ccc3[nH]c4ccccc4c(=O)c3c1)CCO2 ZINC000279602453 1435517715 /nfs/dbraw/zinc/51/77/15/1435517715.db2.gz BEQWZNFMDDHMOS-PEBXRYMYSA-N 0 0 378.428 3.114 20 5 GGBDRN C[C@@H]1OCC[C@@]12CN(C(=O)c1ccc3[nH]c4ccccc4c(=O)c3c1)CCO2 ZINC000279602458 1435517869 /nfs/dbraw/zinc/51/78/69/1435517869.db2.gz BEQWZNFMDDHMOS-RCDICMHDSA-N 0 0 378.428 3.114 20 5 GGBDRN C[C@@H]1OCC[C@]12CN(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CCO2 ZINC000279609200 1435518728 /nfs/dbraw/zinc/51/87/28/1435518728.db2.gz XWCXAJPKGOGCLU-BONVTDFDSA-N 0 0 389.330 3.025 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000279617893 1435519618 /nfs/dbraw/zinc/51/96/18/1435519618.db2.gz CHBNIPCGBXVMDZ-CYBMUJFWSA-N 0 0 385.424 3.064 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)sc1C ZINC000279657978 1435525033 /nfs/dbraw/zinc/52/50/33/1435525033.db2.gz KIRJYCFQMSQWAC-CQSZACIVSA-N 0 0 389.433 3.053 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)c2cc(C)cc([N+](=O)[O-])c2)sc1C ZINC000279707896 1435533121 /nfs/dbraw/zinc/53/31/21/1435533121.db2.gz PPNQIPZXZIWEAX-AWEZNQCLSA-N 0 0 389.433 3.432 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(OC)c(OCCOC)c1 ZINC000279715279 1435533876 /nfs/dbraw/zinc/53/38/76/1435533876.db2.gz LQERZWVTYXIQGE-UHFFFAOYSA-N 0 0 390.392 3.280 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](c2ccc(C)cc2)c2ccccn2)c(C)c1[N+](=O)[O-] ZINC000279717876 1435534293 /nfs/dbraw/zinc/53/42/93/1435534293.db2.gz QQXLLJZXTQAFDO-FQEVSTJZSA-N 0 0 393.447 3.407 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2C)sc1C ZINC000279719355 1435534540 /nfs/dbraw/zinc/53/45/40/1435534540.db2.gz QTEATOCFQXZKTE-AWEZNQCLSA-N 0 0 389.433 3.432 20 5 GGBDRN Cc1c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cccc1NC(=O)N(C)C ZINC000279756363 1435539085 /nfs/dbraw/zinc/53/90/85/1435539085.db2.gz VEGRONDJWINNTP-UHFFFAOYSA-N 0 0 385.424 3.072 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000279763126 1435539888 /nfs/dbraw/zinc/53/98/88/1435539888.db2.gz RPQOJDOODDDFQV-UHFFFAOYSA-N 0 0 397.431 3.484 20 5 GGBDRN CCOC(=O)c1nc(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])oc1C ZINC000279765646 1435540179 /nfs/dbraw/zinc/54/01/79/1435540179.db2.gz UXDLLWAXWATBJW-UHFFFAOYSA-N 0 0 385.735 3.042 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@H](CO)CC2CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000279790270 1435543462 /nfs/dbraw/zinc/54/34/62/1435543462.db2.gz DGGXEFDYGLVCKC-PBHICJAKSA-N 0 0 398.463 3.444 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H](CO)CC2CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000279790274 1435543482 /nfs/dbraw/zinc/54/34/82/1435543482.db2.gz DGGXEFDYGLVCKC-RHSMWYFYSA-N 0 0 398.463 3.444 20 5 GGBDRN COC(CCCC(C)(C)CNC(=O)CCOc1ccccc1[N+](=O)[O-])OC ZINC000279794140 1435544051 /nfs/dbraw/zinc/54/40/51/1435544051.db2.gz SBJVECVVYKEMGS-UHFFFAOYSA-N 0 0 382.457 3.295 20 5 GGBDRN Cc1c(C(=O)O[C@@H]([C@H]2CCCOC2)C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000279804055 1435545314 /nfs/dbraw/zinc/54/53/14/1435545314.db2.gz YHDDZHVJUTUTAD-ZANVPECISA-N 0 0 392.286 3.326 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cc([C@@H]2CCCOC2)[nH]n1 ZINC000279828209 1435547929 /nfs/dbraw/zinc/54/79/29/1435547929.db2.gz DXAKHBIGFMBUBL-LLVKDONJSA-N 0 0 394.815 3.273 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)c3ccccc3C(C)=O)CC2)ccc1[N+](=O)[O-] ZINC000279836308 1435548873 /nfs/dbraw/zinc/54/88/73/1435548873.db2.gz RHUNLLZUGBRLMM-UHFFFAOYSA-N 0 0 397.431 3.159 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000279841966 1435549939 /nfs/dbraw/zinc/54/99/39/1435549939.db2.gz DNOCAUOBAYVBBW-SNVBAGLBSA-N 0 0 382.779 3.027 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000279846516 1435550872 /nfs/dbraw/zinc/55/08/72/1435550872.db2.gz DVHMAEPBHQFJHJ-NSHDSACASA-N 0 0 393.831 3.197 20 5 GGBDRN COC(=O)c1cc(CN(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])oc1C ZINC000279846679 1435550883 /nfs/dbraw/zinc/55/08/83/1435550883.db2.gz DBWTVNPBWHOREY-UHFFFAOYSA-N 0 0 398.774 3.276 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279846621 1435550990 /nfs/dbraw/zinc/55/09/90/1435550990.db2.gz DWMDMGQIYBXNIR-UHFFFAOYSA-N 0 0 382.823 3.105 20 5 GGBDRN COc1ccc([C@H](CCO)NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cc1 ZINC000279854643 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ZINC000280786829 1435720544 /nfs/dbraw/zinc/72/05/44/1435720544.db2.gz IXHGYDKEQADLJI-LIRRHRJNSA-N 0 0 392.477 3.176 20 5 GGBDRN COc1ccc(CN[C@@H](c2ccc(C)cc2)[C@@H](C)S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000280786814 1435720672 /nfs/dbraw/zinc/72/06/72/1435720672.db2.gz IXHGYDKEQADLJI-AUUYWEPGSA-N 0 0 392.477 3.176 20 5 GGBDRN CCC(=O)c1ccc(N(C)Cc2ccc(S(C)(=O)=O)cc2)c([N+](=O)[O-])c1 ZINC000280802171 1435723151 /nfs/dbraw/zinc/72/31/51/1435723151.db2.gz VYMGYRPZOOPTPZ-UHFFFAOYSA-N 0 0 376.434 3.227 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCCO[C@H]1CCCCO1 ZINC000280816336 1435725172 /nfs/dbraw/zinc/72/51/72/1435725172.db2.gz RSFKSYGFXOSPMC-QFIPXVFZSA-N 0 0 394.471 3.204 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCCO[C@@H]1CCCCO1 ZINC000280816334 1435725312 /nfs/dbraw/zinc/72/53/12/1435725312.db2.gz RSFKSYGFXOSPMC-JOCHJYFZSA-N 0 0 394.471 3.204 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000280841306 1435729210 /nfs/dbraw/zinc/72/92/10/1435729210.db2.gz BYDDSSUASMIVEN-AWEZNQCLSA-N 0 0 398.872 3.381 20 5 GGBDRN C[C@H](NC(=O)NCc1ccncc1OCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000280865653 1435732727 /nfs/dbraw/zinc/73/27/27/1435732727.db2.gz BBFOJVMRUFWERM-NSHDSACASA-N 0 0 398.341 3.491 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1CCCCC1CCOCC1 ZINC000280877827 1435734840 /nfs/dbraw/zinc/73/48/40/1435734840.db2.gz BZKPCOUTMBGPQF-UHFFFAOYSA-N 0 0 397.435 3.087 20 5 GGBDRN CC(=O)N1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC000280893625 1435737704 /nfs/dbraw/zinc/73/77/04/1435737704.db2.gz YIDOUYCFEHBUDQ-MRXNPFEDSA-N 0 0 397.431 3.375 20 5 GGBDRN CC(=O)N1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC000280893620 1435737770 /nfs/dbraw/zinc/73/77/70/1435737770.db2.gz YIDOUYCFEHBUDQ-INIZCTEOSA-N 0 0 397.431 3.375 20 5 GGBDRN Cc1c(NC(=O)N(C)C)cccc1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000280931105 1435743757 /nfs/dbraw/zinc/74/37/57/1435743757.db2.gz IFRUVYIQLMZRIC-CYBMUJFWSA-N 0 0 385.424 3.436 20 5 GGBDRN 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Cc1cc(OCC(=O)O[C@H]([C@@H]2CCCOC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000281101206 1435774914 /nfs/dbraw/zinc/77/49/14/1435774914.db2.gz MMBHZMGQTXSVOO-IAQYHMDHSA-N 0 0 377.315 3.183 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000281105161 1435775246 /nfs/dbraw/zinc/77/52/46/1435775246.db2.gz LKPSLHNBSLKNGE-UHFFFAOYSA-N 0 0 391.374 3.470 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)[C@@H](C)S(C)(=O)=O)cc1 ZINC000281123612 1435779254 /nfs/dbraw/zinc/77/92/54/1435779254.db2.gz XBJCGHNGYHDOOI-RDTXWAMCSA-N 0 0 390.461 3.116 20 5 GGBDRN Cc1ccc(NC(=O)CS[C@H](C)C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc1 ZINC000281162881 1435786679 /nfs/dbraw/zinc/78/66/79/1435786679.db2.gz LZKQGSGHZQCSRW-CYBMUJFWSA-N 0 0 388.449 3.021 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000281195736 1435793960 /nfs/dbraw/zinc/79/39/60/1435793960.db2.gz SKYQAKSYSBAYSQ-OAHLLOKOSA-N 0 0 397.431 3.119 20 5 GGBDRN CN(C(=O)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1)c1ccccc1 ZINC000281200296 1435795225 /nfs/dbraw/zinc/79/52/25/1435795225.db2.gz STUHPLRJTBKPPL-CYBMUJFWSA-N 0 0 387.823 3.373 20 5 GGBDRN COC(=O)[C@H]1CC[C@H](C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000281223899 1435798853 /nfs/dbraw/zinc/79/88/53/1435798853.db2.gz ZSFDHKKSIJRGFH-HAQNSBGRSA-N 0 0 388.342 3.209 20 5 GGBDRN Cc1noc(C[C@H](NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c2ccccc2)n1 ZINC000281237017 1435800176 /nfs/dbraw/zinc/80/01/76/1435800176.db2.gz UJVCSCXCSBJJQU-KRWDZBQOSA-N 0 0 396.403 3.074 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)cc1[N+](=O)[O-] ZINC000281247372 1435800700 /nfs/dbraw/zinc/80/07/00/1435800700.db2.gz DJPSXUBNPFRCGY-OPNLHGRLSA-N 0 0 391.424 3.213 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000281286982 1435802401 /nfs/dbraw/zinc/80/24/01/1435802401.db2.gz CFCIJDZLIVYAOR-JWZBEHFJSA-N 0 0 377.441 3.397 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC1CCN(C(=O)CC(C)C)CC1 ZINC000281291044 1435802639 /nfs/dbraw/zinc/80/26/39/1435802639.db2.gz CMCKEKWBKPNMOX-UHFFFAOYSA-N 0 0 392.456 3.152 20 5 GGBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 ZINC000281319457 1435803701 /nfs/dbraw/zinc/80/37/01/1435803701.db2.gz ITXBTWNNBSFBIT-GFCCVEGCSA-N 0 0 387.392 3.081 20 5 GGBDRN CC1([C@@H]2CCCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])C2)OCCO1 ZINC000281322298 1435803742 /nfs/dbraw/zinc/80/37/42/1435803742.db2.gz SVQMDGMZVQWVLH-MRXNPFEDSA-N 0 0 397.431 3.272 20 5 GGBDRN CC1([C@H]2CCCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])C2)OCCO1 ZINC000281322284 1435803823 /nfs/dbraw/zinc/80/38/23/1435803823.db2.gz SVQMDGMZVQWVLH-INIZCTEOSA-N 0 0 397.431 3.272 20 5 GGBDRN CNC(=O)COc1ccc(NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c(C)c1 ZINC000281325308 1435803935 /nfs/dbraw/zinc/80/39/35/1435803935.db2.gz JGXYFGJLEKFFMW-UHFFFAOYSA-N 0 0 386.408 3.289 20 5 GGBDRN COC[C@H](C)Nc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000281328582 1435803998 /nfs/dbraw/zinc/80/39/98/1435803998.db2.gz JFXHHWFRWMCJGP-LBPRGKRZSA-N 0 0 377.372 3.198 20 5 GGBDRN Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000281336890 1435804347 /nfs/dbraw/zinc/80/43/47/1435804347.db2.gz LBNSQSIJFALYPY-GOSISDBHSA-N 0 0 383.404 3.073 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1S(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC000281375875 1435806216 /nfs/dbraw/zinc/80/62/16/1435806216.db2.gz GJPPFRHQHNJPIP-CQSZACIVSA-N 0 0 396.444 3.175 20 5 GGBDRN CCC(=O)c1ccc(N[C@H]2CCCN(Cc3ccccn3)C2=O)c([N+](=O)[O-])c1 ZINC000281412837 1435807957 /nfs/dbraw/zinc/80/79/57/1435807957.db2.gz IAPMQNAZBWQKAM-KRWDZBQOSA-N 0 0 382.420 3.186 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1 ZINC000281430369 1435808557 /nfs/dbraw/zinc/80/85/57/1435808557.db2.gz QQSAXLXJBRGYBF-CYBMUJFWSA-N 0 0 377.441 3.217 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccncc1OCC(F)(F)F ZINC000281438017 1435809012 /nfs/dbraw/zinc/80/90/12/1435809012.db2.gz YWNKYDTZTLIXPV-UHFFFAOYSA-N 0 0 399.325 3.260 20 5 GGBDRN CC(C)(C)Nc1ccccc1NC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O ZINC000281454399 1435809590 /nfs/dbraw/zinc/80/95/90/1435809590.db2.gz SGVXCMQBOCXLFQ-UHFFFAOYSA-N 0 0 396.403 3.040 20 5 GGBDRN COc1ccc(CNc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc1[N+](=O)[O-] ZINC000281463075 1435809848 /nfs/dbraw/zinc/80/98/48/1435809848.db2.gz UHHINADHIQIOAD-IBGZPJMESA-N 0 0 385.420 3.133 20 5 GGBDRN COc1ccc(CNc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)cc1[N+](=O)[O-] ZINC000281463079 1435809910 /nfs/dbraw/zinc/80/99/10/1435809910.db2.gz UHHINADHIQIOAD-LJQANCHMSA-N 0 0 385.420 3.133 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000281465396 1435809980 /nfs/dbraw/zinc/80/99/80/1435809980.db2.gz GUSCQQHVDGEUBP-CQSZACIVSA-N 0 0 387.396 3.395 20 5 GGBDRN O=c1oc2cc([N+](=O)[O-])ccc2n1CCCc1nc([C@H]2CCC(F)(F)C2)no1 ZINC000281464248 1435810010 /nfs/dbraw/zinc/81/00/10/1435810010.db2.gz RJNAADGCLLJRBK-JTQLQIEISA-N 0 0 394.334 3.421 20 5 GGBDRN CC[C@H]1CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCO1 ZINC000281463399 1435810039 /nfs/dbraw/zinc/81/00/39/1435810039.db2.gz IQDHVNPXBHKKDR-AWEZNQCLSA-N 0 0 375.347 3.324 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc([N+](=O)[O-])c1 ZINC000281482812 1435810760 /nfs/dbraw/zinc/81/07/60/1435810760.db2.gz UTEIVYKCTRTGQO-SFHVURJKSA-N 0 0 383.404 3.073 20 5 GGBDRN CCOC(=O)[C@]1(COC)CCCN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000281512469 1435811815 /nfs/dbraw/zinc/81/18/15/1435811815.db2.gz XKTLSCOOKNMKKC-LJQANCHMSA-N 0 0 393.440 3.035 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(S(C)(=O)=O)ccc1CC ZINC000281518655 1435811966 /nfs/dbraw/zinc/81/19/66/1435811966.db2.gz WXUCYIBCINWXLR-UHFFFAOYSA-N 0 0 392.433 3.212 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 ZINC000281529103 1435812403 /nfs/dbraw/zinc/81/24/03/1435812403.db2.gz XMAQTPJVEGWSRQ-INIZCTEOSA-N 0 0 397.431 3.484 20 5 GGBDRN COC[C@@H](C)Nc1ccccc1NC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000281537941 1435812732 /nfs/dbraw/zinc/81/27/32/1435812732.db2.gz SEAYXKBJPGMJDH-YJYMSZOUSA-N 0 0 398.419 3.173 20 5 GGBDRN COC[C@@H](C)Nc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000281582183 1435814503 /nfs/dbraw/zinc/81/45/03/1435814503.db2.gz UZMHSXSDHUVYJX-CYBMUJFWSA-N 0 0 389.408 3.068 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)c1 ZINC000281614041 1435815690 /nfs/dbraw/zinc/81/56/90/1435815690.db2.gz PIWKMZPYLZPVSW-SFHVURJKSA-N 0 0 399.447 3.275 20 5 GGBDRN COc1cc(C(=O)N(C)CCCOCc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000281613744 1435815704 /nfs/dbraw/zinc/81/57/04/1435815704.db2.gz XDMITGWJUDVCMQ-UHFFFAOYSA-N 0 0 388.420 3.291 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccccc2O[C@H]2CCOC2)c1 ZINC000281633861 1435816434 /nfs/dbraw/zinc/81/64/34/1435816434.db2.gz QQUCCXNAZREINW-HNNXBMFYSA-N 0 0 386.404 3.479 20 5 GGBDRN CC(C)(C)Nc1ccccc1NC(=O)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000281633589 1435816451 /nfs/dbraw/zinc/81/64/51/1435816451.db2.gz GKAASCORWXCDTR-UHFFFAOYSA-N 0 0 384.436 3.103 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)c1 ZINC000281668360 1435817714 /nfs/dbraw/zinc/81/77/14/1435817714.db2.gz SZQXVHMSFDZNSI-AEFFLSMTSA-N 0 0 386.448 3.343 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H](C)c1ccccc1F ZINC000281708939 1435819121 /nfs/dbraw/zinc/81/91/21/1435819121.db2.gz QPPWBUCJUHEMED-LBPRGKRZSA-N 0 0 389.383 3.291 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)c1ccccc1F ZINC000281708921 1435819146 /nfs/dbraw/zinc/81/91/46/1435819146.db2.gz QPPWBUCJUHEMED-GFCCVEGCSA-N 0 0 389.383 3.291 20 5 GGBDRN C[C@H](NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)C(=O)N1CCCC1 ZINC000281721863 1435819530 /nfs/dbraw/zinc/81/95/30/1435819530.db2.gz NNXQMSBDQNVOFK-NSHDSACASA-N 0 0 399.397 3.113 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)SCCC(=O)OC(C)(C)C ZINC000281720152 1435819531 /nfs/dbraw/zinc/81/95/31/1435819531.db2.gz VJJBKFJFFXMXGC-NSHDSACASA-N 0 0 384.454 3.395 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCc1ccc(Cl)s1 ZINC000281726642 1435819621 /nfs/dbraw/zinc/81/96/21/1435819621.db2.gz SKWBCJVDLDYUFK-UHFFFAOYSA-N 0 0 397.840 3.006 20 5 GGBDRN O=C(Oc1ccc2oc(=O)oc2c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000281732663 1435819877 /nfs/dbraw/zinc/81/98/77/1435819877.db2.gz ICJSXCWJIVMBCH-UHFFFAOYSA-N 0 0 384.344 3.116 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000281740913 1435820312 /nfs/dbraw/zinc/82/03/12/1435820312.db2.gz IMUUFNPCGYEZCC-MRXNPFEDSA-N 0 0 391.468 3.291 20 5 GGBDRN CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(N3CCCO[C@@H](CC)C3)n2)CCCO1 ZINC000281744454 1435820331 /nfs/dbraw/zinc/82/03/31/1435820331.db2.gz DQENVTWEPVUZCY-CVEARBPZSA-N 0 0 378.473 3.000 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000281745621 1435820383 /nfs/dbraw/zinc/82/03/83/1435820383.db2.gz RUUGYOWZSHJESI-OAHLLOKOSA-N 0 0 378.454 3.036 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000281751339 1435820675 /nfs/dbraw/zinc/82/06/75/1435820675.db2.gz SBFGUHBMQNQCTH-HNNXBMFYSA-N 0 0 378.454 3.036 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN[C@@]3(CO)CCOc4ccccc43)co2)cc1 ZINC000281756905 1435820922 /nfs/dbraw/zinc/82/09/22/1435820922.db2.gz RJFAVJDIPBFSIJ-HXUWFJFHSA-N 0 0 381.388 3.010 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000281772586 1435821468 /nfs/dbraw/zinc/82/14/68/1435821468.db2.gz TXKRGPWSDPCECT-AWEZNQCLSA-N 0 0 398.872 3.381 20 5 GGBDRN Cc1cc(OCC(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000281789335 1435822082 /nfs/dbraw/zinc/82/20/82/1435822082.db2.gz USHBKSBXPBMWMB-CQSZACIVSA-N 0 0 396.403 3.133 20 5 GGBDRN Cc1csc(NC(=O)CS[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000281794911 1435822240 /nfs/dbraw/zinc/82/22/40/1435822240.db2.gz FCUKCBXTMGJISI-LLVKDONJSA-N 0 0 394.478 3.367 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NC2CCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000281813075 1435822854 /nfs/dbraw/zinc/82/28/54/1435822854.db2.gz INMCOXOCHXUFJY-CYBMUJFWSA-N 0 0 389.481 3.389 20 5 GGBDRN O=C1OCCN1c1cc([N+](=O)[O-])ccc1NC1CCN(c2nccs2)CC1 ZINC000281854925 1435824353 /nfs/dbraw/zinc/82/43/53/1435824353.db2.gz MKFVPIBTRZUAIS-UHFFFAOYSA-N 0 0 389.437 3.089 20 5 GGBDRN COc1ccc(C(=O)N2CCC(N3CCc4ccccc43)CC2)cc1[N+](=O)[O-] ZINC000281856903 1435824466 /nfs/dbraw/zinc/82/44/66/1435824466.db2.gz BRMNCOGUZSJBHG-UHFFFAOYSA-N 0 0 381.432 3.271 20 5 GGBDRN Cc1c(C(=O)N[C@H]2CCCC23CCOCC3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000281866795 1435824762 /nfs/dbraw/zinc/82/47/62/1435824762.db2.gz CGIXSSRYHPBOHB-HNNXBMFYSA-N 0 0 377.397 3.199 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000281880617 1435825301 /nfs/dbraw/zinc/82/53/01/1435825301.db2.gz GDIKDKYGMBRKNZ-UHFFFAOYSA-N 0 0 389.330 3.369 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)c[nH]2)c1[N+](=O)[O-] ZINC000281882075 1435825473 /nfs/dbraw/zinc/82/54/73/1435825473.db2.gz OVKDKRIUPJKODH-OAHLLOKOSA-N 0 0 380.408 3.384 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc([C@H]2CCCOC2)[nH]n1 ZINC000281890820 1435825695 /nfs/dbraw/zinc/82/56/95/1435825695.db2.gz HFKFWMNNXXKNLZ-NSHDSACASA-N 0 0 375.385 3.255 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)c([N+](=O)[O-])cc1OC ZINC000281892823 1435825715 /nfs/dbraw/zinc/82/57/15/1435825715.db2.gz FTLQCBHCSFFBDS-LBEHMCEESA-N 0 0 392.452 3.014 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)c([N+](=O)[O-])cc1OC ZINC000281892802 1435825722 /nfs/dbraw/zinc/82/57/22/1435825722.db2.gz FTLQCBHCSFFBDS-CXUGXGMPSA-N 0 0 392.452 3.014 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](CO)c1ccc(OC)cc1 ZINC000281912409 1435826561 /nfs/dbraw/zinc/82/65/61/1435826561.db2.gz JBWVRWRLRCEONJ-QGZVFWFLSA-N 0 0 389.408 3.199 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000281916180 1435826716 /nfs/dbraw/zinc/82/67/16/1435826716.db2.gz GUCMGDMQCSLZIQ-YXUXOOTASA-N 0 0 399.447 3.250 20 5 GGBDRN C[C@H](NC(=O)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000281916754 1435826747 /nfs/dbraw/zinc/82/67/47/1435826747.db2.gz GSKOYKUGTDEMGM-DOTOQJQBSA-N 0 0 396.447 3.350 20 5 GGBDRN C[C@@H](NC(=O)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000281916756 1435826852 /nfs/dbraw/zinc/82/68/52/1435826852.db2.gz GSKOYKUGTDEMGM-NVXWUHKLSA-N 0 0 396.447 3.350 20 5 GGBDRN O=C(NCC1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1)C(F)(F)F ZINC000281930672 1435827289 /nfs/dbraw/zinc/82/72/89/1435827289.db2.gz QZMVVMNSVJPYQG-UHFFFAOYSA-N 0 0 382.342 3.038 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000281994435 1435830153 /nfs/dbraw/zinc/83/01/53/1435830153.db2.gz ZYYBNLUAWBYUPT-CYBMUJFWSA-N 0 0 386.437 3.183 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000281994442 1435830154 /nfs/dbraw/zinc/83/01/54/1435830154.db2.gz ZYYBNLUAWBYUPT-ZDUSSCGKSA-N 0 0 386.437 3.183 20 5 GGBDRN O=C(N[C@@H]1CCCC12CCOCC2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000281996287 1435830234 /nfs/dbraw/zinc/83/02/34/1435830234.db2.gz LRUKTSRRHBXSGJ-LJQANCHMSA-N 0 0 387.480 3.277 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000282014431 1435830983 /nfs/dbraw/zinc/83/09/83/1435830983.db2.gz SWQPVPAXTPOJLA-GFCCVEGCSA-N 0 0 383.470 3.423 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000282019835 1435831163 /nfs/dbraw/zinc/83/11/63/1435831163.db2.gz UEBNXKUOVZKRHE-CQSZACIVSA-N 0 0 377.441 3.362 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC1CCN(c2nccs2)CC1 ZINC000282038047 1435832047 /nfs/dbraw/zinc/83/20/47/1435832047.db2.gz UGVFJZAGHDRDQW-UHFFFAOYSA-N 0 0 375.454 3.459 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[C@H]([S@](=O)CC)C1 ZINC000282057410 1435832847 /nfs/dbraw/zinc/83/28/47/1435832847.db2.gz VTAKXPZZXNGLKH-BSJMDQAVSA-N 0 0 383.470 3.195 20 5 GGBDRN CN(C(=O)[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1)c1ccccc1 ZINC000282061549 1435833052 /nfs/dbraw/zinc/83/30/52/1435833052.db2.gz URQYWHTXGGXFPI-ZDUSSCGKSA-N 0 0 386.383 3.251 20 5 GGBDRN Cc1cc(OCC(=O)Nc2cccc(C(=O)N3CCCC3)c2C)ccc1[N+](=O)[O-] ZINC000282061435 1435833092 /nfs/dbraw/zinc/83/30/92/1435833092.db2.gz UQIKWCJGOWOEGM-UHFFFAOYSA-N 0 0 397.431 3.465 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000282069615 1435833279 /nfs/dbraw/zinc/83/32/79/1435833279.db2.gz VIIPTYPEIFSWNY-OAHLLOKOSA-N 0 0 384.436 3.179 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000282068782 1435833304 /nfs/dbraw/zinc/83/33/04/1435833304.db2.gz YEEKVNRJKUDXGN-OAHLLOKOSA-N 0 0 391.468 3.291 20 5 GGBDRN Cc1cc(OCC(=O)Nc2cccc(CN3CCCCC3=O)c2)ccc1[N+](=O)[O-] ZINC000282095707 1435834395 /nfs/dbraw/zinc/83/43/95/1435834395.db2.gz XNCPFGDHTNHTDU-UHFFFAOYSA-N 0 0 397.431 3.433 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@]2(Cc3ccc(Cl)cc3)CCOC2)c1[N+](=O)[O-] ZINC000282150534 1435836533 /nfs/dbraw/zinc/83/65/33/1435836533.db2.gz LUBJHQMCPIRECY-GOSISDBHSA-N 0 0 392.843 3.226 20 5 GGBDRN O=C(c1ccccc1)N1CC[C@@H](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000282277232 1435841312 /nfs/dbraw/zinc/84/13/12/1435841312.db2.gz UPEIXCPWAKAWAJ-OAHLLOKOSA-N 0 0 377.404 3.016 20 5 GGBDRN CSc1ccc(C(=O)N(CCNC(C)=O)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000282285496 1435841668 /nfs/dbraw/zinc/84/16/68/1435841668.db2.gz BORCLKNECRLCOH-UHFFFAOYSA-N 0 0 393.490 3.157 20 5 GGBDRN COCCOc1cc(OC)ccc1C(=O)Nc1cc([N+](=O)[O-])c(C)cc1F ZINC000282295519 1435842131 /nfs/dbraw/zinc/84/21/31/1435842131.db2.gz CIOBFWROWIECGE-UHFFFAOYSA-N 0 0 378.356 3.328 20 5 GGBDRN CCOC(=O)COc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000282297992 1435842213 /nfs/dbraw/zinc/84/22/13/1435842213.db2.gz SBVLJPDXGOVCAF-UHFFFAOYSA-N 0 0 387.392 3.201 20 5 GGBDRN COc1cc(CC(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)cc(OC)c1OC ZINC000282305050 1435842414 /nfs/dbraw/zinc/84/24/14/1435842414.db2.gz MKWSVQUUGGKJKD-UHFFFAOYSA-N 0 0 378.356 3.249 20 5 GGBDRN Cc1cc(F)c(NC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000282309975 1435842551 /nfs/dbraw/zinc/84/25/51/1435842551.db2.gz DIYNUORGNORMGR-AWEZNQCLSA-N 0 0 394.424 3.199 20 5 GGBDRN O=C(Nc1ccccc1)N1CC[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000282333897 1435843433 /nfs/dbraw/zinc/84/34/33/1435843433.db2.gz VLWVNIICWMCHOR-HNNXBMFYSA-N 0 0 395.419 3.198 20 5 GGBDRN C[C@@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000282352538 1435844198 /nfs/dbraw/zinc/84/41/98/1435844198.db2.gz AQWWCOXSHFKDLG-CQSZACIVSA-N 0 0 391.468 3.099 20 5 GGBDRN COCCOC(=O)c1c(C)[nH]c(C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)c1C ZINC000282362189 1435844380 /nfs/dbraw/zinc/84/43/80/1435844380.db2.gz PXYMFZBFZPZMHL-UHFFFAOYSA-N 0 0 393.371 3.043 20 5 GGBDRN CC(C)(C)OC(=O)NCc1nc(COc2c(Cl)cccc2[N+](=O)[O-])no1 ZINC000282375992 1435845015 /nfs/dbraw/zinc/84/50/15/1435845015.db2.gz BLPRVRFCZCHVKY-UHFFFAOYSA-N 0 0 384.776 3.235 20 5 GGBDRN COc1ccc(OC)c(NC(=O)[C@@H](C)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282383959 1435845319 /nfs/dbraw/zinc/84/53/19/1435845319.db2.gz GEYKLOPTXXLCRD-CQSZACIVSA-N 0 0 387.436 3.114 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)c1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1 ZINC000282393185 1435845646 /nfs/dbraw/zinc/84/56/46/1435845646.db2.gz RQYKGFSSOOSCNB-TXEJJXNPSA-N 0 0 388.399 3.303 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000282403382 1435846009 /nfs/dbraw/zinc/84/60/09/1435846009.db2.gz FOLSRMZNUKQMAN-UHFFFAOYSA-N 0 0 376.438 3.135 20 5 GGBDRN CCn1c(CCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)nc2ccccc21 ZINC000282412346 1435846291 /nfs/dbraw/zinc/84/62/91/1435846291.db2.gz LDARUQDMSCJLDA-UHFFFAOYSA-N 0 0 395.463 3.391 20 5 GGBDRN C[C@H]1Oc2ccc(NC(=O)N(C)CCc3cccc([N+](=O)[O-])c3)cc2NC1=O ZINC000282459154 1435847970 /nfs/dbraw/zinc/84/79/70/1435847970.db2.gz KAFPDLZUMBCXFB-GFCCVEGCSA-N 0 0 384.392 3.021 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1 ZINC000282473964 1435848619 /nfs/dbraw/zinc/84/86/19/1435848619.db2.gz LLMIRQMJHUCRRX-OAHLLOKOSA-N 0 0 383.408 3.331 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)N(Cc1cccs1)C(C)C ZINC000282488213 1435849065 /nfs/dbraw/zinc/84/90/65/1435849065.db2.gz MJJIZXXELFPCPD-UHFFFAOYSA-N 0 0 379.413 3.480 20 5 GGBDRN CCOc1cc(N2CCN([C@H](C)c3nnc(C)s3)CC2)ccc1[N+](=O)[O-] ZINC000282505854 1435849517 /nfs/dbraw/zinc/84/95/17/1435849517.db2.gz NYXHCQRASWDPCK-GFCCVEGCSA-N 0 0 377.470 3.037 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)s1 ZINC000282506213 1435849537 /nfs/dbraw/zinc/84/95/37/1435849537.db2.gz NOKCDKVFAWVIFH-VIFPVBQESA-N 0 0 379.413 3.098 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C[C@H]1CCCN(C(=O)NCC(C)C)C1 ZINC000282512238 1435849800 /nfs/dbraw/zinc/84/98/00/1435849800.db2.gz ZTHPGGUYWBAQKM-CQSZACIVSA-N 0 0 394.447 3.449 20 5 GGBDRN CCOC(=O)c1cnc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000282576459 1435852297 /nfs/dbraw/zinc/85/22/97/1435852297.db2.gz VRNDPLJNUACPOH-UHFFFAOYSA-N 0 0 391.811 3.135 20 5 GGBDRN Cc1ccc([C@H](NCc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000282578464 1435852343 /nfs/dbraw/zinc/85/23/43/1435852343.db2.gz VVCWYPBVWNFRNE-FZKQIMNGSA-N 0 0 380.441 3.306 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 ZINC000282603256 1435853305 /nfs/dbraw/zinc/85/33/05/1435853305.db2.gz YFTVEFPZEJFBFA-MOPGFXCFSA-N 0 0 387.480 3.025 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 ZINC000282603258 1435853316 /nfs/dbraw/zinc/85/33/16/1435853316.db2.gz YFTVEFPZEJFBFA-RBUKOAKNSA-N 0 0 387.480 3.025 20 5 GGBDRN CCOC(=O)[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(OC)c(F)c1 ZINC000282614278 1435853692 /nfs/dbraw/zinc/85/36/92/1435853692.db2.gz ZFKHHKVLBMQFTE-QGZVFWFLSA-N 0 0 380.347 3.276 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)N[C@H]1CCCOc2ccccc21 ZINC000282625538 1435854138 /nfs/dbraw/zinc/85/41/38/1435854138.db2.gz WGDNLDDAVFLJNB-AWEZNQCLSA-N 0 0 387.367 3.011 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2N2CC[NH+](CC)CC2)c1 ZINC000282629967 1435854334 /nfs/dbraw/zinc/85/43/34/1435854334.db2.gz JSZHQJRURNVWBW-UHFFFAOYSA-N 0 0 398.463 3.388 20 5 GGBDRN COc1cc(OC)c(OC)cc1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282651719 1435855198 /nfs/dbraw/zinc/85/51/98/1435855198.db2.gz MPFWZJCGAODZOX-UHFFFAOYSA-N 0 0 389.408 3.327 20 5 GGBDRN CCS[C@H]1CCC[C@@H](NC(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)C1 ZINC000282660095 1435855538 /nfs/dbraw/zinc/85/55/38/1435855538.db2.gz YJBDDBRDPBXIOG-NEPJUHHUSA-N 0 0 383.445 3.161 20 5 GGBDRN CCOc1cc(NC(=O)N2CC[C@@H](OC)C[C@H]2C)c([N+](=O)[O-])cc1OCC ZINC000282690774 1435856596 /nfs/dbraw/zinc/85/65/96/1435856596.db2.gz LTEVCECPGRPWPK-CHWSQXEVSA-N 0 0 381.429 3.423 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2ccccc2N2CCOCC2)c1 ZINC000282695672 1435856789 /nfs/dbraw/zinc/85/67/89/1435856789.db2.gz SCOAIUJWUVTTDP-UHFFFAOYSA-N 0 0 399.447 3.102 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CN3CCCC3=O)cc2)c1 ZINC000282700819 1435857060 /nfs/dbraw/zinc/85/70/60/1435857060.db2.gz SVNQTCAUJSMBKD-UHFFFAOYSA-N 0 0 383.404 3.368 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1 ZINC000282719085 1435857729 /nfs/dbraw/zinc/85/77/29/1435857729.db2.gz VVVRGGKGEKTDTL-GOSISDBHSA-N 0 0 399.403 3.363 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(C(=O)N(CC)CC)cc2)c1 ZINC000282728770 1435858041 /nfs/dbraw/zinc/85/80/41/1435858041.db2.gz XCTFFTXOHFEPPD-UHFFFAOYSA-N 0 0 399.447 3.406 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2cccc(N3CCOC3=O)c2)c1 ZINC000282756829 1435859171 /nfs/dbraw/zinc/85/91/71/1435859171.db2.gz CBCGIJQEISKROD-ZDUSSCGKSA-N 0 0 399.403 3.441 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F)c1ccc(OC)cc1 ZINC000282768552 1435859649 /nfs/dbraw/zinc/85/96/49/1435859649.db2.gz LEDRJWAIHQCXHD-OAHLLOKOSA-N 0 0 389.383 3.257 20 5 GGBDRN CC[C@H](NC(=O)C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F)c1ccc(OC)cc1 ZINC000282768550 1435859658 /nfs/dbraw/zinc/85/96/58/1435859658.db2.gz 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C[N@@H+]1CCC[C@H](CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000517378788 974317439 /nfs/dbraw/zinc/31/74/39/974317439.db2.gz VMJCPKRSYBFJHD-ABAIWWIYSA-N 0 0 376.438 3.245 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)n1 ZINC000518306108 974322244 /nfs/dbraw/zinc/32/22/44/974322244.db2.gz MPIPWKLZOMRBFT-MRXNPFEDSA-N 0 0 384.436 3.402 20 5 GGBDRN C[C@H]1C[C@H](CCNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000520588586 974339277 /nfs/dbraw/zinc/33/92/77/974339277.db2.gz SQZAANPDAARFGE-HOCLYGCPSA-N 0 0 384.436 3.401 20 5 GGBDRN CSc1ccc([C@@H](CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000563815078 974540192 /nfs/dbraw/zinc/54/01/92/974540192.db2.gz ZYWDLDYLRXBBOU-OAHLLOKOSA-N 0 0 376.438 3.125 20 5 GGBDRN Cc1cc(NCc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000566291895 974603417 /nfs/dbraw/zinc/60/34/17/974603417.db2.gz NORLNRIDABJQJL-GOSISDBHSA-N 0 0 399.447 3.170 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)n1 ZINC000566293811 974603958 /nfs/dbraw/zinc/60/39/58/974603958.db2.gz GIOZOEURYFRTBS-AWEZNQCLSA-N 0 0 398.463 3.262 20 5 GGBDRN Cc1cc(NC[C@@H]2C[N@H+](Cc3ccccc3)CCCO2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000566564001 974616855 /nfs/dbraw/zinc/61/68/55/974616855.db2.gz PDSNVDDMOJBUJA-GOSISDBHSA-N 0 0 399.447 3.304 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@@H]2CSCC[N@@H+]2Cc2ccccc2)c1 ZINC000567113928 974627275 /nfs/dbraw/zinc/62/72/75/974627275.db2.gz YHXBRGOINNULCY-MRXNPFEDSA-N 0 0 387.461 3.323 20 5 GGBDRN Cc1cc(NC[C@@H]2C[N@H+](Cc3ccccc3)CCCO2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000568986935 974681400 /nfs/dbraw/zinc/68/14/00/974681400.db2.gz RSRHYJJIHYLIIF-QGZVFWFLSA-N 0 0 399.447 3.304 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NCCCC[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000569225994 974686813 /nfs/dbraw/zinc/68/68/13/974686813.db2.gz SFOPSHSYODAYHA-UHFFFAOYSA-N 0 0 398.463 3.307 20 5 GGBDRN O=C([O-])C1CC[NH+](CCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000569697540 974696978 /nfs/dbraw/zinc/69/69/78/974696978.db2.gz RQPYEVQJMUYUDH-UHFFFAOYSA-N 0 0 375.347 3.212 20 5 GGBDRN CC[N@H+](CCC1CCN(c2nc(C(=O)[O-])ccc2[N+](=O)[O-])CC1)CC1CC1 ZINC000571169009 974723891 /nfs/dbraw/zinc/72/38/91/974723891.db2.gz GVSFFCXANMEDDI-UHFFFAOYSA-N 0 0 376.457 3.026 20 5 GGBDRN CC[NH+](CC)CCN(Cc1cccs1)c1nc(C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000573374998 974764638 /nfs/dbraw/zinc/76/46/38/974764638.db2.gz JARDDGZDIJEEJG-UHFFFAOYSA-N 0 0 392.481 3.406 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC2CC[NH+](Cc3ccc(F)cc3)CC2)n1 ZINC000573805505 974771515 /nfs/dbraw/zinc/77/15/15/974771515.db2.gz FRUMERKKPBUFCS-UHFFFAOYSA-N 0 0 388.399 3.212 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NC2CC[NH+]([C@H](C)c3ccncc3)CC2)n1 ZINC000576758070 974821822 /nfs/dbraw/zinc/82/18/22/974821822.db2.gz GFVXYXACRPZJJM-CYBMUJFWSA-N 0 0 385.424 3.029 20 5 GGBDRN C[C@@H]1C[C@@H](CCNc2ncc(C(=O)[O-])cc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000577183279 974830145 /nfs/dbraw/zinc/83/01/45/974830145.db2.gz WZWMWLLRJYZWOM-GDBMZVCRSA-N 0 0 384.436 3.401 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CCCC[C@@H]2C)n1 ZINC000577734117 974841508 /nfs/dbraw/zinc/84/15/08/974841508.db2.gz RVPSZWTXUKBZFP-HNNXBMFYSA-N 0 0 398.463 3.405 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC(CCC[NH+]3CCCC3)CC2)n1 ZINC000592976266 974977852 /nfs/dbraw/zinc/97/78/52/974977852.db2.gz VBXDQRITGBOXRJ-UHFFFAOYSA-N 0 0 376.457 3.089 20 5 GGBDRN O=C([O-])c1ccnc(N[C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1[N+](=O)[O-] ZINC000592976943 974978722 /nfs/dbraw/zinc/97/87/22/974978722.db2.gz IMXBGDWGWCBQMH-BPQIPLTHSA-N 0 0 396.447 3.401 20 5 GGBDRN CCC[C@H]1CN(c2ncc(C(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000592977226 974978917 /nfs/dbraw/zinc/97/89/17/974978917.db2.gz UPXCIWAJGXHSRD-KRWDZBQOSA-N 0 0 384.436 3.179 20 5 GGBDRN C[C@@H](CC(=O)[O-])[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000630222881 975169445 /nfs/dbraw/zinc/16/94/45/975169445.db2.gz GBPYXIMFGNMQEL-HNNXBMFYSA-N 0 0 377.444 3.009 20 5 GGBDRN C[C@@H](C[NH2+][C@@H](C)CC(=O)Nc1cccc(C(=O)[O-])c1)c1ccccc1[N+](=O)[O-] ZINC001592269334 977527731 /nfs/dbraw/zinc/52/77/31/977527731.db2.gz QIYXADGLGGYULI-KBPBESRZSA-N 0 0 385.420 3.403 20 5 GGBDRN O=C([O-])c1ccnc(Nc2ccc(CC[NH+]3CCSCC3)cc2)c1[N+](=O)[O-] ZINC000738694038 978591572 /nfs/dbraw/zinc/59/15/72/978591572.db2.gz UQUPVSXZEDPUFL-UHFFFAOYSA-N 0 0 388.449 3.023 20 5 GGBDRN O=C([O-])Cc1ccc(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)c([N+](=O)[O-])c1 ZINC000844209859 979362264 /nfs/dbraw/zinc/36/22/64/979362264.db2.gz YBQZWDKGLGVXRQ-KRWDZBQOSA-N 0 0 375.469 3.314 20 5 GGBDRN Cc1cc(NCc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000844212372 979368751 /nfs/dbraw/zinc/36/87/51/979368751.db2.gz HJKTZFJYGJQSTC-QGZVFWFLSA-N 0 0 399.447 3.170 20 5 GGBDRN O=C([O-])c1ccccc1CC1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000851707271 979574047 /nfs/dbraw/zinc/57/40/47/979574047.db2.gz ZDFKWYVFQPHQAN-FQEVSTJZSA-N 0 0 384.432 3.281 20 5 GGBDRN CC[C@@]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)(C(=O)[O-])c1ccccc1 ZINC001595291862 980395236 /nfs/dbraw/zinc/39/52/36/980395236.db2.gz PSRHIXZQNXEOCL-IBGZPJMESA-N 0 0 389.383 3.042 20 5 GGBDRN CC[C@@]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)(C(=O)[O-])c1ccc(Cl)cc1 ZINC001595293849 980404562 /nfs/dbraw/zinc/40/45/62/980404562.db2.gz YVQATVIMCNAGIM-AEFFLSMTSA-N 0 0 378.812 3.261 20 5 GGBDRN CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H](C(=O)[O-])C1 ZINC000902032208 980703872 /nfs/dbraw/zinc/70/38/72/980703872.db2.gz LGVHNTVUBSMFIN-MLGOLLRUSA-N 0 0 376.434 3.387 20 5 GGBDRN Cc1ccc(C[N@H+]2CC[C@@H](CN(C)c3nccc(C(=O)[O-])c3[N+](=O)[O-])C2)s1 ZINC000910378200 981903616 /nfs/dbraw/zinc/90/36/16/981903616.db2.gz JTAWWIZFIOZQCA-ZDUSSCGKSA-N 0 0 390.465 3.016 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC3(CCC([NH+](C)C)CC3)CC2)n1 ZINC000910384574 981908820 /nfs/dbraw/zinc/90/88/20/981908820.db2.gz QRDYTIPJFIGDGI-UHFFFAOYSA-N 0 0 376.457 3.087 20 5 GGBDRN O=C([O-])/C=C/c1ccc(NC2CC[NH+](Cc3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC000917080926 982679280 /nfs/dbraw/zinc/67/92/80/982679280.db2.gz NYMLHIAMOPESGN-FNORWQNLSA-N 0 0 382.420 3.164 20 5 GGBDRN O=C([O-])/C=C\c1ccc(NC2CC[NH+](Cc3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000917086238 982679466 /nfs/dbraw/zinc/67/94/66/982679466.db2.gz USYSGMFGPFUJNP-RQOWECAXSA-N 0 0 382.420 3.164 20 5 GGBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]3C[C@@]32C(=O)[O-])cc1OC ZINC001594964482 982718676 /nfs/dbraw/zinc/71/86/76/982718676.db2.gz JJJYHYBKMYDQLR-RCDCFZSISA-N 0 0 392.452 3.467 20 5 GGBDRN CC[NH+](CC)Cc1ccc(C(=O)N[C@@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1 ZINC001596275818 983694886 /nfs/dbraw/zinc/69/48/86/983694886.db2.gz OKCXUAGABOOSMR-OAQYLSRUSA-N 0 0 399.447 3.166 20 5 GGBDRN CC[NH+](CC)Cc1ccc(C(=O)Nc2cc(C(=O)[O-])cc([N+](=O)[O-])c2C)o1 ZINC001596277072 983697354 /nfs/dbraw/zinc/69/73/54/983697354.db2.gz UZKPBEIDXMMHIS-UHFFFAOYSA-N 0 0 375.381 3.289 20 5 GGBDRN CC[NH+]1CCN(c2cccc(Nc3cc(C)c([N+](=O)[O-])cc3C(=O)[O-])c2)CC1 ZINC001596442339 984136016 /nfs/dbraw/zinc/13/60/16/984136016.db2.gz IRELFZIZMCNGPL-UHFFFAOYSA-N 0 0 384.436 3.487 20 5 GGBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCc2cc(C(=O)[O-])ccc2NC1=O ZINC001589002304 984947177 /nfs/dbraw/zinc/94/71/77/984947177.db2.gz PGAUHVFKNXIJBK-PMTSLALWSA-N 0 0 395.415 3.239 20 5 GGBDRN C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594487690 985576979 /nfs/dbraw/zinc/57/69/79/985576979.db2.gz UTDLEQFVNDREQU-IUODEOHRSA-N 0 0 393.440 3.028 20 5 GGBDRN CCOCCC[N@@H+]1CC[C@H](Nc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])[C@H](C)C1 ZINC001596917458 985961001 /nfs/dbraw/zinc/96/10/01/985961001.db2.gz WYLFPHURNKTHBS-YFZXXLGGSA-N 0 0 391.468 3.242 20 5 GGBDRN C[C@@H]1C[NH+](CCCCNc2c(Cl)cc([N+](=O)[O-])cc2C(=O)[O-])C[C@@H](C)O1 ZINC001594527619 986081652 /nfs/dbraw/zinc/08/16/52/986081652.db2.gz HBGXCABUBINEAF-VXGBXAGGSA-N 0 0 385.848 3.248 20 5 GGBDRN C[C@@H]1C[N@H+](Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C ZINC001594533133 986134800 /nfs/dbraw/zinc/13/48/00/986134800.db2.gz APACIELFIRSMTE-IUODEOHRSA-N 0 0 393.440 3.028 20 5 GGBDRN CC[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC001597291113 987376441 /nfs/dbraw/zinc/37/64/41/987376441.db2.gz BLMHLZFTAAOUPL-OAHLLOKOSA-N 0 0 389.364 3.207 20 5 GGBDRN CC(C)(C(=O)[O-])[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC001589602015 987430430 /nfs/dbraw/zinc/43/04/30/987430430.db2.gz UFSZXKUWUNPYOI-GOSISDBHSA-N 0 0 385.420 3.365 20 5 GGBDRN CCc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)CCO2 ZINC001597569428 988335017 /nfs/dbraw/zinc/33/50/17/988335017.db2.gz VKSPRMMOLKHNHX-INIZCTEOSA-N 0 0 386.404 3.234 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@H]1CCCN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001598066350 990349812 /nfs/dbraw/zinc/34/98/12/990349812.db2.gz ISXYXNZQZFJFPZ-HNNXBMFYSA-N 0 0 393.440 3.124 20 5 GGBDRN COc1ccccc1C[C@H](C)[N@H+](C)Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001599707972 991321763 /nfs/dbraw/zinc/32/17/63/991321763.db2.gz BQIROPNBLKXXGW-AWEZNQCLSA-N 0 0 388.420 3.130 20 5 GGBDRN CN(CCC[N@H+](C)Cc1ccncc1)c1c(Cl)cc([N+](=O)[O-])cc1C(=O)[O-] ZINC001598477710 992102149 /nfs/dbraw/zinc/10/21/49/992102149.db2.gz DZAZSGJDXSAIOH-UHFFFAOYSA-N 0 0 392.843 3.300 20 5 GGBDRN COc1ccc(SCC[NH2+][C@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1 ZINC001599619376 994059905 /nfs/dbraw/zinc/05/99/05/994059905.db2.gz MMLHZDUQEGYLHX-SFHVURJKSA-N 0 0 376.434 3.285 20 5 GGBDRN C[C@@]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593249522 994478218 /nfs/dbraw/zinc/47/82/18/994478218.db2.gz XHCUGQMWMPPECR-WBVHZDCISA-N 0 0 382.775 3.010 20 5 GGBDRN C[C@]([NH2+]Cc1ccc(-c2ccccn2)nc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593291721 994670310 /nfs/dbraw/zinc/67/03/10/994670310.db2.gz BVNNVGUFVRBJIH-HXUWFJFHSA-N 0 0 378.388 3.141 20 5 GGBDRN C[C@@]([NH2+]Cc1ccc(-c2ccccn2)nc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593291719 994670490 /nfs/dbraw/zinc/67/04/90/994670490.db2.gz BVNNVGUFVRBJIH-FQEVSTJZSA-N 0 0 378.388 3.141 20 5 GGBDRN C[C@]([NH2+]Cc1cc2c(c(Cl)c1)OCO2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593292086 994674719 /nfs/dbraw/zinc/67/47/19/994674719.db2.gz HLTVFHMPXRIILP-QGZVFWFLSA-N 0 0 378.768 3.067 20 5 GGBDRN C[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccc(-n2ccnc2)cc1 ZINC001593298524 994716013 /nfs/dbraw/zinc/71/60/13/994716013.db2.gz KMCHJJDWIHGYPU-CQSZACIVSA-N 0 0 396.403 3.095 20 5 GGBDRN C[C@]([NH2+]Cc1ccc(OCC(F)(F)F)nc1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593298854 994718506 /nfs/dbraw/zinc/71/85/06/994718506.db2.gz NXWLQRPINNRNGD-MRXNPFEDSA-N 0 0 399.325 3.021 20 5 GGBDRN C[C@@]([NH2+]Cc1cccc2c1OC(F)(F)O2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593303523 994734206 /nfs/dbraw/zinc/73/42/06/994734206.db2.gz FPSQMHXISVDSNF-INIZCTEOSA-N 0 0 380.303 3.006 20 5 GGBDRN C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](Cc1ccccc1)C(=O)[O-] ZINC001593317314 994818709 /nfs/dbraw/zinc/81/87/09/994818709.db2.gz OZAIIRCIFBHGQQ-SUMWQHHRSA-N 0 0 396.403 3.066 20 5 GGBDRN C[C@@H](Oc1ccc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)[O-] ZINC001593617940 995855401 /nfs/dbraw/zinc/85/54/01/995855401.db2.gz RICPINUOFCVFHM-GFCCVEGCSA-N 0 0 378.812 3.432 20 5 GGBDRN CC1(C)CCC[C@@]([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])(C(=O)[O-])C1 ZINC001593895737 996750406 /nfs/dbraw/zinc/75/04/06/996750406.db2.gz MULPYJZRHNZBDQ-KRWDZBQOSA-N 0 0 383.832 3.200 20 5 GGBDRN CC1(C)CCC[C@]([NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)(C(=O)[O-])C1 ZINC001593896070 996750845 /nfs/dbraw/zinc/75/08/45/996750845.db2.gz PBJHHQGIKZLJMX-GOSISDBHSA-N 0 0 381.404 3.076 20 5 GGBDRN CO[C@]1(C(=O)[O-])CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC001599078384 996933351 /nfs/dbraw/zinc/93/33/51/996933351.db2.gz CJIWTFBLZCAHPP-QGZVFWFLSA-N 0 0 380.784 3.184 20 5 GGBDRN CC1(C)CN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC001593942831 996973223 /nfs/dbraw/zinc/97/32/23/996973223.db2.gz QBZMQKVJBYJCDE-UHFFFAOYSA-N 0 0 383.448 3.389 20 5 GGBDRN C[C@]([NH2+]Cc1ccc2c(c1)COC(C)(C)O2)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593980919 997196547 /nfs/dbraw/zinc/19/65/47/997196547.db2.gz PAMKKSDIXUVOTJ-HXUWFJFHSA-N 0 0 386.404 3.330 20 5 GGBDRN COc1cc(C[N@@H+]2CCC[C@@H](c3ncc(C(=O)[O-])s3)C2)ccc1[N+](=O)[O-] ZINC001599407855 997360731 /nfs/dbraw/zinc/36/07/31/997360731.db2.gz RYNCDUUEKUAMMV-GFCCVEGCSA-N 0 0 377.422 3.138 20 5 GGBDRN COc1cc(C[NH2+]C2(CC(=O)[O-])CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC001599415501 997500636 /nfs/dbraw/zinc/50/06/36/997500636.db2.gz BZLNIXHJDAXDIO-UHFFFAOYSA-N 0 0 388.367 3.124 20 5 GGBDRN COC(=O)c1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc(C(=O)[O-])c1 ZINC001598930135 997733125 /nfs/dbraw/zinc/73/31/25/997733125.db2.gz XBETWYOYUQZOOZ-UHFFFAOYSA-N 0 0 386.404 3.490 20 5 GGBDRN C[C@@]1(c2cccc(F)c2)CC[N@H+](Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)C1 ZINC001594074574 997940175 /nfs/dbraw/zinc/94/01/75/997940175.db2.gz WGFMFLSIOUNNQZ-HXUWFJFHSA-N 0 0 388.395 3.361 20 5 GGBDRN COc1ccc(C[N@H+](Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)C2CC2)cc1 ZINC001599559827 998169081 /nfs/dbraw/zinc/16/90/81/998169081.db2.gz RFRFWBWNOKLQMA-UHFFFAOYSA-N 0 0 386.404 3.231 20 5 GGBDRN COc1ccc(-c2ccc(C[N@@H+]3CCSC[C@H]3CC(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC001599468280 998402069 /nfs/dbraw/zinc/40/20/69/998402069.db2.gz JZEONGVTMGZTSW-GFCCVEGCSA-N 0 0 392.433 3.256 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@]2(C(=O)[O-])CC[C@H](C)c3ccccc32)c1 ZINC001598989063 998719670 /nfs/dbraw/zinc/71/96/70/998719670.db2.gz ZEOCASFPWHQBDU-YEJXKQKISA-N 0 0 398.415 3.348 20 5 GGBDRN CCOc1cccc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])c1 ZINC000276938091 1126078190 /nfs/dbraw/zinc/07/81/90/1126078190.db2.gz ACHAUFFTBUUMMH-LJQANCHMSA-N 0 0 383.404 3.260 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(OCC(F)(F)F)c1 ZINC000277330277 1126078616 /nfs/dbraw/zinc/07/86/16/1126078616.db2.gz OIPZNZWLTPCWBQ-INIZCTEOSA-N 0 0 398.337 3.321 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000426728151 1126083641 /nfs/dbraw/zinc/08/36/41/1126083641.db2.gz TXBUAZCSMGTSSG-IBGZPJMESA-N 0 0 396.378 3.482 20 5 GGBDRN COc1ccc(C)cc1C[NH2+][C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)[O-] ZINC000426729473 1126083823 /nfs/dbraw/zinc/08/38/23/1126083823.db2.gz DADHFPHLEBAMKX-GOSISDBHSA-N 0 0 383.404 3.179 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(OC(F)(F)F)c1 ZINC000426783807 1126090265 /nfs/dbraw/zinc/09/02/65/1126090265.db2.gz NZFPWMULPNEXTP-HNNXBMFYSA-N 0 0 384.310 3.279 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(OCC(F)(F)F)cc1 ZINC000426795381 1126090898 /nfs/dbraw/zinc/09/08/98/1126090898.db2.gz XBYIEVAEYSWOLG-INIZCTEOSA-N 0 0 398.337 3.321 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(OC(F)(F)F)c1 ZINC000426812798 1126092146 /nfs/dbraw/zinc/09/21/46/1126092146.db2.gz ZZQHQKRXXAIVBG-AWEZNQCLSA-N 0 0 384.310 3.279 20 5 GGBDRN CCc1nnc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000019200093 210228863 /nfs/dbraw/zinc/22/88/63/210228863.db2.gz RUIICMGSYOBFRZ-UHFFFAOYSA-N 0 0 389.359 3.468 20 5 GGBDRN O=C(c1cc2ccccc2cc1O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000018077595 210213245 /nfs/dbraw/zinc/21/32/45/210213245.db2.gz OJSJLTHGVKDNEV-UHFFFAOYSA-N 0 0 377.400 3.416 20 5 GGBDRN C[C@@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000017327398 210210549 /nfs/dbraw/zinc/21/05/49/210210549.db2.gz QCAHHFUFQBCKSV-PHIMTYICSA-N 0 0 375.347 3.051 20 5 GGBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000017306067 210207927 /nfs/dbraw/zinc/20/79/27/210207927.db2.gz FHNBBHXAMQXAPD-AWEZNQCLSA-N 0 0 395.419 3.235 20 5 GGBDRN Cc1ccc2c(CN3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc(=O)oc2c1 ZINC000016515426 210190536 /nfs/dbraw/zinc/19/05/36/210190536.db2.gz IZQQSMGQLJMMTM-UHFFFAOYSA-N 0 0 379.416 3.332 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@@H]2CCSc3ccc(F)cc32)cc([N+](=O)[O-])c1 ZINC000016110242 210185136 /nfs/dbraw/zinc/18/51/36/210185136.db2.gz DQLQQRPSJOYOSL-OAHLLOKOSA-N 0 0 390.392 3.487 20 5 GGBDRN CC(=O)Nc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000016019579 210183072 /nfs/dbraw/zinc/18/30/72/210183072.db2.gz ZNBJTKIQNBFZGI-UHFFFAOYSA-N 0 0 382.420 3.408 20 5 GGBDRN C[C@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000015820536 210171112 /nfs/dbraw/zinc/17/11/12/210171112.db2.gz SQMUPYORQRSYMZ-LBPRGKRZSA-N 0 0 377.360 3.413 20 5 GGBDRN CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000015790905 210170598 /nfs/dbraw/zinc/17/05/98/210170598.db2.gz HNFZIVPEGQKCDY-UHFFFAOYSA-N 0 0 391.449 3.186 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000015790964 210170648 /nfs/dbraw/zinc/17/06/48/210170648.db2.gz RWDHPNZCDKWBCP-UHFFFAOYSA-N 0 0 391.449 3.186 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)C(C)C)cc1 ZINC000015332205 210156475 /nfs/dbraw/zinc/15/64/75/210156475.db2.gz HPZDGUKVRJYABK-GOSISDBHSA-N 0 0 394.449 3.288 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000015359458 210155704 /nfs/dbraw/zinc/15/57/04/210155704.db2.gz KQETULWJOHFKBX-CYBMUJFWSA-N 0 0 382.463 3.363 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2nnc(NC[C@@H]3CCCO3)s2)c([N+](=O)[O-])c1 ZINC000015140901 210153852 /nfs/dbraw/zinc/15/38/52/210153852.db2.gz SVGCUQPFUNGZAE-VIFPVBQESA-N 0 0 383.411 3.097 20 5 GGBDRN O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1[nH]nc2ccccc21 ZINC000015033451 210145196 /nfs/dbraw/zinc/14/51/96/210145196.db2.gz WBHXAHLKXXBMQS-UHFFFAOYSA-N 0 0 393.325 3.332 20 5 GGBDRN CNc1ccc(C(=O)N[C@H](c2nccn2C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000014400683 210118121 /nfs/dbraw/zinc/11/81/21/210118121.db2.gz BYGMJIHJWODRPD-KRWDZBQOSA-N 0 0 383.383 3.029 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)Cc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000014376119 210116201 /nfs/dbraw/zinc/11/62/01/210116201.db2.gz GJBRGZRRKCKTQJ-QGZVFWFLSA-N 0 0 388.395 3.476 20 5 GGBDRN CNc1ccc(C(=O)N[C@@H](c2nccn2C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000014400686 210117622 /nfs/dbraw/zinc/11/76/22/210117622.db2.gz BYGMJIHJWODRPD-QGZVFWFLSA-N 0 0 383.383 3.029 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1[N+](=O)[O-] ZINC000014425101 210117271 /nfs/dbraw/zinc/11/72/71/210117271.db2.gz RNRXSGWIKMNODD-UHFFFAOYSA-N 0 0 391.449 3.184 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccc(OC(F)(F)F)cc1)CC2 ZINC000014099087 210103384 /nfs/dbraw/zinc/10/33/84/210103384.db2.gz KNPKLAISJCUEAK-UHFFFAOYSA-N 0 0 388.323 3.245 20 5 GGBDRN COc1ccc(C(=O)Nc2cccc(Cl)c2N2CCOCC2)cc1[N+](=O)[O-] ZINC000014125766 210105813 /nfs/dbraw/zinc/10/58/13/210105813.db2.gz SZWOGHSKWAVCIZ-UHFFFAOYSA-N 0 0 391.811 3.346 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@H]3CCCO3)cc2[N+](=O)[O-])n1 ZINC000013130759 210053841 /nfs/dbraw/zinc/05/38/41/210053841.db2.gz PXUDCXGZMSJKOU-GFCCVEGCSA-N 0 0 379.463 3.420 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@@H]3CCCO3)cc2[N+](=O)[O-])n1 ZINC000013130756 210052854 /nfs/dbraw/zinc/05/28/54/210052854.db2.gz PXUDCXGZMSJKOU-LBPRGKRZSA-N 0 0 379.463 3.420 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(C(=O)c2ccc3ccccc3c2)CC1 ZINC000012981058 210039487 /nfs/dbraw/zinc/03/94/87/210039487.db2.gz PVGPKLBNMFCZFN-UHFFFAOYSA-N 0 0 395.440 3.408 20 5 GGBDRN Cc1c(NC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)cccc1[N+](=O)[O-] ZINC000012939615 210034121 /nfs/dbraw/zinc/03/41/21/210034121.db2.gz QHNXDGCNJMGUNG-UHFFFAOYSA-N 0 0 380.404 3.259 20 5 GGBDRN Cc1ccc([C@@H](CN2CCOCC2)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000012919937 210030523 /nfs/dbraw/zinc/03/05/23/210030523.db2.gz QWTAPBKEECGPBX-LJQANCHMSA-N 0 0 383.448 3.015 20 5 GGBDRN Cc1c(C(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cccc1[N+](=O)[O-] ZINC000012894967 210024703 /nfs/dbraw/zinc/02/47/03/210024703.db2.gz MGRSFPHYYXWMAG-CYBMUJFWSA-N 0 0 376.434 3.140 20 5 GGBDRN COc1ccc(OC)c([C@@H]2CCCN2C(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000012910636 210025490 /nfs/dbraw/zinc/02/54/90/210025490.db2.gz DWBKTRIMXJARNG-INIZCTEOSA-N 0 0 386.404 3.355 20 5 GGBDRN CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(c1ccccc1)c1ccccc1 ZINC000012892986 210024213 /nfs/dbraw/zinc/02/42/13/210024213.db2.gz OPDCPFKTKGDJCQ-UHFFFAOYSA-N 0 0 377.400 3.005 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000012853955 210019324 /nfs/dbraw/zinc/01/93/24/210019324.db2.gz XKYHMJQLKVAUBH-UHFFFAOYSA-N 0 0 383.751 3.056 20 5 GGBDRN O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)Nc1cccc([N+](=O)[O-])c1 ZINC000012780161 210007907 /nfs/dbraw/zinc/00/79/07/210007907.db2.gz GBSXZPRGCHYYBY-UHFFFAOYSA-N 0 0 398.444 3.274 20 5 GGBDRN Cc1nc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)oc1C 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O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N(CC1CC1)CC1CC1 ZINC000115590883 564196790 /nfs/dbraw/zinc/19/67/90/564196790.db2.gz PWJUDXVXPLFVQI-UHFFFAOYSA-N 0 0 389.271 3.168 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCSC[C@@H]1c1ccccc1 ZINC000115590339 564196865 /nfs/dbraw/zinc/19/68/65/564196865.db2.gz VCJQBTTUEZSOOA-MRXNPFEDSA-N 0 0 378.475 3.382 20 5 GGBDRN CCOc1ccccc1CNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000115715257 564198706 /nfs/dbraw/zinc/19/87/06/564198706.db2.gz YZJUBOLTHWNPHE-UHFFFAOYSA-N 0 0 384.841 3.434 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1cccs1)Cc1cccs1 ZINC000116043294 564201849 /nfs/dbraw/zinc/20/18/49/564201849.db2.gz AFCGMEHFOFAFTB-UHFFFAOYSA-N 0 0 376.463 3.452 20 5 GGBDRN C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116276585 564207296 /nfs/dbraw/zinc/20/72/96/564207296.db2.gz AGTTUPJQXHVLLI-NSHDSACASA-N 0 0 383.857 3.089 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC2(c3nccs3)CCCC2)c1C ZINC000116366607 564208392 /nfs/dbraw/zinc/20/83/92/564208392.db2.gz CLRMDXNXFTYFIX-UHFFFAOYSA-N 0 0 381.479 3.416 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2(c3nccs3)CCCC2)c(Cl)c1 ZINC000116366962 564208646 /nfs/dbraw/zinc/20/86/46/564208646.db2.gz ASLZZQCRUXVWMO-UHFFFAOYSA-N 0 0 387.870 3.453 20 5 GGBDRN Cc1ccc([C@H]2CSCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000116376263 564209639 /nfs/dbraw/zinc/20/96/39/564209639.db2.gz WCKQQYKBQUDRLZ-QGZVFWFLSA-N 0 0 378.475 3.382 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H](C)CCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000116449313 564210202 /nfs/dbraw/zinc/21/02/02/564210202.db2.gz SLOIRKUYKCNFBK-SECBINFHSA-N 0 0 381.230 3.140 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2ccc3nc(C)sc3c2)cc1[N+](=O)[O-] ZINC000005127152 564213953 /nfs/dbraw/zinc/21/39/53/564213953.db2.gz QUFJTIJOLOEDRQ-UHFFFAOYSA-N 0 0 379.419 3.322 20 5 GGBDRN CSc1ccccc1NC(=O)CCn1cc(Br)c([N+](=O)[O-])n1 ZINC000116797090 564216967 /nfs/dbraw/zinc/21/69/67/564216967.db2.gz SFTCFZFBYNGLIK-UHFFFAOYSA-N 0 0 385.243 3.305 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000116846536 564218145 /nfs/dbraw/zinc/21/81/45/564218145.db2.gz QNLVAWJQFBUHLL-UHFFFAOYSA-N 0 0 382.825 3.354 20 5 GGBDRN Cc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)s1 ZINC000005748790 564218748 /nfs/dbraw/zinc/21/87/48/564218748.db2.gz RCJNEJGGHVJMNE-UHFFFAOYSA-N 0 0 389.256 3.248 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)nc1C ZINC000117572156 564229400 /nfs/dbraw/zinc/22/94/00/564229400.db2.gz WLVSHWSWARWPGA-UHFFFAOYSA-N 0 0 383.813 3.371 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCC(=O)Nc1ccc(Cl)cc1 ZINC000117626974 564229435 /nfs/dbraw/zinc/22/94/35/564229435.db2.gz PYPOUMPXIHBJJL-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN CS(=O)(=O)c1ccc(NCCSCc2ccccc2F)c([N+](=O)[O-])c1 ZINC000007187246 564233713 /nfs/dbraw/zinc/23/37/13/564233713.db2.gz BWJBTMULNMBFIH-UHFFFAOYSA-N 0 0 384.454 3.483 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCN(c2ccccc2O)CC1 ZINC000007270126 564235177 /nfs/dbraw/zinc/23/51/77/564235177.db2.gz GSILKFBBRSUANZ-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N(C)Cc2ccsc2)c([N+](=O)[O-])c1 ZINC000007366370 564236215 /nfs/dbraw/zinc/23/62/15/564236215.db2.gz IDIVABXBYYORHT-UHFFFAOYSA-N 0 0 383.495 3.323 20 5 GGBDRN CN(CC(=O)Nc1ccccc1Br)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000007407533 564237059 /nfs/dbraw/zinc/23/70/59/564237059.db2.gz UIMXTZUBVZBSNM-UHFFFAOYSA-N 0 0 392.209 3.068 20 5 GGBDRN Cc1ccc(OCc2cc(=O)n3cc(Br)ccc3n2)c([N+](=O)[O-])c1 ZINC000007461455 564237121 /nfs/dbraw/zinc/23/71/21/564237121.db2.gz ANNKUKTXMXRLHD-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN Cc1cc(Cl)ccc1NC(=O)[C@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000007471274 564237179 /nfs/dbraw/zinc/23/71/79/564237179.db2.gz PJCSJJJFATWNPW-NSHDSACASA-N 0 0 382.825 3.358 20 5 GGBDRN O=C(CSc1nnc(NC2CC2)s1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000007577405 564238195 /nfs/dbraw/zinc/23/81/95/564238195.db2.gz MTINMJJOOTXJQU-UHFFFAOYSA-N 0 0 385.858 3.405 20 5 GGBDRN CNS(=O)(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000007737543 564240394 /nfs/dbraw/zinc/24/03/94/564240394.db2.gz MLNHGKRGZKMVJQ-UHFFFAOYSA-N 0 0 381.460 3.264 20 5 GGBDRN C[C@H]1SCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000118441783 564240786 /nfs/dbraw/zinc/24/07/86/564240786.db2.gz LKSQTKAVMRRQQM-DYVFJYSZSA-N 0 0 378.475 3.462 20 5 GGBDRN C[C@@H]1SCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000118441787 564241006 /nfs/dbraw/zinc/24/10/06/564241006.db2.gz LKSQTKAVMRRQQM-GUYCJALGSA-N 0 0 378.475 3.462 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2cccc(Cl)c2Cl)cc1 ZINC000007908894 564242358 /nfs/dbraw/zinc/24/23/58/564242358.db2.gz WBQJCKIAIJNULV-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1c(Cl)cccc1Cl ZINC000007907895 564243112 /nfs/dbraw/zinc/24/31/12/564243112.db2.gz FOKCLWLLBDSLBC-UHFFFAOYSA-N 0 0 390.248 3.292 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCCc2cccs2)c([N+](=O)[O-])c1 ZINC000007981853 564243518 /nfs/dbraw/zinc/24/35/18/564243518.db2.gz BCOGHWGYUFYZKN-UHFFFAOYSA-N 0 0 383.495 3.341 20 5 GGBDRN O=C(c1cccc(Br)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690466 564244046 /nfs/dbraw/zinc/24/40/46/564244046.db2.gz AMVFUBBSURUCAH-ZDUSSCGKSA-N 0 0 391.225 3.079 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Br)c1 ZINC000008007207 564244755 /nfs/dbraw/zinc/24/47/55/564244755.db2.gz LVTHQZSPHLDDTB-JTQLQIEISA-N 0 0 392.209 3.114 20 5 GGBDRN Cc1cc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Br ZINC000008034380 564244766 /nfs/dbraw/zinc/24/47/66/564244766.db2.gz YUINWIRCRNYFII-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2ccc(Br)cc2)cc([N+](=O)[O-])c1 ZINC000118723389 564245448 /nfs/dbraw/zinc/24/54/48/564245448.db2.gz VWBBBUGKQPAAGP-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN COc1ccc(C(=O)NCCNc2ccccc2[N+](=O)[O-])cc1Br ZINC000008146490 564246223 /nfs/dbraw/zinc/24/62/23/564246223.db2.gz IWAONEPUWDOIAS-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN O=C(Cc1ccc(Br)cc1)NCCNc1ccccc1[N+](=O)[O-] ZINC000008145755 564246393 /nfs/dbraw/zinc/24/63/93/564246393.db2.gz GJIHIJUOAQBDGX-UHFFFAOYSA-N 0 0 378.226 3.128 20 5 GGBDRN O=C(Nc1n[nH]c(-c2ccccc2Br)n1)c1ccc([N+](=O)[O-])cc1 ZINC000008115272 564246454 /nfs/dbraw/zinc/24/64/54/564246454.db2.gz IYKKICYOAKQRQM-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN O=C(Cc1ccc(Br)cc1)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000008175080 564246909 /nfs/dbraw/zinc/24/69/09/564246909.db2.gz SFBSEYULRXWTGN-UHFFFAOYSA-N 0 0 378.226 3.128 20 5 GGBDRN COc1ccc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000008183621 564246951 /nfs/dbraw/zinc/24/69/51/564246951.db2.gz VJINCMMMDGJITG-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccccc3Br)C2)nc1 ZINC000118866264 564247377 /nfs/dbraw/zinc/24/73/77/564247377.db2.gz YIVYKJUJHQJLKS-ZDUSSCGKSA-N 0 0 377.242 3.439 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCC(=O)Nc1cc(Cl)ccc1Cl ZINC000008314980 564247782 /nfs/dbraw/zinc/24/77/82/564247782.db2.gz JCWIQYXAIWLTOZ-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000118978309 564249297 /nfs/dbraw/zinc/24/92/97/564249297.db2.gz YSPBXDDXHDTTMH-DYVFJYSZSA-N 0 0 399.285 3.467 20 5 GGBDRN Cc1cc(Br)cnc1NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000008697790 564250947 /nfs/dbraw/zinc/25/09/47/564250947.db2.gz BSOPCDWVURRIOZ-UHFFFAOYSA-N 0 0 386.227 3.003 20 5 GGBDRN CC(=O)[C@H](NC(=O)CSc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000119105280 564254950 /nfs/dbraw/zinc/25/49/50/564254950.db2.gz HVVDRAFWOJAWJK-CQSZACIVSA-N 0 0 389.271 3.179 20 5 GGBDRN CC(C)NC(=O)NC(=O)[C@@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000119102402 564255090 /nfs/dbraw/zinc/25/50/90/564255090.db2.gz FTIWRUWDPXIJHK-MRVPVSSYSA-N 0 0 390.259 3.072 20 5 GGBDRN CN(CC(F)(F)F)C(=O)CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000119125574 564256113 /nfs/dbraw/zinc/25/61/13/564256113.db2.gz KAEOVJNXMQNQDE-UHFFFAOYSA-N 0 0 387.177 3.470 20 5 GGBDRN COc1ccc(C)c2c1N(S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1)CCC2 ZINC000119123576 564256450 /nfs/dbraw/zinc/25/64/50/564256450.db2.gz WMGKJKLRIMDLPK-UHFFFAOYSA-N 0 0 382.463 3.423 20 5 GGBDRN CCCCNC(=O)NC(=O)CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000119129315 564256472 /nfs/dbraw/zinc/25/64/72/564256472.db2.gz FOWZWIGQIRGICU-UHFFFAOYSA-N 0 0 390.259 3.075 20 5 GGBDRN Cn1cc(NC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)cn1 ZINC000119144358 564256905 /nfs/dbraw/zinc/25/69/05/564256905.db2.gz JYWVFKLFRWFQSW-UHFFFAOYSA-N 0 0 381.179 3.073 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCCCOc2ccc(Cl)cc2)cc1 ZINC000010517867 564257758 /nfs/dbraw/zinc/25/77/58/564257758.db2.gz WOAGBZQASOFJHN-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(OCC(F)(F)F)cc2)cc1 ZINC000010516249 564258432 /nfs/dbraw/zinc/25/84/32/564258432.db2.gz CHPIKHBIWXZFRD-UHFFFAOYSA-N 0 0 376.312 3.337 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N[C@H]1CCO[C@@H](C2CC2)C1 ZINC000119221490 564259835 /nfs/dbraw/zinc/25/98/35/564259835.db2.gz WQPCIFKDACHYSB-SMDDNHRTSA-N 0 0 384.230 3.436 20 5 GGBDRN O=c1c([N+](=O)[O-])cccn1Cc1cccc(Br)c1OC(F)F ZINC000119230424 564261256 /nfs/dbraw/zinc/26/12/56/564261256.db2.gz SDZOVNOLJIFALE-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(Br)o1 ZINC000010963526 564261313 /nfs/dbraw/zinc/26/13/13/564261313.db2.gz ZJTRYRZPBRXFFZ-UHFFFAOYSA-N 0 0 383.154 3.364 20 5 GGBDRN C[C@@H](NC(=O)c1cccs1)C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000010904546 564261324 /nfs/dbraw/zinc/26/13/24/564261324.db2.gz QSAUAJGPBHFBIX-SNVBAGLBSA-N 0 0 381.841 3.087 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1cccc2[nH]cnc21 ZINC000119304992 564264888 /nfs/dbraw/zinc/26/48/88/564264888.db2.gz LXRJRJFLZQEILF-UHFFFAOYSA-N 0 0 375.182 3.415 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1Br ZINC000011621197 564265305 /nfs/dbraw/zinc/26/53/05/564265305.db2.gz UPVRTLBJDGODPR-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCc2nc3ccccc3s2)c1C ZINC000119357043 564267253 /nfs/dbraw/zinc/26/72/53/564267253.db2.gz SZPYKDIRDSTHJB-UHFFFAOYSA-N 0 0 377.447 3.300 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000119372970 564267547 /nfs/dbraw/zinc/26/75/47/564267547.db2.gz OSMBAUWKZBLUJE-UHFFFAOYSA-N 0 0 381.230 3.037 20 5 GGBDRN COCCCN(C)C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000119401656 564269039 /nfs/dbraw/zinc/26/90/39/564269039.db2.gz BEVPSXHNOHRZEZ-UHFFFAOYSA-N 0 0 387.223 3.196 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1Cl ZINC000119438904 564271222 /nfs/dbraw/zinc/27/12/22/564271222.db2.gz NHUUHBXTMJGEJK-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN O=C(Cn1cccc(C(F)(F)F)c1=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000012900853 564272536 /nfs/dbraw/zinc/27/25/36/564272536.db2.gz FICCXVCZBJSNCP-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN CCN(Cc1ccccn1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000119537842 564276184 /nfs/dbraw/zinc/27/61/84/564276184.db2.gz YBDYYZDUWUKRAW-UHFFFAOYSA-N 0 0 378.226 3.344 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCO[C@H](c2ccccc2)C1 ZINC000119536834 564276396 /nfs/dbraw/zinc/27/63/96/564276396.db2.gz YPTGWSIUKMJJBL-HNNXBMFYSA-N 0 0 382.825 3.010 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000014101998 564279760 /nfs/dbraw/zinc/27/97/60/564279760.db2.gz OYTSAVPUSDGUPD-HNNXBMFYSA-N 0 0 383.857 3.421 20 5 GGBDRN CCOc1ncccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000119654779 564282072 /nfs/dbraw/zinc/28/20/72/564282072.db2.gz YWGHYKXTXHMUEH-UHFFFAOYSA-N 0 0 380.198 3.332 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2ccc(Cl)cc2F)c([N+](=O)[O-])c1 ZINC000015077318 564284678 /nfs/dbraw/zinc/28/46/78/564284678.db2.gz OVCPNVMLVCSOCK-UHFFFAOYSA-N 0 0 383.788 3.217 20 5 GGBDRN O=C(CNc1cccc([N+](=O)[O-])c1)Nc1cccc(I)c1 ZINC000015288966 564285575 /nfs/dbraw/zinc/28/55/75/564285575.db2.gz VVIWZQOGJJRICB-UHFFFAOYSA-N 0 0 397.172 3.250 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc([N+](=O)[O-])cc1Br ZINC000119753235 564287099 /nfs/dbraw/zinc/28/70/99/564287099.db2.gz KIWURFXWJWXLRE-CFVMTHIKSA-N 0 0 395.253 3.435 20 5 GGBDRN Cc1ccc(NC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000015410328 564287374 /nfs/dbraw/zinc/28/73/74/564287374.db2.gz HGROZHIJWIUTQE-UHFFFAOYSA-N 0 0 382.825 3.359 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H](c2cc[nH]n2)C1 ZINC000119880642 564292530 /nfs/dbraw/zinc/29/25/30/564292530.db2.gz VDFQRWLISWIENT-JTQLQIEISA-N 0 0 379.214 3.100 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1nc2ccccc2s1 ZINC000017332904 564298354 /nfs/dbraw/zinc/29/83/54/564298354.db2.gz IRTSBBFSUJUYDV-UHFFFAOYSA-N 0 0 377.447 3.334 20 5 GGBDRN CN(Cc1ccc(Br)s1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000018107564 564301116 /nfs/dbraw/zinc/30/11/16/564301116.db2.gz GXQDPPFSAXTSHY-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cc1 ZINC000018707111 564302048 /nfs/dbraw/zinc/30/20/48/564302048.db2.gz CBOBDNKLVMNOJK-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1sc(C)nc1C ZINC000120051209 564302108 /nfs/dbraw/zinc/30/21/08/564302108.db2.gz CKIZJNBPRSRJHC-UHFFFAOYSA-N 0 0 381.479 3.337 20 5 GGBDRN CCNc1nnc(S[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000018663588 564302159 /nfs/dbraw/zinc/30/21/59/564302159.db2.gz USUBFLFQQTYWMN-MRVPVSSYSA-N 0 0 383.455 3.006 20 5 GGBDRN O=[N+]([O-])c1cccc(CN(c2nccs2)S(=O)(=O)c2ccccc2)c1 ZINC000019424493 564303203 /nfs/dbraw/zinc/30/32/03/564303203.db2.gz LIAUTRDLANYBSD-UHFFFAOYSA-N 0 0 375.431 3.447 20 5 GGBDRN NC(=O)CCSc1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120115946 564305256 /nfs/dbraw/zinc/30/52/56/564305256.db2.gz GONCESJZMRMZMQ-UHFFFAOYSA-N 0 0 379.825 3.468 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(F)cc2Br)c1 ZINC000020430706 564306810 /nfs/dbraw/zinc/30/68/10/564306810.db2.gz PIEBVRYSWJLBOR-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN CCO[C@@H](C)c1nc(Cn2cc([N+](=O)[O-])cc(Br)c2=O)cs1 ZINC000120177925 564307554 /nfs/dbraw/zinc/30/75/54/564307554.db2.gz QUHWBBLVBBZCNG-QMMMGPOBSA-N 0 0 388.243 3.121 20 5 GGBDRN CCCc1ccc(C(=O)Cn2cc([N+](=O)[O-])cc(Br)c2=O)cc1 ZINC000120185150 564307919 /nfs/dbraw/zinc/30/79/19/564307919.db2.gz MFRYGYPGYHVKEA-UHFFFAOYSA-N 0 0 379.210 3.354 20 5 GGBDRN COc1cc(CN(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])ccc1O ZINC000120181463 564308225 /nfs/dbraw/zinc/30/82/25/564308225.db2.gz DRUKMHLPILQZGQ-UHFFFAOYSA-N 0 0 395.209 3.344 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCCc2csc(C(C)C)n2)c1C ZINC000120217976 564310172 /nfs/dbraw/zinc/31/01/72/564310172.db2.gz SBXYYHGYJYWTDJ-UHFFFAOYSA-N 0 0 383.495 3.313 20 5 GGBDRN O=C(COc1ccccc1Br)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000021623176 564311005 /nfs/dbraw/zinc/31/10/05/564311005.db2.gz LFGPHSQMIOVXRG-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN Cc1nn([C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)c(C)c1[N+](=O)[O-] ZINC000021549801 564311247 /nfs/dbraw/zinc/31/12/47/564311247.db2.gz DTSVILVXBUKKDL-LBPRGKRZSA-N 0 0 395.257 3.390 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1COc2ccc(Br)cc21 ZINC000120259614 564312092 /nfs/dbraw/zinc/31/20/92/564312092.db2.gz WMXTWSGPAAPUAQ-LBPRGKRZSA-N 0 0 393.193 3.481 20 5 GGBDRN Cc1csc(CCCCNS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])n1 ZINC000120256252 564312158 /nfs/dbraw/zinc/31/21/58/564312158.db2.gz MGLMOKUIQQQNGA-UHFFFAOYSA-N 0 0 383.495 3.278 20 5 GGBDRN CN(Cc1ccccc1Br)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000022456658 564317699 /nfs/dbraw/zinc/31/76/99/564317699.db2.gz MMIPFASRUYNAIL-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN Cc1nccn1CCCCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000120411784 564319104 /nfs/dbraw/zinc/31/91/04/564319104.db2.gz HSVJQIRIYKVTRQ-UHFFFAOYSA-N 0 0 395.257 3.001 20 5 GGBDRN O=C(CSc1ncccc1[N+](=O)[O-])Nc1ccnn1Cc1cccs1 ZINC000120469542 564320476 /nfs/dbraw/zinc/32/04/76/564320476.db2.gz ZTNGFEKZFKPXAA-UHFFFAOYSA-N 0 0 375.435 3.027 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1Cn1cnc2ccc(Br)cc2c1=O ZINC000022986975 564320702 /nfs/dbraw/zinc/32/07/02/564320702.db2.gz IFBGCOYMRCZBJZ-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN Cc1nn(CC(=O)Nc2ncc(C(F)(F)F)cc2Cl)c(C)c1[N+](=O)[O-] ZINC000022986343 564321421 /nfs/dbraw/zinc/32/14/21/564321421.db2.gz SUNIFAXNLJGVCN-UHFFFAOYSA-N 0 0 377.710 3.114 20 5 GGBDRN C[C@H](NC(=O)c1cc(I)cc([N+](=O)[O-])c1)c1ccccn1 ZINC000120504303 564322489 /nfs/dbraw/zinc/32/24/89/564322489.db2.gz MUBGMCDJMAFHFH-VIFPVBQESA-N 0 0 397.172 3.085 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H](CO)Cc1ccccc1 ZINC000120557086 564325962 /nfs/dbraw/zinc/32/59/62/564325962.db2.gz QUFOBMOIDAKDDD-AWEZNQCLSA-N 0 0 380.853 3.060 20 5 GGBDRN Cc1cc(NC(=O)[C@H](C)Oc2cccnc2[N+](=O)[O-])ccc1Br ZINC000023753739 564326385 /nfs/dbraw/zinc/32/63/85/564326385.db2.gz UEJKPXZCLFJBGK-JTQLQIEISA-N 0 0 380.198 3.467 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NC1CCC(C(F)(F)F)CC1 ZINC000120611258 564328581 /nfs/dbraw/zinc/32/85/81/564328581.db2.gz FJODYQOAYOGVBR-UHFFFAOYSA-N 0 0 380.388 3.178 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000120608621 564328622 /nfs/dbraw/zinc/32/86/22/564328622.db2.gz ZMNNTAJXFDKAQB-UHFFFAOYSA-N 0 0 394.225 3.041 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000120604418 564328677 /nfs/dbraw/zinc/32/86/77/564328677.db2.gz FRFONWHBKHFJSV-QWHCGFSZSA-N 0 0 380.388 3.178 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000024570420 564331675 /nfs/dbraw/zinc/33/16/75/564331675.db2.gz YPQREPUHKJOMBF-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN CCc1nc(CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)cs1 ZINC000120693824 564332677 /nfs/dbraw/zinc/33/26/77/564332677.db2.gz PUGTYMQEOCLMKN-UHFFFAOYSA-N 0 0 384.255 3.349 20 5 GGBDRN COC(=O)C[C@H](NC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1cccs1 ZINC000025197259 564336868 /nfs/dbraw/zinc/33/68/68/564336868.db2.gz RMVHRFJCCSVXHV-LBPRGKRZSA-N 0 0 380.447 3.412 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2ccc(Br)s2)cc([N+](=O)[O-])c1 ZINC000025472500 564338625 /nfs/dbraw/zinc/33/86/25/564338625.db2.gz NPWYAYGUEQTPHH-UHFFFAOYSA-N 0 0 399.222 3.135 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000025376494 564338790 /nfs/dbraw/zinc/33/87/90/564338790.db2.gz ZZDKAOWJVRKMMF-UWVGGRQHSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000025376237 564338833 /nfs/dbraw/zinc/33/88/33/564338833.db2.gz YYHFJVKLRCIRDZ-NXEZZACHSA-N 0 0 382.360 3.003 20 5 GGBDRN O=C(c1cc(Cl)cc(Cl)c1)N1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000025496776 564339966 /nfs/dbraw/zinc/33/99/66/564339966.db2.gz BCXXLVOVGOBJMN-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)Nc2ccncc2F)cc1[N+](=O)[O-] ZINC000120847256 564340196 /nfs/dbraw/zinc/34/01/96/564340196.db2.gz QHZZXELWNXGSGS-UHFFFAOYSA-N 0 0 390.190 3.001 20 5 GGBDRN O=C(NCc1ccc(Br)s1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000025905205 564342978 /nfs/dbraw/zinc/34/29/78/564342978.db2.gz DYIIVUFASOBSDP-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN CN(CC(=O)Nc1ccc(Br)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000026345991 564345906 /nfs/dbraw/zinc/34/59/06/564345906.db2.gz QIBKDIOAZNCHDH-UHFFFAOYSA-N 0 0 378.226 3.428 20 5 GGBDRN CCNc1nnc(SCCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000026415432 564346837 /nfs/dbraw/zinc/34/68/37/564346837.db2.gz PHKVNUMCJPWADV-UHFFFAOYSA-N 0 0 383.455 3.008 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2nnc(NC3CC3)s2)cccc1[N+](=O)[O-] ZINC000026526458 564347311 /nfs/dbraw/zinc/34/73/11/564347311.db2.gz ZYCLIBIMIAATRJ-SECBINFHSA-N 0 0 379.467 3.448 20 5 GGBDRN Cc1ccc(Br)cc1S(=O)(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000026830819 564349932 /nfs/dbraw/zinc/34/99/32/564349932.db2.gz AZBSYGTZIWDYBQ-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN O=C(CNc1ccccc1Br)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026781879 564350069 /nfs/dbraw/zinc/35/00/69/564350069.db2.gz ICUFNQKCAVMTEO-UHFFFAOYSA-N 0 0 394.181 3.137 20 5 GGBDRN COc1cccc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000121050594 564350179 /nfs/dbraw/zinc/35/01/79/564350179.db2.gz ALBQBBCLFLQYDB-UHFFFAOYSA-N 0 0 393.237 3.267 20 5 GGBDRN C[C@@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000121055610 564351186 /nfs/dbraw/zinc/35/11/86/564351186.db2.gz POLRUVADWPUAAP-NSHDSACASA-N 0 0 377.447 3.114 20 5 GGBDRN CN(C(=O)[C@@H]1COc2ccc(Br)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000121080730 564351891 /nfs/dbraw/zinc/35/18/91/564351891.db2.gz LKESMPZPYQZOHY-CQSZACIVSA-N 0 0 377.194 3.496 20 5 GGBDRN COc1ccc(NC(=O)CSc2ncnc3ccsc32)c([N+](=O)[O-])c1 ZINC000026953203 564351951 /nfs/dbraw/zinc/35/19/51/564351951.db2.gz UMRNXGDESFRTGM-UHFFFAOYSA-N 0 0 376.419 3.339 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCC[C@@H]2c2ccccc2Br)c1[N+](=O)[O-] ZINC000121100271 564353134 /nfs/dbraw/zinc/35/31/34/564353134.db2.gz KYMVBWJRHQZGPV-CYBMUJFWSA-N 0 0 393.241 3.377 20 5 GGBDRN CN(Cc1ccc(Br)s1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027360006 564353438 /nfs/dbraw/zinc/35/34/38/564353438.db2.gz CCCJLINUFNEPIK-UHFFFAOYSA-N 0 0 384.255 3.150 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(c3nc(C)cs3)CC2)cc1[N+](=O)[O-] ZINC000027773680 564356351 /nfs/dbraw/zinc/35/63/51/564356351.db2.gz ZSUKSMVLZJMMKD-UHFFFAOYSA-N 0 0 378.479 3.044 20 5 GGBDRN O=C(NCCSc1ccc(Cl)cc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000027806004 564356741 /nfs/dbraw/zinc/35/67/41/564356741.db2.gz JCLZXMOPTLNDBC-UHFFFAOYSA-N 0 0 380.809 3.499 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3cc(Br)cc([N+](=O)[O-])c3)cn21 ZINC000121185842 564357772 /nfs/dbraw/zinc/35/77/72/564357772.db2.gz PPMGCBIWGIBGOG-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Br)c1 ZINC000028092093 564360873 /nfs/dbraw/zinc/36/08/73/564360873.db2.gz LVTHQZSPHLDDTB-SNVBAGLBSA-N 0 0 392.209 3.114 20 5 GGBDRN CC(C)c1nc([C@H](C)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000121266858 564361735 /nfs/dbraw/zinc/36/17/35/564361735.db2.gz VXFOUNKCJHDPIV-LBPRGKRZSA-N 0 0 383.495 3.299 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2noc(-c3cccs3)n2)cccc1[N+](=O)[O-] ZINC000121300549 564363727 /nfs/dbraw/zinc/36/37/27/564363727.db2.gz WJCGDKCCKDJJPW-UHFFFAOYSA-N 0 0 379.419 3.130 20 5 GGBDRN O=C(CN1CCN(c2cccs2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000121343332 564365174 /nfs/dbraw/zinc/36/51/74/564365174.db2.gz LXSMJFQDXXFFCF-UHFFFAOYSA-N 0 0 380.857 3.070 20 5 GGBDRN O=C(NCCCCNc1ccccn1)c1ccc([N+](=O)[O-])cc1Br ZINC000121376844 564366576 /nfs/dbraw/zinc/36/65/76/564366576.db2.gz IFTKMGXPDWBARC-UHFFFAOYSA-N 0 0 393.241 3.374 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCNc1ncc(Cl)cc1Cl ZINC000121407373 564368043 /nfs/dbraw/zinc/36/80/43/564368043.db2.gz REMJDFGLHCKDNF-UHFFFAOYSA-N 0 0 383.235 3.458 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCCC[C@@H]2c2ncc[nH]2)cc1[N+](=O)[O-] ZINC000121422514 564368784 /nfs/dbraw/zinc/36/87/84/564368784.db2.gz MNHGJYIUYDFCNX-GFCCVEGCSA-N 0 0 384.845 3.196 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000029308387 564369237 /nfs/dbraw/zinc/36/92/37/564369237.db2.gz FZAWWFREKDEDFI-UHFFFAOYSA-N 0 0 383.813 3.180 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)Cc1ccc(Br)o1 ZINC000030213548 564376352 /nfs/dbraw/zinc/37/63/52/564376352.db2.gz ZUOHTHWPGBACEO-UHFFFAOYSA-N 0 0 398.213 3.029 20 5 GGBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1ccc(Br)o1 ZINC000030213786 564377078 /nfs/dbraw/zinc/37/70/78/564377078.db2.gz XRZSQMLPLPYRIN-SNVBAGLBSA-N 0 0 382.214 3.409 20 5 GGBDRN Cc1ccc(Br)cc1NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000121602144 564377695 /nfs/dbraw/zinc/37/76/95/564377695.db2.gz GLDCJOLSTYXCLF-UHFFFAOYSA-N 0 0 378.182 3.243 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1ccccc1Br ZINC000030319446 564379139 /nfs/dbraw/zinc/37/91/39/564379139.db2.gz JIWKHJOYSHJMCV-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CC(C)N(C1CCC1)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121673867 564380607 /nfs/dbraw/zinc/38/06/07/564380607.db2.gz VLEUOGZALDUGRU-UHFFFAOYSA-N 0 0 377.260 3.309 20 5 GGBDRN CCN(CC)[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000030435282 564380723 /nfs/dbraw/zinc/38/07/23/564380723.db2.gz ITNOOVGOOPQPJS-INIZCTEOSA-N 0 0 383.495 3.018 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCc3cc(Cl)ccc32)cc1[N+](=O)[O-] ZINC000031669662 564390593 /nfs/dbraw/zinc/39/05/93/564390593.db2.gz INLFSXRMRGQNAY-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCc3cc(Cl)ccc32)c([N+](=O)[O-])c1 ZINC000031669617 564391001 /nfs/dbraw/zinc/39/10/01/564391001.db2.gz YGOLWAFDROEKGL-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(Cc2ccc(F)cc2Cl)CC1 ZINC000031785823 564392702 /nfs/dbraw/zinc/39/27/02/564392702.db2.gz LMHITHCRXFAWGB-UHFFFAOYSA-N 0 0 383.832 3.407 20 5 GGBDRN C[S@](=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000121995843 564396632 /nfs/dbraw/zinc/39/66/32/564396632.db2.gz AYULRZZOSPZWPC-JOCHJYFZSA-N 0 0 383.223 3.347 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000122034186 564397360 /nfs/dbraw/zinc/39/73/60/564397360.db2.gz HOIBWUVIFSWFKV-STQMWFEESA-N 0 0 376.862 3.072 20 5 GGBDRN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)N1CCc2sccc2C1 ZINC000032428856 564399128 /nfs/dbraw/zinc/39/91/28/564399128.db2.gz RFICZXDUWVTYGS-LLVKDONJSA-N 0 0 379.869 3.486 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCOC2(CCCC2)C1 ZINC000122266596 564407263 /nfs/dbraw/zinc/40/72/63/564407263.db2.gz RYXJDAVLWCADSV-UHFFFAOYSA-N 0 0 395.264 3.235 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)Cc2nnc(-c3ccccc3)s2)c1 ZINC000122313659 564409207 /nfs/dbraw/zinc/40/92/07/564409207.db2.gz LEKTUJZOFKLRFQ-UHFFFAOYSA-N 0 0 375.431 3.228 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@@H](C)CCCO)cc2[N+](=O)[O-])n1 ZINC000122394965 564411817 /nfs/dbraw/zinc/41/18/17/564411817.db2.gz TXKGEXGEKOMTRM-JTQLQIEISA-N 0 0 381.479 3.402 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1CCOc1ccc(Br)cc1 ZINC000033748091 564413855 /nfs/dbraw/zinc/41/38/55/564413855.db2.gz NAWXMYXTKSUYLS-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN O=C(CCCn1cc(Br)cc([N+](=O)[O-])c1=O)c1ccc(F)cc1 ZINC000122692104 564423809 /nfs/dbraw/zinc/42/38/09/564423809.db2.gz PEJSJERTBJYWHX-UHFFFAOYSA-N 0 0 383.173 3.321 20 5 GGBDRN O=C(Cc1cccc(Br)c1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122704952 564424015 /nfs/dbraw/zinc/42/40/15/564424015.db2.gz VBUPUFTZWBDCMW-UHFFFAOYSA-N 0 0 375.182 3.415 20 5 GGBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])NCCc1ccc(F)cc1 ZINC000122804346 564427624 /nfs/dbraw/zinc/42/76/24/564427624.db2.gz YGWWXKDYIUZDQW-UHFFFAOYSA-N 0 0 397.200 3.234 20 5 GGBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])N1CCc2ccccc21 ZINC000122804148 564427798 /nfs/dbraw/zinc/42/77/98/564427798.db2.gz DNGKCIGXWREIBH-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000041173851 564429971 /nfs/dbraw/zinc/42/99/71/564429971.db2.gz HMPYSKVQAWJFJE-MRXNPFEDSA-N 0 0 382.825 3.010 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000041173399 564430454 /nfs/dbraw/zinc/43/04/54/564430454.db2.gz XWFIMDKGTFXOJE-MRXNPFEDSA-N 0 0 382.825 3.010 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@@H]3CCOC3)cc2[N+](=O)[O-])n1 ZINC000041378606 564431786 /nfs/dbraw/zinc/43/17/86/564431786.db2.gz TWFFZVRYDIPTAS-NSHDSACASA-N 0 0 379.463 3.277 20 5 GGBDRN Cc1ccc(CCNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cn1 ZINC000122939113 564432457 /nfs/dbraw/zinc/43/24/57/564432457.db2.gz NVYSDWYDCXORFO-UHFFFAOYSA-N 0 0 378.226 3.342 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000122952517 564433126 /nfs/dbraw/zinc/43/31/26/564433126.db2.gz NSZUDWOBXCOFTL-UHFFFAOYSA-N 0 0 378.378 3.045 20 5 GGBDRN Cc1sc(S(=O)(=O)N2c3ccccc3N(C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000123078422 564437567 /nfs/dbraw/zinc/43/75/67/564437567.db2.gz FNLJNUOIQKPYCH-NSHDSACASA-N 0 0 381.479 3.388 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCOc2c(Cl)cccc21 ZINC000123097234 564438483 /nfs/dbraw/zinc/43/84/83/564438483.db2.gz FTQOXYULYDSQBU-UHFFFAOYSA-N 0 0 389.216 3.489 20 5 GGBDRN CC(C)(C)NS(=O)(=O)Cc1cccc(NCc2csc([N+](=O)[O-])c2)c1 ZINC000123155693 564440441 /nfs/dbraw/zinc/44/04/41/564440441.db2.gz FTYSLSDSNSPRMJ-UHFFFAOYSA-N 0 0 383.495 3.486 20 5 GGBDRN O=C(Nc1ccc(I)cc1Cl)c1cc([N+](=O)[O-])c[nH]1 ZINC000042073392 564440997 /nfs/dbraw/zinc/44/09/97/564440997.db2.gz SGYDRUXIVNYIMG-UHFFFAOYSA-N 0 0 391.552 3.433 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000123243651 564443129 /nfs/dbraw/zinc/44/31/29/564443129.db2.gz IVHVFSUBXPYDGK-UHFFFAOYSA-N 0 0 382.463 3.327 20 5 GGBDRN CN(C(=O)c1cccc(I)c1)c1ccc([N+](=O)[O-])cc1 ZINC000042294269 564444775 /nfs/dbraw/zinc/44/47/75/564444775.db2.gz LHZZGSSOHATNOU-UHFFFAOYSA-N 0 0 382.157 3.476 20 5 GGBDRN CC(C)N(CC(F)F)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000123299473 564444950 /nfs/dbraw/zinc/44/49/50/564444950.db2.gz QGRXDVFPBPMZCY-UHFFFAOYSA-N 0 0 398.147 3.315 20 5 GGBDRN CN(Cc1csc(Br)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000042304170 564445468 /nfs/dbraw/zinc/44/54/68/564445468.db2.gz KOLDGHUTAJTQMO-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@H]1Cc2ccccc21 ZINC000123357071 564446105 /nfs/dbraw/zinc/44/61/05/564446105.db2.gz LZOMVIRKVXVKJF-CYBMUJFWSA-N 0 0 375.222 3.356 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@@H]1Cc2ccccc21 ZINC000123357263 564446273 /nfs/dbraw/zinc/44/62/73/564446273.db2.gz LZOMVIRKVXVKJF-ZDUSSCGKSA-N 0 0 375.222 3.356 20 5 GGBDRN CCS(=O)(=O)N(CCc1cccs1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000123400051 564447428 /nfs/dbraw/zinc/44/74/28/564447428.db2.gz SFHZYXIPJMBEEQ-UHFFFAOYSA-N 0 0 384.479 3.059 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](COCC(C)C)c2ccco2)cc1[N+](=O)[O-] ZINC000123503496 564450467 /nfs/dbraw/zinc/45/04/67/564450467.db2.gz DWGGXCQJXBSJLI-LBPRGKRZSA-N 0 0 388.467 3.250 20 5 GGBDRN CCN(Cc1c(F)cccc1F)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000123515669 564451351 /nfs/dbraw/zinc/45/13/51/564451351.db2.gz GNXRISFZCSESRL-UHFFFAOYSA-N 0 0 376.406 3.454 20 5 GGBDRN CN(CCOc1ccc(Cl)cc1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123664222 564457095 /nfs/dbraw/zinc/45/70/95/564457095.db2.gz XERNFEBAKCJMKX-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN CN(CCOc1cccc(Cl)c1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123682980 564458162 /nfs/dbraw/zinc/45/81/62/564458162.db2.gz BPOBLMJQMPYYHC-UHFFFAOYSA-N 0 0 388.804 3.087 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)s1 ZINC000123821220 564462533 /nfs/dbraw/zinc/46/25/33/564462533.db2.gz MNOQMRTWORPCGB-MRVPVSSYSA-N 0 0 375.497 3.420 20 5 GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CCCC[C@@H]1c1ncon1 ZINC000123873286 564464152 /nfs/dbraw/zinc/46/41/52/564464152.db2.gz UAEMPJAFVGLMAN-LLVKDONJSA-N 0 0 381.186 3.108 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCCC[C@@H]1c1ncon1 ZINC000123930217 564466533 /nfs/dbraw/zinc/46/65/33/564466533.db2.gz ZTZPRRYVYIJKDK-GFCCVEGCSA-N 0 0 381.186 3.108 20 5 GGBDRN Cc1csc(C2(NS(=O)(=O)c3cc([N+](=O)[O-])c(C)s3)CCCC2)n1 ZINC000123989256 564468626 /nfs/dbraw/zinc/46/86/26/564468626.db2.gz PVZRLUSXQANSPI-UHFFFAOYSA-N 0 0 387.508 3.477 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1OCC(F)(F)F ZINC000044695898 564471182 /nfs/dbraw/zinc/47/11/82/564471182.db2.gz PFGZJUSZNDXSJD-UHFFFAOYSA-N 0 0 378.694 3.025 20 5 GGBDRN COCCN(Cc1cccs1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000044667888 564471727 /nfs/dbraw/zinc/47/17/27/564471727.db2.gz GGBSABZPILYVBH-UHFFFAOYSA-N 0 0 390.870 3.147 20 5 GGBDRN Cc1ccccc1OCCN(C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000044770833 564472189 /nfs/dbraw/zinc/47/21/89/564472189.db2.gz YVFVMCLONKTLOO-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN Cc1cc([C@H]2CCCN2S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)no1 ZINC000044783501 564472374 /nfs/dbraw/zinc/47/23/74/564472374.db2.gz IWCSJSHBZIUOMW-CQSZACIVSA-N 0 0 385.829 3.379 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000124158391 564472955 /nfs/dbraw/zinc/47/29/55/564472955.db2.gz LMUAKRSNDWISSH-SMDDNHRTSA-N 0 0 376.500 3.084 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000124158186 564473579 /nfs/dbraw/zinc/47/35/79/564473579.db2.gz LMUAKRSNDWISSH-RISCZKNCSA-N 0 0 376.500 3.084 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000124231670 564476398 /nfs/dbraw/zinc/47/63/98/564476398.db2.gz INWRJZOBMDOKDZ-UHFFFAOYSA-N 0 0 382.463 3.239 20 5 GGBDRN COc1ccc(Br)cc1Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000045022427 564477102 /nfs/dbraw/zinc/47/71/02/564477102.db2.gz BXYAUVPOSSMNHC-UHFFFAOYSA-N 0 0 379.166 3.322 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1cccc2c1OCCO2 ZINC000124548648 564485706 /nfs/dbraw/zinc/48/57/06/564485706.db2.gz VJSXNXZGAILSSL-UHFFFAOYSA-N 0 0 393.193 3.310 20 5 GGBDRN O=C(NCCNc1ncc(Cl)cc1Cl)NCc1ccccc1[N+](=O)[O-] ZINC000045621023 564487097 /nfs/dbraw/zinc/48/70/97/564487097.db2.gz QHQBMMGZALGDJM-UHFFFAOYSA-N 0 0 384.223 3.208 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCSc2ccc(Cl)cc2)cc1 ZINC000045798138 564489416 /nfs/dbraw/zinc/48/94/16/564489416.db2.gz RHFHBBRQPZIDAX-UHFFFAOYSA-N 0 0 386.882 3.460 20 5 GGBDRN Cc1cccc(C(=O)NCc2ccccc2[N+](=O)[O-])c1I ZINC000046149948 564496205 /nfs/dbraw/zinc/49/62/05/564496205.db2.gz NSDWGAFWTUYHDH-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cccc(I)c1 ZINC000046146851 564496538 /nfs/dbraw/zinc/49/65/38/564496538.db2.gz BRWGUBQLPWDBAD-UHFFFAOYSA-N 0 0 382.157 3.129 20 5 GGBDRN COCCC1(CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000124965300 564499022 /nfs/dbraw/zinc/49/90/22/564499022.db2.gz VUSUKLJVQBIDJC-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(N)=O)c(Cl)c1 ZINC000046241963 564499836 /nfs/dbraw/zinc/49/98/36/564499836.db2.gz VRZQLESZEFAWJY-SECBINFHSA-N 0 0 379.825 3.466 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)cc1[N+](=O)[O-] ZINC000125048443 564500644 /nfs/dbraw/zinc/50/06/44/564500644.db2.gz ASAZTEJBCKDEDZ-GDLCADMTSA-N 0 0 383.242 3.209 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCOC[C@H]3C)cc2[N+](=O)[O-])n1 ZINC000046258634 564500699 /nfs/dbraw/zinc/50/06/99/564500699.db2.gz VYOGHLLJVOAKMT-LLVKDONJSA-N 0 0 379.463 3.372 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2cc(F)c(F)cc2Cl)ccc1[N+](=O)[O-] ZINC000125090512 564502813 /nfs/dbraw/zinc/50/28/13/564502813.db2.gz DHXCNUZNVMXRAM-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN O=C(NCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1Cl ZINC000046686550 564505521 /nfs/dbraw/zinc/50/55/21/564505521.db2.gz FPBRWQFLBHGWMP-UHFFFAOYSA-N 0 0 382.203 3.061 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000046736174 564506167 /nfs/dbraw/zinc/50/61/67/564506167.db2.gz CORUCRFVTHXMOI-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCSC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000125206426 564506410 /nfs/dbraw/zinc/50/64/10/564506410.db2.gz ZHMKORBYVQHQPF-UHFFFAOYSA-N 0 0 376.525 3.405 20 5 GGBDRN C[C@H](Cc1ccc(Br)cc1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000047027040 564511834 /nfs/dbraw/zinc/51/18/34/564511834.db2.gz INYGYDLXUQRRJJ-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN O=C(NCCOc1ccc(Br)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000125454982 564514781 /nfs/dbraw/zinc/51/47/81/564514781.db2.gz HMMZVHDUVDHPFV-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N(Cc1ccncc1)C1CC1 ZINC000125473758 564515694 /nfs/dbraw/zinc/51/56/94/564515694.db2.gz OMMPOBYJJMXJKV-UHFFFAOYSA-N 0 0 390.237 3.486 20 5 GGBDRN Cc1cccn2cc(CNC(=O)c3cc(Br)cc([N+](=O)[O-])c3)nc12 ZINC000125505822 564516748 /nfs/dbraw/zinc/51/67/48/564516748.db2.gz CUNNNOCTMSVYNT-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN CSc1nsc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000125494167 564516806 /nfs/dbraw/zinc/51/68/06/564516806.db2.gz QQQUVKJBSULYFJ-UHFFFAOYSA-N 0 0 375.229 3.183 20 5 GGBDRN Cc1cc([C@@H]2CCCN2S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)on1 ZINC000047281247 564517141 /nfs/dbraw/zinc/51/71/41/564517141.db2.gz UYWGTXALQLLJGD-ZDUSSCGKSA-N 0 0 385.829 3.379 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000125526256 564517340 /nfs/dbraw/zinc/51/73/40/564517340.db2.gz HOAWCWACVAEDFU-ZANVPECISA-N 0 0 388.492 3.177 20 5 GGBDRN COc1ccc(CN(c2ccc(Cl)cc2F)S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000047370089 564518856 /nfs/dbraw/zinc/51/88/56/564518856.db2.gz ZPHGSODRSUMJBK-UHFFFAOYSA-N 0 0 388.804 3.362 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCCn1nnc(-c2ccc(Br)cc2)n1 ZINC000047370019 564519312 /nfs/dbraw/zinc/51/93/12/564519312.db2.gz NTUCHOOHSBIHTD-UHFFFAOYSA-N 0 0 390.197 3.090 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC[C@@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000125602275 564519577 /nfs/dbraw/zinc/51/95/77/564519577.db2.gz YZWXJJWVDQXXMQ-CQSZACIVSA-N 0 0 381.479 3.230 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NCc2csc([N+](=O)[O-])c2)c1 ZINC000125603742 564519905 /nfs/dbraw/zinc/51/99/05/564519905.db2.gz XHSTYKBLLNBDLI-LBPRGKRZSA-N 0 0 383.495 3.486 20 5 GGBDRN O=C(NCCSC(F)(F)F)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047425159 564520896 /nfs/dbraw/zinc/52/08/96/564520896.db2.gz QQTIPUPSBOXARC-UHFFFAOYSA-N 0 0 377.388 3.180 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2csc(-c3ccco3)n2)cc1[N+](=O)[O-] ZINC000125611115 564521075 /nfs/dbraw/zinc/52/10/75/564521075.db2.gz AEYQXTSUXIJSDU-UHFFFAOYSA-N 0 0 385.448 3.160 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCc3c([nH]c4ccccc43)C2)cc1[N+](=O)[O-] ZINC000125785009 564526644 /nfs/dbraw/zinc/52/66/44/564526644.db2.gz BOBRHPJROOGCOR-UHFFFAOYSA-N 0 0 377.447 3.193 20 5 GGBDRN COc1ccc(Br)c(C(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000125937635 564530945 /nfs/dbraw/zinc/53/09/45/564530945.db2.gz YWOLHFQRRWGECB-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN CN1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)c2ccccc21 ZINC000125940326 564531919 /nfs/dbraw/zinc/53/19/19/564531919.db2.gz PEHRIFNNWOBFLE-UHFFFAOYSA-N 0 0 376.210 3.454 20 5 GGBDRN COc1ccc(Br)cc1Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000048439696 564539605 /nfs/dbraw/zinc/53/96/05/564539605.db2.gz LFGOKIDLLAAXRM-UHFFFAOYSA-N 0 0 391.019 3.373 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H]1c1ccccc1Br ZINC000126212369 564540755 /nfs/dbraw/zinc/54/07/55/564540755.db2.gz PWQKLAZVFXTSIN-GFCCVEGCSA-N 0 0 379.214 3.068 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)CCO2 ZINC000126271195 564543147 /nfs/dbraw/zinc/54/31/47/564543147.db2.gz CGQAJJJRBIZLOZ-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN COc1ccc(Cl)cc1CS(=O)(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000048720596 564544333 /nfs/dbraw/zinc/54/43/33/564544333.db2.gz KQHKSJJGLGAJQP-UHFFFAOYSA-N 0 0 385.825 3.380 20 5 GGBDRN CC[C@H](C)Oc1cc(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)ccn1 ZINC000126305929 564544989 /nfs/dbraw/zinc/54/49/89/564544989.db2.gz DCCIUYGZUTZFJF-JTQLQIEISA-N 0 0 385.467 3.016 20 5 GGBDRN O=C(NCCc1cccc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000048942436 564547611 /nfs/dbraw/zinc/54/76/11/564547611.db2.gz HGPXJGBPTXEUTF-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN CN(CC(=O)Nc1cc(Br)ccc1O)c1ccccc1[N+](=O)[O-] ZINC000126487356 564550487 /nfs/dbraw/zinc/55/04/87/564550487.db2.gz UQKNAYDWLLFEOT-UHFFFAOYSA-N 0 0 380.198 3.138 20 5 GGBDRN COc1cc(F)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000126505874 564551172 /nfs/dbraw/zinc/55/11/72/564551172.db2.gz KQXLMZASTGTCPY-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN O=C(Nc1nccn1Cc1ccc(Br)cc1)c1ccc([N+](=O)[O-])o1 ZINC000126746000 564561157 /nfs/dbraw/zinc/56/11/57/564561157.db2.gz XXGDSXKPEWEUBA-UHFFFAOYSA-N 0 0 391.181 3.447 20 5 GGBDRN CN(CCc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1ccccc1Br ZINC000051533575 564565165 /nfs/dbraw/zinc/56/51/65/564565165.db2.gz WNLNEOKLFDVHFU-UHFFFAOYSA-N 0 0 392.253 3.470 20 5 GGBDRN CC(C)c1nc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cs1 ZINC000051824277 564566730 /nfs/dbraw/zinc/56/67/30/564566730.db2.gz RHXSYWJCDGDEKY-UHFFFAOYSA-N 0 0 380.495 3.194 20 5 GGBDRN O=C(CSc1nncn1CC(F)(F)F)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000051974496 564568158 /nfs/dbraw/zinc/56/81/58/564568158.db2.gz CVGVTEMJBVIGLK-UHFFFAOYSA-N 0 0 395.750 3.133 20 5 GGBDRN Cc1ccc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)s1 ZINC000052357346 564570732 /nfs/dbraw/zinc/57/07/32/564570732.db2.gz OXZCFFRROXWHPC-UHFFFAOYSA-N 0 0 381.479 3.361 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)o1 ZINC000127177826 564576196 /nfs/dbraw/zinc/57/61/96/564576196.db2.gz YZXACMWRSXBEIA-LBPRGKRZSA-N 0 0 386.451 3.230 20 5 GGBDRN O=C(CCSc1nnc(N2CCCC2)s1)Nc1ccc([N+](=O)[O-])cc1 ZINC000052911594 564578232 /nfs/dbraw/zinc/57/82/32/564578232.db2.gz HVYAGMSOHKKRNG-UHFFFAOYSA-N 0 0 379.467 3.167 20 5 GGBDRN O=C(CSc1nnc(N2CCCC2)s1)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000052912002 564578426 /nfs/dbraw/zinc/57/84/26/564578426.db2.gz IHPPJNXUHILACV-UHFFFAOYSA-N 0 0 399.885 3.431 20 5 GGBDRN C[C@H](Sc1nnc(N2CCCC2)s1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000052911735 564578497 /nfs/dbraw/zinc/57/84/97/564578497.db2.gz ZNOMWJGDVFYOLQ-JTQLQIEISA-N 0 0 379.467 3.166 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ncccc1Br ZINC000127431087 564583548 /nfs/dbraw/zinc/58/35/48/564583548.db2.gz JBGSPGJIVAFQBC-UHFFFAOYSA-N 0 0 398.238 3.492 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)C(N)=O ZINC000053326067 564585055 /nfs/dbraw/zinc/58/50/55/564585055.db2.gz CRVZQDWGEGCRDC-VIFPVBQESA-N 0 0 379.825 3.003 20 5 GGBDRN COc1ccc(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)cc1Br ZINC000127509046 564586503 /nfs/dbraw/zinc/58/65/03/564586503.db2.gz IEXMEAOSHTUFIP-UHFFFAOYSA-N 0 0 379.166 3.322 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ncc(-c2ccccc2F)o1 ZINC000127573808 564588941 /nfs/dbraw/zinc/58/89/41/564588941.db2.gz LTSVMYUWDBDUQC-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1cc(-c2ccccc2)on1 ZINC000127603572 564590007 /nfs/dbraw/zinc/59/00/07/564590007.db2.gz RKFAVIIQVBPYOR-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN CNC(=O)c1ccc(N(C)Cc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000053549527 564590305 /nfs/dbraw/zinc/59/03/05/564590305.db2.gz RWSVOFWVGOMTMF-UHFFFAOYSA-N 0 0 378.226 3.353 20 5 GGBDRN Cc1cc(OCC(=O)NCc2cc(Br)cs2)ccc1[N+](=O)[O-] ZINC000053541672 564590442 /nfs/dbraw/zinc/59/04/42/564590442.db2.gz LCAWQUMHZUKOTJ-UHFFFAOYSA-N 0 0 385.239 3.422 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@@H]1[C@H]2Cc3ccccc3[C@@H]12 ZINC000127639072 564590754 /nfs/dbraw/zinc/59/07/54/564590754.db2.gz ZSOSIGPQZPIGLV-BMGDILEWSA-N 0 0 387.233 3.354 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)c2c(Cl)cccc2Cl)cc1 ZINC000053671602 564593018 /nfs/dbraw/zinc/59/30/18/564593018.db2.gz RDVPBNRTAGEUJT-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccc(F)cc1C(F)(F)F ZINC000127750886 564594388 /nfs/dbraw/zinc/59/43/88/564594388.db2.gz FTWZUKHJDUDPAF-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN O=C(Cn1cnc([N+](=O)[O-])n1)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1 ZINC000053834931 564594667 /nfs/dbraw/zinc/59/46/67/564594667.db2.gz BOQCGGBYOYOZKT-UHFFFAOYSA-N 0 0 399.219 3.255 20 5 GGBDRN COc1ccc(Br)cc1-c1nc(Cn2cnc([N+](=O)[O-])n2)cs1 ZINC000053835307 564594711 /nfs/dbraw/zinc/59/47/11/564594711.db2.gz KUKNPZDTZHVESG-UHFFFAOYSA-N 0 0 396.226 3.129 20 5 GGBDRN CCC[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)c1ccc(Cl)cc1Cl ZINC000053835104 564595177 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3.307 20 5 GGBDRN O=C(Nc1ccc(F)cc1I)c1ccc([N+](=O)[O-])o1 ZINC000127929943 564600424 /nfs/dbraw/zinc/60/04/24/564600424.db2.gz UXYQLLMTKRRWOF-UHFFFAOYSA-N 0 0 376.081 3.184 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000127997845 564603832 /nfs/dbraw/zinc/60/38/32/564603832.db2.gz DAFFWDWJVYGQCR-GFCCVEGCSA-N 0 0 393.241 3.029 20 5 GGBDRN O=C(CN1CCN(c2ccc([N+](=O)[O-])s2)CC1)Nc1ccccc1Cl ZINC000054389568 564604810 /nfs/dbraw/zinc/60/48/10/564604810.db2.gz FYXVTKONYKNDKH-UHFFFAOYSA-N 0 0 380.857 3.070 20 5 GGBDRN CS(=O)(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1Cl ZINC000054709563 564608301 /nfs/dbraw/zinc/60/83/01/564608301.db2.gz HXSHTKDOYCPXNH-UHFFFAOYSA-N 0 0 387.776 3.011 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCCSc2nnnn2Cc2cccs2)cc1 ZINC000054915829 564611628 /nfs/dbraw/zinc/61/16/28/564611628.db2.gz LZNDKLUXCULLSC-UHFFFAOYSA-N 0 0 377.451 3.252 20 5 GGBDRN CCc1ccc(-c2noc(Cn3cc(Br)c([N+](=O)[O-])n3)n2)cc1 ZINC000054919411 564612681 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O=C(c1cccc(Cn2cc(Br)c([N+](=O)[O-])n2)c1)N1CCCCC1 ZINC000054917384 564613039 /nfs/dbraw/zinc/61/30/39/564613039.db2.gz AKQXXDQNGGCHTC-UHFFFAOYSA-N 0 0 393.241 3.228 20 5 GGBDRN CN(CCCOc1ccc(Cl)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000055283810 564619110 /nfs/dbraw/zinc/61/91/10/564619110.db2.gz MWSNZEUIELWGAA-UHFFFAOYSA-N 0 0 384.841 3.338 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc2c(c(Br)c1)OCO2 ZINC000055340873 564620158 /nfs/dbraw/zinc/62/01/58/564620158.db2.gz LLTSPWCJWVWQSQ-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN CCC(CC)(CNC(=O)c1ccc([N+](=O)[O-])cc1Br)C(=O)OC ZINC000128607859 564623716 /nfs/dbraw/zinc/62/37/16/564623716.db2.gz SJFZQEWGZCSKQF-UHFFFAOYSA-N 0 0 387.230 3.067 20 5 GGBDRN CCC(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000055622218 564626586 /nfs/dbraw/zinc/62/65/86/564626586.db2.gz VZCIMNRNSQNVOQ-UHFFFAOYSA-N 0 0 383.813 3.398 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(OC(F)F)c(F)c2)cc1[N+](=O)[O-] ZINC000055638298 564627408 /nfs/dbraw/zinc/62/74/08/564627408.db2.gz PQUVAYPNZRKRGF-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(CCc2cccs2)CC1 ZINC000055642648 564627529 /nfs/dbraw/zinc/62/75/29/564627529.db2.gz RWDZCWIWKGBIFD-UHFFFAOYSA-N 0 0 379.869 3.310 20 5 GGBDRN COCc1cc(Sc2ccc(Br)cc2[N+](=O)[O-])n2ncnc2n1 ZINC000128769603 564629077 /nfs/dbraw/zinc/62/90/77/564629077.db2.gz ZTRFSYQNPLQMCV-UHFFFAOYSA-N 0 0 396.226 3.093 20 5 GGBDRN COc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cc(OC)c1Br ZINC000055797849 564631885 /nfs/dbraw/zinc/63/18/85/564631885.db2.gz KMCYXJBTTNHMEJ-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=C(COc1ccc(F)cc1Br)NCc1ccc([N+](=O)[O-])cc1 ZINC000055796765 564631975 /nfs/dbraw/zinc/63/19/75/564631975.db2.gz NTKFDHSQZTVQCQ-UHFFFAOYSA-N 0 0 383.173 3.192 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000055904744 564634167 /nfs/dbraw/zinc/63/41/67/564634167.db2.gz UWANLPBHPFTJSL-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN O=C(N[C@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1Br ZINC000128929633 564634224 /nfs/dbraw/zinc/63/42/24/564634224.db2.gz IPLJMPJZTLHGDY-OAHLLOKOSA-N 0 0 379.210 3.211 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1CCCOC1 ZINC000055921584 564634529 /nfs/dbraw/zinc/63/45/29/564634529.db2.gz DEIHNIFSZKPRMU-JTQLQIEISA-N 0 0 378.372 3.249 20 5 GGBDRN COCCN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000055956228 564635153 /nfs/dbraw/zinc/63/51/53/564635153.db2.gz CBUZYIMKQSMCLG-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(Br)s2)c(F)c1 ZINC000056039840 564637828 /nfs/dbraw/zinc/63/78/28/564637828.db2.gz ZRDNFFBJQVYMEX-UHFFFAOYSA-N 0 0 395.231 3.036 20 5 GGBDRN CN(CCOc1cccc(Cl)c1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000129098817 564638075 /nfs/dbraw/zinc/63/80/75/564638075.db2.gz YPQIZJCWDFROQD-UHFFFAOYSA-N 0 0 390.870 3.228 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000056077151 564640700 /nfs/dbraw/zinc/64/07/00/564640700.db2.gz BZILUFLDFINEIZ-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1cc(Br)cs1 ZINC000056094497 564641069 /nfs/dbraw/zinc/64/10/69/564641069.db2.gz HVBUKZIOJVAJPU-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1cc(Br)cs1 ZINC000056094579 564641346 /nfs/dbraw/zinc/64/13/46/564641346.db2.gz AGYASXFPJZUAAP-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN C[C@H](NS(=O)(=O)c1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000056108767 564641374 /nfs/dbraw/zinc/64/13/74/564641374.db2.gz JTJKAUUOGJKJDO-JTQLQIEISA-N 0 0 385.239 3.397 20 5 GGBDRN COc1ccc(F)cc1[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000056098542 564641410 /nfs/dbraw/zinc/64/14/10/564641410.db2.gz RAWVISKGNFYRDY-VIFPVBQESA-N 0 0 388.804 3.435 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000056126808 564642124 /nfs/dbraw/zinc/64/21/24/564642124.db2.gz ANHMILYCNUADNU-OAHLLOKOSA-N 0 0 382.825 3.010 20 5 GGBDRN Nc1c(C(=O)NCc2ccc(F)cc2Br)cc(F)cc1[N+](=O)[O-] ZINC000056191098 564644086 /nfs/dbraw/zinc/64/40/86/564644086.db2.gz LHWNIPYFVCNADT-UHFFFAOYSA-N 0 0 386.152 3.148 20 5 GGBDRN CSCC[C@@H](C)N(C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000129301544 564644244 /nfs/dbraw/zinc/64/42/44/564644244.db2.gz AGYBVHRCTFEGHV-SECBINFHSA-N 0 0 397.316 3.119 20 5 GGBDRN CSCC[C@H](C)N(C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000129301345 564644641 /nfs/dbraw/zinc/64/46/41/564644641.db2.gz AGYBVHRCTFEGHV-VIFPVBQESA-N 0 0 397.316 3.119 20 5 GGBDRN Cc1cnc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c(Br)c1 ZINC000129462476 564649430 /nfs/dbraw/zinc/64/94/30/564649430.db2.gz XUMSHXVECNGFIN-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN CCC[C@@H]1SCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000129448429 564649556 /nfs/dbraw/zinc/64/95/56/564649556.db2.gz MYRLCZQULXHQMI-LBPRGKRZSA-N 0 0 384.401 3.477 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1Br ZINC000129498934 564650283 /nfs/dbraw/zinc/65/02/83/564650283.db2.gz SKJJXTGSENCVQX-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN Cc1c(Cl)cc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000129489415 564650324 /nfs/dbraw/zinc/65/03/24/564650324.db2.gz VYPLEHROJVXFHA-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN CCC[C@@H]1SCCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000129479379 564650499 /nfs/dbraw/zinc/65/04/99/564650499.db2.gz BSOPEVGHCZXVKA-LBPRGKRZSA-N 0 0 395.300 3.221 20 5 GGBDRN Cc1ccn(CC(=O)N(C)Cc2cc(Cl)cc(Cl)c2)c(=O)c1[N+](=O)[O-] ZINC000129542428 564652040 /nfs/dbraw/zinc/65/20/40/564652040.db2.gz USZXNBAWPCCJHC-UHFFFAOYSA-N 0 0 384.219 3.030 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NCc1cc(Br)ccc1F ZINC000057004220 564655873 /nfs/dbraw/zinc/65/58/73/564655873.db2.gz OUJWNWGNYUBWIG-UHFFFAOYSA-N 0 0 382.189 3.496 20 5 GGBDRN O=C(NCCNc1ncc(Cl)cc1Cl)NCc1ccc([N+](=O)[O-])cc1 ZINC000057004678 564656142 /nfs/dbraw/zinc/65/61/42/564656142.db2.gz SITVTSMYFSLBJR-UHFFFAOYSA-N 0 0 384.223 3.208 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCOc3c(Cl)cccc32)c(F)c1 ZINC000057010763 564657185 /nfs/dbraw/zinc/65/71/85/564657185.db2.gz PFWQVKDRIOYSQD-CYBMUJFWSA-N 0 0 386.788 3.189 20 5 GGBDRN Cc1cc(Br)ccc1N(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000057021299 564657391 /nfs/dbraw/zinc/65/73/91/564657391.db2.gz SYJBBZYCURGUQR-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN Cc1nn(C)c(NC[C@@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000057151230 564662778 /nfs/dbraw/zinc/66/27/78/564662778.db2.gz FSSBCVJDGUDZSQ-LBPRGKRZSA-N 0 0 394.273 3.338 20 5 GGBDRN Cc1nccn1CCCCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000129892552 564663797 /nfs/dbraw/zinc/66/37/97/564663797.db2.gz JDRFARVCOZWKQW-UHFFFAOYSA-N 0 0 381.230 3.072 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@H]1CCSc2ccc(F)cc21 ZINC000129895627 564663900 /nfs/dbraw/zinc/66/39/00/564663900.db2.gz NACPTGZOESFJLY-AWEZNQCLSA-N 0 0 382.438 3.390 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H]1CCSc2ccc(F)cc21 ZINC000129895415 564664198 /nfs/dbraw/zinc/66/41/98/564664198.db2.gz NACPTGZOESFJLY-CQSZACIVSA-N 0 0 382.438 3.390 20 5 GGBDRN Cc1nn(Cc2nc(-c3cc(Br)cs3)no2)c(C)c1[N+](=O)[O-] ZINC000057465861 564668542 /nfs/dbraw/zinc/66/85/42/564668542.db2.gz RHXRZSLZALCYMA-UHFFFAOYSA-N 0 0 384.215 3.330 20 5 GGBDRN CC(C)(C)c1nc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cs1 ZINC000130142889 564670535 /nfs/dbraw/zinc/67/05/35/564670535.db2.gz YDKAOYRNKYGUTQ-UHFFFAOYSA-N 0 0 387.458 3.009 20 5 GGBDRN O=C(NCCOc1ncc(C(F)(F)F)cc1Cl)c1ccc([N+](=O)[O-])o1 ZINC000130163950 564671891 /nfs/dbraw/zinc/67/18/91/564671891.db2.gz XRRAROVQEOHMMO-UHFFFAOYSA-N 0 0 379.678 3.064 20 5 GGBDRN O=C(c1ccc(I)cc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000057835158 564675276 /nfs/dbraw/zinc/67/52/76/564675276.db2.gz FKWBFABYIZNNBQ-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(CCO)Cc2cc(Br)ccc2F)cc1 ZINC000057842105 564675568 /nfs/dbraw/zinc/67/55/68/564675568.db2.gz WSFAISHIBQELKR-UHFFFAOYSA-N 0 0 383.217 3.491 20 5 GGBDRN Cc1cc(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)sn1 ZINC000130353128 564678261 /nfs/dbraw/zinc/67/82/61/564678261.db2.gz LXCWJWVJWHLHSG-UHFFFAOYSA-N 0 0 389.174 3.217 20 5 GGBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1cccc(O)c1 ZINC000130428299 564681245 /nfs/dbraw/zinc/68/12/45/564681245.db2.gz TZOPUIAPGIDUDW-SNVBAGLBSA-N 0 0 379.210 3.483 20 5 GGBDRN C[C@@H](C(=O)NC1CCCC1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000058282564 564681392 /nfs/dbraw/zinc/68/13/92/564681392.db2.gz NGSVBRFJMPVDEC-NSHDSACASA-N 0 0 396.285 3.163 20 5 GGBDRN O=C(CCOc1ccccc1Br)NCc1ccccc1[N+](=O)[O-] ZINC000058388307 564683662 /nfs/dbraw/zinc/68/36/62/564683662.db2.gz JNFWXUPSTWPHOE-UHFFFAOYSA-N 0 0 379.210 3.443 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000130542356 564684951 /nfs/dbraw/zinc/68/49/51/564684951.db2.gz RDVQGIUEHJYYHA-UHFFFAOYSA-N 0 0 381.230 3.025 20 5 GGBDRN CN(C(=O)CCS(=O)(=O)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000058520238 564685074 /nfs/dbraw/zinc/68/50/74/564685074.db2.gz IHMAZFRYPVKHDA-UHFFFAOYSA-N 0 0 382.825 3.075 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2sccc2Br)cc1 ZINC000058510857 564685245 /nfs/dbraw/zinc/68/52/45/564685245.db2.gz BURWOABYVDVQBH-UHFFFAOYSA-N 0 0 391.268 3.038 20 5 GGBDRN O=c1[nH]cnc2cc(NCc3sccc3Br)c([N+](=O)[O-])cc12 ZINC000058555476 564685430 /nfs/dbraw/zinc/68/54/30/564685430.db2.gz IKPYRPXVMGRWBX-UHFFFAOYSA-N 0 0 381.211 3.267 20 5 GGBDRN NS(=O)(=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000058573720 564686160 /nfs/dbraw/zinc/68/61/60/564686160.db2.gz CTEAKPBOJHEBQN-UHFFFAOYSA-N 0 0 377.205 3.128 20 5 GGBDRN NS(=O)(=O)c1ccc(OCc2ccc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000058573719 564686398 /nfs/dbraw/zinc/68/63/98/564686398.db2.gz DDQLKWCBVHZRHJ-UHFFFAOYSA-N 0 0 377.205 3.128 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1ccc(F)c(Br)c1 ZINC000130593507 564686732 /nfs/dbraw/zinc/68/67/32/564686732.db2.gz BJQKQXMMJIPEGS-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN CC(C)c1nc2c(n1C)CCN(c1ncc(Br)cc1[N+](=O)[O-])C2 ZINC000130621997 564687093 /nfs/dbraw/zinc/68/70/93/564687093.db2.gz YBKGKTZYOOOVNF-UHFFFAOYSA-N 0 0 380.246 3.172 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(CS(C)(=O)=O)c2)c1 ZINC000058735289 564688299 /nfs/dbraw/zinc/68/82/99/564688299.db2.gz IWCBFTYGYXCKLD-UHFFFAOYSA-N 0 0 380.447 3.114 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000130766093 564691353 /nfs/dbraw/zinc/69/13/53/564691353.db2.gz AYPAJBMPDIWCGK-WFASDCNBSA-N 0 0 382.463 3.115 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCSc3c(F)cccc32)cc1 ZINC000130766467 564691588 /nfs/dbraw/zinc/69/15/88/564691588.db2.gz JSZVEBJEKKPSHD-HNNXBMFYSA-N 0 0 382.438 3.390 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc(F)cc(Br)c1 ZINC000058941797 564691865 /nfs/dbraw/zinc/69/18/65/564691865.db2.gz KRJYWFXZJFTWGV-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000130762799 564691845 /nfs/dbraw/zinc/69/18/45/564691845.db2.gz BEEBONPYYPQOLF-ABAIWWIYSA-N 0 0 382.463 3.115 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000059292220 564692303 /nfs/dbraw/zinc/69/23/03/564692303.db2.gz BVZIRJADXFQSAE-UHFFFAOYSA-N 0 0 379.825 3.251 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1ccc(F)cc1Br ZINC000130797109 564692330 /nfs/dbraw/zinc/69/23/30/564692330.db2.gz ZVLKXKXCIJEEKY-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN Cc1ccc(NCCCNC(=O)CSCc2cscn2)c([N+](=O)[O-])c1 ZINC000130923030 564695475 /nfs/dbraw/zinc/69/54/75/564695475.db2.gz IMQAIWRCKVMMOL-UHFFFAOYSA-N 0 0 380.495 3.211 20 5 GGBDRN Cn1nc(Br)c2c1ncnc2Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000060378695 564697530 /nfs/dbraw/zinc/69/75/30/564697530.db2.gz TYZARGDLSUIVNK-UHFFFAOYSA-N 0 0 384.577 3.480 20 5 GGBDRN COc1ccc(Br)cc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000062514577 564712441 /nfs/dbraw/zinc/71/24/41/564712441.db2.gz XKBXKLNBKGCWGX-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN COCCN(CC(F)(F)F)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 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388.205 3.318 20 5 GGBDRN CCS[C@H]1CC[C@H](N(C)C(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000131701075 564721394 /nfs/dbraw/zinc/72/13/94/564721394.db2.gz SLJJCJVFXFXDTO-JQWIXIFHSA-N 0 0 385.873 3.319 20 5 GGBDRN O=C(NCc1cc2c(c(Br)c1)OCO2)c1ccc([N+](=O)[O-])s1 ZINC000063715319 564721713 /nfs/dbraw/zinc/72/17/13/564721713.db2.gz VOGSOCXQNVAYDT-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN Cc1c(C(=O)NCc2cc3c(c(Br)c2)OCO3)cccc1[N+](=O)[O-] ZINC000063716089 564721835 /nfs/dbraw/zinc/72/18/35/564721835.db2.gz NDIMKEWRAFRRHN-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1cccc(Br)c1 ZINC000063764313 564722331 /nfs/dbraw/zinc/72/23/31/564722331.db2.gz QDDMALSZIWQMGL-UHFFFAOYSA-N 0 0 399.266 3.398 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCCOc1ccc(F)cc1 ZINC000063766591 564722826 /nfs/dbraw/zinc/72/28/26/564722826.db2.gz NYWJQIZZWWTODY-UHFFFAOYSA-N 0 0 388.804 3.135 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3cn4cc(Br)ccc4n3)n2)cc1 ZINC000131768568 564723164 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/nfs/dbraw/zinc/78/88/68/564788868.db2.gz NUSXPFMKRQBBOC-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN Cc1nn(Cc2nc(Cc3cccc(Br)c3)no2)c(C)c1[N+](=O)[O-] ZINC000067428134 564792225 /nfs/dbraw/zinc/79/22/25/564792225.db2.gz GDVJVUSCPWZVSC-UHFFFAOYSA-N 0 0 392.213 3.193 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C)C2CCC(CO)CC2)cc1[N+](=O)[O-] ZINC000134083912 564793348 /nfs/dbraw/zinc/79/33/48/564793348.db2.gz AFQWRAHWXUSLLQ-UHFFFAOYSA-N 0 0 385.258 3.289 20 5 GGBDRN C[C@H](CC(=O)c1ccccc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000134156614 564795573 /nfs/dbraw/zinc/79/55/73/564795573.db2.gz KGZPRFKLDUSYOO-LLVKDONJSA-N 0 0 382.825 3.188 20 5 GGBDRN CCN(C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000067823084 564799471 /nfs/dbraw/zinc/79/94/71/564799471.db2.gz BNLJYUJVTXKCIQ-UHFFFAOYSA-N 0 0 394.225 3.357 20 5 GGBDRN COc1ccc(CC(=O)NCc2cc(Br)cs2)cc1[N+](=O)[O-] ZINC000067815751 564799742 /nfs/dbraw/zinc/79/97/42/564799742.db2.gz ZPCLODXRINTGQK-UHFFFAOYSA-N 0 0 385.239 3.286 20 5 GGBDRN COc1ccc(CC(=O)N2CCc3cc(Br)ccc32)cc1[N+](=O)[O-] ZINC000067820183 564799788 /nfs/dbraw/zinc/79/97/88/564799788.db2.gz MUGMLRNHIGQRNT-UHFFFAOYSA-N 0 0 391.221 3.498 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@H](c2ccc(Br)cc2)C1 ZINC000067826921 564799971 /nfs/dbraw/zinc/79/99/71/564799971.db2.gz GCDCMNNXUMDVBX-ZDUSSCGKSA-N 0 0 381.182 3.164 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000067813635 564800000 /nfs/dbraw/zinc/80/00/00/564800000.db2.gz NVBZXFNLXCXMDR-ZETCQYMHSA-N 0 0 375.187 3.423 20 5 GGBDRN CN(Cc1ccc(Br)o1)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000067794881 564800010 /nfs/dbraw/zinc/80/00/10/564800010.db2.gz WPDHUZIYIOYZGQ-UHFFFAOYSA-N 0 0 383.198 3.378 20 5 GGBDRN CN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(Br)cn1 ZINC000067832064 564800024 /nfs/dbraw/zinc/80/00/24/564800024.db2.gz MUHGZXHJLFUNKX-UHFFFAOYSA-N 0 0 389.209 3.370 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000134460949 564803973 /nfs/dbraw/zinc/80/39/73/564803973.db2.gz MHRAMQTZQRFWBJ-XJKCOSOUSA-N 0 0 378.837 3.112 20 5 GGBDRN O=[N+]([O-])c1cc(C[S@@](=O)Cc2csc(C3CC3)n2)c2c(c1)COCO2 ZINC000134516308 564805404 /nfs/dbraw/zinc/80/54/04/564805404.db2.gz UJGZYEAODREGEY-VWLOTQADSA-N 0 0 380.447 3.244 20 5 GGBDRN CSc1ccc(OCCn2cc([N+](=O)[O-])cc(Br)c2=O)cc1 ZINC000134542235 564807018 /nfs/dbraw/zinc/80/70/18/564807018.db2.gz DYCDUVKNMCBUEQ-UHFFFAOYSA-N 0 0 385.239 3.320 20 5 GGBDRN Cn1cc(Br)cc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000068104716 564808765 /nfs/dbraw/zinc/80/87/65/564808765.db2.gz UTQSTXJNIVKBJX-UHFFFAOYSA-N 0 0 390.197 3.134 20 5 GGBDRN Cc1noc(NC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)n1 ZINC000134650022 564811147 /nfs/dbraw/zinc/81/11/47/564811147.db2.gz NHYSQSUYZBBFBU-UHFFFAOYSA-N 0 0 383.151 3.031 20 5 GGBDRN COc1ccc(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000068183971 564811146 /nfs/dbraw/zinc/81/11/46/564811146.db2.gz GQWICAOEMDHXKE-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1Br ZINC000068184963 564811246 /nfs/dbraw/zinc/81/12/46/564811246.db2.gz DVRQAROIPVDQGW-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])o1 ZINC000068239574 564812748 /nfs/dbraw/zinc/81/27/48/564812748.db2.gz KXPWXHKOIZIEPW-UHFFFAOYSA-N 0 0 396.197 3.017 20 5 GGBDRN O=C(COc1ccccc1Br)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000134851422 564817419 /nfs/dbraw/zinc/81/74/19/564817419.db2.gz BADKLVAIBDYBFC-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN CC(C)CN(Cc1ccccc1Br)C(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000134972818 564820363 /nfs/dbraw/zinc/82/03/63/564820363.db2.gz ZFHMYJYUOGAEAC-UHFFFAOYSA-N 0 0 395.257 3.239 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1Br ZINC000068519248 564821867 /nfs/dbraw/zinc/82/18/67/564821867.db2.gz TZHBHKFADVUDIO-UHFFFAOYSA-N 0 0 397.229 3.013 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H]1CCCc2sccc21 ZINC000135035979 564822374 /nfs/dbraw/zinc/82/23/74/564822374.db2.gz MQOFGOQQOAOBCP-LBPRGKRZSA-N 0 0 379.825 3.442 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H]1CCCc2sccc21 ZINC000135030585 564822380 /nfs/dbraw/zinc/82/23/80/564822380.db2.gz WVONVHGFPMCWRV-GFCCVEGCSA-N 0 0 379.825 3.442 20 5 GGBDRN CC(C)CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000068827108 564827668 /nfs/dbraw/zinc/82/76/68/564827668.db2.gz HHKMNGHHZOXVPJ-NEPJUHHUSA-N 0 0 385.511 3.112 20 5 GGBDRN Cc1c(NCc2nnnn2-c2ccccc2Br)cccc1[N+](=O)[O-] ZINC000068923343 564829016 /nfs/dbraw/zinc/82/90/16/564829016.db2.gz RCUINQWMPILTBI-UHFFFAOYSA-N 0 0 389.213 3.254 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCOc3ccc(F)cc32)c(Cl)c1 ZINC000068937853 564829213 /nfs/dbraw/zinc/82/92/13/564829213.db2.gz HBBWEMDWTUTKFQ-ZDUSSCGKSA-N 0 0 386.788 3.189 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NCc1nnnn1-c1ccccc1Br ZINC000068923299 564829408 /nfs/dbraw/zinc/82/94/08/564829408.db2.gz KCYSUBDXMNMCDB-UHFFFAOYSA-N 0 0 389.213 3.254 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000068938503 564829576 /nfs/dbraw/zinc/82/95/76/564829576.db2.gz NPKGVTZRQJOPHE-LBPRGKRZSA-N 0 0 386.788 3.189 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000069122469 564833662 /nfs/dbraw/zinc/83/36/62/564833662.db2.gz MJLRLRVAZUONDX-CYBMUJFWSA-N 0 0 381.841 3.123 20 5 GGBDRN O=C(c1cc(Br)cs1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135529784 564833862 /nfs/dbraw/zinc/83/38/62/564833862.db2.gz MWAQVCYPSFYYNM-JTQLQIEISA-N 0 0 397.254 3.140 20 5 GGBDRN CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000135610482 564836674 /nfs/dbraw/zinc/83/66/74/564836674.db2.gz FIYUWXKMMSWCHK-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN CNC(=O)c1cc(Br)ccc1NCc1cc([N+](=O)[O-])ccc1OC ZINC000135696628 564839399 /nfs/dbraw/zinc/83/93/99/564839399.db2.gz ILCLFIXAHBPVET-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN CCOC(=O)CCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000135944952 564842634 /nfs/dbraw/zinc/84/26/34/564842634.db2.gz SXNQOWFAKDJJEA-UHFFFAOYSA-N 0 0 393.621 3.084 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2ccccc2Br)cc([N+](=O)[O-])c1 ZINC000136146492 564845460 /nfs/dbraw/zinc/84/54/60/564845460.db2.gz TTXRGVQPWBKCDB-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN COc1ccc(S(=O)(=O)NC2(c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] ZINC000069870605 564846330 /nfs/dbraw/zinc/84/63/30/564846330.db2.gz RQDCOLRVPLADBM-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN Cc1cc(Br)cn2cc(CNC(=O)c3cccc([N+](=O)[O-])c3)nc12 ZINC000071446724 564856472 /nfs/dbraw/zinc/85/64/72/564856472.db2.gz OTUGJQKLVSGKSK-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN Cc1ccc(CN(C)[C@@H](C(N)=O)c2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000136963823 564857631 /nfs/dbraw/zinc/85/76/31/564857631.db2.gz MMYOGIVKEPLQMW-MRXNPFEDSA-N 0 0 392.253 3.324 20 5 GGBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1 ZINC000072068314 564861020 /nfs/dbraw/zinc/86/10/20/564861020.db2.gz WNXMYBVSHORNIZ-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN O=C(Nc1ccccc1O)c1ccc([N+](=O)[O-])cc1I ZINC000072075528 564861212 /nfs/dbraw/zinc/86/12/12/564861212.db2.gz ZCRGAZSZZOPVNJ-UHFFFAOYSA-N 0 0 384.129 3.157 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1cc(F)ccc1Br ZINC000137350944 564862205 /nfs/dbraw/zinc/86/22/05/564862205.db2.gz DNZVQAJGSWAKIC-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1cc(Br)ccc1F ZINC000137351025 564862404 /nfs/dbraw/zinc/86/24/04/564862404.db2.gz TZJUAOJLUDNFKJ-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN COc1c(C(=O)Nc2ccccc2I)cccc1[N+](=O)[O-] ZINC000137552322 564863034 /nfs/dbraw/zinc/86/30/34/564863034.db2.gz JJEYPZIAPWHAQR-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN CS(=O)(=O)c1cccc(NCc2ccc(Br)s2)c1[N+](=O)[O-] ZINC000137965142 564864743 /nfs/dbraw/zinc/86/47/43/564864743.db2.gz QCLKQANEFWTTMB-UHFFFAOYSA-N 0 0 391.268 3.434 20 5 GGBDRN O=C(Nc1ccnn1Cc1ccc(Br)cc1)c1ccc([N+](=O)[O-])o1 ZINC000079324934 564867547 /nfs/dbraw/zinc/86/75/47/564867547.db2.gz DKHVFVDTOXUEHI-UHFFFAOYSA-N 0 0 391.181 3.447 20 5 GGBDRN CS(=O)(=O)Nc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000139797613 564870277 /nfs/dbraw/zinc/87/02/77/564870277.db2.gz ZUAQFGQDMOJMIQ-UHFFFAOYSA-N 0 0 384.801 3.264 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1OC ZINC000141027751 564873077 /nfs/dbraw/zinc/87/30/77/564873077.db2.gz HFGAMTHKWOEJHO-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN Cc1noc([C@@H]2CCCN(Cc3ccc(Br)c([N+](=O)[O-])c3)C2)n1 ZINC000091832463 564873111 /nfs/dbraw/zinc/87/31/11/564873111.db2.gz FBSFFCPJTYQSFE-GFCCVEGCSA-N 0 0 381.230 3.428 20 5 GGBDRN CC(C)c1ncc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)s1 ZINC000091978086 564874250 /nfs/dbraw/zinc/87/42/50/564874250.db2.gz DDYIQTQMBWHKAH-UHFFFAOYSA-N 0 0 380.495 3.194 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccc(Br)s2)c1 ZINC000146443232 564880658 /nfs/dbraw/zinc/88/06/58/564880658.db2.gz GGNCTUALGKCZFS-UHFFFAOYSA-N 0 0 385.239 3.400 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(F)ccc2Br)c1 ZINC000147476971 564882676 /nfs/dbraw/zinc/88/26/76/564882676.db2.gz INDRSQIBJCMHST-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN NC(=O)c1c(F)cc(Br)cc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000092830715 564882634 /nfs/dbraw/zinc/88/26/34/564882634.db2.gz QGMCTJRAKUFQGV-UHFFFAOYSA-N 0 0 394.200 3.158 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(Cc1ccc(Br)c([N+](=O)[O-])c1)CC2 ZINC000093613478 564888367 /nfs/dbraw/zinc/88/83/67/564888367.db2.gz BXCTXKAXBOGTDD-HOTGVXAUSA-N 0 0 399.285 3.109 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)C2)n1 ZINC000150797725 564891201 /nfs/dbraw/zinc/89/12/01/564891201.db2.gz GZIHJKQDQJPMTQ-SNVBAGLBSA-N 0 0 395.213 3.069 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)[C@@H](C)c2sc(C)nc2C)ccc1[N+](=O)[O-] ZINC000150811339 564891926 /nfs/dbraw/zinc/89/19/26/564891926.db2.gz HICFCCDDSDTVMP-JTQLQIEISA-N 0 0 385.467 3.058 20 5 GGBDRN O=c1c(Br)cn(CCOc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000093904467 564892139 /nfs/dbraw/zinc/89/21/39/564892139.db2.gz DRSMJNNPOHNQTH-UHFFFAOYSA-N 0 0 391.580 3.391 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000150835217 564892995 /nfs/dbraw/zinc/89/29/95/564892995.db2.gz YLJJHEBQMWNXFO-ZDUSSCGKSA-N 0 0 399.241 3.304 20 5 GGBDRN NS(=O)(=O)c1ccc(OCc2cc(Cl)ccc2Cl)c([N+](=O)[O-])c1 ZINC000150862851 564894831 /nfs/dbraw/zinc/89/48/31/564894831.db2.gz KOIQIXXUCXRNCA-UHFFFAOYSA-N 0 0 377.205 3.128 20 5 GGBDRN COc1cc(NC[C@@H](O)COc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000150919091 564897571 /nfs/dbraw/zinc/89/75/71/564897571.db2.gz ZBFHDTKYWPZYJT-GFCCVEGCSA-N 0 0 397.225 3.218 20 5 GGBDRN CCc1nn(C)c(N2CCO[C@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000094152458 564897915 /nfs/dbraw/zinc/89/79/15/564897915.db2.gz KPQOKNFXGNWYAQ-AWEZNQCLSA-N 0 0 395.257 3.231 20 5 GGBDRN CCc1nn(C)c(N2CCO[C@H](c3ccccc3Br)C2)c1[N+](=O)[O-] ZINC000094153191 564898027 /nfs/dbraw/zinc/89/80/27/564898027.db2.gz VKPRYORKWZDVHL-AWEZNQCLSA-N 0 0 395.257 3.231 20 5 GGBDRN CN(CCOc1ccccc1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000150963829 564899208 /nfs/dbraw/zinc/89/92/08/564899208.db2.gz JQPBNDLWTGCGGB-UHFFFAOYSA-N 0 0 393.237 3.437 20 5 GGBDRN Cn1cc(-c2csc(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)n2)cn1 ZINC000151020552 564902866 /nfs/dbraw/zinc/90/28/66/564902866.db2.gz FVHUWWRWGYTBNV-UHFFFAOYSA-N 0 0 377.813 3.286 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCc1nc2ccccc2s1 ZINC000096942744 564902873 /nfs/dbraw/zinc/90/28/73/564902873.db2.gz WAOJWPCVAQASPI-UHFFFAOYSA-N 0 0 377.447 3.034 20 5 GGBDRN COc1ccc(CNC(=O)COc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000151154317 564908480 /nfs/dbraw/zinc/90/84/80/564908480.db2.gz GRQZJXDAFMVKMU-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN Cc1nn(C)c(C)c1CNc1ccc(I)cc1[N+](=O)[O-] ZINC000097635537 564909425 /nfs/dbraw/zinc/90/94/25/564909425.db2.gz RJGRJFXMSNMXTR-UHFFFAOYSA-N 0 0 386.193 3.162 20 5 GGBDRN CC[C@](C)(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000151485244 564922566 /nfs/dbraw/zinc/92/25/66/564922566.db2.gz HAPZTHMGIHBBQN-ZDUSSCGKSA-N 0 0 375.859 3.308 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)Nc1c(C)cc(C)cc1C ZINC000102202694 564926507 /nfs/dbraw/zinc/92/65/07/564926507.db2.gz SQEKEJAUPGRPHH-UHFFFAOYSA-N 0 0 381.230 3.426 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1nc(-c2ccc(F)cc2)no1 ZINC000102202545 564926529 /nfs/dbraw/zinc/92/65/29/564926529.db2.gz LBPYTOZNNJVECL-UHFFFAOYSA-N 0 0 382.149 3.100 20 5 GGBDRN CCc1c(C(=O)Cn2c(C)nc([N+](=O)[O-])c2Br)[nH]c(C)c1C(C)=O ZINC000102201644 564926707 /nfs/dbraw/zinc/92/67/07/564926707.db2.gz RYWQGIBRJYDQAZ-UHFFFAOYSA-N 0 0 397.229 3.147 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1ccc(O)c(Br)c1 ZINC000151579572 564927396 /nfs/dbraw/zinc/92/73/96/564927396.db2.gz MBBHFFRCPWFEBN-UHFFFAOYSA-N 0 0 379.210 3.312 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(O)c(Br)c1 ZINC000151569400 564927446 /nfs/dbraw/zinc/92/74/46/564927446.db2.gz DHXAQTAGNYJTCC-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000151593292 564928304 /nfs/dbraw/zinc/92/83/04/564928304.db2.gz YVIHNLBLRBXWHZ-MRVPVSSYSA-N 0 0 382.214 3.382 20 5 GGBDRN Cc1noc(C)c1[C@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000151593366 564928396 /nfs/dbraw/zinc/92/83/96/564928396.db2.gz YVIHNLBLRBXWHZ-QMMMGPOBSA-N 0 0 382.214 3.382 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccc(O)c(Br)c1 ZINC000151618172 564930315 /nfs/dbraw/zinc/93/03/15/564930315.db2.gz AHSIMQQHERHTFP-UHFFFAOYSA-N 0 0 397.250 3.471 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCc2cccc(O)c2)cc1[N+](=O)[O-] ZINC000151712895 564933230 /nfs/dbraw/zinc/93/32/30/564933230.db2.gz YXQYZYYFTDRQPB-UHFFFAOYSA-N 0 0 379.210 3.344 20 5 GGBDRN COC(=O)c1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000151697893 564933829 /nfs/dbraw/zinc/93/38/29/564933829.db2.gz XLTIHKLAFWWYGV-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN CCOc1ccc(Br)cc1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000102767633 564934815 /nfs/dbraw/zinc/93/48/15/564934815.db2.gz QAFAGTLXBIDZCR-UHFFFAOYSA-N 0 0 394.225 3.467 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000151797210 564936938 /nfs/dbraw/zinc/93/69/38/564936938.db2.gz MAWDDWYPCLKJOM-DFBGVHRSSA-N 0 0 395.253 3.353 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N2CCC[C@H]2c2ccsc2)c([N+](=O)[O-])c1 ZINC000151950819 564941790 /nfs/dbraw/zinc/94/17/90/564941790.db2.gz IESQLEFLDOBBKD-AWEZNQCLSA-N 0 0 381.479 3.248 20 5 GGBDRN CCOCCNC(=O)CNc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000151995534 564943120 /nfs/dbraw/zinc/94/31/20/564943120.db2.gz VQIHSYMCNNQHQP-UHFFFAOYSA-N 0 0 381.479 3.372 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC([C@H](O)C(F)(F)F)CC1 ZINC000151981022 564943353 /nfs/dbraw/zinc/94/33/53/564943353.db2.gz LVAFUTJGGCMPLN-LBPRGKRZSA-N 0 0 381.738 3.415 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cc([N+](=O)[O-])ccc1Br ZINC000152024333 564943917 /nfs/dbraw/zinc/94/39/17/564943917.db2.gz QBNKGNPFQLCLOR-GLQYFDAESA-N 0 0 395.253 3.435 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CC[C@@H]2CCCC[C@@H]21 ZINC000103158990 564944048 /nfs/dbraw/zinc/94/40/48/564944048.db2.gz WRQQIPMMWIBBDE-JQWIXIFHSA-N 0 0 389.271 3.311 20 5 GGBDRN CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)c2ccccc21 ZINC000152007678 564944282 /nfs/dbraw/zinc/94/42/82/564944282.db2.gz WFXDHEFTUAZHPI-UHFFFAOYSA-N 0 0 376.210 3.454 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000103497347 564949766 /nfs/dbraw/zinc/94/97/66/564949766.db2.gz NEYYLOSEHBJSND-HNNXBMFYSA-N 0 0 382.825 3.010 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCOc2cc(F)ccc21 ZINC000152186774 564950164 /nfs/dbraw/zinc/95/01/64/564950164.db2.gz NDSNZTUWQQFZCQ-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN O=[N+]([O-])c1nn(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1Br ZINC000152288992 564953713 /nfs/dbraw/zinc/95/37/13/564953713.db2.gz ZTUSVHGCXHDAGA-SNVBAGLBSA-N 0 0 394.147 3.176 20 5 GGBDRN C[C@H](CC(=O)c1cccs1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000152308723 564954743 /nfs/dbraw/zinc/95/47/43/564954743.db2.gz CBZODKALMFXZHR-SECBINFHSA-N 0 0 388.854 3.250 20 5 GGBDRN CCN(C(=O)c1ccc([N+](=O)[O-])cc1I)c1cccnc1 ZINC000104402120 564954817 /nfs/dbraw/zinc/95/48/17/564954817.db2.gz OATZZGIVRXHVKY-UHFFFAOYSA-N 0 0 397.172 3.261 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1nnc(C2CC2)s1 ZINC000152345138 564956391 /nfs/dbraw/zinc/95/63/91/564956391.db2.gz LPGOPEQIGZFLPY-UHFFFAOYSA-N 0 0 383.227 3.267 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1ccccc1Br ZINC000104583618 564956620 /nfs/dbraw/zinc/95/66/20/564956620.db2.gz QXNKNBBQUMHZPM-GOEBONIOSA-N 0 0 391.221 3.408 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CC[C@@H]2OCCC[C@@H]2C1 ZINC000152379034 564957234 /nfs/dbraw/zinc/95/72/34/564957234.db2.gz GHBFIVLUYDXWIB-YGRLFVJLSA-N 0 0 388.205 3.205 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCCC[C@H]1c1ncon1 ZINC000152397102 564958133 /nfs/dbraw/zinc/95/81/33/564958133.db2.gz GMIGWAOULFUDJF-ZDUSSCGKSA-N 0 0 395.213 3.037 20 5 GGBDRN Cc1nc(CN2CCN(c3ccc(Br)cc3[N+](=O)[O-])CC2)oc1C ZINC000104658319 564958205 /nfs/dbraw/zinc/95/82/05/564958205.db2.gz XNKWOXVCKFTLLE-UHFFFAOYSA-N 0 0 395.257 3.284 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000152467245 564960736 /nfs/dbraw/zinc/96/07/36/564960736.db2.gz APKLQCVIZCCUQO-VIFPVBQESA-N 0 0 396.241 3.252 20 5 GGBDRN Cc1ccc(OC[C@H](O)COc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000152688925 564968915 /nfs/dbraw/zinc/96/89/15/564968915.db2.gz ZMLDUGZEHVTUPB-LBPRGKRZSA-N 0 0 382.210 3.484 20 5 GGBDRN CN(CCOCc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000152827053 564973055 /nfs/dbraw/zinc/97/30/55/564973055.db2.gz NOZRAPPQCOHTBF-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CN(CCOCc1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000152843492 564973650 /nfs/dbraw/zinc/97/36/50/564973650.db2.gz ZXTLBTAANNQSLY-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN O=C(c1cc(I)cc([N+](=O)[O-])c1)N1Cc2ccccc2C1 ZINC000152837503 564973655 /nfs/dbraw/zinc/97/36/55/564973655.db2.gz KBSYQAAIXJZDNX-UHFFFAOYSA-N 0 0 394.168 3.355 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000152891399 564976323 /nfs/dbraw/zinc/97/63/23/564976323.db2.gz BAWLOTVASFAHRM-SNVBAGLBSA-N 0 0 385.207 3.308 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)s1 ZINC000152942596 564978289 /nfs/dbraw/zinc/97/82/89/564978289.db2.gz IPRZNLAGFRBHGN-KGLIPLIRSA-N 0 0 382.463 3.073 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)Cc2csc(-c3ccccn3)n2)c1 ZINC000106301471 564981462 /nfs/dbraw/zinc/98/14/62/564981462.db2.gz ZCQMUZFJAJIXCV-UHFFFAOYSA-N 0 0 375.431 3.228 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000153019473 564981650 /nfs/dbraw/zinc/98/16/50/564981650.db2.gz LJEPUQMMTLIXGQ-UHFFFAOYSA-N 0 0 392.209 3.311 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)s1 ZINC000153051754 564982843 /nfs/dbraw/zinc/98/28/43/564982843.db2.gz XSXWYQQFSALZNI-LBPRGKRZSA-N 0 0 388.854 3.152 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C12CCC2 ZINC000153180967 564986708 /nfs/dbraw/zinc/98/67/08/564986708.db2.gz RUBCPBNRHWFVDY-LSDHHAIUSA-N 0 0 397.269 3.364 20 5 GGBDRN CN(CCc1ccc(Br)cc1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000106861887 564989751 /nfs/dbraw/zinc/98/97/51/564989751.db2.gz LKWQBIOEURWNGV-UHFFFAOYSA-N 0 0 392.253 3.470 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)c1nc(C(C)(C)C)cs1 ZINC000106893071 564990892 /nfs/dbraw/zinc/99/08/92/564990892.db2.gz QRQCAOZWQJXNFC-MRVPVSSYSA-N 0 0 375.497 3.450 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@@H](C)c2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000106896992 564991143 /nfs/dbraw/zinc/99/11/43/564991143.db2.gz NPACYEQNUXVKLX-JTQLQIEISA-N 0 0 385.467 3.058 20 5 GGBDRN Cn1c2ccc(Cl)cc2nc1Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000153430751 564994431 /nfs/dbraw/zinc/99/44/31/564994431.db2.gz GNEIQCOYTQRKJL-UHFFFAOYSA-N 0 0 397.616 3.107 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1ccc(OC(F)F)cc1 ZINC000153430873 564994815 /nfs/dbraw/zinc/99/48/15/564994815.db2.gz FPNYQPWMIPIPHB-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN O=C(c1ccc(Br)cc1O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153436812 564995251 /nfs/dbraw/zinc/99/52/51/564995251.db2.gz SVRXTIJVGUBKNZ-UHFFFAOYSA-N 0 0 377.194 3.261 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1ccccc1Br ZINC000153435469 564995483 /nfs/dbraw/zinc/99/54/83/564995483.db2.gz ITJRGLSTTWXHQR-UHFFFAOYSA-N 0 0 388.015 3.330 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1ccc2c[nH]nc2c1 ZINC000153463376 564995996 /nfs/dbraw/zinc/99/59/96/564995996.db2.gz LWLKOURUDQEWOH-UHFFFAOYSA-N 0 0 375.182 3.415 20 5 GGBDRN CSc1ccc(OCCn2cc(Br)cc([N+](=O)[O-])c2=O)cc1 ZINC000153467079 564996017 /nfs/dbraw/zinc/99/60/17/564996017.db2.gz RPTUYNIEIWMKEG-UHFFFAOYSA-N 0 0 385.239 3.320 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1cc(-c2ccccc2)on1 ZINC000153454451 564996395 /nfs/dbraw/zinc/99/63/95/564996395.db2.gz QXYOJOGPEQBOFY-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1csc(-c2ccccn2)n1 ZINC000153470817 564996728 /nfs/dbraw/zinc/99/67/28/564996728.db2.gz VTYPEJJJDLHNPB-UHFFFAOYSA-N 0 0 393.222 3.086 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1C(N)=O ZINC000153568104 565001497 /nfs/dbraw/zinc/00/14/97/565001497.db2.gz AZWXNGLKMHEZSV-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN CN(C[C@H]1CCCOC1)c1ccc(I)cc1[N+](=O)[O-] ZINC000107673955 565001675 /nfs/dbraw/zinc/00/16/75/565001675.db2.gz UJEKCMKEKLAGTA-SNVBAGLBSA-N 0 0 376.194 3.062 20 5 GGBDRN CN(CCN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000107703158 565001695 /nfs/dbraw/zinc/00/16/95/565001695.db2.gz FPMSAFPOECJMIL-UHFFFAOYSA-N 0 0 383.857 3.005 20 5 GGBDRN O=C(Cn1cc(Cl)cc([N+](=O)[O-])c1=O)Nc1cccc(Cl)c1Cl ZINC000153619474 565003194 /nfs/dbraw/zinc/00/31/94/565003194.db2.gz FRMGEBZHMBIVOY-UHFFFAOYSA-N 0 0 376.583 3.355 20 5 GGBDRN CC[C@H](NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)c1ccc(Cl)cc1 ZINC000153623116 565003391 /nfs/dbraw/zinc/00/33/91/565003391.db2.gz ROWVBHMPPDQOBI-ZDUSSCGKSA-N 0 0 384.219 3.331 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000153671908 565005676 /nfs/dbraw/zinc/00/56/76/565005676.db2.gz OBNGIUOHLMJIAI-UHFFFAOYSA-N 0 0 398.282 3.447 20 5 GGBDRN O=C(C1CCC(Nc2ncc(Cl)cc2[N+](=O)[O-])CC1)N1CCSCC1 ZINC000153673350 565005845 /nfs/dbraw/zinc/00/58/45/565005845.db2.gz MHMZZLIATVPNOX-UHFFFAOYSA-N 0 0 384.889 3.189 20 5 GGBDRN Cc1nc(C)c(CCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)s1 ZINC000153705155 565007255 /nfs/dbraw/zinc/00/72/55/565007255.db2.gz HPAOCFJMUVCFHO-UHFFFAOYSA-N 0 0 384.255 3.403 20 5 GGBDRN Cc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)ccc1S(C)(=O)=O ZINC000153733087 565008308 /nfs/dbraw/zinc/00/83/08/565008308.db2.gz RKBHQQZHVJUPOJ-UHFFFAOYSA-N 0 0 382.825 3.141 20 5 GGBDRN CC(C)CCN(CCC(C)C)C(=O)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000108276331 565009103 /nfs/dbraw/zinc/00/91/03/565009103.db2.gz VUNMFOKKNLCLSP-UHFFFAOYSA-N 0 0 389.294 3.475 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(Cc3cccs3)n2C2CC2)c1 ZINC000153740571 565009219 /nfs/dbraw/zinc/00/92/19/565009219.db2.gz IBRSFJVHMZWZFA-UHFFFAOYSA-N 0 0 376.467 3.162 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC000153737537 565009250 /nfs/dbraw/zinc/00/92/50/565009250.db2.gz NLRCBMMNXREFOK-GJZGRUSLSA-N 0 0 388.873 3.216 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000153776323 565010499 /nfs/dbraw/zinc/01/04/99/565010499.db2.gz ZOERRLAFCKTVTI-INIZCTEOSA-N 0 0 384.841 3.055 20 5 GGBDRN CCCO[C@@H]1CCCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000108405348 565010545 /nfs/dbraw/zinc/01/05/45/565010545.db2.gz ALRATFGMTNMSLZ-GFCCVEGCSA-N 0 0 376.862 3.218 20 5 GGBDRN CCCO[C@H]1CCCN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000108405252 565010757 /nfs/dbraw/zinc/01/07/57/565010757.db2.gz NZAVPWPZJUFHEJ-ZDUSSCGKSA-N 0 0 376.862 3.218 20 5 GGBDRN O=[N+]([O-])c1ccc(CSCc2ccc(S(=O)(=O)N3CCCC3)o2)cc1 ZINC000108417852 565010929 /nfs/dbraw/zinc/01/09/29/565010929.db2.gz OBPAWQFPNDSTFT-UHFFFAOYSA-N 0 0 382.463 3.406 20 5 GGBDRN O=C1CN(c2ncc(Cl)cc2[N+](=O)[O-])CCN1Cc1ccc(Cl)cc1 ZINC000153813388 565012680 /nfs/dbraw/zinc/01/26/80/565012680.db2.gz XNNSSQNZMMCUDL-UHFFFAOYSA-N 0 0 381.219 3.145 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OC[C@@H](O)COc1ccc(Br)cc1 ZINC000153856412 565014280 /nfs/dbraw/zinc/01/42/80/565014280.db2.gz KJTCESMJXVSKHN-ZDUSSCGKSA-N 0 0 398.209 3.185 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1OC[C@@H](O)COc1ccc(F)cc1 ZINC000153849299 565014351 /nfs/dbraw/zinc/01/43/51/565014351.db2.gz AMFVUCMBKSYZPD-LBPRGKRZSA-N 0 0 386.173 3.315 20 5 GGBDRN CC[C@@H](C)CN(C)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000153868277 565015335 /nfs/dbraw/zinc/01/53/35/565015335.db2.gz LHYZVRYWHBNXHS-SECBINFHSA-N 0 0 376.194 3.318 20 5 GGBDRN Cc1cccc(N(C)S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000108759537 565016256 /nfs/dbraw/zinc/01/62/56/565016256.db2.gz KYRUYTOFGYTHBU-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN Cn1cc([C@@H]2CCCN2c2ccc(I)cc2[N+](=O)[O-])cn1 ZINC000108946231 565018980 /nfs/dbraw/zinc/01/89/80/565018980.db2.gz YIWFPUKFAFMDMU-LBPRGKRZSA-N 0 0 398.204 3.274 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NC[C@@H](O)COc1ccc(F)cc1 ZINC000108931308 565019053 /nfs/dbraw/zinc/01/90/53/565019053.db2.gz JTJSJAAYGRXOTB-GFCCVEGCSA-N 0 0 385.189 3.348 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC[C@@H]3CO)cc2[N+](=O)[O-])n1 ZINC000153956874 565019456 /nfs/dbraw/zinc/01/94/56/565019456.db2.gz LUCMXNUSOYVVPB-GFCCVEGCSA-N 0 0 379.463 3.108 20 5 GGBDRN O=C(CSc1nnc(NCC(F)(F)F)s1)c1cccc([N+](=O)[O-])c1 ZINC000109198212 565022199 /nfs/dbraw/zinc/02/21/99/565022199.db2.gz REHSFKXCRRHYCC-UHFFFAOYSA-N 0 0 378.357 3.396 20 5 GGBDRN Cc1ccc(C[NH+](C)C)cc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000154030904 565022765 /nfs/dbraw/zinc/02/27/65/565022765.db2.gz MHCISVFUQZSPJN-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN CC(C)c1csc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000154068192 565024554 /nfs/dbraw/zinc/02/45/54/565024554.db2.gz ZVVUELGVWGGOKX-UHFFFAOYSA-N 0 0 375.859 3.307 20 5 GGBDRN CS(=O)(=O)c1ccc(NC2CCN(c3cccs3)CC2)c([N+](=O)[O-])c1 ZINC000154101151 565025606 /nfs/dbraw/zinc/02/56/06/565025606.db2.gz NEGVWSJSXBGAHT-UHFFFAOYSA-N 0 0 381.479 3.141 20 5 GGBDRN 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O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3ccc(Br)cc32)cc1 ZINC000112267036 565061568 /nfs/dbraw/zinc/06/15/68/565061568.db2.gz WYRNJDARVXECAR-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN C[C@H](CC(=O)c1ccco1)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000155139493 565062451 /nfs/dbraw/zinc/06/24/51/565062451.db2.gz JHEULRANAIPVTL-SECBINFHSA-N 0 0 381.182 3.342 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N1CC[C@H]2OCCC[C@H]2C1 ZINC000155155507 565063025 /nfs/dbraw/zinc/06/30/25/565063025.db2.gz OVTLKPAENFLDCU-IINYFYTJSA-N 0 0 384.230 3.390 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N1CC[C@H]2OCCC[C@@H]2C1 ZINC000155155299 565063028 /nfs/dbraw/zinc/06/30/28/565063028.db2.gz OVTLKPAENFLDCU-QMTHXVAHSA-N 0 0 384.230 3.390 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000155171447 565063334 /nfs/dbraw/zinc/06/33/34/565063334.db2.gz SWLKNMBHRNJHMW-UHFFFAOYSA-N 0 0 396.245 3.416 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cncc(I)c1 ZINC000155210191 565064190 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CN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155495925 565068361 /nfs/dbraw/zinc/06/83/61/565068361.db2.gz WRHCVHVVBBNIGF-OAHLLOKOSA-N 0 0 384.816 3.348 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](CO)c2ccccc2)cc1[N+](=O)[O-] ZINC000155491646 565068383 /nfs/dbraw/zinc/06/83/83/565068383.db2.gz TWWBMIGPZWGRMZ-AWEZNQCLSA-N 0 0 379.210 3.129 20 5 GGBDRN CN(Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155496043 565068482 /nfs/dbraw/zinc/06/84/82/565068482.db2.gz WRHCVHVVBBNIGF-HNNXBMFYSA-N 0 0 384.816 3.348 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2ccc(O)c(Br)c2)c1[N+](=O)[O-] ZINC000155590529 565069560 /nfs/dbraw/zinc/06/95/60/565069560.db2.gz DWBDLYZWSXVOJK-UHFFFAOYSA-N 0 0 396.197 3.247 20 5 GGBDRN COCCN(C(C)=O)c1nc(COc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000113773005 565071219 /nfs/dbraw/zinc/07/12/19/565071219.db2.gz NVOKCBBOQVNLLU-UHFFFAOYSA-N 0 0 385.829 3.283 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000155891623 565072405 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O=C(NCCc1cn2c(n1)SCC2)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291835574 565079839 /nfs/dbraw/zinc/07/98/39/565079839.db2.gz SUKIXJYYLVXGNL-UHFFFAOYSA-N 0 0 387.248 3.176 20 5 GGBDRN CN(CCc1ccc(Br)cc1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183566803 565079776 /nfs/dbraw/zinc/07/97/76/565079776.db2.gz PQTLTAXIYREHLP-UHFFFAOYSA-N 0 0 379.214 3.459 20 5 GGBDRN O=C(CNC(=O)Nc1ccncc1[N+](=O)[O-])Nc1cc(Cl)ccc1Cl ZINC000183614363 565081960 /nfs/dbraw/zinc/08/19/60/565081960.db2.gz LGSWOLDKLBHYJP-UHFFFAOYSA-N 0 0 384.179 3.057 20 5 GGBDRN C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])Oc1ccccc1Br ZINC000183610505 565082076 /nfs/dbraw/zinc/08/20/76/565082076.db2.gz LUZJPXQXMNQIDV-JTQLQIEISA-N 0 0 395.213 3.341 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC2(C3CC3)CCOCC2)cc1[N+](=O)[O-] ZINC000369260967 565083972 /nfs/dbraw/zinc/08/39/72/565083972.db2.gz ZODZPBUDGBGAQC-UHFFFAOYSA-N 0 0 383.242 3.355 20 5 GGBDRN CC1(CO)CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CC1 ZINC000183646846 565084911 /nfs/dbraw/zinc/08/49/11/565084911.db2.gz XCNYYEKHWNEOSM-UHFFFAOYSA-N 0 0 391.649 3.245 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC(c2ncccc2Cl)CC1 ZINC000369338399 565088162 /nfs/dbraw/zinc/08/81/62/565088162.db2.gz ILJOIYUUPQJLBT-UHFFFAOYSA-N 0 0 381.841 3.212 20 5 GGBDRN C[C@]1(CNC(=O)c2sc(Br)cc2[N+](=O)[O-])CCO[C@@H]1C1CC1 ZINC000369365722 565089342 /nfs/dbraw/zinc/08/93/42/565089342.db2.gz FRRQDTGWQARMNR-TZMCWYRMSA-N 0 0 389.271 3.354 20 5 GGBDRN O=C(NCC1(CCO)CCCCC1)c1ccc([N+](=O)[O-])cc1Br ZINC000156485302 565090001 /nfs/dbraw/zinc/09/00/01/565090001.db2.gz IGPIZMIADUUOMY-UHFFFAOYSA-N 0 0 385.258 3.420 20 5 GGBDRN Cc1cc(Br)cnc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000156514574 565090684 /nfs/dbraw/zinc/09/06/84/565090684.db2.gz KYIMSLKKIRQQFC-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NC2(c3cccc(Cl)c3)CC2)cc1 ZINC000183720973 565090902 /nfs/dbraw/zinc/09/09/02/565090902.db2.gz RQBIRJYGAGGGCP-UHFFFAOYSA-N 0 0 380.853 3.399 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1ccc(O)c(Br)c1 ZINC000156525449 565092001 /nfs/dbraw/zinc/09/20/01/565092001.db2.gz HPESIAMZFDACKO-UHFFFAOYSA-N 0 0 395.209 3.148 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@@H](C)[S@]1=O ZINC000292013638 565092076 /nfs/dbraw/zinc/09/20/76/565092076.db2.gz SFQQVFZNEHINDW-ORXUAUJHSA-N 0 0 379.265 3.273 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@@H](C)[S@@]1=O ZINC000292013640 565092332 /nfs/dbraw/zinc/09/23/32/565092332.db2.gz SFQQVFZNEHINDW-NUHDDLEISA-N 0 0 379.265 3.273 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)[C@@H]2CCCO[C@@H]21 ZINC000369431657 565092944 /nfs/dbraw/zinc/09/29/44/565092944.db2.gz BFMGKAFEUQXYPS-GDLCADMTSA-N 0 0 383.242 3.291 20 5 GGBDRN CCOC(=O)c1csc(N(C)C(=O)c2cc(SC)ccc2[N+](=O)[O-])n1 ZINC000266877721 565094377 /nfs/dbraw/zinc/09/43/77/565094377.db2.gz WEBOCOBYOZIVHB-UHFFFAOYSA-N 0 0 381.435 3.227 20 5 GGBDRN COc1cc(CSc2nc3ccsc3c(=O)n2C)c([N+](=O)[O-])cc1F ZINC000183845781 565098072 /nfs/dbraw/zinc/09/80/72/565098072.db2.gz KIAFYNAZINZNEG-UHFFFAOYSA-N 0 0 381.410 3.343 20 5 GGBDRN COc1ccc(Br)c(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000369555514 565099181 /nfs/dbraw/zinc/09/91/81/565099181.db2.gz DHKZZCCNHDLSSK-UHFFFAOYSA-N 0 0 395.257 3.400 20 5 GGBDRN O=[N+]([O-])c1ccn(C2CCN(c3ccc([N+](=O)[O-])cc3Br)CC2)n1 ZINC000369635508 565103457 /nfs/dbraw/zinc/10/34/57/565103457.db2.gz DDNKLTPTGFSOOU-UHFFFAOYSA-N 0 0 396.201 3.304 20 5 GGBDRN C[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@@H]1OCCc2sccc21 ZINC000292195028 565103936 /nfs/dbraw/zinc/10/39/36/565103936.db2.gz GIAIBRRQKKWTRD-OQPBUACISA-N 0 0 388.492 3.236 20 5 GGBDRN O=C1CCCC[C@H]1[C@H]1CCCN1S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000183959554 565107314 /nfs/dbraw/zinc/10/73/14/565107314.db2.gz PYBIDWCATDHIQI-QWHCGFSZSA-N 0 0 386.857 3.161 20 5 GGBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1Br)c1ccc2c(c1)CC(=O)N2C ZINC000267182207 565107773 /nfs/dbraw/zinc/10/77/73/565107773.db2.gz BWRWYWVNWOSYSC-SECBINFHSA-N 0 0 391.225 3.444 20 5 GGBDRN CCn1cc(C2CCN(c3ncc([N+](=O)[O-])cc3Br)CC2)cn1 ZINC000267186730 565107924 /nfs/dbraw/zinc/10/79/24/565107924.db2.gz CRLXJIVJBBFCJC-UHFFFAOYSA-N 0 0 380.246 3.353 20 5 GGBDRN COc1ccc(CNc2ncc([N+](=O)[O-])cc2Br)c(OC)c1OC ZINC000267175494 565108099 /nfs/dbraw/zinc/10/80/99/565108099.db2.gz AUCWQQZRDZELOS-UHFFFAOYSA-N 0 0 398.213 3.390 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC(=O)Nc2c(F)cccc21 ZINC000369735120 565109942 /nfs/dbraw/zinc/10/99/42/565109942.db2.gz CHVHYVCUOOOBOR-UHFFFAOYSA-N 0 0 394.156 3.095 20 5 GGBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCC[C@H]1[C@H](O)C(F)(F)F ZINC000292349614 565111088 /nfs/dbraw/zinc/11/10/88/565111088.db2.gz YEHZSIKKXLQEAC-ONGXEEELSA-N 0 0 387.141 3.429 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1sc(Br)cc1[N+](=O)[O-])CCO2 ZINC000369783598 565112718 /nfs/dbraw/zinc/11/27/18/565112718.db2.gz JORSKZKUAUHILI-UHFFFAOYSA-N 0 0 384.211 3.161 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@]3(C)CCOC3)cc2[N+](=O)[O-])n1 ZINC000156993698 565114088 /nfs/dbraw/zinc/11/40/88/565114088.db2.gz YITBRBHMHLZHQD-MRXNPFEDSA-N 0 0 379.463 3.420 20 5 GGBDRN CSCCc1ccc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000156982145 565114565 /nfs/dbraw/zinc/11/45/65/565114565.db2.gz GFISBBYZWHDZMF-UHFFFAOYSA-N 0 0 380.491 3.485 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCCSc1ccc(F)cc1 ZINC000184115737 565114506 /nfs/dbraw/zinc/11/45/06/565114506.db2.gz NCYRXVYNRNAYTK-UHFFFAOYSA-N 0 0 384.454 3.336 20 5 GGBDRN CN(Cc1ncnn1CC(F)F)C(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000292416280 565115001 /nfs/dbraw/zinc/11/50/01/565115001.db2.gz SXUYJKRAVXUWSM-UHFFFAOYSA-N 0 0 394.165 3.030 20 5 GGBDRN CSC[C@H]1CCCN(c2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])C1 ZINC000292427763 565115009 /nfs/dbraw/zinc/11/50/09/565115009.db2.gz XAFIPGIHXQCEKF-JTQLQIEISA-N 0 0 380.438 3.171 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000184116609 565115082 /nfs/dbraw/zinc/11/50/82/565115082.db2.gz CJYISNWKLSXIAN-NSHDSACASA-N 0 0 380.857 3.224 20 5 GGBDRN CC(C)C(=O)Nc1nc(CC(=O)Nc2cccc([N+](=O)[O-])c2Cl)cs1 ZINC000292421118 565115398 /nfs/dbraw/zinc/11/53/98/565115398.db2.gz TYZINCXGNIIIEC-UHFFFAOYSA-N 0 0 382.829 3.480 20 5 GGBDRN Cc1ccc(I)cc1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000157035558 565116086 /nfs/dbraw/zinc/11/60/86/565116086.db2.gz RJWSOBPISOGHOH-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN Cc1cc(CNc2c(Br)cncc2[N+](=O)[O-])nc(N2CCCC2)n1 ZINC000292460532 565117490 /nfs/dbraw/zinc/11/74/90/565117490.db2.gz ZYYZSNCHCIJJKQ-UHFFFAOYSA-N 0 0 393.245 3.063 20 5 GGBDRN COc1ccc(Br)c(CC(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000157077375 565118159 /nfs/dbraw/zinc/11/81/59/565118159.db2.gz WXDLEYCNEJVEFF-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC([C@@H]2CCOC2)CC1 ZINC000369920294 565119031 /nfs/dbraw/zinc/11/90/31/565119031.db2.gz OIUYFXXLDIPRJH-CQSZACIVSA-N 0 0 397.269 3.175 20 5 GGBDRN O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1ccc(Br)cc1[N+](=O)[O-] ZINC000267483273 565119069 /nfs/dbraw/zinc/11/90/69/565119069.db2.gz KHRAEIGGOBOJGB-CYBMUJFWSA-N 0 0 392.209 3.265 20 5 GGBDRN CCOC(=O)C1CCC(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000267501994 565119448 /nfs/dbraw/zinc/11/94/48/565119448.db2.gz UQTXMBTVTPPRAK-UHFFFAOYSA-N 0 0 399.241 3.209 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H](C(F)(F)F)[C@H]32)cc1SC ZINC000369968976 565121264 /nfs/dbraw/zinc/12/12/64/565121264.db2.gz GRPUWTBEXOYCOJ-YLJLNXRRSA-N 0 0 376.356 3.348 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2cc(F)c(F)cc2F)c(Cl)c1 ZINC000184249004 565122792 /nfs/dbraw/zinc/12/27/92/565122792.db2.gz ASGGENWEISZANL-UHFFFAOYSA-N 0 0 380.731 3.144 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC(CO)(c2ccccc2)CC1 ZINC000292614115 565125398 /nfs/dbraw/zinc/12/53/98/565125398.db2.gz CWJZFWIDZVZYRA-UHFFFAOYSA-N 0 0 392.253 3.283 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCCC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000267650209 565125723 /nfs/dbraw/zinc/12/57/23/565125723.db2.gz UGRDFFFZJSZOEM-UHFFFAOYSA-N 0 0 388.873 3.138 20 5 GGBDRN O=C(c1sccc1Br)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000370081254 565126525 /nfs/dbraw/zinc/12/65/25/565126525.db2.gz KIXJNYPJJIITDV-UHFFFAOYSA-N 0 0 385.243 3.093 20 5 GGBDRN CO[C@](C)(CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)C1CC1 ZINC000292630431 565126888 /nfs/dbraw/zinc/12/68/88/565126888.db2.gz YRSQNLBECZFBFK-CQSZACIVSA-N 0 0 375.194 3.041 20 5 GGBDRN CCOC(=O)c1csc(COC(=O)c2ccc(SC)c([N+](=O)[O-])c2)n1 ZINC000292663907 565127648 /nfs/dbraw/zinc/12/76/48/565127648.db2.gz CWQOVWKXFXSXNJ-UHFFFAOYSA-N 0 0 382.419 3.307 20 5 GGBDRN CS(=O)(=O)C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000292688028 565129477 /nfs/dbraw/zinc/12/94/77/565129477.db2.gz BDLVOIGMEOZRLK-ZDUSSCGKSA-N 0 0 380.491 3.190 20 5 GGBDRN COC(=O)c1ccc(CNc2ncc(Br)cc2[N+](=O)[O-])cc1OC ZINC000157418134 565130897 /nfs/dbraw/zinc/13/08/97/565130897.db2.gz PMOUUMPARJBQPC-UHFFFAOYSA-N 0 0 396.197 3.160 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC(n2ccnc2)CC1 ZINC000267902955 565134134 /nfs/dbraw/zinc/13/41/34/565134134.db2.gz CAEYTEDGIRQTGQ-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN C[C@H]1CCCCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000184410330 565134824 /nfs/dbraw/zinc/13/48/24/565134824.db2.gz OZHCKSQTRKSYAI-JTQLQIEISA-N 0 0 388.205 3.462 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N(C[C@@H]1CCOC1)C1CC1 ZINC000267912422 565134788 /nfs/dbraw/zinc/13/47/88/565134788.db2.gz FJJDTWOYHVQABZ-VIFPVBQESA-N 0 0 387.205 3.138 20 5 GGBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CSc2nnnn2CC(F)(F)F)c1 ZINC000292783599 565134928 /nfs/dbraw/zinc/13/49/28/565134928.db2.gz YUWLOHQYGHHLJM-UHFFFAOYSA-N 0 0 387.265 3.455 20 5 GGBDRN CO[C@@H]1CCCC[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267916611 565135085 /nfs/dbraw/zinc/13/50/85/565135085.db2.gz HNDCNESSEITODJ-CMPLNLGQSA-N 0 0 375.194 3.184 20 5 GGBDRN O=[N+]([O-])c1cn(Cc2coc(-c3ccc(I)cc3)n2)cn1 ZINC000157544484 565135571 /nfs/dbraw/zinc/13/55/71/565135571.db2.gz HZWHEWIAQOZQNK-UHFFFAOYSA-N 0 0 396.144 3.099 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)cnn1C ZINC000267955937 565135629 /nfs/dbraw/zinc/13/56/29/565135629.db2.gz YDASOQBCLRVBKA-SSDOTTSWSA-N 0 0 385.193 3.029 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@@H]2CCO[C@@H]21 ZINC000267955843 565136014 /nfs/dbraw/zinc/13/60/14/565136014.db2.gz XYZQVZAWDRPYBD-CKLFPEKLSA-N 0 0 387.205 3.040 20 5 GGBDRN O=[N+]([O-])c1cnn(CC[S@@](=O)Cc2ccc(Br)cc2Cl)c1 ZINC000157531521 565136145 /nfs/dbraw/zinc/13/61/45/565136145.db2.gz AOBOSJABFFTKSL-NRFANRHFSA-N 0 0 392.662 3.156 20 5 GGBDRN COC(C)(C)C[C@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267959656 565136172 /nfs/dbraw/zinc/13/61/72/565136172.db2.gz ZICYELJLPNGBAL-QMMMGPOBSA-N 0 0 377.210 3.430 20 5 GGBDRN CN(C[C@@H]1CCCCO1)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267958087 565136257 /nfs/dbraw/zinc/13/62/57/565136257.db2.gz SBSZOIRPOCXLIK-JTQLQIEISA-N 0 0 375.194 3.138 20 5 GGBDRN CN(C[C@H]1CCCCO1)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267958089 565136355 /nfs/dbraw/zinc/13/63/55/565136355.db2.gz SBSZOIRPOCXLIK-SNVBAGLBSA-N 0 0 375.194 3.138 20 5 GGBDRN C[C@@H](c1ccc(OC(F)(F)F)cc1)[S@@](=O)CCn1cc([N+](=O)[O-])cn1 ZINC000157570230 565137056 /nfs/dbraw/zinc/13/70/56/565137056.db2.gz JMZVAGZGDBHWJB-UXMMLNGASA-N 0 0 377.344 3.200 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@H](c2ccc(F)c(Br)c2)C1 ZINC000184479151 565137020 /nfs/dbraw/zinc/13/70/20/565137020.db2.gz BTRRRRPZDBLYLB-ZDUSSCGKSA-N 0 0 399.172 3.303 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCc2ccc(Br)cc21 ZINC000184477497 565137033 /nfs/dbraw/zinc/13/70/33/565137033.db2.gz GVHIBVQGNWEVFV-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)S(=O)(=O)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000184470979 565137452 /nfs/dbraw/zinc/13/74/52/565137452.db2.gz ZADPLDJIZLDRNV-OAHLLOKOSA-N 0 0 381.479 3.199 20 5 GGBDRN Cc1csc(C2(NS(=O)(=O)Cc3ccccc3[N+](=O)[O-])CCCC2)n1 ZINC000184478947 565137545 /nfs/dbraw/zinc/13/75/45/565137545.db2.gz SYIKMIJEELNBSJ-UHFFFAOYSA-N 0 0 381.479 3.249 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000157579469 565137622 /nfs/dbraw/zinc/13/76/22/565137622.db2.gz KESSWNCPQGZNDB-JKSUJKDBSA-N 0 0 391.221 3.408 20 5 GGBDRN C[C@H](O)CC(C)(C)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268015217 565138672 /nfs/dbraw/zinc/13/86/72/565138672.db2.gz DNMKEEALNIZMNK-QMMMGPOBSA-N 0 0 377.210 3.023 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000268072700 565139603 /nfs/dbraw/zinc/13/96/03/565139603.db2.gz FMNLVBMPVYJXDN-CIRKLDFFSA-N 0 0 387.889 3.127 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCSC[C@H]1c1nccs1 ZINC000184520840 565140244 /nfs/dbraw/zinc/14/02/44/565140244.db2.gz FLQNTJWOHGZOQI-ZDUSSCGKSA-N 0 0 381.504 3.460 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCSC[C@@H]1c1nccs1 ZINC000184512599 565140651 /nfs/dbraw/zinc/14/06/51/565140651.db2.gz AQFLTZAQLVEGRV-CYBMUJFWSA-N 0 0 379.463 3.137 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])[C@H]1c1ccncc1 ZINC000292968747 565143477 /nfs/dbraw/zinc/14/34/77/565143477.db2.gz KYOBFEJHNJIFHU-HNNXBMFYSA-N 0 0 381.841 3.415 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@H]2C[C@H](O)c2ccco2)c(Br)c1 ZINC000268209499 565144328 /nfs/dbraw/zinc/14/43/28/565144328.db2.gz OLCIIOPXMFXCMQ-GWCFXTLKSA-N 0 0 382.214 3.438 20 5 GGBDRN COc1cc(C(=O)NC[C@@]2(C)CCCS2)c([N+](=O)[O-])cc1OC(F)F ZINC000268273256 565145876 /nfs/dbraw/zinc/14/58/76/565145876.db2.gz MRMHXMLLQVZYJU-OAHLLOKOSA-N 0 0 376.381 3.220 20 5 GGBDRN C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000268234434 565145931 /nfs/dbraw/zinc/14/59/31/565145931.db2.gz BWMMPBADAZRMSR-SNVBAGLBSA-N 0 0 384.219 3.283 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cc(Br)ccc1NC1CC1 ZINC000268266138 565146011 /nfs/dbraw/zinc/14/60/11/565146011.db2.gz MFYKFBJLQODWHO-UHFFFAOYSA-N 0 0 394.229 3.157 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000184603018 565146473 /nfs/dbraw/zinc/14/64/73/565146473.db2.gz RYNJPJNRXXEHAQ-INIZCTEOSA-N 0 0 384.841 3.055 20 5 GGBDRN CS(=O)(=O)c1cc(Br)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000157868801 565146592 /nfs/dbraw/zinc/14/65/92/565146592.db2.gz FBASUURIXMZGBX-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN C[C@@H](C[S@@](C)=O)NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000184594938 565146693 /nfs/dbraw/zinc/14/66/93/565146693.db2.gz DVQWNXASAILZNZ-UOXLDJKESA-N 0 0 384.523 3.374 20 5 GGBDRN Cc1nc(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)c(C)o1 ZINC000293018628 565147191 /nfs/dbraw/zinc/14/71/91/565147191.db2.gz MMEHEVGXELEWHG-UHFFFAOYSA-N 0 0 380.198 3.161 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000184612702 565147727 /nfs/dbraw/zinc/14/77/27/565147727.db2.gz GOFBKXBGTCGEFB-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184615840 565147760 /nfs/dbraw/zinc/14/77/60/565147760.db2.gz YERXDXDQPWRDGR-UHFFFAOYSA-N 0 0 395.384 3.032 20 5 GGBDRN C[C@@H]1CN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C[C@H](c2ccsc2)O1 ZINC000268332856 565148645 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CC[S@](=O)[C@@H]1CCC[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000268496311 565154598 /nfs/dbraw/zinc/15/45/98/565154598.db2.gz QJXYUIBYJHYIAI-BJFPOWJFSA-N 0 0 376.276 3.244 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC(n2cc(Br)cn2)CC1 ZINC000370650748 565154690 /nfs/dbraw/zinc/15/46/90/565154690.db2.gz NEBOQQWFIRONEN-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN CC(C)CC(=O)N1CCC(Nc2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000268519634 565156166 /nfs/dbraw/zinc/15/61/66/565156166.db2.gz ZPRHDMZUAUVRQO-UHFFFAOYSA-N 0 0 385.262 3.201 20 5 GGBDRN C[C@@H](c1cccnc1)N1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000268502691 565156449 /nfs/dbraw/zinc/15/64/49/565156449.db2.gz SSYAFDAIXPYKKW-LBPRGKRZSA-N 0 0 392.257 3.031 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1OC[C@H](O)COc1ccc(Br)cc1 ZINC000184776330 565156653 /nfs/dbraw/zinc/15/66/53/565156653.db2.gz UVCUALHBAKCJIV-LLVKDONJSA-N 0 0 386.173 3.315 20 5 GGBDRN CN(C(=O)c1cccc(I)c1)c1cccc([N+](=O)[O-])c1 ZINC000158128908 565156926 /nfs/dbraw/zinc/15/69/26/565156926.db2.gz IMUFGPIXEUQJRN-UHFFFAOYSA-N 0 0 382.157 3.476 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(Cl)cc1F ZINC000184826185 565159006 /nfs/dbraw/zinc/15/90/06/565159006.db2.gz XVDHVKBGMURYDV-UHFFFAOYSA-N 0 0 386.166 3.296 20 5 GGBDRN COC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1Br)c1ccc(C)o1 ZINC000184842237 565159606 /nfs/dbraw/zinc/15/96/06/565159606.db2.gz HZNMURJDVYTVKY-NSHDSACASA-N 0 0 383.198 3.376 20 5 GGBDRN COC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1Br)c1ccc(C)o1 ZINC000184842216 565159726 /nfs/dbraw/zinc/15/97/26/565159726.db2.gz HZNMURJDVYTVKY-LLVKDONJSA-N 0 0 383.198 3.376 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000158190231 565160043 /nfs/dbraw/zinc/16/00/43/565160043.db2.gz IBQAIXCGASZXLQ-CABZTGNLSA-N 0 0 390.870 3.100 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1Br ZINC000158189598 565160061 /nfs/dbraw/zinc/16/00/61/565160061.db2.gz KBOKYQGUEVWJOM-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CCc1noc(CC)c1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000184859123 565161170 /nfs/dbraw/zinc/16/11/70/565161170.db2.gz KEALTIHNPLZMCN-UHFFFAOYSA-N 0 0 382.214 3.400 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(n2cc(Br)cn2)CC1 ZINC000370799608 565161408 /nfs/dbraw/zinc/16/14/08/565161408.db2.gz CNOOCAJDWHQEPA-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN CC(C)C[C@@H](CCO)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268645846 565161386 /nfs/dbraw/zinc/16/13/86/565161386.db2.gz PDUVUYHKNSMKEC-SNVBAGLBSA-N 0 0 391.237 3.271 20 5 GGBDRN COc1ccc(CNC(=O)COc2ccccc2[N+](=O)[O-])cc1Br ZINC000158216129 565161840 /nfs/dbraw/zinc/16/18/40/565161840.db2.gz FGLAYZDMKJIVOL-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN CN(C(=O)Cc1ccccc1I)c1cccc([N+](=O)[O-])c1 ZINC000158277909 565163565 /nfs/dbraw/zinc/16/35/65/565163565.db2.gz HUHOFGHLYQZFKL-UHFFFAOYSA-N 0 0 396.184 3.405 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1ncc(-c2ccccc2F)o1 ZINC000158296056 565164889 /nfs/dbraw/zinc/16/48/89/565164889.db2.gz OGIRLJFZGZPJAI-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN C[C@@H](c1ccc(Cl)c(Cl)c1)S(=O)(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000158301088 565164932 /nfs/dbraw/zinc/16/49/32/565164932.db2.gz AOVFDYGHAIKYPR-VIFPVBQESA-N 0 0 378.237 3.274 20 5 GGBDRN O=C(NC[C@@H]1OCCc2ccccc21)c1cc([N+](=O)[O-])ccc1Br ZINC000370906253 565166693 /nfs/dbraw/zinc/16/66/93/565166693.db2.gz UUIPYUGGEHTPKG-INIZCTEOSA-N 0 0 391.221 3.401 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCOC[C@@H]1c1ccco1 ZINC000370904686 565167083 /nfs/dbraw/zinc/16/70/83/565167083.db2.gz KWZQBSGQYNWGOZ-CYBMUJFWSA-N 0 0 381.182 3.164 20 5 GGBDRN NC(=O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(Br)cc1 ZINC000185036160 565173302 /nfs/dbraw/zinc/17/33/02/565173302.db2.gz DXNUINUYBBNIHB-CQSZACIVSA-N 0 0 398.644 3.327 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC(=O)Nc2ccc(Br)cc21 ZINC000371034406 565173777 /nfs/dbraw/zinc/17/37/77/565173777.db2.gz SXTICWCFTRGSPJ-UHFFFAOYSA-N 0 0 382.195 3.018 20 5 GGBDRN CC(C)c1csc(CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000158576246 565175416 /nfs/dbraw/zinc/17/54/16/565175416.db2.gz XMFYRSAJQBODSL-UHFFFAOYSA-N 0 0 382.829 3.083 20 5 GGBDRN O=C(N[C@@H]1CCCc2c[nH]nc21)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000269041826 565176497 /nfs/dbraw/zinc/17/64/97/565176497.db2.gz YNACWUDSGGHICY-SNVBAGLBSA-N 0 0 383.177 3.027 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@@H]2[C@H]1[C@H]2C(F)(F)F ZINC000371072477 565176521 /nfs/dbraw/zinc/17/65/21/565176521.db2.gz IPNOPIHEMMIUNZ-LSJOCFKGSA-N 0 0 379.132 3.380 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1COc2ccc(Br)cc21 ZINC000158780390 565181224 /nfs/dbraw/zinc/18/12/24/565181224.db2.gz MRNGDOGNGCTJBU-OAHLLOKOSA-N 0 0 391.221 3.192 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCC2(CCOCC2)C1 ZINC000269300584 565184228 /nfs/dbraw/zinc/18/42/28/565184228.db2.gz YAAHJYCDSIEUQE-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN COC1CCC(N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)CC1 ZINC000269280099 565185034 /nfs/dbraw/zinc/18/50/34/565185034.db2.gz KEIBDHXYLOFCPM-UHFFFAOYSA-N 0 0 376.862 3.135 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000269282804 565185041 /nfs/dbraw/zinc/18/50/41/565185041.db2.gz BAZANOJCIOSNHV-JTQLQIEISA-N 0 0 379.214 3.100 20 5 GGBDRN COc1cccc(NCC(=O)Nc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000185207416 565186896 /nfs/dbraw/zinc/18/68/96/565186896.db2.gz ZVOWDKWAIGYJPY-UHFFFAOYSA-N 0 0 380.198 3.417 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)c1[N+](=O)[O-] ZINC000269377333 565188140 /nfs/dbraw/zinc/18/81/40/565188140.db2.gz IJMQPKZMZWFJSW-VWLOTQADSA-N 0 0 384.845 3.226 20 5 GGBDRN CC(C)Oc1cc(Br)cc(NC(=O)c2cc([N+](=O)[O-])cnc2N)c1 ZINC000185247773 565189259 /nfs/dbraw/zinc/18/92/59/565189259.db2.gz MTSNQVLPVPLDLQ-UHFFFAOYSA-N 0 0 395.213 3.374 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCCC(F)(F)F)c(C(F)(F)F)c1 ZINC000269461372 565190753 /nfs/dbraw/zinc/19/07/53/565190753.db2.gz HKFFAURREKBSFS-UHFFFAOYSA-N 0 0 380.266 3.234 20 5 GGBDRN CCOC1(CNC(=O)c2sc(Br)cc2[N+](=O)[O-])CCCC1 ZINC000293929040 565190840 /nfs/dbraw/zinc/19/08/40/565190840.db2.gz JBUGTMSJVGPYRJ-UHFFFAOYSA-N 0 0 377.260 3.498 20 5 GGBDRN CC(C)(NC(=O)Cc1cc[nH]c(=O)c1Br)c1ccccc1[N+](=O)[O-] ZINC000293906272 565191053 /nfs/dbraw/zinc/19/10/53/565191053.db2.gz HPGUTSLAFWKDAA-UHFFFAOYSA-N 0 0 394.225 3.052 20 5 GGBDRN Cc1cc(S(=O)(=O)N2Cc3cccc(Br)c3C2)ccc1[N+](=O)[O-] ZINC000185298473 565194554 /nfs/dbraw/zinc/19/45/54/565194554.db2.gz HXOYVHVIIUEXGE-UHFFFAOYSA-N 0 0 397.250 3.370 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1Cc2cccc(Br)c2C1 ZINC000185297099 565194712 /nfs/dbraw/zinc/19/47/12/565194712.db2.gz KJTFWDXTBIXUFO-UHFFFAOYSA-N 0 0 383.223 3.062 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2Cc3cccc(Br)c3C2)cc1[N+](=O)[O-] ZINC000185298928 565195080 /nfs/dbraw/zinc/19/50/80/565195080.db2.gz GDUVYVTYTWBKES-UHFFFAOYSA-N 0 0 397.250 3.370 20 5 GGBDRN O=C(NCCOCC1CC1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000269675461 565196489 /nfs/dbraw/zinc/19/64/89/565196489.db2.gz JRFNKSSBQUGIJN-UHFFFAOYSA-N 0 0 377.622 3.167 20 5 GGBDRN COC(=O)C(C)(C)c1csc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000294071823 565197179 /nfs/dbraw/zinc/19/71/79/565197179.db2.gz PKQGSNOIYZCKQY-UHFFFAOYSA-N 0 0 383.813 3.408 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000185368038 565198142 /nfs/dbraw/zinc/19/81/42/565198142.db2.gz XCBDHCRDCHESDY-VWLOTQADSA-N 0 0 385.804 3.446 20 5 GGBDRN NC(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000159202181 565198358 /nfs/dbraw/zinc/19/83/58/565198358.db2.gz BHLSIUMPTYHHME-UHFFFAOYSA-N 0 0 379.170 3.100 20 5 GGBDRN CCN(Cc1cccs1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185404396 565199263 /nfs/dbraw/zinc/19/92/63/565199263.db2.gz IRMHLSPQDJMKCC-UHFFFAOYSA-N 0 0 377.447 3.415 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCCC3(CC3)C2)cc1[N+](=O)[O-] ZINC000185405113 565199304 /nfs/dbraw/zinc/19/93/04/565199304.db2.gz UHMYJKYKJWIIFH-UHFFFAOYSA-N 0 0 389.271 3.230 20 5 GGBDRN CC[C@H]1[C@@H](C)CCN1C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000185413514 565200405 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SJOMNNIKPRNZER-UHFFFAOYSA-N 0 0 382.438 3.493 20 5 GGBDRN CO[C@H]1CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)[C@@H](C)C1 ZINC000295157742 565248509 /nfs/dbraw/zinc/24/85/09/565248509.db2.gz ASTFAQXVCYWZNV-IUCAKERBSA-N 0 0 383.253 3.090 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000186226747 565248820 /nfs/dbraw/zinc/24/88/20/565248820.db2.gz NHCKHPRLPRPOFX-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N[C@H]2CCO[C@H](C3CC3)C2)c1Cl ZINC000295166858 565248932 /nfs/dbraw/zinc/24/89/32/565248932.db2.gz PNQIJGWZNJUKBW-CABZTGNLSA-N 0 0 395.264 3.138 20 5 GGBDRN CCOc1ccc(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1OC ZINC000271353447 565249874 /nfs/dbraw/zinc/24/98/74/565249874.db2.gz XRXWCFIBGRGQPG-UHFFFAOYSA-N 0 0 386.451 3.079 20 5 GGBDRN CN(CCc1nccs1)S(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC000295181397 565250842 /nfs/dbraw/zinc/25/08/42/565250842.db2.gz PRKNWWXHEYBOGA-UHFFFAOYSA-N 0 0 396.277 3.221 20 5 GGBDRN COC(=O)C(C)(C)c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n1 ZINC000295215137 565251412 /nfs/dbraw/zinc/25/14/12/565251412.db2.gz ANDLBMPCDUWJMT-UHFFFAOYSA-N 0 0 383.813 3.408 20 5 GGBDRN COC[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000271388198 565251756 /nfs/dbraw/zinc/25/17/56/565251756.db2.gz UOJZLZFFAOFQMS-LLVKDONJSA-N 0 0 392.405 3.138 20 5 GGBDRN CC1(C)C[C@H](NS(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CCO1 ZINC000295212116 565251930 /nfs/dbraw/zinc/25/19/30/565251930.db2.gz USYXXQCAQIOGNA-MRVPVSSYSA-N 0 0 383.253 3.138 20 5 GGBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OS(=O)(=O)C[C@@H]1CCCCC1(F)F ZINC000295220723 565252507 /nfs/dbraw/zinc/25/25/07/565252507.db2.gz VPZHSYBQCAZPTB-NSHDSACASA-N 0 0 377.365 3.332 20 5 GGBDRN CCC1(CO)CCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CC1 ZINC000295242621 565254445 /nfs/dbraw/zinc/25/44/45/565254445.db2.gz YFXFDCYQDIGEQV-UHFFFAOYSA-N 0 0 397.280 3.075 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1[N+](=O)[O-] ZINC000160648564 565254595 /nfs/dbraw/zinc/25/45/95/565254595.db2.gz YIWISKDBUYOVMK-UHFFFAOYSA-N 0 0 390.193 3.413 20 5 GGBDRN C[C@@H](CCO)CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000295257906 565255456 /nfs/dbraw/zinc/25/54/56/565255456.db2.gz AVSYIQCNNDREFM-MRVPVSSYSA-N 0 0 379.638 3.149 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)NC(=O)CS2 ZINC000186350197 565257429 /nfs/dbraw/zinc/25/74/29/565257429.db2.gz HMZBJJBFBHWRAL-UHFFFAOYSA-N 0 0 377.809 3.222 20 5 GGBDRN COc1ccc(OS(=O)(=O)C2CCC(C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000295315546 565259087 /nfs/dbraw/zinc/25/90/87/565259087.db2.gz NQKORMGCKNZRHA-UHFFFAOYSA-N 0 0 383.344 3.433 20 5 GGBDRN CC(C)C[C@H](CO)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000160796622 565259073 /nfs/dbraw/zinc/25/90/73/565259073.db2.gz SLUGXADPLOVPKD-SECBINFHSA-N 0 0 379.638 3.148 20 5 GGBDRN Cc1csc([C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(F)(F)F)n1 ZINC000295316642 565259169 /nfs/dbraw/zinc/25/91/69/565259169.db2.gz IDMTZEOVBPPCCU-GFCCVEGCSA-N 0 0 375.328 3.158 20 5 GGBDRN COCCC1(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CCCCC1 ZINC000186420325 565260775 /nfs/dbraw/zinc/26/07/75/565260775.db2.gz HPKQTPGVXDTFJO-UHFFFAOYSA-N 0 0 376.500 3.459 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000271606978 565261195 /nfs/dbraw/zinc/26/11/95/565261195.db2.gz JKCHFUUDUNKNOY-NSHDSACASA-N 0 0 395.261 3.309 20 5 GGBDRN Cc1csc([C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(F)(F)F)n1 ZINC000295349818 565261172 /nfs/dbraw/zinc/26/11/72/565261172.db2.gz KGUYGYROZRNYAE-LBPRGKRZSA-N 0 0 375.328 3.158 20 5 GGBDRN COCCN(Cc1ccco1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000160857507 565261831 /nfs/dbraw/zinc/26/18/31/565261831.db2.gz QFVDHWGZAFJXRP-UHFFFAOYSA-N 0 0 383.198 3.239 20 5 GGBDRN CC(C)(CO)CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000295374064 565262498 /nfs/dbraw/zinc/26/24/98/565262498.db2.gz HSJBPBFGNPSDRJ-UHFFFAOYSA-N 0 0 379.638 3.149 20 5 GGBDRN C[C@@H](CCCO)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000295409621 565264926 /nfs/dbraw/zinc/26/49/26/565264926.db2.gz LABJTANURPGXMA-QMMMGPOBSA-N 0 0 379.638 3.149 20 5 GGBDRN CC(C)(CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccccn1 ZINC000295478745 565267907 /nfs/dbraw/zinc/26/79/07/565267907.db2.gz NXNAZEGJNCFFEU-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN Cn1ccnc1[C@H]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000373057597 565268103 /nfs/dbraw/zinc/26/81/03/565268103.db2.gz NEUDTMNHGXKYKN-NSHDSACASA-N 0 0 393.241 3.111 20 5 GGBDRN C[C@@H](CCO)C1(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])CCC1 ZINC000271790916 565268323 /nfs/dbraw/zinc/26/83/23/565268323.db2.gz CLAYENYRCCOXKP-NSHDSACASA-N 0 0 385.258 3.276 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000295484689 565269137 /nfs/dbraw/zinc/26/91/37/565269137.db2.gz CJIMDUHOFNDDFN-GOEBONIOSA-N 0 0 381.226 3.141 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2nnnn2C2CCOCC2)cc1C(F)(F)F ZINC000161026992 565269148 /nfs/dbraw/zinc/26/91/48/565269148.db2.gz YKPULLWJCVJFPI-UHFFFAOYSA-N 0 0 375.332 3.103 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)CC2CC(F)(F)C2)c(Br)c1 ZINC000295492551 565269389 /nfs/dbraw/zinc/26/93/89/565269389.db2.gz HADVEGSGKXTZAD-UHFFFAOYSA-N 0 0 386.170 3.111 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000295484669 565269594 /nfs/dbraw/zinc/26/95/94/565269594.db2.gz CJIMDUHOFNDDFN-GDBMZVCRSA-N 0 0 381.226 3.141 20 5 GGBDRN CO[C@H](c1ccccc1F)[C@@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271870891 565270842 /nfs/dbraw/zinc/27/08/42/565270842.db2.gz SAVGTNBVSNMWKY-OTYXRUKQSA-N 0 0 388.442 3.387 20 5 GGBDRN CO[C@@H](c1ccccc1F)[C@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271870890 565271266 /nfs/dbraw/zinc/27/12/66/565271266.db2.gz SAVGTNBVSNMWKY-LKFCYVNXSA-N 0 0 388.442 3.387 20 5 GGBDRN O=C(N[C@@H](c1ccc(Br)cc1)C1CCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000161049733 565271696 /nfs/dbraw/zinc/27/16/96/565271696.db2.gz XEEHMOOUMISMHW-CYBMUJFWSA-N 0 0 379.214 3.352 20 5 GGBDRN C[C@H](CCO)C1(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)CCC1 ZINC000271911256 565272234 /nfs/dbraw/zinc/27/22/34/565272234.db2.gz RNDPCAUSCIEFEY-LLVKDONJSA-N 0 0 385.258 3.276 20 5 GGBDRN CC[C@@H]1[C@@H](C)CCN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000186611639 565272216 /nfs/dbraw/zinc/27/22/16/565272216.db2.gz WOOLOYHLLXNPML-GXSJLCMTSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C(Nc1cnc2c(c1)COCC2)c1sc(Br)cc1[N+](=O)[O-] ZINC000373167388 565272660 /nfs/dbraw/zinc/27/26/60/565272660.db2.gz XXCKMZSPKANEKP-UHFFFAOYSA-N 0 0 384.211 3.139 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCSC[C@H]2c2nccs2)c2c(c1)COCO2 ZINC000186644609 565274438 /nfs/dbraw/zinc/27/44/38/565274438.db2.gz XZDBCMQDGDODFE-AWEZNQCLSA-N 0 0 379.463 3.208 20 5 GGBDRN CN(CC(F)(F)Br)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000295587657 565274551 /nfs/dbraw/zinc/27/45/51/565274551.db2.gz WHSPDNVKCLRYDP-UHFFFAOYSA-N 0 0 379.157 3.004 20 5 GGBDRN O=C(c1ccc(Br)c(F)c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373270433 565276788 /nfs/dbraw/zinc/27/67/88/565276788.db2.gz KMIAWHVGMZLNQT-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN O=C(Nc1nnc(CC(F)(F)F)s1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272083456 565277198 /nfs/dbraw/zinc/27/71/98/565277198.db2.gz BNRQKNLLADFVKU-UHFFFAOYSA-N 0 0 382.270 3.282 20 5 GGBDRN CC(C)[C@@]1(CO)CCCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000295625898 565277435 /nfs/dbraw/zinc/27/74/35/565277435.db2.gz PIZOGULBUBZXIR-INIZCTEOSA-N 0 0 385.258 3.228 20 5 GGBDRN Cc1ccc(Br)c(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000373314044 565278881 /nfs/dbraw/zinc/27/88/81/565278881.db2.gz SMIIOXZRLWHHMD-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN CO[C@H](CNC(=O)c1sc(Br)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000295675523 565280302 /nfs/dbraw/zinc/28/03/02/565280302.db2.gz IDFSBUYWWIENOH-NSHDSACASA-N 0 0 399.266 3.406 20 5 GGBDRN CSC1(CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CCOCC1 ZINC000272203119 565280531 /nfs/dbraw/zinc/28/05/31/565280531.db2.gz DHZMYKGYCKNZLE-UHFFFAOYSA-N 0 0 387.889 3.002 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@@H]1[C@H]1CCCC1=O ZINC000272216173 565281803 /nfs/dbraw/zinc/28/18/03/565281803.db2.gz SLDGVZHNSRAJGE-ZYHUDNBSSA-N 0 0 399.216 3.470 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@@H]1[C@@H]1CCCC1=O ZINC000272216170 565282061 /nfs/dbraw/zinc/28/20/61/565282061.db2.gz SLDGVZHNSRAJGE-CMPLNLGQSA-N 0 0 399.216 3.470 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[C@H]1OCCc2sccc21 ZINC000295707255 565282550 /nfs/dbraw/zinc/28/25/50/565282550.db2.gz RABYNWXSVDFJJV-QLJPJBMISA-N 0 0 382.463 3.174 20 5 GGBDRN CSc1cccc(C(=O)Nc2cc(Br)cn(C)c2=O)c1[N+](=O)[O-] ZINC000186744559 565282626 /nfs/dbraw/zinc/28/26/26/565282626.db2.gz RKNSCSPDVWYMOW-UHFFFAOYSA-N 0 0 398.238 3.030 20 5 GGBDRN Cc1cnc([C@@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000186740064 565282638 /nfs/dbraw/zinc/28/26/38/565282638.db2.gz SUAKGBVBSARDKZ-QMMMGPOBSA-N 0 0 375.859 3.095 20 5 GGBDRN Cc1nn([C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000272323994 565284075 /nfs/dbraw/zinc/28/40/75/565284075.db2.gz BOJWPDJWLZMBIE-NSHDSACASA-N 0 0 381.230 3.082 20 5 GGBDRN O=C1[C@@H](Nc2ccc(Br)cc2[N+](=O)[O-])CCCN1CC(F)(F)F ZINC000161517742 565286745 /nfs/dbraw/zinc/28/67/45/565286745.db2.gz KYAABVSQIYUQKH-JTQLQIEISA-N 0 0 396.163 3.323 20 5 GGBDRN CN(C[C@H]1CCCC[C@H]1O)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000272459714 565287419 /nfs/dbraw/zinc/28/74/19/565287419.db2.gz KPWPNAFNCHUQGD-NOZJJQNGSA-N 0 0 389.221 3.120 20 5 GGBDRN Cn1ccnc1[C@@H]1N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1(C)C ZINC000295818962 565288306 /nfs/dbraw/zinc/28/83/06/565288306.db2.gz HNAXULCHDISQEG-ZDUSSCGKSA-N 0 0 393.241 3.314 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1nc2c(s1)COCC2 ZINC000272539683 565290041 /nfs/dbraw/zinc/29/00/41/565290041.db2.gz NKWZJQMFCDTMNE-UHFFFAOYSA-N 0 0 382.829 3.142 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccsc1Cl ZINC000186845751 565290130 /nfs/dbraw/zinc/29/01/30/565290130.db2.gz VKFCOVZXFQKSFX-UHFFFAOYSA-N 0 0 381.841 3.387 20 5 GGBDRN COCC[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccco1 ZINC000272671829 565293128 /nfs/dbraw/zinc/29/31/28/565293128.db2.gz KIYKZEVMELWPOD-GFCCVEGCSA-N 0 0 383.198 3.458 20 5 GGBDRN COCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccco1 ZINC000272670268 565293282 /nfs/dbraw/zinc/29/32/82/565293282.db2.gz KAYFQBFHFQVHPB-CYBMUJFWSA-N 0 0 383.198 3.458 20 5 GGBDRN CC[C@@H](O)[C@@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000161837433 565293716 /nfs/dbraw/zinc/29/37/16/565293716.db2.gz VOGAUYUNUCQWCH-WCQYABFASA-N 0 0 397.280 3.216 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(CC(F)(F)F)[C@H](C)C2)c1[N+](=O)[O-] ZINC000186905395 565294248 /nfs/dbraw/zinc/29/42/48/565294248.db2.gz QREAQLKFRMSIAA-SNVBAGLBSA-N 0 0 377.388 3.025 20 5 GGBDRN CN(CC1(O)CCCCCC1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000186933089 565296266 /nfs/dbraw/zinc/29/62/66/565296266.db2.gz HUDNIRBXRNJUAC-UHFFFAOYSA-N 0 0 399.285 3.444 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Nc2ccc(NC(=O)C3CC3)cc2)s1 ZINC000272780050 565297050 /nfs/dbraw/zinc/29/70/50/565297050.db2.gz AEVJTPYTAANFHQ-UHFFFAOYSA-N 0 0 381.435 3.152 20 5 GGBDRN C[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@@H]1CCCN(C2CCC2)C1 ZINC000272792391 565297794 /nfs/dbraw/zinc/29/77/94/565297794.db2.gz CLBQTURPBBRUMW-NWDGAFQWSA-N 0 0 387.527 3.125 20 5 GGBDRN CC[C@@H](CNC(=O)c1[nH]ncc1[N+](=O)[O-])Cc1cccc(Br)c1 ZINC000161960055 565299015 /nfs/dbraw/zinc/29/90/15/565299015.db2.gz UPSXMQGUDHOKRI-SNVBAGLBSA-N 0 0 381.230 3.079 20 5 GGBDRN CO[C@@H]1CCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000296057877 565299671 /nfs/dbraw/zinc/29/96/71/565299671.db2.gz NJWKWECFWFKEKH-SECBINFHSA-N 0 0 377.260 3.306 20 5 GGBDRN COc1cc(OS(=O)(=O)C2CCC(C(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000296047715 565299907 /nfs/dbraw/zinc/29/99/07/565299907.db2.gz FPCGJEYQQNQSEU-UHFFFAOYSA-N 0 0 383.344 3.433 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC(Oc3ccccc3)CC2)s1 ZINC000272868220 565300444 /nfs/dbraw/zinc/30/04/44/565300444.db2.gz SAXKLCXSXNFSRA-UHFFFAOYSA-N 0 0 382.463 3.108 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC(CCCO)CC1 ZINC000272877741 565300779 /nfs/dbraw/zinc/30/07/79/565300779.db2.gz XIKNCGXEXPBQMN-UHFFFAOYSA-N 0 0 389.221 3.121 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCC(O)(c3scnc3Br)CC2)n1 ZINC000373770392 565302068 /nfs/dbraw/zinc/30/20/68/565302068.db2.gz XXQNHCPWQHFMGN-UHFFFAOYSA-N 0 0 399.270 3.005 20 5 GGBDRN CSC1(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CCOCC1 ZINC000272915703 565302202 /nfs/dbraw/zinc/30/22/02/565302202.db2.gz DRKARCDOEIQMHL-UHFFFAOYSA-N 0 0 390.914 3.369 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NC1CCC2(CC1)OCCO2 ZINC000272914911 565302602 /nfs/dbraw/zinc/30/26/02/565302602.db2.gz HLXYTZHQIAZLQO-UHFFFAOYSA-N 0 0 386.857 3.142 20 5 GGBDRN CC[C@@H](C)[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)OC ZINC000296145803 565304470 /nfs/dbraw/zinc/30/44/70/565304470.db2.gz RHEWLOHOQUSWEL-PRHODGIISA-N 0 0 377.210 3.287 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCS[C@@H]2COCC[C@@H]21 ZINC000272998703 565304597 /nfs/dbraw/zinc/30/45/97/565304597.db2.gz MFOJZSINWZBIFA-SMDDNHRTSA-N 0 0 388.898 3.073 20 5 GGBDRN C[C@H]1C[C@@H](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO1 ZINC000273112965 565307764 /nfs/dbraw/zinc/30/77/64/565307764.db2.gz CPKFLMKDXCQCBJ-UWVGGRQHSA-N 0 0 389.221 3.431 20 5 GGBDRN Cn1ncc2c1CCC[C@H]2NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000273109579 565308020 /nfs/dbraw/zinc/30/80/20/565308020.db2.gz MQNXZCAOCKKYHQ-GFCCVEGCSA-N 0 0 380.857 3.268 20 5 GGBDRN C/C=C/C[C@H](CO)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000187123297 565310728 /nfs/dbraw/zinc/31/07/28/565310728.db2.gz VXOXCGZDMFQKIR-GKQMSVHHSA-N 0 0 377.622 3.068 20 5 GGBDRN CSc1ccc(-c2nc(C3(S(C)(=O)=O)CCCC3)no2)cc1[N+](=O)[O-] ZINC000296289450 565311172 /nfs/dbraw/zinc/31/11/72/565311172.db2.gz CZWPJLQSTHNZRP-UHFFFAOYSA-N 0 0 383.451 3.181 20 5 GGBDRN CC(C)(C)c1csc(CNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])n1 ZINC000162262272 565311744 /nfs/dbraw/zinc/31/17/44/565311744.db2.gz AOKFPSSNAYZQLL-UHFFFAOYSA-N 0 0 383.495 3.011 20 5 GGBDRN CO[C@]1(C)CCCN(S(=O)(=O)c2c(Cl)ccc([N+](=O)[O-])c2Cl)CC1 ZINC000296324741 565312317 /nfs/dbraw/zinc/31/23/17/565312317.db2.gz QJPTYTGWNUKZQY-CQSZACIVSA-N 0 0 397.280 3.481 20 5 GGBDRN Cc1cccnc1CCCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000296343816 565313522 /nfs/dbraw/zinc/31/35/22/565313522.db2.gz DETQNZCAOZHQHG-UHFFFAOYSA-N 0 0 378.226 3.423 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)c1 ZINC000374001122 565314744 /nfs/dbraw/zinc/31/47/44/565314744.db2.gz IGLWYKYVULWYNL-CYBMUJFWSA-N 0 0 385.804 3.308 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@@H](c3ccc(Cl)s3)C2)cc(F)cc1[N+](=O)[O-] ZINC000374076626 565318903 /nfs/dbraw/zinc/31/89/03/565318903.db2.gz FRSQGMRISOFRMW-LLVKDONJSA-N 0 0 385.804 3.245 20 5 GGBDRN O=[N+]([O-])c1cc(CNS(=O)(=O)CC2CC(F)(F)C2)cc(C(F)(F)F)c1 ZINC000296504755 565320503 /nfs/dbraw/zinc/32/05/03/565320503.db2.gz ZJOOMCBPDMRPLS-UHFFFAOYSA-N 0 0 388.314 3.078 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(F)cc2)c(C(F)(F)F)c1 ZINC000162691709 565324657 /nfs/dbraw/zinc/32/46/57/565324657.db2.gz AOMRBINDEZQFFN-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN Cc1cnc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000162759630 565327046 /nfs/dbraw/zinc/32/70/46/565327046.db2.gz PXYMVAKKCKELNB-UHFFFAOYSA-N 0 0 380.198 3.468 20 5 GGBDRN CC(C)(CCc1nc(-c2ccccc2I)no1)[N+](=O)[O-] ZINC000296654235 565327875 /nfs/dbraw/zinc/32/78/75/565327875.db2.gz DREYENGLQGQRHG-UHFFFAOYSA-N 0 0 387.177 3.329 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2ncoc2-c2ccccc2)s1 ZINC000374253023 565327889 /nfs/dbraw/zinc/32/78/89/565327889.db2.gz COPGDINSPXWJRG-UHFFFAOYSA-N 0 0 379.419 3.327 20 5 GGBDRN Cc1n[nH]c(C)c1[C@H]1COCCN1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000374258888 565328107 /nfs/dbraw/zinc/32/81/07/565328107.db2.gz NAYZUGXJRZTJEK-OAHLLOKOSA-N 0 0 395.257 3.271 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC(Oc2cccc(Br)c2)CC1 ZINC000273661112 565329745 /nfs/dbraw/zinc/32/97/45/565329745.db2.gz KDXHYVMMGHLSIA-UHFFFAOYSA-N 0 0 394.225 3.369 20 5 GGBDRN CC(C)(CCc1nc(CC(=O)Nc2ccccc2Br)no1)[N+](=O)[O-] ZINC000296687888 565329848 /nfs/dbraw/zinc/32/98/48/565329848.db2.gz GZOFNXLEQZSNMX-UHFFFAOYSA-N 0 0 397.229 3.001 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@H]1CCCC12CCOCC2 ZINC000374290251 565330269 /nfs/dbraw/zinc/33/02/69/565330269.db2.gz AHBPQCORMACPLZ-HNNXBMFYSA-N 0 0 397.269 3.365 20 5 GGBDRN COC[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccc(Cl)cc1 ZINC000296769518 565335735 /nfs/dbraw/zinc/33/57/35/565335735.db2.gz MOARONJBOYNRHL-HNNXBMFYSA-N 0 0 384.841 3.451 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(CC3CCOCC3)n2)c(Br)c1 ZINC000273788008 565336737 /nfs/dbraw/zinc/33/67/37/565336737.db2.gz HKSONHBMIZPILG-UHFFFAOYSA-N 0 0 382.214 3.300 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(C[C@@H]3CCCCO3)n2)c(Br)c1 ZINC000273834338 565338741 /nfs/dbraw/zinc/33/87/41/565338741.db2.gz MGBXBGQDCMUXCX-LBPRGKRZSA-N 0 0 382.214 3.443 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](c1ccc(Br)cc1)C1CCC1 ZINC000163182627 565339292 /nfs/dbraw/zinc/33/92/92/565339292.db2.gz DNMIZCKOLDKCPY-CQSZACIVSA-N 0 0 393.241 3.362 20 5 GGBDRN Cc1cnc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000163223628 565340291 /nfs/dbraw/zinc/34/02/91/565340291.db2.gz PPMGUXUYXLIIDL-UHFFFAOYSA-N 0 0 379.214 3.136 20 5 GGBDRN CCn1cc([C@@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)cn1 ZINC000296857136 565341006 /nfs/dbraw/zinc/34/10/06/565341006.db2.gz GLZHNALORSVZOV-MRVPVSSYSA-N 0 0 385.193 3.204 20 5 GGBDRN O=C(NC[C@H]1CCCCC1(F)F)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000296876014 565341898 /nfs/dbraw/zinc/34/18/98/565341898.db2.gz OOHDQDONGKEHAT-SECBINFHSA-N 0 0 375.759 3.128 20 5 GGBDRN C[C@@H]1SCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)[C@H]1C ZINC000163369211 565343781 /nfs/dbraw/zinc/34/37/81/565343781.db2.gz ROWONIMIEJJVAI-IUCAKERBSA-N 0 0 384.401 3.128 20 5 GGBDRN COC(=O)N(Cc1noc(-c2ccc([N+](=O)[O-])cc2Br)n1)C1CC1 ZINC000273891687 565344034 /nfs/dbraw/zinc/34/40/34/565344034.db2.gz PDUGWFRDQSLKHJ-UHFFFAOYSA-N 0 0 397.185 3.138 20 5 GGBDRN CSCC[C@@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163371488 565344737 /nfs/dbraw/zinc/34/47/37/565344737.db2.gz RYRBORNTSSPIEM-SECBINFHSA-N 0 0 386.417 3.376 20 5 GGBDRN O=C(NC[C@H]1CCCCC1(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000296919126 565345251 /nfs/dbraw/zinc/34/52/51/565345251.db2.gz RMTCKCXRPSRQPH-SECBINFHSA-N 0 0 375.759 3.128 20 5 GGBDRN C[C@@]1(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCCS1 ZINC000163461023 565346201 /nfs/dbraw/zinc/34/62/01/565346201.db2.gz VRPFOAPJRZGWAP-LBPRGKRZSA-N 0 0 384.401 3.178 20 5 GGBDRN CC[C@@](C)(NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000163669871 565349849 /nfs/dbraw/zinc/34/98/49/565349849.db2.gz YVKHLBPGHAERQV-MRXNPFEDSA-N 0 0 383.495 3.147 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000187690452 565349846 /nfs/dbraw/zinc/34/98/46/565349846.db2.gz FJJAQIVKWDPKJK-XPTSAGLGSA-N 0 0 380.750 3.462 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(Br)c2cccnc12 ZINC000163791513 565350920 /nfs/dbraw/zinc/35/09/20/565350920.db2.gz DZUABENXJUJTDE-UHFFFAOYSA-N 0 0 390.197 3.131 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CC(=O)Nc2c(F)cccc21 ZINC000374681063 565350939 /nfs/dbraw/zinc/35/09/39/565350939.db2.gz TWLUKOHNDVIAOD-UHFFFAOYSA-N 0 0 394.156 3.095 20 5 GGBDRN C[C@@H](CNS(=O)(=O)CCc1ccccc1[N+](=O)[O-])Sc1ccccc1 ZINC000163876437 565352339 /nfs/dbraw/zinc/35/23/39/565352339.db2.gz DQPROSVFIZKMCZ-AWEZNQCLSA-N 0 0 380.491 3.238 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000187747186 565352773 /nfs/dbraw/zinc/35/27/73/565352773.db2.gz IUHRFYHTJGSFEV-YGRLFVJLSA-N 0 0 380.750 3.462 20 5 GGBDRN CC(C)N1C(=S)N=NC1CCNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000297100200 565356109 /nfs/dbraw/zinc/35/61/09/565356109.db2.gz CTLCOLFNKCTAMG-UHFFFAOYSA-N 0 0 384.849 3.074 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000187804928 565356979 /nfs/dbraw/zinc/35/69/79/565356979.db2.gz XZARZBFYVYSFPO-XPTSAGLGSA-N 0 0 380.750 3.462 20 5 GGBDRN CCOC(=O)Cc1cnc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])s1 ZINC000297119254 565357112 /nfs/dbraw/zinc/35/71/12/565357112.db2.gz JVGCWYNAJOLIKY-UHFFFAOYSA-N 0 0 381.435 3.131 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C[C@H]2CCOC2)C2CC2)cc1[N+](=O)[O-] ZINC000164259155 565358057 /nfs/dbraw/zinc/35/80/57/565358057.db2.gz QTSDQAAHVLGXIB-LLVKDONJSA-N 0 0 383.242 3.307 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N(CC1CCC1)CC(F)(F)F ZINC000164282024 565359112 /nfs/dbraw/zinc/35/91/12/565359112.db2.gz OECHRGGAXIVTOK-UHFFFAOYSA-N 0 0 380.388 3.132 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2cc(Br)cn(C)c2=O)cc1[N+](=O)[O-] ZINC000187853884 565359339 /nfs/dbraw/zinc/35/93/39/565359339.db2.gz PKHYXIMBLRIUFK-UHFFFAOYSA-N 0 0 394.225 3.432 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)C1(c2ccc(Cl)c(Cl)c2)CCC1 ZINC000164412632 565360025 /nfs/dbraw/zinc/36/00/25/565360025.db2.gz PQOMXQCKTSPHNI-UHFFFAOYSA-N 0 0 383.235 3.336 20 5 GGBDRN O=C(N[C@@H]1CCC[C@H]1CCO)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000187913520 565363297 /nfs/dbraw/zinc/36/32/97/565363297.db2.gz OZANSJYKRJLAST-GZMMTYOYSA-N 0 0 391.649 3.292 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1I ZINC000164819436 565363656 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Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](n2ccnc2)C1 ZINC000375053744 565365603 /nfs/dbraw/zinc/36/56/03/565365603.db2.gz YVYGUHMZJXUHPB-GFCCVEGCSA-N 0 0 393.241 3.340 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@H]2CCOC2)C1 ZINC000375041215 565365806 /nfs/dbraw/zinc/36/58/06/565365806.db2.gz HXCSCTQEMLYXTH-NEPJUHHUSA-N 0 0 383.242 3.164 20 5 GGBDRN C[C@@H](c1nccs1)N1CCN(c2ncc([N+](=O)[O-])cc2Br)CC1 ZINC000274329709 565367558 /nfs/dbraw/zinc/36/75/58/565367558.db2.gz VYSRVJUQSLADCW-JTQLQIEISA-N 0 0 398.286 3.092 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1ncc[nH]1 ZINC000375082998 565368454 /nfs/dbraw/zinc/36/84/54/565368454.db2.gz YNXFSWJFHACYIZ-ZDUSSCGKSA-N 0 0 379.214 3.366 20 5 GGBDRN C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)CCO[C@H]1C1CC1 ZINC000375132986 565370361 /nfs/dbraw/zinc/37/03/61/565370361.db2.gz BOKAWVNFKLMHJQ-GOEBONIOSA-N 0 0 383.242 3.292 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1c1csc(C)n1 ZINC000188015234 565370581 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O=C(NCCCO[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1Br ZINC000298923522 565433990 /nfs/dbraw/zinc/43/39/90/565433990.db2.gz MMQWHLGVRLZVSZ-CYBMUJFWSA-N 0 0 387.230 3.020 20 5 GGBDRN O=C(NCCCO[C@H]1CCCCO1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000298975164 565435502 /nfs/dbraw/zinc/43/55/02/565435502.db2.gz OYLDJHNHIIVZIL-AWEZNQCLSA-N 0 0 387.230 3.020 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1ccccc1Br ZINC000171548349 565437155 /nfs/dbraw/zinc/43/71/55/565437155.db2.gz NKNIAOXRWKOQJJ-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN CC(C)Oc1nnc(S[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)s1 ZINC000299081788 565438508 /nfs/dbraw/zinc/43/85/08/565438508.db2.gz YMDOGQFUZDVKEV-MRVPVSSYSA-N 0 0 386.430 3.492 20 5 GGBDRN COCc1cc(CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1F ZINC000171641975 565440571 /nfs/dbraw/zinc/44/05/71/565440571.db2.gz IMVDQWWFHSLKCM-UHFFFAOYSA-N 0 0 388.804 3.012 20 5 GGBDRN C[C@H](CN(C)C(=O)c1c([N+](=O)[O-])cnn1C)Oc1ccc(Cl)c(Cl)c1 ZINC000189058503 565441426 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CCOc1ccc(NC(=O)c2n[nH]c(CC)c2[N+](=O)[O-])cc1Br ZINC000189352478 565460509 /nfs/dbraw/zinc/46/05/09/565460509.db2.gz ITWGMHVDEFKANJ-UHFFFAOYSA-N 0 0 383.202 3.294 20 5 GGBDRN Cc1cc(Sc2ccc(S(=O)(=O)N3CCCC3)cn2)ccc1[N+](=O)[O-] ZINC000301061010 565461201 /nfs/dbraw/zinc/46/12/01/565461201.db2.gz BWXNRNLOTXVZJT-UHFFFAOYSA-N 0 0 379.463 3.234 20 5 GGBDRN O=C(c1ccc(Cl)cc1Cl)N1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000301058364 565461366 /nfs/dbraw/zinc/46/13/66/565461366.db2.gz AUDASSOQCZKRLJ-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN CN(C)c1ncc(Br)cc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000172002299 565461984 /nfs/dbraw/zinc/46/19/84/565461984.db2.gz VTCZFCRHWKFZRR-UHFFFAOYSA-N 0 0 393.241 3.091 20 5 GGBDRN C[C@@]1(CNC(=O)c2cccc([N+](=O)[O-])c2Br)CCO[C@H]1C1CC1 ZINC000376983603 565462009 /nfs/dbraw/zinc/46/20/09/565462009.db2.gz VRPOWCGENFOPMR-HOCLYGCPSA-N 0 0 383.242 3.292 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCSC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000172026306 565462265 /nfs/dbraw/zinc/46/22/65/565462265.db2.gz ZAEASTJYKHZURC-KRWDZBQOSA-N 0 0 378.475 3.382 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)Cc2ccc(Br)o2)ccc1[N+](=O)[O-] ZINC000172017362 565462408 /nfs/dbraw/zinc/46/24/08/565462408.db2.gz QFYQEURMHVSQMK-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN O=C(CNc1ccc([N+](=O)[O-])cc1Br)N1CCc2ccccc2C1 ZINC000301072192 565462724 /nfs/dbraw/zinc/46/27/24/565462724.db2.gz JNVJYRVQHAWZLT-UHFFFAOYSA-N 0 0 390.237 3.354 20 5 GGBDRN Cn1c(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])nnc1-c1cccs1 ZINC000301061844 565462856 /nfs/dbraw/zinc/46/28/56/565462856.db2.gz AUTTVLNGACJHDN-UHFFFAOYSA-N 0 0 396.475 3.007 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1)CCC2 ZINC000172021335 565462880 /nfs/dbraw/zinc/46/28/80/565462880.db2.gz NBJDVIBCGFZPDI-OAHLLOKOSA-N 0 0 381.479 3.366 20 5 GGBDRN CNS(=O)(=O)c1ccc(Sc2ccc(C(F)(F)F)cn2)c([N+](=O)[O-])c1 ZINC000301106296 565464898 /nfs/dbraw/zinc/46/48/98/565464898.db2.gz ULTLVPHVLXAGGI-UHFFFAOYSA-N 0 0 393.368 3.068 20 5 GGBDRN Cc1nc(Cc2nnc(Sc3nc4sccn4c3[N+](=O)[O-])o2)cs1 ZINC000301107743 565464976 /nfs/dbraw/zinc/46/49/76/565464976.db2.gz UYOAABIMNXVWGL-UHFFFAOYSA-N 0 0 380.436 3.194 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccccc3O)CC2)c(Br)c1 ZINC000301111409 565465159 /nfs/dbraw/zinc/46/51/59/565465159.db2.gz RRVMYTHAPXIFFX-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)CCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000172107147 565466353 /nfs/dbraw/zinc/46/63/53/565466353.db2.gz WFLCBSJRJNVSND-UHFFFAOYSA-N 0 0 384.841 3.120 20 5 GGBDRN Cc1noc(C)c1CN1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000301147661 565466842 /nfs/dbraw/zinc/46/68/42/565466842.db2.gz BMDKWFCZABJTMA-UHFFFAOYSA-N 0 0 395.257 3.284 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCCc1nc2c(s1)CCCC2 ZINC000172116669 565467016 /nfs/dbraw/zinc/46/70/16/565467016.db2.gz AHUFKIRVRXBHKO-UHFFFAOYSA-N 0 0 379.869 3.485 20 5 GGBDRN NS(=O)(=O)c1ccc(Sc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000301146805 565467190 /nfs/dbraw/zinc/46/71/90/565467190.db2.gz HBLYQGHNZLISJG-UHFFFAOYSA-N 0 0 389.252 3.156 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)cc1OCC(F)(F)F ZINC000172110953 565467273 /nfs/dbraw/zinc/46/72/73/565467273.db2.gz MHEYVOXCOBYWOF-UHFFFAOYSA-N 0 0 378.694 3.025 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CNc1ncc([N+](=O)[O-])cc1C ZINC000301141450 565467408 /nfs/dbraw/zinc/46/74/08/565467408.db2.gz BQAPTUZLXUTGFP-UHFFFAOYSA-N 0 0 379.214 3.420 20 5 GGBDRN CCOC[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)C(C)C ZINC000276934404 565467783 /nfs/dbraw/zinc/46/77/83/565467783.db2.gz VSUVWPKSRQDOEL-NSHDSACASA-N 0 0 377.210 3.287 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCc1noc2c1CCCC2 ZINC000377125958 565467816 /nfs/dbraw/zinc/46/78/16/565467816.db2.gz CMOFHBIZKBSRGX-UHFFFAOYSA-N 0 0 394.225 3.083 20 5 GGBDRN CCOC[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)C(C)C ZINC000276934400 565467866 /nfs/dbraw/zinc/46/78/66/565467866.db2.gz VSUVWPKSRQDOEL-LLVKDONJSA-N 0 0 377.210 3.287 20 5 GGBDRN COc1ccc(Br)cc1[C@@H]1CCCN1c1ncc([N+](=O)[O-])c(N)n1 ZINC000301159019 565467992 /nfs/dbraw/zinc/46/79/92/565467992.db2.gz OOAAFNONLHGHHP-NSHDSACASA-N 0 0 394.229 3.080 20 5 GGBDRN CCn1c(Sc2ncc([N+](=O)[O-])c(N)n2)nnc1-c1cccc(Cl)c1 ZINC000301150970 565468003 /nfs/dbraw/zinc/46/80/03/565468003.db2.gz KAGXFRRFNJERJL-UHFFFAOYSA-N 0 0 377.817 3.050 20 5 GGBDRN CC(C)(CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000301159047 565468411 /nfs/dbraw/zinc/46/84/11/565468411.db2.gz OOWBPGPAMNDFFZ-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN O=C1CCCN1Cc1nnc(Sc2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000301175581 565469533 /nfs/dbraw/zinc/46/95/33/565469533.db2.gz LEQIZSOEFJTYED-UHFFFAOYSA-N 0 0 399.226 3.014 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC(n2cc(Br)cn2)CC1 ZINC000377186447 565470032 /nfs/dbraw/zinc/47/00/32/565470032.db2.gz WZNXACBKDVXYFD-UHFFFAOYSA-N 0 0 385.243 3.093 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCc1ccc(Br)cc1 ZINC000172177043 565470722 /nfs/dbraw/zinc/47/07/22/565470722.db2.gz DWVXHAAVJWDHAF-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccc(Br)cc2)c1 ZINC000172177586 565470741 /nfs/dbraw/zinc/47/07/41/565470741.db2.gz JCWMSMVIJRFINQ-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN Cc1nn(C)c(N[C@H]2CCN(c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000301205090 565471636 /nfs/dbraw/zinc/47/16/36/565471636.db2.gz RGAAIWHSGCNKNG-LBPRGKRZSA-N 0 0 380.246 3.090 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NCc1nc(-c2ccncc2)no1 ZINC000301199527 565472032 /nfs/dbraw/zinc/47/20/32/565472032.db2.gz VYADGTKQCNMSHG-UHFFFAOYSA-N 0 0 376.170 3.414 20 5 GGBDRN Cc1cc(Br)c2c(c1)CN(C(=O)c1c(N)cccc1[N+](=O)[O-])CC2 ZINC000189516103 565472210 /nfs/dbraw/zinc/47/22/10/565472210.db2.gz YGQGGMSXGABMMW-UHFFFAOYSA-N 0 0 390.237 3.446 20 5 GGBDRN CC(C)c1cnc(NC(=O)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000277029214 565472274 /nfs/dbraw/zinc/47/22/74/565472274.db2.gz MJSHWJDFQUJUHT-UHFFFAOYSA-N 0 0 382.829 3.083 20 5 GGBDRN CS(=O)(=O)c1ccc(NCCc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000172239363 565473639 /nfs/dbraw/zinc/47/36/39/565473639.db2.gz CCOOHCPBQVAFQG-UHFFFAOYSA-N 0 0 399.266 3.415 20 5 GGBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2ccc(Br)cn2)CC1 ZINC000301247786 565474017 /nfs/dbraw/zinc/47/40/17/565474017.db2.gz QUWTZAOJWZJHAW-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN Cc1cc(Br)ccc1NC(=O)CNc1nccc(C)c1[N+](=O)[O-] ZINC000301248673 565474164 /nfs/dbraw/zinc/47/41/64/565474164.db2.gz BMKLSNDAMRYAKI-UHFFFAOYSA-N 0 0 379.214 3.420 20 5 GGBDRN Cc1nn(C)c(N[C@@H]2CCN(c3ccccc3Br)C2)c1[N+](=O)[O-] ZINC000301251509 565475163 /nfs/dbraw/zinc/47/51/63/565475163.db2.gz MUPQQVOLHVOSIZ-LLVKDONJSA-N 0 0 380.246 3.090 20 5 GGBDRN COc1ccc(Nc2nnc(Sc3c([N+](=O)[O-])c(C)nn3C)s2)cc1 ZINC000301254106 565475267 /nfs/dbraw/zinc/47/52/67/565475267.db2.gz DXWQPXFKMGUNML-UHFFFAOYSA-N 0 0 378.439 3.392 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1NCc1ccc(Cl)nc1 ZINC000301251555 565475307 /nfs/dbraw/zinc/47/53/07/565475307.db2.gz PVWRFAZOQQJXTA-UHFFFAOYSA-N 0 0 377.756 3.252 20 5 GGBDRN Cc1nn(C)c(Sc2nnc(NCCc3cccs3)s2)c1[N+](=O)[O-] ZINC000301252203 565475509 /nfs/dbraw/zinc/47/55/09/565475509.db2.gz DOEKVTLACUDASY-UHFFFAOYSA-N 0 0 382.496 3.356 20 5 GGBDRN C[C@H]1SCCN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])[C@@H]1C ZINC000301275540 565476975 /nfs/dbraw/zinc/47/69/75/565476975.db2.gz IOVYVVXDUDONHQ-RKDXNWHRSA-N 0 0 384.401 3.219 20 5 GGBDRN CNS(=O)(=O)c1ccc(N(C)[C@@H](C)c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000301276301 565477109 /nfs/dbraw/zinc/47/71/09/565477109.db2.gz OUTBUITWGFSIEY-NSHDSACASA-N 0 0 383.857 3.354 20 5 GGBDRN O=C(NCCNc1ncc([N+](=O)[O-])cc1Cl)c1cccc(Br)c1 ZINC000301291419 565477552 /nfs/dbraw/zinc/47/75/52/565477552.db2.gz UUQZOTMHWQYUDS-UHFFFAOYSA-N 0 0 399.632 3.248 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)[C@@H]2CCCO[C@H]21 ZINC000377391761 565477494 /nfs/dbraw/zinc/47/74/94/565477494.db2.gz NIWAJVWOMMHMMZ-ZLKJLUDKSA-N 0 0 383.242 3.291 20 5 GGBDRN CCc1ccc(Oc2ncnc3c2c(Br)nn3C)c([N+](=O)[O-])c1 ZINC000301299334 565477938 /nfs/dbraw/zinc/47/79/38/565477938.db2.gz QGELQYXQORYAHE-UHFFFAOYSA-N 0 0 378.186 3.389 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)[C@H]2CCCO[C@@H]21 ZINC000377391759 565478405 /nfs/dbraw/zinc/47/84/05/565478405.db2.gz NIWAJVWOMMHMMZ-HONMWMINSA-N 0 0 383.242 3.291 20 5 GGBDRN O=C(NCc1ccco1)[C@@H]1CCCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000301292271 565478360 /nfs/dbraw/zinc/47/83/60/565478360.db2.gz UJOKGFBVELTSRF-AWEZNQCLSA-N 0 0 394.225 3.236 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCC[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301325313 565478822 /nfs/dbraw/zinc/47/88/22/565478822.db2.gz ALVJEULAJAVSTG-WDEREUQCSA-N 0 0 377.260 3.125 20 5 GGBDRN C[C@H](COCC(F)(F)F)NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000277146103 565478797 /nfs/dbraw/zinc/47/87/97/565478797.db2.gz IDSFJFLNPIMQPZ-SSDOTTSWSA-N 0 0 385.136 3.055 20 5 GGBDRN CS(=O)(=O)[C@H]1CCC[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301325312 565479118 /nfs/dbraw/zinc/47/91/18/565479118.db2.gz ALVJEULAJAVSTG-QWRGUYRKSA-N 0 0 377.260 3.125 20 5 GGBDRN O=[N+]([O-])c1cnc(NC[C@H](O)c2cc(Cl)c3c(c2)OCCO3)c(Cl)c1 ZINC000301330132 565479615 /nfs/dbraw/zinc/47/96/15/565479615.db2.gz ARIKYOAPZDGWRS-LBPRGKRZSA-N 0 0 386.191 3.213 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1NC[C@H](O)COc1ccc(F)cc1 ZINC000301353395 565480228 /nfs/dbraw/zinc/48/02/28/565480228.db2.gz NNQBFPAIXWVCCM-LBPRGKRZSA-N 0 0 385.189 3.348 20 5 GGBDRN CSC[C@@H](C)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000301348773 565480630 /nfs/dbraw/zinc/48/06/30/565480630.db2.gz URUYEWKIWHARSP-CYBMUJFWSA-N 0 0 387.527 3.323 20 5 GGBDRN O=C1CN(c2ncc([N+](=O)[O-])cc2Cl)CCN1Cc1ccc(Cl)cc1 ZINC000301339012 565480802 /nfs/dbraw/zinc/48/08/02/565480802.db2.gz DGIROPYQERJFEA-UHFFFAOYSA-N 0 0 381.219 3.145 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1N1CCN(Cc2ccncc2)CC1 ZINC000301354973 565480865 /nfs/dbraw/zinc/48/08/65/565480865.db2.gz OAVOIBXTVMNOOZ-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1Br ZINC000172360239 565481412 /nfs/dbraw/zinc/48/14/12/565481412.db2.gz RUMLTUWPRLSUDG-UHFFFAOYSA-N 0 0 379.214 3.407 20 5 GGBDRN Cn1c(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)nc2ccccc21 ZINC000172363832 565481629 /nfs/dbraw/zinc/48/16/29/565481629.db2.gz YTJXSQPFZGYOIV-UHFFFAOYSA-N 0 0 389.209 3.174 20 5 GGBDRN Cc1csc(N2CCN(c3cc(Br)ccc3[N+](=O)[O-])CC2)n1 ZINC000301369450 565481658 /nfs/dbraw/zinc/48/16/58/565481658.db2.gz UMVYFQJVWZVLGY-UHFFFAOYSA-N 0 0 383.271 3.449 20 5 GGBDRN NS(=O)(=O)c1cc(NCC2(c3cccc(Cl)c3)CC2)cc([N+](=O)[O-])c1 ZINC000301357846 565481664 /nfs/dbraw/zinc/48/16/64/565481664.db2.gz NHSMHYFDFGRFRK-UHFFFAOYSA-N 0 0 381.841 3.039 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(c1ccc([N+](=O)[O-])cc1Br)CC2 ZINC000301391750 565483014 /nfs/dbraw/zinc/48/30/14/565483014.db2.gz HOPRQNXODKOEPQ-HUUCEWRRSA-N 0 0 385.258 3.114 20 5 GGBDRN O=C(NCCc1ccc2c(c1)CCO2)c1ccc([N+](=O)[O-])cc1Br ZINC000172407152 565483451 /nfs/dbraw/zinc/48/34/51/565483451.db2.gz PWAHDYRFQADODS-UHFFFAOYSA-N 0 0 391.221 3.265 20 5 GGBDRN O=C(COc1ccc(Br)cc1F)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172422946 565484517 /nfs/dbraw/zinc/48/45/17/565484517.db2.gz GVBHZZNLLVHCCI-UHFFFAOYSA-N 0 0 395.184 3.465 20 5 GGBDRN O=C(Cc1cccc(F)c1)NCCNc1ccc([N+](=O)[O-])cc1Br ZINC000301422770 565484896 /nfs/dbraw/zinc/48/48/96/565484896.db2.gz SSFLOJNIDHPFJV-UHFFFAOYSA-N 0 0 396.216 3.267 20 5 GGBDRN O=C(COc1ccc(Br)cc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172421279 565484997 /nfs/dbraw/zinc/48/49/97/565484997.db2.gz WFAYCVXEFPPMSC-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN CC[C@H]1CN(c2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)CCS1 ZINC000301423433 565485277 /nfs/dbraw/zinc/48/52/77/565485277.db2.gz FYNQAVAPZSTRGI-ZDUSSCGKSA-N 0 0 380.857 3.126 20 5 GGBDRN Cc1nsc(N2CCCN(c3ccc(Br)cc3[N+](=O)[O-])CC2)n1 ZINC000301417753 565485399 /nfs/dbraw/zinc/48/53/99/565485399.db2.gz BQHOKHAYTSCDHP-UHFFFAOYSA-N 0 0 398.286 3.234 20 5 GGBDRN CO[C@@]1(C)C[C@H](Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])C1(C)C ZINC000301410535 565485428 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CO[C@]1(C)C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000173219485 565538627 /nfs/dbraw/zinc/53/86/27/565538627.db2.gz PZFQBDVLFAXBDE-IUODEOHRSA-N 0 0 376.862 3.072 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC([C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000190518358 565538788 /nfs/dbraw/zinc/53/87/88/565538788.db2.gz YANXYDUQKWFYKH-HNNXBMFYSA-N 0 0 388.873 3.136 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC(Oc3cccc(Br)c3)CC2)nc1 ZINC000302243485 565538907 /nfs/dbraw/zinc/53/89/07/565538907.db2.gz YYKGZGGAFAINRH-UHFFFAOYSA-N 0 0 379.214 3.195 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3nnc(C(F)(F)F)s3)CC2)c(Cl)c1 ZINC000302380310 565539494 /nfs/dbraw/zinc/53/94/94/565539494.db2.gz DLNYNXHQEZVSHB-UHFFFAOYSA-N 0 0 393.778 3.445 20 5 GGBDRN Cc1cnccc1CNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000302379087 565539781 /nfs/dbraw/zinc/53/97/81/565539781.db2.gz GKCZJHYGGZNEKC-UHFFFAOYSA-N 0 0 375.328 3.204 20 5 GGBDRN O=[N+]([O-])c1cccnc1N1CCO[C@H](c2ccc(F)c(Br)c2)C1 ZINC000302408927 565540658 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CS(=O)(=O)c1cccc(Sc2nnc(C(F)(F)F)s2)c1[N+](=O)[O-] ZINC000302520098 565544700 /nfs/dbraw/zinc/54/47/00/565544700.db2.gz XGJCLPKNXXNDPO-UHFFFAOYSA-N 0 0 385.370 3.020 20 5 GGBDRN Cc1cccc(NCCNS(=O)(=O)c2ccc(Cl)s2)c1[N+](=O)[O-] ZINC000302526222 565545077 /nfs/dbraw/zinc/54/50/77/565545077.db2.gz ZXCBXPIBKLBDNK-UHFFFAOYSA-N 0 0 375.859 3.009 20 5 GGBDRN O=C(NC[C@@H]1COC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1Br ZINC000190598021 565545183 /nfs/dbraw/zinc/54/51/83/565545183.db2.gz VHXFXCVDPQFVTQ-LLVKDONJSA-N 0 0 399.241 3.163 20 5 GGBDRN COc1cc(Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])ccc1F ZINC000302554935 565545901 /nfs/dbraw/zinc/54/59/01/565545901.db2.gz RJPAXEHGZMPMGN-UHFFFAOYSA-N 0 0 376.312 3.482 20 5 GGBDRN O=C(N[C@@H]1CCOC2(CCC2)C1)c1sc(Br)cc1[N+](=O)[O-] ZINC000278215766 565546079 /nfs/dbraw/zinc/54/60/79/565546079.db2.gz RPVRPRIJPVYBBD-MRVPVSSYSA-N 0 0 375.244 3.250 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NCC1CCN(CC(F)(F)F)CC1 ZINC000302558460 565546193 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GGBDRN O=C1c2ccccc2CCN1CCNc1ccc([N+](=O)[O-])cc1Br ZINC000302703563 565551199 /nfs/dbraw/zinc/55/11/99/565551199.db2.gz IZDXUJUGXHJGPH-UHFFFAOYSA-N 0 0 390.237 3.468 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccsc2Br)c(F)c1 ZINC000388522992 565551712 /nfs/dbraw/zinc/55/17/12/565551712.db2.gz AHPDUHYDPFEDFK-UHFFFAOYSA-N 0 0 395.231 3.036 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2ccsc2Br)cc1 ZINC000388550299 565551990 /nfs/dbraw/zinc/55/19/90/565551990.db2.gz NOEXOFFOJUAXTC-UHFFFAOYSA-N 0 0 391.268 3.038 20 5 GGBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)c(C)s1 ZINC000388571327 565552013 /nfs/dbraw/zinc/55/20/13/565552013.db2.gz OAFAYPTWESKQFV-UHFFFAOYSA-N 0 0 385.239 3.389 20 5 GGBDRN Cc1cc(N2CCN(Cc3cccnc3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000302720866 565552091 /nfs/dbraw/zinc/55/20/91/565552091.db2.gz ZYMIKPCAZZUELH-UHFFFAOYSA-N 0 0 391.269 3.383 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)c1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302731449 565552793 /nfs/dbraw/zinc/55/27/93/565552793.db2.gz 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565555150 /nfs/dbraw/zinc/55/51/50/565555150.db2.gz QDMFYLOYJJVTCO-UHFFFAOYSA-N 0 0 383.164 3.247 20 5 GGBDRN COC(=O)c1cnc(N(C)Cc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000302771816 565555629 /nfs/dbraw/zinc/55/56/29/565555629.db2.gz NCZPKBRSBJVMTG-UHFFFAOYSA-N 0 0 380.198 3.175 20 5 GGBDRN COC(=O)c1cnc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000302761187 565555752 /nfs/dbraw/zinc/55/57/52/565555752.db2.gz KHHMSDDECOBKGB-CYBMUJFWSA-N 0 0 386.191 3.229 20 5 GGBDRN COC(=O)c1cnc(N(C)Cc2ccc(Br)s2)c([N+](=O)[O-])c1 ZINC000302780932 565556656 /nfs/dbraw/zinc/55/66/56/565556656.db2.gz RQTMIIDCROZCBG-UHFFFAOYSA-N 0 0 386.227 3.237 20 5 GGBDRN COC(=O)c1cnc(NCCc2cc(Br)ccc2F)c([N+](=O)[O-])c1 ZINC000302778487 565556801 /nfs/dbraw/zinc/55/68/01/565556801.db2.gz QCERGOZTOIXTKF-UHFFFAOYSA-N 0 0 398.188 3.333 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1cc(Cl)cc2c1OCC2 ZINC000302786897 565556932 /nfs/dbraw/zinc/55/69/32/565556932.db2.gz WJTDHWMMTGWMLF-UHFFFAOYSA-N 0 0 382.825 3.199 20 5 GGBDRN Cc1cc(N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ncc1Br ZINC000302796002 565556991 /nfs/dbraw/zinc/55/69/91/565556991.db2.gz PLQZYULDOZRNTQ-LLVKDONJSA-N 0 0 378.230 3.147 20 5 GGBDRN COc1cc(CNc2ccc(Cl)c(S(C)(=O)=O)c2)c([N+](=O)[O-])cc1F ZINC000190769403 565557612 /nfs/dbraw/zinc/55/76/12/565557612.db2.gz QTBLCOGSULIMQP-UHFFFAOYSA-N 0 0 388.804 3.412 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000302805631 565558258 /nfs/dbraw/zinc/55/82/58/565558258.db2.gz FPSLAOGWJOQLGW-HNNXBMFYSA-N 0 0 386.246 3.168 20 5 GGBDRN Cc1csc([C@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C2CC2)n1 ZINC000173462112 565558469 /nfs/dbraw/zinc/55/84/69/565558469.db2.gz IQPXPBJMVNBLLP-CYBMUJFWSA-N 0 0 387.870 3.443 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000302821785 565559088 /nfs/dbraw/zinc/55/90/88/565559088.db2.gz KITDMAIEDNBZDF-HNNXBMFYSA-N 0 0 386.246 3.168 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1Br ZINC000278460988 565559878 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384.816 3.397 20 5 GGBDRN CS(=O)(=O)N(CCSCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000190869367 565565490 /nfs/dbraw/zinc/56/54/90/565565490.db2.gz YPQCCPGUQLASIU-UHFFFAOYSA-N 0 0 380.491 3.290 20 5 GGBDRN CCC(C)(C)CNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000190876918 565566810 /nfs/dbraw/zinc/56/68/10/565566810.db2.gz YGJQDGCOGMXQIT-UHFFFAOYSA-N 0 0 376.194 3.365 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCC[C@@H]2CCC[C@@H]21 ZINC000173589949 565569498 /nfs/dbraw/zinc/56/94/98/565569498.db2.gz NJWRCNKVULCQIK-JQWIXIFHSA-N 0 0 389.271 3.311 20 5 GGBDRN O=C(N[C@@H]1CCC[C@H]2OCC[C@H]21)c1sc(Br)cc1[N+](=O)[O-] ZINC000278627310 565569754 /nfs/dbraw/zinc/56/97/54/565569754.db2.gz MGFIUSLSHVYMEC-QXFUBDJGSA-N 0 0 375.244 3.106 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1ccc(F)c(F)c1 ZINC000190943671 565571190 /nfs/dbraw/zinc/57/11/90/565571190.db2.gz KMWNKSCQUDVRCB-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN COC[C@H](OC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])c1nccs1 ZINC000278684104 565571663 /nfs/dbraw/zinc/57/16/63/565571663.db2.gz IEXDEGKJDFNNLK-LBPRGKRZSA-N 0 0 384.435 3.326 20 5 GGBDRN COC[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000278670334 565572131 /nfs/dbraw/zinc/57/21/31/565572131.db2.gz FZGVSNMQJDIEAH-OAHLLOKOSA-N 0 0 384.841 3.451 20 5 GGBDRN CN([C@@H]1CCc2ccccc2C1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000303590281 565572435 /nfs/dbraw/zinc/57/24/35/565572435.db2.gz RUKZHEXAAWVJNN-OAHLLOKOSA-N 0 0 380.853 3.426 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000303670104 565573032 /nfs/dbraw/zinc/57/30/32/565573032.db2.gz DBDILXWNUAAYRV-BDJLRTHQSA-N 0 0 384.841 3.303 20 5 GGBDRN COc1cc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)ccc1Br ZINC000173655516 565574621 /nfs/dbraw/zinc/57/46/21/565574621.db2.gz FDPWJWHXDGBWTL-UHFFFAOYSA-N 0 0 397.229 3.208 20 5 GGBDRN C[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1ccccc1Cl ZINC000173710712 565578077 /nfs/dbraw/zinc/57/80/77/565578077.db2.gz VNKLXQLXGNDZOF-LBPRGKRZSA-N 0 0 384.841 3.135 20 5 GGBDRN C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000278827754 565580025 /nfs/dbraw/zinc/58/00/25/565580025.db2.gz UPOLPANSBFWWKU-MRVPVSSYSA-N 0 0 375.328 3.326 20 5 GGBDRN Cc1c(CNCc2ncc(I)s2)cccc1[N+](=O)[O-] ZINC000311496598 565580449 /nfs/dbraw/zinc/58/04/49/565580449.db2.gz OLYQSQFNOBZDCO-UHFFFAOYSA-N 0 0 389.218 3.254 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CCC(CCCO)CC1 ZINC000401126407 565580408 /nfs/dbraw/zinc/58/04/08/565580408.db2.gz LKWGBQZVQXJFCK-UHFFFAOYSA-N 0 0 390.221 3.188 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2cc(Br)ccc2C)c1[N+](=O)[O-] ZINC000191070988 565581054 /nfs/dbraw/zinc/58/10/54/565581054.db2.gz HYFHNCZFWFHTTP-UHFFFAOYSA-N 0 0 381.230 3.271 20 5 GGBDRN O=C(c1cscc1Br)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000404797897 565583977 /nfs/dbraw/zinc/58/39/77/565583977.db2.gz GUAMTPBTINWFLS-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@H]1n1cccn1)c1ccc([N+](=O)[O-])cc1Br ZINC000173792105 565586080 /nfs/dbraw/zinc/58/60/80/565586080.db2.gz WUYPSXPKCUUBCT-HUUCEWRRSA-N 0 0 393.241 3.468 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000315174358 565588462 /nfs/dbraw/zinc/58/84/62/565588462.db2.gz HRYHFZBOUQFLFJ-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000173805563 565588771 /nfs/dbraw/zinc/58/87/71/565588771.db2.gz OTDWNZORXIPCJB-AWEZNQCLSA-N 0 0 388.804 3.053 20 5 GGBDRN CC(=O)N1CC(C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)C1 ZINC000191203165 565588937 /nfs/dbraw/zinc/58/89/37/565588937.db2.gz OZLWXLSGBXPIMU-UHFFFAOYSA-N 0 0 377.447 3.224 20 5 GGBDRN CCn1nccc1C1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000278981512 565589022 /nfs/dbraw/zinc/58/90/22/565589022.db2.gz DDCHULKICSOZGB-UHFFFAOYSA-N 0 0 380.246 3.353 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)C[C@@H]1C ZINC000407979264 565589708 /nfs/dbraw/zinc/58/97/08/565589708.db2.gz UZDYZXBKXCHTDC-IUCAKERBSA-N 0 0 388.205 3.378 20 5 GGBDRN Cc1csc([C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000173818059 565589677 /nfs/dbraw/zinc/58/96/77/565589677.db2.gz XWEACCXDIMPLCD-CYBMUJFWSA-N 0 0 381.479 3.236 20 5 GGBDRN CN(Cc1cccc(Br)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000315293526 565589827 /nfs/dbraw/zinc/58/98/27/565589827.db2.gz HVJJGAWYUXDHMS-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)C[C@H]1C ZINC000407979265 565589884 /nfs/dbraw/zinc/58/98/84/565589884.db2.gz UZDYZXBKXCHTDC-RKDXNWHRSA-N 0 0 388.205 3.378 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)Nc2ccncc2Br)cc1C ZINC000318919544 565596671 /nfs/dbraw/zinc/59/66/71/565596671.db2.gz MZCKLSDYRQAPSE-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H](C)CC ZINC000173899281 565597405 /nfs/dbraw/zinc/59/74/05/565597405.db2.gz HKSKYVMCZZIYHD-RNCFNFMXSA-N 0 0 387.230 3.065 20 5 GGBDRN Cn1ccnc1[C@](O)(CCNc1cc(Cl)ccc1[N+](=O)[O-])C(F)(F)F ZINC000279155945 565598173 /nfs/dbraw/zinc/59/81/73/565598173.db2.gz BGIYRPNDJVPFIC-CYBMUJFWSA-N 0 0 378.738 3.234 20 5 GGBDRN O=C(NC[C@@H]1CCSC1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000279175420 565598989 /nfs/dbraw/zinc/59/89/89/565598989.db2.gz HTXBPTCFFBZBQB-ZETCQYMHSA-N 0 0 379.663 3.494 20 5 GGBDRN CN(C(=O)Cc1ccc(I)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000191358758 565599437 /nfs/dbraw/zinc/59/94/37/565599437.db2.gz ZOIYTNVPXQEZHM-UHFFFAOYSA-N 0 0 396.184 3.405 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCSC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000408272068 565601877 /nfs/dbraw/zinc/60/18/77/565601877.db2.gz WSRMKKOPOAXQID-UHFFFAOYSA-N 0 0 386.495 3.044 20 5 GGBDRN C[C@H]1CCCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000408314096 565602663 /nfs/dbraw/zinc/60/26/63/565602663.db2.gz QFLBCBKGSCCIKG-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN COC(=O)[C@H](C)CN(C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000320754948 565603120 /nfs/dbraw/zinc/60/31/20/565603120.db2.gz NXENMXNKQGUDCU-SECBINFHSA-N 0 0 382.214 3.151 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2ccccc2Br)c1C ZINC000320556713 565603289 /nfs/dbraw/zinc/60/32/89/565603289.db2.gz QZBLGTPXBRLJDE-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cn1cc([C@H]2CSCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000191434108 565603612 /nfs/dbraw/zinc/60/36/12/565603612.db2.gz KCIQFIYPBUVECE-CQSZACIVSA-N 0 0 381.845 3.304 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1cccc(Br)c1 ZINC000321139206 565604528 /nfs/dbraw/zinc/60/45/28/565604528.db2.gz NMWSEHNFHBMMDI-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CN(Cc1cccc(Br)c1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000321197921 565605187 /nfs/dbraw/zinc/60/51/87/565605187.db2.gz VTEDAKORIQTWMC-UHFFFAOYSA-N 0 0 399.266 3.319 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000191447473 565605793 /nfs/dbraw/zinc/60/57/93/565605793.db2.gz PBDWYRMCZWRDMX-UHFFFAOYSA-N 0 0 382.825 3.466 20 5 GGBDRN C[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC[S@@](=O)C1 ZINC000408390910 565607107 /nfs/dbraw/zinc/60/71/07/565607107.db2.gz ABGHEYRKTLKCGZ-DJNLSKAYSA-N 0 0 398.282 3.110 20 5 GGBDRN C[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC[S@](=O)C1 ZINC000408390940 565607481 /nfs/dbraw/zinc/60/74/81/565607481.db2.gz ABGHEYRKTLKCGZ-WYVULQQZSA-N 0 0 398.282 3.110 20 5 GGBDRN CC(C)C[C@]1(CO)CCCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000191492829 565608063 /nfs/dbraw/zinc/60/80/63/565608063.db2.gz PRINIZNRRHJXEE-INIZCTEOSA-N 0 0 385.258 3.371 20 5 GGBDRN O=C(NCc1cc(Br)cc2c1OCC2)c1cccc([N+](=O)[O-])c1 ZINC000322182640 565609020 /nfs/dbraw/zinc/60/90/20/565609020.db2.gz BEUUZFMTKCPJJP-UHFFFAOYSA-N 0 0 377.194 3.222 20 5 GGBDRN C[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H]1C ZINC000408445575 565609847 /nfs/dbraw/zinc/60/98/47/565609847.db2.gz ADWZTDZPVUERBU-NXEZZACHSA-N 0 0 377.260 3.166 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]3CCC[C@@H]32)c(Br)c1 ZINC000408446644 565609920 /nfs/dbraw/zinc/60/99/20/565609920.db2.gz OHFQDKYQHKDJKX-GWCFXTLKSA-N 0 0 389.271 3.311 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(Nc2cc(Br)cc(OC)c2)n1 ZINC000322992322 565611741 /nfs/dbraw/zinc/61/17/41/565611741.db2.gz RQCSMHGAMQCYFJ-UHFFFAOYSA-N 0 0 382.170 3.291 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc(Br)c(C)n2)ccc1[N+](=O)[O-] ZINC000174092083 565612192 /nfs/dbraw/zinc/61/21/92/565612192.db2.gz DCJGGQZAWUDZIW-UHFFFAOYSA-N 0 0 396.197 3.087 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1cc(Br)cc2c1OCC2 ZINC000323470578 565614224 /nfs/dbraw/zinc/61/42/24/565614224.db2.gz LMIZGCDSMJXMGH-UHFFFAOYSA-N 0 0 381.230 3.429 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCc3cc(Br)cc(F)c32)n1 ZINC000191590197 565615476 /nfs/dbraw/zinc/61/54/76/565615476.db2.gz XNZGCQNTOCGJKK-UHFFFAOYSA-N 0 0 397.204 3.306 20 5 GGBDRN CNc1ccc(C(=O)NCCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000324189617 565616245 /nfs/dbraw/zinc/61/62/45/565616245.db2.gz YVUYUXQVKZEFCL-UHFFFAOYSA-N 0 0 378.226 3.372 20 5 GGBDRN COC(=O)C1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC1 ZINC000324289325 565617487 /nfs/dbraw/zinc/61/74/87/565617487.db2.gz RMWWLAFBDPRWNL-UHFFFAOYSA-N 0 0 394.225 3.295 20 5 GGBDRN COc1cc(Br)cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1 ZINC000324531442 565617648 /nfs/dbraw/zinc/61/76/48/565617648.db2.gz UAQHJJWOVYWRLL-UHFFFAOYSA-N 0 0 384.161 3.340 20 5 GGBDRN CC(=O)c1ccccc1OCCn1cc([N+](=O)[O-])c(C)c(Br)c1=O ZINC000325676174 565622497 /nfs/dbraw/zinc/62/24/97/565622497.db2.gz NDKZSUYQAMEVRH-UHFFFAOYSA-N 0 0 395.209 3.109 20 5 GGBDRN CO[C@@H]1[C@H](C)[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])C1(C)C ZINC000409543696 565623358 /nfs/dbraw/zinc/62/33/58/565623358.db2.gz MNXWPGHSBDZLSK-LIEZGIJOSA-N 0 0 377.260 3.208 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2csc([N+](=O)[O-])c2)sc1C ZINC000279656397 565624150 /nfs/dbraw/zinc/62/41/50/565624150.db2.gz KEEQMLVIHJYPSY-SNVBAGLBSA-N 0 0 381.435 3.185 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000279697937 565627666 /nfs/dbraw/zinc/62/76/66/565627666.db2.gz IZRIKVPYYKPWFT-SNVBAGLBSA-N 0 0 379.766 3.091 20 5 GGBDRN COC(=O)c1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1Br ZINC000191753439 565629069 /nfs/dbraw/zinc/62/90/69/565629069.db2.gz BMXGCGLGGILKKD-UHFFFAOYSA-N 0 0 393.193 3.325 20 5 GGBDRN CSc1ccc(C(=O)N[C@H](C[S@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000174328634 565629244 /nfs/dbraw/zinc/62/92/44/565629244.db2.gz JFQLPKFTACSGPE-PWECECGKSA-N 0 0 378.475 3.166 20 5 GGBDRN CSc1ccc(C(=O)N[C@H](C[S@@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000174328663 565629557 /nfs/dbraw/zinc/62/95/57/565629557.db2.gz JFQLPKFTACSGPE-DLUDVSRJSA-N 0 0 378.475 3.166 20 5 GGBDRN CCSCCCNc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-] ZINC000409650137 565630317 /nfs/dbraw/zinc/63/03/17/565630317.db2.gz SCUATVJZXIOVOQ-UHFFFAOYSA-N 0 0 375.516 3.180 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2ccc(I)c(Cl)c2)s1 ZINC000409675476 565632355 /nfs/dbraw/zinc/63/23/55/565632355.db2.gz KYEHKUYRMYWWJP-UHFFFAOYSA-N 0 0 395.609 3.343 20 5 GGBDRN C[S@](=O)C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000174368721 565632381 /nfs/dbraw/zinc/63/23/81/565632381.db2.gz LGQQIEHSPLZPPZ-MQNRADLISA-N 0 0 381.841 3.490 20 5 GGBDRN Cc1cccc(Cl)c1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000174420572 565633520 /nfs/dbraw/zinc/63/35/20/565633520.db2.gz AUQMGFQDOKEUQX-UHFFFAOYSA-N 0 0 379.825 3.386 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CCO[C@]2(CCSC2)C1 ZINC000279826692 565634848 /nfs/dbraw/zinc/63/48/48/565634848.db2.gz CLGYJVDGILEXMQ-BDJLRTHQSA-N 0 0 388.848 3.101 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(c2ccccc2)[C@@H]2CCOC2)c(Cl)c1 ZINC000191830445 565635522 /nfs/dbraw/zinc/63/55/22/565635522.db2.gz OEHLWCLOYGKSLL-CQSZACIVSA-N 0 0 382.825 3.232 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CCO[C@@]2(CCSC2)C1 ZINC000279826713 565635951 /nfs/dbraw/zinc/63/59/51/565635951.db2.gz CLGYJVDGILEXMQ-ZBEGNZNMSA-N 0 0 388.848 3.101 20 5 GGBDRN C[C@@H](O)C[C@@H]1CCCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000279862809 565637222 /nfs/dbraw/zinc/63/72/22/565637222.db2.gz SKTLUKKUYKUFLM-KOLCDFICSA-N 0 0 389.221 3.262 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000191868790 565638028 /nfs/dbraw/zinc/63/80/28/565638028.db2.gz MTBXJSSOEUMGDW-UHFFFAOYSA-N 0 0 377.447 3.300 20 5 GGBDRN C[C@H](Oc1ccc(Br)cc1)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000409748259 565638900 /nfs/dbraw/zinc/63/89/00/565638900.db2.gz VZTZNFDFXPWLAO-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN CO[C@@H]1Cc2ccccc2N(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000409822744 565642662 /nfs/dbraw/zinc/64/26/62/565642662.db2.gz IRVMHJODRIHZEK-CYBMUJFWSA-N 0 0 382.825 3.015 20 5 GGBDRN CO[C@@H]1Cc2ccccc2N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000409837502 565643485 /nfs/dbraw/zinc/64/34/85/565643485.db2.gz UBXGVNATDLWSLC-CYBMUJFWSA-N 0 0 382.825 3.015 20 5 GGBDRN C[C@H](CCc1cccn1C)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000174582718 565645849 /nfs/dbraw/zinc/64/58/49/565645849.db2.gz UOINJJFAORBDLQ-LLVKDONJSA-N 0 0 380.242 3.447 20 5 GGBDRN COc1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)ccc1Br ZINC000174604946 565647455 /nfs/dbraw/zinc/64/74/55/565647455.db2.gz VAEVCJUHDFASBE-UHFFFAOYSA-N 0 0 384.161 3.340 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NCc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000191986273 565647745 /nfs/dbraw/zinc/64/77/45/565647745.db2.gz YSBDJAMOZYMPHL-UHFFFAOYSA-N 0 0 395.384 3.165 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NC2(c3nccs3)CCCC2)cc1[N+](=O)[O-] ZINC000191977294 565647789 /nfs/dbraw/zinc/64/77/89/565647789.db2.gz KLTUTEJQGUXQHJ-UHFFFAOYSA-N 0 0 381.479 3.416 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000280049842 565649088 /nfs/dbraw/zinc/64/90/88/565649088.db2.gz PXTMJPVCOYOIBS-MRVPVSSYSA-N 0 0 382.218 3.090 20 5 GGBDRN Cc1cc(F)cc2c1CN(S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000409931825 565650060 /nfs/dbraw/zinc/65/00/60/565650060.db2.gz SKCZNYDTMYDGEY-UHFFFAOYSA-N 0 0 384.816 3.443 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CSc2ncc(C(F)(F)F)cc2Cl)c1 ZINC000174669116 565651293 /nfs/dbraw/zinc/65/12/93/565651293.db2.gz GXVUBEKOLCSDSI-VIFPVBQESA-N 0 0 382.751 3.012 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000280110920 565653062 /nfs/dbraw/zinc/65/30/62/565653062.db2.gz KLARHPVVHLEIER-PAUBXPFVSA-N 0 0 390.864 3.126 20 5 GGBDRN Cc1c(CNC(=O)C2(c3cncc(Br)c3)CC2)cccc1[N+](=O)[O-] ZINC000409989785 565656274 /nfs/dbraw/zinc/65/62/74/565656274.db2.gz YPXKLBSRECOJJW-UHFFFAOYSA-N 0 0 390.237 3.409 20 5 GGBDRN C[C@@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000280200520 565657960 /nfs/dbraw/zinc/65/79/60/565657960.db2.gz HRBWEZTVEACRET-LLVKDONJSA-N 0 0 393.241 3.355 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000174830456 565662495 /nfs/dbraw/zinc/66/24/95/565662495.db2.gz NSALAYBNLUIPIY-UHFFFAOYSA-N 0 0 375.328 3.051 20 5 GGBDRN COc1ccc(C(=O)NCCc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000174835008 565662594 /nfs/dbraw/zinc/66/25/94/565662594.db2.gz OPERIMMWOQUJAC-UHFFFAOYSA-N 0 0 375.328 3.051 20 5 GGBDRN C[C@@H](N[C@H](C)c1ccc(Br)cn1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000280288146 565664096 /nfs/dbraw/zinc/66/40/96/565664096.db2.gz DZLMDWVAMMUHLR-GHMZBOCLSA-N 0 0 393.241 3.430 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCCC[C@H]2OC(F)F)c1C ZINC000410171617 565668640 /nfs/dbraw/zinc/66/86/40/565668640.db2.gz NALYWEZRHCYOSR-DGCLKSJQSA-N 0 0 378.397 3.040 20 5 GGBDRN CCC[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000280496663 565674842 /nfs/dbraw/zinc/67/48/42/565674842.db2.gz OYTOJPQMBAEGSZ-WFASDCNBSA-N 0 0 384.479 3.374 20 5 GGBDRN CCC[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000280496659 565674878 /nfs/dbraw/zinc/67/48/78/565674878.db2.gz OYTOJPQMBAEGSZ-SWLSCSKDSA-N 0 0 384.479 3.374 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC(c2ccncc2)CC1 ZINC000192261631 565675113 /nfs/dbraw/zinc/67/51/13/565675113.db2.gz FYVDVEGJSOCMCL-UHFFFAOYSA-N 0 0 381.841 3.212 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)CCSC2CCCCC2)cc1[N+](=O)[O-] ZINC000410296957 565675877 /nfs/dbraw/zinc/67/58/77/565675877.db2.gz HWXHMXTXINSUFN-UHFFFAOYSA-N 0 0 387.527 3.323 20 5 GGBDRN CCn1cc(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)c(C(F)(F)F)n1 ZINC000280549778 565680459 /nfs/dbraw/zinc/68/04/59/565680459.db2.gz DQULRSLWXLSWOI-UHFFFAOYSA-N 0 0 376.722 3.413 20 5 GGBDRN C[C@H](N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1)C(F)(F)F ZINC000175142718 565681525 /nfs/dbraw/zinc/68/15/25/565681525.db2.gz IDCSBMOYVXPDCU-VIFPVBQESA-N 0 0 380.754 3.349 20 5 GGBDRN CN1CCc2nc(NC(=O)c3ccc(Br)cc3[N+](=O)[O-])sc2C1 ZINC000175181373 565683509 /nfs/dbraw/zinc/68/35/09/565683509.db2.gz FRWMGVFRWKQWLX-UHFFFAOYSA-N 0 0 397.254 3.054 20 5 GGBDRN Cc1ncccc1NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000175189654 565683934 /nfs/dbraw/zinc/68/39/34/565683934.db2.gz UOTBMEJBHSFUQV-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc(Br)cn2)ccc1[N+](=O)[O-] ZINC000280622740 565684362 /nfs/dbraw/zinc/68/43/62/565684362.db2.gz ZAQMKYYWJOTHFH-NSHDSACASA-N 0 0 394.225 3.317 20 5 GGBDRN O=C1CN(Cc2cccc(Br)c2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000192403082 565685495 /nfs/dbraw/zinc/68/54/95/565685495.db2.gz LIFMSAFIXQLGJZ-UHFFFAOYSA-N 0 0 390.193 3.326 20 5 GGBDRN CN1C(=O)N(c2cccc([N+](=O)[O-])c2)C(=O)[C@H]1c1cccc(Br)c1 ZINC000192403043 565685657 /nfs/dbraw/zinc/68/56/57/565685657.db2.gz LUJBFXYSIZPHCG-CQSZACIVSA-N 0 0 390.193 3.497 20 5 GGBDRN Cc1nc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(Br)s1 ZINC000410561992 565689423 /nfs/dbraw/zinc/68/94/23/565689423.db2.gz IPIUPPIDFRMHDG-UHFFFAOYSA-N 0 0 382.239 3.321 20 5 GGBDRN Cc1c(NC(=O)N2CCO[C@H]3CCC[C@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000280694273 565689469 /nfs/dbraw/zinc/68/94/69/565689469.db2.gz HCBKVQREKLDSOU-OCCSQVGLSA-N 0 0 384.230 3.451 20 5 GGBDRN C[C@H](CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1cccs1 ZINC000175282711 565690351 /nfs/dbraw/zinc/69/03/51/565690351.db2.gz MWQULLJQDXZFNM-JTQLQIEISA-N 0 0 381.841 3.243 20 5 GGBDRN C[C@@H](CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1cccs1 ZINC000175282726 565690413 /nfs/dbraw/zinc/69/04/13/565690413.db2.gz MWQULLJQDXZFNM-SNVBAGLBSA-N 0 0 381.841 3.243 20 5 GGBDRN COc1ccc(S(=O)(=O)N(CC(F)(F)F)C2CCCC2)c([N+](=O)[O-])c1 ZINC000175305540 565693013 /nfs/dbraw/zinc/69/30/13/565693013.db2.gz UOQUJWQJYQYHKJ-UHFFFAOYSA-N 0 0 382.360 3.099 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000280754405 565693984 /nfs/dbraw/zinc/69/39/84/565693984.db2.gz QCKDHNNNSZSHHS-AWEZNQCLSA-N 0 0 397.204 3.057 20 5 GGBDRN COc1ccc(CSCC(=O)NCc2nc(C)c(C)s2)cc1[N+](=O)[O-] ZINC000175347944 565695032 /nfs/dbraw/zinc/69/50/32/565695032.db2.gz OWLXOKOSBUJKMK-UHFFFAOYSA-N 0 0 381.479 3.226 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(c3ncc([N+](=O)[O-])s3)CC2)cc1Cl ZINC000192505168 565696108 /nfs/dbraw/zinc/69/61/08/565696108.db2.gz GUKIWAVIJHQKQD-UHFFFAOYSA-N 0 0 381.845 3.367 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1c(F)cccc1Br ZINC000175397801 565696876 /nfs/dbraw/zinc/69/68/76/565696876.db2.gz LMCLNWQMMQIAKA-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN O=C(NC[C@@H]1CSCCS1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000280878814 565701071 /nfs/dbraw/zinc/70/10/71/565701071.db2.gz CGPXQRQRQHHEKN-CYBMUJFWSA-N 0 0 375.475 3.235 20 5 GGBDRN O=C(NC[C@H]1CSCCS1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000280878819 565701583 /nfs/dbraw/zinc/70/15/83/565701583.db2.gz CGPXQRQRQHHEKN-ZDUSSCGKSA-N 0 0 375.475 3.235 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(Br)c(C2CC2)n1 ZINC000410966290 565702289 /nfs/dbraw/zinc/70/22/89/565702289.db2.gz QYQMEOPRYXDCEY-UHFFFAOYSA-N 0 0 376.210 3.233 20 5 GGBDRN O=C(N1CCc2ccc([N+](=O)[O-])cc21)C1(c2cncc(Br)c2)CC1 ZINC000280900346 565702283 /nfs/dbraw/zinc/70/22/83/565702283.db2.gz DSLFWDVPGXQQTM-UHFFFAOYSA-N 0 0 388.221 3.373 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(Br)c(C2CC2)n1 ZINC000410960549 565702418 /nfs/dbraw/zinc/70/24/18/565702418.db2.gz DFVMDTDWHMAXDJ-UHFFFAOYSA-N 0 0 394.200 3.372 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2nc(C)cs2)C(F)(F)F)c1 ZINC000411006885 565704149 /nfs/dbraw/zinc/70/41/49/565704149.db2.gz KVKZUAZUDGZXQR-LLVKDONJSA-N 0 0 375.328 3.402 20 5 GGBDRN C[C@@H](CO)N(CC1CCC1)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000280937392 565704573 /nfs/dbraw/zinc/70/45/73/565704573.db2.gz YSTDBVNHKASGTJ-VIFPVBQESA-N 0 0 389.221 3.120 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(I)c(C)n1 ZINC000192683538 565705217 /nfs/dbraw/zinc/70/52/17/565705217.db2.gz LTDUAWBMBKVTCD-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN COc1ccc2c(n1)N(C(=O)c1cc([N+](=O)[O-])cc(Br)c1C)CC2 ZINC000411041202 565706248 /nfs/dbraw/zinc/70/62/48/565706248.db2.gz BGOYFGJVYOMAPM-UHFFFAOYSA-N 0 0 392.209 3.272 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCC[C@@H]1O ZINC000330480898 565709234 /nfs/dbraw/zinc/70/92/34/565709234.db2.gz OJBMXGLTDAROHD-NHYWBVRUSA-N 0 0 385.258 3.289 20 5 GGBDRN COc1cccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1OC ZINC000175572695 565709540 /nfs/dbraw/zinc/70/95/40/565709540.db2.gz FNMSGKOEHMZDEI-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CC(C)(C)c1nnc2sc(SCc3ccc([N+](=O)[O-])cc3)nn2c1=O ZINC000192786704 565709573 /nfs/dbraw/zinc/70/95/73/565709573.db2.gz PFVUZGANJVRKAH-UHFFFAOYSA-N 0 0 377.451 3.044 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCc2ccc(Br)c(C)c21 ZINC000411095198 565711354 /nfs/dbraw/zinc/71/13/54/565711354.db2.gz QYFLSMQPXPBLAQ-UHFFFAOYSA-N 0 0 393.241 3.150 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCc2cc(Cl)cc(Br)c21 ZINC000411115034 565713003 /nfs/dbraw/zinc/71/30/03/565713003.db2.gz YWUQLBHYGQFDCR-UHFFFAOYSA-N 0 0 399.632 3.187 20 5 GGBDRN CCc1n[nH]c(C(=O)NC(C)(C)c2ccccc2Br)c1[N+](=O)[O-] ZINC000192825934 565713371 /nfs/dbraw/zinc/71/33/71/565713371.db2.gz ZHHOIDVRIPOEIO-UHFFFAOYSA-N 0 0 381.230 3.308 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])C2)n1 ZINC000175666451 565714852 /nfs/dbraw/zinc/71/48/52/565714852.db2.gz YJIIHQHZZKRTNW-JTQLQIEISA-N 0 0 395.213 3.069 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)NCCc1ccc(Cl)s1 ZINC000411149618 565715395 /nfs/dbraw/zinc/71/53/95/565715395.db2.gz RTGGHZYYTCRHEU-UHFFFAOYSA-N 0 0 381.841 3.224 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@H]2CCO[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000330630514 565715525 /nfs/dbraw/zinc/71/55/25/565715525.db2.gz OLKTYNXSIBYCLH-XHDPSFHLSA-N 0 0 376.862 3.039 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Br)c(C)cc2OC)c1[N+](=O)[O-] ZINC000192900130 565718605 /nfs/dbraw/zinc/71/86/05/565718605.db2.gz LMLQHAFGAGEJAQ-UHFFFAOYSA-N 0 0 383.202 3.212 20 5 GGBDRN Cn1c(=O)oc2cc(NC(=O)c3ccc(Br)cc3[N+](=O)[O-])ccc21 ZINC000175763035 565722978 /nfs/dbraw/zinc/72/29/78/565722978.db2.gz ADYGUIRXFSOMMN-UHFFFAOYSA-N 0 0 392.165 3.055 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])ccc1C(N)=O ZINC000175768753 565723039 /nfs/dbraw/zinc/72/30/39/565723039.db2.gz QBTBMGGTHWSVLU-UHFFFAOYSA-N 0 0 378.182 3.017 20 5 GGBDRN CN(C[C@@H]1CC=CCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000330809500 565724027 /nfs/dbraw/zinc/72/40/27/565724027.db2.gz BCHWGEREDPOBTB-LLVKDONJSA-N 0 0 389.271 3.334 20 5 GGBDRN CSc1ccc(C(=O)NC2CCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000281323750 565724179 /nfs/dbraw/zinc/72/41/79/565724179.db2.gz QAZNNMGCFWPWCN-UHFFFAOYSA-N 0 0 378.479 3.172 20 5 GGBDRN Cn1cc([C@H]2OCCC[C@@H]2Nc2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000281333746 565724229 /nfs/dbraw/zinc/72/42/29/565724229.db2.gz VYTLBWWWASVDQU-LSDHHAIUSA-N 0 0 381.230 3.423 20 5 GGBDRN CC(=O)N[C@@H]1CC[C@H](C(F)(F)F)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000330848486 565724994 /nfs/dbraw/zinc/72/49/94/565724994.db2.gz MDNNHVISAZGCIA-TZMCWYRMSA-N 0 0 379.766 3.280 20 5 GGBDRN C[C@H](O)C[C@@H]1CCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000330949381 565731456 /nfs/dbraw/zinc/73/14/56/565731456.db2.gz HFYNGKLVFAIVHB-AAEUAGOBSA-N 0 0 385.258 3.052 20 5 GGBDRN C[C@@H](O)C[C@@H]1CCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000330949384 565731619 /nfs/dbraw/zinc/73/16/19/565731619.db2.gz HFYNGKLVFAIVHB-YPMHNXCESA-N 0 0 385.258 3.052 20 5 GGBDRN CC1(C)[C@H](C(F)(F)F)CCN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000330955974 565732184 /nfs/dbraw/zinc/73/21/84/565732184.db2.gz HJEUKASAJGZOFH-CYBMUJFWSA-N 0 0 380.388 3.031 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000175905674 565732709 /nfs/dbraw/zinc/73/27/09/565732709.db2.gz QMWQGKAXQZZJMZ-SNVBAGLBSA-N 0 0 392.209 3.114 20 5 GGBDRN COc1ccc(NC(=O)C2(c3cncc(Br)c3)CC2)cc1[N+](=O)[O-] ZINC000281515786 565734370 /nfs/dbraw/zinc/73/43/70/565734370.db2.gz XQBMPZUXVYJFHT-UHFFFAOYSA-N 0 0 392.209 3.431 20 5 GGBDRN CC[C@@H]1[C@H](C)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331073385 565738033 /nfs/dbraw/zinc/73/80/33/565738033.db2.gz TWZOVSMTKNDHTH-BXKDBHETSA-N 0 0 377.260 3.166 20 5 GGBDRN CN(CC(=O)Nc1nnc(-c2ccsc2)s1)c1ccccc1[N+](=O)[O-] ZINC000175981919 565739302 /nfs/dbraw/zinc/73/93/02/565739302.db2.gz ORZXAHVAFQPZMV-UHFFFAOYSA-N 0 0 375.435 3.250 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175991940 565739647 /nfs/dbraw/zinc/73/96/47/565739647.db2.gz JLXQZYODAOFMSV-QMMMGPOBSA-N 0 0 382.214 3.323 20 5 GGBDRN C[S@@](=O)c1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000176013734 565740727 /nfs/dbraw/zinc/74/07/27/565740727.db2.gz JXVNVXBALRNKBU-JOCHJYFZSA-N 0 0 383.223 3.347 20 5 GGBDRN O=C(Nc1ccc2c(c1)NC(=O)CC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176009236 565740978 /nfs/dbraw/zinc/74/09/78/565740978.db2.gz MZWWUISNUWHRBL-UHFFFAOYSA-N 0 0 390.193 3.494 20 5 GGBDRN CO[C@@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@H](C)C1 ZINC000281646928 565741138 /nfs/dbraw/zinc/74/11/38/565741138.db2.gz BCPRFMASRRFLRS-PSASIEDQSA-N 0 0 375.194 3.136 20 5 GGBDRN Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(I)c2C)n1 ZINC000193281335 565742624 /nfs/dbraw/zinc/74/26/24/565742624.db2.gz XRYVFOKPCVLWFI-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN COc1cc(C(=O)N2CCC(C)=C(Br)C2)c([N+](=O)[O-])cc1OC ZINC000281696112 565742709 /nfs/dbraw/zinc/74/27/09/565742709.db2.gz GVXDOKOKJMHXLH-UHFFFAOYSA-N 0 0 385.214 3.127 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2C[C@@]2(C)C(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000411660830 565743765 /nfs/dbraw/zinc/74/37/65/565743765.db2.gz ARTXVVPPQWCXIG-BBRMVZONSA-N 0 0 398.257 3.155 20 5 GGBDRN COC(=O)c1cc(Br)ccc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000193360150 565746633 /nfs/dbraw/zinc/74/66/33/565746633.db2.gz KCQHGKGVTUCGBA-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN Cc1nc(NC(=O)Cc2cccc([N+](=O)[O-])c2)ccc1I ZINC000176102772 565749030 /nfs/dbraw/zinc/74/90/30/565749030.db2.gz JNQXCLSZEPOPNO-UHFFFAOYSA-N 0 0 397.172 3.084 20 5 GGBDRN Cc1csc(NC(=O)CSCc2cc([N+](=O)[O-])cc3c2OCOC3)n1 ZINC000281810198 565749625 /nfs/dbraw/zinc/74/96/25/565749625.db2.gz GAGZAQUBARJSPU-UHFFFAOYSA-N 0 0 381.435 3.098 20 5 GGBDRN Cc1c(C(=O)N2CCC(C)=C(Br)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000281838565 565751527 /nfs/dbraw/zinc/75/15/27/565751527.db2.gz PJIKVPSBOIZOTK-UHFFFAOYSA-N 0 0 384.186 3.326 20 5 GGBDRN O=C(NCc1nc2cc(F)ccc2[nH]1)c1ccc([N+](=O)[O-])cc1Br ZINC000176126525 565752710 /nfs/dbraw/zinc/75/27/10/565752710.db2.gz LBWZUNKWAJHEKC-UHFFFAOYSA-N 0 0 393.172 3.303 20 5 GGBDRN O=C(N[C@H]1CCCC12CCOCC2)c1cccc([N+](=O)[O-])c1Br ZINC000281885908 565753878 /nfs/dbraw/zinc/75/38/78/565753878.db2.gz DMNMNPWBFDKAQC-ZDUSSCGKSA-N 0 0 383.242 3.436 20 5 GGBDRN CN(C1CCCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331323243 565754293 /nfs/dbraw/zinc/75/42/93/565754293.db2.gz DAJFEVFKWYQPFQ-UHFFFAOYSA-N 0 0 377.260 3.311 20 5 GGBDRN CC[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000331321990 565754412 /nfs/dbraw/zinc/75/44/12/565754412.db2.gz CPVUMVWZJFNMTB-SNVBAGLBSA-N 0 0 377.260 3.168 20 5 GGBDRN CC(C)[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331323248 565754485 /nfs/dbraw/zinc/75/44/85/565754485.db2.gz DAMCQRDKGCTXKF-LBPRGKRZSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C([C@@H]1Cc2cc(Br)ccc2O1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000193487943 565755347 /nfs/dbraw/zinc/75/53/47/565755347.db2.gz QVZZPDZKOSFQOP-INIZCTEOSA-N 0 0 389.205 3.250 20 5 GGBDRN CC[C@H]1C[C@H](C)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331331464 565755596 /nfs/dbraw/zinc/75/55/96/565755596.db2.gz HXXBKXNQYMOLQV-UWVGGRQHSA-N 0 0 377.260 3.166 20 5 GGBDRN COC[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000176189151 565755785 /nfs/dbraw/zinc/75/57/85/565755785.db2.gz JZAVPLJQIUHTNR-GFCCVEGCSA-N 0 0 383.198 3.376 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ncccc1Br ZINC000193539526 565759970 /nfs/dbraw/zinc/75/99/70/565759970.db2.gz LIQHIOUVEBHFSM-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C([C@@H]1Cc2cc(Br)ccc2O1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000193563683 565761581 /nfs/dbraw/zinc/76/15/81/565761581.db2.gz QAWDTFLUVIHRFS-INIZCTEOSA-N 0 0 389.205 3.250 20 5 GGBDRN O=C(N[C@@H]1CCCC12CCOCC2)c1cc([N+](=O)[O-])ccc1Br ZINC000282029135 565761811 /nfs/dbraw/zinc/76/18/11/565761811.db2.gz OAPOEROJIXSMNR-CQSZACIVSA-N 0 0 383.242 3.436 20 5 GGBDRN O=C(N[C@H]1CCCC12CCOCC2)c1cc([N+](=O)[O-])ccc1Br ZINC000282029133 565762000 /nfs/dbraw/zinc/76/20/00/565762000.db2.gz OAPOEROJIXSMNR-AWEZNQCLSA-N 0 0 383.242 3.436 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(F)ccc1Br ZINC000193587501 565763517 /nfs/dbraw/zinc/76/35/17/565763517.db2.gz VCIISPUQIZSZNQ-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Nc1c(C(=O)N2CCc3c(Br)cccc3C2)cccc1[N+](=O)[O-] ZINC000176325054 565764847 /nfs/dbraw/zinc/76/48/47/565764847.db2.gz AWWQSXULTNBMPV-UHFFFAOYSA-N 0 0 376.210 3.138 20 5 GGBDRN O=C(N[C@H]1CCCC12CCOCC2)c1ccc([N+](=O)[O-])cc1Br ZINC000282109956 565764962 /nfs/dbraw/zinc/76/49/62/565764962.db2.gz UAJUWMHQCLKOIS-AWEZNQCLSA-N 0 0 383.242 3.436 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N(C)CC1CCC1 ZINC000193633511 565766773 /nfs/dbraw/zinc/76/67/73/565766773.db2.gz XILWFYSXDFHOOQ-UHFFFAOYSA-N 0 0 388.205 3.380 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)CC1CC1 ZINC000193638081 565767449 /nfs/dbraw/zinc/76/74/49/565767449.db2.gz HGNKPYDIPDAETJ-MRVPVSSYSA-N 0 0 388.205 3.426 20 5 GGBDRN CSc1ccc(C(=O)NCCN2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000193693351 565770853 /nfs/dbraw/zinc/77/08/53/565770853.db2.gz XSZBLCIZHRCPIF-UHFFFAOYSA-N 0 0 377.491 3.166 20 5 GGBDRN C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000331606566 565771154 /nfs/dbraw/zinc/77/11/54/565771154.db2.gz OSPYIBUEBOVOEQ-BMIGLBTASA-N 0 0 394.225 3.288 20 5 GGBDRN O=C(NC[C@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000282275589 565772814 /nfs/dbraw/zinc/77/28/14/565772814.db2.gz YOMKPDKHFRUJHP-VIFPVBQESA-N 0 0 375.759 3.128 20 5 GGBDRN O=C(NC[C@@H]1CCCC(F)(F)C1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000282275585 565772866 /nfs/dbraw/zinc/77/28/66/565772866.db2.gz YOMKPDKHFRUJHP-SECBINFHSA-N 0 0 375.759 3.128 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000331664266 565774937 /nfs/dbraw/zinc/77/49/37/565774937.db2.gz WZCPYECFZVXNAF-NFAWXSAZSA-N 0 0 384.885 3.492 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2nc3c(s2)CSCC3)c1F ZINC000412328974 565781666 /nfs/dbraw/zinc/78/16/66/565781666.db2.gz ARKSCLKBDMQTDY-UHFFFAOYSA-N 0 0 383.426 3.170 20 5 GGBDRN O=C(NCc1cc(Br)ccn1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412366791 565785051 /nfs/dbraw/zinc/78/50/51/565785051.db2.gz ROJXVXCPHYXKAF-LSDHHAIUSA-N 0 0 376.210 3.172 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000331820701 565785777 /nfs/dbraw/zinc/78/57/77/565785777.db2.gz PKALMDWTBUJWGJ-KYOSRNDESA-N 0 0 383.242 3.123 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCc2c(Br)ccc(C)c21 ZINC000331884585 565789892 /nfs/dbraw/zinc/78/98/92/565789892.db2.gz CTIAPDFQMZARJZ-UHFFFAOYSA-N 0 0 393.241 3.150 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc([S@](C)=O)cc1 ZINC000176631535 565790515 /nfs/dbraw/zinc/79/05/15/565790515.db2.gz HTJHIWALAASVMC-YDBLSZJJSA-N 0 0 378.475 3.129 20 5 GGBDRN CSC1(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CCC1 ZINC000194009433 565790710 /nfs/dbraw/zinc/79/07/10/565790710.db2.gz UVIOMEWTGXXSEO-UHFFFAOYSA-N 0 0 384.401 3.178 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]1C(C)C ZINC000331896665 565790902 /nfs/dbraw/zinc/79/09/02/565790902.db2.gz DUXOQTLLTXJCQJ-ZDUSSCGKSA-N 0 0 388.205 3.378 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc([S@@](C)=O)cc1 ZINC000176631568 565790994 /nfs/dbraw/zinc/79/09/94/565790994.db2.gz HTJHIWALAASVMC-XELLLNAOSA-N 0 0 378.475 3.129 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(Cc2ccccn2)C2CC2)cc1[N+](=O)[O-] ZINC000176653981 565791592 /nfs/dbraw/zinc/79/15/92/565791592.db2.gz JKHVWVJDMNRTRK-UHFFFAOYSA-N 0 0 381.841 3.305 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(Cc2cccnc2)C2CC2)cc1[N+](=O)[O-] ZINC000176656125 565791644 /nfs/dbraw/zinc/79/16/44/565791644.db2.gz VGSMVWBQAAYSGK-UHFFFAOYSA-N 0 0 381.841 3.305 20 5 GGBDRN CC1(C)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)c2cc(Br)ccc21 ZINC000331923621 565792903 /nfs/dbraw/zinc/79/29/03/565792903.db2.gz IXHITBFINTVIFA-UHFFFAOYSA-N 0 0 393.241 3.268 20 5 GGBDRN CCSCCCNC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000282690944 565793037 /nfs/dbraw/zinc/79/30/37/565793037.db2.gz PFLWAVXROXLTGP-UHFFFAOYSA-N 0 0 394.234 3.072 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1CCOc2ccc(Br)cc21 ZINC000331916718 565793010 /nfs/dbraw/zinc/79/30/10/565793010.db2.gz IATZHNQVFOMKDN-GFCCVEGCSA-N 0 0 394.225 3.292 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCc3c(Br)ccc(C)c32)n1 ZINC000331927876 565793865 /nfs/dbraw/zinc/79/38/65/565793865.db2.gz DLBMGPHRDIEUMC-UHFFFAOYSA-N 0 0 393.241 3.475 20 5 GGBDRN COc1cccc(C(=O)NCCOc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000194113803 565794885 /nfs/dbraw/zinc/79/48/85/565794885.db2.gz QVMSNVRLVBXUNI-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN Cn1cc([C@H]2CCCCN2C(=O)c2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000331962856 565796212 /nfs/dbraw/zinc/79/62/12/565796212.db2.gz PVWUXACANTYUMX-CQSZACIVSA-N 0 0 393.241 3.458 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@H]1C1CCOCC1 ZINC000331974747 565796964 /nfs/dbraw/zinc/79/69/64/565796964.db2.gz RXHGARUSLRRGKZ-HNNXBMFYSA-N 0 0 383.242 3.389 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1cc(F)cc(Br)c1 ZINC000176719300 565797399 /nfs/dbraw/zinc/79/73/99/565797399.db2.gz FOGQIGNASFMHJM-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)c2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000331995568 565797945 /nfs/dbraw/zinc/79/79/45/565797945.db2.gz ZZXXKRRJTIDYDC-CQSZACIVSA-N 0 0 395.209 3.472 20 5 GGBDRN Cc1cncc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c1 ZINC000176725513 565798681 /nfs/dbraw/zinc/79/86/81/565798681.db2.gz AQJJYVHCQYQXEP-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN C[C@H]1CN2CCCC[C@@H]2CN1C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000332008988 565799105 /nfs/dbraw/zinc/79/91/05/565799105.db2.gz QJOVGHFOSVUFLZ-VHSXEESVSA-N 0 0 388.287 3.118 20 5 GGBDRN O=C(CSc1nnnn1C1CCCC1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000282839456 565799182 /nfs/dbraw/zinc/79/91/82/565799182.db2.gz ACIJVXGUAXUWOL-UHFFFAOYSA-N 0 0 382.833 3.081 20 5 GGBDRN CO[C@](C)([C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000412608066 565799895 /nfs/dbraw/zinc/79/98/95/565799895.db2.gz XKRUWXQSJRBVSK-QLJPJBMISA-N 0 0 385.258 3.220 20 5 GGBDRN Cc1nn(CCC(=O)NCc2cc(C)ccc2Br)c(C)c1[N+](=O)[O-] ZINC000412638628 565802463 /nfs/dbraw/zinc/80/24/63/565802463.db2.gz JAXJCNPMYCLWAR-UHFFFAOYSA-N 0 0 395.257 3.186 20 5 GGBDRN O=C(NCCOc1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1F ZINC000194221237 565802818 /nfs/dbraw/zinc/80/28/18/565802818.db2.gz WLHIXWWGKSFUHP-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN CSc1ccc(C(=O)N2CCCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000194238734 565804242 /nfs/dbraw/zinc/80/42/42/565804242.db2.gz XQGDVTDLTGGPTR-UHFFFAOYSA-N 0 0 377.388 3.027 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCO[C@@H](c2ccco2)C1 ZINC000176810956 565804769 /nfs/dbraw/zinc/80/47/69/565804769.db2.gz HNALVRUJVILAAM-CQSZACIVSA-N 0 0 381.182 3.164 20 5 GGBDRN O=C(NC[C@H](CCO)c1ccccc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176803086 565805036 /nfs/dbraw/zinc/80/50/36/565805036.db2.gz NWUISBYVRWFVNH-ZDUSSCGKSA-N 0 0 393.237 3.253 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCO[C@H](c2ccco2)C1 ZINC000176810938 565805483 /nfs/dbraw/zinc/80/54/83/565805483.db2.gz HNALVRUJVILAAM-AWEZNQCLSA-N 0 0 381.182 3.164 20 5 GGBDRN CCC(CC)(CCO)NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000283029032 565807067 /nfs/dbraw/zinc/80/70/67/565807067.db2.gz HLHWRLUXABNGDG-UHFFFAOYSA-N 0 0 377.210 3.167 20 5 GGBDRN C[C@@H](N(C)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1(C)CC1 ZINC000332124089 565807684 /nfs/dbraw/zinc/80/76/84/565807684.db2.gz IFLNTSGQEHQFIN-SECBINFHSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1cnc(N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(Br)c1 ZINC000194324562 565809716 /nfs/dbraw/zinc/80/97/16/565809716.db2.gz PJRMNXCDPFUYPT-NSHDSACASA-N 0 0 378.230 3.147 20 5 GGBDRN O=C(CCN1CCSC[C@H]1c1nccs1)Nc1ccccc1[N+](=O)[O-] ZINC000283228714 565812754 /nfs/dbraw/zinc/81/27/54/565812754.db2.gz IMRRUSVFVXFKEI-AWEZNQCLSA-N 0 0 378.479 3.170 20 5 GGBDRN COCCN(CC(F)F)C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000283254154 565814350 /nfs/dbraw/zinc/81/43/50/565814350.db2.gz BSXUQTXPRBMYOR-UHFFFAOYSA-N 0 0 381.173 3.019 20 5 GGBDRN CC[C@H]1c2ccsc2CCN1C(=O)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000332227184 565817905 /nfs/dbraw/zinc/81/79/05/565817905.db2.gz KRTZGRUSAQHQBY-NSHDSACASA-N 0 0 399.270 3.151 20 5 GGBDRN CO[C@@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000176954591 565818576 /nfs/dbraw/zinc/81/85/76/565818576.db2.gz RTNZTNBOFNIFSY-HNNXBMFYSA-N 0 0 379.210 3.475 20 5 GGBDRN COc1ccc([C@@H](CCO)Nc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000176959904 565818787 /nfs/dbraw/zinc/81/87/87/565818787.db2.gz JEZQOBAHNDDPQT-CQSZACIVSA-N 0 0 382.214 3.297 20 5 GGBDRN CC(C)(CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1cccnc1 ZINC000412885340 565819130 /nfs/dbraw/zinc/81/91/30/565819130.db2.gz LRSFODVXDACPQF-UHFFFAOYSA-N 0 0 378.226 3.460 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2nnc(C3CC3)s2)cc1[N+](=O)[O-] ZINC000412888363 565819389 /nfs/dbraw/zinc/81/93/89/565819389.db2.gz FBIBICBWDOQMLZ-UHFFFAOYSA-N 0 0 397.254 3.325 20 5 GGBDRN O=C(NCc1nnc(C2CC2)s1)c1sc(Br)cc1[N+](=O)[O-] ZINC000412890663 565819402 /nfs/dbraw/zinc/81/94/02/565819402.db2.gz PNJMIINWRNQMJX-UHFFFAOYSA-N 0 0 389.256 3.078 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1nnc(C2CC2)s1 ZINC000412888864 565819638 /nfs/dbraw/zinc/81/96/38/565819638.db2.gz HOIIPRJTSIUIMB-UHFFFAOYSA-N 0 0 397.254 3.325 20 5 GGBDRN COC[C@H](C)Sc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000332248226 565821338 /nfs/dbraw/zinc/82/13/38/565821338.db2.gz XJVHCLOIOBBNGL-ZDUSSCGKSA-N 0 0 388.511 3.287 20 5 GGBDRN C[C@@H](O)C[C@@H]1CCCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000332254150 565822709 /nfs/dbraw/zinc/82/27/09/565822709.db2.gz CUILLOMVIHUEOT-OCCSQVGLSA-N 0 0 399.285 3.442 20 5 GGBDRN CC(C)[C@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1cccnc1 ZINC000177018004 565822780 /nfs/dbraw/zinc/82/27/80/565822780.db2.gz ZADGMDJNDXRNBQ-ZDUSSCGKSA-N 0 0 383.857 3.361 20 5 GGBDRN CC(C)[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1cccnc1 ZINC000177016497 565823140 /nfs/dbraw/zinc/82/31/40/565823140.db2.gz FUFWLVSUOSIEIA-CQSZACIVSA-N 0 0 383.857 3.361 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)CCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000177056491 565825238 /nfs/dbraw/zinc/82/52/38/565825238.db2.gz AMBSZFXBKOGHDD-UHFFFAOYSA-N 0 0 384.841 3.120 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cnc(C2OCCO2)s1 ZINC000283662534 565826072 /nfs/dbraw/zinc/82/60/72/565826072.db2.gz DPBLCIYBUHDIKA-UHFFFAOYSA-N 0 0 383.813 3.022 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cc(F)cc(F)c2Br)c1 ZINC000194667138 565830312 /nfs/dbraw/zinc/83/03/12/565830312.db2.gz GHHSRMYCMVKXFE-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN CSc1ccc(C(=O)N2CCN([C@H](C)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000177131535 565830708 /nfs/dbraw/zinc/83/07/08/565830708.db2.gz JAQCFJJEPRRVMR-SNVBAGLBSA-N 0 0 377.388 3.025 20 5 GGBDRN Cc1c(NC(=O)N2CCOCC(F)(F)C2)cc(Br)cc1[N+](=O)[O-] ZINC000332342333 565830833 /nfs/dbraw/zinc/83/08/33/565830833.db2.gz PYJZEJIXMOAWQH-UHFFFAOYSA-N 0 0 394.172 3.165 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H](C)c1ccccc1Br ZINC000194687461 565831384 /nfs/dbraw/zinc/83/13/84/565831384.db2.gz WKMFADFOKFWTKW-JTQLQIEISA-N 0 0 381.230 3.082 20 5 GGBDRN Cc1ncsc1C(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000283828477 565832698 /nfs/dbraw/zinc/83/26/98/565832698.db2.gz AJMOCIHHRGNVEJ-UHFFFAOYSA-N 0 0 382.239 3.321 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1c2c(nn1C)CCC2 ZINC000283869133 565833659 /nfs/dbraw/zinc/83/36/59/565833659.db2.gz ITQYZCNYIOJNAU-UHFFFAOYSA-N 0 0 379.214 3.140 20 5 GGBDRN C[C@@H]1CC(=O)CC[C@H]1C(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000283885199 565833723 /nfs/dbraw/zinc/83/37/23/565833723.db2.gz AJTIOOQWZPYHPW-ZYHUDNBSSA-N 0 0 395.253 3.247 20 5 GGBDRN CC(C)(C)c1cnc([S@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000283902737 565835061 /nfs/dbraw/zinc/83/50/61/565835061.db2.gz USLCQBRYNQPZFJ-RUZDIDTESA-N 0 0 381.479 3.485 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)CCc1ccncc1 ZINC000283943266 565836470 /nfs/dbraw/zinc/83/64/70/565836470.db2.gz MZLLSVXVDLQMOI-UHFFFAOYSA-N 0 0 378.226 3.375 20 5 GGBDRN Cc1nn(C)cc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000283979482 565837336 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O=[N+]([O-])c1cnc(NC[C@H](CO)Cc2cccc(Br)c2)c(F)c1 ZINC000413260821 565842775 /nfs/dbraw/zinc/84/27/75/565842775.db2.gz JYNMKJUCFVFWRT-LLVKDONJSA-N 0 0 384.205 3.155 20 5 GGBDRN O=[N+]([O-])c1cnc(NC[C@@H](CO)Cc2cccc(Br)c2)c(F)c1 ZINC000413260822 565843488 /nfs/dbraw/zinc/84/34/88/565843488.db2.gz JYNMKJUCFVFWRT-NSHDSACASA-N 0 0 384.205 3.155 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCN(c3cccc(Br)c3)CC2)c(F)c1 ZINC000413304262 565845254 /nfs/dbraw/zinc/84/52/54/565845254.db2.gz ZPKUAIXAFSGAKF-UHFFFAOYSA-N 0 0 381.205 3.218 20 5 GGBDRN C[C@@H]1C[C@H](C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CCO1 ZINC000284169811 565845262 /nfs/dbraw/zinc/84/52/62/565845262.db2.gz RLHWGEXRCJCUSZ-GHMZBOCLSA-N 0 0 383.242 3.057 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000177377879 565846490 /nfs/dbraw/zinc/84/64/90/565846490.db2.gz CGMVIOXOFIPZRN-SECBINFHSA-N 0 0 381.230 3.004 20 5 GGBDRN O=C(NCCc1ccc(Cl)s1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194914722 565846959 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20 5 GGBDRN CC(C)Oc1cc(Br)cc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1 ZINC000177440521 565851594 /nfs/dbraw/zinc/85/15/94/565851594.db2.gz XKCDCGKTHJKBCP-UHFFFAOYSA-N 0 0 397.229 3.370 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@H](CO)Cc2cc(F)cc(Br)c2)cn1 ZINC000413445245 565852191 /nfs/dbraw/zinc/85/21/91/565852191.db2.gz WLSQNCYVVRVZBY-LLVKDONJSA-N 0 0 384.205 3.155 20 5 GGBDRN O=[N+]([O-])c1cccnc1NC[C@H](CO)Cc1cc(F)cc(Br)c1 ZINC000413437975 565852339 /nfs/dbraw/zinc/85/23/39/565852339.db2.gz PBTDEBMYFMQHQI-LLVKDONJSA-N 0 0 384.205 3.155 20 5 GGBDRN COc1cc(C(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc([N+](=O)[O-])c1OC ZINC000284452861 565853750 /nfs/dbraw/zinc/85/37/50/565853750.db2.gz KSTSBLNTAXPMSG-SWLSCSKDSA-N 0 0 389.235 3.268 20 5 GGBDRN COCCC(C)(C)C(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284441565 565854049 /nfs/dbraw/zinc/85/40/49/565854049.db2.gz JXHLRQJXXOWYJH-UHFFFAOYSA-N 0 0 385.258 3.305 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])c(C2CC2)n1)Nc1ccc(Br)cc1 ZINC000195048441 565855485 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COc1ccc(CN(C)c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])cc1Cl ZINC000413549985 565859450 /nfs/dbraw/zinc/85/94/50/565859450.db2.gz HNGWWVIRTXDHOB-UHFFFAOYSA-N 0 0 384.841 3.297 20 5 GGBDRN O=C(CC[C@@H]1CCOC1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284616645 565860900 /nfs/dbraw/zinc/86/09/00/565860900.db2.gz UKMDYHCYUDQPQW-LLVKDONJSA-N 0 0 383.242 3.059 20 5 GGBDRN Cc1cc(NCC2(CS(C)(=O)=O)CCC2)c(Br)cc1[N+](=O)[O-] ZINC000413575966 565860868 /nfs/dbraw/zinc/86/08/68/565860868.db2.gz GSZUZTYCYCXOOR-UHFFFAOYSA-N 0 0 391.287 3.293 20 5 GGBDRN C[C@@]1(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CCCOC1 ZINC000284610004 565861571 /nfs/dbraw/zinc/86/15/71/565861571.db2.gz UBIGAVGDGLAKHJ-MRXNPFEDSA-N 0 0 383.242 3.059 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1NC1CCN(Cc2cccc(Br)c2)CC1 ZINC000413619821 565862528 /nfs/dbraw/zinc/86/25/28/565862528.db2.gz OJFBHBCIOGDOJD-UHFFFAOYSA-N 0 0 394.273 3.167 20 5 GGBDRN Cc1ccc(CC(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)cn1 ZINC000284663115 565864521 /nfs/dbraw/zinc/86/45/21/565864521.db2.gz WUTVEKFZJGWEPA-UHFFFAOYSA-N 0 0 390.237 3.188 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NCc1ccc(Br)c(F)c1 ZINC000195189166 565865027 /nfs/dbraw/zinc/86/50/27/565865027.db2.gz SOMDREOZLBUIKN-UHFFFAOYSA-N 0 0 382.189 3.496 20 5 GGBDRN CN(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1Br ZINC000195238995 565868302 /nfs/dbraw/zinc/86/83/02/565868302.db2.gz YXRROSPNUAUEGZ-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCSC[C@@H]1c1nccs1 ZINC000413712969 565869964 /nfs/dbraw/zinc/86/99/64/565869964.db2.gz MKZYKYRXPWAFRS-RRFJBIMHSA-N 0 0 375.475 3.472 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)NC1CCN(CC(F)(F)F)CC1 ZINC000195261913 565870999 /nfs/dbraw/zinc/87/09/99/565870999.db2.gz GEOOYGJBCZUHIW-UHFFFAOYSA-N 0 0 380.754 3.396 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000284808859 565871206 /nfs/dbraw/zinc/87/12/06/565871206.db2.gz WSTUUBPAQVBQQE-UKRRQHHQSA-N 0 0 383.242 3.449 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1[C@H]1CCCO1 ZINC000284824394 565872516 /nfs/dbraw/zinc/87/25/16/565872516.db2.gz XZRHJFBURZHAOU-HUUCEWRRSA-N 0 0 383.242 3.449 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1[C@H]1CCCO1 ZINC000284824398 565872705 /nfs/dbraw/zinc/87/27/05/565872705.db2.gz XZRHJFBURZHAOU-LSDHHAIUSA-N 0 0 383.242 3.449 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Cc1cccc(Br)c1 ZINC000195309090 565874999 /nfs/dbraw/zinc/87/49/99/565874999.db2.gz OHELJHDNHZZXGE-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN CC[C@H](C)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000195322386 565875662 /nfs/dbraw/zinc/87/56/62/565875662.db2.gz DSAXUUSAMWLVDM-IUCAKERBSA-N 0 0 376.194 3.364 20 5 GGBDRN Cc1ccc(C[C@@H](C)NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000177829732 565875744 /nfs/dbraw/zinc/87/57/44/565875744.db2.gz NTSWINLMYQBCLA-SECBINFHSA-N 0 0 381.841 3.304 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)c2c1CN(Cc1noc(C3CC3)n1)CC2 ZINC000284898123 565876596 /nfs/dbraw/zinc/87/65/96/565876596.db2.gz URSSWVSYRFSYMA-UHFFFAOYSA-N 0 0 379.214 3.176 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H](C)c1ccccc1Br ZINC000195350410 565877602 /nfs/dbraw/zinc/87/76/02/565877602.db2.gz BSGMDMMANPPYTF-NSHDSACASA-N 0 0 395.257 3.472 20 5 GGBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000413877836 565878722 /nfs/dbraw/zinc/87/87/22/565878722.db2.gz HNJFOXCJASCQCL-MFKMUULPSA-N 0 0 397.250 3.461 20 5 GGBDRN Cn1ncc2c1CCCN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000413872817 565878827 /nfs/dbraw/zinc/87/88/27/565878827.db2.gz NOWGPBKQAOLNAC-UHFFFAOYSA-N 0 0 380.857 3.049 20 5 GGBDRN Cc1c(I)cccc1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000177898375 565880528 /nfs/dbraw/zinc/88/05/28/565880528.db2.gz NUUQMOOGULEIAQ-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN C[C@](O)(CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccsc1 ZINC000177927249 565881391 /nfs/dbraw/zinc/88/13/91/565881391.db2.gz HDZYLMFLOIZPQP-INIZCTEOSA-N 0 0 384.841 3.103 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@@H](C)c2ncc(C)s2)cc1[N+](=O)[O-] ZINC000177922461 565881480 /nfs/dbraw/zinc/88/14/80/565881480.db2.gz MLJZTYIWDFJCOJ-NSHDSACASA-N 0 0 381.479 3.479 20 5 GGBDRN C[C@](O)(CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1cccs1 ZINC000177919717 565881546 /nfs/dbraw/zinc/88/15/46/565881546.db2.gz UXTGPICZCWMOSJ-INIZCTEOSA-N 0 0 384.841 3.103 20 5 GGBDRN C[C@@](O)(CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1cccs1 ZINC000177919699 565881787 /nfs/dbraw/zinc/88/17/87/565881787.db2.gz UXTGPICZCWMOSJ-MRXNPFEDSA-N 0 0 384.841 3.103 20 5 GGBDRN COc1ccc(Br)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000195427012 565882432 /nfs/dbraw/zinc/88/24/32/565882432.db2.gz WNZGUNQESNFNJF-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1I)c1cccnc1 ZINC000195457218 565884453 /nfs/dbraw/zinc/88/44/53/565884453.db2.gz QRNKUUICLGZNJM-VIFPVBQESA-N 0 0 397.172 3.085 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1I)c1cccnc1 ZINC000195457225 565884961 /nfs/dbraw/zinc/88/49/61/565884961.db2.gz QRNKUUICLGZNJM-SECBINFHSA-N 0 0 397.172 3.085 20 5 GGBDRN CC[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1SCCO)CC(F)(F)F ZINC000413997310 565886002 /nfs/dbraw/zinc/88/60/02/565886002.db2.gz CBTJXCCDEBJGET-JTQLQIEISA-N 0 0 380.388 3.388 20 5 GGBDRN O=C(Cc1cccc(I)c1)NCc1cccc([N+](=O)[O-])c1 ZINC000177985544 565886462 /nfs/dbraw/zinc/88/64/62/565886462.db2.gz OPEJBXPTVSEMTR-UHFFFAOYSA-N 0 0 396.184 3.058 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCc1nnc(C2CC2)s1 ZINC000414006540 565886663 /nfs/dbraw/zinc/88/66/63/565886663.db2.gz FPIVNKYCFQABEM-UHFFFAOYSA-N 0 0 382.829 3.062 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC(OC2CCCC2)CC1 ZINC000195480875 565886659 /nfs/dbraw/zinc/88/66/59/565886659.db2.gz IIDHZCHOAZGYRU-UHFFFAOYSA-N 0 0 388.873 3.361 20 5 GGBDRN Cc1c(Cl)cc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000195482199 565887861 /nfs/dbraw/zinc/88/78/61/565887861.db2.gz MDUWPQGYCZCUOU-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN CN(Cc1noc(C2CC2)n1)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000414032974 565888873 /nfs/dbraw/zinc/88/88/73/565888873.db2.gz DJRAECSJGVSWOI-UHFFFAOYSA-N 0 0 382.829 3.259 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)Cc2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000178000033 565889031 /nfs/dbraw/zinc/88/90/31/565889031.db2.gz FESLVHYMVFBPNT-MRVPVSSYSA-N 0 0 399.220 3.143 20 5 GGBDRN C[C@H]1CCCC[C@@H]1OCCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000195669266 565891196 /nfs/dbraw/zinc/89/11/96/565891196.db2.gz KHVNZJORXKBPJI-FZMZJTMJSA-N 0 0 376.862 3.122 20 5 GGBDRN C[C@@H](Cc1cccc(Br)c1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000195683319 565891482 /nfs/dbraw/zinc/89/14/82/565891482.db2.gz FVHWSJCGKXJOBO-VIFPVBQESA-N 0 0 396.216 3.440 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)Cc1ccc(Br)s1 ZINC000195684316 565891520 /nfs/dbraw/zinc/89/15/20/565891520.db2.gz HUJMYTPSODTOLF-UHFFFAOYSA-N 0 0 384.255 3.415 20 5 GGBDRN Cc1cc(C(=O)NCc2cc3c(c(Br)c2)OCO3)cc([N+](=O)[O-])c1 ZINC000195693090 565891579 /nfs/dbraw/zinc/89/15/79/565891579.db2.gz DRNZHIXLKIDIJA-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1NCc1ccc(N2CCOCC2)nc1 ZINC000198704103 565893258 /nfs/dbraw/zinc/89/32/58/565893258.db2.gz NNBZTSYYGIPFJD-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000178094391 565896317 /nfs/dbraw/zinc/89/63/17/565896317.db2.gz KSNOZELITGQAGZ-LAWATIRUSA-N 0 0 384.523 3.271 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)N(Cc2ccccn2)C2CC2)c1 ZINC000285262451 565896531 /nfs/dbraw/zinc/89/65/31/565896531.db2.gz XVGXFDJQBHIJJY-UHFFFAOYSA-N 0 0 385.804 3.136 20 5 GGBDRN CCOc1ccc(C(C)=O)cc1Cn1cc(Br)c(=O)c([N+](=O)[O-])c1 ZINC000178099146 565896664 /nfs/dbraw/zinc/89/66/64/565896664.db2.gz PYEICEQJSXDHGP-UHFFFAOYSA-N 0 0 395.209 3.169 20 5 GGBDRN CO[C@@H](CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1C)c1ccccc1Cl ZINC000218337510 565898541 /nfs/dbraw/zinc/89/85/41/565898541.db2.gz HEXSKIIFVXOPNL-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN Cc1cc(I)ccc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000178145751 565901085 /nfs/dbraw/zinc/90/10/85/565901085.db2.gz XIYAIOQOQQMIDW-UHFFFAOYSA-N 0 0 397.172 3.342 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N(C)CC(=O)Nc2ccc(Br)cc2C)n1 ZINC000178149975 565901147 /nfs/dbraw/zinc/90/11/47/565901147.db2.gz AZQYAIRGYZQLTA-UHFFFAOYSA-N 0 0 393.241 3.444 20 5 GGBDRN Nc1c(C(=O)NC2(c3ccc(Br)cc3)CC2)cccc1[N+](=O)[O-] ZINC000178179122 565904103 /nfs/dbraw/zinc/90/41/03/565904103.db2.gz KWTBIFSHUFPAKE-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN CCCN1CC(=O)N[C@@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000414214625 565904653 /nfs/dbraw/zinc/90/46/53/565904653.db2.gz SQKASGCRNYPFEN-INIZCTEOSA-N 0 0 394.225 3.458 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000285457570 565909315 /nfs/dbraw/zinc/90/93/15/565909315.db2.gz ZTONCQHGZDYQKN-UHFFFAOYSA-N 0 0 395.257 3.333 20 5 GGBDRN CNC(=O)Nc1cccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000178281365 565910041 /nfs/dbraw/zinc/91/00/41/565910041.db2.gz IXUBQDBPCAUFRY-UHFFFAOYSA-N 0 0 393.197 3.361 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)Cc1ccc(Br)cc1 ZINC000178292641 565910468 /nfs/dbraw/zinc/91/04/68/565910468.db2.gz TXJIYUFURYLTTG-UHFFFAOYSA-N 0 0 399.266 3.319 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@]1(C)CCCO ZINC000285531629 565912965 /nfs/dbraw/zinc/91/29/65/565912965.db2.gz HIEWAEVPCWVXJK-MRXNPFEDSA-N 0 0 385.258 3.433 20 5 GGBDRN COCCC1(CNc2ccc(I)cc2[N+](=O)[O-])CC1 ZINC000225368235 565913739 /nfs/dbraw/zinc/91/37/39/565913739.db2.gz LVTVWNVWTNKBRY-UHFFFAOYSA-N 0 0 376.194 3.428 20 5 GGBDRN C[C@@H](Oc1ccc(Oc2ccc(Br)cc2[N+](=O)[O-])cc1)C(N)=O ZINC000225114021 565913861 /nfs/dbraw/zinc/91/38/61/565913861.db2.gz CIROOAZLNCJVSV-SECBINFHSA-N 0 0 381.182 3.402 20 5 GGBDRN O=C(NCCCOCC(F)(F)F)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178435594 565918212 /nfs/dbraw/zinc/91/82/12/565918212.db2.gz UQRSWYXNJXSAHI-UHFFFAOYSA-N 0 0 385.136 3.056 20 5 GGBDRN CO[C@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000178454850 565919432 /nfs/dbraw/zinc/91/94/32/565919432.db2.gz GEGHYPFLJZYERQ-OAHLLOKOSA-N 0 0 379.210 3.475 20 5 GGBDRN Nc1c(C(=O)N[C@@H](c2cncc(Br)c2)C2CC2)cccc1[N+](=O)[O-] ZINC000285670210 565920245 /nfs/dbraw/zinc/92/02/45/565920245.db2.gz ILXYHOIOMIWVJB-OAHLLOKOSA-N 0 0 391.225 3.216 20 5 GGBDRN O=C(NCc1ccc(O)c(Br)c1)NCc1ccccc1[N+](=O)[O-] ZINC000178520567 565923643 /nfs/dbraw/zinc/92/36/43/565923643.db2.gz KRCFYXQPJRQICD-UHFFFAOYSA-N 0 0 380.198 3.062 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@@H]1[C@@H]1CCCO1 ZINC000285780940 565926676 /nfs/dbraw/zinc/92/66/76/565926676.db2.gz LKTAZOQUWLJZNC-YPMHNXCESA-N 0 0 387.205 3.280 20 5 GGBDRN CC(C)CN(Cc1ccccc1Br)C(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000178587233 565928287 /nfs/dbraw/zinc/92/82/87/565928287.db2.gz HGOZUPHZOFEEBR-UHFFFAOYSA-N 0 0 395.257 3.239 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NCc1ccc(O)c(Br)c1 ZINC000178622682 565929471 /nfs/dbraw/zinc/92/94/71/565929471.db2.gz OYERNMPMSKZHRN-UHFFFAOYSA-N 0 0 380.198 3.062 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000285894133 565932434 /nfs/dbraw/zinc/93/24/34/565932434.db2.gz DCXILYBGEXSOLB-CQSZACIVSA-N 0 0 379.214 3.448 20 5 GGBDRN Cc1c(CNC(=O)c2ccc(I)cc2)cccc1[N+](=O)[O-] ZINC000231862857 565932600 /nfs/dbraw/zinc/93/26/00/565932600.db2.gz HCAVNOGCNRYAAO-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc([C@H]3CCS(=O)(=O)c4ccccc43)n2)s1 ZINC000350238528 565934327 /nfs/dbraw/zinc/93/43/27/565934327.db2.gz LOJGURAFSUMKEI-JTQLQIEISA-N 0 0 377.403 3.016 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCS(=O)(=O)c4ccccc43)n2)s1 ZINC000350238529 565934605 /nfs/dbraw/zinc/93/46/05/565934605.db2.gz LOJGURAFSUMKEI-SNVBAGLBSA-N 0 0 377.403 3.016 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC(CCCO)CC1 ZINC000285961231 565934533 /nfs/dbraw/zinc/93/45/33/565934533.db2.gz DFTKXLXFBYLRSC-UHFFFAOYSA-N 0 0 385.258 3.290 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000286000782 565937119 /nfs/dbraw/zinc/93/71/19/565937119.db2.gz MPNJRXRULKGJNC-CQSZACIVSA-N 0 0 379.214 3.448 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(I)cn1)c1cccc([N+](=O)[O-])c1 ZINC000235453550 565937196 /nfs/dbraw/zinc/93/71/96/565937196.db2.gz GMRWLRJDOHFWFZ-VIFPVBQESA-N 0 0 397.172 3.337 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2cccc(CO)c2)cc1[N+](=O)[O-] ZINC000178839046 565940302 /nfs/dbraw/zinc/94/03/02/565940302.db2.gz LYAVMIFBZMRUFW-UHFFFAOYSA-N 0 0 379.210 3.088 20 5 GGBDRN CC(C)NC(=O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000236643542 565940980 /nfs/dbraw/zinc/94/09/80/565940980.db2.gz KTZJTUSWFIBDJK-UHFFFAOYSA-N 0 0 396.241 3.232 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(-c2nc(-c3cnc4cnccn43)no2)c1 ZINC000350851783 565941735 /nfs/dbraw/zinc/94/17/35/565941735.db2.gz BWALAQGWUPIWPJ-UHFFFAOYSA-N 0 0 387.153 3.117 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1cc2n(n1)CCCC2 ZINC000286106186 565942251 /nfs/dbraw/zinc/94/22/51/565942251.db2.gz AVULFAMJBOTUSK-UHFFFAOYSA-N 0 0 379.214 3.451 20 5 GGBDRN Cc1cccc(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])c1Br ZINC000178868854 565942872 /nfs/dbraw/zinc/94/28/72/565942872.db2.gz DCOOANJCNSVYSU-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=[N+]([O-])c1cc(F)c(NCCS(=O)(=O)c2ccc(Cl)cc2)c(F)c1 ZINC000178870077 565942939 /nfs/dbraw/zinc/94/29/39/565942939.db2.gz LFDTYBKQFNAYDE-UHFFFAOYSA-N 0 0 376.768 3.412 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)Cc1ccc(F)c(Cl)c1 ZINC000178978435 565949467 /nfs/dbraw/zinc/94/94/67/565949467.db2.gz BPFSJXKEMNPQMS-UHFFFAOYSA-N 0 0 388.804 3.016 20 5 GGBDRN O=C(c1conc1C1CC1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000286282999 565951585 /nfs/dbraw/zinc/95/15/85/565951585.db2.gz OZCDQCPLAGEUFT-UHFFFAOYSA-N 0 0 392.209 3.421 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H]1c1cccnc1)c1cc([N+](=O)[O-])ccc1Br ZINC000286293932 565951779 /nfs/dbraw/zinc/95/17/79/565951779.db2.gz HPZZDGNJWAMMRF-LSDHHAIUSA-N 0 0 392.209 3.012 20 5 GGBDRN 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397.316 3.119 20 5 GGBDRN O=C(NCc1ccccc1Br)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180267786 566049534 /nfs/dbraw/zinc/04/95/34/566049534.db2.gz QXPHAICOGUVNKE-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2cncc(Cl)c2Cl)ccc1[N+](=O)[O-] ZINC000180288115 566051313 /nfs/dbraw/zinc/05/13/13/566051313.db2.gz BOWNOVVGZLPTFQ-UHFFFAOYSA-N 0 0 378.193 3.106 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@@H](CO)CC1CCCCC1 ZINC000416334748 566055311 /nfs/dbraw/zinc/05/53/11/566055311.db2.gz SNLHRZMSJDAPFV-CQSZACIVSA-N 0 0 399.285 3.347 20 5 GGBDRN COCCN(Cc1ccco1)C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180344485 566056078 /nfs/dbraw/zinc/05/60/78/566056078.db2.gz ICRKNICIJUPXTO-UHFFFAOYSA-N 0 0 383.198 3.239 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)Nc2c(F)cc(Cl)cc2F)cc([N+](=O)[O-])c1 ZINC000180338908 566056084 /nfs/dbraw/zinc/05/60/84/566056084.db2.gz DJVFMXLNYRVVSS-UHFFFAOYSA-N 0 0 390.751 3.182 20 5 GGBDRN CCc1nn(C)c(Oc2cc(C=O)c(Br)cc2OC)c1[N+](=O)[O-] ZINC000288103069 566056495 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O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N(CC(F)(F)F)C1CC1 ZINC000416391508 566061117 /nfs/dbraw/zinc/06/11/17/566061117.db2.gz PGHSTRRBIIUCOL-UHFFFAOYSA-N 0 0 392.277 3.329 20 5 GGBDRN CSCC[C@@H](C)N(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416403125 566063373 /nfs/dbraw/zinc/06/33/73/566063373.db2.gz RAKQBGWAPBPOGC-SECBINFHSA-N 0 0 386.417 3.376 20 5 GGBDRN CCc1nn(C)c(Oc2cc(Br)c(C=O)cc2OC)c1[N+](=O)[O-] ZINC000288239849 566064139 /nfs/dbraw/zinc/06/41/39/566064139.db2.gz WZYLTXDJMCPWDZ-UHFFFAOYSA-N 0 0 384.186 3.267 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCS[C@H]4COCC[C@@H]43)cs2)c1 ZINC000180452395 566064211 /nfs/dbraw/zinc/06/42/11/566064211.db2.gz HLSUBQDAEMKWJT-HOTGVXAUSA-N 0 0 377.491 3.425 20 5 GGBDRN Cc1cnc([C@@H](C)NS(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000416419860 566066314 /nfs/dbraw/zinc/06/63/14/566066314.db2.gz WMQFRDMZQKDOTN-MRVPVSSYSA-N 0 0 395.384 3.418 20 5 GGBDRN CN1CCO[C@@H]([C@@H](NCc2csc([N+](=O)[O-])c2)c2ccc(Cl)cc2)C1 ZINC000247800419 566067087 /nfs/dbraw/zinc/06/70/87/566067087.db2.gz UUGSXMFEIQCIMO-WBVHZDCISA-N 0 0 381.885 3.471 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000416454445 566069869 /nfs/dbraw/zinc/06/98/69/566069869.db2.gz IBQAVWAKUNTCNU-QMMMGPOBSA-N 0 0 395.384 3.152 20 5 GGBDRN C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000288355372 566069948 /nfs/dbraw/zinc/06/99/48/566069948.db2.gz KKYPVHYRPGHWTL-DGCLKSJQSA-N 0 0 382.258 3.056 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCCN(c2ncccc2F)CC1 ZINC000364841532 566072002 /nfs/dbraw/zinc/07/20/02/566072002.db2.gz SAWWZNDNTNYHRE-UHFFFAOYSA-N 0 0 396.220 3.003 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC(n2ccnc2)CC1 ZINC000180554865 566072574 /nfs/dbraw/zinc/07/25/74/566072574.db2.gz SZXKVNKSCAFVFM-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000416474590 566073095 /nfs/dbraw/zinc/07/30/95/566073095.db2.gz YUEVLHMXQNVTNT-VIFPVBQESA-N 0 0 384.401 3.130 20 5 GGBDRN CN([C@H]1CC[C@@H](C(F)(F)F)CC1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000288449737 566074186 /nfs/dbraw/zinc/07/41/86/566074186.db2.gz RHURTTIKOBIUTM-AOOOYVTPSA-N 0 0 384.351 3.476 20 5 GGBDRN Cc1cnc(C(C)(C)NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)s1 ZINC000288437577 566074249 /nfs/dbraw/zinc/07/42/49/566074249.db2.gz FANFLDSUMGMARX-UHFFFAOYSA-N 0 0 382.829 3.003 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCS[C@@H](c3ccccc3)C2)s1 ZINC000364907176 566074568 /nfs/dbraw/zinc/07/45/68/566074568.db2.gz COJSNJMKDGITDD-CYBMUJFWSA-N 0 0 384.504 3.354 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@@H](CCO)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000288466842 566075128 /nfs/dbraw/zinc/07/51/28/566075128.db2.gz KGRRHQIOONUJMW-AWEZNQCLSA-N 0 0 384.841 3.187 20 5 GGBDRN COC[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000288460303 566075261 /nfs/dbraw/zinc/07/52/61/566075261.db2.gz SLXUIXBRJJCYTF-OAHLLOKOSA-N 0 0 384.841 3.055 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)NC[C@H]1CCCSC1 ZINC000416490724 566075554 /nfs/dbraw/zinc/07/55/54/566075554.db2.gz WXAYDEJSQBUPOY-SECBINFHSA-N 0 0 384.401 3.035 20 5 GGBDRN COC1(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCC1 ZINC000180623641 566077956 /nfs/dbraw/zinc/07/79/56/566077956.db2.gz CKMCKSSLWKOYIL-UHFFFAOYSA-N 0 0 377.622 3.310 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CCO[C@@H](c2cccs2)C1 ZINC000416507219 566079292 /nfs/dbraw/zinc/07/92/92/566079292.db2.gz JLQLUUYTWTVCBG-TZMCWYRMSA-N 0 0 382.463 3.163 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000288537278 566079427 /nfs/dbraw/zinc/07/94/27/566079427.db2.gz YHSDARYVZRZZPM-UHFFFAOYSA-N 0 0 394.225 3.081 20 5 GGBDRN CN(C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCC(F)(F)CC1 ZINC000288544605 566079534 /nfs/dbraw/zinc/07/95/34/566079534.db2.gz YJSJABAGGQWVFG-UHFFFAOYSA-N 0 0 375.759 3.223 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCc3cccc(Cl)c3C2)cc1 ZINC000416532880 566082209 /nfs/dbraw/zinc/08/22/09/566082209.db2.gz SEIQRGCXIVOZOY-UHFFFAOYSA-N 0 0 380.853 3.179 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000416535318 566082277 /nfs/dbraw/zinc/08/22/77/566082277.db2.gz ISUNONBWOYKXFY-QMMMGPOBSA-N 0 0 387.870 3.233 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3cccc(Cl)c3C2)c([N+](=O)[O-])c1 ZINC000416530498 566082364 /nfs/dbraw/zinc/08/23/64/566082364.db2.gz MGCRDOUJZGMQOY-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)c1nc2c(s1)CCC2 ZINC000416538871 566083359 /nfs/dbraw/zinc/08/33/59/566083359.db2.gz RHIKAAWIPWXMLF-SNVBAGLBSA-N 0 0 381.479 3.142 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)c2nc3c(s2)CCC3)cc1C ZINC000416537026 566083453 /nfs/dbraw/zinc/08/34/53/566083453.db2.gz NICIQAJNVGMAKG-NSHDSACASA-N 0 0 381.479 3.196 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)c2nc3c(s2)CCC3)cc1C ZINC000416537025 566083460 /nfs/dbraw/zinc/08/34/60/566083460.db2.gz NICIQAJNVGMAKG-LLVKDONJSA-N 0 0 381.479 3.196 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H](C)c2nc3c(s2)CCC3)c1C ZINC000416538115 566083656 /nfs/dbraw/zinc/08/36/56/566083656.db2.gz QDQGLZKZGLONIM-NSHDSACASA-N 0 0 381.479 3.196 20 5 GGBDRN COc1ccc(CCC(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc1Br ZINC000288642102 566084016 /nfs/dbraw/zinc/08/40/16/566084016.db2.gz ARIFCNLFRVJVDC-UHFFFAOYSA-N 0 0 394.225 3.357 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H](C)c1nc2c(s1)CCC2 ZINC000416544738 566084625 /nfs/dbraw/zinc/08/46/25/566084625.db2.gz ZYHMLERIYGRQKU-NSHDSACASA-N 0 0 381.479 3.196 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CCn1cc(Br)cn1 ZINC000288673376 566085089 /nfs/dbraw/zinc/08/50/89/566085089.db2.gz BDJLSRNSEVLBFW-UHFFFAOYSA-N 0 0 396.245 3.335 20 5 GGBDRN O=C(NCc1noc2c1CCCC2)c1ccc([N+](=O)[O-])cc1Br ZINC000288686099 566086283 /nfs/dbraw/zinc/08/62/83/566086283.db2.gz VXCLBYHMHUEZEI-UHFFFAOYSA-N 0 0 380.198 3.154 20 5 GGBDRN O=C1CCCC[C@@H]1[C@@H]1CCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000248720594 566087376 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GGBDRN COc1cccc([C@@H]2C[C@H]2CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000416618392 566096182 /nfs/dbraw/zinc/09/61/82/566096182.db2.gz FWEGITITFYPVNR-JSGCOSHPSA-N 0 0 382.463 3.055 20 5 GGBDRN COc1ccc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1Cl ZINC000416616857 566096514 /nfs/dbraw/zinc/09/65/14/566096514.db2.gz QHCSAWAHUWFQRG-UHFFFAOYSA-N 0 0 390.870 3.447 20 5 GGBDRN CCc1n[nH]c(C(=O)NCCOCc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000180900831 566097924 /nfs/dbraw/zinc/09/79/24/566097924.db2.gz KCAMDFTVLZQMMD-UHFFFAOYSA-N 0 0 387.223 3.134 20 5 GGBDRN C[C@@H]1[C@H](C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H]1C ZINC000416664978 566101854 /nfs/dbraw/zinc/10/18/54/566101854.db2.gz UBXHDQOIZVPYTD-BBBLOLIVSA-N 0 0 377.260 3.022 20 5 GGBDRN C[C@@H]1[C@@H](C)[C@H](C)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000416664980 566102116 /nfs/dbraw/zinc/10/21/16/566102116.db2.gz UBXHDQOIZVPYTD-KXUCPTDWSA-N 0 0 377.260 3.022 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCSC[C@@H]1C1CCC1 ZINC000416662273 566102473 /nfs/dbraw/zinc/10/24/73/566102473.db2.gz PWTQGOWNFXIERK-CYBMUJFWSA-N 0 0 376.887 3.154 20 5 GGBDRN Cn1ccnc1[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000365466296 566102870 /nfs/dbraw/zinc/10/28/70/566102870.db2.gz YHVHYXQWWLRJNX-NSHDSACASA-N 0 0 393.241 3.111 20 5 GGBDRN COC[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000289084251 566105887 /nfs/dbraw/zinc/10/58/87/566105887.db2.gz OGZVJXZRVAIFFB-OAHLLOKOSA-N 0 0 384.841 3.451 20 5 GGBDRN COc1ccc(Br)cc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365518898 566106001 /nfs/dbraw/zinc/10/60/01/566106001.db2.gz UUCZYNRLYNGVDF-UHFFFAOYSA-N 0 0 395.257 3.400 20 5 GGBDRN O=[N+]([O-])c1ccn(Cc2nc(C3(c4ccccc4Br)CC3)no2)n1 ZINC000289120452 566106486 /nfs/dbraw/zinc/10/64/86/566106486.db2.gz MDJDTUWPXAZWCV-UHFFFAOYSA-N 0 0 390.197 3.065 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCc2cc(Br)ccc21 ZINC000181031114 566107019 /nfs/dbraw/zinc/10/70/19/566107019.db2.gz WLGXVBYHNXBYOM-UHFFFAOYSA-N 0 0 391.177 3.289 20 5 GGBDRN CN(Cc1csc([N+](=O)[O-])c1)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000181071975 566110769 /nfs/dbraw/zinc/11/07/69/566110769.db2.gz RYOWHIBVDABWHV-ZDUSSCGKSA-N 0 0 384.255 3.077 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCOC[C@@H]1c1ccco1 ZINC000365678572 566115128 /nfs/dbraw/zinc/11/51/28/566115128.db2.gz PRJOALHSKXMKMK-SECBINFHSA-N 0 0 387.211 3.226 20 5 GGBDRN COCCc1noc(CN(C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000289333580 566116933 /nfs/dbraw/zinc/11/69/33/566116933.db2.gz IAFXJNHAPXEYIR-UHFFFAOYSA-N 0 0 375.212 3.106 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN1CC(C)(C)N(C)c2cc(Br)ccc21 ZINC000253430562 566118209 /nfs/dbraw/zinc/11/82/09/566118209.db2.gz MRYZLYNKQLIUGN-UHFFFAOYSA-N 0 0 394.273 3.326 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CSc2ncccc2Br)c1 ZINC000181153460 566120348 /nfs/dbraw/zinc/12/03/48/566120348.db2.gz XDSSFNOQDTWGEN-NSHDSACASA-N 0 0 385.239 3.284 20 5 GGBDRN C[C@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CCOC1=O ZINC000289409533 566120769 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GGBDRN CCn1cc(S(=O)(=O)N[C@H](C)c2ccc(Cl)cc2Cl)c([N+](=O)[O-])n1 ZINC000444989062 566263043 /nfs/dbraw/zinc/26/30/43/566263043.db2.gz NNLUOVVDAMDBKF-MRVPVSSYSA-N 0 0 393.252 3.158 20 5 GGBDRN C[C@H](NC(=O)c1sc(Br)cc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000445001790 566263213 /nfs/dbraw/zinc/26/32/13/566263213.db2.gz WXZNDKRFPCBGSJ-QMMMGPOBSA-N 0 0 398.238 3.176 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)C1CC1 ZINC000509120398 566264027 /nfs/dbraw/zinc/26/40/27/566264027.db2.gz DUQCLPVBOHFTOS-VIFPVBQESA-N 0 0 388.205 3.378 20 5 GGBDRN COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000509114954 566264878 /nfs/dbraw/zinc/26/48/78/566264878.db2.gz YCQLKYCPHPTRJK-LBPRGKRZSA-N 0 0 395.213 3.066 20 5 GGBDRN O=C(NCc1cc(Br)cc2c1OCC2)c1csc([N+](=O)[O-])c1 ZINC000462219403 566266061 /nfs/dbraw/zinc/26/60/61/566266061.db2.gz VMDQIJCNCQVYJX-UHFFFAOYSA-N 0 0 383.223 3.284 20 5 GGBDRN C[C@H]1CC(F)(F)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000599470822 566267370 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XQQZAHLMCGMONY-UHFFFAOYSA-N 0 0 392.618 3.207 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1cc2c(s1)CCCC2 ZINC000535041725 566274109 /nfs/dbraw/zinc/27/41/09/566274109.db2.gz XPNIGQDOPBSIKM-UHFFFAOYSA-N 0 0 380.491 3.197 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])[C@@H]2CCCO[C@@H]21 ZINC000599574983 566275137 /nfs/dbraw/zinc/27/51/37/566275137.db2.gz FNBHTTVMPDNDDN-FZZIBODNSA-N 0 0 383.242 3.291 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C12CCC2 ZINC000599572459 566275288 /nfs/dbraw/zinc/27/52/88/566275288.db2.gz BQPHRVQPWCENOZ-QWHCGFSZSA-N 0 0 383.242 3.435 20 5 GGBDRN O=C(N[C@@H](c1cc(F)cc(Br)c1)C1CC1)c1[nH]ncc1[N+](=O)[O-] ZINC000482035471 566277159 /nfs/dbraw/zinc/27/71/59/566277159.db2.gz TYSMOWBSQLXXHK-GFCCVEGCSA-N 0 0 383.177 3.101 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCCC2(CCOCC2)C1 ZINC000599582996 566277428 /nfs/dbraw/zinc/27/74/28/566277428.db2.gz VTWKNIOESLKJSH-UHFFFAOYSA-N 0 0 383.242 3.390 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000482045577 566279144 /nfs/dbraw/zinc/27/91/44/566279144.db2.gz SFJXVSCUJKEAHP-CYBMUJFWSA-N 0 0 397.204 3.111 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000482045578 566279807 /nfs/dbraw/zinc/27/98/07/566279807.db2.gz SFJXVSCUJKEAHP-ZDUSSCGKSA-N 0 0 397.204 3.111 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC(OCC2CC2)CC1 ZINC000599625045 566280826 /nfs/dbraw/zinc/28/08/26/566280826.db2.gz MYYDNTDZFJCMQG-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCO[C@@H](c2ccco2)C1 ZINC000599651303 566282104 /nfs/dbraw/zinc/28/21/04/566282104.db2.gz FZYZNRQRDAYAPH-CYBMUJFWSA-N 0 0 381.182 3.164 20 5 GGBDRN CCc1[nH]nc(-c2nc(Cc3ccc(Br)s3)no2)c1[N+](=O)[O-] ZINC000420482516 566282605 /nfs/dbraw/zinc/28/26/05/566282605.db2.gz QZMJPDAQJNXHLS-UHFFFAOYSA-N 0 0 384.215 3.345 20 5 GGBDRN O=C1C[C@H]2C[C@@H]1[C@@H](c1nc(Cc3ccc([N+](=O)[O-])cc3Br)no1)C2 ZINC000420487437 566282647 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CSc1cccc(C(=O)N2C[C@@H](C(F)(F)F)OC(C)(C)C2)c1[N+](=O)[O-] ZINC000575824140 566288590 /nfs/dbraw/zinc/28/85/90/566288590.db2.gz GPEQBIHINUQLQX-NSHDSACASA-N 0 0 378.372 3.499 20 5 GGBDRN NC(=O)c1cccc([N+](=O)[O-])c1N1CCC[C@@H]1c1ccc(Br)cn1 ZINC000420626101 566288994 /nfs/dbraw/zinc/28/89/94/566288994.db2.gz JLEGZJUCCJOUQR-CYBMUJFWSA-N 0 0 391.225 3.193 20 5 GGBDRN O=c1c(Br)cn(-c2nc(C3CCCCC3)ns2)cc1[N+](=O)[O-] ZINC000420603663 566289006 /nfs/dbraw/zinc/28/90/06/566289006.db2.gz QIRYRKGDWIYMLF-UHFFFAOYSA-N 0 0 385.243 3.407 20 5 GGBDRN O=[N+]([O-])c1c(N2CCOc3ccc(Br)cc3C2)nc2sccn21 ZINC000575817348 566289279 /nfs/dbraw/zinc/28/92/79/566289279.db2.gz SFKLCBUZEWGGNU-UHFFFAOYSA-N 0 0 395.238 3.466 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1c(Br)cccc1[N+](=O)[O-] ZINC000599709657 566289482 /nfs/dbraw/zinc/28/94/82/566289482.db2.gz XBYVMYDPJYZLGJ-CUOATXAZSA-N 0 0 381.226 3.045 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)c2c(Br)cccc2[N+](=O)[O-])ccn1 ZINC000599718496 566289501 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C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599724743 566291551 /nfs/dbraw/zinc/29/15/51/566291551.db2.gz MNMFNDDQFXSXOE-NSHDSACASA-N 0 0 384.274 3.160 20 5 GGBDRN CC(C)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000509335071 566291935 /nfs/dbraw/zinc/29/19/35/566291935.db2.gz PFOYZQNSPWMGMW-ZDUSSCGKSA-N 0 0 388.205 3.460 20 5 GGBDRN O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC([C@@H]2CCOC2)CC1 ZINC000599751883 566292815 /nfs/dbraw/zinc/29/28/15/566292815.db2.gz FBIONWVPJMZRBR-GFCCVEGCSA-N 0 0 383.242 3.246 20 5 GGBDRN COCC[C@H](Cc1ccco1)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599757784 566293005 /nfs/dbraw/zinc/29/30/05/566293005.db2.gz MXJKBJYNKWCFFF-LLVKDONJSA-N 0 0 397.225 3.328 20 5 GGBDRN CN1Cc2ccccc2[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000535277076 566293007 /nfs/dbraw/zinc/29/30/07/566293007.db2.gz NKIOYSVZSVOMTL-HNNXBMFYSA-N 0 0 390.237 3.274 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2ccsc2Br)c([N+](=O)[O-])c1 ZINC000509345000 566293372 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20 5 GGBDRN CC[C@@H](CSC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000537033055 566417355 /nfs/dbraw/zinc/41/73/55/566417355.db2.gz RCZQAFFHFGFNGG-ZDUSSCGKSA-N 0 0 387.527 3.323 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000577268997 566418768 /nfs/dbraw/zinc/41/87/68/566418768.db2.gz GVMMBHQNKZIWAQ-JSGCOSHPSA-N 0 0 381.841 3.258 20 5 GGBDRN Cc1cnc(N[C@@H]2CCN(c3cccc(Br)c3)C2=O)c([N+](=O)[O-])c1 ZINC000447683660 566420942 /nfs/dbraw/zinc/42/09/42/566420942.db2.gz SBJBLGHDUKKCAK-CYBMUJFWSA-N 0 0 391.225 3.278 20 5 GGBDRN Cc1nc(-c2ccc(CNc3nccc(C(N)=O)c3[N+](=O)[O-])s2)cs1 ZINC000577313215 566422955 /nfs/dbraw/zinc/42/29/55/566422955.db2.gz XKEHRDNAYHITNY-UHFFFAOYSA-N 0 0 375.435 3.194 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)nc1 ZINC000577295139 566423045 /nfs/dbraw/zinc/42/30/45/566423045.db2.gz UQUQGMDGIQCJLU-UHFFFAOYSA-N 0 0 375.328 3.142 20 5 GGBDRN Cc1nc(N[C@@H]2CCN(c3cccc(Br)c3)C2=O)ccc1[N+](=O)[O-] ZINC000447687989 566422947 /nfs/dbraw/zinc/42/29/47/566422947.db2.gz KQICYSAMKRIRIV-CYBMUJFWSA-N 0 0 391.225 3.278 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])nn1C)[C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000484322734 566425522 /nfs/dbraw/zinc/42/55/22/566425522.db2.gz QEGHYDZHJNYHDR-GFCCVEGCSA-N 0 0 376.722 3.357 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CSc2ccc(Br)cc21 ZINC000577334704 566425908 /nfs/dbraw/zinc/42/59/08/566425908.db2.gz GXFMEPHZRKZAPA-NSHDSACASA-N 0 0 382.239 3.273 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc2n[nH]cc2c1 ZINC000511005296 566427574 /nfs/dbraw/zinc/42/75/74/566427574.db2.gz VTJYGFUMOKSIGN-SECBINFHSA-N 0 0 380.813 3.164 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000601852365 566428268 /nfs/dbraw/zinc/42/82/68/566428268.db2.gz XJZUDMWUCVBYGG-UHFFFAOYSA-N 0 0 376.722 3.088 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21 ZINC000601885531 566429465 /nfs/dbraw/zinc/42/94/65/566429465.db2.gz FYQXFKLVAVQMJL-KFWWJZLASA-N 0 0 383.242 3.123 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000601885535 566429532 /nfs/dbraw/zinc/42/95/32/566429532.db2.gz FYQXFKLVAVQMJL-ZNMIVQPWSA-N 0 0 383.242 3.123 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)CC(F)(F)F)c([N+](=O)[O-])c1 ZINC000463749008 566429768 /nfs/dbraw/zinc/42/97/68/566429768.db2.gz HHFKROXBXZTGRC-SNVBAGLBSA-N 0 0 383.392 3.378 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](O)[C@H]2CCCC[C@@H]21 ZINC000601890897 566430652 /nfs/dbraw/zinc/43/06/52/566430652.db2.gz VGIFEXFFKWQULZ-BPUTZDHNSA-N 0 0 397.269 3.052 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2Cl)c2ncccc12 ZINC000463743191 566430709 /nfs/dbraw/zinc/43/07/09/566430709.db2.gz ASGPUNGIKYCZBO-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](Oc3ccccc3)C2)c(Cl)c1 ZINC000577390282 566430858 /nfs/dbraw/zinc/43/08/58/566430858.db2.gz NCBPKBRCOUMWPH-AWEZNQCLSA-N 0 0 382.825 3.090 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCSc1nnc(-c2ccc(Cl)cc2)n1C ZINC000601915626 566431015 /nfs/dbraw/zinc/43/10/15/566431015.db2.gz BHKYUUPFNYXTLE-UHFFFAOYSA-N 0 0 378.845 3.341 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000601890606 566431143 /nfs/dbraw/zinc/43/11/43/566431143.db2.gz TVQUTKQTLDYFNH-CFVMTHIKSA-N 0 0 383.242 3.123 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCSCc1ccc(Cl)cc1-n1cncn1 ZINC000601918283 566431190 /nfs/dbraw/zinc/43/11/90/566431190.db2.gz SRZJKYAGJGUJGB-UHFFFAOYSA-N 0 0 378.845 3.267 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2c(Cl)ccc(F)c2F)cc1[N+](=O)[O-] ZINC000577403512 566431704 /nfs/dbraw/zinc/43/17/04/566431704.db2.gz OUWPJJASHLIXRK-UHFFFAOYSA-N 0 0 392.767 3.014 20 5 GGBDRN Cc1nc(NCc2nc(-c3cccc(Br)c3)no2)ccc1[N+](=O)[O-] ZINC000447814819 566433371 /nfs/dbraw/zinc/43/33/71/566433371.db2.gz BSSWVYAAHFUOAR-UHFFFAOYSA-N 0 0 390.197 3.145 20 5 GGBDRN COc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1Br ZINC000463833793 566436600 /nfs/dbraw/zinc/43/66/00/566436600.db2.gz CCEHDQWMIHMGSV-UHFFFAOYSA-N 0 0 394.225 3.441 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](CO)c2ccccc2Cl)c1 ZINC000557966857 566438569 /nfs/dbraw/zinc/43/85/69/566438569.db2.gz IJKDFLUZIXBLDW-LLVKDONJSA-N 0 0 380.853 3.476 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])[C@H](C(N)=O)c1ccc(Br)cc1 ZINC000511120092 566438566 /nfs/dbraw/zinc/43/85/66/566438566.db2.gz HEZKADLAECJKLG-INIZCTEOSA-N 0 0 392.253 3.058 20 5 GGBDRN CN(Cc1c(Cl)cccc1Cl)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000484594411 566439026 /nfs/dbraw/zinc/43/90/26/566439026.db2.gz WQAUTGPKWYOSGU-UHFFFAOYSA-N 0 0 382.203 3.499 20 5 GGBDRN CCn1cc(Br)cc1C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000511127226 566439662 /nfs/dbraw/zinc/43/96/62/566439662.db2.gz SZKZPGIYHQQUTA-UHFFFAOYSA-N 0 0 381.230 3.021 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000558005040 566439701 /nfs/dbraw/zinc/43/97/01/566439701.db2.gz DGCDRNZFTWLZRD-JTQLQIEISA-N 0 0 389.239 3.278 20 5 GGBDRN C[C@H]1C[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000511140836 566441935 /nfs/dbraw/zinc/44/19/35/566441935.db2.gz ZBCOYGFUGKCOLR-UWVGGRQHSA-N 0 0 388.205 3.318 20 5 GGBDRN CC1(C)C(=O)N[C@H]1C1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000577526634 566442099 /nfs/dbraw/zinc/44/20/99/566442099.db2.gz GQLVROOBCCFWEE-HNNXBMFYSA-N 0 0 396.285 3.094 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000511140833 566442404 /nfs/dbraw/zinc/44/24/04/566442404.db2.gz ZBCOYGFUGKCOLR-AOOOYVTPSA-N 0 0 388.205 3.318 20 5 GGBDRN Cn1c(-c2nc(-c3cn4ccc(Br)cc4n3)no2)ccc1[N+](=O)[O-] ZINC000577548104 566443233 /nfs/dbraw/zinc/44/32/33/566443233.db2.gz RMALOEUALPERNS-UHFFFAOYSA-N 0 0 389.169 3.061 20 5 GGBDRN CCCc1nc(C)c(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)o1 ZINC000558044213 566444479 /nfs/dbraw/zinc/44/44/79/566444479.db2.gz RPODJOYRUJJHBY-UHFFFAOYSA-N 0 0 396.241 3.465 20 5 GGBDRN Cc1cc(NCc2c([N+](=O)[O-])ncn2C)nn1-c1ccc(Cl)c(Cl)c1 ZINC000537433176 566444935 /nfs/dbraw/zinc/44/49/35/566444935.db2.gz QIIDLPGVXUXLMZ-UHFFFAOYSA-N 0 0 381.223 3.163 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000511277838 566450791 /nfs/dbraw/zinc/45/07/91/566450791.db2.gz UEMMMYOCMUWDAF-AWEZNQCLSA-N 0 0 382.825 3.393 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCC[C@@H](CSC)C2)cc1[N+](=O)[O-] ZINC000558135138 566451774 /nfs/dbraw/zinc/45/17/74/566451774.db2.gz JTDINPLQMNVQIS-CQSZACIVSA-N 0 0 384.523 3.438 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCC(=O)c2ccccc2Cl)cc1C ZINC000464196412 566452944 /nfs/dbraw/zinc/45/29/44/566452944.db2.gz STJPHLKEPNTSQF-UHFFFAOYSA-N 0 0 382.825 3.026 20 5 GGBDRN Cn1c(C(=O)N[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000537592394 566453251 /nfs/dbraw/zinc/45/32/51/566453251.db2.gz ZJSNPPNJTFLBMB-JTQLQIEISA-N 0 0 383.235 3.249 20 5 GGBDRN CSc1ccc(S(=O)(=O)NCCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000464196030 566453320 /nfs/dbraw/zinc/45/33/20/566453320.db2.gz YQRRDYUJNJNXBK-UHFFFAOYSA-N 0 0 386.882 3.491 20 5 GGBDRN CC(C)(C(=O)NCc1ccncc1Br)c1ccccc1[N+](=O)[O-] ZINC000602196899 566453901 /nfs/dbraw/zinc/45/39/01/566453901.db2.gz IBCAAQODPIQLLD-UHFFFAOYSA-N 0 0 378.226 3.346 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCC(=O)c2ccccc2Cl)c1C ZINC000464201665 566455167 /nfs/dbraw/zinc/45/51/67/566455167.db2.gz ULBJAEHTJZUDGQ-UHFFFAOYSA-N 0 0 382.825 3.026 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2cccs2)c(NCCN2CCCS2(=O)=O)c1 ZINC000448057495 566455680 /nfs/dbraw/zinc/45/56/80/566455680.db2.gz COOULQHJLHHBJV-UHFFFAOYSA-N 0 0 399.519 3.255 20 5 GGBDRN COc1ccc2nc(NC(=O)CSc3ccc([N+](=O)[O-])cn3)sc2c1 ZINC000448102768 566456801 /nfs/dbraw/zinc/45/68/01/566456801.db2.gz MGCCMULSEFRRLY-UHFFFAOYSA-N 0 0 376.419 3.339 20 5 GGBDRN Cc1ccc(Br)cc1OC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000448107174 566457200 /nfs/dbraw/zinc/45/72/00/566457200.db2.gz FDPJAURVOTXGQS-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@H]2CCCC[C@H]2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000484831034 566458697 /nfs/dbraw/zinc/45/86/97/566458697.db2.gz SIEKASPTLJPTLS-MWLCHTKSSA-N 0 0 381.376 3.023 20 5 GGBDRN C[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])Oc1ccccc1Br ZINC000484834435 566458971 /nfs/dbraw/zinc/45/89/71/566458971.db2.gz LUKBMKVHHVPBKC-JTQLQIEISA-N 0 0 394.225 3.336 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC1(C)C ZINC000511381992 566459687 /nfs/dbraw/zinc/45/96/87/566459687.db2.gz KDCBOFLVBUQJES-LBPRGKRZSA-N 0 0 388.205 3.378 20 5 GGBDRN Cc1sc(C(=O)N=c2cc3ccc(Br)cn3[nH]2)cc1[N+](=O)[O-] ZINC000511384113 566459740 /nfs/dbraw/zinc/45/97/40/566459740.db2.gz PZRIHUJBMFTPKS-UHFFFAOYSA-N 0 0 381.211 3.049 20 5 GGBDRN NS(=O)(=O)c1cc(NC[C@@H]2CCCC[C@@H]2C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000484835374 566460100 /nfs/dbraw/zinc/46/01/00/566460100.db2.gz ZLEIKDAIJNDTQY-ZANVPECISA-N 0 0 381.376 3.023 20 5 GGBDRN O=C(N=c1cc2ccc(Br)cn2[nH]1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000511390136 566460854 /nfs/dbraw/zinc/46/08/54/566460854.db2.gz HGIHXIMNYKZXQG-UHFFFAOYSA-N 0 0 395.600 3.333 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CCNc2ccccc2[N+](=O)[O-])s1 ZINC000511396403 566461204 /nfs/dbraw/zinc/46/12/04/566461204.db2.gz UHJVUIWBFNZULY-UHFFFAOYSA-N 0 0 383.495 3.341 20 5 GGBDRN COc1c(-c2nc(-c3cncc(Br)c3)no2)cccc1[N+](=O)[O-] ZINC000558291309 566462750 /nfs/dbraw/zinc/46/27/50/566462750.db2.gz MZMMAOPVPBUINB-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN O=C(NC[C@H]1COc2ccccc21)c1sc(Br)cc1[N+](=O)[O-] ZINC000577776278 566463310 /nfs/dbraw/zinc/46/33/10/566463310.db2.gz ORUNJLNOIWFZRX-QMMMGPOBSA-N 0 0 383.223 3.325 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCSCC(F)(F)F ZINC000537699896 566463971 /nfs/dbraw/zinc/46/39/71/566463971.db2.gz IIMJHEGMZODQMK-UHFFFAOYSA-N 0 0 386.779 3.429 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCC2(c3ccccn3)CCC2)c(Cl)c1 ZINC000511428233 566464413 /nfs/dbraw/zinc/46/44/13/566464413.db2.gz XANTXFVZZIETOC-UHFFFAOYSA-N 0 0 381.841 3.043 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1nnc(CC(F)(F)F)s1 ZINC000484940151 566465260 /nfs/dbraw/zinc/46/52/60/566465260.db2.gz VXXFPGAGQOQEMQ-UHFFFAOYSA-N 0 0 380.735 3.386 20 5 GGBDRN C[C@@]1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)OCCc2sccc21 ZINC000484959239 566466324 /nfs/dbraw/zinc/46/63/24/566466324.db2.gz FEXNWLLIVXSLHZ-KRWDZBQOSA-N 0 0 380.853 3.457 20 5 GGBDRN C[C@]1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)OCCc2sccc21 ZINC000484959240 566466871 /nfs/dbraw/zinc/46/68/71/566466871.db2.gz FEXNWLLIVXSLHZ-QGZVFWFLSA-N 0 0 380.853 3.457 20 5 GGBDRN CCc1[nH][nH]c(=NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c1Br ZINC000448316594 566467611 /nfs/dbraw/zinc/46/76/11/566467611.db2.gz XLETXQFIRLHRTD-UHFFFAOYSA-N 0 0 385.243 3.039 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2cc(Cl)sc2Cl)c([N+](=O)[O-])c1 ZINC000537749866 566467916 /nfs/dbraw/zinc/46/79/16/566467916.db2.gz QQFCMSDICVIUEN-UHFFFAOYSA-N 0 0 397.261 3.450 20 5 GGBDRN CCc1ccc([C@H](CO)NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000537776257 566469427 /nfs/dbraw/zinc/46/94/27/566469427.db2.gz CWYBHCVSKCHGBX-INIZCTEOSA-N 0 0 393.237 3.383 20 5 GGBDRN O=C(NCc1ccccc1)c1ccc([N+](=O)[O-])cc1I ZINC000511530926 566469870 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Cc1ccc(OC(F)F)c(Cn2cc(Br)cc([N+](=O)[O-])c2=O)c1 ZINC000488244939 566717213 /nfs/dbraw/zinc/71/72/13/566717213.db2.gz ASWNJCYLTIMWDK-UHFFFAOYSA-N 0 0 389.152 3.477 20 5 GGBDRN C[C@@H](CCCC(F)(F)F)NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000426560197 566717742 /nfs/dbraw/zinc/71/77/42/566717742.db2.gz OXBUCHFUXRTGJF-QMMMGPOBSA-N 0 0 381.738 3.424 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(CCO)Cc2cccc(Br)c2)c(F)c1 ZINC000488259231 566717789 /nfs/dbraw/zinc/71/77/89/566717789.db2.gz ZBAJAHJEGJHPCX-UHFFFAOYSA-N 0 0 383.217 3.491 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCc3sc(Cl)cc32)cc1[N+](=O)[O-] ZINC000515562963 566720921 /nfs/dbraw/zinc/72/09/21/566720921.db2.gz TXNBFLKPVFVBSH-LLVKDONJSA-N 0 0 379.825 3.360 20 5 GGBDRN CC(C)OCCOC1CCN(c2ncc([N+](=O)[O-])cc2Br)CC1 ZINC000450910885 566720962 /nfs/dbraw/zinc/72/09/62/566720962.db2.gz VRAUHFPAGXNDPZ-UHFFFAOYSA-N 0 0 388.262 3.163 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCO[C@H](c3nccn3C)C2)ncc1[N+](=O)[O-] ZINC000450953108 566723344 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Nc1c(C(=O)NCC2(c3ccccc3Br)CC2)cccc1[N+](=O)[O-] ZINC000468745633 566725467 /nfs/dbraw/zinc/72/54/67/566725467.db2.gz CIUYBCVXVRZENE-UHFFFAOYSA-N 0 0 390.237 3.401 20 5 GGBDRN O=C(N[C@H]1CCC[C@H](F)C1)c1ccc([N+](=O)[O-])cc1I ZINC000515652178 566725708 /nfs/dbraw/zinc/72/57/08/566725708.db2.gz JPLIFXXPDXYHBZ-IUCAKERBSA-N 0 0 392.168 3.210 20 5 GGBDRN COc1ccc(Br)c(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c1 ZINC000488443827 566726657 /nfs/dbraw/zinc/72/66/57/566726657.db2.gz VRVCVWQCUIXPAG-UHFFFAOYSA-N 0 0 395.165 3.347 20 5 GGBDRN C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)Oc1cccc(Br)c1 ZINC000468748902 566727433 /nfs/dbraw/zinc/72/74/33/566727433.db2.gz XRDCXXCUYGLCHB-JTQLQIEISA-N 0 0 394.225 3.137 20 5 GGBDRN CC(C)(C)c1cc(CS(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)no1 ZINC000515680459 566727483 /nfs/dbraw/zinc/72/74/83/566727483.db2.gz LCYCSCHOPJZMMO-UHFFFAOYSA-N 0 0 387.845 3.153 20 5 GGBDRN NC(=O)[C@H]1CCO[C@@H]1C1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000488480971 566728280 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3.204 20 5 GGBDRN Cc1cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])ccc1Br ZINC000426808914 566731434 /nfs/dbraw/zinc/73/14/34/566731434.db2.gz BDXXMZWKMLWESL-HNNXBMFYSA-N 0 0 393.237 3.451 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(Br)s1 ZINC000426788437 566731575 /nfs/dbraw/zinc/73/15/75/566731575.db2.gz NGSYVUKTIRWIRT-LBPRGKRZSA-N 0 0 385.239 3.204 20 5 GGBDRN C[C@H]1CCCC[C@H]1OCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000515758846 566732740 /nfs/dbraw/zinc/73/27/40/566732740.db2.gz RKPHBCMMTIWMTG-SMDDNHRTSA-N 0 0 376.862 3.122 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)Cc2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000468816559 566732920 /nfs/dbraw/zinc/73/29/20/566732920.db2.gz FFMDZYLTEMWALF-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN Cc1cc(Br)ccc1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C(=O)[O-] ZINC000426818007 566733527 /nfs/dbraw/zinc/73/35/27/566733527.db2.gz QVBUMOWVZHXMIQ-HNNXBMFYSA-N 0 0 393.237 3.451 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(Br)s1 ZINC000426817692 566733576 /nfs/dbraw/zinc/73/35/76/566733576.db2.gz TZQMWQFAJRDZSC-NSHDSACASA-N 0 0 385.239 3.204 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCCC[C@@H]2N2CCOCC2)ncc1[N+](=O)[O-] ZINC000541578925 566734613 /nfs/dbraw/zinc/73/46/13/566734613.db2.gz OUNVPMWGNVLUAR-OLZOCXBDSA-N 0 0 399.289 3.116 20 5 GGBDRN Cc1c(Br)c(N2CCCN(CC(F)(F)F)CC2)ncc1[N+](=O)[O-] ZINC000541579105 566734759 /nfs/dbraw/zinc/73/47/59/566734759.db2.gz WARADQMHFUFJAP-UHFFFAOYSA-N 0 0 397.195 3.135 20 5 GGBDRN Cc1c(Br)c(NCc2ccccc2-n2ccnc2)ncc1[N+](=O)[O-] ZINC000541577111 566734900 /nfs/dbraw/zinc/73/49/00/566734900.db2.gz HISOXNOTAPSJJY-UHFFFAOYSA-N 0 0 388.225 3.280 20 5 GGBDRN Cc1c(Br)c(SCCCNc2ncccn2)ncc1[N+](=O)[O-] ZINC000541577230 566735077 /nfs/dbraw/zinc/73/50/77/566735077.db2.gz OAYQGBXHTCQOPY-UHFFFAOYSA-N 0 0 384.259 3.445 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CSc2ccc(Br)cc21 ZINC000488556353 566735242 /nfs/dbraw/zinc/73/52/42/566735242.db2.gz CNXGXVFERWYZCC-LLVKDONJSA-N 0 0 395.238 3.143 20 5 GGBDRN Cc1c(Br)c(N(C)Cc2ccc3c(c2)OCCO3)ncc1[N+](=O)[O-] ZINC000541578565 566735295 /nfs/dbraw/zinc/73/52/95/566735295.db2.gz TWRCLEWFXPAJRI-UHFFFAOYSA-N 0 0 394.225 3.468 20 5 GGBDRN Cc1c(Br)c(Oc2ccc(O[C@H](C)C(N)=O)cc2)ncc1[N+](=O)[O-] ZINC000541576468 566735371 /nfs/dbraw/zinc/73/53/71/566735371.db2.gz KFGMTSGCBNOUHI-SECBINFHSA-N 0 0 396.197 3.106 20 5 GGBDRN O=[N+]([O-])c1sccc1NCc1cccc(S(=O)(=O)N2CCCCC2)c1 ZINC000608779047 566735501 /nfs/dbraw/zinc/73/55/01/566735501.db2.gz GXBLUEQQEUTHHO-UHFFFAOYSA-N 0 0 381.479 3.443 20 5 GGBDRN O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000608801396 566736231 /nfs/dbraw/zinc/73/62/31/566736231.db2.gz IPMPMOMCSBZGKG-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C)Cc2nncn2C(C)C)cc1[N+](=O)[O-] ZINC000580959154 566737792 /nfs/dbraw/zinc/73/77/92/566737792.db2.gz PDFJUOATWWJAQV-UHFFFAOYSA-N 0 0 396.245 3.110 20 5 GGBDRN CCOc1ccc([C@@H](C)NCc2ccc(S(C)(=O)=O)s2)cc1[N+](=O)[O-] ZINC000468862431 566738589 /nfs/dbraw/zinc/73/85/89/566738589.db2.gz DRZFTGSPJUQDEN-LLVKDONJSA-N 0 0 384.479 3.309 20 5 GGBDRN Cn1c(=O)c(CNc2ncc([N+](=O)[O-])cc2Br)cc2ccccc21 ZINC000488674613 566739109 /nfs/dbraw/zinc/73/91/09/566739109.db2.gz JNGUFBMQYMMJPE-UHFFFAOYSA-N 0 0 389.209 3.216 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](CO)c2ccc(Br)c(F)c2)ccc1[N+](=O)[O-] ZINC000561774286 566739176 /nfs/dbraw/zinc/73/91/76/566739176.db2.gz NXCRZZMIGDXBRQ-AWEZNQCLSA-N 0 0 397.200 3.268 20 5 GGBDRN CN(Cc1nnc2n1CCCCC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000608855789 566739300 /nfs/dbraw/zinc/73/93/00/566739300.db2.gz WYZCQYYTIVXWRF-UHFFFAOYSA-N 0 0 380.246 3.312 20 5 GGBDRN CC1(C)CN(c2ncc(Br)cc2[N+](=O)[O-])C[C@@H](C(F)(F)F)O1 ZINC000488675394 566739976 /nfs/dbraw/zinc/73/99/76/566739976.db2.gz NMLABTPWNYFSOT-VIFPVBQESA-N 0 0 384.152 3.298 20 5 GGBDRN Cc1c(Br)c(Sc2nnc(C(F)F)n2C)ncc1[N+](=O)[O-] ZINC000541625207 566739984 /nfs/dbraw/zinc/73/99/84/566739984.db2.gz KQIBJQCTSRNNTF-UHFFFAOYSA-N 0 0 380.174 3.278 20 5 GGBDRN CN(C(=O)Cc1c[nH]c2cc(Br)ccc12)c1ccc([N+](=O)[O-])nc1 ZINC000561791915 566740203 /nfs/dbraw/zinc/74/02/03/566740203.db2.gz GGFNLDBYAUCTIY-UHFFFAOYSA-N 0 0 389.209 3.439 20 5 GGBDRN CCSc1cccc(CNc2ccc(S(=O)(=O)NC)cc2[N+](=O)[O-])c1 ZINC000488680930 566741457 /nfs/dbraw/zinc/74/14/57/566741457.db2.gz YOSFPZFMCAPCSP-UHFFFAOYSA-N 0 0 381.479 3.227 20 5 GGBDRN COc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c(Br)c1 ZINC000608901225 566741949 /nfs/dbraw/zinc/74/19/49/566741949.db2.gz VTCBZSYOTBCJCN-UHFFFAOYSA-N 0 0 395.165 3.347 20 5 GGBDRN O=C(c1ccc(Cl)cc1F)N1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000608909591 566742002 /nfs/dbraw/zinc/74/20/02/566742002.db2.gz HNOIBZWBEXNAFU-UHFFFAOYSA-N 0 0 383.832 3.407 20 5 GGBDRN Cc1cc(C(=O)N2CCOc3ncc(Br)cc32)cc([N+](=O)[O-])c1 ZINC000541703970 566743204 /nfs/dbraw/zinc/74/32/04/566743204.db2.gz RLKWNACCAWHBSO-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN CCCN(CC(F)F)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488732121 566744100 /nfs/dbraw/zinc/74/41/00/566744100.db2.gz ZOJCTUNNWKFZNS-UHFFFAOYSA-N 0 0 387.202 3.023 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(F)(F)F)[C@H]1CCOC1 ZINC000468934910 566745749 /nfs/dbraw/zinc/74/57/49/566745749.db2.gz IMWSKYQEZLVSQE-PWSUYJOCSA-N 0 0 378.372 3.255 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(Br)c(F)c2)cc1[N+](=O)[O-] ZINC000609012400 566746031 /nfs/dbraw/zinc/74/60/31/566746031.db2.gz XZOABMXIVRHXAW-UHFFFAOYSA-N 0 0 397.200 3.364 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCc3c2cccc3Br)cc(F)cc1[N+](=O)[O-] ZINC000609025787 566746099 /nfs/dbraw/zinc/74/60/99/566746099.db2.gz SJDAECZPWJVKPY-ZDUSSCGKSA-N 0 0 394.200 3.496 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000561884935 566746673 /nfs/dbraw/zinc/74/66/73/566746673.db2.gz GJUKGBUJASIPHN-CYBMUJFWSA-N 0 0 378.841 3.232 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CC[C@H](Sc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000561883506 566746710 /nfs/dbraw/zinc/74/67/10/566746710.db2.gz GLUUMBIAWWVIFD-ZDUSSCGKSA-N 0 0 380.857 3.297 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)Nc1c(F)cccc1F ZINC000609027070 566746870 /nfs/dbraw/zinc/74/68/70/566746870.db2.gz HRJIRYDQUOVLQX-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N(C1CC1)C1CCCC1 ZINC000609030198 566747683 /nfs/dbraw/zinc/74/76/83/566747683.db2.gz MBIPQWVVTWBHBH-UHFFFAOYSA-N 0 0 389.271 3.453 20 5 GGBDRN CNS(=O)(=O)c1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 ZINC000609042026 566747819 /nfs/dbraw/zinc/74/78/19/566747819.db2.gz RBTKQPMVMNRILD-UHFFFAOYSA-N 0 0 375.431 3.293 20 5 GGBDRN COc1ccc(Cl)c2c1N(S(=O)(=O)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000609069838 566748885 /nfs/dbraw/zinc/74/88/85/566748885.db2.gz WJUFUYGJMLBGQF-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN Cc1cccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1Br ZINC000468981744 566750019 /nfs/dbraw/zinc/75/00/19/566750019.db2.gz NHOQSRMPOAAGIM-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCc2nc(C(F)(F)F)cs2)c1 ZINC000541817772 566750668 /nfs/dbraw/zinc/75/06/68/566750668.db2.gz XGDAYTAKZFPMFB-UHFFFAOYSA-N 0 0 395.384 3.165 20 5 GGBDRN C[C@@H](N(C)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])C(C)(C)C ZINC000609134057 566750949 /nfs/dbraw/zinc/75/09/49/566750949.db2.gz QWSBKHDNGWMSHJ-SECBINFHSA-N 0 0 379.276 3.412 20 5 GGBDRN CC1(C)Cc2ccc(Br)cc2[C@@H]1NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000561943805 566751031 /nfs/dbraw/zinc/75/10/31/566751031.db2.gz BRKCUUSDFKSTPT-ZDUSSCGKSA-N 0 0 379.214 3.134 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@@H](C)CC(=O)c2cccs2)c1 ZINC000541816715 566751397 /nfs/dbraw/zinc/75/13/97/566751397.db2.gz LHFARPAONNKUOY-NSHDSACASA-N 0 0 382.463 3.213 20 5 GGBDRN C[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488850006 566752391 /nfs/dbraw/zinc/75/23/91/566752391.db2.gz FDVYLGHPXRMIMF-KOLCDFICSA-N 0 0 377.260 3.214 20 5 GGBDRN Cc1n[nH]c(C(=O)N(Cc2cccc(Br)c2)C(C)C)c1[N+](=O)[O-] ZINC000609166700 566753031 /nfs/dbraw/zinc/75/30/31/566753031.db2.gz GVNKQLVPMWTDDR-UHFFFAOYSA-N 0 0 381.230 3.440 20 5 GGBDRN CCc1nc(C)c(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)o1 ZINC000561977006 566754259 /nfs/dbraw/zinc/75/42/59/566754259.db2.gz DLIBMGXVLUMXEV-UHFFFAOYSA-N 0 0 382.214 3.075 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CC[C@@H]1c1ccccc1 ZINC000488893924 566755657 /nfs/dbraw/zinc/75/56/57/566755657.db2.gz UQIJJJYVVRIULR-CYBMUJFWSA-N 0 0 397.250 3.493 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1ccc(Br)cc1 ZINC000609289433 566755909 /nfs/dbraw/zinc/75/59/09/566755909.db2.gz PATGXGYUSRDMEM-UHFFFAOYSA-N 0 0 393.241 3.269 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(NCCS(=O)(=O)NCC2CCC2)c(Cl)c1 ZINC000541850665 566756179 /nfs/dbraw/zinc/75/61/79/566756179.db2.gz KYLLEJCKEIJIFQ-UHFFFAOYSA-N 0 0 382.269 3.033 20 5 GGBDRN Cc1ccsc1CNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000488918210 566756819 /nfs/dbraw/zinc/75/68/19/566756819.db2.gz SWQILQUQUIJQQV-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000488912902 566757164 /nfs/dbraw/zinc/75/71/64/566757164.db2.gz BOYOQOFKSLJLIA-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1cccc(CN(C)S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000488908734 566757354 /nfs/dbraw/zinc/75/73/54/566757354.db2.gz CXBPQXMHKYXTJQ-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN COc1ccc(CNC(=O)c2[nH]nc(C(C)C)c2Br)cc1[N+](=O)[O-] ZINC000609316470 566757409 /nfs/dbraw/zinc/75/74/09/566757409.db2.gz FQHKLJTZQYZTFR-UHFFFAOYSA-N 0 0 397.229 3.142 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])N(C)c1ccccc1 ZINC000516341928 566758651 /nfs/dbraw/zinc/75/86/51/566758651.db2.gz GZTKOCFXWCXHMB-GFCCVEGCSA-N 0 0 383.857 3.051 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000609317033 566758926 /nfs/dbraw/zinc/75/89/26/566758926.db2.gz CQYJCFGTHBTABW-UHFFFAOYSA-N 0 0 379.210 3.225 20 5 GGBDRN CCc1n[nH]c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1Br ZINC000469090149 566760426 /nfs/dbraw/zinc/76/04/26/566760426.db2.gz SWOIXKSNBWGCGM-UHFFFAOYSA-N 0 0 393.241 3.448 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CN2CCC[C@@H]2c2cc[nH]n2)c1 ZINC000562060655 566761040 /nfs/dbraw/zinc/76/10/40/566761040.db2.gz WTWSJYNNQUOMLT-CQSZACIVSA-N 0 0 398.204 3.260 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CC[C@H]2c2ccccc2)c1 ZINC000609418613 566763554 /nfs/dbraw/zinc/76/35/54/566763554.db2.gz GQROTSNTKZLRKO-HNNXBMFYSA-N 0 0 397.250 3.493 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)s1 ZINC000609418698 566763895 /nfs/dbraw/zinc/76/38/95/566763895.db2.gz OASZZOQUQZCZKH-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN C[C@H](Cc1ccc(Br)cc1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000516493925 566763906 /nfs/dbraw/zinc/76/39/06/566763906.db2.gz KKNMIEGTJGVNPA-SECBINFHSA-N 0 0 396.216 3.440 20 5 GGBDRN Cn1nccc1CSCc1cc(I)cc([N+](=O)[O-])c1 ZINC000581282328 566764378 /nfs/dbraw/zinc/76/43/78/566764378.db2.gz AOGQUDGCVPTGID-UHFFFAOYSA-N 0 0 389.218 3.366 20 5 GGBDRN CCCc1n[nH]c(C(=O)N(C)Cc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000609473658 566765038 /nfs/dbraw/zinc/76/50/38/566765038.db2.gz UWFVTMVOPKFUOX-UHFFFAOYSA-N 0 0 381.230 3.305 20 5 GGBDRN Cn1nccc1N1CCC[C@@H](Nc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000581289495 566765221 /nfs/dbraw/zinc/76/52/21/566765221.db2.gz MOHVWXCBBYLYAO-GFCCVEGCSA-N 0 0 380.246 3.172 20 5 GGBDRN O=C(Nc1nc(CC(F)(F)F)cs1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000581332303 566768310 /nfs/dbraw/zinc/76/83/10/566768310.db2.gz FOYHGWNZZDRIFS-UHFFFAOYSA-N 0 0 375.284 3.137 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccc2Br)C1)c1ccc([N+](=O)[O-])s1 ZINC000609509156 566768699 /nfs/dbraw/zinc/76/86/99/566768699.db2.gz JDSHCRIYHDGOOD-SNVBAGLBSA-N 0 0 396.266 3.428 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N(CC(F)(F)F)[C@@H]1CCOC1 ZINC000469188338 566769266 /nfs/dbraw/zinc/76/92/66/566769266.db2.gz UZHVEIHCKJZXJD-SECBINFHSA-N 0 0 397.147 3.151 20 5 GGBDRN Cc1cc(Br)ccc1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000609542508 566770141 /nfs/dbraw/zinc/77/01/41/566770141.db2.gz KFTBQRQKNGUNTO-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCc3ccc(Br)cc32)c1 ZINC000609571396 566771129 /nfs/dbraw/zinc/77/11/29/566771129.db2.gz NZOADENCZUMWFR-HNNXBMFYSA-N 0 0 393.237 3.160 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1SCCO)N1Cc2cccc(Cl)c2C1 ZINC000489114273 566771319 /nfs/dbraw/zinc/77/13/19/566771319.db2.gz GTJVIOPFEZUFFB-UHFFFAOYSA-N 0 0 378.837 3.489 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H](C)c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000469209437 566771720 /nfs/dbraw/zinc/77/17/20/566771720.db2.gz QHJWPGAUIDNJDY-VIFPVBQESA-N 0 0 388.804 3.435 20 5 GGBDRN NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCc1cccc(Cl)c1Cl ZINC000542043233 566772498 /nfs/dbraw/zinc/77/24/98/566772498.db2.gz OAZBYSDXRLIUEM-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN CSc1ccc(-c2noc(Cn3ccc(=O)c([N+](=O)[O-])c3)n2)c(Cl)c1 ZINC000562235637 566773799 /nfs/dbraw/zinc/77/37/99/566773799.db2.gz QADFBDMZSQHHJD-UHFFFAOYSA-N 0 0 378.797 3.230 20 5 GGBDRN CC[C@@H](C)c1nnc([C@H](C)NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[nH]1 ZINC000489165881 566773968 /nfs/dbraw/zinc/77/39/68/566773968.db2.gz FNNZEGWUICZDOO-BDAKNGLRSA-N 0 0 396.245 3.480 20 5 GGBDRN CC[C@@H](C)c1nnc([C@@H](C)NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[nH]1 ZINC000489165884 566774246 /nfs/dbraw/zinc/77/42/46/566774246.db2.gz FNNZEGWUICZDOO-RKDXNWHRSA-N 0 0 396.245 3.480 20 5 GGBDRN CC[C@H](C)c1nnc([C@H](C)NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[nH]1 ZINC000489165883 566774492 /nfs/dbraw/zinc/77/44/92/566774492.db2.gz FNNZEGWUICZDOO-IUCAKERBSA-N 0 0 396.245 3.480 20 5 GGBDRN CNC(=O)c1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000489218792 566774928 /nfs/dbraw/zinc/77/49/28/566774928.db2.gz AZNPSYRSPNMHFN-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN CCS(=O)(=O)N1CCC(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000542104077 566775394 /nfs/dbraw/zinc/77/53/94/566775394.db2.gz FXZUYKOVXFWOGT-UHFFFAOYSA-N 0 0 396.296 3.375 20 5 GGBDRN CCc1n[nH]c(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1Br ZINC000469237071 566775459 /nfs/dbraw/zinc/77/54/59/566775459.db2.gz KFRLYRRYKBVCFJ-UHFFFAOYSA-N 0 0 393.241 3.448 20 5 GGBDRN CCOc1cccc([C@H]2C[C@@H]2Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000542119858 566775435 /nfs/dbraw/zinc/77/54/35/566775435.db2.gz MKYMIJMOZBAOFT-OLZOCXBDSA-N 0 0 382.463 3.427 20 5 GGBDRN CCOc1cccc([C@H]2C[C@H]2Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000542119857 566775649 /nfs/dbraw/zinc/77/56/49/566775649.db2.gz MKYMIJMOZBAOFT-CHWSQXEVSA-N 0 0 382.463 3.427 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1Nc1cnc(N2CCOCC2)c(Br)c1 ZINC000581420731 566776370 /nfs/dbraw/zinc/77/63/70/566776370.db2.gz PTDIJXAIXSJQCY-UHFFFAOYSA-N 0 0 397.204 3.472 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N(CCO)Cc1cccc(F)c1 ZINC000427532845 566777492 /nfs/dbraw/zinc/77/74/92/566777492.db2.gz CIFNWCZTMBLIKY-UHFFFAOYSA-N 0 0 397.200 3.131 20 5 GGBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2ncc(Br)s2)CC1 ZINC000542130724 566777515 /nfs/dbraw/zinc/77/75/15/566777515.db2.gz MEOZKQRBVVIQQW-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN CCN(Cc1ccc(Cl)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000469283221 566777959 /nfs/dbraw/zinc/77/79/59/566777959.db2.gz OZTQPZGXDATBIG-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN C[C@H](C(=O)N(C)Cc1cc(Br)cn1C)c1cccc([N+](=O)[O-])c1 ZINC000562300844 566778315 /nfs/dbraw/zinc/77/83/15/566778315.db2.gz IUGKIIVDYVVZMV-NSHDSACASA-N 0 0 380.242 3.458 20 5 GGBDRN CN(C)C(=O)COc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1Cl ZINC000609651800 566778634 /nfs/dbraw/zinc/77/86/34/566778634.db2.gz JGZWLMHIOHQORG-UHFFFAOYSA-N 0 0 383.813 3.029 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N(CCO)Cc1cccc(F)c1 ZINC000427544346 566779080 /nfs/dbraw/zinc/77/90/80/566779080.db2.gz BEOHJZRJASUHPV-UHFFFAOYSA-N 0 0 397.200 3.131 20 5 GGBDRN Cc1cc(Br)ccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000609674268 566780087 /nfs/dbraw/zinc/78/00/87/566780087.db2.gz MJWCMJIIAJKSTQ-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNc2nccc(C)c2[N+](=O)[O-])s1 ZINC000609669071 566780667 /nfs/dbraw/zinc/78/06/67/566780667.db2.gz MEHBNAITMVASCN-UHFFFAOYSA-N 0 0 384.483 3.002 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)Cc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000609673120 566780795 /nfs/dbraw/zinc/78/07/95/566780795.db2.gz DDNVXMAZTVTQAP-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN Cc1cccc(S(=O)(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1Cl ZINC000469315915 566780876 /nfs/dbraw/zinc/78/08/76/566780876.db2.gz ZBZDFQOYODKKIK-UHFFFAOYSA-N 0 0 382.825 3.009 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@H]1C[C@H]1c1c(F)cccc1F ZINC000609708444 566781259 /nfs/dbraw/zinc/78/12/59/566781259.db2.gz LLWKHQHCXJBWMD-PELKAZGASA-N 0 0 388.779 3.361 20 5 GGBDRN CN(Cc1ccc(Br)c(F)c1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000427580322 566781470 /nfs/dbraw/zinc/78/14/70/566781470.db2.gz OPDJKNSDDSQLOT-UHFFFAOYSA-N 0 0 382.189 3.351 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCc2ccc(O)cc2C1 ZINC000427618176 566783222 /nfs/dbraw/zinc/78/32/22/566783222.db2.gz MTQALUOFQGOGFQ-UHFFFAOYSA-N 0 0 391.221 3.190 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000609767115 566783445 /nfs/dbraw/zinc/78/34/45/566783445.db2.gz ZAEDIKXXNUECFM-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN COc1ccc(CC(=O)NCCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000609755881 566783545 /nfs/dbraw/zinc/78/35/45/566783545.db2.gz WKGXOADOQHUVMS-UHFFFAOYSA-N 0 0 393.237 3.267 20 5 GGBDRN COc1ccccc1CCCn1cc([N+](=O)[O-])c(C)c(Br)c1=O ZINC000542220302 566784157 /nfs/dbraw/zinc/78/41/57/566784157.db2.gz DVAJETRYNHOYCE-UHFFFAOYSA-N 0 0 381.226 3.469 20 5 GGBDRN Cc1cc(C)cc(NC(=O)Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)c1 ZINC000542219633 566784284 /nfs/dbraw/zinc/78/42/84/566784284.db2.gz JFCLXUAAFMWSOY-UHFFFAOYSA-N 0 0 394.225 3.083 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1noc(-c2cccs2)n1 ZINC000609785872 566784850 /nfs/dbraw/zinc/78/48/50/566784850.db2.gz MBPGLEUCGFWBRG-UHFFFAOYSA-N 0 0 378.797 3.219 20 5 GGBDRN COC[C@@H]1C[C@@H](OC)CN1c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000489385090 566784870 /nfs/dbraw/zinc/78/48/70/566784870.db2.gz CEVYDSSDNNWQPK-NWDGAFQWSA-N 0 0 396.241 3.146 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](OCC(F)(F)F)C1 ZINC000609784306 566785201 /nfs/dbraw/zinc/78/52/01/566785201.db2.gz MVQCMIJXTKGGFY-LBPRGKRZSA-N 0 0 380.750 3.361 20 5 GGBDRN COC(=O)c1cc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cn1C ZINC000542234040 566785290 /nfs/dbraw/zinc/78/52/90/566785290.db2.gz IZMULWPCCWHYQP-UHFFFAOYSA-N 0 0 383.813 3.104 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000609802441 566786107 /nfs/dbraw/zinc/78/61/07/566786107.db2.gz ZZDGCZBYSPALJZ-QGZVFWFLSA-N 0 0 378.475 3.215 20 5 GGBDRN CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000542248236 566786366 /nfs/dbraw/zinc/78/63/66/566786366.db2.gz ALEGLUMWOYVVNL-SNVBAGLBSA-N 0 0 391.287 3.414 20 5 GGBDRN C[C@@H](CCC1CC1)NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000469390981 566786719 /nfs/dbraw/zinc/78/67/19/566786719.db2.gz MCNONLNORTWARZ-VIFPVBQESA-N 0 0 377.260 3.214 20 5 GGBDRN C[C@@H](Cc1cccc(O)c1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000427650453 566786894 /nfs/dbraw/zinc/78/68/94/566786894.db2.gz HRVMPAITYVGWMT-NSHDSACASA-N 0 0 393.237 3.353 20 5 GGBDRN C[C@H](CCC1CC1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000469389459 566787198 /nfs/dbraw/zinc/78/71/98/566787198.db2.gz WFBVXZQQKPFYJN-SECBINFHSA-N 0 0 377.260 3.214 20 5 GGBDRN CNc1nccc(C(=O)NC[C@@H](C)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000516876404 566787860 /nfs/dbraw/zinc/78/78/60/566787860.db2.gz WFORIJRTEDLAEJ-SECBINFHSA-N 0 0 383.235 3.294 20 5 GGBDRN CNc1nccc(C(=O)NC[C@H](C)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000516876405 566788105 /nfs/dbraw/zinc/78/81/05/566788105.db2.gz WFORIJRTEDLAEJ-VIFPVBQESA-N 0 0 383.235 3.294 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCCNc1cccc(Br)c1 ZINC000427698167 566788661 /nfs/dbraw/zinc/78/86/61/566788661.db2.gz SKXSXHUSTWMIJS-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN C[C@H]1C[C@H](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000542273275 566789727 /nfs/dbraw/zinc/78/97/27/566789727.db2.gz CZOBIRQUMRAJPF-NWDGAFQWSA-N 0 0 385.258 3.221 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000609857899 566789672 /nfs/dbraw/zinc/78/96/72/566789672.db2.gz TYPBPHOBHPOULZ-UHFFFAOYSA-N 0 0 376.722 3.279 20 5 GGBDRN COc1cc(Br)ccc1OC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000489459851 566790043 /nfs/dbraw/zinc/79/00/43/566790043.db2.gz USGGGXNBQCZUTC-CYBMUJFWSA-N 0 0 398.209 3.185 20 5 GGBDRN NC(=O)c1ccnc(N2CCC[C@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000581580516 566790047 /nfs/dbraw/zinc/79/00/47/566790047.db2.gz DYGUAWKKJWDKKG-ZDUSSCGKSA-N 0 0 391.225 3.193 20 5 GGBDRN NS(=O)(=O)c1cccc(NC[C@H]2CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000581577870 566790140 /nfs/dbraw/zinc/79/01/40/566790140.db2.gz YVKXGAROZFJCEV-VHSXEESVSA-N 0 0 381.376 3.023 20 5 GGBDRN O=C(Nc1ncccn1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000609854379 566790314 /nfs/dbraw/zinc/79/03/14/566790314.db2.gz DLJMBEXUCBGKMU-UHFFFAOYSA-N 0 0 379.163 3.130 20 5 GGBDRN CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N(C)Cc1ccc(Cl)s1 ZINC000609840155 566790374 /nfs/dbraw/zinc/79/03/74/566790374.db2.gz CAWSQPVQHUZKJA-LLVKDONJSA-N 0 0 385.877 3.201 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H]1c1ccncc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000562412759 566790664 /nfs/dbraw/zinc/79/06/64/566790664.db2.gz OKFOVGSNEMSKNR-LSDHHAIUSA-N 0 0 392.209 3.012 20 5 GGBDRN O=C(NCCN=c1[nH]c2ccccc2s1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000609874402 566792135 /nfs/dbraw/zinc/79/21/35/566792135.db2.gz WMNTUFQRTKXNBS-UHFFFAOYSA-N 0 0 376.825 3.122 20 5 GGBDRN C[C@@H]1CSCCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000489516079 566793432 /nfs/dbraw/zinc/79/34/32/566793432.db2.gz PWPLGZWJOXZCNL-JTQLQIEISA-N 0 0 378.372 3.361 20 5 GGBDRN Cc1ncc2c(n1)CCN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000542328968 566794629 /nfs/dbraw/zinc/79/46/29/566794629.db2.gz VVXYBXQAHBQBPZ-UHFFFAOYSA-N 0 0 378.841 3.024 20 5 GGBDRN NC(=O)Nc1ccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000542337441 566795240 /nfs/dbraw/zinc/79/52/40/566795240.db2.gz FRWYRZNFTCFMMG-UHFFFAOYSA-N 0 0 380.813 3.470 20 5 GGBDRN C[C@@H](CN(C)C(=O)c1cc([N+](=O)[O-])nn1C)Oc1ccc(Cl)c(Cl)c1 ZINC000469523015 566796748 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Cc1c(Br)c(N(C)Cc2ccc([S@@](C)=O)cc2)ncc1[N+](=O)[O-] ZINC000543437196 566882543 /nfs/dbraw/zinc/88/25/43/566882543.db2.gz VASNCQLODNLXFH-HSZRJFAPSA-N 0 0 398.282 3.435 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(c2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000543438007 566882690 /nfs/dbraw/zinc/88/26/90/566882690.db2.gz GKAVXUUUZKMIFC-LBPRGKRZSA-N 0 0 399.289 3.193 20 5 GGBDRN Cc1c(Br)c(N2CCC[C@H](CNC(=O)C(C)C)C2)ncc1[N+](=O)[O-] ZINC000543438748 566882850 /nfs/dbraw/zinc/88/28/50/566882850.db2.gz ULSKEKVAOXSINO-GFCCVEGCSA-N 0 0 399.289 3.049 20 5 GGBDRN Cc1c(Br)c(Nc2cnn(-c3ccccn3)c2)ncc1[N+](=O)[O-] ZINC000543437549 566882868 /nfs/dbraw/zinc/88/28/68/566882868.db2.gz WQNKXDZTJVVDNB-UHFFFAOYSA-N 0 0 375.186 3.385 20 5 GGBDRN Cc1c(Br)c(N2CCC[C@@H](CNC(=O)C(C)C)C2)ncc1[N+](=O)[O-] ZINC000543438751 566882975 /nfs/dbraw/zinc/88/29/75/566882975.db2.gz ULSKEKVAOXSINO-LBPRGKRZSA-N 0 0 399.289 3.049 20 5 GGBDRN CN(CC1CCCCC1)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000582656776 566883119 /nfs/dbraw/zinc/88/31/19/566883119.db2.gz QSBRKHHQDVEFRO-UHFFFAOYSA-N 0 0 398.257 3.335 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCO[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000611073282 566887246 /nfs/dbraw/zinc/88/72/46/566887246.db2.gz YHBWUJHKCCRAEQ-LLVKDONJSA-N 0 0 397.147 3.069 20 5 GGBDRN C[C@H]1OCC[C@H]1Sc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000611086093 566888196 /nfs/dbraw/zinc/88/81/96/566888196.db2.gz NZSABXIFNRHHAZ-IUODEOHRSA-N 0 0 386.495 3.039 20 5 GGBDRN Cc1cc(C)c(NC(=O)[C@H](C)Sc2ncc([N+](=O)[O-])c(N)n2)c(Cl)c1 ZINC000582737097 566889032 /nfs/dbraw/zinc/88/90/32/566889032.db2.gz QUOIHCYCHSPQTC-VIFPVBQESA-N 0 0 381.845 3.187 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCC2(F)F)c(C(F)(F)F)c1 ZINC000451828621 566889519 /nfs/dbraw/zinc/88/95/19/566889519.db2.gz WNQHFCVCEQOYSJ-MRVPVSSYSA-N 0 0 388.314 3.327 20 5 GGBDRN CCn1cc(S(=O)(=O)N(CC(C)C)c2ccc(Cl)cc2)c([N+](=O)[O-])n1 ZINC000611107519 566889517 /nfs/dbraw/zinc/88/95/17/566889517.db2.gz ZRHNRKLIZVDHAC-UHFFFAOYSA-N 0 0 386.861 3.316 20 5 GGBDRN CN(CCc1cccc(Br)c1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000428918108 566889699 /nfs/dbraw/zinc/88/96/99/566889699.db2.gz ZNROHFFYHSVQFL-UHFFFAOYSA-N 0 0 392.253 3.470 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](c2cccnc2)C1 ZINC000563536910 566893702 /nfs/dbraw/zinc/89/37/02/566893702.db2.gz IOKONBXNRSQAKX-LBPRGKRZSA-N 0 0 376.210 3.382 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000518595168 566893790 /nfs/dbraw/zinc/89/37/90/566893790.db2.gz NDJJDQBTVUVVKV-OLZOCXBDSA-N 0 0 397.250 3.192 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000518595170 566894012 /nfs/dbraw/zinc/89/40/12/566894012.db2.gz NDJJDQBTVUVVKV-STQMWFEESA-N 0 0 397.250 3.192 20 5 GGBDRN CO[C@@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000451847551 566894356 /nfs/dbraw/zinc/89/43/56/566894356.db2.gz JBIQCLLGVZREKC-GFCCVEGCSA-N 0 0 397.280 3.337 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCc2cc(Cl)ccc2Cl)cc1 ZINC000543621179 566895444 /nfs/dbraw/zinc/89/54/44/566895444.db2.gz HMGMGTUXRQPCLX-UHFFFAOYSA-N 0 0 389.260 3.465 20 5 GGBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)[C@@H]1Cc2cc(Br)ccc2O1 ZINC000470698412 566896143 /nfs/dbraw/zinc/89/61/43/566896143.db2.gz FAYUQVFKIJLNOJ-AWEZNQCLSA-N 0 0 381.157 3.439 20 5 GGBDRN CCOc1cc(CN2c3cc(Cl)ccc3CS2(=O)=O)ccc1[N+](=O)[O-] ZINC000518621482 566896998 /nfs/dbraw/zinc/89/69/98/566896998.db2.gz URDKDHRYTQJVSK-UHFFFAOYSA-N 0 0 382.825 3.497 20 5 GGBDRN COc1nc(C)c(Br)cc1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470706976 566897054 /nfs/dbraw/zinc/89/70/54/566897054.db2.gz JJSILBCBTGCROC-UHFFFAOYSA-N 0 0 384.161 3.461 20 5 GGBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)c1cc2c(c(Br)c1)OCO2 ZINC000470702393 566897719 /nfs/dbraw/zinc/89/77/19/566897719.db2.gz AMTOGOTXQWQFON-UHFFFAOYSA-N 0 0 383.129 3.477 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)NCCCc2ccccc2)c1 ZINC000518704647 566898846 /nfs/dbraw/zinc/89/88/46/566898846.db2.gz XESWCZFEESCYAJ-UHFFFAOYSA-N 0 0 399.266 3.268 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)Nc2ccc(F)cc2)c1 ZINC000518697785 566898894 /nfs/dbraw/zinc/89/88/94/566898894.db2.gz IFMBHAJZEINRPL-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN CC(C)[C@H]1CCCN1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000518704326 566899228 /nfs/dbraw/zinc/89/92/28/566899228.db2.gz GUTYAPMOTRTTFY-CYBMUJFWSA-N 0 0 377.260 3.166 20 5 GGBDRN CSc1cccc(C(=O)Nc2nnc(C3CCOCC3)s2)c1[N+](=O)[O-] ZINC000582865516 566899721 /nfs/dbraw/zinc/89/97/21/566899721.db2.gz HJFBZTKKWBIINV-UHFFFAOYSA-N 0 0 380.451 3.315 20 5 GGBDRN COC1CCC(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000543688783 566901648 /nfs/dbraw/zinc/90/16/48/566901648.db2.gz AXTKHWSVMUZEPL-UHFFFAOYSA-N 0 0 376.862 3.122 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CC=C(c2ccccc2F)C1 ZINC000543688580 566901705 /nfs/dbraw/zinc/90/17/05/566901705.db2.gz CNCCTMMDWXUEBG-UHFFFAOYSA-N 0 0 382.800 3.475 20 5 GGBDRN C[C@H](Cc1ccccc1Br)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000470751057 566902007 /nfs/dbraw/zinc/90/20/07/566902007.db2.gz ZCZWBQLKXBSBRE-SECBINFHSA-N 0 0 396.216 3.440 20 5 GGBDRN C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccccc1 ZINC000543686459 566902380 /nfs/dbraw/zinc/90/23/80/566902380.db2.gz PFHZPANVGYNESL-NSHDSACASA-N 0 0 399.266 3.439 20 5 GGBDRN C[S@@](=O)c1ccc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000611223552 566902384 /nfs/dbraw/zinc/90/23/84/566902384.db2.gz ZBVDRUJLYGZJSA-CRICUBBOSA-N 0 0 376.459 3.220 20 5 GGBDRN O=C(CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)Nc1cc(Cl)ccc1Cl ZINC000518787928 566902660 /nfs/dbraw/zinc/90/26/60/566902660.db2.gz FPOQWLYXMPVSIQ-UHFFFAOYSA-N 0 0 386.166 3.409 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1cc2c(cn1)CCC2 ZINC000518783842 566902808 /nfs/dbraw/zinc/90/28/08/566902808.db2.gz BCPLUNGXKBKCST-UHFFFAOYSA-N 0 0 376.210 3.422 20 5 GGBDRN Nc1c(C(=O)NC2(Cc3ccccc3Br)CC2)cccc1[N+](=O)[O-] ZINC000582897082 566903962 /nfs/dbraw/zinc/90/39/62/566903962.db2.gz WSPGRTQDGMFADG-UHFFFAOYSA-N 0 0 390.237 3.445 20 5 GGBDRN CN(Cc1ccc(Br)o1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611254210 566904209 /nfs/dbraw/zinc/90/42/09/566904209.db2.gz SJBBLCYJFNXUNF-UHFFFAOYSA-N 0 0 383.198 3.354 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCSC[C@H]2C2CC2)c(C(F)(F)F)c1 ZINC000451903626 566904170 /nfs/dbraw/zinc/90/41/70/566904170.db2.gz JIZBNEHGONISBH-LBPRGKRZSA-N 0 0 396.412 3.130 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@H]2c2ccsc2)cc1[N+](=O)[O-] ZINC000491349458 566904629 /nfs/dbraw/zinc/90/46/29/566904629.db2.gz VBCXZROWSAAKEN-ZDUSSCGKSA-N 0 0 386.426 3.330 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1cccs1)CC(F)(F)F ZINC000470795036 566905294 /nfs/dbraw/zinc/90/52/94/566905294.db2.gz ROBJAMLBHNLBQW-UHFFFAOYSA-N 0 0 376.360 3.142 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCSC[C@H]1C1CC1 ZINC000451913512 566905781 /nfs/dbraw/zinc/90/57/81/566905781.db2.gz SSMSPQLMTDBQHK-LBPRGKRZSA-N 0 0 397.305 3.418 20 5 GGBDRN COc1ccccc1C(C)(C)CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000611280959 566905876 /nfs/dbraw/zinc/90/58/76/566905876.db2.gz DBCGDSFBAYWWGK-UHFFFAOYSA-N 0 0 384.479 3.458 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000491470777 566905961 /nfs/dbraw/zinc/90/59/61/566905961.db2.gz UIZWOXAYHMHVDB-HZMBPMFUSA-N 0 0 380.447 3.167 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCCO[C@@H](c3ccccc3)C2)s1 ZINC000611281067 566906083 /nfs/dbraw/zinc/90/60/83/566906083.db2.gz HJOQFAKAPXFORU-CQSZACIVSA-N 0 0 382.463 3.028 20 5 GGBDRN O=C(NCCNc1cccc(Br)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000491444471 566906606 /nfs/dbraw/zinc/90/66/06/566906606.db2.gz NEYWETYFDLBFGF-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CCS[C@@H]1CC[C@@H](N(C)S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491512139 566907750 /nfs/dbraw/zinc/90/77/50/566907750.db2.gz MIOFPIYPALENAT-GHMZBOCLSA-N 0 0 392.474 3.037 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)Sc2nnc(C3CC3)s2)c([N+](=O)[O-])c1 ZINC000470839128 566907852 /nfs/dbraw/zinc/90/78/52/566907852.db2.gz DCYCFWNNWPUVJG-QMMMGPOBSA-N 0 0 380.451 3.452 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)Sc2nnc(C3CC3)s2)c([N+](=O)[O-])c1 ZINC000470839127 566908255 /nfs/dbraw/zinc/90/82/55/566908255.db2.gz DCYCFWNNWPUVJG-MRVPVSSYSA-N 0 0 380.451 3.452 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(CC(C)C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000491547105 566908952 /nfs/dbraw/zinc/90/89/52/566908952.db2.gz OOFJWKZRAPZBFP-UHFFFAOYSA-N 0 0 376.450 3.435 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC(c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000451924512 566910184 /nfs/dbraw/zinc/91/01/84/566910184.db2.gz DBQXCBCRIHMPFY-UHFFFAOYSA-N 0 0 382.825 3.045 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](CC)Cc2ccccc2Br)c1[N+](=O)[O-] ZINC000470875945 566911756 /nfs/dbraw/zinc/91/17/56/566911756.db2.gz MMVRZTFCQSESOB-LLVKDONJSA-N 0 0 395.257 3.394 20 5 GGBDRN O=C(COc1ccsc1Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000563733527 566912773 /nfs/dbraw/zinc/91/27/73/566912773.db2.gz VMAPPJRAMHBJJF-UHFFFAOYSA-N 0 0 381.841 3.037 20 5 GGBDRN CC(C)(C)OC(=O)CCCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000611343216 566912734 /nfs/dbraw/zinc/91/27/34/566912734.db2.gz ZKRVNZZNYJRZHV-UHFFFAOYSA-N 0 0 392.861 3.039 20 5 GGBDRN CCS[C@@H]1CCCC[C@H]1NS(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1 ZINC000491613444 566913632 /nfs/dbraw/zinc/91/36/32/566913632.db2.gz REMYLOUOVBDBSL-TZMCWYRMSA-N 0 0 392.474 3.085 20 5 GGBDRN CN(Cc1ccc(Br)c(F)c1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000491768844 566914320 /nfs/dbraw/zinc/91/43/20/566914320.db2.gz YCFJQNZIJSELMU-UHFFFAOYSA-N 0 0 382.189 3.232 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H]2CCc3cc(F)c(F)c(F)c32)cc1[N+](=O)[O-] ZINC000451960782 566914707 /nfs/dbraw/zinc/91/47/07/566914707.db2.gz FLGSNRBCPDEYIV-VIFPVBQESA-N 0 0 392.380 3.348 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H](CCO)c1ccccc1Br ZINC000543845224 566915829 /nfs/dbraw/zinc/91/58/29/566915829.db2.gz HJOSQOFOQJZWMX-HNNXBMFYSA-N 0 0 393.237 3.140 20 5 GGBDRN C[C@@H]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000429252893 566916230 /nfs/dbraw/zinc/91/62/30/566916230.db2.gz IQYZEBSYSXAVND-ZJUUUORDSA-N 0 0 388.205 3.460 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2cc(Cl)cc(Cl)c2)cc1 ZINC000519064894 566918662 /nfs/dbraw/zinc/91/86/62/566918662.db2.gz WRNTVNISLKZSMD-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCCc1cc(Cl)cc(Cl)c1 ZINC000519064845 566918892 /nfs/dbraw/zinc/91/88/92/566918892.db2.gz URGLZJLCKSHQAW-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN COc1ccc(CN[C@H](CO)c2ccc(Br)c(F)c2)cc1[N+](=O)[O-] ZINC000492101642 566923018 /nfs/dbraw/zinc/92/30/18/566923018.db2.gz CDAJZHFNIQHESO-CQSZACIVSA-N 0 0 399.216 3.328 20 5 GGBDRN C[C@H](c1ccccc1)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000611508588 566923766 /nfs/dbraw/zinc/92/37/66/566923766.db2.gz LBIZDGLXHCOGCI-BZNIZROVSA-N 0 0 393.237 3.252 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2c(F)cc(Br)cc2C1 ZINC000611529067 566925063 /nfs/dbraw/zinc/92/50/63/566925063.db2.gz BPIWIDXTHXZGMC-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN C[C@H]1CC[C@H](C(F)(F)F)CN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000611542418 566925334 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GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCCn1cc(Br)cn1 ZINC000471128307 566930895 /nfs/dbraw/zinc/93/08/95/566930895.db2.gz YHRYDSZLMTXUKM-UHFFFAOYSA-N 0 0 396.245 3.464 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1Cc2cnn(-c3ccccc3)c2C1 ZINC000563944149 566931714 /nfs/dbraw/zinc/93/17/14/566931714.db2.gz VHLZQOLXVNSXFS-UHFFFAOYSA-N 0 0 386.209 3.458 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)CC ZINC000544049064 566932878 /nfs/dbraw/zinc/93/28/78/566932878.db2.gz KYCKRKWQBNPGIF-BONVTDFDSA-N 0 0 388.873 3.434 20 5 GGBDRN COCC[C@H](Cc1ccco1)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000544068432 566934581 /nfs/dbraw/zinc/93/45/81/566934581.db2.gz MRDUXSARNIPAOZ-LLVKDONJSA-N 0 0 397.225 3.328 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCCc2ccc(F)c(F)c2F)s1 ZINC000544068009 566934686 /nfs/dbraw/zinc/93/46/86/566934686.db2.gz ZWYHTWALVGDEDP-UHFFFAOYSA-N 0 0 380.369 3.132 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCCOc1ncccc1F ZINC000544086187 566935852 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Cc1c(Br)c(NCCCCC(=O)OC(C)(C)C)ncc1[N+](=O)[O-] ZINC000612449582 566974642 /nfs/dbraw/zinc/97/46/42/566974642.db2.gz RLMFPXMKRPNHQX-UHFFFAOYSA-N 0 0 388.262 3.407 20 5 GGBDRN Cc1c(Br)c(N2C[C@@H](C)O[C@H](C(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000612446351 566975113 /nfs/dbraw/zinc/97/51/13/566975113.db2.gz HKQPFIPKEPAJJQ-MUWHJKNJSA-N 0 0 384.152 3.217 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2cc3c(cc2Cl)OCO3)c1 ZINC000544646949 566975696 /nfs/dbraw/zinc/97/56/96/566975696.db2.gz WBFLIFNRVWLJPP-UHFFFAOYSA-N 0 0 384.797 3.395 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CCOc3c(Cl)cccc32)c1 ZINC000544645996 566976376 /nfs/dbraw/zinc/97/63/76/566976376.db2.gz BAXKOEALHNOXSG-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN O=C(Nc1nnc(SCc2cccs2)s1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000519894014 566977082 /nfs/dbraw/zinc/97/70/82/566977082.db2.gz QRYRMXHXOLYUBR-UHFFFAOYSA-N 0 0 395.447 3.153 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCCOc1ccc(F)cc1 ZINC000519889579 566977218 /nfs/dbraw/zinc/97/72/18/566977218.db2.gz YWEOQGZJVURYBH-UHFFFAOYSA-N 0 0 388.804 3.135 20 5 GGBDRN CS(=O)(=O)Cc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000519901718 566977441 /nfs/dbraw/zinc/97/74/41/566977441.db2.gz HUMHTLUVMNKPKX-UHFFFAOYSA-N 0 0 383.813 3.437 20 5 GGBDRN O=C(NCCc1nc2ccccc2o1)c1ccc([N+](=O)[O-])cc1Br ZINC000583731746 566978498 /nfs/dbraw/zinc/97/84/98/566978498.db2.gz ISPNCZDLCHUGBU-UHFFFAOYSA-N 0 0 390.193 3.471 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)sc1C ZINC000544666502 566978572 /nfs/dbraw/zinc/97/85/72/566978572.db2.gz WYDDJJXWMSCHQM-UHFFFAOYSA-N 0 0 383.495 3.499 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000519929473 566979109 /nfs/dbraw/zinc/97/91/09/566979109.db2.gz LNSVCMURBAMXFI-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1cc(Br)cnc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000430080798 566979983 /nfs/dbraw/zinc/97/99/83/566979983.db2.gz CKTKWBIIJGPFJY-UHFFFAOYSA-N 0 0 394.181 3.084 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000583767160 566982055 /nfs/dbraw/zinc/98/20/55/566982055.db2.gz RCAPNUFZCNGJMB-GDLCADMTSA-N 0 0 383.242 3.209 20 5 GGBDRN CC[C@H](CNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)OC ZINC000564521077 566982082 /nfs/dbraw/zinc/98/20/82/566982082.db2.gz OPZDHWQJPXRWNI-SNVBAGLBSA-N 0 0 387.223 3.242 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C(C)(F)F ZINC000452452953 566982616 /nfs/dbraw/zinc/98/26/16/566982616.db2.gz GBYGCZBGXSQJRT-ZETCQYMHSA-N 0 0 398.147 3.281 20 5 GGBDRN CCc1ccc(S(=O)(=O)N[C@H](C)CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000583809722 566985125 /nfs/dbraw/zinc/98/51/25/566985125.db2.gz AIJBMJACYYGARA-LLVKDONJSA-N 0 0 382.463 3.159 20 5 GGBDRN O=C(c1ccccc1I)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000612646047 566986052 /nfs/dbraw/zinc/98/60/52/566986052.db2.gz FCZRRBDAVIGTRG-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN COc1cc(Br)ccc1-c1noc(-c2c([N+](=O)[O-])c(C)nn2C)n1 ZINC000564555694 566987183 /nfs/dbraw/zinc/98/71/83/566987183.db2.gz JMRVNQOGFZTYNG-UHFFFAOYSA-N 0 0 394.185 3.125 20 5 GGBDRN COCCOCCSCc1cc(I)cc([N+](=O)[O-])c1 ZINC000564563459 566987772 /nfs/dbraw/zinc/98/77/72/566987772.db2.gz WCFWGBVAAZSAAV-UHFFFAOYSA-N 0 0 397.234 3.096 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](C)CCCC(F)(F)F)cc1[N+](=O)[O-] ZINC000494325477 566988468 /nfs/dbraw/zinc/98/84/68/566988468.db2.gz COGMGUHBYWROTK-MRVPVSSYSA-N 0 0 388.339 3.142 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000494325127 566988760 /nfs/dbraw/zinc/98/87/60/566988760.db2.gz CTXHXDNQZYOAQB-MRVPVSSYSA-N 0 0 385.294 3.418 20 5 GGBDRN CC(C)(CNC(=O)c1cc([N+](=O)[O-])cnc1N)c1cccc(Br)c1 ZINC000544736246 566988998 /nfs/dbraw/zinc/98/89/98/566988998.db2.gz GHLUYNRRGVLQCQ-UHFFFAOYSA-N 0 0 393.241 3.042 20 5 GGBDRN Cc1nn(C)c(-c2nc(-c3ccc(C)cc3Br)no2)c1[N+](=O)[O-] ZINC000544728877 566989090 /nfs/dbraw/zinc/98/90/90/566989090.db2.gz WJUXEXHMAPWARQ-UHFFFAOYSA-N 0 0 378.186 3.425 20 5 GGBDRN O=C(CN1CCc2ccc(Br)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000564578767 566989142 /nfs/dbraw/zinc/98/91/42/566989142.db2.gz LCCBOLSFZMRWDY-UHFFFAOYSA-N 0 0 390.237 3.354 20 5 GGBDRN CCCN(CC(N)=O)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000430137925 566989326 /nfs/dbraw/zinc/98/93/26/566989326.db2.gz XCHNRHRYPWVLHK-UHFFFAOYSA-N 0 0 396.241 3.315 20 5 GGBDRN CCCC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C)C(=O)OC ZINC000520244171 566991217 /nfs/dbraw/zinc/99/12/17/566991217.db2.gz JSJPFCMSEOYVNN-CYBMUJFWSA-N 0 0 387.230 3.127 20 5 GGBDRN Cc1cncnc1-c1noc(-c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000520238625 566991438 /nfs/dbraw/zinc/99/14/38/566991438.db2.gz RBGFQJCGAFPQJZ-UHFFFAOYSA-N 0 0 376.170 3.481 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCOC[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000564658769 566995880 /nfs/dbraw/zinc/99/58/80/566995880.db2.gz LTSJGZALPLRXNC-HNNXBMFYSA-N 0 0 383.242 3.307 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC3(C2)CCCCC3)c(Br)c1 ZINC000612799553 566997287 /nfs/dbraw/zinc/99/72/87/566997287.db2.gz KIXLNCSGLQBNQZ-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCCc2c[nH]c3cc(Cl)ccc23)c1 ZINC000612792431 566997368 /nfs/dbraw/zinc/99/73/68/566997368.db2.gz XOINHTHVXVDFGK-UHFFFAOYSA-N 0 0 379.825 3.251 20 5 GGBDRN CC[C@H]1CN(c2ccc(I)cc2[N+](=O)[O-])CCCO1 ZINC000583947625 566998004 /nfs/dbraw/zinc/99/80/04/566998004.db2.gz XSTSRLAMYUAMQC-NSHDSACASA-N 0 0 376.194 3.205 20 5 GGBDRN COc1ncc(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000452621097 566998421 /nfs/dbraw/zinc/99/84/21/566998421.db2.gz YVICAMFTMRDHNJ-JTQLQIEISA-N 0 0 381.841 3.449 20 5 GGBDRN COc1ccc(Br)c(CN(C)C(=O)c2cccc([N+](=O)[O-])c2N)c1 ZINC000430199893 566998940 /nfs/dbraw/zinc/99/89/40/566998940.db2.gz SFHUEHIQPHEMTM-UHFFFAOYSA-N 0 0 394.225 3.220 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCCc2nc3cc(Cl)ccc3s2)c1 ZINC000544835969 566999540 /nfs/dbraw/zinc/99/95/40/566999540.db2.gz FIZGAVYMYMAARI-UHFFFAOYSA-N 0 0 397.865 3.379 20 5 GGBDRN 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0 0 397.269 3.431 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000452678880 567004781 /nfs/dbraw/zinc/00/47/81/567004781.db2.gz JPHHJRLYBQSSJP-BJJXKVORSA-N 0 0 397.269 3.431 20 5 GGBDRN CC[C@H](CSC)NS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000564746076 567004718 /nfs/dbraw/zinc/00/47/18/567004718.db2.gz OFWQZXDEYMUUNE-SECBINFHSA-N 0 0 397.316 3.086 20 5 GGBDRN Cc1c(Br)cc(-c2nc(Cc3cnn(C)c3)no2)cc1[N+](=O)[O-] ZINC000612912479 567005012 /nfs/dbraw/zinc/00/50/12/567005012.db2.gz YXSVWZGCNXJNLA-UHFFFAOYSA-N 0 0 378.186 3.040 20 5 GGBDRN O=c1ccn(Cc2nc(CSc3ccc(Cl)cc3)no2)cc1[N+](=O)[O-] ZINC000544909835 567005780 /nfs/dbraw/zinc/00/57/80/567005780.db2.gz RLUIOIZJIZGBED-UHFFFAOYSA-N 0 0 378.797 3.134 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000452689091 567005666 /nfs/dbraw/zinc/00/56/66/567005666.db2.gz VPOOQDGLVTYTKB-WQVCFCJDSA-N 0 0 397.269 3.431 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CS(=O)(=O)c3ccc(Cl)cc3)no2)cc1 ZINC000544917641 567006105 /nfs/dbraw/zinc/00/61/05/567006105.db2.gz SVSQFRKZYPSRPL-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000452689087 567006263 /nfs/dbraw/zinc/00/62/63/567006263.db2.gz VPOOQDGLVTYTKB-DAXOMENPSA-N 0 0 397.269 3.431 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H](C)CC(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430308470 567007175 /nfs/dbraw/zinc/00/71/75/567007175.db2.gz TXXFJDDRIYKXDK-VIFPVBQESA-N 0 0 386.246 3.155 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC[C@@H]2C(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430313100 567008131 /nfs/dbraw/zinc/00/81/31/567008131.db2.gz DXLYZKWYRGMUST-CYBMUJFWSA-N 0 0 398.257 3.251 20 5 GGBDRN CC[C@H]1[C@@H](C)CCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430318956 567008556 /nfs/dbraw/zinc/00/85/56/567008556.db2.gz LPRXEBPEWYBQIG-ZANVPECISA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)C2CCCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000430317901 567008899 /nfs/dbraw/zinc/00/88/99/567008899.db2.gz SFNBMPKLKSAUEI-UHFFFAOYSA-N 0 0 398.257 3.395 20 5 GGBDRN CCCN(CC1CC1)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430324239 567009576 /nfs/dbraw/zinc/00/95/76/567009576.db2.gz SIGARRHLEQJWGY-UHFFFAOYSA-N 0 0 398.257 3.253 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCC(C)=C(C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430334258 567009656 /nfs/dbraw/zinc/00/96/56/567009656.db2.gz DGKWMLWMZKMHOT-UHFFFAOYSA-N 0 0 396.241 3.173 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@H](C)C[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430332977 567009792 /nfs/dbraw/zinc/00/97/92/567009792.db2.gz PTGQJDDHIMBRCW-AOOOYVTPSA-N 0 0 398.257 3.109 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@@H](C)CC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000430325762 567010028 /nfs/dbraw/zinc/01/00/28/567010028.db2.gz XSXGVKLJGBLHLP-VHSXEESVSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCC[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430330452 567010087 /nfs/dbraw/zinc/01/00/87/567010087.db2.gz JCVFZBUOSVKRTA-SKDRFNHKSA-N 0 0 398.257 3.299 20 5 GGBDRN COc1c(Br)cc(Cl)cc1NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000520513011 567010134 /nfs/dbraw/zinc/01/01/34/567010134.db2.gz XZGVBLKXAUCCDM-UHFFFAOYSA-N 0 0 389.593 3.303 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(-c2cc(F)cc(Br)c2)no1 ZINC000544944460 567010663 /nfs/dbraw/zinc/01/06/63/567010663.db2.gz AYQARSXWMIRNIS-UHFFFAOYSA-N 0 0 382.149 3.100 20 5 GGBDRN CC[C@@H]1CC[C@H](C)N1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430344376 567011082 /nfs/dbraw/zinc/01/10/82/567011082.db2.gz OJQZZWFQBMUHTI-JOYOIKCWSA-N 0 0 398.257 3.394 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[S@@](=O)CC1 ZINC000430344232 567011194 /nfs/dbraw/zinc/01/11/94/567011194.db2.gz LGCBDRXNMXDENZ-SHZVTRLKSA-N 0 0 384.523 3.326 20 5 GGBDRN CC[C@H]1CC[C@@H](C)N1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430344378 567011279 /nfs/dbraw/zinc/01/12/79/567011279.db2.gz OJQZZWFQBMUHTI-SKDRFNHKSA-N 0 0 398.257 3.394 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC2C(C)(C)C2(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430342257 567011383 /nfs/dbraw/zinc/01/13/83/567011383.db2.gz HTCVKIXOZGPXQD-UHFFFAOYSA-N 0 0 398.257 3.155 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)[C@@H]2CC[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430347162 567011389 /nfs/dbraw/zinc/01/13/89/567011389.db2.gz WGOPXTAMAVYSMP-BXKDBHETSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)[C@H]2CC[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430347166 567011531 /nfs/dbraw/zinc/01/15/31/567011531.db2.gz WGOPXTAMAVYSMP-SKDRFNHKSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2nc(C(C)(C)C)cs2)cc1C ZINC000520559084 567012218 /nfs/dbraw/zinc/01/22/18/567012218.db2.gz JJRJTEBPIUNDSR-UHFFFAOYSA-N 0 0 383.495 3.444 20 5 GGBDRN O=[N+]([O-])c1cnn(CCN2CCO[C@H](c3cc(F)c(Cl)cc3Cl)C2)c1 ZINC000472245877 567012434 /nfs/dbraw/zinc/01/24/34/567012434.db2.gz XJERCBJGRZTUOR-HNNXBMFYSA-N 0 0 389.214 3.311 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@@H]3CCC[C@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000430358419 567012643 /nfs/dbraw/zinc/01/26/43/567012643.db2.gz XSAGMASTWOHNIS-GXFFZTMASA-N 0 0 396.241 3.005 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(CCc2ccccc2Br)no1 ZINC000545022676 567013900 /nfs/dbraw/zinc/01/39/00/567013900.db2.gz OFCXQHGLTNLISC-UHFFFAOYSA-N 0 0 392.213 3.079 20 5 GGBDRN O=[N+]([O-])c1ccn(Cc2nc(Cc3nc4cc(Cl)ccc4s3)no2)n1 ZINC000545008458 567014036 /nfs/dbraw/zinc/01/40/36/567014036.db2.gz QGUDJUYEFXMWIV-UHFFFAOYSA-N 0 0 376.785 3.077 20 5 GGBDRN COc1cc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000564864055 567014065 /nfs/dbraw/zinc/01/40/65/567014065.db2.gz QEUZDOOLYCQYTJ-ZDUSSCGKSA-N 0 0 397.225 3.218 20 5 GGBDRN COc1cc(Cc2noc(-c3cncc(Br)c3)n2)ccc1[N+](=O)[O-] ZINC000545056386 567017054 /nfs/dbraw/zinc/01/70/54/567017054.db2.gz ZRKZJNUJUJSYPH-UHFFFAOYSA-N 0 0 391.181 3.402 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N[C@@H](CO)CC(F)F)cc1[N+](=O)[O-] ZINC000430507040 567018131 /nfs/dbraw/zinc/01/81/31/567018131.db2.gz BSJCWXNDIBZCBJ-GFCCVEGCSA-N 0 0 376.425 3.479 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@H]1CCCC1(F)F ZINC000452827552 567020495 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CCO[C@@H]1CCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000452851980 567025329 /nfs/dbraw/zinc/02/53/29/567025329.db2.gz HTVRUIQGCHHGDL-WCBMZHEXSA-N 0 0 377.260 3.306 20 5 GGBDRN CCO[C@H]1CCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000452851979 567025402 /nfs/dbraw/zinc/02/54/02/567025402.db2.gz HTVRUIQGCHHGDL-SCZZXKLOSA-N 0 0 377.260 3.306 20 5 GGBDRN CC1(C)[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H]2CCCO[C@@H]21 ZINC000430613542 567025407 /nfs/dbraw/zinc/02/54/07/567025407.db2.gz WOAIPIAATFFLSK-BNOWGMLFSA-N 0 0 383.242 3.291 20 5 GGBDRN O=[N+]([O-])c1cnn(CCN(Cc2cc(Br)ccc2F)C2CC2)c1 ZINC000472436726 567026286 /nfs/dbraw/zinc/02/62/86/567026286.db2.gz WEONKGGFTHQWDE-UHFFFAOYSA-N 0 0 383.221 3.358 20 5 GGBDRN CC1(C)CS(=O)(=O)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000564985412 567027748 /nfs/dbraw/zinc/02/77/48/567027748.db2.gz IYFIQZSYZFPPDZ-UHFFFAOYSA-N 0 0 380.491 3.332 20 5 GGBDRN CO[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000452872793 567028060 /nfs/dbraw/zinc/02/80/60/567028060.db2.gz SWGYDFMOGVEOBT-CQSZACIVSA-N 0 0 385.258 3.173 20 5 GGBDRN Cc1ccncc1N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000545212708 567029756 /nfs/dbraw/zinc/02/97/56/567029756.db2.gz GXTXEYQYKGLDBQ-UHFFFAOYSA-N 0 0 375.328 3.142 20 5 GGBDRN CN(Cc1cc(Br)ccc1Cl)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000494856099 567030612 /nfs/dbraw/zinc/03/06/12/567030612.db2.gz HAKCNSJIJMYCRF-UHFFFAOYSA-N 0 0 387.621 3.016 20 5 GGBDRN C[C@H]1CCCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000520896952 567030792 /nfs/dbraw/zinc/03/07/92/567030792.db2.gz HKFHSMAIWBKZBN-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@@H]3CCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000545230872 567031356 /nfs/dbraw/zinc/03/13/56/567031356.db2.gz HAEOBFFUXNWDBA-LBPRGKRZSA-N 0 0 379.463 3.142 20 5 GGBDRN Cc1cc(Br)c(CN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)s1 ZINC000584333424 567032711 /nfs/dbraw/zinc/03/27/11/567032711.db2.gz ULECAUPMUKJRAF-UHFFFAOYSA-N 0 0 397.298 3.444 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]([C@H](CO)C1CC1)C1CC1 ZINC000452919569 567032795 /nfs/dbraw/zinc/03/27/95/567032795.db2.gz GIIJMUKPBSNMRK-GDBMZVCRSA-N 0 0 397.269 3.193 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CSC[C@H]2C[C@@H](O)C2)c1 ZINC000521021678 567036036 /nfs/dbraw/zinc/03/60/36/567036036.db2.gz XGJWDDIMXBZALC-WVSHTKLVSA-N 0 0 379.219 3.204 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000521038340 567036430 /nfs/dbraw/zinc/03/64/30/567036430.db2.gz FKVVNISQFHPRHU-AAEUAGOBSA-N 0 0 393.241 3.319 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000521038343 567036863 /nfs/dbraw/zinc/03/68/63/567036863.db2.gz FKVVNISQFHPRHU-YPMHNXCESA-N 0 0 393.241 3.319 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(N)=O)ccc1Cl ZINC000521040690 567037899 /nfs/dbraw/zinc/03/78/99/567037899.db2.gz AWDUTURSIVHYSU-VIFPVBQESA-N 0 0 379.825 3.466 20 5 GGBDRN CCc1nn(C)c(NCc2cn3cc(Br)cc(C)c3n2)c1[N+](=O)[O-] ZINC000545344466 567039483 /nfs/dbraw/zinc/03/94/83/567039483.db2.gz HFOXIYHBASADTM-UHFFFAOYSA-N 0 0 393.245 3.221 20 5 GGBDRN CSCc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000545353874 567041195 /nfs/dbraw/zinc/04/11/95/567041195.db2.gz GICIXZMAISRNPL-UHFFFAOYSA-N 0 0 380.447 3.114 20 5 GGBDRN COCc1cc(Cl)cc(S(=O)(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000521121060 567041428 /nfs/dbraw/zinc/04/14/28/567041428.db2.gz ZBAORIANXYJGST-NSHDSACASA-N 0 0 384.841 3.434 20 5 GGBDRN COC(=O)c1cccc(Br)c1COc1ccc([N+](=O)[O-])c(CO)c1 ZINC000430961769 567041886 /nfs/dbraw/zinc/04/18/86/567041886.db2.gz ARTOBSPTGCGQCR-UHFFFAOYSA-N 0 0 396.193 3.215 20 5 GGBDRN O=C(CSc1nc(C(F)F)cc(=O)[nH]1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000584438824 567043564 /nfs/dbraw/zinc/04/35/64/567043564.db2.gz QLFBYDJVIFOLLA-UHFFFAOYSA-N 0 0 390.755 3.412 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@H]1SCCc2ccccc21 ZINC000545365761 567043940 /nfs/dbraw/zinc/04/39/40/567043940.db2.gz DCUAVJUNZSIGNB-QGZVFWFLSA-N 0 0 378.475 3.045 20 5 GGBDRN 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Cc1cc(OC[C@H](O)COc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000565553635 567077950 /nfs/dbraw/zinc/07/79/50/567077950.db2.gz LXNFTDZWRUYJRF-CYBMUJFWSA-N 0 0 382.210 3.484 20 5 GGBDRN NS(=O)(=O)c1c(NCc2c(Cl)cccc2Cl)cccc1[N+](=O)[O-] ZINC000521762887 567077913 /nfs/dbraw/zinc/07/79/13/567077913.db2.gz IMVKTVHEUFMEOS-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN COc1ccc(Br)cc1Sc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000565571186 567079819 /nfs/dbraw/zinc/07/98/19/567079819.db2.gz KMDUKSLVKUKJKK-UHFFFAOYSA-N 0 0 384.211 3.011 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1c(Cl)cccc1Cl ZINC000521774236 567079835 /nfs/dbraw/zinc/07/98/35/567079835.db2.gz UZACFPMTZAHSLW-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc([C@H](C)c2ccc(Br)cc2)no1 ZINC000545834156 567080161 /nfs/dbraw/zinc/08/01/61/567080161.db2.gz MUJFAZQQAHONDW-SECBINFHSA-N 0 0 392.213 3.445 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC(c2cn[nH]c2)CC1 ZINC000585699366 567080323 /nfs/dbraw/zinc/08/03/23/567080323.db2.gz 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CSc1ccc(C(=O)NCc2ccc(C[S@@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000588088324 567114355 /nfs/dbraw/zinc/11/43/55/567114355.db2.gz ZLGSJLAHFSCPAN-RUZDIDTESA-N 0 0 378.475 3.125 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O ZINC000473914233 567114446 /nfs/dbraw/zinc/11/44/46/567114446.db2.gz HVOFNDPNHIGQIC-NSHDSACASA-N 0 0 384.223 3.243 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1Oc1ccc(Oc2ncc(Br)cn2)cc1 ZINC000473908641 567114491 /nfs/dbraw/zinc/11/44/91/567114491.db2.gz GODKHXQHURCKIW-UHFFFAOYSA-N 0 0 392.169 3.465 20 5 GGBDRN COc1cc(CS(=O)(=O)c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000588107857 567114611 /nfs/dbraw/zinc/11/46/11/567114611.db2.gz PABKDYBANNLPEF-UHFFFAOYSA-N 0 0 386.223 3.340 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)CCOc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000522413294 567115165 /nfs/dbraw/zinc/11/51/65/567115165.db2.gz IECHPGSUZVCWCV-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN COc1ccc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000431918096 567116730 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CC[C@H]1CCC[C@H]1CNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000453887413 567124705 /nfs/dbraw/zinc/12/47/05/567124705.db2.gz XCSFHGJCBMJRFB-QWRGUYRKSA-N 0 0 398.257 3.238 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1Nc1cccc(Oc2ncc(Br)cn2)c1 ZINC000432034885 567125858 /nfs/dbraw/zinc/12/58/58/567125858.db2.gz CHAINHVFLGISRU-UHFFFAOYSA-N 0 0 391.185 3.417 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1Cc1nc(Cc2cc(Cl)ccc2Cl)no1 ZINC000546434041 567127474 /nfs/dbraw/zinc/12/74/74/567127474.db2.gz MZFCYDSNGJJKDL-UHFFFAOYSA-N 0 0 381.175 3.085 20 5 GGBDRN C[C@@H](c1cnn(C)c1)c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000546445350 567128983 /nfs/dbraw/zinc/12/89/83/567128983.db2.gz NEZXWEWKMPWPGR-VIFPVBQESA-N 0 0 392.213 3.216 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(COC[C@H]3CCCO3)n2)c(Br)c1 ZINC000546449924 567129043 /nfs/dbraw/zinc/12/90/43/567129043.db2.gz VNIJLJTVOABMDR-GFCCVEGCSA-N 0 0 398.213 3.027 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC(OC[C@H]2CCOC2)CC1 ZINC000566139763 567129652 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O=[N+]([O-])c1cccc(Cl)c1NCc1cccc(N2CCCS2(=O)=O)c1 ZINC000432131244 567133174 /nfs/dbraw/zinc/13/31/74/567133174.db2.gz WPGOWUUNZLBWEX-UHFFFAOYSA-N 0 0 381.841 3.400 20 5 GGBDRN CO[C@@H](c1noc(-c2ccc([N+](=O)[O-])[nH]2)n1)c1ccc(Br)cc1 ZINC000546520760 567133663 /nfs/dbraw/zinc/13/36/63/567133663.db2.gz CWNXZGRSZPHSBP-GFCCVEGCSA-N 0 0 379.170 3.471 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000432136553 567134337 /nfs/dbraw/zinc/13/43/37/567134337.db2.gz AOEQTJUXLIJTPP-UHFFFAOYSA-N 0 0 393.778 3.445 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCc1csc(C(C)(C)C)n1 ZINC000497938726 567134250 /nfs/dbraw/zinc/13/42/50/567134250.db2.gz MVJUIMSMDJQRBH-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN CN(CCn1cc(Br)cn1)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432149315 567134407 /nfs/dbraw/zinc/13/44/07/567134407.db2.gz UIWHYUASGMZXQE-UHFFFAOYSA-N 0 0 376.214 3.238 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 ZINC000432169818 567135041 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GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCN(C)c2ccc(Cl)cc21 ZINC000474192272 567145357 /nfs/dbraw/zinc/14/53/57/567145357.db2.gz SZUASJPUNFDGAB-UHFFFAOYSA-N 0 0 381.841 3.202 20 5 GGBDRN C[C@](O)(C1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000546635945 567147127 /nfs/dbraw/zinc/14/71/27/567147127.db2.gz XEHKZBQLKDNCJH-LBPRGKRZSA-N 0 0 398.179 3.282 20 5 GGBDRN CC[C@]1(C(C)C)C[C@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000454141717 567147811 /nfs/dbraw/zinc/14/78/11/567147811.db2.gz LTUCVKVKUGYBCI-CZUORRHYSA-N 0 0 398.257 3.237 20 5 GGBDRN Cc1ccc(I)cc1C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000588984072 567148699 /nfs/dbraw/zinc/14/86/99/567148699.db2.gz KWMPUWSGFBIZMX-UHFFFAOYSA-N 0 0 397.172 3.179 20 5 GGBDRN C[C@@](O)(C1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000546664155 567148715 /nfs/dbraw/zinc/14/87/15/567148715.db2.gz MEMSIIGVUAOPKI-CQSZACIVSA-N 0 0 380.750 3.414 20 5 GGBDRN COc1cccc2c1CCCN2S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000432307081 567148826 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O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2COc3ccc(Cl)cc32)c(Cl)c1 ZINC000474300670 567157317 /nfs/dbraw/zinc/15/73/17/567157317.db2.gz DVTKMJGJNGBAQH-GFCCVEGCSA-N 0 0 389.216 3.314 20 5 GGBDRN O=C(NCCOc1ccccc1F)c1ccc([N+](=O)[O-])cc1Br ZINC000523498441 567159178 /nfs/dbraw/zinc/15/91/78/567159178.db2.gz IFRUGDLJMQOAOL-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN C[C@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)S(=O)(=O)c1ccc(F)cc1 ZINC000589147115 567160246 /nfs/dbraw/zinc/16/02/46/567160246.db2.gz RUZJUNGQMZAIMQ-MRVPVSSYSA-N 0 0 383.382 3.380 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1C[C@@H](CO)c2ccccc21 ZINC000498242986 567161671 /nfs/dbraw/zinc/16/16/71/567161671.db2.gz NDVRWNJZOBHWOC-LBPRGKRZSA-N 0 0 391.221 3.023 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cc(Cl)c1=O)Nc1cccc(C(F)(F)F)c1 ZINC000474362455 567162707 /nfs/dbraw/zinc/16/27/07/567162707.db2.gz JHCQISJGMDHCDP-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN CC[C@H](Cc1ccccc1Br)NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000546853959 567164605 /nfs/dbraw/zinc/16/46/05/567164605.db2.gz KKYAWEXNQDVQFY-LLVKDONJSA-N 0 0 393.241 3.086 20 5 GGBDRN NC(=O)c1ccc(CSCc2ncc(Br)s2)c([N+](=O)[O-])c1 ZINC000432518682 567165632 /nfs/dbraw/zinc/16/56/32/567165632.db2.gz KOEMSPGKGCNLBA-UHFFFAOYSA-N 0 0 388.268 3.346 20 5 GGBDRN Cc1cc(=O)n(Cc2nnc(-c3c(Cl)cccc3Cl)o2)cc1[N+](=O)[O-] ZINC000474390353 567167056 /nfs/dbraw/zinc/16/70/56/567167056.db2.gz JXIIRBRCJJNKMP-UHFFFAOYSA-N 0 0 381.175 3.470 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NC2(c3ccc(Br)cc3)CC2)c1 ZINC000546879139 567168624 /nfs/dbraw/zinc/16/86/24/567168624.db2.gz JVFSBZDYJOOSPL-UHFFFAOYSA-N 0 0 397.250 3.325 20 5 GGBDRN Cc1cnn(CCc2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)c1 ZINC000566594003 567169471 /nfs/dbraw/zinc/16/94/71/567169471.db2.gz RENYVRUOKFPTSM-UHFFFAOYSA-N 0 0 392.213 3.079 20 5 GGBDRN CNc1ccc(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)cc1[N+](=O)[O-] ZINC000523749136 567171624 /nfs/dbraw/zinc/17/16/24/567171624.db2.gz MTORPHLVURPPKP-RUZDIDTESA-N 0 0 381.841 3.421 20 5 GGBDRN O=c1[nH]cc(-c2nc(Cc3ccccc3[N+](=O)[O-])no2)cc1Br ZINC000546948124 567173583 /nfs/dbraw/zinc/17/35/83/567173583.db2.gz FGOWCULRCMAYKQ-UHFFFAOYSA-N 0 0 377.154 3.099 20 5 GGBDRN Cc1nn(C)c(-c2nc(-c3ccc(Br)c(C)c3)no2)c1[N+](=O)[O-] ZINC000546945571 567173879 /nfs/dbraw/zinc/17/38/79/567173879.db2.gz WKRCXANFWYZMPI-UHFFFAOYSA-N 0 0 378.186 3.425 20 5 GGBDRN COc1ccc(NCc2cc(I)cc([N+](=O)[O-])c2)cn1 ZINC000589315685 567174681 /nfs/dbraw/zinc/17/46/81/567174681.db2.gz SXPWVBXBZRUOTP-UHFFFAOYSA-N 0 0 385.161 3.215 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CNc2ccccc2CO)c1 ZINC000589315619 567175093 /nfs/dbraw/zinc/17/50/93/567175093.db2.gz FIODKVIZXJWJKT-UHFFFAOYSA-N 0 0 384.173 3.304 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCc1cn2ccsc2n1 ZINC000523979931 567178648 /nfs/dbraw/zinc/17/86/48/567178648.db2.gz VRDNUWJZZZDQLO-UHFFFAOYSA-N 0 0 380.813 3.043 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2nc3ccsc3s2)c([N+](=O)[O-])c1 ZINC000524003992 567180023 /nfs/dbraw/zinc/18/00/23/567180023.db2.gz RCHWBPJNSAUAEL-UHFFFAOYSA-N 0 0 394.459 3.096 20 5 GGBDRN O=C(NCc1ccc2c(c1)COC2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000432715356 567182116 /nfs/dbraw/zinc/18/21/16/567182116.db2.gz GIQFZIHJAIGHMV-UHFFFAOYSA-N 0 0 377.194 3.318 20 5 GGBDRN C[C@@H](C[C@@H]1CCOC1)Nc1ccc(I)cc1[N+](=O)[O-] ZINC000589585508 567184639 /nfs/dbraw/zinc/18/46/39/567184639.db2.gz ZKKLMVDACVPFHR-UWVGGRQHSA-N 0 0 376.194 3.426 20 5 GGBDRN O=C(c1ccsc1)N1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000524161713 567184765 /nfs/dbraw/zinc/18/47/65/567184765.db2.gz NZGDFLRMEWNGAN-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN Cc1c(Br)c(N2CC[C@H](n3cc(Cl)cn3)C2)ncc1[N+](=O)[O-] ZINC000589608909 567186276 /nfs/dbraw/zinc/18/62/76/567186276.db2.gz MHFXUXUATOESBE-JTQLQIEISA-N 0 0 386.637 3.362 20 5 GGBDRN Cc1cc(-c2nc(Cc3cc(Br)c[nH]c3=O)no2)ccc1[N+](=O)[O-] ZINC000547177391 567188250 /nfs/dbraw/zinc/18/82/50/567188250.db2.gz VQEGBBSGLSWOLJ-UHFFFAOYSA-N 0 0 391.181 3.407 20 5 GGBDRN O=[N+]([O-])c1ccsc1N1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000615528025 567189181 /nfs/dbraw/zinc/18/91/81/567189181.db2.gz FBZKVQUYFRSVIW-UHFFFAOYSA-N 0 0 379.389 3.243 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(Cc3ccc(Br)c(F)c3)n2)nc1 ZINC000547194659 567189437 /nfs/dbraw/zinc/18/94/37/567189437.db2.gz OSJVITCYSBAVIE-UHFFFAOYSA-N 0 0 393.172 3.456 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(Cc3ccc(Br)cc3)n2)nc1 ZINC000547195180 567189476 /nfs/dbraw/zinc/18/94/76/567189476.db2.gz SEPFGJQVNYYGNK-UHFFFAOYSA-N 0 0 375.182 3.317 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1-c1nc(CCCc2ccccc2Br)no1 ZINC000547192262 567189984 /nfs/dbraw/zinc/18/99/84/567189984.db2.gz RQEZGXMCBZDUOY-UHFFFAOYSA-N 0 0 392.213 3.316 20 5 GGBDRN CO[C@@H](c1noc(-c2cc([N+](=O)[O-])c[nH]2)n1)c1ccc(Br)cc1 ZINC000547223006 567191466 /nfs/dbraw/zinc/19/14/66/567191466.db2.gz MHOJCWQFCHPVJI-GFCCVEGCSA-N 0 0 379.170 3.471 20 5 GGBDRN O=C(Nc1ccnn1Cc1ccc(Br)cc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000524299257 567192246 /nfs/dbraw/zinc/19/22/46/567192246.db2.gz XOPKWFOAUYBSQM-UHFFFAOYSA-N 0 0 390.197 3.183 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000524337244 567194321 /nfs/dbraw/zinc/19/43/21/567194321.db2.gz UFNKGQFXCKXTHQ-UHFFFAOYSA-N 0 0 394.225 3.365 20 5 GGBDRN CN(C[C@@H]1COc2ccccc2O1)c1ncc(Br)cc1[N+](=O)[O-] ZINC000474789422 567198811 /nfs/dbraw/zinc/19/88/11/567198811.db2.gz JWISNGALIUZFOA-LLVKDONJSA-N 0 0 380.198 3.029 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CCC(C2CC2)CC1 ZINC000589925571 567199316 /nfs/dbraw/zinc/19/93/16/567199316.db2.gz VQYLXFMTKLDRHD-UHFFFAOYSA-N 0 0 389.271 3.168 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCC(C3CC3)CC2)c1 ZINC000589925271 567199682 /nfs/dbraw/zinc/19/96/82/567199682.db2.gz IUTZWIDIASVGEG-UHFFFAOYSA-N 0 0 389.271 3.168 20 5 GGBDRN Cc1nn(C(C)C)c(C)c1S(=O)(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000547343042 567203205 /nfs/dbraw/zinc/20/32/05/567203205.db2.gz YGXJQWGHQRAYFG-UHFFFAOYSA-N 0 0 386.861 3.121 20 5 GGBDRN CC1(C)CCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000524576487 567203839 /nfs/dbraw/zinc/20/38/39/567203839.db2.gz MLEXRAKOKUQEEX-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN O=C(Nc1ccn(-c2ccc(Br)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000498880590 567207905 /nfs/dbraw/zinc/20/79/05/567207905.db2.gz NNRCTDUVKNZRQL-UHFFFAOYSA-N 0 0 387.193 3.217 20 5 GGBDRN COc1c(C(=O)NCCNc2ncc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000474914758 567209458 /nfs/dbraw/zinc/20/94/58/567209458.db2.gz RAMICJGEGWTHEN-UHFFFAOYSA-N 0 0 385.207 3.147 20 5 GGBDRN COC(=O)c1csc(Sc2ncc(Br)cc2[N+](=O)[O-])n1 ZINC000590146769 567212012 /nfs/dbraw/zinc/21/20/12/567212012.db2.gz CGOSBYANGNVVLD-UHFFFAOYSA-N 0 0 376.213 3.147 20 5 GGBDRN Cc1cc(N2CCC(C)(C)S(=O)(=O)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590138839 567212124 /nfs/dbraw/zinc/21/21/24/567212124.db2.gz NYSPHANZOKLTIK-UHFFFAOYSA-N 0 0 380.388 3.326 20 5 GGBDRN O=C1NCCN(Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(Br)c1 ZINC000498923628 567212995 /nfs/dbraw/zinc/21/29/95/567212995.db2.gz QKFHNWQSKCQONL-MRXNPFEDSA-N 0 0 390.237 3.030 20 5 GGBDRN C[C@@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)c(Br)c1 ZINC000590193337 567213279 /nfs/dbraw/zinc/21/32/79/567213279.db2.gz MYGUHJPDWYVBAX-SECBINFHSA-N 0 0 396.216 3.446 20 5 GGBDRN C[C@H](NC(=O)N[C@@H](C)c1ncc(Br)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000455001627 567221293 /nfs/dbraw/zinc/22/12/93/567221293.db2.gz QTYVTEUYPQTUNE-UWVGGRQHSA-N 0 0 394.229 3.269 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@@H](Oc2cncc(Br)c2)C1 ZINC000590389456 567222152 /nfs/dbraw/zinc/22/21/52/567222152.db2.gz JBCTYKJARPYNHI-CQSZACIVSA-N 0 0 392.209 3.046 20 5 GGBDRN CC(C)[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccnn1C ZINC000616014662 567222507 /nfs/dbraw/zinc/22/25/07/567222507.db2.gz ZKYMTJGGYRAZIU-ZDUSSCGKSA-N 0 0 395.257 3.260 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1C[C@H](CO)Cc2ccccc21 ZINC000590406263 567223808 /nfs/dbraw/zinc/22/38/08/567223808.db2.gz KUWLXXRFTPOQNB-LLVKDONJSA-N 0 0 391.221 3.169 20 5 GGBDRN Cc1cc(N[C@@H]2CCCc3c2cnn3CCO)c(Br)cc1[N+](=O)[O-] ZINC000616055636 567224222 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O=C(Nc1nc2c(cccc2Br)s1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000568684851 567347793 /nfs/dbraw/zinc/34/77/93/567347793.db2.gz RZRNPRQASXFLMX-UHFFFAOYSA-N 0 0 395.194 3.320 20 5 GGBDRN COC(=O)[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1cccc(Br)c1 ZINC000500831548 567347697 /nfs/dbraw/zinc/34/76/97/567347697.db2.gz UZFJKQDRXYUGPY-INIZCTEOSA-N 0 0 393.237 3.404 20 5 GGBDRN C[C@@H](CC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)n1cc(Br)cn1 ZINC000592582218 567347960 /nfs/dbraw/zinc/34/79/60/567347960.db2.gz MHLGFFUQHGINRL-QWRGUYRKSA-N 0 0 381.230 3.382 20 5 GGBDRN C[C@@H](CC(=O)N1CCCc2ccc([N+](=O)[O-])cc21)n1cc(Br)cn1 ZINC000592593512 567348365 /nfs/dbraw/zinc/34/83/65/567348365.db2.gz RBIWVHBVEWJUAH-NSHDSACASA-N 0 0 393.241 3.484 20 5 GGBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)c1csc(S(C)(=O)=O)c1 ZINC000456186136 567348868 /nfs/dbraw/zinc/34/88/68/567348868.db2.gz LAYQYQPYPWFPED-UHFFFAOYSA-N 0 0 383.451 3.132 20 5 GGBDRN COC(=O)[C@H](NCCc1ccccc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000500846225 567349095 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20 5 GGBDRN C[C@H](CC(=O)N(C)CCc1ccccc1[N+](=O)[O-])n1cc(Br)cn1 ZINC000592629451 567351876 /nfs/dbraw/zinc/35/18/76/567351876.db2.gz NWZPVVISOMYOQV-GFCCVEGCSA-N 0 0 395.257 3.206 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ncc(Br)s1 ZINC000618020065 567352290 /nfs/dbraw/zinc/35/22/90/567352290.db2.gz KVMVRRSHFADGOU-UHFFFAOYSA-N 0 0 390.646 3.440 20 5 GGBDRN CCc1noc(C)c1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000500926358 567353219 /nfs/dbraw/zinc/35/32/19/567353219.db2.gz PFOUKVWCWYIBJU-UHFFFAOYSA-N 0 0 382.214 3.075 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC([C@H](O)C(F)(F)F)CC1 ZINC000568743202 567353649 /nfs/dbraw/zinc/35/36/49/567353649.db2.gz AJGNJJVGCSCJKJ-ZDUSSCGKSA-N 0 0 397.191 3.493 20 5 GGBDRN O=C1N[C@H](c2ccc(Br)cc2)C(=O)N1Cc1cccc([N+](=O)[O-])c1 ZINC000548825491 567354287 /nfs/dbraw/zinc/35/42/87/567354287.db2.gz XRZSJCBOQGDOGL-CQSZACIVSA-N 0 0 390.193 3.150 20 5 GGBDRN Cc1c(NC(=O)N2CCC[C@@H](C)[C@H]2CO)cc(Br)cc1[N+](=O)[O-] ZINC000435322226 567354709 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C[C@@H]1CC2(CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br)CCOCC2 ZINC000592718445 567357145 /nfs/dbraw/zinc/35/71/45/567357145.db2.gz ALPUVGXWFGMHMQ-GFCCVEGCSA-N 0 0 397.269 3.317 20 5 GGBDRN C[C@H]1CC2(CN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1)CCOCC2 ZINC000592721364 567358500 /nfs/dbraw/zinc/35/85/00/567358500.db2.gz QHBBMZMPRVWGPT-NSHDSACASA-N 0 0 383.242 3.389 20 5 GGBDRN C[C@@H]1SCC[C@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000592737351 567359255 /nfs/dbraw/zinc/35/92/55/567359255.db2.gz WIMICLXVPMTMSK-GXSJLCMTSA-N 0 0 377.388 3.426 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc1[N+](=O)[O-] ZINC000456306794 567360726 /nfs/dbraw/zinc/36/07/26/567360726.db2.gz GNRPEQHEUGSILM-MBNYWOFBSA-N 0 0 397.269 3.289 20 5 GGBDRN O=C(CN1CCc2cc(F)ccc21)Nc1ccc([N+](=O)[O-])cc1Br ZINC000548935378 567361305 /nfs/dbraw/zinc/36/13/05/567361305.db2.gz KFQIMANRJVAHKO-UHFFFAOYSA-N 0 0 394.200 3.498 20 5 GGBDRN O=C(NCCSCc1ccc(Cl)cc1Cl)c1c[nH]nc1[N+](=O)[O-] ZINC000548952359 567363465 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391.221 3.408 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1OCc1ccc(CO)cc1 ZINC000478882031 567488295 /nfs/dbraw/zinc/48/82/95/567488295.db2.gz KGMBUNAMJCHMSX-UHFFFAOYSA-N 0 0 385.157 3.271 20 5 GGBDRN Cc1cc(NCc2nc([C@H]3CCCO3)n[nH]2)c(Br)cc1[N+](=O)[O-] ZINC000594590072 567488668 /nfs/dbraw/zinc/48/86/68/567488668.db2.gz RZXDNILPLUVGJR-GFCCVEGCSA-N 0 0 382.218 3.247 20 5 GGBDRN Cc1noc(C)c1CCOc1ccc(I)cc1[N+](=O)[O-] ZINC000478905554 567489913 /nfs/dbraw/zinc/48/99/13/567489913.db2.gz WBMQQFAKDGOMQB-UHFFFAOYSA-N 0 0 388.161 3.426 20 5 GGBDRN CC(C)(NS(=O)(=O)c1cnc2ccsc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000437316067 567491036 /nfs/dbraw/zinc/49/10/36/567491036.db2.gz ULULCIPBIWYXMR-UHFFFAOYSA-N 0 0 377.447 3.418 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000437331602 567491883 /nfs/dbraw/zinc/49/18/83/567491883.db2.gz GFTHDAYYLVIEJY-NWDGAFQWSA-N 0 0 393.241 3.490 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC1CCC2(CCOCC2)CC1 ZINC000437325404 567492651 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CCCCCN(CCCOC)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000503727184 567503423 /nfs/dbraw/zinc/50/34/23/567503423.db2.gz NEWKYCLYVFLUGL-UHFFFAOYSA-N 0 0 378.878 3.466 20 5 GGBDRN COC1(c2noc(-c3ccc(Br)cc3[N+](=O)[O-])n2)CCOCC1 ZINC000594734239 567504445 /nfs/dbraw/zinc/50/44/45/567504445.db2.gz UEJBRHVUDLWTFW-UHFFFAOYSA-N 0 0 384.186 3.059 20 5 GGBDRN C[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)[C@@H]1C ZINC000551423523 567505017 /nfs/dbraw/zinc/50/50/17/567505017.db2.gz KUXLUQLPDUHUKV-GPCCPHFNSA-N 0 0 398.257 3.237 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC(F)(F)C(F)(F)C2)cc1[N+](=O)[O-] ZINC000457933672 567505758 /nfs/dbraw/zinc/50/57/58/567505758.db2.gz QKKNJMBDSZQOGW-UHFFFAOYSA-N 0 0 385.111 3.392 20 5 GGBDRN CCSCC[C@@H](C)NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000437709042 567506621 /nfs/dbraw/zinc/50/66/21/567506621.db2.gz OCZWKLMUZWQOJF-SECBINFHSA-N 0 0 397.316 3.167 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000570723538 567507888 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CC(C)(C)[C@@H]1CCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000551476496 567510209 /nfs/dbraw/zinc/51/02/09/567510209.db2.gz XKFGJFDOUOSZNZ-SNVBAGLBSA-N 0 0 398.257 3.190 20 5 GGBDRN CS[C@H](CNS(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-])C(C)(C)C ZINC000594773310 567510867 /nfs/dbraw/zinc/51/08/67/567510867.db2.gz QIOFNBCYOMYQFR-CQSZACIVSA-N 0 0 383.495 3.199 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)C(=O)N1CCC[C@H]2CCC[C@H]21 ZINC000551496994 567511576 /nfs/dbraw/zinc/51/15/76/567511576.db2.gz UWFTYSSVVSBFCN-QMTHXVAHSA-N 0 0 396.241 3.087 20 5 GGBDRN CC(C)[C@H]1CCCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000551496330 567511911 /nfs/dbraw/zinc/51/19/11/567511911.db2.gz SSPRIYXSIQANLN-CQSZACIVSA-N 0 0 398.257 3.333 20 5 GGBDRN CCOC(=O)CCCCOc1ccc(I)cc1[N+](=O)[O-] ZINC000479178033 567512513 /nfs/dbraw/zinc/51/25/13/567512513.db2.gz GCIJXWLAIFWWSR-UHFFFAOYSA-N 0 0 393.177 3.312 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2C[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000594789420 567512976 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ZINC000571171736 567543062 /nfs/dbraw/zinc/54/30/62/567543062.db2.gz VTIOOTIMBYGIEY-LLVKDONJSA-N 0 0 379.136 3.474 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N(CCO)c1ccccc1 ZINC000438783189 567545092 /nfs/dbraw/zinc/54/50/92/567545092.db2.gz CCPOSAGKSXDXIR-UHFFFAOYSA-N 0 0 391.232 3.089 20 5 GGBDRN COc1ccc(N(C)C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cn1 ZINC000571228795 567546048 /nfs/dbraw/zinc/54/60/48/567546048.db2.gz IALWGKAWTNTJFI-UHFFFAOYSA-N 0 0 380.198 3.346 20 5 GGBDRN Cc1noc(CN2CCO[C@@H](c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000595295458 567551204 /nfs/dbraw/zinc/55/12/04/567551204.db2.gz YWPJMSYQJJTMGQ-CYBMUJFWSA-N 0 0 382.214 3.227 20 5 GGBDRN Cc1nnsc1CNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000571310579 567553561 /nfs/dbraw/zinc/55/35/61/567553561.db2.gz XLIBCDLIVJOOPD-UHFFFAOYSA-N 0 0 392.384 3.182 20 5 GGBDRN COC[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])C[C@H](C)O1 ZINC000438897402 567553618 /nfs/dbraw/zinc/55/36/18/567553618.db2.gz VOOPLESZHRIJAJ-JQWIXIFHSA-N 0 0 396.241 3.146 20 5 GGBDRN Cc1ccc(Br)cc1CNC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000438914179 567553662 /nfs/dbraw/zinc/55/36/62/567553662.db2.gz DVXIITSXDMNTHZ-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN Cc1ccc(Br)cc1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000438924205 567555197 /nfs/dbraw/zinc/55/51/97/567555197.db2.gz WKPOTWYHABRQLV-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN CC[C@@H](Cc1ccccc1Br)N(C)C(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000479767910 567557104 /nfs/dbraw/zinc/55/71/04/567557104.db2.gz CEBXNIJHGNQTLB-LBPRGKRZSA-N 0 0 395.257 3.482 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CC[C@@H](Oc2ccccc2)C1 ZINC000595363489 567558952 /nfs/dbraw/zinc/55/89/52/567558952.db2.gz DLFMWYUKXHAMPJ-CQSZACIVSA-N 0 0 382.825 3.090 20 5 GGBDRN CSc1ccc(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000552108798 567559072 /nfs/dbraw/zinc/55/90/72/567559072.db2.gz XJOCABQXEPBLNS-LLVKDONJSA-N 0 0 377.388 3.073 20 5 GGBDRN CO[C@@H](C)CCNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000571426607 567562433 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COCC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000479916595 567568712 /nfs/dbraw/zinc/56/87/12/567568712.db2.gz LYDJDKKKJAZEKG-GFCCVEGCSA-N 0 0 388.829 3.206 20 5 GGBDRN COCCC(=O)N1CCC(Nc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000439160767 567569143 /nfs/dbraw/zinc/56/91/43/567569143.db2.gz AFDMSGBVXZEJSL-UHFFFAOYSA-N 0 0 376.240 3.341 20 5 GGBDRN CC[C@H]1CCCN1S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000439219918 567571884 /nfs/dbraw/zinc/57/18/84/567571884.db2.gz BMHFQDRQUXTSKP-JTQLQIEISA-N 0 0 377.260 3.229 20 5 GGBDRN O=C(c1cccc(F)c1Br)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000505375911 567572415 /nfs/dbraw/zinc/57/24/15/567572415.db2.gz WQNIYVGEUDQBMT-UHFFFAOYSA-N 0 0 395.184 3.400 20 5 GGBDRN CO[C@H](c1ccccc1Cl)[C@@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000479986189 567573212 /nfs/dbraw/zinc/57/32/12/567573212.db2.gz BTQRYINNFZQBNJ-BZNIZROVSA-N 0 0 384.841 3.303 20 5 GGBDRN CC[C@H](C)[C@H](C)NS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000439230346 567573318 /nfs/dbraw/zinc/57/33/18/567573318.db2.gz BADLPQAHGVOADI-WPRPVWTQSA-N 0 0 379.276 3.379 20 5 GGBDRN CC[C@@H](C)[C@H](C)NS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000439230344 567573341 /nfs/dbraw/zinc/57/33/41/567573341.db2.gz BADLPQAHGVOADI-SCZZXKLOSA-N 0 0 379.276 3.379 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CCNS(=O)(=O)c1cc(F)c(F)c(F)c1 ZINC000479988461 567573595 /nfs/dbraw/zinc/57/35/95/567573595.db2.gz DEIGDUHOUQUEFE-UHFFFAOYSA-N 0 0 394.758 3.187 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N[C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000439222756 567573701 /nfs/dbraw/zinc/57/37/01/567573701.db2.gz LFNIVAVWVUWRKU-JTQLQIEISA-N 0 0 375.244 3.053 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCC[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000439226477 567573843 /nfs/dbraw/zinc/57/38/43/567573843.db2.gz UULNRZVNANIDPC-JTQLQIEISA-N 0 0 391.287 3.476 20 5 GGBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000505419950 567573991 /nfs/dbraw/zinc/57/39/91/567573991.db2.gz KBHKRISPACGEQJ-QMMMGPOBSA-N 0 0 382.214 3.496 20 5 GGBDRN CC[C@H]1CCCN(S(=O)(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000439245531 567575752 /nfs/dbraw/zinc/57/57/52/567575752.db2.gz KWXPNGDUYGOTGC-NSHDSACASA-N 0 0 391.287 3.476 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)NC(C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000439249476 567575985 /nfs/dbraw/zinc/57/59/85/567575985.db2.gz TWKOFRUQPBCFEB-UHFFFAOYSA-N 0 0 389.271 3.133 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N(C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000439251329 567576002 /nfs/dbraw/zinc/57/60/02/567576002.db2.gz WOESNUANHXVYCM-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C2(CCCCC2)C1 ZINC000480039166 567577316 /nfs/dbraw/zinc/57/73/16/567577316.db2.gz GEKGCGNZJDISGQ-UHFFFAOYSA-N 0 0 396.285 3.448 20 5 GGBDRN C[C@@H]1CSC[C@@H]1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000552322879 567577982 /nfs/dbraw/zinc/57/79/82/567577982.db2.gz COENNWCHNZHYDC-SKDRFNHKSA-N 0 0 377.388 3.283 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)NC[C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000439255667 567578029 /nfs/dbraw/zinc/57/80/29/567578029.db2.gz XJENPPGANWQRFW-LLVKDONJSA-N 0 0 389.271 3.300 20 5 GGBDRN Cc1noc(CN2CCOC[C@H]2c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000595750557 567580130 /nfs/dbraw/zinc/58/01/30/567580130.db2.gz UNKGMPZCCLEOBV-ZDUSSCGKSA-N 0 0 382.214 3.227 20 5 GGBDRN O=c1c2cccc(Br)c2ncn1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000505513243 567580341 /nfs/dbraw/zinc/58/03/41/567580341.db2.gz MSMCZAAEXXRNKY-UHFFFAOYSA-N 0 0 396.147 3.394 20 5 GGBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2cc(O)ccc2Br)CC1 ZINC000505585121 567585328 /nfs/dbraw/zinc/58/53/28/567585328.db2.gz LINMBAWAUDFILA-UHFFFAOYSA-N 0 0 392.253 3.385 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)Nc2cc3c(cc2Cl)OCO3)c1[N+](=O)[O-] ZINC000480193609 567587542 /nfs/dbraw/zinc/58/75/42/567587542.db2.gz LJKHSZCELRLSFS-UHFFFAOYSA-N 0 0 384.797 3.395 20 5 GGBDRN COCC[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccco1 ZINC000505627178 567588672 /nfs/dbraw/zinc/58/86/72/567588672.db2.gz BVNCHFFPGKFTII-ZDUSSCGKSA-N 0 0 383.198 3.458 20 5 GGBDRN CC1(C)C(NC(=O)c2ccc([N+](=O)[O-])cc2I)C1(C)C ZINC000480211977 567588778 /nfs/dbraw/zinc/58/87/78/567588778.db2.gz ZBWSHMMKNJUDAJ-UHFFFAOYSA-N 0 0 388.205 3.364 20 5 GGBDRN CN(C[C@@H]1C[C@H](F)CN1Cc1nccs1)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000480213022 567589257 /nfs/dbraw/zinc/58/92/57/567589257.db2.gz IYQLTRQBIAVMFT-RYUDHWBXSA-N 0 0 385.852 3.149 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000552431160 567589811 /nfs/dbraw/zinc/58/98/11/567589811.db2.gz WVZHVYGJQUAJDB-GFCCVEGCSA-N 0 0 383.177 3.197 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H](CO)c1ccc(Cl)cc1 ZINC000552430294 567590302 /nfs/dbraw/zinc/59/03/02/567590302.db2.gz YXFOGHYHMANXBQ-OAHLLOKOSA-N 0 0 383.231 3.336 20 5 GGBDRN C[C@@H](C(=O)Nc1cc(Cl)ccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000530298925 567590801 /nfs/dbraw/zinc/59/08/01/567590801.db2.gz CLOAVIQNNXBOOO-VIFPVBQESA-N 0 0 386.788 3.188 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000530304003 567590946 /nfs/dbraw/zinc/59/09/46/567590946.db2.gz VYLFRMLGUXJFJF-SNVBAGLBSA-N 0 0 394.225 3.181 20 5 GGBDRN COc1ccc(Br)cc1CS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000480296678 567594395 /nfs/dbraw/zinc/59/43/95/567594395.db2.gz SIXXUGBNUJYKIT-UHFFFAOYSA-N 0 0 386.223 3.340 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000439609898 567595465 /nfs/dbraw/zinc/59/54/65/567595465.db2.gz CKGVIHQKDUDHOF-ZJUUUORDSA-N 0 0 381.376 3.023 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2c(F)cccc2Br)cc1 ZINC000439618538 567596059 /nfs/dbraw/zinc/59/60/59/567596059.db2.gz PFYRGPUNGZNETN-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN C[C@H](CNc1c2cc(Br)ccc2ncc1[N+](=O)[O-])Cn1cccn1 ZINC000480374076 567600205 /nfs/dbraw/zinc/60/02/05/567600205.db2.gz GHCOURTYNHSCFW-LLVKDONJSA-N 0 0 390.241 3.272 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c(Cl)c1 ZINC000571954292 567600518 /nfs/dbraw/zinc/60/05/18/567600518.db2.gz OUZYSWIGDHDNRP-UHFFFAOYSA-N 0 0 382.825 3.004 20 5 GGBDRN Cc1noc(CS(=O)(=O)Cc2cccc(Br)c2C)c1[N+](=O)[O-] ZINC000596037766 567601899 /nfs/dbraw/zinc/60/18/99/567601899.db2.gz FQZCTEFIWSIRJC-UHFFFAOYSA-N 0 0 389.227 3.077 20 5 GGBDRN Cc1noc(CS(=O)(=O)[C@@H](C)c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000596038157 567601903 /nfs/dbraw/zinc/60/19/03/567601903.db2.gz MLVJVZNDBXIFBT-VIFPVBQESA-N 0 0 389.227 3.330 20 5 GGBDRN Cc1cc(Sc2ccc(S(=O)(=O)N3CCCC3)cn2)c([N+](=O)[O-])s1 ZINC000596060607 567605015 /nfs/dbraw/zinc/60/50/15/567605015.db2.gz CBOWYWKWFBIYEO-UHFFFAOYSA-N 0 0 385.492 3.295 20 5 GGBDRN CSc1nnc(CCCNc2c(Cl)cncc2[N+](=O)[O-])n1CC(C)C ZINC000596060760 567605349 /nfs/dbraw/zinc/60/53/49/567605349.db2.gz GOVNFDTUTIVUKS-UHFFFAOYSA-N 0 0 384.893 3.079 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2cnn(S(=O)(=O)c3cc(Cl)ccc3F)c2)c1 ZINC000572017890 567606473 /nfs/dbraw/zinc/60/64/73/567606473.db2.gz UVUPUSQNRPTROS-UHFFFAOYSA-N 0 0 381.772 3.488 20 5 GGBDRN Cc1cnc(-c2noc(-c3cc([N+](=O)[O-])cc(Br)c3C)n2)nc1 ZINC000572022384 567606576 /nfs/dbraw/zinc/60/65/76/567606576.db2.gz YLRWOYHUBCYENB-UHFFFAOYSA-N 0 0 376.170 3.481 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(c2cccc(O)c2)CC1 ZINC000596062705 567606813 /nfs/dbraw/zinc/60/68/13/567606813.db2.gz YYJXWNZMNIUMLS-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1NCc1ccnc(N2CCOCC2)c1 ZINC000596076452 567607099 /nfs/dbraw/zinc/60/70/99/567607099.db2.gz QWNKRRPPRIRXSO-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(Cc2ccccn2)CC1 ZINC000596062663 567607167 /nfs/dbraw/zinc/60/71/67/567607167.db2.gz YKGWXPYPBDSPDR-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN Cc1noc(C)c1CN1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596079224 567607286 /nfs/dbraw/zinc/60/72/86/567607286.db2.gz MMKCORLVQLEDFQ-UHFFFAOYSA-N 0 0 395.257 3.284 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000530501531 567607380 /nfs/dbraw/zinc/60/73/80/567607380.db2.gz NKEHWHYOYDISCU-LLVKDONJSA-N 0 0 383.235 3.249 20 5 GGBDRN O=c1[nH]ccc(N2CCO[C@@H](c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000596091208 567608136 /nfs/dbraw/zinc/60/81/36/567608136.db2.gz YHYTXJKZWYNXNH-CYBMUJFWSA-N 0 0 380.198 3.036 20 5 GGBDRN O=C(c1ccsc1)N1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596084997 567608725 /nfs/dbraw/zinc/60/87/25/567608725.db2.gz FRVUYKFRRCVILD-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN Cc1n[nH]c(C(=O)NCc2cnc(-c3ccc(Cl)cc3)s2)c1[N+](=O)[O-] ZINC000552786293 567609569 /nfs/dbraw/zinc/60/95/69/567609569.db2.gz WHECKWFPSZXATO-UHFFFAOYSA-N 0 0 377.813 3.333 20 5 GGBDRN Cc1ccc(Br)cc1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000439957523 567609911 /nfs/dbraw/zinc/60/99/11/567609911.db2.gz LGYJEGPWHGXAEY-UHFFFAOYSA-N 0 0 382.189 3.317 20 5 GGBDRN C[C@H]1CN(c2ccc(I)cc2[N+](=O)[O-])C[C@H](C2CC2)O1 ZINC000530531590 567610328 /nfs/dbraw/zinc/61/03/28/567610328.db2.gz ATXROEDTMKOZOR-LKFCYVNXSA-N 0 0 388.205 3.203 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(c1c(Br)cccc1[N+](=O)[O-])CC2 ZINC000596146156 567611045 /nfs/dbraw/zinc/61/10/45/567611045.db2.gz RBVQMXMXYSMXSV-ZIAGYGMSSA-N 0 0 385.258 3.114 20 5 GGBDRN CCO[C@@H](C)c1noc(CN(C)c2c(Br)cccc2[N+](=O)[O-])n1 ZINC000596139854 567611086 /nfs/dbraw/zinc/61/10/86/567611086.db2.gz WBYVMLPQSJZHAC-VIFPVBQESA-N 0 0 385.218 3.474 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1-c1nc(-c2cocn2)no1 ZINC000572078603 567611560 /nfs/dbraw/zinc/61/15/60/567611560.db2.gz OXXVZHUUCGQRGO-UHFFFAOYSA-N 0 0 398.116 3.213 20 5 GGBDRN Cc1nsc(N2CCCN(c3c(Br)cccc3[N+](=O)[O-])CC2)n1 ZINC000596142598 567611611 /nfs/dbraw/zinc/61/16/11/567611611.db2.gz RNBLCCRLDDKGMR-UHFFFAOYSA-N 0 0 398.286 3.234 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(c1c(Br)cccc1[N+](=O)[O-])CC2 ZINC000596146154 567611866 /nfs/dbraw/zinc/61/18/66/567611866.db2.gz RBVQMXMXYSMXSV-KGLIPLIRSA-N 0 0 385.258 3.114 20 5 GGBDRN CNc1c(C(=O)NCc2cc(Br)ccc2F)cccc1[N+](=O)[O-] ZINC000506133799 567612057 /nfs/dbraw/zinc/61/20/57/567612057.db2.gz BBMDFBIPURNQFC-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN CCOC(=O)c1cccc(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000480573424 567612451 /nfs/dbraw/zinc/61/24/51/567612451.db2.gz AXASUMNLCMESQC-UHFFFAOYSA-N 0 0 381.431 3.326 20 5 GGBDRN CC(=O)Nc1ccc(Br)cc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000506154521 567612951 /nfs/dbraw/zinc/61/29/51/567612951.db2.gz XRIIVMSARGXKSY-UHFFFAOYSA-N 0 0 392.209 3.497 20 5 GGBDRN O=C1CN(c2c(Cl)cncc2[N+](=O)[O-])CCN1Cc1cccc(Cl)c1 ZINC000596160183 567613212 /nfs/dbraw/zinc/61/32/12/567613212.db2.gz ACCSZQISKOZCGH-UHFFFAOYSA-N 0 0 381.219 3.145 20 5 GGBDRN CN(CCNc1ccc(C(F)F)cc1[N+](=O)[O-])S(=O)(=O)c1cccs1 ZINC000596169924 567613492 /nfs/dbraw/zinc/61/34/92/567613492.db2.gz MPVWZOAGPGIACT-UHFFFAOYSA-N 0 0 391.421 3.327 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2cc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000552849816 567613580 /nfs/dbraw/zinc/61/35/80/567613580.db2.gz ZWKRCODHVQNLSL-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@H]2CCC[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000596153948 567613620 /nfs/dbraw/zinc/61/36/20/567613620.db2.gz CTPYYLDMKVOMKG-UWVGGRQHSA-N 0 0 381.376 3.023 20 5 GGBDRN Cc1cc(NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c([N+](=O)[O-])s1 ZINC000596196520 567614087 /nfs/dbraw/zinc/61/40/87/567614087.db2.gz UVWGBNHXIZTEFL-UHFFFAOYSA-N 0 0 385.442 3.256 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1NCc1cccc(N2CCOCC2)n1 ZINC000596194966 567614639 /nfs/dbraw/zinc/61/46/39/567614639.db2.gz JHUVMGKDTJZMFN-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN Nc1ccc(N2CCO[C@H](c3ccc(F)c(Br)c3)C2)nc1[N+](=O)[O-] ZINC000596197633 567614742 /nfs/dbraw/zinc/61/47/42/567614742.db2.gz SYQKWHRDVHWVMU-ZDUSSCGKSA-N 0 0 397.204 3.052 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](CO)Cc1cccc(Br)c1 ZINC000572108213 567614832 /nfs/dbraw/zinc/61/48/32/567614832.db2.gz LSUOOYKIYGBFQT-ZDUSSCGKSA-N 0 0 397.273 3.145 20 5 GGBDRN Nc1ccc(N2CCO[C@@H](c3ccc(F)c(Br)c3)C2)nc1[N+](=O)[O-] ZINC000596197632 567614931 /nfs/dbraw/zinc/61/49/31/567614931.db2.gz SYQKWHRDVHWVMU-CYBMUJFWSA-N 0 0 397.204 3.052 20 5 GGBDRN O=c1[nH]ccc(N2CCO[C@@H](c3ccc(F)c(Br)c3)C2)c1[N+](=O)[O-] ZINC000596197053 567615094 /nfs/dbraw/zinc/61/50/94/567615094.db2.gz QFHSEAYPBSODCR-CYBMUJFWSA-N 0 0 398.188 3.175 20 5 GGBDRN O=c1[nH]ccc(N[C@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000596214586 567615619 /nfs/dbraw/zinc/61/56/19/567615619.db2.gz WOMGDCDYJQGUQB-NSHDSACASA-N 0 0 379.214 3.149 20 5 GGBDRN Nc1ccc(N2CCC(Nc3cccc(Br)c3)CC2)nc1[N+](=O)[O-] ZINC000596214655 567615968 /nfs/dbraw/zinc/61/59/68/567615968.db2.gz JLJDMPLFCXGHNY-UHFFFAOYSA-N 0 0 392.257 3.415 20 5 GGBDRN Cc1c(Br)cccc1CC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000480620052 567615981 /nfs/dbraw/zinc/61/59/81/567615981.db2.gz RAAIPCPYDFCWHU-UHFFFAOYSA-N 0 0 390.237 3.188 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSCc1ccc(I)cc1 ZINC000530634427 567616110 /nfs/dbraw/zinc/61/61/10/567616110.db2.gz QDTFCKDGLFBXAM-UHFFFAOYSA-N 0 0 389.218 3.366 20 5 GGBDRN CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CNc1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000596230514 567616990 /nfs/dbraw/zinc/61/69/90/567616990.db2.gz BIIAHXUCRPHIMX-VXGBXAGGSA-N 0 0 377.413 3.052 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CC[C@H](C(F)(F)F)[C@H](CO)C1 ZINC000596232840 567617138 /nfs/dbraw/zinc/61/71/38/567617138.db2.gz ZJZGMXCCHHACMY-IUCAKERBSA-N 0 0 383.164 3.354 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H]2CCC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000440125631 567617092 /nfs/dbraw/zinc/61/70/92/567617092.db2.gz ZJUXTTPZCPMQBB-GXSJLCMTSA-N 0 0 398.257 3.157 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@@H](Nc3c(Br)cccc3[N+](=O)[O-])[C@H]2C1 ZINC000596233872 567617440 /nfs/dbraw/zinc/61/74/40/567617440.db2.gz GWSWSKDGBBFPNQ-SGMGOOAPSA-N 0 0 382.258 3.416 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@@H](Nc3c(Br)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC000596233869 567617707 /nfs/dbraw/zinc/61/77/07/567617707.db2.gz GWSWSKDGBBFPNQ-OUCADQQQSA-N 0 0 382.258 3.416 20 5 GGBDRN Cc1cccnc1N(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000480647083 567618657 /nfs/dbraw/zinc/61/86/57/567618657.db2.gz VNNNCPRTERYLBQ-UHFFFAOYSA-N 0 0 376.221 3.430 20 5 GGBDRN NC(=O)c1cc(N2CCC[C@@H]2c2ccc(Br)cn2)ccc1[N+](=O)[O-] ZINC000596260477 567619607 /nfs/dbraw/zinc/61/96/07/567619607.db2.gz DUAARCYCKXNZAQ-OAHLLOKOSA-N 0 0 391.225 3.193 20 5 GGBDRN Cn1ccnc1[C@@H]1C[C@@H](Nc2c(Br)cccc2[N+](=O)[O-])CCO1 ZINC000596266156 567619619 /nfs/dbraw/zinc/61/96/19/567619619.db2.gz NXOTUSZDYSZNBT-GWCFXTLKSA-N 0 0 381.230 3.423 20 5 GGBDRN Cn1ccnc1[C@H]1C[C@H](Nc2c(Br)cccc2[N+](=O)[O-])CCO1 ZINC000596266159 567619780 /nfs/dbraw/zinc/61/97/80/567619780.db2.gz NXOTUSZDYSZNBT-ZWNOBZJWSA-N 0 0 381.230 3.423 20 5 GGBDRN CS(=O)(=O)CC1CCC(Nc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596260175 567620214 /nfs/dbraw/zinc/62/02/14/567620214.db2.gz YUYSBAWTFFDVIL-UHFFFAOYSA-N 0 0 391.287 3.373 20 5 GGBDRN CCN1CCN(c2cc(C)c([N+](=O)[O-])cc2Br)C[C@@H]1c1ncc[nH]1 ZINC000480691848 567621240 /nfs/dbraw/zinc/62/12/40/567621240.db2.gz GOXWRYQYKOJNTR-OAHLLOKOSA-N 0 0 394.273 3.272 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)c2cc(Br)ccc2O1 ZINC000572199786 567621776 /nfs/dbraw/zinc/62/17/76/567621776.db2.gz SNENHKPWGGLECC-SECBINFHSA-N 0 0 380.198 3.124 20 5 GGBDRN O=C1c2ccc(Br)cc2C(=O)N1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000506384465 567624507 /nfs/dbraw/zinc/62/45/07/567624507.db2.gz WHGWOGWNJJXEKM-UHFFFAOYSA-N 0 0 397.131 3.432 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NCC(=O)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000480735158 567625136 /nfs/dbraw/zinc/62/51/36/567625136.db2.gz WPFCBVHSIJYLPZ-UHFFFAOYSA-N 0 0 382.825 3.026 20 5 GGBDRN Cc1c(Br)c(NCc2cccnc2N2CCCC2)ncc1[N+](=O)[O-] ZINC000596356481 567626706 /nfs/dbraw/zinc/62/67/06/567626706.db2.gz HWSPEGYJPIQYAH-UHFFFAOYSA-N 0 0 392.257 3.090 20 5 GGBDRN Cc1cc(OCc2cccc(S(=O)(=O)N(C)C)c2)c(Cl)cc1[N+](=O)[O-] ZINC000506445489 567626700 /nfs/dbraw/zinc/62/67/00/567626700.db2.gz QHMPGHPDKPLAKE-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCC[C@@H]([S@](C)=O)C2)ncc1[N+](=O)[O-] ZINC000596370020 567627830 /nfs/dbraw/zinc/62/78/30/567627830.db2.gz CDHKRIUCKNAFGK-QDXVKYEASA-N 0 0 376.276 3.162 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCC[C@H]([S@](C)=O)C2)ncc1[N+](=O)[O-] ZINC000596370022 567628180 /nfs/dbraw/zinc/62/81/80/567628180.db2.gz CDHKRIUCKNAFGK-ULQSSITMSA-N 0 0 376.276 3.162 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCC[C@@H]([S@@](C)=O)C2)ncc1[N+](=O)[O-] ZINC000596370019 567628278 /nfs/dbraw/zinc/62/82/78/567628278.db2.gz CDHKRIUCKNAFGK-FDXSBTRWSA-N 0 0 376.276 3.162 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1NC[C@H](O)COc1ccccc1Br ZINC000553147480 567629209 /nfs/dbraw/zinc/62/92/09/567629209.db2.gz ACVNUEZHAJYJBJ-JTQLQIEISA-N 0 0 385.189 3.348 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1NC[C@@H](O)COc1ccccc1Br ZINC000553147481 567629353 /nfs/dbraw/zinc/62/93/53/567629353.db2.gz ACVNUEZHAJYJBJ-SNVBAGLBSA-N 0 0 385.189 3.348 20 5 GGBDRN CSc1ccc(-c2nsc(NC(=O)c3ccc([N+](=O)[O-])n3C)n2)cc1 ZINC000440463499 567629714 /nfs/dbraw/zinc/62/97/14/567629714.db2.gz ACANJMZOXREIOL-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN COCCN([C@H]1CC[C@@H](C)C1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000480770514 567629973 /nfs/dbraw/zinc/62/99/73/567629973.db2.gz LIFXWGIVRVWJNW-YPMHNXCESA-N 0 0 376.862 3.074 20 5 GGBDRN C[C@H](O)CCSc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000596407281 567630775 /nfs/dbraw/zinc/63/07/75/567630775.db2.gz JEHVRDBRHGSUAX-ZDUSSCGKSA-N 0 0 388.511 3.023 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc2cc(Br)cnc21 ZINC000553155249 567631205 /nfs/dbraw/zinc/63/12/05/567631205.db2.gz YXBWHCIQUDCPCG-UHFFFAOYSA-N 0 0 390.197 3.049 20 5 GGBDRN CN(Cc1ccc(Cl)s1)C(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506557982 567631531 /nfs/dbraw/zinc/63/15/31/567631531.db2.gz ZPCWVXLUKYIRIR-UHFFFAOYSA-N 0 0 376.221 3.396 20 5 GGBDRN COc1cc(N2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)ncn1 ZINC000553160370 567632351 /nfs/dbraw/zinc/63/23/51/567632351.db2.gz JRUMBYQBKWNSNI-UHFFFAOYSA-N 0 0 384.223 3.027 20 5 GGBDRN COCc1cnc(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000553194193 567633858 /nfs/dbraw/zinc/63/38/58/567633858.db2.gz ITJLMZZOOPZJMA-UHFFFAOYSA-N 0 0 383.451 3.078 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1OCc1ncnn1CCF ZINC000440590832 567633916 /nfs/dbraw/zinc/63/39/16/567633916.db2.gz ZYMPNNKWUFBQSP-UHFFFAOYSA-N 0 0 396.176 3.046 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2C)cc1Br ZINC000480838849 567634061 /nfs/dbraw/zinc/63/40/61/567634061.db2.gz DDYQUIPTLDEYNK-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)C(=O)N1Cc2ccccc2C1 ZINC000480826542 567634117 /nfs/dbraw/zinc/63/41/17/567634117.db2.gz KMFFBVAIZASYEC-JTQLQIEISA-N 0 0 391.225 3.095 20 5 GGBDRN Cc1cccc(CNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)c1Br ZINC000553202770 567634694 /nfs/dbraw/zinc/63/46/94/567634694.db2.gz JJIDMQBYGIINQW-UHFFFAOYSA-N 0 0 389.209 3.349 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCOC[C@@H]2c2ccc(Br)cc2)c(F)c1 ZINC000596467542 567634673 /nfs/dbraw/zinc/63/46/73/567634673.db2.gz RQDRXGWPHWNYBT-CQSZACIVSA-N 0 0 382.189 3.469 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000596458415 567634883 /nfs/dbraw/zinc/63/48/83/567634883.db2.gz FALGYBQHPLYACB-SNVBAGLBSA-N 0 0 383.710 3.254 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCO[C@@H](c2ccco2)C1 ZINC000440631144 567635072 /nfs/dbraw/zinc/63/50/72/567635072.db2.gz WFTYUJVZOVXMQR-CQSZACIVSA-N 0 0 381.182 3.164 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CC[C@H](c3ccccc3)[C@H](CO)C2)c(Br)c1 ZINC000596471189 567635623 /nfs/dbraw/zinc/63/56/23/567635623.db2.gz LOMILVYSIVTJBW-DZGCQCFKSA-N 0 0 392.253 3.355 20 5 GGBDRN Cn1ncc(C2CC2)c1CNc1ccc(I)cc1[N+](=O)[O-] ZINC000596473129 567635862 /nfs/dbraw/zinc/63/58/62/567635862.db2.gz OCTMSJTXMCHECM-UHFFFAOYSA-N 0 0 398.204 3.422 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000596471305 567636211 /nfs/dbraw/zinc/63/62/11/567636211.db2.gz NDUOTEXEPDZJEG-DZGCQCFKSA-N 0 0 392.253 3.355 20 5 GGBDRN Cc1c(CNS(=O)(=O)Cc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000480849752 567636979 /nfs/dbraw/zinc/63/69/79/567636979.db2.gz VZKWCWALQWLVFE-UHFFFAOYSA-N 0 0 399.266 3.285 20 5 GGBDRN CCSC1(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)CC1 ZINC000596512217 567637274 /nfs/dbraw/zinc/63/72/74/567637274.db2.gz ACMVBRFSSJRBRL-UHFFFAOYSA-N 0 0 385.511 3.077 20 5 GGBDRN CC(=O)c1cc(NCc2ccc(S(C)(=O)=O)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000553246607 567637364 /nfs/dbraw/zinc/63/73/64/567637364.db2.gz FVHXJKOTIDHYAP-UHFFFAOYSA-N 0 0 382.825 3.466 20 5 GGBDRN CNC(=O)CC1(CNc2ncc([N+](=O)[O-])cc2Br)CCCCC1 ZINC000596523682 567637688 /nfs/dbraw/zinc/63/76/88/567637688.db2.gz MEYCRBYFOSBUCV-UHFFFAOYSA-N 0 0 385.262 3.251 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N(C)Cc2ccc(F)cc2Br)n1 ZINC000553245616 567637842 /nfs/dbraw/zinc/63/78/42/567637842.db2.gz BSHWJTMUGDPZAP-UHFFFAOYSA-N 0 0 398.188 3.314 20 5 GGBDRN Cc1ccc(CS(=O)(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c(F)c1 ZINC000480862962 567638075 /nfs/dbraw/zinc/63/80/75/567638075.db2.gz KPFRZOGFDUGZEV-UHFFFAOYSA-N 0 0 386.832 3.358 20 5 GGBDRN Cc1cccc(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2C)c1Br ZINC000480883133 567639208 /nfs/dbraw/zinc/63/92/08/567639208.db2.gz PODBDASTKDXEAX-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@@H](C)c2ccccc2SC)c([N+](=O)[O-])c1 ZINC000440683675 567639313 /nfs/dbraw/zinc/63/93/13/567639313.db2.gz YWUYRRHYHJXGAD-NSHDSACASA-N 0 0 381.479 3.398 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000596563279 567640220 /nfs/dbraw/zinc/64/02/20/567640220.db2.gz SXBAJGYJEBROHC-SNVBAGLBSA-N 0 0 398.257 3.109 20 5 GGBDRN CC(C)(C)c1nnc2n1CCN(c1c(Br)cccc1[N+](=O)[O-])C2 ZINC000596554441 567640358 /nfs/dbraw/zinc/64/03/58/567640358.db2.gz LFZAFPFRMGXABK-UHFFFAOYSA-N 0 0 380.246 3.267 20 5 GGBDRN O=C(NCC1CCC(F)(F)CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000506818336 567644612 /nfs/dbraw/zinc/64/46/12/567644612.db2.gz WBVGHJCYZDXRBT-UHFFFAOYSA-N 0 0 375.759 3.128 20 5 GGBDRN NC(=O)c1cccc(N[C@@H]2C[C@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000553375366 567647061 /nfs/dbraw/zinc/64/70/61/567647061.db2.gz PDZVQLQCMDGQFS-GXTWGEPZSA-N 0 0 376.210 3.424 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(Sc2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000506879411 567647240 /nfs/dbraw/zinc/64/72/40/567647240.db2.gz WCDBVGIDOPAWJS-UHFFFAOYSA-N 0 0 382.463 3.482 20 5 GGBDRN Cc1noc([C@@H]2CCCCN2C(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000553383848 567648292 /nfs/dbraw/zinc/64/82/92/567648292.db2.gz MPGFCLOCKMCRJP-ZDUSSCGKSA-N 0 0 395.213 3.416 20 5 GGBDRN Cc1noc([C@H]2CCCCN2C(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000553383847 567648660 /nfs/dbraw/zinc/64/86/60/567648660.db2.gz MPGFCLOCKMCRJP-CYBMUJFWSA-N 0 0 395.213 3.416 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CCc3cccc(Cl)c3C2)cc1 ZINC000459678307 567650584 /nfs/dbraw/zinc/65/05/84/567650584.db2.gz MWLHXQOSBRTVKX-UHFFFAOYSA-N 0 0 380.853 3.080 20 5 GGBDRN COc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1Br ZINC000507000395 567652488 /nfs/dbraw/zinc/65/24/88/567652488.db2.gz HXNBMQRCYZEWOS-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nc3c(cccc3Br)s2)c1[N+](=O)[O-] ZINC000553411550 567652846 /nfs/dbraw/zinc/65/28/46/567652846.db2.gz XVZCUVZMQALZKJ-UHFFFAOYSA-N 0 0 396.226 3.261 20 5 GGBDRN NS(=O)(=O)c1ccc(N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)c([N+](=O)[O-])c1 ZINC000481042491 567653093 /nfs/dbraw/zinc/65/30/93/567653093.db2.gz QZXBMSJMTQDTHE-AULYBMBSSA-N 0 0 381.841 3.254 20 5 GGBDRN CCOC(=O)c1csc(=O)n1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000572619809 567653657 /nfs/dbraw/zinc/65/36/57/567653657.db2.gz MCXVLLPOGTTXSM-UHFFFAOYSA-N 0 0 376.312 3.062 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1-c1nc(C2(c3cccc(Br)c3)CC2)no1 ZINC000572645156 567654637 /nfs/dbraw/zinc/65/46/37/567654637.db2.gz CTVVMCUBBSOORI-UHFFFAOYSA-N 0 0 390.197 3.221 20 5 GGBDRN CN(Cc1ccc2c(c1)OCCO2)c1ncc([N+](=O)[O-])cc1Br ZINC000531380414 567655830 /nfs/dbraw/zinc/65/58/30/567655830.db2.gz KWBDRCUTSKANRZ-UHFFFAOYSA-N 0 0 380.198 3.160 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNS(=O)(=O)c1c(Cl)ccc(F)c1F ZINC000553462894 567656666 /nfs/dbraw/zinc/65/66/66/567656666.db2.gz KJZOWNIEUTYCTB-UHFFFAOYSA-N 0 0 392.767 3.014 20 5 GGBDRN CC(C)(C)n1cc(Br)c(C(=O)NCc2ccccc2[N+](=O)[O-])n1 ZINC000596826127 567656976 /nfs/dbraw/zinc/65/69/76/567656976.db2.gz KVHDYGFRXYUNSN-UHFFFAOYSA-N 0 0 381.230 3.239 20 5 GGBDRN CN(Cc1cc(Br)cn1C)c1ncnc2sc([N+](=O)[O-])cc21 ZINC000553484229 567657374 /nfs/dbraw/zinc/65/73/74/567657374.db2.gz JPRFAYHPQMVMEM-UHFFFAOYSA-N 0 0 382.243 3.337 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCNS(=O)(=O)Cc1cccc(Br)c1 ZINC000553499832 567659329 /nfs/dbraw/zinc/65/93/29/567659329.db2.gz PCMFPBNWBAWEJR-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCC(=O)NCc1ccccc1 ZINC000531482096 567661035 /nfs/dbraw/zinc/66/10/35/567661035.db2.gz COSFUCOJBSQXJV-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C1CCCCC1 ZINC000531517541 567663202 /nfs/dbraw/zinc/66/32/02/567663202.db2.gz XDVQGKJASAFXCY-AWEZNQCLSA-N 0 0 399.241 3.209 20 5 GGBDRN C[C@@H]1CC[C@H](CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000481219891 567663613 /nfs/dbraw/zinc/66/36/13/567663613.db2.gz HNGMQSGLECJYQN-ZJUUUORDSA-N 0 0 377.260 3.072 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000459882963 567664674 /nfs/dbraw/zinc/66/46/74/567664674.db2.gz MOVQPJVWTMTDJY-CYBMUJFWSA-N 0 0 380.447 3.037 20 5 GGBDRN O=[N+]([O-])c1ccn(CCSc2nnc(-c3cccc(Br)c3)o2)n1 ZINC000481245336 567665221 /nfs/dbraw/zinc/66/52/21/567665221.db2.gz HXRQEQNUIXLIQA-UHFFFAOYSA-N 0 0 396.226 3.396 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCc3ccc(Br)cc3C2)n1 ZINC000553561518 567665262 /nfs/dbraw/zinc/66/52/62/567665262.db2.gz KOFPLZDHCSBDNO-UHFFFAOYSA-N 0 0 392.209 3.102 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCOc2c(Br)cccc21 ZINC000441509204 567666218 /nfs/dbraw/zinc/66/62/18/567666218.db2.gz AVJIJGAGDYKAKF-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN COc1ccc(C(=O)N2CCOc3c(Br)cccc32)cc1[N+](=O)[O-] ZINC000441526854 567667239 /nfs/dbraw/zinc/66/72/39/567667239.db2.gz WSCXQFSVVAJOOF-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN C[C@@](O)(CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(F)(F)F ZINC000481262127 567667356 /nfs/dbraw/zinc/66/73/56/567667356.db2.gz UQPJNNGQRFMYMT-SNVBAGLBSA-N 0 0 375.225 3.048 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCOc2c(Br)cccc21 ZINC000441515882 567667739 /nfs/dbraw/zinc/66/77/39/567667739.db2.gz WGAUVAWILRBUJG-UHFFFAOYSA-N 0 0 377.194 3.325 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2CC(C(F)(F)F)C2)c(C(F)(F)F)c1 ZINC000553574547 567668027 /nfs/dbraw/zinc/66/80/27/567668027.db2.gz KSNMSKCXPGQZPR-UHFFFAOYSA-N 0 0 392.277 3.233 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)NC1(c2c(Cl)cccc2Cl)CC1 ZINC000531596799 567668925 /nfs/dbraw/zinc/66/89/25/567668925.db2.gz VLPXIYSWFUZQOG-UHFFFAOYSA-N 0 0 388.232 3.264 20 5 GGBDRN CS(=O)(=O)NC[C@@H]1CCC[C@H]1Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000553590368 567669420 /nfs/dbraw/zinc/66/94/20/567669420.db2.gz ILNRHFFIOMDJEW-GZMMTYOYSA-N 0 0 382.269 3.031 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCN(c3cccc(Br)c3)CC2)n1 ZINC000553591950 567669552 /nfs/dbraw/zinc/66/95/52/567669552.db2.gz BJRWFBKDHDMQAK-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(C)cc1SCC(=O)Nc1nc(C)cs1 ZINC000553590748 567669651 /nfs/dbraw/zinc/66/96/51/567669651.db2.gz KYDCOVKRPYTCAL-UHFFFAOYSA-N 0 0 381.435 3.186 20 5 GGBDRN CS(=O)(=O)NC[C@@H]1CCC[C@@H]1Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000553590372 567669716 /nfs/dbraw/zinc/66/97/16/567669716.db2.gz ILNRHFFIOMDJEW-KWQFWETISA-N 0 0 382.269 3.031 20 5 GGBDRN CNc1nccc(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000572852649 567670506 /nfs/dbraw/zinc/67/05/06/567670506.db2.gz IZWQUHPQUAOXGZ-LBPRGKRZSA-N 0 0 378.841 3.074 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1cc(Cl)ccc1OCC(F)(F)F ZINC000481316253 567670748 /nfs/dbraw/zinc/67/07/48/567670748.db2.gz XPBMJCIJTYADBV-UHFFFAOYSA-N 0 0 378.694 3.175 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(Sc2c(F)cc(F)cc2F)c([N+](=O)[O-])c1 ZINC000531655118 567670930 /nfs/dbraw/zinc/67/09/30/567670930.db2.gz XXMCFNYQGDYOEF-UHFFFAOYSA-N 0 0 392.380 3.414 20 5 GGBDRN COc1cccc(CSc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])c1 ZINC000531657657 567671233 /nfs/dbraw/zinc/67/12/33/567671233.db2.gz HKGGYRCTCTXPBP-UHFFFAOYSA-N 0 0 382.463 3.146 20 5 GGBDRN O=[N+]([O-])c1cnc(NCc2cnn(CC(F)(F)F)c2)c(Br)c1 ZINC000531656600 567671855 /nfs/dbraw/zinc/67/18/55/567671855.db2.gz AHOCDLMOTQDGQF-UHFFFAOYSA-N 0 0 380.124 3.123 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CC[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000481336129 567671907 /nfs/dbraw/zinc/67/19/07/567671907.db2.gz GLZSSFIZQGFCLT-WCBMZHEXSA-N 0 0 377.260 3.085 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000572883957 567672392 /nfs/dbraw/zinc/67/23/92/567672392.db2.gz VPQSQRHOTPUAJT-IAQYHMDHSA-N 0 0 383.242 3.389 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@H]1CCCOC1 ZINC000572883959 567672520 /nfs/dbraw/zinc/67/25/20/567672520.db2.gz VPQSQRHOTPUAJT-XHDPSFHLSA-N 0 0 383.242 3.389 20 5 GGBDRN Cc1nc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)ccc1Br ZINC000481343731 567672709 /nfs/dbraw/zinc/67/27/09/567672709.db2.gz KEODLHWWCXNSAV-UHFFFAOYSA-N 0 0 394.229 3.294 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](c2ccc(Br)cc2)C1 ZINC000572900310 567673978 /nfs/dbraw/zinc/67/39/78/567673978.db2.gz QWVNULYPNCNNQS-AULYBMBSSA-N 0 0 378.226 3.372 20 5 GGBDRN Cc1ccc(N[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)c([N+](=O)[O-])c1 ZINC000572914516 567674263 /nfs/dbraw/zinc/67/42/63/567674263.db2.gz TXZYHJUORONLSV-CYBMUJFWSA-N 0 0 381.479 3.230 20 5 GGBDRN Cc1n[nH]c(C(=O)N[C@H]2c3cccc(Br)c3CC2(C)C)c1[N+](=O)[O-] ZINC000572908497 567674427 /nfs/dbraw/zinc/67/44/27/567674427.db2.gz IMYCYHIOZRRPRQ-AWEZNQCLSA-N 0 0 393.241 3.442 20 5 GGBDRN Cc1csc(CCCCNS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)n1 ZINC000481391811 567676181 /nfs/dbraw/zinc/67/61/81/567676181.db2.gz JPFCULMDJVRGIL-UHFFFAOYSA-N 0 0 383.495 3.278 20 5 GGBDRN CC1(C)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C(F)(F)F)O1 ZINC000553711959 567677700 /nfs/dbraw/zinc/67/77/00/567677700.db2.gz MVYNDMWATYAJPH-GFCCVEGCSA-N 0 0 380.750 3.359 20 5 GGBDRN Cc1c(CNC(=O)c2cc3c(c(Br)c2)OCO3)cccc1[N+](=O)[O-] ZINC000481461142 567679973 /nfs/dbraw/zinc/67/99/73/567679973.db2.gz AEXKUVGXPVGKMX-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN Cc1c(CNC(=O)[C@@H]2COc3ccc(Br)cc32)cccc1[N+](=O)[O-] ZINC000481488401 567682328 /nfs/dbraw/zinc/68/23/28/567682328.db2.gz FTIHPZWVWRDHTA-CQSZACIVSA-N 0 0 391.221 3.458 20 5 GGBDRN CC(C)[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCCO1 ZINC000573040263 567683276 /nfs/dbraw/zinc/68/32/76/567683276.db2.gz YQGKDXNPUWVAJG-HNNXBMFYSA-N 0 0 385.258 3.173 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)CCOc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000507512982 567683860 /nfs/dbraw/zinc/68/38/60/567683860.db2.gz ITDWTUTZRLVKCA-UHFFFAOYSA-N 0 0 384.841 3.256 20 5 GGBDRN O=C(NCCOc1ncc(Cl)cc1Cl)NCc1cccc([N+](=O)[O-])c1 ZINC000531885600 567685048 /nfs/dbraw/zinc/68/50/48/567685048.db2.gz JZWMSHRBAWXOAN-UHFFFAOYSA-N 0 0 385.207 3.175 20 5 GGBDRN Cc1ccc2nc(CNC(=O)c3ccc(Br)cc3[N+](=O)[O-])cn2c1 ZINC000460335042 567685112 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CC[C@@H](NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C(C)(C)C ZINC000573747610 567733819 /nfs/dbraw/zinc/73/38/19/567733819.db2.gz JELKPMFGSQBTLS-GFCCVEGCSA-N 0 0 386.246 3.237 20 5 GGBDRN O=C(COc1c2cc(Br)ccc2ncc1[N+](=O)[O-])N1CCCCC1 ZINC000508166527 567734456 /nfs/dbraw/zinc/73/44/56/567734456.db2.gz VHFBBNODPRUVFM-UHFFFAOYSA-N 0 0 394.225 3.297 20 5 GGBDRN CCc1nnc(COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])o1 ZINC000508158362 567734741 /nfs/dbraw/zinc/73/47/41/567734741.db2.gz DONSNVWBOMDVHC-UHFFFAOYSA-N 0 0 379.170 3.430 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000573772116 567735555 /nfs/dbraw/zinc/73/55/55/567735555.db2.gz DVGUAAAVWBQWSS-OAHLLOKOSA-N 0 0 381.841 3.463 20 5 GGBDRN CCc1cccnc1NC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000508205303 567736954 /nfs/dbraw/zinc/73/69/54/567736954.db2.gz ZKLGMFXIHSYZGY-UHFFFAOYSA-N 0 0 397.172 3.409 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@@H](C)[C@@H]2CCO)cc1[N+](=O)[O-] ZINC000598067949 567737459 /nfs/dbraw/zinc/73/74/59/567737459.db2.gz LXXYGPYZKIZEMA-YGRLFVJLSA-N 0 0 385.258 3.289 20 5 GGBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000573815639 567737508 /nfs/dbraw/zinc/73/75/08/567737508.db2.gz BPTFHNKRWJGFDE-JTQLQIEISA-N 0 0 385.207 3.308 20 5 GGBDRN CC1(C)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)[C@@H]2CCC[C@H]2O1 ZINC000508220498 567738074 /nfs/dbraw/zinc/73/80/74/567738074.db2.gz YJMGYNKYIBHDMX-HUUCEWRRSA-N 0 0 397.269 3.458 20 5 GGBDRN NC(=O)c1ccnc(Sc2ncc(C(F)(F)F)cc2Cl)c1[N+](=O)[O-] ZINC000573854630 567740224 /nfs/dbraw/zinc/74/02/24/567740224.db2.gz XDBUDIUXVKTQHH-UHFFFAOYSA-N 0 0 378.719 3.307 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCN(c2ccc(Br)cc2)CC1 ZINC000598150723 567742100 /nfs/dbraw/zinc/74/21/00/567742100.db2.gz IEDKWEOFYHFBOO-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN Cn1cc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000508334006 567743731 /nfs/dbraw/zinc/74/37/31/567743731.db2.gz ZCRSDOLGWMBBKZ-UHFFFAOYSA-N 0 0 393.119 3.362 20 5 GGBDRN Cn1cnc(-c2ccc(Br)cc2)c1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000508385138 567745695 /nfs/dbraw/zinc/74/56/95/567745695.db2.gz WGAHOHSMNSVMCY-UHFFFAOYSA-N 0 0 390.197 3.338 20 5 GGBDRN CCC1(CC)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000573937800 567745885 /nfs/dbraw/zinc/74/58/85/567745885.db2.gz UBYPUSMKOKDZDP-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN COc1cc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc(Br)c1OC ZINC000554747392 567746380 /nfs/dbraw/zinc/74/63/80/567746380.db2.gz LZZWMEFQNQEYQN-UHFFFAOYSA-N 0 0 396.197 3.046 20 5 GGBDRN CC(C)(F)CCNC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000598198203 567747205 /nfs/dbraw/zinc/74/72/05/567747205.db2.gz IDRASIOHJWODPR-UHFFFAOYSA-N 0 0 380.157 3.067 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2c(C3CC3)cnn2C)cc1[N+](=O)[O-] ZINC000598209919 567747217 /nfs/dbraw/zinc/74/72/17/567747217.db2.gz DTVNGFVNXRANCI-UHFFFAOYSA-N 0 0 393.241 3.207 20 5 GGBDRN COC[C@H](NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000573996467 567748204 /nfs/dbraw/zinc/74/82/04/567748204.db2.gz RGBULKIAAXCFDW-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3ccc([N+](=O)[O-])cc3Br)[C@@H]2C1 ZINC000573995627 567748564 /nfs/dbraw/zinc/74/85/64/567748564.db2.gz LDUGUEVMQUPJEB-LNSITVRQSA-N 0 0 382.258 3.416 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(C)(C)c2ccc(Br)cc21 ZINC000598232162 567749540 /nfs/dbraw/zinc/74/95/40/567749540.db2.gz BXPCOBISFFQYHY-UHFFFAOYSA-N 0 0 379.214 3.029 20 5 GGBDRN C[C@H]1CCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000461859731 567750357 /nfs/dbraw/zinc/75/03/57/567750357.db2.gz UKCQCEZDWRMLIU-UWVGGRQHSA-N 0 0 377.260 3.072 20 5 GGBDRN C[C@@H]1CCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000461859733 567750533 /nfs/dbraw/zinc/75/05/33/567750533.db2.gz UKCQCEZDWRMLIU-ZJUUUORDSA-N 0 0 377.260 3.072 20 5 GGBDRN CSCCCN(C)S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000461879589 567750670 /nfs/dbraw/zinc/75/06/70/567750670.db2.gz BPDQSHNLRDRVDA-UHFFFAOYSA-N 0 0 397.316 3.039 20 5 GGBDRN C[C@@H]1CCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000461859730 567751310 /nfs/dbraw/zinc/75/13/10/567751310.db2.gz UKCQCEZDWRMLIU-NXEZZACHSA-N 0 0 377.260 3.072 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@H](C)c2ccc(SC)cc2)ccc1[N+](=O)[O-] ZINC000461893872 567752483 /nfs/dbraw/zinc/75/24/83/567752483.db2.gz GQCAQZGMFRKJNX-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])c1 ZINC000574093525 567754977 /nfs/dbraw/zinc/75/49/77/567754977.db2.gz HSHXPCFJGGTKHI-JTQLQIEISA-N 0 0 387.870 3.317 20 5 GGBDRN C[C@@H]1CC(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000554910940 567755161 /nfs/dbraw/zinc/75/51/61/567755161.db2.gz OWKLPFFMYNLIGV-GHMZBOCLSA-N 0 0 376.862 3.120 20 5 GGBDRN O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)c1cccc(Cl)c1Cl ZINC000554896213 567755338 /nfs/dbraw/zinc/75/53/38/567755338.db2.gz GTCYHSMTPPXVGX-UHFFFAOYSA-N 0 0 379.155 3.381 20 5 GGBDRN CC(C)N(Cc1cc(Br)ccc1F)C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000508580322 567755780 /nfs/dbraw/zinc/75/57/80/567755780.db2.gz FMLBXYKMKVJJRI-UHFFFAOYSA-N 0 0 385.193 3.270 20 5 GGBDRN COc1cc(S(=O)(=O)NCc2ccc3sccc3c2)ccc1[N+](=O)[O-] ZINC000554914076 567756372 /nfs/dbraw/zinc/75/63/72/567756372.db2.gz ZBDVVOMLNGLYHH-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN CCN(CC)S(=O)(=O)CCNc1cc(C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000461936829 567756749 /nfs/dbraw/zinc/75/67/49/567756749.db2.gz OGIYJTFLVRZFQK-UHFFFAOYSA-N 0 0 383.392 3.006 20 5 GGBDRN CCSC1(CNC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC1 ZINC000598337892 567757106 /nfs/dbraw/zinc/75/71/06/567757106.db2.gz POFFUPSKMDJMBO-UHFFFAOYSA-N 0 0 376.381 3.220 20 5 GGBDRN CC1(C)CCC(O)(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000598339008 567757386 /nfs/dbraw/zinc/75/73/86/567757386.db2.gz STLQNKKNDJLDAT-UHFFFAOYSA-N 0 0 385.258 3.418 20 5 GGBDRN CC1(C)CCC(O)(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000598338453 567757448 /nfs/dbraw/zinc/75/74/48/567757448.db2.gz MMJUXYNIUCAVEW-UHFFFAOYSA-N 0 0 399.285 3.347 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c(OC)c1 ZINC000443462645 567758456 /nfs/dbraw/zinc/75/84/56/567758456.db2.gz APKWAWUKSHHIRS-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN Cc1nn(C)c(-c2nc(-c3cc(Br)ccc3C)no2)c1[N+](=O)[O-] ZINC000508626384 567758520 /nfs/dbraw/zinc/75/85/20/567758520.db2.gz WDDYYSOVCZAMOF-UHFFFAOYSA-N 0 0 378.186 3.425 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC3([C@@H](C)O)CC3)cc2[N+](=O)[O-])n1 ZINC000598387193 567759825 /nfs/dbraw/zinc/75/98/25/567759825.db2.gz RYSGCKYKJYHHGD-SNVBAGLBSA-N 0 0 379.463 3.154 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)sc1Cl ZINC000554963576 567760300 /nfs/dbraw/zinc/76/03/00/567760300.db2.gz DELZCRHPSMKJPJ-UHFFFAOYSA-N 0 0 388.854 3.201 20 5 GGBDRN C[C@H](c1ncc(Br)cn1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000554972259 567760865 /nfs/dbraw/zinc/76/08/65/567760865.db2.gz HMUAXWGJXOLEIX-SNVBAGLBSA-N 0 0 379.214 3.103 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000443479118 567761537 /nfs/dbraw/zinc/76/15/37/567761537.db2.gz WMLLXJSQFMUOEO-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CC[C@H]2c2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000598422581 567764758 /nfs/dbraw/zinc/76/47/58/567764758.db2.gz FTTQUAPSXSTYOK-LBPRGKRZSA-N 0 0 379.214 3.230 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1F ZINC000574227821 567765709 /nfs/dbraw/zinc/76/57/09/567765709.db2.gz JCQUFKHMHDFXTN-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2csc3ccccc32)cc1[N+](=O)[O-] ZINC000508789973 567766823 /nfs/dbraw/zinc/76/68/23/567766823.db2.gz PRRNGDUGXJAMLE-UHFFFAOYSA-N 0 0 378.431 3.297 20 5 GGBDRN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000598428998 567767374 /nfs/dbraw/zinc/76/73/74/567767374.db2.gz VLDUNZBJQGKUPF-AWEZNQCLSA-N 0 0 395.257 3.081 20 5 GGBDRN Cc1cc(NCc2ccc(S(N)(=O)=O)s2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555119294 567769466 /nfs/dbraw/zinc/76/94/66/567769466.db2.gz BXJFSBQSUKNYMD-UHFFFAOYSA-N 0 0 395.384 3.243 20 5 GGBDRN O=[N+]([O-])c1ccc(CCNS(=O)(=O)c2ccc(C(F)(F)F)s2)cc1 ZINC000462093877 567769557 /nfs/dbraw/zinc/76/95/57/567769557.db2.gz SUZHVJMZRCCPBD-UHFFFAOYSA-N 0 0 380.369 3.196 20 5 GGBDRN O=C(Nc1cccc(-c2c[nH]nn2)c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000443684461 567771140 /nfs/dbraw/zinc/77/11/40/567771140.db2.gz SLTDZXXCJSYLPI-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN CCOC(=O)[C@]1(C)CCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000598484668 567771063 /nfs/dbraw/zinc/77/10/63/567771063.db2.gz NKWMJVDBZFHOTC-XJKSGUPXSA-N 0 0 399.241 3.209 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc(C(F)(F)F)s1 ZINC000462100387 567771460 /nfs/dbraw/zinc/77/14/60/567771460.db2.gz GBTREQRHNARUKE-UHFFFAOYSA-N 0 0 380.369 3.496 20 5 GGBDRN COC1(C)CCN(c2ccc(I)cc2[N+](=O)[O-])CC1 ZINC000555162406 567772925 /nfs/dbraw/zinc/77/29/25/567772925.db2.gz VXKRJHWWQMTFND-UHFFFAOYSA-N 0 0 376.194 3.205 20 5 GGBDRN Cc1nnc(CN(C)C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)s1 ZINC000598506888 567773044 /nfs/dbraw/zinc/77/30/44/567773044.db2.gz ZWXRSOPZWIAHDY-UHFFFAOYSA-N 0 0 385.243 3.098 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCC2(C3CC3)CCC2)c(C(F)(F)F)c1 ZINC000443735869 567773619 /nfs/dbraw/zinc/77/36/19/567773619.db2.gz YOOGZFZHWLJGAL-UHFFFAOYSA-N 0 0 378.372 3.472 20 5 GGBDRN CCc1nnsc1-c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000574364742 567774478 /nfs/dbraw/zinc/77/44/78/567774478.db2.gz LGXUYESIAJJEEV-UHFFFAOYSA-N 0 0 396.226 3.412 20 5 GGBDRN CN(C[C@@H]1CC1(C)C)C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000598556180 567777045 /nfs/dbraw/zinc/77/70/45/567777045.db2.gz GIAVTUXIFWGASZ-VIFPVBQESA-N 0 0 388.205 3.318 20 5 GGBDRN CC(C)(C(=O)Nc1cc2c(cc1Br)CCC2)n1cc([N+](=O)[O-])cn1 ZINC000443867875 567777927 /nfs/dbraw/zinc/77/79/27/567777927.db2.gz JYOVVNNPVMVSRM-UHFFFAOYSA-N 0 0 393.241 3.416 20 5 GGBDRN COCCN(Cc1cccs1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1C ZINC000598598056 567778395 /nfs/dbraw/zinc/77/83/95/567778395.db2.gz YFDYHYNUIUPGBC-UHFFFAOYSA-N 0 0 384.479 3.110 20 5 GGBDRN O=[N+]([O-])c1c(NCc2c(Cl)cccc2Cl)ncnc1N1CCOCC1 ZINC000598592124 567779201 /nfs/dbraw/zinc/77/92/01/567779201.db2.gz GAHNXIJJOLRTHR-UHFFFAOYSA-N 0 0 384.223 3.140 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1ccc2c(n1)CCCC2 ZINC000443932655 567779920 /nfs/dbraw/zinc/77/99/20/567779920.db2.gz ACFOCGYMQDKRQW-UHFFFAOYSA-N 0 0 381.841 3.001 20 5 GGBDRN COC(=O)c1ccnc(N2CCc3cc(Br)ccc3C2)c1[N+](=O)[O-] ZINC000598621709 567780403 /nfs/dbraw/zinc/78/04/03/567780403.db2.gz XRXCETREPZXOIY-UHFFFAOYSA-N 0 0 392.209 3.102 20 5 GGBDRN Cc1cc(N2CCCC[C@H](S(C)(=O)=O)C2)c(Br)cc1[N+](=O)[O-] ZINC000443952049 567781251 /nfs/dbraw/zinc/78/12/51/567781251.db2.gz YDORVZJFTMTMFO-NSHDSACASA-N 0 0 391.287 3.069 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN1c2ccc(Br)cc2CS1(=O)=O ZINC000555406985 567782004 /nfs/dbraw/zinc/78/20/04/567782004.db2.gz IWQHFEITADQHCL-UHFFFAOYSA-N 0 0 383.223 3.207 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000574497014 567782016 /nfs/dbraw/zinc/78/20/16/567782016.db2.gz FCJSEFLXLQCYGU-NSHDSACASA-N 0 0 378.372 3.478 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cc(Br)c[nH]c1=O ZINC000598685450 567782082 /nfs/dbraw/zinc/78/20/82/567782082.db2.gz IUKRRZQTIRRECU-UHFFFAOYSA-N 0 0 394.225 3.211 20 5 GGBDRN C[C@H](Cc1cc(Br)ccc1F)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000533716414 567783760 /nfs/dbraw/zinc/78/37/60/567783760.db2.gz IJKRMQUYZDLUAR-SECBINFHSA-N 0 0 396.216 3.440 20 5 GGBDRN Cc1ccccc1OC[C@H](O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000533708052 567784091 /nfs/dbraw/zinc/78/40/91/567784091.db2.gz MEZPXCYGIPVMFZ-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN Cc1cc(OC[C@@H](O)COc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000533709069 567784187 /nfs/dbraw/zinc/78/41/87/567784187.db2.gz WXAMMACQUAJSJH-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN Cc1ccc(OC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000533709011 567784379 /nfs/dbraw/zinc/78/43/79/567784379.db2.gz ULHREYUFHUEIPO-ZDUSSCGKSA-N 0 0 382.210 3.484 20 5 GGBDRN O=c1[nH]c(NCc2cc(Br)ccc2F)nc2ccc([N+](=O)[O-])cc12 ZINC000574535151 567784545 /nfs/dbraw/zinc/78/45/45/567784545.db2.gz RIWRXOPFWCDWHH-UHFFFAOYSA-N 0 0 393.172 3.179 20 5 GGBDRN CS(=O)(=O)[C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000555462841 567785324 /nfs/dbraw/zinc/78/53/24/567785324.db2.gz WRPSWWPDFPHYSP-ZDUSSCGKSA-N 0 0 380.388 3.013 20 5 GGBDRN C[S@](=O)[C@H]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000598754075 567787965 /nfs/dbraw/zinc/78/79/65/567787965.db2.gz NSHAOUAKHALPIC-PDISFODASA-N 0 0 378.372 3.033 20 5 GGBDRN Cc1cc(Br)cc(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000444063670 567788122 /nfs/dbraw/zinc/78/81/22/567788122.db2.gz RTGHDSDICQLMDM-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1cc(Br)ccc1OC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000555545929 567788218 /nfs/dbraw/zinc/78/82/18/567788218.db2.gz NXZOYRAEIPFWEA-AWEZNQCLSA-N 0 0 382.210 3.484 20 5 GGBDRN C[S@](=O)[C@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000598756994 567788651 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ZINC000574789123 567797007 /nfs/dbraw/zinc/79/70/07/567797007.db2.gz OURBTKFEYTYZGR-UHFFFAOYSA-N 0 0 382.189 3.487 20 5 GGBDRN Cn1ncc(Br)c1C(=O)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000598882532 567797081 /nfs/dbraw/zinc/79/70/81/567797081.db2.gz ZNTXYGKZHXIHRP-UHFFFAOYSA-N 0 0 379.214 3.074 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1SCCO)N1CC(Cc2ccsc2)C1 ZINC000598907087 567797794 /nfs/dbraw/zinc/79/77/94/567797794.db2.gz VZTQRHFRUXHVFH-UHFFFAOYSA-N 0 0 378.475 3.055 20 5 GGBDRN COc1cc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])ncc1Br ZINC000444315403 567801265 /nfs/dbraw/zinc/80/12/65/567801265.db2.gz QRKPJBCIARFXAD-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCc2ccsc2C(F)(F)F)cc1 ZINC000598972391 567801994 /nfs/dbraw/zinc/80/19/94/567801994.db2.gz QPXHMVLIYLPYRH-UHFFFAOYSA-N 0 0 394.396 3.239 20 5 GGBDRN C[C@@](CO)(NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000444323094 567802167 /nfs/dbraw/zinc/80/21/67/567802167.db2.gz ZWUAEKVPIIOAHX-INIZCTEOSA-N 0 0 385.258 3.418 20 5 GGBDRN O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1c(Br)cccc1[N+](=O)[O-] ZINC000599001994 567803023 /nfs/dbraw/zinc/80/30/23/567803023.db2.gz UUNLELWIUGHTCT-GFCCVEGCSA-N 0 0 392.209 3.265 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccncc1Br ZINC000534237763 567804385 /nfs/dbraw/zinc/80/43/85/567804385.db2.gz YWVFTBCHALMMEX-SECBINFHSA-N 0 0 382.239 3.294 20 5 GGBDRN CN(Cc1cc(Br)cn1C)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000534246980 567805248 /nfs/dbraw/zinc/80/52/48/567805248.db2.gz RFPCIPOEZARBJB-UHFFFAOYSA-N 0 0 391.225 3.449 20 5 GGBDRN Cn1cc([C@@H]2C[C@@H](Nc3ccc(Br)cc3[N+](=O)[O-])CCO2)cn1 ZINC000599106416 567805550 /nfs/dbraw/zinc/80/55/50/567805550.db2.gz GLQUPVTVPVUEKL-WFASDCNBSA-N 0 0 381.230 3.423 20 5 GGBDRN Cc1c(Br)c(N2C[C@@H](c3cnn(C)c3)C(C)(C)C2)ncc1[N+](=O)[O-] ZINC000599109416 567805805 /nfs/dbraw/zinc/80/58/05/567805805.db2.gz WGBCKBPOIMAVRS-LBPRGKRZSA-N 0 0 394.273 3.424 20 5 GGBDRN Cc1ccnc(N2CC[C@@H](Oc3cncc(Br)c3)C2)c1[N+](=O)[O-] ZINC000599108098 567805905 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CC(=O)N[C@@H](c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1)C(C)C ZINC000599138062 567807079 /nfs/dbraw/zinc/80/70/79/567807079.db2.gz DYXWBBFTWOMAPT-CQSZACIVSA-N 0 0 397.229 3.164 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)c3c(Br)cccc3[N+](=O)[O-])C2)n1 ZINC000599127605 567807278 /nfs/dbraw/zinc/80/72/78/567807278.db2.gz IVSPTFBILOOEIF-JTQLQIEISA-N 0 0 395.213 3.069 20 5 GGBDRN CCC[C@]1(CO)CCCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000444536574 567807417 /nfs/dbraw/zinc/80/74/17/567807417.db2.gz QWOURCIRNIWDMH-MRXNPFEDSA-N 0 0 385.258 3.433 20 5 GGBDRN CCCN(C(=O)c1cc(I)cc([N+](=O)[O-])c1)C(C)C ZINC000574999752 567808283 /nfs/dbraw/zinc/80/82/83/567808283.db2.gz MQERORICHZGYOA-UHFFFAOYSA-N 0 0 376.194 3.460 20 5 GGBDRN O=c1ccc([C@@H]2OCC[C@H]2Nc2ccc(Br)cc2[N+](=O)[O-])c[nH]1 ZINC000599173012 567808473 /nfs/dbraw/zinc/80/84/73/567808473.db2.gz JKRVEDLYKHRGBO-DOMZBBRYSA-N 0 0 380.198 3.400 20 5 GGBDRN COC(=O)[C@@H]1CN(c2c(Br)cncc2[N+](=O)[O-])Cc2ccccc21 ZINC000599187072 567809204 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TZFGTRYQSNJZBF-UHFFFAOYSA-N 0 0 394.313 3.414 20 5 GGBDRN Cc1c(NC(=O)CCCCOc2cccc(-c3nn[nH]n3)c2)cccc1[N+](=O)[O-] ZINC000737219944 598648354 /nfs/dbraw/zinc/64/83/54/598648354.db2.gz UMZDETCVMPSYCC-UHFFFAOYSA-N 0 0 396.407 3.271 20 5 GGBDRN O=[N+]([O-])c1cccc(OCCSCc2ccc(F)cc2-c2nn[nH]n2)c1 ZINC000738370600 598697135 /nfs/dbraw/zinc/69/71/35/598697135.db2.gz WLOJKHMTDTXHNC-UHFFFAOYSA-N 0 0 375.385 3.226 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1N1CCC(Oc2ccc(-c3nn[nH]n3)cc2)CC1 ZINC000737409170 598756192 /nfs/dbraw/zinc/75/61/92/598756192.db2.gz BIXDGUNLUYMJIE-UHFFFAOYSA-N 0 0 380.408 3.131 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000738357625 598756300 /nfs/dbraw/zinc/75/63/00/598756300.db2.gz GQVXYBRFQDQHKM-MRXNPFEDSA-N 0 0 386.799 3.006 20 5 GGBDRN O=[N+]([O-])c1cnc(NCCSCc2ccccc2-c2nn[nH]n2)c(Cl)c1 ZINC000738374967 599399207 /nfs/dbraw/zinc/39/92/07/599399207.db2.gz VLGRPYKBGYWWKQ-UHFFFAOYSA-N 0 0 391.844 3.169 20 5 GGBDRN CC(=O)N(Cc1ccc(Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])cc1)C1CC1 ZINC000735460520 599440408 /nfs/dbraw/zinc/44/04/08/599440408.db2.gz IICRVGJACMSDBW-UHFFFAOYSA-N 0 0 393.407 3.029 20 5 GGBDRN CO[C@H](CNc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1)c1ccccc1 ZINC000821677496 599470021 /nfs/dbraw/zinc/47/00/21/599470021.db2.gz YISALORKPDSXRC-QGZVFWFLSA-N 0 0 391.391 3.123 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCNc2ccc(-c3nn[nH]n3)cc2C(F)(F)F)cc1 ZINC000738368030 599526082 /nfs/dbraw/zinc/52/60/82/599526082.db2.gz YUKUQJRAVCXXFQ-UHFFFAOYSA-N 0 0 394.313 3.285 20 5 GGBDRN O=C([O-])[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000739501274 599788624 /nfs/dbraw/zinc/78/86/24/599788624.db2.gz VNWLXYJDWYOZCJ-OAHLLOKOSA-N 0 0 379.210 3.315 20 5 GGBDRN O=C([O-])[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F ZINC000739499189 599792039 /nfs/dbraw/zinc/79/20/39/599792039.db2.gz GVSRDBBJPPCCEW-HNNXBMFYSA-N 0 0 384.310 3.408 20 5 GGBDRN O=C([O-])[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000739499151 599792182 /nfs/dbraw/zinc/79/21/82/599792182.db2.gz FXWGUBZLFKKJDN-HNNXBMFYSA-N 0 0 395.209 3.152 20 5 GGBDRN O=C([O-])[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000739501815 599792190 /nfs/dbraw/zinc/79/21/90/599792190.db2.gz ZHTBLLBPQDUFLD-OAHLLOKOSA-N 0 0 395.209 3.152 20 5 GGBDRN COc1ccc(-c2ccc(C[NH2+][C@@H]3CCCN(C(=O)[O-])C3)o2)c([N+](=O)[O-])c1 ZINC000737909916 599859527 /nfs/dbraw/zinc/85/95/27/599859527.db2.gz MXTHXYDZWFJAKD-GFCCVEGCSA-N 0 0 375.381 3.095 20 5 GGBDRN O=C([O-])c1cc(C(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc([N+](=O)[O-])c1 ZINC000738670163 599937189 /nfs/dbraw/zinc/93/71/89/599937189.db2.gz UHLBLGYVDLDSIT-HNNXBMFYSA-N 0 0 389.452 3.021 20 5 GGBDRN C[NH+](C)[C@@H](CNc1c(C(=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(F)c1 ZINC000737358052 600075292 /nfs/dbraw/zinc/07/52/92/600075292.db2.gz HLMNBRCKNQXDOO-HNNXBMFYSA-N 0 0 392.343 3.055 20 5 GGBDRN C[C@H](CNc1c(C(=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000736606188 600239629 /nfs/dbraw/zinc/23/96/29/600239629.db2.gz ABZYSDIBCQNDMT-GFCCVEGCSA-N 0 0 388.380 3.134 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000736785356 600259878 /nfs/dbraw/zinc/25/98/78/600259878.db2.gz SDKLHGCOIHKKAM-LSDHHAIUSA-N 0 0 389.452 3.020 20 5 GGBDRN COc1cc(CC[NH2+][C@@H](C(=O)[O-])c2cccc(Cl)c2)c([N+](=O)[O-])cc1OC ZINC000737880451 600419332 /nfs/dbraw/zinc/41/93/32/600419332.db2.gz GABOMPYGUZVVJQ-QGZVFWFLSA-N 0 0 394.811 3.223 20 5 GGBDRN CC[N@@H+]1CCC[C@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000737114136 600432444 /nfs/dbraw/zinc/43/24/44/600432444.db2.gz GXAXSLWGEBNJER-HNNXBMFYSA-N 0 0 397.431 3.420 20 5 GGBDRN Cn1cc(C[NH2+]CCc2ccc(NC(=O)[O-])cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000739032919 600453697 /nfs/dbraw/zinc/45/36/97/600453697.db2.gz APSHUHRDOXFXED-UHFFFAOYSA-N 0 0 395.419 3.418 20 5 GGBDRN O=C([O-])c1cc(C(=O)N(CC[NH+]2CCCC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000738669459 600530673 /nfs/dbraw/zinc/53/06/73/600530673.db2.gz OPFGDADKDPHRJL-UHFFFAOYSA-N 0 0 383.404 3.036 20 5 GGBDRN O=C([O-])c1cccc(OCC[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000578199475 600849229 /nfs/dbraw/zinc/84/92/29/600849229.db2.gz JBJYNQOORPKIDS-UHFFFAOYSA-N 0 0 386.404 3.215 20 5 GGBDRN O=C([O-])c1cc([N+](=O)[O-])c(N2CC[NH+](CCc3ccccc3)CC2)cc1Cl ZINC000740094810 600943069 /nfs/dbraw/zinc/94/30/69/600943069.db2.gz HXGIGBJUUGLPDZ-UHFFFAOYSA-N 0 0 389.839 3.311 20 5 GGBDRN O=C([O-])c1cc(NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)cc([N+](=O)[O-])c1 ZINC000833301310 600961510 /nfs/dbraw/zinc/96/15/10/600961510.db2.gz WUFQSYFFWVJOFZ-UHFFFAOYSA-N 0 0 378.344 3.106 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000828177397 601173221 /nfs/dbraw/zinc/17/32/21/601173221.db2.gz PTSSFBKACHWZRK-KBXCAEBGSA-N 0 0 397.431 3.076 20 5 GGBDRN C[C@H](C(=O)[O-])[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000826055031 601201806 /nfs/dbraw/zinc/20/18/06/601201806.db2.gz UTMYSOAKOKAAHV-APPDUMDISA-N 0 0 391.811 3.238 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832958501 601203385 /nfs/dbraw/zinc/20/33/85/601203385.db2.gz IFNQHRSHPHCMEC-IFXJQAMLSA-N 0 0 385.420 3.283 20 5 GGBDRN Cc1c(NC(=O)CC[NH2+][C@@H](c2ccccc2)[C@H](C)C(=O)[O-])cccc1[N+](=O)[O-] ZINC000832857512 601205459 /nfs/dbraw/zinc/20/54/59/601205459.db2.gz QVFUPWFANAYVBL-IFXJQAMLSA-N 0 0 385.420 3.283 20 5 GGBDRN Cc1c(NC(=O)CC[NH2+][C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])cccc1[N+](=O)[O-] ZINC000832857511 601205602 /nfs/dbraw/zinc/20/56/02/601205602.db2.gz QVFUPWFANAYVBL-AUUYWEPGSA-N 0 0 385.420 3.283 20 5 GGBDRN Cc1c(NC(=O)CC[NH2+][C@H](c2ccccc2)[C@@H](C)C(=O)[O-])cccc1[N+](=O)[O-] ZINC000832857513 601205694 /nfs/dbraw/zinc/20/56/94/601205694.db2.gz QVFUPWFANAYVBL-KUHUBIRLSA-N 0 0 385.420 3.283 20 5 GGBDRN O=C([O-])CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(F)c(F)c1 ZINC000833233178 601318092 /nfs/dbraw/zinc/31/80/92/601318092.db2.gz FXZBXBUEURMXMK-UHFFFAOYSA-N 0 0 391.330 3.491 20 5 GGBDRN CC[C@@H]([NH2+][C@H]1CCN(c2sccc2C(=O)[O-])C1=O)c1cccc([N+](=O)[O-])c1 ZINC000828983018 601380538 /nfs/dbraw/zinc/38/05/38/601380538.db2.gz MSFQPSWRGBMGCB-CABCVRRESA-N 0 0 389.433 3.201 20 5 GGBDRN O=C([O-])[C@@H]([NH2+]CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 ZINC000833167188 601458197 /nfs/dbraw/zinc/45/81/97/601458197.db2.gz ZMBMUPNOWQVASC-HNNXBMFYSA-N 0 0 383.326 3.441 20 5 GGBDRN CCC1CCC([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])(C(=O)[O-])CC1 ZINC000829107584 601494430 /nfs/dbraw/zinc/49/44/30/601494430.db2.gz OLPZECNGSQHXQZ-UHFFFAOYSA-N 0 0 383.832 3.200 20 5 GGBDRN CC[N@H+]1C[C@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000829754804 601564992 /nfs/dbraw/zinc/56/49/92/601564992.db2.gz YEHMZCAGCSKKJO-UGSOOPFHSA-N 0 0 397.431 3.276 20 5 GGBDRN CC[N@@H+]1C[C@@H](C)[C@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000829754796 601565053 /nfs/dbraw/zinc/56/50/53/601565053.db2.gz YEHMZCAGCSKKJO-FZKQIMNGSA-N 0 0 397.431 3.276 20 5 GGBDRN CSc1ccsc1C(=O)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000826231339 607522718 /nfs/dbraw/zinc/52/27/18/607522718.db2.gz HGCYTDUXCKFXEU-UHFFFAOYSA-N 0 0 396.841 3.464 20 5 GGBDRN O=C(Nc1ccc(F)c(-c2nn[nH]n2)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000826453821 607619229 /nfs/dbraw/zinc/61/92/29/607619229.db2.gz AUEHVTJLNNXILO-UHFFFAOYSA-N 0 0 397.370 3.111 20 5 GGBDRN Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1 ZINC000832932432 604350816 /nfs/dbraw/zinc/35/08/16/604350816.db2.gz JZQXXYPZWBFUNJ-UHFFFAOYSA-N 0 0 383.404 3.450 20 5 GGBDRN C[C@H]1C[NH+](CCCCNc2cc(Cl)c(C(=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000828449313 604776212 /nfs/dbraw/zinc/77/62/12/604776212.db2.gz JXXSGBQWXXJWHE-RYUDHWBXSA-N 0 0 385.848 3.248 20 5 GGBDRN CC(C)(C(=O)[O-])[C@@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000833419880 605042692 /nfs/dbraw/zinc/04/26/92/605042692.db2.gz XSTGFPXUNNJTDO-GFCCVEGCSA-N 0 0 380.832 3.378 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1Oc1ccc(Oc2ccc(-c3nn[nH]n3)cc2)cc1 ZINC000822698668 606242438 /nfs/dbraw/zinc/24/24/38/606242438.db2.gz AIRIXLIBLGYGNF-UHFFFAOYSA-N 0 0 379.336 3.093 20 5 GGBDRN O=C(CSc1cccc(-c2nn[nH]n2)c1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000823071004 606326029 /nfs/dbraw/zinc/32/60/29/606326029.db2.gz XBBDMQXCHHSNOZ-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=S)Nc2ccccc2-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000822229050 606417284 /nfs/dbraw/zinc/41/72/84/606417284.db2.gz LEHCPZDEJJRRAC-LLVKDONJSA-N 0 0 383.437 3.131 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@H](C)c2ccc(-c3nn[nH]n3)cc2)cc1[N+](=O)[O-] ZINC000822229177 606440736 /nfs/dbraw/zinc/44/07/36/606440736.db2.gz OKIHFPWYTSXMIW-OLZOCXBDSA-N 0 0 395.423 3.205 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[C@H](C)CO1 ZINC000822352161 606476469 /nfs/dbraw/zinc/47/64/69/606476469.db2.gz VPLAUHHMOIITCS-ACJLOTCBSA-N 0 0 380.408 3.050 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(NCC3(CCO)CCCCC3)cc(-c3nn[nH]n3)c2c1 ZINC000823643881 606610130 /nfs/dbraw/zinc/61/01/30/606610130.db2.gz DROPVNKUCRRWJO-UHFFFAOYSA-N 0 0 397.439 3.068 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@]3(CCCc4ccccc43)C2)c(-c2nn[nH]n2)c1 ZINC000823651447 606610360 /nfs/dbraw/zinc/61/03/60/606610360.db2.gz JTSIBQSMNAIJEV-HXUWFJFHSA-N 0 0 391.435 3.044 20 5 GGBDRN CCCCOc1ccc(CCNc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])cc1 ZINC000821077814 606699040 /nfs/dbraw/zinc/69/90/40/606699040.db2.gz UWZMWOPBJNOBCH-UHFFFAOYSA-N 0 0 383.412 3.003 20 5 GGBDRN Cc1[nH]c2c(cc(C)cc2CNc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])c1C ZINC000822200907 606703375 /nfs/dbraw/zinc/70/33/75/606703375.db2.gz IEEHQVNNONVCID-UHFFFAOYSA-N 0 0 378.396 3.189 20 5 GGBDRN COC(=O)c1cc(N[C@@H](C)c2ccc(-c3nn[nH]n3)cc2)cc(C)c1[N+](=O)[O-] ZINC000821668004 606787158 /nfs/dbraw/zinc/78/71/58/606787158.db2.gz KONFIZJULXMFJY-NSHDSACASA-N 0 0 382.380 3.043 20 5 GGBDRN O=[N+]([O-])c1cnc(Sc2cccc(-c3nn[nH]n3)c2)c(Br)c1 ZINC000823651697 606945770 /nfs/dbraw/zinc/94/57/70/606945770.db2.gz NUTPVIVWCBKUFG-UHFFFAOYSA-N 0 0 379.199 3.084 20 5 GGBDRN CCOCCC1(CNc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)CCC1 ZINC000821373393 607032174 /nfs/dbraw/zinc/03/21/74/607032174.db2.gz HXIBPTIOGQNBAF-UHFFFAOYSA-N 0 0 397.439 3.332 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCc3c(Cl)cc(Cl)cc3C2)c(-c2nn[nH]n2)c1 ZINC000823651469 607043808 /nfs/dbraw/zinc/04/38/08/607043808.db2.gz KVZHBKBIWDSLEB-UHFFFAOYSA-N 0 0 392.206 3.039 20 5 GGBDRN CCCCSc1nnc(Sc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])s1 ZINC000821077654 607162341 /nfs/dbraw/zinc/16/23/41/607162341.db2.gz PATPRKIICXTDIS-UHFFFAOYSA-N 0 0 396.483 3.065 20 5 GGBDRN O=[N+]([O-])c1cc(NCc2nnc(-c3cccc(-c4nn[nH]n4)c3)o2)ccc1Cl ZINC000823634224 607166644 /nfs/dbraw/zinc/16/66/44/607166644.db2.gz DWJOXOLXVYBUPM-UHFFFAOYSA-N 0 0 398.770 3.090 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Oc1ccc(-c2nn[nH]n2)cc1F ZINC000820554906 607248537 /nfs/dbraw/zinc/24/85/37/607248537.db2.gz BCEZUPMGCRBZLL-VIFPVBQESA-N 0 0 389.368 3.000 20 5 GGBDRN CN(C)c1cccc([C@@H]2CCCN2c2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)c1 ZINC000825880046 607841651 /nfs/dbraw/zinc/84/16/51/607841651.db2.gz VTPYGQRTXDBNNH-KRWDZBQOSA-N 0 0 379.424 3.182 20 5 GGBDRN C[C@H](Nc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC000824650606 607842676 /nfs/dbraw/zinc/84/26/76/607842676.db2.gz SSWKFQJWTWPZBD-LBPRGKRZSA-N 0 0 376.380 3.134 20 5 GGBDRN O=C(CSc1ccc(-c2nn[nH]n2)cc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000826420779 607845872 /nfs/dbraw/zinc/84/58/72/607845872.db2.gz BSUPEPJWFCUHAD-UHFFFAOYSA-N 0 0 375.797 3.403 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1c(Cl)cc(-c2nn[nH]n2)cc1Cl ZINC000826443506 607964674 /nfs/dbraw/zinc/96/46/74/607964674.db2.gz SBWXLOUTOLFXHJ-UHFFFAOYSA-N 0 0 393.190 3.012 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N(Cc1ccco1)Cc1ccc(O)cc1 ZINC000826497487 608076711 /nfs/dbraw/zinc/07/67/11/608076711.db2.gz JAZFEAPSRYNOCL-UHFFFAOYSA-N 0 0 392.375 3.280 20 5 GGBDRN 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Cc1c(OCc2nnnn2-c2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000054465769 1406744075 /nfs/dbraw/zinc/74/40/75/1406744075.db2.gz LUZWNUDOEBTSOR-UHFFFAOYSA-N 0 0 379.298 3.477 20 5 GGBDRN CNc1ccc(C(=O)NCc2nn(-c3ccccc3)c3c2CCC3)cc1[N+](=O)[O-] ZINC000054590405 1406777946 /nfs/dbraw/zinc/77/79/46/1406777946.db2.gz XVOBCSQAUYDEHM-UHFFFAOYSA-N 0 0 391.431 3.241 20 5 GGBDRN O=C(CCCNC(=O)Cc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)cc1 ZINC000054592952 1406779628 /nfs/dbraw/zinc/77/96/28/1406779628.db2.gz HAHVECCEYRDTGF-UHFFFAOYSA-N 0 0 375.812 3.326 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCCc1ccc(O)cc1 ZINC000054632242 1406792305 /nfs/dbraw/zinc/79/23/05/1406792305.db2.gz OZIXGLRFKAPCMM-UHFFFAOYSA-N 0 0 397.353 3.480 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000054644025 1406793896 /nfs/dbraw/zinc/79/38/96/1406793896.db2.gz IPNGIFSVFFZSTR-MOPGFXCFSA-N 0 0 387.411 3.496 20 5 GGBDRN CCN(C[C@H]1COc2ccccc2O1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000054644601 1406793995 /nfs/dbraw/zinc/79/39/95/1406793995.db2.gz IMBRSXBTIGLMKE-KRWDZBQOSA-N 0 0 385.420 3.009 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000054644027 1406794393 /nfs/dbraw/zinc/79/43/93/1406794393.db2.gz IPNGIFSVFFZSTR-RTBURBONSA-N 0 0 387.411 3.496 20 5 GGBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000054645480 1406794930 /nfs/dbraw/zinc/79/49/30/1406794930.db2.gz FFJUFCGAERFGKX-HNNXBMFYSA-N 0 0 394.435 3.121 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000054645483 1406795116 /nfs/dbraw/zinc/79/51/16/1406795116.db2.gz FFJUFCGAERFGKX-OAHLLOKOSA-N 0 0 394.435 3.121 20 5 GGBDRN CN(C)[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000054645584 1406795124 /nfs/dbraw/zinc/79/51/24/1406795124.db2.gz RARVSVGNCAYMHG-SFHVURJKSA-N 0 0 390.871 3.393 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1cccnc1OC1CCCC1 ZINC000054647324 1406795143 /nfs/dbraw/zinc/79/51/43/1406795143.db2.gz VMQAMPVEAFMIKZ-UHFFFAOYSA-N 0 0 384.436 3.353 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000054646217 1406795407 /nfs/dbraw/zinc/79/54/07/1406795407.db2.gz CTNBZOAGZUMXJE-GOSISDBHSA-N 0 0 397.410 3.099 20 5 GGBDRN C[C@H](NC(=O)NCC(=O)Nc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000054648738 1406795996 /nfs/dbraw/zinc/79/59/96/1406795996.db2.gz DWGCWFLACHXFOI-NSHDSACASA-N 0 0 376.800 3.247 20 5 GGBDRN Cc1noc([C@@H]2CCCN([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000054677673 1406803440 /nfs/dbraw/zinc/80/34/40/1406803440.db2.gz LTHKRMPSKMWVNJ-CMPLNLGQSA-N 0 0 393.831 3.146 20 5 GGBDRN Cc1noc(C2CCN([C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)CC2)n1 ZINC000054678968 1406804173 /nfs/dbraw/zinc/80/41/73/1406804173.db2.gz FUUMWATVFNMUNA-SNVBAGLBSA-N 0 0 393.831 3.146 20 5 GGBDRN Cc1noc(C2CCN([C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)CC2)n1 ZINC000054678966 1406804381 /nfs/dbraw/zinc/80/43/81/1406804381.db2.gz FUUMWATVFNMUNA-JTQLQIEISA-N 0 0 393.831 3.146 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Sc2nncn2C)cc1 ZINC000054732265 1406815848 /nfs/dbraw/zinc/81/58/48/1406815848.db2.gz HCKODWMDMODCPW-UHFFFAOYSA-N 0 0 385.405 3.135 20 5 GGBDRN COc1ccc(C(=O)Nc2ccc(Sc3nncn3C)cc2)cc1[N+](=O)[O-] ZINC000054730928 1406815961 /nfs/dbraw/zinc/81/59/61/1406815961.db2.gz YNDWOVXASSAQCA-UHFFFAOYSA-N 0 0 385.405 3.135 20 5 GGBDRN CCOCCOCc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000054778873 1406823167 /nfs/dbraw/zinc/82/31/67/1406823167.db2.gz RGZNZQYQGSPQCU-UHFFFAOYSA-N 0 0 376.384 3.217 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000054830175 1406833092 /nfs/dbraw/zinc/83/30/92/1406833092.db2.gz CIKYNKFJCUMBFG-UHFFFAOYSA-N 0 0 397.840 3.107 20 5 GGBDRN C[C@H](Cc1ccccc1F)NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000054895561 1406845699 /nfs/dbraw/zinc/84/56/99/1406845699.db2.gz ZUZKKILFMWTATC-SNVBAGLBSA-N 0 0 379.775 3.073 20 5 GGBDRN C[C@@H](Cc1ccccc1F)NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000054895533 1406845793 /nfs/dbraw/zinc/84/57/93/1406845793.db2.gz MQPKVNLFSSWQAB-JTQLQIEISA-N 0 0 379.775 3.073 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCc1ccccc1C(F)(F)F ZINC000054904165 1406847862 /nfs/dbraw/zinc/84/78/62/1406847862.db2.gz UEQGNDSXQIUIPS-UHFFFAOYSA-N 0 0 395.337 3.219 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1nc2ccccc2[nH]1 ZINC000054950195 1406857609 /nfs/dbraw/zinc/85/76/09/1406857609.db2.gz YAHOGFQCPLUCMG-CQSZACIVSA-N 0 0 394.435 3.064 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1nc2ccccc2[nH]1 ZINC000054950215 1406857690 /nfs/dbraw/zinc/85/76/90/1406857690.db2.gz RINDDKIWKPXKPI-CQSZACIVSA-N 0 0 394.435 3.064 20 5 GGBDRN COc1ccc([C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000054950989 1406858290 /nfs/dbraw/zinc/85/82/90/1406858290.db2.gz ZFANVDGNLMJNFP-LJQANCHMSA-N 0 0 384.436 3.466 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@H]2CCOc3c(Cl)cccc32)c([N+](=O)[O-])c1 ZINC000054981956 1406864848 /nfs/dbraw/zinc/86/48/48/1406864848.db2.gz BGKPXIQFIDOTJJ-ZDUSSCGKSA-N 0 0 397.840 3.092 20 5 GGBDRN CNC(=O)c1ccc(NCC2(c3ccc(F)cc3)CCOCC2)c([N+](=O)[O-])c1 ZINC000054981885 1406865040 /nfs/dbraw/zinc/86/50/40/1406865040.db2.gz WXZRRFXRGYZLBT-UHFFFAOYSA-N 0 0 387.411 3.254 20 5 GGBDRN O=C(CCOc1ccccc1)N1CCC(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000055012802 1406870467 /nfs/dbraw/zinc/87/04/67/1406870467.db2.gz RBXCEAZVUHNJDB-UHFFFAOYSA-N 0 0 397.431 3.241 20 5 GGBDRN CN(Cc1c(F)cccc1Cl)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000055016491 1406871166 /nfs/dbraw/zinc/87/11/66/1406871166.db2.gz VTUFYTYWAKWLSC-UHFFFAOYSA-N 0 0 377.601 3.436 20 5 GGBDRN Cc1ccc(CN(CCc2ccccc2)C(=O)Cn2ccc([N+](=O)[O-])n2)s1 ZINC000055040571 1406875834 /nfs/dbraw/zinc/87/58/34/1406875834.db2.gz PLMLKWWAJGWBPN-UHFFFAOYSA-N 0 0 384.461 3.433 20 5 GGBDRN CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(C)c(C)c1 ZINC000055106022 1406886498 /nfs/dbraw/zinc/88/64/98/1406886498.db2.gz DTHHIWGRTGELOF-AWEZNQCLSA-N 0 0 391.449 3.295 20 5 GGBDRN CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(C)c(F)c1 ZINC000055126805 1406891042 /nfs/dbraw/zinc/89/10/42/1406891042.db2.gz PAUDNVSWKDPOFR-CYBMUJFWSA-N 0 0 395.412 3.126 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@@H](C)c1cc(F)ccc1OC ZINC000055152660 1406895091 /nfs/dbraw/zinc/89/50/91/1406895091.db2.gz VAJCBVGMALAFPW-RYUDHWBXSA-N 0 0 391.399 3.429 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@H](C)c1cc(F)ccc1OC ZINC000055152661 1406895197 /nfs/dbraw/zinc/89/51/97/1406895197.db2.gz VAJCBVGMALAFPW-NEPJUHHUSA-N 0 0 391.399 3.429 20 5 GGBDRN CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1cccc(C)c1C ZINC000055162217 1406896474 /nfs/dbraw/zinc/89/64/74/1406896474.db2.gz OGYKFQZNSUCLMA-CQSZACIVSA-N 0 0 391.449 3.295 20 5 GGBDRN CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1cccc(Cl)c1 ZINC000055186529 1406899508 /nfs/dbraw/zinc/89/95/08/1406899508.db2.gz HPUGTTBXIZUNDX-LBPRGKRZSA-N 0 0 397.840 3.331 20 5 GGBDRN COCCn1c(C)c(C)nc1S[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000055250425 1406913188 /nfs/dbraw/zinc/91/31/88/1406913188.db2.gz DUBFDCJXXDDCSX-ZDUSSCGKSA-N 0 0 378.454 3.174 20 5 GGBDRN CCOc1ccc(CCC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000055260351 1406915787 /nfs/dbraw/zinc/91/57/87/1406915787.db2.gz WKMMKKOQHTXYNP-UHFFFAOYSA-N 0 0 383.448 3.275 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@@H]1CCc1ccccc1 ZINC000055264040 1406916432 /nfs/dbraw/zinc/91/64/32/1406916432.db2.gz UXYBPJNMVLTORD-MRXNPFEDSA-N 0 0 390.461 3.389 20 5 GGBDRN COc1ccc(CCC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000055293231 1406922746 /nfs/dbraw/zinc/92/27/46/1406922746.db2.gz IGMUZEISNLRYKJ-UHFFFAOYSA-N 0 0 377.828 3.418 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000055297380 1406923562 /nfs/dbraw/zinc/92/35/62/1406923562.db2.gz RZMJZHPIDGLJLZ-UHFFFAOYSA-N 0 0 385.420 3.070 20 5 GGBDRN CCn1cnnc1-c1cccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000055305142 1406925302 /nfs/dbraw/zinc/92/53/02/1406925302.db2.gz MJTPCOLRFUHMFU-UHFFFAOYSA-N 0 0 381.392 3.281 20 5 GGBDRN CNc1ccc(C(=O)N2CCC(C(=O)c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000055315189 1406926990 /nfs/dbraw/zinc/92/69/90/1406926990.db2.gz VDDVYHVJMSWYAO-UHFFFAOYSA-N 0 0 383.404 3.077 20 5 GGBDRN CC(C)(C)c1cc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n(-c2ccc(F)cc2)n1 ZINC000055324729 1406930615 /nfs/dbraw/zinc/93/06/15/1406930615.db2.gz MTSPTQGYHKWCSD-UHFFFAOYSA-N 0 0 386.387 3.052 20 5 GGBDRN CCN(CC)C(=O)c1ccc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000055326446 1406931145 /nfs/dbraw/zinc/93/11/45/1406931145.db2.gz PSTMPNVJNYRQIL-UHFFFAOYSA-N 0 0 399.447 3.162 20 5 GGBDRN NC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 ZINC000055333404 1406932303 /nfs/dbraw/zinc/93/23/03/1406932303.db2.gz VHDRCBGCQUWNPN-UHFFFAOYSA-N 0 0 397.435 3.006 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1cccnc1OC1CCCC1 ZINC000055342983 1406935548 /nfs/dbraw/zinc/93/55/48/1406935548.db2.gz QQCNASVBYJGXKV-UHFFFAOYSA-N 0 0 385.420 3.397 20 5 GGBDRN CCN1C(=S)N=NC1[C@H]1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000176269292 1428210071 /nfs/dbraw/zinc/21/00/71/1428210071.db2.gz QYOGALPBQHSZSF-JTQLQIEISA-N 0 0 395.872 3.168 20 5 GGBDRN COc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000001982780 1398303722 /nfs/dbraw/zinc/30/37/22/1398303722.db2.gz FWXGKJPGYHDBCF-SNVBAGLBSA-N 0 0 378.768 3.441 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1ccccc1[N+](=O)[O-] ZINC000001981588 1398304152 /nfs/dbraw/zinc/30/41/52/1398304152.db2.gz HANYKRPFSUJJRM-JTQLQIEISA-N 0 0 378.768 3.441 20 5 GGBDRN CCOc1ccc(NC(=O)COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000003234611 1398329226 /nfs/dbraw/zinc/32/92/26/1398329226.db2.gz DXNCKDVNAHCRCA-UHFFFAOYSA-N 0 0 378.768 3.442 20 5 GGBDRN CCOc1ccc(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000003231781 1398329249 /nfs/dbraw/zinc/32/92/49/1398329249.db2.gz MCTAYJGFTGUJGF-UHFFFAOYSA-N 0 0 378.768 3.442 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000003312411 1398334075 /nfs/dbraw/zinc/33/40/75/1398334075.db2.gz KFFAPXWJRAAIFE-RUDMXATFSA-N 0 0 390.779 3.452 20 5 GGBDRN Cc1ccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000003383927 1398339592 /nfs/dbraw/zinc/33/95/92/1398339592.db2.gz SQFSVFQZYFVVST-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN O=C(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])NCCc1ccc(Cl)cc1 ZINC000003386388 1398339670 /nfs/dbraw/zinc/33/96/70/1398339670.db2.gz PVOYZDSHSYBOPM-UHFFFAOYSA-N 0 0 397.214 3.417 20 5 GGBDRN CC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000003386498 1398340130 /nfs/dbraw/zinc/34/01/30/1398340130.db2.gz PDRWZWPOXKZEAB-UHFFFAOYSA-N 0 0 376.752 3.246 20 5 GGBDRN COCCn1c(C)cc(C(=O)COC(=O)C=Cc2ccc([N+](=O)[O-])cc2)c1C ZINC000003389801 1398340364 /nfs/dbraw/zinc/34/03/64/1398340364.db2.gz HSQSLHBVNSMCTJ-RMKNXTFCSA-N 0 0 386.404 3.099 20 5 GGBDRN C[C@@H](OC(=O)COc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000003388658 1398340409 /nfs/dbraw/zinc/34/04/09/1398340409.db2.gz YSCHUYGSTUCITD-LLVKDONJSA-N 0 0 378.768 3.197 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1398899739 /nfs/dbraw/zinc/89/97/39/1398899739.db2.gz HHYHEQAICNNHEZ-LLVKDONJSA-N 0 0 395.462 3.086 20 5 GGBDRN Cc1cc(C)cc(OCC(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000010589336 1398902129 /nfs/dbraw/zinc/90/21/29/1398902129.db2.gz DCYONIDEBPRKDN-UHFFFAOYSA-N 0 0 392.795 3.426 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000010621116 1398904088 /nfs/dbraw/zinc/90/40/88/1398904088.db2.gz GITYQQALGJRKNY-AWEZNQCLSA-N 0 0 381.388 3.428 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000010621971 1398904161 /nfs/dbraw/zinc/90/41/61/1398904161.db2.gz WGPCLGPFGCNQSI-CQSZACIVSA-N 0 0 381.388 3.428 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)Cn2c(C)cc3ccccc32)c([N+](=O)[O-])c1 ZINC000010620964 1398904218 /nfs/dbraw/zinc/90/42/18/1398904218.db2.gz JOGRRBSGJPMCMY-UHFFFAOYSA-N 0 0 397.387 3.048 20 5 GGBDRN Cc1cc2ccccc2n1CC(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000010621958 1398904265 /nfs/dbraw/zinc/90/42/65/1398904265.db2.gz 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1398969888 /nfs/dbraw/zinc/96/98/88/1398969888.db2.gz OVAXPMZNIAQQSF-MRXNPFEDSA-N 0 0 399.447 3.434 20 5 GGBDRN Cc1ccccc1-c1noc(COC(=O)CCNc2ccccc2[N+](=O)[O-])n1 ZINC000011315339 1398969921 /nfs/dbraw/zinc/96/99/21/1398969921.db2.gz GEZYXMGWCNVKCB-UHFFFAOYSA-N 0 0 382.376 3.499 20 5 GGBDRN C[C@@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cn1 ZINC000011313829 1398969934 /nfs/dbraw/zinc/96/99/34/1398969934.db2.gz PBINEPUEMYZXTG-LLVKDONJSA-N 0 0 392.799 3.016 20 5 GGBDRN CC[C@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1 ZINC000011320945 1398969960 /nfs/dbraw/zinc/96/99/60/1398969960.db2.gz LUGAOQQQQJLUQK-KRWDZBQOSA-N 0 0 388.445 3.325 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(N3CCCC3)c(C)c2)ccc1[N+](=O)[O-] ZINC000011326013 1398970169 /nfs/dbraw/zinc/97/01/69/1398970169.db2.gz FTVGXHLVUOBEAB-UHFFFAOYSA-N 0 0 396.447 3.180 20 5 GGBDRN COc1ccc(C(=O)OCC(=O)N[C@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000011359130 1398972429 /nfs/dbraw/zinc/97/24/29/1398972429.db2.gz 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Cc1nn(Cc2ccc(C(=O)N[C@H](C)c3ccccn3)cc2)c(C)c1[N+](=O)[O-] ZINC000011367709 1398974649 /nfs/dbraw/zinc/97/46/49/1398974649.db2.gz JDTXSZCJGGFEQC-CYBMUJFWSA-N 0 0 379.420 3.342 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](OC(=O)[C@H]2CCCO2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000011392912 1398976544 /nfs/dbraw/zinc/97/65/44/1398976544.db2.gz SMJGAGUBQYMPTI-MSOLQXFVSA-N 0 0 384.388 3.305 20 5 GGBDRN CCCc1cc(=O)[nH]c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000011443227 1398980941 /nfs/dbraw/zinc/98/09/41/1398980941.db2.gz PQAPPMBUZQWLAR-SECBINFHSA-N 0 0 396.856 3.403 20 5 GGBDRN CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1 ZINC000011443724 1398981299 /nfs/dbraw/zinc/98/12/99/1398981299.db2.gz QFYPYHZHIRXQRE-UHFFFAOYSA-N 0 0 382.829 3.427 20 5 GGBDRN Cc1cccc(-c2nnc(SCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)n2C)c1 ZINC000011450356 1398981852 /nfs/dbraw/zinc/98/18/52/1398981852.db2.gz ROGYLPJFUQSWEJ-UHFFFAOYSA-N 0 0 397.460 3.454 20 5 GGBDRN C[C@@H](OC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000011462904 1398982569 /nfs/dbraw/zinc/98/25/69/1398982569.db2.gz PLNQRUVPOCFDKL-SNVBAGLBSA-N 0 0 380.303 3.380 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])OCc1cc(=O)oc2cc3c(cc12)CCC3 ZINC000011467881 1398982764 /nfs/dbraw/zinc/98/27/64/1398982764.db2.gz ZWGNZJBABQIRNI-UHFFFAOYSA-N 0 0 379.368 3.476 20 5 GGBDRN C[C@H](OC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000011462898 1398982989 /nfs/dbraw/zinc/98/29/89/1398982989.db2.gz PLNQRUVPOCFDKL-JTQLQIEISA-N 0 0 380.303 3.380 20 5 GGBDRN COc1cccc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000011479300 1398983836 /nfs/dbraw/zinc/98/38/36/1398983836.db2.gz OLZCOMRYDKXNNE-JTQLQIEISA-N 0 0 378.768 3.441 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccc(COCC(F)(F)F)cc1 ZINC000011483595 1398984662 /nfs/dbraw/zinc/98/46/62/1398984662.db2.gz HODLZPKYJRNHKZ-UHFFFAOYSA-N 0 0 398.337 3.369 20 5 GGBDRN Cc1c(C(=O)NCc2ccc(OC(F)F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000011511368 1398988316 /nfs/dbraw/zinc/98/83/16/1398988316.db2.gz 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ZINC000012826083 1399060033 /nfs/dbraw/zinc/06/00/33/1399060033.db2.gz FZMIXYAZCCYWGK-UHFFFAOYSA-N 0 0 381.291 3.343 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)CCc1ccc(Cl)cc1 ZINC000012950641 1399067924 /nfs/dbraw/zinc/06/79/24/1399067924.db2.gz JJKGMVZQCUAULN-UHFFFAOYSA-N 0 0 392.795 3.371 20 5 GGBDRN CSc1cccc(N2C[C@@H](C(=O)OCc3cccc([N+](=O)[O-])c3)CC2=O)c1 ZINC000012960196 1399068738 /nfs/dbraw/zinc/06/87/38/1399068738.db2.gz UTYBHMJSHXCIEX-AWEZNQCLSA-N 0 0 386.429 3.413 20 5 GGBDRN CSc1cccc(N2C[C@@H](C(=O)OCc3ccccc3[N+](=O)[O-])CC2=O)c1 ZINC000012960261 1399069274 /nfs/dbraw/zinc/06/92/74/1399069274.db2.gz RCLCUJIWZVEMGB-AWEZNQCLSA-N 0 0 386.429 3.413 20 5 GGBDRN COC(=O)c1ccc(OC(=O)c2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000014039959 1399083921 /nfs/dbraw/zinc/08/39/21/1399083921.db2.gz CCFDJYRILQAUFX-UHFFFAOYSA-N 0 0 380.150 3.363 20 5 GGBDRN COc1ccc(S(=O)(=O)Oc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000014099023 1399086417 /nfs/dbraw/zinc/08/64/17/1399086417.db2.gz 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ZINC000028005653 1400117065 /nfs/dbraw/zinc/11/70/65/1400117065.db2.gz PVINKPQNRCSDMG-ZDUSSCGKSA-N 0 0 395.415 3.259 20 5 GGBDRN CCc1cc2c(ncn(CC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c2=O)s1 ZINC000028032607 1400120989 /nfs/dbraw/zinc/12/09/89/1400120989.db2.gz WSMHTJURCUAQAQ-UHFFFAOYSA-N 0 0 392.824 3.221 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCCCOc1ccc(F)cc1 ZINC000028057234 1400123642 /nfs/dbraw/zinc/12/36/42/1400123642.db2.gz ITKUHUBPKWVACF-UHFFFAOYSA-N 0 0 382.413 3.180 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(Cc2ccsc2)CC1 ZINC000028094794 1400129321 /nfs/dbraw/zinc/12/93/21/1400129321.db2.gz YGCVICXFOWENAM-CQSZACIVSA-N 0 0 391.518 3.481 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)OC)c2ccccc2)cc1OC ZINC000028174519 1400136264 /nfs/dbraw/zinc/13/62/64/1400136264.db2.gz KIYYFYROLNBUCY-QGZVFWFLSA-N 0 0 389.360 3.073 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)OC)c2ccccc2)cc1OC ZINC000028174523 1400136629 /nfs/dbraw/zinc/13/66/29/1400136629.db2.gz KIYYFYROLNBUCY-KRWDZBQOSA-N 0 0 389.360 3.073 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1[N+](=O)[O-] ZINC000028251261 1400143451 /nfs/dbraw/zinc/14/34/51/1400143451.db2.gz XGEQDRUNJOMSTG-UHFFFAOYSA-N 0 0 375.406 3.053 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Oc2ccc(N3CCCC3=O)cc2)cc([N+](=O)[O-])c1 ZINC000028256648 1400144101 /nfs/dbraw/zinc/14/41/01/1400144101.db2.gz XHHFZVDELCIYQZ-UHFFFAOYSA-N 0 0 398.371 3.118 20 5 GGBDRN Cc1ccc(C)c(OCC(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000028303014 1400147725 /nfs/dbraw/zinc/14/77/25/1400147725.db2.gz NPCARHNHIACPQG-UHFFFAOYSA-N 0 0 392.795 3.426 20 5 GGBDRN O=C(OCc1nnnn1Cc1ccccc1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000028298929 1400147754 /nfs/dbraw/zinc/14/77/54/1400147754.db2.gz PANBBALTDRHJJK-UHFFFAOYSA-N 0 0 395.400 3.201 20 5 GGBDRN O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)OCc1cccc([N+](=O)[O-])c1 ZINC000028376240 1400156816 /nfs/dbraw/zinc/15/68/16/1400156816.db2.gz PJJXFHXTEDDJCD-UHFFFAOYSA-N 0 0 383.187 3.375 20 5 GGBDRN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])cn1C ZINC000028383603 1400158442 /nfs/dbraw/zinc/15/84/42/1400158442.db2.gz NHGWROHSBWNDMY-LLVKDONJSA-N 0 0 399.359 3.066 20 5 GGBDRN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])cn1C ZINC000028383610 1400158456 /nfs/dbraw/zinc/15/84/56/1400158456.db2.gz NHGWROHSBWNDMY-NSHDSACASA-N 0 0 399.359 3.066 20 5 GGBDRN C[C@H](NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])cn1C)c1cc2ccccc2o1 ZINC000028385522 1400158485 /nfs/dbraw/zinc/15/84/85/1400158485.db2.gz PPMAYGHQPKIMEM-RYUDHWBXSA-N 0 0 385.376 3.102 20 5 GGBDRN O=C(COC(=O)c1ccc([N+](=O)[O-])s1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000028386355 1400158824 /nfs/dbraw/zinc/15/88/24/1400158824.db2.gz FJPCBSQVJZHBCT-UHFFFAOYSA-N 0 0 385.741 3.013 20 5 GGBDRN Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2cc([N+](=O)[O-])cn2C)c(Cl)c1 ZINC000028384319 1400158909 /nfs/dbraw/zinc/15/89/09/1400158909.db2.gz TZGNLXRURCTACD-LLVKDONJSA-N 0 0 379.800 3.388 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)NCc2ccccc2F)c1 ZINC000028401089 1400160587 /nfs/dbraw/zinc/16/05/87/1400160587.db2.gz MBNUFBTWWPVZCD-NSHDSACASA-N 0 0 392.408 3.318 20 5 GGBDRN O=C(CSc1ccccc1C(=O)NCc1ccc([N+](=O)[O-])cc1)N1CCCC1 ZINC000055797230 1407085023 /nfs/dbraw/zinc/08/50/23/1407085023.db2.gz KBLCCUUYAONOIU-UHFFFAOYSA-N 0 0 399.472 3.239 20 5 GGBDRN C[C@H]1CN(Cc2ccc(C(=O)NCc3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1 ZINC000055798073 1407085166 /nfs/dbraw/zinc/08/51/66/1407085166.db2.gz QFVMPWLZIGQPFG-HOTGVXAUSA-N 0 0 383.448 3.134 20 5 GGBDRN CCOc1ccc(C(=O)N[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000055797333 1407085177 /nfs/dbraw/zinc/08/51/77/1407085177.db2.gz IKPDAZZNPAWAHK-LJQANCHMSA-N 0 0 399.447 3.064 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)N(C)Cc1ccc(Cl)s1 ZINC000028422891 1400164092 /nfs/dbraw/zinc/16/40/92/1400164092.db2.gz KBLCVYYCPUNIOP-UHFFFAOYSA-N 0 0 382.825 3.434 20 5 GGBDRN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)OC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000028424098 1400165061 /nfs/dbraw/zinc/16/50/61/1400165061.db2.gz CKFCDYLFGLDVOY-ZIAGYGMSSA-N 0 0 386.404 3.335 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000028424139 1400165109 /nfs/dbraw/zinc/16/51/09/1400165109.db2.gz FCENXXURCPEEBO-DZGCQCFKSA-N 0 0 384.388 3.089 20 5 GGBDRN CC(C)CCN(CCC(C)C)C(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O ZINC000028430431 1400165572 /nfs/dbraw/zinc/16/55/72/1400165572.db2.gz YGTDXHHXELDDNK-UHFFFAOYSA-N 0 0 389.452 3.112 20 5 GGBDRN COc1cc(CC(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1C ZINC000028429842 1400165654 /nfs/dbraw/zinc/16/56/54/1400165654.db2.gz HVAZRQCBJOOGIW-AWEZNQCLSA-N 0 0 386.404 3.333 20 5 GGBDRN Cc1ccc(NC(=O)CS[C@H](C)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000055797017 1407085372 /nfs/dbraw/zinc/08/53/72/1407085372.db2.gz BFPOXNSLMQDTFM-CQSZACIVSA-N 0 0 387.461 3.280 20 5 GGBDRN CCN(CC)C(=O)COC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000028442481 1400166163 /nfs/dbraw/zinc/16/61/63/1400166163.db2.gz OOPHZWWVESAFKS-HUUCEWRRSA-N 0 0 391.468 3.102 20 5 GGBDRN CC[C@H](C)NC(=O)COC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000028442462 1400166202 /nfs/dbraw/zinc/16/62/02/1400166202.db2.gz CDYBGJCGWDHLEP-ZNMIVQPWSA-N 0 0 391.468 3.149 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cnn(-c2ccccc2)c1C1CC1 ZINC000028442159 1400166480 /nfs/dbraw/zinc/16/64/80/1400166480.db2.gz GQZBSGSUTBPIBW-UHFFFAOYSA-N 0 0 391.431 3.500 20 5 GGBDRN CCOc1ccc(C=O)c(OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000028452079 1400166996 /nfs/dbraw/zinc/16/69/96/1400166996.db2.gz CUGGNITYSPKSGL-UHFFFAOYSA-N 0 0 378.768 3.477 20 5 GGBDRN Cc1ccc([C@H]2NC(=S)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)s1 ZINC000028470087 1400169277 /nfs/dbraw/zinc/16/92/77/1400169277.db2.gz XUHOZQFZVWCZDD-OAHLLOKOSA-N 0 0 388.474 3.396 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cnn(-c2ccccn2)c1C(F)(F)F ZINC000055798503 1407085729 /nfs/dbraw/zinc/08/57/29/1407085729.db2.gz XFRASKPGTBRGJY-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN CCOc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C)c1 ZINC000055805071 1407086278 /nfs/dbraw/zinc/08/62/78/1407086278.db2.gz VULHTXOUSOVJIR-UHFFFAOYSA-N 0 0 389.433 3.132 20 5 GGBDRN Cc1cc(C)c(OCC(=O)OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c(C)c1 ZINC000028606668 1400176522 /nfs/dbraw/zinc/17/65/22/1400176522.db2.gz ODWCQRJGBMXICD-UHFFFAOYSA-N 0 0 390.367 3.220 20 5 GGBDRN C[C@@H](Sc1nc2sccc2c(=O)n1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000028607514 1400177089 /nfs/dbraw/zinc/17/70/89/1400177089.db2.gz SGPUSYIFGWJRPA-SECBINFHSA-N 0 0 390.446 3.023 20 5 GGBDRN O=C(/C=C/c1ccc(O)cc1)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000028613902 1400177726 /nfs/dbraw/zinc/17/77/26/1400177726.db2.gz ZVLBXXXEKDHGCL-FPYGCLRLSA-N 0 0 376.752 3.149 20 5 GGBDRN O=C(/C=C/c1ccc(O)cc1)OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000028613925 1400177796 /nfs/dbraw/zinc/17/77/96/1400177796.db2.gz ONIUNCARIWDMRO-FPYGCLRLSA-N 0 0 376.752 3.149 20 5 GGBDRN COc1ccc(OCCC(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000028614681 1400177825 /nfs/dbraw/zinc/17/78/25/1400177825.db2.gz IRZHCDSHJTZFCI-UHFFFAOYSA-N 0 0 399.359 3.166 20 5 GGBDRN CCOc1ccc(CN2CCN(c3nc4sccn4c3[N+](=O)[O-])CC2)cc1 ZINC000028620780 1400178299 /nfs/dbraw/zinc/17/82/99/1400178299.db2.gz NVSHAZOZPSHQBZ-UHFFFAOYSA-N 0 0 387.465 3.025 20 5 GGBDRN CCNc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccccc2OC)cc1[N+](=O)[O-] ZINC000028631433 1400178998 /nfs/dbraw/zinc/17/89/98/1400178998.db2.gz AUMUCFJRKHEAFR-GFCCVEGCSA-N 0 0 387.392 3.219 20 5 GGBDRN C[C@H](OC(=O)COc1ccccc1F)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000028674265 1400183387 /nfs/dbraw/zinc/18/33/87/1400183387.db2.gz HYDMJOUNYJWSBC-JTQLQIEISA-N 0 0 396.758 3.337 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)OCC(=O)c3ccc[nH]3)cc2[N+](=O)[O-])C1 ZINC000028673010 1400183485 /nfs/dbraw/zinc/18/34/85/1400183485.db2.gz GSGSXFYUTBFRAE-KBPBESRZSA-N 0 0 385.420 3.445 20 5 GGBDRN O=C(CN(Cc1ccc(F)cc1)C1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000028726552 1400189668 /nfs/dbraw/zinc/18/96/68/1400189668.db2.gz PCCKCCXBNDLXJJ-UHFFFAOYSA-N 0 0 387.367 3.066 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775201 1400194299 /nfs/dbraw/zinc/19/42/99/1400194299.db2.gz AVNYZFODBFCAAF-HZPDHXFCSA-N 0 0 394.471 3.391 20 5 GGBDRN CC(C)CCNC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775184 1400194585 /nfs/dbraw/zinc/19/45/85/1400194585.db2.gz IMTQZFQNMWDIMP-MRXNPFEDSA-N 0 0 394.471 3.249 20 5 GGBDRN CC(C)CCNC(=O)[C@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775187 1400194681 /nfs/dbraw/zinc/19/46/81/1400194681.db2.gz IMTQZFQNMWDIMP-INIZCTEOSA-N 0 0 394.471 3.249 20 5 GGBDRN CC[C@H](C)NC(=O)[C@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000028775163 1400194688 /nfs/dbraw/zinc/19/46/88/1400194688.db2.gz HRWNMQDSKPCMJL-GJZGRUSLSA-N 0 0 380.444 3.001 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2cc3c(cc2Cl)OCO3)ccc1Cl ZINC000028782145 1400195309 /nfs/dbraw/zinc/19/53/09/1400195309.db2.gz BSXGVABFGPMEGC-UHFFFAOYSA-N 0 0 391.188 3.431 20 5 GGBDRN CCOC(=O)/C=C/c1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000028781861 1400195542 /nfs/dbraw/zinc/19/55/42/1400195542.db2.gz MQGHWSNLKHHDDO-YRNVUSSQSA-N 0 0 390.417 3.280 20 5 GGBDRN Cc1ccc(C)c(OCCC(=O)OCC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000028786820 1400195995 /nfs/dbraw/zinc/19/59/95/1400195995.db2.gz YHPCYSDIDCBEFX-UHFFFAOYSA-N 0 0 386.404 3.471 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccccc1Cn1cccn1 ZINC000028793808 1400196916 /nfs/dbraw/zinc/19/69/16/1400196916.db2.gz MFJCVEWFXKHPJK-UHFFFAOYSA-N 0 0 382.445 3.248 20 5 GGBDRN O=c1[nH]cnc2cc(NCc3ccc(OC(F)(F)F)cc3)c([N+](=O)[O-])cc12 ZINC000028800650 1400197706 /nfs/dbraw/zinc/19/77/06/1400197706.db2.gz MDPZGHDPDYDERV-UHFFFAOYSA-N 0 0 380.282 3.342 20 5 GGBDRN COc1ccccc1CC(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000028801927 1400197767 /nfs/dbraw/zinc/19/77/67/1400197767.db2.gz XMHRTAZSINWYJH-NSHDSACASA-N 0 0 392.795 3.370 20 5 GGBDRN 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ZINC000028833922 1400200995 /nfs/dbraw/zinc/20/09/95/1400200995.db2.gz QRDVBBJJFJORGR-UHFFFAOYSA-N 0 0 393.447 3.409 20 5 GGBDRN C[C@H]1CCc2ccccc2N1C(=O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000028928280 1400213469 /nfs/dbraw/zinc/21/34/69/1400213469.db2.gz KMGIRGHLULKUPX-KRWDZBQOSA-N 0 0 394.475 3.085 20 5 GGBDRN C[C@H]1CCc2ccccc2N1C(=O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000028932200 1400213893 /nfs/dbraw/zinc/21/38/93/1400213893.db2.gz CYZYDKMUOWZRNK-KRWDZBQOSA-N 0 0 394.475 3.085 20 5 GGBDRN CC1CCN(Cc2csc(NC(=O)COc3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000028934079 1400214064 /nfs/dbraw/zinc/21/40/64/1400214064.db2.gz BHDMCXMVXFQEEW-UHFFFAOYSA-N 0 0 390.465 3.301 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000028947106 1400214978 /nfs/dbraw/zinc/21/49/78/1400214978.db2.gz ZMGZUJYGSWUIIS-MRXNPFEDSA-N 0 0 385.811 3.083 20 5 GGBDRN NC(=O)CCn1c(SCc2cccc([N+](=O)[O-])c2)nnc1-c1cccs1 ZINC000028947501 1400215673 /nfs/dbraw/zinc/21/56/73/1400215673.db2.gz 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ZINC000045918473 1404242835 /nfs/dbraw/zinc/24/28/35/1404242835.db2.gz GTUCXVFVZPNQNU-LBPRGKRZSA-N 0 0 396.852 3.242 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000045939044 1404247794 /nfs/dbraw/zinc/24/77/94/1404247794.db2.gz QKLMHZLQZGIICY-AWEZNQCLSA-N 0 0 385.420 3.275 20 5 GGBDRN CC(C)(C)C(=O)N1CCC(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000045960008 1404252020 /nfs/dbraw/zinc/25/20/20/1404252020.db2.gz YQTCUBQHVQTTDK-UHFFFAOYSA-N 0 0 382.848 3.407 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCCc1ccc(OC(F)(F)F)cc1 ZINC000045964476 1404254364 /nfs/dbraw/zinc/25/43/64/1404254364.db2.gz GOIWIBJXXUIXMT-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCc1ccc(OC(F)(F)F)cc1 ZINC000045966017 1404255750 /nfs/dbraw/zinc/25/57/50/1404255750.db2.gz IHGXNPIWQOYPHG-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN COCCOc1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1OC ZINC000045968315 1404256600 /nfs/dbraw/zinc/25/66/00/1404256600.db2.gz 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COCc1ccccc1NC(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000046032846 1404280450 /nfs/dbraw/zinc/28/04/50/1404280450.db2.gz FJDSDPHIKSFKJF-UHFFFAOYSA-N 0 0 389.408 3.123 20 5 GGBDRN CCOc1ccc([C@H](C)NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1OC ZINC000046033966 1404280674 /nfs/dbraw/zinc/28/06/74/1404280674.db2.gz BYRGHCRYDVIDKV-ZDUSSCGKSA-N 0 0 394.449 3.350 20 5 GGBDRN C[C@H](C1CC1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)C1CC1 ZINC000046058754 1404285883 /nfs/dbraw/zinc/28/58/83/1404285883.db2.gz NSAHSFJARMMZLE-LLVKDONJSA-N 0 0 387.465 3.278 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(C[C@@H](O)COCc3ccccc3Cl)n2)cc1 ZINC000046060844 1404286273 /nfs/dbraw/zinc/28/62/73/1404286273.db2.gz SHAUPDBISPCTDT-MRXNPFEDSA-N 0 0 388.811 3.084 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1Cl ZINC000046072700 1404290698 /nfs/dbraw/zinc/29/06/98/1404290698.db2.gz USFNUBXEVVEFOU-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN COC(=O)c1cc(C(=O)NCCCCOc2ccc(C)cc2)cc([N+](=O)[O-])c1 ZINC000046104681 1404296906 /nfs/dbraw/zinc/29/69/06/1404296906.db2.gz OZHREKWSUISFGM-UHFFFAOYSA-N 0 0 386.404 3.279 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)Nc3cccc([N+](=O)[O-])c3C)cn2)n1 ZINC000046120151 1404304920 /nfs/dbraw/zinc/30/49/20/1404304920.db2.gz GHVVNHWJJQTEBR-UHFFFAOYSA-N 0 0 380.408 3.422 20 5 GGBDRN O=C(Nc1cccc(OC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1)C1CC1 ZINC000046124022 1404305266 /nfs/dbraw/zinc/30/52/66/1404305266.db2.gz YUHARNDUWNEASH-UHFFFAOYSA-N 0 0 392.371 3.348 20 5 GGBDRN O=C(Oc1cccc(NC(=O)C2CC2)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000046129241 1404307699 /nfs/dbraw/zinc/30/76/99/1404307699.db2.gz ZNSKOXUNBAJKNZ-UHFFFAOYSA-N 0 0 392.371 3.348 20 5 GGBDRN O=C(CNC(=O)COc1cccc([N+](=O)[O-])c1)Nc1cc(Cl)ccc1Cl ZINC000046143618 1404310889 /nfs/dbraw/zinc/31/08/89/1404310889.db2.gz NVWNOLYXRXSBJN-UHFFFAOYSA-N 0 0 398.202 3.035 20 5 GGBDRN Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC000046147611 1404311241 /nfs/dbraw/zinc/31/12/41/1404311241.db2.gz 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Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000046149723 1404312567 /nfs/dbraw/zinc/31/25/67/1404312567.db2.gz MQZHYDMDGNBAMO-GOSISDBHSA-N 0 0 381.432 3.072 20 5 GGBDRN C[C@H]1CN(Cc2ccc(C(=O)NCc3ccccc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000046149148 1404312672 /nfs/dbraw/zinc/31/26/72/1404312672.db2.gz NAWAOQGZZCNVSF-HOTGVXAUSA-N 0 0 383.448 3.134 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1 ZINC000046162423 1404316725 /nfs/dbraw/zinc/31/67/25/1404316725.db2.gz HWVPFWTZHLTVOJ-KRWDZBQOSA-N 0 0 381.432 3.323 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1cc(Cl)c2c(c1)OCCCO2 ZINC000046167821 1404317854 /nfs/dbraw/zinc/31/78/54/1404317854.db2.gz PCBLHGHNVMMUNW-UHFFFAOYSA-N 0 0 392.795 3.105 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(OCC(F)(F)F)cc1 ZINC000046167411 1404318078 /nfs/dbraw/zinc/31/80/78/1404318078.db2.gz OLMRJJAYRCMJJD-UHFFFAOYSA-N 0 0 383.326 3.378 20 5 GGBDRN COc1ccc(CSCC(=O)NCCN(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000046176329 1404321206 /nfs/dbraw/zinc/32/12/06/1404321206.db2.gz HSZPNSJUOFJMOU-UHFFFAOYSA-N 0 0 389.477 3.089 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000046178784 1404322021 /nfs/dbraw/zinc/32/20/21/1404322021.db2.gz AADILYDNTVWJLO-UHFFFAOYSA-N 0 0 380.404 3.499 20 5 GGBDRN COc1ccc(CSCC(=O)Nc2ccccc2-n2cncn2)cc1[N+](=O)[O-] ZINC000046198246 1404327906 /nfs/dbraw/zinc/32/79/06/1404327906.db2.gz WAHXNYJXVPTGNK-UHFFFAOYSA-N 0 0 399.432 3.056 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2 ZINC000046207958 1404331106 /nfs/dbraw/zinc/33/11/06/1404331106.db2.gz MVDWRYJUFBFCEK-ZDUSSCGKSA-N 0 0 394.431 3.181 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(NC(=O)C(C)C)c2)c([N+](=O)[O-])cc1OC ZINC000046220708 1404335690 /nfs/dbraw/zinc/33/56/90/1404335690.db2.gz ALFFQWOVHHAWPB-UHFFFAOYSA-N 0 0 387.392 3.459 20 5 GGBDRN O=C(CNc1cc([N+](=O)[O-])ccc1NCCO)Nc1ccccc1C(F)(F)F ZINC000046228198 1404338074 /nfs/dbraw/zinc/33/80/74/1404338074.db2.gz QRSGAGNDTLCNLA-UHFFFAOYSA-N 0 0 398.341 3.068 20 5 GGBDRN Cc1nc2ccccc2n1CCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000046229344 1404338450 /nfs/dbraw/zinc/33/84/50/1404338450.db2.gz FEKWNGUPWQHPKO-UHFFFAOYSA-N 0 0 388.449 3.159 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000046245185 1404343448 /nfs/dbraw/zinc/34/34/48/1404343448.db2.gz HOTCBSBGLHICEH-UHFFFAOYSA-N 0 0 387.461 3.393 20 5 GGBDRN Cc1c(NC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000046306610 1404358798 /nfs/dbraw/zinc/35/87/98/1404358798.db2.gz CUVKKLLTURNSFS-UHFFFAOYSA-N 0 0 391.449 3.090 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000046321288 1404363766 /nfs/dbraw/zinc/36/37/66/1404363766.db2.gz XXAYKJAIWINDNW-UHFFFAOYSA-N 0 0 384.392 3.151 20 5 GGBDRN COc1ccc([C@H]2CCCN2C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1OC ZINC000046328260 1404365824 /nfs/dbraw/zinc/36/58/24/1404365824.db2.gz UQJBPYRMYPGNQI-MRXNPFEDSA-N 0 0 396.403 3.466 20 5 GGBDRN 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ZINC000046401140 1404398992 /nfs/dbraw/zinc/39/89/92/1404398992.db2.gz QUSGFFBLDJSELZ-LLVKDONJSA-N 0 0 390.367 3.410 20 5 GGBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000046402632 1404400081 /nfs/dbraw/zinc/40/00/81/1404400081.db2.gz ORUGOUOZURVRJQ-SNVBAGLBSA-N 0 0 377.328 3.450 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000046405050 1404403039 /nfs/dbraw/zinc/40/30/39/1404403039.db2.gz QACPVLZXUSARHX-UHFFFAOYSA-N 0 0 391.449 3.184 20 5 GGBDRN Cc1cc(=O)c(C(=O)N([C@H](C)C(C)C)C2CC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000046444614 1404417884 /nfs/dbraw/zinc/41/78/84/1404417884.db2.gz WJUPPEWWGJIKIR-CQSZACIVSA-N 0 0 384.436 3.098 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCOc1cccc(C(F)(F)F)c1 ZINC000046470215 1404431586 /nfs/dbraw/zinc/43/15/86/1404431586.db2.gz IBZQPOKFCVYIHQ-UHFFFAOYSA-N 0 0 384.310 3.188 20 5 GGBDRN CCn1c(-c2ccncc2)nn(CN(C)Cc2ccccc2[N+](=O)[O-])c1=S ZINC000046477552 1404436238 /nfs/dbraw/zinc/43/62/38/1404436238.db2.gz HCUPVWBGZZJPFY-UHFFFAOYSA-N 0 0 384.465 3.494 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2cccc(F)c2)c(S(=O)(=O)N2CCCC2)c1 ZINC000046485103 1404441340 /nfs/dbraw/zinc/44/13/40/1404441340.db2.gz HSVUVDAVFFKHOM-UHFFFAOYSA-N 0 0 379.413 3.131 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3CCO[C@@H]4CCCC[C@H]43)cc2)c(C)c1[N+](=O)[O-] ZINC000046493432 1404443904 /nfs/dbraw/zinc/44/39/04/1404443904.db2.gz MFXDBSRZJBFYOY-RTBURBONSA-N 0 0 398.463 3.240 20 5 GGBDRN CCOc1cc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])ccc1OC ZINC000046511172 1404454391 /nfs/dbraw/zinc/45/43/91/1404454391.db2.gz CCYXGOQPWTYXRC-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN CCOc1cc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccc1OC ZINC000046510978 1404454639 /nfs/dbraw/zinc/45/46/39/1404454639.db2.gz PEEVTCBKMMOANI-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(OC)c(OCC)c2)cc([N+](=O)[O-])c1 ZINC000046511757 1404455158 /nfs/dbraw/zinc/45/51/58/1404455158.db2.gz DPGHFIFHERSNDJ-UHFFFAOYSA-N 0 0 388.376 3.431 20 5 GGBDRN O=C(NC[C@H]1CCCc2ccccc21)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000046570012 1404487700 /nfs/dbraw/zinc/48/77/00/1404487700.db2.gz UMQYLXIWUXEWDX-QGZVFWFLSA-N 0 0 395.459 3.281 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc(C(N)=O)c(Cl)c2)c1 ZINC000046576650 1404489812 /nfs/dbraw/zinc/48/98/12/1404489812.db2.gz NQEGQVMOVZUQNJ-UHFFFAOYSA-N 0 0 377.784 3.063 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc(CC(=O)NC(C)C)cc2)c1 ZINC000046578689 1404491304 /nfs/dbraw/zinc/49/13/04/1404491304.db2.gz HPXDLSBVTWJEBW-UHFFFAOYSA-N 0 0 399.447 3.378 20 5 GGBDRN C[C@H](NC(=O)[C@H](C)N(C)Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000046599711 1404500114 /nfs/dbraw/zinc/50/01/14/1404500114.db2.gz SWXVLEVQIYBWFQ-GJZGRUSLSA-N 0 0 399.447 3.064 20 5 GGBDRN C[C@H](c1nc(N)nc(Nc2ccccc2)n1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599242 1404500178 /nfs/dbraw/zinc/50/01/78/1404500178.db2.gz AJWQYGIHVNAJJT-CYBMUJFWSA-N 0 0 379.424 3.299 20 5 GGBDRN CN(CC(=O)N(Cc1ccco1)CC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC000046599227 1404500534 /nfs/dbraw/zinc/50/05/34/1404500534.db2.gz FIXAISMJZBEYCW-UHFFFAOYSA-N 0 0 385.342 3.211 20 5 GGBDRN COCCOCc1cccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000046615246 1404511307 /nfs/dbraw/zinc/51/13/07/1404511307.db2.gz NFKKFMFRJYSEDR-UHFFFAOYSA-N 0 0 396.403 3.196 20 5 GGBDRN Cc1[nH]c2ccc(C(=O)N3CCN(c4ccc([N+](=O)[O-])nc4)CC3)cc2c1C ZINC000046618969 1404513788 /nfs/dbraw/zinc/51/37/88/1404513788.db2.gz QRZDBGKSYDLRSJ-UHFFFAOYSA-N 0 0 379.420 3.050 20 5 GGBDRN CCc1ccc(CNC(=O)c2cc(OC)c(OCCOC)cc2[N+](=O)[O-])s1 ZINC000046621093 1404514526 /nfs/dbraw/zinc/51/45/26/1404514526.db2.gz CLWRIOBCFLGOPJ-UHFFFAOYSA-N 0 0 394.449 3.183 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000046636634 1404522257 /nfs/dbraw/zinc/52/22/57/1404522257.db2.gz IOMFTINSUHIOCM-CYBMUJFWSA-N 0 0 387.461 3.142 20 5 GGBDRN CCN(C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC000046644751 1404528198 /nfs/dbraw/zinc/52/81/98/1404528198.db2.gz DHAWWAWEGPVBPI-AWEZNQCLSA-N 0 0 387.411 3.464 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000046647036 1404529775 /nfs/dbraw/zinc/52/97/75/1404529775.db2.gz WYJSJYGUGOCDET-ZDUSSCGKSA-N 0 0 398.419 3.135 20 5 GGBDRN COC(=O)COc1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000046661483 1404539169 /nfs/dbraw/zinc/53/91/69/1404539169.db2.gz MFKJTBSSRXBLDH-LBPRGKRZSA-N 0 0 390.417 3.266 20 5 GGBDRN CCOc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1Cl ZINC000046667879 1404542289 /nfs/dbraw/zinc/54/22/89/1404542289.db2.gz FSVHAYUQIVHPQA-UHFFFAOYSA-N 0 0 387.783 3.480 20 5 GGBDRN CCC(=O)Nc1ccc(C)c(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000046679386 1404549517 /nfs/dbraw/zinc/54/95/17/1404549517.db2.gz LIELAWSFGKARRI-UHFFFAOYSA-N 0 0 398.419 3.010 20 5 GGBDRN CCOCCOCc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)c1 ZINC000046684990 1404551355 /nfs/dbraw/zinc/55/13/55/1404551355.db2.gz ZZXSGFDYYFEUBC-UHFFFAOYSA-N 0 0 387.436 3.466 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccc(COCCOc2ccccc2)c1 ZINC000046689654 1404553953 /nfs/dbraw/zinc/55/39/53/1404553953.db2.gz ZRDIJEBZWTWSPY-UHFFFAOYSA-N 0 0 396.403 3.026 20 5 GGBDRN Cc1ccc(C)c(Cn2cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c2=O)c1 ZINC000046691395 1404554483 /nfs/dbraw/zinc/55/44/83/1404554483.db2.gz NGAATCWFIUZPPO-UHFFFAOYSA-N 0 0 375.388 3.156 20 5 GGBDRN O=C(Nc1cnc(-c2ccccc2)nc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000046747349 1404575936 /nfs/dbraw/zinc/57/59/36/1404575936.db2.gz LKIHTKPPLMNARB-UHFFFAOYSA-N 0 0 386.371 3.490 20 5 GGBDRN COc1cc(C(=O)N(C)Cc2cnc(C)s2)c([N+](=O)[O-])cc1OC(F)F ZINC000046771434 1404584273 /nfs/dbraw/zinc/58/42/73/1404584273.db2.gz GBNXEYVROXYJSP-UHFFFAOYSA-N 0 0 387.364 3.242 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccn(Cc3ccccc3)n2)cc1OC ZINC000046794660 1404591200 /nfs/dbraw/zinc/59/12/00/1404591200.db2.gz LHPLGTRPELDPOU-UHFFFAOYSA-N 0 0 396.403 3.499 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccn(Cc3ccccc3)n2)cc([N+](=O)[O-])c1 ZINC000046794100 1404591481 /nfs/dbraw/zinc/59/14/81/1404591481.db2.gz SBGOIPHZCYLFGJ-UHFFFAOYSA-N 0 0 394.387 3.269 20 5 GGBDRN O=C(Nc1cccc(-c2nnco2)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000046793702 1404591689 /nfs/dbraw/zinc/59/16/89/1404591689.db2.gz RZIKTXCARMTYCG-UHFFFAOYSA-N 0 0 393.403 3.500 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N(C)c1ccccc1 ZINC000046818542 1404601266 /nfs/dbraw/zinc/60/12/66/1404601266.db2.gz FXZJFYJBIHTURW-MRXNPFEDSA-N 0 0 382.464 3.450 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)C2)nc1 ZINC000046817992 1404601604 /nfs/dbraw/zinc/60/16/04/1404601604.db2.gz GBSRCGYIXPDLCM-INIZCTEOSA-N 0 0 382.420 3.098 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N(C)c1ccccc1 ZINC000046818539 1404601735 /nfs/dbraw/zinc/60/17/35/1404601735.db2.gz FXZJFYJBIHTURW-INIZCTEOSA-N 0 0 382.464 3.450 20 5 GGBDRN CCOc1ccc(C(=O)N[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000046868805 1404619003 /nfs/dbraw/zinc/61/90/03/1404619003.db2.gz NMUOUIPRIVTNQX-GOSISDBHSA-N 0 0 385.420 3.387 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1ccc(OC(F)(F)F)cc1 ZINC000046882197 1404621830 /nfs/dbraw/zinc/62/18/30/1404621830.db2.gz DYBKKAVPVCXFDF-UHFFFAOYSA-N 0 0 398.341 3.405 20 5 GGBDRN CC(C)c1ccc(CCNC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 ZINC000046886788 1404623231 /nfs/dbraw/zinc/62/32/31/1404623231.db2.gz UDDHESWWMCQCKY-UHFFFAOYSA-N 0 0 397.479 3.188 20 5 GGBDRN CCOc1ccc(C(=O)Nc2nc3c(s2)CN(CC)CC3)cc1[N+](=O)[O-] ZINC000046930833 1404638667 /nfs/dbraw/zinc/63/86/67/1404638667.db2.gz RMIGSEMVIGMQNN-UHFFFAOYSA-N 0 0 376.438 3.080 20 5 GGBDRN CC(C)Oc1cccc([C@H](C)NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000046999466 1404668105 /nfs/dbraw/zinc/66/81/05/1404668105.db2.gz APZOJRBAKTVVDU-GJZGRUSLSA-N 0 0 399.447 3.378 20 5 GGBDRN Cc1ccn(-c2ccc(C(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2)n1 ZINC000047056260 1404690270 /nfs/dbraw/zinc/69/02/70/1404690270.db2.gz MPFJEKGZUXNTJV-UHFFFAOYSA-N 0 0 391.431 3.051 20 5 GGBDRN O=C(NCc1ncc(-c2ccccc2)o1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000047092540 1404703985 /nfs/dbraw/zinc/70/39/85/1404703985.db2.gz UGDWRLIBYYHYEI-UHFFFAOYSA-N 0 0 389.371 3.366 20 5 GGBDRN O=C(NCc1nncn1-c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000047093713 1404705048 /nfs/dbraw/zinc/70/50/48/1404705048.db2.gz XXEJAUGEHKMSFO-UHFFFAOYSA-N 0 0 379.401 3.320 20 5 GGBDRN O=C(CCc1ccccc1)N1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000176270331 1428211112 /nfs/dbraw/zinc/21/11/12/1428211112.db2.gz LLANIMDPDWPINW-UHFFFAOYSA-N 0 0 399.422 3.041 20 5 GGBDRN COc1cc(C)c([C@@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000047109874 1404709722 /nfs/dbraw/zinc/70/97/22/1404709722.db2.gz KKZKLGNYLAVNIQ-LLVKDONJSA-N 0 0 384.392 3.288 20 5 GGBDRN O=C(NCc1cccc(C(=O)NC2CC2)c1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000047138019 1404718808 /nfs/dbraw/zinc/71/88/08/1404718808.db2.gz QUQPEDYRKZHXPH-UHFFFAOYSA-N 0 0 388.811 3.462 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 ZINC000047166805 1404727820 /nfs/dbraw/zinc/72/78/20/1404727820.db2.gz OQIJYWMQVXHMBV-UHFFFAOYSA-N 0 0 389.387 3.088 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCNC(=O)C[C@H]1c1ccccc1 ZINC000047175657 1404732972 /nfs/dbraw/zinc/73/29/72/1404732972.db2.gz AXXMYHXQTVZIAO-KSSFIOAISA-N 0 0 399.472 3.165 20 5 GGBDRN CCn1cc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)ccc1=O ZINC000047181650 1404736264 /nfs/dbraw/zinc/73/62/64/1404736264.db2.gz HTVRIVQBUAXPAB-UHFFFAOYSA-N 0 0 384.436 3.265 20 5 GGBDRN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000047186735 1404738004 /nfs/dbraw/zinc/73/80/04/1404738004.db2.gz ROEPAICWLVSTDC-UHFFFAOYSA-N 0 0 384.348 3.412 20 5 GGBDRN O=C(Nc1ccc(-c2cnco2)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000047192515 1404740993 /nfs/dbraw/zinc/74/09/93/1404740993.db2.gz RUWRRILDXLDYGW-UHFFFAOYSA-N 0 0 394.387 3.339 20 5 GGBDRN COCCCCNC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC000047199661 1404744109 /nfs/dbraw/zinc/74/41/09/1404744109.db2.gz TXRRFTMHELDDMI-UHFFFAOYSA-N 0 0 399.447 3.048 20 5 GGBDRN Cc1cccc(C)c1OCCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000047201434 1404744657 /nfs/dbraw/zinc/74/46/57/1404744657.db2.gz JUGSPTAUDMMWHF-UHFFFAOYSA-N 0 0 380.404 3.206 20 5 GGBDRN O=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000047218158 1404751740 /nfs/dbraw/zinc/75/17/40/1404751740.db2.gz DGYWFEBSAIKFIV-CYBMUJFWSA-N 0 0 387.461 3.188 20 5 GGBDRN O=C(NCc1cccc(N2CCOC2=O)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000047228573 1404756635 /nfs/dbraw/zinc/75/66/35/1404756635.db2.gz ZUVRYDHRBJQQPH-UHFFFAOYSA-N 0 0 375.768 3.135 20 5 GGBDRN O=C(Nc1cccc(Cn2cncn2)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000047233618 1404760846 /nfs/dbraw/zinc/76/08/46/1404760846.db2.gz KLLNFPHLKLASRD-UHFFFAOYSA-N 0 0 392.419 3.087 20 5 GGBDRN O=C(Nc1ccccn1)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000047237564 1404762089 /nfs/dbraw/zinc/76/20/89/1404762089.db2.gz RFZYCDLVMATRDZ-LBPRGKRZSA-N 0 0 388.811 3.134 20 5 GGBDRN COc1ccc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1OC ZINC000047323213 1404805638 /nfs/dbraw/zinc/80/56/38/1404805638.db2.gz VYDNJOLOWRYJLR-UHFFFAOYSA-N 0 0 375.381 3.251 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000047322976 1404805838 /nfs/dbraw/zinc/80/58/38/1404805838.db2.gz HXEITDQPEFFISQ-QGZVFWFLSA-N 0 0 387.392 3.419 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000047322975 1404805917 /nfs/dbraw/zinc/80/59/17/1404805917.db2.gz HXEITDQPEFFISQ-KRWDZBQOSA-N 0 0 387.392 3.419 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000047323473 1404805919 /nfs/dbraw/zinc/80/59/19/1404805919.db2.gz KEEZBVFSGWLCNY-UHFFFAOYSA-N 0 0 376.457 3.406 20 5 GGBDRN COc1ccc(C(=O)Nc2ccccc2C(=O)NCc2ccco2)cc1[N+](=O)[O-] ZINC000047339217 1404810884 /nfs/dbraw/zinc/81/08/84/1404810884.db2.gz GPYVEQLNJBKGBC-UHFFFAOYSA-N 0 0 395.371 3.379 20 5 GGBDRN C[C@@]1(c2ccc(Cl)cc2)NC(=O)N(CCOc2ccc([N+](=O)[O-])cc2)C1=O ZINC000047346682 1404812171 /nfs/dbraw/zinc/81/21/71/1404812171.db2.gz SFNJUFHRZMKFPH-SFHVURJKSA-N 0 0 389.795 3.094 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@@](C)(c3ccc(Cl)cc3)C2=O)cc1[N+](=O)[O-] ZINC000047346613 1404812327 /nfs/dbraw/zinc/81/23/27/1404812327.db2.gz IARJKWPKZZUHTN-SFHVURJKSA-N 0 0 389.795 3.224 20 5 GGBDRN COc1ccc(CC[C@@]2(C)NC(=O)N(Cc3cccc([N+](=O)[O-])c3C)C2=O)cc1 ZINC000047354025 1404814181 /nfs/dbraw/zinc/81/41/81/1404814181.db2.gz PXUMYLFSULECAZ-OAQYLSRUSA-N 0 0 397.431 3.355 20 5 GGBDRN CC[C@@]1(c2ccc(OC)cc2)NC(=O)N(Cc2cccc([N+](=O)[O-])c2C)C1=O ZINC000047354160 1404814230 /nfs/dbraw/zinc/81/42/30/1404814230.db2.gz RCTAYQZOZJBXFP-FQEVSTJZSA-N 0 0 383.404 3.269 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@](C)(c3ccc4c(c3)CCC4)C2=O)cc1[N+](=O)[O-] ZINC000047353953 1404814348 /nfs/dbraw/zinc/81/43/48/1404814348.db2.gz TWEZXFSMEAMDQR-OAQYLSRUSA-N 0 0 395.415 3.059 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)COc1cccc([N+](=O)[O-])c1C ZINC000047355501 1404815130 /nfs/dbraw/zinc/81/51/30/1404815130.db2.gz RDTWWUQYMDNPIZ-UHFFFAOYSA-N 0 0 388.420 3.348 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2csc(-c3ccco3)n2)C1=O ZINC000047357348 1404815136 /nfs/dbraw/zinc/81/51/36/1404815136.db2.gz WGVNVAJEFDVGKR-SFHVURJKSA-N 0 0 398.400 3.279 20 5 GGBDRN CCCCc1nc(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cs1 ZINC000047357241 1404815188 /nfs/dbraw/zinc/81/51/88/1404815188.db2.gz MGYGUOGINRWHEP-GOSISDBHSA-N 0 0 388.449 3.361 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000047363336 1404816972 /nfs/dbraw/zinc/81/69/72/1404816972.db2.gz LFLDELCBYMQHCF-SNVBAGLBSA-N 0 0 399.375 3.474 20 5 GGBDRN C[C@H](NC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000047363334 1404817140 /nfs/dbraw/zinc/81/71/40/1404817140.db2.gz LFLDELCBYMQHCF-JTQLQIEISA-N 0 0 399.375 3.474 20 5 GGBDRN O=c1c2oc3ccccc3c2ncn1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000047370211 1404818312 /nfs/dbraw/zinc/81/83/12/1404818312.db2.gz NYCUEMGXEDPLOB-UHFFFAOYSA-N 0 0 389.327 3.149 20 5 GGBDRN CC(C)(C)c1nc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000047401921 1404827260 /nfs/dbraw/zinc/82/72/60/1404827260.db2.gz HYMBKENAKQIRRF-UHFFFAOYSA-N 0 0 388.493 3.307 20 5 GGBDRN O=C(NC1CC1)[C@H]1CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000047402218 1404827368 /nfs/dbraw/zinc/82/73/68/1404827368.db2.gz XOPCWHRGHAJRFA-GOSISDBHSA-N 0 0 394.431 3.222 20 5 GGBDRN CCN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H]1COc2ccccc2O1 ZINC000047406744 1404828096 /nfs/dbraw/zinc/82/80/96/1404828096.db2.gz OVRFKSWGFOYPNU-MRXNPFEDSA-N 0 0 396.403 3.307 20 5 GGBDRN CC(C)NC(=O)c1ccc(Cl)c(NC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000047407232 1404828843 /nfs/dbraw/zinc/82/88/43/1404828843.db2.gz HZDBQFYDMXAJOB-UHFFFAOYSA-N 0 0 391.811 3.404 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CN(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000047406893 1404828854 /nfs/dbraw/zinc/82/88/54/1404828854.db2.gz JMXGDOXQFPJINX-UHFFFAOYSA-N 0 0 395.419 3.332 20 5 GGBDRN O=C(c1ccc(-c2cnco2)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000047411329 1404829590 /nfs/dbraw/zinc/82/95/90/1404829590.db2.gz WJCKHAGTPAHFDW-UHFFFAOYSA-N 0 0 378.388 3.212 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(-n3cccn3)c(F)c2)c([N+](=O)[O-])cc1OC ZINC000047420229 1404831474 /nfs/dbraw/zinc/83/14/74/1404831474.db2.gz FHZWRHKUQNDWLL-UHFFFAOYSA-N 0 0 386.339 3.189 20 5 GGBDRN O=C(CCc1ccccc1)N1CCC(C(=O)Oc2cccc([N+](=O)[O-])c2)CC1 ZINC000047439871 1404836398 /nfs/dbraw/zinc/83/63/98/1404836398.db2.gz BEYYDFYRSUNAME-UHFFFAOYSA-N 0 0 382.416 3.372 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(-n3ccnc3)c2)cc1OC ZINC000047514785 1404855912 /nfs/dbraw/zinc/85/59/12/1404855912.db2.gz HRFZCYRSJSKVJW-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN Cc1ccc(CNc2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])cn1 ZINC000047538051 1404861246 /nfs/dbraw/zinc/86/12/46/1404861246.db2.gz DMLIOCRAFJZWMW-UHFFFAOYSA-N 0 0 390.465 3.085 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ncc(-c2ccccc2)s1 ZINC000047543132 1404863747 /nfs/dbraw/zinc/86/37/47/1404863747.db2.gz HKBGJJMEWIIPHO-UHFFFAOYSA-N 0 0 396.428 3.477 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000047543246 1404863758 /nfs/dbraw/zinc/86/37/58/1404863758.db2.gz QFESFWCAUYBNTO-NSHDSACASA-N 0 0 384.392 3.369 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047551286 1404865441 /nfs/dbraw/zinc/86/54/41/1404865441.db2.gz FJDIUQSXRPPTBU-SNVBAGLBSA-N 0 0 376.800 3.491 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047551284 1404865507 /nfs/dbraw/zinc/86/55/07/1404865507.db2.gz FJDIUQSXRPPTBU-JTQLQIEISA-N 0 0 376.800 3.491 20 5 GGBDRN COCCn1c(C)c(C)nc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000047560514 1404867655 /nfs/dbraw/zinc/86/76/55/1404867655.db2.gz KCLGGERMFNJMSR-UHFFFAOYSA-N 0 0 378.454 3.094 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1OC ZINC000047583712 1404872341 /nfs/dbraw/zinc/87/23/41/1404872341.db2.gz MRRXMVRISVLECC-LLVKDONJSA-N 0 0 388.376 3.222 20 5 GGBDRN CCOc1ccc([C@H](C)NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1OC ZINC000047607808 1404878336 /nfs/dbraw/zinc/87/83/36/1404878336.db2.gz GUCOVYRDQAPSED-LBPRGKRZSA-N 0 0 380.422 3.042 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000047609788 1404879021 /nfs/dbraw/zinc/87/90/21/1404879021.db2.gz PHMHNWTYPIQLFS-OAHLLOKOSA-N 0 0 395.419 3.164 20 5 GGBDRN COc1cc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cc(OC)c1OC ZINC000047623666 1404881202 /nfs/dbraw/zinc/88/12/02/1404881202.db2.gz UCNITSBFLAPOSM-UHFFFAOYSA-N 0 0 376.365 3.028 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 ZINC000047625204 1404881646 /nfs/dbraw/zinc/88/16/46/1404881646.db2.gz WAVDRGFYXVQVAA-GOSISDBHSA-N 0 0 399.403 3.120 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNC(=O)CCOc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000047624638 1404881917 /nfs/dbraw/zinc/88/19/17/1404881917.db2.gz JHSZSGLDUUNPTF-UHFFFAOYSA-N 0 0 385.420 3.044 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CCC(OCc2ccccc2)CC1 ZINC000047671638 1404890707 /nfs/dbraw/zinc/89/07/07/1404890707.db2.gz QAMDAPIHDGHBPZ-UHFFFAOYSA-N 0 0 394.424 3.104 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c1 ZINC000047671450 1404890842 /nfs/dbraw/zinc/89/08/42/1404890842.db2.gz FGSLKPJERTYFHS-HNNXBMFYSA-N 0 0 380.397 3.268 20 5 GGBDRN CC(C)COc1cccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000047695756 1404894640 /nfs/dbraw/zinc/89/46/40/1404894640.db2.gz UEROIGXPLCPEHB-UHFFFAOYSA-N 0 0 399.451 3.379 20 5 GGBDRN COC(=O)Nc1cccc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000047713227 1404899199 /nfs/dbraw/zinc/89/91/99/1404899199.db2.gz UZOZDDPYOYVXJZ-UHFFFAOYSA-N 0 0 399.407 3.127 20 5 GGBDRN O=C(NCCOc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000047718353 1404902437 /nfs/dbraw/zinc/90/24/37/1404902437.db2.gz ABFRJPONDLYYIV-UHFFFAOYSA-N 0 0 384.310 3.345 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1cc(Cl)ccc1N1CCOCC1 ZINC000047722070 1404904025 /nfs/dbraw/zinc/90/40/25/1404904025.db2.gz JSMVWRAGMJQPSM-UHFFFAOYSA-N 0 0 390.827 3.407 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1C ZINC000047742889 1404914921 /nfs/dbraw/zinc/91/49/21/1404914921.db2.gz QRWSFQXECZJPTB-GOSISDBHSA-N 0 0 396.491 3.211 20 5 GGBDRN CCN(C(=O)[C@@H](C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000047743140 1404915282 /nfs/dbraw/zinc/91/52/82/1404915282.db2.gz GBKFGUSDAQAYSZ-QGZVFWFLSA-N 0 0 382.464 3.158 20 5 GGBDRN CC(C)c1cccc(NC(=O)CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000047743201 1404915426 /nfs/dbraw/zinc/91/54/26/1404915426.db2.gz XLMSTLRSSFHQPB-UHFFFAOYSA-N 0 0 382.464 3.479 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)[C@@H](C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047743409 1404915559 /nfs/dbraw/zinc/91/55/59/1404915559.db2.gz YCVAWPJJUDKOFO-GOSISDBHSA-N 0 0 396.491 3.154 20 5 GGBDRN CCc1ccc([C@@H](C)NC(=O)CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000047742885 1404915642 /nfs/dbraw/zinc/91/56/42/1404915642.db2.gz RSPDQJQZOHERQQ-QGZVFWFLSA-N 0 0 396.491 3.157 20 5 GGBDRN CC(C)N(C(=O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000047744059 1404916496 /nfs/dbraw/zinc/91/64/96/1404916496.db2.gz DEYSXXWVFYXLEA-UHFFFAOYSA-N 0 0 382.464 3.158 20 5 GGBDRN C[C@H](C(=O)N1c2ccccc2C[C@H]1C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047743764 1404916596 /nfs/dbraw/zinc/91/65/96/1404916596.db2.gz AWVAQZKYCQUVPD-IAGOWNOFSA-N 0 0 394.475 3.083 20 5 GGBDRN C[C@@H](C(=O)NCCC1=CCCCC1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047744211 1404916667 /nfs/dbraw/zinc/91/66/67/1404916667.db2.gz RPRFPEQBTOYFMA-KRWDZBQOSA-N 0 0 386.496 3.112 20 5 GGBDRN Cc1ccc(C)c(NC(=O)[C@H](C)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000047744258 1404916908 /nfs/dbraw/zinc/91/69/08/1404916908.db2.gz APEOVQYUEOEMHG-KRWDZBQOSA-N 0 0 382.464 3.361 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](C)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(F)c1 ZINC000047745260 1404916939 /nfs/dbraw/zinc/91/69/39/1404916939.db2.gz PJLDULFDUKVKBJ-OAHLLOKOSA-N 0 0 386.427 3.192 20 5 GGBDRN C[C@H](C(=O)N1c2ccccc2C[C@@H]1C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047743766 1404916946 /nfs/dbraw/zinc/91/69/46/1404916946.db2.gz AWVAQZKYCQUVPD-DLBZAZTESA-N 0 0 394.475 3.083 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(F)cc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745490 1404918140 /nfs/dbraw/zinc/91/81/40/1404918140.db2.gz PVUNQHTZQUXGLR-ZDUSSCGKSA-N 0 0 390.390 3.022 20 5 GGBDRN Cc1cccc(C)c1NC(=O)[C@@H](C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745571 1404918152 /nfs/dbraw/zinc/91/81/52/1404918152.db2.gz YWPKVSCZFPNELZ-QGZVFWFLSA-N 0 0 382.464 3.361 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745549 1404918192 /nfs/dbraw/zinc/91/81/92/1404918192.db2.gz NSLHOYINQVOJIR-AWEZNQCLSA-N 0 0 388.855 3.397 20 5 GGBDRN COCCOc1ccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000047761225 1404928836 /nfs/dbraw/zinc/92/88/36/1404928836.db2.gz MTAQKTHRTSQFKB-UHFFFAOYSA-N 0 0 388.424 3.162 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 ZINC000047837682 1404968050 /nfs/dbraw/zinc/96/80/50/1404968050.db2.gz LIYQKBYOJGLCTD-KRWDZBQOSA-N 0 0 384.392 3.034 20 5 GGBDRN Cn1ncc2c1CCC[C@@H]2NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047865918 1404978199 /nfs/dbraw/zinc/97/81/99/1404978199.db2.gz NLVUWDBTXCBFHH-NSHDSACASA-N 0 0 381.339 3.129 20 5 GGBDRN CNC(=O)Cc1ccccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000047886539 1404984609 /nfs/dbraw/zinc/98/46/09/1404984609.db2.gz XJJJJFOYBQXKPM-UHFFFAOYSA-N 0 0 399.450 3.082 20 5 GGBDRN COc1ccc(C(=O)NCCCNc2ccc(C(F)(F)F)cn2)cc1[N+](=O)[O-] ZINC000047926743 1404999481 /nfs/dbraw/zinc/99/94/81/1404999481.db2.gz KYQTZMYIPRZRFL-UHFFFAOYSA-N 0 0 398.341 3.249 20 5 GGBDRN COc1ccc(C(=O)NCCCc2cn(-c3ccccc3)nc2C)cc1[N+](=O)[O-] ZINC000047931380 1405001047 /nfs/dbraw/zinc/00/10/47/1405001047.db2.gz GQJZHLGWXDAPIO-UHFFFAOYSA-N 0 0 394.431 3.460 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2-n2cccn2)cc1OC ZINC000047973989 1405013891 /nfs/dbraw/zinc/01/38/91/1405013891.db2.gz QRUCGVAXMNBIFR-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN CN(C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@H]1CCCc2ccccc21 ZINC000047983492 1405016575 /nfs/dbraw/zinc/01/65/75/1405016575.db2.gz NNLWNWBBHSBRCC-INIZCTEOSA-N 0 0 381.388 3.039 20 5 GGBDRN C[C@H](CCc1ccco1)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000047983097 1405016636 /nfs/dbraw/zinc/01/66/36/1405016636.db2.gz MRUFIWHDXIPKEK-CQSZACIVSA-N 0 0 393.465 3.406 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCN(C(=O)c2ccsc2)CC1 ZINC000048053067 1405035069 /nfs/dbraw/zinc/03/50/69/1405035069.db2.gz MBPXCYJJPAOILN-UHFFFAOYSA-N 0 0 394.840 3.300 20 5 GGBDRN COc1ccc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1OC(F)F ZINC000048093200 1405050535 /nfs/dbraw/zinc/05/05/35/1405050535.db2.gz KJPYNROWCASQGV-UHFFFAOYSA-N 0 0 381.335 3.047 20 5 GGBDRN Cc1cc(OC(C)C)ccc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000048121952 1405063427 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CCOc1ccc(C(=O)N2CCN(c3ncccc3Cl)CC2)cc1[N+](=O)[O-] ZINC000058284596 1407806625 /nfs/dbraw/zinc/80/66/25/1407806625.db2.gz YOKOUOODRNXJKL-UHFFFAOYSA-N 0 0 390.827 3.004 20 5 GGBDRN CCN1C[C@H](CN(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])Oc2ccccc21 ZINC000058289095 1407807193 /nfs/dbraw/zinc/80/71/93/1407807193.db2.gz QVHJYPNRLHXOQX-INIZCTEOSA-N 0 0 398.463 3.061 20 5 GGBDRN COc1ccc(-c2nc(COC(=O)CCn3cc([N+](=O)[O-])cn3)cs2)cc1 ZINC000058322141 1407811684 /nfs/dbraw/zinc/81/16/84/1407811684.db2.gz UVKYEJKOTDUYDJ-UHFFFAOYSA-N 0 0 388.405 3.057 20 5 GGBDRN O=C(NCCCn1ccc2ccccc21)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000058323505 1407812208 /nfs/dbraw/zinc/81/22/08/1407812208.db2.gz AVYXQFSOBTYGHB-UHFFFAOYSA-N 0 0 381.388 3.141 20 5 GGBDRN O=C(NCc1ccc(N2CCCCC2)nc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000058331865 1407812851 /nfs/dbraw/zinc/81/28/51/1407812851.db2.gz FSWHNWWCEOHCRZ-UHFFFAOYSA-N 0 0 379.420 3.391 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000058388112 1407821132 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392.433 3.117 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000058560633 1407844705 /nfs/dbraw/zinc/84/47/05/1407844705.db2.gz JRLDTVKRVUIYLW-OAHLLOKOSA-N 0 0 395.506 3.080 20 5 GGBDRN Nc1c(C(=O)NCc2ccc(OCc3ccccn3)cc2)cc(F)cc1[N+](=O)[O-] ZINC000058572178 1407846379 /nfs/dbraw/zinc/84/63/79/1407846379.db2.gz MQIORQWQFSNKAV-UHFFFAOYSA-N 0 0 396.378 3.220 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN1CCCN(C(=O)CC2CCCC2)CC1 ZINC000058578867 1407847555 /nfs/dbraw/zinc/84/75/55/1407847555.db2.gz FZGFLYWCIZJWPK-UHFFFAOYSA-N 0 0 375.469 3.218 20 5 GGBDRN Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)c12 ZINC000058584641 1407847923 /nfs/dbraw/zinc/84/79/23/1407847923.db2.gz SKWMTOMOZYHSSC-UHFFFAOYSA-N 0 0 377.404 3.265 20 5 GGBDRN CCCN(CC(=O)N(C)C)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000058696088 1407866313 /nfs/dbraw/zinc/86/63/13/1407866313.db2.gz GJPFMNCLNGJLEO-UHFFFAOYSA-N 0 0 398.463 3.147 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2sccc2C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000058701194 1407867443 /nfs/dbraw/zinc/86/74/43/1407867443.db2.gz VUFUSHQAQSFQKC-UHFFFAOYSA-N 0 0 390.377 3.017 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CS(C)(=O)=O ZINC000058761758 1407876993 /nfs/dbraw/zinc/87/69/93/1407876993.db2.gz YDCHRQMGBOGJCM-GFCCVEGCSA-N 0 0 394.474 3.259 20 5 GGBDRN O=C(NCc1sccc1Br)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000058764451 1407877093 /nfs/dbraw/zinc/87/70/93/1407877093.db2.gz LWIQIJMCHJLOJT-UHFFFAOYSA-N 0 0 386.183 3.257 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCCN(c3ccc([N+](=O)[O-])cc3F)CC2)c(F)c1 ZINC000058789687 1407881242 /nfs/dbraw/zinc/88/12/42/1407881242.db2.gz MOQCKRCHLFBYQK-UHFFFAOYSA-N 0 0 378.335 3.498 20 5 GGBDRN CC[C@@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)Oc1ccccc1Cl ZINC000176364374 1428272536 /nfs/dbraw/zinc/27/25/36/1428272536.db2.gz WTIJVTKXPKHOHD-AWEZNQCLSA-N 0 0 391.811 3.161 20 5 GGBDRN O=C(CC1CCCC1)N1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000058831557 1407888024 /nfs/dbraw/zinc/88/80/24/1407888024.db2.gz AZVCDDTWTMCCRB-UHFFFAOYSA-N 0 0 398.463 3.331 20 5 GGBDRN Cc1c(NC(=O)NCC2(N3CCOCC3)CCCCC2)cccc1[N+](=O)[O-] ZINC000058856325 1407889435 /nfs/dbraw/zinc/88/94/35/1407889435.db2.gz GRHPDLDEFLLGSA-UHFFFAOYSA-N 0 0 376.457 3.060 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)NCc2cc3ccccc3[nH]2)cc1OC ZINC000058901187 1407896678 /nfs/dbraw/zinc/89/66/78/1407896678.db2.gz LERQOAGMYCVCHR-UHFFFAOYSA-N 0 0 399.403 3.040 20 5 GGBDRN Cn1cc(C(=O)NCc2cc3ccccc3[nH]2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000058904093 1407896695 /nfs/dbraw/zinc/89/66/95/1407896695.db2.gz ZJHQFZDNXPJLQZ-UHFFFAOYSA-N 0 0 375.388 3.407 20 5 GGBDRN C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)CCOc1cccc([N+](=O)[O-])c1 ZINC000058932426 1407900478 /nfs/dbraw/zinc/90/04/78/1407900478.db2.gz MCNNRCDGGVANJZ-CQSZACIVSA-N 0 0 378.450 3.070 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C2CC2)cc1 ZINC000058931019 1407900752 /nfs/dbraw/zinc/90/07/52/1407900752.db2.gz MFLBSKUTFNOSIM-QGZVFWFLSA-N 0 0 376.434 3.341 20 5 GGBDRN C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)CCOc1cccc([N+](=O)[O-])c1 ZINC000058932424 1407900762 /nfs/dbraw/zinc/90/07/62/1407900762.db2.gz MCNNRCDGGVANJZ-AWEZNQCLSA-N 0 0 378.450 3.070 20 5 GGBDRN COc1c(C)cnc(CN(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)c1C ZINC000058958577 1407905818 /nfs/dbraw/zinc/90/58/18/1407905818.db2.gz XDDIZDZGTNTZNJ-UHFFFAOYSA-N 0 0 375.450 3.366 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000058996644 1407910220 /nfs/dbraw/zinc/91/02/20/1407910220.db2.gz PJSJBUIUTZUYLQ-UHFFFAOYSA-N 0 0 389.839 3.366 20 5 GGBDRN COC(=O)c1ccc(OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(OC)c1 ZINC000059009632 1407912781 /nfs/dbraw/zinc/91/27/81/1407912781.db2.gz JBQBEPLLXPWTBP-UHFFFAOYSA-N 0 0 385.332 3.019 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cccc(CN3CCCC3=O)c2)c1 ZINC000059009932 1407913156 /nfs/dbraw/zinc/91/31/56/1407913156.db2.gz ZXBCZAIPZBTXFY-UHFFFAOYSA-N 0 0 397.431 3.433 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1F)NCCc1ccc(OC(F)F)cc1 ZINC000059011939 1407913165 /nfs/dbraw/zinc/91/31/65/1407913165.db2.gz YGPFCRCYUMBCBU-UHFFFAOYSA-N 0 0 384.310 3.073 20 5 GGBDRN CCCc1ccc([C@@]2(C)NC(=O)N(CCOc3ccccc3[N+](=O)[O-])C2=O)cc1 ZINC000059010556 1407913242 /nfs/dbraw/zinc/91/32/42/1407913242.db2.gz RYPIAKAHQAAGDW-OAQYLSRUSA-N 0 0 397.431 3.393 20 5 GGBDRN Cc1c(Cn2nnc(-c3cccc(C(=O)OC(C)C)c3)n2)cccc1[N+](=O)[O-] ZINC000059017262 1407914017 /nfs/dbraw/zinc/91/40/17/1407914017.db2.gz HIIBJOILGKMOBU-UHFFFAOYSA-N 0 0 381.392 3.170 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cccc(OCc2cccnc2)c1 ZINC000059274815 1407917887 /nfs/dbraw/zinc/91/78/87/1407917887.db2.gz FNYPFGFAEYTZLP-UHFFFAOYSA-N 0 0 392.415 3.411 20 5 GGBDRN Cc1ccc(-c2csc(NC(=O)Cn3cc([N+](=O)[O-])ccc3=O)n2)c(C)c1 ZINC000059408019 1407922297 /nfs/dbraw/zinc/92/22/97/1407922297.db2.gz ZUDPLTJQGFBYMG-UHFFFAOYSA-N 0 0 384.417 3.136 20 5 GGBDRN Cc1cccc(N2CCN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)CC2)c1 ZINC000059733986 1407924111 /nfs/dbraw/zinc/92/41/11/1407924111.db2.gz DUMNLWRTDILDFL-UHFFFAOYSA-N 0 0 394.475 3.466 20 5 GGBDRN Cc1ccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1C(=O)N(C)C ZINC000176369969 1428278230 /nfs/dbraw/zinc/27/82/30/1428278230.db2.gz SDRQBQKIEBWJML-UHFFFAOYSA-N 0 0 384.436 3.436 20 5 GGBDRN O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)Nc1cc([N+](=O)[O-])ccc1F ZINC000059742154 1407924870 /nfs/dbraw/zinc/92/48/70/1407924870.db2.gz XIDZHSQWRJRORR-UHFFFAOYSA-N 0 0 392.408 3.025 20 5 GGBDRN O=C(CCCOc1ccccc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000059856071 1407927188 /nfs/dbraw/zinc/92/71/88/1407927188.db2.gz UUMXGJBYHWDBCD-UHFFFAOYSA-N 0 0 387.411 3.242 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2cc(-c3cccs3)[nH]n2)cc([N+](=O)[O-])c1 ZINC000059889079 1407928213 /nfs/dbraw/zinc/92/82/13/1407928213.db2.gz QMCKYCZNDRYFOR-UHFFFAOYSA-N 0 0 386.389 3.475 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccc(Cl)cc2)CC1 ZINC000059897650 1407929787 /nfs/dbraw/zinc/92/97/87/1407929787.db2.gz QLCHJXZETVLOCG-UHFFFAOYSA-N 0 0 388.855 3.277 20 5 GGBDRN CN(C[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)C1)C(=O)OC(C)(C)C ZINC000060060920 1407935122 /nfs/dbraw/zinc/93/51/22/1407935122.db2.gz BHYJUOLUKUUGAU-AWEZNQCLSA-N 0 0 377.441 3.314 20 5 GGBDRN COc1ccc(Cn2ncc(C)c2NC(=O)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000060059711 1407935501 /nfs/dbraw/zinc/93/55/01/1407935501.db2.gz AQKHMRBBWUVIRB-UHFFFAOYSA-N 0 0 396.403 3.418 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1NCc1cccc(OCCN2CCOCC2)c1 ZINC000060102981 1407939468 /nfs/dbraw/zinc/93/94/68/1407939468.db2.gz XKFAKBKOABEIOC-UHFFFAOYSA-N 0 0 375.400 3.057 20 5 GGBDRN COCCCOc1cc(C)ccc1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000176368728 1428276636 /nfs/dbraw/zinc/27/66/36/1428276636.db2.gz FDBFIYRTPQZJBI-UHFFFAOYSA-N 0 0 387.436 3.318 20 5 GGBDRN COc1ccc(CC[C@@H](C)NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000060137594 1407942817 /nfs/dbraw/zinc/94/28/17/1407942817.db2.gz PGSINKJJHZCPSP-CYBMUJFWSA-N 0 0 388.420 3.372 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(Nc2cnn(C(C)(C)C)c2)c([N+](=O)[O-])c1 ZINC000060168144 1407945361 /nfs/dbraw/zinc/94/53/61/1407945361.db2.gz QSXALYBEQDTXLB-UHFFFAOYSA-N 0 0 395.485 3.320 20 5 GGBDRN CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000060190861 1407946230 /nfs/dbraw/zinc/94/62/30/1407946230.db2.gz UXUMOMVUGBSPJA-INIZCTEOSA-N 0 0 395.337 3.405 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1nn(-c2ccccc2)c2c1CCC2 ZINC000060278735 1407950691 /nfs/dbraw/zinc/95/06/91/1407950691.db2.gz MPBBLPJQZNAXDU-UHFFFAOYSA-N 0 0 388.383 3.065 20 5 GGBDRN CCOC(=O)[C@@H]1CCCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000060292689 1407950900 /nfs/dbraw/zinc/95/09/00/1407950900.db2.gz YOWUSVRASGULOE-FQEVSTJZSA-N 0 0 392.455 3.099 20 5 GGBDRN O=C(CCCc1ccccc1)N1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000060320565 1407952485 /nfs/dbraw/zinc/95/24/85/1407952485.db2.gz GYUHYMTZNKCHMB-UHFFFAOYSA-N 0 0 381.476 3.304 20 5 GGBDRN O=[N+]([O-])c1cccc(OS(=O)(=O)c2cc(Br)ccc2F)c1 ZINC000060320983 1407952544 /nfs/dbraw/zinc/95/25/44/1407952544.db2.gz SVHOACCMXDLNBI-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN COc1ccc([C@@H]2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])C2)cc1 ZINC000060338985 1407955378 /nfs/dbraw/zinc/95/53/78/1407955378.db2.gz FNAOPJHMRMWWBZ-CQSZACIVSA-N 0 0 376.434 3.001 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N(CC(F)(F)F)c1ccccn1 ZINC000060350756 1407957855 /nfs/dbraw/zinc/95/78/55/1407957855.db2.gz QLDKWZBJUYNGRO-UHFFFAOYSA-N 0 0 391.309 3.385 20 5 GGBDRN CC[C@](C)(O)CNc1ccc(S(=O)(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000060349540 1407957858 /nfs/dbraw/zinc/95/78/58/1407957858.db2.gz VYWCXFVYPVFQNW-JRSKDTKFSA-N 0 0 399.513 3.025 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000060383307 1407966636 /nfs/dbraw/zinc/96/66/36/1407966636.db2.gz ZGTWXPRAZJPETO-SECBINFHSA-N 0 0 393.739 3.340 20 5 GGBDRN COCCOc1ccccc1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000060452144 1407979826 /nfs/dbraw/zinc/97/98/26/1407979826.db2.gz GTKHVFYBCFJSRQ-UHFFFAOYSA-N 0 0 387.436 3.370 20 5 GGBDRN Cc1cc(C(=O)NC(C)C)ccc1NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000060458855 1407981310 /nfs/dbraw/zinc/98/13/10/1407981310.db2.gz ZVNFSMIBOGKHDK-UHFFFAOYSA-N 0 0 396.447 3.043 20 5 GGBDRN O=[N+]([O-])c1cc(NCc2nnnn2-c2ccc(OC(F)F)cc2)ccc1Cl ZINC000060455956 1407981576 /nfs/dbraw/zinc/98/15/76/1407981576.db2.gz JAUOVXXQXLCCAY-UHFFFAOYSA-N 0 0 396.741 3.437 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])c1 ZINC000060498975 1407990933 /nfs/dbraw/zinc/99/09/33/1407990933.db2.gz OZWUFHNLMIQEEH-CYBMUJFWSA-N 0 0 391.449 3.210 20 5 GGBDRN Cc1cccc(OCCN(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])c1 ZINC000060498128 1407990979 /nfs/dbraw/zinc/99/09/79/1407990979.db2.gz MAXLPMTTWLETBA-UHFFFAOYSA-N 0 0 378.450 3.220 20 5 GGBDRN Cc1cccc(N2CCN(S(=O)(=O)c3cc(C)c(C)cc3[N+](=O)[O-])CC2)c1 ZINC000060498231 1407991048 /nfs/dbraw/zinc/99/10/48/1407991048.db2.gz APYNLOZLZAJPCR-UHFFFAOYSA-N 0 0 389.477 3.031 20 5 GGBDRN 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CC(=O)NC[C@H]1CCCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000067385358 1409096051 /nfs/dbraw/zinc/09/60/51/1409096051.db2.gz AIFBPMDSRGFEQI-MRXNPFEDSA-N 0 0 381.432 3.178 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)c1 ZINC000176595810 1428374364 /nfs/dbraw/zinc/37/43/64/1428374364.db2.gz KYKINCPMQUPYNX-SFHVURJKSA-N 0 0 384.432 3.467 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F ZINC000067424634 1409114230 /nfs/dbraw/zinc/11/42/30/1409114230.db2.gz WBOQQFQHDHSEHX-SNVBAGLBSA-N 0 0 381.310 3.430 20 5 GGBDRN Cc1ccc(C)c(OC2CCN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000067426641 1409115831 /nfs/dbraw/zinc/11/58/31/1409115831.db2.gz NFQWJNYOWZUWQR-UHFFFAOYSA-N 0 0 397.431 3.220 20 5 GGBDRN Cc1occc1-c1nnc(S[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1 ZINC000067428553 1409116048 /nfs/dbraw/zinc/11/60/48/1409116048.db2.gz CIYNBUKLMFRYME-CQSZACIVSA-N 0 0 386.389 3.444 20 5 GGBDRN O=C1[C@H](Sc2n[nH]c(-c3ccccc3F)n2)CCN1c1cccc([N+](=O)[O-])c1 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XMIPWKWDYYFJRV-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])c2)n1 ZINC000067549388 1409156677 /nfs/dbraw/zinc/15/66/77/1409156677.db2.gz KKMKONMTWQDAFI-UHFFFAOYSA-N 0 0 394.387 3.168 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)c1 ZINC000067548925 1409156927 /nfs/dbraw/zinc/15/69/27/1409156927.db2.gz NCOZRUJDJZAOQA-LBPRGKRZSA-N 0 0 398.419 3.378 20 5 GGBDRN CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000067549694 1409157429 /nfs/dbraw/zinc/15/74/29/1409157429.db2.gz KNYCQUUKMKVPEF-ZDUSSCGKSA-N 0 0 385.420 3.062 20 5 GGBDRN Cn1cc(C(=O)Nc2nnc(C(F)F)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067552053 1409157963 /nfs/dbraw/zinc/15/79/63/1409157963.db2.gz PSXNTUCYIPJOLP-UHFFFAOYSA-N 0 0 380.336 3.037 20 5 GGBDRN O=C(NC[C@H](O)COc1cccc(C(F)(F)F)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000067554571 1409159114 /nfs/dbraw/zinc/15/91/14/1409159114.db2.gz ALTCABRSWMZPQC-AWEZNQCLSA-N 0 0 399.325 3.175 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccccc1SC(F)F ZINC000176616111 1428380866 /nfs/dbraw/zinc/38/08/66/1428380866.db2.gz CYWBISICBQTASU-UHFFFAOYSA-N 0 0 381.360 3.278 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2nc(C3CC3)oc2c1 ZINC000176617651 1428380951 /nfs/dbraw/zinc/38/09/51/1428380951.db2.gz UJLFJYMYPBGVIG-LLVKDONJSA-N 0 0 394.387 3.370 20 5 GGBDRN C[C@@H](CN(C)C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000067595901 1409180551 /nfs/dbraw/zinc/18/05/51/1409180551.db2.gz WUMKZRLGCMALRO-LBPRGKRZSA-N 0 0 375.812 3.449 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000067599726 1409183487 /nfs/dbraw/zinc/18/34/87/1409183487.db2.gz NALMTRORHZHOEZ-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCc1nccn1CCc1ccccc1 ZINC000176636229 1428387173 /nfs/dbraw/zinc/38/71/73/1428387173.db2.gz IIDRQADGXNFRGD-UHFFFAOYSA-N 0 0 393.447 3.030 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc(-n2ccnc2)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000067645970 1409195525 /nfs/dbraw/zinc/19/55/25/1409195525.db2.gz LCPHNJXAGLOFOP-ZDUSSCGKSA-N 0 0 383.383 3.480 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)CSc2ncccc2[N+](=O)[O-])cc1 ZINC000067648738 1409197637 /nfs/dbraw/zinc/19/76/37/1409197637.db2.gz SPIUSMVBVLQAQP-UHFFFAOYSA-N 0 0 388.449 3.203 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CSc1ncccc1[N+](=O)[O-] ZINC000067648989 1409197768 /nfs/dbraw/zinc/19/77/68/1409197768.db2.gz MFHPLTDLAYDHAD-UHFFFAOYSA-N 0 0 391.449 3.148 20 5 GGBDRN C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)c1nc2ccccc2n1C(F)F ZINC000067658612 1409199340 /nfs/dbraw/zinc/19/93/40/1409199340.db2.gz RBVHNKFAMCDFJV-SNVBAGLBSA-N 0 0 379.323 3.231 20 5 GGBDRN Cc1cccn2c1nc(-c1ccccc1)c2NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000067658610 1409199860 /nfs/dbraw/zinc/19/98/60/1409199860.db2.gz VQOKIQICLFBHPZ-UHFFFAOYSA-N 0 0 390.403 3.443 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1cc(Cl)ccc1N1CCOCC1 ZINC000067662556 1409200693 /nfs/dbraw/zinc/20/06/93/1409200693.db2.gz KHTRWNVCXANYCA-UHFFFAOYSA-N 0 0 390.827 3.407 20 5 GGBDRN COC(=O)c1ccc(N2CCCC2)c(NC(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000067663613 1409201504 /nfs/dbraw/zinc/20/15/04/1409201504.db2.gz HKOFWHQLRUSVNA-UHFFFAOYSA-N 0 0 398.419 3.303 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(=O)n(CCCOc2ccc3ccccc3c2)c1 ZINC000067737469 1409217787 /nfs/dbraw/zinc/21/77/87/1409217787.db2.gz FTJRLWSZMMEMJH-UHFFFAOYSA-N 0 0 382.372 3.165 20 5 GGBDRN CCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c(C)c1 ZINC000067753016 1409221707 /nfs/dbraw/zinc/22/17/07/1409221707.db2.gz SEWAVCMKKBPGCS-UHFFFAOYSA-N 0 0 392.433 3.348 20 5 GGBDRN CCOc1ccc(NC(=O)CSc2nncn2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000067753162 1409222489 /nfs/dbraw/zinc/22/24/89/1409222489.db2.gz IWWNQWRXLFQOSP-UHFFFAOYSA-N 0 0 379.442 3.071 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000067768482 1409226016 /nfs/dbraw/zinc/22/60/16/1409226016.db2.gz LMAPMWKMAWTJGV-UHFFFAOYSA-N 0 0 375.859 3.172 20 5 GGBDRN NC(=O)c1oc2ccccc2c1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000067773064 1409227159 /nfs/dbraw/zinc/22/71/59/1409227159.db2.gz SZSHWJHIQMTXDE-UHFFFAOYSA-N 0 0 394.387 3.292 20 5 GGBDRN COc1ccc([C@@H](C)CC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000176628860 1428384829 /nfs/dbraw/zinc/38/48/29/1428384829.db2.gz CGOYHWCSVDCOJY-GOEBONIOSA-N 0 0 384.436 3.205 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(Cl)c(OC)cc2OC)cc1[N+](=O)[O-] ZINC000067790775 1409232008 /nfs/dbraw/zinc/23/20/08/1409232008.db2.gz LDRGZLAXSIXAEC-UHFFFAOYSA-N 0 0 380.784 3.455 20 5 GGBDRN CCCCNC(=O)c1ccc(CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])cc1 ZINC000067795637 1409232725 /nfs/dbraw/zinc/23/27/25/1409232725.db2.gz SMGIBDHGRCWMJF-UHFFFAOYSA-N 0 0 385.420 3.063 20 5 GGBDRN COc1ccc(CC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)cc1[N+](=O)[O-] ZINC000067798301 1409233620 /nfs/dbraw/zinc/23/36/20/1409233620.db2.gz KPRNYMQIKCQXNH-UHFFFAOYSA-N 0 0 394.431 3.428 20 5 GGBDRN COc1ccc(CC(=O)N(Cc2ccco2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000067797775 1409233628 /nfs/dbraw/zinc/23/36/28/1409233628.db2.gz KCGRRZWYVLKMNO-UHFFFAOYSA-N 0 0 381.388 3.363 20 5 GGBDRN COc1ccc(OC)c([C@@H](C)NC(=O)[C@H](C)Sc2ncccc2[N+](=O)[O-])c1 ZINC000067807359 1409234617 /nfs/dbraw/zinc/23/46/17/1409234617.db2.gz FCRBPHOLNDFEDM-NEPJUHHUSA-N 0 0 391.449 3.365 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000067811354 1409236823 /nfs/dbraw/zinc/23/68/23/1409236823.db2.gz RZDWNBBQVFSTGN-CYBMUJFWSA-N 0 0 388.420 3.431 20 5 GGBDRN COc1ccc(CC(=O)Nc2c(C)cccc2C(=O)N2CCCC2)cc1[N+](=O)[O-] ZINC000067811016 1409236892 /nfs/dbraw/zinc/23/68/92/1409236892.db2.gz AJQOGANBPDKHAA-UHFFFAOYSA-N 0 0 397.431 3.329 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1[N+](=O)[O-] ZINC000067816486 1409237090 /nfs/dbraw/zinc/23/70/90/1409237090.db2.gz YTUZQVNVWTUJAZ-UHFFFAOYSA-N 0 0 384.392 3.069 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000067817629 1409237127 /nfs/dbraw/zinc/23/71/27/1409237127.db2.gz GAZBFSOFHYQVHI-ICSRJNTNSA-N 0 0 388.395 3.322 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000067817633 1409237201 /nfs/dbraw/zinc/23/72/01/1409237201.db2.gz GAZBFSOFHYQVHI-UYAOXDASSA-N 0 0 388.395 3.322 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1[N+](=O)[O-] ZINC000067816168 1409237374 /nfs/dbraw/zinc/23/73/74/1409237374.db2.gz BNEQTCULMWKJNW-QGZVFWFLSA-N 0 0 386.404 3.342 20 5 GGBDRN COc1ccc(CC(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000067820059 1409237846 /nfs/dbraw/zinc/23/78/46/1409237846.db2.gz KAKIACYTZFBAMG-CQSZACIVSA-N 0 0 397.431 3.150 20 5 GGBDRN COc1ccc(CC(=O)N2CCC[C@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000067820881 1409238226 /nfs/dbraw/zinc/23/82/26/1409238226.db2.gz YDYJVKXMQVZUSI-KRWDZBQOSA-N 0 0 394.431 3.396 20 5 GGBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067821307 1409238380 /nfs/dbraw/zinc/23/83/80/1409238380.db2.gz LVICTYFNMAZLKI-CYBMUJFWSA-N 0 0 382.420 3.393 20 5 GGBDRN COc1ccc([C@@H](NC(=O)Cn2cc([N+](=O)[O-])nc2C)c2ccccc2)cc1 ZINC000067824020 1409238683 /nfs/dbraw/zinc/23/86/83/1409238683.db2.gz NMOPZEFSDRSODM-FQEVSTJZSA-N 0 0 380.404 3.014 20 5 GGBDRN COc1ccc(CNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 ZINC000067824275 1409238740 /nfs/dbraw/zinc/23/87/40/1409238740.db2.gz DLDLOSXRUBLHNV-UHFFFAOYSA-N 0 0 398.337 3.490 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@@H](c2ccccc2)O1 ZINC000067827150 1409239106 /nfs/dbraw/zinc/23/91/06/1409239106.db2.gz UHYCOBGLEWPWGJ-QRWLVFNGSA-N 0 0 392.415 3.383 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1 ZINC000067826877 1409239398 /nfs/dbraw/zinc/23/93/98/1409239398.db2.gz CHVAUJKYZBAFCQ-CYBMUJFWSA-N 0 0 380.404 3.385 20 5 GGBDRN CCCCOc1ccc([C@@H](C)NC(=O)Cn2cc([N+](=O)[O-])nc2C)cc1OC ZINC000067831984 1409240595 /nfs/dbraw/zinc/24/05/95/1409240595.db2.gz OSWFRGUJMVRAQW-CYBMUJFWSA-N 0 0 390.440 3.165 20 5 GGBDRN COC(=O)Cn1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)n1 ZINC000067835933 1409241000 /nfs/dbraw/zinc/24/10/00/1409241000.db2.gz WXJLDAOJYAFCCO-UHFFFAOYSA-N 0 0 396.359 3.009 20 5 GGBDRN CSCCc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000067856528 1409245292 /nfs/dbraw/zinc/24/52/92/1409245292.db2.gz RGQBWOBWJQOKET-UHFFFAOYSA-N 0 0 383.433 3.333 20 5 GGBDRN Cc1c(C(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000067860222 1409246262 /nfs/dbraw/zinc/24/62/62/1409246262.db2.gz VLFZYMOFDNJSOG-KPZWWZAWSA-N 0 0 385.376 3.414 20 5 GGBDRN COc1ccc(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000067901950 1409252703 /nfs/dbraw/zinc/25/27/03/1409252703.db2.gz FNPOTRLCZZZDCW-INIZCTEOSA-N 0 0 398.415 3.281 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067904341 1409253232 /nfs/dbraw/zinc/25/32/32/1409253232.db2.gz MXJQVDWRSRTUNC-UHFFFAOYSA-N 0 0 399.447 3.332 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccccc2NC(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000067907272 1409253582 /nfs/dbraw/zinc/25/35/82/1409253582.db2.gz NZXXQILUFUZZGJ-UHFFFAOYSA-N 0 0 386.408 3.315 20 5 GGBDRN COc1cccc(C[C@@H]2CCCN2C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000067908908 1409253818 /nfs/dbraw/zinc/25/38/18/1409253818.db2.gz GIIYPWACTSBFMK-KRWDZBQOSA-N 0 0 384.432 3.388 20 5 GGBDRN COc1ccc(CC(=O)N(C)CCCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000067914083 1409254697 /nfs/dbraw/zinc/25/46/97/1409254697.db2.gz YSUAXWOWNRLHOK-UHFFFAOYSA-N 0 0 382.420 3.113 20 5 GGBDRN COc1ccc(CC(=O)NCCc2coc(-c3ccc(C)cc3)n2)cc1[N+](=O)[O-] ZINC000067923843 1409256393 /nfs/dbraw/zinc/25/63/93/1409256393.db2.gz MVMKHCMSCXFQEV-UHFFFAOYSA-N 0 0 395.415 3.468 20 5 GGBDRN COc1ccc(CC(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1[N+](=O)[O-] ZINC000067924443 1409256563 /nfs/dbraw/zinc/25/65/63/1409256563.db2.gz MIPYFPVOMADKQU-GOSISDBHSA-N 0 0 392.358 3.024 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000067927219 1409257290 /nfs/dbraw/zinc/25/72/90/1409257290.db2.gz WFWKROBUMOTNNI-LLVKDONJSA-N 0 0 399.394 3.419 20 5 GGBDRN CN(Cc1ccccc1Cl)c1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000067949118 1409261915 /nfs/dbraw/zinc/26/19/15/1409261915.db2.gz FUUFGGOPXDADEY-UHFFFAOYSA-N 0 0 389.839 3.357 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)c1nccn1-c1ccccc1C ZINC000067945946 1409261918 /nfs/dbraw/zinc/26/19/18/1409261918.db2.gz SCYQMRZJSYDKDC-UHFFFAOYSA-N 0 0 387.417 3.071 20 5 GGBDRN CS(=O)(=O)c1ccc(NC[C@H](c2cccs2)N2CCCC2)c([N+](=O)[O-])c1 ZINC000067948656 1409261927 /nfs/dbraw/zinc/26/19/27/1409261927.db2.gz GZIQQPVCRCDGTL-MRXNPFEDSA-N 0 0 395.506 3.309 20 5 GGBDRN CN(CCCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1 ZINC000067948675 1409262217 /nfs/dbraw/zinc/26/22/17/1409262217.db2.gz AOVUNZSWLXZDMJ-UHFFFAOYSA-N 0 0 398.463 3.006 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000067973317 1409267423 /nfs/dbraw/zinc/26/74/23/1409267423.db2.gz CZTPAQGBZLCMIV-LLVKDONJSA-N 0 0 391.374 3.331 20 5 GGBDRN O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000067990198 1409271432 /nfs/dbraw/zinc/27/14/32/1409271432.db2.gz IIWAZHACUXHBNY-UHFFFAOYSA-N 0 0 376.294 3.128 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000067993459 1409272299 /nfs/dbraw/zinc/27/22/99/1409272299.db2.gz DRJIGFYSELUURK-LLVKDONJSA-N 0 0 399.394 3.250 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000067993461 1409272310 /nfs/dbraw/zinc/27/23/10/1409272310.db2.gz DRJIGFYSELUURK-NSHDSACASA-N 0 0 399.394 3.250 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1nc(-c2ccncc2)no1)C(C)C ZINC000067995380 1409272910 /nfs/dbraw/zinc/27/29/10/1409272910.db2.gz ZWTDNNSMJVOALA-MRXNPFEDSA-N 0 0 381.392 3.475 20 5 GGBDRN Cn1c2ccccc2nc1[C@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000068002550 1409274342 /nfs/dbraw/zinc/27/43/42/1409274342.db2.gz VREPCHMPFBTADX-GOSISDBHSA-N 0 0 380.404 3.224 20 5 GGBDRN CC(=O)N1CCC(C(=O)Oc2ccc(Cc3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000176660280 1428394298 /nfs/dbraw/zinc/39/42/98/1428394298.db2.gz CMWVJARZMCNMJZ-UHFFFAOYSA-N 0 0 382.416 3.350 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N(CC2CC2)C2CCCCC2)cc([N+](=O)[O-])c1 ZINC000068013327 1409277141 /nfs/dbraw/zinc/27/71/41/1409277141.db2.gz ALLCDTYYFABKFD-UHFFFAOYSA-N 0 0 380.466 3.183 20 5 GGBDRN CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000068020821 1409278548 /nfs/dbraw/zinc/27/85/48/1409278548.db2.gz XJXCNLQJZIVTBG-HUUCEWRRSA-N 0 0 398.463 3.240 20 5 GGBDRN CC[C@H](C)NC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000068020823 1409278783 /nfs/dbraw/zinc/27/87/83/1409278783.db2.gz XJXCNLQJZIVTBG-GJZGRUSLSA-N 0 0 398.463 3.240 20 5 GGBDRN CC(=O)Nc1ccc(C)cc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000068025669 1409282279 /nfs/dbraw/zinc/28/22/79/1409282279.db2.gz PIILYRAHNJHUJK-UHFFFAOYSA-N 0 0 379.376 3.300 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)c3cccc([N+](=O)[O-])c3C)cc2)n1 ZINC000068066593 1409289577 /nfs/dbraw/zinc/28/95/77/1409289577.db2.gz QYYSKUSQFHUWSX-UHFFFAOYSA-N 0 0 380.404 3.488 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)Cc3ccccc3[N+](=O)[O-])cc2)n1 ZINC000068066739 1409289945 /nfs/dbraw/zinc/28/99/45/1409289945.db2.gz YKUHWUMXUQOFQY-UHFFFAOYSA-N 0 0 380.404 3.109 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C(C)(C)C)ns2)cc1OC ZINC000068073364 1409291058 /nfs/dbraw/zinc/29/10/58/1409291058.db2.gz LJRJJACIBGOADJ-UHFFFAOYSA-N 0 0 380.426 3.403 20 5 GGBDRN COC(=O)[C@H](C)CN(C)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000068084094 1409294981 /nfs/dbraw/zinc/29/49/81/1409294981.db2.gz PMITUTHROOTWJK-CQSZACIVSA-N 0 0 385.420 3.088 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000068104420 1409302412 /nfs/dbraw/zinc/30/24/12/1409302412.db2.gz JMVMIAHEAODKOI-UHFFFAOYSA-N 0 0 397.347 3.096 20 5 GGBDRN COc1ccc(/C=C/C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000068104510 1409303165 /nfs/dbraw/zinc/30/31/65/1409303165.db2.gz PKHNAPFONOLVRE-ONNFQVAWSA-N 0 0 394.387 3.450 20 5 GGBDRN C[C@H](CC(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)NC(=O)C1CCCCC1 ZINC000068104528 1409303218 /nfs/dbraw/zinc/30/32/18/1409303218.db2.gz SYUQVZGEWMEVAA-CQSZACIVSA-N 0 0 399.451 3.194 20 5 GGBDRN C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000068104663 1409303315 /nfs/dbraw/zinc/30/33/15/1409303315.db2.gz TYMBUADWYZMYBE-LLVKDONJSA-N 0 0 388.330 3.465 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1C ZINC000068113436 1409306480 /nfs/dbraw/zinc/30/64/80/1409306480.db2.gz KEKWMHZFMPIYBA-ZDUSSCGKSA-N 0 0 391.474 3.427 20 5 GGBDRN Cc1cc(NC(=O)c2cn3ccc(C)cc3n2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068120960 1409308348 /nfs/dbraw/zinc/30/83/48/1409308348.db2.gz PRCDYHLFYGEJNA-UHFFFAOYSA-N 0 0 376.376 3.297 20 5 GGBDRN O=C(NCCc1nc(-c2ccc(Cl)cc2)no1)c1cc(F)ccc1[N+](=O)[O-] ZINC000068140845 1409312636 /nfs/dbraw/zinc/31/26/36/1409312636.db2.gz BBXHYGSSGCGUGL-UHFFFAOYSA-N 0 0 390.758 3.410 20 5 GGBDRN O=C(NCCc1nc(-c2ccc(Cl)cc2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000068141009 1409312823 /nfs/dbraw/zinc/31/28/23/1409312823.db2.gz 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WRYXVBRLOZLXEH-LJQANCHMSA-N 0 0 399.378 3.006 20 5 GGBDRN CCS[C@@H]1CCC[C@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000176719535 1428432279 /nfs/dbraw/zinc/43/22/79/1428432279.db2.gz ISYMTAMCDVFQCE-NWDGAFQWSA-N 0 0 399.900 3.159 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)o1 ZINC000176720082 1428432292 /nfs/dbraw/zinc/43/22/92/1428432292.db2.gz DHVVJNOZKYFTEJ-DJJJIMSYSA-N 0 0 375.425 3.381 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F ZINC000071070275 1409819770 /nfs/dbraw/zinc/81/97/70/1409819770.db2.gz IRGUWHLAXDUNBE-UHFFFAOYSA-N 0 0 392.721 3.333 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000071526421 1409823467 /nfs/dbraw/zinc/82/34/67/1409823467.db2.gz ZIBVPIDMFAXGSM-UHFFFAOYSA-N 0 0 379.372 3.496 20 5 GGBDRN CCCCn1c2ccc(S(N)(=O)=O)cc2nc1-c1ccc(C)c([N+](=O)[O-])c1 ZINC000071793860 1409823949 /nfs/dbraw/zinc/82/39/49/1409823949.db2.gz BZLNZUBVNHGMCE-UHFFFAOYSA-N 0 0 388.449 3.367 20 5 GGBDRN CSc1nnc(CCCNC(=O)c2ccc(C)c([N+](=O)[O-])c2)n1CC(C)C ZINC000071801696 1409824225 /nfs/dbraw/zinc/82/42/25/1409824225.db2.gz MCAYINNHIVKEQV-UHFFFAOYSA-N 0 0 391.497 3.235 20 5 GGBDRN CC(C)N(C)S(=O)(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC000071816896 1409825670 /nfs/dbraw/zinc/82/56/70/1409825670.db2.gz LFCZJBMJEYXWPT-UHFFFAOYSA-N 0 0 395.412 3.015 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000071872586 1409828561 /nfs/dbraw/zinc/82/85/61/1409828561.db2.gz IJPQQMSFNGBZOI-HNNXBMFYSA-N 0 0 395.506 3.080 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CC1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000071930277 1409831136 /nfs/dbraw/zinc/83/11/36/1409831136.db2.gz UBVJHALCSMHBEV-UHFFFAOYSA-N 0 0 399.422 3.032 20 5 GGBDRN O=C(Nc1ccccc1S(=O)(=O)N1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000071940357 1409831775 /nfs/dbraw/zinc/83/17/75/1409831775.db2.gz RPFUWADSTKFCFF-UHFFFAOYSA-N 0 0 389.433 3.022 20 5 GGBDRN C[C@@]1(c2cccc(Cl)c2)NC(=O)N(CCOc2ccccc2[N+](=O)[O-])C1=O ZINC000071962337 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MYTPZDIMRVVRCD-LBPRGKRZSA-N 0 0 393.403 3.370 20 5 GGBDRN CCCCCCNC(=O)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000072051660 1409841784 /nfs/dbraw/zinc/84/17/84/1409841784.db2.gz XQRJGRZHHMKQSL-KRWDZBQOSA-N 0 0 375.469 3.452 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)C(=O)Nc1ccccc1 ZINC000072058772 1409843075 /nfs/dbraw/zinc/84/30/75/1409843075.db2.gz XFWCFWYSKTZGQD-OAHLLOKOSA-N 0 0 384.436 3.273 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N(Cc1ccco1)CC(F)(F)F ZINC000072068034 1409844607 /nfs/dbraw/zinc/84/46/07/1409844607.db2.gz YPLASPVXIREVLB-UHFFFAOYSA-N 0 0 388.298 3.166 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000072069789 1409844736 /nfs/dbraw/zinc/84/47/36/1409844736.db2.gz LCFQFFBSQLYHPU-KXKDPZRNSA-N 0 0 389.452 3.371 20 5 GGBDRN Cc1cc(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000072069782 1409844803 /nfs/dbraw/zinc/84/48/03/1409844803.db2.gz RIAAEPKXSAALBS-AWEZNQCLSA-N 0 0 377.441 3.280 20 5 GGBDRN CC(C)[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCCC1=O ZINC000072068450 1409844821 /nfs/dbraw/zinc/84/48/21/1409844821.db2.gz WABILWTXFPTHCZ-INIZCTEOSA-N 0 0 388.449 3.304 20 5 GGBDRN O=C(Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)Nc1cc(Cl)ccc1F ZINC000072086029 1409847314 /nfs/dbraw/zinc/84/73/14/1409847314.db2.gz GCNNWOOZMRTDMZ-UHFFFAOYSA-N 0 0 375.747 3.285 20 5 GGBDRN COCCCn1c(C)cc(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c1C ZINC000072086038 1409847479 /nfs/dbraw/zinc/84/74/79/1409847479.db2.gz FWOMFSQOAHTLQL-UHFFFAOYSA-N 0 0 397.435 3.191 20 5 GGBDRN Cc1ccc(CCC(=O)NCCOC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000072087934 1409847687 /nfs/dbraw/zinc/84/76/87/1409847687.db2.gz SAEIFUOFYFPCBS-UHFFFAOYSA-N 0 0 390.823 3.462 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1C ZINC000072104878 1409848976 /nfs/dbraw/zinc/84/89/76/1409848976.db2.gz ZVCFEIAZGXMAHE-QGZVFWFLSA-N 0 0 387.461 3.393 20 5 GGBDRN CO[C@@]1(C)C[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1(C)C ZINC000073276021 1409860289 /nfs/dbraw/zinc/86/02/89/1409860289.db2.gz SFHXZCZLOSTCAC-PXNSSMCTSA-N 0 0 375.469 3.131 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000176726874 1428436965 /nfs/dbraw/zinc/43/69/65/1428436965.db2.gz STNAOBXOQKMDFD-HOTGVXAUSA-N 0 0 390.484 3.302 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C3CCOCC3)cc2[N+](=O)[O-])C1 ZINC000074448708 1409872603 /nfs/dbraw/zinc/87/26/03/1409872603.db2.gz YRYYSFAZOFRDMN-HUUCEWRRSA-N 0 0 375.469 3.328 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)C3CCOCC3)cc2[N+](=O)[O-])C1 ZINC000074448702 1409872604 /nfs/dbraw/zinc/87/26/04/1409872604.db2.gz YRYYSFAZOFRDMN-GASCZTMLSA-N 0 0 375.469 3.328 20 5 GGBDRN CNC(=O)c1ccc(CN(C)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000176730850 1428439752 /nfs/dbraw/zinc/43/97/52/1428439752.db2.gz VSBBLUHRKAVQPY-AWEZNQCLSA-N 0 0 384.436 3.165 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN([C@H](C)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000176731455 1428439850 /nfs/dbraw/zinc/43/98/50/1428439850.db2.gz DUVCWQAJSNVERA-CHWSQXEVSA-N 0 0 388.390 3.242 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H]1CCCN(C(=O)NCC(C)C)C1 ZINC000078072663 1409907416 /nfs/dbraw/zinc/90/74/16/1409907416.db2.gz KRJWRBXVQRQYSY-HNNXBMFYSA-N 0 0 376.457 3.309 20 5 GGBDRN COc1ccc(C)cc1-n1nnnc1SCc1c(F)cccc1[N+](=O)[O-] ZINC000078412041 1409916298 /nfs/dbraw/zinc/91/62/98/1409916298.db2.gz MFQYTEREAVDDFN-UHFFFAOYSA-N 0 0 375.385 3.319 20 5 GGBDRN COc1cc(F)cc2sc(NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)nc21 ZINC000078418839 1409916733 /nfs/dbraw/zinc/91/67/33/1409916733.db2.gz JAFMUFWUDJOIOU-UHFFFAOYSA-N 0 0 393.400 3.194 20 5 GGBDRN CN(CC1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1)C(=O)OC(C)(C)C ZINC000078440713 1409916872 /nfs/dbraw/zinc/91/68/72/1409916872.db2.gz QTLRZZQKKDFDRL-UHFFFAOYSA-N 0 0 391.468 3.243 20 5 GGBDRN CC[C@H](C)[C@H](C)N(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC1 ZINC000078513547 1409922216 /nfs/dbraw/zinc/92/22/16/1409922216.db2.gz BRHPMEDHVDOPLI-RYUDHWBXSA-N 0 0 379.482 3.211 20 5 GGBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000078557131 1409925791 /nfs/dbraw/zinc/92/57/91/1409925791.db2.gz SMMJZEVOQVERLY-UHFFFAOYSA-N 0 0 379.804 3.049 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000176733922 1428441430 /nfs/dbraw/zinc/44/14/30/1428441430.db2.gz RRTIKOBHNSCNAM-DOTOQJQBSA-N 0 0 390.484 3.302 20 5 GGBDRN COc1ccc(C(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000078663889 1409932067 /nfs/dbraw/zinc/93/20/67/1409932067.db2.gz FGNDKFNXKIFUCC-AWEZNQCLSA-N 0 0 384.310 3.086 20 5 GGBDRN CC(C)c1ccc(OCCNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000078721190 1409934870 /nfs/dbraw/zinc/93/48/70/1409934870.db2.gz HYEYSAOWNZYJJS-UHFFFAOYSA-N 0 0 395.419 3.108 20 5 GGBDRN CC(=O)c1ccc(N(CCO)Cc2cnn(Cc3ccccc3)c2)c([N+](=O)[O-])c1 ZINC000176737880 1428442267 /nfs/dbraw/zinc/44/22/67/1428442267.db2.gz WNVPMYXTPIFJJG-UHFFFAOYSA-N 0 0 394.431 3.041 20 5 GGBDRN COCCCOC1CCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000176737231 1428442381 /nfs/dbraw/zinc/44/23/81/1428442381.db2.gz ZAEZQTHNZCFGBD-OAHLLOKOSA-N 0 0 379.457 3.191 20 5 GGBDRN Cc1nc(-c2ccc(S(=O)(=O)Nc3ccc(F)c([N+](=O)[O-])c3)cc2)co1 ZINC000078873616 1409939565 /nfs/dbraw/zinc/93/95/65/1409939565.db2.gz CDZQIXPNDSDBSF-UHFFFAOYSA-N 0 0 377.353 3.498 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(NCCCCNc2ccccn2)c([N+](=O)[O-])c1 ZINC000078880502 1409941193 /nfs/dbraw/zinc/94/11/93/1409941193.db2.gz ADWJRNJGPKVCLZ-UHFFFAOYSA-N 0 0 394.435 3.259 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCOc2ccccc2C(C)C)c([N+](=O)[O-])c1 ZINC000078923855 1409943539 /nfs/dbraw/zinc/94/35/39/1409943539.db2.gz IWSYDDOXELQCDN-UHFFFAOYSA-N 0 0 378.450 3.384 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCOc1ccccc1C(C)C ZINC000078923713 1409943818 /nfs/dbraw/zinc/94/38/18/1409943818.db2.gz CKIFNOTWZDWWHG-UHFFFAOYSA-N 0 0 378.450 3.384 20 5 GGBDRN C[C@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)N1CCc2ccccc2C1 ZINC000078928058 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/nfs/dbraw/zinc/30/86/84/1410308684.db2.gz JTXOQNMZZURBPU-UHFFFAOYSA-N 0 0 376.804 3.249 20 5 GGBDRN CCc1nn(C)c(N2CCN([C@H](C)c3ccc(F)cc3F)CC2)c1[N+](=O)[O-] ZINC000094155591 1410308769 /nfs/dbraw/zinc/30/87/69/1410308769.db2.gz TXZCMSLMJGDOQI-GFCCVEGCSA-N 0 0 379.411 3.052 20 5 GGBDRN CCc1nn(C)c(NCCOc2ncc(C(F)(F)F)cc2Cl)c1[N+](=O)[O-] ZINC000094166549 1410309537 /nfs/dbraw/zinc/30/95/37/1410309537.db2.gz JYYNAUUVOJLYNA-UHFFFAOYSA-N 0 0 393.753 3.449 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000096367394 1410328675 /nfs/dbraw/zinc/32/86/75/1410328675.db2.gz GQPLJFXAGHRSPE-IBGZPJMESA-N 0 0 386.791 3.498 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)ncc1Br ZINC000096514905 1410332655 /nfs/dbraw/zinc/33/26/55/1410332655.db2.gz BOCXXHYASWVLBY-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000096979344 1410342306 /nfs/dbraw/zinc/34/23/06/1410342306.db2.gz BGWIJDLKHIUCSJ-GFCCVEGCSA-N 0 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ZINC000097570230 1410377733 /nfs/dbraw/zinc/37/77/33/1410377733.db2.gz KACVHWDJAHBLOQ-UHFFFAOYSA-N 0 0 377.296 3.402 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000097575298 1410380445 /nfs/dbraw/zinc/38/04/45/1410380445.db2.gz VFFOUBPTOCZBDT-QGZVFWFLSA-N 0 0 378.812 3.499 20 5 GGBDRN C[C@H]1Cc2cc(S(=O)(=O)Oc3cc(F)ccc3[N+](=O)[O-])cc(Cl)c2O1 ZINC000097590674 1410381544 /nfs/dbraw/zinc/38/15/44/1410381544.db2.gz ODISKFDMHSBGNK-QMMMGPOBSA-N 0 0 387.772 3.478 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000097589893 1410381557 /nfs/dbraw/zinc/38/15/57/1410381557.db2.gz STKHHFLBCVUOFA-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN CCOC(=O)c1sc(N(C(=O)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1C ZINC000097589623 1410381582 /nfs/dbraw/zinc/38/15/82/1410381582.db2.gz LTZLGNGMKCACKN-UHFFFAOYSA-N 0 0 389.433 3.275 20 5 GGBDRN COc1ccccc1[C@H]1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2C)C1 ZINC000097593078 1410382815 /nfs/dbraw/zinc/38/28/15/1410382815.db2.gz MRWJPCCGIXEBIQ-AWEZNQCLSA-N 0 0 376.434 3.090 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2nc3ccccc3s2)CC1 ZINC000097656470 1410386209 /nfs/dbraw/zinc/38/62/09/1410386209.db2.gz YCMWEHHFESPKMS-UHFFFAOYSA-N 0 0 396.472 3.091 20 5 GGBDRN O=C(Nc1ccccc1N1CCC(O)CC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000097701349 1410390057 /nfs/dbraw/zinc/39/00/57/1410390057.db2.gz QCTZKPXQWROWPI-UHFFFAOYSA-N 0 0 375.812 3.462 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(CCC(=O)N2CCCC2)cc1 ZINC000097728308 1410392512 /nfs/dbraw/zinc/39/25/12/1410392512.db2.gz YPLJGKRIAMOACW-UHFFFAOYSA-N 0 0 397.431 3.167 20 5 GGBDRN CCOC(=O)C=Cc1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000098006706 1410394001 /nfs/dbraw/zinc/39/40/01/1410394001.db2.gz LNPARKMKWIJCTL-YHYXMXQVSA-N 0 0 380.360 3.300 20 5 GGBDRN C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000098004711 1410394086 /nfs/dbraw/zinc/39/40/86/1410394086.db2.gz LCNAKEICFYAONP-QLKUMGTLSA-N 0 0 388.445 3.231 20 5 GGBDRN CNC(=O)c1cc(Cl)ccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000098040979 1410400366 /nfs/dbraw/zinc/40/03/66/1410400366.db2.gz UWQKRMWDHBCJNK-UHFFFAOYSA-N 0 0 387.783 3.270 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(Cc2ccco2)C[C@H]2CCCO2)cc1C ZINC000098038669 1410400685 /nfs/dbraw/zinc/40/06/85/1410400685.db2.gz VGBYWLIGFLQASM-MRXNPFEDSA-N 0 0 394.449 3.175 20 5 GGBDRN COc1ccccc1[C@@H](C)NC(=O)CNc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000098041128 1410401653 /nfs/dbraw/zinc/40/16/53/1410401653.db2.gz WSOMTXFZPQUGOM-LLVKDONJSA-N 0 0 395.362 3.494 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)c1[N+](=O)[O-] ZINC000098096652 1410413298 /nfs/dbraw/zinc/41/32/98/1410413298.db2.gz NXPSFDQMPCINIV-UHFFFAOYSA-N 0 0 376.376 3.432 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2ccc(OCc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000098097919 1410413688 /nfs/dbraw/zinc/41/36/88/1410413688.db2.gz GEHKOMHTGNSDHP-UHFFFAOYSA-N 0 0 380.404 3.146 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2ccc(COCc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000098098577 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HXTFXAFDONEONS-UHFFFAOYSA-N 0 0 390.827 3.418 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(C(=O)Nc2ccncc2)c1 ZINC000101518806 1410444059 /nfs/dbraw/zinc/44/40/59/1410444059.db2.gz VVFFKZOBVVXBID-UHFFFAOYSA-N 0 0 391.387 3.293 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(C(=O)Nc2ccccn2)c1 ZINC000101518632 1410444394 /nfs/dbraw/zinc/44/43/94/1410444394.db2.gz POPDYPFUJDZMQB-UHFFFAOYSA-N 0 0 391.387 3.293 20 5 GGBDRN NC(=O)CN(CCC1CCCCC1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000101534413 1410452474 /nfs/dbraw/zinc/45/24/74/1410452474.db2.gz PJARHPHTZLKWLL-UHFFFAOYSA-N 0 0 388.468 3.067 20 5 GGBDRN Cc1nn(CN2CCO[C@@H](c3ccccc3Br)C2)c(C)c1[N+](=O)[O-] ZINC000101537921 1410453784 /nfs/dbraw/zinc/45/37/84/1410453784.db2.gz SZGNWWSYWBNVPL-OAHLLOKOSA-N 0 0 395.257 3.202 20 5 GGBDRN COc1ccc(Br)cc1[C@@H]1CCCN1Cn1nccc1[N+](=O)[O-] ZINC000101537932 1410453841 /nfs/dbraw/zinc/45/38/41/1410453841.db2.gz QENMIUVMJXYQPB-ZDUSSCGKSA-N 0 0 381.230 3.357 20 5 GGBDRN CC(C)CCOc1ccccc1CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O ZINC000101539946 1410454820 /nfs/dbraw/zinc/45/48/20/1410454820.db2.gz IMXPYUUZTARIGY-UHFFFAOYSA-N 0 0 393.465 3.279 20 5 GGBDRN CC(=O)Nc1cc(F)c(F)cc1NCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000101542181 1410457529 /nfs/dbraw/zinc/45/75/29/1410457529.db2.gz OAPJWFSDNSHVBP-UHFFFAOYSA-N 0 0 378.335 3.190 20 5 GGBDRN CN(Cc1ccc(F)c(F)c1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000101570467 1410469019 /nfs/dbraw/zinc/46/90/19/1410469019.db2.gz CLODICMVIHFPAI-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCO[C@@H](c2ccccc2)C1 ZINC000101570487 1410469111 /nfs/dbraw/zinc/46/91/11/1410469111.db2.gz NMDKAVVMLMBYKA-OAHLLOKOSA-N 0 0 382.825 3.010 20 5 GGBDRN CCCC(=O)Nc1cccc(CNS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])c1 ZINC000101572310 1410469260 /nfs/dbraw/zinc/46/92/60/1410469260.db2.gz RTJAQAFKOVRDBQ-UHFFFAOYSA-N 0 0 391.449 3.120 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(F)c1 ZINC000101572132 1410469319 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ZINC000103046378 1410822918 /nfs/dbraw/zinc/82/29/18/1410822918.db2.gz AVQKVJLRMUFQME-UHFFFAOYSA-N 0 0 383.404 3.116 20 5 GGBDRN Cc1c(C(=O)NC(C)(C)c2ccc(F)cc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000103052946 1410823283 /nfs/dbraw/zinc/82/32/83/1410823283.db2.gz LKWAFSMAILBKNN-UHFFFAOYSA-N 0 0 383.383 3.288 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)c1 ZINC000103081891 1410826377 /nfs/dbraw/zinc/82/63/77/1410826377.db2.gz PWYUBYSXMOQUOH-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N(C)Cc2ccc(OC)c(C)c2)c([N+](=O)[O-])c1 ZINC000103145020 1410831885 /nfs/dbraw/zinc/83/18/85/1410831885.db2.gz NVYFLFVYMKFOIL-AWEZNQCLSA-N 0 0 387.436 3.379 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176901284 1428516040 /nfs/dbraw/zinc/51/60/40/1428516040.db2.gz IXKFHNSGFFPMDU-AWEZNQCLSA-N 0 0 394.214 3.437 20 5 GGBDRN CC(C)C(=O)Nc1ccc(C(=O)Nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000103201759 1410836742 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OGJLSSRXNJLANT-CQSZACIVSA-N 0 0 399.382 3.271 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000177039350 1428564100 /nfs/dbraw/zinc/56/41/00/1428564100.db2.gz QGHOGMUXRZEJAS-UHFFFAOYSA-N 0 0 381.310 3.113 20 5 GGBDRN O=C(Nc1cccc(OCCn2cncn2)c1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000107831934 1411416879 /nfs/dbraw/zinc/41/68/79/1411416879.db2.gz ZOYNSTARDHRTJQ-UHFFFAOYSA-N 0 0 387.783 3.171 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000177042139 1428565333 /nfs/dbraw/zinc/56/53/33/1428565333.db2.gz ZYCUGKIAXFJLHP-BBRMVZONSA-N 0 0 376.434 3.170 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCCOc1cccc(C(F)(F)F)c1 ZINC000107978784 1411431011 /nfs/dbraw/zinc/43/10/11/1411431011.db2.gz FTCYUOXUNGXAPP-UHFFFAOYSA-N 0 0 384.310 3.188 20 5 GGBDRN C[C@H]1CCCC[C@H]1OCCNC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000108004751 1411431431 /nfs/dbraw/zinc/43/14/31/1411431431.db2.gz ORLBQNJUKWNMTN-QFBILLFUSA-N 0 0 390.484 3.022 20 5 GGBDRN 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397.431 3.142 20 5 GGBDRN COc1ccc(C)cc1N1C[C@@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1=O ZINC000108291344 1411466186 /nfs/dbraw/zinc/46/61/86/1411466186.db2.gz WZQLZKOKLYLMIE-HOCLYGCPSA-N 0 0 397.431 3.142 20 5 GGBDRN CN(C[C@@H]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)C(=O)OC(C)(C)C ZINC000177049465 1428568660 /nfs/dbraw/zinc/56/86/60/1428568660.db2.gz FBBQWOMXIQWMGO-ZDUSSCGKSA-N 0 0 390.440 3.425 20 5 GGBDRN O=C(Nc1nnc(Cc2ccccc2F)s1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000108308959 1411469946 /nfs/dbraw/zinc/46/99/46/1411469946.db2.gz VTHCDWZPDFFQAT-UHFFFAOYSA-N 0 0 398.379 3.305 20 5 GGBDRN CN(Cc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000108308642 1411470202 /nfs/dbraw/zinc/47/02/02/1411470202.db2.gz POTSKEDMOUKJLD-UHFFFAOYSA-N 0 0 383.404 3.196 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1nnc(Cc2ccccc2F)s1 ZINC000108309024 1411471107 /nfs/dbraw/zinc/47/11/07/1411471107.db2.gz GHUZQGIVAYFLHQ-UHFFFAOYSA-N 0 0 387.396 3.227 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC=C(c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000177050724 1428569063 /nfs/dbraw/zinc/56/90/63/1428569063.db2.gz FXDGKOBKRFRLSE-UHFFFAOYSA-N 0 0 392.408 3.221 20 5 GGBDRN COc1ccc(CSCC(=O)NCCc2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000108319682 1411472584 /nfs/dbraw/zinc/47/25/84/1411472584.db2.gz UXXXKQUZUHYLJB-UHFFFAOYSA-N 0 0 395.506 3.269 20 5 GGBDRN CCOC(=O)c1cc(N[C@@H](CO)Cc2c[nH]c3ccccc23)ccc1[N+](=O)[O-] ZINC000177050139 1428569112 /nfs/dbraw/zinc/56/91/12/1428569112.db2.gz JHUJURDOTKFPHD-OAHLLOKOSA-N 0 0 383.404 3.268 20 5 GGBDRN Cc1nc(C)c(CCNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)s1 ZINC000108315224 1411472978 /nfs/dbraw/zinc/47/29/78/1411472978.db2.gz SGZOZOBSKXDVOJ-UHFFFAOYSA-N 0 0 378.410 3.166 20 5 GGBDRN Cc1cccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C(=O)N1CCCC1 ZINC000108349298 1411478800 /nfs/dbraw/zinc/47/88/00/1411478800.db2.gz IIFGDXFFGZEGEK-UHFFFAOYSA-N 0 0 396.447 3.498 20 5 GGBDRN Cc1ccc(Cc2nnc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)s2)cc1 ZINC000108348845 1411479123 /nfs/dbraw/zinc/47/91/23/1411479123.db2.gz UPWJEWWEZCBVGT-UHFFFAOYSA-N 0 0 394.416 3.474 20 5 GGBDRN CCCO[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000108392070 1411488578 /nfs/dbraw/zinc/48/85/78/1411488578.db2.gz VZMLVWIJZFPNBC-LSDHHAIUSA-N 0 0 379.457 3.212 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccc(CCN2CCOCC2)cc1 ZINC000108395094 1411489054 /nfs/dbraw/zinc/48/90/54/1411489054.db2.gz BDYOLTZMGBUJTR-BJMVGYQFSA-N 0 0 381.432 3.121 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC[C@@H]2c2ccccc2C)ccc1[N+](=O)[O-] ZINC000177054007 1428570719 /nfs/dbraw/zinc/57/07/19/1428570719.db2.gz XYTAJEYNJPRVLG-MRXNPFEDSA-N 0 0 376.434 3.438 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC[C@H]2c2ccccc2C)ccc1[N+](=O)[O-] ZINC000177053992 1428570968 /nfs/dbraw/zinc/57/09/68/1428570968.db2.gz XYTAJEYNJPRVLG-INIZCTEOSA-N 0 0 376.434 3.438 20 5 GGBDRN CCOc1cc(C(=O)NCCCc2ccc(OC)cc2)c([N+](=O)[O-])cc1OC ZINC000108441731 1411502147 /nfs/dbraw/zinc/50/21/47/1411502147.db2.gz TWZSLJNQSBHMTQ-UHFFFAOYSA-N 0 0 388.420 3.373 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(-c2cc[nH]n2)cc1 ZINC000108447550 1411504824 /nfs/dbraw/zinc/50/48/24/1411504824.db2.gz VOQARTUKRZAQNF-UHFFFAOYSA-N 0 0 399.794 3.007 20 5 GGBDRN Cc1cccc2c1CC[C@@H]2NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000108450719 1411505961 /nfs/dbraw/zinc/50/59/61/1411505961.db2.gz MWBVTNPUKFDTRJ-HNNXBMFYSA-N 0 0 387.823 3.090 20 5 GGBDRN CC(C)[C@H]1CCC[C@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000108450632 1411506037 /nfs/dbraw/zinc/50/60/37/1411506037.db2.gz DBQLBYWYYSEVCH-STQMWFEESA-N 0 0 381.860 3.309 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000108455359 1411506470 /nfs/dbraw/zinc/50/64/70/1411506470.db2.gz JQNZYAUMJGFOJK-FQEVSTJZSA-N 0 0 388.395 3.085 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC([C@H](O)c2ccc(F)cc2)CC1 ZINC000108458950 1411509392 /nfs/dbraw/zinc/50/93/92/1411509392.db2.gz NFOPLGODGIFBCG-HXUWFJFHSA-N 0 0 388.395 3.085 20 5 GGBDRN 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/nfs/dbraw/zinc/56/35/32/1411563532.db2.gz WIZLUGOECGMINW-UHFFFAOYSA-N 0 0 382.420 3.197 20 5 GGBDRN CCO[C@@H](CCNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCC1 ZINC000177070585 1428576858 /nfs/dbraw/zinc/57/68/58/1428576858.db2.gz AFMGTKIPTHONSH-INIZCTEOSA-N 0 0 397.859 3.288 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(C(=O)Nc2ccccc2)C1 ZINC000108691001 1411574131 /nfs/dbraw/zinc/57/41/31/1411574131.db2.gz ZAHKKUBARRIJQA-INIZCTEOSA-N 0 0 382.420 3.155 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccnc4ccnn43)cc2[N+](=O)[O-])C1 ZINC000108718490 1411584303 /nfs/dbraw/zinc/58/43/03/1411584303.db2.gz SLDDKWIFEUGRPO-ZIAGYGMSSA-N 0 0 394.435 3.372 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccnc4ccnn43)cc2[N+](=O)[O-])C1 ZINC000108718487 1411584350 /nfs/dbraw/zinc/58/43/50/1411584350.db2.gz SLDDKWIFEUGRPO-KBPBESRZSA-N 0 0 394.435 3.372 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)cc1[N+](=O)[O-] ZINC000108727005 1411587354 /nfs/dbraw/zinc/58/73/54/1411587354.db2.gz 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/nfs/dbraw/zinc/80/65/86/1411806586.db2.gz UMFARRZJPMROPC-UHFFFAOYSA-N 0 0 388.468 3.264 20 5 GGBDRN CC(C)CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000109736080 1411806820 /nfs/dbraw/zinc/80/68/20/1411806820.db2.gz JRTNQTCEZCIYRM-XJKSGUPXSA-N 0 0 379.482 3.051 20 5 GGBDRN Cc1c(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C ZINC000109737767 1411806934 /nfs/dbraw/zinc/80/69/34/1411806934.db2.gz RYUGQAWZTTZVTO-UHFFFAOYSA-N 0 0 386.795 3.298 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000109738880 1411806997 /nfs/dbraw/zinc/80/69/97/1411806997.db2.gz DSTQHFSIEKOAET-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN O=C(Nc1cccc(-c2nnnn2C2CC2)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000109741102 1411807190 /nfs/dbraw/zinc/80/71/90/1411807190.db2.gz RPHIAOIVTXHNAS-UHFFFAOYSA-N 0 0 384.783 3.489 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1c(F)cccc1N1CCCC1 ZINC000109745781 1411807498 /nfs/dbraw/zinc/80/74/98/1411807498.db2.gz KIYHIGGRMDXHQP-UHFFFAOYSA-N 0 0 388.399 3.393 20 5 GGBDRN O=C(CN1CCC(c2nc3ccccc3[nH]2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000109764418 1411808149 /nfs/dbraw/zinc/80/81/49/1411808149.db2.gz PVHKTOCOFIDJIZ-UHFFFAOYSA-N 0 0 379.420 3.289 20 5 GGBDRN O=C(NCc1ccc(OCC2CC2)nc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000109859221 1411814631 /nfs/dbraw/zinc/81/46/31/1411814631.db2.gz ADWPSAVPWYSYKC-UHFFFAOYSA-N 0 0 396.447 3.309 20 5 GGBDRN Cn1c(CCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000109870387 1411815606 /nfs/dbraw/zinc/81/56/06/1411815606.db2.gz FDDNIIMRJALZLR-UHFFFAOYSA-N 0 0 397.410 3.167 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000109869340 1411815664 /nfs/dbraw/zinc/81/56/64/1411815664.db2.gz CVRSZQRYJCAIET-OAHLLOKOSA-N 0 0 398.467 3.361 20 5 GGBDRN Cc1cccn2cc(CNC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)nc12 ZINC000109881316 1411816224 /nfs/dbraw/zinc/81/62/24/1411816224.db2.gz ISGHSNFWYRPVMU-UHFFFAOYSA-N 0 0 393.447 3.084 20 5 GGBDRN COc1ccc([C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C2CC2)cc1 ZINC000109985483 1411823268 /nfs/dbraw/zinc/82/32/68/1411823268.db2.gz HCUDMWLOTCMUHM-HXUWFJFHSA-N 0 0 393.399 3.326 20 5 GGBDRN O=C(Nc1cc(-c2cccs2)[nH]n1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000109987114 1411823611 /nfs/dbraw/zinc/82/36/11/1411823611.db2.gz AZNWLROEAMISKU-UHFFFAOYSA-N 0 0 381.373 3.140 20 5 GGBDRN CC(C)C(=O)Nc1cccc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000109985734 1411823620 /nfs/dbraw/zinc/82/36/20/1411823620.db2.gz FRWXHTGDJDLSFN-UHFFFAOYSA-N 0 0 394.387 3.283 20 5 GGBDRN CC(C)n1cnnc1C1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000109993736 1411823873 /nfs/dbraw/zinc/82/38/73/1411823873.db2.gz NMWGBRFWNWTVNL-UHFFFAOYSA-N 0 0 389.481 3.266 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000109998616 1411824027 /nfs/dbraw/zinc/82/40/27/1411824027.db2.gz HRIABOQQBPSCPC-AWEZNQCLSA-N 0 0 389.481 3.266 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC(c2nncn2C2CC2)CC1 ZINC000110006014 1411824709 /nfs/dbraw/zinc/82/47/09/1411824709.db2.gz XDARPPVYDMYSIL-UHFFFAOYSA-N 0 0 398.467 3.120 20 5 GGBDRN Cn1c(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)nc2c1cccc2F ZINC000110008357 1411824833 /nfs/dbraw/zinc/82/48/33/1411824833.db2.gz UCCPYQCVGQMZFF-UHFFFAOYSA-N 0 0 399.426 3.172 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2nc3ccccc3n2C)cc1OC ZINC000110028939 1411826264 /nfs/dbraw/zinc/82/62/64/1411826264.db2.gz VLDFZQNWCGSNRH-UHFFFAOYSA-N 0 0 398.419 3.161 20 5 GGBDRN COc1ccc(NC(=O)CN2[C@H](C)CO[C@@H](c3ccccc3)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000110033482 1411826531 /nfs/dbraw/zinc/82/65/31/1411826531.db2.gz GXNRAPVUVHYKSH-LRAJWGHMSA-N 0 0 399.447 3.392 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(CCc1ccccc1)[C@@H]1CCOC1 ZINC000177138398 1428599208 /nfs/dbraw/zinc/59/92/08/1428599208.db2.gz WEYCEVKCXXMIHQ-LJQANCHMSA-N 0 0 383.448 3.175 20 5 GGBDRN COc1cccc(NC2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000110036931 1411826776 /nfs/dbraw/zinc/82/67/76/1411826776.db2.gz HSFODOFIXABKNA-UHFFFAOYSA-N 0 0 384.436 3.118 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(-n2ccnc2)c(F)c1 ZINC000110122275 1411832492 /nfs/dbraw/zinc/83/24/92/1411832492.db2.gz QBTCQANSKWNKPO-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN COC(=O)CCc1nc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)no1 ZINC000110140310 1411833585 /nfs/dbraw/zinc/83/35/85/1411833585.db2.gz UCCDONDJFWFULO-UHFFFAOYSA-N 0 0 397.387 3.253 20 5 GGBDRN O=C(Nc1ccc(F)c(F)c1F)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110159556 1411834712 /nfs/dbraw/zinc/83/47/12/1411834712.db2.gz ZPYKEAJWUSPSSR-JTQLQIEISA-N 0 0 399.350 3.317 20 5 GGBDRN CC(=O)c1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000110153576 1411834726 /nfs/dbraw/zinc/83/47/26/1411834726.db2.gz YZRIKFIDFXMZKL-CQSZACIVSA-N 0 0 387.417 3.102 20 5 GGBDRN O=C(NCc1ccccc1Cl)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110160069 1411834878 /nfs/dbraw/zinc/83/48/78/1411834878.db2.gz LDRDGBZTLDDBKT-CYBMUJFWSA-N 0 0 393.852 3.231 20 5 GGBDRN O=C(OCc1ccc(F)cc1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110161138 1411834882 /nfs/dbraw/zinc/83/48/82/1411834882.db2.gz CUEKUSGPMZRDJG-CYBMUJFWSA-N 0 0 378.381 3.143 20 5 GGBDRN Cc1ccc(F)cc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110161022 1411834899 /nfs/dbraw/zinc/83/48/99/1411834899.db2.gz ILPIDPATWKJPAI-ZDUSSCGKSA-N 0 0 377.397 3.347 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110161307 1411834931 /nfs/dbraw/zinc/83/49/31/1411834931.db2.gz YVAZRAWJTFWDQC-CYBMUJFWSA-N 0 0 389.433 3.217 20 5 GGBDRN O=C(NCCCc1ccccc1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110162081 1411834952 /nfs/dbraw/zinc/83/49/52/1411834952.db2.gz ITBHZROUQCGVAX-OAHLLOKOSA-N 0 0 387.461 3.010 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(F)c1 ZINC000110162484 1411834992 /nfs/dbraw/zinc/83/49/92/1411834992.db2.gz HIYSLVBKCJTTRD-CYBMUJFWSA-N 0 0 377.397 3.347 20 5 GGBDRN O=C(NCCC1=CCCCC1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110162333 1411835020 /nfs/dbraw/zinc/83/50/20/1411835020.db2.gz OQAAIMIOHVMPGM-AWEZNQCLSA-N 0 0 377.466 3.268 20 5 GGBDRN O=C(NCCCc1ccccc1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110162078 1411835025 /nfs/dbraw/zinc/83/50/25/1411835025.db2.gz ITBHZROUQCGVAX-HNNXBMFYSA-N 0 0 387.461 3.010 20 5 GGBDRN CC(=O)c1ccccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110165298 1411835145 /nfs/dbraw/zinc/83/51/45/1411835145.db2.gz KNVCWEQINVDLCK-CQSZACIVSA-N 0 0 387.417 3.102 20 5 GGBDRN CN(Cc1ccccc1F)C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110170783 1411835552 /nfs/dbraw/zinc/83/55/52/1411835552.db2.gz NPOCTYXGPBJJPG-CQSZACIVSA-N 0 0 391.424 3.059 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c1 ZINC000110177862 1411835722 /nfs/dbraw/zinc/83/57/22/1411835722.db2.gz FJZGXZZYKAPTCH-UHFFFAOYSA-N 0 0 384.360 3.307 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(S(=O)(=O)C(C)C)ccc1F ZINC000110177778 1411835843 /nfs/dbraw/zinc/83/58/43/1411835843.db2.gz SVSNBJPLEGKDCM-UHFFFAOYSA-N 0 0 380.397 3.477 20 5 GGBDRN O=C(N[C@@H]1CCc2ccccc21)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110187125 1411836201 /nfs/dbraw/zinc/83/62/01/1411836201.db2.gz XNXQKFLSNSGYPE-HUUCEWRRSA-N 0 0 385.445 3.065 20 5 GGBDRN Cc1ccc(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(C)c1 ZINC000110200409 1411837358 /nfs/dbraw/zinc/83/73/58/1411837358.db2.gz WPVUUNCAQUTSIR-HNNXBMFYSA-N 0 0 387.461 3.194 20 5 GGBDRN COc1cc(F)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110204311 1411837380 /nfs/dbraw/zinc/83/73/80/1411837380.db2.gz FLOLQONNCLPSDF-GFCCVEGCSA-N 0 0 393.396 3.047 20 5 GGBDRN Cc1ccc([C@@H](O)CNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])cc1 ZINC000110203314 1411837501 /nfs/dbraw/zinc/83/75/01/1411837501.db2.gz KTTMJHBQMRUULM-HNNXBMFYSA-N 0 0 386.376 3.045 20 5 GGBDRN C[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c2ccccc21 ZINC000110220181 1411838150 /nfs/dbraw/zinc/83/81/50/1411838150.db2.gz GWTWWCJOISJRNS-DOMZBBRYSA-N 0 0 385.445 3.411 20 5 GGBDRN O=C(CN1C(=O)CCc2ccccc21)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000110216464 1411838281 /nfs/dbraw/zinc/83/82/81/1411838281.db2.gz NKZDFHYPWBQIRW-UHFFFAOYSA-N 0 0 391.330 3.114 20 5 GGBDRN O=C(NCc1cc2ccccc2o1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110220336 1411838411 /nfs/dbraw/zinc/83/84/11/1411838411.db2.gz FGGAECPSKNELGS-AWEZNQCLSA-N 0 0 399.428 3.324 20 5 GGBDRN O=C(Nc1ccc2ncccc2c1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110221216 1411838485 /nfs/dbraw/zinc/83/84/85/1411838485.db2.gz DHODAUXQYIPAAB-HNNXBMFYSA-N 0 0 396.428 3.448 20 5 GGBDRN C[C@@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c2ccccc21 ZINC000110220185 1411838531 /nfs/dbraw/zinc/83/85/31/1411838531.db2.gz GWTWWCJOISJRNS-IUODEOHRSA-N 0 0 385.445 3.411 20 5 GGBDRN Cc1ccc(-c2nc(CCNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)co2)cc1 ZINC000110244427 1411839787 /nfs/dbraw/zinc/83/97/87/1411839787.db2.gz JRJOJZKRDFNDKA-UHFFFAOYSA-N 0 0 387.417 3.079 20 5 GGBDRN CC1CCC(CNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000110244968 1411839989 /nfs/dbraw/zinc/83/99/89/1411839989.db2.gz DTHLRVWODJMQMO-RUXDESIVSA-N 0 0 379.482 3.203 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CN1C(=O)CCc2ccccc21 ZINC000110245383 1411840153 /nfs/dbraw/zinc/84/01/53/1411840153.db2.gz XTIBTODTXWXBSS-UHFFFAOYSA-N 0 0 381.432 3.311 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000177140113 1428600331 /nfs/dbraw/zinc/60/03/31/1428600331.db2.gz AXICYLRESGVEEF-DOMZBBRYSA-N 0 0 375.381 3.316 20 5 GGBDRN CCCCNC(=O)C1(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCCCC1 ZINC000110258205 1411840832 /nfs/dbraw/zinc/84/08/32/1411840832.db2.gz NTBINAWWDVSULY-UHFFFAOYSA-N 0 0 386.452 3.425 20 5 GGBDRN Cc1cccc2c1CCN2C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110257822 1411840872 /nfs/dbraw/zinc/84/08/72/1411840872.db2.gz ARVZVZDOANVBBG-HNNXBMFYSA-N 0 0 385.445 3.159 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000177140142 1428600388 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399.472 3.373 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1C(=O)N1CCCc2ccccc2C1 ZINC000110305663 1411843300 /nfs/dbraw/zinc/84/33/00/1411843300.db2.gz MXARNJCWPMINDE-INIZCTEOSA-N 0 0 399.472 3.236 20 5 GGBDRN CCc1nc(COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cs1 ZINC000110306701 1411843530 /nfs/dbraw/zinc/84/35/30/1411843530.db2.gz VVVICDDXPLTTFH-NSHDSACASA-N 0 0 395.462 3.023 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000110346744 1411845570 /nfs/dbraw/zinc/84/55/70/1411845570.db2.gz CGNLYLIAHURXFN-UHFFFAOYSA-N 0 0 392.358 3.387 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cccc([N+](=O)[O-])c1C ZINC000110347249 1411845893 /nfs/dbraw/zinc/84/58/93/1411845893.db2.gz KWVHWSJPXBYTDB-UHFFFAOYSA-N 0 0 392.358 3.387 20 5 GGBDRN Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000110355112 1411846684 /nfs/dbraw/zinc/84/66/84/1411846684.db2.gz XPDBOJQJTWJWDJ-CYBMUJFWSA-N 0 0 388.855 3.395 20 5 GGBDRN COc1ccccc1Oc1ccc(CNC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1 ZINC000110359191 1411846963 /nfs/dbraw/zinc/84/69/63/1411846963.db2.gz MWZQJZGNJJOFKE-UHFFFAOYSA-N 0 0 396.403 3.368 20 5 GGBDRN O=C(NC[C@H]1CCc2ccccc21)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110370280 1411847191 /nfs/dbraw/zinc/84/71/91/1411847191.db2.gz BTNLCCCKSJYTRM-ZBFHGGJFSA-N 0 0 399.472 3.107 20 5 GGBDRN O=C(NC[C@H]1CCc2ccccc21)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110370285 1411847243 /nfs/dbraw/zinc/84/72/43/1411847243.db2.gz BTNLCCCKSJYTRM-GDBMZVCRSA-N 0 0 399.472 3.107 20 5 GGBDRN CC(C)(C(=O)Nc1nc(-c2ccccc2Cl)ns1)n1cc([N+](=O)[O-])cn1 ZINC000110382207 1411847990 /nfs/dbraw/zinc/84/79/90/1411847990.db2.gz CGIWEQLJNJTYKA-UHFFFAOYSA-N 0 0 392.828 3.337 20 5 GGBDRN Cc1c(C(=O)N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)cccc1[N+](=O)[O-] ZINC000110390637 1411848232 /nfs/dbraw/zinc/84/82/32/1411848232.db2.gz CWNWQMYKBBZIKY-MRXNPFEDSA-N 0 0 381.392 3.475 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000110419768 1411849797 /nfs/dbraw/zinc/84/97/97/1411849797.db2.gz VSNQGRFPCMGDQH-FHSNZYRGSA-N 0 0 385.376 3.494 20 5 GGBDRN O=C(NCCc1nc2c(s1)CCCC2)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000110429118 1411850287 /nfs/dbraw/zinc/85/02/87/1411850287.db2.gz UXSRFHMMXDDZNO-UHFFFAOYSA-N 0 0 397.460 3.088 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)c1 ZINC000110440958 1411851245 /nfs/dbraw/zinc/85/12/45/1411851245.db2.gz KSGQASXKBLRJMK-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1N1CCC(C2OCCO2)CC1 ZINC000110473906 1411851615 /nfs/dbraw/zinc/85/16/15/1411851615.db2.gz HTJODEYAVVUTQF-UHFFFAOYSA-N 0 0 391.302 3.111 20 5 GGBDRN Cn1cc(C(=O)N2CCN(C)c3ccccc32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000110477630 1411851916 /nfs/dbraw/zinc/85/19/16/1411851916.db2.gz ZBUGXTIRIMVVPI-UHFFFAOYSA-N 0 0 377.404 3.092 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC[C@H]1c1ccncc1 ZINC000110480918 1411852198 /nfs/dbraw/zinc/85/21/98/1411852198.db2.gz WXZPLHRXYWGCEA-KXBFYZLASA-N 0 0 396.447 3.252 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C1CC1)[C@H]1CCc2ccccc21 ZINC000110488679 1411852484 /nfs/dbraw/zinc/85/24/84/1411852484.db2.gz YXLMVMQSTASZGW-VLIAUNLRSA-N 0 0 393.443 3.392 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1C ZINC000110486470 1411852589 /nfs/dbraw/zinc/85/25/89/1411852589.db2.gz SWMDKEWOPPAKHK-UHFFFAOYSA-N 0 0 382.420 3.115 20 5 GGBDRN Cc1c(C(=O)N2CCN(Cc3ccccc3)C[C@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000110507150 1411853566 /nfs/dbraw/zinc/85/35/66/1411853566.db2.gz MMOGCIWEPSSXJC-CQSZACIVSA-N 0 0 398.419 3.158 20 5 GGBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000110518610 1411855034 /nfs/dbraw/zinc/85/50/34/1411855034.db2.gz FEUCKWUGHPBFIY-LRDDRELGSA-N 0 0 392.843 3.168 20 5 GGBDRN 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O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCn2cnnc2C1 ZINC000110584115 1411858459 /nfs/dbraw/zinc/85/84/59/1411858459.db2.gz PLCPRBNRELVBMN-UHFFFAOYSA-N 0 0 399.794 3.288 20 5 GGBDRN CCC(CC)(NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1 ZINC000110601581 1411859604 /nfs/dbraw/zinc/85/96/04/1411859604.db2.gz NLQBHWRMVKCHPB-UHFFFAOYSA-N 0 0 377.828 3.242 20 5 GGBDRN Cc1ccccc1CN(C)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110603062 1411859674 /nfs/dbraw/zinc/85/96/74/1411859674.db2.gz SZPGKGJMQVQQLJ-HNNXBMFYSA-N 0 0 387.461 3.228 20 5 GGBDRN Cn1c(CCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])nc2cc(F)ccc21 ZINC000110775795 1411869328 /nfs/dbraw/zinc/86/93/28/1411869328.db2.gz MQYBGELBKTYQGU-UHFFFAOYSA-N 0 0 376.775 3.247 20 5 GGBDRN CCCN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H](c1ccc(F)cc1)c1cccnc1 ZINC000110780274 1411869584 /nfs/dbraw/zinc/86/95/84/1411869584.db2.gz MBUQORTXAHEKHG-FQEVSTJZSA-N 0 0 397.410 3.354 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCc1nc(-c2ccccn2)cs1 ZINC000110795630 1411870198 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SHWLHBYPXOEFAZ-AWEZNQCLSA-N 0 0 389.456 3.051 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)CC1CCOCC1 ZINC000110978860 1411880231 /nfs/dbraw/zinc/88/02/31/1411880231.db2.gz QNOLKKUMURTNHU-UHFFFAOYSA-N 0 0 383.448 3.462 20 5 GGBDRN O=C(N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1ccc([N+](=O)[O-])o1 ZINC000110981919 1411880299 /nfs/dbraw/zinc/88/02/99/1411880299.db2.gz HJTHAUDGOMVIAK-ZDUSSCGKSA-N 0 0 381.791 3.375 20 5 GGBDRN CC(C)C[C@H](CNC(=O)OC(C)(C)C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000110999494 1411881601 /nfs/dbraw/zinc/88/16/01/1411881601.db2.gz VCWHKEXDKQDLFQ-OAHLLOKOSA-N 0 0 379.457 3.193 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C[C@H](C)O1 ZINC000111003963 1411881798 /nfs/dbraw/zinc/88/17/98/1411881798.db2.gz LGUHTERURYHTOQ-DOTOQJQBSA-N 0 0 375.469 3.471 20 5 GGBDRN CC[C@H]1CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000111018871 1411882344 /nfs/dbraw/zinc/88/23/44/1411882344.db2.gz FBIJFIFAYFCMGJ-MNOVXSKESA-N 0 0 376.331 3.175 20 5 GGBDRN CC[C@H]1CN(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)C[C@@H](C)O1 ZINC000111017118 1411882386 /nfs/dbraw/zinc/88/23/86/1411882386.db2.gz QDIDNKZXZISZGM-ACJLOTCBSA-N 0 0 386.452 3.096 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)C[C@@H](C)O1 ZINC000111017116 1411882471 /nfs/dbraw/zinc/88/24/71/1411882471.db2.gz QDIDNKZXZISZGM-FZKQIMNGSA-N 0 0 386.452 3.096 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])N1Cc2ccccc2C1 ZINC000111117103 1411888270 /nfs/dbraw/zinc/88/82/70/1411888270.db2.gz YHWNSOXYNCLAOA-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])CN(C)C(=O)OC(C)(C)C ZINC000111128303 1411889138 /nfs/dbraw/zinc/88/91/38/1411889138.db2.gz OCWRRIUPFXFPBM-NSHDSACASA-N 0 0 385.848 3.481 20 5 GGBDRN Cc1c(C(=O)N2CCC[C@H](C3N=NC(=S)N3C(C)C)C2)cccc1[N+](=O)[O-] ZINC000111132366 1411889731 /nfs/dbraw/zinc/88/97/31/1411889731.db2.gz ITAVRICSZAAISQ-ZDUSSCGKSA-N 0 0 389.481 3.384 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000111135072 1411890125 /nfs/dbraw/zinc/89/01/25/1411890125.db2.gz NECQPSSLFHKNMO-AWEZNQCLSA-N 0 0 389.481 3.005 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCCC(=O)N1CCc2ccccc21 ZINC000111140469 1411891174 /nfs/dbraw/zinc/89/11/74/1411891174.db2.gz RAFCUEGGFJSINO-FMIVXFBMSA-N 0 0 379.416 3.094 20 5 GGBDRN CSc1ccc(C(=O)NCCCC(=O)N2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000111141723 1411891446 /nfs/dbraw/zinc/89/14/46/1411891446.db2.gz ZUBMHMGBNXDWDW-UHFFFAOYSA-N 0 0 399.472 3.416 20 5 GGBDRN CC(C)NC(=O)c1ccc(Cl)c(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000111188650 1411894452 /nfs/dbraw/zinc/89/44/52/1411894452.db2.gz ZEERRKFAKGVKJH-UHFFFAOYSA-N 0 0 390.827 3.097 20 5 GGBDRN COC(=O)CCN(Cc1ccc(F)c(F)c1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000111255895 1411897845 /nfs/dbraw/zinc/89/78/45/1411897845.db2.gz PBQVJAZULQLFNO-UHFFFAOYSA-N 0 0 394.374 3.447 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)N(C)CCn2cccn2)c([N+](=O)[O-])c1 ZINC000111283457 1411899607 /nfs/dbraw/zinc/89/96/07/1411899607.db2.gz XCGBESOSEGEQFX-HXUWFJFHSA-N 0 0 393.447 3.412 20 5 GGBDRN COc1cccc(NC2CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)c1 ZINC000111304409 1411904068 /nfs/dbraw/zinc/90/40/68/1411904068.db2.gz UMGCWMUBQABLFW-UHFFFAOYSA-N 0 0 398.463 3.427 20 5 GGBDRN CC(C)(C)NC(=O)c1ccccc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000177162049 1428606199 /nfs/dbraw/zinc/60/61/99/1428606199.db2.gz NMWBHXTXYAMLHC-GOSISDBHSA-N 0 0 396.447 3.341 20 5 GGBDRN O=[N+]([O-])c1ccccc1CNS(=O)(=O)Cc1ccc(OC(F)(F)F)cc1 ZINC000111329948 1411916829 /nfs/dbraw/zinc/91/68/29/1411916829.db2.gz DFVJTJBRACOWSZ-UHFFFAOYSA-N 0 0 390.339 3.113 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000111365212 1411925331 /nfs/dbraw/zinc/92/53/31/1411925331.db2.gz ARNLIFCKDHNRGJ-SJKOYZFVSA-N 0 0 396.852 3.399 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@H]2CCCc3nc(C)sc32)cc1[N+](=O)[O-] ZINC000111366309 1411926881 /nfs/dbraw/zinc/92/68/81/1411926881.db2.gz 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QPOBRNWOFVMXNY-ZDUSSCGKSA-N 0 0 395.506 3.490 20 5 GGBDRN COc1ccc(S(=O)(=O)N(CCc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000113947656 1412357830 /nfs/dbraw/zinc/35/78/30/1412357830.db2.gz BIPFQLCFVYNTII-UHFFFAOYSA-N 0 0 394.424 3.138 20 5 GGBDRN Cc1ccc(NCc2ccccc2[N+](=O)[O-])c(C)c1S(=O)(=O)NC1CC1 ZINC000177247268 1428650407 /nfs/dbraw/zinc/65/04/07/1428650407.db2.gz PBGXVFHMHYFXBB-UHFFFAOYSA-N 0 0 375.450 3.264 20 5 GGBDRN COC(=O)CCN(Cc1ccncc1)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000177248328 1428650111 /nfs/dbraw/zinc/65/01/11/1428650111.db2.gz XUXZHLRFSCDBBO-UHFFFAOYSA-N 0 0 399.447 3.493 20 5 GGBDRN Cc1cc(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)c2ccccc2n1 ZINC000114095373 1412378958 /nfs/dbraw/zinc/37/89/58/1412378958.db2.gz AJBLWWWEKKHKOU-NRFANRHFSA-N 0 0 390.399 3.419 20 5 GGBDRN Cc1cc2nc(C)c(CCC(=O)N3CCCc4ccc([N+](=O)[O-])cc43)c(C)n2n1 ZINC000114101671 1412379668 /nfs/dbraw/zinc/37/96/68/1412379668.db2.gz HJDYDPGNUINTGJ-UHFFFAOYSA-N 0 0 393.447 3.475 20 5 GGBDRN C[C@H]1Oc2ccccc2N(CCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)C1=O ZINC000114101125 1412379808 /nfs/dbraw/zinc/37/98/08/1412379808.db2.gz HMPVILSMNHAUBP-CQSZACIVSA-N 0 0 395.415 3.078 20 5 GGBDRN CCc1cccc2c1N(C(=O)Cn1c(=O)oc3cc([N+](=O)[O-])ccc31)CCC2 ZINC000114101050 1412379887 /nfs/dbraw/zinc/37/98/87/1412379887.db2.gz LXWAHBXGGVDFLN-UHFFFAOYSA-N 0 0 381.388 3.045 20 5 GGBDRN COc1ccc(-n2ccc(C(=O)N3CCCc4ccc([N+](=O)[O-])cc43)n2)cc1 ZINC000114101604 1412379951 /nfs/dbraw/zinc/37/99/51/1412379951.db2.gz FJRBLMIDXYHVRW-UHFFFAOYSA-N 0 0 378.388 3.382 20 5 GGBDRN CC(C)N(Cc1nc(-c2ccc3c(c2)OCO3)c[nH]1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000114146793 1412384089 /nfs/dbraw/zinc/38/40/89/1412384089.db2.gz KYLJEZIARLNFSV-UHFFFAOYSA-N 0 0 398.375 3.357 20 5 GGBDRN O=C(N[C@@H]1CCc2n[nH]cc2C1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000114153933 1412384793 /nfs/dbraw/zinc/38/47/93/1412384793.db2.gz NCUXJRWGXCYYOE-MRXNPFEDSA-N 0 0 377.404 3.349 20 5 GGBDRN O=C(CN(CCO)[C@@H]1CCc2ccccc21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114192622 1412391550 /nfs/dbraw/zinc/39/15/50/1412391550.db2.gz KDOJDGZBMMRUOA-QGZVFWFLSA-N 0 0 389.839 3.169 20 5 GGBDRN O=C(CN(CCO)[C@H]1CCc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000114192308 1412391592 /nfs/dbraw/zinc/39/15/92/1412391592.db2.gz NLDBIKDIVAVIJJ-SFHVURJKSA-N 0 0 389.839 3.169 20 5 GGBDRN O=C(CN(CCO)[C@H]1CCc2ccccc21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114191978 1412391660 /nfs/dbraw/zinc/39/16/60/1412391660.db2.gz PCTFAIGPHVZVAW-KRWDZBQOSA-N 0 0 389.839 3.169 20 5 GGBDRN O=C(CN(CCO)[C@@H]1CCc2ccccc21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114191980 1412391911 /nfs/dbraw/zinc/39/19/11/1412391911.db2.gz PCTFAIGPHVZVAW-QGZVFWFLSA-N 0 0 389.839 3.169 20 5 GGBDRN O=C(CN(CCO)[C@@H]1CCc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000114192309 1412392196 /nfs/dbraw/zinc/39/21/96/1412392196.db2.gz NLDBIKDIVAVIJJ-GOSISDBHSA-N 0 0 389.839 3.169 20 5 GGBDRN CC(C)[C@H](C)N(CC(F)(F)F)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000114267957 1412398795 /nfs/dbraw/zinc/39/87/95/1412398795.db2.gz HJEIIMCXINDZTL-NSHDSACASA-N 0 0 385.346 3.225 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)[C@@H]1CCc2ccccc2C1 ZINC000114279266 1412400929 /nfs/dbraw/zinc/40/09/29/1412400929.db2.gz PKYNAMYQMBMZBS-GOSISDBHSA-N 0 0 395.459 3.061 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(C)[C@H]2CCc3ccccc3C2)cc([N+](=O)[O-])c1 ZINC000114281438 1412401215 /nfs/dbraw/zinc/40/12/15/1412401215.db2.gz FAJJQSLHNBSKHN-SFHVURJKSA-N 0 0 382.416 3.401 20 5 GGBDRN CN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 ZINC000114282548 1412401295 /nfs/dbraw/zinc/40/12/95/1412401295.db2.gz MFRFVSCZNYQJLW-SFHVURJKSA-N 0 0 376.416 3.410 20 5 GGBDRN COc1ccc(Cl)cc1N(C)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000114283481 1412402232 /nfs/dbraw/zinc/40/22/32/1412402232.db2.gz CYOBVBFTLQWSRZ-UHFFFAOYSA-N 0 0 387.783 3.114 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1OC ZINC000114285381 1412402465 /nfs/dbraw/zinc/40/24/65/1412402465.db2.gz MVCHUQNJPNUSOC-LBPRGKRZSA-N 0 0 391.399 3.431 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NCCOc3cccnc3)cc2[N+](=O)[O-])CC1 ZINC000114298595 1412405648 /nfs/dbraw/zinc/40/56/48/1412405648.db2.gz CCVJAURUARUBJR-UHFFFAOYSA-N 0 0 384.436 3.035 20 5 GGBDRN Cc1c(C(=O)NCC(C)(C)c2cccs2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000114305656 1412408292 /nfs/dbraw/zinc/40/82/92/1412408292.db2.gz OLHOOSGTUJUREA-UHFFFAOYSA-N 0 0 385.449 3.253 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@H](Cc1ccc(Cl)cc1)C(F)(F)F ZINC000114306889 1412408821 /nfs/dbraw/zinc/40/88/21/1412408821.db2.gz JOLMMYISNCCRAP-GFCCVEGCSA-N 0 0 391.733 3.470 20 5 GGBDRN C[C@@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000114317959 1412412818 /nfs/dbraw/zinc/41/28/18/1412412818.db2.gz ACKIUQJYIIAVDC-ZDUSSCGKSA-N 0 0 379.482 3.157 20 5 GGBDRN CSc1ccc(C(=O)c2ccccc2C(=O)NCc2ncc[nH]2)cc1[N+](=O)[O-] ZINC000114339579 1412416182 /nfs/dbraw/zinc/41/61/82/1412416182.db2.gz AHOVKLBDPSWFFH-UHFFFAOYSA-N 0 0 396.428 3.201 20 5 GGBDRN O=C(NCCOc1cccnc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000114424097 1412431945 /nfs/dbraw/zinc/43/19/45/1412431945.db2.gz YPQOJXUPBPEEQC-UHFFFAOYSA-N 0 0 392.415 3.411 20 5 GGBDRN C[C@](O)(CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccc(F)cc1F ZINC000114451210 1412435729 /nfs/dbraw/zinc/43/57/29/1412435729.db2.gz RRGKMUZYKZQIPB-SFHVURJKSA-N 0 0 377.347 3.077 20 5 GGBDRN COc1cc(F)c([C@@H](C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC ZINC000114501279 1412447358 /nfs/dbraw/zinc/44/73/58/1412447358.db2.gz NZYWSEGBMFPFSQ-NEPJUHHUSA-N 0 0 391.399 3.429 20 5 GGBDRN COc1cc(F)c([C@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC ZINC000114501281 1412447462 /nfs/dbraw/zinc/44/74/62/1412447462.db2.gz NZYWSEGBMFPFSQ-NWDGAFQWSA-N 0 0 391.399 3.429 20 5 GGBDRN COc1cc(F)c([C@@H](C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC ZINC000114501282 1412447611 /nfs/dbraw/zinc/44/76/11/1412447611.db2.gz NZYWSEGBMFPFSQ-VXGBXAGGSA-N 0 0 391.399 3.429 20 5 GGBDRN Cc1noc(COc2ccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC000114502526 1412448012 /nfs/dbraw/zinc/44/80/12/1412448012.db2.gz AVUNWIAMJMMRGH-GFCCVEGCSA-N 0 0 397.391 3.304 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000114522747 1412451333 /nfs/dbraw/zinc/45/13/33/1412451333.db2.gz IVODGZYJNKZEQO-GFCCVEGCSA-N 0 0 391.399 3.354 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(CN3CCCCC3=O)c2)c(N)c([N+](=O)[O-])c1 ZINC000114538608 1412455410 /nfs/dbraw/zinc/45/54/10/1412455410.db2.gz XMIYXGJBNIIELZ-UHFFFAOYSA-N 0 0 382.420 3.250 20 5 GGBDRN C[C@](O)(CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000114547316 1412457513 /nfs/dbraw/zinc/45/75/13/1412457513.db2.gz HMATZJQMWZLOKG-IBGZPJMESA-N 0 0 383.429 3.356 20 5 GGBDRN CN(C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCc2ccccc2C1 ZINC000114609263 1412473896 /nfs/dbraw/zinc/47/38/96/1412473896.db2.gz FXVJOMOOHYKIFJ-CQSZACIVSA-N 0 0 387.823 3.203 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1cnc2cc(F)c(F)cc2c1=O ZINC000114633769 1412481620 /nfs/dbraw/zinc/48/16/20/1412481620.db2.gz HVKBETUXWNYNHL-UHFFFAOYSA-N 0 0 375.331 3.418 20 5 GGBDRN COC(=O)Cc1csc(N(C)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000114641493 1412483943 /nfs/dbraw/zinc/48/39/43/1412483943.db2.gz CHEGDFYGNSQWQX-UHFFFAOYSA-N 0 0 391.449 3.341 20 5 GGBDRN CCNc1ccc(C(=O)N[C@H](c2noc(C)n2)c2ccccc2F)cc1[N+](=O)[O-] ZINC000114651725 1412488973 /nfs/dbraw/zinc/48/89/73/1412488973.db2.gz WTDYNMXZDWDXNH-KRWDZBQOSA-N 0 0 399.382 3.377 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000114692968 1412500925 /nfs/dbraw/zinc/50/09/25/1412500925.db2.gz OYJDOEBCAFRHAI-SHQCLWGWSA-N 0 0 375.425 3.124 20 5 GGBDRN Cc1oc(C(N)=O)cc1-c1csc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000114701729 1412504723 /nfs/dbraw/zinc/50/47/23/1412504723.db2.gz WHQRNULHOXMEPZ-UHFFFAOYSA-N 0 0 386.389 3.279 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)Oc1ccccc1Br ZINC000177260975 1428659122 /nfs/dbraw/zinc/65/91/22/1428659122.db2.gz HNDZCMXREKIKSH-SNVBAGLBSA-N 0 0 394.225 3.137 20 5 GGBDRN COc1ccc([C@H]2CCCN2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC ZINC000114724646 1412511531 /nfs/dbraw/zinc/51/15/31/1412511531.db2.gz DJEZVJDXDWJFND-MRXNPFEDSA-N 0 0 385.420 3.048 20 5 GGBDRN CCOc1ccc(NC(=O)CN(C)Cc2ccccc2OCC)c([N+](=O)[O-])c1 ZINC000114725248 1412511919 /nfs/dbraw/zinc/51/19/19/1412511919.db2.gz KTGLETJJHIQSRG-UHFFFAOYSA-N 0 0 387.436 3.463 20 5 GGBDRN COc1ccc([C@@H]2CCCN2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC ZINC000114724644 1412512086 /nfs/dbraw/zinc/51/20/86/1412512086.db2.gz DJEZVJDXDWJFND-INIZCTEOSA-N 0 0 385.420 3.048 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1ccn(Cc2ccccc2)n1 ZINC000114753083 1412519652 /nfs/dbraw/zinc/51/96/52/1412519652.db2.gz VXCIVAOJQQDEOY-AWEZNQCLSA-N 0 0 395.419 3.287 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H](c2cc[nH]n2)C1 ZINC000114903103 1412545155 /nfs/dbraw/zinc/54/51/55/1412545155.db2.gz BNUDVPXIUADSOR-JTQLQIEISA-N 0 0 381.339 3.331 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)OCCc2cnn(C)c2)cc1[N+](=O)[O-])c1ccccn1 ZINC000114983075 1412560324 /nfs/dbraw/zinc/56/03/24/1412560324.db2.gz ZTCREWPPRACZQR-CQSZACIVSA-N 0 0 395.419 3.296 20 5 GGBDRN O=C(Cc1c[nH]c2ccc(F)cc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000115002505 1412563779 /nfs/dbraw/zinc/56/37/79/1412563779.db2.gz LQXOHFFBBXOEDV-UHFFFAOYSA-N 0 0 382.395 3.107 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)OCc3ccc([N+](=O)[O-])cc3)cc2)no1 ZINC000115003038 1412563816 /nfs/dbraw/zinc/56/38/16/1412563816.db2.gz PCGSDXISXITJQF-UHFFFAOYSA-N 0 0 383.360 3.476 20 5 GGBDRN COc1ccc([C@H]2[C@H](C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CCC(=O)N2C)cc1 ZINC000115008154 1412565690 /nfs/dbraw/zinc/56/56/90/1412565690.db2.gz NYLIBXANTBLCBO-XLIONFOSSA-N 0 0 397.431 3.460 20 5 GGBDRN COc1ccc([C@H]2[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CCC(=O)N2C)cc1 ZINC000115008280 1412565903 /nfs/dbraw/zinc/56/59/03/1412565903.db2.gz APBVTTBBPAACDD-JXFKEZNVSA-N 0 0 397.431 3.460 20 5 GGBDRN Cc1nc(-c2cnn(C)c2)sc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000115014957 1412568862 /nfs/dbraw/zinc/56/88/62/1412568862.db2.gz NUFREXXIEYUWJO-UHFFFAOYSA-N 0 0 379.348 3.291 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H](c1ccco1)N1CCCC1 ZINC000115057040 1412580170 /nfs/dbraw/zinc/58/01/70/1412580170.db2.gz YQIVZCWUZKTTEB-INIZCTEOSA-N 0 0 375.450 3.233 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H](c1ccco1)N1CCCC1 ZINC000115057039 1412580352 /nfs/dbraw/zinc/58/03/52/1412580352.db2.gz YQIVZCWUZKTTEB-MRXNPFEDSA-N 0 0 375.450 3.233 20 5 GGBDRN Cc1nn(CCC(=O)Oc2cccc(NC(=O)c3ccco3)c2)c(C)c1[N+](=O)[O-] ZINC000115079168 1412586160 /nfs/dbraw/zinc/58/61/60/1412586160.db2.gz IAJVJJZAHLFNRW-UHFFFAOYSA-N 0 0 398.375 3.249 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)cc1OC ZINC000115103057 1412587420 /nfs/dbraw/zinc/58/74/20/1412587420.db2.gz DXWTTZIYSNNTFR-OAHLLOKOSA-N 0 0 399.447 3.401 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2)C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000115107770 1412589564 /nfs/dbraw/zinc/58/95/64/1412589564.db2.gz ZEMCEICLLBYIKE-KRWDZBQOSA-N 0 0 391.431 3.179 20 5 GGBDRN COc1ccc(CCN(CC(C)(C)C)C(=O)Cn2cc([N+](=O)[O-])nc2C)cc1 ZINC000115125199 1412592536 /nfs/dbraw/zinc/59/25/36/1412592536.db2.gz JWUMYVZPAHYIEF-UHFFFAOYSA-N 0 0 388.468 3.226 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000115134921 1412594178 /nfs/dbraw/zinc/59/41/78/1412594178.db2.gz VDHPYKYATRXBJJ-WMLDXEAASA-N 0 0 377.404 3.194 20 5 GGBDRN C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000115134916 1412594270 /nfs/dbraw/zinc/59/42/70/1412594270.db2.gz VDHPYKYATRXBJJ-YOEHRIQHSA-N 0 0 377.404 3.194 20 5 GGBDRN C[C@H]1C[C@H](c2ccccc2)CN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000115144530 1412596543 /nfs/dbraw/zinc/59/65/43/1412596543.db2.gz GWIDRDIMGQOHDH-BBRMVZONSA-N 0 0 399.472 3.190 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1 ZINC000115148735 1412598392 /nfs/dbraw/zinc/59/83/92/1412598392.db2.gz SBBJPJRJPHYDCR-GOSISDBHSA-N 0 0 382.464 3.402 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)CC1CCC1 ZINC000115158772 1412600819 /nfs/dbraw/zinc/60/08/19/1412600819.db2.gz OJICHXAJZOLWMW-UHFFFAOYSA-N 0 0 381.432 3.154 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(CCC(F)(F)F)CC1CC1 ZINC000177269183 1428663756 /nfs/dbraw/zinc/66/37/56/1428663756.db2.gz ACUUYGZIAJHOOB-UHFFFAOYSA-N 0 0 375.347 3.477 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(OCC(=O)N(C)C)c(Cl)c1 ZINC000115232423 1412615772 /nfs/dbraw/zinc/61/57/72/1412615772.db2.gz SSVZXMMSBBSZNR-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCSC[C@H]1c1ccccc1 ZINC000115233756 1412616841 /nfs/dbraw/zinc/61/68/41/1412616841.db2.gz PFDGZTULDALCDT-SFHVURJKSA-N 0 0 395.444 3.106 20 5 GGBDRN CN(C[C@@H]1CCOC1)C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000177269836 1428663885 /nfs/dbraw/zinc/66/38/85/1428663885.db2.gz HONQOBYOXIRNCB-JTQLQIEISA-N 0 0 399.234 3.196 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115240051 1412618786 /nfs/dbraw/zinc/61/87/86/1412618786.db2.gz CNDFUDPZFMZQPA-UHFFFAOYSA-N 0 0 399.378 3.081 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cccc(C[S@@](=O)c3ccccc3)c2)c1[N+](=O)[O-] ZINC000115255862 1412622055 /nfs/dbraw/zinc/62/20/55/1412622055.db2.gz NNVHSKDPHRMTDP-NDEPHWFRSA-N 0 0 398.444 3.197 20 5 GGBDRN O=C(Nc1cccc(C[S@@](=O)C2CCOCC2)c1)c1ccc([N+](=O)[O-])s1 ZINC000115289600 1412635256 /nfs/dbraw/zinc/63/52/56/1412635256.db2.gz QOZLCQYJQIGNGW-SANMLTNESA-N 0 0 394.474 3.336 20 5 GGBDRN O=C(Nc1cccc(C[S@](=O)C2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000115290279 1412636777 /nfs/dbraw/zinc/63/67/77/1412636777.db2.gz DRXZYCGPRMJDQA-HHHXNRCGSA-N 0 0 388.445 3.275 20 5 GGBDRN O=C(Nc1cccc(C[S@@](=O)C2CCOCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000115290131 1412636901 /nfs/dbraw/zinc/63/69/01/1412636901.db2.gz KPBVLVXUDUIZCV-MHZLTWQESA-N 0 0 388.445 3.275 20 5 GGBDRN CC[C@H]1COCCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000115307276 1412643128 /nfs/dbraw/zinc/64/31/28/1412643128.db2.gz GYPQBNLYOADDQA-LBPRGKRZSA-N 0 0 375.347 3.053 20 5 GGBDRN COc1ccc(C(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000177273161 1428666211 /nfs/dbraw/zinc/66/62/11/1428666211.db2.gz BFSBWFIXWCKJRA-QDXKXIGTSA-N 0 0 376.434 3.174 20 5 GGBDRN Cc1ccc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)cc1F ZINC000115358056 1412657721 /nfs/dbraw/zinc/65/77/21/1412657721.db2.gz YBLRSUSEIHFTJU-UHFFFAOYSA-N 0 0 393.440 3.439 20 5 GGBDRN O=C(NCCOC[C@@H]1CCCO1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000115431879 1412674619 /nfs/dbraw/zinc/67/46/19/1412674619.db2.gz DAQPPYZXQQRXKK-SFHVURJKSA-N 0 0 399.447 3.132 20 5 GGBDRN CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCCN(c2ccccc2)C1 ZINC000115457517 1412682485 /nfs/dbraw/zinc/68/24/85/1412682485.db2.gz AZEZXQHCGFGAGK-INIZCTEOSA-N 0 0 379.420 3.212 20 5 GGBDRN CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCCN(c2ccccc2)C1 ZINC000115457514 1412682617 /nfs/dbraw/zinc/68/26/17/1412682617.db2.gz AZEZXQHCGFGAGK-MRXNPFEDSA-N 0 0 379.420 3.212 20 5 GGBDRN C[S@](=O)Cc1cccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000115482277 1412687876 /nfs/dbraw/zinc/68/78/76/1412687876.db2.gz CKIJPFKDPXZYSI-AREMUKBSSA-N 0 0 375.450 3.304 20 5 GGBDRN C[S@@](=O)Cc1cccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000115482275 1412688133 /nfs/dbraw/zinc/68/81/33/1412688133.db2.gz CKIJPFKDPXZYSI-SANMLTNESA-N 0 0 375.450 3.304 20 5 GGBDRN C[S@](=O)Cc1cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)ccc1Cl ZINC000115485239 1412688799 /nfs/dbraw/zinc/68/87/99/1412688799.db2.gz CDKBAMHKOXOHDJ-AREMUKBSSA-N 0 0 392.824 3.255 20 5 GGBDRN C[S@@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 ZINC000115482702 1412689228 /nfs/dbraw/zinc/68/92/28/1412689228.db2.gz QYORDXNTKDNOSK-MHZLTWQESA-N 0 0 387.461 3.326 20 5 GGBDRN NC(=O)C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000177282492 1428669423 /nfs/dbraw/zinc/66/94/23/1428669423.db2.gz LSWPQCJAABNHFK-CYBMUJFWSA-N 0 0 387.358 3.168 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(S(=O)(=O)C(F)F)cc1 ZINC000115521711 1412701744 /nfs/dbraw/zinc/70/17/44/1412701744.db2.gz NAIZFVGIEIIDHM-UHFFFAOYSA-N 0 0 392.286 3.122 20 5 GGBDRN COc1cc(NCc2ccc([N+](=O)[O-])cc2)ccc1S(=O)(=O)N1CCCC1 ZINC000115529325 1412702912 /nfs/dbraw/zinc/70/29/12/1412702912.db2.gz FHQHDBBDFNDHKD-UHFFFAOYSA-N 0 0 391.449 3.000 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000115587285 1412720740 /nfs/dbraw/zinc/72/07/40/1412720740.db2.gz HJVKXLDVCWSSBG-UKRRQHHQSA-N 0 0 376.434 3.170 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000115587284 1412721149 /nfs/dbraw/zinc/72/11/49/1412721149.db2.gz HJVKXLDVCWSSBG-ZFWWWQNUSA-N 0 0 376.434 3.170 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)[C@H]2CCCN(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000115588112 1412722055 /nfs/dbraw/zinc/72/20/55/1412722055.db2.gz TZGDYNXDKGUMMY-KRWDZBQOSA-N 0 0 389.477 3.193 20 5 GGBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000115588109 1412722610 /nfs/dbraw/zinc/72/26/10/1412722610.db2.gz TZGDYNXDKGUMMY-QGZVFWFLSA-N 0 0 389.477 3.193 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CC2CC2)CC2CC2)cc1Br ZINC000115591333 1412723791 /nfs/dbraw/zinc/72/37/91/1412723791.db2.gz KFOBLPVSKXETTE-UHFFFAOYSA-N 0 0 389.271 3.168 20 5 GGBDRN COc1cc(Cn2nc(C(C)(C)C)ccc2=O)c([N+](=O)[O-])cc1OC(F)F ZINC000177289465 1428673702 /nfs/dbraw/zinc/67/37/02/1428673702.db2.gz UUEMUUWXJYPJQW-UHFFFAOYSA-N 0 0 383.351 3.107 20 5 GGBDRN O=C(CCc1ccccc1)N1CCCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000177291088 1428673925 /nfs/dbraw/zinc/67/39/25/1428673925.db2.gz LCQVWIZRJNGNBG-UHFFFAOYSA-N 0 0 385.439 3.401 20 5 GGBDRN COc1cc(C(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000177292316 1428674488 /nfs/dbraw/zinc/67/44/88/1428674488.db2.gz JTKGLDJHJLFOLA-RYZVSIALSA-N 0 0 376.434 3.174 20 5 GGBDRN CN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1 ZINC000115807723 1412794934 /nfs/dbraw/zinc/79/49/34/1412794934.db2.gz WRPWBCLKPVTCSX-FQEVSTJZSA-N 0 0 382.464 3.448 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1ccc(-n2ccnc2)c(F)c1 ZINC000115826962 1412800053 /nfs/dbraw/zinc/80/00/53/1412800053.db2.gz LVAHTNSXMPUKFQ-UHFFFAOYSA-N 0 0 384.367 3.005 20 5 GGBDRN CCOc1cc2c(cc1CNC(=O)c1cc(OC)ccc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000115858648 1412803282 /nfs/dbraw/zinc/80/32/82/1412803282.db2.gz UKGCBSBQSLSVMW-LBPRGKRZSA-N 0 0 386.404 3.256 20 5 GGBDRN Cc1cccnc1[C@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000115878609 1412807284 /nfs/dbraw/zinc/80/72/84/1412807284.db2.gz DHCUSWSNUXCLLQ-OAHLLOKOSA-N 0 0 390.827 3.404 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)O[C@H](c1ccc(Br)cc1)C1CC1 ZINC000115922295 1412815504 /nfs/dbraw/zinc/81/55/04/1412815504.db2.gz JEHSADHSUCRZOB-HNNXBMFYSA-N 0 0 380.198 3.248 20 5 GGBDRN CCc1ccc(OC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000115926054 1412816212 /nfs/dbraw/zinc/81/62/12/1412816212.db2.gz DYNBDWLYZRPZKX-KRWDZBQOSA-N 0 0 382.416 3.296 20 5 GGBDRN CC[C@H](C)C[C@@H](C)NS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000115928528 1412816605 /nfs/dbraw/zinc/81/66/05/1412816605.db2.gz IAPPGQZNMFUSEV-VHSXEESVSA-N 0 0 379.276 3.460 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nc(-c2ccc3c(c2)CCO3)cs1 ZINC000115956163 1412817923 /nfs/dbraw/zinc/81/79/23/1412817923.db2.gz DBIDFFRUMHQIBG-UHFFFAOYSA-N 0 0 399.432 3.187 20 5 GGBDRN O=C1N[C@@]2(CCc3ccccc3C2)C(=O)N1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000115963036 1412818142 /nfs/dbraw/zinc/81/81/42/1412818142.db2.gz ICQGNJRXRYRAAY-LJQANCHMSA-N 0 0 385.807 3.228 20 5 GGBDRN Nn1c(COc2ccccc2)nnc1SCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000115964874 1412818155 /nfs/dbraw/zinc/81/81/55/1412818155.db2.gz OGPYEHYATBLIQM-UHFFFAOYSA-N 0 0 391.840 3.425 20 5 GGBDRN C[C@@]1(c2cc(F)ccc2F)NC(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115964649 1412818174 /nfs/dbraw/zinc/81/81/74/1412818174.db2.gz MXZPKDFKIKSXQC-KRWDZBQOSA-N 0 0 395.749 3.494 20 5 GGBDRN COc1ccc([C@]2(C)NC(=O)N(Cc3ccc(Cl)cc3[N+](=O)[O-])C2=O)cc1 ZINC000115963027 1412818267 /nfs/dbraw/zinc/81/82/67/1412818267.db2.gz MUOHKGMULNCAGV-SFHVURJKSA-N 0 0 389.795 3.224 20 5 GGBDRN O=C1C(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C(=O)N1CCC1=CCCCC1 ZINC000115964713 1412818317 /nfs/dbraw/zinc/81/83/17/1412818317.db2.gz LIYQOWQVJVBRNJ-UHFFFAOYSA-N 0 0 391.811 3.430 20 5 GGBDRN C[C@]1(c2ccc(F)cc2)NC(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115965037 1412818513 /nfs/dbraw/zinc/81/85/13/1412818513.db2.gz HIYPIPZGYOAWHT-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@]1(c2ccc(F)cc2F)NC(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115965677 1412818574 /nfs/dbraw/zinc/81/85/74/1412818574.db2.gz FTZQAQXJBJBZSX-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN C[C@@]1(c2ccccc2F)NC(=O)N(Cc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000115965902 1412818624 /nfs/dbraw/zinc/81/86/24/1412818624.db2.gz VQKQGXOTHXPCTE-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN Cc1cc([C@]2(C)NC(=O)N(Cc3ccc(Cl)cc3[N+](=O)[O-])C2=O)c(C)o1 ZINC000115966028 1412818671 /nfs/dbraw/zinc/81/86/71/1412818671.db2.gz FTUPQVUSKBXDRM-KRWDZBQOSA-N 0 0 377.784 3.425 20 5 GGBDRN Cc1coc(-c2cccc(NC(=O)C(=O)N(C)Cc3ccccc3[N+](=O)[O-])c2)n1 ZINC000177301180 1428678184 /nfs/dbraw/zinc/67/81/84/1428678184.db2.gz VXRPCSHRSGORGF-UHFFFAOYSA-N 0 0 394.387 3.155 20 5 GGBDRN Cc1[nH]c2c(cc(C)cc2CNC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1C ZINC000115980502 1412819475 /nfs/dbraw/zinc/81/94/75/1412819475.db2.gz QTYOSKXRACDBJH-UHFFFAOYSA-N 0 0 394.431 3.048 20 5 GGBDRN CCNC(=O)c1ccc(OC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000116035748 1412823942 /nfs/dbraw/zinc/82/39/42/1412823942.db2.gz BJENJKXFXYXHTP-UHFFFAOYSA-N 0 0 393.193 3.326 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1ccco1)c1ccc(F)cc1F ZINC000116046560 1412824601 /nfs/dbraw/zinc/82/46/01/1412824601.db2.gz GYIAQWXEQBPACV-UHFFFAOYSA-N 0 0 376.319 3.204 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccccc1CN1CCc2ccccc21 ZINC000116046485 1412824743 /nfs/dbraw/zinc/82/47/43/1412824743.db2.gz HIQXYLCAOBUNBZ-UHFFFAOYSA-N 0 0 391.431 3.301 20 5 GGBDRN O=C(CCS(=O)(=O)C1CCCC1)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116062076 1412826478 /nfs/dbraw/zinc/82/64/78/1412826478.db2.gz MWWRAZVKBCRWHW-UHFFFAOYSA-N 0 0 375.830 3.039 20 5 GGBDRN O=C(OCc1cc([N+](=O)[O-])ccc1Cl)C1CCN(C(=O)N2CCCC2)CC1 ZINC000116061736 1412826504 /nfs/dbraw/zinc/82/65/04/1412826504.db2.gz OHNINTPXKCJXDD-UHFFFAOYSA-N 0 0 395.843 3.219 20 5 GGBDRN CCS(=O)(=O)c1ccccc1C(=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116062153 1412826509 /nfs/dbraw/zinc/82/65/09/1412826509.db2.gz WQLHANJAXGGTIA-UHFFFAOYSA-N 0 0 383.809 3.399 20 5 GGBDRN Cc1cccc([C@@H](CC(=O)OCc2cc([N+](=O)[O-])ccc2Cl)NC(N)=O)c1 ZINC000116062333 1412826521 /nfs/dbraw/zinc/82/65/21/1412826521.db2.gz FAIMSZWCWXBWKV-MRXNPFEDSA-N 0 0 391.811 3.400 20 5 GGBDRN Cc1ccccc1[C@H](CC(=O)OCc1cc([N+](=O)[O-])ccc1Cl)NC(N)=O ZINC000116062576 1412826618 /nfs/dbraw/zinc/82/66/18/1412826618.db2.gz ZTKYTGKNTCQFMY-INIZCTEOSA-N 0 0 391.811 3.400 20 5 GGBDRN CCN(CC)C(=O)N1CCC(C(=O)OCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000116062104 1412826649 /nfs/dbraw/zinc/82/66/49/1412826649.db2.gz VSYNXXHZPSEKHL-UHFFFAOYSA-N 0 0 397.859 3.465 20 5 GGBDRN O=C(Cn1nc(-c2ccccc2)ccc1=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116062733 1412826960 /nfs/dbraw/zinc/82/69/60/1412826960.db2.gz JJWZTXZSXBIJNU-UHFFFAOYSA-N 0 0 399.790 3.215 20 5 GGBDRN Cn1cc(C(=O)N2CCc3ccccc3CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000116071492 1412828029 /nfs/dbraw/zinc/82/80/29/1412828029.db2.gz RIHLMGSDNCSLNE-UHFFFAOYSA-N 0 0 376.416 3.236 20 5 GGBDRN CCc1cc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n(C)n1 ZINC000116082311 1412828943 /nfs/dbraw/zinc/82/89/43/1412828943.db2.gz RDTHQVDINAEBRV-UHFFFAOYSA-N 0 0 385.346 3.350 20 5 GGBDRN CC(C)(C)Oc1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000177303301 1428679158 /nfs/dbraw/zinc/67/91/58/1428679158.db2.gz IQKOWWSWZDLXAF-HNNXBMFYSA-N 0 0 384.436 3.494 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000116086159 1412829424 /nfs/dbraw/zinc/82/94/24/1412829424.db2.gz ZPGGNZKPEMNQKD-UHFFFAOYSA-N 0 0 395.246 3.255 20 5 GGBDRN COc1ccccc1C(C)(C)CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000116087987 1412830292 /nfs/dbraw/zinc/83/02/92/1412830292.db2.gz XZTLAUHDHTXQFH-UHFFFAOYSA-N 0 0 394.431 3.497 20 5 GGBDRN CC(C)(C)[C@@H]1CCCN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1 ZINC000116090739 1412830691 /nfs/dbraw/zinc/83/06/91/1412830691.db2.gz JPSWEEHWYLHKGG-CYBMUJFWSA-N 0 0 375.425 3.178 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 ZINC000116094559 1412831180 /nfs/dbraw/zinc/83/11/80/1412831180.db2.gz ACHQLEAFDQSBGX-AWEZNQCLSA-N 0 0 383.379 3.214 20 5 GGBDRN O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1ccc([N+](=O)[O-])cc1F ZINC000116094723 1412831265 /nfs/dbraw/zinc/83/12/65/1412831265.db2.gz UZSCQCFHFPWNOE-UHFFFAOYSA-N 0 0 389.427 3.395 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)c([N+](=O)[O-])cc1OC ZINC000116097801 1412831588 /nfs/dbraw/zinc/83/15/88/1412831588.db2.gz WYEHSCUTTKKBOB-TVQRCGJNSA-N 0 0 378.331 3.176 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@H](C)Cc2nc3ccccc3s2)cc([N+](=O)[O-])c1 ZINC000116102291 1412832337 /nfs/dbraw/zinc/83/23/37/1412832337.db2.gz LSJOVKXGUPSXEQ-LLVKDONJSA-N 0 0 399.428 3.352 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN(c2cccc(F)c2)C1 ZINC000116107624 1412832732 /nfs/dbraw/zinc/83/27/32/1412832732.db2.gz XISSVMDDTWPASP-MRXNPFEDSA-N 0 0 387.411 3.288 20 5 GGBDRN O=C(NC1(c2nccs2)CCCC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000116105256 1412832750 /nfs/dbraw/zinc/83/27/50/1412832750.db2.gz XCWVIFYTLKLTDV-UHFFFAOYSA-N 0 0 383.433 3.436 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CCCN(c2cccc(F)c2)C1 ZINC000116107626 1412832839 /nfs/dbraw/zinc/83/28/39/1412832839.db2.gz XISSVMDDTWPASP-INIZCTEOSA-N 0 0 387.411 3.288 20 5 GGBDRN Cc1nn(CCC(=O)N2CCSC[C@@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000116133922 1412835055 /nfs/dbraw/zinc/83/50/55/1412835055.db2.gz SBKJKRKRNYWILS-QGZVFWFLSA-N 0 0 388.493 3.423 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NCCCOc1ccccc1F ZINC000116144394 1412836169 /nfs/dbraw/zinc/83/61/69/1412836169.db2.gz GLDZLGBATUGVNF-UHFFFAOYSA-N 0 0 393.327 3.310 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000177304979 1428680208 /nfs/dbraw/zinc/68/02/08/1428680208.db2.gz YJDAMYLGGZDHJZ-RNUGCUGFSA-N 0 0 391.405 3.074 20 5 GGBDRN CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000116203730 1412841818 /nfs/dbraw/zinc/84/18/18/1412841818.db2.gz NCGIWFYGTQZOKP-AREMUKBSSA-N 0 0 375.450 3.477 20 5 GGBDRN CCOC(=O)CN(CC(F)(F)F)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000116232364 1412845542 /nfs/dbraw/zinc/84/55/42/1412845542.db2.gz DMTSLEJURMZGDN-UHFFFAOYSA-N 0 0 390.339 3.377 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1 ZINC000116264438 1412846637 /nfs/dbraw/zinc/84/66/37/1412846637.db2.gz SHJXUESEEIOZKM-LJQANCHMSA-N 0 0 385.420 3.412 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000116264496 1412846807 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WVMLDWLLUDHGJZ-WFASDCNBSA-N 0 0 377.347 3.237 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000177309771 1428681824 /nfs/dbraw/zinc/68/18/24/1428681824.db2.gz KKDDLCKBULQFLV-RNUGCUGFSA-N 0 0 386.433 3.042 20 5 GGBDRN Cc1nn(CCC(=O)N(Cc2ccco2)Cc2ccc(O)cc2)c(C)c1[N+](=O)[O-] ZINC000116444755 1412861204 /nfs/dbraw/zinc/86/12/04/1412861204.db2.gz LXZARICAILUSOF-UHFFFAOYSA-N 0 0 398.419 3.326 20 5 GGBDRN O=C(CCc1cccc(F)c1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000116453151 1412862423 /nfs/dbraw/zinc/86/24/23/1412862423.db2.gz XDQUDVFTWXMTDY-UHFFFAOYSA-N 0 0 375.375 3.154 20 5 GGBDRN CC(C)(C)c1ccc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 ZINC000116456330 1412862817 /nfs/dbraw/zinc/86/28/17/1412862817.db2.gz PHHVYQSCPNVVLY-KRWDZBQOSA-N 0 0 387.392 3.264 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000116462363 1412864265 /nfs/dbraw/zinc/86/42/65/1412864265.db2.gz MOENINZFJLZMJE-QGZVFWFLSA-N 0 0 378.812 3.499 20 5 GGBDRN CCN(Cc1c(F)cccc1F)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000116561437 1412877169 /nfs/dbraw/zinc/87/71/69/1412877169.db2.gz YPOFHBWBRGKPSR-UHFFFAOYSA-N 0 0 378.331 3.307 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000116583760 1412882358 /nfs/dbraw/zinc/88/23/58/1412882358.db2.gz GOAVFKMBAIQFKE-ZANVPECISA-N 0 0 395.749 3.137 20 5 GGBDRN CN(C)[C@H](CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000116619279 1412887612 /nfs/dbraw/zinc/88/76/12/1412887612.db2.gz ZDNIGAFBRKOZDH-CQSZACIVSA-N 0 0 381.816 3.029 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000116619541 1412887752 /nfs/dbraw/zinc/88/77/52/1412887752.db2.gz MUSFCFOPRXPFHZ-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCc1cn2ccccc2n1 ZINC000116623932 1412888337 /nfs/dbraw/zinc/88/83/37/1412888337.db2.gz QVDTYVYQEOHLTJ-UHFFFAOYSA-N 0 0 388.811 3.024 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H]1Cc2ccccc2O1 ZINC000116626917 1412888623 /nfs/dbraw/zinc/88/86/23/1412888623.db2.gz HKAVXOSPEFXBTK-AWEZNQCLSA-N 0 0 376.796 3.137 20 5 GGBDRN CCOc1ncccc1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116624891 1412888737 /nfs/dbraw/zinc/88/87/37/1412888737.db2.gz JOKPLVRFBZFCNX-UHFFFAOYSA-N 0 0 379.800 3.127 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000116628181 1412888838 /nfs/dbraw/zinc/88/88/38/1412888838.db2.gz UWTWIOUIXOJEBC-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCc1ccc([N+](=O)[O-])cc1 ZINC000116633055 1412889151 /nfs/dbraw/zinc/88/91/51/1412889151.db2.gz QCRCJOSPKCVXTG-UHFFFAOYSA-N 0 0 393.783 3.284 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(N2CCOCC2)cc1 ZINC000116637446 1412889971 /nfs/dbraw/zinc/88/99/71/1412889971.db2.gz MBWBMHDYDZXQQX-UHFFFAOYSA-N 0 0 393.403 3.074 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(-n2ccnn2)cc1 ZINC000116638344 1412890091 /nfs/dbraw/zinc/89/00/91/1412890091.db2.gz DYQWYRJMHCTHTM-UHFFFAOYSA-N 0 0 387.783 3.237 20 5 GGBDRN Cn1c(=O)oc2ccc(NC(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])cc21 ZINC000116637984 1412890118 /nfs/dbraw/zinc/89/01/18/1412890118.db2.gz BLNMUMVAPSACRY-UHFFFAOYSA-N 0 0 391.767 3.101 20 5 GGBDRN COC(=O)c1[nH]c(C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000116641326 1412890381 /nfs/dbraw/zinc/89/03/81/1412890381.db2.gz UDIKAJPAVVMRAY-UHFFFAOYSA-N 0 0 382.170 3.033 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)c(C)c1[N+](=O)[O-] ZINC000116651696 1412891489 /nfs/dbraw/zinc/89/14/89/1412891489.db2.gz OSUQSKQQBYBZOU-UHFFFAOYSA-N 0 0 397.391 3.282 20 5 GGBDRN Cc1nn(CCC(=O)NCCSCc2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000116651357 1412891626 /nfs/dbraw/zinc/89/16/26/1412891626.db2.gz IFMXLUJBFCILTG-UHFFFAOYSA-N 0 0 376.482 3.156 20 5 GGBDRN CC(C)c1ccc(CCCNC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000116657634 1412892363 /nfs/dbraw/zinc/89/23/63/1412892363.db2.gz QJZIZDLXKCQGQI-UHFFFAOYSA-N 0 0 397.431 3.375 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000116659571 1412893378 /nfs/dbraw/zinc/89/33/78/1412893378.db2.gz GKJQPJDEGJXTOJ-CQSZACIVSA-N 0 0 391.374 3.134 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000116660000 1412893631 /nfs/dbraw/zinc/89/36/31/1412893631.db2.gz WJHCEQQGJWAOFH-CQSZACIVSA-N 0 0 391.374 3.134 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000116665462 1412894577 /nfs/dbraw/zinc/89/45/77/1412894577.db2.gz WGUJXMRPFDEZQZ-UHFFFAOYSA-N 0 0 385.420 3.369 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000116679924 1412895961 /nfs/dbraw/zinc/89/59/61/1412895961.db2.gz SGQYXLPGPGOZRQ-SANMLTNESA-N 0 0 376.434 3.051 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000116680615 1412895972 /nfs/dbraw/zinc/89/59/72/1412895972.db2.gz JGXYUPFGDNWKTH-AREMUKBSSA-N 0 0 396.852 3.396 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000116682027 1412896242 /nfs/dbraw/zinc/89/62/42/1412896242.db2.gz ZDZWMTGYHBLJCI-AREMUKBSSA-N 0 0 396.852 3.396 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000116682025 1412896327 /nfs/dbraw/zinc/89/63/27/1412896327.db2.gz ZDZWMTGYHBLJCI-SANMLTNESA-N 0 0 396.852 3.396 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000116681411 1412896375 /nfs/dbraw/zinc/89/63/75/1412896375.db2.gz MSXBAANLCRMEIV-SANMLTNESA-N 0 0 376.434 3.051 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000116682199 1412896662 /nfs/dbraw/zinc/89/66/62/1412896662.db2.gz XDHQYKUJSQIJCX-SANMLTNESA-N 0 0 376.434 3.051 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000116682838 1412896731 /nfs/dbraw/zinc/89/67/31/1412896731.db2.gz DRKGYZUAZQUHQZ-AREMUKBSSA-N 0 0 376.434 3.051 20 5 GGBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000116693325 1412898128 /nfs/dbraw/zinc/89/81/28/1412898128.db2.gz LZCVIGDMQXBBLF-SANMLTNESA-N 0 0 375.450 3.100 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)o1 ZINC000116702142 1412899130 /nfs/dbraw/zinc/89/91/30/1412899130.db2.gz NTHAHCVVNNTUSW-LJQANCHMSA-N 0 0 399.447 3.313 20 5 GGBDRN Cc1ccc([C@H](NC(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)cc1 ZINC000116705454 1412899617 /nfs/dbraw/zinc/89/96/17/1412899617.db2.gz WSDPJKUXJKLRFA-FQEVSTJZSA-N 0 0 391.431 3.429 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)o1 ZINC000116709233 1412899721 /nfs/dbraw/zinc/89/97/21/1412899721.db2.gz UAEDRCCTXZANOZ-CQSZACIVSA-N 0 0 395.209 3.472 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC[C@H]1Cc1ccccc1 ZINC000116713398 1412902572 /nfs/dbraw/zinc/90/25/72/1412902572.db2.gz IKXSGEWQBVRHIC-LPHOPBHVSA-N 0 0 395.459 3.337 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC[C@H]1Cc1ccccc1 ZINC000116713401 1412903086 /nfs/dbraw/zinc/90/30/86/1412903086.db2.gz IKXSGEWQBVRHIC-APWZRJJASA-N 0 0 395.459 3.337 20 5 GGBDRN 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O=C(Nc1nncn1Cc1ccccc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000117736899 1413073821 /nfs/dbraw/zinc/07/38/21/1413073821.db2.gz SEUSXJFJMVREBE-UHFFFAOYSA-N 0 0 378.392 3.061 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000117749828 1413075005 /nfs/dbraw/zinc/07/50/05/1413075005.db2.gz URYGDCCUTNHNKD-AWEZNQCLSA-N 0 0 399.838 3.240 20 5 GGBDRN COC(=O)c1n[nH]c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)cc21 ZINC000117751837 1413075152 /nfs/dbraw/zinc/07/51/52/1413075152.db2.gz PGPSGOHEJJTZCY-UHFFFAOYSA-N 0 0 388.767 3.092 20 5 GGBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(NC(N)=O)cc1 ZINC000117755998 1413075782 /nfs/dbraw/zinc/07/57/82/1413075782.db2.gz HPNOXRGQLNUMMY-JTQLQIEISA-N 0 0 376.800 3.159 20 5 GGBDRN CCC(CC)[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)N1CCOCC1 ZINC000117754045 1413076052 /nfs/dbraw/zinc/07/60/52/1413076052.db2.gz UEQZGOASQZTVHX-GOSISDBHSA-N 0 0 397.903 3.044 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000117766620 1413076712 /nfs/dbraw/zinc/07/67/12/1413076712.db2.gz JGHCAGDYIUBJOQ-DZGCQCFKSA-N 0 0 395.887 3.334 20 5 GGBDRN CCO[C@H](CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000177342275 1428699348 /nfs/dbraw/zinc/69/93/48/1428699348.db2.gz IIUBDHVYWZIPCV-GOSISDBHSA-N 0 0 387.436 3.152 20 5 GGBDRN Cc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1NS(C)(=O)=O ZINC000117767854 1413077103 /nfs/dbraw/zinc/07/71/03/1413077103.db2.gz RESQQYYNKAJGEZ-UHFFFAOYSA-N 0 0 397.840 3.109 20 5 GGBDRN CC(C)(C)OC(=O)NCC(C)(C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117788252 1413078911 /nfs/dbraw/zinc/07/89/11/1413078911.db2.gz PSOVFZBQSIKNGW-UHFFFAOYSA-N 0 0 385.848 3.210 20 5 GGBDRN Cn1c(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)nc2c1cccc2F ZINC000117797199 1413079600 /nfs/dbraw/zinc/07/96/00/1413079600.db2.gz ANJBACQLMMMGJD-UHFFFAOYSA-N 0 0 390.802 3.175 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000117806324 1413081160 /nfs/dbraw/zinc/08/11/60/1413081160.db2.gz MJRCGYPCANRFGF-ZDUSSCGKSA-N 0 0 397.859 3.306 20 5 GGBDRN CN(C)c1cccc([C@@H]2CCCN2CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 ZINC000117864697 1413084615 /nfs/dbraw/zinc/08/46/15/1413084615.db2.gz QRJVNENCGZDORH-KRWDZBQOSA-N 0 0 394.431 3.051 20 5 GGBDRN CN(C)c1cccc([C@@H]2CCCN2Cn2c3cc([N+](=O)[O-])ccc3oc2=O)c1 ZINC000117864628 1413084726 /nfs/dbraw/zinc/08/47/26/1413084726.db2.gz SJPGASBAJSOIFQ-KRWDZBQOSA-N 0 0 382.420 3.363 20 5 GGBDRN CN(C)c1cccc([C@H]2CCCN2CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 ZINC000117864699 1413085035 /nfs/dbraw/zinc/08/50/35/1413085035.db2.gz QRJVNENCGZDORH-QGZVFWFLSA-N 0 0 394.431 3.051 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000117892851 1413087974 /nfs/dbraw/zinc/08/79/74/1413087974.db2.gz FAIROTNLPBYFBX-LJQANCHMSA-N 0 0 399.447 3.394 20 5 GGBDRN CN(C)c1cccc([C@H]2CCCN2S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000117929149 1413089549 /nfs/dbraw/zinc/08/95/49/1413089549.db2.gz XYASQQUNYFZORQ-MRXNPFEDSA-N 0 0 393.440 3.326 20 5 GGBDRN CN(C)c1cccc([C@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000117929295 1413090267 /nfs/dbraw/zinc/09/02/67/1413090267.db2.gz XHCKPTPZYCNACY-GOSISDBHSA-N 0 0 375.450 3.187 20 5 GGBDRN CC(C)N1C(=S)N=NC1C1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000117951974 1413091892 /nfs/dbraw/zinc/09/18/92/1413091892.db2.gz FBTTUZVLMYMCNH-UHFFFAOYSA-N 0 0 390.469 3.467 20 5 GGBDRN O=C(NCCCO)NCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1 ZINC000118090479 1413106429 /nfs/dbraw/zinc/10/64/29/1413106429.db2.gz UZPSVMCXHLJSNP-UHFFFAOYSA-N 0 0 397.790 3.361 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCC[C@H]2c2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000118135646 1413116369 /nfs/dbraw/zinc/11/63/69/1413116369.db2.gz HZVKADRDCWBZGE-SFHVURJKSA-N 0 0 396.447 3.271 20 5 GGBDRN Nc1ccc(C(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1[N+](=O)[O-] ZINC000118158237 1413116869 /nfs/dbraw/zinc/11/68/69/1413116869.db2.gz ZRRUBJYXFOWGLV-UHFFFAOYSA-N 0 0 384.304 3.097 20 5 GGBDRN O=C(OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(-n2cnnc2)cc1 ZINC000118158151 1413117081 /nfs/dbraw/zinc/11/70/81/1413117081.db2.gz IATCMDYQTJQPEJ-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN O=C(Cc1noc(Cc2ccc([N+](=O)[O-])cc2Cl)n1)NC1CCCCC1 ZINC000118165256 1413118225 /nfs/dbraw/zinc/11/82/25/1413118225.db2.gz JPDYCMVXPWQWPW-UHFFFAOYSA-N 0 0 378.816 3.213 20 5 GGBDRN Cc1c(C(=O)Nc2cnn(CC(F)(F)F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000118236393 1413132082 /nfs/dbraw/zinc/13/20/82/1413132082.db2.gz SZXADLUJEGWZRU-UHFFFAOYSA-N 0 0 387.274 3.131 20 5 GGBDRN O=C(Nc1cnn(CC(F)(F)F)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000118236191 1413132340 /nfs/dbraw/zinc/13/23/40/1413132340.db2.gz QAOUDKBDXQAPJX-UHFFFAOYSA-N 0 0 397.357 3.209 20 5 GGBDRN Cc1c(C(=O)NCC(C)(C)c2cccc(F)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000118250807 1413135952 /nfs/dbraw/zinc/13/59/52/1413135952.db2.gz UHKICNAIYOXGHE-UHFFFAOYSA-N 0 0 397.410 3.331 20 5 GGBDRN COc1cc(C(=O)NCC(C)(C)c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000118251936 1413137047 /nfs/dbraw/zinc/13/70/47/1413137047.db2.gz VMEBMCZDSZRAPM-UHFFFAOYSA-N 0 0 376.384 3.459 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000118268979 1413138216 /nfs/dbraw/zinc/13/82/16/1413138216.db2.gz HLKLVSFPOXCVAT-WBMJQRKESA-N 0 0 379.413 3.383 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000118268984 1413138292 /nfs/dbraw/zinc/13/82/92/1413138292.db2.gz HLKLVSFPOXCVAT-MLGOLLRUSA-N 0 0 379.413 3.383 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000118276182 1413140880 /nfs/dbraw/zinc/14/08/80/1413140880.db2.gz IGLZKZZRMFKGBA-KSSFIOAISA-N 0 0 386.452 3.352 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3CCS[C@H](C)[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000118282316 1413142478 /nfs/dbraw/zinc/14/24/78/1413142478.db2.gz VAZQXXOMVPWFPS-DZGCQCFKSA-N 0 0 388.493 3.422 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3CCS[C@H](C)[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000118282320 1413142596 /nfs/dbraw/zinc/14/25/96/1413142596.db2.gz VAZQXXOMVPWFPS-UKRRQHHQSA-N 0 0 388.493 3.422 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3CCS[C@@H](C)[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000118282318 1413142615 /nfs/dbraw/zinc/14/26/15/1413142615.db2.gz VAZQXXOMVPWFPS-ZFWWWQNUSA-N 0 0 388.493 3.422 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3CCS[C@@H](C)[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000118282322 1413142771 /nfs/dbraw/zinc/14/27/71/1413142771.db2.gz VAZQXXOMVPWFPS-HIFRSBDPSA-N 0 0 388.493 3.422 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1ccc(C)c(S(C)(=O)=O)c1 ZINC000118296042 1413144615 /nfs/dbraw/zinc/14/46/15/1413144615.db2.gz MCYWZGKUXCOWJA-UHFFFAOYSA-N 0 0 383.809 3.488 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)CCc1c(C)nc2ncnn2c1C ZINC000118295810 1413144664 /nfs/dbraw/zinc/14/46/64/1413144664.db2.gz UVWQQIQHUKTBGI-UHFFFAOYSA-N 0 0 389.799 3.149 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)Cn1cccc(C(F)(F)F)c1=O ZINC000118296221 1413144743 /nfs/dbraw/zinc/14/47/43/1413144743.db2.gz FNNRAXPQCZMFGW-UHFFFAOYSA-N 0 0 390.701 3.343 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1ccc(CS(C)(=O)=O)cc1 ZINC000118296439 1413144778 /nfs/dbraw/zinc/14/47/78/1413144778.db2.gz DRYSWMCYOWHQRZ-UHFFFAOYSA-N 0 0 383.809 3.320 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000118366348 1413156242 /nfs/dbraw/zinc/15/62/42/1413156242.db2.gz TVPLTQZKOPTNAK-KPZWWZAWSA-N 0 0 387.436 3.007 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000118441519 1413161229 /nfs/dbraw/zinc/16/12/29/1413161229.db2.gz FZIGCAHLVMOSBN-UHFFFAOYSA-N 0 0 390.732 3.372 20 5 GGBDRN COc1ccc(-c2csc(CNC(=O)Cn3cc([N+](=O)[O-])nc3C)c2)cc1 ZINC000177366339 1428705896 /nfs/dbraw/zinc/70/58/96/1428705896.db2.gz OYISAEXBKOUUNZ-UHFFFAOYSA-N 0 0 386.433 3.153 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H]1CCCO[C@@H]1C(C)(C)C ZINC000118470053 1413163507 /nfs/dbraw/zinc/16/35/07/1413163507.db2.gz HMWVFCFVJFLATN-DYVFJYSZSA-N 0 0 379.457 3.244 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118474581 1413164755 /nfs/dbraw/zinc/16/47/55/1413164755.db2.gz VQACDCNMSJAOMG-INIZCTEOSA-N 0 0 398.246 3.477 20 5 GGBDRN Nc1c(C(=O)Nc2n[nH]c(-c3ccccc3Cl)n2)cc(F)cc1[N+](=O)[O-] ZINC000118493826 1413167668 /nfs/dbraw/zinc/16/76/68/1413167668.db2.gz VNHMXPKAPJIADM-UHFFFAOYSA-N 0 0 376.735 3.007 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@H](O)c2cc(Cl)cc(Cl)c2)c1[N+](=O)[O-] ZINC000118520961 1413171385 /nfs/dbraw/zinc/17/13/85/1413171385.db2.gz VBMHWXCBUVKCGL-LBPRGKRZSA-N 0 0 387.223 3.041 20 5 GGBDRN COc1ccc(-c2csc(CNC(=O)c3c([N+](=O)[O-])c(C)nn3C)c2)cc1 ZINC000177368201 1428707031 /nfs/dbraw/zinc/70/70/31/1428707031.db2.gz RJYHXEJZJIZSLJ-UHFFFAOYSA-N 0 0 386.433 3.304 20 5 GGBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000177373151 1428708488 /nfs/dbraw/zinc/70/84/88/1428708488.db2.gz LOLORNFAMMDWOH-SRGMZFCMSA-N 0 0 375.450 3.235 20 5 GGBDRN O=C(NCCOC1CCCCCC1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000118593896 1413190600 /nfs/dbraw/zinc/19/06/00/1413190600.db2.gz ZWXJXJVCVKXXFA-UHFFFAOYSA-N 0 0 383.832 3.042 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000118595390 1413192520 /nfs/dbraw/zinc/19/25/20/1413192520.db2.gz HGTIAZBJRSZUAR-XHDPSFHLSA-N 0 0 397.859 3.144 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000177373171 1428708607 /nfs/dbraw/zinc/70/86/07/1428708607.db2.gz LOLORNFAMMDWOH-WHDAMIPWSA-N 0 0 375.450 3.235 20 5 GGBDRN O=C(CSC1=Nc2ccccc2C1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000118606062 1413196431 /nfs/dbraw/zinc/19/64/31/1413196431.db2.gz OHGMNYFDKBNRHU-UHFFFAOYSA-N 0 0 396.472 3.263 20 5 GGBDRN Cc1c(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000177374593 1428708987 /nfs/dbraw/zinc/70/89/87/1428708987.db2.gz FSZGASMCPOSPIY-QGZVFWFLSA-N 0 0 381.354 3.412 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2[C@H](C)C[C@@H]3CCCC[C@@H]32)nn1-c1ccccc1[N+](=O)[O-] ZINC000118623329 1413198978 /nfs/dbraw/zinc/19/89/78/1413198978.db2.gz JBJNOYVNQVJWGV-KBMXLJTQSA-N 0 0 396.447 3.242 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCN1C(=O)COc2ccccc21 ZINC000118634637 1413199876 /nfs/dbraw/zinc/19/98/76/1413199876.db2.gz UCDLPLMCLJPJIP-UHFFFAOYSA-N 0 0 389.795 3.311 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCN1C(=O)[C@@H]2CCCC[C@@H]2C1=O ZINC000118634524 1413199928 /nfs/dbraw/zinc/19/99/28/1413199928.db2.gz NIVJELGLZNZRCL-TXEJJXNPSA-N 0 0 393.827 3.060 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCc1c(C)nc2ncnn2c1C ZINC000118634166 1413199977 /nfs/dbraw/zinc/19/99/77/1413199977.db2.gz HAKGOGBYPOEFJY-UHFFFAOYSA-N 0 0 388.815 3.182 20 5 GGBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000118664326 1413203101 /nfs/dbraw/zinc/20/31/01/1413203101.db2.gz KBOPVIFGZAPYBG-BZPMIXESSA-N 0 0 379.844 3.158 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)Cn1cccc(C(F)(F)F)c1=O ZINC000118687379 1413204361 /nfs/dbraw/zinc/20/43/61/1413204361.db2.gz QEHSSTWUHVDBND-UHFFFAOYSA-N 0 0 389.717 3.376 20 5 GGBDRN Cc1[nH]c2ccccc2c1CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689640 1413204802 /nfs/dbraw/zinc/20/48/02/1413204802.db2.gz BIUYMUBDAWRVCG-CQSZACIVSA-N 0 0 379.420 3.035 20 5 GGBDRN Cc1ccc(C)c(OCCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689501 1413204907 /nfs/dbraw/zinc/20/49/07/1413204907.db2.gz SFYDODLNQJQDOU-INIZCTEOSA-N 0 0 384.436 3.089 20 5 GGBDRN C[C@H](Oc1ccccc1Cl)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689634 1413204934 /nfs/dbraw/zinc/20/49/34/1413204934.db2.gz AZELIIUPENPMQF-QWHCGFSZSA-N 0 0 390.827 3.124 20 5 GGBDRN O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689037 1413205058 /nfs/dbraw/zinc/20/50/58/1413205058.db2.gz LOCANFFMCXIHPO-ZDUSSCGKSA-N 0 0 385.811 3.451 20 5 GGBDRN CCn1cc(CC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000118689580 1413205065 /nfs/dbraw/zinc/20/50/65/1413205065.db2.gz FIQDHZKDSXMWLU-MRXNPFEDSA-N 0 0 393.447 3.220 20 5 GGBDRN CC(C)c1cccc(OCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689339 1413205159 /nfs/dbraw/zinc/20/51/59/1413205159.db2.gz GMJPKMAHUJBYNN-INIZCTEOSA-N 0 0 384.436 3.205 20 5 GGBDRN CC(C)c1ccc(OCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118690353 1413205739 /nfs/dbraw/zinc/20/57/39/1413205739.db2.gz RKNICUKWDOWISM-MRXNPFEDSA-N 0 0 384.436 3.205 20 5 GGBDRN C[C@H](SCc1ccccc1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689935 1413205821 /nfs/dbraw/zinc/20/58/21/1413205821.db2.gz FNBIVSFPCHLKHY-HOCLYGCPSA-N 0 0 386.477 3.325 20 5 GGBDRN Cc1ccc(OCCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000118690614 1413206251 /nfs/dbraw/zinc/20/62/51/1413206251.db2.gz YIJBQWLZUMKZLM-MRXNPFEDSA-N 0 0 384.436 3.089 20 5 GGBDRN Cc1ccc(OCCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000118690613 1413206299 /nfs/dbraw/zinc/20/62/99/1413206299.db2.gz YIJBQWLZUMKZLM-INIZCTEOSA-N 0 0 384.436 3.089 20 5 GGBDRN COc1ccc2oc(C)c(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2c1 ZINC000118690899 1413206398 /nfs/dbraw/zinc/20/63/98/1413206398.db2.gz PLKDZQWKXHAHOL-CYBMUJFWSA-N 0 0 396.403 3.380 20 5 GGBDRN CCCc1c(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)[nH]c(C)c1C(C)=O ZINC000118690907 1413206409 /nfs/dbraw/zinc/20/64/09/1413206409.db2.gz PMEJUXAMFZHAQR-AWEZNQCLSA-N 0 0 399.451 3.108 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1ccc(Cl)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690729 1413206429 /nfs/dbraw/zinc/20/64/29/1413206429.db2.gz RGYVYMZFTVSCLL-BHYGNILZSA-N 0 0 386.839 3.460 20 5 GGBDRN O=C(CCc1nc2ccccc2s1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691042 1413206503 /nfs/dbraw/zinc/20/65/03/1413206503.db2.gz AHQLHWBLRJIGEH-CYBMUJFWSA-N 0 0 397.460 3.245 20 5 GGBDRN O=C(CCOc1cccc(Cl)c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118691164 1413206863 /nfs/dbraw/zinc/20/68/63/1413206863.db2.gz AYHRUNGOGIGSMU-CQSZACIVSA-N 0 0 390.827 3.125 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)c1nc2ccccc2n1C(C)C ZINC000118706382 1413209246 /nfs/dbraw/zinc/20/92/46/1413209246.db2.gz VDGUSGNUAQVZDB-ZDUSSCGKSA-N 0 0 384.440 3.298 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cn(-c3ccccc3)nc2C)cc([N+](=O)[O-])c1 ZINC000118723527 1413209945 /nfs/dbraw/zinc/20/99/45/1413209945.db2.gz IRSNFHAMGHYWAL-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)Nc2cccc3[nH]cnc32)cc1[N+](=O)[O-] ZINC000118728597 1413211224 /nfs/dbraw/zinc/21/12/24/1413211224.db2.gz JYRNPNWHEQIAFW-UHFFFAOYSA-N 0 0 395.404 3.003 20 5 GGBDRN C[C@@H](NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1nc2ccccc2n1C ZINC000118737385 1413213308 /nfs/dbraw/zinc/21/33/08/1413213308.db2.gz WSBJWTSXPDLIBJ-CYBMUJFWSA-N 0 0 390.403 3.158 20 5 GGBDRN C[C@](NCc1cc(F)ccc1[N+](=O)[O-])(C(N)=O)c1cccc(C(F)(F)F)c1 ZINC000177376670 1428710329 /nfs/dbraw/zinc/71/03/29/1428710329.db2.gz KJYRSNXLGUNWNO-MRXNPFEDSA-N 0 0 385.317 3.243 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000177380853 1428712134 /nfs/dbraw/zinc/71/21/34/1428712134.db2.gz YGWGICBLDVINOI-WHDAMIPWSA-N 0 0 375.450 3.235 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CCc3n[nH]cc3C2)c([N+](=O)[O-])c1 ZINC000118854675 1413247643 /nfs/dbraw/zinc/24/76/43/1413247643.db2.gz XAMIWXMKOFBQGP-FQEVSTJZSA-N 0 0 391.431 3.364 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000118859514 1413249398 /nfs/dbraw/zinc/24/93/98/1413249398.db2.gz HUQUFMDIHYZSFU-HNNXBMFYSA-N 0 0 397.439 3.197 20 5 GGBDRN CCn1c(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2c1cccc2F ZINC000118866255 1413252781 /nfs/dbraw/zinc/25/27/81/1413252781.db2.gz WMMLVHMITHQAKU-CYBMUJFWSA-N 0 0 384.415 3.185 20 5 GGBDRN C[C@@H](c1nc(-c2cccs2)no1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866941 1413252841 /nfs/dbraw/zinc/25/28/41/1413252841.db2.gz WGQSAAFUTKQZFW-RYUDHWBXSA-N 0 0 386.437 3.349 20 5 GGBDRN CC[C@H](CNC(=O)CCn1cc([N+](=O)[O-])nc1C)Oc1ccccc1Cl ZINC000177371586 1428708053 /nfs/dbraw/zinc/70/80/53/1428708053.db2.gz BDHRPKHHMZEBBT-CYBMUJFWSA-N 0 0 380.832 3.117 20 5 GGBDRN Cc1ccc(NC(=O)CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl ZINC000118866401 1413253353 /nfs/dbraw/zinc/25/33/53/1413253353.db2.gz MZDYFAVVWPNTPW-AWEZNQCLSA-N 0 0 389.843 3.077 20 5 GGBDRN C[C@@H](c1nnc(-c2cccs2)o1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866723 1413253401 /nfs/dbraw/zinc/25/34/01/1413253401.db2.gz SJCRRRMRUNEEBI-RYUDHWBXSA-N 0 0 386.437 3.349 20 5 GGBDRN C[C@H](C(=O)Nc1cccc(Cl)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118867149 1413253822 /nfs/dbraw/zinc/25/38/22/1413253822.db2.gz SBLYYAKTNUXFAR-DOMZBBRYSA-N 0 0 389.843 3.157 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)Cc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000118907741 1413265876 /nfs/dbraw/zinc/26/58/76/1413265876.db2.gz PHYQDUMYJPWCMB-UHFFFAOYSA-N 0 0 393.399 3.045 20 5 GGBDRN CCc1nnc(COC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)n1C ZINC000118907884 1413265990 /nfs/dbraw/zinc/26/59/90/1413265990.db2.gz PFGKBUFPLKEPPV-UHFFFAOYSA-N 0 0 381.392 3.386 20 5 GGBDRN CCc1nnc(COC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)n1C ZINC000118909300 1413266805 /nfs/dbraw/zinc/26/68/05/1413266805.db2.gz ZVZILJVRJXWYCI-UHFFFAOYSA-N 0 0 395.419 3.255 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCN(c2nc3ccccc3s2)CC1 ZINC000177386521 1428713834 /nfs/dbraw/zinc/71/38/34/1428713834.db2.gz KAHNAVNCVZJODR-UHFFFAOYSA-N 0 0 386.408 3.306 20 5 GGBDRN O=C(Nc1cccc(OCCn2cncn2)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000118942330 1413267512 /nfs/dbraw/zinc/26/75/12/1413267512.db2.gz VLYJUQVCBGSANL-UHFFFAOYSA-N 0 0 387.783 3.171 20 5 GGBDRN O=C(c1ccc(F)cc1F)N1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000118950110 1413270823 /nfs/dbraw/zinc/27/08/23/1413270823.db2.gz KTOQGAPXICFOJF-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN O=C(Nc1ccccc1O[C@H]1CCOC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000118953146 1413272061 /nfs/dbraw/zinc/27/20/61/1413272061.db2.gz VBHVZAFHFXGXRT-KRWDZBQOSA-N 0 0 394.387 3.201 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000118953888 1413272834 /nfs/dbraw/zinc/27/28/34/1413272834.db2.gz AAOSKFYVQIOXNM-ZNMIVQPWSA-N 0 0 385.468 3.302 20 5 GGBDRN CCCOC1(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCCCC1 ZINC000177387950 1428714265 /nfs/dbraw/zinc/71/42/65/1428714265.db2.gz ZKGLXRRNKJCDCX-UHFFFAOYSA-N 0 0 387.436 3.296 20 5 GGBDRN Cc1cccc(C(C)(C)NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000118977289 1413286431 /nfs/dbraw/zinc/28/64/31/1413286431.db2.gz MBBIFOJZKPAAGZ-UHFFFAOYSA-N 0 0 389.839 3.338 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000118991792 1413294837 /nfs/dbraw/zinc/29/48/37/1413294837.db2.gz YRXRHOSQNJGIPS-UHFFFAOYSA-N 0 0 382.332 3.362 20 5 GGBDRN Cc1cnn(-c2ccc(NC(=O)COc3ccc(C=O)cc3[N+](=O)[O-])cc2F)c1 ZINC000119016052 1413304870 /nfs/dbraw/zinc/30/48/70/1413304870.db2.gz WYLBKIVONMOVBH-UHFFFAOYSA-N 0 0 398.350 3.058 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)OCc1cccc(NC(=O)c2ccccc2)c1 ZINC000119056886 1413319810 /nfs/dbraw/zinc/31/98/10/1413319810.db2.gz YHSWSMFJOICOPS-UHFFFAOYSA-N 0 0 394.387 3.177 20 5 GGBDRN CC(C)Cc1ccc([C@H](NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C2CC2)cc1 ZINC000119061097 1413321305 /nfs/dbraw/zinc/32/13/05/1413321305.db2.gz DFXNQLSJJUFQSJ-NRFANRHFSA-N 0 0 383.448 3.223 20 5 GGBDRN CCCOC1(CNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)CCCCC1 ZINC000177400146 1428718525 /nfs/dbraw/zinc/71/85/25/1428718525.db2.gz VXURCMHCOHKIHR-UHFFFAOYSA-N 0 0 387.440 3.035 20 5 GGBDRN O=C(NC[C@H]1CCC[C@H](O)C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000119083313 1413330427 /nfs/dbraw/zinc/33/04/27/1413330427.db2.gz ZMUKCHDSNIVWKE-WMZOPIPTSA-N 0 0 383.448 3.488 20 5 GGBDRN O=C(Nc1ccccc1CN1CCOCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119086785 1413330735 /nfs/dbraw/zinc/33/07/35/1413330735.db2.gz KGMCEJSQIUKYQT-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN CC(=O)c1ccc(OCC(=O)NCCc2c(C)cc(C)cc2C)c([N+](=O)[O-])c1 ZINC000119087315 1413331765 /nfs/dbraw/zinc/33/17/65/1413331765.db2.gz JEXABFNTCIHMKG-UHFFFAOYSA-N 0 0 384.432 3.460 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000119102921 1413337464 /nfs/dbraw/zinc/33/74/64/1413337464.db2.gz PCJZTCXUYTZWJH-KRWDZBQOSA-N 0 0 387.823 3.103 20 5 GGBDRN COC(=O)c1sc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])nc1C1CC1 ZINC000119105332 1413338193 /nfs/dbraw/zinc/33/81/93/1413338193.db2.gz MYGQTECNFAQJHR-UHFFFAOYSA-N 0 0 379.369 3.415 20 5 GGBDRN Cc1cccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1Cl ZINC000119119700 1413344735 /nfs/dbraw/zinc/34/47/35/1413344735.db2.gz QMXWZRRRKQYBMS-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@@H](N(C)C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000119120022 1413344876 /nfs/dbraw/zinc/34/48/76/1413344876.db2.gz ZZZAPBFZSFSJAF-MRXNPFEDSA-N 0 0 391.468 3.304 20 5 GGBDRN CCOC(=O)CN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000119121883 1413345357 /nfs/dbraw/zinc/34/53/57/1413345357.db2.gz GZPFZNUYFVJHMJ-OAHLLOKOSA-N 0 0 385.420 3.160 20 5 GGBDRN CCOC(=O)CN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000119121720 1413345432 /nfs/dbraw/zinc/34/54/32/1413345432.db2.gz GZPFZNUYFVJHMJ-HNNXBMFYSA-N 0 0 385.420 3.160 20 5 GGBDRN C[C@H](NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000119130699 1413349350 /nfs/dbraw/zinc/34/93/50/1413349350.db2.gz GHIIVUYKYKWUHA-ZDUSSCGKSA-N 0 0 393.440 3.374 20 5 GGBDRN O=C(Nc1ccc(N2CCC(O)CC2)cc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119135678 1413351260 /nfs/dbraw/zinc/35/12/60/1413351260.db2.gz GQRKEDDHAUTVJA-UHFFFAOYSA-N 0 0 375.812 3.462 20 5 GGBDRN Cn1ccnc1-c1csc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)n1 ZINC000119135431 1413351366 /nfs/dbraw/zinc/35/13/66/1413351366.db2.gz GXRINKSYKKINGV-UHFFFAOYSA-N 0 0 386.437 3.283 20 5 GGBDRN Cn1cc(CCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000119142135 1413353412 /nfs/dbraw/zinc/35/34/12/1413353412.db2.gz GGAZHJCXXFBMLL-INIZCTEOSA-N 0 0 393.447 3.127 20 5 GGBDRN O=C(c1cc(F)cc(C(F)(F)F)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000119145625 1413354717 /nfs/dbraw/zinc/35/47/17/1413354717.db2.gz NIYJUXWZNZJEDS-ZDUSSCGKSA-N 0 0 398.316 3.474 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(N2CCCC2)c1 ZINC000119150589 1413356226 /nfs/dbraw/zinc/35/62/26/1413356226.db2.gz IIORSGWTQZDZRH-CYBMUJFWSA-N 0 0 393.440 3.374 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2)c1 ZINC000119155023 1413358022 /nfs/dbraw/zinc/35/80/22/1413358022.db2.gz PUKORAGQTSBFGQ-AWEZNQCLSA-N 0 0 375.450 3.235 20 5 GGBDRN O=C(Nc1cc(Cl)ccc1N1CCOCC1)c1ccc([N+](=O)[O-])cc1[O-] ZINC000119174470 1413365141 /nfs/dbraw/zinc/36/51/41/1413365141.db2.gz QOAMOUTYGRDTAC-UHFFFAOYSA-N 0 0 377.784 3.043 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1 ZINC000119179332 1413366916 /nfs/dbraw/zinc/36/69/16/1413366916.db2.gz GJUGVIQOUBMGMN-UHFFFAOYSA-N 0 0 395.347 3.306 20 5 GGBDRN CC(=O)c1ccc(OCC(=O)N[C@@H](C)Cc2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000119180327 1413367621 /nfs/dbraw/zinc/36/76/21/1413367621.db2.gz RFCDHPCSMMDMQH-NSHDSACASA-N 0 0 392.358 3.202 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000119202638 1413374349 /nfs/dbraw/zinc/37/43/49/1413374349.db2.gz VCGDUPSCOBMRCU-BLLLJJGKSA-N 0 0 387.392 3.096 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000119225476 1413381036 /nfs/dbraw/zinc/38/10/36/1413381036.db2.gz CIWJIGGUUBRRCT-UHFFFAOYSA-N 0 0 380.326 3.366 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H](C)c2cnn(C)c2)cc1[N+](=O)[O-])c1ccccn1 ZINC000119228400 1413382344 /nfs/dbraw/zinc/38/23/44/1413382344.db2.gz JJTAMQFYEFQIMN-UONOGXRCSA-N 0 0 394.435 3.387 20 5 GGBDRN COc1cc(CCNC(=O)C2(Cc3ccccc3)CC2)c([N+](=O)[O-])cc1OC ZINC000177407192 1428722487 /nfs/dbraw/zinc/72/24/87/1428722487.db2.gz VFRMHCXCTLDBRX-UHFFFAOYSA-N 0 0 384.432 3.294 20 5 GGBDRN Cc1c(C(=O)N2CCCc3c(F)ccc(F)c32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000119247514 1413388518 /nfs/dbraw/zinc/38/85/18/1413388518.db2.gz SNSYHNQCPSEFHV-UHFFFAOYSA-N 0 0 399.357 3.355 20 5 GGBDRN CCC(CC)(NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000119255259 1413390979 /nfs/dbraw/zinc/39/09/79/1413390979.db2.gz DYDAZNPPQCJYOZ-UHFFFAOYSA-N 0 0 377.828 3.242 20 5 GGBDRN O=C(Nc1cccc(-n2ccnn2)c1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000119286291 1413399286 /nfs/dbraw/zinc/39/92/86/1413399286.db2.gz YMCIKMLXHWXFLS-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CCC[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000119321868 1413411670 /nfs/dbraw/zinc/41/16/70/1413411670.db2.gz SGEAZOPRGHJOIA-AWEZNQCLSA-N 0 0 397.353 3.433 20 5 GGBDRN Cc1c(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cnn1C ZINC000119325725 1413412416 /nfs/dbraw/zinc/41/24/16/1413412416.db2.gz OMEMMEHBLQNHLN-UHFFFAOYSA-N 0 0 388.371 3.064 20 5 GGBDRN Cc1ccc(OS(=O)(=O)c2csc([N+](=O)[O-])c2)c(Br)c1 ZINC000119347716 1413419882 /nfs/dbraw/zinc/41/98/82/1413419882.db2.gz ICDBAQYCRYVJOW-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N[C@@H](c2ccccc2)c2ccccn2)cs1 ZINC000119348784 1413419886 /nfs/dbraw/zinc/41/98/86/1413419886.db2.gz PLYNCQFHAKTHEI-INIZCTEOSA-N 0 0 375.431 3.119 20 5 GGBDRN CN(Cc1ccc(Br)s1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119352304 1413421044 /nfs/dbraw/zinc/42/10/44/1413421044.db2.gz IJPBFXKRULHKQT-UHFFFAOYSA-N 0 0 397.297 3.301 20 5 GGBDRN O=C(COc1ccc(Br)nc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000119364150 1413424684 /nfs/dbraw/zinc/42/46/84/1413424684.db2.gz GOACLNVUGOZPPV-UHFFFAOYSA-N 0 0 386.589 3.423 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2sccc2Br)c(F)c1 ZINC000119365065 1413425614 /nfs/dbraw/zinc/42/56/14/1413425614.db2.gz SIQCIGOIRLUJDG-UHFFFAOYSA-N 0 0 382.188 3.326 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccc3c(c2)CCO3)no1 ZINC000119372203 1413427395 /nfs/dbraw/zinc/42/73/95/1413427395.db2.gz YRNQPQHSVBWYJK-UHFFFAOYSA-N 0 0 381.344 3.446 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Oc2c(F)cccc2F)ccc1Br ZINC000119372415 1413427510 /nfs/dbraw/zinc/42/75/10/1413427510.db2.gz PHJXFBHIHLNTEO-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN COc1ccc(NC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)c([N+](=O)[O-])c1 ZINC000119373652 1413428073 /nfs/dbraw/zinc/42/80/73/1413428073.db2.gz OLJOSCDUSPQRFR-UHFFFAOYSA-N 0 0 381.344 3.446 20 5 GGBDRN O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)N1CCCc2c(F)ccc(F)c21 ZINC000119374822 1413428292 /nfs/dbraw/zinc/42/82/92/1413428292.db2.gz BCMLAGHNNJWRSF-UHFFFAOYSA-N 0 0 390.342 3.166 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cn(Cc2cccc(F)c2)nn1 ZINC000119379403 1413429531 /nfs/dbraw/zinc/42/95/31/1413429531.db2.gz JNLRDCPRLYEYMQ-UHFFFAOYSA-N 0 0 375.747 3.279 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)cc2F)C[C@@H](C)O1 ZINC000119400846 1413434777 /nfs/dbraw/zinc/43/47/77/1413434777.db2.gz MNYUDIYHBXUNBF-VXGBXAGGSA-N 0 0 388.399 3.182 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1nnc(-c2ccccc2)s1 ZINC000177417795 1428727625 /nfs/dbraw/zinc/72/76/25/1428727625.db2.gz ZQCCFNGWEIXBTJ-UHFFFAOYSA-N 0 0 398.448 3.025 20 5 GGBDRN CN(Cc1ccsc1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000119407206 1413436621 /nfs/dbraw/zinc/43/66/21/1413436621.db2.gz RSDBKPWWQCKNQC-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN CC[C@H](C)N(Cc1ccccc1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000119408872 1413437060 /nfs/dbraw/zinc/43/70/60/1413437060.db2.gz OUBPKSILIRVHRP-AWEZNQCLSA-N 0 0 385.420 3.369 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1[N+](=O)[O-] ZINC000119409316 1413437641 /nfs/dbraw/zinc/43/76/41/1413437641.db2.gz LUGWNXSBZVBNLG-UHFFFAOYSA-N 0 0 383.407 3.014 20 5 GGBDRN COC(=O)[C@H](C)[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000119423043 1413442071 /nfs/dbraw/zinc/44/20/71/1413442071.db2.gz GYYDUDOLQNSREM-ZUOKHONESA-N 0 0 395.415 3.285 20 5 GGBDRN COc1ccc(OCCN(C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000119437312 1413446616 /nfs/dbraw/zinc/44/66/16/1413446616.db2.gz OZOCKYVGYPJJQH-HNNXBMFYSA-N 0 0 387.436 3.250 20 5 GGBDRN O=C(NC[C@@H](O)c1cc2ccccc2s1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000119437562 1413446749 /nfs/dbraw/zinc/44/67/49/1413446749.db2.gz GSBSXPXAZQHGPK-CQSZACIVSA-N 0 0 382.401 3.149 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1csc([N+](=O)[O-])c1)c1ccc(OC(F)F)cc1 ZINC000119444021 1413448526 /nfs/dbraw/zinc/44/85/26/1413448526.db2.gz KBHDEUZCZUNOGP-MRVPVSSYSA-N 0 0 378.378 3.297 20 5 GGBDRN COC(=O)[C@@H](C)[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000177409958 1428723897 /nfs/dbraw/zinc/72/38/97/1428723897.db2.gz QYLJELSGPLAWMH-SCLBCKFNSA-N 0 0 396.403 3.285 20 5 GGBDRN O=C(CCOC[C@@H]1CCCO1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000119461468 1413455408 /nfs/dbraw/zinc/45/54/08/1413455408.db2.gz MOWUSYALFDWAKX-AWEZNQCLSA-N 0 0 377.422 3.243 20 5 GGBDRN Cn1cc(C(=O)OCCOCc2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119472802 1413458884 /nfs/dbraw/zinc/45/88/84/1413458884.db2.gz GZMJBTHRCYRUIN-UHFFFAOYSA-N 0 0 381.388 3.369 20 5 GGBDRN Cc1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119479890 1413461231 /nfs/dbraw/zinc/46/12/31/1413461231.db2.gz LIRZZMFBTRRVLH-UHFFFAOYSA-N 0 0 395.375 3.487 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000119482756 1413462399 /nfs/dbraw/zinc/46/23/99/1413462399.db2.gz ZHSDIVLBPJXOBW-CYBMUJFWSA-N 0 0 391.449 3.065 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCO[C@]3(CCc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000119489362 1413464003 /nfs/dbraw/zinc/46/40/03/1413464003.db2.gz BRAOXZGSRPHLDR-HXUWFJFHSA-N 0 0 397.387 3.126 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)cs1 ZINC000119499611 1413466967 /nfs/dbraw/zinc/46/69/67/1413466967.db2.gz IAXNGJPTWGPNOV-NSHDSACASA-N 0 0 393.446 3.366 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000119516112 1413472683 /nfs/dbraw/zinc/47/26/83/1413472683.db2.gz XUFJWEGOEIHQPQ-AWEZNQCLSA-N 0 0 395.390 3.280 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccc(Cl)c(N2CCNC2=O)c1 ZINC000119524451 1413475417 /nfs/dbraw/zinc/47/54/17/1413475417.db2.gz AFYAZIAWOWKHEC-UHFFFAOYSA-N 0 0 378.747 3.169 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](c1ccccc1)C(F)(F)F ZINC000119534360 1413478276 /nfs/dbraw/zinc/47/82/76/1413478276.db2.gz AKNXAAALMBYBHF-AWEZNQCLSA-N 0 0 390.339 3.185 20 5 GGBDRN COC(=O)c1cc(C)ccc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000119536512 1413478885 /nfs/dbraw/zinc/47/88/85/1413478885.db2.gz OKDHPHDDEZMLOI-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN Cc1oc(-c2ccccc2F)nc1C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000119538994 1413480291 /nfs/dbraw/zinc/48/02/91/1413480291.db2.gz LIKRRIBUJQKVNF-UHFFFAOYSA-N 0 0 399.334 3.493 20 5 GGBDRN CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000119541976 1413480855 /nfs/dbraw/zinc/48/08/55/1413480855.db2.gz QUFLMCLKIJIZPO-IBGZPJMESA-N 0 0 394.431 3.398 20 5 GGBDRN Cc1ccccc1[C@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CCO1 ZINC000119541945 1413481017 /nfs/dbraw/zinc/48/10/17/1413481017.db2.gz DVYZOIZGIUKQOO-HXUWFJFHSA-N 0 0 392.415 3.303 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000177424039 1428730472 /nfs/dbraw/zinc/73/04/72/1428730472.db2.gz JHSDKTDUXIOTGM-PWFNWSNSSA-N 0 0 389.477 3.277 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(N2CCC(O)CC2)cc1 ZINC000119546347 1413482131 /nfs/dbraw/zinc/48/21/31/1413482131.db2.gz LWQYCELJDNBURB-UHFFFAOYSA-N 0 0 389.839 3.391 20 5 GGBDRN COc1ccc(C2=N/C(=C\c3ncccc3C(F)(F)F)C(=O)O2)cc1[N+](=O)[O-] ZINC000119547138 1413482275 /nfs/dbraw/zinc/48/22/75/1413482275.db2.gz ODBLBUOZTUIWAF-WQLSENKSSA-N 0 0 393.277 3.362 20 5 GGBDRN O=[N+]([O-])c1ccc(N(CCO)CCOCC(F)(F)F)nc1-c1ccccc1 ZINC000119550379 1413482938 /nfs/dbraw/zinc/48/29/38/1413482938.db2.gz BSTIEOCTYHBODY-UHFFFAOYSA-N 0 0 385.342 3.034 20 5 GGBDRN CCCN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H](C)C(=O)Nc1ccccc1 ZINC000119574416 1413490657 /nfs/dbraw/zinc/49/06/57/1413490657.db2.gz HMGLIUXBIXMUPW-OAHLLOKOSA-N 0 0 385.420 3.239 20 5 GGBDRN CCCN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H](C)C(=O)Nc1ccccc1 ZINC000119574303 1413490707 /nfs/dbraw/zinc/49/07/07/1413490707.db2.gz HMGLIUXBIXMUPW-HNNXBMFYSA-N 0 0 385.420 3.239 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OS(=O)(=O)c1sccc1Br ZINC000119575739 1413490712 /nfs/dbraw/zinc/49/07/12/1413490712.db2.gz ODVIMATYOJBWFL-UHFFFAOYSA-N 0 0 378.225 3.495 20 5 GGBDRN C[C@H](C1CC1)N(C1CC1)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000119580181 1413491930 /nfs/dbraw/zinc/49/19/30/1413491930.db2.gz PYQJMUAYGMASRK-SECBINFHSA-N 0 0 389.271 3.309 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000119582569 1413493272 /nfs/dbraw/zinc/49/32/72/1413493272.db2.gz GNXCMNQMZCWJQB-ZDUSSCGKSA-N 0 0 395.868 3.053 20 5 GGBDRN CCc1sc(NC(=O)c2c([N+](=O)[O-])cnn2C)nc1-c1ccc(OC)cc1 ZINC000119587406 1413494687 /nfs/dbraw/zinc/49/46/87/1413494687.db2.gz TXJFZTCZDBJYBX-UHFFFAOYSA-N 0 0 387.421 3.275 20 5 GGBDRN Cn1c(=O)oc2c1cccc2C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000119588172 1413495120 /nfs/dbraw/zinc/49/51/20/1413495120.db2.gz KUNWTFIKEQTKCB-UHFFFAOYSA-N 0 0 396.384 3.416 20 5 GGBDRN CC(=O)N1CC[C@H](CN(C)C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000119590538 1413495815 /nfs/dbraw/zinc/49/58/15/1413495815.db2.gz MVZYRAFSKKVAGC-MRXNPFEDSA-N 0 0 396.447 3.279 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCN(c2nc3ccccc3s2)CC1 ZINC000119589366 1413496130 /nfs/dbraw/zinc/49/61/30/1413496130.db2.gz IYMVVWUSXIGWJM-UHFFFAOYSA-N 0 0 396.472 3.486 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNS(=O)(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000119598187 1413498629 /nfs/dbraw/zinc/49/86/29/1413498629.db2.gz ASGPVAQDRSKBHC-NSHDSACASA-N 0 0 397.478 3.119 20 5 GGBDRN Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000119600020 1413499366 /nfs/dbraw/zinc/49/93/66/1413499366.db2.gz YSGMFIAWJVDTLT-SECBINFHSA-N 0 0 389.412 3.390 20 5 GGBDRN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000119600182 1413499447 /nfs/dbraw/zinc/49/94/47/1413499447.db2.gz YSGMFIAWJVDTLT-VIFPVBQESA-N 0 0 389.412 3.390 20 5 GGBDRN C[C@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1ccco1 ZINC000119612000 1413503460 /nfs/dbraw/zinc/50/34/60/1413503460.db2.gz ZDIPBGJBDVDHKO-NRFANRHFSA-N 0 0 395.415 3.437 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1cc2ccccc2s1 ZINC000119618364 1413505480 /nfs/dbraw/zinc/50/54/80/1413505480.db2.gz DYFXDGOLAFVOEQ-MRXNPFEDSA-N 0 0 385.445 3.461 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)cs1 ZINC000119621531 1413506034 /nfs/dbraw/zinc/50/60/34/1413506034.db2.gz JIDFEQYTORNWRB-CYBMUJFWSA-N 0 0 388.854 3.072 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCc3cccc(OC(F)F)c32)cs1 ZINC000119640525 1413512313 /nfs/dbraw/zinc/51/23/13/1413512313.db2.gz CMISYXANTWHLJA-UHFFFAOYSA-N 0 0 390.389 3.399 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCc3cc(OC(F)F)ccc32)cs1 ZINC000119639637 1413512327 /nfs/dbraw/zinc/51/23/27/1413512327.db2.gz JJYSUBADDDVIBA-UHFFFAOYSA-N 0 0 390.389 3.399 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cs1 ZINC000119649283 1413515605 /nfs/dbraw/zinc/51/56/05/1413515605.db2.gz FQVCKLYNIGAZJT-XJKSGUPXSA-N 0 0 382.463 3.103 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCOc2ncccc2Cl)cc1[N+](=O)[O-] ZINC000119656406 1413517437 /nfs/dbraw/zinc/51/74/37/1413517437.db2.gz IITRFJDUIKSXQY-GFCCVEGCSA-N 0 0 378.816 3.391 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCOc2ncccc2Cl)cc1[N+](=O)[O-] ZINC000119656579 1413517545 /nfs/dbraw/zinc/51/75/45/1413517545.db2.gz IITRFJDUIKSXQY-LBPRGKRZSA-N 0 0 378.816 3.391 20 5 GGBDRN CC(C)CCC1CCN(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC1 ZINC000177429096 1428733545 /nfs/dbraw/zinc/73/35/45/1428733545.db2.gz QUTMXOVJEZMQDC-UHFFFAOYSA-N 0 0 382.482 3.287 20 5 GGBDRN CC(=O)c1ccc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1C ZINC000119668343 1413523689 /nfs/dbraw/zinc/52/36/89/1413523689.db2.gz AYFRFQJKXMGURU-UHFFFAOYSA-N 0 0 382.420 3.460 20 5 GGBDRN CCCN([C@H](C)C(=O)Nc1ccccc1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119681838 1413529404 /nfs/dbraw/zinc/52/94/04/1413529404.db2.gz 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O=C(COc1cc(Cl)ccc1[N+](=O)[O-])Nc1cccc(N2CCCC2=O)c1 ZINC000121266997 1414065402 /nfs/dbraw/zinc/06/54/02/1414065402.db2.gz AJJVWFPFJTVRBT-UHFFFAOYSA-N 0 0 389.795 3.393 20 5 GGBDRN O=C(NC[C@@H](O)c1ccc(Cl)cc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000121279216 1414069599 /nfs/dbraw/zinc/06/95/99/1414069599.db2.gz RVXJRFIWJWHMNF-GOSISDBHSA-N 0 0 389.839 3.312 20 5 GGBDRN C[C@@H](c1ccccc1)N1C[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000121284936 1414071337 /nfs/dbraw/zinc/07/13/37/1414071337.db2.gz PKQKUQOBEURUBB-YOEHRIQHSA-N 0 0 379.416 3.094 20 5 GGBDRN C[C@@]1(c2ccccc2)CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000121286483 1414071937 /nfs/dbraw/zinc/07/19/37/1414071937.db2.gz XTLICUJZVNYIMP-FQEVSTJZSA-N 0 0 380.404 3.392 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@H]1CCCOc2ccccc21 ZINC000121288288 1414072937 /nfs/dbraw/zinc/07/29/37/1414072937.db2.gz BBEDGICCGXVVOR-HNNXBMFYSA-N 0 0 383.404 3.180 20 5 GGBDRN O=C(NC[C@@H](O)c1ccc(Cl)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000121299037 1414076568 /nfs/dbraw/zinc/07/65/68/1414076568.db2.gz RKBIXIHASVMRFD-GOSISDBHSA-N 0 0 389.839 3.312 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000121303172 1414077791 /nfs/dbraw/zinc/07/77/91/1414077791.db2.gz IKHGAGKIPMHDCN-CQSZACIVSA-N 0 0 391.449 3.196 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000121303323 1414077912 /nfs/dbraw/zinc/07/79/12/1414077912.db2.gz IKHGAGKIPMHDCN-AWEZNQCLSA-N 0 0 391.449 3.196 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C[C@H]1CCCO1)C1CCCC1 ZINC000121315537 1414080734 /nfs/dbraw/zinc/08/07/34/1414080734.db2.gz JGUDORGIDHLGNM-MRXNPFEDSA-N 0 0 389.452 3.100 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000121327394 1414084423 /nfs/dbraw/zinc/08/44/23/1414084423.db2.gz OTRQYMMFUMGISX-OAHLLOKOSA-N 0 0 387.411 3.246 20 5 GGBDRN COc1cc(C(=O)N(Cc2ccco2)Cc2cccnc2)c([N+](=O)[O-])cc1OC ZINC000121337817 1414087388 /nfs/dbraw/zinc/08/73/88/1414087388.db2.gz MTXVUXHJONGFDC-UHFFFAOYSA-N 0 0 397.387 3.443 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121349045 1414090713 /nfs/dbraw/zinc/09/07/13/1414090713.db2.gz ZZKBGZXPLYXIJN-AWEZNQCLSA-N 0 0 385.420 3.139 20 5 GGBDRN COc1cc(OCC(=O)N(CC(F)(F)F)C2CCCC2)ccc1[N+](=O)[O-] ZINC000177521102 1428780720 /nfs/dbraw/zinc/78/07/20/1428780720.db2.gz BQSUQIRRHGFOAS-UHFFFAOYSA-N 0 0 376.331 3.316 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1nc(C)cs1 ZINC000121351289 1414091959 /nfs/dbraw/zinc/09/19/59/1414091959.db2.gz JCANLPCHWPLADV-GFCCVEGCSA-N 0 0 376.438 3.183 20 5 GGBDRN C[C@@H](CC(=O)c1ccccc1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000121359818 1414094800 /nfs/dbraw/zinc/09/48/00/1414094800.db2.gz FMSRFJOVSMJABJ-AWEZNQCLSA-N 0 0 378.388 3.172 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCO[C@](C)(c2ccccc2)C1 ZINC000121361702 1414095043 /nfs/dbraw/zinc/09/50/43/1414095043.db2.gz WJIGJLVHZSYTIM-NRFANRHFSA-N 0 0 399.447 3.180 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cccc(-c3nncn3C)c2)c1 ZINC000121363887 1414095661 /nfs/dbraw/zinc/09/56/61/1414095661.db2.gz HKXFMPUWWSPVDB-UHFFFAOYSA-N 0 0 381.392 3.106 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)s1 ZINC000121367251 1414097010 /nfs/dbraw/zinc/09/70/10/1414097010.db2.gz ZSWANQXYSMYPFT-GFCCVEGCSA-N 0 0 390.465 3.443 20 5 GGBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)s1 ZINC000121367099 1414097075 /nfs/dbraw/zinc/09/70/75/1414097075.db2.gz ZSWANQXYSMYPFT-LBPRGKRZSA-N 0 0 390.465 3.443 20 5 GGBDRN Cc1ccc(Oc2ccccc2CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)cc1 ZINC000121376636 1414100068 /nfs/dbraw/zinc/10/00/68/1414100068.db2.gz KKQBAEKWLVDGSR-UHFFFAOYSA-N 0 0 393.399 3.174 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1cccnc1Br ZINC000121377528 1414100476 /nfs/dbraw/zinc/10/04/76/1414100476.db2.gz OLHLFZFEKMDNST-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c(F)cc1F ZINC000121389917 1414105005 /nfs/dbraw/zinc/10/50/05/1414105005.db2.gz VOESLECYRWYMTD-UHFFFAOYSA-N 0 0 389.314 3.322 20 5 GGBDRN COc1ccccc1-c1nn(C)cc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121394596 1414106542 /nfs/dbraw/zinc/10/65/42/1414106542.db2.gz UQOKSRIQHADNNS-UHFFFAOYSA-N 0 0 392.415 3.202 20 5 GGBDRN O=C(c1ccc(-c2ccccc2)[nH]c1=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121409634 1414112565 /nfs/dbraw/zinc/11/25/65/1414112565.db2.gz SOBGUNMPGSHXOL-UHFFFAOYSA-N 0 0 375.384 3.149 20 5 GGBDRN Cc1sc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1CS(C)(=O)=O ZINC000121416274 1414115293 /nfs/dbraw/zinc/11/52/93/1414115293.db2.gz IXFHZHGLDUWGGW-JTQLQIEISA-N 0 0 394.474 3.101 20 5 GGBDRN Cc1nc(COc2ccccc2C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)no1 ZINC000121419086 1414115809 /nfs/dbraw/zinc/11/58/09/1414115809.db2.gz LQZQMFUADHAJRO-UHFFFAOYSA-N 0 0 390.302 3.396 20 5 GGBDRN O=C(CCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)Nc1ccccc1 ZINC000121431618 1414120140 /nfs/dbraw/zinc/12/01/40/1414120140.db2.gz XMGDULWIHSASTM-UHFFFAOYSA-N 0 0 382.420 3.298 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H](c1ncccc1C)C(C)C ZINC000121451857 1414129087 /nfs/dbraw/zinc/12/90/87/1414129087.db2.gz XSBGUTBRWIOXJR-MRXNPFEDSA-N 0 0 384.436 3.367 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)Cn2c3cc([N+](=O)[O-])ccc3oc2=O)cc1 ZINC000121458883 1414133281 /nfs/dbraw/zinc/13/32/81/1414133281.db2.gz HHUYIIJWFHDNBM-CQSZACIVSA-N 0 0 385.420 3.279 20 5 GGBDRN COc1ccc(C[C@H](C)CN(C)Cn2c3cc([N+](=O)[O-])ccc3oc2=O)cc1 ZINC000121458724 1414133420 /nfs/dbraw/zinc/13/34/20/1414133420.db2.gz HHUYIIJWFHDNBM-AWEZNQCLSA-N 0 0 385.420 3.279 20 5 GGBDRN Cc1cc(C(=O)OCC[C@H]2CCCCN2C(=O)c2cccn2C)cc([N+](=O)[O-])c1 ZINC000121462274 1414135284 /nfs/dbraw/zinc/13/52/84/1414135284.db2.gz WAYRQQYRHMUCIX-QGZVFWFLSA-N 0 0 399.447 3.484 20 5 GGBDRN O=C([C@@H]1C[C@H]1c1cccc(F)c1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000121471449 1414139148 /nfs/dbraw/zinc/13/91/48/1414139148.db2.gz VYIRKVOPXJYIFF-TUKIKUTGSA-N 0 0 388.374 3.085 20 5 GGBDRN O=[N+]([O-])c1cc2c(cc1Cc1nc(COc3ccc(F)cc3)no1)OCCO2 ZINC000121481166 1414143576 /nfs/dbraw/zinc/14/35/76/1414143576.db2.gz FLYZDWKNJCJRCN-UHFFFAOYSA-N 0 0 387.323 3.058 20 5 GGBDRN CC(=O)N1CCC(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)CC1 ZINC000121488973 1414146564 /nfs/dbraw/zinc/14/65/64/1414146564.db2.gz VGJJMOGXRANSPA-UHFFFAOYSA-N 0 0 388.449 3.224 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(CC(F)(F)F)C1CCCC1 ZINC000177537217 1428784870 /nfs/dbraw/zinc/78/48/70/1428784870.db2.gz WQXHDWRHDRMAMY-UHFFFAOYSA-N 0 0 383.330 3.123 20 5 GGBDRN Cc1ccc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1-n1cnnn1 ZINC000121516308 1414158827 /nfs/dbraw/zinc/15/88/27/1414158827.db2.gz XDWYJEKVWVJBLH-UHFFFAOYSA-N 0 0 393.407 3.075 20 5 GGBDRN Cc1nn(C)c(C(=O)NCCOc2ccccc2-c2ccccc2)c1[N+](=O)[O-] ZINC000121522550 1414161436 /nfs/dbraw/zinc/16/14/36/1414161436.db2.gz OEBBYDIWKVVHIE-UHFFFAOYSA-N 0 0 380.404 3.113 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000177538141 1428785723 /nfs/dbraw/zinc/78/57/23/1428785723.db2.gz NUKPFENSZHGGKU-DOJUMQAQSA-N 0 0 381.432 3.241 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1nc(Br)ccc1O ZINC000121532530 1414165343 /nfs/dbraw/zinc/16/53/43/1414165343.db2.gz JCNSKTLSIRRJGE-UHFFFAOYSA-N 0 0 391.181 3.120 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000121541091 1414169400 /nfs/dbraw/zinc/16/94/00/1414169400.db2.gz SZXWHVPUWQVPLB-HXUWFJFHSA-N 0 0 381.363 3.414 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000121541267 1414169565 /nfs/dbraw/zinc/16/95/65/1414169565.db2.gz SZXWHVPUWQVPLB-FQEVSTJZSA-N 0 0 381.363 3.414 20 5 GGBDRN CCC(CC)C(=O)N1CCC(Nc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000121549411 1414172827 /nfs/dbraw/zinc/17/28/27/1414172827.db2.gz FAHCVGUKZZCDOB-UHFFFAOYSA-N 0 0 379.457 3.451 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(COc2ccc(F)cc2)no1 ZINC000121561689 1414178266 /nfs/dbraw/zinc/17/82/66/1414178266.db2.gz NKZRCECZQXDMJD-NSHDSACASA-N 0 0 386.339 3.187 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[C@H](O)c2ccccc2)c1C ZINC000121563629 1414179066 /nfs/dbraw/zinc/17/90/66/1414179066.db2.gz JGRTUPRKCMKFOG-GUYCJALGSA-N 0 0 378.450 3.002 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)N1CCc2ccccc2C1 ZINC000121572906 1414182990 /nfs/dbraw/zinc/18/29/90/1414182990.db2.gz NCKKEONUYJAHMB-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCO[C@](C)(c2ccccc2)C1 ZINC000121574572 1414183993 /nfs/dbraw/zinc/18/39/93/1414183993.db2.gz GVLOAEJMCIKYPA-NRFANRHFSA-N 0 0 399.447 3.180 20 5 GGBDRN C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000121575310 1414184018 /nfs/dbraw/zinc/18/40/18/1414184018.db2.gz HGDPQGXPSUYGLO-SNVBAGLBSA-N 0 0 397.250 3.497 20 5 GGBDRN C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000121575493 1414184037 /nfs/dbraw/zinc/18/40/37/1414184037.db2.gz HGDPQGXPSUYGLO-JTQLQIEISA-N 0 0 397.250 3.497 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)Nc1c(F)cccc1F ZINC000121576948 1414184751 /nfs/dbraw/zinc/18/47/51/1414184751.db2.gz PMJLCRFZMLGYGY-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)Nc2cccnc2-c2ccccc2)cc([N+](=O)[O-])c1 ZINC000121581120 1414186004 /nfs/dbraw/zinc/18/60/04/1414186004.db2.gz BYUYWLJIIPNZNV-UHFFFAOYSA-N 0 0 397.412 3.313 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](c3ccccc3)C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000121589596 1414189518 /nfs/dbraw/zinc/18/95/18/1414189518.db2.gz RMSBYFVYXGMOGS-MRXNPFEDSA-N 0 0 377.404 3.114 20 5 GGBDRN O=C(Nc1ccc(C(=O)NC2CC2)cc1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000121592065 1414191239 /nfs/dbraw/zinc/19/12/39/1414191239.db2.gz WYDPNKVLAQKMBU-UHFFFAOYSA-N 0 0 376.372 3.288 20 5 GGBDRN CCOC(=O)c1ccnc(NCCCc2nc3ccccc3n2C)c1[N+](=O)[O-] ZINC000177546769 1428788310 /nfs/dbraw/zinc/78/83/10/1428788310.db2.gz KXNSUPRLTPSUCD-UHFFFAOYSA-N 0 0 383.408 3.098 20 5 GGBDRN O=C(NCC1(Cc2ccccc2)CC1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000121613381 1414200908 /nfs/dbraw/zinc/20/09/08/1414200908.db2.gz YGCQTUGGVGSVCN-UHFFFAOYSA-N 0 0 387.823 3.326 20 5 GGBDRN Cc1csc([C@H](NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C2CC2)n1 ZINC000121623963 1414204170 /nfs/dbraw/zinc/20/41/70/1414204170.db2.gz AZIZYRAJTYMYHC-OAHLLOKOSA-N 0 0 388.449 3.183 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(CCCCO)C3CC3)cc2[N+](=O)[O-])CC1 ZINC000121634164 1414207731 /nfs/dbraw/zinc/20/77/31/1414207731.db2.gz DBPUOEAYNHJJRQ-UHFFFAOYSA-N 0 0 375.469 3.208 20 5 GGBDRN Cc1ccc(O[C@H](C)CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000121650135 1414212028 /nfs/dbraw/zinc/21/20/28/1414212028.db2.gz HIPQJTICDHEAQU-CQSZACIVSA-N 0 0 385.420 3.042 20 5 GGBDRN Cc1ccccc1O[C@H](C)CNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000121649479 1414212084 /nfs/dbraw/zinc/21/20/84/1414212084.db2.gz OVYCBVJAMSDIFU-CQSZACIVSA-N 0 0 385.420 3.042 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)n1 ZINC000121649199 1414212216 /nfs/dbraw/zinc/21/22/16/1414212216.db2.gz TZYUZCIORIZGFR-UHFFFAOYSA-N 0 0 375.816 3.202 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(CC(C)(C)C)CC(C)(C)C ZINC000121654622 1414212962 /nfs/dbraw/zinc/21/29/62/1414212962.db2.gz GXGVMIANSBTZPX-UHFFFAOYSA-N 0 0 379.457 3.463 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000177549722 1428789757 /nfs/dbraw/zinc/78/97/57/1428789757.db2.gz GRWZPUOPPLIGOY-ZFWWWQNUSA-N 0 0 383.404 3.140 20 5 GGBDRN Cc1nnnn1-c1cccc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000121657260 1414214139 /nfs/dbraw/zinc/21/41/39/1414214139.db2.gz GGFZWWRIHXSYOU-UHFFFAOYSA-N 0 0 393.407 3.075 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000121658636 1414214868 /nfs/dbraw/zinc/21/48/68/1414214868.db2.gz JKCXEPCVJRZIIY-LBPRGKRZSA-N 0 0 393.469 3.171 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000121662017 1414216213 /nfs/dbraw/zinc/21/62/13/1414216213.db2.gz QBYGUPZBAIFNBJ-LBPRGKRZSA-N 0 0 393.469 3.253 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000121681971 1414222005 /nfs/dbraw/zinc/22/20/05/1414222005.db2.gz JZRLDEYFQAMGSO-RYUDHWBXSA-N 0 0 393.469 3.251 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C12CCCC2 ZINC000121685404 1414223425 /nfs/dbraw/zinc/22/34/25/1414223425.db2.gz QPZAHALHXFRFLA-HZPDHXFCSA-N 0 0 389.452 3.004 20 5 GGBDRN CC(C)N(C1CCC1)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000121686573 1414223959 /nfs/dbraw/zinc/22/39/59/1414223959.db2.gz ALKPFDXHJSEZLO-UHFFFAOYSA-N 0 0 377.260 3.309 20 5 GGBDRN CC(=O)c1ccc(OC[C@H](O)Cn2cnc3cc4ccccc4cc3c2=O)cc1 ZINC000121687881 1414224252 /nfs/dbraw/zinc/22/42/52/1414224252.db2.gz MOKNHKXNMVAHHF-LJQANCHMSA-N 0 0 388.423 3.192 20 5 GGBDRN Nc1c(C(=O)NCCc2csc(-c3ccccc3)n2)cc(F)cc1[N+](=O)[O-] ZINC000177552915 1428790648 /nfs/dbraw/zinc/79/06/48/1428790648.db2.gz XYQYAXPFGXEDJF-UHFFFAOYSA-N 0 0 386.408 3.412 20 5 GGBDRN CC(=O)c1cccc(OC[C@H](O)Cn2cnc3cc4ccccc4cc3c2=O)c1 ZINC000121690473 1414224856 /nfs/dbraw/zinc/22/48/56/1414224856.db2.gz NQVHKUACDBQHFZ-LJQANCHMSA-N 0 0 388.423 3.192 20 5 GGBDRN CC(=O)c1cccc(OC[C@@H](O)Cn2cnc3cc4ccccc4cc3c2=O)c1 ZINC000121690635 1414224912 /nfs/dbraw/zinc/22/49/12/1414224912.db2.gz NQVHKUACDBQHFZ-IBGZPJMESA-N 0 0 388.423 3.192 20 5 GGBDRN Cc1cccc(C2N=NC(=S)N2CCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000121723590 1414236562 /nfs/dbraw/zinc/23/65/62/1414236562.db2.gz KRBLHGAUAPPFOS-UHFFFAOYSA-N 0 0 383.433 3.479 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCN(C)c2ccc(F)cc21 ZINC000121727435 1414237791 /nfs/dbraw/zinc/23/77/91/1414237791.db2.gz MYMDHCYAFPJCQN-UHFFFAOYSA-N 0 0 379.413 3.078 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCCN(C)c3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000121726449 1414237930 /nfs/dbraw/zinc/23/79/30/1414237930.db2.gz GFWFDISQIADALG-UHFFFAOYSA-N 0 0 379.413 3.078 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000121737282 1414241184 /nfs/dbraw/zinc/24/11/84/1414241184.db2.gz PRSUYXIKGPDQSZ-NWDGAFQWSA-N 0 0 393.469 3.251 20 5 GGBDRN Cn1cc(C(=O)Nc2ccc3[nH]c(=S)[nH]c3c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000121738835 1414241868 /nfs/dbraw/zinc/24/18/68/1414241868.db2.gz LLWRHUUPNSJEML-UHFFFAOYSA-N 0 0 394.416 3.413 20 5 GGBDRN C[C@H](CC(=O)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccncc1 ZINC000121778320 1414254241 /nfs/dbraw/zinc/25/42/41/1414254241.db2.gz NQKBYGICOHNASL-OAHLLOKOSA-N 0 0 384.436 3.338 20 5 GGBDRN C[C@@]1(c2ccccc2)CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CCO1 ZINC000121787565 1414256922 /nfs/dbraw/zinc/25/69/22/1414256922.db2.gz NMAIQAKODOHJLN-FQEVSTJZSA-N 0 0 380.404 3.392 20 5 GGBDRN COc1ccc(NC(=O)NC[C@](C)(O)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000121820885 1414269034 /nfs/dbraw/zinc/26/90/34/1414269034.db2.gz UQYFMVBPKZBGQS-KRWDZBQOSA-N 0 0 379.800 3.286 20 5 GGBDRN Cc1cc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)ccc1C(=O)OC(C)(C)C ZINC000121825739 1414270075 /nfs/dbraw/zinc/27/00/75/1414270075.db2.gz JBDGWOMLVYHNMB-UHFFFAOYSA-N 0 0 388.424 3.429 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(N(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)n1 ZINC000121852314 1414278947 /nfs/dbraw/zinc/27/89/47/1414278947.db2.gz SYKWPVUJUKZLTL-ZDUSSCGKSA-N 0 0 385.342 3.193 20 5 GGBDRN CN1CCO[C@H]([C@H](NCc2ccccc2[N+](=O)[O-])c2ccc(Cl)cc2)C1 ZINC000121854013 1414279075 /nfs/dbraw/zinc/27/90/75/1414279075.db2.gz JARNHHOJPKQMRK-RBUKOAKNSA-N 0 0 375.856 3.410 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NC[C@H](c1cccnc1)C(C)C ZINC000121854731 1414279759 /nfs/dbraw/zinc/27/97/59/1414279759.db2.gz RQWRKIGLDQILNJ-INIZCTEOSA-N 0 0 384.436 3.101 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCc1csc(-c2ccccc2)n1 ZINC000177562411 1428794696 /nfs/dbraw/zinc/79/46/96/1428794696.db2.gz YNXHXKIQJZVSSM-UHFFFAOYSA-N 0 0 383.429 3.456 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1nc2c(cccc2C(F)(F)F)s1 ZINC000121856982 1414280355 /nfs/dbraw/zinc/28/03/55/1414280355.db2.gz XOSGUKZVZNEHSJ-UHFFFAOYSA-N 0 0 398.322 3.024 20 5 GGBDRN CCn1c(SCCn2cc([N+](=O)[O-])ccc2=O)nnc1-c1cccc(C)c1 ZINC000121856626 1414280382 /nfs/dbraw/zinc/28/03/82/1414280382.db2.gz BAJOLXAMRFZCLT-UHFFFAOYSA-N 0 0 385.449 3.136 20 5 GGBDRN CS(=O)(=O)c1cccc(Nc2cccc(N3CCCCC3=O)c2)c1[N+](=O)[O-] ZINC000121862899 1414282464 /nfs/dbraw/zinc/28/24/64/1414282464.db2.gz MJCNKBUWZUTKPT-UHFFFAOYSA-N 0 0 389.433 3.259 20 5 GGBDRN O=C(CN1CCCCC[C@H]1C[C@H](O)c1ccco1)Nc1ccccc1[N+](=O)[O-] ZINC000121875695 1414286726 /nfs/dbraw/zinc/28/67/26/1414286726.db2.gz FBXPRABGBVPGKR-YJBOKZPZSA-N 0 0 387.436 3.495 20 5 GGBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCN(Cc2cn3ccccc3n2)CC1 ZINC000121886713 1414291535 /nfs/dbraw/zinc/29/15/35/1414291535.db2.gz PDGIFMITQYHNTO-FNORWQNLSA-N 0 0 377.448 3.074 20 5 GGBDRN COc1ccc(C)cc1CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000121892153 1414293887 /nfs/dbraw/zinc/29/38/87/1414293887.db2.gz ZIWDRLJOCJWVLW-UHFFFAOYSA-N 0 0 387.392 3.409 20 5 GGBDRN CC(=O)C[C@H]1COCCN1C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000121897870 1414297136 /nfs/dbraw/zinc/29/71/36/1414297136.db2.gz XHLJIMYTHQHKMU-SFHVURJKSA-N 0 0 397.431 3.027 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1)c1nccn1C ZINC000121910364 1414303807 /nfs/dbraw/zinc/30/38/07/1414303807.db2.gz AIAZCWWVEJHZRZ-GOSISDBHSA-N 0 0 380.404 3.165 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)cc([N+](=O)[O-])c1 ZINC000121924512 1414308753 /nfs/dbraw/zinc/30/87/53/1414308753.db2.gz BXGRYYUICRGRQJ-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN Nc1c(C(=O)NCc2cccc(COCC(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000121923321 1414308812 /nfs/dbraw/zinc/30/88/12/1414308812.db2.gz LYNIMVPKZBYPSB-UHFFFAOYSA-N 0 0 383.326 3.186 20 5 GGBDRN Nc1ccc(C(=O)NCc2cccc(COCC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000121924984 1414309508 /nfs/dbraw/zinc/30/95/08/1414309508.db2.gz GWKOOBFLYSDLGM-UHFFFAOYSA-N 0 0 383.326 3.186 20 5 GGBDRN Cc1cc(C(=O)Nc2nc(CN3C[C@H](C)O[C@@H](C)C3)cs2)cc([N+](=O)[O-])c1 ZINC000121928172 1414310785 /nfs/dbraw/zinc/31/07/85/1414310785.db2.gz VSTOZSNUXUKMCB-STQMWFEESA-N 0 0 390.465 3.221 20 5 GGBDRN COC(=O)c1cc(-c2csc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)n2)c[nH]1 ZINC000121934224 1414312909 /nfs/dbraw/zinc/31/29/09/1414312909.db2.gz HFFKRKVSCDNMBB-UHFFFAOYSA-N 0 0 386.389 3.394 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000121948880 1414319375 /nfs/dbraw/zinc/31/93/75/1414319375.db2.gz BBKWQHSDZXDKDB-UHFFFAOYSA-N 0 0 397.431 3.142 20 5 GGBDRN Cc1cc(C(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc([N+](=O)[O-])c1 ZINC000121950482 1414319501 /nfs/dbraw/zinc/31/95/01/1414319501.db2.gz BTXBFFXTUFJGNR-CYBMUJFWSA-N 0 0 376.434 3.140 20 5 GGBDRN CCn1cnnc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c1 ZINC000121956143 1414322766 /nfs/dbraw/zinc/32/27/66/1414322766.db2.gz GLAQGIHGKRCQTL-UHFFFAOYSA-N 0 0 396.363 3.342 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(C(=O)NC3CC3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000121959546 1414324101 /nfs/dbraw/zinc/32/41/01/1414324101.db2.gz FGAGBBZBXAAJAS-UHFFFAOYSA-N 0 0 398.375 3.264 20 5 GGBDRN COc1ccc(CCCN(C)c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])cc1 ZINC000121981211 1414330172 /nfs/dbraw/zinc/33/01/72/1414330172.db2.gz YIKUHSDUJJGOCL-UHFFFAOYSA-N 0 0 378.450 3.076 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCc2c(F)cc(F)cc2C1 ZINC000121981364 1414330622 /nfs/dbraw/zinc/33/06/22/1414330622.db2.gz VEFGJUKENKUWNT-UHFFFAOYSA-N 0 0 389.358 3.013 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000121999122 1414335578 /nfs/dbraw/zinc/33/55/78/1414335578.db2.gz OCMDAJRDZWSOPB-OAHLLOKOSA-N 0 0 389.452 3.148 20 5 GGBDRN C[C@]1(c2ccccc2)CN(CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000122002424 1414336571 /nfs/dbraw/zinc/33/65/71/1414336571.db2.gz NSWLGFVGOVFVNI-OAQYLSRUSA-N 0 0 397.431 3.140 20 5 GGBDRN CCCOc1cccc(CCNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000122019179 1414341014 /nfs/dbraw/zinc/34/10/14/1414341014.db2.gz FJEBJERGYXHZES-UHFFFAOYSA-N 0 0 399.447 3.298 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000122018097 1414341126 /nfs/dbraw/zinc/34/11/26/1414341126.db2.gz YALQEXDFYPYZPG-UHFFFAOYSA-N 0 0 394.353 3.434 20 5 GGBDRN CCCCOc1ncccc1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000122017033 1414341216 /nfs/dbraw/zinc/34/12/16/1414341216.db2.gz FGCLLSBCIJNMKJ-UHFFFAOYSA-N 0 0 379.438 3.184 20 5 GGBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000122024487 1414342677 /nfs/dbraw/zinc/34/26/77/1414342677.db2.gz UTXJJKVNFMXPLZ-UHFFFAOYSA-N 0 0 395.293 3.472 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NC1(c2ccc(F)cc2F)CCCCC1 ZINC000122027945 1414343156 /nfs/dbraw/zinc/34/31/56/1414343156.db2.gz CDVDJLIBZWWJRS-UHFFFAOYSA-N 0 0 378.379 3.435 20 5 GGBDRN CC(C)(C)OC(=O)NCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000177574511 1428800213 /nfs/dbraw/zinc/80/02/13/1428800213.db2.gz QTUNIFOYUCBXGL-UHFFFAOYSA-N 0 0 378.454 3.333 20 5 GGBDRN CCC(C)(C)[C@H]1CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000122043798 1414347806 /nfs/dbraw/zinc/34/78/06/1414347806.db2.gz JJLXKSLIOPGNMF-CQSZACIVSA-N 0 0 381.860 3.405 20 5 GGBDRN O=C(CCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)Nc1ccccc1 ZINC000122047231 1414348269 /nfs/dbraw/zinc/34/82/69/1414348269.db2.gz LHYDTIMHVPLHJJ-UHFFFAOYSA-N 0 0 382.420 3.298 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NC1(c2ccc(F)cc2F)CCCCC1 ZINC000122059245 1414351135 /nfs/dbraw/zinc/35/11/35/1414351135.db2.gz NGRHEEKDNFWXCS-UHFFFAOYSA-N 0 0 378.379 3.354 20 5 GGBDRN O=C(CN1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1)Nc1ccccc1 ZINC000122060193 1414351905 /nfs/dbraw/zinc/35/19/05/1414351905.db2.gz PKDFAPHGCOQXSH-UHFFFAOYSA-N 0 0 388.855 3.005 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc([N+](=O)[O-])c1 ZINC000122070999 1414355243 /nfs/dbraw/zinc/35/52/43/1414355243.db2.gz RRRVDNRQFJWDHN-AWEZNQCLSA-N 0 0 397.431 3.052 20 5 GGBDRN CCN(CC)[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])c1ccco1 ZINC000122074442 1414356001 /nfs/dbraw/zinc/35/60/01/1414356001.db2.gz AAGINONAXYOXTJ-AWEZNQCLSA-N 0 0 381.454 3.086 20 5 GGBDRN CCCCNC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000122083400 1414358701 /nfs/dbraw/zinc/35/87/01/1414358701.db2.gz VWAODAWGQWQMIV-UHFFFAOYSA-N 0 0 385.420 3.063 20 5 GGBDRN CC(=O)c1c(C)[nH]c(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1C ZINC000122092824 1414360734 /nfs/dbraw/zinc/36/07/34/1414360734.db2.gz UGCJCFSNDOJVLA-UHFFFAOYSA-N 0 0 381.392 3.489 20 5 GGBDRN Cc1c(C(=O)Nc2cccc(-c3nnco3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122106427 1414363562 /nfs/dbraw/zinc/36/35/62/1414363562.db2.gz QBKVHGWLKPDNEQ-UHFFFAOYSA-N 0 0 383.320 3.422 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc([N+](=O)[O-])c1 ZINC000122120647 1414367296 /nfs/dbraw/zinc/36/72/96/1414367296.db2.gz XZLRDKOQOHYIJN-GJZGRUSLSA-N 0 0 397.431 3.405 20 5 GGBDRN Cc1cc(C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)cc([N+](=O)[O-])c1 ZINC000122119896 1414367445 /nfs/dbraw/zinc/36/74/45/1414367445.db2.gz DPAAFMZWQJPKGU-UHFFFAOYSA-N 0 0 390.399 3.481 20 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ZINC000122214172 1414390574 /nfs/dbraw/zinc/39/05/74/1414390574.db2.gz QWEWBBCUEDDDBZ-UHFFFAOYSA-N 0 0 377.328 3.198 20 5 GGBDRN CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H](c1ccc(C)cc1)c1cccnc1 ZINC000122220345 1414392896 /nfs/dbraw/zinc/39/28/96/1414392896.db2.gz AQWLMXQGRVJAOI-GOSISDBHSA-N 0 0 379.420 3.283 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CCO1 ZINC000122249192 1414400688 /nfs/dbraw/zinc/40/06/88/1414400688.db2.gz ZFBRFBMIEINMLM-RDJZCZTQSA-N 0 0 391.468 3.250 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1cn(Cc2ccccc2)c2ccccc12 ZINC000122250113 1414401076 /nfs/dbraw/zinc/40/10/76/1414401076.db2.gz FFNXWUGINGHUPN-UHFFFAOYSA-N 0 0 389.415 3.224 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N(Cc1ccco1)c1ccccn1 ZINC000122263083 1414405321 /nfs/dbraw/zinc/40/53/21/1414405321.db2.gz NEVVPCBRIWZNBS-UHFFFAOYSA-N 0 0 377.353 3.117 20 5 GGBDRN CN(C(=O)COC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000122283286 1414411007 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Cc1c(NC(=O)C(=O)Nc2cccc(COCC3CC3)c2)cccc1[N+](=O)[O-] ZINC000122409244 1414450846 /nfs/dbraw/zinc/45/08/46/1414450846.db2.gz QOXNPZLPDCXHEZ-UHFFFAOYSA-N 0 0 383.404 3.407 20 5 GGBDRN Cc1c(C(=O)NCc2ccc(-n3cccn3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122415004 1414452202 /nfs/dbraw/zinc/45/22/02/1414452202.db2.gz DJABOFNHUTVXDK-UHFFFAOYSA-N 0 0 395.375 3.236 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(Br)c(Cl)c1 ZINC000122417957 1414452996 /nfs/dbraw/zinc/45/29/96/1414452996.db2.gz WIDVUBGOQZNMTQ-UHFFFAOYSA-N 0 0 388.605 3.373 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3cc(C)nc(C(C)C)n3)CC2)cc([N+](=O)[O-])c1 ZINC000122416478 1414453457 /nfs/dbraw/zinc/45/34/57/1414453457.db2.gz LCRYSAIOXFPDAJ-UHFFFAOYSA-N 0 0 383.452 3.087 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc([N+](=O)[O-])c1 ZINC000122422345 1414454793 /nfs/dbraw/zinc/45/47/93/1414454793.db2.gz IPSJNBDAFHHQLA-UHFFFAOYSA-N 0 0 382.420 3.330 20 5 GGBDRN O=C(NCc1ccco1)c1cccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 ZINC000122421700 1414455070 /nfs/dbraw/zinc/45/50/70/1414455070.db2.gz KVMADVQRHCYRKU-UHFFFAOYSA-N 0 0 397.362 3.187 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](C(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000122421635 1414455075 /nfs/dbraw/zinc/45/50/75/1414455075.db2.gz MSMPSEOCLDYDPJ-GFCCVEGCSA-N 0 0 383.832 3.231 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)c1 ZINC000122448197 1414463511 /nfs/dbraw/zinc/46/35/11/1414463511.db2.gz URTXZQGIRZCWLW-UHFFFAOYSA-N 0 0 381.432 3.200 20 5 GGBDRN Cc1cc(C(=O)N2CCCN(C(=O)c3ccccc3F)CC2)cc([N+](=O)[O-])c1 ZINC000122449655 1414463748 /nfs/dbraw/zinc/46/37/48/1414463748.db2.gz JLABUHNONVTKEW-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000122460470 1414467572 /nfs/dbraw/zinc/46/75/72/1414467572.db2.gz JRQPFEFTIYGDDS-HNNXBMFYSA-N 0 0 397.431 3.087 20 5 GGBDRN C[C@H](C(=O)NCCc1cccs1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000122460033 1414467643 /nfs/dbraw/zinc/46/76/43/1414467643.db2.gz CZYFAQFBTZZYSC-GFCCVEGCSA-N 0 0 381.885 3.489 20 5 GGBDRN Cc1cc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)ccc1OCC(F)(F)F ZINC000122465083 1414469586 /nfs/dbraw/zinc/46/95/86/1414469586.db2.gz DJYURPAGTABYPU-UHFFFAOYSA-N 0 0 386.330 3.415 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](Cc1ccccc1)c1ccccc1 ZINC000177614635 1428811040 /nfs/dbraw/zinc/81/10/40/1428811040.db2.gz WTOFMVUVSSUZBN-LJQANCHMSA-N 0 0 378.432 3.242 20 5 GGBDRN C[C@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H](O)Cc1ccccc1 ZINC000122479004 1414475299 /nfs/dbraw/zinc/47/52/99/1414475299.db2.gz CYSJBHLXQAGYBW-JXFKEZNVSA-N 0 0 385.464 3.209 20 5 GGBDRN C[C@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)[C@H](O)Cc1ccccc1 ZINC000122478597 1414475454 /nfs/dbraw/zinc/47/54/54/1414475454.db2.gz CYSJBHLXQAGYBW-OXJNMPFZSA-N 0 0 385.464 3.209 20 5 GGBDRN C[C@@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)[C@H](O)Cc1ccccc1 ZINC000122478818 1414475461 /nfs/dbraw/zinc/47/54/61/1414475461.db2.gz CYSJBHLXQAGYBW-OXQOHEQNSA-N 0 0 385.464 3.209 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2ccc(N3CCCC3)c(C)c2)ccc1[N+](=O)[O-] ZINC000177616639 1428811761 /nfs/dbraw/zinc/81/17/61/1428811761.db2.gz QAKUWMYVZMXOEB-UHFFFAOYSA-N 0 0 391.449 3.313 20 5 GGBDRN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000122506426 1414484687 /nfs/dbraw/zinc/48/46/87/1414484687.db2.gz NHFZEWKJVJGMBD-FZKQIMNGSA-N 0 0 385.376 3.401 20 5 GGBDRN CCc1ccccc1CNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000122514382 1414487577 /nfs/dbraw/zinc/48/75/77/1414487577.db2.gz OHVRRNFZAKVRRY-UHFFFAOYSA-N 0 0 397.460 3.367 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000122516200 1414487661 /nfs/dbraw/zinc/48/76/61/1414487661.db2.gz FHHRAARLDLBRJP-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN Cc1cc(C(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)cc([N+](=O)[O-])c1 ZINC000122529680 1414491241 /nfs/dbraw/zinc/49/12/41/1414491241.db2.gz CHQKJSGGUZXXGH-UHFFFAOYSA-N 0 0 382.420 3.330 20 5 GGBDRN Cc1cc(C(=O)N2CCC(NC(=O)NC3CCCCC3)CC2)cc([N+](=O)[O-])c1 ZINC000122529468 1414491667 /nfs/dbraw/zinc/49/16/67/1414491667.db2.gz JIZNWEBSDBOGEK-UHFFFAOYSA-N 0 0 388.468 3.140 20 5 GGBDRN CCc1ccccc1CNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000122545033 1414495716 /nfs/dbraw/zinc/49/57/16/1414495716.db2.gz FAZNIPLHFWUAMQ-UHFFFAOYSA-N 0 0 383.404 3.162 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122579638 1414506398 /nfs/dbraw/zinc/50/63/98/1414506398.db2.gz JDUIIGHCAAGDSI-IBGZPJMESA-N 0 0 394.431 3.194 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000122578159 1414506533 /nfs/dbraw/zinc/50/65/33/1414506533.db2.gz JTCBEZVPUWYBOE-UHFFFAOYSA-N 0 0 380.807 3.113 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(Cc1cccnc1)c1ccc(Cl)cc1 ZINC000122580803 1414507052 /nfs/dbraw/zinc/50/70/52/1414507052.db2.gz XGXBWTCPXIHRHY-UHFFFAOYSA-N 0 0 398.806 3.038 20 5 GGBDRN Cc1ccc(Oc2ccc(OCC(=O)NCCn3cc([N+](=O)[O-])cn3)cc2)cc1 ZINC000122581797 1414507597 /nfs/dbraw/zinc/50/75/97/1414507597.db2.gz LLRDCXKHVPWALA-UHFFFAOYSA-N 0 0 396.403 3.087 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCO[C@@H](c3ccc(F)c(C)c3)C2)cc1[N+](=O)[O-] ZINC000122583421 1414508322 /nfs/dbraw/zinc/50/83/22/1414508322.db2.gz UFESRHUFVWDFJF-GOSISDBHSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1ccc(C(=O)NCc2ccc(C(=O)Nc3ccncc3)cc2)cc1[N+](=O)[O-] ZINC000122587426 1414509802 /nfs/dbraw/zinc/50/98/02/1414509802.db2.gz XXOPWMWUWMWGRF-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc(CN3CCCC3=O)cc2)c1 ZINC000122593170 1414511370 /nfs/dbraw/zinc/51/13/70/1414511370.db2.gz DRDDDPIHPMCRNI-UHFFFAOYSA-N 0 0 397.431 3.433 20 5 GGBDRN Cn1ccnc1SCc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)o1 ZINC000122599461 1414512041 /nfs/dbraw/zinc/51/20/41/1414512041.db2.gz VTDDJIHHMXIBCU-UHFFFAOYSA-N 0 0 398.404 3.342 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccccc1COc1ccccc1 ZINC000122601581 1414512905 /nfs/dbraw/zinc/51/29/05/1414512905.db2.gz ZLJZOBGAIRUPGX-UHFFFAOYSA-N 0 0 381.392 3.192 20 5 GGBDRN CCOc1cc(C)ccc1NC(=O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000122604783 1414513703 /nfs/dbraw/zinc/51/37/03/1414513703.db2.gz AAHIIYYINVJNKF-UHFFFAOYSA-N 0 0 399.447 3.380 20 5 GGBDRN CCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 ZINC000122603537 1414513935 /nfs/dbraw/zinc/51/39/35/1414513935.db2.gz XVSGWKZQSLWSMD-UHFFFAOYSA-N 0 0 385.420 3.473 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CCC2 ZINC000122610923 1414516470 /nfs/dbraw/zinc/51/64/70/1414516470.db2.gz IJACAMMRPNGBNX-UHFFFAOYSA-N 0 0 381.432 3.161 20 5 GGBDRN CCOc1ccc(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000122614589 1414518095 /nfs/dbraw/zinc/51/80/95/1414518095.db2.gz FTDLKPCEXSKPLL-UHFFFAOYSA-N 0 0 399.447 3.380 20 5 GGBDRN C[C@@H](c1ccccc1)N1C[C@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC1=O ZINC000122618016 1414518679 /nfs/dbraw/zinc/51/86/79/1414518679.db2.gz DQMAWQOXIFHGKC-GXTWGEPZSA-N 0 0 393.403 3.019 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])n1 ZINC000122617223 1414519044 /nfs/dbraw/zinc/51/90/44/1414519044.db2.gz GYPUUJKRMSKBNC-MRXNPFEDSA-N 0 0 375.450 3.441 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(OC[C@H]2CCCO2)cc1 ZINC000122622135 1414520380 /nfs/dbraw/zinc/52/03/80/1414520380.db2.gz IKSVBWXMDMEPSM-OAHLLOKOSA-N 0 0 382.376 3.281 20 5 GGBDRN Cc1cc([C@H]2CN(S(=O)(=O)c3cccc([N+](=O)[O-])c3C)CCO2)ccc1F ZINC000122624944 1414521451 /nfs/dbraw/zinc/52/14/51/1414521451.db2.gz AXXKLAPSSOFBDB-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000122641354 1414526196 /nfs/dbraw/zinc/52/61/96/1414526196.db2.gz XIGRRRDPIZTMAV-TZMCWYRMSA-N 0 0 394.424 3.309 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](c2ccc(F)cc2)C[C@H]1C ZINC000122640897 1414526295 /nfs/dbraw/zinc/52/62/95/1414526295.db2.gz XIGRRRDPIZTMAV-OCCSQVGLSA-N 0 0 394.424 3.309 20 5 GGBDRN COCCc1ccc(OCCCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122641683 1414527061 /nfs/dbraw/zinc/52/70/61/1414527061.db2.gz GENAJVMYADQPLU-UHFFFAOYSA-N 0 0 398.419 3.458 20 5 GGBDRN CC[C@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000122645192 1414527664 /nfs/dbraw/zinc/52/76/64/1414527664.db2.gz UPDNTEBXGZBNJE-QGZVFWFLSA-N 0 0 395.459 3.463 20 5 GGBDRN C[C@@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1cccc(F)c1 ZINC000122643933 1414527697 /nfs/dbraw/zinc/52/76/97/1414527697.db2.gz PPNKDOIEABJBCF-HNNXBMFYSA-N 0 0 399.422 3.212 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1cccc(C)n1 ZINC000122643991 1414527785 /nfs/dbraw/zinc/52/77/85/1414527785.db2.gz OIHWSJZFJBNSLM-KRWDZBQOSA-N 0 0 375.450 3.386 20 5 GGBDRN COc1cccc2c1CC[C@@H]2NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000177627182 1428815524 /nfs/dbraw/zinc/81/55/24/1428815524.db2.gz GXQXTBCKRPJODZ-KRWDZBQOSA-N 0 0 396.447 3.123 20 5 GGBDRN O=Cc1ccc(OCC(=O)N(Cc2ccc(F)cc2F)C2CC2)c([N+](=O)[O-])c1 ZINC000122650607 1414528720 /nfs/dbraw/zinc/52/87/20/1414528720.db2.gz AIDQJLLXMVZXFW-UHFFFAOYSA-N 0 0 390.342 3.256 20 5 GGBDRN Cc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc23)c(Br)n1 ZINC000122650304 1414528920 /nfs/dbraw/zinc/52/89/20/1414528920.db2.gz IAGBOEVNIYVOEN-UHFFFAOYSA-N 0 0 376.170 3.189 20 5 GGBDRN CC[C@H](C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000122655552 1414530209 /nfs/dbraw/zinc/53/02/09/1414530209.db2.gz MCYLUWKOUXXWTG-IBGZPJMESA-N 0 0 381.432 3.073 20 5 GGBDRN CC[C@@H](C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000122655772 1414530389 /nfs/dbraw/zinc/53/03/89/1414530389.db2.gz MCYLUWKOUXXWTG-LJQANCHMSA-N 0 0 381.432 3.073 20 5 GGBDRN CN(CCOc1ccc(F)cc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000122654841 1414530441 /nfs/dbraw/zinc/53/04/41/1414530441.db2.gz CQBCMRTVQKUQCZ-UHFFFAOYSA-N 0 0 384.367 3.071 20 5 GGBDRN C[C@H]1C[C@H](c2ccc(F)cc2)CN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000122657303 1414530941 /nfs/dbraw/zinc/53/09/41/1414530941.db2.gz NKDUXKUKQVXFOL-BBRMVZONSA-N 0 0 378.425 3.442 20 5 GGBDRN CC[C@@H](CC1CCCC1)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122657186 1414531062 /nfs/dbraw/zinc/53/10/62/1414531062.db2.gz LBUZNTAJKJXMCE-KRWDZBQOSA-N 0 0 387.480 3.486 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N[C@@H](C)C[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000122656385 1414531153 /nfs/dbraw/zinc/53/11/53/1414531153.db2.gz HYJNLMRHEVPJBD-LRDDRELGSA-N 0 0 398.868 3.347 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000122667513 1414533583 /nfs/dbraw/zinc/53/35/83/1414533583.db2.gz YLGDIJKGNQITDQ-DGCLKSJQSA-N 0 0 382.388 3.440 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000122673631 1414535008 /nfs/dbraw/zinc/53/50/08/1414535008.db2.gz DJGFUWFHFZBJPP-UHFFFAOYSA-N 0 0 395.459 3.491 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000122677896 1414536545 /nfs/dbraw/zinc/53/65/45/1414536545.db2.gz AQRNZAONMNUYMT-ABAIWWIYSA-N 0 0 384.841 3.039 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)C2(c3ccccc3)CCC2)CC1 ZINC000122685612 1414537806 /nfs/dbraw/zinc/53/78/06/1414537806.db2.gz ANVPVSGVYYSPHC-UHFFFAOYSA-N 0 0 393.443 3.001 20 5 GGBDRN Cc1sc(S(=O)(=O)Oc2ccc3c(C)cc(=O)oc3c2)cc1[N+](=O)[O-] ZINC000122689516 1414539259 /nfs/dbraw/zinc/53/92/59/1414539259.db2.gz UWMXXUDZZARMIK-UHFFFAOYSA-N 0 0 381.387 3.147 20 5 GGBDRN COCCN(C(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Br)n1 ZINC000122691635 1414540101 /nfs/dbraw/zinc/54/01/01/1414540101.db2.gz YIDXROYWNOUPIC-UHFFFAOYSA-N 0 0 380.198 3.046 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)n1 ZINC000122697185 1414541137 /nfs/dbraw/zinc/54/11/37/1414541137.db2.gz XTKZZNWEXWPNMB-KRWDZBQOSA-N 0 0 375.450 3.441 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)n1 ZINC000122697433 1414541259 /nfs/dbraw/zinc/54/12/59/1414541259.db2.gz XTKZZNWEXWPNMB-QGZVFWFLSA-N 0 0 375.450 3.441 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000122705094 1414543595 /nfs/dbraw/zinc/54/35/95/1414543595.db2.gz QOZKZLXBBYVSGD-UHFFFAOYSA-N 0 0 396.325 3.498 20 5 GGBDRN O=C(N[C@H](C1CCCC1)C(F)(F)F)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000177629901 1428816683 /nfs/dbraw/zinc/81/66/83/1428816683.db2.gz CNSYAIZMJHOKNY-CQSZACIVSA-N 0 0 383.330 3.026 20 5 GGBDRN COCCCOC1CCN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000122712899 1414545420 /nfs/dbraw/zinc/54/54/20/1414545420.db2.gz XGWLBZNCJRBJTF-CYBMUJFWSA-N 0 0 399.875 3.093 20 5 GGBDRN C[C@H](C[C@H](O)c1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000122715442 1414546452 /nfs/dbraw/zinc/54/64/52/1414546452.db2.gz WHUSTHQWRNLMQF-ABAIWWIYSA-N 0 0 384.841 3.039 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@H]1CCC[C@@H](O)C1 ZINC000122715791 1414547081 /nfs/dbraw/zinc/54/70/81/1414547081.db2.gz LUTPTAUDDPUNSV-WCQYABFASA-N 0 0 389.374 3.083 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000122715846 1414547146 /nfs/dbraw/zinc/54/71/46/1414547146.db2.gz WHUSTHQWRNLMQF-IAQYHMDHSA-N 0 0 384.841 3.039 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000122718043 1414547179 /nfs/dbraw/zinc/54/71/79/1414547179.db2.gz QNFXAXXGZSYIEC-NHYWBVRUSA-N 0 0 384.841 3.039 20 5 GGBDRN CCCC[C@@H](CC)CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122719273 1414547966 /nfs/dbraw/zinc/54/79/66/1414547966.db2.gz JFEIEVCDOSGFGU-MRXNPFEDSA-N 0 0 375.469 3.486 20 5 GGBDRN CC(=O)c1cccc(OCCCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000122718662 1414547974 /nfs/dbraw/zinc/54/79/74/1414547974.db2.gz HVGUESHYAMNUII-UHFFFAOYSA-N 0 0 382.376 3.471 20 5 GGBDRN Cc1c(C(=O)N2CCC(OC3CCCC3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000122718231 1414547990 /nfs/dbraw/zinc/54/79/90/1414547990.db2.gz JTFVQNVDOBIYPZ-UHFFFAOYSA-N 0 0 377.397 3.375 20 5 GGBDRN COc1ccc(CCCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c(OC)c1 ZINC000122720860 1414548328 /nfs/dbraw/zinc/54/83/28/1414548328.db2.gz FVSFOIVMJFQAAK-UHFFFAOYSA-N 0 0 384.392 3.450 20 5 GGBDRN COc1cc2c(cc1OC)CN(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)CC2 ZINC000122723921 1414549465 /nfs/dbraw/zinc/54/94/65/1414549465.db2.gz UCGAHUPVSOTEPV-UHFFFAOYSA-N 0 0 395.415 3.221 20 5 GGBDRN CCc1noc(CC)c1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000122728369 1414550919 /nfs/dbraw/zinc/55/09/19/1414550919.db2.gz QNFRKLSGDAWUOC-UHFFFAOYSA-N 0 0 376.369 3.163 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000122733730 1414552326 /nfs/dbraw/zinc/55/23/26/1414552326.db2.gz AIWBKRAUHBKLJC-FUHWJXTLSA-N 0 0 388.395 3.471 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000122737053 1414552802 /nfs/dbraw/zinc/55/28/02/1414552802.db2.gz OBASVPZOEMGHIB-ZDUSSCGKSA-N 0 0 375.425 3.131 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccnc(N2CCCCC2)c1 ZINC000122740337 1414553148 /nfs/dbraw/zinc/55/31/48/1414553148.db2.gz XQMRAIUKPFANQA-UHFFFAOYSA-N 0 0 385.424 3.310 20 5 GGBDRN CCOc1cn(-c2ccccc2)nc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122746540 1414555245 /nfs/dbraw/zinc/55/52/45/1414555245.db2.gz OBWWKCCPUJAELS-UHFFFAOYSA-N 0 0 392.375 3.308 20 5 GGBDRN COCCN(CC(F)(F)F)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122745876 1414555381 /nfs/dbraw/zinc/55/53/81/1414555381.db2.gz AVUJBWHRKQLUEH-UHFFFAOYSA-N 0 0 389.355 3.369 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cccc(Oc2cnccn2)c1 ZINC000122751855 1414556432 /nfs/dbraw/zinc/55/64/32/1414556432.db2.gz QRADUDNHAGJSRW-UHFFFAOYSA-N 0 0 376.332 3.306 20 5 GGBDRN CC(C)OCc1cccc(N[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000122759877 1414558444 /nfs/dbraw/zinc/55/84/44/1414558444.db2.gz BDECKJSAMZBOFF-GOSISDBHSA-N 0 0 383.404 3.264 20 5 GGBDRN O=C(CCc1nc(-c2ccsc2)no1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122771459 1414560587 /nfs/dbraw/zinc/56/05/87/1414560587.db2.gz IGSVHEXBMZUKNE-UHFFFAOYSA-N 0 0 384.377 3.154 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000122771754 1414560616 /nfs/dbraw/zinc/56/06/16/1414560616.db2.gz SKVHKUWPWNKBEN-GOSISDBHSA-N 0 0 388.786 3.490 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2OC)o1 ZINC000122776573 1414561843 /nfs/dbraw/zinc/56/18/43/1414561843.db2.gz CNEFZKGTOZLJSF-HNNXBMFYSA-N 0 0 375.381 3.364 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccccc1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000122777362 1414561887 /nfs/dbraw/zinc/56/18/87/1414561887.db2.gz LAEAAWQKDRSQFT-XHDPSFHLSA-N 0 0 384.841 3.039 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000122784095 1414564459 /nfs/dbraw/zinc/56/44/59/1414564459.db2.gz RVZPNKSOOZDMPM-CQSZACIVSA-N 0 0 392.843 3.152 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)c1cccc(N2CCCC2)c1 ZINC000122789022 1414565056 /nfs/dbraw/zinc/56/50/56/1414565056.db2.gz OFQQTNKYHIPXKJ-OAHLLOKOSA-N 0 0 396.447 3.319 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000122792639 1414566168 /nfs/dbraw/zinc/56/61/68/1414566168.db2.gz GHUWTJUBPCNGMI-OAHLLOKOSA-N 0 0 396.447 3.319 20 5 GGBDRN COc1cccc(-c2nc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c(C)[nH]2)c1 ZINC000122798446 1414567514 /nfs/dbraw/zinc/56/75/14/1414567514.db2.gz HTNJMPQODIAPBI-UHFFFAOYSA-N 0 0 392.375 3.431 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122804982 1414569261 /nfs/dbraw/zinc/56/92/61/1414569261.db2.gz REKCUFAYUMNCAR-VIFPVBQESA-N 0 0 387.377 3.499 20 5 GGBDRN Cc1c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cnn1-c1ccc(F)cc1F ZINC000122808247 1414569802 /nfs/dbraw/zinc/56/98/02/1414569802.db2.gz YGKYWCUJDSQEHX-UHFFFAOYSA-N 0 0 398.329 3.496 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCCN(C)c3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000122808130 1414569900 /nfs/dbraw/zinc/56/99/00/1414569900.db2.gz IDCFHXHRHKOQFZ-UHFFFAOYSA-N 0 0 388.355 3.437 20 5 GGBDRN CN(C)c1ccc(Cl)cc1NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000122814860 1414571665 /nfs/dbraw/zinc/57/16/65/1414571665.db2.gz FFBNWFZONQYMJR-UHFFFAOYSA-N 0 0 377.784 3.144 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Cc1ccccc1[C@@H](OC[C@H](O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000123343117 1414700834 /nfs/dbraw/zinc/70/08/34/1414700834.db2.gz ZGVRKFUYDOTNBP-KNQAVFIVSA-N 0 0 394.427 3.232 20 5 GGBDRN COc1cc(C(=O)Nc2ccnn2CCc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000123343517 1414701226 /nfs/dbraw/zinc/70/12/26/1414701226.db2.gz SNWJTLXWCDRHPS-UHFFFAOYSA-N 0 0 396.403 3.304 20 5 GGBDRN CCCS(=O)(=O)c1ccccc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000123346161 1414702774 /nfs/dbraw/zinc/70/27/74/1414702774.db2.gz XQGGCOVCMRFSTG-UHFFFAOYSA-N 0 0 384.360 3.309 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000123356884 1414705484 /nfs/dbraw/zinc/70/54/84/1414705484.db2.gz JJVGTHNOADKNBL-IAQYHMDHSA-N 0 0 388.342 3.223 20 5 GGBDRN Cc1cc(=O)n(C[C@H](O)Cn2c3ccccc3c3ccccc32)cc1[N+](=O)[O-] ZINC000123386198 1414711950 /nfs/dbraw/zinc/71/19/50/1414711950.db2.gz OGNOERCTRYXELZ-HNNXBMFYSA-N 0 0 377.400 3.234 20 5 GGBDRN CC[C@H](C)NC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SCC(C)C ZINC000123385239 1414712119 /nfs/dbraw/zinc/71/21/19/1414712119.db2.gz BNOOYDQTKDIUKO-STQMWFEESA-N 0 0 381.498 3.376 20 5 GGBDRN Cc1cc(=O)n(C[C@@H](O)COc2ccc(Oc3ccccc3)cc2)cc1[N+](=O)[O-] ZINC000123389877 1414713190 /nfs/dbraw/zinc/71/31/90/1414713190.db2.gz KQCBYKHZXPEWJC-MRXNPFEDSA-N 0 0 396.399 3.297 20 5 GGBDRN Cc1cccc(N2CCN(C(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)CC2)c1 ZINC000123429869 1414728476 /nfs/dbraw/zinc/72/84/76/1414728476.db2.gz NVBYIFGSSGWJFG-UHFFFAOYSA-N 0 0 391.431 3.051 20 5 GGBDRN C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)Cn3cc([N+](=O)[O-])ccc3=O)c2)C1 ZINC000123429045 1414728655 /nfs/dbraw/zinc/72/86/55/1414728655.db2.gz QWSIJRCUIDGBAG-BEFAXECRSA-N 0 0 399.447 3.491 20 5 GGBDRN Cc1c(CC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)cccc1[N+](=O)[O-] ZINC000123480576 1414747173 /nfs/dbraw/zinc/74/71/73/1414747173.db2.gz KNDZQRPXKDTIAU-IBGZPJMESA-N 0 0 381.432 3.100 20 5 GGBDRN O=C(Nc1ccnn1C[C@@H]1CCOC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000123483498 1414747984 /nfs/dbraw/zinc/74/79/84/1414747984.db2.gz GAXNUAJCGGKEMX-LBPRGKRZSA-N 0 0 399.432 3.204 20 5 GGBDRN O=C(Nc1ccnn1C[C@H]1CCOC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000123483759 1414748610 /nfs/dbraw/zinc/74/86/10/1414748610.db2.gz GAXNUAJCGGKEMX-GFCCVEGCSA-N 0 0 399.432 3.204 20 5 GGBDRN O=C(Nc1cccc(OC(F)F)c1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000123492245 1414751101 /nfs/dbraw/zinc/75/11/01/1414751101.db2.gz SHGGWMSCDXIXOR-UHFFFAOYSA-N 0 0 385.710 3.427 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(CN2CCCCC2=O)CC1 ZINC000177684418 1428833454 /nfs/dbraw/zinc/83/34/54/1428833454.db2.gz ZHLZTCJYOUTYQV-UHFFFAOYSA-N 0 0 375.469 3.218 20 5 GGBDRN CCO[C@H]1C[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1(CC)CC ZINC000177692913 1428834975 /nfs/dbraw/zinc/83/49/75/1428834975.db2.gz QTSGUKCRHACSEG-IRXDYDNUSA-N 0 0 387.436 3.150 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@@H]3C(C)(C)O)cc2[N+](=O)[O-])C1 ZINC000123543333 1414769529 /nfs/dbraw/zinc/76/95/29/1414769529.db2.gz BTVKLXALUDBSBG-SPYBWZPUSA-N 0 0 389.496 3.453 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)Nc1cccc(OCCF)c1 ZINC000123552902 1414772294 /nfs/dbraw/zinc/77/22/94/1414772294.db2.gz NZYWGIDBFGDZBZ-UHFFFAOYSA-N 0 0 375.356 3.137 20 5 GGBDRN O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000123555946 1414773111 /nfs/dbraw/zinc/77/31/11/1414773111.db2.gz RGGXMWNHFZZITO-HBMCJLEFSA-N 0 0 392.459 3.012 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCCN(CC(F)(F)F)CC1 ZINC000123560800 1414774973 /nfs/dbraw/zinc/77/49/73/1414774973.db2.gz MWOVSCCAAYWQBF-UHFFFAOYSA-N 0 0 380.754 3.350 20 5 GGBDRN C[C@]1(CNC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CCCO1 ZINC000123563920 1414775892 /nfs/dbraw/zinc/77/58/92/1414775892.db2.gz XTEYZGQEVGZIGB-MRXNPFEDSA-N 0 0 399.234 3.386 20 5 GGBDRN CN(Cc1ccccc1)c1ccccc1NC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000123577918 1414780710 /nfs/dbraw/zinc/78/07/10/1414780710.db2.gz CWYZGLALYJFWIY-UHFFFAOYSA-N 0 0 394.435 3.249 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000123579181 1414781877 /nfs/dbraw/zinc/78/18/77/1414781877.db2.gz DYRSIYTULGDYCE-MAUKXSAKSA-N 0 0 388.395 3.471 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(NCCC(=O)N2CCCCCC2)cc1Cl ZINC000123595563 1414788134 /nfs/dbraw/zinc/78/81/34/1414788134.db2.gz TWJIXGAGSOLXIO-UHFFFAOYSA-N 0 0 383.832 3.239 20 5 GGBDRN CC[C@@H](C)n1ncc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c1C1CC1 ZINC000123598435 1414788852 /nfs/dbraw/zinc/78/88/52/1414788852.db2.gz FRMIYTYTCXEZPZ-GFCCVEGCSA-N 0 0 386.408 3.435 20 5 GGBDRN C[C@@]1(c2ccccc2)CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCO1 ZINC000177700001 1428836945 /nfs/dbraw/zinc/83/69/45/1428836945.db2.gz YYNMZWOWFUZHFO-NRFANRHFSA-N 0 0 392.415 3.168 20 5 GGBDRN Cc1cnn(-c2ccc(NCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)cc2F)c1 ZINC000123604608 1414792573 /nfs/dbraw/zinc/79/25/73/1414792573.db2.gz IIPYIAIZPBYDTL-UHFFFAOYSA-N 0 0 395.394 3.229 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000123607077 1414793255 /nfs/dbraw/zinc/79/32/55/1414793255.db2.gz RAHFMVVVPOPSRX-UHFFFAOYSA-N 0 0 377.441 3.375 20 5 GGBDRN C[C@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CC1(C)OCCO1 ZINC000123632556 1414801265 /nfs/dbraw/zinc/80/12/65/1414801265.db2.gz BBFCXLNZGSXLRY-AWEZNQCLSA-N 0 0 377.441 3.058 20 5 GGBDRN O=C(NCCc1cc2ccccc2o1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000123641386 1414802598 /nfs/dbraw/zinc/80/25/98/1414802598.db2.gz CKURHKGCSKMKBU-UHFFFAOYSA-N 0 0 376.372 3.499 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)Oc1ccc(Br)cc1 ZINC000123646179 1414803178 /nfs/dbraw/zinc/80/31/78/1414803178.db2.gz ALIHOEZZXPKUKH-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1OC ZINC000123653293 1414804219 /nfs/dbraw/zinc/80/42/19/1414804219.db2.gz QDCHZUQPBJVKTG-LBPRGKRZSA-N 0 0 376.384 3.360 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN(C[C@@H]3CCCO3)[C@@H]3CCSC3)n2)cc1 ZINC000123654155 1414804286 /nfs/dbraw/zinc/80/42/86/1414804286.db2.gz MZEAATCVDRRUFV-CVEARBPZSA-N 0 0 390.465 3.131 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1OC ZINC000123653483 1414804424 /nfs/dbraw/zinc/80/44/24/1414804424.db2.gz QDCHZUQPBJVKTG-GFCCVEGCSA-N 0 0 376.384 3.360 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN(C[C@@H]3CCCO3)[C@@H]3CCSC3)o2)cc1 ZINC000123662786 1414805532 /nfs/dbraw/zinc/80/55/32/1414805532.db2.gz JTRTYWHADSAYAF-CVEARBPZSA-N 0 0 390.465 3.131 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC[C@H]2[C@H](O)C(F)(F)F)ccc1Br ZINC000123683251 1414809341 /nfs/dbraw/zinc/80/93/41/1414809341.db2.gz VSGDFGOBOAIFLH-JQWIXIFHSA-N 0 0 383.164 3.245 20 5 GGBDRN CCn1c(S[C@H](C)C(=O)NC(C)(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123687847 1414809812 /nfs/dbraw/zinc/80/98/12/1414809812.db2.gz FVNBRJBBSAKJLD-LLVKDONJSA-N 0 0 377.470 3.269 20 5 GGBDRN CCn1c(SCC(=O)NC2CCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123693031 1414811248 /nfs/dbraw/zinc/81/12/48/1414811248.db2.gz OPCKEEIKTNRRML-UHFFFAOYSA-N 0 0 375.454 3.024 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc(OCc2ccccc2F)cc1 ZINC000123699310 1414811889 /nfs/dbraw/zinc/81/18/89/1414811889.db2.gz SNHCVLWSKWYHPL-UHFFFAOYSA-N 0 0 397.362 3.113 20 5 GGBDRN C[C@H](CCO)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000123719059 1414814963 /nfs/dbraw/zinc/81/49/63/1414814963.db2.gz OBWPUANZPGXBFR-LLVKDONJSA-N 0 0 391.811 3.001 20 5 GGBDRN COc1c(C)cnc(CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1C ZINC000123723787 1414815705 /nfs/dbraw/zinc/81/57/05/1414815705.db2.gz BPNNMVIMOINZKL-UHFFFAOYSA-N 0 0 388.380 3.070 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000123749714 1414819833 /nfs/dbraw/zinc/81/98/33/1414819833.db2.gz ZYHHPAGWQPUMKT-IEBWSBKVSA-N 0 0 388.395 3.227 20 5 GGBDRN Cn1cc(S(=O)(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])nc1Cl ZINC000123757191 1414820589 /nfs/dbraw/zinc/82/05/89/1414820589.db2.gz MFGRYTDQYXFSSC-UHFFFAOYSA-N 0 0 393.808 3.416 20 5 GGBDRN COc1ccc([C@@H](CCO)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000123763171 1414821319 /nfs/dbraw/zinc/82/13/19/1414821319.db2.gz OUEYCGAJMBTKBE-GOSISDBHSA-N 0 0 399.447 3.057 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1OS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123766117 1414821772 /nfs/dbraw/zinc/82/17/72/1414821772.db2.gz KOHSBTIHLIPIID-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN Cc1cc(OCc2ccccc2)ccc1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000123827450 1414830101 /nfs/dbraw/zinc/83/01/01/1414830101.db2.gz KMKAGQFZQZPPGZ-UHFFFAOYSA-N 0 0 393.399 3.283 20 5 GGBDRN CC(C)(O)[C@H]1CCCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000123830440 1414831067 /nfs/dbraw/zinc/83/10/67/1414831067.db2.gz YXPDGXPGSLMERP-CQSZACIVSA-N 0 0 389.374 3.178 20 5 GGBDRN CC(C)(O)[C@@H]1CCCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000123830193 1414831070 /nfs/dbraw/zinc/83/10/70/1414831070.db2.gz YXPDGXPGSLMERP-AWEZNQCLSA-N 0 0 389.374 3.178 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[C@H](O)c2ccc(F)cc2)cc1C ZINC000123845215 1414833779 /nfs/dbraw/zinc/83/37/79/1414833779.db2.gz HNTHZILSRGGZGP-GUYCJALGSA-N 0 0 396.440 3.141 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(-c1csc([N+](=O)[O-])c1)n2C ZINC000123851259 1414834941 /nfs/dbraw/zinc/83/49/41/1414834941.db2.gz PGXXVAHMLSJICD-UHFFFAOYSA-N 0 0 394.478 3.241 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OS(=O)(=O)Cc1cc(Cl)ccc1F ZINC000123867274 1414838457 /nfs/dbraw/zinc/83/84/57/1414838457.db2.gz TVKQJAUBJUXRHQ-UHFFFAOYSA-N 0 0 375.761 3.305 20 5 GGBDRN Cc1ccc(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)cc1[N+](=O)[O-] ZINC000123912947 1414848528 /nfs/dbraw/zinc/84/85/28/1414848528.db2.gz HBYUTKDPSUIAOO-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN Cc1cc(OCc2nnc(C(=O)NCc3ccccc3)s2)ccc1[N+](=O)[O-] ZINC000123938945 1414853869 /nfs/dbraw/zinc/85/38/69/1414853869.db2.gz NTQVOWYXRIPSCS-UHFFFAOYSA-N 0 0 384.417 3.264 20 5 GGBDRN CC(C)(NC(=O)N[C@@H]1CCN(C2CCCCC2)C1=O)c1ccc([N+](=O)[O-])cc1 ZINC000123942463 1414854407 /nfs/dbraw/zinc/85/44/07/1414854407.db2.gz LNNIOAMKAWBNFG-QGZVFWFLSA-N 0 0 388.468 3.063 20 5 GGBDRN CCc1nc(CN2CCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)no1 ZINC000123950282 1414855956 /nfs/dbraw/zinc/85/59/56/1414855956.db2.gz JHMDXHIGFGJPGO-UHFFFAOYSA-N 0 0 397.435 3.118 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cn(Cc2cccc(F)c2)nn1 ZINC000123980232 1414861928 /nfs/dbraw/zinc/86/19/28/1414861928.db2.gz TXHZXSYJWXZUOT-UHFFFAOYSA-N 0 0 397.410 3.425 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000177725921 1428843304 /nfs/dbraw/zinc/84/33/04/1428843304.db2.gz PYBDIYJDVUWWPS-PWFNWSNSSA-N 0 0 389.477 3.272 20 5 GGBDRN O=C1NC2(CCCCCCC2)C(=O)N1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000123992339 1414864557 /nfs/dbraw/zinc/86/45/57/1414864557.db2.gz HDFUMWFUMPPQAA-UHFFFAOYSA-N 0 0 399.407 3.180 20 5 GGBDRN O=C(N[C@H]1CCO[C@]2(CCSC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000123998730 1414866395 /nfs/dbraw/zinc/86/63/95/1414866395.db2.gz HKFSCBOVQWMURO-HNAYVOBHSA-N 0 0 391.493 3.324 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCCC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000124004889 1414867495 /nfs/dbraw/zinc/86/74/95/1414867495.db2.gz HBTRGIIGXRYHTL-IEBWSBKVSA-N 0 0 386.452 3.076 20 5 GGBDRN CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000124026859 1414871907 /nfs/dbraw/zinc/87/19/07/1414871907.db2.gz LDMRSDNUBACVCS-KRWDZBQOSA-N 0 0 383.404 3.237 20 5 GGBDRN CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000124026642 1414871920 /nfs/dbraw/zinc/87/19/20/1414871920.db2.gz LDMRSDNUBACVCS-QGZVFWFLSA-N 0 0 383.404 3.237 20 5 GGBDRN COc1ccc([C@H](CCO)NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000124032815 1414873157 /nfs/dbraw/zinc/87/31/57/1414873157.db2.gz BDFBXSLHZWXFNR-INIZCTEOSA-N 0 0 398.337 3.476 20 5 GGBDRN CCCNC(=O)[C@H]1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000124086330 1414882460 /nfs/dbraw/zinc/88/24/60/1414882460.db2.gz NNIMEAOHKBMODT-HNNXBMFYSA-N 0 0 375.469 3.271 20 5 GGBDRN 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GGBDRN CCCCn1nccc1NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000124694000 1415023152 /nfs/dbraw/zinc/02/31/52/1415023152.db2.gz OGLNZRLYKXVJMY-UHFFFAOYSA-N 0 0 378.454 3.472 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccn3)n2C)cccc1[N+](=O)[O-] ZINC000124693292 1415023360 /nfs/dbraw/zinc/02/33/60/1415023360.db2.gz ZCWRSIWJOBCGRQ-GFCCVEGCSA-N 0 0 398.448 3.213 20 5 GGBDRN CCN(C[C@@H](O)c1ccc(C)cc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000124696267 1415023900 /nfs/dbraw/zinc/02/39/00/1415023900.db2.gz URIJIGMHLHCXQO-MRXNPFEDSA-N 0 0 398.868 3.301 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(Cc1cccc(O)c1)CC1CC1 ZINC000124710076 1415026699 /nfs/dbraw/zinc/02/66/99/1415026699.db2.gz FLXHBFIBMNKLNW-UHFFFAOYSA-N 0 0 397.431 3.295 20 5 GGBDRN O=C(NCc1nc(C2CC2)cs1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000124723493 1415029705 /nfs/dbraw/zinc/02/97/05/1415029705.db2.gz QDQVXIUGJPKNTK-UHFFFAOYSA-N 0 0 386.477 3.462 20 5 GGBDRN C[C@@H](CC(=O)OC[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000124753452 1415036821 /nfs/dbraw/zinc/03/68/21/1415036821.db2.gz VBSZJWUGARMPOG-DOTOQJQBSA-N 0 0 397.431 3.331 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000124769039 1415040263 /nfs/dbraw/zinc/04/02/63/1415040263.db2.gz FNGFZTDVVBIZHR-AWEZNQCLSA-N 0 0 396.378 3.488 20 5 GGBDRN Cc1nn(C)c(OCC(F)(F)F)c1CN1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000124780077 1415042416 /nfs/dbraw/zinc/04/24/16/1415042416.db2.gz WTUSQFBPMUBIGO-UHFFFAOYSA-N 0 0 384.358 3.136 20 5 GGBDRN CCOC(=O)C1CCC(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000124786951 1415043878 /nfs/dbraw/zinc/04/38/78/1415043878.db2.gz CPSSHHPWBNFQCA-UHFFFAOYSA-N 0 0 375.425 3.021 20 5 GGBDRN CCc1ccc(S(C)(=O)=O)cc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000124793129 1415044956 /nfs/dbraw/zinc/04/49/56/1415044956.db2.gz DOAUQCXCSHSARM-UHFFFAOYSA-N 0 0 382.825 3.466 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C1(NC(=O)OC(C)(C)C)CC1 ZINC000177800737 1428860886 /nfs/dbraw/zinc/86/08/86/1428860886.db2.gz VVAWOTXYZGQSDS-UHFFFAOYSA-N 0 0 383.832 3.264 20 5 GGBDRN Cc1c(CC(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000124807656 1415049351 /nfs/dbraw/zinc/04/93/51/1415049351.db2.gz USPBDSHFNUQBLU-UHFFFAOYSA-N 0 0 391.468 3.398 20 5 GGBDRN CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000124810144 1415050054 /nfs/dbraw/zinc/05/00/54/1415050054.db2.gz DZAYEPOQBRDCGJ-ZDUSSCGKSA-N 0 0 381.404 3.253 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000124815327 1415050939 /nfs/dbraw/zinc/05/09/39/1415050939.db2.gz CLIOYJMMONDSTE-INIZCTEOSA-N 0 0 386.379 3.377 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)[C@@H]2CCCc3sccc32)CC1 ZINC000124817381 1415051428 /nfs/dbraw/zinc/05/14/28/1415051428.db2.gz FDLFVUGAYUGENV-QGZVFWFLSA-N 0 0 399.472 3.061 20 5 GGBDRN Cc1nn(CCC(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)c(C)c1[N+](=O)[O-] ZINC000124833721 1415055234 /nfs/dbraw/zinc/05/52/34/1415055234.db2.gz GGTJCELMSVKLQY-INIZCTEOSA-N 0 0 392.843 3.132 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1CC(F)(F)F ZINC000124844683 1415057487 /nfs/dbraw/zinc/05/74/87/1415057487.db2.gz BRGHWRHCWNSMEG-VIFPVBQESA-N 0 0 399.291 3.322 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1CC(F)(F)F ZINC000124844469 1415057501 /nfs/dbraw/zinc/05/75/01/1415057501.db2.gz BRGHWRHCWNSMEG-SECBINFHSA-N 0 0 399.291 3.322 20 5 GGBDRN CC[C@@H](NC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000177804042 1428861882 /nfs/dbraw/zinc/86/18/82/1428861882.db2.gz PLEGRGSJDJKAHG-SJLPKXTDSA-N 0 0 388.468 3.090 20 5 GGBDRN NC(=O)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000177809522 1428862427 /nfs/dbraw/zinc/86/24/27/1428862427.db2.gz XKBVTILPJORPFI-HOTGVXAUSA-N 0 0 382.420 3.112 20 5 GGBDRN NC(=O)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000177809536 1428862696 /nfs/dbraw/zinc/86/26/96/1428862696.db2.gz XKBVTILPJORPFI-HZPDHXFCSA-N 0 0 382.420 3.112 20 5 GGBDRN Cc1nccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1Cl ZINC000124918284 1415072914 /nfs/dbraw/zinc/07/29/14/1415072914.db2.gz IMOSZKJFMZNTMI-LLVKDONJSA-N 0 0 394.840 3.256 20 5 GGBDRN Cc1nn(C)c(C)c1CC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000124929434 1415075068 /nfs/dbraw/zinc/07/50/68/1415075068.db2.gz SLHMNGMGXVRMFE-UHFFFAOYSA-N 0 0 392.415 3.357 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc(N2CCCNC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000177784715 1428857907 /nfs/dbraw/zinc/85/79/07/1428857907.db2.gz RLGPEDWHESWRLV-GOSISDBHSA-N 0 0 382.420 3.396 20 5 GGBDRN CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000124945893 1415078209 /nfs/dbraw/zinc/07/82/09/1415078209.db2.gz AGBOQRGAXSMVLW-KRWDZBQOSA-N 0 0 389.358 3.348 20 5 GGBDRN CC(=O)N1CCc2ccccc2[C@H]1CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000124946110 1415078260 /nfs/dbraw/zinc/07/82/60/1415078260.db2.gz AGBOQRGAXSMVLW-QGZVFWFLSA-N 0 0 389.358 3.348 20 5 GGBDRN CCOc1ccc(NC(=O)CNc2cc(F)c(OC)cc2F)c([N+](=O)[O-])c1 ZINC000124949615 1415079485 /nfs/dbraw/zinc/07/94/85/1415079485.db2.gz NLUZETIGFBQWFV-UHFFFAOYSA-N 0 0 381.335 3.331 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@]12CCC(=O)N1c1ccccc1S2 ZINC000124951417 1415079930 /nfs/dbraw/zinc/07/99/30/1415079930.db2.gz RYPABFTXDQSFOK-KRWDZBQOSA-N 0 0 391.355 3.441 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)C(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000124954274 1415080597 /nfs/dbraw/zinc/08/05/97/1415080597.db2.gz PVOZEECABWIWFN-GFCCVEGCSA-N 0 0 375.400 3.276 20 5 GGBDRN CC(C)n1nc(-c2ccccc2)cc1NC(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000124959518 1415081578 /nfs/dbraw/zinc/08/15/78/1415081578.db2.gz DUYUJAVVLKXJCI-UHFFFAOYSA-N 0 0 383.412 3.057 20 5 GGBDRN Cc1cnn(-c2ccc(S(=O)(=O)Oc3ccc(F)cc3[N+](=O)[O-])cc2F)c1 ZINC000124969551 1415083609 /nfs/dbraw/zinc/08/36/09/1415083609.db2.gz FRZOLCFHZIKMBT-UHFFFAOYSA-N 0 0 395.343 3.135 20 5 GGBDRN CCC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000124972134 1415083910 /nfs/dbraw/zinc/08/39/10/1415083910.db2.gz PGXPHIDQXYWEHM-LBPRGKRZSA-N 0 0 395.437 3.048 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H]1CCCc2occc21 ZINC000124979463 1415085503 /nfs/dbraw/zinc/08/55/03/1415085503.db2.gz IWHMVBBGBPBNFQ-CQSZACIVSA-N 0 0 385.376 3.070 20 5 GGBDRN Cc1c(CC(=O)Nc2cc(-n3nnnc3C3CC3)ccc2F)cccc1[N+](=O)[O-] ZINC000124980353 1415085758 /nfs/dbraw/zinc/08/57/58/1415085758.db2.gz WYYNTFBVKFBKHJ-UHFFFAOYSA-N 0 0 396.382 3.077 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(NC(=O)C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000124991454 1415087770 /nfs/dbraw/zinc/08/77/70/1415087770.db2.gz BHNTWFWQQSPSID-UHFFFAOYSA-N 0 0 381.310 3.334 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1ccc(NC(=O)C(F)(F)F)cc1 ZINC000125007240 1415090759 /nfs/dbraw/zinc/09/07/59/1415090759.db2.gz UUNOOICOZFBANS-BJMVGYQFSA-N 0 0 393.321 3.425 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2c(F)cccc2NC(C)C)cc1[N+](=O)[O-] ZINC000125010457 1415091199 /nfs/dbraw/zinc/09/11/99/1415091199.db2.gz MGGDVGRHNCHYLG-UHFFFAOYSA-N 0 0 383.401 3.364 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Oc1cccnc1Br ZINC000125018978 1415092737 /nfs/dbraw/zinc/09/27/37/1415092737.db2.gz GYHHTEKDVJUXQC-UHFFFAOYSA-N 0 0 387.211 3.137 20 5 GGBDRN O=C(NC[C@H](O)c1c(F)cccc1F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125025238 1415093955 /nfs/dbraw/zinc/09/39/55/1415093955.db2.gz PMIBJMMAUUNNHZ-ZDUSSCGKSA-N 0 0 390.264 3.355 20 5 GGBDRN CCN1CCc2nc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)sc2C1 ZINC000125043635 1415098543 /nfs/dbraw/zinc/09/85/43/1415098543.db2.gz GPHYNWNZICWSFQ-UHFFFAOYSA-N 0 0 385.449 3.092 20 5 GGBDRN O=C(CN1CCC(Oc2ccc(F)cc2F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000125049089 1415099787 /nfs/dbraw/zinc/09/97/87/1415099787.db2.gz BYBXGWXSQLIDDR-UHFFFAOYSA-N 0 0 391.374 3.355 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccco1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000125074137 1415104090 /nfs/dbraw/zinc/10/40/90/1415104090.db2.gz LOZLQPIVRATOKV-ZANVPECISA-N 0 0 383.198 3.192 20 5 GGBDRN CC(C)COC(=O)[C@H](C)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000125082176 1415105687 /nfs/dbraw/zinc/10/56/87/1415105687.db2.gz LBDBTYUPPJGYGT-NSHDSACASA-N 0 0 377.422 3.036 20 5 GGBDRN CCCCC(=O)N1CSC[C@H]1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177836352 1428868973 /nfs/dbraw/zinc/86/89/73/1428868973.db2.gz FHEUSUXIOVXZTN-CJNGLKHVSA-N 0 0 379.482 3.172 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)CCS(=O)(=O)c1ccc(Cl)cc1 ZINC000125137127 1415116583 /nfs/dbraw/zinc/11/65/83/1415116583.db2.gz UXTWCRYJPVHLQJ-UHFFFAOYSA-N 0 0 383.809 3.326 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)NCCc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000125148207 1415118751 /nfs/dbraw/zinc/11/87/51/1415118751.db2.gz RKMFBVCZTFGGBU-UHFFFAOYSA-N 0 0 390.248 3.126 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)C(=O)NCC(C)(C)C ZINC000125163535 1415121768 /nfs/dbraw/zinc/12/17/68/1415121768.db2.gz GYPVTHJIJCOADG-LBPRGKRZSA-N 0 0 381.498 3.133 20 5 GGBDRN O=c1c(Br)nn(CCOc2cccc([N+](=O)[O-])c2)c2ccccc12 ZINC000125173486 1415124063 /nfs/dbraw/zinc/12/40/63/1415124063.db2.gz JRRJDANRGNXUME-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN Cc1cc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1S(C)(=O)=O ZINC000125181806 1415125455 /nfs/dbraw/zinc/12/54/55/1415125455.db2.gz CVUCTODWPFSTNL-UHFFFAOYSA-N 0 0 391.449 3.364 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CNC(=O)c1ccc(F)cc1F ZINC000125182047 1415125498 /nfs/dbraw/zinc/12/54/98/1415125498.db2.gz BNEWFDAVZHYAFP-UHFFFAOYSA-N 0 0 391.374 3.040 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000125194896 1415128119 /nfs/dbraw/zinc/12/81/19/1415128119.db2.gz RGVPMWCOVPQILN-NSHDSACASA-N 0 0 390.831 3.197 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc1[N+](=O)[O-] ZINC000177833674 1428868098 /nfs/dbraw/zinc/86/80/98/1428868098.db2.gz QADASWZDNWPMQT-NSHDSACASA-N 0 0 398.387 3.391 20 5 GGBDRN O=C(CN(Cc1ccccc1)CC(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000177833122 1428868258 /nfs/dbraw/zinc/86/82/58/1428868258.db2.gz DCEZQARKYIYEIT-UHFFFAOYSA-N 0 0 375.375 3.251 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(N3CCSCC3)cc2)cc(F)cc1[N+](=O)[O-] ZINC000125208002 1415130468 /nfs/dbraw/zinc/13/04/68/1415130468.db2.gz MGJAYIJFIYODFS-UHFFFAOYSA-N 0 0 376.413 3.122 20 5 GGBDRN Cc1cc(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)c(N)c([N+](=O)[O-])c1 ZINC000125213926 1415132128 /nfs/dbraw/zinc/13/21/28/1415132128.db2.gz CTQSBWGYTFEFCL-GFCCVEGCSA-N 0 0 381.392 3.069 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCCc2nc3ccccc3c(=O)[nH]2)cc1[N+](=O)[O-] ZINC000177834960 1428868535 /nfs/dbraw/zinc/86/85/35/1428868535.db2.gz SEKLVWKJNKURBE-CQSZACIVSA-N 0 0 394.431 3.340 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(C)c(S(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000177835446 1428868724 /nfs/dbraw/zinc/86/87/24/1428868724.db2.gz XAJNDCJPKDBMCJ-ZDUSSCGKSA-N 0 0 376.434 3.106 20 5 GGBDRN Cc1cccc2c1CCN2S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000125239937 1415137434 /nfs/dbraw/zinc/13/74/34/1415137434.db2.gz FUMHYUSWWYXHMZ-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000177815072 1428863575 /nfs/dbraw/zinc/86/35/75/1428863575.db2.gz BRVYJSYKFVDRCO-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN O=C(Nc1ccc(O)c(C(F)(F)F)c1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000125267622 1415147323 /nfs/dbraw/zinc/14/73/23/1415147323.db2.gz JJXCMZVJJOPIGM-UHFFFAOYSA-N 0 0 393.277 3.413 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000125268862 1415147503 /nfs/dbraw/zinc/14/75/03/1415147503.db2.gz DKSVVOZWUIVIFV-LLVKDONJSA-N 0 0 397.478 3.127 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000125271747 1415148711 /nfs/dbraw/zinc/14/87/11/1415148711.db2.gz HGCMZLUOBALZGD-ZDUSSCGKSA-N 0 0 391.449 3.065 20 5 GGBDRN CCCn1cc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)ccc1=O ZINC000125274016 1415148898 /nfs/dbraw/zinc/14/88/98/1415148898.db2.gz GGLGANBCRWQYGX-UHFFFAOYSA-N 0 0 394.225 3.490 20 5 GGBDRN C[C@@H](CC(=O)c1cccs1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000125275394 1415149409 /nfs/dbraw/zinc/14/94/09/1415149409.db2.gz GYMNZPPONWUFQA-LBPRGKRZSA-N 0 0 384.417 3.233 20 5 GGBDRN O=C(Nc1ccc(O)c(C(F)(F)F)c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000125288334 1415153157 /nfs/dbraw/zinc/15/31/57/1415153157.db2.gz NSSCFDZJZGMRHQ-UHFFFAOYSA-N 0 0 393.281 3.152 20 5 GGBDRN O=C(Oc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1-n1cncn1 ZINC000125292421 1415154577 /nfs/dbraw/zinc/15/45/77/1415154577.db2.gz GFNZZVFXDRTGSB-UHFFFAOYSA-N 0 0 389.165 3.157 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2ccc3c(c2)NC(=O)CCN3C)cc1[N+](=O)[O-] ZINC000177842332 1428870480 /nfs/dbraw/zinc/87/04/80/1428870480.db2.gz GISXUFZALXVLAB-ZDUSSCGKSA-N 0 0 382.420 3.173 20 5 GGBDRN CC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000177842666 1428870491 /nfs/dbraw/zinc/87/04/91/1428870491.db2.gz GOQZURGGZNGNAV-UHFFFAOYSA-N 0 0 382.825 3.272 20 5 GGBDRN Cc1ccccc1[C@H](CC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)NC(N)=O ZINC000177846011 1428871173 /nfs/dbraw/zinc/87/11/73/1428871173.db2.gz WYDRSLPHHXVEOI-YOEHRIQHSA-N 0 0 384.436 3.189 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000177847430 1428871692 /nfs/dbraw/zinc/87/16/92/1428871692.db2.gz DWXIKCIIZSGXKL-NSHDSACASA-N 0 0 390.465 3.374 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000177847547 1428871706 /nfs/dbraw/zinc/87/17/06/1428871706.db2.gz CLRJCOGCXUAOPM-RDJZCZTQSA-N 0 0 390.484 3.158 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000125372022 1415179741 /nfs/dbraw/zinc/17/97/41/1415179741.db2.gz WTUMNEXQCBOLCU-CYBMUJFWSA-N 0 0 391.449 3.065 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCCNC(=O)NC2CCCCC2)cc1[N+](=O)[O-] ZINC000177849536 1428872087 /nfs/dbraw/zinc/87/20/87/1428872087.db2.gz GENKGJXXFCJMSN-HNNXBMFYSA-N 0 0 390.484 3.493 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CCCNC(=O)NC2CCCCC2)cc1[N+](=O)[O-] ZINC000177849524 1428872231 /nfs/dbraw/zinc/87/22/31/1428872231.db2.gz GENKGJXXFCJMSN-OAHLLOKOSA-N 0 0 390.484 3.493 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000125420853 1415192845 /nfs/dbraw/zinc/19/28/45/1415192845.db2.gz JTURQKIFMDRYSU-ZDUSSCGKSA-N 0 0 376.384 3.116 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1[N+](=O)[O-] ZINC000177851146 1428873255 /nfs/dbraw/zinc/87/32/55/1428873255.db2.gz BHGCNGIPKJZVST-CYBMUJFWSA-N 0 0 395.375 3.488 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2nn(-c3ccccc3)c(C)cc2=O)cc1[N+](=O)[O-] ZINC000177854958 1428873838 /nfs/dbraw/zinc/87/38/38/1428873838.db2.gz CMTBLXYEPRAPJO-HNNXBMFYSA-N 0 0 392.415 3.249 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Cc2csc(NC(=O)C(C)C)n2)cc1[N+](=O)[O-] ZINC000177855207 1428873978 /nfs/dbraw/zinc/87/39/78/1428873978.db2.gz QHWPIOVHEONVQA-LBPRGKRZSA-N 0 0 390.465 3.374 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1[N+](=O)[O-] ZINC000177855106 1428874020 /nfs/dbraw/zinc/87/40/20/1428874020.db2.gz QMHWRPMWSIIUBD-NSHDSACASA-N 0 0 396.852 3.451 20 5 GGBDRN Cc1ccc(C(=O)CCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000125443518 1415200635 /nfs/dbraw/zinc/20/06/35/1415200635.db2.gz MCFKKXIOHFBDOY-CYBMUJFWSA-N 0 0 388.449 3.036 20 5 GGBDRN O=C(c1cc2ccccc2cc1O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125447699 1415201689 /nfs/dbraw/zinc/20/16/89/1415201689.db2.gz QTXVMYQGGCUAGU-HNNXBMFYSA-N 0 0 378.388 3.175 20 5 GGBDRN Cc1nn(C)c(C)c1-c1cc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)[nH]n1 ZINC000177856445 1428874651 /nfs/dbraw/zinc/87/46/51/1428874651.db2.gz RLGAYMBMYRQZST-NSHDSACASA-N 0 0 382.424 3.135 20 5 GGBDRN O=C([C@@H]1CCC[C@H](C(F)(F)F)C1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125451694 1415203014 /nfs/dbraw/zinc/20/30/14/1415203014.db2.gz KCQGVUYSTGGXBC-AGIUHOORSA-N 0 0 386.374 3.371 20 5 GGBDRN Cc1cc(OCC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl ZINC000125461046 1415205356 /nfs/dbraw/zinc/20/53/56/1415205356.db2.gz OOEPNHLQFBRVOZ-ZDUSSCGKSA-N 0 0 390.827 3.043 20 5 GGBDRN CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177859426 1428875607 /nfs/dbraw/zinc/87/56/07/1428875607.db2.gz COIZDGSHSZUTMP-JLTOFOAXSA-N 0 0 381.432 3.054 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000177861316 1428875959 /nfs/dbraw/zinc/87/59/59/1428875959.db2.gz OHYHWBKZSBHTDP-RDJZCZTQSA-N 0 0 388.468 3.008 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000177862563 1428876435 /nfs/dbraw/zinc/87/64/35/1428876435.db2.gz ASEQJFTWBSHJFV-CJNGLKHVSA-N 0 0 393.509 3.418 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000125483513 1415211935 /nfs/dbraw/zinc/21/19/35/1415211935.db2.gz YZUBFGWVSFKMKE-OAHLLOKOSA-N 0 0 394.431 3.398 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1nc(C(C)(C)C)cs1 ZINC000125484529 1415212395 /nfs/dbraw/zinc/21/23/95/1415212395.db2.gz GCOWDPDPKLZHLL-SNVBAGLBSA-N 0 0 376.438 3.106 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000177864055 1428876902 /nfs/dbraw/zinc/87/69/02/1428876902.db2.gz HZRNOYHYILJAHQ-HIFRSBDPSA-N 0 0 387.461 3.447 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC(C)(C)C(=O)NCC(C)(C)C ZINC000125489505 1415212932 /nfs/dbraw/zinc/21/29/32/1415212932.db2.gz BFIQJUWPERYVHH-LLVKDONJSA-N 0 0 399.875 3.073 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CNC(=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000177864159 1428877247 /nfs/dbraw/zinc/87/72/47/1428877247.db2.gz IYHAFWRXIXSEPN-GFCCVEGCSA-N 0 0 375.812 3.164 20 5 GGBDRN COC(=O)c1sc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)nc1C ZINC000125494443 1415213814 /nfs/dbraw/zinc/21/38/14/1415213814.db2.gz ZKWYSRMQXIXUGM-UHFFFAOYSA-N 0 0 389.311 3.417 20 5 GGBDRN Cc1sc2ccc(Cl)cc2c1S(=O)(=O)NN=c1[nH]cccc1[N+](=O)[O-] ZINC000125501938 1415215102 /nfs/dbraw/zinc/21/51/02/1415215102.db2.gz JVCGJJGIHIWDQD-UHFFFAOYSA-N 0 0 398.853 3.472 20 5 GGBDRN CN(C(=O)CN1CCC(OC2CCCCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000125508035 1415216830 /nfs/dbraw/zinc/21/68/30/1415216830.db2.gz UYYIKYANHKZIGA-UHFFFAOYSA-N 0 0 375.469 3.371 20 5 GGBDRN Cc1cccc(Oc2ccc(NC(=O)NCCn3cc([N+](=O)[O-])cn3)cn2)c1C ZINC000125512816 1415217890 /nfs/dbraw/zinc/21/78/90/1415217890.db2.gz YERJIPSFHBLYDG-UHFFFAOYSA-N 0 0 396.407 3.417 20 5 GGBDRN O=C(NCc1ccc(CN2CCCC2=O)cc1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000125524999 1415220385 /nfs/dbraw/zinc/22/03/85/1415220385.db2.gz VJVNDAXGOLTODJ-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN CCOc1ccc(C(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000125541994 1415222882 /nfs/dbraw/zinc/22/28/82/1415222882.db2.gz RQPGZEKHITWVLG-UHFFFAOYSA-N 0 0 397.431 3.046 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)cc1[N+](=O)[O-] ZINC000177840528 1428869779 /nfs/dbraw/zinc/86/97/79/1428869779.db2.gz SCZYAOIYEZSWJD-OWCLPIDISA-N 0 0 398.463 3.403 20 5 GGBDRN Cc1ccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1NS(C)(=O)=O ZINC000177839662 1428869833 /nfs/dbraw/zinc/86/98/33/1428869833.db2.gz NRMVCIQIYUTYAX-ZDUSSCGKSA-N 0 0 391.449 3.074 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(N3C(=O)CCC3=O)c2)cc1[N+](=O)[O-] ZINC000177839192 1428869960 /nfs/dbraw/zinc/86/99/60/1428869960.db2.gz VVMNAKCDACFJPH-CYBMUJFWSA-N 0 0 381.388 3.048 20 5 GGBDRN CN(C)c1cccc(CN(C)S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000125562370 1415226969 /nfs/dbraw/zinc/22/69/69/1415226969.db2.gz BIDNTWRMPQMIPZ-UHFFFAOYSA-N 0 0 383.857 3.135 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)cc1[N+](=O)[O-] ZINC000177842615 1428870371 /nfs/dbraw/zinc/87/03/71/1428870371.db2.gz WNADIIGQMNBXNK-XLIONFOSSA-N 0 0 397.475 3.372 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-] ZINC000177873357 1428879296 /nfs/dbraw/zinc/87/92/96/1428879296.db2.gz NHQMTTPCDZJOOU-CYBMUJFWSA-N 0 0 396.378 3.079 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000177874548 1428879361 /nfs/dbraw/zinc/87/93/61/1428879361.db2.gz JBKJZCPTRBCSIJ-HOCLYGCPSA-N 0 0 385.420 3.368 20 5 GGBDRN NS(=O)(=O)c1ccc(OCc2c(Cl)ccc3cccnc32)c([N+](=O)[O-])c1 ZINC000125587803 1415233194 /nfs/dbraw/zinc/23/31/94/1415233194.db2.gz IPSFLHXFUWALPD-UHFFFAOYSA-N 0 0 393.808 3.023 20 5 GGBDRN COc1cccc(CCCN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)c1 ZINC000125605026 1415236374 /nfs/dbraw/zinc/23/63/74/1415236374.db2.gz ODLWTIOHYOBAJK-FQEVSTJZSA-N 0 0 383.404 3.003 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)cc1[N+](=O)[O-] ZINC000125610343 1415237685 /nfs/dbraw/zinc/23/76/85/1415237685.db2.gz YKNKLIUNUDUYKB-UHFFFAOYSA-N 0 0 392.462 3.176 20 5 GGBDRN C[C@@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1nc(-c2ccccc2)no1 ZINC000125629196 1415240911 /nfs/dbraw/zinc/24/09/11/1415240911.db2.gz ZIIDQGNNBUPTMK-NSHDSACASA-N 0 0 392.375 3.055 20 5 GGBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCN(c2ncnc3sccc32)CC1 ZINC000125636847 1415243032 /nfs/dbraw/zinc/24/30/32/1415243032.db2.gz YOGHVJPHFJIXBJ-HWKANZROSA-N 0 0 381.461 3.435 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000125651138 1415246384 /nfs/dbraw/zinc/24/63/84/1415246384.db2.gz ZIRPGJISLYMLFG-CQSZACIVSA-N 0 0 377.466 3.425 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000125691812 1415255147 /nfs/dbraw/zinc/25/51/47/1415255147.db2.gz GDDIGEWJTMAFJS-AWEZNQCLSA-N 0 0 377.441 3.105 20 5 GGBDRN CCOCCOc1cc(C)ccc1CNC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000125693560 1415255643 /nfs/dbraw/zinc/25/56/43/1415255643.db2.gz JUDWHJGTHQQAKP-UHFFFAOYSA-N 0 0 376.384 3.388 20 5 GGBDRN O=C(O[C@@H](c1ncccn1)C1CCCC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000125707028 1415258442 /nfs/dbraw/zinc/25/84/42/1415258442.db2.gz JLFOFPHADAJUAT-QGZVFWFLSA-N 0 0 394.391 3.054 20 5 GGBDRN COC(=O)[C@@H]1C[C@H](OC)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000125717139 1415260970 /nfs/dbraw/zinc/26/09/70/1415260970.db2.gz RVYOQUZYRCQBTD-BBRMVZONSA-N 0 0 394.811 3.271 20 5 GGBDRN COC(=O)[C@H]1C[C@H](OC)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000125716733 1415261219 /nfs/dbraw/zinc/26/12/19/1415261219.db2.gz RVYOQUZYRCQBTD-XJKSGUPXSA-N 0 0 394.811 3.271 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000125750085 1415269847 /nfs/dbraw/zinc/26/98/47/1415269847.db2.gz LRCYVBWBHGMZIL-UHFFFAOYSA-N 0 0 383.408 3.177 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)c1nc(-c2ccccc2)no1 ZINC000125752522 1415270047 /nfs/dbraw/zinc/27/00/47/1415270047.db2.gz VLVKVTAMABCVRM-LBPRGKRZSA-N 0 0 382.376 3.187 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C[C@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000125756564 1415271815 /nfs/dbraw/zinc/27/18/15/1415271815.db2.gz XZSRZLPUILPAOT-CJNGLKHVSA-N 0 0 396.490 3.242 20 5 GGBDRN Cn1ccnc1-c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)n1 ZINC000125763147 1415273356 /nfs/dbraw/zinc/27/33/56/1415273356.db2.gz ZTJHSODDNHKPJF-UHFFFAOYSA-N 0 0 398.448 3.304 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000125765508 1415274086 /nfs/dbraw/zinc/27/40/86/1415274086.db2.gz WJOCHQCJKIEQKQ-HIFRSBDPSA-N 0 0 396.490 3.242 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccc(-c2ccccc2)nn1 ZINC000125765573 1415274348 /nfs/dbraw/zinc/27/43/48/1415274348.db2.gz LDRDMEIIMDZODC-UHFFFAOYSA-N 0 0 379.332 3.237 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000125774703 1415277090 /nfs/dbraw/zinc/27/70/90/1415277090.db2.gz XYCBMDPGAVUAAY-HIFRSBDPSA-N 0 0 396.490 3.242 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000125774914 1415277318 /nfs/dbraw/zinc/27/73/18/1415277318.db2.gz XYCBMDPGAVUAAY-ZFWWWQNUSA-N 0 0 396.490 3.242 20 5 GGBDRN Cc1cc(C(=O)Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)c(Cl)cc1F ZINC000177908900 1428888668 /nfs/dbraw/zinc/88/86/68/1428888668.db2.gz FHCJXAZCAFTRFI-UHFFFAOYSA-N 0 0 375.743 3.289 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000125786399 1415280483 /nfs/dbraw/zinc/28/04/83/1415280483.db2.gz VATOVZRQWNUZQH-HNAYVOBHSA-N 0 0 397.431 3.126 20 5 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CCc1ccc([C@@H]2COCCN2CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000126252872 1415394506 /nfs/dbraw/zinc/39/45/06/1415394506.db2.gz LTRDOMOTMPGQMA-INIZCTEOSA-N 0 0 393.827 3.416 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000126255634 1415395708 /nfs/dbraw/zinc/39/57/08/1415395708.db2.gz FHMYAVXUBDSXMH-MRXNPFEDSA-N 0 0 398.246 3.477 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000126262214 1415397493 /nfs/dbraw/zinc/39/74/93/1415397493.db2.gz NROVZITWWRAZPH-GOSISDBHSA-N 0 0 397.431 3.455 20 5 GGBDRN CCN(C[C@@H]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1)CC(F)(F)F ZINC000126263521 1415397712 /nfs/dbraw/zinc/39/77/12/1415397712.db2.gz ZGHOQXHYLIVAGB-HNNXBMFYSA-N 0 0 387.402 3.260 20 5 GGBDRN C[C@@H](CS(C)(=O)=O)N(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000126269141 1415398736 /nfs/dbraw/zinc/39/87/36/1415398736.db2.gz JPPDHURLZDQLEY-ZDUSSCGKSA-N 0 0 378.450 3.252 20 5 GGBDRN C[C@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc2NC1=O ZINC000126285553 1415402887 /nfs/dbraw/zinc/40/28/87/1415402887.db2.gz MPZJORIOGZZNKY-LBPRGKRZSA-N 0 0 378.388 3.240 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2C[C@H]2c2ccccc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000126311374 1415414902 /nfs/dbraw/zinc/41/49/02/1415414902.db2.gz GECXBVNIADSTCM-ZWKOTPCHSA-N 0 0 377.404 3.078 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1CCN(c2ccccc2)CC1 ZINC000126310079 1415414990 /nfs/dbraw/zinc/41/49/90/1415414990.db2.gz KBNDBVMEMBDRTG-UHFFFAOYSA-N 0 0 389.477 3.105 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@H](C(=O)OCc2cccc([N+](=O)[O-])c2)C1 ZINC000126323601 1415418026 /nfs/dbraw/zinc/41/80/26/1415418026.db2.gz WCODYRXCQIJXAO-SFHVURJKSA-N 0 0 382.416 3.119 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N(Cc1ccc(F)cc1F)C1CC1 ZINC000126324518 1415418032 /nfs/dbraw/zinc/41/80/32/1415418032.db2.gz MYUOICUHKJTEGB-UHFFFAOYSA-N 0 0 375.331 3.003 20 5 GGBDRN COc1ccc(CCCN(C)S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000126325793 1415418624 /nfs/dbraw/zinc/41/86/24/1415418624.db2.gz LWPMXRHPCSYBRZ-UHFFFAOYSA-N 0 0 378.450 3.165 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)n(-c2ccccc2)n1 ZINC000126334297 1415420343 /nfs/dbraw/zinc/42/03/43/1415420343.db2.gz PKNCLUZBZKATSE-GFCCVEGCSA-N 0 0 397.410 3.171 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC[C@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000126351921 1415424386 /nfs/dbraw/zinc/42/43/86/1415424386.db2.gz GLHQYZCPYUFWHH-AWEZNQCLSA-N 0 0 394.474 3.391 20 5 GGBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126351963 1415424408 /nfs/dbraw/zinc/42/44/08/1415424408.db2.gz DILSCZAHWVXQLD-ASHKIFAZSA-N 0 0 389.477 3.277 20 5 GGBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126351753 1415424438 /nfs/dbraw/zinc/42/44/38/1415424438.db2.gz DILSCZAHWVXQLD-PWFNWSNSSA-N 0 0 389.477 3.277 20 5 GGBDRN CCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](C)CS(=O)(=O)CC ZINC000126362215 1415426710 /nfs/dbraw/zinc/42/67/10/1415426710.db2.gz OZTSYSFZQWHZSH-AWEZNQCLSA-N 0 0 380.466 3.500 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000126378031 1415430450 /nfs/dbraw/zinc/43/04/50/1415430450.db2.gz QAMKAHNNZDBNAC-GOSISDBHSA-N 0 0 397.410 3.099 20 5 GGBDRN C[C@@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@H](c2ccsc2)O1 ZINC000126385555 1415432829 /nfs/dbraw/zinc/43/28/29/1415432829.db2.gz XLUPVTKHWHJNIK-CXAGYDPISA-N 0 0 375.450 3.370 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1ccccn1 ZINC000126399094 1415438762 /nfs/dbraw/zinc/43/87/62/1415438762.db2.gz HIEATAWCFMYJFW-LJQANCHMSA-N 0 0 378.388 3.100 20 5 GGBDRN CCCC(=O)Nc1ccc(C(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)cc1 ZINC000126399159 1415438977 /nfs/dbraw/zinc/43/89/77/1415438977.db2.gz OTUPOMHTCMVPSE-UHFFFAOYSA-N 0 0 383.360 3.124 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H](O)c1cc2ccccc2s1 ZINC000126413869 1415444378 /nfs/dbraw/zinc/44/43/78/1415444378.db2.gz DNULVTLRBXTART-AWEZNQCLSA-N 0 0 392.458 3.130 20 5 GGBDRN O=C(NC[C@H](O)c1ccc(F)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000126421076 1415447845 /nfs/dbraw/zinc/44/78/45/1415447845.db2.gz NVJCAHAMFZRDRF-INIZCTEOSA-N 0 0 387.392 3.321 20 5 GGBDRN Cc1c(N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cnn1-c1ccccc1 ZINC000126423636 1415448695 /nfs/dbraw/zinc/44/86/95/1415448695.db2.gz FAWRSHPWOHGZNN-GOSISDBHSA-N 0 0 377.404 3.306 20 5 GGBDRN CC(C)n1c(CCNC(=O)COc2ccccc2[N+](=O)[O-])nc2ccccc21 ZINC000126431748 1415452444 /nfs/dbraw/zinc/45/24/44/1415452444.db2.gz SRUPNWGVDMMYSN-UHFFFAOYSA-N 0 0 382.420 3.263 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nc(-c3c[nH]c4ncccc34)c(C)s2)c1[N+](=O)[O-] ZINC000126461428 1415458979 /nfs/dbraw/zinc/45/89/79/1415458979.db2.gz FAYXIOXZIGTTFN-UHFFFAOYSA-N 0 0 397.420 3.197 20 5 GGBDRN Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cc(C)c1F ZINC000126471689 1415462895 /nfs/dbraw/zinc/46/28/95/1415462895.db2.gz AXQUTQFQMOZTSD-FQEVSTJZSA-N 0 0 399.378 3.001 20 5 GGBDRN COc1cc(F)c(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1F ZINC000126488094 1415467862 /nfs/dbraw/zinc/46/78/62/1415467862.db2.gz BRSSQXLZBSDUHD-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)c(C)n1 ZINC000126488059 1415468220 /nfs/dbraw/zinc/46/82/20/1415468220.db2.gz VEANMDFTQRYVHW-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126501899 1415471309 /nfs/dbraw/zinc/47/13/09/1415471309.db2.gz NQWZNWQMMHSVPU-HNNXBMFYSA-N 0 0 394.435 3.121 20 5 GGBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126502182 1415471639 /nfs/dbraw/zinc/47/16/39/1415471639.db2.gz NQWZNWQMMHSVPU-OAHLLOKOSA-N 0 0 394.435 3.121 20 5 GGBDRN Cc1c(C(=O)NCc2nc(-c3ccccc3)c[nH]2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000126515807 1415475748 /nfs/dbraw/zinc/47/57/48/1415475748.db2.gz PJCCKSGOTQPTFB-UHFFFAOYSA-N 0 0 381.348 3.132 20 5 GGBDRN C[C@@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000126539610 1415483180 /nfs/dbraw/zinc/48/31/80/1415483180.db2.gz ZTKRQLPGPXDEHJ-CZUORRHYSA-N 0 0 392.843 3.323 20 5 GGBDRN C[C@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000126539825 1415483885 /nfs/dbraw/zinc/48/38/85/1415483885.db2.gz ZTKRQLPGPXDEHJ-XJKSGUPXSA-N 0 0 392.843 3.323 20 5 GGBDRN COC(=O)C1(c2ccccc2)CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000126614430 1415507666 /nfs/dbraw/zinc/50/76/66/1415507666.db2.gz POUZAJXEWNMZOA-UHFFFAOYSA-N 0 0 375.812 3.354 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000126618666 1415508213 /nfs/dbraw/zinc/50/82/13/1415508213.db2.gz AAOFKBHCMAVBGX-UHFFFAOYSA-N 0 0 388.727 3.194 20 5 GGBDRN O=C(Nc1cc(Br)ccc1O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000126665987 1415521605 /nfs/dbraw/zinc/52/16/05/1415521605.db2.gz WWJVRIYDOBHXND-UHFFFAOYSA-N 0 0 382.126 3.223 20 5 GGBDRN O=C(Nc1ccc(CCN2CCOCC2)cc1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000126668567 1415522206 /nfs/dbraw/zinc/52/22/06/1415522206.db2.gz PZSOLXJGLFERBM-UHFFFAOYSA-N 0 0 389.839 3.375 20 5 GGBDRN Cn1c(CCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)nc2cc(F)ccc21 ZINC000126674621 1415523846 /nfs/dbraw/zinc/52/38/46/1415523846.db2.gz WDFSSTVATXDAFP-UHFFFAOYSA-N 0 0 376.775 3.247 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1cnn(-c2ccccc2)c1 ZINC000126704909 1415531804 /nfs/dbraw/zinc/53/18/04/1415531804.db2.gz VWIGGTIDEMKKIV-HNNXBMFYSA-N 0 0 379.420 3.240 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)Cc1cnn(-c2ccccc2)c1 ZINC000126706089 1415533234 /nfs/dbraw/zinc/53/32/34/1415533234.db2.gz NSYUDDFQIFZOFO-UHFFFAOYSA-N 0 0 379.420 3.159 20 5 GGBDRN C[C@@H](c1cn(-c2ccccc2)nn1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178025700 1428942908 /nfs/dbraw/zinc/94/29/08/1428942908.db2.gz LFKXZLHMNKPMKT-INIZCTEOSA-N 0 0 378.436 3.059 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCc2ccnc(N3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000126739684 1415543909 /nfs/dbraw/zinc/54/39/09/1415543909.db2.gz BDDMXJMSBZETGC-UHFFFAOYSA-N 0 0 399.407 3.127 20 5 GGBDRN CCOC(=O)C1=C(C)N(CC2CC2)C(=O)N[C@@H]1c1cc([N+](=O)[O-])c(F)cc1F ZINC000126744932 1415545198 /nfs/dbraw/zinc/54/51/98/1415545198.db2.gz DTFCDXMGAGRSJA-MRXNPFEDSA-N 0 0 395.362 3.186 20 5 GGBDRN CCc1ccc(C(=O)N[C@@H](CC)CS(=O)(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000126759631 1415550389 /nfs/dbraw/zinc/55/03/89/1415550389.db2.gz DFOXUZQGKQCMNS-INIZCTEOSA-N 0 0 390.461 3.140 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000178031289 1428945985 /nfs/dbraw/zinc/94/59/85/1428945985.db2.gz HDJUECBAYNMYQI-KSRHRBNTSA-N 0 0 393.509 3.005 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)Cc1cnn(-c2ccccc2)c1 ZINC000126793941 1415560759 /nfs/dbraw/zinc/56/07/59/1415560759.db2.gz BEIAZGRXTDWWJK-HNNXBMFYSA-N 0 0 379.420 3.240 20 5 GGBDRN Cc1c(CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)cccc1[N+](=O)[O-] ZINC000178035750 1428948882 /nfs/dbraw/zinc/94/88/82/1428948882.db2.gz JYCCCMQLYSVCNS-UHFFFAOYSA-N 0 0 385.439 3.319 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000126834531 1415578043 /nfs/dbraw/zinc/57/80/43/1415578043.db2.gz UNGRTYGLRUZJJA-GOSISDBHSA-N 0 0 385.811 3.136 20 5 GGBDRN CCCC(=O)N1CCC[C@@H]1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000126842570 1415581914 /nfs/dbraw/zinc/58/19/14/1415581914.db2.gz GOQABKMFSLASRC-OAHLLOKOSA-N 0 0 388.449 3.448 20 5 GGBDRN Cc1c(C(=O)NC2(c3ccccc3F)CC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000126847747 1415583907 /nfs/dbraw/zinc/58/39/07/1415583907.db2.gz SENRXDPJATZJHT-UHFFFAOYSA-N 0 0 381.367 3.042 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)CC(=O)c2ccc(F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000126851162 1415584819 /nfs/dbraw/zinc/58/48/19/1415584819.db2.gz VRDCUACNCVIVOC-JTQLQIEISA-N 0 0 389.339 3.342 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN(Cc1ccccc1)C1CC1 ZINC000126875782 1415592778 /nfs/dbraw/zinc/59/27/78/1415592778.db2.gz AZPRBLUQZDXTRY-UHFFFAOYSA-N 0 0 376.416 3.441 20 5 GGBDRN Cn1cnc(-c2cccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)c2)n1 ZINC000126884296 1415594479 /nfs/dbraw/zinc/59/44/79/1415594479.db2.gz BRQGITQEKIRKQZ-UHFFFAOYSA-N 0 0 376.376 3.053 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CC[C@H](c2ccccc2)C1 ZINC000126883396 1415594586 /nfs/dbraw/zinc/59/45/86/1415594586.db2.gz OFIAUUBRXWFMPS-SFHVURJKSA-N 0 0 376.416 3.266 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000126920964 1415609839 /nfs/dbraw/zinc/60/98/39/1415609839.db2.gz DZLLYYSNYVUEKJ-OAUYIBNBSA-N 0 0 390.342 3.273 20 5 GGBDRN CC(=O)N[C@H](C)CCc1ccc(C(=O)COc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000126924066 1415610700 /nfs/dbraw/zinc/61/07/00/1415610700.db2.gz LTDGVNPLWNIXGR-CYBMUJFWSA-N 0 0 388.395 3.453 20 5 GGBDRN CC(C)(C)OC(=O)N(CC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000126930193 1415612087 /nfs/dbraw/zinc/61/20/87/1415612087.db2.gz AZLLIVZSLMATPN-UHFFFAOYSA-N 0 0 377.441 3.346 20 5 GGBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126963678 1415619613 /nfs/dbraw/zinc/61/96/13/1415619613.db2.gz PGPVCAKOZDVALO-HNNXBMFYSA-N 0 0 377.466 3.491 20 5 GGBDRN CC(C)(CO)[C@@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000126985659 1415625638 /nfs/dbraw/zinc/62/56/38/1415625638.db2.gz JKFXLKSDBMVRHF-FQEVSTJZSA-N 0 0 397.475 3.465 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc(C2OCCO2)c1 ZINC000126983853 1415626176 /nfs/dbraw/zinc/62/61/76/1415626176.db2.gz QKQQMCLDVWOASK-UHFFFAOYSA-N 0 0 380.360 3.283 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000127008530 1415633734 /nfs/dbraw/zinc/63/37/34/1415633734.db2.gz WPCDGISPNDKWNZ-ZBEGNZNMSA-N 0 0 391.811 3.079 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000127009200 1415634491 /nfs/dbraw/zinc/63/44/91/1415634491.db2.gz WPCDGISPNDKWNZ-BDJLRTHQSA-N 0 0 391.811 3.079 20 5 GGBDRN C[C@@H](CCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000127014456 1415637134 /nfs/dbraw/zinc/63/71/34/1415637134.db2.gz NXIMUPHIOWEULP-LBPRGKRZSA-N 0 0 397.353 3.085 20 5 GGBDRN Cc1ccc(C[C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)s1 ZINC000127015815 1415637665 /nfs/dbraw/zinc/63/76/65/1415637665.db2.gz QYKVIXXHFWKCSS-CYBMUJFWSA-N 0 0 389.477 3.162 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2ccn3ccnc3c2)CC1 ZINC000178067935 1428966762 /nfs/dbraw/zinc/96/67/62/1428966762.db2.gz SEPAKUIZUOVRDM-UHFFFAOYSA-N 0 0 393.447 3.409 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000127016715 1415638179 /nfs/dbraw/zinc/63/81/79/1415638179.db2.gz JJSNPCQQJOSEET-OXJNMPFZSA-N 0 0 398.463 3.474 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000127016960 1415638204 /nfs/dbraw/zinc/63/82/04/1415638204.db2.gz JJSNPCQQJOSEET-JXFKEZNVSA-N 0 0 398.463 3.474 20 5 GGBDRN Cc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1N(C)C ZINC000178067016 1428967129 /nfs/dbraw/zinc/96/71/29/1428967129.db2.gz XGAWUGAAAFCHQS-CQSZACIVSA-N 0 0 384.436 3.094 20 5 GGBDRN Cc1ccc(CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)C2CC2)cc1C ZINC000127095276 1415659224 /nfs/dbraw/zinc/65/92/24/1415659224.db2.gz HIBYTNAESNAUTE-UHFFFAOYSA-N 0 0 395.415 3.311 20 5 GGBDRN CN(Cc1cc(Cl)cn1C)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000127090458 1415659303 /nfs/dbraw/zinc/65/93/03/1415659303.db2.gz YBFPIHSKKXNIAF-UHFFFAOYSA-N 0 0 378.237 3.061 20 5 GGBDRN COc1cc(CN2CCC(CO)CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000127095571 1415659509 /nfs/dbraw/zinc/65/95/09/1415659509.db2.gz GVSPPODOFHZRSU-UHFFFAOYSA-N 0 0 386.448 3.387 20 5 GGBDRN COc1ccc(N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(OC)c1 ZINC000127100005 1415660479 /nfs/dbraw/zinc/66/04/79/1415660479.db2.gz ZIZCKSXHODLLBH-UHFFFAOYSA-N 0 0 382.376 3.074 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000127112523 1415662689 /nfs/dbraw/zinc/66/26/89/1415662689.db2.gz PDRXKLCWWBGVGW-CYBMUJFWSA-N 0 0 381.175 3.450 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000127123529 1415664971 /nfs/dbraw/zinc/66/49/71/1415664971.db2.gz COSFVDJWASBQJZ-UHFFFAOYSA-N 0 0 392.358 3.322 20 5 GGBDRN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000127128919 1415666113 /nfs/dbraw/zinc/66/61/13/1415666113.db2.gz BKQLYYYOOGGHTI-LLVKDONJSA-N 0 0 378.331 3.284 20 5 GGBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000127136476 1415668119 /nfs/dbraw/zinc/66/81/19/1415668119.db2.gz WDJCUUQGJODXCM-WBVHZDCISA-N 0 0 375.469 3.071 20 5 GGBDRN O=C(NCc1ccc(N2CCOC2=O)cc1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000127154794 1415673880 /nfs/dbraw/zinc/67/38/80/1415673880.db2.gz YENKZVAQUOFURB-UHFFFAOYSA-N 0 0 375.768 3.135 20 5 GGBDRN Cc1cc(Cl)ncc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178083558 1428974697 /nfs/dbraw/zinc/97/46/97/1428974697.db2.gz XHFKDJAKWJEFAQ-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN CC(C)(Cc1ccc(Cl)cc1Cl)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000127182462 1415680605 /nfs/dbraw/zinc/68/06/05/1415680605.db2.gz ZJLYWHKDBWWESA-UHFFFAOYSA-N 0 0 398.246 3.201 20 5 GGBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000127197754 1415684447 /nfs/dbraw/zinc/68/44/47/1415684447.db2.gz SVUFMGLEOYAIAS-QFIPXVFZSA-N 0 0 380.488 3.314 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000178060758 1428962857 /nfs/dbraw/zinc/96/28/57/1428962857.db2.gz MSNRMLMSBICCIP-HNNXBMFYSA-N 0 0 396.447 3.319 20 5 GGBDRN Cc1nc2ccc(NC(=O)C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2o1 ZINC000178061178 1428962913 /nfs/dbraw/zinc/96/29/13/1428962913.db2.gz PRWHHOIKEDHLJM-NSHDSACASA-N 0 0 382.376 3.169 20 5 GGBDRN Cc1nc2ccc(NC(=O)C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2o1 ZINC000178061159 1428962979 /nfs/dbraw/zinc/96/29/79/1428962979.db2.gz PRWHHOIKEDHLJM-LLVKDONJSA-N 0 0 382.376 3.169 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cccc(-c3cnco3)c2)cc1[N+](=O)[O-] ZINC000178060973 1428963100 /nfs/dbraw/zinc/96/31/00/1428963100.db2.gz VWMAWMPGUMNXCP-ZDUSSCGKSA-N 0 0 394.387 3.374 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000178060935 1428963245 /nfs/dbraw/zinc/96/32/45/1428963245.db2.gz BZYJMMYAPZTASG-NSHDSACASA-N 0 0 391.811 3.381 20 5 GGBDRN CCCNC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC)C1 ZINC000127223914 1415693011 /nfs/dbraw/zinc/69/30/11/1415693011.db2.gz KNZCALWCXKTEJN-CYBMUJFWSA-N 0 0 379.482 3.085 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C12CCC2 ZINC000127228193 1415693984 /nfs/dbraw/zinc/69/39/84/1415693984.db2.gz JSUUYGBHBFEOHE-MOPGFXCFSA-N 0 0 398.463 3.056 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCCCC[C@H]1C[C@@H](O)c1ccco1 ZINC000127227275 1415693998 /nfs/dbraw/zinc/69/39/98/1415693998.db2.gz VXAGZFJSRHHABX-DOTOQJQBSA-N 0 0 388.420 3.462 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC(C)(C)c2ccccc21 ZINC000127226769 1415694008 /nfs/dbraw/zinc/69/40/08/1415694008.db2.gz BQPILNHRNZMEDR-FZKQIMNGSA-N 0 0 381.432 3.252 20 5 GGBDRN COc1cc(N2CCC(OC(=O)Cc3ccccc3F)CC2)ccc1[N+](=O)[O-] ZINC000127226757 1415694266 /nfs/dbraw/zinc/69/42/66/1415694266.db2.gz JDGVQJOCFZMMBH-UHFFFAOYSA-N 0 0 388.395 3.497 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000178063972 1428964411 /nfs/dbraw/zinc/96/44/11/1428964411.db2.gz UCCHYZLSHVRPMH-LLVKDONJSA-N 0 0 393.346 3.321 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc3ccn(C)c3c2)cc1[N+](=O)[O-] ZINC000178063937 1428964460 /nfs/dbraw/zinc/96/44/60/1428964460.db2.gz XZCJTLJZGLDBCX-CYBMUJFWSA-N 0 0 380.404 3.211 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000127226887 1415694576 /nfs/dbraw/zinc/69/45/76/1415694576.db2.gz VXAGZFJSRHHABX-RDJZCZTQSA-N 0 0 388.420 3.462 20 5 GGBDRN CCn1ncc2ccc(NC(=O)C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc21 ZINC000178062958 1428964737 /nfs/dbraw/zinc/96/47/37/1428964737.db2.gz IVOUWMIFLWCWFZ-ZDUSSCGKSA-N 0 0 395.419 3.089 20 5 GGBDRN CCOc1cc(F)ccc1NC(=O)C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178064028 1428964780 /nfs/dbraw/zinc/96/47/80/1428964780.db2.gz BWOZZJBZGFVGCW-GFCCVEGCSA-N 0 0 389.383 3.257 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCOc1ncccc1Cl ZINC000127239986 1415699814 /nfs/dbraw/zinc/69/98/14/1415699814.db2.gz IIQMWJWCCGZJAQ-UHFFFAOYSA-N 0 0 378.816 3.031 20 5 GGBDRN CCc1ncc(C(=O)OC2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)s1 ZINC000127239617 1415699928 /nfs/dbraw/zinc/69/99/28/1415699928.db2.gz PZMOSBPLMLFZGI-UHFFFAOYSA-N 0 0 391.449 3.448 20 5 GGBDRN CCOc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000178064443 1428965692 /nfs/dbraw/zinc/96/56/92/1428965692.db2.gz GAQFJNLPAKZALM-GFCCVEGCSA-N 0 0 389.383 3.257 20 5 GGBDRN CC[C@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)Oc1cccc(C)c1 ZINC000178089004 1428976677 /nfs/dbraw/zinc/97/66/77/1428976677.db2.gz HGBCOMOMCRASRN-OAHLLOKOSA-N 0 0 385.420 3.124 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000178090704 1428977148 /nfs/dbraw/zinc/97/71/48/1428977148.db2.gz PUKOEOFOLKUASV-FQEVSTJZSA-N 0 0 394.431 3.285 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CNc3ccccc3O[C@H]3CCOC3)n2)cc1 ZINC000127257363 1415706192 /nfs/dbraw/zinc/70/61/92/1415706192.db2.gz YEGCOKIHGMPFFJ-HNNXBMFYSA-N 0 0 382.376 3.425 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CNc3ccccc3O[C@@H]3CCOC3)n2)cc1 ZINC000127257111 1415706727 /nfs/dbraw/zinc/70/67/27/1415706727.db2.gz YEGCOKIHGMPFFJ-OAHLLOKOSA-N 0 0 382.376 3.425 20 5 GGBDRN COCCCOC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000127262602 1415709218 /nfs/dbraw/zinc/70/92/18/1415709218.db2.gz GMTGPZOASBUUGE-UHFFFAOYSA-N 0 0 390.358 3.410 20 5 GGBDRN O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000127268158 1415710265 /nfs/dbraw/zinc/71/02/65/1415710265.db2.gz VZNPLBPQGNQYSU-UHFFFAOYSA-N 0 0 396.447 3.220 20 5 GGBDRN C[C@H](CCC(C)(C)C)NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000127268870 1415710339 /nfs/dbraw/zinc/71/03/39/1415710339.db2.gz BOYAGZOGUBHZHR-SNVBAGLBSA-N 0 0 387.383 3.466 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1c(F)cccc1N1CCCC1 ZINC000127278805 1415715298 /nfs/dbraw/zinc/71/52/98/1415715298.db2.gz FIPLJOXERIJZIC-UHFFFAOYSA-N 0 0 379.413 3.443 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCOc1ccc(C(F)(F)F)cn1 ZINC000178121509 1428990614 /nfs/dbraw/zinc/99/06/14/1428990614.db2.gz FTVCMEVSGIZXOV-UHFFFAOYSA-N 0 0 398.341 3.229 20 5 GGBDRN COC(=O)C1(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CCCC1 ZINC000127297830 1415725065 /nfs/dbraw/zinc/72/50/65/1415725065.db2.gz RHLFYOSWLBOVJX-UHFFFAOYSA-N 0 0 389.452 3.047 20 5 GGBDRN Cc1nc(CC(C)C)c(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)s1 ZINC000127299879 1415726672 /nfs/dbraw/zinc/72/66/72/1415726672.db2.gz WPMWMHIONJEGQY-UHFFFAOYSA-N 0 0 390.421 3.105 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccccc1N1CCc2ccccc21 ZINC000178108108 1428984474 /nfs/dbraw/zinc/98/44/74/1428984474.db2.gz AVWQLEPUAOMLDQ-UHFFFAOYSA-N 0 0 392.419 3.307 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)cc1F ZINC000127338443 1415743565 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NUKUJDMGWZUSEO-MRXNPFEDSA-N 0 0 385.420 3.124 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(COc3ccc(Br)nc3)o2)cc1 ZINC000127366217 1415755231 /nfs/dbraw/zinc/75/52/31/1415755231.db2.gz GLRWSEYLQSSXCK-UHFFFAOYSA-N 0 0 377.154 3.381 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1COC(=O)c1csc(-c2cnn(C)c2)n1 ZINC000127372100 1415756326 /nfs/dbraw/zinc/75/63/26/1415756326.db2.gz SXKCATABAHDTTN-UHFFFAOYSA-N 0 0 388.405 3.208 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000127390408 1415763332 /nfs/dbraw/zinc/76/33/32/1415763332.db2.gz DIBUDBAPCNSYKK-KZULUSFZSA-N 0 0 394.859 3.344 20 5 GGBDRN CC(C)N(CC(=O)OC(C)(C)C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000127406305 1415768371 /nfs/dbraw/zinc/76/83/71/1415768371.db2.gz CLLSAIJULCBTIZ-UHFFFAOYSA-N 0 0 377.441 3.361 20 5 GGBDRN O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178130487 1428992774 /nfs/dbraw/zinc/99/27/74/1428992774.db2.gz RGMAOFQVDRQLHE-CQSZACIVSA-N 0 0 387.461 3.330 20 5 GGBDRN CCCOc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000127453817 1415784483 /nfs/dbraw/zinc/78/44/83/1415784483.db2.gz CEEHJDOYIVNKKY-UHFFFAOYSA-N 0 0 385.420 3.473 20 5 GGBDRN CCOc1ccc(C(=O)N(C)C)cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000178136299 1428994605 /nfs/dbraw/zinc/99/46/05/1428994605.db2.gz BRQHDMUNJIPTMJ-KPKJPENVSA-N 0 0 383.404 3.347 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)NC3C[C@@H](C)O[C@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000127458079 1415786104 /nfs/dbraw/zinc/78/61/04/1415786104.db2.gz MTHGWKVPWFYXQM-CHWSQXEVSA-N 0 0 386.452 3.142 20 5 GGBDRN CCCOc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000127460205 1415787166 /nfs/dbraw/zinc/78/71/66/1415787166.db2.gz DGBQWXMUQOEOSC-UHFFFAOYSA-N 0 0 399.447 3.150 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(COc3ccc(Br)nc3)n2)cc1 ZINC000127463874 1415790009 /nfs/dbraw/zinc/79/00/09/1415790009.db2.gz AXTRXXSSTWJVSH-UHFFFAOYSA-N 0 0 377.154 3.381 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)N2CSC[C@@H]2C(=O)N2CCCC2)cc1[N+](=O)[O-] ZINC000127469081 1415792059 /nfs/dbraw/zinc/79/20/59/1415792059.db2.gz GKLMEPVCDIPFLE-MRXNPFEDSA-N 0 0 391.493 3.030 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1cc(=O)oc2cc3c(cc12)CCC3 ZINC000127503485 1415801734 /nfs/dbraw/zinc/80/17/34/1415801734.db2.gz GXQFRZSWRMPTIY-UHFFFAOYSA-N 0 0 378.340 3.146 20 5 GGBDRN O=C(Nc1ncn(Cc2ccc(Cl)cc2)n1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000178144165 1428998113 /nfs/dbraw/zinc/99/81/13/1428998113.db2.gz UZKFYZRXGJTYNC-UHFFFAOYSA-N 0 0 397.782 3.017 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1C(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000127509857 1415802850 /nfs/dbraw/zinc/80/28/50/1415802850.db2.gz BLQAVIHSQUPTDV-CYBMUJFWSA-N 0 0 387.417 3.100 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000127534311 1415806053 /nfs/dbraw/zinc/80/60/53/1415806053.db2.gz ZZWQTRVNEIQOLT-XHDPSFHLSA-N 0 0 380.832 3.072 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000127539153 1415806796 /nfs/dbraw/zinc/80/67/96/1415806796.db2.gz 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Cc1ccccc1C1(CNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)CC1 ZINC000127622863 1415821513 /nfs/dbraw/zinc/82/15/13/1415821513.db2.gz ZSYGSCNOYSNZOY-UHFFFAOYSA-N 0 0 395.459 3.201 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)c1[N+](=O)[O-] ZINC000127640906 1415824800 /nfs/dbraw/zinc/82/48/00/1415824800.db2.gz BUFRVLAZRJTYGE-UHFFFAOYSA-N 0 0 382.405 3.265 20 5 GGBDRN Cc1nn(C)c(C)c1CCOC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000127642592 1415825407 /nfs/dbraw/zinc/82/54/07/1415825407.db2.gz MVBPVFIYNSLMGU-UHFFFAOYSA-N 0 0 386.433 3.468 20 5 GGBDRN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127654361 1415827010 /nfs/dbraw/zinc/82/70/10/1415827010.db2.gz SDPRGLXPFVJHIV-AEFFLSMTSA-N 0 0 395.459 3.450 20 5 GGBDRN CC(C)(CNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)Cc1ccccc1 ZINC000127662522 1415828701 /nfs/dbraw/zinc/82/87/01/1415828701.db2.gz SXFUTPXAQUXJNE-UHFFFAOYSA-N 0 0 397.475 3.430 20 5 GGBDRN C[C@H](O)[C@H]1CCCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000127668978 1415829628 /nfs/dbraw/zinc/82/96/28/1415829628.db2.gz HXVRVWJNSNXRJU-RDJZCZTQSA-N 0 0 375.469 3.064 20 5 GGBDRN C[C@H](O)[C@@H]1CCCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000127669179 1415829892 /nfs/dbraw/zinc/82/98/92/1415829892.db2.gz HXVRVWJNSNXRJU-DOTOQJQBSA-N 0 0 375.469 3.064 20 5 GGBDRN O=C(NCC1(c2cccc(F)c2)CC1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127678134 1415831289 /nfs/dbraw/zinc/83/12/89/1415831289.db2.gz NGYHFMBCVHZCRL-UHFFFAOYSA-N 0 0 399.422 3.032 20 5 GGBDRN Cn1nccc1C(=O)O[C@H](c1ccc(Br)cc1)C(C)(C)[N+](=O)[O-] ZINC000127678581 1415831437 /nfs/dbraw/zinc/83/14/37/1415831437.db2.gz UATYKLOVXUHZDX-CYBMUJFWSA-N 0 0 382.214 3.136 20 5 GGBDRN Cn1nccc1C(=O)O[C@@H](c1ccc(Br)cc1)C(C)(C)[N+](=O)[O-] ZINC000127678791 1415831497 /nfs/dbraw/zinc/83/14/97/1415831497.db2.gz UATYKLOVXUHZDX-ZDUSSCGKSA-N 0 0 382.214 3.136 20 5 GGBDRN C[C@@H](Nc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)c1ccc(OC(F)F)cc1 ZINC000127682390 1415832606 /nfs/dbraw/zinc/83/26/06/1415832606.db2.gz GOLFGPWWIAHAGO-SECBINFHSA-N 0 0 387.364 3.017 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000127689544 1415833556 /nfs/dbraw/zinc/83/35/56/1415833556.db2.gz SCHDPQDHRSJMHT-SFHVURJKSA-N 0 0 395.459 3.136 20 5 GGBDRN Cc1ccc(N2CC[C@H](NC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)C2=O)cc1 ZINC000127690272 1415834350 /nfs/dbraw/zinc/83/43/50/1415834350.db2.gz UDORUCJTAREDIC-INIZCTEOSA-N 0 0 382.420 3.447 20 5 GGBDRN O=C(Nc1cccc2ccc(O)cc21)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000127697657 1415835359 /nfs/dbraw/zinc/83/53/59/1415835359.db2.gz IHRZQLBZKNMFQN-UHFFFAOYSA-N 0 0 375.344 3.287 20 5 GGBDRN Nc1c(C(=O)NCc2cccnc2Oc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000178166390 1429004241 /nfs/dbraw/zinc/00/42/41/1429004241.db2.gz HWWLGHSSPRHQNY-UHFFFAOYSA-N 0 0 382.351 3.433 20 5 GGBDRN CCOCc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000127707981 1415836743 /nfs/dbraw/zinc/83/67/43/1415836743.db2.gz FHAZIGDAPWDYFT-UHFFFAOYSA-N 0 0 385.420 3.220 20 5 GGBDRN O=C(CCCNC(=O)c1cccnc1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000127709264 1415837225 /nfs/dbraw/zinc/83/72/25/1415837225.db2.gz OPGWFXJHYWTMJA-UHFFFAOYSA-N 0 0 396.447 3.476 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)[C@@H](C)c1ccccc1 ZINC000127716623 1415837873 /nfs/dbraw/zinc/83/78/73/1415837873.db2.gz CBERYWTYFJYUBI-HZPDHXFCSA-N 0 0 383.448 3.353 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)[C@H](C)c1ccccc1 ZINC000127716864 1415837880 /nfs/dbraw/zinc/83/78/80/1415837880.db2.gz CBERYWTYFJYUBI-JKSUJKDBSA-N 0 0 383.448 3.353 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C(=O)N2CCCC2)CC1 ZINC000127716212 1415837979 /nfs/dbraw/zinc/83/79/79/1415837979.db2.gz KKDXMGOVQVMGAZ-UHFFFAOYSA-N 0 0 391.493 3.181 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@@H](c2ccccc2F)C1 ZINC000127725154 1415839456 /nfs/dbraw/zinc/83/94/56/1415839456.db2.gz YUWYUALCYWMQEU-LJQANCHMSA-N 0 0 383.379 3.358 20 5 GGBDRN O=C(NCCO)c1cccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000127726666 1415839611 /nfs/dbraw/zinc/83/96/11/1415839611.db2.gz DZBPHGJHBILOJG-UHFFFAOYSA-N 0 0 398.444 3.053 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCN(CC(F)(F)C(F)F)CC1 ZINC000127740471 1415841929 /nfs/dbraw/zinc/84/19/29/1415841929.db2.gz UJJROLWRYXWYMG-UHFFFAOYSA-N 0 0 392.353 3.262 20 5 GGBDRN Cc1nn(C)c(C(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)c1[N+](=O)[O-] ZINC000127744469 1415842954 /nfs/dbraw/zinc/84/29/54/1415842954.db2.gz WDCAIIIFLPPSSS-UHFFFAOYSA-N 0 0 382.342 3.460 20 5 GGBDRN CC(C)C[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000127749819 1415843486 /nfs/dbraw/zinc/84/34/86/1415843486.db2.gz HUBYMTOKQLYGNR-MRXNPFEDSA-N 0 0 375.469 3.330 20 5 GGBDRN O=C(Nc1cccc(OCCF)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127753660 1415844586 /nfs/dbraw/zinc/84/45/86/1415844586.db2.gz VCLZTKWMEGEEFB-UHFFFAOYSA-N 0 0 389.383 3.032 20 5 GGBDRN Nc1c(C(=O)NCc2cccc(NC(=O)C3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000178173247 1429006929 /nfs/dbraw/zinc/00/69/29/1429006929.db2.gz FKLGHAIWRMIVHY-UHFFFAOYSA-N 0 0 382.420 3.236 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)nc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000127772953 1415847744 /nfs/dbraw/zinc/84/77/44/1415847744.db2.gz BPFIOYBCAICCJD-UHFFFAOYSA-N 0 0 397.435 3.023 20 5 GGBDRN O=C(NCc1cccnc1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000127801382 1415853016 /nfs/dbraw/zinc/85/30/16/1415853016.db2.gz ZWTCXTKOHPIJCT-UHFFFAOYSA-N 0 0 392.202 3.412 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCCN(C(=O)c2cccc(F)c2)CC1 ZINC000127799866 1415853090 /nfs/dbraw/zinc/85/30/90/1415853090.db2.gz OZFATNAVCBEWCU-UHFFFAOYSA-N 0 0 386.383 3.114 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccc2c(c1)OCO2 ZINC000127805403 1415854238 /nfs/dbraw/zinc/85/42/38/1415854238.db2.gz VDYUMZKWGCMSAP-UHFFFAOYSA-N 0 0 379.166 3.363 20 5 GGBDRN Nc1c(C(=O)NCC2(c3ccc(Cl)cc3)CCOCC2)cccc1[N+](=O)[O-] ZINC000178178150 1429008615 /nfs/dbraw/zinc/00/86/15/1429008615.db2.gz ZIAZPHOVEZNJBL-UHFFFAOYSA-N 0 0 389.839 3.309 20 5 GGBDRN COc1cc(CCNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)ccc1C ZINC000127811808 1415855452 /nfs/dbraw/zinc/85/54/52/1415855452.db2.gz HEKXKVDMRQDWSD-UHFFFAOYSA-N 0 0 387.392 3.409 20 5 GGBDRN Nc1c(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)cccc1[N+](=O)[O-] ZINC000178178780 1429008868 /nfs/dbraw/zinc/00/88/68/1429008868.db2.gz RTVWFACGXTYNIA-UHFFFAOYSA-N 0 0 382.351 3.433 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1 ZINC000127819744 1415857168 /nfs/dbraw/zinc/85/71/68/1415857168.db2.gz FJZQIIRHJYWMGU-CQSZACIVSA-N 0 0 399.451 3.153 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc(CS(C)(=O)=O)cc1 ZINC000127824392 1415857659 /nfs/dbraw/zinc/85/76/59/1415857659.db2.gz BNYSSZIZSKWIHP-UHFFFAOYSA-N 0 0 391.449 3.078 20 5 GGBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccc(C(=O)NC2CC2)cc1 ZINC000127846692 1415862576 /nfs/dbraw/zinc/86/25/76/1415862576.db2.gz OCUSPTYITIDLFS-UHFFFAOYSA-N 0 0 376.372 3.288 20 5 GGBDRN CN(Cc1ccccc1Cl)C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000127852508 1415863024 /nfs/dbraw/zinc/86/30/24/1415863024.db2.gz LAQXOAKLHXRFFC-UHFFFAOYSA-N 0 0 382.203 3.499 20 5 GGBDRN CCc1ccccc1Nc1nc(N)nc(CSc2ncccc2[N+](=O)[O-])n1 ZINC000127877984 1415868684 /nfs/dbraw/zinc/86/86/84/1415868684.db2.gz KETFKZOCSOZKKG-UHFFFAOYSA-N 0 0 383.437 3.355 20 5 GGBDRN CC[C@@H](CCO)CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000127879480 1415869194 /nfs/dbraw/zinc/86/91/94/1415869194.db2.gz AJQCETQKBHLEDY-CABCVRRESA-N 0 0 386.452 3.301 20 5 GGBDRN CCOc1cc(F)ccc1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000127896265 1415871900 /nfs/dbraw/zinc/87/19/00/1415871900.db2.gz IDCUBBPKNBBTCE-UHFFFAOYSA-N 0 0 385.355 3.274 20 5 GGBDRN COc1cc(CCNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)ccc1C ZINC000127903690 1415873231 /nfs/dbraw/zinc/87/32/31/1415873231.db2.gz VFVFBZYALYWWCK-UHFFFAOYSA-N 0 0 380.404 3.070 20 5 GGBDRN CN(Cc1ccc(C(F)(F)F)cc1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000127911941 1415874227 /nfs/dbraw/zinc/87/42/27/1415874227.db2.gz LAXOTMNORDCBOZ-UHFFFAOYSA-N 0 0 381.310 3.211 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2ccc(C)nc2Br)cc([N+](=O)[O-])c1 ZINC000127927500 1415876853 /nfs/dbraw/zinc/87/68/53/1415876853.db2.gz SAJOSIZJPBOBNF-UHFFFAOYSA-N 0 0 394.181 3.100 20 5 GGBDRN COc1cc(CCNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)ccc1C ZINC000127930395 1415877549 /nfs/dbraw/zinc/87/75/49/1415877549.db2.gz JPRGWIPSLPBWJM-UHFFFAOYSA-N 0 0 380.404 3.070 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2ccc(COc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000127943582 1415879777 /nfs/dbraw/zinc/87/97/77/1415879777.db2.gz LSYWHKDPJJSTFM-UHFFFAOYSA-N 0 0 380.404 3.146 20 5 GGBDRN CCCOc1cc(F)ccc1NC(=O)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000127944043 1415880112 /nfs/dbraw/zinc/88/01/12/1415880112.db2.gz PFCISZIKRJBPLR-LBPRGKRZSA-N 0 0 389.383 3.339 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000127953932 1415882361 /nfs/dbraw/zinc/88/23/61/1415882361.db2.gz BJOZAMKBYUOYLF-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN Cc1cnn(-c2ccc(S(=O)(=O)Nc3cc([N+](=O)[O-])ccc3C)cc2F)c1 ZINC000127955991 1415882859 /nfs/dbraw/zinc/88/28/59/1415882859.db2.gz BZUIZERPJCLTNP-UHFFFAOYSA-N 0 0 390.396 3.337 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(COC2CCOCC2)cc1 ZINC000127957318 1415882943 /nfs/dbraw/zinc/88/29/43/1415882943.db2.gz QMPBENHGSBLJKA-UHFFFAOYSA-N 0 0 399.447 3.262 20 5 GGBDRN COc1cccc(NC2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000127965640 1415884858 /nfs/dbraw/zinc/88/48/58/1415884858.db2.gz VHOKIHABXHEGJQ-UHFFFAOYSA-N 0 0 385.420 3.085 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H](CCO)c1ccccc1 ZINC000178192350 1429014488 /nfs/dbraw/zinc/01/44/88/1429014488.db2.gz XDGVQKHENYMISN-OAHLLOKOSA-N 0 0 392.839 3.300 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NCc2cccc(S(=O)(=O)N3CCCCC3)c2)n1 ZINC000178206415 1429018193 /nfs/dbraw/zinc/01/81/93/1429018193.db2.gz QXXBYSJXLVUJOU-UHFFFAOYSA-N 0 0 390.465 3.085 20 5 GGBDRN Nc1c(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000178195731 1429015546 /nfs/dbraw/zinc/01/55/46/1429015546.db2.gz GLUGTOSPFCBNPS-GFCCVEGCSA-N 0 0 375.356 3.126 20 5 GGBDRN O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000128019315 1415894276 /nfs/dbraw/zinc/89/42/76/1415894276.db2.gz SGALCRJOZBHSJT-ZDUSSCGKSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000128019534 1415894399 /nfs/dbraw/zinc/89/43/99/1415894399.db2.gz SGALCRJOZBHSJT-CYBMUJFWSA-N 0 0 395.749 3.062 20 5 GGBDRN CN1c2ccccc2N(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1=O ZINC000178200616 1429016622 /nfs/dbraw/zinc/01/66/22/1429016622.db2.gz OVABRBBCADHUFM-UHFFFAOYSA-N 0 0 397.434 3.164 20 5 GGBDRN CC[C@@H](C)n1ncc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C1CC1 ZINC000128045061 1415900016 /nfs/dbraw/zinc/90/00/16/1415900016.db2.gz WARHYSKBQOKGBD-UKRRQHHQSA-N 0 0 398.467 3.361 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000128047553 1415900544 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CC(=O)Nc1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000178284451 1429042275 /nfs/dbraw/zinc/04/22/75/1429042275.db2.gz JXXQYXQCNPHMLM-UHFFFAOYSA-N 0 0 382.420 3.427 20 5 GGBDRN COc1cc(CN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C2CC2)ccc1O ZINC000128647783 1416033383 /nfs/dbraw/zinc/03/33/83/1416033383.db2.gz HTNUSITYFXPTLA-UHFFFAOYSA-N 0 0 385.420 3.221 20 5 GGBDRN Cc1ccc(C[NH+]2CCSCC2)cc1NC(=O)c1cccc([N+](=O)[O-])c1[O-] ZINC000128660621 1416035975 /nfs/dbraw/zinc/03/59/75/1416035975.db2.gz FCTFRVIABUQEKV-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN Cc1ccc([C@@H]2COCCN2CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)o1 ZINC000128665350 1416037320 /nfs/dbraw/zinc/03/73/20/1416037320.db2.gz QVNSGCURWNBHIS-INIZCTEOSA-N 0 0 377.372 3.037 20 5 GGBDRN O=C(c1ccccc1)c1ccc(N2CCC[C@@H](Cn3ccnn3)C2)c([N+](=O)[O-])c1 ZINC000128675458 1416040089 /nfs/dbraw/zinc/04/00/89/1416040089.db2.gz KKEKPDBAVMHGOF-MRXNPFEDSA-N 0 0 391.431 3.334 20 5 GGBDRN Nc1ccc(C(=O)N2CCc3c(Br)cccc3C2)cc1[N+](=O)[O-] ZINC000128688118 1416042547 /nfs/dbraw/zinc/04/25/47/1416042547.db2.gz XFIYAJLKPDHMGM-UHFFFAOYSA-N 0 0 376.210 3.138 20 5 GGBDRN CC(C)(C)OC(=O)NC1CCC(NC(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000128686557 1416042629 /nfs/dbraw/zinc/04/26/29/1416042629.db2.gz BKWCOERLWKUWPV-UHFFFAOYSA-N 0 0 381.404 3.300 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N(C)C[C@@H]2CCC[C@@H]2O)cc1[N+](=O)[O-])c1ccccn1 ZINC000128705663 1416046697 /nfs/dbraw/zinc/04/66/97/1416046697.db2.gz RSJCGQBDAIFLJM-IIMJZQEZSA-N 0 0 398.463 3.396 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N(C)C[C@@H]2CCC[C@@H]2O)cc1[N+](=O)[O-])c1ccccn1 ZINC000128705392 1416046965 /nfs/dbraw/zinc/04/69/65/1416046965.db2.gz RSJCGQBDAIFLJM-UVFQYZLESA-N 0 0 398.463 3.396 20 5 GGBDRN Cc1cccc(OCCN(C)C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000128706476 1416047496 /nfs/dbraw/zinc/04/74/96/1416047496.db2.gz RMTKEDCUVCKZNZ-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN C[C@@]1(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCC[C@H]1O ZINC000178325164 1429051512 /nfs/dbraw/zinc/05/15/12/1429051512.db2.gz SPLHUJBZAVPWSU-QAPCUYQASA-N 0 0 375.450 3.389 20 5 GGBDRN COc1cc(CNC(=O)c2c([N+](=O)[O-])c(C)nn2C)ccc1OCCC(C)C ZINC000128724942 1416051689 /nfs/dbraw/zinc/05/16/89/1416051689.db2.gz XPKSMXCSDKBWDL-UHFFFAOYSA-N 0 0 390.440 3.000 20 5 GGBDRN Cc1c(CC(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000128725302 1416051873 /nfs/dbraw/zinc/05/18/73/1416051873.db2.gz SBUUJMXSCZVOFI-CQSZACIVSA-N 0 0 380.404 3.297 20 5 GGBDRN CC[C@@H]1CCC[C@@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000128726096 1416052001 /nfs/dbraw/zinc/05/20/01/1416052001.db2.gz CDSNEBXXZWECKT-NVXWUHKLSA-N 0 0 388.468 3.031 20 5 GGBDRN CC(C)(C)NC(=O)c1ccccc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178325079 1429051642 /nfs/dbraw/zinc/05/16/42/1429051642.db2.gz RNMIFRIXOPSSQY-UHFFFAOYSA-N 0 0 396.447 3.124 20 5 GGBDRN C[C@@]1(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CCCC[C@H]1O ZINC000178325221 1429051707 /nfs/dbraw/zinc/05/17/07/1429051707.db2.gz SFLBUUQIGQCWCD-QAPCUYQASA-N 0 0 375.450 3.389 20 5 GGBDRN NC(=O)c1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000128726911 1416052883 /nfs/dbraw/zinc/05/28/83/1416052883.db2.gz NZRKPSJBEGBNKY-CQSZACIVSA-N 0 0 375.812 3.000 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC[C@H]1CCO ZINC000128747351 1416058197 /nfs/dbraw/zinc/05/81/97/1416058197.db2.gz QPRPBFINCVNCSL-ZDUSSCGKSA-N 0 0 389.374 3.179 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCOC[C@@H]3C3CC3)cc2[N+](=O)[O-])C1 ZINC000128794928 1416070149 /nfs/dbraw/zinc/07/01/49/1416070149.db2.gz HPSANHAIORWPGL-QEEYODRMSA-N 0 0 387.480 3.328 20 5 GGBDRN CCOc1ccc(C(=O)N(Cc2ccncc2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000128799631 1416071572 /nfs/dbraw/zinc/07/15/72/1416071572.db2.gz FXIHTGDBKRCBQD-QGZVFWFLSA-N 0 0 385.420 3.210 20 5 GGBDRN C[C@H](c1ccccc1F)S(=O)(=O)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000128803711 1416072890 /nfs/dbraw/zinc/07/28/90/1416072890.db2.gz YQLXIPJVCAIZAZ-LLVKDONJSA-N 0 0 381.381 3.276 20 5 GGBDRN CC(=O)Nc1ccc(Cl)cc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178342448 1429055932 /nfs/dbraw/zinc/05/59/32/1429055932.db2.gz MRUMVDWJQFXRQU-UHFFFAOYSA-N 0 0 388.811 3.208 20 5 GGBDRN CC(C)C(=O)NCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000128806398 1416073777 /nfs/dbraw/zinc/07/37/77/1416073777.db2.gz TXCLNWGHCJRCQZ-UHFFFAOYSA-N 0 0 385.420 3.231 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C(=O)NCc1ccccc1 ZINC000128807381 1416073819 /nfs/dbraw/zinc/07/38/19/1416073819.db2.gz FYMYCDXSWFAWFD-LLVKDONJSA-N 0 0 395.337 3.048 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@@H]2CCC[C@@H]2O)CC1 ZINC000128845091 1416083688 /nfs/dbraw/zinc/08/36/88/1416083688.db2.gz DGRMOETXOGXCKE-KXBFYZLASA-N 0 0 375.469 3.064 20 5 GGBDRN Cc1ccc(-n2cnnn2)cc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128866769 1416087970 /nfs/dbraw/zinc/08/79/70/1416087970.db2.gz LEDAUJUOCUKDTN-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN COC(=O)[C@@H](OC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000178297773 1429045695 /nfs/dbraw/zinc/04/56/95/1429045695.db2.gz ZLMOZKVDMGGHHN-AWEZNQCLSA-N 0 0 394.177 3.428 20 5 GGBDRN Cc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2F)n(-c2ccccc2F)n1 ZINC000128876906 1416090818 /nfs/dbraw/zinc/09/08/18/1416090818.db2.gz UUVRHXJHAYANCM-UHFFFAOYSA-N 0 0 388.330 3.385 20 5 GGBDRN O=C(c1ccccc1)c1ccc(N2CCO[C@@H]([C@@H]3CCCO3)C2)c([N+](=O)[O-])c1 ZINC000128890244 1416093854 /nfs/dbraw/zinc/09/38/54/1416093854.db2.gz GNEDAJVQYSVMDL-VQTJNVASSA-N 0 0 382.416 3.210 20 5 GGBDRN C[C@H](O)C[C@@H](CNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 ZINC000128908591 1416098678 /nfs/dbraw/zinc/09/86/78/1416098678.db2.gz FIKMMIMDFPYUNY-JSGCOSHPSA-N 0 0 398.868 3.081 20 5 GGBDRN COc1ccccc1OC[C@H](C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000128911272 1416099139 /nfs/dbraw/zinc/09/91/39/1416099139.db2.gz RKSMGKSCCHEADL-CYBMUJFWSA-N 0 0 376.384 3.116 20 5 GGBDRN Cc1c(CC(=O)NCc2nccn2CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000128916477 1416100662 /nfs/dbraw/zinc/10/06/62/1416100662.db2.gz OBZGSMHYLDQJSH-UHFFFAOYSA-N 0 0 378.432 3.201 20 5 GGBDRN CC[C@H](CCO)CNC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000128923138 1416102439 /nfs/dbraw/zinc/10/24/39/1416102439.db2.gz HFEXTBCZICVIMS-HRCADAONSA-N 0 0 377.485 3.216 20 5 GGBDRN COc1ccc(OC)c([C@H](C)NC(=O)CNc2cc([N+](=O)[O-])ccc2F)c1 ZINC000178306319 1429048242 /nfs/dbraw/zinc/04/82/42/1429048242.db2.gz RJUUHQBZWCSCTC-NSHDSACASA-N 0 0 377.372 3.040 20 5 GGBDRN COc1cccc(C[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)c2ccccc2)c1 ZINC000178353544 1429059267 /nfs/dbraw/zinc/05/92/67/1429059267.db2.gz VLFTXSYIZSORAQ-IBGZPJMESA-N 0 0 381.388 3.327 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000128946944 1416110887 /nfs/dbraw/zinc/11/08/87/1416110887.db2.gz SPYRVYDRRBHZAH-UHFFFAOYSA-N 0 0 391.374 3.006 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000128956265 1416112658 /nfs/dbraw/zinc/11/26/58/1416112658.db2.gz LWWPNHKWKWZCBB-SJCJKPOMSA-N 0 0 398.868 3.444 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000128956696 1416112867 /nfs/dbraw/zinc/11/28/67/1416112867.db2.gz LWWPNHKWKWZCBB-YVEFUNNKSA-N 0 0 398.868 3.444 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000128956478 1416113026 /nfs/dbraw/zinc/11/30/26/1416113026.db2.gz LWWPNHKWKWZCBB-PXAZEXFGSA-N 0 0 398.868 3.444 20 5 GGBDRN Cc1cc(C(=O)N(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)cc([N+](=O)[O-])c1 ZINC000128975197 1416117358 /nfs/dbraw/zinc/11/73/58/1416117358.db2.gz BGDLXQQAYRUZCA-HNNXBMFYSA-N 0 0 394.836 3.157 20 5 GGBDRN Cc1cc(C(=O)N(C)[C@@H]2CS(=O)(=O)c3ccc(Cl)cc32)cc([N+](=O)[O-])c1 ZINC000128974989 1416117436 /nfs/dbraw/zinc/11/74/36/1416117436.db2.gz BGDLXQQAYRUZCA-OAHLLOKOSA-N 0 0 394.836 3.157 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(CC(F)(F)F)cc1 ZINC000129003924 1416123297 /nfs/dbraw/zinc/12/32/97/1416123297.db2.gz FABWJUUXCSRZRN-NSHDSACASA-N 0 0 395.337 3.457 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CCN(c2ncccc2F)C1 ZINC000129037178 1416131122 /nfs/dbraw/zinc/13/11/22/1416131122.db2.gz FJPOKYULBYZKLD-NSHDSACASA-N 0 0 379.779 3.183 20 5 GGBDRN CCN(CC)C(=O)c1ccc(OC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000129047843 1416133250 /nfs/dbraw/zinc/13/32/50/1416133250.db2.gz RHLVOAOFILTFPT-UHFFFAOYSA-N 0 0 385.420 3.484 20 5 GGBDRN CNC(=O)c1cc(Br)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000129050696 1416133926 /nfs/dbraw/zinc/13/39/26/1416133926.db2.gz GGQJDUOGHOUTCZ-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN CCOc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000178375375 1429064578 /nfs/dbraw/zinc/06/45/78/1429064578.db2.gz KOUPTHFIZCTXPY-UHFFFAOYSA-N 0 0 399.447 3.355 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1[N+](=O)[O-] ZINC000178377561 1429064960 /nfs/dbraw/zinc/06/49/60/1429064960.db2.gz GIRUKANGHMCVJM-LBPRGKRZSA-N 0 0 389.433 3.116 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H](CCO)c1ccccc1 ZINC000129079109 1416139559 /nfs/dbraw/zinc/13/95/59/1416139559.db2.gz BNRZYVIMEDVGDY-OAHLLOKOSA-N 0 0 378.812 3.257 20 5 GGBDRN Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000129092076 1416142789 /nfs/dbraw/zinc/14/27/89/1416142789.db2.gz KISRKNFJUMDFBK-RUDMXATFSA-N 0 0 395.415 3.028 20 5 GGBDRN COC(=O)c1cc(OCc2nc(-c3ccc(F)c(F)c3)no2)ccc1[N+](=O)[O-] ZINC000178380522 1429065790 /nfs/dbraw/zinc/06/57/90/1429065790.db2.gz XCQUIGATCPOLNS-UHFFFAOYSA-N 0 0 391.286 3.289 20 5 GGBDRN CC(C)C(=O)NCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000129111329 1416147797 /nfs/dbraw/zinc/14/77/97/1416147797.db2.gz YLUPLFWYGZKBFQ-UHFFFAOYSA-N 0 0 398.463 3.051 20 5 GGBDRN Cc1cc(C(=O)N(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)ccc1[N+](=O)[O-] ZINC000129121876 1416150397 /nfs/dbraw/zinc/15/03/97/1416150397.db2.gz QDKMOFLOTZABCV-HNNXBMFYSA-N 0 0 394.836 3.157 20 5 GGBDRN Cc1ccc(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1C(=O)NC(C)C ZINC000178390628 1429067588 /nfs/dbraw/zinc/06/75/88/1429067588.db2.gz FQHQUBGAVNMWLB-UHFFFAOYSA-N 0 0 396.447 3.043 20 5 GGBDRN O=C(NCCc1ccc2c(c1)CCO2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178396116 1429068775 /nfs/dbraw/zinc/06/87/75/1429068775.db2.gz FCDSQTKBPJFOKA-UHFFFAOYSA-N 0 0 381.432 3.446 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2ccccc21 ZINC000178402029 1429070791 /nfs/dbraw/zinc/07/07/91/1429070791.db2.gz OWIGQMHCNLZDER-OAHLLOKOSA-N 0 0 388.445 3.151 20 5 GGBDRN CC(C)(C)OC(=O)NCC(C)(C)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000129203407 1416169735 /nfs/dbraw/zinc/16/97/35/1416169735.db2.gz KBRHHCCJQSOLQN-UHFFFAOYSA-N 0 0 390.440 3.038 20 5 GGBDRN Cc1ccc(NCCCNC(=O)C[C@H](C)NC(=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000129204477 1416170062 /nfs/dbraw/zinc/17/00/62/1416170062.db2.gz PHVFHYOIWDFPAI-INIZCTEOSA-N 0 0 398.463 3.030 20 5 GGBDRN CCC(=O)N[C@H](C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000129215468 1416172572 /nfs/dbraw/zinc/17/25/72/1416172572.db2.gz OZWVCUALWPDHDD-FQEVSTJZSA-N 0 0 398.463 3.089 20 5 GGBDRN 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CC(C)N1C(=S)N=NC1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000130300786 1416353891 /nfs/dbraw/zinc/35/38/91/1416353891.db2.gz HAEBHUCVWNBAEJ-UHFFFAOYSA-N 0 0 389.359 3.005 20 5 GGBDRN O=C(CN[C@H](c1ccccc1)C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000130304528 1416354807 /nfs/dbraw/zinc/35/48/07/1416354807.db2.gz GVPSDKJNSOBKNI-GOSISDBHSA-N 0 0 393.365 3.373 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N(Cc1ccco1)Cc1ccc(O)cc1 ZINC000130314271 1416356189 /nfs/dbraw/zinc/35/61/89/1416356189.db2.gz RXDBDNBTRXHKOC-UHFFFAOYSA-N 0 0 395.371 3.061 20 5 GGBDRN COc1cccc(S(=O)(=O)CCN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000130393338 1416370394 /nfs/dbraw/zinc/37/03/94/1416370394.db2.gz OVHFOELIHUNRLU-UHFFFAOYSA-N 0 0 390.461 3.042 20 5 GGBDRN Cc1cccc2nc(CNC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)cn21 ZINC000130404091 1416372062 /nfs/dbraw/zinc/37/20/62/1416372062.db2.gz ULLKVVMCHQDZTD-UHFFFAOYSA-N 0 0 378.310 3.500 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCC1(c2ccc(F)cc2F)CC1 ZINC000130403879 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QUMLONDRHPXHLN-QGZVFWFLSA-N 0 0 387.823 3.324 20 5 GGBDRN O=C(COc1c(Cl)cccc1[N+](=O)[O-])N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130459764 1416381811 /nfs/dbraw/zinc/38/18/11/1416381811.db2.gz VIPRWVYAHBXUSE-UHFFFAOYSA-N 0 0 377.740 3.125 20 5 GGBDRN O=C(NC[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccc([N+](=O)[O-])c1[O-] ZINC000130460516 1416381945 /nfs/dbraw/zinc/38/19/45/1416381945.db2.gz NCNSXQIPDPZQOX-CYBMUJFWSA-N 0 0 375.450 3.004 20 5 GGBDRN Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)c1cccc([N+](=O)[O-])c1[O-] ZINC000130464918 1416382287 /nfs/dbraw/zinc/38/22/87/1416382287.db2.gz AEEMNZJXQPKSJW-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN Cn1nc(C(C)(C)C)cc1NC(=O)CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130470537 1416383199 /nfs/dbraw/zinc/38/31/99/1416383199.db2.gz NUXZGAZLVBYPDV-UHFFFAOYSA-N 0 0 385.468 3.229 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000178500927 1429091855 /nfs/dbraw/zinc/09/18/55/1429091855.db2.gz SIUIIJATEOOBOV-UHFFFAOYSA-N 0 0 377.404 3.045 20 5 GGBDRN CN(C)C(=O)CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC(F)(F)F ZINC000130488657 1416386809 /nfs/dbraw/zinc/38/68/09/1416386809.db2.gz HPNSUFYSGZYTNJ-UHFFFAOYSA-N 0 0 385.342 3.307 20 5 GGBDRN O=C(CCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)Nc1ccccc1 ZINC000130500566 1416389469 /nfs/dbraw/zinc/38/94/69/1416389469.db2.gz ULGRMWYPGDPKLB-UHFFFAOYSA-N 0 0 381.310 3.372 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000130514388 1416391663 /nfs/dbraw/zinc/39/16/63/1416391663.db2.gz XGYFVGDWJGNSPC-UHFFFAOYSA-N 0 0 388.767 3.012 20 5 GGBDRN CNC(=O)c1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)c1C ZINC000130530737 1416394800 /nfs/dbraw/zinc/39/48/00/1416394800.db2.gz BENARLYXIONHDQ-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN1C(=O)Cc2ccccc21 ZINC000130540696 1416395716 /nfs/dbraw/zinc/39/57/16/1416395716.db2.gz WFMXHQNLFVOGLV-UHFFFAOYSA-N 0 0 385.445 3.026 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000130548094 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IDFSAXMRSQZJCS-UHFFFAOYSA-N 0 0 376.434 3.364 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000130605505 1416408829 /nfs/dbraw/zinc/40/88/29/1416408829.db2.gz PIEWOPLPDVHFLX-UHFFFAOYSA-N 0 0 388.471 3.208 20 5 GGBDRN CC1(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCOCC1 ZINC000130607439 1416408838 /nfs/dbraw/zinc/40/88/38/1416408838.db2.gz LFOZADBXIMGIHA-UHFFFAOYSA-N 0 0 375.347 3.101 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(C[C@@H](C)O)c1ccccc1 ZINC000130616405 1416410351 /nfs/dbraw/zinc/41/03/51/1416410351.db2.gz HLLHESIUOQVDPG-GFCCVEGCSA-N 0 0 384.841 3.133 20 5 GGBDRN Cc1oc(-c2cccs2)nc1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000130645312 1416416168 /nfs/dbraw/zinc/41/61/68/1416416168.db2.gz BUHFHSXTXFTLHY-UHFFFAOYSA-N 0 0 384.373 3.485 20 5 GGBDRN CCC[C@H](NC(=O)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O)c1ccccc1 ZINC000130649639 1416417282 /nfs/dbraw/zinc/41/72/82/1416417282.db2.gz DFEDHEPIEKODRK-KRWDZBQOSA-N 0 0 396.403 3.069 20 5 GGBDRN 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ZINC000130711915 1416431395 /nfs/dbraw/zinc/43/13/95/1416431395.db2.gz KTOJEUGWRWZWKE-IXDGSTSKSA-N 0 0 384.436 3.196 20 5 GGBDRN CNC(=O)c1ccc(C[S@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000130715189 1416432371 /nfs/dbraw/zinc/43/23/71/1416432371.db2.gz JKMCBZBDKURNCM-MUUNZHRXSA-N 0 0 399.428 3.058 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)C(=O)NCc2ccccc2[N+](=O)[O-])n1 ZINC000178520512 1429096151 /nfs/dbraw/zinc/09/61/51/1429096151.db2.gz PMLYMQDDWWVWQD-NSHDSACASA-N 0 0 379.442 3.134 20 5 GGBDRN CNC(=O)COc1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000130734177 1416438001 /nfs/dbraw/zinc/43/80/01/1416438001.db2.gz CPYAQTHSSXIJEW-UHFFFAOYSA-N 0 0 398.444 3.455 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H](C)[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130740169 1416439504 /nfs/dbraw/zinc/43/95/04/1416439504.db2.gz MZJIROPUVUNFOL-BBFKWACYSA-N 0 0 393.465 3.192 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2F)C1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000130742405 1416440049 /nfs/dbraw/zinc/44/00/49/1416440049.db2.gz OCFGORRSFMRXMU-CQSZACIVSA-N 0 0 391.786 3.313 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2F)C1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000130742209 1416440111 /nfs/dbraw/zinc/44/01/11/1416440111.db2.gz OCFGORRSFMRXMU-AWEZNQCLSA-N 0 0 391.786 3.313 20 5 GGBDRN CSc1ccc(C(=O)Nc2cc(C)nn2-c2ccc(C)nn2)cc1[N+](=O)[O-] ZINC000130741701 1416440147 /nfs/dbraw/zinc/44/01/47/1416440147.db2.gz FPQXJXZCPRFJSZ-UHFFFAOYSA-N 0 0 384.421 3.162 20 5 GGBDRN CC(C)CCNC(=O)[C@H](C)[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130764651 1416445436 /nfs/dbraw/zinc/44/54/36/1416445436.db2.gz LRQSYUZFLFYATH-JGTBNHKDSA-N 0 0 393.465 3.049 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1C ZINC000130792399 1416452423 /nfs/dbraw/zinc/45/24/23/1416452423.db2.gz ZHKGTNCWNXXNKG-BBRMVZONSA-N 0 0 396.490 3.424 20 5 GGBDRN CC[C@H](c1ccncc1)N(CC)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000130798470 1416453624 /nfs/dbraw/zinc/45/36/24/1416453624.db2.gz 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ZINC000131238185 1416527969 /nfs/dbraw/zinc/52/79/69/1416527969.db2.gz ZQOABSDVERXVLY-LLVKDONJSA-N 0 0 389.389 3.188 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC(N2CCCCC2=O)CC1 ZINC000131256014 1416531032 /nfs/dbraw/zinc/53/10/32/1416531032.db2.gz JBOZXRSTDXCKNR-UHFFFAOYSA-N 0 0 380.832 3.257 20 5 GGBDRN C/C=C/c1ccc(OC[C@@H](O)CN2CCc3ccc([N+](=O)[O-])cc3C2)c(OC)c1 ZINC000131271612 1416532969 /nfs/dbraw/zinc/53/29/69/1416532969.db2.gz DSKOMYPTUVUDDV-YADGQWAMSA-N 0 0 398.459 3.435 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CCC(N)=O)C1 ZINC000131302059 1416537059 /nfs/dbraw/zinc/53/70/59/1416537059.db2.gz JKYHMQOYGOBTRL-AWEZNQCLSA-N 0 0 393.509 3.461 20 5 GGBDRN C[C@H](OCCCNC(=O)CN1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000131308445 1416537911 /nfs/dbraw/zinc/53/79/11/1416537911.db2.gz UTHWEIWNSZCOKK-KRWDZBQOSA-N 0 0 397.475 3.237 20 5 GGBDRN Cc1c(CC(=O)Nc2ccccc2N2CCC(CO)CC2)cccc1[N+](=O)[O-] ZINC000131310415 1416538205 /nfs/dbraw/zinc/53/82/05/1416538205.db2.gz ZQIHCEBIYDQBDH-UHFFFAOYSA-N 0 0 383.448 3.293 20 5 GGBDRN O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000131327013 1416540659 /nfs/dbraw/zinc/54/06/59/1416540659.db2.gz SUSRJYBSKNDUNQ-UHFFFAOYSA-N 0 0 396.378 3.371 20 5 GGBDRN O=C(CN1CCc2ccc([N+](=O)[O-])cc2C1)Nc1ccccc1OC(F)F ZINC000131327597 1416540782 /nfs/dbraw/zinc/54/07/82/1416540782.db2.gz IBFKNKFPKFWWSZ-UHFFFAOYSA-N 0 0 377.347 3.193 20 5 GGBDRN CC(C)Oc1ccc(CCNC(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000131344383 1416542759 /nfs/dbraw/zinc/54/27/59/1416542759.db2.gz DRZVQLCDLJXLFB-UHFFFAOYSA-N 0 0 397.475 3.099 20 5 GGBDRN C[N@@H+](Cc1ccccc1)CC1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])CC1 ZINC000131373567 1416547105 /nfs/dbraw/zinc/54/71/05/1416547105.db2.gz JYCJYCRWGYNUOX-UHFFFAOYSA-N 0 0 383.448 3.285 20 5 GGBDRN CN1C(=O)COc2ccc(NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)cc21 ZINC000131382793 1416548451 /nfs/dbraw/zinc/54/84/51/1416548451.db2.gz WMUKRMPADVMQGO-UHFFFAOYSA-N 0 0 395.293 3.221 20 5 GGBDRN COCc1ccc([C@H]2CCCN2[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1 ZINC000131385551 1416549027 /nfs/dbraw/zinc/54/90/27/1416549027.db2.gz WHYVJZLLIDMCLK-QZTJIDSGSA-N 0 0 385.420 3.277 20 5 GGBDRN CCOc1ccc(CN(C)C(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000131406228 1416552508 /nfs/dbraw/zinc/55/25/08/1416552508.db2.gz FMOVONADTYKIKL-UHFFFAOYSA-N 0 0 383.448 3.010 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1nc(COc3ccc(F)cc3)no1)CC2 ZINC000131414048 1416553909 /nfs/dbraw/zinc/55/39/09/1416553909.db2.gz OKGCCJZVHXUFLW-UHFFFAOYSA-N 0 0 384.367 3.254 20 5 GGBDRN CCCn1c(CO)nnc1SCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000131432968 1416556865 /nfs/dbraw/zinc/55/68/65/1416556865.db2.gz XAAFUDIKDORKAY-UHFFFAOYSA-N 0 0 375.410 3.036 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OCC(=O)NCC1(c2ccccc2)CCOCC1 ZINC000131433714 1416557268 /nfs/dbraw/zinc/55/72/68/1416557268.db2.gz HFGMGVCUTNQMCI-UHFFFAOYSA-N 0 0 384.432 3.147 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000131435995 1416557757 /nfs/dbraw/zinc/55/77/57/1416557757.db2.gz SCXFTVADMQRNRP-ZDUSSCGKSA-N 0 0 388.399 3.145 20 5 GGBDRN CN(C(=O)CN1CCc2ccc([N+](=O)[O-])cc2C1)c1nc2ccccc2s1 ZINC000131446819 1416559135 /nfs/dbraw/zinc/55/91/35/1416559135.db2.gz KVMRISGEJSEONB-UHFFFAOYSA-N 0 0 382.445 3.226 20 5 GGBDRN COCCOCCN(Cc1ccccc1)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000131454859 1416560290 /nfs/dbraw/zinc/56/02/90/1416560290.db2.gz VKEYSPGBGZGWME-UHFFFAOYSA-N 0 0 399.447 3.149 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1OCc1nnnn1-c1ccc(OC(F)F)cc1 ZINC000131455052 1416560446 /nfs/dbraw/zinc/56/04/46/1416560446.db2.gz MXNNDRIDLFHOJN-UHFFFAOYSA-N 0 0 377.307 3.059 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CCCN(c2ccccc2Cl)C1=O ZINC000131462490 1416561443 /nfs/dbraw/zinc/56/14/43/1416561443.db2.gz CTHGGMICYIOBKX-HNNXBMFYSA-N 0 0 387.823 3.103 20 5 GGBDRN COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1OCc1cnn(C)c1 ZINC000131464512 1416561891 /nfs/dbraw/zinc/56/18/91/1416561891.db2.gz AUXNLLTYAQODQT-UHFFFAOYSA-N 0 0 396.403 3.477 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000131467835 1416562298 /nfs/dbraw/zinc/56/22/98/1416562298.db2.gz CACNBCQNHIVHPY-SFHVURJKSA-N 0 0 395.371 3.041 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H]2C[C@@H]2c2sccc2C)c([N+](=O)[O-])cc1OC ZINC000178561262 1429107802 /nfs/dbraw/zinc/10/78/02/1429107802.db2.gz IBKRDRBFBLOGCF-UONOGXRCSA-N 0 0 390.461 3.444 20 5 GGBDRN C[C@@](O)(CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccsc1 ZINC000131481707 1416564303 /nfs/dbraw/zinc/56/43/03/1416564303.db2.gz DGNYPSUALOICSE-QGZVFWFLSA-N 0 0 389.458 3.417 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1cn(-c2cccc(C(F)(F)F)c2)nn1 ZINC000131490457 1416565714 /nfs/dbraw/zinc/56/57/14/1416565714.db2.gz IQBXXJXDQFVYTR-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N(C)c3ncccc3F)cc2)c(C)c1[N+](=O)[O-] ZINC000131499761 1416567033 /nfs/dbraw/zinc/56/70/33/1416567033.db2.gz FXQWJHMOFPLOCW-UHFFFAOYSA-N 0 0 383.383 3.267 20 5 GGBDRN Cc1nn(CCC(=O)Oc2cc(F)cc(Br)c2)c(C)c1[N+](=O)[O-] ZINC000131513075 1416569080 /nfs/dbraw/zinc/56/90/80/1416569080.db2.gz OZNNTUSPHSPKTQ-UHFFFAOYSA-N 0 0 386.177 3.305 20 5 GGBDRN COC[C@@H](C)n1c(C)cc(C(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)c1C ZINC000131512368 1416569174 /nfs/dbraw/zinc/56/91/74/1416569174.db2.gz GUDMQVSUDSFHJX-OAHLLOKOSA-N 0 0 385.464 3.462 20 5 GGBDRN CCCOc1cc(F)ccc1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000131520884 1416570383 /nfs/dbraw/zinc/57/03/83/1416570383.db2.gz PQUJZTYLIKQIQV-UHFFFAOYSA-N 0 0 385.355 3.356 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@@H]2C[C@@H](O)c2ccccc2)c1[N+](=O)[O-] ZINC000131535790 1416573101 /nfs/dbraw/zinc/57/31/01/1416573101.db2.gz QEVIVTRNRJKAOI-IAGOWNOFSA-N 0 0 386.452 3.145 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@](C)(O)c1ccc(F)cc1 ZINC000131546637 1416574102 /nfs/dbraw/zinc/57/41/02/1416574102.db2.gz TUVUVEBYOWKWIZ-KZULUSFZSA-N 0 0 378.425 3.238 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCO[C@H](c2ccccc2F)C1 ZINC000131552059 1416574561 /nfs/dbraw/zinc/57/45/61/1416574561.db2.gz RGFHELRJXQRQKP-IBGZPJMESA-N 0 0 396.378 3.133 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000131571627 1416577743 /nfs/dbraw/zinc/57/77/43/1416577743.db2.gz FMNCZROTYKTVFH-CQSZACIVSA-N 0 0 386.379 3.478 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000131571462 1416577755 /nfs/dbraw/zinc/57/77/55/1416577755.db2.gz FMNCZROTYKTVFH-AWEZNQCLSA-N 0 0 386.379 3.478 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1S(=O)(=O)NNc1c(Cl)cc(F)cc1Cl ZINC000131584927 1416580054 /nfs/dbraw/zinc/58/00/54/1416580054.db2.gz ZEPDUHZPOUZBGS-UHFFFAOYSA-N 0 0 398.174 3.485 20 5 GGBDRN CCS[C@H]1CC[C@H](N(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000131594822 1416582059 /nfs/dbraw/zinc/58/20/59/1416582059.db2.gz UPFHKKPHDKNMAU-KBPBESRZSA-N 0 0 379.482 3.283 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(OC[C@H]2CCOC2)CC1 ZINC000131600625 1416582770 /nfs/dbraw/zinc/58/27/70/1416582770.db2.gz BEFIFGZSCWYAIS-INIZCTEOSA-N 0 0 378.469 3.400 20 5 GGBDRN Cn1cc(C(=O)N[C@H](CCCO)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000131604763 1416583413 /nfs/dbraw/zinc/58/34/13/1416583413.db2.gz KTVPYEFRTFRVNX-LJQANCHMSA-N 0 0 394.431 3.239 20 5 GGBDRN C[C@@H](N1CCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1)C(F)(F)F ZINC000131611244 1416584441 /nfs/dbraw/zinc/58/44/41/1416584441.db2.gz KWJVPKGRLSMRGU-SECBINFHSA-N 0 0 399.291 3.322 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)n1 ZINC000131629348 1416587116 /nfs/dbraw/zinc/58/71/16/1416587116.db2.gz SAFLHFCYCJJIMK-UHFFFAOYSA-N 0 0 390.403 3.204 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1O ZINC000131636136 1416587615 /nfs/dbraw/zinc/58/76/15/1416587615.db2.gz PVSZWNGPAJXPGF-UHFFFAOYSA-N 0 0 398.156 3.466 20 5 GGBDRN Cc1cc(OC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)ccc1F ZINC000131645608 1416589650 /nfs/dbraw/zinc/58/96/50/1416589650.db2.gz HQGLSNVIFNUVFI-CYBMUJFWSA-N 0 0 378.381 3.314 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000131649846 1416590609 /nfs/dbraw/zinc/59/06/09/1416590609.db2.gz HGWATOSZNGHDJX-UHFFFAOYSA-N 0 0 388.811 3.198 20 5 GGBDRN CN(Cc1ccccc1N1CCCC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000131656201 1416591449 /nfs/dbraw/zinc/59/14/49/1416591449.db2.gz MLJSBWPKBCYFRZ-NRFANRHFSA-N 0 0 394.475 3.432 20 5 GGBDRN COc1ccc(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000131669508 1416593528 /nfs/dbraw/zinc/59/35/28/1416593528.db2.gz ODVPJEJTLCGLDF-CYBMUJFWSA-N 0 0 385.203 3.374 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000131676450 1416595341 /nfs/dbraw/zinc/59/53/41/1416595341.db2.gz MFJZBEQMMSWTFX-HNNXBMFYSA-N 0 0 386.379 3.234 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000131701005 1416599353 /nfs/dbraw/zinc/59/93/53/1416599353.db2.gz GIYOKMKEYDDYPE-HNNXBMFYSA-N 0 0 386.379 3.478 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000131701196 1416599369 /nfs/dbraw/zinc/59/93/69/1416599369.db2.gz GIYOKMKEYDDYPE-OAHLLOKOSA-N 0 0 386.379 3.478 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000131707438 1416601195 /nfs/dbraw/zinc/60/11/95/1416601195.db2.gz MLXFOPLVNDZWPW-PKOBYXMFSA-N 0 0 397.431 3.096 20 5 GGBDRN Cn1cnc(-c2ccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)cc2)n1 ZINC000131713728 1416602730 /nfs/dbraw/zinc/60/27/30/1416602730.db2.gz FZPRJGLRNDFEIN-UHFFFAOYSA-N 0 0 376.376 3.053 20 5 GGBDRN Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000131727866 1416605933 /nfs/dbraw/zinc/60/59/33/1416605933.db2.gz CWMMGZLIHYTVEC-RDJZCZTQSA-N 0 0 381.432 3.038 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000131750780 1416611695 /nfs/dbraw/zinc/61/16/95/1416611695.db2.gz FXGQPHFBMBQSBN-GFCCVEGCSA-N 0 0 389.358 3.190 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000131753822 1416612049 /nfs/dbraw/zinc/61/20/49/1416612049.db2.gz GGCLLNIFUFNHIN-QGZVFWFLSA-N 0 0 395.419 3.034 20 5 GGBDRN Cc1ccc(OC(=O)CSc2nnc(-c3cccs3)n2C)cc1[N+](=O)[O-] ZINC000131755543 1416613108 /nfs/dbraw/zinc/61/31/08/1416613108.db2.gz JSHJNFPFDXUWFA-UHFFFAOYSA-N 0 0 390.446 3.458 20 5 GGBDRN O=C(NCc1csc(-c2ccco2)n1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000131780757 1416618954 /nfs/dbraw/zinc/61/89/54/1416618954.db2.gz BWUUWXNBTXHNHN-UHFFFAOYSA-N 0 0 395.400 3.427 20 5 GGBDRN Cc1c(C(=O)Nc2cnccc2OC(C)(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000131784940 1416620106 /nfs/dbraw/zinc/62/01/06/1416620106.db2.gz ISLUWFVBGPBYHD-UHFFFAOYSA-N 0 0 396.407 3.309 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000131808555 1416625966 /nfs/dbraw/zinc/62/59/66/1416625966.db2.gz VYAQMHDQOONKGX-BDJLRTHQSA-N 0 0 375.450 3.473 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1c(Cl)cccc1Cl ZINC000131812898 1416626839 /nfs/dbraw/zinc/62/68/39/1416626839.db2.gz FYNKCMRBKREPKB-CQSZACIVSA-N 0 0 385.203 3.130 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2-n2cccn2)c([N+](=O)[O-])c1 ZINC000131821864 1416629195 /nfs/dbraw/zinc/62/91/95/1416629195.db2.gz CFXDJDIFUMYVDA-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN Cn1cccc1[C@H]1COCCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000131824239 1416629545 /nfs/dbraw/zinc/62/95/45/1416629545.db2.gz XRSLXBVVSKXBES-GOSISDBHSA-N 0 0 382.420 3.204 20 5 GGBDRN Cn1cccc1[C@@H]1COCCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000131824044 1416629710 /nfs/dbraw/zinc/62/97/10/1416629710.db2.gz XRSLXBVVSKXBES-SFHVURJKSA-N 0 0 382.420 3.204 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H](O)c2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000178581857 1429113746 /nfs/dbraw/zinc/11/37/46/1429113746.db2.gz KPEULQGCOMYHDM-LJQANCHMSA-N 0 0 386.429 3.068 20 5 GGBDRN Cc1ccc(OC(=O)Cc2csc(NC(=O)c3ccco3)n2)cc1[N+](=O)[O-] ZINC000131835467 1416631954 /nfs/dbraw/zinc/63/19/54/1416631954.db2.gz WWVOYUCRILUKSU-UHFFFAOYSA-N 0 0 387.373 3.353 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@H](O)c2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000178581843 1429113823 /nfs/dbraw/zinc/11/38/23/1429113823.db2.gz KPEULQGCOMYHDM-IBGZPJMESA-N 0 0 386.429 3.068 20 5 GGBDRN O=C(NC1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)Oc1ccccc1 ZINC000131892283 1416642846 /nfs/dbraw/zinc/64/28/46/1416642846.db2.gz MQHAEUSPQVBYCO-UHFFFAOYSA-N 0 0 397.431 3.307 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000178587278 1429114860 /nfs/dbraw/zinc/11/48/60/1429114860.db2.gz VSPQRJRASASJCQ-SFHVURJKSA-N 0 0 387.436 3.177 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000131917887 1416650737 /nfs/dbraw/zinc/65/07/37/1416650737.db2.gz HHXJGGFSKKPDQG-GFCCVEGCSA-N 0 0 398.448 3.388 20 5 GGBDRN CC(=O)N[C@H](CC(=O)Oc1ccc(C)c([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000131992826 1416667992 /nfs/dbraw/zinc/66/79/92/1416667992.db2.gz MXZFQSPZFLUUHG-OAHLLOKOSA-N 0 0 378.331 3.354 20 5 GGBDRN CCCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@H]1C[C@H](OCC)C12CCCC2 ZINC000131998575 1416670045 /nfs/dbraw/zinc/67/00/45/1416670045.db2.gz VKNJBPXPIHOTOE-GJZGRUSLSA-N 0 0 378.473 3.227 20 5 GGBDRN CCCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@H]1C[C@@H](OCC)C12CCCC2 ZINC000131998996 1416670372 /nfs/dbraw/zinc/67/03/72/1416670372.db2.gz VKNJBPXPIHOTOE-LSDHHAIUSA-N 0 0 378.473 3.227 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c1 ZINC000132011799 1416672638 /nfs/dbraw/zinc/67/26/38/1416672638.db2.gz RJBAORCSXKDUNX-UHFFFAOYSA-N 0 0 384.421 3.242 20 5 GGBDRN CCCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@@H]1C[C@H](OCC)C12CCCC2 ZINC000132010966 1416672682 /nfs/dbraw/zinc/67/26/82/1416672682.db2.gz XGEJGSQOFSZPTP-CVEARBPZSA-N 0 0 378.473 3.076 20 5 GGBDRN CCCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@H]1C[C@H](OCC)C12CCCC2 ZINC000132011177 1416672924 /nfs/dbraw/zinc/67/29/24/1416672924.db2.gz XGEJGSQOFSZPTP-HOTGVXAUSA-N 0 0 378.473 3.076 20 5 GGBDRN CCCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@@H]1C[C@@H](OCC)C12CCCC2 ZINC000132011352 1416672943 /nfs/dbraw/zinc/67/29/43/1416672943.db2.gz XGEJGSQOFSZPTP-HZPDHXFCSA-N 0 0 378.473 3.076 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000132015319 1416674032 /nfs/dbraw/zinc/67/40/32/1416674032.db2.gz IHJBKDAKGRBWPO-SFHVURJKSA-N 0 0 387.392 3.197 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000132017587 1416674959 /nfs/dbraw/zinc/67/49/59/1416674959.db2.gz XVSWMQJQNYGSBX-UHFFFAOYSA-N 0 0 393.407 3.095 20 5 GGBDRN CC1CCN(c2ccc(CNC(=O)Cc3ccc([N+](=O)[O-])cc3F)cn2)CC1 ZINC000132043894 1416681450 /nfs/dbraw/zinc/68/14/50/1416681450.db2.gz AQCWXKSKHLMWGJ-UHFFFAOYSA-N 0 0 386.427 3.224 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)NCCc2cccc([N+](=O)[O-])c2)n1 ZINC000132099745 1416695652 /nfs/dbraw/zinc/69/56/52/1416695652.db2.gz FQVFLTMRCCVPMX-UHFFFAOYSA-N 0 0 380.408 3.157 20 5 GGBDRN Cc1c(CC(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000132100117 1416695856 /nfs/dbraw/zinc/69/58/56/1416695856.db2.gz SWKPTQGMHZHUMZ-MRXNPFEDSA-N 0 0 398.337 3.194 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2I)CC[C@@H]1C ZINC000132103582 1416696978 /nfs/dbraw/zinc/69/69/78/1416696978.db2.gz KIJDLLGAYNNPII-UWVGGRQHSA-N 0 0 388.205 3.318 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000132104131 1416696988 /nfs/dbraw/zinc/69/69/88/1416696988.db2.gz SURGLVRZOMMFMU-AWEZNQCLSA-N 0 0 391.786 3.313 20 5 GGBDRN CCC(=O)c1cccc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1 ZINC000132108172 1416697449 /nfs/dbraw/zinc/69/74/49/1416697449.db2.gz PHLUYEBLCNRVBE-UHFFFAOYSA-N 0 0 379.376 3.329 20 5 GGBDRN Cc1c(CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000132117667 1416700352 /nfs/dbraw/zinc/70/03/52/1416700352.db2.gz RHSRZOSTXAJXGK-MRXNPFEDSA-N 0 0 382.338 3.314 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000132139445 1416705769 /nfs/dbraw/zinc/70/57/69/1416705769.db2.gz OOOBKKJNOHMKIT-ZIAGYGMSSA-N 0 0 384.436 3.039 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000132139258 1416705888 /nfs/dbraw/zinc/70/58/88/1416705888.db2.gz OOOBKKJNOHMKIT-KBPBESRZSA-N 0 0 384.436 3.039 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000132141930 1416706356 /nfs/dbraw/zinc/70/63/56/1416706356.db2.gz XUKJYDZWTJSHPI-GFCCVEGCSA-N 0 0 379.394 3.167 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC(C)(C)c2ccccc21 ZINC000178608238 1429120841 /nfs/dbraw/zinc/12/08/41/1429120841.db2.gz LWCKBJJVTUDQJX-MRXNPFEDSA-N 0 0 383.404 3.081 20 5 GGBDRN CC[C@@H](CS(=O)(=O)c1ccccc1)Nc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000132161589 1416709755 /nfs/dbraw/zinc/70/97/55/1416709755.db2.gz DAOZHTGYHGKDCQ-HNNXBMFYSA-N 0 0 376.434 3.462 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)c2)n1 ZINC000132169205 1416710830 /nfs/dbraw/zinc/71/08/30/1416710830.db2.gz LLJGMGPXABVWJE-UHFFFAOYSA-N 0 0 396.378 3.228 20 5 GGBDRN Nc1c(C(=O)N2CCC(Oc3ccc(F)cc3F)CC2)cc(F)cc1[N+](=O)[O-] ZINC000132174789 1416711808 /nfs/dbraw/zinc/71/18/08/1416711808.db2.gz ZFFJJRKCNLHZEX-UHFFFAOYSA-N 0 0 395.337 3.278 20 5 GGBDRN COc1ccc(C(=O)Nc2cccn(Cc3ccc(C)cc3)c2=O)cc1[N+](=O)[O-] ZINC000132230244 1416721023 /nfs/dbraw/zinc/72/10/23/1416721023.db2.gz MZSRJUUEFCMLOL-UHFFFAOYSA-N 0 0 393.399 3.374 20 5 GGBDRN Cc1ccc(Cn2cccc(NC(=O)COc3cccc([N+](=O)[O-])c3)c2=O)cc1 ZINC000132235763 1416721580 /nfs/dbraw/zinc/72/15/80/1416721580.db2.gz IUHNNHVWMUTPSO-UHFFFAOYSA-N 0 0 393.399 3.131 20 5 GGBDRN CC(C)(C)Oc1ccncc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000132242001 1416722469 /nfs/dbraw/zinc/72/24/69/1416722469.db2.gz SUDVZEKDUNJYND-UHFFFAOYSA-N 0 0 382.376 3.261 20 5 GGBDRN CC[C@H](NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCCO1 ZINC000132248431 1416723356 /nfs/dbraw/zinc/72/33/56/1416723356.db2.gz LCKJKRDMNQFBLE-ROUUACIJSA-N 0 0 377.441 3.105 20 5 GGBDRN CC[C@H](NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCCO1 ZINC000132248808 1416723422 /nfs/dbraw/zinc/72/34/22/1416723422.db2.gz LCKJKRDMNQFBLE-ZWKOTPCHSA-N 0 0 377.441 3.105 20 5 GGBDRN CC[C@@H](NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCCO1 ZINC000132248985 1416723834 /nfs/dbraw/zinc/72/38/34/1416723834.db2.gz LCKJKRDMNQFBLE-QZTJIDSGSA-N 0 0 377.441 3.105 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000132252950 1416724377 /nfs/dbraw/zinc/72/43/77/1416724377.db2.gz KSFDAPMBLFYKMO-VQIMIIECSA-N 0 0 384.436 3.226 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000132282781 1416728437 /nfs/dbraw/zinc/72/84/37/1416728437.db2.gz WGDMSTHNGSIWDI-AWEZNQCLSA-N 0 0 395.749 3.062 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)C(=O)NCc2cccc([N+](=O)[O-])c2)n1 ZINC000178622518 1429123705 /nfs/dbraw/zinc/12/37/05/1429123705.db2.gz WYRFETAQVOUMPK-NSHDSACASA-N 0 0 379.442 3.134 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC(N2CCCCC2=O)CC1 ZINC000132285873 1416729495 /nfs/dbraw/zinc/72/94/95/1416729495.db2.gz MVKFVNZRPOUIJD-UHFFFAOYSA-N 0 0 399.369 3.231 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1nc(C2CC2)no1 ZINC000132299317 1416731217 /nfs/dbraw/zinc/73/12/17/1416731217.db2.gz LTAJTWYWXULPNO-MRXNPFEDSA-N 0 0 396.407 3.168 20 5 GGBDRN Cc1ccc(Cn2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)c2=O)cc1 ZINC000132301489 1416731679 /nfs/dbraw/zinc/73/16/79/1416731679.db2.gz FVLGZIUFWUSGDH-UHFFFAOYSA-N 0 0 377.400 3.294 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCCc1c[nH]c2ccccc12 ZINC000132310808 1416733097 /nfs/dbraw/zinc/73/30/97/1416733097.db2.gz WRNQRTZNAQLUIC-UHFFFAOYSA-N 0 0 377.397 3.045 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1nc2ccccc2s1 ZINC000132309246 1416733103 /nfs/dbraw/zinc/73/31/03/1416733103.db2.gz DKRHQINZHPQFOL-UHFFFAOYSA-N 0 0 395.437 3.473 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000132316286 1416734388 /nfs/dbraw/zinc/73/43/88/1416734388.db2.gz PJDCEXGLFZSERW-UHFFFAOYSA-N 0 0 399.750 3.163 20 5 GGBDRN CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)c1 ZINC000132318706 1416735141 /nfs/dbraw/zinc/73/51/41/1416735141.db2.gz IKKYTDQMGIFYFW-UHFFFAOYSA-N 0 0 381.385 3.110 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000132332076 1416738305 /nfs/dbraw/zinc/73/83/05/1416738305.db2.gz ZOFKVQWPSSFGEY-UHFFFAOYSA-N 0 0 392.165 3.468 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000132335224 1416739030 /nfs/dbraw/zinc/73/90/30/1416739030.db2.gz OLFYMYGCJLDMIH-CQSZACIVSA-N 0 0 379.432 3.283 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)c1 ZINC000132342639 1416741307 /nfs/dbraw/zinc/74/13/07/1416741307.db2.gz WYTKMCAHWNMDNY-LLVKDONJSA-N 0 0 395.412 3.040 20 5 GGBDRN Cc1ccc(NC(=O)Cn2c(=O)onc2-c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000132356558 1416744325 /nfs/dbraw/zinc/74/43/25/1416744325.db2.gz BBYQBAJKOUUKIQ-UHFFFAOYSA-N 0 0 388.767 3.012 20 5 GGBDRN CCOc1cc(C)ccc1CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000132369553 1416747106 /nfs/dbraw/zinc/74/71/06/1416747106.db2.gz ROBUGMQGKUPSJL-UHFFFAOYSA-N 0 0 391.811 3.210 20 5 GGBDRN CN(Cc1ccc(Cl)s1)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000132375693 1416747966 /nfs/dbraw/zinc/74/79/66/1416747966.db2.gz GUOZLOIMKHTODS-UHFFFAOYSA-N 0 0 380.813 3.216 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000132394430 1416751467 /nfs/dbraw/zinc/75/14/67/1416751467.db2.gz VDCKIMKIRGVSNG-AWEZNQCLSA-N 0 0 385.395 3.360 20 5 GGBDRN COc1ccc(CN2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000132397177 1416752083 /nfs/dbraw/zinc/75/20/83/1416752083.db2.gz QVGCWJXVDMMSFN-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN O=C(Oc1cc(F)cc([N+](=O)[O-])c1)[C@@H]1CCCN1c1ncnc2sccc21 ZINC000132420169 1416756738 /nfs/dbraw/zinc/75/67/38/1416756738.db2.gz INTILQGGEZVIFX-AWEZNQCLSA-N 0 0 388.380 3.313 20 5 GGBDRN COc1ccc(-c2noc(CCC(=O)Oc3cc(F)cc([N+](=O)[O-])c3)n2)cc1 ZINC000132427177 1416758118 /nfs/dbraw/zinc/75/81/18/1416758118.db2.gz PQDBTOKUCYUZFJ-UHFFFAOYSA-N 0 0 387.323 3.331 20 5 GGBDRN CCCOc1ccc2c(c1)CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C2 ZINC000132430695 1416758705 /nfs/dbraw/zinc/75/87/05/1416758705.db2.gz GYHCTZGQRREJJQ-UHFFFAOYSA-N 0 0 386.452 3.172 20 5 GGBDRN O=C(Nc1cccc(-n2ccnn2)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000132430481 1416758824 /nfs/dbraw/zinc/75/88/24/1416758824.db2.gz DPWDOUCFPYCXRU-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN Cc1nn(-c2nc(C)cc(C)n2)c(C)c1CC(=O)Oc1cc(F)cc([N+](=O)[O-])c1 ZINC000132434683 1416759568 /nfs/dbraw/zinc/75/95/68/1416759568.db2.gz ZQXBDRXCODKVFD-UHFFFAOYSA-N 0 0 399.382 3.091 20 5 GGBDRN O=C(c1ccc(NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c([N+](=O)[O-])c1)N1CCOCC1 ZINC000132440255 1416760671 /nfs/dbraw/zinc/76/06/71/1416760671.db2.gz QKFSMHWBOQJPIR-UEXGIBASSA-N 0 0 393.443 3.065 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000132440224 1416761017 /nfs/dbraw/zinc/76/10/17/1416761017.db2.gz WABOILLIJJOZFB-CYBMUJFWSA-N 0 0 391.449 3.232 20 5 GGBDRN O=c1c(Cl)c(N2CCc3ccsc3C2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000132451680 1416763054 /nfs/dbraw/zinc/76/30/54/1416763054.db2.gz PPNFCNRRCZRYAW-UHFFFAOYSA-N 0 0 388.836 3.418 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000132453762 1416763558 /nfs/dbraw/zinc/76/35/58/1416763558.db2.gz CULCYRMMRGTFIR-DOMZBBRYSA-N 0 0 390.383 3.398 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C12CCC2 ZINC000132459714 1416764976 /nfs/dbraw/zinc/76/49/76/1416764976.db2.gz MOSYDFSOFBAYRC-ZWKOTPCHSA-N 0 0 384.436 3.200 20 5 GGBDRN O=C(Oc1cc(F)cc([N+](=O)[O-])c1)c1cc(N2CCNC2=O)ccc1Cl ZINC000132491388 1416772651 /nfs/dbraw/zinc/77/26/51/1416772651.db2.gz GLDFFESXNGRMLB-UHFFFAOYSA-N 0 0 379.731 3.136 20 5 GGBDRN CC(C)(C)C(=O)NCc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000132505628 1416775339 /nfs/dbraw/zinc/77/53/39/1416775339.db2.gz WRJMGTWDGFWKIJ-UHFFFAOYSA-N 0 0 381.432 3.460 20 5 GGBDRN Cc1c(C(=O)N[C@@H](CCCO)c2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000132523458 1416777218 /nfs/dbraw/zinc/77/72/18/1416777218.db2.gz PBEBVSPJNIFEAG-INIZCTEOSA-N 0 0 387.392 3.363 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](CC(=O)Oc2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000132528987 1416779197 /nfs/dbraw/zinc/77/91/97/1416779197.db2.gz YRBLFYBCXMYULT-CYBMUJFWSA-N 0 0 381.404 3.107 20 5 GGBDRN Cc1c(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)nnn1-c1cccc2cnccc21 ZINC000132540251 1416781520 /nfs/dbraw/zinc/78/15/20/1416781520.db2.gz MBNBGJWMOIHVLA-UHFFFAOYSA-N 0 0 393.334 3.390 20 5 GGBDRN COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)c1ccc(F)cc1[N+](=O)[O-])CC3 ZINC000132542349 1416782145 /nfs/dbraw/zinc/78/21/45/1416782145.db2.gz NUFUWXDLSOXKFW-UHFFFAOYSA-N 0 0 397.362 3.200 20 5 GGBDRN Cc1cccc([C@@H](O)CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])c1 ZINC000132559818 1416785014 /nfs/dbraw/zinc/78/50/14/1416785014.db2.gz AWUKDEXXNUVDQO-SFHVURJKSA-N 0 0 380.404 3.013 20 5 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C[C@@H](C[C@@H](O)c1cccs1)NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000132860226 1416824188 /nfs/dbraw/zinc/82/41/88/1416824188.db2.gz PJDWFRPQVDWPFV-XJKSGUPXSA-N 0 0 377.466 3.477 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(CNC3(c4cccc(F)c4)CCOCC3)n2)cc1 ZINC000132858908 1416824214 /nfs/dbraw/zinc/82/42/14/1416824214.db2.gz XVAGJEZYVGVRPI-UHFFFAOYSA-N 0 0 397.410 3.245 20 5 GGBDRN O=C(NCc1ccc(O)c(F)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000132910302 1416829938 /nfs/dbraw/zinc/82/99/38/1416829938.db2.gz JDPHLSZBFMVRLE-UHFFFAOYSA-N 0 0 388.273 3.311 20 5 GGBDRN O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)Nc1c(F)cccc1NC1CC1 ZINC000132920101 1416831166 /nfs/dbraw/zinc/83/11/66/1416831166.db2.gz XGUJQLUQUFJPSJ-UHFFFAOYSA-N 0 0 387.367 3.261 20 5 GGBDRN CCOC(=O)C[C@@H](C)CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000132951358 1416834778 /nfs/dbraw/zinc/83/47/78/1416834778.db2.gz LGNAYUJACLXTKC-SECBINFHSA-N 0 0 388.218 3.068 20 5 GGBDRN O=C(Nc1cccc(OCC(F)F)n1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000132965900 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BKGONZQVNYXIAI-UHFFFAOYSA-N 0 0 397.309 3.499 20 5 GGBDRN NC(=O)C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCCCC1 ZINC000133195434 1416862848 /nfs/dbraw/zinc/86/28/48/1416862848.db2.gz LTTRBVARRFLZDJ-CQSZACIVSA-N 0 0 387.358 3.168 20 5 GGBDRN COC(=O)CCc1nc(COc2ccc(Cc3ccccc3)cc2[N+](=O)[O-])no1 ZINC000178678234 1429138120 /nfs/dbraw/zinc/13/81/20/1429138120.db2.gz VIMKVQVPDHPDDF-UHFFFAOYSA-N 0 0 397.387 3.253 20 5 GGBDRN CC(C)[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)S(=O)(=O)C1CCCCC1 ZINC000133214707 1416865423 /nfs/dbraw/zinc/86/54/23/1416865423.db2.gz RPWPYXATUUQKCM-GOSISDBHSA-N 0 0 396.509 3.026 20 5 GGBDRN O=C(NCCc1cn2c(n1)CCCC2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000133237970 1416868895 /nfs/dbraw/zinc/86/88/95/1416868895.db2.gz FIYLARXWGRBXKQ-UHFFFAOYSA-N 0 0 383.452 3.044 20 5 GGBDRN NC(=O)c1ccc(CN2CCC[C@@H](Oc3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000133248792 1416869828 /nfs/dbraw/zinc/86/98/28/1416869828.db2.gz ZURGJTGPLHCDPM-OAHLLOKOSA-N 0 0 389.839 3.391 20 5 GGBDRN Cc1ccc(C)c(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000133248179 1416869890 /nfs/dbraw/zinc/86/98/90/1416869890.db2.gz UEOJERYKGMTLFB-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN Cc1cc(C(=O)NCCc2cccc([N+](=O)[O-])c2)c(C)n1Cc1ccccn1 ZINC000133246993 1416869988 /nfs/dbraw/zinc/86/99/88/1416869988.db2.gz WNQRFZKHCBXMSC-UHFFFAOYSA-N 0 0 378.432 3.429 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(Oc3cccnc3)nc2)c(C)c1[N+](=O)[O-] ZINC000133251924 1416870402 /nfs/dbraw/zinc/87/04/02/1416870402.db2.gz FHOUPDQVLRHRIQ-UHFFFAOYSA-N 0 0 382.380 3.019 20 5 GGBDRN COCCC1(CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)CCCC1 ZINC000133257683 1416871254 /nfs/dbraw/zinc/87/12/54/1416871254.db2.gz DEIHKRUBQVUCJE-UHFFFAOYSA-N 0 0 379.413 3.447 20 5 GGBDRN O=C(CCC(=O)N1CCSc2ccccc21)NCCc1cccc([N+](=O)[O-])c1 ZINC000133268411 1416872400 /nfs/dbraw/zinc/87/24/00/1416872400.db2.gz HXFSSNWLRNTEID-UHFFFAOYSA-N 0 0 399.472 3.173 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000133272747 1416873086 /nfs/dbraw/zinc/87/30/86/1416873086.db2.gz GGELOCRJSZEEJN-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN CCc1cccc(C)c1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000133294744 1416875438 /nfs/dbraw/zinc/87/54/38/1416875438.db2.gz ZDNFECDSBWQXON-UHFFFAOYSA-N 0 0 396.447 3.456 20 5 GGBDRN COCCOc1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1Cl ZINC000133314517 1416877559 /nfs/dbraw/zinc/87/75/59/1416877559.db2.gz PYNGSEUXYBCJHV-UHFFFAOYSA-N 0 0 390.783 3.402 20 5 GGBDRN COC(=O)Cc1ccc(OC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000133327745 1416879206 /nfs/dbraw/zinc/87/92/06/1416879206.db2.gz JWCNFAPHCUVYJW-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000133337514 1416880149 /nfs/dbraw/zinc/88/01/49/1416880149.db2.gz CWZZYHXXMDRORF-HXUWFJFHSA-N 0 0 390.443 3.468 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1sccc1NC(=O)c1ccncc1 ZINC000133337152 1416880201 /nfs/dbraw/zinc/88/02/01/1416880201.db2.gz UKOSRZQCGXQQDY-UHFFFAOYSA-N 0 0 396.428 3.276 20 5 GGBDRN CSC[C@@H]1CCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000133344347 1416880761 /nfs/dbraw/zinc/88/07/61/1416880761.db2.gz GDWREIQEVLZDMF-AWEZNQCLSA-N 0 0 399.538 3.101 20 5 GGBDRN CN(Cc1cc2ccccc2o1)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133342926 1416880880 /nfs/dbraw/zinc/88/08/80/1416880880.db2.gz ROINFUNNPVYEJK-UHFFFAOYSA-N 0 0 380.360 3.247 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CSc3nnnn3-c3ccc(O)cc3)co2)cc1 ZINC000133351999 1416881479 /nfs/dbraw/zinc/88/14/79/1416881479.db2.gz SXNNAZJSQVGGNZ-UHFFFAOYSA-N 0 0 396.388 3.223 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000133378173 1416883961 /nfs/dbraw/zinc/88/39/61/1416883961.db2.gz SECGDIJRUQDNTI-DZGCQCFKSA-N 0 0 377.441 3.360 20 5 GGBDRN Cc1ccc(F)cc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000133396571 1416885899 /nfs/dbraw/zinc/88/58/99/1416885899.db2.gz LTBCCPODQXZRPQ-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc(-c2n[nH]c(C3CC3)n2)cc1 ZINC000133414073 1416887402 /nfs/dbraw/zinc/88/74/02/1416887402.db2.gz GTNABSGHHOHWQX-UHFFFAOYSA-N 0 0 377.404 3.230 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccc(C(=O)Nc2ccccc2)nn1 ZINC000133422801 1416888294 /nfs/dbraw/zinc/88/82/94/1416888294.db2.gz GQANBPKHCXGZBE-UHFFFAOYSA-N 0 0 379.376 3.258 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)C[C@H](O)c2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000133442112 1416890274 /nfs/dbraw/zinc/89/02/74/1416890274.db2.gz GQDAGFXVZNNPIQ-GTNSWQLSSA-N 0 0 387.392 3.362 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1cccc(OC(F)(F)F)c1 ZINC000133456136 1416891505 /nfs/dbraw/zinc/89/15/05/1416891505.db2.gz REBDRDHITRCPLP-UHFFFAOYSA-N 0 0 390.339 3.478 20 5 GGBDRN Cc1nc(N(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000133457550 1416891508 /nfs/dbraw/zinc/89/15/08/1416891508.db2.gz OXTWZDXTQXMONG-ZDUSSCGKSA-N 0 0 385.342 3.193 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2ccc(-n3ccnc3C)c(F)c2)c1[N+](=O)[O-] ZINC000133460630 1416892185 /nfs/dbraw/zinc/89/21/85/1416892185.db2.gz MNJSNZHTHFYMPU-UHFFFAOYSA-N 0 0 399.382 3.412 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000133510941 1416896921 /nfs/dbraw/zinc/89/69/21/1416896921.db2.gz AYMIRMMWJXZCHY-UHFFFAOYSA-N 0 0 397.840 3.191 20 5 GGBDRN Cc1cccc(Cl)c1NC(=O)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000133534874 1416899111 /nfs/dbraw/zinc/89/91/11/1416899111.db2.gz GDNRYQIBURQBGA-CYBMUJFWSA-N 0 0 389.843 3.077 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2cn(Cc3cccc(F)c3)nn2)cc1[N+](=O)[O-] ZINC000133561318 1416904665 /nfs/dbraw/zinc/90/46/65/1416904665.db2.gz VIITUUWDSCZKGS-CYBMUJFWSA-N 0 0 383.383 3.173 20 5 GGBDRN COc1cc2[nH]c(CCCNc3ccc(C(N)=O)cc3[N+](=O)[O-])cc2c(OC)c1 ZINC000133582204 1416910781 /nfs/dbraw/zinc/91/07/81/1416910781.db2.gz RYAMHFSVNWBNBY-UHFFFAOYSA-N 0 0 398.419 3.237 20 5 GGBDRN O=C(c1ccccc1)c1ccc(N2CCOC3(CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000133594100 1416913962 /nfs/dbraw/zinc/91/39/62/1416913962.db2.gz YRGVIGCLIDCBAR-UHFFFAOYSA-N 0 0 382.416 3.212 20 5 GGBDRN CCc1cc(N2CCOC3(CCOCC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000133597437 1416915419 /nfs/dbraw/zinc/91/54/19/1416915419.db2.gz YCBXZWHYGVOBRQ-UHFFFAOYSA-N 0 0 384.436 3.000 20 5 GGBDRN CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000133611814 1416919425 /nfs/dbraw/zinc/91/94/25/1416919425.db2.gz QPJXIYYYXNKQGO-SCLBCKFNSA-N 0 0 396.447 3.236 20 5 GGBDRN Cc1c(CC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000178695112 1429143452 /nfs/dbraw/zinc/14/34/52/1429143452.db2.gz ONICVNYEUGRNSD-HNNXBMFYSA-N 0 0 391.468 3.209 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cccc(C(=O)N2CCCC2)c1 ZINC000133630918 1416925315 /nfs/dbraw/zinc/92/53/15/1416925315.db2.gz QXRRSNDYLOIQKM-UHFFFAOYSA-N 0 0 392.415 3.493 20 5 GGBDRN Cc1ccc(-c2noc(CCC(=O)Nc3ccc([N+](=O)[O-])c(C)n3)n2)cc1F ZINC000133647184 1416930496 /nfs/dbraw/zinc/93/04/96/1416930496.db2.gz SHNPKKGUMYALGS-UHFFFAOYSA-N 0 0 385.355 3.367 20 5 GGBDRN Cc1nncn1-c1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1 ZINC000133649570 1416931207 /nfs/dbraw/zinc/93/12/07/1416931207.db2.gz NORLMPPDDYHYDB-UHFFFAOYSA-N 0 0 396.363 3.261 20 5 GGBDRN Cc1nc(NC(=O)CSc2nnc(-c3ccc(F)cc3)o2)ccc1[N+](=O)[O-] ZINC000133676234 1416938269 /nfs/dbraw/zinc/93/82/69/1416938269.db2.gz UZFKIMRSXNKMPL-UHFFFAOYSA-N 0 0 389.368 3.218 20 5 GGBDRN O=C(Cn1ccnc1[C@H](O)c1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000133699246 1416946011 /nfs/dbraw/zinc/94/60/11/1416946011.db2.gz YDGPXUFIPCGSRJ-QGZVFWFLSA-N 0 0 386.795 3.165 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000133714266 1416949582 /nfs/dbraw/zinc/94/95/82/1416949582.db2.gz FQAQWPAWQCQAJX-IMJJTQAJSA-N 0 0 385.445 3.406 20 5 GGBDRN CCn1cnnc1-c1ccccc1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000133727669 1416952257 /nfs/dbraw/zinc/95/22/57/1416952257.db2.gz OVQBDQWVPCUDMS-UHFFFAOYSA-N 0 0 392.419 3.463 20 5 GGBDRN Cc1c(NC(=O)CNC(=O)c2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000133766890 1416959671 /nfs/dbraw/zinc/95/96/71/1416959671.db2.gz AWRWJZHQTDROHT-UHFFFAOYSA-N 0 0 381.310 3.291 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000133789272 1416964121 /nfs/dbraw/zinc/96/41/21/1416964121.db2.gz SQFWWUKZBXMIEB-SFHVURJKSA-N 0 0 396.403 3.150 20 5 GGBDRN O=Cc1cc([N+](=O)[O-])ccc1OCc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC000133842752 1416975983 /nfs/dbraw/zinc/97/59/83/1416975983.db2.gz NOZJZZHCKMNYEV-UHFFFAOYSA-N 0 0 379.250 3.454 20 5 GGBDRN Cc1cccc2c(CC(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c[nH]c21 ZINC000133842697 1416976080 /nfs/dbraw/zinc/97/60/80/1416976080.db2.gz ZORUQXJXRAIPEH-OAHLLOKOSA-N 0 0 379.420 3.035 20 5 GGBDRN COc1cc(CN2CCc3ccccc3[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000133875735 1416984998 /nfs/dbraw/zinc/98/49/98/1416984998.db2.gz XJGFEDVBUSFVRY-MRXNPFEDSA-N 0 0 394.374 3.297 20 5 GGBDRN O=C(CCNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)NC1CCCCC1 ZINC000133890937 1416989483 /nfs/dbraw/zinc/98/94/83/1416989483.db2.gz SVQQGEXOKWDMBL-UHFFFAOYSA-N 0 0 388.468 3.108 20 5 GGBDRN Cc1cc(F)cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1[N+](=O)[O-] ZINC000133934278 1416997727 /nfs/dbraw/zinc/99/77/27/1416997727.db2.gz HSKSJGOLDLQDEY-CQSZACIVSA-N 0 0 383.420 3.321 20 5 GGBDRN O=C(NC1CCC(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1)C1CCCC1 ZINC000133934797 1416997845 /nfs/dbraw/zinc/99/78/45/1416997845.db2.gz PPMWJCONNTZCOH-UHFFFAOYSA-N 0 0 385.464 3.349 20 5 GGBDRN Cc1cc(F)cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)c1[N+](=O)[O-] ZINC000133934055 1416998026 /nfs/dbraw/zinc/99/80/26/1416998026.db2.gz HSKSJGOLDLQDEY-AWEZNQCLSA-N 0 0 383.420 3.321 20 5 GGBDRN O=C(NC1CC1)c1ccc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000133949920 1417000693 /nfs/dbraw/zinc/00/06/93/1417000693.db2.gz FQFJDILECDDEOL-UHFFFAOYSA-N 0 0 379.416 3.292 20 5 GGBDRN Cc1nc(NC(=O)[C@@H](C(C)C)S(=O)(=O)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000133971388 1417003470 /nfs/dbraw/zinc/00/34/70/1417003470.db2.gz WXNLXRQHXPMARV-MRXNPFEDSA-N 0 0 383.470 3.009 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NCc1ccccc1Oc1ccccc1 ZINC000133994573 1417006981 /nfs/dbraw/zinc/00/69/81/1417006981.db2.gz ZDNXVQHJWDIEFK-UHFFFAOYSA-N 0 0 381.392 3.083 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C)c(N2CCCS2(=O)=O)c1 ZINC000133994865 1417007027 /nfs/dbraw/zinc/00/70/27/1417007027.db2.gz ONMWTWKKJIUURH-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN CCOCCC1(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CCCC1 ZINC000133992607 1417007084 /nfs/dbraw/zinc/00/70/84/1417007084.db2.gz MABAOSOCLBJDCO-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN O=C(COc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCO[C@H]2CCCC[C@@H]21 ZINC000133996967 1417007358 /nfs/dbraw/zinc/00/73/58/1417007358.db2.gz JFQBKXCOHOGXOX-JSGCOSHPSA-N 0 0 388.342 3.162 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000133999760 1417007720 /nfs/dbraw/zinc/00/77/20/1417007720.db2.gz JHZLKRKYDUPLEV-LRDDRELGSA-N 0 0 386.433 3.084 20 5 GGBDRN O=C(Nc1cccc(OCC(F)F)n1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000134001511 1417008169 /nfs/dbraw/zinc/00/81/69/1417008169.db2.gz DIAONNTWUOEAIS-UHFFFAOYSA-N 0 0 378.335 3.224 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000134011922 1417009836 /nfs/dbraw/zinc/00/98/36/1417009836.db2.gz FTBISSATWCNFAU-UHFFFAOYSA-N 0 0 379.372 3.234 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000134035725 1417013111 /nfs/dbraw/zinc/01/31/11/1417013111.db2.gz BDJVTCKCJXAIDN-LLVKDONJSA-N 0 0 395.412 3.161 20 5 GGBDRN NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000134048365 1417014663 /nfs/dbraw/zinc/01/46/63/1417014663.db2.gz GFNNUPOSFHXMCD-UHFFFAOYSA-N 0 0 386.383 3.075 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NS(=O)(=O)c1ccc2oc(=O)ccc2c1 ZINC000134057056 1417015762 /nfs/dbraw/zinc/01/57/62/1417015762.db2.gz OABZEJJZDSNEGV-UHFFFAOYSA-N 0 0 394.792 3.464 20 5 GGBDRN O=C(c1cc(-c2ccc(F)cc2)on1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000134096796 1417021533 /nfs/dbraw/zinc/02/15/33/1417021533.db2.gz UNUPSLNIVJRBNH-UHFFFAOYSA-N 0 0 396.378 3.351 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CCc3ccsc3C2)ccc1[N+](=O)[O-] ZINC000134109162 1417023223 /nfs/dbraw/zinc/02/32/23/1417023223.db2.gz HYXLMYOQMLITMW-KRWDZBQOSA-N 0 0 399.472 3.154 20 5 GGBDRN Cc1c(CC(=O)NCCOc2ncccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000134114920 1417024157 /nfs/dbraw/zinc/02/41/57/1417024157.db2.gz VDBWSWGLUMZSAP-UHFFFAOYSA-N 0 0 383.326 3.055 20 5 GGBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000134121480 1417024982 /nfs/dbraw/zinc/02/49/82/1417024982.db2.gz MWLIAAJBXQFKQD-MLGOLLRUSA-N 0 0 376.388 3.195 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCO[C@@H](c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000134132526 1417027049 /nfs/dbraw/zinc/02/70/49/1417027049.db2.gz KQYSISAWMFXSOR-OAHLLOKOSA-N 0 0 393.346 3.023 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC[C@@](C)(O)C3)cc2[N+](=O)[O-])n1 ZINC000134164089 1417031676 /nfs/dbraw/zinc/03/16/76/1417031676.db2.gz 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CC(=O)Nc1ccc(F)c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000134233318 1417042297 /nfs/dbraw/zinc/04/22/97/1417042297.db2.gz XDAXTRQMWKJXJG-UHFFFAOYSA-N 0 0 383.339 3.130 20 5 GGBDRN Cc1ccnc([C@H](NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)n1 ZINC000134254634 1417044506 /nfs/dbraw/zinc/04/45/06/1417044506.db2.gz IRLSUKJTNGBVCF-BDJLRTHQSA-N 0 0 390.827 3.381 20 5 GGBDRN COCCOc1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134268588 1417047367 /nfs/dbraw/zinc/04/73/67/1417047367.db2.gz PZBIGFGOKGRFKM-UHFFFAOYSA-N 0 0 382.376 3.058 20 5 GGBDRN CC(=O)Nc1ccc(C)c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000134276936 1417048031 /nfs/dbraw/zinc/04/80/31/1417048031.db2.gz KOXKVQCDOHRGKK-UHFFFAOYSA-N 0 0 379.376 3.300 20 5 GGBDRN CN(Cc1nc2ccccc2n1C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134278418 1417048718 /nfs/dbraw/zinc/04/87/18/1417048718.db2.gz KZIFZLOJMLYXRX-UHFFFAOYSA-N 0 0 377.404 3.164 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(CCCO)Cc1cccc(Cl)c1 ZINC000134282331 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O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCc2c3ccccc3[nH]c2C1 ZINC000134963808 1417153035 /nfs/dbraw/zinc/15/30/35/1417153035.db2.gz FHTCWATWIZAZJT-UHFFFAOYSA-N 0 0 387.399 3.460 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134962712 1417153358 /nfs/dbraw/zinc/15/33/58/1417153358.db2.gz REVOUNWVEIZQPX-HNNXBMFYSA-N 0 0 394.431 3.398 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000135052026 1417167649 /nfs/dbraw/zinc/16/76/49/1417167649.db2.gz WXWRFVSMKRKJNM-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)NCc2ccccc2[N+](=O)[O-])cc1OC ZINC000135064089 1417169300 /nfs/dbraw/zinc/16/93/00/1417169300.db2.gz SRIPUDRSRDBUIT-AWEZNQCLSA-N 0 0 387.436 3.290 20 5 GGBDRN Cc1ccc(CCC(=O)NCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000135189504 1417184159 /nfs/dbraw/zinc/18/41/59/1417184159.db2.gz SXASZEMSFOTDKL-UHFFFAOYSA-N 0 0 395.459 3.143 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1C(F)(F)F ZINC000135194612 1417185539 /nfs/dbraw/zinc/18/55/39/1417185539.db2.gz FBXZFEIEXRNQFM-UHFFFAOYSA-N 0 0 395.337 3.219 20 5 GGBDRN Cc1cc(F)cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CC2)c1[N+](=O)[O-] ZINC000135196467 1417185784 /nfs/dbraw/zinc/18/57/84/1417185784.db2.gz KRUFWMZAUOTTRP-AWEZNQCLSA-N 0 0 381.404 3.075 20 5 GGBDRN COc1cc(C(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)c([N+](=O)[O-])cc1OC ZINC000135201659 1417186689 /nfs/dbraw/zinc/18/66/89/1417186689.db2.gz XFVHGUGIRKMWRG-AWEZNQCLSA-N 0 0 388.395 3.456 20 5 GGBDRN CCCCN(C)c1ccc(NC(=O)C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000135203503 1417187435 /nfs/dbraw/zinc/18/74/35/1417187435.db2.gz SLIGMECCELDMCW-UHFFFAOYSA-N 0 0 398.463 3.129 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000135206774 1417187934 /nfs/dbraw/zinc/18/79/34/1417187934.db2.gz ARZAZLARQZJEKF-AWEZNQCLSA-N 0 0 383.832 3.281 20 5 GGBDRN CCCn1c(C)nnc1COC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000135208579 1417188102 /nfs/dbraw/zinc/18/81/02/1417188102.db2.gz AJUCESCZKWGTGT-UHFFFAOYSA-N 0 0 390.443 3.208 20 5 GGBDRN C[C@@H](Cc1noc(CNc2ccccc2[N+](=O)[O-])n1)N(C)C(=O)OC(C)(C)C ZINC000135209930 1417188748 /nfs/dbraw/zinc/18/87/48/1417188748.db2.gz FWSVCUHTMYVHLX-LBPRGKRZSA-N 0 0 391.428 3.388 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN(C[C@H](O)COc1cccc2[nH]ccc21)C1CC1 ZINC000135220678 1417190848 /nfs/dbraw/zinc/19/08/48/1417190848.db2.gz MXEOVELHUWFKHZ-KRWDZBQOSA-N 0 0 381.432 3.480 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135224847 1417191225 /nfs/dbraw/zinc/19/12/25/1417191225.db2.gz NCRNRANUVSBLFF-UHFFFAOYSA-N 0 0 382.420 3.156 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135224238 1417191347 /nfs/dbraw/zinc/19/13/47/1417191347.db2.gz NBCBODAMECXEIO-UHFFFAOYSA-N 0 0 384.392 3.415 20 5 GGBDRN COc1ccc(OC)c(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135224209 1417191414 /nfs/dbraw/zinc/19/14/14/1417191414.db2.gz ZQJFFQZOHFVWOO-UHFFFAOYSA-N 0 0 385.420 3.215 20 5 GGBDRN C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000135227258 1417191774 /nfs/dbraw/zinc/19/17/74/1417191774.db2.gz VSFUWSSGZWLXFF-BBRMVZONSA-N 0 0 395.394 3.333 20 5 GGBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000135227284 1417191780 /nfs/dbraw/zinc/19/17/80/1417191780.db2.gz VSFUWSSGZWLXFF-CZUORRHYSA-N 0 0 395.394 3.333 20 5 GGBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000135227240 1417191871 /nfs/dbraw/zinc/19/18/71/1417191871.db2.gz VSFUWSSGZWLXFF-CJNGLKHVSA-N 0 0 395.394 3.333 20 5 GGBDRN Cn1nc(C(C)(C)C)cc1NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135238975 1417194023 /nfs/dbraw/zinc/19/40/23/1417194023.db2.gz AZIWSZUREJJFEH-UHFFFAOYSA-N 0 0 385.468 3.229 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000135244945 1417195146 /nfs/dbraw/zinc/19/51/46/1417195146.db2.gz HJGUGGBOGZJRMH-WMLDXEAASA-N 0 0 388.468 3.055 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000135257160 1417197821 /nfs/dbraw/zinc/19/78/21/1417197821.db2.gz MGJIFQVJFBIKMF-GXTWGEPZSA-N 0 0 399.378 3.046 20 5 GGBDRN Cc1cc(C)cc(C(=O)NCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000135273917 1417200314 /nfs/dbraw/zinc/20/03/14/1417200314.db2.gz AHHZDMUKIKOIGE-UHFFFAOYSA-N 0 0 381.432 3.133 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC(CN2CCCCC2=O)CC1 ZINC000135332614 1417209021 /nfs/dbraw/zinc/20/90/21/1417209021.db2.gz HZPQJLKNQAAAPI-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(OCc2nnnn2-c2ccc(C(F)(F)F)cc2)c1 ZINC000135339848 1417209533 /nfs/dbraw/zinc/20/95/33/1417209533.db2.gz HYMFMERLIYSMJK-UHFFFAOYSA-N 0 0 383.261 3.307 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)COc1cc(F)cc([N+](=O)[O-])c1 ZINC000135348971 1417210184 /nfs/dbraw/zinc/21/01/84/1417210184.db2.gz NOAWMGOMYROIJY-UHFFFAOYSA-N 0 0 376.384 3.356 20 5 GGBDRN COc1ccc(-c2noc(COc3cc(F)cc([N+](=O)[O-])c3)n2)c(OC)c1 ZINC000135351494 1417210597 /nfs/dbraw/zinc/21/05/97/1417210597.db2.gz HTPUZDVVKPTPNF-UHFFFAOYSA-N 0 0 375.312 3.380 20 5 GGBDRN CC(=O)N[C@@H](C)CCc1ccc(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000135360611 1417211281 /nfs/dbraw/zinc/21/12/81/1417211281.db2.gz WSYLUEVCKVWCHL-ZDUSSCGKSA-N 0 0 388.395 3.453 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](C)Cc1ccc(OC)c(OC)c1 ZINC000135362625 1417211546 /nfs/dbraw/zinc/21/15/46/1417211546.db2.gz AEKHZOOCSRRBHT-CYBMUJFWSA-N 0 0 387.436 3.262 20 5 GGBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)COc1cc(F)cc([N+](=O)[O-])c1 ZINC000135361118 1417211576 /nfs/dbraw/zinc/21/15/76/1417211576.db2.gz RONYYAQFUASKKG-UHFFFAOYSA-N 0 0 384.310 3.373 20 5 GGBDRN CCN(C[C@H]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1)CC(F)(F)F ZINC000135371911 1417212360 /nfs/dbraw/zinc/21/23/60/1417212360.db2.gz RKWAYNFKBPNSTN-GFCCVEGCSA-N 0 0 399.373 3.355 20 5 GGBDRN CCN(Cc1ccc(OC)cc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000135408122 1417216075 /nfs/dbraw/zinc/21/60/75/1417216075.db2.gz NHWQHRPZTUYSLU-UHFFFAOYSA-N 0 0 380.404 3.451 20 5 GGBDRN CC(C)N1C(=S)N=NC1C1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000135426915 1417218716 /nfs/dbraw/zinc/21/87/16/1417218716.db2.gz JPWZKNSXVKTIMG-UHFFFAOYSA-N 0 0 393.444 3.215 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1OC)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000135448991 1417221149 /nfs/dbraw/zinc/22/11/49/1417221149.db2.gz VGBLSXATTOOUHO-UHFFFAOYSA-N 0 0 388.380 3.367 20 5 GGBDRN CN(C)c1nnc(-c2ccc(NC(=O)CCOc3ccccc3[N+](=O)[O-])cc2)o1 ZINC000135446774 1417221434 /nfs/dbraw/zinc/22/14/34/1417221434.db2.gz KRYYJTDGGOZQCY-UHFFFAOYSA-N 0 0 397.391 3.118 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cccc1[N+](=O)[O-] ZINC000135452821 1417221811 /nfs/dbraw/zinc/22/18/11/1417221811.db2.gz IKNFRWRNTUKMDI-OAHLLOKOSA-N 0 0 391.786 3.231 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O ZINC000135455959 1417222126 /nfs/dbraw/zinc/22/21/26/1417222126.db2.gz LCTDOMDMIVTROO-INIZCTEOSA-N 0 0 391.786 3.231 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000135462649 1417223173 /nfs/dbraw/zinc/22/31/73/1417223173.db2.gz PWSBICVKYNTXGP-CQSZACIVSA-N 0 0 395.749 3.062 20 5 GGBDRN Cc1cccc(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)c1[N+](=O)[O-] ZINC000135461431 1417223362 /nfs/dbraw/zinc/22/33/62/1417223362.db2.gz ILFJZJYAPGJECW-HNNXBMFYSA-N 0 0 391.786 3.231 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000135460535 1417223410 /nfs/dbraw/zinc/22/34/10/1417223410.db2.gz GCSATKYYNJPQBD-OAHLLOKOSA-N 0 0 395.749 3.062 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CN1C(=O)[C@H](C)Oc2ccccc21 ZINC000135494526 1417228769 /nfs/dbraw/zinc/22/87/69/1417228769.db2.gz JLMJPPHAWQCJSX-NSHDSACASA-N 0 0 389.795 3.309 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2cccnc2OCC(F)F)c1 ZINC000135514416 1417231852 /nfs/dbraw/zinc/23/18/52/1417231852.db2.gz OIMPDRCKYUJMQO-UHFFFAOYSA-N 0 0 395.362 3.027 20 5 GGBDRN Cc1ccc(N2CCCC2)c(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000135534010 1417234315 /nfs/dbraw/zinc/23/43/15/1417234315.db2.gz DQJRHPKPHXGVDZ-MRXNPFEDSA-N 0 0 395.463 3.225 20 5 GGBDRN COc1cccc2cc(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)oc21 ZINC000135535207 1417234327 /nfs/dbraw/zinc/23/43/27/1417234327.db2.gz WVCIOAJBHKJDAX-CYBMUJFWSA-N 0 0 382.376 3.071 20 5 GGBDRN COc1cccc2cc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)oc21 ZINC000135535186 1417234517 /nfs/dbraw/zinc/23/45/17/1417234517.db2.gz WVCIOAJBHKJDAX-ZDUSSCGKSA-N 0 0 382.376 3.071 20 5 GGBDRN Cc1nc2ccccc2cc1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135535490 1417234532 /nfs/dbraw/zinc/23/45/32/1417234532.db2.gz NWCOBTCMIYPZMF-HNNXBMFYSA-N 0 0 377.404 3.173 20 5 GGBDRN Cc1cc(OC(F)F)c(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000135533805 1417234630 /nfs/dbraw/zinc/23/46/30/1417234630.db2.gz DMWWQXJJPSEJSP-SNVBAGLBSA-N 0 0 398.391 3.288 20 5 GGBDRN C[C@H](CSc1ccccc1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135541488 1417235529 /nfs/dbraw/zinc/23/55/29/1417235529.db2.gz MOGNWMUTFCOJEE-CABCVRRESA-N 0 0 386.477 3.431 20 5 GGBDRN CCCOc1cccc(CCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000135543106 1417235767 /nfs/dbraw/zinc/23/57/67/1417235767.db2.gz MLHVXBNZGFDTGL-UHFFFAOYSA-N 0 0 378.450 3.046 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)ccc1[N+](=O)[O-] ZINC000135577461 1417239480 /nfs/dbraw/zinc/23/94/80/1417239480.db2.gz BEVRVTFYJAFJJG-LBPRGKRZSA-N 0 0 393.802 3.405 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN(CC(F)(F)F)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000135584635 1417240427 /nfs/dbraw/zinc/24/04/27/1417240427.db2.gz AKJNPTSAXDBMDV-CHWSQXEVSA-N 0 0 388.390 3.242 20 5 GGBDRN O=[N+]([O-])c1cc(F)cc(OS(=O)(=O)c2sccc2Br)c1 ZINC000135591616 1417241501 /nfs/dbraw/zinc/24/15/01/1417241501.db2.gz ZOBBWHMMIICHGZ-UHFFFAOYSA-N 0 0 382.188 3.326 20 5 GGBDRN CC(C)(NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000135595757 1417242533 /nfs/dbraw/zinc/24/25/33/1417242533.db2.gz PRYKVUALRJMTLO-UHFFFAOYSA-N 0 0 393.802 3.169 20 5 GGBDRN COc1cc(CN(C)[C@H]2CCCc3c2cnn3C)c([N+](=O)[O-])cc1OC(F)F ZINC000135601956 1417244025 /nfs/dbraw/zinc/24/40/25/1417244025.db2.gz KZBBNVNCLGTBDN-ZDUSSCGKSA-N 0 0 396.394 3.448 20 5 GGBDRN CCNc1ccc(C(=O)Nc2ccc(C(=O)NC)cc2Cl)cc1[N+](=O)[O-] ZINC000135610418 1417246311 /nfs/dbraw/zinc/24/63/11/1417246311.db2.gz OXPYSHIBFMVEDD-UHFFFAOYSA-N 0 0 376.800 3.292 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccnc(-n2cccn2)c1 ZINC000135633415 1417250768 /nfs/dbraw/zinc/25/07/68/1417250768.db2.gz CAHIBGIIPZLUNO-UHFFFAOYSA-N 0 0 383.433 3.218 20 5 GGBDRN CC(=O)N1CCCc2ccc(S(=O)(=O)Nc3cccc([N+](=O)[O-])c3C)cc21 ZINC000135677538 1417256887 /nfs/dbraw/zinc/25/68/87/1417256887.db2.gz MAVNDZXQPZHRNR-UHFFFAOYSA-N 0 0 389.433 3.003 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000135714965 1417261038 /nfs/dbraw/zinc/26/10/38/1417261038.db2.gz VWXHGOCZMLJRGN-UHFFFAOYSA-N 0 0 395.419 3.029 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1ccc([S@@](C)=O)cc1 ZINC000178792675 1429171249 /nfs/dbraw/zinc/17/12/49/1429171249.db2.gz RUBHXGPAECNINJ-AREMUKBSSA-N 0 0 395.868 3.056 20 5 GGBDRN O=C(NCC1(CCO)CCCCC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000135840103 1417272612 /nfs/dbraw/zinc/27/26/12/1417272612.db2.gz JOHCAAQXJZIPSE-UHFFFAOYSA-N 0 0 375.469 3.258 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc(C2CC2)n1C1CC1 ZINC000135841017 1417272643 /nfs/dbraw/zinc/27/26/43/1417272643.db2.gz FBQBNHWQYBSSHV-UHFFFAOYSA-N 0 0 387.465 3.441 20 5 GGBDRN CC(C)(C)c1ccc(O)c(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000135885537 1417276057 /nfs/dbraw/zinc/27/60/57/1417276057.db2.gz CPZQISNISDGXPD-UHFFFAOYSA-N 0 0 381.392 3.431 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000135905897 1417276873 /nfs/dbraw/zinc/27/68/73/1417276873.db2.gz NROQITMRULHPGB-HNNXBMFYSA-N 0 0 375.469 3.376 20 5 GGBDRN COC(=O)[C@@H](C)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000135978225 1417282894 /nfs/dbraw/zinc/28/28/94/1417282894.db2.gz NFGDUTZQCLRCFW-AWEZNQCLSA-N 0 0 385.420 3.088 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N[C@@H](C)C3CCOCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000136102949 1417292448 /nfs/dbraw/zinc/29/24/48/1417292448.db2.gz TYDZYZZRZLIPSP-ZDUSSCGKSA-N 0 0 386.452 3.001 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)C[C@@H](C)O2 ZINC000136121109 1417293578 /nfs/dbraw/zinc/29/35/78/1417293578.db2.gz LSBYLNZFQMKGII-GFCCVEGCSA-N 0 0 381.388 3.441 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)C[C@H](C)O2 ZINC000136121149 1417293664 /nfs/dbraw/zinc/29/36/64/1417293664.db2.gz LSBYLNZFQMKGII-LBPRGKRZSA-N 0 0 381.388 3.441 20 5 GGBDRN COc1cccc(O[C@@H](C)CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000136145530 1417295391 /nfs/dbraw/zinc/29/53/91/1417295391.db2.gz GFWDAOOUHXGNEP-ZDUSSCGKSA-N 0 0 383.404 3.211 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc(-c3csc(C)n3)c[nH]2)cc([N+](=O)[O-])c1 ZINC000136147018 1417295560 /nfs/dbraw/zinc/29/55/60/1417295560.db2.gz JWYXZRDYAVHWGL-UHFFFAOYSA-N 0 0 386.389 3.394 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cnn(Cc3ccccc3)c2C)cc([N+](=O)[O-])c1 ZINC000136154436 1417296228 /nfs/dbraw/zinc/29/62/28/1417296228.db2.gz WTLKEPIQIRYTCR-UHFFFAOYSA-N 0 0 394.387 3.187 20 5 GGBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)Cn1cccn1 ZINC000136278029 1417306981 /nfs/dbraw/zinc/30/69/81/1417306981.db2.gz GEPIHJMHEILIPQ-INIZCTEOSA-N 0 0 393.447 3.470 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)cc1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136282295 1417307242 /nfs/dbraw/zinc/30/72/42/1417307242.db2.gz BZOMTRGZPLWJKZ-UHFFFAOYSA-N 0 0 384.417 3.117 20 5 GGBDRN O=C(c1ccccc1)N1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000136311191 1417308842 /nfs/dbraw/zinc/30/88/42/1417308842.db2.gz HPCWMMDLYJDUPW-UHFFFAOYSA-N 0 0 387.823 3.237 20 5 GGBDRN O=C(NCCc1cc(F)cc2c1OCOC2)c1c(Cl)cccc1[N+](=O)[O-] ZINC000136414963 1417314816 /nfs/dbraw/zinc/31/48/16/1417314816.db2.gz UGEDMWHADOUYNQ-UHFFFAOYSA-N 0 0 380.759 3.226 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc2n1CCCC2 ZINC000136459852 1417318665 /nfs/dbraw/zinc/31/86/65/1417318665.db2.gz WSRYJMIZQDTNQQ-UHFFFAOYSA-N 0 0 389.481 3.201 20 5 GGBDRN CC(C)(C)OC(=O)NC1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000136468179 1417319478 /nfs/dbraw/zinc/31/94/78/1417319478.db2.gz HNLIZJPIUIXVLY-UHFFFAOYSA-N 0 0 383.832 3.378 20 5 GGBDRN Cn1ccnc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)c1 ZINC000136518034 1417322777 /nfs/dbraw/zinc/32/27/77/1417322777.db2.gz JOYLNBIUXNFWNM-UHFFFAOYSA-N 0 0 398.444 3.332 20 5 GGBDRN O=C(c1ccsc1)N1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000136557149 1417326101 /nfs/dbraw/zinc/32/61/01/1417326101.db2.gz XMYPWNFMRDJMJD-UHFFFAOYSA-N 0 0 393.852 3.298 20 5 GGBDRN C=CC(=O)Nc1cc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000136571534 1417327292 /nfs/dbraw/zinc/32/72/92/1417327292.db2.gz FDUNCTLSWHNNMG-UHFFFAOYSA-N 0 0 395.350 3.296 20 5 GGBDRN O=C(N[C@H](CN1CCCC1=O)c1ccccc1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000136639049 1417334300 /nfs/dbraw/zinc/33/43/00/1417334300.db2.gz YKAHXVIAYJQTOD-MRXNPFEDSA-N 0 0 387.823 3.342 20 5 GGBDRN CCc1nc(CN2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)cs1 ZINC000136637925 1417334313 /nfs/dbraw/zinc/33/43/13/1417334313.db2.gz MTRYCYQUCYRMJC-UHFFFAOYSA-N 0 0 394.884 3.225 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000136643475 1417334531 /nfs/dbraw/zinc/33/45/31/1417334531.db2.gz KPQCJUJKIHFUFA-GXTWGEPZSA-N 0 0 381.860 3.405 20 5 GGBDRN O=C(NCCc1cc2ccccc2[nH]1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000136653903 1417335967 /nfs/dbraw/zinc/33/59/67/1417335967.db2.gz PRTZVECRJDFFJJ-UHFFFAOYSA-N 0 0 393.447 3.150 20 5 GGBDRN O=C(Nc1cccc(COCCOc2ccccc2)c1)c1n[nH]cc1[N+](=O)[O-] ZINC000136681938 1417338484 /nfs/dbraw/zinc/33/84/84/1417338484.db2.gz VUDFRIRKAULMEH-UHFFFAOYSA-N 0 0 382.376 3.166 20 5 GGBDRN O=C(NCCc1cc2ccccc2[nH]1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000136688004 1417338676 /nfs/dbraw/zinc/33/86/76/1417338676.db2.gz AMBHEUAIMKSHJS-UHFFFAOYSA-N 0 0 393.447 3.150 20 5 GGBDRN CC[C@@H](C)N(CC(=O)Nc1c(C)cccc1[N+](=O)[O-])CC(=O)OC(C)(C)C ZINC000136785559 1417345914 /nfs/dbraw/zinc/34/59/14/1417345914.db2.gz HTMJSEQJMVAWIN-CQSZACIVSA-N 0 0 379.457 3.284 20 5 GGBDRN CC(C)COC(=O)N1CCCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000136791784 1417346417 /nfs/dbraw/zinc/34/64/17/1417346417.db2.gz YOGHVPJBUXTSSB-UHFFFAOYSA-N 0 0 383.832 3.189 20 5 GGBDRN C[C@@H](NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1Cl ZINC000136807525 1417347546 /nfs/dbraw/zinc/34/75/46/1417347546.db2.gz DTOYPFWPWYRAMY-MNOVXSKESA-N 0 0 393.802 3.383 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000136817467 1417347797 /nfs/dbraw/zinc/34/77/97/1417347797.db2.gz GXAYCFKAPDEJDJ-LJQANCHMSA-N 0 0 375.856 3.099 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000136817518 1417347919 /nfs/dbraw/zinc/34/79/19/1417347919.db2.gz GXAYCFKAPDEJDJ-IBGZPJMESA-N 0 0 375.856 3.099 20 5 GGBDRN Cc1sc2nc(SC[C@@H](O)c3cccc([N+](=O)[O-])c3)n(C)c(=O)c2c1C ZINC000136829332 1417348538 /nfs/dbraw/zinc/34/85/38/1417348538.db2.gz YHIINSGAUULSGM-CYBMUJFWSA-N 0 0 391.474 3.346 20 5 GGBDRN CC(C)c1nc(CCNC(=O)c2cc([N+](=O)[O-])ccc2SCCO)cs1 ZINC000136836641 1417348850 /nfs/dbraw/zinc/34/88/50/1417348850.db2.gz KQBYKXHJEYDYJY-UHFFFAOYSA-N 0 0 395.506 3.232 20 5 GGBDRN COc1ccc(-c2nnc(SC[C@@H](O)c3cccc([N+](=O)[O-])c3)n2C)cc1 ZINC000136840393 1417349452 /nfs/dbraw/zinc/34/94/52/1417349452.db2.gz KUDJNAAXKXNWGJ-MRXNPFEDSA-N 0 0 386.433 3.225 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CSc2nnc(-c3cccnc3)n2C2CC2)c1 ZINC000136853894 1417350639 /nfs/dbraw/zinc/35/06/39/1417350639.db2.gz ZAVKDGDUOYOTSF-INIZCTEOSA-N 0 0 383.433 3.409 20 5 GGBDRN CC(C)c1ccc([C@@]2(C)NC(=O)N(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000136862368 1417350967 /nfs/dbraw/zinc/35/09/67/1417350967.db2.gz ZVPJAKPZDWAUAB-WIYYLYMNSA-N 0 0 397.431 3.219 20 5 GGBDRN CC(C)c1ccc([C@@]2(C)NC(=O)N(C[C@H](O)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000136862274 1417351404 /nfs/dbraw/zinc/35/14/04/1417351404.db2.gz ZVPJAKPZDWAUAB-GHTZIAJQSA-N 0 0 397.431 3.219 20 5 GGBDRN C[C@H]1CCc2c(sc3ncn(C[C@H](O)c4cccc([N+](=O)[O-])c4)c(=O)c32)C1 ZINC000136902581 1417353528 /nfs/dbraw/zinc/35/35/28/1417353528.db2.gz PBZBSJQIFJLWMK-NHYWBVRUSA-N 0 0 385.445 3.225 20 5 GGBDRN COc1cc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1O ZINC000136928151 1417356076 /nfs/dbraw/zinc/35/60/76/1417356076.db2.gz ZZFQHOMMNPKOGJ-UHFFFAOYSA-N 0 0 385.420 3.181 20 5 GGBDRN O=C(N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000136929432 1417356168 /nfs/dbraw/zinc/35/61/68/1417356168.db2.gz UZGOWZIEBVUWSS-INIZCTEOSA-N 0 0 399.794 3.081 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1)C1CC1 ZINC000136988023 1417360189 /nfs/dbraw/zinc/36/01/89/1417360189.db2.gz GMENNLLEEMWKSJ-UHFFFAOYSA-N 0 0 386.383 3.079 20 5 GGBDRN Cc1cc(NC(=O)[C@H]2OCCc3ccccc32)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000137054924 1417365532 /nfs/dbraw/zinc/36/55/32/1417365532.db2.gz AJSOZXXRRXTGLW-IBGZPJMESA-N 0 0 378.388 3.341 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCc3c(Br)cccc3C2)c1 ZINC000137063767 1417365943 /nfs/dbraw/zinc/36/59/43/1417365943.db2.gz CXBYJOCDZNKLEY-KRWDZBQOSA-N 0 0 377.238 3.449 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)CS(=O)(=O)Cc2csc(C3CCCC3)n2)c1 ZINC000137146168 1417371042 /nfs/dbraw/zinc/37/10/42/1417371042.db2.gz AWVCPYZDBVHKLA-INIZCTEOSA-N 0 0 396.490 3.357 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)c2)n[nH]1 ZINC000137146610 1417371073 /nfs/dbraw/zinc/37/10/73/1417371073.db2.gz VPAKWEFVMWVERM-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN CC(C)Cc1ccc(CS(=O)(=O)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000137146779 1417371092 /nfs/dbraw/zinc/37/10/92/1417371092.db2.gz GKDCLLCDPXDRRY-LJQANCHMSA-N 0 0 377.462 3.442 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CS(=O)(=O)Cc2csc(C3CCCC3)n2)c1 ZINC000137146130 1417371106 /nfs/dbraw/zinc/37/11/06/1417371106.db2.gz AWVCPYZDBVHKLA-MRXNPFEDSA-N 0 0 396.490 3.357 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCCN(Cc2ccccc2)c2ccccc21 ZINC000137172174 1417372546 /nfs/dbraw/zinc/37/25/46/1417372546.db2.gz PSRVWZGDBKNKLQ-UHFFFAOYSA-N 0 0 377.404 3.375 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)C[C@@H](O)c1ccc(F)cc1 ZINC000137175339 1417373112 /nfs/dbraw/zinc/37/31/12/1417373112.db2.gz PHLJQXPCHSDCIO-YVEFUNNKSA-N 0 0 391.399 3.054 20 5 GGBDRN CCC(=O)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)CC1 ZINC000137283611 1417378888 /nfs/dbraw/zinc/37/88/88/1417378888.db2.gz CSZINQQADDMUJE-UHFFFAOYSA-N 0 0 393.509 3.427 20 5 GGBDRN C[C@@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(NC(=O)c2ccc(F)cc2)cc1 ZINC000137374269 1417382681 /nfs/dbraw/zinc/38/26/81/1417382681.db2.gz YRGXLMDVVKYQMF-LLVKDONJSA-N 0 0 397.366 3.200 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(CC1CCC1)CC(F)(F)F ZINC000178816045 1429180019 /nfs/dbraw/zinc/18/00/19/1429180019.db2.gz ABJYMGFBDXKLAT-UHFFFAOYSA-N 0 0 375.347 3.206 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)c1nc2sccn2c1[N+](=O)[O-] ZINC000137673976 1417392592 /nfs/dbraw/zinc/39/25/92/1417392592.db2.gz HLGDGOBWGIKEOR-UHFFFAOYSA-N 0 0 381.364 3.047 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178824358 1429184007 /nfs/dbraw/zinc/18/40/07/1429184007.db2.gz USTRCPJIBRAWBY-WBMJQRKESA-N 0 0 386.433 3.084 20 5 GGBDRN O=C(Nc1cc(-c2cccs2)[nH]n1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000137830985 1417396424 /nfs/dbraw/zinc/39/64/24/1417396424.db2.gz PFTOJEHXSOMKEI-UHFFFAOYSA-N 0 0 380.389 3.484 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178824369 1429184351 /nfs/dbraw/zinc/18/43/51/1429184351.db2.gz USTRCPJIBRAWBY-BLLLJJGKSA-N 0 0 386.433 3.084 20 5 GGBDRN CN1CCc2ccc(NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)cc2C1=O ZINC000137922604 1417399222 /nfs/dbraw/zinc/39/92/22/1417399222.db2.gz OVDHNPSJLWIMGQ-UHFFFAOYSA-N 0 0 394.431 3.419 20 5 GGBDRN O=C(NC[C@@H](O)c1cc2ccccc2s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000138097532 1417405196 /nfs/dbraw/zinc/40/51/96/1417405196.db2.gz DWLKQXJAQROCCA-CQSZACIVSA-N 0 0 387.373 3.181 20 5 GGBDRN CNC(=O)c1cc(Br)ccc1NCc1cc(F)ccc1[N+](=O)[O-] ZINC000178827083 1429185120 /nfs/dbraw/zinc/18/51/20/1429185120.db2.gz FCMZHXRACAGXIO-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN C[C@@H](NC(=O)COC(=O)c1cc([N+](=O)[O-])cn1C)c1ccc2ccccc2c1 ZINC000138161081 1417406846 /nfs/dbraw/zinc/40/68/46/1417406846.db2.gz OOXLPYUEWOXJNH-CYBMUJFWSA-N 0 0 381.388 3.121 20 5 GGBDRN O=C(Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)c1n[nH]cc1[N+](=O)[O-] ZINC000138206993 1417407426 /nfs/dbraw/zinc/40/74/26/1417407426.db2.gz NQNQLFZLHPKPAN-UHFFFAOYSA-N 0 0 385.767 3.476 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000138408396 1417413555 /nfs/dbraw/zinc/41/35/55/1417413555.db2.gz UXSZZNBRHWDHQL-LLVKDONJSA-N 0 0 391.811 3.290 20 5 GGBDRN Cc1ccc(F)c(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1N ZINC000138674071 1417432417 /nfs/dbraw/zinc/43/24/17/1417432417.db2.gz BMPKKCWXBZCMKF-LLVKDONJSA-N 0 0 375.356 3.117 20 5 GGBDRN CCc1nc(CN(C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)cs1 ZINC000138924120 1417442076 /nfs/dbraw/zinc/44/20/76/1417442076.db2.gz LXEUPBSDNLNCOB-UHFFFAOYSA-N 0 0 378.454 3.083 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000139267448 1417454578 /nfs/dbraw/zinc/45/45/78/1417454578.db2.gz CCAUEZQMPCXXFT-QGZVFWFLSA-N 0 0 386.358 3.170 20 5 GGBDRN CCN1C(=S)N=NC1[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000139294770 1417455102 /nfs/dbraw/zinc/45/51/02/1417455102.db2.gz SYKUWNBHGCJTGC-NSHDSACASA-N 0 0 395.872 3.168 20 5 GGBDRN CCOc1cc2c(cc1CNC(=O)COc1ccc([N+](=O)[O-])cc1)O[C@@H](C)C2 ZINC000139319265 1417456208 /nfs/dbraw/zinc/45/62/08/1417456208.db2.gz JRGUDUBVZMUGKD-ZDUSSCGKSA-N 0 0 386.404 3.012 20 5 GGBDRN CCc1ccc(-c2noc(COC(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)n2)cc1 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ZINC000178871781 1429204987 /nfs/dbraw/zinc/20/49/87/1429204987.db2.gz AFAOQFLJKNBAGX-UHFFFAOYSA-N 0 0 381.432 3.446 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cccn(Cc2ccccc2)c1=O ZINC000146954484 1417735170 /nfs/dbraw/zinc/73/51/70/1417735170.db2.gz SNVAHJVRGBJUJU-UHFFFAOYSA-N 0 0 377.400 3.077 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(OCC(F)(F)F)c2)c1 ZINC000147039793 1417737798 /nfs/dbraw/zinc/73/77/98/1417737798.db2.gz GOFILWQKLYBRKL-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN COc1cc(OCC(=O)N(C)CCOc2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000147215594 1417741606 /nfs/dbraw/zinc/74/16/06/1417741606.db2.gz MOCYERQIGLQHLY-UHFFFAOYSA-N 0 0 394.811 3.173 20 5 GGBDRN Cc1cc(OC(C)C)ccc1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000147440568 1417746743 /nfs/dbraw/zinc/74/67/43/1417746743.db2.gz WTYNHIWVLKCJJN-UHFFFAOYSA-N 0 0 392.433 3.346 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1 ZINC000147462155 1417748020 /nfs/dbraw/zinc/74/80/20/1417748020.db2.gz GVBJPJWQFXQNAH-MJGOQNOKSA-N 0 0 390.461 3.182 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccncc2Br)ccc1Cl ZINC000147524536 1417749270 /nfs/dbraw/zinc/74/92/70/1417749270.db2.gz FBWSKSWXPYMWAB-UHFFFAOYSA-N 0 0 392.618 3.207 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCc2ccc(OC(C)(C)C)cc2)cccc1[N+](=O)[O-] ZINC000148257801 1417761814 /nfs/dbraw/zinc/76/18/14/1417761814.db2.gz OFSWOCNUNPUIDX-UHFFFAOYSA-N 0 0 385.420 3.335 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc2c(c1)nc1n2CCCCC1 ZINC000148335375 1417763203 /nfs/dbraw/zinc/76/32/03/1417763203.db2.gz SGIPNPORVDWMEK-UHFFFAOYSA-N 0 0 382.424 3.205 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)c1 ZINC000148498717 1417764460 /nfs/dbraw/zinc/76/44/60/1417764460.db2.gz UEHQVMMTLIJTRZ-KBPBESRZSA-N 0 0 385.420 3.469 20 5 GGBDRN COc1cc(OCC(=O)N(C)CCCOc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000148568434 1417765761 /nfs/dbraw/zinc/76/57/61/1417765761.db2.gz ZGNKWSGLSJZZGG-UHFFFAOYSA-N 0 0 392.383 3.049 20 5 GGBDRN O=C(NCCc1cc2ccccc2[nH]1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178878771 1429208175 /nfs/dbraw/zinc/20/81/75/1429208175.db2.gz RNYBVXRJODOKAO-UHFFFAOYSA-N 0 0 393.447 3.150 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc(COCC2CC2)c1 ZINC000149103077 1417772139 /nfs/dbraw/zinc/77/21/39/1417772139.db2.gz HGHVTWKKHXOELG-UHFFFAOYSA-N 0 0 397.431 3.280 20 5 GGBDRN CCCOc1ccc([C@@H](C)NC(=O)CCn2cc([N+](=O)[O-])nc2C)cc1OC ZINC000149500077 1417776515 /nfs/dbraw/zinc/77/65/15/1417776515.db2.gz ICOXDFOMTSMEJD-CYBMUJFWSA-N 0 0 390.440 3.165 20 5 GGBDRN CCOc1cc(C(=O)N(C)Cc2csc(CC)n2)c([N+](=O)[O-])cc1OC ZINC000149794679 1417780062 /nfs/dbraw/zinc/78/00/62/1417780062.db2.gz FIYSHOHIQMTMAW-UHFFFAOYSA-N 0 0 379.438 3.293 20 5 GGBDRN COc1cccc([C@@H](CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)[NH+]2CCCC2)c1 ZINC000149844365 1417780704 /nfs/dbraw/zinc/78/07/04/1417780704.db2.gz KQDBWYBOVMKNSL-HXUWFJFHSA-N 0 0 383.448 3.479 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)cc([N+](=O)[O-])c1 ZINC000150028303 1417784109 /nfs/dbraw/zinc/78/41/09/1417784109.db2.gz XOKANXBPDYXALD-SFHVURJKSA-N 0 0 398.419 3.456 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)NC[C@@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000178880657 1429209354 /nfs/dbraw/zinc/20/93/54/1429209354.db2.gz HGHPXABCRXJKSO-CQSZACIVSA-N 0 0 398.868 3.001 20 5 GGBDRN Cc1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n(-c2cc(C)nc(C)n2)n1 ZINC000150694028 1417788837 /nfs/dbraw/zinc/78/88/37/1417788837.db2.gz MGVPIHOSVCNZKZ-UHFFFAOYSA-N 0 0 380.408 3.067 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000150731915 1417793552 /nfs/dbraw/zinc/79/35/52/1417793552.db2.gz AHKJZOPSVWKJNN-UHFFFAOYSA-N 0 0 395.774 3.155 20 5 GGBDRN Cc1cc(=O)c(C(=O)NCC2(CC(C)C)CC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000150745036 1417796611 /nfs/dbraw/zinc/79/66/11/1417796611.db2.gz XRXQLHQEZASXFA-UHFFFAOYSA-N 0 0 384.436 3.005 20 5 GGBDRN O=C(NC[C@@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1)c1ccccc1 ZINC000150747803 1417797419 /nfs/dbraw/zinc/79/74/19/1417797419.db2.gz BFNQTQFHFVZEHK-AWEZNQCLSA-N 0 0 385.395 3.016 20 5 GGBDRN CC[NH+](CC)CCN(Cc1cccs1)C(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000150762703 1417802063 /nfs/dbraw/zinc/80/20/63/1417802063.db2.gz KDXLBYLBXWGZNZ-UHFFFAOYSA-N 0 0 377.466 3.346 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccccc1OCCn1ccnc1 ZINC000150773460 1417804274 /nfs/dbraw/zinc/80/42/74/1417804274.db2.gz PEJQYOABYUWEPS-UHFFFAOYSA-N 0 0 384.367 3.191 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@H](c2ccccc2)c2ccccn2)ccc1[N+](=O)[O-] ZINC000150772293 1417804463 /nfs/dbraw/zinc/80/44/63/1417804463.db2.gz QYRXMDZYAIQIMH-LJQANCHMSA-N 0 0 399.428 3.066 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000150782114 1417805523 /nfs/dbraw/zinc/80/55/23/1417805523.db2.gz BXONWPBQMBYUJS-JTQLQIEISA-N 0 0 386.376 3.263 20 5 GGBDRN COc1cc(S(=O)(=O)N(Cc2ccc(F)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000150778900 1417805695 /nfs/dbraw/zinc/80/56/95/1417805695.db2.gz PCWJITMUFXPXLH-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC[C@H]2c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000150798207 1417808702 /nfs/dbraw/zinc/80/87/02/1417808702.db2.gz FBDOWTGJNDDUMU-INIZCTEOSA-N 0 0 376.434 3.438 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)[C@@H](C)c2cc(F)ccc2F)ccc1[N+](=O)[O-] ZINC000150796683 1417808719 /nfs/dbraw/zinc/80/87/19/1417808719.db2.gz LCSFQNFNBJUZQZ-JTQLQIEISA-N 0 0 386.376 3.263 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)CCCNC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000150801450 1417809508 /nfs/dbraw/zinc/80/95/08/1417809508.db2.gz HLPBBNRMKWICMW-HNNXBMFYSA-N 0 0 399.447 3.381 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCC(N3CCCCC3=O)CC2)cc1[N+](=O)[O-] ZINC000150805524 1417810324 /nfs/dbraw/zinc/81/03/24/1417810324.db2.gz DGUGUZQUIGSCFP-HNNXBMFYSA-N 0 0 388.468 3.151 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c1[N+](=O)[O-] ZINC000150809077 1417811269 /nfs/dbraw/zinc/81/12/69/1417811269.db2.gz FEKFEDBGOUEJQS-OAHLLOKOSA-N 0 0 391.786 3.231 20 5 GGBDRN COc1cc(S(=O)(=O)N(C)[C@@H]2CCCc3nc(C)sc32)ccc1[N+](=O)[O-] ZINC000150813423 1417812111 /nfs/dbraw/zinc/81/21/11/1417812111.db2.gz HEQHWJFRPULDHD-CQSZACIVSA-N 0 0 397.478 3.066 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000150815538 1417812861 /nfs/dbraw/zinc/81/28/61/1417812861.db2.gz ZGGBMWLWTRDONZ-ZFWWWQNUSA-N 0 0 376.434 3.170 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000150817226 1417813385 /nfs/dbraw/zinc/81/33/85/1417813385.db2.gz ZMZNIEIDEHGLKK-GXTWGEPZSA-N 0 0 394.424 3.309 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000150817182 1417813478 /nfs/dbraw/zinc/81/34/78/1417813478.db2.gz ZMZNIEIDEHGLKK-JSGCOSHPSA-N 0 0 394.424 3.309 20 5 GGBDRN COc1cccc(Br)c1OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000150822976 1417814289 /nfs/dbraw/zinc/81/42/89/1417814289.db2.gz SJZHJJQINMFJCA-UHFFFAOYSA-N 0 0 397.137 3.493 20 5 GGBDRN O=C(Nc1ccc(-c2ccccc2)nn1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000150825575 1417814985 /nfs/dbraw/zinc/81/49/85/1417814985.db2.gz KWZAHCVWOPRHGH-UHFFFAOYSA-N 0 0 386.371 3.490 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1Br ZINC000150834462 1417816671 /nfs/dbraw/zinc/81/66/71/1417816671.db2.gz OGZNLXCWHBQXJU-UHFFFAOYSA-N 0 0 394.181 3.238 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2ccc(N[C@@H](C)CCO)c([N+](=O)[O-])c2)c(C)c1 ZINC000150867287 1417824088 /nfs/dbraw/zinc/82/40/88/1417824088.db2.gz JBLYMUVZVGYQNR-AWEZNQCLSA-N 0 0 393.465 3.195 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCO[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000150879406 1417826979 /nfs/dbraw/zinc/82/69/79/1417826979.db2.gz CTKNDKDODJKRAF-IBGZPJMESA-N 0 0 385.376 3.199 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCO[C@@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000150879371 1417827173 /nfs/dbraw/zinc/82/71/73/1417827173.db2.gz CTKNDKDODJKRAF-LJQANCHMSA-N 0 0 385.376 3.199 20 5 GGBDRN CC(C)(CNC(=O)NCCn1cc([N+](=O)[O-])cn1)c1cccc(C(F)(F)F)c1 ZINC000150883318 1417827329 /nfs/dbraw/zinc/82/73/29/1417827329.db2.gz RPLSTOHANFEQIR-UHFFFAOYSA-N 0 0 399.373 3.087 20 5 GGBDRN O=C(NCCCO[C@H]1CCOC1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000150884140 1417827701 /nfs/dbraw/zinc/82/77/01/1417827701.db2.gz WGHGDWSIQONIPL-KRWDZBQOSA-N 0 0 385.420 3.264 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000150896187 1417830140 /nfs/dbraw/zinc/83/01/40/1417830140.db2.gz UWDWMLCIFCRWFQ-AWEZNQCLSA-N 0 0 385.395 3.193 20 5 GGBDRN CCOC(=O)c1csc(N(C(=O)c2cc([N+](=O)[O-])ccc2C)C2CC2)n1 ZINC000150906951 1417832449 /nfs/dbraw/zinc/83/24/49/1417832449.db2.gz LLXPXGXBRQMBAT-UHFFFAOYSA-N 0 0 375.406 3.346 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1F ZINC000150948279 1417841819 /nfs/dbraw/zinc/84/18/19/1417841819.db2.gz CKWHVNRKIJUIMQ-AREMUKBSSA-N 0 0 377.397 3.062 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000150953745 1417843133 /nfs/dbraw/zinc/84/31/33/1417843133.db2.gz WELCDIMQJMWEPX-CYBMUJFWSA-N 0 0 376.434 3.339 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1cc(-c2nnn[n-]2)ccc1F ZINC000826500433 1429214069 /nfs/dbraw/zinc/21/40/69/1429214069.db2.gz YHVPNKQQHUWGNB-FZKQIMNGSA-N 0 0 396.426 3.415 20 5 GGBDRN COc1ccc(C(=O)NCCc2ccccc2OC(F)(F)F)cc1[N+](=O)[O-] ZINC000150961201 1417844606 /nfs/dbraw/zinc/84/46/06/1417844606.db2.gz KSMFNFOBZKQXHF-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN O=C(Nc1ccc2c(c1)NC(=O)CC2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000150973939 1417846587 /nfs/dbraw/zinc/84/65/87/1417846587.db2.gz WKRBRQGHPLBOSS-UHFFFAOYSA-N 0 0 380.404 3.332 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000150981383 1417848660 /nfs/dbraw/zinc/84/86/60/1417848660.db2.gz SJMHLBDFVSIUNS-MOPGFXCFSA-N 0 0 395.459 3.427 20 5 GGBDRN Cn1cc(-c2csc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)cn1 ZINC000150988463 1417850415 /nfs/dbraw/zinc/85/04/15/1417850415.db2.gz PJYUTLQKUIVXQC-UHFFFAOYSA-N 0 0 398.448 3.304 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H](Cc1ccccc1)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000151023547 1417857389 /nfs/dbraw/zinc/85/73/89/1417857389.db2.gz HIGCDWCMTYMNMX-QGZVFWFLSA-N 0 0 384.432 3.207 20 5 GGBDRN CCCOc1cc(C)ccc1CNC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000151033952 1417859331 /nfs/dbraw/zinc/85/93/31/1417859331.db2.gz ZFTPTANMRMRWEN-HNNXBMFYSA-N 0 0 399.447 3.127 20 5 GGBDRN O=C(NCCc1ccc(Cl)nc1)c1ccc([N+](=O)[O-])cc1Br ZINC000151055248 1417863322 /nfs/dbraw/zinc/86/33/22/1417863322.db2.gz FUYBZSAMNXVOKM-UHFFFAOYSA-N 0 0 384.617 3.378 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(c2nc(C)cs2)C2CC2)cc([N+](=O)[O-])c1 ZINC000151063199 1417865354 /nfs/dbraw/zinc/86/53/54/1417865354.db2.gz KBSYCNIPAUWEML-UHFFFAOYSA-N 0 0 375.406 3.346 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000151066511 1417865828 /nfs/dbraw/zinc/86/58/28/1417865828.db2.gz DORUVNGYWUBDNL-AWEZNQCLSA-N 0 0 383.832 3.281 20 5 GGBDRN CC(C)(C)OC(=O)[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000151076211 1417867773 /nfs/dbraw/zinc/86/77/73/1417867773.db2.gz KAAGAZPZLUWERG-GOSISDBHSA-N 0 0 388.395 3.476 20 5 GGBDRN Cc1c(C(=O)NCCc2ccc(Cl)nc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000151125605 1417877408 /nfs/dbraw/zinc/87/74/08/1417877408.db2.gz UOJOXVGBRSXIJW-UHFFFAOYSA-N 0 0 378.772 3.141 20 5 GGBDRN CCn1c(-c2ccncc2)nn(CN2CCc3c2cccc3[N+](=O)[O-])c1=S ZINC000178919151 1429219721 /nfs/dbraw/zinc/21/97/21/1429219721.db2.gz FOMREDOLZPDZBQ-UHFFFAOYSA-N 0 0 382.449 3.424 20 5 GGBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1nnc(-c2ccccc2)s1 ZINC000151172928 1417887214 /nfs/dbraw/zinc/88/72/14/1417887214.db2.gz GETYNOMZBYOPIT-UHFFFAOYSA-N 0 0 398.448 3.025 20 5 GGBDRN Cc1sc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c(C(N)=O)c1C ZINC000151179575 1417888752 /nfs/dbraw/zinc/88/87/52/1417888752.db2.gz FXCXDPJQRBHTJJ-UHFFFAOYSA-N 0 0 398.238 3.387 20 5 GGBDRN CC[C@](C)(NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000151185571 1417889806 /nfs/dbraw/zinc/88/98/06/1417889806.db2.gz CVRAGWUEBWFWEC-KRWDZBQOSA-N 0 0 377.422 3.202 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)OCCc2ccccc2[N+](=O)[O-])cs1 ZINC000151186209 1417890155 /nfs/dbraw/zinc/89/01/55/1417890155.db2.gz CNRYEUOUUOACQI-UHFFFAOYSA-N 0 0 391.449 3.364 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cscc1C ZINC000151186872 1417890259 /nfs/dbraw/zinc/89/02/59/1417890259.db2.gz CCBVTAJBAWSTCH-CQSZACIVSA-N 0 0 393.490 3.455 20 5 GGBDRN CC(=O)N1CCc2ccccc2[C@H]1CC(=O)OCCc1ccccc1[N+](=O)[O-] ZINC000151195873 1417891987 /nfs/dbraw/zinc/89/19/87/1417891987.db2.gz IEJOGIXDGGHJNI-HXUWFJFHSA-N 0 0 382.416 3.217 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](CC(=O)OCCc2ccccc2[N+](=O)[O-])C1 ZINC000151200815 1417892615 /nfs/dbraw/zinc/89/26/15/1417892615.db2.gz JMSPBYCOWZHKPT-INIZCTEOSA-N 0 0 391.468 3.148 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000151204889 1417893540 /nfs/dbraw/zinc/89/35/40/1417893540.db2.gz UBIMKIDVMGHHJS-UHFFFAOYSA-N 0 0 385.395 3.460 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCO[C@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000151235258 1417899180 /nfs/dbraw/zinc/89/91/80/1417899180.db2.gz JHMBQRQPRVDJAE-QIIPPGSGSA-N 0 0 379.482 3.318 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1C)c1ccc(Cl)c(F)c1 ZINC000151234595 1417899213 /nfs/dbraw/zinc/89/92/13/1417899213.db2.gz ZIZSAKHSUHBYMF-OAHLLOKOSA-N 0 0 395.774 3.125 20 5 GGBDRN C[C@@H](CC(=O)c1ccccc1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000178922037 1429220812 /nfs/dbraw/zinc/22/08/12/1429220812.db2.gz UEALWGJGUBYTPW-NSHDSACASA-N 0 0 382.825 3.188 20 5 GGBDRN Cc1ccccc1[C@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000151238985 1417900090 /nfs/dbraw/zinc/90/00/90/1417900090.db2.gz UUVVWQLXVDLWMO-HXUWFJFHSA-N 0 0 392.415 3.303 20 5 GGBDRN CSc1cc(C)ccc1CNC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000151242204 1417901287 /nfs/dbraw/zinc/90/12/87/1417901287.db2.gz NPMDVOOOAXYRRV-UHFFFAOYSA-N 0 0 397.460 3.444 20 5 GGBDRN CS[C@H]1CCCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000151241904 1417901330 /nfs/dbraw/zinc/90/13/30/1417901330.db2.gz VUUOFYQVTWIUHR-STQMWFEESA-N 0 0 397.522 3.005 20 5 GGBDRN O=C(OCCc1ccccc1[N+](=O)[O-])c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000151273689 1417911245 /nfs/dbraw/zinc/91/12/45/1417911245.db2.gz ZLZPSLWHLDSKOG-UHFFFAOYSA-N 0 0 382.332 3.088 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC([C@H](O)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000151278931 1417912415 /nfs/dbraw/zinc/91/24/15/1417912415.db2.gz ZOPNWDSUOJESOP-ABAIWWIYSA-N 0 0 389.374 3.309 20 5 GGBDRN COC(=O)C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(F)c1 ZINC000151289248 1417916146 /nfs/dbraw/zinc/91/61/46/1417916146.db2.gz SZPJFOXWNGLZAJ-HNNXBMFYSA-N 0 0 380.759 3.422 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](C)Cc1nc2ccccc2s1 ZINC000178909342 1429217321 /nfs/dbraw/zinc/21/73/21/1429217321.db2.gz WBPUUENDJXYRRT-LBPRGKRZSA-N 0 0 391.474 3.422 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000178910042 1429217359 /nfs/dbraw/zinc/21/73/59/1429217359.db2.gz ODABKVUYWQZSFA-GFCCVEGCSA-N 0 0 391.474 3.255 20 5 GGBDRN COC(=O)CN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CCCC1 ZINC000151309902 1417922504 /nfs/dbraw/zinc/92/25/04/1417922504.db2.gz POHGGTDWJNTUTR-UHFFFAOYSA-N 0 0 392.455 3.099 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)C[C@@H](O)c2cccs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000151314535 1417924610 /nfs/dbraw/zinc/92/46/10/1417924610.db2.gz CEMWHNZKKUDJAE-YMTOWFKASA-N 0 0 393.421 3.423 20 5 GGBDRN CS(=O)(=O)Cc1cc(F)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000151329577 1417927890 /nfs/dbraw/zinc/92/78/90/1417927890.db2.gz PGRSFZZKYQJNHL-UHFFFAOYSA-N 0 0 386.788 3.184 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000151352630 1417933498 /nfs/dbraw/zinc/93/34/98/1417933498.db2.gz OYRKBUIMRWSMFJ-UHFFFAOYSA-N 0 0 396.447 3.470 20 5 GGBDRN CS(=O)(=O)Cc1cc(F)ccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000151354692 1417933952 /nfs/dbraw/zinc/93/39/52/1417933952.db2.gz IFQIXENVGSUYMK-UHFFFAOYSA-N 0 0 386.788 3.184 20 5 GGBDRN Cc1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)ccc1N1C(=O)CCC1=O ZINC000151381804 1417942886 /nfs/dbraw/zinc/94/28/86/1417942886.db2.gz WSNZVUVDELYVTH-UHFFFAOYSA-N 0 0 381.388 3.128 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N(Cc1ccc(F)cc1)C1CC1 ZINC000178935228 1429224273 /nfs/dbraw/zinc/22/42/73/1429224273.db2.gz HUCCOGDAIMSWCE-UHFFFAOYSA-N 0 0 378.425 3.271 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000178934840 1429224558 /nfs/dbraw/zinc/22/45/58/1429224558.db2.gz XDTBUYLAAPRQED-UHFFFAOYSA-N 0 0 390.461 3.140 20 5 GGBDRN COc1cccc([C@H]2CCCN2S(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000178938273 1429224938 /nfs/dbraw/zinc/22/49/38/1429224938.db2.gz VGTJNBPCURVDAG-GOSISDBHSA-N 0 0 390.461 3.313 20 5 GGBDRN C[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000151461773 1417982760 /nfs/dbraw/zinc/98/27/60/1417982760.db2.gz NJZHYMIEIGKKEO-ZBEGNZNMSA-N 0 0 382.342 3.420 20 5 GGBDRN COCCCn1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000151468823 1417985533 /nfs/dbraw/zinc/98/55/33/1417985533.db2.gz JWRMZUPKOBBOFL-UHFFFAOYSA-N 0 0 375.429 3.270 20 5 GGBDRN CCN(CC)C(=O)c1cccc(NC(=O)CN2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000178945786 1429226970 /nfs/dbraw/zinc/22/69/70/1429226970.db2.gz FISGWWAZTMIWQO-UHFFFAOYSA-N 0 0 396.447 3.078 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151477801 1417991850 /nfs/dbraw/zinc/99/18/50/1417991850.db2.gz QCIGMCHYLDNTFS-CVEARBPZSA-N 0 0 389.477 3.066 20 5 GGBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)[C@H]1CN(Cc2ccccc2)CCO1 ZINC000151477868 1417992122 /nfs/dbraw/zinc/99/21/22/1417992122.db2.gz QCIGMCHYLDNTFS-JKSUJKDBSA-N 0 0 389.477 3.066 20 5 GGBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151477728 1417992286 /nfs/dbraw/zinc/99/22/86/1417992286.db2.gz QCIGMCHYLDNTFS-HOTGVXAUSA-N 0 0 389.477 3.066 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1c[nH]nc1-c1ccccc1 ZINC000178941640 1429225759 /nfs/dbraw/zinc/22/57/59/1429225759.db2.gz DHRBLLQIRQPMKH-UHFFFAOYSA-N 0 0 399.794 3.007 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc(C)c1[N+](=O)[O-])[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151479217 1417992460 /nfs/dbraw/zinc/99/24/60/1417992460.db2.gz MXIZXESFVGQEEE-UXHICEINSA-N 0 0 397.475 3.313 20 5 GGBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000178939139 1429225789 /nfs/dbraw/zinc/22/57/89/1429225789.db2.gz VXSDCZQYFRVILK-LBPRGKRZSA-N 0 0 384.404 3.438 20 5 GGBDRN O=C(NCc1nccs1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000151483323 1417996860 /nfs/dbraw/zinc/99/68/60/1417996860.db2.gz KSIRJCCIFYJPMH-UHFFFAOYSA-N 0 0 376.619 3.397 20 5 GGBDRN O=C(COC(=O)Cc1c[nH]c2ccc(Cl)cc12)Nc1cccc([N+](=O)[O-])c1 ZINC000151492089 1418001885 /nfs/dbraw/zinc/00/18/85/1418001885.db2.gz CEKNUGWJRDMQLK-UHFFFAOYSA-N 0 0 387.779 3.454 20 5 GGBDRN CC[C@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000151494709 1418002386 /nfs/dbraw/zinc/00/23/86/1418002386.db2.gz SKQAEZJHACNACW-ICSRJNTNSA-N 0 0 383.448 3.004 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000151495248 1418002677 /nfs/dbraw/zinc/00/26/77/1418002677.db2.gz WANVRGBGCPSNGY-OAHLLOKOSA-N 0 0 397.200 3.268 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000151515937 1418011071 /nfs/dbraw/zinc/01/10/71/1418011071.db2.gz CRLBGNNKAHUEQA-OAHLLOKOSA-N 0 0 397.200 3.268 20 5 GGBDRN CC(C)NC(=O)c1ccc(N[C@H]2CCN(C3CCCCC3)C2=O)c([N+](=O)[O-])c1 ZINC000151537033 1418016945 /nfs/dbraw/zinc/01/69/45/1418016945.db2.gz LQZLZJBQLOVFQQ-KRWDZBQOSA-N 0 0 388.468 3.079 20 5 GGBDRN O=C(Cn1nnnc1/C=C/c1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000151553217 1418022705 /nfs/dbraw/zinc/02/27/05/1418022705.db2.gz YQBJJURUFOZVCF-RMKNXTFCSA-N 0 0 384.783 3.044 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ncc(-c2ccccc2)o1 ZINC000151570989 1418027839 /nfs/dbraw/zinc/02/78/39/1418027839.db2.gz MHMXARYFZFIXRJ-NSHDSACASA-N 0 0 391.380 3.428 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000151573466 1418028985 /nfs/dbraw/zinc/02/89/85/1418028985.db2.gz HWWUACPKSRIXNL-UHFFFAOYSA-N 0 0 396.447 3.470 20 5 GGBDRN O=C(NCCOC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F ZINC000178966474 1429230203 /nfs/dbraw/zinc/23/02/03/1429230203.db2.gz QMGINCWARZFRDU-UHFFFAOYSA-N 0 0 382.294 3.200 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2ccccc2OCC2CC2)cc1 ZINC000151594388 1418034871 /nfs/dbraw/zinc/03/48/71/1418034871.db2.gz UKNKYQSYKRDJCQ-UHFFFAOYSA-N 0 0 376.434 3.003 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000151648333 1418050004 /nfs/dbraw/zinc/05/00/04/1418050004.db2.gz FLGYACNPGAGQMG-GOSISDBHSA-N 0 0 383.383 3.019 20 5 GGBDRN COC[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC1 ZINC000151662244 1418053823 /nfs/dbraw/zinc/05/38/23/1418053823.db2.gz QITDGBWVGVYQTB-UGSOOPFHSA-N 0 0 384.436 3.318 20 5 GGBDRN CC(=O)N[C@H](CC(=O)Oc1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1F ZINC000151663980 1418054137 /nfs/dbraw/zinc/05/41/37/1418054137.db2.gz SHXWNNSCLQOKJH-OAHLLOKOSA-N 0 0 378.331 3.354 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000151688652 1418061971 /nfs/dbraw/zinc/06/19/71/1418061971.db2.gz WMPQCMBJZDLWMV-QWHCGFSZSA-N 0 0 379.848 3.278 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H](c1cccc(F)c1)C1CCCC1 ZINC000151690085 1418062144 /nfs/dbraw/zinc/06/21/44/1418062144.db2.gz VGMAVXRDZOEMDW-KRWDZBQOSA-N 0 0 375.404 3.161 20 5 GGBDRN Cc1nc([C@@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)c2ccccc2F)no1 ZINC000151691207 1418062479 /nfs/dbraw/zinc/06/24/79/1418062479.db2.gz JMXWFWDEDILXEM-SFHVURJKSA-N 0 0 384.367 3.264 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H](Cc1ccccc1)c1cccs1 ZINC000151692576 1418062679 /nfs/dbraw/zinc/06/26/79/1418062679.db2.gz WKHFRKNVCHNLFY-MRXNPFEDSA-N 0 0 385.449 3.136 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NCC1(Sc2ccccc2)CCCC1 ZINC000151694266 1418063759 /nfs/dbraw/zinc/06/37/59/1418063759.db2.gz KBIOEKPHWBUTJN-UHFFFAOYSA-N 0 0 389.481 3.196 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCn3nc(C(C)C)nc32)c1 ZINC000151708488 1418068258 /nfs/dbraw/zinc/06/82/58/1418068258.db2.gz AJQIPOGYHCRXTA-CYBMUJFWSA-N 0 0 375.454 3.297 20 5 GGBDRN CN(Cc1ccccc1-c1ccccc1)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000151716871 1418069920 /nfs/dbraw/zinc/06/99/20/1418069920.db2.gz BOSGDPLJWTUSLK-UHFFFAOYSA-N 0 0 379.420 3.300 20 5 GGBDRN C[C@@H](CC(=O)c1ccccc1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000151722052 1418071027 /nfs/dbraw/zinc/07/10/27/1418071027.db2.gz NPNVXDCLMLFTJA-AWEZNQCLSA-N 0 0 378.388 3.172 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000151723459 1418071607 /nfs/dbraw/zinc/07/16/07/1418071607.db2.gz RLZJIUMQFDHHBH-IBGZPJMESA-N 0 0 379.420 3.075 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H](Cc1ccccc1)c1ccccc1F ZINC000151750104 1418077615 /nfs/dbraw/zinc/07/76/15/1418077615.db2.gz HQVUHJRQEBFQJI-LJQANCHMSA-N 0 0 397.410 3.214 20 5 GGBDRN COc1cccc2c1OC[C@@H](NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C2 ZINC000151749398 1418077619 /nfs/dbraw/zinc/07/76/19/1418077619.db2.gz HZCSRYHPLFHVQE-INIZCTEOSA-N 0 0 397.431 3.281 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1c1cccc2ccccc21 ZINC000151757798 1418079662 /nfs/dbraw/zinc/07/96/62/1418079662.db2.gz YKBHORWJGLMJDX-IBGZPJMESA-N 0 0 379.420 3.491 20 5 GGBDRN Cc1c(NC(=O)c2ccc3c(c2)[nH]c(=O)n3CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000151767257 1418082184 /nfs/dbraw/zinc/08/21/84/1418082184.db2.gz MECKRDDGQPZONA-UHFFFAOYSA-N 0 0 394.309 3.361 20 5 GGBDRN CC1(c2ccccc2)CCN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)CC1 ZINC000151777224 1418084769 /nfs/dbraw/zinc/08/47/69/1418084769.db2.gz VDQFHERHBDWADO-UHFFFAOYSA-N 0 0 391.431 3.369 20 5 GGBDRN O=C1N[C@]2(CCc3cc(Cl)ccc32)C(=O)N1Cc1ccc([N+](=O)[O-])cc1F ZINC000151793089 1418088124 /nfs/dbraw/zinc/08/81/24/1418088124.db2.gz PIOPEMXMHSPYHK-SFHVURJKSA-N 0 0 389.770 3.281 20 5 GGBDRN COCCC1(CNc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CCCC1 ZINC000151807044 1418091684 /nfs/dbraw/zinc/09/16/84/1418091684.db2.gz YKECNORZFIVDDT-UHFFFAOYSA-N 0 0 391.468 3.076 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Oc1ccc2c(c1)OCO2 ZINC000151840705 1418098709 /nfs/dbraw/zinc/09/87/09/1418098709.db2.gz WEDOPKOYONVUDI-UHFFFAOYSA-N 0 0 380.150 3.234 20 5 GGBDRN CCOC(=O)CCc1ccc(N[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000151839429 1418098885 /nfs/dbraw/zinc/09/88/85/1418098885.db2.gz NAPSNRQUOQHAMB-IBGZPJMESA-N 0 0 397.431 3.308 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000151949935 1418102477 /nfs/dbraw/zinc/10/24/77/1418102477.db2.gz CNTPZAATNDFCIG-CQSZACIVSA-N 0 0 375.454 3.053 20 5 GGBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000151953291 1418103412 /nfs/dbraw/zinc/10/34/12/1418103412.db2.gz OLCZXWPLGQFFAB-CYBMUJFWSA-N 0 0 380.404 3.062 20 5 GGBDRN O=C(CN1CCC[C@H]1C[C@H](O)c1ccco1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000151964049 1418107174 /nfs/dbraw/zinc/10/71/74/1418107174.db2.gz OCTPGZRRMBNAOR-BBRMVZONSA-N 0 0 393.827 3.368 20 5 GGBDRN CC[C@H]1CN(Cn2nc(-c3ccc([N+](=O)[O-])cc3)n(CC)c2=S)CCO1 ZINC000151966474 1418107691 /nfs/dbraw/zinc/10/76/91/1418107691.db2.gz BCYBDULDUPAPRY-HNNXBMFYSA-N 0 0 377.470 3.077 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000151971616 1418108867 /nfs/dbraw/zinc/10/88/67/1418108867.db2.gz DEDWJTIYAMAPNL-UHFFFAOYSA-N 0 0 376.434 3.019 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000151976943 1418110790 /nfs/dbraw/zinc/11/07/90/1418110790.db2.gz RBYPRAIIHNWCDZ-MHZLTWQESA-N 0 0 390.461 3.061 20 5 GGBDRN O=C(C[C@H]1COCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1cccs1 ZINC000151979389 1418111356 /nfs/dbraw/zinc/11/13/56/1418111356.db2.gz SHLOWAWLNUAKLO-AWEZNQCLSA-N 0 0 394.836 3.424 20 5 GGBDRN C[C@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000151988829 1418114115 /nfs/dbraw/zinc/11/41/15/1418114115.db2.gz OQTASZYQSXOISW-AWEZNQCLSA-N 0 0 381.392 3.282 20 5 GGBDRN C[C@@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000151988892 1418114251 /nfs/dbraw/zinc/11/42/51/1418114251.db2.gz OQTASZYQSXOISW-CQSZACIVSA-N 0 0 381.392 3.282 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)c2nnc(C3CC3)n2Cc2ccccc2)c1 ZINC000151992024 1418114771 /nfs/dbraw/zinc/11/47/71/1418114771.db2.gz DFONBRBAULTGGL-UHFFFAOYSA-N 0 0 398.444 3.086 20 5 GGBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000152001549 1418117449 /nfs/dbraw/zinc/11/74/49/1418117449.db2.gz UBJRUXBTUKWYHC-IPELMVKDSA-N 0 0 385.464 3.273 20 5 GGBDRN O=[N+]([O-])c1ccccc1Sc1nnc(-c2cnccn2)n1Cc1ccco1 ZINC000152024870 1418123762 /nfs/dbraw/zinc/12/37/62/1418123762.db2.gz LEKLEZXHEPBEJT-UHFFFAOYSA-N 0 0 380.389 3.436 20 5 GGBDRN CN(CC(C)(C)CN1CCOCC1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178988059 1429235657 /nfs/dbraw/zinc/23/56/57/1429235657.db2.gz DRDPYSSCAZHWAK-UHFFFAOYSA-N 0 0 391.493 3.240 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cnn(-c2ccc(F)cc2)n1 ZINC000152035335 1418126961 /nfs/dbraw/zinc/12/69/61/1418126961.db2.gz NTZYBYQCQDVRSF-UHFFFAOYSA-N 0 0 393.281 3.168 20 5 GGBDRN C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000152045083 1418129156 /nfs/dbraw/zinc/12/91/56/1418129156.db2.gz PHVQCLWVEUAERK-RYUDHWBXSA-N 0 0 378.812 3.469 20 5 GGBDRN C[C@H]1COCCN1c1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1 ZINC000152050632 1418130065 /nfs/dbraw/zinc/13/00/65/1418130065.db2.gz UPVYLYHUFVSBTA-NSHDSACASA-N 0 0 377.347 3.350 20 5 GGBDRN CCn1c(Sc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)nnc1-c1ccccn1 ZINC000152066440 1418135784 /nfs/dbraw/zinc/13/57/84/1418135784.db2.gz ITFDFAMQYLTIAD-UHFFFAOYSA-N 0 0 396.432 3.304 20 5 GGBDRN CC(C)(C)[C@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000152073689 1418137949 /nfs/dbraw/zinc/13/79/49/1418137949.db2.gz YEWSSALNFIQWNE-GOSISDBHSA-N 0 0 387.411 3.367 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@H](O)Cc1ccccc1 ZINC000152079088 1418139524 /nfs/dbraw/zinc/13/95/24/1418139524.db2.gz MHFSEUMYKXZBSW-HRAATJIYSA-N 0 0 397.475 3.307 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2nnc(-c3ccccn3)n2Cc2ccco2)nc1 ZINC000152093111 1418143648 /nfs/dbraw/zinc/14/36/48/1418143648.db2.gz ZXYSJKZTYLJGOC-UHFFFAOYSA-N 0 0 380.389 3.436 20 5 GGBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@@H]([C@@H]2CCCO2)C1 ZINC000152093211 1418143739 /nfs/dbraw/zinc/14/37/39/1418143739.db2.gz IPAYRXNFLQKEQJ-VQTJNVASSA-N 0 0 397.431 3.358 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCCC[C@@H]3O)cc2[N+](=O)[O-])C1 ZINC000152102311 1418145958 /nfs/dbraw/zinc/14/59/58/1418145958.db2.gz NNCKTIDIKWJYQY-DZASIIFFSA-N 0 0 375.469 3.110 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C12CCC2 ZINC000152130227 1418152394 /nfs/dbraw/zinc/15/23/94/1418152394.db2.gz JSNVWGHOUCHLTN-RTBURBONSA-N 0 0 387.480 3.275 20 5 GGBDRN Cc1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1 ZINC000152138665 1418155821 /nfs/dbraw/zinc/15/58/21/1418155821.db2.gz PUTHGYHIFFVREZ-IBGZPJMESA-N 0 0 384.432 3.320 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1-n1nc(C)cc1C ZINC000152162620 1418161907 /nfs/dbraw/zinc/16/19/07/1418161907.db2.gz DPSMKJAXLLKBPA-UHFFFAOYSA-N 0 0 379.420 3.369 20 5 GGBDRN Cc1nn(C)c2nc(C)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)c12 ZINC000152193516 1418169524 /nfs/dbraw/zinc/16/95/24/1418169524.db2.gz VBKIEAKVQSTSQB-UHFFFAOYSA-N 0 0 379.420 3.298 20 5 GGBDRN CNC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000178999670 1429239099 /nfs/dbraw/zinc/23/90/99/1429239099.db2.gz JJZJAVWMVFDBBM-UHFFFAOYSA-N 0 0 387.461 3.248 20 5 GGBDRN O=C([C@@H]1CC(=O)N(Cc2ccccc2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152202254 1418172250 /nfs/dbraw/zinc/17/22/50/1418172250.db2.gz YJXREDCUPYTVRM-GOSISDBHSA-N 0 0 393.443 3.135 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000152207162 1418172916 /nfs/dbraw/zinc/17/29/16/1418172916.db2.gz JQFCLFPIAOZERN-RDTXWAMCSA-N 0 0 387.436 3.420 20 5 GGBDRN Cc1cc2ncn(C[C@@H](O)Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)c2cc1C ZINC000152211420 1418174351 /nfs/dbraw/zinc/17/43/51/1418174351.db2.gz TZOMFMSOEMEZAT-LJQANCHMSA-N 0 0 391.431 3.486 20 5 GGBDRN Cc1cc(S(C)(=O)=O)cc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000179001693 1429239668 /nfs/dbraw/zinc/23/96/68/1429239668.db2.gz XYBNABWZSISVTG-CYBMUJFWSA-N 0 0 376.434 3.106 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C12CCC2 ZINC000152225903 1418178494 /nfs/dbraw/zinc/17/84/94/1418178494.db2.gz QWTQHQMSAPNJFI-HUUCEWRRSA-N 0 0 377.397 3.197 20 5 GGBDRN O=[N+]([O-])c1ccn(C[C@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)n1 ZINC000152245972 1418182525 /nfs/dbraw/zinc/18/25/25/1418182525.db2.gz XITMXQGEZZBQDX-KRWDZBQOSA-N 0 0 389.358 3.237 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152247495 1418183167 /nfs/dbraw/zinc/18/31/67/1418183167.db2.gz PLSBWQXLYADQLK-UHFFFAOYSA-N 0 0 388.445 3.112 20 5 GGBDRN Cc1ccn(C)c(=O)c1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000152248414 1418183771 /nfs/dbraw/zinc/18/37/71/1418183771.db2.gz NKZCGHHXIWBMLM-UHFFFAOYSA-N 0 0 398.341 3.061 20 5 GGBDRN O=C(Cc1csc(-c2cnccn2)n1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152261215 1418187548 /nfs/dbraw/zinc/18/75/48/1418187548.db2.gz DCJLWQSPGLFTQX-UHFFFAOYSA-N 0 0 395.444 3.242 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1OC)C(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000152277414 1418191964 /nfs/dbraw/zinc/19/19/64/1418191964.db2.gz JQWBAVADSYZTLN-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN CN(CCC(=O)OC(C)(C)C)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000152285001 1418195068 /nfs/dbraw/zinc/19/50/68/1418195068.db2.gz BUXSPEVREFAYRT-UHFFFAOYSA-N 0 0 391.468 3.001 20 5 GGBDRN O=C(CCCNC(=O)c1ccc(F)cc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152285787 1418195126 /nfs/dbraw/zinc/19/51/26/1418195126.db2.gz JKVHTXLELXSDKH-UHFFFAOYSA-N 0 0 399.422 3.435 20 5 GGBDRN CN(C(=O)c1cn(-c2ccccc2C(F)(F)F)nn1)c1cccc([N+](=O)[O-])c1 ZINC000179021088 1429244363 /nfs/dbraw/zinc/24/43/63/1429244363.db2.gz VHCIVTSLRLWRRG-UHFFFAOYSA-N 0 0 391.309 3.471 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc1Cl ZINC000179027258 1429245488 /nfs/dbraw/zinc/24/54/88/1429245488.db2.gz LULOTAPTJMBSDR-SFHVURJKSA-N 0 0 389.795 3.224 20 5 GGBDRN O=[N+]([O-])c1ccccc1CN(C1CC1)S(=O)(=O)c1cccc2cccnc21 ZINC000179043337 1429248504 /nfs/dbraw/zinc/24/85/04/1429248504.db2.gz UOBQCOKTCHDRHO-UHFFFAOYSA-N 0 0 383.429 3.496 20 5 GGBDRN C[C@@H]1CN(c2ccc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)cn2)C[C@H](C)O1 ZINC000179092988 1429260680 /nfs/dbraw/zinc/26/06/80/1429260680.db2.gz OHGMKUYZTGICCO-GASCZTMLSA-N 0 0 396.447 3.196 20 5 GGBDRN CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000179097427 1429262104 /nfs/dbraw/zinc/26/21/04/1429262104.db2.gz QAAMWTMMVOZDQT-SDTVSMOJSA-N 0 0 389.477 3.132 20 5 GGBDRN COC(=O)c1cc(OC[C@@H](O)c2ccccc2Br)ccc1[N+](=O)[O-] ZINC000179114157 1429266701 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COc1c(F)ccc(F)c1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000152706073 1422217035 /nfs/dbraw/zinc/21/70/35/1422217035.db2.gz YTLWUMGAZRSUQE-UHFFFAOYSA-N 0 0 379.363 3.422 20 5 GGBDRN O=C(NCC(=O)N1CCC[C@H]2CCCC[C@H]21)c1c(Cl)cccc1[N+](=O)[O-] ZINC000152712943 1422220295 /nfs/dbraw/zinc/22/02/95/1422220295.db2.gz MOZBYYFKGQLGPS-TZMCWYRMSA-N 0 0 379.844 3.159 20 5 GGBDRN Cc1cc(F)cc(NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c1 ZINC000152712554 1422220948 /nfs/dbraw/zinc/22/09/48/1422220948.db2.gz NMEBHNOMWUWMQB-UHFFFAOYSA-N 0 0 382.351 3.149 20 5 GGBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000152717804 1422222885 /nfs/dbraw/zinc/22/28/85/1422222885.db2.gz VFLNAUVWXXVLKA-AWEZNQCLSA-N 0 0 380.404 3.237 20 5 GGBDRN Cn1cc(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000152743059 1422233381 /nfs/dbraw/zinc/23/33/81/1422233381.db2.gz CPJXFMQBLJDBGO-NSHGMRRFSA-N 0 0 388.427 3.311 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N[C@@H]2CCc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000152752172 1422236428 /nfs/dbraw/zinc/23/64/28/1422236428.db2.gz SXRGVODKZJJBDY-OAHLLOKOSA-N 0 0 379.413 3.084 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H](C[NH+]2CCCCC2)c2ccccc2)c(-c2nnn[n-]2)c1 ZINC000823640126 1429541337 /nfs/dbraw/zinc/54/13/37/1429541337.db2.gz ULEHHSSQIWLSSS-LJQANCHMSA-N 0 0 393.451 3.414 20 5 GGBDRN C[C@@H](Oc1cccnc1)C(=O)OCc1ccc([N+](=O)[O-])cc1Br ZINC000152792070 1422249911 /nfs/dbraw/zinc/24/99/11/1422249911.db2.gz UOYRXCSPQMTFPZ-SNVBAGLBSA-N 0 0 381.182 3.263 20 5 GGBDRN O=C(CSc1nncs1)OCc1ccc([N+](=O)[O-])cc1Br ZINC000152793152 1422250764 /nfs/dbraw/zinc/25/07/64/1422250764.db2.gz MRPLHTUHEDEMEH-UHFFFAOYSA-N 0 0 390.240 3.044 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CSCCS1 ZINC000152809589 1422257128 /nfs/dbraw/zinc/25/71/28/1422257128.db2.gz KEYGBWMDQPORKE-NSHDSACASA-N 0 0 378.269 3.249 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CCOC(C)(C)C2)c1=S ZINC000152813864 1422258045 /nfs/dbraw/zinc/25/80/45/1422258045.db2.gz WQVZIRNWOJOTNQ-UHFFFAOYSA-N 0 0 377.470 3.077 20 5 GGBDRN Cc1ccc(-n2nccc2NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)nn1 ZINC000152839561 1422267209 /nfs/dbraw/zinc/26/72/09/1422267209.db2.gz QJRXYBSLPRTWQX-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000152840357 1422267214 /nfs/dbraw/zinc/26/72/14/1422267214.db2.gz WRWZSHUCCHJMOV-LBPRGKRZSA-N 0 0 376.482 3.250 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)CCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000152847268 1422269529 /nfs/dbraw/zinc/26/95/29/1422269529.db2.gz ZQABVLRUHHCGIR-UHFFFAOYSA-N 0 0 398.868 3.394 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000152863176 1422275334 /nfs/dbraw/zinc/27/53/34/1422275334.db2.gz UDQKPFMXVOJFBO-LLVKDONJSA-N 0 0 394.859 3.190 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000152864472 1422276188 /nfs/dbraw/zinc/27/61/88/1422276188.db2.gz DDFROZBCYRSCQW-HNNXBMFYSA-N 0 0 378.432 3.261 20 5 GGBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000152873087 1422279434 /nfs/dbraw/zinc/27/94/34/1422279434.db2.gz NUNFIMAVQOLEHE-AWEZNQCLSA-N 0 0 380.404 3.237 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C1 ZINC000152886987 1422284090 /nfs/dbraw/zinc/28/40/90/1422284090.db2.gz LJNCKPIFIJTQFM-ZDUSSCGKSA-N 0 0 385.376 3.450 20 5 GGBDRN Cc1ccc(NCCCNC(=O)N[C@@H]2CCOC3(CCCC3)C2)c([N+](=O)[O-])c1 ZINC000152890264 1422284704 /nfs/dbraw/zinc/28/47/04/1422284704.db2.gz CKNQJARWWSEMIR-MRXNPFEDSA-N 0 0 390.484 3.496 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)c1ccc(-c2ccccc2)nn1 ZINC000152891316 1422285687 /nfs/dbraw/zinc/28/56/87/1422285687.db2.gz SPPNSYJVBREALT-UHFFFAOYSA-N 0 0 377.404 3.394 20 5 GGBDRN Cc1cc(Cl)ncc1NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179760897 1429545985 /nfs/dbraw/zinc/54/59/85/1429545985.db2.gz GGVGRHCPBIDJDT-UHFFFAOYSA-N 0 0 376.800 3.041 20 5 GGBDRN Cc1cccc2c(=O)n(CCC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)cnc12 ZINC000152935675 1422300764 /nfs/dbraw/zinc/30/07/64/1422300764.db2.gz FBIJFZDJVBMVQQ-UHFFFAOYSA-N 0 0 380.404 3.259 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](C)c2noc(-c3ccccc3)n2)c1[N+](=O)[O-] ZINC000152943024 1422303599 /nfs/dbraw/zinc/30/35/99/1422303599.db2.gz NAKWSWVXYZXWCO-LLVKDONJSA-N 0 0 383.364 3.390 20 5 GGBDRN COc1cc(C(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c([N+](=O)[O-])cc1OC ZINC000152945484 1422304137 /nfs/dbraw/zinc/30/41/37/1422304137.db2.gz CTOBKLSRCXNESF-UHFFFAOYSA-N 0 0 399.447 3.191 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)c2c(C)noc2C)cc1OC ZINC000152950347 1422304783 /nfs/dbraw/zinc/30/47/83/1422304783.db2.gz QQSCFSPUWVWGLL-SNVBAGLBSA-N 0 0 377.397 3.140 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)Cn1nc(-c2ccccc2)ccc1=O ZINC000152957070 1422307326 /nfs/dbraw/zinc/30/73/26/1422307326.db2.gz CUQVPDKPOVOZLB-UHFFFAOYSA-N 0 0 378.388 3.074 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCN(c4ccccc4O)CC3)co2)cc1 ZINC000152955598 1422307458 /nfs/dbraw/zinc/30/74/58/1422307458.db2.gz XLNGRVAKTBLXMX-UHFFFAOYSA-N 0 0 380.404 3.278 20 5 GGBDRN CCc1nc2c(s1)[C@H](N(C)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000152975629 1422313434 /nfs/dbraw/zinc/31/34/34/1422313434.db2.gz KKEFSSMSXKOYKI-OAHLLOKOSA-N 0 0 395.506 3.453 20 5 GGBDRN CC1(C)NC(=O)N(CCCOc2ccc([N+](=O)[O-])cc2-c2cccs2)C1=O ZINC000152986176 1422317833 /nfs/dbraw/zinc/31/78/33/1422317833.db2.gz YXXUDEFZSIEVNL-UHFFFAOYSA-N 0 0 389.433 3.423 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(c3ccc(C)cc3)C2=O)c1 ZINC000153002649 1422322354 /nfs/dbraw/zinc/32/23/54/1422322354.db2.gz XGYADFHRCGZDNQ-MRXNPFEDSA-N 0 0 385.445 3.160 20 5 GGBDRN CN(C)c1nnc(-c2ccc(NC(=O)NCc3ccccc3[N+](=O)[O-])cc2)o1 ZINC000179765123 1429548158 /nfs/dbraw/zinc/54/81/58/1429548158.db2.gz KBNJSUJXFLMHKU-UHFFFAOYSA-N 0 0 382.380 3.033 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccn2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153024951 1422330700 /nfs/dbraw/zinc/33/07/00/1422330700.db2.gz MFQGMCRPZAJGLD-AWEZNQCLSA-N 0 0 395.444 3.122 20 5 GGBDRN CCN(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1nc(C)cs1 ZINC000153025547 1422331051 /nfs/dbraw/zinc/33/10/51/1422331051.db2.gz KUAXPPNLZNIZFC-UHFFFAOYSA-N 0 0 390.421 3.101 20 5 GGBDRN CC1(C)CCC[C@@H](CC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000153036400 1422334773 /nfs/dbraw/zinc/33/47/73/1422334773.db2.gz XDMOSOXWDFYVRV-INIZCTEOSA-N 0 0 387.480 3.486 20 5 GGBDRN O=C(N[C@@H](CCO)c1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000153039843 1422335529 /nfs/dbraw/zinc/33/55/29/1422335529.db2.gz UCQSKMFKDKBUGI-SFHVURJKSA-N 0 0 383.448 3.051 20 5 GGBDRN Cc1ccc(-c2nc3ccccc3n2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)s1 ZINC000153040057 1422336752 /nfs/dbraw/zinc/33/67/52/1422336752.db2.gz CSHFJDFNCLITAO-AWEZNQCLSA-N 0 0 383.433 3.239 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)Cc2ccccc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000153041320 1422336825 /nfs/dbraw/zinc/33/68/25/1422336825.db2.gz XGJRJGOTAHQRTB-OAHLLOKOSA-N 0 0 378.432 3.379 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCO[C@H]2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000153061518 1422343535 /nfs/dbraw/zinc/34/35/35/1422343535.db2.gz DSLFMYYQVWXCEM-CXAGYDPISA-N 0 0 399.513 3.098 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC(Oc2ccccc2Cl)CC1 ZINC000153063611 1422343632 /nfs/dbraw/zinc/34/36/32/1422343632.db2.gz ZXGUTOILXUEOMD-UHFFFAOYSA-N 0 0 377.784 3.032 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCN(Cc2ccc(F)cc2)CC1 ZINC000153069298 1422346056 /nfs/dbraw/zinc/34/60/56/1422346056.db2.gz VHMFXGDQNBGVLS-UHFFFAOYSA-N 0 0 385.439 3.401 20 5 GGBDRN CC(C)[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(C(F)(F)F)cc1 ZINC000153072426 1422346611 /nfs/dbraw/zinc/34/66/11/1422346611.db2.gz KCRZVTRQYMVSQN-KRWDZBQOSA-N 0 0 397.353 3.289 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000153073922 1422346964 /nfs/dbraw/zinc/34/69/64/1422346964.db2.gz AHQYKELYKVMEIH-HNNXBMFYSA-N 0 0 392.415 3.419 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)Cc2cccc([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000153072669 1422347316 /nfs/dbraw/zinc/34/73/16/1422347316.db2.gz GNVFHJJHWMKBIZ-HNNXBMFYSA-N 0 0 378.432 3.379 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCc1nc(-c2ccccn2)cs1 ZINC000153083599 1422350760 /nfs/dbraw/zinc/35/07/60/1422350760.db2.gz BSBFHXDGCCXPOL-UHFFFAOYSA-N 0 0 382.445 3.405 20 5 GGBDRN COCCOc1cc(C)ccc1CNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000153085477 1422350956 /nfs/dbraw/zinc/35/09/56/1422350956.db2.gz FGBSAZYRIKWISH-UHFFFAOYSA-N 0 0 376.384 3.306 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)Nc2cc([N+](=O)[O-])ccc2OC)o1 ZINC000153100505 1422357305 /nfs/dbraw/zinc/35/73/05/1422357305.db2.gz CTBWSOHBCCOFIJ-OAHLLOKOSA-N 0 0 375.381 3.364 20 5 GGBDRN CCS[C@H]1CCCCN(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C1 ZINC000153107644 1422358996 /nfs/dbraw/zinc/35/89/96/1422358996.db2.gz GQXFQVGPWVLDQV-KRWDZBQOSA-N 0 0 388.493 3.384 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)COc2cccc(I)c2)c1 ZINC000153116451 1422362020 /nfs/dbraw/zinc/36/20/20/1422362020.db2.gz OXEQGLWDMFEWGH-CQSZACIVSA-N 0 0 385.157 3.312 20 5 GGBDRN COC(=O)C1(N(C)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CCCCC1 ZINC000153118729 1422363503 /nfs/dbraw/zinc/36/35/03/1422363503.db2.gz LJOXNVLQKQWLFM-UHFFFAOYSA-N 0 0 399.241 3.305 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000153125007 1422365469 /nfs/dbraw/zinc/36/54/69/1422365469.db2.gz NOKKLOOJTHRULP-LLVKDONJSA-N 0 0 398.316 3.156 20 5 GGBDRN Cc1nc(Cc2ccccc2)sc1[C@@H](C)OC(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000153127300 1422365952 /nfs/dbraw/zinc/36/59/52/1422365952.db2.gz NENGXIGMWDGRAO-CYBMUJFWSA-N 0 0 386.433 3.451 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCc2c([nH]c3ccccc32)C1 ZINC000153126861 1422366156 /nfs/dbraw/zinc/36/61/56/1422366156.db2.gz AOSJPAYEYMXNGF-UHFFFAOYSA-N 0 0 388.383 3.116 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000153132168 1422367251 /nfs/dbraw/zinc/36/72/51/1422367251.db2.gz XMMPCBLSXRHIJE-OAHLLOKOSA-N 0 0 394.431 3.215 20 5 GGBDRN Cc1c(C(=O)N2CCc3c4ccccc4[nH]c3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000153132314 1422367411 /nfs/dbraw/zinc/36/74/11/1422367411.db2.gz CRLCIMFCKACTMT-UHFFFAOYSA-N 0 0 380.360 3.491 20 5 GGBDRN COc1ccc(C(=O)N[C@@H](C)Cc2cc(C)nn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000153143345 1422370694 /nfs/dbraw/zinc/37/06/94/1422370694.db2.gz BXQUXVACYKVFGI-AWEZNQCLSA-N 0 0 394.431 3.459 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000153159610 1422376427 /nfs/dbraw/zinc/37/64/27/1422376427.db2.gz GGGDJAMVUHLJHC-CQSZACIVSA-N 0 0 391.449 3.196 20 5 GGBDRN Cc1nc2ccccc2n1CCCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000153160901 1422377917 /nfs/dbraw/zinc/37/79/17/1422377917.db2.gz AQBAIYXULXFGPK-UHFFFAOYSA-N 0 0 391.431 3.483 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000153182869 1422384093 /nfs/dbraw/zinc/38/40/93/1422384093.db2.gz UFNABJMGYQXEHI-CQSZACIVSA-N 0 0 394.435 3.335 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCc1nccn1Cc1ccccc1 ZINC000153201081 1422390833 /nfs/dbraw/zinc/39/08/33/1422390833.db2.gz BRKYKASIILMPSX-UHFFFAOYSA-N 0 0 378.432 3.131 20 5 GGBDRN CSC[C@@H](CCO)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000153206493 1422393164 /nfs/dbraw/zinc/39/31/64/1422393164.db2.gz MXCDVDKCAOGLMY-OAHLLOKOSA-N 0 0 375.450 3.182 20 5 GGBDRN CCOc1cccc(CNC(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000153207139 1422393419 /nfs/dbraw/zinc/39/34/19/1422393419.db2.gz HUTDJJBGVUBBAV-UHFFFAOYSA-N 0 0 395.362 3.323 20 5 GGBDRN COCc1ccccc1CNC(=O)CNc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000153207686 1422393691 /nfs/dbraw/zinc/39/36/91/1422393691.db2.gz HCJOLHDCWTUHMD-UHFFFAOYSA-N 0 0 395.362 3.071 20 5 GGBDRN O=C(CNc1cc([N+](=O)[O-])ccc1OC(F)F)NCc1cc(F)cc(F)c1 ZINC000153207244 1422393981 /nfs/dbraw/zinc/39/39/81/1422393981.db2.gz ZLXJBDNNEHPGIT-UHFFFAOYSA-N 0 0 387.289 3.203 20 5 GGBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000153222454 1422399174 /nfs/dbraw/zinc/39/91/74/1422399174.db2.gz 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ZINC000154284711 1422867068 /nfs/dbraw/zinc/86/70/68/1422867068.db2.gz BBSRYMANGDAIKU-UHFFFAOYSA-N 0 0 382.413 3.262 20 5 GGBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)CC1(C)OCCO1 ZINC000154286436 1422867427 /nfs/dbraw/zinc/86/74/27/1422867427.db2.gz HTGPYYUCTPWHRL-HNNXBMFYSA-N 0 0 391.468 3.104 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000154305541 1422869902 /nfs/dbraw/zinc/86/99/02/1422869902.db2.gz GJWVTNFMHWFDCA-CYBMUJFWSA-N 0 0 385.420 3.062 20 5 GGBDRN COC(=O)CCn1nc(C)c(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000154310445 1422871012 /nfs/dbraw/zinc/87/10/12/1422871012.db2.gz VEQSSHZLGFFINJ-UHFFFAOYSA-N 0 0 386.452 3.136 20 5 GGBDRN CN(C)C(=O)COc1ccccc1CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154312208 1422871303 /nfs/dbraw/zinc/87/13/03/1422871303.db2.gz OCUPBSSIOVXCGB-UHFFFAOYSA-N 0 0 383.448 3.226 20 5 GGBDRN O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)Nc1n[nH]c2c1cccc2Cl ZINC000154333399 1422874292 /nfs/dbraw/zinc/87/42/92/1422874292.db2.gz 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394.234 3.071 20 5 GGBDRN O=Cc1ccc(OCC(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)c([N+](=O)[O-])c1 ZINC000179831891 1429601709 /nfs/dbraw/zinc/60/17/09/1429601709.db2.gz OTOAALOVUOJSKY-UHFFFAOYSA-N 0 0 390.302 3.239 20 5 GGBDRN Cc1c(CO)cc([N+](=O)[O-])c(N2CCOC3(C2)CCCCCC3)c1[N+](=O)[O-] ZINC000154560635 1422929615 /nfs/dbraw/zinc/92/96/15/1422929615.db2.gz OGBNJSITTYZZLE-UHFFFAOYSA-N 0 0 379.413 3.233 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ncon1 ZINC000154562042 1422931367 /nfs/dbraw/zinc/93/13/67/1422931367.db2.gz ALPQCSVFIHEYQV-NWDGAFQWSA-N 0 0 382.380 3.037 20 5 GGBDRN COc1cc(CN2CCC[C@@H](CO)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000154572331 1422938654 /nfs/dbraw/zinc/93/86/54/1422938654.db2.gz YUKOSDDUWNAFEY-QGZVFWFLSA-N 0 0 386.448 3.387 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)COc2ccc(OCC(F)(F)F)cc2)c1 ZINC000154584137 1422944364 /nfs/dbraw/zinc/94/43/64/1422944364.db2.gz FHODYBRLBOMKJM-CYBMUJFWSA-N 0 0 387.310 3.355 20 5 GGBDRN 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/nfs/dbraw/zinc/25/03/82/1423250382.db2.gz WZNSTMHJXTWMRM-UHFFFAOYSA-N 0 0 386.231 3.177 20 5 GGBDRN CCC[C@@H]1CCCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000155222158 1423254788 /nfs/dbraw/zinc/25/47/88/1423254788.db2.gz QSYPLNNXKKCGFK-CQSZACIVSA-N 0 0 375.425 3.322 20 5 GGBDRN CC(C)n1cccc1C(=O)OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000155278200 1423294870 /nfs/dbraw/zinc/29/48/70/1423294870.db2.gz VNFOQVQIYZNPFK-HNNXBMFYSA-N 0 0 385.420 3.439 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000155293222 1423304340 /nfs/dbraw/zinc/30/43/40/1423304340.db2.gz JETNNLOORSIQOY-OAHLLOKOSA-N 0 0 397.746 3.067 20 5 GGBDRN COc1ccc([C@@H]2CCN(CC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])C2)cc1 ZINC000155297910 1423306281 /nfs/dbraw/zinc/30/62/81/1423306281.db2.gz IURUSRYNHZUHCN-OAHLLOKOSA-N 0 0 385.420 3.040 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2[C@H]3Cc4ccccc4[C@@H]23)c(S(=O)(=O)N2CCCC2)c1 ZINC000155301752 1423308365 /nfs/dbraw/zinc/30/83/65/1423308365.db2.gz OCADSUCFXYDKHW-PWIZWCRZSA-N 0 0 399.472 3.130 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n1 ZINC000155303064 1423309129 /nfs/dbraw/zinc/30/91/29/1423309129.db2.gz JFZQCKYDYKCJJY-UHFFFAOYSA-N 0 0 395.375 3.236 20 5 GGBDRN CCC[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000155307184 1423311298 /nfs/dbraw/zinc/31/12/98/1423311298.db2.gz TXDURXOOLKKLKO-KBPBESRZSA-N 0 0 379.482 3.300 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nnc(-c2ccccc2)s1 ZINC000155329365 1423320085 /nfs/dbraw/zinc/32/00/85/1423320085.db2.gz UGAXZIIYPKWEPX-UHFFFAOYSA-N 0 0 385.405 3.444 20 5 GGBDRN CCCC1(CNC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CCC1 ZINC000155334484 1423321988 /nfs/dbraw/zinc/32/19/88/1423321988.db2.gz VLDINDNTGPXQSE-UHFFFAOYSA-N 0 0 388.468 3.033 20 5 GGBDRN O=C(c1cccc(OC(F)(F)F)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000155364214 1423334090 /nfs/dbraw/zinc/33/40/90/1423334090.db2.gz MTBQASMYYFGGRU-LBPRGKRZSA-N 0 0 396.325 3.215 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)ccc1[N+](=O)[O-] ZINC000155369338 1423337105 /nfs/dbraw/zinc/33/71/05/1423337105.db2.gz ABAOJTGJTICZIL-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN O=C(CCCc1ccccc1)N1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000155377156 1423340395 /nfs/dbraw/zinc/34/03/95/1423340395.db2.gz BKZDBGYKMJDQOT-UHFFFAOYSA-N 0 0 399.422 3.041 20 5 GGBDRN O=C(NC[C@@H](O)c1ccsc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000155398429 1423348218 /nfs/dbraw/zinc/34/82/18/1423348218.db2.gz VZNVTMWTFNDTEE-CQSZACIVSA-N 0 0 375.431 3.243 20 5 GGBDRN O=C(NCC1([C@H](O)c2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000155405098 1423350850 /nfs/dbraw/zinc/35/08/50/1423350850.db2.gz SDVIEYUHUGEXPA-HXUWFJFHSA-N 0 0 395.459 3.439 20 5 GGBDRN O=C(NCC1([C@H](O)c2ccccc2)CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000155432522 1423361635 /nfs/dbraw/zinc/36/16/35/1423361635.db2.gz ZTJLPJJUBMJVHU-LJQANCHMSA-N 0 0 381.432 3.413 20 5 GGBDRN CS(=O)(=O)c1cc(SCc2cnn(-c3ccccc3)c2)ccc1[N+](=O)[O-] ZINC000155486857 1423382723 /nfs/dbraw/zinc/38/27/23/1423382723.db2.gz MVZNVPVZECZSBA-UHFFFAOYSA-N 0 0 389.458 3.476 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)n1 ZINC000155514813 1423396083 /nfs/dbraw/zinc/39/60/83/1423396083.db2.gz PAJGNGOAHMGLQZ-SNVBAGLBSA-N 0 0 391.453 3.313 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000155518758 1423396428 /nfs/dbraw/zinc/39/64/28/1423396428.db2.gz VNKBNCFKWAEERV-QFIPXVFZSA-N 0 0 393.443 3.483 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@H](O)c2ccsc2)CC1 ZINC000155526097 1423400231 /nfs/dbraw/zinc/40/02/31/1423400231.db2.gz NKSMWQHCZVGFTM-SFHVURJKSA-N 0 0 389.477 3.356 20 5 GGBDRN O=[N+]([O-])c1cnn(CCN[C@H](c2ccccc2OC(F)F)C(F)(F)F)c1 ZINC000179914688 1429638576 /nfs/dbraw/zinc/63/85/76/1429638576.db2.gz UFBWZOLJXFGIKS-GFCCVEGCSA-N 0 0 380.273 3.286 20 5 GGBDRN CN(CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155534504 1423404606 /nfs/dbraw/zinc/40/46/06/1423404606.db2.gz ZRQRCROUXNXXHL-MRXNPFEDSA-N 0 0 396.852 3.087 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@H](O)CO[C@@H]2CCCc3ccccc32)c1 ZINC000155534074 1423404915 /nfs/dbraw/zinc/40/49/15/1423404915.db2.gz SMJOZKZJIPDSFY-YLJYHZDGSA-N 0 0 386.448 3.495 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000155541854 1423409049 /nfs/dbraw/zinc/40/90/49/1423409049.db2.gz WPDVJLQURJHONS-MAUKXSAKSA-N 0 0 390.823 3.213 20 5 GGBDRN O=C(NCC1([C@H](O)c2ccccc2)CC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155543914 1423410556 /nfs/dbraw/zinc/41/05/56/1423410556.db2.gz ZMRVHNWCIQKWTF-LJQANCHMSA-N 0 0 392.415 3.024 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2ccccc2S1 ZINC000155546746 1423412784 /nfs/dbraw/zinc/41/27/84/1423412784.db2.gz TXWGRWAGEPQJFL-GFCCVEGCSA-N 0 0 381.417 3.317 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3nnc(-c4ccccc4)s3)C2)nc1 ZINC000155563690 1423420474 /nfs/dbraw/zinc/42/04/74/1423420474.db2.gz QHUBUFXGMJGTOG-AWEZNQCLSA-N 0 0 382.449 3.195 20 5 GGBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2cc(F)ccc2Br)cc1F ZINC000155594318 1423435727 /nfs/dbraw/zinc/43/57/27/1423435727.db2.gz QAWFCXMBEXFKMA-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN(C)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155594285 1423435805 /nfs/dbraw/zinc/43/58/05/1423435805.db2.gz AZIBYSVKKUXPEI-OAHLLOKOSA-N 0 0 396.852 3.217 20 5 GGBDRN O=C(NC[C@@H](O)c1ccsc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155598591 1423437897 /nfs/dbraw/zinc/43/78/97/1423437897.db2.gz HRMOCUHJOKCICB-CQSZACIVSA-N 0 0 375.431 3.243 20 5 GGBDRN CC1(C)C[C@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000155605885 1423441493 /nfs/dbraw/zinc/44/14/93/1423441493.db2.gz GJSFJRMHNSDCTI-GFCCVEGCSA-N 0 0 389.374 3.489 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1 ZINC000155612413 1423446066 /nfs/dbraw/zinc/44/60/66/1423446066.db2.gz RHUMHSHUJHJDQY-UHFFFAOYSA-N 0 0 398.202 3.093 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCc2nc3c(s2)CCCC3)c1 ZINC000155621430 1423450890 /nfs/dbraw/zinc/45/08/90/1423450890.db2.gz SAZNFTBTRIRBII-UHFFFAOYSA-N 0 0 389.477 3.366 20 5 GGBDRN COc1ccc(CN(C)[C@@H]2CS(=O)(=O)c3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000155627492 1423454492 /nfs/dbraw/zinc/45/44/92/1423454492.db2.gz MTPCZGWHNVPQSQ-OAHLLOKOSA-N 0 0 396.852 3.217 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000179924011 1429643914 /nfs/dbraw/zinc/64/39/14/1429643914.db2.gz FUGQQHUBODVAAV-CQSZACIVSA-N 0 0 375.812 3.266 20 5 GGBDRN Cc1coc(-c2cc(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3)ccc2C)n1 ZINC000155669986 1423478137 /nfs/dbraw/zinc/47/81/37/1423478137.db2.gz YOXVQLGHLUMUMI-UHFFFAOYSA-N 0 0 394.387 3.122 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCCC[C@@H]1Oc1ccccc1C ZINC000155697857 1423491315 /nfs/dbraw/zinc/49/13/15/1423491315.db2.gz ZKJFACKLJOWFPW-AEFFLSMTSA-N 0 0 386.452 3.305 20 5 GGBDRN Cn1nc(C(C)(C)C)cc1NC(=O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000155706126 1423496938 /nfs/dbraw/zinc/49/69/38/1423496938.db2.gz RBYLWDZKOFKADB-UHFFFAOYSA-N 0 0 385.468 3.229 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NC[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-])c1ccccn1 ZINC000155713178 1423501267 /nfs/dbraw/zinc/50/12/67/1423501267.db2.gz WHOVULHUDBFEPP-NBQZKYEYSA-N 0 0 398.463 3.444 20 5 GGBDRN Cc1cccc(C(=O)N[C@H](C)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000155713741 1423501352 /nfs/dbraw/zinc/50/13/52/1423501352.db2.gz URSWLGAAENTDNZ-MRXNPFEDSA-N 0 0 383.448 3.161 20 5 GGBDRN O=C(CN(Cc1cccc([N+](=O)[O-])c1)C1CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000155718286 1423502917 /nfs/dbraw/zinc/50/29/17/1423502917.db2.gz ALTBUXCETPHNSZ-UHFFFAOYSA-N 0 0 396.403 3.057 20 5 GGBDRN O=C(CN(Cc1cccc([N+](=O)[O-])c1)C1CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000155728600 1423506495 /nfs/dbraw/zinc/50/64/95/1423506495.db2.gz QHGYQTIKWGYSON-UHFFFAOYSA-N 0 0 396.403 3.057 20 5 GGBDRN O=C(NCC1([C@H](O)c2ccccc2)CC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000155756651 1423519601 /nfs/dbraw/zinc/51/96/01/1423519601.db2.gz ZTBZKGPBSXORNE-LJQANCHMSA-N 0 0 392.415 3.024 20 5 GGBDRN CC[C@H](C)[C@H](O)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000155756991 1423519608 /nfs/dbraw/zinc/51/96/08/1423519608.db2.gz JOLZLCXXKXMXOE-CKFHNAJUSA-N 0 0 386.452 3.300 20 5 GGBDRN CC[C@H](C)[C@@H](O)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000155757229 1423520409 /nfs/dbraw/zinc/52/04/09/1423520409.db2.gz JOLZLCXXKXMXOE-NJSLBKSFSA-N 0 0 386.452 3.300 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@@H](c2ccsc2)O1 ZINC000155757956 1423520549 /nfs/dbraw/zinc/52/05/49/1423520549.db2.gz HXYFFZLSMDIALZ-ACJLOTCBSA-N 0 0 398.444 3.444 20 5 GGBDRN Cc1c(CN2C(=O)N[C@](C)(c3cc(F)cc(F)c3)C2=O)cccc1[N+](=O)[O-] ZINC000155763775 1423522853 /nfs/dbraw/zinc/52/28/53/1423522853.db2.gz PODVTKZQFIFOTL-GOSISDBHSA-N 0 0 375.331 3.149 20 5 GGBDRN Cc1ccccc1O[C@H]1CCCC[C@H]1NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000155765656 1423523633 /nfs/dbraw/zinc/52/36/33/1423523633.db2.gz AVZAGNMRTNFCKM-MJGOQNOKSA-N 0 0 397.431 3.348 20 5 GGBDRN CC[C@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1c(C)noc1C ZINC000155769871 1423526793 /nfs/dbraw/zinc/52/67/93/1423526793.db2.gz ZFCPUVDKCMRWEV-FZMZJTMJSA-N 0 0 376.413 3.276 20 5 GGBDRN CC(C)(C)Oc1ccc(NC(=O)C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000155785263 1423533286 /nfs/dbraw/zinc/53/32/86/1423533286.db2.gz SDSPLIGKLOUCMI-UHFFFAOYSA-N 0 0 397.431 3.296 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000155830202 1423552747 /nfs/dbraw/zinc/55/27/47/1423552747.db2.gz JFSJCSHMOHGIFL-OAHLLOKOSA-N 0 0 396.447 3.260 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2CCCOCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000179939477 1429652415 /nfs/dbraw/zinc/65/24/15/1429652415.db2.gz CQVVRMIEIPSBOY-GOEBONIOSA-N 0 0 384.436 3.462 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@H](Nc2ccccc2)C1 ZINC000155846292 1423559777 /nfs/dbraw/zinc/55/97/77/1423559777.db2.gz SAKREKYVIDQZMH-KRWDZBQOSA-N 0 0 391.431 3.497 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Oc2ccc(CO)cc2)cc1 ZINC000155856293 1423564406 /nfs/dbraw/zinc/56/44/06/1423564406.db2.gz BPTKCIBRMDBOON-UHFFFAOYSA-N 0 0 396.403 3.413 20 5 GGBDRN COC(=O)Cc1cccc(OC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000155858312 1423565638 /nfs/dbraw/zinc/56/56/38/1423565638.db2.gz VALOKRNGKQFERB-UHFFFAOYSA-N 0 0 394.177 3.292 20 5 GGBDRN Cc1cccc(C(=O)N[C@@H](C)C(=O)Nc2cccc(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000155888428 1423578677 /nfs/dbraw/zinc/57/86/77/1423578677.db2.gz FUBRFHNDAOYYKV-HNNXBMFYSA-N 0 0 396.447 3.260 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](C)C(=O)Nc2cccc(N3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000155900867 1423585816 /nfs/dbraw/zinc/58/58/16/1423585816.db2.gz GCNGBSVZPKLPRD-HNNXBMFYSA-N 0 0 396.447 3.260 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@H](c2ccsc2)O1 ZINC000155927797 1423597741 /nfs/dbraw/zinc/59/77/41/1423597741.db2.gz CAOOYKKPMJBOTJ-FZKQIMNGSA-N 0 0 398.444 3.444 20 5 GGBDRN CC[C@H]1CCC[C@@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)C1 ZINC000155976849 1423617076 /nfs/dbraw/zinc/61/70/76/1423617076.db2.gz KMFQEDREQJIRQD-UONOGXRCSA-N 0 0 394.497 3.093 20 5 GGBDRN CC[C@@H]1CCC[C@@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)C1 ZINC000155976733 1423617278 /nfs/dbraw/zinc/61/72/78/1423617278.db2.gz KMFQEDREQJIRQD-ZIAGYGMSSA-N 0 0 394.497 3.093 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(NC(=O)c2ccccc2)CC1 ZINC000156014994 1423634322 /nfs/dbraw/zinc/63/43/22/1423634322.db2.gz KLWFYHJPLANDLA-UHFFFAOYSA-N 0 0 382.420 3.330 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](CN1CCCC1=O)c1ccccc1 ZINC000156026415 1423639998 /nfs/dbraw/zinc/63/99/98/1423639998.db2.gz MOEOGCFYLCAXOI-SFHVURJKSA-N 0 0 382.420 3.388 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ncccc2Cl)ccc1[N+](=O)[O-] ZINC000179949724 1429659008 /nfs/dbraw/zinc/65/90/08/1429659008.db2.gz MVMRNJKJGCVGDZ-OAHLLOKOSA-N 0 0 388.811 3.195 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ncccc2Cl)ccc1[N+](=O)[O-] ZINC000179949740 1429659025 /nfs/dbraw/zinc/65/90/25/1429659025.db2.gz MVMRNJKJGCVGDZ-HNNXBMFYSA-N 0 0 388.811 3.195 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC(CNC(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000156030647 1423641885 /nfs/dbraw/zinc/64/18/85/1423641885.db2.gz OYWKDZCHJJUHBF-UHFFFAOYSA-N 0 0 381.404 3.111 20 5 GGBDRN CCC[C@H](C)[C@@H]1CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000156039964 1423646285 /nfs/dbraw/zinc/64/62/85/1423646285.db2.gz RHGZGANIECEPED-JSGCOSHPSA-N 0 0 381.860 3.405 20 5 GGBDRN CCCNC(=O)c1cccc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)c1 ZINC000156042137 1423647056 /nfs/dbraw/zinc/64/70/56/1423647056.db2.gz GDAUQPJRPVRNRL-UHFFFAOYSA-N 0 0 393.403 3.377 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccccc1)[C@H](CO)C1CC1 ZINC000179951651 1429659643 /nfs/dbraw/zinc/65/96/43/1429659643.db2.gz SKKXWXZQMTXYQK-GOSISDBHSA-N 0 0 385.420 3.408 20 5 GGBDRN Cn1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc(Cl)c1=O ZINC000156048737 1423649937 /nfs/dbraw/zinc/64/99/37/1423649937.db2.gz FYTRLIVGJMKQFY-UHFFFAOYSA-N 0 0 390.808 3.323 20 5 GGBDRN O=C(Cc1cccc(OCc2cccnc2)c1)NCc1ccc([N+](=O)[O-])cc1 ZINC000179951964 1429660049 /nfs/dbraw/zinc/66/00/49/1429660049.db2.gz KJTDQDGMVLJEOM-UHFFFAOYSA-N 0 0 377.400 3.428 20 5 GGBDRN O=C(N[C@@H](C[C@H]1CCOC1)c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000156059188 1423655642 /nfs/dbraw/zinc/65/56/42/1423655642.db2.gz RKGWAQDAGFFBHB-ACJLOTCBSA-N 0 0 380.404 3.369 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000156067841 1423658572 /nfs/dbraw/zinc/65/85/72/1423658572.db2.gz CLXBQYWXXBEIIQ-UHFFFAOYSA-N 0 0 376.457 3.452 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](c2ccsc2)O1 ZINC000156070790 1423659396 /nfs/dbraw/zinc/65/93/96/1423659396.db2.gz YGQIIPAJBDRACC-FZKQIMNGSA-N 0 0 398.444 3.444 20 5 GGBDRN 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ZINC000159418664 1424501250 /nfs/dbraw/zinc/50/12/50/1424501250.db2.gz ILTCIZSVYVNUNU-UHFFFAOYSA-N 0 0 385.351 3.302 20 5 GGBDRN COc1ccc(CC2CCN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000159439494 1424502937 /nfs/dbraw/zinc/50/29/37/1424502937.db2.gz RWGBNBHJTDADAY-UHFFFAOYSA-N 0 0 397.431 3.023 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCCN(CC(F)F)CC1 ZINC000159468635 1424504403 /nfs/dbraw/zinc/50/44/03/1424504403.db2.gz KPFJJYAIZLFIER-UHFFFAOYSA-N 0 0 394.325 3.001 20 5 GGBDRN COc1cc(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000159466830 1424504709 /nfs/dbraw/zinc/50/47/09/1424504709.db2.gz NGTAAOTXUHBUPL-UHFFFAOYSA-N 0 0 387.411 3.091 20 5 GGBDRN CC(=O)N1CC[C@@H](NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)C1 ZINC000159470934 1424505483 /nfs/dbraw/zinc/50/54/83/1424505483.db2.gz ASCZPRTUVLRONK-MRXNPFEDSA-N 0 0 399.472 3.405 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)n1 ZINC000159495689 1424508051 /nfs/dbraw/zinc/50/80/51/1424508051.db2.gz ISVZLGADKQAKMT-UHFFFAOYSA-N 0 0 396.363 3.261 20 5 GGBDRN C[C@H](O)CN(C)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000159500754 1424508363 /nfs/dbraw/zinc/50/83/63/1424508363.db2.gz VUNRAIBAIHVSES-SJCJKPOMSA-N 0 0 377.828 3.241 20 5 GGBDRN O=[N+]([O-])c1ccc(CSc2nnnn2C[C@H]2CCCO2)c(C(F)(F)F)c1 ZINC000159496776 1424508413 /nfs/dbraw/zinc/50/84/13/1424508413.db2.gz NMDDJTVKCROHRO-LLVKDONJSA-N 0 0 389.359 3.071 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cccc(CN2CCOCC2)c1 ZINC000159515335 1424509832 /nfs/dbraw/zinc/50/98/32/1424509832.db2.gz SZNSRFPQYFQLMX-UHFFFAOYSA-N 0 0 394.431 3.090 20 5 GGBDRN C[C@@H](O)CN(C)[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000159511773 1424510079 /nfs/dbraw/zinc/51/00/79/1424510079.db2.gz SJVHSIUMYZEJRY-PXAZEXFGSA-N 0 0 377.828 3.241 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000159545495 1424511737 /nfs/dbraw/zinc/51/17/37/1424511737.db2.gz RLKLIYJRVLCOEA-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CCC[C@@H](COC)C2)c1=S ZINC000159554151 1424513036 /nfs/dbraw/zinc/51/30/36/1424513036.db2.gz LSQRKKJTPNQDBG-CQSZACIVSA-N 0 0 391.497 3.325 20 5 GGBDRN O=C1C(=O)N(C2CCCCC2)C(=O)N1Cc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000159557631 1424513594 /nfs/dbraw/zinc/51/35/94/1424513594.db2.gz UGFRKFLHCYODAZ-UHFFFAOYSA-N 0 0 399.325 3.237 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@@]4(CCc5ccccc54)C3)n2)cc1 ZINC000159558702 1424513755 /nfs/dbraw/zinc/51/37/55/1424513755.db2.gz GEARPLBFAWNEJZ-NRFANRHFSA-N 0 0 392.415 3.319 20 5 GGBDRN COc1ccc(N(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1F ZINC000159571340 1424514781 /nfs/dbraw/zinc/51/47/81/1424514781.db2.gz LUZVOWMGLCOCEZ-UHFFFAOYSA-N 0 0 384.367 3.420 20 5 GGBDRN CCOC(=O)c1ccnc(N(Cc2cccs2)C[C@@H]2CCCO2)c1[N+](=O)[O-] ZINC000159571184 1424514923 /nfs/dbraw/zinc/51/49/23/1424514923.db2.gz MNASHCIKMLVMIP-ZDUSSCGKSA-N 0 0 391.449 3.414 20 5 GGBDRN CN(CC(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000159582650 1424515665 /nfs/dbraw/zinc/51/56/65/1424515665.db2.gz CPIYSTODQPPDAU-WMZOPIPTSA-N 0 0 383.448 3.315 20 5 GGBDRN CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)c1ccc(F)cc1F ZINC000159607950 1424517409 /nfs/dbraw/zinc/51/74/09/1424517409.db2.gz BCZZKEZXDSDHTA-AWEZNQCLSA-N 0 0 386.376 3.311 20 5 GGBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1OC)c1ccc(F)cc1F ZINC000159608094 1424517518 /nfs/dbraw/zinc/51/75/18/1424517518.db2.gz BCZZKEZXDSDHTA-CQSZACIVSA-N 0 0 386.376 3.311 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@H](C)c2nc(-c3ccncc3)cs2)c1[N+](=O)[O-] ZINC000159612728 1424518663 /nfs/dbraw/zinc/51/86/63/1424518663.db2.gz IZIHHFCDVVRUES-SNVBAGLBSA-N 0 0 386.437 3.280 20 5 GGBDRN CS[C@@H](CO)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000159647371 1424520658 /nfs/dbraw/zinc/52/06/58/1424520658.db2.gz PGQTUZFUIQNCKJ-UGSOOPFHSA-N 0 0 389.477 3.049 20 5 GGBDRN CS[C@@H](CO)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000159647513 1424520674 /nfs/dbraw/zinc/52/06/74/1424520674.db2.gz PGQTUZFUIQNCKJ-ACJLOTCBSA-N 0 0 389.477 3.049 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cn1)N1CCN(c2cccc(Cl)c2)CC1 ZINC000159652558 1424521103 /nfs/dbraw/zinc/52/11/03/1424521103.db2.gz NNQRAPUIDDYHCW-UHFFFAOYSA-N 0 0 392.868 3.084 20 5 GGBDRN C[C@@H]1CSc2ccccc2N(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000159685588 1424523875 /nfs/dbraw/zinc/52/38/75/1424523875.db2.gz ZHZJMCGYYAVVQD-LBPRGKRZSA-N 0 0 399.428 3.278 20 5 GGBDRN COc1ccccc1S(=O)(=O)Oc1ccc([N+](=O)[O-])cc1Br ZINC000159706092 1424526018 /nfs/dbraw/zinc/52/60/18/1424526018.db2.gz SLXHNFCSIBOQMQ-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)[C@@H](c2ccccc2)CO1 ZINC000159726404 1424528237 /nfs/dbraw/zinc/52/82/37/1424528237.db2.gz SKYVHMJKBDWUDW-MGPUTAFESA-N 0 0 392.415 3.383 20 5 GGBDRN CCC[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000159741641 1424530415 /nfs/dbraw/zinc/53/04/15/1424530415.db2.gz YWIYHQLTKOVDOA-MRXNPFEDSA-N 0 0 377.347 3.469 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159792371 1424536237 /nfs/dbraw/zinc/53/62/37/1424536237.db2.gz ZISPOYIRLPFFTN-MAUKXSAKSA-N 0 0 390.461 3.349 20 5 GGBDRN O=[N+]([O-])c1ccc(CSc2nnnn2C2CCOCC2)c(C(F)(F)F)c1 ZINC000159795222 1424536769 /nfs/dbraw/zinc/53/67/69/1424536769.db2.gz IKHHAVQZYOIQAD-UHFFFAOYSA-N 0 0 389.359 3.244 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159796911 1424538484 /nfs/dbraw/zinc/53/84/84/1424538484.db2.gz OHFASVIQLNTJFO-CJNGLKHVSA-N 0 0 394.424 3.180 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC(C)(C)Oc2ccccc21 ZINC000159823347 1424540029 /nfs/dbraw/zinc/54/00/29/1424540029.db2.gz PYWLQAOXWCUHAZ-DYVFJYSZSA-N 0 0 397.431 3.132 20 5 GGBDRN Cc1cccc([C@@H](C)C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000159844858 1424541614 /nfs/dbraw/zinc/54/16/14/1424541614.db2.gz UQXOZYNAVHFKIC-CQSZACIVSA-N 0 0 387.461 3.053 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159842392 1424542047 /nfs/dbraw/zinc/54/20/47/1424542047.db2.gz JVIKBEUQPSLKIC-GOEBONIOSA-N 0 0 376.434 3.041 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000159837996 1424542098 /nfs/dbraw/zinc/54/20/98/1424542098.db2.gz VPIQFKBEQCHFRO-KSSFIOAISA-N 0 0 376.434 3.041 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000159838274 1424542169 /nfs/dbraw/zinc/54/21/69/1424542169.db2.gz VPIQFKBEQCHFRO-KDOFPFPSSA-N 0 0 376.434 3.041 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(C)Cc1cccc(N(C)C)c1 ZINC000159855846 1424542890 /nfs/dbraw/zinc/54/28/90/1424542890.db2.gz RBVISGZQUZNPEV-CQSZACIVSA-N 0 0 386.452 3.128 20 5 GGBDRN COc1ccc(C(=O)O[C@@H](c2c(C)nn(C)c2C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000159870518 1424546363 /nfs/dbraw/zinc/54/63/63/1424546363.db2.gz ZPIGCPZMWJURIP-AWEZNQCLSA-N 0 0 387.314 3.414 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000159919831 1424552777 /nfs/dbraw/zinc/55/27/77/1424552777.db2.gz CMHMCWHNUJRDPW-YJBOKZPZSA-N 0 0 388.420 3.462 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](c2c(C)nn(C)c2C)C(F)(F)F)c1 ZINC000159945874 1424555402 /nfs/dbraw/zinc/55/54/02/1424555402.db2.gz WLKQADTYWDOKBH-AWEZNQCLSA-N 0 0 387.314 3.414 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000159955840 1424556694 /nfs/dbraw/zinc/55/66/94/1424556694.db2.gz PGIBTUDYJZNKAV-OAQYLSRUSA-N 0 0 392.415 3.316 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NC[C@H](O)c1c(Cl)cccc1Cl ZINC000159989906 1424559915 /nfs/dbraw/zinc/55/99/15/1424559915.db2.gz KYLBTGRBUVGBBH-AWEZNQCLSA-N 0 0 384.219 3.163 20 5 GGBDRN COc1cc(N2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)ccc1[N+](=O)[O-] ZINC000160005346 1424561837 /nfs/dbraw/zinc/56/18/37/1424561837.db2.gz ZPDMTERTGADHEC-IBGZPJMESA-N 0 0 377.441 3.441 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@@H](c1c(C)nn(C)c1C)C(F)(F)F ZINC000160056208 1424568451 /nfs/dbraw/zinc/56/84/51/1424568451.db2.gz GIAPJUDONOJWPT-AWEZNQCLSA-N 0 0 387.314 3.414 20 5 GGBDRN Cn1c(SCc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cnccn1 ZINC000160066893 1424569779 /nfs/dbraw/zinc/56/97/79/1424569779.db2.gz YUCZEUIOYACAFI-UHFFFAOYSA-N 0 0 396.354 3.491 20 5 GGBDRN O=C(N[C@@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000160069800 1424570911 /nfs/dbraw/zinc/57/09/11/1424570911.db2.gz DLXQAHOGDMQZCQ-OAHLLOKOSA-N 0 0 387.461 3.300 20 5 GGBDRN Cn1cnnc1[C@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160086153 1424572212 /nfs/dbraw/zinc/57/22/12/1424572212.db2.gz QOMSRSQAURQDPE-GFCCVEGCSA-N 0 0 384.318 3.111 20 5 GGBDRN Cn1cc(C[C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)cn1 ZINC000160113118 1424575146 /nfs/dbraw/zinc/57/51/46/1424575146.db2.gz COEJGRXMRQDOIN-NSHDSACASA-N 0 0 397.357 3.444 20 5 GGBDRN CC(=O)c1ccc(N2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)c(F)c1 ZINC000160110077 1424575845 /nfs/dbraw/zinc/57/58/45/1424575845.db2.gz NQKDABLNWNBDKU-UHFFFAOYSA-N 0 0 399.422 3.136 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCOC2(CCOCC2)C1 ZINC000160119786 1424576498 /nfs/dbraw/zinc/57/64/98/1424576498.db2.gz LKVDVLGBJPKYMR-UHFFFAOYSA-N 0 0 389.330 3.027 20 5 GGBDRN CN(C(=O)c1cc(F)ccc1[N+](=O)[O-])C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000160137869 1424577775 /nfs/dbraw/zinc/57/77/75/1424577775.db2.gz KTAYFKWBPFHTLT-UHFFFAOYSA-N 0 0 381.404 3.205 20 5 GGBDRN Cc1c(CO)cc([N+](=O)[O-])c(NC[C@@](C)(O)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000160162912 1424581076 /nfs/dbraw/zinc/58/10/76/1424581076.db2.gz NAKGGNUYDVYKNI-QGZVFWFLSA-N 0 0 395.799 3.277 20 5 GGBDRN C[C@H](OCCCNC(=O)CSc1ccc([N+](=O)[O-])cn1)c1ccccc1 ZINC000160164154 1424582595 /nfs/dbraw/zinc/58/25/95/1424582595.db2.gz HLMAQGLWDKTXCT-AWEZNQCLSA-N 0 0 375.450 3.366 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@@H](C(=O)Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000160178159 1424583477 /nfs/dbraw/zinc/58/34/77/1424583477.db2.gz AAHMTDDGFGCDLF-QGZVFWFLSA-N 0 0 381.432 3.323 20 5 GGBDRN CC(C)OC(=O)[C@@H](C)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160197562 1424586326 /nfs/dbraw/zinc/58/63/26/1424586326.db2.gz HNWCFSLREJLJEL-VIFPVBQESA-N 0 0 377.319 3.323 20 5 GGBDRN O=C(c1ccc(F)cc1)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000160193756 1424586568 /nfs/dbraw/zinc/58/65/68/1424586568.db2.gz IYHDCBQZZBADFN-AWEZNQCLSA-N 0 0 392.408 3.018 20 5 GGBDRN C[C@@H](O)C[C@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000160205289 1424587227 /nfs/dbraw/zinc/58/72/27/1424587227.db2.gz OWOAKNOZCSJTDO-RHSMWYFYSA-N 0 0 383.448 3.454 20 5 GGBDRN COc1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)ccc1N1CCCC1=O ZINC000160216684 1424588363 /nfs/dbraw/zinc/58/83/63/1424588363.db2.gz QCJHCKXIUUBCPM-UHFFFAOYSA-N 0 0 383.404 3.220 20 5 GGBDRN Cc1c(CC(=O)Nc2cccc(-c3nnnn3C3CC3)c2)cccc1[N+](=O)[O-] ZINC000160228647 1424589123 /nfs/dbraw/zinc/58/91/23/1424589123.db2.gz ZQMSJNVAGNHHPT-UHFFFAOYSA-N 0 0 378.392 3.073 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000160246622 1424589619 /nfs/dbraw/zinc/58/96/19/1424589619.db2.gz FAEBSBBEGSCLQT-HNNXBMFYSA-N 0 0 382.844 3.439 20 5 GGBDRN Cc1c(C(=O)N[C@H]2CCOC3(CCCC3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000160240939 1424589877 /nfs/dbraw/zinc/58/98/77/1424589877.db2.gz RTUXDYFQMVDXNU-ZDUSSCGKSA-N 0 0 377.397 3.341 20 5 GGBDRN O=C(NCCCOC[C@H]1CCOC1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000160244893 1424589922 /nfs/dbraw/zinc/58/99/22/1424589922.db2.gz OEDZWMNINDSGHK-LLVKDONJSA-N 0 0 391.346 3.178 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2CCOC3(CCCC3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000160240803 1424589974 /nfs/dbraw/zinc/58/99/74/1424589974.db2.gz RTUXDYFQMVDXNU-CYBMUJFWSA-N 0 0 377.397 3.341 20 5 GGBDRN O=C(NCc1ccccc1)c1nnc(CSc2ccc([N+](=O)[O-])cn2)s1 ZINC000160258450 1424590551 /nfs/dbraw/zinc/59/05/51/1424590551.db2.gz LGSACJAWJKFGHM-UHFFFAOYSA-N 0 0 387.446 3.064 20 5 GGBDRN 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CCC(=O)N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000161054587 1424655176 /nfs/dbraw/zinc/65/51/76/1424655176.db2.gz DUIGYWAZYHUDKP-CYBMUJFWSA-N 0 0 379.482 3.084 20 5 GGBDRN Cc1ccc(CNC(=O)c2cc(F)c([N+](=O)[O-])cc2F)c(O[C@H]2CCOC2)c1 ZINC000161056220 1424655187 /nfs/dbraw/zinc/65/51/87/1424655187.db2.gz SSAJODDDKCFDOG-ZDUSSCGKSA-N 0 0 392.358 3.279 20 5 GGBDRN CCCN(Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCS(=O)(=O)C1 ZINC000161075119 1424657055 /nfs/dbraw/zinc/65/70/55/1424657055.db2.gz HZQIBRJFXGTGQN-INIZCTEOSA-N 0 0 395.506 3.117 20 5 GGBDRN O=C(NCc1nnc(-c2ccccc2)s1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000161091504 1424657914 /nfs/dbraw/zinc/65/79/14/1424657914.db2.gz DKPRZEOHWXJRFW-UHFFFAOYSA-N 0 0 376.344 3.322 20 5 GGBDRN CC(C)COc1ccccc1CNS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000161088634 1424657957 /nfs/dbraw/zinc/65/79/57/1424657957.db2.gz OODOZWRMGUZYJG-UHFFFAOYSA-N 0 0 392.477 3.292 20 5 GGBDRN CCc1nc(-c2ccccc2NC(=O)CN(C)c2ccccc2[N+](=O)[O-])n[nH]1 ZINC000161131653 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C[C@@H](SCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C(=O)OC(C)(C)C ZINC000161336677 1424678413 /nfs/dbraw/zinc/67/84/13/1424678413.db2.gz ZWFSWTLTMAYXGK-LLVKDONJSA-N 0 0 382.438 3.356 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1ccccc1N1CCc2ccccc21 ZINC000161345305 1424679727 /nfs/dbraw/zinc/67/97/27/1424679727.db2.gz CFNHUMSVTJXPCF-UHFFFAOYSA-N 0 0 390.399 3.089 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCSc2ccc(C(F)(F)F)cc21 ZINC000161396698 1424683967 /nfs/dbraw/zinc/68/39/67/1424683967.db2.gz QEPUNUOMDGRHGA-UHFFFAOYSA-N 0 0 386.355 3.339 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000161415516 1424686081 /nfs/dbraw/zinc/68/60/81/1424686081.db2.gz UDODOUZJALXBTN-UHFFFAOYSA-N 0 0 399.447 3.332 20 5 GGBDRN CC(C)C(=O)NCCCNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000161451211 1424690659 /nfs/dbraw/zinc/69/06/59/1424690659.db2.gz OYXYKOFLVKXRQV-UHFFFAOYSA-N 0 0 378.307 3.096 20 5 GGBDRN COc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1N1CCCC1=O ZINC000161462057 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ZVKUFBRSSJWSII-MRXNPFEDSA-N 0 0 375.429 3.274 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])o1 ZINC000161592996 1424719900 /nfs/dbraw/zinc/71/99/00/1424719900.db2.gz LDHZYVGUUPMJGR-ZDUSSCGKSA-N 0 0 380.422 3.079 20 5 GGBDRN CC[C@@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1c(C)noc1C ZINC000161617860 1424725426 /nfs/dbraw/zinc/72/54/26/1424725426.db2.gz GJTPGNIYKKFEAD-MRXNPFEDSA-N 0 0 383.408 3.481 20 5 GGBDRN Cc1c(CC(=O)NCc2ccc(COC3CCOCC3)cc2)cccc1[N+](=O)[O-] ZINC000161664626 1424735619 /nfs/dbraw/zinc/73/56/19/1424735619.db2.gz HBFWMSWRLQYHLN-UHFFFAOYSA-N 0 0 398.459 3.458 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccccc1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000161666109 1424735627 /nfs/dbraw/zinc/73/56/27/1424735627.db2.gz SYGAWONIEGIKJE-MGPUTAFESA-N 0 0 383.448 3.437 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@H](O)c1ccc(F)cc1 ZINC000161665753 1424735701 /nfs/dbraw/zinc/73/57/01/1424735701.db2.gz PGGYRGLTBZGOEY-VFZGTOFNSA-N 0 0 397.200 3.348 20 5 GGBDRN Cc1cc(C(=O)Cn2cccc([N+](=O)[O-])c2=O)c(C)n1CCc1ccccc1 ZINC000161680247 1424739678 /nfs/dbraw/zinc/73/96/78/1424739678.db2.gz LJPHEPWHTMBIKI-UHFFFAOYSA-N 0 0 379.416 3.300 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)Cn2cccc([N+](=O)[O-])c2=O)c2cccs2)cc1 ZINC000161703505 1424744926 /nfs/dbraw/zinc/74/49/26/1424744926.db2.gz BJQXIOJGHUTSRB-GOSISDBHSA-N 0 0 383.429 3.032 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000161759377 1424758407 /nfs/dbraw/zinc/75/84/07/1424758407.db2.gz MFDGXAZKEQQPGS-KRWDZBQOSA-N 0 0 394.431 3.194 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000180132765 1429751272 /nfs/dbraw/zinc/75/12/72/1429751272.db2.gz DZJSMQBXHUZPEG-UHFFFAOYSA-N 0 0 394.387 3.220 20 5 GGBDRN CCCS(=O)(=O)c1ccccc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161819508 1424772439 /nfs/dbraw/zinc/77/24/39/1424772439.db2.gz KWHWUZIMYHHWNV-UHFFFAOYSA-N 0 0 388.445 3.372 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(c2ccc(F)cc2Cl)CC1 ZINC000161838451 1424776541 /nfs/dbraw/zinc/77/65/41/1424776541.db2.gz ALVHZBUALQHWJG-UHFFFAOYSA-N 0 0 392.818 3.074 20 5 GGBDRN O=C(CCCc1nc2ccccc2c(=O)[nH]1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161844629 1424777797 /nfs/dbraw/zinc/77/77/97/1424777797.db2.gz CYLCTRGJAGPWKG-UHFFFAOYSA-N 0 0 392.415 3.133 20 5 GGBDRN Cc1cc(C[C@H](C)Nc2ccc(C(N)=O)cc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000161858894 1424780696 /nfs/dbraw/zinc/78/06/96/1424780696.db2.gz WHJOZPZLIRFKAY-ZDUSSCGKSA-N 0 0 379.420 3.231 20 5 GGBDRN CCCN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H](C)C(=O)Nc1ccccc1 ZINC000161944456 1424801655 /nfs/dbraw/zinc/80/16/55/1424801655.db2.gz IIVLBWIANBRRQF-CYBMUJFWSA-N 0 0 395.419 3.351 20 5 GGBDRN O=C(c1cccc(CN2CCOCC2)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000161959271 1424802880 /nfs/dbraw/zinc/80/28/80/1424802880.db2.gz CUSCVOQBPDIXPO-UHFFFAOYSA-N 0 0 395.459 3.232 20 5 GGBDRN CCc1ccccc1NC(=O)CN(C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000161957486 1424802950 /nfs/dbraw/zinc/80/29/50/1424802950.db2.gz HTFHCQLUVUMFNJ-UHFFFAOYSA-N 0 0 387.436 3.245 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)CNc2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000161980982 1424805447 /nfs/dbraw/zinc/80/54/47/1424805447.db2.gz CMNAHUUGEVBJMG-LLVKDONJSA-N 0 0 395.362 3.435 20 5 GGBDRN CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161981350 1424805535 /nfs/dbraw/zinc/80/55/35/1424805535.db2.gz LOSUTWPIBGAZMY-KDOFPFPSSA-N 0 0 388.468 3.094 20 5 GGBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1(c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000824412847 1424805696 /nfs/dbraw/zinc/80/56/96/1424805696.db2.gz GWNKUKRSUTUFGU-AWEZNQCLSA-N 0 0 378.436 3.375 20 5 GGBDRN O=C([C@@H](c1cccc(F)c1)N1CCOCC1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161982661 1424805993 /nfs/dbraw/zinc/80/59/93/1424805993.db2.gz VNFWBKJASWBNSB-HXUWFJFHSA-N 0 0 399.422 3.087 20 5 GGBDRN COc1ccc(CNc2nnc(C)n2C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000162004105 1424807853 /nfs/dbraw/zinc/80/78/53/1424807853.db2.gz PXJLCQYQXQCJSP-UHFFFAOYSA-N 0 0 383.408 3.231 20 5 GGBDRN CCOC(=O)CC[C@@H]1CCCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000162006006 1424807937 /nfs/dbraw/zinc/80/79/37/1424807937.db2.gz GXVUTKHLINXINV-ZDUSSCGKSA-N 0 0 397.859 3.242 20 5 GGBDRN CNC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000162009466 1424808373 /nfs/dbraw/zinc/80/83/73/1424808373.db2.gz TTYCASAEIVHNGF-UHFFFAOYSA-N 0 0 379.482 3.132 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c1 ZINC000162019278 1424809176 /nfs/dbraw/zinc/80/91/76/1424809176.db2.gz QEFQCCCJTWHXMD-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN C[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000162038541 1424810821 /nfs/dbraw/zinc/81/08/21/1424810821.db2.gz BBBDUKQUSHKLII-CYBMUJFWSA-N 0 0 393.403 3.072 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000162046709 1424811911 /nfs/dbraw/zinc/81/19/11/1424811911.db2.gz NYLRNPUFPBYBTB-SFHVURJKSA-N 0 0 396.403 3.497 20 5 GGBDRN Cc1sc(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)nc1-c1ccc(C)cc1 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C[C@H]1c2ccccc2CCN1C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000171510415 1425709803 /nfs/dbraw/zinc/70/98/03/1425709803.db2.gz CKYWVJBVOFEPQD-DZGCQCFKSA-N 0 0 397.406 3.233 20 5 GGBDRN CC(C)[C@@H]1CCC[C@H](NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000171519269 1425712084 /nfs/dbraw/zinc/71/20/84/1425712084.db2.gz LOTPAKVKZKUJTN-OCCSQVGLSA-N 0 0 379.482 3.117 20 5 GGBDRN Cc1ccc(C(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000171521774 1425713576 /nfs/dbraw/zinc/71/35/76/1425713576.db2.gz AOUYYKWHXOPJHV-CQSZACIVSA-N 0 0 377.441 3.232 20 5 GGBDRN Cc1ccc(C(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000171521778 1425713807 /nfs/dbraw/zinc/71/38/07/1425713807.db2.gz AOUYYKWHXOPJHV-AWEZNQCLSA-N 0 0 377.441 3.232 20 5 GGBDRN COc1cccc(Cc2nnc(NC(=O)NCc3ccccc3[N+](=O)[O-])s2)c1 ZINC000171540877 1425724928 /nfs/dbraw/zinc/72/49/28/1425724928.db2.gz HUWHQURFNRECJD-UHFFFAOYSA-N 0 0 399.432 3.367 20 5 GGBDRN CN1C(=O)CCc2cc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)ccc21 ZINC000171554360 1425732079 /nfs/dbraw/zinc/73/20/79/1425732079.db2.gz RFLIJWVAQOCDLM-UHFFFAOYSA-N 0 0 380.404 3.330 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCCc3cccc(Cl)c32)cc1[N+](=O)[O-] ZINC000171557956 1425734684 /nfs/dbraw/zinc/73/46/84/1425734684.db2.gz KLAWYGJNDVGWDO-UHFFFAOYSA-N 0 0 394.836 3.245 20 5 GGBDRN CCCN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000171562126 1425736554 /nfs/dbraw/zinc/73/65/54/1425736554.db2.gz KQUNWCHCSGSEQH-MRXNPFEDSA-N 0 0 391.468 3.385 20 5 GGBDRN CNC(=O)COc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000171566387 1425738545 /nfs/dbraw/zinc/73/85/45/1425738545.db2.gz PKGMTMRDMZWQRP-UHFFFAOYSA-N 0 0 385.401 3.187 20 5 GGBDRN CCCc1noc2nc(C3CC3)cc(C(=O)OCCn3c(C)ncc3[N+](=O)[O-])c12 ZINC000171568335 1425739578 /nfs/dbraw/zinc/73/95/78/1425739578.db2.gz GVBINSXVLUKTMY-UHFFFAOYSA-N 0 0 399.407 3.323 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000171586756 1425746923 /nfs/dbraw/zinc/74/69/23/1425746923.db2.gz GFHOCMHKMFVMTO-CQSZACIVSA-N 0 0 387.411 3.262 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)c1 ZINC000171587468 1425748206 /nfs/dbraw/zinc/74/82/06/1425748206.db2.gz VLWMOGHPJVTTEU-CYBMUJFWSA-N 0 0 375.450 3.184 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)c1 ZINC000171588683 1425750117 /nfs/dbraw/zinc/75/01/17/1425750117.db2.gz HPHCLKXSNRFFGH-MRXNPFEDSA-N 0 0 383.448 3.431 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000171590187 1425750667 /nfs/dbraw/zinc/75/06/67/1425750667.db2.gz OGDWVSLEUZCXJS-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000171590469 1425751192 /nfs/dbraw/zinc/75/11/92/1425751192.db2.gz PGFMWYSKXMNQSC-MRXNPFEDSA-N 0 0 383.448 3.431 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000171626627 1425763261 /nfs/dbraw/zinc/76/32/61/1425763261.db2.gz MLQNYFLWFKQLJK-LBPRGKRZSA-N 0 0 383.832 3.378 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000171628772 1425764368 /nfs/dbraw/zinc/76/43/68/1425764368.db2.gz AROOZVCHPDKJOU-YCABEKBOSA-N 0 0 375.425 3.124 20 5 GGBDRN Cc1c(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)oc2c1C(=O)CCC2 ZINC000171634936 1425767524 /nfs/dbraw/zinc/76/75/24/1425767524.db2.gz JXLLYIBVFNLLEX-UHFFFAOYSA-N 0 0 380.360 3.453 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1nnc(Cc2ccc(F)cc2)s1 ZINC000171643652 1425770252 /nfs/dbraw/zinc/77/02/52/1425770252.db2.gz QPIQNVNDWRXMJG-UHFFFAOYSA-N 0 0 387.396 3.498 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC(c2ccccc2C)CC1 ZINC000171647931 1425772215 /nfs/dbraw/zinc/77/22/15/1425772215.db2.gz QWOKSOGQJRKEGQ-UHFFFAOYSA-N 0 0 397.431 3.257 20 5 GGBDRN O=C(Cc1coc(-c2cccs2)n1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000171651235 1425773837 /nfs/dbraw/zinc/77/38/37/1425773837.db2.gz TYYJMUUNXQQVLA-UHFFFAOYSA-N 0 0 398.444 3.203 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000171655048 1425776910 /nfs/dbraw/zinc/77/69/10/1425776910.db2.gz CLEAZTNBTLUMHF-HNNXBMFYSA-N 0 0 383.326 3.146 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)c1[N+](=O)[O-] ZINC000171666099 1425781274 /nfs/dbraw/zinc/78/12/74/1425781274.db2.gz ZVSSOQBJGKRDOC-UHFFFAOYSA-N 0 0 391.815 3.022 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000171669734 1425783462 /nfs/dbraw/zinc/78/34/62/1425783462.db2.gz FUMQXVRDYSIAET-LBPRGKRZSA-N 0 0 383.832 3.378 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H](c2nccs2)c2ccccc2)cc1 ZINC000171713432 1425800660 /nfs/dbraw/zinc/80/06/60/1425800660.db2.gz HFGUUYVYSCYYSF-INIZCTEOSA-N 0 0 389.458 3.260 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC1(c2ccc(F)cc2)CCOCC1 ZINC000171716684 1425801732 /nfs/dbraw/zinc/80/17/32/1425801732.db2.gz WCCGVPZQKOMWJV-UHFFFAOYSA-N 0 0 388.395 3.325 20 5 GGBDRN Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000171717991 1425802186 /nfs/dbraw/zinc/80/21/86/1425802186.db2.gz QXONDTAMUQBRNI-UHFFFAOYSA-N 0 0 382.424 3.222 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000171720202 1425802727 /nfs/dbraw/zinc/80/27/27/1425802727.db2.gz JGBUJAWIKNTHIT-OAQYLSRUSA-N 0 0 392.415 3.022 20 5 GGBDRN Cc1cc(C)cc([C@H](C)NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c1 ZINC000171719529 1425802945 /nfs/dbraw/zinc/80/29/45/1425802945.db2.gz FQBBBLFKOLDFRD-ZDUSSCGKSA-N 0 0 376.434 3.106 20 5 GGBDRN CC(C)n1ncc2ccc(NC(=O)c3cn(-c4cccc([N+](=O)[O-])c4)nn3)cc21 ZINC000171745301 1425809716 /nfs/dbraw/zinc/80/97/16/1425809716.db2.gz VMIJXJWUOLGGJX-UHFFFAOYSA-N 0 0 391.391 3.358 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCn1c(=O)oc2ccccc21 ZINC000171744135 1425809797 /nfs/dbraw/zinc/80/97/97/1425809797.db2.gz SQYRLLMIJXKLQO-UHFFFAOYSA-N 0 0 398.419 3.123 20 5 GGBDRN CCCN(C(=O)c1ccccc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000171748859 1425810188 /nfs/dbraw/zinc/81/01/88/1425810188.db2.gz HXLASVXFTCJKPC-AWEZNQCLSA-N 0 0 377.441 3.456 20 5 GGBDRN COc1ccc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)cc1[N+](=O)[O-] ZINC000171752851 1425811947 /nfs/dbraw/zinc/81/19/47/1425811947.db2.gz KQJAXMVIYFXRNB-XYOKQWHBSA-N 0 0 394.343 3.166 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H](c1ccccc1)N1CCCCC1=O ZINC000171763625 1425814305 /nfs/dbraw/zinc/81/43/05/1425814305.db2.gz DAUDKCUGQIKCPH-FQEVSTJZSA-N 0 0 381.432 3.307 20 5 GGBDRN COc1cc(CNCc2cc(C)no2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000171765771 1425814484 /nfs/dbraw/zinc/81/44/84/1425814484.db2.gz VPLLZRDFEVYWME-UHFFFAOYSA-N 0 0 375.303 3.131 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](O)c1ccc2ccccc2c1 ZINC000171768025 1425815240 /nfs/dbraw/zinc/81/52/40/1425815240.db2.gz QIOKPEPXVZNZRV-IBGZPJMESA-N 0 0 395.415 3.289 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](c1ccccc1)c1cccnc1 ZINC000171768995 1425815606 /nfs/dbraw/zinc/81/56/06/1425815606.db2.gz LINSKPRVVOFOMT-LJQANCHMSA-N 0 0 383.429 3.366 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](c1ccccc1)c1cccnc1 ZINC000171768650 1425815668 /nfs/dbraw/zinc/81/56/68/1425815668.db2.gz JUGUEOYDFPARIV-IBGZPJMESA-N 0 0 383.429 3.366 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-] ZINC000171769316 1425815910 /nfs/dbraw/zinc/81/59/10/1425815910.db2.gz BKXLCNBBLINAEV-LJQANCHMSA-N 0 0 383.429 3.366 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H](c2ccccc2)c2cccnc2)c([N+](=O)[O-])c1 ZINC000171769336 1425816079 /nfs/dbraw/zinc/81/60/79/1425816079.db2.gz YJPBYIRDHJBUSR-IBGZPJMESA-N 0 0 399.428 3.066 20 5 GGBDRN O=C(Nc1nc2c(s1)CCCCC2)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171771750 1425816285 /nfs/dbraw/zinc/81/62/85/1425816285.db2.gz NXDBYELJRNZYAU-UHFFFAOYSA-N 0 0 384.417 3.414 20 5 GGBDRN CCN1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc21 ZINC000171778222 1425818229 /nfs/dbraw/zinc/81/82/29/1425818229.db2.gz LPDJEMRDIVFPJS-UHFFFAOYSA-N 0 0 381.841 3.283 20 5 GGBDRN CCN1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc21 ZINC000171778125 1425818314 /nfs/dbraw/zinc/81/83/14/1425818314.db2.gz TVGWDKAFTVGIML-UHFFFAOYSA-N 0 0 381.841 3.283 20 5 GGBDRN O=C(OCc1cnc2ccccc2c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000171784560 1425819810 /nfs/dbraw/zinc/81/98/10/1425819810.db2.gz AQAXWVALHWVLPS-UHFFFAOYSA-N 0 0 375.344 3.081 20 5 GGBDRN CCc1n[nH]c(C(=O)NCC2(c3ccc(Cl)cc3)CCOCC2)c1[N+](=O)[O-] ZINC000171804323 1425824956 /nfs/dbraw/zinc/82/49/56/1425824956.db2.gz MMOVCTSBYBQCGH-UHFFFAOYSA-N 0 0 392.843 3.012 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CC=C(c3c[nH]c4ccc(OC)cc43)CC2)c1[N+](=O)[O-] ZINC000171803971 1425824983 /nfs/dbraw/zinc/82/49/83/1425824983.db2.gz OEIGOQFZDYKKLG-UHFFFAOYSA-N 0 0 395.419 3.300 20 5 GGBDRN CCc1n[nH]c(C(=O)NCc2cccc(NC(=O)C3CCCCC3)c2)c1[N+](=O)[O-] ZINC000171805558 1425825452 /nfs/dbraw/zinc/82/54/52/1425825452.db2.gz ZHVFVUXXEXGUNN-UHFFFAOYSA-N 0 0 399.451 3.329 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000171815134 1425827568 /nfs/dbraw/zinc/82/75/68/1425827568.db2.gz FLLUBRZQMWPSFI-VUVZNRFTSA-N 0 0 382.416 3.241 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(F)c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000171840946 1425832884 /nfs/dbraw/zinc/83/28/84/1425832884.db2.gz MBWLXNSBXPQPMU-UHFFFAOYSA-N 0 0 394.424 3.188 20 5 GGBDRN C[C@H](Cc1cccs1)NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171842126 1425833323 /nfs/dbraw/zinc/83/33/23/1425833323.db2.gz IGHMGJTVJWGGAB-YPMHNXCESA-N 0 0 393.490 3.070 20 5 GGBDRN O=C(CC1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1)N1CCCC1 ZINC000171847666 1425834226 /nfs/dbraw/zinc/83/42/26/1425834226.db2.gz YSYOBDXKXATSJI-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(F)c(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000171851025 1425834938 /nfs/dbraw/zinc/83/49/38/1425834938.db2.gz PGPUWTIAVGUBLH-LBPRGKRZSA-N 0 0 394.424 3.407 20 5 GGBDRN C[C@@H](O)c1ccc(CNc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])cc1 ZINC000171861244 1425837252 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Cc1sc2nc(CCC(=O)N3CCc4c3cccc4[N+](=O)[O-])[nH]c(=O)c2c1C ZINC000172360502 1426013643 /nfs/dbraw/zinc/01/36/43/1426013643.db2.gz JMBBXKUZXWATDA-UHFFFAOYSA-N 0 0 398.444 3.032 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C ZINC000172376456 1426018780 /nfs/dbraw/zinc/01/87/80/1426018780.db2.gz WZONVCWJLPHSPX-LSDHHAIUSA-N 0 0 377.441 3.247 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000172384290 1426021959 /nfs/dbraw/zinc/02/19/59/1426021959.db2.gz WTZDVDXKBGKSCR-RCBQFDQVSA-N 0 0 377.441 3.465 20 5 GGBDRN O=C(c1cc(-c2cccs2)on1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172397701 1426026004 /nfs/dbraw/zinc/02/60/04/1426026004.db2.gz BFLQBWBJDFVWGU-LLVKDONJSA-N 0 0 385.405 3.033 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000172402646 1426026928 /nfs/dbraw/zinc/02/69/28/1426026928.db2.gz ZHZMTUGGZNTOLM-SNVBAGLBSA-N 0 0 385.367 3.002 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000172402652 1426027035 /nfs/dbraw/zinc/02/70/35/1426027035.db2.gz ZHZMTUGGZNTOLM-JTQLQIEISA-N 0 0 385.367 3.002 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)[C@H]1Cc2ccccc2O1 ZINC000172410893 1426029769 /nfs/dbraw/zinc/02/97/69/1426029769.db2.gz AKKFDYCTLYFOAZ-OAHLLOKOSA-N 0 0 378.178 3.404 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172409652 1426029816 /nfs/dbraw/zinc/02/98/16/1426029816.db2.gz NNTWWJCBNDSCEY-OCCSQVGLSA-N 0 0 375.425 3.177 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)cc1 ZINC000172412909 1426030270 /nfs/dbraw/zinc/03/02/70/1426030270.db2.gz UUHHLPKPMPDOGL-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)c1ccc2nccn2c1 ZINC000172411077 1426030304 /nfs/dbraw/zinc/03/03/04/1426030304.db2.gz KZBPGJANLYGYRW-UHFFFAOYSA-N 0 0 376.166 3.362 20 5 GGBDRN Cc1nc(Cc2ccccc2)sc1[C@@H](C)OC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000172413680 1426031108 /nfs/dbraw/zinc/03/11/08/1426031108.db2.gz UGJOCAANVPSFFG-CYBMUJFWSA-N 0 0 386.433 3.451 20 5 GGBDRN C=CC(=O)NCc1ccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000172414582 1426032134 /nfs/dbraw/zinc/03/21/34/1426032134.db2.gz BNIGHMANJPEPFS-UHFFFAOYSA-N 0 0 381.432 3.150 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172414846 1426032619 /nfs/dbraw/zinc/03/26/19/1426032619.db2.gz LBFIUEDTVGWMBW-SJLPKXTDSA-N 0 0 389.496 3.318 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN1C(=O)c1ccccc1 ZINC000172416028 1426033208 /nfs/dbraw/zinc/03/32/08/1426033208.db2.gz WNYXVEYHHOEMMG-HXUWFJFHSA-N 0 0 395.459 3.339 20 5 GGBDRN O=C(NCC1CCOCC1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000172418910 1426035497 /nfs/dbraw/zinc/03/54/97/1426035497.db2.gz BHOCEBBBXSAHMU-UHFFFAOYSA-N 0 0 399.234 3.244 20 5 GGBDRN CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000172421897 1426036613 /nfs/dbraw/zinc/03/66/13/1426036613.db2.gz PZNWLQGOQNESDS-KRWDZBQOSA-N 0 0 390.823 3.495 20 5 GGBDRN CC(=O)CCc1ccc(OCCC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000172421495 1426036820 /nfs/dbraw/zinc/03/68/20/1426036820.db2.gz HGZFVGMJDXQIKI-UHFFFAOYSA-N 0 0 382.416 3.475 20 5 GGBDRN CC(C)[C@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])S(=O)(=O)C1CCCCC1 ZINC000172422324 1426037034 /nfs/dbraw/zinc/03/70/34/1426037034.db2.gz HIGRLAMUOISELA-GOSISDBHSA-N 0 0 394.493 3.256 20 5 GGBDRN O=C(c1ccc(F)cc1)N1CCC[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000172422839 1426037270 /nfs/dbraw/zinc/03/72/70/1426037270.db2.gz KMZITYTZWVQCPH-OAHLLOKOSA-N 0 0 397.406 3.175 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])cc2)no1 ZINC000172423785 1426037601 /nfs/dbraw/zinc/03/76/01/1426037601.db2.gz JHCJRLRXXWXQCS-UHFFFAOYSA-N 0 0 394.387 3.322 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1)C1CC1 ZINC000172424633 1426038319 /nfs/dbraw/zinc/03/83/19/1426038319.db2.gz UCLLMAQYPRKXSY-UHFFFAOYSA-N 0 0 382.420 3.427 20 5 GGBDRN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172425749 1426039171 /nfs/dbraw/zinc/03/91/71/1426039171.db2.gz WKOGBQORRKHHJF-HXUWFJFHSA-N 0 0 377.400 3.448 20 5 GGBDRN COc1ccc(Cn2cc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])cn2)cc1 ZINC000172425267 1426039186 /nfs/dbraw/zinc/03/91/86/1426039186.db2.gz BOPMSJBQJNAACJ-UHFFFAOYSA-N 0 0 378.388 3.051 20 5 GGBDRN Cc1c(NC(=O)c2csc([N+](=O)[O-])c2)cccc1S(=O)(=O)NC(C)(C)C ZINC000172427099 1426040322 /nfs/dbraw/zinc/04/03/22/1426040322.db2.gz FHDOZXPUKQWWBR-UHFFFAOYSA-N 0 0 397.478 3.294 20 5 GGBDRN CS(=O)(=O)c1ccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000172429005 1426041498 /nfs/dbraw/zinc/04/14/98/1426041498.db2.gz VZQXFGQWHVAUEH-UHFFFAOYSA-N 0 0 391.449 3.143 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000172432089 1426042479 /nfs/dbraw/zinc/04/24/79/1426042479.db2.gz JJJWFJOGKMFWDY-HNNXBMFYSA-N 0 0 384.219 3.434 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000172457937 1426047409 /nfs/dbraw/zinc/04/74/09/1426047409.db2.gz LYPOSHCPKCKBPI-CQSZACIVSA-N 0 0 398.387 3.158 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000172457934 1426047521 /nfs/dbraw/zinc/04/75/21/1426047521.db2.gz LYPOSHCPKCKBPI-AWEZNQCLSA-N 0 0 398.387 3.158 20 5 GGBDRN Cn1c(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)nc2ccccc21 ZINC000172469319 1426052205 /nfs/dbraw/zinc/05/22/05/1426052205.db2.gz HILCWQPXFKBGJV-UHFFFAOYSA-N 0 0 381.436 3.304 20 5 GGBDRN C[C@H]1CC(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C[C@H](C)C1 ZINC000172473505 1426053788 /nfs/dbraw/zinc/05/37/88/1426053788.db2.gz YHFIHGLJJPGGDB-VXGBXAGGSA-N 0 0 389.481 3.429 20 5 GGBDRN CCOc1cc(CCCNC(=O)NCc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000172489512 1426057563 /nfs/dbraw/zinc/05/75/63/1426057563.db2.gz DKYKBLFNVWXECJ-UHFFFAOYSA-N 0 0 387.436 3.434 20 5 GGBDRN C[C@@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(NC(N)=O)cc1 ZINC000172496878 1426059628 /nfs/dbraw/zinc/05/96/28/1426059628.db2.gz DXYFDUJNLVMKHA-CQSZACIVSA-N 0 0 399.451 3.469 20 5 GGBDRN Cc1ccoc1C(=O)NCCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000172500876 1426060892 /nfs/dbraw/zinc/06/08/92/1426060892.db2.gz LDUGQEARIMZGCR-UHFFFAOYSA-N 0 0 387.417 3.261 20 5 GGBDRN Cc1ncsc1CN(C)C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000172516038 1426067155 /nfs/dbraw/zinc/06/71/55/1426067155.db2.gz HUNDBGXXJFXDSM-UHFFFAOYSA-N 0 0 377.470 3.312 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2ncsc2c1 ZINC000172522611 1426070112 /nfs/dbraw/zinc/07/01/12/1426070112.db2.gz UJYXMZVWQHFNHI-UHFFFAOYSA-N 0 0 398.444 3.282 20 5 GGBDRN Cc1nc(C(F)(F)F)ccc1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000172534665 1426075683 /nfs/dbraw/zinc/07/56/83/1426075683.db2.gz URWYRDLWQWUQBZ-NSHDSACASA-N 0 0 395.341 3.039 20 5 GGBDRN C[C@H]1CC(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)C1 ZINC000172539249 1426078575 /nfs/dbraw/zinc/07/85/75/1426078575.db2.gz UHBGBTGLVZAVNE-NXEZZACHSA-N 0 0 385.367 3.076 20 5 GGBDRN CNC(=O)c1cccc(CCNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000172557006 1426086089 /nfs/dbraw/zinc/08/60/89/1426086089.db2.gz LZDRMEKJDCZBNA-UHFFFAOYSA-N 0 0 383.429 3.142 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2cccc(C(F)F)c2)CC1 ZINC000172559333 1426087506 /nfs/dbraw/zinc/08/75/06/1426087506.db2.gz SJHLXHUCUNZKHV-UHFFFAOYSA-N 0 0 389.358 3.131 20 5 GGBDRN COc1ccccc1-c1nn(C)cc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000172568216 1426091928 /nfs/dbraw/zinc/09/19/28/1426091928.db2.gz RMXLBOWWJUTZJI-UHFFFAOYSA-N 0 0 380.404 3.276 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnc(C(=O)N(C)C)c1 ZINC000172578746 1426095373 /nfs/dbraw/zinc/09/53/73/1426095373.db2.gz FDFFETSTDDOQSL-UHFFFAOYSA-N 0 0 385.424 3.134 20 5 GGBDRN COc1ccccc1-c1nn(C)cc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000172585219 1426099082 /nfs/dbraw/zinc/09/90/82/1426099082.db2.gz WCMYHJZIPPLBCW-UHFFFAOYSA-N 0 0 378.388 3.207 20 5 GGBDRN C[C@@H](N[C@@H](C)c1nnc2ccccn21)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172614137 1426114064 /nfs/dbraw/zinc/11/40/64/1426114064.db2.gz KKDYNWZJUMZDLY-NWDGAFQWSA-N 0 0 379.380 3.099 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CC[C@H](Cc2ccccc2)C1 ZINC000172631909 1426119864 /nfs/dbraw/zinc/11/98/64/1426119864.db2.gz BDOGYCXVCCPCMN-QGZVFWFLSA-N 0 0 376.416 3.485 20 5 GGBDRN O=C(c1cc(NC[C@H](CCO)c2ccccc2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000172642086 1426123524 /nfs/dbraw/zinc/12/35/24/1426123524.db2.gz MILMDEVHHVQAMQ-KRWDZBQOSA-N 0 0 383.448 3.409 20 5 GGBDRN C[C@H]1CCCN(C(=O)c2ccc(I)c([N+](=O)[O-])c2)[C@H]1C ZINC000172646759 1426124836 /nfs/dbraw/zinc/12/48/36/1426124836.db2.gz KDQKXLBJKOHOPK-UWVGGRQHSA-N 0 0 388.205 3.460 20 5 GGBDRN C[C@@H]1[C@@H](C)CCCN1C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000172654025 1426128489 /nfs/dbraw/zinc/12/84/89/1426128489.db2.gz FDVPEJBJTRAWAJ-NWDGAFQWSA-N 0 0 375.454 3.135 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cccc(OC(F)F)c2)CC1 ZINC000172664775 1426133922 /nfs/dbraw/zinc/13/39/22/1426133922.db2.gz RNANRZHOXBAVSP-UHFFFAOYSA-N 0 0 391.374 3.154 20 5 GGBDRN CS(=O)(=O)C1CCC(NC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000172676735 1426139066 /nfs/dbraw/zinc/13/90/66/1426139066.db2.gz KZRFSNUSVCHDOT-UHFFFAOYSA-N 0 0 382.485 3.474 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](c1cccc(F)c1)N1CCOCC1 ZINC000172688309 1426143528 /nfs/dbraw/zinc/14/35/28/1426143528.db2.gz YXPJIDGUHTXMIG-KRWDZBQOSA-N 0 0 393.802 3.399 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1c(Cl)cccc1Cl ZINC000172694373 1426146664 /nfs/dbraw/zinc/14/66/64/1426146664.db2.gz RYEQNZSARXXUGW-CQSZACIVSA-N 0 0 384.219 3.434 20 5 GGBDRN Cc1cc(C)c(OC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000172694226 1426146696 /nfs/dbraw/zinc/14/66/96/1426146696.db2.gz JKYHACWLZGUCIN-INIZCTEOSA-N 0 0 383.404 3.064 20 5 GGBDRN COc1cc(C(=O)N(C)C2CCC2)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000172695214 1426147864 /nfs/dbraw/zinc/14/78/64/1426147864.db2.gz UAKILDPLPLSCDJ-UHFFFAOYSA-N 0 0 377.422 3.263 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1ccn(-c3cccc([N+](=O)[O-])c3)n1)C[C@H](C)O2 ZINC000172719961 1426159144 /nfs/dbraw/zinc/15/91/44/1426159144.db2.gz DHROHDRRAJLUNJ-ZDUSSCGKSA-N 0 0 394.387 3.217 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(Cl)c1N1CCOCC1 ZINC000172719905 1426159169 /nfs/dbraw/zinc/15/91/69/1426159169.db2.gz XUYUSHYVKBLVQZ-UHFFFAOYSA-N 0 0 375.812 3.266 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1ccn(-c3cccc([N+](=O)[O-])c3)n1)C[C@@H](C)O2 ZINC000172719957 1426159230 /nfs/dbraw/zinc/15/92/30/1426159230.db2.gz DHROHDRRAJLUNJ-CYBMUJFWSA-N 0 0 394.387 3.217 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1cnn(-c3ccc([N+](=O)[O-])cc3)c1)C[C@@H](C)O2 ZINC000172720612 1426159356 /nfs/dbraw/zinc/15/93/56/1426159356.db2.gz UYNSWGDLGIEBLW-CYBMUJFWSA-N 0 0 394.387 3.217 20 5 GGBDRN Cc1ccc(N2CCC[C@H](NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])C2=O)cc1 ZINC000172736258 1426167495 /nfs/dbraw/zinc/16/74/95/1426167495.db2.gz XIDWURXSBINMGC-INIZCTEOSA-N 0 0 387.823 3.482 20 5 GGBDRN Cc1cc(C)cc(C[C@@H](C)NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000172756212 1426174275 /nfs/dbraw/zinc/17/42/75/1426174275.db2.gz VJCQPSNGXXTSOG-OAHLLOKOSA-N 0 0 379.420 3.153 20 5 GGBDRN CC(C)(CO)CCCNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000172763623 1426177030 /nfs/dbraw/zinc/17/70/30/1426177030.db2.gz KBCZUUJCETZERU-UHFFFAOYSA-N 0 0 384.376 3.099 20 5 GGBDRN COCCCOC1CCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000172764990 1426177463 /nfs/dbraw/zinc/17/74/63/1426177463.db2.gz IKYLEODOXWDJAN-UHFFFAOYSA-N 0 0 386.452 3.382 20 5 GGBDRN Cc1cc(NC2CCC(S(C)(=O)=O)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000172768042 1426179408 /nfs/dbraw/zinc/17/94/08/1426179408.db2.gz CGAUPINCLIMWAE-UHFFFAOYSA-N 0 0 390.465 3.128 20 5 GGBDRN COCCOCc1cc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1F ZINC000172769638 1426180083 /nfs/dbraw/zinc/18/00/83/1426180083.db2.gz UBURAJWIDAMVFX-UHFFFAOYSA-N 0 0 376.384 3.169 20 5 GGBDRN O=C1COc2ccccc2N1CCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000172771265 1426181024 /nfs/dbraw/zinc/18/10/24/1426181024.db2.gz RKIOUIAGAJRQTL-UHFFFAOYSA-N 0 0 378.388 3.371 20 5 GGBDRN COc1ccc(OC)c(CN(CCO)c2ccc([N+](=O)[O-])c3cnccc32)c1 ZINC000172774990 1426182504 /nfs/dbraw/zinc/18/25/04/1426182504.db2.gz QMRLXDKONUAUEK-UHFFFAOYSA-N 0 0 383.404 3.159 20 5 GGBDRN COc1ccc(CN(CCO)c2ccc([N+](=O)[O-])c3cnccc32)c(OC)c1 ZINC000172775096 1426182729 /nfs/dbraw/zinc/18/27/29/1426182729.db2.gz CDRIIPMSZFPVJA-UHFFFAOYSA-N 0 0 383.404 3.159 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000172778360 1426183782 /nfs/dbraw/zinc/18/37/82/1426183782.db2.gz RWJZYTNPEYGNIB-ZDUSSCGKSA-N 0 0 385.420 3.375 20 5 GGBDRN COCCOC[C@@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000172783307 1426186192 /nfs/dbraw/zinc/18/61/92/1426186192.db2.gz YFEIKQQWJVJYAT-MRXNPFEDSA-N 0 0 384.432 3.315 20 5 GGBDRN CCCNC(=O)c1ccc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC000172786716 1426188133 /nfs/dbraw/zinc/18/81/33/1426188133.db2.gz HDLQLVGSRGMTHP-UHFFFAOYSA-N 0 0 384.436 3.177 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)c1 ZINC000172788489 1426188952 /nfs/dbraw/zinc/18/89/52/1426188952.db2.gz OTYGJUKJOHPHHL-LRDDRELGSA-N 0 0 385.445 3.241 20 5 GGBDRN COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172796013 1426192583 /nfs/dbraw/zinc/19/25/83/1426192583.db2.gz LBKRGBVTZPWLJU-IBGZPJMESA-N 0 0 384.432 3.354 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000172800705 1426195619 /nfs/dbraw/zinc/19/56/19/1426195619.db2.gz HTCIGWFQXWXZGI-UHFFFAOYSA-N 0 0 382.342 3.396 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000172806282 1426197848 /nfs/dbraw/zinc/19/78/48/1426197848.db2.gz HCLWXFGYDNIEHV-INIZCTEOSA-N 0 0 399.403 3.490 20 5 GGBDRN C[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000172808317 1426198683 /nfs/dbraw/zinc/19/86/83/1426198683.db2.gz BDRYISNAQZEGHG-CYBMUJFWSA-N 0 0 382.420 3.299 20 5 GGBDRN CCC[C@H](CCO)CNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000172808892 1426199179 /nfs/dbraw/zinc/19/91/79/1426199179.db2.gz ZFUZMZBILMMNPG-GFCCVEGCSA-N 0 0 380.832 3.005 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2ccc(N3CCSCC3)cc2)ccc1[N+](=O)[O-] ZINC000172811942 1426199745 /nfs/dbraw/zinc/19/97/45/1426199745.db2.gz FVMCTHZNYBHSPL-UHFFFAOYSA-N 0 0 393.490 3.257 20 5 GGBDRN COc1cccc(O[C@H](C)CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000172822180 1426204425 /nfs/dbraw/zinc/20/44/25/1426204425.db2.gz BYUXDLWOLGYTRX-OAHLLOKOSA-N 0 0 399.447 3.401 20 5 GGBDRN CCC(CC)c1cc(C(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])on1 ZINC000172829153 1426207617 /nfs/dbraw/zinc/20/76/17/1426207617.db2.gz CUPNFFUVLGDDJB-UHFFFAOYSA-N 0 0 391.424 3.476 20 5 GGBDRN CCOc1cc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000172830170 1426208490 /nfs/dbraw/zinc/20/84/90/1426208490.db2.gz VEDIGLIXOWZYFW-UHFFFAOYSA-N 0 0 380.347 3.454 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000172848241 1426217950 /nfs/dbraw/zinc/21/79/50/1426217950.db2.gz RZYDLQLEYBIJOB-UHFFFAOYSA-N 0 0 381.429 3.377 20 5 GGBDRN Cc1ccc([C@H](CNC(=O)c2cc(C)ccc2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000172847245 1426218089 /nfs/dbraw/zinc/21/80/89/1426218089.db2.gz ITYVOBKGABJLIH-FQEVSTJZSA-N 0 0 383.448 3.015 20 5 GGBDRN O=C(CNc1ccc(Cl)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000172850811 1426219825 /nfs/dbraw/zinc/21/98/25/1426219825.db2.gz NKHFHXSJHKJOTR-QGZVFWFLSA-N 0 0 393.802 3.399 20 5 GGBDRN O=[N+]([O-])c1cc(NCc2ccc(S(=O)(=O)N3CCCC3)o2)ccc1Cl ZINC000172850892 1426219957 /nfs/dbraw/zinc/21/99/57/1426219957.db2.gz AUJHKOYFPIIGMN-UHFFFAOYSA-N 0 0 385.829 3.238 20 5 GGBDRN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000172862533 1426226924 /nfs/dbraw/zinc/22/69/24/1426226924.db2.gz UQQCRACEZRUTAT-UHFFFAOYSA-N 0 0 381.432 3.412 20 5 GGBDRN CCCCN1C(=O)C2(CCCCC2)N[C@H]1c1cc(OC)c(O)cc1[N+](=O)[O-] ZINC000172862173 1426227009 /nfs/dbraw/zinc/22/70/09/1426227009.db2.gz NNOAKLDPEQPYAL-QGZVFWFLSA-N 0 0 377.441 3.242 20 5 GGBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)Oc1ccccc1Cl ZINC000172865104 1426228193 /nfs/dbraw/zinc/22/81/93/1426228193.db2.gz RBLCQYCWDOGYRT-JTQLQIEISA-N 0 0 379.756 3.354 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000172865841 1426228848 /nfs/dbraw/zinc/22/88/48/1426228848.db2.gz DDMFSZSGASQCDQ-CYBMUJFWSA-N 0 0 388.855 3.349 20 5 GGBDRN Cc1nn(CCC(=O)NC[C@@H](C)Oc2ccccc2Cl)c(C)c1[N+](=O)[O-] ZINC000172868312 1426230333 /nfs/dbraw/zinc/23/03/33/1426230333.db2.gz UVOSKJYHVJPHCJ-LLVKDONJSA-N 0 0 380.832 3.035 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1cccc(OCC(=O)N(C)C)c1 ZINC000172881350 1426237086 /nfs/dbraw/zinc/23/70/86/1426237086.db2.gz FSKNETGHLYLBSU-UHFFFAOYSA-N 0 0 387.436 3.461 20 5 GGBDRN C[C@@]1(C(=O)NCc2cccc([N+](=O)[O-])c2)CCCN(C(=O)c2ccccc2)C1 ZINC000172896550 1426244515 /nfs/dbraw/zinc/24/45/15/1426244515.db2.gz XUEMAKCGRXMHCY-OAQYLSRUSA-N 0 0 381.432 3.154 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccc(F)cc2O1 ZINC000172897892 1426245347 /nfs/dbraw/zinc/24/53/47/1426245347.db2.gz GIARVXUCGKKAIO-SECBINFHSA-N 0 0 386.788 3.364 20 5 GGBDRN Cc1nnnn1-c1cc(NCc2cc([N+](=O)[O-])ccc2OC(C)C)ccc1F ZINC000172900180 1426246603 /nfs/dbraw/zinc/24/66/03/1426246603.db2.gz APZVZTBVVZUGDM-UHFFFAOYSA-N 0 0 386.387 3.417 20 5 GGBDRN COc1ccc(C(=O)N2CCCC2)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172903117 1426249673 /nfs/dbraw/zinc/24/96/73/1426249673.db2.gz ISSCRFCRORCZKH-UHFFFAOYSA-N 0 0 383.404 3.021 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000172903943 1426250437 /nfs/dbraw/zinc/25/04/37/1426250437.db2.gz MOOKCBONPVTNBL-CYBMUJFWSA-N 0 0 384.461 3.388 20 5 GGBDRN O=C1[C@H](Oc2cccnc2[N+](=O)[O-])CCCN1c1ccc(OC(F)F)cc1 ZINC000172905371 1426251382 /nfs/dbraw/zinc/25/13/82/1426251382.db2.gz BWMNEWOCDMILJX-CQSZACIVSA-N 0 0 379.319 3.166 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)NCc2cccnc2)c1 ZINC000172912791 1426257039 /nfs/dbraw/zinc/25/70/39/1426257039.db2.gz BYWLNTAOWGIQFP-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN CCOc1ccc(S(=O)(=O)N(C)C)cc1NCc1cccc([N+](=O)[O-])c1C ZINC000172914921 1426259464 /nfs/dbraw/zinc/25/94/64/1426259464.db2.gz LYSZKKBERRXMCB-UHFFFAOYSA-N 0 0 393.465 3.164 20 5 GGBDRN Cc1ccc(NCc2cccc([N+](=O)[O-])c2)c(C)c1S(=O)(=O)NC1CC1 ZINC000172915753 1426259974 /nfs/dbraw/zinc/25/99/74/1426259974.db2.gz ITNVLYSRFNZFSY-UHFFFAOYSA-N 0 0 375.450 3.264 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CC[C@@H](Cc2ccccc2)C1 ZINC000172916476 1426261047 /nfs/dbraw/zinc/26/10/47/1426261047.db2.gz PHKACWJQLSPRTA-SFHVURJKSA-N 0 0 390.443 3.341 20 5 GGBDRN C[C@@H](CNC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)Sc1ccccc1 ZINC000172916517 1426261562 /nfs/dbraw/zinc/26/15/62/1426261562.db2.gz WOFIRYJXRCXXFT-KBPBESRZSA-N 0 0 387.461 3.010 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)c1 ZINC000172920964 1426264266 /nfs/dbraw/zinc/26/42/66/1426264266.db2.gz NLYPQBNCWQTADO-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN O=C(CNc1ccccc1CC(F)(F)F)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000172928642 1426268521 /nfs/dbraw/zinc/26/85/21/1426268521.db2.gz PJRFPKBFRVXEAD-UHFFFAOYSA-N 0 0 397.309 3.479 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(C(=O)Nc2ccccn2)c1 ZINC000172930626 1426269763 /nfs/dbraw/zinc/26/97/63/1426269763.db2.gz DSDTXASZJZFSMW-UHFFFAOYSA-N 0 0 376.372 3.423 20 5 GGBDRN CCOC(=O)[C@@H](C)NC(=O)c1ccc(NCc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000172936166 1426274324 /nfs/dbraw/zinc/27/43/24/1426274324.db2.gz SRNMJYBUZPTHKZ-GFCCVEGCSA-N 0 0 389.383 3.027 20 5 GGBDRN Cc1ccccc1[C@H]1CN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H](C)CO1 ZINC000172950164 1426281029 /nfs/dbraw/zinc/28/10/29/1426281029.db2.gz PLLCQRSKTPQUHY-AUUYWEPGSA-N 0 0 383.404 3.231 20 5 GGBDRN O=C1C[C@H](Nc2cccc(CC(F)(F)F)c2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000172950321 1426281242 /nfs/dbraw/zinc/28/12/42/1426281242.db2.gz NKLHJDPAZJEWEA-HNNXBMFYSA-N 0 0 393.321 3.444 20 5 GGBDRN O=C1C[C@H](Nc2ccc(CC(F)(F)F)cc2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000172949002 1426281247 /nfs/dbraw/zinc/28/12/47/1426281247.db2.gz BUVPQJHSLYPLBZ-HNNXBMFYSA-N 0 0 393.321 3.444 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)n1 ZINC000172964113 1426285343 /nfs/dbraw/zinc/28/53/43/1426285343.db2.gz WHEPDZKZJODLAF-UHFFFAOYSA-N 0 0 380.404 3.109 20 5 GGBDRN CC(C)(C)OC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000172963279 1426285436 /nfs/dbraw/zinc/28/54/36/1426285436.db2.gz MNWAWENDMCJNNY-UHFFFAOYSA-N 0 0 377.441 3.047 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1CCC1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[n-]n2)CC1 ZINC000820703845 1426287421 /nfs/dbraw/zinc/28/74/21/1426287421.db2.gz KATVORWBTJIQES-OAHLLOKOSA-N 0 0 399.499 3.256 20 5 GGBDRN CCC[C@H]1[C@H](C)CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000172992513 1426299141 /nfs/dbraw/zinc/29/91/41/1426299141.db2.gz SIQLGUPULYRNPP-OCCSQVGLSA-N 0 0 381.860 3.405 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H](C)c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000172993168 1426300079 /nfs/dbraw/zinc/30/00/79/1426300079.db2.gz HONSMVVZSFDNCV-LBPRGKRZSA-N 0 0 376.384 3.214 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)c1 ZINC000173007464 1426305880 /nfs/dbraw/zinc/30/58/80/1426305880.db2.gz TYKDVBREDLMUMC-UHFFFAOYSA-N 0 0 382.420 3.330 20 5 GGBDRN CN(CC(=O)NCCCc1nc2c(s1)CCCC2)c1ccccc1[N+](=O)[O-] ZINC000173008658 1426306094 /nfs/dbraw/zinc/30/60/94/1426306094.db2.gz HYIAXPCCXJFTMC-UHFFFAOYSA-N 0 0 388.493 3.115 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCN(c3ccccc3Cl)C2=O)c1 ZINC000173011092 1426307529 /nfs/dbraw/zinc/30/75/29/1426307529.db2.gz RXXBMTPWHUXANM-KRWDZBQOSA-N 0 0 387.823 3.434 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1 ZINC000173028718 1426315708 /nfs/dbraw/zinc/31/57/08/1426315708.db2.gz IJYCFDQYWACICK-OAHLLOKOSA-N 0 0 383.452 3.241 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1C[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000173031124 1426316012 /nfs/dbraw/zinc/31/60/12/1426316012.db2.gz RODHIGMPSZCGFY-JTQLQIEISA-N 0 0 389.250 3.119 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])c1noc(C)n1 ZINC000173036306 1426318318 /nfs/dbraw/zinc/31/83/18/1426318318.db2.gz GTACKLWYXFTNDA-KRWDZBQOSA-N 0 0 382.376 3.123 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000173055426 1426324930 /nfs/dbraw/zinc/32/49/30/1426324930.db2.gz JXBXKIXWKZUISS-CQSZACIVSA-N 0 0 391.374 3.134 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000173055865 1426325533 /nfs/dbraw/zinc/32/55/33/1426325533.db2.gz UHMWYRSWQFDYKD-AREMUKBSSA-N 0 0 376.434 3.051 20 5 GGBDRN CN(CC(=O)N[C@H](c1ccccc1)c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000173057253 1426326217 /nfs/dbraw/zinc/32/62/17/1426326217.db2.gz XBALJKNXBOXBIA-OAQYLSRUSA-N 0 0 376.416 3.332 20 5 GGBDRN O=C([C@@H]1SCCc2sccc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000173062839 1426327203 /nfs/dbraw/zinc/32/72/03/1426327203.db2.gz GJJPKJBPWAQNDM-QGZVFWFLSA-N 0 0 389.502 3.336 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000173064196 1426328379 /nfs/dbraw/zinc/32/83/79/1426328379.db2.gz CXEIUIYQCXSDNL-MRXNPFEDSA-N 0 0 387.823 3.260 20 5 GGBDRN CN(CC(=O)N(Cc1ccncc1)Cc1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000173073513 1426331605 /nfs/dbraw/zinc/33/16/05/1426331605.db2.gz BRCIKGQODOTDEB-UHFFFAOYSA-N 0 0 391.431 3.050 20 5 GGBDRN C[C@@]1(C(=O)N2CCc3c2cccc3[N+](=O)[O-])CCCN(C(=O)c2ccccc2)C1 ZINC000173080923 1426334327 /nfs/dbraw/zinc/33/43/27/1426334327.db2.gz BUPNVMVRURRRBE-JOCHJYFZSA-N 0 0 393.443 3.426 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCCO2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173084619 1426335454 /nfs/dbraw/zinc/33/54/54/1426335454.db2.gz UYZXRKOCPBKCLR-UHFFFAOYSA-N 0 0 382.294 3.315 20 5 GGBDRN C[C@@H](c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1)N1CCOCC1 ZINC000173089567 1426337666 /nfs/dbraw/zinc/33/76/66/1426337666.db2.gz KMJDUXMHDICZHY-INIZCTEOSA-N 0 0 398.463 3.063 20 5 GGBDRN CN(CC(=O)Nc1ccnn1Cc1ccccc1F)c1ccccc1[N+](=O)[O-] ZINC000173100403 1426342213 /nfs/dbraw/zinc/34/22/13/1426342213.db2.gz FBPTXGOMYRFUBZ-UHFFFAOYSA-N 0 0 383.383 3.054 20 5 GGBDRN COc1cc(C)c(CN(C)C(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000173108596 1426346507 /nfs/dbraw/zinc/34/65/07/1426346507.db2.gz RQSRNYLEZZOBHP-UHFFFAOYSA-N 0 0 387.436 3.015 20 5 GGBDRN C[S@@](=O)C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000173134317 1426357151 /nfs/dbraw/zinc/35/71/51/1426357151.db2.gz SVNFXZVWSWLSOT-XRHLQHRESA-N 0 0 389.477 3.023 20 5 GGBDRN COc1cc(C(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000173138292 1426360225 /nfs/dbraw/zinc/36/02/25/1426360225.db2.gz BAZREHLSMSXIIX-INIZCTEOSA-N 0 0 378.388 3.244 20 5 GGBDRN COc1cc(C(=O)N2C[C@H](n3cccn3)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000173138282 1426360306 /nfs/dbraw/zinc/36/03/06/1426360306.db2.gz BAZREHLSMSXIIX-MRXNPFEDSA-N 0 0 378.388 3.244 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000173140039 1426361529 /nfs/dbraw/zinc/36/15/29/1426361529.db2.gz KEGNLUJLYDFUNY-CQSZACIVSA-N 0 0 387.484 3.051 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173144818 1426363811 /nfs/dbraw/zinc/36/38/11/1426363811.db2.gz SEIIWBCFVYTFJE-QGZVFWFLSA-N 0 0 378.388 3.001 20 5 GGBDRN CN(CC(=O)N1C[C@H](n2cccn2)Cc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000173145617 1426364375 /nfs/dbraw/zinc/36/43/75/1426364375.db2.gz VOUQWPBTLGMYCF-QGZVFWFLSA-N 0 0 391.431 3.058 20 5 GGBDRN COc1ccc([C@@H]2CCCN2C(=O)CN(C)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000173153898 1426367790 /nfs/dbraw/zinc/36/77/90/1426367790.db2.gz KILXSLIZTWHRDR-KRWDZBQOSA-N 0 0 399.447 3.412 20 5 GGBDRN CN(Cc1ccccc1N1CCCC1)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173154364 1426368340 /nfs/dbraw/zinc/36/83/40/1426368340.db2.gz OKHCNHOMOBUZAR-UHFFFAOYSA-N 0 0 382.464 3.290 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@H]2C)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000173159389 1426370855 /nfs/dbraw/zinc/37/08/55/1426370855.db2.gz CQTUIIAMWRYTJR-LLVKDONJSA-N 0 0 377.422 3.263 20 5 GGBDRN CN(CC(=O)Nc1cc2c(cc1Cl)OCCO2)c1ccccc1[N+](=O)[O-] ZINC000173177260 1426378911 /nfs/dbraw/zinc/37/89/11/1426378911.db2.gz SRDWXOQTEXXBNA-UHFFFAOYSA-N 0 0 377.784 3.094 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173179631 1426380089 /nfs/dbraw/zinc/38/00/89/1426380089.db2.gz QMVIKZSZYHOCQK-UHFFFAOYSA-N 0 0 379.420 3.472 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N(C)c2cnn(C)c2)cc1[N+](=O)[O-])c1ccccn1 ZINC000173199656 1426389171 /nfs/dbraw/zinc/38/91/71/1426389171.db2.gz FAQKPGFNMWXNCC-CYBMUJFWSA-N 0 0 380.408 3.173 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000173204034 1426392054 /nfs/dbraw/zinc/39/20/54/1426392054.db2.gz YJTGQAOUCPFGEO-LBPRGKRZSA-N 0 0 383.832 3.281 20 5 GGBDRN CC(C)C[C@@H]1CCN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000173217989 1426400462 /nfs/dbraw/zinc/40/04/62/1426400462.db2.gz OAMRZVFTDGRTLI-NSHDSACASA-N 0 0 385.367 3.029 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)c1[N+](=O)[O-] ZINC000173222657 1426405600 /nfs/dbraw/zinc/40/56/00/1426405600.db2.gz ANOMZCJBXFFVGS-JTQLQIEISA-N 0 0 376.417 3.192 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)c(C)c1[N+](=O)[O-] ZINC000173228120 1426412223 /nfs/dbraw/zinc/41/22/23/1426412223.db2.gz CWFBDWYKHFVGLF-LBPRGKRZSA-N 0 0 390.444 3.106 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000173233279 1426418920 /nfs/dbraw/zinc/41/89/20/1426418920.db2.gz QYTRLXVAJUDDEF-YOEHRIQHSA-N 0 0 397.431 3.194 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000173233292 1426419599 /nfs/dbraw/zinc/41/95/99/1426419599.db2.gz QYTRLXVAJUDDEF-RHSMWYFYSA-N 0 0 397.431 3.194 20 5 GGBDRN Cc1nn(CCC(=O)N2CC[C@H](CSc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000173234944 1426421146 /nfs/dbraw/zinc/42/11/46/1426421146.db2.gz DBQIAKQKRYTKGW-INIZCTEOSA-N 0 0 388.493 3.439 20 5 GGBDRN CCC(O)(CC)CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000173241705 1426425298 /nfs/dbraw/zinc/42/52/98/1426425298.db2.gz HSZFFDOPMFJNSM-CQSZACIVSA-N 0 0 386.452 3.444 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(CN3CCO[C@@H](C)C3)c2)c1 ZINC000173243998 1426426352 /nfs/dbraw/zinc/42/63/52/1426426352.db2.gz GMSKFOVNIBHGBP-INIZCTEOSA-N 0 0 383.448 3.054 20 5 GGBDRN C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)c1nc(C2CCCCC2)no1 ZINC000173253306 1426432699 /nfs/dbraw/zinc/43/26/99/1426432699.db2.gz SVMMYWJYMXMNRD-SECBINFHSA-N 0 0 377.376 3.238 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1[N+](=O)[O-] ZINC000173258928 1426437644 /nfs/dbraw/zinc/43/76/44/1426437644.db2.gz WDLSSCLRWQIDST-UHFFFAOYSA-N 0 0 384.392 3.028 20 5 GGBDRN CCNC(=O)c1cc(Cl)ccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173272462 1426451527 /nfs/dbraw/zinc/45/15/27/1426451527.db2.gz PVTBIAPISIBEPI-UHFFFAOYSA-N 0 0 390.827 3.073 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000173274727 1426454023 /nfs/dbraw/zinc/45/40/23/1426454023.db2.gz MIXLRIOFUCOZHQ-INIZCTEOSA-N 0 0 397.431 3.318 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(NC(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000173279741 1426455917 /nfs/dbraw/zinc/45/59/17/1426455917.db2.gz VHDKPINMLBAMDQ-UHFFFAOYSA-N 0 0 381.432 3.192 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCC[C@H]1c1ccc(C)o1 ZINC000173301889 1426484419 /nfs/dbraw/zinc/48/44/19/1426484419.db2.gz CKRWOASFGWPGHH-AWEZNQCLSA-N 0 0 380.422 3.421 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC[C@@H]1c1ccc(C)o1 ZINC000173302671 1426484609 /nfs/dbraw/zinc/48/46/09/1426484609.db2.gz AQBQXTQKOFKNDI-CQSZACIVSA-N 0 0 380.422 3.421 20 5 GGBDRN Cc1ccc(C[NH2+]CCSCc2ccccc2-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC000737343562 1426487048 /nfs/dbraw/zinc/48/70/48/1426487048.db2.gz YABRWDCGCRPCIW-UHFFFAOYSA-N 0 0 384.465 3.106 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)CN(Cc2cccs2)c2ccc(F)cc2)c1 ZINC000173307353 1426488523 /nfs/dbraw/zinc/48/85/23/1426488523.db2.gz UOEYFVVBARVEOP-INIZCTEOSA-N 0 0 376.413 3.060 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CN(Cc2cccs2)c2ccc(F)cc2)c1 ZINC000173307372 1426488595 /nfs/dbraw/zinc/48/85/95/1426488595.db2.gz UOEYFVVBARVEOP-MRXNPFEDSA-N 0 0 376.413 3.060 20 5 GGBDRN CC(C)[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000173312893 1426496503 /nfs/dbraw/zinc/49/65/03/1426496503.db2.gz AXNIJZXIKINYMB-IBGZPJMESA-N 0 0 381.436 3.421 20 5 GGBDRN CN(CC(=O)Nc1cccc(OC[C@H]2CCCO2)c1)c1ccccc1[N+](=O)[O-] ZINC000173329967 1426511317 /nfs/dbraw/zinc/51/13/17/1426511317.db2.gz DXXLIJRPFALLNU-QGZVFWFLSA-N 0 0 385.420 3.228 20 5 GGBDRN CN(CC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccccc1[N+](=O)[O-] ZINC000173329954 1426511523 /nfs/dbraw/zinc/51/15/23/1426511523.db2.gz DXXLIJRPFALLNU-KRWDZBQOSA-N 0 0 385.420 3.228 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2coc(-c3ccccc3)n2)cc1C ZINC000173348025 1426525861 /nfs/dbraw/zinc/52/58/61/1426525861.db2.gz UGSOJLOTZYYPCX-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C1 ZINC000173358539 1426533184 /nfs/dbraw/zinc/53/31/84/1426533184.db2.gz AZPODCWMILZQJH-MRXNPFEDSA-N 0 0 375.469 3.452 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000173363661 1426537370 /nfs/dbraw/zinc/53/73/70/1426537370.db2.gz QCTDGCCOQWXUJH-UHFFFAOYSA-N 0 0 387.480 3.412 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc(-c3cccs3)nn2CCO)cc1[N+](=O)[O-] ZINC000173372363 1426545521 /nfs/dbraw/zinc/54/55/21/1426545521.db2.gz WLLCSZJTIPDRIN-UHFFFAOYSA-N 0 0 386.433 3.327 20 5 GGBDRN CCc1ccc(C(=O)Oc2cccc(NC(=O)c3cnn(C)c3)c2)cc1[N+](=O)[O-] ZINC000173375735 1426549416 /nfs/dbraw/zinc/54/94/16/1426549416.db2.gz HIDWNGYYHFRBHH-UHFFFAOYSA-N 0 0 394.387 3.362 20 5 GGBDRN COc1cc(C(=O)N[C@H](c2nc(C)cs2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000173376953 1426550492 /nfs/dbraw/zinc/55/04/92/1426550492.db2.gz NXJOTRCGEUBION-HNNXBMFYSA-N 0 0 377.422 3.258 20 5 GGBDRN COc1ccc([C@@H](C)CCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000173379817 1426553463 /nfs/dbraw/zinc/55/34/63/1426553463.db2.gz YNQVJLUWRBNFKT-AWEZNQCLSA-N 0 0 378.450 3.217 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc(Br)nc1 ZINC000173381630 1426555569 /nfs/dbraw/zinc/55/55/69/1426555569.db2.gz ZDVYDTLYJDJBPM-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)CC(C)(C)c1ccc(C)cc1 ZINC000173387437 1426564971 /nfs/dbraw/zinc/56/49/71/1426564971.db2.gz LRCWZHJZYDHZEA-UHFFFAOYSA-N 0 0 399.447 3.287 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)cc2)CCO1 ZINC000173397736 1426578105 /nfs/dbraw/zinc/57/81/05/1426578105.db2.gz VAZKYUBMOBBLGC-OAHLLOKOSA-N 0 0 384.436 3.184 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C2CC2)n1 ZINC000173398506 1426579479 /nfs/dbraw/zinc/57/94/79/1426579479.db2.gz FQDFGTPRMOVBEA-INIZCTEOSA-N 0 0 383.433 3.427 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(NC(=O)CC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000173400701 1426582380 /nfs/dbraw/zinc/58/23/80/1426582380.db2.gz KPEXPOZQIQXWSQ-UHFFFAOYSA-N 0 0 387.480 3.458 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[C@@H]1CCCN1C(=O)OC(C)(C)C ZINC000173399999 1426582498 /nfs/dbraw/zinc/58/24/98/1426582498.db2.gz NJNURWUZQBFSNK-HNNXBMFYSA-N 0 0 377.441 3.343 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)c1 ZINC000173412156 1426595653 /nfs/dbraw/zinc/59/56/53/1426595653.db2.gz RPRHSRVKZQEFEL-UHFFFAOYSA-N 0 0 383.404 3.250 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](c2nc(C)cs2)C2CC2)ccc1[N+](=O)[O-] ZINC000173413942 1426596438 /nfs/dbraw/zinc/59/64/38/1426596438.db2.gz DEERYWHJLDCIDD-MRXNPFEDSA-N 0 0 377.422 3.015 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1 ZINC000173418360 1426601526 /nfs/dbraw/zinc/60/15/26/1426601526.db2.gz ACFIRPFQCJJDAB-OAHLLOKOSA-N 0 0 386.383 3.079 20 5 GGBDRN O=C(NCCc1c[nH]c2ccc(Cl)cc12)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000173420744 1426603447 /nfs/dbraw/zinc/60/34/47/1426603447.db2.gz VITGIZKNUHOVJV-UHFFFAOYSA-N 0 0 386.795 3.027 20 5 GGBDRN Cc1ccc(O[C@H](C)CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000173422717 1426604310 /nfs/dbraw/zinc/60/43/10/1426604310.db2.gz LRDDGNJPJJJYNB-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000173423619 1426606065 /nfs/dbraw/zinc/60/60/65/1426606065.db2.gz DKCVVMOUGBSOEG-UGSOOPFHSA-N 0 0 394.424 3.193 20 5 GGBDRN CCc1ccc(C(=O)N[C@@H](c2noc(C)n2)c2ccccc2OC)cc1[N+](=O)[O-] ZINC000173424885 1426606847 /nfs/dbraw/zinc/60/68/47/1426606847.db2.gz ZTGRDQVPVHMZEW-GOSISDBHSA-N 0 0 396.403 3.377 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cn3cnc(-c4ccccc4)n3)CC2)cc1 ZINC000173435362 1426616452 /nfs/dbraw/zinc/61/64/52/1426616452.db2.gz OGCRNNKRDOEYBF-UHFFFAOYSA-N 0 0 379.420 3.354 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cn3nccc3-c3ccncc3)CC2)cc1 ZINC000173435745 1426616991 /nfs/dbraw/zinc/61/69/91/1426616991.db2.gz LTZWWZKWYWLQMZ-UHFFFAOYSA-N 0 0 379.420 3.354 20 5 GGBDRN Cn1cc(N2CC[C@@H](NC(=O)c3c4ccccc4cc4ccccc43)C2=O)cn1 ZINC000173440202 1426620791 /nfs/dbraw/zinc/62/07/91/1426620791.db2.gz NVDZGSNUCOJLPW-HXUWFJFHSA-N 0 0 384.439 3.262 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@H]2CCCO[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000173457295 1426632981 /nfs/dbraw/zinc/63/29/81/1426632981.db2.gz YSBNQDMGUGUQTL-DNVCBOLYSA-N 0 0 386.452 3.477 20 5 GGBDRN Cc1ccc(Cl)cc1NC(=O)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173462217 1426635910 /nfs/dbraw/zinc/63/59/10/1426635910.db2.gz UIVQQQVJQXGZTC-CQSZACIVSA-N 0 0 389.843 3.077 20 5 GGBDRN C[C@H](c1nc(-c2ccccc2)no1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173462702 1426637075 /nfs/dbraw/zinc/63/70/75/1426637075.db2.gz HHZARRLZJNXSBM-HIFRSBDPSA-N 0 0 380.408 3.287 20 5 GGBDRN CN(C)C(=O)c1cc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])ccc1Cl ZINC000173465915 1426639625 /nfs/dbraw/zinc/63/96/25/1426639625.db2.gz QBSPVSAOXUAVDM-UHFFFAOYSA-N 0 0 390.827 3.025 20 5 GGBDRN CC(C)c1cccc(NC(=O)CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000173465939 1426640791 /nfs/dbraw/zinc/64/07/91/1426640791.db2.gz VSKLVIWZOSLLCN-KRWDZBQOSA-N 0 0 383.452 3.238 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ncc(-c4ccc(F)cc4)o3)C2)nc1 ZINC000173467406 1426641872 /nfs/dbraw/zinc/64/18/72/1426641872.db2.gz MVXGTGKRKNAIGV-OAHLLOKOSA-N 0 0 383.383 3.470 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])C2)nc1 ZINC000173466877 1426641892 /nfs/dbraw/zinc/64/18/92/1426641892.db2.gz QSSHUPDMBXPNTC-ZDUSSCGKSA-N 0 0 377.788 3.238 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ncc(-c4ccccc4F)o3)C2)nc1 ZINC000173468172 1426642813 /nfs/dbraw/zinc/64/28/13/1426642813.db2.gz FSMRNXFCGGAUGG-ZDUSSCGKSA-N 0 0 383.383 3.470 20 5 GGBDRN CCOc1cc(C(=O)N2CCC(C(F)(F)F)CC2)c([N+](=O)[O-])cc1OC ZINC000173469283 1426644186 /nfs/dbraw/zinc/64/41/86/1426644186.db2.gz OIRPLXITOCOCLZ-UHFFFAOYSA-N 0 0 376.331 3.417 20 5 GGBDRN Cc1sc(NC(=O)CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1C ZINC000173470245 1426645484 /nfs/dbraw/zinc/64/54/84/1426645484.db2.gz RFAFNKLJIWQAGX-AWEZNQCLSA-N 0 0 389.481 3.101 20 5 GGBDRN C[C@H](c1nc(Cc2ccccc2)no1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173471382 1426646081 /nfs/dbraw/zinc/64/60/81/1426646081.db2.gz NDJYCYBLDDAOIO-ZBFHGGJFSA-N 0 0 394.435 3.211 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3coc(-c4cccc(F)c4)n3)C2)nc1 ZINC000173472436 1426647320 /nfs/dbraw/zinc/64/73/20/1426647320.db2.gz CGLDLFVENYLUTE-OAHLLOKOSA-N 0 0 383.383 3.470 20 5 GGBDRN CC[C@]1(C)CCCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000173485840 1426659061 /nfs/dbraw/zinc/65/90/61/1426659061.db2.gz OZRJZKIREBMGEG-LJQANCHMSA-N 0 0 375.425 3.322 20 5 GGBDRN CC[C@]1(C)CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000173487963 1426660691 /nfs/dbraw/zinc/66/06/91/1426660691.db2.gz RJEBAJIYOLRKBG-SCLBCKFNSA-N 0 0 379.482 3.300 20 5 GGBDRN CC(C)Nc1ccc(F)cc1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000173509033 1426677887 /nfs/dbraw/zinc/67/78/87/1426677887.db2.gz YUODSVFAEHGNMO-UHFFFAOYSA-N 0 0 395.412 3.210 20 5 GGBDRN CN(CC(=O)NCc1cccc(OCC(F)(F)F)c1)c1ccccc1[N+](=O)[O-] ZINC000173514648 1426685841 /nfs/dbraw/zinc/68/58/41/1426685841.db2.gz QQOZFVAQRDYOQG-UHFFFAOYSA-N 0 0 397.353 3.289 20 5 GGBDRN COc1ccc(-c2cc(N(C)CC(=O)Nc3ccc([N+](=O)[O-])cc3C)n[nH]2)cc1 ZINC000173520291 1426692896 /nfs/dbraw/zinc/69/28/96/1426692896.db2.gz ZGLNDJCLLYGABL-UHFFFAOYSA-N 0 0 395.419 3.377 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccc(F)cc2O1 ZINC000173523751 1426697153 /nfs/dbraw/zinc/69/71/53/1426697153.db2.gz QVKHFOOQLVBYQU-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)CN(C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000173529782 1426704622 /nfs/dbraw/zinc/70/46/22/1426704622.db2.gz YLUPEUPIDNNAAV-UHFFFAOYSA-N 0 0 383.448 3.409 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1)C(C)C ZINC000173531156 1426705690 /nfs/dbraw/zinc/70/56/90/1426705690.db2.gz DGRBQFVNSUFKRJ-UHFFFAOYSA-N 0 0 398.463 3.427 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccc(F)cc2O1 ZINC000173532997 1426708412 /nfs/dbraw/zinc/70/84/12/1426708412.db2.gz IZGGZOXMZCLVQK-LBPRGKRZSA-N 0 0 382.351 3.347 20 5 GGBDRN C[C@H]1CN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](c2ccccc2)CO1 ZINC000173541463 1426715376 /nfs/dbraw/zinc/71/53/76/1426715376.db2.gz DOZARLRQHPGVRN-KXBFYZLASA-N 0 0 379.420 3.273 20 5 GGBDRN CN(CC(=O)NCc1ccc(N2CCCCCC2)nc1)c1ccccc1[N+](=O)[O-] ZINC000173548814 1426722134 /nfs/dbraw/zinc/72/21/34/1426722134.db2.gz ZGLYITGCEJSSNK-UHFFFAOYSA-N 0 0 397.479 3.123 20 5 GGBDRN CN(CC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000173552236 1426725323 /nfs/dbraw/zinc/72/53/23/1426725323.db2.gz TVPPKAOWIFZMIE-UHFFFAOYSA-N 0 0 399.291 3.374 20 5 GGBDRN O=C([C@@H]1SCCc2ccccc21)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560170 1426730044 /nfs/dbraw/zinc/73/00/44/1426730044.db2.gz LAUPPZURKZDRBU-KBXCAEBGSA-N 0 0 384.461 3.033 20 5 GGBDRN C[C@H](CCc1cccc(F)c1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560060 1426730234 /nfs/dbraw/zinc/73/02/34/1426730234.db2.gz FORILJSFSZTMCZ-RHSMWYFYSA-N 0 0 386.427 3.411 20 5 GGBDRN C[C@@H](CCc1ccccc1F)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173559992 1426730476 /nfs/dbraw/zinc/73/04/76/1426730476.db2.gz PNZNMVRZLMREHA-GOEBONIOSA-N 0 0 386.427 3.411 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@@H](CSc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000173564068 1426732905 /nfs/dbraw/zinc/73/29/05/1426732905.db2.gz ZYKMNAFTDFOIFG-OAHLLOKOSA-N 0 0 399.472 3.483 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CC[C@@H](CSc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000173565142 1426734217 /nfs/dbraw/zinc/73/42/17/1426734217.db2.gz GTIFCZIFPYCOJT-OAHLLOKOSA-N 0 0 399.472 3.483 20 5 GGBDRN CC[C@]1(C)CCCN(C(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000173572113 1426738372 /nfs/dbraw/zinc/73/83/72/1426738372.db2.gz LAAGIFXDGFTZOG-LJQANCHMSA-N 0 0 379.457 3.376 20 5 GGBDRN CC[C@@]1(C)CCCN(C(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000173572126 1426738535 /nfs/dbraw/zinc/73/85/35/1426738535.db2.gz LAAGIFXDGFTZOG-IBGZPJMESA-N 0 0 379.457 3.376 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@@H](CC(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000173572517 1426739047 /nfs/dbraw/zinc/73/90/47/1426739047.db2.gz JIWPAAWYCXKANQ-AWEZNQCLSA-N 0 0 379.457 3.232 20 5 GGBDRN COc1cc(CCNC(=O)N2CC[C@H](CC(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000173572529 1426739475 /nfs/dbraw/zinc/73/94/75/1426739475.db2.gz JIWPAAWYCXKANQ-CQSZACIVSA-N 0 0 379.457 3.232 20 5 GGBDRN COc1cc(C(=O)N[C@@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000173581559 1426746617 /nfs/dbraw/zinc/74/66/17/1426746617.db2.gz XYEWXDSOUQCWKE-OAHLLOKOSA-N 0 0 377.422 3.258 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@H](C)CO1 ZINC000173592978 1426756645 /nfs/dbraw/zinc/75/66/45/1426756645.db2.gz JUNQFKRUHVMNKA-DNVCBOLYSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@H](C)CO1 ZINC000173595160 1426759040 /nfs/dbraw/zinc/75/90/40/1426759040.db2.gz DGRBVRCSTOIBNH-CZUORRHYSA-N 0 0 394.424 3.193 20 5 GGBDRN CC[C@@]1(C)CCCN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000173596997 1426763355 /nfs/dbraw/zinc/76/33/55/1426763355.db2.gz GFSFUXNOYXEDJP-KRWDZBQOSA-N 0 0 385.367 3.173 20 5 GGBDRN Cc1cnc([C@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C2CC2)s1 ZINC000173603862 1426777195 /nfs/dbraw/zinc/77/71/95/1426777195.db2.gz XGHSFXSXXYPTMK-MRXNPFEDSA-N 0 0 383.433 3.427 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](c2ncc(C)s2)C2CC2)ccc1[N+](=O)[O-] ZINC000173618136 1426799102 /nfs/dbraw/zinc/79/91/02/1426799102.db2.gz MYEHYWLBDHMAGV-MRXNPFEDSA-N 0 0 377.422 3.015 20 5 GGBDRN Cc1cnc([C@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)s1 ZINC000173619373 1426800162 /nfs/dbraw/zinc/80/01/62/1426800162.db2.gz JBUKVXIXUKYNGW-MRXNPFEDSA-N 0 0 383.433 3.427 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000173619575 1426800536 /nfs/dbraw/zinc/80/05/36/1426800536.db2.gz LCQLLMLADFOEHR-CYBMUJFWSA-N 0 0 375.425 3.274 20 5 GGBDRN C[C@@H](NC(=O)CN(CC1CC1)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173625639 1426801897 /nfs/dbraw/zinc/80/18/97/1426801897.db2.gz SJLLQYXKYIVXRO-CYBMUJFWSA-N 0 0 377.441 3.419 20 5 GGBDRN COc1ccc(OCCN2CCO[C@H](c3ccc(F)c(F)c3)C2)c([N+](=O)[O-])c1 ZINC000173631085 1426803077 /nfs/dbraw/zinc/80/30/77/1426803077.db2.gz PTRPAGWTGNWJGX-IBGZPJMESA-N 0 0 394.374 3.334 20 5 GGBDRN O=C(c1ccc(-n2cccn2)cc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173632492 1426803786 /nfs/dbraw/zinc/80/37/86/1426803786.db2.gz PAJNVTISZIECRQ-UHFFFAOYSA-N 0 0 392.415 3.464 20 5 GGBDRN CNc1snc(C)c1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173634383 1426804466 /nfs/dbraw/zinc/80/44/66/1426804466.db2.gz GUZYVLKDKCSBBV-UHFFFAOYSA-N 0 0 376.438 3.085 20 5 GGBDRN O=C([C@@H]1Cc2cc(F)ccc2O1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173635659 1426804871 /nfs/dbraw/zinc/80/48/71/1426804871.db2.gz GXRCRGOKYTZANK-IBGZPJMESA-N 0 0 386.379 3.107 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCCC[C@@H]1CNC(=O)c1ccccc1 ZINC000173638182 1426805826 /nfs/dbraw/zinc/80/58/26/1426805826.db2.gz OVRLQURQOFMMIQ-RDPWEWGOSA-N 0 0 393.443 3.419 20 5 GGBDRN CCC[C@]1(C)CCCN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000173639193 1426806093 /nfs/dbraw/zinc/80/60/93/1426806093.db2.gz QHKNSAGAPOMHBF-GOSISDBHSA-N 0 0 379.482 3.215 20 5 GGBDRN CCc1noc2ncc(C(=O)N3CCC(Oc4ccc([N+](=O)[O-])cc4)CC3)cc12 ZINC000173639120 1426806193 /nfs/dbraw/zinc/80/61/93/1426806193.db2.gz HIRPIXPHXMSIJV-UHFFFAOYSA-N 0 0 396.403 3.377 20 5 GGBDRN O=C([C@H]1CC(=O)Nc2ccccc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173642127 1426807126 /nfs/dbraw/zinc/80/71/26/1426807126.db2.gz UESPMLHQPMHOMU-SFHVURJKSA-N 0 0 395.415 3.091 20 5 GGBDRN O=C(c1cc2ccccc2c(=O)[nH]1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173642054 1426807227 /nfs/dbraw/zinc/80/72/27/1426807227.db2.gz ORNHISRMOHTTLU-UHFFFAOYSA-N 0 0 393.399 3.120 20 5 GGBDRN C[C@@H]1CN(c2ccccc2NC(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000173648036 1426809329 /nfs/dbraw/zinc/80/93/29/1426809329.db2.gz WVLOFLGUARIGSM-HZPDHXFCSA-N 0 0 398.463 3.283 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC(CN2CCCCC2=O)CC1 ZINC000173649192 1426809802 /nfs/dbraw/zinc/80/98/02/1426809802.db2.gz DRWQFXZFUTYGJW-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1CNC(=O)c1ccccc1 ZINC000173650119 1426810191 /nfs/dbraw/zinc/81/01/91/1426810191.db2.gz XPMWLLLABMGMAT-GOSISDBHSA-N 0 0 381.432 3.328 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H](COCc2ccccc2)C1 ZINC000173654338 1426811503 /nfs/dbraw/zinc/81/15/03/1426811503.db2.gz RSFADBWFUURWBG-KRWDZBQOSA-N 0 0 399.447 3.081 20 5 GGBDRN COc1ccc(NC(=O)CN2CC[C@H](COCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000173656417 1426812036 /nfs/dbraw/zinc/81/20/36/1426812036.db2.gz PSTXKDCDVQADJX-KRWDZBQOSA-N 0 0 399.447 3.081 20 5 GGBDRN Cc1nn(CCC(=O)NC[C@H](C)Oc2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] ZINC000173657347 1426812411 /nfs/dbraw/zinc/81/24/11/1426812411.db2.gz BJFKKYCMUVXGHL-NSHDSACASA-N 0 0 380.832 3.035 20 5 GGBDRN CN(CC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000173659077 1426812632 /nfs/dbraw/zinc/81/26/32/1426812632.db2.gz GAGAFENUOIUUID-UHFFFAOYSA-N 0 0 396.447 3.296 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCN(C)c3ccc(Cl)cc32)cc([N+](=O)[O-])c1 ZINC000173667726 1426815136 /nfs/dbraw/zinc/81/51/36/1426815136.db2.gz RBLAYZAHCOQKGC-UHFFFAOYSA-N 0 0 389.795 3.131 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N[C@@H](c2ccccc2C)C(C)C)cc1[N+](=O)[O-] ZINC000173678546 1426818560 /nfs/dbraw/zinc/81/85/60/1426818560.db2.gz WDCHUFQXDCWPIQ-HXUWFJFHSA-N 0 0 399.447 3.155 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@@H](c2ccccc2)CO1 ZINC000173683919 1426820555 /nfs/dbraw/zinc/82/05/55/1426820555.db2.gz SBOQLFJZMCPFDI-FOIQADDNSA-N 0 0 392.415 3.383 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3nc(CCc4ccccc4)no3)n2)cc1 ZINC000173691927 1426822604 /nfs/dbraw/zinc/82/26/04/1426822604.db2.gz KWYDDJCAUPZUQM-UHFFFAOYSA-N 0 0 376.376 3.070 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NC[C@@](C)(O)c3ccco3)cc2[N+](=O)[O-])CC1 ZINC000173703021 1426826473 /nfs/dbraw/zinc/82/64/73/1426826473.db2.gz UIUPUCAXJFYIOO-HXUWFJFHSA-N 0 0 387.436 3.062 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1 ZINC000826499947 1426829529 /nfs/dbraw/zinc/82/95/29/1426829529.db2.gz FPVRUOIUSYHCQJ-WMZOPIPTSA-N 0 0 378.436 3.276 20 5 GGBDRN CN(CC(=O)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000173729053 1426833006 /nfs/dbraw/zinc/83/30/06/1426833006.db2.gz XRBNYNRFSMFXRO-OAQYLSRUSA-N 0 0 397.431 3.070 20 5 GGBDRN CN(CC(=O)N1CCC(N(C)c2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000173730594 1426833336 /nfs/dbraw/zinc/83/33/36/1426833336.db2.gz FFWDQOQEVSTXSA-UHFFFAOYSA-N 0 0 382.464 3.158 20 5 GGBDRN COc1cc(C(=O)N2C[C@H](C)CN(C)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000173731142 1426833686 /nfs/dbraw/zinc/83/36/86/1426833686.db2.gz VWJYDIRCGLGESC-CYBMUJFWSA-N 0 0 385.420 3.345 20 5 GGBDRN COc1ccc2c(c1)N(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CCO2 ZINC000173736283 1426834821 /nfs/dbraw/zinc/83/48/21/1426834821.db2.gz YLPNJDORDJAFBN-UHFFFAOYSA-N 0 0 377.784 3.094 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCC3(CCCC3)C2)ccc1[N+](=O)[O-] ZINC000173738583 1426835696 /nfs/dbraw/zinc/83/56/96/1426835696.db2.gz RJBLDWTVOJHEBS-GOSISDBHSA-N 0 0 385.464 3.301 20 5 GGBDRN CN(CC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1[N+](=O)[O-] ZINC000173752717 1426839992 /nfs/dbraw/zinc/83/99/92/1426839992.db2.gz BHUPSJKMSFEEPX-UHFFFAOYSA-N 0 0 393.447 3.314 20 5 GGBDRN COc1ccccc1C[C@H](C)N(C)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000173760811 1426842616 /nfs/dbraw/zinc/84/26/16/1426842616.db2.gz BCAZQRIUAKWHDY-AWEZNQCLSA-N 0 0 378.450 3.164 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NCCCCC1CCCC1 ZINC000173771806 1426845845 /nfs/dbraw/zinc/84/58/45/1426845845.db2.gz JTENBLLOXLGVBU-UHFFFAOYSA-N 0 0 381.860 3.455 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)NCc1ccccc1 ZINC000173775361 1426847760 /nfs/dbraw/zinc/84/77/60/1426847760.db2.gz KRZXSWITHUAFJW-LLVKDONJSA-N 0 0 395.337 3.048 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000173780576 1426849395 /nfs/dbraw/zinc/84/93/95/1426849395.db2.gz SMGZHYWNWVLZSI-KRWDZBQOSA-N 0 0 387.411 3.364 20 5 GGBDRN COC[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccco1 ZINC000173781319 1426849757 /nfs/dbraw/zinc/84/97/57/1426849757.db2.gz PRAPEEHGTFRWJE-KRWDZBQOSA-N 0 0 376.412 3.252 20 5 GGBDRN CCN(CC)C(=O)c1ccccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173790891 1426851972 /nfs/dbraw/zinc/85/19/72/1426851972.db2.gz MLXSWJVTXFZSSJ-UHFFFAOYSA-N 0 0 384.436 3.152 20 5 GGBDRN CS(=O)(=O)c1c(Cl)cccc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000173795100 1426853159 /nfs/dbraw/zinc/85/31/59/1426853159.db2.gz RYYGDLDNVKTHDD-JXMROGBWSA-N 0 0 380.809 3.304 20 5 GGBDRN C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173798069 1426853866 /nfs/dbraw/zinc/85/38/66/1426853866.db2.gz STNRBGCIQCXBBV-CQSZACIVSA-N 0 0 394.431 3.436 20 5 GGBDRN C[C@@H](C(=O)NC1CCCCC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173799623 1426854189 /nfs/dbraw/zinc/85/41/89/1426854189.db2.gz IERXAJXMVOARKL-HNNXBMFYSA-N 0 0 375.469 3.275 20 5 GGBDRN Cc1ccsc1CNC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173799013 1426854313 /nfs/dbraw/zinc/85/43/13/1426854313.db2.gz IOMIDASNWGWOEN-UHFFFAOYSA-N 0 0 389.477 3.124 20 5 GGBDRN C[C@H](C1CC1)N(C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000173799560 1426854397 /nfs/dbraw/zinc/85/43/97/1426854397.db2.gz NKMYXOIHVYCHCU-OAHLLOKOSA-N 0 0 387.480 3.228 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000173799176 1426854420 /nfs/dbraw/zinc/85/44/20/1426854420.db2.gz FVVKEXNUNLQDDY-OAHLLOKOSA-N 0 0 399.447 3.474 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000173807288 1426856466 /nfs/dbraw/zinc/85/64/66/1426856466.db2.gz CRLLFMIRKFHCOZ-CQSZACIVSA-N 0 0 388.804 3.053 20 5 GGBDRN COc1cc(CCNC(=O)Nc2ccc3ccn(C)c3c2)c([N+](=O)[O-])cc1OC ZINC000173823877 1426860858 /nfs/dbraw/zinc/86/08/58/1426860858.db2.gz UFCNBAABBOPCQJ-UHFFFAOYSA-N 0 0 398.419 3.468 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)ccc1[N+](=O)[O-] ZINC000173828832 1426862628 /nfs/dbraw/zinc/86/26/28/1426862628.db2.gz ZHJAWYHMJPTZDB-AWEZNQCLSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000173831305 1426863050 /nfs/dbraw/zinc/86/30/50/1426863050.db2.gz PSBGHSZZZNZMEM-MMOPVJDHSA-N 0 0 386.448 3.105 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173850664 1426870963 /nfs/dbraw/zinc/87/09/63/1426870963.db2.gz YIOJPKAHKBRBKI-KRWDZBQOSA-N 0 0 398.444 3.092 20 5 GGBDRN O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173854091 1426871784 /nfs/dbraw/zinc/87/17/84/1426871784.db2.gz INDGGIOCTMPVPA-LBPRGKRZSA-N 0 0 393.321 3.149 20 5 GGBDRN Cc1ccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c(-c2nc(C3CC3)no2)c1 ZINC000173860410 1426873571 /nfs/dbraw/zinc/87/35/71/1426873571.db2.gz ABPXXWLIHPXDAM-UHFFFAOYSA-N 0 0 382.380 3.056 20 5 GGBDRN O=[N+]([O-])c1cccc(N2CCN(Cn3nc(C4CC4)sc3=S)CC2)c1 ZINC000173884714 1426881029 /nfs/dbraw/zinc/88/10/29/1426881029.db2.gz WDOIRPKWQJXKQS-UHFFFAOYSA-N 0 0 377.495 3.239 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000173904977 1426886775 /nfs/dbraw/zinc/88/67/75/1426886775.db2.gz IDFOGVXAOBDCID-UHFFFAOYSA-N 0 0 398.370 3.418 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000173905283 1426886877 /nfs/dbraw/zinc/88/68/77/1426886877.db2.gz JGWCKFWAPZWGNV-UHFFFAOYSA-N 0 0 388.327 3.068 20 5 GGBDRN CCO[C@H](CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C(C)C ZINC000173918340 1426891580 /nfs/dbraw/zinc/89/15/80/1426891580.db2.gz GBFUCQJQTIWMGV-CQSZACIVSA-N 0 0 380.413 3.454 20 5 GGBDRN C[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CCN1C(=O)OC(C)(C)C ZINC000173920989 1426892431 /nfs/dbraw/zinc/89/24/31/1426892431.db2.gz NMQMFAVCWFKEBQ-RNVIBTMRSA-N 0 0 375.425 3.076 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3ccco3)n2Cc2ccccc2)c1 ZINC000173922356 1426893112 /nfs/dbraw/zinc/89/31/12/1426893112.db2.gz PTZRAAXUNTYTPR-UHFFFAOYSA-N 0 0 396.432 3.483 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(S(=O)(=O)CCc3ccccc3)CC2)cc1 ZINC000173930377 1426896802 /nfs/dbraw/zinc/89/68/02/1426896802.db2.gz YHQMEZGZOQALKU-UHFFFAOYSA-N 0 0 390.461 3.011 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CCN1C(=O)OC(C)(C)C ZINC000173930802 1426897354 /nfs/dbraw/zinc/89/73/54/1426897354.db2.gz VBGKTUCZZWUSGQ-LLVKDONJSA-N 0 0 383.832 3.330 20 5 GGBDRN C[C@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)CC[C@@H]1c1ccccc1 ZINC000173933761 1426898173 /nfs/dbraw/zinc/89/81/73/1426898173.db2.gz VCQFJWLJEALRMJ-KXBFYZLASA-N 0 0 391.431 3.441 20 5 GGBDRN COc1ccc2c(c1)N(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C[C@@H](C)O2 ZINC000173944091 1426902392 /nfs/dbraw/zinc/90/23/92/1426902392.db2.gz UAUNUIBQBMUEAT-GFCCVEGCSA-N 0 0 382.376 3.441 20 5 GGBDRN CN1CCOc2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc21 ZINC000173943323 1426902420 /nfs/dbraw/zinc/90/24/20/1426902420.db2.gz RLMUIIJISVCDGJ-UHFFFAOYSA-N 0 0 396.447 3.279 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC3(CCCC3)C2)cc1Br ZINC000173942372 1426902445 /nfs/dbraw/zinc/90/24/45/1426902445.db2.gz QPGVDBDUPDRXIA-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN CC[C@](C)(NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1nc(C)cs1 ZINC000173946248 1426903871 /nfs/dbraw/zinc/90/38/71/1426903871.db2.gz UFFLUCOKEVVEPP-KRWDZBQOSA-N 0 0 378.454 3.222 20 5 GGBDRN CC[C@@](C)(NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1nc(C)cs1 ZINC000173946261 1426904068 /nfs/dbraw/zinc/90/40/68/1426904068.db2.gz UFFLUCOKEVVEPP-QGZVFWFLSA-N 0 0 378.454 3.222 20 5 GGBDRN C[C@H]1CN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000173957380 1426909101 /nfs/dbraw/zinc/90/91/01/1426909101.db2.gz VRRNOWZMEDTKIP-KPZWWZAWSA-N 0 0 385.445 3.005 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@H](O)COCc2ccc(Cl)cc2)nc1-c1ccncc1 ZINC000173959984 1426910623 /nfs/dbraw/zinc/91/06/23/1426910623.db2.gz QCMBLPLPGTUIQZ-INIZCTEOSA-N 0 0 388.811 3.084 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@@H](O)COc2cccc3ccccc32)nc1-c1ccncc1 ZINC000173960218 1426911262 /nfs/dbraw/zinc/91/12/62/1426911262.db2.gz GPGFHHNZRVCCBE-QGZVFWFLSA-N 0 0 390.399 3.446 20 5 GGBDRN C[C@H](CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)C(=O)c1cccc(F)c1 ZINC000173982710 1426926244 /nfs/dbraw/zinc/92/62/44/1426926244.db2.gz FADRJGFSCFZSFH-OAHLLOKOSA-N 0 0 399.422 3.292 20 5 GGBDRN C[C@@H](CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)C(=O)c1cccc(F)c1 ZINC000173982695 1426926378 /nfs/dbraw/zinc/92/63/78/1426926378.db2.gz FADRJGFSCFZSFH-HNNXBMFYSA-N 0 0 399.422 3.292 20 5 GGBDRN COC(=O)c1sc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)nc1C(C)(C)C ZINC000173984371 1426926959 /nfs/dbraw/zinc/92/69/59/1426926959.db2.gz VVFIRWKOVVKOQX-UHFFFAOYSA-N 0 0 377.422 3.317 20 5 GGBDRN C[C@@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000173985549 1426928143 /nfs/dbraw/zinc/92/81/43/1426928143.db2.gz UOOXFTYRYDFAPU-KZULUSFZSA-N 0 0 387.823 3.198 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1C(=O)N1CCC2(C1)CCCCC2 ZINC000173992657 1426930773 /nfs/dbraw/zinc/93/07/73/1426930773.db2.gz WNXNOINRMWLFQL-AWEZNQCLSA-N 0 0 391.493 3.444 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1CCOc1ccc(OC(F)(F)F)cc1 ZINC000174000486 1426935721 /nfs/dbraw/zinc/93/57/21/1426935721.db2.gz NYLJJEAXORHDTE-UHFFFAOYSA-N 0 0 395.293 3.282 20 5 GGBDRN Cc1ccc(CNC(=O)c2nnc(COc3ccccc3[N+](=O)[O-])s2)cc1 ZINC000174002484 1426936146 /nfs/dbraw/zinc/93/61/46/1426936146.db2.gz IQZDEJAXURVNOR-UHFFFAOYSA-N 0 0 384.417 3.264 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)Cc1csc(NC(=O)C(C)(C)C)n1 ZINC000174003531 1426936696 /nfs/dbraw/zinc/93/66/96/1426936696.db2.gz AIJLKLAJESOZJU-UHFFFAOYSA-N 0 0 377.422 3.492 20 5 GGBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000174020548 1426948652 /nfs/dbraw/zinc/94/86/52/1426948652.db2.gz QGWYAUVCGFWFRY-CRAIPNDOSA-N 0 0 383.448 3.193 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(CCc1ccc(C)cc1)Cc1ccco1 ZINC000174040727 1426964049 /nfs/dbraw/zinc/96/40/49/1426964049.db2.gz BOPYPTQPPNXYKX-UHFFFAOYSA-N 0 0 382.420 3.273 20 5 GGBDRN CCc1ccc(C(=O)N2CCC[C@@H](c3nnc4ccccn43)C2)cc1[N+](=O)[O-] ZINC000174041523 1426964134 /nfs/dbraw/zinc/96/41/34/1426964134.db2.gz XYFQZCRLDQVVTK-MRXNPFEDSA-N 0 0 379.420 3.220 20 5 GGBDRN O=[N+]([O-])c1ccc(C[N@H+](CCCOc2cccc(-c3nn[n-]n3)c2)C2CC2)cc1 ZINC000826498168 1426966086 /nfs/dbraw/zinc/96/60/86/1426966086.db2.gz JSQRWQLKIGVPRR-UHFFFAOYSA-N 0 0 394.435 3.208 20 5 GGBDRN CCc1ccc(C(=O)NCCc2nccn2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000174043763 1426967080 /nfs/dbraw/zinc/96/70/80/1426967080.db2.gz ZXWAIDUXOOWJPF-UHFFFAOYSA-N 0 0 378.432 3.375 20 5 GGBDRN CCOc1cc(C(=O)N[C@@H]2CCCC[C@H]2n2cccn2)c([N+](=O)[O-])cc1OC ZINC000174054800 1426975210 /nfs/dbraw/zinc/97/52/10/1426975210.db2.gz IZJWPJQLYHDNRP-HUUCEWRRSA-N 0 0 388.424 3.112 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)cc1SC ZINC000174056378 1426977208 /nfs/dbraw/zinc/97/72/08/1426977208.db2.gz ORRVWGAUZYPWFY-KGLIPLIRSA-N 0 0 390.465 3.436 20 5 GGBDRN C[C@@H]1CN(C)c2ccccc2N(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000174059680 1426979773 /nfs/dbraw/zinc/97/97/73/1426979773.db2.gz NKIZZNTZJKTVPI-CYBMUJFWSA-N 0 0 392.415 3.169 20 5 GGBDRN C[C@@H]([N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1nc(C2CCCCC2)no1 ZINC000174067474 1426984100 /nfs/dbraw/zinc/98/41/00/1426984100.db2.gz NOQRKYASSBMFQM-SNVBAGLBSA-N 0 0 398.416 3.204 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1[N+](=O)[O-] ZINC000174069102 1426985072 /nfs/dbraw/zinc/98/50/72/1426985072.db2.gz UIZQRIOHZJUYKW-UHFFFAOYSA-N 0 0 397.840 3.434 20 5 GGBDRN CCc1ccc(C(=O)N2CCCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000174069712 1426985816 /nfs/dbraw/zinc/98/58/16/1426985816.db2.gz BAABMIYCJQYPMX-UHFFFAOYSA-N 0 0 381.432 3.146 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(=O)N(C)C)c1ccccc1 ZINC000174075996 1426989560 /nfs/dbraw/zinc/98/95/60/1426989560.db2.gz YHLVBDLHSWNYSJ-CQSZACIVSA-N 0 0 387.461 3.197 20 5 GGBDRN CN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174083523 1426993432 /nfs/dbraw/zinc/99/34/32/1426993432.db2.gz XOWBGUBHOCZERH-GFCCVEGCSA-N 0 0 383.832 3.330 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174083852 1426993530 /nfs/dbraw/zinc/99/35/30/1426993530.db2.gz WCJDSNLQCGCWGT-GFCCVEGCSA-N 0 0 383.832 3.330 20 5 GGBDRN CCc1ccc(C(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000174088302 1426995446 /nfs/dbraw/zinc/99/54/46/1426995446.db2.gz FPDMOOPORAPYPF-HNNXBMFYSA-N 0 0 387.480 3.268 20 5 GGBDRN CC[C@H]1CN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1c1ccccc1 ZINC000174093962 1426999332 /nfs/dbraw/zinc/99/93/32/1426999332.db2.gz KZQYCHSBKGEUPQ-JXFKEZNVSA-N 0 0 395.459 3.367 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000174094834 1427000008 /nfs/dbraw/zinc/00/00/08/1427000008.db2.gz MOWAUMJPBZJODT-CXAGYDPISA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])[C@H](c2ccccc2)CO1 ZINC000174094740 1427000304 /nfs/dbraw/zinc/00/03/04/1427000304.db2.gz XXMWFARNPICIHS-LRDDRELGSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)CO1 ZINC000174094771 1427000444 /nfs/dbraw/zinc/00/04/44/1427000444.db2.gz IVELCBUXTIBTBI-LRDDRELGSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H](c2ccccc2)CO1 ZINC000174095903 1427000708 /nfs/dbraw/zinc/00/07/08/1427000708.db2.gz PDBTTYGGWJCJBB-LRDDRELGSA-N 0 0 396.852 3.399 20 5 GGBDRN CCc1ccc(-c2csc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)n2)cc1 ZINC000174097653 1427001743 /nfs/dbraw/zinc/00/17/43/1427001743.db2.gz INCXALZFYOBYDY-UHFFFAOYSA-N 0 0 384.417 3.081 20 5 GGBDRN COc1cc(C(=O)N2CCN(CC3CC3)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000174101996 1427002946 /nfs/dbraw/zinc/00/29/46/1427002946.db2.gz OAZBXRYTKDRILU-UHFFFAOYSA-N 0 0 397.431 3.489 20 5 GGBDRN CN(C)CC(=O)Nc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000174103135 1427003178 /nfs/dbraw/zinc/00/31/78/1427003178.db2.gz RMDMZAIGJUYIGN-UHFFFAOYSA-N 0 0 376.800 3.001 20 5 GGBDRN C[C@H](C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(F)c1 ZINC000174105077 1427004086 /nfs/dbraw/zinc/00/40/86/1427004086.db2.gz VKXSWDZDVWANAA-NSHDSACASA-N 0 0 394.786 3.464 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)cc21 ZINC000174105309 1427004815 /nfs/dbraw/zinc/00/48/15/1427004815.db2.gz XMQGSTJYHSXYDX-UHFFFAOYSA-N 0 0 386.795 3.201 20 5 GGBDRN COc1ccc2c(c1)nccc2OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000174124262 1427011808 /nfs/dbraw/zinc/01/18/08/1427011808.db2.gz WNMSOTHHZHBBCP-UHFFFAOYSA-N 0 0 379.372 3.120 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000174130096 1427015276 /nfs/dbraw/zinc/01/52/76/1427015276.db2.gz IMWCIWBVBUZPAF-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000174135709 1427017291 /nfs/dbraw/zinc/01/72/91/1427017291.db2.gz OIONYGDCVLSEQK-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000174138224 1427017881 /nfs/dbraw/zinc/01/78/81/1427017881.db2.gz MOKZPVJSHDAKBN-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN CSC1(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CCOCC1 ZINC000174139958 1427018734 /nfs/dbraw/zinc/01/87/34/1427018734.db2.gz BCSKVHKABHRZQF-UHFFFAOYSA-N 0 0 393.490 3.360 20 5 GGBDRN COc1ccc(OC)c([C@H](C)NC(=O)Cn2ccc3c2cccc3[N+](=O)[O-])c1 ZINC000174159771 1427026002 /nfs/dbraw/zinc/02/60/02/1427026002.db2.gz JXBSVWGODCIGCM-ZDUSSCGKSA-N 0 0 383.404 3.444 20 5 GGBDRN CCc1ccc(C(=O)N2CCCN(C(=O)OCC(C)C)CC2)cc1[N+](=O)[O-] ZINC000174161353 1427027489 /nfs/dbraw/zinc/02/74/89/1427027489.db2.gz IPVLYQJVOLTIAU-UHFFFAOYSA-N 0 0 377.441 3.098 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)NCc2ccc([N+](=O)[O-])cc2)n1 ZINC000174166016 1427029020 /nfs/dbraw/zinc/02/90/20/1427029020.db2.gz SAKNHVQLQLVSGD-ZDUSSCGKSA-N 0 0 391.428 3.053 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000174169220 1427030898 /nfs/dbraw/zinc/03/08/98/1427030898.db2.gz TXYHLXBABXCVPO-LBPRGKRZSA-N 0 0 377.401 3.375 20 5 GGBDRN Cc1nsc(N2CCCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)CC2)n1 ZINC000174170559 1427031316 /nfs/dbraw/zinc/03/13/16/1427031316.db2.gz JLJAONXSNPVZCE-UHFFFAOYSA-N 0 0 391.497 3.254 20 5 GGBDRN C[C@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2ccccc2NC1=O ZINC000174175835 1427034238 /nfs/dbraw/zinc/03/42/38/1427034238.db2.gz NCCJIMSIYDQEGM-LBPRGKRZSA-N 0 0 379.376 3.240 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(Cc3ccccc3OC)CC2)cc1[N+](=O)[O-] ZINC000174180232 1427036195 /nfs/dbraw/zinc/03/61/95/1427036195.db2.gz HLQKFGRHUNTAKU-UHFFFAOYSA-N 0 0 383.448 3.124 20 5 GGBDRN CN(C)CC(=O)Nc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000174185372 1427038148 /nfs/dbraw/zinc/03/81/48/1427038148.db2.gz GBTDRGROANIDII-UHFFFAOYSA-N 0 0 391.815 3.392 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000174186278 1427038716 /nfs/dbraw/zinc/03/87/16/1427038716.db2.gz UCWTXKGWFBBFCS-UHFFFAOYSA-N 0 0 382.464 3.368 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000174189967 1427041091 /nfs/dbraw/zinc/04/10/91/1427041091.db2.gz WNCIBMLQJSBMJK-UHFFFAOYSA-N 0 0 378.392 3.209 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1ccncc1Cl)c1ccccc1[N+](=O)[O-] ZINC000174205543 1427049459 /nfs/dbraw/zinc/04/94/59/1427049459.db2.gz NXCZGHNPVKRMIA-OAHLLOKOSA-N 0 0 391.811 3.456 20 5 GGBDRN CCc1ccc(N2CCN(C(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])CC2)cc1 ZINC000174212531 1427053835 /nfs/dbraw/zinc/05/38/35/1427053835.db2.gz GJBSCEQWBOGQBX-UHFFFAOYSA-N 0 0 399.447 3.137 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc2c(c1)NC(=O)CCN2C ZINC000174241131 1427065861 /nfs/dbraw/zinc/06/58/61/1427065861.db2.gz PVULMEVWYFMCGR-UHFFFAOYSA-N 0 0 396.447 3.424 20 5 GGBDRN C[C@@H](C(=O)NCc1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174245688 1427067861 /nfs/dbraw/zinc/06/78/61/1427067861.db2.gz PWMRWQHSCVBNAQ-INIZCTEOSA-N 0 0 383.448 3.143 20 5 GGBDRN CC[C@H]1CCCCN1C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174246046 1427067897 /nfs/dbraw/zinc/06/78/97/1427067897.db2.gz GJROHXVASAFEQO-INIZCTEOSA-N 0 0 375.469 3.229 20 5 GGBDRN CCOc1ccccc1NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174248250 1427068972 /nfs/dbraw/zinc/06/89/72/1427068972.db2.gz FGYLHMTUTDCIFO-UHFFFAOYSA-N 0 0 399.447 3.475 20 5 GGBDRN C[C@@H]1CCCC[C@H]1NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174249373 1427069502 /nfs/dbraw/zinc/06/95/02/1427069502.db2.gz CZWRKPRWIIVOQE-DNVCBOLYSA-N 0 0 375.469 3.133 20 5 GGBDRN O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N1CCc2ccccc2C1 ZINC000174249172 1427069809 /nfs/dbraw/zinc/06/98/09/1427069809.db2.gz RFWSXXAPDKEYDS-UHFFFAOYSA-N 0 0 395.459 3.023 20 5 GGBDRN COc1ccc(C(=O)OCc2nc(Cc3ccc(F)cc3)no2)cc1[N+](=O)[O-] ZINC000174277040 1427080436 /nfs/dbraw/zinc/08/04/36/1427080436.db2.gz TVENQKCSEOYMKE-UHFFFAOYSA-N 0 0 387.323 3.073 20 5 GGBDRN Cc1nn(C)c(C(=O)N(CCc2ccc(C)cc2)CC(F)(F)F)c1[N+](=O)[O-] ZINC000174301711 1427092183 /nfs/dbraw/zinc/09/21/83/1427092183.db2.gz QJZDXWBGZLHRNQ-UHFFFAOYSA-N 0 0 384.358 3.192 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)Oc1ccccc1F ZINC000174304888 1427093511 /nfs/dbraw/zinc/09/35/11/1427093511.db2.gz VOCWPYQRCJHZAE-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)Oc1ccccc1F ZINC000174304900 1427093586 /nfs/dbraw/zinc/09/35/86/1427093586.db2.gz VOCWPYQRCJHZAE-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN CN(C)c1ccc(C(=O)c2ccccc2C(=O)NCc2ccc[nH]2)cc1[N+](=O)[O-] ZINC000174312094 1427096677 /nfs/dbraw/zinc/09/66/77/1427096677.db2.gz VUFSNLAKYHAFRW-UHFFFAOYSA-N 0 0 392.415 3.150 20 5 GGBDRN CCc1ccc(N2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)cc1 ZINC000174317334 1427099340 /nfs/dbraw/zinc/09/93/40/1427099340.db2.gz VRTOUUHJMIQPNQ-UHFFFAOYSA-N 0 0 383.448 3.346 20 5 GGBDRN C[C@H](CCOc1ccccc1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000174321873 1427101260 /nfs/dbraw/zinc/10/12/60/1427101260.db2.gz SDLDXIRWSYIERD-HZPDHXFCSA-N 0 0 384.436 3.108 20 5 GGBDRN CCc1nsc(N2CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)CC2)n1 ZINC000174325396 1427102297 /nfs/dbraw/zinc/10/22/97/1427102297.db2.gz MJISCFDCEBSPJG-UHFFFAOYSA-N 0 0 391.497 3.118 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)/C=C/c2ccc(Cl)s2)c([N+](=O)[O-])c1 ZINC000174332626 1427105343 /nfs/dbraw/zinc/10/53/43/1427105343.db2.gz WPKHYAKJLIUYJF-ZZXKWVIFSA-N 0 0 395.824 3.077 20 5 GGBDRN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174330905 1427105363 /nfs/dbraw/zinc/10/53/63/1427105363.db2.gz VMOXVMITFMVXST-NWDGAFQWSA-N 0 0 399.382 3.462 20 5 GGBDRN C[C@H](N[C@@H](C)c1nc(-c2cccc(F)c2)no1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000174330891 1427105372 /nfs/dbraw/zinc/10/53/72/1427105372.db2.gz VMOXVMITFMVXST-RYUDHWBXSA-N 0 0 399.382 3.462 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)c2cccc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000174333125 1427106264 /nfs/dbraw/zinc/10/62/64/1427106264.db2.gz DTOOEKIVALQZKH-UHFFFAOYSA-N 0 0 398.202 3.269 20 5 GGBDRN C[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000174338759 1427109432 /nfs/dbraw/zinc/10/94/32/1427109432.db2.gz MUUVVHFZKSJJEK-NWDGAFQWSA-N 0 0 399.382 3.462 20 5 GGBDRN CCc1ccc(C(=O)N2CCc3c(cccc3N3CCOC3=O)C2)cc1[N+](=O)[O-] ZINC000174340058 1427110220 /nfs/dbraw/zinc/11/02/20/1427110220.db2.gz CHMYYKJUOQMHAF-UHFFFAOYSA-N 0 0 395.415 3.312 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000174344308 1427112046 /nfs/dbraw/zinc/11/20/46/1427112046.db2.gz BOBRTKQHOBQSEC-NWDGAFQWSA-N 0 0 383.470 3.470 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000174348544 1427113816 /nfs/dbraw/zinc/11/38/16/1427113816.db2.gz CRQJYPVSAFEWHK-UKRRQHHQSA-N 0 0 377.441 3.408 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000174348527 1427113839 /nfs/dbraw/zinc/11/38/39/1427113839.db2.gz CRQJYPVSAFEWHK-DZGCQCFKSA-N 0 0 377.441 3.408 20 5 GGBDRN CCS[C@H]1CC[C@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000174394628 1427136748 /nfs/dbraw/zinc/13/67/48/1427136748.db2.gz RUGKCYGJDOYSGO-AAEUAGOBSA-N 0 0 375.450 3.183 20 5 GGBDRN CCS[C@H]1CC[C@H](N(C)C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C1 ZINC000174419736 1427149586 /nfs/dbraw/zinc/14/95/86/1427149586.db2.gz LNIKIYIRDVUILQ-BBRMVZONSA-N 0 0 389.481 3.230 20 5 GGBDRN CNC(=O)c1ccc(N[C@@H](CC(=O)OC(C)C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000174418664 1427149684 /nfs/dbraw/zinc/14/96/84/1427149684.db2.gz METPYGVQZQDHOY-KRWDZBQOSA-N 0 0 385.420 3.449 20 5 GGBDRN Cc1nn(CCC(=O)N2C[C@H](c3ccccc3C)OC[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000174421257 1427149925 /nfs/dbraw/zinc/14/99/25/1427149925.db2.gz LJYCZOQFIGEKED-KBXCAEBGSA-N 0 0 386.452 3.095 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1CC(F)(F)F ZINC000174444090 1427158575 /nfs/dbraw/zinc/15/85/75/1427158575.db2.gz FKVXPPGSMRFXHD-UHFFFAOYSA-N 0 0 395.293 3.246 20 5 GGBDRN Cc1ccc(N2CC[C@@H](NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000174464649 1427168979 /nfs/dbraw/zinc/16/89/79/1427168979.db2.gz PMBIAIORZKDCBN-MRXNPFEDSA-N 0 0 388.811 3.484 20 5 GGBDRN CN(C)C(=O)c1cccc(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000174466109 1427169482 /nfs/dbraw/zinc/16/94/82/1427169482.db2.gz LWGXBMKBBSLWSC-UHFFFAOYSA-N 0 0 390.827 3.314 20 5 GGBDRN CC(C)C1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000174482814 1427176245 /nfs/dbraw/zinc/17/62/45/1427176245.db2.gz ZSYDRLGLPDYGAR-CQSZACIVSA-N 0 0 379.482 3.156 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c(C)o1 ZINC000174486292 1427178307 /nfs/dbraw/zinc/17/83/07/1427178307.db2.gz HGCGKVIQKSNDJX-FQEVSTJZSA-N 0 0 387.436 3.042 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000174496754 1427183076 /nfs/dbraw/zinc/18/30/76/1427183076.db2.gz ZHRCKSIVJYYKTF-ACJLOTCBSA-N 0 0 385.395 3.073 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nc2cc(F)ccc2[nH]1 ZINC000174504595 1427189718 /nfs/dbraw/zinc/18/97/18/1427189718.db2.gz IDNXNVSVZYSHLG-NSHDSACASA-N 0 0 388.424 3.450 20 5 GGBDRN O=C(Nc1c(F)cccc1NC1CC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000174505413 1427190589 /nfs/dbraw/zinc/19/05/89/1427190589.db2.gz XLSIFWKTYHZEKR-UHFFFAOYSA-N 0 0 382.355 3.141 20 5 GGBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000174519462 1427199081 /nfs/dbraw/zinc/19/90/81/1427199081.db2.gz VUNCEKLBYKMCCG-INIZCTEOSA-N 0 0 377.328 3.068 20 5 GGBDRN CC(C)(C)OC(=O)CCC(C)(C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000174526542 1427203745 /nfs/dbraw/zinc/20/37/45/1427203745.db2.gz IDMCGWJIQNPRJZ-UHFFFAOYSA-N 0 0 376.413 3.101 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1C ZINC000174528697 1427205103 /nfs/dbraw/zinc/20/51/03/1427205103.db2.gz WXAMHGQZOFKVFO-IBGZPJMESA-N 0 0 381.432 3.305 20 5 GGBDRN CN(CC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1C=O ZINC000174530789 1427206608 /nfs/dbraw/zinc/20/66/08/1427206608.db2.gz DBIAXZZCEOWQOQ-UHFFFAOYSA-N 0 0 395.337 3.179 20 5 GGBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000174535834 1427209836 /nfs/dbraw/zinc/20/98/36/1427209836.db2.gz UAMYQOAANWUSST-INIZCTEOSA-N 0 0 391.355 3.376 20 5 GGBDRN O=C(NCC(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000174547972 1427216850 /nfs/dbraw/zinc/21/68/50/1427216850.db2.gz BJZYBBAOPXAPBL-UHFFFAOYSA-N 0 0 381.301 3.211 20 5 GGBDRN CCOc1cc(N2CCC(OC(=O)c3cc(CC)[nH]n3)CC2)ccc1[N+](=O)[O-] ZINC000174550852 1427219226 /nfs/dbraw/zinc/21/92/26/1427219226.db2.gz WUUVKMMPTQLSFO-UHFFFAOYSA-N 0 0 388.424 3.105 20 5 GGBDRN CCOc1cc(N2CCC(OC(=O)c3ccc(C)n3C)CC2)ccc1[N+](=O)[O-] ZINC000174550547 1427219268 /nfs/dbraw/zinc/21/92/68/1427219268.db2.gz JXYVJTMFZDFLPG-UHFFFAOYSA-N 0 0 387.436 3.466 20 5 GGBDRN CC(C)C[C@H]1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000174585268 1427241667 /nfs/dbraw/zinc/24/16/67/1427241667.db2.gz PDVKCWWUKBOYRU-ZIAGYGMSSA-N 0 0 379.482 3.156 20 5 GGBDRN CC(C)C[C@@H]1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000174585255 1427242082 /nfs/dbraw/zinc/24/20/82/1427242082.db2.gz PDVKCWWUKBOYRU-UONOGXRCSA-N 0 0 379.482 3.156 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CC[C@@H](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000174589322 1427244618 /nfs/dbraw/zinc/24/46/18/1427244618.db2.gz JHAGMGRYCMDMLW-LPHOPBHVSA-N 0 0 387.480 3.402 20 5 GGBDRN Cn1c2ccc(F)cc2nc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000174597864 1427248515 /nfs/dbraw/zinc/24/85/15/1427248515.db2.gz DDARTOBXACMXAO-UHFFFAOYSA-N 0 0 383.383 3.473 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCN(C(=O)c2ccccc2O)CC1 ZINC000174611002 1427261018 /nfs/dbraw/zinc/26/10/18/1427261018.db2.gz DKJONVUYZGUDAT-UHFFFAOYSA-N 0 0 399.447 3.046 20 5 GGBDRN O=C(OC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000174616970 1427264279 /nfs/dbraw/zinc/26/42/79/1427264279.db2.gz XTVZKEGVHYQTIO-CQSZACIVSA-N 0 0 388.807 3.454 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3cc(F)ccc3[N+](=O)[O-])n2)c1 ZINC000174645636 1427285006 /nfs/dbraw/zinc/28/50/06/1427285006.db2.gz FPFVKAHDLNTPIS-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000174649982 1427287432 /nfs/dbraw/zinc/28/74/32/1427287432.db2.gz IDCOYTZNYNKZNG-FQEVSTJZSA-N 0 0 389.411 3.083 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3F)n2)c1 ZINC000174650964 1427288515 /nfs/dbraw/zinc/28/85/15/1427288515.db2.gz JXTGQQDGZXCDDH-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN Cc1cc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)ccc1C(F)(F)F ZINC000174669866 1427299363 /nfs/dbraw/zinc/29/93/63/1427299363.db2.gz YMMHSBZGDMZIGJ-UHFFFAOYSA-N 0 0 381.310 3.291 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000174673178 1427301457 /nfs/dbraw/zinc/30/14/57/1427301457.db2.gz JKAXGJNYRZNWQW-UGSOOPFHSA-N 0 0 378.450 3.309 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CSc2nc3c(n2-c2ccccc2)CCCC3)c1 ZINC000174684737 1427308831 /nfs/dbraw/zinc/30/88/31/1427308831.db2.gz SFRBDNXSQMQYNF-INIZCTEOSA-N 0 0 399.476 3.009 20 5 GGBDRN Cc1nn(CCC(=O)OCCCN2CCCc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000174698286 1427316351 /nfs/dbraw/zinc/31/63/51/1427316351.db2.gz LIOXTKAXXGIFGT-UHFFFAOYSA-N 0 0 386.452 3.184 20 5 GGBDRN COc1cc(NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000174698711 1427316980 /nfs/dbraw/zinc/31/69/80/1427316980.db2.gz XBHLTCSNKXGYBU-CYBMUJFWSA-N 0 0 386.326 3.474 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCCS(=O)(=O)c2ccccc2)cc1OC(F)F ZINC000174704018 1427318936 /nfs/dbraw/zinc/31/89/36/1427318936.db2.gz IPFXZFVSDRVOKG-UHFFFAOYSA-N 0 0 386.376 3.472 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1nc(C(C)(C)C)no1 ZINC000174716578 1427327168 /nfs/dbraw/zinc/32/71/68/1427327168.db2.gz VYLNLPBVGSOBFN-LBPRGKRZSA-N 0 0 387.440 3.367 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Oc1cccc2[nH]ccc21 ZINC000174722037 1427331509 /nfs/dbraw/zinc/33/15/09/1427331509.db2.gz WPUNRRVFZMHYDB-UHFFFAOYSA-N 0 0 381.344 3.370 20 5 GGBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174723423 1427332284 /nfs/dbraw/zinc/33/22/84/1427332284.db2.gz CWKFPCPHULXILA-CQSZACIVSA-N 0 0 397.859 3.259 20 5 GGBDRN CN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174725393 1427332981 /nfs/dbraw/zinc/33/29/81/1427332981.db2.gz MJXROQXXOMPLLK-GFCCVEGCSA-N 0 0 383.832 3.330 20 5 GGBDRN CN(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174725813 1427333350 /nfs/dbraw/zinc/33/33/50/1427333350.db2.gz BFOJRKNIJPFTLA-GFCCVEGCSA-N 0 0 383.832 3.330 20 5 GGBDRN CN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174727060 1427333969 /nfs/dbraw/zinc/33/39/69/1427333969.db2.gz KRVKMSOLKLIIFA-ZDUSSCGKSA-N 0 0 383.832 3.330 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1nc(-c2cccc(F)c2)no1 ZINC000174740972 1427342628 /nfs/dbraw/zinc/34/26/28/1427342628.db2.gz MARCUTOEECMCLM-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)ccc1[N+](=O)[O-] ZINC000174742545 1427342982 /nfs/dbraw/zinc/34/29/82/1427342982.db2.gz PYXSLFLWFKDEIP-AWEZNQCLSA-N 0 0 396.403 3.045 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)ccc1[N+](=O)[O-] ZINC000174742387 1427343254 /nfs/dbraw/zinc/34/32/54/1427343254.db2.gz KGWJNPFQUYVVHW-JTQLQIEISA-N 0 0 386.339 3.284 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1c2nsnc2ccc1Cl ZINC000174742313 1427343309 /nfs/dbraw/zinc/34/33/09/1427343309.db2.gz DSIDMKLQSXFSLP-UHFFFAOYSA-N 0 0 384.826 3.362 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CCC[C@H](CC(N)=O)C2)cc1[N+](=O)[O-] ZINC000174742906 1427343669 /nfs/dbraw/zinc/34/36/69/1427343669.db2.gz LHMCNJFTIDGIBR-CQSZACIVSA-N 0 0 393.509 3.461 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccccc1CC(F)(F)F ZINC000174745268 1427344957 /nfs/dbraw/zinc/34/49/57/1427344957.db2.gz OWSKUACPJFERHK-UHFFFAOYSA-N 0 0 395.337 3.297 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(CC(F)(F)F)cc1 ZINC000174745423 1427345205 /nfs/dbraw/zinc/34/52/05/1427345205.db2.gz MOQFSBQWSAOXJE-UHFFFAOYSA-N 0 0 395.337 3.297 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000174749265 1427347311 /nfs/dbraw/zinc/34/73/11/1427347311.db2.gz ARULJHUULLGORD-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1cccc(-n2cccn2)c1 ZINC000174754633 1427349430 /nfs/dbraw/zinc/34/94/30/1427349430.db2.gz ZYFPUMAIHKVRRQ-LBPRGKRZSA-N 0 0 376.376 3.148 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)c([N+](=O)[O-])cc1OC ZINC000174758001 1427351260 /nfs/dbraw/zinc/35/12/60/1427351260.db2.gz QEFXNHQAGDRXGI-ZDUSSCGKSA-N 0 0 396.403 3.289 20 5 GGBDRN CC(C)(C)OC(=O)CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000174768554 1427357450 /nfs/dbraw/zinc/35/74/50/1427357450.db2.gz YOYINOKSIBITMP-UHFFFAOYSA-N 0 0 385.420 3.042 20 5 GGBDRN CCCn1ccc2ccc(NC(=O)C(=O)NCCc3ccc([N+](=O)[O-])cc3)cc21 ZINC000174780324 1427362590 /nfs/dbraw/zinc/36/25/90/1427362590.db2.gz PTTSUOXENVZKEH-UHFFFAOYSA-N 0 0 394.431 3.257 20 5 GGBDRN Cc1cc(NC(=O)C(=O)NCCc2ccc([N+](=O)[O-])cc2)c2cccnc2c1C ZINC000174780238 1427363035 /nfs/dbraw/zinc/36/30/35/1427363035.db2.gz ROKPRTZJYGURID-UHFFFAOYSA-N 0 0 392.415 3.057 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@H](O)COCc3ccccc3Cl)n2)c1 ZINC000174796968 1427374027 /nfs/dbraw/zinc/37/40/27/1427374027.db2.gz BBJHCTLBJPJQDG-INIZCTEOSA-N 0 0 388.811 3.084 20 5 GGBDRN Cc1cc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)ccc1C(F)(F)F ZINC000174799709 1427375300 /nfs/dbraw/zinc/37/53/00/1427375300.db2.gz HHJIQGQPHUQJDS-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1nc([C@@H](C)OCC(C)C)no1 ZINC000174802148 1427377000 /nfs/dbraw/zinc/37/70/00/1427377000.db2.gz ZUPVBIKSHMEEAP-CYBMUJFWSA-N 0 0 376.413 3.292 20 5 GGBDRN CC(C)Nc1ncccc1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174805829 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ZINC000174900221 1427435244 /nfs/dbraw/zinc/43/52/44/1427435244.db2.gz NDWNSWWKCFQAHM-UHFFFAOYSA-N 0 0 396.325 3.236 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000174904433 1427437619 /nfs/dbraw/zinc/43/76/19/1427437619.db2.gz BKNSIQCSLLBVNZ-UHFFFAOYSA-N 0 0 398.463 3.377 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000174912198 1427442607 /nfs/dbraw/zinc/44/26/07/1427442607.db2.gz YKAZLZNOTAUQOP-UHFFFAOYSA-N 0 0 382.464 3.297 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000174913953 1427443513 /nfs/dbraw/zinc/44/35/13/1427443513.db2.gz DBSLIPYECUCNQR-UHFFFAOYSA-N 0 0 398.463 3.134 20 5 GGBDRN CCOc1cc(N[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)ccc1[N+](=O)[O-] ZINC000174915782 1427444261 /nfs/dbraw/zinc/44/42/61/1427444261.db2.gz WHHIXVFTTFNUTR-KRWDZBQOSA-N 0 0 385.420 3.215 20 5 GGBDRN CC[C@H]1Oc2cc([C@@H](C)NC(=O)c3csc([N+](=O)[O-])c3)ccc2NC1=O ZINC000174922142 1427446518 /nfs/dbraw/zinc/44/65/18/1427446518.db2.gz 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O=C([C@@H]1C[C@@]12CCc1ccccc12)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174974878 1427474845 /nfs/dbraw/zinc/47/48/45/1427474845.db2.gz AUCGMOZAEQNJRZ-PGRDOPGGSA-N 0 0 377.444 3.148 20 5 GGBDRN O=C([C@H]1C[C@]12CCc1ccccc12)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174974858 1427475194 /nfs/dbraw/zinc/47/51/94/1427475194.db2.gz AUCGMOZAEQNJRZ-GCJKJVERSA-N 0 0 377.444 3.148 20 5 GGBDRN CC[C@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Oc1ccccc1C ZINC000174988315 1427481734 /nfs/dbraw/zinc/48/17/34/1427481734.db2.gz JUVXVVVJNUFHRK-MRXNPFEDSA-N 0 0 395.419 3.071 20 5 GGBDRN CC(=O)Nc1cc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)ccc1C ZINC000175002874 1427490847 /nfs/dbraw/zinc/49/08/47/1427490847.db2.gz NMKDPKTXGYPEKQ-UHFFFAOYSA-N 0 0 377.422 3.279 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000175002713 1427490901 /nfs/dbraw/zinc/49/09/01/1427490901.db2.gz AUSZROWDNLAMAF-UHFFFAOYSA-N 0 0 391.449 3.071 20 5 GGBDRN 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CCc1nc(C)c([C@H](C)N(C)C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000175038627 1427513335 /nfs/dbraw/zinc/51/33/35/1427513335.db2.gz BBNQUAJTDLZBRY-LBPRGKRZSA-N 0 0 390.465 3.389 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN(CC)CC(=O)Nc1ccccc1OC ZINC000175041133 1427514015 /nfs/dbraw/zinc/51/40/15/1427514015.db2.gz HWMQOCBUYQFNHI-UHFFFAOYSA-N 0 0 387.436 3.463 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000175041762 1427514625 /nfs/dbraw/zinc/51/46/25/1427514625.db2.gz ZYSGYJBRZOEYDD-LBPRGKRZSA-N 0 0 390.465 3.389 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H]2C[C@]23CCc2ccccc23)c([N+](=O)[O-])cc1OC ZINC000175043651 1427516252 /nfs/dbraw/zinc/51/62/52/1427516252.db2.gz GGTHDFIYKLEJMX-JTSKRJEESA-N 0 0 396.443 3.175 20 5 GGBDRN CN(C[C@@H](O)COCc1ccccc1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000175044723 1427516776 /nfs/dbraw/zinc/51/67/76/1427516776.db2.gz CCVILEJWCWWBRB-OAHLLOKOSA-N 0 0 382.363 3.210 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCCCC1 ZINC000175060444 1427524914 /nfs/dbraw/zinc/52/49/14/1427524914.db2.gz DXECSKDNMVFDRO-SNVBAGLBSA-N 0 0 385.367 3.220 20 5 GGBDRN Cc1ccc(N(C)CCCOc2cccc(S(C)(=O)=O)c2)c([N+](=O)[O-])c1 ZINC000175066347 1427528129 /nfs/dbraw/zinc/52/81/29/1427528129.db2.gz FQRUQPOHVHWPGA-UHFFFAOYSA-N 0 0 378.450 3.212 20 5 GGBDRN CC(C)(C)C(=O)Nc1nc(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)cs1 ZINC000175073176 1427531707 /nfs/dbraw/zinc/53/17/07/1427531707.db2.gz IRNGVEMOAJYXEA-UHFFFAOYSA-N 0 0 380.401 3.356 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000175074105 1427532364 /nfs/dbraw/zinc/53/23/64/1427532364.db2.gz ANJOUXPPSKGRIK-GOSISDBHSA-N 0 0 383.448 3.441 20 5 GGBDRN Cc1nn(CCC(=O)N2CCN(CC3CC3)c3ccccc32)c(C)c1[N+](=O)[O-] ZINC000175079838 1427535255 /nfs/dbraw/zinc/53/52/55/1427535255.db2.gz TXVLJJLCRUWYHY-UHFFFAOYSA-N 0 0 383.452 3.061 20 5 GGBDRN O=C(CN1CCC(=O)Nc2cc(F)ccc21)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000175083189 1427536951 /nfs/dbraw/zinc/53/69/51/1427536951.db2.gz 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Cc1ccc([C@@H](C)NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000175115101 1427553808 /nfs/dbraw/zinc/55/38/08/1427553808.db2.gz SPUOTFCUPUAABA-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1[N+](=O)[O-] ZINC000175116318 1427554527 /nfs/dbraw/zinc/55/45/27/1427554527.db2.gz NOOQHNIYMOSKFL-GFCCVEGCSA-N 0 0 379.394 3.159 20 5 GGBDRN CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Oc1cc([N+](=O)[O-])ccc1C ZINC000175120563 1427557916 /nfs/dbraw/zinc/55/79/16/1427557916.db2.gz PCOPDSAOSGWRDH-SFHVURJKSA-N 0 0 399.378 3.176 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCCCC2)c(-c2nnn[n-]2)c1 ZINC000823640262 1427558423 /nfs/dbraw/zinc/55/84/23/1427558423.db2.gz ZGAMOMCIQNDLSB-UHFFFAOYSA-N 0 0 393.451 3.373 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCN(C(=O)C2CCCCC2)CC1 ZINC000175131683 1427561998 /nfs/dbraw/zinc/56/19/98/1427561998.db2.gz RYNAZHZBWWBYLF-UHFFFAOYSA-N 0 0 375.469 3.218 20 5 GGBDRN Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)COc1ncc(C)cc1[N+](=O)[O-] ZINC000175137266 1427564238 /nfs/dbraw/zinc/56/42/38/1427564238.db2.gz HVJJAPNYEJAKML-UHFFFAOYSA-N 0 0 395.419 3.427 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000175151420 1427570134 /nfs/dbraw/zinc/57/01/34/1427570134.db2.gz VPHWUAMFRMDLPN-AWEZNQCLSA-N 0 0 379.457 3.340 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCSC2(CCCCC2)C1 ZINC000175153126 1427570806 /nfs/dbraw/zinc/57/08/06/1427570806.db2.gz XTBPDJLSPGSKGR-UHFFFAOYSA-N 0 0 387.461 3.328 20 5 GGBDRN C[C@@H](C(=O)OCCNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000175162117 1427575287 /nfs/dbraw/zinc/57/52/87/1427575287.db2.gz VAIDZLSNZWUITE-SECBINFHSA-N 0 0 397.840 3.167 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC(C)(C)c1ccc(F)c(F)c1 ZINC000175164811 1427576678 /nfs/dbraw/zinc/57/66/78/1427576678.db2.gz QDNNJBHNSWWJMF-NSHDSACASA-N 0 0 391.374 3.043 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000175170476 1427579681 /nfs/dbraw/zinc/57/96/81/1427579681.db2.gz BSUBJIKTFQKCQL-UHFFFAOYSA-N 0 0 397.479 3.438 20 5 GGBDRN COc1cc(CCNC(=O)N(C2CC2)C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000175211570 1427604221 /nfs/dbraw/zinc/60/42/21/1427604221.db2.gz VTSDXXUDAUYIQO-UHFFFAOYSA-N 0 0 377.441 3.271 20 5 GGBDRN O=C(CCC1CCC1)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000175226136 1427612882 /nfs/dbraw/zinc/61/28/82/1427612882.db2.gz QNPZJRKGUNKUKH-UHFFFAOYSA-N 0 0 395.462 3.403 20 5 GGBDRN CCN(CC)C(=O)c1ccc(OC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000175236115 1427618157 /nfs/dbraw/zinc/61/81/57/1427618157.db2.gz TTWQESWFFXZZNT-UHFFFAOYSA-N 0 0 385.420 3.119 20 5 GGBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000175248844 1427624874 /nfs/dbraw/zinc/62/48/74/1427624874.db2.gz RLJHLCMESIZEHO-TZMCWYRMSA-N 0 0 399.900 3.159 20 5 GGBDRN CCS[C@H]1CCCC[C@H]1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000175248857 1427624893 /nfs/dbraw/zinc/62/48/93/1427624893.db2.gz RLJHLCMESIZEHO-OCCSQVGLSA-N 0 0 399.900 3.159 20 5 GGBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000175248830 1427625036 /nfs/dbraw/zinc/62/50/36/1427625036.db2.gz RLJHLCMESIZEHO-JSGCOSHPSA-N 0 0 399.900 3.159 20 5 GGBDRN O=[N+]([O-])c1ccc2oc(=S)n(CN3CCC(OC[C@@H]4CCCO4)CC3)c2c1 ZINC000175251675 1427626409 /nfs/dbraw/zinc/62/64/09/1427626409.db2.gz NNTGQEABYKZXMZ-HNNXBMFYSA-N 0 0 393.465 3.489 20 5 GGBDRN Cc1ccc(S(=O)(=O)Oc2cc(N(C)C)ccc2[N+](=O)[O-])c2cccnc12 ZINC000175262570 1427632455 /nfs/dbraw/zinc/63/24/55/1427632455.db2.gz OCPUKVYFQWCOBJ-UHFFFAOYSA-N 0 0 387.417 3.285 20 5 GGBDRN O=C(NCCc1ccn(-c2ccc(F)cc2)n1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000175270688 1427638591 /nfs/dbraw/zinc/63/85/91/1427638591.db2.gz HLSGGCGWEJBRDE-UHFFFAOYSA-N 0 0 390.321 3.170 20 5 GGBDRN CC(C)[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1cccnc1 ZINC000175274615 1427640937 /nfs/dbraw/zinc/64/09/37/1427640937.db2.gz FKQJBRMKBIYRCS-IBGZPJMESA-N 0 0 379.420 3.345 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N(CCc2ccccc2)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000175282044 1427645923 /nfs/dbraw/zinc/64/59/23/1427645923.db2.gz UYVBUTSWTGFGHL-QGZVFWFLSA-N 0 0 399.403 3.285 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](OC)c1cccc(Cl)c1 ZINC000175290092 1427650342 /nfs/dbraw/zinc/65/03/42/1427650342.db2.gz JSDVDAJSEFAWTA-KRWDZBQOSA-N 0 0 393.827 3.444 20 5 GGBDRN COc1ccc(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000175293457 1427651667 /nfs/dbraw/zinc/65/16/67/1427651667.db2.gz IZZRHAQJVANBMK-UHFFFAOYSA-N 0 0 387.436 3.389 20 5 GGBDRN CC(C)(NC(=O)NCCc1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000175298366 1427656379 /nfs/dbraw/zinc/65/63/79/1427656379.db2.gz WESVTYVFZMRHEV-UHFFFAOYSA-N 0 0 385.420 3.143 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(N2CCC(O)CC2)cc1 ZINC000175305911 1427663954 /nfs/dbraw/zinc/66/39/54/1427663954.db2.gz NSOBLZCRXBJQQY-UHFFFAOYSA-N 0 0 398.463 3.387 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000175313130 1427669858 /nfs/dbraw/zinc/66/98/58/1427669858.db2.gz NWGSZZRQMABFOY-GFCCVEGCSA-N 0 0 382.376 3.068 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(OS(=O)(=O)c2cnn(-c3ccccc3)c2)c1 ZINC000175321619 1427676436 /nfs/dbraw/zinc/67/64/36/1427676436.db2.gz SZAUUIXYWZXXSL-UHFFFAOYSA-N 0 0 379.781 3.202 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1nc(Cc2ccccc2)no1 ZINC000175322250 1427677798 /nfs/dbraw/zinc/67/77/98/1427677798.db2.gz WMMZSPAAABFCGQ-AWEZNQCLSA-N 0 0 396.403 3.215 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1ccccc1-n1ccnc1 ZINC000175324832 1427679119 /nfs/dbraw/zinc/67/91/19/1427679119.db2.gz VGCORFVYXYIZRP-UHFFFAOYSA-N 0 0 379.420 3.289 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000175331136 1427684365 /nfs/dbraw/zinc/68/43/65/1427684365.db2.gz MZRWDHBYWZVQRI-INIZCTEOSA-N 0 0 378.388 3.244 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2cc3ccccc3o2)c([N+](=O)[O-])c1 ZINC000175366157 1427709781 /nfs/dbraw/zinc/70/97/81/1427709781.db2.gz OGDYOSNVELIGSK-UHFFFAOYSA-N 0 0 376.390 3.170 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1C(=O)N(C)C ZINC000175365824 1427709793 /nfs/dbraw/zinc/70/97/93/1427709793.db2.gz DGXLLKKMQATHBS-UHFFFAOYSA-N 0 0 386.364 3.074 20 5 GGBDRN C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Oc2cccc(-c3nnn[n-]3)c2)CC1 ZINC000736204565 1427715500 /nfs/dbraw/zinc/71/55/00/1427715500.db2.gz RSCNIKAABRWNBZ-CQSZACIVSA-N 0 0 394.435 3.379 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)N(CC2CC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000175377800 1427718791 /nfs/dbraw/zinc/71/87/91/1427718791.db2.gz PDUKJZSBWQNAFN-UHFFFAOYSA-N 0 0 385.445 3.229 20 5 GGBDRN COCCOc1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175385096 1427722910 /nfs/dbraw/zinc/72/29/10/1427722910.db2.gz JHPULEADSUNIFG-UHFFFAOYSA-N 0 0 387.436 3.355 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cccc(NC(=O)C2CCCCC2)c1 ZINC000175389114 1427725795 /nfs/dbraw/zinc/72/57/95/1427725795.db2.gz KEMGSWFINXZONK-UHFFFAOYSA-N 0 0 385.424 3.339 20 5 GGBDRN CCOc1cc(C(=O)Nc2ccnn2-c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000175388705 1427725832 /nfs/dbraw/zinc/72/58/32/1427725832.db2.gz MUTICZIDVGRTFY-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)N(CC1CCC1)c1ccccc1 ZINC000175397747 1427731477 /nfs/dbraw/zinc/73/14/77/1427731477.db2.gz XYCWZULEABCETF-UHFFFAOYSA-N 0 0 393.399 3.024 20 5 GGBDRN COc1cccc([C@H](C)CC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000175425566 1427747424 /nfs/dbraw/zinc/74/74/24/1427747424.db2.gz OZXZXFRUVHUSGM-GDBMZVCRSA-N 0 0 384.436 3.205 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000175425483 1427747692 /nfs/dbraw/zinc/74/76/92/1427747692.db2.gz UHMZKDBABQIVSD-SHZVTRLKSA-N 0 0 396.490 3.022 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175429563 1427750869 /nfs/dbraw/zinc/75/08/69/1427750869.db2.gz VYQHWJZBLWBCKP-UHFFFAOYSA-N 0 0 388.380 3.246 20 5 GGBDRN CCC(CC)[C@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])N1CCOCC1 ZINC000175431260 1427751260 /nfs/dbraw/zinc/75/12/60/1427751260.db2.gz NGQXWEHPFPHSGJ-INIZCTEOSA-N 0 0 383.876 3.115 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000175438741 1427754972 /nfs/dbraw/zinc/75/49/72/1427754972.db2.gz GKBCTLGLYIPYCH-IAGOWNOFSA-N 0 0 389.477 3.497 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175440633 1427756341 /nfs/dbraw/zinc/75/63/41/1427756341.db2.gz OGXKYWSHRJXOGC-CYBMUJFWSA-N 0 0 395.375 3.488 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175440616 1427756514 /nfs/dbraw/zinc/75/65/14/1427756514.db2.gz OGXKYWSHRJXOGC-ZDUSSCGKSA-N 0 0 395.375 3.488 20 5 GGBDRN COc1cc(CN2CCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc(OC)c1 ZINC000175445172 1427758545 /nfs/dbraw/zinc/75/85/45/1427758545.db2.gz DCRMRQOQHIXICI-UHFFFAOYSA-N 0 0 389.427 3.069 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175448323 1427760359 /nfs/dbraw/zinc/76/03/59/1427760359.db2.gz NZMVCMXPFZMUHV-UHFFFAOYSA-N 0 0 398.463 3.178 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)cc1[N+](=O)[O-] ZINC000175459708 1427766476 /nfs/dbraw/zinc/76/64/76/1427766476.db2.gz HJXMIWCPUWMKSM-IIBYNOLFSA-N 0 0 397.475 3.278 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000175461393 1427767494 /nfs/dbraw/zinc/76/74/94/1427767494.db2.gz KIMFFHDOPTZGML-UHFFFAOYSA-N 0 0 383.795 3.163 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000175471103 1427773248 /nfs/dbraw/zinc/77/32/48/1427773248.db2.gz SSCDLXYGFKDZHE-UHFFFAOYSA-N 0 0 384.436 3.330 20 5 GGBDRN CC(C)(NC(=O)NCc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000175494978 1427788702 /nfs/dbraw/zinc/78/87/02/1427788702.db2.gz DPPQSVPLUBADBE-UHFFFAOYSA-N 0 0 385.420 3.491 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)cc1 ZINC000175496661 1427789516 /nfs/dbraw/zinc/78/95/16/1427789516.db2.gz ZOPFPCNWJAIUBK-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN Cc1ccccc1Cc1noc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000175523851 1427803314 /nfs/dbraw/zinc/80/33/14/1427803314.db2.gz SKOCHCGQJAPPNB-UHFFFAOYSA-N 0 0 393.447 3.199 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000175529609 1427805182 /nfs/dbraw/zinc/80/51/82/1427805182.db2.gz GVDJOOFUFBTXSZ-QFIPXVFZSA-N 0 0 383.223 3.347 20 5 GGBDRN C[C@@H](NC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000175539150 1427808780 /nfs/dbraw/zinc/80/87/80/1427808780.db2.gz BMRKRZDLOOGUBC-OXQOHEQNSA-N 0 0 383.448 3.063 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)n2)c1 ZINC000175545811 1427810353 /nfs/dbraw/zinc/81/03/53/1427810353.db2.gz XDWVNFFIQQCQDC-NSHDSACASA-N 0 0 397.391 3.035 20 5 GGBDRN CN(C)C(=O)c1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000175544662 1427810478 /nfs/dbraw/zinc/81/04/78/1427810478.db2.gz RAXNGHVGLWNRRP-UHFFFAOYSA-N 0 0 379.775 3.270 20 5 GGBDRN O=C(NCCOCc1ccccc1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000175545374 1427810482 /nfs/dbraw/zinc/81/04/82/1427810482.db2.gz JQGCSPGWONOVEL-UHFFFAOYSA-N 0 0 379.210 3.304 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)n2)c1 ZINC000175545829 1427810721 /nfs/dbraw/zinc/81/07/21/1427810721.db2.gz XDWVNFFIQQCQDC-LLVKDONJSA-N 0 0 397.391 3.035 20 5 GGBDRN CC(C)(NC(=O)NCC[S@@](=O)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000175549008 1427811500 /nfs/dbraw/zinc/81/15/00/1427811500.db2.gz UDLYPTAVLYEGFK-HHHXNRCGSA-N 0 0 389.477 3.078 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000175550823 1427812018 /nfs/dbraw/zinc/81/20/18/1427812018.db2.gz HWHUINKARXWWBW-QDXKXIGTSA-N 0 0 376.434 3.174 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)nc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175570596 1427818703 /nfs/dbraw/zinc/81/87/03/1427818703.db2.gz SHBNLGLZFNLAKV-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCCN2CCCCCC2=O)cc1[N+](=O)[O-] ZINC000175581966 1427821534 /nfs/dbraw/zinc/82/15/34/1427821534.db2.gz DLYANZZKQZIHCY-HNNXBMFYSA-N 0 0 376.457 3.056 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)c(N)c([N+](=O)[O-])c1 ZINC000175601661 1427828229 /nfs/dbraw/zinc/82/82/29/1427828229.db2.gz UVAXLWJPKSWWDB-JTQLQIEISA-N 0 0 385.355 3.166 20 5 GGBDRN O=C(Nc1cccc(OCCn2cncn2)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175610469 1427831052 /nfs/dbraw/zinc/83/10/52/1427831052.db2.gz AOWRBTZPEGZGLJ-UHFFFAOYSA-N 0 0 387.783 3.171 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccc([S@@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000175621060 1427834800 /nfs/dbraw/zinc/83/48/00/1427834800.db2.gz QSASNVVKWARDQC-ZBSNKRKSSA-N 0 0 375.450 3.201 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000175624549 1427836285 /nfs/dbraw/zinc/83/62/85/1427836285.db2.gz PGXBTDLRCNMSHC-GSLFCAENSA-N 0 0 381.498 3.209 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccc(Cn3cncn3)cc2)cc1[N+](=O)[O-] ZINC000175661655 1427848408 /nfs/dbraw/zinc/84/84/08/1427848408.db2.gz VVDZGNWZXLXRPX-HNNXBMFYSA-N 0 0 394.435 3.103 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccc(Cn3cncn3)cc2)cc1[N+](=O)[O-] ZINC000175661633 1427848457 /nfs/dbraw/zinc/84/84/57/1427848457.db2.gz VVDZGNWZXLXRPX-OAHLLOKOSA-N 0 0 394.435 3.103 20 5 GGBDRN CCC1(CNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)CCC1 ZINC000175668470 1427850623 /nfs/dbraw/zinc/85/06/23/1427850623.db2.gz JNCRMMWCZSMNBU-UHFFFAOYSA-N 0 0 375.454 3.185 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@H](C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)C2)cc1 ZINC000175672427 1427852110 /nfs/dbraw/zinc/85/21/10/1427852110.db2.gz MGQNWTPJGDMGRQ-INIZCTEOSA-N 0 0 382.420 3.098 20 5 GGBDRN Cc1ccc(C(=O)N2CCC[C@@H](C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)C2)cc1 ZINC000175672445 1427852214 /nfs/dbraw/zinc/85/22/14/1427852214.db2.gz MGQNWTPJGDMGRQ-MRXNPFEDSA-N 0 0 382.420 3.098 20 5 GGBDRN Cc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1[N+](=O)[O-] ZINC000175677056 1427853335 /nfs/dbraw/zinc/85/33/35/1427853335.db2.gz HYYFIIAUUDFMDL-UHFFFAOYSA-N 0 0 385.380 3.449 20 5 GGBDRN Cc1nc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)ccc1[N+](=O)[O-] ZINC000175681604 1427855316 /nfs/dbraw/zinc/85/53/16/1427855316.db2.gz ZRDXZYOOYDGCEE-UHFFFAOYSA-N 0 0 381.142 3.221 20 5 GGBDRN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000175686363 1427857288 /nfs/dbraw/zinc/85/72/88/1427857288.db2.gz ICIOCAPPTDGBSF-XJKSGUPXSA-N 0 0 399.472 3.190 20 5 GGBDRN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000175693354 1427860712 /nfs/dbraw/zinc/86/07/12/1427860712.db2.gz IMGALZNIFNHYKN-FZKQIMNGSA-N 0 0 388.445 3.017 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NC[C@H](CC(C)C)N2CCOCC2)cc1[N+](=O)[O-] ZINC000175695226 1427861378 /nfs/dbraw/zinc/86/13/78/1427861378.db2.gz QBTAOFCCBWSHKW-WMZOPIPTSA-N 0 0 392.500 3.010 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000175697122 1427861946 /nfs/dbraw/zinc/86/19/46/1427861946.db2.gz GMHKMOKZKPYAIF-WDEREUQCSA-N 0 0 393.802 3.383 20 5 GGBDRN C[C@@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1c(F)cccc1Cl ZINC000175697639 1427862043 /nfs/dbraw/zinc/86/20/43/1427862043.db2.gz ILSIWVQJOWVYED-SNVBAGLBSA-N 0 0 380.759 3.456 20 5 GGBDRN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000175713414 1427867458 /nfs/dbraw/zinc/86/74/58/1427867458.db2.gz KRBLGXNMECJBJX-RHSMWYFYSA-N 0 0 377.404 3.194 20 5 GGBDRN C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175730010 1427871898 /nfs/dbraw/zinc/87/18/98/1427871898.db2.gz XXKQDEZTJQTQOZ-NSHDSACASA-N 0 0 396.852 3.485 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000175734027 1427873281 /nfs/dbraw/zinc/87/32/81/1427873281.db2.gz ABUCVUFGFCSVGD-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN Cc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000175734449 1427873300 /nfs/dbraw/zinc/87/33/00/1427873300.db2.gz WGBMGDIHYQXGNJ-KBXCAEBGSA-N 0 0 382.420 3.069 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1ccccc1[N+](=O)[O-] ZINC000175735338 1427873468 /nfs/dbraw/zinc/87/34/68/1427873468.db2.gz HENVYRLGUWPARP-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175735872 1427874006 /nfs/dbraw/zinc/87/40/06/1427874006.db2.gz OJTKYSZMNOQASY-UHFFFAOYSA-N 0 0 394.836 3.245 20 5 GGBDRN C[C@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1noc(Cc2ccccc2)n1 ZINC000175737566 1427874704 /nfs/dbraw/zinc/87/47/04/1427874704.db2.gz GVWWNKKFQDASPU-AWEZNQCLSA-N 0 0 395.419 3.471 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000175738642 1427875117 /nfs/dbraw/zinc/87/51/17/1427875117.db2.gz OSFMAURQFWXLMR-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN Cc1ccccc1CCCOc1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000175745867 1427877654 /nfs/dbraw/zinc/87/76/54/1427877654.db2.gz FMEABLOVIGEODJ-UHFFFAOYSA-N 0 0 394.405 3.227 20 5 GGBDRN CN1C(=O)COc2ccc(NC(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)cc21 ZINC000175750441 1427878319 /nfs/dbraw/zinc/87/83/19/1427878319.db2.gz NVJPEODUGMQPQC-UHFFFAOYSA-N 0 0 383.404 3.500 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1NCC1(CCO)CCCCC1 ZINC000175760764 1427882029 /nfs/dbraw/zinc/88/20/29/1427882029.db2.gz YARYEBBWIJGCRX-UHFFFAOYSA-N 0 0 392.424 3.336 20 5 GGBDRN Cc1ccc2c(c1)N(C(=O)c1cc(=O)[nH]c3ccc([N+](=O)[O-])cc31)C[C@H](C)O2 ZINC000175776097 1427888214 /nfs/dbraw/zinc/88/82/14/1427888214.db2.gz JKDNOYRCCFECNE-LBPRGKRZSA-N 0 0 379.372 3.172 20 5 GGBDRN O=C(NCCc1ccn(-c2ccc(F)cc2)n1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000175799971 1427897513 /nfs/dbraw/zinc/89/75/13/1427897513.db2.gz VMXUKRJNTMBNMU-UHFFFAOYSA-N 0 0 397.410 3.004 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(OC(F)(F)F)c1 ZINC000175803180 1427898657 /nfs/dbraw/zinc/89/86/57/1427898657.db2.gz BSVYGLYLYYCYEL-SNVBAGLBSA-N 0 0 397.309 3.309 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(OC(F)(F)F)c1 ZINC000175803161 1427898811 /nfs/dbraw/zinc/89/88/11/1427898811.db2.gz BSVYGLYLYYCYEL-JTQLQIEISA-N 0 0 397.309 3.309 20 5 GGBDRN Cc1cc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n(-c2ccc(C)nn2)n1 ZINC000175808815 1427902381 /nfs/dbraw/zinc/90/23/81/1427902381.db2.gz SZZDBDAKXJBNLD-CYBMUJFWSA-N 0 0 398.448 3.307 20 5 GGBDRN C[C@@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@H](C)C1CCCCC1 ZINC000175813808 1427905406 /nfs/dbraw/zinc/90/54/06/1427905406.db2.gz FIQNRQIKAYKCLW-QWHCGFSZSA-N 0 0 375.425 3.224 20 5 GGBDRN O=C(CN1CCC[C@H]1C[C@H](O)c1cccs1)Nc1ccccc1[N+](=O)[O-] ZINC000175827884 1427914835 /nfs/dbraw/zinc/91/48/35/1427914835.db2.gz YZAMGJLKDUAKIW-BBRMVZONSA-N 0 0 375.450 3.183 20 5 GGBDRN O=C(CN1CCC[C@@H]1C[C@H](O)c1cccs1)Nc1ccccc1[N+](=O)[O-] ZINC000175827862 1427914947 /nfs/dbraw/zinc/91/49/47/1427914947.db2.gz YZAMGJLKDUAKIW-CJNGLKHVSA-N 0 0 375.450 3.183 20 5 GGBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000175850620 1427931386 /nfs/dbraw/zinc/93/13/86/1427931386.db2.gz IWXNKPWPNFNECV-KPZWWZAWSA-N 0 0 378.425 3.477 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCCN(C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000175859123 1427936867 /nfs/dbraw/zinc/93/68/67/1427936867.db2.gz LPQCRMIKUJAUCV-GFCCVEGCSA-N 0 0 376.379 3.148 20 5 GGBDRN COC(=O)c1cc(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000175873334 1427945631 /nfs/dbraw/zinc/94/56/31/1427945631.db2.gz IWKQOECMYPPFPX-NSHDSACASA-N 0 0 375.381 3.152 20 5 GGBDRN CCOc1cc(C(=O)N(C)Cc2ncc(CC)s2)c([N+](=O)[O-])cc1OC ZINC000175890346 1427953777 /nfs/dbraw/zinc/95/37/77/1427953777.db2.gz SGMUPUSPCGODCJ-UHFFFAOYSA-N 0 0 379.438 3.293 20 5 GGBDRN Cc1ccc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000175892532 1427954740 /nfs/dbraw/zinc/95/47/40/1427954740.db2.gz FXXHUIXRSSWOFQ-UHFFFAOYSA-N 0 0 379.394 3.025 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)CCNC(=O)c1csc([N+](=O)[O-])c1 ZINC000175906868 1427964486 /nfs/dbraw/zinc/96/44/86/1427964486.db2.gz PULMJJSRSMXPFN-UHFFFAOYSA-N 0 0 397.840 3.385 20 5 GGBDRN O=C(NC[C@H](CCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000175919860 1427971932 /nfs/dbraw/zinc/97/19/32/1427971932.db2.gz XAQYCMAXMYVHLI-KRWDZBQOSA-N 0 0 383.448 3.091 20 5 GGBDRN O=C(NC[C@@H](CCO)c1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000175920503 1427972776 /nfs/dbraw/zinc/97/27/76/1427972776.db2.gz HAKCFNJYZJSJOI-GOSISDBHSA-N 0 0 383.448 3.091 20 5 GGBDRN O=C(NC[C@H](CCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000175926365 1427976805 /nfs/dbraw/zinc/97/68/05/1427976805.db2.gz BVTINFRYLNPVLL-SFHVURJKSA-N 0 0 397.475 3.481 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCC(=O)NC2CCCCC2)cc1[N+](=O)[O-] ZINC000175940909 1427985888 /nfs/dbraw/zinc/98/58/88/1427985888.db2.gz ORVVSZYMOIXHIG-CQSZACIVSA-N 0 0 376.457 3.102 20 5 GGBDRN C[C@@H](Sc1nnc2n(C)c3ccccc3n12)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000175947670 1427989598 /nfs/dbraw/zinc/98/95/98/1427989598.db2.gz XHGRFBYIBHFWSE-LLVKDONJSA-N 0 0 396.432 3.249 20 5 GGBDRN COc1cc(CCNC(=O)c2cc(C)c(F)cc2F)c([N+](=O)[O-])cc1OC ZINC000175954975 1427995596 /nfs/dbraw/zinc/99/55/96/1427995596.db2.gz IEZKQXTWFIDNFM-UHFFFAOYSA-N 0 0 380.347 3.171 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175957722 1427997487 /nfs/dbraw/zinc/99/74/87/1427997487.db2.gz RGPDIOOFBCZFST-CHWSQXEVSA-N 0 0 381.860 3.405 20 5 GGBDRN C[C@@H](NC(=O)CNC(=O)c1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000175962121 1428000726 /nfs/dbraw/zinc/00/07/26/1428000726.db2.gz WWITUEAWCHDIFI-LLVKDONJSA-N 0 0 395.337 3.221 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCN2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000175962639 1428000733 /nfs/dbraw/zinc/00/07/33/1428000733.db2.gz XCOHCILDMJQVBO-CQSZACIVSA-N 0 0 388.493 3.383 20 5 GGBDRN Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000175973468 1428007073 /nfs/dbraw/zinc/00/70/73/1428007073.db2.gz AMYXHQPICQGUFC-UHFFFAOYSA-N 0 0 381.310 3.177 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000175975715 1428008667 /nfs/dbraw/zinc/00/86/67/1428008667.db2.gz YBJPNBNLBPWBGF-UHFFFAOYSA-N 0 0 397.479 3.438 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)CC2)nc(C)n1 ZINC000175981870 1428011527 /nfs/dbraw/zinc/01/15/27/1428011527.db2.gz QOKGUTQMNZOJLL-UHFFFAOYSA-N 0 0 389.843 3.054 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1 ZINC000175986732 1428013624 /nfs/dbraw/zinc/01/36/24/1428013624.db2.gz WUACQUUBUUERSM-OKILXGFUSA-N 0 0 384.436 3.473 20 5 GGBDRN COc1ccc(-n2nnc(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)c2C)cc1 ZINC000175986014 1428014046 /nfs/dbraw/zinc/01/40/46/1428014046.db2.gz ITPPONUYGHGXDW-UHFFFAOYSA-N 0 0 381.392 3.362 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCC(=O)N2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000175989007 1428015053 /nfs/dbraw/zinc/01/50/53/1428015053.db2.gz WNVOQTBMEUWZEC-HNNXBMFYSA-N 0 0 396.447 3.243 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000176015193 1428028516 /nfs/dbraw/zinc/02/85/16/1428028516.db2.gz NRYHTLGDTJGGPI-LLVKDONJSA-N 0 0 383.832 3.235 20 5 GGBDRN Nc1c(C(=O)Nc2cc(F)ccc2NC(=O)c2ccccn2)cccc1[N+](=O)[O-] ZINC000176020148 1428030933 /nfs/dbraw/zinc/03/09/33/1428030933.db2.gz CRQAOGKASBPAOE-UHFFFAOYSA-N 0 0 395.350 3.216 20 5 GGBDRN C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)c1nc2ccc(Cl)cc2n1C ZINC000176029941 1428035557 /nfs/dbraw/zinc/03/55/57/1428035557.db2.gz HEVXQHZBCUXSCR-SNVBAGLBSA-N 0 0 377.788 3.026 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H](C)c1nc2ccc(Cl)cc2n1C ZINC000176032150 1428037117 /nfs/dbraw/zinc/03/71/17/1428037117.db2.gz NSYZHQWIUHPXDR-JTQLQIEISA-N 0 0 391.815 3.334 20 5 GGBDRN C[C@H]1CN(Cc2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2N)C[C@H](C)O1 ZINC000176034488 1428037550 /nfs/dbraw/zinc/03/75/50/1428037550.db2.gz ZTMLHALPUHPIPF-KBPBESRZSA-N 0 0 384.436 3.039 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2N)C[C@@H](C)O1 ZINC000176034503 1428037896 /nfs/dbraw/zinc/03/78/96/1428037896.db2.gz ZTMLHALPUHPIPF-ZIAGYGMSSA-N 0 0 384.436 3.039 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCCNC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000176051074 1428051520 /nfs/dbraw/zinc/05/15/20/1428051520.db2.gz ZGVQTMKINVJTRB-CYBMUJFWSA-N 0 0 390.465 3.145 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(OC(F)F)cc1 ZINC000176058062 1428057358 /nfs/dbraw/zinc/05/73/58/1428057358.db2.gz PJFJCDYOHINVFU-UHFFFAOYSA-N 0 0 390.339 3.122 20 5 GGBDRN O=C(NC[C@H]1CSCCS1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000176059640 1428059355 /nfs/dbraw/zinc/05/93/55/1428059355.db2.gz QKIWWXHAXAXPFT-AWEZNQCLSA-N 0 0 381.523 3.164 20 5 GGBDRN C[C@@H](O)CC(C)(C)CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000176083325 1428072796 /nfs/dbraw/zinc/07/27/96/1428072796.db2.gz QZEZSYGXOPJJIZ-LLVKDONJSA-N 0 0 391.390 3.329 20 5 GGBDRN Cc1ccc(N2CCC[C@@H](NC(=O)N(C)Cc3ccccc3[N+](=O)[O-])C2=O)cc1 ZINC000176088735 1428075834 /nfs/dbraw/zinc/07/58/34/1428075834.db2.gz XGQPULCBIFMRGY-GOSISDBHSA-N 0 0 396.447 3.240 20 5 GGBDRN O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000176089359 1428076320 /nfs/dbraw/zinc/07/63/20/1428076320.db2.gz ZUQXUNJAEQGBPA-CYBMUJFWSA-N 0 0 394.214 3.437 20 5 GGBDRN O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000176089719 1428076353 /nfs/dbraw/zinc/07/63/53/1428076353.db2.gz QWMGZRWKPRNATB-CQSZACIVSA-N 0 0 395.749 3.062 20 5 GGBDRN COc1cc(OCC(=O)N2C[C@H](C(C)C)Nc3ccccc32)ccc1[N+](=O)[O-] ZINC000176094010 1428078969 /nfs/dbraw/zinc/07/89/69/1428078969.db2.gz VDNOISHESSFDCC-MRXNPFEDSA-N 0 0 385.420 3.466 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(-c2ccncc2)cc1 ZINC000176109809 1428088325 /nfs/dbraw/zinc/08/83/25/1428088325.db2.gz MOLLACWQCYPWDB-CQSZACIVSA-N 0 0 390.399 3.473 20 5 GGBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000176110077 1428088637 /nfs/dbraw/zinc/08/86/37/1428088637.db2.gz ATDPWJWITYFBTA-CYBMUJFWSA-N 0 0 384.379 3.063 20 5 GGBDRN COCCOc1cc(C)ccc1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000176114045 1428090468 /nfs/dbraw/zinc/09/04/68/1428090468.db2.gz QPZXNPBKAMSQNX-UHFFFAOYSA-N 0 0 387.436 3.270 20 5 GGBDRN COc1ccccc1C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000176131352 1428105584 /nfs/dbraw/zinc/10/55/84/1428105584.db2.gz NRLHGUHXWJMVEH-KRWDZBQOSA-N 0 0 399.447 3.234 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H]1CCCCC1=O ZINC000176157127 1428125958 /nfs/dbraw/zinc/12/59/58/1428125958.db2.gz VLKRPDWOMBSGEQ-JKSUJKDBSA-N 0 0 382.420 3.144 20 5 GGBDRN Cc1ccc(C(=O)OC[C@@H]2CC(=O)N(CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176169964 1428136317 /nfs/dbraw/zinc/13/63/17/1428136317.db2.gz IEOIONOOQQGNJH-QGZVFWFLSA-N 0 0 382.416 3.151 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000176178192 1428143402 /nfs/dbraw/zinc/14/34/02/1428143402.db2.gz SXCHZSAAIJEAGY-LJQANCHMSA-N 0 0 380.400 3.493 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000176179866 1428144534 /nfs/dbraw/zinc/14/45/34/1428144534.db2.gz ZITRJQPEIUJPMP-SFHVURJKSA-N 0 0 396.399 3.329 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2CC(=O)N(CCc3ccccc3)C2)c1 ZINC000176182380 1428146447 /nfs/dbraw/zinc/14/64/47/1428146447.db2.gz LQFGUYHPKIVHTC-QGZVFWFLSA-N 0 0 382.416 3.151 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N(CC1CC1)c1ccccc1 ZINC000176205191 1428166453 /nfs/dbraw/zinc/16/64/53/1428166453.db2.gz GUQGPEMUKLEFBS-UHFFFAOYSA-N 0 0 387.823 3.421 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000176208624 1428168395 /nfs/dbraw/zinc/16/83/95/1428168395.db2.gz FYDSEHZKUXYBGR-MRXNPFEDSA-N 0 0 377.441 3.043 20 5 GGBDRN O=C(C[C@H]1CCCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000176215110 1428172325 /nfs/dbraw/zinc/17/23/25/1428172325.db2.gz ANTVGCPLJPVQPR-LLVKDONJSA-N 0 0 384.417 3.410 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccccc1C(=O)NC[C@H]1CCCO1 ZINC000176221500 1428175871 /nfs/dbraw/zinc/17/58/71/1428175871.db2.gz ZWAJVNUPZPGYBV-QGZVFWFLSA-N 0 0 397.431 3.075 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000176228432 1428179952 /nfs/dbraw/zinc/17/99/52/1428179952.db2.gz XOQJWUMQOIOXQS-XJKSGUPXSA-N 0 0 376.434 3.150 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H](C)c2nnnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000176237423 1428184952 /nfs/dbraw/zinc/18/49/52/1428184952.db2.gz ZPVSCEQYMSYBFY-KBPBESRZSA-N 0 0 395.423 3.000 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000176240504 1428187902 /nfs/dbraw/zinc/18/79/02/1428187902.db2.gz PRBVORUBRWVVIC-HHHXNRCGSA-N 0 0 394.424 3.190 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000176240897 1428188110 /nfs/dbraw/zinc/18/81/10/1428188110.db2.gz GLOTYBSIUZIVGV-GOEBONIOSA-N 0 0 376.434 3.150 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000176245722 1428192653 /nfs/dbraw/zinc/19/26/53/1428192653.db2.gz GWIKGLCSEJBQCZ-KRWDZBQOSA-N 0 0 381.432 3.405 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCC[S@@](=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000176248338 1428194700 /nfs/dbraw/zinc/19/47/00/1428194700.db2.gz ICBZRIRDTMJQRV-KUNJGFBQSA-N 0 0 389.477 3.212 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc1[N+](=O)[O-] ZINC000176260752 1428203004 /nfs/dbraw/zinc/20/30/04/1428203004.db2.gz FPRKPAWJEXWTJV-ZDUSSCGKSA-N 0 0 395.415 3.238 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CCO)cc([N+](=O)[O-])c1F ZINC000180177058 1429783574 /nfs/dbraw/zinc/78/35/74/1429783574.db2.gz FLEOCNGMXRBSKY-CQSZACIVSA-N 0 0 396.440 3.004 20 5 GGBDRN C[C@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000180178345 1429784679 /nfs/dbraw/zinc/78/46/79/1429784679.db2.gz QNJJPRNOCXPHMM-CYBMUJFWSA-N 0 0 398.868 3.210 20 5 GGBDRN C[C@@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000180180904 1429785828 /nfs/dbraw/zinc/78/58/28/1429785828.db2.gz AGCMAZSJAMPWIU-ZDUSSCGKSA-N 0 0 398.868 3.210 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)CCO ZINC000180183792 1429788766 /nfs/dbraw/zinc/78/87/66/1429788766.db2.gz MYJFYEANRQYWOF-HNNXBMFYSA-N 0 0 392.477 3.119 20 5 GGBDRN CC(C)(O)CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000180212182 1429803077 /nfs/dbraw/zinc/80/30/77/1429803077.db2.gz IZXWJCXMXJCXAY-UHFFFAOYSA-N 0 0 382.420 3.418 20 5 GGBDRN CN(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)c(Cl)c1 ZINC000180216876 1429804461 /nfs/dbraw/zinc/80/44/61/1429804461.db2.gz AUFMTSOJOBZQKD-UHFFFAOYSA-N 0 0 397.815 3.241 20 5 GGBDRN CN(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1 ZINC000180222097 1429806206 /nfs/dbraw/zinc/80/62/06/1429806206.db2.gz VUXFKSRUKGCQAF-UHFFFAOYSA-N 0 0 375.747 3.245 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000180229314 1429808664 /nfs/dbraw/zinc/80/86/64/1429808664.db2.gz KZVLUWSDCRMVCD-KDOFPFPSSA-N 0 0 394.786 3.413 20 5 GGBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180238528 1429811553 /nfs/dbraw/zinc/81/15/53/1429811553.db2.gz HVTVXJXLQYIZTF-HZPDHXFCSA-N 0 0 379.775 3.351 20 5 GGBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000180238560 1429811575 /nfs/dbraw/zinc/81/15/75/1429811575.db2.gz HVTVXJXLQYIZTF-CVEARBPZSA-N 0 0 379.775 3.351 20 5 GGBDRN O=C(NCc1ccc(N2CCCC2)nc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180255533 1429815914 /nfs/dbraw/zinc/81/59/14/1429815914.db2.gz MTONAODKVVOFIM-UHFFFAOYSA-N 0 0 392.362 3.121 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000180258171 1429817387 /nfs/dbraw/zinc/81/73/87/1429817387.db2.gz HWCJKDMDSCTDAF-WMZOPIPTSA-N 0 0 394.786 3.413 20 5 GGBDRN CC(=O)N1CC[C@H](CN(C)C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000180265689 1429818658 /nfs/dbraw/zinc/81/86/58/1429818658.db2.gz CAYCBLFXHOILBL-CQSZACIVSA-N 0 0 379.482 3.036 20 5 GGBDRN COc1ccc(COCCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 ZINC000180274884 1429821243 /nfs/dbraw/zinc/82/12/43/1429821243.db2.gz SEUYZXNSSVKOFD-UHFFFAOYSA-N 0 0 399.447 3.150 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1 ZINC000180278583 1429822680 /nfs/dbraw/zinc/82/26/80/1429822680.db2.gz RJEDVLUOSDGXEQ-UHFFFAOYSA-N 0 0 385.420 3.007 20 5 GGBDRN O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000180285439 1429824695 /nfs/dbraw/zinc/82/46/95/1429824695.db2.gz IIVYVASJUOGJDC-CQSZACIVSA-N 0 0 387.823 3.027 20 5 GGBDRN Cc1c(CCC(=O)N(C)c2nc(-c3ccccc3[N+](=O)[O-])cs2)cnn1C ZINC000180287569 1429825269 /nfs/dbraw/zinc/82/52/69/1429825269.db2.gz INIUNPIROCDNDL-UHFFFAOYSA-N 0 0 385.449 3.356 20 5 GGBDRN COC(=O)c1ccc(C(=O)N(C)c2nc(-c3ccccc3[N+](=O)[O-])cs2)o1 ZINC000180287480 1429825287 /nfs/dbraw/zinc/82/52/87/1429825287.db2.gz NLAKRWJDKSZQNF-UHFFFAOYSA-N 0 0 387.373 3.375 20 5 GGBDRN Cc1cccnc1COC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000180290417 1429826379 /nfs/dbraw/zinc/82/63/79/1429826379.db2.gz UFRMIUMFRJJHDZ-UHFFFAOYSA-N 0 0 398.156 3.260 20 5 GGBDRN CCCN1C(=O)CCc2cc(NC(=O)COc3cccc([N+](=O)[O-])c3)ccc21 ZINC000180290622 1429826447 /nfs/dbraw/zinc/82/64/47/1429826447.db2.gz ALILRSFLDUASQI-UHFFFAOYSA-N 0 0 383.404 3.302 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(CC(=O)OCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000180292644 1429826980 /nfs/dbraw/zinc/82/69/80/1429826980.db2.gz BTRQCMLVYVWNMC-UHFFFAOYSA-N 0 0 377.418 3.063 20 5 GGBDRN O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000180300132 1429829426 /nfs/dbraw/zinc/82/94/26/1429829426.db2.gz KNTRASPMHXHYRT-AWEZNQCLSA-N 0 0 387.823 3.027 20 5 GGBDRN O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000180300148 1429829454 /nfs/dbraw/zinc/82/94/54/1429829454.db2.gz KNTRASPMHXHYRT-CQSZACIVSA-N 0 0 387.823 3.027 20 5 GGBDRN COc1ccc(CN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H](CO)C(C)C)cc1 ZINC000180303170 1429830569 /nfs/dbraw/zinc/83/05/69/1429830569.db2.gz YRLGZUMFOOYJIP-HXUWFJFHSA-N 0 0 386.448 3.192 20 5 GGBDRN C[C@@]1(CNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)CCCc2ccccc21 ZINC000180306398 1429831364 /nfs/dbraw/zinc/83/13/64/1429831364.db2.gz HKTDIJSMZDFOQL-NRFANRHFSA-N 0 0 391.431 3.200 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180310965 1429832938 /nfs/dbraw/zinc/83/29/38/1429832938.db2.gz GFWLYCFRZGXNAS-UHFFFAOYSA-N 0 0 385.767 3.011 20 5 GGBDRN O=C(Nc1ccc(Cn2cncn2)cc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180312355 1429833415 /nfs/dbraw/zinc/83/34/15/1429833415.db2.gz UPPGUMUSZYPHDE-UHFFFAOYSA-N 0 0 389.318 3.088 20 5 GGBDRN CNC(=O)c1cccc(NCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])c1 ZINC000180325737 1429836698 /nfs/dbraw/zinc/83/66/98/1429836698.db2.gz PWGJOSCQVXIWIP-UHFFFAOYSA-N 0 0 395.362 3.219 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(S(=O)(=O)C(C)C)cc1 ZINC000180328516 1429836990 /nfs/dbraw/zinc/83/69/90/1429836990.db2.gz KMWPYYPOXFHJPD-UHFFFAOYSA-N 0 0 376.434 3.267 20 5 GGBDRN Cc1ccc(NC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)cc1[N+](=O)[O-] ZINC000180328402 1429837014 /nfs/dbraw/zinc/83/70/14/1429837014.db2.gz UXIPYERQDKZPTP-UHFFFAOYSA-N 0 0 376.434 3.267 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2CCCOc3cc(F)ccc32)cc1 ZINC000180329408 1429837416 /nfs/dbraw/zinc/83/74/16/1429837416.db2.gz JGUGZRFRTYLDNP-QGZVFWFLSA-N 0 0 394.424 3.110 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21 ZINC000180329954 1429837552 /nfs/dbraw/zinc/83/75/52/1429837552.db2.gz LIBPUWLEDRAYBU-XOKHGSTOSA-N 0 0 385.807 3.031 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000180335468 1429838520 /nfs/dbraw/zinc/83/85/20/1429838520.db2.gz OORUTTPIZJNYSD-SJLPKXTDSA-N 0 0 384.498 3.041 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000180335500 1429838661 /nfs/dbraw/zinc/83/86/61/1429838661.db2.gz OORUTTPIZJNYSD-FUHWJXTLSA-N 0 0 384.498 3.041 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCC(=O)N2)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180343188 1429840526 /nfs/dbraw/zinc/84/05/26/1429840526.db2.gz KBCYNLHJHICYLQ-UHFFFAOYSA-N 0 0 377.303 3.333 20 5 GGBDRN Cn1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(-c2cccs2)n1 ZINC000180344936 1429841023 /nfs/dbraw/zinc/84/10/23/1429841023.db2.gz OGSKNNPCURNAEF-AWEZNQCLSA-N 0 0 384.465 3.138 20 5 GGBDRN Cc1c(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)cccc1[N+](=O)[O-] ZINC000180351276 1429843058 /nfs/dbraw/zinc/84/30/58/1429843058.db2.gz GARFGOYZCFBPRJ-CYBMUJFWSA-N 0 0 376.438 3.143 20 5 GGBDRN CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nccs1 ZINC000180355732 1429844634 /nfs/dbraw/zinc/84/46/34/1429844634.db2.gz AXPMKYFJEJDWBJ-GFCCVEGCSA-N 0 0 396.856 3.488 20 5 GGBDRN COc1ccc(COCCNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000180356354 1429845078 /nfs/dbraw/zinc/84/50/78/1429845078.db2.gz OEAHFYAVDNFJTF-OAHLLOKOSA-N 0 0 387.436 3.489 20 5 GGBDRN Cc1c(CC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)cccc1[N+](=O)[O-] ZINC000180361032 1429846261 /nfs/dbraw/zinc/84/62/61/1429846261.db2.gz KRUKGMDKPCUZTK-AWEZNQCLSA-N 0 0 390.465 3.072 20 5 GGBDRN Cc1ccc(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)cc1[N+](=O)[O-] ZINC000180364427 1429847145 /nfs/dbraw/zinc/84/71/45/1429847145.db2.gz DTBBGLYKQBBVFZ-CYBMUJFWSA-N 0 0 376.438 3.143 20 5 GGBDRN Cc1ccc(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)cc1[N+](=O)[O-] ZINC000180364412 1429847154 /nfs/dbraw/zinc/84/71/54/1429847154.db2.gz DTBBGLYKQBBVFZ-ZDUSSCGKSA-N 0 0 376.438 3.143 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cnn1-c1ccccc1F ZINC000180368705 1429848530 /nfs/dbraw/zinc/84/85/30/1429848530.db2.gz KXOGXMLAOQBACJ-UHFFFAOYSA-N 0 0 397.366 3.114 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1 ZINC000180371322 1429849319 /nfs/dbraw/zinc/84/93/19/1429849319.db2.gz HWHHOEVYFGUMGK-CQSZACIVSA-N 0 0 376.438 3.143 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CCCOc2cc(F)ccc21 ZINC000180380524 1429851827 /nfs/dbraw/zinc/85/18/27/1429851827.db2.gz YRPAIHPLPUMJQP-MRXNPFEDSA-N 0 0 389.383 3.456 20 5 GGBDRN Cc1nn(C)c(=O)c(-c2nc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)cs2)c1C ZINC000180398172 1429856945 /nfs/dbraw/zinc/85/69/45/1429856945.db2.gz CQKPQAPCTNKVGZ-CYBMUJFWSA-N 0 0 399.476 3.280 20 5 GGBDRN COc1ccc([C@H](C)CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000180399847 1429857338 /nfs/dbraw/zinc/85/73/38/1429857338.db2.gz WMYSFHKEBXLNOQ-MRXNPFEDSA-N 0 0 383.448 3.165 20 5 GGBDRN COC[C@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccc(F)c(F)c1 ZINC000180437250 1429869353 /nfs/dbraw/zinc/86/93/53/1429869353.db2.gz KJCVEJJTOYAJQZ-INIZCTEOSA-N 0 0 395.362 3.069 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(Cn3cc(CCCO)c(C(F)(F)F)n3)co2)cc1 ZINC000180442747 1429870520 /nfs/dbraw/zinc/87/05/20/1429870520.db2.gz RDZRQJLBDYLGNY-UHFFFAOYSA-N 0 0 396.325 3.438 20 5 GGBDRN COc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000180451544 1429872444 /nfs/dbraw/zinc/87/24/44/1429872444.db2.gz UPMKDVXLSGZCMN-UHFFFAOYSA-N 0 0 385.420 3.483 20 5 GGBDRN C[C@@H](NCc1nnnn1-c1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000180453787 1429872958 /nfs/dbraw/zinc/87/29/58/1429872958.db2.gz OLTYCNLUIUHMPZ-LLVKDONJSA-N 0 0 392.341 3.440 20 5 GGBDRN COc1ccc(COCCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000180459312 1429874349 /nfs/dbraw/zinc/87/43/49/1429874349.db2.gz GMVWKYNXNKGTBO-UHFFFAOYSA-N 0 0 385.420 3.124 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CC(=O)N(C2CCCC2)C1 ZINC000180467314 1429875840 /nfs/dbraw/zinc/87/58/40/1429875840.db2.gz UCPMRFODEWXBMM-SNVBAGLBSA-N 0 0 385.342 3.343 20 5 GGBDRN CS(=O)(=O)Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)o1 ZINC000180467825 1429875858 /nfs/dbraw/zinc/87/58/58/1429875858.db2.gz FZIWVDOYCJXEIO-UHFFFAOYSA-N 0 0 392.311 3.004 20 5 GGBDRN CN(C(=O)CN(Cc1ccco1)Cc1cccnc1)c1ccc([N+](=O)[O-])cc1 ZINC000180467862 1429875958 /nfs/dbraw/zinc/87/59/58/1429875958.db2.gz RCGXUMUTVVEWQJ-UHFFFAOYSA-N 0 0 380.404 3.248 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CC(=O)N(Cc2ccco2)C1 ZINC000180468268 1429876123 /nfs/dbraw/zinc/87/61/23/1429876123.db2.gz SZPGZRJNNWBXPG-SNVBAGLBSA-N 0 0 397.309 3.194 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180470242 1429876601 /nfs/dbraw/zinc/87/66/01/1429876601.db2.gz PEOMDZABAYPXJX-UHFFFAOYSA-N 0 0 387.274 3.056 20 5 GGBDRN C[C@@]12CCC(=O)N1[C@H](C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CS2 ZINC000180469331 1429876635 /nfs/dbraw/zinc/87/66/35/1429876635.db2.gz UMKMLGLLLDCQGO-SMDDNHRTSA-N 0 0 389.355 3.006 20 5 GGBDRN CS(=O)(=O)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1 ZINC000180469595 1429876681 /nfs/dbraw/zinc/87/66/81/1429876681.db2.gz NHLMWSDSWPXFQV-UHFFFAOYSA-N 0 0 388.323 3.269 20 5 GGBDRN COC[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000180475946 1429878209 /nfs/dbraw/zinc/87/82/09/1429878209.db2.gz IAWNLMGMCAYCDE-QGZVFWFLSA-N 0 0 379.363 3.102 20 5 GGBDRN COC[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000180475928 1429878242 /nfs/dbraw/zinc/87/82/42/1429878242.db2.gz IAWNLMGMCAYCDE-KRWDZBQOSA-N 0 0 379.363 3.102 20 5 GGBDRN Cc1ccc([C@](O)(CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C(F)(F)F)o1 ZINC000180492001 1429881681 /nfs/dbraw/zinc/88/16/81/1429881681.db2.gz GOSBMZKBIDNGIT-OAHLLOKOSA-N 0 0 398.297 3.151 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N(C)Cc2cc(F)c(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000180504665 1429884332 /nfs/dbraw/zinc/88/43/32/1429884332.db2.gz LWACROWLECIFNG-SNVBAGLBSA-N 0 0 397.353 3.480 20 5 GGBDRN CCc1cc(NC(=O)CCS(=O)(=O)CC(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000180505836 1429884624 /nfs/dbraw/zinc/88/46/24/1429884624.db2.gz ZHXGWMCUXAXSEE-UHFFFAOYSA-N 0 0 393.465 3.105 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@]1(C)CCCc2ccccc21 ZINC000180516207 1429887357 /nfs/dbraw/zinc/88/73/57/1429887357.db2.gz MGUVDVMIVUCIIA-NRFANRHFSA-N 0 0 381.432 3.252 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@]1(C)CCCc2ccccc21 ZINC000180516226 1429887363 /nfs/dbraw/zinc/88/73/63/1429887363.db2.gz MGUVDVMIVUCIIA-OAQYLSRUSA-N 0 0 381.432 3.252 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@@H](C)[C@H]3CCCC[C@@H]32)nn1-c1ccccc1[N+](=O)[O-] ZINC000180517350 1429887609 /nfs/dbraw/zinc/88/76/09/1429887609.db2.gz KCSGODNEQIAXAR-BMFZPTHFSA-N 0 0 396.447 3.100 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2C[C@@H](C)[C@@H]3CCCC[C@@H]32)nn1-c1ccccc1[N+](=O)[O-] ZINC000180517385 1429887643 /nfs/dbraw/zinc/88/76/43/1429887643.db2.gz KCSGODNEQIAXAR-KBMXLJTQSA-N 0 0 396.447 3.100 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000180517629 1429887657 /nfs/dbraw/zinc/88/76/57/1429887657.db2.gz OIQJJYNAAZGWAI-NRFANRHFSA-N 0 0 381.432 3.252 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000180520874 1429888585 /nfs/dbraw/zinc/88/85/85/1429888585.db2.gz LDHPPLNSSVZPSK-SJORKVTESA-N 0 0 377.347 3.202 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000180520894 1429888619 /nfs/dbraw/zinc/88/86/19/1429888619.db2.gz LDHPPLNSSVZPSK-IRXDYDNUSA-N 0 0 377.347 3.202 20 5 GGBDRN CC[C@@H](C)N(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)[C@H](C)CC ZINC000180520368 1429888755 /nfs/dbraw/zinc/88/87/55/1429888755.db2.gz LJXFRQPVVRSUMN-ZIAGYGMSSA-N 0 0 386.452 3.488 20 5 GGBDRN COC(=O)[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1 ZINC000180556267 1429896666 /nfs/dbraw/zinc/89/66/66/1429896666.db2.gz JYSSDRGVFILDNT-HXUWFJFHSA-N 0 0 378.384 3.321 20 5 GGBDRN COC(=O)[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc2ccccc2c1 ZINC000180557442 1429897050 /nfs/dbraw/zinc/89/70/50/1429897050.db2.gz MJPQPAFRAHTCJU-FQEVSTJZSA-N 0 0 378.384 3.321 20 5 GGBDRN COC(=O)[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc2ccccc2c1 ZINC000180557424 1429897193 /nfs/dbraw/zinc/89/71/93/1429897193.db2.gz MJPQPAFRAHTCJU-HXUWFJFHSA-N 0 0 378.384 3.321 20 5 GGBDRN CCC(CC)n1nc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000180560125 1429897941 /nfs/dbraw/zinc/89/79/41/1429897941.db2.gz ALOQISMHEDINIQ-AWEZNQCLSA-N 0 0 386.456 3.182 20 5 GGBDRN C[C@H]1CN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@H]2CCCC[C@H]12 ZINC000180560293 1429897983 /nfs/dbraw/zinc/89/79/83/1429897983.db2.gz HJEUQJJWSJVFJF-IMJJTQAJSA-N 0 0 387.436 3.320 20 5 GGBDRN C[C@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000180564138 1429898907 /nfs/dbraw/zinc/89/89/07/1429898907.db2.gz SMNDLIVDCGQRLX-OUCADQQQSA-N 0 0 379.844 3.015 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000180591400 1429917397 /nfs/dbraw/zinc/91/73/97/1429917397.db2.gz IGMVXVCMSWQXLS-UHFFFAOYSA-N 0 0 397.357 3.357 20 5 GGBDRN COc1cc(Cn2c(CO)nc3ccccc32)c([N+](=O)[O-])cc1OCC(F)F ZINC000180605885 1429929500 /nfs/dbraw/zinc/92/95/00/1429929500.db2.gz QYXVRUIHNGCWOQ-UHFFFAOYSA-N 0 0 393.346 3.138 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000180616928 1429935521 /nfs/dbraw/zinc/93/55/21/1429935521.db2.gz XDHBGOWYYOQRIU-CRAIPNDOSA-N 0 0 379.457 3.386 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000180621156 1429937218 /nfs/dbraw/zinc/93/72/18/1429937218.db2.gz WGWJDLIMWMOOTA-DLBZAZTESA-N 0 0 377.347 3.202 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000180622225 1429938089 /nfs/dbraw/zinc/93/80/89/1429938089.db2.gz NXAIUUVHZXBYMD-UHFFFAOYSA-N 0 0 388.855 3.179 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1cccnc1-n1cccn1 ZINC000180622737 1429938932 /nfs/dbraw/zinc/93/89/32/1429938932.db2.gz OIZLQRZRDWWNRK-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COC(=O)[C@@H]1CCC[C@@H](C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000180627202 1429940393 /nfs/dbraw/zinc/94/03/93/1429940393.db2.gz BRLPQSXHYQZRKD-NXEZZACHSA-N 0 0 385.214 3.275 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC1 ZINC000180635482 1429946938 /nfs/dbraw/zinc/94/69/38/1429946938.db2.gz REQJAKCRWYHMPR-UHFFFAOYSA-N 0 0 375.469 3.404 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000180639903 1429948651 /nfs/dbraw/zinc/94/86/51/1429948651.db2.gz WXFLDCUXZRWNJQ-UHFFFAOYSA-N 0 0 391.468 3.104 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000180640552 1429948991 /nfs/dbraw/zinc/94/89/91/1429948991.db2.gz YZLBMRSZWLMUIA-UHFFFAOYSA-N 0 0 391.468 3.104 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1 ZINC000180651759 1429956837 /nfs/dbraw/zinc/95/68/37/1429956837.db2.gz ZYEDTYFUIVDEAE-KRWDZBQOSA-N 0 0 388.855 3.397 20 5 GGBDRN COc1cc(COc2ccc(CCO)cc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180671172 1429967136 /nfs/dbraw/zinc/96/71/36/1429967136.db2.gz NVCHFIBSSAACOI-UHFFFAOYSA-N 0 0 383.347 3.361 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccc(Br)nc2C)ccc1[N+](=O)[O-] ZINC000180674974 1429969365 /nfs/dbraw/zinc/96/93/65/1429969365.db2.gz YUHQENUQOSJENE-UHFFFAOYSA-N 0 0 396.197 3.087 20 5 GGBDRN CC1CC[NH+]([C@@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])c2ccccc2)CC1 ZINC000180690803 1429979868 /nfs/dbraw/zinc/97/98/68/1429979868.db2.gz VKALMCAVOKCPTC-IBGZPJMESA-N 0 0 382.464 3.380 20 5 GGBDRN C[C@@H]1C[C@H](C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC(C)(C)C1 ZINC000180694084 1429981655 /nfs/dbraw/zinc/98/16/55/1429981655.db2.gz WMYGOUXOBDNHHT-WBVHZDCISA-N 0 0 387.480 3.342 20 5 GGBDRN C[C@H](COc1ccccc1C(F)(F)F)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180700723 1429986039 /nfs/dbraw/zinc/98/60/39/1429986039.db2.gz SALMCQWLHMHKBP-SNVBAGLBSA-N 0 0 383.326 3.393 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)cccc1[N+](=O)[O-] ZINC000180711705 1429993626 /nfs/dbraw/zinc/99/36/26/1429993626.db2.gz GGVRSCMHBWTDCP-HNNXBMFYSA-N 0 0 395.337 3.410 20 5 GGBDRN O=C(N[C@H]1CC12CCCCC2)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000180712427 1429993662 /nfs/dbraw/zinc/99/36/62/1429993662.db2.gz VEMVOFJBGOCAMX-OCCSQVGLSA-N 0 0 377.466 3.100 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000180718698 1429998188 /nfs/dbraw/zinc/99/81/88/1429998188.db2.gz HPFSPUKXLKPJMG-OAHLLOKOSA-N 0 0 395.337 3.410 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc2n1CCCCC2 ZINC000180732170 1430005972 /nfs/dbraw/zinc/00/59/72/1430005972.db2.gz JTTGYALUJODVII-UHFFFAOYSA-N 0 0 389.481 3.343 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(c2ccccc2Cl)CCOCC1 ZINC000180759624 1430023413 /nfs/dbraw/zinc/02/34/13/1430023413.db2.gz BGIJJUKSDZZGCN-UHFFFAOYSA-N 0 0 389.839 3.309 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1 ZINC000180769348 1430029227 /nfs/dbraw/zinc/02/92/27/1430029227.db2.gz YQZCAFJOJBWVDU-UHFFFAOYSA-N 0 0 395.375 3.269 20 5 GGBDRN CC(C)(O)CN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000180772867 1430031106 /nfs/dbraw/zinc/03/11/06/1430031106.db2.gz KMVOONXSIVGTDK-UHFFFAOYSA-N 0 0 398.868 3.210 20 5 GGBDRN COC[C@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000180772116 1430031273 /nfs/dbraw/zinc/03/12/73/1430031273.db2.gz KSLVYKUVKPRXMQ-INIZCTEOSA-N 0 0 379.363 3.402 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](c2nncn2C)C1 ZINC000180774614 1430032433 /nfs/dbraw/zinc/03/24/33/1430032433.db2.gz KIICDVPSBIMMLF-CYBMUJFWSA-N 0 0 389.481 3.244 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCO1 ZINC000180776353 1430033241 /nfs/dbraw/zinc/03/32/41/1430033241.db2.gz HHIIZRHOKCATHK-BBRMVZONSA-N 0 0 397.859 3.287 20 5 GGBDRN COc1ccc(-n2nc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)cc2C)cc1 ZINC000180797421 1430045883 /nfs/dbraw/zinc/04/58/83/1430045883.db2.gz MENLPELUIZMYBA-UHFFFAOYSA-N 0 0 392.375 3.226 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000180827207 1430060200 /nfs/dbraw/zinc/06/02/00/1430060200.db2.gz FOBJSOVTHCKZIR-CYBMUJFWSA-N 0 0 392.818 3.465 20 5 GGBDRN CN(C[C@@H](O)C(F)(F)F)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000180830336 1430060995 /nfs/dbraw/zinc/06/09/95/1430060995.db2.gz FKJBTIFMIUMBMY-OAHLLOKOSA-N 0 0 384.310 3.382 20 5 GGBDRN O=C(c1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)cc1)N1CCOCC1 ZINC000180869447 1430078707 /nfs/dbraw/zinc/07/87/07/1430078707.db2.gz SFUHXGDFLMHNDF-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN O=C(Nc1n[nH]c(Cc2cccc(F)c2)n1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000180875594 1430082129 /nfs/dbraw/zinc/08/21/29/1430082129.db2.gz RBAVAXBNKHDQML-UHFFFAOYSA-N 0 0 396.382 3.269 20 5 GGBDRN Cc1cc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)n(Cc2ccccc2)n1 ZINC000180876728 1430082676 /nfs/dbraw/zinc/08/26/76/1430082676.db2.gz YGIZVINFHIDTFW-UHFFFAOYSA-N 0 0 380.360 3.129 20 5 GGBDRN COCCc1nc(C)c([C@H](C)OC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)s1 ZINC000180886028 1430089375 /nfs/dbraw/zinc/08/93/75/1430089375.db2.gz AFQNGHCKWBDLSZ-ZDUSSCGKSA-N 0 0 396.469 3.056 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1[N+](=O)[O-] ZINC000180885782 1430089449 /nfs/dbraw/zinc/08/94/49/1430089449.db2.gz LKHHMUUOCWMQSN-CYBMUJFWSA-N 0 0 398.341 3.113 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCCOc2cc(Cl)ccc21 ZINC000180888285 1430091234 /nfs/dbraw/zinc/09/12/34/1430091234.db2.gz FCVUKYDNWULMSO-OAHLLOKOSA-N 0 0 389.795 3.217 20 5 GGBDRN O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)Nc1ccc(Cl)cc1 ZINC000180888152 1430091298 /nfs/dbraw/zinc/09/12/98/1430091298.db2.gz HLRJUARQDGIAPZ-UHFFFAOYSA-N 0 0 399.737 3.218 20 5 GGBDRN O=C(N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180895317 1430095274 /nfs/dbraw/zinc/09/52/74/1430095274.db2.gz CPZLHRWYOODOGX-SNVBAGLBSA-N 0 0 395.749 3.062 20 5 GGBDRN O=C(N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000180902859 1430099224 /nfs/dbraw/zinc/09/92/24/1430099224.db2.gz AQXUWKXOYMLKTO-SECBINFHSA-N 0 0 395.749 3.062 20 5 GGBDRN COc1cc(CN(C)[C@@H](C)c2cnn(C)c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180908900 1430103781 /nfs/dbraw/zinc/10/37/81/1430103781.db2.gz JLEQYALVNHTSNR-NSHDSACASA-N 0 0 384.383 3.174 20 5 GGBDRN COc1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1OCC(F)(F)F ZINC000180922378 1430117200 /nfs/dbraw/zinc/11/72/00/1430117200.db2.gz BEDJKESHEXGXJA-UHFFFAOYSA-N 0 0 385.298 3.379 20 5 GGBDRN C[C@]1(c2cc(F)ccc2F)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000180935535 1430123343 /nfs/dbraw/zinc/12/33/43/1430123343.db2.gz YROKROHVPKWIGL-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN CCOc1cc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])ccc1OC(F)F ZINC000180943877 1430127886 /nfs/dbraw/zinc/12/78/86/1430127886.db2.gz KQRBZRPFTLLTRO-UHFFFAOYSA-N 0 0 381.335 3.107 20 5 GGBDRN CC(=O)NC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000180944977 1430127955 /nfs/dbraw/zinc/12/79/55/1430127955.db2.gz PEWCMOVBOSNJKZ-AWEZNQCLSA-N 0 0 379.482 3.084 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12 ZINC000180972003 1430144418 /nfs/dbraw/zinc/14/44/18/1430144418.db2.gz SPISISLAHHSPFH-HIFRSBDPSA-N 0 0 399.472 3.277 20 5 GGBDRN CCOc1ccc(C2(CNC(=O)c3c(N)cccc3[N+](=O)[O-])CCOCC2)cc1 ZINC000180973920 1430145661 /nfs/dbraw/zinc/14/56/61/1430145661.db2.gz INXTUCBGVSSJHL-UHFFFAOYSA-N 0 0 399.447 3.054 20 5 GGBDRN C[C@@]1(c2ccccc2F)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000180975251 1430146388 /nfs/dbraw/zinc/14/63/88/1430146388.db2.gz GWJZZZNMDAFNHT-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@H](CCO)N(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000180980152 1430149815 /nfs/dbraw/zinc/14/98/15/1430149815.db2.gz UYOYKVUGLRRKQM-CQSZACIVSA-N 0 0 391.855 3.460 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000180982118 1430150112 /nfs/dbraw/zinc/15/01/12/1430150112.db2.gz RTUWHOJJVJDLAG-JTQLQIEISA-N 0 0 384.358 3.390 20 5 GGBDRN CCCOc1ncccc1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180982717 1430150894 /nfs/dbraw/zinc/15/08/94/1430150894.db2.gz UKEPULYUASHQSV-UHFFFAOYSA-N 0 0 381.335 3.310 20 5 GGBDRN CCc1cc(=O)c2cc(NC(=O)CCNc3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000180985549 1430153293 /nfs/dbraw/zinc/15/32/93/1430153293.db2.gz UYDPXLPKCZFVIB-UHFFFAOYSA-N 0 0 380.404 3.439 20 5 GGBDRN CCCNC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000180999495 1430160313 /nfs/dbraw/zinc/16/03/13/1430160313.db2.gz ZHRKYCCMZPZQGC-CQSZACIVSA-N 0 0 393.509 3.474 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCC(C)(C)c1ccc(F)cc1 ZINC000181016468 1430168498 /nfs/dbraw/zinc/16/84/98/1430168498.db2.gz NZFFXMYWFZAYBY-UHFFFAOYSA-N 0 0 387.411 3.383 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000181016999 1430168573 /nfs/dbraw/zinc/16/85/73/1430168573.db2.gz FOPJAIQQXPDMHI-SNVBAGLBSA-N 0 0 384.358 3.390 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 ZINC000181022886 1430171738 /nfs/dbraw/zinc/17/17/38/1430171738.db2.gz UUUJMENMQYVPET-OAHLLOKOSA-N 0 0 379.775 3.183 20 5 GGBDRN CCCc1n[nH]c(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000181031419 1430176756 /nfs/dbraw/zinc/17/67/56/1430176756.db2.gz IDXWXWPDWBXSFY-CZUORRHYSA-N 0 0 396.806 3.323 20 5 GGBDRN C[C@@]1(c2cc(F)cc(F)c2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000181034129 1430178601 /nfs/dbraw/zinc/17/86/01/1430178601.db2.gz KUFQGEXWWOATHD-KRWDZBQOSA-N 0 0 395.749 3.494 20 5 GGBDRN CCOCCN(C)[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000181039833 1430181902 /nfs/dbraw/zinc/18/19/02/1430181902.db2.gz XTXWLLXIMIBLFD-GFCCVEGCSA-N 0 0 378.454 3.014 20 5 GGBDRN COC[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(F)c(F)c1 ZINC000181068126 1430195661 /nfs/dbraw/zinc/19/56/61/1430195661.db2.gz KYCJWYFDEZZWSY-SFHVURJKSA-N 0 0 389.358 3.401 20 5 GGBDRN CCCN1c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)cc2CCC1=O ZINC000181097826 1430208897 /nfs/dbraw/zinc/20/88/97/1430208897.db2.gz IVAREDOSSCSLIG-UHFFFAOYSA-N 0 0 386.383 3.258 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3cn(-c4ccc(F)c(Cl)c4)nn3)n2)c1 ZINC000181103820 1430211091 /nfs/dbraw/zinc/21/10/91/1430211091.db2.gz PEUOPRSBNRHIJB-UHFFFAOYSA-N 0 0 399.773 3.275 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CCC)c1[N+](=O)[O-] ZINC000181105520 1430211695 /nfs/dbraw/zinc/21/16/95/1430211695.db2.gz LORIVYSSBCIHPW-UHFFFAOYSA-N 0 0 385.424 3.212 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] ZINC000181112576 1430214859 /nfs/dbraw/zinc/21/48/59/1430214859.db2.gz SPIXFSWAOYKHBG-MAUKXSAKSA-N 0 0 392.843 3.098 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181113947 1430215456 /nfs/dbraw/zinc/21/54/56/1430215456.db2.gz UBQGFYYCBVTHRA-SNVBAGLBSA-N 0 0 385.401 3.294 20 5 GGBDRN COC[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1ccc(F)c(F)c1 ZINC000181114719 1430215564 /nfs/dbraw/zinc/21/55/64/1430215564.db2.gz DOFJQMLFGXUQKD-HNNXBMFYSA-N 0 0 381.335 3.391 20 5 GGBDRN O=C(Nc1nncn1-c1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000181116777 1430215924 /nfs/dbraw/zinc/21/59/24/1430215924.db2.gz CGTRVCFSLAOQGO-UHFFFAOYSA-N 0 0 378.392 3.028 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCc2c(ncn2CCc2ccccc2)C1 ZINC000181142673 1430224525 /nfs/dbraw/zinc/22/45/25/1430224525.db2.gz CTVYFJJTUCWEGO-UHFFFAOYSA-N 0 0 394.406 3.372 20 5 GGBDRN COc1c(C)cnc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1C ZINC000181152174 1430228946 /nfs/dbraw/zinc/22/89/46/1430228946.db2.gz CNENYBYOPUQWSY-UHFFFAOYSA-N 0 0 395.362 3.489 20 5 GGBDRN Cc1ccc2[nH]c([C@H]3CCCN3C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)nc2c1 ZINC000181159725 1430231960 /nfs/dbraw/zinc/23/19/60/1430231960.db2.gz BYMFPOIBRLHGMI-OAHLLOKOSA-N 0 0 394.387 3.486 20 5 GGBDRN C[C@@H](c1nc2ccccc2o1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000181177473 1430239238 /nfs/dbraw/zinc/23/92/38/1430239238.db2.gz FZGTWFRWSBDQOX-AWEZNQCLSA-N 0 0 380.404 3.255 20 5 GGBDRN O=C(Nc1ccnn1Cc1ccccn1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000181180801 1430239977 /nfs/dbraw/zinc/23/99/77/1430239977.db2.gz JTUMHXHGSGUWKS-UHFFFAOYSA-N 0 0 392.419 3.431 20 5 GGBDRN Cc1nnc(-c2cccc(NC(=O)[C@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)c2)o1 ZINC000181182749 1430240546 /nfs/dbraw/zinc/24/05/46/1430240546.db2.gz DLSHZBOTIFSAQD-QGZVFWFLSA-N 0 0 393.359 3.085 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)c(Cl)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181188869 1430242740 /nfs/dbraw/zinc/24/27/40/1430242740.db2.gz FTKIBACDFSYDTM-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000181207869 1430247583 /nfs/dbraw/zinc/24/75/83/1430247583.db2.gz RAIKREFIHZWVPP-UHFFFAOYSA-N 0 0 393.346 3.127 20 5 GGBDRN CC(C)(C)c1csc(CCNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)n1 ZINC000181210022 1430248957 /nfs/dbraw/zinc/24/89/57/1430248957.db2.gz DHFMNCCSWLBJHV-UHFFFAOYSA-N 0 0 377.422 3.050 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCO[C@@H](Cc2ccccc2)C1 ZINC000181213140 1430249132 /nfs/dbraw/zinc/24/91/32/1430249132.db2.gz RKZOJHVUNWWYIF-SFHVURJKSA-N 0 0 381.432 3.253 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1 ZINC000181222363 1430250953 /nfs/dbraw/zinc/25/09/53/1430250953.db2.gz WWRUHPHZLKPEIP-UHFFFAOYSA-N 0 0 392.297 3.029 20 5 GGBDRN Cc1ccc2[nH]c([C@H]3CCCN(C(=O)c4c(N)cccc4[N+](=O)[O-])C3)nc2c1 ZINC000181248362 1430256194 /nfs/dbraw/zinc/25/61/94/1430256194.db2.gz ZOCWXUYXLHTRAF-ZDUSSCGKSA-N 0 0 379.420 3.382 20 5 GGBDRN O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000181254621 1430257156 /nfs/dbraw/zinc/25/71/56/1430257156.db2.gz XVOXJFWNCFKVSY-AWEZNQCLSA-N 0 0 394.431 3.079 20 5 GGBDRN O=C(Nc1cnn(Cc2ccncc2)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181260943 1430258126 /nfs/dbraw/zinc/25/81/26/1430258126.db2.gz RKOSRFOHTOTQIF-UHFFFAOYSA-N 0 0 389.318 3.088 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1 ZINC000181274371 1430260860 /nfs/dbraw/zinc/26/08/60/1430260860.db2.gz CTLSOEQJIKPCCM-UHFFFAOYSA-N 0 0 390.399 3.359 20 5 GGBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181289280 1430263911 /nfs/dbraw/zinc/26/39/11/1430263911.db2.gz DZVJPUNHSVKPOE-UHFFFAOYSA-N 0 0 389.311 3.071 20 5 GGBDRN O=C(NCC1(c2ccccc2)CCC1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000181288348 1430263916 /nfs/dbraw/zinc/26/39/16/1430263916.db2.gz DIXKLFNLAVZKHK-UHFFFAOYSA-N 0 0 395.459 3.283 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(CS(=O)(=O)Cc2nnc(C3CC3)n2C2CC2)c1 ZINC000181290615 1430264377 /nfs/dbraw/zinc/26/43/77/1430264377.db2.gz PDXCSTIHPGWFEA-UHFFFAOYSA-N 0 0 396.856 3.167 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000181305282 1430267984 /nfs/dbraw/zinc/26/79/84/1430267984.db2.gz GSQKPIZCZBFCHC-UHFFFAOYSA-N 0 0 385.420 3.007 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181326857 1430273627 /nfs/dbraw/zinc/27/36/27/1430273627.db2.gz GMKRGVDAVGCJOX-MRVPVSSYSA-N 0 0 385.346 3.044 20 5 GGBDRN Cc1cccc(S(=O)(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1F ZINC000181334542 1430275908 /nfs/dbraw/zinc/27/59/08/1430275908.db2.gz XGTTYKOHYSEIMW-UHFFFAOYSA-N 0 0 394.424 3.274 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCc2nnc(-c3ccccc3)n2C)c1 ZINC000181336745 1430276187 /nfs/dbraw/zinc/27/61/87/1430276187.db2.gz CLNWEXKDSKVSPR-UHFFFAOYSA-N 0 0 384.417 3.469 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cc3nnc(C4CC4)n3C3CC3)CC2)cc1 ZINC000181402618 1430289521 /nfs/dbraw/zinc/28/95/21/1430289521.db2.gz IHVALQFUNBHBGO-UHFFFAOYSA-N 0 0 383.452 3.442 20 5 GGBDRN COC[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(F)c(F)c1 ZINC000181415255 1430292489 /nfs/dbraw/zinc/29/24/89/1430292489.db2.gz WVWAWKQILDJWDN-INIZCTEOSA-N 0 0 390.346 3.400 20 5 GGBDRN COc1cccc2[nH]cc(CC(=O)Nc3n[nH]c(-c4cccc([N+](=O)[O-])c4)n3)c21 ZINC000181423277 1430295140 /nfs/dbraw/zinc/29/51/40/1430295140.db2.gz PZJDOIPGLWSTSN-UHFFFAOYSA-N 0 0 392.375 3.051 20 5 GGBDRN CC[C@@H](C)Oc1cc(CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)ccn1 ZINC000181439493 1430299526 /nfs/dbraw/zinc/29/95/26/1430299526.db2.gz KXSJXBBJSHPYSG-CQSZACIVSA-N 0 0 395.419 3.283 20 5 GGBDRN COC[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181442682 1430300251 /nfs/dbraw/zinc/30/02/51/1430300251.db2.gz PMUZLTDTNIVTKJ-OAHLLOKOSA-N 0 0 399.781 3.442 20 5 GGBDRN COC[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(F)c(F)c1 ZINC000181443215 1430300507 /nfs/dbraw/zinc/30/05/07/1430300507.db2.gz OCDRQLKCCUPPHT-SFHVURJKSA-N 0 0 393.390 3.487 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)[C@H](CO)C1CC1 ZINC000181458905 1430304356 /nfs/dbraw/zinc/30/43/56/1430304356.db2.gz RGNLLOMETKTXNB-HXUWFJFHSA-N 0 0 383.448 3.197 20 5 GGBDRN CCn1c(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000181460676 1430304727 /nfs/dbraw/zinc/30/47/27/1430304727.db2.gz GVKMLTGTFSRUJJ-UHFFFAOYSA-N 0 0 386.339 3.142 20 5 GGBDRN Cc1cc(N(C)C)cc(C)c1NC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000181476130 1430307336 /nfs/dbraw/zinc/30/73/36/1430307336.db2.gz XCZYDYNBKMWYSQ-GOSISDBHSA-N 0 0 382.420 3.409 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000181482562 1430308002 /nfs/dbraw/zinc/30/80/02/1430308002.db2.gz XQWNQZMDFHSXIB-GFCCVEGCSA-N 0 0 379.482 3.225 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000181482581 1430308018 /nfs/dbraw/zinc/30/80/18/1430308018.db2.gz XQWNQZMDFHSXIB-LBPRGKRZSA-N 0 0 379.482 3.225 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000181491947 1430309613 /nfs/dbraw/zinc/30/96/13/1430309613.db2.gz MNFKSBFOVYYGGM-UHFFFAOYSA-N 0 0 398.341 3.053 20 5 GGBDRN C[C@@H](NC(=O)N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1)c1cccc([N+](=O)[O-])c1 ZINC000181493929 1430310061 /nfs/dbraw/zinc/31/00/61/1430310061.db2.gz CICKSUMGDISIIC-DOMZBBRYSA-N 0 0 384.440 3.241 20 5 GGBDRN O=C(Nc1ccnn1-c1cccc(Cl)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181522297 1430314881 /nfs/dbraw/zinc/31/48/81/1430314881.db2.gz FJYWPMFHFQWAIS-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN COC(=O)CN(C)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000181557788 1430320066 /nfs/dbraw/zinc/32/00/66/1430320066.db2.gz AFGMRCUAVJWHLI-QGZVFWFLSA-N 0 0 391.811 3.033 20 5 GGBDRN CCN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000181570450 1430321495 /nfs/dbraw/zinc/32/14/95/1430321495.db2.gz FMBYNYIZQNODNN-HNNXBMFYSA-N 0 0 392.477 3.460 20 5 GGBDRN Cc1sc2ncc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)c(=O)n2c1C ZINC000181576547 1430322451 /nfs/dbraw/zinc/32/24/51/1430322451.db2.gz XIDXGNZNRODOSB-UHFFFAOYSA-N 0 0 398.444 3.086 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cc1 ZINC000181594009 1430325411 /nfs/dbraw/zinc/32/54/11/1430325411.db2.gz OVDWNBWRMXMULO-SJORKVTESA-N 0 0 396.852 3.198 20 5 GGBDRN CN1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)C1 ZINC000181612506 1430327798 /nfs/dbraw/zinc/32/77/98/1430327798.db2.gz BJOVANBQTQGMDI-SFHVURJKSA-N 0 0 388.855 3.175 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCCc1nc(-c2ccc(F)cc2)no1 ZINC000181615930 1430328237 /nfs/dbraw/zinc/32/82/37/1430328237.db2.gz XQJIBPLIAVAZQI-UHFFFAOYSA-N 0 0 384.367 3.075 20 5 GGBDRN Cc1cc(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)ccc1[N+](=O)[O-] ZINC000181627511 1430330339 /nfs/dbraw/zinc/33/03/39/1430330339.db2.gz QTQWQCZQDPOWHI-UHFFFAOYSA-N 0 0 384.367 3.455 20 5 GGBDRN Cc1c(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)cccc1[N+](=O)[O-] ZINC000181630320 1430330968 /nfs/dbraw/zinc/33/09/68/1430330968.db2.gz RUUADKLDIIOCCN-UHFFFAOYSA-N 0 0 384.367 3.455 20 5 GGBDRN Cn1cc(C(=O)Nc2ccc(OCCOc3ccc([N+](=O)[O-])cc3)cc2)cn1 ZINC000181634583 1430331962 /nfs/dbraw/zinc/33/19/62/1430331962.db2.gz KKDNKHWZQLKNHZ-UHFFFAOYSA-N 0 0 382.376 3.038 20 5 GGBDRN Cn1cc(C(=O)Nc2ccc(OCCOc3cccc([N+](=O)[O-])c3)cc2)cn1 ZINC000181634534 1430332170 /nfs/dbraw/zinc/33/21/70/1430332170.db2.gz WGHADSMBPAMRPH-UHFFFAOYSA-N 0 0 382.376 3.038 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(CCO)Cc1cccnc1 ZINC000181686094 1430341794 /nfs/dbraw/zinc/34/17/94/1430341794.db2.gz OCDZEZFJKWVKGO-UHFFFAOYSA-N 0 0 375.450 3.125 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000181697525 1430343585 /nfs/dbraw/zinc/34/35/85/1430343585.db2.gz JLXOZKPGHYNFSD-UHFFFAOYSA-N 0 0 379.420 3.207 20 5 GGBDRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000181699213 1430343601 /nfs/dbraw/zinc/34/36/01/1430343601.db2.gz LYKLSJMLWLYYTJ-SNVBAGLBSA-N 0 0 391.840 3.260 20 5 GGBDRN CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000181721917 1430347513 /nfs/dbraw/zinc/34/75/13/1430347513.db2.gz FPBCOAVAIOEHKL-HNNXBMFYSA-N 0 0 391.468 3.245 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000181752203 1430352728 /nfs/dbraw/zinc/35/27/28/1430352728.db2.gz CRAPTZDVXLMTOL-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1 ZINC000181757798 1430353598 /nfs/dbraw/zinc/35/35/98/1430353598.db2.gz ICPFVZITGSYZNA-HNNXBMFYSA-N 0 0 397.431 3.000 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)ccc1[N+](=O)[O-] ZINC000181760867 1430354084 /nfs/dbraw/zinc/35/40/84/1430354084.db2.gz CBUCZZOEEBOCMQ-HNNXBMFYSA-N 0 0 397.431 3.000 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCO[C@H](c2ccccc2Cl)C1 ZINC000181760593 1430354267 /nfs/dbraw/zinc/35/42/67/1430354267.db2.gz DMPIYWOZFMAGSK-LIRRHRJNSA-N 0 0 392.839 3.061 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H](CS(C)(=O)=O)c1ccccc1 ZINC000181783468 1430359162 /nfs/dbraw/zinc/35/91/62/1430359162.db2.gz GTBIUQFQCJMHHQ-SFHVURJKSA-N 0 0 392.477 3.258 20 5 GGBDRN Cc1cccc(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)c1[N+](=O)[O-] ZINC000181793631 1430361588 /nfs/dbraw/zinc/36/15/88/1430361588.db2.gz GLNYGHFBXQLDIV-HNNXBMFYSA-N 0 0 391.786 3.231 20 5 GGBDRN Cc1c(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cccc1[N+](=O)[O-] ZINC000181794587 1430361896 /nfs/dbraw/zinc/36/18/96/1430361896.db2.gz XYUPNWBNCMANEB-HNNXBMFYSA-N 0 0 391.786 3.231 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1 ZINC000181803476 1430363850 /nfs/dbraw/zinc/36/38/50/1430363850.db2.gz SLALOKUFWUUICL-WBVHZDCISA-N 0 0 378.331 3.142 20 5 GGBDRN NC(=O)c1ccc(N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)c([N+](=O)[O-])c1 ZINC000181812518 1430365632 /nfs/dbraw/zinc/36/56/32/1430365632.db2.gz XFHSSQNGRHWDDQ-MRXNPFEDSA-N 0 0 395.337 3.290 20 5 GGBDRN Cc1ccc([C@H](C)NCC(=O)Nc2nnc(CC(C)C)s2)cc1[N+](=O)[O-] ZINC000181825482 1430367836 /nfs/dbraw/zinc/36/78/36/1430367836.db2.gz DXMIUUHHPFTJJT-LBPRGKRZSA-N 0 0 377.470 3.243 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000181872326 1430375292 /nfs/dbraw/zinc/37/52/92/1430375292.db2.gz LOTFCULXHKODNI-WMLDXEAASA-N 0 0 378.331 3.142 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000181874796 1430375472 /nfs/dbraw/zinc/37/54/72/1430375472.db2.gz MXNNADHGDRSQAY-APWZRJJASA-N 0 0 391.374 3.321 20 5 GGBDRN COc1ccc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000181889597 1430378290 /nfs/dbraw/zinc/37/82/90/1430378290.db2.gz LIJJBDNGZVMHJV-WMLDXEAASA-N 0 0 378.331 3.142 20 5 GGBDRN Cc1ccnn1-c1ccccc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000181899736 1430380137 /nfs/dbraw/zinc/38/01/37/1430380137.db2.gz SFLXLBJQZPDEJV-GOSISDBHSA-N 0 0 377.404 3.306 20 5 GGBDRN O=C(NCCc1ccc2c(c1)CCO2)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181907186 1430381365 /nfs/dbraw/zinc/38/13/65/1430381365.db2.gz ZPNPGLUYNIWYIG-UHFFFAOYSA-N 0 0 378.331 3.104 20 5 GGBDRN COCc1cc([N+](=O)[O-])ccc1N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 ZINC000181936669 1430385809 /nfs/dbraw/zinc/38/58/09/1430385809.db2.gz RIALNVFABJXTRC-GOSISDBHSA-N 0 0 383.448 3.387 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cccc(-n2ccnn2)c1 ZINC000181955754 1430388137 /nfs/dbraw/zinc/38/81/37/1430388137.db2.gz MWDCCGSCQXSDOB-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@H](OCc2ccncc2)C1 ZINC000181964624 1430389386 /nfs/dbraw/zinc/38/93/86/1430389386.db2.gz WBVQKWPKORYTRX-AWEZNQCLSA-N 0 0 393.346 3.023 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@@H](OCc2ccncc2)C1 ZINC000181964642 1430389522 /nfs/dbraw/zinc/38/95/22/1430389522.db2.gz WBVQKWPKORYTRX-CQSZACIVSA-N 0 0 393.346 3.023 20 5 GGBDRN C[S@@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000181967925 1430389844 /nfs/dbraw/zinc/38/98/44/1430389844.db2.gz GBZCFUQHPIFART-AREMUKBSSA-N 0 0 384.360 3.327 20 5 GGBDRN O=C(c1ccc(F)c(Cl)c1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000181984158 1430392145 /nfs/dbraw/zinc/39/21/45/1430392145.db2.gz KIAJXMWDXIYVQH-VIFPVBQESA-N 0 0 382.754 3.248 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCNC(=O)[C@@H]1c1ccccc1Cl ZINC000181997714 1430393954 /nfs/dbraw/zinc/39/39/54/1430393954.db2.gz LZIIAVAJORMJSV-HNNXBMFYSA-N 0 0 394.214 3.215 20 5 GGBDRN CCOc1cc(Cl)ccc1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000182001413 1430394613 /nfs/dbraw/zinc/39/46/13/1430394613.db2.gz LKVOVQWVKPBGOR-CYBMUJFWSA-N 0 0 390.827 3.369 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000182008874 1430395267 /nfs/dbraw/zinc/39/52/67/1430395267.db2.gz JYUQSHVXDJEYFB-UHFFFAOYSA-N 0 0 377.422 3.019 20 5 GGBDRN O=C(c1cccc(F)c1)N1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182017881 1430397310 /nfs/dbraw/zinc/39/73/10/1430397310.db2.gz GMOPBCFGKICTFW-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN C[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC[N@@H+]1Cc1ccccc1 ZINC000182036923 1430399756 /nfs/dbraw/zinc/39/97/56/1430399756.db2.gz XWMLSRFHWPMBIE-WBVHZDCISA-N 0 0 383.448 3.426 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@@H](c2cc(C)cc(C)c2)C1 ZINC000182040703 1430400691 /nfs/dbraw/zinc/40/06/91/1430400691.db2.gz QNMURLSWTGBNFI-OAHLLOKOSA-N 0 0 397.431 3.175 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCN(Cc4cccnc4)CC3)cs2)c1 ZINC000182054413 1430402580 /nfs/dbraw/zinc/40/25/80/1430402580.db2.gz HNSADDMUABQBIU-UHFFFAOYSA-N 0 0 395.488 3.431 20 5 GGBDRN CCOc1cc(C(=O)NCCCNc2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000182064976 1430404643 /nfs/dbraw/zinc/40/46/43/1430404643.db2.gz XSANFTBEFGJLPH-UHFFFAOYSA-N 0 0 391.399 3.373 20 5 GGBDRN O=C(Nc1cc(Cl)ccc1O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182071752 1430405871 /nfs/dbraw/zinc/40/58/71/1430405871.db2.gz JUZQZFDVGFVVDM-UHFFFAOYSA-N 0 0 377.784 3.043 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1 ZINC000182083625 1430408312 /nfs/dbraw/zinc/40/83/12/1430408312.db2.gz KOOZOHMCGGIHTI-UHFFFAOYSA-N 0 0 390.484 3.222 20 5 GGBDRN CS(=O)(=O)Nc1cccc2c1CCN(Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000182090701 1430410002 /nfs/dbraw/zinc/41/00/02/1430410002.db2.gz UDGQAXJAYYTJLD-UHFFFAOYSA-N 0 0 395.868 3.178 20 5 GGBDRN Cc1ccc(C[C@H](C)C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000182104529 1430412931 /nfs/dbraw/zinc/41/29/31/1430412931.db2.gz JNMBPNJYCJYTQG-KRWDZBQOSA-N 0 0 395.459 3.066 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1[O-])N1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC000182123835 1430415839 /nfs/dbraw/zinc/41/58/39/1430415839.db2.gz OLIAVEPJBJUURC-XLIONFOSSA-N 0 0 395.459 3.427 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H](CN1CCOCC1)c1ccccc1 ZINC000182138157 1430418347 /nfs/dbraw/zinc/41/83/47/1430418347.db2.gz ZECXVYPHTWFZIA-GOSISDBHSA-N 0 0 375.856 3.411 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)s1 ZINC000182138863 1430418763 /nfs/dbraw/zinc/41/87/63/1430418763.db2.gz HXCXPPCRCXIMQH-JTQLQIEISA-N 0 0 377.422 3.484 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c(=O)n(-c2ccccc2)n1C ZINC000182151017 1430420814 /nfs/dbraw/zinc/42/08/14/1430420814.db2.gz WEEZPDIQYQVVCD-GFCCVEGCSA-N 0 0 398.394 3.274 20 5 GGBDRN Cn1cc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)n2)cn1 ZINC000182161445 1430422313 /nfs/dbraw/zinc/42/23/13/1430422313.db2.gz QNYCTGYYVXJSQC-UHFFFAOYSA-N 0 0 395.347 3.306 20 5 GGBDRN Cc1ccc(-c2nnc(SC[C@@H](O)COc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000182183891 1430426125 /nfs/dbraw/zinc/42/61/25/1430426125.db2.gz IBSOTZRFYWPWCS-AWEZNQCLSA-N 0 0 387.417 3.485 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN(Cc2ccc(F)cc2)C2CC2)cc1 ZINC000182188986 1430427084 /nfs/dbraw/zinc/42/70/84/1430427084.db2.gz GLOFPRIOVFVDMC-UHFFFAOYSA-N 0 0 378.425 3.172 20 5 GGBDRN COc1ccc([C@H]2CCCN2CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000182198223 1430428428 /nfs/dbraw/zinc/42/84/28/1430428428.db2.gz TTXFAOHTXOOISC-LJQANCHMSA-N 0 0 390.461 3.214 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN(Cc2ccccc2F)C2CC2)cc1 ZINC000182199025 1430428810 /nfs/dbraw/zinc/42/88/10/1430428810.db2.gz NLGYBRSMOBHMKY-UHFFFAOYSA-N 0 0 378.425 3.172 20 5 GGBDRN C[C@@H](C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182201712 1430429023 /nfs/dbraw/zinc/42/90/23/1430429023.db2.gz WTEWTPDTGKSTLR-CYBMUJFWSA-N 0 0 375.375 3.325 20 5 GGBDRN C[C@H](C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182201690 1430429201 /nfs/dbraw/zinc/42/92/01/1430429201.db2.gz WTEWTPDTGKSTLR-ZDUSSCGKSA-N 0 0 375.375 3.325 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCN(Cc2cccc(F)c2)C2CC2)cc1 ZINC000182216331 1430431287 /nfs/dbraw/zinc/43/12/87/1430431287.db2.gz NVCYGEKKHHETKO-UHFFFAOYSA-N 0 0 378.425 3.172 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1nc(C(C)(C)C)no1 ZINC000182236677 1430434493 /nfs/dbraw/zinc/43/44/93/1430434493.db2.gz JGXUSTPZZFSPOV-MRVPVSSYSA-N 0 0 384.339 3.368 20 5 GGBDRN CC1(C)CN(CC(F)(F)F)CCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000182248433 1430436641 /nfs/dbraw/zinc/43/66/41/1430436641.db2.gz XYHSKHXDMFECIH-UHFFFAOYSA-N 0 0 375.391 3.322 20 5 GGBDRN CC(C)Oc1cccc(CN(C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000182257050 1430438243 /nfs/dbraw/zinc/43/82/43/1430438243.db2.gz ZVDRDJAFLCAOJY-UHFFFAOYSA-N 0 0 392.477 3.288 20 5 GGBDRN Cn1cc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c(-c2ccccc2)n1 ZINC000182268496 1430440085 /nfs/dbraw/zinc/44/00/85/1430440085.db2.gz KECQVRDHIIAFMN-UHFFFAOYSA-N 0 0 391.431 3.500 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)nc1C ZINC000182274273 1430441018 /nfs/dbraw/zinc/44/10/18/1430441018.db2.gz TUJZBIVOECCKIQ-QMMMGPOBSA-N 0 0 381.385 3.418 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)COc1ccc(OCC(F)(F)F)cc1 ZINC000182287027 1430442699 /nfs/dbraw/zinc/44/26/99/1430442699.db2.gz ZZNLJKZACJWMMB-LBPRGKRZSA-N 0 0 387.310 3.355 20 5 GGBDRN O=C(NCCNC(=O)C1CC1)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000182311317 1430446501 /nfs/dbraw/zinc/44/65/01/1430446501.db2.gz AMCJTDCLMIBUPU-UHFFFAOYSA-N 0 0 391.493 3.133 20 5 GGBDRN COc1ccc(C[C@H](C)C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1OC ZINC000182313109 1430447068 /nfs/dbraw/zinc/44/70/68/1430447068.db2.gz AXOONNZKQQDTRR-NSHDSACASA-N 0 0 384.392 3.306 20 5 GGBDRN CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182316202 1430447387 /nfs/dbraw/zinc/44/73/87/1430447387.db2.gz JZPWHRUSVTVBCW-OPGZXWTPSA-N 0 0 390.408 3.006 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000182322276 1430448324 /nfs/dbraw/zinc/44/83/24/1430448324.db2.gz QDXGDWNAXOYLHF-NSHDSACASA-N 0 0 396.856 3.438 20 5 GGBDRN C[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1F)c1ccc([N+](=O)[O-])cc1F ZINC000182324127 1430448549 /nfs/dbraw/zinc/44/85/49/1430448549.db2.gz ADVLJDLHLZSNKY-SECBINFHSA-N 0 0 384.360 3.019 20 5 GGBDRN COc1ccc(NC(=O)CNc2cc(C)n(-c3ccc(C)cc3)n2)c([N+](=O)[O-])c1 ZINC000182337154 1430450517 /nfs/dbraw/zinc/45/05/17/1430450517.db2.gz DWGIJTPOOZUBGU-UHFFFAOYSA-N 0 0 395.419 3.457 20 5 GGBDRN Cc1cc(NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)nn1-c1ccc(C)cc1 ZINC000182336959 1430450560 /nfs/dbraw/zinc/45/05/60/1430450560.db2.gz KKJBQEPILKWNDR-UHFFFAOYSA-N 0 0 391.431 3.399 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(C(=O)c2nccn2C)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182337756 1430450598 /nfs/dbraw/zinc/45/05/98/1430450598.db2.gz YDHJIWGCQZHEEY-GFCCVEGCSA-N 0 0 396.378 3.441 20 5 GGBDRN Cc1cccc(C2=CCN(CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000182344938 1430451466 /nfs/dbraw/zinc/45/14/66/1430451466.db2.gz SIAFRENMZYGREC-UHFFFAOYSA-N 0 0 386.473 3.466 20 5 GGBDRN CC(C)NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000182351080 1430452480 /nfs/dbraw/zinc/45/24/80/1430452480.db2.gz HIUCSDLNCNBDRH-UHFFFAOYSA-N 0 0 393.509 3.474 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1SCC(N)=O)c1ccc([N+](=O)[O-])cc1F ZINC000182357078 1430452944 /nfs/dbraw/zinc/45/29/44/1430452944.db2.gz CSWLMYBRJSQEON-JTQLQIEISA-N 0 0 377.397 3.054 20 5 GGBDRN COc1ccc(-n2ccnc2SCc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C)c1 ZINC000182357956 1430453076 /nfs/dbraw/zinc/45/30/76/1430453076.db2.gz JHQINARNCIEXMD-UHFFFAOYSA-N 0 0 398.444 3.489 20 5 GGBDRN CC[C@H](CO)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000182360838 1430453249 /nfs/dbraw/zinc/45/32/49/1430453249.db2.gz GJZKTWGSLPRKCH-LLVKDONJSA-N 0 0 391.811 3.001 20 5 GGBDRN COc1ccc(-n2ccnc2SCCn2cc([N+](=O)[O-])ccc2=O)c(C)c1 ZINC000182359960 1430453294 /nfs/dbraw/zinc/45/32/94/1430453294.db2.gz ITHGFENMEWPTTO-UHFFFAOYSA-N 0 0 386.433 3.052 20 5 GGBDRN CC[C@@H](C)Oc1cc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)ccn1 ZINC000182374807 1430455115 /nfs/dbraw/zinc/45/51/15/1430455115.db2.gz LXJWGSKOAQFYPH-OAHLLOKOSA-N 0 0 384.436 3.130 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000182374582 1430455158 /nfs/dbraw/zinc/45/51/58/1430455158.db2.gz IPEIGILPSQNIJP-UHFFFAOYSA-N 0 0 394.435 3.000 20 5 GGBDRN CN(Cc1nnc(C(=O)Nc2ccccc2)s1)Cc1ccccc1[N+](=O)[O-] ZINC000182380311 1430455802 /nfs/dbraw/zinc/45/58/02/1430455802.db2.gz YTXHDSDCSUJMJT-UHFFFAOYSA-N 0 0 383.433 3.331 20 5 GGBDRN O=C(CCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])NC1CCCCC1 ZINC000182380698 1430456194 /nfs/dbraw/zinc/45/61/94/1430456194.db2.gz BGVNCVGPSBKJJG-UHFFFAOYSA-N 0 0 399.900 3.296 20 5 GGBDRN COc1cc(CSc2nncn2C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182385494 1430457168 /nfs/dbraw/zinc/45/71/68/1430457168.db2.gz LAJSFPOCGNKXKW-UHFFFAOYSA-N 0 0 386.380 3.466 20 5 GGBDRN CC(C)n1nnnc1-c1ccc(NC(=O)NCc2ccccc2[N+](=O)[O-])cc1F ZINC000182390395 1430458139 /nfs/dbraw/zinc/45/81/39/1430458139.db2.gz TVHGIFXDGZAWMZ-UHFFFAOYSA-N 0 0 399.386 3.290 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F ZINC000182391139 1430458183 /nfs/dbraw/zinc/45/81/83/1430458183.db2.gz AKJCLTMVLZJNAH-LBPRGKRZSA-N 0 0 396.247 3.230 20 5 GGBDRN CCn1c(C)nnc1SCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000182396597 1430459584 /nfs/dbraw/zinc/45/95/84/1430459584.db2.gz KRPCCRLCGKRHJQ-UHFFFAOYSA-N 0 0 388.396 3.459 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1n1ccnc1 ZINC000182397895 1430459919 /nfs/dbraw/zinc/45/99/19/1430459919.db2.gz MPMMKICJZRPIRT-RISCZKNCSA-N 0 0 380.351 3.116 20 5 GGBDRN Cc1cc(NC(=O)C2CCN(C(=O)COc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000182404438 1430461526 /nfs/dbraw/zinc/46/15/26/1430461526.db2.gz FDKPPQXFKISCRF-UHFFFAOYSA-N 0 0 397.431 3.159 20 5 GGBDRN Cc1cc(NC(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000182411312 1430462767 /nfs/dbraw/zinc/46/27/67/1430462767.db2.gz NXBKNEOHAUMHLF-GFCCVEGCSA-N 0 0 380.397 3.233 20 5 GGBDRN Cc1cc(NC(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000182411332 1430462800 /nfs/dbraw/zinc/46/28/00/1430462800.db2.gz NXBKNEOHAUMHLF-LBPRGKRZSA-N 0 0 380.397 3.233 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182416566 1430464017 /nfs/dbraw/zinc/46/40/17/1430464017.db2.gz PZEVCLXMATVMIM-ZDUSSCGKSA-N 0 0 397.357 3.357 20 5 GGBDRN Cc1cc(NC(=O)CCn2c(=O)oc3cc(Cl)ccc32)ccc1[N+](=O)[O-] ZINC000182422224 1430465104 /nfs/dbraw/zinc/46/51/04/1430465104.db2.gz OTNVJUYCMVDMAL-UHFFFAOYSA-N 0 0 375.768 3.493 20 5 GGBDRN Cc1nn(-c2nc(C)cc(C)n2)c(C)c1CC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000182422001 1430465113 /nfs/dbraw/zinc/46/51/13/1430465113.db2.gz HUKFQWQXWNTFDQ-UHFFFAOYSA-N 0 0 394.435 3.294 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1cn(C)nc1-c1ccccc1 ZINC000182425373 1430465766 /nfs/dbraw/zinc/46/57/66/1430465766.db2.gz OZOHMANTJRPVRZ-UHFFFAOYSA-N 0 0 395.419 3.003 20 5 GGBDRN CC1(C)CN(CC(F)(F)F)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000182427510 1430466058 /nfs/dbraw/zinc/46/60/58/1430466058.db2.gz ZXQWQQJOSBKHQD-UHFFFAOYSA-N 0 0 384.358 3.175 20 5 GGBDRN CC(=O)N[C@H](CC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1ccc(F)cc1F ZINC000182442959 1430468635 /nfs/dbraw/zinc/46/86/35/1430468635.db2.gz BQKDYFFGQMNILC-MRXNPFEDSA-N 0 0 377.347 3.387 20 5 GGBDRN COc1ccc([C@H]2[C@@H](C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CCC(=O)N2C)cc1 ZINC000182449126 1430469435 /nfs/dbraw/zinc/46/94/35/1430469435.db2.gz SQZQVXLZABQBBH-PXNSSMCTSA-N 0 0 397.431 3.460 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182450332 1430469836 /nfs/dbraw/zinc/46/98/36/1430469836.db2.gz UCONKXOZNJVRMK-RDTXWAMCSA-N 0 0 376.796 3.273 20 5 GGBDRN C[C@H](C(=O)N1CCN(CCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182462924 1430471582 /nfs/dbraw/zinc/47/15/82/1430471582.db2.gz TYSREKGTUZBPAF-INIZCTEOSA-N 0 0 385.439 3.224 20 5 GGBDRN CC[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000182463176 1430471863 /nfs/dbraw/zinc/47/18/63/1430471863.db2.gz WMXYNZFYQJYNKX-SMDDNHRTSA-N 0 0 376.413 3.276 20 5 GGBDRN O=C(N[C@@H](CCCO)c1ccccc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182472613 1430473482 /nfs/dbraw/zinc/47/34/82/1430473482.db2.gz LKOWOOXOIQDMOL-HNNXBMFYSA-N 0 0 380.347 3.440 20 5 GGBDRN C[C@H](C(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182473456 1430473636 /nfs/dbraw/zinc/47/36/36/1430473636.db2.gz PUXMTROXWPHRFE-AWEZNQCLSA-N 0 0 399.422 3.258 20 5 GGBDRN CCOC(=O)Cc1csc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000182476290 1430473981 /nfs/dbraw/zinc/47/39/81/1430473981.db2.gz CFJKFTFQPARYNQ-SECBINFHSA-N 0 0 381.385 3.038 20 5 GGBDRN C[C@@H](c1cccc(Cl)c1)S(=O)(=O)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182509152 1430480382 /nfs/dbraw/zinc/48/03/82/1430480382.db2.gz WAKXBUQHDLIJBW-WFASDCNBSA-N 0 0 399.852 3.164 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1NC(C)=O ZINC000182510599 1430480793 /nfs/dbraw/zinc/48/07/93/1430480793.db2.gz QUKCPPYMAXWQJU-JTQLQIEISA-N 0 0 375.356 3.443 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000182511424 1430481089 /nfs/dbraw/zinc/48/10/89/1430481089.db2.gz SJACEVKCDYZBTL-SNVBAGLBSA-N 0 0 384.358 3.390 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000182527593 1430483762 /nfs/dbraw/zinc/48/37/62/1430483762.db2.gz HZYCDLBMYBGZGW-LBPRGKRZSA-N 0 0 381.392 3.454 20 5 GGBDRN C[C@H](C(=O)NCc1ccccc1CN1CCCC1=O)c1ccc([N+](=O)[O-])cc1F ZINC000182545796 1430488021 /nfs/dbraw/zinc/48/80/21/1430488021.db2.gz NJSAJKHKFYOAGV-AWEZNQCLSA-N 0 0 399.422 3.276 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1cn(-c2ccccc2)nc1C ZINC000182548895 1430488958 /nfs/dbraw/zinc/48/89/58/1430488958.db2.gz PDKSRZBNPWBBAU-UHFFFAOYSA-N 0 0 395.419 3.097 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc(F)cc1[N+](=O)[O-] ZINC000182552622 1430490300 /nfs/dbraw/zinc/49/03/00/1430490300.db2.gz SSOFZUXBBRFZCE-XJKSGUPXSA-N 0 0 379.775 3.230 20 5 GGBDRN O=C1NCCN(Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1C(F)(F)F ZINC000182573334 1430495648 /nfs/dbraw/zinc/49/56/48/1430495648.db2.gz BCUUAQWFMVZBTG-MRXNPFEDSA-N 0 0 379.338 3.287 20 5 GGBDRN O=C1NCCN(Cc2csc([N+](=O)[O-])c2)[C@H]1c1ccccc1C(F)(F)F ZINC000182575585 1430495926 /nfs/dbraw/zinc/49/59/26/1430495926.db2.gz BLYXTVFQAUPYNJ-AWEZNQCLSA-N 0 0 385.367 3.348 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1C(F)(F)F ZINC000182580160 1430496797 /nfs/dbraw/zinc/49/67/97/1430496797.db2.gz WLFWWOSKPODASJ-MRXNPFEDSA-N 0 0 379.338 3.287 20 5 GGBDRN O=C1NCCN(Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1C(F)(F)F ZINC000182580135 1430496895 /nfs/dbraw/zinc/49/68/95/1430496895.db2.gz WLFWWOSKPODASJ-INIZCTEOSA-N 0 0 379.338 3.287 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 ZINC000182591073 1430498591 /nfs/dbraw/zinc/49/85/91/1430498591.db2.gz DYBVVDSMOANNSE-OAHLLOKOSA-N 0 0 397.431 3.151 20 5 GGBDRN COc1cccc(C(=O)N2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000182592289 1430498918 /nfs/dbraw/zinc/49/89/18/1430498918.db2.gz SIDXGIZFFQKICS-MRXNPFEDSA-N 0 0 383.448 3.431 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NC[C@H](C)c2nc(C)cs2)cc([N+](=O)[O-])c1 ZINC000182599487 1430500072 /nfs/dbraw/zinc/50/00/72/1430500072.db2.gz IQUNWXBACOEGCX-JTQLQIEISA-N 0 0 377.422 3.070 20 5 GGBDRN Cc1csc([C@@H](C)CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000182605877 1430501141 /nfs/dbraw/zinc/50/11/41/1430501141.db2.gz NIAJJOFNDVSWQY-ZDUSSCGKSA-N 0 0 388.493 3.496 20 5 GGBDRN COc1cc(Cn2c(=O)oc3ccccc32)c([N+](=O)[O-])cc1OCC(F)F ZINC000182612163 1430502436 /nfs/dbraw/zinc/50/24/36/1430502436.db2.gz NCIPPBBKFTVKFO-UHFFFAOYSA-N 0 0 380.303 3.204 20 5 GGBDRN COc1ccc([C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000182633224 1430506204 /nfs/dbraw/zinc/50/62/04/1430506204.db2.gz QVQPIFMCHZPMTE-INIZCTEOSA-N 0 0 384.310 3.402 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000182643235 1430508370 /nfs/dbraw/zinc/50/83/70/1430508370.db2.gz BEUJVDCQDRQSDJ-UHFFFAOYSA-N 0 0 399.737 3.462 20 5 GGBDRN CC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])c2ccccc12 ZINC000182652097 1430510859 /nfs/dbraw/zinc/51/08/59/1430510859.db2.gz RPTUNHMYXHHOQI-UHFFFAOYSA-N 0 0 399.428 3.185 20 5 GGBDRN COCC(=O)N1CCc2c1cccc2NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000182660444 1430512369 /nfs/dbraw/zinc/51/23/69/1430512369.db2.gz JRNHZLMRZPMMHZ-UHFFFAOYSA-N 0 0 389.795 3.036 20 5 GGBDRN COc1cc(Cn2nnc(-c3ccsc3)n2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182673951 1430514625 /nfs/dbraw/zinc/51/46/25/1430514625.db2.gz PKBRGOOVALBSQW-UHFFFAOYSA-N 0 0 397.363 3.011 20 5 GGBDRN COCCOc1ccc(CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000182675951 1430515216 /nfs/dbraw/zinc/51/52/16/1430515216.db2.gz KMIGYRPYUKHXID-ZDUSSCGKSA-N 0 0 376.384 3.179 20 5 GGBDRN COc1cc(Cn2cnc3ccsc3c2=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000182678960 1430515758 /nfs/dbraw/zinc/51/57/58/1430515758.db2.gz LHTBYIJWLDXWQT-UHFFFAOYSA-N 0 0 397.359 3.067 20 5 GGBDRN COc1cccc(CC(=O)N2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000182694786 1430519268 /nfs/dbraw/zinc/51/92/68/1430519268.db2.gz QSVCOMPURLPJFA-KRWDZBQOSA-N 0 0 397.475 3.360 20 5 GGBDRN C[C@H](C(=O)N1CCC(CN2CCCCC2=O)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182709414 1430524145 /nfs/dbraw/zinc/52/41/45/1430524145.db2.gz AWGBZNATCGBCMT-AWEZNQCLSA-N 0 0 391.443 3.089 20 5 GGBDRN COc1cc(Cn2nc(C(C)(C)C)ccc2=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000182726794 1430528060 /nfs/dbraw/zinc/52/80/60/1430528060.db2.gz XGAFUXXCXIKYFS-UHFFFAOYSA-N 0 0 397.378 3.150 20 5 GGBDRN Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000182732695 1430529019 /nfs/dbraw/zinc/52/90/19/1430529019.db2.gz CHUILFHEEVHFKI-UHFFFAOYSA-N 0 0 394.497 3.278 20 5 GGBDRN O=C(NC1(CO)CCCC1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000182730843 1430529130 /nfs/dbraw/zinc/52/91/30/1430529130.db2.gz LRFYKNXXYKCIHB-UHFFFAOYSA-N 0 0 399.234 3.122 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N1CCC(OC2CCCC2)CC1 ZINC000182733561 1430529379 /nfs/dbraw/zinc/52/93/79/1430529379.db2.gz YVDBXCPUMJKAGW-UHFFFAOYSA-N 0 0 395.843 3.137 20 5 GGBDRN CC[C@@](C)(CCO)NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000182734558 1430529982 /nfs/dbraw/zinc/52/99/82/1430529982.db2.gz KYVGEDWYVBRCIO-HNNXBMFYSA-N 0 0 377.363 3.083 20 5 GGBDRN Cc1csc(CCCCNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1 ZINC000182736407 1430530369 /nfs/dbraw/zinc/53/03/69/1430530369.db2.gz LEYSBXOTSMBOJK-UHFFFAOYSA-N 0 0 396.856 3.091 20 5 GGBDRN O=C(NC1CC1)c1ccsc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182738454 1430530674 /nfs/dbraw/zinc/53/06/74/1430530674.db2.gz NPRMBRDMJNFMQS-UHFFFAOYSA-N 0 0 397.359 3.402 20 5 GGBDRN Cc1cnn(-c2ccncc2NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000182750413 1430533324 /nfs/dbraw/zinc/53/33/24/1430533324.db2.gz KTUXOQPAQQGXHO-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN Cc1cc(N[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)nn1-c1cccc(F)c1 ZINC000182758439 1430534905 /nfs/dbraw/zinc/53/49/05/1430534905.db2.gz GVUGSWJWVCHGCW-SFHVURJKSA-N 0 0 395.394 3.445 20 5 GGBDRN Cc1cc(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)nn1-c1cccc(F)c1 ZINC000182762242 1430535576 /nfs/dbraw/zinc/53/55/76/1430535576.db2.gz DDIPSBVPNLUXNE-UHFFFAOYSA-N 0 0 395.394 3.229 20 5 GGBDRN Cc1cc(NC(=O)N2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000182764156 1430536197 /nfs/dbraw/zinc/53/61/97/1430536197.db2.gz ZQSOFVBMAXMHID-UXLLHSPISA-N 0 0 376.457 3.009 20 5 GGBDRN Cc1csc([C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C2CC2)n1 ZINC000182795759 1430541390 /nfs/dbraw/zinc/54/13/90/1430541390.db2.gz JQGOCJIQUCKRGQ-CYBMUJFWSA-N 0 0 394.840 3.219 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(CN2CCOCC2)c(Cl)c1 ZINC000182796597 1430541870 /nfs/dbraw/zinc/54/18/70/1430541870.db2.gz MJAYHFVIMXEQQA-UHFFFAOYSA-N 0 0 389.839 3.262 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)cc([N+](=O)[O-])c1 ZINC000182801048 1430542213 /nfs/dbraw/zinc/54/22/13/1430542213.db2.gz QLLSJJVNEIUQRD-FZKQIMNGSA-N 0 0 383.404 3.390 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000182807986 1430543796 /nfs/dbraw/zinc/54/37/96/1430543796.db2.gz GYBYFIDFJHLZQR-AUUYWEPGSA-N 0 0 377.404 3.399 20 5 GGBDRN CC(C)[C@H](CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1cccnc1 ZINC000182823073 1430546957 /nfs/dbraw/zinc/54/69/57/1430546957.db2.gz RXXFANNHDIEZFM-AWEZNQCLSA-N 0 0 390.827 3.138 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000182825290 1430547848 /nfs/dbraw/zinc/54/78/48/1430547848.db2.gz RHJQTRWSJKUOGO-KUHUBIRLSA-N 0 0 377.404 3.399 20 5 GGBDRN Cc1nncn1-c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000182826361 1430548240 /nfs/dbraw/zinc/54/82/40/1430548240.db2.gz YJYYOPWSJQGILU-UHFFFAOYSA-N 0 0 389.318 3.338 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC[C@H](C3(C)OCCO3)C2)cc1[N+](=O)[O-] ZINC000182835863 1430550328 /nfs/dbraw/zinc/55/03/28/1430550328.db2.gz WOSLNMCOZUOAOX-ZBFHGGJFSA-N 0 0 377.441 3.149 20 5 GGBDRN O=C(CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000182850894 1430553412 /nfs/dbraw/zinc/55/34/12/1430553412.db2.gz IPKKNOSKHAEQQU-LBPRGKRZSA-N 0 0 397.357 3.086 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000182858910 1430555032 /nfs/dbraw/zinc/55/50/32/1430555032.db2.gz BVXHELJXFGAODU-BLLLJJGKSA-N 0 0 397.859 3.287 20 5 GGBDRN COc1cccc2[nH]cc(CC(=O)Nc3ccnn3-c3ccc([N+](=O)[O-])cc3)c21 ZINC000182859155 1430555134 /nfs/dbraw/zinc/55/51/34/1430555134.db2.gz YKFJLSCRCWLWTM-UHFFFAOYSA-N 0 0 391.387 3.452 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000182858888 1430555154 /nfs/dbraw/zinc/55/51/54/1430555154.db2.gz BVXHELJXFGAODU-LRDDRELGSA-N 0 0 397.859 3.287 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182866583 1430556566 /nfs/dbraw/zinc/55/65/66/1430556566.db2.gz TUIMSUZTHUNMMG-CYBMUJFWSA-N 0 0 382.342 3.216 20 5 GGBDRN O=C(NCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182880784 1430560840 /nfs/dbraw/zinc/56/08/40/1430560840.db2.gz PIJPDQIWOWELOY-UHFFFAOYSA-N 0 0 375.812 3.015 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cn(C)nc1-c1ccccc1 ZINC000182920164 1430571362 /nfs/dbraw/zinc/57/13/62/1430571362.db2.gz KXGSKGBKLUFZLY-UHFFFAOYSA-N 0 0 381.392 3.326 20 5 GGBDRN Cc1cc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)nn1-c1ccc(C)cc1 ZINC000182931106 1430574647 /nfs/dbraw/zinc/57/46/47/1430574647.db2.gz OVKIDJKEPFAEDI-UHFFFAOYSA-N 0 0 382.424 3.239 20 5 GGBDRN CCn1c2ccccc2nc1NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182948930 1430578544 /nfs/dbraw/zinc/57/85/44/1430578544.db2.gz VWLPKTFYMBLPLG-UHFFFAOYSA-N 0 0 395.419 3.053 20 5 GGBDRN O=C(Nc1nc(-c2ccc[nH]2)cs1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182949284 1430578880 /nfs/dbraw/zinc/57/88/80/1430578880.db2.gz KKELSLFBVAWVIN-UHFFFAOYSA-N 0 0 399.432 3.135 20 5 GGBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000182970630 1430582924 /nfs/dbraw/zinc/58/29/24/1430582924.db2.gz ILGAAIGKVPPLNH-XHDPSFHLSA-N 0 0 388.811 3.191 20 5 GGBDRN Cc1ccc([C@@H](C)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC000182979627 1430584583 /nfs/dbraw/zinc/58/45/83/1430584583.db2.gz WJJVNFAIRUSQTA-MRXNPFEDSA-N 0 0 383.448 3.478 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCNC(=O)[C@@H]1c1ccccc1Cl ZINC000182982640 1430584927 /nfs/dbraw/zinc/58/49/27/1430584927.db2.gz RZFYUDUUXMAQTO-INIZCTEOSA-N 0 0 388.811 3.262 20 5 GGBDRN Cc1c([C@H](C)Nc2ccc(CC(=O)N3CCOCC3)cc2)cccc1[N+](=O)[O-] ZINC000182983499 1430585194 /nfs/dbraw/zinc/58/51/94/1430585194.db2.gz FCGCMKKJZKQQKJ-INIZCTEOSA-N 0 0 383.448 3.478 20 5 GGBDRN NC(=O)C[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000182990682 1430586907 /nfs/dbraw/zinc/58/69/07/1430586907.db2.gz DNISEJAWGLJRFB-ZDUSSCGKSA-N 0 0 399.900 3.281 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000182995195 1430588054 /nfs/dbraw/zinc/58/80/54/1430588054.db2.gz STCZZEVCPHLBLF-BZNIZROVSA-N 0 0 388.811 3.191 20 5 GGBDRN CCc1[nH]n(C)c2nnc(NC(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])c1-2 ZINC000183015747 1430593093 /nfs/dbraw/zinc/59/30/93/1430593093.db2.gz FYJLIJWHAANONM-UHFFFAOYSA-N 0 0 394.844 3.151 20 5 GGBDRN CCCc1c(NC(=O)Cn2cc([N+](=O)[O-])nc2C)cnn1-c1cccc(F)c1 ZINC000183022568 1430594986 /nfs/dbraw/zinc/59/49/86/1430594986.db2.gz DDAUHTMLEWYMFK-UHFFFAOYSA-N 0 0 386.387 3.016 20 5 GGBDRN CCN(CCc1ccccc1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183042368 1430599005 /nfs/dbraw/zinc/59/90/05/1430599005.db2.gz RXVXSRMXGXYDSR-UHFFFAOYSA-N 0 0 383.448 3.136 20 5 GGBDRN CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c2ccc(F)cc21 ZINC000183052808 1430600769 /nfs/dbraw/zinc/60/07/69/1430600769.db2.gz WEIJSYZKHOAYKZ-UHFFFAOYSA-N 0 0 381.310 3.432 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H](C)c2ccc(OC(C)C)cc2)ccc1[N+](=O)[O-] ZINC000183055956 1430601397 /nfs/dbraw/zinc/60/13/97/1430601397.db2.gz KTRXSTYARQTMPV-OAHLLOKOSA-N 0 0 399.447 3.298 20 5 GGBDRN O=C(N[C@H]1CCCC[C@H]1n1cccn1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183062890 1430602772 /nfs/dbraw/zinc/60/27/72/1430602772.db2.gz OUWVWOXIVODRTC-UONOGXRCSA-N 0 0 380.351 3.306 20 5 GGBDRN O=C(N[C@@H]1CCCC[C@H]1n1cccn1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183062931 1430602790 /nfs/dbraw/zinc/60/27/90/1430602790.db2.gz OUWVWOXIVODRTC-ZIAGYGMSSA-N 0 0 380.351 3.306 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F ZINC000183079835 1430607824 /nfs/dbraw/zinc/60/78/24/1430607824.db2.gz DENOJUUSOVETNW-MFKMUULPSA-N 0 0 389.374 3.196 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000183079868 1430608122 /nfs/dbraw/zinc/60/81/22/1430608122.db2.gz DENOJUUSOVETNW-ZWNOBZJWSA-N 0 0 389.374 3.196 20 5 GGBDRN O=C(NC[C@@H]1COC2(CCOCC2)O1)c1cc2ccccc2c2cccnc12 ZINC000183095851 1430611386 /nfs/dbraw/zinc/61/13/86/1430611386.db2.gz JUXOUNMGSCIYKD-MRXNPFEDSA-N 0 0 378.428 3.040 20 5 GGBDRN COc1c(C)ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1C ZINC000183100193 1430612869 /nfs/dbraw/zinc/61/28/69/1430612869.db2.gz NIHTVWJXVXZJFD-UHFFFAOYSA-N 0 0 385.420 3.309 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H](C)c2cccc(OC(C)C)c2)ccc1[N+](=O)[O-] ZINC000183123820 1430620832 /nfs/dbraw/zinc/62/08/32/1430620832.db2.gz CATIYVOVWFYVJO-OAHLLOKOSA-N 0 0 399.447 3.298 20 5 GGBDRN Cc1cc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)nn1-c1ccc(C)cc1 ZINC000183125375 1430621731 /nfs/dbraw/zinc/62/17/31/1430621731.db2.gz QSHNKEWJXMPJPS-UHFFFAOYSA-N 0 0 380.360 3.378 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCc2ccccc2N2CCCCC2)c([N+](=O)[O-])c1 ZINC000183132556 1430623986 /nfs/dbraw/zinc/62/39/86/1430623986.db2.gz KRWZWICSQZQVMN-UHFFFAOYSA-N 0 0 397.431 3.093 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCCc2csc3ccccc23)ccc1[N+](=O)[O-] ZINC000183143287 1430627671 /nfs/dbraw/zinc/62/76/71/1430627671.db2.gz BVFHFHOWEMINCU-UHFFFAOYSA-N 0 0 397.456 3.207 20 5 GGBDRN CCC(CC)n1nc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1C ZINC000183144028 1430628315 /nfs/dbraw/zinc/62/83/15/1430628315.db2.gz OPBDQHNLCNCYSR-UHFFFAOYSA-N 0 0 385.468 3.423 20 5 GGBDRN COc1ccc(NC(C)=O)c(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000183149206 1430629333 /nfs/dbraw/zinc/62/93/33/1430629333.db2.gz HJODGKBPVWSTLU-SNVBAGLBSA-N 0 0 375.356 3.443 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000183155262 1430631573 /nfs/dbraw/zinc/63/15/73/1430631573.db2.gz YRXQKIOOEBVXRD-UHFFFAOYSA-N 0 0 385.420 3.471 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ncc(Cl)cc2Cl)C1=O ZINC000183164007 1430635508 /nfs/dbraw/zinc/63/55/08/1430635508.db2.gz ZTNQERRXYVGGCL-INIZCTEOSA-N 0 0 395.202 3.264 20 5 GGBDRN CC(C)(NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C(=O)NCC1CCCC1 ZINC000183165129 1430636227 /nfs/dbraw/zinc/63/62/27/1430636227.db2.gz NRALHBQCJVXNRJ-UHFFFAOYSA-N 0 0 399.394 3.011 20 5 GGBDRN CCOc1cc(F)ccc1NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183167729 1430636736 /nfs/dbraw/zinc/63/67/36/1430636736.db2.gz BEVDCQXDKNNFFG-UHFFFAOYSA-N 0 0 389.383 3.222 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)[C@@H](C)C2 ZINC000183173333 1430638306 /nfs/dbraw/zinc/63/83/06/1430638306.db2.gz DMOJZTQFBKXTTD-IQUTYRLHSA-N 0 0 381.432 3.071 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c(Cl)c1 ZINC000183178540 1430639763 /nfs/dbraw/zinc/63/97/63/1430639763.db2.gz BSVNJUXHQFGFPD-UHFFFAOYSA-N 0 0 399.737 3.462 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000183199043 1430645762 /nfs/dbraw/zinc/64/57/62/1430645762.db2.gz BLDSVKUAFPODPY-IBGZPJMESA-N 0 0 381.432 3.305 20 5 GGBDRN COc1cc(CN2CC[C@@H](Oc3cccc(F)c3)C2)c([N+](=O)[O-])cc1OC ZINC000183210116 1430649283 /nfs/dbraw/zinc/64/92/83/1430649283.db2.gz ABQPMGBXXYDKPG-MRXNPFEDSA-N 0 0 376.384 3.404 20 5 GGBDRN COc1ccc(OCCCNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000183225380 1430652107 /nfs/dbraw/zinc/65/21/07/1430652107.db2.gz BGTQALGWJSIXKA-CYBMUJFWSA-N 0 0 376.384 3.431 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000183223722 1430652170 /nfs/dbraw/zinc/65/21/70/1430652170.db2.gz KTUFETJJMAHBQZ-UGSOOPFHSA-N 0 0 387.436 3.150 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183234254 1430655260 /nfs/dbraw/zinc/65/52/60/1430655260.db2.gz CEXAJOUARCNNFZ-CQSZACIVSA-N 0 0 387.411 3.002 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1ccccc1 ZINC000183234258 1430655491 /nfs/dbraw/zinc/65/54/91/1430655491.db2.gz QVSOMMFWALWGLB-AWEZNQCLSA-N 0 0 392.408 3.160 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1CC(=O)c1ccccc1 ZINC000183236991 1430656702 /nfs/dbraw/zinc/65/67/02/1430656702.db2.gz SFMMKAMPGAQNIU-INIZCTEOSA-N 0 0 388.445 3.329 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000183239728 1430657172 /nfs/dbraw/zinc/65/71/72/1430657172.db2.gz MZEOPMJILWSOAR-AWEZNQCLSA-N 0 0 392.408 3.160 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc2nc(-c3ccccn3)oc2c1 ZINC000183243069 1430658104 /nfs/dbraw/zinc/65/81/04/1430658104.db2.gz YCADUVKVQFXNNZ-UHFFFAOYSA-N 0 0 378.348 3.023 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])c1cccs1 ZINC000183243064 1430658133 /nfs/dbraw/zinc/65/81/33/1430658133.db2.gz UWAJDSNUSOJEAL-NSHDSACASA-N 0 0 398.437 3.222 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@H]1CC(=O)c1cccs1 ZINC000183243765 1430658146 /nfs/dbraw/zinc/65/81/46/1430658146.db2.gz PVKMELAWHWBKKY-ZDUSSCGKSA-N 0 0 394.474 3.391 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1CN1C(=O)CCC1=O)c1ccc([N+](=O)[O-])cc1F ZINC000183244279 1430658635 /nfs/dbraw/zinc/65/86/35/1430658635.db2.gz IRACSPPBBOQNAW-LBPRGKRZSA-N 0 0 399.378 3.125 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)c1[N+](=O)[O-] ZINC000183247809 1430659115 /nfs/dbraw/zinc/65/91/15/1430659115.db2.gz QZJLFSLLSWNDAZ-UHFFFAOYSA-N 0 0 378.348 3.092 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@H]1CC(=O)c1cccs1 ZINC000183248268 1430659172 /nfs/dbraw/zinc/65/91/72/1430659172.db2.gz GDLQYVVCKDRMDA-ZDUSSCGKSA-N 0 0 394.474 3.391 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000183249514 1430659520 /nfs/dbraw/zinc/65/95/20/1430659520.db2.gz LJOMNBSCVMDXRO-CYBMUJFWSA-N 0 0 394.474 3.391 20 5 GGBDRN O=C(C[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000183254051 1430660402 /nfs/dbraw/zinc/66/04/02/1430660402.db2.gz GXEDDTIRRZAWNB-INIZCTEOSA-N 0 0 392.408 3.160 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000183252909 1430660627 /nfs/dbraw/zinc/66/06/27/1430660627.db2.gz 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CCOC(=O)CN(Cc1ccccc1)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183341040 1430682932 /nfs/dbraw/zinc/68/29/32/1430682932.db2.gz RGCSVXPLTMEHRD-CQSZACIVSA-N 0 0 388.395 3.429 20 5 GGBDRN COC(=O)CN(CCc1ccccc1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000183347112 1430684560 /nfs/dbraw/zinc/68/45/60/1430684560.db2.gz LVWPXXVTSOHSKZ-UHFFFAOYSA-N 0 0 390.823 3.035 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(Cl)ccc1N1CCCCC1 ZINC000183356131 1430687319 /nfs/dbraw/zinc/68/73/19/1430687319.db2.gz URJQYNCVZRLUGL-UHFFFAOYSA-N 0 0 375.816 3.468 20 5 GGBDRN CN(C[C@H]1CCCC[C@H]1O)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000183359188 1430688465 /nfs/dbraw/zinc/68/84/65/1430688465.db2.gz GTKZCTQFMADBEX-IIBYNOLFSA-N 0 0 378.472 3.164 20 5 GGBDRN COc1ccccc1C1(CNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000183366710 1430691334 /nfs/dbraw/zinc/69/13/34/1430691334.db2.gz ZFSYQDJVIRQRTO-UHFFFAOYSA-N 0 0 397.431 3.088 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CCO1 ZINC000183368273 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CCCNC(=O)C1(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CCCCC1 ZINC000183643201 1430761792 /nfs/dbraw/zinc/76/17/92/1430761792.db2.gz JUZBAIGHABSCAX-CYBMUJFWSA-N 0 0 379.432 3.183 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000183643967 1430762035 /nfs/dbraw/zinc/76/20/35/1430762035.db2.gz QLDBPYUCVMILRL-RHSMWYFYSA-N 0 0 399.422 3.177 20 5 GGBDRN CC[C@H](NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccc(F)cc1F ZINC000183647744 1430762775 /nfs/dbraw/zinc/76/27/75/1430762775.db2.gz UIMPBJZCTBEPBY-INIZCTEOSA-N 0 0 391.374 3.179 20 5 GGBDRN C[C@@H](C(=O)NCc1cc(F)cc2c1OCOC2)c1ccc([N+](=O)[O-])cc1F ZINC000183648558 1430763310 /nfs/dbraw/zinc/76/33/10/1430763310.db2.gz PDPRJJQDFCSBLA-SNVBAGLBSA-N 0 0 378.331 3.159 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@H](CO)C(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 ZINC000183651660 1430763848 /nfs/dbraw/zinc/76/38/48/1430763848.db2.gz LJICFZRNGKLGAP-SCLBCKFNSA-N 0 0 386.452 3.300 20 5 GGBDRN COc1cc(CN[C@@H](CO)c2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000183658305 1430765300 /nfs/dbraw/zinc/76/53/00/1430765300.db2.gz OULKSHMKUPODCH-AWEZNQCLSA-N 0 0 382.363 3.071 20 5 GGBDRN CC[C@@H](NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1cc(F)ccc1F ZINC000183663220 1430766678 /nfs/dbraw/zinc/76/66/78/1430766678.db2.gz AUZGMZLROOTUNB-MRXNPFEDSA-N 0 0 391.374 3.179 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(CC(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000183672405 1430768838 /nfs/dbraw/zinc/76/88/38/1430768838.db2.gz DVNSPUNYRLDRMI-UHFFFAOYSA-N 0 0 395.337 3.377 20 5 GGBDRN CC[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000183675137 1430769658 /nfs/dbraw/zinc/76/96/58/1430769658.db2.gz HDQOMVPUCLOMIP-KRWDZBQOSA-N 0 0 384.404 3.486 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000183682323 1430771571 /nfs/dbraw/zinc/77/15/71/1430771571.db2.gz CUELMADTPBDBNH-SFHVURJKSA-N 0 0 396.378 3.213 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000183691020 1430774318 /nfs/dbraw/zinc/77/43/18/1430774318.db2.gz GICIBPDMCKUXKG-INIZCTEOSA-N 0 0 396.378 3.213 20 5 GGBDRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](O)Cc1ccccc1 ZINC000183700735 1430776463 /nfs/dbraw/zinc/77/64/63/1430776463.db2.gz RMHNQBSLQGHQQI-WBMJQRKESA-N 0 0 394.880 3.449 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000183706426 1430777796 /nfs/dbraw/zinc/77/77/96/1430777796.db2.gz GPYIVXVYLWEVBS-GOSISDBHSA-N 0 0 396.378 3.213 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(Cc2nc3ccccc3s2)CC1 ZINC000183717353 1430779928 /nfs/dbraw/zinc/77/99/28/1430779928.db2.gz HKXOISFOAVYHMR-UHFFFAOYSA-N 0 0 396.472 3.471 20 5 GGBDRN COc1ccc([C@@H](C)CCNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000183735774 1430783593 /nfs/dbraw/zinc/78/35/93/1430783593.db2.gz CZAHFYYMJWHVIM-HNNXBMFYSA-N 0 0 392.477 3.259 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H](C)c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000183760681 1430788541 /nfs/dbraw/zinc/78/85/41/1430788541.db2.gz DMHWDSFPZYMAIA-NSHDSACASA-N 0 0 393.802 3.303 20 5 GGBDRN O=C(NC1(Cc2ccccc2)CCCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000183764634 1430788950 /nfs/dbraw/zinc/78/89/50/1430788950.db2.gz KJSNLJSZEOCUSW-UHFFFAOYSA-N 0 0 391.431 3.461 20 5 GGBDRN CCCCOc1cccc(CNc2cccc(S(N)(=O)=O)c2[N+](=O)[O-])c1 ZINC000183796842 1430796147 /nfs/dbraw/zinc/79/61/47/1430796147.db2.gz QKYBIWRSXVLDRR-UHFFFAOYSA-N 0 0 379.438 3.033 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)c(C)c1 ZINC000183814807 1430800415 /nfs/dbraw/zinc/80/04/15/1430800415.db2.gz RFUOGGLWJHDOJX-OAHLLOKOSA-N 0 0 380.759 3.340 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183825615 1430801721 /nfs/dbraw/zinc/80/17/21/1430801721.db2.gz KICAQQOIDGBCHH-AWEZNQCLSA-N 0 0 375.400 3.298 20 5 GGBDRN COc1cc(CSc2nnc(-c3ccncc3)n2C)c([N+](=O)[O-])cc1F ZINC000183829198 1430802221 /nfs/dbraw/zinc/80/22/21/1430802221.db2.gz ISRBDHXQSVRLAR-UHFFFAOYSA-N 0 0 375.385 3.225 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCN([C@@H](C)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000183835633 1430802931 /nfs/dbraw/zinc/80/29/31/1430802931.db2.gz CTHYVWQRNDOUNG-AWEZNQCLSA-N 0 0 395.506 3.032 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCN([C@H](C)c2ccsc2)CC1 ZINC000183835896 1430803036 /nfs/dbraw/zinc/80/30/36/1430803036.db2.gz OXRWQVQQYRXMNI-CQSZACIVSA-N 0 0 395.506 3.032 20 5 GGBDRN COc1cc(CSc2nc3nc(C)c(C)c(C)n3n2)c([N+](=O)[O-])cc1F ZINC000183852397 1430805103 /nfs/dbraw/zinc/80/51/03/1430805103.db2.gz MODGLKJLZHFXAL-UHFFFAOYSA-N 0 0 377.401 3.398 20 5 GGBDRN COc1cc(CSc2nncn2CCc2ccccn2)c([N+](=O)[O-])cc1F ZINC000183855633 1430805384 /nfs/dbraw/zinc/80/53/84/1430805384.db2.gz MHFWBPGFPRXILK-UHFFFAOYSA-N 0 0 389.412 3.264 20 5 GGBDRN CCn1c(SCc2cc(OC)c(F)cc2[N+](=O)[O-])nnc1-c1cnccn1 ZINC000183865252 1430806503 /nfs/dbraw/zinc/80/65/03/1430806503.db2.gz GQFCKFNGLNCKOM-UHFFFAOYSA-N 0 0 390.400 3.103 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NCc2ncc(-c3ccccc3)cn2)cc1[N+](=O)[O-] ZINC000183874519 1430807528 /nfs/dbraw/zinc/80/75/28/1430807528.db2.gz AQPHQVLFHMZRFS-UHFFFAOYSA-N 0 0 393.359 3.198 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000183876648 1430807791 /nfs/dbraw/zinc/80/77/91/1430807791.db2.gz FSJBENCESDEYOC-CRAIPNDOSA-N 0 0 381.432 3.038 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N(CC2CCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000183877854 1430807998 /nfs/dbraw/zinc/80/79/98/1430807998.db2.gz ZUGYLISGIHIJRT-UHFFFAOYSA-N 0 0 397.431 3.167 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000183884811 1430808943 /nfs/dbraw/zinc/80/89/43/1430808943.db2.gz JYWYWFRPPAUXBN-AWEZNQCLSA-N 0 0 387.411 3.308 20 5 GGBDRN C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000183892643 1430809644 /nfs/dbraw/zinc/80/96/44/1430809644.db2.gz CZRFBNQHHPXGID-RNODOKPDSA-N 0 0 395.415 3.333 20 5 GGBDRN Cc1coc(-c2cccc(NC(=O)CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)c2)n1 ZINC000183901467 1430810982 /nfs/dbraw/zinc/81/09/82/1430810982.db2.gz UVTRJRXKEWQKEW-UHFFFAOYSA-N 0 0 394.387 3.235 20 5 GGBDRN O=C(Nc1ccnn1-c1cccc(F)c1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000183903928 1430811180 /nfs/dbraw/zinc/81/11/80/1430811180.db2.gz GTXMSTZMHWYJGC-UHFFFAOYSA-N 0 0 392.350 3.358 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@H](C2(C)OCCO2)C1 ZINC000183905735 1430811396 /nfs/dbraw/zinc/81/13/96/1430811396.db2.gz PUMAILXHBUANNX-STQMWFEESA-N 0 0 397.859 3.050 20 5 GGBDRN O=C(Nc1ccnn1-c1cccc(F)c1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000183909441 1430811965 /nfs/dbraw/zinc/81/19/65/1430811965.db2.gz UEKWGXILYKCHGQ-UHFFFAOYSA-N 0 0 392.350 3.358 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000183951709 1430817673 /nfs/dbraw/zinc/81/76/73/1430817673.db2.gz DDEINSXAPNGAFS-UHFFFAOYSA-N 0 0 375.469 3.404 20 5 GGBDRN CCOc1ccc(NC(=O)CN(C)C[C@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000183960672 1430819149 /nfs/dbraw/zinc/81/91/49/1430819149.db2.gz JTMHQOPRNXFNPQ-LBPRGKRZSA-N 0 0 378.454 3.124 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1c(OC(C)C)ccc2ccccc21 ZINC000183964688 1430819728 /nfs/dbraw/zinc/81/97/28/1430819728.db2.gz OCFVFNYEJYDTNB-UHFFFAOYSA-N 0 0 382.420 3.357 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(C)C[C@H](C)c1nccs1 ZINC000183966035 1430819912 /nfs/dbraw/zinc/81/99/12/1430819912.db2.gz RYYAOFUSFSOQEG-RYUDHWBXSA-N 0 0 378.454 3.122 20 5 GGBDRN CCOc1cc(NC2CCN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CC2)ncn1 ZINC000183980740 1430822599 /nfs/dbraw/zinc/82/25/99/1430822599.db2.gz COWDFICXTTUGCI-UHFFFAOYSA-N 0 0 399.451 3.063 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)NC(C)(C)c1ncc(C)s1 ZINC000183981236 1430822796 /nfs/dbraw/zinc/82/27/96/1430822796.db2.gz LXDVFJAFEBWWTM-NSHDSACASA-N 0 0 378.454 3.220 20 5 GGBDRN C[C@]1(Cc2ccccc2)CCCN1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000183992491 1430825218 /nfs/dbraw/zinc/82/52/18/1430825218.db2.gz WSAJSRPHRPDGHV-OAQYLSRUSA-N 0 0 395.415 3.127 20 5 GGBDRN CC(C)[C@@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Cl)cc1F ZINC000184003377 1430827271 /nfs/dbraw/zinc/82/72/71/1430827271.db2.gz VUMDSHDYJQTMLU-QGZVFWFLSA-N 0 0 381.791 3.063 20 5 GGBDRN COc1cc(CNc2ccccc2CN2CCOCC2)c([N+](=O)[O-])cc1F ZINC000184006719 1430827798 /nfs/dbraw/zinc/82/77/98/1430827798.db2.gz OPHBERNCMJOLPH-UHFFFAOYSA-N 0 0 375.400 3.187 20 5 GGBDRN COc1cc(CNc2ccccc2N2CCC(O)CC2)c([N+](=O)[O-])cc1F ZINC000184006577 1430827818 /nfs/dbraw/zinc/82/78/18/1430827818.db2.gz VDNPBMXIHWXGSM-UHFFFAOYSA-N 0 0 375.400 3.316 20 5 GGBDRN C[C@@H]1CC[C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000184011072 1430828355 /nfs/dbraw/zinc/82/83/55/1430828355.db2.gz SENDTKNQQQBKAS-RDBSUJKOSA-N 0 0 375.425 3.224 20 5 GGBDRN CCOc1cc(C(=O)N(C)C)ccc1NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184017528 1430829469 /nfs/dbraw/zinc/82/94/69/1430829469.db2.gz CENIZOSEZAOWIS-UHFFFAOYSA-N 0 0 391.399 3.455 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184017771 1430829596 /nfs/dbraw/zinc/82/95/96/1430829596.db2.gz SOVQCOROLMLGKZ-GFCCVEGCSA-N 0 0 394.424 3.329 20 5 GGBDRN COc1cc(CNc2ccc(F)cc2CS(C)(=O)=O)c([N+](=O)[O-])cc1F ZINC000184018708 1430829829 /nfs/dbraw/zinc/82/98/29/1430829829.db2.gz IKTISCBHHHLPNZ-UHFFFAOYSA-N 0 0 386.376 3.038 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000184024130 1430830814 /nfs/dbraw/zinc/83/08/14/1430830814.db2.gz SBHLCNBMPFGUQU-CYBMUJFWSA-N 0 0 390.342 3.080 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)c2ncc(C)s2)cc1OC ZINC000184033598 1430832195 /nfs/dbraw/zinc/83/21/95/1430832195.db2.gz PUQOSLRMXHKQCT-SNVBAGLBSA-N 0 0 379.438 3.301 20 5 GGBDRN COc1cc(CSCc2nnnn2-c2ccccc2)c([N+](=O)[O-])cc1F ZINC000184036752 1430832509 /nfs/dbraw/zinc/83/25/09/1430832509.db2.gz NZIUDKLEOLAOKB-UHFFFAOYSA-N 0 0 375.385 3.152 20 5 GGBDRN Cc1oc2ccccc2c1CNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000184047154 1430833829 /nfs/dbraw/zinc/83/38/29/1430833829.db2.gz SZIKCXVCXGCXSV-UHFFFAOYSA-N 0 0 377.360 3.160 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCC(C)(C)CCOC)c([N+](=O)[O-])c1 ZINC000184052589 1430834664 /nfs/dbraw/zinc/83/46/64/1430834664.db2.gz FNPJGHCNBXUKJZ-UHFFFAOYSA-N 0 0 387.502 3.100 20 5 GGBDRN COCCC(C)(C)CNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000184052860 1430834751 /nfs/dbraw/zinc/83/47/51/1430834751.db2.gz TZLJYZIWPHOYCU-UHFFFAOYSA-N 0 0 380.832 3.269 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC(O)(Cc2cccc(F)c2)CC1 ZINC000184057084 1430835609 /nfs/dbraw/zinc/83/56/09/1430835609.db2.gz ORQWGLFUPWVLTN-UHFFFAOYSA-N 0 0 376.359 3.083 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)NCCC2=CCCCCC2)c([N+](=O)[O-])c1 ZINC000184137289 1430846289 /nfs/dbraw/zinc/84/62/89/1430846289.db2.gz XPIKQFJODAVKMC-UHFFFAOYSA-N 0 0 377.466 3.183 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCCCC[C@@H]1c1ncon1 ZINC000184141749 1430846646 /nfs/dbraw/zinc/84/66/46/1430846646.db2.gz XIQLTTVYDMVGFA-MRXNPFEDSA-N 0 0 385.424 3.336 20 5 GGBDRN COc1ccc([C@@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000184147011 1430847331 /nfs/dbraw/zinc/84/73/31/1430847331.db2.gz NGPLCWXPOZHMEX-SFHVURJKSA-N 0 0 376.434 3.174 20 5 GGBDRN COc1ccc([C@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000184146994 1430847400 /nfs/dbraw/zinc/84/74/00/1430847400.db2.gz NGPLCWXPOZHMEX-GOSISDBHSA-N 0 0 376.434 3.174 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)CCC2 ZINC000184148838 1430847486 /nfs/dbraw/zinc/84/74/86/1430847486.db2.gz YSEFETINZGIMCZ-GOSISDBHSA-N 0 0 381.432 3.135 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](COCC(C)C)c1ccco1 ZINC000184161329 1430848994 /nfs/dbraw/zinc/84/89/94/1430848994.db2.gz JJGMVTDTIDSEBI-QGZVFWFLSA-N 0 0 375.425 3.438 20 5 GGBDRN CC(C)COC[C@@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccco1 ZINC000184162194 1430849095 /nfs/dbraw/zinc/84/90/95/1430849095.db2.gz LNYUBDSJKACUIX-QGZVFWFLSA-N 0 0 387.436 3.080 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCN([C@H](C)c2nccs2)CC1 ZINC000184180518 1430851829 /nfs/dbraw/zinc/85/18/29/1430851829.db2.gz RFXWBSXDEMQSFR-OAHLLOKOSA-N 0 0 388.493 3.496 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000184183213 1430852472 /nfs/dbraw/zinc/85/24/72/1430852472.db2.gz PSKUHEMGUQYHNI-GFCCVEGCSA-N 0 0 394.884 3.153 20 5 GGBDRN Cc1oc2ccccc2c1CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000184190964 1430853971 /nfs/dbraw/zinc/85/39/71/1430853971.db2.gz HJSMYDCCAZZRNA-UHFFFAOYSA-N 0 0 377.360 3.160 20 5 GGBDRN COc1cc(CN2CC[C@H](CNC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184194340 1430854312 /nfs/dbraw/zinc/85/43/12/1430854312.db2.gz VXVYIPPVWXBMMD-GFCCVEGCSA-N 0 0 383.420 3.089 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)n2C ZINC000184196891 1430854710 /nfs/dbraw/zinc/85/47/10/1430854710.db2.gz SRPBOHAXXPPSFN-UHFFFAOYSA-N 0 0 388.811 3.002 20 5 GGBDRN Cc1ccc(CS(=O)(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)n[nH]2)cc1F ZINC000184206541 1430856165 /nfs/dbraw/zinc/85/61/65/1430856165.db2.gz ZIGPVLLMXBYLAE-UHFFFAOYSA-N 0 0 390.396 3.374 20 5 GGBDRN 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1430863450 /nfs/dbraw/zinc/86/34/50/1430863450.db2.gz UOTUOPPMVMHFNF-ZIAGYGMSSA-N 0 0 381.448 3.259 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000184257785 1430863478 /nfs/dbraw/zinc/86/34/78/1430863478.db2.gz HVODVBIBZVPPER-GOSISDBHSA-N 0 0 390.461 3.106 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184258466 1430863526 /nfs/dbraw/zinc/86/35/26/1430863526.db2.gz UOTUOPPMVMHFNF-UONOGXRCSA-N 0 0 381.448 3.259 20 5 GGBDRN COC(=O)[C@H](C)[C@@H](NCc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000184265044 1430864679 /nfs/dbraw/zinc/86/46/79/1430864679.db2.gz RCDUOVOGFLQUHZ-KZULUSFZSA-N 0 0 376.384 3.383 20 5 GGBDRN COC(=O)[C@H](C)[C@H](NCc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000184265014 1430864785 /nfs/dbraw/zinc/86/47/85/1430864785.db2.gz RCDUOVOGFLQUHZ-XIKOKIGWSA-N 0 0 376.384 3.383 20 5 GGBDRN CC(=O)NCCNC(=O)c1cccc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000184281115 1430867205 /nfs/dbraw/zinc/86/72/05/1430867205.db2.gz UOYACAQSUAYYCO-UHFFFAOYSA-N 0 0 393.852 3.265 20 5 GGBDRN CCS(=O)(=O)c1cc(F)ccc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000184285741 1430868267 /nfs/dbraw/zinc/86/82/67/1430868267.db2.gz SMQHHYRRBQDRKU-NSHDSACASA-N 0 0 395.412 3.410 20 5 GGBDRN COc1cc(OCC(=O)Nc2ccccc2-n2nccc2C)ccc1[N+](=O)[O-] ZINC000184303202 1430871056 /nfs/dbraw/zinc/87/10/56/1430871056.db2.gz CURXJUSYRPUOFM-UHFFFAOYSA-N 0 0 382.376 3.115 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NCc1ccc(OCc2ccccc2F)cc1 ZINC000184305790 1430871369 /nfs/dbraw/zinc/87/13/69/1430871369.db2.gz WYRJKESUXMWGOK-UHFFFAOYSA-N 0 0 398.394 3.216 20 5 GGBDRN COc1cccc(O[C@@H](C)CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000184307490 1430871560 /nfs/dbraw/zinc/87/15/60/1430871560.db2.gz OWDQDXACZHDHPI-STQMWFEESA-N 0 0 376.384 3.430 20 5 GGBDRN COc1ccc(O[C@@H](C)CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000184312647 1430871983 /nfs/dbraw/zinc/87/19/83/1430871983.db2.gz FLDGARJXLQBTJR-STQMWFEESA-N 0 0 376.384 3.430 20 5 GGBDRN COc1ccccc1O[C@H](C)CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184313476 1430871996 /nfs/dbraw/zinc/87/19/96/1430871996.db2.gz JZFNGGMBZBBYCO-OLZOCXBDSA-N 0 0 376.384 3.430 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184313496 1430872025 /nfs/dbraw/zinc/87/20/25/1430872025.db2.gz JZFNGGMBZBBYCO-QWHCGFSZSA-N 0 0 376.384 3.430 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184313458 1430872098 /nfs/dbraw/zinc/87/20/98/1430872098.db2.gz JZFNGGMBZBBYCO-STQMWFEESA-N 0 0 376.384 3.430 20 5 GGBDRN COc1ccc(CC[C@@H](C)NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000184316945 1430872469 /nfs/dbraw/zinc/87/24/69/1430872469.db2.gz KDOQLXWYHJEFLU-CQSZACIVSA-N 0 0 378.450 3.044 20 5 GGBDRN O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1[nH]ncc1[N+](=O)[O-] ZINC000184323898 1430873222 /nfs/dbraw/zinc/87/32/22/1430873222.db2.gz CVMBDAPVULZGQT-UHFFFAOYSA-N 0 0 398.250 3.019 20 5 GGBDRN COc1cc(S(=O)(=O)NCc2c(C)oc3ccccc32)ccc1[N+](=O)[O-] ZINC000184328289 1430873726 /nfs/dbraw/zinc/87/37/26/1430873726.db2.gz ZGAZFMTVVACZOK-UHFFFAOYSA-N 0 0 376.390 3.137 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000184329965 1430873953 /nfs/dbraw/zinc/87/39/53/1430873953.db2.gz CMIVEUXDYSKVIF-KBPBESRZSA-N 0 0 380.416 3.418 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000184331260 1430873985 /nfs/dbraw/zinc/87/39/85/1430873985.db2.gz NPILJNFTTYBEAD-AWEZNQCLSA-N 0 0 385.420 3.337 20 5 GGBDRN COC(=O)[C@H](C)Cc1ccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000184352488 1430876825 /nfs/dbraw/zinc/87/68/25/1430876825.db2.gz RYFKTRZWCPZHDW-CQSZACIVSA-N 0 0 385.420 3.305 20 5 GGBDRN COC(=O)[C@@H](C)Cc1ccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000184352509 1430877082 /nfs/dbraw/zinc/87/70/82/1430877082.db2.gz RYFKTRZWCPZHDW-AWEZNQCLSA-N 0 0 385.420 3.305 20 5 GGBDRN Cc1cccc2c(=O)n(CCC(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)cnc12 ZINC000184356309 1430877577 /nfs/dbraw/zinc/87/75/77/1430877577.db2.gz ZKKFYEMOHFPFPJ-UHFFFAOYSA-N 0 0 380.404 3.259 20 5 GGBDRN CCCN(CCc1cccs1)C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000184363108 1430878304 /nfs/dbraw/zinc/87/83/04/1430878304.db2.gz RCCDVTZLFCRAMN-CQSZACIVSA-N 0 0 389.477 3.256 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000184369401 1430879190 /nfs/dbraw/zinc/87/91/90/1430879190.db2.gz DQDHKNWBBKYHBT-LBPRGKRZSA-N 0 0 382.388 3.192 20 5 GGBDRN O=C(NCc1cnn(-c2ccccc2)c1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184369327 1430879252 /nfs/dbraw/zinc/87/92/52/1430879252.db2.gz FJUUPBLRLUNTEP-UHFFFAOYSA-N 0 0 385.811 3.433 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184374049 1430880010 /nfs/dbraw/zinc/88/00/10/1430880010.db2.gz VNSOHLFRPGMHDR-CQSZACIVSA-N 0 0 396.415 3.235 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@@H](c3c(F)cccc3F)C2)ccc1[N+](=O)[O-] ZINC000184374729 1430880349 /nfs/dbraw/zinc/88/03/49/1430880349.db2.gz PPRUAXAFPXHKIW-LLVKDONJSA-N 0 0 398.387 3.060 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccc(Oc2ccccc2)nc1 ZINC000184382163 1430881151 /nfs/dbraw/zinc/88/11/51/1430881151.db2.gz HIXCCSQCDROIGN-UHFFFAOYSA-N 0 0 399.428 3.402 20 5 GGBDRN CC[C@@H](N[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000184394971 1430882737 /nfs/dbraw/zinc/88/27/37/1430882737.db2.gz NSNHNDNMAGBLBV-WCQYABFASA-N 0 0 378.454 3.436 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000184395268 1430882755 /nfs/dbraw/zinc/88/27/55/1430882755.db2.gz WCPSFJOFBKEFQC-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN COc1cc(/C=C/C(=O)Nc2c([N+](=O)[O-])cnn2C)cc(Cl)c1OC(C)C ZINC000184412706 1430884775 /nfs/dbraw/zinc/88/47/75/1430884775.db2.gz OYMVCHGSFILQFO-AATRIKPKSA-N 0 0 394.815 3.429 20 5 GGBDRN CC(C)(C)[S@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N)c1 ZINC000184414071 1430885073 /nfs/dbraw/zinc/88/50/73/1430885073.db2.gz NSJCMRMWHGEKHO-AREMUKBSSA-N 0 0 375.450 3.477 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NCCc3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1 ZINC000184430353 1430887084 /nfs/dbraw/zinc/88/70/84/1430887084.db2.gz JFAFIMWZZKPVKT-IYBDPMFKSA-N 0 0 383.448 3.499 20 5 GGBDRN O=C(c1cccc(NCCc2ccc([N+](=O)[O-])cc2)c1)N1CCC[C@@H](CO)C1 ZINC000184432840 1430887399 /nfs/dbraw/zinc/88/73/99/1430887399.db2.gz XIJPFZBQDQKBON-QGZVFWFLSA-N 0 0 383.448 3.094 20 5 GGBDRN O=C(Cc1ccc(NCCc2ccc([N+](=O)[O-])cc2)cc1)N1CCSCC1 ZINC000184435345 1430887508 /nfs/dbraw/zinc/88/75/08/1430887508.db2.gz JJLLCMRRDIGMRL-UHFFFAOYSA-N 0 0 385.489 3.367 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1sccc1C(=O)OC(C)(C)C ZINC000184454494 1430889889 /nfs/dbraw/zinc/88/98/89/1430889889.db2.gz XVQGWLQJKNYINJ-UHFFFAOYSA-N 0 0 380.426 3.145 20 5 GGBDRN O=C(NCc1ccc(Cn2ccnc2)cc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184460103 1430890182 /nfs/dbraw/zinc/89/01/82/1430890182.db2.gz IZEIOWNWRKBWJS-UHFFFAOYSA-N 0 0 399.838 3.492 20 5 GGBDRN COc1ccc(CN2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1F ZINC000184462966 1430890725 /nfs/dbraw/zinc/89/07/25/1430890725.db2.gz VRSYJFMDCLWEDH-UHFFFAOYSA-N 0 0 387.411 3.009 20 5 GGBDRN Cc1cn(-c2ccccc2)nc1C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000184470863 1430891393 /nfs/dbraw/zinc/89/13/93/1430891393.db2.gz KNPPWHMREPBFDT-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)CC(=O)N2 ZINC000184474390 1430892016 /nfs/dbraw/zinc/89/20/16/1430892016.db2.gz NSTJNRBVYRLFIT-JTQLQIEISA-N 0 0 388.811 3.303 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCN(C(=O)Cc2ccccc2)CC1 ZINC000184478853 1430892198 /nfs/dbraw/zinc/89/21/98/1430892198.db2.gz KYMZVOCYQIXHGL-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000184480411 1430892395 /nfs/dbraw/zinc/89/23/95/1430892395.db2.gz MXXZRWSJMDOUFE-AWEZNQCLSA-N 0 0 388.424 3.199 20 5 GGBDRN COc1cc(CCNC(=O)Nc2c(C)cccc2F)c([N+](=O)[O-])cc1OC ZINC000184480363 1430892434 /nfs/dbraw/zinc/89/24/34/1430892434.db2.gz XVHWSZFCPKHBGW-UHFFFAOYSA-N 0 0 377.372 3.424 20 5 GGBDRN COc1cccc(F)c1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000184479537 1430892495 /nfs/dbraw/zinc/89/24/95/1430892495.db2.gz QPRYRKLQSPWWTQ-UHFFFAOYSA-N 0 0 389.339 3.069 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000184487867 1430893550 /nfs/dbraw/zinc/89/35/50/1430893550.db2.gz NUOAZGLPMBHBSM-QGZVFWFLSA-N 0 0 396.447 3.382 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 ZINC000184512437 1430896659 /nfs/dbraw/zinc/89/66/59/1430896659.db2.gz BAQJIBYFPLUSDY-IEBWSBKVSA-N 0 0 397.431 3.187 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 ZINC000184512425 1430896731 /nfs/dbraw/zinc/89/67/31/1430896731.db2.gz BAQJIBYFPLUSDY-MJGOQNOKSA-N 0 0 397.431 3.187 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC000184512386 1430896780 /nfs/dbraw/zinc/89/67/80/1430896780.db2.gz BAQJIBYFPLUSDY-HKUYNNGSSA-N 0 0 397.431 3.187 20 5 GGBDRN CC(C)c1noc(CCCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000184529786 1430898970 /nfs/dbraw/zinc/89/89/70/1430898970.db2.gz CVAQZBIPFVCTQK-UHFFFAOYSA-N 0 0 381.820 3.187 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000184528643 1430899012 /nfs/dbraw/zinc/89/90/12/1430899012.db2.gz SHQHQLLPLKKVDL-UHFFFAOYSA-N 0 0 393.403 3.283 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCSC[C@@H]2c2nccs2)cc1[N+](=O)[O-] ZINC000184534924 1430899663 /nfs/dbraw/zinc/89/96/63/1430899663.db2.gz KOUURAKNQLAVJN-CYBMUJFWSA-N 0 0 394.434 3.198 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccccc1-n1nccc1C ZINC000184545514 1430902019 /nfs/dbraw/zinc/90/20/19/1430902019.db2.gz XISCPYBWTMSWRD-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000184558436 1430904315 /nfs/dbraw/zinc/90/43/15/1430904315.db2.gz XMDNXCQJJNLPTR-ZDUSSCGKSA-N 0 0 387.417 3.430 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000184568291 1430906943 /nfs/dbraw/zinc/90/69/43/1430906943.db2.gz PPMKOAJGEVEIEV-UHFFFAOYSA-N 0 0 389.477 3.310 20 5 GGBDRN CC(C)n1nnnc1-c1ccccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000184579401 1430908524 /nfs/dbraw/zinc/90/85/24/1430908524.db2.gz AUXWQLMEUZIMQE-UHFFFAOYSA-N 0 0 380.408 3.401 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000184581523 1430908944 /nfs/dbraw/zinc/90/89/44/1430908944.db2.gz YGTXYOBKWFMJCM-FQEVSTJZSA-N 0 0 397.410 3.094 20 5 GGBDRN CC(C)n1nnnc1-c1ccccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000184582730 1430909594 /nfs/dbraw/zinc/90/95/94/1430909594.db2.gz UWEFHEMKHAYKID-UHFFFAOYSA-N 0 0 395.423 3.270 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])[C@H](C)CO1 ZINC000184584721 1430909855 /nfs/dbraw/zinc/90/98/55/1430909855.db2.gz QHAFURPRJBAQCH-DNVCBOLYSA-N 0 0 390.461 3.195 20 5 GGBDRN COc1ccc(C(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)cc1[N+](=O)[O-] ZINC000184597344 1430913726 /nfs/dbraw/zinc/91/37/26/1430913726.db2.gz ILKIUQYFNQXYEZ-UHFFFAOYSA-N 0 0 394.391 3.153 20 5 GGBDRN CSc1c(F)cc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1F ZINC000184604223 1430916582 /nfs/dbraw/zinc/91/65/82/1430916582.db2.gz QFDZIWQXBBPQDM-VIFPVBQESA-N 0 0 395.387 3.352 20 5 GGBDRN CC(C)[C@H](Cc1ccc(F)cc1)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184606333 1430917352 /nfs/dbraw/zinc/91/73/52/1430917352.db2.gz BTSKKHWMHDSMKA-KRWDZBQOSA-N 0 0 380.441 3.421 20 5 GGBDRN Cc1cc(NC(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000184612873 1430919693 /nfs/dbraw/zinc/91/96/93/1430919693.db2.gz XPSKLBWOSRGPDI-INIZCTEOSA-N 0 0 382.420 3.073 20 5 GGBDRN COC(=O)C[C@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000184621357 1430922258 /nfs/dbraw/zinc/92/22/58/1430922258.db2.gz PTGSFPVRHQVWCN-SNVBAGLBSA-N 0 0 375.303 3.173 20 5 GGBDRN COc1ccc(OC)c(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000184639692 1430926864 /nfs/dbraw/zinc/92/68/64/1430926864.db2.gz LLQCZDVHYBKHGU-UHFFFAOYSA-N 0 0 393.827 3.307 20 5 GGBDRN C[C@@H]1CCc2c(F)cccc2[C@H]1NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184645167 1430928858 /nfs/dbraw/zinc/92/88/58/1430928858.db2.gz WPJBNBXSVQQNSY-XIKOKIGWSA-N 0 0 378.425 3.477 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](CC(C)C)N1CCOCC1 ZINC000184661431 1430933694 /nfs/dbraw/zinc/93/36/94/1430933694.db2.gz DHQOIPBIOFMVLB-QUCCMNQESA-N 0 0 391.512 3.027 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C(=O)c2ccoc2)CC1 ZINC000184663938 1430934617 /nfs/dbraw/zinc/93/46/17/1430934617.db2.gz NMOZLCSVINLRAL-INIZCTEOSA-N 0 0 399.447 3.178 20 5 GGBDRN C[C@@H](C(=O)N1CCC(OC[C@@H]2CCCO2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184690523 1430943608 /nfs/dbraw/zinc/94/36/08/1430943608.db2.gz HUXZJYVWABSXBJ-CJNGLKHVSA-N 0 0 380.416 3.024 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)S(=O)(=O)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000184694481 1430944620 /nfs/dbraw/zinc/94/46/20/1430944620.db2.gz OHGTVJMXDRZPAZ-HNNXBMFYSA-N 0 0 395.506 3.453 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184696701 1430945269 /nfs/dbraw/zinc/94/52/69/1430945269.db2.gz QZQSNYXTWZYKGR-GFCCVEGCSA-N 0 0 391.474 3.255 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(-n2ccnc2C)nc1 ZINC000184702053 1430946810 /nfs/dbraw/zinc/94/68/10/1430946810.db2.gz RRUBXHJXMXVUMV-SFHVURJKSA-N 0 0 393.447 3.369 20 5 GGBDRN Cc1ccc(Cl)c(OC[C@@H](O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000184704562 1430947087 /nfs/dbraw/zinc/94/70/87/1430947087.db2.gz SCBQMXWLEOXNGV-HNNXBMFYSA-N 0 0 388.811 3.255 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCN(CC(F)(F)F)CC1 ZINC000184709637 1430948397 /nfs/dbraw/zinc/94/83/97/1430948397.db2.gz YJJHCCTWQLLCKT-HNNXBMFYSA-N 0 0 387.402 3.260 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(CC(F)(F)F)CC1 ZINC000184710781 1430948690 /nfs/dbraw/zinc/94/86/90/1430948690.db2.gz KVHGZAUUCSEEMM-CQSZACIVSA-N 0 0 387.402 3.306 20 5 GGBDRN Nc1ccc2c(c1)CCC[C@H]2NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000184711410 1430948969 /nfs/dbraw/zinc/94/89/69/1430948969.db2.gz XFKXQYOEENBGLG-CQSZACIVSA-N 0 0 381.841 3.186 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C(=O)CC(C)C)CC1 ZINC000184709841 1430948984 /nfs/dbraw/zinc/94/89/84/1430948984.db2.gz WJYUVROHAZTQMH-QGZVFWFLSA-N 0 0 389.496 3.317 20 5 GGBDRN Nc1ccc2c(c1)CCC[C@@H]2NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000184711391 1430949025 /nfs/dbraw/zinc/94/90/25/1430949025.db2.gz XFKXQYOEENBGLG-AWEZNQCLSA-N 0 0 381.841 3.186 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184716997 1430951272 /nfs/dbraw/zinc/95/12/72/1430951272.db2.gz GIMCDCAQFJXMGT-ZWKOTPCHSA-N 0 0 389.496 3.318 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184717029 1430951854 /nfs/dbraw/zinc/95/18/54/1430951854.db2.gz GIMCDCAQFJXMGT-QZTJIDSGSA-N 0 0 389.496 3.318 20 5 GGBDRN CCc1nc([C@H](C)N[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cs1 ZINC000184720507 1430952897 /nfs/dbraw/zinc/95/28/97/1430952897.db2.gz IYBDVVOAPMYPMV-WDEREUQCSA-N 0 0 378.454 3.300 20 5 GGBDRN Cc1cc(C[NH+]2CCSCC2)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1[O-] ZINC000184725845 1430954843 /nfs/dbraw/zinc/95/48/43/1430954843.db2.gz IRCXQSOCRVBQGI-UHFFFAOYSA-N 0 0 387.461 3.410 20 5 GGBDRN Cc1nn(CCC(=O)N2CCN(C3CC3)c3c(C)cccc32)c(C)c1[N+](=O)[O-] ZINC000184733274 1430957223 /nfs/dbraw/zinc/95/72/23/1430957223.db2.gz SPVYFQSGBBQTKS-UHFFFAOYSA-N 0 0 383.452 3.122 20 5 GGBDRN CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000184766859 1430970970 /nfs/dbraw/zinc/97/09/70/1430970970.db2.gz SNLTWARWJYDXJM-MNOVXSKESA-N 0 0 377.422 3.036 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCN(C3CC3)c3c(C)cccc32)cc([N+](=O)[O-])c1 ZINC000184768936 1430971570 /nfs/dbraw/zinc/97/15/70/1430971570.db2.gz ZNSMEBYRPQWCEV-UHFFFAOYSA-N 0 0 395.415 3.319 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@H](O)COc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000184777202 1430975078 /nfs/dbraw/zinc/97/50/78/1430975078.db2.gz SCBGLZYKDCYEMS-HNNXBMFYSA-N 0 0 377.368 3.074 20 5 GGBDRN CCOC(=O)c1csc(CNC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000184785727 1430977291 /nfs/dbraw/zinc/97/72/91/1430977291.db2.gz ROICUSKRRXMXII-ZDUSSCGKSA-N 0 0 391.449 3.113 20 5 GGBDRN CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184786696 1430977563 /nfs/dbraw/zinc/97/75/63/1430977563.db2.gz RFHQDOLKEPDPDE-GHMZBOCLSA-N 0 0 377.422 3.036 20 5 GGBDRN CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184786737 1430977602 /nfs/dbraw/zinc/97/76/02/1430977602.db2.gz RFHQDOLKEPDPDE-MNOVXSKESA-N 0 0 377.422 3.036 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C ZINC000184788475 1430977934 /nfs/dbraw/zinc/97/79/34/1430977934.db2.gz ABTRWJOPXXGYFQ-ZMSDIMECSA-N 0 0 375.469 3.069 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3c2cc(F)cc3F)c2ncccc12 ZINC000184808510 1430984209 /nfs/dbraw/zinc/98/42/09/1430984209.db2.gz FMNKODBIIKIVRS-UHFFFAOYSA-N 0 0 391.355 3.173 20 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CCOc1cc(F)ccc1NC(=O)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184824200 1430991399 /nfs/dbraw/zinc/99/13/99/1430991399.db2.gz AODQGOITXLIQML-UHFFFAOYSA-N 0 0 395.774 3.041 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(C(F)F)c1 ZINC000184823992 1430991642 /nfs/dbraw/zinc/99/16/42/1430991642.db2.gz JJIOVYRUNIRXSX-UHFFFAOYSA-N 0 0 383.738 3.441 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc2scnc2c1 ZINC000184828034 1430992947 /nfs/dbraw/zinc/99/29/47/1430992947.db2.gz ZZLYRRNSRIIOQQ-UHFFFAOYSA-N 0 0 390.808 3.113 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000184827143 1430993473 /nfs/dbraw/zinc/99/34/73/1430993473.db2.gz XURPMFSWZNMPHM-UHFFFAOYSA-N 0 0 391.811 3.290 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN([C@@H](C)c2nccs2)CC1 ZINC000184826741 1430993483 /nfs/dbraw/zinc/99/34/83/1430993483.db2.gz FREGOCBGURCZGI-ZDUSSCGKSA-N 0 0 375.454 3.270 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN([C@H](C)c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000184826652 1430993489 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0 399.428 3.428 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)cc1F ZINC000184867045 1431007311 /nfs/dbraw/zinc/00/73/11/1431007311.db2.gz JDBLTHKMJCFXSK-UHFFFAOYSA-N 0 0 391.380 3.116 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2nc3cc(C)ccc3n2C)cc1OC ZINC000184878813 1431010668 /nfs/dbraw/zinc/01/06/68/1431010668.db2.gz ALKBWWVJZGVGON-UHFFFAOYSA-N 0 0 398.419 3.127 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1ccc(OCCC(F)(F)F)cc1 ZINC000184889696 1431013591 /nfs/dbraw/zinc/01/35/91/1431013591.db2.gz BIDHVBXPERLHSN-UHFFFAOYSA-N 0 0 387.314 3.174 20 5 GGBDRN Cc1ccc(CCN(Cc2ccco2)C(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000184901829 1431017360 /nfs/dbraw/zinc/01/73/60/1431017360.db2.gz ZKSSLCCHIJMZCC-UHFFFAOYSA-N 0 0 380.404 3.359 20 5 GGBDRN C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000184906075 1431018224 /nfs/dbraw/zinc/01/82/24/1431018224.db2.gz ICMVQUWMQBVPNG-HOCLYGCPSA-N 0 0 383.404 3.340 20 5 GGBDRN C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000184906134 1431018345 /nfs/dbraw/zinc/01/83/45/1431018345.db2.gz ICMVQUWMQBVPNG-GDBMZVCRSA-N 0 0 383.404 3.340 20 5 GGBDRN C[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000184906115 1431018370 /nfs/dbraw/zinc/01/83/70/1431018370.db2.gz ICMVQUWMQBVPNG-GOEBONIOSA-N 0 0 383.404 3.340 20 5 GGBDRN CC(C)N(CC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000184907969 1431018802 /nfs/dbraw/zinc/01/88/02/1431018802.db2.gz VSCDXKSEWCLLML-UHFFFAOYSA-N 0 0 379.482 3.213 20 5 GGBDRN CCC(CC)[C@H](CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)N1CCOCC1 ZINC000184920611 1431021507 /nfs/dbraw/zinc/02/15/07/1431021507.db2.gz GZJPBDUZQHXNND-LIRRHRJNSA-N 0 0 395.475 3.091 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1ccc([N+](=O)[O-])cc1F ZINC000184922701 1431022336 /nfs/dbraw/zinc/02/23/36/1431022336.db2.gz OIEKJUBMJWQNNA-SNVBAGLBSA-N 0 0 398.387 3.160 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12 ZINC000184925915 1431023069 /nfs/dbraw/zinc/02/30/69/1431023069.db2.gz PHHANDPIMSIAKW-AEFFLSMTSA-N 0 0 395.459 3.365 20 5 GGBDRN C[C@H](C(=O)N1CCC[C@@H](c2nnc3ccccn32)C1)c1ccc([N+](=O)[O-])cc1F ZINC000184932393 1431024681 /nfs/dbraw/zinc/02/46/81/1431024681.db2.gz PFYDKPDHXHFCOX-UONOGXRCSA-N 0 0 397.410 3.286 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H](CO)c1ccc(OC)cc1 ZINC000184936248 1431025820 /nfs/dbraw/zinc/02/58/20/1431025820.db2.gz GQIBRSCTMRZHKI-OXJNMPFZSA-N 0 0 386.448 3.364 20 5 GGBDRN CC(=O)CCCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000184961259 1431031497 /nfs/dbraw/zinc/03/14/97/1431031497.db2.gz URNJOUOSPQGCHT-UHFFFAOYSA-N 0 0 387.358 3.022 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)c1C ZINC000184962871 1431031703 /nfs/dbraw/zinc/03/17/03/1431031703.db2.gz INZQMXUAECTIMY-ZDUSSCGKSA-N 0 0 386.429 3.481 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc([N+](=O)[O-])c1F ZINC000184967164 1431032791 /nfs/dbraw/zinc/03/27/91/1431032791.db2.gz SYKMNPMBQBLPLT-NSHDSACASA-N 0 0 390.392 3.311 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000184967845 1431032880 /nfs/dbraw/zinc/03/28/80/1431032880.db2.gz VXEGDSOGGXSFIN-ZDUSSCGKSA-N 0 0 386.429 3.481 20 5 GGBDRN C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O ZINC000184995454 1431038140 /nfs/dbraw/zinc/03/81/40/1431038140.db2.gz UKFQLHUNGFZGSK-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@@H](C(=O)N1CCN(Cc2cccc(F)c2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184998977 1431038933 /nfs/dbraw/zinc/03/89/33/1431038933.db2.gz TZUNUEDYLJIOLC-CQSZACIVSA-N 0 0 389.402 3.321 20 5 GGBDRN C[C@@H](OCCCNC(=O)COc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000185016450 1431042591 /nfs/dbraw/zinc/04/25/91/1431042591.db2.gz BRRLDNMIADQBAI-CQSZACIVSA-N 0 0 376.384 3.397 20 5 GGBDRN Cc1cc(NC(=O)COc2c(F)cccc2[N+](=O)[O-])n(-c2ccccc2F)n1 ZINC000185016259 1431042624 /nfs/dbraw/zinc/04/26/24/1431042624.db2.gz SJQORHMZMNQRNP-UHFFFAOYSA-N 0 0 388.330 3.385 20 5 GGBDRN C[C@@H](C(=O)N[C@@](C)(C(N)=O)c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1F ZINC000185021161 1431043267 /nfs/dbraw/zinc/04/32/67/1431043267.db2.gz CDRUUUJBSWERFH-MLCYQJTMSA-N 0 0 393.802 3.008 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O ZINC000185022080 1431043870 /nfs/dbraw/zinc/04/38/70/1431043870.db2.gz HAQBDWSNMOAJQE-ZDUSSCGKSA-N 0 0 381.388 3.028 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCN1CCCCCC1=O ZINC000185025783 1431044182 /nfs/dbraw/zinc/04/41/82/1431044182.db2.gz YBJUMEKKZVLLIS-QGZVFWFLSA-N 0 0 375.469 3.072 20 5 GGBDRN C[C@@H](C(=O)NCCc1cc(F)cc2c1OCOC2)c1ccc([N+](=O)[O-])cc1F ZINC000185026726 1431044623 /nfs/dbraw/zinc/04/46/23/1431044623.db2.gz FVSLTXAQAQYLLS-LLVKDONJSA-N 0 0 392.358 3.202 20 5 GGBDRN Cc1nc(N2CCOCC2)ccc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185028757 1431044824 /nfs/dbraw/zinc/04/48/24/1431044824.db2.gz LSBZFYMALOCBOM-LBPRGKRZSA-N 0 0 388.399 3.016 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1OCc1nnnn1-c1ccc(C(F)(F)F)cc1 ZINC000185034331 1431045878 /nfs/dbraw/zinc/04/58/78/1431045878.db2.gz RAVUJPKFOQJELU-UHFFFAOYSA-N 0 0 383.261 3.307 20 5 GGBDRN CN(CCCOc1ccc(F)cc1)C(=O)COc1c(F)cccc1[N+](=O)[O-] ZINC000185040978 1431047538 /nfs/dbraw/zinc/04/75/38/1431047538.db2.gz MFMZVQYTBGATDC-UHFFFAOYSA-N 0 0 380.347 3.179 20 5 GGBDRN CC(=O)Nc1cccc2c1CCN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)C2 ZINC000185058803 1431051436 /nfs/dbraw/zinc/05/14/36/1431051436.db2.gz WMDJNJLQKSDZNM-LBPRGKRZSA-N 0 0 385.395 3.381 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](C)c1nc(-c2cccc(F)c2)no1 ZINC000185070348 1431053933 /nfs/dbraw/zinc/05/39/33/1431053933.db2.gz LEZMEZKAIYQHSW-LBPRGKRZSA-N 0 0 399.382 3.382 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](C)c1nc(-c2cccc(F)c2)no1 ZINC000185070370 1431053937 /nfs/dbraw/zinc/05/39/37/1431053937.db2.gz LEZMEZKAIYQHSW-GFCCVEGCSA-N 0 0 399.382 3.382 20 5 GGBDRN Cn1nc(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000185072815 1431054689 /nfs/dbraw/zinc/05/46/89/1431054689.db2.gz FRDINMZGPXBDGW-UHFFFAOYSA-N 0 0 381.436 3.033 20 5 GGBDRN COc1cc2c(cc1CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)O[C@@H](C)C2 ZINC000185076951 1431055117 /nfs/dbraw/zinc/05/51/17/1431055117.db2.gz PREIAHPWSNRPDQ-NWDGAFQWSA-N 0 0 388.395 3.486 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 ZINC000185079810 1431055638 /nfs/dbraw/zinc/05/56/38/1431055638.db2.gz ZLUUKYXQNLNWEH-UHFFFAOYSA-N 0 0 379.416 3.465 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC2CCC(O)(c3cccnc3)CC2)c1 ZINC000185093128 1431058839 /nfs/dbraw/zinc/05/88/39/1431058839.db2.gz LKCSZXLDMAVALC-UHFFFAOYSA-N 0 0 399.447 3.014 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000185097732 1431060495 /nfs/dbraw/zinc/06/04/95/1431060495.db2.gz YGKDHWRTYXUJBF-UHFFFAOYSA-N 0 0 375.812 3.203 20 5 GGBDRN COc1cccc(NC[C@H](c2ccc(F)cc2)N2CCOCC2)c1[N+](=O)[O-] ZINC000185098561 1431060700 /nfs/dbraw/zinc/06/07/00/1431060700.db2.gz NPCFJYFYVSMGTD-QGZVFWFLSA-N 0 0 375.400 3.228 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)N1C[C@@H](C)O[C@@H](C)C1 ZINC000185099578 1431061171 /nfs/dbraw/zinc/06/11/71/1431061171.db2.gz YCBPREUIYTWGLC-JZXOWHBKSA-N 0 0 391.512 3.168 20 5 GGBDRN C[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000185103233 1431061670 /nfs/dbraw/zinc/06/16/70/1431061670.db2.gz GJFSDILPJCXPFL-GFCCVEGCSA-N 0 0 399.382 3.098 20 5 GGBDRN C[C@@H]1CSc2ccc(Cl)cc2N(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000185101339 1431061682 /nfs/dbraw/zinc/06/16/82/1431061682.db2.gz IEIPAFGOJJGFJR-NSHDSACASA-N 0 0 393.852 3.185 20 5 GGBDRN COc1ccc(F)cc1CN1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1 ZINC000185109951 1431063255 /nfs/dbraw/zinc/06/32/55/1431063255.db2.gz RKJUUOBPDZLRQS-UHFFFAOYSA-N 0 0 375.400 3.073 20 5 GGBDRN Cc1noc(-c2ccccc2)c1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000185114789 1431064339 /nfs/dbraw/zinc/06/43/39/1431064339.db2.gz XNWGYDUJFMZWDZ-UHFFFAOYSA-N 0 0 394.343 3.105 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNc2cccc(OC)c2[N+](=O)[O-])cc1 ZINC000185117360 1431064640 /nfs/dbraw/zinc/06/46/40/1431064640.db2.gz BOEFJGWISVPTNI-UHFFFAOYSA-N 0 0 393.465 3.246 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccnc(N2CCCC2)c1 ZINC000185121417 1431065290 /nfs/dbraw/zinc/06/52/90/1431065290.db2.gz GHUNTCIXCXENET-SFHVURJKSA-N 0 0 382.464 3.475 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(Cn2cncn2)cc1 ZINC000185123504 1431065939 /nfs/dbraw/zinc/06/59/39/1431065939.db2.gz YHADDWDRRREDQQ-LJQANCHMSA-N 0 0 393.447 3.120 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccn(-c2ccc(Cl)cc2)n1 ZINC000185126545 1431066970 /nfs/dbraw/zinc/06/69/70/1431066970.db2.gz ZNTGAQYUFIIVLW-UHFFFAOYSA-N 0 0 381.779 3.192 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC(C)(C)c1nc2ccccc2n1C ZINC000185127475 1431067210 /nfs/dbraw/zinc/06/72/10/1431067210.db2.gz CYFIHQADKPYUHL-UHFFFAOYSA-N 0 0 388.449 3.004 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(C)(C)c1nc2ccccc2n1C ZINC000185128738 1431067693 /nfs/dbraw/zinc/06/76/93/1431067693.db2.gz NZPUQELFRKFTFZ-UHFFFAOYSA-N 0 0 388.449 3.004 20 5 GGBDRN COc1cccc(NCc2ccccc2CS(=O)(=O)NC(C)C)c1[N+](=O)[O-] ZINC000185131147 1431068369 /nfs/dbraw/zinc/06/83/69/1431068369.db2.gz HPFLVWSBBCNODV-UHFFFAOYSA-N 0 0 393.465 3.043 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000185136414 1431069923 /nfs/dbraw/zinc/06/99/23/1431069923.db2.gz ZTVQVFXQLYZSAI-KRWDZBQOSA-N 0 0 394.836 3.068 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC[C@]3(C2)OCc2ccccc23)c1C ZINC000185140384 1431070832 /nfs/dbraw/zinc/07/08/32/1431070832.db2.gz KAXNYFCZKSJRBM-LJQANCHMSA-N 0 0 388.445 3.032 20 5 GGBDRN C[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1nc(C(C)(C)C)no1 ZINC000185142039 1431071142 /nfs/dbraw/zinc/07/11/42/1431071142.db2.gz PDINWQFAPKBGMI-SECBINFHSA-N 0 0 381.820 3.218 20 5 GGBDRN COc1cccc(NC2CCN(CC(=O)Nc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000185146617 1431072189 /nfs/dbraw/zinc/07/21/89/1431072189.db2.gz OWNRSNNDKWUQGE-UHFFFAOYSA-N 0 0 384.436 3.118 20 5 GGBDRN CN(C)C(=O)c1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000185148757 1431072867 /nfs/dbraw/zinc/07/28/67/1431072867.db2.gz DNXSUJJRVBQNJI-UHFFFAOYSA-N 0 0 377.397 3.167 20 5 GGBDRN C[C@@H](C(=O)N(Cc1ccncc1)C[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1F ZINC000185161392 1431074973 /nfs/dbraw/zinc/07/49/73/1431074973.db2.gz QUORRTPGUMIDFR-PBHICJAKSA-N 0 0 387.411 3.440 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)Nc1cc2c(cc1Cl)OCCCO2 ZINC000185169335 1431076488 /nfs/dbraw/zinc/07/64/88/1431076488.db2.gz TYWLGBFOJLUBMX-UHFFFAOYSA-N 0 0 392.799 3.122 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCOCC2(CCOCC2)C1 ZINC000185169516 1431076556 /nfs/dbraw/zinc/07/65/56/1431076556.db2.gz YIUUFPNOYNBMNV-UHFFFAOYSA-N 0 0 376.434 3.079 20 5 GGBDRN COC(=O)CC1(CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CCCCC1 ZINC000185170539 1431076907 /nfs/dbraw/zinc/07/69/07/1431076907.db2.gz MLZHFKBOYNEVRU-ZDUSSCGKSA-N 0 0 380.416 3.467 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cn2cncn2)cc1 ZINC000185194430 1431081666 /nfs/dbraw/zinc/08/16/66/1431081666.db2.gz PHOBTVBUILXKNK-QGZVFWFLSA-N 0 0 379.420 3.442 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1 ZINC000185194340 1431081899 /nfs/dbraw/zinc/08/18/99/1431081899.db2.gz QFVMIVARZMJDIR-MRXNPFEDSA-N 0 0 399.447 3.269 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 ZINC000185198097 1431082553 /nfs/dbraw/zinc/08/25/53/1431082553.db2.gz AAVJSCGFWANJFA-UKRRQHHQSA-N 0 0 397.431 3.372 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 ZINC000185198079 1431082557 /nfs/dbraw/zinc/08/25/57/1431082557.db2.gz AAVJSCGFWANJFA-HIFRSBDPSA-N 0 0 397.431 3.372 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C)c(-n2cnnn2)c1 ZINC000185197824 1431082736 /nfs/dbraw/zinc/08/27/36/1431082736.db2.gz MQRLWEJSPOUOPB-HNNXBMFYSA-N 0 0 380.408 3.086 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000185216689 1431087471 /nfs/dbraw/zinc/08/74/71/1431087471.db2.gz STMWZZOKWPOAAI-MRXNPFEDSA-N 0 0 399.447 3.317 20 5 GGBDRN CC(C)OCCNC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC000185220516 1431088121 /nfs/dbraw/zinc/08/81/21/1431088121.db2.gz WATQNFPDEPTTFI-UHFFFAOYSA-N 0 0 399.447 3.047 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCc2c(C(N)=O)cccc21 ZINC000185220983 1431088163 /nfs/dbraw/zinc/08/81/63/1431088163.db2.gz CVXAJMBEPXDTRG-OAHLLOKOSA-N 0 0 381.432 3.242 20 5 GGBDRN C[C@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nc(C2CCCCC2)no1 ZINC000185229232 1431089666 /nfs/dbraw/zinc/08/96/66/1431089666.db2.gz MPEBLTUXCOHKHJ-ZDUSSCGKSA-N 0 0 399.451 3.265 20 5 GGBDRN COc1cccc(N2CCC(NC(=O)NC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000185233817 1431090560 /nfs/dbraw/zinc/09/05/60/1431090560.db2.gz REKMDJHCSINFDP-UHFFFAOYSA-N 0 0 376.457 3.204 20 5 GGBDRN C[C@@H](C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000185233363 1431090621 /nfs/dbraw/zinc/09/06/21/1431090621.db2.gz RLXQGPKFGDWLJE-KUHUBIRLSA-N 0 0 399.422 3.145 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(=O)NC)ccc1OC ZINC000185237145 1431091468 /nfs/dbraw/zinc/09/14/68/1431091468.db2.gz BHMSROJVIXULOJ-CQSZACIVSA-N 0 0 385.420 3.170 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 ZINC000185237910 1431091489 /nfs/dbraw/zinc/09/14/89/1431091489.db2.gz ZDBNIVHGMFQNDC-QGZVFWFLSA-N 0 0 383.448 3.433 20 5 GGBDRN COc1cccc(NCc2ccccc2S(=O)(=O)NC(C)(C)C)c1[N+](=O)[O-] ZINC000185246492 1431092925 /nfs/dbraw/zinc/09/29/25/1431092925.db2.gz MAXXNGLEMFAQPS-UHFFFAOYSA-N 0 0 393.465 3.292 20 5 GGBDRN C[C@@H](C(=O)N1CCN([C@@H](C)c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185245067 1431092964 /nfs/dbraw/zinc/09/29/64/1431092964.db2.gz SJMXDCZCSGGZNX-CABCVRRESA-N 0 0 386.427 3.138 20 5 GGBDRN COc1cccc(N2CCN(C(=O)Cc3ccccc3Cl)CC2)c1[N+](=O)[O-] ZINC000185246238 1431092973 /nfs/dbraw/zinc/09/29/73/1431092973.db2.gz GDNFZGSIXYHPAS-UHFFFAOYSA-N 0 0 389.839 3.148 20 5 GGBDRN C[C@@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nc(C2CCCCC2)no1 ZINC000185245453 1431093008 /nfs/dbraw/zinc/09/30/08/1431093008.db2.gz YNIVFNCGAMXWQS-CYBMUJFWSA-N 0 0 399.451 3.265 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCN(C2CC2)c2ccc(F)cc21 ZINC000185250497 1431093838 /nfs/dbraw/zinc/09/38/38/1431093838.db2.gz LJOMSEBATGAIEU-UHFFFAOYSA-N 0 0 381.367 3.239 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCC(=O)NC1CCCCC1 ZINC000185266570 1431097001 /nfs/dbraw/zinc/09/70/01/1431097001.db2.gz ACAAIQJYFUMYGG-INIZCTEOSA-N 0 0 375.469 3.119 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC(O)(Cc2cccc(F)c2)CC1 ZINC000185282342 1431099460 /nfs/dbraw/zinc/09/94/60/1431099460.db2.gz FOBAKDRJNDFPRX-UHFFFAOYSA-N 0 0 387.411 3.013 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccn(Cc2ccncc2)n1 ZINC000185289699 1431100625 /nfs/dbraw/zinc/10/06/25/1431100625.db2.gz YFMVWQDCIZICPJ-KRWDZBQOSA-N 0 0 379.420 3.442 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CCC(N)=O)c1cccc(C)c1 ZINC000185298772 1431104001 /nfs/dbraw/zinc/10/40/01/1431104001.db2.gz XRHDHYLZSYCIJK-QGZVFWFLSA-N 0 0 383.448 3.381 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-n2nnnc2C)ccc1F ZINC000185306899 1431107807 /nfs/dbraw/zinc/10/78/07/1431107807.db2.gz OZDLBBOCFDICBI-CQSZACIVSA-N 0 0 398.398 3.225 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N[C@@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])c1 ZINC000185336107 1431118619 /nfs/dbraw/zinc/11/86/19/1431118619.db2.gz YISDRWWAAIUAAZ-BDJLRTHQSA-N 0 0 390.465 3.436 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N[C@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])c1 ZINC000185336091 1431118679 /nfs/dbraw/zinc/11/86/79/1431118679.db2.gz YISDRWWAAIUAAZ-ZBEGNZNMSA-N 0 0 390.465 3.436 20 5 GGBDRN CCc1c(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cnn1-c1ccc(OC)cc1 ZINC000185357414 1431125308 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AHUKTEWPKLAVMP-ZIAGYGMSSA-N 0 0 395.419 3.246 20 5 GGBDRN CCOC(=O)[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(OC)c(F)c1 ZINC000185390635 1431134093 /nfs/dbraw/zinc/13/40/93/1431134093.db2.gz KRMPBZREHSYTMY-SFHVURJKSA-N 0 0 376.384 3.445 20 5 GGBDRN C[C@H](N[C@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000185406123 1431137966 /nfs/dbraw/zinc/13/79/66/1431137966.db2.gz LXEWSNCSEFKSLK-DJJJIMSYSA-N 0 0 397.410 3.174 20 5 GGBDRN C[C@@H](N[C@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000185406143 1431138038 /nfs/dbraw/zinc/13/80/38/1431138038.db2.gz LXEWSNCSEFKSLK-YJYMSZOUSA-N 0 0 397.410 3.174 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2nccc3ccccc32)c2ncccc12 ZINC000185420028 1431141990 /nfs/dbraw/zinc/14/19/90/1431141990.db2.gz ASUTVFFBWLMCBQ-UHFFFAOYSA-N 0 0 394.412 3.170 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 ZINC000185439014 1431145724 /nfs/dbraw/zinc/14/57/24/1431145724.db2.gz IPTZKXBBUQCQHD-ZFWWWQNUSA-N 0 0 387.402 3.259 20 5 GGBDRN C[C@H](N[C@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000185447585 1431147521 /nfs/dbraw/zinc/14/75/21/1431147521.db2.gz BEWWUIOULCQAMR-DJJJIMSYSA-N 0 0 397.410 3.174 20 5 GGBDRN C[C@@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000185447647 1431147929 /nfs/dbraw/zinc/14/79/29/1431147929.db2.gz BEWWUIOULCQAMR-BFUOFWGJSA-N 0 0 397.410 3.174 20 5 GGBDRN O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000185450082 1431148253 /nfs/dbraw/zinc/14/82/53/1431148253.db2.gz LLLIJLIGGIPQSJ-UHFFFAOYSA-N 0 0 387.289 3.043 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)[C@@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000185450083 1431148576 /nfs/dbraw/zinc/14/85/76/1431148576.db2.gz RZSUKHIJWLSUIU-OAHLLOKOSA-N 0 0 390.399 3.130 20 5 GGBDRN CN(CCCc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185456400 1431149431 /nfs/dbraw/zinc/14/94/31/1431149431.db2.gz LXWZENSRPXGRFC-UHFFFAOYSA-N 0 0 385.445 3.396 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC(O)(c4ccccc4)CC3)n2)c1 ZINC000185464400 1431151005 /nfs/dbraw/zinc/15/10/05/1431151005.db2.gz JDUVSZHVFPGPPS-UHFFFAOYSA-N 0 0 380.404 3.128 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(OC[C@@H]2CCCO2)CC1 ZINC000185466509 1431151429 /nfs/dbraw/zinc/15/14/29/1431151429.db2.gz VJMIXZVNCRLAHI-PXNSSMCTSA-N 0 0 390.480 3.350 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCN([C@H](C)c2ccsc2)CC1 ZINC000185483718 1431155009 /nfs/dbraw/zinc/15/50/09/1431155009.db2.gz PIRKDUXMFNXVEH-OAHLLOKOSA-N 0 0 388.493 3.282 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCN([C@@H](C)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000185487286 1431155558 /nfs/dbraw/zinc/15/55/58/1431155558.db2.gz SMFWTBIRTYTVTF-ZDUSSCGKSA-N 0 0 390.465 3.111 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(N2CCCCC2=O)CC1 ZINC000185516467 1431162827 /nfs/dbraw/zinc/16/28/27/1431162827.db2.gz ZVMVVLXJAWJUEO-KRWDZBQOSA-N 0 0 387.480 3.167 20 5 GGBDRN Cc1ccc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1S(C)(=O)=O 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O=[N+]([O-])c1cccc(S(=O)(=O)N(Cc2cccc(F)c2)C[C@@H]2CCCO2)c1 ZINC000185741304 1431220521 /nfs/dbraw/zinc/22/05/21/1431220521.db2.gz SDCZFYGWYKCUAG-KRWDZBQOSA-N 0 0 394.424 3.104 20 5 GGBDRN CO[C@H](C)c1nc(CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)cs1 ZINC000185745740 1431222288 /nfs/dbraw/zinc/22/22/88/1431222288.db2.gz WYYMFTAUIHOMTF-SECBINFHSA-N 0 0 392.462 3.298 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCc1ccn(-c2ccccc2)n1 ZINC000185747429 1431222575 /nfs/dbraw/zinc/22/25/75/1431222575.db2.gz LLVOPKFDOOQCQE-UHFFFAOYSA-N 0 0 393.428 3.320 20 5 GGBDRN COC(=O)COc1ccc(CN(C)c2ccc([N+](=O)[O-])c3cnccc32)cc1 ZINC000185751163 1431223582 /nfs/dbraw/zinc/22/35/82/1431223582.db2.gz KMYUUBBCAPQVNZ-UHFFFAOYSA-N 0 0 381.388 3.331 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCCOc1cccc(F)c1 ZINC000185755839 1431226211 /nfs/dbraw/zinc/22/62/11/1431226211.db2.gz DFJBOHJXDDIBMO-UHFFFAOYSA-N 0 0 375.381 3.152 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](Cc3ccccc3)C2)c2ncccc12 ZINC000185757150 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Cc1cccc(NC2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000185840630 1431248647 /nfs/dbraw/zinc/24/86/47/1431248647.db2.gz RYDPFCYJCXBFEY-UHFFFAOYSA-N 0 0 375.450 3.168 20 5 GGBDRN CC(C)Oc1ccc2ccccc2c1CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000185842159 1431248937 /nfs/dbraw/zinc/24/89/37/1431248937.db2.gz IPJRFVYKHFHDSC-UHFFFAOYSA-N 0 0 395.415 3.013 20 5 GGBDRN NC(=O)c1ccc(N2CCO[C@@H](c3ccc(F)cc3Cl)C2)c([N+](=O)[O-])c1 ZINC000185845263 1431250177 /nfs/dbraw/zinc/25/01/77/1431250177.db2.gz BHLUQRGDMKVVKE-MRXNPFEDSA-N 0 0 379.775 3.064 20 5 GGBDRN CN1Cc2cc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)ccc2NC1=O ZINC000185848545 1431251001 /nfs/dbraw/zinc/25/10/01/1431251001.db2.gz KPFBJRDNTQGEMA-UHFFFAOYSA-N 0 0 379.376 3.235 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185850022 1431251574 /nfs/dbraw/zinc/25/15/74/1431251574.db2.gz ILBFAMWAOZTEKF-AWEZNQCLSA-N 0 0 392.847 3.297 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)c1[N+](=O)[O-] ZINC000185851095 1431251970 /nfs/dbraw/zinc/25/19/70/1431251970.db2.gz JWTCPJWTSOUQHA-HNNXBMFYSA-N 0 0 385.811 3.448 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]23)c2ncccc12 ZINC000185865282 1431255843 /nfs/dbraw/zinc/25/58/43/1431255843.db2.gz LRCRKRYAUUKHLD-QKYXUNIQSA-N 0 0 395.440 3.150 20 5 GGBDRN CC(C)OC1CCC(NS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000185870511 1431257955 /nfs/dbraw/zinc/25/79/55/1431257955.db2.gz GCHJJBJMDQOZGT-UHFFFAOYSA-N 0 0 393.465 3.158 20 5 GGBDRN Cn1nc(CCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c2ccccc21 ZINC000185878930 1431260895 /nfs/dbraw/zinc/26/08/95/1431260895.db2.gz BDIIVODNZUZNAP-UHFFFAOYSA-N 0 0 393.447 3.398 20 5 GGBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000185893730 1431266670 /nfs/dbraw/zinc/26/66/70/1431266670.db2.gz ZVVQLZVUMAFLHA-NFAWXSAZSA-N 0 0 375.450 3.485 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@@H](c2cnn(C)c2)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000185896428 1431268841 /nfs/dbraw/zinc/26/88/41/1431268841.db2.gz XCBAUNPLBWJLBS-MRXNPFEDSA-N 0 0 399.382 3.241 20 5 GGBDRN Cc1nn(C)c(C)c1CCCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185898668 1431269538 /nfs/dbraw/zinc/26/95/38/1431269538.db2.gz QMUFNFXLTPCZQF-UHFFFAOYSA-N 0 0 379.848 3.031 20 5 GGBDRN Cc1nc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)c2ccc(Cl)cc2)no1 ZINC000185904131 1431272929 /nfs/dbraw/zinc/27/29/29/1431272929.db2.gz OTJXMWCQCUPFKC-HNNXBMFYSA-N 0 0 387.783 3.041 20 5 GGBDRN CCc1nc2ccccc2n1C1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC1 ZINC000185905827 1431273151 /nfs/dbraw/zinc/27/31/51/1431273151.db2.gz PCVHUSDKJPPMKR-UHFFFAOYSA-N 0 0 395.419 3.085 20 5 GGBDRN Cc1ccc([C@@H](C)NS(=O)(=O)Cc2noc3ccccc32)cc1[N+](=O)[O-] ZINC000185909665 1431274637 /nfs/dbraw/zinc/27/46/37/1431274637.db2.gz QFNIDYCKMWZMTQ-GFCCVEGCSA-N 0 0 375.406 3.225 20 5 GGBDRN C[C@H](CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1nccs1 ZINC000185914560 1431277333 /nfs/dbraw/zinc/27/73/33/1431277333.db2.gz XTGOBUQBOFXGNK-LLVKDONJSA-N 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C[S@@](=O)Cc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000185967207 1431300449 /nfs/dbraw/zinc/30/04/49/1431300449.db2.gz XSBQQQXBLANCIR-AREMUKBSSA-N 0 0 384.360 3.327 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000185970071 1431301124 /nfs/dbraw/zinc/30/11/24/1431301124.db2.gz VZFVNANREKLZGD-KRWDZBQOSA-N 0 0 375.812 3.260 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000185994319 1431306971 /nfs/dbraw/zinc/30/69/71/1431306971.db2.gz JSXMGHYDOWBMRY-RDTXWAMCSA-N 0 0 376.434 3.041 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@H](CCO)c1ccccc1 ZINC000186007594 1431309953 /nfs/dbraw/zinc/30/99/53/1431309953.db2.gz GECDYDVRBDVNPX-AWEZNQCLSA-N 0 0 377.828 3.214 20 5 GGBDRN Cc1csc(N2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000186008307 1431310229 /nfs/dbraw/zinc/31/02/29/1431310229.db2.gz CVODHFQVKHFBLS-UHFFFAOYSA-N 0 0 395.872 3.045 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(C2CC2)S(=O)(=O)Cc2noc3ccccc32)cc1 ZINC000186014598 1431311607 /nfs/dbraw/zinc/31/16/07/1431311607.db2.gz IDGXVFZDQVJIRA-UHFFFAOYSA-N 0 0 387.417 3.230 20 5 GGBDRN CC(C)C[C@@H]1OCCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000186014953 1431311937 /nfs/dbraw/zinc/31/19/37/1431311937.db2.gz SVAFUXYNUAXJPQ-HOCLYGCPSA-N 0 0 393.465 3.015 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000186015305 1431311963 /nfs/dbraw/zinc/31/19/63/1431311963.db2.gz DONYIQROEYHKDX-LBPRGKRZSA-N 0 0 379.804 3.029 20 5 GGBDRN CC(C)C[C@H]1OCCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000186014937 1431311969 /nfs/dbraw/zinc/31/19/69/1431311969.db2.gz SVAFUXYNUAXJPQ-GOEBONIOSA-N 0 0 393.465 3.015 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)n2C ZINC000186019592 1431312861 /nfs/dbraw/zinc/31/28/61/1431312861.db2.gz HHAKIRNFWQQLAF-UHFFFAOYSA-N 0 0 389.799 3.465 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(CCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000186027143 1431313568 /nfs/dbraw/zinc/31/35/68/1431313568.db2.gz BWOWJRJWVZFTSH-UHFFFAOYSA-N 0 0 385.489 3.317 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccccc2N2CCCCC2)c1 ZINC000186049912 1431319668 /nfs/dbraw/zinc/31/96/68/1431319668.db2.gz OUZYNZBQHNTUMO-UHFFFAOYSA-N 0 0 375.450 3.064 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1[C@@H]1CCCCC1=O ZINC000186055564 1431320748 /nfs/dbraw/zinc/32/07/48/1431320748.db2.gz FMDKIVNYJZYFBM-JKSUJKDBSA-N 0 0 380.466 3.070 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@H](CCc2ccccc2)C1 ZINC000186058459 1431321439 /nfs/dbraw/zinc/32/14/39/1431321439.db2.gz NFAXBWFUYUYSIH-FUHWJXTLSA-N 0 0 383.448 3.255 20 5 GGBDRN CCOc1cc(C(=O)NC[C@@H](C)c2nc(C)cs2)c([N+](=O)[O-])cc1OC ZINC000186074643 1431325249 /nfs/dbraw/zinc/32/52/49/1431325249.db2.gz XLGLRARIFZOHTA-SNVBAGLBSA-N 0 0 379.438 3.301 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000186095747 1431329314 /nfs/dbraw/zinc/32/93/14/1431329314.db2.gz BHSJOAUASHRUHX-UHFFFAOYSA-N 0 0 394.313 3.094 20 5 GGBDRN CCc1cc(NC(=O)c2cc(OC(F)F)n(C)n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000186126660 1431336364 /nfs/dbraw/zinc/33/63/64/1431336364.db2.gz DPMZLIBDVAXRAM-UHFFFAOYSA-N 0 0 391.334 3.293 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000186129378 1431336738 /nfs/dbraw/zinc/33/67/38/1431336738.db2.gz LUWGGSPTLBMHML-UHFFFAOYSA-N 0 0 394.313 3.094 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000186129197 1431336822 /nfs/dbraw/zinc/33/68/22/1431336822.db2.gz WZQUSYNZCDNOQY-UHFFFAOYSA-N 0 0 381.314 3.318 20 5 GGBDRN COCCC(C)(C)CNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000186162679 1431344477 /nfs/dbraw/zinc/34/44/77/1431344477.db2.gz OWYNRXMVGRBDHZ-UHFFFAOYSA-N 0 0 379.457 3.210 20 5 GGBDRN Cc1ccc2c(c1)nc(CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)n2C ZINC000186162107 1431344642 /nfs/dbraw/zinc/34/46/42/1431344642.db2.gz VJPHKRCVZHPWMP-UHFFFAOYSA-N 0 0 390.346 3.321 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000186186595 1431348610 /nfs/dbraw/zinc/34/86/10/1431348610.db2.gz YFJKZAHDUKQBNL-KRWDZBQOSA-N 0 0 376.796 3.227 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000186189894 1431349259 /nfs/dbraw/zinc/34/92/59/1431349259.db2.gz GXUHLSGOMXTKED-KRWDZBQOSA-N 0 0 376.796 3.471 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000186220201 1431355482 /nfs/dbraw/zinc/35/54/82/1431355482.db2.gz RIPNPEBNWGZIQV-KRWDZBQOSA-N 0 0 377.347 3.156 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1cncnc1N1CCCC1 ZINC000186231993 1431358282 /nfs/dbraw/zinc/35/82/82/1431358282.db2.gz CCTRYIOIZPFFEJ-UHFFFAOYSA-N 0 0 393.856 3.369 20 5 GGBDRN O=C(Nc1cncnc1N1CCCC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000186236570 1431359180 /nfs/dbraw/zinc/35/91/80/1431359180.db2.gz XPTNPMWAWIJIJD-UHFFFAOYSA-N 0 0 381.314 3.256 20 5 GGBDRN C[C@H](C(=O)Nc1n[nH]c(Cc2cccc(F)c2)n1)c1ccc([N+](=O)[O-])cc1F ZINC000186255822 1431364199 /nfs/dbraw/zinc/36/41/99/1431364199.db2.gz ZSRUJBNTJQWJRE-JTQLQIEISA-N 0 0 387.346 3.324 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(Cc2ccccc2F)C2CC2)cc1[N+](=O)[O-] ZINC000186258796 1431364807 /nfs/dbraw/zinc/36/48/07/1431364807.db2.gz ZLISVDCVFVBYCX-UHFFFAOYSA-N 0 0 398.387 3.235 20 5 GGBDRN COCCOc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c(Cl)c1 ZINC000186265869 1431366245 /nfs/dbraw/zinc/36/62/45/1431366245.db2.gz LBSRVXOEWKQJKY-UHFFFAOYSA-N 0 0 390.783 3.402 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@H](c2ccccc2)C(F)(F)F)cc1 ZINC000186275949 1431369671 /nfs/dbraw/zinc/36/96/71/1431369671.db2.gz GEOAEILUFLBXDI-OAHLLOKOSA-N 0 0 388.367 3.360 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2c3ccccc3CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000186285460 1431371498 /nfs/dbraw/zinc/37/14/98/1431371498.db2.gz WLAUSBFITDADFT-NSHDSACASA-N 0 0 380.397 3.273 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(Cc2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000186296871 1431374783 /nfs/dbraw/zinc/37/47/83/1431374783.db2.gz FFBXVASROZRKJI-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186303262 1431376507 /nfs/dbraw/zinc/37/65/07/1431376507.db2.gz MGVAQFPKHQEUIG-CYBMUJFWSA-N 0 0 381.860 3.149 20 5 GGBDRN CCc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cnn1-c1ccccn1 ZINC000186302969 1431376712 /nfs/dbraw/zinc/37/67/12/1431376712.db2.gz BOYZJCOUMTUAEK-UHFFFAOYSA-N 0 0 385.811 3.321 20 5 GGBDRN CC(C)(C)C(=O)N1CCC[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186303241 1431376792 /nfs/dbraw/zinc/37/67/92/1431376792.db2.gz MGVAQFPKHQEUIG-ZDUSSCGKSA-N 0 0 381.860 3.149 20 5 GGBDRN C[C@@H](NC(=O)CC1CCCCC1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186306666 1431377637 /nfs/dbraw/zinc/37/76/37/1431377637.db2.gz HRCJMGUJQZVAPL-GFCCVEGCSA-N 0 0 381.860 3.340 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)NC2(c3ccccc3)CCC2)cc1[N+](=O)[O-] ZINC000186314931 1431380123 /nfs/dbraw/zinc/38/01/23/1431380123.db2.gz ZKFWVLRTVLEIMV-UHFFFAOYSA-N 0 0 380.397 3.100 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2c(O)cccc21 ZINC000186325197 1431382689 /nfs/dbraw/zinc/38/26/89/1431382689.db2.gz CBJPOIAVDDOBIZ-GFCCVEGCSA-N 0 0 379.376 3.035 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cccc(CN2CCCC2=O)c1 ZINC000186330500 1431384584 /nfs/dbraw/zinc/38/45/84/1431384584.db2.gz RTOPAUMINLLQCM-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN COCC(=O)N1CCc2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)ccc21 ZINC000186333674 1431385533 /nfs/dbraw/zinc/38/55/33/1431385533.db2.gz OORBVWHOSOHORG-UHFFFAOYSA-N 0 0 389.795 3.036 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)C(=O)N(C)C ZINC000186337476 1431386706 /nfs/dbraw/zinc/38/67/06/1431386706.db2.gz YOUBJVMLAKPCNS-GFCCVEGCSA-N 0 0 379.482 3.084 20 5 GGBDRN CC(=O)N[C@@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000186351651 1431389685 /nfs/dbraw/zinc/38/96/85/1431389685.db2.gz MXRROZOFVXGQRZ-KRWDZBQOSA-N 0 0 375.812 3.132 20 5 GGBDRN COCCOc1cccc(CC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186354071 1431390232 /nfs/dbraw/zinc/39/02/32/1431390232.db2.gz AQTUJTVAQXBGOG-UHFFFAOYSA-N 0 0 378.812 3.132 20 5 GGBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)[C@@H](C)Cc1ccsc1 ZINC000186363212 1431392359 /nfs/dbraw/zinc/39/23/59/1431392359.db2.gz JPQHKQWJQCVMJI-LBPRGKRZSA-N 0 0 396.490 3.153 20 5 GGBDRN COCc1cccc(CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000186374560 1431395165 /nfs/dbraw/zinc/39/51/65/1431395165.db2.gz MBWKMKSDHWGNGB-UHFFFAOYSA-N 0 0 380.404 3.417 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)[C@@H]1Oc1ccccc1 ZINC000186378460 1431396126 /nfs/dbraw/zinc/39/61/26/1431396126.db2.gz UEMBPMARUWJOPA-SBHAEUEKSA-N 0 0 384.432 3.269 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000186381574 1431396882 /nfs/dbraw/zinc/39/68/82/1431396882.db2.gz YUXMJFNMNSEEHR-GOSISDBHSA-N 0 0 391.374 3.199 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000186388695 1431398416 /nfs/dbraw/zinc/39/84/16/1431398416.db2.gz JBBCOYHTGYMTHK-UHFFFAOYSA-N 0 0 380.322 3.136 20 5 GGBDRN Cc1c(CC(=O)N2CCC(O)(c3c(F)cccc3F)CC2)cccc1[N+](=O)[O-] ZINC000186388273 1431398421 /nfs/dbraw/zinc/39/84/21/1431398421.db2.gz PBMYGURXRGILEC-UHFFFAOYSA-N 0 0 390.386 3.234 20 5 GGBDRN CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000186398397 1431400769 /nfs/dbraw/zinc/40/07/69/1431400769.db2.gz KEDPTQUXEFCMSO-KDOFPFPSSA-N 0 0 381.432 3.077 20 5 GGBDRN CCc1cc(NCCCCCS(C)(=O)=O)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186402878 1431403477 /nfs/dbraw/zinc/40/34/77/1431403477.db2.gz COVDJUVGVZTVPY-UHFFFAOYSA-N 0 0 392.481 3.241 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(-c2cncnc2)cc1F ZINC000186407239 1431405376 /nfs/dbraw/zinc/40/53/76/1431405376.db2.gz AKARRTOVGXEVIT-UHFFFAOYSA-N 0 0 381.367 3.033 20 5 GGBDRN CC[C@H]1CN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)CCN1Cc1ccccc1 ZINC000186414576 1431409768 /nfs/dbraw/zinc/40/97/68/1431409768.db2.gz SQVMLTAFGFJJMT-SFHVURJKSA-N 0 0 383.448 3.340 20 5 GGBDRN Cc1c(CC(=O)NCCc2ccc(OCC(F)(F)F)nc2)cccc1[N+](=O)[O-] ZINC000186419931 1431411997 /nfs/dbraw/zinc/41/19/97/1431411997.db2.gz VBDHAQBVTVSIHE-UHFFFAOYSA-N 0 0 397.353 3.141 20 5 GGBDRN COc1cc(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)ccc1[N+](=O)[O-] ZINC000186424004 1431414055 /nfs/dbraw/zinc/41/40/55/1431414055.db2.gz ASKRPYDCIDXCIO-UHFFFAOYSA-N 0 0 392.358 3.005 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186427052 1431415297 /nfs/dbraw/zinc/41/52/97/1431415297.db2.gz RPRRNOCXLUDSBY-OAQYLSRUSA-N 0 0 381.432 3.445 20 5 GGBDRN COc1cc(CNCc2cc(COC(C)(C)C)on2)c([N+](=O)[O-])cc1OC ZINC000186427589 1431415662 /nfs/dbraw/zinc/41/56/62/1431415662.db2.gz ZOLWGIWSCZYOKZ-UHFFFAOYSA-N 0 0 379.413 3.205 20 5 GGBDRN O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000186433544 1431418105 /nfs/dbraw/zinc/41/81/05/1431418105.db2.gz NWGUFLSKHPFLCJ-CMDGGOBGSA-N 0 0 388.370 3.396 20 5 GGBDRN CSc1cccc(C(=O)N(C)CC(=O)Nc2cc(F)cc(F)c2)c1[N+](=O)[O-] ZINC000186450706 1431422909 /nfs/dbraw/zinc/42/29/09/1431422909.db2.gz NCWKTZDXRAYJQN-UHFFFAOYSA-N 0 0 395.387 3.306 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)[C@@H](C)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000186482778 1431431826 /nfs/dbraw/zinc/43/18/26/1431431826.db2.gz YGZFSZLTAAQUHP-LBPRGKRZSA-N 0 0 382.413 3.433 20 5 GGBDRN CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000186482868 1431432230 /nfs/dbraw/zinc/43/22/30/1431432230.db2.gz NWYSJEVZWBZRHC-UHFFFAOYSA-N 0 0 387.461 3.401 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000186516439 1431444205 /nfs/dbraw/zinc/44/42/05/1431444205.db2.gz XUSBKLJIWDNAPA-IAQYHMDHSA-N 0 0 379.413 3.209 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)c1C ZINC000186524467 1431445799 /nfs/dbraw/zinc/44/57/99/1431445799.db2.gz YCBUGGHZLYVHKU-YVEFUNNKSA-N 0 0 375.450 3.378 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)c1C ZINC000186524448 1431445840 /nfs/dbraw/zinc/44/58/40/1431445840.db2.gz YCBUGGHZLYVHKU-SJKOYZFVSA-N 0 0 375.450 3.378 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@H](OC(C)C)c2ccccc2OC)c1[N+](=O)[O-] ZINC000186526557 1431446353 /nfs/dbraw/zinc/44/63/53/1431446353.db2.gz IVCRCHPLSWHRMO-INIZCTEOSA-N 0 0 390.440 3.175 20 5 GGBDRN COC[C@H](C)n1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000186531586 1431447202 /nfs/dbraw/zinc/44/72/02/1431447202.db2.gz UYMGEZKANMLZMV-NSHDSACASA-N 0 0 387.421 3.375 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)[C@@H](C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000186540524 1431449611 /nfs/dbraw/zinc/44/96/11/1431449611.db2.gz XVSJLZJPJVODLZ-JTQLQIEISA-N 0 0 386.376 3.263 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(C)(C)c1nc2ccccc2n1C ZINC000186554047 1431452341 /nfs/dbraw/zinc/45/23/41/1431452341.db2.gz YJWBCLYZVRIJGZ-UHFFFAOYSA-N 0 0 381.436 3.253 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2ccc(OC(C)C)c(Cl)c2)c1 ZINC000186571476 1431457099 /nfs/dbraw/zinc/45/70/99/1431457099.db2.gz FYXRSHUQISPVRK-UHFFFAOYSA-N 0 0 380.784 3.032 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NCCC[C@H]2CCCCO2)c([N+](=O)[O-])c1 ZINC000186579592 1431459652 /nfs/dbraw/zinc/45/96/52/1431459652.db2.gz HEHSTDDORKOZGQ-MRXNPFEDSA-N 0 0 378.473 3.354 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3cccc(SC)c3[N+](=O)[O-])cc21 ZINC000186588858 1431462064 /nfs/dbraw/zinc/46/20/64/1431462064.db2.gz YSXZIURDVLVIMN-UHFFFAOYSA-N 0 0 398.444 3.270 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(c2ccc(F)cc2Cl)CCCC1 ZINC000186590594 1431462270 /nfs/dbraw/zinc/46/22/70/1431462270.db2.gz YWZPBSROYLWIHM-UHFFFAOYSA-N 0 0 380.807 3.212 20 5 GGBDRN CSc1cccc(C(=O)N2CCn3c(nnc3-c3ccccc3)C2)c1[N+](=O)[O-] ZINC000186636182 1431476793 /nfs/dbraw/zinc/47/67/93/1431476793.db2.gz OJYDXIOMEDHBSO-UHFFFAOYSA-N 0 0 395.444 3.231 20 5 GGBDRN O=C(NCCC[C@H]1CCCCO1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000186640735 1431477933 /nfs/dbraw/zinc/47/79/33/1431477933.db2.gz NQGKRQIBOIXWBJ-QGZVFWFLSA-N 0 0 391.468 3.497 20 5 GGBDRN C[C@H](C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1cn(C)c2ccccc12 ZINC000186649580 1431480459 /nfs/dbraw/zinc/48/04/59/1431480459.db2.gz SJOBWIVAAIDIMO-GJZGRUSLSA-N 0 0 393.447 3.298 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@H](O)[C@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000186690932 1431493301 /nfs/dbraw/zinc/49/33/01/1431493301.db2.gz YVUIUYKYJVKLQM-YGRLFVJLSA-N 0 0 393.490 3.354 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@H](O)[C@@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000186690993 1431493320 /nfs/dbraw/zinc/49/33/20/1431493320.db2.gz YVUIUYKYJVKLQM-IINYFYTJSA-N 0 0 393.490 3.354 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@H](O)[C@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000186690955 1431493354 /nfs/dbraw/zinc/49/33/54/1431493354.db2.gz YVUIUYKYJVKLQM-QMTHXVAHSA-N 0 0 393.490 3.354 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@@]4(C3)OCc3ccccc34)n2)c1 ZINC000186698649 1431494947 /nfs/dbraw/zinc/49/49/47/1431494947.db2.gz AZZMDHWALPVZEG-FQEVSTJZSA-N 0 0 378.388 3.276 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000186709424 1431497753 /nfs/dbraw/zinc/49/77/53/1431497753.db2.gz STZXVLKKVGKWJI-NJSLBKSFSA-N 0 0 384.436 3.006 20 5 GGBDRN COc1cc(C)c(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1F ZINC000186732786 1431504749 /nfs/dbraw/zinc/50/47/49/1431504749.db2.gz QWUGYHPXQURNCK-UHFFFAOYSA-N 0 0 388.399 3.405 20 5 GGBDRN CSc1cccc(C(=O)Nc2cc(C)nn2-c2cc(C)nc(C)n2)c1[N+](=O)[O-] ZINC000186741544 1431506198 /nfs/dbraw/zinc/50/61/98/1431506198.db2.gz JNFIWIMPUMLGMI-UHFFFAOYSA-N 0 0 398.448 3.470 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1nc(-c2ccccc2F)no1 ZINC000186772642 1431512752 /nfs/dbraw/zinc/51/27/52/1431512752.db2.gz ZUJOGGAIQLMIIL-UHFFFAOYSA-N 0 0 393.334 3.056 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000186784439 1431516049 /nfs/dbraw/zinc/51/60/49/1431516049.db2.gz WQVJCSGLCCFYOE-GOSISDBHSA-N 0 0 399.382 3.387 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000186787199 1431516677 /nfs/dbraw/zinc/51/66/77/1431516677.db2.gz DUUHNYPBDFKMPL-HNNXBMFYSA-N 0 0 375.356 3.428 20 5 GGBDRN CSc1cccc(C(=O)Nc2cccn(CC(F)(F)F)c2=O)c1[N+](=O)[O-] ZINC000186795172 1431518247 /nfs/dbraw/zinc/51/82/47/1431518247.db2.gz WDTHIEDWDPISOP-UHFFFAOYSA-N 0 0 387.339 3.293 20 5 GGBDRN Cn1cc([C@H](NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)cn1 ZINC000186797591 1431519399 /nfs/dbraw/zinc/51/93/99/1431519399.db2.gz CVNJIADUPQONRE-FTJUBABDSA-N 0 0 380.379 3.386 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCN(C2CC2)c2ccccc21 ZINC000186803770 1431521559 /nfs/dbraw/zinc/52/15/59/1431521559.db2.gz UNEIHIBTSWKIDW-UHFFFAOYSA-N 0 0 389.415 3.410 20 5 GGBDRN COc1cc(C(=O)NC(C)(C)c2nc3ccccc3n2C)c([N+](=O)[O-])cc1OC ZINC000186805128 1431522007 /nfs/dbraw/zinc/52/20/07/1431522007.db2.gz WLJHRTXCBVRWGL-UHFFFAOYSA-N 0 0 398.419 3.164 20 5 GGBDRN O=C(Nc1ccc(-n2cnc3ccccc32)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000186834771 1431532350 /nfs/dbraw/zinc/53/23/50/1431532350.db2.gz NXGHWNWIEUZEEN-UHFFFAOYSA-N 0 0 375.344 3.287 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCN(C2CC2)c2ccccc21 ZINC000186847778 1431537949 /nfs/dbraw/zinc/53/79/49/1431537949.db2.gz PXLSXEBBWSLXRG-UHFFFAOYSA-N 0 0 389.415 3.410 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC2(CCOCC2)C1 ZINC000186847940 1431538733 /nfs/dbraw/zinc/53/87/33/1431538733.db2.gz KXESXPPXLUAKRY-MRXNPFEDSA-N 0 0 378.494 3.288 20 5 GGBDRN Cn1cc([C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)c2ccc(F)cc2)cn1 ZINC000186851861 1431539712 /nfs/dbraw/zinc/53/97/12/1431539712.db2.gz QQTVNBUCBRLKKE-HXUWFJFHSA-N 0 0 382.395 3.306 20 5 GGBDRN Cn1cc([C@@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)c2ccc(F)cc2)cn1 ZINC000186851882 1431539834 /nfs/dbraw/zinc/53/98/34/1431539834.db2.gz QQTVNBUCBRLKKE-FQEVSTJZSA-N 0 0 382.395 3.306 20 5 GGBDRN O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000186861287 1431544414 /nfs/dbraw/zinc/54/44/14/1431544414.db2.gz YKYXNEHJODZDNH-UHFFFAOYSA-N 0 0 392.343 3.273 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CNC(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000186864921 1431545815 /nfs/dbraw/zinc/54/58/15/1431545815.db2.gz DMFVGELDNMHDDZ-UHFFFAOYSA-N 0 0 379.388 3.031 20 5 GGBDRN Nc1c(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000186868720 1431547441 /nfs/dbraw/zinc/54/74/41/1431547441.db2.gz MDACBHLLNQGUCQ-NSHDSACASA-N 0 0 391.811 3.498 20 5 GGBDRN C[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@@H+]1Cc1ccccc1 ZINC000186869908 1431547896 /nfs/dbraw/zinc/54/78/96/1431547896.db2.gz JWUUBQQZSKJRTG-DOTOQJQBSA-N 0 0 383.448 3.426 20 5 GGBDRN CSc1cccc(C(=O)Nc2ccnn2-c2nc(C)cc(C)n2)c1[N+](=O)[O-] ZINC000186870973 1431548388 /nfs/dbraw/zinc/54/83/88/1431548388.db2.gz ZURUDTGBVVXMIR-UHFFFAOYSA-N 0 0 384.421 3.162 20 5 GGBDRN CSc1cccc(C(=O)N2CCN(c3nc(C)c(C)s3)CC2)c1[N+](=O)[O-] ZINC000186887219 1431555046 /nfs/dbraw/zinc/55/50/46/1431555046.db2.gz BIIQEUBJZLNIPP-UHFFFAOYSA-N 0 0 392.506 3.352 20 5 GGBDRN CSc1cccc(C(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000186898035 1431559397 /nfs/dbraw/zinc/55/93/97/1431559397.db2.gz WGOFWRWLPJYMPL-HNNXBMFYSA-N 0 0 399.472 3.095 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000186926029 1431567898 /nfs/dbraw/zinc/56/78/98/1431567898.db2.gz LAWGJPAFDBAWJW-NSHDSACASA-N 0 0 380.397 3.051 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000186937121 1431571416 /nfs/dbraw/zinc/57/14/16/1431571416.db2.gz ADASTPFAHBRFQN-UHFFFAOYSA-N 0 0 380.404 3.420 20 5 GGBDRN CC1CCN(c2ccc(C(=O)NCC3(CO)CCCC3)cc2[N+](=O)[O-])CC1 ZINC000186942376 1431572675 /nfs/dbraw/zinc/57/26/75/1431572675.db2.gz UFBSFWCXCBQMMP-UHFFFAOYSA-N 0 0 375.469 3.114 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186946888 1431574102 /nfs/dbraw/zinc/57/41/02/1431574102.db2.gz WCKTZPBPQMQGFW-NRFANRHFSA-N 0 0 390.399 3.052 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186950917 1431574931 /nfs/dbraw/zinc/57/49/31/1431574931.db2.gz CJNMIXHYHMUOKF-OAQYLSRUSA-N 0 0 375.384 3.415 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186950937 1431575183 /nfs/dbraw/zinc/57/51/83/1431575183.db2.gz CJNMIXHYHMUOKF-NRFANRHFSA-N 0 0 375.384 3.415 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)c3ccc(OC)c([N+](=O)[O-])c3)n2)cc1 ZINC000186960945 1431577380 /nfs/dbraw/zinc/57/73/80/1431577380.db2.gz OOHJCDIAXWOOMR-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@H](C)C[C@@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000186982392 1431582567 /nfs/dbraw/zinc/58/25/67/1431582567.db2.gz OQJFVRUIDUZHTA-CZUORRHYSA-N 0 0 393.509 3.459 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCC1CCN(CC(F)(F)F)CC1 ZINC000186990163 1431584493 /nfs/dbraw/zinc/58/44/93/1431584493.db2.gz ZVONBDVDLRQJQD-UHFFFAOYSA-N 0 0 393.793 3.181 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](c2ncccc2C)C(C)C)cc1[N+](=O)[O-] ZINC000187006338 1431587901 /nfs/dbraw/zinc/58/79/01/1431587901.db2.gz YHECEWRHAAHZHB-HNNXBMFYSA-N 0 0 397.428 3.122 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000187013068 1431589942 /nfs/dbraw/zinc/58/99/42/1431589942.db2.gz CQKOVSSSPLZCGF-JSGCOSHPSA-N 0 0 394.424 3.309 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000187013106 1431589957 /nfs/dbraw/zinc/58/99/57/1431589957.db2.gz CQKOVSSSPLZCGF-GXTWGEPZSA-N 0 0 394.424 3.309 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@]2(C1)OCc1ccccc12 ZINC000187020838 1431592392 /nfs/dbraw/zinc/59/23/92/1431592392.db2.gz GTMXOTYPGAMPBA-LJQANCHMSA-N 0 0 390.342 3.468 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000187038921 1431597411 /nfs/dbraw/zinc/59/74/11/1431597411.db2.gz YPQSRHIMFVWLLB-IBGZPJMESA-N 0 0 389.411 3.227 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC(O)(c2c(F)cccc2F)CC1 ZINC000187042256 1431598382 /nfs/dbraw/zinc/59/83/82/1431598382.db2.gz ZCFKDAQCFLUQHQ-UHFFFAOYSA-N 0 0 377.347 3.389 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C ZINC000187055469 1431600809 /nfs/dbraw/zinc/60/08/09/1431600809.db2.gz GLUXRWZWGNDAAC-WBMJQRKESA-N 0 0 392.843 3.132 20 5 GGBDRN C/C=C/C[C@@H](CO)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000187056531 1431601360 /nfs/dbraw/zinc/60/13/60/1431601360.db2.gz POSOHJCVLOZDEA-BVWQNDCPSA-N 0 0 384.436 3.220 20 5 GGBDRN C/C=C/C[C@H](CO)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000187056547 1431601388 /nfs/dbraw/zinc/60/13/88/1431601388.db2.gz POSOHJCVLOZDEA-AIROSISHSA-N 0 0 384.436 3.220 20 5 GGBDRN CC(C)c1ccc2c(c1)[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000187071723 1431605900 /nfs/dbraw/zinc/60/59/00/1431605900.db2.gz SDHFDFJPSWNTTR-IBGZPJMESA-N 0 0 381.432 3.252 20 5 GGBDRN CC[C@]1(CO)CCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000187085463 1431610031 /nfs/dbraw/zinc/61/00/31/1431610031.db2.gz ZFTIXLIXMJWEGP-SFHVURJKSA-N 0 0 375.450 3.343 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)c1cccc(SC)c1[N+](=O)[O-])n2C ZINC000187094390 1431612791 /nfs/dbraw/zinc/61/27/91/1431612791.db2.gz JZIJDRUARWVGDY-UHFFFAOYSA-N 0 0 386.433 3.142 20 5 GGBDRN C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000187099152 1431614950 /nfs/dbraw/zinc/61/49/50/1431614950.db2.gz XIMVIDADMXRQSC-ZBEGNZNMSA-N 0 0 375.812 3.433 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)c2ccc3ccccc3n2)cc1[N+](=O)[O-] ZINC000187109786 1431618017 /nfs/dbraw/zinc/61/80/17/1431618017.db2.gz VLXQCTFRDNUQJN-UHFFFAOYSA-N 0 0 391.380 3.116 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)NC(C)(C)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000187114564 1431619697 /nfs/dbraw/zinc/61/96/97/1431619697.db2.gz GELYCEFWJOXPTO-UHFFFAOYSA-N 0 0 386.376 3.095 20 5 GGBDRN Nc1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)cc1[N+](=O)[O-] ZINC000187144292 1431629798 /nfs/dbraw/zinc/62/97/98/1431629798.db2.gz BRIYOHSFDJGACU-UHFFFAOYSA-N 0 0 380.404 3.119 20 5 GGBDRN C/C=C/C[C@@H](CO)NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000187148377 1431630913 /nfs/dbraw/zinc/63/09/13/1431630913.db2.gz QMYXVBGOKLOGFQ-PBKGFPTLSA-N 0 0 399.234 3.144 20 5 GGBDRN CC[C@]1(CO)CCCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000187181293 1431639488 /nfs/dbraw/zinc/63/94/88/1431639488.db2.gz WRXBZHKDDWSVFE-SFHVURJKSA-N 0 0 375.450 3.343 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)co1 ZINC000187185791 1431640116 /nfs/dbraw/zinc/64/01/16/1431640116.db2.gz CZSMBBFCLCWBNU-UHFFFAOYSA-N 0 0 383.326 3.477 20 5 GGBDRN C/C=C/C[C@H](CO)NC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000187208336 1431648232 /nfs/dbraw/zinc/64/82/32/1431648232.db2.gz MEJAFSWZEMQFRQ-JMSZGNQPSA-N 0 0 375.469 3.134 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2C[C@@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000187241895 1431662271 /nfs/dbraw/zinc/66/22/71/1431662271.db2.gz XJCNYDNGKBYCHJ-BZNIZROVSA-N 0 0 380.397 3.124 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCO[C@H](c3ccc(F)cc3F)C2)c2c(c1)COCO2 ZINC000187247602 1431664248 /nfs/dbraw/zinc/66/42/48/1431664248.db2.gz WUAFTZYDIOILQH-SFHVURJKSA-N 0 0 392.358 3.313 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000187247219 1431664344 /nfs/dbraw/zinc/66/43/44/1431664344.db2.gz GVBLABPVWIHGNA-XIKOKIGWSA-N 0 0 391.374 3.274 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000187262073 1431671240 /nfs/dbraw/zinc/67/12/40/1431671240.db2.gz HQMQUVRQSQDVNQ-GOSISDBHSA-N 0 0 391.374 3.193 20 5 GGBDRN COc1ccc2nc(CN3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)sc2c1 ZINC000187262357 1431671635 /nfs/dbraw/zinc/67/16/35/1431671635.db2.gz ZHQBBAKODQIEHF-GFCCVEGCSA-N 0 0 385.449 3.295 20 5 GGBDRN COC(=O)C[C@](C)(NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000187264463 1431673128 /nfs/dbraw/zinc/67/31/28/1431673128.db2.gz UWIZZVUCLXOQDS-NRFANRHFSA-N 0 0 399.447 3.496 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000187266403 1431673580 /nfs/dbraw/zinc/67/35/80/1431673580.db2.gz SMRHGKHVHDIWNJ-SGTLLEGYSA-N 0 0 391.374 3.274 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2F)C1 ZINC000187266424 1431673754 /nfs/dbraw/zinc/67/37/54/1431673754.db2.gz SMRHGKHVHDIWNJ-XIKOKIGWSA-N 0 0 391.374 3.274 20 5 GGBDRN CCN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000187279802 1431679371 /nfs/dbraw/zinc/67/93/71/1431679371.db2.gz BIRQHHBANORRLH-UHFFFAOYSA-N 0 0 379.482 3.085 20 5 GGBDRN CCN(C)C(=O)CNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000187280372 1431679638 /nfs/dbraw/zinc/67/96/38/1431679638.db2.gz PLRKIDXAULMVGT-UHFFFAOYSA-N 0 0 391.811 3.249 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000187283942 1431681469 /nfs/dbraw/zinc/68/14/69/1431681469.db2.gz ZADYPMDAVZGKGH-UHFFFAOYSA-N 0 0 375.812 3.203 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000187290967 1431684037 /nfs/dbraw/zinc/68/40/37/1431684037.db2.gz DFCDIYFOGOHLMI-RYUDHWBXSA-N 0 0 382.413 3.213 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](C)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000187290932 1431684117 /nfs/dbraw/zinc/68/41/17/1431684117.db2.gz DFCDIYFOGOHLMI-NWDGAFQWSA-N 0 0 382.413 3.213 20 5 GGBDRN CCCCOc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cn1 ZINC000187295334 1431685666 /nfs/dbraw/zinc/68/56/66/1431685666.db2.gz VWFDAKZZDQNUSA-UHFFFAOYSA-N 0 0 382.380 3.002 20 5 GGBDRN O=C(CCN1CCO[C@@H](c2ccc(F)cc2F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000187298769 1431686412 /nfs/dbraw/zinc/68/64/12/1431686412.db2.gz ADOBEAITBCWXCL-GOSISDBHSA-N 0 0 391.374 3.275 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000187302465 1431688083 /nfs/dbraw/zinc/68/80/83/1431688083.db2.gz OSIJSXSENIUQIR-UHFFFAOYSA-N 0 0 391.811 3.290 20 5 GGBDRN O=C(Nc1cc(Cl)ccc1OC[C@@H]1CCCCO1)c1n[nH]cc1[N+](=O)[O-] ZINC000187315983 1431694198 /nfs/dbraw/zinc/69/41/98/1431694198.db2.gz OEYFFNPFZSTVKU-NSHDSACASA-N 0 0 380.788 3.172 20 5 GGBDRN Cc1ccc(SC[C@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000187316615 1431694704 /nfs/dbraw/zinc/69/47/04/1431694704.db2.gz YNNJLOGHNIXWMC-ZDUSSCGKSA-N 0 0 387.461 3.447 20 5 GGBDRN C[C@H](C(=O)NC1CCC(O)(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000187321244 1431695877 /nfs/dbraw/zinc/69/58/77/1431695877.db2.gz MJXLAQAFFROVPP-LMVFOVOHSA-N 0 0 387.411 3.179 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@](C)(CC(=O)OC)c1ccncc1 ZINC000187340241 1431702395 /nfs/dbraw/zinc/70/23/95/1431702395.db2.gz PNQYLXJTWJPNDE-IIBYNOLFSA-N 0 0 399.447 3.153 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@](C)(CC(=O)OC)c1ccncc1 ZINC000187340201 1431702486 /nfs/dbraw/zinc/70/24/86/1431702486.db2.gz PNQYLXJTWJPNDE-IERDGZPVSA-N 0 0 399.447 3.153 20 5 GGBDRN COC(=O)C[C@](C)(NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccncc1 ZINC000187348526 1431704815 /nfs/dbraw/zinc/70/48/15/1431704815.db2.gz JBDKXEFNGUWTCC-IBGZPJMESA-N 0 0 399.428 3.413 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccccn1 ZINC000187390109 1431716885 /nfs/dbraw/zinc/71/68/85/1431716885.db2.gz IXPCNLXTNFYHAU-IBGZPJMESA-N 0 0 378.388 3.100 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000187402749 1431720081 /nfs/dbraw/zinc/72/00/81/1431720081.db2.gz UFWAKYYQIUELMB-WFASDCNBSA-N 0 0 394.424 3.309 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@H]3CCCC[C@@H]3O)cc2[N+](=O)[O-])C1 ZINC000187413056 1431722800 /nfs/dbraw/zinc/72/28/00/1431722800.db2.gz NNCKTIDIKWJYQY-ZLHSVIROSA-N 0 0 375.469 3.110 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)c2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000187433300 1431727897 /nfs/dbraw/zinc/72/78/97/1431727897.db2.gz DVEBBVAAXMPGQY-UHFFFAOYSA-N 0 0 376.434 3.398 20 5 GGBDRN CC(C)c1ccc(C(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000187449362 1431733666 /nfs/dbraw/zinc/73/36/66/1431733666.db2.gz CSISFVXWCZFMQX-UHFFFAOYSA-N 0 0 376.434 3.052 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000187468070 1431740147 /nfs/dbraw/zinc/74/01/47/1431740147.db2.gz OUDKJUAJDSBRBL-ZDUSSCGKSA-N 0 0 399.357 3.083 20 5 GGBDRN COCCC1(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCCCC1 ZINC000187488446 1431746278 /nfs/dbraw/zinc/74/62/78/1431746278.db2.gz KGLBSVQPDFCTJH-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN COc1ccc(Cn2ccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000187521247 1431755409 /nfs/dbraw/zinc/75/54/09/1431755409.db2.gz HOHASTRBFJZSFN-AWEZNQCLSA-N 0 0 395.419 3.287 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(CC2CC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000187534480 1431759276 /nfs/dbraw/zinc/75/92/76/1431759276.db2.gz GZGDQUINOYGQOP-UHFFFAOYSA-N 0 0 380.397 3.348 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NC2(Cc3cccc(F)c3)CCC2)ccc1[N+](=O)[O-] ZINC000187561697 1431767946 /nfs/dbraw/zinc/76/79/46/1431767946.db2.gz UDMMMHJGGJTVNX-UHFFFAOYSA-N 0 0 399.422 3.054 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC([C@H]2CCCO2)CC1 ZINC000187582773 1431772625 /nfs/dbraw/zinc/77/26/25/1431772625.db2.gz SRDRLXFIRBHGIS-HXUWFJFHSA-N 0 0 387.480 3.229 20 5 GGBDRN Cc1nnnn1-c1ccc(F)c(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000187589822 1431774295 /nfs/dbraw/zinc/77/42/95/1431774295.db2.gz UCSKZNMFWYKTJV-UHFFFAOYSA-N 0 0 384.371 3.394 20 5 GGBDRN CCOc1ccc2c(c1)[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000187595105 1431775639 /nfs/dbraw/zinc/77/56/39/1431775639.db2.gz NUIXJFAODZUGJI-GOSISDBHSA-N 0 0 385.420 3.359 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)C(C)C ZINC000187616863 1431780187 /nfs/dbraw/zinc/78/01/87/1431780187.db2.gz XQJKYKVODWCZLL-MRXNPFEDSA-N 0 0 395.525 3.245 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)C(C)C ZINC000187616880 1431780225 /nfs/dbraw/zinc/78/02/25/1431780225.db2.gz XQJKYKVODWCZLL-INIZCTEOSA-N 0 0 395.525 3.245 20 5 GGBDRN C[C@H](NC(=O)NCC1CCN(CC(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000187627911 1431782390 /nfs/dbraw/zinc/78/23/90/1431782390.db2.gz HMNNHXPNRADPAK-LBPRGKRZSA-N 0 0 388.390 3.229 20 5 GGBDRN O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000187676169 1431796955 /nfs/dbraw/zinc/79/69/55/1431796955.db2.gz VUZHCNHGNISYCM-GTNSWQLSSA-N 0 0 397.353 3.356 20 5 GGBDRN CC(C)CNC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187678345 1431798622 /nfs/dbraw/zinc/79/86/22/1431798622.db2.gz UYTSPDYYAWIHMT-INIZCTEOSA-N 0 0 379.482 3.006 20 5 GGBDRN CN(CC(=O)NC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000187712948 1431803021 /nfs/dbraw/zinc/80/30/21/1431803021.db2.gz NHVKEQQEBBADMJ-CQSZACIVSA-N 0 0 381.354 3.493 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(Cl)cc2F)C1=O ZINC000187715985 1431803168 /nfs/dbraw/zinc/80/31/68/1431803168.db2.gz BFZTUPXQUFKHBD-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN COC(=O)Cc1csc(N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)n1 ZINC000187731718 1431805269 /nfs/dbraw/zinc/80/52/69/1431805269.db2.gz DCMOAAYGURWGMR-UHFFFAOYSA-N 0 0 377.422 3.167 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(NC(=O)CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000187810206 1431814930 /nfs/dbraw/zinc/81/49/30/1431814930.db2.gz WVCQFNVORLTQGJ-UHFFFAOYSA-N 0 0 384.436 3.471 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ccc(Cl)cc2F)C1=O ZINC000187817460 1431815838 /nfs/dbraw/zinc/81/58/38/1431815838.db2.gz PYPIZJFMSQJYFC-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@H]1CCC[C@@H]1CCO ZINC000187816475 1431815911 /nfs/dbraw/zinc/81/59/11/1431815911.db2.gz BCFHAASTPCAYFY-YPMHNXCESA-N 0 0 389.374 3.083 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1CCC[C@@H]1CCO ZINC000187816457 1431815984 /nfs/dbraw/zinc/81/59/84/1431815984.db2.gz BCFHAASTPCAYFY-DGCLKSJQSA-N 0 0 389.374 3.083 20 5 GGBDRN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000187819112 1431816174 /nfs/dbraw/zinc/81/61/74/1431816174.db2.gz VUZBLVTXBKVPMF-GXTWGEPZSA-N 0 0 382.376 3.231 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1CCOc2c(F)cccc21 ZINC000187821997 1431816677 /nfs/dbraw/zinc/81/66/77/1431816677.db2.gz IRBCDVYWHMPIFK-HNNXBMFYSA-N 0 0 375.356 3.066 20 5 GGBDRN COc1cc(OCC(=O)N2CCC(c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000187826077 1431817004 /nfs/dbraw/zinc/81/70/04/1431817004.db2.gz WRQOVBMXXLTKCN-UHFFFAOYSA-N 0 0 376.434 3.450 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3noc(-c4ccc(F)cc4F)n3)n2)cc1 ZINC000187843067 1431819098 /nfs/dbraw/zinc/81/90/98/1431819098.db2.gz SYHMNDNIRVHFOA-UHFFFAOYSA-N 0 0 384.302 3.230 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])[C@@H]1Oc1ccccc1 ZINC000187851628 1431820078 /nfs/dbraw/zinc/82/00/78/1431820078.db2.gz QAQODZFUZBBQPC-SXLOBPIMSA-N 0 0 399.447 3.361 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@@H]3CCC[C@@H]3CCO)cc2[N+](=O)[O-])CC1 ZINC000187855544 1431820569 /nfs/dbraw/zinc/82/05/69/1431820569.db2.gz IFDOEJBPIDCAAP-NVXWUHKLSA-N 0 0 375.469 3.112 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@H]3CCC[C@@H]3CCO)cc2[N+](=O)[O-])CC1 ZINC000187855568 1431820602 /nfs/dbraw/zinc/82/06/02/1431820602.db2.gz IFDOEJBPIDCAAP-WBVHZDCISA-N 0 0 375.469 3.112 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCC[C@@H]3CCO)cc2[N+](=O)[O-])C1 ZINC000187872518 1431822297 /nfs/dbraw/zinc/82/22/97/1431822297.db2.gz HGIQVLPLTNZAGV-KYHPRHEASA-N 0 0 389.496 3.358 20 5 GGBDRN NC(=O)c1ccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)c([N+](=O)[O-])c1 ZINC000187886817 1431824375 /nfs/dbraw/zinc/82/43/75/1431824375.db2.gz FMBOCBVABFQLBX-QGZVFWFLSA-N 0 0 393.802 3.060 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccccc2N(C)S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000187902417 1431825767 /nfs/dbraw/zinc/82/57/67/1431825767.db2.gz QJCIXXJWPLYBLM-UHFFFAOYSA-N 0 0 391.449 3.366 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@@H](CCO)c3ccco3)cc2[N+](=O)[O-])CC1 ZINC000187907713 1431826210 /nfs/dbraw/zinc/82/62/10/1431826210.db2.gz CSYWTQNSBDJZRA-INIZCTEOSA-N 0 0 387.436 3.278 20 5 GGBDRN Cc1nn(C)c(C(=O)N(C)c2ccc(OCc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000187925837 1431828041 /nfs/dbraw/zinc/82/80/41/1431828041.db2.gz VVNZFQDVADWNFW-UHFFFAOYSA-N 0 0 380.404 3.492 20 5 GGBDRN O=C(c1ccc(C2CCC2)cc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000187995750 1431834560 /nfs/dbraw/zinc/83/45/60/1431834560.db2.gz NEWCTTJJDNNJOQ-UHFFFAOYSA-N 0 0 393.443 3.461 20 5 GGBDRN CCN(C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)Cc1ccsc1 ZINC000188053425 1431840186 /nfs/dbraw/zinc/84/01/86/1431840186.db2.gz HGYOVTYROUJQHP-LBPRGKRZSA-N 0 0 391.449 3.083 20 5 GGBDRN CCOc1cccc2[nH]cc(CC(=O)NCCNc3ccccc3[N+](=O)[O-])c21 ZINC000188053488 1431840225 /nfs/dbraw/zinc/84/02/25/1431840225.db2.gz AHCYOJDVKDKQPE-UHFFFAOYSA-N 0 0 382.420 3.246 20 5 GGBDRN CSc1cccc(C(=O)NCc2ccccc2N2CCOCC2)c1[N+](=O)[O-] ZINC000188079331 1431843740 /nfs/dbraw/zinc/84/37/40/1431843740.db2.gz NBXVYTWUCOGKEO-UHFFFAOYSA-N 0 0 387.461 3.083 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)c2cccc(S(C)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000188094688 1431845878 /nfs/dbraw/zinc/84/58/78/1431845878.db2.gz NVSOHGHXBMQIIK-UHFFFAOYSA-N 0 0 376.434 3.398 20 5 GGBDRN CC(C)c1ccc(C(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1[N+](=O)[O-] ZINC000188094292 1431845954 /nfs/dbraw/zinc/84/59/54/1431845954.db2.gz KLDPZCZGLHFIPF-UHFFFAOYSA-N 0 0 385.420 3.346 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000188100207 1431846456 /nfs/dbraw/zinc/84/64/56/1431846456.db2.gz WKEBMGAZGFXAHR-ZIAGYGMSSA-N 0 0 393.509 3.474 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000188100254 1431846525 /nfs/dbraw/zinc/84/65/25/1431846525.db2.gz WKEBMGAZGFXAHR-KGLIPLIRSA-N 0 0 393.509 3.474 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000188116830 1431848995 /nfs/dbraw/zinc/84/89/95/1431848995.db2.gz MCMHORQELMOYFB-IAGOWNOFSA-N 0 0 381.432 3.369 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000188138334 1431851659 /nfs/dbraw/zinc/85/16/59/1431851659.db2.gz KAANTJJYJFWSBN-CVEARBPZSA-N 0 0 397.431 3.070 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188140098 1431852186 /nfs/dbraw/zinc/85/21/86/1431852186.db2.gz HFRKSKCKEQTHCG-SJORKVTESA-N 0 0 381.432 3.369 20 5 GGBDRN CSc1cccc(C(=O)N2CCC(c3nncn3C3CC3)CC2)c1[N+](=O)[O-] ZINC000188148152 1431853328 /nfs/dbraw/zinc/85/33/28/1431853328.db2.gz RGGHBJYHNXHFQO-UHFFFAOYSA-N 0 0 387.465 3.263 20 5 GGBDRN Cc1nn(C)c(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)c1[N+](=O)[O-] ZINC000188157963 1431854365 /nfs/dbraw/zinc/85/43/65/1431854365.db2.gz USTLVKTXGOKKCG-UHFFFAOYSA-N 0 0 382.342 3.117 20 5 GGBDRN CSc1cccc(C(=O)N2CCC(CN3CCCCC3=O)CC2)c1[N+](=O)[O-] ZINC000188165367 1431855424 /nfs/dbraw/zinc/85/54/24/1431855424.db2.gz ULJNKHBNIDOUFG-UHFFFAOYSA-N 0 0 391.493 3.181 20 5 GGBDRN CC[NH+](CC)CCN(Cc1cccs1)C(=O)c1ccc([N+](=O)[O-])cc1[O-] ZINC000188180301 1431857377 /nfs/dbraw/zinc/85/73/77/1431857377.db2.gz KRDMDRWMFNYFQQ-UHFFFAOYSA-N 0 0 377.466 3.346 20 5 GGBDRN CSc1cccc(C(=O)N2CCC[C@@H](c3nnc4ccccn43)C2)c1[N+](=O)[O-] ZINC000188188851 1431858459 /nfs/dbraw/zinc/85/84/59/1431858459.db2.gz SODWKKGQSPJQRO-CYBMUJFWSA-N 0 0 397.460 3.379 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000188219424 1431862401 /nfs/dbraw/zinc/86/24/01/1431862401.db2.gz JWZUTVGNKXETSF-AWEZNQCLSA-N 0 0 395.337 3.304 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F ZINC000188228337 1431863356 /nfs/dbraw/zinc/86/33/56/1431863356.db2.gz IRBQPOGCHQTCNM-AWEZNQCLSA-N 0 0 395.337 3.304 20 5 GGBDRN COc1cc(OC)cc(N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1 ZINC000188230222 1431863610 /nfs/dbraw/zinc/86/36/10/1431863610.db2.gz NGHBYKHSHQLUOW-UHFFFAOYSA-N 0 0 382.376 3.074 20 5 GGBDRN COc1cc(OC)cc(N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000188233814 1431864271 /nfs/dbraw/zinc/86/42/71/1431864271.db2.gz VWDBBYWTBUPZMC-UHFFFAOYSA-N 0 0 385.420 3.489 20 5 GGBDRN COc1cc(OC)cc(N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000188236328 1431864486 /nfs/dbraw/zinc/86/44/86/1431864486.db2.gz DSKMMMMTEXEOFL-UHFFFAOYSA-N 0 0 382.376 3.074 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000188287051 1431869741 /nfs/dbraw/zinc/86/97/41/1431869741.db2.gz ZEDWCBAXVVPVKS-UHFFFAOYSA-N 0 0 391.811 3.404 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000188296729 1431870701 /nfs/dbraw/zinc/87/07/01/1431870701.db2.gz PAOIRNBUJWMFMZ-QGZVFWFLSA-N 0 0 393.346 3.487 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1Oc1ccccc1 ZINC000188313138 1431872227 /nfs/dbraw/zinc/87/22/27/1431872227.db2.gz AQYPCTHQMXMJGX-UHOSZYNNSA-N 0 0 385.420 3.019 20 5 GGBDRN C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000188335606 1431874396 /nfs/dbraw/zinc/87/43/96/1431874396.db2.gz JUDVLZRKXIPWEI-SJCJKPOMSA-N 0 0 396.852 3.399 20 5 GGBDRN O=c1cc(-c2nc(COc3ccccc3F)no2)c2cc([N+](=O)[O-])ccc2[nH]1 ZINC000188337434 1431874603 /nfs/dbraw/zinc/87/46/03/1431874603.db2.gz RULMVKFAZZCPAP-UHFFFAOYSA-N 0 0 382.307 3.204 20 5 GGBDRN COc1cc(OCc2nc(COc3ccccc3F)no2)ccc1[N+](=O)[O-] ZINC000188351729 1431876104 /nfs/dbraw/zinc/87/61/04/1431876104.db2.gz CAKROSGELCSTBS-UHFFFAOYSA-N 0 0 375.312 3.284 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000188372401 1431878259 /nfs/dbraw/zinc/87/82/59/1431878259.db2.gz NTGWZQSOKJLJHA-KRWDZBQOSA-N 0 0 392.477 3.090 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])CC1 ZINC000188381315 1431879235 /nfs/dbraw/zinc/87/92/35/1431879235.db2.gz HKDJYHILCNDLIM-UHFFFAOYSA-N 0 0 397.378 3.170 20 5 GGBDRN O=C(NCCc1c[nH]c2ccccc12)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188425028 1431883198 /nfs/dbraw/zinc/88/31/98/1431883198.db2.gz GTHJWRWDENCWGL-UHFFFAOYSA-N 0 0 380.404 3.091 20 5 GGBDRN COc1cc(C(=O)NC[C@@H](C)N2CCc3sccc3C2)cc([N+](=O)[O-])c1C ZINC000188428292 1431883414 /nfs/dbraw/zinc/88/34/14/1431883414.db2.gz FLKRVAKGQWCPFE-GFCCVEGCSA-N 0 0 389.477 3.150 20 5 GGBDRN O=C(c1cc[nH]c1)c1ccc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000188448976 1431884802 /nfs/dbraw/zinc/88/48/02/1431884802.db2.gz RGFWPRANADSHCB-UHFFFAOYSA-N 0 0 391.383 3.057 20 5 GGBDRN Cc1nc(-c2ccccc2)oc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188449715 1431885023 /nfs/dbraw/zinc/88/50/23/1431885023.db2.gz CEYNJZGPQOKKKY-UHFFFAOYSA-N 0 0 379.372 3.462 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2OCCC[C@H]12 ZINC000188460281 1431885927 /nfs/dbraw/zinc/88/59/27/1431885927.db2.gz ZDZYSPBKHUVLDA-KYOSRNDESA-N 0 0 387.358 3.099 20 5 GGBDRN Cn1ccc2ccc(NC(=O)C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)cc21 ZINC000188499656 1431889391 /nfs/dbraw/zinc/88/93/91/1431889391.db2.gz BPSPVVURTJILLS-UHFFFAOYSA-N 0 0 392.415 3.216 20 5 GGBDRN Cc1cc(C)n(-c2ccc(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)cc2)n1 ZINC000188499764 1431889399 /nfs/dbraw/zinc/88/93/99/1431889399.db2.gz HRWZKGIGTAWKDT-UHFFFAOYSA-N 0 0 392.415 3.301 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@](C)(C(=O)OC)c1ccccc1 ZINC000188505025 1431889980 /nfs/dbraw/zinc/88/99/80/1431889980.db2.gz GNMFWXNVZTUYMR-JTSKRJEESA-N 0 0 398.459 3.411 20 5 GGBDRN Cc1noc2nc(C3CC3)cc(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)c12 ZINC000188514475 1431890733 /nfs/dbraw/zinc/89/07/33/1431890733.db2.gz GWKOGAUYEDADDG-UHFFFAOYSA-N 0 0 394.387 3.220 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1C[C@H]2OCCC[C@H]12 ZINC000188528978 1431892218 /nfs/dbraw/zinc/89/22/18/1431892218.db2.gz LXFMLSPEQFRXML-NQBHXWOUSA-N 0 0 390.383 3.389 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1Oc1ccccc1 ZINC000188537020 1431893096 /nfs/dbraw/zinc/89/30/96/1431893096.db2.gz YGBOAOZAJIQLMV-OTWHNJEPSA-N 0 0 385.420 3.019 20 5 GGBDRN Cc1onc(-c2ccccc2)c1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188550622 1431894272 /nfs/dbraw/zinc/89/42/72/1431894272.db2.gz MQJDOFXAXDWFCL-UHFFFAOYSA-N 0 0 379.372 3.462 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccccc1 ZINC000188556069 1431894747 /nfs/dbraw/zinc/89/47/47/1431894747.db2.gz YMRIVHIIHXHSAT-NRFANRHFSA-N 0 0 393.399 3.004 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCC2(CCCCC2)CC1 ZINC000188570176 1431896151 /nfs/dbraw/zinc/89/61/51/1431896151.db2.gz JYQXUJCOSBYTAU-UHFFFAOYSA-N 0 0 387.436 3.466 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)cn2)CC1 ZINC000188572140 1431896463 /nfs/dbraw/zinc/89/64/63/1431896463.db2.gz LYKKTNDQWRUVML-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN Cc1nc2cc(F)cc(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)c2nc1C ZINC000188580805 1431897082 /nfs/dbraw/zinc/89/70/82/1431897082.db2.gz FYCZTSYAGDJXKN-UHFFFAOYSA-N 0 0 396.378 3.197 20 5 GGBDRN CCOc1cc(OCC(=O)NC[C@@H]2CCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000188583143 1431897261 /nfs/dbraw/zinc/89/72/61/1431897261.db2.gz UAIMIYPIBVLWLX-INIZCTEOSA-N 0 0 399.447 3.015 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000188591871 1431898218 /nfs/dbraw/zinc/89/82/18/1431898218.db2.gz OJIYWJVEUSCXCX-LBPRGKRZSA-N 0 0 399.375 3.175 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000188599798 1431899020 /nfs/dbraw/zinc/89/90/20/1431899020.db2.gz PWKFUYFLRZDZOS-UHFFFAOYSA-N 0 0 383.404 3.061 20 5 GGBDRN COc1ccc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)c(OCc2ccccc2)c1 ZINC000188609017 1431899805 /nfs/dbraw/zinc/89/98/05/1431899805.db2.gz HRHNUGLQPZJGIS-UHFFFAOYSA-N 0 0 396.403 3.326 20 5 GGBDRN Cc1cc(C)c2c(c1)CN(C(=O)c1cc(=O)[nH]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000188654572 1431920557 /nfs/dbraw/zinc/92/05/57/1431920557.db2.gz PZKGNSNRASWNIY-UHFFFAOYSA-N 0 0 377.400 3.252 20 5 GGBDRN COc1cc(C(=O)NCCCn2c(C)nc3ccccc32)cc([N+](=O)[O-])c1C ZINC000188669481 1431927921 /nfs/dbraw/zinc/92/79/21/1431927921.db2.gz AYZHBBHMNFBAIE-UHFFFAOYSA-N 0 0 382.420 3.390 20 5 GGBDRN CC[C@@H](NC(=O)NCCN1CCc2ccccc2C1=O)c1cccc([N+](=O)[O-])c1 ZINC000188681902 1431931321 /nfs/dbraw/zinc/93/13/21/1431931321.db2.gz HGZKJDHGRMVKKZ-LJQANCHMSA-N 0 0 396.447 3.044 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000188741457 1431954255 /nfs/dbraw/zinc/95/42/55/1431954255.db2.gz WPGVMIGMXRTUCU-CQSZACIVSA-N 0 0 395.525 3.013 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000188764307 1431963966 /nfs/dbraw/zinc/96/39/66/1431963966.db2.gz LFYFQFYMZOLBRG-LJQANCHMSA-N 0 0 390.823 3.038 20 5 GGBDRN CC(C)[C@@H](CNC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Cc1ccccc1 ZINC000188772376 1431968130 /nfs/dbraw/zinc/96/81/30/1431968130.db2.gz BOFBUSZUYMBNCB-MRXNPFEDSA-N 0 0 397.431 3.134 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)c1ccccc1 ZINC000188783587 1431973649 /nfs/dbraw/zinc/97/36/49/1431973649.db2.gz GDEKPTQXUYTNCL-OAQYLSRUSA-N 0 0 384.432 3.381 20 5 GGBDRN CCO[C@H]1C[C@@](CO)(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1(C)C ZINC000188808152 1431983561 /nfs/dbraw/zinc/98/35/61/1431983561.db2.gz OYKKEVAPDLBLDU-YJBOKZPZSA-N 0 0 378.450 3.105 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000188830755 1431992663 /nfs/dbraw/zinc/99/26/63/1431992663.db2.gz RPSQCWTYCHIABE-MRXNPFEDSA-N 0 0 382.420 3.073 20 5 GGBDRN O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000188856645 1431998908 /nfs/dbraw/zinc/99/89/08/1431998908.db2.gz HQFAGONFUIIOEV-UHFFFAOYSA-N 0 0 395.337 3.282 20 5 GGBDRN COc1c(C)ccc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000188868638 1432001678 /nfs/dbraw/zinc/00/16/78/1432001678.db2.gz HRACXTGEBZXWFI-UHFFFAOYSA-N 0 0 377.784 3.451 20 5 GGBDRN O=C(Nc1ccc(Cl)c(Cl)n1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000188936228 1432012316 /nfs/dbraw/zinc/01/23/16/1432012316.db2.gz QPPQAXXMQLYLQW-UHFFFAOYSA-N 0 0 397.218 3.386 20 5 GGBDRN O=C(NCCCCCc1ccc(F)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000188937928 1432012734 /nfs/dbraw/zinc/01/27/34/1432012734.db2.gz BQCAQMOWYWAQKF-UHFFFAOYSA-N 0 0 397.410 3.457 20 5 GGBDRN CCn1cc(C(=O)C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])cn1 ZINC000188975021 1432019935 /nfs/dbraw/zinc/01/99/35/1432019935.db2.gz WMTLSVMFBBFHSG-UHFFFAOYSA-N 0 0 394.387 3.212 20 5 GGBDRN Cc1nc(CN2CCN(C(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)cs1 ZINC000188975267 1432019955 /nfs/dbraw/zinc/01/99/55/1432019955.db2.gz BYFZIMMBWKMSMK-UHFFFAOYSA-N 0 0 388.493 3.441 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)cc([N+](=O)[O-])c1C ZINC000188999635 1432024498 /nfs/dbraw/zinc/02/44/98/1432024498.db2.gz IWKVJIVGFDTMCE-ZDUSSCGKSA-N 0 0 396.403 3.377 20 5 GGBDRN Cc1nn(C)c(-n2cccn2)c1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000189001274 1432024936 /nfs/dbraw/zinc/02/49/36/1432024936.db2.gz PYBICVZVLBVXNV-UHFFFAOYSA-N 0 0 394.313 3.094 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CC1 ZINC000189049898 1432034680 /nfs/dbraw/zinc/03/46/80/1432034680.db2.gz VUYKRCOKCCWREL-UHFFFAOYSA-N 0 0 391.468 3.023 20 5 GGBDRN CCSc1cc(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)ccn1 ZINC000189058026 1432036486 /nfs/dbraw/zinc/03/64/86/1432036486.db2.gz MUKHDVXRHKMRJT-UHFFFAOYSA-N 0 0 383.433 3.218 20 5 GGBDRN CN(CCOc1ccc(C(F)(F)F)cc1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000189060392 1432037024 /nfs/dbraw/zinc/03/70/24/1432037024.db2.gz MWMMYELWFLGJPP-UHFFFAOYSA-N 0 0 383.326 3.347 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c2cccnc2O1 ZINC000189061408 1432037425 /nfs/dbraw/zinc/03/74/25/1432037425.db2.gz IDWVVFPPQRARGF-CQSZACIVSA-N 0 0 382.420 3.408 20 5 GGBDRN COc1cc(C(=O)NCc2nccn2CCc2ccccc2)cc([N+](=O)[O-])c1C ZINC000189088533 1432042850 /nfs/dbraw/zinc/04/28/50/1432042850.db2.gz ROSQRXOKWVZOKO-UHFFFAOYSA-N 0 0 394.431 3.281 20 5 GGBDRN COc1cc(C(=O)N(CCc2ccccc2)[C@@H]2CCOC2)cc([N+](=O)[O-])c1C ZINC000189106877 1432046118 /nfs/dbraw/zinc/04/61/18/1432046118.db2.gz ZIDDRPGLVMBEKB-GOSISDBHSA-N 0 0 384.432 3.386 20 5 GGBDRN COc1cc(C(=O)N(CCc2ccccc2)[C@H]2CCOC2)cc([N+](=O)[O-])c1C ZINC000189106900 1432046213 /nfs/dbraw/zinc/04/62/13/1432046213.db2.gz ZIDDRPGLVMBEKB-SFHVURJKSA-N 0 0 384.432 3.386 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2N2CCC(O)CC2)cc([N+](=O)[O-])c1C ZINC000189122223 1432049076 /nfs/dbraw/zinc/04/90/76/1432049076.db2.gz MWMGTTSAYJNXQF-UHFFFAOYSA-N 0 0 385.420 3.125 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC([C@@H]2CCCO2)CC1 ZINC000189143726 1432051997 /nfs/dbraw/zinc/05/19/97/1432051997.db2.gz UJEOZXGLFGJVIF-SJCJKPOMSA-N 0 0 381.860 3.466 20 5 GGBDRN 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ZINC000189248156 1432071316 /nfs/dbraw/zinc/07/13/16/1432071316.db2.gz QNRLAODKPVWRJQ-MRXNPFEDSA-N 0 0 390.465 3.070 20 5 GGBDRN C[C@@H]1CCC[C@@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1 ZINC000189252590 1432072193 /nfs/dbraw/zinc/07/21/93/1432072193.db2.gz UQMBZMHSTGZFAD-ZIAGYGMSSA-N 0 0 375.425 3.368 20 5 GGBDRN C[C@H]1CCC[C@@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1 ZINC000189252611 1432072365 /nfs/dbraw/zinc/07/23/65/1432072365.db2.gz UQMBZMHSTGZFAD-UONOGXRCSA-N 0 0 375.425 3.368 20 5 GGBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000189264717 1432074519 /nfs/dbraw/zinc/07/45/19/1432074519.db2.gz LAOIEZXNFLUPHB-INIZCTEOSA-N 0 0 382.351 3.173 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCC1CCN(CC(F)(F)F)CC1 ZINC000189277848 1432077035 /nfs/dbraw/zinc/07/70/35/1432077035.db2.gz PWXXYWNZWMTAHC-UHFFFAOYSA-N 0 0 391.415 3.077 20 5 GGBDRN Cc1csc([C@H]2COCCN2CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1 ZINC000189281461 1432077857 /nfs/dbraw/zinc/07/78/57/1432077857.db2.gz OPSXDADUHCSRJJ-CQSZACIVSA-N 0 0 396.856 3.025 20 5 GGBDRN Cc1csc([C@H]2COCCN2CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000189288427 1432079617 /nfs/dbraw/zinc/07/96/17/1432079617.db2.gz MIPASGWGCGKEEC-CQSZACIVSA-N 0 0 396.856 3.025 20 5 GGBDRN CC[C@]1(C)CN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CCO1 ZINC000189301128 1432081718 /nfs/dbraw/zinc/08/17/18/1432081718.db2.gz JHXPIYAEWKGTQU-HXUWFJFHSA-N 0 0 375.469 3.472 20 5 GGBDRN Cc1csc([C@@H]2COCCN2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000189305822 1432082239 /nfs/dbraw/zinc/08/22/39/1432082239.db2.gz KXNLENPMMSBLIV-INIZCTEOSA-N 0 0 390.465 3.070 20 5 GGBDRN CCN(C[C@@H](O)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000189325544 1432086560 /nfs/dbraw/zinc/08/65/60/1432086560.db2.gz UOJAZUHTTFOARO-SNVBAGLBSA-N 0 0 389.252 3.391 20 5 GGBDRN CCOC(=O)[C@@H](C)N(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CC1 ZINC000189358037 1432092670 /nfs/dbraw/zinc/09/26/70/1432092670.db2.gz LNUPEOFMUVUAAA-OAHLLOKOSA-N 0 0 392.455 3.097 20 5 GGBDRN COC(=O)c1cnc(N[C@H](C)Cc2cc(C)nn2-c2ccccc2)c([N+](=O)[O-])c1 ZINC000189363015 1432093559 /nfs/dbraw/zinc/09/35/59/1432093559.db2.gz IUFSHZCCIMVVOE-CYBMUJFWSA-N 0 0 395.419 3.314 20 5 GGBDRN COC(=O)c1cnc(NC[C@@H](C)c2nc(-c3ccccc3)no2)c([N+](=O)[O-])c1 ZINC000189370518 1432094840 /nfs/dbraw/zinc/09/48/40/1432094840.db2.gz PICIPMKHCIXABD-LLVKDONJSA-N 0 0 383.364 3.042 20 5 GGBDRN COC(=O)c1cnc(N2CCC(OCc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000189375424 1432095600 /nfs/dbraw/zinc/09/56/00/1432095600.db2.gz SFEJYPKWJYWHFW-UHFFFAOYSA-N 0 0 389.383 3.101 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCC1(c2cc(F)cc(C(F)(F)F)c2)CC1 ZINC000189393508 1432098180 /nfs/dbraw/zinc/09/81/80/1432098180.db2.gz RFDKZOXFCNZGBY-UHFFFAOYSA-N 0 0 398.316 3.192 20 5 GGBDRN O=C(NCC1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000189396351 1432098693 /nfs/dbraw/zinc/09/86/93/1432098693.db2.gz FAEBNFYUUWWJNB-UHFFFAOYSA-N 0 0 399.300 3.315 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cc(Cl)ccc1OC[C@@H]1CCCCO1 ZINC000189462448 1432120636 /nfs/dbraw/zinc/12/06/36/1432120636.db2.gz RHQGRGKVBUTIPK-ZDUSSCGKSA-N 0 0 394.815 3.031 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCSC[C@H]2c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000189465775 1432121729 /nfs/dbraw/zinc/12/17/29/1432121729.db2.gz WMNDXMVWOSLUTR-DYVFJYSZSA-N 0 0 389.481 3.197 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2-n2nc(C)nc2C)cc([N+](=O)[O-])c1C ZINC000189474274 1432125667 /nfs/dbraw/zinc/12/56/67/1432125667.db2.gz YSUAWUIGQULQDQ-UHFFFAOYSA-N 0 0 381.392 3.362 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000189477535 1432127135 /nfs/dbraw/zinc/12/71/35/1432127135.db2.gz GQMATNZQFHGLID-SFHVURJKSA-N 0 0 394.431 3.110 20 5 GGBDRN CC(=O)N1CCN(Cc2cccc(NCc3ccc(C)c([N+](=O)[O-])c3)c2)CC1 ZINC000189520107 1432146175 /nfs/dbraw/zinc/14/61/75/1432146175.db2.gz HXNRLMYPWYVCOL-UHFFFAOYSA-N 0 0 382.464 3.179 20 5 GGBDRN O=C(Nc1ccc(OC2COC2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000189575002 1432164422 /nfs/dbraw/zinc/16/44/22/1432164422.db2.gz DPLIEJOEXLZUOL-UHFFFAOYSA-N 0 0 397.431 3.228 20 5 GGBDRN O=C(N[C@@H]1CC[C@@H](Cc2ccccc2)C1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000189584366 1432167863 /nfs/dbraw/zinc/16/78/63/1432167863.db2.gz UXFXHNRTTTWARZ-FUHWJXTLSA-N 0 0 391.431 3.317 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000189594884 1432169887 /nfs/dbraw/zinc/16/98/87/1432169887.db2.gz SSLMUUBSPFEUCA-XOBRGWDASA-N 0 0 385.420 3.086 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCC(OCc2ccccc2)CC1 ZINC000189599250 1432171963 /nfs/dbraw/zinc/17/19/63/1432171963.db2.gz PAVCQBLOYNVURT-UHFFFAOYSA-N 0 0 390.461 3.184 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000189601885 1432172472 /nfs/dbraw/zinc/17/24/72/1432172472.db2.gz OFQNDBOSAOWQJK-HOTGVXAUSA-N 0 0 395.415 3.030 20 5 GGBDRN O=C(Nc1nnc(Cc2ccc(Cl)cc2)s1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000189628949 1432183964 /nfs/dbraw/zinc/18/39/64/1432183964.db2.gz ZHNOUNSIQYJIKO-UHFFFAOYSA-N 0 0 391.796 3.043 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@](C)(Cc2ccccc2)[C@H](C)O)c1[N+](=O)[O-] ZINC000189652197 1432191557 /nfs/dbraw/zinc/19/15/57/1432191557.db2.gz MMRMUTDXCYENLS-XOBRGWDASA-N 0 0 387.436 3.208 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1cccc(CSC)c1 ZINC000189694144 1432206779 /nfs/dbraw/zinc/20/67/79/1432206779.db2.gz FPFSTLNLABUKEQ-UHFFFAOYSA-N 0 0 375.450 3.466 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC(C3N=NC(=S)N3C)CC2)cc1[N+](=O)[O-] ZINC000189715920 1432213013 /nfs/dbraw/zinc/21/30/13/1432213013.db2.gz MKCAKRJPPUQQOM-UHFFFAOYSA-N 0 0 389.481 3.155 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000189718441 1432213273 /nfs/dbraw/zinc/21/32/73/1432213273.db2.gz VJJGEHGZESWKET-QVKFZJNVSA-N 0 0 399.447 3.394 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(Cl)c(F)c2)C1=O ZINC000189751186 1432224050 /nfs/dbraw/zinc/22/40/50/1432224050.db2.gz HQFITSRJEMARDJ-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN CCOC(=O)c1csc([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1 ZINC000189753501 1432224402 /nfs/dbraw/zinc/22/44/02/1432224402.db2.gz VJIMEZDQIXQEGR-ZDUSSCGKSA-N 0 0 392.393 3.478 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1 ZINC000189753516 1432224670 /nfs/dbraw/zinc/22/46/70/1432224670.db2.gz VJIMEZDQIXQEGR-CYBMUJFWSA-N 0 0 392.393 3.478 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C2CC2)s1 ZINC000189779404 1432232913 /nfs/dbraw/zinc/23/29/13/1432232913.db2.gz MTJSMGPYZPIZJF-INIZCTEOSA-N 0 0 388.449 3.284 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCO[C@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000189829391 1432246596 /nfs/dbraw/zinc/24/65/96/1432246596.db2.gz RFJJZZXYEKGTLB-INIZCTEOSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1cc(-n2cccn2)ccc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000189829007 1432246893 /nfs/dbraw/zinc/24/68/93/1432246893.db2.gz JEPLPKCPGMSTEM-LJQANCHMSA-N 0 0 377.404 3.306 20 5 GGBDRN Cc1nn(CCC(=O)NCc2ccc(C(F)(F)F)cc2C)c(C)c1[N+](=O)[O-] ZINC000189851966 1432253201 /nfs/dbraw/zinc/25/32/01/1432253201.db2.gz SNJPYOGHJLNFCS-UHFFFAOYSA-N 0 0 384.358 3.442 20 5 GGBDRN C[C@H]1CN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c2cccc(Cl)c2O1 ZINC000189855965 1432254628 /nfs/dbraw/zinc/25/46/28/1432254628.db2.gz LOCQZMHQTXTWQP-NSHDSACASA-N 0 0 399.794 3.257 20 5 GGBDRN CCO[C@@H]1C[C@H](O)C12CCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)CC2 ZINC000189895309 1432266269 /nfs/dbraw/zinc/26/62/69/1432266269.db2.gz IXQIXFIZNJQJSN-ZWKOTPCHSA-N 0 0 376.453 3.110 20 5 GGBDRN CC[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Oc1ccccc1F ZINC000189907519 1432269556 /nfs/dbraw/zinc/26/95/56/1432269556.db2.gz WDWHJVBOYHLOKO-ZDUSSCGKSA-N 0 0 382.413 3.407 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1cnn([C@H](C)C2CC2)c1 ZINC000189920518 1432274092 /nfs/dbraw/zinc/27/40/92/1432274092.db2.gz QHNSNLYQNAVULN-CQSZACIVSA-N 0 0 399.451 3.138 20 5 GGBDRN COc1cc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1F ZINC000189920352 1432274214 /nfs/dbraw/zinc/27/42/14/1432274214.db2.gz GNSMDVZCGMEHPQ-UHFFFAOYSA-N 0 0 389.383 3.118 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCO[C@@H](c3ccccc3F)C2)c1[N+](=O)[O-] ZINC000189939134 1432281576 /nfs/dbraw/zinc/28/15/76/1432281576.db2.gz HNBLPEWOAYVFBM-MRXNPFEDSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@H](c3ccccc3)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000189939215 1432281755 /nfs/dbraw/zinc/28/17/55/1432281755.db2.gz UCVNABCUJRXHFK-DOTOQJQBSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](c3ccccc3)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000189939235 1432281943 /nfs/dbraw/zinc/28/19/43/1432281943.db2.gz UCVNABCUJRXHFK-RDJZCZTQSA-N 0 0 390.461 3.362 20 5 GGBDRN CC(C)(CO)[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1 ZINC000189961858 1432290361 /nfs/dbraw/zinc/29/03/61/1432290361.db2.gz ZJGNIGYBGIBWCG-MRXNPFEDSA-N 0 0 392.477 3.213 20 5 GGBDRN CCCN1CCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c2cc(F)ccc21 ZINC000189965109 1432291187 /nfs/dbraw/zinc/29/11/87/1432291187.db2.gz FBNMLMKGANPUDS-UHFFFAOYSA-N 0 0 389.431 3.201 20 5 GGBDRN CC(C)c1cccc2c1CCN(C(=O)Cn1c(=O)oc3cc([N+](=O)[O-])ccc31)C2 ZINC000189985049 1432299399 /nfs/dbraw/zinc/29/93/99/1432299399.db2.gz HMTQQFLXMOFHBP-UHFFFAOYSA-N 0 0 395.415 3.211 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc([N+](=O)[O-])c1C ZINC000190010533 1432304460 /nfs/dbraw/zinc/30/44/60/1432304460.db2.gz FENPPUYVLHHHKR-MAUKXSAKSA-N 0 0 392.358 3.450 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc([N+](=O)[O-])c1C ZINC000190010552 1432304526 /nfs/dbraw/zinc/30/45/26/1432304526.db2.gz FENPPUYVLHHHKR-QAPCUYQASA-N 0 0 392.358 3.450 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000190029800 1432307804 /nfs/dbraw/zinc/30/78/04/1432307804.db2.gz GWXHWEUUBWANHM-MEBBXXQBSA-N 0 0 391.346 3.209 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000190034190 1432308665 /nfs/dbraw/zinc/30/86/65/1432308665.db2.gz RBUITZXKCILOIB-DOTOQJQBSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(C)Cc2nc3c(s2)CCCC3)c1[N+](=O)[O-] ZINC000190046625 1432310217 /nfs/dbraw/zinc/31/02/17/1432310217.db2.gz ZXPSTYFPVVVSAE-UHFFFAOYSA-N 0 0 395.506 3.368 20 5 GGBDRN CC(C)c1cc(NC(=O)NCc2ccccc2[N+](=O)[O-])n(-c2ncccn2)n1 ZINC000190053195 1432311664 /nfs/dbraw/zinc/31/16/64/1432311664.db2.gz HZPLVZICQTVZQK-UHFFFAOYSA-N 0 0 381.396 3.016 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@@H](c2cccnc2)C(C)C)c1[N+](=O)[O-] ZINC000190061685 1432312891 /nfs/dbraw/zinc/31/28/91/1432312891.db2.gz HBUANARTJCLBDT-MRXNPFEDSA-N 0 0 377.466 3.325 20 5 GGBDRN CO[C@H]1C[C@@H](c2nc(C)no2)N(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000190064082 1432313285 /nfs/dbraw/zinc/31/32/85/1432313285.db2.gz PJTCMWQNWFNZMG-BBRMVZONSA-N 0 0 388.424 3.186 20 5 GGBDRN CO[C@@H]1C[C@@H](c2nc(C)no2)N(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000190064100 1432313331 /nfs/dbraw/zinc/31/33/31/1432313331.db2.gz PJTCMWQNWFNZMG-CJNGLKHVSA-N 0 0 388.424 3.186 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)c1[N+](=O)[O-] ZINC000190072740 1432314610 /nfs/dbraw/zinc/31/46/10/1432314610.db2.gz GCEMGBYJUHBNDO-HIFRSBDPSA-N 0 0 396.490 3.424 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000190075798 1432314988 /nfs/dbraw/zinc/31/49/88/1432314988.db2.gz YVHUSSZXVVIVDC-UKRRQHHQSA-N 0 0 391.468 3.069 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cccc1[N+](=O)[O-] ZINC000190075909 1432314994 /nfs/dbraw/zinc/31/49/94/1432314994.db2.gz ZQZJLCIHRICMQF-UHFFFAOYSA-N 0 0 391.431 3.213 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000190080453 1432315989 /nfs/dbraw/zinc/31/59/89/1432315989.db2.gz IAZFDUKTHMCJNN-COXVUDFISA-N 0 0 387.440 3.092 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H](C)[C@H]2COc3ccccc32)c1[N+](=O)[O-] ZINC000190087360 1432317549 /nfs/dbraw/zinc/31/75/49/1432317549.db2.gz NUNVLFDBKRSZIW-DZGCQCFKSA-N 0 0 376.434 3.055 20 5 GGBDRN CCc1ccc([C@@H]2CN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)CCO2)cc1 ZINC000190101802 1432319780 /nfs/dbraw/zinc/31/97/80/1432319780.db2.gz BDKMOVHOOBPLDL-IBGZPJMESA-N 0 0 397.431 3.004 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CCO)c1[N+](=O)[O-] ZINC000190106510 1432320884 /nfs/dbraw/zinc/32/08/84/1432320884.db2.gz YFDJDKXPUIOVKR-MRXNPFEDSA-N 0 0 392.477 3.173 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000190129641 1432324770 /nfs/dbraw/zinc/32/47/70/1432324770.db2.gz WENFQAPZEOSKFL-ZFWWWQNUSA-N 0 0 378.816 3.115 20 5 GGBDRN O=C([C@@H]1CCCc2c(O)cccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000190133696 1432325908 /nfs/dbraw/zinc/32/59/08/1432325908.db2.gz VDROGGAFSVDHLU-LJQANCHMSA-N 0 0 381.432 3.069 20 5 GGBDRN COc1cc(CN2CCO[C@@H](c3ccc(F)cc3F)C2)c([N+](=O)[O-])cc1OC ZINC000190136958 1432326248 /nfs/dbraw/zinc/32/62/48/1432326248.db2.gz GKZHJBWCQIJPDS-LJQANCHMSA-N 0 0 394.374 3.464 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000190155451 1432329925 /nfs/dbraw/zinc/32/99/25/1432329925.db2.gz TYDZSISBNQDQTM-IAGOWNOFSA-N 0 0 390.461 3.410 20 5 GGBDRN CCCNc1ccccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000190157907 1432330194 /nfs/dbraw/zinc/33/01/94/1432330194.db2.gz RIZUKTVEHJLGIB-UHFFFAOYSA-N 0 0 390.827 3.439 20 5 GGBDRN COC(=O)c1cnc(NCc2ccc(OCC(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000190166021 1432331771 /nfs/dbraw/zinc/33/17/71/1432331771.db2.gz IRUKUOJLJSVEBO-UHFFFAOYSA-N 0 0 385.298 3.330 20 5 GGBDRN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000190190872 1432337239 /nfs/dbraw/zinc/33/72/39/1432337239.db2.gz VTUFXIVYWGYZGO-UHFFFAOYSA-N 0 0 397.410 3.411 20 5 GGBDRN CC1(C)CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@@H]1C(F)(F)F ZINC000190196589 1432338337 /nfs/dbraw/zinc/33/83/37/1432338337.db2.gz WHRVMGRQVRLFNT-HNNXBMFYSA-N 0 0 385.386 3.394 20 5 GGBDRN O=C(N[C@H]1CCCc2c(O)cccc21)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000190207923 1432341230 /nfs/dbraw/zinc/34/12/30/1432341230.db2.gz IYZTVHHAUWQPSK-SFHVURJKSA-N 0 0 378.388 3.294 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@@H](CCc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000190223350 1432344032 /nfs/dbraw/zinc/34/40/32/1432344032.db2.gz LJEMVCFFPKCRNT-SFHVURJKSA-N 0 0 384.432 3.386 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@H]2CC(=O)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000190226206 1432344438 /nfs/dbraw/zinc/34/44/38/1432344438.db2.gz HJQXKBWPRDFMEP-INIZCTEOSA-N 0 0 384.436 3.329 20 5 GGBDRN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000190244112 1432347912 /nfs/dbraw/zinc/34/79/12/1432347912.db2.gz KYBFYIJKMYJRMU-JXFKEZNVSA-N 0 0 392.415 3.288 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)cc1[N+](=O)[O-] ZINC000190258968 1432350134 /nfs/dbraw/zinc/35/01/34/1432350134.db2.gz XCJOORAWJSJYIR-MAUKXSAKSA-N 0 0 385.464 3.334 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)CC(C)(C)CN2CCOCC2)cc1[N+](=O)[O-] ZINC000190272171 1432351602 /nfs/dbraw/zinc/35/16/02/1432351602.db2.gz AKMYVXIXZUJFSC-UHFFFAOYSA-N 0 0 377.485 3.149 20 5 GGBDRN COc1ccc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(OC(C)C)c1 ZINC000190275377 1432352305 /nfs/dbraw/zinc/35/23/05/1432352305.db2.gz VMCRQAQKQYNRHI-UHFFFAOYSA-N 0 0 399.447 3.353 20 5 GGBDRN COc1ccc(CSCC(=O)NCCc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000190285587 1432353450 /nfs/dbraw/zinc/35/34/50/1432353450.db2.gz UMXZMIWFEWRWFD-UHFFFAOYSA-N 0 0 396.415 3.474 20 5 GGBDRN CCc1ccc([C@@H]2CN(CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CCO2)cc1 ZINC000190291379 1432354478 /nfs/dbraw/zinc/35/44/78/1432354478.db2.gz KZIDEWXPDQOCFI-FQEVSTJZSA-N 0 0 383.448 3.194 20 5 GGBDRN CCc1ccc([C@H]2CN(CC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])CCO2)cc1 ZINC000190306105 1432356843 /nfs/dbraw/zinc/35/68/43/1432356843.db2.gz HYYMQWZRYDXWFA-HXUWFJFHSA-N 0 0 399.447 3.178 20 5 GGBDRN CC(C)C1(C)CCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)CC1 ZINC000190308696 1432357386 /nfs/dbraw/zinc/35/73/86/1432357386.db2.gz KKHOZSUPCGDXIK-UHFFFAOYSA-N 0 0 375.469 3.330 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1cc2ccccc2o1 ZINC000190313627 1432358349 /nfs/dbraw/zinc/35/83/49/1432358349.db2.gz DGJGAOUBFLGUOE-QWHCGFSZSA-N 0 0 381.388 3.337 20 5 GGBDRN Cc1ccc(CNC(=O)c2cccc(C)c2[N+](=O)[O-])c(-n2cc(Cl)cn2)n1 ZINC000190338899 1432364207 /nfs/dbraw/zinc/36/42/07/1432364207.db2.gz RFJRBBWVPOUECC-UHFFFAOYSA-N 0 0 385.811 3.376 20 5 GGBDRN CC(C)C1(C)CCN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000190346589 1432365472 /nfs/dbraw/zinc/36/54/72/1432365472.db2.gz LHCIPADNCQHWRJ-UHFFFAOYSA-N 0 0 379.482 3.071 20 5 GGBDRN COc1cc(C[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000190347313 1432365630 /nfs/dbraw/zinc/36/56/30/1432365630.db2.gz ISQKNUZJSGPMQU-YRGRVCCFSA-N 0 0 390.358 3.202 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@](C)(Cc1ccccc1)[C@@H](C)O ZINC000190358662 1432366944 /nfs/dbraw/zinc/36/69/44/1432366944.db2.gz MHVWAWVZWOXNCD-JLTOFOAXSA-N 0 0 387.436 3.355 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@](C)(Cc1ccccc1)[C@@H](C)O ZINC000190358627 1432366948 /nfs/dbraw/zinc/36/69/48/1432366948.db2.gz MHVWAWVZWOXNCD-VLIAUNLRSA-N 0 0 387.436 3.355 20 5 GGBDRN CCOC(=O)[C@@](C)(CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccccc1 ZINC000190376880 1432369826 /nfs/dbraw/zinc/36/98/26/1432369826.db2.gz JFAPELXISOQEEV-NRFANRHFSA-N 0 0 397.431 3.412 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCN(c2cncc3ccccc32)CC1 ZINC000190382923 1432370852 /nfs/dbraw/zinc/37/08/52/1432370852.db2.gz BGLKAIGFXBNRJC-UHFFFAOYSA-N 0 0 376.416 3.034 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000190392380 1432372433 /nfs/dbraw/zinc/37/24/33/1432372433.db2.gz WZYJBJKYTQWPJL-CYBMUJFWSA-N 0 0 396.387 3.203 20 5 GGBDRN Cc1cc(C)nc(-n2nccc2NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000190427037 1432379728 /nfs/dbraw/zinc/37/97/28/1432379728.db2.gz QJJGKCMNPPPZNW-CQSZACIVSA-N 0 0 395.423 3.378 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000190431867 1432380779 /nfs/dbraw/zinc/38/07/79/1432380779.db2.gz HPZPWJNLTUOAJX-CVEARBPZSA-N 0 0 397.214 3.338 20 5 GGBDRN Cc1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)c(-n2cc(Cl)cn2)n1 ZINC000190439961 1432382443 /nfs/dbraw/zinc/38/24/43/1432382443.db2.gz IPGAFLXGDRJABO-UHFFFAOYSA-N 0 0 386.799 3.459 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000190440500 1432382583 /nfs/dbraw/zinc/38/25/83/1432382583.db2.gz CYJSDIULPKKOCG-UHFFFAOYSA-N 0 0 381.432 3.316 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000190443924 1432382843 /nfs/dbraw/zinc/38/28/43/1432382843.db2.gz BWGWEOTYFASGEA-GFCCVEGCSA-N 0 0 383.832 3.378 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000190493624 1432391969 /nfs/dbraw/zinc/39/19/69/1432391969.db2.gz SFNRBVFIIRJRLP-GJZGRUSLSA-N 0 0 378.816 3.115 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000190496773 1432392840 /nfs/dbraw/zinc/39/28/40/1432392840.db2.gz DHHKNSYPJBRIQR-KSSFIOAISA-N 0 0 385.376 3.319 20 5 GGBDRN CCN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1c[nH]c2ccccc12 ZINC000190508147 1432394744 /nfs/dbraw/zinc/39/47/44/1432394744.db2.gz ZVSVXDVUTOMGMW-UHFFFAOYSA-N 0 0 387.461 3.372 20 5 GGBDRN CCCCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1 ZINC000190513350 1432395633 /nfs/dbraw/zinc/39/56/33/1432395633.db2.gz IOHBTSCXOFUJMT-OAHLLOKOSA-N 0 0 382.482 3.148 20 5 GGBDRN CCCCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1 ZINC000190513371 1432395643 /nfs/dbraw/zinc/39/56/43/1432395643.db2.gz IOHBTSCXOFUJMT-HNNXBMFYSA-N 0 0 382.482 3.148 20 5 GGBDRN COc1cc(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)cc([N+](=O)[O-])c1C ZINC000190517173 1432396420 /nfs/dbraw/zinc/39/64/20/1432396420.db2.gz OPNKITNEXLWMIW-UHFFFAOYSA-N 0 0 381.392 3.474 20 5 GGBDRN C[C@](O)(CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000190532350 1432399346 /nfs/dbraw/zinc/39/93/46/1432399346.db2.gz NFDIHBWGCHYXFC-FQEVSTJZSA-N 0 0 375.469 3.256 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000190565810 1432408485 /nfs/dbraw/zinc/40/84/85/1432408485.db2.gz DWFZRGQUJJNABE-UHFFFAOYSA-N 0 0 397.431 3.443 20 5 GGBDRN CCCc1cnc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000190606688 1432418610 /nfs/dbraw/zinc/41/86/10/1432418610.db2.gz FBOHXUQJVCXWBL-LLVKDONJSA-N 0 0 376.438 3.128 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1cccc2ccn(C)c21 ZINC000190608336 1432419219 /nfs/dbraw/zinc/41/92/19/1432419219.db2.gz RCLZWFDLDJPMGZ-UHFFFAOYSA-N 0 0 394.431 3.462 20 5 GGBDRN Cc1ccccc1C[C@@H](CO)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000190635742 1432427838 /nfs/dbraw/zinc/42/78/38/1432427838.db2.gz CANMIBDHDQISJK-INIZCTEOSA-N 0 0 392.839 3.045 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000190658749 1432433437 /nfs/dbraw/zinc/43/34/37/1432433437.db2.gz LDGJNLTYAJWTMN-LJQANCHMSA-N 0 0 392.477 3.088 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000190658559 1432433526 /nfs/dbraw/zinc/43/35/26/1432433526.db2.gz PFIVJXRMZOFKAM-LJQANCHMSA-N 0 0 392.477 3.255 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@H]2C(=O)NCc2ccco2)cc1[N+](=O)[O-] ZINC000190666121 1432437207 /nfs/dbraw/zinc/43/72/07/1432437207.db2.gz AIQDDEBUZRLUPU-KRWDZBQOSA-N 0 0 385.420 3.232 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)cc1[N+](=O)[O-] ZINC000190666104 1432437223 /nfs/dbraw/zinc/43/72/23/1432437223.db2.gz AIQDDEBUZRLUPU-QGZVFWFLSA-N 0 0 385.420 3.232 20 5 GGBDRN CCOc1cc(OC[C@@H](O)Cn2cnc3cc(C)c(C)cc32)ccc1[N+](=O)[O-] ZINC000190691466 1432443412 /nfs/dbraw/zinc/44/34/12/1432443412.db2.gz IEFOWNDBXCROLL-HNNXBMFYSA-N 0 0 385.420 3.400 20 5 GGBDRN CC(C)c1cccc2c1CCN(C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)C2 ZINC000190692759 1432444725 /nfs/dbraw/zinc/44/47/25/1432444725.db2.gz CZCWIBRYIGBDFX-UHFFFAOYSA-N 0 0 381.432 3.033 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCOc3c(F)cccc32)cc1C ZINC000190726175 1432457008 /nfs/dbraw/zinc/45/70/08/1432457008.db2.gz DUPWNTSCMNKVKU-AWEZNQCLSA-N 0 0 380.397 3.153 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H](C)c2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000190730939 1432460375 /nfs/dbraw/zinc/46/03/75/1432460375.db2.gz JZDXFEBCMDKBGK-LLVKDONJSA-N 0 0 376.390 3.389 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccc(-n2cccn2)cc1C ZINC000190767865 1432471432 /nfs/dbraw/zinc/47/14/32/1432471432.db2.gz YFYYEYLPIOLBGK-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000190776221 1432475203 /nfs/dbraw/zinc/47/52/03/1432475203.db2.gz NJRRCCYZUJMZHW-DZGCQCFKSA-N 0 0 391.468 3.069 20 5 GGBDRN CCC[C@@H]1CCCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000190903679 1432524884 /nfs/dbraw/zinc/52/48/84/1432524884.db2.gz LRRATXAWBXNIFP-LLVKDONJSA-N 0 0 385.367 3.316 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2cc(CC3CCCCC3)[nH]n2)cc1[N+](=O)[O-] ZINC000190943914 1432534880 /nfs/dbraw/zinc/53/48/80/1432534880.db2.gz YWDKFECYQQPHBK-UHFFFAOYSA-N 0 0 385.424 3.326 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C[C@H]2CCC3(CCCCC3)O2)CC1 ZINC000190995502 1432546034 /nfs/dbraw/zinc/54/60/34/1432546034.db2.gz RNLXRMKPIXZLTC-LJQANCHMSA-N 0 0 387.480 3.235 20 5 GGBDRN Cc1ccc(C[C@H](CO)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000191041383 1432555540 /nfs/dbraw/zinc/55/55/40/1432555540.db2.gz ZJHBHZBXXFVTPZ-MRXNPFEDSA-N 0 0 397.456 3.360 20 5 GGBDRN CC[NH+](CC)Cc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000191053923 1432558030 /nfs/dbraw/zinc/55/80/30/1432558030.db2.gz GNYAOJDPKLEGRH-UHFFFAOYSA-N 0 0 393.465 3.246 20 5 GGBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 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PJPVQMIGVRUJSK-CQSZACIVSA-N 0 0 398.444 3.391 20 5 GGBDRN COc1cc(C(=O)NCc2ccccc2Cn2cccn2)cc([N+](=O)[O-])c1C ZINC000191584340 1432687312 /nfs/dbraw/zinc/68/73/12/1432687312.db2.gz NNQDEFGKQQEZAK-UHFFFAOYSA-N 0 0 380.404 3.087 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](c3ccccc3Cl)OCC2(C)C)n1 ZINC000191612193 1432692530 /nfs/dbraw/zinc/69/25/30/1432692530.db2.gz KPWQHDGQIVZPNK-OAHLLOKOSA-N 0 0 392.843 3.457 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3ccccc3Cl)OC[C@H]2C)n1 ZINC000191612343 1432692602 /nfs/dbraw/zinc/69/26/02/1432692602.db2.gz KAUFJFKLOIVCAN-ABAIWWIYSA-N 0 0 378.816 3.067 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)C2=O)cc1 ZINC000191614743 1432693335 /nfs/dbraw/zinc/69/33/35/1432693335.db2.gz UOEIVTYJAFFTAJ-KRWDZBQOSA-N 0 0 387.823 3.088 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])C2=O)cc1 ZINC000191617486 1432693690 /nfs/dbraw/zinc/69/36/90/1432693690.db2.gz FZOAGQGBRJGSPO-INIZCTEOSA-N 0 0 387.823 3.088 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)C2=O)cc1 ZINC000191619524 1432693860 /nfs/dbraw/zinc/69/38/60/1432693860.db2.gz ALENMAHVYVJFGT-AUUYWEPGSA-N 0 0 399.422 3.063 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)cc([N+](=O)[O-])c1C ZINC000191620734 1432694304 /nfs/dbraw/zinc/69/43/04/1432694304.db2.gz CHANYCCHSKJLHQ-UHFFFAOYSA-N 0 0 394.391 3.153 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CCC(c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000191657216 1432700924 /nfs/dbraw/zinc/70/09/24/1432700924.db2.gz YMVPPNWGAKGPGU-AWEZNQCLSA-N 0 0 384.436 3.205 20 5 GGBDRN CCN(C)C(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000191658567 1432701100 /nfs/dbraw/zinc/70/11/00/1432701100.db2.gz VNIIMYDVFVMNKG-ZDUSSCGKSA-N 0 0 393.509 3.474 20 5 GGBDRN CCN(C)C(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000191658556 1432701213 /nfs/dbraw/zinc/70/12/13/1432701213.db2.gz VNIIMYDVFVMNKG-CYBMUJFWSA-N 0 0 393.509 3.474 20 5 GGBDRN O=[N+]([O-])c1cc(CN2CCC(Oc3ccc(F)nc3)CC2)c2c(c1)COCO2 ZINC000191679746 1432704215 /nfs/dbraw/zinc/70/42/15/1432704215.db2.gz KRXJHDWUHQPYOK-UHFFFAOYSA-N 0 0 389.383 3.039 20 5 GGBDRN C[C@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1 ZINC000191681449 1432704858 /nfs/dbraw/zinc/70/48/58/1432704858.db2.gz HNGBATQGYDKEMN-LLVKDONJSA-N 0 0 395.337 3.472 20 5 GGBDRN Cc1nn(C)c(C(=O)NCC(C)(C)c2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000191748833 1432717532 /nfs/dbraw/zinc/71/75/32/1432717532.db2.gz XZXXBCVBXLNBMN-UHFFFAOYSA-N 0 0 384.358 3.363 20 5 GGBDRN CNC(=O)c1cc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)ccc1Cl ZINC000191790344 1432725903 /nfs/dbraw/zinc/72/59/03/1432725903.db2.gz MHIKVKQAQDBZIQ-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc1[N+](=O)[O-] ZINC000191796100 1432727319 /nfs/dbraw/zinc/72/73/19/1432727319.db2.gz IFWLFTUTNXJFRE-UHFFFAOYSA-N 0 0 389.433 3.287 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1[N+](=O)[O-] ZINC000191799354 1432728088 /nfs/dbraw/zinc/72/80/88/1432728088.db2.gz NWLPEVMCOJGLQG-UHFFFAOYSA-N 0 0 393.396 3.036 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc1[N+](=O)[O-] ZINC000191799140 1432728175 /nfs/dbraw/zinc/72/81/75/1432728175.db2.gz BLAFHQOINYMBJE-ZDUSSCGKSA-N 0 0 386.429 3.481 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc3c(cc2Cl)CCC3=O)c(C)c1[N+](=O)[O-] ZINC000191804117 1432728910 /nfs/dbraw/zinc/72/89/10/1432728910.db2.gz MEEGCLSMLOQQQX-UHFFFAOYSA-N 0 0 376.800 3.219 20 5 GGBDRN COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000191821968 1432732512 /nfs/dbraw/zinc/73/25/12/1432732512.db2.gz AUXJWEWJZKZMLH-LLVKDONJSA-N 0 0 396.831 3.196 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N(c2ccccc2)[C@@H]2CCOC2)c1[N+](=O)[O-] ZINC000191826342 1432733610 /nfs/dbraw/zinc/73/36/10/1432733610.db2.gz YFQDUDNLLMUBSU-MRXNPFEDSA-N 0 0 376.434 3.196 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@](C)(Cc1ccccc1)[C@H](C)O ZINC000191860451 1432741596 /nfs/dbraw/zinc/74/15/96/1432741596.db2.gz ADAAVYPXQUKBQP-VBKZILBWSA-N 0 0 387.436 3.355 20 5 GGBDRN COc1cccc(Cl)c1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000191859165 1432741642 /nfs/dbraw/zinc/74/16/42/1432741642.db2.gz ZPXFZSRWEXINCL-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN COc1cc(C(=O)Nc2cccc(C[S@@](C)=O)c2C)cc([N+](=O)[O-])c1C ZINC000191880354 1432745567 /nfs/dbraw/zinc/74/55/67/1432745567.db2.gz IFQQZLSJDDPYMD-AREMUKBSSA-N 0 0 376.434 3.351 20 5 GGBDRN COc1cc(C(=O)Nc2sccc2C(=O)NC2CC2)cc([N+](=O)[O-])c1C ZINC000191886480 1432747460 /nfs/dbraw/zinc/74/74/60/1432747460.db2.gz HFYLDYNWXXNQEI-UHFFFAOYSA-N 0 0 375.406 3.118 20 5 GGBDRN CN(C)c1noc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)n1 ZINC000191899427 1432750961 /nfs/dbraw/zinc/75/09/61/1432750961.db2.gz XWGLBXHFLFVGHX-UHFFFAOYSA-N 0 0 377.788 3.247 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)Nc2cccc(-c3nccn3C)c2)cc1[N+](=O)[O-] ZINC000191902189 1432751201 /nfs/dbraw/zinc/75/12/01/1432751201.db2.gz LUQJXGLTYKCWQY-UHFFFAOYSA-N 0 0 386.433 3.413 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCO[C@@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000191917638 1432755219 /nfs/dbraw/zinc/75/52/19/1432755219.db2.gz NEHKVYZFBXHHNC-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCO[C@@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000191917612 1432755328 /nfs/dbraw/zinc/75/53/28/1432755328.db2.gz HHBGKMMLBVODHT-QGZVFWFLSA-N 0 0 394.424 3.113 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000191936514 1432760473 /nfs/dbraw/zinc/76/04/73/1432760473.db2.gz SYPLTCCKVIWJNL-UHFFFAOYSA-N 0 0 375.429 3.306 20 5 GGBDRN CCC(=O)N1CCCC[C@H]1C(=O)Nc1cc(CC)nc2ccc([N+](=O)[O-])cc21 ZINC000191980069 1432773400 /nfs/dbraw/zinc/77/34/00/1432773400.db2.gz MTRGBLARQPMEKP-SFHVURJKSA-N 0 0 384.436 3.435 20 5 GGBDRN CCc1cc(NC(=O)[C@H](C(C)C)N2CCCC2=O)c2cc([N+](=O)[O-])ccc2n1 ZINC000191979398 1432773470 /nfs/dbraw/zinc/77/34/70/1432773470.db2.gz DNVLPKFYWVBEMN-IBGZPJMESA-N 0 0 384.436 3.291 20 5 GGBDRN CCc1cc(NC(=O)[C@@H]2CCCN2C(=O)C2CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000191979352 1432773602 /nfs/dbraw/zinc/77/36/02/1432773602.db2.gz VGUCNUGPQXWIEE-SFHVURJKSA-N 0 0 382.420 3.045 20 5 GGBDRN Cn1cc([C@@H]2CSCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn1 ZINC000191990633 1432775813 /nfs/dbraw/zinc/77/58/13/1432775813.db2.gz PLWICTOMCJGORW-AWEZNQCLSA-N 0 0 388.474 3.473 20 5 GGBDRN COc1cc(C(=O)NC[C@@](C)(Cc2ccccc2)[C@@H](C)O)cc([N+](=O)[O-])c1C ZINC000192039465 1432784220 /nfs/dbraw/zinc/78/42/20/1432784220.db2.gz GFWOXCRMEMZALP-QVKFZJNVSA-N 0 0 386.448 3.271 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000192039860 1432784689 /nfs/dbraw/zinc/78/46/89/1432784689.db2.gz AUZIQLYBVRWWFN-BBRMVZONSA-N 0 0 396.490 3.424 20 5 GGBDRN C[C@H](O)[C@](C)(CNC(=O)CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000192052220 1432788166 /nfs/dbraw/zinc/78/81/66/1432788166.db2.gz SUESXWZORBLAID-KKSFZXQISA-N 0 0 386.448 3.110 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)n1 ZINC000192054632 1432788697 /nfs/dbraw/zinc/78/86/97/1432788697.db2.gz MSMCBQQJDDVOHL-MRXNPFEDSA-N 0 0 375.450 3.441 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N(c1ccccc1)[C@H]1CCOC1 ZINC000192058141 1432789403 /nfs/dbraw/zinc/78/94/03/1432789403.db2.gz QBVLHKIVZVABDF-SFHVURJKSA-N 0 0 378.388 3.216 20 5 GGBDRN C[C@H](O)[C@](C)(CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Cc1ccccc1 ZINC000192060272 1432790150 /nfs/dbraw/zinc/79/01/50/1432790150.db2.gz SYCMXQMTOAWKGL-NYHFZMIOSA-N 0 0 395.459 3.365 20 5 GGBDRN COc1ccc(Cl)c(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000192109580 1432799420 /nfs/dbraw/zinc/79/94/20/1432799420.db2.gz SFJOFJMRELWCMR-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)c1ncc(F)cc1F)c1ccccc1[N+](=O)[O-] ZINC000192108784 1432799428 /nfs/dbraw/zinc/79/94/28/1432799428.db2.gz BERWCMVMLVLMMR-AWEZNQCLSA-N 0 0 393.346 3.081 20 5 GGBDRN CCc1c(NC(=O)CCn2cc([N+](=O)[O-])cn2)cnn1-c1ccccc1Cl ZINC000192120336 1432801233 /nfs/dbraw/zinc/80/12/33/1432801233.db2.gz OBDHBNBHIDJLKB-UHFFFAOYSA-N 0 0 388.815 3.222 20 5 GGBDRN CCc1c(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cnn1-c1cccc(Cl)c1 ZINC000192131104 1432803569 /nfs/dbraw/zinc/80/35/69/1432803569.db2.gz ANIBENLUVLRPMT-UHFFFAOYSA-N 0 0 388.815 3.291 20 5 GGBDRN CCc1c(NC(=O)Cn2cc([N+](=O)[O-])nc2C)cnn1-c1cccc(Cl)c1 ZINC000192133894 1432804090 /nfs/dbraw/zinc/80/40/90/1432804090.db2.gz NHXNZRBPWFEAER-UHFFFAOYSA-N 0 0 388.815 3.140 20 5 GGBDRN CCc1c(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cnn1-c1cccc(Cl)c1 ZINC000192134343 1432804417 /nfs/dbraw/zinc/80/44/17/1432804417.db2.gz RNWHTJFEOHJRGN-UHFFFAOYSA-N 0 0 387.783 3.349 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192145605 1432806888 /nfs/dbraw/zinc/80/68/88/1432806888.db2.gz RPTBHNSUEWHBQT-AEFFLSMTSA-N 0 0 390.461 3.410 20 5 GGBDRN CC(C)c1c(NC(=O)Cn2cc([N+](=O)[O-])cn2)cnn1-c1ccc(Cl)cc1 ZINC000192162328 1432810290 /nfs/dbraw/zinc/81/02/90/1432810290.db2.gz WMOJFFXZKVDVGM-UHFFFAOYSA-N 0 0 388.815 3.393 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(F)ccc2OCC2CC2)c(C)c1[N+](=O)[O-] ZINC000192172607 1432811601 /nfs/dbraw/zinc/81/16/01/1432811601.db2.gz QNMFIBDVBXBGHL-UHFFFAOYSA-N 0 0 376.388 3.365 20 5 GGBDRN O=C(Nc1cc(F)ccc1OCC1CC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000192174568 1432811880 /nfs/dbraw/zinc/81/18/80/1432811880.db2.gz VNSPVFVAAFGVCI-UHFFFAOYSA-N 0 0 397.366 3.356 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC2(CCCC2)c2cccc(Cl)c21 ZINC000192231437 1432820241 /nfs/dbraw/zinc/82/02/41/1432820241.db2.gz GYVHDMQDSJWRGT-UHFFFAOYSA-N 0 0 387.823 3.269 20 5 GGBDRN CCCn1ccnc1CCCN(C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000192236037 1432820667 /nfs/dbraw/zinc/82/06/67/1432820667.db2.gz VIIYJCNMWMHWLK-UHFFFAOYSA-N 0 0 385.468 3.163 20 5 GGBDRN CCCn1ccnc1CCCN(C)S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000192242965 1432821592 /nfs/dbraw/zinc/82/15/92/1432821592.db2.gz KIVOYFYPJJGTAB-UHFFFAOYSA-N 0 0 394.497 3.071 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000192267671 1432824801 /nfs/dbraw/zinc/82/48/01/1432824801.db2.gz KINXGICDWWUHQK-LPHOPBHVSA-N 0 0 390.461 3.213 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c1C ZINC000192269541 1432825375 /nfs/dbraw/zinc/82/53/75/1432825375.db2.gz MFUFVCCJPHPNNN-WMZOPIPTSA-N 0 0 390.461 3.268 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000192271860 1432825533 /nfs/dbraw/zinc/82/55/33/1432825533.db2.gz FFXJHPWASBLTBN-UHFFFAOYSA-N 0 0 390.461 3.441 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)c3c(Cl)cccc3[N+](=O)[O-])C2=O)cc1 ZINC000192298409 1432829069 /nfs/dbraw/zinc/82/90/69/1432829069.db2.gz SYLOIQGXCRDOBK-HNNXBMFYSA-N 0 0 387.823 3.088 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(Cc2c(F)cccc2F)C2CC2)cc1[N+](=O)[O-] ZINC000192306730 1432829779 /nfs/dbraw/zinc/82/97/79/1432829779.db2.gz VDTADGBPGQCMHC-UHFFFAOYSA-N 0 0 389.358 3.311 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1c(F)cccc1F)C1CC1 ZINC000192308758 1432830000 /nfs/dbraw/zinc/83/00/00/1432830000.db2.gz KEUPDCUSUHROJC-UHFFFAOYSA-N 0 0 389.358 3.311 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1 ZINC000192335878 1432833406 /nfs/dbraw/zinc/83/34/06/1432833406.db2.gz PISTXQLUDONLGF-UHFFFAOYSA-N 0 0 377.422 3.124 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000192377660 1432839157 /nfs/dbraw/zinc/83/91/57/1432839157.db2.gz BNQJKUCWZKICEV-CYBMUJFWSA-N 0 0 387.358 3.279 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(F)cc1 ZINC000192408465 1432841635 /nfs/dbraw/zinc/84/16/35/1432841635.db2.gz YZZQYYMLIPDQQJ-OAHLLOKOSA-N 0 0 375.356 3.121 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000192408448 1432841675 /nfs/dbraw/zinc/84/16/75/1432841675.db2.gz LTNITYUREGZJNQ-OAHLLOKOSA-N 0 0 375.356 3.121 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1ccc(F)cc1 ZINC000192419191 1432842802 /nfs/dbraw/zinc/84/28/02/1432842802.db2.gz NPYWMLXZBCLSDO-HNNXBMFYSA-N 0 0 375.356 3.121 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccn1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000192424433 1432843432 /nfs/dbraw/zinc/84/34/32/1432843432.db2.gz JIGBWXLAJVTGGH-UHFFFAOYSA-N 0 0 395.341 3.363 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(F)cc1 ZINC000192427553 1432843865 /nfs/dbraw/zinc/84/38/65/1432843865.db2.gz KKNHAKPSKSPNCC-OAHLLOKOSA-N 0 0 375.356 3.121 20 5 GGBDRN CCN(Cc1ccccc1Cl)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000192456638 1432847058 /nfs/dbraw/zinc/84/70/58/1432847058.db2.gz NFEDODXMVWMLET-UHFFFAOYSA-N 0 0 396.852 3.314 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(CSc2nccn2C)o1 ZINC000192466987 1432848260 /nfs/dbraw/zinc/84/82/60/1432848260.db2.gz JUMKPHAAQYFGER-UHFFFAOYSA-N 0 0 386.433 3.486 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 ZINC000192468751 1432848539 /nfs/dbraw/zinc/84/85/39/1432848539.db2.gz HSTZLFAFUIYWMT-UHFFFAOYSA-N 0 0 384.367 3.455 20 5 GGBDRN Cc1nc(Cl)ccc1NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000192487327 1432850155 /nfs/dbraw/zinc/85/01/55/1432850155.db2.gz SRYNZCUKBCZODK-UHFFFAOYSA-N 0 0 376.800 3.041 20 5 GGBDRN Cc1cc(OC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc(C)c1Cl ZINC000192487898 1432850408 /nfs/dbraw/zinc/85/04/08/1432850408.db2.gz FDSFKTVXDLUYAJ-UHFFFAOYSA-N 0 0 383.809 3.488 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1Nc1cccc(NC(=O)[C@H](C)n2cccn2)c1 ZINC000192491203 1432850571 /nfs/dbraw/zinc/85/05/71/1432850571.db2.gz QBGLAQCCOGJXRD-ZDUSSCGKSA-N 0 0 383.412 3.259 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)no2)c1[N+](=O)[O-] ZINC000192493640 1432850812 /nfs/dbraw/zinc/85/08/12/1432850812.db2.gz PYOWLAVFILFPCT-CQSZACIVSA-N 0 0 396.407 3.298 20 5 GGBDRN CCn1c(Sc2ncnc3onc(C)c32)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000192495203 1432851056 /nfs/dbraw/zinc/85/10/56/1432851056.db2.gz PZPXXEAHMHFEDU-UHFFFAOYSA-N 0 0 383.393 3.264 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(-c3noc(C(F)(F)F)n3)cc2)c1[N+](=O)[O-] ZINC000192495147 1432851131 /nfs/dbraw/zinc/85/11/31/1432851131.db2.gz WOMAELRLXKQOSW-UHFFFAOYSA-N 0 0 396.285 3.201 20 5 GGBDRN O=C(NCc1cc2ccccc2o1)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000192505853 1432852412 /nfs/dbraw/zinc/85/24/12/1432852412.db2.gz YANZOOICUXEOON-CYBMUJFWSA-N 0 0 397.362 3.149 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000192507612 1432852690 /nfs/dbraw/zinc/85/26/90/1432852690.db2.gz QCYMMHJRFQAURC-HNNXBMFYSA-N 0 0 395.799 3.028 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1S(=O)(=O)C(F)(F)F ZINC000192523654 1432854662 /nfs/dbraw/zinc/85/46/62/1432854662.db2.gz NBEQTJAHPVTRMC-UHFFFAOYSA-N 0 0 388.323 3.449 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000192525309 1432854810 /nfs/dbraw/zinc/85/48/10/1432854810.db2.gz XMWSGFHFGXCPAG-UHFFFAOYSA-N 0 0 391.859 3.126 20 5 GGBDRN COc1cc(C)c(CN(C)C(=O)CCNc2ccccc2[N+](=O)[O-])cc1OC ZINC000192531698 1432855808 /nfs/dbraw/zinc/85/58/08/1432855808.db2.gz GELTVAFKEZMIBD-UHFFFAOYSA-N 0 0 387.436 3.381 20 5 GGBDRN O=C([C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CCC[C@@H]1c1ccccc1 ZINC000192535880 1432856257 /nfs/dbraw/zinc/85/62/57/1432856257.db2.gz ZAASQYMVPQUGRT-MAUKXSAKSA-N 0 0 397.406 3.451 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000192542403 1432857236 /nfs/dbraw/zinc/85/72/36/1432857236.db2.gz COKNQFYZWFAIFM-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN O=C(CC1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1)N1CCCC1 ZINC000192547258 1432857699 /nfs/dbraw/zinc/85/76/99/1432857699.db2.gz KCAORDZTMLUQGD-UHFFFAOYSA-N 0 0 379.844 3.113 20 5 GGBDRN CSc1ccc(C(=O)N2CCC(CC(=O)N3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000192546781 1432857711 /nfs/dbraw/zinc/85/77/11/1432857711.db2.gz AIGVYHONOUDRKK-UHFFFAOYSA-N 0 0 391.493 3.181 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](c1cccc(Cl)c1)N1CCOCC1 ZINC000192558726 1432859789 /nfs/dbraw/zinc/85/97/89/1432859789.db2.gz QCHJNEGIOFTKOR-INIZCTEOSA-N 0 0 393.875 3.258 20 5 GGBDRN COC(=O)c1ccc(N2CCCC2)c(NC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000192560434 1432860037 /nfs/dbraw/zinc/86/00/37/1432860037.db2.gz BFKZBZRMEMWVBO-UHFFFAOYSA-N 0 0 375.406 3.295 20 5 GGBDRN Cc1ccc(C(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000192565056 1432860715 /nfs/dbraw/zinc/86/07/15/1432860715.db2.gz ULRMSFIBCVRYOR-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(O)(c3ccccc3Cl)CC2)c1 ZINC000192568753 1432861172 /nfs/dbraw/zinc/86/11/72/1432861172.db2.gz IOOOTGQUMIMPQP-UHFFFAOYSA-N 0 0 390.823 3.381 20 5 GGBDRN CCc1[nH]nc(C(=O)N(Cc2ccco2)c2ccc(OC)c(F)c2)c1[N+](=O)[O-] ZINC000192605849 1432865186 /nfs/dbraw/zinc/86/51/86/1432865186.db2.gz HGBPUUWFRHPVKC-UHFFFAOYSA-N 0 0 388.355 3.468 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1ccc(N(C)C(=O)c2ccncc2)cc1 ZINC000192608226 1432865426 /nfs/dbraw/zinc/86/54/26/1432865426.db2.gz YRWBNKJPRWLRTC-UHFFFAOYSA-N 0 0 394.435 3.403 20 5 GGBDRN Cc1cc(NC(=O)CN(C)Cc2ccccc2[N+](=O)[O-])n(-c2ccc(C)cc2)n1 ZINC000192638079 1432869757 /nfs/dbraw/zinc/86/97/57/1432869757.db2.gz HSQXKQOCQMDQNW-UHFFFAOYSA-N 0 0 393.447 3.468 20 5 GGBDRN CNC(=O)c1ccc(OC)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000192640178 1432869927 /nfs/dbraw/zinc/86/99/27/1432869927.db2.gz VYXULQRMRFWZCA-UHFFFAOYSA-N 0 0 385.401 3.430 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCC(=O)N1CCC(Cc2ccccc2)CC1 ZINC000192642440 1432870426 /nfs/dbraw/zinc/87/04/26/1432870426.db2.gz QNOWXOHSUNJAOT-UHFFFAOYSA-N 0 0 385.468 3.013 20 5 GGBDRN C[C@H]1CO[C@@H](c2ccccc2Cl)CN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000192660147 1432872284 /nfs/dbraw/zinc/87/22/84/1432872284.db2.gz YRVWJPBIAFTNGS-APPDUMDISA-N 0 0 375.812 3.314 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC(Nc2cc(OC)cc(OC)c2)CC1 ZINC000192668033 1432873255 /nfs/dbraw/zinc/87/32/55/1432873255.db2.gz SJLTZBQHKFEMJY-UHFFFAOYSA-N 0 0 389.456 3.218 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)nc2ccccc12 ZINC000192673940 1432874124 /nfs/dbraw/zinc/87/41/24/1432874124.db2.gz RVSBDBXREGBYMG-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3ncsc3c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000192676319 1432874262 /nfs/dbraw/zinc/87/42/62/1432874262.db2.gz HQTKRXXHHBQHMK-UHFFFAOYSA-N 0 0 380.389 3.346 20 5 GGBDRN COc1cccc(C(=O)NCc2nccn2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000192688549 1432875683 /nfs/dbraw/zinc/87/56/83/1432875683.db2.gz SDAYLIBZAMAPPL-UHFFFAOYSA-N 0 0 394.431 3.363 20 5 GGBDRN Cc1ccn(C)c(=O)c1NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192689791 1432875687 /nfs/dbraw/zinc/87/56/87/1432875687.db2.gz CHBGGIYJBKOMKZ-UHFFFAOYSA-N 0 0 393.399 3.433 20 5 GGBDRN CCc1c(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cnn1-c1ccccc1C ZINC000192691041 1432875883 /nfs/dbraw/zinc/87/58/83/1432875883.db2.gz GLONYVYYGSAXSB-UHFFFAOYSA-N 0 0 379.420 3.362 20 5 GGBDRN O=C(Nc1ccc(N2CCCCC2)cn1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000192697123 1432876704 /nfs/dbraw/zinc/87/67/04/1432876704.db2.gz WPBYUBXHNQVGAF-UHFFFAOYSA-N 0 0 392.419 3.418 20 5 GGBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CC[C@@]2(CCOC2)C1 ZINC000192707061 1432878012 /nfs/dbraw/zinc/87/80/12/1432878012.db2.gz FUIKLMSULHRZTB-OAQYLSRUSA-N 0 0 382.416 3.426 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2ccc(C(F)(F)F)cc2)CC1 ZINC000192714515 1432878971 /nfs/dbraw/zinc/87/89/71/1432878971.db2.gz ATFMPYCCDAILHQ-UHFFFAOYSA-N 0 0 383.374 3.465 20 5 GGBDRN COc1cc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000192720931 1432879777 /nfs/dbraw/zinc/87/97/77/1432879777.db2.gz JCYLGPJGYISYDG-JTQLQIEISA-N 0 0 377.784 3.073 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCn3c4ccccc4nc32)cc1[N+](=O)[O-] ZINC000192724293 1432880103 /nfs/dbraw/zinc/88/01/03/1432880103.db2.gz FVOLIWSYPHCCNB-UHFFFAOYSA-N 0 0 392.824 3.115 20 5 GGBDRN CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000192730515 1432881322 /nfs/dbraw/zinc/88/13/22/1432881322.db2.gz ZPXMLLAHIWNKRE-UHFFFAOYSA-N 0 0 391.449 3.071 20 5 GGBDRN CCc1c(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cnn1-c1cccc(C)c1 ZINC000192733354 1432881595 /nfs/dbraw/zinc/88/15/95/1432881595.db2.gz FQMHLJLDEXKBQW-UHFFFAOYSA-N 0 0 379.420 3.362 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCCCC[C@@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000192742260 1432883192 /nfs/dbraw/zinc/88/31/92/1432883192.db2.gz KZARNKWRNQITNC-LJQANCHMSA-N 0 0 398.463 3.115 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000192771565 1432888223 /nfs/dbraw/zinc/88/82/23/1432888223.db2.gz PFBLNMWSZXGUEZ-LBPRGKRZSA-N 0 0 380.759 3.074 20 5 GGBDRN CCO[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000192778132 1432889489 /nfs/dbraw/zinc/88/94/89/1432889489.db2.gz RHDLUUZYHORIRL-IBGZPJMESA-N 0 0 380.404 3.288 20 5 GGBDRN Cc1c(CNC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])cnn1C ZINC000192786791 1432890971 /nfs/dbraw/zinc/89/09/71/1432890971.db2.gz LIIWVKVQMABGQH-UHFFFAOYSA-N 0 0 380.404 3.146 20 5 GGBDRN C[C@@]1(c2ccc(F)cc2)NC(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000192789835 1432891245 /nfs/dbraw/zinc/89/12/45/1432891245.db2.gz RDEZKBGAFUAFDI-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN CC[C@@](NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])(C(N)=O)C(C)C ZINC000192819213 1432894611 /nfs/dbraw/zinc/89/46/11/1432894611.db2.gz AWPNLRKFEPNZKA-NRFANRHFSA-N 0 0 399.447 3.194 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)c1[N+](=O)[O-] ZINC000192820068 1432894971 /nfs/dbraw/zinc/89/49/71/1432894971.db2.gz IOVINKOCIHLUGY-UHFFFAOYSA-N 0 0 380.408 3.271 20 5 GGBDRN O=c1c2cnn(-c3ccccc3)c2ncn1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000192820742 1432894981 /nfs/dbraw/zinc/89/49/81/1432894981.db2.gz TXLCHVZQJNXGML-UHFFFAOYSA-N 0 0 381.779 3.192 20 5 GGBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000192828373 1432895985 /nfs/dbraw/zinc/89/59/85/1432895985.db2.gz QULWMMVMPNJQNW-UHFFFAOYSA-N 0 0 390.783 3.119 20 5 GGBDRN O=C(NCc1ccccc1CN1CCCC1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000192833135 1432896560 /nfs/dbraw/zinc/89/65/60/1432896560.db2.gz WDKMAVXEQANJAS-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN CCOCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)c(F)c1 ZINC000192841240 1432897850 /nfs/dbraw/zinc/89/78/50/1432897850.db2.gz JUMZANCDGUTMRT-UHFFFAOYSA-N 0 0 386.376 3.105 20 5 GGBDRN CC(C)c1ccc(CN(C)C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1 ZINC000192854998 1432899318 /nfs/dbraw/zinc/89/93/18/1432899318.db2.gz RRDYMFZMKZRQFJ-UHFFFAOYSA-N 0 0 390.461 3.394 20 5 GGBDRN CCN(CC(=O)Nc1ccccc1OC)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000192856099 1432899618 /nfs/dbraw/zinc/89/96/18/1432899618.db2.gz XKQXEGHWZNCEPI-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN COC(=O)c1ccc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 ZINC000192869738 1432901291 /nfs/dbraw/zinc/90/12/91/1432901291.db2.gz SYEYHTSXWDTFHE-UHFFFAOYSA-N 0 0 387.367 3.373 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(O)(c1ccccc1)c1ccccc1 ZINC000192892476 1432903775 /nfs/dbraw/zinc/90/37/75/1432903775.db2.gz VIPYLBCKGILLQO-UHFFFAOYSA-N 0 0 376.412 3.489 20 5 GGBDRN CCCc1c(NC(=O)c2n[nH]c(CC)c2[N+](=O)[O-])cnn1-c1cccc(F)c1 ZINC000192895315 1432904166 /nfs/dbraw/zinc/90/41/66/1432904166.db2.gz HXJBJHAXARLWPV-UHFFFAOYSA-N 0 0 386.387 3.410 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000192902536 1432905157 /nfs/dbraw/zinc/90/51/57/1432905157.db2.gz PMFAHCMZSKEMJE-INIZCTEOSA-N 0 0 376.796 3.471 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)c1 ZINC000192909803 1432906169 /nfs/dbraw/zinc/90/61/69/1432906169.db2.gz DGKCUIBLUJWIDH-ZDUSSCGKSA-N 0 0 387.417 3.304 20 5 GGBDRN Cc1cc(NC(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000192920257 1432907822 /nfs/dbraw/zinc/90/78/22/1432907822.db2.gz FLIWZSAYWHPVCH-YIONKMFJSA-N 0 0 382.420 3.423 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC2(CCCC2)c2ccccc21 ZINC000192922632 1432908453 /nfs/dbraw/zinc/90/84/53/1432908453.db2.gz HKWYRKBHTTZUHO-UHFFFAOYSA-N 0 0 395.415 3.401 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Cl)ccc2O[C@H](C)COC)c1[N+](=O)[O-] ZINC000192934047 1432910016 /nfs/dbraw/zinc/91/00/16/1432910016.db2.gz PIYWIKKZRVEFBZ-SECBINFHSA-N 0 0 382.804 3.200 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Cl)ccc2O[C@@H](C)COC)c1[N+](=O)[O-] ZINC000192934033 1432910060 /nfs/dbraw/zinc/91/00/60/1432910060.db2.gz PIYWIKKZRVEFBZ-VIFPVBQESA-N 0 0 382.804 3.200 20 5 GGBDRN COc1cc(CN[C@@H](C)c2nnc3ccccn32)c([N+](=O)[O-])cc1OC(F)F ZINC000192937294 1432910223 /nfs/dbraw/zinc/91/02/23/1432910223.db2.gz UQVATXZWODPPIX-JTQLQIEISA-N 0 0 393.350 3.098 20 5 GGBDRN Cc1nc2ccc(NC(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2o1 ZINC000192937569 1432910334 /nfs/dbraw/zinc/91/03/34/1432910334.db2.gz JFUJFXMXMSMVSD-UHFFFAOYSA-N 0 0 381.392 3.399 20 5 GGBDRN Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192988981 1432918176 /nfs/dbraw/zinc/91/81/76/1432918176.db2.gz CDXAOEXFMXGBRW-MSOLQXFVSA-N 0 0 396.491 3.291 20 5 GGBDRN COc1cc(CCNC(=O)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OC ZINC000192992765 1432918631 /nfs/dbraw/zinc/91/86/31/1432918631.db2.gz ZIUGUYZRPJWPTQ-UHFFFAOYSA-N 0 0 387.417 3.194 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000192999267 1432919509 /nfs/dbraw/zinc/91/95/09/1432919509.db2.gz PNDQREWIZVWPCY-HIFRSBDPSA-N 0 0 379.457 3.375 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@@H]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000192999305 1432919654 /nfs/dbraw/zinc/91/96/54/1432919654.db2.gz PNDQREWIZVWPCY-DZGCQCFKSA-N 0 0 379.457 3.375 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nccn2CCS(=O)(=O)c2ccc(F)cc2)cc1 ZINC000193000808 1432919923 /nfs/dbraw/zinc/91/99/23/1432919923.db2.gz CQPPOUSQFPTHRD-UHFFFAOYSA-N 0 0 375.381 3.071 20 5 GGBDRN CCCNc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000193009438 1432921802 /nfs/dbraw/zinc/92/18/02/1432921802.db2.gz RECVXEZMQPHJTF-UHFFFAOYSA-N 0 0 398.463 3.183 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(C(=O)NCC(F)(F)F)cc1 ZINC000193016948 1432922638 /nfs/dbraw/zinc/92/26/38/1432922638.db2.gz HBPMQPJPUNLZDV-UHFFFAOYSA-N 0 0 396.325 3.209 20 5 GGBDRN O=C(NCc1ccccc1CN1CCCC1=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000193017262 1432922758 /nfs/dbraw/zinc/92/27/58/1432922758.db2.gz IPGKKUHLRDHMGM-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN C[C@H](CC1CCCCC1)NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000193017513 1432922786 /nfs/dbraw/zinc/92/27/86/1432922786.db2.gz ARCIEPJANLZWOX-GFCCVEGCSA-N 0 0 381.860 3.453 20 5 GGBDRN COc1ccccc1N1CC[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1=O ZINC000193019063 1432922899 /nfs/dbraw/zinc/92/28/99/1432922899.db2.gz BRWNMRAYHOUIMG-ROUUACIJSA-N 0 0 381.432 3.376 20 5 GGBDRN CCCNc1ccc(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000193021841 1432923320 /nfs/dbraw/zinc/92/33/20/1432923320.db2.gz PIEHJKQSEFZEPQ-UHFFFAOYSA-N 0 0 380.404 3.188 20 5 GGBDRN C[C@@H](c1ccccc1)N(C)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000193029725 1432924581 /nfs/dbraw/zinc/92/45/81/1432924581.db2.gz WQOOAFNCPCEVDI-ZFWWWQNUSA-N 0 0 387.461 3.481 20 5 GGBDRN O=C(NCc1ccccc1Br)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000193033148 1432925223 /nfs/dbraw/zinc/92/52/23/1432925223.db2.gz AQBQCUSUTURMTN-UHFFFAOYSA-N 0 0 380.154 3.196 20 5 GGBDRN COc1ccc2c(c1)C(=O)N(C1CC1)[C@@H](c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N2 ZINC000193043589 1432926681 /nfs/dbraw/zinc/92/66/81/1432926681.db2.gz NGRMYEUYWKYSFU-KRWDZBQOSA-N 0 0 384.348 3.241 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cnn1C1CCCC1 ZINC000193053082 1432928679 /nfs/dbraw/zinc/92/86/79/1432928679.db2.gz FYWRVMRMJQFMTJ-GFCCVEGCSA-N 0 0 385.424 3.031 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c2cccnc12 ZINC000193075968 1432932386 /nfs/dbraw/zinc/93/23/86/1432932386.db2.gz MZOXOCNZEUKIKS-UHFFFAOYSA-N 0 0 378.388 3.128 20 5 GGBDRN O=C(Cc1ccc(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1)N1CCOCC1 ZINC000193078003 1432933064 /nfs/dbraw/zinc/93/30/64/1432933064.db2.gz FKXTVSQVCLIOKJ-NRFANRHFSA-N 0 0 395.459 3.486 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000193106376 1432936956 /nfs/dbraw/zinc/93/69/56/1432936956.db2.gz OPHLERBRNGFYFN-CQSZACIVSA-N 0 0 384.440 3.324 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)nc1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000193108888 1432937210 /nfs/dbraw/zinc/93/72/10/1432937210.db2.gz XNMIZLIOBXDXPA-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(COc1ccc2c(c1)oc(=O)cc2-c1ccc([N+](=O)[O-])cc1)NCC1CC1 ZINC000193110391 1432937290 /nfs/dbraw/zinc/93/72/90/1432937290.db2.gz GONQZVRADFXVFD-UHFFFAOYSA-N 0 0 394.383 3.273 20 5 GGBDRN Cc1sc2ncn(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)c(=O)c2c1C ZINC000193112294 1432937754 /nfs/dbraw/zinc/93/77/54/1432937754.db2.gz DHSCDULOSMOBNQ-UHFFFAOYSA-N 0 0 383.389 3.081 20 5 GGBDRN CCc1nc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1C ZINC000193119571 1432939273 /nfs/dbraw/zinc/93/92/73/1432939273.db2.gz QGXPPPRYIXOWEJ-JTQLQIEISA-N 0 0 376.438 3.046 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccccc1C(=O)Nc1cccc(Cl)c1 ZINC000193137964 1432942665 /nfs/dbraw/zinc/94/26/65/1432942665.db2.gz KJHDHVGCANTEKY-UHFFFAOYSA-N 0 0 399.794 3.336 20 5 GGBDRN COc1ccc(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1NS(C)(=O)=O ZINC000193140732 1432943056 /nfs/dbraw/zinc/94/30/56/1432943056.db2.gz MTALNMJZIFCMAO-MRXNPFEDSA-N 0 0 391.449 3.464 20 5 GGBDRN Cc1ccccc1-n1nc(C(C)(C)C)cc1NC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000193145046 1432944110 /nfs/dbraw/zinc/94/41/10/1432944110.db2.gz AQHBMMILUZSYNN-UHFFFAOYSA-N 0 0 382.424 3.222 20 5 GGBDRN Cc1cccc(Cc2cnc(NC(=O)Cn3cc([N+](=O)[O-])cn3)s2)c1Cl ZINC000193170969 1432949917 /nfs/dbraw/zinc/94/99/17/1432949917.db2.gz FOIHFSNSMZBHEW-UHFFFAOYSA-N 0 0 391.840 3.439 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000193204385 1432957435 /nfs/dbraw/zinc/95/74/35/1432957435.db2.gz SXDICSHTOWHJAZ-UHFFFAOYSA-N 0 0 389.274 3.219 20 5 GGBDRN C[C@@H]1CCc2ccccc2N1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000193223342 1432961446 /nfs/dbraw/zinc/96/14/46/1432961446.db2.gz XZAPUADJYWSCLS-GFCCVEGCSA-N 0 0 385.445 3.154 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccc(OCC(F)(F)F)cc2)c1 ZINC000193222724 1432961449 /nfs/dbraw/zinc/96/14/49/1432961449.db2.gz BBKQCWQCQSYGGR-UHFFFAOYSA-N 0 0 390.339 3.014 20 5 GGBDRN Cn1nc(-c2cccs2)nc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000193222872 1432961736 /nfs/dbraw/zinc/96/17/36/1432961736.db2.gz JVBUIFHGYUMNST-UHFFFAOYSA-N 0 0 382.405 3.114 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193227237 1432962480 /nfs/dbraw/zinc/96/24/80/1432962480.db2.gz DKGXHNQMGWVXDZ-GOSISDBHSA-N 0 0 387.411 3.147 20 5 GGBDRN C[C@H](c1ccccc1)N1C[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC1=O ZINC000193230199 1432963127 /nfs/dbraw/zinc/96/31/27/1432963127.db2.gz PTQNMIISHZCSEA-CRAIPNDOSA-N 0 0 381.432 3.163 20 5 GGBDRN C[C@@H](c1ccccc1)N1C[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC1=O ZINC000193230184 1432963245 /nfs/dbraw/zinc/96/32/45/1432963245.db2.gz PTQNMIISHZCSEA-MAUKXSAKSA-N 0 0 381.432 3.163 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 ZINC000193234649 1432964561 /nfs/dbraw/zinc/96/45/61/1432964561.db2.gz NNVFSXSWAZJXNA-LJQANCHMSA-N 0 0 395.459 3.035 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000193244566 1432966797 /nfs/dbraw/zinc/96/67/97/1432966797.db2.gz OYNQFSXPFJIVKC-LBPRGKRZSA-N 0 0 391.374 3.131 20 5 GGBDRN C[C@@H]1CCC[C@@H](C)C1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000193258516 1432969059 /nfs/dbraw/zinc/96/90/59/1432969059.db2.gz HCOGRKXREWTXPH-VXGBXAGGSA-N 0 0 389.481 3.429 20 5 GGBDRN CCn1c2nnc(CNc3cc([N+](=O)[O-])c(C)cc3C)n2c2ccccc2c1=O ZINC000193264492 1432971017 /nfs/dbraw/zinc/97/10/17/1432971017.db2.gz ITWFCONEPPWORI-UHFFFAOYSA-N 0 0 392.419 3.201 20 5 GGBDRN Cc1ccc(NC(=O)NCc2cccc(CN3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000193265216 1432971276 /nfs/dbraw/zinc/97/12/76/1432971276.db2.gz QWUAXFXDCGTUGB-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN CC(C)Oc1ccc([C@H](C)NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000193272145 1432972423 /nfs/dbraw/zinc/97/24/23/1432972423.db2.gz ZMLUQQQRWACTNF-ZDUSSCGKSA-N 0 0 399.403 3.167 20 5 GGBDRN Cc1cc(=O)c(C(=O)N(C)[C@@H]2CCC[C@H](C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000193286365 1432974288 /nfs/dbraw/zinc/97/42/88/1432974288.db2.gz KAWIFVOGCODISD-DZGCQCFKSA-N 0 0 384.436 3.100 20 5 GGBDRN Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1 ZINC000193291623 1432974530 /nfs/dbraw/zinc/97/45/30/1432974530.db2.gz KVFLTXUUPZQGED-CYBMUJFWSA-N 0 0 376.434 3.140 20 5 GGBDRN O=C(c1cc(O)ccc1C(F)(F)F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000193294551 1432975197 /nfs/dbraw/zinc/97/51/97/1432975197.db2.gz MCPDDSDZHQXYPU-SNVBAGLBSA-N 0 0 396.325 3.041 20 5 GGBDRN C[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000193294667 1432975261 /nfs/dbraw/zinc/97/52/61/1432975261.db2.gz ZGUGMXBZQQFUDK-LLVKDONJSA-N 0 0 396.852 3.485 20 5 GGBDRN C[C@@H](Nc1ccc2c(c1)CC(=O)N2C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000193341495 1432982526 /nfs/dbraw/zinc/98/25/26/1432982526.db2.gz MPAFXPYIDZPLCX-SNVBAGLBSA-N 0 0 388.811 3.206 20 5 GGBDRN CCc1nc(NC(=O)C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)sc1C ZINC000193353275 1432984570 /nfs/dbraw/zinc/98/45/70/1432984570.db2.gz UXUWWYWMEZTOLJ-UHFFFAOYSA-N 0 0 388.449 3.052 20 5 GGBDRN Cc1nc(Cl)ccc1NC(=O)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000193353301 1432984657 /nfs/dbraw/zinc/98/46/57/1432984657.db2.gz CQXFNSFHAJXQEV-UHFFFAOYSA-N 0 0 388.811 3.081 20 5 GGBDRN CC(C)CCOC1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000193358799 1432985199 /nfs/dbraw/zinc/98/51/99/1432985199.db2.gz OEFGINBANRCOLM-UHFFFAOYSA-N 0 0 386.452 3.448 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCC(OCCC(C)C)CC2)cc1[N+](=O)[O-] ZINC000193362198 1432985746 /nfs/dbraw/zinc/98/57/46/1432985746.db2.gz YVVBAGUQDFTVFZ-UHFFFAOYSA-N 0 0 379.413 3.479 20 5 GGBDRN Cc1nc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)sc1C ZINC000193370093 1432986529 /nfs/dbraw/zinc/98/65/29/1432986529.db2.gz GHSNUJSJYMPXAJ-UHFFFAOYSA-N 0 0 376.438 3.044 20 5 GGBDRN Cc1nc(Cl)ccc1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000193370064 1432986531 /nfs/dbraw/zinc/98/65/31/1432986531.db2.gz BOJJCBJJIDHIGZ-UHFFFAOYSA-N 0 0 390.827 3.327 20 5 GGBDRN Cc1cc(N2CCN(Cc3nc(-c4cccs4)no3)CC2)ccc1[N+](=O)[O-] ZINC000193379846 1432987966 /nfs/dbraw/zinc/98/79/66/1432987966.db2.gz YETGILXCWWXSRB-UHFFFAOYSA-N 0 0 385.449 3.337 20 5 GGBDRN Cc1sc(NC(=O)CN2CCCCCC2=O)nc1-c1cccc([N+](=O)[O-])c1 ZINC000193389388 1432989462 /nfs/dbraw/zinc/98/94/62/1432989462.db2.gz HIGPFVCNDFDHFW-UHFFFAOYSA-N 0 0 388.449 3.368 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(CNc3cc(N)ccc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000193394674 1432990361 /nfs/dbraw/zinc/99/03/61/1432990361.db2.gz IARKIJNEURQWEK-OKILXGFUSA-N 0 0 384.436 3.039 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000193393932 1432990397 /nfs/dbraw/zinc/99/03/97/1432990397.db2.gz DQGVPJAIJKNNSQ-QGZVFWFLSA-N 0 0 375.450 3.150 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCCc3cc(N)ccc32)c1[N+](=O)[O-] ZINC000193396246 1432990564 /nfs/dbraw/zinc/99/05/64/1432990564.db2.gz BBDZNKJOXGRKIF-MRXNPFEDSA-N 0 0 375.450 3.150 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1 ZINC000193400231 1432991595 /nfs/dbraw/zinc/99/15/95/1432991595.db2.gz GYSQBXPDXWZOQR-FQEVSTJZSA-N 0 0 391.468 3.149 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)CCOc1ccc(Cl)cc1 ZINC000193402799 1432991827 /nfs/dbraw/zinc/99/18/27/1432991827.db2.gz WIRHXZIQPHNOID-UHFFFAOYSA-N 0 0 393.827 3.477 20 5 GGBDRN CCOc1ccc(C(=O)N2CCc3c(cccc3NC(C)=O)C2)cc1[N+](=O)[O-] ZINC000193403971 1432992080 /nfs/dbraw/zinc/99/20/80/1432992080.db2.gz LCIRAXKWWODNED-UHFFFAOYSA-N 0 0 383.404 3.150 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000193414067 1432993753 /nfs/dbraw/zinc/99/37/53/1432993753.db2.gz JONPVVCDCXQLED-NSHDSACASA-N 0 0 377.347 3.340 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])CC2)s1 ZINC000193418055 1432994793 /nfs/dbraw/zinc/99/47/93/1432994793.db2.gz PSFZNJOHZCPGAB-UHFFFAOYSA-N 0 0 393.852 3.216 20 5 GGBDRN CSc1ccc(C(=O)Nc2ccccc2CN2CCOCC2)cc1[N+](=O)[O-] ZINC000193418879 1432994925 /nfs/dbraw/zinc/99/49/25/1432994925.db2.gz JRTZRVPJBYKFHY-UHFFFAOYSA-N 0 0 387.461 3.401 20 5 GGBDRN CSc1ccc(C(=O)c2ccccc2C(=O)NCc2cc[nH]n2)cc1[N+](=O)[O-] ZINC000193422462 1432995595 /nfs/dbraw/zinc/99/55/95/1432995595.db2.gz QMNBHTYHDQDKCM-UHFFFAOYSA-N 0 0 396.428 3.201 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CC=C(c2c[nH]c3cc(F)ccc32)CC1 ZINC000193423453 1432995980 /nfs/dbraw/zinc/99/59/80/1432995980.db2.gz LQSUNBCXBLAYNB-UHFFFAOYSA-N 0 0 382.351 3.245 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCCN1C(=O)c1cccs1 ZINC000193431990 1432997892 /nfs/dbraw/zinc/99/78/92/1432997892.db2.gz QSYQEVAUUYITCB-MRXNPFEDSA-N 0 0 387.461 3.010 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2CC(=O)N([C@H](C)c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000193437975 1432999131 /nfs/dbraw/zinc/99/91/31/1432999131.db2.gz MRBRDDOWCVJHOZ-UKRRQHHQSA-N 0 0 383.404 3.152 20 5 GGBDRN COc1ccccc1CN(CCO)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000193443876 1432999999 /nfs/dbraw/zinc/99/99/99/1432999999.db2.gz IXHULUHCUMNTGB-UHFFFAOYSA-N 0 0 386.429 3.453 20 5 GGBDRN CCO[C@@H](C)c1nc(CN2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)cs1 ZINC000193457360 1433002550 /nfs/dbraw/zinc/00/25/50/1433002550.db2.gz KCNVUTSZRCWTLH-ZDUSSCGKSA-N 0 0 391.497 3.053 20 5 GGBDRN CN(C(=O)COc1c(F)c(F)c(F)c(F)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000193460227 1433003297 /nfs/dbraw/zinc/00/32/97/1433003297.db2.gz JHKBIEYRQFTLFU-UHFFFAOYSA-N 0 0 376.237 3.332 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000193473676 1433004939 /nfs/dbraw/zinc/00/49/39/1433004939.db2.gz XFZGNEIMEQCWRE-CQSZACIVSA-N 0 0 397.431 3.052 20 5 GGBDRN CN(CC1CCCCC1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000193474959 1433005197 /nfs/dbraw/zinc/00/51/97/1433005197.db2.gz QSKFSJBJIKZUKF-UHFFFAOYSA-N 0 0 385.367 3.173 20 5 GGBDRN Cc1ccc(COC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)cc1 ZINC000193491967 1433008280 /nfs/dbraw/zinc/00/82/80/1433008280.db2.gz PFVNAOXCDGNIPX-UHFFFAOYSA-N 0 0 379.372 3.115 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cnn1C1CCCC1 ZINC000193499389 1433009657 /nfs/dbraw/zinc/00/96/57/1433009657.db2.gz PMYGXMMZTLFZDQ-CYBMUJFWSA-N 0 0 399.451 3.339 20 5 GGBDRN O=C(Nc1ccc(N2CCC(O)CC2)cc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000193499920 1433009941 /nfs/dbraw/zinc/00/99/41/1433009941.db2.gz IVTHUPNISPXVFB-UHFFFAOYSA-N 0 0 375.812 3.462 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000193502291 1433010381 /nfs/dbraw/zinc/01/03/81/1433010381.db2.gz QFXBOEPBAOQEFU-UHFFFAOYSA-N 0 0 376.359 3.486 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccc(-n2nc(C)cc2C)nc1 ZINC000193507077 1433010848 /nfs/dbraw/zinc/01/08/48/1433010848.db2.gz YIUDCXGSSSUHIN-UHFFFAOYSA-N 0 0 396.407 3.123 20 5 GGBDRN COc1ccc(CN(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000193511446 1433011684 /nfs/dbraw/zinc/01/16/84/1433011684.db2.gz YARGXJCILNMUEB-ZDUSSCGKSA-N 0 0 378.450 3.200 20 5 GGBDRN C[C@H]1C[C@@H]1c1ccc(CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000193530800 1433015274 /nfs/dbraw/zinc/01/52/74/1433015274.db2.gz ITEZJICQGRDQKX-SJCJKPOMSA-N 0 0 383.404 3.441 20 5 GGBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000193532440 1433015696 /nfs/dbraw/zinc/01/56/96/1433015696.db2.gz FNTBXUQJOHBWNF-CQSZACIVSA-N 0 0 398.202 3.216 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCCc1csc2ccccc12 ZINC000193535484 1433015871 /nfs/dbraw/zinc/01/58/71/1433015871.db2.gz JTOBIRXWCQCINR-UHFFFAOYSA-N 0 0 397.412 3.076 20 5 GGBDRN CC[C@@H](c1nnc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)s1)c1ccccc1 ZINC000193560598 1433019864 /nfs/dbraw/zinc/01/98/64/1433019864.db2.gz BONHLKFWPPIDKD-GFCCVEGCSA-N 0 0 385.405 3.341 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccccc1 ZINC000193565681 1433020566 /nfs/dbraw/zinc/02/05/66/1433020566.db2.gz NQOKSAPMNVOHOV-GOSISDBHSA-N 0 0 379.372 3.223 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCc1c(C)nn(CC(C)C)c1C ZINC000193587908 1433024387 /nfs/dbraw/zinc/02/43/87/1433024387.db2.gz ACGWSYZJFRSSKP-UHFFFAOYSA-N 0 0 388.468 3.322 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc2cnn(C(C)C)c2nc1C ZINC000193588384 1433024432 /nfs/dbraw/zinc/02/44/32/1433024432.db2.gz AMWDLKQCMZBBEK-UHFFFAOYSA-N 0 0 383.408 3.167 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1COc2ccc(Cl)cc2C1 ZINC000193587869 1433024475 /nfs/dbraw/zinc/02/44/75/1433024475.db2.gz WKEJBIOLPLUHPC-ZDUSSCGKSA-N 0 0 376.796 3.124 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c(C)c1 ZINC000193591392 1433025124 /nfs/dbraw/zinc/02/51/24/1433025124.db2.gz DCZKDPOMFPYZGY-UHFFFAOYSA-N 0 0 382.420 3.455 20 5 GGBDRN CCc1c(C(=O)NCc2cc([N+](=O)[O-])ccc2OC)cnn1Cc1ccccc1 ZINC000193596015 1433025913 /nfs/dbraw/zinc/02/59/13/1433025913.db2.gz AGTZBGNSZUFXAF-UHFFFAOYSA-N 0 0 394.431 3.341 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000193596721 1433025943 /nfs/dbraw/zinc/02/59/43/1433025943.db2.gz ZGRKAVRMCBQLRL-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H](C)c1cc(F)ccc1F ZINC000193605861 1433027492 /nfs/dbraw/zinc/02/74/92/1433027492.db2.gz GIJCJFZAEYDPGD-JTQLQIEISA-N 0 0 393.346 3.040 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000193607111 1433027892 /nfs/dbraw/zinc/02/78/92/1433027892.db2.gz IAPPRQPQUSYHAK-LLVKDONJSA-N 0 0 377.347 3.340 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCc1cnc(-c2ccccc2)s1 ZINC000193624322 1433030694 /nfs/dbraw/zinc/03/06/94/1433030694.db2.gz KVCGDDCEGJFCEP-UHFFFAOYSA-N 0 0 397.412 3.192 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(c3ncnc4sccc43)CC2)ccc1[N+](=O)[O-] ZINC000193631065 1433031260 /nfs/dbraw/zinc/03/12/60/1433031260.db2.gz MJLRQOIAELNONP-UHFFFAOYSA-N 0 0 398.448 3.262 20 5 GGBDRN O=C(Nc1ccccc1)C1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000193635927 1433031740 /nfs/dbraw/zinc/03/17/40/1433031740.db2.gz OZMHEAKKDQNHNB-UHFFFAOYSA-N 0 0 384.392 3.354 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3cccc(Cn4cccn4)c3)cc2N1 ZINC000193635630 1433031850 /nfs/dbraw/zinc/03/18/50/1433031850.db2.gz UXBPLNHVBGUABV-UHFFFAOYSA-N 0 0 377.404 3.336 20 5 GGBDRN Cc1c(C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000193641427 1433032762 /nfs/dbraw/zinc/03/27/62/1433032762.db2.gz ZBGGFDIVQLPTAG-UHFFFAOYSA-N 0 0 383.360 3.447 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 ZINC000193641601 1433032809 /nfs/dbraw/zinc/03/28/09/1433032809.db2.gz WJCXMUVXTTVQEP-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN O=C(Nc1nnc(Cc2cccc(Cl)c2)s1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000193646117 1433033381 /nfs/dbraw/zinc/03/33/81/1433033381.db2.gz ZIVDHZSRJISALP-UHFFFAOYSA-N 0 0 391.796 3.043 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(-c2ccccc2)cn1 ZINC000193654274 1433034888 /nfs/dbraw/zinc/03/48/88/1433034888.db2.gz SQFOFXQAVKVUPZ-UHFFFAOYSA-N 0 0 390.355 3.203 20 5 GGBDRN Cc1ccc(CC(=O)OCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000193671723 1433038026 /nfs/dbraw/zinc/03/80/26/1433038026.db2.gz YEKPEPDWRNLBKH-UHFFFAOYSA-N 0 0 376.796 3.072 20 5 GGBDRN CCc1ccc(C(=O)OCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000193671966 1433038064 /nfs/dbraw/zinc/03/80/64/1433038064.db2.gz HBUCICJJJKXAJK-UHFFFAOYSA-N 0 0 382.825 3.459 20 5 GGBDRN Cc1cc(C)c(CCNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 ZINC000193675415 1433038532 /nfs/dbraw/zinc/03/85/32/1433038532.db2.gz GDXICQZOALCATQ-UHFFFAOYSA-N 0 0 389.839 3.471 20 5 GGBDRN Cc1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)ccc1[N+](=O)[O-] ZINC000193677948 1433039197 /nfs/dbraw/zinc/03/91/97/1433039197.db2.gz HGAGNJFWNVNVQI-IBGZPJMESA-N 0 0 384.436 3.098 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCCc1nc2ccccc2c(=O)[nH]1 ZINC000193679332 1433039279 /nfs/dbraw/zinc/03/92/79/1433039279.db2.gz RBRPBVRUXZGEJE-UHFFFAOYSA-N 0 0 380.404 3.410 20 5 GGBDRN COC[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000193687379 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Cc1c(C(=O)N[C@H](C)Cc2ccccc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000194112739 1433119662 /nfs/dbraw/zinc/11/96/62/1433119662.db2.gz CBOJLWYYMOSKPQ-CQSZACIVSA-N 0 0 379.420 3.153 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCc2[nH]c3ccccc3c2C1 ZINC000194112017 1433119743 /nfs/dbraw/zinc/11/97/43/1433119743.db2.gz OXTUIJFRZYXLFY-UHFFFAOYSA-N 0 0 398.806 3.253 20 5 GGBDRN CCCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1cccc([N+](=O)[O-])c1 ZINC000194121397 1433121176 /nfs/dbraw/zinc/12/11/76/1433121176.db2.gz IORFEFOBPLKITA-UHFFFAOYSA-N 0 0 375.385 3.150 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C1(c2cccc(F)c2)CCOCC1 ZINC000194124010 1433121738 /nfs/dbraw/zinc/12/17/38/1433121738.db2.gz XVXBSYUYIOGMGT-UHFFFAOYSA-N 0 0 388.395 3.107 20 5 GGBDRN CCCN(C(=O)[C@H]1CN(Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000194125875 1433122073 /nfs/dbraw/zinc/12/20/73/1433122073.db2.gz OEOKSRNDPSGEFT-HXUWFJFHSA-N 0 0 383.448 3.239 20 5 GGBDRN Cc1ccc(NCCCNC(=O)Nc2ccc3c(c2)CC(=O)N3C)c([N+](=O)[O-])c1 ZINC000194126391 1433122081 /nfs/dbraw/zinc/12/20/81/1433122081.db2.gz IOHADTMAIPPFPE-UHFFFAOYSA-N 0 0 397.435 3.046 20 5 GGBDRN CCCN(C(=O)C(=O)c1cnn(-c2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000194133296 1433123241 /nfs/dbraw/zinc/12/32/41/1433123241.db2.gz ZACVCWSUGYXXJO-UHFFFAOYSA-N 0 0 378.388 3.406 20 5 GGBDRN COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)cc1 ZINC000194134362 1433123244 /nfs/dbraw/zinc/12/32/44/1433123244.db2.gz JFMZBQFZNNHFIK-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN CCCN(C(=O)c1cccc(C(=O)N2CCCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000194133437 1433123296 /nfs/dbraw/zinc/12/32/96/1433123296.db2.gz ROENBFJXRQRVOE-UHFFFAOYSA-N 0 0 382.420 3.283 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccccc2F)cc1Br ZINC000194134655 1433123538 /nfs/dbraw/zinc/12/35/38/1433123538.db2.gz NWFTXPIHDNNFPM-UHFFFAOYSA-N 0 0 375.175 3.297 20 5 GGBDRN CCCN(C(=O)CCc1c(C)nc2ncnn2c1C)c1cccc([N+](=O)[O-])c1 ZINC000194135172 1433123543 /nfs/dbraw/zinc/12/35/43/1433123543.db2.gz QEPQRPLZHCFVJD-UHFFFAOYSA-N 0 0 382.424 3.025 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1Br ZINC000194135840 1433123558 /nfs/dbraw/zinc/12/35/58/1433123558.db2.gz VRIOLGVGHURLQM-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc(F)ccc2F)cc1Br ZINC000194135864 1433123575 /nfs/dbraw/zinc/12/35/75/1433123575.db2.gz AONOZZABGGCFJP-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN COCCN(C(=O)c1ccnc(C)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000194138090 1433123841 /nfs/dbraw/zinc/12/38/41/1433123841.db2.gz RCDJURMUIGJDQP-UHFFFAOYSA-N 0 0 399.432 3.110 20 5 GGBDRN CCCN(C(=O)c1ccc(=O)n(-c2ccccc2F)n1)c1cccc([N+](=O)[O-])c1 ZINC000194147695 1433126810 /nfs/dbraw/zinc/12/68/10/1433126810.db2.gz LBIBYWOWIBBJHR-UHFFFAOYSA-N 0 0 396.378 3.337 20 5 GGBDRN O=C(NC[C@H]1CCCC1=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000194160778 1433128651 /nfs/dbraw/zinc/12/86/51/1433128651.db2.gz FQOUBOBPSPDCHP-SECBINFHSA-N 0 0 397.218 3.186 20 5 GGBDRN O=C(NCCCOCC(F)(F)F)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000194158881 1433128899 /nfs/dbraw/zinc/12/88/99/1433128899.db2.gz AMTVSUQCLFVAGD-UHFFFAOYSA-N 0 0 389.374 3.284 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000194177802 1433132617 /nfs/dbraw/zinc/13/26/17/1433132617.db2.gz ZXMKSXMCBAVUIA-UHFFFAOYSA-N 0 0 382.735 3.150 20 5 GGBDRN COc1cccc(C(=O)Nc2ccccc2CN2CCSCC2)c1[N+](=O)[O-] ZINC000194184325 1433133899 /nfs/dbraw/zinc/13/38/99/1433133899.db2.gz WAQHWSKSEOCDOJ-UHFFFAOYSA-N 0 0 387.461 3.405 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N[C@@H]2CCN(C)C(=O)C2)cc1[N+](=O)[O-] ZINC000194189909 1433134907 /nfs/dbraw/zinc/13/49/07/1433134907.db2.gz KZVHUHXHNRLXFI-CQSZACIVSA-N 0 0 379.482 3.084 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCNC(=O)C[C@H]2c2ccccc2)c1 ZINC000194202449 1433137875 /nfs/dbraw/zinc/13/78/75/1433137875.db2.gz OISQJBBRYKGPNI-KRWDZBQOSA-N 0 0 385.445 3.020 20 5 GGBDRN CC1CCN(c2ccc(NC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000194214052 1433140291 /nfs/dbraw/zinc/14/02/91/1433140291.db2.gz XWCWBDQYOQZKIM-UHFFFAOYSA-N 0 0 382.420 3.408 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)CN1C(=O)CN(c2ccccc2)C1=O ZINC000194241892 1433146843 /nfs/dbraw/zinc/14/68/43/1433146843.db2.gz GLYLVAQLDAMKGP-UHFFFAOYSA-N 0 0 388.811 3.106 20 5 GGBDRN COc1cccc(C(=O)NCCCc2nc3c(s2)CCCC3)c1[N+](=O)[O-] ZINC000194265536 1433151808 /nfs/dbraw/zinc/15/18/08/1433151808.db2.gz UMNXUQRUHBVCGY-UHFFFAOYSA-N 0 0 375.450 3.301 20 5 GGBDRN Cc1ccn2cc(-c3ccc(NC(=O)Cn4cc([N+](=O)[O-])cn4)cc3)nc2c1 ZINC000194267586 1433152710 /nfs/dbraw/zinc/15/27/10/1433152710.db2.gz IHNGXNGBPTZELE-UHFFFAOYSA-N 0 0 376.376 3.053 20 5 GGBDRN COc1ccc(C2(CNC(=O)c3c(C)cccc3[N+](=O)[O-])CCOCC2)cc1 ZINC000194273553 1433153774 /nfs/dbraw/zinc/15/37/74/1433153774.db2.gz VITFJZFHURLRPQ-UHFFFAOYSA-N 0 0 384.432 3.390 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccc(CN2CCCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000194316044 1433160390 /nfs/dbraw/zinc/16/03/90/1433160390.db2.gz XZNDGVBKALAKPA-OAHLLOKOSA-N 0 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1433163011 /nfs/dbraw/zinc/16/30/11/1433163011.db2.gz OJIUXNOLRXACEM-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC(OCCC(C)C)CC1 ZINC000194335146 1433163274 /nfs/dbraw/zinc/16/32/74/1433163274.db2.gz XBNIZUCMNLVGDP-HNNXBMFYSA-N 0 0 393.484 3.458 20 5 GGBDRN COc1ccc(CN(C2CC2)S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1 ZINC000194336393 1433163499 /nfs/dbraw/zinc/16/34/99/1433163499.db2.gz RHSVLHQZLJPVGB-UHFFFAOYSA-N 0 0 380.397 3.096 20 5 GGBDRN CC(C)CCOC1CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000194340501 1433164171 /nfs/dbraw/zinc/16/41/71/1433164171.db2.gz AILWCIAFXSZVEL-UHFFFAOYSA-N 0 0 375.469 3.011 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@H]1CCSc2c(F)cccc21 ZINC000194341002 1433164237 /nfs/dbraw/zinc/16/42/37/1433164237.db2.gz MYDYOHSGEWRERH-LBPRGKRZSA-N 0 0 386.401 3.388 20 5 GGBDRN CCOc1ccc(C(C)=O)cc1CS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000194367448 1433167817 /nfs/dbraw/zinc/16/78/17/1433167817.db2.gz HZVLZJNBKATDOT-UHFFFAOYSA-N 0 0 377.418 3.311 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N(CCO)CC(F)F ZINC000194383703 1433169974 /nfs/dbraw/zinc/16/99/74/1433169974.db2.gz OWHHBZRGCWOAPL-UHFFFAOYSA-N 0 0 382.388 3.446 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(=O)n(C)c3)cc2[N+](=O)[O-])C1 ZINC000194397286 1433172022 /nfs/dbraw/zinc/17/20/22/1433172022.db2.gz DNHMKEGRDSXNIM-OKILXGFUSA-N 0 0 384.436 3.028 20 5 GGBDRN C[C@H](NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C(=O)NC(C)(C)C ZINC000194406597 1433173264 /nfs/dbraw/zinc/17/32/64/1433173264.db2.gz CUWOJCHTQMIJGR-AWEZNQCLSA-N 0 0 399.447 3.207 20 5 GGBDRN COc1cccc(C(=O)N2Cc3ccccc3C[C@@H]2c2nnc(C)o2)c1[N+](=O)[O-] ZINC000194407628 1433173318 /nfs/dbraw/zinc/17/33/18/1433173318.db2.gz VPJJTPVRRJOKGU-MRXNPFEDSA-N 0 0 394.387 3.235 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 ZINC000194426625 1433176038 /nfs/dbraw/zinc/17/60/38/1433176038.db2.gz YGIPKGAECVIMNC-UHFFFAOYSA-N 0 0 394.256 3.359 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 ZINC000194426451 1433176039 /nfs/dbraw/zinc/17/60/39/1433176039.db2.gz MWXLNWZJVSGIBN-UHFFFAOYSA-N 0 0 380.229 3.050 20 5 GGBDRN Cc1ccccc1[C@H](CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)NC(N)=O ZINC000194429194 1433176542 /nfs/dbraw/zinc/17/65/42/1433176542.db2.gz XCEKBBYVBRLBOP-IBGZPJMESA-N 0 0 398.463 3.440 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000194439999 1433178438 /nfs/dbraw/zinc/17/84/38/1433178438.db2.gz CUCANUDLGBIEOS-OAHLLOKOSA-N 0 0 386.427 3.402 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000194461434 1433181965 /nfs/dbraw/zinc/18/19/65/1433181965.db2.gz PXWKFVFJDKMDLK-AWEZNQCLSA-N 0 0 384.436 3.295 20 5 GGBDRN COc1ccc(COCc2cccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)c2)cc1 ZINC000194464547 1433182580 /nfs/dbraw/zinc/18/25/80/1433182580.db2.gz DKZIWNQRUWPRFD-UHFFFAOYSA-N 0 0 396.403 3.155 20 5 GGBDRN O=C(CNC(=O)NCc1cccc([N+](=O)[O-])c1)Nc1cc(Cl)ccc1Cl ZINC000194488313 1433186250 /nfs/dbraw/zinc/18/62/50/1433186250.db2.gz LVBRSGDBDHZKOP-UHFFFAOYSA-N 0 0 397.218 3.340 20 5 GGBDRN C[C@H](NC(=O)NCCc1cc(F)cc2c1OCOC2)c1cccc([N+](=O)[O-])c1 ZINC000194515596 1433190825 /nfs/dbraw/zinc/19/08/25/1433190825.db2.gz DQUGLEUCOXTOMY-LBPRGKRZSA-N 0 0 389.383 3.203 20 5 GGBDRN C[C@@H](NC(=O)NCCc1cc(F)cc2c1OCOC2)c1cccc([N+](=O)[O-])c1 ZINC000194515613 1433190885 /nfs/dbraw/zinc/19/08/85/1433190885.db2.gz DQUGLEUCOXTOMY-GFCCVEGCSA-N 0 0 389.383 3.203 20 5 GGBDRN O=C([C@@H]1CCCc2cccnc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000194522918 1433191662 /nfs/dbraw/zinc/19/16/62/1433191662.db2.gz NPWSBQUEIJFKOY-LJQANCHMSA-N 0 0 381.432 3.480 20 5 GGBDRN CCc1cccc2c(C3CCN(C(=O)Cn4cc([N+](=O)[O-])cn4)CC3)c[nH]c21 ZINC000194523627 1433191937 /nfs/dbraw/zinc/19/19/37/1433191937.db2.gz LVAYXJJLOXHRPA-UHFFFAOYSA-N 0 0 381.436 3.241 20 5 GGBDRN COc1cccc(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)c1[N+](=O)[O-] ZINC000194527690 1433192576 /nfs/dbraw/zinc/19/25/76/1433192576.db2.gz PJEBQVIYDQVEQS-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1C(=O)NCc1ccco1 ZINC000194527335 1433192649 /nfs/dbraw/zinc/19/26/49/1433192649.db2.gz ZNYHTWLJSZUBFG-UHFFFAOYSA-N 0 0 395.371 3.379 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000194528641 1433192994 /nfs/dbraw/zinc/19/29/94/1433192994.db2.gz LOPTWYUYUWDZFS-UHFFFAOYSA-N 0 0 398.463 3.377 20 5 GGBDRN COc1cccc(N2CCN(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000194552667 1433196126 /nfs/dbraw/zinc/19/61/26/1433196126.db2.gz HRSIMFNQUVTPNA-OAHLLOKOSA-N 0 0 384.436 3.196 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC000194550493 1433196131 /nfs/dbraw/zinc/19/61/31/1433196131.db2.gz NLNRMIQROBIZCX-UHFFFAOYSA-N 0 0 393.403 3.368 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000194558470 1433197307 /nfs/dbraw/zinc/19/73/07/1433197307.db2.gz NCBKFOXLEMOXFO-INIZCTEOSA-N 0 0 396.447 3.132 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)c(C)o1 ZINC000194563141 1433197919 /nfs/dbraw/zinc/19/79/19/1433197919.db2.gz HNEOVNVHQGYQEH-UHFFFAOYSA-N 0 0 385.420 3.148 20 5 GGBDRN COc1cc(CCNC(=O)c2cc3ccccc3nc2C)c([N+](=O)[O-])cc1OC ZINC000194569665 1433199057 /nfs/dbraw/zinc/19/90/57/1433199057.db2.gz CZAJFHLTUAPRRN-UHFFFAOYSA-N 0 0 395.415 3.441 20 5 GGBDRN C[C@H](Sc1n[nH]c(Cc2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194592414 1433202820 /nfs/dbraw/zinc/20/28/20/1433202820.db2.gz NDQPSLFEXIYOQB-LBPRGKRZSA-N 0 0 383.433 3.423 20 5 GGBDRN CC(=O)Nc1nc2ccc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)cc2s1 ZINC000194596296 1433203382 /nfs/dbraw/zinc/20/33/82/1433203382.db2.gz ZWYIGDKQZJJUAG-UHFFFAOYSA-N 0 0 396.388 3.292 20 5 GGBDRN C[C@H](Sc1n[nH]c(Cc2ccccc2)n1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000194601230 1433203948 /nfs/dbraw/zinc/20/39/48/1433203948.db2.gz YIPFVMPZRZHXBS-LBPRGKRZSA-N 0 0 383.433 3.423 20 5 GGBDRN COc1cccc(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c1[N+](=O)[O-] ZINC000194613000 1433205557 /nfs/dbraw/zinc/20/55/57/1433205557.db2.gz YRHUUGUDSVIRLI-GFCCVEGCSA-N 0 0 382.376 3.068 20 5 GGBDRN COc1cccc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000194615420 1433205852 /nfs/dbraw/zinc/20/58/52/1433205852.db2.gz FGPDGAICVLARAX-QGZVFWFLSA-N 0 0 384.432 3.467 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000194625125 1433207040 /nfs/dbraw/zinc/20/70/40/1433207040.db2.gz ZBRUHHKCGKYWAC-UHFFFAOYSA-N 0 0 383.694 3.110 20 5 GGBDRN O=C(c1ccc(F)cc1Cl)N1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000194625793 1433207238 /nfs/dbraw/zinc/20/72/38/1433207238.db2.gz GBGUMMWNXURIMC-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2ccccc2OC)c1C ZINC000194635542 1433208804 /nfs/dbraw/zinc/20/88/04/1433208804.db2.gz CCXFHTCAXXQJPU-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN COc1ccc(NC(=O)c2cnn(-c3ccccc3OC)c2C)c([N+](=O)[O-])c1 ZINC000194635565 1433208919 /nfs/dbraw/zinc/20/89/19/1433208919.db2.gz TYVGDONZJPDBOU-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN Cc1ccnc(NC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)n1 ZINC000194663238 1433212446 /nfs/dbraw/zinc/21/24/46/1433212446.db2.gz BEYRULNFXBMUDI-UHFFFAOYSA-N 0 0 393.190 3.438 20 5 GGBDRN O=C(NCc1ccc(=O)[nH]c1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194669449 1433213127 /nfs/dbraw/zinc/21/31/27/1433213127.db2.gz CQMXNWRUHXALKA-UHFFFAOYSA-N 0 0 379.372 3.204 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1C(=O)N(C)C(C)C ZINC000194669888 1433213595 /nfs/dbraw/zinc/21/35/95/1433213595.db2.gz IPZVHWDHTXTFOR-UHFFFAOYSA-N 0 0 391.449 3.184 20 5 GGBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(C)c(NC(C)=O)c1 ZINC000194674115 1433214172 /nfs/dbraw/zinc/21/41/72/1433214172.db2.gz XQZZBWWAXUUCRA-UHFFFAOYSA-N 0 0 391.449 3.467 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccc3cnn(CC)c3c2)cc([N+](=O)[O-])c1 ZINC000194678993 1433214688 /nfs/dbraw/zinc/21/46/88/1433214688.db2.gz ZIGOFYDCBNDILW-UHFFFAOYSA-N 0 0 382.376 3.393 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000194679403 1433214717 /nfs/dbraw/zinc/21/47/17/1433214717.db2.gz TUHUAQZESUBYQC-INIZCTEOSA-N 0 0 387.823 3.434 20 5 GGBDRN O=C(NC[C@H]1CCCC[C@@H]1O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194682878 1433214921 /nfs/dbraw/zinc/21/49/21/1433214921.db2.gz FMUSIMJYAPMHQT-UZLBHIALSA-N 0 0 384.432 3.455 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000194681428 1433214946 /nfs/dbraw/zinc/21/49/46/1433214946.db2.gz BMRMIQQBPZOWIY-RYUDHWBXSA-N 0 0 375.812 3.244 20 5 GGBDRN O=C(NC[C@H]1CCC[C@@H](O)C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194684460 1433215186 /nfs/dbraw/zinc/21/51/86/1433215186.db2.gz OACMTYPNKUWNAI-DLBZAZTESA-N 0 0 384.432 3.455 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(N)=O)c(N2CCCCC2)c1 ZINC000194706345 1433218000 /nfs/dbraw/zinc/21/80/00/1433218000.db2.gz QDGBNWRPRKIPIV-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN COc1ccccc1-c1noc(-c2cccc([N+](=O)[O-])c2N2CCOCC2)n1 ZINC000194707665 1433218002 /nfs/dbraw/zinc/21/80/02/1433218002.db2.gz KYOFTOYQFRKJNO-UHFFFAOYSA-N 0 0 382.376 3.157 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c([N+](=O)[O-])c1 ZINC000194716416 1433219087 /nfs/dbraw/zinc/21/90/87/1433219087.db2.gz KXDDOLGIAKWXTF-UHFFFAOYSA-N 0 0 389.383 3.212 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)NC1(c2ccc(F)cc2F)CCC1 ZINC000194721114 1433219633 /nfs/dbraw/zinc/21/96/33/1433219633.db2.gz XQTKRWDOAHWIPH-UHFFFAOYSA-N 0 0 375.331 3.007 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN(c2ccccc2Cl)C1=O ZINC000194754254 1433225328 /nfs/dbraw/zinc/22/53/28/1433225328.db2.gz NCHMFRLXRZOTNA-AWEZNQCLSA-N 0 0 387.823 3.482 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC1(Cc2cccc(F)c2)CCC1 ZINC000194761482 1433226137 /nfs/dbraw/zinc/22/61/37/1433226137.db2.gz JKNXUDORVAFFEE-UHFFFAOYSA-N 0 0 385.395 3.262 20 5 GGBDRN CCOC(=O)N1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000194773439 1433229206 /nfs/dbraw/zinc/22/92/06/1433229206.db2.gz MDEMDBIYMZXDMV-UHFFFAOYSA-N 0 0 377.441 3.197 20 5 GGBDRN CCOC(=O)N1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000194776247 1433229441 /nfs/dbraw/zinc/22/94/41/1433229441.db2.gz WEJJLLJDKGDNPO-UHFFFAOYSA-N 0 0 377.422 3.114 20 5 GGBDRN CCn1ncc2ccc(NC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc21 ZINC000194778308 1433230014 /nfs/dbraw/zinc/23/00/14/1433230014.db2.gz FCHSDHYZHAUMEL-UHFFFAOYSA-N 0 0 394.435 3.319 20 5 GGBDRN O=C(Nc1nc2c(s1)CCCC2)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000194794506 1433234143 /nfs/dbraw/zinc/23/41/43/1433234143.db2.gz JFHCEUVMOLWPJG-UHFFFAOYSA-N 0 0 387.465 3.284 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000194802425 1433235688 /nfs/dbraw/zinc/23/56/88/1433235688.db2.gz GXKKPOMFXCPBQT-MRXNPFEDSA-N 0 0 381.432 3.185 20 5 GGBDRN O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000194811009 1433237745 /nfs/dbraw/zinc/23/77/45/1433237745.db2.gz SUBZKOHJBBOABY-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN COc1cccc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000194827797 1433242244 /nfs/dbraw/zinc/24/22/44/1433242244.db2.gz GWNMHCPZBJZWJZ-WMLDXEAASA-N 0 0 378.331 3.142 20 5 GGBDRN COc1cccc(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000194827783 1433242308 /nfs/dbraw/zinc/24/23/08/1433242308.db2.gz GWNMHCPZBJZWJZ-RHSMWYFYSA-N 0 0 378.331 3.142 20 5 GGBDRN CCOc1ccc([C@H](C)NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OCC ZINC000194829632 1433243186 /nfs/dbraw/zinc/24/31/86/1433243186.db2.gz NVIBJJMUTDCFGN-ZDUSSCGKSA-N 0 0 387.436 3.342 20 5 GGBDRN COc1cccc(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000194836429 1433244745 /nfs/dbraw/zinc/24/47/45/1433244745.db2.gz DFLWXRFYNFTNMQ-NSHDSACASA-N 0 0 393.802 3.405 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cnn1C1CCCC1 ZINC000194841361 1433246114 /nfs/dbraw/zinc/24/61/14/1433246114.db2.gz DYYIVAQCSVFEIT-UHFFFAOYSA-N 0 0 391.815 3.445 20 5 GGBDRN COc1cccc(C2CCN(Cn3c4cc([N+](=O)[O-])ccc4oc3=O)CC2)c1 ZINC000194842307 1433246232 /nfs/dbraw/zinc/24/62/32/1433246232.db2.gz FZDFYARCRIHGCL-UHFFFAOYSA-N 0 0 383.404 3.348 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000194849445 1433248595 /nfs/dbraw/zinc/24/85/95/1433248595.db2.gz CZYHBLJEELHTGK-CYBMUJFWSA-N 0 0 398.337 3.092 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000194862555 1433251269 /nfs/dbraw/zinc/25/12/69/1433251269.db2.gz SJMPLOBKTWKARB-UHFFFAOYSA-N 0 0 397.746 3.333 20 5 GGBDRN CN(CC(=O)OC(C)(C)C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194871645 1433253155 /nfs/dbraw/zinc/25/31/55/1433253155.db2.gz MXBDPAPJIWUCCK-UHFFFAOYSA-N 0 0 377.422 3.132 20 5 GGBDRN COc1cccc(C2CCN(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)CC2)c1 ZINC000194878570 1433254894 /nfs/dbraw/zinc/25/48/94/1433254894.db2.gz FRQKFNWEDYFEOT-UHFFFAOYSA-N 0 0 395.459 3.372 20 5 GGBDRN Cc1cc(=O)oc2cc(NC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)ccc12 ZINC000194881436 1433255643 /nfs/dbraw/zinc/25/56/43/1433255643.db2.gz NMOOUGUQCYJDDM-UHFFFAOYSA-N 0 0 390.355 3.448 20 5 GGBDRN O=C(N[C@H]1CCC[C@H]1CCO)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194882727 1433255938 /nfs/dbraw/zinc/25/59/38/1433255938.db2.gz JSMJVJPLYJGTRW-LPHOPBHVSA-N 0 0 384.432 3.455 20 5 GGBDRN O=C(N[C@H]1CCC[C@@H]1CCO)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194882699 1433256079 /nfs/dbraw/zinc/25/60/79/1433256079.db2.gz JSMJVJPLYJGTRW-APWZRJJASA-N 0 0 384.432 3.455 20 5 GGBDRN COc1cccc(C(=O)N2CCN([C@H](C)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000194883377 1433256478 /nfs/dbraw/zinc/25/64/78/1433256478.db2.gz UPPOGKLKMOFIPK-CYBMUJFWSA-N 0 0 375.450 3.184 20 5 GGBDRN COc1cccc(C2CCN(CC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])CC2)c1 ZINC000194883594 1433256617 /nfs/dbraw/zinc/25/66/17/1433256617.db2.gz OKURRYCNDDWDJL-UHFFFAOYSA-N 0 0 399.447 3.430 20 5 GGBDRN COc1cccc(-c2nc(-c3cccc(CN4CCOCC4)c3)no2)c1[N+](=O)[O-] ZINC000194889390 1433257784 /nfs/dbraw/zinc/25/77/84/1433257784.db2.gz DCWOVSGRHQXVEE-UHFFFAOYSA-N 0 0 396.403 3.153 20 5 GGBDRN CC(C)N(CC1CCC1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194891302 1433258483 /nfs/dbraw/zinc/25/84/83/1433258483.db2.gz MGOTTYOSCZNAKX-UHFFFAOYSA-N 0 0 385.367 3.172 20 5 GGBDRN COc1cccc(C2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000194896043 1433259388 /nfs/dbraw/zinc/25/93/88/1433259388.db2.gz RTBMFXWLANFOSD-UHFFFAOYSA-N 0 0 376.434 3.172 20 5 GGBDRN COc1cccc(C2CCN(S(=O)(=O)c3c(C)cccc3[N+](=O)[O-])CC2)c1 ZINC000194895436 1433259445 /nfs/dbraw/zinc/25/94/45/1433259445.db2.gz HUHUOFMAJHNQGH-UHFFFAOYSA-N 0 0 390.461 3.480 20 5 GGBDRN COc1cc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)ccc1Cl ZINC000194896580 1433259828 /nfs/dbraw/zinc/25/98/28/1433259828.db2.gz BBAPYUDRUYTYHG-UHFFFAOYSA-N 0 0 387.783 3.398 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1 ZINC000194900784 1433260666 /nfs/dbraw/zinc/26/06/66/1433260666.db2.gz NLTZZXZRRVOFHD-UHFFFAOYSA-N 0 0 381.310 3.448 20 5 GGBDRN C[C@H](Nc1cc(F)cc(N2CCOCC2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194902263 1433260879 /nfs/dbraw/zinc/26/08/79/1433260879.db2.gz QVCDNQVABZSPBQ-ZDUSSCGKSA-N 0 0 388.399 3.010 20 5 GGBDRN C[C@@H](Nc1cc(F)cc(N2CCOCC2)c1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000194901302 1433260933 /nfs/dbraw/zinc/26/09/33/1433260933.db2.gz FIUXBJLTHPHPRT-CYBMUJFWSA-N 0 0 388.399 3.010 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)cn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000194917037 1433264032 /nfs/dbraw/zinc/26/40/32/1433264032.db2.gz MBLDMZUTDKECRI-UHFFFAOYSA-N 0 0 397.435 3.023 20 5 GGBDRN COc1cc(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000194922773 1433265087 /nfs/dbraw/zinc/26/50/87/1433265087.db2.gz GVFGDONKXDWLRP-UHFFFAOYSA-N 0 0 386.379 3.478 20 5 GGBDRN CCCCCCNC(=O)[C@H]1CCCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000194924298 1433265377 /nfs/dbraw/zinc/26/53/77/1433265377.db2.gz RXWLXTAKOAWIFC-KRWDZBQOSA-N 0 0 390.484 3.213 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn(Cc2ccccn2)c1 ZINC000194934436 1433267834 /nfs/dbraw/zinc/26/78/34/1433267834.db2.gz DAEWWUDBHPHBGY-CYBMUJFWSA-N 0 0 383.433 3.354 20 5 GGBDRN CSc1ccc(C(=O)NCc2ccccc2N2CCOCC2)cc1[N+](=O)[O-] ZINC000194935812 1433268165 /nfs/dbraw/zinc/26/81/65/1433268165.db2.gz WRRIUVCUEVFXKS-UHFFFAOYSA-N 0 0 387.461 3.083 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H](c1ccccc1)N1CCSCC1 ZINC000194939017 1433268684 /nfs/dbraw/zinc/26/86/84/1433268684.db2.gz REDYLZGGESGFQF-LJQANCHMSA-N 0 0 385.489 3.343 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000194939354 1433268889 /nfs/dbraw/zinc/26/88/89/1433268889.db2.gz KGZUWDDKQCVFQT-UHFFFAOYSA-N 0 0 388.399 3.145 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000194943358 1433269510 /nfs/dbraw/zinc/26/95/10/1433269510.db2.gz BUVZKEYLDWFPCU-CQSZACIVSA-N 0 0 394.836 3.157 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C1CCN(C(=O)OCc2ccccc2)CC1 ZINC000194953605 1433271694 /nfs/dbraw/zinc/27/16/94/1433271694.db2.gz XIYYEFOCBPIUMN-UHFFFAOYSA-N 0 0 397.431 3.260 20 5 GGBDRN Cc1c(C(=O)OCc2ncc(C)c([N+](=O)[O-])c2C)nnn1Cc1ccc(F)cc1 ZINC000194955416 1433271941 /nfs/dbraw/zinc/27/19/41/1433271941.db2.gz IBUQGENRQGWUBG-UHFFFAOYSA-N 0 0 399.382 3.051 20 5 GGBDRN CC[C@H](C)N(Cc1ccccc1)C(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000194968789 1433274436 /nfs/dbraw/zinc/27/44/36/1433274436.db2.gz XCQRURKMIZEJOS-HNNXBMFYSA-N 0 0 399.447 3.161 20 5 GGBDRN O=C(Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000194971324 1433274790 /nfs/dbraw/zinc/27/47/90/1433274790.db2.gz NNHUBMXSBWGIKJ-INIZCTEOSA-N 0 0 392.375 3.451 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(C(=O)c2ccccc2F)CC1 ZINC000195013371 1433280638 /nfs/dbraw/zinc/28/06/38/1433280638.db2.gz ABQHNKMZNQFEFO-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C ZINC000195018448 1433281341 /nfs/dbraw/zinc/28/13/41/1433281341.db2.gz RSPYSYYGVXRZQR-INIZCTEOSA-N 0 0 377.441 3.343 20 5 GGBDRN O=C(NCc1nccn1C(F)F)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000195028369 1433282719 /nfs/dbraw/zinc/28/27/19/1433282719.db2.gz IQXCGSUDDVVVGI-UHFFFAOYSA-N 0 0 379.367 3.107 20 5 GGBDRN C[C@@H](c1ccco1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000195026351 1433282847 /nfs/dbraw/zinc/28/28/47/1433282847.db2.gz IJIPQJZGQJXVSB-VIFPVBQESA-N 0 0 389.227 3.332 20 5 GGBDRN C[C@H]1CCc2c(sc3nc(Cn4cc([N+](=O)[O-])c(C5CC5)n4)nc(N)c23)C1 ZINC000195039675 1433284240 /nfs/dbraw/zinc/28/42/40/1433284240.db2.gz SZBDHSQUTLFUHK-VIFPVBQESA-N 0 0 384.465 3.429 20 5 GGBDRN COc1cccc(C2CCN(C(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000195056471 1433286269 /nfs/dbraw/zinc/28/62/69/1433286269.db2.gz FVMAYBKQRMFEIT-UHFFFAOYSA-N 0 0 397.431 3.257 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(NCc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000195071537 1433288423 /nfs/dbraw/zinc/28/84/23/1433288423.db2.gz WNHACQARQBENSD-UHFFFAOYSA-N 0 0 385.420 3.233 20 5 GGBDRN Nc1c(C(=O)N2CCC(OCCc3ccccc3)CC2)cc(F)cc1[N+](=O)[O-] ZINC000195079404 1433289894 /nfs/dbraw/zinc/28/98/94/1433289894.db2.gz HJKXCSUBPSTNSI-UHFFFAOYSA-N 0 0 387.411 3.180 20 5 GGBDRN COC(=O)CCNC(=O)c1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000195083410 1433290629 /nfs/dbraw/zinc/29/06/29/1433290629.db2.gz GUMWKTXXWQTMFC-UHFFFAOYSA-N 0 0 391.811 3.153 20 5 GGBDRN CC[C@H](C)[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)OC ZINC000195094583 1433291733 /nfs/dbraw/zinc/29/17/33/1433291733.db2.gz CYXXMCDNRNQWSH-IINYFYTJSA-N 0 0 377.422 3.036 20 5 GGBDRN COc1cc(CCNC(=O)N2CCc3ccc(F)cc32)c([N+](=O)[O-])cc1OC ZINC000195129499 1433296761 /nfs/dbraw/zinc/29/67/61/1433296761.db2.gz NQJVGXFYORBDFM-UHFFFAOYSA-N 0 0 389.383 3.066 20 5 GGBDRN COc1ccc(CNc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000195135662 1433297412 /nfs/dbraw/zinc/29/74/12/1433297412.db2.gz RYLYVPPLOBPVOM-GASCZTMLSA-N 0 0 399.447 3.465 20 5 GGBDRN COc1ccc(CNc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000195135750 1433297816 /nfs/dbraw/zinc/29/78/16/1433297816.db2.gz RYLYVPPLOBPVOM-HUUCEWRRSA-N 0 0 399.447 3.465 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(Cc2cccc3ccccc32)CC1 ZINC000195137245 1433297841 /nfs/dbraw/zinc/29/78/41/1433297841.db2.gz FPFUYMUIJSYILO-UHFFFAOYSA-N 0 0 390.443 3.288 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(COCC(F)(F)F)cc1 ZINC000195143897 1433298896 /nfs/dbraw/zinc/29/88/96/1433298896.db2.gz SBDFSHYRRNIPKF-UHFFFAOYSA-N 0 0 383.326 3.186 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(CC(F)(F)F)CC1 ZINC000195154766 1433300464 /nfs/dbraw/zinc/30/04/64/1433300464.db2.gz VKNPWIGMJFKCPL-LLVKDONJSA-N 0 0 391.415 3.218 20 5 GGBDRN CCS(=O)(=O)C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000195159226 1433301263 /nfs/dbraw/zinc/30/12/63/1433301263.db2.gz HWZXRBRZWNRIIN-UHFFFAOYSA-N 0 0 378.450 3.254 20 5 GGBDRN COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000195169411 1433302226 /nfs/dbraw/zinc/30/22/26/1433302226.db2.gz RBTDXBJJXWAOEC-CVEARBPZSA-N 0 0 398.463 3.490 20 5 GGBDRN O=C(N[C@H]1CCCOc2ccccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000195176653 1433303273 /nfs/dbraw/zinc/30/32/73/1433303273.db2.gz SVYBCYSGINGYPV-KRWDZBQOSA-N 0 0 396.447 3.340 20 5 GGBDRN O=C(NCCCOCC(F)(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000195178014 1433303429 /nfs/dbraw/zinc/30/34/29/1433303429.db2.gz QAOIBIFLTAYSNQ-UHFFFAOYSA-N 0 0 389.355 3.417 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000195218414 1433308317 /nfs/dbraw/zinc/30/83/17/1433308317.db2.gz UECGKKIHLDRKRF-UKRRQHHQSA-N 0 0 388.468 3.001 20 5 GGBDRN COc1cc(C(=O)NCC(=O)Nc2cc(Cl)ccc2Cl)ccc1[N+](=O)[O-] ZINC000195224987 1433309258 /nfs/dbraw/zinc/30/92/58/1433309258.db2.gz PGLCFXNJQLTLRM-UHFFFAOYSA-N 0 0 398.202 3.279 20 5 GGBDRN COc1ccc(OCCNC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000195242750 1433311074 /nfs/dbraw/zinc/31/10/74/1433311074.db2.gz SABOUNWBMGCMBP-UHFFFAOYSA-N 0 0 395.209 3.175 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCCCc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000195261148 1433312933 /nfs/dbraw/zinc/31/29/33/1433312933.db2.gz NTDLCTYQMWUPBI-UHFFFAOYSA-N 0 0 375.812 3.244 20 5 GGBDRN CCn1c(CCNC(=O)NCc2cc([N+](=O)[O-])ccc2OC)nc2ccccc21 ZINC000195266663 1433313426 /nfs/dbraw/zinc/31/34/26/1433313426.db2.gz YBSCPVNWSMYMDK-UHFFFAOYSA-N 0 0 397.435 3.015 20 5 GGBDRN COc1ccc(CC[C@@H](C)NC(=O)NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000195268147 1433313607 /nfs/dbraw/zinc/31/36/07/1433313607.db2.gz FZKKXIPZVCXXHG-CQSZACIVSA-N 0 0 387.436 3.433 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1CCC(NC(=O)C2CCCC2)CC1 ZINC000195272106 1433314071 /nfs/dbraw/zinc/31/40/71/1433314071.db2.gz VCJLULXKTLPDDV-UHFFFAOYSA-N 0 0 387.480 3.418 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1cccc(OC(F)F)c1 ZINC000195282062 1433314793 /nfs/dbraw/zinc/31/47/93/1433314793.db2.gz JUZHNUIZEBYZDG-UHFFFAOYSA-N 0 0 381.335 3.204 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1nc(-c2ccc3c(c2)CCC3)cs1 ZINC000195290463 1433315703 /nfs/dbraw/zinc/31/57/03/1433315703.db2.gz QTZVLYXRYGHHQG-UHFFFAOYSA-N 0 0 383.433 3.432 20 5 GGBDRN O=C(CC1CCCC1)NC1CCC(C(=O)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000195294745 1433316239 /nfs/dbraw/zinc/31/62/39/1433316239.db2.gz WDEACHSVOXLUJL-UHFFFAOYSA-N 0 0 387.480 3.466 20 5 GGBDRN Cc1ccccc1OCCNC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000195310524 1433317874 /nfs/dbraw/zinc/31/78/74/1433317874.db2.gz LZXSMCZOAJWYEC-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC(OC2CCCC2)CC1 ZINC000195317190 1433318267 /nfs/dbraw/zinc/31/82/67/1433318267.db2.gz YVYLUNAPHKALOC-CQSZACIVSA-N 0 0 391.468 3.354 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])[NH+]1CCCC1 ZINC000195320895 1433318658 /nfs/dbraw/zinc/31/86/58/1433318658.db2.gz MRCNQFTUGWQLES-QGZVFWFLSA-N 0 0 399.447 3.179 20 5 GGBDRN Cc1c(C(=O)NCCCn2cnc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195333524 1433320006 /nfs/dbraw/zinc/32/00/06/1433320006.db2.gz BIWNLOHNJYDZIH-UHFFFAOYSA-N 0 0 397.391 3.290 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(Cc2cccc(C(F)(F)F)c2)CC1 ZINC000195336518 1433320230 /nfs/dbraw/zinc/32/02/30/1433320230.db2.gz PTWKINADGIIIRA-UHFFFAOYSA-N 0 0 397.401 3.461 20 5 GGBDRN CC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 ZINC000195342384 1433320901 /nfs/dbraw/zinc/32/09/01/1433320901.db2.gz YFVJGEACCLCVGA-UHFFFAOYSA-N 0 0 392.209 3.246 20 5 GGBDRN O=C(Nc1ccccc1-n1ccnn1)c1cc([N+](=O)[O-])ccc1Br ZINC000195342671 1433320937 /nfs/dbraw/zinc/32/09/37/1433320937.db2.gz WAZYDNURMBRUTR-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CC(C)N(C)C(=O)[C@@H]1CSCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000195374229 1433323628 /nfs/dbraw/zinc/32/36/28/1433323628.db2.gz JZQZQPYIUOZOSS-ZDUSSCGKSA-N 0 0 393.490 3.191 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](c2ccccc2)c2ccc3[nH]cnc3c2)c1[N+](=O)[O-] ZINC000195372623 1433323686 /nfs/dbraw/zinc/32/36/86/1433323686.db2.gz ZPGYTYSANPIYNO-KRWDZBQOSA-N 0 0 390.403 3.276 20 5 GGBDRN CC(C)CNC(=O)[C@H]1CSCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000195381846 1433324376 /nfs/dbraw/zinc/32/43/76/1433324376.db2.gz FZSONPDKFOBGFR-CYBMUJFWSA-N 0 0 393.490 3.097 20 5 GGBDRN CCCCNC(=O)[C@@H]1CSCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000195384841 1433324627 /nfs/dbraw/zinc/32/46/27/1433324627.db2.gz NITUYWPPXWSOJT-ZDUSSCGKSA-N 0 0 393.490 3.241 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC(OC2CCCC2)CC1 ZINC000195401958 1433325714 /nfs/dbraw/zinc/32/57/14/1433325714.db2.gz YSVQBZLWZCLOLA-UHFFFAOYSA-N 0 0 384.436 3.344 20 5 GGBDRN CSc1ccc(C(=O)Nc2ccn(CCc3ccncc3)n2)cc1[N+](=O)[O-] ZINC000195409294 1433326436 /nfs/dbraw/zinc/32/64/36/1433326436.db2.gz OOIPRWXHESNKCS-UHFFFAOYSA-N 0 0 383.433 3.403 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1ccc(Oc2ccccc2)nc1 ZINC000195412579 1433327005 /nfs/dbraw/zinc/32/70/05/1433327005.db2.gz FZSWKHBSZNGBAI-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc2c(c1)CCCO2 ZINC000195417123 1433327481 /nfs/dbraw/zinc/32/74/81/1433327481.db2.gz UZYZOJBQYPNZBQ-UHFFFAOYSA-N 0 0 397.387 3.247 20 5 GGBDRN COc1cc(CNCc2c(C)noc2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000195422572 1433328061 /nfs/dbraw/zinc/32/80/61/1433328061.db2.gz GEGXUCMXPJLXLV-UHFFFAOYSA-N 0 0 389.330 3.439 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2cccc(C(F)F)c2)c([N+](=O)[O-])c1 ZINC000195427356 1433328663 /nfs/dbraw/zinc/32/86/63/1433328663.db2.gz WSQFYAXAFFWEKF-UHFFFAOYSA-N 0 0 381.360 3.362 20 5 GGBDRN COc1cccc(C(=O)NCc2ccc(N3CCCCCC3)nc2)c1[N+](=O)[O-] ZINC000195430258 1433328843 /nfs/dbraw/zinc/32/88/43/1433328843.db2.gz GPTFTWPMHGBRPT-UHFFFAOYSA-N 0 0 384.436 3.309 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(C(=O)NCC(C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000195439152 1433329512 /nfs/dbraw/zinc/32/95/12/1433329512.db2.gz AXSFUACNKPOQTJ-UHFFFAOYSA-N 0 0 393.831 3.172 20 5 GGBDRN COc1cccc(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000195438487 1433329532 /nfs/dbraw/zinc/32/95/32/1433329532.db2.gz NRSGCFSMJYHWKD-UHFFFAOYSA-N 0 0 391.811 3.406 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000195439884 1433329855 /nfs/dbraw/zinc/32/98/55/1433329855.db2.gz CQCBMQOZQFVGDY-MRXNPFEDSA-N 0 0 376.796 3.471 20 5 GGBDRN CSc1ccc(C(=O)N(CC[NH+](C)C)Cc2ccc(C)o2)cc1[N+](=O)[O-] ZINC000195447938 1433330949 /nfs/dbraw/zinc/33/09/49/1433330949.db2.gz IDDSZXZHWFGZNA-UHFFFAOYSA-N 0 0 377.466 3.422 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1ccc2cnn(C(C)C)c2c1 ZINC000195448612 1433330974 /nfs/dbraw/zinc/33/09/74/1433330974.db2.gz MBEYJRDRLQGDKQ-UHFFFAOYSA-N 0 0 390.421 3.335 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)cc1 ZINC000195450540 1433331303 /nfs/dbraw/zinc/33/13/03/1433331303.db2.gz VLMZZDFJCRTRJS-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000195461018 1433332763 /nfs/dbraw/zinc/33/27/63/1433332763.db2.gz ZIXPFIRZICQPBP-UONOGXRCSA-N 0 0 395.887 3.491 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000195461005 1433332817 /nfs/dbraw/zinc/33/28/17/1433332817.db2.gz ZIXPFIRZICQPBP-KGLIPLIRSA-N 0 0 395.887 3.491 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000195467083 1433333544 /nfs/dbraw/zinc/33/35/44/1433333544.db2.gz ZUZYODOKWHRCBS-HNNXBMFYSA-N 0 0 375.812 3.465 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000195467462 1433333567 /nfs/dbraw/zinc/33/35/67/1433333567.db2.gz APGCUDCZZAZQEK-HNNXBMFYSA-N 0 0 375.812 3.465 20 5 GGBDRN O=C(Nc1cnn(Cc2ccncc2)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000195473869 1433334406 /nfs/dbraw/zinc/33/44/06/1433334406.db2.gz XYZBAIOAHUZTHH-UHFFFAOYSA-N 0 0 392.419 3.087 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC(OC3CCCC3)CC2)c1C ZINC000195481161 1433335161 /nfs/dbraw/zinc/33/51/61/1433335161.db2.gz LLQCQPUYDVLHDP-UHFFFAOYSA-N 0 0 382.482 3.324 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(OC2CCCC2)CC1 ZINC000195480826 1433335240 /nfs/dbraw/zinc/33/52/40/1433335240.db2.gz SSAFUAHXHQXBRN-UHFFFAOYSA-N 0 0 382.482 3.270 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1OC1CCCC1 ZINC000195482184 1433335333 /nfs/dbraw/zinc/33/53/33/1433335333.db2.gz VGNHXVHWSIFUCQ-UHFFFAOYSA-N 0 0 383.404 3.171 20 5 GGBDRN CCOc1ccc(-c2nc(Cn3cccc([N+](=O)[O-])c3=O)cs2)cc1OC ZINC000195524340 1433338073 /nfs/dbraw/zinc/33/80/73/1433338073.db2.gz PMDZUYDNGYHGBG-UHFFFAOYSA-N 0 0 387.417 3.336 20 5 GGBDRN O=C(Nc1ccccc1)C1CCN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])CC1 ZINC000195525281 1433338305 /nfs/dbraw/zinc/33/83/05/1433338305.db2.gz FZCDLKCBZSSYFJ-UHFFFAOYSA-N 0 0 389.358 3.364 20 5 GGBDRN Cc1cccc(CN2CCN(C(=O)c3cc(F)c(F)cc3[N+](=O)[O-])CC2)c1 ZINC000195526780 1433338580 /nfs/dbraw/zinc/33/85/80/1433338580.db2.gz GEZJTJDFPGQUMX-UHFFFAOYSA-N 0 0 375.375 3.139 20 5 GGBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000195526775 1433338633 /nfs/dbraw/zinc/33/86/33/1433338633.db2.gz DWQNEPWDTLKBOT-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN CCC(CC)N1C[C@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)CC1=O ZINC000195638587 1433342703 /nfs/dbraw/zinc/34/27/03/1433342703.db2.gz JQXOLDYWXPUHSB-MRXNPFEDSA-N 0 0 375.469 3.369 20 5 GGBDRN CC(C)Oc1ncccc1NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000195652268 1433343182 /nfs/dbraw/zinc/34/31/82/1433343182.db2.gz KPAIMZAMQDHAAX-UHFFFAOYSA-N 0 0 385.424 3.131 20 5 GGBDRN Cc1cc(=O)c(C(=O)NC[C@@H]2CCCC[C@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000195657185 1433343545 /nfs/dbraw/zinc/34/35/45/1433343545.db2.gz GZLDOJXZFHFVIA-HIFRSBDPSA-N 0 0 384.436 3.005 20 5 GGBDRN Cc1cc(NC(=O)NCC2(N3CCOCC3)CCCCC2)ccc1[N+](=O)[O-] ZINC000195660875 1433343981 /nfs/dbraw/zinc/34/39/81/1433343981.db2.gz OPAYFDNKMJIJCD-UHFFFAOYSA-N 0 0 376.457 3.060 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C(=O)c2ccc(OC)cc2)CC1 ZINC000195684500 1433344405 /nfs/dbraw/zinc/34/44/05/1433344405.db2.gz ACHHASYEBLDKQH-UHFFFAOYSA-N 0 0 397.431 3.062 20 5 GGBDRN O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000195704626 1433344953 /nfs/dbraw/zinc/34/49/53/1433344953.db2.gz RHDBPGNLYRUUHK-CYBMUJFWSA-N 0 0 381.413 3.345 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@H](C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000195731142 1433345875 /nfs/dbraw/zinc/34/58/75/1433345875.db2.gz ICJTWRQTBFJTQF-GFCCVEGCSA-N 0 0 391.474 3.422 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)Cc1nc2ccccc2s1 ZINC000195731186 1433346124 /nfs/dbraw/zinc/34/61/24/1433346124.db2.gz OGAFZONZOHCRGJ-GFCCVEGCSA-N 0 0 391.474 3.422 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N2CCCc3ccccc32)cc1OC ZINC000198122703 1433347369 /nfs/dbraw/zinc/34/73/69/1433347369.db2.gz MPNIUAFHCJQNOK-UHFFFAOYSA-N 0 0 386.404 3.222 20 5 GGBDRN CCN(C(=O)c1cc(OC)c(OCCOC)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000198127116 1433347619 /nfs/dbraw/zinc/34/76/19/1433347619.db2.gz JZESLCXKBILGRT-UHFFFAOYSA-N 0 0 392.383 3.434 20 5 GGBDRN Cc1c(C(=O)NCCc2cc(Cl)c3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000198131018 1433347647 /nfs/dbraw/zinc/34/76/47/1433347647.db2.gz DTHIZXWBYZZOIN-UHFFFAOYSA-N 0 0 376.796 3.300 20 5 GGBDRN Cc1cccc(C(=O)NCCc2cc(Cl)c3c(c2)OCCO3)c1[N+](=O)[O-] ZINC000198131293 1433347672 /nfs/dbraw/zinc/34/76/72/1433347672.db2.gz UFPPBKXZPVEHQG-UHFFFAOYSA-N 0 0 376.796 3.300 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2c(F)cccc2F)cc1OC ZINC000198124203 1433347705 /nfs/dbraw/zinc/34/77/05/1433347705.db2.gz PFJZOMDWYLMWSE-UHFFFAOYSA-N 0 0 382.319 3.159 20 5 GGBDRN NC(=O)c1ccccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000198334515 1433349460 /nfs/dbraw/zinc/34/94/60/1433349460.db2.gz CAMNTDVEZOTQLE-UHFFFAOYSA-N 0 0 396.325 3.153 20 5 GGBDRN COc1cccc([C@@H]2CCCN2C(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000198629709 1433350603 /nfs/dbraw/zinc/35/06/03/1433350603.db2.gz HCACFBZKAMJOTQ-LIRRHRJNSA-N 0 0 397.431 3.085 20 5 GGBDRN Cn1ccnc1[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000198975940 1433352512 /nfs/dbraw/zinc/35/25/12/1433352512.db2.gz XRESLKNNLYPYOI-IBGZPJMESA-N 0 0 379.420 3.036 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccccc1C(=O)NC[C@H]1CCCO1 ZINC000207272997 1433354425 /nfs/dbraw/zinc/35/44/25/1433354425.db2.gz KVNZEULBFVMHNW-QJWNTBNXSA-N 0 0 395.415 3.156 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@](C)(NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000210029096 1433356505 /nfs/dbraw/zinc/35/65/05/1433356505.db2.gz GXLTTYXISDRQBQ-HXKWKUIBSA-N 0 0 389.452 3.418 20 5 GGBDRN NC(=O)c1ccc(NCCOC(=O)/C=C\c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000210198864 1433356712 /nfs/dbraw/zinc/35/67/12/1433356712.db2.gz DCBQOFVYVWUCKM-BAQGIRSFSA-N 0 0 389.795 3.016 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000210211405 1433356762 /nfs/dbraw/zinc/35/67/62/1433356762.db2.gz GJRRMBLREZIYTI-IEODJVTJSA-N 0 0 397.456 3.457 20 5 GGBDRN O=C(/C=C\c1ccco1)OCC(=O)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000211535259 1433357630 /nfs/dbraw/zinc/35/76/30/1433357630.db2.gz LCSWHSKEMKUIGI-XQRVVYSFSA-N 0 0 384.266 3.402 20 5 GGBDRN CCC(=O)Nc1ccc(C(=O)COC(=O)C=Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000211544033 1433357633 /nfs/dbraw/zinc/35/76/33/1433357633.db2.gz DYJNMOWTYXHRRP-XGICHPGQSA-N 0 0 382.372 3.383 20 5 GGBDRN CSc1ccccc1NC(=O)CN(C)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000211663164 1433357790 /nfs/dbraw/zinc/35/77/90/1433357790.db2.gz LNMHUGIFFLFJJB-XFXZXTDPSA-N 0 0 385.445 3.427 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C(=O)OCc1ccccc1 ZINC000212717265 1433358744 /nfs/dbraw/zinc/35/87/44/1433358744.db2.gz HAXWOQQMEUCPQS-QTJNJRLBSA-N 0 0 380.400 3.342 20 5 GGBDRN CC[C@@H](C)[C@@H](C(=O)OCc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O ZINC000212767996 1433358799 /nfs/dbraw/zinc/35/87/99/1433358799.db2.gz KCTQHUMAYIHEQB-ACJLOTCBSA-N 0 0 396.399 3.349 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)/C=C\Sc2ccccc2)c([N+](=O)[O-])c1 ZINC000214968847 1433361299 /nfs/dbraw/zinc/36/12/99/1433361299.db2.gz PRGSUDFMWVCFOO-KTKRTIGZSA-N 0 0 388.401 3.391 20 5 GGBDRN CCN(C(C)=O)c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 ZINC000214895205 1433361462 /nfs/dbraw/zinc/36/14/62/1433361462.db2.gz XGZDDKSGUZFISY-TWGQIWQCSA-N 0 0 375.406 3.181 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCC(=O)NCCc1ccc(Cl)cc1 ZINC000215230480 1433361660 /nfs/dbraw/zinc/36/16/60/1433361660.db2.gz DNBHLJPZJYDCCY-YHYXMXQVSA-N 0 0 388.807 3.164 20 5 GGBDRN O=C(/C=C\c1ccc2c(c1)OCO2)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000216024322 1433362638 /nfs/dbraw/zinc/36/26/38/1433362638.db2.gz HAFXXDFTGCEXCA-WAPJZHGLSA-N 0 0 395.327 3.130 20 5 GGBDRN CCOC(=O)N1CCCN(c2cc(CC)nc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000216485861 1433363896 /nfs/dbraw/zinc/36/38/96/1433363896.db2.gz UWGBHKPYVZZABV-UHFFFAOYSA-N 0 0 399.451 3.283 20 5 GGBDRN CN1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000216733161 1433364064 /nfs/dbraw/zinc/36/40/64/1433364064.db2.gz NGCXKWFDHFMRIU-GOSISDBHSA-N 0 0 388.855 3.175 20 5 GGBDRN CNS(=O)(=O)c1ccc(N2CCC[C@@H]2/C=C\c2ccccc2)c([N+](=O)[O-])c1 ZINC000222235138 1433366307 /nfs/dbraw/zinc/36/63/07/1433366307.db2.gz YJYKPJRSEOENSP-ZBTGYSDGSA-N 0 0 387.461 3.185 20 5 GGBDRN COc1cc(C(=O)NC[C@H]2CCC(F)(F)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000225481367 1433367133 /nfs/dbraw/zinc/36/71/33/1433367133.db2.gz KSWAPXXCWVXGNN-QMMMGPOBSA-N 0 0 380.294 3.370 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)cc1OC ZINC000228705680 1433371337 /nfs/dbraw/zinc/37/13/37/1433371337.db2.gz VDJFWVZVAUCHIN-VNHYZAJKSA-N 0 0 380.441 3.183 20 5 GGBDRN C[C@H]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000230669735 1433372879 /nfs/dbraw/zinc/37/28/79/1433372879.db2.gz PCYRKCGIGBFJOF-VHSXEESVSA-N 0 0 388.205 3.365 20 5 GGBDRN C[C@@H]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2I)C1 ZINC000230415480 1433372927 /nfs/dbraw/zinc/37/29/27/1433372927.db2.gz JXVCJHPJBUNNQB-ZJUUUORDSA-N 0 0 388.205 3.365 20 5 GGBDRN C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000237389812 1433400122 /nfs/dbraw/zinc/40/01/22/1433400122.db2.gz WBPLZQPKYRLNIO-PMGBHYCQSA-N 0 0 389.477 3.209 20 5 GGBDRN O=[N+]([O-])c1cc(CNCc2ccccc2S(=O)(=O)N2CCCCC2)cs1 ZINC000237975890 1433437736 /nfs/dbraw/zinc/43/77/36/1433437736.db2.gz NNELHDJFDSRFLH-UHFFFAOYSA-N 0 0 395.506 3.121 20 5 GGBDRN Cc1cc(F)c(S(=O)(=O)N(C)c2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000242197016 1433446462 /nfs/dbraw/zinc/44/64/62/1433446462.db2.gz XHAIEHIEUJJYIT-UHFFFAOYSA-N 0 0 375.381 3.416 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](c2ccccc2)OC[C@H]1C ZINC000245406142 1433461772 /nfs/dbraw/zinc/46/17/72/1433461772.db2.gz WDRNUBJSNODIPO-CXAGYDPISA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000245406295 1433461780 /nfs/dbraw/zinc/46/17/80/1433461780.db2.gz WUGMHIJXYVRGHK-KZULUSFZSA-N 0 0 391.374 3.274 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)c1[N+](=O)[O-] ZINC000245414132 1433463137 /nfs/dbraw/zinc/46/31/37/1433463137.db2.gz CSDWPXFMMCUCFP-BIXPNRAVSA-N 0 0 391.449 3.101 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000245419809 1433464078 /nfs/dbraw/zinc/46/40/78/1433464078.db2.gz MHFYGIZARJEFLJ-YMXBGEKHSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000245424316 1433465136 /nfs/dbraw/zinc/46/51/36/1433465136.db2.gz RWHYXJXBRVEMJL-ZJWNCGCPSA-N 0 0 396.490 3.022 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000245446739 1433469595 /nfs/dbraw/zinc/46/95/95/1433469595.db2.gz LKIULMLCSMWIDS-JXFKEZNVSA-N 0 0 383.448 3.328 20 5 GGBDRN COc1ccc(NC(=O)CN2C[C@@H](c3ccccc3C)OC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000245452139 1433470568 /nfs/dbraw/zinc/47/05/68/1433470568.db2.gz QCIRDLYMDATQJT-YWZLYKJASA-N 0 0 399.447 3.312 20 5 GGBDRN CCOc1ccc(NC(=O)CN2C[C@@H](C)OC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000245458362 1433471987 /nfs/dbraw/zinc/47/19/87/1433471987.db2.gz UUXMBCKHZNNFAJ-QRWLVFNGSA-N 0 0 399.447 3.394 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N[C@H]2CC[C@H](O)CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000245505184 1433478450 /nfs/dbraw/zinc/47/84/50/1433478450.db2.gz FRGYIQDZHHZHHP-BPUTZDHNSA-N 0 0 384.436 3.196 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cccc1[N+](=O)[O-] ZINC000245775155 1433515860 /nfs/dbraw/zinc/51/58/60/1433515860.db2.gz TVSZSDTUIDOBQP-DZGCQCFKSA-N 0 0 398.467 3.105 20 5 GGBDRN O=C1CC[C@H]2CN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC[C@H]2N1C1CC1 ZINC000245788884 1433517635 /nfs/dbraw/zinc/51/76/35/1433517635.db2.gz NJDSVDGPBORHLR-HNAYVOBHSA-N 0 0 396.447 3.225 20 5 GGBDRN CN1CCO[C@@H]([C@@H](NC(=O)c2csc([N+](=O)[O-])c2)c2ccc(Cl)cc2)C1 ZINC000245800232 1433520125 /nfs/dbraw/zinc/52/01/25/1433520125.db2.gz ZDKWLCCBADUYJV-ZBFHGGJFSA-N 0 0 395.868 3.111 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN(C[C@H]3CCCO3)[C@H]3CCSC3)n2)c1 ZINC000245834565 1433523825 /nfs/dbraw/zinc/52/38/25/1433523825.db2.gz GVWMKLDLOFGBPH-JKSUJKDBSA-N 0 0 390.465 3.131 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@](C)(O)C3)cc2[N+](=O)[O-])C1 ZINC000245872679 1433531259 /nfs/dbraw/zinc/53/12/59/1433531259.db2.gz HCQMOPOPTPJPKP-SXGZJXTBSA-N 0 0 375.469 3.064 20 5 GGBDRN CN1CCO[C@H]([C@@H](NC(=O)c2ccccc2[N+](=O)[O-])c2ccc(Cl)cc2)C1 ZINC000245919154 1433542320 /nfs/dbraw/zinc/54/23/20/1433542320.db2.gz NOAVWBDTKTYEIE-ROUUACIJSA-N 0 0 389.839 3.050 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000245922922 1433543735 /nfs/dbraw/zinc/54/37/35/1433543735.db2.gz ODFFQRYIBMQCHB-NXEZZACHSA-N 0 0 377.260 3.024 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCOC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000246068265 1433564398 /nfs/dbraw/zinc/56/43/98/1433564398.db2.gz RTVGZTBBIQVQGQ-VQTJNVASSA-N 0 0 386.448 3.318 20 5 GGBDRN Cc1ccc(C)c(NC(=O)[C@H](C)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000246095163 1433567972 /nfs/dbraw/zinc/56/79/72/1433567972.db2.gz ALWXAKOITAQGQN-JKSUJKDBSA-N 0 0 383.452 3.120 20 5 GGBDRN C[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)[C@H]1C ZINC000246116311 1433571072 /nfs/dbraw/zinc/57/10/72/1433571072.db2.gz ISOKOKAXHCTMIB-UWVGGRQHSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000246128001 1433572354 /nfs/dbraw/zinc/57/23/54/1433572354.db2.gz JLVDWCCDOJFCBL-SJKOYZFVSA-N 0 0 394.424 3.193 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000246145403 1433574392 /nfs/dbraw/zinc/57/43/92/1433574392.db2.gz HDJUECBAYNMYQI-JQQNFUDXSA-N 0 0 393.509 3.005 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 ZINC000246146782 1433574706 /nfs/dbraw/zinc/57/47/06/1433574706.db2.gz PXWHRBRYLSQIBZ-LERXQTSPSA-N 0 0 383.351 3.275 20 5 GGBDRN Cc1ccccc1[C@H]1CN(S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000246163017 1433576643 /nfs/dbraw/zinc/57/66/43/1433576643.db2.gz LZSRXBNBOCTYKJ-MAUKXSAKSA-N 0 0 390.461 3.362 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000246200256 1433581249 /nfs/dbraw/zinc/58/12/49/1433581249.db2.gz URFMQSSVKXIZTG-ARGWCVDVSA-N 0 0 388.395 3.490 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000246205274 1433581532 /nfs/dbraw/zinc/58/15/32/1433581532.db2.gz VSNQGRFPCMGDQH-SNUQEOBHSA-N 0 0 385.376 3.494 20 5 GGBDRN C[C@H]1CC(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C[C@H](C)C1 ZINC000246224874 1433584105 /nfs/dbraw/zinc/58/41/05/1433584105.db2.gz REPHHKHOHFWLBN-YRGRVCCFSA-N 0 0 379.482 3.202 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000246254224 1433586681 /nfs/dbraw/zinc/58/66/81/1433586681.db2.gz WTZDVDXKBGKSCR-VBNZEHGJSA-N 0 0 377.441 3.465 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246270577 1433588328 /nfs/dbraw/zinc/58/83/28/1433588328.db2.gz MJJQCDSWXIEPTM-RTBURBONSA-N 0 0 399.447 3.048 20 5 GGBDRN COC(=O)[C@@H](C)CN(C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000246272660 1433588352 /nfs/dbraw/zinc/58/83/52/1433588352.db2.gz BAACLAODPQSQIO-HNAYVOBHSA-N 0 0 399.447 3.324 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@H]3CCc4n[nH]cc4C3)cc2[N+](=O)[O-])C1 ZINC000246292366 1433590456 /nfs/dbraw/zinc/59/04/56/1433590456.db2.gz BAAXBCJUTWYUOH-CPUCHLNUSA-N 0 0 397.479 3.088 20 5 GGBDRN C[C@@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H](c2ccsc2)O1 ZINC000246292923 1433590892 /nfs/dbraw/zinc/59/08/92/1433590892.db2.gz BNEWBIZGNVTSDM-BVGQSLNGSA-N 0 0 387.461 3.224 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@@H](c2ccco2)C1 ZINC000246312663 1433593088 /nfs/dbraw/zinc/59/30/88/1433593088.db2.gz CAODIWHKPOWGPB-BDJLRTHQSA-N 0 0 379.800 3.242 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000246317991 1433594186 /nfs/dbraw/zinc/59/41/86/1433594186.db2.gz XYCBMDPGAVUAAY-UKRRQHHQSA-N 0 0 396.490 3.242 20 5 GGBDRN C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000246351369 1433599133 /nfs/dbraw/zinc/59/91/33/1433599133.db2.gz KBOPVIFGZAPYBG-MBNYWOFBSA-N 0 0 379.844 3.158 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2C[C@@H]3CCCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000246360459 1433600249 /nfs/dbraw/zinc/60/02/49/1433600249.db2.gz MZBZWFIOHUSUJL-JENIJYKNSA-N 0 0 385.464 3.156 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C[C@H]3CCOC3)cc2[N+](=O)[O-])C1 ZINC000246379176 1433603447 /nfs/dbraw/zinc/60/34/47/1433603447.db2.gz BPTUUEWVZFCQCI-BZUAXINKSA-N 0 0 375.469 3.186 20 5 GGBDRN CN(CC(=O)N1CCC[C@H]1C[C@@H](O)c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000246393840 1433606194 /nfs/dbraw/zinc/60/61/94/1433606194.db2.gz SPUNJTPNPXJPJY-WMLDXEAASA-N 0 0 389.477 3.207 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC[C@H](C)c2ccccc21 ZINC000246398269 1433607019 /nfs/dbraw/zinc/60/70/19/1433607019.db2.gz XLSZJVVZDBEPQT-NJSLBKSFSA-N 0 0 381.432 3.468 20 5 GGBDRN COc1ccc(NC(=O)CN2C[C@@H](C)O[C@H](c3ccsc3)C2)c([N+](=O)[O-])c1 ZINC000246437021 1433612591 /nfs/dbraw/zinc/61/25/91/1433612591.db2.gz KRPROTHMAKIYMK-PXAZEXFGSA-N 0 0 391.449 3.065 20 5 GGBDRN 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CC[C@H](C)C(=O)N1CCC[C@H](C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000246518077 1433624088 /nfs/dbraw/zinc/62/40/88/1433624088.db2.gz UYDSAHFQGLZISB-LXZKKBNFSA-N 0 0 375.469 3.365 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CCO[C@](C)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000246616588 1433639896 /nfs/dbraw/zinc/63/98/96/1433639896.db2.gz VGXDUMHEQNTVQH-BTYIYWSLSA-N 0 0 399.447 3.178 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CC[C@H](c2ccccc2)[C@@H]1C ZINC000246623056 1433641264 /nfs/dbraw/zinc/64/12/64/1433641264.db2.gz YZUJFRJBZAOWSN-DOXZYTNZSA-N 0 0 381.432 3.118 20 5 GGBDRN C[C@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H](c2ccsc2)O1 ZINC000246697901 1433651528 /nfs/dbraw/zinc/65/15/28/1433651528.db2.gz ZYSVDQOVRLAZBE-SJCJKPOMSA-N 0 0 376.434 3.485 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](c2ccccc2)C[C@@H]1C ZINC000246701303 1433651779 /nfs/dbraw/zinc/65/17/79/1433651779.db2.gz DTXBTAKPFSRKIT-RLFYNMQTSA-N 0 0 381.432 3.118 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000246728739 1433656225 /nfs/dbraw/zinc/65/62/25/1433656225.db2.gz HCAULHQKECZBLG-ATZDWAIDSA-N 0 0 385.464 3.299 20 5 GGBDRN C[C@H](O)C[C@H]1CCCN1C(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000246732323 1433657241 /nfs/dbraw/zinc/65/72/41/1433657241.db2.gz ZNGQNLLDXAWSOW-UIBIWLFHSA-N 0 0 389.496 3.453 20 5 GGBDRN Cc1cc(S(=O)(=O)N2c3ccccc3N(C)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000246756847 1433661010 /nfs/dbraw/zinc/66/10/10/1433661010.db2.gz VUBMBYBXPQZQMI-CQSZACIVSA-N 0 0 375.450 3.327 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2[C@@H]3c4ccccc4C[C@H]23)cc1OC ZINC000246842452 1433677116 /nfs/dbraw/zinc/67/71/16/1433677116.db2.gz SYVZGALCXJUNBI-AKCHCHLHSA-N 0 0 382.416 3.318 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000246856852 1433678922 /nfs/dbraw/zinc/67/89/22/1433678922.db2.gz CJYZVFBKDQKGHQ-JYJNAYRXSA-N 0 0 392.500 3.151 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CCO[C@H](C)[C@H]2C)c1=S ZINC000246903156 1433685094 /nfs/dbraw/zinc/68/50/94/1433685094.db2.gz FYDHNLCOPFORDS-CHWSQXEVSA-N 0 0 377.470 3.076 20 5 GGBDRN CC[C@@H]1CN([C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)CCO1 ZINC000246976800 1433689438 /nfs/dbraw/zinc/68/94/38/1433689438.db2.gz JMZLKEIMOHYIGQ-IUODEOHRSA-N 0 0 390.465 3.156 20 5 GGBDRN C[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)[C@H]1C ZINC000247231174 1433694246 /nfs/dbraw/zinc/69/42/46/1433694246.db2.gz YHTBDGSLTHJGLV-ZJUUUORDSA-N 0 0 377.260 3.166 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000247290694 1433700628 /nfs/dbraw/zinc/70/06/28/1433700628.db2.gz ASOIRJHNLSHTJQ-NRFANRHFSA-N 0 0 383.448 3.369 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCN(C/C=C/c2ccccc2)CC1 ZINC000247304995 1433702996 /nfs/dbraw/zinc/70/29/96/1433702996.db2.gz GMOLRBFPYPSQEC-RMKNXTFCSA-N 0 0 394.475 3.254 20 5 GGBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000247324265 1433706550 /nfs/dbraw/zinc/70/65/50/1433706550.db2.gz MYFMJLGQEPUXLG-LBPRGKRZSA-N 0 0 385.811 3.311 20 5 GGBDRN C[C@@H]1CN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](c2ccccc2)CO1 ZINC000247359933 1433713285 /nfs/dbraw/zinc/71/32/85/1433713285.db2.gz CCCWCMVQYKGTOO-DNVCBOLYSA-N 0 0 379.420 3.273 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000247408778 1433718651 /nfs/dbraw/zinc/71/86/51/1433718651.db2.gz IQFVOELXNJYJSD-TZMCWYRMSA-N 0 0 380.422 3.358 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000247466417 1433725862 /nfs/dbraw/zinc/72/58/62/1433725862.db2.gz RKXLOTGUMZLSMB-TZMCWYRMSA-N 0 0 380.422 3.358 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000247492717 1433729470 /nfs/dbraw/zinc/72/94/70/1433729470.db2.gz HAFVPEQNZMKCIC-ZOCZFRKYSA-N 0 0 383.448 3.408 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000247731006 1433748527 /nfs/dbraw/zinc/74/85/27/1433748527.db2.gz VDUSXKMUZHRALB-XNJGSVPQSA-N 0 0 391.859 3.355 20 5 GGBDRN COc1cc(CN2CC[C@@H](C)[C@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000247776822 1433750482 /nfs/dbraw/zinc/75/04/82/1433750482.db2.gz WYQVTFFTEWBCGK-IUODEOHRSA-N 0 0 396.394 3.484 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2cn3ccsc3n2)CC1 ZINC000247820176 1433753112 /nfs/dbraw/zinc/75/31/12/1433753112.db2.gz GBLAQIKVQQFPAS-UHFFFAOYSA-N 0 0 399.476 3.470 20 5 GGBDRN Cc1cc(C)n(-c2ccc(Cn3cnc4cc([N+](=O)[O-])ccc4c3=O)cc2)n1 ZINC000247931529 1433756869 /nfs/dbraw/zinc/75/68/69/1433756869.db2.gz QTKZWTHTSHQAFV-UHFFFAOYSA-N 0 0 375.388 3.156 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000247944930 1433757859 /nfs/dbraw/zinc/75/78/59/1433757859.db2.gz YTZWXBISNXXFEL-JTQLQIEISA-N 0 0 386.376 3.263 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCO[C@@H](C)[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000247958415 1433759334 /nfs/dbraw/zinc/75/93/34/1433759334.db2.gz FXWRJHSEXHNNGX-QXSJWSMHSA-N 0 0 375.469 3.327 20 5 GGBDRN CC(C)NC(=O)c1ccc(NCc2ccc(N3CCCC3)nc2)c([N+](=O)[O-])c1 ZINC000248029990 1433764506 /nfs/dbraw/zinc/76/45/06/1433764506.db2.gz XCPZBDQVXPKCRY-UHFFFAOYSA-N 0 0 383.452 3.340 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000248034205 1433765192 /nfs/dbraw/zinc/76/51/92/1433765192.db2.gz RHKKTMFNCXYNPC-LJQANCHMSA-N 0 0 383.429 3.366 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)Cc2cc(Cl)ccc2OC)cc1[N+](=O)[O-] ZINC000248060050 1433766887 /nfs/dbraw/zinc/76/68/87/1433766887.db2.gz PSQCVZFPTLIONG-UHFFFAOYSA-N 0 0 399.856 3.119 20 5 GGBDRN C[NH+](C)CCN(Cc1ccccc1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000248064760 1433767239 /nfs/dbraw/zinc/76/72/39/1433767239.db2.gz ZPXHJZVNYGPRPZ-UHFFFAOYSA-N 0 0 382.464 3.373 20 5 GGBDRN C[C@@H]1CCC[C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@H]1C ZINC000248165617 1433776244 /nfs/dbraw/zinc/77/62/44/1433776244.db2.gz RIIKBVZPANIZTK-IPYPFGDCSA-N 0 0 375.425 3.224 20 5 GGBDRN CCN(Cc1ccc2c(c1)OCO2)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000248248256 1433782960 /nfs/dbraw/zinc/78/29/60/1433782960.db2.gz KQUYAKYGACHXBF-UHFFFAOYSA-N 0 0 383.404 3.242 20 5 GGBDRN CC(=O)c1ccc(NC2CCN(CC(=O)Nc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000248377447 1433789498 /nfs/dbraw/zinc/78/94/98/1433789498.db2.gz GQUXZLMHWYJKAC-UHFFFAOYSA-N 0 0 396.447 3.312 20 5 GGBDRN C[C@@H]1CN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H]2CCCC[C@H]21 ZINC000248384165 1433791157 /nfs/dbraw/zinc/79/11/57/1433791157.db2.gz CXTYYYGTNZNACE-SCDSUCTJSA-N 0 0 397.378 3.172 20 5 GGBDRN C[C@@H]1CN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@@H]2CCCC[C@H]21 ZINC000248385141 1433791499 /nfs/dbraw/zinc/79/14/99/1433791499.db2.gz HJEUQJJWSJVFJF-VNQPRFMTSA-N 0 0 387.436 3.320 20 5 GGBDRN CN1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](c2ccccc2)C1 ZINC000248395639 1433795392 /nfs/dbraw/zinc/79/53/92/1433795392.db2.gz GJHVNALGMIVUOM-GOSISDBHSA-N 0 0 379.420 3.134 20 5 GGBDRN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000248401264 1433797819 /nfs/dbraw/zinc/79/78/19/1433797819.db2.gz LRSBECGFVBEELT-QVDMIQRCSA-N 0 0 383.448 3.187 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000248465368 1433805174 /nfs/dbraw/zinc/80/51/74/1433805174.db2.gz RPVAPFSDPANMAK-FIKGOQFSSA-N 0 0 386.448 3.105 20 5 GGBDRN C[C@@H]1CC[C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C ZINC000248495064 1433805897 /nfs/dbraw/zinc/80/58/97/1433805897.db2.gz KSJPDZHZHPAZEI-GMTAPVOTSA-N 0 0 385.367 3.076 20 5 GGBDRN C[C@H](C(=O)N[C@H](C[S@@](C)=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000248518702 1433806682 /nfs/dbraw/zinc/80/66/82/1433806682.db2.gz QBTRQJRSQFBUCN-FLFOAQQMSA-N 0 0 378.425 3.073 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@H]2[C@H](C)CCC[C@@H]2C)nn1-c1ccccc1[N+](=O)[O-] ZINC000248529947 1433807158 /nfs/dbraw/zinc/80/71/58/1433807158.db2.gz LYKQCUDOXQBSHL-MCBXIFIFSA-N 0 0 384.436 3.004 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@@H]2CC[C@@H](C)[C@@H](C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000248587253 1433810056 /nfs/dbraw/zinc/81/00/56/1433810056.db2.gz KAHGZISQPSSEHR-VNHYZAJKSA-N 0 0 384.436 3.004 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000248619870 1433811738 /nfs/dbraw/zinc/81/17/38/1433811738.db2.gz MELNUZJBNFVYEO-VQIMIIECSA-N 0 0 392.839 3.061 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000248619863 1433811746 /nfs/dbraw/zinc/81/17/46/1433811746.db2.gz MELNUZJBNFVYEO-QFBILLFUSA-N 0 0 392.839 3.061 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c1C ZINC000248692664 1433815516 /nfs/dbraw/zinc/81/55/16/1433815516.db2.gz YCBUGGHZLYVHKU-PXAZEXFGSA-N 0 0 375.450 3.378 20 5 GGBDRN O=C(N[C@@H]1C[C@@H]2OCCC[C@@H]12)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000248737886 1433818820 /nfs/dbraw/zinc/81/88/20/1433818820.db2.gz PFSVRGKHQZJTII-HQRMLTQVSA-N 0 0 382.416 3.471 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NC[C@@H]2CC[C@@H](O)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000248902231 1433828601 /nfs/dbraw/zinc/82/86/01/1433828601.db2.gz NPJBXGDKZIDBNP-SQWLQELKSA-N 0 0 384.436 3.054 20 5 GGBDRN C[C@@H](NC(=O)c1cc(N2C[C@@H](C)O[C@H](C)C2)ccn1)c1cccc([N+](=O)[O-])c1 ZINC000248986268 1433831456 /nfs/dbraw/zinc/83/14/56/1433831456.db2.gz VKHFVTHKZILYAW-RBSFLKMASA-N 0 0 384.436 3.094 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC[C@@H]1CN1C[C@H](C)O[C@@H](C)C1 ZINC000249054230 1433833321 /nfs/dbraw/zinc/83/33/21/1433833321.db2.gz IMZOWNXRBAEXTF-YESZJQIVSA-N 0 0 390.484 3.317 20 5 GGBDRN C[C@H](NC(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000249073627 1433834014 /nfs/dbraw/zinc/83/40/14/1433834014.db2.gz ALVHUMNPFBCSQX-NORZTCDRSA-N 0 0 389.374 3.439 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N(C)C[C@H]2COc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000249253165 1433839637 /nfs/dbraw/zinc/83/96/37/1433839637.db2.gz ZRHOGNDBUZTCRF-CABCVRRESA-N 0 0 385.420 3.002 20 5 GGBDRN CCC[C@@H]1CN(c2ccc([N+](=O)[O-])c(N3CCO[C@@H](CCC)C3)n2)CCO1 ZINC000249323480 1433841353 /nfs/dbraw/zinc/84/13/53/1433841353.db2.gz RIKYWAFRWWLAKY-CVEARBPZSA-N 0 0 378.473 3.000 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2C[C@@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000249487455 1433844818 /nfs/dbraw/zinc/84/48/18/1433844818.db2.gz XJCNYDNGKBYCHJ-BDJLRTHQSA-N 0 0 380.397 3.124 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@H]1Oc1ccccc1 ZINC000249485994 1433844874 /nfs/dbraw/zinc/84/48/74/1433844874.db2.gz YGBOAOZAJIQLMV-GUDVDZBRSA-N 0 0 385.420 3.019 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCC[C@H]3CCO)cc2[N+](=O)[O-])C1 ZINC000249497640 1433845169 /nfs/dbraw/zinc/84/51/69/1433845169.db2.gz HGIQVLPLTNZAGV-UIBIWLFHSA-N 0 0 389.496 3.358 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC[C@H]2[C@H]2CCCCC2=O)c1[N+](=O)[O-] ZINC000249555465 1433846901 /nfs/dbraw/zinc/84/69/01/1433846901.db2.gz LSJNBDSCZHFLDA-CABCVRRESA-N 0 0 380.466 3.124 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000249584638 1433847389 /nfs/dbraw/zinc/84/73/89/1433847389.db2.gz SMRHGKHVHDIWNJ-KPZWWZAWSA-N 0 0 391.374 3.274 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@H](c3ccccc3)OC[C@H]2C)c1[N+](=O)[O-] ZINC000249649174 1433848584 /nfs/dbraw/zinc/84/85/84/1433848584.db2.gz UCVNABCUJRXHFK-NVXWUHKLSA-N 0 0 390.461 3.362 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000249689619 1433849058 /nfs/dbraw/zinc/84/90/58/1433849058.db2.gz XAYRJYRMJGDBAE-NWDGAFQWSA-N 0 0 377.832 3.178 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000249703775 1433849195 /nfs/dbraw/zinc/84/91/95/1433849195.db2.gz KWQHSBVBIJDJOW-QLFBSQMISA-N 0 0 384.436 3.094 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@@H](c2ccccc2)O1 ZINC000250084150 1433854270 /nfs/dbraw/zinc/85/42/70/1433854270.db2.gz CZDBKJHSEKSVAR-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN COc1cc(C[N@@H+]2CC[C@@H](O)[C@@H](C)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000250142438 1433854797 /nfs/dbraw/zinc/85/47/97/1433854797.db2.gz ZGEMIKISANKVDJ-HNAYVOBHSA-N 0 0 386.448 3.385 20 5 GGBDRN CSc1ccc(C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000250198984 1433855022 /nfs/dbraw/zinc/85/50/22/1433855022.db2.gz BCDSYRBZQJLZLT-OFQRWUPVSA-N 0 0 393.509 3.031 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1[N+](=O)[O-] ZINC000250918415 1433857431 /nfs/dbraw/zinc/85/74/31/1433857431.db2.gz KYKOVGDNVXMKTK-NUJGCVRESA-N 0 0 399.447 3.208 20 5 GGBDRN C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000251745921 1433860414 /nfs/dbraw/zinc/86/04/14/1433860414.db2.gz CZCIMTOXLMFGNO-IIAWOOMASA-N 0 0 387.436 3.463 20 5 GGBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2OCCC[C@@H]12 ZINC000251791955 1433860520 /nfs/dbraw/zinc/86/05/20/1433860520.db2.gz LXFMLSPEQFRXML-LOWVWBTDSA-N 0 0 390.383 3.389 20 5 GGBDRN C[C@@H]1CCC[C@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)[C@H]1C ZINC000251853749 1433860814 /nfs/dbraw/zinc/86/08/14/1433860814.db2.gz PGBUYTTWNTYAOM-DYEKYZERSA-N 0 0 389.481 3.429 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000251924987 1433861522 /nfs/dbraw/zinc/86/15/22/1433861522.db2.gz SQBAJJHWZTXRSM-SOLBZPMBSA-N 0 0 389.496 3.432 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)[C@H]1Oc1ccccc1 ZINC000252004574 1433862152 /nfs/dbraw/zinc/86/21/52/1433862152.db2.gz ZKIWXEBCDROPKT-YFVAEKQCSA-N 0 0 384.432 3.187 20 5 GGBDRN C[C@@H]1CCC[C@@H](N(C)C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000252441000 1433863181 /nfs/dbraw/zinc/86/31/81/1433863181.db2.gz KFMZJKBJIDAQBF-MGPQQGTHSA-N 0 0 379.482 3.298 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc1C ZINC000253357432 1433865873 /nfs/dbraw/zinc/86/58/73/1433865873.db2.gz AGRQDLZLUYREEO-CRAIPNDOSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1c(C(=O)NC23CC4CC(CC(C4)C2)C3)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000253599813 1433869909 /nfs/dbraw/zinc/86/99/09/1433869909.db2.gz WLDXUSVGHBXRTB-UHFFFAOYSA-N 0 0 381.436 3.183 20 5 GGBDRN CC[C@H](NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C)c1ccc(OC)cc1 ZINC000253599860 1433869945 /nfs/dbraw/zinc/86/99/45/1433869945.db2.gz YRUGERDGZPWIOJ-SFHVURJKSA-N 0 0 395.419 3.374 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000253599252 1433869947 /nfs/dbraw/zinc/86/99/47/1433869947.db2.gz GGPMVBFWEYLFTP-UHFFFAOYSA-N 0 0 387.783 3.398 20 5 GGBDRN Cc1cccc(C(=O)N2CCCN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000254939894 1433872529 /nfs/dbraw/zinc/87/25/29/1433872529.db2.gz UFOSLRIEHRNNOZ-FLIBITNWSA-N 0 0 393.443 3.291 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OC[C@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000254972371 1433873293 /nfs/dbraw/zinc/87/32/93/1433873293.db2.gz KFPBBLUOVIZKRL-YFWYWMRJSA-N 0 0 380.400 3.200 20 5 GGBDRN COc1ccc(C(=O)N2CCCC2)cc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 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XXRHMFNIHBWYGI-NSIKDUERSA-N 0 0 397.778 3.183 20 5 GGBDRN O=C(/C=C\c1nc2ccccc2s1)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000255335193 1433880587 /nfs/dbraw/zinc/88/05/87/1433880587.db2.gz NFUOYRMQTDDCTJ-HJWRWDBZSA-N 0 0 383.385 3.400 20 5 GGBDRN C[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCOC2=O)c1 ZINC000255388888 1433882081 /nfs/dbraw/zinc/88/20/81/1433882081.db2.gz RMJFTRAKUJBGLY-YHAOYDPOSA-N 0 0 381.388 3.442 20 5 GGBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCOC[C@H]1CC(=O)c1ccccc1 ZINC000255397285 1433882231 /nfs/dbraw/zinc/88/22/31/1433882231.db2.gz NNTKXAGAGZNLRD-SCEWNMGZSA-N 0 0 380.400 3.108 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(N3CCN(C/C=C\c4ccccc4)CC3)cc2N1 ZINC000255430546 1433882765 /nfs/dbraw/zinc/88/27/65/1433882765.db2.gz DUEMAJKKUSBQQJ-DAXSKMNVSA-N 0 0 392.459 3.315 20 5 GGBDRN Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255470906 1433883222 /nfs/dbraw/zinc/88/32/22/1433883222.db2.gz KISRKNFJUMDFBK-WTKPLQERSA-N 0 0 395.415 3.028 20 5 GGBDRN 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HGKFBRPUGZDDNA-PKNBQFBNSA-N 0 0 381.344 3.019 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCc1cccc(CN2CCCC2=O)c1 ZINC000255776530 1433889577 /nfs/dbraw/zinc/88/95/77/1433889577.db2.gz SCJJMNOCZCPKMM-FLIBITNWSA-N 0 0 379.416 3.047 20 5 GGBDRN Cc1cccc([C@H](CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)N2CCOCC2)c1 ZINC000255829468 1433889729 /nfs/dbraw/zinc/88/97/29/1433889729.db2.gz JDZAKRCCVHLKDN-UKSYNSBOSA-N 0 0 395.459 3.106 20 5 GGBDRN Cc1cccc([C@@H](CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)N2CCOCC2)c1 ZINC000255829467 1433889764 /nfs/dbraw/zinc/88/97/64/1433889764.db2.gz JDZAKRCCVHLKDN-PWYGHMFVSA-N 0 0 395.459 3.106 20 5 GGBDRN O=[N+]([O-])c1ccc(/C=C\Sc2nnc(N3CCOCC3)n2-c2ccccc2)o1 ZINC000255844199 1433890095 /nfs/dbraw/zinc/89/00/95/1433890095.db2.gz MBRAHSVUZMQBLW-JYRVWZFOSA-N 0 0 399.432 3.368 20 5 GGBDRN CCN(C(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1S(=O)(=O)CC ZINC000255846924 1433890250 /nfs/dbraw/zinc/89/02/50/1433890250.db2.gz RFLWMXVVVLWZTL-SDNWHVSQSA-N 0 0 388.445 3.455 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1ccn(-c2ccccc2)n1 ZINC000255904869 1433891590 /nfs/dbraw/zinc/89/15/90/1433891590.db2.gz NWDJGEBINZHVBG-WYMLVPIESA-N 0 0 385.383 3.435 20 5 GGBDRN CC[C@H](C)[C@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(=O)OC ZINC000255945707 1433892273 /nfs/dbraw/zinc/89/22/73/1433892273.db2.gz BICUETHFOJXTEH-KSSFIOAISA-N 0 0 391.468 3.149 20 5 GGBDRN CCN(C[C@H]1COc2ccccc2O1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000255952965 1433892462 /nfs/dbraw/zinc/89/24/62/1433892462.db2.gz GZYWHYOQXDIFHU-PBHICJAKSA-N 0 0 385.420 3.084 20 5 GGBDRN CCOc1ccc(C(=O)N2CCNC[C@@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000261956350 1433915836 /nfs/dbraw/zinc/91/58/36/1433915836.db2.gz LZSCQWIYFQAQEB-QGZVFWFLSA-N 0 0 389.839 3.434 20 5 GGBDRN CSc1ccc(C(=O)N2CCNC[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000262097507 1433927088 /nfs/dbraw/zinc/92/70/88/1433927088.db2.gz YYYHLWBRJNIYCU-INIZCTEOSA-N 0 0 375.425 3.243 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c([O-])c1)N(Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000262339865 1433935667 /nfs/dbraw/zinc/93/56/67/1433935667.db2.gz HUIGONNIYMGOBZ-QGZVFWFLSA-N 0 0 387.461 3.146 20 5 GGBDRN CC1CCN(c2ccc(C(=O)Nc3cc4c(cc3N)OCO4)cc2[N+](=O)[O-])CC1 ZINC000262584179 1433944873 /nfs/dbraw/zinc/94/48/73/1433944873.db2.gz MYXCMOBNIXHJDW-UHFFFAOYSA-N 0 0 398.419 3.394 20 5 GGBDRN C[N@H+](CC(=O)[O-])[C@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000263522159 1434011157 /nfs/dbraw/zinc/01/11/57/1434011157.db2.gz ROEBSRSEDVNLPC-INIZCTEOSA-N 0 0 387.436 3.226 20 5 GGBDRN O=C([O-])C[N@H+](CC1CC1)C1CC(Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000263563071 1434013540 /nfs/dbraw/zinc/01/35/40/1434013540.db2.gz TUEHBBVSBSYJQW-UHFFFAOYSA-N 0 0 387.358 3.353 20 5 GGBDRN Cc1nn(CCC(=O)N(C)Cc2ccccc2C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000263640322 1434014217 /nfs/dbraw/zinc/01/42/17/1434014217.db2.gz AEJDPNYNYGNEQQ-UHFFFAOYSA-N 0 0 384.358 3.476 20 5 GGBDRN CC(=O)c1ccc(OC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000263642640 1434014429 /nfs/dbraw/zinc/01/44/29/1434014429.db2.gz DBIPAMKVFWNBGE-LJQANCHMSA-N 0 0 396.399 3.316 20 5 GGBDRN CC(=O)Nc1ccc(Cl)c(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000263645163 1434014639 /nfs/dbraw/zinc/01/46/39/1434014639.db2.gz FEOIXFRWGLZIJL-UHFFFAOYSA-N 0 0 379.804 3.049 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)Cc3nccn3C)cc2[N+](=O)[O-])C1 ZINC000263648220 1434015214 /nfs/dbraw/zinc/01/52/14/1434015214.db2.gz FWUVFQSDBOWYNN-GJZGRUSLSA-N 0 0 385.468 3.083 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cccc(OCc3ccccn3)c2)c(C)c1[N+](=O)[O-] ZINC000263653211 1434015955 /nfs/dbraw/zinc/01/59/55/1434015955.db2.gz HOTSJJHUQIOLQB-UHFFFAOYSA-N 0 0 395.419 3.411 20 5 GGBDRN CCOC(=O)/C=C/c1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000263659416 1434016676 /nfs/dbraw/zinc/01/66/76/1434016676.db2.gz JFBBNGMTIABQAS-JXMROGBWSA-N 0 0 386.408 3.013 20 5 GGBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H]1OCCc2ccccc21 ZINC000263667854 1434017998 /nfs/dbraw/zinc/01/79/98/1434017998.db2.gz FTHUDOJSVXOAMH-GOSISDBHSA-N 0 0 380.404 3.391 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000263670365 1434018381 /nfs/dbraw/zinc/01/83/81/1434018381.db2.gz FDWONDAGZIJICV-LBPRGKRZSA-N 0 0 388.424 3.063 20 5 GGBDRN O=C(Nc1cccc(F)c1)C1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000263676023 1434019202 /nfs/dbraw/zinc/01/92/02/1434019202.db2.gz HCYLSPMSMHYWEZ-UHFFFAOYSA-N 0 0 389.412 3.298 20 5 GGBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000263678400 1434019447 /nfs/dbraw/zinc/01/94/47/1434019447.db2.gz GREHQKLRLRSGFE-INIZCTEOSA-N 0 0 383.404 3.044 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000263682469 1434020204 /nfs/dbraw/zinc/02/02/04/1434020204.db2.gz FAVQPBZNDGHWFU-GFCCVEGCSA-N 0 0 382.848 3.264 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccccc2OCC(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000263683618 1434020371 /nfs/dbraw/zinc/02/03/71/1434020371.db2.gz PPHMPLZCFMFSGT-UHFFFAOYSA-N 0 0 386.330 3.378 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N(C)Cc2cccs2)ccc1[N+](=O)[O-] ZINC000263686695 1434020914 /nfs/dbraw/zinc/02/09/14/1434020914.db2.gz QGOAWTAWRBXOKA-QGZVFWFLSA-N 0 0 387.461 3.228 20 5 GGBDRN Cc1nc(COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cs1 ZINC000263689887 1434021170 /nfs/dbraw/zinc/02/11/70/1434021170.db2.gz RCISDFOGJZRQEZ-INIZCTEOSA-N 0 0 389.433 3.016 20 5 GGBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000263688610 1434021222 /nfs/dbraw/zinc/02/12/22/1434021222.db2.gz ILZYKAHEESALIJ-INIZCTEOSA-N 0 0 383.404 3.044 20 5 GGBDRN CCOC(=O)Nc1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000263695722 1434022135 /nfs/dbraw/zinc/02/21/35/1434022135.db2.gz SIRXSXFULNRLNQ-UHFFFAOYSA-N 0 0 375.385 3.005 20 5 GGBDRN O=C(Nc1ccc(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1)[C@@H]1CCCO1 ZINC000263700233 1434022722 /nfs/dbraw/zinc/02/27/22/1434022722.db2.gz LMLSJZMCWZAGSQ-SFHVURJKSA-N 0 0 396.403 3.341 20 5 GGBDRN O=C(Nc1ccc(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1)[C@H]1CCCO1 ZINC000263700225 1434022838 /nfs/dbraw/zinc/02/28/38/1434022838.db2.gz LMLSJZMCWZAGSQ-GOSISDBHSA-N 0 0 396.403 3.341 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000263721804 1434025327 /nfs/dbraw/zinc/02/53/27/1434025327.db2.gz BOTKHLIKBSNTOM-UHFFFAOYSA-N 0 0 387.396 3.176 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cc(NC(=O)C(C)C)ccc2C)c(C)c1[N+](=O)[O-] ZINC000263728289 1434026111 /nfs/dbraw/zinc/02/61/11/1434026111.db2.gz ZLIUHDNEJRCILJ-UHFFFAOYSA-N 0 0 387.440 3.340 20 5 GGBDRN O=C(NC[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])o2)C1)Nc1cccc(F)c1 ZINC000263741105 1434027700 /nfs/dbraw/zinc/02/77/00/1434027700.db2.gz AGWIQHMEYGWOTG-GFCCVEGCSA-N 0 0 390.371 3.001 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccccc2-c2n[nH]c(C(C)C)n2)c(C)c1[N+](=O)[O-] ZINC000263741234 1434027780 /nfs/dbraw/zinc/02/77/80/1434027780.db2.gz AQJXIOMBZIFGLH-UHFFFAOYSA-N 0 0 397.439 3.345 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 ZINC000263742706 1434027926 /nfs/dbraw/zinc/02/79/26/1434027926.db2.gz OQGHUQOFFHASKA-CQSZACIVSA-N 0 0 398.419 3.154 20 5 GGBDRN O=C(Nc1ccc(F)cc1)C1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000263746151 1434028308 /nfs/dbraw/zinc/02/83/08/1434028308.db2.gz PGWSRUHWVKEYNM-UHFFFAOYSA-N 0 0 389.412 3.298 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccccc2NCC(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000263748315 1434028527 /nfs/dbraw/zinc/02/85/27/1434028527.db2.gz BKTDREOEDRPRRS-UHFFFAOYSA-N 0 0 385.346 3.411 20 5 GGBDRN CCOc1cc(NC(=O)NCc2nccn2C(F)F)c([N+](=O)[O-])cc1OCC ZINC000263761120 1434030426 /nfs/dbraw/zinc/03/04/26/1434030426.db2.gz HJBGJHXVJMRSPF-UHFFFAOYSA-N 0 0 399.354 3.306 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000263775915 1434032412 /nfs/dbraw/zinc/03/24/12/1434032412.db2.gz UJYIDVKVGDWXDN-MRXNPFEDSA-N 0 0 397.479 3.493 20 5 GGBDRN O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)N[C@H](c1ccccc1)C1CC1 ZINC000263795460 1434034700 /nfs/dbraw/zinc/03/47/00/1434034700.db2.gz RWFDRMSXANBWDE-LJQANCHMSA-N 0 0 377.404 3.121 20 5 GGBDRN O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)N[C@@H](c1ccccc1)C1CC1 ZINC000263795457 1434034892 /nfs/dbraw/zinc/03/48/92/1434034892.db2.gz RWFDRMSXANBWDE-IBGZPJMESA-N 0 0 377.404 3.121 20 5 GGBDRN CC(C)C(=O)NC[C@@H]1CCCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000263812712 1434036659 /nfs/dbraw/zinc/03/66/59/1434036659.db2.gz OKBPKUSWGPKTBF-GJZGRUSLSA-N 0 0 393.509 3.086 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(O)c1 ZINC000263834427 1434039491 /nfs/dbraw/zinc/03/94/91/1434039491.db2.gz ZPDXYAZTVBZGIQ-KRWDZBQOSA-N 0 0 383.404 3.161 20 5 GGBDRN COc1ccc(CNC(=O)N2CCO[C@@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000263834111 1434039552 /nfs/dbraw/zinc/03/95/52/1434039552.db2.gz APBYCBONGJHOAK-GOSISDBHSA-N 0 0 389.383 3.026 20 5 GGBDRN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000263836729 1434039952 /nfs/dbraw/zinc/03/99/52/1434039952.db2.gz VJSCKIHUCFMCSG-HNNXBMFYSA-N 0 0 396.447 3.342 20 5 GGBDRN CSc1ccc(C(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000263845246 1434040981 /nfs/dbraw/zinc/04/09/81/1434040981.db2.gz XUPHAGCNCGAUTH-GFCCVEGCSA-N 0 0 395.481 3.304 20 5 GGBDRN C[C@H](NC(=O)N1CCC(C(=O)OC(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000263852358 1434041638 /nfs/dbraw/zinc/04/16/38/1434041638.db2.gz AAMGFSVMPPUOJN-ZDUSSCGKSA-N 0 0 377.441 3.419 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)c2cc(SC)ccc2[N+](=O)[O-])C1 ZINC000263857388 1434042241 /nfs/dbraw/zinc/04/22/41/1434042241.db2.gz ZLYXXSBMRDNEQT-ZDUSSCGKSA-N 0 0 379.482 3.085 20 5 GGBDRN COc1ccc(NC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])c(C)c1 ZINC000263884949 1434045574 /nfs/dbraw/zinc/04/55/74/1434045574.db2.gz OQFTYPMFXGRVBG-UHFFFAOYSA-N 0 0 389.408 3.293 20 5 GGBDRN COc1ccc(COCCCNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000263885226 1434045644 /nfs/dbraw/zinc/04/56/44/1434045644.db2.gz VZVHPWROIBUFCC-UHFFFAOYSA-N 0 0 387.436 3.352 20 5 GGBDRN COC(=O)c1ccccc1C(=O)c1ccc(N2CCCO[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000263884765 1434045675 /nfs/dbraw/zinc/04/56/75/1434045675.db2.gz RWZZSSHUYJBELK-AWEZNQCLSA-N 0 0 398.415 3.228 20 5 GGBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nnc2n1CCCCC2 ZINC000263920091 1434048873 /nfs/dbraw/zinc/04/88/73/1434048873.db2.gz OYCSZMNZYRQILQ-CQSZACIVSA-N 0 0 377.832 3.447 20 5 GGBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nnc2n1CCCCC2 ZINC000263920083 1434048963 /nfs/dbraw/zinc/04/89/63/1434048963.db2.gz OYCSZMNZYRQILQ-AWEZNQCLSA-N 0 0 377.832 3.447 20 5 GGBDRN CCCCCC(=O)NC1CCN(C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])CC1 ZINC000263925359 1434049292 /nfs/dbraw/zinc/04/92/92/1434049292.db2.gz OBEXCFJCTZVMOG-UHFFFAOYSA-N 0 0 383.395 3.174 20 5 GGBDRN Cc1ccc(CN(C)C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)s1 ZINC000263928891 1434049875 /nfs/dbraw/zinc/04/98/75/1434049875.db2.gz GPKQQFXUERCXCQ-UHFFFAOYSA-N 0 0 389.433 3.311 20 5 GGBDRN Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000263942347 1434051428 /nfs/dbraw/zinc/05/14/28/1434051428.db2.gz HMYGAGGKFHRZLO-OAHLLOKOSA-N 0 0 380.408 3.309 20 5 GGBDRN CCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)C(=O)N1CCc2sccc2C1 ZINC000263943963 1434051715 /nfs/dbraw/zinc/05/17/15/1434051715.db2.gz YFPGHNGYJMBKKQ-GFCCVEGCSA-N 0 0 393.490 3.201 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)C(C)(C)c1ccccc1 ZINC000263955699 1434053087 /nfs/dbraw/zinc/05/30/87/1434053087.db2.gz PHUUAOIECRTNPS-ZDUSSCGKSA-N 0 0 390.461 3.094 20 5 GGBDRN COc1cc(C(=O)Nc2ccccc2C(=O)N2CCCC2)c([N+](=O)[O-])cc1OC ZINC000263961387 1434053953 /nfs/dbraw/zinc/05/39/53/1434053953.db2.gz PWLCAMJAIWAWQB-UHFFFAOYSA-N 0 0 399.403 3.100 20 5 GGBDRN CCOC(=O)c1csc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])n1 ZINC000263977301 1434056503 /nfs/dbraw/zinc/05/65/03/1434056503.db2.gz ATHRRZQHIJBLNY-UHFFFAOYSA-N 0 0 397.434 3.211 20 5 GGBDRN COc1ccccc1CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000263981044 1434057288 /nfs/dbraw/zinc/05/72/88/1434057288.db2.gz CAYBZQNUEIBEJG-UHFFFAOYSA-N 0 0 376.434 3.306 20 5 GGBDRN COc1cc(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)c([N+](=O)[O-])cc1OC ZINC000264000610 1434060039 /nfs/dbraw/zinc/06/00/39/1434060039.db2.gz RBTGKTKJQNINME-APWZRJJASA-N 0 0 386.404 3.262 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](O)c2ccc(C)cc2)cc1SC ZINC000264007756 1434061326 /nfs/dbraw/zinc/06/13/26/1434061326.db2.gz DSXSDNDATVDJEK-OAHLLOKOSA-N 0 0 376.434 3.097 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC[C@H]2c2nc3ccccc3n2C)c(C)c1[N+](=O)[O-] ZINC000264017563 1434062474 /nfs/dbraw/zinc/06/24/74/1434062474.db2.gz WYUWPVDDPSNOFK-KRWDZBQOSA-N 0 0 396.451 3.049 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2C ZINC000264023158 1434063116 /nfs/dbraw/zinc/06/31/16/1434063116.db2.gz MSOXSWJKOITSBK-LLVKDONJSA-N 0 0 384.392 3.005 20 5 GGBDRN CCN(CC)C(=O)CCCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000264031498 1434064331 /nfs/dbraw/zinc/06/43/31/1434064331.db2.gz CGAJUDUJEHBLGY-UHFFFAOYSA-N 0 0 378.473 3.163 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC(c3nc(C)no3)CC2)cc1SC ZINC000264032999 1434064422 /nfs/dbraw/zinc/06/44/22/1434064422.db2.gz VSRBZEWAATWEHC-UHFFFAOYSA-N 0 0 392.437 3.037 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)COCC(F)(F)F ZINC000264038032 1434064809 /nfs/dbraw/zinc/06/48/09/1434064809.db2.gz FHVSGLMWRNFGOE-LBPRGKRZSA-N 0 0 377.363 3.482 20 5 GGBDRN CCOc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1OCC(=O)OC ZINC000264040657 1434065413 /nfs/dbraw/zinc/06/54/13/1434065413.db2.gz XTQRJWMVGUSXBQ-UHFFFAOYSA-N 0 0 388.376 3.106 20 5 GGBDRN CCOc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1OCC(=O)OC ZINC000264046470 1434066113 /nfs/dbraw/zinc/06/61/13/1434066113.db2.gz ZOJCKJQJLZOUMP-UHFFFAOYSA-N 0 0 388.376 3.106 20 5 GGBDRN CC(C)n1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1N(C)C ZINC000264060708 1434067747 /nfs/dbraw/zinc/06/77/47/1434067747.db2.gz PNOBVNOGOAZSIE-UHFFFAOYSA-N 0 0 389.441 3.176 20 5 GGBDRN 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ZINC000264155382 1434076511 /nfs/dbraw/zinc/07/65/11/1434076511.db2.gz HMEKEXSPMBPPIU-CYBMUJFWSA-N 0 0 382.380 3.044 20 5 GGBDRN Cc1c(C(=O)N2CCC(C3N=NC(=S)N3C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000264164181 1434077166 /nfs/dbraw/zinc/07/71/66/1434077166.db2.gz KSTBXDGPEOCWSC-UHFFFAOYSA-N 0 0 387.465 3.138 20 5 GGBDRN COc1cc(C(=O)NCCCc2nccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000264168381 1434077879 /nfs/dbraw/zinc/07/78/79/1434077879.db2.gz VKQARRNMPBPHJZ-UHFFFAOYSA-N 0 0 387.364 3.024 20 5 GGBDRN CC[C@H](C)[C@@H](C)N(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)C1CC1 ZINC000264175875 1434078374 /nfs/dbraw/zinc/07/83/74/1434078374.db2.gz LPZHUWZYWIUKFM-DZGCQCFKSA-N 0 0 398.463 3.488 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000264204486 1434081865 /nfs/dbraw/zinc/08/18/65/1434081865.db2.gz RLNVXVOPSUZQBU-UHFFFAOYSA-N 0 0 384.392 3.200 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000264208406 1434082357 /nfs/dbraw/zinc/08/23/57/1434082357.db2.gz 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ZINC000265336904 1434220581 /nfs/dbraw/zinc/22/05/81/1434220581.db2.gz HOFDYPJTMDBIIE-UHFFFAOYSA-N 0 0 399.838 3.083 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000265338483 1434220932 /nfs/dbraw/zinc/22/09/32/1434220932.db2.gz QINKZUFJPPNHFH-UHFFFAOYSA-N 0 0 390.749 3.208 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H](c2ncc[nH]2)C1 ZINC000265344012 1434221691 /nfs/dbraw/zinc/22/16/91/1434221691.db2.gz ISVOLURUJVVAAX-LBPRGKRZSA-N 0 0 378.816 3.146 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2cccc(C[S@@](=O)C3CCCCC3)c2)c1[N+](=O)[O-] ZINC000265350609 1434222969 /nfs/dbraw/zinc/22/29/69/1434222969.db2.gz SOYVSTSSNFYDDF-HHHXNRCGSA-N 0 0 390.465 3.460 20 5 GGBDRN COCC[C@@](C)(O)CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000265365753 1434225176 /nfs/dbraw/zinc/22/51/76/1434225176.db2.gz MDBPPYDKCKHKMY-LJQANCHMSA-N 0 0 389.408 3.296 20 5 GGBDRN CC(=O)N1CCCN(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000265411566 1434230992 /nfs/dbraw/zinc/23/09/92/1434230992.db2.gz YYOBCLUFQRHPLO-UHFFFAOYSA-N 0 0 398.419 3.473 20 5 GGBDRN CCOc1cc(CCCNC(=O)c2cc(OC)ccc2[N+](=O)[O-])ccc1OC ZINC000265426979 1434232996 /nfs/dbraw/zinc/23/29/96/1434232996.db2.gz DDINUZUYNWNJGA-UHFFFAOYSA-N 0 0 388.420 3.373 20 5 GGBDRN O=C(NCc1ccnc(OC2CCOCC2)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000265442722 1434235158 /nfs/dbraw/zinc/23/51/58/1434235158.db2.gz HLERFVQHFJVDDN-UHFFFAOYSA-N 0 0 391.811 3.131 20 5 GGBDRN COC1CCN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CC1 ZINC000265451888 1434235688 /nfs/dbraw/zinc/23/56/88/1434235688.db2.gz DBWXOWXJNBXVKS-UHFFFAOYSA-N 0 0 399.234 3.338 20 5 GGBDRN CCC[C@@H]1SCCN1C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000265458913 1434236273 /nfs/dbraw/zinc/23/62/73/1434236273.db2.gz PEBQHEFDHBWVER-AWEZNQCLSA-N 0 0 393.494 3.190 20 5 GGBDRN CSc1ccc(C(=O)c2ccccc2C(=O)NCC[C@H](C)O)cc1[N+](=O)[O-] ZINC000265465231 1434236913 /nfs/dbraw/zinc/23/69/13/1434236913.db2.gz CRWAZVGFLGCICM-LBPRGKRZSA-N 0 0 388.445 3.048 20 5 GGBDRN O=C(NCCc1cccs1)C1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000265477716 1434238080 /nfs/dbraw/zinc/23/80/80/1434238080.db2.gz BNGKCNIBKYLVIM-UHFFFAOYSA-N 0 0 394.884 3.280 20 5 GGBDRN O=C(Nc1cccc(CNc2ncc([N+](=O)[O-])cc2Cl)c1)[C@@H]1CCCO1 ZINC000265503285 1434240169 /nfs/dbraw/zinc/24/01/69/1434240169.db2.gz ISRJDORYTGMTEB-HNNXBMFYSA-N 0 0 376.800 3.373 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCCCC[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000265513337 1434241069 /nfs/dbraw/zinc/24/10/69/1434241069.db2.gz NHPPDUWDPWZXBZ-CQSZACIVSA-N 0 0 392.433 3.349 20 5 GGBDRN CCOC(=O)c1ccnc(Oc2ccc(C(=O)N3CCCC3)cc2)c1[N+](=O)[O-] ZINC000265536237 1434243572 /nfs/dbraw/zinc/24/35/72/1434243572.db2.gz CIJXLSZJWUXILM-UHFFFAOYSA-N 0 0 385.376 3.195 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](C)c2ccc3c(c2)CCC(=O)N3)c1[N+](=O)[O-] ZINC000265592515 1434249076 /nfs/dbraw/zinc/24/90/76/1434249076.db2.gz PSHRAMUOEYDCMR-LLVKDONJSA-N 0 0 384.392 3.224 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2c2ncon2)cc1SC ZINC000265599053 1434249425 /nfs/dbraw/zinc/24/94/25/1434249425.db2.gz HQJMJVIJEITSBL-LLVKDONJSA-N 0 0 378.410 3.076 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2c2ncon2)cc1SC ZINC000265599055 1434249460 /nfs/dbraw/zinc/24/94/60/1434249460.db2.gz HQJMJVIJEITSBL-NSHDSACASA-N 0 0 378.410 3.076 20 5 GGBDRN COC(=O)Nc1ccc(CCNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000265677322 1434255518 /nfs/dbraw/zinc/25/55/18/1434255518.db2.gz IHPLBMVWFSWECH-CYBMUJFWSA-N 0 0 386.408 3.376 20 5 GGBDRN CN(C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCN(C)C1=O ZINC000265679387 1434255933 /nfs/dbraw/zinc/25/59/33/1434255933.db2.gz BJPQOYBDKUNURL-KRWDZBQOSA-N 0 0 384.392 3.082 20 5 GGBDRN CC(C)(C(=O)N1CCC(NC(=O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000265681242 1434256075 /nfs/dbraw/zinc/25/60/75/1434256075.db2.gz BVNUBJAJSFAQCG-UHFFFAOYSA-N 0 0 395.459 3.293 20 5 GGBDRN CC(C)(C(=O)NCc1ccc(CN2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000265695108 1434257397 /nfs/dbraw/zinc/25/73/97/1434257397.db2.gz BRENABAJMRFOSV-UHFFFAOYSA-N 0 0 395.459 3.311 20 5 GGBDRN CC(C)(C(=O)Nc1cccc(OCCn2cncn2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000265693244 1434257460 /nfs/dbraw/zinc/25/74/60/1434257460.db2.gz AWLQYGASDHUHAW-UHFFFAOYSA-N 0 0 395.419 3.182 20 5 GGBDRN Cc1ccc(CN2CCOCC2)cc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000265699174 1434257936 /nfs/dbraw/zinc/25/79/36/1434257936.db2.gz SMWSOWQNJFSCAU-UHFFFAOYSA-N 0 0 394.431 3.469 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000265702697 1434258498 /nfs/dbraw/zinc/25/84/98/1434258498.db2.gz FHIOFCPHTQXEEC-OAHLLOKOSA-N 0 0 387.348 3.231 20 5 GGBDRN CCN(CC(=O)Nc1ccccc1OC)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265703054 1434258505 /nfs/dbraw/zinc/25/85/05/1434258505.db2.gz KWOABIPRMRLGTC-UHFFFAOYSA-N 0 0 399.447 3.368 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000265715182 1434259630 /nfs/dbraw/zinc/25/96/30/1434259630.db2.gz PKIIHDBHLUFGGC-UHFFFAOYSA-N 0 0 385.420 3.026 20 5 GGBDRN CC[C@H](C)[C@@H]1CCCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000265721497 1434260341 /nfs/dbraw/zinc/26/03/41/1434260341.db2.gz ZMHDZBGIRRSBFG-JSGCOSHPSA-N 0 0 381.860 3.405 20 5 GGBDRN CC(C)(C(=O)NCc1cccc(CN2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000265723681 1434260387 /nfs/dbraw/zinc/26/03/87/1434260387.db2.gz UDQGLFAQXYVFNK-UHFFFAOYSA-N 0 0 395.459 3.311 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000265743008 1434261800 /nfs/dbraw/zinc/26/18/00/1434261800.db2.gz CGHFISDAXHRSPV-UHFFFAOYSA-N 0 0 389.496 3.370 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2ccc(N3CCOC3=O)cc2)c([N+](=O)[O-])c1 ZINC000265750950 1434262441 /nfs/dbraw/zinc/26/24/41/1434262441.db2.gz YOAVBLOVERFIBE-UHFFFAOYSA-N 0 0 398.419 3.092 20 5 GGBDRN CN(C)C(=O)c1cccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000265756212 1434262856 /nfs/dbraw/zinc/26/28/56/1434262856.db2.gz IXBLRTOBABGXNY-UHFFFAOYSA-N 0 0 384.436 3.441 20 5 GGBDRN CC(=O)NCc1ccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000265776590 1434264350 /nfs/dbraw/zinc/26/43/50/1434264350.db2.gz FFFAYYRIZFWLFO-UHFFFAOYSA-N 0 0 384.436 3.375 20 5 GGBDRN CC(C)(C(=O)NCc1ccnc(OC2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000265804502 1434266682 /nfs/dbraw/zinc/26/66/82/1434266682.db2.gz WJLJJIUOPGENMR-UHFFFAOYSA-N 0 0 399.447 3.142 20 5 GGBDRN CCOc1cc(NC(=O)NC[C@@H](O)c2ccsc2)c([N+](=O)[O-])cc1OCC ZINC000265807263 1434266800 /nfs/dbraw/zinc/26/68/00/1434266800.db2.gz JBKFJHOUNCSVLV-CQSZACIVSA-N 0 0 395.437 3.309 20 5 GGBDRN C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@@H]1NC(=O)OC(C)(C)C ZINC000265810401 1434266993 /nfs/dbraw/zinc/26/69/93/1434266993.db2.gz SHYADGLYKPOOTP-WFASDCNBSA-N 0 0 378.429 3.362 20 5 GGBDRN CC(C)(C(=O)NCc1cccc(C(=O)NC2CC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000265815983 1434267845 /nfs/dbraw/zinc/26/78/45/1434267845.db2.gz ZKMGBDOLHKEBIL-UHFFFAOYSA-N 0 0 381.432 3.081 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2ccccc2OCC2CC2)cc1[N+](=O)[O-] ZINC000265830255 1434269687 /nfs/dbraw/zinc/26/96/87/1434269687.db2.gz WHRRUYVDKJHKSZ-UHFFFAOYSA-N 0 0 390.417 3.039 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCn2c(nnc2C(F)(F)F)C1 ZINC000265840074 1434271140 /nfs/dbraw/zinc/27/11/40/1434271140.db2.gz SFDRBMYDCPRQLT-UHFFFAOYSA-N 0 0 381.236 3.244 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000265840910 1434271192 /nfs/dbraw/zinc/27/11/92/1434271192.db2.gz DLDYHAAGEDRIAY-IUODEOHRSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1cccc(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000265842247 1434271441 /nfs/dbraw/zinc/27/14/41/1434271441.db2.gz DPSRHONKIFISSE-ZFWWWQNUSA-N 0 0 377.441 3.279 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCCN(c3ccccc3)C2)cc([N+](=O)[O-])c1OC ZINC000265852885 1434272878 /nfs/dbraw/zinc/27/28/78/1434272878.db2.gz BDQYWBYKGYVMHT-HNNXBMFYSA-N 0 0 385.420 3.011 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000265856892 1434273468 /nfs/dbraw/zinc/27/34/68/1434273468.db2.gz YJPSXGCFDBDCRQ-HNNXBMFYSA-N 0 0 385.468 3.451 20 5 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CC(C)c1n[nH]c(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c1[N+](=O)[O-] ZINC000269422720 1434643183 /nfs/dbraw/zinc/64/31/83/1434643183.db2.gz XUJGVDHCQFTLQP-LLVKDONJSA-N 0 0 385.424 3.281 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1OC(F)F ZINC000269426639 1434643753 /nfs/dbraw/zinc/64/37/53/1434643753.db2.gz YSNJXWSWTZIONY-UHFFFAOYSA-N 0 0 398.366 3.324 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c1[N+](=O)[O-] ZINC000269438374 1434645800 /nfs/dbraw/zinc/64/58/00/1434645800.db2.gz OWVFYRBVXWOHPI-CYBMUJFWSA-N 0 0 387.440 3.087 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@H](O)c1cccc(F)c1 ZINC000269457876 1434648545 /nfs/dbraw/zinc/64/85/45/1434648545.db2.gz VODXCCGAXJERTR-DJJJIMSYSA-N 0 0 387.411 3.186 20 5 GGBDRN Cc1nccn1-c1ccc(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1F ZINC000269471351 1434650529 /nfs/dbraw/zinc/65/05/29/1434650529.db2.gz UQVOKKOSVULCNN-UHFFFAOYSA-N 0 0 386.387 3.005 20 5 GGBDRN CCOCCOc1cc(C)ccc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000269481666 1434652269 /nfs/dbraw/zinc/65/22/69/1434652269.db2.gz KKJYXFBGSBATRD-UHFFFAOYSA-N 0 0 390.440 3.095 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000269510543 1434655043 /nfs/dbraw/zinc/65/50/43/1434655043.db2.gz OOZMXBVNJFOAAL-BXUZGUMPSA-N 0 0 376.388 3.183 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000269524797 1434656259 /nfs/dbraw/zinc/65/62/59/1434656259.db2.gz QZNWYCDXQSOTAF-GFCCVEGCSA-N 0 0 377.832 3.103 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)c1[N+](=O)[O-] ZINC000269541437 1434657817 /nfs/dbraw/zinc/65/78/17/1434657817.db2.gz VIAGXEADBUJMBG-RPHGYIDUSA-N 0 0 378.454 3.012 20 5 GGBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@@H](O)c1c(F)cccc1F ZINC000269574447 1434660540 /nfs/dbraw/zinc/66/05/40/1434660540.db2.gz QFBWDPNUXQQNNY-SUMWQHHRSA-N 0 0 380.347 3.124 20 5 GGBDRN 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ZINC000270121976 1434705367 /nfs/dbraw/zinc/70/53/67/1434705367.db2.gz MIZHOEPYUYEHCZ-CTNGQTDRSA-N 0 0 393.447 3.222 20 5 GGBDRN CC[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000270141084 1434707222 /nfs/dbraw/zinc/70/72/22/1434707222.db2.gz PJBCAUXBWANSKP-PKOBYXMFSA-N 0 0 397.410 3.432 20 5 GGBDRN CC(=O)Nc1ccc(S(=O)(=O)CCCOc2cccc(C)c2[N+](=O)[O-])cc1 ZINC000270147049 1434707438 /nfs/dbraw/zinc/70/74/38/1434707438.db2.gz WDNRVSMWTHDFCK-UHFFFAOYSA-N 0 0 392.433 3.104 20 5 GGBDRN COc1cccc(OC)c1OC[C@H](O)COc1ccc([N+](=O)[O-])cc1Cl ZINC000270145955 1434707514 /nfs/dbraw/zinc/70/75/14/1434707514.db2.gz VXHGHUZLLXUITI-GFCCVEGCSA-N 0 0 383.784 3.084 20 5 GGBDRN C[C@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc([S@@](C)=O)cc1 ZINC000270153762 1434707993 /nfs/dbraw/zinc/70/79/93/1434707993.db2.gz SOWGUUOENORNFM-MGYFDLHMSA-N 0 0 375.450 3.454 20 5 GGBDRN Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000270156647 1434708121 /nfs/dbraw/zinc/70/81/21/1434708121.db2.gz SVPNHDMIYWAQPI-AWEZNQCLSA-N 0 0 396.451 3.404 20 5 GGBDRN C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc([S@@](C)=O)cc1 ZINC000270170237 1434709100 /nfs/dbraw/zinc/70/91/00/1434709100.db2.gz VIWQTCXXULQWPX-BIXPNRAVSA-N 0 0 387.461 3.398 20 5 GGBDRN C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000270180355 1434710061 /nfs/dbraw/zinc/71/00/61/1434710061.db2.gz WSNRLOTWAHICNI-SRGMZFCMSA-N 0 0 375.450 3.012 20 5 GGBDRN COc1cccc(OC)c1OC[C@H](O)COc1c(Cl)cccc1[N+](=O)[O-] ZINC000270195505 1434711911 /nfs/dbraw/zinc/71/19/11/1434711911.db2.gz YTIMIZVEVZLVSI-LLVKDONJSA-N 0 0 383.784 3.084 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000270237111 1434715773 /nfs/dbraw/zinc/71/57/73/1434715773.db2.gz QWIPRWVIZNEUMK-CQSZACIVSA-N 0 0 390.403 3.126 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000270257791 1434717180 /nfs/dbraw/zinc/71/71/80/1434717180.db2.gz UTTFZSJYNYTOOS-OAHLLOKOSA-N 0 0 380.404 3.015 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000270299532 1434720902 /nfs/dbraw/zinc/72/09/02/1434720902.db2.gz YUKYEVSDLDRSDF-AWEZNQCLSA-N 0 0 377.441 3.248 20 5 GGBDRN CC[C@H](C)Oc1cccc(NC(=O)C(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000270310794 1434722029 /nfs/dbraw/zinc/72/20/29/1434722029.db2.gz HBORGZBUIXCMFB-AWEZNQCLSA-N 0 0 385.420 3.070 20 5 GGBDRN Cc1cc(C)c(NC(=O)CNC(=O)NCCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000270318770 1434722914 /nfs/dbraw/zinc/72/29/14/1434722914.db2.gz SZYBGLHFQGYCML-UHFFFAOYSA-N 0 0 384.436 3.000 20 5 GGBDRN CC1(C2CCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)CC2)OCCO1 ZINC000270345411 1434725087 /nfs/dbraw/zinc/72/50/87/1434725087.db2.gz OTRIBRPOIFHUCU-UHFFFAOYSA-N 0 0 391.468 3.102 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@H]1[C@@H](O)C(F)(F)F ZINC000270370690 1434727530 /nfs/dbraw/zinc/72/75/30/1434727530.db2.gz DAGDMDVIUIPASS-WDEREUQCSA-N 0 0 386.248 3.141 20 5 GGBDRN CC1(C)CCC(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])(C(N)=O)CC1 ZINC000270394855 1434729892 /nfs/dbraw/zinc/72/98/92/1434729892.db2.gz DHYXLTFGIWXJIR-UHFFFAOYSA-N 0 0 387.358 3.168 20 5 GGBDRN O=C(C[C@H]1CCCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccco1 ZINC000270404374 1434730806 /nfs/dbraw/zinc/73/08/06/1434730806.db2.gz PSWPXQURRQWMFQ-CQSZACIVSA-N 0 0 381.388 3.476 20 5 GGBDRN CCOc1cc(NC(=O)c2c(C)nc3ccnn3c2C)c([N+](=O)[O-])cc1OCC ZINC000270429643 1434732320 /nfs/dbraw/zinc/73/23/20/1434732320.db2.gz CSVWVVZTPCJUIT-UHFFFAOYSA-N 0 0 399.407 3.304 20 5 GGBDRN COCc1cc([N+](=O)[O-])ccc1N1CCC(C(=O)Nc2ccc(O)cc2)CC1 ZINC000270449730 1434734095 /nfs/dbraw/zinc/73/40/95/1434734095.db2.gz IHKDNIJEOJQZFT-UHFFFAOYSA-N 0 0 385.420 3.302 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000270456640 1434734770 /nfs/dbraw/zinc/73/47/70/1434734770.db2.gz ODUOLNBAIQDBNJ-MRXNPFEDSA-N 0 0 391.468 3.291 20 5 GGBDRN O=C(c1cccc([C@@H]2CCOC2)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000270470443 1434736371 /nfs/dbraw/zinc/73/63/71/1434736371.db2.gz HEOHTXIGCRGHEV-GOSISDBHSA-N 0 0 381.432 3.061 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCN(c2ncccc2F)CC1 ZINC000270473737 1434736551 /nfs/dbraw/zinc/73/65/51/1434736551.db2.gz GWCCZMZUHXNHJP-UHFFFAOYSA-N 0 0 379.779 3.136 20 5 GGBDRN COc1ccc(COCCCC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000270476216 1434736879 /nfs/dbraw/zinc/73/68/79/1434736879.db2.gz WXUAZSVWGUUXGU-UHFFFAOYSA-N 0 0 388.420 3.225 20 5 GGBDRN O=C(c1cc(N2CC[C@@H](OCc3ccccn3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000270475351 1434736941 /nfs/dbraw/zinc/73/69/41/1434736941.db2.gz ODGIYSWFIVPPOT-GOSISDBHSA-N 0 0 396.447 3.021 20 5 GGBDRN CC[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@H](c1ccc(C)cc1)n1cncn1 ZINC000270491096 1434738387 /nfs/dbraw/zinc/73/83/87/1434738387.db2.gz UUNVCCQFEXIGPD-MJGOQNOKSA-N 0 0 379.420 3.293 20 5 GGBDRN COc1cc(NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)c(F)cc1[N+](=O)[O-] ZINC000270500215 1434739233 /nfs/dbraw/zinc/73/92/33/1434739233.db2.gz 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/nfs/dbraw/zinc/85/50/47/1434855047.db2.gz SCIHIZHLQZOVIC-GFCCVEGCSA-N 0 0 393.403 3.015 20 5 GGBDRN CCn1c2ccc(C)cc2nc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000271856761 1434855215 /nfs/dbraw/zinc/85/52/15/1434855215.db2.gz JVLOHTULWNJBKJ-UHFFFAOYSA-N 0 0 382.376 3.296 20 5 GGBDRN C[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc2c(c1)CC(=O)N2C ZINC000271856991 1434855242 /nfs/dbraw/zinc/85/52/42/1434855242.db2.gz SPWOLMLAPVGLIS-GFCCVEGCSA-N 0 0 393.403 3.015 20 5 GGBDRN Cc1nc(-c2ccc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])cc2Cl)n[nH]1 ZINC000271866389 1434855789 /nfs/dbraw/zinc/85/57/89/1434855789.db2.gz BDWSZTVJCZMJFW-UHFFFAOYSA-N 0 0 389.803 3.441 20 5 GGBDRN CC(C)[C@H](O)C1(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 ZINC000271887867 1434857341 /nfs/dbraw/zinc/85/73/41/1434857341.db2.gz OCIYQPHVFXTIEL-QFIPXVFZSA-N 0 0 378.472 3.068 20 5 GGBDRN CC(C)[C@@H](O)C1(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 ZINC000271887864 1434857361 /nfs/dbraw/zinc/85/73/61/1434857361.db2.gz OCIYQPHVFXTIEL-JOCHJYFZSA-N 0 0 378.472 3.068 20 5 GGBDRN Cc1cc(N(C)C)ccc1NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000271908740 1434858625 /nfs/dbraw/zinc/85/86/25/1434858625.db2.gz RQKYIHLJEXHHKD-UHFFFAOYSA-N 0 0 384.436 3.058 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000271940281 1434860735 /nfs/dbraw/zinc/86/07/35/1434860735.db2.gz ROGWPDNCHMZGBW-MAUKXSAKSA-N 0 0 396.321 3.037 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1([C@@H](C)CCO)CCC1 ZINC000271942680 1434860888 /nfs/dbraw/zinc/86/08/88/1434860888.db2.gz WXKPPGPSHKVMEE-AWEZNQCLSA-N 0 0 396.509 3.252 20 5 GGBDRN CC(=O)c1ccc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)nc1C ZINC000271999949 1434864919 /nfs/dbraw/zinc/86/49/19/1434864919.db2.gz JYPPUITZJFGETM-UHFFFAOYSA-N 0 0 382.420 3.349 20 5 GGBDRN COc1c(Cl)cccc1NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000272047603 1434868611 /nfs/dbraw/zinc/86/86/11/1434868611.db2.gz YWODIRMMEYOUNV-UHFFFAOYSA-N 0 0 391.811 3.346 20 5 GGBDRN C[C@H](Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)[C@@H]1CCCCO1 ZINC000272053586 1434869084 /nfs/dbraw/zinc/86/90/84/1434869084.db2.gz XZOGXWPCZWXGMA-NHYWBVRUSA-N 0 0 378.816 3.164 20 5 GGBDRN CC(=O)N(c1nc(Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)cs1)C1CC1 ZINC000272072949 1434870412 /nfs/dbraw/zinc/87/04/12/1434870412.db2.gz CTFGWTWVCMAIPV-UHFFFAOYSA-N 0 0 383.433 3.478 20 5 GGBDRN CC(C)(C)[C@@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H]1O ZINC000272081382 1434870814 /nfs/dbraw/zinc/87/08/14/1434870814.db2.gz JKGPUWYZWRXFEO-VQIMIIECSA-N 0 0 389.496 3.067 20 5 GGBDRN CC(C)(C)[C@@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@@H]1O ZINC000272081376 1434870858 /nfs/dbraw/zinc/87/08/58/1434870858.db2.gz JKGPUWYZWRXFEO-APWZRJJASA-N 0 0 389.496 3.067 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)CCO1 ZINC000272086301 1434871329 /nfs/dbraw/zinc/87/13/29/1434871329.db2.gz CCBUSVIHTJQJSB-ZBFHGGJFSA-N 0 0 380.441 3.326 20 5 GGBDRN COc1cc(C(=O)N[C@@H](C)[C@@H](OC)c2ccccc2F)c([N+](=O)[O-])cc1OC ZINC000272087194 1434871336 /nfs/dbraw/zinc/87/13/36/1434871336.db2.gz XFZLTRIAKBHMEH-BBATYDOGSA-N 0 0 392.383 3.257 20 5 GGBDRN CC(=O)NC1(c2noc(C(F)(F)c3ccc([N+](=O)[O-])cc3)n2)CCCCC1 ZINC000272116693 1434873134 /nfs/dbraw/zinc/87/31/34/1434873134.db2.gz QNBLRDTYPYLYBN-UHFFFAOYSA-N 0 0 380.351 3.413 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cc(OCC(F)F)ccn1 ZINC000272133629 1434874113 /nfs/dbraw/zinc/87/41/13/1434874113.db2.gz XNMCREDBWFWMQO-UHFFFAOYSA-N 0 0 395.318 3.047 20 5 GGBDRN CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000272145129 1434874697 /nfs/dbraw/zinc/87/46/97/1434874697.db2.gz BWWSFEWVKWKWEQ-UKRRQHHQSA-N 0 0 395.887 3.192 20 5 GGBDRN C[C@@H](NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000272144558 1434874737 /nfs/dbraw/zinc/87/47/37/1434874737.db2.gz BIIWHUONAMBOKL-LLVKDONJSA-N 0 0 389.358 3.083 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000272147053 1434874915 /nfs/dbraw/zinc/87/49/15/1434874915.db2.gz CONBXGGBSONBCW-DZGCQCFKSA-N 0 0 392.456 3.040 20 5 GGBDRN COCC[C@@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccc(C)o1 ZINC000272156283 1434875335 /nfs/dbraw/zinc/87/53/35/1434875335.db2.gz FCNXBWZAFMPSFL-OAHLLOKOSA-N 0 0 377.397 3.082 20 5 GGBDRN Cc1nccn1CCCCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272160883 1434875553 /nfs/dbraw/zinc/87/55/53/1434875553.db2.gz ANRNQGPDXUPJTD-UHFFFAOYSA-N 0 0 379.848 3.075 20 5 GGBDRN COc1ccc(C(C)=O)cc1CC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272176219 1434876204 /nfs/dbraw/zinc/87/62/04/1434876204.db2.gz RKSSRVVNCJIVRB-UHFFFAOYSA-N 0 0 390.823 3.361 20 5 GGBDRN CCN(C)C(=O)c1cccc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000272180076 1434876409 /nfs/dbraw/zinc/87/64/09/1434876409.db2.gz SKPXMZCZSKNRTE-UHFFFAOYSA-N 0 0 389.839 3.313 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC[C@H]2CC(=O)c2cccs2)c([N+](=O)[O-])c1 ZINC000272191938 1434877126 /nfs/dbraw/zinc/87/71/26/1434877126.db2.gz FJXIENLVEFWWMI-LBPRGKRZSA-N 0 0 394.474 3.302 20 5 GGBDRN COCCNc1ccccc1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272192170 1434877144 /nfs/dbraw/zinc/87/71/44/1434877144.db2.gz KQJMGHBUYSPJAJ-UHFFFAOYSA-N 0 0 379.363 3.061 20 5 GGBDRN O=C(Nc1ccccc1C(=O)N1CCCCC1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272206377 1434878015 /nfs/dbraw/zinc/87/80/15/1434878015.db2.gz HFCFZDOCXAVZHT-UHFFFAOYSA-N 0 0 397.387 3.202 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 ZINC000272208836 1434878131 /nfs/dbraw/zinc/87/81/31/1434878131.db2.gz CETJPBMZRAGLRG-XJKSGUPXSA-N 0 0 380.441 3.326 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000272208102 1434878219 /nfs/dbraw/zinc/87/82/19/1434878219.db2.gz DZLPQQOYZQHTDP-VXGBXAGGSA-N 0 0 381.404 3.109 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272233086 1434880104 /nfs/dbraw/zinc/88/01/04/1434880104.db2.gz PQPMYQQJDDEAMZ-UHFFFAOYSA-N 0 0 392.284 3.104 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](CCOC)c2ccc(C)o2)cc1OC ZINC000272236547 1434880596 /nfs/dbraw/zinc/88/05/96/1434880596.db2.gz GMFITRKPMVQZGD-CQSZACIVSA-N 0 0 392.408 3.411 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000272243006 1434880944 /nfs/dbraw/zinc/88/09/44/1434880944.db2.gz KZZHFBVJWDIFGQ-GHMZBOCLSA-N 0 0 381.458 3.044 20 5 GGBDRN O=C(N[C@H]1CCCOc2c(F)cccc21)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000272249434 1434881576 /nfs/dbraw/zinc/88/15/76/1434881576.db2.gz HVGHTUCLEAAYAK-AWEZNQCLSA-N 0 0 388.351 3.149 20 5 GGBDRN COc1cc(CNCc2ccc3c(c2)OCO3)c([N+](=O)[O-])cc1OCC(F)F ZINC000272251531 1434881845 /nfs/dbraw/zinc/88/18/45/1434881845.db2.gz CDBOEXCSWMBHOH-UHFFFAOYSA-N 0 0 396.346 3.266 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000272254207 1434881990 /nfs/dbraw/zinc/88/19/90/1434881990.db2.gz TXACIVSSNWMTSC-NSHDSACASA-N 0 0 398.385 3.433 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)cccc1[N+](=O)[O-] ZINC000272265667 1434882801 /nfs/dbraw/zinc/88/28/01/1434882801.db2.gz REDVSLPGFXZRQD-AWEZNQCLSA-N 0 0 398.467 3.363 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCO[C@@H](c2ccccc2)C1 ZINC000272277288 1434883611 /nfs/dbraw/zinc/88/36/11/1434883611.db2.gz OGVNLFZXVYDLFB-MRXNPFEDSA-N 0 0 378.331 3.410 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)cc([N+](=O)[O-])c1 ZINC000272281897 1434884049 /nfs/dbraw/zinc/88/40/49/1434884049.db2.gz IOGQPTFMCOOBMX-UONOGXRCSA-N 0 0 377.441 3.279 20 5 GGBDRN O=C(C[C@H]1CCCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1cccs1 ZINC000272287769 1434884390 /nfs/dbraw/zinc/88/43/90/1434884390.db2.gz GTGKJABWWSNAGQ-GFCCVEGCSA-N 0 0 388.401 3.263 20 5 GGBDRN CC(C)n1cnnc1C1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1 ZINC000272296442 1434885144 /nfs/dbraw/zinc/88/51/44/1434885144.db2.gz QAYDVRXLCKELSM-UHFFFAOYSA-N 0 0 398.467 3.043 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272298011 1434885182 /nfs/dbraw/zinc/88/51/82/1434885182.db2.gz IEYAMNNJZZTWHH-UHFFFAOYSA-N 0 0 399.403 3.041 20 5 GGBDRN C[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccc(NC(=O)C2CC2)cc1 ZINC000272304077 1434885784 /nfs/dbraw/zinc/88/57/84/1434885784.db2.gz QWPYCDPZGGLLBO-NSHDSACASA-N 0 0 397.387 3.163 20 5 GGBDRN Nc1ccc(C(=O)N2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000272302417 1434885807 /nfs/dbraw/zinc/88/58/07/1434885807.db2.gz WYVGPILLYAJZGN-HNNXBMFYSA-N 0 0 398.467 3.363 20 5 GGBDRN Cc1cccc(N2C(=O)N[C@@H](CCC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2=O)c1 ZINC000272308837 1434886195 /nfs/dbraw/zinc/88/61/95/1434886195.db2.gz SQYJVOGWCINTOM-INIZCTEOSA-N 0 0 396.403 3.055 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000272316381 1434886846 /nfs/dbraw/zinc/88/68/46/1434886846.db2.gz SQYMGOGKUAYOMG-NEPJUHHUSA-N 0 0 381.404 3.109 20 5 GGBDRN C[C@@H](O)C[C@@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000272332177 1434887781 /nfs/dbraw/zinc/88/77/81/1434887781.db2.gz LTMZJNNZNZRUGL-HIFRSBDPSA-N 0 0 378.375 3.358 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1 ZINC000272340716 1434888538 /nfs/dbraw/zinc/88/85/38/1434888538.db2.gz NETLKXDDSSNCOX-NSHDSACASA-N 0 0 384.417 3.238 20 5 GGBDRN CNC(=O)c1ccc(N2CCC(n3ccc(C(F)(F)F)n3)CC2)c([N+](=O)[O-])c1 ZINC000272344368 1434888964 /nfs/dbraw/zinc/88/89/64/1434888964.db2.gz XKRPHEQBSRVCQW-UHFFFAOYSA-N 0 0 397.357 3.011 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000272353330 1434889792 /nfs/dbraw/zinc/88/97/92/1434889792.db2.gz RBOYZMLRISIMQB-PBHICJAKSA-N 0 0 399.900 3.145 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CCO[C@@]2(CCSC2)C1 ZINC000272354555 1434889831 /nfs/dbraw/zinc/88/98/31/1434889831.db2.gz RBOYZMLRISIMQB-YOEHRIQHSA-N 0 0 399.900 3.145 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000272356117 1434889977 /nfs/dbraw/zinc/88/99/77/1434889977.db2.gz RLRZZONMLPONKL-OCCSQVGLSA-N 0 0 390.417 3.113 20 5 GGBDRN Cc1c(CC(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000272362286 1434890438 /nfs/dbraw/zinc/89/04/38/1434890438.db2.gz SHIKIDCZRGDXJN-ZBFHGGJFSA-N 0 0 391.468 3.207 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H](CCO)c1ccccc1 ZINC000272372099 1434891163 /nfs/dbraw/zinc/89/11/63/1434891163.db2.gz UMHWCYHTCMZJQF-INIZCTEOSA-N 0 0 391.855 3.256 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H](CCO)c1ccccc1 ZINC000272372100 1434891165 /nfs/dbraw/zinc/89/11/65/1434891165.db2.gz UMHWCYHTCMZJQF-MRXNPFEDSA-N 0 0 391.855 3.256 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cc2c([nH]c1=O)CCCC2 ZINC000272380941 1434892255 /nfs/dbraw/zinc/89/22/55/1434892255.db2.gz YMCVKWUURSETAL-UHFFFAOYSA-N 0 0 375.812 3.200 20 5 GGBDRN Cc1noc(C2CCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000272393044 1434893337 /nfs/dbraw/zinc/89/33/37/1434893337.db2.gz XATYOYHFORJAMZ-UHFFFAOYSA-N 0 0 393.831 3.071 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000272426172 1434895431 /nfs/dbraw/zinc/89/54/31/1434895431.db2.gz NKHQWZOFDNZXCC-CHWSQXEVSA-N 0 0 378.429 3.362 20 5 GGBDRN Cc1nc2sccn2c1CN(C)C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272424288 1434895444 /nfs/dbraw/zinc/89/54/44/1434895444.db2.gz XVYSSBIIRPVRJI-UHFFFAOYSA-N 0 0 380.376 3.363 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1c1nnc2n1CCCC2 ZINC000272432033 1434895868 /nfs/dbraw/zinc/89/58/68/1434895868.db2.gz DBTWTPOSRGPAAH-KRWDZBQOSA-N 0 0 398.467 3.002 20 5 GGBDRN COc1ccc(CNC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000272456954 1434897618 /nfs/dbraw/zinc/89/76/18/1434897618.db2.gz ULIDWTOKROMXTB-MRXNPFEDSA-N 0 0 385.420 3.214 20 5 GGBDRN Cc1c(C(=O)N2CC[C@@H](COc3ccccc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000272463351 1434898040 /nfs/dbraw/zinc/89/80/40/1434898040.db2.gz CVIIHMFSHJEAKS-CQSZACIVSA-N 0 0 385.376 3.353 20 5 GGBDRN Cc1c(C(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000272466508 1434898260 /nfs/dbraw/zinc/89/82/60/1434898260.db2.gz KWPDZTFJCMQEBF-KBPBESRZSA-N 0 0 377.441 3.279 20 5 GGBDRN Cc1ccc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1C(=O)NC(C)C ZINC000272469183 1434898508 /nfs/dbraw/zinc/89/85/08/1434898508.db2.gz SSFDSYCCILZCAX-UHFFFAOYSA-N 0 0 385.376 3.022 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCCOc3c(F)cccc32)c([N+](=O)[O-])cc1OC ZINC000272468368 1434898550 /nfs/dbraw/zinc/89/85/50/1434898550.db2.gz FFOCELIDMABDJZ-AWEZNQCLSA-N 0 0 390.367 3.395 20 5 GGBDRN COc1ccc(OC)c(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272474268 1434898893 /nfs/dbraw/zinc/89/88/93/1434898893.db2.gz AXWYMXFPLDEWMI-LJQANCHMSA-N 0 0 382.420 3.225 20 5 GGBDRN COc1cccc(OCCCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272492171 1434900196 /nfs/dbraw/zinc/90/01/96/1434900196.db2.gz DZWKTQRQJFLJJL-FQEVSTJZSA-N 0 0 396.447 3.485 20 5 GGBDRN CN(C)[C@@H](CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000272496123 1434900510 /nfs/dbraw/zinc/90/05/10/1434900510.db2.gz FYKOWRMNCATXFA-ZWKOTPCHSA-N 0 0 385.493 3.372 20 5 GGBDRN CN(C)[C@H](CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000272496107 1434900539 /nfs/dbraw/zinc/90/05/39/1434900539.db2.gz FYKOWRMNCATXFA-MSOLQXFVSA-N 0 0 385.493 3.372 20 5 GGBDRN CCCOc1ccc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000272496003 1434900647 /nfs/dbraw/zinc/90/06/47/1434900647.db2.gz FWJVAWMMTYRMAF-LJQANCHMSA-N 0 0 381.436 3.391 20 5 GGBDRN COc1ccc(O[C@H](C)CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272498650 1434900809 /nfs/dbraw/zinc/90/08/09/1434900809.db2.gz GHZLDXBZACUTSE-FOIQADDNSA-N 0 0 396.447 3.483 20 5 GGBDRN COc1ccc(O[C@@H](C)CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272498667 1434901000 /nfs/dbraw/zinc/90/10/00/1434901000.db2.gz GHZLDXBZACUTSE-YWZLYKJASA-N 0 0 396.447 3.483 20 5 GGBDRN CO[C@@H](C)c1nc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000272518972 1434903336 /nfs/dbraw/zinc/90/33/36/1434903336.db2.gz KVJSGYXJVXPVHB-BLLLJJGKSA-N 0 0 387.465 3.371 20 5 GGBDRN O=C(NCCCOCCOCc1ccccc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000272533284 1434904926 /nfs/dbraw/zinc/90/49/26/1434904926.db2.gz KFTTUWBJDAZVQO-UHFFFAOYSA-N 0 0 376.384 3.087 20 5 GGBDRN COc1cccc(O[C@H](C)CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272537910 1434905517 /nfs/dbraw/zinc/90/55/17/1434905517.db2.gz OKBZJHKSODAMKZ-QRWLVFNGSA-N 0 0 396.447 3.483 20 5 GGBDRN C[NH+]1CCC2(CC1)C[C@H](NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)c1ccccc1O2 ZINC000272572579 1434909169 /nfs/dbraw/zinc/90/91/69/1434909169.db2.gz NFJCCSZLIQDPSG-SFHVURJKSA-N 0 0 397.431 3.018 20 5 GGBDRN COc1ccc(CCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000272576406 1434909784 /nfs/dbraw/zinc/90/97/84/1434909784.db2.gz XFEWQSFVFICQAN-HXUWFJFHSA-N 0 0 396.447 3.267 20 5 GGBDRN CC(C)n1cnnc1C1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272601123 1434913437 /nfs/dbraw/zinc/91/34/37/1434913437.db2.gz VCIGCDFGYBWJSG-UHFFFAOYSA-N 0 0 393.394 3.265 20 5 GGBDRN CC(C)Oc1cc(F)ccc1NC(=O)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000272603596 1434913708 /nfs/dbraw/zinc/91/37/08/1434913708.db2.gz JJBJDTVHQHLTSR-UHFFFAOYSA-N 0 0 389.383 3.118 20 5 GGBDRN COc1cc(CNc2ccc3c(c2)C(=O)NC3)c([N+](=O)[O-])cc1OCC(F)F ZINC000272607716 1434914490 /nfs/dbraw/zinc/91/44/90/1434914490.db2.gz JWANIIRYDLYDBW-UHFFFAOYSA-N 0 0 393.346 3.103 20 5 GGBDRN CN(C[C@H]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000272641441 1434918639 /nfs/dbraw/zinc/91/86/39/1434918639.db2.gz CGTJIWSMSOETGF-CYBMUJFWSA-N 0 0 393.444 3.101 20 5 GGBDRN O=[N+]([O-])c1ccc(OCc2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)cc1 ZINC000272675955 1434921762 /nfs/dbraw/zinc/92/17/62/1434921762.db2.gz RDTZIRUSNVAZID-SFHVURJKSA-N 0 0 396.403 3.130 20 5 GGBDRN CC(C)[C@@H]1C[C@H](CC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)CCO1 ZINC000272690287 1434923160 /nfs/dbraw/zinc/92/31/60/1434923160.db2.gz DFKSNVSZDKWUND-APWZRJJASA-N 0 0 375.469 3.085 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](CCOC)c2ccco2)cc1OC ZINC000272692391 1434923339 /nfs/dbraw/zinc/92/33/39/1434923339.db2.gz OAWVWVVASPFQCZ-ZDUSSCGKSA-N 0 0 378.381 3.103 20 5 GGBDRN COCC[C@H](NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)c1ccco1 ZINC000272710109 1434924959 /nfs/dbraw/zinc/92/49/59/1434924959.db2.gz RITSJZGCFXPLOJ-ZDUSSCGKSA-N 0 0 377.353 3.220 20 5 GGBDRN CC(C)N1CCO[C@H](c2noc(-c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)C1 ZINC000272717044 1434925664 /nfs/dbraw/zinc/92/56/64/1434925664.db2.gz YVMJNMALLRTPHW-KRWDZBQOSA-N 0 0 387.440 3.027 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CCOC)c1ccco1 ZINC000272724241 1434926047 /nfs/dbraw/zinc/92/60/47/1434926047.db2.gz UFRAWBVPUJRDFP-HNNXBMFYSA-N 0 0 394.449 3.434 20 5 GGBDRN COc1ccc(CN(C(=O)Nc2ccncc2[N+](=O)[O-])[C@H](CO)C(C)C)cc1 ZINC000272722891 1434926139 /nfs/dbraw/zinc/92/61/39/1434926139.db2.gz NEZHICHBZWQUJL-GOSISDBHSA-N 0 0 388.424 3.049 20 5 GGBDRN CN(CC1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1)C(=O)OC(C)(C)C ZINC000272740849 1434927344 /nfs/dbraw/zinc/92/73/44/1434927344.db2.gz QWJSWXYEPAQDGP-UHFFFAOYSA-N 0 0 393.444 3.101 20 5 GGBDRN COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000272756721 1434928546 /nfs/dbraw/zinc/92/85/46/1434928546.db2.gz UTVIJMBIINKCOB-HNNXBMFYSA-N 0 0 386.408 3.212 20 5 GGBDRN COc1ccc(NC(=O)C2CCC(NC(=O)C3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000272763046 1434929002 /nfs/dbraw/zinc/92/90/02/1434929002.db2.gz CTOVPVMHVIPFMD-UHFFFAOYSA-N 0 0 389.452 3.407 20 5 GGBDRN COc1ccc(NC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)cc1[N+](=O)[O-] ZINC000272766961 1434929460 /nfs/dbraw/zinc/92/94/60/1434929460.db2.gz BHYZPYBCNQPPEA-QGZVFWFLSA-N 0 0 389.408 3.246 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000272779555 1434930568 /nfs/dbraw/zinc/93/05/68/1434930568.db2.gz DPJCBCBXKUFENK-UHFFFAOYSA-N 0 0 392.456 3.106 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000272787438 1434931105 /nfs/dbraw/zinc/93/11/05/1434931105.db2.gz SREPZTLTRFJELB-UHFFFAOYSA-N 0 0 379.457 3.294 20 5 GGBDRN COc1ccc(NC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)cc1[N+](=O)[O-] ZINC000272794106 1434931519 /nfs/dbraw/zinc/93/15/19/1434931519.db2.gz GRHRUDQFZMALSB-LLVKDONJSA-N 0 0 384.392 3.005 20 5 GGBDRN COc1ccc(NC(=O)N(Cc2ccco2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000272795847 1434931643 /nfs/dbraw/zinc/93/16/43/1434931643.db2.gz GVZOALLYJCZGAL-OAHLLOKOSA-N 0 0 375.381 3.410 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2CCCN2c2ncnc3sccc32)cc1[N+](=O)[O-] ZINC000272805935 1434932185 /nfs/dbraw/zinc/93/21/85/1434932185.db2.gz MANPFQPHPMTFCU-CYBMUJFWSA-N 0 0 399.432 3.216 20 5 GGBDRN COCCOCc1cc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)ccc1F ZINC000272808812 1434932376 /nfs/dbraw/zinc/93/23/76/1434932376.db2.gz MQTMWROAFJZYSM-UHFFFAOYSA-N 0 0 378.356 3.158 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000272811433 1434932851 /nfs/dbraw/zinc/93/28/51/1434932851.db2.gz NBHRBQSZBNWFQW-KGLIPLIRSA-N 0 0 393.415 3.348 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000272813072 1434932914 /nfs/dbraw/zinc/93/29/14/1434932914.db2.gz JRBKQBGSAOBIOB-LBPRGKRZSA-N 0 0 386.412 3.010 20 5 GGBDRN Cc1cc(NC(=O)[C@@H](C)SCC(=O)OCc2ccc([N+](=O)[O-])c(C)c2)no1 ZINC000272818211 1434933551 /nfs/dbraw/zinc/93/35/51/1434933551.db2.gz WXWYTGPMRDVIAV-GFCCVEGCSA-N 0 0 393.421 3.003 20 5 GGBDRN CC(C)(C)OC(=O)NCCCCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272823118 1434933878 /nfs/dbraw/zinc/93/38/78/1434933878.db2.gz XKOGTLPEVWVTEE-UHFFFAOYSA-N 0 0 387.383 3.108 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272837872 1434934976 /nfs/dbraw/zinc/93/49/76/1434934976.db2.gz NXFVBDVYAXXWGW-ZIAGYGMSSA-N 0 0 392.456 3.152 20 5 GGBDRN COc1ccc(NC(=O)N2CCN(C(C)=O)C3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000272839326 1434935056 /nfs/dbraw/zinc/93/50/56/1434935056.db2.gz OEEDXWQUHORHOD-UHFFFAOYSA-N 0 0 390.440 3.002 20 5 GGBDRN COc1ccc(NC(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)cc1[N+](=O)[O-] ZINC000272842434 1434935168 /nfs/dbraw/zinc/93/51/68/1434935168.db2.gz OVPHIAUTYFSDLS-GOSISDBHSA-N 0 0 385.420 3.408 20 5 GGBDRN COc1ccc(NC(=O)CCc2c(C)nc(SC)nc2C)cc1[N+](=O)[O-] ZINC000272851076 1434936008 /nfs/dbraw/zinc/93/60/08/1434936008.db2.gz VPAZFMLDEKZWFM-UHFFFAOYSA-N 0 0 376.438 3.303 20 5 GGBDRN COc1ccc(NC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000272851521 1434936057 /nfs/dbraw/zinc/93/60/57/1434936057.db2.gz QIAHENRDCDJMPO-UHFFFAOYSA-N 0 0 398.419 3.486 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000272854323 1434936213 /nfs/dbraw/zinc/93/62/13/1434936213.db2.gz IEVSZAUFAHRTTG-SFHVURJKSA-N 0 0 383.404 3.118 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H]2CC(C)(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000272860504 1434936625 /nfs/dbraw/zinc/93/66/25/1434936625.db2.gz IWMFQWHXEKNWBC-OAHLLOKOSA-N 0 0 383.404 3.081 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H]2CC(C)(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000272860503 1434936650 /nfs/dbraw/zinc/93/66/50/1434936650.db2.gz IWMFQWHXEKNWBC-HNNXBMFYSA-N 0 0 383.404 3.081 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N(C)[C@H](C)c2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000272860535 1434936660 /nfs/dbraw/zinc/93/66/60/1434936660.db2.gz IYMCZXOCBSEYDB-CQSZACIVSA-N 0 0 385.420 3.378 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H](c2ccccc2)C2CCC2)cc1[N+](=O)[O-] ZINC000272864865 1434937156 /nfs/dbraw/zinc/93/71/56/1434937156.db2.gz JOKCCFWFPWZETQ-GOSISDBHSA-N 0 0 383.404 3.200 20 5 GGBDRN COc1ccc(NC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000272865591 1434937227 /nfs/dbraw/zinc/93/72/27/1434937227.db2.gz SUUAUQOQQBGHEE-QGZVFWFLSA-N 0 0 375.356 3.348 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@H]2C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000272868374 1434937552 /nfs/dbraw/zinc/93/75/52/1434937552.db2.gz UATJTROOTYVGKE-DZGCQCFKSA-N 0 0 375.381 3.316 20 5 GGBDRN C[C@H]1CN(c2ccc(Nc3sc(S(C)(=O)=O)cc3[N+](=O)[O-])cc2)CCO1 ZINC000272881247 1434938437 /nfs/dbraw/zinc/93/84/37/1434938437.db2.gz VKLMAAOFSSWMSQ-NSHDSACASA-N 0 0 397.478 3.029 20 5 GGBDRN CC(C)Oc1cccc([C@@H](C)Nc2cc([N+](=O)[O-])ccc2S(N)(=O)=O)c1 ZINC000272887197 1434938672 /nfs/dbraw/zinc/93/86/72/1434938672.db2.gz ILNDCFVLYMCZGI-GFCCVEGCSA-N 0 0 379.438 3.203 20 5 GGBDRN COc1ccc(NC(=O)NCCCCNC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000272891289 1434939055 /nfs/dbraw/zinc/93/90/55/1434939055.db2.gz YPWAJTIKKGHICK-UHFFFAOYSA-N 0 0 382.417 3.030 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H](c2ccccc2C)C2CC2)cc1[N+](=O)[O-] ZINC000272941400 1434942703 /nfs/dbraw/zinc/94/27/03/1434942703.db2.gz PDEUAURFFVKJMD-GOSISDBHSA-N 0 0 383.404 3.118 20 5 GGBDRN CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000272975167 1434945575 /nfs/dbraw/zinc/94/55/75/1434945575.db2.gz SJBKGLWLLBUWQW-YPMHNXCESA-N 0 0 399.900 3.104 20 5 GGBDRN COc1cc(CCNC(=O)C[C@@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000272983897 1434946988 /nfs/dbraw/zinc/94/69/88/1434946988.db2.gz RUUJCPHQILZTAG-RHSMWYFYSA-N 0 0 394.468 3.112 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000273010780 1434949864 /nfs/dbraw/zinc/94/98/64/1434949864.db2.gz ZAMZRZMVIXCWJB-GFCCVEGCSA-N 0 0 391.346 3.025 20 5 GGBDRN Cc1cccc([C@H]2CCN(C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)C2)c1 ZINC000273032398 1434952936 /nfs/dbraw/zinc/95/29/36/1434952936.db2.gz CHPIXWITPIDCOV-KRWDZBQOSA-N 0 0 377.404 3.114 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCCC(=O)N2)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000273064980 1434956845 /nfs/dbraw/zinc/95/68/45/1434956845.db2.gz DPSXIWUAYHRPHG-GOSISDBHSA-N 0 0 394.387 3.001 20 5 GGBDRN Cc1nnc([C@H]2CCCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C2)[nH]1 ZINC000273101690 1434961034 /nfs/dbraw/zinc/96/10/34/1434961034.db2.gz AQSXFFMZAGAMAN-NSHDSACASA-N 0 0 395.872 3.173 20 5 GGBDRN O=C(c1ccccc1)c1ccc(N2CCOCC3(CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000273126269 1434964365 /nfs/dbraw/zinc/96/43/65/1434964365.db2.gz HYNPLZOURXDDFT-UHFFFAOYSA-N 0 0 396.443 3.459 20 5 GGBDRN COC(=O)c1ccc(OCC2CCN(C(=O)C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000273134409 1434965193 /nfs/dbraw/zinc/96/51/93/1434965193.db2.gz RLVXFRCGVSETIR-UHFFFAOYSA-N 0 0 378.425 3.045 20 5 GGBDRN Cc1cccc([C@@H]2CCN(C(=O)CSc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000273158505 1434967468 /nfs/dbraw/zinc/96/74/68/1434967468.db2.gz ZEPWPCYQLXMFMF-MRXNPFEDSA-N 0 0 399.472 3.110 20 5 GGBDRN Cc1nc(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])ccc1[C@H](C)O ZINC000273168866 1434968378 /nfs/dbraw/zinc/96/83/78/1434968378.db2.gz CEQHPEYSXSDBMR-NSHDSACASA-N 0 0 395.868 3.413 20 5 GGBDRN C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)c1nccs1 ZINC000273191598 1434971086 /nfs/dbraw/zinc/97/10/86/1434971086.db2.gz CXTPVSBLTNIBCJ-LBPRGKRZSA-N 0 0 396.494 3.051 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273218033 1434973250 /nfs/dbraw/zinc/97/32/50/1434973250.db2.gz BLSUFCNOMJMMBS-IEBWSBKVSA-N 0 0 387.411 3.496 20 5 GGBDRN C[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)c(F)c1 ZINC000273226791 1434973717 /nfs/dbraw/zinc/97/37/17/1434973717.db2.gz VQBFLNDDZAXUFD-SNVBAGLBSA-N 0 0 388.367 3.137 20 5 GGBDRN CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273257621 1434976152 /nfs/dbraw/zinc/97/61/52/1434976152.db2.gz FFMMHOIJIADBTI-LPHOPBHVSA-N 0 0 388.395 3.491 20 5 GGBDRN CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273257626 1434976177 /nfs/dbraw/zinc/97/61/77/1434976177.db2.gz FFMMHOIJIADBTI-QFBILLFUSA-N 0 0 388.395 3.491 20 5 GGBDRN COc1ccccc1-c1noc([C@H](C)NCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000273264323 1434976458 /nfs/dbraw/zinc/97/64/58/1434976458.db2.gz FGRDRUORQRLOCO-ZDUSSCGKSA-N 0 0 384.392 3.383 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273265200 1434976567 /nfs/dbraw/zinc/97/65/67/1434976567.db2.gz AFXAHCALUARGTG-DNVCBOLYSA-N 0 0 387.411 3.450 20 5 GGBDRN CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273268529 1434976922 /nfs/dbraw/zinc/97/69/22/1434976922.db2.gz HANDBIHLZMUCNF-HKUYNNGSSA-N 0 0 388.395 3.491 20 5 GGBDRN Cc1cc(-c2noc([C@@H](C)NC[C@@H](O)c3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000273273731 1434977213 /nfs/dbraw/zinc/97/72/13/1434977213.db2.gz FDVXPJVOZYVCBG-SJKOYZFVSA-N 0 0 386.383 3.477 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(N3CC[C@@H](n4cnc5ccccc54)C3)cc2N1 ZINC000273291315 1434978570 /nfs/dbraw/zinc/97/85/70/1434978570.db2.gz KHXUXLGCNUEYFW-CQSZACIVSA-N 0 0 377.404 3.281 20 5 GGBDRN Cc1nnc(CNC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)n1C ZINC000273295670 1434978973 /nfs/dbraw/zinc/97/89/73/1434978973.db2.gz JPIMWLAETDVOCJ-UHFFFAOYSA-N 0 0 389.481 3.244 20 5 GGBDRN CCCc1ccccc1NC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273321344 1434980521 /nfs/dbraw/zinc/98/05/21/1434980521.db2.gz KWFCNHNEMPCRDA-UHFFFAOYSA-N 0 0 391.449 3.143 20 5 GGBDRN CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273328053 1434981113 /nfs/dbraw/zinc/98/11/13/1434981113.db2.gz SOIJJNLUOYBCJC-VQIMIIECSA-N 0 0 388.395 3.491 20 5 GGBDRN CCOc1cc(NC(=O)NOCc2cccnc2)c([N+](=O)[O-])cc1OCC ZINC000273342433 1434981983 /nfs/dbraw/zinc/98/19/83/1434981983.db2.gz QWYMJUVYTRXYIR-UHFFFAOYSA-N 0 0 376.369 3.041 20 5 GGBDRN O=C(NCc1cc(F)ccc1N1CCOCC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000273344828 1434982143 /nfs/dbraw/zinc/98/21/43/1434982143.db2.gz BJFFUDLUQLNTBS-UHFFFAOYSA-N 0 0 392.362 3.031 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273346251 1434982178 /nfs/dbraw/zinc/98/21/78/1434982178.db2.gz BTJRGBUDCWDRBL-GFCCVEGCSA-N 0 0 376.392 3.318 20 5 GGBDRN C[C@H](CCC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000273347642 1434982190 /nfs/dbraw/zinc/98/21/90/1434982190.db2.gz XXHIIANTQSTWBK-OAHLLOKOSA-N 0 0 390.461 3.069 20 5 GGBDRN CC1([C@H]2CCCN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)OCCO1 ZINC000273351342 1434982536 /nfs/dbraw/zinc/98/25/36/1434982536.db2.gz BYPMCEIDXQDIJZ-LBPRGKRZSA-N 0 0 388.342 3.229 20 5 GGBDRN O=C(NCCCC(=O)N1Cc2ccccc2C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000273352609 1434982689 /nfs/dbraw/zinc/98/26/89/1434982689.db2.gz CVTZCWCHZYDMPS-UHFFFAOYSA-N 0 0 386.383 3.178 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000273392529 1434985757 /nfs/dbraw/zinc/98/57/57/1434985757.db2.gz DUDWUWCJRJRQQI-BBRMVZONSA-N 0 0 398.387 3.072 20 5 GGBDRN CN([C@@H]1CCO[C@H](c2ccc(F)cc2)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273394797 1434985972 /nfs/dbraw/zinc/98/59/72/1434985972.db2.gz FITALLDPFYPXPK-AEFFLSMTSA-N 0 0 394.424 3.275 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000273397112 1434985985 /nfs/dbraw/zinc/98/59/85/1434985985.db2.gz FSIMERVKYMBNFH-SJLPKXTDSA-N 0 0 394.424 3.074 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000273397115 1434986001 /nfs/dbraw/zinc/98/60/01/1434986001.db2.gz FSIMERVKYMBNFH-WMZOPIPTSA-N 0 0 394.424 3.074 20 5 GGBDRN COc1cc(C(=O)NCc2cc(Cl)cc3c2OCC3)c([N+](=O)[O-])cc1OC ZINC000273410314 1434987031 /nfs/dbraw/zinc/98/70/31/1434987031.db2.gz OIYAZOHFQYSORC-UHFFFAOYSA-N 0 0 392.795 3.130 20 5 GGBDRN C[C@H](C(=O)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1)c1cccs1 ZINC000273419576 1434987615 /nfs/dbraw/zinc/98/76/15/1434987615.db2.gz GQOFYRXYHMMGHB-ZDUSSCGKSA-N 0 0 399.476 3.375 20 5 GGBDRN O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000273435205 1434988644 /nfs/dbraw/zinc/98/86/44/1434988644.db2.gz WUDZTKQXFLBQDT-DYVFJYSZSA-N 0 0 384.367 3.260 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000273435209 1434988717 /nfs/dbraw/zinc/98/87/17/1434988717.db2.gz WUDZTKQXFLBQDT-SUMWQHHRSA-N 0 0 384.367 3.260 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273440236 1434988919 /nfs/dbraw/zinc/98/89/19/1434988919.db2.gz WCCNLKFHKWRJHO-MJGOQNOKSA-N 0 0 387.411 3.496 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273457087 1434989920 /nfs/dbraw/zinc/98/99/20/1434989920.db2.gz MDJMOZOBHDEZJT-OLZOCXBDSA-N 0 0 380.420 3.283 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273457090 1434989970 /nfs/dbraw/zinc/98/99/70/1434989970.db2.gz MDJMOZOBHDEZJT-QWHCGFSZSA-N 0 0 380.420 3.283 20 5 GGBDRN Cc1ccc(C)n1C1CCN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000273458762 1434990008 /nfs/dbraw/zinc/99/00/08/1434990008.db2.gz AYTHCBQOEWHADX-UHFFFAOYSA-N 0 0 377.466 3.180 20 5 GGBDRN O=C(NC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1)c1ccsc1 ZINC000273464986 1434990334 /nfs/dbraw/zinc/99/03/34/1434990334.db2.gz NMGVKXWFZLPAQL-UHFFFAOYSA-N 0 0 392.412 3.222 20 5 GGBDRN O=C(NC1CCCCC1)C1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273465095 1434990545 /nfs/dbraw/zinc/99/05/45/1434990545.db2.gz NNCDEDYXCIHILA-UHFFFAOYSA-N 0 0 392.431 3.427 20 5 GGBDRN CCCCCC(=O)NC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273468207 1434990653 /nfs/dbraw/zinc/99/06/53/1434990653.db2.gz NXSXAJPYRUNXMH-UHFFFAOYSA-N 0 0 380.420 3.427 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000273475653 1434991070 /nfs/dbraw/zinc/99/10/70/1434991070.db2.gz PIEBJRULDFHQSH-KRWDZBQOSA-N 0 0 377.372 3.376 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000273485430 1434991585 /nfs/dbraw/zinc/99/15/85/1434991585.db2.gz RIMKQWXUBDULGD-GFCCVEGCSA-N 0 0 384.371 3.188 20 5 GGBDRN C[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000273490303 1434991922 /nfs/dbraw/zinc/99/19/22/1434991922.db2.gz MGKCURMIAIWIHS-LLVKDONJSA-N 0 0 386.376 3.377 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273490703 1434992018 /nfs/dbraw/zinc/99/20/18/1434992018.db2.gz SIYXCLRNOQFYIS-LBPRGKRZSA-N 0 0 382.392 3.207 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@]12CCCO2 ZINC000273513976 1434993926 /nfs/dbraw/zinc/99/39/26/1434993926.db2.gz CWYXHRSCGHTSHC-IIAWOOMASA-N 0 0 388.342 3.070 20 5 GGBDRN COc1cc(C)c([C@@H](C)NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000273524155 1434994294 /nfs/dbraw/zinc/99/42/94/1434994294.db2.gz SPXAMEAOHVWVEC-CYBMUJFWSA-N 0 0 394.449 3.101 20 5 GGBDRN CC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1nnc2n1CCCCC2 ZINC000273522604 1434994400 /nfs/dbraw/zinc/99/44/00/1434994400.db2.gz YYUQAZZFTFQMAV-ZDUSSCGKSA-N 0 0 376.392 3.325 20 5 GGBDRN COC[C@H](NCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])c1ccco1 ZINC000273530491 1434994820 /nfs/dbraw/zinc/99/48/20/1434994820.db2.gz SPDJQZSPLDWJQD-LBPRGKRZSA-N 0 0 386.351 3.318 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273532530 1434994974 /nfs/dbraw/zinc/99/49/74/1434994974.db2.gz RDLUMPQHGJMEIA-HIFRSBDPSA-N 0 0 398.387 3.072 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273532532 1434994993 /nfs/dbraw/zinc/99/49/93/1434994993.db2.gz RDLUMPQHGJMEIA-UKRRQHHQSA-N 0 0 398.387 3.072 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273586435 1434998509 /nfs/dbraw/zinc/99/85/09/1434998509.db2.gz HZDZNWXCHQYLNR-SJLPKXTDSA-N 0 0 394.424 3.074 20 5 GGBDRN Cc1ccc(-n2c(Sc3ncc([N+](=O)[O-])cn3)nnc2N2CCCC2)cc1 ZINC000273592818 1434998731 /nfs/dbraw/zinc/99/87/31/1434998731.db2.gz HNYHHBLNBAWPSI-UHFFFAOYSA-N 0 0 383.437 3.025 20 5 GGBDRN O=C(Nc1cncnc1N1CCCC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000273601168 1434999241 /nfs/dbraw/zinc/99/92/41/1434999241.db2.gz FVJNBWWPNVANLK-UHFFFAOYSA-N 0 0 381.314 3.256 20 5 GGBDRN O=[N+]([O-])c1cnc(Nc2cccc(CS(=O)(=O)C3CCCCC3)c2)nc1 ZINC000273602442 1434999284 /nfs/dbraw/zinc/99/92/84/1434999284.db2.gz JRLICGLTOAUAFE-UHFFFAOYSA-N 0 0 376.438 3.376 20 5 GGBDRN CCCN(CCC)C(=O)CCCc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000273653794 1435002843 /nfs/dbraw/zinc/00/28/43/1435002843.db2.gz HAHRBVMHFRZEEV-UHFFFAOYSA-N 0 0 375.429 3.198 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1Cc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000273689824 1435005540 /nfs/dbraw/zinc/00/55/40/1435005540.db2.gz BDWIUDFVJWPKSP-UHFFFAOYSA-N 0 0 396.329 3.193 20 5 GGBDRN CCOc1cc(NC(=O)N[C@@H](C)c2nnc(C)s2)c([N+](=O)[O-])cc1OCC ZINC000273699812 1435006262 /nfs/dbraw/zinc/00/62/62/1435006262.db2.gz MRNCZJDLTJFYEG-VIFPVBQESA-N 0 0 395.441 3.435 20 5 GGBDRN O=C(NC1CCC(O)(c2ccccc2)CC1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000273715110 1435007362 /nfs/dbraw/zinc/00/73/62/1435007362.db2.gz LLLBHGJLZPFRMN-UHFFFAOYSA-N 0 0 376.359 3.433 20 5 GGBDRN Cc1nnc([C@@H](C)NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000273724611 1435008116 /nfs/dbraw/zinc/00/81/16/1435008116.db2.gz RZFYCOXFPQNMPV-LLVKDONJSA-N 0 0 391.453 3.069 20 5 GGBDRN CCN(Cc1noc(CNc2ccccc2[N+](=O)[O-])n1)C(=O)OC(C)(C)C ZINC000273729079 1435008467 /nfs/dbraw/zinc/00/84/67/1435008467.db2.gz AOKLAJLWCXUWLK-UHFFFAOYSA-N 0 0 377.401 3.347 20 5 GGBDRN Cc1ccc(-c2noc(Cc3csc(N4CCCC4=O)n3)n2)cc1[N+](=O)[O-] ZINC000273735455 1435009327 /nfs/dbraw/zinc/00/93/27/1435009327.db2.gz KXPVIRDJFXSYEK-UHFFFAOYSA-N 0 0 385.405 3.127 20 5 GGBDRN CC1(C)Cc2[nH]c(=O)c(-c3nc(-c4ccc(N)c([N+](=O)[O-])c4)no3)cc2C(=O)C1 ZINC000273747383 1435010274 /nfs/dbraw/zinc/01/02/74/1435010274.db2.gz UTIVGECXKAZCCX-UHFFFAOYSA-N 0 0 395.375 3.150 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCc1nc(Cc2ccon2)no1 ZINC000273763352 1435012034 /nfs/dbraw/zinc/01/20/34/1435012034.db2.gz BFUMLUPSHJIEFW-UHFFFAOYSA-N 0 0 383.286 3.230 20 5 GGBDRN O=C1CCCN1Cc1cccc(-c2noc(COc3ccccc3[N+](=O)[O-])n2)c1 ZINC000273771742 1435012711 /nfs/dbraw/zinc/01/27/11/1435012711.db2.gz DRYPMAQWQZRRSA-UHFFFAOYSA-N 0 0 394.387 3.346 20 5 GGBDRN Cc1nn(CCc2nc(-c3ccccc3OC(F)F)no2)c(C)c1[N+](=O)[O-] ZINC000273771931 1435012791 /nfs/dbraw/zinc/01/27/91/1435012791.db2.gz UOHNOUNRXJBRES-UHFFFAOYSA-N 0 0 379.323 3.302 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1noc(C[C@@H]2OCCc3ccccc32)n1 ZINC000273775692 1435013079 /nfs/dbraw/zinc/01/30/79/1435013079.db2.gz FKUCJGYRLNDRNQ-SFHVURJKSA-N 0 0 380.404 3.489 20 5 GGBDRN O=C1CCCN1Cc1cccc(-c2noc(CNc3ccccc3[N+](=O)[O-])n2)c1 ZINC000273775469 1435013205 /nfs/dbraw/zinc/01/32/05/1435013205.db2.gz FDIYMUDTWUDQIR-UHFFFAOYSA-N 0 0 393.403 3.379 20 5 GGBDRN COc1ccc(NC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])cc1OC(C)C ZINC000273782029 1435013716 /nfs/dbraw/zinc/01/37/16/1435013716.db2.gz WBIDLWMGAAZCMN-UHFFFAOYSA-N 0 0 388.376 3.221 20 5 GGBDRN O=C1C[C@H](c2noc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)CN1CC1CCC1 ZINC000273783984 1435013894 /nfs/dbraw/zinc/01/38/94/1435013894.db2.gz ADHHMWQPFILNSG-AWEZNQCLSA-N 0 0 395.419 3.166 20 5 GGBDRN CC(=O)N1CCC[C@H](c2noc(-c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)C1 ZINC000273784751 1435014042 /nfs/dbraw/zinc/01/40/42/1435014042.db2.gz DXINLMGXJVSWAK-ZDUSSCGKSA-N 0 0 399.432 3.494 20 5 GGBDRN CCS[C@H](C)c1noc(CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)n1 ZINC000273785247 1435014046 /nfs/dbraw/zinc/01/40/46/1435014046.db2.gz AFXHHBHYFFFLET-SNVBAGLBSA-N 0 0 378.410 3.333 20 5 GGBDRN CCS[C@@H](C)c1noc(CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)n1 ZINC000273785241 1435014079 /nfs/dbraw/zinc/01/40/79/1435014079.db2.gz AFXHHBHYFFFLET-JTQLQIEISA-N 0 0 378.410 3.333 20 5 GGBDRN CC1CCC(N2C[C@H](c3nc(-c4ccc(N)c([N+](=O)[O-])c4)no3)CC2=O)CC1 ZINC000273787510 1435014418 /nfs/dbraw/zinc/01/44/18/1435014418.db2.gz ZUFDWQBCFGFELI-HRDQMINSSA-N 0 0 385.424 3.122 20 5 GGBDRN CC(C)(C)OC(=O)NCCc1noc(CSc2ccc([N+](=O)[O-])cc2)n1 ZINC000273789239 1435014621 /nfs/dbraw/zinc/01/46/21/1435014621.db2.gz WQVGUPSLQODPFX-UHFFFAOYSA-N 0 0 380.426 3.337 20 5 GGBDRN CC(C)(C(=O)N1CCC[C@H](C2(C)OCCO2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273806046 1435016272 /nfs/dbraw/zinc/01/62/72/1435016272.db2.gz CAADFXMZYINJRK-ZDUSSCGKSA-N 0 0 380.416 3.013 20 5 GGBDRN CN(Cc1nc([C@H]2CC(=O)N(c3ccccc3)C2)no1)c1ccccc1[N+](=O)[O-] ZINC000273806618 1435016367 /nfs/dbraw/zinc/01/63/67/1435016367.db2.gz FQUFTWLCSIJWDX-AWEZNQCLSA-N 0 0 393.403 3.135 20 5 GGBDRN CN(Cc1nc([C@@H]2CC(=O)N(c3ccccc3)C2)no1)c1ccccc1[N+](=O)[O-] ZINC000273806623 1435016378 /nfs/dbraw/zinc/01/63/78/1435016378.db2.gz FQUFTWLCSIJWDX-CQSZACIVSA-N 0 0 393.403 3.135 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N2CCCC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000273816338 1435017673 /nfs/dbraw/zinc/01/76/73/1435017673.db2.gz BXUIAECGMFAIBC-KRWDZBQOSA-N 0 0 397.431 3.087 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@@H](C)c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000273818609 1435018094 /nfs/dbraw/zinc/01/80/94/1435018094.db2.gz IZDSZQAZSAUDRK-GFCCVEGCSA-N 0 0 384.440 3.329 20 5 GGBDRN Cc1cc(C2CCN(S(=O)(=O)c3cc(Cl)c(C)c([N+](=O)[O-])c3)CC2)[nH]n1 ZINC000273821723 1435018276 /nfs/dbraw/zinc/01/82/76/1435018276.db2.gz CYAVPTHCWPOFSV-UHFFFAOYSA-N 0 0 398.872 3.156 20 5 GGBDRN O=C1C[C@@H](c2noc(-c3ccc(Cl)cc3[N+](=O)[O-])n2)CN1CC1CCC1 ZINC000273825077 1435018608 /nfs/dbraw/zinc/01/86/08/1435018608.db2.gz DFCSQBNUODEVHN-LLVKDONJSA-N 0 0 376.800 3.414 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc([C@@H]2CN(C3CC3)CCO2)no1 ZINC000273825136 1435018656 /nfs/dbraw/zinc/01/86/56/1435018656.db2.gz JHUBMBGTISUFMJ-NHYWBVRUSA-N 0 0 376.438 3.367 20 5 GGBDRN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1cccc(F)c1 ZINC000273831071 1435019132 /nfs/dbraw/zinc/01/91/32/1435019132.db2.gz HHQMIBUDBZQPEK-PIGZYNQJSA-N 0 0 378.375 3.389 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(CNc3ccccc3[N+](=O)[O-])n2)cs1 ZINC000273830625 1435019147 /nfs/dbraw/zinc/01/91/47/1435019147.db2.gz AHZJCUVHJHMGSM-SNVBAGLBSA-N 0 0 375.410 3.345 20 5 GGBDRN CNC(=O)c1ccc(CN(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000273831849 1435019317 /nfs/dbraw/zinc/01/93/17/1435019317.db2.gz DVVYMDMTJBCGGC-UHFFFAOYSA-N 0 0 387.411 3.030 20 5 GGBDRN CC(C)(C(=O)N[C@@H]1CCO[C@]2(CCSC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273835810 1435019678 /nfs/dbraw/zinc/01/96/78/1435019678.db2.gz FLUZKFFAPZPACE-KZULUSFZSA-N 0 0 382.457 3.182 20 5 GGBDRN COc1cc(Cc2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)cc(OC)c1OC 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/nfs/dbraw/zinc/02/40/24/1435024024.db2.gz KHLOKAKDSQSBPN-OAHLLOKOSA-N 0 0 378.388 3.284 20 5 GGBDRN CCS(=O)(=O)c1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000273878223 1435024554 /nfs/dbraw/zinc/02/45/54/1435024554.db2.gz LHCQCEJVAIEYQK-UHFFFAOYSA-N 0 0 394.424 3.444 20 5 GGBDRN O=C1C[C@@H](c2noc(-c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)CN1C1CC1 ZINC000273893637 1435026068 /nfs/dbraw/zinc/02/60/68/1435026068.db2.gz LTCCBLRQMGZZBT-LLVKDONJSA-N 0 0 397.416 3.247 20 5 GGBDRN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccc(F)cc1 ZINC000273900967 1435026887 /nfs/dbraw/zinc/02/68/87/1435026887.db2.gz XEKCCDPCYKNIMN-DIFFPNOSSA-N 0 0 378.375 3.389 20 5 GGBDRN O=C(CC1CCCCC1)NCc1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000273902344 1435027001 /nfs/dbraw/zinc/02/70/01/1435027001.db2.gz PZSXFDLSYRMXJA-UHFFFAOYSA-N 0 0 387.440 3.219 20 5 GGBDRN CC(C)C(=O)N(C)Cc1ccc(-c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1 ZINC000273902754 1435027110 /nfs/dbraw/zinc/02/71/10/1435027110.db2.gz 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CC(C)c1[nH]nc(-c2nc(-c3ccc(N4CCOC4=O)cc3)no2)c1[N+](=O)[O-] ZINC000273935974 1435030029 /nfs/dbraw/zinc/03/00/29/1435030029.db2.gz MLOOUOZGFQANNY-UHFFFAOYSA-N 0 0 384.352 3.115 20 5 GGBDRN CCOC(=O)c1csc(N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000273940494 1435030330 /nfs/dbraw/zinc/03/03/30/1435030330.db2.gz SWHKJBFWHHJPLX-UHFFFAOYSA-N 0 0 395.412 3.308 20 5 GGBDRN CC(=O)Nc1ccc(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000273940482 1435030351 /nfs/dbraw/zinc/03/03/51/1435030351.db2.gz SWEIIXIJGGFELE-UHFFFAOYSA-N 0 0 387.411 3.329 20 5 GGBDRN O=C1CCCN1Cc1ccc(-c2noc(CNc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000273952807 1435031711 /nfs/dbraw/zinc/03/17/11/1435031711.db2.gz TUDOHNLACJMNGD-UHFFFAOYSA-N 0 0 393.403 3.379 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3cccc(OC[C@H]4CCCO4)c3)n2)nc1 ZINC000273956363 1435031925 /nfs/dbraw/zinc/03/19/25/1435031925.db2.gz NPDJKXKQOKBMKG-QGZVFWFLSA-N 0 0 382.376 3.188 20 5 GGBDRN CC(C)(C(=O)Nc1ccn(CCc2ccncc2)n1)c1ccc([N+](=O)[O-])cc1F ZINC000273966417 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MRRBZKZPDFYBSQ-QMMMGPOBSA-N 0 0 390.377 3.128 20 5 GGBDRN O=C1C[C@@H](c2noc(-c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)n2)CN1CC1CC1 ZINC000274023839 1435037887 /nfs/dbraw/zinc/03/78/87/1435037887.db2.gz TTZOURVGBOKUAS-LLVKDONJSA-N 0 0 396.325 3.390 20 5 GGBDRN CO[C@H](C)c1nc(Cc2noc(-c3n[nH]c(C(C)C)c3[N+](=O)[O-])n2)cs1 ZINC000274029805 1435038237 /nfs/dbraw/zinc/03/82/37/1435038237.db2.gz OHRDRZNGJWMALJ-MRVPVSSYSA-N 0 0 378.414 3.246 20 5 GGBDRN CC(=O)c1cccc(OCCCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)c1 ZINC000274050409 1435039685 /nfs/dbraw/zinc/03/96/85/1435039685.db2.gz VEMUWIOKXRTOPG-UHFFFAOYSA-N 0 0 382.376 3.178 20 5 GGBDRN O=C1C[C@@H](c2noc(Cc3cccc([N+](=O)[O-])c3)n2)CN1Cc1ccccc1 ZINC000274050039 1435039688 /nfs/dbraw/zinc/03/96/88/1435039688.db2.gz QUIWMGCSTBEZAA-MRXNPFEDSA-N 0 0 378.388 3.085 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccco1 ZINC000274059096 1435040503 /nfs/dbraw/zinc/04/05/03/1435040503.db2.gz ZQWCQKJGHRDUET-LLVKDONJSA-N 0 0 398.824 3.267 20 5 GGBDRN 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ZINC000274084459 1435042204 /nfs/dbraw/zinc/04/22/04/1435042204.db2.gz RPXNPFKNEUUVPG-QMMMGPOBSA-N 0 0 391.365 3.308 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc([C@H]2CC(=O)N(Cc3ccccc3)C2)no1 ZINC000274093839 1435043093 /nfs/dbraw/zinc/04/30/93/1435043093.db2.gz UNZBAOUDGZBZHZ-HNNXBMFYSA-N 0 0 378.388 3.469 20 5 GGBDRN CCOC(=O)c1cnc(C)c(-c2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)c1 ZINC000274102488 1435043937 /nfs/dbraw/zinc/04/39/37/1435043937.db2.gz YQZDAHWJNLTAIZ-UHFFFAOYSA-N 0 0 382.376 3.424 20 5 GGBDRN O=c1oc2cc([N+](=O)[O-])ccc2n1CCCc1nc([C@H]2CCCS2)no1 ZINC000274109205 1435044392 /nfs/dbraw/zinc/04/43/92/1435044392.db2.gz ISFZOJZODUAHSM-CYBMUJFWSA-N 0 0 376.394 3.087 20 5 GGBDRN O=C(CC1CCCC1)Nc1ccc(-c2noc(Cn3ccc([N+](=O)[O-])n3)n2)cc1 ZINC000274110032 1435044397 /nfs/dbraw/zinc/04/43/97/1435044397.db2.gz ZXEXYUDDFDKULO-UHFFFAOYSA-N 0 0 396.407 3.408 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@H]1COC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000274110935 1435044655 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AYSKHHRIOUOHLD-UHFFFAOYSA-N 0 0 388.449 3.263 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])c(OC)c2)o1 ZINC000274238940 1435053907 /nfs/dbraw/zinc/05/39/07/1435053907.db2.gz BVNUIYYBVACMKJ-OAHLLOKOSA-N 0 0 390.392 3.085 20 5 GGBDRN O=C1OCCN1c1cc([N+](=O)[O-])ccc1N1CCC(O)(c2ccccc2)CC1 ZINC000274239100 1435054042 /nfs/dbraw/zinc/05/40/42/1435054042.db2.gz GYMHBLGJFUTOJH-UHFFFAOYSA-N 0 0 383.404 3.039 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000274243688 1435054116 /nfs/dbraw/zinc/05/41/16/1435054116.db2.gz SLKDXVYLJKQKKY-PKOBYXMFSA-N 0 0 398.415 3.422 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000274243682 1435054121 /nfs/dbraw/zinc/05/41/21/1435054121.db2.gz SLKDXVYLJKQKKY-MJGOQNOKSA-N 0 0 398.415 3.422 20 5 GGBDRN COc1ccc(OC)c([C@@H](O)CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000274246904 1435054629 /nfs/dbraw/zinc/05/46/29/1435054629.db2.gz HIBPGHZIGJVTQD-KRWDZBQOSA-N 0 0 389.408 3.084 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCO[C@H](c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1 ZINC000274256235 1435055216 /nfs/dbraw/zinc/05/52/16/1435055216.db2.gz LKJFXUOPFKCONU-KRWDZBQOSA-N 0 0 396.852 3.230 20 5 GGBDRN COc1ccc(NC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000274256385 1435055318 /nfs/dbraw/zinc/05/53/18/1435055318.db2.gz JHWOAIXYPFAENJ-UHFFFAOYSA-N 0 0 397.387 3.090 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000274259956 1435055554 /nfs/dbraw/zinc/05/55/54/1435055554.db2.gz KSLYUTVIWLASGK-OAHLLOKOSA-N 0 0 389.408 3.390 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000274263324 1435055996 /nfs/dbraw/zinc/05/59/96/1435055996.db2.gz XNLWFTSACHVGSD-FUHWJXTLSA-N 0 0 384.388 3.032 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)Cc1ccc(S(C)(=O)=O)cc1 ZINC000274263381 1435056037 /nfs/dbraw/zinc/05/60/37/1435056037.db2.gz KVFDCAUFTCIBIZ-UHFFFAOYSA-N 0 0 391.449 3.279 20 5 GGBDRN CCOc1ccc([C@@H](C)NC(=O)COc2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000274268693 1435056579 /nfs/dbraw/zinc/05/65/79/1435056579.db2.gz DQYJGKMUABWWLP-GFCCVEGCSA-N 0 0 392.383 3.397 20 5 GGBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCCO2)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000274273563 1435056718 /nfs/dbraw/zinc/05/67/18/1435056718.db2.gz BLPZZSZVLBOBCN-LLVKDONJSA-N 0 0 380.356 3.087 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])o1 ZINC000274273206 1435056729 /nfs/dbraw/zinc/05/67/29/1435056729.db2.gz RQZNHHULGCNFNN-AWEZNQCLSA-N 0 0 390.392 3.329 20 5 GGBDRN COc1ccc(OC)c([C@H](C)NC(=O)COc2c(F)cccc2[N+](=O)[O-])c1 ZINC000274275139 1435056934 /nfs/dbraw/zinc/05/69/34/1435056934.db2.gz GKDGKBUFTVMIAJ-NSHDSACASA-N 0 0 378.356 3.007 20 5 GGBDRN COc1ccc(OC)c([C@@H](C)NC(=O)COc2c(F)cccc2[N+](=O)[O-])c1 ZINC000274275136 1435056967 /nfs/dbraw/zinc/05/69/67/1435056967.db2.gz GKDGKBUFTVMIAJ-LLVKDONJSA-N 0 0 378.356 3.007 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000274294032 1435058720 /nfs/dbraw/zinc/05/87/20/1435058720.db2.gz DEXBFTOKEDRPIS-GFCCVEGCSA-N 0 0 386.433 3.317 20 5 GGBDRN COc1cc(C(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc([N+](=O)[O-])c1OC ZINC000274303993 1435059664 /nfs/dbraw/zinc/05/96/64/1435059664.db2.gz KSTVLMARZVVSFC-NSHDSACASA-N 0 0 382.372 3.333 20 5 GGBDRN CCOC(=O)CCN(Cc1cccnc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000274319916 1435061386 /nfs/dbraw/zinc/06/13/86/1435061386.db2.gz OOMFTKQNJCSSEU-UHFFFAOYSA-N 0 0 391.399 3.093 20 5 GGBDRN COc1ccccc1S(=O)(=O)CCCOc1ccc([N+](=O)[O-])cc1C(C)=O ZINC000274322942 1435061555 /nfs/dbraw/zinc/06/15/55/1435061555.db2.gz UCMMRULDKNGYGJ-UHFFFAOYSA-N 0 0 393.417 3.049 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 ZINC000274328181 1435061963 /nfs/dbraw/zinc/06/19/63/1435061963.db2.gz VOLYWCHNRSDCRX-UHFFFAOYSA-N 0 0 380.404 3.024 20 5 GGBDRN COC(=O)c1cc(C(=O)N2C[C@H]3CCC(=O)c4cccc2c43)cc([N+](=O)[O-])c1 ZINC000274328837 1435062245 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380.408 3.119 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000274459211 1435072653 /nfs/dbraw/zinc/07/26/53/1435072653.db2.gz WHGUCBWIIOOQQR-ZDUSSCGKSA-N 0 0 378.816 3.308 20 5 GGBDRN COC(=O)COc1ccc([C@H](C)NCc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000274498431 1435074884 /nfs/dbraw/zinc/07/48/84/1435074884.db2.gz UMWBOQGZZKQTLY-LBPRGKRZSA-N 0 0 392.383 3.145 20 5 GGBDRN C[C@H](CNC(=O)OC(C)(C)C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000274566379 1435078594 /nfs/dbraw/zinc/07/85/94/1435078594.db2.gz QBWZQFRSSFECLT-SECBINFHSA-N 0 0 391.346 3.257 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ncc(C3(O)CCCCC3)s2)c(C)c1[N+](=O)[O-] ZINC000274676256 1435084837 /nfs/dbraw/zinc/08/48/37/1435084837.db2.gz IVDVDFIJXWHHQB-UHFFFAOYSA-N 0 0 393.469 3.045 20 5 GGBDRN COC(CCCC(C)(C)CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)OC ZINC000274695196 1435085953 /nfs/dbraw/zinc/08/59/53/1435085953.db2.gz OAXUSWDBTIVHDH-UHFFFAOYSA-N 0 0 383.401 3.048 20 5 GGBDRN 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O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCN(CC(F)(F)F)CC1 ZINC000275588264 1435150967 /nfs/dbraw/zinc/15/09/67/1435150967.db2.gz HZTWUGCUJWQKHK-UHFFFAOYSA-N 0 0 389.377 3.414 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)Nc1cccc(NC(=O)C(C)C)c1 ZINC000275617202 1435153159 /nfs/dbraw/zinc/15/31/59/1435153159.db2.gz HOSRUTPINAXEAJ-UHFFFAOYSA-N 0 0 398.419 3.383 20 5 GGBDRN CC(C)c1ccc(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1[N+](=O)[O-] ZINC000275732318 1435163552 /nfs/dbraw/zinc/16/35/52/1435163552.db2.gz AFEJTTXRRAZXAU-SFHVURJKSA-N 0 0 396.447 3.034 20 5 GGBDRN Cc1c(NC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cccc1[N+](=O)[O-] ZINC000275735629 1435163994 /nfs/dbraw/zinc/16/39/94/1435163994.db2.gz QGXLEHXFEUTWOO-INIZCTEOSA-N 0 0 399.403 3.038 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000275764671 1435166861 /nfs/dbraw/zinc/16/68/61/1435166861.db2.gz XFENVPLODNDUMD-IUODEOHRSA-N 0 0 376.438 3.204 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N(Cc2ccccc2F)C(C)C)cc1[N+](=O)[O-] ZINC000275785167 1435168980 /nfs/dbraw/zinc/16/89/80/1435168980.db2.gz WNHOYAJYJXRUAJ-UHFFFAOYSA-N 0 0 389.383 3.118 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)n[nH]1 ZINC000275787439 1435169404 /nfs/dbraw/zinc/16/94/04/1435169404.db2.gz AQWABMDUEQOHKW-UHFFFAOYSA-N 0 0 378.820 3.070 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(Oc2cc(C)ccn2)CC1 ZINC000275800833 1435170802 /nfs/dbraw/zinc/17/08/02/1435170802.db2.gz UGZFLKBFCAJWHE-UHFFFAOYSA-N 0 0 386.408 3.382 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc([C@@H]3CCCN3Cc3ccc(F)cc3)n2)nc1 ZINC000275821392 1435172595 /nfs/dbraw/zinc/17/25/95/1435172595.db2.gz RDWIGADZRNDVBN-KRWDZBQOSA-N 0 0 383.383 3.440 20 5 GGBDRN O=C(c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)N(CCO)C1CCC1 ZINC000275832413 1435173433 /nfs/dbraw/zinc/17/34/33/1435173433.db2.gz CKSDUFYQNSSUIX-UHFFFAOYSA-N 0 0 399.234 3.074 20 5 GGBDRN COC(=O)C[C@@H]1CSCCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275834663 1435173555 /nfs/dbraw/zinc/17/35/55/1435173555.db2.gz UWUYFMAEXVOTSH-CQSZACIVSA-N 0 0 396.468 3.214 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@@H]2CCCO2)CC1 ZINC000275888290 1435177385 /nfs/dbraw/zinc/17/73/85/1435177385.db2.gz QZLMKWZEPCCDGR-KRWDZBQOSA-N 0 0 381.860 3.391 20 5 GGBDRN CC1(C)C[C@@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C(=O)O1 ZINC000275910315 1435179212 /nfs/dbraw/zinc/17/92/12/1435179212.db2.gz DKASAMVPYJOREA-OAHLLOKOSA-N 0 0 386.354 3.196 20 5 GGBDRN CCOc1cc(NC(=O)N2CC[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OCC ZINC000275917742 1435179723 /nfs/dbraw/zinc/17/97/23/1435179723.db2.gz VETUOYMHNJXLDS-MRXNPFEDSA-N 0 0 381.429 3.017 20 5 GGBDRN Cc1nc(C)c(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000275953245 1435182064 /nfs/dbraw/zinc/18/20/64/1435182064.db2.gz ZELVLIMBBKCFFW-UHFFFAOYSA-N 0 0 376.438 3.044 20 5 GGBDRN CS[C@H](CO)[C@H](C)NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275955577 1435182372 /nfs/dbraw/zinc/18/23/72/1435182372.db2.gz LJJMMXLOJHYAAY-XXFAHNHDSA-N 0 0 392.427 3.214 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@@H](O)C(C)(C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000276005307 1435185032 /nfs/dbraw/zinc/18/50/32/1435185032.db2.gz PDJOZAKIOGLJHY-IFXJQAMLSA-N 0 0 398.463 3.396 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@H](O)C(C)(C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000276005329 1435185075 /nfs/dbraw/zinc/18/50/75/1435185075.db2.gz PDJOZAKIOGLJHY-LIRRHRJNSA-N 0 0 398.463 3.396 20 5 GGBDRN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000276037941 1435186946 /nfs/dbraw/zinc/18/69/46/1435186946.db2.gz RODFIXFFZFJHHL-KSSFIOAISA-N 0 0 387.440 3.214 20 5 GGBDRN COc1cc(CN2CC[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000276043915 1435187484 /nfs/dbraw/zinc/18/74/84/1435187484.db2.gz SYIACDZTMRNLOQ-OAHLLOKOSA-N 0 0 392.374 3.137 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000276083630 1435189891 /nfs/dbraw/zinc/18/98/91/1435189891.db2.gz GRERTPISPVZYOF-LRDDRELGSA-N 0 0 392.456 3.085 20 5 GGBDRN CC(C)C[C@H]1C(=O)NCCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276108672 1435191424 /nfs/dbraw/zinc/19/14/24/1435191424.db2.gz ZVYKZPOONKQRBJ-IBGZPJMESA-N 0 0 377.444 3.080 20 5 GGBDRN COc1ccc(COCCCNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000276134193 1435193134 /nfs/dbraw/zinc/19/31/34/1435193134.db2.gz BPSPVPPMLBXKSX-UHFFFAOYSA-N 0 0 394.449 3.026 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@@H]2CCCO2)CC1 ZINC000276162085 1435194871 /nfs/dbraw/zinc/19/48/71/1435194871.db2.gz KGMZQFYRMHHDTE-INIZCTEOSA-N 0 0 382.844 3.435 20 5 GGBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000276164913 1435194938 /nfs/dbraw/zinc/19/49/38/1435194938.db2.gz UDSMPHPANLXPBP-CYBMUJFWSA-N 0 0 398.419 3.087 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000276164926 1435194954 /nfs/dbraw/zinc/19/49/54/1435194954.db2.gz UDSMPHPANLXPBP-ZDUSSCGKSA-N 0 0 398.419 3.087 20 5 GGBDRN CC(C)(C)OC(=O)C1CCC(Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CC1 ZINC000276218846 1435198192 /nfs/dbraw/zinc/19/81/92/1435198192.db2.gz LBMQZJDHJLMPPD-UHFFFAOYSA-N 0 0 398.481 3.311 20 5 GGBDRN COCCCOc1cccc(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c1 ZINC000276223861 1435198595 /nfs/dbraw/zinc/19/85/95/1435198595.db2.gz LPZDJXJWMZLQPN-UHFFFAOYSA-N 0 0 394.449 3.026 20 5 GGBDRN CCOC(CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)OCC ZINC000276229975 1435198862 /nfs/dbraw/zinc/19/88/62/1435198862.db2.gz NYVUBRZQZAJUHU-UHFFFAOYSA-N 0 0 379.457 3.104 20 5 GGBDRN COCCOc1cc(OC)ccc1C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000276256501 1435200420 /nfs/dbraw/zinc/20/04/20/1435200420.db2.gz AJTPYYJZCYBBJN-UHFFFAOYSA-N 0 0 386.404 3.222 20 5 GGBDRN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000276257663 1435200578 /nfs/dbraw/zinc/20/05/78/1435200578.db2.gz LNPGPNDWELWXGA-DOTOQJQBSA-N 0 0 386.404 3.041 20 5 GGBDRN COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000276257677 1435200608 /nfs/dbraw/zinc/20/06/08/1435200608.db2.gz LNPGPNDWELWXGA-WBVHZDCISA-N 0 0 386.404 3.041 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c(C)cc1C ZINC000276269131 1435201217 /nfs/dbraw/zinc/20/12/17/1435201217.db2.gz CJYFFAHEMLMHHV-UHFFFAOYSA-N 0 0 386.360 3.022 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC([C@H]3CCCO3)CC2)cc1SC ZINC000276287429 1435202282 /nfs/dbraw/zinc/20/22/82/1435202282.db2.gz PSQBZYNPDMBCEN-OAHLLOKOSA-N 0 0 380.466 3.357 20 5 GGBDRN CO[C@@H](c1ccccc1F)[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276300525 1435203356 /nfs/dbraw/zinc/20/33/56/1435203356.db2.gz MYXNNAWOCBAFGR-APPDUMDISA-N 0 0 382.413 3.326 20 5 GGBDRN CCS(=O)(=O)c1ccc(NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000276319929 1435204700 /nfs/dbraw/zinc/20/47/00/1435204700.db2.gz OOMWVHPJCDVFPQ-UHFFFAOYSA-N 0 0 394.449 3.060 20 5 GGBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276330883 1435205236 /nfs/dbraw/zinc/20/52/36/1435205236.db2.gz REXZJMXRZCOEBD-DIFFPNOSSA-N 0 0 382.413 3.326 20 5 GGBDRN Cc1cccc(C[C@H](CO)NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000276334820 1435205645 /nfs/dbraw/zinc/20/56/45/1435205645.db2.gz DRPVMOLIVDPTHG-CQSZACIVSA-N 0 0 382.338 3.255 20 5 GGBDRN CCc1nc(C(=O)OCc2ncc(C)c([N+](=O)[O-])c2C)nn1-c1ccccc1F ZINC000276373677 1435207812 /nfs/dbraw/zinc/20/78/12/1435207812.db2.gz DNFGUECUEBPJBG-UHFFFAOYSA-N 0 0 399.382 3.246 20 5 GGBDRN Cc1cnc(Cl)c(NC(=O)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000276410907 1435210038 /nfs/dbraw/zinc/21/00/38/1435210038.db2.gz RRJIXJMLQVAAPR-UHFFFAOYSA-N 0 0 390.827 3.029 20 5 GGBDRN Cc1nc2ccccc2n1C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000276419302 1435210521 /nfs/dbraw/zinc/21/05/21/1435210521.db2.gz WZISMIAXSCEHKR-OAHLLOKOSA-N 0 0 379.420 3.140 20 5 GGBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NOC[C@@H]2CCOC2)cc1 ZINC000276422774 1435210734 /nfs/dbraw/zinc/21/07/34/1435210734.db2.gz JHWWRNSDBOVPSF-CYBMUJFWSA-N 0 0 388.376 3.094 20 5 GGBDRN Cc1cnc(Cl)c(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000276439004 1435211652 /nfs/dbraw/zinc/21/16/52/1435211652.db2.gz DZQQOZIUTPERID-UHFFFAOYSA-N 0 0 376.800 3.041 20 5 GGBDRN COC(=O)[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@@H](C)O ZINC000276448503 1435212013 /nfs/dbraw/zinc/21/20/13/1435212013.db2.gz JOAPGOWSPBSQTO-DIFFPNOSSA-N 0 0 394.811 3.053 20 5 GGBDRN Cc1nc(COc2ccccc2C(=O)OCc2ncc(C)c([N+](=O)[O-])c2C)no1 ZINC000276459637 1435212447 /nfs/dbraw/zinc/21/24/47/1435212447.db2.gz WGXQHRZLCPJRQD-UHFFFAOYSA-N 0 0 398.375 3.234 20 5 GGBDRN COc1cc(C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc([N+](=O)[O-])c1C ZINC000276614267 1435220742 /nfs/dbraw/zinc/22/07/42/1435220742.db2.gz JUDYFSZEXKBMSA-UHFFFAOYSA-N 0 0 376.365 3.190 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1 ZINC000276633397 1435221634 /nfs/dbraw/zinc/22/16/34/1435221634.db2.gz PYZADDXPKCFVRX-KRWDZBQOSA-N 0 0 398.398 3.074 20 5 GGBDRN Cc1csc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1Cl ZINC000276659605 1435223447 /nfs/dbraw/zinc/22/34/47/1435223447.db2.gz PQZLWFIBYIWFSW-UHFFFAOYSA-N 0 0 393.852 3.216 20 5 GGBDRN CCc1ccc([C@@H]2CN(c3sc(S(C)(=O)=O)cc3[N+](=O)[O-])CCO2)cc1 ZINC000276662324 1435223577 /nfs/dbraw/zinc/22/35/77/1435223577.db2.gz CULDRALWWGESTK-HNNXBMFYSA-N 0 0 396.490 3.200 20 5 GGBDRN COc1cc(C(=O)NC[C@H]2CCC3(CCCCC3)O2)c([N+](=O)[O-])cc1OC ZINC000276716374 1435227317 /nfs/dbraw/zinc/22/73/17/1435227317.db2.gz LAVGCBKGOCWQQC-CYBMUJFWSA-N 0 0 378.425 3.224 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC2(CC1)CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)CC2 ZINC000276731303 1435228577 /nfs/dbraw/zinc/22/85/77/1435228577.db2.gz VKZOHZHKMBXNPL-UHFFFAOYSA-N 0 0 392.456 3.176 20 5 GGBDRN CC[C@]1(C)Oc2ccc(NC(=O)C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2O1 ZINC000276739382 1435229159 /nfs/dbraw/zinc/22/91/59/1435229159.db2.gz KHNLFNJWKAAYQR-HXUWFJFHSA-N 0 0 399.403 3.089 20 5 GGBDRN COC(=O)c1cc(NC(=O)Cc2c(C)nn(C(F)F)c2C)c(C)c([N+](=O)[O-])c1 ZINC000276743969 1435229392 /nfs/dbraw/zinc/22/93/92/1435229392.db2.gz FGYUQYATOQKQHE-UHFFFAOYSA-N 0 0 396.350 3.079 20 5 GGBDRN COc1ccc(OC(=O)CCc2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-] ZINC000276776436 1435231658 /nfs/dbraw/zinc/23/16/58/1435231658.db2.gz PVOYFSGRVJHYQF-UHFFFAOYSA-N 0 0 391.376 3.167 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1c1nnc(C2CCOCC2)o1 ZINC000276778095 1435231893 /nfs/dbraw/zinc/23/18/93/1435231893.db2.gz CYXLDIMDGUMCSI-INIZCTEOSA-N 0 0 386.408 3.239 20 5 GGBDRN COc1cc(C(=O)N2CCCc3c(NC(C)=O)cccc32)cc([N+](=O)[O-])c1C ZINC000276790431 1435232712 /nfs/dbraw/zinc/23/27/12/1435232712.db2.gz CTIDTTXSBAGYLN-UHFFFAOYSA-N 0 0 383.404 3.463 20 5 GGBDRN CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2O1 ZINC000276803216 1435233749 /nfs/dbraw/zinc/23/37/49/1435233749.db2.gz SWAAFJHFZYBSHR-YUNKPMOVSA-N 0 0 399.403 3.308 20 5 GGBDRN CC[C@]1(C)Oc2ccc(NC(=O)C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2O1 ZINC000276803207 1435233769 /nfs/dbraw/zinc/23/37/69/1435233769.db2.gz SWAAFJHFZYBSHR-FKIZINRSSA-N 0 0 399.403 3.308 20 5 GGBDRN CCN(C)C(=O)c1cccc(OS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c1 ZINC000276804059 1435233883 /nfs/dbraw/zinc/23/38/83/1435233883.db2.gz LCBNFAVZDNGKPH-UHFFFAOYSA-N 0 0 392.433 3.071 20 5 GGBDRN COC(=O)c1cc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc(Cl)c1F ZINC000276833009 1435236039 /nfs/dbraw/zinc/23/60/39/1435236039.db2.gz INQYJXRWVILJCC-UHFFFAOYSA-N 0 0 398.778 3.016 20 5 GGBDRN CCc1c(C(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2C)cnn1C(C)(C)C ZINC000276840583 1435236674 /nfs/dbraw/zinc/23/66/74/1435236674.db2.gz CJNRIFLNOUCMET-UHFFFAOYSA-N 0 0 388.424 3.456 20 5 GGBDRN COC(=O)C[C@](C)(NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccncc1 ZINC000276843137 1435236939 /nfs/dbraw/zinc/23/69/39/1435236939.db2.gz HDVILLNQGDRPHX-IBGZPJMESA-N 0 0 386.408 3.207 20 5 GGBDRN CCOc1cc(CNc2ccccc2C(=O)N2CCOCC2)ccc1[N+](=O)[O-] ZINC000276846873 1435237242 /nfs/dbraw/zinc/23/72/42/1435237242.db2.gz DCKYAFDPWYZDRU-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN CCOc1cc(CNc2cccc(C(=O)N3CCC[C@H](O)C3)c2)ccc1[N+](=O)[O-] ZINC000276886731 1435240168 /nfs/dbraw/zinc/24/01/68/1435240168.db2.gz JLXRUPBFWTUCAZ-SFHVURJKSA-N 0 0 399.447 3.203 20 5 GGBDRN O=C(N1CCC(Oc2ccc(F)nc2)CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000276890792 1435240637 /nfs/dbraw/zinc/24/06/37/1435240637.db2.gz MTUKDWDUYLUADT-UHFFFAOYSA-N 0 0 395.337 3.291 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc([C@H](C)N2CCOCC2)c1 ZINC000276898344 1435241296 /nfs/dbraw/zinc/24/12/96/1435241296.db2.gz DSRDUOCITGAJFQ-AWEZNQCLSA-N 0 0 385.420 3.249 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000276902018 1435241468 /nfs/dbraw/zinc/24/14/68/1435241468.db2.gz AJLKXJFMRGVBIK-WBVHZDCISA-N 0 0 378.331 3.142 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000276902013 1435241521 /nfs/dbraw/zinc/24/15/21/1435241521.db2.gz AJLKXJFMRGVBIK-RDJZCZTQSA-N 0 0 378.331 3.142 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2c2nc3sccn3c2[N+](=O)[O-])n1 ZINC000276903017 1435241608 /nfs/dbraw/zinc/24/16/08/1435241608.db2.gz WDKWXKIUSOYARD-SNVBAGLBSA-N 0 0 393.450 3.279 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccc(N3CCCC3=O)cc2)c(C)c([N+](=O)[O-])c1 ZINC000276910437 1435242237 /nfs/dbraw/zinc/24/22/37/1435242237.db2.gz QDCZWJGBPISHGS-UHFFFAOYSA-N 0 0 397.387 3.069 20 5 GGBDRN COc1ccc(CCC(C)=O)cc1OS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000276913948 1435242452 /nfs/dbraw/zinc/24/24/52/1435242452.db2.gz JTBLMFRVQIABEK-UHFFFAOYSA-N 0 0 393.417 3.201 20 5 GGBDRN CCOc1cc(CN(C)Cc2ccc(S(C)(=O)=O)cc2)ccc1[N+](=O)[O-] ZINC000276925088 1435243476 /nfs/dbraw/zinc/24/34/76/1435243476.db2.gz PSRULLQBRLUPBZ-UHFFFAOYSA-N 0 0 378.450 3.029 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccc(F)cc2)C2CCOCC2)cc1 ZINC000276927878 1435243759 /nfs/dbraw/zinc/24/37/59/1435243759.db2.gz MAKHNQFOWAVTAL-UHFFFAOYSA-N 0 0 394.424 3.104 20 5 GGBDRN COc1cc(C(=O)N2CCC(OC[C@H]3CCCCO3)CC2)cc([N+](=O)[O-])c1C ZINC000276939837 1435245261 /nfs/dbraw/zinc/24/52/61/1435245261.db2.gz TYZZMRNDPDYEFN-QGZVFWFLSA-N 0 0 392.452 3.102 20 5 GGBDRN COc1cc(C[NH2+]CC(C)(C)C(=O)[O-])c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000276967137 1435247962 /nfs/dbraw/zinc/24/79/62/1435247962.db2.gz GPFIYRZKWQZOAZ-UHFFFAOYSA-N 0 0 388.420 3.383 20 5 GGBDRN COCCOc1ccc(CC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000276989628 1435250158 /nfs/dbraw/zinc/25/01/58/1435250158.db2.gz IIZQWQHSOFABHK-UHFFFAOYSA-N 0 0 392.839 3.175 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277014293 1435252195 /nfs/dbraw/zinc/25/21/95/1435252195.db2.gz YOJOBJNVUPWGQE-UHFFFAOYSA-N 0 0 394.424 3.104 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000277041431 1435255258 /nfs/dbraw/zinc/25/52/58/1435255258.db2.gz HFSUZXNAUHBBDP-DOMZBBRYSA-N 0 0 376.434 3.393 20 5 GGBDRN COCCN(Cc1cccnc1)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000277055990 1435257172 /nfs/dbraw/zinc/25/71/72/1435257172.db2.gz IYNSNCWJZHINPS-UHFFFAOYSA-N 0 0 397.378 3.248 20 5 GGBDRN COc1ccc(C(=O)C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3OC)CC2)cc1 ZINC000277062162 1435257884 /nfs/dbraw/zinc/25/78/84/1435257884.db2.gz KEHHUJVQAMRFFB-UHFFFAOYSA-N 0 0 398.415 3.347 20 5 GGBDRN COC(=O)c1cc(NC(=O)N(Cc2ccncc2)C2CC2)c(C)c([N+](=O)[O-])c1 ZINC000277074360 1435259322 /nfs/dbraw/zinc/25/93/22/1435259322.db2.gz BUWMRHNRIIEXSC-UHFFFAOYSA-N 0 0 384.392 3.281 20 5 GGBDRN O=C(N[C@H]1CCCN(C2CCCCC2)C1=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000277099059 1435261855 /nfs/dbraw/zinc/26/18/55/1435261855.db2.gz LRGXIGWWPDOYIK-HNNXBMFYSA-N 0 0 379.844 3.302 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc(CN2CCCCC2)cs1 ZINC000277105668 1435262397 /nfs/dbraw/zinc/26/23/97/1435262397.db2.gz MPTFZJMNVZXCDP-UHFFFAOYSA-N 0 0 376.438 3.298 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CSCCOc1ccccc1)C(=O)[O-] ZINC000277123120 1435264661 /nfs/dbraw/zinc/26/46/61/1435264661.db2.gz BAQDMWUJFFXJTQ-SFHVURJKSA-N 0 0 390.461 3.258 20 5 GGBDRN O=C(N[C@@H]1CCCN(C2CCCCC2)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000277144008 1435267979 /nfs/dbraw/zinc/26/79/79/1435267979.db2.gz QPJPGAXTJSBHJN-CQSZACIVSA-N 0 0 379.844 3.302 20 5 GGBDRN O=C(N[C@H]1CCCN(C2CCCCC2)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000277144006 1435268061 /nfs/dbraw/zinc/26/80/61/1435268061.db2.gz QPJPGAXTJSBHJN-AWEZNQCLSA-N 0 0 379.844 3.302 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2nnc([C@@H](C)CC)[nH]2)cc1OC ZINC000277147696 1435268894 /nfs/dbraw/zinc/26/88/94/1435268894.db2.gz VZWQLVSJVGQGLR-WDEREUQCSA-N 0 0 391.428 3.125 20 5 GGBDRN COc1cc(C(=O)N[C@H](Cc2nc(C)no2)c2ccccc2)cc([N+](=O)[O-])c1C ZINC000277164317 1435271600 /nfs/dbraw/zinc/27/16/00/1435271600.db2.gz KKGFWJAUGGFQDZ-MRXNPFEDSA-N 0 0 396.403 3.317 20 5 GGBDRN CS(=O)(=O)c1ccc(NC[C@@H]2CCO[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000277178141 1435274289 /nfs/dbraw/zinc/27/42/89/1435274289.db2.gz NGCLRZFILPEPHQ-KSSFIOAISA-N 0 0 376.434 3.188 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)CC(=O)Nc1c(C)cc(C)cc1C ZINC000277184603 1435275001 /nfs/dbraw/zinc/27/50/01/1435275001.db2.gz ARIRAYGQDFKNKP-UHFFFAOYSA-N 0 0 385.420 3.239 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277202930 1435277780 /nfs/dbraw/zinc/27/77/80/1435277780.db2.gz UTACECQLBNBMQJ-UHFFFAOYSA-N 0 0 388.395 3.321 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)c1ncnn1C ZINC000277207646 1435278447 /nfs/dbraw/zinc/27/84/47/1435278447.db2.gz OIHBDAVCCJQOJS-LBPRGKRZSA-N 0 0 389.481 3.497 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000277207280 1435278578 /nfs/dbraw/zinc/27/85/78/1435278578.db2.gz VCDFHPNXRJOSSF-OAHLLOKOSA-N 0 0 380.404 3.258 20 5 GGBDRN Cc1cc(NC2CCN(c3cccnn3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000277218094 1435279964 /nfs/dbraw/zinc/27/99/64/1435279964.db2.gz RIDZYSQLPDMANZ-UHFFFAOYSA-N 0 0 391.435 3.231 20 5 GGBDRN COC(=O)c1cc(NC(=O)N2CCO[C@H](c3ccccc3)C2)c(C)c([N+](=O)[O-])c1 ZINC000277251595 1435284834 /nfs/dbraw/zinc/28/48/34/1435284834.db2.gz QBNWTUJXEIMJMQ-SFHVURJKSA-N 0 0 399.403 3.295 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)Oc2ncccc21 ZINC000277317799 1435293338 /nfs/dbraw/zinc/29/33/38/1435293338.db2.gz XAVASYHHZWRHNK-LBPRGKRZSA-N 0 0 389.433 3.156 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@@H]2CCOC3(CCCC3)C2)c(C)c([N+](=O)[O-])c1 ZINC000277321872 1435293850 /nfs/dbraw/zinc/29/38/50/1435293850.db2.gz VZMASHQNHPVSAF-CQSZACIVSA-N 0 0 391.424 3.303 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@H]2CCO[C@@H](C(C)(C)C)C2)c(C)c([N+](=O)[O-])c1 ZINC000277336413 1435295433 /nfs/dbraw/zinc/29/54/33/1435295433.db2.gz WUWKCWDWFNCHSZ-XJKSGUPXSA-N 0 0 393.440 3.405 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@H]2CCO[C@H](C(C)(C)C)C2)c(C)c([N+](=O)[O-])c1 ZINC000277336399 1435295575 /nfs/dbraw/zinc/29/55/75/1435295575.db2.gz WUWKCWDWFNCHSZ-BBRMVZONSA-N 0 0 393.440 3.405 20 5 GGBDRN Cc1noc(C[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000277381285 1435300216 /nfs/dbraw/zinc/30/02/16/1435300216.db2.gz YEXCYCYIGSTHKP-KRWDZBQOSA-N 0 0 395.419 3.188 20 5 GGBDRN COc1cccc(CSC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])c1 ZINC000277384480 1435300609 /nfs/dbraw/zinc/30/06/09/1435300609.db2.gz QZSQDUCAYSEYCD-QGZVFWFLSA-N 0 0 376.434 3.080 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000277395796 1435301448 /nfs/dbraw/zinc/30/14/48/1435301448.db2.gz GGUUEAAPRBLWNK-LBPRGKRZSA-N 0 0 398.419 3.378 20 5 GGBDRN CCN(C(=O)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1S(=O)(=O)CC ZINC000277403362 1435302290 /nfs/dbraw/zinc/30/22/90/1435302290.db2.gz HCRNTJQCZAZILY-UHFFFAOYSA-N 0 0 392.433 3.064 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000277420327 1435303503 /nfs/dbraw/zinc/30/35/03/1435303503.db2.gz DJGQGPQRRIQUNF-UHFFFAOYSA-N 0 0 380.395 3.384 20 5 GGBDRN CCCOc1cc(NC(=O)C(=O)NC(C)(C)C)c([N+](=O)[O-])cc1OCCC ZINC000277420599 1435303527 /nfs/dbraw/zinc/30/35/27/1435303527.db2.gz HIDJLKCIDCXDEX-UHFFFAOYSA-N 0 0 381.429 3.026 20 5 GGBDRN CCOc1cc(CS(=O)(=O)Cc2cccc(NC(C)=O)c2)ccc1[N+](=O)[O-] ZINC000277468827 1435306653 /nfs/dbraw/zinc/30/66/53/1435306653.db2.gz JOSTVQPQKDFEDZ-UHFFFAOYSA-N 0 0 392.433 3.067 20 5 GGBDRN Cc1cnc(C2CCN(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)CC2)s1 ZINC000277496503 1435308359 /nfs/dbraw/zinc/30/83/59/1435308359.db2.gz PDOFXGXQGRJWJN-UHFFFAOYSA-N 0 0 386.477 3.128 20 5 GGBDRN CCOCCC1(CNC(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2C)CC1 ZINC000277511823 1435309346 /nfs/dbraw/zinc/30/93/46/1435309346.db2.gz WMNVXRQBHRKYNI-UHFFFAOYSA-N 0 0 379.413 3.018 20 5 GGBDRN COc1cccc(CSC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C(=O)[O-])c1 ZINC000277518821 1435309909 /nfs/dbraw/zinc/30/99/09/1435309909.db2.gz YOXVKKJYKCPLCF-KRWDZBQOSA-N 0 0 390.461 3.388 20 5 GGBDRN Cc1nn(CC(C)C)c(C)c1CCC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000277540235 1435311351 /nfs/dbraw/zinc/31/13/51/1435311351.db2.gz BGPRJQGCBIGFCU-UHFFFAOYSA-N 0 0 398.467 3.189 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000277539170 1435311465 /nfs/dbraw/zinc/31/14/65/1435311465.db2.gz NCPNARYUKVYRAY-UHFFFAOYSA-N 0 0 397.435 3.174 20 5 GGBDRN Cc1cnc(C2CCN(CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000277560285 1435312964 /nfs/dbraw/zinc/31/29/64/1435312964.db2.gz XCFYWQXBEHYHPR-UHFFFAOYSA-N 0 0 395.506 3.013 20 5 GGBDRN Cc1cnc(C2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)CC2)s1 ZINC000277574831 1435313774 /nfs/dbraw/zinc/31/37/74/1435313774.db2.gz BJZIONRAEYLRHG-UHFFFAOYSA-N 0 0 376.394 3.288 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCOCC(F)(F)C(F)F ZINC000277594893 1435315220 /nfs/dbraw/zinc/31/52/20/1435315220.db2.gz NUGHKSCQWLHLPP-UHFFFAOYSA-N 0 0 395.353 3.432 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1 ZINC000277601264 1435315711 /nfs/dbraw/zinc/31/57/11/1435315711.db2.gz OPVSYCGBERYKIY-GFCCVEGCSA-N 0 0 383.404 3.443 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000277613941 1435316344 /nfs/dbraw/zinc/31/63/44/1435316344.db2.gz BGTZABUUINJRQH-UHFFFAOYSA-N 0 0 392.433 3.430 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1Cc2ccccc2C[C@H]1c1nnc(C)o1 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C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@@H]2CCCO2)nn1C ZINC000279034675 1435454286 /nfs/dbraw/zinc/45/42/86/1435454286.db2.gz BYECHALTWQRSMG-NHYWBVRUSA-N 0 0 376.438 3.299 20 5 GGBDRN C[C@]1(CCCO)CCCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279039609 1435454618 /nfs/dbraw/zinc/45/46/18/1435454618.db2.gz OLBZDSVJUCIGLJ-MRXNPFEDSA-N 0 0 389.374 3.450 20 5 GGBDRN COC[C@@H](c1ccc(Cl)cc1)N(C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000279051482 1435455762 /nfs/dbraw/zinc/45/57/62/1435455762.db2.gz YKRODRJQWCPCPD-KRWDZBQOSA-N 0 0 377.828 3.167 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279062216 1435456889 /nfs/dbraw/zinc/45/68/89/1435456889.db2.gz DGBGLMMSVYQDQE-CQSZACIVSA-N 0 0 394.815 3.241 20 5 GGBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279087836 1435459284 /nfs/dbraw/zinc/45/92/84/1435459284.db2.gz VADCHAPBFZNFOH-HNNXBMFYSA-N 0 0 393.831 3.197 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279089660 1435459424 /nfs/dbraw/zinc/45/94/24/1435459424.db2.gz GAADWKJDOVQXKW-UHFFFAOYSA-N 0 0 381.791 3.000 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@@H]1c2ccccc2C[C@@H]1O ZINC000279102789 1435460746 /nfs/dbraw/zinc/46/07/46/1435460746.db2.gz VDLLRVGPPZLHCI-JKSUJKDBSA-N 0 0 395.337 3.071 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)c1 ZINC000279130285 1435463228 /nfs/dbraw/zinc/46/32/28/1435463228.db2.gz BQJDPQQCBGOMSS-UHFFFAOYSA-N 0 0 388.399 3.110 20 5 GGBDRN C[C@H]1OCC[C@]12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C[C@@H](C)O2 ZINC000279134752 1435463969 /nfs/dbraw/zinc/46/39/69/1435463969.db2.gz AETZZVBTVPSZHC-FMTVUPSXSA-N 0 0 376.434 3.218 20 5 GGBDRN CC[C@H](C)Oc1cc(CNC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)ccn1 ZINC000279137104 1435464201 /nfs/dbraw/zinc/46/42/01/1435464201.db2.gz XSTGLBAGLRCZEL-LBPRGKRZSA-N 0 0 398.423 3.043 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)c1nc(C2CC2)no1 ZINC000279135651 1435464239 /nfs/dbraw/zinc/46/42/39/1435464239.db2.gz FMHNVPLAFNYNLX-OAHLLOKOSA-N 0 0 391.403 3.187 20 5 GGBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000279136436 1435464257 /nfs/dbraw/zinc/46/42/57/1435464257.db2.gz NWERTLBUQUKDJS-GOSISDBHSA-N 0 0 399.451 3.422 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279140867 1435464694 /nfs/dbraw/zinc/46/46/94/1435464694.db2.gz GFTKBCCCQYTHSK-BBATYDOGSA-N 0 0 393.390 3.181 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N[C@H]2CCOC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000279154394 1435465789 /nfs/dbraw/zinc/46/57/89/1435465789.db2.gz BDNIXZODEMRPEZ-ZDUSSCGKSA-N 0 0 379.432 3.412 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2nc(C3CCC3)cs2)cc1[N+](=O)[O-] ZINC000279175239 1435467658 /nfs/dbraw/zinc/46/76/58/1435467658.db2.gz HWVVYMRWZGMLKR-NSHDSACASA-N 0 0 388.449 3.443 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)CC(=O)Nc1c(C)cccc1C ZINC000279177492 1435467849 /nfs/dbraw/zinc/46/78/49/1435467849.db2.gz AXPYAFXXVDFGQH-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1[N+](=O)[O-] ZINC000279179988 1435468283 /nfs/dbraw/zinc/46/82/83/1435468283.db2.gz KAJLZOROEXJYHA-UHFFFAOYSA-N 0 0 386.383 3.401 20 5 GGBDRN CCn1nccc1C1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000279195760 1435469941 /nfs/dbraw/zinc/46/99/41/1435469941.db2.gz ILTASAKHFRLICU-UHFFFAOYSA-N 0 0 379.420 3.379 20 5 GGBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279203989 1435471166 /nfs/dbraw/zinc/47/11/66/1435471166.db2.gz NBEXGFDLTKWLMF-AWEZNQCLSA-N 0 0 375.404 3.117 20 5 GGBDRN Cc1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1C(=O)N1CCCCC1 ZINC000279227344 1435474041 /nfs/dbraw/zinc/47/40/41/1435474041.db2.gz QPWPMOLNAWUEIW-UHFFFAOYSA-N 0 0 382.420 3.364 20 5 GGBDRN C[C@@H]1CN(c2ccccc2NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@H](C)O1 ZINC000279233694 1435474835 /nfs/dbraw/zinc/47/48/35/1435474835.db2.gz PICQAJUDDJHBGY-TXEJJXNPSA-N 0 0 388.399 3.182 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccccc1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279237412 1435475523 /nfs/dbraw/zinc/47/55/23/1435475523.db2.gz RCCCZLCGAJAYTF-KPZWWZAWSA-N 0 0 375.400 3.042 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000279239902 1435475797 /nfs/dbraw/zinc/47/57/97/1435475797.db2.gz GZXQICILNOIZKJ-LBPRGKRZSA-N 0 0 381.392 3.023 20 5 GGBDRN COc1ccc(CNC(=O)c2cc3c(C(F)F)nn(C)c3s2)cc1[N+](=O)[O-] ZINC000279242757 1435475995 /nfs/dbraw/zinc/47/59/95/1435475995.db2.gz GDPYBXZXQBJYQS-UHFFFAOYSA-N 0 0 396.375 3.419 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)c1ccccc1 ZINC000279243621 1435476290 /nfs/dbraw/zinc/47/62/90/1435476290.db2.gz RZWZLQRWRHLMSK-ZFWWWQNUSA-N 0 0 389.427 3.084 20 5 GGBDRN Cc1csc([C@@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C2CC2)n1 ZINC000279248677 1435477064 /nfs/dbraw/zinc/47/70/64/1435477064.db2.gz SRZNKJHEEAUNSI-HNNXBMFYSA-N 0 0 378.429 3.446 20 5 GGBDRN 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ZINC000279307023 1435484303 /nfs/dbraw/zinc/48/43/03/1435484303.db2.gz AJMPRTSOIXXAEC-JTQLQIEISA-N 0 0 377.397 3.255 20 5 GGBDRN Cc1cc(N2C[C@@H](C)OC3(CCOCC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279309502 1435484630 /nfs/dbraw/zinc/48/46/30/1435484630.db2.gz BOKONAYQGASXKH-OAHLLOKOSA-N 0 0 384.436 3.135 20 5 GGBDRN O=C(O[C@H]([C@H]1CCCOC1)C(F)(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000279307400 1435484658 /nfs/dbraw/zinc/48/46/58/1435484658.db2.gz YOAFCTTWDULWEO-XHDPSFHLSA-N 0 0 399.325 3.295 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)c1ccc(N2CCOC2=O)cc1 ZINC000279312129 1435485312 /nfs/dbraw/zinc/48/53/12/1435485312.db2.gz NGFPOWHYMJTAOO-ZDUSSCGKSA-N 0 0 399.403 3.441 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)s1 ZINC000279329516 1435487170 /nfs/dbraw/zinc/48/71/70/1435487170.db2.gz GQCGIMHDLCOMMY-UHFFFAOYSA-N 0 0 396.490 3.305 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])sc1C ZINC000279331064 1435487366 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395.394 3.139 20 5 GGBDRN Cn1nc([C@@H]2CCCOC2)cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000279399354 1435495071 /nfs/dbraw/zinc/49/50/71/1435495071.db2.gz RPKVYDCKEFTBBH-OAHLLOKOSA-N 0 0 399.451 3.075 20 5 GGBDRN Cc1nc(C2(NC(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])CCCC2)no1 ZINC000279408410 1435496016 /nfs/dbraw/zinc/49/60/16/1435496016.db2.gz XDUXVASOKJHENI-UHFFFAOYSA-N 0 0 382.779 3.207 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1cccc(N2CCOC2=O)c1 ZINC000279422530 1435497595 /nfs/dbraw/zinc/49/75/95/1435497595.db2.gz WZZFLZSVZSTOKY-CYBMUJFWSA-N 0 0 399.403 3.441 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000279432267 1435498615 /nfs/dbraw/zinc/49/86/15/1435498615.db2.gz JKDROTQPBGHNFF-UHFFFAOYSA-N 0 0 383.452 3.217 20 5 GGBDRN COc1ncccc1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279474021 1435503088 /nfs/dbraw/zinc/50/30/88/1435503088.db2.gz KFGPOYHMQKESLB-UHFFFAOYSA-N 0 0 384.314 3.017 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1[N+](=O)[O-] ZINC000279478045 1435503451 /nfs/dbraw/zinc/50/34/51/1435503451.db2.gz QKTYNYDZMWXLHX-CQSZACIVSA-N 0 0 389.383 3.220 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1[N+](=O)[O-] ZINC000279478036 1435503507 /nfs/dbraw/zinc/50/35/07/1435503507.db2.gz QKTYNYDZMWXLHX-AWEZNQCLSA-N 0 0 389.383 3.220 20 5 GGBDRN Cc1nn(CCC(=O)N(CCC(F)(F)F)CC(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000279539928 1435511233 /nfs/dbraw/zinc/51/12/33/1435511233.db2.gz IFUZTLCMSZYUOF-UHFFFAOYSA-N 0 0 390.284 3.142 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279544515 1435511477 /nfs/dbraw/zinc/51/14/77/1435511477.db2.gz VXFMRKKFMRAKPS-BONVTDFDSA-N 0 0 381.429 3.103 20 5 GGBDRN Cc1ccnc(-c2n[nH]c([C@H](C)NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000279544676 1435511834 /nfs/dbraw/zinc/51/18/34/1435511834.db2.gz QJPGLEUTBNYWKF-OLZOCXBDSA-N 0 0 395.423 3.205 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000279569048 1435514276 /nfs/dbraw/zinc/51/42/76/1435514276.db2.gz UQPAGOBNERIDOP-GFCCVEGCSA-N 0 0 397.859 3.023 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CCC(C(=O)C(F)(F)F)CC1 ZINC000279584521 1435515746 /nfs/dbraw/zinc/51/57/46/1435515746.db2.gz VWIGMFHDSMPSHF-UHFFFAOYSA-N 0 0 394.733 3.383 20 5 GGBDRN Cc1c([C@H](C)NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cnn1C ZINC000279586243 1435516153 /nfs/dbraw/zinc/51/61/53/1435516153.db2.gz VAECECYUSQLVFX-VIFPVBQESA-N 0 0 385.346 3.216 20 5 GGBDRN CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)s1 ZINC000279595149 1435517143 /nfs/dbraw/zinc/51/71/43/1435517143.db2.gz WYDTXIRMTFWFSY-UHFFFAOYSA-N 0 0 397.478 3.388 20 5 GGBDRN COc1cc(CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)ccn1 ZINC000279599308 1435517791 /nfs/dbraw/zinc/51/77/91/1435517791.db2.gz WAZYLRAMLYDIOM-UHFFFAOYSA-N 0 0 384.314 3.017 20 5 GGBDRN C[C@@H]1OCC[C@@]12CN(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CCO2 ZINC000279609202 1435518657 /nfs/dbraw/zinc/51/86/57/1435518657.db2.gz XWCXAJPKGOGCLU-ZUZCIYMTSA-N 0 0 389.330 3.025 20 5 GGBDRN C[C@H]1OCC[C@]12CN(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CCO2 ZINC000279609198 1435518665 /nfs/dbraw/zinc/51/86/65/1435518665.db2.gz XWCXAJPKGOGCLU-BMIGLBTASA-N 0 0 389.330 3.025 20 5 GGBDRN Cc1cc(N2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279623124 1435520184 /nfs/dbraw/zinc/52/01/84/1435520184.db2.gz YQFFVQXUXLXWFU-BXTJHSDWSA-N 0 0 384.436 3.133 20 5 GGBDRN CCOc1cc(N2CCN(Cc3ccccc3NC(C)=O)CC2)ccc1[N+](=O)[O-] ZINC000279631509 1435521330 /nfs/dbraw/zinc/52/13/30/1435521330.db2.gz BWMGKOBOLPQWRE-UHFFFAOYSA-N 0 0 398.463 3.274 20 5 GGBDRN Cc1c(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cccc1NC(=O)N(C)C ZINC000279670190 1435526638 /nfs/dbraw/zinc/52/66/38/1435526638.db2.gz LQBKKRMIZLURDZ-UHFFFAOYSA-N 0 0 385.424 3.361 20 5 GGBDRN CCOC(=O)CC1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC000279677697 1435528327 /nfs/dbraw/zinc/52/83/27/1435528327.db2.gz ZRQLLHHNHYWRPH-UHFFFAOYSA-N 0 0 386.807 3.122 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2)sc1C ZINC000279690417 1435529902 /nfs/dbraw/zinc/52/99/02/1435529902.db2.gz NMUGCJBXUDYTIL-CYBMUJFWSA-N 0 0 375.406 3.124 20 5 GGBDRN COc1ccc(NC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000279701168 1435532020 /nfs/dbraw/zinc/53/20/20/1435532020.db2.gz JIVZXYBOLVRLLR-UHFFFAOYSA-N 0 0 377.441 3.263 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(CCC(F)(F)F)CC(F)(F)F ZINC000279720886 1435535050 /nfs/dbraw/zinc/53/50/50/1435535050.db2.gz ZMPMUKOEEQSMMT-UHFFFAOYSA-N 0 0 388.220 3.280 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC2(CCOCC2)O1 ZINC000279728876 1435535954 /nfs/dbraw/zinc/53/59/54/1435535954.db2.gz JCGMKDBETNFIKE-AWEZNQCLSA-N 0 0 376.453 3.302 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)sc1C ZINC000279742683 1435537104 /nfs/dbraw/zinc/53/71/04/1435537104.db2.gz UAQOILVSAQIIJF-CYBMUJFWSA-N 0 0 375.406 3.124 20 5 GGBDRN CCOc1cc(N2CCN(C(=O)c3cccc(C(C)=O)c3)CC2)ccc1[N+](=O)[O-] ZINC000279757513 1435539261 /nfs/dbraw/zinc/53/92/61/1435539261.db2.gz DURIHJUITVOZNB-UHFFFAOYSA-N 0 0 397.431 3.159 20 5 GGBDRN Cc1ccc([C@@H]2CCN(C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)C2)c(C)c1 ZINC000279765961 1435540228 /nfs/dbraw/zinc/54/02/28/1435540228.db2.gz WBIMIGFZUKWYQF-QGZVFWFLSA-N 0 0 391.431 3.422 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCCC2=O)c(OC)c1 ZINC000279785624 1435542779 /nfs/dbraw/zinc/54/27/79/1435542779.db2.gz UUCYQVWYCWJWMD-UHFFFAOYSA-N 0 0 399.403 3.381 20 5 GGBDRN Cc1nc2ccccc2n1C1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000279818013 1435547147 /nfs/dbraw/zinc/54/71/47/1435547147.db2.gz OXWHKRJOGHZONI-UHFFFAOYSA-N 0 0 394.431 3.495 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@](C)(OC)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000279833972 1435548504 /nfs/dbraw/zinc/54/85/04/1435548504.db2.gz BFDATEQUEAXSFK-KRWDZBQOSA-N 0 0 388.367 3.236 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([C@H]2CCCOC2)[nH]n1 ZINC000279839907 1435549964 /nfs/dbraw/zinc/54/99/64/1435549964.db2.gz FLPPDNNILXCCOT-RYUDHWBXSA-N 0 0 376.438 3.331 20 5 GGBDRN CC(=O)N1CCC[C@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000279852754 1435552009 /nfs/dbraw/zinc/55/20/09/1435552009.db2.gz UAIBXEGCNFESSF-OAHLLOKOSA-N 0 0 377.444 3.082 20 5 GGBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000279856624 1435553114 /nfs/dbraw/zinc/55/31/14/1435553114.db2.gz GCILVTPHQOIILT-VIFPVBQESA-N 0 0 384.314 3.483 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(CCC(F)(F)F)CC(F)(F)F ZINC000279865545 1435554735 /nfs/dbraw/zinc/55/47/35/1435554735.db2.gz SPBQCSYYGGIEDZ-UHFFFAOYSA-N 0 0 384.236 3.428 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CN(CCC(F)(F)F)CC(F)(F)F)c1 ZINC000279863954 1435554757 /nfs/dbraw/zinc/55/47/57/1435554757.db2.gz SURPBGKBENJHAS-LLVKDONJSA-N 0 0 390.280 3.151 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000279899791 1435559945 /nfs/dbraw/zinc/55/99/45/1435559945.db2.gz DRBPLWFIVOGAAB-SECBINFHSA-N 0 0 397.338 3.457 20 5 GGBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000279899798 1435560127 /nfs/dbraw/zinc/56/01/27/1435560127.db2.gz DRBPLWFIVOGAAB-VIFPVBQESA-N 0 0 397.338 3.457 20 5 GGBDRN Cc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1NC(=O)N(C)C ZINC000279928394 1435564708 /nfs/dbraw/zinc/56/47/08/1435564708.db2.gz LDWYRJATXIIARG-UHFFFAOYSA-N 0 0 385.424 3.437 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000279937056 1435566320 /nfs/dbraw/zinc/56/63/20/1435566320.db2.gz GDBMXCNEKZBHTF-MRXNPFEDSA-N 0 0 392.452 3.184 20 5 GGBDRN C[C@@H](O)C[C@@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279951914 1435568235 /nfs/dbraw/zinc/56/82/35/1435568235.db2.gz XSPVQNHTZCSUMX-DOMZBBRYSA-N 0 0 375.450 3.484 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000279972367 1435571160 /nfs/dbraw/zinc/57/11/60/1435571160.db2.gz KYYJUNAYRVPZDH-SECBINFHSA-N 0 0 382.323 3.066 20 5 GGBDRN CN(C)C(=O)Nc1ccc(CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000280023864 1435578305 /nfs/dbraw/zinc/57/83/05/1435578305.db2.gz MDCXGQTWGAJHIW-UHFFFAOYSA-N 0 0 399.451 3.197 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cnc(C(C)C)nc2)ccc1[N+](=O)[O-] ZINC000280034217 1435580191 /nfs/dbraw/zinc/58/01/91/1435580191.db2.gz VWOGAUQNBJPXRZ-KRWDZBQOSA-N 0 0 397.435 3.060 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCOCC2)c(C)c1 ZINC000280035139 1435580863 /nfs/dbraw/zinc/58/08/63/1435580863.db2.gz NNYRXOJEULTGGC-UHFFFAOYSA-N 0 0 385.420 3.391 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CCNC(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000280042743 1435581753 /nfs/dbraw/zinc/58/17/53/1435581753.db2.gz PKGIYLDHIGAMAI-UHFFFAOYSA-N 0 0 375.425 3.282 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCN(CC(F)(F)F)C1 ZINC000280089506 1435590225 /nfs/dbraw/zinc/59/02/25/1435590225.db2.gz RSCICHOKBUDDID-JTQLQIEISA-N 0 0 399.291 3.114 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2CCCc3n[nH]cc32)cc1[N+](=O)[O-])c1ccccn1 ZINC000280096908 1435591526 /nfs/dbraw/zinc/59/15/26/1435591526.db2.gz MFJYJFXTBOPBIZ-CYBMUJFWSA-N 0 0 392.419 3.479 20 5 GGBDRN COc1ccc(CN[C@@H](CO)c2ccccc2OC(F)(F)F)cc1[N+](=O)[O-] ZINC000280122813 1435595957 /nfs/dbraw/zinc/59/59/57/1435595957.db2.gz BUCNJISGFDIIHH-ZDUSSCGKSA-N 0 0 386.326 3.325 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(C)cc1OCCOC ZINC000280134243 1435598025 /nfs/dbraw/zinc/59/80/25/1435598025.db2.gz QRBRTJRXMOTBAU-UHFFFAOYSA-N 0 0 388.420 3.257 20 5 GGBDRN CC(C)(C)OC(=O)N1CC=C(CCNC(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000280140479 1435598172 /nfs/dbraw/zinc/59/81/72/1435598172.db2.gz XFJPYAWMYBJZRG-UHFFFAOYSA-N 0 0 389.452 3.211 20 5 GGBDRN C[C@@]1(C(N)=O)CCN(C(=O)/C=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000280140881 1435598282 /nfs/dbraw/zinc/59/82/82/1435598282.db2.gz SGRLIZSQUHKBMD-QRBZPYHOSA-N 0 0 385.445 3.060 20 5 GGBDRN Cn1nc([C@H]2CCCOC2)cc1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000280140961 1435598881 /nfs/dbraw/zinc/59/88/81/1435598881.db2.gz MJAHKXJHRWXIGP-HNNXBMFYSA-N 0 0 399.451 3.419 20 5 GGBDRN CCC(=O)c1ccc(N2Cc3c(OC)ccc(OC)c3[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000280142344 1435598895 /nfs/dbraw/zinc/59/88/95/1435598895.db2.gz ZFZIGVNFHGDUPC-QGZVFWFLSA-N 0 0 386.404 3.258 20 5 GGBDRN CCC(=O)c1ccc(NCc2ccc(N3CCO[C@@H](C)C3)nc2)c([N+](=O)[O-])c1 ZINC000280155329 1435600473 /nfs/dbraw/zinc/60/04/73/1435600473.db2.gz BKTGMCLMRJBPEH-AWEZNQCLSA-N 0 0 384.436 3.420 20 5 GGBDRN COc1cc(OCc2nc([C@@H](C)C(=O)OC(C)(C)C)no2)ccc1[N+](=O)[O-] ZINC000280195244 1435606915 /nfs/dbraw/zinc/60/69/15/1435606915.db2.gz BAOHFPKHWFGJIA-SNVBAGLBSA-N 0 0 379.369 3.011 20 5 GGBDRN CO[C@@]1(C)CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000280201854 1435607640 /nfs/dbraw/zinc/60/76/40/1435607640.db2.gz JMGJHHWQKJAMCG-AWEZNQCLSA-N 0 0 396.387 3.193 20 5 GGBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000280205311 1435608542 /nfs/dbraw/zinc/60/85/42/1435608542.db2.gz WMSRODDVOYNNFJ-CQSZACIVSA-N 0 0 385.424 3.064 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cc(COC(C)(C)C)on1 ZINC000280207717 1435608829 /nfs/dbraw/zinc/60/88/29/1435608829.db2.gz ZSUYXHYKJMUBHV-UHFFFAOYSA-N 0 0 377.397 3.227 20 5 GGBDRN C[NH+](C)CC1CCN(c2ccccc2NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC1 ZINC000280237848 1435615805 /nfs/dbraw/zinc/61/58/05/1435615805.db2.gz XWNITHVYIUWNFU-UHFFFAOYSA-N 0 0 398.463 3.331 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])Nc1cc([C@@H]2CCCOC2)[nH]n1 ZINC000280240178 1435615874 /nfs/dbraw/zinc/61/58/74/1435615874.db2.gz XZXJZCSKXAMFKS-SECBINFHSA-N 0 0 382.779 3.186 20 5 GGBDRN Cc1cccc(CC2(O)CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000280240595 1435616328 /nfs/dbraw/zinc/61/63/28/1435616328.db2.gz MVNHNXBDYTVJCZ-UHFFFAOYSA-N 0 0 382.460 3.432 20 5 GGBDRN CC(C)N1CCO[C@H](c2noc(-c3cc([N+](=O)[O-])ccc3N3CCCC3)n2)C1 ZINC000280255460 1435619767 /nfs/dbraw/zinc/61/97/67/1435619767.db2.gz JFVGIOGAQRWIQR-KRWDZBQOSA-N 0 0 387.440 3.027 20 5 GGBDRN Cc1cc(N(CCCO)Cc2ccccn2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000280256143 1435619788 /nfs/dbraw/zinc/61/97/88/1435619788.db2.gz NMLCSBATBINKEK-UHFFFAOYSA-N 0 0 379.420 3.144 20 5 GGBDRN C[C@@H]1CN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000280285498 1435626209 /nfs/dbraw/zinc/62/62/09/1435626209.db2.gz QCILNIQAWMLSQZ-NOZJJQNGSA-N 0 0 397.300 3.028 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cc([C@H]3CCCOC3)nn2C)cc1[N+](=O)[O-] ZINC000280312904 1435632757 /nfs/dbraw/zinc/63/27/57/1435632757.db2.gz XWAAINPJPZMHFI-HIFRSBDPSA-N 0 0 387.440 3.413 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(O)(Cc3cccc(C)c3)CC2)c1 ZINC000280352903 1435642593 /nfs/dbraw/zinc/64/25/93/1435642593.db2.gz XJHXPSPZDNXQFH-UHFFFAOYSA-N 0 0 384.432 3.122 20 5 GGBDRN Cc1c(NC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000280352667 1435642628 /nfs/dbraw/zinc/64/26/28/1435642628.db2.gz BDMMNSZDVDOIBI-OAHLLOKOSA-N 0 0 376.434 3.060 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2C[C@H](O)c2cccc([N+](=O)[O-])c2)sc1C ZINC000280430736 1435659705 /nfs/dbraw/zinc/65/97/05/1435659705.db2.gz MLYHYAKIVRKBQN-CABCVRRESA-N 0 0 391.449 3.017 20 5 GGBDRN C[C@@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@]2(CCOC2)O1 ZINC000280430338 1435659874 /nfs/dbraw/zinc/65/98/74/1435659874.db2.gz ZZGKCVMYSHJKDY-ACJLOTCBSA-N 0 0 375.450 3.098 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2Cc2ccc(OC)c([N+](=O)[O-])c2)sc1C ZINC000280453424 1435663489 /nfs/dbraw/zinc/66/34/89/1435663489.db2.gz NUQPMEDWGUORTJ-CYBMUJFWSA-N 0 0 391.449 3.492 20 5 GGBDRN CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000280479717 1435667815 /nfs/dbraw/zinc/66/78/15/1435667815.db2.gz JTWGSEPQCWFJGA-MRXNPFEDSA-N 0 0 388.342 3.024 20 5 GGBDRN CCC[C@H](NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000280498076 1435669815 /nfs/dbraw/zinc/66/98/15/1435669815.db2.gz 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Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](C)c2ccc(NC(N)=O)cc2)c1 ZINC000281089420 1435772134 /nfs/dbraw/zinc/77/21/34/1435772134.db2.gz GUHIYKGGVFPCKP-CYBMUJFWSA-N 0 0 386.408 3.040 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000281118063 1435778008 /nfs/dbraw/zinc/77/80/08/1435778008.db2.gz MIIMSSHXUZGMHJ-UHFFFAOYSA-N 0 0 384.436 3.181 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)[C@H](C)S(C)(=O)=O)cc1 ZINC000281123592 1435779191 /nfs/dbraw/zinc/77/91/91/1435779191.db2.gz XBJCGHNGYHDOOI-KBXCAEBGSA-N 0 0 390.461 3.116 20 5 GGBDRN CN(C(=O)[C@H]1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000281123676 1435779298 /nfs/dbraw/zinc/77/92/98/1435779298.db2.gz MSIOLSFCVCHAJS-AWEZNQCLSA-N 0 0 387.823 3.373 20 5 GGBDRN COC(=O)[C@H](C)N(C)C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000281125080 1435779989 /nfs/dbraw/zinc/77/99/89/1435779989.db2.gz GYIFPUXNSFNPOM-JTQLQIEISA-N 0 0 395.462 3.144 20 5 GGBDRN COc1ccc(-c2noc(CCCC(=O)N(C)c3ccc([N+](=O)[O-])nc3)n2)cc1 ZINC000281135383 1435781945 /nfs/dbraw/zinc/78/19/45/1435781945.db2.gz JMDPGWJIOQYELY-UHFFFAOYSA-N 0 0 397.391 3.034 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000281180691 1435790520 /nfs/dbraw/zinc/79/05/20/1435790520.db2.gz RHLWMAVXFJATAT-UHFFFAOYSA-N 0 0 385.420 3.147 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccc(O[C@H]2CCN(C)C2=O)cc1C ZINC000281183120 1435790871 /nfs/dbraw/zinc/79/08/71/1435790871.db2.gz LYHSKGCNJDBJAV-IBGZPJMESA-N 0 0 385.420 3.133 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)CCn1cnc2c(C)cccc2c1=O ZINC000281196472 1435793796 /nfs/dbraw/zinc/79/37/96/1435793796.db2.gz BUAANNCXOIREDW-UHFFFAOYSA-N 0 0 396.403 3.041 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CCN(c2nccs2)CC1 ZINC000281203227 1435795068 /nfs/dbraw/zinc/79/50/68/1435795068.db2.gz ACRIGSIHDXHDMY-UHFFFAOYSA-N 0 0 375.454 3.459 20 5 GGBDRN Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000281214194 1435797661 /nfs/dbraw/zinc/79/76/61/1435797661.db2.gz CYEVESPGCDBZOI-IBGZPJMESA-N 0 0 397.431 3.002 20 5 GGBDRN Cc1noc(C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c2ccccc2)n1 ZINC000281237025 1435800174 /nfs/dbraw/zinc/80/01/74/1435800174.db2.gz UJVCSCXCSBJJQU-QGZVFWFLSA-N 0 0 396.403 3.074 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000281243393 1435800467 /nfs/dbraw/zinc/80/04/67/1435800467.db2.gz COLGECFOFZCJGC-IQCLKLAJSA-N 0 0 385.464 3.407 20 5 GGBDRN NC(=O)c1ccc(SCc2nc([C@@H]3CCC(F)(F)C3)no2)c([N+](=O)[O-])c1 ZINC000281249510 1435800864 /nfs/dbraw/zinc/80/08/64/1435800864.db2.gz DOJDFAAFCNMSJQ-SECBINFHSA-N 0 0 384.364 3.272 20 5 GGBDRN Cc1noc(C)c1COc1ccc(CC(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc1 ZINC000281257693 1435801125 /nfs/dbraw/zinc/80/11/25/1435801125.db2.gz VANPQGHRJTXKKK-UHFFFAOYSA-N 0 0 396.403 3.379 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc(C2CCOCC2)[nH]n1 ZINC000281273103 1435801816 /nfs/dbraw/zinc/80/18/16/1435801816.db2.gz BGMJTYWVFMESOQ-UHFFFAOYSA-N 0 0 375.385 3.255 20 5 GGBDRN COc1cc(C(C)=O)ccc1OCCCC(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000281281445 1435802258 /nfs/dbraw/zinc/80/22/58/1435802258.db2.gz WYGKHBQANDMEHK-UHFFFAOYSA-N 0 0 387.392 3.023 20 5 GGBDRN O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N1CCS[C@@H]2COCC[C@H]21 ZINC000281283907 1435802355 /nfs/dbraw/zinc/80/23/55/1435802355.db2.gz XFKCUVVPPBTIIK-HZPDHXFCSA-N 0 0 385.445 3.003 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nnc(C(C)(C)C)s1 ZINC000281284964 1435802375 /nfs/dbraw/zinc/80/23/75/1435802375.db2.gz CCWPCUGKJVCXHN-UHFFFAOYSA-N 0 0 379.442 3.464 20 5 GGBDRN CN(C(=O)C1CCN(c2nc3ccccc3o2)CC1)c1ccc([N+](=O)[O-])nc1 ZINC000281283965 1435802425 /nfs/dbraw/zinc/80/24/25/1435802425.db2.gz XFVSAHFVTRSIGO-UHFFFAOYSA-N 0 0 381.392 3.010 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)c1 ZINC000281296869 1435802886 /nfs/dbraw/zinc/80/28/86/1435802886.db2.gz REJRCXTZINNGNG-UHFFFAOYSA-N 0 0 385.298 3.430 20 5 GGBDRN CCOc1cc(NC(=O)N2CCCO[C@@H](CC)C2)c([N+](=O)[O-])cc1OCC ZINC000281309600 1435803338 /nfs/dbraw/zinc/80/33/38/1435803338.db2.gz IIUQYGSUFXYBFR-ZDUSSCGKSA-N 0 0 381.429 3.425 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)CCc1c(C)nc(SC)[nH]c1=O ZINC000281313757 1435803478 /nfs/dbraw/zinc/80/34/78/1435803478.db2.gz JSCHJYQKTLKVDB-UHFFFAOYSA-N 0 0 392.437 3.091 20 5 GGBDRN COc1ccc(NC(C)=O)c(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])c1 ZINC000281317324 1435803709 /nfs/dbraw/zinc/80/37/09/1435803709.db2.gz SMWVNQGJHPJGQV-UHFFFAOYSA-N 0 0 387.392 3.278 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1cc(OC)ccc1OC ZINC000281331454 1435804165 /nfs/dbraw/zinc/80/41/65/1435804165.db2.gz VUHWTZMQWAWWOA-UHFFFAOYSA-N 0 0 375.381 3.061 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000281335093 1435804251 /nfs/dbraw/zinc/80/42/51/1435804251.db2.gz JMKZWRGGDJSHQA-MQMHXKEQSA-N 0 0 382.342 3.181 20 5 GGBDRN Cc1nnc([C@@H]2CCCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])C2)[nH]1 ZINC000281361157 1435805509 /nfs/dbraw/zinc/80/55/09/1435805509.db2.gz WAUARRZGDQYZKM-OAHLLOKOSA-N 0 0 392.419 3.103 20 5 GGBDRN CCOC(=O)c1cc(NCc2ccc(S(=O)(=O)CC)s2)ccc1[N+](=O)[O-] ZINC000281380253 1435806358 /nfs/dbraw/zinc/80/63/58/1435806358.db2.gz FKYXPECQUGTPOW-UHFFFAOYSA-N 0 0 398.462 3.239 20 5 GGBDRN COc1cc(CNc2cc(N3CCOCC3)ccc2C)c([N+](=O)[O-])cc1OC ZINC000281393347 1435806981 /nfs/dbraw/zinc/80/69/81/1435806981.db2.gz HFOPRDRDHWPWLF-UHFFFAOYSA-N 0 0 387.436 3.369 20 5 GGBDRN COC(=O)c1cccc(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])c1OC(C)C ZINC000281392505 1435807034 /nfs/dbraw/zinc/80/70/34/1435807034.db2.gz VMQLSCGPANFHCH-UHFFFAOYSA-N 0 0 388.376 3.430 20 5 GGBDRN CCC(=O)c1ccc(N[C@@H]2CCCN(Cc3ccccn3)C2=O)c([N+](=O)[O-])c1 ZINC000281412842 1435807880 /nfs/dbraw/zinc/80/78/80/1435807880.db2.gz IAPMQNAZBWQKAM-QGZVFWFLSA-N 0 0 382.420 3.186 20 5 GGBDRN CC(C)(C(=O)NC1CCN(c2nccs2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000281416473 1435808114 /nfs/dbraw/zinc/80/81/14/1435808114.db2.gz XJNMKGQFGOEMFM-UHFFFAOYSA-N 0 0 392.456 3.253 20 5 GGBDRN Cc1c(-c2nc([C@H]3CCC(F)(F)C3)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000281453407 1435809478 /nfs/dbraw/zinc/80/94/78/1435809478.db2.gz QREVYKDAYHMUGS-JTQLQIEISA-N 0 0 376.323 3.437 20 5 GGBDRN Cc1c(-c2nc([C@@H]3CCC(F)(F)C3)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000281453412 1435809537 /nfs/dbraw/zinc/80/95/37/1435809537.db2.gz QREVYKDAYHMUGS-SNVBAGLBSA-N 0 0 376.323 3.437 20 5 GGBDRN CC[C@@H]1CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCO1 ZINC000281463401 1435810032 /nfs/dbraw/zinc/81/00/32/1435810032.db2.gz IQDHVNPXBHKKDR-CQSZACIVSA-N 0 0 375.347 3.324 20 5 GGBDRN Cc1csc([C@H]2COCCN2C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])n1 ZINC000281491794 1435811059 /nfs/dbraw/zinc/81/10/59/1435811059.db2.gz HLXBPEYDYWIUCK-OAHLLOKOSA-N 0 0 391.449 3.037 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000281519265 1435811960 /nfs/dbraw/zinc/81/19/60/1435811960.db2.gz XYUVLSZSDAANIA-JWZBEHFJSA-N 0 0 377.441 3.397 20 5 GGBDRN CC(C)(C)Nc1ccccc1NC(=O)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000281626792 1435816193 /nfs/dbraw/zinc/81/61/93/1435816193.db2.gz FMIBWCXHPCOJMO-UHFFFAOYSA-N 0 0 384.436 3.103 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000281671680 1435817942 /nfs/dbraw/zinc/81/79/42/1435817942.db2.gz BQVWAFRQMQUFPL-GFCCVEGCSA-N 0 0 383.470 3.423 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(C)(C)Cc1nc2ccccc2[nH]1 ZINC000281717408 1435819371 /nfs/dbraw/zinc/81/93/71/1435819371.db2.gz CWLUQKWAYBCBCF-UHFFFAOYSA-N 0 0 382.420 3.365 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000281740908 1435820216 /nfs/dbraw/zinc/82/02/16/1435820216.db2.gz IMUUFNPCGYEZCC-INIZCTEOSA-N 0 0 391.468 3.291 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000281745617 1435820416 /nfs/dbraw/zinc/82/04/16/1435820416.db2.gz RUUGYOWZSHJESI-HNNXBMFYSA-N 0 0 378.454 3.036 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)c1ccc(F)cc1 ZINC000281745991 1435820514 /nfs/dbraw/zinc/82/05/14/1435820514.db2.gz VJUXSKHORHTWON-GFCCVEGCSA-N 0 0 389.383 3.291 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H](C)C[C@H](O)c2cccs2)c1 ZINC000281764570 1435821119 /nfs/dbraw/zinc/82/11/19/1435821119.db2.gz ZGLDMEQRQMMHBB-ZFWWWQNUSA-N 0 0 378.450 3.362 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000281763056 1435821154 /nfs/dbraw/zinc/82/11/54/1435821154.db2.gz SQPSIEUBWWHNPW-CQSZACIVSA-N 0 0 398.872 3.381 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)Cc1ccc(Cl)s1 ZINC000281766467 1435821223 /nfs/dbraw/zinc/82/12/23/1435821223.db2.gz XKSHGGSWNIHOHZ-UHFFFAOYSA-N 0 0 397.840 3.306 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCc2nc3cc(F)ccc3[nH]2)c1 ZINC000281777839 1435821672 /nfs/dbraw/zinc/82/16/72/1435821672.db2.gz ZVNLUOFCRBNMNG-UHFFFAOYSA-N 0 0 386.383 3.046 20 5 GGBDRN CCCN(C(=O)CCNC(=O)OCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000281818630 1435823108 /nfs/dbraw/zinc/82/31/08/1435823108.db2.gz MTDJPNBOMHYGBX-UHFFFAOYSA-N 0 0 377.319 3.016 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCCC12CCOCC2 ZINC000281855346 1435824338 /nfs/dbraw/zinc/82/43/38/1435824338.db2.gz JVOHRBKLQQVLCW-MRXNPFEDSA-N 0 0 381.860 3.439 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)CCC(=O)N1CCC(c2ccccc2)=N1 ZINC000281861392 1435824563 /nfs/dbraw/zinc/82/45/63/1435824563.db2.gz BZYNAKWLAMOUEE-UHFFFAOYSA-N 0 0 398.394 3.398 20 5 GGBDRN Cc1cc(OCC(=O)NC2(c3ccc(F)cc3)CCOCC2)ccc1[N+](=O)[O-] ZINC000281875497 1435825065 /nfs/dbraw/zinc/82/50/65/1435825065.db2.gz ZQSLUPVAGMZLAS-UHFFFAOYSA-N 0 0 388.395 3.243 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cc1[N+](=O)[O-] ZINC000281886864 1435825511 /nfs/dbraw/zinc/82/55/11/1435825511.db2.gz GSUJAPWERWJIKA-FAYQHZLMSA-N 0 0 377.441 3.397 20 5 GGBDRN COc1ccc(NC(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cc1[N+](=O)[O-] ZINC000281886858 1435825524 /nfs/dbraw/zinc/82/55/24/1435825524.db2.gz GSUJAPWERWJIKA-DUFGSWQCSA-N 0 0 377.441 3.397 20 5 GGBDRN CCCCNC(=O)C1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)CC1 ZINC000281910564 1435826390 /nfs/dbraw/zinc/82/63/90/1435826390.db2.gz IVXRPYNGTGETLL-UHFFFAOYSA-N 0 0 392.456 3.154 20 5 GGBDRN CCn1ncc2cc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)c(C)nc21 ZINC000281911100 1435826489 /nfs/dbraw/zinc/82/64/89/1435826489.db2.gz RFBQQMWCRFHJOE-UHFFFAOYSA-N 0 0 379.420 3.473 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000281916171 1435826683 /nfs/dbraw/zinc/82/66/83/1435826683.db2.gz GUCMGDMQCSLZIQ-WTMJQUOKSA-N 0 0 399.447 3.250 20 5 GGBDRN CO[C@H]1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000281922977 1435827064 /nfs/dbraw/zinc/82/70/64/1435827064.db2.gz STQATDACDJTDLI-YPMHNXCESA-N 0 0 389.374 3.442 20 5 GGBDRN COC(=O)c1cc(NC(=O)N[C@@H]2CCCC23CCOCC3)c(C)c([N+](=O)[O-])c1 ZINC000281932881 1435827324 /nfs/dbraw/zinc/82/73/24/1435827324.db2.gz BJZCOOYKZSIGHO-MRXNPFEDSA-N 0 0 391.424 3.161 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCN(CC(F)(F)F)CC1 ZINC000281935129 1435827482 /nfs/dbraw/zinc/82/74/82/1435827482.db2.gz KWVGZEUWCZKXHW-UHFFFAOYSA-N 0 0 390.362 3.095 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(C2(C)OCCO2)CC1 ZINC000281936826 1435827641 /nfs/dbraw/zinc/82/76/41/1435827641.db2.gz KZTRLAFSNSKVTD-UHFFFAOYSA-N 0 0 379.413 3.000 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC1CCN(c2nccs2)CC1 ZINC000281947443 1435828017 /nfs/dbraw/zinc/82/80/17/1435828017.db2.gz LYRCOYRYILGVRD-UHFFFAOYSA-N 0 0 375.454 3.459 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000281949624 1435828154 /nfs/dbraw/zinc/82/81/54/1435828154.db2.gz NCJNYCLVVLXEPT-HNNXBMFYSA-N 0 0 391.468 3.291 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H](c2nc(C)no2)C1 ZINC000281962358 1435828777 /nfs/dbraw/zinc/82/87/77/1435828777.db2.gz NFSNGCTYVCXMCH-LBPRGKRZSA-N 0 0 375.385 3.096 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](c2nc(C)no2)C1 ZINC000281962355 1435828797 /nfs/dbraw/zinc/82/87/97/1435828797.db2.gz NFSNGCTYVCXMCH-GFCCVEGCSA-N 0 0 375.385 3.096 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000281984200 1435829735 /nfs/dbraw/zinc/82/97/35/1435829735.db2.gz QEFDRSKIGWUKJR-CQSZACIVSA-N 0 0 377.441 3.362 20 5 GGBDRN CO[C@@H]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000281998437 1435830327 /nfs/dbraw/zinc/83/03/27/1435830327.db2.gz XRJOEBTZCTVYNO-DOTOQJQBSA-N 0 0 375.469 3.471 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000282019831 1435831180 /nfs/dbraw/zinc/83/11/80/1435831180.db2.gz UEBNXKUOVZKRHE-AWEZNQCLSA-N 0 0 377.441 3.362 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000282037010 1435831862 /nfs/dbraw/zinc/83/18/62/1435831862.db2.gz LSELJNMUDSJFER-ASKNOMKYSA-N 0 0 398.463 3.182 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000282041594 1435832175 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Cc1cc(=O)c(C(=O)N(C)C2CCCCCC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000282264092 1435840825 /nfs/dbraw/zinc/84/08/25/1435840825.db2.gz SBBBUEMCDQAVHI-UHFFFAOYSA-N 0 0 384.436 3.244 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)CS(=O)(=O)CCCc1ccccc1 ZINC000282309831 1435842600 /nfs/dbraw/zinc/84/26/00/1435842600.db2.gz MSUCMLSXTOZPRE-UHFFFAOYSA-N 0 0 394.424 3.028 20 5 GGBDRN Cc1cccnc1[C@@H](NC(=O)C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F)C(C)C ZINC000282339945 1435843719 /nfs/dbraw/zinc/84/37/19/1435843719.db2.gz DPEJPEBRSHTBEG-HNNXBMFYSA-N 0 0 388.399 3.198 20 5 GGBDRN Cc1cc(F)c(NC(=O)CS(=O)(=O)CCCc2ccccc2)cc1[N+](=O)[O-] ZINC000282349544 1435844051 /nfs/dbraw/zinc/84/40/51/1435844051.db2.gz HBGFJYZTRUYANO-UHFFFAOYSA-N 0 0 394.424 3.028 20 5 GGBDRN CCN(C(=O)C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F)[C@H](C)c1cccc(O)c1 ZINC000282361764 1435844449 /nfs/dbraw/zinc/84/44/49/1435844449.db2.gz FSWJWQTVRUEJDQ-GFCCVEGCSA-N 0 0 389.383 3.296 20 5 GGBDRN CCc1ccc(OCc2noc(CNC(=O)OC(C)(C)C)n2)c([N+](=O)[O-])c1 ZINC000282365304 1435844563 /nfs/dbraw/zinc/84/45/63/1435844563.db2.gz AWMHXCYEHJYMOH-UHFFFAOYSA-N 0 0 378.385 3.144 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccnc(N3CCCCC3)c2)c1 ZINC000282379397 1435845146 /nfs/dbraw/zinc/84/51/46/1435845146.db2.gz ARSWNIZGQBZLTN-UHFFFAOYSA-N 0 0 384.436 3.309 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1cccc(N2CCCC2=O)c1 ZINC000282385140 1435845307 /nfs/dbraw/zinc/84/53/07/1435845307.db2.gz JJQPNMFNOSMEFR-UHFFFAOYSA-N 0 0 396.447 3.106 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OCC(=O)OC)cc2C)c1 ZINC000282386488 1435845379 /nfs/dbraw/zinc/84/53/79/1435845379.db2.gz BHGZWNNOGLCRRY-UHFFFAOYSA-N 0 0 388.376 3.106 20 5 GGBDRN CC(C)NC(=O)c1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282394053 1435845628 /nfs/dbraw/zinc/84/56/28/1435845628.db2.gz DVZDERRWALQYFM-UHFFFAOYSA-N 0 0 384.436 3.439 20 5 GGBDRN CCN(CCc1cccs1)C(=O)C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F ZINC000282392402 1435845707 /nfs/dbraw/zinc/84/57/07/1435845707.db2.gz 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/nfs/dbraw/zinc/85/29/36/1435852936.db2.gz XGJQWGOFYBYTKD-UHFFFAOYSA-N 0 0 398.419 3.418 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C1 ZINC000282618791 1435853896 /nfs/dbraw/zinc/85/38/96/1435853896.db2.gz ZROHDMMTLZUGHR-OAHLLOKOSA-N 0 0 379.420 3.393 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OC)c(OCCOC)c2)c1 ZINC000282644297 1435854954 /nfs/dbraw/zinc/85/49/54/1435854954.db2.gz LQHVOAGWMQNVHM-UHFFFAOYSA-N 0 0 390.392 3.280 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(C(=O)N[C@H](C)CC)c2)c1 ZINC000282651666 1435855126 /nfs/dbraw/zinc/85/51/26/1435855126.db2.gz MOGUUUZZYKULLR-CQSZACIVSA-N 0 0 399.447 3.452 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1 ZINC000282654427 1435855296 /nfs/dbraw/zinc/85/52/96/1435855296.db2.gz MVXNAMDSPRLHOV-UHFFFAOYSA-N 0 0 383.404 3.446 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCOCC3)cc2C)c1 ZINC000282656997 1435855388 /nfs/dbraw/zinc/85/53/88/1435855388.db2.gz NENWCZLSTNKVNZ-UHFFFAOYSA-N 0 0 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ZINC000282816018 1435861494 /nfs/dbraw/zinc/86/14/94/1435861494.db2.gz JTPJTUSIABYZBU-UHFFFAOYSA-N 0 0 375.450 3.301 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(OCCCOC)c2)c1 ZINC000282829207 1435861968 /nfs/dbraw/zinc/86/19/68/1435861968.db2.gz LGSLFOBPPSPRRT-UHFFFAOYSA-N 0 0 388.420 3.339 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(OCC(F)(F)F)c(F)c2)c1[N+](=O)[O-] ZINC000282829808 1435862068 /nfs/dbraw/zinc/86/20/68/1435862068.db2.gz QISUIMZOPWHJTR-UHFFFAOYSA-N 0 0 376.266 3.213 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)c1 ZINC000282836549 1435862302 /nfs/dbraw/zinc/86/23/02/1435862302.db2.gz METJHMBXBGMLNY-UHFFFAOYSA-N 0 0 396.407 3.345 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(CN3CCOCC3)ccc2C)c1 ZINC000282842428 1435862582 /nfs/dbraw/zinc/86/25/82/1435862582.db2.gz MWDGJHJOMIKMNY-UHFFFAOYSA-N 0 0 399.447 3.386 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC(O)(c2ccccc2Cl)CC1 ZINC000282849731 1435862912 /nfs/dbraw/zinc/86/29/12/1435862912.db2.gz SBEDQVVADMXWTM-UHFFFAOYSA-N 0 0 393.802 3.093 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1 ZINC000282854965 1435863193 /nfs/dbraw/zinc/86/31/93/1435863193.db2.gz OJBWPJLCYLIYHF-UHFFFAOYSA-N 0 0 389.383 3.222 20 5 GGBDRN COc1ccc(C)cc1[C@@H](C)NC(=O)C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F ZINC000282885981 1435864709 /nfs/dbraw/zinc/86/47/09/1435864709.db2.gz VQQLMAXDWIDSGK-GFCCVEGCSA-N 0 0 389.383 3.175 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3CCCC4(CC4)C3)n2C[C@@H]2CCOC2)c1 ZINC000282885730 1435864755 /nfs/dbraw/zinc/86/47/55/1435864755.db2.gz BIEFVWNWSLDPFJ-HNNXBMFYSA-N 0 0 383.452 3.270 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CC2)c1 ZINC000282900628 1435865302 /nfs/dbraw/zinc/86/53/02/1435865302.db2.gz UGKZKPHWRSPLSA-OAHLLOKOSA-N 0 0 393.440 3.027 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282922563 1435866170 /nfs/dbraw/zinc/86/61/70/1435866170.db2.gz FXSIVDDFKGHJLJ-UHFFFAOYSA-N 0 0 399.447 3.159 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(F)ccc2OCCOC)c1 ZINC000282923752 1435866253 /nfs/dbraw/zinc/86/62/53/1435866253.db2.gz WPIAYMFQKJBDHU-UHFFFAOYSA-N 0 0 378.356 3.410 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)N(C(N)=O)CCC3)c1 ZINC000282926799 1435866383 /nfs/dbraw/zinc/86/63/83/1435866383.db2.gz YSLIEWKVTGWXPY-UHFFFAOYSA-N 0 0 384.392 3.077 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C(=O)Nc1ccccc1OCC1CC1 ZINC000282924866 1435866387 /nfs/dbraw/zinc/86/63/87/1435866387.db2.gz GDOUDGUWABLVJU-UHFFFAOYSA-N 0 0 397.431 3.023 20 5 GGBDRN C[C@@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2Cc2cccs2)CCO1 ZINC000282965910 1435868009 /nfs/dbraw/zinc/86/80/09/1435868009.db2.gz KSHCMCRXQKFIRY-CYBMUJFWSA-N 0 0 385.449 3.188 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2ccc3c(c2)nc(C)n3C2CC2)c1[N+](=O)[O-] ZINC000282968709 1435868254 /nfs/dbraw/zinc/86/82/54/1435868254.db2.gz SAYUFHGBRKEBOB-UHFFFAOYSA-N 0 0 382.424 3.193 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)c2ccccc2S[C@H](C)C(N)=O)cc1[N+](=O)[O-] ZINC000282974500 1435868456 /nfs/dbraw/zinc/86/84/56/1435868456.db2.gz LNFDFRBKLVMWSF-CHWSQXEVSA-N 0 0 387.461 3.360 20 5 GGBDRN CCCOc1ccccc1NC(=O)C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282995987 1435869371 /nfs/dbraw/zinc/86/93/71/1435869371.db2.gz LLHGSBBLWIZTAM-UHFFFAOYSA-N 0 0 385.420 3.023 20 5 GGBDRN COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)O1 ZINC000283038132 1435871523 /nfs/dbraw/zinc/87/15/23/1435871523.db2.gz AXLSOWOBCSUGPW-LSZYVWPRSA-N 0 0 390.436 3.042 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)c1 ZINC000283061336 1435872754 /nfs/dbraw/zinc/87/27/54/1435872754.db2.gz IHGCASJJNLLJJN-HNNXBMFYSA-N 0 0 397.431 3.119 20 5 GGBDRN Cc1nc(COc2ccccc2C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)no1 ZINC000283082003 1435873632 /nfs/dbraw/zinc/87/36/32/1435873632.db2.gz DPZGKSINWMNAOJ-UHFFFAOYSA-N 0 0 396.403 3.180 20 5 GGBDRN CC(=O)CCc1ccc(OCC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000283086633 1435873721 /nfs/dbraw/zinc/87/37/21/1435873721.db2.gz DVXLBCCDONVEPA-UHFFFAOYSA-N 0 0 384.432 3.196 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C(=O)Nc1ccc(OCC2CC2)cc1 ZINC000283160084 1435877320 /nfs/dbraw/zinc/87/73/20/1435877320.db2.gz ZFUGNDYDSACZQG-UHFFFAOYSA-N 0 0 397.431 3.023 20 5 GGBDRN CC(C)Oc1ccccc1NC(=O)C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283167340 1435877630 /nfs/dbraw/zinc/87/76/30/1435877630.db2.gz ZUSWSKDNKAQZNM-UHFFFAOYSA-N 0 0 385.420 3.022 20 5 GGBDRN CCn1nccc1C1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC)CC1 ZINC000283171778 1435877781 /nfs/dbraw/zinc/87/77/81/1435877781.db2.gz PMJPUUSTWHCWEJ-UHFFFAOYSA-N 0 0 395.467 3.474 20 5 GGBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCO[C@@H](c2ccccc2F)C1 ZINC000283193673 1435878731 /nfs/dbraw/zinc/87/87/31/1435878731.db2.gz OVKHRSRRKPQQBD-QGZVFWFLSA-N 0 0 383.383 3.107 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(-c2cccnc2)n1C[C@H]1CCCO1 ZINC000283222733 1435880028 /nfs/dbraw/zinc/88/00/28/1435880028.db2.gz CIGBCSNJPBKWOW-QGZVFWFLSA-N 0 0 394.435 3.064 20 5 GGBDRN CCOC(=O)COc1ccc(NC(=O)c2cc(OCC)ccc2[N+](=O)[O-])cc1 ZINC000283231365 1435880387 /nfs/dbraw/zinc/88/03/87/1435880387.db2.gz PMBHKZXNBOWYEC-UHFFFAOYSA-N 0 0 388.376 3.188 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(N3C[C@@H]4CCC[C@@H]4C3)n2C[C@H]2CCCO2)cc1 ZINC000283248004 1435881144 /nfs/dbraw/zinc/88/11/44/1435881144.db2.gz DOITYKMJMIJPSA-SOLBZPMBSA-N 0 0 383.452 3.269 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)c1 ZINC000283321761 1435884259 /nfs/dbraw/zinc/88/42/59/1435884259.db2.gz XGLHGCLFQSAXKM-UHFFFAOYSA-N 0 0 387.392 3.132 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(F)cc2OCCC(F)(F)F)c1[N+](=O)[O-] ZINC000283342715 1435885163 /nfs/dbraw/zinc/88/51/63/1435885163.db2.gz QJVLAJCSKIYUIW-UHFFFAOYSA-N 0 0 390.293 3.359 20 5 GGBDRN C[C@@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccc([S@](C)=O)cc1 ZINC000283369666 1435886419 /nfs/dbraw/zinc/88/64/19/1435886419.db2.gz CMQFWDBEFWNQLO-ASHKIFAZSA-N 0 0 389.477 3.277 20 5 GGBDRN Cc1ccnc(OC2CCN(c3nnc(-c4cccc([N+](=O)[O-])c4)n3C)CC2)c1 ZINC000283368547 1435886447 /nfs/dbraw/zinc/88/64/47/1435886447.db2.gz CFONPVHUPBINAZ-UHFFFAOYSA-N 0 0 394.435 3.142 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)c1 ZINC000283416323 1435888866 /nfs/dbraw/zinc/88/88/66/1435888866.db2.gz IERSDQKGJUNAKC-LBPRGKRZSA-N 0 0 381.429 3.027 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N[C@H]1CCCC12CCOCC2 ZINC000283429506 1435889459 /nfs/dbraw/zinc/88/94/59/1435889459.db2.gz HFNNVIVTAICIHO-AWEZNQCLSA-N 0 0 390.408 3.352 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000283430843 1435889462 /nfs/dbraw/zinc/88/94/62/1435889462.db2.gz SKABJVSUXXSYBH-CABCVRRESA-N 0 0 377.404 3.270 20 5 GGBDRN C[C@@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])c(F)cc3N)cc2)C[C@@H](C)O1 ZINC000283499887 1435892703 /nfs/dbraw/zinc/89/27/03/1435892703.db2.gz OTTUGSDANGUENP-VXGBXAGGSA-N 0 0 388.399 3.182 20 5 GGBDRN CCc1nc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)nn1-c1ccccc1F ZINC000283574603 1435896135 /nfs/dbraw/zinc/89/61/35/1435896135.db2.gz KNXMAHUXZOFSHB-UHFFFAOYSA-N 0 0 397.410 3.192 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000283597813 1435897206 /nfs/dbraw/zinc/89/72/06/1435897206.db2.gz YAASCJQTFDLXKR-CYBMUJFWSA-N 0 0 375.356 3.126 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCCc1ccc2c(c1)CC(=O)N2 ZINC000283608425 1435897757 /nfs/dbraw/zinc/89/77/57/1435897757.db2.gz NBRPYZYWNQUUTI-UHFFFAOYSA-N 0 0 381.432 3.113 20 5 GGBDRN COCc1nnc(-c2cccc(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)c2)o1 ZINC000283642705 1435899140 /nfs/dbraw/zinc/89/91/40/1435899140.db2.gz PSDNAHXOSKCZNR-UHFFFAOYSA-N 0 0 396.403 3.106 20 5 GGBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(n2c(=O)[nH]c3ccccc32)CC1 ZINC000283687130 1435904077 /nfs/dbraw/zinc/90/40/77/1435904077.db2.gz YISLXHWTDROMFY-UHFFFAOYSA-N 0 0 380.404 3.282 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(CN2CCCC2=O)cc1 ZINC000283700649 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COc1cc(-c2nc(C(C)(C)NC(=O)OC(C)(C)C)no2)ccc1[N+](=O)[O-] ZINC000283864777 1435939872 /nfs/dbraw/zinc/93/98/72/1435939872.db2.gz KVGSTYGAAINKSB-UHFFFAOYSA-N 0 0 378.385 3.413 20 5 GGBDRN CCn1cnnc1[C@@H]1CCCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2F)C1 ZINC000283896382 1435947499 /nfs/dbraw/zinc/94/74/99/1435947499.db2.gz JGAYZVHMWQZHGU-GFCCVEGCSA-N 0 0 376.392 3.065 20 5 GGBDRN CC(=O)c1cc(N2CCC(NC(=O)NC3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000283909955 1435950767 /nfs/dbraw/zinc/95/07/67/1435950767.db2.gz WNQYKDLGFOQVJW-UHFFFAOYSA-N 0 0 388.468 3.398 20 5 GGBDRN O=[N+]([O-])c1ccc(CNc2ccccc2N2CCC(CO)CC2)c([N+](=O)[O-])c1 ZINC000283939678 1435957622 /nfs/dbraw/zinc/95/76/22/1435957622.db2.gz FLFIVTREBGOEER-UHFFFAOYSA-N 0 0 386.408 3.324 20 5 GGBDRN CC[C@H](NC(=O)C(=O)N[C@@H](C)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000283962764 1435962436 /nfs/dbraw/zinc/96/24/36/1435962436.db2.gz KZYMMUUBWOJUQJ-ZBEGNZNMSA-N 0 0 391.374 3.318 20 5 GGBDRN O=C(NCc1ccco1)[C@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000284035449 1435977661 /nfs/dbraw/zinc/97/76/61/1435977661.db2.gz OXYAZXBADOAREM-CQSZACIVSA-N 0 0 392.799 3.154 20 5 GGBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000284042018 1435979055 /nfs/dbraw/zinc/97/90/55/1435979055.db2.gz IZXNZHBIIUPCML-ZDUSSCGKSA-N 0 0 384.392 3.481 20 5 GGBDRN COc1cc(-c2nc(CCNC(=O)OC(C)(C)C)no2)cc([N+](=O)[O-])c1C ZINC000284070520 1435985357 /nfs/dbraw/zinc/98/53/57/1435985357.db2.gz UQDJQQTYDKNQES-UHFFFAOYSA-N 0 0 378.385 3.029 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)Cc1ccc(C(F)(F)F)cn1 ZINC000284101715 1435990735 /nfs/dbraw/zinc/99/07/35/1435990735.db2.gz WEKRZQIIGXZFBP-UHFFFAOYSA-N 0 0 390.339 3.132 20 5 GGBDRN Cc1cc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n(C)n1 ZINC000284143269 1435998064 /nfs/dbraw/zinc/99/80/64/1435998064.db2.gz PXNUOKCHKVWIKZ-CQSZACIVSA-N 0 0 394.435 3.135 20 5 GGBDRN Cc1cc(F)c(NC(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000284150624 1435999943 /nfs/dbraw/zinc/99/99/43/1435999943.db2.gz VVKQTHVIJFWKCQ-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN O=C([C@H]1CCC(=O)c2ccccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000284202406 1436003733 /nfs/dbraw/zinc/00/37/33/1436003733.db2.gz ZFOUFITWZUIIDK-IBGZPJMESA-N 0 0 379.416 3.004 20 5 GGBDRN C[C@@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000284237544 1436006160 /nfs/dbraw/zinc/00/61/60/1436006160.db2.gz VKWBEFCCUHULKN-GFCCVEGCSA-N 0 0 386.364 3.310 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1F ZINC000284259724 1436007980 /nfs/dbraw/zinc/00/79/80/1436007980.db2.gz QMPDFCYMLOODGO-STQMWFEESA-N 0 0 395.431 3.418 20 5 GGBDRN CCn1c(-c2ccc[nH]2)nnc1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000284293948 1436010666 /nfs/dbraw/zinc/01/06/66/1436010666.db2.gz GHBPQYBZMIBNGB-UHFFFAOYSA-N 0 0 382.424 3.249 20 5 GGBDRN COc1cc(CCNC(=O)[C@H]2CCC(=O)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000284414276 1436019858 /nfs/dbraw/zinc/01/98/58/1436019858.db2.gz DVJFUFNVRQQCOE-INIZCTEOSA-N 0 0 398.415 3.031 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC3(CCOCC3)CC2)cc1OC ZINC000284436030 1436021784 /nfs/dbraw/zinc/02/17/84/1436021784.db2.gz JMNYLHHOWAEQJP-UHFFFAOYSA-N 0 0 378.425 3.035 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1CC(=O)c1ccc(F)cc1 ZINC000284460830 1436023360 /nfs/dbraw/zinc/02/33/60/1436023360.db2.gz RWSKYBGMZKSYFT-CYBMUJFWSA-N 0 0 389.358 3.333 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@H](c3cccc(OC)c3)C2)c1 ZINC000284527315 1436028098 /nfs/dbraw/zinc/02/80/98/1436028098.db2.gz WNYWBGMPOXQZRE-LJQANCHMSA-N 0 0 386.404 3.216 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)c1F ZINC000284561417 1436030529 /nfs/dbraw/zinc/03/05/29/1436030529.db2.gz FBODONQHNHXZFY-CQSZACIVSA-N 0 0 386.383 3.079 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC(C(=O)NC3CCCCC3)CC2)c1F ZINC000284594264 1436033028 /nfs/dbraw/zinc/03/30/28/1436033028.db2.gz IBBWYNKOTNCYCJ-UHFFFAOYSA-N 0 0 391.443 3.343 20 5 GGBDRN CCS(=O)(=O)c1ccc([C@@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000284717597 1436042725 /nfs/dbraw/zinc/04/27/25/1436042725.db2.gz JDNZVCPBQAOAIT-GFCCVEGCSA-N 0 0 389.433 3.380 20 5 GGBDRN COc1ccc(CCNC(=O)c2cc([N+](=O)[O-])cc(C)c2F)c(OC)c1OC ZINC000284735223 1436044627 /nfs/dbraw/zinc/04/46/27/1436044627.db2.gz SLRFIVCSDLJWPH-UHFFFAOYSA-N 0 0 392.383 3.041 20 5 GGBDRN CCS(=O)(=O)c1ccc([C@@H](C)[NH2+]CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000284775627 1436048651 /nfs/dbraw/zinc/04/86/51/1436048651.db2.gz NMKSSPJYZDUUIZ-CQSZACIVSA-N 0 0 378.450 3.118 20 5 GGBDRN O=[N+]([O-])c1ccc(NCc2ccc(C[NH+]3CCCCC3)cc2)c(-c2nn[n-]n2)c1 ZINC000823639848 1442046532 /nfs/dbraw/zinc/04/65/32/1442046532.db2.gz ITPURKLRPIFURJ-UHFFFAOYSA-N 0 0 393.451 3.373 20 5 GGBDRN CCc1ccc([C@@H](CNc2ccc(-c3nnn[n-]3)c([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000821482035 1443904318 /nfs/dbraw/zinc/90/43/18/1443904318.db2.gz PNMHKTIWWJMSMI-GOSISDBHSA-N 0 0 381.440 3.052 20 5 GGBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824658252 1446826432 /nfs/dbraw/zinc/82/64/32/1446826432.db2.gz VFHYNVAXAWICHL-ZBFHGGJFSA-N 0 0 393.451 3.097 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CNCc3ccc(-c4nn[n-]n4)cc3)cs2)c1 ZINC000738366658 1447253686 /nfs/dbraw/zinc/25/36/86/1447253686.db2.gz GVTNLEPDVFJLDJ-UHFFFAOYSA-N 0 0 393.432 3.188 20 5 GGBDRN CC[C@H]([NH2+]CCCOc1cccc(-c2nn[n-]n2)c1)c1cccc([N+](=O)[O-])c1 ZINC000825142898 1450038761 /nfs/dbraw/zinc/03/87/61/1450038761.db2.gz TXABOZMYHSCDHV-SFHVURJKSA-N 0 0 382.424 3.285 20 5 GGBDRN O=C1Nc2ccccc2[C@H]2CN(C(F)(F)c3ccc([N+](=O)[O-])c(Cl)n3)C[C@@H]12 ZINC001164409594 718856267 /nfs/dbraw/zinc/85/62/67/718856267.db2.gz VXFVQJIPJHZTDS-GHMZBOCLSA-N 0 0 394.765 3.360 20 5 GGBDRN CC(C)n1nc(CN(C)C)c2c1CN(c1cc(Cl)ncc1[N+](=O)[O-])CC2 ZINC001164646211 719308552 /nfs/dbraw/zinc/30/85/52/719308552.db2.gz CJDRAYYTGFLHGV-UHFFFAOYSA-N 0 0 378.864 3.045 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])c(N2CCc3c(CN(C)C)nn(C(C)C)c3C2)n1 ZINC001164649122 719310042 /nfs/dbraw/zinc/31/00/42/719310042.db2.gz ODINXMHJYJKWBQ-UHFFFAOYSA-N 0 0 392.891 3.353 20 5 GGBDRN Cc1cnc(N2CCC3(CC2)CN(Cc2cccs2)CCO3)c([N+](=O)[O-])c1 ZINC001164695304 719886938 /nfs/dbraw/zinc/88/69/38/719886938.db2.gz MNTROBFQZMAFTL-UHFFFAOYSA-N 0 0 388.493 3.231 20 5 GGBDRN O=[N+]([O-])c1ccc(C(F)(F)N2CC[C@@H](O)[C@@H]2Cc2ccccc2)nc1Cl ZINC001164830946 720486992 /nfs/dbraw/zinc/48/69/92/720486992.db2.gz CVWUVDHUVWTPOR-UONOGXRCSA-N 0 0 383.782 3.370 20 5 GGBDRN O=[N+]([O-])c1ccc(C(F)(F)N2CC[C@@H](O)[C@H]2Cc2ccccc2)nc1Cl ZINC001164830948 720487121 /nfs/dbraw/zinc/48/71/21/720487121.db2.gz CVWUVDHUVWTPOR-ZIAGYGMSSA-N 0 0 383.782 3.370 20 5 GGBDRN CC[C@@H]1N(C(F)(F)c2cnc(Cl)c([N+](=O)[O-])c2)CCC[C@@]12CCC(=O)N2 ZINC001164844890 720746690 /nfs/dbraw/zinc/74/66/90/720746690.db2.gz VDFOXIOOMRKOKU-SWLSCSKDSA-N 0 0 388.802 3.216 20 5 GGBDRN CC[C@H]1N(C(F)(F)c2cnc(Cl)c([N+](=O)[O-])c2)CCC[C@@]12CCC(=O)N2 ZINC001164844889 720746766 /nfs/dbraw/zinc/74/67/66/720746766.db2.gz VDFOXIOOMRKOKU-IUODEOHRSA-N 0 0 388.802 3.216 20 5 GGBDRN CC[C@H]1N(C(F)(F)c2cnc(Cl)c([N+](=O)[O-])c2)CCC[C@]12CCC(=O)N2 ZINC001164844888 720747365 /nfs/dbraw/zinc/74/73/65/720747365.db2.gz VDFOXIOOMRKOKU-DOMZBBRYSA-N 0 0 388.802 3.216 20 5 GGBDRN O=[N+]([O-])c1cccc2nc(N3C[C@H]4CN(Cc5nccs5)C[C@@H]4C3)ccc21 ZINC001164783435 721407765 /nfs/dbraw/zinc/40/77/65/721407765.db2.gz IIFADLBMYCSMMF-ZIAGYGMSSA-N 0 0 381.461 3.168 20 5 GGBDRN CN(Cc1ccco1)Cc1cncc2c1CCN(c1cc([N+](=O)[O-])ccn1)C2 ZINC001164908911 721744034 /nfs/dbraw/zinc/74/40/34/721744034.db2.gz OEIARWXJMLZLFJ-UHFFFAOYSA-N 0 0 379.420 3.173 20 5 GGBDRN O=[N+]([O-])c1cnc(Cl)c(C(F)(F)N2CCc3ncnc(C4CC4)c3CC2)c1 ZINC001164917419 721803651 /nfs/dbraw/zinc/80/36/51/721803651.db2.gz WKQBUAAMKVURLT-UHFFFAOYSA-N 0 0 395.797 3.461 20 5 GGBDRN Cc1cnc2n1CCN(C)C21CCN(c2ccc3cccc([N+](=O)[O-])c3n2)CC1 ZINC001164916841 721815071 /nfs/dbraw/zinc/81/50/71/721815071.db2.gz IINXZFCITOJSAX-UHFFFAOYSA-N 0 0 392.463 3.089 20 5 GGBDRN O=[N+]([O-])c1ccccc1-c1cc(C(F)(F)N2CC[C@@H](CO)C2)c(Cl)nn1 ZINC001165033222 721879659 /nfs/dbraw/zinc/87/96/59/721879659.db2.gz NPCSRNSIDABXRB-SNVBAGLBSA-N 0 0 384.770 3.069 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(Cl)nc1N1CCN(CCOc2ccccc2)CC1 ZINC001165043814 721954612 /nfs/dbraw/zinc/95/46/12/721954612.db2.gz CVBZYGDZILAMGW-UHFFFAOYSA-N 0 0 397.262 3.498 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(C=Cc3ccc(-c4nn[nH]n4)cn3)cs2)c1 ZINC000738368053 945262951 /nfs/dbraw/zinc/26/29/51/945262951.db2.gz ZKXMNFXKKMRYDD-VOTSOKGWSA-N 0 0 377.389 3.464 20 5 GGBDRN C[C@@H]1CN(c2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)Cc2ccccc21 ZINC000736291271 944788662 /nfs/dbraw/zinc/78/86/62/944788662.db2.gz UXDKVQXXOHBZKA-GFCCVEGCSA-N 0 0 387.403 3.447 20 5 GGBDRN CCS[C@@H]1CCC[C@H]1Nc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000821456952 945700105 /nfs/dbraw/zinc/70/01/05/945700105.db2.gz SZGKNSKDIUIENC-HUUCEWRRSA-N 0 0 385.453 3.409 20 5 GGBDRN CC(=O)c1cccc(CNc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)c1 ZINC001573555428 946909526 /nfs/dbraw/zinc/90/95/26/946909526.db2.gz LMEHXBAGKIXKMQ-UHFFFAOYSA-N 0 0 389.375 3.138 20 5 GGBDRN Cc1cc(N(C)Cc2ccc(-c3nn[nH]n3)cc2)c2cccc([N+](=O)[O-])c2n1 ZINC000826268515 947775442 /nfs/dbraw/zinc/77/54/42/947775442.db2.gz ASIJSTVJWKFMJK-UHFFFAOYSA-N 0 0 375.392 3.268 20 5 GGBDRN O=C(C[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1ccc(F)cc1 ZINC000826405005 948232480 /nfs/dbraw/zinc/23/24/80/948232480.db2.gz SFPZMWDRRHOYGG-AWEZNQCLSA-N 0 0 396.382 3.156 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1Sc1cccc(-c2nn[nH]n2)n1 ZINC000826497580 948411673 /nfs/dbraw/zinc/41/16/73/948411673.db2.gz MIHCYKALYBGPBU-UHFFFAOYSA-N 0 0 379.199 3.084 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000826497688 948412030 /nfs/dbraw/zinc/41/20/30/948412030.db2.gz QCUUFKNGCQFUST-CYBMUJFWSA-N 0 0 385.815 3.119 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3ccc(Cl)cc3)C2)c(-c2nn[nH]n2)c1 ZINC000826499099 948413633 /nfs/dbraw/zinc/41/36/33/948413633.db2.gz VVJXQGUQKYPDKJ-GFCCVEGCSA-N 0 0 385.815 3.119 20 5 GGBDRN CC(C)(C)c1ccc(C(=O)NCc2ccc(-c3nn[nH]n3)c(F)c2)cc1[N+](=O)[O-] ZINC001573881987 950763100 /nfs/dbraw/zinc/76/31/00/950763100.db2.gz MURKJHYSQJCECJ-UHFFFAOYSA-N 0 0 398.398 3.142 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccccc1)[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001595159600 952188602 /nfs/dbraw/zinc/18/86/02/952188602.db2.gz VERXPHLYZOENQW-CQSZACIVSA-N 0 0 379.210 3.143 20 5 GGBDRN O=C([O-])[C@H]1C[C@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC001595201522 952315285 /nfs/dbraw/zinc/31/52/85/952315285.db2.gz LAWYJEYTMIKUTF-JCNLHEQBSA-N 0 0 392.415 3.400 20 5 GGBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@]2(C)C(=O)[O-])cc1OC ZINC001589458859 954855350 /nfs/dbraw/zinc/85/53/50/954855350.db2.gz NUTWVBVXZKAWOX-BFUOFWGJSA-N 0 0 380.441 3.467 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001574748231 957713979 /nfs/dbraw/zinc/71/39/79/957713979.db2.gz KVDCYEOFGURMGN-CQSZACIVSA-N 0 0 379.210 3.143 20 5 GGBDRN C[C@@](C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-])(C(=O)[O-])c1ccccc1 ZINC001603193530 972298506 /nfs/dbraw/zinc/29/85/06/972298506.db2.gz XNFOSUYULDAHBG-KRWDZBQOSA-N 0 0 393.237 3.489 20 5 GGBDRN COc1ccc(-c2ccc(C[NH2+][C@@H](Cc3ccncc3)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC001594071309 958186763 /nfs/dbraw/zinc/18/67/63/958186763.db2.gz RWYHRMBTUDAVKL-KRWDZBQOSA-N 0 0 397.387 3.044 20 5 GGBDRN COc1cc(C[N@@H+]2CC[C@@H](C(=O)[O-])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000263382354 962539652 /nfs/dbraw/zinc/53/96/52/962539652.db2.gz BZTSALZQFWBYQX-MRXNPFEDSA-N 0 0 386.404 3.089 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Br ZINC001595192840 970324406 /nfs/dbraw/zinc/32/44/06/970324406.db2.gz VKMXJADZBYZCLN-HNNXBMFYSA-N 0 0 379.210 3.143 20 5 GGBDRN O=C([O-])C1(CC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)CCC1 ZINC001605950469 972909576 /nfs/dbraw/zinc/90/95/76/972909576.db2.gz KIKUWBKRNJUVMF-QAQDUYKDSA-N 0 0 376.453 3.345 20 5 GGBDRN CC[C@H]1CN(c2nc(C)cc(C(=O)[O-])c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000514675683 974290374 /nfs/dbraw/zinc/29/03/74/974290374.db2.gz VFDHLQZRYPQRGN-INIZCTEOSA-N 0 0 384.436 3.097 20 5 GGBDRN CC[C@@H]1CN(c2nc(C)cc(C(=O)[O-])c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000514675684 974291005 /nfs/dbraw/zinc/29/10/05/974291005.db2.gz VFDHLQZRYPQRGN-MRXNPFEDSA-N 0 0 384.436 3.097 20 5 GGBDRN CSc1ccc([C@H](CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000563815071 974539346 /nfs/dbraw/zinc/53/93/46/974539346.db2.gz ZYWDLDYLRXBBOU-HNNXBMFYSA-N 0 0 376.438 3.125 20 5 GGBDRN CC(C)c1ccc(CN2CCN(c3ncc(C(=O)[O-])cc3[N+](=O)[O-])CC2)cc1 ZINC000565039677 974564844 /nfs/dbraw/zinc/56/48/44/974564844.db2.gz DIVWUMKUKWBLKD-UHFFFAOYSA-N 0 0 384.436 3.134 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000566292233 974603052 /nfs/dbraw/zinc/60/30/52/974603052.db2.gz ZTMBKUHELKXCBN-HOCLYGCPSA-N 0 0 384.436 3.319 20 5 GGBDRN Cc1cc(N2CCC([NH2+]CCOc3ccccc3)CC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000566297752 974605389 /nfs/dbraw/zinc/60/53/89/974605389.db2.gz SFSJGEBSHSUJSC-UHFFFAOYSA-N 0 0 399.447 3.239 20 5 GGBDRN Cc1cc(NC[C@H]2C[N@H+](Cc3ccccc3)CCCO2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000566564006 974617121 /nfs/dbraw/zinc/61/71/21/974617121.db2.gz PDSNVDDMOJBUJA-SFHVURJKSA-N 0 0 399.447 3.304 20 5 GGBDRN CC[NH+]1CCN(Cc2ccccc2CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1 ZINC000566563714 974617253 /nfs/dbraw/zinc/61/72/53/974617253.db2.gz LEQLFCRAZZRRRD-UHFFFAOYSA-N 0 0 398.463 3.043 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000567977060 974651111 /nfs/dbraw/zinc/65/11/11/974651111.db2.gz YPKNVMMFSIQNAN-HNNXBMFYSA-N 0 0 384.436 3.097 20 5 GGBDRN O=C([O-])c1cnc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000568887766 974680493 /nfs/dbraw/zinc/68/04/93/974680493.db2.gz IACZIAQZEZGPLM-ALOPSCKCSA-N 0 0 382.420 3.296 20 5 GGBDRN CC(C)Oc1ccc([C@H](CNc2nc(C(=O)[O-])ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000569696927 974697180 /nfs/dbraw/zinc/69/71/80/974697180.db2.gz FVYVPOJWCRISJQ-KRWDZBQOSA-N 0 0 388.424 3.190 20 5 GGBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)n1 ZINC000572042720 974740819 /nfs/dbraw/zinc/74/08/19/974740819.db2.gz AHGWZMGFQGLHQE-LBPRGKRZSA-N 0 0 376.438 3.074 20 5 GGBDRN O=C([O-])c1ccnc(N2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1[N+](=O)[O-] ZINC000573890105 974772498 /nfs/dbraw/zinc/77/24/98/974772498.db2.gz FKDUPASLCLSHGI-UHFFFAOYSA-N 0 0 396.447 3.181 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)n1 ZINC000575127849 974795870 /nfs/dbraw/zinc/79/58/70/974795870.db2.gz SGBLTVDJSDNACB-HNNXBMFYSA-N 0 0 398.463 3.405 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1CCC1CCN(c2nccc(C(=O)[O-])c2[N+](=O)[O-])CC1 ZINC000578536760 974857436 /nfs/dbraw/zinc/85/74/36/974857436.db2.gz MDSOAFDYTQDQDO-CQSZACIVSA-N 0 0 376.457 3.169 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)n1 ZINC000580569619 974896910 /nfs/dbraw/zinc/89/69/10/974896910.db2.gz YAYZCHFVRINXOR-HNNXBMFYSA-N 0 0 376.457 3.089 20 5 GGBDRN COc1cc(C[N@H+](CC(=O)[O-])C2CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000581440416 974910599 /nfs/dbraw/zinc/91/05/99/974910599.db2.gz GQNYIXMESBGRQF-UHFFFAOYSA-N 0 0 388.367 3.077 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)n1 ZINC000582788361 974931569 /nfs/dbraw/zinc/93/15/69/974931569.db2.gz HCWUJFWDKXISGZ-HOCLYGCPSA-N 0 0 384.436 3.461 20 5 GGBDRN COc1ccccc1[C@@H](CNc1ccc(CC(=O)[O-])cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000592966641 974976837 /nfs/dbraw/zinc/97/68/37/974976837.db2.gz FYUUHKXVOFRWJW-LJQANCHMSA-N 0 0 399.447 3.480 20 5 GGBDRN Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(N2CCC[N@H+](Cc3ccccc3C)CC2)n1 ZINC000592968685 974976900 /nfs/dbraw/zinc/97/69/00/974976900.db2.gz BJHHNQXULDKUOZ-UHFFFAOYSA-N 0 0 384.436 3.017 20 5 GGBDRN COc1ccccc1[C@H](CNc1ccc(CC(=O)[O-])cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000592966634 974977054 /nfs/dbraw/zinc/97/70/54/974977054.db2.gz FYUUHKXVOFRWJW-IBGZPJMESA-N 0 0 399.447 3.480 20 5 GGBDRN O=C([O-])c1ccnc(N[C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-] ZINC000592976944 974978597 /nfs/dbraw/zinc/97/85/97/974978597.db2.gz IMXBGDWGWCBQMH-CGTJXYLNSA-N 0 0 396.447 3.401 20 5 GGBDRN O=C([O-])c1cnc(N[C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c([N+](=O)[O-])c1 ZINC000592976829 974978629 /nfs/dbraw/zinc/97/86/29/974978629.db2.gz AWBLNPIWUHULJS-BPQIPLTHSA-N 0 0 396.447 3.401 20 5 GGBDRN O=C([O-])c1cnc(N[C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c([N+](=O)[O-])c1 ZINC000592976833 974978829 /nfs/dbraw/zinc/97/88/29/974978829.db2.gz AWBLNPIWUHULJS-KBAYOESNSA-N 0 0 396.447 3.401 20 5 GGBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCC(C(=O)[O-])CC2)cc1OC ZINC000593733269 974984608 /nfs/dbraw/zinc/98/46/08/974984608.db2.gz KMUTZDYGRRFDEU-ZDUSSCGKSA-N 0 0 380.441 3.325 20 5 GGBDRN CC(C)OC(=O)c1ccc(C[NH2+][C@@](C)(C(=O)[O-])c2cccc([N+](=O)[O-])c2)cc1 ZINC001591686063 975490107 /nfs/dbraw/zinc/49/01/07/975490107.db2.gz WVXNREAZMFIUQJ-HXUWFJFHSA-N 0 0 386.404 3.250 20 5 GGBDRN CC(C)n1c(Sc2cc(C(=O)[O-])ccc2[N+](=O)[O-])nnc1C1CC[NH2+]CC1 ZINC001592121436 976929684 /nfs/dbraw/zinc/92/96/84/976929684.db2.gz UJEOYUIJWFYTME-UHFFFAOYSA-N 0 0 391.453 3.084 20 5 GGBDRN C[C@H](CC(=O)Nc1cccc(C(=O)[O-])c1)[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001592269343 977527680 /nfs/dbraw/zinc/52/76/80/977527680.db2.gz QIYXADGLGGYULI-ZIAGYGMSSA-N 0 0 385.420 3.403 20 5 GGBDRN C[C@](CC(=O)[O-])([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1cccnc1 ZINC001592328624 977748614 /nfs/dbraw/zinc/74/86/14/977748614.db2.gz NJEZLFCWAAUAGM-MRXNPFEDSA-N 0 0 394.225 3.232 20 5 GGBDRN C[C@H](C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccccc1)C(=O)[O-] ZINC001592604502 978543444 /nfs/dbraw/zinc/54/34/44/978543444.db2.gz DPQACMNJNVSYBO-CQSZACIVSA-N 0 0 396.403 3.368 20 5 GGBDRN O=C([O-])c1cc(C(=O)NCc2ccc(C[NH+]3CCCCC3)cc2)cc([N+](=O)[O-])c1 ZINC000738672937 978586023 /nfs/dbraw/zinc/58/60/23/978586023.db2.gz NPYMHNCWYHJZFU-UHFFFAOYSA-N 0 0 397.431 3.209 20 5 GGBDRN C[C@H](C[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)Oc1ccc(Cl)cc1 ZINC001592712886 979208640 /nfs/dbraw/zinc/20/86/40/979208640.db2.gz VXSUJTJPMAYWCH-GFCCVEGCSA-N 0 0 394.811 3.269 20 5 GGBDRN O=C([O-])Cc1ccc(N2CCC[N@H+](Cc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000844206621 979353494 /nfs/dbraw/zinc/35/34/94/979353494.db2.gz GTXJAKAFFINLOZ-UHFFFAOYSA-N 0 0 387.411 3.073 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2ccc(CC(=O)[O-])cc2[N+](=O)[O-])C1 ZINC000844207200 979356154 /nfs/dbraw/zinc/35/61/54/979356154.db2.gz CBFRXJLHVMAJHE-RDJZCZTQSA-N 0 0 375.469 3.313 20 5 GGBDRN Cc1cc(NCc2ccccc2C[N@@H+]2CCC[C@H]2CO)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000844212371 979368899 /nfs/dbraw/zinc/36/88/99/979368899.db2.gz HJKTZFJYGJQSTC-KRWDZBQOSA-N 0 0 399.447 3.170 20 5 GGBDRN C[C@](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)(C(=O)[O-])c1ccccc1 ZINC000844938610 979402710 /nfs/dbraw/zinc/40/27/10/979402710.db2.gz JYLAUOJXIILFSJ-OAQYLSRUSA-N 0 0 383.448 3.196 20 5 GGBDRN O=C([O-])C[N@H+](Cc1ccc(C(F)(F)F)cc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000846269562 979435232 /nfs/dbraw/zinc/43/52/32/979435232.db2.gz SFDJGWHTLCEHJM-INIZCTEOSA-N 0 0 398.337 3.234 20 5 GGBDRN CCC(CC)[C@H](CNc1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000859994125 979654169 /nfs/dbraw/zinc/65/41/69/979654169.db2.gz RURZNHDEHGJNGS-FNQPIQQGSA-N 0 0 391.468 3.242 20 5 GGBDRN CCC(CC)[C@@H](CNc1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000859994128 979654317 /nfs/dbraw/zinc/65/43/17/979654317.db2.gz RURZNHDEHGJNGS-ZLQZBKBYSA-N 0 0 391.468 3.242 20 5 GGBDRN CC[C@]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)(C(=O)[O-])c1ccc(Cl)cc1 ZINC001595293851 980404489 /nfs/dbraw/zinc/40/44/89/980404489.db2.gz YVQATVIMCNAGIM-FUHWJXTLSA-N 0 0 378.812 3.261 20 5 GGBDRN O=C([O-])CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000901677359 980440329 /nfs/dbraw/zinc/44/03/29/980440329.db2.gz JHVDXDODKWSABY-GFCCVEGCSA-N 0 0 377.224 3.357 20 5 GGBDRN O=C([O-])CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000901677360 980440356 /nfs/dbraw/zinc/44/03/56/980440356.db2.gz JHVDXDODKWSABY-LBPRGKRZSA-N 0 0 377.224 3.357 20 5 GGBDRN O=C([O-])[C@@]1(c2ccccc2)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000901826605 980546397 /nfs/dbraw/zinc/54/63/97/980546397.db2.gz ITGBHGDKDYKGOF-IBGZPJMESA-N 0 0 392.358 3.425 20 5 GGBDRN Cc1cc([C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C(=O)[O-])ccc1F ZINC000901843012 980563399 /nfs/dbraw/zinc/56/33/99/980563399.db2.gz CIBXEMIHRBVQJG-IBGZPJMESA-N 0 0 387.411 3.427 20 5 GGBDRN O=C([O-])C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CCOCC1 ZINC000901984023 980664481 /nfs/dbraw/zinc/66/44/81/980664481.db2.gz MMJGHYMDWZTWGK-UHFFFAOYSA-N 0 0 376.434 3.389 20 5 GGBDRN CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H](C(=O)[O-])C1 ZINC000902032209 980703891 /nfs/dbraw/zinc/70/38/91/980703891.db2.gz LGVHNTVUBSMFIN-WBMJQRKESA-N 0 0 376.434 3.387 20 5 GGBDRN CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001595482340 981206852 /nfs/dbraw/zinc/20/68/52/981206852.db2.gz HITIETYPVTXSDV-QGZVFWFLSA-N 0 0 399.447 3.289 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)[NH2+]Cc3cc(C(=O)[O-])ccc3[N+](=O)[O-])ccc2NC1=O ZINC001595499644 981265732 /nfs/dbraw/zinc/26/57/32/981265732.db2.gz NQTCWYKHTHPFIY-GTNSWQLSSA-N 0 0 399.403 3.253 20 5 GGBDRN CC[C@](C)(C(=O)[O-])[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CC1 ZINC001594778209 981773351 /nfs/dbraw/zinc/77/33/51/981773351.db2.gz KYAGDJWZEYXJGV-QGZVFWFLSA-N 0 0 383.832 3.152 20 5 GGBDRN CCCC[C@H](C(=O)[O-])[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC001595628236 981782693 /nfs/dbraw/zinc/78/26/93/981782693.db2.gz QWLGOYCZKVWAAA-OAHLLOKOSA-N 0 0 389.374 3.379 20 5 GGBDRN CC[C@@](C)(C(=O)[O-])[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC1CC1 ZINC001594787922 981829845 /nfs/dbraw/zinc/82/98/45/981829845.db2.gz PSIDYDIDJFNPCT-IBGZPJMESA-N 0 0 377.441 3.197 20 5 GGBDRN CC[C@](C)(C(=O)[O-])[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC1CC1 ZINC001594787924 981830141 /nfs/dbraw/zinc/83/01/41/981830141.db2.gz PSIDYDIDJFNPCT-LJQANCHMSA-N 0 0 377.441 3.197 20 5 GGBDRN C[NH+]1CCC2(CC1)CN(c1ccc(CC(=O)[O-])cc1[N+](=O)[O-])Cc1ccccc12 ZINC000910383217 981908007 /nfs/dbraw/zinc/90/80/07/981908007.db2.gz BAORZUNRHHCWNO-UHFFFAOYSA-N 0 0 395.459 3.206 20 5 GGBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](C)[C@H](C(=O)[O-])C2)cc1OC ZINC001594965361 982721993 /nfs/dbraw/zinc/72/19/93/982721993.db2.gz VKPLKLNSLBDGFM-UMVBOHGHSA-N 0 0 380.441 3.181 20 5 GGBDRN O=C([O-])[C@@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@H]1c1ccc(F)cc1F ZINC001118261713 982949142 /nfs/dbraw/zinc/94/91/42/982949142.db2.gz BZXNVXPGRGDELU-LSDHHAIUSA-N 0 0 392.358 3.052 20 5 GGBDRN CC[NH+](CC)[C@@H](CNC(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C)CC(C)C ZINC001596254460 983663114 /nfs/dbraw/zinc/66/31/14/983663114.db2.gz OQLCVJIOPQWBDD-OAHLLOKOSA-N 0 0 394.472 3.479 20 5 GGBDRN CC[NH+](CC)[C@H](CNC(=O)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C)CC(C)C ZINC001596254459 983663231 /nfs/dbraw/zinc/66/32/31/983663231.db2.gz OQLCVJIOPQWBDD-HNNXBMFYSA-N 0 0 394.472 3.479 20 5 GGBDRN CC[NH+](CC)CCCC1CCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1 ZINC001596264948 983682920 /nfs/dbraw/zinc/68/29/20/983682920.db2.gz ZTNXYPKWLJUKGZ-UHFFFAOYSA-N 0 0 391.468 3.267 20 5 GGBDRN CCO[C@@H]1C[C@]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)(C(=O)[O-])C1(C)C ZINC001596836944 985489005 /nfs/dbraw/zinc/48/90/05/985489005.db2.gz GSUPAWTXFZEVPB-APWZRJJASA-N 0 0 380.441 3.130 20 5 GGBDRN C[C@H]1C[N@H+](Cc2ccccc2)CCCN1Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594545970 986212870 /nfs/dbraw/zinc/21/28/70/986212870.db2.gz WQDGMFRWHDTAOO-INIZCTEOSA-N 0 0 383.448 3.389 20 5 GGBDRN CCOc1cc(N2CC[NH+](C[C@@H]3CCCC[C@@H]3C(=O)[O-])CC2)ccc1[N+](=O)[O-] ZINC001597041739 986488739 /nfs/dbraw/zinc/48/87/39/986488739.db2.gz AOZFNUVNFHNGMX-RDJZCZTQSA-N 0 0 391.468 3.007 20 5 GGBDRN COc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001599707974 991322094 /nfs/dbraw/zinc/32/20/94/991322094.db2.gz BQIROPNBLKXXGW-CQSZACIVSA-N 0 0 388.420 3.130 20 5 GGBDRN C[N@H+](Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-])C1CCN(C(=O)c2ccccc2)CC1 ZINC001598507885 992529763 /nfs/dbraw/zinc/52/97/63/992529763.db2.gz WIKNWOHGQGRMBZ-UHFFFAOYSA-N 0 0 397.431 3.030 20 5 GGBDRN C[C@@]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593249519 994478052 /nfs/dbraw/zinc/47/80/52/994478052.db2.gz XHCUGQMWMPPECR-RDJZCZTQSA-N 0 0 382.775 3.010 20 5 GGBDRN C[C@]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593249512 994478646 /nfs/dbraw/zinc/47/86/46/994478646.db2.gz XHCUGQMWMPPECR-DOTOQJQBSA-N 0 0 382.775 3.010 20 5 GGBDRN C[C@@H]([NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC001593288547 994657480 /nfs/dbraw/zinc/65/74/80/994657480.db2.gz LKBNUHACSJHBMI-GFCCVEGCSA-N 0 0 383.404 3.492 20 5 GGBDRN C[C@H]([NH2+]Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC001593288549 994658105 /nfs/dbraw/zinc/65/81/05/994658105.db2.gz LKBNUHACSJHBMI-LBPRGKRZSA-N 0 0 383.404 3.492 20 5 GGBDRN C[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC001593298085 994709756 /nfs/dbraw/zinc/70/97/56/994709756.db2.gz DLZLCGVQDOGZMD-CQSZACIVSA-N 0 0 396.403 3.095 20 5 GGBDRN C[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)c1ccc(-n2ccnc2)cc1 ZINC001593298523 994715376 /nfs/dbraw/zinc/71/53/76/994715376.db2.gz KMCHJJDWIHGYPU-AWEZNQCLSA-N 0 0 396.403 3.095 20 5 GGBDRN C[C@@]([NH2+]Cc1cccc(F)c1OC(F)F)(C(=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001593303407 994734741 /nfs/dbraw/zinc/73/47/41/994734741.db2.gz CMPIFIFJMABXRC-KRWDZBQOSA-N 0 0 384.310 3.425 20 5 GGBDRN C[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](Cc1ccccc1)C(=O)[O-] ZINC001593312192 994796015 /nfs/dbraw/zinc/79/60/15/994796015.db2.gz PXOHRBMBAXJBOV-DYVFJYSZSA-N 0 0 396.403 3.066 20 5 GGBDRN CO[C@@]1(C(=O)[O-])CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC001599078378 996933568 /nfs/dbraw/zinc/93/35/68/996933568.db2.gz CJIWTFBLZCAHPP-KRWDZBQOSA-N 0 0 380.784 3.184 20 5 GGBDRN COc1ccc([C@@H]([NH2+]CCCOc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cc1Cl ZINC001599526648 997571426 /nfs/dbraw/zinc/57/14/26/997571426.db2.gz GUEUDOTYUVQBCV-QGZVFWFLSA-N 0 0 394.811 3.441 20 5 GGBDRN COc1ccc([C@H]([NH2+]CCCOc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cc1Cl ZINC001599526646 997571563 /nfs/dbraw/zinc/57/15/63/997571563.db2.gz GUEUDOTYUVQBCV-KRWDZBQOSA-N 0 0 394.811 3.441 20 5 GGBDRN COc1ccc([C@@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C(=O)[O-])cc1Cl ZINC001599530689 997646521 /nfs/dbraw/zinc/64/65/21/997646521.db2.gz FGQAFSHYYSNOJP-MRXNPFEDSA-N 0 0 380.784 3.181 20 5 GGBDRN C[C@]1(c2cccc(F)c2)CC[N@H+](Cc2ccc(OCC(=O)[O-])c([N+](=O)[O-])c2)C1 ZINC001594074572 997940369 /nfs/dbraw/zinc/94/03/69/997940369.db2.gz WGFMFLSIOUNNQZ-FQEVSTJZSA-N 0 0 388.395 3.361 20 5 GGBDRN COc1c(O)ccc(C[NH2+][C@@H](C(=O)[O-])c2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC001599345087 997989550 /nfs/dbraw/zinc/98/95/50/997989550.db2.gz QDFOBSZHFGJJMP-QGZVFWFLSA-N 0 0 382.372 3.378 20 5 GGBDRN COc1ccc(C[NH+]2CCC(Cc3ncc(C(=O)[O-])s3)CC2)cc1[N+](=O)[O-] ZINC001599564453 998260692 /nfs/dbraw/zinc/26/06/92/998260692.db2.gz YWFUJYOWEOSEOT-UHFFFAOYSA-N 0 0 391.449 3.213 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@@H+]2Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC001594329265 999264955 /nfs/dbraw/zinc/26/49/55/999264955.db2.gz VKUNVWCLDDKJSL-OLQIXAPSSA-N 0 0 376.453 3.445 20 5 GGBDRN CO[C@@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1 ZINC001599064269 999288072 /nfs/dbraw/zinc/28/80/72/999288072.db2.gz VNWSCTZULKGNJO-CWTRNNRKSA-N 0 0 392.383 3.063 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1CCCCNc1c(C(=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001594374872 999412708 /nfs/dbraw/zinc/41/27/08/999412708.db2.gz FVLIHIYMMPSJNJ-LBPRGKRZSA-N 0 0 380.401 3.268 20 5 GGBDRN C[C@H]1CCC[N@H+](CCCCNc2c(C(=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001594382320 999440925 /nfs/dbraw/zinc/44/09/25/999440925.db2.gz AEJPRTOQZOPSKJ-LBPRGKRZSA-N 0 0 380.401 3.125 20 5 GGBDRN C[C@H]1CCN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC001594423447 999580701 /nfs/dbraw/zinc/58/07/01/999580701.db2.gz WXVAEPAUPFOVKW-INIZCTEOSA-N 0 0 383.448 3.389 20 5 GGBDRN C[C@@H]1CCN(Cc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC001594423449 999580919 /nfs/dbraw/zinc/58/09/19/999580919.db2.gz WXVAEPAUPFOVKW-MRXNPFEDSA-N 0 0 383.448 3.389 20 5 GGBDRN C[C@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC001594425921 999590150 /nfs/dbraw/zinc/59/01/50/999590150.db2.gz CEQQWSPVHPYRHD-INIZCTEOSA-N 0 0 383.448 3.389 20 5 GGBDRN COc1cc(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])ccc1C ZINC000417566664 1126080406 /nfs/dbraw/zinc/08/04/06/1126080406.db2.gz RGZKCJJCCUJFNQ-GOSISDBHSA-N 0 0 383.404 3.179 20 5 GGBDRN COc1cc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])ccc1OC(C)C ZINC000277309955 1126078528 /nfs/dbraw/zinc/07/85/28/1126078528.db2.gz NJIFKBYLJUNBHL-KRWDZBQOSA-N 0 0 388.420 3.176 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000277275762 1126078547 /nfs/dbraw/zinc/07/85/47/1126078547.db2.gz LQDPHBGLBDTXLP-AWEZNQCLSA-N 0 0 386.376 3.429 20 5 GGBDRN COc1cc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])ccc1C ZINC000417566665 1126080474 /nfs/dbraw/zinc/08/04/74/1126080474.db2.gz RGZKCJJCCUJFNQ-SFHVURJKSA-N 0 0 383.404 3.179 20 5 GGBDRN Cc1cnn(C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C(=O)[O-])c1 ZINC000426723578 1126082664 /nfs/dbraw/zinc/08/26/64/1126082664.db2.gz MQCBRLXEZQANEZ-MRXNPFEDSA-N 0 0 386.433 3.071 20 5 GGBDRN Cc1cnn(C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C(=O)[O-])c1 ZINC000426728165 1126083652 /nfs/dbraw/zinc/08/36/52/1126083652.db2.gz UAFVRMPUCHEOPF-OAHLLOKOSA-N 0 0 386.433 3.071 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cc(F)cc(F)c1 ZINC000426730521 1126084033 /nfs/dbraw/zinc/08/40/33/1126084033.db2.gz AEBZLCIKPNTYHJ-KRWDZBQOSA-N 0 0 375.331 3.140 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc2cccnc21 ZINC000426742452 1126085898 /nfs/dbraw/zinc/08/58/98/1126085898.db2.gz JZGWRVANLHLHQH-IBGZPJMESA-N 0 0 390.399 3.410 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(-c2ccncc2)c1 ZINC000426808698 1126091744 /nfs/dbraw/zinc/09/17/44/1126091744.db2.gz NNCDKUSTPSTSAO-IBGZPJMESA-N 0 0 377.400 3.442 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](Cc1ccc(OC(F)F)cc1)C(=O)[O-] ZINC000426814247 1126092111 /nfs/dbraw/zinc/09/21/11/1126092111.db2.gz DPDJZPPXWJOCIE-MRXNPFEDSA-N 0 0 380.347 3.290 20 5 GGBDRN COc1ccc(-c2ccc(C[NH2+][C@@H](Cc3ccco3)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000426817247 1126092416 /nfs/dbraw/zinc/09/24/16/1126092416.db2.gz OKBIKJAXMGLBJP-INIZCTEOSA-N 0 0 386.360 3.242 20 5 GGBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc2c1CCC2 ZINC000593007132 1126098647 /nfs/dbraw/zinc/09/86/47/1126098647.db2.gz KRIKCCVLDAKISU-FQEVSTJZSA-N 0 0 379.416 3.350 20 5 GGBDRN CC(C)c1ccc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000756353405 1126107343 /nfs/dbraw/zinc/10/73/43/1126107343.db2.gz CDYGXJZQLRZHEW-KRWDZBQOSA-N 0 0 387.392 3.412 20 5 GGBDRN CC(C)c1nc(C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])cs1 ZINC001255794880 1126160860 /nfs/dbraw/zinc/16/08/60/1126160860.db2.gz YLOZXQWGSZUIKQ-INIZCTEOSA-N 0 0 388.449 3.442 20 5 GGBDRN O=C([O-])[C@@H](Cc1ccccc1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Br ZINC001601660195 1126224482 /nfs/dbraw/zinc/22/44/82/1126224482.db2.gz QSZDAGWKQGIBOB-OAHLLOKOSA-N 0 0 379.210 3.143 20 5 GGBDRN Cc1ccc(-c2ncc[nH]2)cc1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000225437389 222677448 /nfs/dbraw/zinc/67/74/48/222677448.db2.gz UEOKBEBUNBXUDK-UHFFFAOYSA-N 0 0 389.375 3.126 20 5 GGBDRN Cc1c(C(=O)N2CCCN(C(=O)c3ccccc3F)CC2)cccc1[N+](=O)[O-] ZINC000097134632 212157771 /nfs/dbraw/zinc/15/77/71/212157771.db2.gz NJUDCOZXWJOVJY-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN COc1cc(NC(=O)/C=C\c2ccccc2[N+](=O)[O-])ccc1N1CCCC1=O ZINC000096936999 212155134 /nfs/dbraw/zinc/15/51/34/212155134.db2.gz HLHCLSLUMZOEER-FLIBITNWSA-N 0 0 381.388 3.382 20 5 GGBDRN COc1ccc(C2=N/C(=C/C3=Cc4ccccc4OC3)C(=O)O2)cc1[N+](=O)[O-] ZINC000096935626 212155143 /nfs/dbraw/zinc/15/51/43/212155143.db2.gz PWQMJMFYJJCHDW-OQLLNIDSSA-N 0 0 378.340 3.267 20 5 GGBDRN Cn1cc([C@@H](NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)cn1 ZINC000359957650 212127775 /nfs/dbraw/zinc/12/77/75/212127775.db2.gz HZWUNSTZNWCJSC-IBGZPJMESA-N 0 0 399.838 3.299 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000359960335 212127495 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GGBDRN CC(=O)c1ccc(NC(=O)COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000003229653 220611445 /nfs/dbraw/zinc/61/14/45/220611445.db2.gz KHILZKZJGRIABN-UHFFFAOYSA-N 0 0 376.752 3.246 20 5 GGBDRN NC(=O)c1cc(-c2ccccc2)sc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000003328856 220629203 /nfs/dbraw/zinc/62/92/03/220629203.db2.gz XHQYKSNXRHUWMX-UHFFFAOYSA-N 0 0 397.412 3.440 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1cc2c(s1)CCC2 ZINC000003420492 220644071 /nfs/dbraw/zinc/64/40/71/220644071.db2.gz CNCNSVNMIGYLDY-JTQLQIEISA-N 0 0 390.417 3.338 20 5 GGBDRN Cc1ccccc1Nc1nc(N)nc(COC(=O)c2cccc([N+](=O)[O-])c2C)n1 ZINC000003444407 220645029 /nfs/dbraw/zinc/64/50/29/220645029.db2.gz MAHOFAITXCNCPR-UHFFFAOYSA-N 0 0 394.391 3.079 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c(Cl)c1 ZINC000003598288 220659251 /nfs/dbraw/zinc/65/92/51/220659251.db2.gz YIRSANOEKQMJDL-UHFFFAOYSA-N 0 0 387.779 3.100 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccc(F)cc1Cl ZINC000004915556 220791444 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/nfs/dbraw/zinc/39/25/56/221392556.db2.gz VMVRWGZGWTXSPP-INIZCTEOSA-N 0 0 376.434 3.302 20 5 GGBDRN CC(C)c1ccc(CN2CCN(C(=O)COc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000018892355 221392967 /nfs/dbraw/zinc/39/29/67/221392967.db2.gz KMXKIJBYDOOYEL-UHFFFAOYSA-N 0 0 397.475 3.441 20 5 GGBDRN C[C@@H](C(=O)Nc1c(F)cccc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000047745495 132428937 /nfs/dbraw/zinc/42/89/37/132428937.db2.gz NMOSQKMSLUKTPG-ZDUSSCGKSA-N 0 0 390.390 3.022 20 5 GGBDRN CCS(=O)(=O)c1ccc(N2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000063992808 136156611 /nfs/dbraw/zinc/15/66/11/136156611.db2.gz OPQAJTLOWNCFPM-UHFFFAOYSA-N 0 0 389.477 3.469 20 5 GGBDRN Cc1ccc(C(=O)N[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C(C)C)cc1 ZINC000024977770 221621894 /nfs/dbraw/zinc/62/18/94/221621894.db2.gz OLHNRJAGXOOCGQ-IBGZPJMESA-N 0 0 381.432 3.247 20 5 GGBDRN O=C(NCCSc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000026528372 221642747 /nfs/dbraw/zinc/64/27/47/221642747.db2.gz BSDYPULXDZRAFE-UHFFFAOYSA-N 0 0 386.477 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ZINC000040087142 221903269 /nfs/dbraw/zinc/90/32/69/221903269.db2.gz DPISIOZEIJLIIZ-UHFFFAOYSA-N 0 0 398.400 3.482 20 5 GGBDRN COc1ccc(Br)cc1CN(C)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000056696153 222026856 /nfs/dbraw/zinc/02/68/56/222026856.db2.gz OYKAHDNNBBTWNT-UHFFFAOYSA-N 0 0 383.246 3.269 20 5 GGBDRN CNC(=O)c1ccc(N(C)Cc2csc(Br)c2)c([N+](=O)[O-])c1 ZINC000057152200 222030255 /nfs/dbraw/zinc/03/02/55/222030255.db2.gz DMQSWHCNCBJYQF-UHFFFAOYSA-N 0 0 384.255 3.415 20 5 GGBDRN Cc1cc(N(C)CC(=O)N2c3ccccc3NC(=O)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000051592178 222007039 /nfs/dbraw/zinc/00/70/39/222007039.db2.gz GBELAKGTEHSXFN-AWEZNQCLSA-N 0 0 382.420 3.103 20 5 GGBDRN CC(=O)Nc1ccc(F)c(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000053411952 222010641 /nfs/dbraw/zinc/01/06/41/222010641.db2.gz ABMHVWYMYKZTPU-UHFFFAOYSA-N 0 0 397.366 3.345 20 5 GGBDRN CNC(=O)c1ccc(N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1 ZINC000053550895 222011443 /nfs/dbraw/zinc/01/14/43/222011443.db2.gz ACFWATAPXAEBDJ-OAHLLOKOSA-N 0 0 383.404 3.067 20 5 GGBDRN C[C@H]1CN(Cc2cccc(CNC(=O)Nc3cccc([N+](=O)[O-])c3)c2)CCO1 ZINC000058162290 222042837 /nfs/dbraw/zinc/04/28/37/222042837.db2.gz OWOCCVZVOGENIB-HNNXBMFYSA-N 0 0 384.436 3.137 20 5 GGBDRN CCOC(=O)c1cc(C(=O)NCc2cc(-c3ccccc3)on2)cc([N+](=O)[O-])c1 ZINC000058195345 222044676 /nfs/dbraw/zinc/04/46/76/222044676.db2.gz SNWPHEMHCMRZHZ-UHFFFAOYSA-N 0 0 395.371 3.357 20 5 GGBDRN O=C(Nc1ccnn1CCc1ccccc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000058225659 222047249 /nfs/dbraw/zinc/04/72/49/222047249.db2.gz GCIIHJWFOJIHDY-UHFFFAOYSA-N 0 0 376.376 3.163 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000058354852 222050317 /nfs/dbraw/zinc/05/03/17/222050317.db2.gz QTJKUJJGWLMWOS-INIZCTEOSA-N 0 0 380.404 3.467 20 5 GGBDRN Cc1cccc(C(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000063817600 222067875 /nfs/dbraw/zinc/06/78/75/222067875.db2.gz JLBIIUYYCMESPQ-CQSZACIVSA-N 0 0 377.441 3.280 20 5 GGBDRN 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O=C(c1ccccc1)c1ccc(N(CCO)Cc2cccnc2)c([N+](=O)[O-])c1 ZINC000072301712 222219785 /nfs/dbraw/zinc/21/97/85/222219785.db2.gz WBVMVNXKRDKTHQ-UHFFFAOYSA-N 0 0 377.400 3.220 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000095958465 222363792 /nfs/dbraw/zinc/36/37/92/222363792.db2.gz MMTRIKDCJRPHRC-STQMWFEESA-N 0 0 395.431 3.499 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000095958466 222364065 /nfs/dbraw/zinc/36/40/65/222364065.db2.gz MMTRIKDCJRPHRC-OLZOCXBDSA-N 0 0 395.431 3.499 20 5 GGBDRN COc1ccc([C@@H](OC)[C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1 ZINC000095983640 222367199 /nfs/dbraw/zinc/36/71/99/222367199.db2.gz NSHPHDPPDLSCNY-DJJJIMSYSA-N 0 0 387.436 3.175 20 5 GGBDRN C[C@H]1CCSCCN1c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000170611255 222556586 /nfs/dbraw/zinc/55/65/86/222556586.db2.gz QAZSPOJACWEEFP-VIFPVBQESA-N 0 0 384.401 3.220 20 5 GGBDRN COc1ccccc1N1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000048297763 537066753 /nfs/dbraw/zinc/06/67/53/537066753.db2.gz UDWUYINFCOXRMO-UHFFFAOYSA-N 0 0 380.404 3.047 20 5 GGBDRN Cc1sc(Br)cc1S(=O)(=O)NCc1ccccc1[N+](=O)[O-] ZINC000122434863 564413521 /nfs/dbraw/zinc/41/35/21/564413521.db2.gz JBGOHQGDUXVUHG-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CC[C@H]1CCCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000123050579 564436704 /nfs/dbraw/zinc/43/67/04/564436704.db2.gz WBCCCIBVELBLRJ-JTQLQIEISA-N 0 0 388.205 3.462 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1 ZINC000002467329 564187506 /nfs/dbraw/zinc/18/75/06/564187506.db2.gz NACZALBUOMJASQ-UHFFFAOYSA-N 0 0 380.809 3.193 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)ccc1[N+](=O)[O-] ZINC000115268411 564188602 /nfs/dbraw/zinc/18/86/02/564188602.db2.gz VMNAJWQXRWRTHG-VWLOTQADSA-N 0 0 382.825 3.388 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1 ZINC000115267965 564188685 /nfs/dbraw/zinc/18/86/85/564188685.db2.gz JOCCXUABXQSDSV-RUZDIDTESA-N 0 0 382.825 3.388 20 5 GGBDRN C[C@@H](Sc1nnc2ccccn21)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000002619424 564188750 /nfs/dbraw/zinc/18/87/50/564188750.db2.gz APNGQUHZAHZVLW-SECBINFHSA-N 0 0 377.813 3.410 20 5 GGBDRN C[S@](=O)Cc1cc(NC(=O)COc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000115265915 564188933 /nfs/dbraw/zinc/18/89/33/564188933.db2.gz LIXZJAYAOALFIG-RUZDIDTESA-N 0 0 382.825 3.144 20 5 GGBDRN C[S@](=O)Cc1cc(NC(=O)CNc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000115485360 564194106 /nfs/dbraw/zinc/19/41/06/564194106.db2.gz COQRDMULRDGPHH-RUZDIDTESA-N 0 0 381.841 3.177 20 5 GGBDRN O=C(COC(=O)c1cc(Cl)nc(Cl)c1)Nc1cc([N+](=O)[O-])ccc1F ZINC000003240470 564194217 /nfs/dbraw/zinc/19/42/17/564194217.db2.gz WWFYSMWXQGEUHE-UHFFFAOYSA-N 0 0 388.138 3.231 20 5 GGBDRN C[S@@](=O)Cc1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)ccc1Cl ZINC000115485895 564194627 /nfs/dbraw/zinc/19/46/27/564194627.db2.gz BLDHNHSDOIJAPG-VWLOTQADSA-N 0 0 385.804 3.100 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2c(F)cc(F)cc2Br)cc1 ZINC000003298476 564194969 /nfs/dbraw/zinc/19/49/69/564194969.db2.gz UYDMRHMTFPALEK-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(Br)o1 ZINC000003321104 564195453 /nfs/dbraw/zinc/19/54/53/564195453.db2.gz RHNSEWSZMPJIHX-UHFFFAOYSA-N 0 0 384.138 3.174 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCSC[C@H]2c2ccccc2)c(F)c1 ZINC000115590461 564196565 /nfs/dbraw/zinc/19/65/65/564196565.db2.gz VZSBGDIONPXVOC-HNNXBMFYSA-N 0 0 382.438 3.213 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCSC[C@H]2c2ccccc2)cc1 ZINC000115590327 564196580 /nfs/dbraw/zinc/19/65/80/564196580.db2.gz FJMPBTAQEZUNOG-KRWDZBQOSA-N 0 0 378.475 3.215 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCSC[C@@H]1c1ccccc1 ZINC000115590222 564196586 /nfs/dbraw/zinc/19/65/86/564196586.db2.gz PAVOYYFVBQZGDM-MRXNPFEDSA-N 0 0 378.475 3.382 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1coc(-c2cccs2)n1 ZINC000115640833 564197782 /nfs/dbraw/zinc/19/77/82/564197782.db2.gz UQXDQCHEROUKQI-UHFFFAOYSA-N 0 0 399.837 3.443 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1CCOc1cccc(Br)c1 ZINC000003602149 564198913 /nfs/dbraw/zinc/19/89/13/564198913.db2.gz NVCNCWVJUUVJBX-UHFFFAOYSA-N 0 0 391.177 3.032 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000116135971 564203587 /nfs/dbraw/zinc/20/35/87/564203587.db2.gz HLEJAWUXMSHOAX-HNNXBMFYSA-N 0 0 380.857 3.152 20 5 GGBDRN COc1ccc(CSCC(=O)NC(C)(C)c2nccs2)cc1[N+](=O)[O-] ZINC000116139224 564203784 /nfs/dbraw/zinc/20/37/84/564203784.db2.gz UURVOQYIRKYHSI-UHFFFAOYSA-N 0 0 381.479 3.345 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000116135974 564203903 /nfs/dbraw/zinc/20/39/03/564203903.db2.gz HLEJAWUXMSHOAX-OAHLLOKOSA-N 0 0 380.857 3.152 20 5 GGBDRN Cc1nn(CC(=O)N[C@H](C)c2ccc(Br)cc2)c(C)c1[N+](=O)[O-] ZINC000004548767 564204392 /nfs/dbraw/zinc/20/43/92/564204392.db2.gz VBKMCWDUHTZNTG-SECBINFHSA-N 0 0 381.230 3.048 20 5 GGBDRN Cc1ccc(C(=O)NC2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)s1 ZINC000116235715 564206065 /nfs/dbraw/zinc/20/60/65/564206065.db2.gz AGKGFAXDICVCFU-UHFFFAOYSA-N 0 0 379.463 3.061 20 5 GGBDRN C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116270517 564206359 /nfs/dbraw/zinc/20/63/59/564206359.db2.gz FHFHHLSMOCOOJE-LLVKDONJSA-N 0 0 383.857 3.089 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1(c2nccs2)CCCC1 ZINC000116366868 564208603 /nfs/dbraw/zinc/20/86/03/564208603.db2.gz DUCFMHQDSZCLKO-UHFFFAOYSA-N 0 0 381.479 3.362 20 5 GGBDRN Cc1ccc([C@H]2CSCCN2S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000116375733 564209315 /nfs/dbraw/zinc/20/93/15/564209315.db2.gz ZRYOYRIGYMILSO-MRXNPFEDSA-N 0 0 378.475 3.382 20 5 GGBDRN Cc1csc(C(C)(C)NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000116377962 564209516 /nfs/dbraw/zinc/20/95/16/564209516.db2.gz IDCMQFOCTLJWQY-UHFFFAOYSA-N 0 0 375.859 3.227 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2ccccc2Br)cc1[N+](=O)[O-] ZINC000005121350 564212230 /nfs/dbraw/zinc/21/22/30/564212230.db2.gz UIPDQAKUXDBNNV-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@H](NC(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000116659239 564214211 /nfs/dbraw/zinc/21/42/11/564214211.db2.gz YWVFWHNHXXOYBJ-LBPRGKRZSA-N 0 0 381.841 3.327 20 5 GGBDRN C[S@](=O)c1cccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000116759178 564216237 /nfs/dbraw/zinc/21/62/37/564216237.db2.gz RDVRJCOLTFYZHE-RUZDIDTESA-N 0 0 382.825 3.393 20 5 GGBDRN COC(=O)c1cc(Br)ccc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000005660535 564218820 /nfs/dbraw/zinc/21/88/20/564218820.db2.gz MMBQBBKYTJERBK-UHFFFAOYSA-N 0 0 379.166 3.396 20 5 GGBDRN C[C@H](NC(=O)COc1cccnc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000005970711 564220485 /nfs/dbraw/zinc/22/04/85/564220485.db2.gz SHTDTHRGUUGICC-JTQLQIEISA-N 0 0 380.198 3.009 20 5 GGBDRN O=C(NCc1csc(Br)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000117007382 564220707 /nfs/dbraw/zinc/22/07/07/564220707.db2.gz HYXKVMXNPPLCAZ-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000006120134 564221456 /nfs/dbraw/zinc/22/14/56/564221456.db2.gz VOKJCVCHWVYGTC-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN O=C(Nc1cc2c(cc1Br)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000006849547 564228105 /nfs/dbraw/zinc/22/81/05/564228105.db2.gz ZEBNXURLWBITHK-UHFFFAOYSA-N 0 0 379.166 3.381 20 5 GGBDRN COC(=O)C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1cccs1 ZINC000117590413 564229364 /nfs/dbraw/zinc/22/93/64/564229364.db2.gz QGDWEBQQBONSPH-ZDUSSCGKSA-N 0 0 382.825 3.273 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1nnc(-c2ccccn2)s1 ZINC000117618338 564229418 /nfs/dbraw/zinc/22/94/18/564229418.db2.gz NCUAROVMUDHONJ-UHFFFAOYSA-N 0 0 375.797 3.343 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1Cl ZINC000117623828 564229433 /nfs/dbraw/zinc/22/94/33/564229433.db2.gz UMZMGZNJRXUDFZ-UHFFFAOYSA-N 0 0 382.203 3.442 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cc(C(F)(F)F)c[nH]c1=O ZINC000117613099 564229493 /nfs/dbraw/zinc/22/94/93/564229493.db2.gz VIJKDYMXANUPSW-UHFFFAOYSA-N 0 0 375.690 3.137 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])c1ccc(I)cc1 ZINC000007169392 564232541 /nfs/dbraw/zinc/23/25/41/564232541.db2.gz XXDVLNQYOUGIIV-UHFFFAOYSA-N 0 0 383.141 3.461 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000007117111 564233105 /nfs/dbraw/zinc/23/31/05/564233105.db2.gz NTGBUISPAARZLE-UHFFFAOYSA-N 0 0 382.189 3.338 20 5 GGBDRN CCCNC(=O)CSc1nnc(SCc2ccccc2[N+](=O)[O-])s1 ZINC000007289959 564235162 /nfs/dbraw/zinc/23/51/62/564235162.db2.gz VZOBRKSVUCANTH-UHFFFAOYSA-N 0 0 384.508 3.357 20 5 GGBDRN CCCNC(=O)CSc1nnc(SCc2ccc([N+](=O)[O-])cc2)s1 ZINC000007290074 564235518 /nfs/dbraw/zinc/23/55/18/564235518.db2.gz AUCJYUYUSHDJSO-UHFFFAOYSA-N 0 0 384.508 3.357 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2Cl)cc1 ZINC000007376429 564236001 /nfs/dbraw/zinc/23/60/01/564236001.db2.gz OQYHNVFJIRGSKS-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=[N+]([O-])c1ncccc1OCc1nc(-c2cccc(Br)c2)no1 ZINC000007550816 564238050 /nfs/dbraw/zinc/23/80/50/564238050.db2.gz CXVFXMITZDEBDO-UHFFFAOYSA-N 0 0 377.154 3.381 20 5 GGBDRN C[C@@H](Sc1nnc(N)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000007535882 564238277 /nfs/dbraw/zinc/23/82/77/564238277.db2.gz PFGZRUNFEYLCKJ-RXMQYKEDSA-N 0 0 393.372 3.167 20 5 GGBDRN CCn1c(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])nnc1C1CC1 ZINC000007618147 564238828 /nfs/dbraw/zinc/23/88/28/564238828.db2.gz OCUVWYVZVHDVLP-UHFFFAOYSA-N 0 0 381.845 3.468 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118384547 564239465 /nfs/dbraw/zinc/23/94/65/564239465.db2.gz ZKRXQTVNXQDYEV-HNNXBMFYSA-N 0 0 384.219 3.407 20 5 GGBDRN C[C@H]1SCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000118441779 564240674 /nfs/dbraw/zinc/24/06/74/564240674.db2.gz LKSQTKAVMRRQQM-CXAGYDPISA-N 0 0 378.475 3.462 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(N(C)Cc2cccs2)c([N+](=O)[O-])c1 ZINC000007984982 564243427 /nfs/dbraw/zinc/24/34/27/564243427.db2.gz XBFSOPOSMHLVEF-UHFFFAOYSA-N 0 0 383.495 3.323 20 5 GGBDRN O=C(c1sccc1Br)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689088 564244178 /nfs/dbraw/zinc/24/41/78/564244178.db2.gz LTPJBAJTUGAVON-VIFPVBQESA-N 0 0 397.254 3.140 20 5 GGBDRN O=C(c1sccc1Br)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689086 564244297 /nfs/dbraw/zinc/24/42/97/564244297.db2.gz LTPJBAJTUGAVON-SECBINFHSA-N 0 0 397.254 3.140 20 5 GGBDRN O=C(c1ccc(Br)s1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690116 564244304 /nfs/dbraw/zinc/24/43/04/564244304.db2.gz WEWFXWFMSDGLMP-VIFPVBQESA-N 0 0 397.254 3.140 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2oc(Br)cc2C)cc([N+](=O)[O-])c1 ZINC000118723928 564244886 /nfs/dbraw/zinc/24/48/86/564244886.db2.gz IWCZGVYKHYZNHK-UHFFFAOYSA-N 0 0 383.154 3.298 20 5 GGBDRN O=C(Nc1n[nH]c(-c2ccccc2Br)n1)c1cccc([N+](=O)[O-])c1 ZINC000008115266 564246213 /nfs/dbraw/zinc/24/62/13/564246213.db2.gz UVELLTRLYCITON-UHFFFAOYSA-N 0 0 388.181 3.395 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccccc3Br)C2)nc1 ZINC000118866266 564247509 /nfs/dbraw/zinc/24/75/09/564247509.db2.gz YIVYKJUJHQJLKS-CYBMUJFWSA-N 0 0 377.242 3.439 20 5 GGBDRN NC(=O)c1ccc(CNc2c(F)cc(Br)cc2F)c([N+](=O)[O-])c1 ZINC000118966739 564248975 /nfs/dbraw/zinc/24/89/75/564248975.db2.gz GDDXREPTBVGODD-UHFFFAOYSA-N 0 0 386.152 3.347 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1Sc1nnc(-c2ccccc2Br)o1 ZINC000008376212 564249249 /nfs/dbraw/zinc/24/92/49/564249249.db2.gz HMWUQXKUDIJYFP-UHFFFAOYSA-N 0 0 382.199 3.292 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1ccc(Br)cc1 ZINC000119080404 564254396 /nfs/dbraw/zinc/25/43/96/564254396.db2.gz ATGHEWPRJZTEKE-UHFFFAOYSA-N 0 0 378.226 3.399 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@@H]1Cc2ccccc2O1 ZINC000119087584 564254480 /nfs/dbraw/zinc/25/44/80/564254480.db2.gz WJPHWZUHMGDNDT-AWEZNQCLSA-N 0 0 391.221 3.020 20 5 GGBDRN CC(C)NC(=O)NC(=O)[C@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000119102518 564254832 /nfs/dbraw/zinc/25/48/32/564254832.db2.gz FTIWRUWDPXIJHK-QMMMGPOBSA-N 0 0 390.259 3.072 20 5 GGBDRN Cn1ccnc1-c1csc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)n1 ZINC000119168976 564258364 /nfs/dbraw/zinc/25/83/64/564258364.db2.gz YVZLQCWKCYWYLM-UHFFFAOYSA-N 0 0 375.435 3.183 20 5 GGBDRN Cc1n[nH]c(C)c1NC(=O)CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000119197715 564258735 /nfs/dbraw/zinc/25/87/35/564258735.db2.gz USHVRTRDSJHEAS-UHFFFAOYSA-N 0 0 385.243 3.428 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N[C@@H]1CCO[C@H](C2CC2)C1 ZINC000119221176 564259850 /nfs/dbraw/zinc/25/98/50/564259850.db2.gz WQPCIFKDACHYSB-RISCZKNCSA-N 0 0 384.230 3.436 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N[C@@H]1CCO[C@@H](C2CC2)C1 ZINC000119221364 564260240 /nfs/dbraw/zinc/26/02/40/564260240.db2.gz WQPCIFKDACHYSB-BXUZGUMPSA-N 0 0 384.230 3.436 20 5 GGBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1ccc(F)cc1Br ZINC000011407154 564262795 /nfs/dbraw/zinc/26/27/95/564262795.db2.gz XGASJSDXFKZYFN-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCO[C@@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000011454723 564263685 /nfs/dbraw/zinc/26/36/85/564263685.db2.gz NZCYNEGBQUZFNN-NSHDSACASA-N 0 0 379.463 3.372 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccc(F)cc1Br ZINC000011500817 564263688 /nfs/dbraw/zinc/26/36/88/564263688.db2.gz YXERGLICLHADHX-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN CCS(=O)(=O)c1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000011541872 564264201 /nfs/dbraw/zinc/26/42/01/564264201.db2.gz LMBNTCOLCBCJOG-UHFFFAOYSA-N 0 0 380.447 3.119 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(Sc2nncs2)c(Cl)c1 ZINC000119311878 564264608 /nfs/dbraw/zinc/26/46/08/564264608.db2.gz JSMISYCRQZTEFY-UHFFFAOYSA-N 0 0 396.841 3.237 20 5 GGBDRN CCc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)[nH]1 ZINC000011711139 564264655 /nfs/dbraw/zinc/26/46/55/564264655.db2.gz LXWCWEIITKBBEK-UHFFFAOYSA-N 0 0 375.332 3.025 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(OCCCCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000119361069 564267000 /nfs/dbraw/zinc/26/70/00/564267000.db2.gz HTESYPDXNAQXQO-UHFFFAOYSA-N 0 0 386.304 3.018 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)c1ccc(Br)cc1)CC2 ZINC000119434146 564271132 /nfs/dbraw/zinc/27/11/32/564271132.db2.gz IVBZOCIGBLAULH-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN O=c1c2cccc(Br)c2ncn1CCOc1ccccc1[N+](=O)[O-] ZINC000119471330 564272444 /nfs/dbraw/zinc/27/24/44/564272444.db2.gz DZAPBOGFYIZKQN-UHFFFAOYSA-N 0 0 390.193 3.146 20 5 GGBDRN C[C@H](c1cccc(Cl)c1)S(=O)(=O)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000119488857 564273608 /nfs/dbraw/zinc/27/36/08/564273608.db2.gz ODXGBZVTBHSYID-SNVBAGLBSA-N 0 0 382.825 3.023 20 5 GGBDRN C[C@@H](c1cccc(Cl)c1)S(=O)(=O)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000119488706 564273657 /nfs/dbraw/zinc/27/36/57/564273657.db2.gz ODXGBZVTBHSYID-JTQLQIEISA-N 0 0 382.825 3.023 20 5 GGBDRN COCCN(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119495600 564273662 /nfs/dbraw/zinc/27/36/62/564273662.db2.gz RDOPZQCJSFJDMT-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CCOCc1ccc(CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000119543493 564276417 /nfs/dbraw/zinc/27/64/17/564276417.db2.gz GXQHDVZSLCXLCU-UHFFFAOYSA-N 0 0 384.841 3.263 20 5 GGBDRN CN(Cc1ccccc1)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000119603376 564278421 /nfs/dbraw/zinc/27/84/21/564278421.db2.gz IOANAVUJKYGOFZ-UHFFFAOYSA-N 0 0 396.184 3.472 20 5 GGBDRN O=c1ccn(Cc2cccc(Br)c2OC(F)F)cc1[N+](=O)[O-] ZINC000119588688 564278447 /nfs/dbraw/zinc/27/84/47/564278447.db2.gz PPMBRQRXVAMNJH-UHFFFAOYSA-N 0 0 375.125 3.169 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccc(Br)s1)CC2 ZINC000014099088 564279336 /nfs/dbraw/zinc/27/93/36/564279336.db2.gz UMMOIKKGIRGPAT-UHFFFAOYSA-N 0 0 389.252 3.170 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1Cl ZINC000014097606 564279377 /nfs/dbraw/zinc/27/93/77/564279377.db2.gz LOXRFWHQTOMXGT-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN CN(C(=O)c1cc(I)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000119642205 564281199 /nfs/dbraw/zinc/28/11/99/564281199.db2.gz ANKDTTDHRKSQJI-UHFFFAOYSA-N 0 0 382.157 3.476 20 5 GGBDRN CNc1ccc(C(=O)NCCc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000014418371 564282430 /nfs/dbraw/zinc/28/24/30/564282430.db2.gz HCQXQSBQYUSIQB-UHFFFAOYSA-N 0 0 384.255 3.433 20 5 GGBDRN COc1ccc(NC(=O)c2cc(I)cc([N+](=O)[O-])c2)cc1 ZINC000119673550 564283047 /nfs/dbraw/zinc/28/30/47/564283047.db2.gz RTUYGJYZKUFYNL-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN CC(C)CCC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000014826801 564283409 /nfs/dbraw/zinc/28/34/09/564283409.db2.gz IUBLHZVESRVFBT-UHFFFAOYSA-N 0 0 383.451 3.259 20 5 GGBDRN CN(CCOc1ccccc1Cl)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000015143151 564284688 /nfs/dbraw/zinc/28/46/88/564284688.db2.gz DUHPLZCYJCAYMQ-UHFFFAOYSA-N 0 0 384.841 3.167 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)Nc2ccc(F)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000015014654 564284784 /nfs/dbraw/zinc/28/47/84/564284784.db2.gz HZCCCQLZQTVWKF-UHFFFAOYSA-N 0 0 383.788 3.217 20 5 GGBDRN Cc1ccn(Cc2cccc(Br)c2OC(F)F)c(=O)c1[N+](=O)[O-] ZINC000119744427 564285733 /nfs/dbraw/zinc/28/57/33/564285733.db2.gz HRSMUEXAHXJSNE-UHFFFAOYSA-N 0 0 389.152 3.477 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000119731955 564286309 /nfs/dbraw/zinc/28/63/09/564286309.db2.gz BTBSPYNLZYYEHE-NXEZZACHSA-N 0 0 388.205 3.318 20 5 GGBDRN C[C@H]1c2cccn2CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000015415676 564287224 /nfs/dbraw/zinc/28/72/24/564287224.db2.gz YIGXIZQTVBPBSI-NSHDSACASA-N 0 0 393.241 3.174 20 5 GGBDRN Cc1ccc(NC(=O)CNC(=O)c2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000015409680 564287522 /nfs/dbraw/zinc/28/75/22/564287522.db2.gz ZFBHPRSEWCMJPK-UHFFFAOYSA-N 0 0 392.209 3.034 20 5 GGBDRN O=c1c2cc(Br)cc(F)c2ncn1Cc1ccc([N+](=O)[O-])cc1F ZINC000119781433 564287827 /nfs/dbraw/zinc/28/78/27/564287827.db2.gz QEHCIYGPQJHCKG-UHFFFAOYSA-N 0 0 396.147 3.394 20 5 GGBDRN O=c1c2cc(Br)cc(F)c2ncn1Cc1c(F)cccc1[N+](=O)[O-] ZINC000119818051 564289959 /nfs/dbraw/zinc/28/99/59/564289959.db2.gz HCHPMJNGUYXVLH-UHFFFAOYSA-N 0 0 396.147 3.394 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCCc1ccc(Cl)cc1Cl ZINC000016093457 564290846 /nfs/dbraw/zinc/29/08/46/564290846.db2.gz BXKQDDLXZDFRRJ-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN C[C@H](Sc1nnnn1C(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000016290433 564292213 /nfs/dbraw/zinc/29/22/13/564292213.db2.gz MWZGDCOEJNVWBQ-QMMMGPOBSA-N 0 0 384.849 3.109 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCSc1ccc(Cl)cc1 ZINC000017281600 564297203 /nfs/dbraw/zinc/29/72/03/564297203.db2.gz JZVATVQQWKBEMC-UHFFFAOYSA-N 0 0 387.870 3.100 20 5 GGBDRN CSc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000016832999 564297352 /nfs/dbraw/zinc/29/73/52/564297352.db2.gz OVRKDUUVUDMGDD-UHFFFAOYSA-N 0 0 377.447 3.146 20 5 GGBDRN CCOc1cc(C(=O)Nc2nnc(SCC)s2)c([N+](=O)[O-])cc1OC ZINC000018079261 564301356 /nfs/dbraw/zinc/30/13/56/564301356.db2.gz BFOPACIVHHJRBN-UHFFFAOYSA-N 0 0 384.439 3.218 20 5 GGBDRN CCNc1nnc(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)s1 ZINC000018662879 564302043 /nfs/dbraw/zinc/30/20/43/564302043.db2.gz DZBZTEUYKWWYSL-MRVPVSSYSA-N 0 0 383.455 3.006 20 5 GGBDRN O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2cccs2)cc1C(F)(F)F ZINC000120041263 564302195 /nfs/dbraw/zinc/30/21/95/564302195.db2.gz SKELFWLKARXXJW-UHFFFAOYSA-N 0 0 395.384 3.066 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000018940962 564302473 /nfs/dbraw/zinc/30/24/73/564302473.db2.gz FOTDMTAZGYXOGB-UHFFFAOYSA-N 0 0 376.843 3.139 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nnc(SCC)s2)cc1OC ZINC000019199493 564302814 /nfs/dbraw/zinc/30/28/14/564302814.db2.gz JRZANIVGOGEHCK-UHFFFAOYSA-N 0 0 384.439 3.218 20 5 GGBDRN O=C(CS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Nc1c(Cl)cccc1Cl ZINC000019850076 564304423 /nfs/dbraw/zinc/30/44/23/564304423.db2.gz ZDWSFLDWFLWSNV-UHFFFAOYSA-N 0 0 389.216 3.314 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ncc(-c2ccc(F)cc2)o1 ZINC000120164694 564306647 /nfs/dbraw/zinc/30/66/47/564306647.db2.gz RPWAPCCILKWYQG-UHFFFAOYSA-N 0 0 394.156 3.361 20 5 GGBDRN O=c1c(Br)cn(Cc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000120146447 564306666 /nfs/dbraw/zinc/30/66/66/564306666.db2.gz AQZZKJGCNOTNPH-UHFFFAOYSA-N 0 0 384.133 3.043 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ccc(Br)cc1 ZINC000120180566 564308123 /nfs/dbraw/zinc/30/81/23/564308123.db2.gz ZFCRKRJZRPFMKT-UHFFFAOYSA-N 0 0 388.015 3.330 20 5 GGBDRN Cc1nn(CC(=O)Nc2ccc(Br)cc2Cl)c(C)c1[N+](=O)[O-] ZINC000021363462 564310317 /nfs/dbraw/zinc/31/03/17/564310317.db2.gz KYQSXUDHIKWKRO-UHFFFAOYSA-N 0 0 387.621 3.463 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@@H]1COc2ccccc2C1 ZINC000120224923 564310932 /nfs/dbraw/zinc/31/09/32/564310932.db2.gz PCFPQHNRCYVHOS-ZDUSSCGKSA-N 0 0 391.221 3.020 20 5 GGBDRN Cc1nn([C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)c(C)c1[N+](=O)[O-] ZINC000021549802 564311294 /nfs/dbraw/zinc/31/12/94/564311294.db2.gz DTSVILVXBUKKDL-GFCCVEGCSA-N 0 0 395.257 3.390 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1COc2ccc(Br)cc21 ZINC000120259463 564311608 /nfs/dbraw/zinc/31/16/08/564311608.db2.gz WMXTWSGPAAPUAQ-GFCCVEGCSA-N 0 0 393.193 3.481 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2I)[C@H](C)C1 ZINC000120244718 564312011 /nfs/dbraw/zinc/31/20/11/564312011.db2.gz UXYZFBMWMPRXBN-NXEZZACHSA-N 0 0 388.205 3.460 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC(n2ccnc2)CC1 ZINC000120312446 564314944 /nfs/dbraw/zinc/31/49/44/564314944.db2.gz VUPBCHFFWUECPI-UHFFFAOYSA-N 0 0 379.214 3.031 20 5 GGBDRN C[C@@H](Sc1nnc(NC2CC2)s1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000022173929 564315217 /nfs/dbraw/zinc/31/52/17/564315217.db2.gz KPZVAHWKANYRGZ-SSDOTTSWSA-N 0 0 383.430 3.279 20 5 GGBDRN CN(C)c1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000120357708 564316751 /nfs/dbraw/zinc/31/67/51/564316751.db2.gz SJYJGXQGTGGARK-UHFFFAOYSA-N 0 0 378.226 3.353 20 5 GGBDRN CCOC(=O)c1sc(N(C)C(=O)c2cc(Cl)ccc2[N+](=O)[O-])nc1C ZINC000120464026 564320856 /nfs/dbraw/zinc/32/08/56/564320856.db2.gz SOHZKLZAKTXKQC-UHFFFAOYSA-N 0 0 383.813 3.466 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H]2CCSc3ccccc32)cc1 ZINC000120486557 564321474 /nfs/dbraw/zinc/32/14/74/564321474.db2.gz XIERLDJYMYFTSM-INIZCTEOSA-N 0 0 378.475 3.294 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)Cc2c(F)cccc2Cl)c([N+](=O)[O-])c1 ZINC000023395386 564324379 /nfs/dbraw/zinc/32/43/79/564324379.db2.gz SYPHKLLSZXVNQL-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN O=C(CNc1ccc(Br)cc1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000023694308 564326345 /nfs/dbraw/zinc/32/63/45/564326345.db2.gz GZYVFRZNWNUGBL-UHFFFAOYSA-N 0 0 394.181 3.137 20 5 GGBDRN C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)N(C)Cc1ccc(Br)cc1 ZINC000023754106 564326460 /nfs/dbraw/zinc/32/64/60/564326460.db2.gz BYSRDRRSIYTDRA-NSHDSACASA-N 0 0 394.225 3.178 20 5 GGBDRN C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)N(C)Cc1ccc(Br)cc1 ZINC000023754102 564326486 /nfs/dbraw/zinc/32/64/86/564326486.db2.gz BYSRDRRSIYTDRA-LLVKDONJSA-N 0 0 394.225 3.178 20 5 GGBDRN Cc1ccc(CN(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Br)o1 ZINC000023819803 564327638 /nfs/dbraw/zinc/32/76/38/564327638.db2.gz WXKIXNJAZYANKL-UHFFFAOYSA-N 0 0 382.214 3.329 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000120604905 564329060 /nfs/dbraw/zinc/32/90/60/564329060.db2.gz FRFONWHBKHFJSV-OLZOCXBDSA-N 0 0 380.388 3.178 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000120662100 564331361 /nfs/dbraw/zinc/33/13/61/564331361.db2.gz RJTGFBCXTAVRLN-UHFFFAOYSA-N 0 0 395.257 3.146 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Br ZINC000120796108 564337874 /nfs/dbraw/zinc/33/78/74/564337874.db2.gz DEEZISQVPJQBRO-UHFFFAOYSA-N 0 0 378.182 3.243 20 5 GGBDRN COc1ccc(S(=O)(=O)NC2CCC(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000025454264 564338543 /nfs/dbraw/zinc/33/85/43/564338543.db2.gz ZGMLSEXLTDMAQR-UHFFFAOYSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000025376247 564338734 /nfs/dbraw/zinc/33/87/34/564338734.db2.gz YYHFJVKLRCIRDZ-VHSXEESVSA-N 0 0 382.360 3.003 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000025376242 564338935 /nfs/dbraw/zinc/33/89/35/564338935.db2.gz YYHFJVKLRCIRDZ-ZJUUUORDSA-N 0 0 382.360 3.003 20 5 GGBDRN O=C(Nc1ccccc1-n1cc(Br)cn1)c1ccc([N+](=O)[O-])o1 ZINC000120920513 564342959 /nfs/dbraw/zinc/34/29/59/564342959.db2.gz YMWJDHKBDIROSR-UHFFFAOYSA-N 0 0 377.154 3.388 20 5 GGBDRN CCCN(CC(=O)OCC)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000120925452 564343409 /nfs/dbraw/zinc/34/34/09/564343409.db2.gz RLHXUFVFOCWFMX-UHFFFAOYSA-N 0 0 387.230 3.081 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C)CC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000120936515 564344129 /nfs/dbraw/zinc/34/41/29/564344129.db2.gz URWRNBIFOVPIEU-UHFFFAOYSA-N 0 0 387.230 3.079 20 5 GGBDRN Cc1csc([C@@H](NS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C2CC2)n1 ZINC000120965924 564345961 /nfs/dbraw/zinc/34/59/61/564345961.db2.gz COLWDKUQDIONIE-AWEZNQCLSA-N 0 0 381.479 3.406 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccccc3Br)CC2)cn1 ZINC000026485091 564347128 /nfs/dbraw/zinc/34/71/28/564347128.db2.gz VQAHWCIUJBKIKM-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccc(F)cc3Br)CC2)cn1 ZINC000026595351 564348118 /nfs/dbraw/zinc/34/81/18/564348118.db2.gz QQHVIKJFKAUHMZ-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cccc(Br)c1 ZINC000026830772 564349741 /nfs/dbraw/zinc/34/97/41/564349741.db2.gz TXWZAJQBZLPMPB-UHFFFAOYSA-N 0 0 385.239 3.178 20 5 GGBDRN O=C(CNc1cccc(Br)c1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026781367 564349855 /nfs/dbraw/zinc/34/98/55/564349855.db2.gz MOLBSRGLNDNWDE-UHFFFAOYSA-N 0 0 394.181 3.137 20 5 GGBDRN C[C@H](Cc1nc2ccccc2s1)NS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000121055779 564351318 /nfs/dbraw/zinc/35/13/18/564351318.db2.gz POLRUVADWPUAAP-LLVKDONJSA-N 0 0 377.447 3.114 20 5 GGBDRN Cc1ccc(Br)cc1S(=O)(=O)N(C)Cc1cccc([N+](=O)[O-])c1 ZINC000026979836 564351749 /nfs/dbraw/zinc/35/17/49/564351749.db2.gz FMVDWYYAXRJZEK-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CN(C(=O)[C@H]1COc2ccc(Br)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000121080890 564352218 /nfs/dbraw/zinc/35/22/18/564352218.db2.gz LKESMPZPYQZOHY-AWEZNQCLSA-N 0 0 377.194 3.496 20 5 GGBDRN COCc1ccccc1CNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000028055583 564359477 /nfs/dbraw/zinc/35/94/77/564359477.db2.gz FMEZGMDWMIRLPQ-UHFFFAOYSA-N 0 0 384.841 3.182 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000028059570 564359909 /nfs/dbraw/zinc/35/99/09/564359909.db2.gz OLLYYWGMYSBZHM-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN CCOCc1ccc(CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000028331125 564361714 /nfs/dbraw/zinc/36/17/14/564361714.db2.gz UIHUGJKSRFFVGQ-UHFFFAOYSA-N 0 0 384.841 3.263 20 5 GGBDRN CN(Cc1ccc(Br)cc1)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000029187187 564368016 /nfs/dbraw/zinc/36/80/16/564368016.db2.gz OUTFVOLOYFDKLG-UHFFFAOYSA-N 0 0 389.209 3.230 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3CCC(O)CC3)cc2[N+](=O)[O-])n1 ZINC000121406958 564368050 /nfs/dbraw/zinc/36/80/50/564368050.db2.gz SIIPODDLKVCKDH-UHFFFAOYSA-N 0 0 379.463 3.108 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCCC[C@H]2c2ncc[nH]2)cc1[N+](=O)[O-] ZINC000121422725 564368965 /nfs/dbraw/zinc/36/89/65/564368965.db2.gz MNHGJYIUYDFCNX-LBPRGKRZSA-N 0 0 384.845 3.196 20 5 GGBDRN O=c1[nH]cnc2cc(NCc3csc(Br)c3)c([N+](=O)[O-])cc12 ZINC000029623323 564372189 /nfs/dbraw/zinc/37/21/89/564372189.db2.gz UWVVGQBZHQOXLK-UHFFFAOYSA-N 0 0 381.211 3.267 20 5 GGBDRN CC(C)c1nnc(COc2cc([N+](=O)[O-])ccc2I)o1 ZINC000121517779 564372933 /nfs/dbraw/zinc/37/29/33/564372933.db2.gz SYDMHDZTEGZSIH-UHFFFAOYSA-N 0 0 389.149 3.285 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1-n1cncn1 ZINC000121567227 564374393 /nfs/dbraw/zinc/37/43/93/564374393.db2.gz CVWMAHRCKUQMJP-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)o1 ZINC000030217025 564377995 /nfs/dbraw/zinc/37/79/95/564377995.db2.gz PGGQXFBGXIKXGZ-UHFFFAOYSA-N 0 0 382.214 3.045 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(SC)cc2)cc1[N+](=O)[O-] ZINC000030365638 564379733 /nfs/dbraw/zinc/37/97/33/564379733.db2.gz XSPYPEZPVVFTNT-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H](C)c2ccc(SC)cc2)c([N+](=O)[O-])c1 ZINC000030366111 564379918 /nfs/dbraw/zinc/37/99/18/564379918.db2.gz UYXQPEHAUISMEZ-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H](C)c2ccc(SC)cc2)cc1[N+](=O)[O-] ZINC000030365641 564379995 /nfs/dbraw/zinc/37/99/95/564379995.db2.gz XSPYPEZPVVFTNT-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2csc(Br)c2)cc1[N+](=O)[O-] ZINC000030444849 564381451 /nfs/dbraw/zinc/38/14/51/564381451.db2.gz DKRGSAUGYVOOJG-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN CC(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000031556048 564390136 /nfs/dbraw/zinc/39/01/36/564390136.db2.gz OJDKPJNWCJSBMP-UHFFFAOYSA-N 0 0 383.813 3.316 20 5 GGBDRN O=C(Cn1cc(C(F)(F)F)ccc1=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000031625243 564390224 /nfs/dbraw/zinc/39/02/24/564390224.db2.gz APZCVCSLZMEWHL-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN CCc1cnc(CNC(=O)c2cc([N+](=O)[O-])ccc2SCCOC)s1 ZINC000121905953 564392366 /nfs/dbraw/zinc/39/23/66/564392366.db2.gz BVNZJSVRZLVLNY-UHFFFAOYSA-N 0 0 381.479 3.282 20 5 GGBDRN COc1ccc(CSCC(=O)Nc2nnc(C3CC3)s2)cc1[N+](=O)[O-] ZINC000031875176 564393446 /nfs/dbraw/zinc/39/34/46/564393446.db2.gz AWEDZJFQOBDFKU-UHFFFAOYSA-N 0 0 380.451 3.204 20 5 GGBDRN O=C(Cn1cccc(C(F)(F)F)c1=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000031813355 564393947 /nfs/dbraw/zinc/39/39/47/564393947.db2.gz WDMQLNFCZNPNFY-UHFFFAOYSA-N 0 0 375.690 3.067 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCc2cc(Cl)ccc21 ZINC000032433644 564399887 /nfs/dbraw/zinc/39/98/87/564399887.db2.gz VZKAGDHVKKEWTD-UHFFFAOYSA-N 0 0 382.825 3.398 20 5 GGBDRN COc1ccc(S(=O)(=O)N[C@H]2CCSc3ccccc32)c([N+](=O)[O-])c1 ZINC000032444905 564400877 /nfs/dbraw/zinc/40/08/77/564400877.db2.gz DSWYEYWGUOAMEB-ZDUSSCGKSA-N 0 0 380.447 3.119 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)c1ccc(SC)cc1 ZINC000032435603 564400937 /nfs/dbraw/zinc/40/09/37/564400937.db2.gz VRRHZLPSYYPXNG-LLVKDONJSA-N 0 0 382.463 3.365 20 5 GGBDRN CCSc1nnc(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])s1 ZINC000032533869 564402619 /nfs/dbraw/zinc/40/26/19/564402619.db2.gz UFCIFZCUTBVNNC-UHFFFAOYSA-N 0 0 377.494 3.113 20 5 GGBDRN COc1cc(Br)c(COC(=O)c2cc([N+](=O)[O-])cn2C)cc1OC ZINC000032842842 564406636 /nfs/dbraw/zinc/40/66/36/564406636.db2.gz XYACCBLSDNEDPA-UHFFFAOYSA-N 0 0 399.197 3.070 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1NCc1cn2ccccc2n1 ZINC000032927111 564407853 /nfs/dbraw/zinc/40/78/53/564407853.db2.gz HTIQUIYYRSJRPX-UHFFFAOYSA-N 0 0 394.172 3.459 20 5 GGBDRN COc1ccc(Br)cc1CS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000122338866 564410162 /nfs/dbraw/zinc/41/01/62/564410162.db2.gz KCTHJTLLEFBVBW-UHFFFAOYSA-N 0 0 386.223 3.340 20 5 GGBDRN C[C@H](c1cccs1)N(C)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000033235213 564412090 /nfs/dbraw/zinc/41/20/90/564412090.db2.gz VMHVIBVWIGTTHY-SNVBAGLBSA-N 0 0 379.463 3.067 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000122441515 564413980 /nfs/dbraw/zinc/41/39/80/564413980.db2.gz SJJBSZLHVHNWLR-UONOGXRCSA-N 0 0 382.825 3.091 20 5 GGBDRN CCOC(=O)C1CCC(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000122480631 564415504 /nfs/dbraw/zinc/41/55/04/564415504.db2.gz PUSAFGFBKIPUOC-UHFFFAOYSA-N 0 0 399.241 3.209 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC1(c2cccc(Cl)c2)CC1 ZINC000122543646 564418160 /nfs/dbraw/zinc/41/81/60/564418160.db2.gz IEXOTVFDAOXBPG-UHFFFAOYSA-N 0 0 382.825 3.224 20 5 GGBDRN CCOCCC1(CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CCC1 ZINC000122552235 564419372 /nfs/dbraw/zinc/41/93/72/564419372.db2.gz RWLCJKJBRCWMEM-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000122599961 564420361 /nfs/dbraw/zinc/42/03/61/564420361.db2.gz UTXNALFZCWPKRN-OAHLLOKOSA-N 0 0 381.841 3.477 20 5 GGBDRN CSc1cc(C(=O)NCCn2cc([N+](=O)[O-])cn2)c(Cl)cc1Cl ZINC000122674523 564422956 /nfs/dbraw/zinc/42/29/56/564422956.db2.gz QVHOOZPHPVHMHN-UHFFFAOYSA-N 0 0 375.237 3.250 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000122678292 564423012 /nfs/dbraw/zinc/42/30/12/564423012.db2.gz URVXPWDWZIYCSO-AWEZNQCLSA-N 0 0 381.841 3.477 20 5 GGBDRN COCCN(C(=O)c1cc(C)ccc1[N+](=O)[O-])c1cccc(Br)n1 ZINC000122666291 564423293 /nfs/dbraw/zinc/42/32/93/564423293.db2.gz VNFONEWAYLAJAR-UHFFFAOYSA-N 0 0 394.225 3.354 20 5 GGBDRN Cc1cc(C)c(C(=O)Cn2cc(Br)cc([N+](=O)[O-])c2=O)c(C)c1 ZINC000122697573 564423871 /nfs/dbraw/zinc/42/38/71/564423871.db2.gz HGFOOOMCAWUYDB-UHFFFAOYSA-N 0 0 379.210 3.327 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1Br ZINC000122719894 564425014 /nfs/dbraw/zinc/42/50/14/564425014.db2.gz QNZHKJNUDXEQFC-UHFFFAOYSA-N 0 0 393.201 3.332 20 5 GGBDRN O=C(Nc1ccc2c(c1)CC(=O)N2)c1ccc([N+](=O)[O-])cc1Br ZINC000122736135 564425986 /nfs/dbraw/zinc/42/59/86/564425986.db2.gz QKANILHUBXFBER-UHFFFAOYSA-N 0 0 376.166 3.104 20 5 GGBDRN Cc1cccc2nc(COc3c(Br)cccc3[N+](=O)[O-])cc(=O)n12 ZINC000122779380 564427883 /nfs/dbraw/zinc/42/78/83/564427883.db2.gz NEJOMTMQRGVQKB-UHFFFAOYSA-N 0 0 390.193 3.253 20 5 GGBDRN NC(=O)Nc1ccc(C(=O)COc2c(Br)cccc2[N+](=O)[O-])cc1 ZINC000122812568 564428636 /nfs/dbraw/zinc/42/86/36/564428636.db2.gz RYOXQZNKVOITPD-UHFFFAOYSA-N 0 0 394.181 3.110 20 5 GGBDRN Cc1ccc(CNC(=O)COc2c(Br)cccc2[N+](=O)[O-])cc1 ZINC000122831086 564428792 /nfs/dbraw/zinc/42/87/92/564428792.db2.gz GCCGPUGPHHDGRQ-UHFFFAOYSA-N 0 0 379.210 3.361 20 5 GGBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000122832753 564428951 /nfs/dbraw/zinc/42/89/51/564428951.db2.gz CYXBIWWELMFFEV-UHFFFAOYSA-N 0 0 394.177 3.390 20 5 GGBDRN CN(Cc1cccs1)C(=O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000122828183 564429003 /nfs/dbraw/zinc/42/90/03/564429003.db2.gz DNDZRYQMUOKIGG-UHFFFAOYSA-N 0 0 385.239 3.456 20 5 GGBDRN COc1ccc([C@@H](NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C2CC2)cc1 ZINC000122924153 564432222 /nfs/dbraw/zinc/43/22/22/564432222.db2.gz UOMOFDKNXLOXBK-INIZCTEOSA-N 0 0 382.463 3.403 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCCN(C)c3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000123077404 564437651 /nfs/dbraw/zinc/43/76/51/564437651.db2.gz VJMQJLMYYRHNDK-UHFFFAOYSA-N 0 0 385.442 3.139 20 5 GGBDRN CC[C@H](O)CCNC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000123109499 564438057 /nfs/dbraw/zinc/43/80/57/564438057.db2.gz IIDVHMPQRFRDKJ-LBPRGKRZSA-N 0 0 381.479 3.402 20 5 GGBDRN O=C(NCc1csc(Br)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000041989312 564439916 /nfs/dbraw/zinc/43/99/16/564439916.db2.gz CVPLIEFQKMDJIT-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2ccc(S(=O)(=O)N3CCCC3)cn2)c(F)c1 ZINC000042096842 564441886 /nfs/dbraw/zinc/44/18/86/564441886.db2.gz IWAOFTRJSJESPN-UHFFFAOYSA-N 0 0 383.426 3.065 20 5 GGBDRN COc1ccc(CSc2nnc(NC[C@H]3CCCO3)s2)cc1[N+](=O)[O-] ZINC000042154410 564442542 /nfs/dbraw/zinc/44/25/42/564442542.db2.gz LXSSMCHZDQHJNE-LLVKDONJSA-N 0 0 382.467 3.338 20 5 GGBDRN CC(=O)N(c1nnc(SCCOc2cccc([N+](=O)[O-])c2)s1)C1CC1 ZINC000042155883 564443013 /nfs/dbraw/zinc/44/30/13/564443013.db2.gz YVMCCBFXLIXTEL-UHFFFAOYSA-N 0 0 380.451 3.133 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2csc(Br)c2)cc1 ZINC000042170171 564443396 /nfs/dbraw/zinc/44/33/96/564443396.db2.gz PPBGRQOWVKFJSO-UHFFFAOYSA-N 0 0 391.268 3.038 20 5 GGBDRN COc1ccc(CCCN(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000123278829 564443824 /nfs/dbraw/zinc/44/38/24/564443824.db2.gz XTMUIYMQIVXGGS-UHFFFAOYSA-N 0 0 384.479 3.227 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000123291347 564444151 /nfs/dbraw/zinc/44/41/51/564444151.db2.gz YUCXHEZPHOGRHK-LLVKDONJSA-N 0 0 388.854 3.420 20 5 GGBDRN CN(Cc1cc(Br)cs1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000042266984 564445039 /nfs/dbraw/zinc/44/50/39/564445039.db2.gz KMLSYRAPQWXQHX-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccccc1I ZINC000042373110 564445919 /nfs/dbraw/zinc/44/59/19/564445919.db2.gz KESXAUHBRAANJW-UHFFFAOYSA-N 0 0 396.184 3.472 20 5 GGBDRN O=C(Nc1cc(Br)ccn1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000123343607 564446203 /nfs/dbraw/zinc/44/62/03/564446203.db2.gz OUVPIVWOJXGXHU-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000123473162 564449417 /nfs/dbraw/zinc/44/94/17/564449417.db2.gz MWABKRPLSUZQBB-UHFFFAOYSA-N 0 0 378.378 3.045 20 5 GGBDRN O=C(/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CCO[C@@]2(CCSC2)C1 ZINC000123455333 564449735 /nfs/dbraw/zinc/44/97/35/564449735.db2.gz SECJZWZXXHOKMZ-KKONFLHWSA-N 0 0 382.869 3.432 20 5 GGBDRN COC(=O)CCN(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)C(C)C ZINC000123480575 564450006 /nfs/dbraw/zinc/45/00/06/564450006.db2.gz NNONTSFOCFLAQC-UHFFFAOYSA-N 0 0 387.230 3.079 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](COCC(C)C)c2ccco2)cc1[N+](=O)[O-] ZINC000123503679 564450799 /nfs/dbraw/zinc/45/07/99/564450799.db2.gz DWGGXCQJXBSJLI-GFCCVEGCSA-N 0 0 388.467 3.250 20 5 GGBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000042994324 564452064 /nfs/dbraw/zinc/45/20/64/564452064.db2.gz XEMDMKVCODWFSI-UHFFFAOYSA-N 0 0 384.841 3.468 20 5 GGBDRN CN(CCc1ccccn1)C(=O)CNc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000123595576 564454521 /nfs/dbraw/zinc/45/45/21/564454521.db2.gz IMOWEXKQAMMBDY-UHFFFAOYSA-N 0 0 383.235 3.410 20 5 GGBDRN O=C(Nc1cc(Br)ccn1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000123585672 564454904 /nfs/dbraw/zinc/45/49/04/564454904.db2.gz AOQKIVURDWPCAY-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3c(F)cc(F)cc3C2)c(Cl)c1 ZINC000123654907 564457021 /nfs/dbraw/zinc/45/70/21/564457021.db2.gz GFYWOYTVZNLHGK-UHFFFAOYSA-N 0 0 388.779 3.273 20 5 GGBDRN Cc1cccnc1NC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000123848388 564463323 /nfs/dbraw/zinc/46/33/23/564463323.db2.gz FYJQQGGDRNICOP-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCSC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000124056557 564470099 /nfs/dbraw/zinc/47/00/99/564470099.db2.gz APTYPTGXRCYCRS-CQSZACIVSA-N 0 0 384.504 3.444 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000124122446 564472482 /nfs/dbraw/zinc/47/24/82/564472482.db2.gz MFDUOUMPNSVPGA-IAQYHMDHSA-N 0 0 393.241 3.277 20 5 GGBDRN CN(Cc1ccc(F)cc1F)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000044771988 564472698 /nfs/dbraw/zinc/47/26/98/564472698.db2.gz RRTGNVZRZFRWLQ-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN CN(Cc1ccc(F)c(F)c1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000044782417 564472708 /nfs/dbraw/zinc/47/27/08/564472708.db2.gz AQCZIRMRCFXCCF-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2cccc(O)c2)CC2CC2)cc1[N+](=O)[O-] ZINC000124319054 564478825 /nfs/dbraw/zinc/47/88/25/564478825.db2.gz NKZQUMMOYICOEQ-UHFFFAOYSA-N 0 0 382.463 3.271 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000124348220 564479394 /nfs/dbraw/zinc/47/93/94/564479394.db2.gz YUPITKWTKKSNDB-UHFFFAOYSA-N 0 0 387.211 3.167 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000124575572 564486949 /nfs/dbraw/zinc/48/69/49/564486949.db2.gz GADRZCMDACGGEV-GFCCVEGCSA-N 0 0 384.845 3.196 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000124601100 564487517 /nfs/dbraw/zinc/48/75/17/564487517.db2.gz HPCGRTWLVBMNGG-CYBMUJFWSA-N 0 0 379.214 3.448 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@@H](C)OC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000124869047 564496247 /nfs/dbraw/zinc/49/62/47/564496247.db2.gz BGPYOXWEVZYMOM-IAQYHMDHSA-N 0 0 382.463 3.115 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1ccc(I)cc1 ZINC000046136860 564496393 /nfs/dbraw/zinc/49/63/93/564496393.db2.gz RBYOVTMPKFKUOV-UHFFFAOYSA-N 0 0 382.157 3.129 20 5 GGBDRN COCCC1(CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CCCC1 ZINC000124937198 564498324 /nfs/dbraw/zinc/49/83/24/564498324.db2.gz DGIYEMQGNCXMNP-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc(C)c(C)s1 ZINC000125011735 564500178 /nfs/dbraw/zinc/50/01/78/564500178.db2.gz AJKUQYJRDZGHBF-UHFFFAOYSA-N 0 0 381.479 3.337 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(CC(F)(F)F)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000125018988 564500622 /nfs/dbraw/zinc/50/06/22/564500622.db2.gz PKRYGIYZRPFNBL-SNVBAGLBSA-N 0 0 377.388 3.025 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(Cl)s1 ZINC000046388582 564502801 /nfs/dbraw/zinc/50/28/01/564502801.db2.gz ZPPIMYGPDHJQGZ-UWVGGRQHSA-N 0 0 381.841 3.305 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCO[C@H](c2ccccc2)C1 ZINC000125221255 564507644 /nfs/dbraw/zinc/50/76/44/564507644.db2.gz COSYQDSCNSTHJI-HNNXBMFYSA-N 0 0 382.825 3.010 20 5 GGBDRN COc1ccc(CSCC(=O)N(C)Cc2cnc(C)s2)cc1[N+](=O)[O-] ZINC000046774392 564508429 /nfs/dbraw/zinc/50/84/29/564508429.db2.gz JQPBVMGWDLUAJV-UHFFFAOYSA-N 0 0 381.479 3.260 20 5 GGBDRN CN(CCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)CC(F)(F)F ZINC000047136555 564513655 /nfs/dbraw/zinc/51/36/55/564513655.db2.gz AFWPUCDQYXCUAM-UHFFFAOYSA-N 0 0 375.372 3.424 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(Cc1cccnc1)C1CC1 ZINC000125453838 564514885 /nfs/dbraw/zinc/51/48/85/564514885.db2.gz ZDTRPAVIXNVDBN-UHFFFAOYSA-N 0 0 381.841 3.305 20 5 GGBDRN Cc1sc(S(=O)(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000125526551 564517308 /nfs/dbraw/zinc/51/73/08/564517308.db2.gz HOAWCWACVAEDFU-RNCFNFMXSA-N 0 0 388.492 3.177 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccc(F)c(Br)c1 ZINC000047368630 564518698 /nfs/dbraw/zinc/51/86/98/564518698.db2.gz ZUGXHSINXQWWMV-UHFFFAOYSA-N 0 0 379.141 3.293 20 5 GGBDRN CCOCCC1(CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CCCC1 ZINC000125555986 564519033 /nfs/dbraw/zinc/51/90/33/564519033.db2.gz WKFKNVKTOHJJLW-UHFFFAOYSA-N 0 0 376.500 3.230 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1ccc(F)c(Br)c1 ZINC000047368616 564518962 /nfs/dbraw/zinc/51/89/62/564518962.db2.gz MSXNXFRQTRRUGP-UHFFFAOYSA-N 0 0 378.157 3.255 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@H](C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000125623950 564521093 /nfs/dbraw/zinc/52/10/93/564521093.db2.gz XWNPVVWPJPPEJY-SECBINFHSA-N 0 0 397.503 3.484 20 5 GGBDRN CN(Cc1ccc(F)cc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000047543789 564522483 /nfs/dbraw/zinc/52/24/83/564522483.db2.gz SLXXUFRZLCNLGW-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N(C)CC[C@H](C)O)cc2[N+](=O)[O-])n1 ZINC000125811021 564528379 /nfs/dbraw/zinc/52/83/79/564528379.db2.gz PYFMNXQOHGMDBS-NSHDSACASA-N 0 0 381.479 3.354 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)CCO2 ZINC000125897245 564530285 /nfs/dbraw/zinc/53/02/85/564530285.db2.gz VPKAAGSAJUKWKA-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN C[C@H](Oc1ccc(Br)cc1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126025925 564533602 /nfs/dbraw/zinc/53/36/02/564533602.db2.gz VPHARLIVBMXFGE-LBPRGKRZSA-N 0 0 393.237 3.484 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCCOc1c(Cl)cc(Cl)cc1Cl ZINC000126002566 564533659 /nfs/dbraw/zinc/53/36/59/564533659.db2.gz GLYOINDRWDMOJN-UHFFFAOYSA-N 0 0 393.614 3.097 20 5 GGBDRN O=C(c1sccc1Br)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048305616 564535724 /nfs/dbraw/zinc/53/57/24/564535724.db2.gz FKKOULGBBMIUNL-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN O=C(c1ccc(Br)s1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048306011 564536293 /nfs/dbraw/zinc/53/62/93/564536293.db2.gz NVUCFBGGJRSZBL-UHFFFAOYSA-N 0 0 396.266 3.381 20 5 GGBDRN O=C(Cn1cc(Br)c([N+](=O)[O-])n1)c1ccc(Br)cc1 ZINC000048439691 564539106 /nfs/dbraw/zinc/53/91/06/564539106.db2.gz RXMXRAYCAXGQMA-UHFFFAOYSA-N 0 0 389.003 3.199 20 5 GGBDRN O=[N+]([O-])c1nn(CCOc2cccc(Br)c2)cc1Br ZINC000048439740 564539522 /nfs/dbraw/zinc/53/95/22/564539522.db2.gz IDIQLJWUVMCVJQ-UHFFFAOYSA-N 0 0 391.019 3.395 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000048668635 564543503 /nfs/dbraw/zinc/54/35/03/564543503.db2.gz YDTAZKOTZXULBF-UHFFFAOYSA-N 0 0 382.203 3.199 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCc2ccc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000048652844 564543598 /nfs/dbraw/zinc/54/35/98/564543598.db2.gz GMXLKPSAQXNAGE-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1c(CS(=O)(=O)Cc2nc(-c3ccsc3)no2)cccc1[N+](=O)[O-] ZINC000048717598 564544592 /nfs/dbraw/zinc/54/45/92/564544592.db2.gz LZDNGILVLWJBDX-UHFFFAOYSA-N 0 0 379.419 3.130 20 5 GGBDRN O=C(Nc1cnccn1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000126324648 564545850 /nfs/dbraw/zinc/54/58/50/564545850.db2.gz SWPUUXJNCXCZGK-UHFFFAOYSA-N 0 0 379.163 3.130 20 5 GGBDRN CN(Cc1cscn1)c1ccc(I)cc1[N+](=O)[O-] ZINC000049056403 564548128 /nfs/dbraw/zinc/54/81/28/564548128.db2.gz JXQUCAOPWQSMPJ-UHFFFAOYSA-N 0 0 375.191 3.292 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H]2CCCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000126415201 564548314 /nfs/dbraw/zinc/54/83/14/564548314.db2.gz CUHAEQGKHSMIGE-GFCCVEGCSA-N 0 0 386.426 3.296 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CCO1 ZINC000126411029 564548332 /nfs/dbraw/zinc/54/83/32/564548332.db2.gz HGJINZLSTVTHNT-TZMCWYRMSA-N 0 0 376.500 3.227 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)CCO1 ZINC000126410771 564548610 /nfs/dbraw/zinc/54/86/10/564548610.db2.gz HGJINZLSTVTHNT-OCCSQVGLSA-N 0 0 376.500 3.227 20 5 GGBDRN NC(=O)[C@H](Sc1ncccc1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000126539688 564552193 /nfs/dbraw/zinc/55/21/93/564552193.db2.gz PUVPFLOWBJTGCN-LLVKDONJSA-N 0 0 386.202 3.210 20 5 GGBDRN CCN1CCc2nc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000049951522 564555729 /nfs/dbraw/zinc/55/57/29/564555729.db2.gz REUADNMURRYEBR-UHFFFAOYSA-N 0 0 378.479 3.160 20 5 GGBDRN O=C(Cn1cc(Br)cc([N+](=O)[O-])c1=O)c1ccc(Cl)s1 ZINC000050131213 564555992 /nfs/dbraw/zinc/55/59/92/564555992.db2.gz XSKQOFGQZLVYTL-UHFFFAOYSA-N 0 0 377.603 3.117 20 5 GGBDRN Cc1nc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)sc1C ZINC000126668962 564556982 /nfs/dbraw/zinc/55/69/82/564556982.db2.gz JWXKXORPUXEHIP-UHFFFAOYSA-N 0 0 380.857 3.284 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1cccc(OC(F)F)c1 ZINC000051157288 564562111 /nfs/dbraw/zinc/56/21/11/564562111.db2.gz ONPXXRZQQMJLDK-UHFFFAOYSA-N 0 0 392.767 3.328 20 5 GGBDRN Cc1ccc(Br)c(S(=O)(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000126805173 564562695 /nfs/dbraw/zinc/56/26/95/564562695.db2.gz HPPQVFJVLLMHCV-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN Cc1nn(C)c(NCCNc2ncc(C(F)(F)F)cc2Cl)c1[N+](=O)[O-] ZINC000051423735 564564554 /nfs/dbraw/zinc/56/45/54/564564554.db2.gz LVLJCPJTASFDHB-UHFFFAOYSA-N 0 0 378.742 3.228 20 5 GGBDRN O=C(CSc1nncn1CC(F)(F)F)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000051974535 564567880 /nfs/dbraw/zinc/56/78/80/564567880.db2.gz HQZFAJLSMCWNRL-UHFFFAOYSA-N 0 0 395.750 3.133 20 5 GGBDRN O=C(CSc1nncn1CC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000051975237 564567995 /nfs/dbraw/zinc/56/79/95/564567995.db2.gz OHXQEXGCNXFHOQ-UHFFFAOYSA-N 0 0 395.750 3.133 20 5 GGBDRN O=C(c1ccc(Cl)c(Cl)c1)N1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000052129824 564569037 /nfs/dbraw/zinc/56/90/37/564569037.db2.gz DPMGHSRFTZUTOT-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN CS(=O)(=O)c1ccc(Nc2ccc(OC(F)F)c(F)c2)c([N+](=O)[O-])c1 ZINC000052458300 564572206 /nfs/dbraw/zinc/57/22/06/564572206.db2.gz LMDBPZBYAGMTFJ-UHFFFAOYSA-N 0 0 376.312 3.482 20 5 GGBDRN O=C(CNc1nc2sccn2c1[N+](=O)[O-])Nc1ccc(Br)cc1 ZINC000052464854 564572667 /nfs/dbraw/zinc/57/26/67/564572667.db2.gz CVRCTSKIEPNEAR-UHFFFAOYSA-N 0 0 396.226 3.117 20 5 GGBDRN COc1ccc(-c2csc(NC(=O)c3n[nH]cc3[N+](=O)[O-])n2)cc1Cl ZINC000127174962 564576381 /nfs/dbraw/zinc/57/63/81/564576381.db2.gz KCKRQAGUIZXPNH-UHFFFAOYSA-N 0 0 379.785 3.356 20 5 GGBDRN CN(CCC1CCOCC1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000127252738 564578345 /nfs/dbraw/zinc/57/83/45/564578345.db2.gz CTRBFTCSXOBSRU-UHFFFAOYSA-N 0 0 397.280 3.339 20 5 GGBDRN O=C(CSc1nnc(N2CCCC2)s1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000052911638 564578366 /nfs/dbraw/zinc/57/83/66/564578366.db2.gz OQPUUCCVQAMHTL-UHFFFAOYSA-N 0 0 399.885 3.431 20 5 GGBDRN CN(CCc1ccccc1)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000053047631 564580965 /nfs/dbraw/zinc/58/09/65/564580965.db2.gz CUDWVFCTAXFCLF-UHFFFAOYSA-N 0 0 392.253 3.470 20 5 GGBDRN Cc1csc2nc(C)nc(-n3cc(Br)c(=O)c([N+](=O)[O-])c3)c12 ZINC000127374872 564581674 /nfs/dbraw/zinc/58/16/74/564581674.db2.gz TZGDHUGZJZHWDC-UHFFFAOYSA-N 0 0 381.211 3.130 20 5 GGBDRN Cc1ccc(NCCCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)nc1 ZINC000127373530 564581692 /nfs/dbraw/zinc/58/16/92/564581692.db2.gz UTBCXAHDTCFGIY-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN O=C(COc1ccc(Br)cc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053215873 564583167 /nfs/dbraw/zinc/58/31/67/564583167.db2.gz OISYADKSFDWGAR-UHFFFAOYSA-N 0 0 379.210 3.095 20 5 GGBDRN O=C(CSc1ncccc1Br)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000127413938 564583685 /nfs/dbraw/zinc/58/36/85/564583685.db2.gz CXSMZYGIRPQURA-UHFFFAOYSA-N 0 0 394.250 3.434 20 5 GGBDRN COc1ccc(NC(=O)CSc2ncccc2Br)c([N+](=O)[O-])c1 ZINC000127461311 564584565 /nfs/dbraw/zinc/58/45/65/564584565.db2.gz OMVUVSAGMXZIAA-UHFFFAOYSA-N 0 0 398.238 3.492 20 5 GGBDRN Cc1c(Br)cc(C(=O)N(C)[C@@H](C)C(=O)OC(C)C)cc1[N+](=O)[O-] ZINC000127558165 564588221 /nfs/dbraw/zinc/58/82/21/564588221.db2.gz 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CC(=O)c1ccc(NCCS(=O)(=O)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000053581892 564591050 /nfs/dbraw/zinc/59/10/50/564591050.db2.gz HZWPWBFMQPYNOJ-UHFFFAOYSA-N 0 0 382.825 3.337 20 5 GGBDRN CNC(=O)c1ccc(NCc2ccc(F)cc2Br)c([N+](=O)[O-])c1 ZINC000053582670 564591061 /nfs/dbraw/zinc/59/10/61/564591061.db2.gz UYNLGYQNWMMTTP-UHFFFAOYSA-N 0 0 382.189 3.468 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCc1c(Cl)cccc1Cl ZINC000053578791 564591234 /nfs/dbraw/zinc/59/12/34/564591234.db2.gz XTBIRQVVSRKPLD-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN COCc1c(Br)cccc1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000127850233 564599318 /nfs/dbraw/zinc/59/93/18/564599318.db2.gz OWMSKHVPBAHPCU-UHFFFAOYSA-N 0 0 397.229 3.037 20 5 GGBDRN O=C(CNC(=O)CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)cc1 ZINC000054191677 564600583 /nfs/dbraw/zinc/60/05/83/564600583.db2.gz RDGPJPGCLLVEAM-UHFFFAOYSA-N 0 0 379.825 3.095 20 5 GGBDRN CN(C)c1nc2sc(C(=O)NCCc3ccc([N+](=O)[O-])cc3)cc2s1 ZINC000054168350 564600602 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CN(Cc1cc(Br)ccc1F)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000063736564 564721673 /nfs/dbraw/zinc/72/16/73/564721673.db2.gz OKBVREQLTFSEPX-UHFFFAOYSA-N 0 0 382.189 3.232 20 5 GGBDRN Cc1ccc(OCc2nnnn2-c2ccccc2Br)cc1[N+](=O)[O-] ZINC000131722618 564722100 /nfs/dbraw/zinc/72/21/00/564722100.db2.gz GSQISEFHONPEEZ-UHFFFAOYSA-N 0 0 390.197 3.220 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3cn4cc(Br)ccc4n3)n2)c1 ZINC000131773969 564723478 /nfs/dbraw/zinc/72/34/78/564723478.db2.gz VVZWAWNMDYOLDI-UHFFFAOYSA-N 0 0 399.208 3.312 20 5 GGBDRN CCCc1n[nH]c(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000131818168 564725431 /nfs/dbraw/zinc/72/54/31/564725431.db2.gz PBJONQHCMFPZOQ-LLVKDONJSA-N 0 0 387.223 3.041 20 5 GGBDRN O=[N+]([O-])c1nn(C[C@@H](O)COc2ccc3ccccc3c2)cc1Br ZINC000064040030 564725947 /nfs/dbraw/zinc/72/59/47/564725947.db2.gz INSYPOGPGSDKFC-CYBMUJFWSA-N 0 0 392.209 3.147 20 5 GGBDRN O=[N+]([O-])c1sccc1N1CCN(Cc2cn3cc(Cl)ccc3n2)CC1 ZINC000064115011 564725999 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CC(C)CCOCCS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000153884349 565015985 /nfs/dbraw/zinc/01/59/85/565015985.db2.gz HHLJSKNWSLHERS-UHFFFAOYSA-N 0 0 380.260 3.194 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)Nc2cc(F)ccc2F)c1 ZINC000108759263 565016374 /nfs/dbraw/zinc/01/63/74/565016374.db2.gz JOLMGPLVFMQOTA-UHFFFAOYSA-N 0 0 393.165 3.436 20 5 GGBDRN C[C@H](Nc1ccc(Br)cc1[N+](=O)[O-])C(=O)NCc1ccccc1 ZINC000108815018 565017384 /nfs/dbraw/zinc/01/73/84/565017384.db2.gz ORAZSOXPAFBSMV-NSHDSACASA-N 0 0 378.226 3.474 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCOc3ccccc32)c(Cl)c1 ZINC000108874989 565018068 /nfs/dbraw/zinc/01/80/68/565018068.db2.gz MRFLCMMHFQGXLF-LLVKDONJSA-N 0 0 382.825 3.093 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OC[C@H](O)COCc1cccs1 ZINC000154001716 565020854 /nfs/dbraw/zinc/02/08/54/565020854.db2.gz ZXVXOVZYUZWOCV-SNVBAGLBSA-N 0 0 388.239 3.375 20 5 GGBDRN Cc1ccccc1OC[C@H](O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000153999815 565021205 /nfs/dbraw/zinc/02/12/05/565021205.db2.gz 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SIPGGHMKSUTDTC-UHFFFAOYSA-N 0 0 390.237 3.336 20 5 GGBDRN CCCn1c(CO)nnc1SCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000292616917 565125361 /nfs/dbraw/zinc/12/53/61/565125361.db2.gz JFWXHUGSRBATQK-UHFFFAOYSA-N 0 0 376.360 3.400 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCOc2ccc(Cl)cc21 ZINC000157255605 565125590 /nfs/dbraw/zinc/12/55/90/565125590.db2.gz SVQFIQHEJJAKMQ-UHFFFAOYSA-N 0 0 382.825 3.020 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCc2cc(Br)ccc21 ZINC000184302646 565126718 /nfs/dbraw/zinc/12/67/18/565126718.db2.gz RUFWDMNPGYPUJV-UHFFFAOYSA-N 0 0 397.250 3.250 20 5 GGBDRN COc1ccc(CSCC(=O)NC[C@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000184307941 565126964 /nfs/dbraw/zinc/12/69/64/565126964.db2.gz GIRWGVXMUQYKLD-NSHDSACASA-N 0 0 381.479 3.213 20 5 GGBDRN COc1ccc(CSCC(=O)NC[C@@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000184307959 565127027 /nfs/dbraw/zinc/12/70/27/565127027.db2.gz GIRWGVXMUQYKLD-LLVKDONJSA-N 0 0 381.479 3.213 20 5 GGBDRN Nn1c(SCc2cc([N+](=O)[O-])ccc2C(F)(F)F)nnc1C(F)(F)F ZINC000292667687 565127636 /nfs/dbraw/zinc/12/76/36/565127636.db2.gz LHPKXPJNPGZSRK-UHFFFAOYSA-N 0 0 387.265 3.230 20 5 GGBDRN COCCN(C(C)=O)c1nc(COc2cccc(Cl)c2[N+](=O)[O-])cs1 ZINC000292758325 565132899 /nfs/dbraw/zinc/13/28/99/565132899.db2.gz WJSHULYBQFCTKU-UHFFFAOYSA-N 0 0 385.829 3.283 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)CCSc1ccccc1Br ZINC000184405274 565133129 /nfs/dbraw/zinc/13/31/29/565133129.db2.gz FKQZEXFSCMJEHG-UHFFFAOYSA-N 0 0 385.243 3.212 20 5 GGBDRN COC(=O)[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@@H]1C ZINC000292766795 565133322 /nfs/dbraw/zinc/13/33/22/565133322.db2.gz GHDCAKFGDPUWTR-WPRPVWTQSA-N 0 0 375.208 3.173 20 5 GGBDRN Cc1cc(Br)ccc1SCC(=O)Nc1c([N+](=O)[O-])cnn1C ZINC000184404601 565133700 /nfs/dbraw/zinc/13/37/00/565133700.db2.gz HSBNQLQYGHKTHY-UHFFFAOYSA-N 0 0 385.243 3.130 20 5 GGBDRN Cc1nccn1C[C@@H](C)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267907453 565133924 /nfs/dbraw/zinc/13/39/24/565133924.db2.gz BQJQPOXDWPYHJQ-VIFPVBQESA-N 0 0 399.220 3.067 20 5 GGBDRN C[C@]1(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCCC[C@@H]1O ZINC000267915750 565134475 /nfs/dbraw/zinc/13/44/75/565134475.db2.gz HCOOUQWLDVLSJE-SWLSCSKDSA-N 0 0 389.221 3.167 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)ccn1 ZINC000157520931 565134655 /nfs/dbraw/zinc/13/46/55/565134655.db2.gz HPSWXDYNITWHTF-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000267922802 565134504 /nfs/dbraw/zinc/13/45/04/565134504.db2.gz KKGTZCPXOSMEIH-VIFPVBQESA-N 0 0 397.204 3.239 20 5 GGBDRN CO[C@H]1CCCC[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267916612 565134587 /nfs/dbraw/zinc/13/45/87/565134587.db2.gz HNDCNESSEITODJ-JQWIXIFHSA-N 0 0 375.194 3.184 20 5 GGBDRN CCOC[C@@H]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000267932912 565134665 /nfs/dbraw/zinc/13/46/65/565134665.db2.gz OWKNOFGZQSBWQY-SNVBAGLBSA-N 0 0 389.221 3.385 20 5 GGBDRN CC(C)(C)C[C@H](O)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267916550 565134974 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GGBDRN O=[N+]([O-])c1ccnn1Cc1coc(-c2ccc(I)cc2)n1 ZINC000157571879 565136867 /nfs/dbraw/zinc/13/68/67/565136867.db2.gz XQGODUYCBSLGPM-UHFFFAOYSA-N 0 0 396.144 3.099 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000370272775 565137109 /nfs/dbraw/zinc/13/71/09/565137109.db2.gz LXMSLIKARMWPIR-AWEZNQCLSA-N 0 0 381.841 3.477 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@@H](c2ccc(F)c(Br)c2)C1 ZINC000184479169 565137284 /nfs/dbraw/zinc/13/72/84/565137284.db2.gz BTRRRRPZDBLYLB-CYBMUJFWSA-N 0 0 399.172 3.303 20 5 GGBDRN Cn1ncc2c1CCC[C@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267980101 565137402 /nfs/dbraw/zinc/13/74/02/565137402.db2.gz XTRQFJVQEAGKAC-LLVKDONJSA-N 0 0 397.204 3.037 20 5 GGBDRN O=C(NC[C@H]1CSCCS1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268032674 565137909 /nfs/dbraw/zinc/13/79/09/565137909.db2.gz LHSFOZJPWDVKFV-QMMMGPOBSA-N 0 0 395.275 3.075 20 5 GGBDRN C[C@@H](O)CC(C)(C)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000268015213 565138169 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3.460 20 5 GGBDRN CCCN(CCc1cccs1)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000184516879 565140675 /nfs/dbraw/zinc/14/06/75/565140675.db2.gz MFSWPKGNVIINBJ-UHFFFAOYSA-N 0 0 382.507 3.385 20 5 GGBDRN C[C@H](N(C)C(=O)c1cc(I)cc([N+](=O)[O-])c1)C1(C)CC1 ZINC000157679236 565140907 /nfs/dbraw/zinc/14/09/07/565140907.db2.gz HRUPFPHWGCIDCQ-VIFPVBQESA-N 0 0 388.205 3.460 20 5 GGBDRN C[C@H](CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])Oc1ccc(Cl)cc1 ZINC000184600992 565147073 /nfs/dbraw/zinc/14/70/73/565147073.db2.gz QFAYEVSHSAZBDG-GFCCVEGCSA-N 0 0 384.841 3.135 20 5 GGBDRN C[C@H]1CN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C[C@@H](c2ccsc2)O1 ZINC000268332859 565148634 /nfs/dbraw/zinc/14/86/34/565148634.db2.gz QDKAGUMISGMZON-ZBEGNZNMSA-N 0 0 382.463 3.026 20 5 GGBDRN COc1cccc(COCCNc2ncc(Br)cc2[N+](=O)[O-])c1 ZINC000157912034 565149389 /nfs/dbraw/zinc/14/93/89/565149389.db2.gz OCLSVNHTMOCVGE-UHFFFAOYSA-N 0 0 382.214 3.390 20 5 GGBDRN CCOC(COCCNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])OCC ZINC000293065068 565149917 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CC(C)n1cnnc1[C@@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000268488438 565155034 /nfs/dbraw/zinc/15/50/34/565155034.db2.gz NMTREXXXRDLKDD-LLVKDONJSA-N 0 0 395.261 3.309 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000268488440 565155119 /nfs/dbraw/zinc/15/51/19/565155119.db2.gz NMTREXXXRDLKDD-NSHDSACASA-N 0 0 395.261 3.309 20 5 GGBDRN CC(C)(C)c1nc(CCNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cs1 ZINC000184777063 565156770 /nfs/dbraw/zinc/15/67/70/565156770.db2.gz ZELVIHMIGJBUMO-UHFFFAOYSA-N 0 0 383.495 3.011 20 5 GGBDRN COc1ccccc1S(=O)(=O)CCCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000184776845 565156793 /nfs/dbraw/zinc/15/67/93/565156793.db2.gz UYQUPIVBKYOKOA-UHFFFAOYSA-N 0 0 385.825 3.500 20 5 GGBDRN C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)C1CCOCC1 ZINC000268552616 565157280 /nfs/dbraw/zinc/15/72/80/565157280.db2.gz AGKOJMYGJFWDRC-MRVPVSSYSA-N 0 0 375.194 3.041 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cc(F)cc(Cl)c1 ZINC000184825133 565158834 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C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)[N@@H+]1CCC[C@@H](C)C1 ZINC000159872826 565221788 /nfs/dbraw/zinc/22/17/88/565221788.db2.gz JPMGXJBQGHBSJU-NEPJUHHUSA-N 0 0 384.274 3.208 20 5 GGBDRN Cc1ccc([C@H]2CSCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000185807171 565222795 /nfs/dbraw/zinc/22/27/95/565222795.db2.gz OBPIQNJHVXSGFY-QGZVFWFLSA-N 0 0 378.475 3.382 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)c1 ZINC000185809940 565222959 /nfs/dbraw/zinc/22/29/59/565222959.db2.gz ROVOAHZNZIEYEM-UHFFFAOYSA-N 0 0 392.277 3.100 20 5 GGBDRN CC(C)c1nnc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000270614441 565223680 /nfs/dbraw/zinc/22/36/80/565223680.db2.gz FWKMAXZRTZHMAY-QMMMGPOBSA-N 0 0 382.218 3.090 20 5 GGBDRN CCCc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2SCCOC)s1 ZINC000270647039 565224442 /nfs/dbraw/zinc/22/44/42/565224442.db2.gz LCAGEJRCHHGIJT-UHFFFAOYSA-N 0 0 382.467 3.390 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@H](CSc3ccccc3)C2)c1 ZINC000185858173 565224886 /nfs/dbraw/zinc/22/48/86/565224886.db2.gz XSEUWDGHHDJTJM-AWEZNQCLSA-N 0 0 378.475 3.398 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000294751508 565225622 /nfs/dbraw/zinc/22/56/22/565225622.db2.gz ITOBFQPDDHZUPR-HOCLYGCPSA-N 0 0 399.216 3.280 20 5 GGBDRN CN(Cc1nccn1CC(F)(F)F)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000270756538 565227318 /nfs/dbraw/zinc/22/73/18/565227318.db2.gz VYLXZJXQTKKKDJ-UHFFFAOYSA-N 0 0 376.722 3.279 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000294788847 565228378 /nfs/dbraw/zinc/22/83/78/565228378.db2.gz KKSFWAOUSYBTNM-GOEBONIOSA-N 0 0 381.226 3.141 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cccc(NC(N)=O)c2)cc1[N+](=O)[O-] ZINC000160047751 565229266 /nfs/dbraw/zinc/22/92/66/565229266.db2.gz URLIZLBUIRFCRM-UHFFFAOYSA-N 0 0 393.197 3.409 20 5 GGBDRN CC(C)[C@@]1(CO)CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000294859760 565231943 /nfs/dbraw/zinc/23/19/43/565231943.db2.gz SNCVWWAIRGXLTP-INIZCTEOSA-N 0 0 385.258 3.228 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCSc1nnc(-c2ccc(Cl)s2)o1 ZINC000160147242 565232651 /nfs/dbraw/zinc/23/26/51/565232651.db2.gz KOZZQGHTGNHKSA-UHFFFAOYSA-N 0 0 384.826 3.314 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000185969216 565232685 /nfs/dbraw/zinc/23/26/85/565232685.db2.gz WXLDQWCHKYDUNT-AWEZNQCLSA-N 0 0 381.479 3.312 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC[C@H]2COc2ccccc2)s1 ZINC000294867953 565233044 /nfs/dbraw/zinc/23/30/44/565233044.db2.gz AUBGVHKOSGNWIF-LBPRGKRZSA-N 0 0 382.463 3.108 20 5 GGBDRN CSC1(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCOCC1 ZINC000294865828 565233805 /nfs/dbraw/zinc/23/38/05/565233805.db2.gz HEKZIRKAXYMBDW-UHFFFAOYSA-N 0 0 378.372 3.256 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000186014499 565234433 /nfs/dbraw/zinc/23/44/33/565234433.db2.gz RQOMVPGBIKQASO-WBMJQRKESA-N 0 0 385.873 3.102 20 5 GGBDRN O=C(NC1CC1)c1cccc(CNc2c(Br)cncc2[N+](=O)[O-])c1 ZINC000270986207 565235199 /nfs/dbraw/zinc/23/51/99/565235199.db2.gz SUEZLSDNFDKWSH-UHFFFAOYSA-N 0 0 391.225 3.257 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c1 ZINC000186031863 565235950 /nfs/dbraw/zinc/23/59/50/565235950.db2.gz IKYYVTPBULWAGF-CVEARBPZSA-N 0 0 382.825 3.057 20 5 GGBDRN O=C1CCCC[C@H]1[C@@H]1CCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000186059237 565238583 /nfs/dbraw/zinc/23/85/83/565238583.db2.gz HRYOFRMXPHAKEI-AAEUAGOBSA-N 0 0 386.857 3.161 20 5 GGBDRN CC(C)[C@@]1(CO)CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000294996045 565239560 /nfs/dbraw/zinc/23/95/60/565239560.db2.gz ZZDMVZBUNKZFKT-INIZCTEOSA-N 0 0 385.258 3.228 20 5 GGBDRN CN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2 ZINC000160300715 565239901 /nfs/dbraw/zinc/23/99/01/565239901.db2.gz XTXKUDSMCKIYRP-UHFFFAOYSA-N 0 0 379.166 3.363 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)c1cccs1 ZINC000271178796 565241666 /nfs/dbraw/zinc/24/16/66/565241666.db2.gz UINTVLFFUGFWPY-UHFFFAOYSA-N 0 0 380.447 3.008 20 5 GGBDRN NC(=O)[C@@H](Sc1ccc([N+](=O)[O-])cn1)c1ccc(Br)cc1F ZINC000160346275 565241767 /nfs/dbraw/zinc/24/17/67/565241767.db2.gz ASKZBFQLKNJDCC-LBPRGKRZSA-N 0 0 386.202 3.210 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc([S@](C)=O)cc1 ZINC000160384810 565242848 /nfs/dbraw/zinc/24/28/48/565242848.db2.gz BUQFNBHPZLJMBR-RUZDIDTESA-N 0 0 378.475 3.374 20 5 GGBDRN O=[N+]([O-])c1ccc(Sc2nnc(N3CCOCC3)s2)cc1OC(F)F ZINC000271320513 565247679 /nfs/dbraw/zinc/24/76/79/565247679.db2.gz OIGNOMKJQKOKQF-UHFFFAOYSA-N 0 0 390.393 3.036 20 5 GGBDRN CC1(C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)[C@@H]2CCCO[C@@H]21 ZINC000372695571 565249005 /nfs/dbraw/zinc/24/90/05/565249005.db2.gz RQWRHGOOKBOSSH-MAZHCROVSA-N 0 0 397.269 3.220 20 5 GGBDRN Cc1cccc2oc(CCNc3sc(S(C)(=O)=O)cc3[N+](=O)[O-])nc21 ZINC000271350166 565249735 /nfs/dbraw/zinc/24/97/35/565249735.db2.gz HFBQQBMCWGANBW-UHFFFAOYSA-N 0 0 381.435 3.164 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](Oc3ccccc3Cl)C2)cc1 ZINC000160561528 565250350 /nfs/dbraw/zinc/25/03/50/565250350.db2.gz PABFRVCJYCOLCD-ZDUSSCGKSA-N 0 0 382.825 3.090 20 5 GGBDRN O=C1CCCN1c1cccc(CNc2c(Br)cncc2[N+](=O)[O-])c1 ZINC000160583324 565251786 /nfs/dbraw/zinc/25/17/86/565251786.db2.gz JZBKBBUWEYSETM-UHFFFAOYSA-N 0 0 391.225 3.491 20 5 GGBDRN CCOc1cc(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])ccc1OC ZINC000271430374 565253251 /nfs/dbraw/zinc/25/32/51/565253251.db2.gz STIPEMSKLTUJMY-UHFFFAOYSA-N 0 0 386.451 3.079 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccc(F)cc1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271456645 565254247 /nfs/dbraw/zinc/25/42/47/565254247.db2.gz YCCSVOPVARXWIO-ZANVPECISA-N 0 0 388.442 3.123 20 5 GGBDRN C[C@H](CCO)CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000295257910 565255544 /nfs/dbraw/zinc/25/55/44/565255544.db2.gz AVSYIQCNNDREFM-QMMMGPOBSA-N 0 0 379.638 3.149 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)c2cc(C)sc2C)cc1[N+](=O)[O-] ZINC000186327160 565255714 /nfs/dbraw/zinc/25/57/14/565255714.db2.gz CZSSJMSPTKCVRV-VIFPVBQESA-N 0 0 388.442 3.460 20 5 GGBDRN O=C(CCCNC(=O)c1ccsc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186332991 565256029 /nfs/dbraw/zinc/25/60/29/565256029.db2.gz YBSFCMPIMNEOKS-UHFFFAOYSA-N 0 0 381.841 3.136 20 5 GGBDRN C[C@@H]1CCCCN(C(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000186437051 565261128 /nfs/dbraw/zinc/26/11/28/565261128.db2.gz YHRHRSGTVLNEOQ-SNVBAGLBSA-N 0 0 388.205 3.462 20 5 GGBDRN Cc1csc([C@@H](C)CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000186475703 565262325 /nfs/dbraw/zinc/26/23/25/565262325.db2.gz XIKAJLHJQGEFGX-QMMMGPOBSA-N 0 0 375.859 3.095 20 5 GGBDRN CC[C@H](COCC(F)(F)F)NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000295385381 565262571 /nfs/dbraw/zinc/26/25/71/565262571.db2.gz JHJUHNBXDWQSMQ-MRVPVSSYSA-N 0 0 399.163 3.445 20 5 GGBDRN CC[C@@H](Cc1ccccc1Br)N(C)C(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000186480632 565263187 /nfs/dbraw/zinc/26/31/87/565263187.db2.gz PPSWPCOVPKUELX-ZDUSSCGKSA-N 0 0 395.257 3.034 20 5 GGBDRN Cc1cc(Cl)c(C(=O)NC2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000295397594 565263559 /nfs/dbraw/zinc/26/35/59/565263559.db2.gz ZAZHQTGBNJZWDV-UHFFFAOYSA-N 0 0 379.766 3.313 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCOC[C@H](C2CCC2)C1 ZINC000295420699 565264801 /nfs/dbraw/zinc/26/48/01/565264801.db2.gz UZJQUMBBWPWVLA-GFCCVEGCSA-N 0 0 383.242 3.246 20 5 GGBDRN CC(C)(C)C[C@H](CO)NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000271693385 565264827 /nfs/dbraw/zinc/26/48/27/565264827.db2.gz SLHQPNPVMQVCRW-SECBINFHSA-N 0 0 377.210 3.023 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000186514694 565265049 /nfs/dbraw/zinc/26/50/49/565265049.db2.gz CQUKJXRQAMPRHJ-ABAIWWIYSA-N 0 0 381.841 3.415 20 5 GGBDRN CC(C)(C)C[C@@H](CO)NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000271693386 565265018 /nfs/dbraw/zinc/26/50/18/565265018.db2.gz SLHQPNPVMQVCRW-VIFPVBQESA-N 0 0 377.210 3.023 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000186531192 565266302 /nfs/dbraw/zinc/26/63/02/565266302.db2.gz GTJKGJYYZOEVAJ-BXUZGUMPSA-N 0 0 381.841 3.415 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000186531227 565266506 /nfs/dbraw/zinc/26/65/06/565266506.db2.gz GTJKGJYYZOEVAJ-RISCZKNCSA-N 0 0 381.841 3.415 20 5 GGBDRN COC[C@@H](C)n1ccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000186543516 565267429 /nfs/dbraw/zinc/26/74/29/565267429.db2.gz CFXZHDXNGDZDQM-SNVBAGLBSA-N 0 0 384.845 3.383 20 5 GGBDRN CC[C@H](COCC(F)(F)F)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000295494234 565269393 /nfs/dbraw/zinc/26/93/93/565269393.db2.gz SLBUYUZUMRXPSR-MRVPVSSYSA-N 0 0 399.163 3.445 20 5 GGBDRN C[C@H]1CN(C(=O)c2sc(Br)cc2[N+](=O)[O-])c2cccnc2O1 ZINC000373163365 565272980 /nfs/dbraw/zinc/27/29/80/565272980.db2.gz KQRPMQVVXRQEKS-ZETCQYMHSA-N 0 0 384.211 3.242 20 5 GGBDRN C[C@@H]1CN(C(=O)c2sc(Br)cc2[N+](=O)[O-])c2cccnc2O1 ZINC000373163363 565273096 /nfs/dbraw/zinc/27/30/96/565273096.db2.gz KQRPMQVVXRQEKS-SSDOTTSWSA-N 0 0 384.211 3.242 20 5 GGBDRN Cc1nc(N2CCO[C@H](c3ccc(Br)cc3)C2)ncc1[N+](=O)[O-] ZINC000295604391 565275799 /nfs/dbraw/zinc/27/57/99/565275799.db2.gz URKXFJFWCZVTHW-AWEZNQCLSA-N 0 0 379.214 3.034 20 5 GGBDRN Cc1nc(N2CCO[C@@H](c3ccc(Br)cc3)C2)ncc1[N+](=O)[O-] ZINC000295604393 565276284 /nfs/dbraw/zinc/27/62/84/565276284.db2.gz URKXFJFWCZVTHW-CQSZACIVSA-N 0 0 379.214 3.034 20 5 GGBDRN COc1cc(CN2CCSC[C@@H]2c2nccs2)c([N+](=O)[O-])cc1OC ZINC000186657176 565276304 /nfs/dbraw/zinc/27/63/04/565276304.db2.gz OWXFKGROTWZFLA-CYBMUJFWSA-N 0 0 381.479 3.359 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1nccs1 ZINC000186671648 565277101 /nfs/dbraw/zinc/27/71/01/565277101.db2.gz CLVDULRBLDYWLG-MRVPVSSYSA-N 0 0 395.384 3.152 20 5 GGBDRN O=C(NCC(F)(F)Br)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000295637990 565277945 /nfs/dbraw/zinc/27/79/45/565277945.db2.gz DDSWAXCUVIPAHT-UHFFFAOYSA-N 0 0 377.063 3.331 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1scnc1C ZINC000295636107 565278066 /nfs/dbraw/zinc/27/80/66/565278066.db2.gz ALMGDFFAEOJDNJ-UHFFFAOYSA-N 0 0 381.479 3.071 20 5 GGBDRN Cc1ncc(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(Cl)c1Cl ZINC000373309021 565279028 /nfs/dbraw/zinc/27/90/28/565279028.db2.gz ODQYCNDNZPENKF-UHFFFAOYSA-N 0 0 384.223 3.279 20 5 GGBDRN O=C([C@@H]1SCCc2sccc21)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373306671 565279062 /nfs/dbraw/zinc/27/90/62/565279062.db2.gz SPYOJEOPIAFMOP-OAHLLOKOSA-N 0 0 378.479 3.047 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@@H]1CCCC1=O ZINC000272189582 565280209 /nfs/dbraw/zinc/28/02/09/565280209.db2.gz NDSORVYFUHVXGH-GXTWGEPZSA-N 0 0 381.226 3.331 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1[C@@H]1CCCC1=O ZINC000272189586 565280368 /nfs/dbraw/zinc/28/03/68/565280368.db2.gz NDSORVYFUHVXGH-JSGCOSHPSA-N 0 0 381.226 3.331 20 5 GGBDRN CCOC(=O)Cc1csc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)n1 ZINC000295688010 565281145 /nfs/dbraw/zinc/28/11/45/565281145.db2.gz LNEWYKJJGNDPBF-UHFFFAOYSA-N 0 0 383.813 3.371 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc(Br)cn1)c1ccccc1[N+](=O)[O-] ZINC000373378416 565281653 /nfs/dbraw/zinc/28/16/53/565281653.db2.gz SANWZYBYYWANJM-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN Cc1cnc([C@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000186740084 565282389 /nfs/dbraw/zinc/28/23/89/565282389.db2.gz SUAKGBVBSARDKZ-MRVPVSSYSA-N 0 0 375.859 3.095 20 5 GGBDRN C[C@@H](Sc1nc2cncnc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186738984 565282498 /nfs/dbraw/zinc/28/24/98/565282498.db2.gz YFSZGLHCVIGQKW-SSDOTTSWSA-N 0 0 378.801 3.034 20 5 GGBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[C@@H]1OCCc2sccc21 ZINC000295707253 565282679 /nfs/dbraw/zinc/28/26/79/565282679.db2.gz RABYNWXSVDFJJV-QFYYESIMSA-N 0 0 382.463 3.174 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CCO1 ZINC000272258679 565283247 /nfs/dbraw/zinc/28/32/47/565283247.db2.gz UUOGLZSVKUQPMZ-WCQYABFASA-N 0 0 376.500 3.456 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CCO1 ZINC000272258676 565283297 /nfs/dbraw/zinc/28/32/97/565283297.db2.gz UUOGLZSVKUQPMZ-DGCLKSJQSA-N 0 0 376.500 3.456 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)[C@H](O)c2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000272310962 565283752 /nfs/dbraw/zinc/28/37/52/565283752.db2.gz YGJLALJZMZKXBB-WJWGPLDTSA-N 0 0 387.223 3.039 20 5 GGBDRN CC(C)N1CCO[C@@H](c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)C1 ZINC000272351004 565285163 /nfs/dbraw/zinc/28/51/63/565285163.db2.gz AFAOBDHDLFDAFS-CYBMUJFWSA-N 0 0 397.229 3.189 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCc1ccccc1Br ZINC000161485788 565285486 /nfs/dbraw/zinc/28/54/86/565285486.db2.gz ZDWKVRJNOSCYBT-UHFFFAOYSA-N 0 0 399.266 3.019 20 5 GGBDRN CNc1nnc(SCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])s1 ZINC000272364525 565285481 /nfs/dbraw/zinc/28/54/81/565285481.db2.gz GACANCXYPXJOLX-UHFFFAOYSA-N 0 0 392.409 3.433 20 5 GGBDRN O=C(NCC1(c2cccc(Br)c2)CCCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000161459666 565285698 /nfs/dbraw/zinc/28/56/98/565285698.db2.gz HEFSKKWQCDFIFW-UHFFFAOYSA-N 0 0 393.241 3.322 20 5 GGBDRN CN(Cc1ncc(Cl)n1C)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000272428685 565287311 /nfs/dbraw/zinc/28/73/11/565287311.db2.gz NCNGEEDOTLECKF-UHFFFAOYSA-N 0 0 376.722 3.273 20 5 GGBDRN COc1ccc(OS(=O)(=O)C2CCC(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000295817805 565288180 /nfs/dbraw/zinc/28/81/80/565288180.db2.gz BSRRCMPOKBGQBP-UHFFFAOYSA-N 0 0 383.344 3.433 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)NCc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000186850837 565290190 /nfs/dbraw/zinc/29/01/90/565290190.db2.gz FPJQLBDZYIHZKD-UHFFFAOYSA-N 0 0 392.767 3.014 20 5 GGBDRN CSc1cccc(C(=O)Nc2nc(-c3nccn3C)cs2)c1[N+](=O)[O-] ZINC000186862860 565291958 /nfs/dbraw/zinc/29/19/58/565291958.db2.gz ZFRVZXXASGTSIV-UHFFFAOYSA-N 0 0 375.435 3.426 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccc(F)c2O1 ZINC000186860210 565292025 /nfs/dbraw/zinc/29/20/25/565292025.db2.gz IYRKZLSYNFKCPX-VIFPVBQESA-N 0 0 386.788 3.364 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N2CCC[C@H]2[C@H]2CCCO2)c1Cl ZINC000295939518 565294707 /nfs/dbraw/zinc/29/47/07/565294707.db2.gz ITZNIRUPRZTZGL-CMPLNLGQSA-N 0 0 395.264 3.234 20 5 GGBDRN CC[C@@H](O)[C@H]1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000161837715 565295250 /nfs/dbraw/zinc/29/52/50/565295250.db2.gz VOGAUYUNUCQWCH-DGCLKSJQSA-N 0 0 397.280 3.216 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H]2[C@H]2CCCO2)c1Cl ZINC000295939540 565295337 /nfs/dbraw/zinc/29/53/37/565295337.db2.gz ITZNIRUPRZTZGL-ZYHUDNBSSA-N 0 0 395.264 3.234 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](c1nc(C)cs1)C(F)(F)F ZINC000295961136 565295343 /nfs/dbraw/zinc/29/53/43/565295343.db2.gz NCAFKBAQKBFVEF-NSHDSACASA-N 0 0 375.328 3.402 20 5 GGBDRN CO[C@H]1CCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000296057879 565299408 /nfs/dbraw/zinc/29/94/08/565299408.db2.gz NJWKWECFWFKEKH-VIFPVBQESA-N 0 0 377.260 3.306 20 5 GGBDRN CSc1cccc(C(=O)Nc2cn(C)cc(Br)c2=O)c1[N+](=O)[O-] ZINC000186982831 565300655 /nfs/dbraw/zinc/30/06/55/565300655.db2.gz HQQXNDKDJRPANR-UHFFFAOYSA-N 0 0 398.238 3.030 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCCCOC1CCOCC1 ZINC000272922334 565301952 /nfs/dbraw/zinc/30/19/52/565301952.db2.gz GIHVAWGHPAUHJJ-UHFFFAOYSA-N 0 0 388.873 3.042 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCSC[C@@H]1c1nccs1 ZINC000187015713 565302552 /nfs/dbraw/zinc/30/25/52/565302552.db2.gz HXPKACLTJOUKQQ-CQSZACIVSA-N 0 0 378.479 3.088 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCSC[C@@H]1c1nccs1 ZINC000187022997 565302753 /nfs/dbraw/zinc/30/27/53/565302753.db2.gz UZCSRLCHLSODMD-CQSZACIVSA-N 0 0 378.479 3.088 20 5 GGBDRN O=C(CN1CCSC[C@H]1c1nccs1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000187046573 565305185 /nfs/dbraw/zinc/30/51/85/565305185.db2.gz SKYYDTSKVXFYOU-ZDUSSCGKSA-N 0 0 398.897 3.433 20 5 GGBDRN Cc1nc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])ccc1[C@H](C)O ZINC000273043843 565305410 /nfs/dbraw/zinc/30/54/10/565305410.db2.gz VSDTWKKWAMHMER-JTQLQIEISA-N 0 0 394.225 3.044 20 5 GGBDRN CC[C@@]1(CO)CCCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000187077898 565307384 /nfs/dbraw/zinc/30/73/84/565307384.db2.gz SORHKSIWSATVCJ-MRXNPFEDSA-N 0 0 385.258 3.290 20 5 GGBDRN Cn1ncc2c1CCC[C@@H]2NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000273109583 565308244 /nfs/dbraw/zinc/30/82/44/565308244.db2.gz MQNXZCAOCKKYHQ-LBPRGKRZSA-N 0 0 380.857 3.268 20 5 GGBDRN O=C(c1ccc(F)cc1Br)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373924225 565310120 /nfs/dbraw/zinc/31/01/20/565310120.db2.gz RFPYXNFXOXRSOE-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](CO)c1ccc(Br)cc1 ZINC000273158480 565310586 /nfs/dbraw/zinc/31/05/86/565310586.db2.gz YUDYDGGCJSQSEN-OAHLLOKOSA-N 0 0 381.226 3.189 20 5 GGBDRN Cc1cc(Br)c(NC(=O)C(=O)N(C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000273155966 565310670 /nfs/dbraw/zinc/31/06/70/565310670.db2.gz SHPMKUNQPWKNTJ-UHFFFAOYSA-N 0 0 386.246 3.109 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@@H](C)Cc2ccc(C)s2)cc1[N+](=O)[O-] ZINC000187132099 565312194 /nfs/dbraw/zinc/31/21/94/565312194.db2.gz XSBCDVKANLFRFP-VIFPVBQESA-N 0 0 388.442 3.022 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)N2CCC[C@H]2c2ccncc2)c1 ZINC000374001123 565314729 /nfs/dbraw/zinc/31/47/29/565314729.db2.gz IGLWYKYVULWYNL-ZDUSSCGKSA-N 0 0 385.804 3.308 20 5 GGBDRN CS(=O)(=O)C1(c2noc(Cc3ccc([N+](=O)[O-])cc3Cl)n2)CCCC1 ZINC000296358514 565314972 /nfs/dbraw/zinc/31/49/72/565314972.db2.gz HYKHSJOIEWEYAE-UHFFFAOYSA-N 0 0 385.829 3.036 20 5 GGBDRN CSCC1CCC(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000296401968 565316499 /nfs/dbraw/zinc/31/64/99/565316499.db2.gz PKCJDWQCGYNVAM-UHFFFAOYSA-N 0 0 385.873 3.225 20 5 GGBDRN CC(C)(C)N(CCS(C)(=O)=O)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000187242894 565318445 /nfs/dbraw/zinc/31/84/45/565318445.db2.gz BSYGBKNFHWYPMD-UHFFFAOYSA-N 0 0 384.479 3.095 20 5 GGBDRN C[C@@]1(NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO[C@@H]1C1CC1 ZINC000273446319 565321202 /nfs/dbraw/zinc/32/12/02/565321202.db2.gz GUBXTLDOUKJAOZ-UKRRQHHQSA-N 0 0 387.205 3.184 20 5 GGBDRN C[C@@]1(NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCO[C@H]1C1CC1 ZINC000273446316 565321775 /nfs/dbraw/zinc/32/17/75/565321775.db2.gz GUBXTLDOUKJAOZ-DZGCQCFKSA-N 0 0 387.205 3.184 20 5 GGBDRN CCOC(=O)C1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CC1 ZINC000162666148 565324840 /nfs/dbraw/zinc/32/48/40/565324840.db2.gz XWKAVAKDFHLWFM-UHFFFAOYSA-N 0 0 399.241 3.081 20 5 GGBDRN CN(Cc1ccsc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000162725295 565325264 /nfs/dbraw/zinc/32/52/64/565325264.db2.gz OVVLLZQMJWTTDT-UHFFFAOYSA-N 0 0 380.369 3.496 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCOC[C@H]1c1nc2ccccc2s1 ZINC000374205294 565325473 /nfs/dbraw/zinc/32/54/73/565325473.db2.gz NTSXGVGRLQCXJT-NSHDSACASA-N 0 0 375.431 3.480 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1cccnc1 ZINC000162720216 565325924 /nfs/dbraw/zinc/32/59/24/565325924.db2.gz KZEAJORUCDPGCZ-VIFPVBQESA-N 0 0 375.328 3.048 20 5 GGBDRN C[C@H]1[C@H](c2ccc(Br)cc2)OCCN1c1ncc([N+](=O)[O-])cn1 ZINC000273573291 565326491 /nfs/dbraw/zinc/32/64/91/565326491.db2.gz AOPMSFSXLQWGJI-IINYFYTJSA-N 0 0 379.214 3.114 20 5 GGBDRN COc1cc(OCC(=O)Nc2ncc(C)cc2Br)ccc1[N+](=O)[O-] ZINC000162763117 565326783 /nfs/dbraw/zinc/32/67/83/565326783.db2.gz CBJHRKOTIDDMSK-UHFFFAOYSA-N 0 0 396.197 3.087 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1[C@H]1CCCC1=O ZINC000374293277 565330044 /nfs/dbraw/zinc/33/00/44/565330044.db2.gz HCUCUVHXHILPNA-HIFRSBDPSA-N 0 0 395.253 3.260 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1Cc2cccc(Br)c2C1 ZINC000187396828 565330075 /nfs/dbraw/zinc/33/00/75/565330075.db2.gz VOHPOIIJUAJLRU-UHFFFAOYSA-N 0 0 376.210 3.312 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H]1[C@H]1CCCC1=O ZINC000374293282 565330498 /nfs/dbraw/zinc/33/04/98/565330498.db2.gz HCUCUVHXHILPNA-UKRRQHHQSA-N 0 0 395.253 3.260 20 5 GGBDRN C[C@H](NC(=O)NCCCn1cc(Br)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000296706625 565331357 /nfs/dbraw/zinc/33/13/57/565331357.db2.gz VIEGMBYUZDHDPD-NSHDSACASA-N 0 0 396.245 3.004 20 5 GGBDRN CCN(C[C@@H]1CCCO1)S(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC000296733331 565331989 /nfs/dbraw/zinc/33/19/89/565331989.db2.gz OEDLDEGGQFCILO-VIFPVBQESA-N 0 0 383.253 3.091 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H]1c1cccc(Br)c1 ZINC000163046659 565334649 /nfs/dbraw/zinc/33/46/49/565334649.db2.gz XSNMHYYDQKMBFJ-GFCCVEGCSA-N 0 0 379.214 3.068 20 5 GGBDRN CC(C)(C(=O)Nc1cc(-c2ccc(Cl)s2)[nH]n1)n1cc([N+](=O)[O-])cn1 ZINC000163092123 565336376 /nfs/dbraw/zinc/33/63/76/565336376.db2.gz ZBLLVFBWTMNZAE-UHFFFAOYSA-N 0 0 380.817 3.270 20 5 GGBDRN COc1cc(C(=O)Nc2ncc(C)cc2Br)c([N+](=O)[O-])cc1OC ZINC000163159595 565338031 /nfs/dbraw/zinc/33/80/31/565338031.db2.gz IBYDMFATVMDPGI-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(C[C@H]3CCCCO3)n2)c(Br)c1 ZINC000273834337 565338914 /nfs/dbraw/zinc/33/89/14/565338914.db2.gz MGBXBGQDCMUXCX-GFCCVEGCSA-N 0 0 382.214 3.443 20 5 GGBDRN CC(=O)N1CCC[C@@H](c2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)C1 ZINC000273825290 565339024 /nfs/dbraw/zinc/33/90/24/565339024.db2.gz IJXYHGCMEXKEKJ-SNVBAGLBSA-N 0 0 395.213 3.133 20 5 GGBDRN CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000163205807 565340028 /nfs/dbraw/zinc/34/00/28/565340028.db2.gz DKCATJSBADKEMT-ZDUSSCGKSA-N 0 0 376.722 3.207 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000187550928 565340758 /nfs/dbraw/zinc/34/07/58/565340758.db2.gz GTPVDGFJDORQJI-UHFFFAOYSA-N 0 0 386.788 3.147 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(CC[C@H]3CCCO3)n2)c(Br)c1 ZINC000273858090 565341601 /nfs/dbraw/zinc/34/16/01/565341601.db2.gz OPFXIDRAOHRQDU-GFCCVEGCSA-N 0 0 382.214 3.443 20 5 GGBDRN CN(c1ccc(Cl)cn1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163350913 565343512 /nfs/dbraw/zinc/34/35/12/565343512.db2.gz IREBZKZDAQHHPU-UHFFFAOYSA-N 0 0 395.746 3.487 20 5 GGBDRN C[C@H]1SCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)[C@@H]1C ZINC000163369324 565345088 /nfs/dbraw/zinc/34/50/88/565345088.db2.gz ROWONIMIEJJVAI-RKDXNWHRSA-N 0 0 384.401 3.128 20 5 GGBDRN COC(C)(C)C[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163389274 565345270 /nfs/dbraw/zinc/34/52/70/565345270.db2.gz AKDVROZXPWKACU-VIFPVBQESA-N 0 0 384.376 3.096 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000187617255 565345471 /nfs/dbraw/zinc/34/54/71/565345471.db2.gz WPBURSNJOSPTTG-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN O=C(NC[C@@H]1CCCCC1(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000296919127 565345417 /nfs/dbraw/zinc/34/54/17/565345417.db2.gz RMTCKCXRPSRQPH-VIFPVBQESA-N 0 0 375.759 3.128 20 5 GGBDRN CCN(c1ccncc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163430368 565346437 /nfs/dbraw/zinc/34/64/37/565346437.db2.gz JVTIYSYRFCCOJS-UHFFFAOYSA-N 0 0 375.328 3.224 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CC[C@@](F)(c3ccccc3F)C2)s1 ZINC000374619162 565347112 /nfs/dbraw/zinc/34/71/12/565347112.db2.gz JAGLPXWRZBRHQQ-HNNXBMFYSA-N 0 0 388.417 3.274 20 5 GGBDRN CSC[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163495525 565347913 /nfs/dbraw/zinc/34/79/13/565347913.db2.gz HCMFRXXZPKVGSD-SNVBAGLBSA-N 0 0 384.401 3.130 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)NC1(c2cccc(Cl)c2)CC1 ZINC000163573246 565348493 /nfs/dbraw/zinc/34/84/93/565348493.db2.gz AWCZQZGQERNMDE-UHFFFAOYSA-N 0 0 380.853 3.399 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000163738959 565351443 /nfs/dbraw/zinc/35/14/43/565351443.db2.gz HVNKUWYEIJGQEM-CQSZACIVSA-N 0 0 396.241 3.291 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2cn3ccccc3n2)cc1[N+](=O)[O-] ZINC000163882858 565352272 /nfs/dbraw/zinc/35/22/72/565352272.db2.gz GWIAKSYBIQHVQY-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN Cc1cc(C2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)ccc1Br ZINC000187768095 565353989 /nfs/dbraw/zinc/35/39/89/565353989.db2.gz NPXRLKNXOSAMPR-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN CS(=O)(=O)[C@@H]1CCCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000274047876 565353990 /nfs/dbraw/zinc/35/39/90/565353990.db2.gz KLKVZQNIAFTOBZ-MRVPVSSYSA-N 0 0 386.779 3.280 20 5 GGBDRN C[C@H](C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccc(Cl)s1 ZINC000297098555 565356135 /nfs/dbraw/zinc/35/61/35/565356135.db2.gz YWJNADXKGMUXLL-NSHDSACASA-N 0 0 380.857 3.157 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2cc(Br)c(=O)n(C)c2)cc1[N+](=O)[O-] ZINC000187876691 565361604 /nfs/dbraw/zinc/36/16/04/565361604.db2.gz ZWTGKFRZFAFONB-UHFFFAOYSA-N 0 0 394.225 3.432 20 5 GGBDRN COc1ccc2c(c1)[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])CCO2 ZINC000274242545 565363022 /nfs/dbraw/zinc/36/30/22/565363022.db2.gz DFQYVTRKUOOAQB-NSHDSACASA-N 0 0 384.435 3.004 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(I)c1 ZINC000164819300 565363850 /nfs/dbraw/zinc/36/38/50/565363850.db2.gz JGAGTFJBPIJWFA-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](n2ccnc2)C1 ZINC000375053745 565365561 /nfs/dbraw/zinc/36/55/61/565365561.db2.gz YVYGUHMZJXUHPB-LBPRGKRZSA-N 0 0 393.241 3.340 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@@H]2CCOC2)C1 ZINC000375041217 565365631 /nfs/dbraw/zinc/36/56/31/565365631.db2.gz HXCSCTQEMLYXTH-NWDGAFQWSA-N 0 0 383.242 3.164 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCc2ccc(Cl)cc2C1 ZINC000165727645 565370536 /nfs/dbraw/zinc/37/05/36/565370536.db2.gz GIHZYVCVGBGMDF-UHFFFAOYSA-N 0 0 380.853 3.179 20 5 GGBDRN CCO[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)C12CCOCC2 ZINC000274439905 565371008 /nfs/dbraw/zinc/37/10/08/565371008.db2.gz DPJRSKHEHBAMGN-CHWSQXEVSA-N 0 0 386.246 3.138 20 5 GGBDRN COC[C@@H]1CCCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000375139204 565371460 /nfs/dbraw/zinc/37/14/60/565371460.db2.gz HOCWWDZOXLSVAF-GFCCVEGCSA-N 0 0 385.258 3.175 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NC1CCC(O)(c2cccnc2)CC1 ZINC000274490208 565371998 /nfs/dbraw/zinc/37/19/98/565371998.db2.gz QXJAMLYNDAGGFO-UHFFFAOYSA-N 0 0 393.241 3.390 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCSC[C@@H]1c1nccs1 ZINC000274553586 565373978 /nfs/dbraw/zinc/37/39/78/565373978.db2.gz YEKXYOJYAROYIK-CQSZACIVSA-N 0 0 378.479 3.094 20 5 GGBDRN CSc1cccc(C(=O)NCCN2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000188079294 565376453 /nfs/dbraw/zinc/37/64/53/565376453.db2.gz KTMHBUYZGPRHTN-UHFFFAOYSA-N 0 0 377.491 3.166 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000167556541 565378274 /nfs/dbraw/zinc/37/82/74/565378274.db2.gz YSSKXDUCSRUXLN-MFKMUULPSA-N 0 0 382.825 3.091 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@H]1COc2ccccc21 ZINC000167532047 565378314 /nfs/dbraw/zinc/37/83/14/565378314.db2.gz DMTYOMQGTYYTMH-ZWNOBZJWSA-N 0 0 382.825 3.091 20 5 GGBDRN CC(C)(C)OC(=O)[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000167692588 565379081 /nfs/dbraw/zinc/37/90/81/565379081.db2.gz PJMLELNRUGZVBQ-JTQLQIEISA-N 0 0 386.246 3.310 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000167692477 565379370 /nfs/dbraw/zinc/37/93/70/565379370.db2.gz PJMLELNRUGZVBQ-SNVBAGLBSA-N 0 0 386.246 3.310 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000167720940 565380007 /nfs/dbraw/zinc/38/00/07/565380007.db2.gz NFHSJVIMEALMGX-SNVBAGLBSA-N 0 0 386.246 3.310 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2cn(C)cc(Br)c2=O)cc1[N+](=O)[O-] ZINC000188117252 565380547 /nfs/dbraw/zinc/38/05/47/565380547.db2.gz DPMCSGWPKMGUTF-UHFFFAOYSA-N 0 0 394.225 3.432 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(Br)c(F)cc1F ZINC000188144891 565382586 /nfs/dbraw/zinc/38/25/86/565382586.db2.gz BIDCKRAKUPYSNB-UHFFFAOYSA-N 0 0 389.156 3.169 20 5 GGBDRN CC[C@@H](COCC(F)(F)F)NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000297729690 565384134 /nfs/dbraw/zinc/38/41/34/565384134.db2.gz MDGCDYJQVIGYKE-QMMMGPOBSA-N 0 0 399.163 3.445 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(Sc3nnc(N4CCCC4)s3)cc2N1 ZINC000170639887 565385028 /nfs/dbraw/zinc/38/50/28/565385028.db2.gz AVVCVOMVRULYOZ-UHFFFAOYSA-N 0 0 377.451 3.082 20 5 GGBDRN COCCN(C(=O)C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000297762554 565385426 /nfs/dbraw/zinc/38/54/26/565385426.db2.gz PDRZEWANULZROV-UHFFFAOYSA-N 0 0 375.328 3.260 20 5 GGBDRN CCOC(=O)Cc1cnc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)s1 ZINC000297833418 565389117 /nfs/dbraw/zinc/38/91/17/565389117.db2.gz VXCZNWQKDNTHNC-UHFFFAOYSA-N 0 0 383.813 3.371 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2nnc(-c3cccc(Cl)c3)s2)c1[N+](=O)[O-] ZINC000170803613 565392945 /nfs/dbraw/zinc/39/29/45/565392945.db2.gz VZLFBGFRUQKWEF-UHFFFAOYSA-N 0 0 378.801 3.061 20 5 GGBDRN CCN(Cc1cc(Br)ccc1F)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000188336965 565395957 /nfs/dbraw/zinc/39/59/57/565395957.db2.gz DSODALNJNGEXKX-UHFFFAOYSA-N 0 0 398.188 3.259 20 5 GGBDRN O=C(c1ccc(Br)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188463988 565403108 /nfs/dbraw/zinc/40/31/08/565403108.db2.gz IGIPALXGBNHNOB-UHFFFAOYSA-N 0 0 377.194 3.261 20 5 GGBDRN Cn1nnnc1Sc1ccc(Cl)cc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000171033283 565403918 /nfs/dbraw/zinc/40/39/18/565403918.db2.gz QYESECMARHPLSY-UHFFFAOYSA-N 0 0 396.841 3.237 20 5 GGBDRN Cn1nnnc1Sc1ccc(Cl)cc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000171033250 565404066 /nfs/dbraw/zinc/40/40/66/565404066.db2.gz OZMJRMKNPMQVSJ-UHFFFAOYSA-N 0 0 396.841 3.237 20 5 GGBDRN O=C(c1cc(Br)cs1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188545355 565407814 /nfs/dbraw/zinc/40/78/14/565407814.db2.gz KMHHYFSIQFNEKU-UHFFFAOYSA-N 0 0 383.223 3.322 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000275417405 565409493 /nfs/dbraw/zinc/40/94/93/565409493.db2.gz HXNGCISRCAOPIY-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC(c2ccncn2)CC1 ZINC000298346069 565409741 /nfs/dbraw/zinc/40/97/41/565409741.db2.gz OJAUCMQURXSWIM-UHFFFAOYSA-N 0 0 391.225 3.167 20 5 GGBDRN CCOC1CC2(C1)CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)C2 ZINC000375872731 565410762 /nfs/dbraw/zinc/41/07/62/565410762.db2.gz KZMMRDVQVROLMO-UHFFFAOYSA-N 0 0 397.269 3.317 20 5 GGBDRN O=C([C@H]1CC12CCOCC2)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000375885887 565411704 /nfs/dbraw/zinc/41/17/04/565411704.db2.gz WQQVCHCSNQSRME-CYBMUJFWSA-N 0 0 395.253 3.059 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@H]2c2nc(C)cs2)c1 ZINC000188610240 565412800 /nfs/dbraw/zinc/41/28/00/565412800.db2.gz VXYQJEJKAHNALA-AWEZNQCLSA-N 0 0 379.463 3.295 20 5 GGBDRN CC(C)CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000171204262 565417606 /nfs/dbraw/zinc/41/76/06/565417606.db2.gz GNZCCEBCZRFMLT-WCQYABFASA-N 0 0 385.511 3.112 20 5 GGBDRN CC(C)CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000171204246 565418365 /nfs/dbraw/zinc/41/83/65/565418365.db2.gz GNZCCEBCZRFMLT-YPMHNXCESA-N 0 0 385.511 3.112 20 5 GGBDRN CCN([C@H](C)Cc1ccsc1)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000188762038 565421766 /nfs/dbraw/zinc/42/17/66/565421766.db2.gz HRPFUUXSZBREOF-GFCCVEGCSA-N 0 0 384.479 3.307 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(C3(O)CCCCC3)n2)c(Br)c1 ZINC000275685424 565422783 /nfs/dbraw/zinc/42/27/83/565422783.db2.gz HNOHWNQXKKNPDP-UHFFFAOYSA-N 0 0 382.214 3.483 20 5 GGBDRN CCN([C@@H](C)Cc1ccsc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000188763070 565423183 /nfs/dbraw/zinc/42/31/83/565423183.db2.gz NTKUENWIASGJJV-LBPRGKRZSA-N 0 0 384.479 3.307 20 5 GGBDRN CSc1nnc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000275670972 565423311 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GGBDRN O=C(NCCCO[C@@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1Br ZINC000298829733 565431324 /nfs/dbraw/zinc/43/13/24/565431324.db2.gz CENAZNBEPFVBLG-CQSZACIVSA-N 0 0 387.230 3.020 20 5 GGBDRN CC[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl)C(OC)OC ZINC000298860268 565432330 /nfs/dbraw/zinc/43/23/30/565432330.db2.gz GBSWZNWVQPUPSJ-VIFPVBQESA-N 0 0 395.637 3.138 20 5 GGBDRN COc1ccc(Br)c(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000171446324 565432541 /nfs/dbraw/zinc/43/25/41/565432541.db2.gz SIQXZEGXRBLTRX-UHFFFAOYSA-N 0 0 397.229 3.208 20 5 GGBDRN CC1(C)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC(C)(C)O1 ZINC000188934082 565433864 /nfs/dbraw/zinc/43/38/64/565433864.db2.gz OIULBHMUDIXNNM-UHFFFAOYSA-N 0 0 385.258 3.316 20 5 GGBDRN CCOC(CCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])OCC ZINC000276162790 565438449 /nfs/dbraw/zinc/43/84/49/565438449.db2.gz DWDVMADPCDRVRS-UHFFFAOYSA-N 0 0 376.862 3.246 20 5 GGBDRN C[C@@H](CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1)Oc1ccc(Cl)c(Cl)c1 ZINC000189054949 565441128 /nfs/dbraw/zinc/44/11/28/565441128.db2.gz LDAXJYGUHQTMGH-JTQLQIEISA-N 0 0 387.223 3.024 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2Cl)s1 ZINC000299268894 565444604 /nfs/dbraw/zinc/44/46/04/565444604.db2.gz LYWQYIJQWXTXLX-VIFPVBQESA-N 0 0 381.841 3.304 20 5 GGBDRN Cn1nccc1[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000376598300 565444707 /nfs/dbraw/zinc/44/47/07/565444707.db2.gz BFFWCOFOGLPMBA-NSHDSACASA-N 0 0 393.241 3.111 20 5 GGBDRN C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C[C@@H](c2ccsc2)O1 ZINC000276377123 565446657 /nfs/dbraw/zinc/44/66/57/565446657.db2.gz YAXDZROPDWCHLE-ABAIWWIYSA-N 0 0 382.463 3.026 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H](c1nccs1)c1ccccc1 ZINC000171713626 565446720 /nfs/dbraw/zinc/44/67/20/565446720.db2.gz HFHQBZBGMSNPCO-HNNXBMFYSA-N 0 0 375.431 3.119 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2nccs2)c2ccccc2)cc1 ZINC000171713584 565446916 /nfs/dbraw/zinc/44/69/16/565446916.db2.gz DLBIIDKRUVAFEN-OAHLLOKOSA-N 0 0 375.431 3.119 20 5 GGBDRN C[C@H]1CN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C[C@H](c2ccsc2)O1 ZINC000276377133 565447095 /nfs/dbraw/zinc/44/70/95/565447095.db2.gz YAXDZROPDWCHLE-XHDPSFHLSA-N 0 0 382.463 3.026 20 5 GGBDRN C[C@H](N[C@@H](C(N)=O)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000171758628 565449647 /nfs/dbraw/zinc/44/96/47/565449647.db2.gz RICYSDYHQIHKRV-ZUZCIYMTSA-N 0 0 378.226 3.235 20 5 GGBDRN O=C(NC[C@H]1CCCCC1(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000299415960 565449761 /nfs/dbraw/zinc/44/97/61/565449761.db2.gz UBPGCSJOXFXTGS-SECBINFHSA-N 0 0 375.759 3.128 20 5 GGBDRN CCc1n[nH]c(C(=O)N(C)Cc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000171774740 565450670 /nfs/dbraw/zinc/45/06/70/565450670.db2.gz DGDLSGRUOKDVEN-UHFFFAOYSA-N 0 0 385.193 3.054 20 5 GGBDRN Cn1nccc1[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000376714622 565451381 /nfs/dbraw/zinc/45/13/81/565451381.db2.gz FPPRVPNYZLPJKW-NSHDSACASA-N 0 0 393.241 3.111 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCc3ccc(Br)cc32)c([N+](=O)[O-])c1 ZINC000171820046 565452669 /nfs/dbraw/zinc/45/26/69/565452669.db2.gz APLZUOLWGCHCOS-UHFFFAOYSA-N 0 0 397.250 3.455 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000189262365 565454434 /nfs/dbraw/zinc/45/44/34/565454434.db2.gz UABXURMEHZGPFK-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN CCS(=O)(=O)CCCCCSCCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000276607597 565454489 /nfs/dbraw/zinc/45/44/89/565454489.db2.gz LEHRGBVJJRSKJA-UHFFFAOYSA-N 0 0 391.511 3.320 20 5 GGBDRN O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000189271735 565455805 /nfs/dbraw/zinc/45/58/05/565455805.db2.gz YSSHBHHIGAEXMG-UHFFFAOYSA-N 0 0 379.766 3.252 20 5 GGBDRN O=C(CC[C@@H]1CCCO1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000299615525 565456231 /nfs/dbraw/zinc/45/62/31/565456231.db2.gz HAPZUGMBESSQFV-NSHDSACASA-N 0 0 383.242 3.201 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@@H]1CCCN(C(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000171887060 565456588 /nfs/dbraw/zinc/45/65/88/565456588.db2.gz NTEJZYXROCZCOI-SNVBAGLBSA-N 0 0 381.483 3.137 20 5 GGBDRN O=C(NCC(F)(F)C(F)F)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000276695604 565458153 /nfs/dbraw/zinc/45/81/53/565458153.db2.gz GOIAZFXBWOVLNA-UHFFFAOYSA-N 0 0 377.063 3.127 20 5 GGBDRN Cn1cc([C@H]2CSCCN2Cc2ccc(Br)c([N+](=O)[O-])c2)cn1 ZINC000276767004 565459661 /nfs/dbraw/zinc/45/96/61/565459661.db2.gz HOTRDLBVPSXFOI-OAHLLOKOSA-N 0 0 397.298 3.381 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1 ZINC000189359497 565460887 /nfs/dbraw/zinc/46/08/87/565460887.db2.gz MMNNJZXNBLKFBN-UHFFFAOYSA-N 0 0 375.324 3.466 20 5 GGBDRN COc1cc(C(=O)Nc2nnc(CC(F)(F)F)s2)cc([N+](=O)[O-])c1C ZINC000276794342 565460995 /nfs/dbraw/zinc/46/09/95/565460995.db2.gz PZXJBVTVUSHUPB-UHFFFAOYSA-N 0 0 376.316 3.120 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCc2nc(C(C)(C)C)cs2)ccc1[N+](=O)[O-] ZINC000172020641 565463014 /nfs/dbraw/zinc/46/30/14/565463014.db2.gz GFOZXNMXCUHTHP-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN COc1ccc(C(=O)NCCNc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000301062604 565463024 /nfs/dbraw/zinc/46/30/24/565463024.db2.gz DQCWDUXYZROCKD-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN Cc1ncc(CNc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000301088008 565463580 /nfs/dbraw/zinc/46/35/80/565463580.db2.gz KLHIEJBYECZQPX-UHFFFAOYSA-N 0 0 381.357 3.265 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1cc(Br)ccc1OC ZINC000301091542 565463641 /nfs/dbraw/zinc/46/36/41/565463641.db2.gz HXZNEHAUQXTCPV-UHFFFAOYSA-N 0 0 394.225 3.338 20 5 GGBDRN CN(Cc1csc2ccccc12)c1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1 ZINC000301119166 565464907 /nfs/dbraw/zinc/46/49/07/565464907.db2.gz QVCPCLQTNPCBMS-UHFFFAOYSA-N 0 0 377.447 3.093 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccncc3)CC2)c(Br)c1 ZINC000301107124 565465119 /nfs/dbraw/zinc/46/51/19/565465119.db2.gz PXSHCUGECZBIRG-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc3c(s2)CSCC3)cc1[N+](=O)[O-] ZINC000377106277 565466142 /nfs/dbraw/zinc/46/61/42/565466142.db2.gz RHJIANMNYNQNEK-UHFFFAOYSA-N 0 0 380.407 3.310 20 5 GGBDRN Cn1nc(Br)c2c1ncnc2Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000301144838 565466897 /nfs/dbraw/zinc/46/68/97/565466897.db2.gz FVSMGABXDTZEBT-UHFFFAOYSA-N 0 0 384.577 3.480 20 5 GGBDRN O=C(CNc1ccc(Br)cc1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000301148741 565467525 /nfs/dbraw/zinc/46/75/25/565467525.db2.gz CDJWDXMUWHHSJN-UHFFFAOYSA-N 0 0 390.237 3.354 20 5 GGBDRN CCc1n[nH]c(C(=O)NCCCc2ccc(Br)cc2F)c1[N+](=O)[O-] ZINC000172138360 565468703 /nfs/dbraw/zinc/46/87/03/565468703.db2.gz KVJVCCQQDQPICV-UHFFFAOYSA-N 0 0 399.220 3.145 20 5 GGBDRN O=C(CCNc1ccc(Br)cc1[N+](=O)[O-])NCc1ccccc1 ZINC000301164350 565469328 /nfs/dbraw/zinc/46/93/28/565469328.db2.gz IBEZOBXBFKSBNH-UHFFFAOYSA-N 0 0 378.226 3.476 20 5 GGBDRN COc1cccc(C(=O)NCCNc2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000301167249 565469858 /nfs/dbraw/zinc/46/98/58/565469858.db2.gz IYGGUTNBRKIBCZ-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN Cc1cccc(C(=O)N2CCC(n3cc(Br)cn3)CC2)c1[N+](=O)[O-] ZINC000377186169 565469941 /nfs/dbraw/zinc/46/99/41/565469941.db2.gz WHFWUYUYPOZZTH-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN C[C@@H]1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CCS1(=O)=O ZINC000276992392 565470299 /nfs/dbraw/zinc/47/02/99/565470299.db2.gz IRKCMKKYJJKRRF-MRVPVSSYSA-N 0 0 386.779 3.280 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301188634 565470878 /nfs/dbraw/zinc/47/08/78/565470878.db2.gz LDVCWUJIPCZKLS-NSHDSACASA-N 0 0 386.246 3.461 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301193495 565470971 /nfs/dbraw/zinc/47/09/71/565470971.db2.gz SRJJFJFGYSOOAV-GFCCVEGCSA-N 0 0 384.274 3.490 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1NCCCNC(=O)c1cccc(Br)c1 ZINC000301213029 565471822 /nfs/dbraw/zinc/47/18/22/565471822.db2.gz YCORZIUVFXJNPE-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN Cc1noc(C)c1CCNc1ccc(I)cc1[N+](=O)[O-] ZINC000301214083 565472135 /nfs/dbraw/zinc/47/21/35/565472135.db2.gz YUSAEHLGERDCNZ-UHFFFAOYSA-N 0 0 387.177 3.459 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301207412 565472159 /nfs/dbraw/zinc/47/21/59/565472159.db2.gz ZWCACNIDTVOWFY-GFCCVEGCSA-N 0 0 384.274 3.346 20 5 GGBDRN C[C@H](CNc1ccc(I)cc1[N+](=O)[O-])Cn1cccn1 ZINC000301230287 565473237 /nfs/dbraw/zinc/47/32/37/565473237.db2.gz FBKXUVUSTOXFEP-SNVBAGLBSA-N 0 0 386.193 3.144 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1NCc1cc(F)ccc1F ZINC000301238383 565474161 /nfs/dbraw/zinc/47/41/61/565474161.db2.gz IRRTYYIZRAVJOG-UHFFFAOYSA-N 0 0 378.303 3.481 20 5 GGBDRN CNC(=O)c1ccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000301247852 565474283 /nfs/dbraw/zinc/47/42/83/565474283.db2.gz LSPCCADTGYXTMG-OAHLLOKOSA-N 0 0 384.219 3.407 20 5 GGBDRN Cc1ccnc(NCCCNC(=O)c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000301253974 565475302 /nfs/dbraw/zinc/47/53/02/565475302.db2.gz CZCVICRNYUYFAL-UHFFFAOYSA-N 0 0 393.241 3.293 20 5 GGBDRN Cc1nn(C)c(N[C@H]2CCN(c3ccccc3Br)C2)c1[N+](=O)[O-] ZINC000301251510 565475802 /nfs/dbraw/zinc/47/58/02/565475802.db2.gz MUPQQVOLHVOSIZ-NSHDSACASA-N 0 0 380.246 3.090 20 5 GGBDRN O=C(N[C@H]1CCO[C@@H]1c1cccnc1)c1cccc([N+](=O)[O-])c1Br ZINC000277082511 565476003 /nfs/dbraw/zinc/47/60/03/565476003.db2.gz ARLINZVNSJNWJR-SWLSCSKDSA-N 0 0 392.209 3.012 20 5 GGBDRN CC[C@H](C)c1nnc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2Br)[nH]1 ZINC000277114326 565476477 /nfs/dbraw/zinc/47/64/77/565476477.db2.gz DUABQHCSVFWMGU-DTWKUNHWSA-N 0 0 396.245 3.480 20 5 GGBDRN CC(C)N1C(=S)N=NC1CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000301275597 565476670 /nfs/dbraw/zinc/47/66/70/565476670.db2.gz IRYXTDUAMOTVHC-UHFFFAOYSA-N 0 0 386.275 3.473 20 5 GGBDRN Cc1ccc(C(=O)NC2CCN(c3ncc([N+](=O)[O-])cc3Cl)CC2)s1 ZINC000301285286 565476834 /nfs/dbraw/zinc/47/68/34/565476834.db2.gz QJIXJBHFYZYXJB-UHFFFAOYSA-N 0 0 380.857 3.412 20 5 GGBDRN COC[C@@H]1CCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000301272176 565476908 /nfs/dbraw/zinc/47/69/08/565476908.db2.gz NWSWXOZXAVJFBA-SNVBAGLBSA-N 0 0 376.194 3.062 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000277118038 565476995 /nfs/dbraw/zinc/47/69/95/565476995.db2.gz FFZSYOMGWGMKDA-SNVBAGLBSA-N 0 0 379.214 3.100 20 5 GGBDRN CNS(=O)(=O)c1ccc(N(C)[C@H](C)c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000301276300 565477027 /nfs/dbraw/zinc/47/70/27/565477027.db2.gz OUTBUITWGFSIEY-LLVKDONJSA-N 0 0 383.857 3.354 20 5 GGBDRN C[C@@H]1SCCN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000301275539 565477100 /nfs/dbraw/zinc/47/71/00/565477100.db2.gz IOVYVVXDUDONHQ-IUCAKERBSA-N 0 0 384.401 3.219 20 5 GGBDRN O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cccc([N+](=O)[O-])c1Br ZINC000277106855 565477203 /nfs/dbraw/zinc/47/72/03/565477203.db2.gz CZCPPBYRSVEHKW-UHFFFAOYSA-N 0 0 395.213 3.227 20 5 GGBDRN Cc1noc(C)c1[C@H](C)Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000301297016 565477727 /nfs/dbraw/zinc/47/77/27/565477727.db2.gz SOXXPNGZTKXJJC-ZETCQYMHSA-N 0 0 375.353 3.369 20 5 GGBDRN CCOC[C@H]1CCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000301292100 565477794 /nfs/dbraw/zinc/47/77/94/565477794.db2.gz QPQYYTRURZXWRB-NSHDSACASA-N 0 0 390.221 3.452 20 5 GGBDRN Cc1nn(C)c(Sc2nnc(COc3ccc(Cl)cc3)o2)c1[N+](=O)[O-] ZINC000301305213 565477865 /nfs/dbraw/zinc/47/78/65/565477865.db2.gz XRAFIAQDWUMDDN-UHFFFAOYSA-N 0 0 381.801 3.403 20 5 GGBDRN O=C(NCc1ccco1)[C@H]1CCCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000301292272 565477930 /nfs/dbraw/zinc/47/79/30/565477930.db2.gz UJOKGFBVELTSRF-CQSZACIVSA-N 0 0 394.225 3.236 20 5 GGBDRN CNC(=O)COc1ccc(Oc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000301309971 565477959 /nfs/dbraw/zinc/47/79/59/565477959.db2.gz YLVHRFFAWXJPGD-UHFFFAOYSA-N 0 0 381.182 3.274 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1N1CCN(c2ccccc2O)CC1 ZINC000301364897 565481500 /nfs/dbraw/zinc/48/15/00/565481500.db2.gz RWWOPKPNULZZQZ-UHFFFAOYSA-N 0 0 378.226 3.390 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1NCc1cccnc1N1CCOCC1 ZINC000301362031 565481521 /nfs/dbraw/zinc/48/15/21/565481521.db2.gz QLSJTJWNDZTBIS-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1F ZINC000172375369 565482110 /nfs/dbraw/zinc/48/21/10/565482110.db2.gz 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Cc1ccc(S(=O)(=O)N2CCC(Nc3sccc3[N+](=O)[O-])CC2)cc1 ZINC000301944808 565519682 /nfs/dbraw/zinc/51/96/82/565519682.db2.gz ZQNQWSWYQUDXEC-UHFFFAOYSA-N 0 0 381.479 3.230 20 5 GGBDRN COc1ccc(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1Cl ZINC000301937302 565519912 /nfs/dbraw/zinc/51/99/12/565519912.db2.gz QYUJWNMDHOADPN-UHFFFAOYSA-N 0 0 376.843 3.334 20 5 GGBDRN COc1ccc(C(C)(C)CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000301944235 565520116 /nfs/dbraw/zinc/52/01/16/565520116.db2.gz ZBABGTBXLWLSAP-UHFFFAOYSA-N 0 0 384.479 3.458 20 5 GGBDRN O=C(C1CCCCC1)N1CC[C@@H](Nc2c(Br)cncc2[N+](=O)[O-])C1 ZINC000301943682 565520243 /nfs/dbraw/zinc/52/02/43/565520243.db2.gz WDOBMGULLIZNLH-GFCCVEGCSA-N 0 0 397.273 3.345 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)s1 ZINC000190301406 565520738 /nfs/dbraw/zinc/52/07/38/565520738.db2.gz ONJZMESFLVQOBU-UHFFFAOYSA-N 0 0 393.778 3.445 20 5 GGBDRN CC[C@@H](C)c1nnc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000277789247 565520753 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396.245 3.480 20 5 GGBDRN CSc1nnc(-c2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000277821939 565522309 /nfs/dbraw/zinc/52/23/09/565522309.db2.gz BHLNROHKQAAOMB-UHFFFAOYSA-N 0 0 378.439 3.263 20 5 GGBDRN Cc1nc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1Br ZINC000301987194 565522769 /nfs/dbraw/zinc/52/27/69/565522769.db2.gz KPJGYDAKAFNFIK-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN C[C@@H]1C[C@@H](Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000301981264 565522813 /nfs/dbraw/zinc/52/28/13/565522813.db2.gz XYDKSWFAOPFTIP-ILWJIGKKSA-N 0 0 382.360 3.256 20 5 GGBDRN CCC1(CC)[C@H](Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])[C@@H](C)[C@H]1OC ZINC000301979066 565523253 /nfs/dbraw/zinc/52/32/53/565523253.db2.gz OQCCDGKSNAFWNP-OASPWFOLSA-N 0 0 376.500 3.311 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1N1CCC[C@H](c2cc[nH]n2)C1 ZINC000301989792 565523606 /nfs/dbraw/zinc/52/36/06/565523606.db2.gz OWCBPEXSUGICSS-JTQLQIEISA-N 0 0 398.204 3.307 20 5 GGBDRN O=C(c1ccc(Br)cc1)N1CCN(c2sccc2[N+](=O)[O-])CC1 ZINC000302005094 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Cc1c(Br)cc(C(=O)N2CCC[C@@H]2c2ncc[nH]2)cc1[N+](=O)[O-] ZINC000378521790 565533149 /nfs/dbraw/zinc/53/31/49/565533149.db2.gz VTCJZYUZPLBTMC-GFCCVEGCSA-N 0 0 379.214 3.366 20 5 GGBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cn1)c1cc2c(cc1Br)OCCO2 ZINC000302160784 565533600 /nfs/dbraw/zinc/53/36/00/565533600.db2.gz PBOMHSIMQSQFBA-MRVPVSSYSA-N 0 0 381.186 3.092 20 5 GGBDRN O=[N+]([O-])c1cnc(NC[C@@H]2CCN(c3ccc(Br)cc3)C2)nc1 ZINC000302155387 565533717 /nfs/dbraw/zinc/53/37/17/565533717.db2.gz MJGXWSCLUTZSOH-NSHDSACASA-N 0 0 378.230 3.086 20 5 GGBDRN Cc1cc(N2CC[C@H](Nc3ncccc3[N+](=O)[O-])C2=O)ccc1Br ZINC000302150955 565534026 /nfs/dbraw/zinc/53/40/26/565534026.db2.gz BKYBDGBORZQJNZ-ZDUSSCGKSA-N 0 0 391.225 3.278 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2cccnc2Br)s1 ZINC000302162098 565534143 /nfs/dbraw/zinc/53/41/43/565534143.db2.gz KCNCQHXHKRJWHW-UHFFFAOYSA-N 0 0 379.213 3.010 20 5 GGBDRN CN(Cc1cc(Cl)cc(Cl)c1)c1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000302163307 565534303 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GGBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CC(=O)Nc2c(F)cccc21 ZINC000378618216 565536363 /nfs/dbraw/zinc/53/63/63/565536363.db2.gz CIKLIKSSEZTCOK-UHFFFAOYSA-N 0 0 394.156 3.095 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-])CCC2 ZINC000302197861 565536345 /nfs/dbraw/zinc/53/63/45/565536345.db2.gz TXRWQRMJIKIPLX-SNVBAGLBSA-N 0 0 387.508 3.339 20 5 GGBDRN O=[N+]([O-])c1cnc(NC2CCN(Cc3ccc(Br)cc3)CC2)nc1 ZINC000302222596 565537447 /nfs/dbraw/zinc/53/74/47/565537447.db2.gz NAUFKGJWRDTMFD-UHFFFAOYSA-N 0 0 392.257 3.224 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)c1cccc([N+](=O)[O-])c1Br)CCO2 ZINC000190526152 565539134 /nfs/dbraw/zinc/53/91/34/565539134.db2.gz GNLVEADSKLPYTA-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)s1 ZINC000173231408 565539320 /nfs/dbraw/zinc/53/93/20/565539320.db2.gz NAVFDGUCBJZVEG-JTQLQIEISA-N 0 0 387.458 3.443 20 5 GGBDRN COc1ccc2c(c1)nc(CNc1ncc([N+](=O)[O-])cc1Br)n2C ZINC000302267213 565539417 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C[S@@](=O)C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000174302549 565628581 /nfs/dbraw/zinc/62/85/81/565628581.db2.gz OMWRYZJLCPEIFF-PUAOIOHZSA-N 0 0 380.853 3.027 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC000409648467 565629701 /nfs/dbraw/zinc/62/97/01/565629701.db2.gz RVZFHPBVJONJRP-LLVKDONJSA-N 0 0 377.413 3.083 20 5 GGBDRN CNS(=O)(=O)c1ccc(N[C@H](C)c2ccccc2SC)c([N+](=O)[O-])c1 ZINC000409654975 565630167 /nfs/dbraw/zinc/63/01/67/565630167.db2.gz YWUYRRHYHJXGAD-LLVKDONJSA-N 0 0 381.479 3.398 20 5 GGBDRN CCSCCCNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000409654948 565630433 /nfs/dbraw/zinc/63/04/33/565630433.db2.gz YRBJVWSJWJTABL-UHFFFAOYSA-N 0 0 387.527 3.325 20 5 GGBDRN O=C(CSC[C@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000191764490 565630556 /nfs/dbraw/zinc/63/05/56/565630556.db2.gz BBIXAYYHZVKHFD-SNVBAGLBSA-N 0 0 375.244 3.208 20 5 GGBDRN O=C1[C@@H](Nc2ncc([N+](=O)[O-])s2)CCN1c1cccc(Br)c1 ZINC000409656328 565631539 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O=[N+]([O-])c1ccccc1S(=O)(=O)N(CCC(F)(F)F)CC(F)(F)F ZINC000279910523 565640828 /nfs/dbraw/zinc/64/08/28/565640828.db2.gz HQFHHVXDZAQOFP-UHFFFAOYSA-N 0 0 380.266 3.100 20 5 GGBDRN CCc1nsc(N2CCCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)n1 ZINC000174512968 565640810 /nfs/dbraw/zinc/64/08/10/565640810.db2.gz MVMMDLWQIPJBDD-UHFFFAOYSA-N 0 0 381.889 3.374 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(Br)cc(C(F)(F)F)c1 ZINC000174530593 565642431 /nfs/dbraw/zinc/64/24/31/565642431.db2.gz OJEPZKBEBMJNPM-UHFFFAOYSA-N 0 0 393.119 3.211 20 5 GGBDRN CO[C@@H]1Cc2ccccc2N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000409833060 565643593 /nfs/dbraw/zinc/64/35/93/565643593.db2.gz OEHYETPADOXQHI-GFCCVEGCSA-N 0 0 382.825 3.015 20 5 GGBDRN CO[C@H]1Cc2ccccc2N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000409837503 565643668 /nfs/dbraw/zinc/64/36/68/565643668.db2.gz UBXGVNATDLWSLC-ZDUSSCGKSA-N 0 0 382.825 3.015 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCSc3c(F)cccc32)c(F)c1 ZINC000409861784 565645314 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565658095 /nfs/dbraw/zinc/65/80/95/565658095.db2.gz VTBCNXFKRIUUSO-VIFPVBQESA-N 0 0 395.213 3.227 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@H](C)c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000280209278 565658923 /nfs/dbraw/zinc/65/89/23/565658923.db2.gz KBCOKIACNFJCGG-SECBINFHSA-N 0 0 395.213 3.497 20 5 GGBDRN CS(=O)(=O)c1ccc(SCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000410035141 565660118 /nfs/dbraw/zinc/66/01/18/565660118.db2.gz UXZBZRCHYOBDAY-UHFFFAOYSA-N 0 0 380.447 3.119 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCn2c3ccccc3nc21 ZINC000192117976 565660161 /nfs/dbraw/zinc/66/01/61/565660161.db2.gz VEFSHDUDGGXSQP-UHFFFAOYSA-N 0 0 387.193 3.367 20 5 GGBDRN C[C@@H](N[C@@H](C)c1ccc(Br)cn1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000280288149 565663645 /nfs/dbraw/zinc/66/36/45/565663645.db2.gz DZLMDWVAMMUHLR-WDEREUQCSA-N 0 0 393.241 3.430 20 5 GGBDRN CCCn1ccnc1CCCN(C)c1c(Br)cncc1[N+](=O)[O-] ZINC000192235087 565672708 /nfs/dbraw/zinc/67/27/08/565672708.db2.gz SVUPOXPKKJRYAF-UHFFFAOYSA-N 0 0 382.262 3.428 20 5 GGBDRN 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Cc1c([N+](=O)[O-])cc(C(=O)N2CCC(C)=C(Br)C2)cc1[N+](=O)[O-] ZINC000280837679 565698981 /nfs/dbraw/zinc/69/89/81/565698981.db2.gz VBEOQITZDCKUMX-UHFFFAOYSA-N 0 0 384.186 3.326 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(Br)c(C2CC2)n1 ZINC000410961786 565702278 /nfs/dbraw/zinc/70/22/78/565702278.db2.gz JFPAOPDRJUUGPP-UHFFFAOYSA-N 0 0 392.209 3.069 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)c(C2CC2)n1 ZINC000410960888 565702441 /nfs/dbraw/zinc/70/24/41/565702441.db2.gz FNQUGZDPLQKUAJ-UHFFFAOYSA-N 0 0 392.209 3.069 20 5 GGBDRN CC(C)(C(=O)Nc1ccc(Br)c(C2CC2)n1)n1cc([N+](=O)[O-])cn1 ZINC000410966676 565702563 /nfs/dbraw/zinc/70/25/63/565702563.db2.gz RGOYKXAFVURYGK-UHFFFAOYSA-N 0 0 394.229 3.200 20 5 GGBDRN COc1ccc(CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000175500864 565702633 /nfs/dbraw/zinc/70/26/33/565702633.db2.gz AQWDUQQVZRNMHJ-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CCC=C(C)C1 ZINC000330387546 565704399 /nfs/dbraw/zinc/70/43/99/565704399.db2.gz BNDVGZAOBNEGLA-UHFFFAOYSA-N 0 0 386.189 3.300 20 5 GGBDRN COc1cccc(C(=O)N[C@H](c2nc(C)cs2)C(F)(F)F)c1[N+](=O)[O-] ZINC000411005440 565704602 /nfs/dbraw/zinc/70/46/02/565704602.db2.gz FTTBJLDVGJUXCJ-LLVKDONJSA-N 0 0 375.328 3.402 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NC1CCN(c2nccs2)CC1 ZINC000280934209 565704687 /nfs/dbraw/zinc/70/46/87/565704687.db2.gz AUKQSTILASGEHD-UHFFFAOYSA-N 0 0 384.259 3.290 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000411026406 565705526 /nfs/dbraw/zinc/70/55/26/565705526.db2.gz UHOYAUXERFFIQF-GOEBONIOSA-N 0 0 381.226 3.141 20 5 GGBDRN Cc1ccc(OCCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000175524268 565705594 /nfs/dbraw/zinc/70/55/94/565705594.db2.gz MJFZYZOALVZYFH-UHFFFAOYSA-N 0 0 379.210 3.475 20 5 GGBDRN CSC(C)(C)CNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000175523957 565705687 /nfs/dbraw/zinc/70/56/87/565705687.db2.gz ZVEAWGFOQAIGRW-UHFFFAOYSA-N 0 0 394.234 3.071 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C1(c2cncc(Br)c2)CC1 ZINC000280979503 565706218 /nfs/dbraw/zinc/70/62/18/565706218.db2.gz JYYCNRCRVDQMJK-UHFFFAOYSA-N 0 0 392.209 3.431 20 5 GGBDRN CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175540180 565706254 /nfs/dbraw/zinc/70/62/54/565706254.db2.gz MPWPVDXMUJJRAS-UHFFFAOYSA-N 0 0 393.193 3.358 20 5 GGBDRN O=C1CCCN1Cc1nnc(Sc2ccc([N+](=O)[O-])cc2Br)o1 ZINC000280986543 565706848 /nfs/dbraw/zinc/70/68/48/565706848.db2.gz IRMUUKAJKDJJJM-UHFFFAOYSA-N 0 0 399.226 3.014 20 5 GGBDRN O=C(NCCc1nc2ccccc2[nH]1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175542921 565707355 /nfs/dbraw/zinc/70/73/55/565707355.db2.gz JPTVVAUSMBOLFV-UHFFFAOYSA-N 0 0 389.209 3.206 20 5 GGBDRN O=C(N1CCc2cc([N+](=O)[O-])ccc21)C1(c2cncc(Br)c2)CC1 ZINC000281035214 565708869 /nfs/dbraw/zinc/70/88/69/565708869.db2.gz QUZJRBKJKPTYPW-UHFFFAOYSA-N 0 0 388.221 3.373 20 5 GGBDRN COC(=O)C1(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])CCCCCC1 ZINC000175563741 565709453 /nfs/dbraw/zinc/70/94/53/565709453.db2.gz ALKAZLZGDKROMM-UHFFFAOYSA-N 0 0 399.241 3.353 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(Br)c(F)cc1Cl ZINC000175575855 565709468 /nfs/dbraw/zinc/70/94/68/565709468.db2.gz OEHQBKBNXAGWGS-UHFFFAOYSA-N 0 0 391.584 3.293 20 5 GGBDRN Cc1c(COc2c(CO)cc(Br)cc2CO)cccc1[N+](=O)[O-] ZINC000192775857 565709927 /nfs/dbraw/zinc/70/99/27/565709927.db2.gz PEKSLNDCVIJYIP-UHFFFAOYSA-N 0 0 382.210 3.229 20 5 GGBDRN COCc1ccccc1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175587519 565710632 /nfs/dbraw/zinc/71/06/32/565710632.db2.gz INQPGPBCXSROEO-UHFFFAOYSA-N 0 0 379.210 3.434 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)NC1CCC(F)(F)CC1 ZINC000330526981 565710796 /nfs/dbraw/zinc/71/07/96/565710796.db2.gz KLFHKAAKBBMVNB-UHFFFAOYSA-N 0 0 399.213 3.214 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000175591924 565711621 /nfs/dbraw/zinc/71/16/21/565711621.db2.gz JKDADSXWKDAYOQ-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN O=C(Nc1cccnc1-n1cccn1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175593487 565711691 /nfs/dbraw/zinc/71/16/91/565711691.db2.gz BWTJZUZFNIGNEE-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCc2c(Cl)ccc(Br)c21 ZINC000411110870 565711854 /nfs/dbraw/zinc/71/18/54/565711854.db2.gz PHDKBHTWJKPHSS-UHFFFAOYSA-N 0 0 399.632 3.187 20 5 GGBDRN COc1cccc(CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000175617799 565712684 /nfs/dbraw/zinc/71/26/84/565712684.db2.gz FAUCPJIRLMOAGC-UHFFFAOYSA-N 0 0 379.210 3.338 20 5 GGBDRN COc1ccc(NC(=O)C2(c3cncc(Br)c3)CC2)c([N+](=O)[O-])c1 ZINC000281115970 565712864 /nfs/dbraw/zinc/71/28/64/565712864.db2.gz XNIIUBVLZAZSRK-UHFFFAOYSA-N 0 0 392.209 3.431 20 5 GGBDRN CCn1c(SC[C@](C)(O)C(F)(F)F)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000281114013 565713055 /nfs/dbraw/zinc/71/30/55/565713055.db2.gz XHMHLRIZCWXHQF-ZDUSSCGKSA-N 0 0 376.360 3.279 20 5 GGBDRN CCC[C@]1(CO)CCCN1C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000330623654 565714575 /nfs/dbraw/zinc/71/45/75/565714575.db2.gz PXBAHMLGZGBOLL-MRXNPFEDSA-N 0 0 385.258 3.433 20 5 GGBDRN O=C(Nc1cc2c(cc1Br)NC(=O)CO2)c1csc([N+](=O)[O-])c1 ZINC000175684438 565715680 /nfs/dbraw/zinc/71/56/80/565715680.db2.gz KHCYUBPHDZOICL-UHFFFAOYSA-N 0 0 398.194 3.002 20 5 GGBDRN COc1cccc(C(=O)NCCNc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000192855464 565715666 /nfs/dbraw/zinc/71/56/66/565715666.db2.gz DGEUVKCZKJCOMF-UHFFFAOYSA-N 0 0 394.225 3.208 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCOc2cc(Cl)c(Cl)cc21 ZINC000281194484 565716388 /nfs/dbraw/zinc/71/63/88/565716388.db2.gz MNDQXRPIABYPOG-UHFFFAOYSA-N 0 0 385.207 3.222 20 5 GGBDRN Cc1ccc(O[C@H](C)C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c(Br)c1 ZINC000281192371 565716816 /nfs/dbraw/zinc/71/68/16/565716816.db2.gz OZOGOVWTXUTPIL-LLVKDONJSA-N 0 0 394.225 3.491 20 5 GGBDRN O=[N+]([O-])c1cc(F)c(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)cc1Cl ZINC000281216286 565717840 /nfs/dbraw/zinc/71/78/40/565717840.db2.gz QSNLVMBWFCELBD-CYBMUJFWSA-N 0 0 385.804 3.308 20 5 GGBDRN COC[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000192929496 565719577 /nfs/dbraw/zinc/71/95/77/565719577.db2.gz LOGPUDXZENKKIT-INIZCTEOSA-N 0 0 384.841 3.055 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Br)c(F)cc2F)c1[N+](=O)[O-] ZINC000192933333 565720194 /nfs/dbraw/zinc/72/01/94/565720194.db2.gz DHPWUQJWZFXERK-UHFFFAOYSA-N 0 0 375.129 3.173 20 5 GGBDRN COC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000192929285 565720250 /nfs/dbraw/zinc/72/02/50/565720250.db2.gz LZYCPTHXAMQZHT-CQSZACIVSA-N 0 0 388.804 3.053 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1c(F)ccc(C)c1Br ZINC000281264222 565720702 /nfs/dbraw/zinc/72/07/02/565720702.db2.gz RQTUANPICIHXSN-UHFFFAOYSA-N 0 0 385.193 3.339 20 5 GGBDRN COc1ccc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2N)cc1Br ZINC000175793631 565724023 /nfs/dbraw/zinc/72/40/23/565724023.db2.gz OJXZWLXGDYKIOA-VIFPVBQESA-N 0 0 394.225 3.439 20 5 GGBDRN CN(C[C@H]1CC=CCC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000330830811 565724800 /nfs/dbraw/zinc/72/48/00/565724800.db2.gz IVQYQBCJRISOFC-NSHDSACASA-N 0 0 389.271 3.334 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1ccc2ncccc2c1 ZINC000193030146 565725854 /nfs/dbraw/zinc/72/58/54/565725854.db2.gz ZGTORGJKOCIOIN-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN COc1cc(C(=O)NCc2ccccc2Br)c([N+](=O)[O-])cc1OC ZINC000193032341 565726570 /nfs/dbraw/zinc/72/65/70/565726570.db2.gz TZOIHAAKPHYRSX-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1ccc2ncccc2c1 ZINC000193032432 565726815 /nfs/dbraw/zinc/72/68/15/565726815.db2.gz FMQFGDKMRIXVKI-UHFFFAOYSA-N 0 0 377.809 3.275 20 5 GGBDRN CC[C@H]1C[C@@H](C)CN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000330946457 565731516 /nfs/dbraw/zinc/73/15/16/565731516.db2.gz LBCQEVCPTOLVDY-KOLCDFICSA-N 0 0 377.260 3.166 20 5 GGBDRN COC(=O)c1cnc(N(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C2CC2)s1 ZINC000175900833 565731868 /nfs/dbraw/zinc/73/18/68/565731868.db2.gz XBBGZGZNRSQORD-UHFFFAOYSA-N 0 0 381.797 3.301 20 5 GGBDRN O=[N+]([O-])c1cc(CSc2nnc(CO)n2C2CC2)ccc1Br ZINC000193093848 565732878 /nfs/dbraw/zinc/73/28/78/565732878.db2.gz OUHZFSODKIVQJB-UHFFFAOYSA-N 0 0 385.243 3.068 20 5 GGBDRN COC(CCCC(C)(C)CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])OC ZINC000281498385 565733359 /nfs/dbraw/zinc/73/33/59/565733359.db2.gz OKTBKDBVDUUPKO-UHFFFAOYSA-N 0 0 394.515 3.287 20 5 GGBDRN CC(C)(C)[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCO1 ZINC000330991695 565733312 /nfs/dbraw/zinc/73/33/12/565733312.db2.gz SMLVFHHARTXMCF-CQSZACIVSA-N 0 0 385.258 3.173 20 5 GGBDRN CC[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCCO1 ZINC000281575009 565737826 /nfs/dbraw/zinc/73/78/26/565737826.db2.gz LSJGAGWHVFJINM-SNVBAGLBSA-N 0 0 375.194 3.138 20 5 GGBDRN CS(=O)(=O)Nc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000193235708 565740193 /nfs/dbraw/zinc/74/01/93/565740193.db2.gz AMOKFXRBDQIALM-UHFFFAOYSA-N 0 0 387.776 3.011 20 5 GGBDRN CO[C@@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@@H](C)C1 ZINC000281646933 565740775 /nfs/dbraw/zinc/74/07/75/565740775.db2.gz BCPRFMASRRFLRS-WCBMZHEXSA-N 0 0 375.194 3.136 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@@H](C)CC ZINC000176021901 565741142 /nfs/dbraw/zinc/74/11/42/565741142.db2.gz OYLRSWACXVUFQY-ZANVPECISA-N 0 0 387.230 3.065 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000176013750 565741548 /nfs/dbraw/zinc/74/15/48/565741548.db2.gz JXVNVXBALRNKBU-QFIPXVFZSA-N 0 0 383.223 3.347 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(I)c2C)nc1 ZINC000193281398 565742012 /nfs/dbraw/zinc/74/20/12/565742012.db2.gz DFBCXRQHXWVQLL-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN CN(Cc1ccccc1Br)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000193315815 565744724 /nfs/dbraw/zinc/74/47/24/565744724.db2.gz ZXVXPAJKOFPEJH-AWEZNQCLSA-N 0 0 395.253 3.229 20 5 GGBDRN Cc1csc(NC(=O)CS[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000281741566 565744983 /nfs/dbraw/zinc/74/49/83/565744983.db2.gz BGGAKFLVCANPIH-JTQLQIEISA-N 0 0 380.451 3.059 20 5 GGBDRN CC[C@@H](C)N(C)C(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193337925 565746103 /nfs/dbraw/zinc/74/61/03/565746103.db2.gz IOAKNHIMUOVOKJ-MRVPVSSYSA-N 0 0 376.194 3.378 20 5 GGBDRN CCCn1c(CO)nnc1SCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000193328768 565746189 /nfs/dbraw/zinc/74/61/89/565746189.db2.gz VDJARHBETQFRNX-UHFFFAOYSA-N 0 0 387.259 3.143 20 5 GGBDRN Cc1csc(NC(=O)CS[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000281792835 565748050 /nfs/dbraw/zinc/74/80/50/565748050.db2.gz DZCVZSXHPQCITL-SNVBAGLBSA-N 0 0 380.451 3.059 20 5 GGBDRN Cc1csc(NC(=O)CS[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000281792834 565748130 /nfs/dbraw/zinc/74/81/30/565748130.db2.gz DZCVZSXHPQCITL-JTQLQIEISA-N 0 0 380.451 3.059 20 5 GGBDRN Cc1nc(NC(=O)Cc2ccccc2[N+](=O)[O-])ccc1I ZINC000176098456 565748921 /nfs/dbraw/zinc/74/89/21/565748921.db2.gz IKFLUDGZCJGIBB-UHFFFAOYSA-N 0 0 397.172 3.084 20 5 GGBDRN Nc1ccc2c(c1)CCC[C@H]2NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000193391421 565749807 /nfs/dbraw/zinc/74/98/07/565749807.db2.gz ITRMNWXZVISXGB-CQSZACIVSA-N 0 0 381.841 3.186 20 5 GGBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(I)c1C)C(C)C ZINC000193453044 565752894 /nfs/dbraw/zinc/75/28/94/565752894.db2.gz GCVJQDUZDSEDDF-UHFFFAOYSA-N 0 0 376.194 3.378 20 5 GGBDRN Cc1ccc(OCCNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000176143901 565753422 /nfs/dbraw/zinc/75/34/22/565753422.db2.gz NYHHXRVQIXZJIP-UHFFFAOYSA-N 0 0 393.237 3.403 20 5 GGBDRN CC(C)[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331323247 565754357 /nfs/dbraw/zinc/75/43/57/565754357.db2.gz DAMCQRDKGCTXKF-GFCCVEGCSA-N 0 0 377.260 3.166 20 5 GGBDRN CC[C@@H]1C[C@@H](C)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331331462 565755548 /nfs/dbraw/zinc/75/55/48/565755548.db2.gz HXXBKXNQYMOLQV-NXEZZACHSA-N 0 0 377.260 3.166 20 5 GGBDRN CC[C@@H]1C[C@H](C)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000331331465 565755696 /nfs/dbraw/zinc/75/56/96/565755696.db2.gz HXXBKXNQYMOLQV-VHSXEESVSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1ncsc1CN(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000176216333 565757858 /nfs/dbraw/zinc/75/78/58/565757858.db2.gz BOQOXKZQRYJIAR-UHFFFAOYSA-N 0 0 384.255 3.323 20 5 GGBDRN CCO[C@@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000193538865 565759186 /nfs/dbraw/zinc/75/91/86/565759186.db2.gz LDQCWWBQCMWGIM-HNNXBMFYSA-N 0 0 384.841 3.304 20 5 GGBDRN CCO[C@H](CNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000193538881 565759259 /nfs/dbraw/zinc/75/92/59/565759259.db2.gz LDQCWWBQCMWGIM-OAHLLOKOSA-N 0 0 384.841 3.304 20 5 GGBDRN O=[N+]([O-])c1ccn(CCN2CCO[C@H](c3cc(F)c(Cl)cc3Cl)C2)n1 ZINC000176235598 565759348 /nfs/dbraw/zinc/75/93/48/565759348.db2.gz AJGDBHJYPYKXIE-AWEZNQCLSA-N 0 0 389.214 3.311 20 5 GGBDRN COc1ccc(OC(=O)C2(c3cncc(Br)c3)CC2)cc1[N+](=O)[O-] ZINC000282061064 565762765 /nfs/dbraw/zinc/76/27/65/565762765.db2.gz BHXNOHQPHYLNMC-UHFFFAOYSA-N 0 0 393.193 3.398 20 5 GGBDRN CCS[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000176303019 565763406 /nfs/dbraw/zinc/76/34/06/565763406.db2.gz VPJYTVQQHIPYOP-ZYHUDNBSSA-N 0 0 385.873 3.367 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000282075156 565763977 /nfs/dbraw/zinc/76/39/77/565763977.db2.gz TXCXBEODXSRNSP-HAQNSBGRSA-N 0 0 383.235 3.469 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)COc1cccc(Br)c1 ZINC000193582016 565764194 /nfs/dbraw/zinc/76/41/94/565764194.db2.gz ZMAKVCVKJVUTQQ-UHFFFAOYSA-N 0 0 395.209 3.061 20 5 GGBDRN CN(C(=O)[C@@H]1Cc2cc(Br)ccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000193608912 565766289 /nfs/dbraw/zinc/76/62/89/565766289.db2.gz CEMKBZGPZTWYKE-HNNXBMFYSA-N 0 0 377.194 3.324 20 5 GGBDRN CCN(CC1CC1)C(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193635701 565766941 /nfs/dbraw/zinc/76/69/41/565766941.db2.gz BGJCPLMEVWQRII-UHFFFAOYSA-N 0 0 388.205 3.380 20 5 GGBDRN O=C(NC[C@@H]1CCCC(F)(F)C1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000282159104 565767171 /nfs/dbraw/zinc/76/71/71/565767171.db2.gz OSUCURRSBITNAR-SECBINFHSA-N 0 0 375.759 3.128 20 5 GGBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000176369692 565767365 /nfs/dbraw/zinc/76/73/65/565767365.db2.gz XIUOGRCVRYMNRU-UONOGXRCSA-N 0 0 385.873 3.367 20 5 GGBDRN C[C@H]1c2cccn2CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000176354279 565767386 /nfs/dbraw/zinc/76/73/86/565767386.db2.gz NKBXRGUCBJTSEQ-NSHDSACASA-N 0 0 378.226 3.305 20 5 GGBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000176369710 565767405 /nfs/dbraw/zinc/76/74/05/565767405.db2.gz XIUOGRCVRYMNRU-KBPBESRZSA-N 0 0 385.873 3.367 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000331570603 565768097 /nfs/dbraw/zinc/76/80/97/565768097.db2.gz KDOFERQLIBMVSX-LBPRGKRZSA-N 0 0 379.214 3.068 20 5 GGBDRN COCC1(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CCC1 ZINC000282260669 565771152 /nfs/dbraw/zinc/77/11/52/565771152.db2.gz PASZWSQGDPEWIE-UHFFFAOYSA-N 0 0 375.194 3.043 20 5 GGBDRN Cc1ncccc1NC(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193719249 565772039 /nfs/dbraw/zinc/77/20/39/565772039.db2.gz ORHOQAHSJRLIOE-UHFFFAOYSA-N 0 0 397.172 3.464 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[C@@H]1C ZINC000193735065 565772604 /nfs/dbraw/zinc/77/26/04/565772604.db2.gz ZNERGBAKRZWFBF-WPRPVWTQSA-N 0 0 388.205 3.378 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@H]1C=CCCC1 ZINC000193765627 565773639 /nfs/dbraw/zinc/77/36/39/565773639.db2.gz AKBXHUYQMMDHPZ-JTQLQIEISA-N 0 0 386.189 3.346 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCC[C@H]2c2cccc(Br)c2)c1[N+](=O)[O-] ZINC000331672918 565775747 /nfs/dbraw/zinc/77/57/47/565775747.db2.gz UZDAVJRHKLGCGH-LBPRGKRZSA-N 0 0 379.214 3.366 20 5 GGBDRN COc1cccc(C(=O)Nc2cccc(I)c2)c1[N+](=O)[O-] ZINC000193791726 565776174 /nfs/dbraw/zinc/77/61/74/565776174.db2.gz VDFXBOJOMBLDAT-UHFFFAOYSA-N 0 0 398.156 3.460 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(C(F)(F)F)ccc1Br ZINC000193816530 565776428 /nfs/dbraw/zinc/77/64/28/565776428.db2.gz OVOSTPQNDDHMSJ-UHFFFAOYSA-N 0 0 393.119 3.211 20 5 GGBDRN Cn1cc2c(n1)CCC[C@@H]2NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000282375307 565776904 /nfs/dbraw/zinc/77/69/04/565776904.db2.gz COZOAFZYZLJNRD-LBPRGKRZSA-N 0 0 380.857 3.268 20 5 GGBDRN O=[N+]([O-])c1cc(CN[C@@]2(CO)CCOc3ccccc32)ccc1Br ZINC000282458845 565780435 /nfs/dbraw/zinc/78/04/35/565780435.db2.gz SXNWXRQXZXLGEM-QGZVFWFLSA-N 0 0 393.237 3.117 20 5 GGBDRN CCN(CC(F)F)C(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000193870209 565780412 /nfs/dbraw/zinc/78/04/12/565780412.db2.gz GDHPUZAVVGHTFP-UHFFFAOYSA-N 0 0 398.147 3.235 20 5 GGBDRN CN(CCc1ccc(Br)cc1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176531014 565781787 /nfs/dbraw/zinc/78/17/87/565781787.db2.gz TYSBRWXHPPKMRW-UHFFFAOYSA-N 0 0 378.226 3.254 20 5 GGBDRN Cc1nc2c(s1)[C@H](N(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000331764570 565782290 /nfs/dbraw/zinc/78/22/90/565782290.db2.gz CMJFKLZFQXBVPZ-CQSZACIVSA-N 0 0 381.479 3.366 20 5 GGBDRN CN(Cc1cccc(Cl)c1Cl)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000193932676 565783995 /nfs/dbraw/zinc/78/39/95/565783995.db2.gz YKRLPYDXYRYXJM-UHFFFAOYSA-N 0 0 382.203 3.499 20 5 GGBDRN CON(CC1CCOCC1)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000282513030 565784244 /nfs/dbraw/zinc/78/42/44/565784244.db2.gz SHIJBYSFLDSKAA-UHFFFAOYSA-N 0 0 387.230 3.096 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000193940138 565784636 /nfs/dbraw/zinc/78/46/36/565784636.db2.gz QUDLPWKJGIRAEO-SNVBAGLBSA-N 0 0 392.209 3.173 20 5 GGBDRN COCC[C@@H](C)CNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000412465283 565790132 /nfs/dbraw/zinc/79/01/32/565790132.db2.gz QIMYJEYAZIBVMA-SNVBAGLBSA-N 0 0 380.388 3.495 20 5 GGBDRN Cn1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000331887291 565790420 /nfs/dbraw/zinc/79/04/20/565790420.db2.gz FYACUDHTCXOZDB-HNNXBMFYSA-N 0 0 393.241 3.458 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc([S@@](C)=O)cc1 ZINC000176631551 565790482 /nfs/dbraw/zinc/79/04/82/565790482.db2.gz HTJHIWALAASVMC-UOXLDJKESA-N 0 0 378.475 3.129 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000176662997 565791918 /nfs/dbraw/zinc/79/19/18/565791918.db2.gz ZUPPSXWYDSRRPO-CQSZACIVSA-N 0 0 381.841 3.477 20 5 GGBDRN CCc1[nH]nc(C(=O)N2CCCc3cc(Br)ccc32)c1[N+](=O)[O-] ZINC000331929997 565793831 /nfs/dbraw/zinc/79/38/31/565793831.db2.gz DSHGKMGJMNOJGZ-UHFFFAOYSA-N 0 0 379.214 3.236 20 5 GGBDRN CS(=O)(=O)[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000282722552 565793948 /nfs/dbraw/zinc/79/39/48/565793948.db2.gz LQGRWKUABOWVKF-ZDUSSCGKSA-N 0 0 384.841 3.127 20 5 GGBDRN Cc1nn(C)c(C(=O)N(C)[C@H](C)c2ccccc2Br)c1[N+](=O)[O-] ZINC000194095128 565794420 /nfs/dbraw/zinc/79/44/20/565794420.db2.gz WPURHOZOACJNHS-SNVBAGLBSA-N 0 0 381.230 3.232 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000331952296 565795273 /nfs/dbraw/zinc/79/52/73/565795273.db2.gz PJNKMDAFSXOHLG-HNNXBMFYSA-N 0 0 388.873 3.136 20 5 GGBDRN CCC[C@]1(COC)CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000194128824 565795757 /nfs/dbraw/zinc/79/57/57/565795757.db2.gz GBCYPLHHRAHVPH-OAHLLOKOSA-N 0 0 376.862 3.218 20 5 GGBDRN C[C@@H]1C[C@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CS1 ZINC000412572292 565796103 /nfs/dbraw/zinc/79/61/03/565796103.db2.gz LRIJZTGTDAUMQU-KOLCDFICSA-N 0 0 377.388 3.426 20 5 GGBDRN C[C@H]1C[C@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CS1 ZINC000412572296 565796525 /nfs/dbraw/zinc/79/65/25/565796525.db2.gz LRIJZTGTDAUMQU-ONGXEEELSA-N 0 0 377.388 3.426 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cc(F)c(F)cc1Cl ZINC000176725143 565798768 /nfs/dbraw/zinc/79/87/68/565798768.db2.gz LDKMOHZWAFDPNL-UHFFFAOYSA-N 0 0 378.740 3.336 20 5 GGBDRN COc1cccc(C(=O)NCc2ccc(Br)c(F)c2)c1[N+](=O)[O-] ZINC000194176744 565799823 /nfs/dbraw/zinc/79/98/23/565799823.db2.gz DSDDCEPICSUJGR-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1nc(C)c(-c2csc(NC(=O)c3c([N+](=O)[O-])c(C)nn3C)n2)s1 ZINC000194196302 565800144 /nfs/dbraw/zinc/80/01/44/565800144.db2.gz SSHKHYKGCBYJSG-UHFFFAOYSA-N 0 0 378.439 3.086 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2ncnn2C(C)(C)C)cc1[N+](=O)[O-] ZINC000282947474 565803583 /nfs/dbraw/zinc/80/35/83/565803583.db2.gz GXMWMRMSLCXPJZ-UHFFFAOYSA-N 0 0 382.218 3.265 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](c2ncc[nH]2)C1 ZINC000283271295 565813906 /nfs/dbraw/zinc/81/39/06/565813906.db2.gz ASMNLNRHDPHJTP-NSHDSACASA-N 0 0 393.241 3.409 20 5 GGBDRN CNC(=O)Nc1cccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000176930414 565814464 /nfs/dbraw/zinc/81/44/64/565814464.db2.gz JFUUIABQOLOKBD-UHFFFAOYSA-N 0 0 393.197 3.361 20 5 GGBDRN NC(=O)Nc1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000176930001 565814548 /nfs/dbraw/zinc/81/45/48/565814548.db2.gz SGTBDFWEWCDZOG-UHFFFAOYSA-N 0 0 379.170 3.100 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1C(=O)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000332227183 565817789 /nfs/dbraw/zinc/81/77/89/565817789.db2.gz KRTZGRUSAQHQBY-LLVKDONJSA-N 0 0 399.270 3.151 20 5 GGBDRN CN(Cc1nccn1C(F)F)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176961506 565818157 /nfs/dbraw/zinc/81/81/57/565818157.db2.gz DJBIUSXSWBQRNQ-UHFFFAOYSA-N 0 0 389.156 3.221 20 5 GGBDRN Cc1c(NC(=O)N2C[C@@H]3CC[C@H](O)C[C@H]3C2)cc(Br)cc1[N+](=O)[O-] ZINC000332224152 565818361 /nfs/dbraw/zinc/81/83/61/565818361.db2.gz YQQRMTHQTYCOPX-GVXVVHGQSA-N 0 0 398.257 3.290 20 5 GGBDRN CC(C)N(Cc1cccs1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000283449952 565819198 /nfs/dbraw/zinc/81/91/98/565819198.db2.gz WSMBEPFLYMCUEI-UHFFFAOYSA-N 0 0 382.463 3.111 20 5 GGBDRN Cc1ncsc1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1Cl ZINC000283479925 565820299 /nfs/dbraw/zinc/82/02/99/565820299.db2.gz HOZRWGCSIULLTH-UHFFFAOYSA-N 0 0 396.277 3.487 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000176987905 565820472 /nfs/dbraw/zinc/82/04/72/565820472.db2.gz KGFGWCHLZUCHNG-SNVBAGLBSA-N 0 0 384.219 3.283 20 5 GGBDRN C[C@H](O)C[C@@H]1CCCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000332254148 565822547 /nfs/dbraw/zinc/82/25/47/565822547.db2.gz CUILLOMVIHUEOT-JSGCOSHPSA-N 0 0 399.285 3.442 20 5 GGBDRN COC(=O)[C@@]1(C)CCCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000412932459 565822613 /nfs/dbraw/zinc/82/26/13/565822613.db2.gz LXBVNWLTTCNGAO-INIZCTEOSA-N 0 0 399.241 3.081 20 5 GGBDRN Cc1ccc(Br)nc1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283554958 565822887 /nfs/dbraw/zinc/82/28/87/565822887.db2.gz JHXGBLPYOVEEJL-UHFFFAOYSA-N 0 0 378.226 3.375 20 5 GGBDRN CC(C)[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccnc1 ZINC000177023032 565824145 /nfs/dbraw/zinc/82/41/45/565824145.db2.gz WHNZIJLFLBQSBK-AWEZNQCLSA-N 0 0 383.857 3.361 20 5 GGBDRN O=[N+]([O-])c1cc(CN(CCCO)Cc2ccccn2)ccc1Br ZINC000283641958 565824403 /nfs/dbraw/zinc/82/44/03/565824403.db2.gz ARSGPXSULZNFGV-UHFFFAOYSA-N 0 0 380.242 3.137 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@@H](c3ccsc3)C2)c([N+](=O)[O-])c1 ZINC000332285384 565825322 /nfs/dbraw/zinc/82/53/22/565825322.db2.gz IKSIFSGSERERBD-IUODEOHRSA-N 0 0 382.463 3.115 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCc3ccc(Br)cc32)c1 ZINC000194631892 565827717 /nfs/dbraw/zinc/82/77/17/565827717.db2.gz CSIZPIQGERHOCU-UHFFFAOYSA-N 0 0 383.223 3.109 20 5 GGBDRN COc1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)nc1Br ZINC000283719687 565828311 /nfs/dbraw/zinc/82/83/11/565828311.db2.gz XVUUVNSXCJMFGM-UHFFFAOYSA-N 0 0 394.225 3.076 20 5 GGBDRN CNc1ccc(S(=O)(=O)N(C)CC2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000412989485 565828266 /nfs/dbraw/zinc/82/82/66/565828266.db2.gz FWZGUKMEKLHHFO-UHFFFAOYSA-N 0 0 377.413 3.083 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)N(C)Cc1cc(Cl)cc(Cl)c1 ZINC000413004531 565829678 /nfs/dbraw/zinc/82/96/78/565829678.db2.gz TUMIQRJXNANOIL-UHFFFAOYSA-N 0 0 384.219 3.030 20 5 GGBDRN O=C(NCCCCNc1ccccn1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177110245 565829674 /nfs/dbraw/zinc/82/96/74/565829674.db2.gz JYXOFXMYLMXGLL-UHFFFAOYSA-N 0 0 393.241 3.374 20 5 GGBDRN CSc1ccc(C(=O)NCc2nc(-c3cccs3)no2)cc1[N+](=O)[O-] ZINC000194738646 565833264 /nfs/dbraw/zinc/83/32/64/565833264.db2.gz MWCHQCBGWGGECD-UHFFFAOYSA-N 0 0 376.419 3.358 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3cccc(Br)c3)C2)c(F)c1 ZINC000413112713 565835002 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CC[C@@H](Cc1cccc(Br)c1)C(=O)Nc1c([N+](=O)[O-])cnn1C ZINC000194834868 565841784 /nfs/dbraw/zinc/84/17/84/565841784.db2.gz HUDRUEDBGQHXSK-NSHDSACASA-N 0 0 381.230 3.298 20 5 GGBDRN COc1ccc(Br)cc1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000177282457 565842279 /nfs/dbraw/zinc/84/22/79/565842279.db2.gz VXDAROCRDWMGJJ-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN COCCN(C(C)=O)c1nc(COc2cc([N+](=O)[O-])ccc2Cl)cs1 ZINC000177334898 565844495 /nfs/dbraw/zinc/84/44/95/565844495.db2.gz BHCPAUPVGPYDKU-UHFFFAOYSA-N 0 0 385.829 3.283 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCc2c1cnn2C ZINC000284174179 565845199 /nfs/dbraw/zinc/84/51/99/565845199.db2.gz XLBAMWAWMCANHG-AWEZNQCLSA-N 0 0 393.241 3.207 20 5 GGBDRN C[C@H]1C[C@@H](C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CCO1 ZINC000284169818 565845368 /nfs/dbraw/zinc/84/53/68/565845368.db2.gz RLHWGEXRCJCUSZ-QWRGUYRKSA-N 0 0 383.242 3.057 20 5 GGBDRN Cc1nnc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)s1 ZINC000284248165 565846315 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CC(C)(C)C[C@H](O)CNc1ccc(I)cc1[N+](=O)[O-] ZINC000227356455 565922966 /nfs/dbraw/zinc/92/29/66/565922966.db2.gz OIFPAGPDGJUBHK-JTQLQIEISA-N 0 0 378.210 3.408 20 5 GGBDRN CCOCCN(c1ccc(Cl)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000414411640 565925272 /nfs/dbraw/zinc/92/52/72/565925272.db2.gz PUCFGTUIBMTVKP-UHFFFAOYSA-N 0 0 384.841 3.480 20 5 GGBDRN C[C@@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1cc(F)c(Cl)cc1Cl ZINC000178552264 565925751 /nfs/dbraw/zinc/92/57/51/565925751.db2.gz YHHYBFRXQNQQHI-MRVPVSSYSA-N 0 0 388.182 3.080 20 5 GGBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@H]1[C@@H]1CCCO1 ZINC000285780924 565927257 /nfs/dbraw/zinc/92/72/57/565927257.db2.gz LKTAZOQUWLJZNC-AAEUAGOBSA-N 0 0 387.205 3.280 20 5 GGBDRN CCC1(CO)CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CC1 ZINC000285780965 565927365 /nfs/dbraw/zinc/92/73/65/565927365.db2.gz WTTFLYCOBWIUKI-UHFFFAOYSA-N 0 0 385.258 3.290 20 5 GGBDRN CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000178602944 565928201 /nfs/dbraw/zinc/92/82/01/565928201.db2.gz FCSFOYSIHKNKMM-UHFFFAOYSA-N 0 0 384.219 3.112 20 5 GGBDRN Cc1c(CNC(=O)c2cccc(I)c2)cccc1[N+](=O)[O-] ZINC000231862820 565931962 /nfs/dbraw/zinc/93/19/62/565931962.db2.gz ZGKNXXDCSDUCKY-UHFFFAOYSA-N 0 0 396.184 3.438 20 5 GGBDRN Cc1c(CNS(=O)(=O)c2sccc2Br)cccc1[N+](=O)[O-] ZINC000231877076 565932512 /nfs/dbraw/zinc/93/25/12/565932512.db2.gz KFGIGBFAYGDZGE-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN Cc1cccc(S(=O)(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1Br ZINC000178867894 565942401 /nfs/dbraw/zinc/94/24/01/565942401.db2.gz OTDYEDOUSBCPLR-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN CCSCCCc1noc(CSc2ccc(C(N)=O)cc2[N+](=O)[O-])n1 ZINC000350986532 565943856 /nfs/dbraw/zinc/94/38/56/565943856.db2.gz SMJLFJPBYMNTLL-UHFFFAOYSA-N 0 0 382.467 3.055 20 5 GGBDRN C[C@]12CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000286157303 565945073 /nfs/dbraw/zinc/94/50/73/565945073.db2.gz BLWOWOSDSSANMC-OLZOCXBDSA-N 0 0 379.265 3.018 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC[C@@H](C(F)(F)F)[C@H](CO)C1 ZINC000286211864 565947956 /nfs/dbraw/zinc/94/79/56/565947956.db2.gz CKJZXNDZTDCRQW-WCBMZHEXSA-N 0 0 383.164 3.354 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC[C@H](C(F)(F)F)[C@H](CO)C1 ZINC000286211867 565948057 /nfs/dbraw/zinc/94/80/57/565948057.db2.gz CKJZXNDZTDCRQW-WPRPVWTQSA-N 0 0 383.164 3.354 20 5 GGBDRN Cc1nc(C(C)(C)NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])sc1C ZINC000178952385 565948996 /nfs/dbraw/zinc/94/89/96/565948996.db2.gz ZNFKFVORNDAGDM-UHFFFAOYSA-N 0 0 383.495 3.065 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC[C@](O)(C(F)(F)F)CC1 ZINC000286234685 565949648 /nfs/dbraw/zinc/94/96/48/565949648.db2.gz CYAZJETVJXEMLH-LLVKDONJSA-N 0 0 384.152 3.036 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1OC[C@H](O)COc1cccc(Br)c1 ZINC000179065924 565955202 /nfs/dbraw/zinc/95/52/02/565955202.db2.gz NPHKIJFEYXIJBD-GFCCVEGCSA-N 0 0 386.173 3.315 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC[C@H](O)COc1cccc(Br)c1 ZINC000179056037 565955844 /nfs/dbraw/zinc/95/58/44/565955844.db2.gz NMZVAJFPANXKJH-CYBMUJFWSA-N 0 0 398.209 3.185 20 5 GGBDRN Cc1cnccc1CC(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000286375482 565956173 /nfs/dbraw/zinc/95/61/73/565956173.db2.gz UIJUAJYPZMHEER-UHFFFAOYSA-N 0 0 390.237 3.188 20 5 GGBDRN CS(=O)(=O)CCNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000237309241 565956975 /nfs/dbraw/zinc/95/69/75/565956975.db2.gz SXQWOKVXLGYEGH-UHFFFAOYSA-N 0 0 384.841 3.175 20 5 GGBDRN CN(C)c1cc(F)c(C(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000286410309 565958346 /nfs/dbraw/zinc/95/83/46/565958346.db2.gz VYWKYQNBUJIXIX-DZGCQCFKSA-N 0 0 390.242 3.456 20 5 GGBDRN Cc1cc(Cl)c(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000179117030 565959064 /nfs/dbraw/zinc/95/90/64/565959064.db2.gz RLPNAFYWYUMTQY-UHFFFAOYSA-N 0 0 382.203 3.465 20 5 GGBDRN Cc1noc([C@H]2CCCN2C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000286496005 565963153 /nfs/dbraw/zinc/96/31/53/565963153.db2.gz IIPPAWQASANCSE-LLVKDONJSA-N 0 0 382.829 3.395 20 5 GGBDRN CO[C@@H]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)C1 ZINC000179167212 565963661 /nfs/dbraw/zinc/96/36/61/565963661.db2.gz DYFMKWFKFYWMFO-SECBINFHSA-N 0 0 377.622 3.262 20 5 GGBDRN NCC(F)(F)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000414921677 565965299 /nfs/dbraw/zinc/96/52/99/565965299.db2.gz BGQUMZPJNYQSMH-UHFFFAOYSA-N 0 0 390.184 3.301 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)c1ccc(C(F)(F)F)cn1 ZINC000286537049 565966093 /nfs/dbraw/zinc/96/60/93/565966093.db2.gz KLSDORPQOWDYRZ-UHFFFAOYSA-N 0 0 393.119 3.159 20 5 GGBDRN Cc1noc([C@H]2CCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)n1 ZINC000286544376 565967313 /nfs/dbraw/zinc/96/73/13/565967313.db2.gz KTVVIEZBIPSJDD-SNVBAGLBSA-N 0 0 399.176 3.165 20 5 GGBDRN C[C@@H]1CCCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)[C@H]1C ZINC000179248937 565968288 /nfs/dbraw/zinc/96/82/88/565968288.db2.gz XPMMXGJRUZKBID-ZJUUUORDSA-N 0 0 388.205 3.460 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])c2cccnc2O1 ZINC000179302384 565971946 /nfs/dbraw/zinc/97/19/46/565971946.db2.gz WGRIDVLZBKYFHI-SECBINFHSA-N 0 0 378.182 3.180 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(CC(F)(F)F)CC1 ZINC000179321168 565972776 /nfs/dbraw/zinc/97/27/76/565972776.db2.gz FSZLECODOOQJDT-UHFFFAOYSA-N 0 0 377.388 3.027 20 5 GGBDRN Cc1noc([C@H]2CCCN2C(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000286675025 565973408 /nfs/dbraw/zinc/97/34/08/565973408.db2.gz SCGYDBQLGJCFDQ-GFCCVEGCSA-N 0 0 381.186 3.026 20 5 GGBDRN O=C(NCCc1csc(-c2ccc(Cl)cc2)n1)c1[nH]ncc1[N+](=O)[O-] ZINC000179339119 565973464 /nfs/dbraw/zinc/97/34/64/565973464.db2.gz RPOLNYLUHGUVDN-UHFFFAOYSA-N 0 0 377.813 3.067 20 5 GGBDRN Cc1noc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000286684114 565975293 /nfs/dbraw/zinc/97/52/93/565975293.db2.gz SLNNLRKFSBNVNP-LBPRGKRZSA-N 0 0 381.186 3.026 20 5 GGBDRN CCOC1CC2(C1)CCN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000286799943 565980169 /nfs/dbraw/zinc/98/01/69/565980169.db2.gz WLHMHZGGVVHGME-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN Cc1cn2c(n1)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)CCC2 ZINC000362442055 565981053 /nfs/dbraw/zinc/98/10/53/565981053.db2.gz MYPNXIKDQGMGLZ-NSHDSACASA-N 0 0 393.241 3.170 20 5 GGBDRN CC[C@@]1(CO)CCCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C1 ZINC000286847038 565982706 /nfs/dbraw/zinc/98/27/06/565982706.db2.gz TXJPGJLRHQYDJB-MRXNPFEDSA-N 0 0 385.258 3.290 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1COc2ccc(Br)cc21 ZINC000179493441 565984045 /nfs/dbraw/zinc/98/40/45/565984045.db2.gz RGBOOFWXWAXJDR-CQSZACIVSA-N 0 0 391.221 3.492 20 5 GGBDRN O=C([C@H]1COc2ccc(Br)cc21)N1CCc2c1cccc2[N+](=O)[O-] ZINC000179511744 565985709 /nfs/dbraw/zinc/98/57/09/565985709.db2.gz XSXBEZAYIBIKML-ZDUSSCGKSA-N 0 0 389.205 3.423 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H](c2ncon2)C(C)C)cc1[N+](=O)[O-] ZINC000286932781 565987023 /nfs/dbraw/zinc/98/70/23/565987023.db2.gz DKAYDDDKFXYRQN-GFCCVEGCSA-N 0 0 383.202 3.176 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCCCCOc2ccc(F)cc2)s1 ZINC000179565041 565988885 /nfs/dbraw/zinc/98/88/85/565988885.db2.gz DQZMLJZYCKCXDT-UHFFFAOYSA-N 0 0 388.442 3.470 20 5 GGBDRN CC(C)CCOC1CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000179570562 565989635 /nfs/dbraw/zinc/98/96/35/565989635.db2.gz YJWQMBPLMHHKLZ-UHFFFAOYSA-N 0 0 376.500 3.091 20 5 GGBDRN CN(CCCCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000179574206 565990472 /nfs/dbraw/zinc/99/04/72/565990472.db2.gz MMFXGEAZNRWOAQ-UHFFFAOYSA-N 0 0 383.495 3.388 20 5 GGBDRN CN(CCCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1F ZINC000179573554 565990476 /nfs/dbraw/zinc/99/04/76/565990476.db2.gz XONHZTSHMPGURL-UHFFFAOYSA-N 0 0 387.458 3.137 20 5 GGBDRN Cc1ccccc1OCCCN(C)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000179573323 565990525 /nfs/dbraw/zinc/99/05/25/565990525.db2.gz CZZOBDBHPPNRSG-UHFFFAOYSA-N 0 0 384.479 3.274 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179598023 565991230 /nfs/dbraw/zinc/99/12/30/565991230.db2.gz QJSOIWSISXHCCX-JTQLQIEISA-N 0 0 393.245 3.132 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H](Cc3ccc(F)cc3)C2)s1 ZINC000179595318 565991278 /nfs/dbraw/zinc/99/12/78/565991278.db2.gz AVWUOHSNKIONCP-LBPRGKRZSA-N 0 0 384.454 3.268 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2cccc(OCC(F)F)c2)s1 ZINC000179581763 565991607 /nfs/dbraw/zinc/99/16/07/565991607.db2.gz MLBHSXJTAOQEEK-UHFFFAOYSA-N 0 0 392.405 3.316 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H](c2ccccc2)[C@H]2CCCO2)s1 ZINC000179581559 565991739 /nfs/dbraw/zinc/99/17/39/565991739.db2.gz QOKWLVQTMATSSA-HIFRSBDPSA-N 0 0 382.463 3.392 20 5 GGBDRN COc1ccc(C[C@@H](C)CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000179615307 565992692 /nfs/dbraw/zinc/99/26/92/565992692.db2.gz XZKAEXBGMOZIGW-LLVKDONJSA-N 0 0 384.479 3.359 20 5 GGBDRN CC[C@@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])Oc1ccccc1F ZINC000179603309 565992928 /nfs/dbraw/zinc/99/29/28/565992928.db2.gz JXTTULDHWLWGHU-JTQLQIEISA-N 0 0 388.442 3.468 20 5 GGBDRN CC(C)[C@@H](NC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)c1nncn1C ZINC000287090636 565996616 /nfs/dbraw/zinc/99/66/16/565996616.db2.gz MREWEOWMQMVNEM-GFCCVEGCSA-N 0 0 397.233 3.005 20 5 GGBDRN CC(C)[C@H](NC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)c1nncn1C ZINC000287090640 565996725 /nfs/dbraw/zinc/99/67/25/565996725.db2.gz MREWEOWMQMVNEM-LBPRGKRZSA-N 0 0 397.233 3.005 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[C@H](C(F)(F)F)[C@H](CO)C1 ZINC000287103418 565998030 /nfs/dbraw/zinc/99/80/30/565998030.db2.gz WWNXSEMRYIDQRQ-WPRPVWTQSA-N 0 0 381.738 3.273 20 5 GGBDRN C[C@@H]1CCCN(C(=O)c2cc(I)cc([N+](=O)[O-])c2)CC1 ZINC000179676360 565999194 /nfs/dbraw/zinc/99/91/94/565999194.db2.gz IHYYZPXGSPNAJM-SNVBAGLBSA-N 0 0 388.205 3.462 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ncon1)C(C)C ZINC000287137588 566000210 /nfs/dbraw/zinc/00/02/10/566000210.db2.gz QMXWILRJAOPRNL-GFCCVEGCSA-N 0 0 383.202 3.176 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCS[C@H]4COCC[C@H]43)cs2)c1 ZINC000245754470 566004715 /nfs/dbraw/zinc/00/47/15/566004715.db2.gz HLSUBQDAEMKWJT-CVEARBPZSA-N 0 0 377.491 3.425 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC(c3cn[nH]c3)CC2)cc1[N+](=O)[O-] ZINC000363502149 566008441 /nfs/dbraw/zinc/00/84/41/566008441.db2.gz HYMPVPLGMKEFIO-UHFFFAOYSA-N 0 0 393.241 3.409 20 5 GGBDRN C[C@H]1CCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000245871252 566009096 /nfs/dbraw/zinc/00/90/96/566009096.db2.gz GUZAMGZLFSOSCL-VHSXEESVSA-N 0 0 377.260 3.024 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)c1ncon1 ZINC000287285957 566009330 /nfs/dbraw/zinc/00/93/30/566009330.db2.gz ZEACSQRGRYWBHJ-LLVKDONJSA-N 0 0 387.165 3.007 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000246091713 566016111 /nfs/dbraw/zinc/01/61/11/566016111.db2.gz MAWDDWYPCLKJOM-NILFDRSVSA-N 0 0 395.253 3.353 20 5 GGBDRN COc1ccc([C@@H](C)OC(=O)Cn2cc([N+](=O)[O-])nc2C)c(Br)c1 ZINC000179947196 566020519 /nfs/dbraw/zinc/02/05/19/566020519.db2.gz TXRZSMYQNPKZLA-SECBINFHSA-N 0 0 398.213 3.175 20 5 GGBDRN CN(Cc1ccccc1Br)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000179937234 566020625 /nfs/dbraw/zinc/02/06/25/566020625.db2.gz YTJKBKFDALVMOL-UHFFFAOYSA-N 0 0 393.193 3.358 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@H]1CCSc2ccccc21 ZINC000179937758 566020863 /nfs/dbraw/zinc/02/08/63/566020863.db2.gz RXAQZLFPPCIBIK-HNNXBMFYSA-N 0 0 378.475 3.294 20 5 GGBDRN C[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c2cc(Cl)ccc2S1 ZINC000246377477 566026852 /nfs/dbraw/zinc/02/68/52/566026852.db2.gz RHLSKTAOFUPVFY-BXUZGUMPSA-N 0 0 382.873 3.197 20 5 GGBDRN C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000246400846 566028164 /nfs/dbraw/zinc/02/81/64/566028164.db2.gz ALDYSCUOIGBHKX-RYUDHWBXSA-N 0 0 384.274 3.208 20 5 GGBDRN COCCCN(C(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000416036077 566028849 /nfs/dbraw/zinc/02/88/49/566028849.db2.gz SCYFEMVPRKKKNI-UHFFFAOYSA-N 0 0 394.225 3.436 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC12CC2 ZINC000416053941 566031225 /nfs/dbraw/zinc/03/12/25/566031225.db2.gz VYZYUPHFFQNPJA-VIFPVBQESA-N 0 0 386.189 3.038 20 5 GGBDRN COCCn1cc2c(n1)[C@@H](Nc1ncc(Br)cc1[N+](=O)[O-])CCC2 ZINC000364070471 566033120 /nfs/dbraw/zinc/03/31/20/566033120.db2.gz JGOJMWMXPJJHNC-LBPRGKRZSA-N 0 0 396.245 3.085 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(CCC(F)(F)F)CC2CC2)cc1 ZINC000180114469 566033824 /nfs/dbraw/zinc/03/38/24/566033824.db2.gz BBOCHEFZHIJQKY-UHFFFAOYSA-N 0 0 380.388 3.132 20 5 GGBDRN CSc1cc(C)ccc1CNS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000180130120 566035205 /nfs/dbraw/zinc/03/52/05/566035205.db2.gz GYVOKRLJYHRCTE-UHFFFAOYSA-N 0 0 380.491 3.287 20 5 GGBDRN C[C@@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)CCO[C@@H]1C1CC1 ZINC000364122374 566035541 /nfs/dbraw/zinc/03/55/41/566035541.db2.gz VTYOPGDBHJHPFE-ZBFHGGJFSA-N 0 0 383.242 3.292 20 5 GGBDRN O=C(NCCc1ccc(Br)s1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180139484 566036430 /nfs/dbraw/zinc/03/64/30/566036430.db2.gz SVJOGZKWGFZGIJ-UHFFFAOYSA-N 0 0 399.222 3.120 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 ZINC000246685115 566037173 /nfs/dbraw/zinc/03/71/73/566037173.db2.gz HYDJNYZSBFIYBK-CZUORRHYSA-N 0 0 385.251 3.296 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2nc(C)c(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000180211742 566044936 /nfs/dbraw/zinc/04/49/36/566044936.db2.gz VKCXLTNEDIYWCI-UHFFFAOYSA-N 0 0 392.220 3.414 20 5 GGBDRN Cc1nc(-c2cc3c(s2)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C3)cs1 ZINC000180259661 566049523 /nfs/dbraw/zinc/04/95/23/566049523.db2.gz IPYQCTMCEAXOPQ-UHFFFAOYSA-N 0 0 375.435 3.010 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000287973526 566050156 /nfs/dbraw/zinc/05/01/56/566050156.db2.gz UMONZQVNZIBHFS-AWEZNQCLSA-N 0 0 380.750 3.097 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cncc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000180284409 566051166 /nfs/dbraw/zinc/05/11/66/566051166.db2.gz LHNDVEJJULBYOS-UHFFFAOYSA-N 0 0 378.193 3.106 20 5 GGBDRN O=C(NCc1ccc(Br)s1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180306950 566053462 /nfs/dbraw/zinc/05/34/62/566053462.db2.gz MMUOIJSZEABROB-UHFFFAOYSA-N 0 0 385.195 3.078 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N[C@H](CO)CC1CCCCC1 ZINC000416334747 566054653 /nfs/dbraw/zinc/05/46/53/566054653.db2.gz SNLHRZMSJDAPFV-AWEZNQCLSA-N 0 0 399.285 3.347 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2Br)cn1 ZINC000180344924 566055787 /nfs/dbraw/zinc/05/57/87/566055787.db2.gz VKGAFBHTZHWMLO-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN COc1ccc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])nc1Br ZINC000288099265 566056743 /nfs/dbraw/zinc/05/67/43/566056743.db2.gz AQWAYPXQIYACFG-UHFFFAOYSA-N 0 0 394.225 3.076 20 5 GGBDRN C[C@H](NS(=O)(=O)c1c[nH]c2nccc(Cl)c21)c1cccc([N+](=O)[O-])c1 ZINC000180350259 566056814 /nfs/dbraw/zinc/05/68/14/566056814.db2.gz KQCYIKLEXVUURS-VIFPVBQESA-N 0 0 380.813 3.164 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1c[nH]c2nccc(Cl)c21)c1cccc([N+](=O)[O-])c1 ZINC000180350278 566057154 /nfs/dbraw/zinc/05/71/54/566057154.db2.gz KQCYIKLEXVUURS-SECBINFHSA-N 0 0 380.813 3.164 20 5 GGBDRN Cc1c([C@@H](C)Nc2ccc(I)cc2[N+](=O)[O-])cnn1C ZINC000180397932 566060044 /nfs/dbraw/zinc/06/00/44/566060044.db2.gz SOBOXFTYRCNXBX-MRVPVSSYSA-N 0 0 386.193 3.414 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC[C@@H](Oc3ccccc3)C2)s1 ZINC000364659309 566062466 /nfs/dbraw/zinc/06/24/66/566062466.db2.gz PCUZLJUHHXZTHI-CYBMUJFWSA-N 0 0 382.463 3.108 20 5 GGBDRN C[C@H]1SCCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000416400615 566062418 /nfs/dbraw/zinc/06/24/18/566062418.db2.gz KKJAUOUYYNYDSG-DTWKUNHWSA-N 0 0 384.401 3.128 20 5 GGBDRN CC(C)(NS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000416397980 566062462 /nfs/dbraw/zinc/06/24/62/566062462.db2.gz LLBSDNITPNYCQP-UHFFFAOYSA-N 0 0 395.384 3.284 20 5 GGBDRN C[C@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000288228704 566063180 /nfs/dbraw/zinc/06/31/80/566063180.db2.gz FDGRPQCPPONJAI-WCQYABFASA-N 0 0 382.258 3.056 20 5 GGBDRN CC[C@@H]1CN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000416410591 566064006 /nfs/dbraw/zinc/06/40/06/566064006.db2.gz GGCGRSUTQIYTHN-SNVBAGLBSA-N 0 0 384.401 3.130 20 5 GGBDRN CCc1cnc(CNS(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000416411230 566065150 /nfs/dbraw/zinc/06/51/50/566065150.db2.gz IYYVYOKATMLEDR-UHFFFAOYSA-N 0 0 395.384 3.111 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1Oc1cc(C=O)c(Br)cc1OC ZINC000288259445 566065359 /nfs/dbraw/zinc/06/53/59/566065359.db2.gz YIKQUYTWWFZRID-UHFFFAOYSA-N 0 0 384.186 3.496 20 5 GGBDRN CSC[C@H]1CCCN1S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416430952 566066853 /nfs/dbraw/zinc/06/68/53/566066853.db2.gz FWEKPALGITUBAA-SNVBAGLBSA-N 0 0 384.401 3.130 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000416431175 566067002 /nfs/dbraw/zinc/06/70/02/566067002.db2.gz AGQYETJBNCIVAX-UHFFFAOYSA-N 0 0 376.240 3.277 20 5 GGBDRN CCC[C@H]1SCCN1S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416448022 566069148 /nfs/dbraw/zinc/06/91/48/566069148.db2.gz FOPFUIFYBDFZSW-GFCCVEGCSA-N 0 0 384.401 3.477 20 5 GGBDRN C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000288355378 566069470 /nfs/dbraw/zinc/06/94/70/566069470.db2.gz KKYPVHYRPGHWTL-YPMHNXCESA-N 0 0 382.258 3.056 20 5 GGBDRN CC[C@@H](CSC)N(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416451344 566069533 /nfs/dbraw/zinc/06/95/33/566069533.db2.gz NWFPZHUKBZBWSJ-JTQLQIEISA-N 0 0 386.417 3.376 20 5 GGBDRN CC(C)OCCCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416461574 566070442 /nfs/dbraw/zinc/07/04/42/566070442.db2.gz ZWDSABXNIBCTPY-UHFFFAOYSA-N 0 0 384.376 3.097 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(F)(F)F ZINC000416465885 566072048 /nfs/dbraw/zinc/07/20/48/566072048.db2.gz NJTGIAXEGIYFBT-ZCFIWIBFSA-N 0 0 380.266 3.090 20 5 GGBDRN C[C@H]1CCSCCN1S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416467384 566072281 /nfs/dbraw/zinc/07/22/81/566072281.db2.gz BNYJGOCDFPBBGT-VIFPVBQESA-N 0 0 384.401 3.130 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCCn2cc(Br)cn2)c1 ZINC000288417371 566072614 /nfs/dbraw/zinc/07/26/14/566072614.db2.gz PZDLGRVHLSMEGY-UHFFFAOYSA-N 0 0 399.270 3.096 20 5 GGBDRN O=C(Cn1cc(Cl)cn1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000288440141 566074595 /nfs/dbraw/zinc/07/45/95/566074595.db2.gz DZFVEYWYGOZWKF-UHFFFAOYSA-N 0 0 376.722 3.036 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1CCC[C@@H](C2CC2)C1 ZINC000416490428 566074924 /nfs/dbraw/zinc/07/49/24/566074924.db2.gz VSFXNDHRKYLPJX-LLVKDONJSA-N 0 0 378.372 3.424 20 5 GGBDRN CSC[C@H]1CCCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000416487479 566075443 /nfs/dbraw/zinc/07/54/43/566075443.db2.gz JNVBLCLTYSHYJC-JTQLQIEISA-N 0 0 398.428 3.377 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)N1CC[C@@H](CC2CC2)C1 ZINC000416486165 566075572 /nfs/dbraw/zinc/07/55/72/566075572.db2.gz DHYSAVGHXASRFL-NSHDSACASA-N 0 0 378.372 3.424 20 5 GGBDRN COc1cc(CN(C)Cc2cc(Br)cn2C)c([N+](=O)[O-])cc1OC ZINC000180614522 566076777 /nfs/dbraw/zinc/07/67/77/566076777.db2.gz VCIXZNBGCVHUOY-UHFFFAOYSA-N 0 0 398.257 3.345 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H]2CCO[C@@H](c3cccs3)C2)ccc1[N+](=O)[O-] ZINC000416510546 566079256 /nfs/dbraw/zinc/07/92/56/566079256.db2.gz UVWGZAQEUKVVPH-IUODEOHRSA-N 0 0 382.463 3.163 20 5 GGBDRN O=C(NCc1noc2c1CCCC2)c1cc([N+](=O)[O-])ccc1Br ZINC000288553683 566079279 /nfs/dbraw/zinc/07/92/79/566079279.db2.gz YAGHZHDAYVEUKD-UHFFFAOYSA-N 0 0 380.198 3.154 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H]2CCO[C@@H](c3cccs3)C2)cc1[N+](=O)[O-] ZINC000416509203 566079363 /nfs/dbraw/zinc/07/93/63/566079363.db2.gz QPHDDHCMKNFKLS-IUODEOHRSA-N 0 0 382.463 3.163 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000416529975 566081011 /nfs/dbraw/zinc/08/10/11/566081011.db2.gz CVXUTSSIQDREPE-NSHDSACASA-N 0 0 381.479 3.196 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](C)c2nc3c(s2)CCC3)c(C)cc1[N+](=O)[O-] ZINC000416525770 566081149 /nfs/dbraw/zinc/08/11/49/566081149.db2.gz JHMQVMNJIVYMEV-LLVKDONJSA-N 0 0 381.479 3.196 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000416529973 566081352 /nfs/dbraw/zinc/08/13/52/566081352.db2.gz CVXUTSSIQDREPE-LLVKDONJSA-N 0 0 381.479 3.196 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1S(=O)(=O)NC[C@H]1CCC(F)(F)C1 ZINC000416524996 566081388 /nfs/dbraw/zinc/08/13/88/566081388.db2.gz NAMUXOSXFVBETH-QMMMGPOBSA-N 0 0 388.314 3.327 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000416535317 566082475 /nfs/dbraw/zinc/08/24/75/566082475.db2.gz ISUNONBWOYKXFY-MRVPVSSYSA-N 0 0 387.870 3.233 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)c2nc3c(s2)CCC3)c1C ZINC000416536279 566083414 /nfs/dbraw/zinc/08/34/14/566083414.db2.gz LMQQXOLORJDQPK-NSHDSACASA-N 0 0 381.479 3.196 20 5 GGBDRN C[C@@H](CCCc1cccnc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000416536476 566083627 /nfs/dbraw/zinc/08/36/27/566083627.db2.gz LZCWNMGFQNLOMU-LBPRGKRZSA-N 0 0 383.857 3.333 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc2[nH]c(-c3ccc([N+](=O)[O-])s3)nc2c1 ZINC000180730064 566084267 /nfs/dbraw/zinc/08/42/67/566084267.db2.gz DURONLUJCCSJDI-UHFFFAOYSA-N 0 0 380.451 3.230 20 5 GGBDRN Cc1noc([C@@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])ccc2Br)n1 ZINC000288668372 566085042 /nfs/dbraw/zinc/08/50/42/566085042.db2.gz BDLTXSRPRHNDOL-ZDUSSCGKSA-N 0 0 395.213 3.416 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CCn1cc(Br)cn1 ZINC000288659921 566085326 /nfs/dbraw/zinc/08/53/26/566085326.db2.gz AJVQYBDVQLEJDJ-UHFFFAOYSA-N 0 0 382.218 3.026 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCc2c1cccc2Br ZINC000180747356 566086596 /nfs/dbraw/zinc/08/65/96/566086596.db2.gz NNFGBYDPUDNKPJ-CYBMUJFWSA-N 0 0 376.210 3.357 20 5 GGBDRN Cc1ccc(OCCC(=O)N(C)c2ccc([N+](=O)[O-])nc2)c(Br)c1 ZINC000288685397 566086644 /nfs/dbraw/zinc/08/66/44/566086644.db2.gz CYBKNXPUOCMLCI-UHFFFAOYSA-N 0 0 394.225 3.493 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCCn1cc(Br)cn1 ZINC000288698407 566086806 /nfs/dbraw/zinc/08/68/06/566086806.db2.gz CQWGZUDTUZPHCW-UHFFFAOYSA-N 0 0 382.218 3.074 20 5 GGBDRN CN(C1CC(C)(C)C1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000416563196 566088059 /nfs/dbraw/zinc/08/80/59/566088059.db2.gz XJVRTGPXZDPYQI-UHFFFAOYSA-N 0 0 377.260 3.166 20 5 GGBDRN CN(C(=O)c1sc(Br)cc1[N+](=O)[O-])[C@H]1CCCc2c1cnn2C ZINC000365199646 566088939 /nfs/dbraw/zinc/08/89/39/566088939.db2.gz FTEPGZZTHYWQQS-VIFPVBQESA-N 0 0 399.270 3.302 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CC(F)(F)F)c1ccncc1 ZINC000180795165 566089576 /nfs/dbraw/zinc/08/95/76/566089576.db2.gz YAXHXKPZKRPQGT-UHFFFAOYSA-N 0 0 375.328 3.056 20 5 GGBDRN C[C@H](c1cccnc1)N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000180809747 566090159 /nfs/dbraw/zinc/09/01/59/566090159.db2.gz MKRUCFGUGCCUCT-LLVKDONJSA-N 0 0 393.241 3.384 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(c2ccccc2Br)CC1 ZINC000180807706 566090357 /nfs/dbraw/zinc/09/03/57/566090357.db2.gz AECMIGCCYJVSDA-UHFFFAOYSA-N 0 0 390.237 3.401 20 5 GGBDRN CC(C)(C)c1ccncc1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000416579452 566090360 /nfs/dbraw/zinc/09/03/60/566090360.db2.gz CQRZPDWBFDMDLK-UHFFFAOYSA-N 0 0 383.857 3.419 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)COc2cc(Br)ccc2F)c1 ZINC000180798747 566090867 /nfs/dbraw/zinc/09/08/67/566090867.db2.gz VJXHDIXUYIQRGG-LBPRGKRZSA-N 0 0 386.173 3.315 20 5 GGBDRN Cc1nn(C)cc1[C@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000365249589 566091409 /nfs/dbraw/zinc/09/14/09/566091409.db2.gz QZVNNGLMGJXRSG-CYBMUJFWSA-N 0 0 393.241 3.377 20 5 GGBDRN O=C(Nc1nnc(C(F)(F)F)s1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180859719 566093968 /nfs/dbraw/zinc/09/39/68/566093968.db2.gz MMMWNVRWZJOLOK-UHFFFAOYSA-N 0 0 384.242 3.319 20 5 GGBDRN C[C@@H](Cc1ccccc1Br)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180863533 566094034 /nfs/dbraw/zinc/09/40/34/566094034.db2.gz PHRJJYSNFRHNTO-JTQLQIEISA-N 0 0 378.226 3.301 20 5 GGBDRN C[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])Oc1ccccc1Br ZINC000180844638 566094414 /nfs/dbraw/zinc/09/44/14/566094414.db2.gz SYUQZHWTULBPPK-SNVBAGLBSA-N 0 0 394.225 3.137 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC[C@H](Oc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000416612177 566096048 /nfs/dbraw/zinc/09/60/48/566096048.db2.gz PZTPPNYBALXKQK-AWEZNQCLSA-N 0 0 382.463 3.197 20 5 GGBDRN Cc1noc([C@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)n1 ZINC000288961359 566099214 /nfs/dbraw/zinc/09/92/14/566099214.db2.gz ZFEMPOKEWRHRMZ-GFCCVEGCSA-N 0 0 395.213 3.416 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC(OCC2CC2)CC1 ZINC000365428433 566101500 /nfs/dbraw/zinc/10/15/00/566101500.db2.gz NHMZZMYPTPGHQB-UHFFFAOYSA-N 0 0 383.242 3.389 20 5 GGBDRN C[C@@H]1[C@@H](C)[C@H](C)CN1S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000416658926 566102121 /nfs/dbraw/zinc/10/21/21/566102121.db2.gz KSMFSGSYLGHGQC-KXUCPTDWSA-N 0 0 377.260 3.022 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)C1CCC(C(F)(F)F)CC1 ZINC000289093842 566105288 /nfs/dbraw/zinc/10/52/88/566105288.db2.gz IOMVAGMADXAAET-UHFFFAOYSA-N 0 0 380.388 3.478 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000289121377 566108248 /nfs/dbraw/zinc/10/82/48/566108248.db2.gz MMCOGZGYAYTOOD-UHFFFAOYSA-N 0 0 376.722 3.435 20 5 GGBDRN COCc1nc(Cc2noc(Cc3ccc([N+](=O)[O-])cc3Cl)n2)cs1 ZINC000289152660 566109211 /nfs/dbraw/zinc/10/92/11/566109211.db2.gz QJYDKQOIPCZGIN-UHFFFAOYSA-N 0 0 380.813 3.416 20 5 GGBDRN Cc1cccc(CCCNC(=O)c2sc(Br)cc2[N+](=O)[O-])n1 ZINC000289166848 566109590 /nfs/dbraw/zinc/10/95/90/566109590.db2.gz YXTTYEBUVNPAMW-UHFFFAOYSA-N 0 0 384.255 3.485 20 5 GGBDRN CN(Cc1c(F)cccc1[N+](=O)[O-])[C@H](C(N)=O)c1cccc(Br)c1 ZINC000181071472 566110805 /nfs/dbraw/zinc/11/08/05/566110805.db2.gz DWDQVIFRAZBACO-HNNXBMFYSA-N 0 0 396.216 3.155 20 5 GGBDRN CN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000181071493 566110888 /nfs/dbraw/zinc/11/08/88/566110888.db2.gz DWDQVIFRAZBACO-OAHLLOKOSA-N 0 0 396.216 3.155 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(c2cccc(Br)c2)CC1 ZINC000181087521 566112501 /nfs/dbraw/zinc/11/25/01/566112501.db2.gz GXYVCPVQBGAVJP-UHFFFAOYSA-N 0 0 390.237 3.401 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)NC1CCN(CC(F)(F)F)CC1 ZINC000289306157 566116165 /nfs/dbraw/zinc/11/61/65/566116165.db2.gz AAIRMRHEUFAKAE-UHFFFAOYSA-N 0 0 380.754 3.396 20 5 GGBDRN CSc1ccc(C(=O)N(C)CCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000289333890 566117387 /nfs/dbraw/zinc/11/73/87/566117387.db2.gz YLQJUIPUDICDLK-UHFFFAOYSA-N 0 0 399.270 3.048 20 5 GGBDRN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN(C1CC1)[C@H]1CCS(=O)(=O)C1 ZINC000289350165 566118718 /nfs/dbraw/zinc/11/87/18/566118718.db2.gz KUUAUWSJOUYFPE-LBPRGKRZSA-N 0 0 379.265 3.053 20 5 GGBDRN C[C@@]1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CCOC1=O ZINC000289409537 566121545 /nfs/dbraw/zinc/12/15/45/566121545.db2.gz ACAONUWIWWKCSI-MRXNPFEDSA-N 0 0 395.209 3.413 20 5 GGBDRN O=C(NC[C@H]1CCN(CC(F)(F)F)C1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000289517182 566125922 /nfs/dbraw/zinc/12/59/22/566125922.db2.gz CBCWNXVIWORLKN-SECBINFHSA-N 0 0 380.754 3.254 20 5 GGBDRN CC[C@H](CSC)NC(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000181225118 566126242 /nfs/dbraw/zinc/12/62/42/566126242.db2.gz AYCBZLCWSBDHLT-SNVBAGLBSA-N 0 0 394.234 3.071 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCCN(c2nccs2)CC1 ZINC000289556137 566128320 /nfs/dbraw/zinc/12/83/20/566128320.db2.gz FPZVZONPZBQHEV-UHFFFAOYSA-N 0 0 381.845 3.449 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CN[C@@H]2CCCc3c[nH]nc32)c1 ZINC000289567539 566128326 /nfs/dbraw/zinc/12/83/26/566128326.db2.gz ROBZXHSSCXSDNI-CYBMUJFWSA-N 0 0 398.204 3.090 20 5 GGBDRN Cc1cccc(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1Br ZINC000365955438 566129003 /nfs/dbraw/zinc/12/90/03/566129003.db2.gz OAICEZSODHKOCB-UHFFFAOYSA-N 0 0 393.241 3.340 20 5 GGBDRN C[C@@H](N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1)C(F)(F)F ZINC000289554094 566129210 /nfs/dbraw/zinc/12/92/10/566129210.db2.gz FPIBLNQEYLSWHP-SECBINFHSA-N 0 0 380.754 3.349 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)[C@@H]1CCS(=O)(=O)c2ccccc21 ZINC000366039293 566133157 /nfs/dbraw/zinc/13/31/57/566133157.db2.gz JANGYZQSOUXFSE-LLVKDONJSA-N 0 0 380.809 3.148 20 5 GGBDRN O=c1[nH]c(Cc2ccc([N+](=O)[O-])cc2Br)nc2cc(F)ccc12 ZINC000181367513 566137220 /nfs/dbraw/zinc/13/72/20/566137220.db2.gz VMWMIDMUTVDJIV-UHFFFAOYSA-N 0 0 378.157 3.324 20 5 GGBDRN Cc1nnc([C@@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2Cl)s1 ZINC000289801082 566141716 /nfs/dbraw/zinc/14/17/16/566141716.db2.gz JJCRFOGNYUQYAP-RXMQYKEDSA-N 0 0 397.265 3.101 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 ZINC000289830593 566142530 /nfs/dbraw/zinc/14/25/30/566142530.db2.gz WUBQWJHISDPJRT-RKDXNWHRSA-N 0 0 381.738 3.273 20 5 GGBDRN Cc1csc(CCCCNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])n1 ZINC000181500994 566144814 /nfs/dbraw/zinc/14/48/14/566144814.db2.gz FHBGCYNROCAKGN-UHFFFAOYSA-N 0 0 375.497 3.260 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N(Cc2cccc(O)c2)CC2CC2)s1 ZINC000181532444 566147718 /nfs/dbraw/zinc/14/77/18/566147718.db2.gz GTEJNDZNLFJOCP-UHFFFAOYSA-N 0 0 382.463 3.182 20 5 GGBDRN CC[C@]1(CO)CCCN(S(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2Cl)C1 ZINC000289930015 566147859 /nfs/dbraw/zinc/14/78/59/566147859.db2.gz RHFXSOCMCWLWPY-AWEZNQCLSA-N 0 0 397.280 3.075 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccncc1 ZINC000366350235 566147981 /nfs/dbraw/zinc/14/79/81/566147981.db2.gz RSFIKZUYMLWYQT-OAHLLOKOSA-N 0 0 381.841 3.415 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)s1 ZINC000181594580 566151524 /nfs/dbraw/zinc/15/15/24/566151524.db2.gz UZLVMYJCOCIUOM-BXUZGUMPSA-N 0 0 388.854 3.118 20 5 GGBDRN COCC1(c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)CCC1 ZINC000289989696 566151589 /nfs/dbraw/zinc/15/15/89/566151589.db2.gz DZKXWWKAICHERX-UHFFFAOYSA-N 0 0 382.214 3.399 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cc1 ZINC000181597725 566151598 /nfs/dbraw/zinc/15/15/98/566151598.db2.gz RNODVFRIOXRDHK-CVEARBPZSA-N 0 0 382.825 3.057 20 5 GGBDRN CNC(=O)c1ccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000181595383 566151617 /nfs/dbraw/zinc/15/16/17/566151617.db2.gz DQVOVUOMUHFCOP-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000181599026 566151776 /nfs/dbraw/zinc/15/17/76/566151776.db2.gz PKAVSIMLLVRKBC-CZUORRHYSA-N 0 0 382.825 3.057 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000181599058 566151930 /nfs/dbraw/zinc/15/19/30/566151930.db2.gz PKAVSIMLLVRKBC-CJNGLKHVSA-N 0 0 382.825 3.057 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CCC1(F)F ZINC000290047789 566154492 /nfs/dbraw/zinc/15/44/92/566154492.db2.gz BBYKIOLRCXZWAK-MRVPVSSYSA-N 0 0 399.213 3.023 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCC(OCC2CC2)CC1 ZINC000366507786 566154786 /nfs/dbraw/zinc/15/47/86/566154786.db2.gz NINPLPHBDJJIQS-UHFFFAOYSA-N 0 0 388.873 3.136 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCOC[C@H](C2CCC2)C1 ZINC000366499570 566155124 /nfs/dbraw/zinc/15/51/24/566155124.db2.gz XQWQDRXXWPPZLQ-GFCCVEGCSA-N 0 0 383.242 3.246 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCOC[C@@H](C2CCC2)C1 ZINC000366499572 566155153 /nfs/dbraw/zinc/15/51/53/566155153.db2.gz XQWQDRXXWPPZLQ-LBPRGKRZSA-N 0 0 383.242 3.246 20 5 GGBDRN C[C@@H](CS(C)(=O)=O)N(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000290083809 566156528 /nfs/dbraw/zinc/15/65/28/566156528.db2.gz VFFLQXRGOKQTAC-VIFPVBQESA-N 0 0 381.281 3.299 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)CCC1(F)F ZINC000290094727 566157157 /nfs/dbraw/zinc/15/71/57/566157157.db2.gz DXFDTBVJTVOFJL-MRVPVSSYSA-N 0 0 399.213 3.023 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)CCC1(F)F ZINC000290094730 566157493 /nfs/dbraw/zinc/15/74/93/566157493.db2.gz DXFDTBVJTVOFJL-QMMMGPOBSA-N 0 0 399.213 3.023 20 5 GGBDRN C[C@@H]1C(=O)CC[C@H]1Cc1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000290110710 566157630 /nfs/dbraw/zinc/15/76/30/566157630.db2.gz ODNAAJIPTNHRNZ-UWVGGRQHSA-N 0 0 394.225 3.489 20 5 GGBDRN CCN([C@@H]1CCOC(C)(C)C1)S(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F ZINC000290191533 566160933 /nfs/dbraw/zinc/16/09/33/566160933.db2.gz LYYJUWYXDFBSBT-SNVBAGLBSA-N 0 0 394.852 3.356 20 5 GGBDRN CCN([C@H]1CCOC(C)(C)C1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000290223782 566162003 /nfs/dbraw/zinc/16/20/03/566162003.db2.gz OZDDAVQHYDDDMD-NSHDSACASA-N 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Cc1ccc(O[C@H](C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000462720554 566347888 /nfs/dbraw/zinc/34/78/88/566347888.db2.gz JXJDAAMWMYFPQY-GFCCVEGCSA-N 0 0 384.841 3.302 20 5 GGBDRN O=C(COc1ccc(Br)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000446423668 566349447 /nfs/dbraw/zinc/34/94/47/566349447.db2.gz WPHGLQYGRMZXPV-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCNS(=O)(=O)c1c(Cl)cccc1Cl ZINC000462725406 566349989 /nfs/dbraw/zinc/34/99/89/566349989.db2.gz HFINWROQABSOFC-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)CC(=O)c1cccs1 ZINC000536086473 566349978 /nfs/dbraw/zinc/34/99/78/566349978.db2.gz JECLYHSRZINIKG-LLVKDONJSA-N 0 0 382.463 3.159 20 5 GGBDRN CC(C)S(=O)(=O)c1c(Cl)cccc1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000576476378 566350204 /nfs/dbraw/zinc/35/02/04/566350204.db2.gz ZDGLWPAVULVDCN-UHFFFAOYSA-N 0 0 385.829 3.021 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C)CC(=O)c1cccs1 ZINC000536086474 566350302 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Cc1cnc(NC(=O)c2cc([N+](=O)[O-])cc(I)c2C)o1 ZINC000510118814 566364994 /nfs/dbraw/zinc/36/49/94/566364994.db2.gz LWVZNDSEDMKYES-UHFFFAOYSA-N 0 0 387.133 3.057 20 5 GGBDRN CSCCN(C)c1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000446840416 566368447 /nfs/dbraw/zinc/36/84/47/566368447.db2.gz GEUJGOKCAQMUJZ-UHFFFAOYSA-N 0 0 381.479 3.195 20 5 GGBDRN CN(Cc1cccs1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000446936177 566370555 /nfs/dbraw/zinc/37/05/55/566370555.db2.gz KRQDOBJOOOPQRE-UHFFFAOYSA-N 0 0 380.369 3.496 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2CCCCCC2)c(Br)c1 ZINC000446940755 566370954 /nfs/dbraw/zinc/37/09/54/566370954.db2.gz WMNYWHVOERESBV-UHFFFAOYSA-N 0 0 377.260 3.358 20 5 GGBDRN CO[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000462958079 566371287 /nfs/dbraw/zinc/37/12/87/566371287.db2.gz OGDLHPFWTHNPTN-MRXNPFEDSA-N 0 0 384.841 3.451 20 5 GGBDRN CN(Cc1cccs1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446934981 566371429 /nfs/dbraw/zinc/37/14/29/566371429.db2.gz CNAILSJZQTYFOK-UHFFFAOYSA-N 0 0 391.268 3.240 20 5 GGBDRN CNC(=O)c1ccc(N(C)Cc2ccc(Br)cc2F)c([N+](=O)[O-])c1 ZINC000600853875 566371431 /nfs/dbraw/zinc/37/14/31/566371431.db2.gz XKFVRJSBUYDLJB-UHFFFAOYSA-N 0 0 396.216 3.492 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCc1n[nH]cc1Br ZINC000576697360 566371740 /nfs/dbraw/zinc/37/17/40/566371740.db2.gz WRFQLMUBLCHTBQ-UHFFFAOYSA-N 0 0 389.593 3.133 20 5 GGBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1cccc(Br)c1)CCC2 ZINC000510221495 566371730 /nfs/dbraw/zinc/37/17/30/566371730.db2.gz HMXZPVRJDZISHK-UHFFFAOYSA-N 0 0 397.250 3.499 20 5 GGBDRN C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000446951514 566373186 /nfs/dbraw/zinc/37/31/86/566373186.db2.gz VRJSBXWKLLGWQW-JTQLQIEISA-N 0 0 397.250 3.497 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3ccccc3C2)c(Br)c1 ZINC000446950425 566373614 /nfs/dbraw/zinc/37/36/14/566373614.db2.gz OKJUHYZUMHRZRX-UHFFFAOYSA-N 0 0 397.250 3.104 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(S(C)(=O)=O)s1 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C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(-c2ncsc2Cl)no1 ZINC000463175110 566389265 /nfs/dbraw/zinc/38/92/65/566389265.db2.gz YLXLHYUKQOQRGC-ZETCQYMHSA-N 0 0 379.785 3.246 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(Sc2nc3cc(Cl)ccc3n2C)n1 ZINC000557510952 566391366 /nfs/dbraw/zinc/39/13/66/566391366.db2.gz MLKOYXTYNFZAGS-UHFFFAOYSA-N 0 0 378.797 3.468 20 5 GGBDRN CC[C@@H]1CCN(S(=O)(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000447163607 566391951 /nfs/dbraw/zinc/39/19/51/566391951.db2.gz UBXRTVOEVNBVRS-SNVBAGLBSA-N 0 0 377.260 3.086 20 5 GGBDRN Cc1nc2c(n1CCO)CC[C@@H](Nc1c(Cl)cc([N+](=O)[O-])cc1Cl)C2 ZINC000601184478 566395385 /nfs/dbraw/zinc/39/53/85/566395385.db2.gz MAPKZHKBCRSVKT-SNVBAGLBSA-N 0 0 385.251 3.368 20 5 GGBDRN O=[N+]([O-])c1cc2c(ncnc2NC[C@@H]2CCCN(CC(F)(F)F)C2)s1 ZINC000601192007 566395804 /nfs/dbraw/zinc/39/58/04/566395804.db2.gz OUIQJVFFGQXDOW-VIFPVBQESA-N 0 0 375.376 3.286 20 5 GGBDRN CNc1nccc(C(=O)N[C@@H](C)Cc2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000577002705 566397109 /nfs/dbraw/zinc/39/71/09/566397109.db2.gz KJECECVORQJQTL-VIFPVBQESA-N 0 0 383.235 3.121 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Br)cc1 ZINC000510606288 566397342 /nfs/dbraw/zinc/39/73/42/566397342.db2.gz PMFLKVGSNKAPFT-UHFFFAOYSA-N 0 0 399.266 3.221 20 5 GGBDRN C[C@H]1c2cc(Cl)c(Cl)cc2CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000536746053 566398165 /nfs/dbraw/zinc/39/81/65/566398165.db2.gz VHEBQFMLLYHZKL-GXFFZTMASA-N 0 0 385.251 3.078 20 5 GGBDRN CCOc1ccc([C@@H](C)NCc2c(Br)cnn2C)cc1[N+](=O)[O-] ZINC000601292805 566398401 /nfs/dbraw/zinc/39/84/01/566398401.db2.gz TWEQVLRKLYTMNZ-SNVBAGLBSA-N 0 0 383.246 3.340 20 5 GGBDRN CCOc1ccc([C@H](C)NCc2c(Br)cnn2C)cc1[N+](=O)[O-] ZINC000601292804 566398858 /nfs/dbraw/zinc/39/88/58/566398858.db2.gz TWEQVLRKLYTMNZ-JTQLQIEISA-N 0 0 383.246 3.340 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccnc(SC)c2)cc1SC ZINC000536805943 566402597 /nfs/dbraw/zinc/40/25/97/566402597.db2.gz JBQDDTRWEBXJKE-UHFFFAOYSA-N 0 0 379.463 3.372 20 5 GGBDRN CC(C)n1cc(C(C)(C)NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)nn1 ZINC000421735684 566404765 /nfs/dbraw/zinc/40/47/65/566404765.db2.gz OAUZPRHFKSBOCB-UHFFFAOYSA-N 0 0 396.245 3.195 20 5 GGBDRN Cc1cc(=NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)[nH]n1C(C)C ZINC000421731788 566405394 /nfs/dbraw/zinc/40/53/94/566405394.db2.gz KDAACEDXHKROHZ-UHFFFAOYSA-N 0 0 381.230 3.046 20 5 GGBDRN CSC1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000601479870 566408164 /nfs/dbraw/zinc/40/81/64/566408164.db2.gz AGSXGZJCOLZBET-UHFFFAOYSA-N 0 0 384.401 3.130 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1NCCCNS(=O)(=O)c1ccccc1Cl ZINC000557673415 566408149 /nfs/dbraw/zinc/40/81/49/566408149.db2.gz VTASZYQUEALFTF-UHFFFAOYSA-N 0 0 387.820 3.168 20 5 GGBDRN COCCN(Cc1cccnc1)c1ncc([N+](=O)[O-])c(C)c1Br ZINC000577145837 566409062 /nfs/dbraw/zinc/40/90/62/566409062.db2.gz KMGPTBAZDQLVMS-UHFFFAOYSA-N 0 0 381.230 3.109 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCC2(CCSCC2)CC1 ZINC000601495922 566409839 /nfs/dbraw/zinc/40/98/39/566409839.db2.gz IGQOGLOYCUHIJG-UHFFFAOYSA-N 0 0 384.523 3.076 20 5 GGBDRN O=c1c(Br)cn(Cc2sccc2Br)cc1[N+](=O)[O-] ZINC000463439364 566410091 /nfs/dbraw/zinc/41/00/91/566410091.db2.gz AEWZBTVBGJPSDE-UHFFFAOYSA-N 0 0 394.044 3.391 20 5 GGBDRN Cc1cc2c(cc1[N+](=O)[O-])N(S(=O)(=O)c1ccccc1Br)CC2 ZINC000536900109 566411008 /nfs/dbraw/zinc/41/10/08/566411008.db2.gz IEJMYSDQGGHXGK-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(F)c(Br)c(Cl)c2)c1[N+](=O)[O-] ZINC000557714826 566411192 /nfs/dbraw/zinc/41/11/92/566411192.db2.gz DDUYLDSYAPIZOQ-UHFFFAOYSA-N 0 0 391.584 3.444 20 5 GGBDRN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000536931836 566413119 /nfs/dbraw/zinc/41/31/19/566413119.db2.gz GRHPSOHMMKYHRC-XPTSAGLGSA-N 0 0 383.198 3.456 20 5 GGBDRN CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])s1 ZINC000557753245 566414688 /nfs/dbraw/zinc/41/46/88/566414688.db2.gz NNJJFGBCWZGRJX-JGVFFNPUSA-N 0 0 384.849 3.132 20 5 GGBDRN O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000510843788 566415770 /nfs/dbraw/zinc/41/57/70/566415770.db2.gz WZDPCTQWRUMJLI-UHFFFAOYSA-N 0 0 382.814 3.226 20 5 GGBDRN C[C@@H](CC[S@@](C)=O)Nc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000447676157 566421338 /nfs/dbraw/zinc/42/13/38/566421338.db2.gz PVKROBMSBVLGBR-PIMCKEEVSA-N 0 0 375.319 3.213 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Sc2ccc3c(c2)OCCCO3)s1 ZINC000537090467 566421473 /nfs/dbraw/zinc/42/14/73/566421473.db2.gz GOSKFJIUOYAZGT-UHFFFAOYSA-N 0 0 387.460 3.372 20 5 GGBDRN O=C(NCCCOc1ccc(Cl)cc1Cl)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000484265284 566421689 /nfs/dbraw/zinc/42/16/89/566421689.db2.gz DHFPONYRIOTVOK-UHFFFAOYSA-N 0 0 386.191 3.201 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](CO)Cc1ccc(Br)cc1 ZINC000577318020 566424755 /nfs/dbraw/zinc/42/47/55/566424755.db2.gz UCLLDONUHQVLRY-ZDUSSCGKSA-N 0 0 397.273 3.145 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC=C(c2ccncc2)C1 ZINC000510982668 566424782 /nfs/dbraw/zinc/42/47/82/566424782.db2.gz JWWHCLKMWAYIJW-UHFFFAOYSA-N 0 0 379.825 3.121 20 5 GGBDRN CCOc1cc(COc2ccc(Br)cc2C(N)=O)ccc1[N+](=O)[O-] ZINC000557830838 566424890 /nfs/dbraw/zinc/42/48/90/566424890.db2.gz XCYGBEYMRKBECA-UHFFFAOYSA-N 0 0 395.209 3.434 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000601851446 566427497 /nfs/dbraw/zinc/42/74/97/566427497.db2.gz NCICMSPLIZWSPH-UHFFFAOYSA-N 0 0 376.722 3.170 20 5 GGBDRN Cn1nc2c(c1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)CCCC2 ZINC000601841582 566427812 /nfs/dbraw/zinc/42/78/12/566427812.db2.gz BMVAHOADTFPTRA-UHFFFAOYSA-N 0 0 393.241 3.151 20 5 GGBDRN Cn1nc2c(c1NC(=O)c1ccc([N+](=O)[O-])cc1Br)CCCC2 ZINC000601843620 566428061 /nfs/dbraw/zinc/42/80/61/566428061.db2.gz VGMGIKDRRONKLL-UHFFFAOYSA-N 0 0 379.214 3.222 20 5 GGBDRN Cn1nc2c(c1NC(=O)c1sc(Br)cc1[N+](=O)[O-])CCCC2 ZINC000601842039 566428126 /nfs/dbraw/zinc/42/81/26/566428126.db2.gz GXRXMUVEDPOLQT-UHFFFAOYSA-N 0 0 385.243 3.283 20 5 GGBDRN CSC1CCN(c2nnc(CSc3ccccc3[N+](=O)[O-])n2C)CC1 ZINC000601857066 566428379 /nfs/dbraw/zinc/42/83/79/566428379.db2.gz NVTWEOHYNKLXCR-UHFFFAOYSA-N 0 0 379.511 3.347 20 5 GGBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCCC[C@@H]1Cc1cccc(Br)c1 ZINC000422036248 566428734 /nfs/dbraw/zinc/42/87/34/566428734.db2.gz NDBZSKXYGVQWHH-CYBMUJFWSA-N 0 0 393.241 3.318 20 5 GGBDRN Cc1c(NS(=O)(=O)c2ccc(OC(F)F)c(F)c2)cccc1[N+](=O)[O-] ZINC000447779700 566428940 /nfs/dbraw/zinc/42/89/40/566428940.db2.gz UNDMXWVUNQQPOS-UHFFFAOYSA-N 0 0 376.312 3.445 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc2n[nH]cc2c1 ZINC000511032497 566429405 /nfs/dbraw/zinc/42/94/05/566429405.db2.gz RKUUNFWAWUZCNT-VIFPVBQESA-N 0 0 380.813 3.164 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CCc2ccccc21 ZINC000511034563 566429563 /nfs/dbraw/zinc/42/95/63/566429563.db2.gz XDPJZHIFVUPAAE-UHFFFAOYSA-N 0 0 394.168 3.402 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)NCCSC(C)C)cc1[N+](=O)[O-] ZINC000557855278 566429638 /nfs/dbraw/zinc/42/96/38/566429638.db2.gz QRAFBSZXXDSQLR-UHFFFAOYSA-N 0 0 397.316 3.086 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000601917519 566430849 /nfs/dbraw/zinc/43/08/49/566430849.db2.gz XEHFJYPEYKWICT-UHFFFAOYSA-N 0 0 397.762 3.246 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000601890608 566431137 /nfs/dbraw/zinc/43/11/37/566431137.db2.gz TVQUTKQTLDYFNH-SNPRPXQTSA-N 0 0 383.242 3.123 20 5 GGBDRN CC[C@H](C)n1[nH]c(=NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1C ZINC000537211622 566431694 /nfs/dbraw/zinc/43/16/94/566431694.db2.gz OHFLRZFCSDLWHT-JTQLQIEISA-N 0 0 395.257 3.436 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](O)[C@@H]2CCCC[C@H]21 ZINC000601890609 566431612 /nfs/dbraw/zinc/43/16/12/566431612.db2.gz TVQUTKQTLDYFNH-YUELXQCFSA-N 0 0 383.242 3.123 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCC[C@@H]1C(F)F ZINC000511046491 566431514 /nfs/dbraw/zinc/43/15/14/566431514.db2.gz RJCUWNJKYBIKBB-MRVPVSSYSA-N 0 0 375.180 3.320 20 5 GGBDRN C[C@H](CC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000463753507 566432209 /nfs/dbraw/zinc/43/22/09/566432209.db2.gz WYXFDUQODVXVJP-SNVBAGLBSA-N 0 0 381.376 3.132 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)SCC(=O)N2 ZINC000577431230 566433768 /nfs/dbraw/zinc/43/37/68/566433768.db2.gz ROSQGZKCKZZJSP-UHFFFAOYSA-N 0 0 377.809 3.222 20 5 GGBDRN O=[N+]([O-])c1cccnc1NCc1nc(-c2cccc(Br)c2)no1 ZINC000447813826 566434003 /nfs/dbraw/zinc/43/40/03/566434003.db2.gz UTGALYSKGXTRGF-UHFFFAOYSA-N 0 0 376.170 3.414 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCC2([C@@H](O)C(C)C)CC2)cc1[N+](=O)[O-] ZINC000537258793 566434320 /nfs/dbraw/zinc/43/43/20/566434320.db2.gz GZBDLTPOIPTGKV-AWEZNQCLSA-N 0 0 385.258 3.193 20 5 GGBDRN O=[N+]([O-])c1cc(CNCc2cc(Br)c3c(c2)OCCO3)cs1 ZINC000537289378 566435741 /nfs/dbraw/zinc/43/57/41/566435741.db2.gz VMJJLTBNKBODTN-UHFFFAOYSA-N 0 0 385.239 3.480 20 5 GGBDRN Cc1cc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)ccn1 ZINC000463844153 566437520 /nfs/dbraw/zinc/43/75/20/566437520.db2.gz BCNPEEZEMGAMQY-UHFFFAOYSA-N 0 0 375.328 3.142 20 5 GGBDRN CN(CC(=O)N1CCc2ccc(Br)cc21)c1ccccc1[N+](=O)[O-] ZINC000463849416 566437908 /nfs/dbraw/zinc/43/79/08/566437908.db2.gz ZCWXRZAGFKVLGW-UHFFFAOYSA-N 0 0 390.237 3.383 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNCc2csc([N+](=O)[O-])c2)s1 ZINC000537301031 566438061 /nfs/dbraw/zinc/43/80/61/566438061.db2.gz ACLFOVCUMWDWNK-UHFFFAOYSA-N 0 0 389.524 3.038 20 5 GGBDRN O=C(N[C@H]1C[C@@H]1C(F)F)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000557963460 566438244 /nfs/dbraw/zinc/43/82/44/566438244.db2.gz XXABYHUXTCXIRK-CPCISQLKSA-N 0 0 391.161 3.471 20 5 GGBDRN CC(C)O[C@H]1C[C@H](NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000463859428 566438738 /nfs/dbraw/zinc/43/87/38/566438738.db2.gz NTQMTIUQFBSVRR-STQMWFEESA-N 0 0 376.862 3.119 20 5 GGBDRN CN(CCc1ccccc1[N+](=O)[O-])[C@@H](C(N)=O)c1ccc(Br)cc1 ZINC000511120094 566439196 /nfs/dbraw/zinc/43/91/96/566439196.db2.gz HEZKADLAECJKLG-MRXNPFEDSA-N 0 0 392.253 3.058 20 5 GGBDRN O=C(Nc1cscc1Cl)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000602033986 566442180 /nfs/dbraw/zinc/44/21/80/566442180.db2.gz QPSLJVUSNNGCGX-UHFFFAOYSA-N 0 0 379.825 3.439 20 5 GGBDRN COc1cc(CSc2nnnn2CCc2cccs2)ccc1[N+](=O)[O-] ZINC000484688206 566446131 /nfs/dbraw/zinc/44/61/31/566446131.db2.gz HYPIATXAFRAJSW-UHFFFAOYSA-N 0 0 377.451 3.186 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CCS(C)(=O)=O ZINC000537461671 566447080 /nfs/dbraw/zinc/44/70/80/566447080.db2.gz LHGGRUVPSDETJP-LBPRGKRZSA-N 0 0 388.511 3.040 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cc(Br)cc(C(F)(F)F)c1 ZINC000464142128 566448839 /nfs/dbraw/zinc/44/88/39/566448839.db2.gz PIJDTWUJLGSTPT-UHFFFAOYSA-N 0 0 393.119 3.211 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000511276212 566449613 /nfs/dbraw/zinc/44/96/13/566449613.db2.gz JQHDIJLFOKAKSN-AWEZNQCLSA-N 0 0 382.825 3.393 20 5 GGBDRN Cc1ccnc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000602162698 566450485 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Cc1c(I)cc([N+](=O)[O-])cc1C(=O)Nc1ccccn1 ZINC000512321001 566525950 /nfs/dbraw/zinc/52/59/50/566525950.db2.gz HPSQMLZDOPRZFK-UHFFFAOYSA-N 0 0 383.145 3.155 20 5 GGBDRN CC(C)(C)OC(=O)CCCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000465272767 566526088 /nfs/dbraw/zinc/52/60/88/566526088.db2.gz NXWZNXBBAFWUEL-UHFFFAOYSA-N 0 0 387.230 3.209 20 5 GGBDRN CC[C@H]1C[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1I ZINC000465295128 566526939 /nfs/dbraw/zinc/52/69/39/566526939.db2.gz LMHCJWUEYNRUJT-UWVGGRQHSA-N 0 0 388.205 3.460 20 5 GGBDRN CCC1(CC)CN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000559120117 566527022 /nfs/dbraw/zinc/52/70/22/566527022.db2.gz GXILLTHCBMGPAD-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1SC1CCCCC1 ZINC000603476099 566529169 /nfs/dbraw/zinc/52/91/69/566529169.db2.gz XKARSRYSFFTXGX-UHFFFAOYSA-N 0 0 386.495 3.041 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2ccc(SCCO)c([N+](=O)[O-])c2)c(C)c1 ZINC000603474609 566529458 /nfs/dbraw/zinc/52/94/58/566529458.db2.gz 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Cn1cnc([N+](=O)[O-])c1NCC1(c2cccc(Br)c2)CCOCC1 ZINC000603870900 566544448 /nfs/dbraw/zinc/54/44/48/566544448.db2.gz BQLJJZCFOJOHIB-UHFFFAOYSA-N 0 0 395.257 3.251 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)c1ccc(Br)cc1 ZINC000538886046 566544967 /nfs/dbraw/zinc/54/49/67/566544967.db2.gz CWMNJXBGQPXSLU-HNNXBMFYSA-N 0 0 379.210 3.129 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCCc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000512615907 566545391 /nfs/dbraw/zinc/54/53/91/566545391.db2.gz YMWCHVMEGCPYKK-UHFFFAOYSA-N 0 0 379.210 3.344 20 5 GGBDRN Cc1c(Br)c(N2CC[C@H](OCc3ccncc3)C2)ncc1[N+](=O)[O-] ZINC000578698060 566545449 /nfs/dbraw/zinc/54/54/49/566545449.db2.gz DFRPCXHKLKRTKV-ZDUSSCGKSA-N 0 0 393.241 3.251 20 5 GGBDRN NS(=O)(=O)c1c(NCCc2csc3ccccc23)cccc1[N+](=O)[O-] ZINC000603932706 566546085 /nfs/dbraw/zinc/54/60/85/566546085.db2.gz VJERUIWGDPNMBD-UHFFFAOYSA-N 0 0 377.447 3.112 20 5 GGBDRN C[C@@H](C[S@@](C)=O)N(C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000485971335 566546142 /nfs/dbraw/zinc/54/61/42/566546142.db2.gz YDPLVSBJRKDAMC-GTUYJWLHSA-N 0 0 386.271 3.109 20 5 GGBDRN CN(Cc1ccc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1S(N)(=O)=O ZINC000603929030 566546237 /nfs/dbraw/zinc/54/62/37/566546237.db2.gz QBYVOSWUSIEZHK-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN CN(CCCOc1ccc(Cl)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000603958976 566546815 /nfs/dbraw/zinc/54/68/15/566546815.db2.gz NOJLJTAUWBUAEH-UHFFFAOYSA-N 0 0 384.841 3.338 20 5 GGBDRN CN(Cc1ccc(Br)s1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000603945334 566547011 /nfs/dbraw/zinc/54/70/11/566547011.db2.gz JHPRPFCSNPHGPZ-UHFFFAOYSA-N 0 0 399.222 3.420 20 5 GGBDRN O=[N+]([O-])c1nn(Cc2nnc(-c3ccccc3Cl)o2)cc1Br ZINC000603948607 566547111 /nfs/dbraw/zinc/54/71/11/566547111.db2.gz ZEYMSFZSJUSRBT-UHFFFAOYSA-N 0 0 384.577 3.306 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCCSc2ccc(F)cc2)c(F)c1 ZINC000603956449 566547760 /nfs/dbraw/zinc/54/77/60/566547760.db2.gz OIXJSCBNEZCADL-UHFFFAOYSA-N 0 0 388.417 3.334 20 5 GGBDRN O=[N+]([O-])c1cnc(N2CCC[C@H](Oc3ncccc3F)C2)c(Br)c1 ZINC000486016430 566548284 /nfs/dbraw/zinc/54/82/84/566548284.db2.gz LFMYHBYEQIWILC-NSHDSACASA-N 0 0 397.204 3.334 20 5 GGBDRN COc1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c(Br)c1 ZINC000559438911 566548163 /nfs/dbraw/zinc/54/81/63/566548163.db2.gz DPGJTJPMXOBFOZ-UHFFFAOYSA-N 0 0 391.181 3.495 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C1=Cc2cc(Br)ccc2OC1 ZINC000603999574 566549187 /nfs/dbraw/zinc/54/91/87/566549187.db2.gz JIFQGKDQFQPCAR-UHFFFAOYSA-N 0 0 389.205 3.450 20 5 GGBDRN Cc1ccc(CSCCNS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000604021945 566549974 /nfs/dbraw/zinc/54/99/74/566549974.db2.gz VLWNHEVYPSNTOE-UHFFFAOYSA-N 0 0 380.491 3.423 20 5 GGBDRN COc1ccc(CNC(=O)c2cc(F)ccc2Br)cc1[N+](=O)[O-] ZINC000604016680 566550003 /nfs/dbraw/zinc/55/00/03/566550003.db2.gz NCIFJRKALXLYLX-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN C[C@@H]1CCCC[C@H]1OCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000604033399 566550348 /nfs/dbraw/zinc/55/03/48/566550348.db2.gz LPAVQTITNDKKEE-BXUZGUMPSA-N 0 0 376.862 3.122 20 5 GGBDRN COc1ccc(CNC(=O)c2cc(F)cc(Br)c2)cc1[N+](=O)[O-] ZINC000604017574 566550835 /nfs/dbraw/zinc/55/08/35/566550835.db2.gz IHXMVYSELJMJFI-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)c(Cl)c1 ZINC000604021012 566550864 /nfs/dbraw/zinc/55/08/64/566550864.db2.gz HNVNBHIXJNSCPN-UHFFFAOYSA-N 0 0 391.232 3.259 20 5 GGBDRN COc1cccc(CCNS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1 ZINC000604033964 566551541 /nfs/dbraw/zinc/55/15/41/566551541.db2.gz NKAXFIDAGKKHJU-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000604074507 566552383 /nfs/dbraw/zinc/55/23/83/566552383.db2.gz CTFZYJDECOMOME-UHFFFAOYSA-N 0 0 385.207 3.331 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cscc2Br)cc([N+](=O)[O-])c1 ZINC000512722495 566552638 /nfs/dbraw/zinc/55/26/38/566552638.db2.gz GQDCOTKNDOCLSH-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN C[C@@H](Cc1ccc(Br)cc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000604034166 566552632 /nfs/dbraw/zinc/55/26/32/566552632.db2.gz LYDUIYZPHHLQNM-NSHDSACASA-N 0 0 399.266 3.267 20 5 GGBDRN O=C(c1cscc1Br)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000512714734 566552756 /nfs/dbraw/zinc/55/27/56/566552756.db2.gz XMNSOZYPADNEIW-VIFPVBQESA-N 0 0 397.254 3.140 20 5 GGBDRN COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000539005222 566553314 /nfs/dbraw/zinc/55/33/14/566553314.db2.gz KIAXVIPIGBEXIG-CZUORRHYSA-N 0 0 399.241 3.209 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1nccn1C(F)F ZINC000559515077 566553689 /nfs/dbraw/zinc/55/36/89/566553689.db2.gz MFKPDDQURIJEOF-UHFFFAOYSA-N 0 0 389.156 3.187 20 5 GGBDRN COC[C@@]1(C)CCN(Cc2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000449394667 566555544 /nfs/dbraw/zinc/55/55/44/566555544.db2.gz OITAJSRMFYWPKL-AWEZNQCLSA-N 0 0 390.221 3.058 20 5 GGBDRN O=C(NCCCCSc1ccccc1Br)c1cc([N+](=O)[O-])n[nH]1 ZINC000512769996 566555613 /nfs/dbraw/zinc/55/56/13/566555613.db2.gz DOOCSLSOQOJLRY-UHFFFAOYSA-N 0 0 399.270 3.383 20 5 GGBDRN COC[C@]1(C)CCN(Cc2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000449394668 566555998 /nfs/dbraw/zinc/55/59/98/566555998.db2.gz OITAJSRMFYWPKL-CQSZACIVSA-N 0 0 390.221 3.058 20 5 GGBDRN Cc1cc2c(cc1[N+](=O)[O-])N(S(=O)(=O)c1ccc(Br)cc1)CC2 ZINC000539113858 566559513 /nfs/dbraw/zinc/55/95/13/566559513.db2.gz PIPJOCFRSRWFOS-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CCCN(C(=O)c1sc(Br)cc1[N+](=O)[O-])[C@H](C)C(=O)OCC ZINC000486105354 566559622 /nfs/dbraw/zinc/55/96/22/566559622.db2.gz YBNYPPYHELGXCX-MRVPVSSYSA-N 0 0 393.259 3.223 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)cc1Cl ZINC000539113822 566560102 /nfs/dbraw/zinc/56/01/02/566560102.db2.gz NXXMMZLOCPPEPV-UHFFFAOYSA-N 0 0 382.825 3.317 20 5 GGBDRN COc1ccc(CSCC(=O)N(CC(F)(F)F)C2CC2)cc1[N+](=O)[O-] ZINC000512848956 566562609 /nfs/dbraw/zinc/56/26/09/566562609.db2.gz APINNUKETGAHPC-UHFFFAOYSA-N 0 0 378.372 3.390 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1c(F)c(F)ccc1Cl ZINC000559639754 566563958 /nfs/dbraw/zinc/56/39/58/566563958.db2.gz MXTXLANBKDOCFJ-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN COc1ccc(Br)c(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 ZINC000466295337 566564699 /nfs/dbraw/zinc/56/46/99/566564699.db2.gz FSBJUBDWAVLWFC-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1nnc([C@H](C)NC(=O)c2sc(Br)cc2[N+](=O)[O-])s1 ZINC000486166304 566565047 /nfs/dbraw/zinc/56/50/47/566565047.db2.gz QCXKFLSQKYNRGB-BYPYZUCNSA-N 0 0 377.245 3.070 20 5 GGBDRN O=C(NCc1cc(Br)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000604457432 566566001 /nfs/dbraw/zinc/56/60/01/566566001.db2.gz JVPXMGJIQKJWTC-UHFFFAOYSA-N 0 0 393.193 3.059 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NCc2cc(-c3ccccc3)no2)s1 ZINC000539187511 566566653 /nfs/dbraw/zinc/56/66/53/566566653.db2.gz MYGKZFCWNXEQPM-UHFFFAOYSA-N 0 0 379.419 3.327 20 5 GGBDRN C[C@H](Cc1cccc(Br)c1)Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000604438388 566566638 /nfs/dbraw/zinc/56/66/38/566566638.db2.gz QDNFUNQALSTXNZ-SNVBAGLBSA-N 0 0 378.226 3.499 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1Br ZINC000559703009 566567395 /nfs/dbraw/zinc/56/73/95/566567395.db2.gz HUYXQWRRXBPPCL-UHFFFAOYSA-N 0 0 383.173 3.305 20 5 GGBDRN O=C(NCc1ccc(Br)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000604497867 566567361 /nfs/dbraw/zinc/56/73/61/566567361.db2.gz UCGWIOTWWODEOB-UHFFFAOYSA-N 0 0 397.156 3.155 20 5 GGBDRN CSc1ccc(C(=O)Nc2ccc(CS(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000604497852 566567934 /nfs/dbraw/zinc/56/79/34/566567934.db2.gz PNTVSVKLUSSVIF-UHFFFAOYSA-N 0 0 380.447 3.114 20 5 GGBDRN CO[C@H]1CCN(Cc2cc(I)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000449495160 566569777 /nfs/dbraw/zinc/56/97/77/566569777.db2.gz HLGALVKFBIJGHE-HZMBPMFUSA-N 0 0 390.221 3.056 20 5 GGBDRN COCC[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C(C)(C)C ZINC000512947606 566569756 /nfs/dbraw/zinc/56/97/56/566569756.db2.gz KMEHJWUNUKXPAX-AWEZNQCLSA-N 0 0 387.274 3.467 20 5 GGBDRN CO[C@@H]1CCN(Cc2cc(I)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000449495164 566570002 /nfs/dbraw/zinc/57/00/02/566570002.db2.gz HLGALVKFBIJGHE-QMTHXVAHSA-N 0 0 390.221 3.056 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)COc1ccc(Br)cc1 ZINC000512959577 566570941 /nfs/dbraw/zinc/57/09/41/566570941.db2.gz BIAWQLJIYQBQSA-UHFFFAOYSA-N 0 0 393.237 3.437 20 5 GGBDRN Cc1oc(Br)cc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000424790959 566571284 /nfs/dbraw/zinc/57/12/84/566571284.db2.gz JQYJXCCYQDCJJM-UHFFFAOYSA-N 0 0 381.182 3.162 20 5 GGBDRN Cc1occc1CNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000604572941 566571745 /nfs/dbraw/zinc/57/17/45/566571745.db2.gz BXIFLAUYKAUOEE-UHFFFAOYSA-N 0 0 386.145 3.031 20 5 GGBDRN Cc1cccc(C[C@@H](CO)Nc2ncc([N+](=O)[O-])c(C)c2Br)c1 ZINC000466383034 566572182 /nfs/dbraw/zinc/57/21/82/566572182.db2.gz JUGUXJLAHWTXES-ZDUSSCGKSA-N 0 0 380.242 3.385 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)COc1cccc(Br)c1 ZINC000513029915 566574905 /nfs/dbraw/zinc/57/49/05/566574905.db2.gz BHPDXTKEAWQSMP-UHFFFAOYSA-N 0 0 393.237 3.437 20 5 GGBDRN O=C(c1c(Cl)cncc1Cl)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000559891339 566574966 /nfs/dbraw/zinc/57/49/66/566574966.db2.gz QDWWNIDLQXHTMS-SECBINFHSA-N 0 0 382.207 3.018 20 5 GGBDRN COc1cc(OC)cc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000466420109 566575395 /nfs/dbraw/zinc/57/53/95/566575395.db2.gz WOMQCMQLYMZOGA-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN CC(C)CCn1ccc(=NC(=O)c2sc(Br)cc2[N+](=O)[O-])[nH]1 ZINC000486290924 566575961 /nfs/dbraw/zinc/57/59/61/566575961.db2.gz GRLGBRPZEYSSHL-UHFFFAOYSA-N 0 0 387.259 3.336 20 5 GGBDRN CC1(C)CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[S@@]1=O ZINC000449573979 566577175 /nfs/dbraw/zinc/57/71/75/566577175.db2.gz UZKSVNXNFYJMIY-VWLOTQADSA-N 0 0 379.507 3.451 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CCCOc2cc(Cl)ccc21 ZINC000539385495 566578998 /nfs/dbraw/zinc/57/89/98/566578998.db2.gz RZMUAFGRTNUPNR-CYBMUJFWSA-N 0 0 382.825 3.440 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(F)cc1F ZINC000466519747 566581407 /nfs/dbraw/zinc/58/14/07/566581407.db2.gz AWLCWKRDZUCJBD-UHFFFAOYSA-N 0 0 376.768 3.313 20 5 GGBDRN O=[N+]([O-])c1ccc(CNS(=O)(=O)c2cc(F)c(F)c(F)c2)c(Cl)c1 ZINC000466514879 566581674 /nfs/dbraw/zinc/58/16/74/566581674.db2.gz MMQONYYHHXFSCP-UHFFFAOYSA-N 0 0 380.731 3.144 20 5 GGBDRN CCN(Cc1ccccc1Cl)c1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-] ZINC000513194726 566588294 /nfs/dbraw/zinc/58/82/94/566588294.db2.gz SFHAKIFDHNGNCI-UHFFFAOYSA-N 0 0 383.857 3.183 20 5 GGBDRN CCN(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000513202127 566589050 /nfs/dbraw/zinc/58/90/50/566589050.db2.gz OKTCIEGPHDKAPC-UHFFFAOYSA-N 0 0 382.825 3.318 20 5 GGBDRN C[C@]1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCO[C@@H]1C1CC1 ZINC000466690555 566592171 /nfs/dbraw/zinc/59/21/71/566592171.db2.gz KQKQPYRWVVGORS-IAGOWNOFSA-N 0 0 397.269 3.221 20 5 GGBDRN CC(C)C[C@H]1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000539637679 566594103 /nfs/dbraw/zinc/59/41/03/566594103.db2.gz CVYXEGWCIPJQPM-YPMHNXCESA-N 0 0 376.862 3.120 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1CC[C@](O)(C2CC2)C1 ZINC000486507591 566594826 /nfs/dbraw/zinc/59/48/26/566594826.db2.gz LASUSZSPQMLWBZ-MRXNPFEDSA-N 0 0 378.226 3.257 20 5 GGBDRN COC(=O)c1cnc([C@H](C)NC(=O)c2cc(SC)ccc2[N+](=O)[O-])s1 ZINC000424993289 566595571 /nfs/dbraw/zinc/59/55/71/566595571.db2.gz HNXKLYBHMNOTQP-QMMMGPOBSA-N 0 0 381.435 3.051 20 5 GGBDRN Cc1ccc(Br)c2c1N(C(=O)CCn1cc([N+](=O)[O-])cn1)CCC2 ZINC000539660010 566595532 /nfs/dbraw/zinc/59/55/32/566595532.db2.gz KFGUJBKZTDKSIQ-UHFFFAOYSA-N 0 0 393.241 3.232 20 5 GGBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccncc1F ZINC000513387466 566598979 /nfs/dbraw/zinc/59/89/79/566598979.db2.gz BLQSJRCBGNUCOT-SECBINFHSA-N 0 0 382.189 3.311 20 5 GGBDRN CC(=O)Nc1cccnc1NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000560118314 566599608 /nfs/dbraw/zinc/59/96/08/566599608.db2.gz XXEQIIFWAKVHAE-UHFFFAOYSA-N 0 0 393.197 3.271 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCc2ccc(Br)cc2C1 ZINC000560125472 566600858 /nfs/dbraw/zinc/60/08/58/566600858.db2.gz WBECGMHGOSGKBH-UHFFFAOYSA-N 0 0 391.221 3.321 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2cnn(S(=O)(=O)c3ccc(F)cc3Cl)c2)c1 ZINC000539768923 566601420 /nfs/dbraw/zinc/60/14/20/566601420.db2.gz YCJQVWFWNWICEL-UHFFFAOYSA-N 0 0 381.772 3.488 20 5 GGBDRN COCCN([C@@H]1CCC[C@H]1C)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000486613902 566603362 /nfs/dbraw/zinc/60/33/62/566603362.db2.gz BJRQDZPQZYQERX-IAQYHMDHSA-N 0 0 390.889 3.382 20 5 GGBDRN COCCN([C@H]1CCC[C@@H]1C)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000486613905 566603674 /nfs/dbraw/zinc/60/36/74/566603674.db2.gz BJRQDZPQZYQERX-NHYWBVRUSA-N 0 0 390.889 3.382 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N=c1ccn(CCC(F)(F)F)[nH]1 ZINC000425097614 566603834 /nfs/dbraw/zinc/60/38/34/566603834.db2.gz VUJZYJOFZVEIKN-UHFFFAOYSA-N 0 0 376.722 3.000 20 5 GGBDRN CC(C)C[C@@H]1CCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000466881239 566604081 /nfs/dbraw/zinc/60/40/81/566604081.db2.gz PRJAHUXLCXDXQK-NSHDSACASA-N 0 0 391.287 3.414 20 5 GGBDRN CC(C)C[C@@H]1CCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000466894295 566605814 /nfs/dbraw/zinc/60/58/14/566605814.db2.gz QCPBYBXJQHCZMP-NSHDSACASA-N 0 0 391.287 3.414 20 5 GGBDRN CN(CCOc1ccccc1Cl)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000539844384 566606196 /nfs/dbraw/zinc/60/61/96/566606196.db2.gz VOOMQMRBUBVHRO-UHFFFAOYSA-N 0 0 390.870 3.228 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 ZINC000579396979 566606544 /nfs/dbraw/zinc/60/65/44/566606544.db2.gz XDOQPNWHWCPQLR-CYBMUJFWSA-N 0 0 381.479 3.230 20 5 GGBDRN COCCN([C@H]1CCC[C@@H]1C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000486642274 566607133 /nfs/dbraw/zinc/60/71/33/566607133.db2.gz UAEWPOZMLFKWJN-AAEUAGOBSA-N 0 0 376.862 3.074 20 5 GGBDRN CN(C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CCC(C)(C)C1 ZINC000560217535 566608155 /nfs/dbraw/zinc/60/81/55/566608155.db2.gz IDJMMJZDVBPHSY-LBPRGKRZSA-N 0 0 398.257 3.333 20 5 GGBDRN C[C@@H]1CCCCCN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560223983 566608206 /nfs/dbraw/zinc/60/82/06/566608206.db2.gz LLHGWWVBLLXWGE-SNVBAGLBSA-N 0 0 384.230 3.087 20 5 GGBDRN CC[C@H](C)C[C@@H](C)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000560224505 566608833 /nfs/dbraw/zinc/60/88/33/566608833.db2.gz CFQKOHRCMPGGJF-VHSXEESVSA-N 0 0 386.246 3.237 20 5 GGBDRN CC[C@H]1C[C@@H](C)CN1S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000466929611 566609093 /nfs/dbraw/zinc/60/90/93/566609093.db2.gz SBZZVHIGIPTXFM-KOLCDFICSA-N 0 0 391.287 3.475 20 5 GGBDRN CC[C@H]1C[C@H](C)CN1S(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000466929613 566609185 /nfs/dbraw/zinc/60/91/85/566609185.db2.gz SBZZVHIGIPTXFM-ONGXEEELSA-N 0 0 391.287 3.475 20 5 GGBDRN CC[C@@H]1C[C@@H](C)CN1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000466929380 566609547 /nfs/dbraw/zinc/60/95/47/566609547.db2.gz AUCPYORJBHGGHD-MWLCHTKSSA-N 0 0 377.260 3.166 20 5 GGBDRN C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000486673549 566611095 /nfs/dbraw/zinc/61/10/95/566611095.db2.gz GNBBJUMRYLMVDS-JTQLQIEISA-N 0 0 387.889 3.102 20 5 GGBDRN CSCc1ccccc1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000513653597 566615968 /nfs/dbraw/zinc/61/59/68/566615968.db2.gz GGPSARSFPXAPMS-UHFFFAOYSA-N 0 0 380.447 3.114 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(C2CC2)s1 ZINC000560325737 566617305 /nfs/dbraw/zinc/61/73/05/566617305.db2.gz WGENNGZPWQVXBB-UHFFFAOYSA-N 0 0 380.451 3.315 20 5 GGBDRN Cc1cc(C(=O)N[C@@H](CO)c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000539984488 566619866 /nfs/dbraw/zinc/61/98/66/566619866.db2.gz TXNHFYJALBGSTL-AWEZNQCLSA-N 0 0 379.210 3.129 20 5 GGBDRN O=C(N[C@@H](CO)c1ccc(Br)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000539986497 566619907 /nfs/dbraw/zinc/61/99/07/566619907.db2.gz YXGSSLQBFWMNHO-AWEZNQCLSA-N 0 0 399.628 3.474 20 5 GGBDRN Cc1ccccc1[C@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000539983081 566619939 /nfs/dbraw/zinc/61/99/39/566619939.db2.gz HLQMGMHMLWSPFS-INIZCTEOSA-N 0 0 393.237 3.058 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H](CO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000539983615 566620071 /nfs/dbraw/zinc/62/00/71/566620071.db2.gz JHMCCORUDGNKLS-CQSZACIVSA-N 0 0 385.258 3.337 20 5 GGBDRN COc1ccccc1[C@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)C1 ZINC000467053879 566621626 /nfs/dbraw/zinc/62/16/26/566621626.db2.gz NJXMCKGAGUDMJC-LBPRGKRZSA-N 0 0 382.463 3.152 20 5 GGBDRN COc1ccc(C[C@@H](C)CNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000467051651 566621631 /nfs/dbraw/zinc/62/16/31/566621631.db2.gz QSZKPTHHKVPGEB-LLVKDONJSA-N 0 0 384.479 3.130 20 5 GGBDRN CCOc1cccc([C@H]2C[C@H]2NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000467063829 566622229 /nfs/dbraw/zinc/62/22/29/566622229.db2.gz KUJKSUCGBOYEKW-ZIAGYGMSSA-N 0 0 382.463 3.198 20 5 GGBDRN CCOc1cccc([C@H]2C[C@@H]2NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000467063828 566622931 /nfs/dbraw/zinc/62/29/31/566622931.db2.gz KUJKSUCGBOYEKW-KGLIPLIRSA-N 0 0 382.463 3.198 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000467066597 566623148 /nfs/dbraw/zinc/62/31/48/566623148.db2.gz VKCNXDSCKYMDFC-ZDUSSCGKSA-N 0 0 382.463 3.054 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2cccc(OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000467075675 566624339 /nfs/dbraw/zinc/62/43/39/566624339.db2.gz PQDRDEUVXQIXJI-UHFFFAOYSA-N 0 0 385.467 3.016 20 5 GGBDRN Cc1sc(S(=O)(=O)NCCc2c[nH]c3cc(C)ccc23)cc1[N+](=O)[O-] ZINC000467079842 566625318 /nfs/dbraw/zinc/62/53/18/566625318.db2.gz QPBFAMHBZYELAI-UHFFFAOYSA-N 0 0 379.463 3.275 20 5 GGBDRN CC(C)(C)OC(=O)C(C)(C)CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000425271201 566625341 /nfs/dbraw/zinc/62/53/41/566625341.db2.gz HRLPZUWSOUHQKU-UHFFFAOYSA-N 0 0 392.499 3.230 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000486816502 566625675 /nfs/dbraw/zinc/62/56/75/566625675.db2.gz BZXXVQOIUFFINP-MRVPVSSYSA-N 0 0 395.384 3.418 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCCN2S(=O)(=O)c1cccc(Br)c1 ZINC000513814592 566626646 /nfs/dbraw/zinc/62/66/46/566626646.db2.gz BXTAYTOHSDPJTM-UHFFFAOYSA-N 0 0 397.250 3.499 20 5 GGBDRN COc1ccc([C@@H](OC)[C@H](C)Nc2c(Br)cncc2[N+](=O)[O-])cc1 ZINC000540079305 566628026 /nfs/dbraw/zinc/62/80/26/566628026.db2.gz ZRHVXYLSPCSOQV-QFYYESIMSA-N 0 0 396.241 3.371 20 5 GGBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cccc(OC(F)(F)F)c1 ZINC000513815913 566628000 /nfs/dbraw/zinc/62/80/00/566628000.db2.gz DFLFLFQHBAJRKV-UHFFFAOYSA-N 0 0 376.312 3.319 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(Br)c(C)n2)cc([N+](=O)[O-])c1OC ZINC000467128133 566628302 /nfs/dbraw/zinc/62/83/02/566628302.db2.gz RRENGZZZHFOJLM-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)ccc1[N+](=O)[O-] ZINC000486846674 566628454 /nfs/dbraw/zinc/62/84/54/566628454.db2.gz ZKXQXLXGXUAJTM-QMMMGPOBSA-N 0 0 395.384 3.418 20 5 GGBDRN COC[C@H](c1ccc(Cl)cc1)N(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000486857722 566629774 /nfs/dbraw/zinc/62/97/74/566629774.db2.gz SDXRFPVQFHRDIE-MRXNPFEDSA-N 0 0 384.841 3.256 20 5 GGBDRN COC[C@H](c1ccc(Cl)cc1)N(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000486848265 566629938 /nfs/dbraw/zinc/62/99/38/566629938.db2.gz VUXLIWNBQQVXAP-OAHLLOKOSA-N 0 0 384.841 3.256 20 5 GGBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000486866174 566631538 /nfs/dbraw/zinc/63/15/38/566631538.db2.gz MIQVECDIVZZSKY-SSDOTTSWSA-N 0 0 381.357 3.110 20 5 GGBDRN COc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cc(Br)c1OC ZINC000579738823 566635476 /nfs/dbraw/zinc/63/54/76/566635476.db2.gz BWUNDZGRYFESDE-UHFFFAOYSA-N 0 0 395.209 3.305 20 5 GGBDRN CC(C)(C)c1nnc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000467216185 566635598 /nfs/dbraw/zinc/63/55/98/566635598.db2.gz HPPYXFFHETYYAA-UHFFFAOYSA-N 0 0 383.861 3.397 20 5 GGBDRN CC[C@@H](CSC)N(C)c1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-] ZINC000540205983 566636007 /nfs/dbraw/zinc/63/60/07/566636007.db2.gz WCBTYRMZCGHBAK-ZDUSSCGKSA-N 0 0 389.543 3.203 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)CCOc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000467264040 566636432 /nfs/dbraw/zinc/63/64/32/566636432.db2.gz HRHANYVDBSOGKO-UHFFFAOYSA-N 0 0 390.870 3.318 20 5 GGBDRN CC[C@H](CSC)N(C)c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000540204356 566636708 /nfs/dbraw/zinc/63/67/08/566636708.db2.gz CGWGMAFWWJYMSW-LLVKDONJSA-N 0 0 382.873 3.372 20 5 GGBDRN O=C(NCc1cc(Cl)cc(Cl)c1OC(F)F)c1cc([N+](=O)[O-])n[nH]1 ZINC000560555158 566637026 /nfs/dbraw/zinc/63/70/26/566637026.db2.gz VUECEWFWOPDDLH-UHFFFAOYSA-N 0 0 381.122 3.156 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCN(c2ccccn2)CC1 ZINC000425382888 566637206 /nfs/dbraw/zinc/63/72/06/566637206.db2.gz JHPMVPCKWDHBNY-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN O=C(NCc1ccsc1Br)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000514013907 566637245 /nfs/dbraw/zinc/63/72/45/566637245.db2.gz SLKWJFBIRHUVIB-UHFFFAOYSA-N 0 0 381.211 3.225 20 5 GGBDRN CC[C@H](CSC)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000540215444 566637428 /nfs/dbraw/zinc/63/74/28/566637428.db2.gz RUMFFYPVZWSOLI-SECBINFHSA-N 0 0 397.316 3.119 20 5 GGBDRN CCCNC(=O)[C@@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425401835 566639322 /nfs/dbraw/zinc/63/93/22/566639322.db2.gz QRQPHDLTNZBPSU-CYBMUJFWSA-N 0 0 384.274 3.096 20 5 GGBDRN O=C1NCCN(Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000425413587 566639517 /nfs/dbraw/zinc/63/95/17/566639517.db2.gz HAMRUPDPBQLXBQ-AWEZNQCLSA-N 0 0 396.266 3.092 20 5 GGBDRN CN(CC(=O)NCc1cccs1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425409993 566640222 /nfs/dbraw/zinc/64/02/22/566640222.db2.gz WYBHFFGHSOUSJW-UHFFFAOYSA-N 0 0 398.282 3.167 20 5 GGBDRN CCO[C@H](C)c1noc(CN(C)Cc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000425415886 566641094 /nfs/dbraw/zinc/64/10/94/566641094.db2.gz HIBLIFXKFSBVHB-SNVBAGLBSA-N 0 0 399.245 3.470 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccc(Br)cc1[N+](=O)[O-])CC2 ZINC000425419868 566641450 /nfs/dbraw/zinc/64/14/50/566641450.db2.gz ODPPKONUTFCHBN-CVEARBPZSA-N 0 0 399.285 3.109 20 5 GGBDRN Cc1nc(CCNc2ccc(I)cc2[N+](=O)[O-])c(C)o1 ZINC000540295882 566641622 /nfs/dbraw/zinc/64/16/22/566641622.db2.gz 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ZINC000467399880 566644118 /nfs/dbraw/zinc/64/41/18/566644118.db2.gz HXDXXAVQKFDEDA-UHFFFAOYSA-N 0 0 380.369 3.462 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000467405322 566644985 /nfs/dbraw/zinc/64/49/85/566644985.db2.gz PJDSAVVCYBXLCD-UHFFFAOYSA-N 0 0 380.369 3.462 20 5 GGBDRN Cc1sc(S(=O)(=O)N(C)CCOc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000467416482 566645055 /nfs/dbraw/zinc/64/50/55/566645055.db2.gz GIWRFCDZCRYRNI-UHFFFAOYSA-N 0 0 390.870 3.318 20 5 GGBDRN CNC(=O)CC[C@@H]1CCCCN1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425455296 566645159 /nfs/dbraw/zinc/64/51/59/566645159.db2.gz GEBPWLNVCUVHNS-AWEZNQCLSA-N 0 0 384.274 3.238 20 5 GGBDRN CC(=O)NCC[C@@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425453960 566645252 /nfs/dbraw/zinc/64/52/52/566645252.db2.gz CSDIDXJYNITQMA-ZDUSSCGKSA-N 0 0 384.274 3.096 20 5 GGBDRN Cc1sc(S(=O)(=O)N(CCc2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000467412701 566645401 /nfs/dbraw/zinc/64/54/01/566645401.db2.gz JSBPHVFXCYATCB-UHFFFAOYSA-N 0 0 384.454 3.500 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O=c1c(Cl)c(NC[C@@H]2CCCCS2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000541330891 566718895 /nfs/dbraw/zinc/71/88/95/566718895.db2.gz AAPRTWDYXLSPKH-ZDUSSCGKSA-N 0 0 380.857 3.492 20 5 GGBDRN CCc1nn(C)cc1-c1noc(-c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000426625878 566720788 /nfs/dbraw/zinc/72/07/88/566720788.db2.gz OWKYWCTVXLXJEA-UHFFFAOYSA-N 0 0 378.186 3.370 20 5 GGBDRN COc1ccc(CNc2ncnc3ccc(Br)cc32)cc1[N+](=O)[O-] ZINC000515590117 566721797 /nfs/dbraw/zinc/72/17/97/566721797.db2.gz GGGDDZFTJCQSLL-UHFFFAOYSA-N 0 0 389.209 3.343 20 5 GGBDRN CC[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](O)C(F)(F)F ZINC000541466995 566726093 /nfs/dbraw/zinc/72/60/93/566726093.db2.gz XQHHMDQVFPRULK-PRHODGIISA-N 0 0 386.779 3.158 20 5 GGBDRN COc1ccc(Br)cc1[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C(=O)[O-] ZINC000426741396 566727361 /nfs/dbraw/zinc/72/73/61/566727361.db2.gz FFPHBVLTSOYLRQ-HNNXBMFYSA-N 0 0 395.209 3.281 20 5 GGBDRN COc1ccc(Br)cc1[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C(=O)[O-] ZINC000426750137 566727845 /nfs/dbraw/zinc/72/78/45/566727845.db2.gz LJFQLFPSGJUVSY-HNNXBMFYSA-N 0 0 395.209 3.281 20 5 GGBDRN CN(CCc1ccccc1O)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000541504493 566728450 /nfs/dbraw/zinc/72/84/50/566728450.db2.gz WLDMVZRPIOVQRJ-UHFFFAOYSA-N 0 0 393.237 3.307 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] ZINC000515755331 566730205 /nfs/dbraw/zinc/73/02/05/566730205.db2.gz CSBXZSRZQOPDMV-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1csc(Br)c1 ZINC000426812750 566730603 /nfs/dbraw/zinc/73/06/03/566730603.db2.gz RWHOWHWAMCFJOQ-NSHDSACASA-N 0 0 385.239 3.204 20 5 GGBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(Br)cc1 ZINC000426787481 566731208 /nfs/dbraw/zinc/73/12/08/566731208.db2.gz FBMDIETXNMKIGQ-HNNXBMFYSA-N 0 0 379.210 3.143 20 5 GGBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cc(Br)cs1 ZINC000426815329 566732350 /nfs/dbraw/zinc/73/23/50/566732350.db2.gz KLYXPKZZJSNKSM-LBPRGKRZSA-N 0 0 385.239 3.204 20 5 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/nfs/dbraw/zinc/74/78/36/566747836.db2.gz RFIWZUWEIRGAMT-SNVBAGLBSA-N 0 0 377.260 3.168 20 5 GGBDRN CC(C)N(CC1CC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000609134242 566750863 /nfs/dbraw/zinc/75/08/63/566750863.db2.gz OZIXCCBKHJQRBA-UHFFFAOYSA-N 0 0 377.260 3.166 20 5 GGBDRN Cc1n[nH]c(C(=O)N(Cc2ccc(Br)cc2)C(C)C)c1[N+](=O)[O-] ZINC000609167244 566752426 /nfs/dbraw/zinc/75/24/26/566752426.db2.gz ZOPBVMDBYVFYOM-UHFFFAOYSA-N 0 0 381.230 3.440 20 5 GGBDRN CNS(=O)(=O)c1ccc(N2CC(C)(C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000581153477 566753463 /nfs/dbraw/zinc/75/34/63/566753463.db2.gz UMACHBWBDGWFIR-OAHLLOKOSA-N 0 0 381.479 3.152 20 5 GGBDRN COc1cc(S(=O)(=O)N2C[C@H](C)Sc3ccccc32)ccc1[N+](=O)[O-] ZINC000469030517 566754482 /nfs/dbraw/zinc/75/44/82/566754482.db2.gz RDAVEPRWUSHXQN-NSHDSACASA-N 0 0 380.447 3.293 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N1CC[C@H]1c1ccccc1 ZINC000488893925 566755263 /nfs/dbraw/zinc/75/52/63/566755263.db2.gz UQIJJJYVVRIULR-ZDUSSCGKSA-N 0 0 397.250 3.493 20 5 GGBDRN Cc1ccc(CN(C)S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000488919573 566757294 /nfs/dbraw/zinc/75/72/94/566757294.db2.gz PCPGAIYOMIJENM-UHFFFAOYSA-N 0 0 399.266 3.486 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@@H]2CCc3c2cccc3Cl)ccc1[N+](=O)[O-] ZINC000469058430 566757293 /nfs/dbraw/zinc/75/72/93/566757293.db2.gz VKLJQAKJLDXHEN-CQSZACIVSA-N 0 0 382.825 3.223 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@H](C)Sc3ccccc32)c([N+](=O)[O-])c1 ZINC000469069471 566759252 /nfs/dbraw/zinc/75/92/52/566759252.db2.gz VYHLVTPSJAUQGV-NSHDSACASA-N 0 0 380.447 3.293 20 5 GGBDRN O=[N+]([O-])c1ccn(CCN2CCOc3c(Cl)cc(Br)cc32)n1 ZINC000562049984 566760533 /nfs/dbraw/zinc/76/05/33/566760533.db2.gz JGTVLZHLSACMHE-UHFFFAOYSA-N 0 0 387.621 3.106 20 5 GGBDRN Cn1cc(Br)c(=O)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000541934380 566761401 /nfs/dbraw/zinc/76/14/01/566761401.db2.gz KEARNVWMKSPCKV-UHFFFAOYSA-N 0 0 392.165 3.055 20 5 GGBDRN CC[C@H]1CCCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000609418442 566763681 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O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC(n2cc(Br)cn2)CC1 ZINC000609455450 566765004 /nfs/dbraw/zinc/76/50/04/566765004.db2.gz NAXBLFFMOMKOEL-UHFFFAOYSA-N 0 0 397.204 3.170 20 5 GGBDRN O=C(NCc1cc2c(c(Br)c1)OCO2)c1cc(F)cc([N+](=O)[O-])c1 ZINC000609442818 566765240 /nfs/dbraw/zinc/76/52/40/566765240.db2.gz IRTKFFNNKQTSBD-UHFFFAOYSA-N 0 0 397.156 3.155 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(-c2ccc(=O)[nH]c2)no1 ZINC000516512256 566766298 /nfs/dbraw/zinc/76/62/98/566766298.db2.gz KWGSDOIRXIQDLK-UHFFFAOYSA-N 0 0 377.154 3.483 20 5 GGBDRN CCC[C@@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)OCC ZINC000516537036 566767095 /nfs/dbraw/zinc/76/70/95/566767095.db2.gz WWLGELSXSREFQP-JTQLQIEISA-N 0 0 387.230 3.067 20 5 GGBDRN CS(=O)(=O)c1ccc(NCc2nc3cc(Cl)ccc3[nH]2)c([N+](=O)[O-])c1 ZINC000609497170 566767408 /nfs/dbraw/zinc/76/74/08/566767408.db2.gz YCZCEYSTEGXXDM-UHFFFAOYSA-N 0 0 380.813 3.140 20 5 GGBDRN COc1ccc(NC(=O)[C@H]2COc3ccc(Br)cc32)cc1[N+](=O)[O-] ZINC000542003010 566767398 /nfs/dbraw/zinc/76/73/98/566767398.db2.gz NKFSHOYKLATGQO-LBPRGKRZSA-N 0 0 393.193 3.481 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCOc2ccc(Br)cc21 ZINC000427325779 566767617 /nfs/dbraw/zinc/76/76/17/566767617.db2.gz YXVJNOSLWLJVGO-UHFFFAOYSA-N 0 0 393.193 3.405 20 5 GGBDRN O=C(Nc1ccncc1Br)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000541996870 566767553 /nfs/dbraw/zinc/76/75/53/566767553.db2.gz NRLSKASCXHLWIF-UHFFFAOYSA-N 0 0 390.115 3.445 20 5 GGBDRN CO[C@H](C)CSc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000542003650 566768348 /nfs/dbraw/zinc/76/83/48/566768348.db2.gz BSZSAVZWPGLWPN-CYBMUJFWSA-N 0 0 388.511 3.287 20 5 GGBDRN CO[C@@H](C)CSc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000542003651 566768631 /nfs/dbraw/zinc/76/86/31/566768631.db2.gz BSZSAVZWPGLWPN-ZDUSSCGKSA-N 0 0 388.511 3.287 20 5 GGBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N(CC(F)(F)F)[C@H]1CCOC1 ZINC000469188363 566769464 /nfs/dbraw/zinc/76/94/64/566769464.db2.gz UZHVEIHCKJZXJD-VIFPVBQESA-N 0 0 397.147 3.151 20 5 GGBDRN Cc1cc(Br)ccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000609542395 566769704 /nfs/dbraw/zinc/76/97/04/566769704.db2.gz FCHHWLLOQSUBJJ-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN Cc1cc(Br)ccc1CNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000609542699 566770540 /nfs/dbraw/zinc/77/05/40/566770540.db2.gz WKYHHTGGPYSRQO-UHFFFAOYSA-N 0 0 385.239 3.144 20 5 GGBDRN O=c1oc2cc(Br)ccc2n1CCOc1ccccc1[N+](=O)[O-] ZINC000542049855 566772013 /nfs/dbraw/zinc/77/20/13/566772013.db2.gz BMXGAIHPVUVAKZ-UHFFFAOYSA-N 0 0 379.166 3.344 20 5 GGBDRN Cc1cccc2c1OC[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C2 ZINC000516608828 566772677 /nfs/dbraw/zinc/77/26/77/566772677.db2.gz UOHGWSZMGGEBMF-CQSZACIVSA-N 0 0 391.221 3.399 20 5 GGBDRN Cc1ccc(Cl)c(S(=O)(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000469257488 566776128 /nfs/dbraw/zinc/77/61/28/566776128.db2.gz JOYVWSWCZOXYTG-UHFFFAOYSA-N 0 0 382.825 3.009 20 5 GGBDRN COC[C@@H]1C[C@H](OC)CN1c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000489322401 566781272 /nfs/dbraw/zinc/78/12/72/566781272.db2.gz CEVYDSSDNNWQPK-RYUDHWBXSA-N 0 0 396.241 3.146 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCc2cc(Br)ccc21 ZINC000542209941 566782623 /nfs/dbraw/zinc/78/26/23/566782623.db2.gz MAUCSLAZJKLFDF-AWEZNQCLSA-N 0 0 393.237 3.160 20 5 GGBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCC[C@@H](OCC(F)(F)F)C1 ZINC000542212725 566782764 /nfs/dbraw/zinc/78/27/64/566782764.db2.gz LUCPBEXUJQQOIN-LLVKDONJSA-N 0 0 378.372 3.257 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCCc1cccc(Cl)c1 ZINC000516787832 566782938 /nfs/dbraw/zinc/78/29/38/566782938.db2.gz PWYYUKGJVOHXAF-UHFFFAOYSA-N 0 0 375.233 3.423 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCCc1ccc(Br)cc1 ZINC000609762609 566783484 /nfs/dbraw/zinc/78/34/84/566783484.db2.gz JWMDKBPCFFTMDX-UHFFFAOYSA-N 0 0 378.226 3.128 20 5 GGBDRN Cc1c(Br)c(=O)n(Cc2cccc(OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000542219101 566783676 /nfs/dbraw/zinc/78/36/76/566783676.db2.gz XCRJJISRIRXVRK-UHFFFAOYSA-N 0 0 396.241 3.448 20 5 GGBDRN Nc1c(C(=O)N2CCC[C@H]2c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000516805927 566784043 /nfs/dbraw/zinc/78/40/43/566784043.db2.gz FHIGZEZWDGMDNQ-ZDUSSCGKSA-N 0 0 391.225 3.312 20 5 GGBDRN COc1ccc(OCCCn2cc([N+](=O)[O-])c(C)c(Br)c2=O)cc1 ZINC000542218445 566784038 /nfs/dbraw/zinc/78/40/38/566784038.db2.gz SMWYIMTYZJJKBI-UHFFFAOYSA-N 0 0 397.225 3.305 20 5 GGBDRN CCc1cccc(OCCn2cc([N+](=O)[O-])c(C)c(Br)c2=O)c1 ZINC000542220458 566784146 /nfs/dbraw/zinc/78/41/46/566784146.db2.gz OZUNXFZVMVDIFO-UHFFFAOYSA-N 0 0 381.226 3.469 20 5 GGBDRN O=c1c2cc(Br)c(F)cc2ncn1Cc1ccc([N+](=O)[O-])cc1F ZINC000542219929 566784190 /nfs/dbraw/zinc/78/41/90/566784190.db2.gz DUOLWHIPTVOWFQ-UHFFFAOYSA-N 0 0 396.147 3.394 20 5 GGBDRN Cc1cccc(NC(=O)Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)c1C ZINC000542218798 566784245 /nfs/dbraw/zinc/78/42/45/566784245.db2.gz WORZTKQUTDUTLA-UHFFFAOYSA-N 0 0 394.225 3.083 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000542222313 566784265 /nfs/dbraw/zinc/78/42/65/566784265.db2.gz HGYXEMLSBPTEQC-UHFFFAOYSA-N 0 0 379.825 3.339 20 5 GGBDRN CCC[C@H](CCCS(C)(=O)=O)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000469345248 566784639 /nfs/dbraw/zinc/78/46/39/566784639.db2.gz SKOBSZDDAVABAE-GFCCVEGCSA-N 0 0 390.889 3.106 20 5 GGBDRN C[C@H](O)C[C@H](CNc1c(Br)cncc1[N+](=O)[O-])c1ccccc1 ZINC000516824148 566784688 /nfs/dbraw/zinc/78/46/88/566784688.db2.gz LICIGNLIGBTXMJ-WCQYABFASA-N 0 0 380.242 3.141 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1ccc(F)c(F)c1F ZINC000542238381 566785276 /nfs/dbraw/zinc/78/52/76/566785276.db2.gz CMRXGRASNGBTDU-UHFFFAOYSA-N 0 0 394.758 3.187 20 5 GGBDRN O=C(NCCc1ccc(Br)cc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000609771396 566785379 /nfs/dbraw/zinc/78/53/79/566785379.db2.gz BJEIXCLGOSPNJS-UHFFFAOYSA-N 0 0 392.253 3.442 20 5 GGBDRN CO[C@H]1CCN(Cc2cc(I)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000581517201 566785353 /nfs/dbraw/zinc/78/53/53/566785353.db2.gz SQQIFKCNDNXDLK-HZMBPMFUSA-N 0 0 390.221 3.199 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCS[C@H](c2ccccc2)C1 ZINC000609802085 566786479 /nfs/dbraw/zinc/78/64/79/566786479.db2.gz JNBQOVMJWKVGOD-INIZCTEOSA-N 0 0 378.475 3.382 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCS[C@H](c2ccccc2)C1 ZINC000609802370 566786682 /nfs/dbraw/zinc/78/66/82/566786682.db2.gz VGKIRIBNSNBEQQ-INIZCTEOSA-N 0 0 378.475 3.382 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCS[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000609802426 566787282 /nfs/dbraw/zinc/78/72/82/566787282.db2.gz ZHYVBJILYSZMBJ-KRWDZBQOSA-N 0 0 378.475 3.382 20 5 GGBDRN O=[N+]([O-])c1ccc(NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)s1 ZINC000609802564 566787417 /nfs/dbraw/zinc/78/74/17/566787417.db2.gz JCLIKBZZKUXNAH-UHFFFAOYSA-N 0 0 381.479 3.063 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCOC2CCCCCC2)c(Cl)c1 ZINC000609824576 566787899 /nfs/dbraw/zinc/78/78/99/566787899.db2.gz GJJHLKOHONXWBA-UHFFFAOYSA-N 0 0 376.862 3.266 20 5 GGBDRN C[C@@H]1SCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000609825432 566787922 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CCOC(=O)CC(C)(C)N(C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000490341363 566844258 /nfs/dbraw/zinc/84/42/58/566844258.db2.gz FIFPTTSMGRMJKX-UHFFFAOYSA-N 0 0 387.230 3.161 20 5 GGBDRN CC[C@H](C[NH+]1CCCC1)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000610576945 566844736 /nfs/dbraw/zinc/84/47/36/566844736.db2.gz KIYKROSMNBTDBC-LLVKDONJSA-N 0 0 396.296 3.054 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC[C@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000517736334 566845702 /nfs/dbraw/zinc/84/57/02/566845702.db2.gz QUSDNQFSENJAPN-ZDUSSCGKSA-N 0 0 381.841 3.130 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2c(F)c(F)cc(F)c2F)c(Cl)c1 ZINC000610591647 566846826 /nfs/dbraw/zinc/84/68/26/566846826.db2.gz CEJYLBGDKPTUQH-UHFFFAOYSA-N 0 0 398.721 3.283 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NCCOc1cccc(Cl)c1Cl ZINC000517769987 566847078 /nfs/dbraw/zinc/84/70/78/566847078.db2.gz ITXGDQYTOVRJHE-UHFFFAOYSA-N 0 0 391.232 3.259 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1c(F)c(F)cc(F)c1F ZINC000610591696 566847344 /nfs/dbraw/zinc/84/73/44/566847344.db2.gz NOALPQKNANOJHA-UHFFFAOYSA-N 0 0 398.721 3.283 20 5 GGBDRN COCc1cc(Cl)cc(S(=O)(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000451590551 566847371 /nfs/dbraw/zinc/84/73/71/566847371.db2.gz YWAMXBUFXCBMBS-NSHDSACASA-N 0 0 384.841 3.434 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000610599353 566847379 /nfs/dbraw/zinc/84/73/79/566847379.db2.gz VIMFYMGLXHTCRP-NSHDSACASA-N 0 0 381.230 3.130 20 5 GGBDRN Cc1ccoc1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000490409742 566847727 /nfs/dbraw/zinc/84/77/27/566847727.db2.gz FRBPFUOSAGMYIQ-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN CCSc1cccc(CNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000490425998 566848475 /nfs/dbraw/zinc/84/84/75/566848475.db2.gz JDMWKTMIDDCASA-UHFFFAOYSA-N 0 0 380.491 3.369 20 5 GGBDRN COC(=O)[C@@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000470135730 566849758 /nfs/dbraw/zinc/84/97/58/566849758.db2.gz ZCFXPUSWSAUCNK-HZMBPMFUSA-N 0 0 380.447 3.167 20 5 GGBDRN Cc1cc(N2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c(Br)cc1[N+](=O)[O-] ZINC000517847257 566850298 /nfs/dbraw/zinc/85/02/98/566850298.db2.gz ZJNUWCFXENOPRF-MKBNYLNASA-N 0 0 385.258 3.438 20 5 GGBDRN C[C@H](Cc1ccccc1Br)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000470159479 566851156 /nfs/dbraw/zinc/85/11/56/566851156.db2.gz YMQOYERPSZWLEE-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN O=[N+]([O-])c1ccc(CNc2cnc(N3CCOCC3)c(Br)c2)cc1 ZINC000543075577 566851375 /nfs/dbraw/zinc/85/13/75/566851375.db2.gz FSDGJNKYOXLQFM-UHFFFAOYSA-N 0 0 393.241 3.201 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCC[C@H]2c2ccccc2Br)c1[N+](=O)[O-] ZINC000610672356 566853117 /nfs/dbraw/zinc/85/31/17/566853117.db2.gz FHFMDPOYIMRXBT-LBPRGKRZSA-N 0 0 379.214 3.366 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@H]1COc2c1cccc2Cl ZINC000610711746 566855852 /nfs/dbraw/zinc/85/58/52/566855852.db2.gz BDYJWPBBYSRSEO-NSHDSACASA-N 0 0 389.216 3.314 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1COc2c1cccc2Cl ZINC000610711753 566856535 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O=C(c1ccc(Br)s1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470311015 566863647 /nfs/dbraw/zinc/86/36/47/566863647.db2.gz WZQUJTAGCLIHSF-UHFFFAOYSA-N 0 0 383.223 3.322 20 5 GGBDRN CO[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C)c1ccccc1Cl ZINC000610786541 566863960 /nfs/dbraw/zinc/86/39/60/566863960.db2.gz FPEGKRSMZOGESI-OAHLLOKOSA-N 0 0 384.841 3.223 20 5 GGBDRN COCCOc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000518081142 566865501 /nfs/dbraw/zinc/86/55/01/566865501.db2.gz SRRUHQDANWFWCT-UHFFFAOYSA-N 0 0 386.813 3.074 20 5 GGBDRN CS(=O)(=O)c1ccc(CNc2ncc(Cl)cc2[N+](=O)[O-])cc1Cl ZINC000428665434 566866218 /nfs/dbraw/zinc/86/62/18/566866218.db2.gz OSSDRYLGGZAZRK-UHFFFAOYSA-N 0 0 376.221 3.312 20 5 GGBDRN Nc1c(F)c(NC[C@H](CO)Cc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000428666210 566866239 /nfs/dbraw/zinc/86/62/39/566866239.db2.gz GXTKMJBVVHWWAQ-LLVKDONJSA-N 0 0 398.232 3.342 20 5 GGBDRN Cc1c(Br)c(N(C)Cc2cn3c(n2)CCCC3)ncc1[N+](=O)[O-] ZINC000428662940 566866322 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CC(C)(CCNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C1CC1 ZINC000490607702 566869601 /nfs/dbraw/zinc/86/96/01/566869601.db2.gz QGIUYKFTPUAUKA-UHFFFAOYSA-N 0 0 398.257 3.238 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@@]1(CO)C[C@H]1c1ccc(F)cc1 ZINC000428689001 566869503 /nfs/dbraw/zinc/86/95/03/566869503.db2.gz IEVOGPAHVUYFOG-XJKSGUPXSA-N 0 0 396.216 3.470 20 5 GGBDRN CSC[C@H]1CCCN(S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)C1 ZINC000490624473 566872584 /nfs/dbraw/zinc/87/25/84/566872584.db2.gz AVOUKBVIKUWKQE-NSHDSACASA-N 0 0 378.903 3.320 20 5 GGBDRN Cc1sc(C(N)=O)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610887040 566872986 /nfs/dbraw/zinc/87/29/86/566872986.db2.gz LPOZQLFBULNGDT-SSDOTTSWSA-N 0 0 383.813 3.123 20 5 GGBDRN C[C@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H](C(F)(F)F)O1 ZINC000610906200 566873523 /nfs/dbraw/zinc/87/35/23/566873523.db2.gz XMANYDUYVAQADU-WRWORJQWSA-N 0 0 397.147 3.149 20 5 GGBDRN Cc1sc(C(N)=O)cc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000610911786 566873713 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O=C(N[C@H]1CCN(c2cccc(Br)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000470459812 566875596 /nfs/dbraw/zinc/87/55/96/566875596.db2.gz RWZMRIVMJJDXEW-AWEZNQCLSA-N 0 0 390.237 3.366 20 5 GGBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NC(C)(C)COc1ncc(Cl)cc1Cl ZINC000610934352 566876039 /nfs/dbraw/zinc/87/60/39/566876039.db2.gz GAWXVAYOJAXYGP-UHFFFAOYSA-N 0 0 387.223 3.223 20 5 GGBDRN NC(=O)c1ccc(N2CCc3sc(Br)cc3C2)c([N+](=O)[O-])c1 ZINC000610929932 566876186 /nfs/dbraw/zinc/87/61/86/566876186.db2.gz SRUBDBGUKCLWCF-UHFFFAOYSA-N 0 0 382.239 3.080 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCc3sc(Br)cc3C2)c1[N+](=O)[O-] ZINC000610938042 566876255 /nfs/dbraw/zinc/87/62/55/566876255.db2.gz BACLGODKMSCIET-UHFFFAOYSA-N 0 0 399.270 3.293 20 5 GGBDRN Nc1c(C(=O)N2CCc3sc(Br)cc3C2)cccc1[N+](=O)[O-] ZINC000610938041 566876299 /nfs/dbraw/zinc/87/62/99/566876299.db2.gz ATBBADKHBUNQNO-UHFFFAOYSA-N 0 0 382.239 3.200 20 5 GGBDRN CN(CCc1cccc(Br)c1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000428767787 566876402 /nfs/dbraw/zinc/87/64/02/566876402.db2.gz XYUWJJUXSOKSAE-UHFFFAOYSA-N 0 0 378.226 3.254 20 5 GGBDRN CN(CCOC(C)(C)C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000610957886 566877348 /nfs/dbraw/zinc/87/73/48/566877348.db2.gz VIVBFBPJNDVZDM-UHFFFAOYSA-N 0 0 384.376 3.049 20 5 GGBDRN Cc1ccc2c(c1)N(S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)CC2 ZINC000610954015 566877505 /nfs/dbraw/zinc/87/75/05/566877505.db2.gz RFRXKEQYJRMZER-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CCCCc1cc(=NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)[nH][nH]1 ZINC000490717071 566877638 /nfs/dbraw/zinc/87/76/38/566877638.db2.gz JJLGPHIZFOBTPV-UHFFFAOYSA-N 0 0 381.230 3.406 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1CN[C@@H](CO)c1ccc(Br)cc1 ZINC000428785933 566877840 /nfs/dbraw/zinc/87/78/40/566877840.db2.gz MPGOHIDXNZPQMM-HNNXBMFYSA-N 0 0 381.226 3.189 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CNc1ccc(I)cc1Cl ZINC000470525874 566880483 /nfs/dbraw/zinc/88/04/83/566880483.db2.gz LWAPATZIRPEQMY-UHFFFAOYSA-N 0 0 392.584 3.198 20 5 GGBDRN Cc1c(Br)c(NCc2ccnc(N3CCCC3)c2)ncc1[N+](=O)[O-] ZINC000543434737 566880476 /nfs/dbraw/zinc/88/04/76/566880476.db2.gz IFVPEJDKWMJKHH-UHFFFAOYSA-N 0 0 392.257 3.090 20 5 GGBDRN O=[N+]([O-])c1cccc2ncnc(NCc3ccc(Br)c(F)c3)c21 ZINC000543434519 566880523 /nfs/dbraw/zinc/88/05/23/566880523.db2.gz WPWHMADUPOOSAJ-UHFFFAOYSA-N 0 0 377.173 3.474 20 5 GGBDRN Cc1c(Br)c(NCCCc2nc3ccccc3[nH]2)ncc1[N+](=O)[O-] ZINC000543435422 566880710 /nfs/dbraw/zinc/88/07/10/566880710.db2.gz SFHLGXWXPAKLJD-UHFFFAOYSA-N 0 0 390.241 3.404 20 5 GGBDRN Cc1c(Br)c(N2CC[C@H](OCc3ccccn3)C2)ncc1[N+](=O)[O-] ZINC000543436105 566880853 /nfs/dbraw/zinc/88/08/53/566880853.db2.gz GKXOEXFHVSJGAM-ZDUSSCGKSA-N 0 0 393.241 3.251 20 5 GGBDRN COc1ccc(CNc2ncnc3cccc([N+](=O)[O-])c32)cc1Br ZINC000543437062 566881944 /nfs/dbraw/zinc/88/19/44/566881944.db2.gz QGWJQKRTWLWHNQ-UHFFFAOYSA-N 0 0 389.209 3.343 20 5 GGBDRN Cc1c(Br)c(N2CCC[C@@H](c3ccnn3C)C2)ncc1[N+](=O)[O-] ZINC000543449419 566882006 /nfs/dbraw/zinc/88/20/06/566882006.db2.gz KKESSRCQKOAYMB-LLVKDONJSA-N 0 0 380.246 3.178 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCOC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000490847959 566882579 /nfs/dbraw/zinc/88/25/79/566882579.db2.gz KQGZJHTWBZRWJB-WQVCFCJDSA-N 0 0 385.258 3.114 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(c2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000543436948 566882984 /nfs/dbraw/zinc/88/29/84/566882984.db2.gz DCYUAVIOISCLIV-GFCCVEGCSA-N 0 0 399.289 3.193 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@H]1c1ccc(O)cc1 ZINC000611019721 566883548 /nfs/dbraw/zinc/88/35/48/566883548.db2.gz CTSAQDGYQSVBMA-AWEZNQCLSA-N 0 0 382.825 3.480 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccc(O)cc2)c(Cl)c1 ZINC000611020051 566883842 /nfs/dbraw/zinc/88/38/42/566883842.db2.gz VDEKZQICGFLQRI-OAHLLOKOSA-N 0 0 382.825 3.480 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCOC[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000611072791 566885422 /nfs/dbraw/zinc/88/54/22/566885422.db2.gz NLMXSGURMRCKFN-CQSZACIVSA-N 0 0 395.209 3.472 20 5 GGBDRN Cc1cccnc1C(C)(C)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000563483871 566886981 /nfs/dbraw/zinc/88/69/81/566886981.db2.gz UAARYASJWYJVIC-UHFFFAOYSA-N 0 0 383.857 3.208 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC[C@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000611076072 566886962 /nfs/dbraw/zinc/88/69/62/566886962.db2.gz JAYHYLYZJQKRNF-ZDUSSCGKSA-N 0 0 393.241 3.340 20 5 GGBDRN Cc1c(Br)cc(C(=O)N=c2cc(C(C)(C)C)[nH][nH]2)cc1[N+](=O)[O-] ZINC000611078421 566887279 /nfs/dbraw/zinc/88/72/79/566887279.db2.gz VREUSALSEYGQAD-UHFFFAOYSA-N 0 0 381.230 3.361 20 5 GGBDRN COc1ccc2nc(NC(=O)CSc3ncccc3[N+](=O)[O-])sc2c1 ZINC000518520741 566887311 /nfs/dbraw/zinc/88/73/11/566887311.db2.gz GBPOHVUNZJYLFJ-UHFFFAOYSA-N 0 0 376.419 3.339 20 5 GGBDRN Cc1sc(C(N)=O)cc1NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000611075558 566887986 /nfs/dbraw/zinc/88/79/86/566887986.db2.gz HPBZHUCFDUPVID-UHFFFAOYSA-N 0 0 398.238 3.387 20 5 GGBDRN O=C(CN1CCN(c2ccsc2[N+](=O)[O-])CC1)Nc1ccc(Cl)cc1 ZINC000611116670 566891092 /nfs/dbraw/zinc/89/10/92/566891092.db2.gz IVTIPCWVFAOCQQ-UHFFFAOYSA-N 0 0 380.857 3.070 20 5 GGBDRN CCn1cc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2Cl)c([N+](=O)[O-])n1 ZINC000611107603 566891496 /nfs/dbraw/zinc/89/14/96/566891496.db2.gz WAZYTYQAIHJTKK-QMMMGPOBSA-N 0 0 393.252 3.158 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C)O[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000470688492 566894517 /nfs/dbraw/zinc/89/45/17/566894517.db2.gz GKVUOFFXQPXPKM-PSLIRLAXSA-N 0 0 383.242 3.305 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@H](C)O[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000470688491 566894969 /nfs/dbraw/zinc/89/49/69/566894969.db2.gz GKVUOFFXQPXPKM-BJOHPYRUSA-N 0 0 383.242 3.305 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H]2CCCN(S(=O)(=O)c3cncc(Cl)c3)C2)cc1 ZINC000451852095 566895559 /nfs/dbraw/zinc/89/55/59/566895559.db2.gz NIDSTILIZQBCQG-CYBMUJFWSA-N 0 0 381.841 3.212 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2ncccc2Br)c1 ZINC000543640219 566896352 /nfs/dbraw/zinc/89/63/52/566896352.db2.gz UYYWGDAAWSWUCV-UHFFFAOYSA-N 0 0 386.227 3.170 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(I)cc1 ZINC000518640163 566897196 /nfs/dbraw/zinc/89/71/96/566897196.db2.gz VSFJSUCPZACOLR-UHFFFAOYSA-N 0 0 397.172 3.250 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)NC[C@@H]2COc3ccccc32)cc1[N+](=O)[O-] ZINC000582807968 566897188 /nfs/dbraw/zinc/89/71/88/566897188.db2.gz FAATZKPEJNZMDQ-LLVKDONJSA-N 0 0 382.825 3.011 20 5 GGBDRN CSc1ccc(C(=O)NC[C@@H](CO)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000563567583 566897320 /nfs/dbraw/zinc/89/73/20/566897320.db2.gz ZDLHMPAHIDGWDS-LBPRGKRZSA-N 0 0 380.853 3.476 20 5 GGBDRN C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000518705432 566899357 /nfs/dbraw/zinc/89/93/57/566899357.db2.gz ZZDCWQBTRSWBRG-UWVGGRQHSA-N 0 0 377.260 3.024 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)O[C@H](C(F)(F)F)C1 ZINC000611210812 566899676 /nfs/dbraw/zinc/89/96/76/566899676.db2.gz HAQILUNUBPPYCX-ZANVPECISA-N 0 0 378.372 3.499 20 5 GGBDRN CS[C@H](CO)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611213514 566900045 /nfs/dbraw/zinc/90/00/45/566900045.db2.gz YHDISLGAGUELOF-BDJLRTHQSA-N 0 0 384.523 3.472 20 5 GGBDRN O=C(Nc1cc(Br)c[nH]c1=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000518711822 566900105 /nfs/dbraw/zinc/90/01/05/566900105.db2.gz UWFHRKJCTAVMBY-UHFFFAOYSA-N 0 0 378.138 3.456 20 5 GGBDRN O=C(NC[C@@H](O)COc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])s1 ZINC000518726974 566900138 /nfs/dbraw/zinc/90/01/38/566900138.db2.gz FADXDQSSBUUUGL-MRVPVSSYSA-N 0 0 391.232 3.133 20 5 GGBDRN CS[C@H](CO)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611213516 566900342 /nfs/dbraw/zinc/90/03/42/566900342.db2.gz YHDISLGAGUELOF-MEDUHNTESA-N 0 0 384.523 3.472 20 5 GGBDRN O=C(NCCSCCCO)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611212557 566900580 /nfs/dbraw/zinc/90/05/80/566900580.db2.gz NGEJMBODXYRRLP-UHFFFAOYSA-N 0 0 384.523 3.475 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H](O)C(F)(F)F ZINC000543679229 566900727 /nfs/dbraw/zinc/90/07/27/566900727.db2.gz BWULAQYEAWKWKI-ZDUSSCGKSA-N 0 0 380.388 3.482 20 5 GGBDRN CCCN(CC(C)C)S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000518714082 566900768 /nfs/dbraw/zinc/90/07/68/566900768.db2.gz UIIJESMYUANTRF-UHFFFAOYSA-N 0 0 379.276 3.414 20 5 GGBDRN CSC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611215932 566900942 /nfs/dbraw/zinc/90/09/42/566900942.db2.gz QTGMCAXDJBCSTP-GFCCVEGCSA-N 0 0 384.523 3.473 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H](O)C(F)(F)F ZINC000543681637 566901074 /nfs/dbraw/zinc/90/10/74/566901074.db2.gz OCBQGMOZHYCENO-ZDUSSCGKSA-N 0 0 380.388 3.338 20 5 GGBDRN C[C@@H](Cc1ccccc1Br)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000470751058 566901520 /nfs/dbraw/zinc/90/15/20/566901520.db2.gz ZCZWBQLKXBSBRE-VIFPVBQESA-N 0 0 396.216 3.440 20 5 GGBDRN COC(=O)c1cc(NC(=O)C(=O)c2ccc(Cl)s2)c(C)c([N+](=O)[O-])c1 ZINC000429022905 566901514 /nfs/dbraw/zinc/90/15/14/566901514.db2.gz AIMAMWFTQHWCSY-UHFFFAOYSA-N 0 0 382.781 3.226 20 5 GGBDRN CC[C@@H](Cc1ccccc1Br)NC(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000470759399 566901663 /nfs/dbraw/zinc/90/16/63/566901663.db2.gz FHGGEFYBQSLMAV-NSHDSACASA-N 0 0 381.230 3.140 20 5 GGBDRN O=C(N[C@@H]1CCC(F)(F)C1)c1cc(I)cc([N+](=O)[O-])c1 ZINC000611223279 566901998 /nfs/dbraw/zinc/90/19/98/566901998.db2.gz LITGMRPXOFICRV-SECBINFHSA-N 0 0 396.131 3.117 20 5 GGBDRN C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccccc1 ZINC000543686458 566902067 /nfs/dbraw/zinc/90/20/67/566902067.db2.gz PFHZPANVGYNESL-LLVKDONJSA-N 0 0 399.266 3.439 20 5 GGBDRN COc1ccc(CN(C)c2c(Br)cncc2[N+](=O)[O-])cc1OC ZINC000611227328 566902684 /nfs/dbraw/zinc/90/26/84/566902684.db2.gz NIKLDIYZYLIRQH-UHFFFAOYSA-N 0 0 382.214 3.406 20 5 GGBDRN Cc1cc(S(=O)(=O)NCCc2nc3ccccc3s2)ccc1[N+](=O)[O-] ZINC000470774072 566903098 /nfs/dbraw/zinc/90/30/98/566903098.db2.gz RKVAZBNYCJYHBE-UHFFFAOYSA-N 0 0 377.447 3.034 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCc1nc2ccccc2s1 ZINC000470777616 566903116 /nfs/dbraw/zinc/90/31/16/566903116.db2.gz YGRGHFJTGJBQBN-UHFFFAOYSA-N 0 0 377.447 3.034 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC3(CO)CCC3)cc2[N+](=O)[O-])n1 ZINC000611245906 566903684 /nfs/dbraw/zinc/90/36/84/566903684.db2.gz ADVIJQWVALAQMF-UHFFFAOYSA-N 0 0 379.463 3.156 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCc1nc2ccccc2s1 ZINC000470775558 566903835 /nfs/dbraw/zinc/90/38/35/566903835.db2.gz ZIOKHGVJSVIWKC-UHFFFAOYSA-N 0 0 377.447 3.034 20 5 GGBDRN O=C(COc1cc(Cl)ccc1Cl)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000518829587 566906135 /nfs/dbraw/zinc/90/61/35/566906135.db2.gz NKMADPBKYWVBFX-UHFFFAOYSA-N 0 0 385.203 3.476 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCNc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000491444832 566906466 /nfs/dbraw/zinc/90/64/66/566906466.db2.gz PGNSEGXQZLTFMY-UHFFFAOYSA-N 0 0 396.245 3.046 20 5 GGBDRN Cc1ccncc1[C@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000611299551 566907226 /nfs/dbraw/zinc/90/72/26/566907226.db2.gz FAADMLXDDGDJCE-NSHDSACASA-N 0 0 378.226 3.481 20 5 GGBDRN CCS[C@@H]1CC[C@H](N(C)S(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)C1 ZINC000491512142 566907821 /nfs/dbraw/zinc/90/78/21/566907821.db2.gz MIOFPIYPALENAT-WDEREUQCSA-N 0 0 392.474 3.037 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCSC2(CCC2)CC1 ZINC000582952908 566908904 /nfs/dbraw/zinc/90/89/04/566908904.db2.gz CAYJXKBZPDHRPK-UHFFFAOYSA-N 0 0 376.887 3.299 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2nnc(-c3cccc(Br)c3)o2)c1 ZINC000470852764 566909666 /nfs/dbraw/zinc/90/96/66/566909666.db2.gz ZZGNGEABKFLXTG-UHFFFAOYSA-N 0 0 396.226 3.396 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCOc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000491546948 566910064 /nfs/dbraw/zinc/91/00/64/566910064.db2.gz OCODOALANSWIKM-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000491578319 566910076 /nfs/dbraw/zinc/91/00/76/566910076.db2.gz FRSVUZWEVBZWNZ-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN CC(C)(CNC(=O)Nc1ccncc1[N+](=O)[O-])c1ccccc1Br ZINC000543766132 566910059 /nfs/dbraw/zinc/91/00/59/566910059.db2.gz PXQQKEHTGZDQIH-UHFFFAOYSA-N 0 0 393.241 3.274 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC(c3cccc(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000451934680 566910851 /nfs/dbraw/zinc/91/08/51/566910851.db2.gz WGIAPNDZILGSEN-UHFFFAOYSA-N 0 0 382.825 3.045 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1Cc2cc(Br)ccc2O1 ZINC000470867916 566911100 /nfs/dbraw/zinc/91/11/00/566911100.db2.gz HAGMLBRRCDOGLR-AWEZNQCLSA-N 0 0 381.157 3.439 20 5 GGBDRN CC(C)(C)S(=O)(=O)N1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000491582042 566911071 /nfs/dbraw/zinc/91/10/71/566911071.db2.gz STFQKLWTYVQXDC-UHFFFAOYSA-N 0 0 375.878 3.253 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@H]1C1CCC1 ZINC000518983887 566912397 /nfs/dbraw/zinc/91/23/97/566912397.db2.gz WKKUIZQGEMEFCC-OAHLLOKOSA-N 0 0 383.242 3.307 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000611343418 566912439 /nfs/dbraw/zinc/91/24/39/566912439.db2.gz GNEIYHIJBSWGFI-QWHCGFSZSA-N 0 0 388.873 3.076 20 5 GGBDRN CCc1nn(C)c(N2CCc3cc(Br)cc(F)c3C2)c1[N+](=O)[O-] ZINC000611373393 566912708 /nfs/dbraw/zinc/91/27/08/566912708.db2.gz UJQWLNUNSWUYED-UHFFFAOYSA-N 0 0 383.221 3.355 20 5 GGBDRN Cc1cc(Br)oc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470888206 566912993 /nfs/dbraw/zinc/91/29/93/566912993.db2.gz KMNUHOBBSKCFPC-UHFFFAOYSA-N 0 0 381.182 3.162 20 5 GGBDRN CNC(=O)c1ccc(N(C)Cc2ccc(Br)c(F)c2)c([N+](=O)[O-])c1 ZINC000491613018 566913127 /nfs/dbraw/zinc/91/31/27/566913127.db2.gz NOEXLZUMNRCPKV-UHFFFAOYSA-N 0 0 396.216 3.492 20 5 GGBDRN CC(C)(C)OC(=O)CCCCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000611343083 566913113 /nfs/dbraw/zinc/91/31/13/566913113.db2.gz RJEDMAZXWXIDAV-UHFFFAOYSA-N 0 0 392.861 3.039 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H](CCO)c1ccccc1Br ZINC000543834983 566914047 /nfs/dbraw/zinc/91/40/47/566914047.db2.gz KEHXOJKFHNGKDP-MRXNPFEDSA-N 0 0 393.237 3.140 20 5 GGBDRN O=C(N[C@@H](CCO)c1ccccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000543837705 566914656 /nfs/dbraw/zinc/91/46/56/566914656.db2.gz IHWPQEKHZQELCY-HNNXBMFYSA-N 0 0 379.210 3.211 20 5 GGBDRN CN(C(=O)c1cn2ccc(Br)cc2n1)c1cccc([N+](=O)[O-])c1 ZINC000563769667 566915924 /nfs/dbraw/zinc/91/59/24/566915924.db2.gz GXGNXLTYBXZXDA-UHFFFAOYSA-N 0 0 375.182 3.282 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNc2sccc2[N+](=O)[O-])s1 ZINC000611411397 566916667 /nfs/dbraw/zinc/91/66/67/566916667.db2.gz RMLGTJKZYWPTSZ-UHFFFAOYSA-N 0 0 375.497 3.360 20 5 GGBDRN COc1ccc(NC(=O)c2cc(Br)cnc2N(C)C)cc1[N+](=O)[O-] ZINC000543857227 566917830 /nfs/dbraw/zinc/91/78/30/566917830.db2.gz ZPMOBURLLZVLSP-UHFFFAOYSA-N 0 0 395.213 3.079 20 5 GGBDRN C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543859193 566917990 /nfs/dbraw/zinc/91/79/90/566917990.db2.gz NMNFBBWGBVQTPW-NSHDSACASA-N 0 0 383.857 3.089 20 5 GGBDRN Cn1cc([C@H]2N(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)CC2(C)C)cn1 ZINC000583089202 566920293 /nfs/dbraw/zinc/92/02/93/566920293.db2.gz MUDVLGHWVYGXEM-CQSZACIVSA-N 0 0 393.241 3.314 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN1CC(C)(C)N(C)c2ccc(Br)cc21 ZINC000471008846 566921904 /nfs/dbraw/zinc/92/19/04/566921904.db2.gz UOFZLFTZPKTSTM-UHFFFAOYSA-N 0 0 394.273 3.326 20 5 GGBDRN O=C(NC[C@H]1COc2ccccc21)c1ccc(Br)cc1[N+](=O)[O-] ZINC000563840819 566921954 /nfs/dbraw/zinc/92/19/54/566921954.db2.gz GQLPBVWQSAHSFT-JTQLQIEISA-N 0 0 377.194 3.263 20 5 GGBDRN Cc1[nH]nc(C(F)(F)F)c1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000611505727 566922349 /nfs/dbraw/zinc/92/23/49/566922349.db2.gz NFURVKZGZTVQBV-UHFFFAOYSA-N 0 0 376.722 3.271 20 5 GGBDRN CC(C)(CNc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000563846592 566923593 /nfs/dbraw/zinc/92/35/93/566923593.db2.gz GVPISIYGBAVQLK-UHFFFAOYSA-N 0 0 393.241 3.241 20 5 GGBDRN NS(=O)(=O)c1ccc(CCNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])cc1 ZINC000429332662 566924115 /nfs/dbraw/zinc/92/41/15/566924115.db2.gz KBMCBPGJIXHIJZ-UHFFFAOYSA-N 0 0 390.248 3.204 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCCCc1cccc(Br)c1 ZINC000611528067 566925619 /nfs/dbraw/zinc/92/56/19/566925619.db2.gz AMWLIEDJTQHWNX-UHFFFAOYSA-N 0 0 378.226 3.302 20 5 GGBDRN O=[N+]([O-])c1cc(F)ccc1Nc1cnc(N2CCOCC2)c(Br)c1 ZINC000543991914 566926677 /nfs/dbraw/zinc/92/66/77/566926677.db2.gz FZPWHYALCDGDHY-UHFFFAOYSA-N 0 0 397.204 3.472 20 5 GGBDRN COc1ccc(NC(=O)[C@@H]2Cc3cc(Br)ccc3O2)cc1[N+](=O)[O-] ZINC000471089585 566927375 /nfs/dbraw/zinc/92/73/75/566927375.db2.gz UHXHTEYWBGEDOM-HNNXBMFYSA-N 0 0 393.193 3.308 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@]2(CCSC2)C1 ZINC000452057126 566928307 /nfs/dbraw/zinc/92/83/07/566928307.db2.gz VIGKPMYRZNJTLG-AWEZNQCLSA-N 0 0 376.887 3.156 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N[C@H](C)C[C@@H](C)O)cc2[N+](=O)[O-])n1 ZINC000544027874 566929694 /nfs/dbraw/zinc/92/96/94/566929694.db2.gz QSRUXAQQYLNTLG-MWLCHTKSSA-N 0 0 381.479 3.400 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)Cc1csc2ccc(Br)cc12 ZINC000471132664 566932037 /nfs/dbraw/zinc/93/20/37/566932037.db2.gz GEJUTAJUZGBZHB-UHFFFAOYSA-N 0 0 395.238 3.487 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)CC ZINC000544049065 566932895 /nfs/dbraw/zinc/93/28/95/566932895.db2.gz KYCKRKWQBNPGIF-MEBBXXQBSA-N 0 0 388.873 3.434 20 5 GGBDRN Cc1ccc(C)c(NC(=O)Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)c1 ZINC000544079549 566935869 /nfs/dbraw/zinc/93/58/69/566935869.db2.gz LZSUBBDSNHCEHL-UHFFFAOYSA-N 0 0 394.225 3.083 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CCC1(F)F ZINC000564005405 566936141 /nfs/dbraw/zinc/93/61/41/566936141.db2.gz NJMNDZSBGPMWRM-MRVPVSSYSA-N 0 0 399.213 3.023 20 5 GGBDRN CN(Cc1ccc(Cl)cc1Cl)c1cc([N+](=O)[O-])ccc1S(N)(=O)=O ZINC000611739124 566936300 /nfs/dbraw/zinc/93/63/00/566936300.db2.gz XATJJMQZFXKLDJ-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCCc1nc2c(s1)CCCC2 ZINC000544091469 566937042 /nfs/dbraw/zinc/93/70/42/566937042.db2.gz RNVUGIHFGUQUSI-UHFFFAOYSA-N 0 0 377.491 3.381 20 5 GGBDRN C[C@]1(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)OCCc2sccc21 ZINC000583294256 566937608 /nfs/dbraw/zinc/93/76/08/566937608.db2.gz YKYHCFVEOZTKCA-QGZVFWFLSA-N 0 0 378.475 3.353 20 5 GGBDRN C[C@@]1(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)OCCc2sccc21 ZINC000583294255 566938038 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CC(C)CCc1cc(=NC(=O)c2ccc([N+](=O)[O-])cc2Br)[nH][nH]1 ZINC000471413063 566952039 /nfs/dbraw/zinc/95/20/39/566952039.db2.gz WDQSSBXOJRINSQ-UHFFFAOYSA-N 0 0 381.230 3.343 20 5 GGBDRN COCCN(Cc1cccs1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000493675063 566952461 /nfs/dbraw/zinc/95/24/61/566952461.db2.gz GBNJLQMGQAEUBO-UHFFFAOYSA-N 0 0 384.479 3.110 20 5 GGBDRN COc1ccc(CNS(=O)(=O)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000429829048 566954340 /nfs/dbraw/zinc/95/43/40/566954340.db2.gz GGMVRNDPWORXQA-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000612164907 566958192 /nfs/dbraw/zinc/95/81/92/566958192.db2.gz IPRHDZLOPTZNIC-SNVBAGLBSA-N 0 0 391.287 3.414 20 5 GGBDRN CCCN(CCC)S(=O)(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000519678837 566958588 /nfs/dbraw/zinc/95/85/88/566958588.db2.gz VEMOIFFAHHEYOX-UHFFFAOYSA-N 0 0 383.392 3.070 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H](C)S1(=O)=O ZINC000519674609 566958720 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Cc1cc(Br)c(F)cc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000471562315 566960847 /nfs/dbraw/zinc/96/08/47/566960847.db2.gz HDVSIUOJHKNRBP-UHFFFAOYSA-N 0 0 385.193 3.375 20 5 GGBDRN Cc1ccn2cc(CNc3ncc([N+](=O)[O-])c(C)c3Br)nc2c1 ZINC000544410289 566961136 /nfs/dbraw/zinc/96/11/36/566961136.db2.gz DJALJVCAAXOTRQ-UHFFFAOYSA-N 0 0 376.214 3.051 20 5 GGBDRN Cc1c(Br)c(NCc2cccc(-c3ncc[nH]3)c2)ncc1[N+](=O)[O-] ZINC000544396460 566961263 /nfs/dbraw/zinc/96/12/63/566961263.db2.gz CVSWDUCXAAFUBF-UHFFFAOYSA-N 0 0 388.225 3.485 20 5 GGBDRN O=[N+]([O-])c1cccc2ncnc(NCc3cc(F)ccc3Br)c21 ZINC000544409717 566961288 /nfs/dbraw/zinc/96/12/88/566961288.db2.gz HMZIKYQOWKNWKY-UHFFFAOYSA-N 0 0 377.173 3.474 20 5 GGBDRN Cc1c(Br)c(N2CCC(N3CCCCC3=O)CC2)ncc1[N+](=O)[O-] ZINC000544397546 566961417 /nfs/dbraw/zinc/96/14/17/566961417.db2.gz FYUOITRCSUHNQQ-UHFFFAOYSA-N 0 0 397.273 3.042 20 5 GGBDRN Cc1ncc2c(n1)CC[C@H](Nc1ncc([N+](=O)[O-])c(C)c1Br)C2 ZINC000544410698 566961807 /nfs/dbraw/zinc/96/18/07/566961807.db2.gz UVLZFLHXWUVTKE-NSHDSACASA-N 0 0 378.230 3.129 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1cnc2n1CCCC2 ZINC000452331086 566962668 /nfs/dbraw/zinc/96/26/68/566962668.db2.gz JLYQSLZZOFSEDM-UHFFFAOYSA-N 0 0 379.214 3.451 20 5 GGBDRN C[C@@H](C(=O)Nc1nnc(CC(F)(F)F)s1)c1ccc([N+](=O)[O-])cc1F ZINC000544417495 566963122 /nfs/dbraw/zinc/96/31/22/566963122.db2.gz UVGNIGVMBYAGRH-ZCFIWIBFSA-N 0 0 378.307 3.432 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCOc3ncc(Br)cc32)c1 ZINC000544465120 566964500 /nfs/dbraw/zinc/96/45/00/566964500.db2.gz VMJGHIKFOYGVEQ-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)NC[C@@H]1CCC(F)(F)C1 ZINC000429910250 566966419 /nfs/dbraw/zinc/96/64/19/566966419.db2.gz NCRILZCMGIEBIJ-MRVPVSSYSA-N 0 0 399.213 3.071 20 5 GGBDRN Cc1c(Br)cc(C(=O)Nc2cc(N(C)C)ccn2)cc1[N+](=O)[O-] ZINC000612346035 566966696 /nfs/dbraw/zinc/96/66/96/566966696.db2.gz BTKRCIZWHBITCG-UHFFFAOYSA-N 0 0 379.214 3.379 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCc2sc(Cl)cc21 ZINC000564358506 566966820 /nfs/dbraw/zinc/96/68/20/566966820.db2.gz SCHWULYYQNZUPH-JTQLQIEISA-N 0 0 388.854 3.284 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1NC1CCN(S(=O)(=O)C2CC2)CC1 ZINC000519767276 566967239 /nfs/dbraw/zinc/96/72/39/566967239.db2.gz RNANGTPELPOACS-UHFFFAOYSA-N 0 0 394.280 3.270 20 5 GGBDRN CS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000429924953 566967572 /nfs/dbraw/zinc/96/75/72/566967572.db2.gz MDMXTIMVCUUPMD-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN C[C@H](O)CNC(=O)c1cccc(Oc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000494030719 566967509 /nfs/dbraw/zinc/96/75/09/566967509.db2.gz YHMFMZXEUTWLSV-JTQLQIEISA-N 0 0 395.209 3.260 20 5 GGBDRN O=C(NCc1ccc2c(c1)OCO2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429938409 566967838 /nfs/dbraw/zinc/96/78/38/566967838.db2.gz DQNQUVRAPSGFDN-UHFFFAOYSA-N 0 0 379.166 3.016 20 5 GGBDRN CNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1C ZINC000429946512 566969458 /nfs/dbraw/zinc/96/94/58/566969458.db2.gz QWTAXMJQQSHQSP-UHFFFAOYSA-N 0 0 392.209 3.278 20 5 GGBDRN C[C@H]1N(Cc2cc(I)cc([N+](=O)[O-])c2)CCOC1(C)C ZINC000564385281 566970700 /nfs/dbraw/zinc/97/07/00/566970700.db2.gz NZOYKNKGGCUCCN-SNVBAGLBSA-N 0 0 390.221 3.199 20 5 GGBDRN O=C(NC[C@H]1Cc2ccccc2O1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000429964033 566971141 /nfs/dbraw/zinc/97/11/41/566971141.db2.gz MBSKUZLDHSHXQL-GFCCVEGCSA-N 0 0 377.194 3.091 20 5 GGBDRN C[C@@H]1N(Cc2cc(I)cc([N+](=O)[O-])c2)CCOC1(C)C ZINC000564385280 566971476 /nfs/dbraw/zinc/97/14/76/566971476.db2.gz NZOYKNKGGCUCCN-JTQLQIEISA-N 0 0 390.221 3.199 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCC(F)(F)C2)c(C(F)(F)F)c1 ZINC000429981753 566972514 /nfs/dbraw/zinc/97/25/14/566972514.db2.gz ZVSMZZLUXFPYKG-MRVPVSSYSA-N 0 0 388.314 3.327 20 5 GGBDRN Cc1nc([C@H]2CCCCN2c2ncc([N+](=O)[O-])c(C)c2Br)no1 ZINC000612438644 566973011 /nfs/dbraw/zinc/97/30/11/566973011.db2.gz UBGYFKYBHWGIOQ-SNVBAGLBSA-N 0 0 382.218 3.484 20 5 GGBDRN Cc1c(Br)c(Nc2cnn(Cc3ccccn3)c2)ncc1[N+](=O)[O-] ZINC000612444102 566974523 /nfs/dbraw/zinc/97/45/23/566974523.db2.gz TZACJJHIMMVGJC-UHFFFAOYSA-N 0 0 389.213 3.444 20 5 GGBDRN Cc1c(Br)c(N[C@H]2CCN(C(=O)C3CCCC3)C2)ncc1[N+](=O)[O-] ZINC000612449760 566974694 /nfs/dbraw/zinc/97/46/94/566974694.db2.gz QOUZFACZFFUVLZ-LBPRGKRZSA-N 0 0 397.273 3.264 20 5 GGBDRN Cc1nc(CNC(=O)c2cc([N+](=O)[O-])c(C)s2)sc1Br ZINC000452395600 566974711 /nfs/dbraw/zinc/97/47/11/566974711.db2.gz GKJBBXLMMZKMTG-UHFFFAOYSA-N 0 0 376.257 3.422 20 5 GGBDRN Cc1c(Br)c(N2C[C@H](C(F)(F)F)O[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000612446348 566974776 /nfs/dbraw/zinc/97/47/76/566974776.db2.gz HKQPFIPKEPAJJQ-IMTBSYHQSA-N 0 0 384.152 3.217 20 5 GGBDRN Cc1c(Br)c(N(CCO)CCc2ccccc2)ncc1[N+](=O)[O-] ZINC000612445894 566975147 /nfs/dbraw/zinc/97/51/47/566975147.db2.gz AKJKDOCEVAGEMF-UHFFFAOYSA-N 0 0 380.242 3.102 20 5 GGBDRN NS(=O)(=O)c1ccc(NCc2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000519887501 566976867 /nfs/dbraw/zinc/97/68/67/566976867.db2.gz SEAQHJCIRZXXCM-UHFFFAOYSA-N 0 0 376.221 3.161 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2C(F)(F)F)c(F)c1 ZINC000519891465 566977127 /nfs/dbraw/zinc/97/71/27/566977127.db2.gz AUNXUFZOHBEADN-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN CCOCc1nc([C@H](C)Nc2ncc([N+](=O)[O-])c(C)c2Br)no1 ZINC000583725612 566977766 /nfs/dbraw/zinc/97/77/66/566977766.db2.gz WRCFCHAXHJHRGZ-QMMMGPOBSA-N 0 0 386.206 3.153 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1c[nH]c2ncc(Br)cc12 ZINC000471791444 566978811 /nfs/dbraw/zinc/97/88/11/566978811.db2.gz IFAIKFHDZHYIKH-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCOc2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000452426322 566979032 /nfs/dbraw/zinc/97/90/32/566979032.db2.gz TZIKDDFJXGWCSD-UHFFFAOYSA-N 0 0 387.223 3.386 20 5 GGBDRN COc1cc(C(=O)Nc2ncc(Br)cc2C)cc([N+](=O)[O-])c1OC ZINC000430085579 566979536 /nfs/dbraw/zinc/97/95/36/566979536.db2.gz AYOQDBSWBXFGSX-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN COC1CCC(CCNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000544671627 566980178 /nfs/dbraw/zinc/98/01/78/566980178.db2.gz OYTDXPHWFTWACQ-UHFFFAOYSA-N 0 0 376.862 3.122 20 5 GGBDRN CN(Cc1c(Cl)cccc1Cl)c1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000544677257 566980254 /nfs/dbraw/zinc/98/02/54/566980254.db2.gz CAHAGCDZJDHSSK-UHFFFAOYSA-N 0 0 390.248 3.185 20 5 GGBDRN O=C(N=c1cc2ccc(Br)cn2[nH]1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000430107413 566982680 /nfs/dbraw/zinc/98/26/80/566982680.db2.gz TVVWDQIKSKQZHZ-UHFFFAOYSA-N 0 0 395.600 3.333 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(C)(F)F ZINC000452452951 566982869 /nfs/dbraw/zinc/98/28/69/566982869.db2.gz GBYGCZBGXSQJRT-SSDOTTSWSA-N 0 0 398.147 3.281 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](n2cc(Cl)cn2)C1 ZINC000583785714 566983145 /nfs/dbraw/zinc/98/31/45/566983145.db2.gz OYHWKVWWOFDNFW-ZDUSSCGKSA-N 0 0 384.223 3.255 20 5 GGBDRN CCSc1cc(CNS(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])ccn1 ZINC000494304777 566985448 /nfs/dbraw/zinc/98/54/48/566985448.db2.gz XPDQXKPTRANPPW-UHFFFAOYSA-N 0 0 381.479 3.197 20 5 GGBDRN Cn1ccc(COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])cc1=O ZINC000612661153 566987389 /nfs/dbraw/zinc/98/73/89/566987389.db2.gz OXYSYSRYOAFODO-UHFFFAOYSA-N 0 0 390.193 3.183 20 5 GGBDRN CCc1noc(COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])n1 ZINC000612661114 566987412 /nfs/dbraw/zinc/98/74/12/566987412.db2.gz KMNNHNWWOCFEFS-UHFFFAOYSA-N 0 0 379.170 3.430 20 5 GGBDRN C[C@@H](Cn1ccnc1)Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000564558507 566987742 /nfs/dbraw/zinc/98/77/42/566987742.db2.gz JAYLQXWKTKNSII-JTQLQIEISA-N 0 0 376.214 3.025 20 5 GGBDRN Cc1cc(Br)ccc1S(=O)(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000471969664 566989894 /nfs/dbraw/zinc/98/98/94/566989894.db2.gz UICXBJNZHTULIC-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN Cc1c(CNC(=O)c2nc(C3CC3)ncc2Br)cccc1[N+](=O)[O-] ZINC000494350699 566991777 /nfs/dbraw/zinc/99/17/77/566991777.db2.gz QFUFFMRJDUQJGE-UHFFFAOYSA-N 0 0 391.225 3.263 20 5 GGBDRN CC(C)[C@@H](C)N(CC(F)(F)F)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000564624167 566992083 /nfs/dbraw/zinc/99/20/83/566992083.db2.gz PJLJVZUSSLHIMJ-GFCCVEGCSA-N 0 0 382.404 3.376 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)CCc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000520278928 566993486 /nfs/dbraw/zinc/99/34/86/566993486.db2.gz LNIFGXMNLIUMBO-UHFFFAOYSA-N 0 0 384.841 3.120 20 5 GGBDRN CCSc1cc(CNS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)ccn1 ZINC000494359893 566993978 /nfs/dbraw/zinc/99/39/78/566993978.db2.gz UCIDZUUIHHPSAR-UHFFFAOYSA-N 0 0 381.479 3.197 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2cc(F)ccc2Br)c1[N+](=O)[O-] ZINC000520291822 566995898 /nfs/dbraw/zinc/99/58/98/566995898.db2.gz MBMIECMIWGDWAZ-UHFFFAOYSA-N 0 0 385.193 3.102 20 5 GGBDRN CCCc1n[nH]c(C(=O)N(C)Cc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000520303904 566996143 /nfs/dbraw/zinc/99/61/43/566996143.db2.gz NDHIABFKPYQBAS-UHFFFAOYSA-N 0 0 399.220 3.444 20 5 GGBDRN CCN(CCC1CC1)S(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000612801107 566996917 /nfs/dbraw/zinc/99/69/17/566996917.db2.gz ZXQPAIYCDWUYHA-UHFFFAOYSA-N 0 0 377.260 3.168 20 5 GGBDRN COc1ncc(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000452621098 566998604 /nfs/dbraw/zinc/99/86/04/566998604.db2.gz YVICAMFTMRDHNJ-SNVBAGLBSA-N 0 0 381.841 3.449 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC/C=C\c1ccc(Br)cc1 ZINC000452619618 566998922 /nfs/dbraw/zinc/99/89/22/566998922.db2.gz XZRMBABQOJXJCJ-IHWYPQMZSA-N 0 0 393.241 3.082 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000520347670 566999440 /nfs/dbraw/zinc/99/94/40/566999440.db2.gz XRIMPFOEZNLSOM-CVEARBPZSA-N 0 0 391.221 3.408 20 5 GGBDRN Cc1cc(C)c(Br)c(-c2nc(-c3c([N+](=O)[O-])ncn3C)no2)c1 ZINC000583960485 567000001 /nfs/dbraw/zinc/00/00/01/567000001.db2.gz FDPHEUVUHCWOSE-UHFFFAOYSA-N 0 0 378.186 3.425 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H](CO)c1ccc(Br)c(F)c1 ZINC000494425583 567000063 /nfs/dbraw/zinc/00/00/63/567000063.db2.gz MISCFMHZESOETL-AWEZNQCLSA-N 0 0 398.188 3.352 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CC1(F)F ZINC000494429005 567000246 /nfs/dbraw/zinc/00/02/46/567000246.db2.gz WLHOZPMKHYFSOY-MRVPVSSYSA-N 0 0 399.213 3.023 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000544842349 567001091 /nfs/dbraw/zinc/00/10/91/567001091.db2.gz DAPYVGBLFUSFPD-BZNIZROVSA-N 0 0 384.841 3.303 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1Cc2cccc(O)c2C1 ZINC000430245209 567002233 /nfs/dbraw/zinc/00/22/33/567002233.db2.gz AKBFREQOGHRNHY-GFCCVEGCSA-N 0 0 378.837 3.330 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3cccc(I)c3)no2)[nH]1 ZINC000612888996 567003194 /nfs/dbraw/zinc/00/31/94/567003194.db2.gz NTNJDEOLDCNPDY-UHFFFAOYSA-N 0 0 382.117 3.245 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]2Cc3cccc(O)c3C2)cc1[N+](=O)[O-] ZINC000430265643 567003502 /nfs/dbraw/zinc/00/35/02/567003502.db2.gz ZRDREJSIISEQMR-LBPRGKRZSA-N 0 0 391.221 3.269 20 5 GGBDRN CCC1CCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CC1 ZINC000430302299 567006617 /nfs/dbraw/zinc/00/66/17/567006617.db2.gz KORAFPSJMXSQQX-UHFFFAOYSA-N 0 0 398.257 3.253 20 5 GGBDRN CC[C@@H](C)[C@@H](C)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430307764 567006975 /nfs/dbraw/zinc/00/69/75/567006975.db2.gz WFWMGKHEUSKCRG-PSASIEDQSA-N 0 0 386.246 3.155 20 5 GGBDRN CCN(CC(C)C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430315943 567008056 /nfs/dbraw/zinc/00/80/56/567008056.db2.gz GAHODBAGGVHIIN-UHFFFAOYSA-N 0 0 386.246 3.109 20 5 GGBDRN CC[C@@]1(C)CCN(C(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)C1 ZINC000430317839 567008251 /nfs/dbraw/zinc/00/82/51/567008251.db2.gz JNLATHRSZNEAHH-INIZCTEOSA-N 0 0 398.257 3.253 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@H](C(C)C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430311115 567008419 /nfs/dbraw/zinc/00/84/19/567008419.db2.gz HDKNENLMUBZVOG-NSHDSACASA-N 0 0 398.257 3.109 20 5 GGBDRN CC[C@H]1C[C@H](C)CN1C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430320695 567008595 /nfs/dbraw/zinc/00/85/95/567008595.db2.gz KQQFMGCZTJSJFY-CABZTGNLSA-N 0 0 398.257 3.251 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCC2(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430312819 567008638 /nfs/dbraw/zinc/00/86/38/567008638.db2.gz QUYQVQPSLHJIAK-UHFFFAOYSA-N 0 0 384.230 3.005 20 5 GGBDRN COc1ccc(S(=O)(=O)NCc2cc3c(s2)CCCC3)c([N+](=O)[O-])c1 ZINC000520481083 567008745 /nfs/dbraw/zinc/00/87/45/567008745.db2.gz CBOVCMVZEFMEEE-UHFFFAOYSA-N 0 0 382.463 3.022 20 5 GGBDRN O=C(c1cccc(Br)c1F)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000430328556 567009758 /nfs/dbraw/zinc/00/97/58/567009758.db2.gz HBKLCTIFONOTMW-UHFFFAOYSA-N 0 0 395.184 3.400 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H](C)C(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000430329724 567009769 /nfs/dbraw/zinc/00/97/69/567009769.db2.gz HMKFBCOFGGISGN-SECBINFHSA-N 0 0 386.246 3.013 20 5 GGBDRN C[C@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000584082436 567009854 /nfs/dbraw/zinc/00/98/54/567009854.db2.gz RJFAMRWLEIEWOI-VIFPVBQESA-N 0 0 396.216 3.446 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H]2CC[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430328226 567010066 /nfs/dbraw/zinc/01/00/66/567010066.db2.gz DJVMWRGMKXYYOO-KOLCDFICSA-N 0 0 398.257 3.157 20 5 GGBDRN O=C(NC[C@@H]1CCOC2(CCC2)C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000452736742 567010633 /nfs/dbraw/zinc/01/06/33/567010633.db2.gz WDJMLYCHVDOJNQ-LLVKDONJSA-N 0 0 383.242 3.436 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCCC23CCC3)cc(Br)cc1[N+](=O)[O-] ZINC000430338354 567011015 /nfs/dbraw/zinc/01/10/15/567011015.db2.gz HMCDIJWPWMGKDK-UHFFFAOYSA-N 0 0 396.241 3.149 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[S@@](=O)CC1 ZINC000430339171 567011057 /nfs/dbraw/zinc/01/10/57/567011057.db2.gz COKCLPDLDJCIST-CANCMXDXSA-N 0 0 384.523 3.470 20 5 GGBDRN CCC[C@H](CC)NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000430340076 567011323 /nfs/dbraw/zinc/01/13/23/567011323.db2.gz FJPHVDOHWQKOPH-NSHDSACASA-N 0 0 386.246 3.299 20 5 GGBDRN O=[N+]([O-])c1cccc(NS(=O)(=O)c2ccc(OCC(F)(F)F)cc2)c1 ZINC000494613475 567011964 /nfs/dbraw/zinc/01/19/64/567011964.db2.gz FPOJUOYNDCBCQN-UHFFFAOYSA-N 0 0 376.312 3.337 20 5 GGBDRN Cc1nn(CCC(=O)Nc2c(C)c(Br)ccc2O)c(C)c1[N+](=O)[O-] ZINC000452746933 567012006 /nfs/dbraw/zinc/01/20/06/567012006.db2.gz GXHTYVWFIJBYBH-UHFFFAOYSA-N 0 0 397.229 3.213 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3ccccc3Br)no2)c1[N+](=O)[O-] ZINC000544984680 567012463 /nfs/dbraw/zinc/01/24/63/567012463.db2.gz LEBLKLKSZXIOPB-UHFFFAOYSA-N 0 0 378.186 3.040 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@H]3CCC[C@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000430358422 567013069 /nfs/dbraw/zinc/01/30/69/567013069.db2.gz XSAGMASTWOHNIS-ZWNOBZJWSA-N 0 0 396.241 3.005 20 5 GGBDRN CN(Cc1cc(Br)ccc1Cl)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000494644313 567013514 /nfs/dbraw/zinc/01/35/14/567013514.db2.gz ALGTWAGGSKHUFD-UHFFFAOYSA-N 0 0 399.632 3.492 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCCc1ccc(Br)s1 ZINC000494616859 567013857 /nfs/dbraw/zinc/01/38/57/567013857.db2.gz RUPGXZCDIXZRAK-UHFFFAOYSA-N 0 0 385.239 3.400 20 5 GGBDRN CC[C@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])Cc1cccc(Br)c1 ZINC000520614757 567014026 /nfs/dbraw/zinc/01/40/26/567014026.db2.gz KJBCSYMXWYOTTB-JTQLQIEISA-N 0 0 381.230 3.079 20 5 GGBDRN O=[N+]([O-])c1ccc(SCc2nc(Cn3cc(Br)cn3)no2)cc1 ZINC000545016664 567014076 /nfs/dbraw/zinc/01/40/76/567014076.db2.gz CATDQVYEXZAJBY-UHFFFAOYSA-N 0 0 396.226 3.277 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(OC[C@@H](O)COc2cccc(Br)c2)c1 ZINC000520583620 567014375 /nfs/dbraw/zinc/01/43/75/567014375.db2.gz XXBLTVYFGSHEEI-LBPRGKRZSA-N 0 0 398.209 3.185 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(Br)c(F)c1 ZINC000494657860 567014824 /nfs/dbraw/zinc/01/48/24/567014824.db2.gz VOQPDFRJQQZZNC-UHFFFAOYSA-N 0 0 383.173 3.435 20 5 GGBDRN Cc1cc(OCC(=O)NCc2sccc2Br)ccc1[N+](=O)[O-] ZINC000430419057 567015844 /nfs/dbraw/zinc/01/58/44/567015844.db2.gz RGWRIWKBPVNCEG-UHFFFAOYSA-N 0 0 385.239 3.422 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC(C)=C[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000430488130 567017282 /nfs/dbraw/zinc/01/72/82/567017282.db2.gz ZBFKMOGOSLIUKZ-VIFPVBQESA-N 0 0 396.241 3.029 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1 ZINC000494680072 567017768 /nfs/dbraw/zinc/01/77/68/567017768.db2.gz HIQHRXVXTHJYGN-RUZDIDTESA-N 0 0 382.825 3.388 20 5 GGBDRN C[C@H](CCOCc1ccccc1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000584177570 567019114 /nfs/dbraw/zinc/01/91/14/567019114.db2.gz CXKLRFIGHIMWTD-GFCCVEGCSA-N 0 0 384.479 3.467 20 5 GGBDRN C[C@@H](CCOCc1ccccc1)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000584177571 567019423 /nfs/dbraw/zinc/01/94/23/567019423.db2.gz CXKLRFIGHIMWTD-LBPRGKRZSA-N 0 0 384.479 3.467 20 5 GGBDRN CC(C)(C(=O)NCCOc1ccc(Cl)c(Cl)c1)n1cc([N+](=O)[O-])cn1 ZINC000452811610 567019660 /nfs/dbraw/zinc/01/96/60/567019660.db2.gz GEGLFCHWWYIPGD-UHFFFAOYSA-N 0 0 387.223 3.028 20 5 GGBDRN COc1ccc(CCNS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])c(Cl)c1 ZINC000472340950 567020604 /nfs/dbraw/zinc/02/06/04/567020604.db2.gz WPUZILDFWYOZNC-UHFFFAOYSA-N 0 0 384.841 3.086 20 5 GGBDRN Cc1noc2ncc(NC(=O)c3ccc(Br)cc3[N+](=O)[O-])cc12 ZINC000430587854 567022879 /nfs/dbraw/zinc/02/28/79/567022879.db2.gz BBMQMVSRRMCMBX-UHFFFAOYSA-N 0 0 377.154 3.454 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CC[C@H](c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000452843604 567023973 /nfs/dbraw/zinc/02/39/73/567023973.db2.gz JJIFWOAPWIKSHS-NSHDSACASA-N 0 0 379.214 3.019 20 5 GGBDRN CCO[C@@H]1CCN(C(=O)c2sc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000452851978 567025230 /nfs/dbraw/zinc/02/52/30/567025230.db2.gz HTVRUIQGCHHGDL-PSASIEDQSA-N 0 0 377.260 3.306 20 5 GGBDRN O=C(N[C@H]1CCCC[C@H]1n1cccn1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430593913 567025756 /nfs/dbraw/zinc/02/57/56/567025756.db2.gz UHCNNEWQBKPKDB-UONOGXRCSA-N 0 0 393.241 3.468 20 5 GGBDRN Cn1cc(Br)c(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000452868194 567026521 /nfs/dbraw/zinc/02/65/21/567026521.db2.gz YRTOCWZPVAZPAU-LBPRGKRZSA-N 0 0 393.241 3.111 20 5 GGBDRN CCOc1ccc(CNS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])cc1Cl ZINC000520850434 567027702 /nfs/dbraw/zinc/02/77/02/567027702.db2.gz BMFCUEHIUMEBEO-UHFFFAOYSA-N 0 0 384.841 3.434 20 5 GGBDRN CCSc1nccnc1C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000430680115 567029432 /nfs/dbraw/zinc/02/94/32/567029432.db2.gz XKQNHOXCGGVOQT-MRXNPFEDSA-N 0 0 376.463 3.385 20 5 GGBDRN C[C@H](Cc1ccsc1)NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000545208070 567029980 /nfs/dbraw/zinc/02/99/80/567029980.db2.gz ASOITQPUCYVLCR-LLVKDONJSA-N 0 0 377.447 3.114 20 5 GGBDRN C[C@@H]1CCCN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000520896953 567030337 /nfs/dbraw/zinc/03/03/37/567030337.db2.gz HKFHSMAIWBKZBN-SNVBAGLBSA-N 0 0 377.260 3.168 20 5 GGBDRN CCN([C@@H]1CCOC(C)(C)C1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000584319891 567031822 /nfs/dbraw/zinc/03/18/22/567031822.db2.gz TXAOYOBSWHOAFU-GFCCVEGCSA-N 0 0 376.862 3.216 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]([C@@H](CO)C1CC1)C1CC1 ZINC000452919572 567032355 /nfs/dbraw/zinc/03/23/55/567032355.db2.gz GIIJMUKPBSNMRK-GOEBONIOSA-N 0 0 397.269 3.193 20 5 GGBDRN C[C@@](O)(C1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545247607 567032916 /nfs/dbraw/zinc/03/29/16/567032916.db2.gz LMBPYYXTGWPGNS-CQSZACIVSA-N 0 0 380.750 3.414 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]([C@H](CO)C1CC1)C1CC1 ZINC000452919577 567033303 /nfs/dbraw/zinc/03/33/03/567033303.db2.gz GIIJMUKPBSNMRK-ZBFHGGJFSA-N 0 0 397.269 3.193 20 5 GGBDRN CC(C)(NC(=O)c1cc(I)c[nH]1)c1ccccc1[N+](=O)[O-] ZINC000584342784 567035036 /nfs/dbraw/zinc/03/50/36/567035036.db2.gz DGGLICZDRDOAJW-UHFFFAOYSA-N 0 0 399.188 3.193 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@@H]([C@@H](CO)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000452948427 567035511 /nfs/dbraw/zinc/03/55/11/567035511.db2.gz SYQYGJPDMTYKTD-XJKSGUPXSA-N 0 0 397.269 3.193 20 5 GGBDRN Cc1c(Br)cc(C(=O)N[C@H]([C@H](CO)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000452948425 567035553 /nfs/dbraw/zinc/03/55/53/567035553.db2.gz SYQYGJPDMTYKTD-CJNGLKHVSA-N 0 0 397.269 3.193 20 5 GGBDRN CCN(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)C1COC1 ZINC000452950960 567035614 /nfs/dbraw/zinc/03/56/14/567035614.db2.gz CJLUOQVPBNFLMP-UHFFFAOYSA-N 0 0 379.463 3.372 20 5 GGBDRN NC(=O)c1ccc(SCc2nc(Cc3cccs3)no2)c([N+](=O)[O-])c1 ZINC000521028228 567036215 /nfs/dbraw/zinc/03/62/15/567036215.db2.gz ZNUGNOZLZMQBHD-UHFFFAOYSA-N 0 0 376.419 3.021 20 5 GGBDRN CC(C)c1ccc(C(=O)N(C)CCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000584374018 567036651 /nfs/dbraw/zinc/03/66/51/567036651.db2.gz NZJSDUOCPGFZFJ-UHFFFAOYSA-N 0 0 395.257 3.449 20 5 GGBDRN COC[C@H]1CCCCN(c2ccc(I)cc2[N+](=O)[O-])C1 ZINC000613435843 567037419 /nfs/dbraw/zinc/03/74/19/567037419.db2.gz LFDWIUJPIMUSBG-NSHDSACASA-N 0 0 390.221 3.452 20 5 GGBDRN CC(C)[C@@H](CO)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC000452977134 567037730 /nfs/dbraw/zinc/03/77/30/567037730.db2.gz GREYKUXNMZDRIV-UKRRQHHQSA-N 0 0 387.274 3.376 20 5 GGBDRN CC(C)[C@H](CO)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC000452977136 567038676 /nfs/dbraw/zinc/03/86/76/567038676.db2.gz GREYKUXNMZDRIV-ZFWWWQNUSA-N 0 0 387.274 3.376 20 5 GGBDRN COc1ccccc1C(C)(C)CNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000613472380 567040256 /nfs/dbraw/zinc/04/02/56/567040256.db2.gz ICFDMLVMIDSRHT-UHFFFAOYSA-N 0 0 384.479 3.229 20 5 GGBDRN COC(=O)c1cccc(Br)c1COc1ncc(C)cc1[N+](=O)[O-] ZINC000430972691 567042604 /nfs/dbraw/zinc/04/26/04/567042604.db2.gz QXUBCTBMJUQAQJ-UHFFFAOYSA-N 0 0 381.182 3.426 20 5 GGBDRN COc1nc2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2s1 ZINC000430977839 567043651 /nfs/dbraw/zinc/04/36/51/567043651.db2.gz HERLKWWODHKJSB-UHFFFAOYSA-N 0 0 379.419 3.322 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@@H]1SCCc2ccccc21 ZINC000545365747 567043833 /nfs/dbraw/zinc/04/38/33/567043833.db2.gz DCUAVJUNZSIGNB-KRWDZBQOSA-N 0 0 378.475 3.045 20 5 GGBDRN CN(C(=O)C(C)(C)c1ccccc1[N+](=O)[O-])c1ncc(Br)cn1 ZINC000565163342 567044849 /nfs/dbraw/zinc/04/48/49/567044849.db2.gz MQEAGIHESAMKSB-UHFFFAOYSA-N 0 0 379.214 3.088 20 5 GGBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000545370062 567045430 /nfs/dbraw/zinc/04/54/30/567045430.db2.gz OLNPWETXDPFXFR-SNVBAGLBSA-N 0 0 391.287 3.414 20 5 GGBDRN CC(C)(CNC(=O)c1ccnc(N)c1[N+](=O)[O-])c1c(Cl)cccc1Cl ZINC000565183050 567047010 /nfs/dbraw/zinc/04/70/10/567047010.db2.gz VRAXACNBBVRHED-UHFFFAOYSA-N 0 0 383.235 3.417 20 5 GGBDRN CC(C)Nc1ccc(Br)cc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000545383092 567047377 /nfs/dbraw/zinc/04/73/77/567047377.db2.gz RQFRRUGRGQBYIH-UHFFFAOYSA-N 0 0 394.229 3.407 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CCSC[C@@H]2c2nccs2)c1 ZINC000472745448 567047774 /nfs/dbraw/zinc/04/77/74/567047774.db2.gz DLTKTIKTGYTFHX-CYBMUJFWSA-N 0 0 399.519 3.147 20 5 GGBDRN CC(C)Oc1nc(Sc2nnnn2Cc2cccs2)ccc1[N+](=O)[O-] ZINC000565223316 567048146 /nfs/dbraw/zinc/04/81/46/567048146.db2.gz UICMNAZNXBQKLF-UHFFFAOYSA-N 0 0 378.439 3.025 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCCOc1ncc(Cl)cc1Cl ZINC000495155595 567050286 /nfs/dbraw/zinc/05/02/86/567050286.db2.gz GEDWSTQMHOFLOR-UHFFFAOYSA-N 0 0 386.191 3.114 20 5 GGBDRN CSc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000584561560 567053702 /nfs/dbraw/zinc/05/37/02/567053702.db2.gz PEDGZKFRDDIJSC-UHFFFAOYSA-N 0 0 377.491 3.336 20 5 GGBDRN CO[C@@H](c1ccccc1Cl)[C@@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000545467179 567054194 /nfs/dbraw/zinc/05/41/94/567054194.db2.gz UAPHRPOUZZLWEF-BDJLRTHQSA-N 0 0 384.841 3.303 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@H]1CCC(F)(F)C1 ZINC000431092759 567054318 /nfs/dbraw/zinc/05/43/18/567054318.db2.gz DYXDDVGNOITGSB-VIFPVBQESA-N 0 0 377.185 3.451 20 5 GGBDRN O=[N+]([O-])c1cc(Br)cc(S(=O)(=O)N2CCC[C@H]2C2CCC2)c1 ZINC000521296941 567054516 /nfs/dbraw/zinc/05/45/16/567054516.db2.gz XPEISHYPPSMAJZ-AWEZNQCLSA-N 0 0 389.271 3.311 20 5 GGBDRN C[C@H]1SCCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000545469306 567054676 /nfs/dbraw/zinc/05/46/76/567054676.db2.gz OXMLVNPYVIXQLH-CXAGYDPISA-N 0 0 378.475 3.462 20 5 GGBDRN CO[C@@H](c1ccccc1Cl)[C@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000545467181 567054804 /nfs/dbraw/zinc/05/48/04/567054804.db2.gz UAPHRPOUZZLWEF-MEDUHNTESA-N 0 0 384.841 3.303 20 5 GGBDRN COc1ccc(CC(=O)N2Cc3cccc(Br)c3C2)cc1[N+](=O)[O-] ZINC000613689205 567055286 /nfs/dbraw/zinc/05/52/86/567055286.db2.gz CEANCEODONILOB-UHFFFAOYSA-N 0 0 391.221 3.451 20 5 GGBDRN O=[N+]([O-])c1cnc(Sc2nnc(-c3cccc(Br)c3)o2)nc1 ZINC000545484913 567055864 /nfs/dbraw/zinc/05/58/64/567055864.db2.gz VKPAQIRCVMNZOC-UHFFFAOYSA-N 0 0 380.183 3.349 20 5 GGBDRN Cc1cc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])nn2C)ccc1Br ZINC000431151144 567059643 /nfs/dbraw/zinc/05/96/43/567059643.db2.gz NNQXPXJSBDOYIJ-CYBMUJFWSA-N 0 0 393.241 3.377 20 5 GGBDRN Cc1cc(-c2noc(CCn3cc([N+](=O)[O-])cn3)n2)ccc1Br ZINC000545530678 567059799 /nfs/dbraw/zinc/05/97/99/567059799.db2.gz BKSZEXMPFGTEIJ-UHFFFAOYSA-N 0 0 378.186 3.155 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC000431155025 567060178 /nfs/dbraw/zinc/06/01/78/567060178.db2.gz BBGIDFLVBTTZBT-GFCCVEGCSA-N 0 0 397.204 3.207 20 5 GGBDRN O=[N+]([O-])c1cc2c(cc1CN1CCSC[C@@H]1c1nccs1)OCCO2 ZINC000613746056 567060384 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O=[N+]([O-])c1cccc(CNS(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)c1 ZINC000522239667 567108574 /nfs/dbraw/zinc/10/85/74/567108574.db2.gz JXFIZCLAZMLDNI-UHFFFAOYSA-N 0 0 378.303 3.231 20 5 GGBDRN CCS(=O)(=O)c1cccc(CNc2ncnc3sc([N+](=O)[O-])cc32)c1 ZINC000588039577 567109715 /nfs/dbraw/zinc/10/97/15/567109715.db2.gz SXCWFOQOQOPPLY-UHFFFAOYSA-N 0 0 378.435 3.005 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2CCc3c2cccc3Br)c1 ZINC000546171714 567110792 /nfs/dbraw/zinc/11/07/92/567110792.db2.gz GNIOOGCCVYOMHN-HNNXBMFYSA-N 0 0 397.250 3.323 20 5 GGBDRN Cc1c(Br)c(NCCc2ccc3c[nH]nc3c2)ncc1[N+](=O)[O-] ZINC000588048726 567110863 /nfs/dbraw/zinc/11/08/63/567110863.db2.gz XAGQEQSIJGGNON-UHFFFAOYSA-N 0 0 376.214 3.014 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2CCc3c2cccc3Br)c1 ZINC000546171715 567111424 /nfs/dbraw/zinc/11/14/24/567111424.db2.gz GNIOOGCCVYOMHN-OAHLLOKOSA-N 0 0 397.250 3.323 20 5 GGBDRN Cc1cnc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c(Br)c1 ZINC000497595265 567111490 /nfs/dbraw/zinc/11/14/90/567111490.db2.gz KUNPWGCDQBQLND-UHFFFAOYSA-N 0 0 380.154 3.042 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cc(I)c[nH]3)n2)cc1 ZINC000546258334 567119217 /nfs/dbraw/zinc/11/92/17/567119217.db2.gz HKZDWBMTYJEGFY-UHFFFAOYSA-N 0 0 382.117 3.245 20 5 GGBDRN O=C1Nc2ccccc2[C@]12CCN(c1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000614524419 567119845 /nfs/dbraw/zinc/11/98/45/567119845.db2.gz FIJOAOZMCFVZLF-QGZVFWFLSA-N 0 0 388.221 3.458 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCc3cccc(Cl)c32)cc1[N+](=O)[O-] ZINC000614539583 567119966 /nfs/dbraw/zinc/11/99/66/567119966.db2.gz PVMJUNYAWFZBAV-UHFFFAOYSA-N 0 0 386.788 3.147 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCCc2csc(C(C)C)n2)c1C ZINC000522617471 567120560 /nfs/dbraw/zinc/12/05/60/567120560.db2.gz BXKAGZYZUBLNAO-UHFFFAOYSA-N 0 0 383.495 3.313 20 5 GGBDRN C[C@@H](COc1cccc(F)c1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000497774409 567122656 /nfs/dbraw/zinc/12/26/56/567122656.db2.gz TXTGTDTXPHJSAH-JTQLQIEISA-N 0 0 388.804 3.133 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2ccccc2[N+](=O)[O-])c(C)cc1Br ZINC000522629060 567123484 /nfs/dbraw/zinc/12/34/84/567123484.db2.gz UUHDWUBFFCVJEC-UHFFFAOYSA-N 0 0 399.266 3.453 20 5 GGBDRN C[C@H](COc1cccc(F)c1)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000497779465 567125156 /nfs/dbraw/zinc/12/51/56/567125156.db2.gz BRUSOKSXWDNHSH-SNVBAGLBSA-N 0 0 388.804 3.133 20 5 GGBDRN C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000474015315 567126000 /nfs/dbraw/zinc/12/60/00/567126000.db2.gz VKQPJLPOIAOEBV-JTQLQIEISA-N 0 0 379.214 3.313 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCCc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000522714898 567125970 /nfs/dbraw/zinc/12/59/70/567125970.db2.gz JRVJUOPHEGDHRA-UHFFFAOYSA-N 0 0 399.266 3.187 20 5 GGBDRN O=[N+]([O-])c1ccc(Cc2noc(COC[C@@H]3CCCO3)n2)c(Br)c1 ZINC000546449925 567129106 /nfs/dbraw/zinc/12/91/06/567129106.db2.gz VNIJLJTVOABMDR-LBPRGKRZSA-N 0 0 398.213 3.027 20 5 GGBDRN O=c1[nH]cc(Br)cc1Cc1noc(-c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000546464371 567130181 /nfs/dbraw/zinc/13/01/81/567130181.db2.gz NPDORMPNILTHIU-UHFFFAOYSA-N 0 0 395.144 3.238 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)C(=O)N1CCC2(CCC2)CC1 ZINC000588708240 567133299 /nfs/dbraw/zinc/13/32/99/567133299.db2.gz NIMYKIBGKFZOJN-UHFFFAOYSA-N 0 0 396.241 3.089 20 5 GGBDRN Cc1cc(F)cc(S(=O)(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000497940381 567133298 /nfs/dbraw/zinc/13/32/98/567133298.db2.gz XMAVZRPPTVYAPW-INIZCTEOSA-N 0 0 382.438 3.479 20 5 GGBDRN COc1ccccc1S(=O)(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497940096 567133996 /nfs/dbraw/zinc/13/39/96/567133996.db2.gz SCWDIUNFMIYTEZ-INIZCTEOSA-N 0 0 380.447 3.040 20 5 GGBDRN COc1ccccc1S(=O)(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000497940099 567134045 /nfs/dbraw/zinc/13/40/45/567134045.db2.gz SCWDIUNFMIYTEZ-MRXNPFEDSA-N 0 0 380.447 3.040 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCc1csc(C(C)(C)C)n1 ZINC000497934823 567134321 /nfs/dbraw/zinc/13/43/21/567134321.db2.gz VPZZSSPHMZBZTR-UHFFFAOYSA-N 0 0 383.495 3.178 20 5 GGBDRN Cc1nn(C)c(N2CC[C@@H](Cc3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000432172950 567135026 /nfs/dbraw/zinc/13/50/26/567135026.db2.gz RASGDJRQZHYVKV-ZDUSSCGKSA-N 0 0 379.258 3.468 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C1CCCC1 ZINC000454027032 567137417 /nfs/dbraw/zinc/13/74/17/567137417.db2.gz JWDLEDYBSZWQAR-CQSZACIVSA-N 0 0 398.257 3.381 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)c2ccc(F)c(F)c2)cc1 ZINC000497968084 567137933 /nfs/dbraw/zinc/13/79/33/567137933.db2.gz GIXDVUKBHVULEM-OAHLLOKOSA-N 0 0 386.401 3.309 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1F ZINC000497971965 567138439 /nfs/dbraw/zinc/13/84/39/567138439.db2.gz WPIHOPNXFYDFJE-MRXNPFEDSA-N 0 0 382.438 3.479 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cc1F ZINC000497971964 567138564 /nfs/dbraw/zinc/13/85/64/567138564.db2.gz WPIHOPNXFYDFJE-INIZCTEOSA-N 0 0 382.438 3.479 20 5 GGBDRN CCC[C@H]1SCCN1S(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000497982312 567138899 /nfs/dbraw/zinc/13/88/99/567138899.db2.gz HZIRVUUKDLGYRK-GFCCVEGCSA-N 0 0 395.300 3.221 20 5 GGBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCOc2c(Br)cccc2C1 ZINC000588834531 567139173 /nfs/dbraw/zinc/13/91/73/567139173.db2.gz KARXYFNZVSQHDS-UHFFFAOYSA-N 0 0 381.230 3.281 20 5 GGBDRN CCc1nn(C)c(Oc2cc(Br)cc(C(=O)OC)c2)c1[N+](=O)[O-] ZINC000588823415 567139804 /nfs/dbraw/zinc/13/98/04/567139804.db2.gz XIXPWFZIOKHKLX-UHFFFAOYSA-N 0 0 384.186 3.232 20 5 GGBDRN O=[N+]([O-])c1ccc([C@H]2SCCN2S(=O)(=O)c2cc(F)ccc2F)cc1 ZINC000497984163 567140324 /nfs/dbraw/zinc/14/03/24/567140324.db2.gz PFUMHYDAISZUDD-OAHLLOKOSA-N 0 0 386.401 3.309 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000474142547 567140416 /nfs/dbraw/zinc/14/04/16/567140416.db2.gz PFCWVTCMKUQEFL-AWEZNQCLSA-N 0 0 384.219 3.434 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000497985204 567140898 /nfs/dbraw/zinc/14/08/98/567140898.db2.gz TYTLEMIAEIZLMU-INIZCTEOSA-N 0 0 382.438 3.479 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)C(C)(C)C1 ZINC000474164144 567141833 /nfs/dbraw/zinc/14/18/33/567141833.db2.gz LNKTXOSLVDJVRM-VIFPVBQESA-N 0 0 377.260 3.166 20 5 GGBDRN CC1(C)CS(=O)(=O)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000566242165 567142281 /nfs/dbraw/zinc/14/22/81/567142281.db2.gz GLEYGMRHYGCHIE-UHFFFAOYSA-N 0 0 380.491 3.332 20 5 GGBDRN COc1cc(Cn2c(=O)oc3cc(Br)ccc32)c([N+](=O)[O-])cc1F ZINC000546621717 567142930 /nfs/dbraw/zinc/14/29/30/567142930.db2.gz ZNLHADKOFMUTDT-UHFFFAOYSA-N 0 0 397.156 3.461 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(C)c2ccc(Cl)cc21 ZINC000474174004 567143611 /nfs/dbraw/zinc/14/36/11/567143611.db2.gz VURQKNPNHLRSKY-UHFFFAOYSA-N 0 0 381.841 3.202 20 5 GGBDRN O=[N+]([O-])c1cc2cnn(CCCS(=O)(=O)c3ccccc3)c2c(Cl)c1 ZINC000546623670 567144227 /nfs/dbraw/zinc/14/42/27/567144227.db2.gz DCFYHTTWOCORAY-UHFFFAOYSA-N 0 0 379.825 3.462 20 5 GGBDRN COC[C@H](NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C)c1cccc(Cl)c1 ZINC000588910358 567144741 /nfs/dbraw/zinc/14/47/41/567144741.db2.gz YMEYCUKGVLDEDN-HNNXBMFYSA-N 0 0 384.841 3.223 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@H](Cc2ccc(Br)cc2)C1 ZINC000498032768 567145513 /nfs/dbraw/zinc/14/55/13/567145513.db2.gz SGOGGTQCXWAYCD-GFCCVEGCSA-N 0 0 378.226 3.390 20 5 GGBDRN O=C(NCCNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000498049164 567146601 /nfs/dbraw/zinc/14/66/01/567146601.db2.gz OFCNJMRZFPNDMR-UHFFFAOYSA-N 0 0 382.203 3.061 20 5 GGBDRN CN(C(=O)CCc1ccc(Br)cc1F)c1ccc([N+](=O)[O-])nc1 ZINC000588984867 567147668 /nfs/dbraw/zinc/14/76/68/567147668.db2.gz IPFBLADXQHMKEJ-UHFFFAOYSA-N 0 0 382.189 3.487 20 5 GGBDRN C[C@](O)(C1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000546664153 567148640 /nfs/dbraw/zinc/14/86/40/567148640.db2.gz MEMSIIGVUAOPKI-AWEZNQCLSA-N 0 0 380.750 3.414 20 5 GGBDRN CS(=O)(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])Cc2ccccc21 ZINC000432329008 567150505 /nfs/dbraw/zinc/15/05/05/567150505.db2.gz NNSNOIHEDKFSOA-UHFFFAOYSA-N 0 0 381.841 3.034 20 5 GGBDRN COC(=O)c1ccnc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)c1 ZINC000566356473 567152497 /nfs/dbraw/zinc/15/24/97/567152497.db2.gz OPJHELXKOXGLAS-UHFFFAOYSA-N 0 0 394.181 3.100 20 5 GGBDRN Cc1nnc([C@H](C)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000546763363 567154842 /nfs/dbraw/zinc/15/48/42/567154842.db2.gz JFIQPIDCQYEOAS-QMMMGPOBSA-N 0 0 375.435 3.369 20 5 GGBDRN COc1cnc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c(Br)c1 ZINC000589082508 567155090 /nfs/dbraw/zinc/15/50/90/567155090.db2.gz HJHZAIYMWCTPDE-UHFFFAOYSA-N 0 0 380.198 3.251 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000566396597 567155426 /nfs/dbraw/zinc/15/54/26/567155426.db2.gz LRSQKHJFNKUJDJ-IAQYHMDHSA-N 0 0 390.889 3.368 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000566396599 567155675 /nfs/dbraw/zinc/15/56/75/567155675.db2.gz LRSQKHJFNKUJDJ-XHDPSFHLSA-N 0 0 390.889 3.368 20 5 GGBDRN O=[N+]([O-])c1cncc(Cl)c1NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000589111502 567157467 /nfs/dbraw/zinc/15/74/67/567157467.db2.gz VDEKLEYAXGAFCV-QMMMGPOBSA-N 0 0 392.626 3.224 20 5 GGBDRN CN(C)c1cc(Br)cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000432400606 567158238 /nfs/dbraw/zinc/15/82/38/567158238.db2.gz KBFXOKDVEOAMJG-UHFFFAOYSA-N 0 0 392.253 3.396 20 5 GGBDRN CCNC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1 ZINC000523484931 567159156 /nfs/dbraw/zinc/15/91/56/567159156.db2.gz SFJBQTMMQRTFLX-UHFFFAOYSA-N 0 0 392.209 3.359 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(Br)ccc1NC1CC1 ZINC000546793361 567159499 /nfs/dbraw/zinc/15/94/99/567159499.db2.gz SKFRMLBFBVRPBB-UHFFFAOYSA-N 0 0 392.213 3.161 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CC[S@](=O)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000523536952 567160408 /nfs/dbraw/zinc/16/04/08/567160408.db2.gz VPVHDCBPJNQRHJ-SHZVTRLKSA-N 0 0 384.523 3.326 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCC1(c2cccc(F)c2)CC1 ZINC000523523581 567160751 /nfs/dbraw/zinc/16/07/51/567160751.db2.gz ZCLNWVXPARTSMK-UHFFFAOYSA-N 0 0 384.816 3.397 20 5 GGBDRN Cc1nc(CNc2ccc([N+](=O)[O-])c(OC(C)C)n2)sc1Br ZINC000566481477 567161050 /nfs/dbraw/zinc/16/10/50/567161050.db2.gz DIZQNUGDJWKTQM-UHFFFAOYSA-N 0 0 387.259 3.338 20 5 GGBDRN C[C@@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)S(=O)(=O)c1ccc(F)cc1 ZINC000589147116 567160991 /nfs/dbraw/zinc/16/09/91/567160991.db2.gz RUZJUNGQMZAIMQ-QMMMGPOBSA-N 0 0 383.382 3.380 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](CO)c3ccccc32)cc1[N+](=O)[O-] ZINC000498235849 567161609 /nfs/dbraw/zinc/16/16/09/567161609.db2.gz YDCOIYGIWJDINB-LBPRGKRZSA-N 0 0 391.221 3.402 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2C[C@H](CO)c3ccccc32)cc1[N+](=O)[O-] ZINC000498235848 567161702 /nfs/dbraw/zinc/16/17/02/567161702.db2.gz YDCOIYGIWJDINB-GFCCVEGCSA-N 0 0 391.221 3.402 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1C[C@@H](CO)c2ccccc21 ZINC000498296500 567164218 /nfs/dbraw/zinc/16/42/18/567164218.db2.gz QZYGNCPPJINEGK-JTQLQIEISA-N 0 0 377.194 3.094 20 5 GGBDRN CN(CC(=O)Nc1cccc(Cl)c1)c1ncnc2sc([N+](=O)[O-])cc21 ZINC000566518983 567164723 /nfs/dbraw/zinc/16/47/23/567164723.db2.gz AWXVGIPNRNIERK-UHFFFAOYSA-N 0 0 377.813 3.328 20 5 GGBDRN Cc1sc(S(=O)(=O)N[C@@H](c2ccccc2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000589230142 567168325 /nfs/dbraw/zinc/16/83/25/567168325.db2.gz SOXDIACNHCEZAA-HNNXBMFYSA-N 0 0 384.479 3.003 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)c1 ZINC000546879323 567168390 /nfs/dbraw/zinc/16/83/90/567168390.db2.gz YDXBTGJSOHUJOE-GJZGRUSLSA-N 0 0 397.250 3.192 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@](=O)C[C@H](C)C1 ZINC000432570322 567168812 /nfs/dbraw/zinc/16/88/12/567168812.db2.gz BBQXEEBTUOQFAV-SHZVTRLKSA-N 0 0 384.523 3.184 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCc3ccc(Br)cc32)ccc1[N+](=O)[O-] ZINC000523727866 567168845 /nfs/dbraw/zinc/16/88/45/567168845.db2.gz RDSNSURILICODL-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@@](=O)C[C@@H](C)C1 ZINC000432570324 567168925 /nfs/dbraw/zinc/16/89/25/567168925.db2.gz BBQXEEBTUOQFAV-ZJWNCGCPSA-N 0 0 384.523 3.184 20 5 GGBDRN CO[C@H]1CCCN(Cc2cc(I)cc([N+](=O)[O-])c2)CC1 ZINC000589258464 567169416 /nfs/dbraw/zinc/16/94/16/567169416.db2.gz CQCIDZYGZUFPLN-AWEZNQCLSA-N 0 0 390.221 3.200 20 5 GGBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[S@](=O)C[C@H](C)C1 ZINC000432588687 567170417 /nfs/dbraw/zinc/17/04/17/567170417.db2.gz QHOOLAJQSKGJEM-SHZVTRLKSA-N 0 0 384.523 3.328 20 5 GGBDRN O=[N+]([O-])c1cc(I)cc(CN(CC(F)F)C2CC2)c1 ZINC000589253921 567170293 /nfs/dbraw/zinc/17/02/93/567170293.db2.gz JLXRJURYGLGZGG-UHFFFAOYSA-N 0 0 382.148 3.429 20 5 GGBDRN C[C@@H](Cc1ncc[nH]1)OCc1cc(I)cc([N+](=O)[O-])c1 ZINC000589255821 567170308 /nfs/dbraw/zinc/17/03/08/567170308.db2.gz YDHNDCSVIBADGF-VIFPVBQESA-N 0 0 387.177 3.070 20 5 GGBDRN CCO[C@@H]1CCCN(Cc2cc(I)cc([N+](=O)[O-])c2)C1 ZINC000589254195 567170402 /nfs/dbraw/zinc/17/04/02/567170402.db2.gz PPUSJOVXKCQAME-CQSZACIVSA-N 0 0 390.221 3.200 20 5 GGBDRN O=c1nc(-c2ccc(Br)cc2)on1Cc1ccc([N+](=O)[O-])cc1 ZINC000589270362 567171597 /nfs/dbraw/zinc/17/15/97/567171597.db2.gz UNAYYMNXAQXLBS-UHFFFAOYSA-N 0 0 376.166 3.222 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1Cn1nnc(-c2ccc(Br)o2)n1 ZINC000523808547 567173120 /nfs/dbraw/zinc/17/31/20/567173120.db2.gz MHRSHPLKALOYDY-UHFFFAOYSA-N 0 0 384.577 3.306 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H]1C1CC1 ZINC000589297069 567173733 /nfs/dbraw/zinc/17/37/33/567173733.db2.gz JWGHANVMSPSXPL-ZDUSSCGKSA-N 0 0 389.271 3.166 20 5 GGBDRN CCc1cnc(NCc2cc(I)cc([N+](=O)[O-])c2)s1 ZINC000566652555 567176348 /nfs/dbraw/zinc/17/63/48/567176348.db2.gz RQMCOWJQBKSSIC-UHFFFAOYSA-N 0 0 389.218 3.252 20 5 GGBDRN O=C(N[C@H]1CCc2sc(Cl)cc21)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000589466507 567180561 /nfs/dbraw/zinc/18/05/61/567180561.db2.gz KXPDIVXKZCARHC-NSHDSACASA-N 0 0 380.809 3.498 20 5 GGBDRN CCN(Cc1cccc(Br)c1)C(=O)c1ccc([N+](=O)[O-])c(NC)n1 ZINC000454569162 567183506 /nfs/dbraw/zinc/18/35/06/567183506.db2.gz IFRSVCTWWXRWDY-UHFFFAOYSA-N 0 0 393.241 3.456 20 5 GGBDRN 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O=[N+]([O-])c1ccc(CNc2cccc(S(=O)(=O)NC3CC3)c2)c(Cl)c1 ZINC000616732632 567254096 /nfs/dbraw/zinc/25/40/96/567254096.db2.gz PEUPDIYJPQICDM-UHFFFAOYSA-N 0 0 381.841 3.301 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CN(Cc1cc(Br)ccc1F)C1CC1 ZINC000475533923 567255890 /nfs/dbraw/zinc/25/58/90/567255890.db2.gz CYNASWYFBHXYGY-UHFFFAOYSA-N 0 0 383.221 3.395 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000590914251 567256392 /nfs/dbraw/zinc/25/63/92/567256392.db2.gz PVWZXXGCYNUKIW-NSHDSACASA-N 0 0 378.372 3.478 20 5 GGBDRN CCSCCCNC(=O)c1ccc([N+](=O)[O-])cc1I ZINC000499525781 567256381 /nfs/dbraw/zinc/25/63/81/567256381.db2.gz KXNXFUQYHOPUHR-UHFFFAOYSA-N 0 0 394.234 3.072 20 5 GGBDRN Cn1c(=O)c(COc2ccc(Br)cc2[N+](=O)[O-])nc2ccccc21 ZINC000525626187 567256695 /nfs/dbraw/zinc/25/66/95/567256695.db2.gz KKEJKQHIYISWBL-UHFFFAOYSA-N 0 0 390.193 3.183 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)cc(F)cc1[N+](=O)[O-] ZINC000567568784 567258045 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O=C1NCCN(Cc2csc([N+](=O)[O-])c2)[C@@H]1c1ccc(Br)cc1 ZINC000475668663 567265895 /nfs/dbraw/zinc/26/58/95/567265895.db2.gz FUSNCRIWIASTMM-CQSZACIVSA-N 0 0 396.266 3.092 20 5 GGBDRN O=C1NCCN(Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(Br)cc1 ZINC000475673071 567266962 /nfs/dbraw/zinc/26/69/62/567266962.db2.gz PYAKTBDAOGTWIB-INIZCTEOSA-N 0 0 390.237 3.030 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H](OCC2CC2)C1 ZINC000547980766 567271342 /nfs/dbraw/zinc/27/13/42/567271342.db2.gz KJMSNKQEYQPNAE-ZDUSSCGKSA-N 0 0 383.242 3.389 20 5 GGBDRN Cc1sc(S(=O)(=O)NC(C)(C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000499759024 567271463 /nfs/dbraw/zinc/27/14/63/567271463.db2.gz SDOLCHVDSBIPQL-UHFFFAOYSA-N 0 0 384.479 3.238 20 5 GGBDRN Cn1c(CNc2c(Br)cncc2[N+](=O)[O-])nc2cccc(Cl)c21 ZINC000475742654 567271856 /nfs/dbraw/zinc/27/18/56/567271856.db2.gz ASHWWFNBGWXBDN-UHFFFAOYSA-N 0 0 396.632 3.326 20 5 GGBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1NCCc1cscn1 ZINC000475732697 567271990 /nfs/dbraw/zinc/27/19/90/567271990.db2.gz 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O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](C3CCC3)C2)c(Br)c1 ZINC000591333413 567274914 /nfs/dbraw/zinc/27/49/14/567274914.db2.gz AZMGWFAJSDFSFE-LLVKDONJSA-N 0 0 389.271 3.168 20 5 GGBDRN CN(CCOC(C)(C)C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000591326951 567274988 /nfs/dbraw/zinc/27/49/88/567274988.db2.gz PVOHCFBWWRQZMZ-UHFFFAOYSA-N 0 0 384.376 3.049 20 5 GGBDRN CC[C@@H]1Cc2c(Br)cccc2CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000567768917 567275891 /nfs/dbraw/zinc/27/58/91/567275891.db2.gz DJDPBTUGPDSFOA-SNVBAGLBSA-N 0 0 379.214 3.058 20 5 GGBDRN COc1cc(C(=O)NCCc2ccccc2[N+](=O)[O-])sc1Br ZINC000548089677 567278421 /nfs/dbraw/zinc/27/84/21/567278421.db2.gz JMHDBITVVAFPPZ-UHFFFAOYSA-N 0 0 385.239 3.400 20 5 GGBDRN Cc1ccc2c(c1)CCN2S(=O)(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000526004987 567281257 /nfs/dbraw/zinc/28/12/57/567281257.db2.gz ABUWKNHLCQZESR-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN NC(=O)CSc1nnc(Sc2c(Cl)cc([N+](=O)[O-])cc2Cl)s1 ZINC000548117205 567282319 /nfs/dbraw/zinc/28/23/19/567282319.db2.gz ABOWKULINNQOQD-UHFFFAOYSA-N 0 0 397.290 3.482 20 5 GGBDRN CSc1ccccc1NC(=O)[C@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000526019883 567283395 /nfs/dbraw/zinc/28/33/95/567283395.db2.gz SOKGRHVMDSSXOQ-NSHDSACASA-N 0 0 380.447 3.118 20 5 GGBDRN CC(C)(C)[C@H](NC(=O)Cn1cc([N+](=O)[O-])cc(Cl)c1=O)c1cccs1 ZINC000475894745 567285584 /nfs/dbraw/zinc/28/55/84/567285584.db2.gz APZURFVZWBQHJO-CQSZACIVSA-N 0 0 383.857 3.375 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1ccc(F)c(F)c1 ZINC000526049275 567286324 /nfs/dbraw/zinc/28/63/24/567286324.db2.gz ZLUMNNFMIGAHSJ-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)NCCOc2cccc(Br)c2)c1[N+](=O)[O-] ZINC000433983713 567286423 /nfs/dbraw/zinc/28/64/23/567286423.db2.gz CPEUIOQTSWVROE-UHFFFAOYSA-N 0 0 397.229 3.013 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1Sc1nnc(N2CCOCC2)n1C1CC1 ZINC000526073937 567289584 /nfs/dbraw/zinc/28/95/84/567289584.db2.gz STVFUYFZXNQODT-UHFFFAOYSA-N 0 0 381.845 3.162 20 5 GGBDRN CCOC(=O)CN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])C1CCCC1 ZINC000434035279 567289585 /nfs/dbraw/zinc/28/95/85/567289585.db2.gz HLEVIOKGVAJDQS-UHFFFAOYSA-N 0 0 399.241 3.305 20 5 GGBDRN COc1c(C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)cccc1[N+](=O)[O-] ZINC000476051384 567292567 /nfs/dbraw/zinc/29/25/67/567292567.db2.gz POHBQHRMPRBPOU-RUZDIDTESA-N 0 0 382.825 3.388 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Br)s1 ZINC000434070837 567293095 /nfs/dbraw/zinc/29/30/95/567293095.db2.gz JLTFEMOSKQQMKK-UHFFFAOYSA-N 0 0 394.210 3.456 20 5 GGBDRN COc1c(C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)cccc1[N+](=O)[O-] ZINC000476051385 567293374 /nfs/dbraw/zinc/29/33/74/567293374.db2.gz POHBQHRMPRBPOU-VWLOTQADSA-N 0 0 382.825 3.388 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1c2ccccc2SC[C@H]1C ZINC000434108861 567293823 /nfs/dbraw/zinc/29/38/23/567293823.db2.gz LETZRESZCKVCSP-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1c2ccccc2SC[C@@H]1C ZINC000434108862 567293972 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CCN(CC1CCC1)C(=O)c1cc(I)cc([N+](=O)[O-])c1 ZINC000527025823 567305991 /nfs/dbraw/zinc/30/59/91/567305991.db2.gz RHMSKAPJDLBYKX-UHFFFAOYSA-N 0 0 388.205 3.462 20 5 GGBDRN CC[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)C(=O)NCc1cccs1 ZINC000591976138 567306567 /nfs/dbraw/zinc/30/65/67/567306567.db2.gz RGDJVQHRADJSJL-NSHDSACASA-N 0 0 377.451 3.168 20 5 GGBDRN O=[N+]([O-])c1cncc(Br)c1NCc1ccc(N2CCCCC2)nc1 ZINC000500259979 567311296 /nfs/dbraw/zinc/31/12/96/567311296.db2.gz CCFBJYMDKZTZFT-UHFFFAOYSA-N 0 0 392.257 3.172 20 5 GGBDRN C[C@H](Nc1c(Br)cncc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000500290987 567312649 /nfs/dbraw/zinc/31/26/49/567312649.db2.gz VZSLXOQEZTWCEZ-GTUYJWLHSA-N 0 0 384.255 3.085 20 5 GGBDRN COc1ccc(Cl)cc1CS(=O)(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000500303793 567312671 /nfs/dbraw/zinc/31/26/71/567312671.db2.gz MQCGPZYIGMUOHG-UHFFFAOYSA-N 0 0 384.841 3.219 20 5 GGBDRN O=C(N[C@@H]1COc2cc(F)c(Br)cc21)c1ccc([N+](=O)[O-])cc1F ZINC000500330485 567313523 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Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccc(Br)cc1)C1CCC1 ZINC000476381772 567319076 /nfs/dbraw/zinc/31/90/76/567319076.db2.gz XCQMXOZGZBQFJI-OAHLLOKOSA-N 0 0 393.241 3.362 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3ncc(Br)cc3Cl)CC2)cn1 ZINC000568345753 567320947 /nfs/dbraw/zinc/32/09/47/567320947.db2.gz OVGKFLPEYBKDLH-UHFFFAOYSA-N 0 0 398.648 3.127 20 5 GGBDRN C[C@H](NS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000500435930 567320940 /nfs/dbraw/zinc/32/09/40/567320940.db2.gz YNTRHHHABRBYTJ-JTQLQIEISA-N 0 0 385.239 3.397 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000527222548 567322042 /nfs/dbraw/zinc/32/20/42/567322042.db2.gz CBDYXKMBUXICAB-AWEZNQCLSA-N 0 0 384.219 3.434 20 5 GGBDRN Nc1c(C(=O)N2CCc3cc(Br)cc(F)c3C2)cccc1[N+](=O)[O-] ZINC000527277911 567325950 /nfs/dbraw/zinc/32/59/50/567325950.db2.gz MVGRVXMPPCAEGF-UHFFFAOYSA-N 0 0 394.200 3.277 20 5 GGBDRN CN(Cc1cc(F)cc(F)c1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000434759682 567326440 /nfs/dbraw/zinc/32/64/40/567326440.db2.gz URWRLWMGQQCLIM-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN CNc1ccc(C(=O)N[C@@H](CO)c2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000527278259 567326810 /nfs/dbraw/zinc/32/68/10/567326810.db2.gz NFTQJGVQUJGWOE-ZDUSSCGKSA-N 0 0 384.219 3.407 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cc(C(C)=O)ccc2Cl)c([N+](=O)[O-])c1 ZINC000476487969 567328805 /nfs/dbraw/zinc/32/88/05/567328805.db2.gz WTEMTAAQTDBXQX-UHFFFAOYSA-N 0 0 384.797 3.260 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC[C@H](CO)CC1CCCC1 ZINC000500532429 567329110 /nfs/dbraw/zinc/32/91/10/567329110.db2.gz LYAGBWHSSKCTPM-CYBMUJFWSA-N 0 0 399.285 3.205 20 5 GGBDRN CN(Cc1cc(F)cc(F)c1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000434780487 567329507 /nfs/dbraw/zinc/32/95/07/567329507.db2.gz ZLRPBTCHUBAHLL-UHFFFAOYSA-N 0 0 376.768 3.347 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCc2sc(Cl)cc2C1 ZINC000592295567 567329787 /nfs/dbraw/zinc/32/97/87/567329787.db2.gz ZLMKVVMFILFFBI-UHFFFAOYSA-N 0 0 379.825 3.142 20 5 GGBDRN CCNC(=O)NC(=O)CNc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000434881426 567334061 /nfs/dbraw/zinc/33/40/61/567334061.db2.gz VEHQYCHNXLHTGH-UHFFFAOYSA-N 0 0 380.451 3.065 20 5 GGBDRN C[C@H](Cc1nc(Cc2ccccc2[N+](=O)[O-])no1)n1cc(Br)cn1 ZINC000592399468 567334751 /nfs/dbraw/zinc/33/47/51/567334751.db2.gz RIVQVNJKAOKIQB-SNVBAGLBSA-N 0 0 392.213 3.331 20 5 GGBDRN Cc1n[nH]c(C(=O)N(Cc2cccc(Br)c2)CC2CC2)c1[N+](=O)[O-] ZINC000476561405 567334834 /nfs/dbraw/zinc/33/48/34/567334834.db2.gz MYZFSCWQHXKQEE-UHFFFAOYSA-N 0 0 393.241 3.441 20 5 GGBDRN NC(=O)[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000434952387 567335651 /nfs/dbraw/zinc/33/56/51/567335651.db2.gz UDQLWHXUBFRDBJ-NSHDSACASA-N 0 0 385.605 3.044 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCCCCc2ccc(F)c(F)c2)s1 ZINC000476573610 567335751 /nfs/dbraw/zinc/33/57/51/567335751.db2.gz MDVDHGNRBSIPMH-UHFFFAOYSA-N 0 0 376.406 3.236 20 5 GGBDRN C[C@H](Cc1nc(-c2ccc([N+](=O)[O-])s2)no1)n1cc(Br)cn1 ZINC000592408729 567336085 /nfs/dbraw/zinc/33/60/85/567336085.db2.gz KUTWDRDKHBBQGI-SSDOTTSWSA-N 0 0 384.215 3.469 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1c[nH]c2ncc(Br)cc12 ZINC000527455908 567336896 /nfs/dbraw/zinc/33/68/96/567336896.db2.gz IEWZSFFMHLNBFG-UHFFFAOYSA-N 0 0 375.182 3.164 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(OC[C@H](O)COc2ccc(Br)cc2)c1 ZINC000592446701 567339236 /nfs/dbraw/zinc/33/92/36/567339236.db2.gz OQWXIOVYYVPPBY-GFCCVEGCSA-N 0 0 398.209 3.185 20 5 GGBDRN CN(C)CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000500696925 567339647 /nfs/dbraw/zinc/33/96/47/567339647.db2.gz KTUGRVZVWJELSH-UHFFFAOYSA-N 0 0 383.857 3.005 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000476659421 567342803 /nfs/dbraw/zinc/34/28/03/567342803.db2.gz OFVSXENRTKEZCY-GFCCVEGCSA-N 0 0 397.204 3.207 20 5 GGBDRN CN(Cc1c(F)cccc1Cl)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000500793501 567344901 /nfs/dbraw/zinc/34/49/01/567344901.db2.gz OOBKRNLAWVXRCD-UHFFFAOYSA-N 0 0 386.832 3.392 20 5 GGBDRN Cc1nc(CNc2ccc([N+](=O)[O-])c(NCc3csc(C)n3)n2)cs1 ZINC000617939855 567346699 /nfs/dbraw/zinc/34/66/99/567346699.db2.gz HJUMQAGJVKKTJG-UHFFFAOYSA-N 0 0 376.467 3.166 20 5 GGBDRN C[C@@H](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)n1cc(Br)cn1 ZINC000592574431 567347061 /nfs/dbraw/zinc/34/70/61/567347061.db2.gz OEFXFSOEHXFDGZ-JTQLQIEISA-N 0 0 379.214 3.094 20 5 GGBDRN COC(=O)[C@H](NCCc1cccc([N+](=O)[O-])c1)c1cccc(Br)c1 ZINC000500831550 567347948 /nfs/dbraw/zinc/34/79/48/567347948.db2.gz UZFJKQDRXYUGPY-MRXNPFEDSA-N 0 0 393.237 3.404 20 5 GGBDRN COC(=O)[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1 ZINC000500836952 567348107 /nfs/dbraw/zinc/34/81/07/567348107.db2.gz GYSJZCCZIYRRLF-INIZCTEOSA-N 0 0 393.237 3.404 20 5 GGBDRN C[C@H](CC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)n1cc(Br)cn1 ZINC000592582216 567348271 /nfs/dbraw/zinc/34/82/71/567348271.db2.gz MHLGFFUQHGINRL-MNOVXSKESA-N 0 0 381.230 3.382 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCSC[C@H]1C1CC1 ZINC000456194051 567350008 /nfs/dbraw/zinc/35/00/08/567350008.db2.gz ZPKJVPCVHRDVMM-AWEZNQCLSA-N 0 0 385.283 3.254 20 5 GGBDRN CS(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1F ZINC000476817164 567350533 /nfs/dbraw/zinc/35/05/33/567350533.db2.gz MSQRSHJJLPCUJJ-UHFFFAOYSA-N 0 0 376.768 3.493 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]23)c(Cl)c1 ZINC000435225488 567350760 /nfs/dbraw/zinc/35/07/60/567350760.db2.gz HRLFDLPUWZOUHR-IAOVAPTHSA-N 0 0 378.837 3.255 20 5 GGBDRN Cc1c(CNC(=O)C[C@H](C)n2cc(Br)cn2)cccc1[N+](=O)[O-] ZINC000592625706 567351775 /nfs/dbraw/zinc/35/17/75/567351775.db2.gz XJYORYRKYABJHG-JTQLQIEISA-N 0 0 381.230 3.130 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCSC[C@@H]1C1CC1 ZINC000456210864 567352184 /nfs/dbraw/zinc/35/21/84/567352184.db2.gz XACGSCFONCNUOK-SECBINFHSA-N 0 0 377.285 3.386 20 5 GGBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCSC[C@H]1C1CC1 ZINC000456210866 567352230 /nfs/dbraw/zinc/35/22/30/567352230.db2.gz XACGSCFONCNUOK-VIFPVBQESA-N 0 0 377.285 3.386 20 5 GGBDRN CC(C)(C(=O)Nc1cc(F)c(F)cc1Br)n1cc([N+](=O)[O-])cn1 ZINC000435262457 567354032 /nfs/dbraw/zinc/35/40/32/567354032.db2.gz IWLZPIXKIKORRD-UHFFFAOYSA-N 0 0 389.156 3.206 20 5 GGBDRN Cc1c(NC(=O)N[C@H]2CCC[C@]2(C)CO)cc(Br)cc1[N+](=O)[O-] ZINC000435322537 567355066 /nfs/dbraw/zinc/35/50/66/567355066.db2.gz DQDMUAIMCDEUMY-DZGCQCFKSA-N 0 0 386.246 3.338 20 5 GGBDRN Cc1c(NC(=O)N(C)[C@@H]2CCCC[C@H]2O)cc(Br)cc1[N+](=O)[O-] ZINC000435330634 567355746 /nfs/dbraw/zinc/35/57/46/567355746.db2.gz VAJLMWKJGQPNAC-TZMCWYRMSA-N 0 0 386.246 3.433 20 5 GGBDRN CC[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)NCc1cccs1 ZINC000592692231 567355989 /nfs/dbraw/zinc/35/59/89/567355989.db2.gz PORJOHVYDUNFIU-LBPRGKRZSA-N 0 0 381.841 3.135 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000592714686 567356823 /nfs/dbraw/zinc/35/68/23/567356823.db2.gz FIKFMSZDRWBLSF-NSHDSACASA-N 0 0 387.230 3.207 20 5 GGBDRN CC[C@H](NC(=O)c1sc(Br)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000592718050 567356969 /nfs/dbraw/zinc/35/69/69/567356969.db2.gz WLWPSPLFGHOORP-ZETCQYMHSA-N 0 0 393.259 3.269 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)c1 ZINC000435423413 567360756 /nfs/dbraw/zinc/36/07/56/567360756.db2.gz QHHJNIRWMLDMOH-LSDHHAIUSA-N 0 0 397.250 3.192 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc1[N+](=O)[O-] ZINC000456306792 567360775 /nfs/dbraw/zinc/36/07/75/567360775.db2.gz GNRPEQHEUGSILM-DYEKYZERSA-N 0 0 397.269 3.289 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)[C@@H](C(N)=O)c1ccc(Br)cc1 ZINC000548926836 567362041 /nfs/dbraw/zinc/36/20/41/567362041.db2.gz CXSALABQYOGSFR-MRXNPFEDSA-N 0 0 392.253 3.058 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000456316241 567362229 /nfs/dbraw/zinc/36/22/29/567362229.db2.gz KGKKHVIPAVCRDK-DYEKYZERSA-N 0 0 384.885 3.350 20 5 GGBDRN O=C(NCCc1csc(-c2ccc(Cl)cc2)n1)c1c[nH]nc1[N+](=O)[O-] ZINC000548952322 567362449 /nfs/dbraw/zinc/36/24/49/567362449.db2.gz JINAXTRAIDVVCD-UHFFFAOYSA-N 0 0 377.813 3.067 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(OC)c(Br)cn2)c1 ZINC000476978241 567362640 /nfs/dbraw/zinc/36/26/40/567362640.db2.gz DOCZMWSPWFYBGQ-UHFFFAOYSA-N 0 0 382.170 3.022 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000456333883 567363693 /nfs/dbraw/zinc/36/36/93/567363693.db2.gz LYSVYEXZPXBAKM-DYEKYZERSA-N 0 0 397.269 3.289 20 5 GGBDRN O=C(N[C@@H]1CCc2cc(O)ccc2C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000618249787 567365325 /nfs/dbraw/zinc/36/53/25/567365325.db2.gz DZZTZMDSPFNSIT-CYBMUJFWSA-N 0 0 391.221 3.350 20 5 GGBDRN COc1cc(NC(=O)CCNc2ccccc2[N+](=O)[O-])ncc1Br ZINC000477029769 567365503 /nfs/dbraw/zinc/36/55/03/567365503.db2.gz SXVHISXRUVPCOX-UHFFFAOYSA-N 0 0 395.213 3.202 20 5 GGBDRN CC(C)c1nc([C@H]2COCCN2c2ccc(Br)cc2[N+](=O)[O-])no1 ZINC000501116787 567365527 /nfs/dbraw/zinc/36/55/27/567365527.db2.gz HCRTXKOCYNQLPY-CYBMUJFWSA-N 0 0 397.229 3.442 20 5 GGBDRN CCn1ccnc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000456354596 567365530 /nfs/dbraw/zinc/36/55/30/567365530.db2.gz NPXSCWDYVPMXKJ-JTQLQIEISA-N 0 0 381.230 3.373 20 5 GGBDRN CC(C)c1nc([C@@H]2COCCN2c2ccc(Br)cc2[N+](=O)[O-])no1 ZINC000501116788 567365950 /nfs/dbraw/zinc/36/59/50/567365950.db2.gz HCRTXKOCYNQLPY-ZDUSSCGKSA-N 0 0 397.229 3.442 20 5 GGBDRN Cc1ccc(Cc2noc(-c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)n2)s1 ZINC000568917079 567366071 /nfs/dbraw/zinc/36/60/71/567366071.db2.gz FUPYBTSMUPTJHW-UHFFFAOYSA-N 0 0 379.419 3.009 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nnc(-c3ccc(Cl)cc3)o2)cc1 ZINC000477043035 567366950 /nfs/dbraw/zinc/36/69/50/567366950.db2.gz ZYBWMDRQWGGODL-UHFFFAOYSA-N 0 0 379.781 3.272 20 5 GGBDRN CCO[C@@H]1C[C@@H]1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000618259086 567367308 /nfs/dbraw/zinc/36/73/08/567367308.db2.gz LFYHUPDIVPKRIS-WCQYABFASA-N 0 0 379.463 3.418 20 5 GGBDRN Cn1cc2c(n1)CCC[C@@H]2NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501125620 567367215 /nfs/dbraw/zinc/36/72/15/567367215.db2.gz QPFKQSVCIXMHMJ-ZDUSSCGKSA-N 0 0 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GGBDRN COC(=O)c1cnc(Nc2ccc(OC)c(Br)c2)c([N+](=O)[O-])c1 ZINC000477746878 567414353 /nfs/dbraw/zinc/41/43/53/567414353.db2.gz SXXVLKYGOQMAAO-UHFFFAOYSA-N 0 0 382.170 3.291 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2ccc(Br)cn2)ccc1[N+](=O)[O-] ZINC000477776377 567415987 /nfs/dbraw/zinc/41/59/87/567415987.db2.gz QCQOKBZRFIQWTK-SECBINFHSA-N 0 0 380.198 3.252 20 5 GGBDRN C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccc(Br)cn1 ZINC000477773313 567416100 /nfs/dbraw/zinc/41/61/00/567416100.db2.gz ZCFQSTDZUSFQIM-QMMMGPOBSA-N 0 0 390.197 3.120 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2cnc(C3CC3)o2)cc1[N+](=O)[O-] ZINC000456765832 567416164 /nfs/dbraw/zinc/41/61/64/567416164.db2.gz SANYPLYSUWAYTE-UHFFFAOYSA-N 0 0 380.198 3.461 20 5 GGBDRN C[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000477770721 567416344 /nfs/dbraw/zinc/41/63/44/567416344.db2.gz BMPMJDJXHOMFSK-JTQLQIEISA-N 0 0 380.198 3.009 20 5 GGBDRN CNc1c(C(=O)N[C@H](C)c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000477805802 567419543 /nfs/dbraw/zinc/41/95/43/567419543.db2.gz ONOSGHRSLVVIRR-SECBINFHSA-N 0 0 379.214 3.285 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)c2cc(Br)ccc2O1 ZINC000436348082 567419743 /nfs/dbraw/zinc/41/97/43/567419743.db2.gz VCXUUZNWMNBPGQ-VIFPVBQESA-N 0 0 380.198 3.124 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)c2cc(Br)ccc2O1 ZINC000436348081 567420171 /nfs/dbraw/zinc/42/01/71/567420171.db2.gz VCXUUZNWMNBPGQ-SECBINFHSA-N 0 0 380.198 3.124 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1SCCO)N1CCC[C@@]2(CCSC2)C1 ZINC000456839079 567421181 /nfs/dbraw/zinc/42/11/81/567421181.db2.gz NZKDYWKGWBDNCO-QGZVFWFLSA-N 0 0 382.507 3.039 20 5 GGBDRN Cc1cc(C)c(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000456830556 567421361 /nfs/dbraw/zinc/42/13/61/567421361.db2.gz CYZIMIOOPFCOHI-UHFFFAOYSA-N 0 0 378.226 3.228 20 5 GGBDRN CCN(C1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1)S(C)(=O)=O ZINC000618897838 567422035 /nfs/dbraw/zinc/42/20/35/567422035.db2.gz NLTPIMIDBPUCCB-UHFFFAOYSA-N 0 0 396.296 3.152 20 5 GGBDRN CC(C)Oc1cc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])ccn1 ZINC000502178728 567422615 /nfs/dbraw/zinc/42/26/15/567422615.db2.gz XRHSUDOECHNIHN-UHFFFAOYSA-N 0 0 394.225 3.470 20 5 GGBDRN COCC1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCCC1 ZINC000456863367 567422662 /nfs/dbraw/zinc/42/26/62/567422662.db2.gz YCWCHOOZRGKJTL-UHFFFAOYSA-N 0 0 385.258 3.223 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc2c(c(Br)c1)OCO2 ZINC000502206390 567423879 /nfs/dbraw/zinc/42/38/79/567423879.db2.gz ATPHTUOWFVQOBV-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC2(CCC2)O1 ZINC000569697254 567424078 /nfs/dbraw/zinc/42/40/78/567424078.db2.gz YMYHCGVMISRIHA-NSHDSACASA-N 0 0 383.242 3.070 20 5 GGBDRN O=[N+]([O-])c1cnc(NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c(Cl)c1 ZINC000436430177 567424094 /nfs/dbraw/zinc/42/40/94/567424094.db2.gz IEUWTWLUFUKIEL-SECBINFHSA-N 0 0 375.734 3.324 20 5 GGBDRN O=[N+]([O-])c1cnc(NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c(Cl)c1 ZINC000436430178 567424416 /nfs/dbraw/zinc/42/44/16/567424416.db2.gz IEUWTWLUFUKIEL-VIFPVBQESA-N 0 0 375.734 3.324 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000436448821 567425762 /nfs/dbraw/zinc/42/57/62/567425762.db2.gz FOAGRXQJCFYFSL-LBPRGKRZSA-N 0 0 380.685 3.004 20 5 GGBDRN O=C(NCCOCC(F)(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000502353253 567429267 /nfs/dbraw/zinc/42/92/67/567429267.db2.gz YQUJCWLIBGYRTB-UHFFFAOYSA-N 0 0 375.328 3.027 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H](OC(C)C)C2)cc1[N+](=O)[O-] ZINC000593625416 567430253 /nfs/dbraw/zinc/43/02/53/567430253.db2.gz SWGKNLWCLLSJBU-LBPRGKRZSA-N 0 0 376.862 3.135 20 5 GGBDRN Cc1c(Br)cc(S(=O)(=O)N2CCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000593624183 567430258 /nfs/dbraw/zinc/43/02/58/567430258.db2.gz GDJSRIHPRWMTPB-UHFFFAOYSA-N 0 0 399.213 3.086 20 5 GGBDRN CN(CCN1CCCCC1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000593666234 567433282 /nfs/dbraw/zinc/43/32/82/567433282.db2.gz NKFQJWNRHSKZHN-UHFFFAOYSA-N 0 0 396.296 3.008 20 5 GGBDRN CC(C)(C)C[C@@H]1C[C@H]1NC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000593679669 567434991 /nfs/dbraw/zinc/43/49/91/567434991.db2.gz GBWDVKVDWALYDK-TVQRCGJNSA-N 0 0 398.257 3.237 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(Br)cc1O ZINC000436567995 567435087 /nfs/dbraw/zinc/43/50/87/567435087.db2.gz ZNULCMZYJJCKDU-UHFFFAOYSA-N 0 0 381.182 3.002 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)N(C)C ZINC000550263615 567436767 /nfs/dbraw/zinc/43/67/67/567436767.db2.gz QFZGONQJMLKSSJ-AWEZNQCLSA-N 0 0 396.241 3.291 20 5 GGBDRN Cc1c[nH]c(C(C)(C)NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000593735570 567437989 /nfs/dbraw/zinc/43/79/89/567437989.db2.gz QFRRXWMXIQMQEL-UHFFFAOYSA-N 0 0 381.230 3.362 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)c1ccccc1 ZINC000550273676 567438145 /nfs/dbraw/zinc/43/81/45/567438145.db2.gz RAXOKLCXNSBDFR-HNNXBMFYSA-N 0 0 379.210 3.129 20 5 GGBDRN C[C@H]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2I)C1 ZINC000478155243 567439302 /nfs/dbraw/zinc/43/93/02/567439302.db2.gz WWHABPUKQKSBIB-UWVGGRQHSA-N 0 0 388.205 3.365 20 5 GGBDRN O=C1NCCN(Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1Br ZINC000502509227 567440113 /nfs/dbraw/zinc/44/01/13/567440113.db2.gz UHTXUNRWKBJDFR-INIZCTEOSA-N 0 0 390.237 3.030 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CC(=O)N2 ZINC000550316875 567440318 /nfs/dbraw/zinc/44/03/18/567440318.db2.gz GQMOBVMMSWUWLG-UHFFFAOYSA-N 0 0 390.193 3.413 20 5 GGBDRN CCOC(=O)Cc1cnc(N(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])s1 ZINC000457121544 567442153 /nfs/dbraw/zinc/44/21/53/567442153.db2.gz YKTXYPWVFQGCOY-UHFFFAOYSA-N 0 0 383.813 3.087 20 5 GGBDRN Cc1c(Br)cc(C(=O)N2CCC([C@H](C)CO)CC2)cc1[N+](=O)[O-] ZINC000593830604 567442224 /nfs/dbraw/zinc/44/22/24/567442224.db2.gz PMSQVXLBEHEMKV-SNVBAGLBSA-N 0 0 385.258 3.146 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC([C@H](C)CO)CC1 ZINC000593827046 567442246 /nfs/dbraw/zinc/44/22/46/567442246.db2.gz BZMXKYRDLCRFCX-SNVBAGLBSA-N 0 0 385.258 3.146 20 5 GGBDRN CS[C@H](C)CNC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000502565450 567442253 /nfs/dbraw/zinc/44/22/53/567442253.db2.gz MFLWREQJHHLGET-SECBINFHSA-N 0 0 380.392 3.076 20 5 GGBDRN CS(=O)(=O)Nc1ccc(Oc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cn1 ZINC000550345147 567443179 /nfs/dbraw/zinc/44/31/79/567443179.db2.gz DDTYOHGXIIYXBT-UHFFFAOYSA-N 0 0 377.300 3.172 20 5 GGBDRN COC(=O)c1cnc(Sc2cc3c(cc2Cl)OCCO3)c([N+](=O)[O-])c1 ZINC000478265241 567444710 /nfs/dbraw/zinc/44/47/10/567444710.db2.gz FXSOOZRVTAGTPV-UHFFFAOYSA-N 0 0 382.781 3.352 20 5 GGBDRN CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)Cc1ccncc1 ZINC000502729422 567448522 /nfs/dbraw/zinc/44/85/22/567448522.db2.gz ACTBDRQFFYOALB-UHFFFAOYSA-N 0 0 393.241 3.213 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCOc2c(Br)cccc2C1 ZINC000619420599 567450572 /nfs/dbraw/zinc/45/05/72/567450572.db2.gz IWUAEHUCQPNYMP-UHFFFAOYSA-N 0 0 383.223 3.454 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1I)N1CCC(F)(F)CC1 ZINC000619457460 567454534 /nfs/dbraw/zinc/45/45/34/567454534.db2.gz NKXKQBWUHMXGRM-UHFFFAOYSA-N 0 0 396.131 3.071 20 5 GGBDRN O=C(CCn1cc(Br)c([N+](=O)[O-])n1)N[C@H]1CCCc2ccccc21 ZINC000502820366 567454937 /nfs/dbraw/zinc/45/49/37/567454937.db2.gz XOIMRINLXPBEBL-AWEZNQCLSA-N 0 0 393.241 3.138 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H](CO)c1c(Cl)cccc1Cl ZINC000478428096 567455011 /nfs/dbraw/zinc/45/50/11/567455011.db2.gz CBGKEQDNDQQHCW-CQSZACIVSA-N 0 0 387.194 3.433 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)Sc2ccccc21 ZINC000619468113 567455580 /nfs/dbraw/zinc/45/55/80/567455580.db2.gz YDDSJNCEKWULDO-LLVKDONJSA-N 0 0 380.447 3.293 20 5 GGBDRN COc1ccc(Cl)cc1N(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1OC ZINC000619467585 567455988 /nfs/dbraw/zinc/45/59/88/567455988.db2.gz QPSVTANFJUINDY-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN COc1ccc(N(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cc1Cl ZINC000619468000 567456329 /nfs/dbraw/zinc/45/63/29/567456329.db2.gz RDEYSTIRHDLSAM-UHFFFAOYSA-N 0 0 386.813 3.091 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCOc2ncccc21 ZINC000550674611 567456714 /nfs/dbraw/zinc/45/67/14/567456714.db2.gz MUBQDGLVQGQENG-UHFFFAOYSA-N 0 0 378.182 3.100 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H]1CCc2c1cccc2Cl ZINC000619478463 567457028 /nfs/dbraw/zinc/45/70/28/567457028.db2.gz OEHCSLIUUPWKBM-CYBMUJFWSA-N 0 0 382.825 3.223 20 5 GGBDRN CC[C@@H]1c2ccsc2CCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1OC ZINC000619476075 567457373 /nfs/dbraw/zinc/45/73/73/567457373.db2.gz AWTMRPTWPIJGCY-GFCCVEGCSA-N 0 0 382.463 3.363 20 5 GGBDRN CC[C@H]1c2ccsc2CCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1OC ZINC000619476076 567457748 /nfs/dbraw/zinc/45/77/48/567457748.db2.gz AWTMRPTWPIJGCY-LBPRGKRZSA-N 0 0 382.463 3.363 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1cc2c(s1)CCCC2 ZINC000619477417 567457802 /nfs/dbraw/zinc/45/78/02/567457802.db2.gz QUZYLXSILPPIGX-UHFFFAOYSA-N 0 0 382.463 3.022 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1cccc(Cl)c1Cl ZINC000619479510 567457956 /nfs/dbraw/zinc/45/79/56/567457956.db2.gz OKCRYMYBMARIEL-UHFFFAOYSA-N 0 0 391.232 3.389 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)[C@H](C)c1sc(C)nc1C ZINC000619482557 567458571 /nfs/dbraw/zinc/45/85/71/567458571.db2.gz PZJGFKDJENGORU-SNVBAGLBSA-N 0 0 385.467 3.058 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000619485211 567459191 /nfs/dbraw/zinc/45/91/91/567459191.db2.gz UWBUFQFKZADXBZ-UHFFFAOYSA-N 0 0 384.841 3.470 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H](C)S1(=O)=O ZINC000570132691 567460379 /nfs/dbraw/zinc/46/03/79/567460379.db2.gz BTDNOWYRKJRQMT-CHWSQXEVSA-N 0 0 380.491 3.331 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000619495436 567460465 /nfs/dbraw/zinc/46/04/65/567460465.db2.gz SNZBTXSMXMUTRY-LLVKDONJSA-N 0 0 384.376 3.249 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1ccc(F)c(Cl)c1 ZINC000619499647 567460551 /nfs/dbraw/zinc/46/05/51/567460551.db2.gz HNIKGAWHPZQOIG-UHFFFAOYSA-N 0 0 388.804 3.217 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC(c2ccsc2)CC1 ZINC000619497877 567460902 /nfs/dbraw/zinc/46/09/02/567460902.db2.gz ZNVRBQUUWFITDA-UHFFFAOYSA-N 0 0 382.463 3.233 20 5 GGBDRN O=C(N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1cc([N+](=O)[O-])c[nH]1 ZINC000478472192 567461017 /nfs/dbraw/zinc/46/10/17/567461017.db2.gz PXEFQWVZRFJEIN-LBPRGKRZSA-N 0 0 377.706 3.059 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)Cc1ccccn1 ZINC000594145754 567461639 /nfs/dbraw/zinc/46/16/39/567461639.db2.gz ZABJRNHYTRHZAC-SNVBAGLBSA-N 0 0 378.226 3.422 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)c1ccc(F)cc1 ZINC000550792226 567461703 /nfs/dbraw/zinc/46/17/03/567461703.db2.gz MXWSKBWKUTZLQC-HNNXBMFYSA-N 0 0 397.200 3.268 20 5 GGBDRN C[C@H]1CC[C@H](CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])O1 ZINC000457442837 567465988 /nfs/dbraw/zinc/46/59/88/567465988.db2.gz PJWQFOSWVSRZQS-GXSJLCMTSA-N 0 0 378.372 3.389 20 5 GGBDRN C[C@@H]1CC[C@@H](CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])O1 ZINC000457442838 567466346 /nfs/dbraw/zinc/46/63/46/567466346.db2.gz PJWQFOSWVSRZQS-KOLCDFICSA-N 0 0 378.372 3.389 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCCCc3sccc32)cc1[N+](=O)[O-] ZINC000619570734 567466799 /nfs/dbraw/zinc/46/67/99/567466799.db2.gz TZWWBDXOQHJJDC-UHFFFAOYSA-N 0 0 380.447 3.043 20 5 GGBDRN COC(C)(C)C(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000619585365 567466923 /nfs/dbraw/zinc/46/69/23/567466923.db2.gz SJNPIACIRYIBNX-UHFFFAOYSA-N 0 0 383.198 3.278 20 5 GGBDRN COc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](C)c1ccc(SC)cc1 ZINC000619596554 567468518 /nfs/dbraw/zinc/46/85/18/567468518.db2.gz JTFHNHCNHLFSNI-NSHDSACASA-N 0 0 382.463 3.365 20 5 GGBDRN CC(C)(C)CC[C@@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000478601654 567470624 /nfs/dbraw/zinc/47/06/24/567470624.db2.gz WVLZVUIEWVNPCW-LBPRGKRZSA-N 0 0 387.274 3.203 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@@H](OC2CCC2)C1 ZINC000594388764 567473058 /nfs/dbraw/zinc/47/30/58/567473058.db2.gz LWINARKXHIHVEK-OAHLLOKOSA-N 0 0 397.269 3.460 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@@H]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000619714775 567474131 /nfs/dbraw/zinc/47/41/31/567474131.db2.gz ZYGXXXNNTQJDQS-OAHLLOKOSA-N 0 0 388.873 3.184 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@H]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000619714774 567474704 /nfs/dbraw/zinc/47/47/04/567474704.db2.gz ZYGXXXNNTQJDQS-HNNXBMFYSA-N 0 0 388.873 3.184 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCc3cccc(F)c3C2)cc1[N+](=O)[O-] ZINC000503220160 567475648 /nfs/dbraw/zinc/47/56/48/567475648.db2.gz PKUSTQQSCYUOEC-UHFFFAOYSA-N 0 0 384.816 3.443 20 5 GGBDRN CCC[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc(I)c1C ZINC000619743323 567476780 /nfs/dbraw/zinc/47/67/80/567476780.db2.gz GNIKBMSQCBOYQT-QMMMGPOBSA-N 0 0 376.194 3.426 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1CCOc1ccc(Cl)c(F)c1 ZINC000478717624 567478098 /nfs/dbraw/zinc/47/80/98/567478098.db2.gz MHDJWMDNVTUZPC-UHFFFAOYSA-N 0 0 391.580 3.391 20 5 GGBDRN C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccsc1 ZINC000619758338 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382.258 3.416 20 5 GGBDRN Cc1sc(CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)nc1C(C)C ZINC000503469796 567487185 /nfs/dbraw/zinc/48/71/85/567487185.db2.gz NGPAJCDMXDNMPO-UHFFFAOYSA-N 0 0 383.495 3.145 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000437288904 567487946 /nfs/dbraw/zinc/48/79/46/567487946.db2.gz FHCQCPUECUCRPA-STQMWFEESA-N 0 0 380.388 3.383 20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1OCc1cn2ccccc2n1 ZINC000478891548 567488218 /nfs/dbraw/zinc/48/82/18/567488218.db2.gz GIEXFQHQNQEGAY-UHFFFAOYSA-N 0 0 395.156 3.426 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1S(=O)(=O)N1CCC[C@@H]1[C@H]1CCCO1 ZINC000551222648 567489678 /nfs/dbraw/zinc/48/96/78/567489678.db2.gz LQUIOGNITOZXBX-DGCLKSJQSA-N 0 0 395.264 3.234 20 5 GGBDRN Cc1nccn1CCCOc1ccc(I)cc1[N+](=O)[O-] ZINC000478899487 567489825 /nfs/dbraw/zinc/48/98/25/567489825.db2.gz MGZIEFGJRGYLOY-UHFFFAOYSA-N 0 0 387.177 3.173 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)Oc2ncccc21 ZINC000551259438 567491601 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CS(=O)(=O)c1cccc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000551332497 567498178 /nfs/dbraw/zinc/49/81/78/567498178.db2.gz JTBZDRLWSSSZLB-UHFFFAOYSA-N 0 0 399.222 3.013 20 5 GGBDRN Cn1cnnc1Sc1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cc1Cl ZINC000503682196 567501107 /nfs/dbraw/zinc/50/11/07/567501107.db2.gz VASJOLUTHCTSGY-UHFFFAOYSA-N 0 0 378.801 3.108 20 5 GGBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1CCOc1cc(F)cc(Br)c1 ZINC000437607880 567502696 /nfs/dbraw/zinc/50/26/96/567502696.db2.gz WJOUCAKQRSFRJU-UHFFFAOYSA-N 0 0 391.580 3.391 20 5 GGBDRN CC(C)N(CC(F)(F)F)S(=O)(=O)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000594725279 567503046 /nfs/dbraw/zinc/50/30/46/567503046.db2.gz AKGKMNINSARLHO-UHFFFAOYSA-N 0 0 377.344 3.104 20 5 GGBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]1C1CCC1 ZINC000551416460 567504284 /nfs/dbraw/zinc/50/42/84/567504284.db2.gz DXZBTIVJSNVIFF-CQSZACIVSA-N 0 0 396.241 3.087 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCOC[C@H]2c2ccccc2)c(Cl)c1 ZINC000437707855 567506562 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CN(C(=O)CCc1cc(F)ccc1Br)c1ccc([N+](=O)[O-])nc1 ZINC000439299170 567580860 /nfs/dbraw/zinc/58/08/60/567580860.db2.gz PCQYMKAIUYYLBH-UHFFFAOYSA-N 0 0 382.189 3.487 20 5 GGBDRN CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1ncc(Br)cn1 ZINC000571818590 567590804 /nfs/dbraw/zinc/59/08/04/567590804.db2.gz RGQCJYJFOILAAS-UHFFFAOYSA-N 0 0 397.204 3.227 20 5 GGBDRN CCN(C[C@H](O)C(F)(F)F)C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000552446815 567591258 /nfs/dbraw/zinc/59/12/58/567591258.db2.gz VYSBWZSNCMQJNN-NSHDSACASA-N 0 0 399.163 3.051 20 5 GGBDRN CCN(Cc1ccccc1Br)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000439548140 567591480 /nfs/dbraw/zinc/59/14/80/567591480.db2.gz KEWNPNBOJVYBSZ-UHFFFAOYSA-N 0 0 380.198 3.120 20 5 GGBDRN COCC[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccco1 ZINC000505684006 567591591 /nfs/dbraw/zinc/59/15/91/567591591.db2.gz ZZMLIVIBPPOKBH-AWEZNQCLSA-N 0 0 397.225 3.387 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCOc3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000480244154 567591923 /nfs/dbraw/zinc/59/19/23/567591923.db2.gz XDJXDUYBOGXUDQ-UHFFFAOYSA-N 0 0 382.825 3.453 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000552494265 567593760 /nfs/dbraw/zinc/59/37/60/567593760.db2.gz FBRZSWBZSOARFD-UHFFFAOYSA-N 0 0 380.198 3.005 20 5 GGBDRN CCC(CC)(CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(=O)OC ZINC000505726754 567594722 /nfs/dbraw/zinc/59/47/22/567594722.db2.gz USMXFROTXGNPJZ-UHFFFAOYSA-N 0 0 387.230 3.067 20 5 GGBDRN NS(=O)(=O)c1cc(NC[C@H]2CCC[C@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000439601029 567594867 /nfs/dbraw/zinc/59/48/67/567594867.db2.gz ZOFVPHAPLPKBSZ-UWVGGRQHSA-N 0 0 381.376 3.023 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3ncc(Cl)cc3Br)CC2)cn1 ZINC000530369216 567596670 /nfs/dbraw/zinc/59/66/70/567596670.db2.gz AJHNCBKLKFGQSY-UHFFFAOYSA-N 0 0 398.648 3.127 20 5 GGBDRN CCC(CC)(CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)OC ZINC000505789713 567596770 /nfs/dbraw/zinc/59/67/70/567596770.db2.gz MCCDZPBJAVEBJX-UHFFFAOYSA-N 0 0 387.230 3.067 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC000552576539 567597518 /nfs/dbraw/zinc/59/75/18/567597518.db2.gz BHJMVASANIXWNX-GFCCVEGCSA-N 0 0 383.177 3.197 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCC3(CCC3)C2)c(Br)c1 ZINC000480388393 567600337 /nfs/dbraw/zinc/60/03/37/567600337.db2.gz NCRCURKXKSSCNT-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC=C(c2cccc(Cl)c2)CC1 ZINC000530433414 567601221 /nfs/dbraw/zinc/60/12/21/567601221.db2.gz BYKXRWSDMPNQFN-UHFFFAOYSA-N 0 0 379.825 3.121 20 5 GGBDRN Cc1sc(S(=O)(=O)NCc2c(C)c3ccccc3n2C)cc1[N+](=O)[O-] ZINC000480394550 567601739 /nfs/dbraw/zinc/60/17/39/567601739.db2.gz OXECQHKEDHEVIQ-UHFFFAOYSA-N 0 0 379.463 3.243 20 5 GGBDRN CC1(C)Cc2ccc(Br)cc2[C@@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000571971917 567602138 /nfs/dbraw/zinc/60/21/38/567602138.db2.gz IXFRZJDSSFWHTM-LBPRGKRZSA-N 0 0 379.214 3.134 20 5 GGBDRN O=C(Nc1cnccc1-n1cccn1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000505902914 567602590 /nfs/dbraw/zinc/60/25/90/567602590.db2.gz DLRNHZXWWZIQNL-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1cc(F)c(F)cc1Br ZINC000552716977 567604474 /nfs/dbraw/zinc/60/44/74/567604474.db2.gz OQIQQXNLDDQNLP-UHFFFAOYSA-N 0 0 385.164 3.494 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(Cc2ccncc2)CC1 ZINC000596057346 567605687 /nfs/dbraw/zinc/60/56/87/567605687.db2.gz MRDLKHFXQXJYLD-UHFFFAOYSA-N 0 0 377.242 3.075 20 5 GGBDRN COc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])n[nH]3)n2)cc1Cl ZINC000572008614 567605774 /nfs/dbraw/zinc/60/57/74/567605774.db2.gz HVGAIVSCPNEDNH-UHFFFAOYSA-N 0 0 379.785 3.356 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@H](C2CC2)O1 ZINC000480442965 567605961 /nfs/dbraw/zinc/60/59/61/567605961.db2.gz RTEAQLMKFSCRFM-AMIZOPFISA-N 0 0 395.264 3.090 20 5 GGBDRN Cc1nc(C)c(Br)c(N2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000596076517 567606276 /nfs/dbraw/zinc/60/62/76/567606276.db2.gz GRSFJTDKGRPGNH-UHFFFAOYSA-N 0 0 392.257 3.091 20 5 GGBDRN O=C(C1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1)N1CCCC1 ZINC000596066272 567606467 /nfs/dbraw/zinc/60/64/67/567606467.db2.gz QPNDJCRXQDQXSH-UHFFFAOYSA-N 0 0 382.258 3.196 20 5 GGBDRN Cc1ccc(C(=O)N[C@H](CO)c2ccc(Br)c(F)c2)cc1[N+](=O)[O-] ZINC000572021431 567606970 /nfs/dbraw/zinc/60/69/70/567606970.db2.gz UGZRBJXGMWOGAH-CQSZACIVSA-N 0 0 397.200 3.268 20 5 GGBDRN Cc1cc(NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c([N+](=O)[O-])s1 ZINC000596081694 567607090 /nfs/dbraw/zinc/60/70/90/567607090.db2.gz YOFCNELXSAZVCF-UHFFFAOYSA-N 0 0 381.479 3.361 20 5 GGBDRN Cc1cc(N(C)CCCOc2cccc(S(C)(=O)=O)c2)c([N+](=O)[O-])s1 ZINC000596096324 567607949 /nfs/dbraw/zinc/60/79/49/567607949.db2.gz FZOAKBMZKFTRQY-UHFFFAOYSA-N 0 0 384.479 3.274 20 5 GGBDRN Cc1c2ccccc2n(C)c1CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000480499981 567608147 /nfs/dbraw/zinc/60/81/47/567608147.db2.gz OAEWAOVXUBEYFM-UHFFFAOYSA-N 0 0 379.463 3.472 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCN(Cc2cscn2)CC1 ZINC000596086031 567608213 /nfs/dbraw/zinc/60/82/13/567608213.db2.gz SPMDZICNDNBJDF-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN O=c1[nH]ccc(NC[C@H]2CCN(c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000596085351 567608344 /nfs/dbraw/zinc/60/83/44/567608344.db2.gz TVSCKCFQTHVUNI-LLVKDONJSA-N 0 0 393.241 3.396 20 5 GGBDRN O=c1[nH]ccc(NC[C@@H]2CCN(c3ccc(Br)cc3)C2)c1[N+](=O)[O-] ZINC000596085352 567608374 /nfs/dbraw/zinc/60/83/74/567608374.db2.gz TVSCKCFQTHVUNI-NSHDSACASA-N 0 0 393.241 3.396 20 5 GGBDRN CC(C)(CNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000596095308 567608430 /nfs/dbraw/zinc/60/84/30/567608430.db2.gz OTAJRZDGQHMBCY-UHFFFAOYSA-N 0 0 383.857 3.285 20 5 GGBDRN O=c1[nH]ccc(NC[C@@H]2CCN(c3cccc(Br)c3)C2)c1[N+](=O)[O-] ZINC000596089000 567608967 /nfs/dbraw/zinc/60/89/67/567608967.db2.gz QNMRDUOCYPYRBV-NSHDSACASA-N 0 0 393.241 3.396 20 5 GGBDRN Cc1c(Br)c(NCc2ncnn2-c2ccccc2)ncc1[N+](=O)[O-] ZINC000480514002 567609392 /nfs/dbraw/zinc/60/93/92/567609392.db2.gz KORQFUNYRCFCJT-UHFFFAOYSA-N 0 0 389.213 3.254 20 5 GGBDRN Cc1ccc(Br)cc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000439972258 567609467 /nfs/dbraw/zinc/60/94/67/567609467.db2.gz NHEZLUGVLHGTMH-UHFFFAOYSA-N 0 0 381.230 3.442 20 5 GGBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C)[C@@H](O)C(F)(F)F ZINC000572064014 567609728 /nfs/dbraw/zinc/60/97/28/567609728.db2.gz XPLYDBZXDIONFE-WDEREUQCSA-N 0 0 399.163 3.097 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000596123733 567610099 /nfs/dbraw/zinc/61/00/99/567610099.db2.gz OYAUUCVDJLHXQZ-LLVKDONJSA-N 0 0 392.257 3.279 20 5 GGBDRN O=c1[nH]ccc(N[C@H]2CCN(c3ccccc3Br)C2)c1[N+](=O)[O-] ZINC000596123960 567610605 /nfs/dbraw/zinc/61/06/05/567610605.db2.gz UHEMQWYJHVNNIS-JTQLQIEISA-N 0 0 379.214 3.149 20 5 GGBDRN CCO[C@@H]1C[C@H](O)C12CCN(c1c(Br)cccc1[N+](=O)[O-])CC2 ZINC000596146155 567611007 /nfs/dbraw/zinc/61/10/07/567611007.db2.gz RBVQMXMXYSMXSV-UONOGXRCSA-N 0 0 385.258 3.114 20 5 GGBDRN CC[C@H](Cc1ccc(Cl)cc1)Nc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 ZINC000596133733 567611854 /nfs/dbraw/zinc/61/18/54/567611854.db2.gz ZKBLMPVFWDHIKR-CYBMUJFWSA-N 0 0 383.857 3.329 20 5 GGBDRN NS(=O)(=O)c1ccc(NC[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000596150178 567611973 /nfs/dbraw/zinc/61/19/73/567611973.db2.gz HBUCITARXOXBOT-ONGXEEELSA-N 0 0 381.376 3.023 20 5 GGBDRN CN(Cc1ccnn1C)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000480570069 567612215 /nfs/dbraw/zinc/61/22/15/567612215.db2.gz ZILPLGCHPSMIDV-UHFFFAOYSA-N 0 0 376.214 3.275 20 5 GGBDRN CCS(=O)(=O)N1CCC(CNc2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000596197521 567614069 /nfs/dbraw/zinc/61/40/69/567614069.db2.gz FHRSEMUDJLLMBG-UHFFFAOYSA-N 0 0 377.413 3.006 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(-c2noc(Cc3ccc(C)c(Br)c3)n2)n1C ZINC000572109661 567614098 /nfs/dbraw/zinc/61/40/98/567614098.db2.gz XSXWJQRQZQJMDU-UHFFFAOYSA-N 0 0 392.213 3.348 20 5 GGBDRN Nc1ccc(N2CCC(Oc3cccc(Br)c3)CC2)nc1[N+](=O)[O-] ZINC000596191652 567614617 /nfs/dbraw/zinc/61/46/17/567614617.db2.gz ANLBEUQCGUKNRX-UHFFFAOYSA-N 0 0 393.241 3.382 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000596210374 567615769 /nfs/dbraw/zinc/61/57/69/567615769.db2.gz HVKCXXKOYADPFU-QPUJVOFHSA-N 0 0 383.164 3.497 20 5 GGBDRN Cc1nc(C)c(Br)c(N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000596205231 567615908 /nfs/dbraw/zinc/61/59/08/567615908.db2.gz HFQSDENAORMTJI-UHFFFAOYSA-N 0 0 379.214 3.032 20 5 GGBDRN Cn1ccnc1N1CCC(Nc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596207445 567616055 /nfs/dbraw/zinc/61/60/55/567616055.db2.gz QQLRKTNIVYQTCF-UHFFFAOYSA-N 0 0 380.246 3.172 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1N1CC[C@@H](C(F)(F)F)[C@H](CO)C1 ZINC000596232833 567616935 /nfs/dbraw/zinc/61/69/35/567616935.db2.gz ZJZGMXCCHHACMY-DTWKUNHWSA-N 0 0 383.164 3.354 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CCc3sc(Cl)cc3C2)cccc1[N+](=O)[O-] ZINC000572156388 567617133 /nfs/dbraw/zinc/61/71/33/567617133.db2.gz JSDKXSFEWVXCNN-UHFFFAOYSA-N 0 0 379.825 3.142 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3c(Br)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC000596233871 567617299 /nfs/dbraw/zinc/61/72/99/567617299.db2.gz GWSWSKDGBBFPNQ-SCRDCRAPSA-N 0 0 382.258 3.416 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(N(C)Cc2ccc(Br)s2)n1 ZINC000552907096 567617621 /nfs/dbraw/zinc/61/76/21/567617621.db2.gz QABZZVRSLQGAHP-UHFFFAOYSA-N 0 0 386.227 3.237 20 5 GGBDRN NS(=O)(=O)c1ccc(NCCCCc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000596224525 567617658 /nfs/dbraw/zinc/61/76/58/567617658.db2.gz CBMDDBBTXBHKMQ-UHFFFAOYSA-N 0 0 389.886 3.392 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3c(Br)cccc3[N+](=O)[O-])[C@H]2C1 ZINC000596233867 567617661 /nfs/dbraw/zinc/61/76/61/567617661.db2.gz GWSWSKDGBBFPNQ-OBJOEFQTSA-N 0 0 382.258 3.416 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1NC[C@@H]1CCC2(CCOCC2)[C@H]1O ZINC000596227953 567617775 /nfs/dbraw/zinc/61/77/75/567617775.db2.gz VAJSZXGIHPMPLK-NHYWBVRUSA-N 0 0 385.258 3.337 20 5 GGBDRN COc1cccc(CCNc2ncc([N+](=O)[O-])cc2Br)c1OC ZINC000530664197 567617699 /nfs/dbraw/zinc/61/76/99/567617699.db2.gz PYVFNMDQLIGBJT-UHFFFAOYSA-N 0 0 382.214 3.424 20 5 GGBDRN CN(C)S(=O)(=O)c1cc(NCc2c(Cl)cccc2[N+](=O)[O-])ccc1F ZINC000506248401 567618753 /nfs/dbraw/zinc/61/87/53/567618753.db2.gz XHKXZKYLTMLNQE-UHFFFAOYSA-N 0 0 387.820 3.250 20 5 GGBDRN Cn1nccc1[C@@H]1C[C@H](Nc2c(Br)cccc2[N+](=O)[O-])CCO1 ZINC000596256490 567619023 /nfs/dbraw/zinc/61/90/23/567619023.db2.gz AXZDTJFPYAEOEW-YGRLFVJLSA-N 0 0 381.230 3.423 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)c1ncc(Br)cn1 ZINC000572175799 567619852 /nfs/dbraw/zinc/61/98/52/567619852.db2.gz VURKGZKOQYMLJE-UHFFFAOYSA-N 0 0 379.214 3.349 20 5 GGBDRN COCCN(C[C@@H]1CC=CCC1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000480670394 567619904 /nfs/dbraw/zinc/61/99/04/567619904.db2.gz WDWJVCCGJLPIBH-CYBMUJFWSA-N 0 0 388.873 3.242 20 5 GGBDRN Cn1ccnc1[C@H]1C[C@@H](Nc2c(Br)cccc2[N+](=O)[O-])CCO1 ZINC000596266157 567620031 /nfs/dbraw/zinc/62/00/31/567620031.db2.gz NXOTUSZDYSZNBT-GXFFZTMASA-N 0 0 381.230 3.423 20 5 GGBDRN O=[N+]([O-])c1cc(N2CCC[C@@]3(CCS(=O)(=O)C3)C2)ccc1C(F)(F)F ZINC000596257511 567620082 /nfs/dbraw/zinc/62/00/82/567620082.db2.gz PNOYJCQKUQHHGN-CQSZACIVSA-N 0 0 378.372 3.019 20 5 GGBDRN NC(=O)c1cc(N2CCC[C@H]2c2ccc(Br)cn2)ccc1[N+](=O)[O-] ZINC000596260476 567620334 /nfs/dbraw/zinc/62/03/34/567620334.db2.gz DUAARCYCKXNZAQ-HNNXBMFYSA-N 0 0 391.225 3.193 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCCOc2ccc(Br)cc2)n1 ZINC000553030661 567622019 /nfs/dbraw/zinc/62/20/19/567622019.db2.gz NCZYHJGOMPKTFZ-UHFFFAOYSA-N 0 0 396.197 3.030 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCC1(c2ccc(Br)s2)CCC1 ZINC000553066236 567623156 /nfs/dbraw/zinc/62/31/56/567623156.db2.gz VEVQMSFIQDTDQK-UHFFFAOYSA-N 0 0 399.270 3.004 20 5 GGBDRN CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(Br)cc21 ZINC000553067913 567624112 /nfs/dbraw/zinc/62/41/12/567624112.db2.gz MUMHXRCVVJQXPR-UHFFFAOYSA-N 0 0 376.210 3.454 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3cc(Br)ccc3o2)cc1 ZINC000506379970 567624241 /nfs/dbraw/zinc/62/42/41/567624241.db2.gz JHUARPPRBLYFGH-UHFFFAOYSA-N 0 0 397.206 3.472 20 5 GGBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1nc2cc(Br)ccc2o1 ZINC000506422830 567624997 /nfs/dbraw/zinc/62/49/97/567624997.db2.gz PPATYLPNDSIDBV-UHFFFAOYSA-N 0 0 384.573 3.362 20 5 GGBDRN O=C(c1c(Cl)cccc1Cl)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000530854587 567626312 /nfs/dbraw/zinc/62/63/12/567626312.db2.gz YNPDBKTWRIITCG-UHFFFAOYSA-N 0 0 381.219 3.259 20 5 GGBDRN COCCN([C@H]1CC[C@H](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000480760644 567628973 /nfs/dbraw/zinc/62/89/73/567628973.db2.gz RRALMWJFUDDGMN-RYUDHWBXSA-N 0 0 376.862 3.074 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H]2C[C@H]2c2ccccc2Cl)cc1 ZINC000572304745 567629258 /nfs/dbraw/zinc/62/92/58/567629258.db2.gz YWFSQTIDNCATAN-DOTOQJQBSA-N 0 0 380.853 3.266 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](C)COCC(F)(F)F ZINC000572307591 567629603 /nfs/dbraw/zinc/62/96/03/567629603.db2.gz UTGQGAGJRNMCDJ-ZETCQYMHSA-N 0 0 399.163 3.363 20 5 GGBDRN O=C(COc1c(Cl)cncc1[N+](=O)[O-])Nc1ccccc1Br ZINC000506566045 567631388 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CCC[C@@H](CC)Sc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000480851217 567636560 /nfs/dbraw/zinc/63/65/60/567636560.db2.gz JEILNAJBHWSFPB-CYBMUJFWSA-N 0 0 388.511 3.287 20 5 GGBDRN COc1cc(CCNc2ncccc2Br)c([N+](=O)[O-])cc1OC ZINC000553242068 567637664 /nfs/dbraw/zinc/63/76/64/567637664.db2.gz HBGDAVDXYWAFGH-UHFFFAOYSA-N 0 0 382.214 3.424 20 5 GGBDRN CCCC[C@@H](C)N(C)C(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000572415935 567638307 /nfs/dbraw/zinc/63/83/07/567638307.db2.gz IIHIBFQACUDUNH-SNVBAGLBSA-N 0 0 386.246 3.333 20 5 GGBDRN Cc1c(Br)c(NCC(C)(C)[C@@]2(O)CCCOC2)ncc1[N+](=O)[O-] ZINC000596535459 567639007 /nfs/dbraw/zinc/63/90/07/567639007.db2.gz RABDRJMHQKSOAX-OAHLLOKOSA-N 0 0 388.262 3.040 20 5 GGBDRN CC[C@H](Cc1ccc(Br)cc1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000596534765 567639048 /nfs/dbraw/zinc/63/90/48/567639048.db2.gz RFQFPCOXKPTDDZ-GFCCVEGCSA-N 0 0 393.241 3.284 20 5 GGBDRN Cc1ccnc(N2CCN(c3cccc(Br)c3)CC2)c1[N+](=O)[O-] ZINC000553252851 567639110 /nfs/dbraw/zinc/63/91/10/567639110.db2.gz FKVIXHYOVBSQSF-UHFFFAOYSA-N 0 0 377.242 3.387 20 5 GGBDRN O=[N+]([O-])c1cnn(CCSc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000531066241 567639215 /nfs/dbraw/zinc/63/92/15/567639215.db2.gz ACUWQPCZFLFUDX-UHFFFAOYSA-N 0 0 395.242 3.131 20 5 GGBDRN CN(CC1=CCSC1)c1ccc([N+](=O)[O-])c(N(C)CC2=CCSC2)n1 ZINC000596554868 567639741 /nfs/dbraw/zinc/63/97/41/567639741.db2.gz WCJJJODOMBNFBB-UHFFFAOYSA-N 0 0 378.523 3.209 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCN(Cc2cscn2)CC1 ZINC000531094099 567640387 /nfs/dbraw/zinc/64/03/87/567640387.db2.gz APVVUNCLMBWBER-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN Cn1cnc([N+](=O)[O-])c1CSc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000531106103 567640837 /nfs/dbraw/zinc/64/08/37/567640837.db2.gz LZLMGMJOCLKWQW-UHFFFAOYSA-N 0 0 395.242 3.168 20 5 GGBDRN COc1ccc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1Br ZINC000506764512 567641754 /nfs/dbraw/zinc/64/17/54/567641754.db2.gz BFDRUGJPFKVFDR-UHFFFAOYSA-N 0 0 380.198 3.077 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3cc(F)cc(Br)c3)CC2)cn1 ZINC000531143169 567643420 /nfs/dbraw/zinc/64/34/20/567643420.db2.gz LJHFQIJLCOWPKL-UHFFFAOYSA-N 0 0 395.232 3.214 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2cccc(Br)c2)CC1 ZINC000572508198 567645460 /nfs/dbraw/zinc/64/54/60/567645460.db2.gz WWSYBNBBJADDDZ-UHFFFAOYSA-N 0 0 394.273 3.209 20 5 GGBDRN COc1ccc(CC(=O)Nc2cc(C)c(Br)cn2)cc1[N+](=O)[O-] ZINC000531177295 567645648 /nfs/dbraw/zinc/64/56/48/567645648.db2.gz LAHYAEWNYTUASN-UHFFFAOYSA-N 0 0 380.198 3.251 20 5 GGBDRN Cc1c(Cn2nnc(Cc3cccc(Br)c3)n2)cccc1[N+](=O)[O-] ZINC000506848843 567645825 /nfs/dbraw/zinc/64/58/25/567645825.db2.gz NODWQRBHVWNMMB-UHFFFAOYSA-N 0 0 388.225 3.291 20 5 GGBDRN CN(CCc1ccccn1)C(=O)CNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000553378026 567648218 /nfs/dbraw/zinc/64/82/18/567648218.db2.gz ZJIBGFWFWVPSGF-UHFFFAOYSA-N 0 0 383.235 3.410 20 5 GGBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCc1cnn2ccccc12 ZINC000553376614 567648952 /nfs/dbraw/zinc/64/89/52/567648952.db2.gz 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GGBDRN CC(C)(C)n1cc(Br)c(C(=O)NCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000596896944 567662082 /nfs/dbraw/zinc/66/20/82/567662082.db2.gz OAIWRCVOHYFJBU-UHFFFAOYSA-N 0 0 395.257 3.281 20 5 GGBDRN COc1cc(OCC(=O)Nc2cc(Br)ccc2O)ccc1[N+](=O)[O-] ZINC000531492608 567662977 /nfs/dbraw/zinc/66/29/77/567662977.db2.gz CCORHLPWZSAXEF-UHFFFAOYSA-N 0 0 397.181 3.089 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCc1ccc2c(c1)CCO2 ZINC000531508663 567663063 /nfs/dbraw/zinc/66/30/63/567663063.db2.gz NSOYAXIPETURQP-UHFFFAOYSA-N 0 0 391.221 3.151 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cc(Br)ccc2O)cc([N+](=O)[O-])c1 ZINC000531492666 567663563 /nfs/dbraw/zinc/66/35/63/567663563.db2.gz LVKITOIIOZVICF-UHFFFAOYSA-N 0 0 395.165 3.102 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C1CCCCC1 ZINC000531517542 567663591 /nfs/dbraw/zinc/66/35/91/567663591.db2.gz XDVQGKJASAFXCY-CQSZACIVSA-N 0 0 399.241 3.209 20 5 GGBDRN C[C@@H]1CC[C@@H](CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000481219884 567663694 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O=[N+]([O-])c1ccc(N(CCn2ccnc2)Cc2ccc(Br)o2)nc1 ZINC000553578834 567668520 /nfs/dbraw/zinc/66/85/20/567668520.db2.gz QRQJIOYKKIFQST-UHFFFAOYSA-N 0 0 392.213 3.249 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC[C@@H]1CCN(S(=O)(=O)c2cccs2)C1 ZINC000553579088 567668590 /nfs/dbraw/zinc/66/85/90/567668590.db2.gz XDSXRMDWMVIPLS-ZDUSSCGKSA-N 0 0 381.479 3.087 20 5 GGBDRN COC(=O)c1csc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c1 ZINC000531623756 567669967 /nfs/dbraw/zinc/66/99/67/567669967.db2.gz QFSAJBOABCHJFP-UHFFFAOYSA-N 0 0 382.419 3.426 20 5 GGBDRN CNc1nccc(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000572852648 567670457 /nfs/dbraw/zinc/67/04/57/567670457.db2.gz IZWQUHPQUAOXGZ-GFCCVEGCSA-N 0 0 378.841 3.074 20 5 GGBDRN Cc1c(Br)cncc1CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000597013791 567670763 /nfs/dbraw/zinc/67/07/63/567670763.db2.gz MDGDHBNMODXOID-CYBMUJFWSA-N 0 0 392.257 3.142 20 5 GGBDRN Cc1c(Br)cncc1CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000597013794 567671338 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20 5 GGBDRN O=[N+]([O-])c1cc(I)ccc1OCCO[C@@H]1CCCCO1 ZINC000441822624 567675750 /nfs/dbraw/zinc/67/57/50/567675750.db2.gz MTGVQLLJEISZQU-CYBMUJFWSA-N 0 0 393.177 3.121 20 5 GGBDRN CN1CCN(c2ncc([N+](=O)[O-])cc2Br)C[C@H]1Cc1ccccc1 ZINC000553686287 567676427 /nfs/dbraw/zinc/67/64/27/567676427.db2.gz ABKQPJBQWDCWEH-OAHLLOKOSA-N 0 0 391.269 3.115 20 5 GGBDRN CC1(C)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C(F)(F)F)O1 ZINC000553711960 567677939 /nfs/dbraw/zinc/67/79/39/567677939.db2.gz MVYNDMWATYAJPH-LBPRGKRZSA-N 0 0 380.750 3.359 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCN(c2nccs2)CC1 ZINC000572994466 567679397 /nfs/dbraw/zinc/67/93/97/567679397.db2.gz OVCGNXOYKLGJOZ-UHFFFAOYSA-N 0 0 383.271 3.136 20 5 GGBDRN Cc1ccc(S(=O)(=O)NCc2csc(Br)c2)c([N+](=O)[O-])c1 ZINC000507408540 567679482 /nfs/dbraw/zinc/67/94/82/567679482.db2.gz QCFOYIKGLFJJPK-UHFFFAOYSA-N 0 0 391.268 3.206 20 5 GGBDRN COc1cc(C(C)=O)ccc1Sc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000441954357 567679796 /nfs/dbraw/zinc/67/97/96/567679796.db2.gz PAYBOCBXJGDAML-UHFFFAOYSA-N 0 0 381.431 3.361 20 5 GGBDRN Cc1c(CNC(=O)c2cc(Br)cnc2N(C)C)cccc1[N+](=O)[O-] ZINC000481472850 567680938 /nfs/dbraw/zinc/68/09/38/567680938.db2.gz CXMCJZFUDOBYRR-UHFFFAOYSA-N 0 0 393.241 3.057 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)N(CC1CC1)C1CCC1 ZINC000481490920 567682725 /nfs/dbraw/zinc/68/27/25/567682725.db2.gz HQNTWFDPLZGJEY-UHFFFAOYSA-N 0 0 389.271 3.311 20 5 GGBDRN Cc1c(Br)cncc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000597116556 567683912 /nfs/dbraw/zinc/68/39/12/567683912.db2.gz GSWPUBYQJYXQBF-UHFFFAOYSA-N 0 0 380.246 3.094 20 5 GGBDRN Cc1ccc2nc(CNC(=O)c3cc(Br)cc([N+](=O)[O-])c3)cn2c1 ZINC000460331757 567684482 /nfs/dbraw/zinc/68/44/82/567684482.db2.gz WIPKNDQZMQPRKT-UHFFFAOYSA-N 0 0 389.209 3.243 20 5 GGBDRN Cc1ocnc1-c1noc(-c2ccc([N+](=O)[O-])cc2I)n1 ZINC000573056406 567684923 /nfs/dbraw/zinc/68/49/23/567684923.db2.gz WYLXFNRBRQYRFI-UHFFFAOYSA-N 0 0 398.116 3.213 20 5 GGBDRN Cc1nn(CC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1Cl ZINC000460365947 567685824 /nfs/dbraw/zinc/68/58/24/567685824.db2.gz WVROCPGIIPOCMK-MRXNPFEDSA-N 0 0 380.857 3.336 20 5 GGBDRN Cc1nn(CC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1Cl ZINC000460365946 567686668 /nfs/dbraw/zinc/68/66/68/567686668.db2.gz WVROCPGIIPOCMK-INIZCTEOSA-N 0 0 380.857 3.336 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCCc2ccc(Cl)s2)c([N+](=O)[O-])c1 ZINC000531909321 567686840 /nfs/dbraw/zinc/68/68/40/567686840.db2.gz XVNAPWKTKYMKEA-UHFFFAOYSA-N 0 0 389.886 3.215 20 5 GGBDRN Cn1c(C(=O)NCC(C)(C)c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000481574952 567689604 /nfs/dbraw/zinc/68/96/04/567689604.db2.gz PXJDUALMRAXLLT-UHFFFAOYSA-N 0 0 380.242 3.403 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCCc3cccc(Br)c32)c1 ZINC000442328091 567690302 /nfs/dbraw/zinc/69/03/02/567690302.db2.gz TZFQSXWGRDTZMJ-UHFFFAOYSA-N 0 0 397.250 3.499 20 5 GGBDRN CS(=O)(=O)c1cc(SCCc2ccc3c(c2)CCO3)ccc1[N+](=O)[O-] ZINC000507610514 567690284 /nfs/dbraw/zinc/69/02/84/567690284.db2.gz VHWPDXWKVHCBGO-UHFFFAOYSA-N 0 0 379.459 3.268 20 5 GGBDRN C[C@@H](Oc1cccc(Br)c1)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000460481879 567690464 /nfs/dbraw/zinc/69/04/64/567690464.db2.gz WCOKMPHFNKJKRT-GFCCVEGCSA-N 0 0 393.237 3.484 20 5 GGBDRN COc1ccc(OCCSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)cc1 ZINC000507616781 567691118 /nfs/dbraw/zinc/69/11/18/567691118.db2.gz QBZLTVMKRXLRIP-UHFFFAOYSA-N 0 0 383.447 3.178 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(CNc2nc(C)ccc2[N+](=O)[O-])s1 ZINC000481663736 567693977 /nfs/dbraw/zinc/69/39/77/567693977.db2.gz ASMUBOVDYMJHAA-UHFFFAOYSA-N 0 0 384.483 3.002 20 5 GGBDRN Cc1nc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)ccc1Br ZINC000507659917 567695061 /nfs/dbraw/zinc/69/50/61/567695061.db2.gz LSGIKTOQIOJHFA-UHFFFAOYSA-N 0 0 394.181 3.084 20 5 GGBDRN CSC1(CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CCOCC1 ZINC000460637155 567695637 /nfs/dbraw/zinc/69/56/37/567695637.db2.gz RRASUQKWCAMGBK-LLVKDONJSA-N 0 0 388.873 3.044 20 5 GGBDRN COc1cc(OC[C@H](O)COc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000481702280 567697295 /nfs/dbraw/zinc/69/72/95/567697295.db2.gz GXFBZOVOJXUCLC-GFCCVEGCSA-N 0 0 398.209 3.185 20 5 GGBDRN COc1ccc(Br)c(CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 ZINC000573223813 567698214 /nfs/dbraw/zinc/69/82/14/567698214.db2.gz FTJUPDNCJPOUNG-UHFFFAOYSA-N 0 0 391.177 3.162 20 5 GGBDRN O=C(CCS(=O)(=O)c1ccc(F)c(Cl)c1)Nc1ccccc1[N+](=O)[O-] ZINC000507703937 567699295 /nfs/dbraw/zinc/69/92/95/567699295.db2.gz DNVZTABBRZMKOF-UHFFFAOYSA-N 0 0 386.788 3.190 20 5 GGBDRN NC(=O)c1ccnc(NCCc2nc3cc(Cl)ccc3s2)c1[N+](=O)[O-] ZINC000573261006 567699797 /nfs/dbraw/zinc/69/97/97/567699797.db2.gz XTMJSQOPHWTKHQ-UHFFFAOYSA-N 0 0 377.813 3.006 20 5 GGBDRN O=C(NCc1cnn(CC(F)(F)F)c1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532162936 567700442 /nfs/dbraw/zinc/70/04/42/567700442.db2.gz ZGNOAUQHJVWCEJ-UHFFFAOYSA-N 0 0 377.710 3.329 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1noc(-c2cccs2)n1 ZINC000553936028 567700489 /nfs/dbraw/zinc/70/04/89/567700489.db2.gz BDSMLFAXRWWEOY-UHFFFAOYSA-N 0 0 376.419 3.115 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)c1ccc(F)c(Br)c1 ZINC000507735589 567701928 /nfs/dbraw/zinc/70/19/28/567701928.db2.gz ADDUOTHZRNACQO-SECBINFHSA-N 0 0 399.220 3.269 20 5 GGBDRN COc1ccc(-c2nc(-c3ccc(Br)cn3)no2)cc1[N+](=O)[O-] ZINC000460831673 567704797 /nfs/dbraw/zinc/70/47/97/567704797.db2.gz SNOFGACGIMVKLM-UHFFFAOYSA-N 0 0 377.154 3.478 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3ccc(Br)cc3o2)cc1 ZINC000460869171 567706755 /nfs/dbraw/zinc/70/67/55/567706755.db2.gz FGUDAVCYEUBKQE-UHFFFAOYSA-N 0 0 397.206 3.472 20 5 GGBDRN O=[N+]([O-])c1cccc(OCc2nc(-c3ccc(Br)cn3)no2)c1 ZINC000460860085 567706859 /nfs/dbraw/zinc/70/68/59/567706859.db2.gz WOYQWWACERRTFU-UHFFFAOYSA-N 0 0 377.154 3.381 20 5 GGBDRN Cc1[nH]c(=O)c(Br)cc1C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000554073151 567708766 /nfs/dbraw/zinc/70/87/66/567708766.db2.gz NXFPIAHOYPAQAX-UHFFFAOYSA-N 0 0 394.225 3.431 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]CCSc2ccc(Cl)cc2)c1 ZINC000554194815 567715231 /nfs/dbraw/zinc/71/52/31/567715231.db2.gz QMWZCPRQEDXYEB-OAHLLOKOSA-N 0 0 382.869 3.370 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1ccc(F)cc1F ZINC000573515059 567718893 /nfs/dbraw/zinc/71/88/93/567718893.db2.gz ZQPPAFNSAWSPJV-UHFFFAOYSA-N 0 0 376.768 3.047 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCC2([S@](C)=O)CC2)cc1[N+](=O)[O-] ZINC000442929364 567718901 /nfs/dbraw/zinc/71/89/01/567718901.db2.gz XUPUJMCEYGKTTN-VWLOTQADSA-N 0 0 384.523 3.374 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCc3cc(Br)ccc32)ccc1[N+](=O)[O-] ZINC000532499007 567720094 /nfs/dbraw/zinc/72/00/94/567720094.db2.gz HOYBKOLQCIZJAF-UHFFFAOYSA-N 0 0 397.250 3.417 20 5 GGBDRN CC1(c2ccc(Br)cc2)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 ZINC000442982329 567721756 /nfs/dbraw/zinc/72/17/56/567721756.db2.gz LHOLDDMRDUXQOU-UHFFFAOYSA-N 0 0 393.241 3.274 20 5 GGBDRN O=[N+]([O-])c1ccc(NS(=O)(=O)CCc2ccccc2Br)cc1 ZINC000461117066 567722378 /nfs/dbraw/zinc/72/23/78/567722378.db2.gz PALHMCHEQJXBFW-UHFFFAOYSA-N 0 0 385.239 3.342 20 5 GGBDRN Cc1sc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)nc1C(C)C ZINC000597893865 567722472 /nfs/dbraw/zinc/72/24/72/567722472.db2.gz IYQDDIWTPWLRSP-UHFFFAOYSA-N 0 0 383.451 3.139 20 5 GGBDRN Cc1sc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)nc1C(C)C ZINC000597895117 567722618 /nfs/dbraw/zinc/72/26/18/567722618.db2.gz SWGIYLNOLUPKEH-UHFFFAOYSA-N 0 0 383.451 3.139 20 5 GGBDRN O=c1cc(CSc2ccc([N+](=O)[O-])cn2)nc2ccc(Br)cn12 ZINC000532589453 567723066 /nfs/dbraw/zinc/72/30/66/567723066.db2.gz LAYWUUBPJKHYOA-UHFFFAOYSA-N 0 0 393.222 3.053 20 5 GGBDRN CCN(CCOc1ccc(Br)cc1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000461185971 567724027 /nfs/dbraw/zinc/72/40/27/567724027.db2.gz FQKHDNAZNQTVBC-UHFFFAOYSA-N 0 0 382.214 3.227 20 5 GGBDRN Cc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000461212376 567725228 /nfs/dbraw/zinc/72/52/28/567725228.db2.gz PXESIXZXPLOLDJ-UHFFFAOYSA-N 0 0 385.239 3.491 20 5 GGBDRN CNc1ccc(C(=O)NCc2ccc(O)c(Br)c2)cc1[N+](=O)[O-] ZINC000532635790 567726710 /nfs/dbraw/zinc/72/67/10/567726710.db2.gz ZAMGEFLNLAGPGV-UHFFFAOYSA-N 0 0 380.198 3.035 20 5 GGBDRN COCC1(N(C)C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000597941162 567728892 /nfs/dbraw/zinc/72/88/92/567728892.db2.gz RQFKAOWSBNXWAP-UHFFFAOYSA-N 0 0 378.372 3.343 20 5 GGBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC(C)(C)O[C@@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000443090542 567731183 /nfs/dbraw/zinc/73/11/83/567731183.db2.gz YFMAVTHBRUSEIJ-UKRRQHHQSA-N 0 0 388.873 3.277 20 5 GGBDRN Cn1c(C(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000597998447 567731605 /nfs/dbraw/zinc/73/16/05/567731605.db2.gz NRISOWJORLTJOM-UHFFFAOYSA-N 0 0 383.235 3.203 20 5 GGBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1[C@@H](C)CO ZINC000598021082 567732753 /nfs/dbraw/zinc/73/27/53/567732753.db2.gz QLJXPRCNCKSBOX-BONVTDFDSA-N 0 0 385.258 3.289 20 5 GGBDRN Cc1cc(Br)oc1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461398010 567733640 /nfs/dbraw/zinc/73/36/40/567733640.db2.gz FAMOUKRWHJLXFB-UHFFFAOYSA-N 0 0 381.182 3.294 20 5 GGBDRN CCCCNC(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000508165939 567734249 /nfs/dbraw/zinc/73/42/49/567734249.db2.gz UIOBKGCIUOTIIH-UHFFFAOYSA-N 0 0 382.214 3.201 20 5 GGBDRN O=C(c1ccc(Br)cc1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461410195 567734774 /nfs/dbraw/zinc/73/47/74/567734774.db2.gz ZORGKUNGMSTELA-UHFFFAOYSA-N 0 0 377.194 3.392 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CC(Oc3cccc(Cl)c3Cl)C2)c1[N+](=O)[O-] ZINC000598063563 567737296 /nfs/dbraw/zinc/73/72/96/567737296.db2.gz AWGVKZHNNKDOLO-UHFFFAOYSA-N 0 0 385.207 3.091 20 5 GGBDRN C[NH+](C)CCN(Cc1cccs1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000573805540 567737247 /nfs/dbraw/zinc/73/72/47/567737247.db2.gz ZATVEBLNWRYQMN-UHFFFAOYSA-N 0 0 383.857 3.219 20 5 GGBDRN COc1ccccc1CS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000443187222 567738856 /nfs/dbraw/zinc/73/88/56/567738856.db2.gz ANHCAMZOACVSHN-UHFFFAOYSA-N 0 0 386.223 3.340 20 5 GGBDRN Cn1nc([N+](=O)[O-])cc1-c1nc(C(C)(C)c2ccccc2Br)no1 ZINC000573851475 567740083 /nfs/dbraw/zinc/74/00/83/567740083.db2.gz QRFSHQIHERBHHC-UHFFFAOYSA-N 0 0 392.213 3.467 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2cccc3ccsc32)cc1[N+](=O)[O-] ZINC000508258211 567740607 /nfs/dbraw/zinc/74/06/07/567740607.db2.gz DSLDLXAJDOPFIM-UHFFFAOYSA-N 0 0 376.415 3.465 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc([S@@](C)=O)cc2)cc1SC ZINC000461629334 567741168 /nfs/dbraw/zinc/74/11/68/567741168.db2.gz RGMUQOKIXFDTDE-RUZDIDTESA-N 0 0 380.447 3.315 20 5 GGBDRN Cc1ccccc1-c1nc(CNc2c(Br)cncc2[N+](=O)[O-])no1 ZINC000554679619 567741964 /nfs/dbraw/zinc/74/19/64/567741964.db2.gz UCDJRVOSQDLGHI-UHFFFAOYSA-N 0 0 390.197 3.145 20 5 GGBDRN O=C(Nc1nc2ccc(Cl)cn2n1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000508316977 567742871 /nfs/dbraw/zinc/74/28/71/567742871.db2.gz HFVSEYNLIVTMHG-UHFFFAOYSA-N 0 0 396.588 3.306 20 5 GGBDRN C[C@@H](O)CN(Cc1ccccc1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000532898330 567743204 /nfs/dbraw/zinc/74/32/04/567743204.db2.gz JBNNQLVQEXDFAM-GFCCVEGCSA-N 0 0 393.237 3.381 20 5 GGBDRN O=C(CSCc1ccncc1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000461681767 567743412 /nfs/dbraw/zinc/74/34/12/567743412.db2.gz MLCIPYFJRRTVRO-QGZVFWFLSA-N 0 0 375.475 3.497 20 5 GGBDRN Cn1cnc(-c2ccc(Br)cc2)c1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000508385564 567745738 /nfs/dbraw/zinc/74/57/38/567745738.db2.gz WWHFDWRIZAFRTP-UHFFFAOYSA-N 0 0 390.197 3.338 20 5 GGBDRN Cn1ncc(C2CC2)c1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000598211374 567746879 /nfs/dbraw/zinc/74/68/79/567746879.db2.gz PMOKSQDQERCFCB-UHFFFAOYSA-N 0 0 380.857 3.268 20 5 GGBDRN Cc1c(Br)cc(C(=O)NCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000508400565 567747184 /nfs/dbraw/zinc/74/71/84/567747184.db2.gz CJUJPUWZJPVGQZ-UHFFFAOYSA-N 0 0 393.193 3.324 20 5 GGBDRN Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NCCC(C)(C)F ZINC000598199214 567747523 /nfs/dbraw/zinc/74/75/23/567747523.db2.gz OKPLQYJWXNSJRU-UHFFFAOYSA-N 0 0 394.184 3.376 20 5 GGBDRN COC(=O)[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000533054764 567748523 /nfs/dbraw/zinc/74/85/23/567748523.db2.gz POEWNLVBIAZOEB-HNNXBMFYSA-N 0 0 379.210 3.361 20 5 GGBDRN COC(=O)[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000533054852 567748597 /nfs/dbraw/zinc/74/85/97/567748597.db2.gz WURXSKHBERFFOJ-OAHLLOKOSA-N 0 0 379.210 3.361 20 5 GGBDRN CC(=O)N1C[C@@H]2CCC[C@@H](Nc3ccc([N+](=O)[O-])cc3Br)[C@@H]2C1 ZINC000573995628 567749044 /nfs/dbraw/zinc/74/90/44/567749044.db2.gz LDUGUEVMQUPJEB-NJZAAPMLSA-N 0 0 382.258 3.416 20 5 GGBDRN O=C(CN1CCc2cc(Br)ccc21)Nc1ccccc1[N+](=O)[O-] ZINC000533079474 567749553 /nfs/dbraw/zinc/74/95/53/567749553.db2.gz JHKCKTMZXZOEBP-UHFFFAOYSA-N 0 0 376.210 3.359 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(C)(C)c2ccc(Br)cc21 ZINC000598232959 567749733 /nfs/dbraw/zinc/74/97/33/567749733.db2.gz JAVQQEQOBWPKQJ-UHFFFAOYSA-N 0 0 393.241 3.187 20 5 GGBDRN C[C@@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Br)s1 ZINC000443336917 567750209 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Cc1ccnc(N2CC[C@H](Oc3cncc(Br)c3)C2)c1[N+](=O)[O-] ZINC000599108099 567805426 /nfs/dbraw/zinc/80/54/26/567805426.db2.gz RGMBDMGWJGMDTJ-LBPRGKRZSA-N 0 0 379.214 3.113 20 5 GGBDRN Cc1c(Br)c(N[C@@H]2CCO[C@H](c3cnn(C)c3)C2)ncc1[N+](=O)[O-] ZINC000599106802 567805469 /nfs/dbraw/zinc/80/54/69/567805469.db2.gz HJEXBTYQHHPIER-YPMHNXCESA-N 0 0 396.245 3.126 20 5 GGBDRN O=[N+]([O-])c1c(N2CCC(Oc3cncc(Cl)c3)CC2)nc2sccn21 ZINC000599097258 567805835 /nfs/dbraw/zinc/80/58/35/567805835.db2.gz CLQMLXSWYVQYFZ-UHFFFAOYSA-N 0 0 379.829 3.400 20 5 GGBDRN O=[N+]([O-])c1cncc(Cl)c1N1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000599108527 567805873 /nfs/dbraw/zinc/80/58/73/567805873.db2.gz URMSFXOTUQHIRO-JTQLQIEISA-N 0 0 399.632 3.458 20 5 GGBDRN COC(=O)c1cnc(C2CCN(c3c(Cl)cncc3[N+](=O)[O-])CC2)s1 ZINC000599136176 567807163 /nfs/dbraw/zinc/80/71/63/567807163.db2.gz JURSVHVTUXDFSL-UHFFFAOYSA-N 0 0 382.829 3.270 20 5 GGBDRN CCC[C@@]1(CO)CCCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000444536573 567807468 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383.404 3.294 20 5 GGBDRN Cc1nc2ccc(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)cc2s1 ZINC000006561712 570478337 /nfs/dbraw/zinc/47/83/37/570478337.db2.gz XXLFFCSYKCXONQ-UHFFFAOYSA-N 0 0 391.430 3.169 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccc(N(C)C)cc2)no1 ZINC000036000495 570506407 /nfs/dbraw/zinc/50/64/07/570506407.db2.gz CMWTUCCDEUATCE-GFCCVEGCSA-N 0 0 381.392 3.202 20 5 GGBDRN O=C(N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000024334676 570511361 /nfs/dbraw/zinc/51/13/61/570511361.db2.gz GQOACPMWAHEGGC-QGZVFWFLSA-N 0 0 389.839 3.052 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1oc2ccccc2c1C ZINC000005311068 570551751 /nfs/dbraw/zinc/55/17/51/570551751.db2.gz TYMYAUQBYZEWNE-UHFFFAOYSA-N 0 0 384.344 3.454 20 5 GGBDRN O=C1c2ccccc2C(=O)N1CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000004336313 570574681 /nfs/dbraw/zinc/57/46/81/570574681.db2.gz NKNKJTQNMPSEMM-UHFFFAOYSA-N 0 0 379.294 3.322 20 5 GGBDRN CCOc1cc2c(cc1CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1)O[C@@H](C)C2 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570870282 /nfs/dbraw/zinc/87/02/82/570870282.db2.gz LTJLUFXAXICUSC-UHFFFAOYSA-N 0 0 394.767 3.061 20 5 GGBDRN COc1ccc(C(=O)Nc2nc3ccccc3nc2N2CCCC2)cc1[N+](=O)[O-] ZINC000032871770 570873780 /nfs/dbraw/zinc/87/37/80/570873780.db2.gz SBEPWVQAUAJIPR-UHFFFAOYSA-N 0 0 393.403 3.399 20 5 GGBDRN O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)Nc2ncc(C(F)(F)F)cc2Cl)cc1 ZINC000024527627 570887496 /nfs/dbraw/zinc/88/74/96/570887496.db2.gz UKEKRUWTNRFOOU-CHWSQXEVSA-N 0 0 391.733 3.168 20 5 GGBDRN COCCn1c(C)c(C)nc1SCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000032893943 570890563 /nfs/dbraw/zinc/89/05/63/570890563.db2.gz AWPXPARSNKIWOA-UHFFFAOYSA-N 0 0 398.872 3.439 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)Cc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000014376121 570905127 /nfs/dbraw/zinc/90/51/27/570905127.db2.gz GJBRGZRRKCKTQJ-KRWDZBQOSA-N 0 0 388.395 3.476 20 5 GGBDRN Cc1noc2nc(C3CC3)cc(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)c12 ZINC000014529067 570905958 /nfs/dbraw/zinc/90/59/58/570905958.db2.gz NCMCKIIZVVRHKR-UHFFFAOYSA-N 0 0 381.392 3.159 20 5 GGBDRN C[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C1CCCCC1 ZINC000032910699 570914147 /nfs/dbraw/zinc/91/41/47/570914147.db2.gz UPUYCFAMBFAOIC-CYBMUJFWSA-N 0 0 380.466 3.410 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H](C)CC(=O)c1ccccc1 ZINC000084086289 570997121 /nfs/dbraw/zinc/99/71/21/570997121.db2.gz LFBYFWOCOUBKQI-AWEZNQCLSA-N 0 0 376.434 3.151 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](C)Cc2nc3ccccc3s2)ccc1[N+](=O)[O-] ZINC000084101513 570998362 /nfs/dbraw/zinc/99/83/62/570998362.db2.gz YAUIQYHGZFIWJZ-GFCCVEGCSA-N 0 0 391.474 3.422 20 5 GGBDRN O=C(COC(=O)c1ccc(O)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000005754298 571000012 /nfs/dbraw/zinc/00/00/12/571000012.db2.gz XNRPWKHNRIPQMJ-UHFFFAOYSA-N 0 0 384.266 3.115 20 5 GGBDRN Cc1cccc(C(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000084225710 571009976 /nfs/dbraw/zinc/00/99/76/571009976.db2.gz JLBIIUYYCMESPQ-AWEZNQCLSA-N 0 0 377.441 3.280 20 5 GGBDRN Cc1ccc([C@@H]2OCCC[C@@H]2CNc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000822233066 599108542 /nfs/dbraw/zinc/10/85/42/599108542.db2.gz HMNRTNBQQRBDTH-PBHICJAKSA-N 0 0 395.423 3.058 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OCc1ccc(F)c(-c2nn[nH]n2)c1 ZINC000823646885 607259265 /nfs/dbraw/zinc/25/92/65/607259265.db2.gz CCXAHGQTCTVVLH-UHFFFAOYSA-N 0 0 394.160 3.256 20 5 GGBDRN O=[N+]([O-])c1cc(CSc2ccc(-c3nn[nH]n3)cc2F)c2c(c1)COCO2 ZINC000738361729 599174869 /nfs/dbraw/zinc/17/48/69/599174869.db2.gz ZHYWKNVUIHDDJG-UHFFFAOYSA-N 0 0 389.368 3.073 20 5 GGBDRN CCN(C(=O)c1cc(C)ccc1[N+](=O)[O-])[C@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000736505774 599183118 /nfs/dbraw/zinc/18/31/18/599183118.db2.gz MVMLVZVXFZTLFJ-CYBMUJFWSA-N 0 0 380.408 3.307 20 5 GGBDRN CN(Cc1ccc(Cl)cc1Cl)c1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000821609814 599214818 /nfs/dbraw/zinc/21/48/18/599214818.db2.gz MZCJBWRSFMQWAK-UHFFFAOYSA-N 0 0 380.195 3.113 20 5 GGBDRN O=Cc1cc(Oc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)ccc1Br ZINC000823557882 607306237 /nfs/dbraw/zinc/30/62/37/607306237.db2.gz UQFTYBBVMUSDDL-UHFFFAOYSA-N 0 0 390.153 3.142 20 5 GGBDRN C[C@H](Cc1cccs1)Nc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000736066246 599269272 /nfs/dbraw/zinc/26/92/72/599269272.db2.gz MIRNGZOBTNLYMB-SNVBAGLBSA-N 0 0 381.421 3.428 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cccc1-c1nn[nH]n1 ZINC000822061198 607321691 /nfs/dbraw/zinc/32/16/91/607321691.db2.gz KVVNQUOEBBLXDV-LLVKDONJSA-N 0 0 384.421 3.203 20 5 GGBDRN CC(C)(C)OCc1cccc(CNc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)c1 ZINC000735639691 598298762 /nfs/dbraw/zinc/29/87/62/598298762.db2.gz NFCRFCKHEQTRTM-UHFFFAOYSA-N 0 0 383.412 3.097 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000737369519 598333246 /nfs/dbraw/zinc/33/32/46/598333246.db2.gz VSQXWTMKTAHNRM-LBPRGKRZSA-N 0 0 381.396 3.274 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Sc2ccc(-c3nn[nH]n3)cc2)cccc1[N+](=O)[O-] ZINC000737218986 598417410 /nfs/dbraw/zinc/41/74/10/598417410.db2.gz OBUNAIZMQDFYGS-NSHDSACASA-N 0 0 384.421 3.203 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccc(-c2nn[nH]n2)cc1)C1CC1 ZINC000737373285 598475156 /nfs/dbraw/zinc/47/51/56/598475156.db2.gz SOLQBVKIEKVRSC-UHFFFAOYSA-N 0 0 393.407 3.280 20 5 GGBDRN C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(-c2nn[nH]n2)c1 ZINC000736160496 598484905 /nfs/dbraw/zinc/48/49/05/598484905.db2.gz QQCZNBVLMSGQTK-SNVBAGLBSA-N 0 0 378.348 3.174 20 5 GGBDRN C[C@@H](OC(=O)CSc1ccc(-c2nn[nH]n2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000736155042 598653027 /nfs/dbraw/zinc/65/30/27/598653027.db2.gz GFXQCJBKUPKKSL-LLVKDONJSA-N 0 0 385.405 3.171 20 5 GGBDRN C[C@H](OC(=O)CSc1ccc(-c2nn[nH]n2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000736155043 598653261 /nfs/dbraw/zinc/65/32/61/598653261.db2.gz GFXQCJBKUPKKSL-NSHDSACASA-N 0 0 385.405 3.171 20 5 GGBDRN O=C(CCCCOc1cccc(-c2nn[nH]n2)c1)OCc1ccccc1[N+](=O)[O-] ZINC000737841976 598727080 /nfs/dbraw/zinc/72/70/80/598727080.db2.gz ROURKMPHFHJEIB-UHFFFAOYSA-N 0 0 397.391 3.067 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H](c2nccs2)c2ccccc2)c(-c2nn[nH]n2)c1 ZINC000738370933 598757916 /nfs/dbraw/zinc/75/79/16/598757916.db2.gz SSVZBXPSBSJEOO-HNNXBMFYSA-N 0 0 379.405 3.433 20 5 GGBDRN CC(C)Oc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1-c1nn[nH]n1 ZINC000820174314 607367154 /nfs/dbraw/zinc/36/71/54/607367154.db2.gz RMOXAMNJYPGTBE-UHFFFAOYSA-N 0 0 399.436 3.371 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@H](O)c2cc(Cl)cc(Cl)c2)c(-c2nn[nH]n2)c1 ZINC000738368417 599306567 /nfs/dbraw/zinc/30/65/67/599306567.db2.gz DGMBGAJUURATNM-AWEZNQCLSA-N 0 0 395.206 3.227 20 5 GGBDRN O=C(CSc1ccccc1-c1nn[nH]n1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000823070514 599343494 /nfs/dbraw/zinc/34/34/94/599343494.db2.gz BPVPUZVVVQASIK-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN O=C(Nc1ccc(-c2nn[nH]n2)c(Cl)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000738151614 599370553 /nfs/dbraw/zinc/37/05/53/599370553.db2.gz JSWOZKVDNPUVNE-UHFFFAOYSA-N 0 0 379.163 3.334 20 5 GGBDRN O=[N+]([O-])c1cccc2ccc(C=Cc3cnc4ccc(-c5nn[nH]n5)cn34)nc21 ZINC000738368688 599461743 /nfs/dbraw/zinc/46/17/43/599461743.db2.gz IQQRFMCYWINMOU-BQYQJAHWSA-N 0 0 384.359 3.141 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1Nc1ccc(OCC2CCOCC2)cc1 ZINC000738357168 599472930 /nfs/dbraw/zinc/47/29/30/599472930.db2.gz DSOIZFQFUATVLD-UHFFFAOYSA-N 0 0 396.407 3.324 20 5 GGBDRN C[C@H]1CCCC[C@H]1OCCNc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000820705928 599476816 /nfs/dbraw/zinc/47/68/16/599476816.db2.gz WVQDXDNPZUSSHT-YVEFUNNKSA-N 0 0 397.439 3.330 20 5 GGBDRN Cc1nc([C@@H](C)Nc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)cs1 ZINC000822427799 599545394 /nfs/dbraw/zinc/54/53/94/599545394.db2.gz VMKWRSMIRRLMRB-MRVPVSSYSA-N 0 0 382.409 3.261 20 5 GGBDRN CCO[C@@H]1C[C@@H](Nc2cc(-c3nn[nH]n3)c3cc([N+](=O)[O-])ccc3n2)C12CCC2 ZINC000821358026 599586621 /nfs/dbraw/zinc/58/66/21/599586621.db2.gz GUHIZDIGUIUMTC-HZPDHXFCSA-N 0 0 395.423 3.083 20 5 GGBDRN O=C([O-])c1cc(C(=O)NCc2ccccc2C[NH+]2CCCCC2)cc([N+](=O)[O-])c1 ZINC000738672470 599746030 /nfs/dbraw/zinc/74/60/30/599746030.db2.gz HBAHWMMHIDELAV-UHFFFAOYSA-N 0 0 397.431 3.209 20 5 GGBDRN COc1cc(C[NH2+][C@H](C(=O)[O-])c2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000737885866 599783087 /nfs/dbraw/zinc/78/30/87/599783087.db2.gz KMQAHULYFIWGHQ-HNNXBMFYSA-N 0 0 382.319 3.120 20 5 GGBDRN COc1cc(C[NH2+][C@@H](C(=O)[O-])c2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000737885867 599783191 /nfs/dbraw/zinc/78/31/91/599783191.db2.gz KMQAHULYFIWGHQ-OAHLLOKOSA-N 0 0 382.319 3.120 20 5 GGBDRN O=C([O-])[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000739499909 599789538 /nfs/dbraw/zinc/78/95/38/599789538.db2.gz LFUYELMROTZMOZ-OAHLLOKOSA-N 0 0 395.209 3.152 20 5 GGBDRN O=C([O-])[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000739499905 599789572 /nfs/dbraw/zinc/78/95/72/599789572.db2.gz LFUYELMROTZMOZ-HNNXBMFYSA-N 0 0 395.209 3.152 20 5 GGBDRN O=C([O-])[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000739499154 599792234 /nfs/dbraw/zinc/79/22/34/599792234.db2.gz FXWGUBZLFKKJDN-OAHLLOKOSA-N 0 0 395.209 3.152 20 5 GGBDRN C[C@H](C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1)C(=O)[O-] ZINC000736583189 599888448 /nfs/dbraw/zinc/88/84/48/599888448.db2.gz LJVOQWYDKLRWQV-CQSZACIVSA-N 0 0 396.403 3.368 20 5 GGBDRN C[C@@H](C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1)C(=O)[O-] ZINC000736583188 599888458 /nfs/dbraw/zinc/88/84/58/599888458.db2.gz LJVOQWYDKLRWQV-AWEZNQCLSA-N 0 0 396.403 3.368 20 5 GGBDRN O=C([O-])c1sc2ccccc2c1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000740281121 599937935 /nfs/dbraw/zinc/93/79/35/599937935.db2.gz QAHHQBSSNAHAJZ-UHFFFAOYSA-N 0 0 398.444 3.225 20 5 GGBDRN O=C([O-])c1cc(C(=O)NC[C@@H]2CCC[N@@H+]2CC2CCCCC2)cc([N+](=O)[O-])c1 ZINC000740067123 599998113 /nfs/dbraw/zinc/99/81/13/599998113.db2.gz JREPVPXKMCCTPI-KRWDZBQOSA-N 0 0 389.452 3.068 20 5 GGBDRN C[C@@]([NH2+]CCc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])c1cccc(Br)c1 ZINC000736665788 600078842 /nfs/dbraw/zinc/07/88/42/600078842.db2.gz ZECIGTCATKICCF-KRWDZBQOSA-N 0 0 393.237 3.489 20 5 GGBDRN C[C@@]([NH2+]Cc1ccccc1[N+](=O)[O-])(C(=O)[O-])c1cccc(Br)c1 ZINC000736664679 600078848 /nfs/dbraw/zinc/07/88/48/600078848.db2.gz QLOUVIUOLHEYNQ-INIZCTEOSA-N 0 0 379.210 3.447 20 5 GGBDRN C[C@]([NH2+]Cc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])c1cccc(Br)c1 ZINC000736665801 600079191 /nfs/dbraw/zinc/07/91/91/600079191.db2.gz ZHCOMUMGMZJQET-MRXNPFEDSA-N 0 0 379.210 3.447 20 5 GGBDRN CCc1c(C)sc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1-c1nn[nH]n1 ZINC000825687956 607431756 /nfs/dbraw/zinc/43/17/56/607431756.db2.gz ORMQGMUMXVTUBE-UHFFFAOYSA-N 0 0 386.437 3.197 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000736785354 600259866 /nfs/dbraw/zinc/25/98/66/600259866.db2.gz SDKLHGCOIHKKAM-GJZGRUSLSA-N 0 0 389.452 3.020 20 5 GGBDRN C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000736785353 600259880 /nfs/dbraw/zinc/25/98/80/600259880.db2.gz SDKLHGCOIHKKAM-CABCVRRESA-N 0 0 389.452 3.020 20 5 GGBDRN O=C([O-])/C=C\c1ccc(NCC2([NH+]3CCCCC3)CCOCC2)c([N+](=O)[O-])c1 ZINC000739623458 600260640 /nfs/dbraw/zinc/26/06/40/600260640.db2.gz FMRPKBCOLQIOOV-ALCCZGGFSA-N 0 0 389.452 3.140 20 5 GGBDRN COc1ccc(C[N@H+](CCC(=O)[O-])Cc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000593747167 600327658 /nfs/dbraw/zinc/32/76/58/600327658.db2.gz UTIIMICXOYFPME-UHFFFAOYSA-N 0 0 380.347 3.359 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+](C)C[C@@H](C)C(=O)[O-])c([N+](=O)[O-])c1 ZINC000263376164 600373916 /nfs/dbraw/zinc/37/39/16/600373916.db2.gz WPZIKNBXOVTVIR-RDTXWAMCSA-N 0 0 385.420 3.236 20 5 GGBDRN O=C([O-])c1cc(NC(=O)C2CC[NH+](Cc3ccccc3)CC2)cc([N+](=O)[O-])c1 ZINC000740080692 600541645 /nfs/dbraw/zinc/54/16/45/600541645.db2.gz HVDIHLTXCSPZMA-UHFFFAOYSA-N 0 0 383.404 3.144 20 5 GGBDRN C[C@@H](C[N@@H+](Cc1ccccc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)[O-] ZINC000736581746 600685129 /nfs/dbraw/zinc/68/51/29/600685129.db2.gz DAGSWEFQULZBTD-HNNXBMFYSA-N 0 0 395.419 3.034 20 5 GGBDRN C[C@@H](C[N@@H+](Cc1ccccc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)[O-] ZINC000736585052 600685673 /nfs/dbraw/zinc/68/56/73/600685673.db2.gz RQMRUAOJGIPCRI-HNNXBMFYSA-N 0 0 395.419 3.034 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c(-c2nn[nH]n2)c1 ZINC000823640186 607468886 /nfs/dbraw/zinc/46/88/86/607468886.db2.gz WUSJQRYDHCWZMB-KDOFPFPSSA-N 0 0 398.398 3.007 20 5 GGBDRN C[C@@H](CC[NH+](C)C)Nc1ccc(C(=O)c2ccccc2C(=O)[O-])cc1[N+](=O)[O-] ZINC000827412799 600811209 /nfs/dbraw/zinc/81/12/09/600811209.db2.gz SJTHUYHPXNVPPY-ZDUSSCGKSA-N 0 0 385.420 3.276 20 5 GGBDRN C[C@@H]1C[C@H](Nc2ccc(C(=O)c3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000828184381 600818178 /nfs/dbraw/zinc/81/81/78/600818178.db2.gz PSGYVAKVYMQSLO-UKRRQHHQSA-N 0 0 397.431 3.419 20 5 GGBDRN CN(C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000830524393 600984109 /nfs/dbraw/zinc/98/41/09/600984109.db2.gz XIGACYWEFGUEIY-GOSISDBHSA-N 0 0 397.431 3.030 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccccc1)C[C@H](C)C(=O)[O-] ZINC000832905473 600993978 /nfs/dbraw/zinc/99/39/78/600993978.db2.gz NXXNCHQDPBVWAX-HNNXBMFYSA-N 0 0 385.420 3.065 20 5 GGBDRN O=C([O-])c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NC1CC[NH+](C2CCCCC2)CC1 ZINC000833307969 601202135 /nfs/dbraw/zinc/20/21/35/601202135.db2.gz SYGYGQQIOPHHFY-UHFFFAOYSA-N 0 0 392.412 3.410 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832958503 601203643 /nfs/dbraw/zinc/20/36/43/601203643.db2.gz IFNQHRSHPHCMEC-LIRRHRJNSA-N 0 0 385.420 3.283 20 5 GGBDRN C[C@H](C(=O)[O-])[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000826055093 601204047 /nfs/dbraw/zinc/20/40/47/601204047.db2.gz VPAZCYNXQSCKHZ-GTNSWQLSSA-N 0 0 391.811 3.238 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000832905408 601206515 /nfs/dbraw/zinc/20/65/15/601206515.db2.gz IRALPGYRPNKIPH-IFXJQAMLSA-N 0 0 385.420 3.283 20 5 GGBDRN O=C([O-])[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)cc1 ZINC000833170616 601353965 /nfs/dbraw/zinc/35/39/65/601353965.db2.gz ZMYSACYSORYGMR-AWEZNQCLSA-N 0 0 383.173 3.412 20 5 GGBDRN O=C([O-])[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)cc1 ZINC000833170618 601353973 /nfs/dbraw/zinc/35/39/73/601353973.db2.gz ZMYSACYSORYGMR-CQSZACIVSA-N 0 0 383.173 3.412 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2C[C@H](C)[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])c1 ZINC000832941976 601527691 /nfs/dbraw/zinc/52/76/91/601527691.db2.gz PYSQEBLBIWBMTC-QOKNQOGYSA-N 0 0 397.431 3.236 20 5 GGBDRN COc1cc(C[NH2+]C2(CC(=O)[O-])CCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000832000476 601553700 /nfs/dbraw/zinc/55/37/00/601553700.db2.gz PELDUTBQKLIXSY-UHFFFAOYSA-N 0 0 388.367 3.472 20 5 GGBDRN C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830791590 601899126 /nfs/dbraw/zinc/89/91/26/601899126.db2.gz GQMJEGHKOGOEJS-INIZCTEOSA-N 0 0 384.310 3.149 20 5 GGBDRN C[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H](C(=O)[O-])c1cc(F)c(F)c(F)c1 ZINC000830795496 601906208 /nfs/dbraw/zinc/90/62/08/601906208.db2.gz VAXIXKURHMZZIM-MRXNPFEDSA-N 0 0 384.310 3.149 20 5 GGBDRN COc1ccc(CSCCOc2cccc([N+](=O)[O-])c2)cc1-c1nn[nH]n1 ZINC000826208001 607534321 /nfs/dbraw/zinc/53/43/21/607534321.db2.gz OHQDHBSAAKTWBP-UHFFFAOYSA-N 0 0 387.421 3.096 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)NC1(c2cccc(-c3nn[nH]n3)c2)CC1 ZINC000826455459 607674368 /nfs/dbraw/zinc/67/43/68/607674368.db2.gz PDYBCLXSNABNSV-UHFFFAOYSA-N 0 0 399.798 3.239 20 5 GGBDRN O=C([O-])c1cc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1Cl ZINC000833308158 604802112 /nfs/dbraw/zinc/80/21/12/604802112.db2.gz XSOSXNAGDZXDPS-XHDPSFHLSA-N 0 0 379.844 3.400 20 5 GGBDRN CC(C)(C(=O)[O-])[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000833421538 604948278 /nfs/dbraw/zinc/94/82/78/604948278.db2.gz QZEXZLBKXHJOLP-NSHDSACASA-N 0 0 383.832 3.010 20 5 GGBDRN CC(C)(C)Oc1cc(NCCC[NH+]2CCC(C(=O)[O-])CC2)ccc1[N+](=O)[O-] ZINC000592981029 605040761 /nfs/dbraw/zinc/04/07/61/605040761.db2.gz STFSPMZIIFUJDK-UHFFFAOYSA-N 0 0 379.457 3.371 20 5 GGBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)c1cc(-c2nn[nH]n2)c[nH]1 ZINC000823368036 606277706 /nfs/dbraw/zinc/27/77/06/606277706.db2.gz SEVODLRSXMZEMY-UHFFFAOYSA-N 0 0 391.347 3.148 20 5 GGBDRN CCNc1ccc(C(=O)O[C@H](C)c2ccc(-c3nn[nH]n3)cc2)cc1[N+](=O)[O-] ZINC000821308998 606346624 /nfs/dbraw/zinc/34/66/24/606346624.db2.gz IVXYJFXKYQIHFN-LLVKDONJSA-N 0 0 382.380 3.125 20 5 GGBDRN CN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1cc(Cl)ccc1-c1nn[nH]n1 ZINC000821573528 606414921 /nfs/dbraw/zinc/41/49/21/606414921.db2.gz UIKMUFKDOXEILQ-UHFFFAOYSA-N 0 0 393.190 3.358 20 5 GGBDRN CC(C)[C@H]1OCCC[C@@H]1CNc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000820047305 606426926 /nfs/dbraw/zinc/42/69/26/606426926.db2.gz XBEGZUMLCSQVBP-KZULUSFZSA-N 0 0 397.439 3.186 20 5 GGBDRN CC(C)[C@@H]1OCCC[C@@H]1CNc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000820047310 606427046 /nfs/dbraw/zinc/42/70/46/606427046.db2.gz XBEGZUMLCSQVBP-XIKOKIGWSA-N 0 0 397.439 3.186 20 5 GGBDRN Cc1ccc(C)c([C@@H]2CN(c3ccc([N+](=O)[O-])cc3-c3nn[nH]n3)[C@@H](C)CO2)c1 ZINC000822231702 606475973 /nfs/dbraw/zinc/47/59/73/606475973.db2.gz DTQKQONCHMYEKN-LIRRHRJNSA-N 0 0 394.435 3.358 20 5 GGBDRN Cn1c2ccccc2nc1[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000822596500 606637592 /nfs/dbraw/zinc/63/75/92/606637592.db2.gz MUQOZYKNGRTRFY-QGZVFWFLSA-N 0 0 390.407 3.003 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1NCC1(c2ccc(F)cc2)CCCC1 ZINC000823619741 606698640 /nfs/dbraw/zinc/69/86/40/606698640.db2.gz AISZMXLFPVXTAC-UHFFFAOYSA-N 0 0 383.387 3.233 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1NCc1nc2cc(Cl)ccc2s1 ZINC000823624713 606703888 /nfs/dbraw/zinc/70/38/88/606703888.db2.gz FYMYNEQZGZZJBA-UHFFFAOYSA-N 0 0 388.800 3.045 20 5 GGBDRN CC(C)(C)OCc1cccc(CNc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])c1 ZINC000819950247 606706353 /nfs/dbraw/zinc/70/63/53/606706353.db2.gz GFNYUYOREUCOJX-UHFFFAOYSA-N 0 0 383.412 3.097 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NCc1nnc(-c2cccc(-c3nn[nH]n3)c2)o1 ZINC000822271181 606707035 /nfs/dbraw/zinc/70/70/35/606707035.db2.gz PNGCXMRKAJYKQR-UHFFFAOYSA-N 0 0 392.379 3.054 20 5 GGBDRN CC1CCN(c2cccc(Nc3nccc(-c4nn[nH]n4)c3[N+](=O)[O-])c2)CC1 ZINC000820727513 606711994 /nfs/dbraw/zinc/71/19/94/606711994.db2.gz MLNPLLYUVFYOPO-UHFFFAOYSA-N 0 0 380.412 3.150 20 5 GGBDRN CC[C@@H](C)Oc1cc(C)ccc1CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] ZINC000820875425 606719511 /nfs/dbraw/zinc/71/95/11/606719511.db2.gz AERPPHZOULEVSV-GFCCVEGCSA-N 0 0 383.412 3.268 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])n1 ZINC000822197719 606722982 /nfs/dbraw/zinc/72/29/82/606722982.db2.gz MNHLGWGHLVHSJH-UHFFFAOYSA-N 0 0 390.407 3.190 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1OCCCOc1cccc(-c2nn[nH]n2)c1 ZINC000823646889 606839755 /nfs/dbraw/zinc/83/97/55/606839755.db2.gz CHCBSDKGBRRRAM-UHFFFAOYSA-N 0 0 375.772 3.276 20 5 GGBDRN O=C(CSc1cccc(-c2nn[nH]n2)c1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000823070614 607015487 /nfs/dbraw/zinc/01/54/87/607015487.db2.gz HGZGVPHQVFGRTF-UHFFFAOYSA-N 0 0 390.812 3.159 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCCCC[C@H]2C[C@@H](O)c2ccco2)c(-c2nn[nH]n2)c1 ZINC000823639658 607048403 /nfs/dbraw/zinc/04/84/03/607048403.db2.gz FFYVXMSNCXEOJJ-SUMWQHHRSA-N 0 0 398.423 3.241 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N[C@H]3CCOC4(CCCC4)C3)cc(-c3nn[nH]n3)c2c1 ZINC000823646000 607130693 /nfs/dbraw/zinc/13/06/93/607130693.db2.gz ZGECCCOVVNVHML-LBPRGKRZSA-N 0 0 395.423 3.227 20 5 GGBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Sc1ccc(Br)cc1 ZINC000823629799 607162243 /nfs/dbraw/zinc/16/22/43/607162243.db2.gz HJWGJOPYJNYSAS-UHFFFAOYSA-N 0 0 379.199 3.084 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCc1nnc(-c2ccc(-c3nn[nH]n3)cc2)o1 ZINC000822195295 607165899 /nfs/dbraw/zinc/16/58/99/607165899.db2.gz NRITZCBALFQXGA-UHFFFAOYSA-N 0 0 392.379 3.054 20 5 GGBDRN O=[N+]([O-])c1cc(Cn2ccc(-c3ccc(-c4nn[nH]n4)cc3)n2)ccc1Cl ZINC000823634160 607173523 /nfs/dbraw/zinc/17/35/23/607173523.db2.gz BKLSMMNAGJGDCB-UHFFFAOYSA-N 0 0 381.783 3.340 20 5 GGBDRN O=C(Nc1ccc(-c2nn[nH]n2)cc1Cl)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000823318694 607241671 /nfs/dbraw/zinc/24/16/71/607241671.db2.gz HWRJEXZBVZEGQK-UHFFFAOYSA-N 0 0 379.163 3.334 20 5 GGBDRN CC1=CCN(c2cc(-c3nn[nH]n3)c([N+](=O)[O-])c(N3CC=C(C)CC3)c2)CC1 ZINC000824858729 607903679 /nfs/dbraw/zinc/90/36/79/607903679.db2.gz MFGFNQVIKVSWJV-UHFFFAOYSA-N 0 0 381.440 3.088 20 5 GGBDRN O=[N+]([O-])c1cccc2c1CCN(c1ccc(C(F)(F)F)cc1-c1nn[nH]n1)C2 ZINC000826500304 607937825 /nfs/dbraw/zinc/93/78/25/607937825.db2.gz STLSGLITBARDQH-UHFFFAOYSA-N 0 0 390.325 3.356 20 5 GGBDRN O=Cc1cc(Cl)c(Oc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1Cl ZINC000826484205 607967641 /nfs/dbraw/zinc/96/76/41/607967641.db2.gz SAIYRXMXZDTQDY-UHFFFAOYSA-N 0 0 381.135 3.082 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1OC[C@H](O)c1ccc(Cl)cc1Cl ZINC000826499271 607982186 /nfs/dbraw/zinc/98/21/86/607982186.db2.gz CADQHDVIKIUGDK-ZDUSSCGKSA-N 0 0 396.190 3.194 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1OC[C@H](O)c1ccc(Cl)cc1Cl ZINC000826497272 607982287 /nfs/dbraw/zinc/98/22/87/607982287.db2.gz AIOQYNWADCYIAT-ZDUSSCGKSA-N 0 0 396.190 3.194 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(-c2nn[nH]n2)c(Cl)c1 ZINC000826421525 608000332 /nfs/dbraw/zinc/00/03/32/608000332.db2.gz MFPFOXRHSIEIDW-UHFFFAOYSA-N 0 0 397.782 3.091 20 5 GGBDRN COc1ccc(C[C@H](C)CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1OC ZINC000826191220 608099353 /nfs/dbraw/zinc/09/93/53/608099353.db2.gz AAKZJBHDBXHAJD-LBPRGKRZSA-N 0 0 398.423 3.083 20 5 GGBDRN CC(=CC(=O)O[C@H](C)c1cccc(-c2nn[nH]n2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000823942572 608141558 /nfs/dbraw/zinc/14/15/58/608141558.db2.gz GTOYRJBOFGYLMH-KXXVWKPMSA-N 0 0 379.376 3.483 20 5 GGBDRN Cc1cccc(C2(C(=O)Nc3cc(-c4nn[nH]n4)cc([N+](=O)[O-])c3Cl)CC2)c1 ZINC000826296660 608160256 /nfs/dbraw/zinc/16/02/56/608160256.db2.gz 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GGBDRN C[C@H](NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000016017417 1399204092 /nfs/dbraw/zinc/20/40/92/1399204092.db2.gz RPQVCAOHWVOOSC-JTQLQIEISA-N 0 0 393.852 3.317 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc3c(c2)CCC3)c([N+](=O)[O-])c1 ZINC000016058988 1399205542 /nfs/dbraw/zinc/20/55/42/1399205542.db2.gz ASWDNMBYSNGJKY-GFCCVEGCSA-N 0 0 384.388 3.276 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)Sc2nnc3n2CCCCC3)c([N+](=O)[O-])c1 ZINC000016067057 1399206048 /nfs/dbraw/zinc/20/60/48/1399206048.db2.gz AMZGCATWOHDICV-NSHDSACASA-N 0 0 391.453 3.041 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCN(CCOc2ccccc2)CC1 ZINC000016064828 1399206143 /nfs/dbraw/zinc/20/61/43/1399206143.db2.gz FKCOHJSXLKHZNW-UHFFFAOYSA-N 0 0 389.839 3.085 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OS(=O)(=O)c1cccc(Br)c1 ZINC000016088890 1399208637 /nfs/dbraw/zinc/20/86/37/1399208637.db2.gz LAFMJKSWJPYTME-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN COc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000016091109 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COc1cc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1C ZINC000018657417 1399318397 /nfs/dbraw/zinc/31/83/97/1399318397.db2.gz QZTDOEPILQEWMO-GFCCVEGCSA-N 0 0 388.376 3.104 20 5 GGBDRN C[C@H](OC(=O)c1ccc(F)cc1N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000018749510 1399319998 /nfs/dbraw/zinc/31/99/98/1399319998.db2.gz XQGJPOSIBVLVHC-QMMMGPOBSA-N 0 0 381.747 3.154 20 5 GGBDRN Cc1cccc(C)c1OCc1nnc(SCc2ccc([N+](=O)[O-])cc2)n1N ZINC000018763418 1399320254 /nfs/dbraw/zinc/32/02/54/1399320254.db2.gz GUUDXKOMZDMNKP-UHFFFAOYSA-N 0 0 385.449 3.388 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)c2)cs1 ZINC000018824236 1399321082 /nfs/dbraw/zinc/32/10/82/1399321082.db2.gz GOZIWVDHOFMVJS-UHFFFAOYSA-N 0 0 396.428 3.395 20 5 GGBDRN Cc1ccccc1CCNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000018831661 1399321366 /nfs/dbraw/zinc/32/13/66/1399321366.db2.gz YLNZEABLSORATJ-UHFFFAOYSA-N 0 0 397.460 3.155 20 5 GGBDRN CN(Cc1ccccc1N1CCOCC1)C(=S)Nc1ccc([N+](=O)[O-])cc1 ZINC000018945034 1399322631 /nfs/dbraw/zinc/32/26/31/1399322631.db2.gz NQQBNZRARDDLIB-UHFFFAOYSA-N 0 0 386.477 3.260 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)OCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000018968961 1399323758 /nfs/dbraw/zinc/32/37/58/1399323758.db2.gz NQJGCCVNXFTCHR-UHFFFAOYSA-N 0 0 376.321 3.267 20 5 GGBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)COc1ccc(C)cc1[N+](=O)[O-] ZINC000018977399 1399324273 /nfs/dbraw/zinc/32/42/73/1399324273.db2.gz FNAQURNQMWQJMI-UHFFFAOYSA-N 0 0 388.420 3.348 20 5 GGBDRN CCOc1ccc(C(=O)NCC(=O)Nc2c(C)cc(C)cc2C)cc1[N+](=O)[O-] ZINC000019005919 1399324369 /nfs/dbraw/zinc/32/43/69/1399324369.db2.gz OFJXPWJMXZVVSA-UHFFFAOYSA-N 0 0 385.420 3.287 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccc2c(C)cc(=O)oc2c1 ZINC000019159467 1399326443 /nfs/dbraw/zinc/32/64/43/1399326443.db2.gz CFJGFVBRAGGCHD-UHFFFAOYSA-N 0 0 384.344 3.036 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(OC)cc(OC)c2)cc1OC ZINC000019198931 1399327593 /nfs/dbraw/zinc/32/75/93/1399327593.db2.gz QGOQCUDYBVSSIT-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)OC)ccc2C)cc1OC ZINC000019203405 1399328078 /nfs/dbraw/zinc/32/80/78/1399328078.db2.gz ZIFNNSVLVDHRAH-UHFFFAOYSA-N 0 0 388.376 3.349 20 5 GGBDRN CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1C)c1ccccc1OCC(=O)N(C)C ZINC000055597872 1407020102 /nfs/dbraw/zinc/02/01/02/1407020102.db2.gz CPCWEIUUJFOJFR-QGZVFWFLSA-N 0 0 399.447 3.251 20 5 GGBDRN CCc1cc2c(COC(=O)c3cc([N+](=O)[O-])ccc3OC)cc(=O)oc2cc1O ZINC000019284949 1399329081 /nfs/dbraw/zinc/32/90/81/1399329081.db2.gz SDENNSZJCMEDSB-UHFFFAOYSA-N 0 0 399.355 3.335 20 5 GGBDRN COc1ccc(CC(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1F ZINC000019474711 1399330691 /nfs/dbraw/zinc/33/06/91/1399330691.db2.gz BQFFVXSTQHHWMH-UHFFFAOYSA-N 0 0 396.758 3.120 20 5 GGBDRN CCOc1cc(C(=O)OCC(=O)c2ccc(F)cc2F)c([N+](=O)[O-])cc1OC ZINC000019473448 1399330917 /nfs/dbraw/zinc/33/09/17/1399330917.db2.gz BQGIKPIUJJZNAD-UHFFFAOYSA-N 0 0 395.314 3.320 20 5 GGBDRN O=C(CN1CCN(Cc2cccs2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl 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KMOBNTMSZAICGU-UHFFFAOYSA-N 0 0 397.840 3.189 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(Cc2cccs2)CC1 ZINC000020544221 1399348833 /nfs/dbraw/zinc/34/88/33/1399348833.db2.gz FSJGOYDANWLKCH-UHFFFAOYSA-N 0 0 376.438 3.015 20 5 GGBDRN CCC[C@@H](NC(=O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000020685076 1399352200 /nfs/dbraw/zinc/35/22/00/1399352200.db2.gz RDDFASCKSDHFKV-LJQANCHMSA-N 0 0 396.491 3.374 20 5 GGBDRN O=C(CN1CCN(Cc2ccccc2[N+](=O)[O-])CC1)Nc1ccccc1Cl ZINC000020804381 1399353843 /nfs/dbraw/zinc/35/38/43/1399353843.db2.gz JDBQZDQNNVCZLP-UHFFFAOYSA-N 0 0 388.855 3.005 20 5 GGBDRN CCc1ccc(C(=O)[C@@H](C)OC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000020897344 1399356179 /nfs/dbraw/zinc/35/61/79/1399356179.db2.gz KLXUBNRCBWUHBZ-CQSZACIVSA-N 0 0 398.415 3.092 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CCN(c2ccccc2F)CC1 ZINC000020897904 1399356222 /nfs/dbraw/zinc/35/62/22/1399356222.db2.gz NHKVGNQNTLKACM-UHFFFAOYSA-N 0 0 398.438 3.297 20 5 GGBDRN Cc1cc(C)cc(OCCNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000055602489 1407022678 /nfs/dbraw/zinc/02/26/78/1407022678.db2.gz UGGZQRPBZXGKAW-UHFFFAOYSA-N 0 0 380.404 3.206 20 5 GGBDRN CCCCN(C(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)c1ccccc1 ZINC000020915359 1399357060 /nfs/dbraw/zinc/35/70/60/1399357060.db2.gz UKWBBYOWXVNJOD-UHFFFAOYSA-N 0 0 381.388 3.024 20 5 GGBDRN COc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1OC ZINC000020934108 1399357342 /nfs/dbraw/zinc/35/73/42/1399357342.db2.gz KZHPPEKTZGAAJY-UHFFFAOYSA-N 0 0 399.447 3.484 20 5 GGBDRN CC(=O)N1CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)ccc21 ZINC000020924834 1399357405 /nfs/dbraw/zinc/35/74/05/1399357405.db2.gz OMVFEMKKWSMUCB-UHFFFAOYSA-N 0 0 394.431 3.356 20 5 GGBDRN CCNC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000020974454 1399358950 /nfs/dbraw/zinc/35/89/50/1399358950.db2.gz HMOITUGZLYYOTE-UHFFFAOYSA-N 0 0 391.811 3.153 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(C(=O)Nc2nccs2)cc1 ZINC000021143033 1399366652 /nfs/dbraw/zinc/36/66/52/1399366652.db2.gz NSLQSNZGEDSWRO-UHFFFAOYSA-N 0 0 398.400 3.321 20 5 GGBDRN CSc1ccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1[N+](=O)[O-] ZINC000021140511 1399366845 /nfs/dbraw/zinc/36/68/45/1399366845.db2.gz YHNFJGPMDVSLPP-UHFFFAOYSA-N 0 0 399.472 3.483 20 5 GGBDRN O=C(Nc1ncccn1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000021210560 1399369201 /nfs/dbraw/zinc/36/92/01/1399369201.db2.gz DCIKQIILJZRHFQ-UHFFFAOYSA-N 0 0 395.341 3.259 20 5 GGBDRN O=C(COc1ccc2c(c1)oc(=O)cc2-c1ccc([N+](=O)[O-])cc1)NC1CC1 ZINC000021283756 1399372568 /nfs/dbraw/zinc/37/25/68/1399372568.db2.gz GMWMRTXWGFXLBL-UHFFFAOYSA-N 0 0 380.356 3.026 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c1 ZINC000055611450 1407024241 /nfs/dbraw/zinc/02/42/41/1407024241.db2.gz RMMNWYVMROQBAG-UHFFFAOYSA-N 0 0 391.449 3.071 20 5 GGBDRN O=C(CNc1ccc(F)c([N+](=O)[O-])c1)NCc1ccc(OC(F)(F)F)cc1 ZINC000021357938 1399376081 /nfs/dbraw/zinc/37/60/81/1399376081.db2.gz CHAGKDZDTPWZAJ-UHFFFAOYSA-N 0 0 387.289 3.361 20 5 GGBDRN COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)Oc1cc(F)ccc1[N+](=O)[O-] ZINC000021389782 1399377385 /nfs/dbraw/zinc/37/73/85/1399377385.db2.gz ZNMVHQMVIYEEFP-SNVBAGLBSA-N 0 0 391.355 3.107 20 5 GGBDRN COc1ccc(-n2ccc(CNC(=O)CSc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000055611989 1407024452 /nfs/dbraw/zinc/02/44/52/1407024452.db2.gz BMMOSBBHBVUQMG-UHFFFAOYSA-N 0 0 398.444 3.198 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc1 ZINC000021476030 1399384232 /nfs/dbraw/zinc/38/42/32/1399384232.db2.gz VFUMRKBCNPXLKM-UHFFFAOYSA-N 0 0 375.450 3.013 20 5 GGBDRN Cc1cc(C(=O)OCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c2ccccc2n1 ZINC000021555797 1399389559 /nfs/dbraw/zinc/38/95/59/1399389559.db2.gz VHZBALIXEQACEE-UHFFFAOYSA-N 0 0 391.383 3.198 20 5 GGBDRN CCc1cc(=O)oc2cc(OCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)ccc12 ZINC000021586439 1399392218 /nfs/dbraw/zinc/39/22/18/1399392218.db2.gz LYCMWVOLYVQCHN-UHFFFAOYSA-N 0 0 394.383 3.232 20 5 GGBDRN O=C(COc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1)Nc1ccccc1 ZINC000055615352 1407025461 /nfs/dbraw/zinc/02/54/61/1407025461.db2.gz ACVRRFZNVZOMDS-UHFFFAOYSA-N 0 0 381.344 3.458 20 5 GGBDRN Nc1ccc(Cl)cc1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000021605654 1399394247 /nfs/dbraw/zinc/39/42/47/1399394247.db2.gz NSZAYDBZTFYNAL-UHFFFAOYSA-N 0 0 384.175 3.279 20 5 GGBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000021615982 1399394727 /nfs/dbraw/zinc/39/47/27/1399394727.db2.gz GBJGIPJNAYNSNR-MRVPVSSYSA-N 0 0 386.332 3.442 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2C(N)=O)cccc1[N+](=O)[O-] ZINC000021632939 1399395932 /nfs/dbraw/zinc/39/59/32/1399395932.db2.gz RYAHGNCYEBHSAN-SNVBAGLBSA-N 0 0 377.784 3.062 20 5 GGBDRN COc1ccc(NC(=O)COC(=O)CCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000021638175 1399396897 /nfs/dbraw/zinc/39/68/97/1399396897.db2.gz KMNYJRXUOGSQOQ-UHFFFAOYSA-N 0 0 392.795 3.371 20 5 GGBDRN Cc1ccoc1C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000021669081 1399399425 /nfs/dbraw/zinc/39/94/25/1399399425.db2.gz AVFMEOVYQKTLOH-UHFFFAOYSA-N 0 0 393.402 3.038 20 5 GGBDRN C[C@@H](OC(=O)COc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000021678455 1399400103 /nfs/dbraw/zinc/40/01/03/1399400103.db2.gz PENDWOIQFTXKCW-LLVKDONJSA-N 0 0 378.768 3.197 20 5 GGBDRN Cc1cccc(OCCC(=O)O[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c1 ZINC000021679893 1399400644 /nfs/dbraw/zinc/40/06/44/1399400644.db2.gz JXQNPSROOOEWAH-ZDUSSCGKSA-N 0 0 390.367 3.382 20 5 GGBDRN COc1ccccc1CCC(=O)O[C@@H](C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000021688759 1399401259 /nfs/dbraw/zinc/40/12/59/1399401259.db2.gz SLOVZADRGGTTBT-LBPRGKRZSA-N 0 0 390.367 3.246 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000021740875 1399405483 /nfs/dbraw/zinc/40/54/83/1399405483.db2.gz KUIBDLANAMKPLW-CQSZACIVSA-N 0 0 388.445 3.243 20 5 GGBDRN CCc1cccc(CC)c1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1N ZINC000021765285 1399407682 /nfs/dbraw/zinc/40/76/82/1399407682.db2.gz NJRPGKOULGMNJE-GFCCVEGCSA-N 0 0 385.420 3.486 20 5 GGBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2N)c(Cl)c1 ZINC000021765252 1399407830 /nfs/dbraw/zinc/40/78/30/1399407830.db2.gz YXELZBRZTIMADX-JTQLQIEISA-N 0 0 377.784 3.323 20 5 GGBDRN CC[C@H](NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1N)c1ccc(Cl)cc1 ZINC000021765180 1399407969 /nfs/dbraw/zinc/40/79/69/1399407969.db2.gz OWQJLUZSBRVJQG-INIZCTEOSA-N 0 0 391.811 3.255 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCCc3ccccn3)cc2[N+](=O)[O-])C1 ZINC000021773807 1399408510 /nfs/dbraw/zinc/40/85/10/1399408510.db2.gz BQWBUOBLIFKKQF-HZPDHXFCSA-N 0 0 382.464 3.445 20 5 GGBDRN COc1cc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC ZINC000021819254 1399410552 /nfs/dbraw/zinc/41/05/52/1399410552.db2.gz BWKPYJLQOVSIGJ-LLVKDONJSA-N 0 0 375.381 3.060 20 5 GGBDRN COc1ccc(OS(=O)(=O)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000021821310 1399411350 /nfs/dbraw/zinc/41/13/50/1399411350.db2.gz KHDDBSRDMJYARW-UHFFFAOYSA-N 0 0 377.296 3.390 20 5 GGBDRN CCc1cc(=O)oc2cc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc12 ZINC000021821599 1399411505 /nfs/dbraw/zinc/41/15/05/1399411505.db2.gz BMSAHEAGYMGYIE-UHFFFAOYSA-N 0 0 375.358 3.031 20 5 GGBDRN CCC[C@@H](NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000021838719 1399413628 /nfs/dbraw/zinc/41/36/28/1399413628.db2.gz RECSYTDOGFPNPR-OAHLLOKOSA-N 0 0 387.461 3.443 20 5 GGBDRN CCOc1ccccc1N1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000021846856 1399414799 /nfs/dbraw/zinc/41/47/99/1399414799.db2.gz OOGSGXKVWHWIDH-MRXNPFEDSA-N 0 0 398.463 3.143 20 5 GGBDRN COC(=O)c1ccccc1N(C)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000021867660 1399416950 /nfs/dbraw/zinc/41/69/50/1399416950.db2.gz QALOTOUVDZKVED-UHFFFAOYSA-N 0 0 398.824 3.168 20 5 GGBDRN O=C(CCC(=O)N1CCC(c2ccccc2)=N1)OCc1ccccc1[N+](=O)[O-] ZINC000021867872 1399417066 /nfs/dbraw/zinc/41/70/66/1399417066.db2.gz IFZAQRVFTXLWKM-UHFFFAOYSA-N 0 0 381.388 3.055 20 5 GGBDRN Cc1cc(=O)c(C(=O)Oc2ccccc2Cl)nn1-c1ccccc1[N+](=O)[O-] ZINC000021887883 1399419730 /nfs/dbraw/zinc/41/97/30/1399419730.db2.gz LHKOYGRCRAWFSS-UHFFFAOYSA-N 0 0 385.763 3.322 20 5 GGBDRN COC(=O)c1cc(C(=O)O[C@@H](C)C(=O)c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000021976598 1399428499 /nfs/dbraw/zinc/42/84/99/1399428499.db2.gz CDMPJZJEJQQOII-JTQLQIEISA-N 0 0 391.763 3.463 20 5 GGBDRN C[C@@H](OC(=O)Cc1csc(N2CCCC2=O)n1)c1cccc([N+](=O)[O-])c1 ZINC000022011312 1399430609 /nfs/dbraw/zinc/43/06/09/1399430609.db2.gz SVCAJAHQTWVFGN-LLVKDONJSA-N 0 0 375.406 3.025 20 5 GGBDRN O=C(COC(=O)CCSc1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000022038531 1399433499 /nfs/dbraw/zinc/43/34/99/1399433499.db2.gz FXZDINAUYQJERI-UHFFFAOYSA-N 0 0 378.381 3.398 20 5 GGBDRN Cc1cccc(N2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000022066672 1399434724 /nfs/dbraw/zinc/43/47/24/1399434724.db2.gz UMCWUBIFXHCZQA-UHFFFAOYSA-N 0 0 389.839 3.284 20 5 GGBDRN Cc1ccc([C@H](NC(=O)COC(=O)COc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000022094811 1399436428 /nfs/dbraw/zinc/43/64/28/1399436428.db2.gz TVVRXPKTAAUIOF-NRFANRHFSA-N 0 0 398.415 3.093 20 5 GGBDRN C[C@H](OC(=O)CSc1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000022097236 1399437076 /nfs/dbraw/zinc/43/70/76/1399437076.db2.gz XAFLVCUMRQPMAT-NSHDSACASA-N 0 0 378.381 3.396 20 5 GGBDRN C[C@@H]1CCc2nc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)sc2C1 ZINC000022131223 1399439014 /nfs/dbraw/zinc/43/90/14/1399439014.db2.gz KGNFPGLFAPGMQV-SECBINFHSA-N 0 0 375.406 3.200 20 5 GGBDRN C[C@H]1CCc2nc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)sc2C1 ZINC000022131224 1399439084 /nfs/dbraw/zinc/43/90/84/1399439084.db2.gz KGNFPGLFAPGMQV-VIFPVBQESA-N 0 0 375.406 3.200 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCc1ccccc1S(=O)(=O)N1CCCCC1 ZINC000022138352 1399439891 /nfs/dbraw/zinc/43/98/91/1399439891.db2.gz KRAAWWFEJSLZRR-UHFFFAOYSA-N 0 0 375.450 3.382 20 5 GGBDRN Cc1nc(CC(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cs1 ZINC000022188063 1399442612 /nfs/dbraw/zinc/44/26/12/1399442612.db2.gz VZXOFWWAGNQQSW-OAHLLOKOSA-N 0 0 391.449 3.101 20 5 GGBDRN Cc1nc(CC(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cs1 ZINC000022188066 1399443079 /nfs/dbraw/zinc/44/30/79/1399443079.db2.gz VZXOFWWAGNQQSW-HNNXBMFYSA-N 0 0 391.449 3.101 20 5 GGBDRN Cc1ccc(C(=O)C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cc1 ZINC000022189315 1399443144 /nfs/dbraw/zinc/44/31/44/1399443144.db2.gz TWLJZPFGFPVHNM-QGZVFWFLSA-N 0 0 398.415 3.285 20 5 GGBDRN C[C@H](OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(=O)NC1CCC(C)CC1 ZINC000022243720 1399446600 /nfs/dbraw/zinc/44/66/00/1399446600.db2.gz XFDBRXARNSMIQY-UYJPIKCFSA-N 0 0 389.452 3.409 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(=O)NC1CCC(C)CC1 ZINC000022243719 1399446688 /nfs/dbraw/zinc/44/66/88/1399446688.db2.gz XFDBRXARNSMIQY-MFOWVQHXSA-N 0 0 389.452 3.409 20 5 GGBDRN O=C(COc1ccc(Cl)cc1Cl)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000022262419 1399449019 /nfs/dbraw/zinc/44/90/19/1399449019.db2.gz XYBYKJBDOFBYKE-UHFFFAOYSA-N 0 0 395.202 3.473 20 5 GGBDRN CNc1ccc(C(=O)O[C@H](C)C(=O)Nc2cc(F)ccc2C)cc1[N+](=O)[O-] ZINC000022272973 1399449549 /nfs/dbraw/zinc/44/95/49/1399449549.db2.gz LPHNUEUEUQCXCW-LLVKDONJSA-N 0 0 375.356 3.268 20 5 GGBDRN CNc1ccc(C(=O)OCC(=O)N[C@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000022272655 1399449691 /nfs/dbraw/zinc/44/96/91/1399449691.db2.gz FPXSGEYGIKCZFO-HXUWFJFHSA-N 0 0 397.431 3.369 20 5 GGBDRN Cc1cccc(C(=O)Nc2nc(CN3C[C@@H](C)O[C@@H](C)C3)cs2)c1[N+](=O)[O-] ZINC000022296948 1399452167 /nfs/dbraw/zinc/45/21/67/1399452167.db2.gz LECWJRNUZLOSCE-BETUJISGSA-N 0 0 390.465 3.221 20 5 GGBDRN Cc1c(C(=O)Nc2nc(CN3C[C@@H](C)O[C@H](C)C3)cs2)cccc1[N+](=O)[O-] ZINC000022300569 1399452783 /nfs/dbraw/zinc/45/27/83/1399452783.db2.gz BFEIUVLXKAYKJS-VXGBXAGGSA-N 0 0 390.465 3.221 20 5 GGBDRN COC(=O)c1ccc2c(=O)[nH]c(C(Cl)=Cc3cccc([N+](=O)[O-])c3)nc2c1 ZINC000022347226 1399455753 /nfs/dbraw/zinc/45/57/53/1399455753.db2.gz JPQUTPXYUJCVGE-ZSOIEALJSA-N 0 0 385.763 3.355 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(N2CCCCC2)cc1 ZINC000022394836 1399460232 /nfs/dbraw/zinc/46/02/32/1399460232.db2.gz BNCRTRWUIDZTSR-UHFFFAOYSA-N 0 0 396.403 3.132 20 5 GGBDRN O=C(CSc1ccc2c(c1)OCCCO2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022398858 1399461098 /nfs/dbraw/zinc/46/10/98/1399461098.db2.gz YSRSTXJUCGPEOI-UHFFFAOYSA-N 0 0 386.429 3.438 20 5 GGBDRN COc1ccc([C@@H](NC(=O)COC(=O)c2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000022443404 1399464230 /nfs/dbraw/zinc/46/42/30/1399464230.db2.gz UEYXRSZSCXNOBS-IBGZPJMESA-N 0 0 384.388 3.028 20 5 GGBDRN O=C(COC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)NCC1(c2ccccc2)CC1 ZINC000022467559 1399466499 /nfs/dbraw/zinc/46/64/99/1399466499.db2.gz DQEDFDACSQUTLD-UHFFFAOYSA-N 0 0 388.807 3.253 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000022468388 1399466516 /nfs/dbraw/zinc/46/65/16/1399466516.db2.gz WWCRHEPBSWRJEW-GFCCVEGCSA-N 0 0 376.796 3.418 20 5 GGBDRN C[C@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000022471858 1399467000 /nfs/dbraw/zinc/46/70/00/1399467000.db2.gz HUWIJQJVYAPJPD-LBPRGKRZSA-N 0 0 399.428 3.408 20 5 GGBDRN COc1ccc(N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c(OC)c1 ZINC000022471443 1399467017 /nfs/dbraw/zinc/46/70/17/1399467017.db2.gz FQBIOZNHEOVSDO-LLVKDONJSA-N 0 0 375.381 3.060 20 5 GGBDRN C[C@@H](OC(=O)COc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2ncccc21 ZINC000022478264 1399468226 /nfs/dbraw/zinc/46/82/26/1399468226.db2.gz BQGWTWGNPNJOMQ-CYBMUJFWSA-N 0 0 395.371 3.092 20 5 GGBDRN C[C@@H](NC(=O)[C@@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000022488880 1399468662 /nfs/dbraw/zinc/46/86/62/1399468662.db2.gz KYTTZBNNWJMBPG-VXGBXAGGSA-N 0 0 397.387 3.346 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1cc2ccccc2o1 ZINC000022488883 1399468809 /nfs/dbraw/zinc/46/88/09/1399468809.db2.gz KYTTZBNNWJMBPG-NWDGAFQWSA-N 0 0 397.387 3.346 20 5 GGBDRN C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(Cl)cc1 ZINC000022488419 1399468878 /nfs/dbraw/zinc/46/88/78/1399468878.db2.gz IRQIXGAKBJNYHC-QWRGUYRKSA-N 0 0 391.811 3.253 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(N)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000022488205 1399468964 /nfs/dbraw/zinc/46/89/64/1399468964.db2.gz WNXWXEGWYTXDCA-SNVBAGLBSA-N 0 0 377.784 3.323 20 5 GGBDRN C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2CC[C@H]1C ZINC000022489126 1399469525 /nfs/dbraw/zinc/46/95/25/1399469525.db2.gz KKVQADRTWZJSIJ-OLZOCXBDSA-N 0 0 383.404 3.090 20 5 GGBDRN C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)NCc1ccccc1F ZINC000022496133 1399470083 /nfs/dbraw/zinc/47/00/83/1399470083.db2.gz OLIMOAGSGBUDJV-SNVBAGLBSA-N 0 0 380.759 3.249 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000022495762 1399470232 /nfs/dbraw/zinc/47/02/32/1399470232.db2.gz ZXLWLUFQZASHJU-ZDUSSCGKSA-N 0 0 390.823 3.461 20 5 GGBDRN Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000022495765 1399470333 /nfs/dbraw/zinc/47/03/33/1399470333.db2.gz IVVLENCFJTYZRI-GFCCVEGCSA-N 0 0 376.796 3.418 20 5 GGBDRN CC(C)Cc1noc(COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 ZINC000022526680 1399472583 /nfs/dbraw/zinc/47/25/83/1399472583.db2.gz CAMYMHPEDYPOTH-UHFFFAOYSA-N 0 0 391.427 3.480 20 5 GGBDRN COc1cccc(CNC(=O)[C@H](C)OC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000022547628 1399474642 /nfs/dbraw/zinc/47/46/42/1399474642.db2.gz GZNAEOFGJIEMHB-NSHDSACASA-N 0 0 392.795 3.119 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@@H](C)OC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000022547646 1399474659 /nfs/dbraw/zinc/47/46/59/1399474659.db2.gz PWKMJWLBSFVNEG-CYBMUJFWSA-N 0 0 390.823 3.461 20 5 GGBDRN CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000022550775 1399475185 /nfs/dbraw/zinc/47/51/85/1399475185.db2.gz WLRNKERQOHKETP-RUNBWSAHSA-N 0 0 397.387 3.137 20 5 GGBDRN C[C@@H](OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCc2sccc2C1 ZINC000022550383 1399475296 /nfs/dbraw/zinc/47/52/96/1399475296.db2.gz ZOAPPMZLGSSLAH-WXJAXGNASA-N 0 0 386.429 3.186 20 5 GGBDRN Cc1ccccc1CCNC(=O)[C@@H](C)OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000022550879 1399475307 /nfs/dbraw/zinc/47/53/07/1399475307.db2.gz XKKMGZKGSJYMPK-ONOODXEBSA-N 0 0 382.416 3.207 20 5 GGBDRN Cc1cccc(OCCNC(=O)[C@@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000022550901 1399475365 /nfs/dbraw/zinc/47/53/65/1399475365.db2.gz YCAHLPVPNHEIPJ-YCABEKBOSA-N 0 0 398.415 3.043 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cccc1[N+](=O)[O-] ZINC000022550425 1399475456 /nfs/dbraw/zinc/47/54/56/1399475456.db2.gz WWLCPRRLIJRBMF-YKWSONSWSA-N 0 0 399.359 3.395 20 5 GGBDRN O=C(COC(=O)C12CC3CC(CC(C3)C1)C2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000022557414 1399476568 /nfs/dbraw/zinc/47/65/68/1399476568.db2.gz DPKPCQFTWAEDDM-UHFFFAOYSA-N 0 0 384.432 3.244 20 5 GGBDRN CC(=O)N1CCN(c2ccc(C(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])CC1 ZINC000022560724 1399477403 /nfs/dbraw/zinc/47/74/03/1399477403.db2.gz QCGAWCFPPUKWKD-UHFFFAOYSA-N 0 0 396.447 3.132 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000022559465 1399477440 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DBWQDAYLWQXRFD-UHFFFAOYSA-N 0 0 382.376 3.063 20 5 GGBDRN COC(=O)c1ccc(CN(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000026207993 1399869594 /nfs/dbraw/zinc/86/95/94/1399869594.db2.gz VIBXLXWWHHOGLX-UHFFFAOYSA-N 0 0 391.811 3.105 20 5 GGBDRN COC(=O)c1ccc(CN(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000026207936 1399869672 /nfs/dbraw/zinc/86/96/72/1399869672.db2.gz MPLUXJTVSLCPOM-UHFFFAOYSA-N 0 0 391.811 3.105 20 5 GGBDRN Cc1cccc2c1ncn(CCC(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1)c2=O ZINC000026233579 1399872010 /nfs/dbraw/zinc/87/20/10/1399872010.db2.gz HSIGDTKUKNFTHM-CQSZACIVSA-N 0 0 381.388 3.308 20 5 GGBDRN Cc1c(C(=O)NCCNc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1F ZINC000026253026 1399873880 /nfs/dbraw/zinc/87/38/80/1399873880.db2.gz YKTAPBYFMYLYDD-UHFFFAOYSA-N 0 0 383.383 3.070 20 5 GGBDRN O=C(CN(Cc1cccs1)C[C@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC000026301458 1399877011 /nfs/dbraw/zinc/87/70/11/1399877011.db2.gz RIJYYJMPQRDMMA-CQSZACIVSA-N 0 0 375.450 3.276 20 5 GGBDRN Cc1cc(OCC(=O)N2CCC[C@H](C(=O)Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000026332587 1399879015 /nfs/dbraw/zinc/87/90/15/1399879015.db2.gz JDDYEXHMYPYLPG-INIZCTEOSA-N 0 0 397.431 3.159 20 5 GGBDRN CN(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)Cc1c(F)cccc1Cl ZINC000026332946 1399879265 /nfs/dbraw/zinc/87/92/65/1399879265.db2.gz FCHKRLBUNIXWCC-UHFFFAOYSA-N 0 0 377.803 3.408 20 5 GGBDRN COc1cc(NC(=O)CN(C)Cc2ccccc2[N+](=O)[O-])c(OC)cc1Cl ZINC000026349103 1399880992 /nfs/dbraw/zinc/88/09/92/1399880992.db2.gz UXIXFTFBZJJXEX-UHFFFAOYSA-N 0 0 393.827 3.336 20 5 GGBDRN CC(C)CNC(=O)c1ccccc1NC(=O)CN(C)Cc1ccccc1[N+](=O)[O-] ZINC000026349629 1399881001 /nfs/dbraw/zinc/88/10/01/1399881001.db2.gz OHUTWZCEAWVYCQ-UHFFFAOYSA-N 0 0 398.463 3.051 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN(C)Cc1ccccc1[N+](=O)[O-] ZINC000026347286 1399881019 /nfs/dbraw/zinc/88/10/19/1399881019.db2.gz KCHGMZKPTYPWPX-UHFFFAOYSA-N 0 0 393.447 3.468 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1ccccc1[N+](=O)[O-] ZINC000026346242 1399881116 /nfs/dbraw/zinc/88/11/16/1399881116.db2.gz ORESKSYRVLIZQB-UHFFFAOYSA-N 0 0 378.772 3.227 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000026358554 1399882584 /nfs/dbraw/zinc/88/25/84/1399882584.db2.gz NOMFKYDCXDQVCV-HNNXBMFYSA-N 0 0 396.490 3.335 20 5 GGBDRN O=C(CCSc1nncn1-c1ccccc1F)Nc1ccccc1[N+](=O)[O-] ZINC000026372927 1399883844 /nfs/dbraw/zinc/88/38/44/1399883844.db2.gz NPBZLBKFOHUKRI-UHFFFAOYSA-N 0 0 387.396 3.436 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCc2c1cccc2Cl ZINC000055711999 1407064069 /nfs/dbraw/zinc/06/40/69/1407064069.db2.gz OLQZVYJUCZHXMP-KRWDZBQOSA-N 0 0 387.823 3.172 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(NC2CC2)s1 ZINC000026409546 1399886745 /nfs/dbraw/zinc/88/67/45/1399886745.db2.gz GORHHFJEWSKWDE-UHFFFAOYSA-N 0 0 395.466 3.150 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCc2c1cccc2Cl ZINC000055712000 1407064171 /nfs/dbraw/zinc/06/41/71/1407064171.db2.gz OLQZVYJUCZHXMP-QGZVFWFLSA-N 0 0 387.823 3.172 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@H](C)C(=O)N1CCCc2ccccc21 ZINC000026412510 1399887195 /nfs/dbraw/zinc/88/71/95/1399887195.db2.gz QHLHGSHQTZIOOO-CYBMUJFWSA-N 0 0 384.388 3.128 20 5 GGBDRN Cc1ccc(N2C[C@H](C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)CC2=O)cc1F ZINC000026414080 1399887582 /nfs/dbraw/zinc/88/75/82/1399887582.db2.gz LAZQDNIBNLXRHS-LLVKDONJSA-N 0 0 375.331 3.173 20 5 GGBDRN C[C@@H](OC(=O)c1ccc(C(F)(F)F)nc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000026434557 1399888836 /nfs/dbraw/zinc/88/88/36/1399888836.db2.gz LOYWPGJQWCYECF-SECBINFHSA-N 0 0 383.282 3.193 20 5 GGBDRN O=C(CSc1ncnc2sccc21)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026459568 1399892295 /nfs/dbraw/zinc/89/22/95/1399892295.db2.gz IKYLEJNSSYYCPS-UHFFFAOYSA-N 0 0 390.402 3.059 20 5 GGBDRN Cc1cc(C)c(NC(=O)[C@@H](C)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C)c1 ZINC000026485366 1399894813 /nfs/dbraw/zinc/89/48/13/1399894813.db2.gz LDRHOFVVASEDOR-QGZVFWFLSA-N 0 0 397.479 3.064 20 5 GGBDRN CC(C)c1ccccc1NC(=O)[C@@H](C)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000026489817 1399895153 /nfs/dbraw/zinc/89/51/53/1399895153.db2.gz OBYYVKCNGPTAEK-MRXNPFEDSA-N 0 0 397.479 3.262 20 5 GGBDRN CC(C)c1ccccc1NC(=O)[C@H](C)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000026489820 1399895383 /nfs/dbraw/zinc/89/53/83/1399895383.db2.gz OBYYVKCNGPTAEK-INIZCTEOSA-N 0 0 397.479 3.262 20 5 GGBDRN C[C@H](CCc1ccccc1)NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000026518438 1399896280 /nfs/dbraw/zinc/89/62/80/1399896280.db2.gz KVDUGXZKYQCQPO-QGZVFWFLSA-N 0 0 382.464 3.448 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccccc2O)CC1 ZINC000026527024 1399896973 /nfs/dbraw/zinc/89/69/73/1399896973.db2.gz OEHHKIZYPOXUTL-AWEZNQCLSA-N 0 0 387.461 3.130 20 5 GGBDRN CCC(CC)c1nnc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000026560635 1399899624 /nfs/dbraw/zinc/89/96/24/1399899624.db2.gz WVWYCLDQCAGILR-UHFFFAOYSA-N 0 0 391.453 3.109 20 5 GGBDRN C[C@@H](OC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1nnc(-c2cccs2)o1 ZINC000026575337 1399902097 /nfs/dbraw/zinc/90/20/97/1399902097.db2.gz UGYBNRPSATXXCP-MRVPVSSYSA-N 0 0 389.345 3.353 20 5 GGBDRN Cc1sc2ncn(CC(=O)O[C@H](C)c3cccc([N+](=O)[O-])c3)c(=O)c2c1C ZINC000026596019 1399905078 /nfs/dbraw/zinc/90/50/78/1399905078.db2.gz YUUOTLUWLIZVRL-LLVKDONJSA-N 0 0 387.417 3.287 20 5 GGBDRN CCOc1c(Cl)cc(CNC(=O)COc2cccc([N+](=O)[O-])c2)cc1OC ZINC000055715887 1407065785 /nfs/dbraw/zinc/06/57/85/1407065785.db2.gz UBYOYSCRFKYYDY-UHFFFAOYSA-N 0 0 394.811 3.351 20 5 GGBDRN COc1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1F ZINC000026613049 1399907525 /nfs/dbraw/zinc/90/75/25/1399907525.db2.gz RPZWFMVVCYXECF-LLVKDONJSA-N 0 0 376.340 3.235 20 5 GGBDRN COC(=O)c1cc(CN(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)oc1C ZINC000026617191 1399908415 /nfs/dbraw/zinc/90/84/15/1399908415.db2.gz HECZFODBKWKWBM-UHFFFAOYSA-N 0 0 389.408 3.134 20 5 GGBDRN CN(Cc1ccc(OC(F)(F)F)cc1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000026620510 1399909255 /nfs/dbraw/zinc/90/92/55/1399909255.db2.gz AMBBVYHFHUPRLT-UHFFFAOYSA-N 0 0 397.309 3.491 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)OCc1ccc(Cl)nc1 ZINC000026696956 1399921909 /nfs/dbraw/zinc/92/19/09/1399921909.db2.gz GZWLJONULGBHIG-UHFFFAOYSA-N 0 0 391.767 3.075 20 5 GGBDRN O=C(OCc1cc(=O)n2cc(Cl)ccc2n1)c1cc([N+](=O)[O-])ccc1Cl ZINC000026719144 1399925730 /nfs/dbraw/zinc/92/57/30/1399925730.db2.gz SNDCFPSORSSHLA-UHFFFAOYSA-N 0 0 394.170 3.267 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCc1ccc(-n2cccn2)cc1 ZINC000026717364 1399925744 /nfs/dbraw/zinc/92/57/44/1399925744.db2.gz PWCJLJLVVORACR-UHFFFAOYSA-N 0 0 393.447 3.332 20 5 GGBDRN O=C(OCc1cc(=O)n2cc(Cl)ccc2n1)c1ccc([N+](=O)[O-])cc1Cl ZINC000026718898 1399925935 /nfs/dbraw/zinc/92/59/35/1399925935.db2.gz NNONNNPKWRMQND-UHFFFAOYSA-N 0 0 394.170 3.267 20 5 GGBDRN Cc1nc2ccc(NC(=O)[C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)cc2s1 ZINC000026746161 1399928202 /nfs/dbraw/zinc/92/82/02/1399928202.db2.gz DQBPTDRLKBWROA-SNVBAGLBSA-N 0 0 384.417 3.270 20 5 GGBDRN O=C(NCc1nn(-c2ccccc2)c2c1CCC2)c1ccc([N+](=O)[O-])cc1F ZINC000055721635 1407067527 /nfs/dbraw/zinc/06/75/27/1407067527.db2.gz QMSAXUYDLXCZPC-UHFFFAOYSA-N 0 0 380.379 3.338 20 5 GGBDRN O=C(CNc1ccc(OC(F)(F)F)cc1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026782113 1399934312 /nfs/dbraw/zinc/93/43/12/1399934312.db2.gz UGSZTPPGHJCELZ-UHFFFAOYSA-N 0 0 399.281 3.273 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc(OC(F)(F)F)cc1 ZINC000026830752 1399938830 /nfs/dbraw/zinc/93/88/30/1399938830.db2.gz YTGQFECLZZMAAI-UHFFFAOYSA-N 0 0 390.339 3.314 20 5 GGBDRN CCN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccc(Cl)s1 ZINC000026854387 1399941256 /nfs/dbraw/zinc/94/12/56/1399941256.db2.gz JOLQGNBYOQSVMX-UHFFFAOYSA-N 0 0 397.840 3.499 20 5 GGBDRN COc1ccc(OC)c(-c2csc(NC(=O)c3cc([N+](=O)[O-])cn3C)n2)c1 ZINC000026855398 1399942227 /nfs/dbraw/zinc/94/22/27/1399942227.db2.gz LADDVJULEWPXBZ-UHFFFAOYSA-N 0 0 388.405 3.326 20 5 GGBDRN O=C(COC(=O)c1cccc(-n2cccc2)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000026859976 1399942534 /nfs/dbraw/zinc/94/25/34/1399942534.db2.gz IXZMFFUPEQXDGX-UHFFFAOYSA-N 0 0 391.383 3.132 20 5 GGBDRN COc1cccc(CNC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c1 ZINC000026868839 1399944594 /nfs/dbraw/zinc/94/45/94/1399944594.db2.gz YBINPZQJMOGGMW-UHFFFAOYSA-N 0 0 382.319 3.143 20 5 GGBDRN C[C@H](c1ccc(F)cc1)N(C)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000026871879 1399944683 /nfs/dbraw/zinc/94/46/83/1399944683.db2.gz WUYPTYHTMHKRIU-LLVKDONJSA-N 0 0 391.424 3.145 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)ccc1Cl ZINC000026882127 1399946440 /nfs/dbraw/zinc/94/64/40/1399946440.db2.gz SLQCCVXOVDTGTI-UHFFFAOYSA-N 0 0 377.784 3.353 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N(Cc1ccc(C(=O)NC2CC2)cc1)C1CC1 ZINC000026897165 1399948186 /nfs/dbraw/zinc/94/81/86/1399948186.db2.gz VNSOELLRROCQIO-UHFFFAOYSA-N 0 0 393.443 3.221 20 5 GGBDRN CC(=O)N1CCc2cc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)ccc21 ZINC000026901919 1399949751 /nfs/dbraw/zinc/94/97/51/1399949751.db2.gz YLIDXCSXKXKANM-UHFFFAOYSA-N 0 0 380.404 3.330 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)N[C@@H](c1ccc(C)cc1)C1CC1 ZINC000027006777 1399964256 /nfs/dbraw/zinc/96/42/56/1399964256.db2.gz KPBKQMYTIDZDRS-FQEVSTJZSA-N 0 0 398.415 3.336 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@@H](C)C(=O)Nc1cccc2ncccc21 ZINC000027007727 1399964725 /nfs/dbraw/zinc/96/47/25/1399964725.db2.gz SYOCYVJQBRFTPX-LBPRGKRZSA-N 0 0 395.371 3.336 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@H](C)C(=O)N(C)Cc1ccccc1C ZINC000027007335 1399964880 /nfs/dbraw/zinc/96/48/80/1399964880.db2.gz GSLPUDBCNQJPJL-CQSZACIVSA-N 0 0 386.404 3.116 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@@H](C)C(=O)Nc1cc(F)ccc1C ZINC000027007095 1399965157 /nfs/dbraw/zinc/96/51/57/1399965157.db2.gz AJTHELZMLIHEIN-NSHDSACASA-N 0 0 376.340 3.235 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000027007906 1399965249 /nfs/dbraw/zinc/96/52/49/1399965249.db2.gz IIYKBEFJCLDUFU-AWEZNQCLSA-N 0 0 384.436 3.101 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)Nc2ccc(CC(=O)NC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000027009317 1399966368 /nfs/dbraw/zinc/96/63/68/1399966368.db2.gz STQMTAPLZHHEQI-OAHLLOKOSA-N 0 0 398.463 3.409 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@H]1CC(=O)N(c2ccc(F)c(Cl)c2)C1=O ZINC000027052009 1399974101 /nfs/dbraw/zinc/97/41/01/1399974101.db2.gz WISZUQPKRTZTFQ-INIZCTEOSA-N 0 0 391.786 3.151 20 5 GGBDRN CCCOc1cccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000027066141 1399977355 /nfs/dbraw/zinc/97/73/55/1399977355.db2.gz GCKWLGGMALDDHE-UHFFFAOYSA-N 0 0 389.433 3.213 20 5 GGBDRN Cc1c(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cnn1-c1ccccc1 ZINC000027085210 1399980100 /nfs/dbraw/zinc/98/01/00/1399980100.db2.gz FIHOIYJCTACDGW-UHFFFAOYSA-N 0 0 391.431 3.051 20 5 GGBDRN C[C@H](C(=O)Nc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1)n1cccn1 ZINC000027126487 1399988494 /nfs/dbraw/zinc/98/84/94/1399988494.db2.gz UPSMGCUABULCOI-CQSZACIVSA-N 0 0 393.403 3.172 20 5 GGBDRN CC[C@H]1CCCN(C(=O)[C@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)C1 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ZINC000027382010 1400029591 /nfs/dbraw/zinc/02/95/91/1400029591.db2.gz IIVFTIRKMMKXCV-INIZCTEOSA-N 0 0 398.463 3.061 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000027398196 1400033276 /nfs/dbraw/zinc/03/32/76/1400033276.db2.gz JGTIJYYBUVLHNH-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)Cc2noc3ccccc23)cccc1[N+](=O)[O-] ZINC000027411293 1400035570 /nfs/dbraw/zinc/03/55/70/1400035570.db2.gz DJZNLJTYYLZUGT-GFCCVEGCSA-N 0 0 383.360 3.157 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000027416808 1400036388 /nfs/dbraw/zinc/03/63/88/1400036388.db2.gz XUXWZNXMGFAXQI-OINDORCXSA-N 0 0 380.379 3.386 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)c2cnn(-c3ccccc3)c2)cccc1[N+](=O)[O-] ZINC000027442883 1400039831 /nfs/dbraw/zinc/03/98/31/1400039831.db2.gz CIUAKOCLGAZUAG-CQSZACIVSA-N 0 0 394.387 3.273 20 5 GGBDRN CCOc1ccc(C(=O)NCc2ccc(C(=O)N(CC)CC)cc2)cc1[N+](=O)[O-] ZINC000027466364 1400044556 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ZINC000027662125 1400072861 /nfs/dbraw/zinc/07/28/61/1400072861.db2.gz CWWFBNNMISLYLV-UHFFFAOYSA-N 0 0 387.461 3.044 20 5 GGBDRN COCCOc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(Cl)cc2)cc1OC ZINC000027693335 1400077587 /nfs/dbraw/zinc/07/75/87/1400077587.db2.gz MWNBNCQCZVPVEU-UHFFFAOYSA-N 0 0 394.811 3.212 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2)cc([N+](=O)[O-])c1 ZINC000055755704 1407075594 /nfs/dbraw/zinc/07/55/94/1407075594.db2.gz ICMNSTSATIWRHR-UHFFFAOYSA-N 0 0 399.403 3.162 20 5 GGBDRN CC(C)NC(=O)c1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000055756644 1407075655 /nfs/dbraw/zinc/07/56/55/1407075655.db2.gz UYOVLNBRABHXOC-UHFFFAOYSA-N 0 0 393.403 3.171 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(Cc3cc([N+](=O)[O-])ccc3OC)CC2)cc1 ZINC000027745747 1400086039 /nfs/dbraw/zinc/08/60/39/1400086039.db2.gz XFHGZXRTUTYYNT-UHFFFAOYSA-N 0 0 383.448 3.124 20 5 GGBDRN Cc1noc([C@H](C)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 ZINC000027770079 1400090166 /nfs/dbraw/zinc/09/01/66/1400090166.db2.gz 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CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[C@H](NC(N)=O)c1ccccc1 ZINC000056288164 1407280996 /nfs/dbraw/zinc/28/09/96/1407280996.db2.gz RNRFCTCJTMUWNJ-SFHVURJKSA-N 0 0 384.436 3.132 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)COc1ccc2c(c1)CCC(=O)N2 ZINC000056288250 1407281141 /nfs/dbraw/zinc/28/11/41/1407281141.db2.gz WNEPIGIAQRSTRY-UHFFFAOYSA-N 0 0 397.431 3.296 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1c[nH]c(C(=O)N2CCCC2)c1 ZINC000056288526 1407281163 /nfs/dbraw/zinc/28/11/63/1407281163.db2.gz YGRJJJWVLOSUKQ-UHFFFAOYSA-N 0 0 384.436 3.210 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(Cn2cncn2)cc1 ZINC000056288175 1407281247 /nfs/dbraw/zinc/28/12/47/1407281247.db2.gz VIAJRWODRDVSTM-UHFFFAOYSA-N 0 0 379.420 3.285 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCn1ncc(=O)c2ccccc21 ZINC000056288127 1407281264 /nfs/dbraw/zinc/28/12/64/1407281264.db2.gz JXKMHQWZMFPCBY-UHFFFAOYSA-N 0 0 394.431 3.132 20 5 GGBDRN Cc1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1N1CCNC1=O ZINC000056290614 1407282372 /nfs/dbraw/zinc/28/23/72/1407282372.db2.gz VAQHLEMYOFUBME-UHFFFAOYSA-N 0 0 396.447 3.484 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCNC(=O)c1ccc(F)cc1 ZINC000056288839 1407282510 /nfs/dbraw/zinc/28/25/10/1407282510.db2.gz WXBOCSWZKFAJIT-UHFFFAOYSA-N 0 0 387.411 3.291 20 5 GGBDRN NC(=O)c1ccc(N2CCCC2)c(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c1 ZINC000056320321 1407297530 /nfs/dbraw/zinc/29/75/30/1407297530.db2.gz WCAURVFDVOMMSG-UHFFFAOYSA-N 0 0 393.403 3.028 20 5 GGBDRN CCOc1ccc(C(=O)N[C@@H](C)COc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000056334186 1407302171 /nfs/dbraw/zinc/30/21/71/1407302171.db2.gz WXSPQXYJHFTMHZ-NSHDSACASA-N 0 0 380.347 3.469 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000056332944 1407301701 /nfs/dbraw/zinc/30/17/01/1407301701.db2.gz MSCHAMDNLCSSKT-KRWDZBQOSA-N 0 0 387.392 3.419 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000056332945 1407301900 /nfs/dbraw/zinc/30/19/00/1407301900.db2.gz MSCHAMDNLCSSKT-QGZVFWFLSA-N 0 0 387.392 3.419 20 5 GGBDRN CCOc1ccc(C(=O)Nc2ccc(OCCOC)c(F)c2)cc1[N+](=O)[O-] ZINC000056338306 1407303465 /nfs/dbraw/zinc/30/34/65/1407303465.db2.gz XFOYXPPBRIJPDE-UHFFFAOYSA-N 0 0 378.356 3.410 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(OCC(=O)N(C)C)c1 ZINC000056338887 1407303733 /nfs/dbraw/zinc/30/37/33/1407303733.db2.gz DDGAVVNEPFFVBV-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN Cc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(OCC(=O)N(C)C)c1 ZINC000056339569 1407304326 /nfs/dbraw/zinc/30/43/26/1407304326.db2.gz AIYHMMFUNWSRKN-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)c1cc([N+](=O)[O-])c[nH]1 ZINC000056344376 1407305582 /nfs/dbraw/zinc/30/55/82/1407305582.db2.gz ZWHUXMBOOQPXEA-UHFFFAOYSA-N 0 0 382.351 3.244 20 5 GGBDRN CCOc1ccc(C2(CNC(=O)Cc3ccc([N+](=O)[O-])cc3)CCOCC2)cc1 ZINC000056366391 1407311612 /nfs/dbraw/zinc/31/16/12/1407311612.db2.gz QCCQMTQVTDYEET-UHFFFAOYSA-N 0 0 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C[C@@H](NC(=O)NCc1cccc(N2CCCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000056400276 1407320600 /nfs/dbraw/zinc/32/06/00/1407320600.db2.gz KGFYHYXJMNXCKF-CQSZACIVSA-N 0 0 382.420 3.282 20 5 GGBDRN CC(C)COc1cccc(CNC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000056434617 1407327945 /nfs/dbraw/zinc/32/79/45/1407327945.db2.gz PCARSPXBYSYVAD-HNNXBMFYSA-N 0 0 399.447 3.064 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)NCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000056459550 1407338449 /nfs/dbraw/zinc/33/84/49/1407338449.db2.gz MDFAHCJJMNXYHT-UHFFFAOYSA-N 0 0 384.436 3.300 20 5 GGBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000056460127 1407338776 /nfs/dbraw/zinc/33/87/76/1407338776.db2.gz BZZBNHRXCLAXEE-AWEZNQCLSA-N 0 0 380.408 3.078 20 5 GGBDRN COc1ccc(C2(CNC(=O)Cc3ccccc3[N+](=O)[O-])CCOCC2)cc1 ZINC000056451768 1407335181 /nfs/dbraw/zinc/33/51/81/1407335181.db2.gz CMBFHVSSCRIREE-UHFFFAOYSA-N 0 0 384.432 3.011 20 5 GGBDRN CNc1ccc([N+](=O)[O-])cc1C(=O)NCC1(c2ccc(OC)cc2)CCOCC1 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381.392 3.248 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](c1nccn1C)c1cccc(F)c1 ZINC000043122984 1403713026 /nfs/dbraw/zinc/71/30/26/1403713026.db2.gz BFNVYYCDIGFFDJ-KRWDZBQOSA-N 0 0 399.382 3.387 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)COc1ccc(F)cc1F ZINC000056519645 1407351543 /nfs/dbraw/zinc/35/15/43/1407351543.db2.gz JUBDGHABOXBUHH-SNVBAGLBSA-N 0 0 381.335 3.471 20 5 GGBDRN O=C(CNC(=O)NCc1ccccc1[N+](=O)[O-])Nc1cc(Cl)ccc1Cl ZINC000043138932 1403715513 /nfs/dbraw/zinc/71/55/13/1403715513.db2.gz DPDUJZDNRGAJIF-UHFFFAOYSA-N 0 0 397.218 3.340 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000056519630 1407351746 /nfs/dbraw/zinc/35/17/46/1407351746.db2.gz VORDFXPJMRQDIQ-HNNXBMFYSA-N 0 0 375.381 3.410 20 5 GGBDRN Cc1ccc(NC(=O)N[C@H](CN2CCOCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000043148218 1403719574 /nfs/dbraw/zinc/71/95/74/1403719574.db2.gz FAZLGBOGEADEDR-GOSISDBHSA-N 0 0 384.436 3.098 20 5 GGBDRN 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Cc1cc(N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)nc(C)n1 ZINC000044711587 1403988558 /nfs/dbraw/zinc/98/85/58/1403988558.db2.gz DTWSCUOBQMVKKT-UHFFFAOYSA-N 0 0 381.358 3.347 20 5 GGBDRN CCOc1ccc(C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)cc1[N+](=O)[O-] ZINC000044736572 1403991575 /nfs/dbraw/zinc/99/15/75/1403991575.db2.gz XBJJKPYDGIBJMW-UHFFFAOYSA-N 0 0 383.404 3.446 20 5 GGBDRN COc1ccc(Cl)cc1CNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000044737730 1403991720 /nfs/dbraw/zinc/99/17/20/1403991720.db2.gz ROZUNSPHLLTWJE-UHFFFAOYSA-N 0 0 380.784 3.204 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000044738829 1403992514 /nfs/dbraw/zinc/99/25/14/1403992514.db2.gz PSOWRCLLDCOTNZ-UHFFFAOYSA-N 0 0 398.463 3.310 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(C)c(NC(C)=O)c2)cc([N+](=O)[O-])c1 ZINC000044754886 1403995147 /nfs/dbraw/zinc/99/51/47/1403995147.db2.gz OUWMAXSZUNGLBP-UHFFFAOYSA-N 0 0 385.376 3.291 20 5 GGBDRN Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000044760135 1403997145 /nfs/dbraw/zinc/99/71/45/1403997145.db2.gz JGAMUFVIZSMRLE-UHFFFAOYSA-N 0 0 395.337 3.377 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000044787544 1404002373 /nfs/dbraw/zinc/00/23/73/1404002373.db2.gz IWKANGLVOPRCBV-UHFFFAOYSA-N 0 0 375.812 3.318 20 5 GGBDRN CCC(=O)Nc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000044790682 1404002919 /nfs/dbraw/zinc/00/29/19/1404002919.db2.gz YHKLTUNCGPVREC-UHFFFAOYSA-N 0 0 379.376 3.381 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)Nc2ccc(Cl)c(C(N)=O)c2)cccc1[N+](=O)[O-] ZINC000044806864 1404005637 /nfs/dbraw/zinc/00/56/37/1404005637.db2.gz KIUNRMIEIVJETF-JTQLQIEISA-N 0 0 376.800 3.095 20 5 GGBDRN COC(=O)C1(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)CCCC1 ZINC000044841009 1404010191 /nfs/dbraw/zinc/01/01/91/1404010191.db2.gz SXSULPHSOYERKE-CQSZACIVSA-N 0 0 389.452 3.047 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc(-n2cccc2)c1 ZINC000044873358 1404015186 /nfs/dbraw/zinc/01/51/86/1404015186.db2.gz JVLSRVGXKBGUHQ-UHFFFAOYSA-N 0 0 378.388 3.144 20 5 GGBDRN O=C([C@H]1CCCC[C@@H]1C(F)(F)F)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000045020397 1404038817 /nfs/dbraw/zinc/03/88/17/1404038817.db2.gz DXIUTXNJTMAKDP-KBPBESRZSA-N 0 0 386.374 3.007 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)C2CC2)cc1 ZINC000045022511 1404039452 /nfs/dbraw/zinc/03/94/52/1404039452.db2.gz ALTAPZDLGGOZHW-LJQANCHMSA-N 0 0 381.388 3.079 20 5 GGBDRN O=C(NCc1ccccc1CN1CCCC1=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000045076799 1404049292 /nfs/dbraw/zinc/04/92/92/1404049292.db2.gz WBGGJHMXGWCLMB-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN Cc1c(C(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000045074958 1404049511 /nfs/dbraw/zinc/04/95/11/1404049511.db2.gz FBKTWESUDYPNGU-QGZVFWFLSA-N 0 0 389.339 3.164 20 5 GGBDRN Cc1ccc(-c2noc([C@H](C)N3CCN(c4ccc([N+](=O)[O-])cn4)CC3)n2)cc1 ZINC000045096408 1404052228 /nfs/dbraw/zinc/05/22/28/1404052228.db2.gz OCZKVSBKOKABSR-HNNXBMFYSA-N 0 0 394.435 3.231 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(CCC(=O)N2CCCC2)cc1 ZINC000056607997 1407377409 /nfs/dbraw/zinc/37/74/09/1407377409.db2.gz IGFUITDTRIGTLS-UHFFFAOYSA-N 0 0 396.447 3.472 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(N2CCCC2=O)cc1 ZINC000045190593 1404071922 /nfs/dbraw/zinc/07/19/22/1404071922.db2.gz KJSGLPYZWKJYHY-UHFFFAOYSA-N 0 0 382.420 3.063 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000045213103 1404075905 /nfs/dbraw/zinc/07/59/05/1404075905.db2.gz SHDOQENNPRUWDW-KRWDZBQOSA-N 0 0 399.447 3.483 20 5 GGBDRN COc1cc(CCNC(=O)N(CCC(C)C)C2CC2)c([N+](=O)[O-])cc1OC ZINC000045213254 1404075929 /nfs/dbraw/zinc/07/59/29/1404075929.db2.gz HGJAOQBJTSROIS-UHFFFAOYSA-N 0 0 379.457 3.375 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H](c1nccn1C)c1ccc(F)cc1 ZINC000045233234 1404079169 /nfs/dbraw/zinc/07/91/69/1404079169.db2.gz UWOCGEMJAABHLZ-SFHVURJKSA-N 0 0 397.410 3.398 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(Cn2cccn2)cc1 ZINC000045262171 1404086682 /nfs/dbraw/zinc/08/66/82/1404086682.db2.gz UARAJBJOXNKKKW-UHFFFAOYSA-N 0 0 379.420 3.181 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H](c1nccn1C)c1cccc(F)c1 ZINC000045264688 1404088328 /nfs/dbraw/zinc/08/83/28/1404088328.db2.gz FXNKTSNHRDWTQK-SFHVURJKSA-N 0 0 397.410 3.398 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccccc1Cn1cccn1 ZINC000045321297 1404099052 /nfs/dbraw/zinc/09/90/52/1404099052.db2.gz OPCMDXOPSTXAGP-UHFFFAOYSA-N 0 0 379.420 3.181 20 5 GGBDRN O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000045347560 1404103619 /nfs/dbraw/zinc/10/36/19/1404103619.db2.gz LQKGKXPXHCSGAP-HNNXBMFYSA-N 0 0 382.376 3.281 20 5 GGBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000045382619 1404111131 /nfs/dbraw/zinc/11/11/31/1404111131.db2.gz KVNOLKHPJCTJPX-MRXNPFEDSA-N 0 0 398.463 3.153 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(Cc1ccc(F)cc1F)C1CC1 ZINC000045399157 1404113985 /nfs/dbraw/zinc/11/39/85/1404113985.db2.gz RFWMJSCHYJSBSW-UHFFFAOYSA-N 0 0 399.357 3.259 20 5 GGBDRN Cc1ccc(CNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c(C)c1 ZINC000045400448 1404114006 /nfs/dbraw/zinc/11/40/06/1404114006.db2.gz QJKPMRSBWXOIAJ-UHFFFAOYSA-N 0 0 397.460 3.421 20 5 GGBDRN CC(C)Oc1ccc([C@@H](C)NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000045413744 1404118248 /nfs/dbraw/zinc/11/82/48/1404118248.db2.gz XCSDSKCKWIBCDC-HUUCEWRRSA-N 0 0 399.447 3.378 20 5 GGBDRN CCC1CCC(N(C(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)C2CC2)CC1 ZINC000045416507 1404118783 /nfs/dbraw/zinc/11/87/83/1404118783.db2.gz BZWZPGHPZVNWHH-UHFFFAOYSA-N 0 0 399.447 3.151 20 5 GGBDRN Cc1ccc([C@@H](C)N(C)C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000045417906 1404119721 /nfs/dbraw/zinc/11/97/21/1404119721.db2.gz FVQOETSULSRMDN-CYBMUJFWSA-N 0 0 387.461 3.314 20 5 GGBDRN C[C@@H]1CO[C@@H](C)CN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000045448314 1404122951 /nfs/dbraw/zinc/12/29/51/1404122951.db2.gz BHWLZLXYMXJLDW-MNOVXSKESA-N 0 0 375.347 3.051 20 5 GGBDRN CCN(Cc1ccccc1Cl)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000045450879 1404123802 /nfs/dbraw/zinc/12/38/02/1404123802.db2.gz XXNHPEDGSNFBKO-UHFFFAOYSA-N 0 0 385.811 3.491 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NC1CCC(c2ccccc2)CC1 ZINC000045465352 1404127517 /nfs/dbraw/zinc/12/75/17/1404127517.db2.gz NQMYRAYYCJGMGU-UHFFFAOYSA-N 0 0 381.432 3.167 20 5 GGBDRN CCN(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)C1CCCC1 ZINC000045486780 1404129385 /nfs/dbraw/zinc/12/93/85/1404129385.db2.gz ZRWPCAXLBHIJOM-UHFFFAOYSA-N 0 0 375.454 3.279 20 5 GGBDRN CCN(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cc(C)ccc1C ZINC000045517052 1404136941 /nfs/dbraw/zinc/13/69/41/1404136941.db2.gz MYGYAZSCQGJFGT-UHFFFAOYSA-N 0 0 387.461 3.456 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000045541521 1404144200 /nfs/dbraw/zinc/14/42/00/1404144200.db2.gz LSFHPWCYWXEQJY-UHFFFAOYSA-N 0 0 398.463 3.414 20 5 GGBDRN Cc1cccc(CN2CCN(C(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000045603536 1404157816 /nfs/dbraw/zinc/15/78/16/1404157816.db2.gz LTKFCWOOGRCFFY-UHFFFAOYSA-N 0 0 398.419 3.078 20 5 GGBDRN CCN(Cc1ccc(Cl)s1)C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000045601439 1404157883 /nfs/dbraw/zinc/15/78/83/1404157883.db2.gz YBVHOXMKUGAHSE-NSHDSACASA-N 0 0 395.868 3.477 20 5 GGBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000045606949 1404159474 /nfs/dbraw/zinc/15/94/74/1404159474.db2.gz JSBFHMUQAUPFEY-INIZCTEOSA-N 0 0 398.463 3.153 20 5 GGBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000045624644 1404164546 /nfs/dbraw/zinc/16/45/46/1404164546.db2.gz RXHIVNSCVTYUGY-AWEZNQCLSA-N 0 0 380.408 3.078 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CCc2cc([N+](=O)[O-])ccc21 ZINC000045631520 1404165077 /nfs/dbraw/zinc/16/50/77/1404165077.db2.gz HLHPQSPGQHAMRS-UHFFFAOYSA-N 0 0 391.431 3.399 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCc2ccccc21 ZINC000045670658 1404173353 /nfs/dbraw/zinc/17/33/53/1404173353.db2.gz IDQHCNMXOYJRJN-KRWDZBQOSA-N 0 0 399.472 3.036 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)cc([N+](=O)[O-])c1 ZINC000045673900 1404173908 /nfs/dbraw/zinc/17/39/08/1404173908.db2.gz UZHUMOQWGBAWQK-QGZVFWFLSA-N 0 0 396.403 3.385 20 5 GGBDRN O=C(Nc1ccc(C(=O)NC2CC2)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000045679256 1404175941 /nfs/dbraw/zinc/17/59/41/1404175941.db2.gz DOWQXEXEWIPJCP-UHFFFAOYSA-N 0 0 380.404 3.314 20 5 GGBDRN COc1ccc(CN(C)c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])cc1OC ZINC000045683314 1404176666 /nfs/dbraw/zinc/17/66/66/1404176666.db2.gz ULDJBPJEKCNXGA-UHFFFAOYSA-N 0 0 387.436 3.387 20 5 GGBDRN CC(C)c1cccc(O[C@H](C)C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000045731708 1404188515 /nfs/dbraw/zinc/18/85/15/1404188515.db2.gz LDMNLALDQRTXHJ-MRXNPFEDSA-N 0 0 398.463 3.229 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCCO[C@H](C)c1ccccc1 ZINC000045742381 1404192630 /nfs/dbraw/zinc/19/26/30/1404192630.db2.gz DAZMGRPLOUZVAL-CQSZACIVSA-N 0 0 394.449 3.050 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)ccc1[N+](=O)[O-] ZINC000045780000 1404201874 /nfs/dbraw/zinc/20/18/74/1404201874.db2.gz ZPBGMXFHLXBXBO-UHFFFAOYSA-N 0 0 385.395 3.077 20 5 GGBDRN Cc1ccccc1CN1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1 ZINC000045795158 1404207046 /nfs/dbraw/zinc/20/70/46/1404207046.db2.gz RQQOEJCPICYUNL-UHFFFAOYSA-N 0 0 382.464 3.050 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NCCCCOc2ccc(F)cc2)cc1 ZINC000045799491 1404207710 /nfs/dbraw/zinc/20/77/10/1404207710.db2.gz XQGMOPXQNZGMDE-UHFFFAOYSA-N 0 0 382.413 3.013 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)cc1 ZINC000045799729 1404207833 /nfs/dbraw/zinc/20/78/33/1404207833.db2.gz PSYZEQUXDQAVBX-UHFFFAOYSA-N 0 0 398.444 3.090 20 5 GGBDRN O=C(c1ccccc1)C1CCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000045799725 1404208017 /nfs/dbraw/zinc/20/80/17/1404208017.db2.gz ZGYXNNWPCFJVLY-UHFFFAOYSA-N 0 0 388.445 3.020 20 5 GGBDRN Cn1ccnc1[C@@](O)(CCNc1ccc([N+](=O)[O-])c2cnccc12)C(F)(F)F ZINC000045802403 1404208685 /nfs/dbraw/zinc/20/86/85/1404208685.db2.gz RYNGRQRYBQCLBW-INIZCTEOSA-N 0 0 395.341 3.129 20 5 GGBDRN O=C(NCc1ccc(-n2cccn2)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000045830509 1404217242 /nfs/dbraw/zinc/21/72/42/1404217242.db2.gz IWDCKYUIKKIGDX-UHFFFAOYSA-N 0 0 377.404 3.285 20 5 GGBDRN CCC[C@@](C)(NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)OC ZINC000045858182 1404226175 /nfs/dbraw/zinc/22/61/75/1404226175.db2.gz BOJGSBRKVNDHBV-JOCHJYFZSA-N 0 0 380.444 3.003 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1ccco1)Cc1cccnc1 ZINC000045866200 1404228397 /nfs/dbraw/zinc/22/83/97/1404228397.db2.gz JZIQIIHVWJGDJN-UHFFFAOYSA-N 0 0 387.417 3.282 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccc(O)cc1 ZINC000045889673 1404236676 /nfs/dbraw/zinc/23/66/76/1404236676.db2.gz RABODADJFPPQLN-UHFFFAOYSA-N 0 0 383.326 3.438 20 5 GGBDRN COc1ncccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000045932651 1404245897 /nfs/dbraw/zinc/24/58/97/1404245897.db2.gz KFRXDHNBWRJXAC-UHFFFAOYSA-N 0 0 384.314 3.458 20 5 GGBDRN COc1cc(CN(C)C(=O)COc2cccc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000045933761 1404246361 /nfs/dbraw/zinc/24/63/61/1404246361.db2.gz RQZZSHJHKARCSF-UHFFFAOYSA-N 0 0 396.346 3.242 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(OCC(F)(F)F)nc1 ZINC000045939715 1404247497 /nfs/dbraw/zinc/24/74/97/1404247497.db2.gz UAJYICFNNPQJIK-UHFFFAOYSA-N 0 0 398.341 3.273 20 5 GGBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000045939918 1404247909 /nfs/dbraw/zinc/24/79/09/1404247909.db2.gz LQFRLGWEUHPBFM-LBPRGKRZSA-N 0 0 399.403 3.238 20 5 GGBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000045940783 1404248393 /nfs/dbraw/zinc/24/83/93/1404248393.db2.gz VAVMUOPDVGVEPU-CQSZACIVSA-N 0 0 385.420 3.275 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)c1 ZINC000045960557 1404253181 /nfs/dbraw/zinc/25/31/81/1404253181.db2.gz ZDGQLOBRWDGJMK-CQSZACIVSA-N 0 0 398.463 3.119 20 5 GGBDRN CC[C@H](C)NC(=O)c1cccc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000045960654 1404253186 /nfs/dbraw/zinc/25/31/86/1404253186.db2.gz VKTZVBXLFBDEPP-HNNXBMFYSA-N 0 0 398.463 3.242 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000045962300 1404253848 /nfs/dbraw/zinc/25/38/48/1404253848.db2.gz FAQMZJJEDUSBMV-UHFFFAOYSA-N 0 0 396.447 3.078 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 ZINC000045962288 1404253989 /nfs/dbraw/zinc/25/39/89/1404253989.db2.gz DYNHCTIINJNEHS-ZDUSSCGKSA-N 0 0 387.461 3.345 20 5 GGBDRN Cc1nn(-c2nc(C)cc(C)n2)c(C)c1CC(=O)Oc1cc([N+](=O)[O-])ccc1C ZINC000045997730 1404267720 /nfs/dbraw/zinc/26/77/20/1404267720.db2.gz NKUJQBADEKKZFD-UHFFFAOYSA-N 0 0 395.419 3.261 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)CCn1c(=O)oc2cc(Cl)ccc21 ZINC000045997948 1404267823 /nfs/dbraw/zinc/26/78/23/1404267823.db2.gz ROYWREQQTWAWKC-UHFFFAOYSA-N 0 0 376.752 3.460 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2 ZINC000045998263 1404268014 /nfs/dbraw/zinc/26/80/14/1404268014.db2.gz XBQRHNUNTCFCRN-UHFFFAOYSA-N 0 0 389.429 3.161 20 5 GGBDRN O=C(Nc1ccc(Cl)c(F)c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 ZINC000045999563 1404268675 /nfs/dbraw/zinc/26/86/75/1404268675.db2.gz LUEFCVSWRSFOFS-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ncc(Cc2ccccc2F)s1 ZINC000046026968 1404278537 /nfs/dbraw/zinc/27/85/37/1404278537.db2.gz IAXLABSHYJXJEC-UHFFFAOYSA-N 0 0 387.392 3.221 20 5 GGBDRN O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000046072268 1404290467 /nfs/dbraw/zinc/29/04/67/1404290467.db2.gz SYSKFCPXENFGEW-AWEZNQCLSA-N 0 0 397.218 3.473 20 5 GGBDRN CCOC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000046081770 1404292024 /nfs/dbraw/zinc/29/20/24/1404292024.db2.gz HMRBEIRFVGTIPU-OAHLLOKOSA-N 0 0 389.452 3.000 20 5 GGBDRN Cc1ccc(OCCCCNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000046104915 1404296767 /nfs/dbraw/zinc/29/67/67/1404296767.db2.gz RPFBLMQXOAUXDG-UHFFFAOYSA-N 0 0 395.419 3.073 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(-n2nc(C)cc2C)nc1 ZINC000046119420 1404303109 /nfs/dbraw/zinc/30/31/09/1404303109.db2.gz KUWZNTBCDSWQLL-UHFFFAOYSA-N 0 0 396.407 3.123 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)cn2)n1 ZINC000046120786 1404304933 /nfs/dbraw/zinc/30/49/33/1404304933.db2.gz XUJARHSZSFRZEV-UHFFFAOYSA-N 0 0 380.408 3.422 20 5 GGBDRN O=C(CSc1nnc(-c2ccc(F)cc2)o1)NCc1ccccc1[N+](=O)[O-] ZINC000046135958 1404309014 /nfs/dbraw/zinc/30/90/14/1404309014.db2.gz DXOCIVFEKSVFDY-UHFFFAOYSA-N 0 0 388.380 3.192 20 5 GGBDRN CCOc1ccc(C(=O)N[C@@H](C(=O)NCc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000046146883 1404311350 /nfs/dbraw/zinc/31/13/50/1404311350.db2.gz UZEFEKDYPZMWAE-LJQANCHMSA-N 0 0 399.447 3.064 20 5 GGBDRN O=C(COc1ccc(Oc2ccccn2)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000046147787 1404311869 /nfs/dbraw/zinc/31/18/69/1404311869.db2.gz RAIXPSUGQMJNPF-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 ZINC000046162421 1404316664 /nfs/dbraw/zinc/31/66/64/1404316664.db2.gz HWVPFWTZHLTVOJ-QGZVFWFLSA-N 0 0 381.432 3.323 20 5 GGBDRN CCOCc1ccc(CNC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000046177814 1404322120 /nfs/dbraw/zinc/32/21/20/1404322120.db2.gz OQLHQYSPWLVLRG-UHFFFAOYSA-N 0 0 398.463 3.163 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C)cc2C(=O)OC)cc1OC ZINC000046186566 1404325665 /nfs/dbraw/zinc/32/56/65/1404325665.db2.gz TXEULDUYQYZELO-UHFFFAOYSA-N 0 0 388.376 3.349 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1nc(CN2CCCCCC2)cs1 ZINC000046188506 1404326548 /nfs/dbraw/zinc/32/65/48/1404326548.db2.gz SPQLJVWAHDWNTR-UHFFFAOYSA-N 0 0 390.465 3.445 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 ZINC000046207771 1404331080 /nfs/dbraw/zinc/33/10/80/1404331080.db2.gz DZOJGMCIPFCDKE-NWDGAFQWSA-N 0 0 385.445 3.447 20 5 GGBDRN COC(=O)C(C)(C)NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000046217156 1404334660 /nfs/dbraw/zinc/33/46/60/1404334660.db2.gz MGYCOPKOZYFTQY-UHFFFAOYSA-N 0 0 395.462 3.192 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000046223547 1404336124 /nfs/dbraw/zinc/33/61/24/1404336124.db2.gz FIIOQISATYJOPL-UHFFFAOYSA-N 0 0 398.419 3.378 20 5 GGBDRN CCOc1ccccc1C(=O)NCCCC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046223590 1404336530 /nfs/dbraw/zinc/33/65/30/1404336530.db2.gz NPJWFXMXRQUWLD-UHFFFAOYSA-N 0 0 399.447 3.162 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)cn1 ZINC000046229941 1404338964 /nfs/dbraw/zinc/33/89/64/1404338964.db2.gz MWKDPQVKIJQCBT-UHFFFAOYSA-N 0 0 387.749 3.384 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000046245111 1404343480 /nfs/dbraw/zinc/34/34/80/1404343480.db2.gz KGRFXBGUWJJHMJ-UHFFFAOYSA-N 0 0 396.447 3.489 20 5 GGBDRN CC(C)NC(=O)Cc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000046244798 1404344022 /nfs/dbraw/zinc/34/40/22/1404344022.db2.gz PCOAIDMCHYTXCZ-UHFFFAOYSA-N 0 0 384.436 3.103 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000046250537 1404345358 /nfs/dbraw/zinc/34/53/58/1404345358.db2.gz CCYNSEVMHKRHIY-UHFFFAOYSA-N 0 0 396.447 3.200 20 5 GGBDRN CCNC(=O)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000046250476 1404345474 /nfs/dbraw/zinc/34/54/74/1404345474.db2.gz ODKLGPKMMLPPOT-UHFFFAOYSA-N 0 0 392.209 3.359 20 5 GGBDRN CCN(CC)C(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000046266577 1404350189 /nfs/dbraw/zinc/35/01/89/1404350189.db2.gz WKQRBRJCSOJJDQ-UHFFFAOYSA-N 0 0 385.420 3.267 20 5 GGBDRN COc1ccc(CN(C)C(=O)Cc2ccccc2[N+](=O)[O-])cc1OC(F)F ZINC000046267803 1404350600 /nfs/dbraw/zinc/35/06/00/1404350600.db2.gz YTYNVNYOZZKHRL-UHFFFAOYSA-N 0 0 380.347 3.406 20 5 GGBDRN Cc1ccc(CN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C2CC2)o1 ZINC000046284237 1404353555 /nfs/dbraw/zinc/35/35/55/1404353555.db2.gz OAKCZVMYNHAEIN-UHFFFAOYSA-N 0 0 399.403 3.376 20 5 GGBDRN CCn1cnnc1-c1cccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000046294234 1404355338 /nfs/dbraw/zinc/35/53/38/1404355338.db2.gz YJFZQHGOQNNXMA-UHFFFAOYSA-N 0 0 380.408 3.314 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCc1ccc(OC2CCCC2)nc1 ZINC000046301823 1404355732 /nfs/dbraw/zinc/35/57/32/1404355732.db2.gz JBDUUOYAZOMWDR-UHFFFAOYSA-N 0 0 384.436 3.430 20 5 GGBDRN COC(=O)c1cc(C(=O)NCc2ccc(OC3CCCC3)nc2)cc([N+](=O)[O-])c1 ZINC000046302923 1404356667 /nfs/dbraw/zinc/35/66/67/1404356667.db2.gz HMEXLGCWHGCNIP-UHFFFAOYSA-N 0 0 399.403 3.028 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)CSc3ccc([N+](=O)[O-])cc3)cn2)n1 ZINC000046310177 1404359346 /nfs/dbraw/zinc/35/93/46/1404359346.db2.gz GWTNNNOPXFSCAM-UHFFFAOYSA-N 0 0 397.460 3.201 20 5 GGBDRN COc1ccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000046343715 1404373137 /nfs/dbraw/zinc/37/31/37/1404373137.db2.gz RYTPLTDHZJAQMD-HUUCEWRRSA-N 0 0 399.447 3.465 20 5 GGBDRN CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046361779 1404383801 /nfs/dbraw/zinc/38/38/01/1404383801.db2.gz AQDKIDLSEAQTCI-HNNXBMFYSA-N 0 0 379.457 3.493 20 5 GGBDRN CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046361765 1404383919 /nfs/dbraw/zinc/38/39/19/1404383919.db2.gz CERYXTCWFQQYHF-IBGZPJMESA-N 0 0 398.463 3.077 20 5 GGBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000046400153 1404398928 /nfs/dbraw/zinc/39/89/28/1404398928.db2.gz UDHRWXAWNCPRAB-GFCCVEGCSA-N 0 0 384.367 3.419 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000046432944 1404411866 /nfs/dbraw/zinc/41/18/66/1404411866.db2.gz NDACBPNVZJCMCV-GJZGRUSLSA-N 0 0 399.447 3.465 20 5 GGBDRN CN(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)C1C2CC3CC(C2)CC1C3 ZINC000046441898 1404416959 /nfs/dbraw/zinc/41/69/59/1404416959.db2.gz UZZYHHTZVGOSRV-UHFFFAOYSA-N 0 0 381.436 3.072 20 5 GGBDRN CC(C)[C@@H](C)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)C1CC1 ZINC000046444801 1404418852 /nfs/dbraw/zinc/41/88/52/1404418852.db2.gz VUJWCBNIXZXTIF-CYBMUJFWSA-N 0 0 375.425 3.318 20 5 GGBDRN O=C(NCCOc1cccc(C(F)(F)F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000046470187 1404431066 /nfs/dbraw/zinc/43/10/66/1404431066.db2.gz CYOFEYKSWKSQBR-UHFFFAOYSA-N 0 0 398.293 3.151 20 5 GGBDRN O=C(NCCOc1ccc(C(F)(F)F)cc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000046480192 1404436968 /nfs/dbraw/zinc/43/69/68/1404436968.db2.gz SDTKANCYGJHGEE-UHFFFAOYSA-N 0 0 398.293 3.151 20 5 GGBDRN NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCC(c2ccccc2)CC1 ZINC000046479029 1404437455 /nfs/dbraw/zinc/43/74/55/1404437455.db2.gz YNXFNWKXWDYNTA-UHFFFAOYSA-N 0 0 375.450 3.381 20 5 GGBDRN COc1ccc(C(=O)NCCOc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000046479783 1404437466 /nfs/dbraw/zinc/43/74/66/1404437466.db2.gz UWAZZVGVRFDQIV-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN COc1ccc(C(=O)NCCOc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000046480807 1404438440 /nfs/dbraw/zinc/43/84/40/1404438440.db2.gz FGBAKZSSZZLLHO-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN Cc1cc(C(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)c(C)n1-c1nccs1 ZINC000046487013 1404441240 /nfs/dbraw/zinc/44/12/40/1404441240.db2.gz CZMXIHRLWBLMFV-UHFFFAOYSA-N 0 0 398.400 3.250 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3CCO[C@H]4CCCC[C@@H]43)cc2)c(C)c1[N+](=O)[O-] ZINC000046493427 1404443761 /nfs/dbraw/zinc/44/37/61/1404443761.db2.gz MFXDBSRZJBFYOY-OALUTQOASA-N 0 0 398.463 3.240 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCO[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000046495180 1404443778 /nfs/dbraw/zinc/44/37/78/1404443778.db2.gz SDKBZULLPOICTI-RHSMWYFYSA-N 0 0 380.466 3.007 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCO[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000046495174 1404443829 /nfs/dbraw/zinc/44/38/29/1404443829.db2.gz SDKBZULLPOICTI-YOEHRIQHSA-N 0 0 380.466 3.007 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N3CCO[C@H]4CCCC[C@H]43)cc2)c(C)c1[N+](=O)[O-] ZINC000046493430 1404443875 /nfs/dbraw/zinc/44/38/75/1404443875.db2.gz MFXDBSRZJBFYOY-MOPGFXCFSA-N 0 0 398.463 3.240 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCO[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000046495178 1404443972 /nfs/dbraw/zinc/44/39/72/1404443972.db2.gz SDKBZULLPOICTI-PBHICJAKSA-N 0 0 380.466 3.007 20 5 GGBDRN COc1ccc(CN(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(OC)c1 ZINC000046502608 1404449740 /nfs/dbraw/zinc/44/97/40/1404449740.db2.gz CBUKNYFQZXGTMB-UHFFFAOYSA-N 0 0 384.392 3.294 20 5 GGBDRN O=C(OCc1nc(-c2ccccc2)no1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000046504328 1404449809 /nfs/dbraw/zinc/44/98/09/1404449809.db2.gz AWHUHWJPIRJIMS-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000046507269 1404451736 /nfs/dbraw/zinc/45/17/36/1404451736.db2.gz TZPFXYSVIVHBED-AWEZNQCLSA-N 0 0 386.360 3.134 20 5 GGBDRN COc1c(F)cc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1F ZINC000056716379 1407406427 /nfs/dbraw/zinc/40/64/27/1407406427.db2.gz PPOSFMGDXHMFCB-UHFFFAOYSA-N 0 0 392.362 3.236 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(NC(=O)OC)cc2)cc([N+](=O)[O-])c1 ZINC000046520922 1404459709 /nfs/dbraw/zinc/45/97/09/1404459709.db2.gz XUMAFJKJMIVBKZ-UHFFFAOYSA-N 0 0 387.348 3.202 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 ZINC000046535611 1404468644 /nfs/dbraw/zinc/46/86/44/1404468644.db2.gz AGQSRBJHEZGSJY-UHFFFAOYSA-N 0 0 386.404 3.238 20 5 GGBDRN O=C(c1csc(-c2ccco2)n1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000046560657 1404480712 /nfs/dbraw/zinc/48/07/12/1404480712.db2.gz FHHIGHKBTKGSNT-UHFFFAOYSA-N 0 0 384.417 3.274 20 5 GGBDRN COc1cccc([C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000046582743 1404492693 /nfs/dbraw/zinc/49/26/93/1404492693.db2.gz QBFNXAMTFAXZBC-QGZVFWFLSA-N 0 0 376.434 3.438 20 5 GGBDRN CCOc1ccc(C(=O)NCc2ccc(OCC(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000046594965 1404496709 /nfs/dbraw/zinc/49/67/09/1404496709.db2.gz XFMPQHVEAFCOFB-UHFFFAOYSA-N 0 0 399.325 3.260 20 5 GGBDRN C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599604 1404500446 /nfs/dbraw/zinc/50/04/46/1404500446.db2.gz AYRDEGPPAGWVCD-OAHLLOKOSA-N 0 0 380.448 3.255 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 ZINC000046604568 1404502853 /nfs/dbraw/zinc/50/28/53/1404502853.db2.gz DXGMOKOMJGEELQ-UHFFFAOYSA-N 0 0 384.436 3.441 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc([N+](=O)[O-])c1 ZINC000046606052 1404504169 /nfs/dbraw/zinc/50/41/69/1404504169.db2.gz NDTCPRBUXVDLPE-UHFFFAOYSA-N 0 0 399.403 3.162 20 5 GGBDRN CCOc1cc(CNC(=O)Cc2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000046610177 1404507122 /nfs/dbraw/zinc/50/71/22/1404507122.db2.gz MZWARUGWJBQNIY-UHFFFAOYSA-N 0 0 380.347 3.454 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(CCc2cccs2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000056726785 1407409756 /nfs/dbraw/zinc/40/97/56/1407409756.db2.gz QSRDIQFOYVLVIO-OAHLLOKOSA-N 0 0 388.493 3.287 20 5 GGBDRN CCc1ccc(CNC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)s1 ZINC000046620742 1404514948 /nfs/dbraw/zinc/51/49/48/1404514948.db2.gz HXFUGUSHFWWNSL-UHFFFAOYSA-N 0 0 398.444 3.003 20 5 GGBDRN COc1ccccc1CCNC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000046629053 1404518317 /nfs/dbraw/zinc/51/83/17/1404518317.db2.gz AAOCZEPDHKGHRP-UHFFFAOYSA-N 0 0 396.346 3.186 20 5 GGBDRN COc1ccc(C(=O)NCCc2ccc(-n3nc(C)cc3C)cc2)cc1[N+](=O)[O-] ZINC000046634809 1404522343 /nfs/dbraw/zinc/52/23/43/1404522343.db2.gz TYZHIRLJWKGTBP-UHFFFAOYSA-N 0 0 394.431 3.378 20 5 GGBDRN CCNC(=O)c1ccc(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000046636635 1404523035 /nfs/dbraw/zinc/52/30/35/1404523035.db2.gz IOMFTINSUHIOCM-ZDUSSCGKSA-N 0 0 387.461 3.142 20 5 GGBDRN CCN(C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000046644753 1404528900 /nfs/dbraw/zinc/52/89/00/1404528900.db2.gz DHAWWAWEGPVBPI-CQSZACIVSA-N 0 0 387.411 3.464 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000046647037 1404529380 /nfs/dbraw/zinc/52/93/80/1404529380.db2.gz WYJSJYGUGOCDET-CYBMUJFWSA-N 0 0 398.419 3.135 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1ccc(F)cc1Cl ZINC000046658460 1404537636 /nfs/dbraw/zinc/53/76/36/1404537636.db2.gz MYRQJFMCEPXOQJ-UHFFFAOYSA-N 0 0 399.769 3.331 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1ccnc(Oc2ccccc2)c1 ZINC000046660990 1404538865 /nfs/dbraw/zinc/53/88/65/1404538865.db2.gz MHLRCDAIGHSOFG-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1cccc(OCc2ccccn2)c1 ZINC000046678146 1404547533 /nfs/dbraw/zinc/54/75/33/1404547533.db2.gz SUTSQCDHTICODU-UHFFFAOYSA-N 0 0 377.400 3.428 20 5 GGBDRN COc1ccc(C(=O)NCc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000046678409 1404548643 /nfs/dbraw/zinc/54/86/43/1404548643.db2.gz XQWXVFAIRTUJCZ-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1cccc(OCC(F)(F)F)c1 ZINC000046678883 1404549536 /nfs/dbraw/zinc/54/95/36/1404549536.db2.gz DDQLNOUAWZUVNC-UHFFFAOYSA-N 0 0 384.310 3.231 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2ccc(-n3cccn3)cc2)c1 ZINC000046699785 1404557296 /nfs/dbraw/zinc/55/72/96/1404557296.db2.gz WHUOESSCAAYGPI-UHFFFAOYSA-N 0 0 380.404 3.174 20 5 GGBDRN CNc1ccc(C(=O)Nc2ccc(OC)c(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000046710025 1404560708 /nfs/dbraw/zinc/56/07/08/1404560708.db2.gz RYFGPMPJVIEBEV-UHFFFAOYSA-N 0 0 384.392 3.024 20 5 GGBDRN CCNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000046719618 1404566245 /nfs/dbraw/zinc/56/62/45/1404566245.db2.gz ACYIETZEPGZTEU-UHFFFAOYSA-N 0 0 377.784 3.259 20 5 GGBDRN CCNC(=O)c1ccc(Cl)cc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000046720407 1404567093 /nfs/dbraw/zinc/56/70/93/1404567093.db2.gz BBNVOIJCSBTJNE-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CC(C)Oc1cccc([C@@H](C)NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000046726000 1404569753 /nfs/dbraw/zinc/56/97/53/1404569753.db2.gz DXOBHPZMBVIOLJ-OAHLLOKOSA-N 0 0 399.447 3.379 20 5 GGBDRN O=C(Nc1ccc(N2CCCCC2)nc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000046747276 1404575942 /nfs/dbraw/zinc/57/59/42/1404575942.db2.gz MCESJINYWSJMNC-UHFFFAOYSA-N 0 0 392.419 3.418 20 5 GGBDRN COc1cc(C(=O)Nc2ccn(Cc3ccccc3)n2)c([N+](=O)[O-])cc1OC ZINC000046786250 1404588942 /nfs/dbraw/zinc/58/89/42/1404588942.db2.gz GQDRGHMXUXFWKL-UHFFFAOYSA-N 0 0 382.376 3.109 20 5 GGBDRN Cc1cc2cc(NC(=O)CSc3ccc(C(N)=O)cc3[N+](=O)[O-])ccc2[nH]1 ZINC000046793109 1404591597 /nfs/dbraw/zinc/59/15/97/1404591597.db2.gz STUYTQBYBDVGGG-UHFFFAOYSA-N 0 0 384.417 3.214 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3C)C2)nc1 ZINC000046820430 1404602997 /nfs/dbraw/zinc/60/29/97/1404602997.db2.gz IBCZJDSODRVHMX-HNNXBMFYSA-N 0 0 382.420 3.098 20 5 GGBDRN O=C(NCCCC1CCCC1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000046873000 1404619321 /nfs/dbraw/zinc/61/93/21/1404619321.db2.gz ULXNEPWJWGXCDU-UHFFFAOYSA-N 0 0 394.497 3.094 20 5 GGBDRN C[C@@]1(c2ccc(Cl)cc2)NC(=O)N(CCOc2cccc([N+](=O)[O-])c2)C1=O ZINC000046875352 1404620329 /nfs/dbraw/zinc/62/03/29/1404620329.db2.gz TWRAEYBWVZKYCM-SFHVURJKSA-N 0 0 389.795 3.094 20 5 GGBDRN CC(C)[C@H](NC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccc1 ZINC000046888146 1404622803 /nfs/dbraw/zinc/62/28/03/1404622803.db2.gz UVILVPZFFXVTEH-IBGZPJMESA-N 0 0 383.452 3.219 20 5 GGBDRN CC(C)Cc1ccc(C(=O)C2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)CC2)cc1 ZINC000046890249 1404623882 /nfs/dbraw/zinc/62/38/82/1404623882.db2.gz KQONZJOOMOBZOS-UHFFFAOYSA-N 0 0 398.463 3.111 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1cnn(Cc2ccccc2)c1 ZINC000046959826 1404654145 /nfs/dbraw/zinc/65/41/45/1404654145.db2.gz UCWPELUYPRRHRZ-UHFFFAOYSA-N 0 0 379.420 3.181 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000046968847 1404656294 /nfs/dbraw/zinc/65/62/94/1404656294.db2.gz RAOIRORUMGUINI-UHFFFAOYSA-N 0 0 391.468 3.152 20 5 GGBDRN CC(C)Oc1cccc([C@H](C)NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000046999462 1404667953 /nfs/dbraw/zinc/66/79/53/1404667953.db2.gz APZOJRBAKTVVDU-LSDHHAIUSA-N 0 0 399.447 3.378 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCO[C@H]2CCCC[C@H]2C)cc1OC ZINC000047005814 1404671468 /nfs/dbraw/zinc/67/14/68/1404671468.db2.gz YXDACXHYDXHXHK-CJNGLKHVSA-N 0 0 380.441 3.327 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCO[C@H]2CCCC[C@@H]2C)cc1OC ZINC000047005810 1404671664 /nfs/dbraw/zinc/67/16/64/1404671664.db2.gz YXDACXHYDXHXHK-BBRMVZONSA-N 0 0 380.441 3.327 20 5 GGBDRN C[C@@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000047009915 1404673906 /nfs/dbraw/zinc/67/39/06/1404673906.db2.gz XVEWCQUXBVELQB-AWEZNQCLSA-N 0 0 388.493 3.245 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](c1ccco1)N1CCCCC1 ZINC000047031281 1404680791 /nfs/dbraw/zinc/68/07/91/1404680791.db2.gz BSFGYOGIIYZRAS-INIZCTEOSA-N 0 0 393.465 3.002 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)NCCNc2ncccn2)cc1[N+](=O)[O-] ZINC000047106366 1404708542 /nfs/dbraw/zinc/70/85/42/1404708542.db2.gz LLRSFSKYHMLNNX-UHFFFAOYSA-N 0 0 389.481 3.365 20 5 GGBDRN CCCNC(=O)c1cccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000047119418 1404712970 /nfs/dbraw/zinc/71/29/70/1404712970.db2.gz ZIMYKQMIIWMXIH-UHFFFAOYSA-N 0 0 387.392 3.004 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)N2CCC[C@@H]2c2ccsc2)c([N+](=O)[O-])c1 ZINC000047165660 1404727646 /nfs/dbraw/zinc/72/76/46/1404727646.db2.gz LIRPRFKBKASVDW-CYBMUJFWSA-N 0 0 391.474 3.211 20 5 GGBDRN O=C(Cn1nccc1[N+](=O)[O-])N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 ZINC000047169804 1404730125 /nfs/dbraw/zinc/73/01/25/1404730125.db2.gz NEHUKTHFHQCQIV-OAHLLOKOSA-N 0 0 399.794 3.416 20 5 GGBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccco2)cs1 ZINC000047171210 1404730708 /nfs/dbraw/zinc/73/07/08/1404730708.db2.gz PFWUFKSGPUOZCW-UHFFFAOYSA-N 0 0 386.389 3.070 20 5 GGBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(Cn3cccn3)cc2)cc([N+](=O)[O-])c1 ZINC000047177035 1404734405 /nfs/dbraw/zinc/73/44/05/1404734405.db2.gz XJMPEFZZRWCNMJ-UHFFFAOYSA-N 0 0 394.387 3.269 20 5 GGBDRN O=C(NCc1ccc(OCCOc2ccccc2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000047194269 1404742170 /nfs/dbraw/zinc/74/21/70/1404742170.db2.gz ARANXGJGDVERKY-UHFFFAOYSA-N 0 0 393.399 3.378 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000047198411 1404742728 /nfs/dbraw/zinc/74/27/28/1404742728.db2.gz XWASZPGFSQMMBJ-UHFFFAOYSA-N 0 0 383.429 3.489 20 5 GGBDRN Cc1nccn1-c1ncccc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000047228300 1404757031 /nfs/dbraw/zinc/75/70/31/1404757031.db2.gz DTPKOZQFYOFZPI-UHFFFAOYSA-N 0 0 392.419 3.336 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(N2CCNC2=O)c1 ZINC000047235744 1404760623 /nfs/dbraw/zinc/76/06/23/1404760623.db2.gz ALCMQUVLPCXBIQ-LBPRGKRZSA-N 0 0 386.433 3.244 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cn2cncn2)c1 ZINC000047233387 1404760713 /nfs/dbraw/zinc/76/07/13/1404760713.db2.gz QBXAYQGTHZECQR-ZDUSSCGKSA-N 0 0 383.433 3.354 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-n2cncn2)c(F)c1 ZINC000047244253 1404764552 /nfs/dbraw/zinc/76/45/52/1404764552.db2.gz HPQRNBSQMODOBW-NSHDSACASA-N 0 0 387.396 3.434 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000047277081 1404783121 /nfs/dbraw/zinc/78/31/21/1404783121.db2.gz RDTVZCUZNLQBDT-UHFFFAOYSA-N 0 0 394.431 3.455 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2ncc(-c3ccccc3)o2)c1C ZINC000047279969 1404785478 /nfs/dbraw/zinc/78/54/78/1404785478.db2.gz IHWQOEWGRLMGKD-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000047292741 1404791454 /nfs/dbraw/zinc/79/14/54/1404791454.db2.gz TVYHAZDWOQZYRI-UHFFFAOYSA-N 0 0 388.811 3.134 20 5 GGBDRN CCOc1ccc(C(=O)OCc2csc(-c3cnn(C)c3)n2)cc1[N+](=O)[O-] ZINC000047317449 1404804086 /nfs/dbraw/zinc/80/40/86/1404804086.db2.gz HFOKEDFFJNZHJX-UHFFFAOYSA-N 0 0 388.405 3.208 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)nc1 ZINC000047323227 1404805800 /nfs/dbraw/zinc/80/58/00/1404805800.db2.gz OGPBCPZPSAZHHB-UHFFFAOYSA-N 0 0 397.435 3.489 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@](C)(c3ccc(Cl)cc3)C2=O)cc1[N+](=O)[O-] ZINC000047346615 1404812125 /nfs/dbraw/zinc/81/21/25/1404812125.db2.gz IARJKWPKZZUHTN-GOSISDBHSA-N 0 0 389.795 3.224 20 5 GGBDRN Cc1ccc(NC(=O)C2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)nc1 ZINC000047345916 1404812298 /nfs/dbraw/zinc/81/22/98/1404812298.db2.gz OUPUKGMHQZZWEX-UHFFFAOYSA-N 0 0 397.435 3.489 20 5 GGBDRN Cc1c(CN2C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C2=O)cccc1[N+](=O)[O-] ZINC000047349290 1404812947 /nfs/dbraw/zinc/81/29/47/1404812947.db2.gz HLTHSGZAENOQRS-KRWDZBQOSA-N 0 0 378.388 3.048 20 5 GGBDRN Cc1c(CN2C(=O)N[C@](C)(c3ccc4c(c3)CCC4)C2=O)cccc1[N+](=O)[O-] ZINC000047353970 1404814285 /nfs/dbraw/zinc/81/42/85/1404814285.db2.gz ZWVDVJJFJKSIGN-OAQYLSRUSA-N 0 0 379.416 3.359 20 5 GGBDRN CCC[C@@H](NC(=O)COc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000047354859 1404814403 /nfs/dbraw/zinc/81/44/03/1404814403.db2.gz KQLYKWQTEUOGIT-MRXNPFEDSA-N 0 0 386.404 3.418 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)N(C)[C@@H]2CCCc3ccccc32)c1 ZINC000047354829 1404814410 /nfs/dbraw/zinc/81/44/10/1404814410.db2.gz DFVBWSLZFAOCMW-QGZVFWFLSA-N 0 0 398.415 3.296 20 5 GGBDRN Cc1c(CN2C(=O)N[C@@](C)(c3ccc4c(c3)CCC4)C2=O)cccc1[N+](=O)[O-] ZINC000047353971 1404814427 /nfs/dbraw/zinc/81/44/27/1404814427.db2.gz ZWVDVJJFJKSIGN-NRFANRHFSA-N 0 0 379.416 3.359 20 5 GGBDRN CCN(CC)C(=O)c1cccc(NC(=O)COc2cccc([N+](=O)[O-])c2C)c1 ZINC000047355473 1404815050 /nfs/dbraw/zinc/81/50/50/1404815050.db2.gz JUAFOMBAUMHERY-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cc(-c3ccccc3)on2)C1=O ZINC000047357354 1404815067 /nfs/dbraw/zinc/81/50/67/1404815067.db2.gz JFGPKJARJBTDBE-HXUWFJFHSA-N 0 0 392.371 3.217 20 5 GGBDRN Cc1c(OCC(=O)NCc2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000047355369 1404815084 /nfs/dbraw/zinc/81/50/84/1404815084.db2.gz OPYBPFTWSPQPPU-UHFFFAOYSA-N 0 0 384.310 3.497 20 5 GGBDRN Cc1ccc(C(=O)N(C)C)cc1OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000047362419 1404817088 /nfs/dbraw/zinc/81/70/88/1404817088.db2.gz JDJQOAKJSBLMRC-UHFFFAOYSA-N 0 0 391.811 3.276 20 5 GGBDRN Cn1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1cccnc1 ZINC000047370176 1404818259 /nfs/dbraw/zinc/81/82/59/1404818259.db2.gz YNGJTIOUZZOLBU-UHFFFAOYSA-N 0 0 395.404 3.128 20 5 GGBDRN CCc1ccc(-c2nc(Cn3cc([N+](=O)[O-])cc(C(=O)OC)c3=O)cs2)cc1 ZINC000047369071 1404818388 /nfs/dbraw/zinc/81/83/88/1404818388.db2.gz TXRLBMGPGPVMPF-UHFFFAOYSA-N 0 0 399.428 3.277 20 5 GGBDRN Cc1ccc(S(C)(=O)=O)cc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000047393661 1404825190 /nfs/dbraw/zinc/82/51/90/1404825190.db2.gz ZHZCJGFPWASALX-GFCCVEGCSA-N 0 0 377.422 3.189 20 5 GGBDRN O=C(NC1CC1)[C@@H]1CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000047402219 1404827238 /nfs/dbraw/zinc/82/72/38/1404827238.db2.gz XOPCWHRGHAJRFA-SFHVURJKSA-N 0 0 394.431 3.222 20 5 GGBDRN O=C(NCc1ccc(N2CCCCC2)nc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000047417446 1404831105 /nfs/dbraw/zinc/83/11/05/1404831105.db2.gz ORFWZCRRVJHNDF-UHFFFAOYSA-N 0 0 395.463 3.484 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000047418921 1404831717 /nfs/dbraw/zinc/83/17/17/1404831717.db2.gz 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O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1cc(Cl)ccc1O ZINC000047495367 1404851916 /nfs/dbraw/zinc/85/19/16/1404851916.db2.gz YCAOAUQSGNDDDJ-UHFFFAOYSA-N 0 0 375.724 3.361 20 5 GGBDRN O=C(COc1cccc(Cl)c1)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000047495761 1404851991 /nfs/dbraw/zinc/85/19/91/1404851991.db2.gz QQEILTHLCGAJBR-UHFFFAOYSA-N 0 0 389.751 3.420 20 5 GGBDRN CCOC(=O)COc1cccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047498170 1404852385 /nfs/dbraw/zinc/85/23/85/1404852385.db2.gz YCOYIJKOVJNLLS-CYBMUJFWSA-N 0 0 387.392 3.419 20 5 GGBDRN Cc1nc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)sc1-c1ccccc1 ZINC000047508508 1404854977 /nfs/dbraw/zinc/85/49/77/1404854977.db2.gz AGLQCMVDDUAUQO-UHFFFAOYSA-N 0 0 396.428 3.395 20 5 GGBDRN O=C(c1cc(-c2ccccc2F)on1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047526905 1404859004 /nfs/dbraw/zinc/85/90/04/1404859004.db2.gz NJZAUXIBKNPVPZ-UHFFFAOYSA-N 0 0 396.378 3.351 20 5 GGBDRN Cc1cc(=O)oc2cc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc12 ZINC000047542827 1404863355 /nfs/dbraw/zinc/86/33/55/1404863355.db2.gz WCKBAAMLDVPXNU-UHFFFAOYSA-N 0 0 395.776 3.431 20 5 GGBDRN CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000047543294 1404863714 /nfs/dbraw/zinc/86/37/14/1404863714.db2.gz WVPUMFOJKBHPET-UHFFFAOYSA-N 0 0 398.824 3.188 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000047553261 1404866086 /nfs/dbraw/zinc/86/60/86/1404866086.db2.gz YULBSXPMHSUCNS-UHFFFAOYSA-N 0 0 396.325 3.154 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000047553283 1404866559 /nfs/dbraw/zinc/86/65/59/1404866559.db2.gz IQRDWETUJACPLV-UHFFFAOYSA-N 0 0 382.298 3.129 20 5 GGBDRN COCCn1c(C)c(C)nc1S[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000047561795 1404868536 /nfs/dbraw/zinc/86/85/36/1404868536.db2.gz CDCDTRHACKKOJY-CQSZACIVSA-N 0 0 392.481 3.482 20 5 GGBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)c(C(=O)N2CCCC2)cc1OC ZINC000047570350 1404869971 /nfs/dbraw/zinc/86/99/71/1404869971.db2.gz 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ZINC000061365513 1408115270 /nfs/dbraw/zinc/11/52/70/1408115270.db2.gz YJZLJGGHKJOPEG-MRVPVSSYSA-N 0 0 391.268 3.458 20 5 GGBDRN Cc1cccc(-c2nnc(COC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)o2)c1 ZINC000061356647 1408114077 /nfs/dbraw/zinc/11/40/77/1408114077.db2.gz JBDXVMLRHJAPNG-UHFFFAOYSA-N 0 0 382.376 3.376 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000061408329 1408123282 /nfs/dbraw/zinc/12/32/82/1408123282.db2.gz FNZLFFCXTXXHQZ-SNVBAGLBSA-N 0 0 397.840 3.111 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cnccc1-c1cccc(F)c1 ZINC000176389345 1428293546 /nfs/dbraw/zinc/29/35/46/1428293546.db2.gz PURSUZZFHFTDEI-UHFFFAOYSA-N 0 0 394.362 3.051 20 5 GGBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CSc2n[nH]c(-c3ccccc3F)n2)c1 ZINC000061731067 1408165783 /nfs/dbraw/zinc/16/57/83/1408165783.db2.gz PDBHSBYULTUMMY-GFCCVEGCSA-N 0 0 390.396 3.051 20 5 GGBDRN Cc1ccccc1-c1nnc(SC[C@H](O)COc2cccc([N+](=O)[O-])c2)o1 ZINC000061729813 1408166151 /nfs/dbraw/zinc/16/61/51/1408166151.db2.gz SWZUASLDIMLWMC-CQSZACIVSA-N 0 0 387.417 3.485 20 5 GGBDRN Cc1c(CS(=O)(=O)[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000061796299 1408180328 /nfs/dbraw/zinc/18/03/28/1408180328.db2.gz WCBKTNQCNIRSCE-TZDHZFECSA-N 0 0 396.509 3.147 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCc1ccc(C(F)(F)F)cc1 ZINC000061808936 1408181493 /nfs/dbraw/zinc/18/14/93/1408181493.db2.gz XXSONWYYFFXBJU-UHFFFAOYSA-N 0 0 395.337 3.219 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(OC)cc1 ZINC000061915465 1408189904 /nfs/dbraw/zinc/18/99/04/1408189904.db2.gz ULWRKWWHCAWVTL-OAHLLOKOSA-N 0 0 391.811 3.463 20 5 GGBDRN CCN(c1ccc(NC(=O)C(=O)NCc2ccccc2[N+](=O)[O-])cc1)C(C)C ZINC000062032705 1408204354 /nfs/dbraw/zinc/20/43/54/1408204354.db2.gz LRVNFUZUWWIXKV-UHFFFAOYSA-N 0 0 384.436 3.084 20 5 GGBDRN C[C@@H](CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)Cn1ccnc1 ZINC000176395731 1428298940 /nfs/dbraw/zinc/29/89/40/1428298940.db2.gz WJGUHTBDGSFYCL-INIZCTEOSA-N 0 0 385.468 3.094 20 5 GGBDRN COc1ccc([C@@H]2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)C2)cc1 ZINC000062146152 1408214259 /nfs/dbraw/zinc/21/42/59/1408214259.db2.gz JTSOCDSHUZBXTF-OAHLLOKOSA-N 0 0 376.434 3.090 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2ccccc2COC(C)C)cc1[N+](=O)[O-] ZINC000062207050 1408218912 /nfs/dbraw/zinc/21/89/12/1408218912.db2.gz AIPWFRIZLGYZQG-UHFFFAOYSA-N 0 0 385.420 3.083 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(-c2cn3c(n2)CCCC3)cc1 ZINC000062271511 1408227071 /nfs/dbraw/zinc/22/70/71/1408227071.db2.gz SMQKXSNUFXWKJI-UHFFFAOYSA-N 0 0 380.408 3.020 20 5 GGBDRN Cc1nnc([C@@H](C)OC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])o1 ZINC000062276548 1408227969 /nfs/dbraw/zinc/22/79/69/1408227969.db2.gz NQHRLYGLTGGZLI-MRVPVSSYSA-N 0 0 388.302 3.411 20 5 GGBDRN CC(C)COC(=O)Nc1cccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1 ZINC000062302215 1408236394 /nfs/dbraw/zinc/23/63/94/1408236394.db2.gz BPHKMSFNFYWHSP-UHFFFAOYSA-N 0 0 375.385 3.025 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@@H](c2ccccc2)O1 ZINC000062514486 1408272737 /nfs/dbraw/zinc/27/27/37/1408272737.db2.gz UHYCOBGLEWPWGJ-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@@H](c2ccccc2)O1 ZINC000062514513 1408272929 /nfs/dbraw/zinc/27/29/29/1408272929.db2.gz CMGNBIZPABLOPC-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)N(C)c2ccccc2)cc1C ZINC000062640556 1408286320 /nfs/dbraw/zinc/28/63/20/1408286320.db2.gz XPHPCZGYEIWTMP-HNNXBMFYSA-N 0 0 377.466 3.015 20 5 GGBDRN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000062866244 1408292743 /nfs/dbraw/zinc/29/27/43/1408292743.db2.gz JJXKKDIVYHIVLU-HNNXBMFYSA-N 0 0 382.416 3.473 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)[C@@H](C)Oc1ccc(CCC(C)=O)cc1 ZINC000062865216 1408292961 /nfs/dbraw/zinc/29/29/61/1408292961.db2.gz RKWSCMRXRWWZKE-CQSZACIVSA-N 0 0 387.388 3.498 20 5 GGBDRN COc1ccc(C(=O)N2CCCC2)cc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000062906538 1408296894 /nfs/dbraw/zinc/29/68/94/1408296894.db2.gz OUBAOMKXYRMMOQ-UHFFFAOYSA-N 0 0 383.404 3.021 20 5 GGBDRN COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000062907243 1408297483 /nfs/dbraw/zinc/29/74/83/1408297483.db2.gz KDISAPQDEMIIPC-UHFFFAOYSA-N 0 0 387.367 3.231 20 5 GGBDRN C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000063069780 1408300745 /nfs/dbraw/zinc/30/07/45/1408300745.db2.gz GCKVFTXJUPPFER-CYBMUJFWSA-N 0 0 397.435 3.439 20 5 GGBDRN COc1ccc(C2(CNC(=O)CCn3cc([N+](=O)[O-])cn3)CCCCC2)cc1 ZINC000063083384 1408302670 /nfs/dbraw/zinc/30/26/70/1408302670.db2.gz ZJGSRWNJBYPYOI-UHFFFAOYSA-N 0 0 386.452 3.208 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(C[C@@H]1CCOC1)C1CC1 ZINC000063088974 1408303016 /nfs/dbraw/zinc/30/30/16/1408303016.db2.gz GOSHZJGPDMZDKX-INIZCTEOSA-N 0 0 376.456 3.182 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)COc2c(C)cccc2C)c1 ZINC000063106155 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CS(=O)(=O)c1cc(C(=O)N2CCC(c3ccccc3)CC2)cc([N+](=O)[O-])c1 ZINC000067544519 1409154370 /nfs/dbraw/zinc/15/43/70/1409154370.db2.gz QNJQLMSBVUEHGA-UHFFFAOYSA-N 0 0 388.445 3.018 20 5 GGBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000067544047 1409154388 /nfs/dbraw/zinc/15/43/88/1409154388.db2.gz SHLXYNZNTFQYCC-JTQLQIEISA-N 0 0 398.387 3.110 20 5 GGBDRN C[C@H](c1cc(F)ccc1F)N(C)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000067545807 1409154806 /nfs/dbraw/zinc/15/48/06/1409154806.db2.gz QTXLCOKAXUWZDN-SNVBAGLBSA-N 0 0 398.387 3.110 20 5 GGBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1cc(C)cc(C)c1 ZINC000067547111 1409155585 /nfs/dbraw/zinc/15/55/85/1409155585.db2.gz ZYVPYPNZWPIUNJ-UHFFFAOYSA-N 0 0 376.434 3.282 20 5 GGBDRN CCN(CC)C(=O)c1ccc(CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])cc1 ZINC000067548240 1409156150 /nfs/dbraw/zinc/15/61/50/1409156150.db2.gz SBCLWWFJSJNWGZ-UHFFFAOYSA-N 0 0 385.420 3.015 20 5 GGBDRN Cc1ccc(NC(=O)NCc2cccc(CN3CCO[C@@H](C)C3)c2)cc1[N+](=O)[O-] ZINC000067556341 1409160222 /nfs/dbraw/zinc/16/02/22/1409160222.db2.gz XVUBIBMKXONEPP-INIZCTEOSA-N 0 0 398.463 3.446 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cccc(CN2CCO[C@@H](C)C2)c1 ZINC000067556373 1409160257 /nfs/dbraw/zinc/16/02/57/1409160257.db2.gz WYLIZFFJICQDQS-INIZCTEOSA-N 0 0 398.463 3.446 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(SC(F)F)c1 ZINC000067557897 1409161508 /nfs/dbraw/zinc/16/15/08/1409161508.db2.gz NPXLUDDVEQFGKX-UHFFFAOYSA-N 0 0 381.360 3.164 20 5 GGBDRN Cc1c(NC(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)cccc1[N+](=O)[O-] ZINC000067558143 1409161531 /nfs/dbraw/zinc/16/15/31/1409161531.db2.gz VGTVRVLXKPOZOC-OAHLLOKOSA-N 0 0 398.463 3.446 20 5 GGBDRN CCN(CC(C)(C)O)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000176615509 1428380629 /nfs/dbraw/zinc/38/06/29/1428380629.db2.gz DDZOTDJYRAWJEZ-UHFFFAOYSA-N 0 0 377.363 3.035 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000067592732 1409178571 /nfs/dbraw/zinc/17/85/71/1409178571.db2.gz SCHUHSKSIKWUGC-CQSZACIVSA-N 0 0 398.337 3.092 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2(c3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000067598361 1409181161 /nfs/dbraw/zinc/18/11/61/1409181161.db2.gz UIELHCMQVKNZKO-UHFFFAOYSA-N 0 0 387.823 3.343 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)CCc1ccc(OC(F)(F)F)cc1 ZINC000067627458 1409190487 /nfs/dbraw/zinc/19/04/87/1409190487.db2.gz NMJNBVBFLOBKOI-UHFFFAOYSA-N 0 0 387.314 3.174 20 5 GGBDRN C[C@H]1CSc2ccccc2N1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000176637556 1428387702 /nfs/dbraw/zinc/38/77/02/1428387702.db2.gz QSJODDMIJCUTSH-NSHDSACASA-N 0 0 385.401 3.030 20 5 GGBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1cccc(O)c1)CC1CC1 ZINC000176621447 1428382582 /nfs/dbraw/zinc/38/25/82/1428382582.db2.gz VTAIOGVWEPFOST-UHFFFAOYSA-N 0 0 393.399 3.194 20 5 GGBDRN CCN(CC)C(=O)Cc1ccc(NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000067664038 1409201278 /nfs/dbraw/zinc/20/12/78/1409201278.db2.gz VEEVUHSNSMZJIH-UHFFFAOYSA-N 0 0 384.436 3.327 20 5 GGBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176624885 1428383573 /nfs/dbraw/zinc/38/35/73/1428383573.db2.gz ATKZVWHPLUSHJA-ZBEGNZNMSA-N 0 0 375.812 3.433 20 5 GGBDRN COc1ccccc1CN(C[C@H]1CCCO1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067724443 1409215341 /nfs/dbraw/zinc/21/53/41/1409215341.db2.gz PXUMRCLRYNIGJA-LJQANCHMSA-N 0 0 399.447 3.494 20 5 GGBDRN COc1ccc(C2(NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)CCCC2)cc1 ZINC000067727581 1409215427 /nfs/dbraw/zinc/21/54/27/1409215427.db2.gz CKYPBXYOBWZZJL-UHFFFAOYSA-N 0 0 386.452 3.393 20 5 GGBDRN O=C(NCc1cccc(NC(=O)C2CCC2)c1)NCc1cccc([N+](=O)[O-])c1 ZINC000067725767 1409215572 /nfs/dbraw/zinc/21/55/72/1409215572.db2.gz CSWPFQXJNKDZLG-UHFFFAOYSA-N 0 0 382.420 3.333 20 5 GGBDRN COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067724435 1409215647 /nfs/dbraw/zinc/21/56/47/1409215647.db2.gz PXUMRCLRYNIGJA-IBGZPJMESA-N 0 0 399.447 3.494 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1nccn1CCCc1ccccc1 ZINC000176638846 1428388164 /nfs/dbraw/zinc/38/81/64/1428388164.db2.gz IZJPQVVNYTZXRB-UHFFFAOYSA-N 0 0 393.447 3.152 20 5 GGBDRN COc1ccc(NC(=O)CCSc2nncn2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000067750965 1409221458 /nfs/dbraw/zinc/22/14/58/1409221458.db2.gz MBNONJABDJTWRH-UHFFFAOYSA-N 0 0 379.442 3.071 20 5 GGBDRN CCOc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1Cl ZINC000067751699 1409221911 /nfs/dbraw/zinc/22/19/11/1409221911.db2.gz PIKKXIAIPHPQIL-UHFFFAOYSA-N 0 0 398.824 3.303 20 5 GGBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)[C@@H](C)c1ccc(F)cc1 ZINC000067751495 1409221955 /nfs/dbraw/zinc/22/19/55/1409221955.db2.gz VYDAIHSQXGTROD-LBPRGKRZSA-N 0 0 394.424 3.361 20 5 GGBDRN CC[C@@H](C)Oc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 ZINC000067753925 1409222294 /nfs/dbraw/zinc/22/22/94/1409222294.db2.gz GBKAGEJQHIWOSW-GFCCVEGCSA-N 0 0 392.433 3.428 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2OCC(F)(F)F)c1 ZINC000067753270 1409222359 /nfs/dbraw/zinc/22/23/59/1409222359.db2.gz WFKFZEJFTXKWIK-UHFFFAOYSA-N 0 0 384.310 3.475 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2OCCn2ccnc2)c1 ZINC000067754180 1409222371 /nfs/dbraw/zinc/22/23/71/1409222371.db2.gz ICNQMZRPDSBXSY-UHFFFAOYSA-N 0 0 382.376 3.131 20 5 GGBDRN Cc1ccc(CN(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)C(C)C)s1 ZINC000067753940 1409222427 /nfs/dbraw/zinc/22/24/27/1409222427.db2.gz SCKSDRWPNBHRPJ-UHFFFAOYSA-N 0 0 396.490 3.419 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c1 ZINC000067753876 1409222507 /nfs/dbraw/zinc/22/25/07/1409222507.db2.gz ILLQGPGHIAEHQL-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN O=C(Nc1ccc2nc(C3CC3)oc2c1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000176627581 1428384332 /nfs/dbraw/zinc/38/43/32/1428384332.db2.gz UVGUCLZYITXYOQ-UHFFFAOYSA-N 0 0 390.359 3.446 20 5 GGBDRN CC[C@H](C)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000067753784 1409222530 /nfs/dbraw/zinc/22/25/30/1409222530.db2.gz HAMBVTOPBNOHCZ-LBPRGKRZSA-N 0 0 392.433 3.428 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000067766327 1409225129 /nfs/dbraw/zinc/22/51/29/1409225129.db2.gz DNXDAAOWBNCUNL-UHFFFAOYSA-N 0 0 383.404 3.171 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000067766047 1409225188 /nfs/dbraw/zinc/22/51/88/1409225188.db2.gz SGQJGUXUEMKMKB-UHFFFAOYSA-N 0 0 375.384 3.102 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(OC2CCCC2)c1 ZINC000067766329 1409225309 /nfs/dbraw/zinc/22/53/09/1409225309.db2.gz GTZFHCLWHANBOA-UHFFFAOYSA-N 0 0 383.404 3.171 20 5 GGBDRN C[S@](=O)c1ccc(CNC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000176629348 1428384592 /nfs/dbraw/zinc/38/45/92/1428384592.db2.gz IVTUQGISQUQPEY-QHCPKHFHSA-N 0 0 397.250 3.025 20 5 GGBDRN CC[C@H](C)Oc1ccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000176629157 1428385045 /nfs/dbraw/zinc/38/50/45/1428385045.db2.gz KCJRFOZSKGDCAZ-GOEBONIOSA-N 0 0 384.436 3.494 20 5 GGBDRN COc1ccc(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000067791664 1409231900 /nfs/dbraw/zinc/23/19/00/1409231900.db2.gz KIFNVYXXNPTJOM-UHFFFAOYSA-N 0 0 380.347 3.406 20 5 GGBDRN COc1ccc(CC(=O)N(C)CCOc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000067791999 1409232011 /nfs/dbraw/zinc/23/20/11/1409232011.db2.gz XZQRYSUZFQSXJH-UHFFFAOYSA-N 0 0 378.812 3.337 20 5 GGBDRN COc1ccc(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000067794882 1409232937 /nfs/dbraw/zinc/23/29/37/1409232937.db2.gz QPOBQIFCPBKLLA-UHFFFAOYSA-N 0 0 397.431 3.023 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1[N+](=O)[O-] ZINC000067800012 1409233674 /nfs/dbraw/zinc/23/36/74/1409233674.db2.gz WPHCOLZLEYFRKV-ZDUSSCGKSA-N 0 0 397.431 3.372 20 5 GGBDRN COc1ccc(CC(=O)NCc2cccc(NC(=O)C3CCC3)c2)cc1[N+](=O)[O-] ZINC000067801829 1409234167 /nfs/dbraw/zinc/23/41/67/1409234167.db2.gz MXCMLWUFAXNNJR-UHFFFAOYSA-N 0 0 397.431 3.201 20 5 GGBDRN Cc1cccc(C(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)c1[N+](=O)[O-] ZINC000067809425 1409235432 /nfs/dbraw/zinc/23/54/32/1409235432.db2.gz PHFQQTUXEIEJHO-MRXNPFEDSA-N 0 0 383.448 3.054 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(Oc3cnccn3)c2)cc1[N+](=O)[O-] ZINC000067810477 1409236441 /nfs/dbraw/zinc/23/64/41/1409236441.db2.gz JOSKHKKJLMHWQD-UHFFFAOYSA-N 0 0 380.360 3.367 20 5 GGBDRN CCOc1ccc([C@H](C)NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000067811358 1409236662 /nfs/dbraw/zinc/23/66/62/1409236662.db2.gz RZDWNBBQVFSTGN-ZDUSSCGKSA-N 0 0 388.420 3.431 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1[N+](=O)[O-] ZINC000067816167 1409237113 /nfs/dbraw/zinc/23/71/13/1409237113.db2.gz BNEQTCULMWKJNW-KRWDZBQOSA-N 0 0 386.404 3.342 20 5 GGBDRN COc1ccc(CC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000067816904 1409237216 /nfs/dbraw/zinc/23/72/16/1409237216.db2.gz MQEFARMNCRNVAF-UHFFFAOYSA-N 0 0 397.431 3.411 20 5 GGBDRN Cc1nn(C)c(=O)c(-c2nc(CSc3ncccc3[N+](=O)[O-])cs2)c1C ZINC000176630987 1428385614 /nfs/dbraw/zinc/38/56/14/1428385614.db2.gz DBWWASZMLODJCK-UHFFFAOYSA-N 0 0 389.462 3.116 20 5 GGBDRN CC[C@@H](NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 ZINC000067817717 1409237338 /nfs/dbraw/zinc/23/73/38/1409237338.db2.gz WPANROUJJAGIBE-OAHLLOKOSA-N 0 0 386.404 3.185 20 5 GGBDRN COCCOc1ccc(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1Cl ZINC000067818404 1409237799 /nfs/dbraw/zinc/23/77/99/1409237799.db2.gz HSPUSUSIKBMPFH-UHFFFAOYSA-N 0 0 394.811 3.463 20 5 GGBDRN COc1ccc(CC(=O)Nc2ccnn2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000067822898 1409238231 /nfs/dbraw/zinc/23/82/31/1409238231.db2.gz MBFZCRKYDFZPRH-UHFFFAOYSA-N 0 0 380.404 3.224 20 5 GGBDRN COc1ccc(CC(=O)N[C@@H](COCC(C)C)c2ccco2)cc1[N+](=O)[O-] ZINC000067823392 1409238672 /nfs/dbraw/zinc/23/86/72/1409238672.db2.gz SWLGNWGFVDZTRB-HNNXBMFYSA-N 0 0 376.409 3.269 20 5 GGBDRN Cn1ccnc1[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000067824897 1409238872 /nfs/dbraw/zinc/23/88/72/1409238872.db2.gz UUIWKKSJVPIQLB-HXUWFJFHSA-N 0 0 389.415 3.189 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](c2ccccc2)O1 ZINC000067827253 1409239082 /nfs/dbraw/zinc/23/90/82/1409239082.db2.gz MUVMUXOMBZYQFY-QRWLVFNGSA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](c2ccccc2)O1 ZINC000067827254 1409239180 /nfs/dbraw/zinc/23/91/80/1409239180.db2.gz MUVMUXOMBZYQFY-YWZLYKJASA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@H](c2ccccc2)O1 ZINC000067827129 1409239274 /nfs/dbraw/zinc/23/92/74/1409239274.db2.gz CMGNBIZPABLOPC-FOIQADDNSA-N 0 0 392.415 3.383 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@H](c2ccccc2)O1 ZINC000067827146 1409239403 /nfs/dbraw/zinc/23/94/03/1409239403.db2.gz UHYCOBGLEWPWGJ-FOIQADDNSA-N 0 0 392.415 3.383 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](COc1ccccc1F)c1ccccc1 ZINC000067831585 1409240380 /nfs/dbraw/zinc/24/03/80/1409240380.db2.gz YBQNYUZGEIBDJP-QGZVFWFLSA-N 0 0 398.394 3.175 20 5 GGBDRN COCCOCCNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000067832703 1409240760 /nfs/dbraw/zinc/24/07/60/1409240760.db2.gz QBCGIAJKQJTCQT-UHFFFAOYSA-N 0 0 394.811 3.433 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Oc1cccc(NC(=O)c2cnn(C)c2)c1 ZINC000067839489 1409241390 /nfs/dbraw/zinc/24/13/90/1409241390.db2.gz MWGDUZSLHFBJLH-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN CCOc1ccccc1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000067845074 1409242711 /nfs/dbraw/zinc/24/27/11/1409242711.db2.gz HKZQQLNUVNTKMQ-UHFFFAOYSA-N 0 0 380.404 3.152 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCCc3c(C)ccc(OC)c32)cc([N+](=O)[O-])c1 ZINC000067844062 1409242787 /nfs/dbraw/zinc/24/27/87/1409242787.db2.gz PRONWNVWTLURMC-UHFFFAOYSA-N 0 0 384.388 3.291 20 5 GGBDRN CCOc1ccccc1CCNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000067844684 1409242958 /nfs/dbraw/zinc/24/29/58/1409242958.db2.gz AQRUOQFNDWFCHM-UHFFFAOYSA-N 0 0 394.431 3.367 20 5 GGBDRN CSCCc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000067854954 1409244671 /nfs/dbraw/zinc/24/46/71/1409244671.db2.gz CDKFNJMJPLZPHW-UHFFFAOYSA-N 0 0 394.474 3.156 20 5 GGBDRN COc1ccccc1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000176634637 1428386525 /nfs/dbraw/zinc/38/65/25/1428386525.db2.gz SURWBFCEANMJOY-UHFFFAOYSA-N 0 0 384.841 3.386 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000067859502 1409245561 /nfs/dbraw/zinc/24/55/61/1409245561.db2.gz CIXSDHMQVDSVMP-CYBMUJFWSA-N 0 0 398.337 3.092 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000067860224 1409246187 /nfs/dbraw/zinc/24/61/87/1409246187.db2.gz VLFZYMOFDNJSOG-KZULUSFZSA-N 0 0 385.376 3.414 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCCCCCc1ccccc1 ZINC000067876043 1409248092 /nfs/dbraw/zinc/24/80/92/1409248092.db2.gz MBFIHDJDWJBHDR-UHFFFAOYSA-N 0 0 383.404 3.032 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000067879060 1409248119 /nfs/dbraw/zinc/24/81/19/1409248119.db2.gz GWWRSMURXBSBJT-YOEHRIQHSA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@H](OC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1cc(F)ccc1F ZINC000067893723 1409250745 /nfs/dbraw/zinc/25/07/45/1409250745.db2.gz QVIIGUXTNZBDCN-VIFPVBQESA-N 0 0 385.344 3.195 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CCCc3c(C)ccc(OC)c32)c([N+](=O)[O-])c1 ZINC000067899473 1409252054 /nfs/dbraw/zinc/25/20/54/1409252054.db2.gz NXLFBUNVCQAYCQ-UHFFFAOYSA-N 0 0 392.433 3.062 20 5 GGBDRN COc1ccc(CC(=O)NCc2ccc(N3CCC(C)CC3)nc2)cc1[N+](=O)[O-] ZINC000067907449 1409253700 /nfs/dbraw/zinc/25/37/00/1409253700.db2.gz LESLTTJPWXARRQ-UHFFFAOYSA-N 0 0 398.463 3.094 20 5 GGBDRN COc1ccc(CC(=O)N2CCC(N(C)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000067909986 1409253724 /nfs/dbraw/zinc/25/37/24/1409253724.db2.gz SAZYTTSVQPZERK-UHFFFAOYSA-N 0 0 383.448 3.273 20 5 GGBDRN COc1ccc(CC(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000067924498 1409256535 /nfs/dbraw/zinc/25/65/35/1409256535.db2.gz XRSLFWWTQUHGGZ-MRXNPFEDSA-N 0 0 398.415 3.281 20 5 GGBDRN Cc1cc(C(=O)NC[C@H](O)COc2cccc(Cl)c2Cl)ccc1[N+](=O)[O-] ZINC000067936156 1409259982 /nfs/dbraw/zinc/25/99/82/1409259982.db2.gz MDSYECUULHSQMC-LBPRGKRZSA-N 0 0 399.230 3.380 20 5 GGBDRN O=C(c1ccc(NCc2ccc(Cl)cc2)c([N+](=O)[O-])c1)N1CCOCC1 ZINC000067949423 1409262707 /nfs/dbraw/zinc/26/27/07/1409262707.db2.gz MKIRRJKQTKAVGM-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN O=C(NCc1cccnc1OCC(F)(F)F)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000067971312 1409266818 /nfs/dbraw/zinc/26/68/18/1409266818.db2.gz FFWDWKQBNVALAM-UHFFFAOYSA-N 0 0 391.252 3.139 20 5 GGBDRN C[C@@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000067990793 1409271375 /nfs/dbraw/zinc/27/13/75/1409271375.db2.gz PAAOJFUNFYOFMS-SNVBAGLBSA-N 0 0 391.330 3.321 20 5 GGBDRN C[C@@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000067990776 1409271534 /nfs/dbraw/zinc/27/15/34/1409271534.db2.gz RTOCAUUCEQUWKL-LLVKDONJSA-N 0 0 389.358 3.491 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000067990537 1409271558 /nfs/dbraw/zinc/27/15/58/1409271558.db2.gz CZTRITWEICFJRT-VIFPVBQESA-N 0 0 379.319 3.099 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)c1 ZINC000067994952 1409272358 /nfs/dbraw/zinc/27/23/58/1409272358.db2.gz OHIMNOQTWKEREV-MRXNPFEDSA-N 0 0 397.391 3.176 20 5 GGBDRN C[C@@H](c1ccccn1)N(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000067999636 1409273236 /nfs/dbraw/zinc/27/32/36/1409273236.db2.gz XWOHOGOYYSICBH-LBPRGKRZSA-N 0 0 398.448 3.103 20 5 GGBDRN Cn1c2ccccc2nc1[C@@H]1CCCN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000068004787 1409274672 /nfs/dbraw/zinc/27/46/72/1409274672.db2.gz FUXNMQXFKXBEOK-SFHVURJKSA-N 0 0 380.404 3.224 20 5 GGBDRN Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)c3ccc(N)c([N+](=O)[O-])c3)cc2)n1 ZINC000176658938 1428394350 /nfs/dbraw/zinc/39/43/50/1428394350.db2.gz RASNRMRJEPZCBZ-CQSZACIVSA-N 0 0 379.420 3.471 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1nc(C2CC2)no1 ZINC000068051406 1409287612 /nfs/dbraw/zinc/28/76/12/1409287612.db2.gz NENRMWUNLHAOLS-MRXNPFEDSA-N 0 0 396.407 3.168 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)n1 ZINC000068066257 1409289603 /nfs/dbraw/zinc/28/96/03/1409289603.db2.gz KWTZPPYIITZFLN-UHFFFAOYSA-N 0 0 384.367 3.319 20 5 GGBDRN CCc1noc(-c2ccc(CCNC(=O)c3cc(OC)ccc3[N+](=O)[O-])cc2)n1 ZINC000068066183 1409289696 /nfs/dbraw/zinc/28/96/96/1409289696.db2.gz YFDWGBWHNZBVON-UHFFFAOYSA-N 0 0 396.403 3.188 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSCCCNc1ncccn1 ZINC000068068122 1409290187 /nfs/dbraw/zinc/29/01/87/1409290187.db2.gz WBLCGKPTRRXCME-UHFFFAOYSA-N 0 0 375.454 3.257 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc3c[nH]nc3c2)ccc1[N+](=O)[O-] ZINC000068098414 1409301380 /nfs/dbraw/zinc/30/13/80/1409301380.db2.gz BVXAEERDOCJOQS-SFHVURJKSA-N 0 0 393.403 3.023 20 5 GGBDRN COc1cccc(CO[C@H](C)C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000068104279 1409302510 /nfs/dbraw/zinc/30/25/10/1409302510.db2.gz RGWHUYIRNNGKSO-CQSZACIVSA-N 0 0 396.403 3.333 20 5 GGBDRN COc1cccc(CCC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1OC ZINC000068103319 1409302533 /nfs/dbraw/zinc/30/25/33/1409302533.db2.gz BDBBANOMHPWQCU-UHFFFAOYSA-N 0 0 396.403 3.369 20 5 GGBDRN O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000068104745 1409303301 /nfs/dbraw/zinc/30/33/01/1409303301.db2.gz WTGZKLAPJLUPCZ-INIZCTEOSA-N 0 0 378.344 3.021 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000068110180 1409305381 /nfs/dbraw/zinc/30/53/81/1409305381.db2.gz VRCHTZXFABVXQI-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1cc(NC(=O)C[C@@H]2OC(=O)c3ccccc32)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068120795 1409308328 /nfs/dbraw/zinc/30/83/28/1409308328.db2.gz IVDRBBBXEPNQNA-KRWDZBQOSA-N 0 0 392.371 3.329 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000068140389 1409312567 /nfs/dbraw/zinc/31/25/67/1409312567.db2.gz HUTMWAUOBZSPOI-UHFFFAOYSA-N 0 0 386.795 3.200 20 5 GGBDRN CC(C)c1noc(CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)n1 ZINC000068148496 1409315405 /nfs/dbraw/zinc/31/54/05/1409315405.db2.gz GWKFYGADGIJIEK-UHFFFAOYSA-N 0 0 387.440 3.064 20 5 GGBDRN Cc1nn(C)cc1[C@@H](C)NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000068158228 1409317799 /nfs/dbraw/zinc/31/77/99/1409317799.db2.gz KSIGPZFOLSDESH-CQSZACIVSA-N 0 0 385.468 3.364 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068159877 1409318628 /nfs/dbraw/zinc/31/86/28/1409318628.db2.gz ZMMXYUXOYIMLGY-UHFFFAOYSA-N 0 0 398.444 3.402 20 5 GGBDRN Cn1cc(C(=O)N[C@H]2CCOc3ccc(F)cc32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068166344 1409320551 /nfs/dbraw/zinc/32/05/51/1409320551.db2.gz VMLMQGBQRGMVEC-KRWDZBQOSA-N 0 0 396.378 3.388 20 5 GGBDRN O=C(N[C@@H]1CCOc2ccc(F)cc21)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000068166459 1409320790 /nfs/dbraw/zinc/32/07/90/1409320790.db2.gz GBNRRCAGFUUZRO-MRXNPFEDSA-N 0 0 382.351 3.173 20 5 GGBDRN CCOc1cc(C(=O)N[C@H]2CCOc3ccc(F)cc32)c([N+](=O)[O-])cc1OC 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ICNAWIRSKIJYQI-UHFFFAOYSA-N 0 0 393.399 3.378 20 5 GGBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000068186631 1409326038 /nfs/dbraw/zinc/32/60/38/1409326038.db2.gz KMGYOUKHPRLFEG-UHFFFAOYSA-N 0 0 384.310 3.345 20 5 GGBDRN CCOc1c(Cl)cc(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000068186733 1409326095 /nfs/dbraw/zinc/32/60/95/1409326095.db2.gz IKZYODQYVBZHMA-UHFFFAOYSA-N 0 0 394.811 3.464 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000068195346 1409327379 /nfs/dbraw/zinc/32/73/79/1409327379.db2.gz QIZFGJKHPWKKIB-QGZVFWFLSA-N 0 0 393.399 3.476 20 5 GGBDRN CCNc1ccc(C(=O)Nc2cccc(CN3CCOCC3)c2)cc1[N+](=O)[O-] ZINC000068197623 1409328342 /nfs/dbraw/zinc/32/83/42/1409328342.db2.gz BWSMXLSWZAYOTQ-UHFFFAOYSA-N 0 0 384.436 3.111 20 5 GGBDRN CC(=O)N1CCC[C@H](C(=O)Oc2ccc(Cc3ccccc3)cc2[N+](=O)[O-])C1 ZINC000176661654 1428395569 /nfs/dbraw/zinc/39/55/69/1428395569.db2.gz LVLIWBDIKFWHJA-SFHVURJKSA-N 0 0 382.416 3.350 20 5 GGBDRN O=C(NCC1(Sc2ccccc2)CC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000068215049 1409331531 /nfs/dbraw/zinc/33/15/31/1409331531.db2.gz SPQVMRTUKCCDBD-UHFFFAOYSA-N 0 0 395.444 3.230 20 5 GGBDRN COc1cc(OCC(=O)NCC2(Sc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000068214436 1409331544 /nfs/dbraw/zinc/33/15/44/1409331544.db2.gz XTYLURCCUGPKAJ-UHFFFAOYSA-N 0 0 388.445 3.423 20 5 GGBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)N[C@@H](c1ccccc1)C(C)C ZINC000068224829 1409334219 /nfs/dbraw/zinc/33/42/19/1409334219.db2.gz KFWHYGAIGXLZEB-CQSZACIVSA-N 0 0 395.257 3.376 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NC1CCN(c2ccc(C(C)(C)C)cc2)CC1 ZINC000068226581 1409335036 /nfs/dbraw/zinc/33/50/36/1409335036.db2.gz DRWAVMZXCPVWDT-UHFFFAOYSA-N 0 0 399.495 3.182 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cccc(CN2CCOCC2)c1 ZINC000068230141 1409335674 /nfs/dbraw/zinc/33/56/74/1409335674.db2.gz QIZASPBCVSZEDP-UHFFFAOYSA-N 0 0 398.463 3.258 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCN1Cc2ccccc2C1 ZINC000068245075 1409339028 /nfs/dbraw/zinc/33/90/28/1409339028.db2.gz OQTPHXVTWYFNBO-ZDUSSCGKSA-N 0 0 389.839 3.148 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1Cc2ccccc2O1 ZINC000068265637 1409345733 /nfs/dbraw/zinc/34/57/33/1409345733.db2.gz ZRYGVEKBTGENMT-BXUZGUMPSA-N 0 0 376.796 3.135 20 5 GGBDRN CCNC(=O)c1cccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000068265610 1409345873 /nfs/dbraw/zinc/34/58/73/1409345873.db2.gz YJUVYYZOYYWAPJ-LLVKDONJSA-N 0 0 391.811 3.404 20 5 GGBDRN COc1ccc(OC)c(CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000068265824 1409345906 /nfs/dbraw/zinc/34/59/06/1409345906.db2.gz BCQGBDBSTDWNSK-LLVKDONJSA-N 0 0 394.811 3.349 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CCCCC[C@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC000068279123 1409350666 /nfs/dbraw/zinc/35/06/66/1409350666.db2.gz HFHOYMHMTUQHOP-KRWDZBQOSA-N 0 0 383.404 3.325 20 5 GGBDRN CC(C)N(C)c1ccc(NC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])cc1F ZINC000068290768 1409354682 /nfs/dbraw/zinc/35/46/82/1409354682.db2.gz JXBRVAXRJVBCNP-UHFFFAOYSA-N 0 0 389.383 3.409 20 5 GGBDRN CCOc1cc(C(=O)NCCN2c3ccccc3C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000068293954 1409355196 /nfs/dbraw/zinc/35/51/96/1409355196.db2.gz PKXHBKAVPUETPN-CQSZACIVSA-N 0 0 399.447 3.183 20 5 GGBDRN O=Cc1ccc(OCC(=O)N(C2CC2)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000068309502 1409360132 /nfs/dbraw/zinc/36/01/32/1409360132.db2.gz AVRZXXGFQKUSEO-GOSISDBHSA-N 0 0 380.400 3.465 20 5 GGBDRN O=C(NCc1cccs1)c1ccc(I)c([N+](=O)[O-])c1 ZINC000068316496 1409364980 /nfs/dbraw/zinc/36/49/80/1409364980.db2.gz AEYHZCPSHFFERU-UHFFFAOYSA-N 0 0 388.186 3.191 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC000068343018 1409373858 /nfs/dbraw/zinc/37/38/58/1409373858.db2.gz ZKTUJYGXXLLLAC-GOSISDBHSA-N 0 0 399.472 3.294 20 5 GGBDRN COCCN(CCCc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000068347906 1409375101 /nfs/dbraw/zinc/37/51/01/1409375101.db2.gz XRTKTDRIIZVXDU-UHFFFAOYSA-N 0 0 396.440 3.004 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCN(c2nccs2)CC1 ZINC000068362405 1409379371 /nfs/dbraw/zinc/37/93/71/1409379371.db2.gz KNROZZGXYTUTGJ-ZDUSSCGKSA-N 0 0 392.506 3.271 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(-n2cccn2)nc1 ZINC000068377989 1409383383 /nfs/dbraw/zinc/38/33/83/1409383383.db2.gz JNJCXMPNNBVHFH-LLVKDONJSA-N 0 0 387.783 3.235 20 5 GGBDRN COC(=O)C1(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CCCCC1 ZINC000068377792 1409383406 /nfs/dbraw/zinc/38/34/06/1409383406.db2.gz FDBNZGHHKAMHTO-NSHDSACASA-N 0 0 384.816 3.008 20 5 GGBDRN COc1cccc(CN(C[C@H]2CCCO2)C(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000068380686 1409384457 /nfs/dbraw/zinc/38/44/57/1409384457.db2.gz NJFOEFFXCWMWRR-OAHLLOKOSA-N 0 0 376.434 3.486 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3c(c2)CCCN3C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000068381468 1409385214 /nfs/dbraw/zinc/38/52/14/1409385214.db2.gz GSKPJQPGCVBJHV-UHFFFAOYSA-N 0 0 392.419 3.119 20 5 GGBDRN C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)OCCn1cnc([N+](=O)[O-])n1 ZINC000176672580 1428399935 /nfs/dbraw/zinc/39/99/35/1428399935.db2.gz OOLKPUUMMMEFRE-QMMMGPOBSA-N 0 0 391.236 3.217 20 5 GGBDRN O=Cc1ccc(OCC(=O)N[C@H](c2ccccc2)c2cccnc2)c([N+](=O)[O-])c1 ZINC000068389353 1409387778 /nfs/dbraw/zinc/38/77/78/1409387778.db2.gz ZMJBMXOFBKVUDI-OAQYLSRUSA-N 0 0 391.383 3.087 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCCCOc1cccc2cccnc21 ZINC000068390932 1409388577 /nfs/dbraw/zinc/38/85/77/1409388577.db2.gz PMBJZQBMNKWFQE-UHFFFAOYSA-N 0 0 399.378 3.246 20 5 GGBDRN Cc1nc(CN2CCC(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)CC2)cs1 ZINC000068391121 1409389078 /nfs/dbraw/zinc/38/90/78/1409389078.db2.gz HXPCRRZKYXNGES-UHFFFAOYSA-N 0 0 386.477 3.161 20 5 GGBDRN O=C(OCCn1cnc([N+](=O)[O-])n1)c1ccc(Oc2ccc(F)c(F)c2)cc1 ZINC000176675221 1428400939 /nfs/dbraw/zinc/40/09/39/1428400939.db2.gz XFLGGNKUUOQAKJ-UHFFFAOYSA-N 0 0 390.302 3.114 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCCCNc1ccccn1 ZINC000068422324 1409397508 /nfs/dbraw/zinc/39/75/08/1409397508.db2.gz XDKKTDNFNJHAFR-ZDUSSCGKSA-N 0 0 392.843 3.419 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC(c2n[nH]c(=S)n2C2CC2)CC1 ZINC000068424384 1409398644 /nfs/dbraw/zinc/39/86/44/1409398644.db2.gz DXVQMZPSUZWFPH-UHFFFAOYSA-N 0 0 391.428 3.343 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000068428691 1409399367 /nfs/dbraw/zinc/39/93/67/1409399367.db2.gz FDKSJJCGYSWZSM-JTQLQIEISA-N 0 0 377.784 3.474 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000068430993 1409400754 /nfs/dbraw/zinc/40/07/54/1409400754.db2.gz PPCOADBEVJUAPE-ZDUSSCGKSA-N 0 0 386.408 3.009 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCc3ccccc3CO)cc2[N+](=O)[O-])C1 ZINC000068434346 1409401459 /nfs/dbraw/zinc/40/14/59/1409401459.db2.gz IORVEIMBYVSHET-HOTGVXAUSA-N 0 0 397.475 3.499 20 5 GGBDRN CC(C)n1c(C2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)n[nH]c1=S ZINC000068435322 1409402175 /nfs/dbraw/zinc/40/21/75/1409402175.db2.gz RLHIDUUHGQZNNB-UHFFFAOYSA-N 0 0 375.454 3.450 20 5 GGBDRN CCn1c(C2CCN(C(=O)C=Cc3ccccc3[N+](=O)[O-])CC2)n[nH]c1=S ZINC000068452778 1409407551 /nfs/dbraw/zinc/40/75/51/1409407551.db2.gz MCXMEHOHXBPKJA-BQYQJAHWSA-N 0 0 387.465 3.288 20 5 GGBDRN CC(C)N(C)c1cccc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000068479588 1409412919 /nfs/dbraw/zinc/41/29/19/1409412919.db2.gz YXNKPIAITFFTSY-AWEZNQCLSA-N 0 0 384.436 3.196 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(COCC(F)(F)F)cc2)c(N)c([N+](=O)[O-])c1 ZINC000068511584 1409422024 /nfs/dbraw/zinc/42/20/24/1409422024.db2.gz YTMXDAQHYHFHLH-UHFFFAOYSA-N 0 0 397.353 3.494 20 5 GGBDRN Cc1cc(C(=O)CCC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000068520046 1409425923 /nfs/dbraw/zinc/42/59/23/1409425923.db2.gz MZYVIVJIKOHQPJ-UHFFFAOYSA-N 0 0 376.434 3.431 20 5 GGBDRN Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000068520348 1409425936 /nfs/dbraw/zinc/42/59/36/1409425936.db2.gz FTJDGHLKDWNUQF-UHFFFAOYSA-N 0 0 398.394 3.345 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21 ZINC000068534477 1409429989 /nfs/dbraw/zinc/42/99/89/1409429989.db2.gz RZXWKWPGLUSRFV-IBGZPJMESA-N 0 0 395.415 3.015 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21 ZINC000068534476 1409430086 /nfs/dbraw/zinc/43/00/86/1409430086.db2.gz RZXWKWPGLUSRFV-LJQANCHMSA-N 0 0 395.415 3.015 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(OCc3nccn3C)cc2)c(N)c([N+](=O)[O-])c1 ZINC000068549601 1409435484 /nfs/dbraw/zinc/43/54/84/1409435484.db2.gz RUMDXNPYWMYDBY-UHFFFAOYSA-N 0 0 381.392 3.050 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(NC(=O)c3ccco3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000068552649 1409436599 /nfs/dbraw/zinc/43/65/99/1409436599.db2.gz NSTXUVDMIAJEOO-UHFFFAOYSA-N 0 0 394.387 3.261 20 5 GGBDRN CCc1cc(N2CCC(N(C)C(C)=O)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068575756 1409442639 /nfs/dbraw/zinc/44/26/39/1409442639.db2.gz MNQGRNXWAJZOOG-UHFFFAOYSA-N 0 0 383.452 3.061 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC1(Sc2ccccc2)CC1 ZINC000068608285 1409449714 /nfs/dbraw/zinc/44/97/14/1409449714.db2.gz ODFZVUBYVHNFTF-CQSZACIVSA-N 0 0 399.472 3.154 20 5 GGBDRN Cc1c(NC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000068650672 1409455300 /nfs/dbraw/zinc/45/53/00/1409455300.db2.gz LVVGJHIWMAWOGR-GFCCVEGCSA-N 0 0 375.303 3.005 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F ZINC000068650573 1409455367 /nfs/dbraw/zinc/45/53/67/1409455367.db2.gz VSQWLWUHVHBOLN-LBPRGKRZSA-N 0 0 375.303 3.005 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1ccc(N2CCCC2=O)cc1 ZINC000068657787 1409458955 /nfs/dbraw/zinc/45/89/55/1409458955.db2.gz XOBOJEQYDNJROM-AWEZNQCLSA-N 0 0 396.447 3.279 20 5 GGBDRN C[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000068657359 1409458960 /nfs/dbraw/zinc/45/89/60/1409458960.db2.gz WXDJULQABRFSGI-HNNXBMFYSA-N 0 0 396.447 3.401 20 5 GGBDRN COc1ccc(C(=O)N[C@H](C)c2cccc(N3CCOC3=O)c2)cc1[N+](=O)[O-] ZINC000068658734 1409459463 /nfs/dbraw/zinc/45/94/63/1409459463.db2.gz ZERIDESFAYRGDQ-GFCCVEGCSA-N 0 0 385.376 3.051 20 5 GGBDRN C[C@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCOC2=O)c1 ZINC000068658875 1409459662 /nfs/dbraw/zinc/45/96/62/1409459662.db2.gz RMJFTRAKUJBGLY-RNVIBTMRSA-N 0 0 381.388 3.442 20 5 GGBDRN C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000068660253 1409460062 /nfs/dbraw/zinc/46/00/62/1409460062.db2.gz GZKCZTRXUAGMBD-CQSZACIVSA-N 0 0 398.419 3.231 20 5 GGBDRN CNC(=O)c1ccc(N[C@@H](C)c2cccc(N3CCCC3=O)c2)c([N+](=O)[O-])c1 ZINC000068665461 1409463339 /nfs/dbraw/zinc/46/33/39/1409463339.db2.gz DAKQOMIIJVQIAC-ZDUSSCGKSA-N 0 0 382.420 3.254 20 5 GGBDRN NC(=O)c1ccc(NCCc2nc(-c3ccc(Cl)cc3)no2)c([N+](=O)[O-])c1 ZINC000068704510 1409471930 /nfs/dbraw/zinc/47/19/30/1409471930.db2.gz HPTWAOZUMRNKHT-UHFFFAOYSA-N 0 0 387.783 3.052 20 5 GGBDRN CCCCN(CCOC)c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000068704174 1409472035 /nfs/dbraw/zinc/47/20/35/1409472035.db2.gz JAQURPLYOKZZSJ-UHFFFAOYSA-N 0 0 380.832 3.047 20 5 GGBDRN CCC[C@H](Cc1ccccc1)NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000068707652 1409472375 /nfs/dbraw/zinc/47/23/75/1409472375.db2.gz OULVSHXXPOHWHF-OAHLLOKOSA-N 0 0 383.404 3.030 20 5 GGBDRN CCCC[C@@H]1CCC[C@@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000068712655 1409474262 /nfs/dbraw/zinc/47/42/62/1409474262.db2.gz LBJCVIZTCDHXBB-OCCSQVGLSA-N 0 0 379.482 3.261 20 5 GGBDRN CCCC[C@H]1CCC[C@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000068712663 1409474345 /nfs/dbraw/zinc/47/43/45/1409474345.db2.gz LBJCVIZTCDHXBB-GXTWGEPZSA-N 0 0 379.482 3.261 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000068714060 1409474851 /nfs/dbraw/zinc/47/48/51/1409474851.db2.gz SQVSVGJDMHFJTI-CYBMUJFWSA-N 0 0 384.392 3.112 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](c2ccccc2)c2ccncc2)ccc1[N+](=O)[O-] ZINC000068760643 1409486942 /nfs/dbraw/zinc/48/69/42/1409486942.db2.gz NHGGKEYKVONHFB-NRFANRHFSA-N 0 0 393.399 3.283 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](c2ccccc2)c2ccccn2)ccc1[N+](=O)[O-] ZINC000068759218 1409487021 /nfs/dbraw/zinc/48/70/21/1409487021.db2.gz FGYCJEFXEJDCDW-NRFANRHFSA-N 0 0 393.399 3.283 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)C(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000068763616 1409487554 /nfs/dbraw/zinc/48/75/54/1409487554.db2.gz FGSMMRWKUUZUEE-UHFFFAOYSA-N 0 0 394.811 3.303 20 5 GGBDRN COc1cc(OCC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000068767399 1409487912 /nfs/dbraw/zinc/48/79/12/1409487912.db2.gz KFEYGIIIPRTABD-LLVKDONJSA-N 0 0 380.347 3.480 20 5 GGBDRN COc1cc(OCC(=O)N[C@H]2CCSc3c(F)cccc32)ccc1[N+](=O)[O-] ZINC000068764536 1409487984 /nfs/dbraw/zinc/48/79/84/1409487984.db2.gz SDYRXMNCTUOFDU-AWEZNQCLSA-N 0 0 392.408 3.475 20 5 GGBDRN COc1cc(OCC(=O)NCc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000068764421 1409488055 /nfs/dbraw/zinc/48/80/55/1409488055.db2.gz NCEKTHSXUXBDKN-UHFFFAOYSA-N 0 0 384.310 3.317 20 5 GGBDRN Cc1cccc2nc(CNc3ccc(C(=O)c4nccn4C)cc3[N+](=O)[O-])cn21 ZINC000068772464 1409488610 /nfs/dbraw/zinc/48/86/10/1409488610.db2.gz VZXBIRQICQOQFD-UHFFFAOYSA-N 0 0 390.403 3.128 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](C)c2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-] ZINC000068770816 1409488631 /nfs/dbraw/zinc/48/86/31/1409488631.db2.gz IHVZEQDBORRROZ-NSHDSACASA-N 0 0 396.346 3.461 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccccc1NC(=O)OC(C)(C)C ZINC000068773281 1409488952 /nfs/dbraw/zinc/48/89/52/1409488952.db2.gz VRXZIANHQSFGRP-UHFFFAOYSA-N 0 0 375.385 3.085 20 5 GGBDRN C[C@@H]1CCCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)CC1 ZINC000068779506 1409491126 /nfs/dbraw/zinc/49/11/26/1409491126.db2.gz GLPVZHBRFBWVCV-GFCCVEGCSA-N 0 0 375.454 3.137 20 5 GGBDRN CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000068789992 1409492918 /nfs/dbraw/zinc/49/29/18/1409492918.db2.gz FJTJTYKBKJQSSL-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN C[C@H](OC[C@@H]1CCCO1)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000068790244 1409493056 /nfs/dbraw/zinc/49/30/56/1409493056.db2.gz YJVDOAVUBGARAK-JSGCOSHPSA-N 0 0 390.358 3.070 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](C)c2cccc(OC(F)F)c2)ccc1[N+](=O)[O-] ZINC000068790991 1409493591 /nfs/dbraw/zinc/49/35/91/1409493591.db2.gz QYKCUAUVVJIBAX-NSHDSACASA-N 0 0 396.346 3.461 20 5 GGBDRN CN(C)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1 ZINC000068802630 1409495616 /nfs/dbraw/zinc/49/56/16/1409495616.db2.gz ITFAZHUPHJILEH-UHFFFAOYSA-N 0 0 384.314 3.249 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000068811451 1409497163 /nfs/dbraw/zinc/49/71/63/1409497163.db2.gz KBTUINXAXBMWIR-MRXNPFEDSA-N 0 0 393.403 3.161 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Oc1ccc(NC(=O)c2cnn(C)c2)cc1 ZINC000068817717 1409498296 /nfs/dbraw/zinc/49/82/96/1409498296.db2.gz PKFVTMAFQNMPGI-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN Cc1cc(C(=O)Oc2ccc(NC(=O)c3cnn(C)c3)cc2)ccc1[N+](=O)[O-] ZINC000068819251 1409499073 /nfs/dbraw/zinc/49/90/73/1409499073.db2.gz PSNZDUXJABTRPW-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@H](C)CC1 ZINC000068822429 1409500125 /nfs/dbraw/zinc/50/01/25/1409500125.db2.gz VSKSASJTBMUESR-YOEHRIQHSA-N 0 0 393.509 3.095 20 5 GGBDRN CC(C)CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000068822394 1409500231 /nfs/dbraw/zinc/50/02/31/1409500231.db2.gz ASIBNFWLONIXQH-MLGOLLRUSA-N 0 0 397.472 3.190 20 5 GGBDRN Cc1sc(C(=O)N2CSC[C@@H]2C(=O)N[C@@H](C)CCC(C)C)cc1[N+](=O)[O-] ZINC000068824490 1409501312 /nfs/dbraw/zinc/50/13/12/1409501312.db2.gz AOPAMJFUUDPAJM-SMDDNHRTSA-N 0 0 399.538 3.421 20 5 GGBDRN Cc1sc(C(=O)N2CSC[C@H]2C(=O)N[C@H](C)CCC(C)C)cc1[N+](=O)[O-] ZINC000068824508 1409501531 /nfs/dbraw/zinc/50/15/31/1409501531.db2.gz AOPAMJFUUDPAJM-RISCZKNCSA-N 0 0 399.538 3.421 20 5 GGBDRN COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1 ZINC000068825817 1409502063 /nfs/dbraw/zinc/50/20/63/1409502063.db2.gz QPMGCEBTEAEIPX-SFHVURJKSA-N 0 0 398.394 3.039 20 5 GGBDRN C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000176689202 1428409013 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O=C(c1c(F)cccc1F)N1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000068906012 1409521429 /nfs/dbraw/zinc/52/14/29/1409521429.db2.gz WHSMXOFOLHCUJP-UHFFFAOYSA-N 0 0 398.369 3.384 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)Oc2ccccc2OCC(F)(F)F)cc1 ZINC000068911451 1409522572 /nfs/dbraw/zinc/52/25/72/1409522572.db2.gz YNEXTSAGFTTWNR-UHFFFAOYSA-N 0 0 391.323 3.445 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000068911386 1409522577 /nfs/dbraw/zinc/52/25/77/1409522577.db2.gz BWTMYFLOUQXUKM-CQSZACIVSA-N 0 0 399.451 3.001 20 5 GGBDRN COc1ccc(N(C(C)C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000068920040 1409524736 /nfs/dbraw/zinc/52/47/36/1409524736.db2.gz AZWUXELGLRXQOD-UHFFFAOYSA-N 0 0 398.412 3.355 20 5 GGBDRN CN(Cc1ccccc1N1CCCC1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000068930973 1409527988 /nfs/dbraw/zinc/52/79/88/1409527988.db2.gz PAWACVKZEFCPKC-UHFFFAOYSA-N 0 0 397.431 3.238 20 5 GGBDRN CCOc1ccc(NC(=O)CNc2cc(C)ccc2NC(C)=O)c([N+](=O)[O-])c1 ZINC000068962487 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375.450 3.428 20 5 GGBDRN O=C(CN1CCC(OCc2ccccc2F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000091862487 1410087692 /nfs/dbraw/zinc/08/76/92/1410087692.db2.gz LRGQCDWDZTVJDY-UHFFFAOYSA-N 0 0 387.411 3.354 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC(OCc2ccc(F)cc2)CC1 ZINC000092074416 1410105358 /nfs/dbraw/zinc/10/53/58/1410105358.db2.gz XAKRQHITLLWPBG-UHFFFAOYSA-N 0 0 388.395 3.321 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)c3cc(F)cc(C)c3[N+](=O)[O-])cn2)n1 ZINC000176775320 1428456999 /nfs/dbraw/zinc/45/69/99/1428456999.db2.gz QAYJFCBNJURUCX-UHFFFAOYSA-N 0 0 383.383 3.170 20 5 GGBDRN CCOc1ccc(C2=CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000092266348 1410131279 /nfs/dbraw/zinc/13/12/79/1410131279.db2.gz QTWWVGBEXHRPGL-UHFFFAOYSA-N 0 0 388.445 3.472 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 ZINC000092364393 1410145177 /nfs/dbraw/zinc/14/51/77/1410145177.db2.gz FCJOSVKBBFHMTN-CQSZACIVSA-N 0 0 399.300 3.482 20 5 GGBDRN 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GGBDRN Cc1ccc(CCNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cn1 ZINC000111034706 1411883455 /nfs/dbraw/zinc/88/34/55/1411883455.db2.gz TWBGSQMYLKYXPI-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN CN(CCn1cccn1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000111039008 1411883547 /nfs/dbraw/zinc/88/35/47/1411883547.db2.gz MJYLKZIMZQAYRK-UHFFFAOYSA-N 0 0 379.420 3.176 20 5 GGBDRN CCc1nc(CN2CCC(CNC(=O)c3ccc([N+](=O)[O-])s3)CC2)cs1 ZINC000111043665 1411883779 /nfs/dbraw/zinc/88/37/79/1411883779.db2.gz OZXOBHHVHICSSW-UHFFFAOYSA-N 0 0 394.522 3.317 20 5 GGBDRN CCc1cccc2c(CCNC(=O)COc3ccc([N+](=O)[O-])c(OC)c3)c[nH]c21 ZINC000111047382 1411884225 /nfs/dbraw/zinc/88/42/25/1411884225.db2.gz NQRXPXFMVALUTL-UHFFFAOYSA-N 0 0 397.431 3.385 20 5 GGBDRN Cc1c(C(=O)Nc2ccc(-c3nc[nH]n3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000111090081 1411886113 /nfs/dbraw/zinc/88/61/13/1411886113.db2.gz RVRQJZZHKGSRLR-UHFFFAOYSA-N 0 0 382.336 3.157 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(-c2nc[nH]n2)cc1 ZINC000111093736 1411886510 /nfs/dbraw/zinc/88/65/10/1411886510.db2.gz POWRDEBXNVRLGO-SNVBAGLBSA-N 0 0 387.783 3.439 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NCCc1nc(C2CCCCC2)cs1 ZINC000111095563 1411886695 /nfs/dbraw/zinc/88/66/95/1411886695.db2.gz YOBDFPTWAJTKHC-UHFFFAOYSA-N 0 0 377.470 3.045 20 5 GGBDRN O=C(CCCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])N1Cc2ccccc2C1 ZINC000111113969 1411887741 /nfs/dbraw/zinc/88/77/41/1411887741.db2.gz RMEAJMNBBRHEFN-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN C[C@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])CN(C)C(=O)OC(C)(C)C ZINC000111128306 1411889081 /nfs/dbraw/zinc/88/90/81/1411889081.db2.gz OCWRRIUPFXFPBM-LLVKDONJSA-N 0 0 385.848 3.481 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000111133919 1411889893 /nfs/dbraw/zinc/88/98/93/1411889893.db2.gz HLUHJVRASSRAQU-CQSZACIVSA-N 0 0 389.481 3.005 20 5 GGBDRN Cc1cccc(C(=O)N2CCC[C@@H](C3N=NC(=S)N3C3CC3)C2)c1[N+](=O)[O-] ZINC000111135483 1411890081 /nfs/dbraw/zinc/89/00/81/1411890081.db2.gz 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GGBDRN Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1ccccc1Cl)N1CCOCC1 ZINC000111178737 1411893868 /nfs/dbraw/zinc/89/38/68/1411893868.db2.gz NUWCFRZMQUMKKP-KRWDZBQOSA-N 0 0 376.844 3.437 20 5 GGBDRN COC(=O)CCc1nc(COc2ccc([N+](=O)[O-])cc2-c2cccs2)no1 ZINC000111176476 1411894013 /nfs/dbraw/zinc/89/40/13/1411894013.db2.gz DZWQFDMLSPVIMM-UHFFFAOYSA-N 0 0 389.389 3.391 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000111185595 1411894318 /nfs/dbraw/zinc/89/43/18/1411894318.db2.gz HKSYIGAPLYKHAI-UHFFFAOYSA-N 0 0 387.783 3.270 20 5 GGBDRN COCCNC(=O)c1ccc(Cl)c(NCc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000111190510 1411894756 /nfs/dbraw/zinc/89/47/56/1411894756.db2.gz ZENOIPVKPWKCFZ-UHFFFAOYSA-N 0 0 393.827 3.245 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000111278646 1411899256 /nfs/dbraw/zinc/89/92/56/1411899256.db2.gz LHTAKWJLMULYNH-DFPKUZHUSA-N 0 0 386.448 3.185 20 5 GGBDRN C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000111278492 1411899409 /nfs/dbraw/zinc/89/94/09/1411899409.db2.gz HAFVPEQNZMKCIC-VWKPWSFCSA-N 0 0 383.448 3.408 20 5 GGBDRN C[C@H]1CO[C@@H](c2ccccc2Cl)CN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000111309292 1411905999 /nfs/dbraw/zinc/90/59/99/1411905999.db2.gz GQZWZGSUJBISDN-KPZWWZAWSA-N 0 0 389.839 3.309 20 5 GGBDRN CCN(CC)C(=O)c1ccccc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000177163765 1428607307 /nfs/dbraw/zinc/60/73/07/1428607307.db2.gz IXMJIWFOQNXNBJ-LJQANCHMSA-N 0 0 396.447 3.294 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000111365207 1411924728 /nfs/dbraw/zinc/92/47/28/1411924728.db2.gz ARNLIFCKDHNRGJ-PXAZEXFGSA-N 0 0 396.852 3.399 20 5 GGBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000111365166 1411925304 /nfs/dbraw/zinc/92/53/04/1411925304.db2.gz RAYXIYYJHYOIEC-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000111369122 1411928573 /nfs/dbraw/zinc/92/85/73/1411928573.db2.gz WMGFCXUSEQAHFR-HOTGVXAUSA-N 0 0 376.434 3.218 20 5 GGBDRN COc1ccc(-c2ccc(CN[C@H](C)C(=O)NCc3ccco3)o2)c([N+](=O)[O-])c1 ZINC000111399138 1411940249 /nfs/dbraw/zinc/94/02/49/1411940249.db2.gz QOVWIDYRLPEEAK-CYBMUJFWSA-N 0 0 399.403 3.251 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1ccc(Cl)cc1Cl ZINC000111458560 1411964385 /nfs/dbraw/zinc/96/43/85/1411964385.db2.gz QNWURBSSFGFBIO-OAHLLOKOSA-N 0 0 384.219 3.434 20 5 GGBDRN C[C@@H](NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000177173074 1428612857 /nfs/dbraw/zinc/61/28/57/1428612857.db2.gz WDXXLFBDWLVZMR-QWHCGFSZSA-N 0 0 389.839 3.286 20 5 GGBDRN CC(=O)Nc1ccc(Cl)cc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000177173460 1428613054 /nfs/dbraw/zinc/61/30/54/1428613054.db2.gz QKIKPJNNTMZINM-MRXNPFEDSA-N 0 0 388.811 3.424 20 5 GGBDRN C[C@H](NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000177173091 1428613262 /nfs/dbraw/zinc/61/32/62/1428613262.db2.gz WDXXLFBDWLVZMR-OLZOCXBDSA-N 0 0 389.839 3.286 20 5 GGBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111570654 1411994094 /nfs/dbraw/zinc/99/40/94/1411994094.db2.gz NYTPTRDXYVCIGD-SNVBAGLBSA-N 0 0 385.351 3.075 20 5 GGBDRN O=C(NCc1ccc(F)c(Cl)c1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111594090 1411998073 /nfs/dbraw/zinc/99/80/73/1411998073.db2.gz MMAZKXYFZRGHDH-UHFFFAOYSA-N 0 0 375.743 3.159 20 5 GGBDRN O=C(NCCCc1c[nH]c2ccccc12)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111616784 1412002280 /nfs/dbraw/zinc/00/22/80/1412002280.db2.gz HZCPENSORMFQIX-UHFFFAOYSA-N 0 0 390.399 3.280 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)s1 ZINC000111615731 1412002291 /nfs/dbraw/zinc/00/22/91/1412002291.db2.gz XPIUTUFJGUVVLC-SNVBAGLBSA-N 0 0 386.433 3.343 20 5 GGBDRN Cc1ccc(C[C@H](C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000111618575 1412003180 /nfs/dbraw/zinc/00/31/80/1412003180.db2.gz WDMWDEJMMARSDE-AWEZNQCLSA-N 0 0 379.416 3.414 20 5 GGBDRN O=C(NCC1(Sc2ccccc2)CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111620073 1412003359 /nfs/dbraw/zinc/00/33/59/1412003359.db2.gz PZIBSAIZKNQZQJ-UHFFFAOYSA-N 0 0 395.440 3.491 20 5 GGBDRN Nc1c(C(=O)NC[C@H](O)c2ccc(Cl)cc2Cl)cc(F)cc1[N+](=O)[O-] ZINC000111641351 1412006176 /nfs/dbraw/zinc/00/61/76/1412006176.db2.gz YLRPJPTXSRRZEQ-ZDUSSCGKSA-N 0 0 388.182 3.086 20 5 GGBDRN COc1ccc(C(=O)NC[C@H](O)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000111642267 1412006689 /nfs/dbraw/zinc/00/66/89/1412006689.db2.gz RFQZJROPPGIHNG-AWEZNQCLSA-N 0 0 385.203 3.374 20 5 GGBDRN COc1cc(C(=O)NC[C@H](O)c2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000111642798 1412006801 /nfs/dbraw/zinc/00/68/01/1412006801.db2.gz YYADSBYNOYKQBD-AWEZNQCLSA-N 0 0 385.203 3.374 20 5 GGBDRN CCC(CC)[C@H](O)CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000111653383 1412008153 /nfs/dbraw/zinc/00/81/53/1412008153.db2.gz FHRIQTGTYBVXHB-CQSZACIVSA-N 0 0 378.347 3.063 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC(=O)N1CCc2ccccc21 ZINC000111700547 1412013300 /nfs/dbraw/zinc/01/33/00/1412013300.db2.gz VMDYCJYOSHBQEQ-UHFFFAOYSA-N 0 0 382.420 3.394 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)cccc1[N+](=O)[O-] ZINC000111707154 1412013628 /nfs/dbraw/zinc/01/36/28/1412013628.db2.gz KXGBEUXCDFTLEY-CQSZACIVSA-N 0 0 388.811 3.484 20 5 GGBDRN Cc1c(NC(=O)NCCCC(=O)N2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000111707216 1412013720 /nfs/dbraw/zinc/01/37/20/1412013720.db2.gz ZBXALFIRNIGQIX-UHFFFAOYSA-N 0 0 382.420 3.394 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC(n2ccnc2)CC1 ZINC000111730020 1412020049 /nfs/dbraw/zinc/02/00/49/1412020049.db2.gz OACOGIRRPGEELT-UHFFFAOYSA-N 0 0 381.339 3.262 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCCOc2ccccc2C(C)C)cc1[N+](=O)[O-] ZINC000111931071 1412057343 /nfs/dbraw/zinc/05/73/43/1412057343.db2.gz OOBTVZRBVPTOJK-UHFFFAOYSA-N 0 0 385.420 3.160 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)CCC2 ZINC000111931824 1412057771 /nfs/dbraw/zinc/05/77/71/1412057771.db2.gz 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GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-]c1cccc(OCCC[NH+](C)C)c1 ZINC000111995942 1412064996 /nfs/dbraw/zinc/06/49/96/1412064996.db2.gz ORKNJMVZJCOLMI-UHFFFAOYSA-N 0 0 393.465 3.035 20 5 GGBDRN O=C(Nc1ccccc1)C1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000112006683 1412066939 /nfs/dbraw/zinc/06/69/39/1412066939.db2.gz BFYCWDCRDOJZTH-UHFFFAOYSA-N 0 0 379.420 3.253 20 5 GGBDRN CCS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000112012855 1412067683 /nfs/dbraw/zinc/06/76/83/1412067683.db2.gz WZZIKUMEENTSGN-UHFFFAOYSA-N 0 0 386.788 3.433 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1 ZINC000112016996 1412067952 /nfs/dbraw/zinc/06/79/52/1412067952.db2.gz DNTOBKGWYZZTDK-JTQLQIEISA-N 0 0 392.209 3.114 20 5 GGBDRN CCS[C@H]1CCCCN(C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C1 ZINC000112038381 1412070805 /nfs/dbraw/zinc/07/08/05/1412070805.db2.gz XKTHKHHDQDGKED-INIZCTEOSA-N 0 0 389.481 3.232 20 5 GGBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000112073590 1412073730 /nfs/dbraw/zinc/07/37/30/1412073730.db2.gz ZUJAIHZTNNRAQE-UHFFFAOYSA-N 0 0 375.388 3.406 20 5 GGBDRN O=C(NC1CCCCC1)N1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112073787 1412073769 /nfs/dbraw/zinc/07/37/69/1412073769.db2.gz YENVDQBTXOGDTQ-UHFFFAOYSA-N 0 0 383.452 3.307 20 5 GGBDRN CNS(=O)(=O)c1cccc([C@H](C)Nc2ccc3ncccc3c2[N+](=O)[O-])c1 ZINC000112079902 1412073958 /nfs/dbraw/zinc/07/39/58/1412073958.db2.gz JQOXUBQAMSWEQC-LBPRGKRZSA-N 0 0 386.433 3.224 20 5 GGBDRN O=C(Cc1ccc(Nc2ccc3ncccc3c2[N+](=O)[O-])cc1)N1CCOCC1 ZINC000112074264 1412074126 /nfs/dbraw/zinc/07/41/26/1412074126.db2.gz BHKAOBIZRYPYEE-UHFFFAOYSA-N 0 0 392.415 3.288 20 5 GGBDRN Cc1cc(CNc2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])on1 ZINC000112076818 1412074397 /nfs/dbraw/zinc/07/43/97/1412074397.db2.gz WRWGDFZETLVNQT-UHFFFAOYSA-N 0 0 388.405 3.304 20 5 GGBDRN Cc1cc(F)cc(C(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000177186548 1428620911 /nfs/dbraw/zinc/62/09/11/1428620911.db2.gz 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CCOc1cc([N+](=O)[O-])c(C(=O)NCCc2ccc(F)cc2F)cc1OC ZINC000112185520 1412089536 /nfs/dbraw/zinc/08/95/36/1412089536.db2.gz UIGDBXGJVDBDSO-UHFFFAOYSA-N 0 0 380.347 3.253 20 5 GGBDRN COc1ccc(CSCC(=O)NCCc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000112185144 1412089934 /nfs/dbraw/zinc/08/99/34/1412089934.db2.gz CLIKJULNONUZCM-UHFFFAOYSA-N 0 0 396.415 3.474 20 5 GGBDRN COC(=O)CCN(C(=O)c1cc(C)cc([N+](=O)[O-])c1)c1nc2ccccc2o1 ZINC000112244943 1412099843 /nfs/dbraw/zinc/09/98/43/1412099843.db2.gz GNYPETPAYXLDKB-UHFFFAOYSA-N 0 0 383.360 3.254 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(CS(=O)(=O)C(C)C)c1 ZINC000112260171 1412106485 /nfs/dbraw/zinc/10/64/85/1412106485.db2.gz BWUYCBIBFQRBPG-UHFFFAOYSA-N 0 0 376.434 3.479 20 5 GGBDRN CCCN(CC(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000112305713 1412129486 /nfs/dbraw/zinc/12/94/86/1412129486.db2.gz ZOXVYLVUPGVBLL-UHFFFAOYSA-N 0 0 390.827 3.321 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)Oc2ccc(Br)c(F)c2)cc1 ZINC000112364144 1412135296 /nfs/dbraw/zinc/13/52/96/1412135296.db2.gz QVJOXZNQBVPWIF-UHFFFAOYSA-N 0 0 390.186 3.405 20 5 GGBDRN COc1ccc(-c2ccc([C@H]3NC(=O)CN3Cc3ccccc3)o2)c([N+](=O)[O-])c1 ZINC000112368993 1412136395 /nfs/dbraw/zinc/13/63/95/1412136395.db2.gz FUIGYIFJGNGYON-NRFANRHFSA-N 0 0 393.399 3.494 20 5 GGBDRN Cc1ccccc1[C@H](O)CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000112396511 1412140285 /nfs/dbraw/zinc/14/02/85/1412140285.db2.gz GPUCKZHIIYERSX-JOCHJYFZSA-N 0 0 386.451 3.313 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1nc2ccccc2n1C ZINC000177197948 1428627214 /nfs/dbraw/zinc/62/72/14/1428627214.db2.gz UBTGKRJCDHBJSM-UHFFFAOYSA-N 0 0 387.827 3.205 20 5 GGBDRN CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1nc2ccccc2n1C ZINC000177199523 1428627568 /nfs/dbraw/zinc/62/75/68/1428627568.db2.gz CQAWXXFZNXOLFR-UHFFFAOYSA-N 0 0 387.827 3.205 20 5 GGBDRN CSc1ccc(C(=O)OCC2CCN(c3ncccc3[N+](=O)[O-])CC2)o1 ZINC000112485069 1412154770 /nfs/dbraw/zinc/15/47/70/1412154770.db2.gz KYQLGNOQLFGOLA-UHFFFAOYSA-N 0 0 377.422 3.378 20 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ZINC000112572197 1412170107 /nfs/dbraw/zinc/17/01/07/1412170107.db2.gz RBZBIUGQKPLNKJ-UHFFFAOYSA-N 0 0 397.300 3.409 20 5 GGBDRN CCOc1ccc2c(c1)CN([C@@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)CC2 ZINC000112580684 1412172184 /nfs/dbraw/zinc/17/21/84/1412172184.db2.gz FYORHZMBVYHXCT-HXUWFJFHSA-N 0 0 381.432 3.157 20 5 GGBDRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 ZINC000112587268 1412172557 /nfs/dbraw/zinc/17/25/57/1412172557.db2.gz FIDRAIIDFZTZMT-NRFANRHFSA-N 0 0 397.431 3.176 20 5 GGBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)ccc1N1C(=O)CCC1=O ZINC000112591312 1412174401 /nfs/dbraw/zinc/17/44/01/1412174401.db2.gz AZWFBKSHBMZDJL-UHFFFAOYSA-N 0 0 387.779 3.462 20 5 GGBDRN Cc1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])ccc1N1C(=O)CCC1=O ZINC000112590376 1412174428 /nfs/dbraw/zinc/17/44/28/1412174428.db2.gz AXSCQDPCHPNVSF-UHFFFAOYSA-N 0 0 387.779 3.462 20 5 GGBDRN O=C(Nc1nc(-c2ccc(F)cc2)ns1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000112594977 1412175479 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SWKMCLRSZDAFGW-CYBMUJFWSA-N 0 0 389.843 3.077 20 5 GGBDRN CSc1ccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000112677552 1412190788 /nfs/dbraw/zinc/19/07/88/1412190788.db2.gz GKRKISIBPMSDSH-ZDUSSCGKSA-N 0 0 393.509 3.331 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000112681089 1412191544 /nfs/dbraw/zinc/19/15/44/1412191544.db2.gz KAVVKWXVLAIRBO-UHFFFAOYSA-N 0 0 375.454 3.137 20 5 GGBDRN CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC(C)(C)C1 ZINC000112685904 1412192568 /nfs/dbraw/zinc/19/25/68/1412192568.db2.gz VEJBGPOBAHEXTF-INIZCTEOSA-N 0 0 393.509 3.095 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(CCO)CCc1ccccc1 ZINC000112726137 1412204249 /nfs/dbraw/zinc/20/42/49/1412204249.db2.gz IORAUCRPBKBIII-AWEZNQCLSA-N 0 0 392.839 3.079 20 5 GGBDRN CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000112727232 1412204604 /nfs/dbraw/zinc/20/46/04/1412204604.db2.gz RZUDJRLQOQUQFU-GFCCVEGCSA-N 0 0 381.860 3.263 20 5 GGBDRN 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ZINC000113012305 1412255125 /nfs/dbraw/zinc/25/51/25/1412255125.db2.gz KDRITYDCBTYPPV-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN O=C(CCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccccc1 ZINC000113101478 1412262913 /nfs/dbraw/zinc/26/29/13/1412262913.db2.gz TUIKBGSHZPKOMG-UHFFFAOYSA-N 0 0 396.428 3.477 20 5 GGBDRN CCCN(CCc1cccc(F)c1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000113122930 1412265840 /nfs/dbraw/zinc/26/58/40/1412265840.db2.gz IWMPQXYBYZRKPZ-UHFFFAOYSA-N 0 0 397.410 3.410 20 5 GGBDRN Cc1ccc(C[C@H]2CCCN2C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000113136248 1412267723 /nfs/dbraw/zinc/26/77/23/1412267723.db2.gz NXTOHLDTLSYCRZ-QGZVFWFLSA-N 0 0 391.431 3.331 20 5 GGBDRN COc1cc(C(=O)Nc2ccnn2-c2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000113139226 1412268178 /nfs/dbraw/zinc/26/81/78/1412268178.db2.gz BUARRXSLPDJSDG-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN Cc1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1C(=O)N(C)C ZINC000177218297 1428637733 /nfs/dbraw/zinc/63/77/33/1428637733.db2.gz 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O=C(CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)Nc1cccc2ccccc21 ZINC000113867094 1412345853 /nfs/dbraw/zinc/34/58/53/1412345853.db2.gz BZHGSYPYTYVYII-UHFFFAOYSA-N 0 0 394.343 3.025 20 5 GGBDRN Cc1nn([C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2=O)c(C)c1[N+](=O)[O-] ZINC000113925620 1412353145 /nfs/dbraw/zinc/35/31/45/1412353145.db2.gz FHYVHOWAKVLYMO-CYBMUJFWSA-N 0 0 384.314 3.285 20 5 GGBDRN COc1ccc(NC(=O)CN(CCc2cccc(F)c2)C2CC2)c([N+](=O)[O-])c1 ZINC000113940938 1412356758 /nfs/dbraw/zinc/35/67/58/1412356758.db2.gz XUTWHEILQLFMRP-UHFFFAOYSA-N 0 0 387.411 3.388 20 5 GGBDRN COc1cc(C)sc1C(=O)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000114050487 1412377343 /nfs/dbraw/zinc/37/73/43/1412377343.db2.gz NZYVXURBTMRIEX-UHFFFAOYSA-N 0 0 391.449 3.442 20 5 GGBDRN COC(=O)[C@H](C)CN(C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000114063835 1412378983 /nfs/dbraw/zinc/37/89/83/1412378983.db2.gz BAACLAODPQSQIO-BEFAXECRSA-N 0 0 399.447 3.324 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)ccc1Cl 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/nfs/dbraw/zinc/37/99/42/1412379942.db2.gz GDSLSESZRXQWQF-IBGZPJMESA-N 0 0 381.432 3.450 20 5 GGBDRN O=C(CCc1ccccc1)N1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000177240469 1428646011 /nfs/dbraw/zinc/64/60/11/1428646011.db2.gz IZODLOJCTYJYLR-UHFFFAOYSA-N 0 0 396.447 3.294 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000114188451 1412389627 /nfs/dbraw/zinc/38/96/27/1412389627.db2.gz KYEAGJIAZJNMOJ-HNNXBMFYSA-N 0 0 384.354 3.485 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN(CCO)[C@H]3CCc4ccccc43)n2)cc1 ZINC000114191828 1412392159 /nfs/dbraw/zinc/39/21/59/1412392159.db2.gz KCQRBPLULLXGBB-SFHVURJKSA-N 0 0 380.404 3.127 20 5 GGBDRN COc1cc(OCC(=O)N(CC(F)(F)F)[C@H](C)C(C)C)ccc1[N+](=O)[O-] ZINC000114267835 1412398662 /nfs/dbraw/zinc/39/86/62/1412398662.db2.gz NQVBKNQPVNHKHX-LLVKDONJSA-N 0 0 378.347 3.418 20 5 GGBDRN CC(C)[C@@H](C)N(CC(F)(F)F)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000114268435 1412399326 /nfs/dbraw/zinc/39/93/26/1412399326.db2.gz GZHAXGYYOKVAPJ-LLVKDONJSA-N 0 0 385.346 3.225 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)[C@H]1CCc2ccccc2C1 ZINC000114279268 1412400731 /nfs/dbraw/zinc/40/07/31/1412400731.db2.gz PKYNAMYQMBMZBS-SFHVURJKSA-N 0 0 395.459 3.061 20 5 GGBDRN Cc1c(C(=O)N(C)[C@@H]2CCc3ccccc3C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000114280705 1412400762 /nfs/dbraw/zinc/40/07/62/1412400762.db2.gz JRLFOKNZHWLXJW-QGZVFWFLSA-N 0 0 391.431 3.113 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1OC ZINC000114285383 1412402220 /nfs/dbraw/zinc/40/22/20/1412402220.db2.gz MVCHUQNJPNUSOC-GFCCVEGCSA-N 0 0 391.399 3.431 20 5 GGBDRN CC[C@@H]1c2ccccc2CCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000114304687 1412408226 /nfs/dbraw/zinc/40/82/26/1412408226.db2.gz XCZHWXKDVMZEBH-MRXNPFEDSA-N 0 0 399.472 3.322 20 5 GGBDRN COc1cc(C(=O)NCc2cc(C(C)C)no2)c([N+](=O)[O-])cc1OC(F)F ZINC000114307552 1412408920 /nfs/dbraw/zinc/40/89/20/1412408920.db2.gz PKCAFRXIDOQENV-UHFFFAOYSA-N 0 0 385.323 3.246 20 5 GGBDRN Cn1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1=O ZINC000114351687 1412417988 /nfs/dbraw/zinc/41/79/88/1412417988.db2.gz DKHLENIGVITAKM-UHFFFAOYSA-N 0 0 378.388 3.158 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)CNc2ccccc2[N+](=O)[O-])cc1OC ZINC000114417885 1412429548 /nfs/dbraw/zinc/42/95/48/1412429548.db2.gz CNTRRVMGFZWRLK-LLVKDONJSA-N 0 0 377.372 3.040 20 5 GGBDRN CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NCc1ccccc1[N+](=O)[O-] ZINC000177247207 1428650641 /nfs/dbraw/zinc/65/06/41/1428650641.db2.gz KQPVRUYWBIYGLT-UHFFFAOYSA-N 0 0 393.465 3.244 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCc2cc(C(C)C)no2)c([N+](=O)[O-])c1 ZINC000114451277 1412435629 /nfs/dbraw/zinc/43/56/29/1412435629.db2.gz FEOWIXCCMKDXLE-UHFFFAOYSA-N 0 0 396.469 3.349 20 5 GGBDRN COC(=O)CCN(Cc1ccncc1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000177248718 1428651250 /nfs/dbraw/zinc/65/12/50/1428651250.db2.gz JJFVVINUMXXCJZ-UHFFFAOYSA-N 0 0 399.428 3.410 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(CCO)[C@@H]1CCCc2ccccc21 ZINC000114468411 1412440013 /nfs/dbraw/zinc/44/00/13/1412440013.db2.gz JFLFXEGZUJGKPS-GOSISDBHSA-N 0 0 383.448 3.214 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cc1OC ZINC000114539848 1412455426 /nfs/dbraw/zinc/45/54/26/1412455426.db2.gz LDDVDJWQWUUTNX-JTQLQIEISA-N 0 0 377.372 3.133 20 5 GGBDRN C[C@@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1ccccc1 ZINC000114547114 1412457583 /nfs/dbraw/zinc/45/75/83/1412457583.db2.gz MGHVMCVJZPAQGQ-OAQYLSRUSA-N 0 0 383.448 3.223 20 5 GGBDRN CSc1ccc(C(=O)NC[C@](C)(O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000114555503 1412460531 /nfs/dbraw/zinc/46/05/31/1412460531.db2.gz QNWKPSYIQGQJCJ-KRWDZBQOSA-N 0 0 382.388 3.232 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cccc(COc2ccc(C)nc2)c1 ZINC000114618759 1412479031 /nfs/dbraw/zinc/47/90/31/1412479031.db2.gz AVJYOTANZQKODG-UHFFFAOYSA-N 0 0 396.403 3.239 20 5 GGBDRN CC(C)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1=O ZINC000114656593 1412490067 /nfs/dbraw/zinc/49/00/67/1412490067.db2.gz 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ZINC000115200936 1412605991 /nfs/dbraw/zinc/60/59/91/1412605991.db2.gz HDQTVNSIDSXWFS-KRWDZBQOSA-N 0 0 383.448 3.179 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N(C)C[C@@H]2CCOC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000177268020 1428663213 /nfs/dbraw/zinc/66/32/13/1428663213.db2.gz NLVSSSYABHXBKV-CABCVRRESA-N 0 0 384.436 3.271 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115239368 1412618830 /nfs/dbraw/zinc/61/88/30/1412618830.db2.gz FPUKYAFKOSQUCY-UHFFFAOYSA-N 0 0 395.394 3.367 20 5 GGBDRN Cc1nn(C)c(C(=O)N[C@@H](Cc2ccc(C)cc2)c2ccccn2)c1[N+](=O)[O-] ZINC000115252034 1412619678 /nfs/dbraw/zinc/61/96/78/1412619678.db2.gz VXCIIKZNXPWOTN-KRWDZBQOSA-N 0 0 379.420 3.054 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N(CC2CC2)CC2CC2)cc1[N+](=O)[O-] ZINC000115249829 1412619923 /nfs/dbraw/zinc/61/99/23/1412619923.db2.gz KPCKAKNRROPACQ-UHFFFAOYSA-N 0 0 387.465 3.137 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1 ZINC000115268859 1412626391 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0 0 399.447 3.435 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(-c2nccc(C)n2)cc1 ZINC000115528247 1412701649 /nfs/dbraw/zinc/70/16/49/1412701649.db2.gz ZODJCUUYQFMNIX-UHFFFAOYSA-N 0 0 393.403 3.419 20 5 GGBDRN O=C(Nc1ccncc1)c1ccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000177272100 1428665290 /nfs/dbraw/zinc/66/52/90/1428665290.db2.gz VGKMKIABRZULAY-UHFFFAOYSA-N 0 0 394.362 3.311 20 5 GGBDRN COc1cc(C(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000177292332 1428674831 /nfs/dbraw/zinc/67/48/31/1428674831.db2.gz JTKGLDJHJLFOLA-GWQKEKGPSA-N 0 0 376.434 3.174 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000115571314 1412716217 /nfs/dbraw/zinc/71/62/17/1412716217.db2.gz AISXPFPQOQBHNF-DNVCBOLYSA-N 0 0 396.447 3.049 20 5 GGBDRN CN([C@@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000115588099 1412722577 /nfs/dbraw/zinc/72/25/77/1412722577.db2.gz DOLPGXSYVABMMV-MRXNPFEDSA-N 0 0 393.440 3.023 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N1CCSC[C@H]1c1ccccc1 ZINC000115590381 1412722636 /nfs/dbraw/zinc/72/26/36/1412722636.db2.gz CTBIPOVWZRZXND-AWEZNQCLSA-N 0 0 382.438 3.213 20 5 GGBDRN CCc1ccc(OS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c([N+](=O)[O-])c1 ZINC000115593050 1412723961 /nfs/dbraw/zinc/72/39/61/1412723961.db2.gz COVYLTLHGBWSOH-UHFFFAOYSA-N 0 0 386.769 3.487 20 5 GGBDRN O=C(Nc1ccc2c(c1)C(=O)CCC2)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000177287640 1428672675 /nfs/dbraw/zinc/67/26/75/1428672675.db2.gz BTDVWLMAZLJGBG-UHFFFAOYSA-N 0 0 394.431 3.468 20 5 GGBDRN O=C(C[C@H]1OCCc2ccccc21)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000115712302 1412771902 /nfs/dbraw/zinc/77/19/02/1412771902.db2.gz QESVQXGUOKYVQQ-MRXNPFEDSA-N 0 0 379.376 3.023 20 5 GGBDRN O=C(Nc1cccc(C[S@@](=O)c2ccccc2)c1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000115723903 1412773957 /nfs/dbraw/zinc/77/39/57/1412773957.db2.gz AJXQGPAYKNKVNJ-NDEPHWFRSA-N 0 0 397.412 3.256 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cccc(C[S@@](C)=O)c2)c1 ZINC000115730999 1412774789 /nfs/dbraw/zinc/77/47/89/1412774789.db2.gz DTSBZTNBUUPQEE-SANMLTNESA-N 0 0 376.434 3.189 20 5 GGBDRN CN(C)[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000115807712 1412795141 /nfs/dbraw/zinc/79/51/41/1412795141.db2.gz JGQZCXLPZWIECF-QGZVFWFLSA-N 0 0 392.406 3.018 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cc(OC)c(OC)c(OC)c2)c1 ZINC000115859690 1412803195 /nfs/dbraw/zinc/80/31/95/1412803195.db2.gz ZLCIMXNTIXTCEJ-LLVKDONJSA-N 0 0 390.392 3.120 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1 ZINC000115858844 1412803207 /nfs/dbraw/zinc/80/32/07/1412803207.db2.gz XOFPFZKKYJVXSK-KRWDZBQOSA-N 0 0 376.434 3.125 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1 ZINC000115858847 1412803263 /nfs/dbraw/zinc/80/32/63/1412803263.db2.gz XOFPFZKKYJVXSK-QGZVFWFLSA-N 0 0 376.434 3.125 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(C)c(Oc2ccncc2)c1 ZINC000115907274 1412813985 /nfs/dbraw/zinc/81/39/85/1412813985.db2.gz IYUIYIKPLQKTBM-UHFFFAOYSA-N 0 0 382.376 3.452 20 5 GGBDRN CCc1ccc(OC(=O)Cc2csc(NC(=O)C(C)C)n2)c([N+](=O)[O-])c1 ZINC000115927131 1412816119 /nfs/dbraw/zinc/81/61/19/1412816119.db2.gz IAZFVAAJGKWQAL-UHFFFAOYSA-N 0 0 377.422 3.356 20 5 GGBDRN CCc1ccc(OC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)c([N+](=O)[O-])c1 ZINC000115926585 1412816200 /nfs/dbraw/zinc/81/62/00/1412816200.db2.gz VGDFRJBDUGIKLT-UHFFFAOYSA-N 0 0 383.809 3.433 20 5 GGBDRN CC[C@H](C)C[C@H](C)NS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000115928535 1412816548 /nfs/dbraw/zinc/81/65/48/1412816548.db2.gz IAPPGQZNMFUSEV-UWVGGRQHSA-N 0 0 379.276 3.460 20 5 GGBDRN O=C1N[C@]2(CCCc3sccc32)C(=O)N1Cc1c(F)cccc1[N+](=O)[O-] ZINC000115963448 1412818345 /nfs/dbraw/zinc/81/83/45/1412818345.db2.gz ZQDRPFWWFYMPPD-KRWDZBQOSA-N 0 0 375.381 3.079 20 5 GGBDRN O=C1N[C@@]2(CCCc3sccc32)C(=O)N1Cc1c(F)cccc1[N+](=O)[O-] ZINC000115963451 1412818355 /nfs/dbraw/zinc/81/83/55/1412818355.db2.gz ZQDRPFWWFYMPPD-QGZVFWFLSA-N 0 0 375.381 3.079 20 5 GGBDRN Cc1cc([C@@]2(C)NC(=O)N(Cc3ccc(Cl)cc3[N+](=O)[O-])C2=O)c(C)o1 ZINC000115966025 1412818660 /nfs/dbraw/zinc/81/86/60/1412818660.db2.gz FTUPQVUSKBXDRM-QGZVFWFLSA-N 0 0 377.784 3.425 20 5 GGBDRN O=C([C@H]1C[C@@H]1c1c(F)cccc1F)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000115994480 1412820585 /nfs/dbraw/zinc/82/05/85/1412820585.db2.gz VCKREUSKIMSTGU-HOTGVXAUSA-N 0 0 387.386 3.325 20 5 GGBDRN O=C(COC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)Nc1cccc([N+](=O)[O-])c1 ZINC000116017309 1412821868 /nfs/dbraw/zinc/82/18/68/1412821868.db2.gz RISZACIGSPKZIM-CHWSQXEVSA-N 0 0 376.315 3.158 20 5 GGBDRN CC(C)(C)[S@](=O)Cc1cccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1 ZINC000116033294 1412823587 /nfs/dbraw/zinc/82/35/87/1412823587.db2.gz JKDPILLZIBVYKR-MHZLTWQESA-N 0 0 392.481 3.212 20 5 GGBDRN Cc1coc(-c2cccc(NC(=O)C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)c2)n1 ZINC000177302467 1428678660 /nfs/dbraw/zinc/67/86/60/1428678660.db2.gz AUXJBBNNLAQNAH-CYBMUJFWSA-N 0 0 394.387 3.374 20 5 GGBDRN Cc1coc(-c2cccc(NC(=O)C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)c2)n1 ZINC000177302449 1428678765 /nfs/dbraw/zinc/67/87/65/1428678765.db2.gz AUXJBBNNLAQNAH-ZDUSSCGKSA-N 0 0 394.387 3.374 20 5 GGBDRN O=C(COc1ccc2ccc(=O)oc2c1)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000116062205 1412826482 /nfs/dbraw/zinc/82/64/82/1412826482.db2.gz KIUDBRFZJDWIET-UHFFFAOYSA-N 0 0 389.747 3.477 20 5 GGBDRN Cc1ccc(C(=O)OCc2cc([N+](=O)[O-])ccc2Cl)cc1S(C)(=O)=O ZINC000116062080 1412826584 /nfs/dbraw/zinc/82/65/84/1412826584.db2.gz MWIGLCQWZYTRJE-UHFFFAOYSA-N 0 0 383.809 3.317 20 5 GGBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCc2ccccc2CC1 ZINC000116069954 1412827841 /nfs/dbraw/zinc/82/78/41/1412827841.db2.gz JPJOPKAQNHZWCA-UHFFFAOYSA-N 0 0 379.460 3.439 20 5 GGBDRN COc1ccc(CSCC(=O)N2CCc3ccccc3CC2)cc1[N+](=O)[O-] ZINC000116070296 1412828245 /nfs/dbraw/zinc/82/82/45/1412828245.db2.gz RHDXDTNIWLIDMA-UHFFFAOYSA-N 0 0 386.473 3.464 20 5 GGBDRN COc1ccccc1C(C)(C)CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000116088310 1412830082 /nfs/dbraw/zinc/83/00/82/1412830082.db2.gz PABBNLBPBIVFSI-UHFFFAOYSA-N 0 0 394.431 3.497 20 5 GGBDRN CC(C)(C)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CC1 ZINC000116090302 1412830523 /nfs/dbraw/zinc/83/05/23/1412830523.db2.gz SQHPLXRPFHEZRN-CQSZACIVSA-N 0 0 382.482 3.287 20 5 GGBDRN CC(C)(C)[C@@H]1CCCN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000116091479 1412830541 /nfs/dbraw/zinc/83/05/41/1412830541.db2.gz QFYWRCSNPQOZTM-CQSZACIVSA-N 0 0 393.509 3.461 20 5 GGBDRN CC(C)(C)[C@H]1CCCN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1 ZINC000116090742 1412830554 /nfs/dbraw/zinc/83/05/54/1412830554.db2.gz JPSWEEHWYLHKGG-ZDUSSCGKSA-N 0 0 375.425 3.178 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000116095075 1412831415 /nfs/dbraw/zinc/83/14/15/1412831415.db2.gz BZRDZMHPYLCPGP-CZUORRHYSA-N 0 0 399.357 3.048 20 5 GGBDRN O=C(c1cccc(C(F)(F)F)c1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000177303338 1428679465 /nfs/dbraw/zinc/67/94/65/1428679465.db2.gz ATXYZHBTQHBHNY-JTQLQIEISA-N 0 0 398.316 3.474 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@@H](C)Cc2nc3ccccc3s2)cc([N+](=O)[O-])c1 ZINC000116102289 1412832526 /nfs/dbraw/zinc/83/25/26/1412832526.db2.gz LSJOVKXGUPSXEQ-NSHDSACASA-N 0 0 399.428 3.352 20 5 GGBDRN O=C(N[C@H]1CCCN(c2cccc(F)c2)C1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000116108872 1412833154 /nfs/dbraw/zinc/83/31/54/1412833154.db2.gz SFAHRWOYXFPLTA-LBPRGKRZSA-N 0 0 379.338 3.411 20 5 GGBDRN Cc1nn(CCC(=O)N2CCSC[C@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000116133920 1412835219 /nfs/dbraw/zinc/83/52/19/1412835219.db2.gz SBKJKRKRNYWILS-KRWDZBQOSA-N 0 0 388.493 3.423 20 5 GGBDRN COCCCn1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 ZINC000116153575 1412837428 /nfs/dbraw/zinc/83/74/28/1412837428.db2.gz YYPYCWMVKQCWHG-UHFFFAOYSA-N 0 0 390.443 3.026 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1 ZINC000116173833 1412839546 /nfs/dbraw/zinc/83/95/46/1412839546.db2.gz IVSZJIWRRKNYLL-UHFFFAOYSA-N 0 0 385.355 3.455 20 5 GGBDRN CC(C)(C)[S@](=O)Cc1cccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000116203732 1412841937 /nfs/dbraw/zinc/84/19/37/1412841937.db2.gz NCGIWFYGTQZOKP-SANMLTNESA-N 0 0 375.450 3.477 20 5 GGBDRN Cc1ccc(CCNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000116208422 1412842680 /nfs/dbraw/zinc/84/26/80/1412842680.db2.gz ZYDSZVXWDPBOQJ-FQEVSTJZSA-N 0 0 395.459 3.175 20 5 GGBDRN O=C(Nc1ccc2c(c1)C(=O)CCC2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000177304654 1428680286 /nfs/dbraw/zinc/68/02/86/1428680286.db2.gz FAIOUCTZKNJYES-UHFFFAOYSA-N 0 0 394.431 3.468 20 5 GGBDRN CCNC(=O)c1ccc(OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000116268461 1412847099 /nfs/dbraw/zinc/84/70/99/1412847099.db2.gz WEIYXTZYNRJUGB-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(N2CCCC2=O)cc1 ZINC000116303423 1412848382 /nfs/dbraw/zinc/84/83/82/1412848382.db2.gz VUPFGHIGZKWQBN-UHFFFAOYSA-N 0 0 391.387 3.364 20 5 GGBDRN CC(C)Oc1ccccc1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000116313015 1412849282 /nfs/dbraw/zinc/84/92/82/1412849282.db2.gz CAZRZAKWOYJMKF-UHFFFAOYSA-N 0 0 383.448 3.273 20 5 GGBDRN COc1cc(C2(C(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)CC2)ccc1C ZINC000116380992 1412853609 /nfs/dbraw/zinc/85/36/09/1412853609.db2.gz YHXSVFPTOSMHKJ-UHFFFAOYSA-N 0 0 395.459 3.292 20 5 GGBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000177309817 1428681735 /nfs/dbraw/zinc/68/17/35/1428681735.db2.gz KKDDLCKBULQFLV-DQQVXTMASA-N 0 0 386.433 3.042 20 5 GGBDRN CC(C)(C)c1ccc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 ZINC000116456327 1412862844 /nfs/dbraw/zinc/86/28/44/1412862844.db2.gz PHHVYQSCPNVVLY-QGZVFWFLSA-N 0 0 387.392 3.264 20 5 GGBDRN CCC[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000116458315 1412863188 /nfs/dbraw/zinc/86/31/88/1412863188.db2.gz SAYNBLHZMBEGTJ-HNNXBMFYSA-N 0 0 385.449 3.387 20 5 GGBDRN COC(=O)c1ccc(N2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)[C@H](C)C2)cc1 ZINC000116460688 1412863770 /nfs/dbraw/zinc/86/37/70/1412863770.db2.gz IRHFDAFBWRYWQV-OAHLLOKOSA-N 0 0 397.431 3.041 20 5 GGBDRN COC(=O)c1ccc(N2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)[C@@H](C)C2)cc1 ZINC000116460685 1412863841 /nfs/dbraw/zinc/86/38/41/1412863841.db2.gz IRHFDAFBWRYWQV-HNNXBMFYSA-N 0 0 397.431 3.041 20 5 GGBDRN COC(=O)c1ccc(N2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])[C@H](C)C2)cc1 ZINC000116460752 1412863938 /nfs/dbraw/zinc/86/39/38/1412863938.db2.gz MWWBFNSWZOSFBM-OAHLLOKOSA-N 0 0 397.431 3.041 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000116460816 1412863978 /nfs/dbraw/zinc/86/39/78/1412863978.db2.gz JSOUUOVYKVMPTH-QGZVFWFLSA-N 0 0 378.812 3.499 20 5 GGBDRN CC(C)Oc1ccc([C@H](O)CNC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000116463017 1412864284 /nfs/dbraw/zinc/86/42/84/1412864284.db2.gz KDFSOCHUFVKUKT-LJQANCHMSA-N 0 0 387.436 3.034 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(Cc2ccc(Cl)nc2)CC1 ZINC000116474259 1412865478 /nfs/dbraw/zinc/86/54/78/1412865478.db2.gz CMIGSSXQNGCPLB-UHFFFAOYSA-N 0 0 389.843 3.301 20 5 GGBDRN CN1C[C@H](NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1=O ZINC000116494348 1412868226 /nfs/dbraw/zinc/86/82/26/1412868226.db2.gz DCFBGTAUAFAJHR-CYBMUJFWSA-N 0 0 389.795 3.001 20 5 GGBDRN CCOC(=O)C[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000116544898 1412875091 /nfs/dbraw/zinc/87/50/91/1412875091.db2.gz KBRDGEKHIYATLK-INIZCTEOSA-N 0 0 390.367 3.167 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000116576763 1412880423 /nfs/dbraw/zinc/88/04/23/1412880423.db2.gz DVCKXXLFHPDCIU-LBPRGKRZSA-N 0 0 381.404 3.111 20 5 GGBDRN Cn1c(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])nc2ccccc21 ZINC000116621442 1412888033 /nfs/dbraw/zinc/88/80/33/1412888033.db2.gz JQXPYLXKZNHWMT-UHFFFAOYSA-N 0 0 388.811 3.220 20 5 GGBDRN Cc1nc(C2(NC(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])CCCC2)no1 ZINC000116623409 1412888315 /nfs/dbraw/zinc/88/83/15/1412888315.db2.gz ZBLFIZJLZXIRNE-UHFFFAOYSA-N 0 0 394.815 3.294 20 5 GGBDRN Cc1nn(C)c2ncc(NC(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])cc12 ZINC000116623338 1412888348 /nfs/dbraw/zinc/88/83/48/1412888348.db2.gz UDFSKPZGOXFKRT-UHFFFAOYSA-N 0 0 389.799 3.246 20 5 GGBDRN CCNC(=O)c1ccccc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116628000 1412888964 /nfs/dbraw/zinc/88/89/64/1412888964.db2.gz GCCXAZYQAGRQAK-UHFFFAOYSA-N 0 0 391.811 3.406 20 5 GGBDRN Cc1cccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1C(N)=O ZINC000116630302 1412888988 /nfs/dbraw/zinc/88/89/88/1412888988.db2.gz PCHQJQPDGIKYAK-UHFFFAOYSA-N 0 0 377.784 3.063 20 5 GGBDRN Cc1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1C(N)=O ZINC000116638761 1412889950 /nfs/dbraw/zinc/88/99/50/1412889950.db2.gz OBVBJSRYUNNABQ-UHFFFAOYSA-N 0 0 377.784 3.063 20 5 GGBDRN Cn1c(=O)oc2cc(NC(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000116639536 1412890139 /nfs/dbraw/zinc/89/01/39/1412890139.db2.gz TYNRUVUZLIMLDH-UHFFFAOYSA-N 0 0 391.767 3.101 20 5 GGBDRN O=C(COCCOc1ccccc1)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000116637491 1412890165 /nfs/dbraw/zinc/89/01/65/1412890165.db2.gz ZWGYHSVDWHNRLR-UHFFFAOYSA-N 0 0 382.376 3.019 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC(Oc3ccc(C)cc3)CC2)c(C)c1[N+](=O)[O-] ZINC000116654053 1412892080 /nfs/dbraw/zinc/89/20/80/1412892080.db2.gz OEBKZNWQZQWITK-UHFFFAOYSA-N 0 0 386.452 3.177 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000116659574 1412893332 /nfs/dbraw/zinc/89/33/32/1412893332.db2.gz GKJQPJDEGJXTOJ-AWEZNQCLSA-N 0 0 391.374 3.134 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000116659870 1412893371 /nfs/dbraw/zinc/89/33/71/1412893371.db2.gz HJUGFLQELHGIOH-HNNXBMFYSA-N 0 0 389.839 3.194 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000116659996 1412893723 /nfs/dbraw/zinc/89/37/23/1412893723.db2.gz WJHCEQQGJWAOFH-AWEZNQCLSA-N 0 0 391.374 3.134 20 5 GGBDRN O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc([N+](=O)[O-])s1 ZINC000116661134 1412894140 /nfs/dbraw/zinc/89/41/40/1412894140.db2.gz UITGSXLBMPUKTE-JTQLQIEISA-N 0 0 383.376 3.266 20 5 GGBDRN Cc1nn(CCC(=O)NCc2ccc(OC3CCCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000116665193 1412894647 /nfs/dbraw/zinc/89/46/47/1412894647.db2.gz FLTBYLRTHHRFMZ-UHFFFAOYSA-N 0 0 386.452 3.436 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000116678848 1412895703 /nfs/dbraw/zinc/89/57/03/1412895703.db2.gz RPHWXTFXCNHOQS-UHFFFAOYSA-N 0 0 382.825 3.354 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000116679290 1412895736 /nfs/dbraw/zinc/89/57/36/1412895736.db2.gz APWOJDMWTYTWSK-UHFFFAOYSA-N 0 0 382.825 3.354 20 5 GGBDRN COCC[S@@](=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000116680613 1412896081 /nfs/dbraw/zinc/89/60/81/1412896081.db2.gz JGXYUPFGDNWKTH-SANMLTNESA-N 0 0 396.852 3.396 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000116681023 1412896178 /nfs/dbraw/zinc/89/61/78/1412896178.db2.gz FOVSQIPRKUFNNR-AREMUKBSSA-N 0 0 376.434 3.051 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000116684079 1412896843 /nfs/dbraw/zinc/89/68/43/1412896843.db2.gz WAPBBIBJHSOXSA-HHHXNRCGSA-N 0 0 398.387 3.020 20 5 GGBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000116692860 1412898161 /nfs/dbraw/zinc/89/81/61/1412898161.db2.gz XREODBIQDVYSSG-MUUNZHRXSA-N 0 0 398.444 3.220 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)c2cc([N+](=O)[O-])ccc2Br)o1 ZINC000116704858 1412899624 /nfs/dbraw/zinc/89/96/24/1412899624.db2.gz VPFDMRKPOUMKAS-CQSZACIVSA-N 0 0 395.209 3.472 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cccc(C[S@@](C)=O)c2C)c1C ZINC000116711936 1412900404 /nfs/dbraw/zinc/90/04/04/1412900404.db2.gz MWZBXIPUSLDTJD-VWLOTQADSA-N 0 0 396.490 3.199 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cccc(C[S@](C)=O)c2C)c1C ZINC000116711933 1412901802 /nfs/dbraw/zinc/90/18/02/1412901802.db2.gz MWZBXIPUSLDTJD-RUZDIDTESA-N 0 0 396.490 3.199 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC[C@@H]1Cc1ccccc1 ZINC000116713394 1412903130 /nfs/dbraw/zinc/90/31/30/1412903130.db2.gz IKXSGEWQBVRHIC-QFBILLFUSA-N 0 0 395.459 3.337 20 5 GGBDRN CC(C)(C)NC(=O)[C@@H]1CSCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000116742346 1412913128 /nfs/dbraw/zinc/91/31/28/1412913128.db2.gz KPAGXQWEAWCLQF-LBPRGKRZSA-N 0 0 393.490 3.239 20 5 GGBDRN Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000116790448 1412924264 /nfs/dbraw/zinc/92/42/64/1412924264.db2.gz YPTHBFYZBYMRAK-JXMROGBWSA-N 0 0 394.431 3.293 20 5 GGBDRN CCc1nc(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)sc1C ZINC000116796348 1412925131 /nfs/dbraw/zinc/92/51/31/1412925131.db2.gz KVVQUZLQUYLZIO-UHFFFAOYSA-N 0 0 376.482 3.473 20 5 GGBDRN O=C(Nc1cnn(CC(F)F)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000116842581 1412938420 /nfs/dbraw/zinc/93/84/20/1412938420.db2.gz BDSZAIWZJOHEKL-UHFFFAOYSA-N 0 0 394.256 3.250 20 5 GGBDRN COCCN(C(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1)C1CCCC1 ZINC000116878274 1412947703 /nfs/dbraw/zinc/94/77/03/1412947703.db2.gz POVOKXYOBPFHQU-UHFFFAOYSA-N 0 0 382.482 3.254 20 5 GGBDRN Cc1ccc(OC2CCN(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)CC2)cc1 ZINC000116882866 1412948573 /nfs/dbraw/zinc/94/85/73/1412948573.db2.gz XBQSNKHHQLUJRN-UHFFFAOYSA-N 0 0 395.459 3.336 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(Oc2ccc(C)cc2)CC1 ZINC000116882459 1412948896 /nfs/dbraw/zinc/94/88/96/1412948896.db2.gz UBOKVAQLHPTFRE-UHFFFAOYSA-N 0 0 399.447 3.394 20 5 GGBDRN Cc1ccc(OC2CCN(S(=O)(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 ZINC000116903368 1412952393 /nfs/dbraw/zinc/95/23/93/1412952393.db2.gz AISWGCXBHJQGAL-UHFFFAOYSA-N 0 0 394.424 3.274 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)c1[N+](=O)[O-] ZINC000116981975 1412971612 /nfs/dbraw/zinc/97/16/12/1412971612.db2.gz YVESOLSRCXXROG-UHFFFAOYSA-N 0 0 387.440 3.280 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000116997517 1412975653 /nfs/dbraw/zinc/97/56/53/1412975653.db2.gz PPMPYHNZLMVPII-UHFFFAOYSA-N 0 0 377.422 3.400 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)Nc1ccccc1N1CCCC1=O ZINC000177329055 1428692315 /nfs/dbraw/zinc/69/23/15/1428692315.db2.gz BIWHGOCFTGOXHK-UHFFFAOYSA-N 0 0 389.795 3.393 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCOc1ccc([N+](=O)[O-])c(F)c1 ZINC000117111439 1413000537 /nfs/dbraw/zinc/00/05/37/1413000537.db2.gz NYZZMSLHJNHJED-UHFFFAOYSA-N 0 0 377.284 3.019 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCOc1ccc([N+](=O)[O-])cc1F ZINC000117109576 1413000717 /nfs/dbraw/zinc/00/07/17/1413000717.db2.gz LTVTVPGGWGMNDZ-UHFFFAOYSA-N 0 0 377.284 3.019 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CSc3n[nH]c(-c4ccccn4)n3)o2)cc1 ZINC000117116669 1413002366 /nfs/dbraw/zinc/00/23/66/1413002366.db2.gz KPNBRBGWMDULSR-UHFFFAOYSA-N 0 0 381.377 3.117 20 5 GGBDRN CC[C@@H]1CCCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1 ZINC000117158928 1413007524 /nfs/dbraw/zinc/00/75/24/1413007524.db2.gz PUYXQBFGYAKIJX-CQSZACIVSA-N 0 0 375.425 3.322 20 5 GGBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)Nc1cccc(C(=O)NC2CC2)c1 ZINC000177332397 1428693737 /nfs/dbraw/zinc/69/37/37/1428693737.db2.gz 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ZINC000117381043 1413032796 /nfs/dbraw/zinc/03/27/96/1413032796.db2.gz SZHGWGBCODYCCI-CYBMUJFWSA-N 0 0 393.465 3.027 20 5 GGBDRN CC(C)c1nc(CSCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)no1 ZINC000117380721 1413032812 /nfs/dbraw/zinc/03/28/12/1413032812.db2.gz UULPXRCWKJFXIF-UHFFFAOYSA-N 0 0 378.410 3.333 20 5 GGBDRN CCC(CC)NC(=O)[C@H](C)SCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117381037 1413032913 /nfs/dbraw/zinc/03/29/13/1413032913.db2.gz GQFGIIDYPWGCBL-LBPRGKRZSA-N 0 0 395.481 3.319 20 5 GGBDRN CC(C)N(C(=O)CSCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C(C)C ZINC000117381088 1413033023 /nfs/dbraw/zinc/03/30/23/1413033023.db2.gz UROUMHBSPUDXES-UHFFFAOYSA-N 0 0 395.481 3.271 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H](C)SCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117380907 1413033280 /nfs/dbraw/zinc/03/32/80/1413033280.db2.gz HBJUATXEFUTOPB-STQMWFEESA-N 0 0 395.481 3.319 20 5 GGBDRN O=C(CCSCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)NC1CCCC1 ZINC000117380994 1413033294 /nfs/dbraw/zinc/03/32/94/1413033294.db2.gz 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CCCNC(=O)c1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000117612815 1413056242 /nfs/dbraw/zinc/05/62/42/1413056242.db2.gz GUJQVMYKPCETDR-UHFFFAOYSA-N 0 0 389.839 3.247 20 5 GGBDRN Cc1sc(NC(=O)COC[C@H]2CCOC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000117622230 1413056806 /nfs/dbraw/zinc/05/68/06/1413056806.db2.gz ZEQCPFFLMMAEPF-LBPRGKRZSA-N 0 0 377.422 3.018 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)cn2)n1 ZINC000117615619 1413057001 /nfs/dbraw/zinc/05/70/01/1413057001.db2.gz JPJGKOLBQMKXKS-UHFFFAOYSA-N 0 0 399.838 3.305 20 5 GGBDRN CCN(CC)C(=O)C1(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000117626288 1413057316 /nfs/dbraw/zinc/05/73/16/1413057316.db2.gz MMSPKDSNRHVVGZ-UHFFFAOYSA-N 0 0 395.887 3.478 20 5 GGBDRN CN(c1ccccc1)C1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000117623067 1413057688 /nfs/dbraw/zinc/05/76/88/1413057688.db2.gz WRWHFONJWAQHCG-UHFFFAOYSA-N 0 0 397.431 3.107 20 5 GGBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000117631202 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IWDPBZDGVOVMAH-UHFFFAOYSA-N 0 0 384.392 3.276 20 5 GGBDRN O=C(OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cnn(-c2ccccc2)n1 ZINC000117677893 1413065330 /nfs/dbraw/zinc/06/53/30/1413065330.db2.gz LMXMDLSUNJKQNU-UHFFFAOYSA-N 0 0 391.343 3.188 20 5 GGBDRN CCc1ccc(C(C)(C)CNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000177338675 1428698347 /nfs/dbraw/zinc/69/83/47/1428698347.db2.gz NFLGHVXVQBBSTP-UHFFFAOYSA-N 0 0 399.447 3.198 20 5 GGBDRN CCCC(=O)N1CCC[C@H]1C(=O)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117677065 1413065483 /nfs/dbraw/zinc/06/54/83/1413065483.db2.gz GLKJXWHQAGPYJV-INIZCTEOSA-N 0 0 387.392 3.084 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000117708517 1413069388 /nfs/dbraw/zinc/06/93/88/1413069388.db2.gz LNMOSEHFDLACAW-QGZVFWFLSA-N 0 0 383.404 3.155 20 5 GGBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000117709480 1413069737 /nfs/dbraw/zinc/06/97/37/1413069737.db2.gz ILTYTBCKHMVFAR-GOSISDBHSA-N 0 0 397.431 3.084 20 5 GGBDRN 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ZINC000117766623 1413076520 /nfs/dbraw/zinc/07/65/20/1413076520.db2.gz JGHCAGDYIUBJOQ-ZFWWWQNUSA-N 0 0 395.887 3.334 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1cccc(Cn2cccn2)c1 ZINC000117762708 1413076748 /nfs/dbraw/zinc/07/67/48/1413076748.db2.gz HADJCTRFAHIKED-UHFFFAOYSA-N 0 0 384.823 3.352 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC(c2nncn2C2CC2)CC1 ZINC000117796342 1413079440 /nfs/dbraw/zinc/07/94/40/1413079440.db2.gz JWAGIBHGOKQOSY-UHFFFAOYSA-N 0 0 389.843 3.123 20 5 GGBDRN CC(C)c1nc2c(n1C)CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000117801735 1413080477 /nfs/dbraw/zinc/08/04/77/1413080477.db2.gz XOKKXKWGTMUHSR-UHFFFAOYSA-N 0 0 376.844 3.233 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1nncn1Cc1ccccc1 ZINC000117860494 1413084211 /nfs/dbraw/zinc/08/42/11/1413084211.db2.gz RUKRUZKYEKSXAT-UHFFFAOYSA-N 0 0 380.408 3.065 20 5 GGBDRN CN(C)c1cccc([C@@H]2CCCN2Cn2cc(Br)c([N+](=O)[O-])n2)c1 ZINC000117864784 1413084777 /nfs/dbraw/zinc/08/47/77/1413084777.db2.gz RKVHBDCTEIOJAY-HNNXBMFYSA-N 0 0 394.273 3.414 20 5 GGBDRN CN(C)c1cccc([C@H]2CCCN2CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 ZINC000117864866 1413084978 /nfs/dbraw/zinc/08/49/78/1413084978.db2.gz DNKDSNSXYIEZJV-LJQANCHMSA-N 0 0 394.431 3.051 20 5 GGBDRN COc1ccc(CN(CCO)Cc2cc([N+](=O)[O-])ccc2Cl)c(OC)c1 ZINC000117882757 1413086312 /nfs/dbraw/zinc/08/63/12/1413086312.db2.gz ZOJKWFMJYMAZSL-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN C[C@]1(O)CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000177344513 1428700118 /nfs/dbraw/zinc/70/01/18/1428700118.db2.gz REJQMBRNROTCJT-IBGZPJMESA-N 0 0 389.839 3.457 20 5 GGBDRN CC(C)N1C(=S)N=NC1[C@H]1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000117951774 1413092194 /nfs/dbraw/zinc/09/21/94/1413092194.db2.gz LMRJGYPAMNHQSS-LBPRGKRZSA-N 0 0 390.469 3.467 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000117973460 1413093333 /nfs/dbraw/zinc/09/33/33/1413093333.db2.gz QTTPOJVYXFVICI-LBPRGKRZSA-N 0 0 377.832 3.440 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000117986552 1413095153 /nfs/dbraw/zinc/09/51/53/1413095153.db2.gz YRAKAHDYAJQLOM-LJQANCHMSA-N 0 0 385.395 3.121 20 5 GGBDRN COc1ccc(-c2nnc(CNC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)[nH]2)cc1 ZINC000118007064 1413095866 /nfs/dbraw/zinc/09/58/66/1413095866.db2.gz WPUNAEOEXSNERK-UHFFFAOYSA-N 0 0 382.380 3.019 20 5 GGBDRN C[C@H](O)c1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000177354492 1428702539 /nfs/dbraw/zinc/70/25/39/1428702539.db2.gz VUCSSDGZTSQFLZ-JTQLQIEISA-N 0 0 379.210 3.341 20 5 GGBDRN CCO[C@@H](CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CCCC1 ZINC000177347695 1428701126 /nfs/dbraw/zinc/70/11/26/1428701126.db2.gz BXQKLPPLWQIAPR-IBGZPJMESA-N 0 0 386.452 3.496 20 5 GGBDRN CCO[C@H](CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CCCC1 ZINC000177347712 1428701147 /nfs/dbraw/zinc/70/11/47/1428701147.db2.gz BXQKLPPLWQIAPR-LJQANCHMSA-N 0 0 386.452 3.496 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000177350507 1428702045 /nfs/dbraw/zinc/70/20/45/1428702045.db2.gz MNLSXNYQHSCYOD-INIZCTEOSA-N 0 0 386.301 3.497 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2ccc(-n3ccnc3)c(F)c2)cc1[N+](=O)[O-] ZINC000118161364 1413117590 /nfs/dbraw/zinc/11/75/90/1413117590.db2.gz YPMSUIXFPIJCBD-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN O=C(Cc1noc(Cc2ccc([N+](=O)[O-])cc2Cl)n1)NCc1ccccc1 ZINC000118165304 1413118329 /nfs/dbraw/zinc/11/83/29/1413118329.db2.gz YUHCTAJWXXNSPR-UHFFFAOYSA-N 0 0 386.795 3.081 20 5 GGBDRN COC[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000118240663 1413133315 /nfs/dbraw/zinc/13/33/15/1413133315.db2.gz LIZXGVYABBJEFC-MRXNPFEDSA-N 0 0 398.337 3.496 20 5 GGBDRN COC[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000118241081 1413133676 /nfs/dbraw/zinc/13/36/76/1413133676.db2.gz LCOCLSGWWQHZKT-CQSZACIVSA-N 0 0 398.337 3.496 20 5 GGBDRN CC(C)(CNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)c1cccc(F)c1 ZINC000118250739 1413135725 /nfs/dbraw/zinc/13/57/25/1413135725.db2.gz SMGDGKRWNZGFQY-UHFFFAOYSA-N 0 0 383.383 3.022 20 5 GGBDRN Cc1cnc(C(=O)Nc2cc(-c3ccco3)nn2-c2cccc([N+](=O)[O-])c2)cn1 ZINC000118249813 1413136349 /nfs/dbraw/zinc/13/63/49/1413136349.db2.gz UKROGYRGKUKKNJ-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000118272537 1413139977 /nfs/dbraw/zinc/13/99/77/1413139977.db2.gz VJGXNNPXRHMAHU-KSSFIOAISA-N 0 0 386.452 3.352 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000118273642 1413140909 /nfs/dbraw/zinc/14/09/09/1413140909.db2.gz XRORRKCTSGAWBH-KDOFPFPSSA-N 0 0 386.452 3.352 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000118276185 1413140949 /nfs/dbraw/zinc/14/09/49/1413140949.db2.gz IGLZKZZRMFKGBA-KDOFPFPSSA-N 0 0 386.452 3.352 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)CCn1cnc2sccc2c1=O ZINC000118296353 1413144275 /nfs/dbraw/zinc/14/42/75/1413144275.db2.gz HAMREEUCXVXWQM-UHFFFAOYSA-N 0 0 393.808 3.324 20 5 GGBDRN COC[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000118349436 1413154435 /nfs/dbraw/zinc/15/44/35/1413154435.db2.gz VSAPLXHTFVBTHE-AWEZNQCLSA-N 0 0 383.326 3.313 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H]1CCCO[C@H]1C(C)(C)C ZINC000118470058 1413163839 /nfs/dbraw/zinc/16/38/39/1413163839.db2.gz HMWVFCFVJFLATN-CXAGYDPISA-N 0 0 379.457 3.244 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118518290 1413170144 /nfs/dbraw/zinc/17/01/44/1413170144.db2.gz HTGNKJQRPANHTO-HNNXBMFYSA-N 0 0 385.203 3.130 20 5 GGBDRN Nc1c(C(=O)NC[C@H](O)c2cc(Cl)cc(Cl)c2)cc(F)cc1[N+](=O)[O-] ZINC000118520333 1413170507 /nfs/dbraw/zinc/17/05/07/1413170507.db2.gz UFHQNQSEICEBFR-ZDUSSCGKSA-N 0 0 388.182 3.086 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118519207 1413170702 /nfs/dbraw/zinc/17/07/02/1413170702.db2.gz HIAINIBVRLLBSJ-HNNXBMFYSA-N 0 0 385.203 3.130 20 5 GGBDRN CC(C)(CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000118592501 1413190819 /nfs/dbraw/zinc/19/08/19/1413190819.db2.gz VJOUDOUJOZHWRM-UHFFFAOYSA-N 0 0 393.802 3.420 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000118595689 1413192650 /nfs/dbraw/zinc/19/26/50/1413192650.db2.gz GZMQVCDPBBZVOH-XHDPSFHLSA-N 0 0 397.859 3.144 20 5 GGBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000118595693 1413192686 /nfs/dbraw/zinc/19/26/86/1413192686.db2.gz GZMQVCDPBBZVOH-IAQYHMDHSA-N 0 0 397.859 3.144 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O ZINC000118634529 1413199944 /nfs/dbraw/zinc/19/99/44/1413199944.db2.gz NIVJELGLZNZRCL-VXGBXAGGSA-N 0 0 393.827 3.060 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCNC(=O)OCC(F)(F)F ZINC000118634728 1413199980 /nfs/dbraw/zinc/19/99/80/1413199980.db2.gz LRLFFJIXOFTPMU-UHFFFAOYSA-N 0 0 383.710 3.174 20 5 GGBDRN CCN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1C(=O)OC ZINC000118661442 1413202299 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RIOSZVUZGZSJKQ-INIZCTEOSA-N 0 0 384.411 3.264 20 5 GGBDRN Cc1cccc2[nH]cc(CC(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c21 ZINC000118689878 1413205526 /nfs/dbraw/zinc/20/55/26/1413205526.db2.gz RABGWVGFLUHTPM-OAHLLOKOSA-N 0 0 379.420 3.035 20 5 GGBDRN O=C(c1ccc(-n2cccc2)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690069 1413205548 /nfs/dbraw/zinc/20/55/48/1413205548.db2.gz CNYHOKFGIIISBQ-MRXNPFEDSA-N 0 0 377.404 3.107 20 5 GGBDRN O=C(c1nc(Cl)ccc1Cl)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118689746 1413205632 /nfs/dbraw/zinc/20/56/32/1413205632.db2.gz XMQNTMYDWRWPQT-SECBINFHSA-N 0 0 382.207 3.018 20 5 GGBDRN O=C(Cc1ccc2ccccc2c1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690338 1413205663 /nfs/dbraw/zinc/20/56/63/1413205663.db2.gz CJUXRHNIPAHFNH-GOSISDBHSA-N 0 0 376.416 3.399 20 5 GGBDRN O=C(Cn1ccc2ccc(Cl)cc21)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690167 1413205702 /nfs/dbraw/zinc/20/57/02/1413205702.db2.gz PJTHSNXBDDIWKU-HNNXBMFYSA-N 0 0 399.838 3.311 20 5 GGBDRN O=C(Cn1ccc2ccc(Cl)cc21)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690168 1413205798 /nfs/dbraw/zinc/20/57/98/1413205798.db2.gz PJTHSNXBDDIWKU-OAHLLOKOSA-N 0 0 399.838 3.311 20 5 GGBDRN O=C(c1ccc(OC(F)(F)F)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690422 1413205802 /nfs/dbraw/zinc/20/58/02/1413205802.db2.gz AEEBHIRVRYLCCD-LBPRGKRZSA-N 0 0 396.325 3.215 20 5 GGBDRN Cc1cc(C)cc(OCCC(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118689900 1413205832 /nfs/dbraw/zinc/20/58/32/1413205832.db2.gz BAFWHERDVPTGFJ-MRXNPFEDSA-N 0 0 384.436 3.089 20 5 GGBDRN O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690901 1413206132 /nfs/dbraw/zinc/20/61/32/1413206132.db2.gz NRJTWJISGAHMDO-YUTCNCBUSA-N 0 0 386.374 3.371 20 5 GGBDRN O=C(Cc1c(F)cccc1Cl)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690738 1413206192 /nfs/dbraw/zinc/20/61/92/1413206192.db2.gz XWASUFCPSRLOPS-NSHDSACASA-N 0 0 378.791 3.038 20 5 GGBDRN O=C(CSc1ccccc1Cl)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690517 1413206266 /nfs/dbraw/zinc/20/62/66/1413206266.db2.gz LAULUCOIKKPKBC-LBPRGKRZSA-N 0 0 392.868 3.448 20 5 GGBDRN O=C(Cc1cccc2ccccc21)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690735 1413206350 /nfs/dbraw/zinc/20/63/50/1413206350.db2.gz NOKAAKNBVPVHCM-QGZVFWFLSA-N 0 0 376.416 3.399 20 5 GGBDRN Cc1[nH]c2ccc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1C ZINC000118691063 1413206456 /nfs/dbraw/zinc/20/64/56/1413206456.db2.gz AGLDVOYLJBZOFV-HNNXBMFYSA-N 0 0 379.420 3.415 20 5 GGBDRN O=C(CCSc1ccc(F)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118690459 1413206491 /nfs/dbraw/zinc/20/64/91/1413206491.db2.gz KJZYMNUMFAGRMI-AWEZNQCLSA-N 0 0 390.440 3.324 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118710166 1413209179 /nfs/dbraw/zinc/20/91/79/1413209179.db2.gz VFXGCOYTAHRXIW-INIZCTEOSA-N 0 0 398.246 3.431 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000118710169 1413209295 /nfs/dbraw/zinc/20/92/95/1413209295.db2.gz VFXGCOYTAHRXIW-MRXNPFEDSA-N 0 0 398.246 3.431 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2cnn(-c3ccccc3F)c2C)cc([N+](=O)[O-])c1 ZINC000118723562 1413209954 /nfs/dbraw/zinc/20/99/54/1413209954.db2.gz SQROSCPZANAIBL-UHFFFAOYSA-N 0 0 398.350 3.267 20 5 GGBDRN CC1(C)C(NC(=O)c2cc([N+](=O)[O-])ccc2I)C1(C)C ZINC000118724718 1413210552 /nfs/dbraw/zinc/21/05/52/1413210552.db2.gz QFPPKILPXQODEW-UHFFFAOYSA-N 0 0 388.205 3.364 20 5 GGBDRN O=C(NCCCNc1ccccn1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000118724553 1413210563 /nfs/dbraw/zinc/21/05/63/1413210563.db2.gz AJGIRYIVUBXDSV-UHFFFAOYSA-N 0 0 398.341 3.163 20 5 GGBDRN CC(C)n1c(CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)nc2ccccc21 ZINC000118732877 1413212039 /nfs/dbraw/zinc/21/20/39/1413212039.db2.gz KJNBHAABKZBNQP-UHFFFAOYSA-N 0 0 385.399 3.219 20 5 GGBDRN O=C(NCC[S@@](=O)Cc1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000118792214 1413221112 /nfs/dbraw/zinc/22/11/12/1413221112.db2.gz QPHYUOPDZLCYPI-VWLOTQADSA-N 0 0 381.841 3.319 20 5 GGBDRN Cc1nc(C2(NC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)CCCC2)no1 ZINC000118807884 1413227552 /nfs/dbraw/zinc/22/75/52/1413227552.db2.gz MHIVXWIHJAZXPU-UHFFFAOYSA-N 0 0 397.338 3.479 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000118859512 1413248138 /nfs/dbraw/zinc/24/81/38/1413248138.db2.gz HUQUFMDIHYZSFU-OAHLLOKOSA-N 0 0 397.439 3.197 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1Cl)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866903 1413252587 /nfs/dbraw/zinc/25/25/87/1413252587.db2.gz HDQWQDGWWOHEPI-OLZOCXBDSA-N 0 0 389.843 3.157 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866389 1413252649 /nfs/dbraw/zinc/25/26/49/1413252649.db2.gz LYROTPTWBFINAL-ZDUSSCGKSA-N 0 0 389.843 3.077 20 5 GGBDRN CC[C@@H](CNC(=O)CCn1cc([N+](=O)[O-])nc1C)Oc1ccccc1Cl ZINC000177371568 1428708057 /nfs/dbraw/zinc/70/80/57/1428708057.db2.gz BDHRPKHHMZEBBT-ZDUSSCGKSA-N 0 0 380.832 3.117 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866867 1413253255 /nfs/dbraw/zinc/25/32/55/1413253255.db2.gz CJINUNPQNSJZBB-WFASDCNBSA-N 0 0 389.843 3.157 20 5 GGBDRN C[C@H](c1nnc(-c2cccs2)o1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866724 1413253588 /nfs/dbraw/zinc/25/35/88/1413253588.db2.gz SJCRRRMRUNEEBI-NEPJUHHUSA-N 0 0 386.437 3.349 20 5 GGBDRN CCc1ccc(NC(=O)[C@H](C)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118867155 1413253658 /nfs/dbraw/zinc/25/36/58/1413253658.db2.gz RHYHVMUZAZWXCO-YOEHRIQHSA-N 0 0 383.452 3.066 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1 ZINC000177384117 1428713132 /nfs/dbraw/zinc/71/31/32/1428713132.db2.gz VMOHPHYKJCOGKE-KRWDZBQOSA-N 0 0 397.353 3.113 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000177386349 1428713814 /nfs/dbraw/zinc/71/38/14/1428713814.db2.gz GHYVTZNNEKALKN-SNVBAGLBSA-N 0 0 399.234 3.481 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000177386335 1428713951 /nfs/dbraw/zinc/71/39/51/1428713951.db2.gz GHYVTZNNEKALKN-JTQLQIEISA-N 0 0 399.234 3.481 20 5 GGBDRN C[C@H](NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000118954021 1413272166 /nfs/dbraw/zinc/27/21/66/1413272166.db2.gz AAOSKFYVQIOXNM-KFWWJZLASA-N 0 0 385.468 3.302 20 5 GGBDRN CN(C)c1cccc(CNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)n1 ZINC000118954307 1413272204 /nfs/dbraw/zinc/27/22/04/1413272204.db2.gz CGQIOQPVQFLQJA-UHFFFAOYSA-N 0 0 394.229 3.140 20 5 GGBDRN Cc1ccccc1C1(CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCCCC1 ZINC000118974965 1413285262 /nfs/dbraw/zinc/28/52/62/1413285262.db2.gz PXHWXMDOGMWTEZ-UHFFFAOYSA-N 0 0 383.448 3.083 20 5 GGBDRN O=C(Nc1cnn(-c2ccccc2)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000118974319 1413285733 /nfs/dbraw/zinc/28/57/33/1413285733.db2.gz FMVHPYSOPPLGEU-UHFFFAOYSA-N 0 0 392.419 3.135 20 5 GGBDRN COC(=O)c1sc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)nc1C1CC1 ZINC000118986331 1413290888 /nfs/dbraw/zinc/29/08/88/1413290888.db2.gz YERMAARWIDQUHT-UHFFFAOYSA-N 0 0 375.406 3.205 20 5 GGBDRN CCOc1cc(C(=O)N(C)C)ccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000119010351 1413302392 /nfs/dbraw/zinc/30/23/92/1413302392.db2.gz GXHJPSCXYUQFPL-UHFFFAOYSA-N 0 0 385.420 3.267 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000119031657 1413311262 /nfs/dbraw/zinc/31/12/62/1413311262.db2.gz RBGDPVYAYFVBKR-AEFFLSMTSA-N 0 0 381.432 3.369 20 5 GGBDRN Cc1cc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cnc1Cl ZINC000119035200 1413312485 /nfs/dbraw/zinc/31/24/85/1413312485.db2.gz KCASDEFBBILVJG-UHFFFAOYSA-N 0 0 375.816 3.306 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000119042725 1413314709 /nfs/dbraw/zinc/31/47/09/1413314709.db2.gz YCOCURRAOZHTEJ-QFBILLFUSA-N 0 0 385.420 3.323 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2cc(C)n3nc(C(F)(F)F)nc3n2)c1[N+](=O)[O-] ZINC000119054107 1413318422 /nfs/dbraw/zinc/31/84/22/1413318422.db2.gz SNFLYAKMHKQTRY-UHFFFAOYSA-N 0 0 398.276 3.060 20 5 GGBDRN CCO[C@H]1C[C@H](O)C12CCN(Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)CC2 ZINC000119057394 1413319413 /nfs/dbraw/zinc/31/94/13/1413319413.db2.gz WKWHUNXSSKOVLI-ROUUACIJSA-N 0 0 387.436 3.002 20 5 GGBDRN C[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Oc2ccccc2)cc1 ZINC000119059778 1413320559 /nfs/dbraw/zinc/32/05/59/1413320559.db2.gz SIKNMTJPNMKUBJ-HNNXBMFYSA-N 0 0 393.399 3.426 20 5 GGBDRN O=C(C1CC1)N1CCCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000119082965 1413329437 /nfs/dbraw/zinc/32/94/37/1413329437.db2.gz OJEJMLDQMXPPKL-UHFFFAOYSA-N 0 0 386.477 3.163 20 5 GGBDRN CCS[C@@H](C)c1noc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000119083435 1413330122 /nfs/dbraw/zinc/33/01/22/1413330122.db2.gz DURQLJPWBRKBMD-ZDUSSCGKSA-N 0 0 377.470 3.114 20 5 GGBDRN Cc1cc(C(=O)N[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)cc([N+](=O)[O-])c1 ZINC000177399709 1428718664 /nfs/dbraw/zinc/71/86/64/1428718664.db2.gz JWMJSADWIPOVEK-QGZVFWFLSA-N 0 0 395.337 3.053 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccccc2O)CC1 ZINC000119093977 1413334269 /nfs/dbraw/zinc/33/42/69/1413334269.db2.gz IYVRBBBVEGYMJH-UHFFFAOYSA-N 0 0 387.461 3.375 20 5 GGBDRN COc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119099691 1413335802 /nfs/dbraw/zinc/33/58/02/1413335802.db2.gz QZXFKZIUVKAWMM-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN C[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2)c1 ZINC000119139169 1413352535 /nfs/dbraw/zinc/35/25/35/1413352535.db2.gz WVIRCXHREMUGID-HNNXBMFYSA-N 0 0 389.477 3.376 20 5 GGBDRN C[C@@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2)c1 ZINC000119139273 1413352592 /nfs/dbraw/zinc/35/25/92/1413352592.db2.gz WVIRCXHREMUGID-OAHLLOKOSA-N 0 0 389.477 3.376 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C12CCC2 ZINC000119144154 1413353996 /nfs/dbraw/zinc/35/39/96/1413353996.db2.gz MXQZXOZXLJTCPM-IRXDYDNUSA-N 0 0 377.441 3.093 20 5 GGBDRN CCC(CC)(CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000119159377 1413359550 /nfs/dbraw/zinc/35/95/50/1413359550.db2.gz KKPNWLYDUWRXBY-UHFFFAOYSA-N 0 0 391.855 3.284 20 5 GGBDRN Cn1ccnc1C[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000119179148 1413366774 /nfs/dbraw/zinc/36/67/74/1413366774.db2.gz VCFNPJNCCFZCLY-LBPRGKRZSA-N 0 0 396.369 3.442 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CCCc3c(F)ccc(F)c32)cc([N+](=O)[O-])c1 ZINC000119182146 1413368481 /nfs/dbraw/zinc/36/84/81/1413368481.db2.gz JWDCBTMGSYIRDJ-UHFFFAOYSA-N 0 0 376.315 3.253 20 5 GGBDRN CSCC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000119206976 1413375541 /nfs/dbraw/zinc/37/55/41/1413375541.db2.gz CXPYTNNTNJJHKH-HNNXBMFYSA-N 0 0 389.477 3.051 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000119228615 1413382198 /nfs/dbraw/zinc/38/21/98/1413382198.db2.gz JJTAMQFYEFQIMN-ZIAGYGMSSA-N 0 0 394.435 3.387 20 5 GGBDRN Cc1cc(=O)oc2cc(OCCn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)ccc12 ZINC000119228489 1413382423 /nfs/dbraw/zinc/38/24/23/1413382423.db2.gz MBPXBDBINDBKOB-UHFFFAOYSA-N 0 0 392.371 3.347 20 5 GGBDRN C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1 ZINC000119232711 1413383287 /nfs/dbraw/zinc/38/32/87/1413383287.db2.gz XGJDTEDSQCUTGJ-HNNXBMFYSA-N 0 0 375.469 3.417 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)C(=O)NC(C)(C)C ZINC000119238921 1413386104 /nfs/dbraw/zinc/38/61/04/1413386104.db2.gz XVYOOPPJVJCQJB-AWEZNQCLSA-N 0 0 398.463 3.240 20 5 GGBDRN COC(=O)[C@H](C)[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000177411944 1428724909 /nfs/dbraw/zinc/72/49/09/1428724909.db2.gz LTKWKJODXAMWTO-FZKQIMNGSA-N 0 0 396.403 3.285 20 5 GGBDRN O=C(Nc1cccc(-n2ccnn2)c1)c1cc([N+](=O)[O-])ccc1Br ZINC000119276834 1413397133 /nfs/dbraw/zinc/39/71/33/1413397133.db2.gz YEZQEQVJMABMKZ-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ncc(-c2ccccc2)s1 ZINC000119298898 1413403289 /nfs/dbraw/zinc/40/32/89/1413403289.db2.gz NPMQZSRYNUTJHF-UHFFFAOYSA-N 0 0 382.401 3.087 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000119299024 1413403324 /nfs/dbraw/zinc/40/33/24/1413403324.db2.gz RHGYNPZOLMVBEU-OAHLLOKOSA-N 0 0 380.759 3.422 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCCc2nc3ccccc3n2C(C)C)c1[N+](=O)[O-] ZINC000119301378 1413403978 /nfs/dbraw/zinc/40/39/78/1413403978.db2.gz GLOJSSRNTPUDGN-UHFFFAOYSA-N 0 0 384.440 3.174 20 5 GGBDRN COc1cc(C(=O)Nc2c(C)cnn2-c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000177413271 1428725406 /nfs/dbraw/zinc/72/54/06/1428725406.db2.gz QZSWKFFTWQVUHU-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN COCCN(Cc1ccccc1)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000119312632 1413407993 /nfs/dbraw/zinc/40/79/93/1413407993.db2.gz USWRCLUUKXEVJM-UHFFFAOYSA-N 0 0 378.450 3.049 20 5 GGBDRN CCc1nc2c(s1)[C@H](N(C)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)CCC2 ZINC000119313654 1413408529 /nfs/dbraw/zinc/40/85/29/1413408529.db2.gz NRPOVYWZAGFMQV-CQSZACIVSA-N 0 0 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Cc1c(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)cccc1[N+](=O)[O-] ZINC000120620461 1413857235 /nfs/dbraw/zinc/85/72/35/1413857235.db2.gz BYXDIQRXSVSITO-QGZVFWFLSA-N 0 0 382.420 3.216 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000120622194 1413857779 /nfs/dbraw/zinc/85/77/79/1413857779.db2.gz SXJIWXSHXUXGNC-ZDUSSCGKSA-N 0 0 394.387 3.081 20 5 GGBDRN COc1cc(OCC(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000120629687 1413860091 /nfs/dbraw/zinc/86/00/91/1413860091.db2.gz FWLKITLCMIASIQ-FZMZJTMJSA-N 0 0 394.786 3.447 20 5 GGBDRN Cc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000120643726 1413863745 /nfs/dbraw/zinc/86/37/45/1413863745.db2.gz QQQOXRXUCMUFCB-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000177482847 1428761396 /nfs/dbraw/zinc/76/13/96/1428761396.db2.gz BMLDVQLHEMOWHM-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000120664599 1413869330 /nfs/dbraw/zinc/86/93/30/1413869330.db2.gz UCZMHBXGCIHMCA-IIYDPXPESA-N 0 0 375.450 3.445 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)c(C)c1[N+](=O)[O-] ZINC000120676031 1413872400 /nfs/dbraw/zinc/87/24/00/1413872400.db2.gz VGXIJFCIPGSYQN-RISCZKNCSA-N 0 0 380.807 3.263 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H](Oc2ccncc2)C1 ZINC000120690961 1413876007 /nfs/dbraw/zinc/87/60/07/1413876007.db2.gz UPVWSCTWVBZODI-WFASDCNBSA-N 0 0 391.811 3.090 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H](Oc2ccncc2)C1 ZINC000120691305 1413876049 /nfs/dbraw/zinc/87/60/49/1413876049.db2.gz UPVWSCTWVBZODI-SWLSCSKDSA-N 0 0 391.811 3.090 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000177484377 1428762311 /nfs/dbraw/zinc/76/23/11/1428762311.db2.gz FHAJMGWIWROGKQ-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C(=O)CC(C)C)CC1 ZINC000120705777 1413879815 /nfs/dbraw/zinc/87/98/15/1413879815.db2.gz SSXQQVNKVLIKSA-UHFFFAOYSA-N 0 0 393.509 3.474 20 5 GGBDRN Cc1cccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)CC2)c1 ZINC000120709023 1413880866 /nfs/dbraw/zinc/88/08/66/1413880866.db2.gz MDMOERMFJWJUOW-UHFFFAOYSA-N 0 0 390.443 3.409 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000120730209 1413887262 /nfs/dbraw/zinc/88/72/62/1413887262.db2.gz LMUSVQXFUCSSCH-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN CN(C)[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000120732959 1413887512 /nfs/dbraw/zinc/88/75/12/1413887512.db2.gz OZCSEVWITOVVSL-KRWDZBQOSA-N 0 0 392.406 3.018 20 5 GGBDRN O=C(NCc1nncn1-c1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120741198 1413889707 /nfs/dbraw/zinc/88/97/07/1413889707.db2.gz MGCHUYGHAFMXPS-UHFFFAOYSA-N 0 0 392.419 3.050 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])o1 ZINC000120745851 1413891100 /nfs/dbraw/zinc/89/11/00/1413891100.db2.gz FYCFZGIOTKYVFG-INIZCTEOSA-N 0 0 394.449 3.129 20 5 GGBDRN O=C(NCCc1cn2c(n1)CCCC2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120744802 1413891336 /nfs/dbraw/zinc/89/13/36/1413891336.db2.gz UDQFLVFEQHJEQS-UHFFFAOYSA-N 0 0 383.452 3.044 20 5 GGBDRN COc1cc(C(=O)N(C)C)ccc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000177486983 1428763504 /nfs/dbraw/zinc/76/35/04/1428763504.db2.gz PLXPMAKKTIRFSY-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN COc1ccc(OCCN(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000120752282 1413892495 /nfs/dbraw/zinc/89/24/95/1413892495.db2.gz VPNJKLJLEWUJTC-UHFFFAOYSA-N 0 0 381.388 3.303 20 5 GGBDRN Cc1c(NC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)cccc1[N+](=O)[O-] ZINC000120755126 1413893664 /nfs/dbraw/zinc/89/36/64/1413893664.db2.gz NKECWWBOAIVOMM-OAHLLOKOSA-N 0 0 386.383 3.359 20 5 GGBDRN O=C(c1ccccc1COC1CCOCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000120767032 1413896782 /nfs/dbraw/zinc/89/67/82/1413896782.db2.gz STCRWYKSKDWCFA-UHFFFAOYSA-N 0 0 382.416 3.493 20 5 GGBDRN COc1ccccc1COC[C@H](O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000120765922 1413896809 /nfs/dbraw/zinc/89/68/09/1413896809.db2.gz BTQWBPVYWLGIQW-QGZVFWFLSA-N 0 0 394.855 3.266 20 5 GGBDRN CC(C)(CO)[C@H](CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])c1ccccc1 ZINC000120768539 1413897246 /nfs/dbraw/zinc/89/72/46/1413897246.db2.gz TUBZKOCQEIAXHB-OAHLLOKOSA-N 0 0 382.420 3.046 20 5 GGBDRN COc1ccc(COCc2cccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])c2)cc1 ZINC000120780563 1413900718 /nfs/dbraw/zinc/90/07/18/1413900718.db2.gz KREBTUMBIMUVLA-UHFFFAOYSA-N 0 0 382.376 3.296 20 5 GGBDRN O=C(CN1CCC(OCC2CCCC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000177487836 1428764202 /nfs/dbraw/zinc/76/42/02/1428764202.db2.gz AICJVRNSRQPBBW-UHFFFAOYSA-N 0 0 387.480 3.155 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2F)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000120797899 1413905848 /nfs/dbraw/zinc/90/58/48/1413905848.db2.gz OPXSWOIEKWJHIR-ZDUSSCGKSA-N 0 0 388.355 3.041 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c1)n1cccn1 ZINC000120802227 1413907748 /nfs/dbraw/zinc/90/77/48/1413907748.db2.gz NNDGGQMHTVUYMJ-LBPRGKRZSA-N 0 0 397.366 3.382 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC1(Cc2ccccc2)CCC1 ZINC000120804983 1413908264 /nfs/dbraw/zinc/90/82/64/1413908264.db2.gz JYHXVYGXLSSJIO-UHFFFAOYSA-N 0 0 381.432 3.371 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCN(Cc2cccs2)CC1 ZINC000120804731 1413908586 /nfs/dbraw/zinc/90/85/86/1413908586.db2.gz LSIOZGWPCQWEIU-UHFFFAOYSA-N 0 0 382.445 3.163 20 5 GGBDRN C[C@@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](c2ccsc2)O1 ZINC000120810849 1413910514 /nfs/dbraw/zinc/91/05/14/1413910514.db2.gz BNEWBIZGNVTSDM-FSPWUOQZSA-N 0 0 387.461 3.224 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000120813165 1413911597 /nfs/dbraw/zinc/91/15/97/1413911597.db2.gz BEWLQEOEAXNZDE-UHFFFAOYSA-N 0 0 397.840 3.059 20 5 GGBDRN O=C1[C@@H](N2CCC(OCC3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000177489736 1428765178 /nfs/dbraw/zinc/76/51/78/1428765178.db2.gz RFPXJUWSRFAADZ-FQEVSTJZSA-N 0 0 387.480 3.371 20 5 GGBDRN C[C@@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](c2ccsc2)O1 ZINC000120821968 1413915275 /nfs/dbraw/zinc/91/52/75/1413915275.db2.gz IYMWOTDQLISFDU-FZKQIMNGSA-N 0 0 387.461 3.007 20 5 GGBDRN C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccsc2)O1 ZINC000120837392 1413920886 /nfs/dbraw/zinc/92/08/86/1413920886.db2.gz WWEJGBMFYRFVKK-CXAGYDPISA-N 0 0 375.450 3.447 20 5 GGBDRN CCCOc1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000120838507 1413921970 /nfs/dbraw/zinc/92/19/70/1413921970.db2.gz YBLYQOLBWDBIAP-UHFFFAOYSA-N 0 0 391.811 3.292 20 5 GGBDRN O=Cc1ccc(OCC(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000120842500 1413923263 /nfs/dbraw/zinc/92/32/63/1413923263.db2.gz YTVBAHGLTFRYIT-QZTJIDSGSA-N 0 0 382.416 3.314 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000120863875 1413930601 /nfs/dbraw/zinc/93/06/01/1413930601.db2.gz KPUVYAYMXYNYAF-DYVFJYSZSA-N 0 0 375.450 3.365 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1ccc2[nH]ccc2c1 ZINC000120865475 1413930971 /nfs/dbraw/zinc/93/09/71/1413930971.db2.gz DXVRHKMWECQGBD-UHFFFAOYSA-N 0 0 380.404 3.452 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1ccccc1F ZINC000120866348 1413931143 /nfs/dbraw/zinc/93/11/43/1413931143.db2.gz GGSHDKKZGUCVDM-GOSISDBHSA-N 0 0 375.400 3.089 20 5 GGBDRN C[C@@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H](c2ccsc2)O1 ZINC000120865738 1413931203 /nfs/dbraw/zinc/93/12/03/1413931203.db2.gz ZYSVDQOVRLAZBE-SJKOYZFVSA-N 0 0 376.434 3.485 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1ccc(N(C)C)cc1 ZINC000120867752 1413931896 /nfs/dbraw/zinc/93/18/96/1413931896.db2.gz WLAGHHUYNXVNJH-UHFFFAOYSA-N 0 0 384.436 3.037 20 5 GGBDRN Cc1ccc2c(c1)N(C(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)CC2 ZINC000120869563 1413932289 /nfs/dbraw/zinc/93/22/89/1413932289.db2.gz VISOOKXTEAQCNC-UHFFFAOYSA-N 0 0 381.432 3.230 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1ccc(F)c(F)c1 ZINC000120872342 1413932840 /nfs/dbraw/zinc/93/28/40/1413932840.db2.gz IWOSLXLFONNCEY-UHFFFAOYSA-N 0 0 377.347 3.249 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1cccc(F)c1 ZINC000120873237 1413933548 /nfs/dbraw/zinc/93/35/48/1413933548.db2.gz LYGXFEONKRZJAN-GOSISDBHSA-N 0 0 375.400 3.089 20 5 GGBDRN Nc1c(C(=O)N2CCN(c3ccc(F)cc3Cl)CC2)cc(F)cc1[N+](=O)[O-] ZINC000120877691 1413934916 /nfs/dbraw/zinc/93/49/16/1413934916.db2.gz ZDWYQYDAIMKUHS-UHFFFAOYSA-N 0 0 396.781 3.071 20 5 GGBDRN COCc1ccccc1NC(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000120877730 1413934998 /nfs/dbraw/zinc/93/49/98/1413934998.db2.gz HKRHDVPUBDYDGE-UHFFFAOYSA-N 0 0 385.420 3.117 20 5 GGBDRN Cc1ccnc(N2CCN(Cc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000120885336 1413937619 /nfs/dbraw/zinc/93/76/19/1413937619.db2.gz RJGKGIIANHYDIE-UHFFFAOYSA-N 0 0 392.463 3.021 20 5 GGBDRN CCc1cccc2c1N(C(=O)c1cn(-c3cccc([N+](=O)[O-])c3)nn1)CCC2 ZINC000120886434 1413937995 /nfs/dbraw/zinc/93/79/95/1413937995.db2.gz RLOILNVUKUJFGH-UHFFFAOYSA-N 0 0 377.404 3.331 20 5 GGBDRN O=C(Cc1ccc(F)c(F)c1)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000120887705 1413938029 /nfs/dbraw/zinc/93/80/29/1413938029.db2.gz OZUZHEQCNLRDNJ-UHFFFAOYSA-N 0 0 391.374 3.270 20 5 GGBDRN O=C(Cc1ccc(F)cc1F)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000120888965 1413938671 /nfs/dbraw/zinc/93/86/71/1413938671.db2.gz QVEYRRNBWOVJNB-UHFFFAOYSA-N 0 0 391.374 3.270 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCCCOC1CCCCC1 ZINC000120888740 1413938748 /nfs/dbraw/zinc/93/87/48/1413938748.db2.gz FGGYDVSYRVPFHQ-UHFFFAOYSA-N 0 0 377.441 3.006 20 5 GGBDRN O=C(COC(=O)c1csc(Cc2ccccc2)n1)Nc1cccc([N+](=O)[O-])c1 ZINC000120900121 1413942507 /nfs/dbraw/zinc/94/25/07/1413942507.db2.gz HNKOWUWFTCGAFF-UHFFFAOYSA-N 0 0 397.412 3.438 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccccc1OC(F)F ZINC000120910271 1413944815 /nfs/dbraw/zinc/94/48/15/1413944815.db2.gz XUSPODBUGIRSIL-UHFFFAOYSA-N 0 0 393.346 3.068 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000120914025 1413946706 /nfs/dbraw/zinc/94/67/06/1413946706.db2.gz HCISENWCQRLPEH-VXGBXAGGSA-N 0 0 387.358 3.387 20 5 GGBDRN Cc1cnc([C@H](NS(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C2CC2)s1 ZINC000120944526 1413955314 /nfs/dbraw/zinc/95/53/14/1413955314.db2.gz IRPYQRKJHCTFDR-CQSZACIVSA-N 0 0 385.442 3.237 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccn(Cc2ccc(F)cc2)c1=O ZINC000120957971 1413959839 /nfs/dbraw/zinc/95/98/39/1413959839.db2.gz BFPYAPLICVJWII-UHFFFAOYSA-N 0 0 381.363 3.125 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1[N+](=O)[O-] ZINC000177496232 1428769183 /nfs/dbraw/zinc/76/91/83/1428769183.db2.gz SRWFSVMLRZHYSU-GJZGRUSLSA-N 0 0 385.420 3.395 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000120965816 1413962724 /nfs/dbraw/zinc/96/27/24/1413962724.db2.gz KVCIEFUKWJIZHL-NSHDSACASA-N 0 0 375.816 3.264 20 5 GGBDRN O=C([C@H]1CC(=O)N(c2ccccc2F)C1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000120974708 1413965233 /nfs/dbraw/zinc/96/52/33/1413965233.db2.gz OPAKEBORVBULPS-AWEZNQCLSA-N 0 0 383.379 3.066 20 5 GGBDRN Cc1nc([C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c2ccccc2F)no1 ZINC000120996820 1413972134 /nfs/dbraw/zinc/97/21/34/1413972134.db2.gz ANVAKBMNBSHKSE-KRWDZBQOSA-N 0 0 399.382 3.057 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCC1(c2ccc(F)cc2)CC1 ZINC000121006165 1413974886 /nfs/dbraw/zinc/97/48/86/1413974886.db2.gz CNUBKFABZBGMOH-UHFFFAOYSA-N 0 0 385.395 3.137 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ncc(-c2ccccc2)o1 ZINC000121009878 1413976105 /nfs/dbraw/zinc/97/61/05/1413976105.db2.gz QHSDONVROHAHGL-UHFFFAOYSA-N 0 0 394.387 3.122 20 5 GGBDRN COc1cc(C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)ccc1[N+](=O)[O-] ZINC000121016235 1413977905 /nfs/dbraw/zinc/97/79/05/1413977905.db2.gz SMEOLHKZIWASPF-UHFFFAOYSA-N 0 0 397.362 3.205 20 5 GGBDRN CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000121020517 1413979090 /nfs/dbraw/zinc/97/90/90/1413979090.db2.gz ZTGGUMVGTTWJCL-UHFFFAOYSA-N 0 0 384.392 3.382 20 5 GGBDRN O=C(Nc1cccn(Cc2ccc(F)cc2)c1=O)c1ccc([N+](=O)[O-])cc1F ZINC000121024014 1413980437 /nfs/dbraw/zinc/98/04/37/1413980437.db2.gz LHABYDQDZUIPCX-UHFFFAOYSA-N 0 0 385.326 3.335 20 5 GGBDRN COc1ccc(-c2noc(CCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000121030194 1413982738 /nfs/dbraw/zinc/98/27/38/1413982738.db2.gz XRGDXHAOTQIYSE-UHFFFAOYSA-N 0 0 382.376 3.249 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000121050424 1413989228 /nfs/dbraw/zinc/98/92/28/1413989228.db2.gz UANZMODGXLVLIK-YVEFUNNKSA-N 0 0 391.449 3.065 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000121054271 1413990182 /nfs/dbraw/zinc/99/01/82/1413990182.db2.gz VTXFBPBVWXPTCS-LLVKDONJSA-N 0 0 375.816 3.264 20 5 GGBDRN CCOc1ccc(CN(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000121057198 1413991686 /nfs/dbraw/zinc/99/16/86/1413991686.db2.gz LNPMJTJXEVPCCV-UHFFFAOYSA-N 0 0 385.420 3.207 20 5 GGBDRN O=C(c1ccccc1)N1CCC[C@H](C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000121065883 1413994746 /nfs/dbraw/zinc/99/47/46/1413994746.db2.gz WHVJAKGMUHWWJV-SFHVURJKSA-N 0 0 393.443 3.426 20 5 GGBDRN Cc1nc(COc2cccc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)c2)no1 ZINC000121067783 1413995275 /nfs/dbraw/zinc/99/52/75/1413995275.db2.gz NIWBYUZMDOZBJH-UHFFFAOYSA-N 0 0 380.360 3.068 20 5 GGBDRN O=c1cc(-c2nc(COc3ccc(F)cc3)no2)c2cc([N+](=O)[O-])ccc2[nH]1 ZINC000121072093 1413997094 /nfs/dbraw/zinc/99/70/94/1413997094.db2.gz AMHUQATVZCZFJK-UHFFFAOYSA-N 0 0 382.307 3.204 20 5 GGBDRN Cc1nn(CN2CCC(NC(=O)c3ccccc3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121074514 1413997531 /nfs/dbraw/zinc/99/75/31/1413997531.db2.gz NNMDUSVQFLVZQO-UHFFFAOYSA-N 0 0 393.447 3.105 20 5 GGBDRN C[C@@H](c1cn(-c2ccccc2)nn1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000121079095 1413999646 /nfs/dbraw/zinc/99/96/46/1413999646.db2.gz PZSUNUIHWBRGRG-INIZCTEOSA-N 0 0 378.436 3.059 20 5 GGBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCC3(CCCC3)C2)ccc1Br ZINC000121081919 1414000742 /nfs/dbraw/zinc/00/07/42/1414000742.db2.gz UUXZOPNAMVCFRB-UHFFFAOYSA-N 0 0 389.271 3.312 20 5 GGBDRN COCCOc1cc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)nc2ccccc21 ZINC000121082928 1414001572 /nfs/dbraw/zinc/00/15/72/1414001572.db2.gz VAQJMYVIPRDGLN-UHFFFAOYSA-N 0 0 381.388 3.445 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)c1ccncc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000121085515 1414001966 /nfs/dbraw/zinc/00/19/66/1414001966.db2.gz GCEURBRFMLCMMA-SFHVURJKSA-N 0 0 378.344 3.417 20 5 GGBDRN COc1ccc([C@@H](C)N(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000121093775 1414005533 /nfs/dbraw/zinc/00/55/33/1414005533.db2.gz HGUJKAOBWFLIRD-CQSZACIVSA-N 0 0 385.420 3.378 20 5 GGBDRN CO[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000121095984 1414006070 /nfs/dbraw/zinc/00/60/70/1414006070.db2.gz XADXPDOSVQLQPD-QGZVFWFLSA-N 0 0 377.828 3.478 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)ccc1Cl ZINC000121096906 1414006768 /nfs/dbraw/zinc/00/67/68/1414006768.db2.gz XFMFRBQSWZKJSU-UHFFFAOYSA-N 0 0 393.852 3.216 20 5 GGBDRN CCOc1cc(NC(=O)CCc2cnn(C)c2C)c([N+](=O)[O-])cc1OCC ZINC000121112389 1414011759 /nfs/dbraw/zinc/01/17/59/1414011759.db2.gz TUIWVVZGQQVQEV-UHFFFAOYSA-N 0 0 376.413 3.005 20 5 GGBDRN C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](c2ccsc2)O1 ZINC000121114123 1414012355 /nfs/dbraw/zinc/01/23/55/1414012355.db2.gz PVJQZRRMEOVSKR-CXAGYDPISA-N 0 0 375.450 3.447 20 5 GGBDRN COc1ccc(OC)c(CCCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000121113608 1414012491 /nfs/dbraw/zinc/01/24/91/1414012491.db2.gz QHCSYBOJYBHFQO-UHFFFAOYSA-N 0 0 397.431 3.385 20 5 GGBDRN CN(C)c1ccc(Cl)cc1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000121115495 1414012864 /nfs/dbraw/zinc/01/28/64/1414012864.db2.gz KBEIPKVZUQHCKY-UHFFFAOYSA-N 0 0 386.799 3.147 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CC=C(c2ccc(O)cc2)CC1 ZINC000121118852 1414014360 /nfs/dbraw/zinc/01/43/60/1414014360.db2.gz YEYAIMICGYMJEM-UHFFFAOYSA-N 0 0 395.415 3.172 20 5 GGBDRN O=C(Oc1ccc(N2CCCC2=O)cc1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000121127860 1414017561 /nfs/dbraw/zinc/01/75/61/1414017561.db2.gz BDEBBDJASPYCPC-UHFFFAOYSA-N 0 0 377.356 3.489 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C12CCCCC2 ZINC000121127087 1414017624 /nfs/dbraw/zinc/01/76/24/1414017624.db2.gz VVNBRBOSIWZAMB-SJORKVTESA-N 0 0 389.452 3.120 20 5 GGBDRN COC(=O)c1ccccc1N(C)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000121138002 1414020912 /nfs/dbraw/zinc/02/09/12/1414020912.db2.gz JSOPPBBUGDANIJ-UHFFFAOYSA-N 0 0 393.193 3.421 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000121142542 1414022800 /nfs/dbraw/zinc/02/28/00/1414022800.db2.gz NCEWQVQDDRLBAV-DYVFJYSZSA-N 0 0 375.450 3.365 20 5 GGBDRN COc1ccc(OC)c(CCCNC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000121142051 1414022921 /nfs/dbraw/zinc/02/29/21/1414022921.db2.gz KEDNSLDZGRQIRH-UHFFFAOYSA-N 0 0 376.384 3.422 20 5 GGBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000121145646 1414023964 /nfs/dbraw/zinc/02/39/64/1414023964.db2.gz UTIKMRHMKPUVMM-IIYDPXPESA-N 0 0 375.450 3.445 20 5 GGBDRN COc1ccc(NC(=O)NCCn2cc([N+](=O)[O-])cn2)cc1Cc1ccccc1 ZINC000121159550 1414028286 /nfs/dbraw/zinc/02/82/86/1414028286.db2.gz XYTSEKVGAVWNGD-UHFFFAOYSA-N 0 0 395.419 3.212 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000121161083 1414029717 /nfs/dbraw/zinc/02/97/17/1414029717.db2.gz CKQAUOHKKIUNQA-UHFFFAOYSA-N 0 0 396.447 3.007 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCc1ccccc1OC(C)C ZINC000121168977 1414031303 /nfs/dbraw/zinc/03/13/03/1414031303.db2.gz IMAZXBLXKIRROK-UHFFFAOYSA-N 0 0 385.420 3.254 20 5 GGBDRN Cc1cccc(OC[C@H](C)NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000121189472 1414039004 /nfs/dbraw/zinc/03/90/04/1414039004.db2.gz ACUJMNFOYMBFIW-AWEZNQCLSA-N 0 0 385.420 3.042 20 5 GGBDRN CS(=O)(=O)c1ccccc1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000121193765 1414040198 /nfs/dbraw/zinc/04/01/98/1414040198.db2.gz LRPMISZYPGSVAZ-UHFFFAOYSA-N 0 0 389.433 3.195 20 5 GGBDRN O=C(NCc1ccccc1Cn1cccn1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000121233934 1414052908 /nfs/dbraw/zinc/05/29/08/1414052908.db2.gz WFPNXWSMFCGKTN-UHFFFAOYSA-N 0 0 387.399 3.318 20 5 GGBDRN Cc1nn(CN2CC[C@@H](N(C)C(=O)OC(C)(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121245143 1414056983 /nfs/dbraw/zinc/05/69/83/1414056983.db2.gz ILUBKCMMDIPINN-OAHLLOKOSA-N 0 0 389.456 3.152 20 5 GGBDRN O=C(COc1cc(Cl)ccc1[N+](=O)[O-])NC[C@@H]1CCN(c2ccccc2)C1 ZINC000121249862 1414058609 /nfs/dbraw/zinc/05/86/09/1414058609.db2.gz YSEFPZCZSPVHSN-AWEZNQCLSA-N 0 0 389.839 3.270 20 5 GGBDRN COc1cc(N[C@@H]2CCCN(C(=O)c3ccccc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000121265710 1414064806 /nfs/dbraw/zinc/06/48/06/1414064806.db2.gz DYCAQVNHOPQDRI-CQSZACIVSA-N 0 0 385.420 3.329 20 5 GGBDRN CCS[C@@H](C)c1noc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000121283775 1414070667 /nfs/dbraw/zinc/07/06/67/1414070667.db2.gz DJYSXYNLBIPKKE-ZDUSSCGKSA-N 0 0 377.470 3.114 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccnc1-n1cccn1 ZINC000121283459 1414070714 /nfs/dbraw/zinc/07/07/14/1414070714.db2.gz NZKROUAZCBYIQP-UHFFFAOYSA-N 0 0 375.291 3.029 20 5 GGBDRN O=C(N[C@H]1CCC[C@@H]1Cc1ccccc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000121283781 1414070739 /nfs/dbraw/zinc/07/07/39/1414070739.db2.gz GKSJJCLBUBLRFI-AEFFLSMTSA-N 0 0 391.431 3.317 20 5 GGBDRN O=C(N[C@H]1CCC[C@H]1Cc1ccccc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000121283607 1414070916 /nfs/dbraw/zinc/07/09/16/1414070916.db2.gz GKSJJCLBUBLRFI-WMZOPIPTSA-N 0 0 391.431 3.317 20 5 GGBDRN C[C@H](c1ccccc1)N1C[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000121285087 1414071351 /nfs/dbraw/zinc/07/13/51/1414071351.db2.gz PKQKUQOBEURUBB-PBHICJAKSA-N 0 0 379.416 3.094 20 5 GGBDRN C[C@]1(c2ccccc2)CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000121286312 1414071799 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VVNXNMIRANCNRA-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN CCc1cccc(NC(=O)CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000121318282 1414082080 /nfs/dbraw/zinc/08/20/80/1414082080.db2.gz KUZPEVVUOYHYDI-UHFFFAOYSA-N 0 0 396.447 3.470 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCO[C@@](C)(c2ccccc2)C1 ZINC000121320756 1414082434 /nfs/dbraw/zinc/08/24/34/1414082434.db2.gz BRMINOQTJNCUQR-YCRPNKLZSA-N 0 0 399.447 3.178 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000121327567 1414084317 /nfs/dbraw/zinc/08/43/17/1414084317.db2.gz OTRQYMMFUMGISX-HNNXBMFYSA-N 0 0 387.411 3.246 20 5 GGBDRN CC(C)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1 ZINC000121330014 1414084974 /nfs/dbraw/zinc/08/49/74/1414084974.db2.gz RPUOORSUZJFVBO-MRXNPFEDSA-N 0 0 377.828 3.314 20 5 GGBDRN CC(C)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1 ZINC000121329873 1414085172 /nfs/dbraw/zinc/08/51/72/1414085172.db2.gz RPUOORSUZJFVBO-INIZCTEOSA-N 0 0 377.828 3.314 20 5 GGBDRN CCOc1ccccc1N(C)C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000121340068 1414087719 /nfs/dbraw/zinc/08/77/19/1414087719.db2.gz BDJFJXIWIBMXDC-UHFFFAOYSA-N 0 0 381.392 3.159 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N(C[C@H]1CCCO1)C1CCCC1 ZINC000121353878 1414092444 /nfs/dbraw/zinc/09/24/44/1414092444.db2.gz YDXHLXVMWOAVEJ-CQSZACIVSA-N 0 0 395.843 3.137 20 5 GGBDRN COc1cc(S(=O)(=O)Nc2ccc(N(C)C)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000121354645 1414092678 /nfs/dbraw/zinc/09/26/78/1414092678.db2.gz DATSPOLHFPUKME-UHFFFAOYSA-N 0 0 385.829 3.124 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000121365224 1414095821 /nfs/dbraw/zinc/09/58/21/1414095821.db2.gz QRFSSPCIUULCKB-WBVHZDCISA-N 0 0 395.415 3.030 20 5 GGBDRN CCc1ccc(S(C)(=O)=O)cc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000121365363 1414096307 /nfs/dbraw/zinc/09/63/07/1414096307.db2.gz HRHAMMVKRNKXIV-UHFFFAOYSA-N 0 0 384.360 3.091 20 5 GGBDRN C[C@H](N(C)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1)C1(C)CC1 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C[C@@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C(=O)N1CCCC[C@@H]1C ZINC000121695337 1414226665 /nfs/dbraw/zinc/22/66/65/1414226665.db2.gz ZNCNDZPXLFSBAU-LSDHHAIUSA-N 0 0 388.468 3.058 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1nc2c(ccc3ccccc23)s1 ZINC000121698913 1414228192 /nfs/dbraw/zinc/22/81/92/1414228192.db2.gz WTPBFHACZXCLQK-UHFFFAOYSA-N 0 0 380.385 3.158 20 5 GGBDRN C[C@@]1(c2ccccc2)CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000121701944 1414229480 /nfs/dbraw/zinc/22/94/80/1414229480.db2.gz MHVAYXJNTYOUQD-IBGZPJMESA-N 0 0 389.839 3.434 20 5 GGBDRN Cc1cccc(C)c1CNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000121702339 1414229500 /nfs/dbraw/zinc/22/95/00/1414229500.db2.gz FGZPIAGJBCGGKF-HNNXBMFYSA-N 0 0 387.461 3.194 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000121719598 1414235288 /nfs/dbraw/zinc/23/52/88/1414235288.db2.gz NVJQJUMMNSYASR-HXUWFJFHSA-N 0 0 380.379 3.447 20 5 GGBDRN Cc1ccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)c(O[C@H]2CCOC2)c1 ZINC000121768320 1414250921 /nfs/dbraw/zinc/25/09/21/1414250921.db2.gz QXZOBKZLCWQYOF-SFHVURJKSA-N 0 0 385.420 3.070 20 5 GGBDRN Cc1cc(C)c(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c(C)c1 ZINC000121771885 1414252525 /nfs/dbraw/zinc/25/25/25/1414252525.db2.gz WOVJAYYHUFWGJP-UHFFFAOYSA-N 0 0 387.461 3.180 20 5 GGBDRN C[C@@H](CC(=O)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccncc1 ZINC000121778168 1414254174 /nfs/dbraw/zinc/25/41/74/1414254174.db2.gz NQKBYGICOHNASL-HNNXBMFYSA-N 0 0 384.436 3.338 20 5 GGBDRN Cc1c(C(=O)Nc2ccccc2C(=O)NC2CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000121786974 1414256980 /nfs/dbraw/zinc/25/69/80/1414256980.db2.gz DONUJZFJKHPJOH-UHFFFAOYSA-N 0 0 398.375 3.264 20 5 GGBDRN O=C(Nc1ccc2[nH]c(=S)[nH]c2c1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000121788802 1414257455 /nfs/dbraw/zinc/25/74/55/1414257455.db2.gz DHCCVUIXFBWCAD-UHFFFAOYSA-N 0 0 380.389 3.198 20 5 GGBDRN C[C@]1(c2ccccc2)CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCO1 ZINC000121790531 1414258146 /nfs/dbraw/zinc/25/81/46/1414258146.db2.gz LQFLASNLCAMFHL-HXUWFJFHSA-N 0 0 380.404 3.392 20 5 GGBDRN COc1cccc(Br)c1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000121804664 1414263134 /nfs/dbraw/zinc/26/31/34/1414263134.db2.gz TZBSKEYYCHCAGZ-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCc1ccccc1[N+](=O)[O-] ZINC000121822215 1414269613 /nfs/dbraw/zinc/26/96/13/1414269613.db2.gz ZXMDQGAWNZIRKR-UHFFFAOYSA-N 0 0 394.181 3.124 20 5 GGBDRN Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 ZINC000121831446 1414271941 /nfs/dbraw/zinc/27/19/41/1414271941.db2.gz SPDGJKVLUIKQEY-LSDHHAIUSA-N 0 0 395.415 3.216 20 5 GGBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000121848032 1414277493 /nfs/dbraw/zinc/27/74/93/1414277493.db2.gz VUMUYVZHSQKROE-ZFWWWQNUSA-N 0 0 379.482 3.331 20 5 GGBDRN CN1CCO[C@@H]([C@H](NCc2ccccc2[N+](=O)[O-])c2ccc(Cl)cc2)C1 ZINC000121854209 1414278998 /nfs/dbraw/zinc/27/89/98/1414278998.db2.gz JARNHHOJPKQMRK-RTBURBONSA-N 0 0 375.856 3.410 20 5 GGBDRN O=C(NCc1ccccc1)c1nnc(COc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000121870354 1414285563 /nfs/dbraw/zinc/28/55/63/1414285563.db2.gz VAVIGYWYMVQNEQ-UHFFFAOYSA-N 0 0 388.380 3.094 20 5 GGBDRN O=C(CN1CCCCC[C@@H]1C[C@H](O)c1ccco1)Nc1ccccc1[N+](=O)[O-] ZINC000121875532 1414287159 /nfs/dbraw/zinc/28/71/59/1414287159.db2.gz FBXPRABGBVPGKR-QAPCUYQASA-N 0 0 387.436 3.495 20 5 GGBDRN Cc1cc(C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)cc([N+](=O)[O-])c1 ZINC000121881898 1414289837 /nfs/dbraw/zinc/28/98/37/1414289837.db2.gz BZFFZGXBDIDAFF-UHFFFAOYSA-N 0 0 391.449 3.232 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-] ZINC000177565696 1428795955 /nfs/dbraw/zinc/79/59/55/1428795955.db2.gz ORBAGRGEEFJWIA-IBGZPJMESA-N 0 0 390.399 3.143 20 5 GGBDRN CC(=O)C[C@@H]1COCCN1C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000121897729 1414297151 /nfs/dbraw/zinc/29/71/51/1414297151.db2.gz XHLJIMYTHQHKMU-GOSISDBHSA-N 0 0 397.431 3.027 20 5 GGBDRN O=C(OCc1cc([N+](=O)[O-])ccc1Cl)c1cn(Cc2cccc(F)c2)nn1 ZINC000121902230 1414299690 /nfs/dbraw/zinc/29/96/90/1414299690.db2.gz ZESIADNUOOIXOI-UHFFFAOYSA-N 0 0 390.758 3.384 20 5 GGBDRN CC(=O)c1ccc(N2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)c(F)c1 ZINC000121907360 1414302186 /nfs/dbraw/zinc/30/21/86/1414302186.db2.gz POQAJZCKSZJCKJ-UHFFFAOYSA-N 0 0 385.395 3.207 20 5 GGBDRN CSCC[C@@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000121907978 1414302634 /nfs/dbraw/zinc/30/26/34/1414302634.db2.gz RTHJDKKWSPEPRA-OAHLLOKOSA-N 0 0 385.449 3.170 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1cccc(CN2CCCC2=O)c1 ZINC000121909375 1414302994 /nfs/dbraw/zinc/30/29/94/1414302994.db2.gz FAEQJKUWSYBQBG-UHFFFAOYSA-N 0 0 399.472 3.126 20 5 GGBDRN COc1ccccc1[C@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1)c1nccn1C ZINC000121910202 1414303668 /nfs/dbraw/zinc/30/36/68/1414303668.db2.gz AIAZCWWVEJHZRZ-SFHVURJKSA-N 0 0 380.404 3.165 20 5 GGBDRN CCOc1ccc(CN2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)cc1 ZINC000121914546 1414304906 /nfs/dbraw/zinc/30/49/06/1414304906.db2.gz GDNQFWVQQJRXFF-UHFFFAOYSA-N 0 0 383.448 3.260 20 5 GGBDRN CCOCCCNC(=O)c1cccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 ZINC000121918728 1414306920 /nfs/dbraw/zinc/30/69/20/1414306920.db2.gz GPHFZLOPDPKEFG-UHFFFAOYSA-N 0 0 389.383 3.143 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc1[N+](=O)[O-] ZINC000121933131 1414312587 /nfs/dbraw/zinc/31/25/87/1414312587.db2.gz YYFLVYQUGGJCSK-DZGCQCFKSA-N 0 0 387.415 3.076 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1[N+](=O)[O-] ZINC000121933285 1414313071 /nfs/dbraw/zinc/31/30/71/1414313071.db2.gz YYFLVYQUGGJCSK-HIFRSBDPSA-N 0 0 387.415 3.076 20 5 GGBDRN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000121940252 1414315789 /nfs/dbraw/zinc/31/57/89/1414315789.db2.gz KQAAOPUEGDMPJZ-FQEVSTJZSA-N 0 0 377.400 3.448 20 5 GGBDRN COc1cc(OCC(=O)NCc2csc(-c3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000121946542 1414318526 /nfs/dbraw/zinc/31/85/26/1414318526.db2.gz KEPGOAVEJKTPQS-UHFFFAOYSA-N 0 0 399.428 3.422 20 5 GGBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000121948705 1414319344 /nfs/dbraw/zinc/31/93/44/1414319344.db2.gz APRYYJSNJRAQPG-CQSZACIVSA-N 0 0 397.431 3.222 20 5 GGBDRN Cc1cc(C(=O)N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc([N+](=O)[O-])c1 ZINC000121950325 1414319677 /nfs/dbraw/zinc/31/96/77/1414319677.db2.gz BTXBFFXTUFJGNR-ZDUSSCGKSA-N 0 0 376.434 3.140 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000121950112 1414319913 /nfs/dbraw/zinc/31/99/13/1414319913.db2.gz QWTXAYYQNSCJKG-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN Cc1ccc(Oc2ccc(NC(=O)NCCn3cc([N+](=O)[O-])cn3)cn2)cc1C ZINC000121950728 1414320713 /nfs/dbraw/zinc/32/07/13/1414320713.db2.gz DHURERBBGAOYBQ-UHFFFAOYSA-N 0 0 396.407 3.417 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000121954271 1414321920 /nfs/dbraw/zinc/32/19/20/1414321920.db2.gz LVVFPUHOGJNXAV-UHFFFAOYSA-N 0 0 396.447 3.422 20 5 GGBDRN Cc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000121964146 1414325507 /nfs/dbraw/zinc/32/55/07/1414325507.db2.gz DXGAPVYQOYMAEH-UHFFFAOYSA-N 0 0 386.320 3.231 20 5 GGBDRN COc1ccc(CNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1Cl ZINC000121980349 1414330329 /nfs/dbraw/zinc/33/03/29/1414330329.db2.gz LNGMDAJHAXJVIG-UHFFFAOYSA-N 0 0 391.811 3.129 20 5 GGBDRN COc1cccc2c1CC[C@@H]2NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000121995157 1414334655 /nfs/dbraw/zinc/33/46/55/1414334655.db2.gz LJHRARXWPFZALC-SFHVURJKSA-N 0 0 378.388 3.206 20 5 GGBDRN NC(=O)c1cnc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)s1 ZINC000121999880 1414336211 /nfs/dbraw/zinc/33/62/11/1414336211.db2.gz IKZDQDKPTJECNP-UHFFFAOYSA-N 0 0 383.389 3.146 20 5 GGBDRN O=C(N[C@H](CCCO)c1ccccc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000122004841 1414337677 /nfs/dbraw/zinc/33/76/77/1414337677.db2.gz RXRJXRHCFVGQAU-MRXNPFEDSA-N 0 0 380.404 3.024 20 5 GGBDRN Cc1c(C(=O)N2CCc3ccc(Cl)cc3C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000122010138 1414339061 /nfs/dbraw/zinc/33/90/61/1414339061.db2.gz IBLIDLGGQJNCSE-UHFFFAOYSA-N 0 0 397.822 3.336 20 5 GGBDRN C[C@@H](C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccsc1 ZINC000122028027 1414343411 /nfs/dbraw/zinc/34/34/11/1414343411.db2.gz FGMGRJWWNFDXOA-SNVBAGLBSA-N 0 0 382.825 3.386 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000122060155 1414352122 /nfs/dbraw/zinc/35/21/22/1414352122.db2.gz MNNVNBIEPIAMQE-UHFFFAOYSA-N 0 0 395.337 3.421 20 5 GGBDRN CCN(CC)[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])c1ccco1 ZINC000122074668 1414355527 /nfs/dbraw/zinc/35/55/27/1414355527.db2.gz AAGINONAXYOXTJ-CQSZACIVSA-N 0 0 381.454 3.086 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000122079393 1414357347 /nfs/dbraw/zinc/35/73/47/1414357347.db2.gz XXOVDINOSVBWSN-AWEZNQCLSA-N 0 0 376.434 3.486 20 5 GGBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OS(=O)(=O)C[C@@H]1CCCO1 ZINC000177578571 1428801507 /nfs/dbraw/zinc/80/15/07/1428801507.db2.gz QJIQZFQXJRSQJI-INIZCTEOSA-N 0 0 377.418 3.073 20 5 GGBDRN COCCNC(=O)c1ccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1Cl ZINC000122088872 1414360140 /nfs/dbraw/zinc/36/01/40/1414360140.db2.gz IVHZADDBTKUSRG-UHFFFAOYSA-N 0 0 391.811 3.185 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)OC[C@H]1CC(=O)N(CCc2ccccc2)C1 ZINC000122136321 1414370767 /nfs/dbraw/zinc/37/07/67/1414370767.db2.gz OGSIZQZNWVQYEJ-IBGZPJMESA-N 0 0 396.443 3.162 20 5 GGBDRN CCc1c(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cnn1CC(C)C ZINC000122145051 1414372819 /nfs/dbraw/zinc/37/28/19/1414372819.db2.gz IBKMRKIYLNVJRD-UHFFFAOYSA-N 0 0 387.440 3.204 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCc2c3ccccc3[nH]c2C1 ZINC000122152376 1414375204 /nfs/dbraw/zinc/37/52/04/1414375204.db2.gz QVTSKXHLRYIJKB-UHFFFAOYSA-N 0 0 392.415 3.216 20 5 GGBDRN CCC(CC)n1ncc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000122174189 1414379963 /nfs/dbraw/zinc/37/99/63/1414379963.db2.gz HTBAWYWZLLVBHL-CQSZACIVSA-N 0 0 386.456 3.182 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc(-c2nc3ccccc3s2)o1 ZINC000122173701 1414380159 /nfs/dbraw/zinc/38/01/59/1414380159.db2.gz XNMWBYSXIRRFFJ-UHFFFAOYSA-N 0 0 383.389 3.091 20 5 GGBDRN CCC(CC)n1ncc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000122173987 1414380176 /nfs/dbraw/zinc/38/01/76/1414380176.db2.gz HTBAWYWZLLVBHL-AWEZNQCLSA-N 0 0 386.456 3.182 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@H]1CCCc2ccc(F)cc21 ZINC000122200893 1414386753 /nfs/dbraw/zinc/38/67/53/1414386753.db2.gz IOLFERGZOGLPDQ-INIZCTEOSA-N 0 0 385.395 3.483 20 5 GGBDRN Cc1nc(-c2cccc(Cl)c2)sc1C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000122212308 1414389820 /nfs/dbraw/zinc/38/98/20/1414389820.db2.gz CRCCDXFFHAVRQE-UHFFFAOYSA-N 0 0 391.840 3.307 20 5 GGBDRN COc1ccc(C[C@H](C)CN(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000122221733 1414393684 /nfs/dbraw/zinc/39/36/84/1414393684.db2.gz CFWVHAMUICLBME-AWEZNQCLSA-N 0 0 378.450 3.103 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000122221956 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1414451451 /nfs/dbraw/zinc/45/14/51/1414451451.db2.gz CCYMTTWXIFNYRJ-UHFFFAOYSA-N 0 0 398.448 3.262 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCN(C(=O)c2ccccc2)CC1 ZINC000122421530 1414454292 /nfs/dbraw/zinc/45/42/92/1414454292.db2.gz NRSQQQJATAIFMJ-UHFFFAOYSA-N 0 0 382.420 3.283 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCNC(=O)c1ccc(Cl)cc1 ZINC000122427716 1414456776 /nfs/dbraw/zinc/45/67/76/1414456776.db2.gz PBJIYOOORBSJJO-UHFFFAOYSA-N 0 0 376.800 3.108 20 5 GGBDRN CCc1cc(NC(=O)c2cnc3c(c2)ncn3C)c2cc([N+](=O)[O-])ccc2n1 ZINC000122458465 1414467110 /nfs/dbraw/zinc/46/71/10/1414467110.db2.gz IGVYEKXFBATBHM-UHFFFAOYSA-N 0 0 376.376 3.239 20 5 GGBDRN C[C@@H](C(=O)NCCc1cccs1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000122459833 1414467555 /nfs/dbraw/zinc/46/75/55/1414467555.db2.gz CZYFAQFBTZZYSC-LBPRGKRZSA-N 0 0 381.885 3.489 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CCCOCCc1ccccc1 ZINC000122461637 1414468457 /nfs/dbraw/zinc/46/84/57/1414468457.db2.gz IGDAGESTBZSICK-UHFFFAOYSA-N 0 0 379.416 3.468 20 5 GGBDRN COc1ccccc1CNC(=O)[C@@H](C)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000122468173 1414470568 /nfs/dbraw/zinc/47/05/68/1414470568.db2.gz ZNKNTTJYMBCGAY-CYBMUJFWSA-N 0 0 391.855 3.394 20 5 GGBDRN Cc1cc(C(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)cc([N+](=O)[O-])c1 ZINC000122470465 1414471767 /nfs/dbraw/zinc/47/17/67/1414471767.db2.gz PYHLWFSTVRGWKQ-UHFFFAOYSA-N 0 0 377.441 3.375 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](Cc1ccccc1)c1ccccc1 ZINC000177614651 1428811067 /nfs/dbraw/zinc/81/10/67/1428811067.db2.gz WTOFMVUVSSUZBN-IBGZPJMESA-N 0 0 378.432 3.242 20 5 GGBDRN Cc1c(NC(=O)N2CCOC[C@H]2C[C@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000122499679 1414483243 /nfs/dbraw/zinc/48/32/43/1414483243.db2.gz QPJZCCMDLCBJTG-CJNGLKHVSA-N 0 0 391.449 3.321 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H](Cc1ccccc1)c1ccccc1 ZINC000177618427 1428812583 /nfs/dbraw/zinc/81/25/83/1428812583.db2.gz LHDLJDPOZQOWNZ-IBGZPJMESA-N 0 0 378.432 3.324 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCC[C@@H]2[C@@H]2CCCCC2=O)cc1C ZINC000177618745 1428812674 /nfs/dbraw/zinc/81/26/74/1428812674.db2.gz VHZMJGXPFFDAIF-LSDHHAIUSA-N 0 0 380.466 3.124 20 5 GGBDRN Cc1c(C(=O)NCc2ccc(OC(C)C)nc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122528011 1414490464 /nfs/dbraw/zinc/49/04/64/1414490464.db2.gz HHKUSIPKRCIGMG-UHFFFAOYSA-N 0 0 388.380 3.232 20 5 GGBDRN CC[C@]1(c2ccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)cc2)CCC(=O)NC1=O ZINC000122526407 1414490664 /nfs/dbraw/zinc/49/06/64/1414490664.db2.gz GVIHXFBHDZQGQB-OAQYLSRUSA-N 0 0 395.415 3.240 20 5 GGBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])s1)c1cccc(Br)n1 ZINC000122526560 1414490909 /nfs/dbraw/zinc/49/09/09/1414490909.db2.gz FRMIKMYRLFPDRG-UHFFFAOYSA-N 0 0 386.227 3.107 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000122534908 1414492483 /nfs/dbraw/zinc/49/24/83/1414492483.db2.gz SSDVPXPZSDAGFB-RDTXWAMCSA-N 0 0 388.395 3.397 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000122534507 1414492647 /nfs/dbraw/zinc/49/26/47/1414492647.db2.gz SSDVPXPZSDAGFB-KBXCAEBGSA-N 0 0 388.395 3.397 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000122535126 1414492892 /nfs/dbraw/zinc/49/28/92/1414492892.db2.gz SSDVPXPZSDAGFB-KDOFPFPSSA-N 0 0 388.395 3.397 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC000122551573 1414497940 /nfs/dbraw/zinc/49/79/40/1414497940.db2.gz YKZLPKGDAXJQPM-QAPCUYQASA-N 0 0 387.411 3.353 20 5 GGBDRN CCOCCC1(CNS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CCC1 ZINC000122561598 1414501247 /nfs/dbraw/zinc/50/12/47/1414501247.db2.gz OMAYIWJVGXHMFK-UHFFFAOYSA-N 0 0 376.862 3.123 20 5 GGBDRN O=C(Nc1ccccc1Cn1cncn1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000122570668 1414504603 /nfs/dbraw/zinc/50/46/03/1414504603.db2.gz SKFUSROCPWCSGR-UHFFFAOYSA-N 0 0 392.419 3.431 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])n1 ZINC000122592818 1414510158 /nfs/dbraw/zinc/51/01/58/1414510158.db2.gz MQYSJDZWQARIKC-MRXNPFEDSA-N 0 0 375.450 3.441 20 5 GGBDRN O=C(CCc1nc(-c2cccs2)no1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122597154 1414512197 /nfs/dbraw/zinc/51/21/97/1414512197.db2.gz WNJFUGKDJNONKB-UHFFFAOYSA-N 0 0 384.377 3.154 20 5 GGBDRN Cc1cc(F)cc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000122598195 1414512326 /nfs/dbraw/zinc/51/23/26/1414512326.db2.gz MPYSYFHTFFYORK-UHFFFAOYSA-N 0 0 383.282 3.221 20 5 GGBDRN CCOc1cc(C(=O)NCc2c(CC)noc2CC)c([N+](=O)[O-])cc1OC ZINC000122603239 1414513767 /nfs/dbraw/zinc/51/37/67/1414513767.db2.gz UBOJHJOOPLGVMO-UHFFFAOYSA-N 0 0 377.397 3.045 20 5 GGBDRN Cc1cc(N(C)C)ccc1NC(=O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000122610717 1414516708 /nfs/dbraw/zinc/51/67/08/1414516708.db2.gz HOTHNKWSFKBXDC-UHFFFAOYSA-N 0 0 398.463 3.047 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])n1 ZINC000122617022 1414518716 /nfs/dbraw/zinc/51/87/16/1414518716.db2.gz GYPUUJKRMSKBNC-INIZCTEOSA-N 0 0 375.450 3.441 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1F ZINC000122617466 1414518824 /nfs/dbraw/zinc/51/88/24/1414518824.db2.gz IWUSMXBBYMSSTE-UHFFFAOYSA-N 0 0 393.802 3.465 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)c(F)c1 ZINC000122620178 1414519707 /nfs/dbraw/zinc/51/97/07/1414519707.db2.gz NNSIPCQPDDLGNS-ZDUSSCGKSA-N 0 0 382.388 3.126 20 5 GGBDRN C[C@H]1CCc2ccccc2[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000122624375 1414521732 /nfs/dbraw/zinc/52/17/32/1414521732.db2.gz UQUYRFGTKYXTCQ-KPZWWZAWSA-N 0 0 388.445 3.052 20 5 GGBDRN C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(N2CCCC2)c1 ZINC000122625959 1414522128 /nfs/dbraw/zinc/52/21/28/1414522128.db2.gz KKDSKAGGEHFDGZ-AWEZNQCLSA-N 0 0 397.435 3.344 20 5 GGBDRN O=C(Nc1cccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1)NC1CC1 ZINC000122634952 1414524270 /nfs/dbraw/zinc/52/42/70/1414524270.db2.gz WCBNAZBIZAMOQJ-UHFFFAOYSA-N 0 0 380.364 3.007 20 5 GGBDRN Cc1c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cnn1Cc1ccccc1 ZINC000122633427 1414524289 /nfs/dbraw/zinc/52/42/89/1414524289.db2.gz UDYILHPPERMNJQ-UHFFFAOYSA-N 0 0 376.376 3.277 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(=O)Nc1cccc2cccnc21 ZINC000122633988 1414524335 /nfs/dbraw/zinc/52/43/35/1414524335.db2.gz HNJJDLLKPSOTHQ-UHFFFAOYSA-N 0 0 379.376 3.212 20 5 GGBDRN CC(C)NC(=O)Nc1cccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000122632849 1414524465 /nfs/dbraw/zinc/52/44/65/1414524465.db2.gz RDXHQXDBMUVZTA-UHFFFAOYSA-N 0 0 382.380 3.253 20 5 GGBDRN COc1ccc(S(=O)(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000122637361 1414525569 /nfs/dbraw/zinc/52/55/69/1414525569.db2.gz VRTJDZRARGIAEF-TZMCWYRMSA-N 0 0 394.424 3.309 20 5 GGBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)n1 ZINC000122637587 1414525672 /nfs/dbraw/zinc/52/56/72/1414525672.db2.gz JPPOLHVTLNHUMG-KRWDZBQOSA-N 0 0 375.450 3.441 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)OCc1cn(-c2ccc(F)c(Cl)c2)nn1 ZINC000122641553 1414526664 /nfs/dbraw/zinc/52/66/64/1414526664.db2.gz FTAGEDOUMVJQNN-UHFFFAOYSA-N 0 0 390.758 3.254 20 5 GGBDRN CC[C@@H](CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000122644939 1414527751 /nfs/dbraw/zinc/52/77/51/1414527751.db2.gz UPDNTEBXGZBNJE-KRWDZBQOSA-N 0 0 395.459 3.463 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000122647932 1414528408 /nfs/dbraw/zinc/52/84/08/1414528408.db2.gz IYYKNUPYNUZIGV-CYBMUJFWSA-N 0 0 399.794 3.116 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000122650273 1414528871 /nfs/dbraw/zinc/52/88/71/1414528871.db2.gz AUMPCNNHJKZYET-QFBILLFUSA-N 0 0 387.411 3.261 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cc(-c2ccc3c(c2)CCO3)no1 ZINC000122648875 1414528903 /nfs/dbraw/zinc/52/89/03/1414528903.db2.gz XJJWSKGFVMXONR-UHFFFAOYSA-N 0 0 391.343 3.313 20 5 GGBDRN C[C@H]1C[C@H](c2ccc(F)cc2)CN1S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000122667380 1414533787 /nfs/dbraw/zinc/53/37/87/1414533787.db2.gz YLGDIJKGNQITDQ-AAEUAGOBSA-N 0 0 382.388 3.440 20 5 GGBDRN Cc1ccccc1[C@@H](C)CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000122671317 1414534071 /nfs/dbraw/zinc/53/40/71/1414534071.db2.gz NLHGIKPKSMBYDI-KRWDZBQOSA-N 0 0 395.459 3.381 20 5 GGBDRN O=C(Nc1cccnc1OCC(F)F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000122673043 1414534934 /nfs/dbraw/zinc/53/49/34/1414534934.db2.gz UPVXRGWCUNYCHF-UHFFFAOYSA-N 0 0 378.335 3.224 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000122678428 1414536154 /nfs/dbraw/zinc/53/61/54/1414536154.db2.gz AQRNZAONMNUYMT-IAQYHMDHSA-N 0 0 384.841 3.039 20 5 GGBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cc(Cl)nc(N2CCCC2)c1 ZINC000122679539 1414536609 /nfs/dbraw/zinc/53/66/09/1414536609.db2.gz VDZXFEABNLKKNQ-UHFFFAOYSA-N 0 0 386.799 3.372 20 5 GGBDRN CC(C)=CC(=O)NCc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122681480 1414536909 /nfs/dbraw/zinc/53/69/09/1414536909.db2.gz 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3.399 20 5 GGBDRN Cc1ccc(Cn2nccc2NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000123134670 1414650815 /nfs/dbraw/zinc/65/08/15/1414650815.db2.gz UMRGIUBODHJUBZ-UHFFFAOYSA-N 0 0 392.375 3.179 20 5 GGBDRN Cc1cc(C(=O)NC[C@H](O)COc2cccc(Cl)c2Cl)cc([N+](=O)[O-])c1 ZINC000123135917 1414651181 /nfs/dbraw/zinc/65/11/81/1414651181.db2.gz BQDQJCNLSYUWLX-ZDUSSCGKSA-N 0 0 399.230 3.380 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000123144337 1414653039 /nfs/dbraw/zinc/65/30/39/1414653039.db2.gz QJRPAJNTAQUTRR-GOEBONIOSA-N 0 0 390.415 3.138 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1ccc(N2CCCC2)c(F)c1 ZINC000123145686 1414653211 /nfs/dbraw/zinc/65/32/11/1414653211.db2.gz RFEQBKOCTMAVKX-UHFFFAOYSA-N 0 0 379.413 3.276 20 5 GGBDRN O=C(Nc1cccc(C(F)(F)F)c1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000123148696 1414653815 /nfs/dbraw/zinc/65/38/15/1414653815.db2.gz NILOCQXFVBXNGY-UHFFFAOYSA-N 0 0 393.321 3.137 20 5 GGBDRN O=C(Nc1ccccc1-n1ccnn1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000123159187 1414656381 /nfs/dbraw/zinc/65/63/81/1414656381.db2.gz MDAFNFHXWYAJSD-UHFFFAOYSA-N 0 0 392.419 3.031 20 5 GGBDRN CN(Cc1ccc([S@](C)=O)cc1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000177662163 1428826057 /nfs/dbraw/zinc/82/60/57/1428826057.db2.gz UAFIBJPBMARBHA-MHZLTWQESA-N 0 0 387.461 3.179 20 5 GGBDRN COc1ccc([C@@H](CCO)NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000123191191 1414664714 /nfs/dbraw/zinc/66/47/14/1414664714.db2.gz ITVZPLPTQMUWIV-QGZVFWFLSA-N 0 0 378.812 3.039 20 5 GGBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCCC[C@H]1c1ncon1 ZINC000123210594 1414669003 /nfs/dbraw/zinc/66/90/03/1414669003.db2.gz BMFNSNIWMCITJN-JQWIXIFHSA-N 0 0 380.788 3.152 20 5 GGBDRN Cc1nc(NC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)ccc1[N+](=O)[O-] ZINC000177663837 1428827006 /nfs/dbraw/zinc/82/70/06/1428827006.db2.gz STYQXZZRIGJVND-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN Cc1cc(C)c(N2C[C@@H](C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)CC2=O)c(C)c1 ZINC000177664765 1428827080 /nfs/dbraw/zinc/82/70/80/1428827080.db2.gz YMIQUDRPNZSMAC-HNNXBMFYSA-N 0 0 382.420 3.215 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCCC[C@@H]1c1ncon1 ZINC000123235190 1414674599 /nfs/dbraw/zinc/67/45/99/1414674599.db2.gz SZDYSZBXGOSCTC-LJQANCHMSA-N 0 0 388.427 3.292 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1ccc(OCC2CC2)nc1 ZINC000123235909 1414675472 /nfs/dbraw/zinc/67/54/72/1414675472.db2.gz FZLKBAZSVPSPSU-UHFFFAOYSA-N 0 0 380.404 3.119 20 5 GGBDRN NC(=O)c1ccc(SCC(=O)NCc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000123244513 1414677339 /nfs/dbraw/zinc/67/73/39/1414677339.db2.gz SQIZNQYTLHAOKZ-UHFFFAOYSA-N 0 0 395.440 3.255 20 5 GGBDRN COc1nn(C)c2nc(C)c(CCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)c(C)c12 ZINC000123270159 1414683682 /nfs/dbraw/zinc/68/36/82/1414683682.db2.gz VXMQFSXWJPWPJG-UHFFFAOYSA-N 0 0 397.435 3.098 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2ccccc2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000123282137 1414686893 /nfs/dbraw/zinc/68/68/93/1414686893.db2.gz DUDZXCSUVDYVLH-OAHLLOKOSA-N 0 0 396.490 3.335 20 5 GGBDRN CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000123313329 1414694769 /nfs/dbraw/zinc/69/47/69/1414694769.db2.gz PPPBZIDNXQXCAW-PGXXRXHMSA-N 0 0 393.509 3.349 20 5 GGBDRN CCC1(CC)[C@H](OC)C[C@H]1N(C)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000123316816 1414695147 /nfs/dbraw/zinc/69/51/47/1414695147.db2.gz KBXRBIZLZQMCSM-IAGOWNOFSA-N 0 0 387.436 3.102 20 5 GGBDRN Cc1sc(S(=O)(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000123317904 1414695685 /nfs/dbraw/zinc/69/56/85/1414695685.db2.gz VJSKSBQIYRXSJN-PBHICJAKSA-N 0 0 396.490 3.411 20 5 GGBDRN CCn1c(=O)c2cc3ccccc3cc2nc1SCC(=O)c1cnn(C)c1 ZINC000123328441 1414697641 /nfs/dbraw/zinc/69/76/41/1414697641.db2.gz YKTGJFUMKPFSEW-UHFFFAOYSA-N 0 0 378.457 3.278 20 5 GGBDRN Cc1sc(S(=O)(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000123331786 1414698540 /nfs/dbraw/zinc/69/85/40/1414698540.db2.gz FPYDOVFIRCPGGY-UHFFFAOYSA-N 0 0 378.771 3.294 20 5 GGBDRN Cc1ccc([C@H](OC[C@@H](O)Cn2cc([N+](=O)[O-])ccc2=O)c2ccccc2)cc1 ZINC000123341827 1414701181 /nfs/dbraw/zinc/70/11/81/1414701181.db2.gz KYFNDQNCLMHIQP-RBBKRZOGSA-N 0 0 394.427 3.232 20 5 GGBDRN Cc1ccc([C@@H](OC[C@H](O)Cn2cc([N+](=O)[O-])ccc2=O)c2ccccc2)cc1 ZINC000123341613 1414701236 /nfs/dbraw/zinc/70/12/36/1414701236.db2.gz KYFNDQNCLMHIQP-IRLDBZIGSA-N 0 0 394.427 3.232 20 5 GGBDRN Cc1ccccc1[C@H](OC[C@H](O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000123342829 1414701273 /nfs/dbraw/zinc/70/12/73/1414701273.db2.gz ZGVRKFUYDOTNBP-DENIHFKCSA-N 0 0 394.427 3.232 20 5 GGBDRN CC(C)Oc1cccc(CN(C)C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1 ZINC000123347118 1414702507 /nfs/dbraw/zinc/70/25/07/1414702507.db2.gz ADIMICUIUAVWFI-UHFFFAOYSA-N 0 0 395.419 3.235 20 5 GGBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCn2c(nnc2-c2ccccc2)C1 ZINC000177672557 1428829571 /nfs/dbraw/zinc/82/95/71/1428829571.db2.gz VBFKOVBWPCGBJU-UHFFFAOYSA-N 0 0 383.795 3.163 20 5 GGBDRN COc1ccccc1[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N(C)C ZINC000123354964 1414704797 /nfs/dbraw/zinc/70/47/97/1414704797.db2.gz CMEILGZUENZKCM-IBGZPJMESA-N 0 0 396.447 3.046 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(C(=O)[C@H](c2ccccc2)C2CC2)CC1 ZINC000123359890 1414705864 /nfs/dbraw/zinc/70/58/64/1414705864.db2.gz SOTBVJITAJLMTE-GOSISDBHSA-N 0 0 399.472 3.135 20 5 GGBDRN C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000123369499 1414708653 /nfs/dbraw/zinc/70/86/53/1414708653.db2.gz PAFLFJVAPNMFFN-QWHCGFSZSA-N 0 0 394.424 3.021 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000123371255 1414708718 /nfs/dbraw/zinc/70/87/18/1414708718.db2.gz ZRAGSKWOKWHZPT-SJLPKXTDSA-N 0 0 388.395 3.227 20 5 GGBDRN O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000123371047 1414708852 /nfs/dbraw/zinc/70/88/52/1414708852.db2.gz CLIMMRGVMXPGHQ-GFCCVEGCSA-N 0 0 395.749 3.062 20 5 GGBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccc(NC(N)=O)cc1 ZINC000123371786 1414709290 /nfs/dbraw/zinc/70/92/90/1414709290.db2.gz CREHZLSPOLFJIQ-NSHDSACASA-N 0 0 379.376 3.125 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)OC[C@@H]1CC(=O)N(c2ccccc2)C1 ZINC000123387379 1414713121 /nfs/dbraw/zinc/71/31/21/1414713121.db2.gz JLPMNSMHQOLLBW-MRXNPFEDSA-N 0 0 397.431 3.383 20 5 GGBDRN Cc1cc(=O)n(C[C@@H](O)Cn2c3ccccc3c3ccccc32)cc1[N+](=O)[O-] ZINC000123386410 1414713402 /nfs/dbraw/zinc/71/34/02/1414713402.db2.gz OGNOERCTRYXELZ-OAHLLOKOSA-N 0 0 377.400 3.234 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCC[C@H]1c1ncon1 ZINC000123440694 1414732574 /nfs/dbraw/zinc/73/25/74/1414732574.db2.gz VSSGSPYDBJPTKS-AWEZNQCLSA-N 0 0 385.405 3.469 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCC[C@@H]1c1ncon1 ZINC000123440489 1414732655 /nfs/dbraw/zinc/73/26/55/1414732655.db2.gz VSSGSPYDBJPTKS-CQSZACIVSA-N 0 0 385.405 3.469 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1nnc(-c2ccccc2)o1 ZINC000177681183 1428832268 /nfs/dbraw/zinc/83/22/68/1428832268.db2.gz ZMYYGQYZUFGNFZ-UHFFFAOYSA-N 0 0 383.364 3.018 20 5 GGBDRN CSc1cc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1F ZINC000123458639 1414738559 /nfs/dbraw/zinc/73/85/59/1414738559.db2.gz YUDHXTXZXLTMLT-LBPRGKRZSA-N 0 0 376.413 3.177 20 5 GGBDRN Cc1ccc(NCCCNC(=O)C(=O)Nc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000123469394 1414742582 /nfs/dbraw/zinc/74/25/82/1414742582.db2.gz XTHGATLNLNXEAQ-UHFFFAOYSA-N 0 0 390.827 3.114 20 5 GGBDRN CCn1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccn1 ZINC000123480503 1414746501 /nfs/dbraw/zinc/74/65/01/1414746501.db2.gz AGTBUMOIXUWXIA-UHFFFAOYSA-N 0 0 398.448 3.389 20 5 GGBDRN O=C(Nc1ccnn1C[C@H]1CCOC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000123484237 1414749106 /nfs/dbraw/zinc/74/91/06/1414749106.db2.gz PXWJCWRKGXANHF-GFCCVEGCSA-N 0 0 399.432 3.204 20 5 GGBDRN CC(C)Oc1cccc(CN(C)C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000123494886 1414751802 /nfs/dbraw/zinc/75/18/02/1414751802.db2.gz UDHKONAHXMKPPD-UHFFFAOYSA-N 0 0 395.419 3.235 20 5 GGBDRN CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C)nnc1-c1ccccn1 ZINC000123501848 1414753930 /nfs/dbraw/zinc/75/39/30/1414753930.db2.gz SBGLGUBLTHONOW-UHFFFAOYSA-N 0 0 398.448 3.307 20 5 GGBDRN COc1ccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1OCC(F)(F)F ZINC000123517056 1414759941 /nfs/dbraw/zinc/75/99/41/1414759941.db2.gz OSRNPARQZNACSN-UHFFFAOYSA-N 0 0 385.298 3.379 20 5 GGBDRN O=C(N[C@H]1CCN(c2ncccc2F)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000123517759 1414760505 /nfs/dbraw/zinc/76/05/05/1414760505.db2.gz PAPJJEHWNJPOIG-HNNXBMFYSA-N 0 0 399.426 3.082 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1(CC)CC ZINC000177692904 1428834921 /nfs/dbraw/zinc/83/49/21/1428834921.db2.gz QTSGUKCRHACSEG-SJORKVTESA-N 0 0 387.436 3.150 20 5 GGBDRN COC(=O)CCCc1csc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000123534667 1414766223 /nfs/dbraw/zinc/76/62/23/1414766223.db2.gz SXSFXNSFDBEFBG-UHFFFAOYSA-N 0 0 383.813 3.453 20 5 GGBDRN CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccn1 ZINC000123536491 1414766791 /nfs/dbraw/zinc/76/67/91/1414766791.db2.gz QNJOZBIDVMVKLH-UHFFFAOYSA-N 0 0 398.448 3.307 20 5 GGBDRN CNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000123556526 1414773239 /nfs/dbraw/zinc/77/32/39/1414773239.db2.gz HOQQOMMSQHDRGH-HNNXBMFYSA-N 0 0 393.509 3.474 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC(OC[C@H]2CCCO2)CC1 ZINC000177697755 1428836000 /nfs/dbraw/zinc/83/60/00/1428836000.db2.gz IZRCFNIMZRJYLO-CQSZACIVSA-N 0 0 383.832 3.440 20 5 GGBDRN CCC(=O)N1CC[C@H](C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)C1 ZINC000123587627 1414785389 /nfs/dbraw/zinc/78/53/89/1414785389.db2.gz KANOOESMIWMVNZ-ZDUSSCGKSA-N 0 0 388.449 3.224 20 5 GGBDRN Cc1c(Br)cc(C(=O)OCCCc2cnn(C)c2)cc1[N+](=O)[O-] ZINC000123596973 1414788061 /nfs/dbraw/zinc/78/80/61/1414788061.db2.gz KUPNPCABXLPBRH-UHFFFAOYSA-N 0 0 382.214 3.189 20 5 GGBDRN CC[C@H](C)n1ncc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c1C1CC1 ZINC000123598722 1414788973 /nfs/dbraw/zinc/78/89/73/1414788973.db2.gz FRMIYTYTCXEZPZ-LBPRGKRZSA-N 0 0 386.408 3.435 20 5 GGBDRN C[C@@H](OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000123630061 1414800724 /nfs/dbraw/zinc/80/07/24/1414800724.db2.gz BTVMVZIESSLLFX-LLVKDONJSA-N 0 0 383.320 3.002 20 5 GGBDRN Cc1c(C(=O)O[C@H](C)c2cn(-c3ccccc3)nn2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000123630873 1414800951 /nfs/dbraw/zinc/80/09/51/1414800951.db2.gz ZGHNRUYFNRRVEJ-GFCCVEGCSA-N 0 0 397.347 3.310 20 5 GGBDRN O=C(CN(C[C@@H]1CCCO1)[C@@H]1CCSC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000123635151 1414801384 /nfs/dbraw/zinc/80/13/84/1414801384.db2.gz UPNIVVNRLCMPRJ-KGLIPLIRSA-N 0 0 399.900 3.173 20 5 GGBDRN O=C(NCCc1cc2ccccc2o1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000123642044 1414802492 /nfs/dbraw/zinc/80/24/92/1414802492.db2.gz UNBIOEBAVLLNQA-UHFFFAOYSA-N 0 0 376.372 3.499 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C(=O)N(C)C)ccc1Cl ZINC000123654830 1414804694 /nfs/dbraw/zinc/80/46/94/1414804694.db2.gz WQLVPCKSXBPSNA-UHFFFAOYSA-N 0 0 377.784 3.211 20 5 GGBDRN COc1ccc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 ZINC000123656415 1414804881 /nfs/dbraw/zinc/80/48/81/1414804881.db2.gz FQHUOSJOVQNTPH-HXUWFJFHSA-N 0 0 399.447 3.057 20 5 GGBDRN CC[C@H](NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(Cl)c1 ZINC000123665662 1414805923 /nfs/dbraw/zinc/80/59/23/1414805923.db2.gz UHFDPERLEAVMIK-AWEZNQCLSA-N 0 0 389.795 3.424 20 5 GGBDRN Cc1sc(NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)nc1-c1c[nH]c2ncccc12 ZINC000123672751 1414807111 /nfs/dbraw/zinc/80/71/11/1414807111.db2.gz PCDSCFBIISZAHH-UHFFFAOYSA-N 0 0 396.388 3.256 20 5 GGBDRN CCn1nccc1C(=O)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000123676518 1414808024 /nfs/dbraw/zinc/80/80/24/1414808024.db2.gz ASXWQEBPOFDUSE-UHFFFAOYSA-N 0 0 380.360 3.283 20 5 GGBDRN CN(C)C(=O)c1cc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)ccc1F ZINC000123684185 1414809428 /nfs/dbraw/zinc/80/94/28/1414809428.db2.gz CZSZPKMPDOIFKE-UHFFFAOYSA-N 0 0 384.367 3.098 20 5 GGBDRN O=C(CN(C[C@H]1CCCO1)[C@@H]1CCSC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000123709729 1414813686 /nfs/dbraw/zinc/81/36/86/1414813686.db2.gz JZOIPHXIAWRAKZ-ZIAGYGMSSA-N 0 0 399.900 3.173 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)NC(=O)CO2)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000123713687 1414814186 /nfs/dbraw/zinc/81/41/86/1414814186.db2.gz FIXTVZPXIRSURP-UHFFFAOYSA-N 0 0 382.159 3.485 20 5 GGBDRN O=[N+]([O-])c1ccn(CCSc2nnc(-c3ccccn3)n2-c2ccccc2)n1 ZINC000123717309 1414814688 /nfs/dbraw/zinc/81/46/88/1414814688.db2.gz SGTHVISIUJPKCO-UHFFFAOYSA-N 0 0 393.432 3.226 20 5 GGBDRN O=C(CC1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1)N1CCCC1 ZINC000123740745 1414818256 /nfs/dbraw/zinc/81/82/56/1414818256.db2.gz UDYGVBQCRIEUAH-UHFFFAOYSA-N 0 0 396.447 3.008 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000123753964 1414820512 /nfs/dbraw/zinc/82/05/12/1414820512.db2.gz RYQOKAFFAZULDF-HNNXBMFYSA-N 0 0 394.424 3.104 20 5 GGBDRN O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000123754208 1414820625 /nfs/dbraw/zinc/82/06/25/1414820625.db2.gz RYQOKAFFAZULDF-OAHLLOKOSA-N 0 0 394.424 3.104 20 5 GGBDRN CC1CCN(c2ccc(CNC(=O)NCc3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000123760944 1414820836 /nfs/dbraw/zinc/82/08/36/1414820836.db2.gz CNUTYVAUVJGTGF-UHFFFAOYSA-N 0 0 383.452 3.226 20 5 GGBDRN CCCCNC(=O)c1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000123762146 1414820973 /nfs/dbraw/zinc/82/09/73/1414820973.db2.gz VXKAGRQESJGBOH-UHFFFAOYSA-N 0 0 384.436 3.124 20 5 GGBDRN O=C(NCCc1cc(Cl)c2c(c1)OCCO2)NCc1ccc([N+](=O)[O-])cc1 ZINC000123768665 1414822332 /nfs/dbraw/zinc/82/23/32/1414822332.db2.gz MXDYFVSFMBGMKW-UHFFFAOYSA-N 0 0 391.811 3.061 20 5 GGBDRN O=C(Nc1cccc2c1C(=O)NC2)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000123769117 1414822396 /nfs/dbraw/zinc/82/23/96/1414822396.db2.gz CBNNQVALKWGYQY-UHFFFAOYSA-N 0 0 380.385 3.214 20 5 GGBDRN O=C(c1ccccc1)N1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000123794913 1414825536 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WMYFHCIGZJKLII-UHFFFAOYSA-N 0 0 381.383 3.227 20 5 GGBDRN Cc1cccc2c(CC(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)c[nH]c21 ZINC000123936861 1414853140 /nfs/dbraw/zinc/85/31/40/1414853140.db2.gz VRFNPBDNBRWEST-UHFFFAOYSA-N 0 0 378.432 3.276 20 5 GGBDRN O=C(Nc1ccc(-n2ccnn2)cc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000123986146 1414862932 /nfs/dbraw/zinc/86/29/32/1414862932.db2.gz HZAVNVYALFIXKJ-UHFFFAOYSA-N 0 0 378.392 3.372 20 5 GGBDRN COc1ccc([C@@H](CCO)NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000124032624 1414873027 /nfs/dbraw/zinc/87/30/27/1414873027.db2.gz BDFBXSLHZWXFNR-MRXNPFEDSA-N 0 0 398.337 3.476 20 5 GGBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1ccccc1C(=O)c1ccc(F)cc1 ZINC000177735469 1428845558 /nfs/dbraw/zinc/84/55/58/1428845558.db2.gz ZVQHCROWMIMQMA-UHFFFAOYSA-N 0 0 383.335 3.018 20 5 GGBDRN O=C(C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 ZINC000124068956 1414879670 /nfs/dbraw/zinc/87/96/70/1414879670.db2.gz BARFOSWZIKBCIE-OAHLLOKOSA-N 0 0 383.360 3.381 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccc2c(c1)CC(=O)N2 ZINC000124096695 1414884887 /nfs/dbraw/zinc/88/48/87/1414884887.db2.gz NSVKLDWFCITXFA-LLVKDONJSA-N 0 0 376.372 3.129 20 5 GGBDRN COc1ccc(C2(CNC(=O)c3ccc(F)cc3[N+](=O)[O-])CCOCC2)cc1 ZINC000124095427 1414884974 /nfs/dbraw/zinc/88/49/74/1414884974.db2.gz GWRFOPQDNOGGTF-UHFFFAOYSA-N 0 0 388.395 3.221 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cccc(N2CCCC2=O)c1 ZINC000124109179 1414887129 /nfs/dbraw/zinc/88/71/29/1414887129.db2.gz GNPIJQHDWIXATC-UHFFFAOYSA-N 0 0 378.388 3.384 20 5 GGBDRN CC(C)(C(=O)Nc1cccc2oc(C(F)(F)F)nc21)n1cc([N+](=O)[O-])cn1 ZINC000124121119 1414889214 /nfs/dbraw/zinc/88/92/14/1414889214.db2.gz ARXZNLIHNAPCHQ-UHFFFAOYSA-N 0 0 383.286 3.325 20 5 GGBDRN Cc1ccc(-c2ncco2)cc1NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000124127588 1414890621 /nfs/dbraw/zinc/89/06/21/1414890621.db2.gz ODQMKIFRHIUIHW-ZDUSSCGKSA-N 0 0 394.387 3.315 20 5 GGBDRN O=C(Nc1cccc(C(=O)N2CCCC2)c1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124131812 1414891746 /nfs/dbraw/zinc/89/17/46/1414891746.db2.gz OSBPJSUFCSFCHQ-UHFFFAOYSA-N 0 0 394.431 3.421 20 5 GGBDRN Cc1cc(C(=O)OCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc(Cl)n1 ZINC000124137800 1414892933 /nfs/dbraw/zinc/89/29/33/1414892933.db2.gz VSLOVLYXOVCVBS-UHFFFAOYSA-N 0 0 398.202 3.192 20 5 GGBDRN Cc1ccc(NC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000124148851 1414895424 /nfs/dbraw/zinc/89/54/24/1414895424.db2.gz RFVKOKAVHDOFOV-HNNXBMFYSA-N 0 0 376.457 3.309 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1 ZINC000124149460 1414895670 /nfs/dbraw/zinc/89/56/70/1414895670.db2.gz LSUBRRKBKFDSOV-INIZCTEOSA-N 0 0 397.431 3.159 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c1 ZINC000124148888 1414895676 /nfs/dbraw/zinc/89/56/76/1414895676.db2.gz QJLLFNZRSMYSMZ-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1 ZINC000124149291 1414895693 /nfs/dbraw/zinc/89/56/93/1414895693.db2.gz LSUBRRKBKFDSOV-MRXNPFEDSA-N 0 0 397.431 3.159 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccccc2C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000124151790 1414896044 /nfs/dbraw/zinc/89/60/44/1414896044.db2.gz WBAQIBIVOIYCQU-UHFFFAOYSA-N 0 0 386.364 3.202 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](CC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000124152751 1414896545 /nfs/dbraw/zinc/89/65/45/1414896545.db2.gz UQPBJQJJFVVWNZ-ZDUSSCGKSA-N 0 0 380.420 3.140 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000124169466 1414899132 /nfs/dbraw/zinc/89/91/32/1414899132.db2.gz IJMQYKXLGPPPEY-QWHCGFSZSA-N 0 0 381.860 3.405 20 5 GGBDRN Cc1ccc(OC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000124202703 1414907921 /nfs/dbraw/zinc/90/79/21/1414907921.db2.gz KWXWZWCSVVQTNB-HNNXBMFYSA-N 0 0 377.441 3.276 20 5 GGBDRN Cc1ccc([C@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1 ZINC000124207544 1414908450 /nfs/dbraw/zinc/90/84/50/1414908450.db2.gz TUBDSLDQZYVXTO-NRFANRHFSA-N 0 0 397.475 3.026 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C ZINC000124227200 1414914077 /nfs/dbraw/zinc/91/40/77/1414914077.db2.gz DMLQCTCAOBUZDK-VIFPVBQESA-N 0 0 387.845 3.071 20 5 GGBDRN Cc1sc(S(=O)(=O)N2CCC([C@H](O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000124232839 1414915217 /nfs/dbraw/zinc/91/52/17/1414915217.db2.gz VIXVZTWQVPBNBU-QGZVFWFLSA-N 0 0 396.490 3.099 20 5 GGBDRN Cc1onc(-c2ccccc2Cl)c1C(=O)OCCn1cc([N+](=O)[O-])cn1 ZINC000177742626 1428847829 /nfs/dbraw/zinc/84/78/29/1428847829.db2.gz LWLRYTJWGIBWIY-UHFFFAOYSA-N 0 0 376.756 3.265 20 5 GGBDRN O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000124291494 1414930673 /nfs/dbraw/zinc/93/06/73/1414930673.db2.gz VXRNZZFMHWESGK-BEFAXECRSA-N 0 0 391.493 3.324 20 5 GGBDRN O=C(CNc1ccccc1OCC(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000124312473 1414936634 /nfs/dbraw/zinc/93/66/34/1414936634.db2.gz VFPABEACDNCADX-UHFFFAOYSA-N 0 0 377.347 3.240 20 5 GGBDRN COc1ccc(Cl)cc1CN(C)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000124333898 1414942156 /nfs/dbraw/zinc/94/21/56/1414942156.db2.gz LSHNUZVJTFPWFG-UHFFFAOYSA-N 0 0 377.784 3.254 20 5 GGBDRN CCn1c(S[C@@H]2CCCN(C(C)C)C2=O)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000177750507 1428849545 /nfs/dbraw/zinc/84/95/45/1428849545.db2.gz VNQNGTFAPXTYOP-OAHLLOKOSA-N 0 0 389.481 3.365 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NCC(C)(C)CCO)cc1[N+](=O)[O-])c1ccccn1 ZINC000177752822 1428850039 /nfs/dbraw/zinc/85/00/39/1428850039.db2.gz DNMGDYVRMQVMNP-AWEZNQCLSA-N 0 0 386.452 3.301 20 5 GGBDRN CC(C)Oc1cccc(CN(C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 ZINC000124368148 1414950687 /nfs/dbraw/zinc/95/06/87/1414950687.db2.gz BXIAABQTSOLDQW-UHFFFAOYSA-N 0 0 383.404 3.068 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NCC(C)(C)CCO)cc1[N+](=O)[O-])c1ccccn1 ZINC000177752837 1428850160 /nfs/dbraw/zinc/85/01/60/1428850160.db2.gz DNMGDYVRMQVMNP-CQSZACIVSA-N 0 0 386.452 3.301 20 5 GGBDRN COCc1c(C(=O)OCCn2cc([N+](=O)[O-])cn2)sc2cccc(F)c21 ZINC000177754921 1428850672 /nfs/dbraw/zinc/85/06/72/1428850672.db2.gz PUINTMROLNWLOQ-UHFFFAOYSA-N 0 0 379.369 3.149 20 5 GGBDRN Cc1c(C(=O)N2CC(C)(C)Oc3ccccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000124422327 1414964725 /nfs/dbraw/zinc/96/47/25/1414964725.db2.gz XYUCZNLVCPKLPG-UHFFFAOYSA-N 0 0 393.403 3.302 20 5 GGBDRN COC[C@@H](NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C)c1ccc(C)o1 ZINC000124441502 1414969483 /nfs/dbraw/zinc/96/94/83/1414969483.db2.gz YIUIPGILNJAJOQ-GFCCVEGCSA-N 0 0 388.829 3.124 20 5 GGBDRN CCN(Cc1cccc(Cl)c1)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000124442755 1414969647 /nfs/dbraw/zinc/96/96/47/1414969647.db2.gz HVRUBSDDKYBOIH-UHFFFAOYSA-N 0 0 389.795 3.205 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1cccc(NC(=O)N2CCCC2)c1 ZINC000124457190 1414972649 /nfs/dbraw/zinc/97/26/49/1414972649.db2.gz PYJGUDIEXJKHER-UHFFFAOYSA-N 0 0 396.447 3.472 20 5 GGBDRN Cc1sc(S(=O)(=O)N(CCN2CCCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000124464340 1414974416 /nfs/dbraw/zinc/97/44/16/1414974416.db2.gz UONHOLKBHPVUNE-UHFFFAOYSA-N 0 0 395.506 3.256 20 5 GGBDRN CCOc1ccc(-c2nc(C(=O)OCCn3cc([N+](=O)[O-])cn3)cs2)cc1 ZINC000177763040 1428852747 /nfs/dbraw/zinc/85/27/47/1428852747.db2.gz XSOQXSWEPZCSGX-UHFFFAOYSA-N 0 0 388.405 3.171 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@@H](CC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)C1 ZINC000124506064 1414983824 /nfs/dbraw/zinc/98/38/24/1414983824.db2.gz CKZCCDNIRCZXBA-LBPRGKRZSA-N 0 0 398.410 3.279 20 5 GGBDRN COc1cc(S(=O)(=O)N2CCC(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000124556556 1414993783 /nfs/dbraw/zinc/99/37/83/1414993783.db2.gz KINXTBAVUVODQM-UHFFFAOYSA-N 0 0 376.434 3.172 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)C(=O)NC1CCCCCCC1 ZINC000124564022 1414994791 /nfs/dbraw/zinc/99/47/91/1414994791.db2.gz GCCFCFJUOCLBHY-UHFFFAOYSA-N 0 0 385.367 3.364 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000124601403 1415003408 /nfs/dbraw/zinc/00/34/08/1415003408.db2.gz UGTILBMOPHRUQP-UHFFFAOYSA-N 0 0 378.266 3.102 20 5 GGBDRN C[C@@]1(CNC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000124609863 1415004779 /nfs/dbraw/zinc/00/47/79/1415004779.db2.gz ADFKBBMCBYCGLZ-HNNXBMFYSA-N 0 0 375.347 3.101 20 5 GGBDRN O=C(CSc1nc2cc(Cl)cnc2[nH]1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000124608742 1415005118 /nfs/dbraw/zinc/00/51/18/1415005118.db2.gz MHYCCMJXCYOZEX-UHFFFAOYSA-N 0 0 389.824 3.201 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1cc(Cl)cn1C ZINC000124615795 1415006117 /nfs/dbraw/zinc/00/61/17/1415006117.db2.gz LGOCXJXLMLRDHC-UHFFFAOYSA-N 0 0 392.264 3.369 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2ccccc2OCC(C)C)cc1[N+](=O)[O-] ZINC000124616837 1415006483 /nfs/dbraw/zinc/00/64/83/1415006483.db2.gz KRBVCPCXGRSYQZ-UHFFFAOYSA-N 0 0 385.420 3.193 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCc2ccccc2OCC(C)C)cccc1[N+](=O)[O-] ZINC000124622680 1415007797 /nfs/dbraw/zinc/00/77/97/1415007797.db2.gz LDCSDQJTBVECEJ-UHFFFAOYSA-N 0 0 385.420 3.193 20 5 GGBDRN COc1cc(NC2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1 ZINC000124631402 1415009166 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ZINC000177789761 1428858913 /nfs/dbraw/zinc/85/89/13/1428858913.db2.gz ZNTTZVKUMUXPDJ-UHFFFAOYSA-N 0 0 383.448 3.380 20 5 GGBDRN Cc1sc(NC(=O)Cn2cc(C3CC3)nn2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000125020010 1415093033 /nfs/dbraw/zinc/09/30/33/1415093033.db2.gz ICTSZNSFIIQCIF-UHFFFAOYSA-N 0 0 384.421 3.134 20 5 GGBDRN O=C(NC[C@@H](O)c1c(F)cccc1F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125025054 1415093818 /nfs/dbraw/zinc/09/38/18/1415093818.db2.gz PMIBJMMAUUNNHZ-CYBMUJFWSA-N 0 0 390.264 3.355 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000125024564 1415093874 /nfs/dbraw/zinc/09/38/74/1415093874.db2.gz ANDGYRGSIXULPU-HNNXBMFYSA-N 0 0 384.479 3.017 20 5 GGBDRN O=C(C[C@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000125030845 1415094764 /nfs/dbraw/zinc/09/47/64/1415094764.db2.gz ZLXRVMSMRMDCIC-QGZVFWFLSA-N 0 0 386.379 3.377 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000125030645 1415095141 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1415130388 /nfs/dbraw/zinc/13/03/88/1415130388.db2.gz XBCAPQOJGPKYAX-UHFFFAOYSA-N 0 0 382.420 3.176 20 5 GGBDRN CC(C)(C)CNC(=O)C(C)(C)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125207158 1415130430 /nfs/dbraw/zinc/13/04/30/1415130430.db2.gz TXXZAQIAROSNBJ-UHFFFAOYSA-N 0 0 389.374 3.284 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1nc2ccccc2n1-c1ccccc1F ZINC000125226293 1415134164 /nfs/dbraw/zinc/13/41/64/1415134164.db2.gz KRCHHFODCRANRN-UHFFFAOYSA-N 0 0 380.339 3.059 20 5 GGBDRN CN(CCCNC(=O)OC(C)(C)C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000125239089 1415137821 /nfs/dbraw/zinc/13/78/21/1415137821.db2.gz VZXLMBRBOGLQJV-UHFFFAOYSA-N 0 0 385.848 3.164 20 5 GGBDRN O=C(NCCc1cn2c(n1)CCCC2)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125247274 1415139894 /nfs/dbraw/zinc/13/98/94/1415139894.db2.gz ATFRWXPYXZUVPH-UHFFFAOYSA-N 0 0 382.342 3.119 20 5 GGBDRN COc1ccc(OCCN2CCCN(C(C)=O)c3ccccc32)c([N+](=O)[O-])c1 ZINC000177815481 1428863442 /nfs/dbraw/zinc/86/34/42/1428863442.db2.gz 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ZINC000125440331 1415199009 /nfs/dbraw/zinc/19/90/09/1415199009.db2.gz ADUFDXNLHSCOTK-UHFFFAOYSA-N 0 0 399.875 3.074 20 5 GGBDRN Cc1nn(C)c(C)c1-c1cc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[nH]n1 ZINC000177856430 1428874390 /nfs/dbraw/zinc/87/43/90/1428874390.db2.gz RLGAYMBMYRQZST-LLVKDONJSA-N 0 0 382.424 3.135 20 5 GGBDRN CCS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177857496 1428874446 /nfs/dbraw/zinc/87/44/46/1428874446.db2.gz FSQGFALUXDTTDZ-LBPRGKRZSA-N 0 0 394.424 3.327 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C2CCN(C(=O)N3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000177856165 1428874573 /nfs/dbraw/zinc/87/45/73/1428874573.db2.gz IDIQTIHWTXWAQH-HNNXBMFYSA-N 0 0 388.468 3.008 20 5 GGBDRN O=C([C@@H]1CCC[C@H](C(F)(F)F)C1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125451498 1415202974 /nfs/dbraw/zinc/20/29/74/1415202974.db2.gz KCQGVUYSTGGXBC-FRRDWIJNSA-N 0 0 386.374 3.371 20 5 GGBDRN COc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)ccc1N1CCCC1=O ZINC000125456755 1415204779 /nfs/dbraw/zinc/20/47/79/1415204779.db2.gz VSWMJMDXFIKNQD-UHFFFAOYSA-N 0 0 387.367 3.051 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)CCN2C(=O)CCc3ccccc32)cc1[N+](=O)[O-] ZINC000177870029 1428878780 /nfs/dbraw/zinc/87/87/80/1428878780.db2.gz BLXNDVDPQSKZBB-HNNXBMFYSA-N 0 0 381.432 3.450 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)CC2CN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000177870437 1428878801 /nfs/dbraw/zinc/87/88/01/1428878801.db2.gz ULSZXHGWZJBIPT-CYBMUJFWSA-N 0 0 377.441 3.337 20 5 GGBDRN COC(=O)c1ccc(F)c(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000125479540 1415211200 /nfs/dbraw/zinc/21/12/00/1415211200.db2.gz GACQWHPBWZUROW-UHFFFAOYSA-N 0 0 375.356 3.351 20 5 GGBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1 ZINC000125484227 1415211813 /nfs/dbraw/zinc/21/18/13/1415211813.db2.gz UMGFQIHYPAOLMO-NSHDSACASA-N 0 0 397.347 3.087 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(N3CCNC3=O)c2C)cc1[N+](=O)[O-] ZINC000177863324 1428877013 /nfs/dbraw/zinc/87/70/13/1428877013.db2.gz XCGJRGBKCVDKGE-AWEZNQCLSA-N 0 0 382.420 3.232 20 5 GGBDRN COc1ccc(-n2nnc(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)c2C)cc1 ZINC000177866623 1428877695 /nfs/dbraw/zinc/87/76/95/1428877695.db2.gz OVJYAVYWTRVKDQ-CYBMUJFWSA-N 0 0 395.419 3.292 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(Cc2cccc(F)c2)CC1 ZINC000177867404 1428877781 /nfs/dbraw/zinc/87/77/81/1428877781.db2.gz AEVOKLOFRLNZNH-UHFFFAOYSA-N 0 0 388.399 3.092 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)Cc1ccccc1F ZINC000125512143 1415217885 /nfs/dbraw/zinc/21/78/85/1415217885.db2.gz VVWZIOZRVPQQRZ-UHFFFAOYSA-N 0 0 390.186 3.405 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1c(F)cccc1F ZINC000125515527 1415218466 /nfs/dbraw/zinc/21/84/66/1415218466.db2.gz BHEGFNCAXNROEP-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCc1ccccn1 ZINC000125516602 1415218758 /nfs/dbraw/zinc/21/87/58/1415218758.db2.gz KRPLLXKJOAKGMC-UHFFFAOYSA-N 0 0 375.450 3.043 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)c1cc(F)cc(F)c1 ZINC000125518570 1415219483 /nfs/dbraw/zinc/21/94/83/1415219483.db2.gz UDKNCSJHJONXQM-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=[N+]([O-])c1cccc(Br)c1OS(=O)(=O)Cc1cccc(F)c1 ZINC000125522495 1415220148 /nfs/dbraw/zinc/22/01/48/1415220148.db2.gz SWBKDHPGSWJPBI-UHFFFAOYSA-N 0 0 390.186 3.405 20 5 GGBDRN CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000177836143 1428869100 /nfs/dbraw/zinc/86/91/00/1428869100.db2.gz UYDSAHFQGLZISB-JLJPHGGASA-N 0 0 375.469 3.365 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000177835923 1428869127 /nfs/dbraw/zinc/86/91/27/1428869127.db2.gz GMBWYQVKRVQTEP-QFBILLFUSA-N 0 0 395.459 3.314 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CCSc2ccc(F)cc2)CC1 ZINC000125536363 1415222408 /nfs/dbraw/zinc/22/24/08/1415222408.db2.gz PGOLEHWOFCPOBD-UHFFFAOYSA-N 0 0 389.452 3.284 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000125548372 1415223691 /nfs/dbraw/zinc/22/36/91/1415223691.db2.gz MNMRDACYZZMNLR-CYBMUJFWSA-N 0 0 391.449 3.232 20 5 GGBDRN Cc1cc(=O)c(C(=O)N[C@H](C)C2CCCCC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000125548205 1415223724 /nfs/dbraw/zinc/22/37/24/1415223724.db2.gz AESRCUTWTIRHNU-CQSZACIVSA-N 0 0 384.436 3.148 20 5 GGBDRN CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000125550293 1415224371 /nfs/dbraw/zinc/22/43/71/1415224371.db2.gz ZJHLRZNDKOXKDN-UHFFFAOYSA-N 0 0 388.445 3.154 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000125548545 1415224375 /nfs/dbraw/zinc/22/43/75/1415224375.db2.gz MNMRDACYZZMNLR-ZDUSSCGKSA-N 0 0 391.449 3.232 20 5 GGBDRN CCS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177841574 1428870293 /nfs/dbraw/zinc/87/02/93/1428870293.db2.gz CLSAJHVIFMEVAB-ZDUSSCGKSA-N 0 0 376.434 3.188 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000177876006 1428880348 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DGRKGPZEQAQVKX-UHFFFAOYSA-N 0 0 393.802 3.405 20 5 GGBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccc(F)cc1F ZINC000125639269 1415243700 /nfs/dbraw/zinc/24/37/00/1415243700.db2.gz KCECLLPLVTVXDZ-MRXNPFEDSA-N 0 0 398.387 3.158 20 5 GGBDRN CC[C@@H](C)NS(=O)(=O)Cc1cccc(NCc2cccc([N+](=O)[O-])c2)c1 ZINC000125641386 1415244204 /nfs/dbraw/zinc/24/42/04/1415244204.db2.gz VMLGWAVJMCUDJK-CQSZACIVSA-N 0 0 377.466 3.425 20 5 GGBDRN CC[C@H](OC1CCCCC1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125662063 1415248531 /nfs/dbraw/zinc/24/85/31/1415248531.db2.gz PQHGWBXYUVODEN-PBHICJAKSA-N 0 0 376.457 3.131 20 5 GGBDRN CC[C@@H](OC1CCCCC1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000125662320 1415249154 /nfs/dbraw/zinc/24/91/54/1415249154.db2.gz PQHGWBXYUVODEN-RHSMWYFYSA-N 0 0 376.457 3.131 20 5 GGBDRN Cc1sc(S(=O)(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1[N+](=O)[O-] ZINC000125674362 1415251485 /nfs/dbraw/zinc/25/14/85/1415251485.db2.gz QLSYBUXUTCLTAK-UHFFFAOYSA-N 0 0 397.434 3.226 20 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ZINC000126225398 1415388211 /nfs/dbraw/zinc/38/82/11/1415388211.db2.gz XWHKJGDJXJWJLJ-UHFFFAOYSA-N 0 0 399.447 3.143 20 5 GGBDRN COc1ccc(NC(=O)CCN2CCO[C@H](c3ccccc3C)C2)c([N+](=O)[O-])c1 ZINC000126230068 1415389127 /nfs/dbraw/zinc/38/91/27/1415389127.db2.gz RARWSAKWIJRTCD-FQEVSTJZSA-N 0 0 399.447 3.314 20 5 GGBDRN Cc1cccc(C)c1OC[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1ccccc1 ZINC000126230141 1415389517 /nfs/dbraw/zinc/38/95/17/1415389517.db2.gz FXDZOBARDIDWTP-KRWDZBQOSA-N 0 0 394.431 3.495 20 5 GGBDRN COCCOc1ccc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 ZINC000126245345 1415392418 /nfs/dbraw/zinc/39/24/18/1415392418.db2.gz TVVZLLGIUZFKKL-UHFFFAOYSA-N 0 0 399.447 3.468 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)n(-c2ccccc2)n1 ZINC000126255964 1415395763 /nfs/dbraw/zinc/39/57/63/1415395763.db2.gz KJYFIIVCEZPLLR-AWEZNQCLSA-N 0 0 393.447 3.341 20 5 GGBDRN C[C@H](CS(C)(=O)=O)N(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000126257365 1415396001 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AGVLGYPDDZSXFT-UHFFFAOYSA-N 0 0 386.477 3.389 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)NCCCC(C)(C)C)cc1[N+](=O)[O-] ZINC000126716246 1415537274 /nfs/dbraw/zinc/53/72/74/1415537274.db2.gz DCEFEHFWSAEDMK-UHFFFAOYSA-N 0 0 377.470 3.431 20 5 GGBDRN Cc1c(N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cnn1-c1ccccc1F ZINC000126724176 1415539615 /nfs/dbraw/zinc/53/96/15/1415539615.db2.gz XXCDHOYUDBYSQJ-QGZVFWFLSA-N 0 0 395.394 3.445 20 5 GGBDRN CCOC(=O)C1=C(C)N(CC2CC2)C(=O)N[C@H]1c1cc([N+](=O)[O-])c(F)cc1F ZINC000126745188 1415545329 /nfs/dbraw/zinc/54/53/29/1415545329.db2.gz DTFCDXMGAGRSJA-INIZCTEOSA-N 0 0 395.362 3.186 20 5 GGBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000126751810 1415548136 /nfs/dbraw/zinc/54/81/36/1415548136.db2.gz IBBGKOFERCPYHL-AWEZNQCLSA-N 0 0 392.374 3.309 20 5 GGBDRN CCc1ccc(C(=O)N[C@H](CC)CS(=O)(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000126759932 1415551283 /nfs/dbraw/zinc/55/12/83/1415551283.db2.gz DFOXUZQGKQCMNS-MRXNPFEDSA-N 0 0 390.461 3.140 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)OCCOc1ccccc1C(F)(F)F ZINC000126759981 1415551470 /nfs/dbraw/zinc/55/14/70/1415551470.db2.gz QVBPVNSKTHCAEP-UHFFFAOYSA-N 0 0 387.314 3.131 20 5 GGBDRN O=C(CNc1ccc(F)c([N+](=O)[O-])c1)N(Cc1ccco1)CC(F)(F)F ZINC000126800138 1415563479 /nfs/dbraw/zinc/56/34/79/1415563479.db2.gz NNDQMGQIRUOVAW-UHFFFAOYSA-N 0 0 375.278 3.330 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)cn1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126802928 1415564459 /nfs/dbraw/zinc/56/44/59/1415564459.db2.gz BAKLHLRLXFLWJB-UHFFFAOYSA-N 0 0 396.325 3.098 20 5 GGBDRN CN1CCO[C@@H]([C@H](NC(=O)c2ccc([N+](=O)[O-])s2)c2ccc(Cl)cc2)C1 ZINC000126808093 1415566176 /nfs/dbraw/zinc/56/61/76/1415566176.db2.gz YSAPVCPHFBNLFL-CZUORRHYSA-N 0 0 395.868 3.111 20 5 GGBDRN Cc1ccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c(OCC(=O)N(C)C)c1 ZINC000126812105 1415567887 /nfs/dbraw/zinc/56/78/87/1415567887.db2.gz PYBBMSCVECYAAA-UHFFFAOYSA-N 0 0 389.383 3.070 20 5 GGBDRN CCOc1cc(C(=O)N(C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000178038249 1428950572 /nfs/dbraw/zinc/95/05/72/1428950572.db2.gz OKANENBPFJTTIX-UHFFFAOYSA-N 0 0 375.356 3.087 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2cccc(-c3nc(C)co3)c2)cc1[N+](=O)[O-] ZINC000126828960 1415575010 /nfs/dbraw/zinc/57/50/10/1415575010.db2.gz LMBWOMVKRWENEY-UHFFFAOYSA-N 0 0 389.389 3.368 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000126834739 1415578579 /nfs/dbraw/zinc/57/85/79/1415578579.db2.gz UNGRTYGLRUZJJA-SFHVURJKSA-N 0 0 385.811 3.136 20 5 GGBDRN CC[C@H]1Oc2cc([C@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3C)ccc2NC1=O ZINC000126889816 1415596270 /nfs/dbraw/zinc/59/62/70/1415596270.db2.gz PJDULFVBTFMSDD-SCLBCKFNSA-N 0 0 397.431 3.433 20 5 GGBDRN CC[C@@H]1Oc2cc([C@@H](C)NC(=O)Cc3cccc([N+](=O)[O-])c3C)ccc2NC1=O ZINC000126889574 1415596353 /nfs/dbraw/zinc/59/63/53/1415596353.db2.gz PJDULFVBTFMSDD-ACJLOTCBSA-N 0 0 397.431 3.433 20 5 GGBDRN COCCC1(CNC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCC1 ZINC000178046137 1428955018 /nfs/dbraw/zinc/95/50/18/1428955018.db2.gz DDVWMASJPVRZTB-UHFFFAOYSA-N 0 0 390.484 3.023 20 5 GGBDRN COc1cc(C(=O)N[C@H]2[C@@H]3Cc4ccccc4[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000126921179 1415609905 /nfs/dbraw/zinc/60/99/05/1415609905.db2.gz DZLLYYSNYVUEKJ-DQYPLSBCSA-N 0 0 390.342 3.273 20 5 GGBDRN COC(=O)CCN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(F)c1 ZINC000126923130 1415610235 /nfs/dbraw/zinc/61/02/35/1415610235.db2.gz VTMUTEBDUITZDC-UHFFFAOYSA-N 0 0 399.378 3.354 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCc3c4ccccc4[nH]c3C2)cc([N+](=O)[O-])c1 ZINC000126924450 1415611040 /nfs/dbraw/zinc/61/10/40/1415611040.db2.gz KXYHFSFHCAMXFD-UHFFFAOYSA-N 0 0 393.399 3.451 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)O[C@@H]3[C@H]4CCO[C@@H]4C3(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000126925460 1415611649 /nfs/dbraw/zinc/61/16/49/1415611649.db2.gz DCJGKDCFXJEFMB-YTQUADARSA-N 0 0 399.447 3.427 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000126941959 1415614917 /nfs/dbraw/zinc/61/49/17/1415614917.db2.gz BPQWRPVMXQECJR-CYBMUJFWSA-N 0 0 392.818 3.465 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)N1CCc2c1cc(F)cc2F)c1cccc([N+](=O)[O-])c1 ZINC000178055558 1428958633 /nfs/dbraw/zinc/95/86/33/1428958633.db2.gz CUEYTOIPTKFYNL-MRXNPFEDSA-N 0 0 389.358 3.030 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2c3ccccc3[nH]c2C1 ZINC000126956917 1415617674 /nfs/dbraw/zinc/61/76/74/1415617674.db2.gz YAAJOSMRKCEBET-UHFFFAOYSA-N 0 0 387.399 3.460 20 5 GGBDRN CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000126996333 1415630795 /nfs/dbraw/zinc/63/07/95/1415630795.db2.gz CIXZLYTYSHPGCW-CYBMUJFWSA-N 0 0 396.852 3.231 20 5 GGBDRN Cc1c(Br)cc(C(=O)OCc2ccccc2C(N)=O)cc1[N+](=O)[O-] ZINC000127012205 1415635149 /nfs/dbraw/zinc/63/51/49/1415635149.db2.gz DDRDCNLSSWQWDK-UHFFFAOYSA-N 0 0 393.193 3.122 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000178065649 1428966316 /nfs/dbraw/zinc/96/63/16/1428966316.db2.gz JICQZOILSKSIJA-NSHDSACASA-N 0 0 393.346 3.321 20 5 GGBDRN COc1ccc(Cl)c(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000178067089 1428966845 /nfs/dbraw/zinc/96/68/45/1428966845.db2.gz VEUUYJUSPAVZFD-LLVKDONJSA-N 0 0 391.811 3.381 20 5 GGBDRN CCOc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000178068020 1428966995 /nfs/dbraw/zinc/96/69/95/1428966995.db2.gz CZYNKKCCSCOABO-AWEZNQCLSA-N 0 0 385.420 3.426 20 5 GGBDRN CCOCc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000178067811 1428967216 /nfs/dbraw/zinc/96/72/16/1428967216.db2.gz NYTFVTXDMDVLSS-CQSZACIVSA-N 0 0 385.420 3.256 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1cc2ccccc2s1 ZINC000127021174 1415640410 /nfs/dbraw/zinc/64/04/10/1415640410.db2.gz FRGOOUNOAJLFEZ-OAHLLOKOSA-N 0 0 386.429 3.428 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H](O)c1cc2ccccc2s1 ZINC000127021411 1415640453 /nfs/dbraw/zinc/64/04/53/1415640453.db2.gz FRGOOUNOAJLFEZ-HNNXBMFYSA-N 0 0 386.429 3.428 20 5 GGBDRN CC(C)[C@@H](O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000127028726 1415642824 /nfs/dbraw/zinc/64/28/24/1415642824.db2.gz CXPXWKYNLWQXHQ-GOSISDBHSA-N 0 0 377.485 3.358 20 5 GGBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000127028522 1415642839 /nfs/dbraw/zinc/64/28/39/1415642839.db2.gz CXPXWKYNLWQXHQ-SFHVURJKSA-N 0 0 377.485 3.358 20 5 GGBDRN O=C(CN1CCc2c3ccccc3[nH]c2C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000127036420 1415644746 /nfs/dbraw/zinc/64/47/46/1415644746.db2.gz YAGJTGITGCBTKM-UHFFFAOYSA-N 0 0 376.416 3.024 20 5 GGBDRN NC(=O)C[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)C1 ZINC000127037379 1415645216 /nfs/dbraw/zinc/64/52/16/1415645216.db2.gz LGZZAJINGMWEQU-ZDUSSCGKSA-N 0 0 391.493 3.357 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NC1(c2ccccc2F)CC1 ZINC000127039800 1415646131 /nfs/dbraw/zinc/64/61/31/1415646131.db2.gz NQKMTNNNTKGALE-UHFFFAOYSA-N 0 0 399.378 3.228 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)Nc1cccc(F)c1 ZINC000127042724 1415646737 /nfs/dbraw/zinc/64/67/37/1415646737.db2.gz XAAJIXIZZXOEJZ-UHFFFAOYSA-N 0 0 377.397 3.214 20 5 GGBDRN CN1CCc2ccc(NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)cc2C1=O ZINC000127053748 1415649147 /nfs/dbraw/zinc/64/91/47/1415649147.db2.gz XMNCXZXZYZXRGC-UHFFFAOYSA-N 0 0 394.431 3.419 20 5 GGBDRN O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000127059152 1415650192 /nfs/dbraw/zinc/65/01/92/1415650192.db2.gz CRVCIQVAWBLQCN-UHFFFAOYSA-N 0 0 391.362 3.398 20 5 GGBDRN Cc1cnc2c(c1)N(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])CCO2 ZINC000127066563 1415652338 /nfs/dbraw/zinc/65/23/38/1415652338.db2.gz MTKIINMSKLCAJW-LLVKDONJSA-N 0 0 377.784 3.145 20 5 GGBDRN Cc1sc(-c2ccco2)nc1C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000127067595 1415652962 /nfs/dbraw/zinc/65/29/62/1415652962.db2.gz YLVQRSONZNBMCX-UHFFFAOYSA-N 0 0 387.373 3.415 20 5 GGBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000127106939 1415661867 /nfs/dbraw/zinc/66/18/67/1415661867.db2.gz HCUPHEYPBBXEAP-CYBMUJFWSA-N 0 0 396.378 3.311 20 5 GGBDRN Cc1ccc(-c2nc(SCC(=O)NCc3ccc([N+](=O)[O-])cc3)n[nH]2)cc1 ZINC000178076147 1428971714 /nfs/dbraw/zinc/97/17/14/1428971714.db2.gz LAHJKVXPJHIAPN-UHFFFAOYSA-N 0 0 383.433 3.097 20 5 GGBDRN Nc1c(C(=O)Nc2nc(CN3CCCCC3)cs2)cc(F)cc1[N+](=O)[O-] ZINC000127115331 1415663742 /nfs/dbraw/zinc/66/37/42/1415663742.db2.gz PWCJECJYZIUTQD-UHFFFAOYSA-N 0 0 379.417 3.011 20 5 GGBDRN CC(C)(C)OC(=O)[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000127122405 1415664957 /nfs/dbraw/zinc/66/49/57/1415664957.db2.gz KAAGAZPZLUWERG-SFHVURJKSA-N 0 0 388.395 3.476 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC000127125475 1415666335 /nfs/dbraw/zinc/66/63/35/1415666335.db2.gz PMPIBRZPAWDDDO-UHFFFAOYSA-N 0 0 397.366 3.199 20 5 GGBDRN COc1ccc(OCC(=O)N[C@H](C)Cc2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000127163712 1415676241 /nfs/dbraw/zinc/67/62/41/1415676241.db2.gz GNFFQOLVMCDBOW-LLVKDONJSA-N 0 0 380.347 3.008 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)Cc1cnn(-c2ccccc2)c1 ZINC000127171101 1415677817 /nfs/dbraw/zinc/67/78/17/1415677817.db2.gz DZTZSYKHLLWLCL-HNNXBMFYSA-N 0 0 379.420 3.240 20 5 GGBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000127172355 1415678388 /nfs/dbraw/zinc/67/83/88/1415678388.db2.gz OGMPFUSVHMOEIR-SNVBAGLBSA-N 0 0 375.312 3.033 20 5 GGBDRN COC(=O)c1cccc(CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000127177611 1415679255 /nfs/dbraw/zinc/67/92/55/1415679255.db2.gz YPDWVGUJAZKXIP-UHFFFAOYSA-N 0 0 394.387 3.057 20 5 GGBDRN COCc1nc(C)c(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000127178362 1415679723 /nfs/dbraw/zinc/67/97/23/1415679723.db2.gz RCUSODZVEHZZGC-UHFFFAOYSA-N 0 0 387.421 3.253 20 5 GGBDRN Cc1c(CSc2nnc(-c3cccc(N(C)C)c3)n2N)cccc1[N+](=O)[O-] ZINC000127197860 1415684380 /nfs/dbraw/zinc/68/43/80/1415684380.db2.gz ORYKZUHGXVRABT-UHFFFAOYSA-N 0 0 384.465 3.234 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2nnc(Cc3ccccc3C)o2)c1 ZINC000127212702 1415688930 /nfs/dbraw/zinc/68/89/30/1415688930.db2.gz TZSGDQQOOZVCQL-UHFFFAOYSA-N 0 0 383.360 3.243 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000178062512 1428963512 /nfs/dbraw/zinc/96/35/12/1428963512.db2.gz QUNPYXOITRWUTE-CYBMUJFWSA-N 0 0 378.388 3.267 20 5 GGBDRN O=C(NCc1ccnc(OC2CCC2)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000127216661 1415690414 /nfs/dbraw/zinc/69/04/14/1415690414.db2.gz JLFLRLRMPYZSBH-UHFFFAOYSA-N 0 0 393.403 3.037 20 5 GGBDRN CCCNC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC)C1 ZINC000127224178 1415693794 /nfs/dbraw/zinc/69/37/94/1415693794.db2.gz KNZCALWCXKTEJN-ZDUSSCGKSA-N 0 0 379.482 3.085 20 5 GGBDRN COc1cc(N2CCC(OC(=O)c3cccc4c[nH]nc43)CC2)ccc1[N+](=O)[O-] ZINC000127227247 1415693975 /nfs/dbraw/zinc/69/39/75/1415693975.db2.gz NHSALPHEWMIMOR-UHFFFAOYSA-N 0 0 396.403 3.306 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC(C)(C)c2ccccc21 ZINC000127227225 1415694449 /nfs/dbraw/zinc/69/44/49/1415694449.db2.gz BQPILNHRNZMEDR-ACJLOTCBSA-N 0 0 381.432 3.252 20 5 GGBDRN CCc1nc2cc(NC(=O)C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)ccc2o1 ZINC000178063288 1428964404 /nfs/dbraw/zinc/96/44/04/1428964404.db2.gz KWWPJBRGKPONCG-GFCCVEGCSA-N 0 0 396.403 3.423 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cc(F)c(F)cc2F)cc1[N+](=O)[O-] ZINC000178063378 1428964500 /nfs/dbraw/zinc/96/45/00/1428964500.db2.gz XHFUDQGCZFENQV-SECBINFHSA-N 0 0 381.310 3.136 20 5 GGBDRN CCO[C@@H]1C[C@H](N(C)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C12CCC2 ZINC000127227443 1415694613 /nfs/dbraw/zinc/69/46/13/1415694613.db2.gz JSUUYGBHBFEOHE-RBUKOAKNSA-N 0 0 398.463 3.056 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccn2ccnc2c1 ZINC000178063601 1428964709 /nfs/dbraw/zinc/96/47/09/1428964709.db2.gz BQZHVINGYRUCLK-UHFFFAOYSA-N 0 0 382.423 3.119 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000178063987 1428964829 /nfs/dbraw/zinc/96/48/29/1428964829.db2.gz UCCHYZLSHVRPMH-NSHDSACASA-N 0 0 393.346 3.321 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccc3ccn(C)c3c2)cc1[N+](=O)[O-] ZINC000178063951 1428964834 /nfs/dbraw/zinc/96/48/34/1428964834.db2.gz XZCJTLJZGLDBCX-ZDUSSCGKSA-N 0 0 380.404 3.211 20 5 GGBDRN C[C@H](CCC(C)(C)C)NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000127232813 1415696571 /nfs/dbraw/zinc/69/65/71/1415696571.db2.gz YWOYTBQVBLSDSV-OAHLLOKOSA-N 0 0 390.484 3.277 20 5 GGBDRN CCc1nc2cc(NC(=O)C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)ccc2o1 ZINC000178063270 1428964900 /nfs/dbraw/zinc/96/49/00/1428964900.db2.gz KWWPJBRGKPONCG-LBPRGKRZSA-N 0 0 396.403 3.423 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178064558 1428965146 /nfs/dbraw/zinc/96/51/46/1428965146.db2.gz IZUHVTPPWUDRBP-LLVKDONJSA-N 0 0 391.811 3.381 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2cccc3cnccc32)cc1[N+](=O)[O-] ZINC000178064505 1428965352 /nfs/dbraw/zinc/96/53/52/1428965352.db2.gz PFUOIWOXXFTVTO-ZDUSSCGKSA-N 0 0 378.388 3.267 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccc3ncccc3c2)cc1[N+](=O)[O-] ZINC000178064825 1428965361 /nfs/dbraw/zinc/96/53/61/1428965361.db2.gz IAMGZMLEQTYGQL-ZDUSSCGKSA-N 0 0 378.388 3.267 20 5 GGBDRN COc1cc(N2CCC(OC(=O)[C@H]3CC3(Cl)Cl)CC2)ccc1[N+](=O)[O-] ZINC000127238668 1415699643 /nfs/dbraw/zinc/69/96/43/1415699643.db2.gz PDJYDXMCUCCKGO-GFCCVEGCSA-N 0 0 389.235 3.309 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000127251709 1415704448 /nfs/dbraw/zinc/70/44/48/1415704448.db2.gz BMIUNBQJBJZWRE-PIGZYNQJSA-N 0 0 380.832 3.036 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1(C)C ZINC000127255431 1415705590 /nfs/dbraw/zinc/70/55/90/1415705590.db2.gz FYRSGFXTMLDJRF-RTBURBONSA-N 0 0 389.496 3.473 20 5 GGBDRN COCCCOc1cc(C)ccc1CNC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000127268889 1415711621 /nfs/dbraw/zinc/71/16/21/1415711621.db2.gz SKHXIVGPWKDYJJ-UHFFFAOYSA-N 0 0 376.384 3.388 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2c(F)cccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000127284530 1415717750 /nfs/dbraw/zinc/71/77/50/1415717750.db2.gz KBUMUFXPQOQXJD-UHFFFAOYSA-N 0 0 395.412 3.144 20 5 GGBDRN NS(=O)(=O)c1ccc2c(c1)CCN2Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127296373 1415724363 /nfs/dbraw/zinc/72/43/63/1415724363.db2.gz OAUHBKWDHMJHBB-UHFFFAOYSA-N 0 0 399.428 3.065 20 5 GGBDRN Cc1ccc(S(=O)(=O)Nc2c(F)cccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000127298506 1415725006 /nfs/dbraw/zinc/72/50/06/1415725006.db2.gz ULZKEMOBWHSWND-UHFFFAOYSA-N 0 0 379.413 3.443 20 5 GGBDRN CCCCNC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC)C1 ZINC000127305991 1415728865 /nfs/dbraw/zinc/72/88/65/1415728865.db2.gz WYBUJHWDXPFVLD-AWEZNQCLSA-N 0 0 393.509 3.475 20 5 GGBDRN CN(C(=O)C1CCN(C(=O)CCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000127313654 1415731481 /nfs/dbraw/zinc/73/14/81/1415731481.db2.gz KCPSULUJNYCXQB-UHFFFAOYSA-N 0 0 395.459 3.429 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000127320907 1415735647 /nfs/dbraw/zinc/73/56/47/1415735647.db2.gz QLVJJHWLHHYZBU-QWHCGFSZSA-N 0 0 377.828 3.061 20 5 GGBDRN O=C(Nc1cccc(N2CCCC2=O)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000127327370 1415738908 /nfs/dbraw/zinc/73/89/08/1415738908.db2.gz DILNIZYGHAIKSI-UHFFFAOYSA-N 0 0 391.387 3.160 20 5 GGBDRN CCOC(=O)CCN(Cc1cccnc1)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000127340505 1415744257 /nfs/dbraw/zinc/74/42/57/1415744257.db2.gz USCBMJFGMFQNMO-UHFFFAOYSA-N 0 0 380.404 3.498 20 5 GGBDRN CCN(CC)C(=O)Cn1ccc2cc(NC(=O)c3ccc([N+](=O)[O-])o3)ccc21 ZINC000127341745 1415744783 /nfs/dbraw/zinc/74/47/83/1415744783.db2.gz STXPEDVNYOERLZ-UHFFFAOYSA-N 0 0 384.392 3.263 20 5 GGBDRN CC[C@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)Oc1ccccc1C ZINC000178110356 1428985829 /nfs/dbraw/zinc/98/58/29/1428985829.db2.gz XOOTWLYMOQYQFB-OAHLLOKOSA-N 0 0 385.420 3.124 20 5 GGBDRN CC[C@@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)Oc1ccccc1C ZINC000178110344 1428986045 /nfs/dbraw/zinc/98/60/45/1428986045.db2.gz XOOTWLYMOQYQFB-HNNXBMFYSA-N 0 0 385.420 3.124 20 5 GGBDRN CC[C@@H](CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)Oc1ccccc1C ZINC000178110613 1428986110 /nfs/dbraw/zinc/98/61/10/1428986110.db2.gz ZNPOUEOCVOAFQL-INIZCTEOSA-N 0 0 385.420 3.124 20 5 GGBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000178111168 1428986591 /nfs/dbraw/zinc/98/65/91/1428986591.db2.gz QDIADVPQORSSEB-XJKSGUPXSA-N 0 0 393.465 3.073 20 5 GGBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1(C)C ZINC000127361714 1415752919 /nfs/dbraw/zinc/75/29/19/1415752919.db2.gz DMIZMMPNWQYEPZ-ROUUACIJSA-N 0 0 375.469 3.471 20 5 GGBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1(C)C ZINC000127362140 1415753125 /nfs/dbraw/zinc/75/31/25/1415753125.db2.gz DMIZMMPNWQYEPZ-MSOLQXFVSA-N 0 0 375.469 3.471 20 5 GGBDRN CC[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccccc1 ZINC000127364538 1415753994 /nfs/dbraw/zinc/75/39/94/1415753994.db2.gz WDGJGEZGIOAPME-MRXNPFEDSA-N 0 0 383.448 3.355 20 5 GGBDRN COc1cc(N[C@@H]2CCCN(C(=O)c3csc([N+](=O)[O-])c3)C2)cc(OC)c1 ZINC000178115603 1428988216 /nfs/dbraw/zinc/98/82/16/1428988216.db2.gz KWGFBOICNAIEQS-CYBMUJFWSA-N 0 0 391.449 3.390 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000127389752 1415763004 /nfs/dbraw/zinc/76/30/04/1415763004.db2.gz DIBUDBAPCNSYKK-SGTLLEGYSA-N 0 0 394.859 3.344 20 5 GGBDRN CC[C@@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)Oc1cccc(C)c1 ZINC000178088991 1428976581 /nfs/dbraw/zinc/97/65/81/1428976581.db2.gz HGBCOMOMCRASRN-HNNXBMFYSA-N 0 0 385.420 3.124 20 5 GGBDRN CC(C)N(CC(=O)Nc1ccc(F)cc1)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000127424125 1415773533 /nfs/dbraw/zinc/77/35/33/1415773533.db2.gz JLXJZPSNLKKWMT-UHFFFAOYSA-N 0 0 391.374 3.291 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000127447170 1415781503 /nfs/dbraw/zinc/78/15/03/1415781503.db2.gz ZCHIAIRPWUFSOS-UHFFFAOYSA-N 0 0 399.447 3.149 20 5 GGBDRN CC(C)NC(=O)Nc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000127449617 1415782753 /nfs/dbraw/zinc/78/27/53/1415782753.db2.gz SEMUSUYKTJWGHM-UHFFFAOYSA-N 0 0 382.420 3.323 20 5 GGBDRN O=C(NCc1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127458406 1415786169 /nfs/dbraw/zinc/78/61/69/1415786169.db2.gz UKGSRJUAXRMKQN-UHFFFAOYSA-N 0 0 381.388 3.108 20 5 GGBDRN Cc1ccccc1C[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127462116 1415788800 /nfs/dbraw/zinc/78/88/00/1415788800.db2.gz FRPICAXGLZHSSE-MRXNPFEDSA-N 0 0 383.448 3.101 20 5 GGBDRN O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000178140537 1428995967 /nfs/dbraw/zinc/99/59/67/1428995967.db2.gz ZVUXTIPGAQBSOP-ZDUSSCGKSA-N 0 0 397.456 3.239 20 5 GGBDRN O=C(COc1ccc(Br)nc1)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000127494957 1415800719 /nfs/dbraw/zinc/80/07/19/1415800719.db2.gz IEHLROKYPXNRIG-UHFFFAOYSA-N 0 0 386.589 3.423 20 5 GGBDRN CC(C)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CC1 ZINC000127495779 1415801099 /nfs/dbraw/zinc/80/10/99/1415801099.db2.gz LYDIEFOMYRSRJZ-UHFFFAOYSA-N 0 0 382.464 3.373 20 5 GGBDRN Nc1c([N+](=O)[O-])cnn1CC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000127496404 1415801139 /nfs/dbraw/zinc/80/11/39/1415801139.db2.gz STOBPOUGJLOPFP-UHFFFAOYSA-N 0 0 387.783 3.458 20 5 GGBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000127534072 1415805930 /nfs/dbraw/zinc/80/59/30/1415805930.db2.gz ZZWQTRVNEIQOLT-ABAIWWIYSA-N 0 0 380.832 3.072 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CC[C@@H](c2ccccc2)C1 ZINC000127564735 1415810535 /nfs/dbraw/zinc/81/05/35/1415810535.db2.gz OFHYQVRQWCLEHI-QGZVFWFLSA-N 0 0 381.432 3.061 20 5 GGBDRN C[C@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000127583323 1415813641 /nfs/dbraw/zinc/81/36/41/1415813641.db2.gz GYPQEPBMQPTJPE-HNNXBMFYSA-N 0 0 397.431 3.264 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000127582346 1415813798 /nfs/dbraw/zinc/81/37/98/1415813798.db2.gz WIRREKUZMKLGOO-GOSISDBHSA-N 0 0 398.463 3.234 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1OS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000127594757 1415815958 /nfs/dbraw/zinc/81/59/58/1415815958.db2.gz VWUVPHCBJJXLMB-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN COc1ccc(NC(=O)c2nnn(-c3cccc(Cl)c3)c2C)c([N+](=O)[O-])c1 ZINC000127614204 1415820267 /nfs/dbraw/zinc/82/02/67/1415820267.db2.gz XCHHAJBUDHZVNY-UHFFFAOYSA-N 0 0 387.783 3.398 20 5 GGBDRN CCCc1csc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)n1 ZINC000127628383 1415822448 /nfs/dbraw/zinc/82/24/48/1415822448.db2.gz DAYCMLJWEXUILR-UHFFFAOYSA-N 0 0 376.438 3.093 20 5 GGBDRN COc1ccc2cc(CNc3cc([N+](=O)[O-])ccc3S(N)(=O)=O)ccc2c1 ZINC000127630137 1415823030 /nfs/dbraw/zinc/82/30/30/1415823030.db2.gz KCPRXACJMNMAQJ-UHFFFAOYSA-N 0 0 387.417 3.016 20 5 GGBDRN COC(=O)c1cc(OCc2nc(-c3ccc(F)c(C)c3)no2)ccc1[N+](=O)[O-] ZINC000178156942 1429001822 /nfs/dbraw/zinc/00/18/22/1429001822.db2.gz KBNQGINXUSMWOB-UHFFFAOYSA-N 0 0 387.323 3.458 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1OS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000127633129 1415823589 /nfs/dbraw/zinc/82/35/89/1415823589.db2.gz HPEXJFXRRFGZJQ-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN Nc1c(C(=O)NCc2ccc(COCC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000178155484 1429002064 /nfs/dbraw/zinc/00/20/64/1429002064.db2.gz QKTJQEUBXNWZGQ-UHFFFAOYSA-N 0 0 383.326 3.186 20 5 GGBDRN CCCOc1ccc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1OCCC ZINC000127648583 1415825697 /nfs/dbraw/zinc/82/56/97/1415825697.db2.gz ZANDWEUPUYRPKU-UHFFFAOYSA-N 0 0 376.413 3.467 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000127655067 1415826954 /nfs/dbraw/zinc/82/69/54/1415826954.db2.gz SDPRGLXPFVJHIV-FUHWJXTLSA-N 0 0 395.459 3.450 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000127660042 1415828080 /nfs/dbraw/zinc/82/80/80/1415828080.db2.gz AKXUDRKHKSEDLM-MRVPVSSYSA-N 0 0 397.284 3.143 20 5 GGBDRN O=C(Nc1cc(F)c(F)c(F)c1)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000127660302 1415828255 /nfs/dbraw/zinc/82/82/55/1415828255.db2.gz AKXUDRKHKSEDLM-QMMMGPOBSA-N 0 0 397.284 3.143 20 5 GGBDRN CN(C(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C1CC1 ZINC000127662015 1415828706 /nfs/dbraw/zinc/82/87/06/1415828706.db2.gz GLDACNRDTQFJOU-INIZCTEOSA-N 0 0 391.493 3.028 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccccc2S(=O)(=O)N2CCCCC2)n1 ZINC000178161326 1429003051 /nfs/dbraw/zinc/00/30/51/1429003051.db2.gz QVERNJROPKGPDW-UHFFFAOYSA-N 0 0 390.465 3.085 20 5 GGBDRN C[C@@H](O)[C@H]1CCCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000127668530 1415829793 /nfs/dbraw/zinc/82/97/93/1415829793.db2.gz HXVRVWJNSNXRJU-WBVHZDCISA-N 0 0 375.469 3.064 20 5 GGBDRN CN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccc(Cl)c(F)c1 ZINC000127668136 1415829909 /nfs/dbraw/zinc/82/99/09/1415829909.db2.gz IEXRPDAFRUMASH-UHFFFAOYSA-N 0 0 395.774 3.187 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCNC(=O)c1cccc(F)c1 ZINC000127677421 1415831467 /nfs/dbraw/zinc/83/14/67/1415831467.db2.gz AYYABVQMNPTKKA-UHFFFAOYSA-N 0 0 388.399 3.292 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000127695119 1415834674 /nfs/dbraw/zinc/83/46/74/1415834674.db2.gz JQTZBBYGFJHBFB-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1cc(F)ccc1N1CCC(O)CC1 ZINC000127705072 1415836250 /nfs/dbraw/zinc/83/62/50/1415836250.db2.gz UUDITWNLHTUNOA-LLVKDONJSA-N 0 0 393.440 3.248 20 5 GGBDRN CCC(CC)[C@H](CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)N1CCOCC1 ZINC000127709692 1415837301 /nfs/dbraw/zinc/83/73/01/1415837301.db2.gz NGSJFOMJCCIUNC-SFHVURJKSA-N 0 0 392.500 3.470 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)[C@@H](C)c1ccccc1 ZINC000127717078 1415837974 /nfs/dbraw/zinc/83/79/74/1415837974.db2.gz CBERYWTYFJYUBI-CVEARBPZSA-N 0 0 383.448 3.353 20 5 GGBDRN CSc1ccc(C(=O)N[C@@](C)(C(N)=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000178169723 1429005504 /nfs/dbraw/zinc/00/55/04/1429005504.db2.gz RUCSBOKYYJSHNX-QGZVFWFLSA-N 0 0 393.852 3.101 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCS(=O)(=O)c1ccccc1 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FTPCKNHGDRTPID-UHFFFAOYSA-N 0 0 380.404 3.488 20 5 GGBDRN COc1ccc(C2=N/C(=C\c3c(Cl)nc4ccccn43)C(=O)O2)cc1[N+](=O)[O-] ZINC000127927547 1415877094 /nfs/dbraw/zinc/87/70/94/1415877094.db2.gz LBIOVGAQGRXYJY-LUAWRHEFSA-N 0 0 398.762 3.249 20 5 GGBDRN CC(C)CC[C@H]1CCCCN1C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000127937672 1415878791 /nfs/dbraw/zinc/87/87/91/1415878791.db2.gz BJNDMEPCTQBSMI-CQSZACIVSA-N 0 0 375.425 3.320 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(n2ccnc2)CC1 ZINC000127947140 1415880712 /nfs/dbraw/zinc/88/07/12/1415880712.db2.gz WZZYTSDNMHRSIN-UHFFFAOYSA-N 0 0 390.465 3.007 20 5 GGBDRN Cc1nn(-c2ccccc2)c(C)c1COC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000127958555 1415883597 /nfs/dbraw/zinc/88/35/97/1415883597.db2.gz ZYEUTWJHEHWEOB-UHFFFAOYSA-N 0 0 383.408 3.036 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000128030030 1415897153 /nfs/dbraw/zinc/89/71/53/1415897153.db2.gz UIDNIMFKZWYPFU-UHFFFAOYSA-N 0 0 377.404 3.195 20 5 GGBDRN O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000178205518 1429018305 /nfs/dbraw/zinc/01/83/05/1429018305.db2.gz VKFGGHNJDFOPHS-CQSZACIVSA-N 0 0 394.214 3.437 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(C)nc2Br)c([N+](=O)[O-])cc1OC ZINC000128069391 1415905437 /nfs/dbraw/zinc/90/54/37/1415905437.db2.gz HRIIUCACVMEJFV-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN CCCc1cnc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)s1 ZINC000128077457 1415906666 /nfs/dbraw/zinc/90/66/66/1415906666.db2.gz YYQGQNMQAPYGNW-UHFFFAOYSA-N 0 0 376.438 3.093 20 5 GGBDRN Cc1cc(F)cc(C(=O)N2CCN(Cc3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000178237125 1429026801 /nfs/dbraw/zinc/02/68/01/1429026801.db2.gz WKSACGCSIBLVDK-UHFFFAOYSA-N 0 0 375.375 3.139 20 5 GGBDRN Cc1cc(NC(=O)[C@H]2Cc3cc(F)ccc3O2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000128095322 1415911529 /nfs/dbraw/zinc/91/15/29/1415911529.db2.gz SJKGXXLLHQZEEC-QGZVFWFLSA-N 0 0 382.351 3.170 20 5 GGBDRN C[C@@H]1CCCN(c2ccc(C(=O)N(C)C[C@@H]3CCC[C@@H]3O)cc2[N+](=O)[O-])C1 ZINC000128116039 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ZINC000128395507 1415977955 /nfs/dbraw/zinc/97/79/55/1415977955.db2.gz WPYRFGCFNCRTPZ-UHFFFAOYSA-N 0 0 377.347 3.270 20 5 GGBDRN Cn1cc(CNc2ccc([S@@](C)=O)c(F)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000178249352 1429032863 /nfs/dbraw/zinc/03/28/63/1429032863.db2.gz JBABMCCSEBWSRX-HHHXNRCGSA-N 0 0 388.424 3.484 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(C)Cc2nc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000128433104 1415985857 /nfs/dbraw/zinc/98/58/57/1415985857.db2.gz AGWOYJKVFPJXKH-UHFFFAOYSA-N 0 0 384.417 3.110 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCN(c3ccccc3C)CC2)cc1OC ZINC000128452598 1415990263 /nfs/dbraw/zinc/99/02/63/1415990263.db2.gz QFXBWOBZPZLRKY-UHFFFAOYSA-N 0 0 399.447 3.273 20 5 GGBDRN COc1cc(CCNC(=O)Nc2cc(C)cc(F)c2)c([N+](=O)[O-])cc1OC ZINC000178257252 1429035010 /nfs/dbraw/zinc/03/50/10/1429035010.db2.gz MBRZNVRWZAKSLQ-UHFFFAOYSA-N 0 0 377.372 3.424 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000128492813 1415999832 /nfs/dbraw/zinc/99/98/32/1415999832.db2.gz WCLAVMDTJASEOJ-QGZVFWFLSA-N 0 0 392.477 3.173 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000128508952 1416002026 /nfs/dbraw/zinc/00/20/26/1416002026.db2.gz QDIDAFALCZQXCM-HOCLYGCPSA-N 0 0 381.432 3.290 20 5 GGBDRN CCOC(=O)CN(CC(C)C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128519955 1416005283 /nfs/dbraw/zinc/00/52/83/1416005283.db2.gz FOVJULKCCVFOEF-UHFFFAOYSA-N 0 0 376.331 3.275 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000128524841 1416005914 /nfs/dbraw/zinc/00/59/14/1416005914.db2.gz NSJPSXWDNXDCHD-UHFFFAOYSA-N 0 0 377.422 3.307 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](CCO)c1ccccc1 ZINC000128551505 1416011343 /nfs/dbraw/zinc/01/13/43/1416011343.db2.gz BJVILGWZSCXKIZ-IUODEOHRSA-N 0 0 378.812 3.255 20 5 GGBDRN Cc1cc(=O)n(CCC(=O)N[C@H](c2cccs2)c2ccccc2)cc1[N+](=O)[O-] ZINC000128560133 1416013712 /nfs/dbraw/zinc/01/37/12/1416013712.db2.gz NMXUQYVCVDUXNI-FQEVSTJZSA-N 0 0 397.456 3.422 20 5 GGBDRN COc1cccc([C@@H]2CCCN2S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000128570841 1416016114 /nfs/dbraw/zinc/01/61/14/1416016114.db2.gz VERWJBWIOLPLBC-HNNXBMFYSA-N 0 0 380.397 3.268 20 5 GGBDRN COc1ccc(OCCNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000178277084 1429040519 /nfs/dbraw/zinc/04/05/19/1429040519.db2.gz CVLSOQFBGBPJMD-UHFFFAOYSA-N 0 0 385.420 3.356 20 5 GGBDRN CCCCOc1ccc(-c2nnc(Cn3cc([N+](=O)[O-])c(C)cc3=O)o2)cc1 ZINC000128609104 1416024521 /nfs/dbraw/zinc/02/45/21/1416024521.db2.gz JEHSQJVEBFDHDL-UHFFFAOYSA-N 0 0 384.392 3.342 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(C)CCOc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000128636910 1416031243 /nfs/dbraw/zinc/03/12/43/1416031243.db2.gz BAAZGOABBCGBCZ-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN Cc1cc(=O)n(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000128645397 1416032610 /nfs/dbraw/zinc/03/26/10/1416032610.db2.gz STPRHMBXIWFSHH-UHFFFAOYSA-N 0 0 389.717 3.376 20 5 GGBDRN CN(Cc1ccccc1)C(=O)CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128650307 1416033752 /nfs/dbraw/zinc/03/37/52/1416033752.db2.gz OMHWPCGKAUXAQX-UHFFFAOYSA-N 0 0 395.337 3.002 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CCc2ccc(Cl)cc2C1 ZINC000128650959 1416033910 /nfs/dbraw/zinc/03/39/10/1416033910.db2.gz YUWVAFMTTBSFHU-UHFFFAOYSA-N 0 0 383.795 3.027 20 5 GGBDRN Cc1cc(=O)n(CC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)cc1[N+](=O)[O-] ZINC000128657507 1416035392 /nfs/dbraw/zinc/03/53/92/1416035392.db2.gz VFLLKQHOLZEZQG-IBGZPJMESA-N 0 0 391.427 3.165 20 5 GGBDRN O=C(c1ccccc1)c1ccc(N2CCC[C@H](Cn3ccnn3)C2)c([N+](=O)[O-])c1 ZINC000128675220 1416039935 /nfs/dbraw/zinc/03/99/35/1416039935.db2.gz KKEKPDBAVMHGOF-INIZCTEOSA-N 0 0 391.431 3.334 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000128680119 1416040937 /nfs/dbraw/zinc/04/09/37/1416040937.db2.gz OPRSLNGHWGLNIY-RDJZCZTQSA-N 0 0 394.424 3.011 20 5 GGBDRN Cc1occc1CN(C)S(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000178312251 1429049493 /nfs/dbraw/zinc/04/94/93/1429049493.db2.gz JXMKSTNABNBLMD-UHFFFAOYSA-N 0 0 389.227 3.079 20 5 GGBDRN Cc1ccccc1OCCN(C)C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000128693459 1416044001 /nfs/dbraw/zinc/04/40/01/1416044001.db2.gz NJBUAQFEOHJRBL-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN CC(C)C(=O)Nc1nc(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cs1 ZINC000128692201 1416044225 /nfs/dbraw/zinc/04/42/25/1416044225.db2.gz RMNNZWXQDPQEBO-UHFFFAOYSA-N 0 0 382.829 3.480 20 5 GGBDRN COC(=O)C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccs1 ZINC000128694910 1416045007 /nfs/dbraw/zinc/04/50/07/1416045007.db2.gz APOYBLVRXZRQHC-OAHLLOKOSA-N 0 0 387.417 3.101 20 5 GGBDRN Cc1noc([C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)C2)n1 ZINC000128700892 1416046488 /nfs/dbraw/zinc/04/64/88/1416046488.db2.gz WFKJGIZRYNJTJS-SNVBAGLBSA-N 0 0 384.314 3.325 20 5 GGBDRN C[C@]1(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCC[C@@H]1O ZINC000178325121 1429051544 /nfs/dbraw/zinc/05/15/44/1429051544.db2.gz SPLHUJBZAVPWSU-MAUKXSAKSA-N 0 0 375.450 3.389 20 5 GGBDRN Cc1nc(COc2cccc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)c2)no1 ZINC000128724669 1416051887 /nfs/dbraw/zinc/05/18/87/1416051887.db2.gz ILKLQDUTMDKMGM-UHFFFAOYSA-N 0 0 394.387 3.458 20 5 GGBDRN Cc1c(CC(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000128725050 1416051993 /nfs/dbraw/zinc/05/19/93/1416051993.db2.gz SBUUJMXSCZVOFI-AWEZNQCLSA-N 0 0 380.404 3.297 20 5 GGBDRN COc1ccc2c(c1)N(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C[C@@H](C)O2 ZINC000128726037 1416052029 /nfs/dbraw/zinc/05/20/29/1416052029.db2.gz XRTOVGRZWYZDTI-GFCCVEGCSA-N 0 0 389.383 3.359 20 5 GGBDRN C[C@]1(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCC[C@H]1O ZINC000178325148 1429051592 /nfs/dbraw/zinc/05/15/92/1429051592.db2.gz SPLHUJBZAVPWSU-CRAIPNDOSA-N 0 0 375.450 3.389 20 5 GGBDRN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000128734404 1416054808 /nfs/dbraw/zinc/05/48/08/1416054808.db2.gz FAPAZNASIPAALB-UHFFFAOYSA-N 0 0 399.451 3.275 20 5 GGBDRN COc1cc(OCC(=O)N2CCc3ccc(Cl)cc3C2)ccc1[N+](=O)[O-] ZINC000128736758 1416055358 /nfs/dbraw/zinc/05/53/58/1416055358.db2.gz DLDNKKNECMDJFG-UHFFFAOYSA-N 0 0 376.796 3.221 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](C)CN(C)c2ccccc21 ZINC000128771442 1416064132 /nfs/dbraw/zinc/06/41/32/1416064132.db2.gz CCXBSKLENVNYII-CQSZACIVSA-N 0 0 384.436 3.134 20 5 GGBDRN COc1ccc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1Cl ZINC000128772377 1416064473 /nfs/dbraw/zinc/06/44/73/1416064473.db2.gz BLVHVXRVHJRICW-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-] ZINC000128773939 1416065136 /nfs/dbraw/zinc/06/51/36/1416065136.db2.gz RCFKNMHKGYNHBN-OAHLLOKOSA-N 0 0 391.811 3.456 20 5 GGBDRN CC(C)[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)OC(C)(C)C ZINC000128781410 1416067219 /nfs/dbraw/zinc/06/72/19/1416067219.db2.gz YIGURBKMRZPHBC-KRWDZBQOSA-N 0 0 375.425 3.101 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000128782184 1416067983 /nfs/dbraw/zinc/06/79/83/1416067983.db2.gz OLSQETAIQMRCCF-HNNXBMFYSA-N 0 0 394.836 3.157 20 5 GGBDRN C[C@H](C[C@H](O)c1ccco1)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000128786858 1416068448 /nfs/dbraw/zinc/06/84/48/1416068448.db2.gz UQPOIEIRNBYVTP-SKDRFNHKSA-N 0 0 385.323 3.423 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccco1)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000128787098 1416069383 /nfs/dbraw/zinc/06/93/83/1416069383.db2.gz UQPOIEIRNBYVTP-JOYOIKCWSA-N 0 0 385.323 3.423 20 5 GGBDRN COc1ccc(Cn2nc(Br)c(=O)c3ccccc32)cc1[N+](=O)[O-] ZINC000128805384 1416073052 /nfs/dbraw/zinc/07/30/52/1416073052.db2.gz USBRSBMUNZJNIY-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN Cc1cc(Cl)cc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1O ZINC000128819554 1416076826 /nfs/dbraw/zinc/07/68/26/1416076826.db2.gz CMKJYHGGTJEXQR-UHFFFAOYSA-N 0 0 391.811 3.351 20 5 GGBDRN COc1cc(N2CCC(OC(=O)CCc3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000128832399 1416079996 /nfs/dbraw/zinc/07/99/96/1416079996.db2.gz NFKHWMJJFWRZQQ-UHFFFAOYSA-N 0 0 385.420 3.143 20 5 GGBDRN Cc1nn(CCC(=O)NCc2cc(C)ccc2OC(F)F)c(C)c1[N+](=O)[O-] ZINC000128838374 1416082305 /nfs/dbraw/zinc/08/23/05/1416082305.db2.gz IAJGWFMNUQDMGX-UHFFFAOYSA-N 0 0 382.367 3.024 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cccnc1OCC(F)F ZINC000128847917 1416083968 /nfs/dbraw/zinc/08/39/68/1416083968.db2.gz XSQRWMKNFBNYAL-UHFFFAOYSA-N 0 0 380.351 3.465 20 5 GGBDRN CCCOCc1ccccc1CNC(=O)COc1ccc([N+](=O)[O-])cc1F ZINC000128874509 1416089871 /nfs/dbraw/zinc/08/98/71/1416089871.db2.gz QYFWZUTYOURBAX-UHFFFAOYSA-N 0 0 376.384 3.356 20 5 GGBDRN CC(C)OCc1ccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000128874767 1416090846 /nfs/dbraw/zinc/09/08/46/1416090846.db2.gz UGXKRIXUGQCPIW-UHFFFAOYSA-N 0 0 376.384 3.354 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C(=O)Nc2ccccc2O)CC1 ZINC000178348848 1429058327 /nfs/dbraw/zinc/05/83/27/1429058327.db2.gz HLFLWMRTHGFMCQ-UHFFFAOYSA-N 0 0 383.404 3.100 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(CC1CC1)C1CCCCC1 ZINC000128884407 1416092799 /nfs/dbraw/zinc/09/27/99/1416092799.db2.gz DJSBPIUSTOJMSX-UHFFFAOYSA-N 0 0 375.425 3.113 20 5 GGBDRN C[C@H](O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000128886742 1416093218 /nfs/dbraw/zinc/09/32/18/1416093218.db2.gz KFCGPPXFIHAMIX-HOTGVXAUSA-N 0 0 375.469 3.064 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000128889292 1416094146 /nfs/dbraw/zinc/09/41/46/1416094146.db2.gz IUYHNMGFIKLNMK-UHFFFAOYSA-N 0 0 377.404 3.045 20 5 GGBDRN Cc1ccccc1[C@H](O)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000128894321 1416095375 /nfs/dbraw/zinc/09/53/75/1416095375.db2.gz GMLFXNWSMZDGPF-OAHLLOKOSA-N 0 0 379.210 3.129 20 5 GGBDRN C[C@@H](O)C[C@@H](CNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 ZINC000128908834 1416098838 /nfs/dbraw/zinc/09/88/38/1416098838.db2.gz FIKMMIMDFPYUNY-OCCSQVGLSA-N 0 0 398.868 3.081 20 5 GGBDRN CC[C@@H]1CCC[C@H](NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)C1 ZINC000128914155 1416100360 /nfs/dbraw/zinc/10/03/60/1416100360.db2.gz OYVXLLMMEWEAFH-CABCVRRESA-N 0 0 384.436 3.148 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cccc2ncccc21 ZINC000128914460 1416100915 /nfs/dbraw/zinc/10/09/15/1416100915.db2.gz CFDLELRFELFKCU-UHFFFAOYSA-N 0 0 392.415 3.256 20 5 GGBDRN O=C(Nc1cccc(-c2cn[nH]c2)c1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000128916222 1416101143 /nfs/dbraw/zinc/10/11/43/1416101143.db2.gz ZQLCAKLHSPBIOL-UHFFFAOYSA-N 0 0 375.344 3.079 20 5 GGBDRN CC[C@H]1CCC[C@H](NC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)C1 ZINC000128914358 1416101209 /nfs/dbraw/zinc/10/12/09/1416101209.db2.gz OYVXLLMMEWEAFH-GJZGRUSLSA-N 0 0 384.436 3.148 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000178311253 1429049040 /nfs/dbraw/zinc/04/90/40/1429049040.db2.gz JHXNEKXKLSHAHP-UHFFFAOYSA-N 0 0 396.447 3.219 20 5 GGBDRN O=C(NCc1ccc(-n2cncn2)cc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128934691 1416107634 /nfs/dbraw/zinc/10/76/34/1416107634.db2.gz DRGPFRVFWDWSQY-UHFFFAOYSA-N 0 0 391.309 3.124 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2C[C@H]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000178354283 1429059262 /nfs/dbraw/zinc/05/92/62/1429059262.db2.gz YRUXDTBDWMPUDK-ZIAGYGMSSA-N 0 0 387.465 3.137 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2C[C@@H]3CCCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000178354297 1429059751 /nfs/dbraw/zinc/05/97/51/1429059751.db2.gz YRUXDTBDWMPUDK-KBPBESRZSA-N 0 0 387.465 3.137 20 5 GGBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000128956914 1416112846 /nfs/dbraw/zinc/11/28/46/1416112846.db2.gz LWWPNHKWKWZCBB-SJKOYZFVSA-N 0 0 398.868 3.444 20 5 GGBDRN O=C(CNc1ccc(-n2cccn2)c(Cl)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178361882 1429060872 /nfs/dbraw/zinc/06/08/72/1429060872.db2.gz SSUZPGICGYTFPF-UHFFFAOYSA-N 0 0 397.822 3.435 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1Cn1nc(Br)c(=O)c2ccccc21 ZINC000128982972 1416119459 /nfs/dbraw/zinc/11/94/59/1416119459.db2.gz HYXIMHJURVHZIM-UHFFFAOYSA-N 0 0 390.193 3.124 20 5 GGBDRN Cc1c(CO)cc([N+](=O)[O-])c(N[C@@H](C)C[C@H](O)c2cccs2)c1[N+](=O)[O-] ZINC000128993093 1416121447 /nfs/dbraw/zinc/12/14/47/1416121447.db2.gz JMHOXTQXSPONLD-ZANVPECISA-N 0 0 381.410 3.289 20 5 GGBDRN COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)cc1 ZINC000129036170 1416130402 /nfs/dbraw/zinc/13/04/02/1416130402.db2.gz WUSPMEUCKHJIIU-JTQLQIEISA-N 0 0 378.331 3.477 20 5 GGBDRN COc1cc(CCNC(=O)Cc2ccc(F)cc2Cl)c([N+](=O)[O-])cc1OC ZINC000178372611 1429063925 /nfs/dbraw/zinc/06/39/25/1429063925.db2.gz DTUOKVXWYKRYQN-UHFFFAOYSA-N 0 0 396.802 3.306 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NC2CCN(Cc3ccccc3)CC2)s1 ZINC000129063912 1416136218 /nfs/dbraw/zinc/13/62/18/1416136218.db2.gz SRJMBYDAPASDQW-UHFFFAOYSA-N 0 0 395.506 3.136 20 5 GGBDRN CCOc1cccc(COC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129070403 1416137916 /nfs/dbraw/zinc/13/79/16/1416137916.db2.gz NIYGAPUKVFNRBT-UHFFFAOYSA-N 0 0 382.376 3.146 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@H](c2ccco2)N2CCCCC2)s1 ZINC000129076885 1416139539 /nfs/dbraw/zinc/13/95/39/1416139539.db2.gz GRYKVSNEDHETNJ-CYBMUJFWSA-N 0 0 399.494 3.292 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H](CCO)c1ccccc1 ZINC000129079315 1416139753 /nfs/dbraw/zinc/13/97/53/1416139753.db2.gz BNRZYVIMEDVGDY-HNNXBMFYSA-N 0 0 378.812 3.257 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C(=O)N1CCCC[C@H]1C ZINC000129094899 1416143268 /nfs/dbraw/zinc/14/32/68/1416143268.db2.gz GFRDDTXTQDALKF-MNOVXSKESA-N 0 0 387.358 3.133 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC(COc3ccccc3)CC2)s1 ZINC000129144054 1416155511 /nfs/dbraw/zinc/15/55/11/1416155511.db2.gz VSSCFTGCQOMQGR-UHFFFAOYSA-N 0 0 396.490 3.355 20 5 GGBDRN O=C(Nc1cccnc1OCC(F)F)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000129172961 1416162814 /nfs/dbraw/zinc/16/28/14/1416162814.db2.gz FEUJQZHJKWXUKX-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN O=C(NC[C@@H](O)c1ccccc1Cl)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000129184886 1416165501 /nfs/dbraw/zinc/16/55/01/1416165501.db2.gz FCKWYCWWAQMNHO-CQSZACIVSA-N 0 0 399.628 3.474 20 5 GGBDRN Cc1cc(NC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)n(C)n1 ZINC000129192676 1416167483 /nfs/dbraw/zinc/16/74/83/1416167483.db2.gz HTQKXQYSCQTUPU-UHFFFAOYSA-N 0 0 395.206 3.382 20 5 GGBDRN Cc1coc(-c2cc(NC(=O)C(=O)NCc3ccccc3[N+](=O)[O-])ccc2C)n1 ZINC000178417008 1429072927 /nfs/dbraw/zinc/07/29/27/1429072927.db2.gz AZHCTIFCSIPLKB-UHFFFAOYSA-N 0 0 394.387 3.122 20 5 GGBDRN CN(C[C@H]1CCC[C@@H]1O)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000129195765 1416168153 /nfs/dbraw/zinc/16/81/53/1416168153.db2.gz MDLQBYRTKTUERO-ABAIWWIYSA-N 0 0 389.374 3.035 20 5 GGBDRN COc1cccc(Cc2nnc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])s2)c1 ZINC000129196719 1416168456 /nfs/dbraw/zinc/16/84/56/1416168456.db2.gz GNEAQOJEFYWRPF-UHFFFAOYSA-N 0 0 388.380 3.437 20 5 GGBDRN CCc1ccc([C@H]2COCCN2S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])o1 ZINC000129210497 1416171726 /nfs/dbraw/zinc/17/17/26/1416171726.db2.gz GTPMICYWAOWOHM-MRXNPFEDSA-N 0 0 394.449 3.129 20 5 GGBDRN CCc1ccc([C@@H]2COCCN2S(=O)(=O)c2cc([N+](=O)[O-])ccc2CC)o1 ZINC000129214415 1416172181 /nfs/dbraw/zinc/17/21/81/1416172181.db2.gz JTSQKWKPCLYHMY-INIZCTEOSA-N 0 0 394.449 3.075 20 5 GGBDRN Cc1ccc(NCCCNC(=O)CCn2cnc3ccccc32)c([N+](=O)[O-])c1 ZINC000129220657 1416173329 /nfs/dbraw/zinc/17/33/29/1416173329.db2.gz BUFSDUOIZNAWOP-UHFFFAOYSA-N 0 0 381.436 3.261 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cccnc2Cl)ccc1[N+](=O)[O-] ZINC000178407028 1429071942 /nfs/dbraw/zinc/07/19/42/1429071942.db2.gz DXESCBPJYYITTN-HNNXBMFYSA-N 0 0 388.811 3.195 20 5 GGBDRN O=C(NCc1nc(-c2cccs2)no1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000129244757 1416178795 /nfs/dbraw/zinc/17/87/95/1416178795.db2.gz KXIFZIHIRYPTJS-UHFFFAOYSA-N 0 0 381.373 3.185 20 5 GGBDRN Cc1ccc(-c2cc(NC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)n[nH]2)s1 ZINC000129287344 1416185656 /nfs/dbraw/zinc/18/56/56/1416185656.db2.gz VFWRKGFBYMHWHE-UHFFFAOYSA-N 0 0 395.404 3.188 20 5 GGBDRN CSCC[C@@H](C)N(C)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000129296705 1416187022 /nfs/dbraw/zinc/18/70/22/1416187022.db2.gz QUUMPRWKBOQXTR-SECBINFHSA-N 0 0 397.316 3.119 20 5 GGBDRN CSCC[C@H](C)N(C)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000129296496 1416187097 /nfs/dbraw/zinc/18/70/97/1416187097.db2.gz QUUMPRWKBOQXTR-VIFPVBQESA-N 0 0 397.316 3.119 20 5 GGBDRN Cc1cccc(C(=O)N(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000129297537 1416187358 /nfs/dbraw/zinc/18/73/58/1416187358.db2.gz UPFARKFJWMAKFU-AWEZNQCLSA-N 0 0 394.836 3.157 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1ccc(Cl)cc1 ZINC000129307885 1416188760 /nfs/dbraw/zinc/18/87/60/1416188760.db2.gz JUKDLYNJASUZJV-QGZVFWFLSA-N 0 0 377.828 3.290 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000129329601 1416192273 /nfs/dbraw/zinc/19/22/73/1416192273.db2.gz WMKGSDYZOAHARU-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000129329399 1416192299 /nfs/dbraw/zinc/19/22/99/1416192299.db2.gz WMKGSDYZOAHARU-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1cc(F)cc(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000129338608 1416193722 /nfs/dbraw/zinc/19/37/22/1416193722.db2.gz WWXCHPLAQKGTLR-CYBMUJFWSA-N 0 0 395.431 3.419 20 5 GGBDRN COc1ccc(-c2ccc(CNc3cccc(NC(=O)CO)c3)o2)c([N+](=O)[O-])c1 ZINC000129347914 1416194853 /nfs/dbraw/zinc/19/48/53/1416194853.db2.gz ZMHIWRULQXQIRY-UHFFFAOYSA-N 0 0 397.387 3.406 20 5 GGBDRN CN(C[C@@H]1CCC[C@H]1O)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000129347316 1416195087 /nfs/dbraw/zinc/19/50/87/1416195087.db2.gz NBEQYNCCRLVEMC-FXAWDEMLSA-N 0 0 383.448 3.440 20 5 GGBDRN O=C(NC[C@H](c1c[nH]c2ccccc21)c1ccccc1)c1[nH]ncc1[N+](=O)[O-] ZINC000129357117 1416196353 /nfs/dbraw/zinc/19/63/53/1416196353.db2.gz FORJLANQKGWPKO-HNNXBMFYSA-N 0 0 375.388 3.361 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000129359741 1416196392 /nfs/dbraw/zinc/19/63/92/1416196392.db2.gz YENHOUHNEYWEKY-QGZVFWFLSA-N 0 0 385.445 3.365 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000129364802 1416197185 /nfs/dbraw/zinc/19/71/85/1416197185.db2.gz ZKJQICIUAHXAEA-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)cc(F)cc1[N+](=O)[O-] ZINC000129368324 1416197617 /nfs/dbraw/zinc/19/76/17/1416197617.db2.gz SZZCJMOVVZHHFO-GFCCVEGCSA-N 0 0 392.362 3.298 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1 ZINC000129377753 1416199816 /nfs/dbraw/zinc/19/98/16/1416199816.db2.gz ONAORTVZPOQCOW-UHFFFAOYSA-N 0 0 385.344 3.048 20 5 GGBDRN Cc1cccc([C@@H](C)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 ZINC000129381520 1416200172 /nfs/dbraw/zinc/20/01/72/1416200172.db2.gz NMPGSUDTZTUCOC-INIZCTEOSA-N 0 0 383.448 3.273 20 5 GGBDRN CCNc1ncc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000129386517 1416200953 /nfs/dbraw/zinc/20/09/53/1416200953.db2.gz XMEIJBBUADOGHN-UHFFFAOYSA-N 0 0 376.438 3.167 20 5 GGBDRN O=C(Nc1cccc(Cn2cccn2)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000129387572 1416201119 /nfs/dbraw/zinc/20/11/19/1416201119.db2.gz BWAUXRHNIVSGOU-UHFFFAOYSA-N 0 0 399.794 3.070 20 5 GGBDRN COCCCOc1cc(C)ccc1CNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000129390622 1416201876 /nfs/dbraw/zinc/20/18/76/1416201876.db2.gz QHFGICHBOHLVGT-UHFFFAOYSA-N 0 0 386.448 3.486 20 5 GGBDRN Cc1c(C(=O)NC[C@@H](C)c2cccc(C)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000129397533 1416202833 /nfs/dbraw/zinc/20/28/33/1416202833.db2.gz FRAAJRWKCUUSIR-CQSZACIVSA-N 0 0 379.420 3.326 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(NC[C@@H]2CCCO2)c(F)c1 ZINC000129398709 1416203433 /nfs/dbraw/zinc/20/34/33/1416203433.db2.gz FUGVCIWUUUAFIM-AWEZNQCLSA-N 0 0 389.383 3.342 20 5 GGBDRN CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000129409574 1416205133 /nfs/dbraw/zinc/20/51/33/1416205133.db2.gz AXNAWMLXLRENLL-UHFFFAOYSA-N 0 0 394.836 3.245 20 5 GGBDRN Cc1cccc([C@@H](C)CNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000129409361 1416205139 /nfs/dbraw/zinc/20/51/39/1416205139.db2.gz WXXAEDQGXFTAJA-ZDUSSCGKSA-N 0 0 387.461 3.014 20 5 GGBDRN COc1ccccc1N1C[C@@H](C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC1=O ZINC000129409990 1416205336 /nfs/dbraw/zinc/20/53/36/1416205336.db2.gz RGIFRCNBXJHIPQ-AWEZNQCLSA-N 0 0 383.404 3.212 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(C(=O)N2CCSCC2)c1 ZINC000129412662 1416205722 /nfs/dbraw/zinc/20/57/22/1416205722.db2.gz NKFAZSCLBOICNR-UHFFFAOYSA-N 0 0 399.472 3.355 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000129416377 1416206024 /nfs/dbraw/zinc/20/60/24/1416206024.db2.gz LUEVTBYISIPAIA-CABZTGNLSA-N 0 0 381.816 3.368 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(NC[C@H]2CCCO2)c(F)c1 ZINC000129415402 1416206054 /nfs/dbraw/zinc/20/60/54/1416206054.db2.gz PEFFNEVKUGIFFJ-CQSZACIVSA-N 0 0 388.399 3.375 20 5 GGBDRN C[C@H](COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)COc1ccccc1 ZINC000129421428 1416206654 /nfs/dbraw/zinc/20/66/54/1416206654.db2.gz SFXQHOJNJWGHAN-AWEZNQCLSA-N 0 0 382.376 3.047 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000129424538 1416207481 /nfs/dbraw/zinc/20/74/81/1416207481.db2.gz RMKVMVIREHUEMF-OAQYLSRUSA-N 0 0 393.399 3.283 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1 ZINC000129438679 1416209620 /nfs/dbraw/zinc/20/96/20/1416209620.db2.gz FQVACSAOMWHMSU-GFCCVEGCSA-N 0 0 389.358 3.481 20 5 GGBDRN COc1ccccc1[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000129446050 1416211154 /nfs/dbraw/zinc/21/11/54/1416211154.db2.gz JSWOSUFBIACRQB-OAQYLSRUSA-N 0 0 393.399 3.283 20 5 GGBDRN Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000129458552 1416213020 /nfs/dbraw/zinc/21/30/20/1416213020.db2.gz DRMVUPHCCJEOAB-UHFFFAOYSA-N 0 0 380.360 3.444 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000129476559 1416215798 /nfs/dbraw/zinc/21/57/98/1416215798.db2.gz JFOCZVANPRYSOT-GFCCVEGCSA-N 0 0 396.852 3.149 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(=O)n(Cc2ccccc2)n1 ZINC000129480831 1416216519 /nfs/dbraw/zinc/21/65/19/1416216519.db2.gz DGJZHCMBMVPOFM-UHFFFAOYSA-N 0 0 378.388 3.069 20 5 GGBDRN Cc1noc(C)c1C[C@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000129488362 1416217646 /nfs/dbraw/zinc/21/76/46/1416217646.db2.gz XIRUZDONXDTDRQ-ZDUSSCGKSA-N 0 0 386.452 3.163 20 5 GGBDRN Cc1cc(C)cc(C(=O)NCC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000129501973 1416219344 /nfs/dbraw/zinc/21/93/44/1416219344.db2.gz HNWYONNCIDMMCQ-UHFFFAOYSA-N 0 0 381.432 3.133 20 5 GGBDRN CCN(C)C(=O)c1cccc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000129505309 1416219652 /nfs/dbraw/zinc/21/96/52/1416219652.db2.gz ZXTMKGVWHHKZBR-UHFFFAOYSA-N 0 0 381.432 3.492 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129507236 1416220161 /nfs/dbraw/zinc/22/01/61/1416220161.db2.gz BFEIFUFQOZMKCP-UHFFFAOYSA-N 0 0 386.320 3.216 20 5 GGBDRN Cc1sc2ncn(CC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)c(=O)c2c1C ZINC000129507074 1416220217 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ZINC000129603809 1416235601 /nfs/dbraw/zinc/23/56/01/1416235601.db2.gz LPBIOQQBDGXNGY-LLVKDONJSA-N 0 0 391.811 3.322 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)Cc2c(C)noc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000129605005 1416235984 /nfs/dbraw/zinc/23/59/84/1416235984.db2.gz QGZFHIUPJONRIZ-MRVPVSSYSA-N 0 0 399.350 3.171 20 5 GGBDRN O=C(Cc1csc(-c2cnccn2)n1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129607699 1416236488 /nfs/dbraw/zinc/23/64/88/1416236488.db2.gz MNGRDHVCEPESHC-UHFFFAOYSA-N 0 0 395.444 3.242 20 5 GGBDRN CNC(=O)c1cc(C)ccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000129616588 1416237773 /nfs/dbraw/zinc/23/77/73/1416237773.db2.gz RIWFTLIYMDVWAV-UHFFFAOYSA-N 0 0 396.447 3.118 20 5 GGBDRN COCCC1(CNC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)CC1 ZINC000129636644 1416241043 /nfs/dbraw/zinc/24/10/43/1416241043.db2.gz KNLJZAAPLYWNQH-UHFFFAOYSA-N 0 0 386.452 3.003 20 5 GGBDRN CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000129641726 1416241996 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O=C(N[C@H]1CCO[C@H](C2CC2)C1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000130435296 1416377990 /nfs/dbraw/zinc/37/79/90/1416377990.db2.gz UCCURDABXGPLCT-KXBFYZLASA-N 0 0 389.452 3.105 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCC(=O)Nc1cccc2ccccc21 ZINC000130455646 1416381108 /nfs/dbraw/zinc/38/11/08/1416381108.db2.gz BYVVAFHCPKHGFE-UHFFFAOYSA-N 0 0 377.400 3.436 20 5 GGBDRN COc1cc(OCC(=O)NCC2(c3ccc(F)cc3F)CC2)ccc1[N+](=O)[O-] ZINC000130470290 1416383196 /nfs/dbraw/zinc/38/31/96/1416383196.db2.gz GBZGUWRYJJKCGY-UHFFFAOYSA-N 0 0 392.358 3.108 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000130490178 1416387267 /nfs/dbraw/zinc/38/72/67/1416387267.db2.gz QTIMEIMITAQXCL-UHFFFAOYSA-N 0 0 383.404 3.157 20 5 GGBDRN CC[C@H]1CCCN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000130518115 1416392482 /nfs/dbraw/zinc/39/24/82/1416392482.db2.gz NESUFESOPJKTLS-JTQLQIEISA-N 0 0 377.260 3.168 20 5 GGBDRN CC(C)c1ccccc1NC(=O)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000130508676 1416390573 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HKFKLNIQCLGMGD-UHFFFAOYSA-N 0 0 378.797 3.301 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1ccccc1OCC(F)(F)F ZINC000130560113 1416399231 /nfs/dbraw/zinc/39/92/31/1416399231.db2.gz MBHVBRWWTNCBBM-UHFFFAOYSA-N 0 0 395.293 3.401 20 5 GGBDRN CC(C)(CO)CCCNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000130579551 1416402998 /nfs/dbraw/zinc/40/29/98/1416402998.db2.gz ADILZSRNGOESKI-UHFFFAOYSA-N 0 0 378.347 3.064 20 5 GGBDRN CCO[C@@H](C)c1nc(Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)cs1 ZINC000130584472 1416404454 /nfs/dbraw/zinc/40/44/54/1416404454.db2.gz HBHOWFYQLGJXHF-JTQLQIEISA-N 0 0 376.394 3.014 20 5 GGBDRN CCO[C@H](C)c1nc(Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)cs1 ZINC000130584680 1416404570 /nfs/dbraw/zinc/40/45/70/1416404570.db2.gz HBHOWFYQLGJXHF-SNVBAGLBSA-N 0 0 376.394 3.014 20 5 GGBDRN Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000130592931 1416406508 /nfs/dbraw/zinc/40/65/08/1416406508.db2.gz KVRHTGMYLAOHHS-AWEZNQCLSA-N 0 0 399.403 3.234 20 5 GGBDRN COc1c(F)cc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1F ZINC000130595635 1416406744 /nfs/dbraw/zinc/40/67/44/1416406744.db2.gz UAZRMIYFUVAAEO-UHFFFAOYSA-N 0 0 385.710 3.112 20 5 GGBDRN CCCC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180623919 1429938866 /nfs/dbraw/zinc/93/88/66/1429938866.db2.gz HGGJATOTXLHONJ-GFCCVEGCSA-N 0 0 384.230 3.087 20 5 GGBDRN O=C(NCCC(c1ccccc1)c1ccccc1)NCCn1cc([N+](=O)[O-])cn1 ZINC000130618873 1416411089 /nfs/dbraw/zinc/41/10/89/1416411089.db2.gz CBFZMJDDVAXHFA-UHFFFAOYSA-N 0 0 393.447 3.313 20 5 GGBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000130621416 1416412632 /nfs/dbraw/zinc/41/26/32/1416412632.db2.gz FHSWFJYANRVONE-CQSZACIVSA-N 0 0 377.832 3.364 20 5 GGBDRN Cc1cc(C)n(-c2ccc(Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)cc2)n1 ZINC000130643571 1416415956 /nfs/dbraw/zinc/41/59/56/1416415956.db2.gz SPOBRNPHMPOAMQ-UHFFFAOYSA-N 0 0 391.387 3.262 20 5 GGBDRN CC(C)(C)SCCCC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000130647468 1416416835 /nfs/dbraw/zinc/41/68/35/1416416835.db2.gz XBTOXYCQOPEIEA-UHFFFAOYSA-N 0 0 399.538 3.253 20 5 GGBDRN O=C(NCc1cccc(CO)c1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000178513926 1429094932 /nfs/dbraw/zinc/09/49/32/1429094932.db2.gz IQOGAGSFRDEMLD-UHFFFAOYSA-N 0 0 399.628 3.433 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCNC(=O)[C@H]1c1ccccc1Cl ZINC000130671091 1416422356 /nfs/dbraw/zinc/42/23/56/1416422356.db2.gz DIXDPWXASYOFKC-OAHLLOKOSA-N 0 0 394.214 3.215 20 5 GGBDRN CCCCc1noc(C[S@@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000130703106 1416429349 /nfs/dbraw/zinc/42/93/49/1416429349.db2.gz SNHYDUNYVQAZCC-HHHXNRCGSA-N 0 0 390.421 3.424 20 5 GGBDRN CNC(=O)c1cccc(C[S@@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000130716370 1416432474 /nfs/dbraw/zinc/43/24/74/1416432474.db2.gz KWEDBXSGZXWVOQ-NDEPHWFRSA-N 0 0 399.428 3.058 20 5 GGBDRN CNC(=O)c1cccc(C[S@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000130716607 1416432858 /nfs/dbraw/zinc/43/28/58/1416432858.db2.gz KWEDBXSGZXWVOQ-MUUNZHRXSA-N 0 0 399.428 3.058 20 5 GGBDRN CCCn1c(C)cc(C(=O)Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)c1C ZINC000130726216 1416435413 /nfs/dbraw/zinc/43/54/13/1416435413.db2.gz IIBFGUUHUXJGQC-UHFFFAOYSA-N 0 0 384.392 3.123 20 5 GGBDRN CCC(C)(C)NC(=O)[C@H](C)[S@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130728490 1416435811 /nfs/dbraw/zinc/43/58/11/1416435811.db2.gz YPBMUKHOTBDAJF-JWNZJDHWSA-N 0 0 393.465 3.192 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)C(=O)COc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000130726653 1416435884 /nfs/dbraw/zinc/43/58/84/1416435884.db2.gz IOVBCFRIWBCFEH-UHFFFAOYSA-N 0 0 391.811 3.033 20 5 GGBDRN CCc1noc([C@H](C)[S@@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000130738602 1416438682 /nfs/dbraw/zinc/43/86/82/1416438682.db2.gz CATLPNGTDMRNHS-RSNKEIGGSA-N 0 0 376.394 3.205 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H](C)[S@@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130739504 1416439468 /nfs/dbraw/zinc/43/94/68/1416439468.db2.gz MZJIROPUVUNFOL-NTFYDNOESA-N 0 0 393.465 3.192 20 5 GGBDRN COC(=O)CC[C@H](Cc1ccccc1)NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000130748822 1416441353 /nfs/dbraw/zinc/44/13/53/1416441353.db2.gz HNDCOQHXAPFJSW-GOSISDBHSA-N 0 0 384.432 3.126 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(C[S@](=O)CCCOCC(F)(F)F)co2)cc1 ZINC000130748519 1416441817 /nfs/dbraw/zinc/44/18/17/1416441817.db2.gz KCOTXJQTPABEAH-SANMLTNESA-N 0 0 392.355 3.468 20 5 GGBDRN Cc1ccc2c(c1)c(=O)n(C)c1nnc(COc3c(Cl)cccc3[N+](=O)[O-])n12 ZINC000130754620 1416443015 /nfs/dbraw/zinc/44/30/15/1416443015.db2.gz LXTKQOUSADADHL-UHFFFAOYSA-N 0 0 399.794 3.030 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000130754752 1416443249 /nfs/dbraw/zinc/44/32/49/1416443249.db2.gz ZNYWVIPORPFPCP-GFCCVEGCSA-N 0 0 380.832 3.069 20 5 GGBDRN Cc1ccc([C@](O)(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C(F)(F)F)o1 ZINC000130757488 1416443769 /nfs/dbraw/zinc/44/37/69/1416443769.db2.gz HAYWYFCGNMPRFV-MRXNPFEDSA-N 0 0 384.310 3.226 20 5 GGBDRN Cc1ccc([C@@](O)(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C(F)(F)F)o1 ZINC000130757291 1416443962 /nfs/dbraw/zinc/44/39/62/1416443962.db2.gz HAYWYFCGNMPRFV-INIZCTEOSA-N 0 0 384.310 3.226 20 5 GGBDRN Cc1ccccc1NC(=O)C[S@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130762651 1416444715 /nfs/dbraw/zinc/44/47/15/1416444715.db2.gz PEVCJUBMNXMBCK-NDEPHWFRSA-N 0 0 399.428 3.446 20 5 GGBDRN COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)[NH+]1CCCCC1 ZINC000130760604 1416444826 /nfs/dbraw/zinc/44/48/26/1416444826.db2.gz MGKPHYMELDASAC-GOSISDBHSA-N 0 0 399.447 3.266 20 5 GGBDRN CN(C(=O)C[S@](=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000130778423 1416448057 /nfs/dbraw/zinc/44/80/57/1416448057.db2.gz SPLOJBNGSHDMJA-NDEPHWFRSA-N 0 0 399.428 3.162 20 5 GGBDRN NC(=O)[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(F)cc1 ZINC000130780048 1416449508 /nfs/dbraw/zinc/44/95/08/1416449508.db2.gz RMLRPCQQZUUDHR-INIZCTEOSA-N 0 0 386.408 3.174 20 5 GGBDRN O=C(Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O)c1ccc2c(c1)CCCC2 ZINC000130806741 1416455459 /nfs/dbraw/zinc/45/54/59/1416455459.db2.gz LJSUOLBPRGDRBR-UHFFFAOYSA-N 0 0 379.372 3.173 20 5 GGBDRN C[C@@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H]1CNC(=O)OC(C)(C)C ZINC000178532745 1429098406 /nfs/dbraw/zinc/09/84/06/1429098406.db2.gz NBPURAABZFSTRB-MLGOLLRUSA-N 0 0 395.431 3.499 20 5 GGBDRN C[C@@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H]1CNC(=O)OC(C)(C)C ZINC000178532777 1429098926 /nfs/dbraw/zinc/09/89/26/1429098926.db2.gz NBPURAABZFSTRB-WBMJQRKESA-N 0 0 395.431 3.499 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000130841809 1416464939 /nfs/dbraw/zinc/46/49/39/1416464939.db2.gz UMTMPFFCUIAORM-DZGCQCFKSA-N 0 0 385.395 3.385 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)OC1CCCC1 ZINC000178542894 1429103109 /nfs/dbraw/zinc/10/31/09/1429103109.db2.gz KNCLCJRUJHGBOJ-AWEZNQCLSA-N 0 0 389.452 3.189 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(C)cc1O[C@H]1CCOC1 ZINC000130849349 1416466874 /nfs/dbraw/zinc/46/68/74/1416466874.db2.gz KGUYPCSLTIZNFF-INIZCTEOSA-N 0 0 385.420 3.043 20 5 GGBDRN C[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000130861269 1416470095 /nfs/dbraw/zinc/47/00/95/1416470095.db2.gz YKNKDOUMFHIHCO-NEPJUHHUSA-N 0 0 397.353 3.084 20 5 GGBDRN Cc1ccc(NC(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000130872910 1416472309 /nfs/dbraw/zinc/47/23/09/1416472309.db2.gz PBPVSSOTFYZMGC-PKOBYXMFSA-N 0 0 385.420 3.260 20 5 GGBDRN COc1ccc(-c2ccc(CN[C@H](C(N)=O)c3ccc(F)cc3)o2)c([N+](=O)[O-])c1 ZINC000130872379 1416472571 /nfs/dbraw/zinc/47/25/71/1416472571.db2.gz LZMWWLICCHBCPF-IBGZPJMESA-N 0 0 399.378 3.319 20 5 GGBDRN Cc1ccc(NC(=O)N2CCOC[C@@H]2C[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000130872500 1416472774 /nfs/dbraw/zinc/47/27/74/1416472774.db2.gz PBPVSSOTFYZMGC-HKUYNNGSSA-N 0 0 385.420 3.260 20 5 GGBDRN C[C@]1(c2ccccc2)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000130899548 1416477740 /nfs/dbraw/zinc/47/77/40/1416477740.db2.gz NRGGTAGMBKWBQA-QGZVFWFLSA-N 0 0 396.852 3.185 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000130907172 1416478806 /nfs/dbraw/zinc/47/88/06/1416478806.db2.gz QSSDLUSOVRKARP-SWLSCSKDSA-N 0 0 385.395 3.385 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N1CCOc2ccc(F)cc21 ZINC000130907504 1416478933 /nfs/dbraw/zinc/47/89/33/1416478933.db2.gz AXJVACPJCAEMAQ-UHFFFAOYSA-N 0 0 386.788 3.283 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000130907401 1416478944 /nfs/dbraw/zinc/47/89/44/1416478944.db2.gz QSSDLUSOVRKARP-WFASDCNBSA-N 0 0 385.395 3.385 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)C(=O)N2CCc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000130926239 1416482544 /nfs/dbraw/zinc/48/25/44/1416482544.db2.gz MCZRKLBIPNIGSK-LBPRGKRZSA-N 0 0 387.823 3.323 20 5 GGBDRN Cc1noc(-c2ccccc2)c1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000130998926 1416493655 /nfs/dbraw/zinc/49/36/55/1416493655.db2.gz CRYMONAPTCFSGR-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H](C)c1c(F)cccc1-n1cccn1 ZINC000130999801 1416493753 /nfs/dbraw/zinc/49/37/53/1416493753.db2.gz MVPKCFRLPOSDQV-LBPRGKRZSA-N 0 0 387.371 3.119 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCc1nc(C)cs1 ZINC000131005867 1416495190 /nfs/dbraw/zinc/49/51/90/1416495190.db2.gz IDGBXVNBGYRJFO-UHFFFAOYSA-N 0 0 395.506 3.461 20 5 GGBDRN O=C([C@H]1CCCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCOCC1 ZINC000131033467 1416498478 /nfs/dbraw/zinc/49/84/78/1416498478.db2.gz NWPANHYIGISUKC-LJQANCHMSA-N 0 0 399.447 3.068 20 5 GGBDRN C[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])[C@@H]1CNC(=O)OC(C)(C)C ZINC000178538893 1429101755 /nfs/dbraw/zinc/10/17/55/1429101755.db2.gz OQPRHKJDSLNINH-XJKSGUPXSA-N 0 0 377.441 3.360 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(CN2CCOCC2)cc1 ZINC000131042863 1416499944 /nfs/dbraw/zinc/49/99/44/1416499944.db2.gz OOOLFSFJLZTXEL-UHFFFAOYSA-N 0 0 387.461 3.158 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000131041655 1416500177 /nfs/dbraw/zinc/50/01/77/1416500177.db2.gz BSAQZBLEHQMXEH-GJZGRUSLSA-N 0 0 398.463 3.300 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cnc(Cl)c(C)c2)cc1[N+](=O)[O-] ZINC000131050285 1416501583 /nfs/dbraw/zinc/50/15/83/1416501583.db2.gz UPCXRNTZPFVQEH-LLVKDONJSA-N 0 0 376.800 3.076 20 5 GGBDRN C[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]1CNC(=O)OC(C)(C)C ZINC000178539844 1429102001 /nfs/dbraw/zinc/10/20/01/1429102001.db2.gz LFYJBFYYUBOAGN-MLGOLLRUSA-N 0 0 395.431 3.499 20 5 GGBDRN CCn1nccc1CN1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000131056381 1416502548 /nfs/dbraw/zinc/50/25/48/1416502548.db2.gz UOSUOUOCJIRJJB-UHFFFAOYSA-N 0 0 383.374 3.152 20 5 GGBDRN CCC(=O)N1CC[C@@H](C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000131071780 1416504934 /nfs/dbraw/zinc/50/49/34/1416504934.db2.gz AIIQVOZDPBPFDQ-CYBMUJFWSA-N 0 0 379.844 3.250 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OC1CCN(CC(F)(F)F)CC1 ZINC000131087642 1416506731 /nfs/dbraw/zinc/50/67/31/1416506731.db2.gz MBQILONTDHOMCA-UHFFFAOYSA-N 0 0 385.342 3.189 20 5 GGBDRN CCCCNC(=O)C1(NC(=O)CCc2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000131086455 1416506738 /nfs/dbraw/zinc/50/67/38/1416506738.db2.gz BQJMBMROZCVODS-UHFFFAOYSA-N 0 0 375.469 3.263 20 5 GGBDRN COc1ccc(NC(=O)c2ccc(CN(C)C(=O)C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000131086513 1416506754 /nfs/dbraw/zinc/50/67/54/1416506754.db2.gz MEVJBONNAJFAHJ-UHFFFAOYSA-N 0 0 385.420 3.470 20 5 GGBDRN C[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H]1CNC(=O)OC(C)(C)C ZINC000178540967 1429102518 /nfs/dbraw/zinc/10/25/18/1429102518.db2.gz RCOWABRVTQRBAY-RHSMWYFYSA-N 0 0 391.468 3.289 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@H](C)Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000131090057 1416507190 /nfs/dbraw/zinc/50/71/90/1416507190.db2.gz KEMQIVUXRQIGRU-LBPRGKRZSA-N 0 0 379.394 3.086 20 5 GGBDRN C[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)[C@H]1CNC(=O)OC(C)(C)C ZINC000178541039 1429102725 /nfs/dbraw/zinc/10/27/25/1429102725.db2.gz LJIIYDPYOOSFBY-NEPJUHHUSA-N 0 0 383.470 3.422 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000131111721 1416510434 /nfs/dbraw/zinc/51/04/34/1416510434.db2.gz VXUOJZOOBFIGAZ-HXUWFJFHSA-N 0 0 397.818 3.316 20 5 GGBDRN O=C(CSCc1ccc([N+](=O)[O-])cc1)NCCc1cnn(-c2ccccc2)c1 ZINC000131150378 1416516715 /nfs/dbraw/zinc/51/67/15/1416516715.db2.gz VEGHYWCZIXZZRS-UHFFFAOYSA-N 0 0 396.472 3.373 20 5 GGBDRN CC(C)NC(=O)Nc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000131183001 1416520548 /nfs/dbraw/zinc/52/05/48/1416520548.db2.gz GZXSGNAEIUYVST-UHFFFAOYSA-N 0 0 388.399 3.123 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000131190369 1416521788 /nfs/dbraw/zinc/52/17/88/1416521788.db2.gz XDEZSKVKXSTDPK-FQEVSTJZSA-N 0 0 397.431 3.256 20 5 GGBDRN Cc1nn(CCC(=O)Oc2ccc(Br)cc2C)c(C)c1[N+](=O)[O-] ZINC000131209337 1416523848 /nfs/dbraw/zinc/52/38/48/1416523848.db2.gz ZPUAPGLMSNZZBX-UHFFFAOYSA-N 0 0 382.214 3.475 20 5 GGBDRN CN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000131219841 1416525234 /nfs/dbraw/zinc/52/52/34/1416525234.db2.gz WZMIIMQPMZOXQN-NRFANRHFSA-N 0 0 395.390 3.144 20 5 GGBDRN Cc1cc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl ZINC000131234838 1416527575 /nfs/dbraw/zinc/52/75/75/1416527575.db2.gz JSMWNYOEZOCASM-UHFFFAOYSA-N 0 0 387.823 3.155 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000131246365 1416529211 /nfs/dbraw/zinc/52/92/11/1416529211.db2.gz RSKQSHQGXBOGGT-MRXNPFEDSA-N 0 0 391.767 3.370 20 5 GGBDRN COCCCN(Cc1ccncc1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000131249331 1416529748 /nfs/dbraw/zinc/52/97/48/1416529748.db2.gz ZWJLPMTYMKVZDB-UHFFFAOYSA-N 0 0 382.420 3.079 20 5 GGBDRN COc1ccc(CN(C(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)C2CC2)cc1 ZINC000131256122 1416530946 /nfs/dbraw/zinc/53/09/46/1416530946.db2.gz OLYKTVLDOFZECL-UHFFFAOYSA-N 0 0 395.459 3.153 20 5 GGBDRN O=C(CN1CCc2ccc([N+](=O)[O-])cc2C1)N(Cc1ccco1)CC(F)(F)F ZINC000131257169 1416530992 /nfs/dbraw/zinc/53/09/92/1416530992.db2.gz LOELUKRHGJHDHZ-UHFFFAOYSA-N 0 0 397.353 3.137 20 5 GGBDRN CCCNC(=O)c1cccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000131276493 1416533720 /nfs/dbraw/zinc/53/37/20/1416533720.db2.gz KGCXSRKGJXVMAD-UHFFFAOYSA-N 0 0 382.420 3.325 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)C(=O)CCNc2ccccc2[N+](=O)[O-])n1 ZINC000131293849 1416536189 /nfs/dbraw/zinc/53/61/89/1416536189.db2.gz VAPAZWUDENIHOU-GFCCVEGCSA-N 0 0 393.469 3.253 20 5 GGBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000131295731 1416536254 /nfs/dbraw/zinc/53/62/54/1416536254.db2.gz UWCAZDKYIRMNSW-UHFFFAOYSA-N 0 0 381.348 3.165 20 5 GGBDRN C[C@@H](OCCCNC(=O)CN1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000131308619 1416538147 /nfs/dbraw/zinc/53/81/47/1416538147.db2.gz UTHWEIWNSZCOKK-QGZVFWFLSA-N 0 0 397.475 3.237 20 5 GGBDRN Cc1c(NC(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000131317944 1416539588 /nfs/dbraw/zinc/53/95/88/1416539588.db2.gz JCAXIDSALXHYNC-QFBILLFUSA-N 0 0 385.420 3.260 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)C(=O)COc1cccc(C)c1[N+](=O)[O-] ZINC000131320074 1416539603 /nfs/dbraw/zinc/53/96/03/1416539603.db2.gz ITYMGVYJIUYFBI-UHFFFAOYSA-N 0 0 399.447 3.468 20 5 GGBDRN O=C(OCCN1C(=O)NCc2ccccc21)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000131327714 1416540858 /nfs/dbraw/zinc/54/08/58/1416540858.db2.gz DTDKECSDNPJAIP-UHFFFAOYSA-N 0 0 375.768 3.135 20 5 GGBDRN COCCCn1c(C)cc(C(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)c1C ZINC000131332902 1416541695 /nfs/dbraw/zinc/54/16/95/1416541695.db2.gz OOJHKTUESYOJGD-UHFFFAOYSA-N 0 0 385.464 3.291 20 5 GGBDRN Cc1csc(CCCCNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)n1 ZINC000131338052 1416542058 /nfs/dbraw/zinc/54/20/58/1416542058.db2.gz YWBUSXUDHGLRND-UHFFFAOYSA-N 0 0 385.449 3.298 20 5 GGBDRN Cc1cccc(OCc2nnnn2-c2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000131344015 1416542876 /nfs/dbraw/zinc/54/28/76/1416542876.db2.gz CNNKKTOWVRWXCW-UHFFFAOYSA-N 0 0 379.298 3.477 20 5 GGBDRN COc1ccc(NC(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)cc1Cl ZINC000131353443 1416544299 /nfs/dbraw/zinc/54/42/99/1416544299.db2.gz DNGLYBDYNPFTLY-UHFFFAOYSA-N 0 0 375.812 3.254 20 5 GGBDRN COCCCNC(=O)[C@@H](C)SCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000131357277 1416544678 /nfs/dbraw/zinc/54/46/78/1416544678.db2.gz VFDSPSCQDAFLAM-GFCCVEGCSA-N 0 0 379.438 3.024 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1C ZINC000131356128 1416544681 /nfs/dbraw/zinc/54/46/81/1416544681.db2.gz HHFXFWKAZHUGOW-UHFFFAOYSA-N 0 0 381.385 3.056 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000131379015 1416547823 /nfs/dbraw/zinc/54/78/23/1416547823.db2.gz ZCVHADNCWWSCSS-UHFFFAOYSA-N 0 0 397.137 3.493 20 5 GGBDRN CCCCn1c(=O)[nH]nc1SCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000131379070 1416548036 /nfs/dbraw/zinc/54/80/36/1416548036.db2.gz MAGMSECQLNGTLF-UHFFFAOYSA-N 0 0 375.410 3.227 20 5 GGBDRN COC(=O)c1csc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000131384656 1416548863 /nfs/dbraw/zinc/54/88/63/1416548863.db2.gz MNBHQDDDXIKQPL-UHFFFAOYSA-N 0 0 385.195 3.458 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CSc3nnnn3Cc3ccco3)co2)cc1 ZINC000131410949 1416553145 /nfs/dbraw/zinc/55/31/45/1416553145.db2.gz BYHGMCCQUISWGX-UHFFFAOYSA-N 0 0 384.377 3.170 20 5 GGBDRN COc1ccc([C@@H](NC(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)C2CC2)cc1 ZINC000131414787 1416554121 /nfs/dbraw/zinc/55/41/21/1416554121.db2.gz SXCOIAHZJAPADV-QFIPXVFZSA-N 0 0 395.459 3.229 20 5 GGBDRN COc1cc(CCNC(=O)[C@H]2C[C@@H]2c2sccc2C)c([N+](=O)[O-])cc1OC ZINC000178561239 1429107013 /nfs/dbraw/zinc/10/70/13/1429107013.db2.gz IBKRDRBFBLOGCF-KBPBESRZSA-N 0 0 390.461 3.444 20 5 GGBDRN CC(C)C(=O)Nc1ccc(O[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000131423551 1416555570 /nfs/dbraw/zinc/55/55/70/1416555570.db2.gz AULOOMHUIMHWCE-SFHVURJKSA-N 0 0 383.404 3.374 20 5 GGBDRN CC(C)C(=O)Nc1ccc(O[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000131423355 1416555799 /nfs/dbraw/zinc/55/57/99/1416555799.db2.gz AULOOMHUIMHWCE-GOSISDBHSA-N 0 0 383.404 3.374 20 5 GGBDRN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000131439657 1416558151 /nfs/dbraw/zinc/55/81/51/1416558151.db2.gz XMBTYVXFCQVOKQ-HUUCEWRRSA-N 0 0 383.448 3.227 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000131443403 1416558531 /nfs/dbraw/zinc/55/85/31/1416558531.db2.gz DFWKQZZNISKJKF-OAHLLOKOSA-N 0 0 391.786 3.313 20 5 GGBDRN CCCOc1cc(F)ccc1NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000131443244 1416558628 /nfs/dbraw/zinc/55/86/28/1416558628.db2.gz JTFOGBBPFGKQEV-LBPRGKRZSA-N 0 0 389.383 3.280 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(COc3ccc([N+](=O)[O-])cc3C)nc2c1 ZINC000131448649 1416559688 /nfs/dbraw/zinc/55/96/88/1416559688.db2.gz WAOWSZJQYALOAF-UHFFFAOYSA-N 0 0 376.390 3.417 20 5 GGBDRN Cn1cc(C[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)C2)cn1 ZINC000131459444 1416561138 /nfs/dbraw/zinc/56/11/38/1416561138.db2.gz CFFVMZRDVLLXRT-LLVKDONJSA-N 0 0 382.342 3.052 20 5 GGBDRN CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000131471622 1416563076 /nfs/dbraw/zinc/56/30/76/1416563076.db2.gz NCWSFXODTUMOJH-HNNXBMFYSA-N 0 0 389.477 3.060 20 5 GGBDRN CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 ZINC000131471840 1416563160 /nfs/dbraw/zinc/56/31/60/1416563160.db2.gz NCWSFXODTUMOJH-OAHLLOKOSA-N 0 0 389.477 3.060 20 5 GGBDRN Cc1ccc(-c2[nH]nc(NC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)c2C)o1 ZINC000178562861 1429107761 /nfs/dbraw/zinc/10/77/61/1429107761.db2.gz UFVQYERCZGLHJO-UHFFFAOYSA-N 0 0 393.363 3.028 20 5 GGBDRN Cc1cc(C)n(-c2ccc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)cn2)n1 ZINC000131473992 1416563490 /nfs/dbraw/zinc/56/34/90/1416563490.db2.gz YYQULMVRWVGNDY-UHFFFAOYSA-N 0 0 392.419 3.383 20 5 GGBDRN COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000131478387 1416563839 /nfs/dbraw/zinc/56/38/39/1416563839.db2.gz VBKFKNAXEHLPCU-CQSZACIVSA-N 0 0 397.431 3.075 20 5 GGBDRN CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000131480848 1416564663 /nfs/dbraw/zinc/56/46/63/1416564663.db2.gz PMMAKBJGSZIVOS-HNNXBMFYSA-N 0 0 376.482 3.485 20 5 GGBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1nc(Cl)ccc1Cl ZINC000131486308 1416565287 /nfs/dbraw/zinc/56/52/87/1416565287.db2.gz TYIRZTZAAXWWRK-UHFFFAOYSA-N 0 0 378.997 3.269 20 5 GGBDRN O=C(NCC1(c2ccccc2Cl)CC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000131497465 1416567135 /nfs/dbraw/zinc/56/71/35/1416567135.db2.gz AIFPTVLIVMIJKP-UHFFFAOYSA-N 0 0 397.822 3.291 20 5 GGBDRN O=C(CN1CCc2ccc([N+](=O)[O-])cc2C1)N1CCc2[nH]c3ccccc3c2C1 ZINC000131522773 1416570963 /nfs/dbraw/zinc/57/09/63/1416570963.db2.gz KZXZNSUMLMVGLW-UHFFFAOYSA-N 0 0 390.443 3.019 20 5 GGBDRN O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000131525965 1416571209 /nfs/dbraw/zinc/57/12/09/1416571209.db2.gz XHCYTBNISMYWCH-CQSZACIVSA-N 0 0 391.786 3.313 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@](C)(O)c1ccc(F)cc1 ZINC000131546202 1416574265 /nfs/dbraw/zinc/57/42/65/1416574265.db2.gz TUVUVEBYOWKWIZ-XIKOKIGWSA-N 0 0 378.425 3.238 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@](C)(O)c1ccc(F)cc1 ZINC000131546391 1416574326 /nfs/dbraw/zinc/57/43/26/1416574326.db2.gz TUVUVEBYOWKWIZ-KPZWWZAWSA-N 0 0 378.425 3.238 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCO[C@@H](c2ccccc2F)C1 ZINC000131552278 1416575126 /nfs/dbraw/zinc/57/51/26/1416575126.db2.gz RGFHELRJXQRQKP-LJQANCHMSA-N 0 0 396.378 3.133 20 5 GGBDRN C[C@@H](NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1nc(C(C)(C)C)no1 ZINC000131568958 1416577544 /nfs/dbraw/zinc/57/75/44/1416577544.db2.gz UAYXQVDORNGQKQ-SNVBAGLBSA-N 0 0 379.392 3.094 20 5 GGBDRN CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000131609861 1416583869 /nfs/dbraw/zinc/58/38/69/1416583869.db2.gz USUJEUSPWASNDX-SNVBAGLBSA-N 0 0 382.825 3.490 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCC(OC[C@H]4CCOC4)CC3)co2)cc1 ZINC000131624315 1416586181 /nfs/dbraw/zinc/58/61/81/1416586181.db2.gz FBRCOSXYMLKHJV-HNNXBMFYSA-N 0 0 387.436 3.267 20 5 GGBDRN Cc1cc(F)cc(C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)c1[N+](=O)[O-] ZINC000131629196 1416586787 /nfs/dbraw/zinc/58/67/87/1416586787.db2.gz FXRJUSKHYMTALA-ZDUSSCGKSA-N 0 0 379.338 3.329 20 5 GGBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000131646223 1416589700 /nfs/dbraw/zinc/58/97/00/1416589700.db2.gz ZIYBFLCIPBGXLC-CMPLNLGQSA-N 0 0 385.873 3.319 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000131687387 1416597340 /nfs/dbraw/zinc/59/73/40/1416597340.db2.gz JPOBRPONTWSQJG-VEWLYKBQSA-N 0 0 392.399 3.423 20 5 GGBDRN Cc1c(CC(=O)N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cccc1[N+](=O)[O-] ZINC000178574982 1429111121 /nfs/dbraw/zinc/11/11/21/1429111121.db2.gz YULSKESAFVICNR-AWEZNQCLSA-N 0 0 390.461 3.069 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000131707026 1416601063 /nfs/dbraw/zinc/60/10/63/1416601063.db2.gz MLXFOPLVNDZWPW-HKUYNNGSSA-N 0 0 397.431 3.096 20 5 GGBDRN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000131728259 1416606173 /nfs/dbraw/zinc/60/61/73/1416606173.db2.gz CWMMGZLIHYTVEC-WBVHZDCISA-N 0 0 381.432 3.038 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCC[C@H]1OCc1ccccc1 ZINC000131742529 1416608971 /nfs/dbraw/zinc/60/89/71/1416608971.db2.gz WBDJJUYQMBVVPA-IEBWSBKVSA-N 0 0 397.431 3.096 20 5 GGBDRN COc1cc(C=Cc2nccc(=O)[nH]2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000131744104 1416609082 /nfs/dbraw/zinc/60/90/82/1416609082.db2.gz MZKVORAULLMFCW-BQYQJAHWSA-N 0 0 379.372 3.436 20 5 GGBDRN O=C(CCC1CCCCC1)N1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000178577276 1429112407 /nfs/dbraw/zinc/11/24/07/1429112407.db2.gz SPOSACTWPJMIFX-FQEVSTJZSA-N 0 0 389.496 3.133 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@H]1CCOC2(CCCCC2)C1 ZINC000131759672 1416613947 /nfs/dbraw/zinc/61/39/47/1416613947.db2.gz QJOLWEXMRDSTIN-HNNXBMFYSA-N 0 0 376.457 3.188 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCOC2(CCCCC2)C1 ZINC000131759482 1416614071 /nfs/dbraw/zinc/61/40/71/1416614071.db2.gz QJOLWEXMRDSTIN-OAHLLOKOSA-N 0 0 376.457 3.188 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OCc2cn3cc(Br)ccc3n2)c1 ZINC000131766900 1416616284 /nfs/dbraw/zinc/61/62/84/1416616284.db2.gz QLLUOOZNRGSSHE-UHFFFAOYSA-N 0 0 376.166 3.397 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])NC[C@H](O)c1c(Cl)cccc1Cl ZINC000131771449 1416616817 /nfs/dbraw/zinc/61/68/17/1416616817.db2.gz DVFKRKHJPFRAHD-ZDUSSCGKSA-N 0 0 385.203 3.130 20 5 GGBDRN Cc1ccc(OCc2nnnn2-c2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000131775705 1416617447 /nfs/dbraw/zinc/61/74/47/1416617447.db2.gz VAIGGPGGUUKINP-UHFFFAOYSA-N 0 0 379.298 3.477 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000131782621 1416619401 /nfs/dbraw/zinc/61/94/01/1416619401.db2.gz HTPDFHYBNSBOFR-ZDUSSCGKSA-N 0 0 375.812 3.266 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000178580936 1429113082 /nfs/dbraw/zinc/11/30/82/1429113082.db2.gz WXLWDTMPMIEAHA-HRAATJIYSA-N 0 0 385.464 3.016 20 5 GGBDRN O=C(CCCc1ccccc1)N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000131849884 1416634748 /nfs/dbraw/zinc/63/47/48/1416634748.db2.gz RGZPNPNRLDGSMP-UHFFFAOYSA-N 0 0 396.447 3.294 20 5 GGBDRN Cc1ccc(OC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000131860040 1416636651 /nfs/dbraw/zinc/63/66/51/1416636651.db2.gz FYXXIJBNXVTISD-OAHLLOKOSA-N 0 0 377.441 3.276 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c(C)o1 ZINC000131870631 1416638191 /nfs/dbraw/zinc/63/81/91/1416638191.db2.gz GKJCWJDUQLNQAE-UHFFFAOYSA-N 0 0 399.447 3.158 20 5 GGBDRN O=C(NC[C@@H](O)c1c(Cl)cccc1Cl)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000131881466 1416640550 /nfs/dbraw/zinc/64/05/50/1416640550.db2.gz PZDKAQDDABBONE-CYBMUJFWSA-N 0 0 395.202 3.241 20 5 GGBDRN COc1cc(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)ccc1[N+](=O)[O-] ZINC000131911682 1416649750 /nfs/dbraw/zinc/64/97/50/1416649750.db2.gz CYIGJXHKFZDGTF-ZDUSSCGKSA-N 0 0 385.203 3.374 20 5 GGBDRN CC[C@@H]1CN([C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)CCO1 ZINC000178593370 1429115701 /nfs/dbraw/zinc/11/57/01/1429115701.db2.gz JMZLKEIMOHYIGQ-SWLSCSKDSA-N 0 0 390.465 3.156 20 5 GGBDRN CCn1nnnc1-c1cccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000131918127 1416650841 /nfs/dbraw/zinc/65/08/41/1416650841.db2.gz HHXJGGFSKKPDQG-LBPRGKRZSA-N 0 0 398.448 3.388 20 5 GGBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCOC(C)(C)C1 ZINC000178594580 1429116559 /nfs/dbraw/zinc/11/65/59/1429116559.db2.gz MHPLOLAUXYYTAJ-LBPRGKRZSA-N 0 0 390.465 3.156 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)C[C@@H](O)c2cccs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000132013882 1416673662 /nfs/dbraw/zinc/67/36/62/1416673662.db2.gz KLULDDHCGYAEPD-LKFCYVNXSA-N 0 0 379.394 3.115 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)C[C@@H](O)c2cccs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000132014065 1416673693 /nfs/dbraw/zinc/67/36/93/1416673693.db2.gz KLULDDHCGYAEPD-YMTOWFKASA-N 0 0 379.394 3.115 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000178604835 1429119612 /nfs/dbraw/zinc/11/96/12/1429119612.db2.gz JBWJOQHUKUARLC-HXUWFJFHSA-N 0 0 391.431 3.301 20 5 GGBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000132089888 1416693235 /nfs/dbraw/zinc/69/32/35/1416693235.db2.gz FRJNRZMNETWRIY-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2I)C[C@@H]1C ZINC000132103352 1416696296 /nfs/dbraw/zinc/69/62/96/1416696296.db2.gz KIJDLLGAYNNPII-ZJUUUORDSA-N 0 0 388.205 3.318 20 5 GGBDRN CCCN(CCNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000132109301 1416697387 /nfs/dbraw/zinc/69/73/87/1416697387.db2.gz MOKLNUICFJFHLL-UHFFFAOYSA-N 0 0 383.420 3.419 20 5 GGBDRN CN(C)C(=O)Nc1cccc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000132119688 1416701069 /nfs/dbraw/zinc/70/10/69/1416701069.db2.gz UMTFZGMJYXLURT-UHFFFAOYSA-N 0 0 376.800 3.272 20 5 GGBDRN CN(CC(=O)Nc1ccc2c(c1)nc(C1CC1)n2C)c1ccccc1[N+](=O)[O-] ZINC000132134014 1416704347 /nfs/dbraw/zinc/70/43/47/1416704347.db2.gz DWGOTAVLWBWNSU-UHFFFAOYSA-N 0 0 379.420 3.434 20 5 GGBDRN CN(C(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1)c1ccc([N+](=O)[O-])cc1 ZINC000132139649 1416705807 /nfs/dbraw/zinc/70/58/07/1416705807.db2.gz KZNCZSRGFOMYIP-UHFFFAOYSA-N 0 0 391.309 3.471 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CC(C)(C)c2ccccc21 ZINC000178608224 1429120860 /nfs/dbraw/zinc/12/08/60/1429120860.db2.gz LWCKBJJVTUDQJX-INIZCTEOSA-N 0 0 383.404 3.081 20 5 GGBDRN CC[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000132155176 1416708457 /nfs/dbraw/zinc/70/84/57/1416708457.db2.gz AWNKETLOJDXNFF-TZMCWYRMSA-N 0 0 376.331 3.223 20 5 GGBDRN CC[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000132154736 1416708537 /nfs/dbraw/zinc/70/85/37/1416708537.db2.gz AWNKETLOJDXNFF-OCCSQVGLSA-N 0 0 376.331 3.223 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC1CCC(C(C)C)CC1 ZINC000178609818 1429121108 /nfs/dbraw/zinc/12/11/08/1429121108.db2.gz GKAQJBAHQRFEGN-UHFFFAOYSA-N 0 0 377.441 3.121 20 5 GGBDRN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000132180377 1416712801 /nfs/dbraw/zinc/71/28/01/1416712801.db2.gz FWLYJLJQUWTPKQ-UHFFFAOYSA-N 0 0 381.432 3.412 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000132208572 1416717474 /nfs/dbraw/zinc/71/74/74/1416717474.db2.gz DCGFPVQBOOFQAB-LRDDRELGSA-N 0 0 386.433 3.084 20 5 GGBDRN O=C(NCc1ccnc(N2CCCC2)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000132227845 1416720581 /nfs/dbraw/zinc/72/05/81/1416720581.db2.gz SISVSWSTRNIDHA-UHFFFAOYSA-N 0 0 395.463 3.464 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CNc3ccc(O[C@H]4CCOC4)cc3)n2)c1 ZINC000132236319 1416721901 /nfs/dbraw/zinc/72/19/01/1416721901.db2.gz OFNIOLILBDURGL-KRWDZBQOSA-N 0 0 382.376 3.425 20 5 GGBDRN Cc1ccc(CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC(F)(F)F)cc1 ZINC000132242767 1416722369 /nfs/dbraw/zinc/72/23/69/1416722369.db2.gz MTVRKOMAWNCWFN-UHFFFAOYSA-N 0 0 383.370 3.172 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1OCc1nc(COc2ccc(F)cc2)no1 ZINC000132253460 1416724267 /nfs/dbraw/zinc/72/42/67/1416724267.db2.gz ZKDYONXOUBUKFS-UHFFFAOYSA-N 0 0 375.312 3.284 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)C(=O)NCc2cccc([N+](=O)[O-])c2)n1 ZINC000178622652 1429123374 /nfs/dbraw/zinc/12/33/74/1429123374.db2.gz WYRFETAQVOUMPK-LLVKDONJSA-N 0 0 379.442 3.134 20 5 GGBDRN Cc1[nH]c2ccccc2c1C(=O)Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1 ZINC000132278567 1416727925 /nfs/dbraw/zinc/72/79/25/1416727925.db2.gz VNYPWVLLHZKHPU-UHFFFAOYSA-N 0 0 378.344 3.084 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000132283005 1416728769 /nfs/dbraw/zinc/72/87/69/1416728769.db2.gz WGDMSTHNGSIWDI-CQSZACIVSA-N 0 0 395.749 3.062 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000132304215 1416732124 /nfs/dbraw/zinc/73/21/24/1416732124.db2.gz KUYBVMIGMLMNFV-UHFFFAOYSA-N 0 0 393.396 3.192 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCc1ccccc1OC(F)F ZINC000132308796 1416733166 /nfs/dbraw/zinc/73/31/66/1416733166.db2.gz QZTIGMIQGOBMAY-UHFFFAOYSA-N 0 0 390.339 3.122 20 5 GGBDRN CCC[C@@H](NC(=O)Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000132322156 1416735791 /nfs/dbraw/zinc/73/57/91/1416735791.db2.gz GYHVXFNJTKGUPM-QGZVFWFLSA-N 0 0 396.403 3.069 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(-n2cccn2)cc1 ZINC000132323198 1416736218 /nfs/dbraw/zinc/73/62/18/1416736218.db2.gz PGEFQCMXFCQGJZ-UHFFFAOYSA-N 0 0 376.369 3.029 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)c1 ZINC000132342462 1416741212 /nfs/dbraw/zinc/74/12/12/1416741212.db2.gz WYTKMCAHWNMDNY-NSHDSACASA-N 0 0 395.412 3.040 20 5 GGBDRN COc1ccccc1CN(C1CC1)S(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC000132351568 1416742646 /nfs/dbraw/zinc/74/26/46/1416742646.db2.gz ZRNAPAOETJSODQ-UHFFFAOYSA-N 0 0 394.424 3.404 20 5 GGBDRN Cc1ccnc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)CC2)c1 ZINC000132354771 1416743561 /nfs/dbraw/zinc/74/35/61/1416743561.db2.gz XNEHWPOHXLWCMC-UHFFFAOYSA-N 0 0 394.353 3.279 20 5 GGBDRN Cc1c(Cl)cccc1NC(=O)Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1 ZINC000132369065 1416746769 /nfs/dbraw/zinc/74/67/69/1416746769.db2.gz GEKXPLQELSBODG-UHFFFAOYSA-N 0 0 388.767 3.012 20 5 GGBDRN O=C(O[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000132374087 1416748178 /nfs/dbraw/zinc/74/81/78/1416748178.db2.gz BRANVQVLHIDWTR-RYQLBKOJSA-N 0 0 383.404 3.285 20 5 GGBDRN CC(C)S(=O)(=O)c1ccc(F)c(C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000132379272 1416748517 /nfs/dbraw/zinc/74/85/17/1416748517.db2.gz UARAGUPAFTVUTN-UHFFFAOYSA-N 0 0 385.344 3.274 20 5 GGBDRN Cn1c(SCC(=O)Oc2cc(F)cc([N+](=O)[O-])c2)nnc1-c1cccs1 ZINC000132381933 1416749303 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ZINC000133133215 1416855326 /nfs/dbraw/zinc/85/53/26/1416855326.db2.gz CZRYMMHJBWQGND-UHFFFAOYSA-N 0 0 389.371 3.366 20 5 GGBDRN CCCCCCNC(=O)[C@@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 ZINC000133145980 1416857079 /nfs/dbraw/zinc/85/70/79/1416857079.db2.gz ZSXRPVSKQKPNGH-CYBMUJFWSA-N 0 0 379.486 3.217 20 5 GGBDRN CCC[C@@H](C)[C@@H]1CCCN1c1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000133144983 1416857121 /nfs/dbraw/zinc/85/71/21/1416857121.db2.gz UUURPFRIWZDYRG-WBVHZDCISA-N 0 0 375.469 3.472 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(-c2cnco2)cc1 ZINC000133155972 1416858388 /nfs/dbraw/zinc/85/83/88/1416858388.db2.gz QWRFLGXPLLEBDF-GFCCVEGCSA-N 0 0 380.360 3.007 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(NC(=O)Nc2ccccc2)cc1 ZINC000133156657 1416858514 /nfs/dbraw/zinc/85/85/14/1416858514.db2.gz GAOLVJVZUNATSC-UHFFFAOYSA-N 0 0 380.364 3.074 20 5 GGBDRN C[C@H]1C[C@H](c2ccccc2)CN1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133162833 1416859512 /nfs/dbraw/zinc/85/95/12/1416859512.db2.gz SOCAUAIYPREBSB-YOEHRIQHSA-N 0 0 380.404 3.247 20 5 GGBDRN C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccccc2)no1 ZINC000133173441 1416860454 /nfs/dbraw/zinc/86/04/54/1416860454.db2.gz WHWAFJBLAKEBDH-CYBMUJFWSA-N 0 0 381.392 3.248 20 5 GGBDRN C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccccc2)no1 ZINC000133173214 1416860490 /nfs/dbraw/zinc/86/04/90/1416860490.db2.gz WHWAFJBLAKEBDH-ZDUSSCGKSA-N 0 0 381.392 3.248 20 5 GGBDRN C[C@@]1(C(=O)NCCc2cccc([N+](=O)[O-])c2)CCCN(C(=O)c2ccccc2)C1 ZINC000133173655 1416860787 /nfs/dbraw/zinc/86/07/87/1416860787.db2.gz IDBFLTKECNJZOS-JOCHJYFZSA-N 0 0 395.459 3.196 20 5 GGBDRN O=c1ccc([N+](=O)[O-])cn1CCN[C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000133191329 1416862561 /nfs/dbraw/zinc/86/25/61/1416862561.db2.gz LBVSPPFTUDCNQT-IBGZPJMESA-N 0 0 384.823 3.184 20 5 GGBDRN O=C(NCc1nncn1-c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000133229492 1416867519 /nfs/dbraw/zinc/86/75/19/1416867519.db2.gz XNXCFROJEYOSDD-UHFFFAOYSA-N 0 0 392.419 3.050 20 5 GGBDRN CCC1(CC)[C@H](NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1OC ZINC000133245953 1416869466 /nfs/dbraw/zinc/86/94/66/1416869466.db2.gz WSIUSCNNFONNEC-SJORKVTESA-N 0 0 386.452 3.319 20 5 GGBDRN NC(=O)c1ccc(CN2CCC[C@H](Oc3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000133248996 1416869917 /nfs/dbraw/zinc/86/99/17/1416869917.db2.gz ZURGJTGPLHCDPM-HNNXBMFYSA-N 0 0 389.839 3.391 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000133251683 1416870453 /nfs/dbraw/zinc/87/04/53/1416870453.db2.gz YJHYRDDNBQNHMA-CXAGYDPISA-N 0 0 389.477 3.499 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000133264959 1416872009 /nfs/dbraw/zinc/87/20/09/1416872009.db2.gz MPONGXUFADXJTH-HXUWFJFHSA-N 0 0 391.468 3.291 20 5 GGBDRN COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000133266884 1416872116 /nfs/dbraw/zinc/87/21/16/1416872116.db2.gz MMWJMSLMNBQONN-OAHLLOKOSA-N 0 0 396.321 3.128 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(O)(c1ccccc1)c1ccccc1 ZINC000133291815 1416875207 /nfs/dbraw/zinc/87/52/07/1416875207.db2.gz UBXZFECSXQUUSJ-UHFFFAOYSA-N 0 0 376.412 3.190 20 5 GGBDRN CCc1ccc([C@@H](COC)NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)o1 ZINC000133317129 1416878056 /nfs/dbraw/zinc/87/80/56/1416878056.db2.gz RFCWKITYEWPNMU-CYBMUJFWSA-N 0 0 377.353 3.084 20 5 GGBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1CN(Cc1ccccc1)CC(F)F ZINC000133316245 1416878136 /nfs/dbraw/zinc/87/81/36/1416878136.db2.gz AZKRTLOYSMJCAI-UHFFFAOYSA-N 0 0 390.346 3.136 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@@H](C)N2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000133333425 1416879785 /nfs/dbraw/zinc/87/97/85/1416879785.db2.gz FXWMSNDITLBXEY-GFCCVEGCSA-N 0 0 390.465 3.087 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000133337310 1416880166 /nfs/dbraw/zinc/88/01/66/1416880166.db2.gz CWZZYHXXMDRORF-FQEVSTJZSA-N 0 0 390.443 3.468 20 5 GGBDRN CSC[C@H]1CCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000133344567 1416880735 /nfs/dbraw/zinc/88/07/35/1416880735.db2.gz GDWREIQEVLZDMF-CQSZACIVSA-N 0 0 399.538 3.101 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1Br ZINC000133360034 1416882352 /nfs/dbraw/zinc/88/23/52/1416882352.db2.gz BVNPPOQXPYBXNW-UHFFFAOYSA-N 0 0 394.181 3.238 20 5 GGBDRN COc1cccc(-c2nc(C)c(C(=O)NCCc3cccc([N+](=O)[O-])c3)[nH]2)c1 ZINC000133361872 1416882427 /nfs/dbraw/zinc/88/24/27/1416882427.db2.gz XOZMPNDWCFSONY-UHFFFAOYSA-N 0 0 380.404 3.274 20 5 GGBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133385209 1416884874 /nfs/dbraw/zinc/88/48/74/1416884874.db2.gz SVXOUAZWWSFJDS-KDOFPFPSSA-N 0 0 380.404 3.247 20 5 GGBDRN C[C@H]1[C@H](c2ccccc2)CCN1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000133384999 1416884893 /nfs/dbraw/zinc/88/48/93/1416884893.db2.gz SVXOUAZWWSFJDS-KBXCAEBGSA-N 0 0 380.404 3.247 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2ccc(N3CCC(C)CC3)nc2)c1[N+](=O)[O-] ZINC000133389217 1416885205 /nfs/dbraw/zinc/88/52/05/1416885205.db2.gz GLHFDBYGKLIJHL-UHFFFAOYSA-N 0 0 399.451 3.410 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000133395371 1416885518 /nfs/dbraw/zinc/88/55/18/1416885518.db2.gz ZNQHTXFQPRJDTO-NWDGAFQWSA-N 0 0 383.470 3.422 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000133395803 1416885858 /nfs/dbraw/zinc/88/58/58/1416885858.db2.gz ZNQHTXFQPRJDTO-RYUDHWBXSA-N 0 0 383.470 3.422 20 5 GGBDRN O=C(Nc1cccc(OCC(F)F)n1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000133411574 1416887486 /nfs/dbraw/zinc/88/74/86/1416887486.db2.gz BXMPPEOADCUETI-UHFFFAOYSA-N 0 0 389.318 3.072 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(F)c1 ZINC000133425638 1416888591 /nfs/dbraw/zinc/88/85/91/1416888591.db2.gz OMWDVZNRZWRUNY-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1ccccc1Cl ZINC000133426258 1416888876 /nfs/dbraw/zinc/88/88/76/1416888876.db2.gz AQHKTGIEKQVSSQ-KRWDZBQOSA-N 0 0 377.828 3.432 20 5 GGBDRN CN1C(=O)CCc2cc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)ccc21 ZINC000133440503 1416889900 /nfs/dbraw/zinc/88/99/00/1416889900.db2.gz AWLQTQSKBFZYRP-UHFFFAOYSA-N 0 0 380.404 3.094 20 5 GGBDRN CC(C)CC(=O)N[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000133444131 1416890179 /nfs/dbraw/zinc/89/01/79/1416890179.db2.gz PVFDVNTXHDPABS-FQEVSTJZSA-N 0 0 383.448 3.157 20 5 GGBDRN CCOC(=O)c1ccnc(NC[C@@H]2CCN(c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000133452672 1416891346 /nfs/dbraw/zinc/89/13/46/1416891346.db2.gz KMTBQFLBJOCFNV-ZDUSSCGKSA-N 0 0 388.399 3.244 20 5 GGBDRN CCCN(CC(F)F)S(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] ZINC000133486422 1416894657 /nfs/dbraw/zinc/89/46/57/1416894657.db2.gz YQNUYDMBLRZSNX-UHFFFAOYSA-N 0 0 387.202 3.023 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1ccc(N2CCCC2)c(F)c1 ZINC000133490641 1416894922 /nfs/dbraw/zinc/89/49/22/1416894922.db2.gz UKSZMOOFWGXZJR-UHFFFAOYSA-N 0 0 393.440 3.319 20 5 GGBDRN Cn1cccc1C(=O)N1CCCC[C@H]1CCOC(=O)c1cccc([N+](=O)[O-])c1 ZINC000133489383 1416894980 /nfs/dbraw/zinc/89/49/80/1416894980.db2.gz WVBUGLGIXPJJNB-INIZCTEOSA-N 0 0 385.420 3.175 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OS(=O)(=O)c2c(Cl)cccc2Cl)c1 ZINC000133511636 1416896881 /nfs/dbraw/zinc/89/68/81/1416896881.db2.gz OXMZGKYTAHYMGB-UHFFFAOYSA-N 0 0 376.173 3.482 20 5 GGBDRN Cc1cc(F)cc(C(=O)NCC(=O)OCc2ccccc2Cl)c1[N+](=O)[O-] ZINC000133526798 1416898298 /nfs/dbraw/zinc/89/82/98/1416898298.db2.gz BQEVBWULWIOVMI-UHFFFAOYSA-N 0 0 380.759 3.169 20 5 GGBDRN CN(Cc1cc(Br)cn1C)c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000133551073 1416901454 /nfs/dbraw/zinc/90/14/54/1416901454.db2.gz VHDLSVFNHNEZAG-UHFFFAOYSA-N 0 0 393.241 3.217 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000133568210 1416905912 /nfs/dbraw/zinc/90/59/12/1416905912.db2.gz WJQHYSGCYQYJKF-HOCLYGCPSA-N 0 0 391.468 3.289 20 5 GGBDRN Cc1cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)ccc1C(=O)N(C)C ZINC000133591164 1416913431 /nfs/dbraw/zinc/91/34/31/1416913431.db2.gz FPJOJIAJUKNDPU-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN COC(=O)CN(C)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000178673604 1429136249 /nfs/dbraw/zinc/13/62/49/1429136249.db2.gz FMYLZFZAUHSKLC-UHFFFAOYSA-N 0 0 391.811 3.105 20 5 GGBDRN CCOCCC1(CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CCCC1 ZINC000133602728 1416916007 /nfs/dbraw/zinc/91/60/07/1416916007.db2.gz CGCMMZGYOVCRRD-UHFFFAOYSA-N 0 0 386.452 3.497 20 5 GGBDRN Cc1cc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)ccc1C(=O)N(C)C ZINC000133625826 1416924088 /nfs/dbraw/zinc/92/40/88/1416924088.db2.gz HXERLKWCQFBJIL-UHFFFAOYSA-N 0 0 393.403 3.043 20 5 GGBDRN CCc1ccc(OCCCOc2ccc(S(C)(=O)=O)cc2)c([N+](=O)[O-])c1 ZINC000133646824 1416930319 /nfs/dbraw/zinc/93/03/19/1416930319.db2.gz ABEZTCMDPZTQPB-UHFFFAOYSA-N 0 0 379.434 3.409 20 5 GGBDRN Cc1c(NC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cccc1[N+](=O)[O-] ZINC000133657977 1416932553 /nfs/dbraw/zinc/93/25/53/1416932553.db2.gz LKWIULCYNMVOMN-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN COCCn1cc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cn1 ZINC000133676089 1416937631 /nfs/dbraw/zinc/93/76/31/1416937631.db2.gz VDSYZKPZBWVMLL-UHFFFAOYSA-N 0 0 395.419 3.302 20 5 GGBDRN Cc1c(Br)cc(C(=O)NC[C@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000133689681 1416942018 /nfs/dbraw/zinc/94/20/18/1416942018.db2.gz LXWOWTPWPJJABL-HNNXBMFYSA-N 0 0 397.200 3.268 20 5 GGBDRN Cc1nc(NC(=O)C2CCC(NC(=O)CC3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000133747963 1416955928 /nfs/dbraw/zinc/95/59/28/1416955928.db2.gz YMUUGTAGHOGGIC-UHFFFAOYSA-N 0 0 388.468 3.492 20 5 GGBDRN C[C@@H](CO[C@@H]1CCOC1)Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000133752288 1416956737 /nfs/dbraw/zinc/95/67/37/1416956737.db2.gz GFOPHQDNKAJNNT-WCBMZHEXSA-N 0 0 379.291 3.128 20 5 GGBDRN O=C1N[C@]2(CCc3ccccc3C2)C(=O)N1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000133769176 1416960223 /nfs/dbraw/zinc/96/02/23/1416960223.db2.gz UQRBZWSAVNBIIT-IBGZPJMESA-N 0 0 385.807 3.228 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CCC[C@@](C)(O)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000133772579 1416960935 /nfs/dbraw/zinc/96/09/35/1416960935.db2.gz UXNDBGXJBKLNSK-VBKZILBWSA-N 0 0 384.436 3.150 20 5 GGBDRN COc1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c(OC)c1 ZINC000133778669 1416961761 /nfs/dbraw/zinc/96/17/61/1416961761.db2.gz YSSCXFCDQBJQDV-UHFFFAOYSA-N 0 0 385.420 3.486 20 5 GGBDRN COc1ccc(NC(=O)CN2CCc3c(Cl)cccc3C2)c([N+](=O)[O-])c1 ZINC000133783575 1416962498 /nfs/dbraw/zinc/96/24/98/1416962498.db2.gz AFHCZPXCRGPCCZ-UHFFFAOYSA-N 0 0 375.812 3.254 20 5 GGBDRN Cc1nc(C)n(-c2ccccc2NC(=O)CCOc2ccccc2[N+](=O)[O-])n1 ZINC000133787850 1416963495 /nfs/dbraw/zinc/96/34/95/1416963495.db2.gz MOQQKKMJWZDERP-UHFFFAOYSA-N 0 0 381.392 3.200 20 5 GGBDRN COc1ccccc1OC[C@@H](C)CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000133805876 1416967505 /nfs/dbraw/zinc/96/75/05/1416967505.db2.gz VWONJESJLLOSQY-HNNXBMFYSA-N 0 0 399.447 3.386 20 5 GGBDRN C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1 ZINC000133813155 1416968709 /nfs/dbraw/zinc/96/87/09/1416968709.db2.gz DXWWULHPWXSGGF-ZDUSSCGKSA-N 0 0 381.392 3.248 20 5 GGBDRN Cc1nc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1[N+](=O)[O-] ZINC000133822349 1416970730 /nfs/dbraw/zinc/97/07/30/1416970730.db2.gz HNHLOAOVMHRVTQ-SECBINFHSA-N 0 0 380.744 3.266 20 5 GGBDRN Cc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)nn1C ZINC000133840842 1416974731 /nfs/dbraw/zinc/97/47/31/1416974731.db2.gz IQAHLKVZNDBVER-CYBMUJFWSA-N 0 0 380.408 3.457 20 5 GGBDRN Cc1cccc2c(CC(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c[nH]c21 ZINC000133842496 1416975267 /nfs/dbraw/zinc/97/52/67/1416975267.db2.gz ZORUQXJXRAIPEH-HNNXBMFYSA-N 0 0 379.420 3.035 20 5 GGBDRN Cc1ccc(C(=O)N2CCC(NC(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000133852699 1416978287 /nfs/dbraw/zinc/97/82/87/1416978287.db2.gz PSJGCEIJWNTAIN-UHFFFAOYSA-N 0 0 385.395 3.077 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](C)CS(=O)(=O)c1ccc(F)cc1 ZINC000133851363 1416978818 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392.350 3.174 20 5 GGBDRN Cc1cccc(F)c1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000133944953 1416999620 /nfs/dbraw/zinc/99/96/20/1416999620.db2.gz WHXBXLQXSPSGCD-UHFFFAOYSA-N 0 0 386.383 3.032 20 5 GGBDRN CCc1cc2c(ncn(CCOc3ccc(OC)cc3[N+](=O)[O-])c2=O)s1 ZINC000133956139 1417001315 /nfs/dbraw/zinc/00/13/15/1417001315.db2.gz CYKIWGGOKNNVOY-UHFFFAOYSA-N 0 0 375.406 3.016 20 5 GGBDRN Cc1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1N1CCCS1(=O)=O ZINC000133961307 1417002324 /nfs/dbraw/zinc/00/23/24/1417002324.db2.gz WXBAUUDPEGBPNU-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2ccc(F)cc2F)C1 ZINC000133982836 1417005226 /nfs/dbraw/zinc/00/52/26/1417005226.db2.gz RRGFUULRCZVBPR-OAHLLOKOSA-N 0 0 375.375 3.201 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000133984709 1417005898 /nfs/dbraw/zinc/00/58/98/1417005898.db2.gz OZLFPIQBSBKTIX-OLZOCXBDSA-N 0 0 395.431 3.499 20 5 GGBDRN 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O=C(NCCCOc1ccc(F)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134533688 1417083269 /nfs/dbraw/zinc/08/32/69/1417083269.db2.gz LEQAUNMRHNJFFU-UHFFFAOYSA-N 0 0 384.367 3.119 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000134547484 1417085635 /nfs/dbraw/zinc/08/56/35/1417085635.db2.gz QJBUOSNBBDSYRI-LBPRGKRZSA-N 0 0 385.811 3.311 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccc(F)cc1)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000134563334 1417087378 /nfs/dbraw/zinc/08/73/78/1417087378.db2.gz YVTKTXWVVGDQLG-UGSOOPFHSA-N 0 0 375.400 3.164 20 5 GGBDRN CCCNS(=O)(=O)c1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000134562099 1417087672 /nfs/dbraw/zinc/08/76/72/1417087672.db2.gz HJUDLKWAQCYNJF-UHFFFAOYSA-N 0 0 397.840 3.189 20 5 GGBDRN Cc1c(CC(=O)Nc2cccc(N3C(=S)N=NC3C)c2)cccc1[N+](=O)[O-] ZINC000134569566 1417088976 /nfs/dbraw/zinc/08/89/76/1417088976.db2.gz SSJQIDSRHKDTPC-UHFFFAOYSA-N 0 0 383.433 3.262 20 5 GGBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C 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O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1cccc2c1OCCCO2 ZINC000134671241 1417110319 /nfs/dbraw/zinc/11/03/19/1417110319.db2.gz QDRDQOHHLWPPQX-UHFFFAOYSA-N 0 0 385.420 3.265 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134678756 1417111755 /nfs/dbraw/zinc/11/17/55/1417111755.db2.gz VKOHWMBRTMZYSD-CHWSQXEVSA-N 0 0 381.860 3.405 20 5 GGBDRN O=C(NCc1cccc(NC(=O)N2CCCC2)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000134689813 1417113204 /nfs/dbraw/zinc/11/32/04/1417113204.db2.gz HLRFTXGJMBHWLY-UHFFFAOYSA-N 0 0 386.383 3.292 20 5 GGBDRN O=C(N[C@@H]1C[C@H]1c1c(F)cccc1F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134699052 1417113835 /nfs/dbraw/zinc/11/38/35/1417113835.db2.gz PBAREACRCZEADB-IAQYHMDHSA-N 0 0 384.342 3.345 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134714585 1417116328 /nfs/dbraw/zinc/11/63/28/1417116328.db2.gz XRNDVLPJTYWCKK-KSSFIOAISA-N 0 0 386.452 3.352 20 5 GGBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134714632 1417116471 /nfs/dbraw/zinc/11/64/71/1417116471.db2.gz XRNDVLPJTYWCKK-KDOFPFPSSA-N 0 0 386.452 3.352 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134724958 1417117463 /nfs/dbraw/zinc/11/74/63/1417117463.db2.gz WLISHSLYWUSLBK-STQMWFEESA-N 0 0 381.860 3.405 20 5 GGBDRN Cc1cn2c(nc(C)c2CN(C)C(=O)CN(C)c2ccccc2[N+](=O)[O-])s1 ZINC000134745670 1417119667 /nfs/dbraw/zinc/11/96/67/1417119667.db2.gz ZQEKXAVKSCASBW-UHFFFAOYSA-N 0 0 387.465 3.016 20 5 GGBDRN CCC1(CO)CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1 ZINC000134746906 1417120297 /nfs/dbraw/zinc/12/02/97/1417120297.db2.gz JIQQITGDTIQCJI-UHFFFAOYSA-N 0 0 375.469 3.210 20 5 GGBDRN C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)Oc1ccc(F)cc1 ZINC000134763230 1417121938 /nfs/dbraw/zinc/12/19/38/1417121938.db2.gz DTLKYJJLWXPUCU-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN CCOc1ccc(-c2nc(Cn3cnc4cc([N+](=O)[O-])ccc4c3=O)co2)cc1 ZINC000178746721 1429159771 /nfs/dbraw/zinc/15/97/71/1429159771.db2.gz PGGCMRCTIDQBHL-UHFFFAOYSA-N 0 0 392.371 3.407 20 5 GGBDRN COc1cc(-c2noc(CCc3cccc([N+](=O)[O-])c3)n2)cc(OC)c1OC ZINC000134779022 1417124533 /nfs/dbraw/zinc/12/45/33/1417124533.db2.gz HSVXBVUXMLMQNX-UHFFFAOYSA-N 0 0 385.376 3.456 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)ccc1C ZINC000134801182 1417128188 /nfs/dbraw/zinc/12/81/88/1417128188.db2.gz RZNHDLHTHUOBEK-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN CN(Cc1ccc(Cl)c(F)c1)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000134817527 1417131263 /nfs/dbraw/zinc/13/12/63/1417131263.db2.gz IWWIAJSNJITCPQ-UHFFFAOYSA-N 0 0 392.774 3.294 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC(C)(c2ccccc2)CC1 ZINC000178748301 1429160449 /nfs/dbraw/zinc/16/04/49/1429160449.db2.gz PNJTUSLSEWQLPZ-UHFFFAOYSA-N 0 0 397.431 3.122 20 5 GGBDRN CCN1C(=S)N=NC1[C@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134857047 1417134623 /nfs/dbraw/zinc/13/46/23/1417134623.db2.gz BNJWEZKBNMEWQE-JTQLQIEISA-N 0 0 395.872 3.168 20 5 GGBDRN 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1417155388 /nfs/dbraw/zinc/15/53/88/1417155388.db2.gz IOPALUGZWAITME-UHFFFAOYSA-N 0 0 397.431 3.186 20 5 GGBDRN COc1ccccc1OC[C@H](C)CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134977680 1417156084 /nfs/dbraw/zinc/15/60/84/1417156084.db2.gz TXWBSDZJKNOIEX-CQSZACIVSA-N 0 0 397.431 3.459 20 5 GGBDRN COC(=O)c1cccc(NC2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000135025259 1417164413 /nfs/dbraw/zinc/16/44/13/1417164413.db2.gz JIGLGIKDCUKPAX-UHFFFAOYSA-N 0 0 383.404 3.098 20 5 GGBDRN COC(=O)c1cccc(NC2CCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000135025367 1417164504 /nfs/dbraw/zinc/16/45/04/1417164504.db2.gz VYRUFLIDNFIZIK-UHFFFAOYSA-N 0 0 397.431 3.407 20 5 GGBDRN COc1ccc(C[C@@H](C)CNC(=O)NCc2ccccc2[N+](=O)[O-])cc1OC ZINC000135064104 1417169322 /nfs/dbraw/zinc/16/93/22/1417169322.db2.gz SRIPUDRSRDBUIT-CQSZACIVSA-N 0 0 387.436 3.290 20 5 GGBDRN CNC(=O)c1ccc(C)c(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000178765016 1429163294 /nfs/dbraw/zinc/16/32/94/1429163294.db2.gz HGSLHMHHZUFULR-UHFFFAOYSA-N 0 0 382.420 3.459 20 5 GGBDRN COC(=O)NCc1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000135085724 1417171387 /nfs/dbraw/zinc/17/13/87/1417171387.db2.gz POPWLGLYCGZABY-UHFFFAOYSA-N 0 0 382.376 3.113 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCN(Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000135119420 1417174180 /nfs/dbraw/zinc/17/41/80/1417174180.db2.gz IPXPSCTYBVYGLN-CQSZACIVSA-N 0 0 398.419 3.158 20 5 GGBDRN Cn1c(CCCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)nc2ccccc21 ZINC000135146399 1417177909 /nfs/dbraw/zinc/17/79/09/1417177909.db2.gz MJLTYLZSNVFZIK-UHFFFAOYSA-N 0 0 386.839 3.426 20 5 GGBDRN COc1cc(OCC(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000135167635 1417180562 /nfs/dbraw/zinc/18/05/62/1417180562.db2.gz QDDCHFVRNIZDJX-HNNXBMFYSA-N 0 0 388.395 3.213 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 ZINC000135169532 1417180632 /nfs/dbraw/zinc/18/06/32/1417180632.db2.gz MFDAQALFPNJXQJ-UHFFFAOYSA-N 0 0 399.300 3.050 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1SC(F)F ZINC000135172530 1417180955 /nfs/dbraw/zinc/18/09/55/1417180955.db2.gz RIFZQHGDBIUSPQ-UHFFFAOYSA-N 0 0 395.387 3.207 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1nc(-c2ccccc2)cs1 ZINC000135177759 1417181963 /nfs/dbraw/zinc/18/19/63/1417181963.db2.gz XYRJOFGBJHNVOE-UHFFFAOYSA-N 0 0 396.428 3.016 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000135181027 1417182544 /nfs/dbraw/zinc/18/25/44/1417182544.db2.gz BKKYQIRVIKZIDP-HNNXBMFYSA-N 0 0 395.394 3.019 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000135182648 1417183076 /nfs/dbraw/zinc/18/30/76/1417183076.db2.gz BDTVJYBGMROGKG-UHFFFAOYSA-N 0 0 389.411 3.144 20 5 GGBDRN O=C(CNC(=O)c1cccc(Cl)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135186334 1417183788 /nfs/dbraw/zinc/18/37/88/1417183788.db2.gz CDMPIYNKQBSKCW-UHFFFAOYSA-N 0 0 387.823 3.169 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000135202842 1417186616 /nfs/dbraw/zinc/18/66/16/1417186616.db2.gz GBAOFPZEMHDULF-OAHLLOKOSA-N 0 0 397.859 3.210 20 5 GGBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(SC(F)F)c1 ZINC000135202926 1417186695 /nfs/dbraw/zinc/18/66/95/1417186695.db2.gz NMHUPJZIYLTRQF-UHFFFAOYSA-N 0 0 395.387 3.207 20 5 GGBDRN COC(=O)c1c(C)[nH]c(C(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000135224333 1417191146 /nfs/dbraw/zinc/19/11/46/1417191146.db2.gz LXWNMWGMAUQEFP-UHFFFAOYSA-N 0 0 385.420 3.174 20 5 GGBDRN COc1ccccc1CN(C)C(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135226049 1417191252 /nfs/dbraw/zinc/19/12/52/1417191252.db2.gz IGOSIUDKEDXDKP-UHFFFAOYSA-N 0 0 383.448 3.226 20 5 GGBDRN O=C(CN(Cc1ccccc1[N+](=O)[O-])C1CC1)NCC1(c2ccccc2)CC1 ZINC000135228952 1417191970 /nfs/dbraw/zinc/19/19/70/1417191970.db2.gz YOENVKJQBLSEFF-UHFFFAOYSA-N 0 0 379.460 3.407 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135227448 1417192092 /nfs/dbraw/zinc/19/20/92/1417192092.db2.gz ZQBRPWQWJHOBQV-UHFFFAOYSA-N 0 0 384.392 3.415 20 5 GGBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000135229725 1417192550 /nfs/dbraw/zinc/19/25/50/1417192550.db2.gz MGHJJEXWFXMZLP-DZGCQCFKSA-N 0 0 395.394 3.333 20 5 GGBDRN O=c1cc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)nc2ccc(Cl)cn12 ZINC000135230179 1417192571 /nfs/dbraw/zinc/19/25/71/1417192571.db2.gz YWSQXNWIPLZQIV-UHFFFAOYSA-N 0 0 384.823 3.421 20 5 GGBDRN COCc1ccc(CNC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000135229896 1417192777 /nfs/dbraw/zinc/19/27/77/1417192777.db2.gz FDIKPOYBFIIRRQ-UHFFFAOYSA-N 0 0 383.448 3.022 20 5 GGBDRN CCc1ccc([C@H]2COCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)o1 ZINC000135234626 1417193208 /nfs/dbraw/zinc/19/32/08/1417193208.db2.gz ZTUTZVDCQHHCLP-GOSISDBHSA-N 0 0 383.404 3.374 20 5 GGBDRN O=C(CN(Cc1ccccc1[N+](=O)[O-])C1CC1)NCc1cc(F)cc(F)c1 ZINC000135235734 1417193420 /nfs/dbraw/zinc/19/34/20/1417193420.db2.gz OYCDCLIMAFEAKY-UHFFFAOYSA-N 0 0 375.375 3.154 20 5 GGBDRN O=C(CN(Cc1ccccc1[N+](=O)[O-])C1CC1)N[C@H]1CCOc2ccccc21 ZINC000135237811 1417193748 /nfs/dbraw/zinc/19/37/48/1417193748.db2.gz CNNXHMWCDKFUIE-SFHVURJKSA-N 0 0 381.432 3.199 20 5 GGBDRN Cc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c(Br)n1 ZINC000135243488 1417195173 /nfs/dbraw/zinc/19/51/73/1417195173.db2.gz ITTMEIPWSAVSGT-UHFFFAOYSA-N 0 0 390.190 3.001 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCN(Cc4cccc(F)c4)CC3)n2)c1 ZINC000178772251 1429165641 /nfs/dbraw/zinc/16/56/41/1429165641.db2.gz OPKIXFOKWVWEMX-UHFFFAOYSA-N 0 0 397.410 3.102 20 5 GGBDRN Cc1cccc(N(C)C(=O)c2cc([N+](=O)[O-])ccc2I)n1 ZINC000135247404 1417195632 /nfs/dbraw/zinc/19/56/32/1417195632.db2.gz HJERRNSISMMXGZ-UHFFFAOYSA-N 0 0 397.172 3.179 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@@](C)(c3ccc(C)cc3C)C2=O)cc1[N+](=O)[O-] ZINC000135323262 1417207684 /nfs/dbraw/zinc/20/76/84/1417207684.db2.gz OTPSKDNYNLFHDR-FQEVSTJZSA-N 0 0 383.404 3.187 20 5 GGBDRN CCSCC[C@H](C)N(C)c1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000135347617 1417210033 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392.419 3.336 20 5 GGBDRN Cc1c(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cccc1[N+](=O)[O-] ZINC000135452843 1417221685 /nfs/dbraw/zinc/22/16/85/1417221685.db2.gz IKNFRWRNTUKMDI-HNNXBMFYSA-N 0 0 391.786 3.231 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1cccc(N2CC=CC2)c1 ZINC000135450518 1417221780 /nfs/dbraw/zinc/22/17/80/1417221780.db2.gz UQRLVOFYHHKBAS-UHFFFAOYSA-N 0 0 376.416 3.311 20 5 GGBDRN Cc1cccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)c1[N+](=O)[O-] ZINC000135461405 1417223158 /nfs/dbraw/zinc/22/31/58/1417223158.db2.gz ILFJZJYAPGJECW-OAHLLOKOSA-N 0 0 391.786 3.231 20 5 GGBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N(C)CCO)cc1 ZINC000135474378 1417225058 /nfs/dbraw/zinc/22/50/58/1417225058.db2.gz KZOGMQULFYMTRF-CYBMUJFWSA-N 0 0 375.450 3.143 20 5 GGBDRN Cc1cc(F)cc(C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)c1[N+](=O)[O-] ZINC000135479119 1417225343 /nfs/dbraw/zinc/22/53/43/1417225343.db2.gz KCZUKOBJTAODEW-UHFFFAOYSA-N 0 0 385.355 3.411 20 5 GGBDRN 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ZINC000135509338 1417231281 /nfs/dbraw/zinc/23/12/81/1417231281.db2.gz KNZWYMGSNKLCNR-NSHDSACASA-N 0 0 393.469 3.130 20 5 GGBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCCCC(C)(C)CO)CC1 ZINC000135514367 1417231871 /nfs/dbraw/zinc/23/18/71/1417231871.db2.gz SSKOCJDZIIFWSR-UHFFFAOYSA-N 0 0 377.485 3.360 20 5 GGBDRN O=C(Cc1c[nH]c2cc(Cl)ccc12)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135526775 1417232761 /nfs/dbraw/zinc/23/27/61/1417232761.db2.gz KMYUQXDDWLPXTK-CQSZACIVSA-N 0 0 399.838 3.380 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1nc(C(F)(F)F)cs1 ZINC000135523629 1417232806 /nfs/dbraw/zinc/23/28/06/1417232806.db2.gz FNCGIJYXULBXBV-UHFFFAOYSA-N 0 0 384.339 3.410 20 5 GGBDRN Cc1ccc(-c2cc(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)on2)cc1 ZINC000135527546 1417233604 /nfs/dbraw/zinc/23/36/04/1417233604.db2.gz YRVJMQPTTBCHHA-OAHLLOKOSA-N 0 0 393.403 3.280 20 5 GGBDRN Cn1ccnc1C(=O)c1ccc(Oc2cc(F)cc([N+](=O)[O-])c2)c([N+](=O)[O-])c1 ZINC000135532184 1417233806 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C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)Cn1cccn1 ZINC000136278062 1417306760 /nfs/dbraw/zinc/30/67/60/1417306760.db2.gz GEPIHJMHEILIPQ-MRXNPFEDSA-N 0 0 393.447 3.470 20 5 GGBDRN CCC(=O)N1CC[C@@H](NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)C1 ZINC000136291173 1417307824 /nfs/dbraw/zinc/30/78/24/1417307824.db2.gz ZMBWIIMVJYSVRU-OAHLLOKOSA-N 0 0 393.509 3.474 20 5 GGBDRN C[C@@H](O)C1CCN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000136313071 1417308763 /nfs/dbraw/zinc/30/87/63/1417308763.db2.gz LMYSLOGTRPUDPR-OWCLPIDISA-N 0 0 389.496 3.310 20 5 GGBDRN C[C@@H](O)C1CCN(C(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000136313159 1417308825 /nfs/dbraw/zinc/30/88/25/1417308825.db2.gz LMYSLOGTRPUDPR-BZUAXINKSA-N 0 0 389.496 3.310 20 5 GGBDRN O=C(c1ccccc1)N1CCCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000136310965 1417308862 /nfs/dbraw/zinc/30/88/62/1417308862.db2.gz JYHOBAGPBUWIRU-UHFFFAOYSA-N 0 0 387.823 3.237 20 5 GGBDRN 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1417461426 /nfs/dbraw/zinc/46/14/26/1417461426.db2.gz FORLWRAVGMCSRP-SWLSCSKDSA-N 0 0 396.852 3.274 20 5 GGBDRN CC(C)(C)Oc1ccc(CNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000140031616 1417485790 /nfs/dbraw/zinc/48/57/90/1417485790.db2.gz ZCFSOSUDSMTLKE-UHFFFAOYSA-N 0 0 379.438 3.032 20 5 GGBDRN O=C(c1csc(-c2cnccn2)n1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178833654 1429187962 /nfs/dbraw/zinc/18/79/62/1429187962.db2.gz AVYDUKHQVABGGA-UHFFFAOYSA-N 0 0 381.417 3.313 20 5 GGBDRN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000140245024 1417493935 /nfs/dbraw/zinc/49/39/35/1417493935.db2.gz ITKRPTWIWQCIKM-LIRRHRJNSA-N 0 0 380.404 3.369 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)NC[C@@H]2CCCCO2)cc1[N+](=O)[O-])c1ccccn1 ZINC000140777105 1417516101 /nfs/dbraw/zinc/51/61/01/1417516101.db2.gz WERYZWLYHYXJJZ-ZBFHGGJFSA-N 0 0 384.436 3.462 20 5 GGBDRN Cc1cc(NC2CCN(C(=O)C3CC3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000140911905 1417520656 /nfs/dbraw/zinc/52/06/56/1417520656.db2.gz SFZGVWJNQDHYRL-UHFFFAOYSA-N 0 0 381.436 3.173 20 5 GGBDRN CCOC(=O)N[C@@H]1CCCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000140965699 1417522583 /nfs/dbraw/zinc/52/25/83/1417522583.db2.gz DGTMWMKKZAWIEP-OAHLLOKOSA-N 0 0 385.424 3.075 20 5 GGBDRN COc1cccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000141248986 1417530937 /nfs/dbraw/zinc/53/09/37/1417530937.db2.gz FFCYMZVBGZDYMX-IBGZPJMESA-N 0 0 384.432 3.354 20 5 GGBDRN C[C@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 ZINC000141678512 1417549938 /nfs/dbraw/zinc/54/99/38/1417549938.db2.gz GVBCERVXLRGIKH-BJTBTHHMSA-N 0 0 381.388 3.442 20 5 GGBDRN O=C(CN(Cc1ccco1)C[C@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000141798679 1417557715 /nfs/dbraw/zinc/55/77/15/1417557715.db2.gz LGSMFNRUAANRTQ-OAHLLOKOSA-N 0 0 393.827 3.461 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN(Cc3ccco3)C[C@@H]3CCCO3)n2)cc1 ZINC000141871352 1417561751 /nfs/dbraw/zinc/56/17/51/1417561751.db2.gz GUIFIPBZXFYMTK-KRWDZBQOSA-N 0 0 384.392 3.419 20 5 GGBDRN COc1ccc([C@H]2CCCN2C(=O)COc2ccccc2[N+](=O)[O-])cc1OC ZINC000141988283 1417568847 /nfs/dbraw/zinc/56/88/47/1417568847.db2.gz XMPGTXIMQVQZFJ-OAHLLOKOSA-N 0 0 386.404 3.355 20 5 GGBDRN CNc1ccc(C(=O)N(Cc2cccc(OC)c2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000142306455 1417581750 /nfs/dbraw/zinc/58/17/50/1417581750.db2.gz TWHQBNKHWTZEDD-SFHVURJKSA-N 0 0 399.447 3.467 20 5 GGBDRN Cc1ccc([C@H](CNS(=O)(=O)c2ccccc2[N+](=O)[O-])N2CCCC2)cc1 ZINC000142608704 1417593280 /nfs/dbraw/zinc/59/32/80/1417593280.db2.gz STFABECGLYRINN-SFHVURJKSA-N 0 0 389.477 3.019 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H](O)c2cc3ccccc3s2)ccc1[N+](=O)[O-] ZINC000178853484 1429195871 /nfs/dbraw/zinc/19/58/71/1429195871.db2.gz ZDCQRWWOYVNCOZ-OAHLLOKOSA-N 0 0 392.458 3.130 20 5 GGBDRN CCCCOc1ccc(OC)cc1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000143024262 1417608854 /nfs/dbraw/zinc/60/88/54/1417608854.db2.gz CVMJDPAHQNOGOG-UHFFFAOYSA-N 0 0 376.413 3.316 20 5 GGBDRN Cc1cc(CNc2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])on1 ZINC000143361805 1417629298 /nfs/dbraw/zinc/62/92/98/1417629298.db2.gz PJCRDPVWTCNUDV-UHFFFAOYSA-N 0 0 394.453 3.068 20 5 GGBDRN Cc1c(C(=O)NC[C@H](O)COc2cccc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000143797581 1417649224 /nfs/dbraw/zinc/64/92/24/1417649224.db2.gz INBQCUCLSZUHGE-NSHDSACASA-N 0 0 399.230 3.380 20 5 GGBDRN O=C(NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000143921291 1417651901 /nfs/dbraw/zinc/65/19/01/1417651901.db2.gz CNXZPYLJFQWGMI-UHFFFAOYSA-N 0 0 388.387 3.101 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2C[C@@H](C)OC[C@@H]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC000144000838 1417654090 /nfs/dbraw/zinc/65/40/90/1417654090.db2.gz FEXBTQXAHKPOMJ-ZNMIVQPWSA-N 0 0 384.436 3.412 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 ZINC000144266222 1417659903 /nfs/dbraw/zinc/65/99/03/1417659903.db2.gz NTXWHLFNKHGEBD-ZDUSSCGKSA-N 0 0 384.392 3.112 20 5 GGBDRN COC(=O)c1cc(C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000144914918 1417675204 /nfs/dbraw/zinc/67/52/04/1417675204.db2.gz XULUQUCTZYHFKS-DNVCBOLYSA-N 0 0 398.415 3.279 20 5 GGBDRN O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000144921873 1417675917 /nfs/dbraw/zinc/67/59/17/1417675917.db2.gz MTXPGZCXXNATKM-KDOFPFPSSA-N 0 0 385.376 3.401 20 5 GGBDRN COc1cc(CCNC(=O)Nc2cccnc2Cl)c([N+](=O)[O-])cc1OC ZINC000145119694 1417680583 /nfs/dbraw/zinc/68/05/83/1417680583.db2.gz YOLNGKQZZNQGRX-UHFFFAOYSA-N 0 0 380.788 3.025 20 5 GGBDRN CC(=O)Nc1cc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)ccc1Cl ZINC000145250154 1417684011 /nfs/dbraw/zinc/68/40/11/1417684011.db2.gz MHGHKKQQZZIOPM-UHFFFAOYSA-N 0 0 377.740 3.188 20 5 GGBDRN CCCCN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1 ZINC000145522590 1417690836 /nfs/dbraw/zinc/69/08/36/1417690836.db2.gz RQJUYFUAPLPOGY-UHFFFAOYSA-N 0 0 376.434 3.445 20 5 GGBDRN CC(C)c1ccc(CCNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 ZINC000145757495 1417699385 /nfs/dbraw/zinc/69/93/85/1417699385.db2.gz QHPXPCGBQKWYJA-UHFFFAOYSA-N 0 0 390.461 3.094 20 5 GGBDRN O=C(NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000146183428 1417712254 /nfs/dbraw/zinc/71/22/54/1417712254.db2.gz SJQUEQWOPSVPGT-UHFFFAOYSA-N 0 0 379.298 3.057 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000146252758 1417713251 /nfs/dbraw/zinc/71/32/51/1417713251.db2.gz MAPIIAIEKGELFV-KDOFPFPSSA-N 0 0 394.424 3.180 20 5 GGBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000146314485 1417715155 /nfs/dbraw/zinc/71/51/55/1417715155.db2.gz CCMYTHLXEUSHAL-YJBOKZPZSA-N 0 0 376.434 3.041 20 5 GGBDRN CC(C)N(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000146391373 1417718202 /nfs/dbraw/zinc/71/82/02/1417718202.db2.gz NSWGWZPQWQQCMA-UHFFFAOYSA-N 0 0 376.434 3.049 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCCOc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000146408057 1417719276 /nfs/dbraw/zinc/71/92/76/1417719276.db2.gz JKFNAIIXGNCVGY-HNNXBMFYSA-N 0 0 387.367 3.011 20 5 GGBDRN O=C([C@H]1C[C@@H]1c1cccc(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000146651037 1417726618 /nfs/dbraw/zinc/72/66/18/1417726618.db2.gz ZLNBRTUWHGJDHB-SJORKVTESA-N 0 0 386.839 3.096 20 5 GGBDRN CC(C)CCc1nc(CN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cs1 ZINC000146671068 1417727810 /nfs/dbraw/zinc/72/78/10/1417727810.db2.gz BJJHSHWHGAYURK-UHFFFAOYSA-N 0 0 375.498 3.357 20 5 GGBDRN CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000146668684 1417727823 /nfs/dbraw/zinc/72/78/23/1417727823.db2.gz VFZQFYXQQNLFGT-CVEARBPZSA-N 0 0 382.482 3.333 20 5 GGBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NCc1ccccc1N1CCCC1 ZINC000146959948 1417734974 /nfs/dbraw/zinc/73/49/74/1417734974.db2.gz BEOFVOSYHAOYBD-UHFFFAOYSA-N 0 0 395.868 3.327 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)[C@H]2CCCC[C@H]12 ZINC000146972237 1417735407 /nfs/dbraw/zinc/73/54/07/1417735407.db2.gz LTLYVWLFMFNJMA-JLZZUVOBSA-N 0 0 380.466 3.039 20 5 GGBDRN CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000147191565 1417740003 /nfs/dbraw/zinc/74/00/03/1417740003.db2.gz AFYBMVKFILOEPM-UHFFFAOYSA-N 0 0 377.347 3.282 20 5 GGBDRN CN(CCCCc1ccccc1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 ZINC000147198210 1417741218 /nfs/dbraw/zinc/74/12/18/1417741218.db2.gz MRXJFQJERNDXIT-UHFFFAOYSA-N 0 0 390.461 3.093 20 5 GGBDRN COc1cc2c(cc1CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)O[C@H](C)C2 ZINC000178876432 1429206324 /nfs/dbraw/zinc/20/63/24/1429206324.db2.gz QHJIBCRHVRNEBW-OLZOCXBDSA-N 0 0 385.420 3.487 20 5 GGBDRN CCCCNS(=O)(=O)c1cccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000147367796 1417745311 /nfs/dbraw/zinc/74/53/11/1417745311.db2.gz KPSRXODMARPBQZ-UHFFFAOYSA-N 0 0 391.449 3.234 20 5 GGBDRN Cc1cc(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)cc([N+](=O)[O-])c1 ZINC000147452049 1417748026 /nfs/dbraw/zinc/74/80/26/1417748026.db2.gz UNALFCPKLJROBM-INIZCTEOSA-N 0 0 383.404 3.064 20 5 GGBDRN COc1cc2c(cc1CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)O[C@H](C)C2 ZINC000178876449 1429206847 /nfs/dbraw/zinc/20/68/47/1429206847.db2.gz QHJIBCRHVRNEBW-CHWSQXEVSA-N 0 0 385.420 3.487 20 5 GGBDRN Cc1cc(C(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000147725215 1417753152 /nfs/dbraw/zinc/75/31/52/1417753152.db2.gz WBSCLSBBTZLHLO-UHFFFAOYSA-N 0 0 385.395 3.077 20 5 GGBDRN C[C@@H](CC(=O)OCc1ccccc1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000178877031 1429207856 /nfs/dbraw/zinc/20/78/56/1429207856.db2.gz PPULZNOUOIDRDZ-HNNXBMFYSA-N 0 0 385.420 3.258 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@@H](OCc2ccncc2)C1 ZINC000178878768 1429208099 /nfs/dbraw/zinc/20/80/99/1429208099.db2.gz BZCAOCINCSTGCH-MRXNPFEDSA-N 0 0 395.337 3.440 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccccc1C(=O)NC(C)(C)C ZINC000149321789 1417774600 /nfs/dbraw/zinc/77/46/00/1417774600.db2.gz YRGVTUNILYPYDR-UHFFFAOYSA-N 0 0 384.436 3.482 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1 ZINC000149446017 1417776315 /nfs/dbraw/zinc/77/63/15/1417776315.db2.gz YILVPJMEWAZZTN-UHFFFAOYSA-N 0 0 394.435 3.328 20 5 GGBDRN COc1ccc(N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1OC ZINC000149725341 1417779517 /nfs/dbraw/zinc/77/95/17/1417779517.db2.gz TTWBKYJUCURMPD-UHFFFAOYSA-N 0 0 385.420 3.489 20 5 GGBDRN COc1ccc(N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1OC ZINC000149799967 1417780136 /nfs/dbraw/zinc/78/01/36/1417780136.db2.gz FTAHGZVDZNUBJD-UHFFFAOYSA-N 0 0 382.376 3.074 20 5 GGBDRN COc1cc(OCC(=O)N[C@@H](C)COc2c(C)cccc2C)ccc1[N+](=O)[O-] ZINC000150009606 1417783433 /nfs/dbraw/zinc/78/34/33/1417783433.db2.gz LXUQXAJKXJOPQY-HNNXBMFYSA-N 0 0 388.420 3.183 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)cc([N+](=O)[O-])c1 ZINC000150028504 1417784221 /nfs/dbraw/zinc/78/42/21/1417784221.db2.gz XOKANXBPDYXALD-GOSISDBHSA-N 0 0 398.419 3.456 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)NC[C@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000178880669 1429209563 /nfs/dbraw/zinc/20/95/63/1429209563.db2.gz HGHPXABCRXJKSO-AWEZNQCLSA-N 0 0 398.868 3.001 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CC=C(c2ccc(F)cc2)CC1 ZINC000178884083 1429210067 /nfs/dbraw/zinc/21/00/67/1429210067.db2.gz HPDVTPUPCWUNKS-AWEZNQCLSA-N 0 0 397.406 3.168 20 5 GGBDRN CC[C@@](C)(NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1nc(C)cs1 ZINC000150735418 1417794306 /nfs/dbraw/zinc/79/43/06/1417794306.db2.gz HGFHOJQCNHRUBF-GOSISDBHSA-N 0 0 386.433 3.256 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c2ccccc2NC1=O ZINC000150746904 1417797385 /nfs/dbraw/zinc/79/73/85/1417797385.db2.gz HMAAKTQNFCEGRX-CQSZACIVSA-N 0 0 394.431 3.430 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c2ccccc2NC1=O ZINC000150746917 1417797412 /nfs/dbraw/zinc/79/74/12/1417797412.db2.gz HMAAKTQNFCEGRX-AWEZNQCLSA-N 0 0 394.431 3.430 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(OC3CCOCC3)c(C)c2)c1[N+](=O)[O-] ZINC000150761456 1417802080 /nfs/dbraw/zinc/80/20/80/1417802080.db2.gz KHIJHSIJYBXXOW-UHFFFAOYSA-N 0 0 388.424 3.389 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NCC1(c2ccc(F)cc2)CCOCC1 ZINC000150791071 1417807325 /nfs/dbraw/zinc/80/73/25/1417807325.db2.gz DROJALLJRXUENH-UHFFFAOYSA-N 0 0 390.386 3.280 20 5 GGBDRN COc1cc(S(=O)(=O)N[C@H](c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000150795362 1417808134 /nfs/dbraw/zinc/80/81/34/1417808134.db2.gz ODUDQIDHDPGAAE-CQSZACIVSA-N 0 0 390.339 3.185 20 5 GGBDRN CC(=O)c1ccc(Cl)c(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000150808019 1417810947 /nfs/dbraw/zinc/81/09/47/1417810947.db2.gz HTBZCDZDEMLLGV-UHFFFAOYSA-N 0 0 385.767 3.284 20 5 GGBDRN O=C(NC1(c2cccc(Cl)c2)CC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000150821241 1417813742 /nfs/dbraw/zinc/81/37/42/1417813742.db2.gz UWNIKWMVCXKXEL-UHFFFAOYSA-N 0 0 383.795 3.248 20 5 GGBDRN COc1cc(S(=O)(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000150824398 1417814615 /nfs/dbraw/zinc/81/46/15/1417814615.db2.gz TVUCQKRXSIXSAZ-DOMZBBRYSA-N 0 0 380.422 3.358 20 5 GGBDRN COc1cccc(Br)c1OC(=O)COc1ccccc1[N+](=O)[O-] ZINC000150833639 1417816160 /nfs/dbraw/zinc/81/61/60/1417816160.db2.gz SBHIYCYWXPJJKZ-UHFFFAOYSA-N 0 0 382.166 3.350 20 5 GGBDRN CCOC(=O)c1ccnc(N(C)[C@@H]2CCCc3nc(C)sc32)c1[N+](=O)[O-] ZINC000150839744 1417817839 /nfs/dbraw/zinc/81/78/39/1417817839.db2.gz XXEMONLXCRIQGI-CYBMUJFWSA-N 0 0 376.438 3.445 20 5 GGBDRN Cc1ccc(CNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c(OC(C)C)c1 ZINC000150847741 1417819731 /nfs/dbraw/zinc/81/97/31/1417819731.db2.gz GJQZIIXOMCHIRQ-UHFFFAOYSA-N 0 0 395.419 3.201 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000150848718 1417820102 /nfs/dbraw/zinc/82/01/02/1417820102.db2.gz APFODBHWNACLHM-HOCLYGCPSA-N 0 0 391.468 3.289 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000150848673 1417820263 /nfs/dbraw/zinc/82/02/63/1417820263.db2.gz APFODBHWNACLHM-GOEBONIOSA-N 0 0 391.468 3.289 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000150871453 1417824989 /nfs/dbraw/zinc/82/49/89/1417824989.db2.gz JPASRJBUMBFQBR-ZBFHGGJFSA-N 0 0 391.468 3.289 20 5 GGBDRN 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390.399 3.154 20 5 GGBDRN CC(C)c1ccc(C[C@@H](C)NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000152204580 1418172520 /nfs/dbraw/zinc/17/25/20/1418172520.db2.gz JLNNQKJMVJMKRY-CQSZACIVSA-N 0 0 397.431 3.374 20 5 GGBDRN O=C(NCCOc1ncc(Cl)cc1Cl)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000152205810 1418172681 /nfs/dbraw/zinc/17/26/81/1418172681.db2.gz IYLGKJYQSMLCLV-UHFFFAOYSA-N 0 0 392.145 3.384 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccco1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000152206894 1418173272 /nfs/dbraw/zinc/17/32/72/1418173272.db2.gz JQFCLFPIAOZERN-KSSFIOAISA-N 0 0 387.436 3.420 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)c1 ZINC000152234566 1418180236 /nfs/dbraw/zinc/18/02/36/1418180236.db2.gz YIROGEQMEHPQOS-GOSISDBHSA-N 0 0 389.358 3.237 20 5 GGBDRN O=C(CCN1C(=O)CCc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152236458 1418180672 /nfs/dbraw/zinc/18/06/72/1418180672.db2.gz IPSPMFPWUOIXOZ-UHFFFAOYSA-N 0 0 393.443 3.455 20 5 GGBDRN O=C(c1cccc(N2C(=O)CCC2=O)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152249637 1418184128 /nfs/dbraw/zinc/18/41/28/1418184128.db2.gz MALLVPRLMFAYJS-UHFFFAOYSA-N 0 0 393.399 3.053 20 5 GGBDRN C[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)n1nnc(-c2ccccc2)n1 ZINC000152259450 1418187233 /nfs/dbraw/zinc/18/72/33/1418187233.db2.gz LQYLKLKWGSLDOH-AWEZNQCLSA-N 0 0 392.419 3.001 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@H]2CC[C@H](CO)CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000152272688 1418190593 /nfs/dbraw/zinc/19/05/93/1418190593.db2.gz SIJXUWOKFDRXJI-INMHGKMJSA-N 0 0 398.463 3.444 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000179005740 1429240668 /nfs/dbraw/zinc/24/06/68/1429240668.db2.gz IWUJQISHSGXWSF-YJBOKZPZSA-N 0 0 390.461 3.349 20 5 GGBDRN NC(=O)c1ccc(N2CCC[C@@H](c3nc4c(s3)CCCC4)C2)c([N+](=O)[O-])c1 ZINC000152283998 1418194250 /nfs/dbraw/zinc/19/42/50/1418194250.db2.gz WZRRNHVKIMQLLL-CYBMUJFWSA-N 0 0 386.477 3.413 20 5 GGBDRN COC[C@@H](NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)C1CC1 ZINC000152296306 1418198146 /nfs/dbraw/zinc/19/81/46/1418198146.db2.gz QSPHYBMEOSFZBT-CQSZACIVSA-N 0 0 399.234 3.242 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000179005769 1429240961 /nfs/dbraw/zinc/24/09/61/1429240961.db2.gz IWUJQISHSGXWSF-CRAIPNDOSA-N 0 0 390.461 3.349 20 5 GGBDRN Cn1cc(-c2nc(C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)cs2)cn1 ZINC000152299687 1418198411 /nfs/dbraw/zinc/19/84/11/1418198411.db2.gz HBBNRWIOBXSLHP-UHFFFAOYSA-N 0 0 383.433 3.257 20 5 GGBDRN CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000179012401 1429242923 /nfs/dbraw/zinc/24/29/23/1429242923.db2.gz POGXKQLOSRLUBP-NSHDSACASA-N 0 0 397.478 3.127 20 5 GGBDRN C[C@H]1c2cccn2CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000179023717 1429245031 /nfs/dbraw/zinc/24/50/31/1429245031.db2.gz GFIWZKKFVDMLLW-JTQLQIEISA-N 0 0 389.355 3.181 20 5 GGBDRN COc1ccc(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cc1Cl ZINC000179030494 1429246011 /nfs/dbraw/zinc/24/60/11/1429246011.db2.gz GLZYSVIAFZQWJN-GOSISDBHSA-N 0 0 389.795 3.224 20 5 GGBDRN O=C(Nc1ccc(N2CCOCC2)nc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000179037904 1429247336 /nfs/dbraw/zinc/24/73/36/1429247336.db2.gz GLDGVYSZAXJNSE-UHFFFAOYSA-N 0 0 397.435 3.023 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1OC[C@@H](O)COc1cccc(Br)c1 ZINC000179043888 1429248491 /nfs/dbraw/zinc/24/84/91/1429248491.db2.gz FBQWEZYIZZGUKU-LBPRGKRZSA-N 0 0 386.173 3.315 20 5 GGBDRN CC(=O)c1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1C ZINC000179044050 1429248989 /nfs/dbraw/zinc/24/89/89/1429248989.db2.gz CGKRFXAXCIOCBY-UHFFFAOYSA-N 0 0 382.420 3.460 20 5 GGBDRN CC1CCC2(CC1)NC(=O)N(Cc1ccc(Br)c([N+](=O)[O-])c1)C2=O ZINC000179044523 1429249187 /nfs/dbraw/zinc/24/91/87/1429249187.db2.gz QBXFPCQPXUHPSB-UHFFFAOYSA-N 0 0 396.241 3.358 20 5 GGBDRN O=C(c1ccccc1)N1CCC[C@@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000179092149 1429259290 /nfs/dbraw/zinc/25/92/90/1429259290.db2.gz PADKLMLLZPVUPY-LJQANCHMSA-N 0 0 379.416 3.179 20 5 GGBDRN C[C@H](NC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000179129617 1429271324 /nfs/dbraw/zinc/27/13/24/1429271324.db2.gz CGUZDWYLOBYGRL-RDJZCZTQSA-N 0 0 396.447 3.004 20 5 GGBDRN O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179161845 1429281963 /nfs/dbraw/zinc/28/19/63/1429281963.db2.gz QBLRXZTZSTVAMP-VQTJNVASSA-N 0 0 392.415 3.431 20 5 GGBDRN O=C(CSCc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cccs2)CC1 ZINC000179151027 1429279078 /nfs/dbraw/zinc/27/90/78/1429279078.db2.gz RAJUYHZMTRTSCP-UHFFFAOYSA-N 0 0 391.518 3.234 20 5 GGBDRN Cc1oc(-c2cnn(C)c2)nc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179151012 1429279156 /nfs/dbraw/zinc/27/91/56/1429279156.db2.gz GUCOQGMLGYYGIC-UHFFFAOYSA-N 0 0 381.392 3.097 20 5 GGBDRN CC[C@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)CCO1 ZINC000179154440 1429279821 /nfs/dbraw/zinc/27/98/21/1429279821.db2.gz JPXJTYMOCUOLCF-VIFPVBQESA-N 0 0 377.622 3.262 20 5 GGBDRN Cc1nc(CN2CCN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)cs1 ZINC000179155958 1429279879 /nfs/dbraw/zinc/27/98/79/1429279879.db2.gz JNUJVMWMTNSYQP-UHFFFAOYSA-N 0 0 399.476 3.333 20 5 GGBDRN O=C(NCCc1nc2c(s1)CCCC2)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179158860 1429281090 /nfs/dbraw/zinc/28/10/90/1429281090.db2.gz DVVNEPQMDOASMY-UHFFFAOYSA-N 0 0 397.460 3.088 20 5 GGBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179161860 1429281754 /nfs/dbraw/zinc/28/17/54/1429281754.db2.gz QBLRXZTZSTVAMP-WOJBJXKFSA-N 0 0 392.415 3.431 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCC[C@@H](COc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000179179589 1429286843 /nfs/dbraw/zinc/28/68/43/1429286843.db2.gz IBUJAFWZPVQOOM-GFCCVEGCSA-N 0 0 392.843 3.465 20 5 GGBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000179182209 1429288160 /nfs/dbraw/zinc/28/81/60/1429288160.db2.gz QYYPXKNYFOWDKS-SFHVURJKSA-N 0 0 387.436 3.086 20 5 GGBDRN CC(C)(CCO)CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000179183366 1429288505 /nfs/dbraw/zinc/28/85/05/1429288505.db2.gz RXITVSWCPYUTQG-UHFFFAOYSA-N 0 0 379.638 3.149 20 5 GGBDRN Cc1cc(S(=O)(=O)Nc2cccc(-c3cc[nH]n3)c2)cc([N+](=O)[O-])c1F ZINC000179188690 1429289822 /nfs/dbraw/zinc/28/98/22/1429289822.db2.gz BFQZGJRVNYLTHT-UHFFFAOYSA-N 0 0 376.369 3.233 20 5 GGBDRN C[C@@]1(c2ccccc2)CC(=O)N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1=O ZINC000179205784 1429294383 /nfs/dbraw/zinc/29/43/83/1429294383.db2.gz UZHSDQKUBWMLTO-NRFANRHFSA-N 0 0 391.383 3.467 20 5 GGBDRN COc1c(C)cnc(CN(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1C ZINC000179208935 1429295484 /nfs/dbraw/zinc/29/54/84/1429295484.db2.gz XMXWKROPXHLXKE-UHFFFAOYSA-N 0 0 382.420 3.298 20 5 GGBDRN C[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000179213548 1429296926 /nfs/dbraw/zinc/29/69/26/1429296926.db2.gz GKLZYXDAJXJIGV-KXBFYZLASA-N 0 0 396.447 3.146 20 5 GGBDRN O=C(Nc1ccccc1C(=O)N[C@@H]1CCOC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000179220594 1429298200 /nfs/dbraw/zinc/29/82/00/1429298200.db2.gz WBMZBAUMOCDSDC-LLVKDONJSA-N 0 0 389.795 3.019 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)OCO2)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179223336 1429298809 /nfs/dbraw/zinc/29/88/09/1429298809.db2.gz HQFIBCGVMXDSJG-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN Cc1ncsc1CCS(=O)(=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179237724 1429302597 /nfs/dbraw/zinc/30/25/97/1429302597.db2.gz NCBFJJDPVOGACL-UHFFFAOYSA-N 0 0 393.446 3.172 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(C[S@](=O)Cc3nccn3C(F)F)co2)cc1 ZINC000179234457 1429301431 /nfs/dbraw/zinc/30/14/31/1429301431.db2.gz GZSRRMOLMIOGAN-SANMLTNESA-N 0 0 382.348 3.290 20 5 GGBDRN O=C(OCc1nc(C(F)(F)F)cs1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000179237069 1429301925 /nfs/dbraw/zinc/30/19/25/1429301925.db2.gz FGAGDSGEUXHQAE-UHFFFAOYSA-N 0 0 399.310 3.008 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000179235065 1429302162 /nfs/dbraw/zinc/30/21/62/1429302162.db2.gz KEYHSNRXQIJSOC-UHFFFAOYSA-N 0 0 387.484 3.275 20 5 GGBDRN Cc1c(C(=O)Nc2ccc([S@@](C)=O)c(F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000179248158 1429304667 /nfs/dbraw/zinc/30/46/67/1429304667.db2.gz SYTTVQOEZCIETM-HHHXNRCGSA-N 0 0 395.368 3.249 20 5 GGBDRN COc1ccccc1C[C@H]1CCC[C@@H]1OC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000179273541 1429310315 /nfs/dbraw/zinc/31/03/15/1429310315.db2.gz BNVIFKVPADKZRI-AEFFLSMTSA-N 0 0 387.436 3.453 20 5 GGBDRN O=C1NC2(CCCCCC2)C(=O)N1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179275893 1429311328 /nfs/dbraw/zinc/31/13/28/1429311328.db2.gz AUYKVJCPECZZSH-UHFFFAOYSA-N 0 0 384.392 3.395 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCN(Cc2cccc(F)c2)CC1 ZINC000179305369 1429322080 /nfs/dbraw/zinc/32/20/80/1429322080.db2.gz CKNYZZWRZFXWBV-UHFFFAOYSA-N 0 0 396.422 3.102 20 5 GGBDRN C[C@H](NC(=O)NCc1cccnc1OCC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000179311996 1429324610 /nfs/dbraw/zinc/32/46/10/1429324610.db2.gz VDVZGQAFGAULFZ-NSHDSACASA-N 0 0 380.351 3.194 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000179311418 1429324755 /nfs/dbraw/zinc/32/47/55/1429324755.db2.gz YCCTXUQEZNXUOZ-IBGZPJMESA-N 0 0 383.379 3.358 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000179311427 1429324776 /nfs/dbraw/zinc/32/47/76/1429324776.db2.gz YCCTXUQEZNXUOZ-LJQANCHMSA-N 0 0 383.379 3.358 20 5 GGBDRN O=C(Nc1nc(-c2ccc[nH]2)cs1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179320306 1429327919 /nfs/dbraw/zinc/32/79/19/1429327919.db2.gz YTGAOFUUCGHLPW-UHFFFAOYSA-N 0 0 380.389 3.484 20 5 GGBDRN COc1ccc(C[C@@H](C)C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000179328707 1429330631 /nfs/dbraw/zinc/33/06/31/1429330631.db2.gz MHOJUXRDICEXNO-MRXNPFEDSA-N 0 0 383.448 3.131 20 5 GGBDRN C[C@@H](NC(=O)NC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000179329784 1429330875 /nfs/dbraw/zinc/33/08/75/1429330875.db2.gz BNIZTHKZLPHDKO-QLJPJBMISA-N 0 0 381.791 3.481 20 5 GGBDRN COc1ccc(C[C@H](C)C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000179331429 1429331000 /nfs/dbraw/zinc/33/10/00/1429331000.db2.gz ZGSCVFMCJFEZQG-INIZCTEOSA-N 0 0 383.448 3.131 20 5 GGBDRN O=C(c1cnc2ccc(F)cc2c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000179331359 1429331290 /nfs/dbraw/zinc/33/12/90/1429331290.db2.gz LSLFCBHBGVTMNA-UHFFFAOYSA-N 0 0 380.379 3.245 20 5 GGBDRN CSc1ccc(C(=O)N2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000179334944 1429332449 /nfs/dbraw/zinc/33/24/49/1429332449.db2.gz HKXSWQCMXPCAIH-CYBMUJFWSA-N 0 0 387.465 3.332 20 5 GGBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179336972 1429333895 /nfs/dbraw/zinc/33/38/95/1429333895.db2.gz FWDXJFSWTGYOLT-CYBMUJFWSA-N 0 0 387.465 3.089 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000179343575 1429336233 /nfs/dbraw/zinc/33/62/33/1429336233.db2.gz PYNBMIGQJLFKEF-LBPRGKRZSA-N 0 0 383.832 3.330 20 5 GGBDRN CCN(C[C@H]1COc2ccccc2O1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179355710 1429341085 /nfs/dbraw/zinc/34/10/85/1429341085.db2.gz AQUXXTXCAACAFH-INIZCTEOSA-N 0 0 395.415 3.307 20 5 GGBDRN C[C@H](NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccc(F)c1F ZINC000179348640 1429338215 /nfs/dbraw/zinc/33/82/15/1429338215.db2.gz OYXOBEBYNHXSPF-ZDUSSCGKSA-N 0 0 390.390 3.466 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(F)c(NS(C)(=O)=O)c1 ZINC000179360402 1429343475 /nfs/dbraw/zinc/34/34/75/1429343475.db2.gz RXTXZNPVSFVFLG-UHFFFAOYSA-N 0 0 395.412 3.283 20 5 GGBDRN O=C(Nc1ccc(C(F)(F)F)nc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000179361423 1429343787 /nfs/dbraw/zinc/34/37/87/1429343787.db2.gz RSVCMGDLNBBFSB-UHFFFAOYSA-N 0 0 395.341 3.363 20 5 GGBDRN CC(C)(CNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000179362740 1429344869 /nfs/dbraw/zinc/34/48/69/1429344869.db2.gz XLIRQRFCCWUENC-UHFFFAOYSA-N 0 0 382.482 3.335 20 5 GGBDRN O=C(c1ccnc(OCC(F)F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000179365706 1429345905 /nfs/dbraw/zinc/34/59/05/1429345905.db2.gz GQPMYLFXRCJYBP-UHFFFAOYSA-N 0 0 377.347 3.439 20 5 GGBDRN COc1cc(CCNC(=O)/C=C/c2ccc(Cl)nc2)c([N+](=O)[O-])cc1OC ZINC000179378461 1429350236 /nfs/dbraw/zinc/35/02/36/1429350236.db2.gz RANIJTJEIWQJQN-GQCTYLIASA-N 0 0 391.811 3.033 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cccc(NS(C)(=O)=O)c1 ZINC000179382573 1429352191 /nfs/dbraw/zinc/35/21/91/1429352191.db2.gz ZLXDKSXHVDPANK-UHFFFAOYSA-N 0 0 377.422 3.144 20 5 GGBDRN CCOc1cc(/C=C/C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1O ZINC000179388432 1429353860 /nfs/dbraw/zinc/35/38/60/1429353860.db2.gz BUAXTDWYUNXRNY-CSKARUKUSA-N 0 0 397.431 3.061 20 5 GGBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc2c(c1)CCC(=O)N2C ZINC000179393243 1429356681 /nfs/dbraw/zinc/35/66/81/1429356681.db2.gz HEHZXXFHTZHBAN-UHFFFAOYSA-N 0 0 387.823 3.429 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCCc1nc2ccccc2[nH]1 ZINC000179395219 1429357355 /nfs/dbraw/zinc/35/73/55/1429357355.db2.gz MLUZJUJNHHIFDB-UHFFFAOYSA-N 0 0 377.404 3.244 20 5 GGBDRN O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000179394384 1429357516 /nfs/dbraw/zinc/35/75/16/1429357516.db2.gz SIHXVGOBUYMXMW-AWEZNQCLSA-N 0 0 387.823 3.027 20 5 GGBDRN COc1cc(CCNC(=O)NC2(C)Cc3ccccc3C2)c([N+](=O)[O-])cc1OC ZINC000179403746 1429361341 /nfs/dbraw/zinc/36/13/41/1429361341.db2.gz BJDMBAPLFYTAQO-UHFFFAOYSA-N 0 0 399.447 3.011 20 5 GGBDRN COc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1Cl ZINC000179406711 1429362561 /nfs/dbraw/zinc/36/25/61/1429362561.db2.gz UBWXTWPOUVMALH-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cccc(S(C)(=O)=O)c1 ZINC000179412313 1429364610 /nfs/dbraw/zinc/36/46/10/1429364610.db2.gz ZNRUTJNMKQUQHM-UHFFFAOYSA-N 0 0 390.442 3.490 20 5 GGBDRN COc1cc(CN2CCO[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1OC ZINC000179427666 1429371401 /nfs/dbraw/zinc/37/14/01/1429371401.db2.gz XQLYEUZTLFNLTJ-IBGZPJMESA-N 0 0 376.384 3.325 20 5 GGBDRN COc1cc(CN2CCO[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1OC ZINC000179427679 1429371672 /nfs/dbraw/zinc/37/16/72/1429371672.db2.gz XQLYEUZTLFNLTJ-LJQANCHMSA-N 0 0 376.384 3.325 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1ccc(Cn2cccn2)cc1 ZINC000179440013 1429377184 /nfs/dbraw/zinc/37/71/84/1429377184.db2.gz AXYJTWPPCWTPPP-UHFFFAOYSA-N 0 0 389.415 3.180 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000179437937 1429375597 /nfs/dbraw/zinc/37/55/97/1429375597.db2.gz PVOBQYDVSKLBAC-IBGZPJMESA-N 0 0 383.379 3.358 20 5 GGBDRN C[C@H]1CCc2ccccc2[C@H]1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000179446668 1429379703 /nfs/dbraw/zinc/37/97/03/1429379703.db2.gz YGAFGHRYRFBWCG-BUXKBTBVSA-N 0 0 399.472 3.226 20 5 GGBDRN CCc1nc2ccccc2n1C1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1 ZINC000179469152 1429385384 /nfs/dbraw/zinc/38/53/84/1429385384.db2.gz IQHWFYYKHPTOFN-UHFFFAOYSA-N 0 0 396.451 3.026 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1[O-])N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000179470869 1429386375 /nfs/dbraw/zinc/38/63/75/1429386375.db2.gz LYQDDGRYGMJQTJ-UHFFFAOYSA-N 0 0 383.448 3.081 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)CCC2 ZINC000179474399 1429388029 /nfs/dbraw/zinc/38/80/29/1429388029.db2.gz LSRMNKKATVMARB-GOSISDBHSA-N 0 0 388.445 3.114 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000179484158 1429389740 /nfs/dbraw/zinc/38/97/40/1429389740.db2.gz QOKVUWZNTOFQBK-UHFFFAOYSA-N 0 0 384.358 3.172 20 5 GGBDRN Cc1nc(COc2cccc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])c2)no1 ZINC000179493583 1429393440 /nfs/dbraw/zinc/39/34/40/1429393440.db2.gz WYUMRGGWIOBPCP-UHFFFAOYSA-N 0 0 382.376 3.137 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)Nc1ccc(COc2ccccc2)cc1 ZINC000179499048 1429396585 /nfs/dbraw/zinc/39/65/85/1429396585.db2.gz FARUAGZOWBYUNK-UHFFFAOYSA-N 0 0 381.392 3.192 20 5 GGBDRN CN(CCCOc1ccc(F)cc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179499536 1429396819 /nfs/dbraw/zinc/39/68/19/1429396819.db2.gz LUEFEIQXKHPWIZ-UHFFFAOYSA-N 0 0 398.394 3.461 20 5 GGBDRN C[NH+](C)CC1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3[O-])cc2)CC1 ZINC000179510314 1429402165 /nfs/dbraw/zinc/40/21/65/1429402165.db2.gz CBDKXMPRXLVQJK-UHFFFAOYSA-N 0 0 398.463 3.331 20 5 GGBDRN CCOC(=O)CC[C@H]1CCCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000179510859 1429402582 /nfs/dbraw/zinc/40/25/82/1429402582.db2.gz ZPTSNSLLJRGQDD-CQSZACIVSA-N 0 0 387.436 3.201 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCC1([C@H](O)c2ccccc2)CC1 ZINC000179519656 1429407126 /nfs/dbraw/zinc/40/71/26/1429407126.db2.gz JHPMWQOXGWSDFV-HXUWFJFHSA-N 0 0 379.416 3.249 20 5 GGBDRN CN(C[C@@H]1COc2ccccc2O1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179543044 1429419554 /nfs/dbraw/zinc/41/95/54/1429419554.db2.gz YZEYYCCNSDECCO-CYBMUJFWSA-N 0 0 379.372 3.055 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000179543817 1429420833 /nfs/dbraw/zinc/42/08/33/1429420833.db2.gz NAEIRTTVGHQPNJ-QFIPXVFZSA-N 0 0 391.427 3.319 20 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COCCn1nc(C)c(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000179575242 1429445441 /nfs/dbraw/zinc/44/54/41/1429445441.db2.gz XJPHOPQYYZPYOT-UHFFFAOYSA-N 0 0 389.456 3.497 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)c2noc(-c3ccc(Cl)cc3)n2)c1[N+](=O)[O-] ZINC000179575597 1429445682 /nfs/dbraw/zinc/44/56/82/1429445682.db2.gz CUFBDYGFPYNPOT-MRVPVSSYSA-N 0 0 390.787 3.075 20 5 GGBDRN NC(=O)[C@@H]1CCCN1Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000179581167 1429450800 /nfs/dbraw/zinc/45/08/00/1429450800.db2.gz ABZUOVNWHQEHJK-HNNXBMFYSA-N 0 0 375.812 3.490 20 5 GGBDRN COCCn1nc(C)c(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000179584744 1429453124 /nfs/dbraw/zinc/45/31/24/1429453124.db2.gz WZMZXVGZRGTWSS-UHFFFAOYSA-N 0 0 387.440 3.251 20 5 GGBDRN CCc1nn(C)c(N2CCC([C@@H](C)NC(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000179589235 1429456614 /nfs/dbraw/zinc/45/66/14/1429456614.db2.gz DAKVFEIMKLMCID-GFCCVEGCSA-N 0 0 381.477 3.020 20 5 GGBDRN Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(-n3cncn3)c([N+](=O)[O-])c1)CCC2 ZINC000179594173 1429459469 /nfs/dbraw/zinc/45/94/69/1429459469.db2.gz ZWINUAMJVXDYEE-KRWDZBQOSA-N 0 0 377.404 3.291 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(=O)NCc1ccccc1 ZINC000179600534 1429464877 /nfs/dbraw/zinc/46/48/77/1429464877.db2.gz HPFAIDLIVZEDBS-CYBMUJFWSA-N 0 0 387.461 3.142 20 5 GGBDRN Cc1nnc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1C1CC1 ZINC000179608365 1429468449 /nfs/dbraw/zinc/46/84/49/1429468449.db2.gz RVSWTRWMFWFBHT-UHFFFAOYSA-N 0 0 385.405 3.310 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl ZINC000179624556 1429475887 /nfs/dbraw/zinc/47/58/87/1429475887.db2.gz LDKCMPXLHHJPBW-UHFFFAOYSA-N 0 0 395.206 3.132 20 5 GGBDRN O=C(N[C@@H](Cc1ccccc1)C1CC1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179645296 1429486891 /nfs/dbraw/zinc/48/68/91/1429486891.db2.gz IQGPQKFTMJNSDZ-IBGZPJMESA-N 0 0 395.459 3.183 20 5 GGBDRN O=C(N[C@H](Cc1ccccc1)C1CC1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179645308 1429486898 /nfs/dbraw/zinc/48/68/98/1429486898.db2.gz IQGPQKFTMJNSDZ-LJQANCHMSA-N 0 0 395.459 3.183 20 5 GGBDRN O=C(c1cn(-c2cccc(Cl)c2F)nn1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000179647241 1429488455 /nfs/dbraw/zinc/48/84/55/1429488455.db2.gz NUYSZTWFKHPQQX-UHFFFAOYSA-N 0 0 387.758 3.171 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(Cc2ccc(CO)o2)CC1 ZINC000179654991 1429491980 /nfs/dbraw/zinc/49/19/80/1429491980.db2.gz YEOIRHNDRLJJFY-UHFFFAOYSA-N 0 0 385.342 3.021 20 5 GGBDRN CC(C)N(CC(N)=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000179660579 1429495648 /nfs/dbraw/zinc/49/56/48/1429495648.db2.gz REXYPCJJCVRWHO-UHFFFAOYSA-N 0 0 393.447 3.143 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N(Cc1ccccc1)C1CC1 ZINC000179667086 1429498251 /nfs/dbraw/zinc/49/82/51/1429498251.db2.gz MKPWJWKBCDNDAE-UHFFFAOYSA-N 0 0 381.432 3.236 20 5 GGBDRN O=C(Nc1nncn1-c1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000179672336 1429500704 /nfs/dbraw/zinc/50/07/04/1429500704.db2.gz ZCYYKXIGQYNBMC-UHFFFAOYSA-N 0 0 392.419 3.031 20 5 GGBDRN COC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000179681466 1429504709 /nfs/dbraw/zinc/50/47/09/1429504709.db2.gz GQNWDUHAAIPZDJ-UHFFFAOYSA-N 0 0 391.811 3.105 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000179684796 1429506311 /nfs/dbraw/zinc/50/63/11/1429506311.db2.gz UTIPENZPWWDBKL-UHFFFAOYSA-N 0 0 391.431 3.435 20 5 GGBDRN CSc1ccccc1N(C)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000179708261 1429516193 /nfs/dbraw/zinc/51/61/93/1429516193.db2.gz UUYHLWJYXFERPC-UHFFFAOYSA-N 0 0 387.461 3.430 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000179725774 1429524098 /nfs/dbraw/zinc/52/40/98/1429524098.db2.gz GBOUGOOSZOEKBC-OAHLLOKOSA-N 0 0 385.203 3.260 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000179725787 1429524275 /nfs/dbraw/zinc/52/42/75/1429524275.db2.gz GBOUGOOSZOEKBC-HNNXBMFYSA-N 0 0 385.203 3.260 20 5 GGBDRN CCS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000152301196 1422067170 /nfs/dbraw/zinc/06/71/70/1422067170.db2.gz ZLXZIIBKNDWONI-UHFFFAOYSA-N 0 0 388.445 3.193 20 5 GGBDRN O=C(CNc1cccc([N+](=O)[O-])c1)NCc1cccc(OCC(F)(F)F)c1 ZINC000152300635 1422067328 /nfs/dbraw/zinc/06/73/28/1422067328.db2.gz NHIMIAIAGYBDPR-UHFFFAOYSA-N 0 0 383.326 3.264 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000152311969 1422070054 /nfs/dbraw/zinc/07/00/54/1422070054.db2.gz FFZAJJUXEJNNMO-ZDUSSCGKSA-N 0 0 377.803 3.325 20 5 GGBDRN Cc1nn(CN2CCO[C@H](c3cccc(OC(F)F)c3)C2)c(C)c1[N+](=O)[O-] ZINC000152321231 1422071594 /nfs/dbraw/zinc/07/15/94/1422071594.db2.gz ZRKOKYNJKBPHOF-HNNXBMFYSA-N 0 0 382.367 3.041 20 5 GGBDRN Cn1ccnc1C[C@H]1CCCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000152333013 1422075096 /nfs/dbraw/zinc/07/50/96/1422075096.db2.gz BSZWBMRAQSFJKO-GFCCVEGCSA-N 0 0 377.832 3.468 20 5 GGBDRN CC[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C ZINC000179729433 1429526456 /nfs/dbraw/zinc/52/64/56/1429526456.db2.gz JLYDPUDJSBEKPR-QGZVFWFLSA-N 0 0 389.427 3.442 20 5 GGBDRN O=C(Nc1ccc(F)cc1)C1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000152344236 1422078642 /nfs/dbraw/zinc/07/86/42/1422078642.db2.gz FMZNFRKQMBEOTL-UHFFFAOYSA-N 0 0 397.410 3.392 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 ZINC000179730622 1429526508 /nfs/dbraw/zinc/52/65/08/1429526508.db2.gz XULXMDCZSBEWAA-GFCCVEGCSA-N 0 0 391.786 3.057 20 5 GGBDRN Cn1c(COc2ccccc2)nnc1Sc1nc2sccn2c1[N+](=O)[O-] ZINC000152348976 1422080729 /nfs/dbraw/zinc/08/07/29/1422080729.db2.gz SIQJKXXMMDRJAF-UHFFFAOYSA-N 0 0 388.434 3.163 20 5 GGBDRN C[C@@H](CC(=O)c1cccs1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000152352756 1422081262 /nfs/dbraw/zinc/08/12/62/1422081262.db2.gz AKBIPXQOBWTVRN-VIFPVBQESA-N 0 0 388.854 3.250 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)OCCCc1ccncc1 ZINC000152360139 1422083162 /nfs/dbraw/zinc/08/31/62/1422083162.db2.gz CSEFVNAYRPVZOU-UHFFFAOYSA-N 0 0 379.210 3.471 20 5 GGBDRN CCNC(=O)c1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000152364747 1422083905 /nfs/dbraw/zinc/08/39/05/1422083905.db2.gz QWTXMQMCWVGSLY-UHFFFAOYSA-N 0 0 393.193 3.326 20 5 GGBDRN CC[C@@H](CCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000152368905 1422085179 /nfs/dbraw/zinc/08/51/79/1422085179.db2.gz UJKUUBQSSGFGRA-AWEZNQCLSA-N 0 0 393.465 3.216 20 5 GGBDRN O=C(c1ccc2c(c1)NC(=O)CS2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152368324 1422085202 /nfs/dbraw/zinc/08/52/02/1422085202.db2.gz ROSXYMNSAXJOGI-UHFFFAOYSA-N 0 0 383.429 3.444 20 5 GGBDRN O=C(c1cccc([N+](=O)[O-])c1N1CCOCC1)N1CCc2c1cccc2Cl ZINC000179731052 1429527143 /nfs/dbraw/zinc/52/71/43/1429527143.db2.gz XBMUWZUNDAQEKA-UHFFFAOYSA-N 0 0 387.823 3.288 20 5 GGBDRN CC[C@@]1(c2ccc(C)cc2)CC(=O)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O ZINC000152410231 1422095624 /nfs/dbraw/zinc/09/56/24/1422095624.db2.gz SNNGRDVDLJFZPL-RXVVDRJESA-N 0 0 382.416 3.044 20 5 GGBDRN CC[C@]1(c2ccc(C)cc2)CC(=O)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O ZINC000152410165 1422095793 /nfs/dbraw/zinc/09/57/93/1422095793.db2.gz SNNGRDVDLJFZPL-GHTZIAJQSA-N 0 0 382.416 3.044 20 5 GGBDRN C[C@@H](Cc1ccc(O)cc1)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000152431491 1422101745 /nfs/dbraw/zinc/10/17/45/1422101745.db2.gz JMYKGWJXCSSPCW-HNNXBMFYSA-N 0 0 383.448 3.264 20 5 GGBDRN COc1cc(C(=O)NC[C@H](C)c2c(C)noc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000152449582 1422106423 /nfs/dbraw/zinc/10/64/23/1422106423.db2.gz YSKCPTPHKJDAPR-QMMMGPOBSA-N 0 0 399.350 3.343 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(-c2nnnn2C2CC2)c1 ZINC000152485374 1422116188 /nfs/dbraw/zinc/11/61/88/1422116188.db2.gz TXUTZFNFABEGCG-UHFFFAOYSA-N 0 0 378.392 3.155 20 5 GGBDRN C[C@@H](CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1F ZINC000152491522 1422118501 /nfs/dbraw/zinc/11/85/01/1422118501.db2.gz LSZANAXQPCUJBO-GXTWGEPZSA-N 0 0 390.390 3.475 20 5 GGBDRN Cc1csc(CCCCNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])n1 ZINC000152496292 1422121462 /nfs/dbraw/zinc/12/14/62/1422121462.db2.gz PLMUONQDBIAJHT-UHFFFAOYSA-N 0 0 398.510 3.045 20 5 GGBDRN C[C@@H](Cc1ccc(O)cc1)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000152506724 1422124059 /nfs/dbraw/zinc/12/40/59/1422124059.db2.gz FQBMPYYRCDVJKF-LBPRGKRZSA-N 0 0 378.812 3.470 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N(Cc1ccncc1)Cc1cccnc1 ZINC000152519784 1422128986 /nfs/dbraw/zinc/12/89/86/1422128986.db2.gz CWXGXDZWQFNECS-UHFFFAOYSA-N 0 0 380.379 3.295 20 5 GGBDRN COCCOc1ccc(CNC(=O)CNc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000152519346 1422129230 /nfs/dbraw/zinc/12/92/30/1422129230.db2.gz KBAHLGLTWXZNIC-UHFFFAOYSA-N 0 0 393.827 3.002 20 5 GGBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccccc1N(C)C ZINC000152527887 1422132513 /nfs/dbraw/zinc/13/25/13/1422132513.db2.gz IRFZBJOOPUOMDS-UHFFFAOYSA-N 0 0 383.857 3.448 20 5 GGBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)c2ccccc2N(C)C)cc1[N+](=O)[O-] ZINC000152536036 1422134564 /nfs/dbraw/zinc/13/45/64/1422134564.db2.gz QOSBSPPDRVDKHN-UHFFFAOYSA-N 0 0 383.857 3.448 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])nc2ccccc21 ZINC000152535791 1422134580 /nfs/dbraw/zinc/13/45/80/1422134580.db2.gz VFEZCZATVLDBLY-UHFFFAOYSA-N 0 0 378.388 3.074 20 5 GGBDRN CCNC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)nc2ccccc21 ZINC000152551916 1422140603 /nfs/dbraw/zinc/14/06/03/1422140603.db2.gz CKQPZFUWGRNFGR-UHFFFAOYSA-N 0 0 382.351 3.284 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2cccc3[nH]ccc32)c2ncccc12 ZINC000152553254 1422141623 /nfs/dbraw/zinc/14/16/23/1422141623.db2.gz QRQPLLQUMMQKAO-ZDUSSCGKSA-N 0 0 379.372 3.443 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2ccccc2NC1=O ZINC000152571531 1422147894 /nfs/dbraw/zinc/14/78/94/1422147894.db2.gz LMBSUGWSRYJQCZ-ZDUSSCGKSA-N 0 0 391.387 3.016 20 5 GGBDRN Cc1c([N-]S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2F)cnn1-c1ccccc1 ZINC000152576535 1422149666 /nfs/dbraw/zinc/14/96/66/1422149666.db2.gz HYVJHKSMOAWEPH-UHFFFAOYSA-N 0 0 390.396 3.337 20 5 GGBDRN Cc1ccc(C(=O)N2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)cc1[N+](=O)[O-] ZINC000152577735 1422150291 /nfs/dbraw/zinc/15/02/91/1422150291.db2.gz SNLSJNWMENBTAW-FQEVSTJZSA-N 0 0 389.452 3.376 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCOC[C@@H]1C[C@@H](O)c1cccs1 ZINC000152581224 1422151877 /nfs/dbraw/zinc/15/18/77/1422151877.db2.gz IEBHHTJNCSRZBY-SWLSCSKDSA-N 0 0 396.852 3.274 20 5 GGBDRN C[C@@]1(O)CCCN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)C1 ZINC000152599468 1422157360 /nfs/dbraw/zinc/15/73/60/1422157360.db2.gz ZTTHFKXAYXCLRE-MRXNPFEDSA-N 0 0 399.234 3.074 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(NCc2nc(C(C)(C)C)cs2)c([N+](=O)[O-])c1 ZINC000152606669 1422160736 /nfs/dbraw/zinc/16/07/36/1422160736.db2.gz DNTNAEUMZDZNGQ-UHFFFAOYSA-N 0 0 398.510 3.211 20 5 GGBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1nccn1CCCc1ccccc1 ZINC000152607767 1422162179 /nfs/dbraw/zinc/16/21/79/1422162179.db2.gz OALRPNKCQTUFEL-UHFFFAOYSA-N 0 0 393.447 3.396 20 5 GGBDRN CCOCCOc1cc(C)ccc1CNc1ccc([N+](=O)[O-])cc1C(=O)NC ZINC000152608658 1422162827 /nfs/dbraw/zinc/16/28/27/1422162827.db2.gz QFMGYHKWUWICEB-UHFFFAOYSA-N 0 0 387.436 3.290 20 5 GGBDRN CCOCCOc1cc(C)ccc1CNc1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000152610818 1422164043 /nfs/dbraw/zinc/16/40/43/1422164043.db2.gz XLLNVYBHYFFCAK-UHFFFAOYSA-N 0 0 387.436 3.290 20 5 GGBDRN O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152610920 1422164138 /nfs/dbraw/zinc/16/41/38/1422164138.db2.gz CYBSTZDQTOAWRD-HNNXBMFYSA-N 0 0 395.868 3.113 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)Cn1c(=O)oc3cc([N+](=O)[O-])ccc31)CCC2 ZINC000179747414 1429535151 /nfs/dbraw/zinc/53/51/51/1429535151.db2.gz AJWRBQPTLLUIQP-MRXNPFEDSA-N 0 0 381.388 3.005 20 5 GGBDRN CCCOc1cc(F)ccc1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000152628570 1422176314 /nfs/dbraw/zinc/17/63/14/1422176314.db2.gz XXQJRFLHGVRUDV-UHFFFAOYSA-N 0 0 389.339 3.069 20 5 GGBDRN CC1(C)CN(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)C[C@H]1c1ccccc1 ZINC000152688911 1422210547 /nfs/dbraw/zinc/21/05/47/1422210547.db2.gz ALYUDZCXRDNYHX-INIZCTEOSA-N 0 0 395.415 3.155 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152705919 1422216843 /nfs/dbraw/zinc/21/68/43/1422216843.db2.gz HZRKHBHRZUHNIS-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN C[C@@H](NC(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1cccc(F)c1F ZINC000152735711 1422230057 /nfs/dbraw/zinc/23/00/57/1422230057.db2.gz RAZKSXZKQXAQTC-SNVBAGLBSA-N 0 0 378.331 3.064 20 5 GGBDRN COc1ccccc1[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000152735533 1422230199 /nfs/dbraw/zinc/23/01/99/1422230199.db2.gz KOBHQQGTXHLZKM-SFHVURJKSA-N 0 0 388.401 3.264 20 5 GGBDRN CC(=O)N[C@@H](C(=O)OCc1ccc([N+](=O)[O-])cc1Br)C1CCCC1 ZINC000152782708 1422246774 /nfs/dbraw/zinc/24/67/74/1422246774.db2.gz WNMGPIPSYAQPKN-OAHLLOKOSA-N 0 0 399.241 3.095 20 5 GGBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H](C)N1CCOCC1 ZINC000152785310 1422247851 /nfs/dbraw/zinc/24/78/51/1422247851.db2.gz RWGUHYGLJOHENR-HUUCEWRRSA-N 0 0 395.525 3.182 20 5 GGBDRN COc1ccccc1OCC(=O)OCc1ccc([N+](=O)[O-])cc1Br ZINC000152805395 1422255323 /nfs/dbraw/zinc/25/53/23/1422255323.db2.gz RUKNWFQHNMIJLN-UHFFFAOYSA-N 0 0 396.193 3.488 20 5 GGBDRN CC(=O)N1CCC(CNC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)CC1 ZINC000152805303 1422255695 /nfs/dbraw/zinc/25/56/95/1422255695.db2.gz HUEHLAAMYXFTER-UHFFFAOYSA-N 0 0 393.509 3.331 20 5 GGBDRN O=C(Nc1nccc2sccc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000152820849 1422261664 /nfs/dbraw/zinc/26/16/64/1422261664.db2.gz WEYQINSZPUZSSZ-UHFFFAOYSA-N 0 0 384.417 3.293 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1nc(Cc2ccccc2)cs1 ZINC000152828144 1422263099 /nfs/dbraw/zinc/26/30/99/1422263099.db2.gz DUHPNSOMVMOJRQ-UHFFFAOYSA-N 0 0 396.428 3.011 20 5 GGBDRN CCc1cc(N2CCCN(C(=O)C3CC3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000152830003 1422264973 /nfs/dbraw/zinc/26/49/73/1422264973.db2.gz IXDOPZBEBJJXFG-UHFFFAOYSA-N 0 0 395.463 3.063 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000179757680 1429543326 /nfs/dbraw/zinc/54/33/26/1429543326.db2.gz BTZFWOAZKVOIPB-IFXJQAMLSA-N 0 0 381.432 3.215 20 5 GGBDRN CCc1nn(C)c(CC)c1CNC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000152857960 1422273450 /nfs/dbraw/zinc/27/34/50/1422273450.db2.gz AYGUZABVSBQTNS-UHFFFAOYSA-N 0 0 395.257 3.146 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@H]1CCN(c2ccccc2)C1 ZINC000152864362 1422275955 /nfs/dbraw/zinc/27/59/55/1422275955.db2.gz DDFROZBCYRSCQW-OAHLLOKOSA-N 0 0 378.432 3.261 20 5 GGBDRN C[C@](CO)(NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000152916256 1422295337 /nfs/dbraw/zinc/29/53/37/1422295337.db2.gz APKQQMDMEDNKTD-HXUWFJFHSA-N 0 0 375.469 3.256 20 5 GGBDRN O=[N+]([O-])c1ccc(F)cc1OC[C@@H](O)COc1ccc(Br)cc1 ZINC000152922165 1422296617 /nfs/dbraw/zinc/29/66/17/1422296617.db2.gz KJDDJLQLEHYSSN-LBPRGKRZSA-N 0 0 386.173 3.315 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cccc(S(=O)(=O)NC(C)C)c1 ZINC000152936032 1422300878 /nfs/dbraw/zinc/30/08/78/1422300878.db2.gz KNJDGHDSWVVQLT-UHFFFAOYSA-N 0 0 391.449 3.151 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)COc1ccc(N2CCCC2=O)cc1 ZINC000152934667 1422300944 /nfs/dbraw/zinc/30/09/44/1422300944.db2.gz VBYLBRAYXFSKHC-UHFFFAOYSA-N 0 0 383.404 3.356 20 5 GGBDRN Cc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)CC2)cc1C ZINC000152953975 1422306422 /nfs/dbraw/zinc/30/64/22/1422306422.db2.gz FUPWCSYPPIUYBQ-UHFFFAOYSA-N 0 0 384.392 3.082 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCN1c2ccccc2O[C@@H](C)C1=O ZINC000152962985 1422309445 /nfs/dbraw/zinc/30/94/45/1422309445.db2.gz UGGLKAQLYSQAGL-AWEZNQCLSA-N 0 0 383.404 3.354 20 5 GGBDRN CCc1nc2c(s1)[C@@H](N(C)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])CCC2 ZINC000152982027 1422315685 /nfs/dbraw/zinc/31/56/85/1422315685.db2.gz HCGAGWGCGHJKAA-LBPRGKRZSA-N 0 0 399.469 3.451 20 5 GGBDRN C[C@H]1C[C@H](c2ccccc2)CN1c1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] ZINC000152984776 1422317280 /nfs/dbraw/zinc/31/72/80/1422317280.db2.gz PSIPGNHZIXKYNN-HOCLYGCPSA-N 0 0 389.477 3.228 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(-c2nnnn2C)c1 ZINC000152997940 1422321324 /nfs/dbraw/zinc/32/13/24/1422321324.db2.gz ZCRKWWFUKOLTPV-UHFFFAOYSA-N 0 0 384.421 3.150 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@@H](O)c2ccccc2Br)nc1-c1ccncc1 ZINC000153011080 1422325744 /nfs/dbraw/zinc/32/57/44/1422325744.db2.gz BJOSMVSPZRPFCW-OAHLLOKOSA-N 0 0 389.209 3.349 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2F)CC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000153017039 1422327371 /nfs/dbraw/zinc/32/73/71/1422327371.db2.gz KBFUCPVVMPKFAO-UHFFFAOYSA-N 0 0 377.303 3.243 20 5 GGBDRN CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@H]2c2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000153019853 1422328614 /nfs/dbraw/zinc/32/86/14/1422328614.db2.gz NZGYJHGSIWMHDZ-ABAIWWIYSA-N 0 0 397.403 3.091 20 5 GGBDRN O=C(N[C@@H]1CCN(c2ccccn2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000153025069 1422330538 /nfs/dbraw/zinc/33/05/38/1422330538.db2.gz MFQGMCRPZAJGLD-CQSZACIVSA-N 0 0 395.444 3.122 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000153028451 1422331560 /nfs/dbraw/zinc/33/15/60/1422331560.db2.gz GVQKWBFRNNBTLG-MRXNPFEDSA-N 0 0 392.415 3.419 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000153028553 1422332147 /nfs/dbraw/zinc/33/21/47/1422332147.db2.gz GVQKWBFRNNBTLG-INIZCTEOSA-N 0 0 392.415 3.419 20 5 GGBDRN CC1(C)CCC[C@H](CC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000153036303 1422335145 /nfs/dbraw/zinc/33/51/45/1422335145.db2.gz XDMOSOXWDFYVRV-MRXNPFEDSA-N 0 0 387.480 3.486 20 5 GGBDRN Cc1ccc(-c2nc3ccccc3n2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)s1 ZINC000153039991 1422335382 /nfs/dbraw/zinc/33/53/82/1422335382.db2.gz CSHFJDFNCLITAO-CQSZACIVSA-N 0 0 383.433 3.239 20 5 GGBDRN O=C(N[C@H](CCO)c1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000153039736 1422335611 /nfs/dbraw/zinc/33/56/11/1422335611.db2.gz UCQSKMFKDKBUGI-GOSISDBHSA-N 0 0 383.448 3.051 20 5 GGBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCN(C(=O)OCc2ccccc2)CC1 ZINC000153045370 1422338334 /nfs/dbraw/zinc/33/83/34/1422338334.db2.gz RRLLZFDBEZPNQE-UHFFFAOYSA-N 0 0 397.431 3.008 20 5 GGBDRN Cc1cccc(NC2CCN(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)CC2)c1 ZINC000153069013 1422345636 /nfs/dbraw/zinc/34/56/36/1422345636.db2.gz DYWMOFGWCOHPSG-UHFFFAOYSA-N 0 0 394.475 3.369 20 5 GGBDRN CC(C)[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(C(F)(F)F)cc1 ZINC000153072553 1422346455 /nfs/dbraw/zinc/34/64/55/1422346455.db2.gz KCRZVTRQYMVSQN-QGZVFWFLSA-N 0 0 397.353 3.289 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000153073813 1422347164 /nfs/dbraw/zinc/34/71/64/1422347164.db2.gz AHQYKELYKVMEIH-OAHLLOKOSA-N 0 0 392.415 3.419 20 5 GGBDRN Cc1nc(Cc2ccccc2)sc1[C@H](C)OC(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000153127402 1422365728 /nfs/dbraw/zinc/36/57/28/1422365728.db2.gz NENGXIGMWDGRAO-ZDUSSCGKSA-N 0 0 386.433 3.451 20 5 GGBDRN Cc1cc(C[C@@H](C)NC(=O)COc2ccc([N+](=O)[O-])cc2)n(-c2ccccc2)n1 ZINC000153126761 1422366011 /nfs/dbraw/zinc/36/60/11/1422366011.db2.gz BLOYAMHLNYPVBV-OAHLLOKOSA-N 0 0 394.431 3.215 20 5 GGBDRN Cc1cc(C[C@H](C)NC(=O)COc2ccc([N+](=O)[O-])cc2)n(-c2ccccc2)n1 ZINC000153126868 1422366277 /nfs/dbraw/zinc/36/62/77/1422366277.db2.gz BLOYAMHLNYPVBV-HNNXBMFYSA-N 0 0 394.431 3.215 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)COc2ccc(I)cc2)c1 ZINC000153129048 1422366691 /nfs/dbraw/zinc/36/66/91/1422366691.db2.gz GGWUHFXYGSHRAK-CQSZACIVSA-N 0 0 385.157 3.312 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)nc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000153141651 1422369821 /nfs/dbraw/zinc/36/98/21/1422369821.db2.gz NCNGVATZSMKWLO-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000153141468 1422370258 /nfs/dbraw/zinc/37/02/58/1422370258.db2.gz WBKRWMOJAONDBN-HNNXBMFYSA-N 0 0 392.415 3.419 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)Cc1cc(C)nn1-c1ccccc1 ZINC000153145734 1422371731 /nfs/dbraw/zinc/37/17/31/1422371731.db2.gz LXWHFCPCXAXVBK-AWEZNQCLSA-N 0 0 394.431 3.459 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCc2ccc(Cl)cc2C1 ZINC000153150283 1422372947 /nfs/dbraw/zinc/37/29/47/1422372947.db2.gz WEDOYKXCVFXXMX-UHFFFAOYSA-N 0 0 375.812 3.254 20 5 GGBDRN Cn1c(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)nc2cc(F)ccc21 ZINC000153188357 1422386963 /nfs/dbraw/zinc/38/69/63/1422386963.db2.gz XOVAAQSKEQFRQO-UHFFFAOYSA-N 0 0 393.378 3.141 20 5 GGBDRN O=C(C1CCCCC1)N1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000153191087 1422387410 /nfs/dbraw/zinc/38/74/10/1422387410.db2.gz VJPVNDRIMYWFSS-UHFFFAOYSA-N 0 0 398.463 3.474 20 5 GGBDRN Cc1ccccc1[C@H](CC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)NC(N)=O ZINC000153219718 1422398525 /nfs/dbraw/zinc/39/85/25/1422398525.db2.gz WATQXVDJSNWUJI-IBGZPJMESA-N 0 0 398.463 3.142 20 5 GGBDRN CSC1(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCOCC1 ZINC000153223120 1422399432 /nfs/dbraw/zinc/39/94/32/1422399432.db2.gz WRTFDDXPVBTPOF-UHFFFAOYSA-N 0 0 379.482 3.181 20 5 GGBDRN COc1ccccc1[C@H](C)NC(=O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153229312 1422405440 /nfs/dbraw/zinc/40/54/40/1422405440.db2.gz YTQZHJHUVKPBGT-HNNXBMFYSA-N 0 0 383.448 3.445 20 5 GGBDRN C[C@H]1Oc2c(cccc2C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)NC1=O ZINC000153232520 1422406876 /nfs/dbraw/zinc/40/68/76/1422406876.db2.gz MERRSYVCJZXMPK-CYBMUJFWSA-N 0 0 383.404 3.067 20 5 GGBDRN O=C(Cc1ccc(-n2cccn2)cc1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153233213 1422408318 /nfs/dbraw/zinc/40/83/18/1422408318.db2.gz WUGLQSFSVYPKJT-UHFFFAOYSA-N 0 0 378.432 3.462 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cc(=O)[nH]c2cc(F)ccc21 ZINC000153235936 1422409624 /nfs/dbraw/zinc/40/96/24/1422409624.db2.gz FOOGVIMORMSZRM-UHFFFAOYSA-N 0 0 383.379 3.328 20 5 GGBDRN COCc1cccc(CNC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153237526 1422410603 /nfs/dbraw/zinc/41/06/03/1422410603.db2.gz MFVOPFFJGUDJLZ-UHFFFAOYSA-N 0 0 383.448 3.022 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccco2)[nH]c1=O ZINC000153238417 1422410900 /nfs/dbraw/zinc/41/09/00/1422410900.db2.gz OSYBJQNYQWXOIV-UHFFFAOYSA-N 0 0 381.388 3.296 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C1CCN(CC(F)(F)F)CC1 ZINC000153260774 1422424698 /nfs/dbraw/zinc/42/46/98/1422424698.db2.gz BWDVNFQKBWFLDJ-UHFFFAOYSA-N 0 0 387.402 3.308 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(Cc3ccc(Cl)cc3)C(=O)C2)cc1[N+](=O)[O-] ZINC000153285957 1422440804 /nfs/dbraw/zinc/44/08/04/1422440804.db2.gz NCFASUHGOCVFJQ-UHFFFAOYSA-N 0 0 387.823 3.041 20 5 GGBDRN COCc1ccccc1CNC(=O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153293092 1422446230 /nfs/dbraw/zinc/44/62/30/1422446230.db2.gz UZIIWEOKXLQNTP-UHFFFAOYSA-N 0 0 383.448 3.022 20 5 GGBDRN COc1cccc(S(=O)(=O)CCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153295057 1422447443 /nfs/dbraw/zinc/44/74/43/1422447443.db2.gz NXWHEBOLTGPRMP-UHFFFAOYSA-N 0 0 390.461 3.042 20 5 GGBDRN O=C(C[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000153295517 1422447508 /nfs/dbraw/zinc/44/75/08/1422447508.db2.gz HAOLYHOZKNAXMI-HNNXBMFYSA-N 0 0 388.807 3.362 20 5 GGBDRN COC(=O)CC[C@@H](Cc1ccccc1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000153311628 1422462388 /nfs/dbraw/zinc/46/23/88/1422462388.db2.gz GSEQVRHGMDAJFI-INIZCTEOSA-N 0 0 397.431 3.456 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000153321049 1422467301 /nfs/dbraw/zinc/46/73/01/1422467301.db2.gz JORSENCDGXHEJB-KRWDZBQOSA-N 0 0 392.358 3.339 20 5 GGBDRN Cc1cc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)n(C(C)(C)C)n1 ZINC000153323206 1422468813 /nfs/dbraw/zinc/46/88/13/1422468813.db2.gz QBJBUDGTORJTJA-UHFFFAOYSA-N 0 0 385.468 3.458 20 5 GGBDRN COc1cc(C(=O)Nc2cnn(-c3ccccc3)c2C)c([N+](=O)[O-])cc1OC ZINC000153327459 1422471150 /nfs/dbraw/zinc/47/11/50/1422471150.db2.gz CPBLLZYJLYUPHW-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN Cc1c(C(=O)N2CCc3c(Cl)cccc3C2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000153344671 1422481815 /nfs/dbraw/zinc/48/18/15/1422481815.db2.gz PUFAGVJZGOBRTC-UHFFFAOYSA-N 0 0 397.822 3.336 20 5 GGBDRN COCCCOc1cc(C)ccc1CNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000153373034 1422502362 /nfs/dbraw/zinc/50/23/62/1422502362.db2.gz GGNOULCHSATQAN-UHFFFAOYSA-N 0 0 387.436 3.318 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)c1 ZINC000153386185 1422508260 /nfs/dbraw/zinc/50/82/60/1422508260.db2.gz ZNYMBUXTQVQJAV-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cnn(-c3ccccc3)c2C)cc([N+](=O)[O-])c1 ZINC000153386812 1422508316 /nfs/dbraw/zinc/50/83/16/1422508316.db2.gz FUOBLVQFXYBIGM-UHFFFAOYSA-N 0 0 380.360 3.128 20 5 GGBDRN CCCCc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)n[nH]1 ZINC000153391637 1422510468 /nfs/dbraw/zinc/51/04/68/1422510468.db2.gz JLQXIMUCZRTAPR-QGZVFWFLSA-N 0 0 399.451 3.212 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@H]2Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000153396948 1422513885 /nfs/dbraw/zinc/51/38/85/1422513885.db2.gz VONPBSPMSYIIIV-MRXNPFEDSA-N 0 0 398.467 3.493 20 5 GGBDRN CCC(=O)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC000153399432 1422514958 /nfs/dbraw/zinc/51/49/58/1422514958.db2.gz YVKCVPJQLCKWIJ-AWEZNQCLSA-N 0 0 383.404 3.128 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 ZINC000153400597 1422515871 /nfs/dbraw/zinc/51/58/71/1422515871.db2.gz NTRBZQDVTFEORE-INIZCTEOSA-N 0 0 378.331 3.410 20 5 GGBDRN COc1cc(OCC(=O)Nc2cnn(-c3ccccc3)c2C)ccc1[N+](=O)[O-] ZINC000153405000 1422518254 /nfs/dbraw/zinc/51/82/54/1422518254.db2.gz IQVPFAWNNSWODO-UHFFFAOYSA-N 0 0 382.376 3.115 20 5 GGBDRN CC(C)c1nc2n(n1)CCC[C@@H]2Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000153413459 1422521885 /nfs/dbraw/zinc/52/18/85/1422521885.db2.gz NJUYULGXPDHFHL-HNNXBMFYSA-N 0 0 384.440 3.149 20 5 GGBDRN CCOC(=O)c1cc(NCc2cccnc2OCC(F)F)ccc1[N+](=O)[O-] ZINC000153411921 1422522004 /nfs/dbraw/zinc/52/20/04/1422522004.db2.gz DGIUEWZRMQUWBN-UHFFFAOYSA-N 0 0 381.335 3.423 20 5 GGBDRN CCOCCCNC(=O)C1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153426117 1422528344 /nfs/dbraw/zinc/52/83/44/1422528344.db2.gz BUAGRLKNWXVJHH-UHFFFAOYSA-N 0 0 383.876 3.003 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000153428987 1422531008 /nfs/dbraw/zinc/53/10/08/1422531008.db2.gz WWZJNZDOBBGWEY-YXMGTMDOSA-N 0 0 380.322 3.477 20 5 GGBDRN C[C@]1(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCCS1 ZINC000153431406 1422531872 /nfs/dbraw/zinc/53/18/72/1422531872.db2.gz WUEGVFSNNZJBKN-GOSISDBHSA-N 0 0 379.482 3.433 20 5 GGBDRN CC(C)NC(=O)c1ccc(N[C@@H]2CCCn3nc(C(C)C)nc32)c([N+](=O)[O-])c1 ZINC000153435634 1422535603 /nfs/dbraw/zinc/53/56/03/1422535603.db2.gz GILGKZKOKOWZPW-OAHLLOKOSA-N 0 0 386.456 3.395 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000153452133 1422543570 /nfs/dbraw/zinc/54/35/70/1422543570.db2.gz RDKGUCLWPJHUJL-OAHLLOKOSA-N 0 0 386.452 3.378 20 5 GGBDRN C[C@@H]1[C@H](c2ccccc2)CCN1c1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] ZINC000153465519 1422552842 /nfs/dbraw/zinc/55/28/42/1422552842.db2.gz WFBYSLQHIVBYJL-RHSMWYFYSA-N 0 0 389.477 3.228 20 5 GGBDRN O=C(c1ccc(F)cc1)[C@H]1CCCN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000153479245 1422560656 /nfs/dbraw/zinc/56/06/56/1422560656.db2.gz UHNLJOXWAVPBCY-AWEZNQCLSA-N 0 0 399.378 3.194 20 5 GGBDRN Cc1cccc(NC2CCN(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000153494895 1422569311 /nfs/dbraw/zinc/56/93/11/1422569311.db2.gz BARMAHSORDKAMB-UHFFFAOYSA-N 0 0 389.477 3.477 20 5 GGBDRN COC(=O)[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1C)c1ccc(Cl)c(F)c1 ZINC000153504301 1422574085 /nfs/dbraw/zinc/57/40/85/1422574085.db2.gz PKXXKQANNCKBTG-QGZVFWFLSA-N 0 0 394.786 3.269 20 5 GGBDRN CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000153512543 1422578892 /nfs/dbraw/zinc/57/88/92/1422578892.db2.gz HCQWMIXTZLEVTP-UHFFFAOYSA-N 0 0 391.815 3.067 20 5 GGBDRN CCO[C@H]1C[C@@H](O)C12CCN(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC000153515783 1422579985 /nfs/dbraw/zinc/57/99/85/1422579985.db2.gz CDYDWRKUWYTRTK-CABCVRRESA-N 0 0 383.832 3.032 20 5 GGBDRN Cc1csc(CCCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000153546601 1422602626 /nfs/dbraw/zinc/60/26/26/1422602626.db2.gz MRIHZPKXBIISCP-UHFFFAOYSA-N 0 0 384.255 3.485 20 5 GGBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000153553007 1422608853 /nfs/dbraw/zinc/60/88/53/1422608853.db2.gz BIAQSLHNMXPQHK-CYBMUJFWSA-N 0 0 391.449 3.196 20 5 GGBDRN CCc1ccc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000153559910 1422616706 /nfs/dbraw/zinc/61/67/06/1422616706.db2.gz HZQOVHTXGCODDJ-SFHVURJKSA-N 0 0 382.416 3.271 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1C)c1ccc(Cl)c(F)c1 ZINC000153567161 1422622846 /nfs/dbraw/zinc/62/28/46/1422622846.db2.gz AWVZBCHEKPCISJ-OAHLLOKOSA-N 0 0 380.759 3.340 20 5 GGBDRN Cc1cccc([C@@H](O)CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000153578019 1422629699 /nfs/dbraw/zinc/62/96/99/1422629699.db2.gz RBYDNEULHVIYNA-INIZCTEOSA-N 0 0 393.237 3.058 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@@]2(CCOC2)C1 ZINC000153584190 1422632891 /nfs/dbraw/zinc/63/28/91/1422632891.db2.gz JPVUSESYKFGNNW-MRXNPFEDSA-N 0 0 387.358 3.055 20 5 GGBDRN O=C(NC1CC1)c1cccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000153586699 1422633377 /nfs/dbraw/zinc/63/33/77/1422633377.db2.gz AIKRYIIHGNQVLY-UHFFFAOYSA-N 0 0 376.372 3.288 20 5 GGBDRN O=C(Nc1ccc(-n2nccn2)cc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000153594297 1422638394 /nfs/dbraw/zinc/63/83/94/1422638394.db2.gz QNCKUMOFKLOPAS-UHFFFAOYSA-N 0 0 388.181 3.190 20 5 GGBDRN C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccc(OCC(=O)NC2CC2)cc1 ZINC000153598307 1422639308 /nfs/dbraw/zinc/63/93/08/1422639308.db2.gz NELMIANNJSNKIJ-NSHDSACASA-N 0 0 390.827 3.474 20 5 GGBDRN COc1cc2c(cc1OC)CN(CCNc1ncc(Cl)cc1[N+](=O)[O-])CC2 ZINC000153609664 1422646920 /nfs/dbraw/zinc/64/69/20/1422646920.db2.gz ZSSDVYXKUXBCRX-UHFFFAOYSA-N 0 0 392.843 3.131 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000153614335 1422649311 /nfs/dbraw/zinc/64/93/11/1422649311.db2.gz BJUJBOTVMBHXTL-CABCVRRESA-N 0 0 376.457 3.452 20 5 GGBDRN COC(=O)c1ccc(OC[C@H](O)c2ccccc2Br)c([N+](=O)[O-])c1 ZINC000153641904 1422669600 /nfs/dbraw/zinc/66/96/00/1422669600.db2.gz UCPKLXVJFBVDGF-AWEZNQCLSA-N 0 0 396.193 3.256 20 5 GGBDRN CCOC(=O)c1ccnc(N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1[N+](=O)[O-] ZINC000153643699 1422672770 /nfs/dbraw/zinc/67/27/70/1422672770.db2.gz VLENMOQRORZSAA-UHFFFAOYSA-N 0 0 386.364 3.244 20 5 GGBDRN CCSCc1ccnc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1 ZINC000153651718 1422677276 /nfs/dbraw/zinc/67/72/76/1422677276.db2.gz DYHHVVRZXFXIAT-UHFFFAOYSA-N 0 0 384.421 3.076 20 5 GGBDRN COc1cccc2c1CC[C@@H]2NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000153662219 1422687233 /nfs/dbraw/zinc/68/72/33/1422687233.db2.gz XNQMCKMGCSZOKO-KRWDZBQOSA-N 0 0 378.388 3.206 20 5 GGBDRN O=C(Nc1ccc(NC(=O)C2CC2)nc1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000153662029 1422688353 /nfs/dbraw/zinc/68/83/53/1422688353.db2.gz VJHIYXQNGJUKKV-UHFFFAOYSA-N 0 0 377.360 3.139 20 5 GGBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)ccc1S(C)(=O)=O ZINC000153675170 1422697335 /nfs/dbraw/zinc/69/73/35/1422697335.db2.gz LYRQPKILJNRUIO-UHFFFAOYSA-N 0 0 385.401 3.107 20 5 GGBDRN O=c1c2ccccc2nc(SCCn2cc([N+](=O)[O-])cn2)n1C1CCCC1 ZINC000153690190 1422704204 /nfs/dbraw/zinc/70/42/04/1422704204.db2.gz JSVUPYDDGCHRFD-UHFFFAOYSA-N 0 0 385.449 3.409 20 5 GGBDRN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@@H](O)COCc1ccccc1 ZINC000153704301 1422710261 /nfs/dbraw/zinc/71/02/61/1422710261.db2.gz XSTWENLAKURORI-HXUWFJFHSA-N 0 0 397.431 3.259 20 5 GGBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COC2CCOCC2)c(-c2cccs2)c1 ZINC000153704442 1422711601 /nfs/dbraw/zinc/71/16/01/1422711601.db2.gz UCQCYEKIJXBAHK-CQSZACIVSA-N 0 0 379.434 3.259 20 5 GGBDRN Cc1ccc(C)c(OCc2nnc(SCCn3cc([N+](=O)[O-])cn3)o2)c1 ZINC000153707232 1422712798 /nfs/dbraw/zinc/71/27/98/1422712798.db2.gz PIIWHPVYQGYPLA-UHFFFAOYSA-N 0 0 375.410 3.162 20 5 GGBDRN O=C(NC[C@H]1CCN(c2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153720061 1422720785 /nfs/dbraw/zinc/72/07/85/1422720785.db2.gz VNPQWRSWTXWQOR-MRXNPFEDSA-N 0 0 380.448 3.189 20 5 GGBDRN COc1ccc(COc2cccc(NC(=O)c3cnn(C)c3)c2)cc1[N+](=O)[O-] ZINC000153729891 1422727406 /nfs/dbraw/zinc/72/74/06/1422727406.db2.gz CIQUGSAGIHVIFS-UHFFFAOYSA-N 0 0 382.376 3.168 20 5 GGBDRN CCO[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C12CCC2 ZINC000153736773 1422729990 /nfs/dbraw/zinc/72/99/90/1422729990.db2.gz MWOCBYPMLOPGMO-HUUCEWRRSA-N 0 0 388.873 3.216 20 5 GGBDRN CC(C)=CCC[C@@]1(C)NC(=O)N(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1=O ZINC000153750984 1422738212 /nfs/dbraw/zinc/73/82/12/1422738212.db2.gz GSQOBPDRPUIEGX-LJQANCHMSA-N 0 0 399.407 3.202 20 5 GGBDRN Cc1cc(NC(=O)Nc2cccc(CS(C)(=O)=O)c2C)ccc1[N+](=O)[O-] ZINC000153759761 1422741791 /nfs/dbraw/zinc/74/17/91/1422741791.db2.gz MVAMVFDBMQRHPT-UHFFFAOYSA-N 0 0 377.422 3.400 20 5 GGBDRN Cc1cccc(C)c1OC[C@@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccccc1 ZINC000153764004 1422744724 /nfs/dbraw/zinc/74/47/24/1422744724.db2.gz SRFCXSQMXNEPEL-MRXNPFEDSA-N 0 0 380.404 3.485 20 5 GGBDRN Cc1cc(NC(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000153785800 1422757127 /nfs/dbraw/zinc/75/71/27/1422757127.db2.gz BZDDIHVPFIDXLT-UHFFFAOYSA-N 0 0 388.468 3.406 20 5 GGBDRN Cc1cc(NC(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)ccc1[N+](=O)[O-] ZINC000153796306 1422762136 /nfs/dbraw/zinc/76/21/36/1422762136.db2.gz SOKBYRVVXTZMQI-KRWDZBQOSA-N 0 0 377.441 3.485 20 5 GGBDRN CC1(C)C[C@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])CCO1 ZINC000153800934 1422764758 /nfs/dbraw/zinc/76/47/58/1422764758.db2.gz IFEDNRHQGTXOJJ-SNVBAGLBSA-N 0 0 376.331 3.223 20 5 GGBDRN C[C@@H](C[C@@H](O)c1ccco1)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000153821831 1422780118 /nfs/dbraw/zinc/78/01/18/1422780118.db2.gz CCHBMEGAOAIJBP-WMLDXEAASA-N 0 0 375.425 3.322 20 5 GGBDRN Cc1cc(NC(=O)N2CCOC[C@H]2C[C@@H](O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000153827238 1422782748 /nfs/dbraw/zinc/78/27/48/1422782748.db2.gz DMZDLXVXULNIBX-IEBWSBKVSA-N 0 0 385.420 3.260 20 5 GGBDRN O=C(CNc1c(F)cccc1N1CCCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000153827501 1422782758 /nfs/dbraw/zinc/78/27/58/1422782758.db2.gz QZGILTHLYKQBGV-UHFFFAOYSA-N 0 0 384.411 3.335 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N(CCCO)Cc1cccc(Cl)c1 ZINC000153828180 1422784551 /nfs/dbraw/zinc/78/45/51/1422784551.db2.gz PYYKPZFKUWQTEY-UHFFFAOYSA-N 0 0 391.855 3.385 20 5 GGBDRN CC[NH+](CC)Cc1cccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000153828636 1422785316 /nfs/dbraw/zinc/78/53/16/1422785316.db2.gz KNQXXLULTDXINO-UHFFFAOYSA-N 0 0 393.465 3.246 20 5 GGBDRN COc1cc(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)ccc1[N+](=O)[O-] ZINC000153837513 1422791758 /nfs/dbraw/zinc/79/17/58/1422791758.db2.gz HBSZGBNBKBVGFN-GFCCVEGCSA-N 0 0 383.404 3.443 20 5 GGBDRN Cc1cc(NC(=O)NCCCC(=O)N2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000153846247 1422795476 /nfs/dbraw/zinc/79/54/76/1422795476.db2.gz OPHVYYNKICEBRK-UHFFFAOYSA-N 0 0 382.420 3.394 20 5 GGBDRN COc1ccccc1-c1noc([C@H](C)NC(=O)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000153849873 1422797295 /nfs/dbraw/zinc/79/72/95/1422797295.db2.gz ADDPCMKXXYVHLA-ZDUSSCGKSA-N 0 0 396.403 3.463 20 5 GGBDRN Cc1nccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1Cl ZINC000153862906 1422801036 /nfs/dbraw/zinc/80/10/36/1422801036.db2.gz WTWKZAODMUCXGV-UHFFFAOYSA-N 0 0 376.800 3.041 20 5 GGBDRN CSc1nnc(CCCNC(=O)Nc2ccc([N+](=O)[O-])cc2)n1CC(C)C ZINC000153866542 1422801594 /nfs/dbraw/zinc/80/15/94/1422801594.db2.gz TVMYZJYARODYBL-UHFFFAOYSA-N 0 0 392.485 3.319 20 5 GGBDRN O=C(NC[C@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1ccccc1[N+](=O)[O-] ZINC000153867307 1422801717 /nfs/dbraw/zinc/80/17/17/1422801717.db2.gz KLCSLEDWSPGBAL-CYBMUJFWSA-N 0 0 398.337 3.074 20 5 GGBDRN O=C(NC[C@@H](CO)Cc1ccc(OC(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000153883431 1422804814 /nfs/dbraw/zinc/80/48/14/1422804814.db2.gz WTKUFRBLTIPUEL-ZDUSSCGKSA-N 0 0 398.337 3.074 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1ccc([N+](=O)[O-])cc1 ZINC000153888333 1422805693 /nfs/dbraw/zinc/80/56/93/1422805693.db2.gz NCJMTRRPVZDTEL-UHFFFAOYSA-N 0 0 380.154 3.447 20 5 GGBDRN O=C(Cn1cnc(-c2ccccc2)n1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000153887608 1422805714 /nfs/dbraw/zinc/80/57/14/1422805714.db2.gz SLWJJKDORRTKQT-UHFFFAOYSA-N 0 0 377.404 3.045 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@@H](O)COc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000153895523 1422807133 /nfs/dbraw/zinc/80/71/33/1422807133.db2.gz ZSWMSIKKJMNGFM-MRXNPFEDSA-N 0 0 377.368 3.074 20 5 GGBDRN CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000153901778 1422807596 /nfs/dbraw/zinc/80/75/96/1422807596.db2.gz VZGQMPNBRZERTC-HRSKYJMSSA-N 0 0 393.509 3.349 20 5 GGBDRN C[C@@H](NC(=O)OCc1ccccc1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000153902458 1422808135 /nfs/dbraw/zinc/80/81/35/1422808135.db2.gz WKRMKQIOYFNQNF-OAHLLOKOSA-N 0 0 397.431 3.401 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@H](O)COc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000153908702 1422809165 /nfs/dbraw/zinc/80/91/65/1422809165.db2.gz UPQOVRCEALAPEQ-INIZCTEOSA-N 0 0 377.368 3.074 20 5 GGBDRN O=C(NCc1cccc(Cn2cccn2)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000153911687 1422809435 /nfs/dbraw/zinc/80/94/35/1422809435.db2.gz VIRVVGQTPWHSEW-UHFFFAOYSA-N 0 0 391.431 3.108 20 5 GGBDRN Cc1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1-n1cncn1 ZINC000153927902 1422812470 /nfs/dbraw/zinc/81/24/70/1422812470.db2.gz MLGJQWBERCKQCE-UHFFFAOYSA-N 0 0 377.404 3.289 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])OCCNc1ccc(C(F)(F)F)cn1 ZINC000153934648 1422813420 /nfs/dbraw/zinc/81/34/20/1422813420.db2.gz CTQXHEHTNRHZNL-UHFFFAOYSA-N 0 0 385.298 3.043 20 5 GGBDRN Cc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cccc1N1CCNC1=O ZINC000153939371 1422814009 /nfs/dbraw/zinc/81/40/09/1422814009.db2.gz PDRIHVKFVBIVMJ-UHFFFAOYSA-N 0 0 394.431 3.238 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N[C@@H]3CCC[C@H]4OCC[C@@H]43)cc2)c(C)c1[N+](=O)[O-] ZINC000153940502 1422814457 /nfs/dbraw/zinc/81/44/57/1422814457.db2.gz VQBYDPVGTLNHGW-GUDVDZBRSA-N 0 0 398.463 3.144 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCOC[C@@H]2C[C@H](O)c2ccccc2)c2ccncc21 ZINC000153949015 1422815701 /nfs/dbraw/zinc/81/57/01/1422815701.db2.gz NXMFSUSQVGEGHR-KKSFZXQISA-N 0 0 379.416 3.472 20 5 GGBDRN C[C@]1(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)Cc2ccccc2C(=O)O1 ZINC000153950656 1422815992 /nfs/dbraw/zinc/81/59/92/1422815992.db2.gz PQFPUZSXSHHXFT-OAQYLSRUSA-N 0 0 380.400 3.258 20 5 GGBDRN O=C(N[C@H]1CCCCNC1=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000153961866 1422817679 /nfs/dbraw/zinc/81/76/79/1422817679.db2.gz JEIOJRZILZHNGW-HNNXBMFYSA-N 0 0 377.466 3.028 20 5 GGBDRN O=[N+]([O-])c1ccc2nc(N3CCOC[C@H]3C[C@@H](O)c3ccccc3)ccc2c1 ZINC000153982987 1422820770 /nfs/dbraw/zinc/82/07/70/1422820770.db2.gz HBDYHBKYSZOKSL-UYAOXDASSA-N 0 0 379.416 3.472 20 5 GGBDRN CC(C)N(CC(=O)OC(C)(C)C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000153996071 1422822769 /nfs/dbraw/zinc/82/27/69/1422822769.db2.gz LLHIUEFMPZBXIZ-UHFFFAOYSA-N 0 0 376.413 3.197 20 5 GGBDRN O=[N+]([O-])c1cccc([C@@H](O)COc2c(Br)cccc2[N+](=O)[O-])c1 ZINC000154003997 1422823837 /nfs/dbraw/zinc/82/38/37/1422823837.db2.gz JFZGSUBRPNGMPE-ZDUSSCGKSA-N 0 0 383.154 3.378 20 5 GGBDRN CCCOc1ccc(Cl)cc1NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000154002406 1422823904 /nfs/dbraw/zinc/82/39/04/1422823904.db2.gz 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ZINC000155166531 1423207136 /nfs/dbraw/zinc/20/71/36/1423207136.db2.gz IZFIUPWPHDZTQW-GDLCADMTSA-N 0 0 396.241 3.436 20 5 GGBDRN O=C(c1ccc(C(=O)N2C[C@@H]3CCC[C@@H]3C2)c([N+](=O)[O-])c1)N1C[C@H]2CCC[C@@H]2C1 ZINC000155168454 1423207705 /nfs/dbraw/zinc/20/77/05/1423207705.db2.gz QNNMXAXFYBBRPJ-TVFCKZIOSA-N 0 0 397.475 3.339 20 5 GGBDRN CC(C)Oc1ccc([C@@H](O)CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000155168014 1423207792 /nfs/dbraw/zinc/20/77/92/1423207792.db2.gz IXAPPXMIDPKOAY-KRWDZBQOSA-N 0 0 378.812 3.499 20 5 GGBDRN COc1ccc(C[C@H](C)CN(C)C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000155173312 1423211654 /nfs/dbraw/zinc/21/16/54/1423211654.db2.gz YRDAUQYKYBABDR-AWEZNQCLSA-N 0 0 399.447 3.188 20 5 GGBDRN COc1ccc(C[C@@H](C)CN(C)C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000155173399 1423212045 /nfs/dbraw/zinc/21/20/45/1423212045.db2.gz YRDAUQYKYBABDR-CQSZACIVSA-N 0 0 399.447 3.188 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000179881899 1429622504 /nfs/dbraw/zinc/62/25/04/1429622504.db2.gz HZUZYUBXYSJWNV-HNNXBMFYSA-N 0 0 389.839 3.412 20 5 GGBDRN CCS(=O)(=O)c1ccc(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000155178239 1423215209 /nfs/dbraw/zinc/21/52/09/1423215209.db2.gz BXRMAUKGKGBWNE-UHFFFAOYSA-N 0 0 376.434 3.268 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2-n2nc(C)cc2C)c1 ZINC000155190976 1423229968 /nfs/dbraw/zinc/22/99/68/1423229968.db2.gz LNNSZOZJQXGOAZ-UHFFFAOYSA-N 0 0 380.404 3.336 20 5 GGBDRN O=C(NC[C@@H](O)c1ccccc1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000155190067 1423230822 /nfs/dbraw/zinc/23/08/22/1423230822.db2.gz PAFYWUAYPRQPQL-CQSZACIVSA-N 0 0 380.198 3.212 20 5 GGBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CN1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000155196975 1423237127 /nfs/dbraw/zinc/23/71/27/1423237127.db2.gz DZXXCSXLJMFMCS-CYBMUJFWSA-N 0 0 389.795 3.267 20 5 GGBDRN Cc1cc(C)nc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000155205621 1423243904 /nfs/dbraw/zinc/24/39/04/1423243904.db2.gz YKUFNELBUCKHQW-KRWDZBQOSA-N 0 0 382.420 3.158 20 5 GGBDRN CN(C)c1nnc(-c2ccc(NC(=O)CCNc3ccccc3[N+](=O)[O-])cc2)o1 ZINC000155206940 1423244877 /nfs/dbraw/zinc/24/48/77/1423244877.db2.gz UOYPUDROENOOFQ-UHFFFAOYSA-N 0 0 396.407 3.152 20 5 GGBDRN O=C(NC[C@@H](O)c1ccc(F)cc1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000155216070 1423251560 /nfs/dbraw/zinc/25/15/60/1423251560.db2.gz AYJXQURKXVXMSE-CQSZACIVSA-N 0 0 398.188 3.352 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)c(C)c1[N+](=O)[O-] ZINC000155216652 1423252834 /nfs/dbraw/zinc/25/28/34/1423252834.db2.gz LLXUGCHQNJZHLQ-AWEZNQCLSA-N 0 0 385.468 3.276 20 5 GGBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000179892523 1429627550 /nfs/dbraw/zinc/62/75/50/1429627550.db2.gz GARSJAJBLJXZAB-UHFFFAOYSA-N 0 0 386.305 3.427 20 5 GGBDRN O=C(Nc1cccc(C(=O)N2CCSCC2)c1)c1cc(F)ccc1[N+](=O)[O-] ZINC000155258424 1423282602 /nfs/dbraw/zinc/28/26/02/1423282602.db2.gz QAZLXDKVBXGKFL-UHFFFAOYSA-N 0 0 389.408 3.175 20 5 GGBDRN O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccccc1CCC(F)(F)F ZINC000155263742 1423285124 /nfs/dbraw/zinc/28/51/24/1423285124.db2.gz SRXKQIZDGFBLPM-UHFFFAOYSA-N 0 0 395.337 3.458 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@H](O)COc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000155278059 1423294282 /nfs/dbraw/zinc/29/42/82/1423294282.db2.gz JQLOOPZDAPUJFU-KRWDZBQOSA-N 0 0 377.368 3.074 20 5 GGBDRN C[C@@H](CC(=O)c1ccco1)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000155282913 1423296965 /nfs/dbraw/zinc/29/69/65/1423296965.db2.gz BJNGLQIEYXIRNS-QWRGUYRKSA-N 0 0 380.784 3.386 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N(CCN1CCOCC1)c1ccccc1 ZINC000155291488 1423303382 /nfs/dbraw/zinc/30/33/82/1423303382.db2.gz ISUCFPIBEYNPHA-UHFFFAOYSA-N 0 0 389.839 3.227 20 5 GGBDRN Cc1c(C(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000155293124 1423303775 /nfs/dbraw/zinc/30/37/75/1423303775.db2.gz JETNNLOORSIQOY-HNNXBMFYSA-N 0 0 397.746 3.067 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c(S(=O)(=O)N2CCCC2)c1 ZINC000155301857 1423308381 /nfs/dbraw/zinc/30/83/81/1423308381.db2.gz OCADSUCFXYDKHW-LSTHTHJFSA-N 0 0 399.472 3.130 20 5 GGBDRN CCC[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000155307287 1423311283 /nfs/dbraw/zinc/31/12/83/1423311283.db2.gz TXDURXOOLKKLKO-ZIAGYGMSSA-N 0 0 379.482 3.300 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@H]1[C@H]1CCCCC1=O ZINC000155325143 1423317835 /nfs/dbraw/zinc/31/78/35/1423317835.db2.gz DGDZCMQIJWNCTJ-AEFFLSMTSA-N 0 0 382.420 3.144 20 5 GGBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@@H]1[C@@H]1CCCCC1=O ZINC000155324829 1423317942 /nfs/dbraw/zinc/31/79/42/1423317942.db2.gz DGDZCMQIJWNCTJ-FUHWJXTLSA-N 0 0 382.420 3.144 20 5 GGBDRN Cc1ccc(C(=O)NC2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)s1 ZINC000155333479 1423321781 /nfs/dbraw/zinc/32/17/81/1423321781.db2.gz JMNQXDLRFYMFSK-UHFFFAOYSA-N 0 0 391.424 3.138 20 5 GGBDRN COc1ccc([C@H]2CCN([C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3OC)C2)cc1 ZINC000155334105 1423321901 /nfs/dbraw/zinc/32/19/01/1423321901.db2.gz JWZQLXKVOYTKLU-HOCLYGCPSA-N 0 0 399.447 3.429 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000179902611 1429632226 /nfs/dbraw/zinc/63/22/26/1429632226.db2.gz BEXTWERIDHZFMW-AWEZNQCLSA-N 0 0 375.812 3.022 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)ccc1[N+](=O)[O-] ZINC000155350530 1423328440 /nfs/dbraw/zinc/32/84/40/1423328440.db2.gz MFSIIFVBWRIQBS-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2[C@H](C1)OCCN2Cc1ccccc1 ZINC000155354032 1423330259 /nfs/dbraw/zinc/33/02/59/1423330259.db2.gz SQDWADZYRRFLHS-UXHICEINSA-N 0 0 396.447 3.020 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(-c2ncco2)c1 ZINC000155358443 1423331372 /nfs/dbraw/zinc/33/13/72/1423331372.db2.gz XMLDGYIBMQWAEX-GFCCVEGCSA-N 0 0 380.360 3.007 20 5 GGBDRN COC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000155361099 1423332745 /nfs/dbraw/zinc/33/27/45/1423332745.db2.gz UWZHARPTDGHHPD-UHFFFAOYSA-N 0 0 385.420 3.136 20 5 GGBDRN O=C(NCc1ccc(NC(=O)c2cccnc2)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000155366340 1423335075 /nfs/dbraw/zinc/33/50/75/1423335075.db2.gz NJFPSLHGCSPOBZ-UHFFFAOYSA-N 0 0 394.362 3.311 20 5 GGBDRN COc1ccc([C@H]2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)cc1 ZINC000155397472 1423347410 /nfs/dbraw/zinc/34/74/10/1423347410.db2.gz VCHRQVSKSCICLW-ZDUSSCGKSA-N 0 0 396.852 3.435 20 5 GGBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H](O)c1ccc(Cl)c(F)c1 ZINC000155395878 1423347760 /nfs/dbraw/zinc/34/77/60/1423347760.db2.gz OPVUMTMUKIJVHA-MRXNPFEDSA-N 0 0 381.791 3.039 20 5 GGBDRN O=C(Nc1cccc(C(F)(F)F)n1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000155399102 1423348728 /nfs/dbraw/zinc/34/87/28/1423348728.db2.gz NNOCRDCAHITRLC-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN O=C(NC1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1)C1CC1 ZINC000179910152 1429636191 /nfs/dbraw/zinc/63/61/91/1429636191.db2.gz ISBYEXFPYBBIDJ-UHFFFAOYSA-N 0 0 386.477 3.209 20 5 GGBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OC[C@@H](O)COC1CCOCC1 ZINC000155470580 1423377612 /nfs/dbraw/zinc/37/76/12/1423377612.db2.gz JTTVYQXAWCSQBO-SFHVURJKSA-N 0 0 387.432 3.121 20 5 GGBDRN C[C@H]1COCCN1c1ccc(NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)cc1 ZINC000155472483 1423378977 /nfs/dbraw/zinc/37/89/77/1423378977.db2.gz XKGMLQKPPOXVKZ-NSHDSACASA-N 0 0 377.347 3.350 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCCC(C)(C)CC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000155487716 1423384111 /nfs/dbraw/zinc/38/41/11/1423384111.db2.gz BZZVLUYXWYANBJ-UHFFFAOYSA-N 0 0 384.436 3.101 20 5 GGBDRN Cc1c(C(=O)N2CCO[C@@]3(CCc4ccccc43)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000155494527 1423386623 /nfs/dbraw/zinc/38/66/23/1423386623.db2.gz LLICTQXBJARYRP-FQEVSTJZSA-N 0 0 397.387 3.126 20 5 GGBDRN CN(CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155498346 1423387180 /nfs/dbraw/zinc/38/71/80/1423387180.db2.gz LMPBSURRKOXOJI-MRXNPFEDSA-N 0 0 396.852 3.087 20 5 GGBDRN COc1ccc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000179923009 1429643083 /nfs/dbraw/zinc/64/30/83/1429643083.db2.gz VSQZDWVNJLPESE-AWEZNQCLSA-N 0 0 375.812 3.266 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@@H](CO)c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000155515397 1423396007 /nfs/dbraw/zinc/39/60/07/1423396007.db2.gz HQYYUPREENVVOG-SFHVURJKSA-N 0 0 383.448 3.295 20 5 GGBDRN C[C@H]1CCc2ccccc2[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000155521251 1423397325 /nfs/dbraw/zinc/39/73/25/1423397325.db2.gz VIVRCJGLSMKROP-FKIZINRSSA-N 0 0 377.400 3.490 20 5 GGBDRN C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000155521149 1423397984 /nfs/dbraw/zinc/39/79/84/1423397984.db2.gz VIVRCJGLSMKROP-MPBGBICISA-N 0 0 377.400 3.490 20 5 GGBDRN COC(=O)c1cc(C(=O)NCCc2csc(C(C)(C)C)n2)cc([N+](=O)[O-])c1 ZINC000155523425 1423398808 /nfs/dbraw/zinc/39/88/08/1423398808.db2.gz MKGVJVQTWUOMGB-UHFFFAOYSA-N 0 0 391.449 3.108 20 5 GGBDRN CCc1ccc(C(=O)N2CCOC[C@H]2C[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000155530905 1423402904 /nfs/dbraw/zinc/40/29/04/1423402904.db2.gz LBDZZKLIJLLMFZ-UYAOXDASSA-N 0 0 384.432 3.122 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@@H](O)COCc2ccc(Cl)cc2)c1 ZINC000155533500 1423403555 /nfs/dbraw/zinc/40/35/55/1423403555.db2.gz VCHJWIQGKAMFMP-INIZCTEOSA-N 0 0 380.828 3.271 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2ccn(-c3c(F)cccc3F)n2)cc1 ZINC000155532454 1423403959 /nfs/dbraw/zinc/40/39/59/1423403959.db2.gz HIINJQODBJSDGE-UHFFFAOYSA-N 0 0 379.344 3.033 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@@H](O)CO[C@@H]2CCCc3ccccc32)c1 ZINC000155534172 1423404733 /nfs/dbraw/zinc/40/47/33/1423404733.db2.gz SMJOZKZJIPDSFY-FXAWDEMLSA-N 0 0 386.448 3.495 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCOC[C@H]1C[C@@H](O)c1ccccc1 ZINC000155541628 1423409353 /nfs/dbraw/zinc/40/93/53/1423409353.db2.gz WPDVJLQURJHONS-CRAIPNDOSA-N 0 0 390.823 3.213 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1c(C)noc1C ZINC000155573104 1423425246 /nfs/dbraw/zinc/42/52/46/1423425246.db2.gz YRBWWOSOFPHDJB-GFCCVEGCSA-N 0 0 380.788 3.059 20 5 GGBDRN CC[C@H](NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1c(C)noc1C ZINC000155572555 1423425695 /nfs/dbraw/zinc/42/56/95/1423425695.db2.gz DYIREKQLAYDHHV-LBPRGKRZSA-N 0 0 380.788 3.059 20 5 GGBDRN C[C@@H]1CN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@H](c2ccsc2)O1 ZINC000155575214 1423426442 /nfs/dbraw/zinc/42/64/42/1423426442.db2.gz DMCBTORWLYTVOV-CXAGYDPISA-N 0 0 375.450 3.081 20 5 GGBDRN CC(C)CC[C@@H]1CCCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000155590788 1423434435 /nfs/dbraw/zinc/43/44/35/1423434435.db2.gz YXAZBCLEBKQWOH-AWEZNQCLSA-N 0 0 379.482 3.213 20 5 GGBDRN COc1ccc(C[C@H](C)CNC(=O)CNc2ccccc2[N+](=O)[O-])cc1OC ZINC000155592718 1423435819 /nfs/dbraw/zinc/43/58/19/1423435819.db2.gz LGXOVENANYGNPC-AWEZNQCLSA-N 0 0 387.436 3.019 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN(C)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000155594423 1423436009 /nfs/dbraw/zinc/43/60/09/1423436009.db2.gz AZIBYSVKKUXPEI-HNNXBMFYSA-N 0 0 396.852 3.217 20 5 GGBDRN O=C(NC[C@H](O)c1ccsc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155598480 1423438330 /nfs/dbraw/zinc/43/83/30/1423438330.db2.gz HRMOCUHJOKCICB-AWEZNQCLSA-N 0 0 375.431 3.243 20 5 GGBDRN COc1ccc(-n2nc(C(=O)Nc3ccc(OC)cc3[N+](=O)[O-])cc2C)cc1 ZINC000179920085 1429641886 /nfs/dbraw/zinc/64/18/86/1429641886.db2.gz HHZQZUDMXLKIHP-UHFFFAOYSA-N 0 0 382.376 3.358 20 5 GGBDRN CC(C)CC[C@@H]1CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000155608604 1423443519 /nfs/dbraw/zinc/44/35/19/1423443519.db2.gz QZTAFMZNTRVKSW-ZDUSSCGKSA-N 0 0 381.860 3.405 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@H](c2ccsc2)O1 ZINC000155609689 1423443698 /nfs/dbraw/zinc/44/36/98/1423443698.db2.gz UKMQGBBFPOFEIO-SJKOYZFVSA-N 0 0 375.450 3.325 20 5 GGBDRN O=C(N[C@@H]1C[C@@H]1C1CCCCC1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000155613690 1423446095 /nfs/dbraw/zinc/44/60/95/1423446095.db2.gz PMKXLQVRVFTADN-RBSFLKMASA-N 0 0 391.493 3.346 20 5 GGBDRN CC(=O)c1cccc(OCc2cc(C(=O)NCc3ccccc3[N+](=O)[O-])no2)c1 ZINC000179926255 1429644823 /nfs/dbraw/zinc/64/48/23/1429644823.db2.gz ISWFTVIAAGQGQX-UHFFFAOYSA-N 0 0 395.371 3.294 20 5 GGBDRN CC1CCN(C(=O)c2ccc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)cc2)CC1 ZINC000155686989 1423487340 /nfs/dbraw/zinc/48/73/40/1423487340.db2.gz QYCJMJBIJKSLPJ-UHFFFAOYSA-N 0 0 382.420 3.301 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCCC[C@H]1Oc1ccccc1C ZINC000155697741 1423491343 /nfs/dbraw/zinc/49/13/43/1423491343.db2.gz ZKJFACKLJOWFPW-SJLPKXTDSA-N 0 0 386.452 3.305 20 5 GGBDRN Cc1nnc([C@H]2Cc3ccccc3CN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)o1 ZINC000155701930 1423494199 /nfs/dbraw/zinc/49/41/99/1423494199.db2.gz MUOSCWLFGSGCIH-GOSISDBHSA-N 0 0 396.378 3.294 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(CCS(C)(=O)=O)cc1 ZINC000179929190 1429647001 /nfs/dbraw/zinc/64/70/01/1429647001.db2.gz PUMGPGUXMQJHKI-UHFFFAOYSA-N 0 0 390.461 3.359 20 5 GGBDRN CSc1cc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1F ZINC000155710138 1423499147 /nfs/dbraw/zinc/49/91/47/1423499147.db2.gz SRCPSKNBFWRKHW-UHFFFAOYSA-N 0 0 375.425 3.418 20 5 GGBDRN Cc1nn(Cc2ccc(C(=O)N[C@H]3CCOC(C)(C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000155734018 1423509619 /nfs/dbraw/zinc/50/96/19/1423509619.db2.gz INFRMXIAHNNKJV-KRWDZBQOSA-N 0 0 386.452 3.144 20 5 GGBDRN CC[C@@H](C)[C@@H](O)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000155757127 1423520452 /nfs/dbraw/zinc/52/04/52/1423520452.db2.gz JOLZLCXXKXMXOE-TYILLQQXSA-N 0 0 386.452 3.300 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](c2ccsc2)O1 ZINC000155764499 1423523439 /nfs/dbraw/zinc/52/34/39/1423523439.db2.gz YUYFVILDXGMGQD-UGSOOPFHSA-N 0 0 398.444 3.444 20 5 GGBDRN Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000155765281 1423523456 /nfs/dbraw/zinc/52/34/56/1423523456.db2.gz AVZAGNMRTNFCKM-PKOBYXMFSA-N 0 0 397.431 3.348 20 5 GGBDRN Cc1ccc([C@@H](C)[NH2+]CCCOc2ccc(-c3nn[n-]n3)cc2)cc1[N+](=O)[O-] ZINC000826283111 1423523551 /nfs/dbraw/zinc/52/35/51/1423523551.db2.gz KNZBZCCLYNYTSN-CQSZACIVSA-N 0 0 382.424 3.203 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](c2ccsc2)O1 ZINC000155764171 1423523619 /nfs/dbraw/zinc/52/36/19/1423523619.db2.gz YUYFVILDXGMGQD-FZKQIMNGSA-N 0 0 398.444 3.444 20 5 GGBDRN Cc1c(CN2C(=O)N[C@@](C)(c3cc(F)cc(F)c3)C2=O)cccc1[N+](=O)[O-] ZINC000155763889 1423523697 /nfs/dbraw/zinc/52/36/97/1423523697.db2.gz PODVTKZQFIFOTL-SFHVURJKSA-N 0 0 375.331 3.149 20 5 GGBDRN C[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000155783018 1423532667 /nfs/dbraw/zinc/53/26/67/1423532667.db2.gz DPRDIAWGYPBIPO-LBPRGKRZSA-N 0 0 377.828 3.361 20 5 GGBDRN C[C@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H](c2ccsc2)O1 ZINC000155788669 1423534084 /nfs/dbraw/zinc/53/40/84/1423534084.db2.gz YHPQELAVDFFGHY-GUYCJALGSA-N 0 0 375.450 3.447 20 5 GGBDRN C[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@H](c2ccsc2)O1 ZINC000155788351 1423534680 /nfs/dbraw/zinc/53/46/80/1423534680.db2.gz YHPQELAVDFFGHY-CXAGYDPISA-N 0 0 375.450 3.447 20 5 GGBDRN CO[C@@H](C)COC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000155800157 1423540070 /nfs/dbraw/zinc/54/00/70/1423540070.db2.gz OZRRRAOHHYXWSP-NSHDSACASA-N 0 0 390.358 3.408 20 5 GGBDRN C[C@H]1Oc2ccc(NCc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)cc2NC1=O ZINC000155800898 1423540238 /nfs/dbraw/zinc/54/02/38/1423540238.db2.gz UIUPWGHMNBOISB-GFCCVEGCSA-N 0 0 393.403 3.327 20 5 GGBDRN O=[N+]([O-])c1cc(-c2nc(-c3ccc(N4CCCCC4)nc3)no2)cc2c1OCO2 ZINC000179940183 1429652370 /nfs/dbraw/zinc/65/23/70/1429652370.db2.gz IEIHHMXSWANXHV-UHFFFAOYSA-N 0 0 395.375 3.426 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCCOCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000179939492 1429652815 /nfs/dbraw/zinc/65/28/15/1429652815.db2.gz CQVVRMIEIPSBOY-GDBMZVCRSA-N 0 0 384.436 3.462 20 5 GGBDRN CC(C)COc1ccccc1CNC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000155848957 1423561033 /nfs/dbraw/zinc/56/10/33/1423561033.db2.gz KSYXGSMEHWYYFM-HNNXBMFYSA-N 0 0 399.447 3.064 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)c1[N+](=O)[O-] ZINC000155872640 1423570498 /nfs/dbraw/zinc/57/04/98/1423570498.db2.gz BCYOCRHTXCGEEU-UHFFFAOYSA-N 0 0 394.391 3.170 20 5 GGBDRN Cc1cc(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])nn1-c1ccccc1Cl ZINC000179942835 1429654304 /nfs/dbraw/zinc/65/43/04/1429654304.db2.gz MCSHSNFLOLTQHB-UHFFFAOYSA-N 0 0 385.811 3.453 20 5 GGBDRN Cc1sc(NC(=O)CS(=O)(=O)C(C)(C)C)nc1-c1cccc([N+](=O)[O-])c1 ZINC000155895725 1423582190 /nfs/dbraw/zinc/58/21/90/1423582190.db2.gz PRLLTUIYFPJCOM-UHFFFAOYSA-N 0 0 397.478 3.179 20 5 GGBDRN Cc1c(C(=O)N[C@@H](C)C(=O)Nc2cccc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000155897639 1423583399 /nfs/dbraw/zinc/58/33/99/1423583399.db2.gz DDVRKHDXVKBPLE-HNNXBMFYSA-N 0 0 396.447 3.260 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)C(=O)Nc2cccc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000155897750 1423583463 /nfs/dbraw/zinc/58/34/63/1423583463.db2.gz DDVRKHDXVKBPLE-OAHLLOKOSA-N 0 0 396.447 3.260 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC[C@@H](CCCc2ccccc2)C1 ZINC000155897618 1423583507 /nfs/dbraw/zinc/58/35/07/1423583507.db2.gz RPOLTWCQQVSKHS-GOSISDBHSA-N 0 0 383.448 3.018 20 5 GGBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCN(Cc2nc3ccccc3[nH]2)CC1 ZINC000155899526 1423584317 /nfs/dbraw/zinc/58/43/17/1423584317.db2.gz XNKKTRPRVLWLOD-UHFFFAOYSA-N 0 0 399.838 3.083 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cnc(C(F)(F)F)nc1 ZINC000155900999 1423585483 /nfs/dbraw/zinc/58/54/83/1423585483.db2.gz GZKFTVASBSRQFF-UHFFFAOYSA-N 0 0 378.270 3.046 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H]1C[C@@H]1C1CCCCC1 ZINC000155930653 1423598554 /nfs/dbraw/zinc/59/85/54/1423598554.db2.gz DQUOFSVTADFLOZ-HZPDHXFCSA-N 0 0 387.436 3.368 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@@H](C)c2cc(F)ccc2OC)c([N+](=O)[O-])c1 ZINC000179953333 1429660757 /nfs/dbraw/zinc/66/07/57/1429660757.db2.gz JFBGROMKDJCHHX-LBPRGKRZSA-N 0 0 391.399 3.431 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN(Cc3ccccc3)[C@@H](CO)C3CC3)n2)c1 ZINC000155957026 1423609403 /nfs/dbraw/zinc/60/94/03/1423609403.db2.gz FKAZCADIKOKVEI-IBGZPJMESA-N 0 0 394.431 3.418 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN(Cc3ccccc3)[C@H](CO)C3CC3)n2)c1 ZINC000155957151 1423609488 /nfs/dbraw/zinc/60/94/88/1423609488.db2.gz FKAZCADIKOKVEI-LJQANCHMSA-N 0 0 394.431 3.418 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c(OCC2CC2)c1 ZINC000155986136 1423621064 /nfs/dbraw/zinc/62/10/64/1423621064.db2.gz SJBNGUVOKYYTIA-UHFFFAOYSA-N 0 0 390.461 3.312 20 5 GGBDRN CCOCCC1(CNC(=O)NCc2cc([N+](=O)[O-])ccc2OC)CCCC1 ZINC000155988732 1423623239 /nfs/dbraw/zinc/62/32/39/1423623239.db2.gz DVDGRFYGOMPYPA-UHFFFAOYSA-N 0 0 379.457 3.390 20 5 GGBDRN CCC[C@@H](C)[C@H]1CCCN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000156008062 1423631561 /nfs/dbraw/zinc/63/15/61/1423631561.db2.gz CLWYFVOYWDMSBS-TZMCWYRMSA-N 0 0 379.482 3.213 20 5 GGBDRN Cc1cccc(C)c1NC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000179950518 1429659213 /nfs/dbraw/zinc/65/92/13/1429659213.db2.gz WCWXXGZZWPQYRW-UHFFFAOYSA-N 0 0 393.346 3.182 20 5 GGBDRN Cc1cccc(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000156034681 1423643624 /nfs/dbraw/zinc/64/36/24/1423643624.db2.gz GKAPYAQZYNEFBX-UHFFFAOYSA-N 0 0 377.441 3.280 20 5 GGBDRN Cc1ccc2c(c1)[C@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CO2 ZINC000156051815 1423650888 /nfs/dbraw/zinc/65/08/88/1423650888.db2.gz GNLOAMQRKIWFHX-QGZVFWFLSA-N 0 0 378.388 3.167 20 5 GGBDRN O=C(Nc1ccccc1OCC1CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000156051547 1423651457 /nfs/dbraw/zinc/65/14/57/1423651457.db2.gz JENUIHAFEQMZSJ-UHFFFAOYSA-N 0 0 379.372 3.477 20 5 GGBDRN O=C(NC[C@@H](c1ccco1)N1CCCC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000179951429 1429659863 /nfs/dbraw/zinc/65/98/63/1429659863.db2.gz YOVLQRDSWFGWQH-AWEZNQCLSA-N 0 0 395.362 3.356 20 5 GGBDRN Cc1cccc(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000156059730 1423655235 /nfs/dbraw/zinc/65/52/35/1423655235.db2.gz AYQVRDFUQZOABR-AWEZNQCLSA-N 0 0 377.441 3.280 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](c2ccsc2)O1 ZINC000156070887 1423659193 /nfs/dbraw/zinc/65/91/93/1423659193.db2.gz YGQIIPAJBDRACC-SCLBCKFNSA-N 0 0 398.444 3.444 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](c2ccsc2)O1 ZINC000156070985 1423660011 /nfs/dbraw/zinc/66/00/11/1423660011.db2.gz YGQIIPAJBDRACC-ACJLOTCBSA-N 0 0 398.444 3.444 20 5 GGBDRN C[C@@H]1CN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H](c2ccsc2)O1 ZINC000156074816 1423661419 /nfs/dbraw/zinc/66/14/19/1423661419.db2.gz AJNODDIGMLMOLD-DIFFPNOSSA-N 0 0 399.428 3.100 20 5 GGBDRN Cc1nc(CN2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)cs1 ZINC000156079117 1423662756 /nfs/dbraw/zinc/66/27/56/1423662756.db2.gz ZDDZZPJKBJRWDC-UHFFFAOYSA-N 0 0 375.454 3.018 20 5 GGBDRN Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000156133145 1423687265 /nfs/dbraw/zinc/68/72/65/1423687265.db2.gz GTJRPSPXVGOONC-GOSISDBHSA-N 0 0 399.472 3.294 20 5 GGBDRN Cc1cc(C(=O)Nc2cc(-c3ccco3)nn2-c2cccc([N+](=O)[O-])c2)ncn1 ZINC000156139856 1423690197 /nfs/dbraw/zinc/69/01/97/1423690197.db2.gz MXUWRQYMHUXWPX-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN CNC(=O)c1cc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)ccc1Cl ZINC000156151643 1423696441 /nfs/dbraw/zinc/69/64/41/1423696441.db2.gz BTFVFLKDDOOXEY-UHFFFAOYSA-N 0 0 386.795 3.270 20 5 GGBDRN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1cc(-c2nnn[n-]2)ccc1F ZINC000826500432 1429665018 /nfs/dbraw/zinc/66/50/18/1429665018.db2.gz YHVPNKQQHUWGNB-ACJLOTCBSA-N 0 0 396.426 3.415 20 5 GGBDRN O=C(NCc1csc(-c2ccco2)n1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000156217147 1423731870 /nfs/dbraw/zinc/73/18/70/1423731870.db2.gz IDMMFIQOABWVBU-UHFFFAOYSA-N 0 0 395.400 3.427 20 5 GGBDRN CCOCCC1(CNC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)CCC1 ZINC000156256089 1423744991 /nfs/dbraw/zinc/74/49/91/1423744991.db2.gz XQWIYEWMXRCJOE-UHFFFAOYSA-N 0 0 390.484 3.023 20 5 GGBDRN O=C(Nc1ccc(O[C@H]2CCOC2)cc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000156257469 1423745461 /nfs/dbraw/zinc/74/54/61/1423745461.db2.gz NOFQHAJASJONIE-SFHVURJKSA-N 0 0 394.387 3.201 20 5 GGBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000156257343 1423745527 /nfs/dbraw/zinc/74/55/27/1423745527.db2.gz NOFQHAJASJONIE-GOSISDBHSA-N 0 0 394.387 3.201 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)NCC(C)(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000156295346 1423762427 /nfs/dbraw/zinc/76/24/27/1423762427.db2.gz RIHISQWOSWNHGW-UHFFFAOYSA-N 0 0 391.468 3.056 20 5 GGBDRN COc1cc(NCCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc(OC)c1 ZINC000156313399 1423772724 /nfs/dbraw/zinc/77/27/24/1423772724.db2.gz SKDPQEQKFAPVOO-UHFFFAOYSA-N 0 0 379.800 3.107 20 5 GGBDRN COc1cc(C(=O)NCC(=O)Nc2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000156339452 1423788858 /nfs/dbraw/zinc/78/88/58/1423788858.db2.gz SEKGRQZTPPHXCS-UHFFFAOYSA-N 0 0 379.372 3.125 20 5 GGBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](Oc2ccncc2)C1 ZINC000156341598 1423789446 /nfs/dbraw/zinc/78/94/46/1423789446.db2.gz XFLKVKGQVCIRFA-DOMZBBRYSA-N 0 0 390.827 3.124 20 5 GGBDRN NC(=O)CCSc1ccccc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000156348334 1423790615 /nfs/dbraw/zinc/79/06/15/1423790615.db2.gz MXVMIRCGPPFIKP-UHFFFAOYSA-N 0 0 379.825 3.468 20 5 GGBDRN COc1cc2c(cc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)O[C@@H](C)C2 ZINC000156347736 1423790719 /nfs/dbraw/zinc/79/07/19/1423790719.db2.gz NCVSQXDFYSYRNM-NSHDSACASA-N 0 0 390.823 3.439 20 5 GGBDRN C[C@H](NC(=O)NCCOc1ccc(C(F)(F)F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000156365993 1423800247 /nfs/dbraw/zinc/80/02/47/1423800247.db2.gz KFEXYWHIRNHEGF-NSHDSACASA-N 0 0 398.341 3.448 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000156385958 1423803164 /nfs/dbraw/zinc/80/31/64/1423803164.db2.gz JAGZAFYJCXDUIT-HWPZZCPQSA-N 0 0 391.405 3.475 20 5 GGBDRN COc1cc(NCCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc(OC)c1 ZINC000156404717 1423806505 /nfs/dbraw/zinc/80/65/05/1423806505.db2.gz DUQQDMNYGBXAAH-UHFFFAOYSA-N 0 0 379.800 3.107 20 5 GGBDRN CN(c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)[C@@H](CCO)c1ccccc1 ZINC000156422383 1423808780 /nfs/dbraw/zinc/80/87/80/1423808780.db2.gz RITOLNPXLMOYPR-IBGZPJMESA-N 0 0 383.448 3.391 20 5 GGBDRN COC(=O)C1(N(C)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCC1 ZINC000156441373 1423810941 /nfs/dbraw/zinc/81/09/41/1423810941.db2.gz KLOKQXHHSQNYHQ-UHFFFAOYSA-N 0 0 389.433 3.276 20 5 GGBDRN CCOc1ccc2c(c1)C[C@@H](C(=O)N1CCc3ccc([N+](=O)[O-])cc3C1)CO2 ZINC000156491119 1423817712 /nfs/dbraw/zinc/81/77/12/1423817712.db2.gz ISVHDVKBCKSKFY-QGZVFWFLSA-N 0 0 382.416 3.130 20 5 GGBDRN Cn1c(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)nc2ccccc21 ZINC000179983928 1429674709 /nfs/dbraw/zinc/67/47/09/1429674709.db2.gz LKMIKSXYRHOKCK-UHFFFAOYSA-N 0 0 376.319 3.013 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(OCCc2csc(C)n2)c([N+](=O)[O-])c1 ZINC000156515899 1423822001 /nfs/dbraw/zinc/82/20/01/1423822001.db2.gz 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CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156593485 1423833509 /nfs/dbraw/zinc/83/35/09/1423833509.db2.gz NKJHGNDWQXLYSX-FQEVSTJZSA-N 0 0 395.459 3.007 20 5 GGBDRN Cc1cccc(C(=O)N[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C(C)C)c1 ZINC000156602814 1423834723 /nfs/dbraw/zinc/83/47/23/1423834723.db2.gz ANINXLONOYQEQG-FQEVSTJZSA-N 0 0 395.459 3.243 20 5 GGBDRN O=C(CCc1nnc(-c2ccsc2)o1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156603369 1423834766 /nfs/dbraw/zinc/83/47/66/1423834766.db2.gz PBXSKWWTWOILGZ-UHFFFAOYSA-N 0 0 384.417 3.224 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1C(=O)c1ccccc1 ZINC000156602660 1423834871 /nfs/dbraw/zinc/83/48/71/1423834871.db2.gz IFFPFBDCJAVGDH-UHFFFAOYSA-N 0 0 378.388 3.360 20 5 GGBDRN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000156611043 1423835460 /nfs/dbraw/zinc/83/54/60/1423835460.db2.gz ZZZYZVIITCROGX-UHFFFAOYSA-N 0 0 395.459 3.408 20 5 GGBDRN O=C(CCc1nc(-c2ccsc2)no1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000156607707 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1423870750 /nfs/dbraw/zinc/87/07/50/1423870750.db2.gz NUFXSBUVRWJWAE-UHFFFAOYSA-N 0 0 382.420 3.080 20 5 GGBDRN COC(=O)CCCN(Cc1ccccc1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000156838078 1423873099 /nfs/dbraw/zinc/87/30/99/1423873099.db2.gz CMYGINNVCXAQQI-UHFFFAOYSA-N 0 0 396.403 3.067 20 5 GGBDRN COc1cc(CN(C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1O ZINC000156863262 1423876842 /nfs/dbraw/zinc/87/68/42/1423876842.db2.gz MTGSKKFFVHHSMH-LLVKDONJSA-N 0 0 393.827 3.421 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000156864471 1423877300 /nfs/dbraw/zinc/87/73/00/1423877300.db2.gz JCQWITSGCWUNRX-UHFFFAOYSA-N 0 0 381.348 3.184 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000156868240 1423877398 /nfs/dbraw/zinc/87/73/98/1423877398.db2.gz VCIXXHVGVKGVJD-UHFFFAOYSA-N 0 0 385.376 3.463 20 5 GGBDRN O=C(c1cccnc1)N1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000156880276 1423879739 /nfs/dbraw/zinc/87/97/39/1423879739.db2.gz 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O=C(N[C@H]1CCN(c2ccccc2Cl)C1=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000156944374 1423890814 /nfs/dbraw/zinc/89/08/14/1423890814.db2.gz LSXZABBIGBGUNM-ZDUSSCGKSA-N 0 0 394.214 3.437 20 5 GGBDRN Cc1ccc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])c(O[C@H]2CCOC2)c1 ZINC000156947215 1423891407 /nfs/dbraw/zinc/89/14/07/1423891407.db2.gz KHVGPOMFGCFULD-KRWDZBQOSA-N 0 0 399.447 3.189 20 5 GGBDRN Cc1ccc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])c(O[C@@H]2CCOC2)c1 ZINC000156947068 1423891504 /nfs/dbraw/zinc/89/15/04/1423891504.db2.gz KHVGPOMFGCFULD-QGZVFWFLSA-N 0 0 399.447 3.189 20 5 GGBDRN CCn1c(SCc2nc([C@H](C)OC)no2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000156950781 1423891870 /nfs/dbraw/zinc/89/18/70/1423891870.db2.gz IHZKTMWPZQEAIF-JTQLQIEISA-N 0 0 390.425 3.256 20 5 GGBDRN CCn1c(S[C@@H](C)C(=O)N(C)C(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000156949660 1423891909 /nfs/dbraw/zinc/89/19/09/1423891909.db2.gz DHBMNPPGYQNBCY-LBPRGKRZSA-N 0 0 377.470 3.221 20 5 GGBDRN CCn1c(S[C@H](C)C(=O)N(C)C(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000156949810 1423891990 /nfs/dbraw/zinc/89/19/90/1423891990.db2.gz DHBMNPPGYQNBCY-GFCCVEGCSA-N 0 0 377.470 3.221 20 5 GGBDRN Cc1noc(C)c1CSCC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000156957521 1423893225 /nfs/dbraw/zinc/89/32/25/1423893225.db2.gz QTFFOHZOHUSLFS-UHFFFAOYSA-N 0 0 392.481 3.360 20 5 GGBDRN Nc1c(C(=O)Nc2cnn(-c3ncc(Cl)cc3Cl)c2)cccc1[N+](=O)[O-] ZINC000156973002 1423895726 /nfs/dbraw/zinc/89/57/26/1423895726.db2.gz KSPJKBHOZOHYKB-UHFFFAOYSA-N 0 0 393.190 3.317 20 5 GGBDRN CC(C)Oc1cccc(CN(C)S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c1 ZINC000156979359 1423896661 /nfs/dbraw/zinc/89/66/61/1423896661.db2.gz ZQXSXNDCWXPSON-UHFFFAOYSA-N 0 0 382.413 3.342 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc(-c2ccco2)nc2ccccc21 ZINC000156998558 1423899510 /nfs/dbraw/zinc/89/95/10/1423899510.db2.gz WCLAPKUEYWCKPF-UHFFFAOYSA-N 0 0 377.360 3.030 20 5 GGBDRN CCCCCNC(=O)CSc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000157007281 1423901646 /nfs/dbraw/zinc/90/16/46/1423901646.db2.gz YHBJJDJLXLIKID-UHFFFAOYSA-N 0 0 377.470 3.272 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ccc(CN(C3CC3)[C@H]3CCS(=O)(=O)C3)o2)cc1 ZINC000157024001 1423904937 /nfs/dbraw/zinc/90/49/37/1423904937.db2.gz OZZSRKPPIGAHAQ-INIZCTEOSA-N 0 0 376.434 3.006 20 5 GGBDRN CCn1c(SCc2cccc(C(N)=O)c2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157025002 1423905572 /nfs/dbraw/zinc/90/55/72/1423905572.db2.gz YVBFJOSQBMRZDX-UHFFFAOYSA-N 0 0 383.433 3.264 20 5 GGBDRN CCn1c(SCC(=O)N2CCCC[C@@H]2C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157028845 1423906319 /nfs/dbraw/zinc/90/63/19/1423906319.db2.gz QMIHFRDFWBLIJD-ZDUSSCGKSA-N 0 0 389.481 3.366 20 5 GGBDRN CCn1c(SCC(=O)N2CCCC[C@H]2C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157028998 1423906472 /nfs/dbraw/zinc/90/64/72/1423906472.db2.gz QMIHFRDFWBLIJD-CYBMUJFWSA-N 0 0 389.481 3.366 20 5 GGBDRN O=C(CSc1nccc2ccccc21)NCCNc1ccccc1[N+](=O)[O-] ZINC000157032077 1423907381 /nfs/dbraw/zinc/90/73/81/1423907381.db2.gz TYMQHMMTKYTJIT-UHFFFAOYSA-N 0 0 382.445 3.463 20 5 GGBDRN Cc1nc(-c2ccccc2)ncc1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000157033221 1423907978 /nfs/dbraw/zinc/90/79/78/1423907978.db2.gz OVCRZOQLVRHWAJ-UHFFFAOYSA-N 0 0 377.404 3.202 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCCN(c2ccccc2)CC1 ZINC000157044734 1423909470 /nfs/dbraw/zinc/90/94/70/1423909470.db2.gz IUWASKWWTOZJIK-UHFFFAOYSA-N 0 0 378.432 3.358 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ccc(CN(C3CC3)[C@@H]3CCS(=O)(=O)C3)o2)c1 ZINC000157053531 1423912725 /nfs/dbraw/zinc/91/27/25/1423912725.db2.gz PBAAHCLYRCYDLQ-MRXNPFEDSA-N 0 0 376.434 3.006 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCC[C@H]2c2c(C)n[nH]c2C)cc([N+](=O)[O-])c1 ZINC000157063202 1423915317 /nfs/dbraw/zinc/91/53/17/1423915317.db2.gz NANZOPLDHJVGNP-INIZCTEOSA-N 0 0 386.408 3.089 20 5 GGBDRN COC(=O)CCc1nnc(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC000157079992 1423919809 /nfs/dbraw/zinc/91/98/09/1423919809.db2.gz JDVMBDJDIGCACK-UHFFFAOYSA-N 0 0 388.405 3.424 20 5 GGBDRN CCCCNC(=O)[C@H](C)Sc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000157082395 1423920692 /nfs/dbraw/zinc/92/06/92/1423920692.db2.gz FRSJMVQOYKTILY-LBPRGKRZSA-N 0 0 377.470 3.270 20 5 GGBDRN CCN(CC)C(=O)[C@H](C)Sc1nnc(-c2ccc([N+](=O)[O-])cc2)n1CC ZINC000157082860 1423921139 /nfs/dbraw/zinc/92/11/39/1423921139.db2.gz CHHIVINXEFUEAR-LBPRGKRZSA-N 0 0 377.470 3.222 20 5 GGBDRN CCc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1S(C)(=O)=O ZINC000157095622 1423924512 /nfs/dbraw/zinc/92/45/12/1423924512.db2.gz ATEYZEATDOZPAM-UHFFFAOYSA-N 0 0 384.360 3.091 20 5 GGBDRN COC(=O)CCc1nnc(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 ZINC000157098224 1423925062 /nfs/dbraw/zinc/92/50/62/1423925062.db2.gz VXCUIFHIVKTJOD-UHFFFAOYSA-N 0 0 388.405 3.424 20 5 GGBDRN CCn1c(SCC(=O)N2CCCCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157124501 1423932009 /nfs/dbraw/zinc/93/20/09/1423932009.db2.gz WMFPIHDITLLCQO-UHFFFAOYSA-N 0 0 389.481 3.368 20 5 GGBDRN CN(C(N)=O)c1ccc(OC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000157126314 1423932067 /nfs/dbraw/zinc/93/20/67/1423932067.db2.gz OIRWBDYMPGQITC-UHFFFAOYSA-N 0 0 383.282 3.348 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000157136809 1423934521 /nfs/dbraw/zinc/93/45/21/1423934521.db2.gz GHUSMRKJMZLNSO-CQSZACIVSA-N 0 0 383.832 3.281 20 5 GGBDRN CCn1c(S[C@@H](C)C(=O)NCC(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157141561 1423935498 /nfs/dbraw/zinc/93/54/98/1423935498.db2.gz CGCWVCNHUWIPFV-LBPRGKRZSA-N 0 0 377.470 3.126 20 5 GGBDRN CCn1c(SCC(=O)N[C@H](C)C(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157145328 1423936496 /nfs/dbraw/zinc/93/64/96/1423936496.db2.gz BFGJTCNMNJDHQQ-GFCCVEGCSA-N 0 0 377.470 3.126 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000157160761 1423941236 /nfs/dbraw/zinc/94/12/36/1423941236.db2.gz CNLFLLVILUUBDN-SMDDNHRTSA-N 0 0 391.786 3.307 20 5 GGBDRN CC(C)Cn1ncc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C1CC1 ZINC000157175142 1423944890 /nfs/dbraw/zinc/94/48/90/1423944890.db2.gz MSCCJTYJUHDHSB-OAHLLOKOSA-N 0 0 398.467 3.046 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000157187562 1423949118 /nfs/dbraw/zinc/94/91/18/1423949118.db2.gz KQYPBNYSUIJEPA-UHFFFAOYSA-N 0 0 393.359 3.282 20 5 GGBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1cccc(-n2cccn2)c1 ZINC000157222739 1423959561 /nfs/dbraw/zinc/95/95/61/1423959561.db2.gz ZOEXZKYDAFXOGE-RVDMUPIBSA-N 0 0 385.383 3.435 20 5 GGBDRN C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccccc1Oc1ccccc1 ZINC000157236835 1423963209 /nfs/dbraw/zinc/96/32/09/1423963209.db2.gz SFOXHGBPLFLNJB-OAHLLOKOSA-N 0 0 393.399 3.426 20 5 GGBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nc2ccc(Cl)cn2n1 ZINC000157241864 1423964220 /nfs/dbraw/zinc/96/42/20/1423964220.db2.gz ZLGJRBDIXOJNJS-MRVPVSSYSA-N 0 0 396.190 3.350 20 5 GGBDRN Cc1c(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1F ZINC000157266435 1423970232 /nfs/dbraw/zinc/97/02/32/1423970232.db2.gz BRWULZIGWIKHSP-UHFFFAOYSA-N 0 0 398.398 3.462 20 5 GGBDRN Cc1ccc2c(c1)O[C@H](C)CN2S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000157293176 1423976729 /nfs/dbraw/zinc/97/67/29/1423976729.db2.gz WQEALBKXNYNWMS-CQSZACIVSA-N 0 0 376.434 3.063 20 5 GGBDRN CCCC1(CNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)CCC1 ZINC000157358557 1423994237 /nfs/dbraw/zinc/99/42/37/1423994237.db2.gz CZQUZGCLOXBBOT-CYBMUJFWSA-N 0 0 379.482 3.348 20 5 GGBDRN O=C(N[C@H]1CCC[C@@H]1OCc1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000157374456 1423996986 /nfs/dbraw/zinc/99/69/86/1423996986.db2.gz IGGRELUEFNDDDJ-ROUUACIJSA-N 0 0 380.404 3.339 20 5 GGBDRN Cc1ccc(CNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(OCC2CC2)c1 ZINC000157375158 1423997258 /nfs/dbraw/zinc/99/72/58/1423997258.db2.gz WXAOPBQHMRDRAL-UHFFFAOYSA-N 0 0 397.431 3.255 20 5 GGBDRN Cc1c(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1 ZINC000157376534 1423998166 /nfs/dbraw/zinc/99/81/66/1423998166.db2.gz KJFXEEBXEKOAGB-UHFFFAOYSA-N 0 0 386.433 3.073 20 5 GGBDRN O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000180010654 1429689840 /nfs/dbraw/zinc/68/98/40/1429689840.db2.gz CTTFKQRQMVWCRE-CQSZACIVSA-N 0 0 387.823 3.027 20 5 GGBDRN COc1ccc(COCCNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000180010720 1429689895 /nfs/dbraw/zinc/68/98/95/1429689895.db2.gz SIHPCSUSRPCEER-UHFFFAOYSA-N 0 0 385.420 3.124 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ncccc1F ZINC000157499768 1424024275 /nfs/dbraw/zinc/02/42/75/1424024275.db2.gz YFKGEBTUCIXMIQ-UHFFFAOYSA-N 0 0 386.305 3.266 20 5 GGBDRN O=C(Nc1ccc(F)cc1NC1CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000157504008 1424025301 /nfs/dbraw/zinc/02/53/01/1424025301.db2.gz SDINQDNEIFKEGQ-UHFFFAOYSA-N 0 0 382.351 3.402 20 5 GGBDRN COc1ccc(COCCNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 ZINC000180016794 1429693296 /nfs/dbraw/zinc/69/32/96/1429693296.db2.gz PAJPVGDSTXFVPH-UHFFFAOYSA-N 0 0 399.447 3.468 20 5 GGBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])o1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000157623740 1424051032 /nfs/dbraw/zinc/05/10/32/1424051032.db2.gz SLDPXJBEKFHCRD-UHFFFAOYSA-N 0 0 385.420 3.345 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(C(=O)N(C)C)CCCC1 ZINC000157674724 1424062461 /nfs/dbraw/zinc/06/24/61/1424062461.db2.gz NQFLTLODKGWAJO-UHFFFAOYSA-N 0 0 379.482 3.085 20 5 GGBDRN CC(C)C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cc[nH]n1 ZINC000157681929 1424064165 /nfs/dbraw/zinc/06/41/65/1424064165.db2.gz PXRSANTWOXFAQV-CYBMUJFWSA-N 0 0 394.819 3.146 20 5 GGBDRN O=[N+]([O-])c1ccc(OCCCN2CCOC[C@@H]2C[C@@H](O)c2ccccc2)cc1 ZINC000157693876 1424066454 /nfs/dbraw/zinc/06/64/54/1424066454.db2.gz SXWBACVEFZEDKI-PZJWPPBQSA-N 0 0 386.448 3.188 20 5 GGBDRN Cc1ocnc1CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000157701304 1424067684 /nfs/dbraw/zinc/06/76/84/1424067684.db2.gz YXDZPPSVORPPHN-GFCCVEGCSA-N 0 0 381.392 3.389 20 5 GGBDRN CN(C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[C@@H]1CCc2ccccc2C1 ZINC000157722841 1424074522 /nfs/dbraw/zinc/07/45/22/1424074522.db2.gz PPYDABRCRAYSFP-QGZVFWFLSA-N 0 0 376.416 3.410 20 5 GGBDRN CCc1cc(N2CCC(Cn3ccnn3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000157730145 1424075951 /nfs/dbraw/zinc/07/59/51/1424075951.db2.gz XMNYBAIKAQQLKD-UHFFFAOYSA-N 0 0 393.451 3.122 20 5 GGBDRN CN(CCc1nccs1)c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000157796669 1424090588 /nfs/dbraw/zinc/09/05/88/1424090588.db2.gz RDHJGUVFYNGSPN-UHFFFAOYSA-N 0 0 395.384 3.024 20 5 GGBDRN COc1ccc(NC(=O)CN2CC[C@@H](c3ccccc3OC)C2)c([N+](=O)[O-])c1 ZINC000157838641 1424100138 /nfs/dbraw/zinc/10/01/38/1424100138.db2.gz BZPFPJVORRBFDA-CQSZACIVSA-N 0 0 385.420 3.040 20 5 GGBDRN C[C@@H](CC(=O)OCc1ccccc1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000157843152 1424102458 /nfs/dbraw/zinc/10/24/58/1424102458.db2.gz FYWAXJTWJUBWKI-ZDUSSCGKSA-N 0 0 383.404 3.413 20 5 GGBDRN Cc1ccccc1CC(=O)N1CCN(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000157850344 1424103989 /nfs/dbraw/zinc/10/39/89/1424103989.db2.gz ZEFPYVMQEWXYOV-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(N3CCO[C@@]4(CCc5ccccc54)C3)cc2N1 ZINC000157867698 1424108113 /nfs/dbraw/zinc/10/81/13/1424108113.db2.gz PXHDXEWOUZJZJW-NRFANRHFSA-N 0 0 379.416 3.158 20 5 GGBDRN CC(C)NC(=O)c1ccc(N2CCO[C@]3(CCc4ccccc43)C2)c([N+](=O)[O-])c1 ZINC000157904518 1424116609 /nfs/dbraw/zinc/11/66/09/1424116609.db2.gz LMZZPJFWCFDXDB-JOCHJYFZSA-N 0 0 395.459 3.411 20 5 GGBDRN COc1cccc(COCCNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1 ZINC000157913596 1424118528 /nfs/dbraw/zinc/11/85/28/1424118528.db2.gz CWMNTFDTIPUTBK-UHFFFAOYSA-N 0 0 385.420 3.124 20 5 GGBDRN Cc1ccccc1CC(=O)N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000157913177 1424118533 /nfs/dbraw/zinc/11/85/33/1424118533.db2.gz SOXNWPQQRKEHHQ-UHFFFAOYSA-N 0 0 396.447 3.130 20 5 GGBDRN CS(=O)(=O)c1ccccc1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000157935217 1424123190 /nfs/dbraw/zinc/12/31/90/1424123190.db2.gz NBWHLCDJJCOKJA-UHFFFAOYSA-N 0 0 391.449 3.143 20 5 GGBDRN CC[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000157942965 1424125247 /nfs/dbraw/zinc/12/52/47/1424125247.db2.gz ZLUUMXWRRPNLHN-GHMZBOCLSA-N 0 0 385.367 3.220 20 5 GGBDRN Cc1cnc(OCC(=O)Nc2ncc(C(F)(F)F)cc2Cl)c([N+](=O)[O-])c1 ZINC000157951722 1424127930 /nfs/dbraw/zinc/12/79/30/1424127930.db2.gz ODDLOOIBKTVHGH-UHFFFAOYSA-N 0 0 390.705 3.383 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(OCCO)cc1 ZINC000157964977 1424130310 /nfs/dbraw/zinc/13/03/10/1424130310.db2.gz QMXNXKIGVLKLSJ-UHFFFAOYSA-N 0 0 388.423 3.165 20 5 GGBDRN CCCOc1ccc2c(c1)CCN(S(=O)(=O)c1cccc(F)c1[N+](=O)[O-])C2 ZINC000157967405 1424130690 /nfs/dbraw/zinc/13/06/90/1424130690.db2.gz CBQBDDROAKHJHJ-UHFFFAOYSA-N 0 0 394.424 3.270 20 5 GGBDRN CCCOc1ccc2c(c1)CCN(S(=O)(=O)c1ccccc1[N+](=O)[O-])C2 ZINC000157994408 1424136830 /nfs/dbraw/zinc/13/68/30/1424136830.db2.gz MBFFNEVEXWIAKD-UHFFFAOYSA-N 0 0 376.434 3.131 20 5 GGBDRN CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158013175 1424139506 /nfs/dbraw/zinc/13/95/06/1424139506.db2.gz XKGGDWQGCOKWMQ-KRWDZBQOSA-N 0 0 391.374 3.290 20 5 GGBDRN CCCCn1ccnc1-c1cccc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)c1 ZINC000158025300 1424142534 /nfs/dbraw/zinc/14/25/34/1424142534.db2.gz DRFLVRCMOBMUJB-UHFFFAOYSA-N 0 0 382.424 3.402 20 5 GGBDRN CC[C@@H](NC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000158049343 1424148201 /nfs/dbraw/zinc/14/82/01/1424148201.db2.gz ALKJBJYUVYTRHJ-OAHLLOKOSA-N 0 0 377.347 3.387 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1c(-c2cccs2)nc2ccccn21 ZINC000158052545 1424149682 /nfs/dbraw/zinc/14/96/82/1424149682.db2.gz HGNDMIAHWYOLKD-UHFFFAOYSA-N 0 0 382.405 3.115 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)C[C@H](O)c1cccs1 ZINC000158058494 1424152214 /nfs/dbraw/zinc/15/22/14/1424152214.db2.gz LNADWDCAUNKDKN-RISCZKNCSA-N 0 0 384.479 3.009 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C)C[C@H](O)c1cccs1 ZINC000158058340 1424152355 /nfs/dbraw/zinc/15/23/55/1424152355.db2.gz LNADWDCAUNKDKN-FZMZJTMJSA-N 0 0 384.479 3.009 20 5 GGBDRN CN(C(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000158064646 1424154060 /nfs/dbraw/zinc/15/40/60/1424154060.db2.gz KGLHDCPSAIRRDD-UHFFFAOYSA-N 0 0 391.309 3.471 20 5 GGBDRN C[C@@H](C[C@H](O)c1cccs1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000158087562 1424163488 /nfs/dbraw/zinc/16/34/88/1424163488.db2.gz APBADXAEILOLJU-CABZTGNLSA-N 0 0 390.870 3.100 20 5 GGBDRN CCOc1ccccc1[C@@H](CC(=O)N(C)c1cccc([N+](=O)[O-])c1)NC(C)=O ZINC000158110047 1424169151 /nfs/dbraw/zinc/16/91/51/1424169151.db2.gz NLHMSLZDLRMKCP-GOSISDBHSA-N 0 0 385.420 3.224 20 5 GGBDRN CSc1ccc(C(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000180030494 1429703319 /nfs/dbraw/zinc/70/33/19/1429703319.db2.gz NLCMUNFHMQRQKE-HNNXBMFYSA-N 0 0 399.472 3.095 20 5 GGBDRN CC[C@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])c1ccncc1 ZINC000158136096 1424176320 /nfs/dbraw/zinc/17/63/20/1424176320.db2.gz QIYKVEUOXUUXKG-LBPRGKRZSA-N 0 0 381.335 3.481 20 5 GGBDRN CC(=O)N1CCN(c2ccc(C(=O)OCC3(C)CCCC3)cc2[N+](=O)[O-])CC1 ZINC000180032125 1429703981 /nfs/dbraw/zinc/70/39/81/1429703981.db2.gz NMKLGXCIWIJZNC-UHFFFAOYSA-N 0 0 389.452 3.000 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000158156668 1424181545 /nfs/dbraw/zinc/18/15/45/1424181545.db2.gz YFXVCIOGQLKDRD-INIZCTEOSA-N 0 0 375.450 3.168 20 5 GGBDRN COc1ccc([C@@H]2[C@H](C(=O)N(C)c3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1 ZINC000158158575 1424182442 /nfs/dbraw/zinc/18/24/42/1424182442.db2.gz DDCHQVLHIYAKDK-UYAOXDASSA-N 0 0 397.431 3.176 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCCc2cccc(F)c21 ZINC000158179052 1424187373 /nfs/dbraw/zinc/18/73/73/1424187373.db2.gz RLOAJYCSHBZLFK-UHFFFAOYSA-N 0 0 380.379 3.368 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000158190966 1424190589 /nfs/dbraw/zinc/19/05/89/1424190589.db2.gz FIGOUFPURZKYDU-SKDRFNHKSA-N 0 0 390.870 3.100 20 5 GGBDRN CC[C@H](NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1)c1ccncc1 ZINC000158213233 1424197171 /nfs/dbraw/zinc/19/71/71/1424197171.db2.gz UNSXOWIQPVSQBJ-HNNXBMFYSA-N 0 0 375.450 3.499 20 5 GGBDRN C[C@H]1CN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2ccccc2NC1=O ZINC000158233055 1424201845 /nfs/dbraw/zinc/20/18/45/1424201845.db2.gz WBONUKGULWCSGI-ZDUSSCGKSA-N 0 0 391.387 3.016 20 5 GGBDRN Cc1nn(C)c2ncc(NC(=O)NCCCCc3ccc([N+](=O)[O-])cc3)cc12 ZINC000158232198 1424202322 /nfs/dbraw/zinc/20/23/22/1424202322.db2.gz DQYZZWVPOGFKGV-UHFFFAOYSA-N 0 0 382.424 3.329 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H](C)C[C@@H](O)c2cccs2)c1C ZINC000158236883 1424203443 /nfs/dbraw/zinc/20/34/43/1424203443.db2.gz HKCJBPAFVYRZIQ-SMDDNHRTSA-N 0 0 384.479 3.064 20 5 GGBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCOc2c(Cl)cccc21 ZINC000158241397 1424204985 /nfs/dbraw/zinc/20/49/85/1424204985.db2.gz BDMCMPUIVDJLPU-UHFFFAOYSA-N 0 0 384.779 3.473 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000158253643 1424209670 /nfs/dbraw/zinc/20/96/70/1424209670.db2.gz GWBJCHLLQANIRD-LJQANCHMSA-N 0 0 395.415 3.394 20 5 GGBDRN CC1(C)C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2ccccc21 ZINC000158259741 1424211741 /nfs/dbraw/zinc/21/17/41/1424211741.db2.gz ZXIFJWZXTXUPFD-KRWDZBQOSA-N 0 0 388.445 3.151 20 5 GGBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCNC(=O)c1occc1C ZINC000158282938 1424216809 /nfs/dbraw/zinc/21/68/09/1424216809.db2.gz LXZMLZLAFMZZEX-UHFFFAOYSA-N 0 0 391.449 3.158 20 5 GGBDRN Cc1cccc(Cl)c1NC(=O)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000158298595 1424220559 /nfs/dbraw/zinc/22/05/59/1424220559.db2.gz PSUSOTRVKPFPKW-UHFFFAOYSA-N 0 0 388.767 3.012 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)C[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000158301043 1424221043 /nfs/dbraw/zinc/22/10/43/1424221043.db2.gz YXXYQGRZIMTGKY-BMLIUANNSA-N 0 0 391.355 3.193 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)c1[N+](=O)[O-] ZINC000158303990 1424221741 /nfs/dbraw/zinc/22/17/41/1424221741.db2.gz YVCXQSYVTRQTMV-UHFFFAOYSA-N 0 0 381.396 3.185 20 5 GGBDRN O=C(Nc1cccnc1N1CCOCC1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000158322164 1424226117 /nfs/dbraw/zinc/22/61/17/1424226117.db2.gz FKKDXEZTJRFNQR-UHFFFAOYSA-N 0 0 397.435 3.023 20 5 GGBDRN CN1CCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2cc(F)ccc21 ZINC000158348414 1424233196 /nfs/dbraw/zinc/23/31/96/1424233196.db2.gz BCHOSHARWUMVSC-UHFFFAOYSA-N 0 0 395.394 3.406 20 5 GGBDRN CC(C)[C@@H](C(=O)N(C)c1cccc([N+](=O)[O-])c1)S(=O)(=O)C1CCCCC1 ZINC000158356240 1424235610 /nfs/dbraw/zinc/23/56/10/1424235610.db2.gz HYHHXJHISXRBHY-KRWDZBQOSA-N 0 0 382.482 3.330 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC000158383599 1424241212 /nfs/dbraw/zinc/24/12/12/1424241212.db2.gz JBHGEOCTOQCXHS-CYBMUJFWSA-N 0 0 383.832 3.281 20 5 GGBDRN Cc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)nnn1-c1cccc2cccnc21 ZINC000158384075 1424241232 /nfs/dbraw/zinc/24/12/32/1424241232.db2.gz PCNKYDDDOAUXMP-UHFFFAOYSA-N 0 0 388.387 3.309 20 5 GGBDRN CCCCN1C(=O)c2ccc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)cc2C1=O ZINC000158395044 1424244341 /nfs/dbraw/zinc/24/43/41/1424244341.db2.gz HMFMUYMMICEYFL-UHFFFAOYSA-N 0 0 381.388 3.268 20 5 GGBDRN CN(C(=O)Cc1csc(NC(=O)c2ccco2)n1)c1cccc([N+](=O)[O-])c1 ZINC000158398545 1424244927 /nfs/dbraw/zinc/24/49/27/1424244927.db2.gz VNEBCPCAZUXJDC-UHFFFAOYSA-N 0 0 386.389 3.102 20 5 GGBDRN O=C(O[C@@H]([C@@H]1CCCO1)C(F)(F)F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000158412767 1424248073 /nfs/dbraw/zinc/24/80/73/1424248073.db2.gz QWGBXAHDVNAVMY-KBPBESRZSA-N 0 0 385.298 3.047 20 5 GGBDRN O=C(O[C@H]([C@@H]1CCCO1)C(F)(F)F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000158412920 1424248119 /nfs/dbraw/zinc/24/81/19/1424248119.db2.gz QWGBXAHDVNAVMY-UONOGXRCSA-N 0 0 385.298 3.047 20 5 GGBDRN COc1cc(CCNC(=O)[C@H](C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000180044551 1429711378 /nfs/dbraw/zinc/71/13/78/1429711378.db2.gz KPPJWQUVECCPQZ-OAHLLOKOSA-N 0 0 386.448 3.458 20 5 GGBDRN Cc1nn(-c2nc(C)cc(C)n2)c(C)c1CC(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158435696 1424253594 /nfs/dbraw/zinc/25/35/94/1424253594.db2.gz XZQNIAMVBXUCMJ-UHFFFAOYSA-N 0 0 394.435 3.010 20 5 GGBDRN CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158437516 1424254402 /nfs/dbraw/zinc/25/44/02/1424254402.db2.gz XDNVOBCUOBFYLP-SFHVURJKSA-N 0 0 397.431 3.261 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccn(-c3ccccc3Cl)n2)c(C)c1[N+](=O)[O-] ZINC000158446647 1424257823 /nfs/dbraw/zinc/25/78/23/1424257823.db2.gz PKTWIISJHNDVTR-UHFFFAOYSA-N 0 0 388.815 3.276 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000158446481 1424257985 /nfs/dbraw/zinc/25/79/85/1424257985.db2.gz QOPYZTFIBIIFNG-BFUOFWGJSA-N 0 0 398.394 3.162 20 5 GGBDRN CN(C(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000158463886 1424264232 /nfs/dbraw/zinc/26/42/32/1424264232.db2.gz NZFJNAKKXLCHKZ-OAHLLOKOSA-N 0 0 385.395 3.249 20 5 GGBDRN O=C(c1ccco1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000158473561 1424266792 /nfs/dbraw/zinc/26/67/92/1424266792.db2.gz UKXXFDPPTVTGKQ-UHFFFAOYSA-N 0 0 381.388 3.406 20 5 GGBDRN Cc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)nnn1-c1ccc2ncccc2c1 ZINC000158476855 1424267454 /nfs/dbraw/zinc/26/74/54/1424267454.db2.gz NZVADURFOGHTDS-UHFFFAOYSA-N 0 0 388.387 3.309 20 5 GGBDRN COc1cc(Cl)c(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1OC ZINC000158502576 1424274016 /nfs/dbraw/zinc/27/40/16/1424274016.db2.gz BMIFUZCSZLVFKI-UHFFFAOYSA-N 0 0 376.796 3.464 20 5 GGBDRN CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H](CCO)c1ccccc1 ZINC000158517331 1424277348 /nfs/dbraw/zinc/27/73/48/1424277348.db2.gz WMNGVTATMOREQG-LJQANCHMSA-N 0 0 397.475 3.393 20 5 GGBDRN CCN(C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O)[C@@H](C)c1ccc(F)cc1 ZINC000158521624 1424278630 /nfs/dbraw/zinc/27/86/30/1424278630.db2.gz QXZAMMKFLMPPDX-NSHDSACASA-N 0 0 381.791 3.159 20 5 GGBDRN C[C@H]1CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c2cccnc2O1 ZINC000158537840 1424282925 /nfs/dbraw/zinc/28/29/25/1424282925.db2.gz AKACYCDOPFLZIN-NSHDSACASA-N 0 0 377.784 3.226 20 5 GGBDRN C[C@@H]1CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c2cccnc2O1 ZINC000158537690 1424283032 /nfs/dbraw/zinc/28/30/32/1424283032.db2.gz AKACYCDOPFLZIN-LLVKDONJSA-N 0 0 377.784 3.226 20 5 GGBDRN O=C(Cn1cc(Cl)cc([N+](=O)[O-])c1=O)N[C@H](c1ccccc1)C1CCCC1 ZINC000158562345 1424289744 /nfs/dbraw/zinc/28/97/44/1424289744.db2.gz OPRBVYRUSOIOAV-GOSISDBHSA-N 0 0 389.839 3.458 20 5 GGBDRN O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000158565502 1424291188 /nfs/dbraw/zinc/29/11/88/1424291188.db2.gz AQVNJMKZPRSAPC-LIRRHRJNSA-N 0 0 393.399 3.086 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCN(Cc3ccccc3Cl)CC2)c1 ZINC000158569045 1424291582 /nfs/dbraw/zinc/29/15/82/1424291582.db2.gz VKXGIJPRKGHVNM-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3cn(-c4ccc(Cl)cc4)nn3)n2)c1 ZINC000158576325 1424294370 /nfs/dbraw/zinc/29/43/70/1424294370.db2.gz HBERCCUINWMUSE-UHFFFAOYSA-N 0 0 381.783 3.136 20 5 GGBDRN Cc1cc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2Cl)cc([N+](=O)[O-])c1F ZINC000180051704 1429715244 /nfs/dbraw/zinc/71/52/44/1429715244.db2.gz 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O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2ccccc2)nn1 ZINC000158727009 1424328226 /nfs/dbraw/zinc/32/82/26/1424328226.db2.gz HYFBLVWLOLJDDI-UHFFFAOYSA-N 0 0 378.392 3.285 20 5 GGBDRN O=C(O[C@H]([C@@H]1CCCO1)C(F)(F)F)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000158739656 1424331581 /nfs/dbraw/zinc/33/15/81/1424331581.db2.gz MCYSXEIXJVYGAE-UONOGXRCSA-N 0 0 385.298 3.047 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)c1[N+](=O)[O-] ZINC000158749656 1424333941 /nfs/dbraw/zinc/33/39/41/1424333941.db2.gz DRWQRFAEEIERMU-UHFFFAOYSA-N 0 0 380.408 3.027 20 5 GGBDRN COc1ccc(CCCN(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)cc1 ZINC000180060273 1429718232 /nfs/dbraw/zinc/71/82/32/1429718232.db2.gz DMCUJUJQDJPQNS-UHFFFAOYSA-N 0 0 396.440 3.304 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(CCc3ccccc32)C1 ZINC000158760956 1424336361 /nfs/dbraw/zinc/33/63/61/1424336361.db2.gz RCMMHJHWGNGSAF-YCRPNKLZSA-N 0 0 381.432 3.096 20 5 GGBDRN CCCC[C@@H](NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CCC1 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O=[N+]([O-])c1ccc(-c2ncn(C[C@@H](O)Cc3ccc(C(F)(F)F)cc3)n2)cc1 ZINC000159041316 1424402805 /nfs/dbraw/zinc/40/28/05/1424402805.db2.gz YBKIWVITYVNKLI-INIZCTEOSA-N 0 0 392.337 3.476 20 5 GGBDRN O=C(CCN1CCO[C@@]2(CCc3ccccc32)C1)Nc1ccccc1[N+](=O)[O-] ZINC000159067490 1424409621 /nfs/dbraw/zinc/40/96/21/1424409621.db2.gz CLARIRHMQWCEAH-NRFANRHFSA-N 0 0 381.432 3.097 20 5 GGBDRN O=C(O[C@H]([C@H]1CCCO1)C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000159067670 1424409628 /nfs/dbraw/zinc/40/96/28/1424409628.db2.gz BRUSBFUPAKEQGM-HUUCEWRRSA-N 0 0 388.342 3.462 20 5 GGBDRN O=C(CCN1CCO[C@]2(CCc3ccccc32)C1)Nc1ccccc1[N+](=O)[O-] ZINC000159067351 1424409657 /nfs/dbraw/zinc/40/96/57/1424409657.db2.gz CLARIRHMQWCEAH-OAQYLSRUSA-N 0 0 381.432 3.097 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SC(F)(F)F ZINC000159070216 1424410525 /nfs/dbraw/zinc/41/05/25/1424410525.db2.gz HOWALPLNXNKBIV-UHFFFAOYSA-N 0 0 399.350 3.462 20 5 GGBDRN O=[N+]([O-])c1cn(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)nc1-c1ccncc1 ZINC000159145871 1424428519 /nfs/dbraw/zinc/42/85/19/1424428519.db2.gz DFLRVKPHBLNION-OAHLLOKOSA-N 0 0 392.337 3.476 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000159162186 1424431919 /nfs/dbraw/zinc/43/19/19/1424431919.db2.gz MFKONQQTBGQMRZ-QFIPXVFZSA-N 0 0 389.411 3.457 20 5 GGBDRN CC(C)Cn1c(SCCn2cc([N+](=O)[O-])ccc2=O)nnc1-c1ccco1 ZINC000159165631 1424432927 /nfs/dbraw/zinc/43/29/27/1424432927.db2.gz RLMZSBXIHRRMSC-UHFFFAOYSA-N 0 0 389.437 3.056 20 5 GGBDRN COc1ccc(-c2n[nH]cc2CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000159175054 1424435459 /nfs/dbraw/zinc/43/54/59/1424435459.db2.gz YFPACWOYBGUAOX-UHFFFAOYSA-N 0 0 393.447 3.316 20 5 GGBDRN CC1(c2ccccc2)CCN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000159179631 1424436442 /nfs/dbraw/zinc/43/64/42/1424436442.db2.gz FAQVQEGDUSQYHH-UHFFFAOYSA-N 0 0 378.425 3.476 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)cc([N+](=O)[O-])c1F ZINC000180078116 1429727044 /nfs/dbraw/zinc/72/70/44/1429727044.db2.gz SDPJVFXRHLGJCB-MLGOLLRUSA-N 0 0 388.461 3.162 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)cc([N+](=O)[O-])c1F ZINC000180078061 1429727077 /nfs/dbraw/zinc/72/70/77/1429727077.db2.gz SDPJVFXRHLGJCB-LRDDRELGSA-N 0 0 388.461 3.162 20 5 GGBDRN Cc1cc(S(=O)(=O)NC2(c3nccs3)CCCC2)cc([N+](=O)[O-])c1F ZINC000180077193 1429727314 /nfs/dbraw/zinc/72/73/14/1429727314.db2.gz MWXIINDBZRCVHW-UHFFFAOYSA-N 0 0 385.442 3.247 20 5 GGBDRN Cc1c(CS(=O)(=O)[C@H](C)c2cn(-c3ccccc3)nn2)cccc1[N+](=O)[O-] ZINC000159259547 1424462934 /nfs/dbraw/zinc/46/29/34/1424462934.db2.gz ZLFXXBACQGYQOT-CQSZACIVSA-N 0 0 386.433 3.160 20 5 GGBDRN CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)Oc1cccc([N+](=O)[O-])c1 ZINC000159264321 1424464143 /nfs/dbraw/zinc/46/41/43/1424464143.db2.gz DRAXIIDWAGWHIV-KUHUBIRLSA-N 0 0 382.416 3.500 20 5 GGBDRN C[C@H](O)C[C@@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000159270648 1424466726 /nfs/dbraw/zinc/46/67/26/1424466726.db2.gz MJGWOPGAFUNFDC-WMZOPIPTSA-N 0 0 385.464 3.458 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2ncn(CN3CCCc4c([N+](=O)[O-])cccc43)n2)cc1 ZINC000159274037 1424467751 /nfs/dbraw/zinc/46/77/51/1424467751.db2.gz CNIADOXPRBWOMS-UHFFFAOYSA-N 0 0 380.364 3.172 20 5 GGBDRN C[C@H](O)C[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000159304403 1424478692 /nfs/dbraw/zinc/47/86/92/1424478692.db2.gz LGQBBQUTALMGBY-DOTOQJQBSA-N 0 0 394.431 3.065 20 5 GGBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1cccn(CC(F)(F)F)c1=O ZINC000159328180 1424486886 /nfs/dbraw/zinc/48/68/86/1424486886.db2.gz JNQNNRXFZPTKFQ-UHFFFAOYSA-N 0 0 387.339 3.050 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000159333952 1424488479 /nfs/dbraw/zinc/48/84/79/1424488479.db2.gz GBRJOKWORVKFDD-AUUYWEPGSA-N 0 0 380.404 3.023 20 5 GGBDRN C[C@H](O)C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000159343639 1424490533 /nfs/dbraw/zinc/49/05/33/1424490533.db2.gz KOHYCMKMWWDYJV-XJKSGUPXSA-N 0 0 376.840 3.462 20 5 GGBDRN 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ZINC000159387522 1424498738 /nfs/dbraw/zinc/49/87/38/1424498738.db2.gz ODCZILOKHPGXHA-UHFFFAOYSA-N 0 0 387.367 3.422 20 5 GGBDRN Cc1cccc(Oc2ccccc2NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c1 ZINC000159403717 1424499512 /nfs/dbraw/zinc/49/95/12/1424499512.db2.gz SNGORMIDFIMUDT-UHFFFAOYSA-N 0 0 379.372 3.496 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCC2(c3ccc(F)cc3)CCC2)cccc1[N+](=O)[O-] ZINC000159397600 1424499820 /nfs/dbraw/zinc/49/98/20/1424499820.db2.gz COAPCPWUPDFTIA-UHFFFAOYSA-N 0 0 385.395 3.219 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCO[C@]2(CCc3ccccc32)C1 ZINC000159453332 1424503563 /nfs/dbraw/zinc/50/35/63/1424503563.db2.gz QDWVXNSPADSWHV-OAQYLSRUSA-N 0 0 381.432 3.016 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCO[C@@]2(CCc3ccccc32)C1 ZINC000159453442 1424503758 /nfs/dbraw/zinc/50/37/58/1424503758.db2.gz QDWVXNSPADSWHV-NRFANRHFSA-N 0 0 381.432 3.016 20 5 GGBDRN Cc1cc2nnc(SCCn3cc([N+](=O)[O-])ccc3=O)n2c2ccccc12 ZINC000159498772 1424507933 /nfs/dbraw/zinc/50/79/33/1424507933.db2.gz 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1424599009 /nfs/dbraw/zinc/59/90/09/1424599009.db2.gz UULLVQOEUZLSFX-UHFFFAOYSA-N 0 0 399.451 3.167 20 5 GGBDRN CCC(=O)N1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000160374490 1424599070 /nfs/dbraw/zinc/59/90/70/1424599070.db2.gz IETUXHPTDDMZII-UHFFFAOYSA-N 0 0 388.346 3.090 20 5 GGBDRN COc1ccc([C@H](C)N(C)S(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000160404462 1424602282 /nfs/dbraw/zinc/60/22/82/1424602282.db2.gz YMXFNHHCXUIIJO-AWEZNQCLSA-N 0 0 378.450 3.169 20 5 GGBDRN Cc1ccc(-c2nc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)n[nH]2)o1 ZINC000160419711 1424603314 /nfs/dbraw/zinc/60/33/14/1424603314.db2.gz CFYIIQHUWCZNGW-UHFFFAOYSA-N 0 0 396.407 3.136 20 5 GGBDRN CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000160469136 1424605759 /nfs/dbraw/zinc/60/57/59/1424605759.db2.gz SFDCIFUUHVNFLR-MGPUTAFESA-N 0 0 395.459 3.211 20 5 GGBDRN Cc1c(CC(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cccc1[N+](=O)[O-] ZINC000160493647 1424608246 /nfs/dbraw/zinc/60/82/46/1424608246.db2.gz 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COc1ccccc1[C@H]1CCN(S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1 ZINC000160551497 1424613151 /nfs/dbraw/zinc/61/31/51/1424613151.db2.gz KBKDQUMIQIILSR-HNNXBMFYSA-N 0 0 390.461 3.398 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CCOC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000160560575 1424614336 /nfs/dbraw/zinc/61/43/36/1424614336.db2.gz FKUAQFDCBCGAKG-AWEZNQCLSA-N 0 0 377.397 3.423 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000160579653 1424614993 /nfs/dbraw/zinc/61/49/93/1424614993.db2.gz YZVKLEUFNMMUPO-OAHLLOKOSA-N 0 0 396.465 3.433 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000160585973 1424616611 /nfs/dbraw/zinc/61/66/11/1424616611.db2.gz WISNNNBUFSODCM-FQEVSTJZSA-N 0 0 391.468 3.291 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc([N+](=O)[O-])c1F ZINC000180105588 1429740096 /nfs/dbraw/zinc/74/00/96/1429740096.db2.gz PXDPVANGEGZBGI-NSHDSACASA-N 0 0 397.384 3.298 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCCc1csc(C(C)(C)C)n1 ZINC000160610230 1424618771 /nfs/dbraw/zinc/61/87/71/1424618771.db2.gz FILHEKABAGYHEP-UHFFFAOYSA-N 0 0 376.482 3.387 20 5 GGBDRN O=C(Nc1cccc(C[S@@](=O)C2CCCCC2)c1)c1n[nH]cc1[N+](=O)[O-] ZINC000160637399 1424621389 /nfs/dbraw/zinc/62/13/89/1424621389.db2.gz XQDBZNBYYMOYFA-SANMLTNESA-N 0 0 376.438 3.152 20 5 GGBDRN CC(C)CSCCCNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000160653870 1424622932 /nfs/dbraw/zinc/62/29/32/1424622932.db2.gz DMOMANJFENIIOU-CYBMUJFWSA-N 0 0 399.538 3.156 20 5 GGBDRN CCN(CC(=O)Nc1ccc2c(c1)OCCO2)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000160670154 1424624294 /nfs/dbraw/zinc/62/42/94/1424624294.db2.gz GOYUSBWHZMPQGF-UHFFFAOYSA-N 0 0 385.420 3.135 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OCc1nc(-c2ccsc2)no1 ZINC000160669829 1424624603 /nfs/dbraw/zinc/62/46/03/1424624603.db2.gz HNGODUNWAZMQLD-UHFFFAOYSA-N 0 0 384.373 3.474 20 5 GGBDRN C[C@H]1Cc2ccccc2N1C(=O)COC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000160671478 1424625396 /nfs/dbraw/zinc/62/53/96/1424625396.db2.gz LYWKNZCILIBPFE-ZDUSSCGKSA-N 0 0 393.399 3.140 20 5 GGBDRN CC1(C)C[C@@H](Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)CCO1 ZINC000160672705 1424625706 /nfs/dbraw/zinc/62/57/06/1424625706.db2.gz VBFHXVIRVZWOKH-NSHDSACASA-N 0 0 378.816 3.164 20 5 GGBDRN CS(=O)(=O)Cc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1F ZINC000160680226 1424626178 /nfs/dbraw/zinc/62/61/78/1424626178.db2.gz WEMWBNNSZXLQDC-UHFFFAOYSA-N 0 0 386.788 3.184 20 5 GGBDRN COC(=O)c1cc(-c2csc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])n2)c[nH]1 ZINC000160744101 1424631443 /nfs/dbraw/zinc/63/14/43/1424631443.db2.gz BBHUUBXHVGRDCB-UHFFFAOYSA-N 0 0 390.352 3.224 20 5 GGBDRN CCCOc1ccc(CNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000160778015 1424634532 /nfs/dbraw/zinc/63/45/32/1424634532.db2.gz FTGUXAIQVHGIFX-UHFFFAOYSA-N 0 0 378.450 3.046 20 5 GGBDRN CCc1ncsc1C(=O)OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000160805810 1424636042 /nfs/dbraw/zinc/63/60/42/1424636042.db2.gz OXIBQEJAPGVVTP-LBPRGKRZSA-N 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COC(=O)c1cccc(-c2noc(-c3ccn(-c4ccccc4[N+](=O)[O-])n3)n2)c1 ZINC000160882760 1424641343 /nfs/dbraw/zinc/64/13/43/1424641343.db2.gz XMAAMJLIIKCWOU-UHFFFAOYSA-N 0 0 391.343 3.284 20 5 GGBDRN CCc1ccc([C@H](CO)Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])cc1 ZINC000160893557 1424642498 /nfs/dbraw/zinc/64/24/98/1424642498.db2.gz NNFWPSSMVSNRLS-SFHVURJKSA-N 0 0 394.431 3.267 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12 ZINC000160924185 1424645104 /nfs/dbraw/zinc/64/51/04/1424645104.db2.gz SFXZHOGZIJMUTC-PDYKDVAVSA-N 0 0 388.427 3.355 20 5 GGBDRN CC[C@H]1CCCC[C@@H]1N(C)C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000160961331 1424647771 /nfs/dbraw/zinc/64/77/71/1424647771.db2.gz PMAJZGBWXFKZNX-HOTGVXAUSA-N 0 0 398.463 3.490 20 5 GGBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(Cl)nc1 ZINC000160964298 1424648539 /nfs/dbraw/zinc/64/85/39/1424648539.db2.gz JFAWFKYPEPBKQL-UHFFFAOYSA-N 0 0 395.868 3.354 20 5 GGBDRN Nc1c(C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)cccc1[N+](=O)[O-] ZINC000160977633 1424649796 /nfs/dbraw/zinc/64/97/96/1424649796.db2.gz UVJCIUDJVIKVPD-UHFFFAOYSA-N 0 0 390.399 3.359 20 5 GGBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)Cc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000160990042 1424650629 /nfs/dbraw/zinc/65/06/29/1424650629.db2.gz GKGIJPLDUDTGSY-UHFFFAOYSA-N 0 0 383.448 3.468 20 5 GGBDRN Cc1c(CC(=O)N2CCN(C(=O)CCC3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000160986121 1424650651 /nfs/dbraw/zinc/65/06/51/1424650651.db2.gz PXVXDTXZWVWTFR-UHFFFAOYSA-N 0 0 387.480 3.087 20 5 GGBDRN O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000161018169 1424653132 /nfs/dbraw/zinc/65/31/32/1424653132.db2.gz YVOVTRVDCJFQTC-HNNXBMFYSA-N 0 0 384.436 3.392 20 5 GGBDRN CC[NH+](CC)CCN(Cc1cccs1)C(=O)c1cccc([N+](=O)[O-])c1[O-] ZINC000161034392 1424654244 /nfs/dbraw/zinc/65/42/44/1424654244.db2.gz OJLZIUOFSSHTGO-UHFFFAOYSA-N 0 0 377.466 3.346 20 5 GGBDRN COc1ccc(CCCN(C)S(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000161088242 1424657855 /nfs/dbraw/zinc/65/78/55/1424657855.db2.gz 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CCCN([C@@H](C)C(=O)Nc1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000161234216 1424668895 /nfs/dbraw/zinc/66/88/95/1424668895.db2.gz MRLBWJKAWILWSL-AWEZNQCLSA-N 0 0 391.449 3.023 20 5 GGBDRN O=C(c1cc(F)c(Cl)cc1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000161244656 1424669983 /nfs/dbraw/zinc/66/99/83/1424669983.db2.gz ZYCPFTSOHPFYJL-VIFPVBQESA-N 0 0 382.754 3.248 20 5 GGBDRN CCc1nc(-c2ccccc2NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)n[nH]1 ZINC000161258268 1424670522 /nfs/dbraw/zinc/67/05/22/1424670522.db2.gz MZMYOTVCIYYTAN-UHFFFAOYSA-N 0 0 385.355 3.099 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2Cl)CC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000161259645 1424670732 /nfs/dbraw/zinc/67/07/32/1424670732.db2.gz GNFMEHQIJQRMIN-UHFFFAOYSA-N 0 0 391.786 3.174 20 5 GGBDRN C[C@@](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)(C(N)=O)c1cccc(Cl)c1 ZINC000161299455 1424674062 /nfs/dbraw/zinc/67/40/62/1424674062.db2.gz NJXWIIGNSAXNGX-INIZCTEOSA-N 0 0 382.203 3.032 20 5 GGBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1Cl)N1CCOC[C@H]1C1CC1 ZINC000161335104 1424678279 /nfs/dbraw/zinc/67/82/79/1424678279.db2.gz AXPNLRZYEPUCLC-LBPRGKRZSA-N 0 0 389.633 3.262 20 5 GGBDRN Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)c4cccc([N+](=O)[O-])c4N)C3)nc2c1 ZINC000161341027 1424679231 /nfs/dbraw/zinc/67/92/31/1424679231.db2.gz TWYUUNMPLNGURQ-CYBMUJFWSA-N 0 0 379.420 3.382 20 5 GGBDRN Cc1ccn(-c2ccccc2NC(=O)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)n1 ZINC000161367477 1424682437 /nfs/dbraw/zinc/68/24/37/1424682437.db2.gz GKPKVAPCFOANBA-UHFFFAOYSA-N 0 0 394.387 3.041 20 5 GGBDRN Cc1cc(C(=O)NCc2ccc(COC3CCOCC3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000161374850 1424682492 /nfs/dbraw/zinc/68/24/92/1424682492.db2.gz FEJNDJHGJIEGMA-UHFFFAOYSA-N 0 0 399.447 3.111 20 5 GGBDRN CC(C)(C)CN(CCCO)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000161372223 1424682566 /nfs/dbraw/zinc/68/25/66/1424682566.db2.gz XLHBKUFJFTVRMT-UHFFFAOYSA-N 0 0 398.403 3.033 20 5 GGBDRN Cc1nc(COC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(C)s1 ZINC000161366279 1424683045 /nfs/dbraw/zinc/68/30/45/1424683045.db2.gz PPQIZAPQPLHMKC-GFCCVEGCSA-N 0 0 395.462 3.078 20 5 GGBDRN Cc1nc(COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(C)s1 ZINC000161366132 1424683145 /nfs/dbraw/zinc/68/31/45/1424683145.db2.gz PPQIZAPQPLHMKC-LBPRGKRZSA-N 0 0 395.462 3.078 20 5 GGBDRN CC(C)(C)C[C@@H](CO)Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000161424539 1424686694 /nfs/dbraw/zinc/68/66/94/1424686694.db2.gz UDIILXSCPXGHEP-NSHDSACASA-N 0 0 380.832 3.003 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N(CCc1ccccc1)Cc1ccccc1 ZINC000161417037 1424687305 /nfs/dbraw/zinc/68/73/05/1424687305.db2.gz FVJVCYQAXLRABK-UHFFFAOYSA-N 0 0 393.447 3.246 20 5 GGBDRN COc1ccc(CC[C@@H](C)NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000161426499 1424687486 /nfs/dbraw/zinc/68/74/86/1424687486.db2.gz PMYPOXNBIRCGFO-OAHLLOKOSA-N 0 0 392.477 3.087 20 5 GGBDRN CN(CCOCc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000161471203 1424692900 /nfs/dbraw/zinc/69/29/00/1424692900.db2.gz KSDQNANXMIIBBK-UHFFFAOYSA-N 0 0 383.448 3.484 20 5 GGBDRN Cc1c(CC(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000161466695 1424693078 /nfs/dbraw/zinc/69/30/78/1424693078.db2.gz ILOHRQZQSDTVMQ-UHFFFAOYSA-N 0 0 391.468 3.304 20 5 GGBDRN O=C(c1cccc(OCC(F)(F)F)n1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000161479727 1424695113 /nfs/dbraw/zinc/69/51/13/1424695113.db2.gz JQJVTNMZNHBXET-UHFFFAOYSA-N 0 0 381.310 3.129 20 5 GGBDRN CCS[C@@H](C)c1noc(CN(C)C(=O)NCc2ccc([N+](=O)[O-])cc2)n1 ZINC000161512015 1424696629 /nfs/dbraw/zinc/69/66/29/1424696629.db2.gz YGBWTSYBAJPOFP-NSHDSACASA-N 0 0 379.442 3.134 20 5 GGBDRN CCS[C@H](C)c1noc(CN(C)C(=O)NCc2ccc([N+](=O)[O-])cc2)n1 ZINC000161512097 1424697086 /nfs/dbraw/zinc/69/70/86/1424697086.db2.gz YGBWTSYBAJPOFP-LLVKDONJSA-N 0 0 379.442 3.134 20 5 GGBDRN CCOCCC1(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000161513123 1424697873 /nfs/dbraw/zinc/69/78/73/1424697873.db2.gz JLMZTOTWGMJIBW-UHFFFAOYSA-N 0 0 391.468 3.354 20 5 GGBDRN CC[C@@H](O)CN(Cc1ccccc1)S(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000180112329 1429742501 /nfs/dbraw/zinc/74/25/01/1429742501.db2.gz HRMIFUQNRXAFRR-OAHLLOKOSA-N 0 0 396.440 3.004 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(COC2CCOCC2)cc1 ZINC000161578098 1424716336 /nfs/dbraw/zinc/71/63/36/1424716336.db2.gz VMEVINQNKPADAB-UHFFFAOYSA-N 0 0 384.432 3.149 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])o1 ZINC000161581650 1424717064 /nfs/dbraw/zinc/71/70/64/1424717064.db2.gz BLLFLHKZBIXVKT-HNNXBMFYSA-N 0 0 380.422 3.079 20 5 GGBDRN COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000161621888 1424726322 /nfs/dbraw/zinc/72/63/22/1424726322.db2.gz OYFPECPEMKNFFC-ZDUSSCGKSA-N 0 0 388.323 3.060 20 5 GGBDRN CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000161652230 1424733180 /nfs/dbraw/zinc/73/31/80/1424733180.db2.gz WFPYFQLSXDPULO-OAHLLOKOSA-N 0 0 389.477 3.060 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)NC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000161653224 1424733211 /nfs/dbraw/zinc/73/32/11/1424733211.db2.gz CZOYFOUALIDSLY-UHFFFAOYSA-N 0 0 397.357 3.189 20 5 GGBDRN C[C@@H](C[C@H](O)c1ccccc1)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000161652019 1424733383 /nfs/dbraw/zinc/73/33/83/1424733383.db2.gz AGKFPGJCKARXRB-YWZLYKJASA-N 0 0 383.448 3.437 20 5 GGBDRN C[C@H](C[C@@H](O)c1ccccc1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000161666243 1424735353 /nfs/dbraw/zinc/73/53/53/1424735353.db2.gz SYGAWONIEGIKJE-FOIQADDNSA-N 0 0 383.448 3.437 20 5 GGBDRN Cc1cc(C)c(-c2csc(NC(=O)Cn3cccc([N+](=O)[O-])c3=O)n2)c(C)c1 ZINC000161673853 1424737993 /nfs/dbraw/zinc/73/79/93/1424737993.db2.gz OIVPHJQNNLGTNL-UHFFFAOYSA-N 0 0 398.444 3.444 20 5 GGBDRN CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000161679117 1424739114 /nfs/dbraw/zinc/73/91/14/1424739114.db2.gz PBPZNMVLGBOHTF-HNNXBMFYSA-N 0 0 376.482 3.404 20 5 GGBDRN Cc1cc(C(=O)Cn2cccc([N+](=O)[O-])c2=O)c(C)n1Cc1ccc(F)cc1 ZINC000161680693 1424739671 /nfs/dbraw/zinc/73/96/71/1424739671.db2.gz IMYICKONEMRPNZ-UHFFFAOYSA-N 0 0 383.379 3.245 20 5 GGBDRN COc1c(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])c(C)nn1C ZINC000161731387 1424752847 /nfs/dbraw/zinc/75/28/47/1424752847.db2.gz VQXUECIYUGXLSI-UHFFFAOYSA-N 0 0 380.404 3.488 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1ccc(COC2CCOCC2)cc1 ZINC000161748966 1424756040 /nfs/dbraw/zinc/75/60/40/1424756040.db2.gz XZYIEVZVRLZOBR-UHFFFAOYSA-N 0 0 384.432 3.149 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@H](CC)c2c(C)noc2C)cc([N+](=O)[O-])c1 ZINC000161771239 1424761080 /nfs/dbraw/zinc/76/10/80/1424761080.db2.gz WXNUCQOADBGNLZ-OAHLLOKOSA-N 0 0 375.381 3.257 20 5 GGBDRN O=C(c1cccs1)N1CCC[C@H]1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161807368 1424770603 /nfs/dbraw/zinc/77/06/03/1424770603.db2.gz JWPRAJKGLAOMGK-INIZCTEOSA-N 0 0 385.445 3.240 20 5 GGBDRN CC(C)(CNS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000161844079 1424777827 /nfs/dbraw/zinc/77/78/27/1424777827.db2.gz MWYFUTNBFPPQIC-UHFFFAOYSA-N 0 0 380.441 3.174 20 5 GGBDRN CC(=O)N[C@H](CC(=O)N1CCCc2c([N+](=O)[O-])cccc21)c1ccc(C)cc1 ZINC000161851466 1424778642 /nfs/dbraw/zinc/77/86/42/1424778642.db2.gz SIJWWSCWAPOUEV-GOSISDBHSA-N 0 0 381.432 3.450 20 5 GGBDRN C[C@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1nc2ccccc2n1C ZINC000161854284 1424779566 /nfs/dbraw/zinc/77/95/66/1424779566.db2.gz ZGOSQEPKABXZSH-ZDUSSCGKSA-N 0 0 390.403 3.158 20 5 GGBDRN CCc1cccc(Oc2ccc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)cn2)c1 ZINC000161860355 1424782113 /nfs/dbraw/zinc/78/21/13/1424782113.db2.gz CWWKTURTDQTDLS-UHFFFAOYSA-N 0 0 394.387 3.145 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N[C@H]3CCC[C@@]3(C)CO)cc2[N+](=O)[O-])CC1 ZINC000161867583 1424782914 /nfs/dbraw/zinc/78/29/14/1424782914.db2.gz WLBFBJVDRMTFFD-ICSRJNTNSA-N 0 0 375.469 3.112 20 5 GGBDRN Cc1ccc(Oc2ccc(NC(=O)Cn3ccc(=O)c([N+](=O)[O-])c3)cn2)cc1C ZINC000161865211 1424782928 /nfs/dbraw/zinc/78/29/28/1424782928.db2.gz ADAUSIWOYAHWBP-UHFFFAOYSA-N 0 0 394.387 3.199 20 5 GGBDRN Cc1cc2nc(C)c(CCC(=O)N3CCCc4c([N+](=O)[O-])cccc43)c(C)n2n1 ZINC000161876829 1424785555 /nfs/dbraw/zinc/78/55/55/1424785555.db2.gz JOQCLVPAHKCSHH-UHFFFAOYSA-N 0 0 393.447 3.475 20 5 GGBDRN CC[C@@H](C)NC(=O)c1cccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000161882940 1424786705 /nfs/dbraw/zinc/78/67/05/1424786705.db2.gz CXKQPHXXTHPOJB-CQSZACIVSA-N 0 0 383.448 3.290 20 5 GGBDRN CCc1cc(=O)[nH]c(-c2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)c2)n1 ZINC000161902854 1424792334 /nfs/dbraw/zinc/79/23/34/1424792334.db2.gz UGFBWNXLAXTLLB-UHFFFAOYSA-N 0 0 392.415 3.397 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CNc3cccnc3-n3cncn3)cs2)c1 ZINC000161941242 1424801043 /nfs/dbraw/zinc/80/10/43/1424801043.db2.gz QRKDBDDQISPDAQ-UHFFFAOYSA-N 0 0 379.405 3.306 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)o1 ZINC000161964282 1424803716 /nfs/dbraw/zinc/80/37/16/1424803716.db2.gz HGXUCGCWGZHLLA-KRWDZBQOSA-N 0 0 396.403 3.497 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)o1 ZINC000161969748 1424804752 /nfs/dbraw/zinc/80/47/52/1424804752.db2.gz CWQCJZOQBFIQEY-OAHLLOKOSA-N 0 0 375.337 3.220 20 5 GGBDRN CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161981474 1424805428 /nfs/dbraw/zinc/80/54/28/1424805428.db2.gz LOSUTWPIBGAZMY-KSSFIOAISA-N 0 0 388.468 3.094 20 5 GGBDRN COc1cc(CNc2nnc(C)n2C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000161996657 1424807514 /nfs/dbraw/zinc/80/75/14/1424807514.db2.gz DEYRWSZELDYDRT-UHFFFAOYSA-N 0 0 383.408 3.231 20 5 GGBDRN Cc1[nH]c2ccccc2c1CCNS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000162012085 1424808826 /nfs/dbraw/zinc/80/88/26/1424808826.db2.gz JAOJKBVTDFDYPL-UHFFFAOYSA-N 0 0 387.461 3.089 20 5 GGBDRN C[C@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@H](O)c1ccc(F)cc1 ZINC000162019429 1424809032 /nfs/dbraw/zinc/80/90/32/1424809032.db2.gz NZRAUWGSYNSHIJ-VOJFVSQTSA-N 0 0 396.802 3.395 20 5 GGBDRN Cn1c2ccc(NC(=O)COc3ccc(C=O)cc3[N+](=O)[O-])cc2nc1C1CC1 ZINC000162032395 1424810604 /nfs/dbraw/zinc/81/06/04/1424810604.db2.gz PCHUZAWBHUFQHI-UHFFFAOYSA-N 0 0 394.387 3.189 20 5 GGBDRN COCc1ccc([C@H]2CCCN2C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000162046795 1424811829 /nfs/dbraw/zinc/81/18/29/1424811829.db2.gz NYLRNPUFPBYBTB-GOSISDBHSA-N 0 0 396.403 3.497 20 5 GGBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H](O)c1ccc(F)cc1 ZINC000162056135 1424812366 /nfs/dbraw/zinc/81/23/66/1424812366.db2.gz ZDCMAFDKLZZQJM-PSLIRLAXSA-N 0 0 397.200 3.348 20 5 GGBDRN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)C2)nc1 ZINC000162063497 1424813180 /nfs/dbraw/zinc/81/31/80/1424813180.db2.gz KXKOODPOHUAFIK-KRWDZBQOSA-N 0 0 396.447 3.026 20 5 GGBDRN COc1ccccc1[C@@H]1CCCN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000162089517 1424815224 /nfs/dbraw/zinc/81/52/24/1424815224.db2.gz FHXDEVQJWXZKNX-SFHVURJKSA-N 0 0 390.461 3.313 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000162106547 1424816758 /nfs/dbraw/zinc/81/67/58/1424816758.db2.gz DEORUZHAQYEUBU-UHFFFAOYSA-N 0 0 393.394 3.224 20 5 GGBDRN CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162176139 1424822791 /nfs/dbraw/zinc/82/27/91/1424822791.db2.gz PANGEYYARQYKQC-LJQANCHMSA-N 0 0 381.432 3.329 20 5 GGBDRN CC(C)OC(=O)[C@H](C)N(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000162179509 1424823889 /nfs/dbraw/zinc/82/38/89/1424823889.db2.gz DKOAWWGKANRXJP-NSHDSACASA-N 0 0 377.422 3.130 20 5 GGBDRN O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1CCCc2sccc21 ZINC000162193463 1424825226 /nfs/dbraw/zinc/82/52/26/1424825226.db2.gz KPSOZBBAPXQLDG-GFCCVEGCSA-N 0 0 393.852 3.233 20 5 GGBDRN Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162200192 1424825583 /nfs/dbraw/zinc/82/55/83/1424825583.db2.gz XPSJLTNEUUVCRD-UHFFFAOYSA-N 0 0 383.433 3.353 20 5 GGBDRN O=C(c1ccc(CN2CCCC2=O)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162216996 1424827151 /nfs/dbraw/zinc/82/71/51/1424827151.db2.gz MNWCALOIAGAJFK-UHFFFAOYSA-N 0 0 379.416 3.310 20 5 GGBDRN COc1ccccc1CC(C)(C)NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000162231943 1424829273 /nfs/dbraw/zinc/82/92/73/1424829273.db2.gz QWHQJGIMHPSCSS-UHFFFAOYSA-N 0 0 392.477 3.087 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)S(=O)(=O)Cc1cccc(C(=O)N(C)C)c1 ZINC000180142599 1429756566 /nfs/dbraw/zinc/75/65/66/1429756566.db2.gz GELDHWLOYJYWME-AWEZNQCLSA-N 0 0 390.461 3.281 20 5 GGBDRN Cc1c(CC(=O)N[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000162264514 1424832562 /nfs/dbraw/zinc/83/25/62/1424832562.db2.gz DJBHHSOBRVZWQC-HZPDHXFCSA-N 0 0 391.468 3.398 20 5 GGBDRN COCCOCc1cc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)ccc1F ZINC000162274673 1424833549 /nfs/dbraw/zinc/83/35/49/1424833549.db2.gz JGCCBMPGYOWVMX-UHFFFAOYSA-N 0 0 388.395 3.490 20 5 GGBDRN Cc1c(CC(=O)Nc2cc(C(=O)N(C)C)ccc2Cl)cccc1[N+](=O)[O-] ZINC000162277164 1424833890 /nfs/dbraw/zinc/83/38/90/1424833890.db2.gz LULIQMNMRRFUNQ-UHFFFAOYSA-N 0 0 375.812 3.440 20 5 GGBDRN CN(Cc1ccccc1)c1ccc(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)cc1 ZINC000162288623 1424834703 /nfs/dbraw/zinc/83/47/03/1424834703.db2.gz DOGDMEDSWGJAOA-UHFFFAOYSA-N 0 0 392.415 3.032 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCS[C@H]2COCC[C@H]21 ZINC000162422792 1424849872 /nfs/dbraw/zinc/84/98/72/1424849872.db2.gz JWQNPOZZMAEPCP-CABCVRRESA-N 0 0 391.474 3.065 20 5 GGBDRN C[C@@H]1CCN(C)c2ccccc2N1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000180135685 1429753013 /nfs/dbraw/zinc/75/30/13/1429753013.db2.gz OFLCORYEKDDYOB-OAHLLOKOSA-N 0 0 389.477 3.202 20 5 GGBDRN Cc1cccn2cc(-c3ccc(NC(=O)c4c([N+](=O)[O-])cnn4C)cc3)nc12 ZINC000162450945 1424853606 /nfs/dbraw/zinc/85/36/06/1424853606.db2.gz LUHATFSSARCBDU-UHFFFAOYSA-N 0 0 376.376 3.204 20 5 GGBDRN C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H](O)c1ccc(F)cc1 ZINC000162453010 1424854092 /nfs/dbraw/zinc/85/40/92/1424854092.db2.gz PXKDUSJWZIEXLL-BFUOFWGJSA-N 0 0 375.400 3.164 20 5 GGBDRN Cc1c(CC(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C(C)C)cccc1[N+](=O)[O-] ZINC000162454939 1424854685 /nfs/dbraw/zinc/85/46/85/1424854685.db2.gz UFBUXHOLIRCSEM-UHFFFAOYSA-N 0 0 394.431 3.119 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)o1 ZINC000162511252 1424859961 /nfs/dbraw/zinc/85/99/61/1424859961.db2.gz VAMFTPKTBIGBEG-KRWDZBQOSA-N 0 0 394.449 3.044 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CCN1CCN(c2ccccc2)CC1 ZINC000162517523 1424860457 /nfs/dbraw/zinc/86/04/57/1424860457.db2.gz PZHSDSVGFFVDDM-UHFFFAOYSA-N 0 0 397.479 3.189 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1ccc(COC)o1 ZINC000162517004 1424860593 /nfs/dbraw/zinc/86/05/93/1424860593.db2.gz DKMMFFDMIHMDAD-INIZCTEOSA-N 0 0 394.449 3.422 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000162512318 1424860686 /nfs/dbraw/zinc/86/06/86/1424860686.db2.gz ICOLPRMSDIHNRP-INIZCTEOSA-N 0 0 388.811 3.484 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])o1 ZINC000162535116 1424863584 /nfs/dbraw/zinc/86/35/84/1424863584.db2.gz LYQKWBUEDVSZNC-OAHLLOKOSA-N 0 0 394.449 3.477 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])o1 ZINC000162535253 1424863685 /nfs/dbraw/zinc/86/36/85/1424863685.db2.gz LYQKWBUEDVSZNC-HNNXBMFYSA-N 0 0 394.449 3.477 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)cc1 ZINC000162542476 1424864712 /nfs/dbraw/zinc/86/47/12/1424864712.db2.gz HMMJJTBMIAKGTC-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])o1 ZINC000162551373 1424865132 /nfs/dbraw/zinc/86/51/32/1424865132.db2.gz KEGQTINCLPMJEX-CQSZACIVSA-N 0 0 380.422 3.168 20 5 GGBDRN COCc1ccc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)o1 ZINC000162548622 1424865232 /nfs/dbraw/zinc/86/52/32/1424865232.db2.gz ZAXFUPKEMSAADB-CQSZACIVSA-N 0 0 398.412 3.308 20 5 GGBDRN CCN(C[C@@H]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1)CC(F)(F)F ZINC000162557046 1424866077 /nfs/dbraw/zinc/86/60/77/1424866077.db2.gz HQIGHYYKAQPDOD-AWEZNQCLSA-N 0 0 388.390 3.011 20 5 GGBDRN COCc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)o1 ZINC000162570077 1424866887 /nfs/dbraw/zinc/86/68/87/1424866887.db2.gz CPDZXSAPXBLUSG-INIZCTEOSA-N 0 0 394.449 3.477 20 5 GGBDRN Cc1c(C(=O)N[C@H](C)[C@H](O)c2ccc(F)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000162587217 1424869227 /nfs/dbraw/zinc/86/92/27/1424869227.db2.gz ZPEIYICFVZWBJH-DIFFPNOSSA-N 0 0 391.355 3.111 20 5 GGBDRN Cc1c(NC(=O)C(=O)NCCc2ccc([N+](=O)[O-])cc2)cccc1C(F)(F)F ZINC000162598948 1424870138 /nfs/dbraw/zinc/87/01/38/1424870138.db2.gz JKDBXGZLMSYZCW-UHFFFAOYSA-N 0 0 395.337 3.219 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCc2c(F)cccc2C1 ZINC000162605426 1424871000 /nfs/dbraw/zinc/87/10/00/1424871000.db2.gz MDIUVYANNAZYGO-UHFFFAOYSA-N 0 0 399.378 3.007 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)S(=O)(=O)CCc1ccccc1[N+](=O)[O-])CCC2 ZINC000162620406 1424872428 /nfs/dbraw/zinc/87/24/28/1424872428.db2.gz JYARZYDCDWJSMD-INIZCTEOSA-N 0 0 395.506 3.241 20 5 GGBDRN Cn1cnnc1-c1cncc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c1 ZINC000162648427 1424874906 /nfs/dbraw/zinc/87/49/06/1424874906.db2.gz XZXXZUCTJHJKEX-UHFFFAOYSA-N 0 0 380.408 3.335 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccccc2[N+](=O)[O-])c(C(F)(F)F)c1 ZINC000162672592 1424877811 /nfs/dbraw/zinc/87/78/11/1424877811.db2.gz YQEAPEKKXWBEOZ-UHFFFAOYSA-N 0 0 392.267 3.290 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@H](O)c1ccc(F)cc1 ZINC000162679874 1424879106 /nfs/dbraw/zinc/87/91/06/1424879106.db2.gz QNPMUHNMBFIZAY-DJJJIMSYSA-N 0 0 387.411 3.186 20 5 GGBDRN CNC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)c1 ZINC000180149346 1429761011 /nfs/dbraw/zinc/76/10/11/1429761011.db2.gz LQSBYKYBGQFASN-UHFFFAOYSA-N 0 0 387.461 3.385 20 5 GGBDRN O=C(NCCc1ccc2c(c1)OCO2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000162714742 1424884110 /nfs/dbraw/zinc/88/41/10/1424884110.db2.gz GFSWWNYKAZKYNE-UHFFFAOYSA-N 0 0 383.404 3.240 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 ZINC000162724182 1424885314 /nfs/dbraw/zinc/88/53/14/1424885314.db2.gz NJOOBEBQHWJCBJ-CQSZACIVSA-N 0 0 388.468 3.406 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 ZINC000162778837 1424889636 /nfs/dbraw/zinc/88/96/36/1424889636.db2.gz XHPWYJJSZSHVBX-QGZVFWFLSA-N 0 0 396.447 3.258 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 ZINC000162778947 1424889641 /nfs/dbraw/zinc/88/96/41/1424889641.db2.gz XHPWYJJSZSHVBX-KRWDZBQOSA-N 0 0 396.447 3.258 20 5 GGBDRN CS[C@@H](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000162779683 1424889737 /nfs/dbraw/zinc/88/97/37/1424889737.db2.gz JQLKUIZIGRMIRX-NSHDSACASA-N 0 0 391.415 3.404 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3nnc4n3CCCC4)cc2[N+](=O)[O-])C1 ZINC000162806349 1424892039 /nfs/dbraw/zinc/89/20/39/1424892039.db2.gz FSISCUSLMLLVDX-OKILXGFUSA-N 0 0 398.467 3.257 20 5 GGBDRN C[C@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1nnc2ccccn21 ZINC000162813644 1424892953 /nfs/dbraw/zinc/89/29/53/1424892953.db2.gz JLDLFLFGJMMNDZ-ZDUSSCGKSA-N 0 0 380.408 3.073 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1 ZINC000162846372 1424896153 /nfs/dbraw/zinc/89/61/53/1424896153.db2.gz NBAHUBBBBMHJEW-MRXNPFEDSA-N 0 0 398.463 3.446 20 5 GGBDRN Cc1cccc([C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)N2CCOCC2)c1 ZINC000162863100 1424897439 /nfs/dbraw/zinc/89/74/39/1424897439.db2.gz OKYGKKFOVMMJPS-HXUWFJFHSA-N 0 0 398.463 3.407 20 5 GGBDRN Cc1ccc(C(=O)N2C[C@H](C)C[C@H](C)C2)cc1NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000162895814 1424901531 /nfs/dbraw/zinc/90/15/31/1424901531.db2.gz SVDGTJSXTRTTEC-BETUJISGSA-N 0 0 399.451 3.007 20 5 GGBDRN Cc1ccc(C)c([C@@H]2CCCN2C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000162910962 1424904805 /nfs/dbraw/zinc/90/48/05/1424904805.db2.gz RLWIQXMSKDDQSR-IBGZPJMESA-N 0 0 381.432 3.305 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCSC[C@H]1c1ccccc1 ZINC000162916654 1424905501 /nfs/dbraw/zinc/90/55/01/1424905501.db2.gz VGHCKXGXXRXWBB-SFHVURJKSA-N 0 0 392.502 3.257 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2Cc3ccccc32)c(C(F)(F)F)c1 ZINC000162919502 1424905568 /nfs/dbraw/zinc/90/55/68/1424905568.db2.gz LYLDNBVLYADDKM-NSHDSACASA-N 0 0 386.351 3.232 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2Cc3ccccc32)c(C(F)(F)F)c1 ZINC000162919380 1424905749 /nfs/dbraw/zinc/90/57/49/1424905749.db2.gz LYLDNBVLYADDKM-LLVKDONJSA-N 0 0 386.351 3.232 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O ZINC000162926893 1424907272 /nfs/dbraw/zinc/90/72/72/1424907272.db2.gz GBAOWUZFDJOWGI-OAHLLOKOSA-N 0 0 390.346 3.108 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(CCOc2ccccc2)CC1 ZINC000162966827 1424914173 /nfs/dbraw/zinc/91/41/73/1424914173.db2.gz SDOBMIQQOCYORX-UHFFFAOYSA-N 0 0 384.436 3.132 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O ZINC000163026180 1424926193 /nfs/dbraw/zinc/92/61/93/1424926193.db2.gz NEVGDCGGLWXUHV-IBGZPJMESA-N 0 0 396.447 3.258 20 5 GGBDRN CC(C)(CNS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000163044642 1424929723 /nfs/dbraw/zinc/92/97/23/1424929723.db2.gz IZQPDIHGMMPZGO-UHFFFAOYSA-N 0 0 380.441 3.174 20 5 GGBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CC[C@@]3(CCOC3)C2)c1=S ZINC000163054145 1424932269 /nfs/dbraw/zinc/93/22/69/1424932269.db2.gz BZRSXZPUSPKOTF-GOSISDBHSA-N 0 0 389.481 3.079 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000163061101 1424933849 /nfs/dbraw/zinc/93/38/49/1424933849.db2.gz RLLGNPPVGOTQCZ-QGZVFWFLSA-N 0 0 388.395 3.396 20 5 GGBDRN O=C(Nc1ccccc1O[C@@H]1CCOC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000163084176 1424937248 /nfs/dbraw/zinc/93/72/48/1424937248.db2.gz VGDBFKINICYESU-MRXNPFEDSA-N 0 0 394.387 3.201 20 5 GGBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000163101058 1424940441 /nfs/dbraw/zinc/94/04/41/1424940441.db2.gz MQEDSXPOXXGTGK-UHFFFAOYSA-N 0 0 384.367 3.445 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cc2c(cc1F)NC(=O)CC2 ZINC000163111356 1424942438 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GGBDRN O=C(c1ccc(F)cc1F)N1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000171070047 1425467470 /nfs/dbraw/zinc/46/74/70/1425467470.db2.gz YJKZVEWXUOUZHC-UHFFFAOYSA-N 0 0 398.369 3.384 20 5 GGBDRN COc1c(C)cnc(CN(C)S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1C ZINC000171091710 1425478372 /nfs/dbraw/zinc/47/83/72/1425478372.db2.gz OIWSEAZEPWPMNI-UHFFFAOYSA-N 0 0 399.856 3.089 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCc1c(C)[nH]c2ccccc21 ZINC000171101688 1425483236 /nfs/dbraw/zinc/48/32/36/1425483236.db2.gz WALBPJWSDQYTSA-UHFFFAOYSA-N 0 0 382.420 3.435 20 5 GGBDRN CCN(Cc1c(F)cccc1F)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000171109500 1425487717 /nfs/dbraw/zinc/48/77/17/1425487717.db2.gz CONZWNGUPJYDKV-UHFFFAOYSA-N 0 0 386.376 3.092 20 5 GGBDRN CO[C@@H]1CCCN(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000171115597 1425490493 /nfs/dbraw/zinc/49/04/93/1425490493.db2.gz PDUWEQIMSUOVEN-GDBMZVCRSA-N 0 0 384.436 3.414 20 5 GGBDRN C[C@@H](Nc1ncnc2c1c(Br)nn2C)c1cccc([N+](=O)[O-])c1 ZINC000171131451 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COc1cc(C(=O)Nc2cc(-c3ccccc3C)nn2CCO)ccc1[N+](=O)[O-] ZINC000171230625 1425554100 /nfs/dbraw/zinc/55/41/00/1425554100.db2.gz XERIMVZZLCXVNZ-UHFFFAOYSA-N 0 0 396.403 3.020 20 5 GGBDRN O=C(Oc1ccc(C(=O)N2CCCC2)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000171247297 1425564836 /nfs/dbraw/zinc/56/48/36/1425564836.db2.gz KYGAPAKIUOIHLU-UHFFFAOYSA-N 0 0 376.315 3.328 20 5 GGBDRN O=C(Nc1ccc2c(c1)CCCC(=O)N2)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000171251342 1425568245 /nfs/dbraw/zinc/56/82/45/1425568245.db2.gz HHXNGHVJGUPTHR-UHFFFAOYSA-N 0 0 391.387 3.308 20 5 GGBDRN Cc1c(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000171253804 1425571998 /nfs/dbraw/zinc/57/19/98/1425571998.db2.gz BARQZDQHQGGEPF-UHFFFAOYSA-N 0 0 384.348 3.339 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1C(F)(F)F ZINC000171257841 1425576260 /nfs/dbraw/zinc/57/62/60/1425576260.db2.gz YJFXJFWOSZEELE-UHFFFAOYSA-N 0 0 385.273 3.008 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(F)(F)F)ccc1F ZINC000171257617 1425576558 /nfs/dbraw/zinc/57/65/58/1425576558.db2.gz NFDGWXXBULDMBJ-UHFFFAOYSA-N 0 0 385.273 3.008 20 5 GGBDRN O=C1CCCc2cc(NS(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)ccc2N1 ZINC000171267915 1425585408 /nfs/dbraw/zinc/58/54/08/1425585408.db2.gz MNDFBZSFBPCJPA-UHFFFAOYSA-N 0 0 395.824 3.324 20 5 GGBDRN CC(C)(C)c1nc(CC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cs1 ZINC000171288929 1425594994 /nfs/dbraw/zinc/59/49/94/1425594994.db2.gz ZIIXNGZTRLWAMZ-UHFFFAOYSA-N 0 0 377.422 3.073 20 5 GGBDRN Cc1cc(C(=O)NC2CCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)c(C)o1 ZINC000171291818 1425598233 /nfs/dbraw/zinc/59/82/33/1425598233.db2.gz IYQYCCLBCUJDJL-UHFFFAOYSA-N 0 0 385.420 3.148 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(C(=O)OC(C)C)ccc1Cl ZINC000171295505 1425600673 /nfs/dbraw/zinc/60/06/73/1425600673.db2.gz ASODYXMNADFGEK-UHFFFAOYSA-N 0 0 394.815 3.347 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Sc2nc3ccccc3[nH]2)cc1 ZINC000171297597 1425601658 /nfs/dbraw/zinc/60/16/58/1425601658.db2.gz CWROOOHLQVYXCO-UHFFFAOYSA-N 0 0 394.416 3.458 20 5 GGBDRN Cc1nn(C)c(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)c1[N+](=O)[O-] ZINC000171303475 1425604718 /nfs/dbraw/zinc/60/47/18/1425604718.db2.gz AKXQOYAZZSMNFM-UHFFFAOYSA-N 0 0 382.342 3.117 20 5 GGBDRN CCN(Cc1c(F)cccc1F)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000171312792 1425610895 /nfs/dbraw/zinc/61/08/95/1425610895.db2.gz XPQHQXSERVFALV-UHFFFAOYSA-N 0 0 377.347 3.169 20 5 GGBDRN CCc1[nH]nc(C(=O)Oc2ccc(NC(=O)c3cccs3)cc2)c1[N+](=O)[O-] ZINC000171368815 1425644809 /nfs/dbraw/zinc/64/48/09/1425644809.db2.gz WRPGZFAFGINVHB-UHFFFAOYSA-N 0 0 386.389 3.413 20 5 GGBDRN CC(C)CC(=O)N[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000171371086 1425645771 /nfs/dbraw/zinc/64/57/71/1425645771.db2.gz UBJBAJQFGBBISR-HXUWFJFHSA-N 0 0 383.448 3.457 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccccc2C(=O)N2C[C@H](C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000171371392 1425646006 /nfs/dbraw/zinc/64/60/06/1425646006.db2.gz TZPPJJUYPLYDGH-CHWSQXEVSA-N 0 0 399.451 3.251 20 5 GGBDRN CCc1n[nH]c(C(=O)NC[C@@H](c2cccc(Cl)c2)N2CCCC2)c1[N+](=O)[O-] ZINC000171371339 1425646024 /nfs/dbraw/zinc/64/60/24/1425646024.db2.gz BNGMORFGAHTBKO-HNNXBMFYSA-N 0 0 391.859 3.101 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@H](c2ccccc2)[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000171372796 1425646738 /nfs/dbraw/zinc/64/67/38/1425646738.db2.gz SSBSLFNHRGOGAB-QZTJIDSGSA-N 0 0 376.434 3.331 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccnc1N1CCOCC1 ZINC000171379316 1425650003 /nfs/dbraw/zinc/65/00/03/1425650003.db2.gz LCMAVFSEYINQBM-UHFFFAOYSA-N 0 0 399.451 3.269 20 5 GGBDRN CC(C)(C)NC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000171387878 1425655596 /nfs/dbraw/zinc/65/55/96/1425655596.db2.gz UPBRGXRIOPLYQA-HNNXBMFYSA-N 0 0 393.509 3.322 20 5 GGBDRN CC(C)(C)NC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000171387871 1425655725 /nfs/dbraw/zinc/65/57/25/1425655725.db2.gz UPBRGXRIOPLYQA-OAHLLOKOSA-N 0 0 393.509 3.322 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](NC(=O)CC(C)C)c1ccccc1 ZINC000171389323 1425656485 /nfs/dbraw/zinc/65/64/85/1425656485.db2.gz FBWOTTVFVZGUCB-HXUWFJFHSA-N 0 0 399.447 3.123 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(OCC(C)C)c(OC)c2)c1[N+](=O)[O-] ZINC000171399362 1425662148 /nfs/dbraw/zinc/66/21/48/1425662148.db2.gz WWJGSVIJZBAHHU-LBPRGKRZSA-N 0 0 390.440 3.415 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2cccc(OCc3ccccn3)c2)c1[N+](=O)[O-] ZINC000171400474 1425663255 /nfs/dbraw/zinc/66/32/55/1425663255.db2.gz HPNCKWIJMVMTCL-ZDUSSCGKSA-N 0 0 395.419 3.345 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N(C)CCN2CCOCC2)cc1[N+](=O)[O-] ZINC000171418421 1425670564 /nfs/dbraw/zinc/67/05/64/1425670564.db2.gz KFTRJAYVUOTRMI-UHFFFAOYSA-N 0 0 395.525 3.137 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Oc2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000171423129 1425672015 /nfs/dbraw/zinc/67/20/15/1425672015.db2.gz SFJYVVLMRDACQW-MRXNPFEDSA-N 0 0 390.342 3.392 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(=O)N(C)Cc1ccccc1 ZINC000171428763 1425674605 /nfs/dbraw/zinc/67/46/05/1425674605.db2.gz AQZHVGBSJFEENA-UHFFFAOYSA-N 0 0 398.463 3.173 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc3c(c2)CCO3)ccc1[N+](=O)[O-] ZINC000171429344 1425674667 /nfs/dbraw/zinc/67/46/67/1425674667.db2.gz NTGLCLBNULXSIE-GOSISDBHSA-N 0 0 395.415 3.081 20 5 GGBDRN COc1cccc([C@@H](C)N2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000171434201 1425676825 /nfs/dbraw/zinc/67/68/25/1425676825.db2.gz VCUWDQRXHNBHFS-MRXNPFEDSA-N 0 0 398.463 3.192 20 5 GGBDRN Cc1nn(CCC(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000171441140 1425679342 /nfs/dbraw/zinc/67/93/42/1425679342.db2.gz POJJPKPIAXJGGH-YLJYHZDGSA-N 0 0 386.452 3.082 20 5 GGBDRN CCn1cnnc1-c1ccccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000171440984 1425679596 /nfs/dbraw/zinc/67/95/96/1425679596.db2.gz WRARHDYLXUSLIS-UHFFFAOYSA-N 0 0 381.392 3.281 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc3nc(N(C)C)ccc3c2)c(C)c1[N+](=O)[O-] ZINC000171441853 1425680333 /nfs/dbraw/zinc/68/03/33/1425680333.db2.gz MFIQMITVKSLHST-UHFFFAOYSA-N 0 0 382.424 3.051 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC[C@@H]2c2nc3cc(C)ccc3[nH]2)c(C)c1[N+](=O)[O-] ZINC000171444339 1425681044 /nfs/dbraw/zinc/68/10/44/1425681044.db2.gz GLXMBFCLLQKKHP-QGZVFWFLSA-N 0 0 396.451 3.347 20 5 GGBDRN O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000171455164 1425685403 /nfs/dbraw/zinc/68/54/03/1425685403.db2.gz UTQYKBKWDKGWFE-VQTJNVASSA-N 0 0 392.415 3.431 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000171457422 1425687213 /nfs/dbraw/zinc/68/72/13/1425687213.db2.gz HDEINXWQNACBGP-PMACEKPBSA-N 0 0 392.415 3.431 20 5 GGBDRN O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000171457136 1425687247 /nfs/dbraw/zinc/68/72/47/1425687247.db2.gz LRWWUPDGGQLQKR-VQTJNVASSA-N 0 0 392.415 3.431 20 5 GGBDRN Cc1c(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000171464472 1425690795 /nfs/dbraw/zinc/69/07/95/1425690795.db2.gz GZRVEAILAOEQPW-QZTJIDSGSA-N 0 0 385.376 3.462 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@H](c2nccs2)c2ccccc2)cc1[N+](=O)[O-] ZINC000171473356 1425695108 /nfs/dbraw/zinc/69/51/08/1425695108.db2.gz MTDOXRVVMPCYRP-INIZCTEOSA-N 0 0 396.428 3.204 20 5 GGBDRN CNC(=O)CCN(C)C(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000171504025 1425707389 /nfs/dbraw/zinc/70/73/89/1425707389.db2.gz AWXOJLHMGOJGPW-UHFFFAOYSA-N 0 0 387.461 3.263 20 5 GGBDRN Cc1c(C(=O)N2CCc3ccccc3[C@H]2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000171507242 1425708878 /nfs/dbraw/zinc/70/88/78/1425708878.db2.gz DPDYYSUEDSWCDP-CYBMUJFWSA-N 0 0 377.404 3.243 20 5 GGBDRN C[C@@H]1c2ccccc2CCN1C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000171510420 1425709791 /nfs/dbraw/zinc/70/97/91/1425709791.db2.gz CKYWVJBVOFEPQD-HIFRSBDPSA-N 0 0 397.406 3.233 20 5 GGBDRN CN(C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1)C(=O)OC(C)(C)C ZINC000171524786 1425715896 /nfs/dbraw/zinc/71/58/96/1425715896.db2.gz AMWBDIYAEKITDD-GFCCVEGCSA-N 0 0 381.404 3.063 20 5 GGBDRN Cc1cccc2c1CCN(C(=O)CCCn1c(=O)oc3cc([N+](=O)[O-])ccc31)C2 ZINC000171538825 1425723783 /nfs/dbraw/zinc/72/37/83/1425723783.db2.gz UTYAICBDPBSSPC-UHFFFAOYSA-N 0 0 395.415 3.176 20 5 GGBDRN C[C@@H](NC(=O)C[C@H](C)S(=O)(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000171545923 1425728363 /nfs/dbraw/zinc/72/83/63/1425728363.db2.gz JPOGQYDITNFVMM-QWHCGFSZSA-N 0 0 394.424 3.164 20 5 GGBDRN C[C@H](CC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)cc1 ZINC000171545921 1425728509 /nfs/dbraw/zinc/72/85/09/1425728509.db2.gz JPOGQYDITNFVMM-OLZOCXBDSA-N 0 0 394.424 3.164 20 5 GGBDRN Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000171560868 1425735812 /nfs/dbraw/zinc/73/58/12/1425735812.db2.gz HLQWYYXMSJQKBR-JTQLQIEISA-N 0 0 389.412 3.240 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)c1 ZINC000171586139 1425745911 /nfs/dbraw/zinc/74/59/11/1425745911.db2.gz JZOXCGQHCCOYMT-AWEZNQCLSA-N 0 0 387.411 3.262 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)c1 ZINC000171588676 1425749931 /nfs/dbraw/zinc/74/99/31/1425749931.db2.gz HPHCLKXSNRFFGH-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000171590121 1425750640 /nfs/dbraw/zinc/75/06/40/1425750640.db2.gz YMPBHLBZZUYPFY-INIZCTEOSA-N 0 0 383.448 3.051 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000171590517 1425751952 /nfs/dbraw/zinc/75/19/52/1425751952.db2.gz VWXAGCSKSOABRI-ZDUSSCGKSA-N 0 0 375.450 3.184 20 5 GGBDRN CN(CC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1)C(=O)OC(C)(C)C ZINC000171597091 1425753290 /nfs/dbraw/zinc/75/32/90/1425753290.db2.gz XYAVEXBOTOGXPF-UHFFFAOYSA-N 0 0 383.470 3.375 20 5 GGBDRN COc1cc(CCNC(=O)N2CCc3c(C)cccc3C2)c([N+](=O)[O-])cc1OC ZINC000171598938 1425754230 /nfs/dbraw/zinc/75/42/30/1425754230.db2.gz DVBMJBGUZXANFT-UHFFFAOYSA-N 0 0 399.447 3.231 20 5 GGBDRN COc1ccc([C@H]2Nc3ccccc3C(=O)N2C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000171603744 1425756795 /nfs/dbraw/zinc/75/67/95/1425756795.db2.gz SEXUXRSBHYMWFR-LIRRHRJNSA-N 0 0 383.404 3.349 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000171626621 1425763503 /nfs/dbraw/zinc/76/35/03/1425763503.db2.gz MLQNYFLWFKQLJK-GFCCVEGCSA-N 0 0 383.832 3.378 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000171628777 1425764291 /nfs/dbraw/zinc/76/42/91/1425764291.db2.gz AROOZVCHPDKJOU-KXKDPZRNSA-N 0 0 375.425 3.124 20 5 GGBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@@H]1CC(c2cccc(F)c2)=NO1 ZINC000171635006 1425767315 /nfs/dbraw/zinc/76/73/15/1425767315.db2.gz CBEWRMBRYASYPF-KRWDZBQOSA-N 0 0 395.350 3.051 20 5 GGBDRN O=[N+]([O-])c1cc(Br)ccc1S(=O)(=O)Oc1cc(F)ccc1F ZINC000171634422 1425767412 /nfs/dbraw/zinc/76/74/12/1425767412.db2.gz JXNIUDDYUSIXMP-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000171655045 1425776190 /nfs/dbraw/zinc/77/61/90/1425776190.db2.gz CLEAZTNBTLUMHF-OAHLLOKOSA-N 0 0 383.326 3.146 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ccc(Cl)cc1OC ZINC000171655112 1425776666 /nfs/dbraw/zinc/77/66/66/1425776666.db2.gz GNQOVDIAOYQURG-UHFFFAOYSA-N 0 0 379.800 3.265 20 5 GGBDRN CC(C)[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1nc(-c2cccnc2)no1 ZINC000171665610 1425781253 /nfs/dbraw/zinc/78/12/53/1425781253.db2.gz OPJXCFZFZFWHRA-MRXNPFEDSA-N 0 0 396.407 3.236 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)c1[N+](=O)[O-] ZINC000171680810 1425787238 /nfs/dbraw/zinc/78/72/38/1425787238.db2.gz IVUBCPFIGHPKGN-UHFFFAOYSA-N 0 0 395.872 3.339 20 5 GGBDRN COc1cc(CCNC(=O)N2CCCc3ccccc3C2)c([N+](=O)[O-])cc1OC ZINC000171704917 1425795801 /nfs/dbraw/zinc/79/58/01/1425795801.db2.gz MSTKMUKQUAWJEK-UHFFFAOYSA-N 0 0 399.447 3.313 20 5 GGBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H](c2nccs2)c2ccccc2)cc1 ZINC000171713435 1425800579 /nfs/dbraw/zinc/80/05/79/1425800579.db2.gz HFGUUYVYSCYYSF-MRXNPFEDSA-N 0 0 389.458 3.260 20 5 GGBDRN O=C(NC1(c2ccc(F)cc2)CCOCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000171716095 1425801050 /nfs/dbraw/zinc/80/10/50/1425801050.db2.gz CQQQKRKJGPXFBL-UHFFFAOYSA-N 0 0 389.339 3.078 20 5 GGBDRN CC[C@H](NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1nc(C)cs1 ZINC000171719423 1425802170 /nfs/dbraw/zinc/80/21/70/1425802170.db2.gz KZFIGPLOXOCNLA-INIZCTEOSA-N 0 0 389.481 3.343 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000171720198 1425802744 /nfs/dbraw/zinc/80/27/44/1425802744.db2.gz JGBUJAWIKNTHIT-NRFANRHFSA-N 0 0 392.415 3.022 20 5 GGBDRN CCCN(C(=O)c1ccccc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000171748854 1425810172 /nfs/dbraw/zinc/81/01/72/1425810172.db2.gz HXLASVXFTCJKPC-CQSZACIVSA-N 0 0 377.441 3.456 20 5 GGBDRN CN(c1ccccc1)C1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000171758724 1425813158 /nfs/dbraw/zinc/81/31/58/1425813158.db2.gz HVSRMCLDSBVDBV-OAQYLSRUSA-N 0 0 394.475 3.301 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](c1ccccc1)c1cccnc1 ZINC000171768886 1425815579 /nfs/dbraw/zinc/81/55/79/1425815579.db2.gz XAGVQGIAUODLQV-LJQANCHMSA-N 0 0 399.428 3.066 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)c(F)c1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171796569 1425822711 /nfs/dbraw/zinc/82/27/11/1425822711.db2.gz VOHMLDFMVCFBLL-UHFFFAOYSA-N 0 0 393.334 3.013 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCCC2(CCCCC2)C1 ZINC000171796253 1425822795 /nfs/dbraw/zinc/82/27/95/1425822795.db2.gz GAFADEPXBCGTES-UHFFFAOYSA-N 0 0 375.425 3.115 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)COc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000171804284 1425824867 /nfs/dbraw/zinc/82/48/67/1425824867.db2.gz DCXXLGKCFUZYSG-SECBINFHSA-N 0 0 386.330 3.096 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(OCC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000171804410 1425824950 /nfs/dbraw/zinc/82/49/50/1425824950.db2.gz FFBIJJNNAGJNNV-VIFPVBQESA-N 0 0 386.330 3.312 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ncc(Cc3ccc(F)cc3F)s2)c1[N+](=O)[O-] ZINC000171804324 1425825006 /nfs/dbraw/zinc/82/50/06/1425825006.db2.gz XWVRJRTUTJPIGS-UHFFFAOYSA-N 0 0 393.375 3.458 20 5 GGBDRN CCCc1n[nH]c(C(=O)NCc2ccc(Oc3ccccc3)nc2)c1[N+](=O)[O-] ZINC000171806806 1425825311 /nfs/dbraw/zinc/82/53/11/1425825311.db2.gz HHNZEWBFNFFYNE-UHFFFAOYSA-N 0 0 381.392 3.388 20 5 GGBDRN CCc1n[nH]c(C(=O)NC[C@@H](C)CSc2ccccc2OC)c1[N+](=O)[O-] ZINC000171809641 1425826434 /nfs/dbraw/zinc/82/64/34/1425826434.db2.gz ICBNISUCXHDLDY-LLVKDONJSA-N 0 0 378.454 3.047 20 5 GGBDRN O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)c1cc2ccccc2c2cccnc12 ZINC000171816358 1425828067 /nfs/dbraw/zinc/82/80/67/1425828067.db2.gz FPMVTXHCSOOJPT-MRXNPFEDSA-N 0 0 387.361 3.281 20 5 GGBDRN CCN(CC(=O)Nc1ccccc1OC)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000171822774 1425829483 /nfs/dbraw/zinc/82/94/83/1425829483.db2.gz GCKCAMHWXJHNDJ-UHFFFAOYSA-N 0 0 391.811 3.358 20 5 GGBDRN Cc1cc(NC(=O)C2CCN(c3ccc4ncccc4c3[N+](=O)[O-])CC2)no1 ZINC000171829734 1425830679 /nfs/dbraw/zinc/83/06/79/1425830679.db2.gz WVNJGMIBFZXNPU-UHFFFAOYSA-N 0 0 381.392 3.295 20 5 GGBDRN C[C@H](NC(=O)NCCCC(=O)N1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000171838397 1425832219 /nfs/dbraw/zinc/83/22/19/1425832219.db2.gz NFFLNOUJKZQSOX-HNNXBMFYSA-N 0 0 396.447 3.325 20 5 GGBDRN C[C@H](Cc1cccs1)NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171842138 1425833290 /nfs/dbraw/zinc/83/32/90/1425833290.db2.gz IGHMGJTVJWGGAB-DGCLKSJQSA-N 0 0 393.490 3.070 20 5 GGBDRN O=C(Oc1cccc2ncccc21)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000171843452 1425833390 /nfs/dbraw/zinc/83/33/90/1425833390.db2.gz QADHFLYVBLAACJ-AWEZNQCLSA-N 0 0 397.412 3.415 20 5 GGBDRN O=C(NCc1ccccc1N1CCOCC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000171844404 1425833690 /nfs/dbraw/zinc/83/36/90/1425833690.db2.gz DIHBAEXWGRJEDE-UHFFFAOYSA-N 0 0 375.812 3.015 20 5 GGBDRN CCc1nc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)sc1C ZINC000171847869 1425834268 /nfs/dbraw/zinc/83/42/68/1425834268.db2.gz KDMKXZHXTCNWKK-NSHDSACASA-N 0 0 394.478 3.227 20 5 GGBDRN CCc1nc([C@H](C)NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000171857700 1425836744 /nfs/dbraw/zinc/83/67/44/1425836744.db2.gz VMRRVTFFOFCOSC-ZDUSSCGKSA-N 0 0 389.481 3.207 20 5 GGBDRN O=C(Nc1cccc(-c2cc[nH]n2)c1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171862749 1425837535 /nfs/dbraw/zinc/83/75/35/1425837535.db2.gz VBXHOURYPWGIIT-UHFFFAOYSA-N 0 0 375.344 3.079 20 5 GGBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171869090 1425839139 /nfs/dbraw/zinc/83/91/39/1425839139.db2.gz GBQSSFRQHKIKNY-UYAOXDASSA-N 0 0 393.399 3.086 20 5 GGBDRN Cc1cccc2c1CCN(C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)C2 ZINC000171867933 1425839146 /nfs/dbraw/zinc/83/91/46/1425839146.db2.gz NFYNXXWAHZJIMA-INIZCTEOSA-N 0 0 399.472 3.154 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000171869089 1425839165 /nfs/dbraw/zinc/83/91/65/1425839165.db2.gz GBQSSFRQHKIKNY-QUCCMNQESA-N 0 0 393.399 3.086 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000171872509 1425839913 /nfs/dbraw/zinc/83/99/13/1425839913.db2.gz ZCRSXGHFDWPKOE-UHFFFAOYSA-N 0 0 383.429 3.278 20 5 GGBDRN COC(=O)[C@H]1CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000171889598 1425844509 /nfs/dbraw/zinc/84/45/09/1425844509.db2.gz MFDPHSMXNOWZJR-KRWDZBQOSA-N 0 0 383.404 3.090 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CC=C(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000171913700 1425850809 /nfs/dbraw/zinc/85/08/09/1425850809.db2.gz CECGAJRPQFOBSM-UHFFFAOYSA-N 0 0 384.363 3.241 20 5 GGBDRN CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000171913684 1425850823 /nfs/dbraw/zinc/85/08/23/1425850823.db2.gz FYDVNHOWJPDMBG-QGZVFWFLSA-N 0 0 390.823 3.495 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000171916787 1425852001 /nfs/dbraw/zinc/85/20/01/1425852001.db2.gz VQZHSHIVVVMOJW-UHFFFAOYSA-N 0 0 390.783 3.119 20 5 GGBDRN C[C@@H](Cc1nc2ccccc2s1)NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000171922602 1425853259 /nfs/dbraw/zinc/85/32/59/1425853259.db2.gz FTDZJXZTBUEFRH-LBPRGKRZSA-N 0 0 399.428 3.143 20 5 GGBDRN Cc1cccc2c1CCN(c1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C2 ZINC000171926178 1425854433 /nfs/dbraw/zinc/85/44/33/1425854433.db2.gz UQRRJYJQRUTQPJ-UHFFFAOYSA-N 0 0 382.388 3.462 20 5 GGBDRN CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000171995503 1425869330 /nfs/dbraw/zinc/86/93/30/1425869330.db2.gz KGXUOVIAADHZAT-GOSISDBHSA-N 0 0 390.461 3.468 20 5 GGBDRN Cc1c([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cnn1C ZINC000171999042 1425870363 /nfs/dbraw/zinc/87/03/63/1425870363.db2.gz GKIRYVGWQYPPMZ-CQSZACIVSA-N 0 0 385.468 3.364 20 5 GGBDRN Cc1cc(S(=O)(=O)N(C)Cc2ccccc2N2CCCC2)ccc1[N+](=O)[O-] ZINC000172015942 1425874248 /nfs/dbraw/zinc/87/42/48/1425874248.db2.gz OFDDMRNHSNQQPQ-UHFFFAOYSA-N 0 0 389.477 3.324 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC(N(C)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000172018013 1425874633 /nfs/dbraw/zinc/87/46/33/1425874633.db2.gz KIBFBNIXPBNVFR-UHFFFAOYSA-N 0 0 389.477 3.193 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000172018891 1425875256 /nfs/dbraw/zinc/87/52/56/1425875256.db2.gz BNZDOVMNWPPBTJ-VQIMIIECSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1cc(S(=O)(=O)N(Cc2ccccc2)C[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000172018548 1425875283 /nfs/dbraw/zinc/87/52/83/1425875283.db2.gz OAFPALSVVAQKNP-QGZVFWFLSA-N 0 0 390.461 3.273 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000172018901 1425875297 /nfs/dbraw/zinc/87/52/97/1425875297.db2.gz BNZDOVMNWPPBTJ-APWZRJJASA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1cc(S(=O)(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000172018895 1425875301 /nfs/dbraw/zinc/87/53/01/1425875301.db2.gz BNZDOVMNWPPBTJ-LPHOPBHVSA-N 0 0 390.461 3.349 20 5 GGBDRN Cc1cc(S(=O)(=O)NCc2cccc(OCC(F)F)c2)ccc1[N+](=O)[O-] ZINC000172019917 1425875708 /nfs/dbraw/zinc/87/57/08/1425875708.db2.gz LVLLGZXYPOXOPW-UHFFFAOYSA-N 0 0 386.376 3.026 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000172019904 1425875728 /nfs/dbraw/zinc/87/57/28/1425875728.db2.gz XKJYWWKHWUVXGM-QZTJIDSGSA-N 0 0 376.434 3.102 20 5 GGBDRN C[C@@H](c1ccccc1)N1C(=O)C(=O)N(Cc2cc([N+](=O)[O-])ccc2Cl)C1=O ZINC000172023838 1425876273 /nfs/dbraw/zinc/87/62/73/1425876273.db2.gz DQJABUJRCGDFMD-NSHDSACASA-N 0 0 387.779 3.300 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@@H](c2ccccc2)c2cccnc2)ccc1[N+](=O)[O-] ZINC000172021144 1425876320 /nfs/dbraw/zinc/87/63/20/1425876320.db2.gz SDBAFJQLJXADRC-IBGZPJMESA-N 0 0 383.429 3.366 20 5 GGBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172024591 1425876756 /nfs/dbraw/zinc/87/67/56/1425876756.db2.gz JQVOVKUISRIGGX-UHFFFAOYSA-N 0 0 376.712 3.021 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000172025946 1425877282 /nfs/dbraw/zinc/87/72/82/1425877282.db2.gz XJDOXMVICONGSE-LLVKDONJSA-N 0 0 377.372 3.312 20 5 GGBDRN C[C@H](NC(=O)NC[C@](C)(O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000172027890 1425877651 /nfs/dbraw/zinc/87/76/51/1425877651.db2.gz QBGDFBDGHRCEAW-VOJFVSQTSA-N 0 0 379.363 3.141 20 5 GGBDRN C[C@@H](NC(=O)NC[C@](C)(O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000172027893 1425877719 /nfs/dbraw/zinc/87/77/19/1425877719.db2.gz QBGDFBDGHRCEAW-ZMZPIMSZSA-N 0 0 379.363 3.141 20 5 GGBDRN CC(C)Oc1cccc([C@H](O)CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000172062374 1425886404 /nfs/dbraw/zinc/88/64/04/1425886404.db2.gz IVJQBLBWZFVHBU-AUUYWEPGSA-N 0 0 387.436 3.476 20 5 GGBDRN CCc1nc(COc2ccc(C(=O)NCc3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000172067029 1425887964 /nfs/dbraw/zinc/88/79/64/1425887964.db2.gz UTWKSBDLGQPLHI-UHFFFAOYSA-N 0 0 382.376 3.049 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1cc(F)cc2c1OCOC2 ZINC000172068560 1425887990 /nfs/dbraw/zinc/88/79/90/1425887990.db2.gz ZEOOLKFUZKIGHU-UHFFFAOYSA-N 0 0 380.759 3.113 20 5 GGBDRN O=C(N[C@H]1CCCN(c2ccccc2)C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172081957 1425892535 /nfs/dbraw/zinc/89/25/35/1425892535.db2.gz WJEMRFZEZZTZSI-KRWDZBQOSA-N 0 0 391.431 3.179 20 5 GGBDRN Cc1c(CS(C)(=O)=O)cccc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000172109070 1425898146 /nfs/dbraw/zinc/89/81/46/1425898146.db2.gz CEGCUCRUGNCMAQ-ZDUSSCGKSA-N 0 0 391.449 3.331 20 5 GGBDRN COC(=O)Cc1csc(N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000172110961 1425898821 /nfs/dbraw/zinc/89/88/21/1425898821.db2.gz WKRKDAJYXLENNL-UHFFFAOYSA-N 0 0 391.430 3.258 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N(Cc1ccncc1)C[C@@H]1CCCO1 ZINC000172115173 1425900331 /nfs/dbraw/zinc/90/03/31/1425900331.db2.gz RWZDFDHJMOAXCT-KRWDZBQOSA-N 0 0 389.839 3.394 20 5 GGBDRN CC(C)[C@@H](C)N(CC(F)(F)F)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000172130091 1425908674 /nfs/dbraw/zinc/90/86/74/1425908674.db2.gz YLYCPTWOCBCXOA-SNVBAGLBSA-N 0 0 396.387 3.047 20 5 GGBDRN C[C@@H](NC(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000172139007 1425912616 /nfs/dbraw/zinc/91/26/16/1425912616.db2.gz SZMHVROBJVOKAH-DNVCBOLYSA-N 0 0 396.447 3.493 20 5 GGBDRN C[C@H](NC(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000172139013 1425912674 /nfs/dbraw/zinc/91/26/74/1425912674.db2.gz SZMHVROBJVOKAH-KXBFYZLASA-N 0 0 396.447 3.493 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1 ZINC000172140802 1425914601 /nfs/dbraw/zinc/91/46/01/1425914601.db2.gz LKZVHKYCEOPKMR-LJQANCHMSA-N 0 0 398.463 3.414 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)[C@H]1CCCN(c2ccccc2)C1 ZINC000172140806 1425914739 /nfs/dbraw/zinc/91/47/39/1425914739.db2.gz LKZVHKYCEOPKMR-IBGZPJMESA-N 0 0 398.463 3.414 20 5 GGBDRN O=C(NCCc1ccc2c(c1)CCO2)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000172149021 1425920188 /nfs/dbraw/zinc/92/01/88/1425920188.db2.gz FFIBKJWJQNRSES-UHFFFAOYSA-N 0 0 391.221 3.265 20 5 GGBDRN CCOc1cc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)ccc1OC ZINC000172150364 1425922366 /nfs/dbraw/zinc/92/23/66/1425922366.db2.gz 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/nfs/dbraw/zinc/15/33/53/1426153353.db2.gz LPDQYGHYCVDXSJ-UHFFFAOYSA-N 0 0 388.371 3.497 20 5 GGBDRN CC(C)CNC(=O)N1CCC[C@H](CC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000172717788 1426157622 /nfs/dbraw/zinc/15/76/22/1426157622.db2.gz WFIIIYNXKDAOMS-MRXNPFEDSA-N 0 0 390.484 3.021 20 5 GGBDRN COc1ccc2c(c1)N(C(=O)c1ccc(-n3ccnc3)c([N+](=O)[O-])c1)C[C@@H](C)O2 ZINC000172717735 1426157956 /nfs/dbraw/zinc/15/79/56/1426157956.db2.gz PMWFTJNHAGSWGG-CYBMUJFWSA-N 0 0 394.387 3.217 20 5 GGBDRN O=C(Nc1ccc(F)cc1OC(F)F)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000172722179 1426160191 /nfs/dbraw/zinc/16/01/91/1426160191.db2.gz HRSXEXSGMPRRCO-UHFFFAOYSA-N 0 0 393.281 3.168 20 5 GGBDRN COCCOCc1cc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)ccc1F ZINC000172723763 1426160907 /nfs/dbraw/zinc/16/09/07/1426160907.db2.gz YYBPNPLPWMNCGV-UHFFFAOYSA-N 0 0 384.310 3.427 20 5 GGBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H](c1cccc(F)c1)N1CCOCC1 ZINC000172723746 1426160989 /nfs/dbraw/zinc/16/09/89/1426160989.db2.gz 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GGBDRN C[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)Oc1cccc(F)c1 ZINC000172747739 1426172396 /nfs/dbraw/zinc/17/23/96/1426172396.db2.gz ZGANSBFPIUDQFN-ZDUSSCGKSA-N 0 0 384.367 3.117 20 5 GGBDRN Cn1c(CCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)nc2ccc(F)cc21 ZINC000172761987 1426176335 /nfs/dbraw/zinc/17/63/35/1426176335.db2.gz UZSQACKCZKIGNJ-UHFFFAOYSA-N 0 0 383.383 3.160 20 5 GGBDRN O=C1CCCN1C[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccccc1 ZINC000172765575 1426177457 /nfs/dbraw/zinc/17/74/57/1426177457.db2.gz OSKKAMYUHNVYQT-SFHVURJKSA-N 0 0 394.431 3.255 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C(=O)Nc2nccs2)cc1 ZINC000172768240 1426179052 /nfs/dbraw/zinc/17/90/52/1426179052.db2.gz XGNISUHQFXZWLT-UHFFFAOYSA-N 0 0 382.401 3.485 20 5 GGBDRN Cc1ccc(N2CC[C@@H](Nc3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)C2=O)cc1 ZINC000172770597 1426179902 /nfs/dbraw/zinc/17/99/02/1426179902.db2.gz PCVUTVXFASZXOY-OAHLLOKOSA-N 0 0 380.404 3.005 20 5 GGBDRN Cc1ccc(N2CC[C@H](Nc3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)C2=O)cc1 ZINC000172770591 1426180049 /nfs/dbraw/zinc/18/00/49/1426180049.db2.gz PCVUTVXFASZXOY-HNNXBMFYSA-N 0 0 380.404 3.005 20 5 GGBDRN O=C1CN(c2ccc([N+](=O)[O-])c3cnccc32)CCN1Cc1cccc(F)c1 ZINC000172770356 1426180157 /nfs/dbraw/zinc/18/01/57/1426180157.db2.gz WVAITUNPDMLFOW-UHFFFAOYSA-N 0 0 380.379 3.131 20 5 GGBDRN CCOC(=O)c1ccnc(NCCc2ccn(-c3ccc(F)cc3)n2)c1[N+](=O)[O-] ZINC000172777432 1426183332 /nfs/dbraw/zinc/18/33/32/1426183332.db2.gz QFEZOSFZSNTVPI-UHFFFAOYSA-N 0 0 399.382 3.146 20 5 GGBDRN C[C@@H](C(=O)Nc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1)n1cccn1 ZINC000172785083 1426186854 /nfs/dbraw/zinc/18/68/54/1426186854.db2.gz QGXBEVKMFSDZGF-AWEZNQCLSA-N 0 0 393.403 3.172 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000172786645 1426188244 /nfs/dbraw/zinc/18/82/44/1426188244.db2.gz LTEIGBJDUSQUPY-UHFFFAOYSA-N 0 0 385.420 3.403 20 5 GGBDRN C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000172788424 1426189043 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SEWWBQFGSZEJNO-SFHVURJKSA-N 0 0 384.432 3.429 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000172805961 1426197822 /nfs/dbraw/zinc/19/78/22/1426197822.db2.gz NYSXRAVHTCRFTQ-OAHLLOKOSA-N 0 0 385.376 3.182 20 5 GGBDRN Cc1cnc(N(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000172807684 1426198577 /nfs/dbraw/zinc/19/85/77/1426198577.db2.gz GJSDKKIHXMCZMQ-ZDUSSCGKSA-N 0 0 385.342 3.193 20 5 GGBDRN COc1cccc(Cl)c1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000172807920 1426198611 /nfs/dbraw/zinc/19/86/11/1426198611.db2.gz OWYPGNCXPCKTKM-UHFFFAOYSA-N 0 0 375.812 3.219 20 5 GGBDRN CCOC(=O)c1ccnc(NCCc2nc(C(F)(F)F)cs2)c1[N+](=O)[O-] ZINC000172808727 1426199275 /nfs/dbraw/zinc/19/92/75/1426199275.db2.gz YRFOGOUXHMNKEB-UHFFFAOYSA-N 0 0 390.343 3.296 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1 ZINC000172812786 1426200979 /nfs/dbraw/zinc/20/09/79/1426200979.db2.gz YKPKEISXSGLYQG-UHFFFAOYSA-N 0 0 397.431 3.231 20 5 GGBDRN COc1cc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)ccc1OCC(F)(F)F ZINC000172820085 1426203957 /nfs/dbraw/zinc/20/39/57/1426203957.db2.gz NTUUANJWENBQQP-UHFFFAOYSA-N 0 0 398.337 3.403 20 5 GGBDRN C[C@@H]1CN(Cc2ccccc2NC(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000172824203 1426206127 /nfs/dbraw/zinc/20/61/27/1426206127.db2.gz ALRATPUAKFOYIT-IYBDPMFKSA-N 0 0 383.448 3.385 20 5 GGBDRN O=C(Nc1ccc(F)cc1OC(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000172829042 1426207547 /nfs/dbraw/zinc/20/75/47/1426207547.db2.gz WWMBZAVHZDJSAO-UHFFFAOYSA-N 0 0 393.277 3.429 20 5 GGBDRN CN(C(=O)COC(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCc2ccccc21 ZINC000172833349 1426210079 /nfs/dbraw/zinc/21/00/79/1426210079.db2.gz BKBKERAIYAKKTP-LJQANCHMSA-N 0 0 382.416 3.217 20 5 GGBDRN Cc1nn(CCC(=O)NC[C@@H](C)Oc2cccc(Cl)c2)c(C)c1[N+](=O)[O-] ZINC000172837083 1426211651 /nfs/dbraw/zinc/21/16/51/1426211651.db2.gz PFNZBVGTRZKXKQ-LLVKDONJSA-N 0 0 380.832 3.035 20 5 GGBDRN Cc1nn(CCC(=O)NC[C@H](C)Oc2cccc(Cl)c2)c(C)c1[N+](=O)[O-] ZINC000172837089 1426211672 /nfs/dbraw/zinc/21/16/72/1426211672.db2.gz PFNZBVGTRZKXKQ-NSHDSACASA-N 0 0 380.832 3.035 20 5 GGBDRN COCCOCc1cc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000172836342 1426211695 /nfs/dbraw/zinc/21/16/95/1426211695.db2.gz ODRADZJYSWTEHF-CYBMUJFWSA-N 0 0 376.384 3.388 20 5 GGBDRN CC[C@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C ZINC000172839758 1426214122 /nfs/dbraw/zinc/21/41/22/1426214122.db2.gz YAEPMOCAECAIGM-KRWDZBQOSA-N 0 0 399.447 3.251 20 5 GGBDRN Cc1ccc([C@@H](CNC(=O)c2cc(C)ccc2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000172847237 1426216828 /nfs/dbraw/zinc/21/68/28/1426216828.db2.gz ITYVOBKGABJLIH-HXUWFJFHSA-N 0 0 383.448 3.015 20 5 GGBDRN Cc1cc(C)cc(C[C@H](C)NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000172851084 1426219519 /nfs/dbraw/zinc/21/95/19/1426219519.db2.gz BUXGFDGUDQJUOC-JKSUJKDBSA-N 0 0 383.448 3.077 20 5 GGBDRN Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000172851091 1426219921 /nfs/dbraw/zinc/21/99/21/1426219921.db2.gz BUXGFDGUDQJUOC-CVEARBPZSA-N 0 0 383.448 3.077 20 5 GGBDRN CCNc1ccc(S(=O)(=O)N(C)C)cc1NCc1cccc([N+](=O)[O-])c1C ZINC000172853574 1426221265 /nfs/dbraw/zinc/22/12/65/1426221265.db2.gz QSAGPFFCSIZVNS-UHFFFAOYSA-N 0 0 392.481 3.197 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2)c([N+](=O)[O-])cc1OC ZINC000172856618 1426222472 /nfs/dbraw/zinc/22/24/72/1426222472.db2.gz MPRCMSMYFRUIMJ-HNNXBMFYSA-N 0 0 399.447 3.319 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1 ZINC000172862745 1426227226 /nfs/dbraw/zinc/22/72/26/1426227226.db2.gz SEDZUACOVMBFAR-HUUCEWRRSA-N 0 0 397.431 3.405 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 ZINC000172862789 1426227422 /nfs/dbraw/zinc/22/74/22/1426227422.db2.gz KAAAPMBSWOKCLN-HUUCEWRRSA-N 0 0 397.431 3.025 20 5 GGBDRN C[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000172865837 1426229044 /nfs/dbraw/zinc/22/90/44/1426229044.db2.gz DDMFSZSGASQCDQ-ZDUSSCGKSA-N 0 0 388.855 3.349 20 5 GGBDRN CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000172870691 1426231341 /nfs/dbraw/zinc/23/13/41/1426231341.db2.gz BEVKHTGYSLTFBA-INIZCTEOSA-N 0 0 397.431 3.291 20 5 GGBDRN CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000172870697 1426231636 /nfs/dbraw/zinc/23/16/36/1426231636.db2.gz BEVKHTGYSLTFBA-MRXNPFEDSA-N 0 0 397.431 3.291 20 5 GGBDRN COc1cccc(O[C@@H](C)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 ZINC000172872472 1426232323 /nfs/dbraw/zinc/23/23/23/1426232323.db2.gz MWCLNVMHQAXXHW-HNNXBMFYSA-N 0 0 399.447 3.401 20 5 GGBDRN COc1cccc(O[C@H](C)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 ZINC000172872476 1426232516 /nfs/dbraw/zinc/23/25/16/1426232516.db2.gz MWCLNVMHQAXXHW-OAHLLOKOSA-N 0 0 399.447 3.401 20 5 GGBDRN CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CC2 ZINC000172875465 1426234280 /nfs/dbraw/zinc/23/42/80/1426234280.db2.gz NUDSFOWDBCLYHA-IAGOWNOFSA-N 0 0 390.461 3.202 20 5 GGBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1cccc(C(=O)N2CCOCC2)c1 ZINC000172879273 1426235693 /nfs/dbraw/zinc/23/56/93/1426235693.db2.gz QICXOAAORMVQJH-UHFFFAOYSA-N 0 0 399.447 3.467 20 5 GGBDRN COCCNC(=O)c1ccc(NCc2cc(F)ccc2[N+](=O)[O-])cc1Cl ZINC000172882732 1426237560 /nfs/dbraw/zinc/23/75/60/1426237560.db2.gz GTKFFOGGKJVZHW-UHFFFAOYSA-N 0 0 381.791 3.376 20 5 GGBDRN O=C(c1ccc(NCc2cccc([N+](=O)[O-])c2)cc1Cl)N1CCOCC1 ZINC000172884165 1426238617 /nfs/dbraw/zinc/23/86/17/1426238617.db2.gz YLRTUUPPFKTBLG-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN COc1cccc(CN(C[C@H]2CCCO2)C(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000172889470 1426241505 /nfs/dbraw/zinc/24/15/05/1426241505.db2.gz XDFDPOCZLJMISX-HXUWFJFHSA-N 0 0 384.432 3.354 20 5 GGBDRN COc1cccc(CN(C[C@@H]2CCCO2)C(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000172889464 1426241594 /nfs/dbraw/zinc/24/15/94/1426241594.db2.gz XDFDPOCZLJMISX-FQEVSTJZSA-N 0 0 384.432 3.354 20 5 GGBDRN Cc1cccc(N2CCN(Cn3cc([N+](=O)[O-])c(-c4ccncc4)n3)CC2)c1C ZINC000172891574 1426242237 /nfs/dbraw/zinc/24/22/37/1426242237.db2.gz HJLRHAQWGSRJNN-UHFFFAOYSA-N 0 0 392.463 3.250 20 5 GGBDRN Cc1cc(F)c(S(=O)(=O)N2C[C@@H](C)Oc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000172897677 1426244417 /nfs/dbraw/zinc/24/44/17/1426244417.db2.gz YJQZTBZZECNTKK-SNVBAGLBSA-N 0 0 384.360 3.158 20 5 GGBDRN C[C@]1(C(=O)NCc2cccc([N+](=O)[O-])c2)CCCN(C(=O)c2ccccc2)C1 ZINC000172896546 1426244443 /nfs/dbraw/zinc/24/44/43/1426244443.db2.gz XUEMAKCGRXMHCY-NRFANRHFSA-N 0 0 381.432 3.154 20 5 GGBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccccc1OCC(F)(F)F ZINC000172897012 1426244479 /nfs/dbraw/zinc/24/44/79/1426244479.db2.gz RPIICXXYSJCARM-UHFFFAOYSA-N 0 0 380.278 3.332 20 5 GGBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccc(F)cc2O1 ZINC000172897897 1426244908 /nfs/dbraw/zinc/24/49/08/1426244908.db2.gz GIARVXUCGKKAIO-VIFPVBQESA-N 0 0 386.788 3.364 20 5 GGBDRN CCOc1ccc2c(c1)CN(Cn1cc([N+](=O)[O-])c(-c3ccncc3)n1)CC2 ZINC000172898689 1426245101 /nfs/dbraw/zinc/24/51/01/1426245101.db2.gz WOYMNMACNBDGKS-UHFFFAOYSA-N 0 0 379.420 3.268 20 5 GGBDRN COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000172903094 1426249891 /nfs/dbraw/zinc/24/98/91/1426249891.db2.gz XEJPLBLMWSPTKI-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN COc1ccccc1O[C@H](C)CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000172904456 1426250126 /nfs/dbraw/zinc/25/01/26/1426250126.db2.gz ZNTZXLNPSSSQDE-OAHLLOKOSA-N 0 0 399.447 3.401 20 5 GGBDRN COc1ccccc1O[C@@H](C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172909575 1426254912 /nfs/dbraw/zinc/25/49/12/1426254912.db2.gz IIGSLRXCJJOOTJ-LBPRGKRZSA-N 0 0 378.812 3.383 20 5 GGBDRN Cc1ccc(NCc2cc(F)ccc2[N+](=O)[O-])c(C)c1S(=O)(=O)NC1CC1 ZINC000172915837 1426260533 /nfs/dbraw/zinc/26/05/33/1426260533.db2.gz DOBXBSBGCGKCQJ-UHFFFAOYSA-N 0 0 393.440 3.404 20 5 GGBDRN Cc1c(NC(=O)Cc2cccc([N+](=O)[O-])c2)cccc1C(=O)N1CCSCC1 ZINC000172921015 1426264653 /nfs/dbraw/zinc/26/46/53/1426264653.db2.gz CZMNONHTPSQYES-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN O=C(CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(F)c1 ZINC000172925706 1426266197 /nfs/dbraw/zinc/26/61/97/1426266197.db2.gz KSXKAGBCSGRHBN-UHFFFAOYSA-N 0 0 385.273 3.121 20 5 GGBDRN CN(CC(=O)Nc1cccc(CN2CCCCC2=O)c1)c1ccccc1[N+](=O)[O-] ZINC000172929379 1426268186 /nfs/dbraw/zinc/26/81/86/1426268186.db2.gz LVKZFZRTMFMJKH-UHFFFAOYSA-N 0 0 396.447 3.182 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2nc(-c3cccnc3)no2)C(C)C)c1 ZINC000172939081 1426274866 /nfs/dbraw/zinc/27/48/66/1426274866.db2.gz XWQWGDSCTDZIGR-INIZCTEOSA-N 0 0 381.392 3.475 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H](C)CO1 ZINC000172950158 1426281254 /nfs/dbraw/zinc/28/12/54/1426281254.db2.gz PLLCQRSKTPQUHY-KUHUBIRLSA-N 0 0 383.404 3.231 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)c1 ZINC000172962566 1426284550 /nfs/dbraw/zinc/28/45/50/1426284550.db2.gz FVPMIOHJDQHRFW-UHFFFAOYSA-N 0 0 379.372 3.162 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Oc2cccc(NC(=O)c3cnn(C)c3)c2)c1 ZINC000172960314 1426284713 /nfs/dbraw/zinc/28/47/13/1426284713.db2.gz XRVZTUJYLHBJAI-UHFFFAOYSA-N 0 0 380.360 3.108 20 5 GGBDRN CC(C)(C)c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)n(-c2ncccn2)n1 ZINC000172961914 1426284752 /nfs/dbraw/zinc/28/47/52/1426284752.db2.gz HUPGEEZDEMMCAO-UHFFFAOYSA-N 0 0 380.408 3.049 20 5 GGBDRN COCCNC(=O)c1ccc(Cl)c(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000172965927 1426286538 /nfs/dbraw/zinc/28/65/38/1426286538.db2.gz FIESNHUPQJPUKQ-UHFFFAOYSA-N 0 0 391.811 3.185 20 5 GGBDRN Cc1ccc(-c2ocnc2C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000172966613 1426286970 /nfs/dbraw/zinc/28/69/70/1426286970.db2.gz PTTJJRAUYINLAJ-UHFFFAOYSA-N 0 0 381.344 3.354 20 5 GGBDRN CC(C)COC[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000172966600 1426287019 /nfs/dbraw/zinc/28/70/19/1426287019.db2.gz QOSRIZJRAZGCMT-OAHLLOKOSA-N 0 0 375.425 3.154 20 5 GGBDRN Cc1c(C(=O)N2CCc3c(cccc3N3CCOC3=O)C2)cccc1[N+](=O)[O-] ZINC000172986048 1426295527 /nfs/dbraw/zinc/29/55/27/1426295527.db2.gz OVKMALXGIRCHLD-UHFFFAOYSA-N 0 0 381.388 3.058 20 5 GGBDRN CCC[C@@H]1[C@H](C)CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000172992507 1426299288 /nfs/dbraw/zinc/29/92/88/1426299288.db2.gz SIQLGUPULYRNPP-TZMCWYRMSA-N 0 0 381.860 3.405 20 5 GGBDRN CCC[C@H]1[C@@H](C)CCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000172992522 1426299347 /nfs/dbraw/zinc/29/93/47/1426299347.db2.gz SIQLGUPULYRNPP-JSGCOSHPSA-N 0 0 381.860 3.405 20 5 GGBDRN CCC[C@H]1[C@@H](C)CCCN1C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O ZINC000172992889 1426300327 /nfs/dbraw/zinc/30/03/27/1426300327.db2.gz QIBQOZBRCQNHHS-HOCLYGCPSA-N 0 0 398.463 3.490 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2F)c1 ZINC000173005173 1426304870 /nfs/dbraw/zinc/30/48/70/1426304870.db2.gz ICOILYDWZDVEPX-MRXNPFEDSA-N 0 0 389.408 3.196 20 5 GGBDRN O=[N+]([O-])c1ccc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)cc1-c1nnn[n-]1 ZINC000826499025 1426305843 /nfs/dbraw/zinc/30/58/43/1426305843.db2.gz SCAKGERJPQLLFB-INIZCTEOSA-N 0 0 383.412 3.007 20 5 GGBDRN CN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000173011108 1426307327 /nfs/dbraw/zinc/30/73/27/1426307327.db2.gz OHHHUFJEWXBQAQ-QGZVFWFLSA-N 0 0 387.823 3.055 20 5 GGBDRN CC(C)(C)OC(=O)NCC1(NC(=O)Cc2cccc([N+](=O)[O-])c2)CCCC1 ZINC000173017988 1426309383 /nfs/dbraw/zinc/30/93/83/1426309383.db2.gz JUPZYCVJTQZOLQ-UHFFFAOYSA-N 0 0 377.441 3.091 20 5 GGBDRN CON(C)C(=O)c1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173043507 1426321184 /nfs/dbraw/zinc/32/11/84/1426321184.db2.gz TZPMMKRJXRSQLW-UHFFFAOYSA-N 0 0 397.309 3.499 20 5 GGBDRN CN(CC(=O)N[C@@H](c1ccccc1)c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000173052367 1426324301 /nfs/dbraw/zinc/32/43/01/1426324301.db2.gz OZODWJULCQOEIM-NRFANRHFSA-N 0 0 376.416 3.332 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000173055862 1426325605 /nfs/dbraw/zinc/32/56/05/1426325605.db2.gz UHMWYRSWQFDYKD-SANMLTNESA-N 0 0 376.434 3.051 20 5 GGBDRN CN(CC(=O)N[C@@H](c1ccccc1)c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000173057246 1426325957 /nfs/dbraw/zinc/32/59/57/1426325957.db2.gz XBALJKNXBOXBIA-NRFANRHFSA-N 0 0 376.416 3.332 20 5 GGBDRN CCO[C@@H]1C[C@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C12CCCCC2 ZINC000173062757 1426327554 /nfs/dbraw/zinc/32/75/54/1426327554.db2.gz XAKQMQDMVCSCGE-JKSUJKDBSA-N 0 0 378.473 3.042 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000173064190 1426328631 /nfs/dbraw/zinc/32/86/31/1426328631.db2.gz CXEIUIYQCXSDNL-INIZCTEOSA-N 0 0 387.823 3.260 20 5 GGBDRN O=C([C@H](c1ccccc1)N1CCCCC1=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000173080850 1426334135 /nfs/dbraw/zinc/33/41/35/1426334135.db2.gz MPEFYXSZWCPPPX-FQEVSTJZSA-N 0 0 379.416 3.238 20 5 GGBDRN O=C(c1ncoc1-c1ccc2c(c1)OCCO2)N1CCc2c1cccc2[N+](=O)[O-] ZINC000173080894 1426334347 /nfs/dbraw/zinc/33/43/47/1426334347.db2.gz OOBNEJVDTCDFED-UHFFFAOYSA-N 0 0 393.355 3.224 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)c1 ZINC000173093123 1426338787 /nfs/dbraw/zinc/33/87/87/1426338787.db2.gz KNNPQCRWXFVYGG-UHFFFAOYSA-N 0 0 385.395 3.077 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)cc21 ZINC000173112373 1426348450 /nfs/dbraw/zinc/34/84/50/1426348450.db2.gz KCVYZMRIKMYEGM-UHFFFAOYSA-N 0 0 398.444 3.026 20 5 GGBDRN CNC(=O)Cn1ccc2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc21 ZINC000173113116 1426348913 /nfs/dbraw/zinc/34/89/13/1426348913.db2.gz HOHPCJQUKPWWHC-UHFFFAOYSA-N 0 0 386.795 3.201 20 5 GGBDRN CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000173120476 1426351975 /nfs/dbraw/zinc/35/19/75/1426351975.db2.gz ILLMCVOXRKPPCC-UHFFFAOYSA-N 0 0 399.375 3.277 20 5 GGBDRN C[S@](=O)C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000173134323 1426357028 /nfs/dbraw/zinc/35/70/28/1426357028.db2.gz SVNFXZVWSWLSOT-MYUZEXMDSA-N 0 0 389.477 3.023 20 5 GGBDRN COc1ccc(OCCNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173134704 1426357107 /nfs/dbraw/zinc/35/71/07/1426357107.db2.gz JVZZENRRBVGEFE-UHFFFAOYSA-N 0 0 384.310 3.431 20 5 GGBDRN C[S@@](=O)C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000173134332 1426357300 /nfs/dbraw/zinc/35/73/00/1426357300.db2.gz SVNFXZVWSWLSOT-DNOBIOAJSA-N 0 0 389.477 3.023 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C[S@](C)=O)c1ccccc1 ZINC000173138013 1426360432 /nfs/dbraw/zinc/36/04/32/1426360432.db2.gz NBRONZHPMMCBFI-WOBZEYENSA-N 0 0 392.502 3.311 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173140782 1426361288 /nfs/dbraw/zinc/36/12/88/1426361288.db2.gz JAPLHXWKYRWEEE-QGZVFWFLSA-N 0 0 393.359 3.144 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1C[C@@H](n2cccn2)Cc2ccccc21 ZINC000173140773 1426361507 /nfs/dbraw/zinc/36/15/07/1426361507.db2.gz JAPLHXWKYRWEEE-KRWDZBQOSA-N 0 0 393.359 3.144 20 5 GGBDRN C[C@H](NC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000173142562 1426362893 /nfs/dbraw/zinc/36/28/93/1426362893.db2.gz CHLUAKAHIOOVKE-SJCJKPOMSA-N 0 0 387.823 3.479 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1C[C@H](n2cccn2)Cc2ccccc21 ZINC000173143441 1426363178 /nfs/dbraw/zinc/36/31/78/1426363178.db2.gz NWCQRGVWSYLLKG-QGZVFWFLSA-N 0 0 392.415 3.391 20 5 GGBDRN CCCCCC[C@@H](C)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000173150272 1426366559 /nfs/dbraw/zinc/36/65/59/1426366559.db2.gz YQEGTIXTQRBMPB-MRXNPFEDSA-N 0 0 375.469 3.486 20 5 GGBDRN CN(CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccccc1[N+](=O)[O-] ZINC000173150953 1426367034 /nfs/dbraw/zinc/36/70/34/1426367034.db2.gz ZTULSWQFEKBCEK-MRXNPFEDSA-N 0 0 397.431 3.166 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000173159776 1426370839 /nfs/dbraw/zinc/37/08/39/1426370839.db2.gz ZHFCQVMNMPNHDX-SECBINFHSA-N 0 0 379.298 3.147 20 5 GGBDRN C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000173159765 1426370872 /nfs/dbraw/zinc/37/08/72/1426370872.db2.gz ZHFCQVMNMPNHDX-VIFPVBQESA-N 0 0 379.298 3.147 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000173168813 1426374660 /nfs/dbraw/zinc/37/46/60/1426374660.db2.gz JNVNJRXOPVWNFT-HNNXBMFYSA-N 0 0 385.420 3.022 20 5 GGBDRN Cc1cnc([C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C2CC2)s1 ZINC000173173194 1426376853 /nfs/dbraw/zinc/37/68/53/1426376853.db2.gz LXQDUZNGOUWTQT-ZDUSSCGKSA-N 0 0 394.840 3.219 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000173173590 1426377328 /nfs/dbraw/zinc/37/73/28/1426377328.db2.gz LDZFNYNGKABTAE-UHFFFAOYSA-N 0 0 384.436 3.152 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000173190718 1426383931 /nfs/dbraw/zinc/38/39/31/1426383931.db2.gz WRLPOPPEAQLRMO-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN CN(CC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1[N+](=O)[O-] ZINC000173195910 1426386913 /nfs/dbraw/zinc/38/69/13/1426386913.db2.gz SVUXYHOTNPZWNQ-UHFFFAOYSA-N 0 0 393.447 3.314 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000173204046 1426392163 /nfs/dbraw/zinc/39/21/63/1426392163.db2.gz YJTGQAOUCPFGEO-GFCCVEGCSA-N 0 0 383.832 3.281 20 5 GGBDRN NC(=O)Nc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173209255 1426395154 /nfs/dbraw/zinc/39/51/54/1426395154.db2.gz DYPUCBPAEXPFPI-UHFFFAOYSA-N 0 0 382.298 3.034 20 5 GGBDRN CN(CC(=O)NCc1csc(-c2ccccc2)n1)c1ccccc1[N+](=O)[O-] ZINC000173216533 1426399485 /nfs/dbraw/zinc/39/94/85/1426399485.db2.gz XNMXMOMVHCKGCJ-UHFFFAOYSA-N 0 0 382.445 3.471 20 5 GGBDRN CN(CC(=O)NC[C@@H](O)c1ccc2ccccc2c1)c1ccccc1[N+](=O)[O-] ZINC000173219249 1426400523 /nfs/dbraw/zinc/40/05/23/1426400523.db2.gz WNWZHFMOMBZALK-HXUWFJFHSA-N 0 0 379.416 3.034 20 5 GGBDRN CCNC(=O)N1CCc2ccc(NC(=O)c3cc(F)c(F)cc3[N+](=O)[O-])cc21 ZINC000173228212 1426412286 /nfs/dbraw/zinc/41/22/86/1426412286.db2.gz WYQJBVOOYFUKJO-UHFFFAOYSA-N 0 0 390.346 3.217 20 5 GGBDRN Cc1cc(S(=O)(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)ccc1[N+](=O)[O-] ZINC000173230142 1426414764 /nfs/dbraw/zinc/41/47/64/1426414764.db2.gz WMGRNCUEZROQJC-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](C)c1ccc(-n2cccn2)cc1 ZINC000173230649 1426416381 /nfs/dbraw/zinc/41/63/81/1426416381.db2.gz YESGXXHTAGARPI-CQSZACIVSA-N 0 0 386.433 3.128 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])s1 ZINC000173232293 1426417888 /nfs/dbraw/zinc/41/78/88/1426417888.db2.gz QZQFVXOBVLLFTP-LLVKDONJSA-N 0 0 399.494 3.312 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCN(c2ccccc2Cl)C1=O ZINC000173246989 1426427744 /nfs/dbraw/zinc/42/77/44/1426427744.db2.gz KAIPNLHERGMFIL-MRXNPFEDSA-N 0 0 387.823 3.103 20 5 GGBDRN C[C@@H]1CCN(C)c2ccccc2N1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173251357 1426431418 /nfs/dbraw/zinc/43/14/18/1426431418.db2.gz PNLTZTYARXQOAF-CQSZACIVSA-N 0 0 392.419 3.051 20 5 GGBDRN COc1cc(C(=O)N2c3ccccc3N(C)CC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000173251451 1426431914 /nfs/dbraw/zinc/43/19/14/1426431914.db2.gz CXMXMHSYCMXADY-ZDUSSCGKSA-N 0 0 385.420 3.487 20 5 GGBDRN Cc1cc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])ccc1C(=O)NC(C)C ZINC000173257045 1426435963 /nfs/dbraw/zinc/43/59/63/1426435963.db2.gz CUMZDGFIXRFCDP-UHFFFAOYSA-N 0 0 384.436 3.116 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000173256775 1426436038 /nfs/dbraw/zinc/43/60/38/1426436038.db2.gz IQFVOELXNJYJSD-OCCSQVGLSA-N 0 0 380.422 3.358 20 5 GGBDRN Cc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1C(=O)NC(C)C ZINC000173257534 1426436872 /nfs/dbraw/zinc/43/68/72/1426436872.db2.gz PTGWXBZXPGLBSR-UHFFFAOYSA-N 0 0 384.436 3.116 20 5 GGBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC000173260777 1426439375 /nfs/dbraw/zinc/43/93/75/1426439375.db2.gz HYKKMQRGLYCIAN-CYBMUJFWSA-N 0 0 387.440 3.339 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc1[N+](=O)[O-] ZINC000173268586 1426445624 /nfs/dbraw/zinc/44/56/24/1426445624.db2.gz IYPQURHCRUGDFQ-UHFFFAOYSA-N 0 0 378.388 3.374 20 5 GGBDRN CC(C)N1C(=S)N=NC1CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000173269311 1426446633 /nfs/dbraw/zinc/44/66/33/1426446633.db2.gz FPSYUZFNKKFBJP-UHFFFAOYSA-N 0 0 389.359 3.005 20 5 GGBDRN CCSCC[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000173283063 1426458760 /nfs/dbraw/zinc/45/87/60/1426458760.db2.gz WHAQTSVSNSWJEO-YOEHRIQHSA-N 0 0 393.509 3.156 20 5 GGBDRN CCc1ccc(C(=O)N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000173288373 1426467871 /nfs/dbraw/zinc/46/78/71/1426467871.db2.gz YTUPXGMENWEYDV-ZDUSSCGKSA-N 0 0 390.461 3.394 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cc1[N+](=O)[O-] ZINC000173289207 1426467987 /nfs/dbraw/zinc/46/79/87/1426467987.db2.gz ZRRWKLATPLPUDU-UHFFFAOYSA-N 0 0 381.388 3.059 20 5 GGBDRN C[C@@H]1[C@@H](C)CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000173289618 1426469217 /nfs/dbraw/zinc/46/92/17/1426469217.db2.gz ISOKOKAXHCTMIB-VHSXEESVSA-N 0 0 377.260 3.166 20 5 GGBDRN CCc1ccc(C(=O)NCc2ccccc2CN2CCCC2=O)cc1[N+](=O)[O-] ZINC000173290779 1426470643 /nfs/dbraw/zinc/47/06/43/1426470643.db2.gz HSLYVVTYAXPTSC-UHFFFAOYSA-N 0 0 381.432 3.210 20 5 GGBDRN CC(C)=CC(=O)NCc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000173295980 1426477389 /nfs/dbraw/zinc/47/73/89/1426477389.db2.gz FROSAGKMCHAHJC-UHFFFAOYSA-N 0 0 379.416 3.380 20 5 GGBDRN Cc1ccc(NC(=O)N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC2)cc1 ZINC000173299101 1426481566 /nfs/dbraw/zinc/48/15/66/1426481566.db2.gz COAXFIQZDAMGIN-UHFFFAOYSA-N 0 0 382.420 3.202 20 5 GGBDRN Cc1ccc(C(=O)NCCNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173307478 1426489725 /nfs/dbraw/zinc/48/97/25/1426489725.db2.gz BWHBSQJLXSFMPC-UHFFFAOYSA-N 0 0 395.337 3.082 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1[N+](=O)[O-] ZINC000173310961 1426493070 /nfs/dbraw/zinc/49/30/70/1426493070.db2.gz AYTPWXCVLLZYCN-UHFFFAOYSA-N 0 0 384.392 3.028 20 5 GGBDRN COc1cccc([C@H](O)CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000173316986 1426500712 /nfs/dbraw/zinc/50/07/12/1426500712.db2.gz JYSWLWRHXOLCJJ-OAHLLOKOSA-N 0 0 384.310 3.086 20 5 GGBDRN COc1ccc(CSCC(=O)Nc2cnn(CC3CC3)c2)cc1[N+](=O)[O-] ZINC000173336690 1426516924 /nfs/dbraw/zinc/51/69/24/1426516924.db2.gz KLALKOMYZMIMRD-UHFFFAOYSA-N 0 0 376.438 3.082 20 5 GGBDRN C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000173348908 1426526397 /nfs/dbraw/zinc/52/63/97/1426526397.db2.gz QMUZDLCHLORDRW-JTQLQIEISA-N 0 0 381.310 3.371 20 5 GGBDRN CCc1ccc(C(=O)N(CCN2CCOCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000173356387 1426532159 /nfs/dbraw/zinc/53/21/59/1426532159.db2.gz GOARPHNCYVPCHT-UHFFFAOYSA-N 0 0 383.448 3.136 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3Cl)CC2)n1 ZINC000173357621 1426532838 /nfs/dbraw/zinc/53/28/38/1426532838.db2.gz VZLVVYPWFFLCQU-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1C(=O)OCc1ccccc1 ZINC000173369316 1426541675 /nfs/dbraw/zinc/54/16/75/1426541675.db2.gz ZXMPEDPRBUOQDU-IBGZPJMESA-N 0 0 397.431 3.050 20 5 GGBDRN O=[N+]([O-])c1cnn(C[C@H](O)CN(Cc2ccccc2F)c2ccc(F)cc2)c1 ZINC000173373177 1426545794 /nfs/dbraw/zinc/54/57/94/1426545794.db2.gz FRXSLTGLUWKQAG-GOSISDBHSA-N 0 0 388.374 3.137 20 5 GGBDRN CCc1ccc(C(=O)NCCCc2cc(N)n(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000173372507 1426545982 /nfs/dbraw/zinc/54/59/82/1426545982.db2.gz FJDCYUSSQWBBKH-UHFFFAOYSA-N 0 0 393.447 3.288 20 5 GGBDRN CCc1ccc(C(=O)N(C)CC(=O)Nc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000173373134 1426546202 /nfs/dbraw/zinc/54/62/02/1426546202.db2.gz VFBXLSGOEINPQP-UHFFFAOYSA-N 0 0 377.347 3.146 20 5 GGBDRN COc1ccc([C@H](C)CCNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000173379828 1426553564 /nfs/dbraw/zinc/55/35/64/1426553564.db2.gz YNQVJLUWRBNFKT-CQSZACIVSA-N 0 0 378.450 3.217 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000173384803 1426559809 /nfs/dbraw/zinc/55/98/09/1426559809.db2.gz OLNDKGXPERCCEM-CQSZACIVSA-N 0 0 376.394 3.457 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 ZINC000173387690 1426565581 /nfs/dbraw/zinc/56/55/81/1426565581.db2.gz FGZAQNFNCBPSPS-UHFFFAOYSA-N 0 0 388.815 3.027 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@@H](c2nc(C)cs2)C2CC2)cc([N+](=O)[O-])c1 ZINC000173396452 1426577095 /nfs/dbraw/zinc/57/70/95/1426577095.db2.gz VJWWAWPBJOWMRZ-CQSZACIVSA-N 0 0 375.406 3.027 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 ZINC000173400330 1426583176 /nfs/dbraw/zinc/58/31/76/1426583176.db2.gz VMOFHINKOVSLDI-OAHLLOKOSA-N 0 0 388.468 3.031 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@@H](C)Oc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000173404210 1426587707 /nfs/dbraw/zinc/58/77/07/1426587707.db2.gz AXAQNMKMEOEGNP-GFCCVEGCSA-N 0 0 391.811 3.079 20 5 GGBDRN Cc1csc([C@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C2CC2)n1 ZINC000173403913 1426587766 /nfs/dbraw/zinc/58/77/66/1426587766.db2.gz DDGOOUXBFGOIMY-CQSZACIVSA-N 0 0 376.394 3.457 20 5 GGBDRN COC(=O)c1cc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])oc1C ZINC000173410456 1426593468 /nfs/dbraw/zinc/59/34/68/1426593468.db2.gz VMCTZCVZNOPQJB-UHFFFAOYSA-N 0 0 386.282 3.232 20 5 GGBDRN Cc1cn(CN2CCC(C(F)(F)F)CC2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000173415877 1426598495 /nfs/dbraw/zinc/59/84/95/1426598495.db2.gz QLORIZZSSBTPLM-UHFFFAOYSA-N 0 0 384.358 3.087 20 5 GGBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCC(C(F)(F)F)CC1 ZINC000173417139 1426600835 /nfs/dbraw/zinc/60/08/35/1426600835.db2.gz WEYNKMWQFIZCRV-UHFFFAOYSA-N 0 0 382.342 3.050 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1 ZINC000173424139 1426606814 /nfs/dbraw/zinc/60/68/14/1426606814.db2.gz AQMQYJYDXZDIRC-DYVFJYSZSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1 ZINC000173424123 1426606993 /nfs/dbraw/zinc/60/69/93/1426606993.db2.gz AQMQYJYDXZDIRC-GUYCJALGSA-N 0 0 394.424 3.193 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1 ZINC000173425892 1426608004 /nfs/dbraw/zinc/60/80/04/1426608004.db2.gz XONPVONTBBNSOU-DYVFJYSZSA-N 0 0 394.424 3.193 20 5 GGBDRN CCOc1ccc(NC(=O)CNC(C)(C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000173428930 1426610936 /nfs/dbraw/zinc/61/09/36/1426610936.db2.gz MBSKYUARHAFARK-UHFFFAOYSA-N 0 0 378.454 3.222 20 5 GGBDRN Cn1c(C2CC2)nn(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1=S ZINC000173434670 1426616651 /nfs/dbraw/zinc/61/66/51/1426616651.db2.gz HZUYOHXXCXNFRX-UHFFFAOYSA-N 0 0 389.481 3.238 20 5 GGBDRN CCc1ccc(C(=O)Nc2cccc(C[S@@](=O)CCOC)c2)cc1[N+](=O)[O-] ZINC000173436620 1426617694 /nfs/dbraw/zinc/61/76/94/1426617694.db2.gz HFWJWJGQVRJAAA-MHZLTWQESA-N 0 0 390.461 3.305 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(Cn3cc(Br)cn3)CC2)cc1 ZINC000173435705 1426617730 /nfs/dbraw/zinc/61/77/30/1426617730.db2.gz ZANCUODTFRPXIQ-UHFFFAOYSA-N 0 0 381.230 3.055 20 5 GGBDRN C[C@@H]1CN(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)[C@@H]1c1ccccc1 ZINC000173457510 1426633888 /nfs/dbraw/zinc/63/38/88/1426633888.db2.gz KOHNQFYEXYCRQX-VFNWGFHPSA-N 0 0 376.416 3.469 20 5 GGBDRN COc1cc(F)c([C@@H](C)NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000173462268 1426636174 /nfs/dbraw/zinc/63/61/74/1426636174.db2.gz KHRMCJISCHQWRK-GFCCVEGCSA-N 0 0 391.399 3.065 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3cc(Cl)c4c(c3)OCCO4)C2)nc1 ZINC000173462483 1426636312 /nfs/dbraw/zinc/63/63/12/1426636312.db2.gz UTHVKAZTLNENIY-CYBMUJFWSA-N 0 0 390.827 3.101 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3csc(-c4ccccn4)n3)C2)nc1 ZINC000173466086 1426640687 /nfs/dbraw/zinc/64/06/87/1426640687.db2.gz SIKLDKNHNZZDCM-CYBMUJFWSA-N 0 0 382.449 3.195 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ncc(-c4ccccc4F)o3)C2)nc1 ZINC000173468189 1426643378 /nfs/dbraw/zinc/64/33/78/1426643378.db2.gz FSMRNXFCGGAUGG-CYBMUJFWSA-N 0 0 383.383 3.470 20 5 GGBDRN Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173469148 1426644358 /nfs/dbraw/zinc/64/43/58/1426644358.db2.gz LHFXHUVYEAAYIN-ULQDDVLXSA-N 0 0 397.479 3.050 20 5 GGBDRN CCO[C@H](C)c1nc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000173470047 1426645258 /nfs/dbraw/zinc/64/52/58/1426645258.db2.gz YAMKJJDQSSGORO-OLZOCXBDSA-N 0 0 377.470 3.230 20 5 GGBDRN CCOc1ccc(C(C)=O)cc1CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173470400 1426645261 /nfs/dbraw/zinc/64/52/61/1426645261.db2.gz KRKDCDXMOICCIZ-KRWDZBQOSA-N 0 0 384.436 3.278 20 5 GGBDRN C[C@@H](c1nc(Cc2ccccc2)no1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173471365 1426645856 /nfs/dbraw/zinc/64/58/56/1426645856.db2.gz NDJYCYBLDDAOIO-HOCLYGCPSA-N 0 0 394.435 3.211 20 5 GGBDRN Cc1nnnn1-c1cccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000173475943 1426650331 /nfs/dbraw/zinc/65/03/31/1426650331.db2.gz FQTLRPCZEZEGDP-UHFFFAOYSA-N 0 0 392.297 3.150 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C1 ZINC000173486270 1426659873 /nfs/dbraw/zinc/65/98/73/1426659873.db2.gz FQZKYTANQBVOGM-WBVHZDCISA-N 0 0 388.493 3.382 20 5 GGBDRN CC[C@]1(C)CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000173487985 1426660865 /nfs/dbraw/zinc/66/08/65/1426660865.db2.gz RJEBAJIYOLRKBG-FZKQIMNGSA-N 0 0 379.482 3.300 20 5 GGBDRN CCc1ccc(C(=O)N2CCn3c(nnc3-c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000173494776 1426666407 /nfs/dbraw/zinc/66/64/07/1426666407.db2.gz GJTWCJBCWHQURQ-UHFFFAOYSA-N 0 0 377.404 3.072 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2C[C@H](C)CN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000173506734 1426675729 /nfs/dbraw/zinc/67/57/29/1426675729.db2.gz JJLZORPJNDQYSL-CYBMUJFWSA-N 0 0 375.450 3.184 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](C)CN(C)c2ccccc21 ZINC000173506236 1426675898 /nfs/dbraw/zinc/67/58/98/1426675898.db2.gz JFFYAPJKWIPPCH-CYBMUJFWSA-N 0 0 375.450 3.184 20 5 GGBDRN COc1ccc(OCCN2CCO[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000173515736 1426686582 /nfs/dbraw/zinc/68/65/82/1426686582.db2.gz VAAYJBBGHUPOGF-IBGZPJMESA-N 0 0 376.384 3.195 20 5 GGBDRN COc1ccc(OCCN2CCO[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000173515753 1426686931 /nfs/dbraw/zinc/68/69/31/1426686931.db2.gz VAAYJBBGHUPOGF-LJQANCHMSA-N 0 0 376.384 3.195 20 5 GGBDRN Cc1cnc([C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000173522029 1426695452 /nfs/dbraw/zinc/69/54/52/1426695452.db2.gz NRJVEKFYTGRVKP-OAHLLOKOSA-N 0 0 375.454 3.222 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000173521882 1426695746 /nfs/dbraw/zinc/69/57/46/1426695746.db2.gz HLXQIGNJBYZMNZ-UHFFFAOYSA-N 0 0 395.337 3.293 20 5 GGBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3nc(CCc4ccccc4)no3)CC2)c1 ZINC000173526353 1426700305 /nfs/dbraw/zinc/70/03/05/1426700305.db2.gz CERRUDNYBOLGJD-UHFFFAOYSA-N 0 0 393.447 3.085 20 5 GGBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1cccc(Cl)c1 ZINC000173540182 1426714758 /nfs/dbraw/zinc/71/47/58/1426714758.db2.gz GHAVOZAKRDIMOA-KRWDZBQOSA-N 0 0 377.828 3.432 20 5 GGBDRN C[C@@H]1CN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](c2ccccc2)CO1 ZINC000173541926 1426715924 /nfs/dbraw/zinc/71/59/24/1426715924.db2.gz CCCWCMVQYKGTOO-BEFAXECRSA-N 0 0 379.420 3.273 20 5 GGBDRN COC(=O)c1cc(C(=O)Nc2cc(-c3ccccc3C)nn2C)cc([N+](=O)[O-])c1 ZINC000173543114 1426717304 /nfs/dbraw/zinc/71/73/04/1426717304.db2.gz QMFYBQDHWUYKMR-UHFFFAOYSA-N 0 0 394.387 3.343 20 5 GGBDRN CC(C)NC(=O)Nc1ccccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000173546341 1426720609 /nfs/dbraw/zinc/72/06/09/1426720609.db2.gz DTLKBUPAMWTNLF-UHFFFAOYSA-N 0 0 385.424 3.200 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000173552673 1426725998 /nfs/dbraw/zinc/72/59/98/1426725998.db2.gz UKXDSYCSHPIPSO-KRWDZBQOSA-N 0 0 379.420 3.269 20 5 GGBDRN CN(C)C(=O)Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000173557729 1426729273 /nfs/dbraw/zinc/72/92/73/1426729273.db2.gz AWEPYHDILSWTTM-UHFFFAOYSA-N 0 0 395.337 3.497 20 5 GGBDRN O=C([C@H]1SCCc2sccc21)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560094 1426730111 /nfs/dbraw/zinc/73/01/11/1426730111.db2.gz QVIMNOPKRYBLJO-BZNIZROVSA-N 0 0 390.490 3.095 20 5 GGBDRN C[C@H](CCc1cccc(F)c1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173560034 1426730338 /nfs/dbraw/zinc/73/03/38/1426730338.db2.gz FORILJSFSZTMCZ-PBHICJAKSA-N 0 0 386.427 3.411 20 5 GGBDRN C[C@@H](CCc1ccccc1F)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173559966 1426730390 /nfs/dbraw/zinc/73/03/90/1426730390.db2.gz PNZNMVRZLMREHA-HOCLYGCPSA-N 0 0 386.427 3.411 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000173570014 1426737316 /nfs/dbraw/zinc/73/73/16/1426737316.db2.gz ACORFMBCTYVIED-HXUWFJFHSA-N 0 0 389.452 3.334 20 5 GGBDRN COc1cc(CCNC(=O)N([C@@H](C)C2CC2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000173572203 1426738418 /nfs/dbraw/zinc/73/84/18/1426738418.db2.gz XXKCJXWYGDNPIH-LBPRGKRZSA-N 0 0 377.441 3.127 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000173572667 1426739252 /nfs/dbraw/zinc/73/92/52/1426739252.db2.gz QKULVOGFQNFFCK-KBPBESRZSA-N 0 0 379.457 3.375 20 5 GGBDRN COc1cc(CCNC(=O)N2CCC3(CCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000173572276 1426739302 /nfs/dbraw/zinc/73/93/02/1426739302.db2.gz SMPKNRADUXMPNP-UHFFFAOYSA-N 0 0 377.441 3.130 20 5 GGBDRN COc1cc(CCNC(=O)N2CCCC(C)(C)CC2)c([N+](=O)[O-])cc1OC ZINC000173572478 1426739452 /nfs/dbraw/zinc/73/94/52/1426739452.db2.gz MFVKGKLXYLLDDT-UHFFFAOYSA-N 0 0 379.457 3.376 20 5 GGBDRN COc1cc(CCNC(=O)N2CCC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000173572559 1426739516 /nfs/dbraw/zinc/73/95/16/1426739516.db2.gz HCKXFKOJGRWLFZ-ZFWWWQNUSA-N 0 0 377.441 3.129 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000173573884 1426741463 /nfs/dbraw/zinc/74/14/63/1426741463.db2.gz LKIULMLCSMWIDS-UZLBHIALSA-N 0 0 383.448 3.328 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](c2ccccc2C)OC[C@H]1C ZINC000173574623 1426742412 /nfs/dbraw/zinc/74/24/12/1426742412.db2.gz ISWZSRJWFAJNSX-QRWLVFNGSA-N 0 0 399.447 3.312 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000173585938 1426750046 /nfs/dbraw/zinc/75/00/46/1426750046.db2.gz DPIAMRCWWVAQQP-CQSZACIVSA-N 0 0 379.420 3.429 20 5 GGBDRN CC(=O)Nc1nc2ccc(NC(=O)CN(C)c3ccccc3[N+](=O)[O-])cc2s1 ZINC000173593151 1426755987 /nfs/dbraw/zinc/75/59/87/1426755987.db2.gz VMQYMEUBDDHTSJ-UHFFFAOYSA-N 0 0 399.432 3.238 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@H](C)CO1 ZINC000173592961 1426756612 /nfs/dbraw/zinc/75/66/12/1426756612.db2.gz JUNQFKRUHVMNKA-BEFAXECRSA-N 0 0 390.461 3.362 20 5 GGBDRN Cc1nn(CCC(=O)N2C[C@@H](C)Oc3ccc(Cl)cc32)c(C)c1[N+](=O)[O-] ZINC000173607128 1426781043 /nfs/dbraw/zinc/78/10/43/1426781043.db2.gz UNIHFFDJSYEOLR-SNVBAGLBSA-N 0 0 378.816 3.266 20 5 GGBDRN Cc1cnc([C@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C2CC2)s1 ZINC000173609185 1426784295 /nfs/dbraw/zinc/78/42/95/1426784295.db2.gz BJAXKOIDSNNXQX-CQSZACIVSA-N 0 0 376.394 3.457 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CN1CCOc2ccc(Cl)cc21 ZINC000173610820 1426786378 /nfs/dbraw/zinc/78/63/78/1426786378.db2.gz 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Cc1c(C(=O)N2C[C@H](C)[C@@H]2c2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000174020784 1426948590 /nfs/dbraw/zinc/94/85/90/1426948590.db2.gz SQXDRTYVYWEGEH-ORAYPTAESA-N 0 0 377.404 3.317 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000174020535 1426948644 /nfs/dbraw/zinc/94/86/44/1426948644.db2.gz QGWYAUVCGFWFRY-QAPCUYQASA-N 0 0 383.448 3.193 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000174020560 1426948735 /nfs/dbraw/zinc/94/87/35/1426948735.db2.gz QGWYAUVCGFWFRY-YJBOKZPZSA-N 0 0 383.448 3.193 20 5 GGBDRN CCC(CC)c1cc(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)on1 ZINC000174039979 1426962906 /nfs/dbraw/zinc/96/29/06/1426962906.db2.gz WZOKXEYIMGLDTR-UHFFFAOYSA-N 0 0 384.392 3.258 20 5 GGBDRN C[S@](=O)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000174046439 1426969398 /nfs/dbraw/zinc/96/93/98/1426969398.db2.gz RDLLEEHIKPBPRX-QFIPXVFZSA-N 0 0 383.223 3.347 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1)c1cc(N2CCNC2=O)ccc1Cl ZINC000174047222 1426970126 /nfs/dbraw/zinc/97/01/26/1426970126.db2.gz XCFLTAJXURVPGV-UHFFFAOYSA-N 0 0 375.768 3.135 20 5 GGBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@@H](C)c1ccc(Br)s1 ZINC000174047801 1426970138 /nfs/dbraw/zinc/97/01/38/1426970138.db2.gz QVBWIFLNIJZFIN-QMMMGPOBSA-N 0 0 388.243 3.271 20 5 GGBDRN Cc1ccc(C(F)(F)F)cc1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000174047631 1426970191 /nfs/dbraw/zinc/97/01/91/1426970191.db2.gz PWZPKUPVCLZGJR-UHFFFAOYSA-N 0 0 395.293 3.469 20 5 GGBDRN CC(C)[C@@H](Cc1ccc(F)cc1)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000174049896 1426971820 /nfs/dbraw/zinc/97/18/20/1426971820.db2.gz NSLLKGWSUWKKEV-GOSISDBHSA-N 0 0 380.441 3.421 20 5 GGBDRN CN(CC(=O)N1CC[C@@H](COCc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000174050232 1426971978 /nfs/dbraw/zinc/97/19/78/1426971978.db2.gz ASRQADUAJNUCOU-GOSISDBHSA-N 0 0 383.448 3.096 20 5 GGBDRN CCOc1cc(C(=O)N[C@H]2CCCC[C@@H]2n2cccn2)c([N+](=O)[O-])cc1OC ZINC000174054788 1426975111 /nfs/dbraw/zinc/97/51/11/1426975111.db2.gz IZJWPJQLYHDNRP-GJZGRUSLSA-N 0 0 388.424 3.112 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCC[C@@H]2n2cccn2)cc1OC ZINC000174056083 1426977013 /nfs/dbraw/zinc/97/70/13/1426977013.db2.gz YQTDSAFLLFDAHS-GJZGRUSLSA-N 0 0 388.424 3.112 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1/C=C1\NC(=S)N(Cc2ccccc2)C1=O ZINC000174059761 1426980225 /nfs/dbraw/zinc/98/02/25/1426980225.db2.gz FWDCUNNALXHGKL-WJDWOHSUSA-N 0 0 383.429 3.251 20 5 GGBDRN C[C@@H](NC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000174062651 1426981826 /nfs/dbraw/zinc/98/18/26/1426981826.db2.gz UJZPAFSNXAPJKI-ZBFHGGJFSA-N 0 0 388.468 3.136 20 5 GGBDRN Nc1c(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc(F)cc1[N+](=O)[O-] ZINC000174064016 1426982472 /nfs/dbraw/zinc/98/24/72/1426982472.db2.gz AAQNKUVQMDKMEW-UHFFFAOYSA-N 0 0 376.775 3.423 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)c1nc(C2CCCCC2)no1 ZINC000174067352 1426984424 /nfs/dbraw/zinc/98/44/24/1426984424.db2.gz MXSZZQCSJGFSFX-GFCCVEGCSA-N 0 0 394.453 3.373 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](C)c1nc(C2CCCCC2)no1 ZINC000174067447 1426984447 /nfs/dbraw/zinc/98/44/47/1426984447.db2.gz YXJWUAWZOPILSZ-GFCCVEGCSA-N 0 0 394.453 3.373 20 5 GGBDRN Cc1ccc(S(=O)(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)cc1[N+](=O)[O-] ZINC000174068739 1426984857 /nfs/dbraw/zinc/98/48/57/1426984857.db2.gz BPLKSJMXBIKYQS-LBPRGKRZSA-N 0 0 394.453 3.373 20 5 GGBDRN Cc1nn(C)c(C)c1CNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000174075045 1426988886 /nfs/dbraw/zinc/98/88/86/1426988886.db2.gz VQWFCZSVGKMCQS-OKILXGFUSA-N 0 0 399.495 3.357 20 5 GGBDRN CC(C)C[C@@H]1CC(=O)N(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000174080479 1426991429 /nfs/dbraw/zinc/99/14/29/1426991429.db2.gz YVXOSCRTOQBKKN-MRXNPFEDSA-N 0 0 375.469 3.290 20 5 GGBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000174092679 1426998018 /nfs/dbraw/zinc/99/80/18/1426998018.db2.gz JRUDCNWXXJLIKZ-KBXCAEBGSA-N 0 0 376.434 3.054 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000174093380 1426998594 /nfs/dbraw/zinc/99/85/94/1426998594.db2.gz BDAUBAHNDARNFC-WMLDXEAASA-N 0 0 376.434 3.054 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)Cn2ncc3cc([N+](=O)[O-])ccc32)n1 ZINC000174094183 1426999311 /nfs/dbraw/zinc/99/93/11/1426999311.db2.gz LQOGCCWEGPDDKQ-CYBMUJFWSA-N 0 0 388.428 3.151 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000174094821 1427000332 /nfs/dbraw/zinc/00/03/32/1427000332.db2.gz MOWAUMJPBZJODT-SUMWQHHRSA-N 0 0 376.434 3.054 20 5 GGBDRN C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)CO1 ZINC000174094762 1427000429 /nfs/dbraw/zinc/00/04/29/1427000429.db2.gz IVELCBUXTIBTBI-WBMJQRKESA-N 0 0 396.852 3.399 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1c2ccccc2CCc2ccccc21 ZINC000174100262 1427001976 /nfs/dbraw/zinc/00/19/76/1427001976.db2.gz MLKKXELNVGKPDH-UHFFFAOYSA-N 0 0 375.384 3.220 20 5 GGBDRN O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(Cc1ccc(F)cc1)C1CCCCC1 ZINC000174100791 1427002594 /nfs/dbraw/zinc/00/25/94/1427002594.db2.gz QVYCWAUFGYCUGW-UHFFFAOYSA-N 0 0 387.411 3.257 20 5 GGBDRN CN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(c1ccccc1)c1ccccc1 ZINC000174101160 1427002597 /nfs/dbraw/zinc/00/25/97/1427002597.db2.gz BVPPSTODGRSRIR-UHFFFAOYSA-N 0 0 377.400 3.005 20 5 GGBDRN CC[C@H](C)C[C@H](C)NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000174104227 1427004131 /nfs/dbraw/zinc/00/41/31/1427004131.db2.gz FEASSRGLDMRUQL-RYUDHWBXSA-N 0 0 377.470 3.429 20 5 GGBDRN CCc1ccc(C(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)cc1[N+](=O)[O-] ZINC000174117030 1427009215 /nfs/dbraw/zinc/00/92/15/1427009215.db2.gz QWVXJYOETVSAHP-UHFFFAOYSA-N 0 0 391.449 3.480 20 5 GGBDRN CCc1ccc(C(=O)N2CCCN(C(=O)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000174118074 1427009869 /nfs/dbraw/zinc/00/98/69/1427009869.db2.gz SWKGMAWSWNARFX-UHFFFAOYSA-N 0 0 387.461 3.207 20 5 GGBDRN CN(CCOC(=O)Cc1ccc(NC(=O)C2CC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000174117556 1427009894 /nfs/dbraw/zinc/00/98/94/1427009894.db2.gz BIZKUMMGFMQICJ-UHFFFAOYSA-N 0 0 397.431 3.165 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)s3)CC2)cc1[N+](=O)[O-] ZINC000174121597 1427011019 /nfs/dbraw/zinc/01/10/19/1427011019.db2.gz YHWPKUBXAPUNGF-UHFFFAOYSA-N 0 0 387.461 3.125 20 5 GGBDRN C[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000174126554 1427012764 /nfs/dbraw/zinc/01/27/64/1427012764.db2.gz YORZLMQBJUBBGY-CRAIPNDOSA-N 0 0 383.448 3.426 20 5 GGBDRN C[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c([O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000174126589 1427013032 /nfs/dbraw/zinc/01/30/32/1427013032.db2.gz YORZLMQBJUBBGY-YJBOKZPZSA-N 0 0 383.448 3.426 20 5 GGBDRN CCN(CC(=O)Nc1c(C)cccc1C)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000174127212 1427014015 /nfs/dbraw/zinc/01/40/15/1427014015.db2.gz ZWGGPNPXKYTYCC-UHFFFAOYSA-N 0 0 385.420 3.078 20 5 GGBDRN CCc1ccc(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000174129672 1427014345 /nfs/dbraw/zinc/01/43/45/1427014345.db2.gz YZKPXYXOLWVGBK-GOSISDBHSA-N 0 0 381.432 3.251 20 5 GGBDRN O=C(Cn1ccc2c1cccc2[N+](=O)[O-])Nc1ccc(N2CCOCC2)cc1 ZINC000174159570 1427026105 /nfs/dbraw/zinc/02/61/05/1427026105.db2.gz ISSKSAYZZMILPR-UHFFFAOYSA-N 0 0 380.404 3.025 20 5 GGBDRN Nc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)cc1[N+](=O)[O-] ZINC000174160625 1427026591 /nfs/dbraw/zinc/02/65/91/1427026591.db2.gz LYESXXLSMORDSL-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN CCc1ccc(C(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000174162317 1427028328 /nfs/dbraw/zinc/02/83/28/1427028328.db2.gz SWQXBNBXGPTLID-ZDUSSCGKSA-N 0 0 377.441 3.144 20 5 GGBDRN C[C@@H]1CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2NC1=O ZINC000174184247 1427036979 /nfs/dbraw/zinc/03/69/79/1427036979.db2.gz INTSKSVGPZOBLI-LLVKDONJSA-N 0 0 388.811 3.282 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(Cc1ccc(O)cc1)CC1CC1 ZINC000174184556 1427037181 /nfs/dbraw/zinc/03/71/81/1427037181.db2.gz AYWCSYWTRVRGKY-UHFFFAOYSA-N 0 0 385.420 3.431 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000174199083 1427046406 /nfs/dbraw/zinc/04/64/06/1427046406.db2.gz FSCGEPLIVIGORL-UHFFFAOYSA-N 0 0 386.427 3.199 20 5 GGBDRN Cc1c(C(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)cccc1[N+](=O)[O-] ZINC000174202531 1427048198 /nfs/dbraw/zinc/04/81/98/1427048198.db2.gz FAVVBBPSPKTPBW-UHFFFAOYSA-N 0 0 382.464 3.368 20 5 GGBDRN CCc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)CC2)cc1 ZINC000174208504 1427051683 /nfs/dbraw/zinc/05/16/83/1427051683.db2.gz IQAZFTONIOZZLW-UHFFFAOYSA-N 0 0 384.392 3.028 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000174219147 1427056595 /nfs/dbraw/zinc/05/65/95/1427056595.db2.gz WPXHSGBNSPMDGN-UHFFFAOYSA-N 0 0 396.369 3.357 20 5 GGBDRN CN(Cc1cccs1)C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174241523 1427065639 /nfs/dbraw/zinc/06/56/39/1427065639.db2.gz HYQQPYBMZGHTCK-UHFFFAOYSA-N 0 0 389.477 3.158 20 5 GGBDRN Cc1ccccc1CCNC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242566 1427066235 /nfs/dbraw/zinc/06/62/35/1427066235.db2.gz UBISFDQXIWMSCR-UHFFFAOYSA-N 0 0 397.475 3.105 20 5 GGBDRN COc1ccc(C)cc1NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174243891 1427066364 /nfs/dbraw/zinc/06/63/64/1427066364.db2.gz PWSLVXXPKXWKPS-UHFFFAOYSA-N 0 0 399.447 3.394 20 5 GGBDRN C[C@@H](NC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1cccs1 ZINC000174243694 1427066404 /nfs/dbraw/zinc/06/64/04/1427066404.db2.gz GKFPQGQWPISQJY-CQSZACIVSA-N 0 0 389.477 3.377 20 5 GGBDRN CN(Cc1ccccc1)C(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174247312 1427068299 /nfs/dbraw/zinc/06/82/99/1427068299.db2.gz GZEYOKXWVONQCW-UHFFFAOYSA-N 0 0 383.448 3.097 20 5 GGBDRN O=C1[C@H](N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCN1c1ccccc1 ZINC000174247661 1427069003 /nfs/dbraw/zinc/06/90/03/1427069003.db2.gz IALVGXLZFPJIHC-HXUWFJFHSA-N 0 0 381.432 3.244 20 5 GGBDRN O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)NCC1CCCCC1 ZINC000174249210 1427069420 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397.435 3.262 20 5 GGBDRN Cc1ccc(CCN(CC(F)(F)F)C(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000174300416 1427091521 /nfs/dbraw/zinc/09/15/21/1427091521.db2.gz DCIZQHBYPNBJHQ-UHFFFAOYSA-N 0 0 384.358 3.123 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000174300903 1427092099 /nfs/dbraw/zinc/09/20/99/1427092099.db2.gz VDWKLUHKRQQOTC-TZMCWYRMSA-N 0 0 387.465 3.279 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(CCc1ccc(C)cc1)CC(F)(F)F ZINC000174300687 1427092223 /nfs/dbraw/zinc/09/22/23/1427092223.db2.gz LFIFILLFXUVAFM-UHFFFAOYSA-N 0 0 384.358 3.042 20 5 GGBDRN CC(C)[C@@H]1CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCS1 ZINC000174303308 1427092946 /nfs/dbraw/zinc/09/29/46/1427092946.db2.gz BVFCYQBEXQNPOF-SFHVURJKSA-N 0 0 377.510 3.411 20 5 GGBDRN O=C(NCc1ccc[nH]1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000174313770 1427097483 /nfs/dbraw/zinc/09/74/83/1427097483.db2.gz VADVXTXXXCPXLQ-UHFFFAOYSA-N 0 0 396.369 3.475 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCc1nc(Cc2ccc(F)cc2)no1 ZINC000174327356 1427103774 /nfs/dbraw/zinc/10/37/74/1427103774.db2.gz RAFWGCWCHDCQNR-UHFFFAOYSA-N 0 0 387.323 3.073 20 5 GGBDRN CCc1nc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)sc1C ZINC000174328402 1427104056 /nfs/dbraw/zinc/10/40/56/1427104056.db2.gz YGKQCTGISUNXSW-UHFFFAOYSA-N 0 0 375.454 3.276 20 5 GGBDRN C[S@@](=O)C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000174334749 1427106544 /nfs/dbraw/zinc/10/65/44/1427106544.db2.gz GVWTYDCAMIEMJF-XGCWNURASA-N 0 0 387.461 3.019 20 5 GGBDRN C[S@](=O)C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000174334738 1427106799 /nfs/dbraw/zinc/10/67/99/1427106799.db2.gz GVWTYDCAMIEMJF-SOKVYYICSA-N 0 0 387.461 3.019 20 5 GGBDRN CCc1ccc(OC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000174337711 1427109093 /nfs/dbraw/zinc/10/90/93/1427109093.db2.gz JYPAHACTXKEVII-INIZCTEOSA-N 0 0 383.404 3.010 20 5 GGBDRN COC(=O)[C@H](CC(C)C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000174343676 1427111504 /nfs/dbraw/zinc/11/15/04/1427111504.db2.gz NJNZAGPJNPHDOA-IBGZPJMESA-N 0 0 381.428 3.286 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000174347483 1427113453 /nfs/dbraw/zinc/11/34/53/1427113453.db2.gz VTQOEIDSCJDCDK-DOTOQJQBSA-N 0 0 391.468 3.337 20 5 GGBDRN C[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)Oc1ccc(F)cc1 ZINC000174365678 1427122314 /nfs/dbraw/zinc/12/23/14/1427122314.db2.gz YZROPRDMBPLSJY-CYBMUJFWSA-N 0 0 384.367 3.117 20 5 GGBDRN Cc1nnc(-c2cccc(NC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)c2)o1 ZINC000174379217 1427129062 /nfs/dbraw/zinc/12/90/62/1427129062.db2.gz PXUVCWQZSHHYOA-UHFFFAOYSA-N 0 0 390.359 3.391 20 5 GGBDRN O=C(OC[C@H]1CCN(c2ccccc2)C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000174382591 1427130279 /nfs/dbraw/zinc/13/02/79/1427130279.db2.gz QVAPVFLDGHIFSK-INIZCTEOSA-N 0 0 392.415 3.464 20 5 GGBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000174394658 1427136703 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/nfs/dbraw/zinc/15/03/85/1427150385.db2.gz LJYCZOQFIGEKED-KSSFIOAISA-N 0 0 386.452 3.095 20 5 GGBDRN CN(C)C(=O)c1cccc(CCNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000174451816 1427162317 /nfs/dbraw/zinc/16/23/17/1427162317.db2.gz KDZJASDUPZFNRE-UHFFFAOYSA-N 0 0 390.827 3.314 20 5 GGBDRN O=C(NCc1nc2cc(F)ccc2[nH]1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000174461085 1427166972 /nfs/dbraw/zinc/16/69/72/1427166972.db2.gz WEWNSGIXQMWQFG-UHFFFAOYSA-N 0 0 383.383 3.140 20 5 GGBDRN CN1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccc(F)cc21 ZINC000174461824 1427167865 /nfs/dbraw/zinc/16/78/65/1427167865.db2.gz DCLCVHDIGQXDMW-UHFFFAOYSA-N 0 0 381.367 3.016 20 5 GGBDRN Cc1ccc(N2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000174464632 1427168706 /nfs/dbraw/zinc/16/87/06/1427168706.db2.gz PMBIAIORZKDCBN-INIZCTEOSA-N 0 0 388.811 3.484 20 5 GGBDRN Cc1nsc(N2CCCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000174466753 1427169553 /nfs/dbraw/zinc/16/95/53/1427169553.db2.gz OXDPHQFYHSSNKP-UHFFFAOYSA-N 0 0 396.860 3.152 20 5 GGBDRN Cc1c(NC(=O)N2CCn3c(nnc3-c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000174474520 1427172972 /nfs/dbraw/zinc/17/29/72/1427172972.db2.gz XPLNKHJGSQWEJS-UHFFFAOYSA-N 0 0 378.392 3.209 20 5 GGBDRN C[C@@H](Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824647622 1427183536 /nfs/dbraw/zinc/18/35/36/1427183536.db2.gz ABAYVNWYDDPFBQ-RHSMWYFYSA-N 0 0 393.451 3.097 20 5 GGBDRN CO[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccc(F)cc1 ZINC000174507513 1427191334 /nfs/dbraw/zinc/19/13/34/1427191334.db2.gz MYPWDQKYCJFXHV-SFHVURJKSA-N 0 0 384.367 3.037 20 5 GGBDRN COC(=O)[C@@H]1CCC[C@@H](C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000174524037 1427202538 /nfs/dbraw/zinc/20/25/38/1427202538.db2.gz XNPKFOZFNZKFNJ-ZIAGYGMSSA-N 0 0 386.408 3.007 20 5 GGBDRN COc1cc(CN(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1O ZINC000174539408 1427210825 /nfs/dbraw/zinc/21/08/25/1427210825.db2.gz SQOJKTWYZZBBKH-UHFFFAOYSA-N 0 0 379.800 3.033 20 5 GGBDRN COc1cc(CN(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])ccc1O ZINC000174540144 1427212061 /nfs/dbraw/zinc/21/20/61/1427212061.db2.gz LDQJLLCGMPLDRM-UHFFFAOYSA-N 0 0 379.800 3.033 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](C)Oc2ccccc2F)cc1[N+](=O)[O-] ZINC000174542475 1427213928 /nfs/dbraw/zinc/21/39/28/1427213928.db2.gz ZVIMMPIMRQEZLT-JTQLQIEISA-N 0 0 377.328 3.148 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](C)Oc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000174545293 1427215664 /nfs/dbraw/zinc/21/56/64/1427215664.db2.gz YSDOMONPTDHEIQ-JTQLQIEISA-N 0 0 377.328 3.148 20 5 GGBDRN C[C@@H](CCc1cccn1C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174550321 1427218319 /nfs/dbraw/zinc/21/83/19/1427218319.db2.gz SRAPESMJZWBBQJ-INIZCTEOSA-N 0 0 384.480 3.287 20 5 GGBDRN CCOc1cc(N2CCC(OC(=O)c3ncoc3C)CC2)ccc1[N+](=O)[O-] ZINC000174550833 1427219626 /nfs/dbraw/zinc/21/96/26/1427219626.db2.gz UMHYAJRHWSOANS-UHFFFAOYSA-N 0 0 375.381 3.116 20 5 GGBDRN COc1ccc(CSCC(=O)N[C@H](C)CCc2cccn2C)cc1[N+](=O)[O-] ZINC000174565255 1427227025 /nfs/dbraw/zinc/22/70/25/1427227025.db2.gz VFDORPXEXFJKFV-CQSZACIVSA-N 0 0 391.493 3.313 20 5 GGBDRN CCOc1cc(C(=O)N[C@H](C)CCc2cccn2C)c([N+](=O)[O-])cc1OC ZINC000174566876 1427227595 /nfs/dbraw/zinc/22/75/95/1427227595.db2.gz LCCDPMKLUUNBJT-CYBMUJFWSA-N 0 0 375.425 3.092 20 5 GGBDRN C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000174569298 1427230883 /nfs/dbraw/zinc/23/08/83/1427230883.db2.gz YBDOJFAGOXAGEK-UGSOOPFHSA-N 0 0 385.395 3.073 20 5 GGBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C12CCCC2 ZINC000174572106 1427232797 /nfs/dbraw/zinc/23/27/97/1427232797.db2.gz HYAJURQCBQJKSK-HZPDHXFCSA-N 0 0 377.397 3.279 20 5 GGBDRN CCO[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C12CCCC2 ZINC000174572117 1427233289 /nfs/dbraw/zinc/23/32/89/1427233289.db2.gz HYAJURQCBQJKSK-CVEARBPZSA-N 0 0 377.397 3.279 20 5 GGBDRN C[C@@H](CCc1cccn1C)NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000174587709 1427243842 /nfs/dbraw/zinc/24/38/42/1427243842.db2.gz CEKPJSKXQIJJPE-NSHDSACASA-N 0 0 380.242 3.447 20 5 GGBDRN COc1ccc(CN(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1O ZINC000174627977 1427273587 /nfs/dbraw/zinc/27/35/87/1427273587.db2.gz XLMJNISMNDBBOQ-UHFFFAOYSA-N 0 0 379.800 3.033 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N(Cc1ccccc1)CC(F)F ZINC000174627275 1427273815 /nfs/dbraw/zinc/27/38/15/1427273815.db2.gz KLYDWNPSBKLTOP-UHFFFAOYSA-N 0 0 387.346 3.083 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(Cc1ccccc1)CC(F)F ZINC000174628880 1427274157 /nfs/dbraw/zinc/27/41/57/1427274157.db2.gz JUXQTTAZZYVURL-UHFFFAOYSA-N 0 0 387.346 3.083 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)Cc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000174634895 1427278703 /nfs/dbraw/zinc/27/87/03/1427278703.db2.gz BNEUADZWXJGKFB-GFCCVEGCSA-N 0 0 382.376 3.073 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3cc(C)ccc3[N+](=O)[O-])n2)c1 ZINC000174637085 1427279900 /nfs/dbraw/zinc/27/99/00/1427279900.db2.gz XQIPGEADPIPCPI-GFCCVEGCSA-N 0 0 382.376 3.453 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])c(C)c3)n2)c1 ZINC000174637308 1427280242 /nfs/dbraw/zinc/28/02/42/1427280242.db2.gz RLHIHPZLMUBLHA-LBPRGKRZSA-N 0 0 382.376 3.453 20 5 GGBDRN COc1cccc(-c2noc([C@H](C)NC(=O)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000174648579 1427286319 /nfs/dbraw/zinc/28/63/19/1427286319.db2.gz RGTHOFQRKLDVFX-LBPRGKRZSA-N 0 0 382.376 3.453 20 5 GGBDRN COc1cccc(-c2noc([C@@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3F)n2)c1 ZINC000174650975 1427288033 /nfs/dbraw/zinc/28/80/33/1427288033.db2.gz JXTGQQDGZXCDDH-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN Cc1cc([C@@](C)(O)CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000174673155 1427301169 /nfs/dbraw/zinc/30/11/69/1427301169.db2.gz JKAXGJNYRZNWQW-ACJLOTCBSA-N 0 0 378.450 3.309 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1nc(C(C)(C)C)no1 ZINC000174676947 1427304526 /nfs/dbraw/zinc/30/45/26/1427304526.db2.gz SMUZGIGOXKLTHA-GFCCVEGCSA-N 0 0 387.440 3.367 20 5 GGBDRN CCN(c1ccccc1)c1ccc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)cc1 ZINC000174684982 1427308730 /nfs/dbraw/zinc/30/87/30/1427308730.db2.gz HJXLTBOENBRMFQ-UHFFFAOYSA-N 0 0 379.420 3.266 20 5 GGBDRN CC(C)c1ccc(-n2ccnc2SC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000174686083 1427309279 /nfs/dbraw/zinc/30/92/79/1427309279.db2.gz FHMMTXHRQJHSPI-KRWDZBQOSA-N 0 0 387.465 3.254 20 5 GGBDRN O=[N+]([O-])c1ccc(NC2CCN(c3ncccn3)CC2)c(Br)c1 ZINC000174686689 1427309585 /nfs/dbraw/zinc/30/95/85/1427309585.db2.gz CQKPJCGVVNFPON-UHFFFAOYSA-N 0 0 378.230 3.228 20 5 GGBDRN COc1cc(N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1[N+](=O)[O-] ZINC000174689784 1427311471 /nfs/dbraw/zinc/31/14/71/1427311471.db2.gz FNZUDYUYOILLHM-ZDUSSCGKSA-N 0 0 385.420 3.434 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1cc2ccccc2o1 ZINC000174695118 1427313998 /nfs/dbraw/zinc/31/39/98/1427313998.db2.gz DKWDFPCCTVVCKQ-CYBMUJFWSA-N 0 0 381.388 3.118 20 5 GGBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000174702121 1427318514 /nfs/dbraw/zinc/31/85/14/1427318514.db2.gz NMPQATQFSULDAM-PJIJBLCYSA-N 0 0 399.422 3.462 20 5 GGBDRN O=C(Nc1nnc(Cc2cccc(Cl)c2)s1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000174711546 1427324208 /nfs/dbraw/zinc/32/42/08/1427324208.db2.gz VUKCCXSVXKXYOS-UHFFFAOYSA-N 0 0 391.796 3.043 20 5 GGBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174722249 1427331558 /nfs/dbraw/zinc/33/15/58/1427331558.db2.gz BEFOVAVNCJMFMN-GFCCVEGCSA-N 0 0 383.832 3.330 20 5 GGBDRN CN(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174725803 1427333300 /nfs/dbraw/zinc/33/33/00/1427333300.db2.gz BFOJRKNIJPFTLA-LBPRGKRZSA-N 0 0 383.832 3.330 20 5 GGBDRN COc1ccc(CCNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)cc1F ZINC000174726493 1427333606 /nfs/dbraw/zinc/33/36/06/1427333606.db2.gz UAUKFVGDUZBUGZ-UHFFFAOYSA-N 0 0 375.356 3.354 20 5 GGBDRN NC(=O)C[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000174727597 1427333993 /nfs/dbraw/zinc/33/39/93/1427333993.db2.gz CRSOIUUKQUZYQH-AWEZNQCLSA-N 0 0 399.472 3.474 20 5 GGBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1cccc(-n2cccn2)c1 ZINC000174738180 1427341304 /nfs/dbraw/zinc/34/13/04/1427341304.db2.gz AGLICYKXPSBDIX-AWEZNQCLSA-N 0 0 379.420 3.338 20 5 GGBDRN COc1ccc(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)cc1[N+](=O)[O-] ZINC000174747272 1427345768 /nfs/dbraw/zinc/34/57/68/1427345768.db2.gz XPMBHSWIJSPRNN-SNVBAGLBSA-N 0 0 386.339 3.284 20 5 GGBDRN C[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000174753107 1427348897 /nfs/dbraw/zinc/34/88/97/1427348897.db2.gz SZUMAVDBIGCVLR-HNNXBMFYSA-N 0 0 379.420 3.094 20 5 GGBDRN C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000174757581 1427351104 /nfs/dbraw/zinc/35/11/04/1427351104.db2.gz AURREUNRHNKGQH-LLVKDONJSA-N 0 0 386.339 3.040 20 5 GGBDRN C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000174757570 1427351277 /nfs/dbraw/zinc/35/12/77/1427351277.db2.gz AURREUNRHNKGQH-NSHDSACASA-N 0 0 386.339 3.040 20 5 GGBDRN C[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000174757898 1427351325 /nfs/dbraw/zinc/35/13/25/1427351325.db2.gz OOUYBARLYUYRBT-HNNXBMFYSA-N 0 0 379.420 3.460 20 5 GGBDRN C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000174758041 1427351366 /nfs/dbraw/zinc/35/13/66/1427351366.db2.gz AUFIJOOXYQVRNR-GFCCVEGCSA-N 0 0 399.382 3.463 20 5 GGBDRN C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000174757908 1427351451 /nfs/dbraw/zinc/35/14/51/1427351451.db2.gz OOUYBARLYUYRBT-OAHLLOKOSA-N 0 0 379.420 3.460 20 5 GGBDRN O=C(NCCOC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 ZINC000174771983 1427358852 /nfs/dbraw/zinc/35/88/52/1427358852.db2.gz YTOMESHLHJFGPP-UHFFFAOYSA-N 0 0 382.294 3.200 20 5 GGBDRN O=C(OCCNC(=O)c1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000174779766 1427362803 /nfs/dbraw/zinc/36/28/03/1427362803.db2.gz VKXKXKCYQYQSFP-UHFFFAOYSA-N 0 0 397.412 3.305 20 5 GGBDRN CC(C)C[C@@H](CCO)CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000174786242 1427366850 /nfs/dbraw/zinc/36/68/50/1427366850.db2.gz BIPWXVNQKKWXLY-LLVKDONJSA-N 0 0 375.372 3.362 20 5 GGBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)c2cc(F)ccc2[N+](=O)[O-])n1 ZINC000174794118 1427372353 /nfs/dbraw/zinc/37/23/53/1427372353.db2.gz YERQYSCDVKSQAH-NSHDSACASA-N 0 0 380.376 3.123 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@@H](O)CO[C@@H]3CCCc4ccccc43)n2)c1 ZINC000174796923 1427373366 /nfs/dbraw/zinc/37/33/66/1427373366.db2.gz WLIYTIFJPFQPLQ-UYAOXDASSA-N 0 0 394.431 3.308 20 5 GGBDRN COc1ccc(NC(=O)CN2c3ccccc3N(C)CC[C@H]2C)c([N+](=O)[O-])c1 ZINC000174796146 1427373510 /nfs/dbraw/zinc/37/35/10/1427373510.db2.gz JDEMPIQPCMRUNC-CQSZACIVSA-N 0 0 384.436 3.277 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@H](O)CO[C@@H]3CCCc4ccccc43)n2)c1 ZINC000174796948 1427373571 /nfs/dbraw/zinc/37/35/71/1427373571.db2.gz WLIYTIFJPFQPLQ-AZUAARDMSA-N 0 0 394.431 3.308 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@@H](O)c3ccc(OC(F)(F)F)cc3)n2)c1 ZINC000174797721 1427374208 /nfs/dbraw/zinc/37/42/08/1427374208.db2.gz SRCPYLFUJDRQBF-OAHLLOKOSA-N 0 0 394.309 3.486 20 5 GGBDRN CC(C)CO[C@H](C)c1noc(CN(C)C(=O)/C=C/c2ccccc2[N+](=O)[O-])n1 ZINC000174800165 1427376331 /nfs/dbraw/zinc/37/63/31/1427376331.db2.gz LWQXRERRSDSAIV-ATWMFIQVSA-N 0 0 388.424 3.383 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1nc([C@H](C)OCC(C)C)no1 ZINC000174802154 1427376709 /nfs/dbraw/zinc/37/67/09/1427376709.db2.gz ZUPVBIKSHMEEAP-ZDUSSCGKSA-N 0 0 376.413 3.292 20 5 GGBDRN Cc1cc(C(=O)N(C)Cc2nc([C@@H](C)OCC(C)C)no2)ccc1[N+](=O)[O-] ZINC000174801233 1427376738 /nfs/dbraw/zinc/37/67/38/1427376738.db2.gz SWGBOOJPJBVZLP-CYBMUJFWSA-N 0 0 376.413 3.292 20 5 GGBDRN O=[N+]([O-])c1ccc(OC2CCN(C[C@@H](O)c3c(F)cccc3F)CC2)cc1 ZINC000174802253 1427376875 /nfs/dbraw/zinc/37/68/75/1427376875.db2.gz MLCMOALEZPKTFP-GOSISDBHSA-N 0 0 378.375 3.450 20 5 GGBDRN O=C(c1cccc(F)c1)N1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174817744 1427385108 /nfs/dbraw/zinc/38/51/08/1427385108.db2.gz CFIUFLPITNJSAE-UHFFFAOYSA-N 0 0 377.803 3.345 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccnn2-c2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] ZINC000174819121 1427385676 /nfs/dbraw/zinc/38/56/76/1427385676.db2.gz MLCFHUMGVNEENQ-UHFFFAOYSA-N 0 0 388.815 3.276 20 5 GGBDRN CC(C)(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000174838259 1427397142 /nfs/dbraw/zinc/39/71/42/1427397142.db2.gz NJCYDWNBXDWJJY-UHFFFAOYSA-N 0 0 391.811 3.001 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCc1nc(C(F)(F)F)cs1 ZINC000174841179 1427399074 /nfs/dbraw/zinc/39/90/74/1427399074.db2.gz LLXOJNHRGREHQQ-UHFFFAOYSA-N 0 0 389.355 3.198 20 5 GGBDRN COc1ccc(OC)c(CN(CCO)Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000174857317 1427410717 /nfs/dbraw/zinc/41/07/17/1427410717.db2.gz LLXDJNNSGRJFQG-UHFFFAOYSA-N 0 0 380.828 3.260 20 5 GGBDRN CC[C@H](NC(=O)CCn1cc([N+](=O)[O-])nc1C)c1nc(C(F)(F)F)cs1 ZINC000174858552 1427411492 /nfs/dbraw/zinc/41/14/92/1427411492.db2.gz DMPWZPYXDHLECG-VIFPVBQESA-N 0 0 391.375 3.233 20 5 GGBDRN CC(=O)N1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc21 ZINC000174866775 1427417908 /nfs/dbraw/zinc/41/79/08/1427417908.db2.gz PGKJMMIONWZGPM-UHFFFAOYSA-N 0 0 393.403 3.408 20 5 GGBDRN Cc1ccc2[nH]c(CNC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)nc2c1 ZINC000174871762 1427420330 /nfs/dbraw/zinc/42/03/30/1427420330.db2.gz UHQRHTQEGQIDQP-UHFFFAOYSA-N 0 0 379.420 3.310 20 5 GGBDRN Cc1cc(N2CCC(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)nc(C)n1 ZINC000174885617 1427427254 /nfs/dbraw/zinc/42/72/54/1427427254.db2.gz MHXAUOUBSFYBPD-UHFFFAOYSA-N 0 0 389.843 3.054 20 5 GGBDRN Cc1ccc2[nH]c(CNC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)nc2c1 ZINC000174898474 1427434202 /nfs/dbraw/zinc/43/42/02/1427434202.db2.gz UOYGLISITIVZED-UHFFFAOYSA-N 0 0 379.420 3.310 20 5 GGBDRN Cc1ccc2[nH]c(CNC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)nc2c1 ZINC000174908607 1427441215 /nfs/dbraw/zinc/44/12/15/1427441215.db2.gz NZBYKGIDFVMXHR-UHFFFAOYSA-N 0 0 383.364 3.235 20 5 GGBDRN CCOc1cc(N[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)ccc1[N+](=O)[O-] ZINC000174915764 1427444121 /nfs/dbraw/zinc/44/41/21/1427444121.db2.gz WHHIXVFTTFNUTR-QGZVFWFLSA-N 0 0 385.420 3.215 20 5 GGBDRN O=C([C@@H]1C[C@@]12CCc1ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000174946638 1427460132 /nfs/dbraw/zinc/46/01/32/1427460132.db2.gz FEYPJTBNEKQZHB-RBBKRZOGSA-N 0 0 377.444 3.148 20 5 GGBDRN CC[C@@H]1Oc2cc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])s3)ccc2NC1=O ZINC000174949114 1427461692 /nfs/dbraw/zinc/46/16/92/1427461692.db2.gz MHEPMFGRXJWLBC-CABZTGNLSA-N 0 0 375.406 3.257 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2[nH]ccc2c1 ZINC000174966983 1427470784 /nfs/dbraw/zinc/47/07/84/1427470784.db2.gz DROKRAFLOYIDIU-UHFFFAOYSA-N 0 0 380.404 3.154 20 5 GGBDRN O=C(CN(Cc1ccccc1)CC(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000174989326 1427482320 /nfs/dbraw/zinc/48/23/20/1427482320.db2.gz UYEIJVRXYAZMGC-UHFFFAOYSA-N 0 0 375.375 3.251 20 5 GGBDRN Cn1cnnc1Sc1ccc(C(=O)N[C@H]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000174990499 1427483405 /nfs/dbraw/zinc/48/34/05/1427483405.db2.gz XNBYUNPQBUCMBY-AWEZNQCLSA-N 0 0 375.454 3.183 20 5 GGBDRN COc1cc(CCNC(=O)Nc2cccc(F)c2C)c([N+](=O)[O-])cc1OC ZINC000175013667 1427497811 /nfs/dbraw/zinc/49/78/11/1427497811.db2.gz KVVVVAKRYAAXLG-UHFFFAOYSA-N 0 0 377.372 3.424 20 5 GGBDRN Cc1nn(C)c(C)c1[C@H]1CCCN1S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000175019584 1427502061 /nfs/dbraw/zinc/50/20/61/1427502061.db2.gz JFQRXDAJSVZPEX-MRXNPFEDSA-N 0 0 392.481 3.088 20 5 GGBDRN Cc1nn(C)c(C)c1[C@@H]1CCCN1S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000175019601 1427502401 /nfs/dbraw/zinc/50/24/01/1427502401.db2.gz JFQRXDAJSVZPEX-INIZCTEOSA-N 0 0 392.481 3.088 20 5 GGBDRN CCOc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2COC)CC1 ZINC000175023779 1427504781 /nfs/dbraw/zinc/50/47/81/1427504781.db2.gz VPUXJPNEJFWGQQ-UHFFFAOYSA-N 0 0 399.447 3.102 20 5 GGBDRN COCc1ccc(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000175035886 1427511931 /nfs/dbraw/zinc/51/19/31/1427511931.db2.gz ZCRIKUYGOVLOGX-UHFFFAOYSA-N 0 0 399.447 3.494 20 5 GGBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000175041748 1427514833 /nfs/dbraw/zinc/51/48/33/1427514833.db2.gz ZYSGYJBRZOEYDD-GFCCVEGCSA-N 0 0 390.465 3.389 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCN(C(=O)c2cccc(F)c2)CC1 ZINC000175047256 1427517704 /nfs/dbraw/zinc/51/77/04/1427517704.db2.gz UAYYRWPFTXYRMQ-UHFFFAOYSA-N 0 0 387.411 3.091 20 5 GGBDRN CON(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](C)Cc1cccs1 ZINC000175047547 1427518374 /nfs/dbraw/zinc/51/83/74/1427518374.db2.gz HUVTVAYYAXKYEF-LBPRGKRZSA-N 0 0 399.494 3.129 20 5 GGBDRN O=C(NCc1ccccc1CN1CCOCC1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175048403 1427519186 /nfs/dbraw/zinc/51/91/86/1427519186.db2.gz ASAQGJSNPFHWRA-UHFFFAOYSA-N 0 0 389.839 3.010 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(NC(=O)c2ccccc2)CC1 ZINC000175053784 1427521268 /nfs/dbraw/zinc/52/12/68/1427521268.db2.gz ZYCOMETVWZTJLM-UHFFFAOYSA-N 0 0 383.448 3.388 20 5 GGBDRN O=C(NC[C@H]1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000175056584 1427523027 /nfs/dbraw/zinc/52/30/27/1427523027.db2.gz PXYZTNYJPGTBHC-OAHLLOKOSA-N 0 0 382.420 3.269 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Oc1ccc2ccc(=O)oc2c1 ZINC000175061559 1427525656 /nfs/dbraw/zinc/52/56/56/1427525656.db2.gz RNBGEUZVRVACHY-UHFFFAOYSA-N 0 0 375.358 3.086 20 5 GGBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000175065470 1427527309 /nfs/dbraw/zinc/52/73/09/1427527309.db2.gz NSICPGHLVFKKEW-KRWDZBQOSA-N 0 0 382.844 3.439 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CC[C@H](Cc2ccccc2)C1 ZINC000175068393 1427529615 /nfs/dbraw/zinc/52/96/15/1427529615.db2.gz KASNXAYTTLWBSF-CQSZACIVSA-N 0 0 387.823 3.278 20 5 GGBDRN COCc1cc([N+](=O)[O-])ccc1N1CCN(C(=O)CCCc2ccccc2)CC1 ZINC000175069125 1427530217 /nfs/dbraw/zinc/53/02/17/1427530217.db2.gz DHEZZUGQYPCLPU-UHFFFAOYSA-N 0 0 397.475 3.413 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(CNC(=O)C=C(C)C)cc1 ZINC000175071469 1427530894 /nfs/dbraw/zinc/53/08/94/1427530894.db2.gz CEFBAUKCCXRVDF-UHFFFAOYSA-N 0 0 383.404 3.438 20 5 GGBDRN CC(=O)Nc1cccc([C@H](C)NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000175072488 1427531533 /nfs/dbraw/zinc/53/15/33/1427531533.db2.gz BGQPMPUPENVYJE-ZDUSSCGKSA-N 0 0 391.449 3.210 20 5 GGBDRN COC(=O)c1sc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1C ZINC000175078302 1427534637 /nfs/dbraw/zinc/53/46/37/1427534637.db2.gz WYIATORXAJREIK-UHFFFAOYSA-N 0 0 389.311 3.417 20 5 GGBDRN O=Cc1ccc(OCC(=O)N2CCN(CC3CC3)c3ccccc32)c([N+](=O)[O-])c1 ZINC000175080006 1427536182 /nfs/dbraw/zinc/53/61/82/1427536182.db2.gz NBSAKRGSJSJESR-UHFFFAOYSA-N 0 0 395.415 3.049 20 5 GGBDRN CN(CCc1ccccn1)C(=O)CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000175083222 1427537571 /nfs/dbraw/zinc/53/75/71/1427537571.db2.gz MIBSPKZQSUNAQQ-UHFFFAOYSA-N 0 0 382.342 3.122 20 5 GGBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCN(CC2CC2)c2ccccc21 ZINC000175088572 1427540099 /nfs/dbraw/zinc/54/00/99/1427540099.db2.gz INKNJSOFWCNYJV-UHFFFAOYSA-N 0 0 377.404 3.348 20 5 GGBDRN Cc1cc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000175092804 1427542260 /nfs/dbraw/zinc/54/22/60/1427542260.db2.gz RASPLLWJYUTJDF-QGZVFWFLSA-N 0 0 383.448 3.349 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC(OC2CCCC2)CC1 ZINC000175096972 1427544229 /nfs/dbraw/zinc/54/42/29/1427544229.db2.gz VJTCZRYQZIIIJN-UHFFFAOYSA-N 0 0 382.482 3.324 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2cc(-c3nc(CC)no3)ccc2C)c1[N+](=O)[O-] ZINC000175099844 1427545750 /nfs/dbraw/zinc/54/57/50/1427545750.db2.gz MHSGRIZEEHGXGL-UHFFFAOYSA-N 0 0 384.396 3.444 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCO[C@H](c2ccccc2F)C1 ZINC000175101451 1427547135 /nfs/dbraw/zinc/54/71/35/1427547135.db2.gz OWSGPJMEOPOHJQ-KRWDZBQOSA-N 0 0 394.424 3.113 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C(=O)N2CCC(C)CC2)CC1 ZINC000175108557 1427550660 /nfs/dbraw/zinc/55/06/60/1427550660.db2.gz SKYKLDJBWNILDY-UHFFFAOYSA-N 0 0 389.496 3.464 20 5 GGBDRN CC(=O)Nc1cc(S(=O)(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1C ZINC000175116391 1427554598 /nfs/dbraw/zinc/55/45/98/1427554598.db2.gz RHYAFYNFNUWQSI-ZDUSSCGKSA-N 0 0 391.449 3.210 20 5 GGBDRN CCC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175115938 1427554733 /nfs/dbraw/zinc/55/47/33/1427554733.db2.gz AFVDGEBQAJXLIC-CYBMUJFWSA-N 0 0 391.449 3.291 20 5 GGBDRN Cc1ccc([C@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1[N+](=O)[O-] ZINC000175116331 1427554797 /nfs/dbraw/zinc/55/47/97/1427554797.db2.gz NOOQHNIYMOSKFL-LBPRGKRZSA-N 0 0 379.394 3.159 20 5 GGBDRN Cc1ccc([C@@H](C)NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000175119082 1427557015 /nfs/dbraw/zinc/55/70/15/1427557015.db2.gz YHNCMBSEKQYYPO-GFCCVEGCSA-N 0 0 379.394 3.159 20 5 GGBDRN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000175121685 1427558515 /nfs/dbraw/zinc/55/85/15/1427558515.db2.gz VIYAQYRJYFUGTR-UHFFFAOYSA-N 0 0 396.447 3.214 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(NC(=O)c2ccsc2)CC1 ZINC000175125717 1427560272 /nfs/dbraw/zinc/56/02/72/1427560272.db2.gz UZPQQTMVNVJRMC-UHFFFAOYSA-N 0 0 389.477 3.449 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCc1coc(-c2ccccc2)n1 ZINC000175131724 1427562171 /nfs/dbraw/zinc/56/21/71/1427562171.db2.gz FSQDJNFRGXRYFY-UHFFFAOYSA-N 0 0 387.417 3.345 20 5 GGBDRN CNC(=O)c1ccc(OC)c(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000175135147 1427563673 /nfs/dbraw/zinc/56/36/73/1427563673.db2.gz UBQLBDCKYZHNSG-UHFFFAOYSA-N 0 0 397.309 3.234 20 5 GGBDRN NC(=O)CCOc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000175139473 1427565839 /nfs/dbraw/zinc/56/58/39/1427565839.db2.gz WHGXDQGQJBCHEP-UHFFFAOYSA-N 0 0 397.309 3.120 20 5 GGBDRN CC(C)(C)OC(=O)N1CC(CC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000175151012 1427570120 /nfs/dbraw/zinc/57/01/20/1427570120.db2.gz DKHDIWLDEANDGG-UHFFFAOYSA-N 0 0 377.441 3.203 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000175172214 1427581042 /nfs/dbraw/zinc/58/10/42/1427581042.db2.gz QNCGWJFBAOPKOI-LLVKDONJSA-N 0 0 385.355 3.344 20 5 GGBDRN C[C@@H]1CCC[C@@H](C)N(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000175174930 1427582896 /nfs/dbraw/zinc/58/28/96/1427582896.db2.gz DXGZHQHEKYSJET-GHMZBOCLSA-N 0 0 385.367 3.172 20 5 GGBDRN C[C@@H]1CCC[C@H](C)CN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000175174949 1427582989 /nfs/dbraw/zinc/58/29/89/1427582989.db2.gz DXGZHQHEKYSJET-WDEREUQCSA-N 0 0 385.367 3.172 20 5 GGBDRN COCCn1nc(C)c(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000175178098 1427583555 /nfs/dbraw/zinc/58/35/55/1427583555.db2.gz QRZZVZUDLANSGX-UHFFFAOYSA-N 0 0 396.831 3.116 20 5 GGBDRN COc1cc(S(=O)(=O)Oc2ccccc2[N+](=O)[O-])ccc1Br ZINC000175177748 1427583749 /nfs/dbraw/zinc/58/37/49/1427583749.db2.gz GBEKUAYGMDUORH-UHFFFAOYSA-N 0 0 388.195 3.134 20 5 GGBDRN CC[C@H](NC(=O)Nc1ccc(N2CCOCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000175186786 1427589045 /nfs/dbraw/zinc/58/90/45/1427589045.db2.gz RDBMHRRFMAJBEL-KRWDZBQOSA-N 0 0 385.424 3.099 20 5 GGBDRN O=C(NC1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1)c1ccccc1 ZINC000175190109 1427590595 /nfs/dbraw/zinc/59/05/95/1427590595.db2.gz ZFSJATVJMNZRPD-UHFFFAOYSA-N 0 0 387.823 3.283 20 5 GGBDRN O=C(NC[C@H](O)c1ccc(Cl)cc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175190153 1427590954 /nfs/dbraw/zinc/59/09/54/1427590954.db2.gz LLOJNXVPNMOFGK-AWEZNQCLSA-N 0 0 399.628 3.474 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2Cc3ccccc3N(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000175227167 1427613565 /nfs/dbraw/zinc/61/35/65/1427613565.db2.gz RSEDUWZMCCHJSE-LBPRGKRZSA-N 0 0 384.392 3.292 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000175228566 1427614286 /nfs/dbraw/zinc/61/42/86/1427614286.db2.gz QOFSWFDPTVMRBJ-HNNXBMFYSA-N 0 0 377.485 3.368 20 5 GGBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000175244300 1427623428 /nfs/dbraw/zinc/62/34/28/1427623428.db2.gz UIESFZWQTNDSAT-JKSUJKDBSA-N 0 0 389.481 3.278 20 5 GGBDRN CC(C)[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1cccnc1 ZINC000175252423 1427626512 /nfs/dbraw/zinc/62/65/12/1427626512.db2.gz VRMPVXSPZMJPIU-QGZVFWFLSA-N 0 0 379.420 3.345 20 5 GGBDRN Cc1cccc(C(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c2cccc(C)c2)c1 ZINC000175254856 1427628199 /nfs/dbraw/zinc/62/81/99/1427628199.db2.gz VDIDKNOJNGSAJE-UHFFFAOYSA-N 0 0 391.427 3.279 20 5 GGBDRN CN(C)c1cc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c2ccccc2n1 ZINC000175264660 1427633835 /nfs/dbraw/zinc/63/38/35/1427633835.db2.gz GPYIHPMLQZXIIC-UHFFFAOYSA-N 0 0 379.420 3.208 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OS(=O)(=O)Cc2cccc3cccnc32)c1 ZINC000175266017 1427634718 /nfs/dbraw/zinc/63/47/18/1427634718.db2.gz XMTFCPAXDRIXEP-UHFFFAOYSA-N 0 0 387.417 3.118 20 5 GGBDRN CCN(CC1CCN(c2ccccn2)CC1)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000175265289 1427634883 /nfs/dbraw/zinc/63/48/83/1427634883.db2.gz IPBMFVLUUKAFIW-UHFFFAOYSA-N 0 0 397.479 3.438 20 5 GGBDRN CN(C)c1ccc([N+](=O)[O-])c(OS(=O)(=O)c2cnc(Cl)c(Cl)c2)c1 ZINC000175265006 1427635140 /nfs/dbraw/zinc/63/51/40/1427635140.db2.gz QYOKQIWPNKYZPQ-UHFFFAOYSA-N 0 0 392.220 3.130 20 5 GGBDRN Cc1c(C(=O)N(CCc2ccccc2)[C@H]2CCOC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175268804 1427636456 /nfs/dbraw/zinc/63/64/56/1427636456.db2.gz NKVZVCCMTGIQQQ-INIZCTEOSA-N 0 0 399.403 3.285 20 5 GGBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000175269427 1427637339 /nfs/dbraw/zinc/63/73/39/1427637339.db2.gz ATBUFIVFMXKAAC-JKSUJKDBSA-N 0 0 375.450 3.230 20 5 GGBDRN CS(=O)(=O)Nc1cc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])ccc1F ZINC000175273884 1427641036 /nfs/dbraw/zinc/64/10/36/1427641036.db2.gz UYEWNZZGFAXFDW-UHFFFAOYSA-N 0 0 387.776 3.011 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1cc(Cl)ccc1OC(F)F ZINC000175274772 1427641641 /nfs/dbraw/zinc/64/16/41/1427641641.db2.gz TYEDOZSUPDYHMU-UHFFFAOYSA-N 0 0 388.758 3.061 20 5 GGBDRN O=C(Nc1c(F)cc(F)cc1F)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000175299550 1427658073 /nfs/dbraw/zinc/65/80/73/1427658073.db2.gz WREYJBZXUUPOKG-QMMMGPOBSA-N 0 0 397.284 3.143 20 5 GGBDRN CC(C)[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1cccnc1 ZINC000175301152 1427660356 /nfs/dbraw/zinc/66/03/56/1427660356.db2.gz LQCRTTVFSLOGNU-SFHVURJKSA-N 0 0 379.420 3.345 20 5 GGBDRN O=C(Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1)c1csc([N+](=O)[O-])c1 ZINC000175312403 1427669042 /nfs/dbraw/zinc/66/90/42/1427669042.db2.gz CABWEYORSJAERO-UHFFFAOYSA-N 0 0 390.812 3.415 20 5 GGBDRN O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175312589 1427669152 /nfs/dbraw/zinc/66/91/52/1427669152.db2.gz QKVITIWVRZHVNS-DLBZAZTESA-N 0 0 381.413 3.106 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2cc([N+](=O)[O-])ccc2Cl)c(F)c1 ZINC000175321718 1427676750 /nfs/dbraw/zinc/67/67/50/1427676750.db2.gz MENPPJTVXOGGEF-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)c(OS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c1 ZINC000175321963 1427676851 /nfs/dbraw/zinc/67/68/51/1427676851.db2.gz JLAGUVMFYLQQMX-UHFFFAOYSA-N 0 0 376.705 3.063 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000175327823 1427680608 /nfs/dbraw/zinc/68/06/08/1427680608.db2.gz HTSKPNJCCUELJL-LBPRGKRZSA-N 0 0 382.376 3.068 20 5 GGBDRN Cc1c(F)cccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000175331466 1427684269 /nfs/dbraw/zinc/68/42/69/1427684269.db2.gz ZXJGNHPBKLUQNP-ZDUSSCGKSA-N 0 0 377.397 3.347 20 5 GGBDRN COC(=O)c1ccc(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175345753 1427694712 /nfs/dbraw/zinc/69/47/12/1427694712.db2.gz WBLGLXSFKPXHGI-UHFFFAOYSA-N 0 0 385.420 3.158 20 5 GGBDRN CC(C)CC(C)(C)CNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000175348605 1427697067 /nfs/dbraw/zinc/69/70/67/1427697067.db2.gz HUUGXUUQAJTRAL-UHFFFAOYSA-N 0 0 377.441 3.471 20 5 GGBDRN C[C@H]1COc2ccccc2N1C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000175353884 1427700366 /nfs/dbraw/zinc/70/03/66/1427700366.db2.gz OFLAAURFTVZAHS-ZDUSSCGKSA-N 0 0 397.387 3.097 20 5 GGBDRN O=C(NCc1nccn1CCc1ccccc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000175359836 1427705451 /nfs/dbraw/zinc/70/54/51/1427705451.db2.gz JMFSLLLREHXHCT-UHFFFAOYSA-N 0 0 379.420 3.033 20 5 GGBDRN CC(C)(NC(=O)NCc1ccc(N2CCCC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000175361188 1427706157 /nfs/dbraw/zinc/70/61/57/1427706157.db2.gz PNCMAXPTFSUYEF-UHFFFAOYSA-N 0 0 383.452 3.325 20 5 GGBDRN C[C@H](NC(=O)N1CCC(OC[C@@H]2CCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000175379491 1427719582 /nfs/dbraw/zinc/71/95/82/1427719582.db2.gz TZAWEWCIYIVARU-KSSFIOAISA-N 0 0 377.441 3.025 20 5 GGBDRN CCOC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H](C)CC ZINC000175382927 1427721331 /nfs/dbraw/zinc/72/13/31/1427721331.db2.gz GLBDWQKVRBTVLS-RNCFNFMXSA-N 0 0 376.331 3.321 20 5 GGBDRN COc1ccccc1[C@@H](CC(C)C)NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000175384304 1427722617 /nfs/dbraw/zinc/72/26/17/1427722617.db2.gz GDNDWOOIRDJMHQ-GOSISDBHSA-N 0 0 399.447 3.237 20 5 GGBDRN O=C(NCc1nccn1CCc1ccccc1)NCc1cccc([N+](=O)[O-])c1 ZINC000175390535 1427726508 /nfs/dbraw/zinc/72/65/08/1427726508.db2.gz RJFGEWXNUNXELB-UHFFFAOYSA-N 0 0 379.420 3.033 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)c1[N+](=O)[O-] ZINC000175394107 1427729482 /nfs/dbraw/zinc/72/94/82/1427729482.db2.gz OHCXTYCGECZEGS-UHFFFAOYSA-N 0 0 385.424 3.408 20 5 GGBDRN Cc1c(C(=O)N2CCN(C)c3cc(F)ccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000175397368 1427731284 /nfs/dbraw/zinc/73/12/84/1427731284.db2.gz SQETZDLCGCLLKF-UHFFFAOYSA-N 0 0 388.355 3.356 20 5 GGBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000175415576 1427742807 /nfs/dbraw/zinc/74/28/07/1427742807.db2.gz RCQXSGKDQDXIPY-PFUSGODGSA-N 0 0 390.461 3.392 20 5 GGBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000175415512 1427742817 /nfs/dbraw/zinc/74/28/17/1427742817.db2.gz RCQXSGKDQDXIPY-CEXHIMGSSA-N 0 0 390.461 3.392 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000175420212 1427744951 /nfs/dbraw/zinc/74/49/51/1427744951.db2.gz WCSJSEWOFQMIEH-SHZVTRLKSA-N 0 0 396.490 3.022 20 5 GGBDRN COC(=O)c1cc(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)cc([N+](=O)[O-])c1 ZINC000175429306 1427749916 /nfs/dbraw/zinc/74/99/16/1427749916.db2.gz VXPWGWRDHYXOPX-ZDUSSCGKSA-N 0 0 394.387 3.058 20 5 GGBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175431315 1427751646 /nfs/dbraw/zinc/75/16/46/1427751646.db2.gz NSDQQQIQAIRXBT-KRWDZBQOSA-N 0 0 393.443 3.280 20 5 GGBDRN Cc1c(C(=O)N2C[C@@H](C)OC[C@H]2c2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175433433 1427752867 /nfs/dbraw/zinc/75/28/67/1427752867.db2.gz IIZXCLMHGXRSRQ-XIKOKIGWSA-N 0 0 385.376 3.414 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000175438724 1427755131 /nfs/dbraw/zinc/75/51/31/1427755131.db2.gz GKBCTLGLYIPYCH-IRXDYDNUSA-N 0 0 389.477 3.497 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1C[C@H](CCN2CCCC2=O)c2ccccc21 ZINC000175436882 1427755232 /nfs/dbraw/zinc/75/52/32/1427755232.db2.gz LKFVQWAFHYLCDC-ZDUSSCGKSA-N 0 0 385.445 3.413 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000175441195 1427756553 /nfs/dbraw/zinc/75/65/53/1427756553.db2.gz ZUMNOINFDWBHPB-QGZVFWFLSA-N 0 0 393.443 3.280 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000175456888 1427765143 /nfs/dbraw/zinc/76/51/43/1427765143.db2.gz FXMZADODMAMBAI-GOEBONIOSA-N 0 0 375.450 3.454 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)cc1[N+](=O)[O-] ZINC000175459727 1427766662 /nfs/dbraw/zinc/76/66/62/1427766662.db2.gz HJXMIWCPUWMKSM-HRAATJIYSA-N 0 0 397.475 3.278 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCn2c(nnc2-c2ccccc2)C1 ZINC000175461674 1427767633 /nfs/dbraw/zinc/76/76/33/1427767633.db2.gz BUWUEWBKVGJHFL-UHFFFAOYSA-N 0 0 383.795 3.163 20 5 GGBDRN CCc1cc(N2CCC(NC(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)ncn1 ZINC000175460717 1427767656 /nfs/dbraw/zinc/76/76/56/1427767656.db2.gz FLJBHZMWPMOZER-UHFFFAOYSA-N 0 0 384.440 3.046 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)N2CCC(OC[C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000175463225 1427768167 /nfs/dbraw/zinc/76/81/67/1427768167.db2.gz WLJSKYIZMRRACL-MAUKXSAKSA-N 0 0 391.468 3.334 20 5 GGBDRN CCNC(=O)COc1cccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1 ZINC000175464975 1427769075 /nfs/dbraw/zinc/76/90/75/1427769075.db2.gz AYARJDLVFRLKAU-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CC[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)Oc1cccc(F)c1 ZINC000175472024 1427772900 /nfs/dbraw/zinc/77/29/00/1427772900.db2.gz HQFLKLGZCOKUKQ-CQSZACIVSA-N 0 0 399.378 3.163 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)Cc2nc3c(s2)CCCC3)c1C ZINC000175474320 1427774511 /nfs/dbraw/zinc/77/45/11/1427774511.db2.gz WHMXUWHBEWHQOR-UHFFFAOYSA-N 0 0 395.506 3.368 20 5 GGBDRN C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)C1 ZINC000175482021 1427779170 /nfs/dbraw/zinc/77/91/70/1427779170.db2.gz PTAGQBXWOSQQBU-CYBMUJFWSA-N 0 0 393.871 3.359 20 5 GGBDRN C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000175522330 1427802618 /nfs/dbraw/zinc/80/26/18/1427802618.db2.gz PDVDNIDHFJSNLR-AWEZNQCLSA-N 0 0 383.404 3.189 20 5 GGBDRN CCOC[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000175545970 1427810817 /nfs/dbraw/zinc/81/08/17/1427810817.db2.gz PDAWEXDDHIMGFJ-INIZCTEOSA-N 0 0 375.469 3.330 20 5 GGBDRN COc1ccc([C@H](C)CC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000175547823 1427811158 /nfs/dbraw/zinc/81/11/58/1427811158.db2.gz GETCKGFXIKGCPH-MRXNPFEDSA-N 0 0 383.448 3.446 20 5 GGBDRN CC(C)(NC(=O)NCC[S@](=O)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000175549027 1427811582 /nfs/dbraw/zinc/81/15/82/1427811582.db2.gz UDLYPTAVLYEGFK-MHZLTWQESA-N 0 0 389.477 3.078 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000175550024 1427811947 /nfs/dbraw/zinc/81/19/47/1427811947.db2.gz XSRRPGUYEKSWNW-MZHQLVBMSA-N 0 0 376.434 3.174 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000175549974 1427812101 /nfs/dbraw/zinc/81/21/01/1427812101.db2.gz XSRRPGUYEKSWNW-QDXKXIGTSA-N 0 0 376.434 3.174 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000175550007 1427812221 /nfs/dbraw/zinc/81/22/21/1427812221.db2.gz XSRRPGUYEKSWNW-GWQKEKGPSA-N 0 0 376.434 3.174 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000175566934 1427817498 /nfs/dbraw/zinc/81/74/98/1427817498.db2.gz NAXOFCQDXVTXRE-UHFFFAOYSA-N 0 0 383.795 3.163 20 5 GGBDRN O=C(NC[C@H](O)c1ccccc1F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175582194 1427821673 /nfs/dbraw/zinc/82/16/73/1427821673.db2.gz SHGYXQDUQFPQPS-INIZCTEOSA-N 0 0 387.392 3.321 20 5 GGBDRN CN(C)C(=O)c1cccc(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000175580611 1427821817 /nfs/dbraw/zinc/82/18/17/1427821817.db2.gz ASFMXKZSRZWFBT-UHFFFAOYSA-N 0 0 398.463 3.074 20 5 GGBDRN O=Cc1cc(F)c(OS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c(F)c1 ZINC000175614092 1427832143 /nfs/dbraw/zinc/83/21/43/1427832143.db2.gz BBNKGOVMVMTKAW-UHFFFAOYSA-N 0 0 377.708 3.107 20 5 GGBDRN CN(C)c1cc(CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)c2ccccc2n1 ZINC000175615897 1427833324 /nfs/dbraw/zinc/83/33/24/1427833324.db2.gz PXJMSUPUODCQQD-UHFFFAOYSA-N 0 0 390.403 3.015 20 5 GGBDRN CN(C)c1cc(CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c2ccccc2n1 ZINC000175618302 1427833944 /nfs/dbraw/zinc/83/39/44/1427833944.db2.gz HECJHKAVLFZPPC-UHFFFAOYSA-N 0 0 395.375 3.047 20 5 GGBDRN Cc1ccc(NC(=O)COC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000175622174 1427835370 /nfs/dbraw/zinc/83/53/70/1427835370.db2.gz XLHVMDWZRPCZAN-UHFFFAOYSA-N 0 0 393.193 3.461 20 5 GGBDRN C[C@H](N(C)C(=O)c1cc([N+](=O)[O-])ccc1I)C1(C)CC1 ZINC000175624999 1427836250 /nfs/dbraw/zinc/83/62/50/1427836250.db2.gz ICUPWNGSBSAGQT-VIFPVBQESA-N 0 0 388.205 3.460 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCCNc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000175626341 1427836837 /nfs/dbraw/zinc/83/68/37/1427836837.db2.gz JEGJORCWRGIXEH-CYBMUJFWSA-N 0 0 387.396 3.284 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCO[C@@H](c2cccc(-c3nn[n-]n3)c2)C1 ZINC000826293744 1427847018 /nfs/dbraw/zinc/84/70/18/1427847018.db2.gz ZVASQXNOTAVQMY-IFXJQAMLSA-N 0 0 394.435 3.218 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N(CCC(N)=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000175657939 1427847119 /nfs/dbraw/zinc/84/71/19/1427847119.db2.gz NTVLGAISPYMUJA-OAHLLOKOSA-N 0 0 384.436 3.051 20 5 GGBDRN O=[N+]([O-])c1ccc(Br)cc1S(=O)(=O)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000175667658 1427850777 /nfs/dbraw/zinc/85/07/77/1427850777.db2.gz KCAXMFGBNZQFGY-PHIMTYICSA-N 0 0 389.271 3.168 20 5 GGBDRN Cc1nc(NC(=O)CCNC(=O)c2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000175672591 1427852059 /nfs/dbraw/zinc/85/20/59/1427852059.db2.gz LXPHVOHOIHIDCI-UHFFFAOYSA-N 0 0 378.388 3.210 20 5 GGBDRN Cc1nc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1[N+](=O)[O-] ZINC000175671616 1427852129 /nfs/dbraw/zinc/85/21/29/1427852129.db2.gz MVCQCTHVRIJNFU-UHFFFAOYSA-N 0 0 385.380 3.062 20 5 GGBDRN CCCCCn1nc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)c2ccccc2c1=O ZINC000175679200 1427854155 /nfs/dbraw/zinc/85/41/55/1427854155.db2.gz FEAWGXGSBXSQDD-UHFFFAOYSA-N 0 0 395.419 3.451 20 5 GGBDRN CCc1nsc(N2CCCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)n1 ZINC000175679105 1427854351 /nfs/dbraw/zinc/85/43/51/1427854351.db2.gz SLMSMNKQGQDQRN-UHFFFAOYSA-N 0 0 395.872 3.015 20 5 GGBDRN CCN(C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1)CC(F)(F)F ZINC000175690057 1427858877 /nfs/dbraw/zinc/85/88/77/1427858877.db2.gz GDMTZNCMTQKWBN-LLVKDONJSA-N 0 0 377.338 3.080 20 5 GGBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000175699311 1427862991 /nfs/dbraw/zinc/86/29/91/1427862991.db2.gz LVJYROLXGJPNRT-CJNGLKHVSA-N 0 0 388.445 3.017 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)COc2cccc(Cl)c2Cl)c1 ZINC000175707758 1427866053 /nfs/dbraw/zinc/86/60/53/1427866053.db2.gz YTRHCDHHZSDFCU-LLVKDONJSA-N 0 0 399.230 3.380 20 5 GGBDRN C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000175708654 1427866078 /nfs/dbraw/zinc/86/60/78/1427866078.db2.gz JTFODRCQWHTYEQ-CHWSQXEVSA-N 0 0 377.828 3.061 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O ZINC000175708671 1427866221 /nfs/dbraw/zinc/86/62/21/1427866221.db2.gz JTFODRCQWHTYEQ-QWHCGFSZSA-N 0 0 377.828 3.061 20 5 GGBDRN COC[C@H](NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccco1 ZINC000175712682 1427867343 /nfs/dbraw/zinc/86/73/43/1427867343.db2.gz ZIZLDCJVIZEUTH-KRWDZBQOSA-N 0 0 389.408 3.128 20 5 GGBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000175713451 1427867462 /nfs/dbraw/zinc/86/74/62/1427867462.db2.gz KRBLGXNMECJBJX-PBHICJAKSA-N 0 0 377.404 3.194 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000175731428 1427872353 /nfs/dbraw/zinc/87/23/53/1427872353.db2.gz FYKVUSYZHWYATO-UHFFFAOYSA-N 0 0 395.774 3.155 20 5 GGBDRN Cc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000175734486 1427873308 /nfs/dbraw/zinc/87/33/08/1427873308.db2.gz WGBMGDIHYQXGNJ-RDTXWAMCSA-N 0 0 382.420 3.069 20 5 GGBDRN C[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000175735718 1427873637 /nfs/dbraw/zinc/87/36/37/1427873637.db2.gz UQAARMDCIFZLDX-QWQRMKEZSA-N 0 0 382.420 3.149 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1C ZINC000175737835 1427874573 /nfs/dbraw/zinc/87/45/73/1427874573.db2.gz MJKPOIZWTVHJIF-UHFFFAOYSA-N 0 0 391.811 3.324 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2cccnc2-n2cccn2)cc1[N+](=O)[O-] ZINC000175758530 1427881499 /nfs/dbraw/zinc/88/14/99/1427881499.db2.gz JNCLBRWTGGVURD-AWEZNQCLSA-N 0 0 380.408 3.044 20 5 GGBDRN COc1cc(CCNC(=O)N([C@@H](C)C(C)C)C2CC2)c([N+](=O)[O-])cc1OC ZINC000175760137 1427881577 /nfs/dbraw/zinc/88/15/77/1427881577.db2.gz ZNVUIDYXVWIAGI-ZDUSSCGKSA-N 0 0 379.457 3.373 20 5 GGBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000175761996 1427882561 /nfs/dbraw/zinc/88/25/61/1427882561.db2.gz LNVVBTSZJSJUAX-KDOFPFPSSA-N 0 0 377.404 3.194 20 5 GGBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000175762015 1427882608 /nfs/dbraw/zinc/88/26/08/1427882608.db2.gz LNVVBTSZJSJUAX-KSSFIOAISA-N 0 0 377.404 3.194 20 5 GGBDRN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000175761976 1427882634 /nfs/dbraw/zinc/88/26/34/1427882634.db2.gz LNVVBTSZJSJUAX-KBXCAEBGSA-N 0 0 377.404 3.194 20 5 GGBDRN Cc1ccc2c(c1)N(C(=O)c1cc(=O)[nH]c3ccc([N+](=O)[O-])cc31)C[C@@H](C)O2 ZINC000175776119 1427888367 /nfs/dbraw/zinc/88/83/67/1427888367.db2.gz JKDNOYRCCFECNE-GFCCVEGCSA-N 0 0 379.372 3.172 20 5 GGBDRN CNC(=O)c1ccc(N2CC[C@@H](OCCCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000175783225 1427891257 /nfs/dbraw/zinc/89/12/57/1427891257.db2.gz KXLZIKYWDQZVPV-GOSISDBHSA-N 0 0 383.448 3.183 20 5 GGBDRN CCc1nc(CN2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)cs1 ZINC000175800023 1427897580 /nfs/dbraw/zinc/89/75/80/1427897580.db2.gz KLMDZJJWNMEEQX-UHFFFAOYSA-N 0 0 394.884 3.225 20 5 GGBDRN CN(C)c1cc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)c2ccccc2n1 ZINC000175801906 1427897961 /nfs/dbraw/zinc/89/79/61/1427897961.db2.gz VSFZDBKAWRMQAV-UHFFFAOYSA-N 0 0 393.447 3.251 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cccn2)cc1 ZINC000175801876 1427897979 /nfs/dbraw/zinc/89/79/79/1427897979.db2.gz NGQYNSNECBCMGQ-OAHLLOKOSA-N 0 0 379.420 3.383 20 5 GGBDRN CCc1nnc(-c2ccc(NC(=O)COc3ccc([N+](=O)[O-])c(F)c3)cc2)o1 ZINC000175801374 1427898189 /nfs/dbraw/zinc/89/81/89/1427898189.db2.gz LFEOGWAHTGZRMD-UHFFFAOYSA-N 0 0 386.339 3.364 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000175803405 1427898646 /nfs/dbraw/zinc/89/86/46/1427898646.db2.gz XNDSEZFYVZWCQB-GFCCVEGCSA-N 0 0 399.382 3.387 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[C@H](COCc2ccccc2)C1 ZINC000175803272 1427898751 /nfs/dbraw/zinc/89/87/51/1427898751.db2.gz VKFGPYNZECYRAQ-IBGZPJMESA-N 0 0 383.448 3.386 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175806528 1427900699 /nfs/dbraw/zinc/90/06/99/1427900699.db2.gz AXJXHADRCMTBLI-UHFFFAOYSA-N 0 0 375.812 3.027 20 5 GGBDRN COCCOc1ccc(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000175814753 1427906534 /nfs/dbraw/zinc/90/65/34/1427906534.db2.gz DJQHHHCVQDVEGR-HNNXBMFYSA-N 0 0 387.436 3.489 20 5 GGBDRN COc1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])c(C(=O)NC2CC2)c1 ZINC000175815174 1427907461 /nfs/dbraw/zinc/90/74/61/1427907461.db2.gz WPKOPYVDXNDAJJ-UHFFFAOYSA-N 0 0 389.795 3.401 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccc1O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000175817101 1427908067 /nfs/dbraw/zinc/90/80/67/1427908067.db2.gz ZIDSOWNRKWBKOS-UHFFFAOYSA-N 0 0 393.281 3.152 20 5 GGBDRN O=C(Nc1cc(C2CC2)nn1-c1ncccn1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175817284 1427908405 /nfs/dbraw/zinc/90/84/05/1427908405.db2.gz JSABCPOTTULKMY-UHFFFAOYSA-N 0 0 384.783 3.354 20 5 GGBDRN O=C(Nc1ccc(CN2CCOCC2)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175820440 1427909984 /nfs/dbraw/zinc/90/99/84/1427909984.db2.gz KQGXLFGLFPYTSH-UHFFFAOYSA-N 0 0 375.812 3.333 20 5 GGBDRN O=C(Nc1ccccc1CN1C(=O)CCC1=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175820694 1427910935 /nfs/dbraw/zinc/91/09/35/1427910935.db2.gz OQAAHIUCAZKGSO-UHFFFAOYSA-N 0 0 387.779 3.150 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1 ZINC000175827802 1427915205 /nfs/dbraw/zinc/91/52/05/1427915205.db2.gz DEYPYWXBGZRYGL-UHFFFAOYSA-N 0 0 387.783 3.149 20 5 GGBDRN C[C@@H]1c2ccccc2CCN1C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000175849398 1427930987 /nfs/dbraw/zinc/93/09/87/1427930987.db2.gz QBUYCUANDVVNQP-CJNGLKHVSA-N 0 0 399.472 3.407 20 5 GGBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000175850655 1427932030 /nfs/dbraw/zinc/93/20/30/1427932030.db2.gz IWXNKPWPNFNECV-SGTLLEGYSA-N 0 0 378.425 3.477 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2nncn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000175851902 1427932610 /nfs/dbraw/zinc/93/26/10/1427932610.db2.gz RJWVDADPNDSTER-AWEZNQCLSA-N 0 0 380.408 3.044 20 5 GGBDRN CC[C@@H](NC(=O)NCc1cc(C(=O)OC)c(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000175873677 1427945809 /nfs/dbraw/zinc/94/58/09/1427945809.db2.gz HMDUSQSTFYWPAL-MRXNPFEDSA-N 0 0 375.381 3.233 20 5 GGBDRN CCNC(=O)c1cccc(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000175889025 1427953264 /nfs/dbraw/zinc/95/32/64/1427953264.db2.gz IBCRGKWJJNUVGZ-AWEZNQCLSA-N 0 0 384.436 3.213 20 5 GGBDRN CC(C)(NS(=O)(=O)c1ccccc1OC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000175892885 1427955626 /nfs/dbraw/zinc/95/56/26/1427955626.db2.gz HZELPFQVGWUXBQ-UHFFFAOYSA-N 0 0 386.376 3.410 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC(C)(C)c1ccc(F)c(F)c1 ZINC000175896716 1427957527 /nfs/dbraw/zinc/95/75/27/1427957527.db2.gz GACXGLHNLAZBNQ-UHFFFAOYSA-N 0 0 386.376 3.095 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000175907173 1427964687 /nfs/dbraw/zinc/96/46/87/1427964687.db2.gz DOLZWPHLVMCUSG-UHFFFAOYSA-N 0 0 397.840 3.385 20 5 GGBDRN C[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C1(N2CCOCC2)CCCC1 ZINC000175932752 1427981146 /nfs/dbraw/zinc/98/11/46/1427981146.db2.gz DTXDLWMBBWVWCF-CYBMUJFWSA-N 0 0 381.860 3.012 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175937735 1427984184 /nfs/dbraw/zinc/98/41/84/1427984184.db2.gz SBVZGHYUOOJOBZ-LBPRGKRZSA-N 0 0 388.380 3.380 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC(N(C)c2ccccc2)CC1 ZINC000175938112 1427984356 /nfs/dbraw/zinc/98/43/56/1427984356.db2.gz ZKUARRPCGIFUMV-UHFFFAOYSA-N 0 0 398.463 3.414 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCC(=O)NC2CCCCC2)cc1[N+](=O)[O-] ZINC000175940932 1427985853 /nfs/dbraw/zinc/98/58/53/1427985853.db2.gz ORVVSZYMOIXHIG-AWEZNQCLSA-N 0 0 376.457 3.102 20 5 GGBDRN CCc1n[nH]c(C(=O)N[C@H](C)c2ccc(-n3nc(C)cc3C)cc2)c1[N+](=O)[O-] ZINC000175948895 1427990517 /nfs/dbraw/zinc/99/05/17/1427990517.db2.gz XBWJFASCVQWATK-CYBMUJFWSA-N 0 0 382.424 3.174 20 5 GGBDRN COc1cc(C(=O)N(CC2CCC2)CC(F)(F)F)c([N+](=O)[O-])cc1OC ZINC000175950211 1427991560 /nfs/dbraw/zinc/99/15/60/1427991560.db2.gz BGNQWVKPMKEUIG-UHFFFAOYSA-N 0 0 376.331 3.417 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCCN2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000175962659 1428000813 /nfs/dbraw/zinc/00/08/13/1428000813.db2.gz XCOHCILDMJQVBO-AWEZNQCLSA-N 0 0 388.493 3.383 20 5 GGBDRN Cc1cc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)c(N)c([N+](=O)[O-])c1 ZINC000175966712 1428003288 /nfs/dbraw/zinc/00/32/88/1428003288.db2.gz JVUZTNPKLQLOPQ-UHFFFAOYSA-N 0 0 397.460 3.058 20 5 GGBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1C[C@@H]1c1cccc(F)c1F ZINC000175993938 1428018386 /nfs/dbraw/zinc/01/83/86/1428018386.db2.gz SMCCMKOAPJKCTR-OLZOCXBDSA-N 0 0 385.330 3.400 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H](C)c1nc2ccc(Cl)cc2n1C ZINC000176032168 1428037102 /nfs/dbraw/zinc/03/71/02/1428037102.db2.gz NSYZHQWIUHPXDR-SNVBAGLBSA-N 0 0 391.815 3.334 20 5 GGBDRN CC(C)CC(C)(C)CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000176042557 1428045156 /nfs/dbraw/zinc/04/51/56/1428045156.db2.gz GXBVAVSTNORIOV-UHFFFAOYSA-N 0 0 387.383 3.323 20 5 GGBDRN CCOc1cc(CNC(=O)c2cccc([N+](=O)[O-])c2N)ccc1OC(F)F ZINC000176043272 1428045385 /nfs/dbraw/zinc/04/53/85/1428045385.db2.gz VXYKNDGTYOXNDZ-UHFFFAOYSA-N 0 0 381.335 3.107 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H](C)c1nc2cc(Cl)ccc2n1C ZINC000176050465 1428050749 /nfs/dbraw/zinc/05/07/49/1428050749.db2.gz KDARWUGLAFGGAO-SNVBAGLBSA-N 0 0 391.815 3.334 20 5 GGBDRN CN(C)C(=O)c1cc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000176053435 1428052920 /nfs/dbraw/zinc/05/29/20/1428052920.db2.gz NSXOZVJNOBDJMR-UHFFFAOYSA-N 0 0 388.399 3.493 20 5 GGBDRN Cc1cc(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c(N)c([N+](=O)[O-])c1 ZINC000176059156 1428058090 /nfs/dbraw/zinc/05/80/90/1428058090.db2.gz AXWXMCCTIGFPKR-UHFFFAOYSA-N 0 0 388.811 3.283 20 5 GGBDRN C[C@@H](N1CCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1)C(F)(F)F ZINC000176068504 1428065402 /nfs/dbraw/zinc/06/54/02/1428065402.db2.gz MLXSUMYRMBBWEC-SNVBAGLBSA-N 0 0 390.387 3.398 20 5 GGBDRN CCOc1c(Cl)cc(CNC(=O)c2cccc([N+](=O)[O-])c2N)cc1OC ZINC000176068519 1428065442 /nfs/dbraw/zinc/06/54/42/1428065442.db2.gz CAHUFIOFWWWQBE-UHFFFAOYSA-N 0 0 379.800 3.168 20 5 GGBDRN C[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 ZINC000176077732 1428070504 /nfs/dbraw/zinc/07/05/04/1428070504.db2.gz RHNSZHLCYSMYHU-CQSZACIVSA-N 0 0 383.404 3.361 20 5 GGBDRN O=C(C=Cc1ccccc1[N+](=O)[O-])N1CCOC[C@@H]1CC(=O)c1cccs1 ZINC000176078068 1428070757 /nfs/dbraw/zinc/07/07/57/1428070757.db2.gz VSBNYFCNZOBCLN-KIUWMYQTSA-N 0 0 386.429 3.170 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CCCN1Cc1ccc(F)cc1 ZINC000176078747 1428071384 /nfs/dbraw/zinc/07/13/84/1428071384.db2.gz GENQPXHZNYATHK-GOSISDBHSA-N 0 0 387.411 3.023 20 5 GGBDRN O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000176089341 1428076639 /nfs/dbraw/zinc/07/66/39/1428076639.db2.gz ZUQXUNJAEQGBPA-ZDUSSCGKSA-N 0 0 394.214 3.437 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCc2cc(F)cc3c2OCOC3)cc1[N+](=O)[O-] ZINC000176091524 1428077859 /nfs/dbraw/zinc/07/78/59/1428077859.db2.gz ATICMMDHXGTNSZ-GFCCVEGCSA-N 0 0 389.383 3.469 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)NCc2cc(F)cc3c2OCOC3)cc1[N+](=O)[O-] ZINC000176091546 1428078020 /nfs/dbraw/zinc/07/80/20/1428078020.db2.gz ATICMMDHXGTNSZ-LBPRGKRZSA-N 0 0 389.383 3.469 20 5 GGBDRN O=C(Nc1cnc(C2CC2)nc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000176116802 1428093133 /nfs/dbraw/zinc/09/31/33/1428093133.db2.gz SMJVAGJYKRGKCA-UHFFFAOYSA-N 0 0 383.408 3.338 20 5 GGBDRN CN(CC(=O)Nc1cc(F)cc(F)c1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176121521 1428095873 /nfs/dbraw/zinc/09/58/73/1428095873.db2.gz BDIQMJNRWZYOEP-UHFFFAOYSA-N 0 0 383.738 3.237 20 5 GGBDRN COc1cccc2c1OC[C@@H](NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000176122761 1428096580 /nfs/dbraw/zinc/09/65/80/1428096580.db2.gz OAQNRUDGLKSIBX-BBRMVZONSA-N 0 0 385.420 3.276 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000176129651 1428103758 /nfs/dbraw/zinc/10/37/58/1428103758.db2.gz DWXUNHICDJMTQQ-VIFPVBQESA-N 0 0 395.774 3.212 20 5 GGBDRN COc1ccccc1C[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000176131366 1428105178 /nfs/dbraw/zinc/10/51/78/1428105178.db2.gz NRLHGUHXWJMVEH-QGZVFWFLSA-N 0 0 399.447 3.234 20 5 GGBDRN COc1ccccc1C[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000176133556 1428107257 /nfs/dbraw/zinc/10/72/57/1428107257.db2.gz XTNFREKTHHKDAW-KRWDZBQOSA-N 0 0 399.447 3.234 20 5 GGBDRN Cc1nn(CN(C)CC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c(C)c1[N+](=O)[O-] ZINC000176151295 1428120869 /nfs/dbraw/zinc/12/08/69/1428120869.db2.gz DQQLWUKHGWZWPH-OAHLLOKOSA-N 0 0 383.493 3.237 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)[C@H](C)C1CCCCC1 ZINC000176163583 1428130328 /nfs/dbraw/zinc/13/03/28/1428130328.db2.gz CCEYTBDFRFZEPA-QWHCGFSZSA-N 0 0 377.441 3.263 20 5 GGBDRN Nc1c(C(=O)N(Cc2ccccc2)C[C@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000176168372 1428133845 /nfs/dbraw/zinc/13/38/45/1428133845.db2.gz XUONXLFPITXZON-KRWDZBQOSA-N 0 0 381.388 3.146 20 5 GGBDRN Nc1c(C(=O)N(Cc2ccccc2)C[C@@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000176168385 1428133951 /nfs/dbraw/zinc/13/39/51/1428133951.db2.gz XUONXLFPITXZON-QGZVFWFLSA-N 0 0 381.388 3.146 20 5 GGBDRN O=C(OC1CCN(c2nncc3ccccc32)CC1)c1cccc([N+](=O)[O-])c1 ZINC000176168943 1428135422 /nfs/dbraw/zinc/13/54/22/1428135422.db2.gz JUJWPWPKHXGVGD-UHFFFAOYSA-N 0 0 378.388 3.364 20 5 GGBDRN Cc1ccc(C(=O)OC[C@H]2CC(=O)N(CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176169978 1428135963 /nfs/dbraw/zinc/13/59/63/1428135963.db2.gz IEOIONOOQQGNJH-KRWDZBQOSA-N 0 0 382.416 3.151 20 5 GGBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OC[C@@H]1CC(=O)N(CCc2ccccc2)C1 ZINC000176178001 1428142412 /nfs/dbraw/zinc/14/24/12/1428142412.db2.gz DIIBYGFNYXADDL-UFUQCMIWSA-N 0 0 394.427 3.242 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000176179878 1428144447 /nfs/dbraw/zinc/14/44/47/1428144447.db2.gz ZITRJQPEIUJPMP-GOSISDBHSA-N 0 0 396.399 3.329 20 5 GGBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000176182173 1428146325 /nfs/dbraw/zinc/14/63/25/1428146325.db2.gz KCJRZTKWAHOXDL-WLRWDXFRSA-N 0 0 399.378 3.082 20 5 GGBDRN C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000176182128 1428146479 /nfs/dbraw/zinc/14/64/79/1428146479.db2.gz KCJRZTKWAHOXDL-NSPYISDASA-N 0 0 399.378 3.082 20 5 GGBDRN C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000176182161 1428146706 /nfs/dbraw/zinc/14/67/06/1428146706.db2.gz KCJRZTKWAHOXDL-WYRIXSBYSA-N 0 0 399.378 3.082 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@H]1CC(=O)N(CCc2ccccc2)C1 ZINC000176182888 1428147164 /nfs/dbraw/zinc/14/71/64/1428147164.db2.gz XCVXIMTWQLICGL-QGZVFWFLSA-N 0 0 382.416 3.151 20 5 GGBDRN CCc1ccc(C(=O)N[C@H](CC(N)=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000176192564 1428156169 /nfs/dbraw/zinc/15/61/69/1428156169.db2.gz CEDBMADVZKMIHY-OAHLLOKOSA-N 0 0 375.812 3.157 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](CC(N)=O)c2cccc(Cl)c2)c1 ZINC000176211750 1428170568 /nfs/dbraw/zinc/17/05/68/1428170568.db2.gz XEASMOQOLUDLAZ-CQSZACIVSA-N 0 0 393.852 3.317 20 5 GGBDRN CCN(Cc1ccccc1)C(=O)CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000176215653 1428172952 /nfs/dbraw/zinc/17/29/52/1428172952.db2.gz AYLRNTODEIKRFF-UHFFFAOYSA-N 0 0 384.436 3.382 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC[C@@H]2CC(=O)c2cccs2)c(C)c1[N+](=O)[O-] ZINC000176217726 1428173727 /nfs/dbraw/zinc/17/37/27/1428173727.db2.gz RLUFDSHVTCOPEM-CQSZACIVSA-N 0 0 390.465 3.124 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc(Cn2cncn2)cc1 ZINC000176223820 1428176624 /nfs/dbraw/zinc/17/66/24/1428176624.db2.gz WJAAOWGWMJSJPM-UHFFFAOYSA-N 0 0 380.408 3.173 20 5 GGBDRN COCC[S@](=O)Cc1cccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000176240489 1428187825 /nfs/dbraw/zinc/18/78/25/1428187825.db2.gz PRBVORUBRWVVIC-MHZLTWQESA-N 0 0 394.424 3.190 20 5 GGBDRN CN(CCCc1cc(-c2ccccc2)n(C)n1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176243622 1428190036 /nfs/dbraw/zinc/19/00/36/1428190036.db2.gz MOSHBLIXXMIQEZ-UHFFFAOYSA-N 0 0 393.447 3.282 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)NCC[S@@](=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000176248320 1428194252 /nfs/dbraw/zinc/19/42/52/1428194252.db2.gz ICBZRIRDTMJQRV-YVORESIASA-N 0 0 389.477 3.212 20 5 GGBDRN COc1ccc(C(=O)N2CCC[C@@H]2C[C@@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000176250651 1428195740 /nfs/dbraw/zinc/19/57/40/1428195740.db2.gz FHWQCBWWBJGQHP-UKRRQHHQSA-N 0 0 376.434 3.393 20 5 GGBDRN CCOCCOc1c(Cl)cccc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000176252998 1428197603 /nfs/dbraw/zinc/19/76/03/1428197603.db2.gz RZCOJOLFMNKUGC-UHFFFAOYSA-N 0 0 379.800 3.498 20 5 GGBDRN C[C@@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000180178330 1429784737 /nfs/dbraw/zinc/78/47/37/1429784737.db2.gz QNJJPRNOCXPHMM-ZDUSSCGKSA-N 0 0 398.868 3.210 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CCO)c1C ZINC000180180537 1429785721 /nfs/dbraw/zinc/78/57/21/1429785721.db2.gz JSEVIGUGEQTOPE-HNNXBMFYSA-N 0 0 392.477 3.173 20 5 GGBDRN C[C@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000180180124 1429786191 /nfs/dbraw/zinc/78/61/91/1429786191.db2.gz FWIXRHCIBJTJMT-CYBMUJFWSA-N 0 0 398.868 3.210 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CCO)c1C ZINC000180180555 1429786197 /nfs/dbraw/zinc/78/61/97/1429786197.db2.gz JSEVIGUGEQTOPE-OAHLLOKOSA-N 0 0 392.477 3.173 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CCO)cc1C ZINC000180181715 1429787073 /nfs/dbraw/zinc/78/70/73/1429787073.db2.gz TVBRZLNXOWCDOR-MRXNPFEDSA-N 0 0 392.477 3.173 20 5 GGBDRN C[C@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000180181801 1429787215 /nfs/dbraw/zinc/78/72/15/1429787215.db2.gz PTCAWCMNYVRPPG-CYBMUJFWSA-N 0 0 398.868 3.210 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)CCO ZINC000180183810 1429788501 /nfs/dbraw/zinc/78/85/01/1429788501.db2.gz MYJFYEANRQYWOF-OAHLLOKOSA-N 0 0 392.477 3.119 20 5 GGBDRN O=C(NC1CC1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000180200855 1429800226 /nfs/dbraw/zinc/80/02/26/1429800226.db2.gz PEPBIESMALSAAG-UHFFFAOYSA-N 0 0 391.330 3.341 20 5 GGBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Cl)C1CCN(C(=O)N2CCCC2)CC1 ZINC000180228673 1429808554 /nfs/dbraw/zinc/80/85/54/1429808554.db2.gz KOFQZUHIDDUJBT-UHFFFAOYSA-N 0 0 395.843 3.219 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000180229330 1429808586 /nfs/dbraw/zinc/80/85/86/1429808586.db2.gz KZVLUWSDCRMVCD-KSSFIOAISA-N 0 0 394.786 3.413 20 5 GGBDRN CC(C)[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1nc2ccccc2[nH]1 ZINC000180239744 1429812097 /nfs/dbraw/zinc/81/20/97/1429812097.db2.gz BRPYXCREPOJIHU-INIZCTEOSA-N 0 0 382.376 3.327 20 5 GGBDRN COc1cc(CN(C)CCc2nccs2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180243915 1429813416 /nfs/dbraw/zinc/81/34/16/1429813416.db2.gz LOGDKUVEEZZIIR-UHFFFAOYSA-N 0 0 387.408 3.378 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 ZINC000180256226 1429816490 /nfs/dbraw/zinc/81/64/90/1429816490.db2.gz UHQUQEVXKWLESP-SJLPKXTDSA-N 0 0 394.786 3.413 20 5 GGBDRN CCC[C@@](C)(CO)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000180264992 1429818752 /nfs/dbraw/zinc/81/87/52/1429818752.db2.gz YAYFLKAOUSPQBJ-VLIAUNLRSA-N 0 0 386.452 3.444 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000180279682 1429823016 /nfs/dbraw/zinc/82/30/16/1429823016.db2.gz RRDJGBBJGPLJRJ-UHFFFAOYSA-N 0 0 376.434 3.486 20 5 GGBDRN O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000180285420 1429824687 /nfs/dbraw/zinc/82/46/87/1429824687.db2.gz IIVYVASJUOGJDC-AWEZNQCLSA-N 0 0 387.823 3.027 20 5 GGBDRN Cc1nn(C)c(C)c1CC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180288533 1429825597 /nfs/dbraw/zinc/82/55/97/1429825597.db2.gz NZNZEWHVFPGBSI-UHFFFAOYSA-N 0 0 385.449 3.274 20 5 GGBDRN CC(=O)N[C@H](C)C(=O)N(CC(C)C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180299712 1429829561 /nfs/dbraw/zinc/82/95/61/1429829561.db2.gz HTYPWDMPJLZQOH-GFCCVEGCSA-N 0 0 390.465 3.232 20 5 GGBDRN CC(C)n1cnnc1C1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000180299723 1429829631 /nfs/dbraw/zinc/82/96/31/1429829631.db2.gz UESCPTJWUQIONS-UHFFFAOYSA-N 0 0 384.440 3.036 20 5 GGBDRN COc1ccc(CN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@H](CO)C(C)C)cc1 ZINC000180306839 1429831908 /nfs/dbraw/zinc/83/19/08/1429831908.db2.gz TYVXMAVRKUQAQA-HXUWFJFHSA-N 0 0 386.448 3.192 20 5 GGBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12 ZINC000180329937 1429837567 /nfs/dbraw/zinc/83/75/67/1429837567.db2.gz LIBPUWLEDRAYBU-IAOVAPTHSA-N 0 0 385.807 3.031 20 5 GGBDRN Cc1cc(C)n(-c2ccccc2NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)n1 ZINC000180335539 1429838504 /nfs/dbraw/zinc/83/85/04/1429838504.db2.gz XPMSTFNOCZVENT-UHFFFAOYSA-N 0 0 380.360 3.378 20 5 GGBDRN Cc1c(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)cccc1[N+](=O)[O-] ZINC000180351260 1429842974 /nfs/dbraw/zinc/84/29/74/1429842974.db2.gz GARFGOYZCFBPRJ-ZDUSSCGKSA-N 0 0 376.438 3.143 20 5 GGBDRN CC(C)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)C(=O)Nc1nccs1 ZINC000180360408 1429846267 /nfs/dbraw/zinc/84/62/67/1429846267.db2.gz KLUJSIMHQPJKQT-GFCCVEGCSA-N 0 0 396.856 3.488 20 5 GGBDRN Cc1cc(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)cc([N+](=O)[O-])c1 ZINC000180373559 1429849482 /nfs/dbraw/zinc/84/94/82/1429849482.db2.gz ZZWHQTOHIULFAI-CQSZACIVSA-N 0 0 376.438 3.143 20 5 GGBDRN Cc1cc(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)ccc1[N+](=O)[O-] ZINC000180375933 1429850020 /nfs/dbraw/zinc/85/00/20/1429850020.db2.gz CONDSKITLTWOKY-CYBMUJFWSA-N 0 0 376.438 3.143 20 5 GGBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000180383368 1429852357 /nfs/dbraw/zinc/85/23/57/1429852357.db2.gz UCKNQOIRUSOSRF-GFCCVEGCSA-N 0 0 395.371 3.485 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1 ZINC000180385154 1429852755 /nfs/dbraw/zinc/85/27/55/1429852755.db2.gz AMXPRWDUFTVGOQ-UHFFFAOYSA-N 0 0 391.449 3.023 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cc(S(C)(=O)=O)ccc1F ZINC000180391276 1429854712 /nfs/dbraw/zinc/85/47/12/1429854712.db2.gz SVJCQXKKDVKUBS-UHFFFAOYSA-N 0 0 380.397 3.315 20 5 GGBDRN Cc1c([C@@H](C)Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)cnn1C ZINC000180397333 1429856581 /nfs/dbraw/zinc/85/65/81/1429856581.db2.gz MRBOXFAZCVHZAD-SNVBAGLBSA-N 0 0 388.815 3.009 20 5 GGBDRN Cc1cc(C)n(-c2cccc(NC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)c2)n1 ZINC000180405192 1429859422 /nfs/dbraw/zinc/85/94/22/1429859422.db2.gz GUBRJCPMHKBTIH-UHFFFAOYSA-N 0 0 380.360 3.378 20 5 GGBDRN COC(=O)c1c(C)c(C)sc1NC(=O)CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180408239 1429860197 /nfs/dbraw/zinc/86/01/97/1429860197.db2.gz XISYSCHLSCIVRP-NSHDSACASA-N 0 0 391.449 3.349 20 5 GGBDRN CSc1ccc(C(=O)N2CCN(CC(F)(F)F)CC2(C)C)cc1[N+](=O)[O-] ZINC000180414670 1429862105 /nfs/dbraw/zinc/86/21/05/1429862105.db2.gz ZLLBVMRLLACFIO-UHFFFAOYSA-N 0 0 391.415 3.415 20 5 GGBDRN CCS(=O)(=O)c1ccc2oc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)nc2c1 ZINC000180423419 1429864986 /nfs/dbraw/zinc/86/49/86/1429864986.db2.gz QYHJYOGLKXQWCS-GFCCVEGCSA-N 0 0 389.433 3.380 20 5 GGBDRN CCOC(=O)c1cc(C)sc1NC(=O)CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180433801 1429868595 /nfs/dbraw/zinc/86/85/95/1429868595.db2.gz GMEQSFJCZJLVGZ-LBPRGKRZSA-N 0 0 391.449 3.431 20 5 GGBDRN COCCOC1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000180435984 1429868943 /nfs/dbraw/zinc/86/89/43/1429868943.db2.gz PMJHZVGZAVJVBU-UHFFFAOYSA-N 0 0 393.318 3.154 20 5 GGBDRN CC(C)n1cnnc1[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000180436748 1429869127 /nfs/dbraw/zinc/86/91/27/1429869127.db2.gz CFMPKSRCIKSJMC-CQSZACIVSA-N 0 0 384.440 3.036 20 5 GGBDRN CC(C)n1cnnc1[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000180436764 1429869146 /nfs/dbraw/zinc/86/91/46/1429869146.db2.gz CFMPKSRCIKSJMC-AWEZNQCLSA-N 0 0 384.440 3.036 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 ZINC000180453627 1429872807 /nfs/dbraw/zinc/87/28/07/1429872807.db2.gz DAEMIEDHLZBVJB-UHFFFAOYSA-N 0 0 378.388 3.340 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CCCN(C(=O)C2CC2)C1 ZINC000180469687 1429876564 /nfs/dbraw/zinc/87/65/64/1429876564.db2.gz QYDGRTSTVHECRS-LLVKDONJSA-N 0 0 385.342 3.201 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cccc(-n2cccn2)n1 ZINC000180470444 1429876605 /nfs/dbraw/zinc/87/66/05/1429876605.db2.gz WVIUPPOWEBAOFB-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1 ZINC000180469887 1429876673 /nfs/dbraw/zinc/87/66/73/1429876673.db2.gz ANGZGLJFHAFAIR-UHFFFAOYSA-N 0 0 388.323 3.269 20 5 GGBDRN CC(C)n1nnnc1-c1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cc1F ZINC000180475625 1429878396 /nfs/dbraw/zinc/87/83/96/1429878396.db2.gz MRFDUNNDZOBVTD-UHFFFAOYSA-N 0 0 384.371 3.150 20 5 GGBDRN Cc1cccc(C2=CCN(C(=O)Cn3c(=O)oc4cc([N+](=O)[O-])ccc43)CC2)c1 ZINC000180478551 1429878905 /nfs/dbraw/zinc/87/89/05/1429878905.db2.gz PLKNUYVCCHMALZ-UHFFFAOYSA-N 0 0 393.399 3.127 20 5 GGBDRN O=C(Nc1ccc(-c2nnco2)cc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180503261 1429884151 /nfs/dbraw/zinc/88/41/51/1429884151.db2.gz QEXAVAVOEHJDMU-UHFFFAOYSA-N 0 0 376.275 3.499 20 5 GGBDRN CCc1cc(NC(=O)c2nc3nc(C)cc(C)n3n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000180503891 1429884392 /nfs/dbraw/zinc/88/43/92/1429884392.db2.gz PCIWVAYDWFIYJA-UHFFFAOYSA-N 0 0 391.391 3.012 20 5 GGBDRN CCc1cc(NC(=O)c2ccc(S(C)(=O)=O)cc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000180505738 1429884804 /nfs/dbraw/zinc/88/48/04/1429884804.db2.gz GJOHOURNURGWPY-UHFFFAOYSA-N 0 0 399.428 3.361 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCC[C@H]2c2c(C)n[nH]c2C)c([N+](=O)[O-])c1 ZINC000180506516 1429885220 /nfs/dbraw/zinc/88/52/20/1429885220.db2.gz YLVIQPAEKYBSCQ-INIZCTEOSA-N 0 0 387.440 3.109 20 5 GGBDRN COc1ccc(-c2nc(NC(=O)c3cc([N+](=O)[O-])cnc3N)sc2C)cc1 ZINC000180508091 1429885403 /nfs/dbraw/zinc/88/54/03/1429885403.db2.gz WXPGSHIYAOAZRI-UHFFFAOYSA-N 0 0 385.405 3.265 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1nc2ccc(OC(F)(F)F)cc2s1 ZINC000180507936 1429885409 /nfs/dbraw/zinc/88/54/09/1429885409.db2.gz FILQYRHGUQYTMO-UHFFFAOYSA-N 0 0 399.310 3.333 20 5 GGBDRN CN(Cc1cc(F)c(F)c(F)c1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000180509745 1429885764 /nfs/dbraw/zinc/88/57/64/1429885764.db2.gz CZDMCEHOMGHZEA-INIZCTEOSA-N 0 0 379.338 3.249 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCOC4(CCOCC4)C3)cs2)c1 ZINC000180525435 1429889954 /nfs/dbraw/zinc/88/99/54/1429889954.db2.gz RGHMDDKKCKSYNG-UHFFFAOYSA-N 0 0 375.450 3.100 20 5 GGBDRN C[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000180526077 1429890034 /nfs/dbraw/zinc/89/00/34/1429890034.db2.gz JRHWRNBXTMOGSV-LBPRGKRZSA-N 0 0 397.884 3.349 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccc(-c2nc3ccccc3s2)o1 ZINC000180529478 1429891053 /nfs/dbraw/zinc/89/10/53/1429891053.db2.gz IXNOOOCDRRUPEW-UHFFFAOYSA-N 0 0 395.400 3.372 20 5 GGBDRN CC(C)c1nccn1Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cnc2N)c1 ZINC000180537380 1429892815 /nfs/dbraw/zinc/89/28/15/1429892815.db2.gz PSKHGFBMYJHAGW-UHFFFAOYSA-N 0 0 380.408 3.193 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000180537510 1429892859 /nfs/dbraw/zinc/89/28/59/1429892859.db2.gz UJDRYKRUNKZULL-UHFFFAOYSA-N 0 0 381.335 3.308 20 5 GGBDRN O=C(Nc1cc(C(F)(F)F)ccn1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000180550774 1429895741 /nfs/dbraw/zinc/89/57/41/1429895741.db2.gz XKNYEGQCXPHSNX-UHFFFAOYSA-N 0 0 377.282 3.447 20 5 GGBDRN COC(=O)[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1 ZINC000180556287 1429896764 /nfs/dbraw/zinc/89/67/64/1429896764.db2.gz JYSSDRGVFILDNT-FQEVSTJZSA-N 0 0 378.384 3.321 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCO[C@@H]([C@@H]4CCCO4)C3)cs2)c1 ZINC000180559869 1429897529 /nfs/dbraw/zinc/89/75/29/1429897529.db2.gz BFYOEYYEYMNTTH-DLBZAZTESA-N 0 0 375.450 3.098 20 5 GGBDRN C[C@H]1CN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@@H]2CCCC[C@H]12 ZINC000180560325 1429897908 /nfs/dbraw/zinc/89/79/08/1429897908.db2.gz HJEUQJJWSJVFJF-NUEKZKHPSA-N 0 0 387.436 3.320 20 5 GGBDRN C[C@@H]1CN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@H]2CCCC[C@H]12 ZINC000180560274 1429897923 /nfs/dbraw/zinc/89/79/23/1429897923.db2.gz HJEUQJJWSJVFJF-BMFZPTHFSA-N 0 0 387.436 3.320 20 5 GGBDRN C[C@@H]1CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000180564081 1429898990 /nfs/dbraw/zinc/89/89/90/1429898990.db2.gz SMNDLIVDCGQRLX-BZPMIXESSA-N 0 0 379.844 3.015 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000180587273 1429914831 /nfs/dbraw/zinc/91/48/31/1429914831.db2.gz MIPUYXSCRJHSAD-INIZCTEOSA-N 0 0 383.795 3.140 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000180591305 1429917547 /nfs/dbraw/zinc/91/75/47/1429917547.db2.gz IBNFQPPAEYAVMP-CYBMUJFWSA-N 0 0 392.818 3.465 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000180612868 1429932905 /nfs/dbraw/zinc/93/29/05/1429932905.db2.gz NMWZTGKKRKVEEF-UHFFFAOYSA-N 0 0 397.357 3.357 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(COCC(F)(F)F)cc1 ZINC000180614952 1429934109 /nfs/dbraw/zinc/93/41/09/1429934109.db2.gz GSYDHHZRWVEOSU-UHFFFAOYSA-N 0 0 383.326 3.186 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180618800 1429936329 /nfs/dbraw/zinc/93/63/29/1429936329.db2.gz VVOCQLASRPPQEQ-UHFFFAOYSA-N 0 0 380.154 3.447 20 5 GGBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)[C@H]1Cc2cc(F)ccc2O1 ZINC000180622918 1429938556 /nfs/dbraw/zinc/93/85/56/1429938556.db2.gz ZJBHJEHKODFVKY-CQSZACIVSA-N 0 0 381.157 3.439 20 5 GGBDRN C[C@@H](OC[C@H]1CCCCO1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180624455 1429939326 /nfs/dbraw/zinc/93/93/26/1429939326.db2.gz YYTULOCUDKTDCW-ZYHUDNBSSA-N 0 0 387.230 3.270 20 5 GGBDRN CN(CC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000180625564 1429940084 /nfs/dbraw/zinc/94/00/84/1429940084.db2.gz UIOHNBQAQWYEBP-UHFFFAOYSA-N 0 0 388.218 3.163 20 5 GGBDRN O=C(Cc1ccc2c(c1)OCO2)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180626729 1429940520 /nfs/dbraw/zinc/94/05/20/1429940520.db2.gz XKLLANAUNGVOJD-UHFFFAOYSA-N 0 0 379.166 3.267 20 5 GGBDRN CCCC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180627887 1429941620 /nfs/dbraw/zinc/94/16/20/1429941620.db2.gz FYWOAGQYPLPURE-CYBMUJFWSA-N 0 0 398.257 3.477 20 5 GGBDRN CCCc1csc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000180636826 1429947933 /nfs/dbraw/zinc/94/79/33/1429947933.db2.gz SBTFIQCECHBQHC-UHFFFAOYSA-N 0 0 375.454 3.358 20 5 GGBDRN CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000180639738 1429948363 /nfs/dbraw/zinc/94/83/63/1429948363.db2.gz IRGUXXSBXQUDGV-UHFFFAOYSA-N 0 0 379.432 3.235 20 5 GGBDRN CCCn1cc(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cn1 ZINC000180649409 1429954863 /nfs/dbraw/zinc/95/48/63/1429954863.db2.gz RANWKZAYLSHAIQ-MRXNPFEDSA-N 0 0 388.424 3.014 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(Br)nc2C)c([N+](=O)[O-])cc1OC ZINC000180694509 1429982301 /nfs/dbraw/zinc/98/23/01/1429982301.db2.gz JKQYZRDVIILAKX-UHFFFAOYSA-N 0 0 396.197 3.330 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(c2cccc(Cl)c2)CCOCC1 ZINC000180698166 1429984427 /nfs/dbraw/zinc/98/44/27/1429984427.db2.gz SCPHYMZUDKCHGI-UHFFFAOYSA-N 0 0 389.839 3.309 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)cccc1[N+](=O)[O-] ZINC000180711725 1429993950 /nfs/dbraw/zinc/99/39/50/1429993950.db2.gz GGVRSCMHBWTDCP-OAHLLOKOSA-N 0 0 395.337 3.410 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1cccc2c1CN(C(C)C)C2 ZINC000180714113 1429995276 /nfs/dbraw/zinc/99/52/76/1429995276.db2.gz NOTJQQFKFXYGOF-UHFFFAOYSA-N 0 0 391.449 3.128 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccnc(Oc2ccc(F)cc2)c1 ZINC000180730448 1430005326 /nfs/dbraw/zinc/00/53/26/1430005326.db2.gz SJALURGSPVWSPX-UHFFFAOYSA-N 0 0 382.351 3.433 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1 ZINC000180732268 1430005765 /nfs/dbraw/zinc/00/57/65/1430005765.db2.gz HYSBQCJWKVYTTF-UHFFFAOYSA-N 0 0 377.360 3.077 20 5 GGBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180774307 1430031856 /nfs/dbraw/zinc/03/18/56/1430031856.db2.gz UTAADCWKEBODNX-WBMJQRKESA-N 0 0 397.859 3.287 20 5 GGBDRN CCCc1cnc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000180799233 1430047268 /nfs/dbraw/zinc/04/72/68/1430047268.db2.gz IPVZWPNHOFISIZ-UHFFFAOYSA-N 0 0 375.454 3.358 20 5 GGBDRN Cc1cn2c(nc(C)c2CN(C)C(=O)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000180800757 1430048454 /nfs/dbraw/zinc/04/84/54/1430048454.db2.gz LRKCUBALDQOCQA-UHFFFAOYSA-N 0 0 388.449 3.348 20 5 GGBDRN CN(Cc1ccco1)Cc1ccccc1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180810198 1430053867 /nfs/dbraw/zinc/05/38/67/1430053867.db2.gz XAOPGJHXZMXDKT-UHFFFAOYSA-N 0 0 394.431 3.332 20 5 GGBDRN Cc1ccc(-c2n[nH]c(NS(=O)(=O)Cc3ccccc3[N+](=O)[O-])c2C)o1 ZINC000180821086 1430057300 /nfs/dbraw/zinc/05/73/00/1430057300.db2.gz NKYVIDIUFSFXRE-UHFFFAOYSA-N 0 0 376.394 3.137 20 5 GGBDRN Cn1ccnc1COC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000180825596 1430059645 /nfs/dbraw/zinc/05/96/45/1430059645.db2.gz PHOHNODQPISIOK-UHFFFAOYSA-N 0 0 396.190 3.178 20 5 GGBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1noc(-c2ccc(Cl)cc2)n1 ZINC000180849109 1430068627 /nfs/dbraw/zinc/06/86/27/1430068627.db2.gz WUGKMXLTNAWDSM-SECBINFHSA-N 0 0 387.783 3.371 20 5 GGBDRN O=C(N[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000180851346 1430070299 /nfs/dbraw/zinc/07/02/99/1430070299.db2.gz NEJDJUDUUDOFMW-JTQLQIEISA-N 0 0 395.749 3.062 20 5 GGBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCO1 ZINC000180852577 1430070674 /nfs/dbraw/zinc/07/06/74/1430070674.db2.gz RMOGGNQRRRVLND-LPHOPBHVSA-N 0 0 386.452 3.494 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CCO1 ZINC000180852558 1430070758 /nfs/dbraw/zinc/07/07/58/1430070758.db2.gz RMOGGNQRRRVLND-VQIMIIECSA-N 0 0 386.452 3.494 20 5 GGBDRN O=C(Nc1nnc(-c2ccccn2)s1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180860766 1430074003 /nfs/dbraw/zinc/07/40/03/1430074003.db2.gz DICIAZXGEMZQBR-UHFFFAOYSA-N 0 0 393.331 3.362 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCCOc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000180884311 1430087765 /nfs/dbraw/zinc/08/77/65/1430087765.db2.gz XMMIFARNRRUFKR-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N[C@@H]2CCCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000180883994 1430087951 /nfs/dbraw/zinc/08/79/51/1430087951.db2.gz BDKXXDOATCMNNH-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN CC[C@@H](C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(OC)cc1 ZINC000180885159 1430088394 /nfs/dbraw/zinc/08/83/94/1430088394.db2.gz ACRQJQOATLXANE-CRAIPNDOSA-N 0 0 384.436 3.205 20 5 GGBDRN COCCc1nc(C)c([C@H](C)OC(=O)CN(C)c2ccccc2[N+](=O)[O-])s1 ZINC000180892081 1430093464 /nfs/dbraw/zinc/09/34/64/1430093464.db2.gz ZEYSTRCZDGQZAS-ZDUSSCGKSA-N 0 0 393.465 3.289 20 5 GGBDRN Cc1c(C(=O)OCc2nc(C3CC3)cs2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000180922767 1430116964 /nfs/dbraw/zinc/11/69/64/1430116964.db2.gz NRIDYZHBPMGYEF-UHFFFAOYSA-N 0 0 385.405 3.175 20 5 GGBDRN C[C@]1(c2ccc(F)cc2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000180946114 1430128389 /nfs/dbraw/zinc/12/83/89/1430128389.db2.gz OMPHQILVKXQETN-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000180954897 1430133457 /nfs/dbraw/zinc/13/34/57/1430133457.db2.gz RDDREEGBNRCSJC-ZDUSSCGKSA-N 0 0 382.420 3.444 20 5 GGBDRN CSc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)cc1[N+](=O)[O-] ZINC000180954931 1430133475 /nfs/dbraw/zinc/13/34/75/1430133475.db2.gz HZRANIQWDXHSSV-AWEZNQCLSA-N 0 0 385.445 3.131 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12 ZINC000180957971 1430135470 /nfs/dbraw/zinc/13/54/70/1430135470.db2.gz NGSJXLJMHVRYLM-MRXNPFEDSA-N 0 0 381.432 3.335 20 5 GGBDRN C[C@@]1(c2ccc(F)cc2F)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000180964676 1430139888 /nfs/dbraw/zinc/13/98/88/1430139888.db2.gz FEOJYPBCXDOOBA-KRWDZBQOSA-N 0 0 395.749 3.494 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c1 ZINC000180966283 1430140862 /nfs/dbraw/zinc/14/08/62/1430140862.db2.gz SJDOGWUSIQQBCC-CYBMUJFWSA-N 0 0 385.445 3.131 20 5 GGBDRN Cc1cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)nn1-c1cccc(F)c1 ZINC000180965914 1430140980 /nfs/dbraw/zinc/14/09/80/1430140980.db2.gz TUXMLODURIDZDN-UHFFFAOYSA-N 0 0 380.339 3.357 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1 ZINC000180970111 1430142839 /nfs/dbraw/zinc/14/28/39/1430142839.db2.gz UJWZSYMLZPFFBD-UHFFFAOYSA-N 0 0 382.420 3.492 20 5 GGBDRN Cc1cc([C@@]2(C)NC(=O)N(Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)c(C)o1 ZINC000180978940 1430148978 /nfs/dbraw/zinc/14/89/78/1430148978.db2.gz GWUWHRUMRYHQMU-QGZVFWFLSA-N 0 0 377.784 3.425 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N[C@H](C)c1ccc(F)cc1F ZINC000180981903 1430150461 /nfs/dbraw/zinc/15/04/61/1430150461.db2.gz VAYOJKCSOFEXRO-LLVKDONJSA-N 0 0 377.347 3.306 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000180983591 1430151969 /nfs/dbraw/zinc/15/19/69/1430151969.db2.gz JNJNNIVNFHSDJD-UHFFFAOYSA-N 0 0 382.342 3.367 20 5 GGBDRN Cc1cc([N+](=O)[O-])cnc1N(C)C[C@@H](O)COc1ccccc1C(F)(F)F ZINC000180995149 1430157461 /nfs/dbraw/zinc/15/74/61/1430157461.db2.gz PWQUHJZAVPTQIJ-CYBMUJFWSA-N 0 0 385.342 3.193 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 ZINC000181018992 1430170055 /nfs/dbraw/zinc/17/00/55/1430170055.db2.gz LSNNPWMTHDPTFL-UHFFFAOYSA-N 0 0 393.281 3.498 20 5 GGBDRN Nc1c(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000181025564 1430173726 /nfs/dbraw/zinc/17/37/26/1430173726.db2.gz FAEMUILEUQGQRG-CZUORRHYSA-N 0 0 379.775 3.230 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000181025583 1430173876 /nfs/dbraw/zinc/17/38/76/1430173876.db2.gz FAEMUILEUQGQRG-XJKSGUPXSA-N 0 0 379.775 3.230 20 5 GGBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 ZINC000181036142 1430179531 /nfs/dbraw/zinc/17/95/31/1430179531.db2.gz DGFRVIQYPOUYSE-QAPCUYQASA-N 0 0 393.802 3.446 20 5 GGBDRN O=C(c1ccc(F)c(Cl)c1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000181053253 1430187630 /nfs/dbraw/zinc/18/76/30/1430187630.db2.gz XWGVSMOUHLSWBJ-UHFFFAOYSA-N 0 0 381.766 3.489 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1 ZINC000181059992 1430192624 /nfs/dbraw/zinc/19/26/24/1430192624.db2.gz QDFDVBFFUVJKAV-UHFFFAOYSA-N 0 0 378.392 3.024 20 5 GGBDRN CN(Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C(N)=O)c1cccc(Br)c1 ZINC000181066805 1430195705 /nfs/dbraw/zinc/19/57/05/1430195705.db2.gz NCFTTYLXZBUNFF-HNNXBMFYSA-N 0 0 396.216 3.155 20 5 GGBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](CCC(N)=O)C1 ZINC000181075143 1430199362 /nfs/dbraw/zinc/19/93/62/1430199362.db2.gz ZNMSIPDQYLQGKU-CYBMUJFWSA-N 0 0 379.482 3.213 20 5 GGBDRN CC(C)(C)[C@H]1CCc2nc(NC(=O)Cn3cc([N+](=O)[O-])ccc3=O)sc2C1 ZINC000181092431 1430207018 /nfs/dbraw/zinc/20/70/18/1430207018.db2.gz JFYMPFBNJDEICX-NSHDSACASA-N 0 0 390.465 3.003 20 5 GGBDRN Cn1cnc(-c2ccc(C(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)cc2)n1 ZINC000181112788 1430214904 /nfs/dbraw/zinc/21/49/04/1430214904.db2.gz VVDUGGXULOVOHZ-UHFFFAOYSA-N 0 0 377.404 3.195 20 5 GGBDRN C[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000181130618 1430220046 /nfs/dbraw/zinc/22/00/46/1430220046.db2.gz ISHUMJNZAWDXRT-CYBMUJFWSA-N 0 0 388.855 3.349 20 5 GGBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCc2c(ncn2CCc2ccccc2)C1 ZINC000181130226 1430220221 /nfs/dbraw/zinc/22/02/21/1430220221.db2.gz QWVIPOYPOWGTSZ-UHFFFAOYSA-N 0 0 376.416 3.233 20 5 GGBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCc2c(ncn2CCc2ccccc2)C1 ZINC000181133403 1430221264 /nfs/dbraw/zinc/22/12/64/1430221264.db2.gz CFSLJUAUICSQHV-UHFFFAOYSA-N 0 0 390.443 3.161 20 5 GGBDRN COC[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000181138810 1430223207 /nfs/dbraw/zinc/22/32/07/1430223207.db2.gz LJAAOHUFGPORMX-MRXNPFEDSA-N 0 0 382.388 3.469 20 5 GGBDRN COC[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181143489 1430225279 /nfs/dbraw/zinc/22/52/79/1430225279.db2.gz GFRUBPQKHGKFDP-INIZCTEOSA-N 0 0 379.363 3.179 20 5 GGBDRN CC(C)(NC(=O)Nc1ccnn1Cc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000181152574 1430228686 /nfs/dbraw/zinc/22/86/86/1430228686.db2.gz CNCYHXOVOHSCTA-UHFFFAOYSA-N 0 0 380.408 3.291 20 5 GGBDRN Cc1ccc2[nH]c([C@@H]3CCCN3C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)nc2c1 ZINC000181159704 1430232003 /nfs/dbraw/zinc/23/20/03/1430232003.db2.gz BYMFPOIBRLHGMI-HNNXBMFYSA-N 0 0 394.387 3.486 20 5 GGBDRN COc1cc2[nH]c(CCCNC(=O)c3c(N)cccc3[N+](=O)[O-])cc2c(OC)c1 ZINC000181176801 1430238500 /nfs/dbraw/zinc/23/85/00/1430238500.db2.gz KLTPBCKQBMRQDF-UHFFFAOYSA-N 0 0 398.419 3.038 20 5 GGBDRN CCOc1cccc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])c1OC(F)F ZINC000181182760 1430240524 /nfs/dbraw/zinc/24/05/24/1430240524.db2.gz HCHZHEMPIASURM-UHFFFAOYSA-N 0 0 381.335 3.107 20 5 GGBDRN O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000181189648 1430242968 /nfs/dbraw/zinc/24/29/68/1430242968.db2.gz FJVBLTTXYQSMLJ-AWEZNQCLSA-N 0 0 395.415 3.128 20 5 GGBDRN O=C(Nc1ccc(-n2ccnc2)c(Cl)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181192716 1430244217 /nfs/dbraw/zinc/24/42/17/1430244217.db2.gz HJELNYVPAUTTJB-UHFFFAOYSA-N 0 0 386.751 3.415 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCO[C@@H](Cc2ccccc2)C1 ZINC000181204905 1430247391 /nfs/dbraw/zinc/24/73/91/1430247391.db2.gz BNBUZHZSENPLBP-SFHVURJKSA-N 0 0 379.416 3.089 20 5 GGBDRN Cc1sc2ncc(C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)c(=O)n2c1C ZINC000181206777 1430247779 /nfs/dbraw/zinc/24/77/79/1430247779.db2.gz XAUJUDWTEUEMEF-JTQLQIEISA-N 0 0 386.433 3.080 20 5 GGBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCO[C@@H](Cc2ccccc2)C1 ZINC000181225740 1430251584 /nfs/dbraw/zinc/25/15/84/1430251584.db2.gz DKZXNBSGOIPISL-IBGZPJMESA-N 0 0 395.459 3.279 20 5 GGBDRN CCCCN(C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)[C@H]1CCS(=O)(=O)C1 ZINC000181229910 1430252612 /nfs/dbraw/zinc/25/26/12/1430252612.db2.gz DIDLNTGGGALBGY-AWEZNQCLSA-N 0 0 383.470 3.033 20 5 GGBDRN CN(Cc1ncc(Cl)n1C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000181229990 1430252648 /nfs/dbraw/zinc/25/26/48/1430252648.db2.gz JSUARSMSZFYHRR-UHFFFAOYSA-N 0 0 379.848 3.146 20 5 GGBDRN O=C(Nc1ccnn1CCc1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181253612 1430257416 /nfs/dbraw/zinc/25/74/16/1430257416.db2.gz KXECMWNLMOXEEF-UHFFFAOYSA-N 0 0 380.360 3.015 20 5 GGBDRN Cc1cc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)n(-c2ccc(F)cc2)n1 ZINC000181280773 1430262088 /nfs/dbraw/zinc/26/20/88/1430262088.db2.gz RPNAFGWFVRPSCU-UHFFFAOYSA-N 0 0 384.323 3.209 20 5 GGBDRN Cc1cc(COC(=O)CCC(=O)N2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000181302094 1430267121 /nfs/dbraw/zinc/26/71/21/1430267121.db2.gz IRTINEYMBWDWMG-UHFFFAOYSA-N 0 0 388.445 3.373 20 5 GGBDRN Cc1nc(Br)ccc1NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000181305402 1430268463 /nfs/dbraw/zinc/26/84/63/1430268463.db2.gz NFIVSOZYGUKQAJ-UHFFFAOYSA-N 0 0 379.214 3.425 20 5 GGBDRN C[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1cccc(N2CCCC2)c1 ZINC000181316799 1430271261 /nfs/dbraw/zinc/27/12/61/1430271261.db2.gz QKIUCYNXMKZFEJ-ZDUSSCGKSA-N 0 0 383.404 3.415 20 5 GGBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000181316071 1430271290 /nfs/dbraw/zinc/27/12/90/1430271290.db2.gz RDKRQGQNQMMORH-LLVKDONJSA-N 0 0 375.816 3.264 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OCCOc1ccnc(Cl)c1 ZINC000181327768 1430273820 /nfs/dbraw/zinc/27/38/20/1430273820.db2.gz HRAJFNAYINEZEO-UHFFFAOYSA-N 0 0 375.768 3.289 20 5 GGBDRN C[C@@H](Nc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000181353936 1430280046 /nfs/dbraw/zinc/28/00/46/1430280046.db2.gz XRFVLNHUDSPTGH-QLFBSQMISA-N 0 0 384.436 3.412 20 5 GGBDRN COCCn1ccc2ccc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)cc21 ZINC000181356541 1430280803 /nfs/dbraw/zinc/28/08/03/1430280803.db2.gz FSDDKVLLCJMLRV-UHFFFAOYSA-N 0 0 379.376 3.325 20 5 GGBDRN CC1([C@@H]2CCCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)OCCO1 ZINC000181368633 1430283004 /nfs/dbraw/zinc/28/30/04/1430283004.db2.gz PYEGZEVDCKVALW-CYBMUJFWSA-N 0 0 376.434 3.425 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)c1ccc(F)c(Cl)c1 ZINC000181409236 1430290662 /nfs/dbraw/zinc/29/06/62/1430290662.db2.gz LJVQPNDSFDLPBF-JTQLQIEISA-N 0 0 379.775 3.169 20 5 GGBDRN COC[C@H](NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 ZINC000181427675 1430296391 /nfs/dbraw/zinc/29/63/91/1430296391.db2.gz VORJHEIIGGLAIR-KRWDZBQOSA-N 0 0 379.363 3.097 20 5 GGBDRN COC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(F)c(F)c1 ZINC000181427724 1430296416 /nfs/dbraw/zinc/29/64/16/1430296416.db2.gz BLQAEHONWFQXMR-KRWDZBQOSA-N 0 0 379.363 3.097 20 5 GGBDRN CC[C@@H](C)Oc1cc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)ccn1 ZINC000181434052 1430298256 /nfs/dbraw/zinc/29/82/56/1430298256.db2.gz YDTHZEAVXLZTHL-CQSZACIVSA-N 0 0 395.419 3.283 20 5 GGBDRN CC[C@@H](C)Oc1cc(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccn1 ZINC000181450313 1430302423 /nfs/dbraw/zinc/30/24/23/1430302423.db2.gz JXEZIEPZHTZEPZ-CQSZACIVSA-N 0 0 395.419 3.283 20 5 GGBDRN Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000181466983 1430305651 /nfs/dbraw/zinc/30/56/51/1430305651.db2.gz KRGPUSBCNPRXLG-UHFFFAOYSA-N 0 0 399.794 3.094 20 5 GGBDRN COc1cc(C(=O)N2CCC(n3ccc(C(F)(F)F)n3)CC2)ccc1[N+](=O)[O-] ZINC000181472256 1430306735 /nfs/dbraw/zinc/30/67/35/1430306735.db2.gz RYWAGCJJFHJEGT-UHFFFAOYSA-N 0 0 398.341 3.296 20 5 GGBDRN COc1ccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000181508434 1430312625 /nfs/dbraw/zinc/31/26/25/1430312625.db2.gz YDEMDBIPEGHZEE-UHFFFAOYSA-N 0 0 384.310 3.316 20 5 GGBDRN COc1ccc(CN(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000181509880 1430312881 /nfs/dbraw/zinc/31/28/81/1430312881.db2.gz VRQFKJDTMVCCJW-UHFFFAOYSA-N 0 0 390.461 3.042 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000181520239 1430314582 /nfs/dbraw/zinc/31/45/82/1430314582.db2.gz KQGWDZNYJHGJJS-NSHDSACASA-N 0 0 390.346 3.108 20 5 GGBDRN Cc1ccccc1[C@H]1CN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])[C@H](C)CO1 ZINC000181522626 1430314759 /nfs/dbraw/zinc/31/47/59/1430314759.db2.gz CFMYNELAGFUPFJ-IUODEOHRSA-N 0 0 396.490 3.335 20 5 GGBDRN Cc1ccccc1[C@@H]1CN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])[C@H](C)CO1 ZINC000181522608 1430314833 /nfs/dbraw/zinc/31/48/33/1430314833.db2.gz CFMYNELAGFUPFJ-DOMZBBRYSA-N 0 0 396.490 3.335 20 5 GGBDRN O=C(N[C@@H](c1ccccc1)c1cccnc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181525361 1430315215 /nfs/dbraw/zinc/31/52/15/1430315215.db2.gz ZVWGREZVFHGNPZ-SFHVURJKSA-N 0 0 377.356 3.238 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N(Cc2ccccc2)C[C@H]2CCCO2)s1 ZINC000181532389 1430316317 /nfs/dbraw/zinc/31/63/17/1430316317.db2.gz SSAWANFNIOAHRY-CQSZACIVSA-N 0 0 396.490 3.245 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCO[C@@H](Cc4ccccc4)C3)n2)c1 ZINC000181533910 1430316637 /nfs/dbraw/zinc/31/66/37/1430316637.db2.gz KTGMDBMQZLCTDW-SFHVURJKSA-N 0 0 380.404 3.088 20 5 GGBDRN COC(=O)CN(C)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000181557768 1430320070 /nfs/dbraw/zinc/32/00/70/1430320070.db2.gz AFGMRCUAVJWHLI-KRWDZBQOSA-N 0 0 391.811 3.033 20 5 GGBDRN Cc1c(NC(=O)CCN2CCO[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000181560020 1430320424 /nfs/dbraw/zinc/32/04/24/1430320424.db2.gz MEZHKLQOYINHDS-GOSISDBHSA-N 0 0 383.448 3.175 20 5 GGBDRN CC(C)(C)Oc1ccc(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000181566806 1430321279 /nfs/dbraw/zinc/32/12/79/1430321279.db2.gz BRZZFDCEGBTWNU-UHFFFAOYSA-N 0 0 395.419 3.283 20 5 GGBDRN C[C@@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(OCC2CC2)c(F)c1 ZINC000181570065 1430321557 /nfs/dbraw/zinc/32/15/57/1430321557.db2.gz BCVZTQJMVZBREW-GFCCVEGCSA-N 0 0 387.411 3.472 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N2CCO[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000181570385 1430321571 /nfs/dbraw/zinc/32/15/71/1430321571.db2.gz VZGCAONBQKKZCC-FUHWJXTLSA-N 0 0 383.448 3.174 20 5 GGBDRN O=C(N[C@@H]1COc2ccccc2C1=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181569936 1430321585 /nfs/dbraw/zinc/32/15/85/1430321585.db2.gz 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CCN(CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC000181675693 1430339816 /nfs/dbraw/zinc/33/98/16/1430339816.db2.gz YIFHWBAIVYUMDP-UHFFFAOYSA-N 0 0 384.404 3.169 20 5 GGBDRN CSc1c(F)cc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1F ZINC000181679061 1430340345 /nfs/dbraw/zinc/34/03/45/1430340345.db2.gz ZHFBURUJRRBGNU-UHFFFAOYSA-N 0 0 391.359 3.428 20 5 GGBDRN COc1ccc([C@H](CO)N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000181692212 1430342506 /nfs/dbraw/zinc/34/25/06/1430342506.db2.gz YKDJDROMPFOOSX-FQEVSTJZSA-N 0 0 399.447 3.009 20 5 GGBDRN CC(C)[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1F ZINC000181694509 1430342628 /nfs/dbraw/zinc/34/26/28/1430342628.db2.gz PGKXAYCJKPVAHL-OAHLLOKOSA-N 0 0 383.811 3.280 20 5 GGBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000181697028 1430343243 /nfs/dbraw/zinc/34/32/43/1430343243.db2.gz DOUSBKDIODBCMM-UHFFFAOYSA-N 0 0 382.445 3.497 20 5 GGBDRN COc1cc(OCC(=O)N(C)Cc2cc(F)c(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000181710752 1430345418 /nfs/dbraw/zinc/34/54/18/1430345418.db2.gz SIRNLZHQHQVQRJ-UHFFFAOYSA-N 0 0 384.310 3.058 20 5 GGBDRN NC(=O)CCN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000181714394 1430345991 /nfs/dbraw/zinc/34/59/91/1430345991.db2.gz BPZWSQABZRWJNZ-UHFFFAOYSA-N 0 0 393.852 3.249 20 5 GGBDRN COc1ccccc1[C@H]1CCCN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181722579 1430347741 /nfs/dbraw/zinc/34/77/41/1430347741.db2.gz VHDFBCHDTABXFG-GOSISDBHSA-N 0 0 390.461 3.214 20 5 GGBDRN CC[C@H](CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)Oc1ccccc1Cl ZINC000181726282 1430348213 /nfs/dbraw/zinc/34/82/13/1430348213.db2.gz ZAXQUNDAHRCBTH-GFCCVEGCSA-N 0 0 399.856 3.165 20 5 GGBDRN NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1Cl ZINC000181733108 1430349795 /nfs/dbraw/zinc/34/97/95/1430349795.db2.gz JSDYBVVRAXZWMD-UHFFFAOYSA-N 0 0 385.710 3.201 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000181741561 1430351036 /nfs/dbraw/zinc/35/10/36/1430351036.db2.gz ZSVPTYIYTOWTMM-UHFFFAOYSA-N 0 0 399.737 3.105 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(C)Cc2cc(F)c(F)c(F)c2)cc([N+](=O)[O-])c1 ZINC000181742214 1430351311 /nfs/dbraw/zinc/35/13/11/1430351311.db2.gz LOXIYHXOWQWPSK-UHFFFAOYSA-N 0 0 396.321 3.461 20 5 GGBDRN CCOC(=O)C[C@H](C)N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000181750246 1430352397 /nfs/dbraw/zinc/35/23/97/1430352397.db2.gz DRXCYIPYYOZHML-NSHDSACASA-N 0 0 377.422 3.132 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1 ZINC000181757816 1430353667 /nfs/dbraw/zinc/35/36/67/1430353667.db2.gz ICPFVZITGSYZNA-OAHLLOKOSA-N 0 0 397.431 3.000 20 5 GGBDRN COc1ccc(CCc2nnc(NCc3ccc(OC)c([N+](=O)[O-])c3)o2)cc1 ZINC000181758169 1430353692 /nfs/dbraw/zinc/35/36/92/1430353692.db2.gz MXCFCKGAPMZDTH-UHFFFAOYSA-N 0 0 384.392 3.392 20 5 GGBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCO[C@@H](c2ccccc2Cl)C1 ZINC000181760614 1430354201 /nfs/dbraw/zinc/35/42/01/1430354201.db2.gz DMPIYWOZFMAGSK-IFXJQAMLSA-N 0 0 392.839 3.061 20 5 GGBDRN 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ZSGQFUYKRKPNCP-UHFFFAOYSA-N 0 0 383.383 3.152 20 5 GGBDRN COCc1ccccc1CNC(=O)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000182114504 1430414617 /nfs/dbraw/zinc/41/46/17/1430414617.db2.gz KUUCCOUPRKSKDQ-UHFFFAOYSA-N 0 0 398.337 3.455 20 5 GGBDRN O=C(c1ccc(F)cc1F)N1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182117393 1430414753 /nfs/dbraw/zinc/41/47/53/1430414753.db2.gz VDMUHIZLWGCFHV-UHFFFAOYSA-N 0 0 395.793 3.484 20 5 GGBDRN O=C(NCCCNc1cccc(F)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000182132890 1430417648 /nfs/dbraw/zinc/41/76/48/1430417648.db2.gz YLYUVRSTMIHSMP-UHFFFAOYSA-N 0 0 383.383 3.152 20 5 GGBDRN O=C(Nc1nc(-c2cccs2)ns1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000182159400 1430421868 /nfs/dbraw/zinc/42/18/68/1430421868.db2.gz NZQKLXRJTXUWNI-UHFFFAOYSA-N 0 0 399.413 3.269 20 5 GGBDRN CC[N@@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc([N+](=O)[O-])ccc1[O-] ZINC000182161080 1430422261 /nfs/dbraw/zinc/42/22/61/1430422261.db2.gz VHEDQTOPJCFBIG-KRWDZBQOSA-N 0 0 399.447 3.133 20 5 GGBDRN 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ZINC000182631650 1430505699 /nfs/dbraw/zinc/50/56/99/1430505699.db2.gz IWCJHYQOLQFOAB-STQMWFEESA-N 0 0 391.468 3.462 20 5 GGBDRN COc1ccc([C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000182633238 1430506136 /nfs/dbraw/zinc/50/61/36/1430506136.db2.gz QVQPIFMCHZPMTE-MRXNPFEDSA-N 0 0 384.310 3.402 20 5 GGBDRN COc1ccc([C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000182637699 1430506952 /nfs/dbraw/zinc/50/69/52/1430506952.db2.gz YAMLSYGDTRIMOJ-QGZVFWFLSA-N 0 0 397.353 3.459 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000182639550 1430507486 /nfs/dbraw/zinc/50/74/86/1430507486.db2.gz BTBDRWRHZDHKLH-UHFFFAOYSA-N 0 0 395.868 3.411 20 5 GGBDRN C[C@@H](C[C@@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182642202 1430508418 /nfs/dbraw/zinc/50/84/18/1430508418.db2.gz BUTBOJXODXTRJZ-JOYOIKCWSA-N 0 0 386.376 3.500 20 5 GGBDRN C[C@H](C[C@@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182642223 1430508430 /nfs/dbraw/zinc/50/84/30/1430508430.db2.gz BUTBOJXODXTRJZ-BXKDBHETSA-N 0 0 386.376 3.500 20 5 GGBDRN C[C@H](C[C@H](O)c1cccs1)NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182642182 1430508476 /nfs/dbraw/zinc/50/84/76/1430508476.db2.gz BUTBOJXODXTRJZ-SKDRFNHKSA-N 0 0 386.376 3.500 20 5 GGBDRN O=C(N[C@H]1CCCCNC1=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000182646901 1430509138 /nfs/dbraw/zinc/50/91/38/1430509138.db2.gz FRFCDWLMVJSYNI-INIZCTEOSA-N 0 0 391.493 3.276 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCO[C@@H](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000182654988 1430511325 /nfs/dbraw/zinc/51/13/25/1430511325.db2.gz XGTYPZXZZVYNJO-INIZCTEOSA-N 0 0 385.420 3.005 20 5 GGBDRN COc1cc(CN(C)CCc2ccccn2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182663668 1430512958 /nfs/dbraw/zinc/51/29/58/1430512958.db2.gz IAKQIGWFRXVUTF-UHFFFAOYSA-N 0 0 381.379 3.317 20 5 GGBDRN CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)c2ccccc12 ZINC000182666248 1430513251 /nfs/dbraw/zinc/51/32/51/1430513251.db2.gz KBKBVOGGXONVFU-UHFFFAOYSA-N 0 0 399.428 3.185 20 5 GGBDRN C[C@H](C(=O)NCc1cccc(CN2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182667935 1430513289 /nfs/dbraw/zinc/51/32/89/1430513289.db2.gz FOMRDXRBXRDUIP-AWEZNQCLSA-N 0 0 399.422 3.276 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ncc(Cl)cc2Cl)CC1 ZINC000182671945 1430514222 /nfs/dbraw/zinc/51/42/22/1430514222.db2.gz KJGGIJVZOSZEKP-UHFFFAOYSA-N 0 0 395.246 3.255 20 5 GGBDRN O=C(NCCCOC1CCCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000182675408 1430515191 /nfs/dbraw/zinc/51/51/91/1430515191.db2.gz OAWXHENZAHBZHM-UHFFFAOYSA-N 0 0 383.832 3.042 20 5 GGBDRN Cc1csc(N(CC(F)(F)F)C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)n1 ZINC000182700262 1430520839 /nfs/dbraw/zinc/52/08/39/1430520839.db2.gz VZXBUDDLBYAPDM-UHFFFAOYSA-N 0 0 389.311 3.298 20 5 GGBDRN Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000182729633 1430528639 /nfs/dbraw/zinc/52/86/39/1430528639.db2.gz ZOYRUGXAAWYYJE-CYBMUJFWSA-N 0 0 394.497 3.412 20 5 GGBDRN Cc1cc(N(C)C)cc(C)c1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000182732672 1430528980 /nfs/dbraw/zinc/52/89/80/1430528980.db2.gz CRKUZLTWIHQTRG-UHFFFAOYSA-N 0 0 377.466 3.262 20 5 GGBDRN C[C@@H](C(=O)NCc1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182735005 1430530049 /nfs/dbraw/zinc/53/00/49/1430530049.db2.gz SZICYMNOXCMHML-CYBMUJFWSA-N 0 0 385.395 3.281 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000182737345 1430530231 /nfs/dbraw/zinc/53/02/31/1430530231.db2.gz MPAQBGJGFBCGKS-HNNXBMFYSA-N 0 0 399.422 3.130 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cc(C)n(-c2cccc(F)c2)n1 ZINC000182757487 1430534628 /nfs/dbraw/zinc/53/46/28/1430534628.db2.gz NMSQPZGUSAGEHL-UHFFFAOYSA-N 0 0 399.382 3.287 20 5 GGBDRN Cc1cc(NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)nn1-c1cccc(F)c1 ZINC000182762292 1430535759 /nfs/dbraw/zinc/53/57/59/1430535759.db2.gz PFVDVNMFCNPQSU-UHFFFAOYSA-N 0 0 395.394 3.229 20 5 GGBDRN O=C(CN1CCc2ccc([N+](=O)[O-])cc21)N[C@@H](c1nccs1)c1ccccc1 ZINC000182769235 1430536617 /nfs/dbraw/zinc/53/66/17/1430536617.db2.gz YHGADVMZHKQCTP-LJQANCHMSA-N 0 0 394.456 3.320 20 5 GGBDRN Cc1csc([C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C2CC2)n1 ZINC000182795778 1430541376 /nfs/dbraw/zinc/54/13/76/1430541376.db2.gz JQGOCJIQUCKRGQ-ZDUSSCGKSA-N 0 0 394.840 3.219 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)c1[N+](=O)[O-] ZINC000182797021 1430541638 /nfs/dbraw/zinc/54/16/38/1430541638.db2.gz RJHRPPFBLRBJLU-UHFFFAOYSA-N 0 0 394.313 3.337 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(CN2CCOCC2)c(Cl)c1 ZINC000182800352 1430542214 /nfs/dbraw/zinc/54/22/14/1430542214.db2.gz ILYFVZJWANVDAN-UHFFFAOYSA-N 0 0 389.839 3.262 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)cc([N+](=O)[O-])c1 ZINC000182801106 1430542503 /nfs/dbraw/zinc/54/25/03/1430542503.db2.gz QLLSJJVNEIUQRD-UGSOOPFHSA-N 0 0 383.404 3.390 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000182803306 1430542899 /nfs/dbraw/zinc/54/28/99/1430542899.db2.gz PYLCHEZETKHTNY-KUHUBIRLSA-N 0 0 377.404 3.399 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000182803266 1430542999 /nfs/dbraw/zinc/54/29/99/1430542999.db2.gz PYLCHEZETKHTNY-AUUYWEPGSA-N 0 0 377.404 3.399 20 5 GGBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000182808030 1430544018 /nfs/dbraw/zinc/54/40/18/1430544018.db2.gz GYBYFIDFJHLZQR-KUHUBIRLSA-N 0 0 377.404 3.399 20 5 GGBDRN CC(C)[C@@H](CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1cccnc1 ZINC000182823050 1430547211 /nfs/dbraw/zinc/54/72/11/1430547211.db2.gz RXXFANNHDIEZFM-CQSZACIVSA-N 0 0 390.827 3.138 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC[C@@H](C3(C)OCCO3)C2)cc1[N+](=O)[O-] ZINC000182835898 1430550736 /nfs/dbraw/zinc/55/07/36/1430550736.db2.gz WOSLNMCOZUOAOX-GDBMZVCRSA-N 0 0 377.441 3.149 20 5 GGBDRN CC(C)(O)CN(Cc1ccccc1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000182841826 1430551796 /nfs/dbraw/zinc/55/17/96/1430551796.db2.gz KGLYPXFKWFRZHI-UHFFFAOYSA-N 0 0 394.431 3.194 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182863088 1430556005 /nfs/dbraw/zinc/55/60/05/1430556005.db2.gz GIKLOWNSZYTIRF-CQSZACIVSA-N 0 0 382.342 3.216 20 5 GGBDRN Cc1ccc(NS(C)(=O)=O)c(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000182864528 1430556203 /nfs/dbraw/zinc/55/62/03/1430556203.db2.gz KFANKMXUYUKCGQ-LLVKDONJSA-N 0 0 395.412 3.156 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)cn2)n1 ZINC000182877491 1430559897 /nfs/dbraw/zinc/55/98/97/1430559897.db2.gz XKLDBCKOCSBKSE-AWEZNQCLSA-N 0 0 397.410 3.351 20 5 GGBDRN Nc1c(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc(F)cc1[N+](=O)[O-] ZINC000182886736 1430562286 /nfs/dbraw/zinc/56/22/86/1430562286.db2.gz RQAIJGMZVZIOOW-JTQLQIEISA-N 0 0 396.781 3.117 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182888515 1430562704 /nfs/dbraw/zinc/56/27/04/1430562704.db2.gz FXTSUWAUGHQYFP-ZDUSSCGKSA-N 0 0 398.341 3.053 20 5 GGBDRN O=C(N[C@@H](c1cccc(F)c1)c1ccccn1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000182897902 1430565561 /nfs/dbraw/zinc/56/55/61/1430565561.db2.gz LYWHUVDJQIDDCR-SFHVURJKSA-N 0 0 395.346 3.377 20 5 GGBDRN C[NH+](C)[C@@H]1Cc2ccccc2N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182901310 1430566382 /nfs/dbraw/zinc/56/63/82/1430566382.db2.gz MQIOTSAMHYXLOD-CQSZACIVSA-N 0 0 391.374 3.329 20 5 GGBDRN C[NH+](C)[C@H]1Cc2ccccc2N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182901335 1430566526 /nfs/dbraw/zinc/56/65/26/1430566526.db2.gz MQIOTSAMHYXLOD-AWEZNQCLSA-N 0 0 391.374 3.329 20 5 GGBDRN COc1cc(OCC(=O)Nc2cc(C)n(-c3ccc(C)cc3)n2)ccc1[N+](=O)[O-] ZINC000182902277 1430567077 /nfs/dbraw/zinc/56/70/77/1430567077.db2.gz OLGZOGLDJSZGPP-UHFFFAOYSA-N 0 0 396.403 3.423 20 5 GGBDRN O=C(Nc1cccc2ncccc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182914441 1430570050 /nfs/dbraw/zinc/57/00/50/1430570050.db2.gz CWJYUYBEHKRRMU-UHFFFAOYSA-N 0 0 378.388 3.232 20 5 GGBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182916684 1430570524 /nfs/dbraw/zinc/57/05/24/1430570524.db2.gz WINPFCJAEQPRHR-ZDUSSCGKSA-N 0 0 398.341 3.053 20 5 GGBDRN CCC(CC)n1nc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1C ZINC000182916111 1430570658 /nfs/dbraw/zinc/57/06/58/1430570658.db2.gz NFOXECYJJSJEDY-UHFFFAOYSA-N 0 0 385.468 3.423 20 5 GGBDRN COc1cccc([C@@H]2[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC(=O)N2C2CC2)c1 ZINC000182933677 1430575118 /nfs/dbraw/zinc/57/51/18/1430575118.db2.gz BYGNCILVFCXSJU-AZUAARDMSA-N 0 0 395.415 3.294 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000182976847 1430584041 /nfs/dbraw/zinc/58/40/41/1430584041.db2.gz YFJDRLQMWQLASN-HNNXBMFYSA-N 0 0 375.356 3.428 20 5 GGBDRN O=C(Nc1cnc2ccccc2c1)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000182980386 1430584681 /nfs/dbraw/zinc/58/46/81/1430584681.db2.gz HMBRZCJYOQWETE-UHFFFAOYSA-N 0 0 378.388 3.232 20 5 GGBDRN C[C@@H](C(=O)Nc1ccccc1N1CCC(O)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182987851 1430586169 /nfs/dbraw/zinc/58/61/69/1430586169.db2.gz LSEUQOFNGAOQFW-CYBMUJFWSA-N 0 0 387.411 3.437 20 5 GGBDRN C[C@H](C(=O)Nc1ccccc1N1CCC(O)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000182987833 1430586370 /nfs/dbraw/zinc/58/63/70/1430586370.db2.gz LSEUQOFNGAOQFW-ZDUSSCGKSA-N 0 0 387.411 3.437 20 5 GGBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000182995152 1430588303 /nfs/dbraw/zinc/58/83/03/1430588303.db2.gz STCZZEVCPHLBLF-BDJLRTHQSA-N 0 0 388.811 3.191 20 5 GGBDRN Cc1c([C@@H](C)NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000183001000 1430589322 /nfs/dbraw/zinc/58/93/22/1430589322.db2.gz LUCWSWLQTPHBFI-GFCCVEGCSA-N 0 0 397.410 3.178 20 5 GGBDRN CC(C)(C)C[C@H](NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)C(F)(F)F ZINC000183009373 1430591611 /nfs/dbraw/zinc/59/16/11/1430591611.db2.gz YISBJUSCGUYEPT-ZDUSSCGKSA-N 0 0 385.346 3.272 20 5 GGBDRN O=C(NC[C@@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000183024939 1430595280 /nfs/dbraw/zinc/59/52/80/1430595280.db2.gz NJOZUTWJEWXLCB-KRWDZBQOSA-N 0 0 395.459 3.281 20 5 GGBDRN CCc1ccc([C@@H](COC)NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)o1 ZINC000183027305 1430596034 /nfs/dbraw/zinc/59/60/34/1430596034.db2.gz LZGPRKPHXQUFBE-CYBMUJFWSA-N 0 0 384.335 3.469 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NCCc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000183100579 1430613163 /nfs/dbraw/zinc/61/31/63/1430613163.db2.gz ZZUOEETWWODLQD-UHFFFAOYSA-N 0 0 391.427 3.145 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)cc1[N+](=O)[O-] ZINC000183116040 1430618082 /nfs/dbraw/zinc/61/80/82/1430618082.db2.gz YNCDRMRXKXXMHP-CYBMUJFWSA-N 0 0 399.451 3.110 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@@H](C)c2cccc(OC(C)C)c2)ccc1[N+](=O)[O-] ZINC000183123797 1430620870 /nfs/dbraw/zinc/62/08/70/1430620870.db2.gz CATIYVOVWFYVJO-HNNXBMFYSA-N 0 0 399.447 3.298 20 5 GGBDRN O=C(NCc1ccccc1N1CCCCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000183135006 1430624954 /nfs/dbraw/zinc/62/49/54/1430624954.db2.gz VRJBGTZMCDJMQM-UHFFFAOYSA-N 0 0 379.420 3.391 20 5 GGBDRN C[S@](=O)C[C@@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000183139896 1430626661 /nfs/dbraw/zinc/62/66/61/1430626661.db2.gz LWMQDZKUDWWXTG-CLYVBNDRSA-N 0 0 385.445 3.459 20 5 GGBDRN CCOc1cccc(N2CCN(C(=O)Cc3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000183147255 1430628631 /nfs/dbraw/zinc/62/86/31/1430628631.db2.gz UALDKCUJOSDJEB-UHFFFAOYSA-N 0 0 387.411 3.024 20 5 GGBDRN Cc1nn(CCC(=O)NCc2ccccc2N2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000183155813 1430631331 /nfs/dbraw/zinc/63/13/31/1430631331.db2.gz AKWFEVCKUGMLHZ-UHFFFAOYSA-N 0 0 385.468 3.105 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(OC(F)F)c(F)c2)ccc1[N+](=O)[O-] ZINC000183166752 1430636465 /nfs/dbraw/zinc/63/64/65/1430636465.db2.gz ZMFABZCTYYGSKA-UHFFFAOYSA-N 0 0 397.309 3.012 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CCCc2c1cnn2C ZINC000183175839 1430639478 /nfs/dbraw/zinc/63/94/78/1430639478.db2.gz CGKFYMSSGIEIOR-ZDUSSCGKSA-N 0 0 380.351 3.079 20 5 GGBDRN COCc1nnc(-c2cccc(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)c2)o1 ZINC000183175982 1430639615 /nfs/dbraw/zinc/63/96/15/1430639615.db2.gz KIFACAUUOQLGQH-GFCCVEGCSA-N 0 0 382.376 3.282 20 5 GGBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000183178532 1430640151 /nfs/dbraw/zinc/64/01/51/1430640151.db2.gz FCCJPLYFORLJFD-MRVPVSSYSA-N 0 0 385.346 3.416 20 5 GGBDRN Cc1cccc([C@H]2CCCN2C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000183199064 1430645915 /nfs/dbraw/zinc/64/59/15/1430645915.db2.gz BLDSVKUAFPODPY-LJQANCHMSA-N 0 0 381.432 3.305 20 5 GGBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000183223735 1430652364 /nfs/dbraw/zinc/65/23/64/1430652364.db2.gz KTUFETJJMAHBQZ-SCLBCKFNSA-N 0 0 387.436 3.150 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@H]1CC(=O)c1ccccc1 ZINC000183233611 1430654841 /nfs/dbraw/zinc/65/48/41/1430654841.db2.gz OIAWLHHHJQGBTA-INIZCTEOSA-N 0 0 388.445 3.329 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1 ZINC000183236294 1430656090 /nfs/dbraw/zinc/65/60/90/1430656090.db2.gz WTOWELIKIIGREE-UHFFFAOYSA-N 0 0 393.394 3.397 20 5 GGBDRN CC[C@@H](C)Oc1ccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000183237045 1430656463 /nfs/dbraw/zinc/65/64/63/1430656463.db2.gz QSOAMDOWDALHQJ-CQSZACIVSA-N 0 0 385.420 3.449 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H]2CCc3c2cccc3Cl)ccc1[N+](=O)[O-] ZINC000183239457 1430657122 /nfs/dbraw/zinc/65/71/22/1430657122.db2.gz XGCUEFDRTSKNOB-INIZCTEOSA-N 0 0 387.823 3.090 20 5 GGBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000183240373 1430657766 /nfs/dbraw/zinc/65/77/66/1430657766.db2.gz NZWLDQVTWFSIKG-MRXNPFEDSA-N 0 0 388.445 3.329 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@H]1CC(=O)c1cccs1 ZINC000183241936 1430658161 /nfs/dbraw/zinc/65/81/61/1430658161.db2.gz NIIDZOHYRZGZOX-ZDUSSCGKSA-N 0 0 394.474 3.391 20 5 GGBDRN O=[N+]([O-])c1ccc(CCSCc2ccc(S(=O)(=O)N3CCCC3)o2)cc1 ZINC000183270955 1430666232 /nfs/dbraw/zinc/66/62/32/1430666232.db2.gz QPCXZQOQLPDHTA-UHFFFAOYSA-N 0 0 396.490 3.448 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000183280221 1430668771 /nfs/dbraw/zinc/66/87/71/1430668771.db2.gz LMVOUXZMBPSANZ-JTQLQIEISA-N 0 0 384.318 3.074 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc2nc(N3CCCC3)sc2c1 ZINC000183282730 1430669345 /nfs/dbraw/zinc/66/93/45/1430669345.db2.gz BBJFKGMZVBKYIP-UHFFFAOYSA-N 0 0 384.421 3.034 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CC[C@@H](Oc4cccc(F)c4)C3)o2)cc1 ZINC000183366737 1430691489 /nfs/dbraw/zinc/69/14/89/1430691489.db2.gz ILRPQRFPDDLVNF-QGZVFWFLSA-N 0 0 384.367 3.437 20 5 GGBDRN Cc1ccc(Cn2nccc2NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000183379552 1430695152 /nfs/dbraw/zinc/69/51/52/1430695152.db2.gz NQHDMJYISKKEBF-UHFFFAOYSA-N 0 0 386.433 3.090 20 5 GGBDRN COc1ccc([C@@H](NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc1 ZINC000183380795 1430695481 /nfs/dbraw/zinc/69/54/81/1430695481.db2.gz PMPOLTGHKMEZCI-QGZVFWFLSA-N 0 0 397.353 3.459 20 5 GGBDRN O=C(CN1CC[C@@H](Oc2cccc(F)c2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000183379979 1430695739 /nfs/dbraw/zinc/69/57/39/1430695739.db2.gz IIZPQHOCDZBNLE-OAHLLOKOSA-N 0 0 393.802 3.479 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCCOc2cc(F)ccc21 ZINC000183387118 1430697563 /nfs/dbraw/zinc/69/75/63/1430697563.db2.gz BMZPIYXRQXXDKT-OAHLLOKOSA-N 0 0 387.367 3.011 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@@H](Oc4cccc(F)c4)C3)n2)c1 ZINC000183387078 1430697737 /nfs/dbraw/zinc/69/77/37/1430697737.db2.gz LNMODCIDAQZMGE-QGZVFWFLSA-N 0 0 384.367 3.437 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)NC(C)(C)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000183389835 1430698486 /nfs/dbraw/zinc/69/84/86/1430698486.db2.gz OIOCRRLCMAYUNN-UHFFFAOYSA-N 0 0 389.839 3.338 20 5 GGBDRN COc1ccc([C@@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000183406035 1430703506 /nfs/dbraw/zinc/70/35/06/1430703506.db2.gz YOJUKUYAEXYXOU-OAHLLOKOSA-N 0 0 383.326 3.096 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N[C@H](c2ccc(F)cc2)C2CCC2)ccc1[N+](=O)[O-] ZINC000183415501 1430705879 /nfs/dbraw/zinc/70/58/79/1430705879.db2.gz VNLZLXHVNLAHTE-FQEVSTJZSA-N 0 0 399.422 3.430 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1C(F)(F)F)C1CC1 ZINC000183416608 1430706484 /nfs/dbraw/zinc/70/64/84/1430706484.db2.gz BIDKHBBQGCGDLS-UHFFFAOYSA-N 0 0 380.326 3.396 20 5 GGBDRN CSc1cccc(N(C)C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1 ZINC000183438642 1430712005 /nfs/dbraw/zinc/71/20/05/1430712005.db2.gz NYPNMQGPZWEMTL-UHFFFAOYSA-N 0 0 387.461 3.430 20 5 GGBDRN CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000183460460 1430717234 /nfs/dbraw/zinc/71/72/34/1430717234.db2.gz LTQDXXZIDOOUIN-XJKSGUPXSA-N 0 0 375.450 3.341 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2cccc(N(C)C(C)C)c2)ccc1[N+](=O)[O-] ZINC000183470785 1430719997 /nfs/dbraw/zinc/71/99/97/1430719997.db2.gz BPDHDZUPRAIVKB-UHFFFAOYSA-N 0 0 384.436 3.116 20 5 GGBDRN O=C(NCCC[C@H]1CCCCO1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000183476154 1430721607 /nfs/dbraw/zinc/72/16/07/1430721607.db2.gz MKAKQUBAWHYBAK-QGZVFWFLSA-N 0 0 375.469 3.277 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000183478305 1430722440 /nfs/dbraw/zinc/72/24/40/1430722440.db2.gz ZKTOQSBEOMKKAL-DNVCBOLYSA-N 0 0 386.452 3.494 20 5 GGBDRN Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183490924 1430725865 /nfs/dbraw/zinc/72/58/65/1430725865.db2.gz HAYVAWOXZFTCJK-UHFFFAOYSA-N 0 0 391.387 3.385 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](c1nc(C)cs1)C1CC1 ZINC000183511794 1430731722 /nfs/dbraw/zinc/73/17/22/1430731722.db2.gz UHVQTOINOOIASX-MRXNPFEDSA-N 0 0 376.438 3.048 20 5 GGBDRN CCOc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])cnc3N)n2)cc1 ZINC000183522784 1430734198 /nfs/dbraw/zinc/73/41/98/1430734198.db2.gz ZCUSOFGPCXWEGT-UHFFFAOYSA-N 0 0 385.405 3.347 20 5 GGBDRN CC(C)(C)Oc1c(F)cc(NC(=O)NCCn2cc([N+](=O)[O-])cn2)cc1F ZINC000183529290 1430735475 /nfs/dbraw/zinc/73/54/75/1430735475.db2.gz FEABOPPPLOMYGC-UHFFFAOYSA-N 0 0 383.355 3.069 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@@H](c2nc(C)cs2)C2CC2)c([N+](=O)[O-])c1 ZINC000183552906 1430741060 /nfs/dbraw/zinc/74/10/60/1430741060.db2.gz NGASGHUVFQTNSI-QGZVFWFLSA-N 0 0 390.465 3.438 20 5 GGBDRN CCS[C@@H]1CCCCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 ZINC000183563627 1430743052 /nfs/dbraw/zinc/74/30/52/1430743052.db2.gz HDXARHUFEDHBDF-OAHLLOKOSA-N 0 0 393.509 3.179 20 5 GGBDRN O=C(Nc1ccc(NC[C@H]2CCCO2)c(F)c1)Nc1ccncc1[N+](=O)[O-] ZINC000183568365 1430743325 /nfs/dbraw/zinc/74/33/25/1430743325.db2.gz OLRHLNCRLDKSNE-GFCCVEGCSA-N 0 0 375.360 3.364 20 5 GGBDRN O=C(NCCc1nc(-c2cccc(Cl)c2)no1)Nc1ccncc1[N+](=O)[O-] ZINC000183568094 1430743389 /nfs/dbraw/zinc/74/33/89/1430743389.db2.gz YEKMNOHKMXMQHA-UHFFFAOYSA-N 0 0 388.771 3.057 20 5 GGBDRN O=C(Nc1ccc(NC[C@@H]2CCCO2)c(F)c1)Nc1ccncc1[N+](=O)[O-] ZINC000183568345 1430743484 /nfs/dbraw/zinc/74/34/84/1430743484.db2.gz OLRHLNCRLDKSNE-LBPRGKRZSA-N 0 0 375.360 3.364 20 5 GGBDRN COc1ccc([C@H](CCO)NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000183570618 1430743786 /nfs/dbraw/zinc/74/37/86/1430743786.db2.gz AXGOZACVUWZKJZ-SGTLLEGYSA-N 0 0 376.384 3.086 20 5 GGBDRN COc1ccc(C(=O)NCC(=O)N(C)[C@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000183574214 1430744665 /nfs/dbraw/zinc/74/46/65/1430744665.db2.gz JDPHDNHFWACLTE-FQEVSTJZSA-N 0 0 399.447 3.189 20 5 GGBDRN O=C(NCc1ccc(NC(=O)c2ccco2)cc1)Nc1ccncc1[N+](=O)[O-] ZINC000183579799 1430746049 /nfs/dbraw/zinc/74/60/49/1430746049.db2.gz XQMCHDIPUIKCAP-UHFFFAOYSA-N 0 0 381.348 3.157 20 5 GGBDRN CC(C)[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)CC1 ZINC000183588289 1430748712 /nfs/dbraw/zinc/74/87/12/1430748712.db2.gz NEQIGLMBYNZUHQ-INIZCTEOSA-N 0 0 375.469 3.330 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])NC1CCN(Cc2ccc(F)c(F)c2)CC1 ZINC000183589800 1430748780 /nfs/dbraw/zinc/74/87/80/1430748780.db2.gz HZHUDTGWTPKMBJ-UHFFFAOYSA-N 0 0 391.378 3.054 20 5 GGBDRN COc1ccc(C(C)(C)CNS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000183604282 1430752503 /nfs/dbraw/zinc/75/25/03/1430752503.db2.gz LBFANASHJUFANG-UHFFFAOYSA-N 0 0 392.477 3.043 20 5 GGBDRN COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)Nc2ccncc2[N+](=O)[O-])C1 ZINC000183604422 1430752571 /nfs/dbraw/zinc/75/25/71/1430752571.db2.gz WCVJMWDOLPOMBN-GFCCVEGCSA-N 0 0 391.815 3.052 20 5 GGBDRN Cc1ccc(C[C@@H]2CCCN2C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000183606412 1430753350 /nfs/dbraw/zinc/75/33/50/1430753350.db2.gz PUWGBSVRFHGHIK-IBGZPJMESA-N 0 0 395.459 3.175 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccccc2OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000183617393 1430755484 /nfs/dbraw/zinc/75/54/84/1430755484.db2.gz BUHLLGFHLDZORQ-UHFFFAOYSA-N 0 0 385.420 3.449 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 ZINC000183618512 1430756082 /nfs/dbraw/zinc/75/60/82/1430756082.db2.gz RTFHUDAHQIIRRC-OAHLLOKOSA-N 0 0 380.763 3.388 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CCCN(c2ccccc2Cl)C1 ZINC000183621760 1430756576 /nfs/dbraw/zinc/75/65/76/1430756576.db2.gz RGJWOYBXZUIVSV-LBPRGKRZSA-N 0 0 375.816 3.434 20 5 GGBDRN O=C(Nc1ccccc1)c1nnc(CN2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000183624139 1430756845 /nfs/dbraw/zinc/75/68/45/1430756845.db2.gz MNWVDPKBHXNPMI-UHFFFAOYSA-N 0 0 381.417 3.261 20 5 GGBDRN CC(C)CN(C[C@@H](O)c1ccc(F)cc1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183622934 1430756882 /nfs/dbraw/zinc/75/68/82/1430756882.db2.gz BKRSHOIZPNDPEY-QGZVFWFLSA-N 0 0 376.388 3.352 20 5 GGBDRN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000183644957 1430762527 /nfs/dbraw/zinc/76/25/27/1430762527.db2.gz BMWVODYINGPVRF-AEFFLSMTSA-N 0 0 395.459 3.346 20 5 GGBDRN COc1ccccc1C(C)(C)NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183644655 1430762565 /nfs/dbraw/zinc/76/25/65/1430762565.db2.gz JSGSKOJEJSKFAR-UHFFFAOYSA-N 0 0 378.450 3.001 20 5 GGBDRN CC[C@@H](NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccc(F)cc1F ZINC000183647774 1430763655 /nfs/dbraw/zinc/76/36/55/1430763655.db2.gz UIMPBJZCTBEPBY-MRXNPFEDSA-N 0 0 391.374 3.179 20 5 GGBDRN Cc1nc2c(s1)[C@@H](N(C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000183660342 1430765823 /nfs/dbraw/zinc/76/58/23/1430765823.db2.gz WKDOBFJKRYIAIM-INIZCTEOSA-N 0 0 395.506 3.241 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccccc2OCC2CC2)ccc1[N+](=O)[O-] ZINC000183665363 1430767126 /nfs/dbraw/zinc/76/71/26/1430767126.db2.gz VDWOVXTTZHOPSN-UHFFFAOYSA-N 0 0 383.404 3.061 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(OC(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000183675226 1430769757 /nfs/dbraw/zinc/76/97/57/1430769757.db2.gz BSTFQQWAQWPIJV-UHFFFAOYSA-N 0 0 385.420 3.449 20 5 GGBDRN CC[C@@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000183675155 1430769819 /nfs/dbraw/zinc/76/98/19/1430769819.db2.gz HDQOMVPUCLOMIP-QGZVFWFLSA-N 0 0 384.404 3.486 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CC[C@@H](c3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000183684656 1430772156 /nfs/dbraw/zinc/77/21/56/1430772156.db2.gz HKMFPSINOKTPOD-VQIMIIECSA-N 0 0 395.459 3.285 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CCC(C)(CO)CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000183686426 1430772702 /nfs/dbraw/zinc/77/27/02/1430772702.db2.gz GVZKYDQKKDWNQA-HNNXBMFYSA-N 0 0 398.463 3.398 20 5 GGBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000183691038 1430774178 /nfs/dbraw/zinc/77/41/78/1430774178.db2.gz GICIBPDMCKUXKG-MRXNPFEDSA-N 0 0 396.378 3.213 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2C[C@H](C)C[C@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000183691103 1430774207 /nfs/dbraw/zinc/77/42/07/1430774207.db2.gz MAPLVRHYFCYKND-YJYMSZOUSA-N 0 0 399.422 3.382 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(Cc2cccc(O)c2)CC2CC2)cc1 ZINC000183693707 1430774430 /nfs/dbraw/zinc/77/44/30/1430774430.db2.gz HGVFTUHMRIJGKD-UHFFFAOYSA-N 0 0 390.461 3.085 20 5 GGBDRN Cc1ccc(-n2nc(C(C)C)cc2NC(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000183695143 1430774945 /nfs/dbraw/zinc/77/49/45/1430774945.db2.gz GOUBNDATLQCLRV-UHFFFAOYSA-N 0 0 380.408 3.442 20 5 GGBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N ZINC000183703519 1430777372 /nfs/dbraw/zinc/77/73/72/1430777372.db2.gz OAZSSKFIXCVTQG-SNVBAGLBSA-N 0 0 383.433 3.495 20 5 GGBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NCc2ccccc2OCC2CC2)cc1 ZINC000183712724 1430778905 /nfs/dbraw/zinc/77/89/05/1430778905.db2.gz NKLCBTVRSMACID-UHFFFAOYSA-N 0 0 390.461 3.046 20 5 GGBDRN CC(C)NC(=O)c1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000183755979 1430787471 /nfs/dbraw/zinc/78/74/71/1430787471.db2.gz UYKWEORKOUFMHL-UHFFFAOYSA-N 0 0 375.812 3.316 20 5 GGBDRN CCN(C)C(=O)c1cccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000183767374 1430789640 /nfs/dbraw/zinc/78/96/40/1430789640.db2.gz ORADKWWGNWBNGN-UHFFFAOYSA-N 0 0 375.812 3.270 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CCc3c2cccc3F)ccc1[N+](=O)[O-] ZINC000183773892 1430790735 /nfs/dbraw/zinc/79/07/35/1430790735.db2.gz FMAXTKJJQQSMCG-IBGZPJMESA-N 0 0 397.406 3.236 20 5 GGBDRN COC(=O)[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)c(C)c1 ZINC000183804713 1430798338 /nfs/dbraw/zinc/79/83/38/1430798338.db2.gz FGVBXVDDQPCPQG-KRWDZBQOSA-N 0 0 394.786 3.269 20 5 GGBDRN COc1cc(CSc2nnnn2-c2cccc(C)c2)c([N+](=O)[O-])cc1F ZINC000183831847 1430802567 /nfs/dbraw/zinc/80/25/67/1430802567.db2.gz ZGXACHOHXWFWEE-UHFFFAOYSA-N 0 0 375.385 3.319 20 5 GGBDRN CC[C@H]1Cc2ccccc2CN1C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000183837044 1430803014 /nfs/dbraw/zinc/80/30/14/1430803014.db2.gz QXCKCXYMODRHMN-INIZCTEOSA-N 0 0 399.472 3.149 20 5 GGBDRN Cn1c(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)nc2cccc(Cl)c21 ZINC000183849167 1430804617 /nfs/dbraw/zinc/80/46/17/1430804617.db2.gz SVFDDDBAVGBFLE-UHFFFAOYSA-N 0 0 397.778 3.229 20 5 GGBDRN CC[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000183851580 1430804953 /nfs/dbraw/zinc/80/49/53/1430804953.db2.gz FKUXJJKGGFBBAY-QGZVFWFLSA-N 0 0 377.404 3.153 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1CC(=O)c1ccccc1 ZINC000183858758 1430805711 /nfs/dbraw/zinc/80/57/11/1430805711.db2.gz UUQVHPLABDOQPN-HNNXBMFYSA-N 0 0 382.420 3.230 20 5 GGBDRN CCc1n[nH]c(C(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)c1[N+](=O)[O-] ZINC000183856996 1430805730 /nfs/dbraw/zinc/80/57/30/1430805730.db2.gz AELVBXHJZFJGIJ-UHFFFAOYSA-N 0 0 398.250 3.150 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1CC(=O)c1ccccc1 ZINC000183858776 1430805747 /nfs/dbraw/zinc/80/57/47/1430805747.db2.gz UUQVHPLABDOQPN-OAHLLOKOSA-N 0 0 382.420 3.230 20 5 GGBDRN CC(=O)C[C@@H]1COCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000183865429 1430806483 /nfs/dbraw/zinc/80/64/83/1430806483.db2.gz XQOCZFDHDWKPPO-QGZVFWFLSA-N 0 0 383.404 3.159 20 5 GGBDRN CC(C)CCOc1ccccc1CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-] ZINC000183867137 1430806810 /nfs/dbraw/zinc/80/68/10/1430806810.db2.gz WIWXMCDMHVISMS-UHFFFAOYSA-N 0 0 393.465 3.279 20 5 GGBDRN C[NH+](C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)c1cccc(C(F)(F)F)c1 ZINC000183898373 1430810364 /nfs/dbraw/zinc/81/03/64/1430810364.db2.gz DQSQWGLCAABDTL-HNNXBMFYSA-N 0 0 397.353 3.352 20 5 GGBDRN CC(C)OC(=O)c1ccn(Cc2ccc([N+](=O)[O-])cc2C(F)(F)F)c(=O)c1 ZINC000183900960 1430810544 /nfs/dbraw/zinc/81/05/44/1430810544.db2.gz FSMUPJFFAGQCCL-UHFFFAOYSA-N 0 0 384.310 3.389 20 5 GGBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@H](C2(C)OCCO2)C1 ZINC000183905755 1430811379 /nfs/dbraw/zinc/81/13/79/1430811379.db2.gz PUMAILXHBUANNX-OLZOCXBDSA-N 0 0 397.859 3.050 20 5 GGBDRN COc1cc(C(=O)Nc2ccnn2-c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000183908971 1430812013 /nfs/dbraw/zinc/81/20/13/1430812013.db2.gz RHYZTEVXLPFGAE-UHFFFAOYSA-N 0 0 386.339 3.189 20 5 GGBDRN CC(C)OC(=O)c1ccn(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c(=O)c1 ZINC000183916065 1430812881 /nfs/dbraw/zinc/81/28/81/1430812881.db2.gz JDIIGXBEXZQYDY-UHFFFAOYSA-N 0 0 383.360 3.025 20 5 GGBDRN CC[C@H](CNc1cccc(S(N)(=O)=O)c1[N+](=O)[O-])Oc1ccccc1Cl ZINC000183939643 1430815613 /nfs/dbraw/zinc/81/56/13/1430815613.db2.gz DTTSEKWEWVDHBC-LLVKDONJSA-N 0 0 399.856 3.165 20 5 GGBDRN CCOc1ccc(NC(=O)CNC(C)(C)c2ncc(C)s2)c([N+](=O)[O-])c1 ZINC000183973228 1430821193 /nfs/dbraw/zinc/82/11/93/1430821193.db2.gz WKKWUTRYXIFOEX-UHFFFAOYSA-N 0 0 378.454 3.222 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)NC(C)(C)c1ncc(C)s1 ZINC000183981249 1430822972 /nfs/dbraw/zinc/82/29/72/1430822972.db2.gz LXDVFJAFEBWWTM-LLVKDONJSA-N 0 0 378.454 3.220 20 5 GGBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccccc2CN2CCNC2=O)cc1[N+](=O)[O-] ZINC000184002298 1430826919 /nfs/dbraw/zinc/82/69/19/1430826919.db2.gz HLFONOFUSVYZRW-CQSZACIVSA-N 0 0 397.435 3.311 20 5 GGBDRN COc1cc(CNc2cccc(-c3nnnn3C3CC3)c2)c([N+](=O)[O-])cc1F ZINC000184001067 1430826977 /nfs/dbraw/zinc/82/69/77/1430826977.db2.gz CXNJMZGARCLTGH-UHFFFAOYSA-N 0 0 384.371 3.343 20 5 GGBDRN C[C@H](C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184016633 1430829165 /nfs/dbraw/zinc/82/91/65/1430829165.db2.gz MVBUSDDAERVLFF-IFXJQAMLSA-N 0 0 399.422 3.491 20 5 GGBDRN Cc1c(CC(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)cccc1[N+](=O)[O-] ZINC000184057598 1430835588 /nfs/dbraw/zinc/83/55/88/1430835588.db2.gz QJGTYZQWXFTWPL-UHFFFAOYSA-N 0 0 386.423 3.181 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCOC[C@@H]1[C@H]1CCCCC1=O ZINC000184059436 1430835781 /nfs/dbraw/zinc/83/57/81/1430835781.db2.gz VZAAMEUTHPGPDK-HUUCEWRRSA-N 0 0 388.445 3.410 20 5 GGBDRN COCCn1c(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)nc2ccccc21 ZINC000184059852 1430835849 /nfs/dbraw/zinc/83/58/49/1430835849.db2.gz SXERWQAJIBSAEV-GFCCVEGCSA-N 0 0 386.383 3.472 20 5 GGBDRN COCCn1c(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)nc2ccccc21 ZINC000184059835 1430835887 /nfs/dbraw/zinc/83/58/87/1430835887.db2.gz SXERWQAJIBSAEV-LBPRGKRZSA-N 0 0 386.383 3.472 20 5 GGBDRN COc1cc(CN2CCC(C)(CO)CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000184073740 1430837603 /nfs/dbraw/zinc/83/76/03/1430837603.db2.gz OJQYGTSERPDLNA-UHFFFAOYSA-N 0 0 392.374 3.139 20 5 GGBDRN COCCn1c2ccccc2nc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000184091204 1430840163 /nfs/dbraw/zinc/84/01/63/1430840163.db2.gz WVBFWAPSHFIYKX-UHFFFAOYSA-N 0 0 383.408 3.032 20 5 GGBDRN Cc1c(NC(=O)c2cc([N+](=O)[O-])cnc2N)cccc1C(=O)Nc1ccccc1 ZINC000184099151 1430840923 /nfs/dbraw/zinc/84/09/23/1430840923.db2.gz JJEJUMHTLZWERH-UHFFFAOYSA-N 0 0 391.387 3.385 20 5 GGBDRN CSc1ccc(C(=O)N2CCN([C@H](C)c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000184121254 1430843837 /nfs/dbraw/zinc/84/38/37/1430843837.db2.gz IZROXVIRTYHYSQ-GFCCVEGCSA-N 0 0 392.506 3.292 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc2c1CCN2C(=O)COC ZINC000184128254 1430844968 /nfs/dbraw/zinc/84/49/68/1430844968.db2.gz OBAUYESNRZBSTJ-UHFFFAOYSA-N 0 0 385.420 3.141 20 5 GGBDRN COC(=O)CNC(=O)c1ccc(NCc2c(C)oc3ccccc32)c([N+](=O)[O-])c1 ZINC000184130976 1430845601 /nfs/dbraw/zinc/84/56/01/1430845601.db2.gz DVGZQOOLUDWGDU-UHFFFAOYSA-N 0 0 397.387 3.164 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)Cc2cccc(OC(C)C)c2)ccc1[N+](=O)[O-] ZINC000184134101 1430845823 /nfs/dbraw/zinc/84/58/23/1430845823.db2.gz HUIRUGUTUCXVTJ-UHFFFAOYSA-N 0 0 399.447 3.079 20 5 GGBDRN COCC(=O)N1CCc2c1cccc2NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184134229 1430845824 /nfs/dbraw/zinc/84/58/24/1430845824.db2.gz XDKPXUXDSWIUJN-UHFFFAOYSA-N 0 0 375.812 3.396 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCCOc1ccc2ccccc2c1 ZINC000184141937 1430846563 /nfs/dbraw/zinc/84/65/63/1430846563.db2.gz SCPHQIMLWZBEKW-UHFFFAOYSA-N 0 0 386.429 3.246 20 5 GGBDRN CC(C)COC[C@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccco1 ZINC000184162178 1430849089 /nfs/dbraw/zinc/84/90/89/1430849089.db2.gz LNYUBDSJKACUIX-KRWDZBQOSA-N 0 0 387.436 3.080 20 5 GGBDRN Cc1oc2ccccc2c1CNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000184189691 1430853546 /nfs/dbraw/zinc/85/35/46/1430853546.db2.gz KCVZLNAGXKKXRW-UHFFFAOYSA-N 0 0 399.428 3.157 20 5 GGBDRN O=[N+]([O-])c1cc(C[NH2+][C@]2(CO)CCOC2)ccc1Oc1ccccc1Cl ZINC000184189813 1430853548 /nfs/dbraw/zinc/85/35/48/1430853548.db2.gz RVVDNAYQRUOAJX-SFHVURJKSA-N 0 0 378.812 3.282 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000184195293 1430854571 /nfs/dbraw/zinc/85/45/71/1430854571.db2.gz VNJQQHOVUGHXJW-ZDUSSCGKSA-N 0 0 375.425 3.038 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCc1ccc(F)cc1C(F)(F)F ZINC000184205591 1430856297 /nfs/dbraw/zinc/85/62/97/1430856297.db2.gz FHKUOTGBBYBZDQ-UHFFFAOYSA-N 0 0 392.330 3.372 20 5 GGBDRN COc1cc(CN2CCC[C@H](c3nnc4ccccn43)C2)c([N+](=O)[O-])cc1F ZINC000184219221 1430858051 /nfs/dbraw/zinc/85/80/51/1430858051.db2.gz YJINWMQMHHXRNS-ZDUSSCGKSA-N 0 0 385.399 3.165 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)c2ccc(F)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000184220876 1430858320 /nfs/dbraw/zinc/85/83/20/1430858320.db2.gz HLLPHGKGPYKVAR-UHFFFAOYSA-N 0 0 379.775 3.089 20 5 GGBDRN CCN(CC(=O)NCc1ccc(F)cc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184224842 1430858877 /nfs/dbraw/zinc/85/88/77/1430858877.db2.gz WCQGGXXVLJXGGO-UHFFFAOYSA-N 0 0 393.390 3.020 20 5 GGBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000184234005 1430860102 /nfs/dbraw/zinc/86/01/02/1430860102.db2.gz IUECMWAUVISSMH-QGZVFWFLSA-N 0 0 394.786 3.366 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000184237502 1430860599 /nfs/dbraw/zinc/86/05/99/1430860599.db2.gz GJCGHMHLNVKUPF-QGZVFWFLSA-N 0 0 396.852 3.152 20 5 GGBDRN CCN(CC(=O)Nc1cccc(OC)c1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184238743 1430860748 /nfs/dbraw/zinc/86/07/48/1430860748.db2.gz OGCNAYMJSUMQRH-UHFFFAOYSA-N 0 0 391.399 3.212 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000184238926 1430860802 /nfs/dbraw/zinc/86/08/02/1430860802.db2.gz JNOLXRNIDAWPNP-QGZVFWFLSA-N 0 0 396.852 3.319 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000184240222 1430861115 /nfs/dbraw/zinc/86/11/15/1430861115.db2.gz YBHJHJWPRIMPNC-INIZCTEOSA-N 0 0 396.852 3.319 20 5 GGBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000184241367 1430861132 /nfs/dbraw/zinc/86/11/32/1430861132.db2.gz NJVKXOJDFDBLNI-INIZCTEOSA-N 0 0 396.852 3.319 20 5 GGBDRN COc1cc(CN2CCN(C(=O)c3ccc(C)s3)CC2)c([N+](=O)[O-])cc1F ZINC000184250252 1430862299 /nfs/dbraw/zinc/86/22/99/1430862299.db2.gz HLZZHQNYFHOJBL-UHFFFAOYSA-N 0 0 393.440 3.070 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184251777 1430862462 /nfs/dbraw/zinc/86/24/62/1430862462.db2.gz GJXLMQSTMBOAFL-ZIAGYGMSSA-N 0 0 381.448 3.259 20 5 GGBDRN CC(C)COc1ccccc1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184252650 1430862741 /nfs/dbraw/zinc/86/27/41/1430862741.db2.gz LAWFGLARHHENCY-UHFFFAOYSA-N 0 0 378.450 3.249 20 5 GGBDRN Cc1cccc(C)c1OC[C@H](C)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184264188 1430864483 /nfs/dbraw/zinc/86/44/83/1430864483.db2.gz UYUNKJUXYDSEOZ-HNNXBMFYSA-N 0 0 378.450 3.099 20 5 GGBDRN COC(=O)[C@@H](C)[C@@H](NCc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000184265026 1430864779 /nfs/dbraw/zinc/86/47/79/1430864779.db2.gz RCDUOVOGFLQUHZ-KPZWWZAWSA-N 0 0 376.384 3.383 20 5 GGBDRN COc1cccc(O[C@H](C)CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000184307508 1430871488 /nfs/dbraw/zinc/87/14/88/1430871488.db2.gz OWDQDXACZHDHPI-OLZOCXBDSA-N 0 0 376.384 3.430 20 5 GGBDRN COc1cccc(CN(C[C@@H]2CCCO2)C(=O)c2cc([N+](=O)[O-])ccc2N)c1 ZINC000184323552 1430873160 /nfs/dbraw/zinc/87/31/60/1430873160.db2.gz DNFCQKCHYOUFBY-KRWDZBQOSA-N 0 0 385.420 3.007 20 5 GGBDRN COc1cccc(CN(C[C@H]2CCCO2)C(=O)c2cc([N+](=O)[O-])ccc2N)c1 ZINC000184323570 1430873197 /nfs/dbraw/zinc/87/31/97/1430873197.db2.gz DNFCQKCHYOUFBY-QGZVFWFLSA-N 0 0 385.420 3.007 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(OC(F)F)c2cccnc12 ZINC000184323245 1430873306 /nfs/dbraw/zinc/87/33/06/1430873306.db2.gz LSSVCKWFRBQBDX-UHFFFAOYSA-N 0 0 391.334 3.278 20 5 GGBDRN CC(C)OC(=O)C[C@H]1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000184330023 1430873902 /nfs/dbraw/zinc/87/39/02/1430873902.db2.gz CMIVEUXDYSKVIF-ZIAGYGMSSA-N 0 0 380.416 3.418 20 5 GGBDRN C[C@H](C(=O)N1CCn2c(nnc2-c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000184338751 1430874792 /nfs/dbraw/zinc/87/47/92/1430874792.db2.gz ORSXSBFOWLLXHB-ZDUSSCGKSA-N 0 0 395.394 3.138 20 5 GGBDRN COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000184342232 1430875273 /nfs/dbraw/zinc/87/52/73/1430875273.db2.gz YQXHSSZBPMIPMF-INIZCTEOSA-N 0 0 385.420 3.007 20 5 GGBDRN O=C(NCCc1ccc2c(c1)OCCO2)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184355107 1430877209 /nfs/dbraw/zinc/87/72/09/1430877209.db2.gz HVDDSVBKZAUKCJ-UHFFFAOYSA-N 0 0 391.811 3.061 20 5 GGBDRN O=C(NCCCn1cnc2ccccc21)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184357739 1430877784 /nfs/dbraw/zinc/87/77/84/1430877784.db2.gz VTEVNEVTFKHSQK-UHFFFAOYSA-N 0 0 387.827 3.487 20 5 GGBDRN COc1ccc(OCCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000184357862 1430877887 /nfs/dbraw/zinc/87/78/87/1430877887.db2.gz JEPJZEOFAPBWOE-UHFFFAOYSA-N 0 0 379.800 3.135 20 5 GGBDRN COC(=O)[C@H](C)Cc1ccc(NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000184365410 1430878608 /nfs/dbraw/zinc/87/86/08/1430878608.db2.gz SNNRUYXEPZZIDP-CQSZACIVSA-N 0 0 385.420 3.305 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184369419 1430879445 /nfs/dbraw/zinc/87/94/45/1430879445.db2.gz DQDHKNWBBKYHBT-GFCCVEGCSA-N 0 0 382.388 3.192 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)c(F)c1 ZINC000184371862 1430879876 /nfs/dbraw/zinc/87/98/76/1430879876.db2.gz KUDSNBOTAICDIY-JTQLQIEISA-N 0 0 386.351 3.190 20 5 GGBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000184374029 1430880021 /nfs/dbraw/zinc/88/00/21/1430880021.db2.gz VNSOHLFRPGMHDR-AWEZNQCLSA-N 0 0 396.415 3.235 20 5 GGBDRN COc1ccc(S(=O)(=O)N2CC[C@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000184374326 1430880120 /nfs/dbraw/zinc/88/01/20/1430880120.db2.gz ZUTVUYIDUIKKKW-NSHDSACASA-N 0 0 398.387 3.060 20 5 GGBDRN C[C@@H](c1ccsc1)N1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000184381506 1430881108 /nfs/dbraw/zinc/88/11/08/1430881108.db2.gz RMZIOLOLROEGKD-HNNXBMFYSA-N 0 0 389.477 3.331 20 5 GGBDRN C[C@H](c1ccsc1)N1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000184381527 1430881114 /nfs/dbraw/zinc/88/11/14/1430881114.db2.gz RMZIOLOLROEGKD-OAHLLOKOSA-N 0 0 389.477 3.331 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)[C@@H]1CCCN(CC(F)(F)F)C1 ZINC000184392284 1430882374 /nfs/dbraw/zinc/88/23/74/1430882374.db2.gz GGRFGZDIIWHXCV-LLVKDONJSA-N 0 0 382.342 3.356 20 5 GGBDRN CC[C@H](N[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000184394986 1430882721 /nfs/dbraw/zinc/88/27/21/1430882721.db2.gz NSNHNDNMAGBLBV-YPMHNXCESA-N 0 0 378.454 3.436 20 5 GGBDRN COc1cc(C(=O)Nc2c([N+](=O)[O-])cnn2C)cc(Cl)c1OCC(C)C ZINC000184402520 1430883704 /nfs/dbraw/zinc/88/37/04/1430883704.db2.gz BHKYYSASRGKSAG-UHFFFAOYSA-N 0 0 382.804 3.277 20 5 GGBDRN CC(C)Oc1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000184404342 1430883958 /nfs/dbraw/zinc/88/39/58/1430883958.db2.gz YPTZCLJTSHHORY-UHFFFAOYSA-N 0 0 378.816 3.430 20 5 GGBDRN Cc1ccc(C(=O)Nc2c([N+](=O)[O-])cnn2C)cc1NC(=O)c1ccccc1 ZINC000184405166 1430884069 /nfs/dbraw/zinc/88/40/69/1430884069.db2.gz ANLPZKWTMDMRIK-UHFFFAOYSA-N 0 0 379.376 3.141 20 5 GGBDRN CCOc1ccc(NC(=O)CN[C@@H](CC)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000184418717 1430885711 /nfs/dbraw/zinc/88/57/11/1430885711.db2.gz FCVYSVPTKBWAKB-ZDUSSCGKSA-N 0 0 378.454 3.438 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000184442852 1430888287 /nfs/dbraw/zinc/88/82/87/1430888287.db2.gz CIECFHXJLRFGIG-AWEZNQCLSA-N 0 0 389.452 3.363 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000184458295 1430890298 /nfs/dbraw/zinc/89/02/98/1430890298.db2.gz NQSJARMBGMKITG-UHFFFAOYSA-N 0 0 383.383 3.212 20 5 GGBDRN CC(C)OC(=O)C[C@@H]1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000184467453 1430890876 /nfs/dbraw/zinc/89/08/76/1430890876.db2.gz MVDQQVRSIUZZDZ-AWEZNQCLSA-N 0 0 388.424 3.199 20 5 GGBDRN O=C(NCCN1CCc2sccc2C1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184481498 1430892825 /nfs/dbraw/zinc/89/28/25/1430892825.db2.gz LUOLZQVTCXJPKA-UHFFFAOYSA-N 0 0 394.884 3.167 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 ZINC000184487849 1430893442 /nfs/dbraw/zinc/89/34/42/1430893442.db2.gz NUOAZGLPMBHBSM-KRWDZBQOSA-N 0 0 396.447 3.382 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(Cc1ccc(F)cc1)CC1CC1 ZINC000184497269 1430894877 /nfs/dbraw/zinc/89/48/77/1430894877.db2.gz GFDLFCQNUZNHGY-UHFFFAOYSA-N 0 0 378.425 3.476 20 5 GGBDRN CN([C@H]1CCCN(c2ccccc2)C1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184495672 1430894927 /nfs/dbraw/zinc/89/49/27/1430894927.db2.gz IXTFGXWQWUYMOM-SFHVURJKSA-N 0 0 389.477 3.025 20 5 GGBDRN Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000184508656 1430896423 /nfs/dbraw/zinc/89/64/23/1430896423.db2.gz YJKLYDUJAHHFOC-AWEZNQCLSA-N 0 0 384.436 3.094 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NCc1ccccc1-n1cccn1 ZINC000184510098 1430896739 /nfs/dbraw/zinc/89/67/39/1430896739.db2.gz PWZBLUUPCSTUTA-UHFFFAOYSA-N 0 0 385.811 3.433 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000184530371 1430899151 /nfs/dbraw/zinc/89/91/51/1430899151.db2.gz YKXILVJVIOESPF-YVEFUNNKSA-N 0 0 382.420 3.155 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCSC[C@H]1c1nccs1 ZINC000184544055 1430901756 /nfs/dbraw/zinc/90/17/56/1430901756.db2.gz DOFXINNMYMHQPM-HNNXBMFYSA-N 0 0 388.474 3.392 20 5 GGBDRN CN1CCCN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])c2cc(Cl)ccc21 ZINC000184580598 1430909003 /nfs/dbraw/zinc/90/90/03/1430909003.db2.gz IELBORHMAVUZCT-UHFFFAOYSA-N 0 0 395.868 3.425 20 5 GGBDRN CSCC[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000184602841 1430915985 /nfs/dbraw/zinc/91/59/85/1430915985.db2.gz DGHOMDXFMRUOAZ-CQSZACIVSA-N 0 0 375.429 3.361 20 5 GGBDRN O=C(NCc1nc[nH]n1)c1cccc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000184605322 1430916871 /nfs/dbraw/zinc/91/68/71/1430916871.db2.gz SOMMFIKBXYQRLX-UHFFFAOYSA-N 0 0 389.824 3.448 20 5 GGBDRN C[C@@H](C(=O)N1CCC(OC[C@H]2CCCCO2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184610031 1430918659 /nfs/dbraw/zinc/91/86/59/1430918659.db2.gz BLPDZPAZJHDPGC-RHSMWYFYSA-N 0 0 394.443 3.414 20 5 GGBDRN C[C@H](c1nccs1)N1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000184612377 1430919477 /nfs/dbraw/zinc/91/94/77/1430919477.db2.gz FFWGDHBHYPLGPE-OAHLLOKOSA-N 0 0 376.482 3.199 20 5 GGBDRN COc1cc(CN2CCN([C@H](C)c3nccs3)CC2)c([N+](=O)[O-])cc1F ZINC000184612990 1430919684 /nfs/dbraw/zinc/91/96/84/1430919684.db2.gz DBXBHUXUHRHUAM-GFCCVEGCSA-N 0 0 380.445 3.078 20 5 GGBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1 ZINC000184625008 1430922725 /nfs/dbraw/zinc/92/27/25/1430922725.db2.gz NCIUQBHNPJNRJS-NDEPHWFRSA-N 0 0 396.428 3.132 20 5 GGBDRN Cc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1-c1nnnn1C1CC1 ZINC000184628247 1430923693 /nfs/dbraw/zinc/92/36/93/1430923693.db2.gz OCRWOACBKYJABG-UHFFFAOYSA-N 0 0 392.419 3.381 20 5 GGBDRN CC(C)n1nnnc1-c1ccccc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000184633035 1430924849 /nfs/dbraw/zinc/92/48/49/1430924849.db2.gz NSJBGMIHFWOSPB-UHFFFAOYSA-N 0 0 381.396 3.151 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccc(O)cc2)CC1 ZINC000184641270 1430927493 /nfs/dbraw/zinc/92/74/93/1430927493.db2.gz GZSYUGWLUGSKEW-QGZVFWFLSA-N 0 0 383.448 3.218 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000184644836 1430928334 /nfs/dbraw/zinc/92/83/34/1430928334.db2.gz KGZKURRQQFMIDY-HOCLYGCPSA-N 0 0 396.490 3.074 20 5 GGBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184645187 1430928902 /nfs/dbraw/zinc/92/89/02/1430928902.db2.gz WPJBNBXSVQQNSY-SGTLLEGYSA-N 0 0 378.425 3.477 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCC(OCC2CCCC2)CC1 ZINC000184651675 1430930736 /nfs/dbraw/zinc/93/07/36/1430930736.db2.gz ZWPIKDQTJPOVQK-UHFFFAOYSA-N 0 0 382.482 3.096 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2cccc(O)c2)CC1 ZINC000184657600 1430932277 /nfs/dbraw/zinc/93/22/77/1430932277.db2.gz SCNOCJGFFAAJBF-QGZVFWFLSA-N 0 0 383.448 3.218 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C(=O)c2ccco2)CC1 ZINC000184660942 1430932994 /nfs/dbraw/zinc/93/29/94/1430932994.db2.gz NVGVLKGVNSFPPL-INIZCTEOSA-N 0 0 399.447 3.178 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C(=O)c2ccco2)CC1 ZINC000184660961 1430933331 /nfs/dbraw/zinc/93/33/31/1430933331.db2.gz NVGVLKGVNSFPPL-MRXNPFEDSA-N 0 0 399.447 3.178 20 5 GGBDRN Cc1ccc(CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])c(OCC2CC2)c1 ZINC000184663510 1430934722 /nfs/dbraw/zinc/93/47/22/1430934722.db2.gz BCHBPRGIOCTTHY-UHFFFAOYSA-N 0 0 390.461 3.312 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1NS(C)(=O)=O ZINC000184665971 1430935998 /nfs/dbraw/zinc/93/59/98/1430935998.db2.gz KKKZCLWXNBSLBI-AWEZNQCLSA-N 0 0 391.449 3.174 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccnc(-n2cccn2)c1 ZINC000184680734 1430940722 /nfs/dbraw/zinc/94/07/22/1430940722.db2.gz NDOHGHGREXEBAY-KRWDZBQOSA-N 0 0 379.420 3.061 20 5 GGBDRN CCCCNC(=O)C1CCN(C(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000184683321 1430942096 /nfs/dbraw/zinc/94/20/96/1430942096.db2.gz UGBGYHRHJSBIFV-KRWDZBQOSA-N 0 0 389.496 3.318 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000184692626 1430944359 /nfs/dbraw/zinc/94/43/59/1430944359.db2.gz LQYBRFYRINHJJQ-QGZVFWFLSA-N 0 0 375.450 3.001 20 5 GGBDRN CCc1nc([C@H](C)NCCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cs1 ZINC000184698781 1430945427 /nfs/dbraw/zinc/94/54/27/1430945427.db2.gz AILLBVAPKAPDHZ-NSHDSACASA-N 0 0 378.454 3.302 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCc2sccc2C1 ZINC000184705165 1430947570 /nfs/dbraw/zinc/94/75/70/1430947570.db2.gz FJBSQCVUEMKPRN-MRXNPFEDSA-N 0 0 387.505 3.400 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCN(CC(F)(F)F)CC1 ZINC000184709654 1430948438 /nfs/dbraw/zinc/94/84/38/1430948438.db2.gz YJJHCCTWQLLCKT-OAHLLOKOSA-N 0 0 387.402 3.260 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCCc3cc(N)ccc32)cc1C ZINC000184710821 1430948798 /nfs/dbraw/zinc/94/87/98/1430948798.db2.gz AEXOXSYGOFFZJP-MRXNPFEDSA-N 0 0 375.450 3.150 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H]2CCCc3cc(N)ccc32)c1C ZINC000184713356 1430949940 /nfs/dbraw/zinc/94/99/40/1430949940.db2.gz VPPDIWSATRBPDG-KRWDZBQOSA-N 0 0 375.450 3.150 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCC(=O)N1CCCCCC1 ZINC000184718579 1430952103 /nfs/dbraw/zinc/95/21/03/1430952103.db2.gz QUIWRWOWAHBDJL-QGZVFWFLSA-N 0 0 375.469 3.072 20 5 GGBDRN O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1[O-] ZINC000184718941 1430952429 /nfs/dbraw/zinc/95/24/29/1430952429.db2.gz VSWGXPNZOWGBNQ-ZDUSSCGKSA-N 0 0 375.450 3.004 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184723010 1430953831 /nfs/dbraw/zinc/95/38/31/1430953831.db2.gz CZEQUNSFRNMZAN-ZWKOTPCHSA-N 0 0 389.496 3.318 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(C(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184722993 1430953844 /nfs/dbraw/zinc/95/38/44/1430953844.db2.gz CZEQUNSFRNMZAN-MSOLQXFVSA-N 0 0 389.496 3.318 20 5 GGBDRN C[C@H](C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1)c1ccc([N+](=O)[O-])cc1F ZINC000184735877 1430958887 /nfs/dbraw/zinc/95/88/87/1430958887.db2.gz XKVQAOGIQMPMES-JTQLQIEISA-N 0 0 377.347 3.317 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000184737778 1430959577 /nfs/dbraw/zinc/95/95/77/1430959577.db2.gz COXPEAFGMSKXNW-YJBOKZPZSA-N 0 0 390.461 3.182 20 5 GGBDRN Cc1cccc2c1N(C1CC1)CCN2C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000184740282 1430960654 /nfs/dbraw/zinc/96/06/54/1430960654.db2.gz GCQCIZLJTCTWCD-UHFFFAOYSA-N 0 0 377.404 3.409 20 5 GGBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000184753723 1430966697 /nfs/dbraw/zinc/96/66/97/1430966697.db2.gz FFLHJZKARLJKAA-VXGBXAGGSA-N 0 0 379.338 3.344 20 5 GGBDRN CCOc1ccc(Cl)cc1CCNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184753484 1430966773 /nfs/dbraw/zinc/96/67/73/1430966773.db2.gz BRVVXCCRJIFKOQ-UHFFFAOYSA-N 0 0 398.868 3.309 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC[C@H](Oc2cccc(Cl)c2)C1 ZINC000184761156 1430969835 /nfs/dbraw/zinc/96/98/35/1430969835.db2.gz LVXQXZVOEMXFDT-INIZCTEOSA-N 0 0 396.852 3.231 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2F)c2ncccc12 ZINC000184768085 1430971617 /nfs/dbraw/zinc/97/16/17/1430971617.db2.gz YWXVIRIARAYJDG-UHFFFAOYSA-N 0 0 383.307 3.361 20 5 GGBDRN CC(=O)CCc1ccc(OC[C@@H](O)COc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000184777216 1430974988 /nfs/dbraw/zinc/97/49/88/1430974988.db2.gz SCBGLZYKDCYEMS-OAHLLOKOSA-N 0 0 377.368 3.074 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C ZINC000184788438 1430977530 /nfs/dbraw/zinc/97/75/30/1430977530.db2.gz ABTRWJOPXXGYFQ-YQQAZPJKSA-N 0 0 375.469 3.069 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCc1nnc2n1CCCCC2 ZINC000184788611 1430977781 /nfs/dbraw/zinc/97/77/81/1430977781.db2.gz JNAFNLBSBPXNDD-QGZVFWFLSA-N 0 0 399.495 3.230 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN([C@@H](C)c2cccnc2)CC1 ZINC000184792319 1430978659 /nfs/dbraw/zinc/97/86/59/1430978659.db2.gz CYJRTTFJMWXPII-PKOBYXMFSA-N 0 0 396.491 3.464 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](OCc2ccncc2)C1 ZINC000184792838 1430979674 /nfs/dbraw/zinc/97/96/74/1430979674.db2.gz JMCSYEQWBDWKHA-UYAOXDASSA-N 0 0 383.448 3.376 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](OCc2ccncc2)C1 ZINC000184792803 1430979790 /nfs/dbraw/zinc/97/97/90/1430979790.db2.gz JMCSYEQWBDWKHA-QUCCMNQESA-N 0 0 383.448 3.376 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000184803565 1430983349 /nfs/dbraw/zinc/98/33/49/1430983349.db2.gz XJJLHZVLYVTYTK-LBPRGKRZSA-N 0 0 381.388 3.122 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCc3ccc(F)cc32)c2ncccc12 ZINC000184807798 1430984302 /nfs/dbraw/zinc/98/43/02/1430984302.db2.gz PRUVOHNWTMSLDL-UHFFFAOYSA-N 0 0 387.392 3.424 20 5 GGBDRN CC(C)(C)c1ncc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)cn1 ZINC000184824275 1430991744 /nfs/dbraw/zinc/99/17/44/1430991744.db2.gz AWBAPQGEYZTPFX-UHFFFAOYSA-N 0 0 387.421 3.031 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C[S@](C)=O)c1ccccc1 ZINC000184826262 1430992625 /nfs/dbraw/zinc/99/26/25/1430992625.db2.gz KPXKEOUZMGRBOL-GHJQATOXSA-N 0 0 388.489 3.400 20 5 GGBDRN CCc1ccc(OCCCS(=O)(=O)c2ccccc2OC)c([N+](=O)[O-])c1 ZINC000184827121 1430993061 /nfs/dbraw/zinc/99/30/61/1430993061.db2.gz IFQAPYVRDWUUSA-UHFFFAOYSA-N 0 0 379.434 3.409 20 5 GGBDRN O=C(C[C@H]1CCCN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000184830259 1430994828 /nfs/dbraw/zinc/99/48/28/1430994828.db2.gz GENATHAEDAGSIB-QGZVFWFLSA-N 0 0 388.445 3.162 20 5 GGBDRN CCCOc1cccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000184830752 1430995010 /nfs/dbraw/zinc/99/50/10/1430995010.db2.gz RHRPNZULSKMYJL-UHFFFAOYSA-N 0 0 391.811 3.292 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c2cccnc12 ZINC000184829861 1430995260 /nfs/dbraw/zinc/99/52/60/1430995260.db2.gz PXOBKLVBADGXEU-UHFFFAOYSA-N 0 0 398.806 3.360 20 5 GGBDRN CCc1ccc([C@@H](COC)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)o1 ZINC000184832594 1430995825 /nfs/dbraw/zinc/99/58/25/1430995825.db2.gz PLGSFTPJYBDESX-XJKSGUPXSA-N 0 0 375.425 3.363 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCc2c1cccc2Cl ZINC000184832217 1430996039 /nfs/dbraw/zinc/99/60/39/1430996039.db2.gz XWSSASKETWYVAZ-UHFFFAOYSA-N 0 0 394.214 3.107 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cnc2ccccc2c1 ZINC000184833048 1430996535 /nfs/dbraw/zinc/99/65/35/1430996535.db2.gz ZXTYXMPVHNNWKY-UHFFFAOYSA-N 0 0 384.779 3.051 20 5 GGBDRN Cc1c(NC(=O)N2CCN([C@H](C)c3nccs3)CC2)cccc1[N+](=O)[O-] ZINC000184834175 1430996996 /nfs/dbraw/zinc/99/69/96/1430996996.db2.gz LGBCAEODBDJXFS-CYBMUJFWSA-N 0 0 375.454 3.270 20 5 GGBDRN CC(C)Oc1ccccc1NC(=O)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184833024 1430997114 /nfs/dbraw/zinc/99/71/14/1430997114.db2.gz GYRMYKIXWHNCMZ-UHFFFAOYSA-N 0 0 391.811 3.290 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(Cc2cccc(O)c2)CC1 ZINC000184841438 1431000095 /nfs/dbraw/zinc/00/00/95/1431000095.db2.gz KQVMAQOCAOQWFH-IBGZPJMESA-N 0 0 397.475 3.214 20 5 GGBDRN Cc1ccc2c(c1)nc(CNC(=O)c1ccc([N+](=O)[O-])c3cccnc13)n2C ZINC000184853887 1431004057 /nfs/dbraw/zinc/00/40/57/1431004057.db2.gz VPGCXANFVWGEPB-UHFFFAOYSA-N 0 0 375.388 3.268 20 5 GGBDRN Cc1ccc2c(c1)N(S(=O)(=O)c1ccc([N+](=O)[O-])c3cccnc31)C[C@@H](C)O2 ZINC000184863719 1431006321 /nfs/dbraw/zinc/00/63/21/1431006321.db2.gz BICKIJAJNNIVRX-CYBMUJFWSA-N 0 0 399.428 3.428 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1C(=O)OC(C)(C)C ZINC000184869313 1431008244 /nfs/dbraw/zinc/00/82/44/1431008244.db2.gz AGIFQOVTLFAUAL-RDJZCZTQSA-N 0 0 376.453 3.496 20 5 GGBDRN C[C@@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ncc(-c2ccccc2)o1 ZINC000184874302 1431009281 /nfs/dbraw/zinc/00/92/81/1431009281.db2.gz IYUMSHRFWVWWDP-CQSZACIVSA-N 0 0 392.415 3.490 20 5 GGBDRN C[C@H](C(=O)Nc1cccn(CC(F)(F)F)c1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184877179 1431010005 /nfs/dbraw/zinc/01/00/05/1431010005.db2.gz CHJIMKFLAIOVEZ-VIFPVBQESA-N 0 0 387.289 3.200 20 5 GGBDRN C[C@@H](C(=O)Nc1cccn(CC(F)(F)F)c1=O)c1ccc([N+](=O)[O-])cc1F ZINC000184877197 1431010012 /nfs/dbraw/zinc/01/00/12/1431010012.db2.gz CHJIMKFLAIOVEZ-SECBINFHSA-N 0 0 387.289 3.200 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1CC(=O)c1cnn(C)c1 ZINC000184887028 1431013132 /nfs/dbraw/zinc/01/31/32/1431013132.db2.gz QSPOHFWWEKVUHA-LPHOPBHVSA-N 0 0 398.463 3.161 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCCC2=O)cn1 ZINC000184887716 1431013219 /nfs/dbraw/zinc/01/32/19/1431013219.db2.gz LLIZCGCDCDNFLL-HNNXBMFYSA-N 0 0 382.420 3.324 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000184894486 1431015231 /nfs/dbraw/zinc/01/52/31/1431015231.db2.gz AOQZTMQLAKLEEJ-HLIPFELVSA-N 0 0 399.491 3.165 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N(C)C[C@H](C)c2nccs2)cc([N+](=O)[O-])c1 ZINC000184901515 1431016988 /nfs/dbraw/zinc/01/69/88/1431016988.db2.gz FQMMQUCUFWNASG-NSHDSACASA-N 0 0 377.422 3.104 20 5 GGBDRN CCOc1cc(C(=O)N(C)C[C@@H](C)c2nccs2)c([N+](=O)[O-])cc1OC ZINC000184906444 1431018041 /nfs/dbraw/zinc/01/80/41/1431018041.db2.gz YXPJAOFBLWTTSS-LLVKDONJSA-N 0 0 379.438 3.334 20 5 GGBDRN C[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000184906098 1431018327 /nfs/dbraw/zinc/01/83/27/1431018327.db2.gz ICMVQUWMQBVPNG-ZBFHGGJFSA-N 0 0 383.404 3.340 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CCO)c1ccc(OC)cc1 ZINC000184912016 1431019314 /nfs/dbraw/zinc/01/93/14/1431019314.db2.gz LWACILCDMDIMBD-OXQOHEQNSA-N 0 0 386.448 3.412 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CCO)c1ccc(OC)cc1 ZINC000184911998 1431019334 /nfs/dbraw/zinc/01/93/34/1431019334.db2.gz LWACILCDMDIMBD-OXJNMPFZSA-N 0 0 386.448 3.412 20 5 GGBDRN COC(=O)c1cc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc([N+](=O)[O-])c1 ZINC000184912874 1431019481 /nfs/dbraw/zinc/01/94/81/1431019481.db2.gz ZDCREQWKKYVURR-LLVKDONJSA-N 0 0 390.342 3.289 20 5 GGBDRN CCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000184916999 1431020576 /nfs/dbraw/zinc/02/05/76/1431020576.db2.gz DGEMHBUHHUIHSP-UHFFFAOYSA-N 0 0 379.482 3.133 20 5 GGBDRN COc1cc2c(=O)ncn(Cc3cc([N+](=O)[O-])ccc3OC(C)C)c2cc1F ZINC000184916714 1431020861 /nfs/dbraw/zinc/02/08/61/1431020861.db2.gz HBEDUCLBYLECHL-UHFFFAOYSA-N 0 0 387.367 3.288 20 5 GGBDRN O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184920792 1431021417 /nfs/dbraw/zinc/02/14/17/1431021417.db2.gz FTFKJUJSWYHJOF-GFCCVEGCSA-N 0 0 399.357 3.083 20 5 GGBDRN C[C@@H](C(=O)NCCc1nccn1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000184921195 1431021977 /nfs/dbraw/zinc/02/19/77/1431021977.db2.gz RXAGFSNKIXTTFC-OAHLLOKOSA-N 0 0 396.422 3.441 20 5 GGBDRN COC(=O)c1cc(CN(C)C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)oc1C ZINC000184933116 1431025071 /nfs/dbraw/zinc/02/50/71/1431025071.db2.gz OCMLVGLMQAWMKV-JTQLQIEISA-N 0 0 378.356 3.184 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CN1CCNC1=O ZINC000184936335 1431025833 /nfs/dbraw/zinc/02/58/33/1431025833.db2.gz VIIVDJFCNIONAG-MRXNPFEDSA-N 0 0 396.447 3.327 20 5 GGBDRN CN(CC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)c1ccccc1[N+](=O)[O-] ZINC000184942676 1431027248 /nfs/dbraw/zinc/02/72/48/1431027248.db2.gz SSYPXSILDKOOJX-CYBMUJFWSA-N 0 0 375.375 3.325 20 5 GGBDRN C[C@H](C(=O)N1CCCN(C(=O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184948351 1431028271 /nfs/dbraw/zinc/02/82/71/1431028271.db2.gz DKCIVJWBCPVXRN-HNNXBMFYSA-N 0 0 399.422 3.212 20 5 GGBDRN Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000184956232 1431029881 /nfs/dbraw/zinc/02/98/81/1431029881.db2.gz RVAKFJBMMCAOSJ-NSHDSACASA-N 0 0 390.392 3.311 20 5 GGBDRN C[C@H]1Cc2cc(S(=O)(=O)Nc3ccc([N+](=O)[O-])c4ncccc34)ccc2O1 ZINC000184965425 1431032558 /nfs/dbraw/zinc/03/25/58/1431032558.db2.gz NDIHXMOVULZBMF-NSHDSACASA-N 0 0 385.401 3.267 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000184967868 1431033068 /nfs/dbraw/zinc/03/30/68/1431033068.db2.gz VXEGDSOGGXSFIN-CYBMUJFWSA-N 0 0 386.429 3.481 20 5 GGBDRN C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(Cc2c(F)cccc2[N+](=O)[O-])C1=O ZINC000184998227 1431038805 /nfs/dbraw/zinc/03/88/05/1431038805.db2.gz MCTQPRNAIFMDJW-QGZVFWFLSA-N 0 0 395.749 3.494 20 5 GGBDRN C[C@@H](C(=O)NCc1cnn(Cc2ccccc2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000185008521 1431041149 /nfs/dbraw/zinc/04/11/49/1431041149.db2.gz OXDISKSZMFLKIF-CQSZACIVSA-N 0 0 382.395 3.399 20 5 GGBDRN Cn1c(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)nnc1-c1ccc(Cl)cc1 ZINC000185012608 1431041960 /nfs/dbraw/zinc/04/19/60/1431041960.db2.gz RMOHCXGWERGSHJ-UHFFFAOYSA-N 0 0 395.810 3.351 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000185016311 1431042615 /nfs/dbraw/zinc/04/26/15/1431042615.db2.gz KOCIFPRGKRUSTN-QGZVFWFLSA-N 0 0 384.432 3.294 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000185033472 1431045594 /nfs/dbraw/zinc/04/55/94/1431045594.db2.gz IUBOBKBRCQJNGJ-NSHDSACASA-N 0 0 395.412 3.238 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@@H]1C(=O)Nc2ccccc21 ZINC000185044305 1431048351 /nfs/dbraw/zinc/04/83/51/1431048351.db2.gz GBBRABCXPOXSMI-YJBOKZPZSA-N 0 0 381.432 3.406 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OC ZINC000185046368 1431048517 /nfs/dbraw/zinc/04/85/17/1431048517.db2.gz ZNBKXHFTJPFGQI-OXJNMPFZSA-N 0 0 396.443 3.290 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OC ZINC000185046389 1431048717 /nfs/dbraw/zinc/04/87/17/1431048717.db2.gz ZNBKXHFTJPFGQI-OXQOHEQNSA-N 0 0 396.443 3.290 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc(C)c(C(=O)OC)s1 ZINC000185048479 1431048958 /nfs/dbraw/zinc/04/89/58/1431048958.db2.gz JCDGRURGJCOSQW-LBPRGKRZSA-N 0 0 377.422 3.354 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SCC(N)=O ZINC000185049808 1431049428 /nfs/dbraw/zinc/04/94/28/1431049428.db2.gz IYGCLBJYFPAMLA-AWEZNQCLSA-N 0 0 387.461 3.380 20 5 GGBDRN C[C@@H](C(=O)NCCNC(=O)c1ccccc1Cl)c1ccc([N+](=O)[O-])cc1F ZINC000185055028 1431050719 /nfs/dbraw/zinc/05/07/19/1431050719.db2.gz WQEXTARHGWHDTI-LLVKDONJSA-N 0 0 393.802 3.037 20 5 GGBDRN C[C@H](C(=O)NCc1cccc(Cn2cccn2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000185060741 1431051710 /nfs/dbraw/zinc/05/17/10/1431051710.db2.gz RERPVRLWYFYOSN-AWEZNQCLSA-N 0 0 382.395 3.399 20 5 GGBDRN COC(=O)c1cccc2[nH]c(NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)nc21 ZINC000185065018 1431052483 /nfs/dbraw/zinc/05/24/83/1431052483.db2.gz YCHYFZQQZNKQGO-SECBINFHSA-N 0 0 386.339 3.139 20 5 GGBDRN C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000185076947 1431054897 /nfs/dbraw/zinc/05/48/97/1431054897.db2.gz AGWHBYFNXMADSK-NSHDSACASA-N 0 0 385.355 3.073 20 5 GGBDRN C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000185076965 1431055313 /nfs/dbraw/zinc/05/53/13/1431055313.db2.gz AGWHBYFNXMADSK-LLVKDONJSA-N 0 0 385.355 3.073 20 5 GGBDRN C[C@@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1 ZINC000185077105 1431055338 /nfs/dbraw/zinc/05/53/38/1431055338.db2.gz UOHFGGHSFHMEIU-GFCCVEGCSA-N 0 0 399.382 3.463 20 5 GGBDRN CC(=O)Nc1cccnc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000185089042 1431057616 /nfs/dbraw/zinc/05/76/16/1431057616.db2.gz WURKXSOJBPWHRO-UHFFFAOYSA-N 0 0 397.435 3.437 20 5 GGBDRN COc1ccc([C@H](CNc2cccc(OC)c2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000185097296 1431059890 /nfs/dbraw/zinc/05/98/90/1431059890.db2.gz ZRDGXSSYSLQMHF-SFHVURJKSA-N 0 0 387.436 3.097 20 5 GGBDRN COc1ccc([C@@H](CNc2cccc(OC)c2[N+](=O)[O-])N2CCOCC2)cc1 ZINC000185097279 1431060081 /nfs/dbraw/zinc/06/00/81/1431060081.db2.gz ZRDGXSSYSLQMHF-GOSISDBHSA-N 0 0 387.436 3.097 20 5 GGBDRN COC(=O)[C@H](C)Cc1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000185097570 1431060420 /nfs/dbraw/zinc/06/04/20/1431060420.db2.gz GDKIOJIIQUGVQV-LLVKDONJSA-N 0 0 382.376 3.075 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(C(=O)N(C)C)cc1 ZINC000185108632 1431062639 /nfs/dbraw/zinc/06/26/39/1431062639.db2.gz GYHMGTBCYODSGU-KRWDZBQOSA-N 0 0 383.448 3.182 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccnc(N2CCCC2)c1 ZINC000185121434 1431065448 /nfs/dbraw/zinc/06/54/48/1431065448.db2.gz GHUNTCIXCXENET-GOSISDBHSA-N 0 0 382.464 3.475 20 5 GGBDRN Cc1ccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1NS(C)(=O)=O ZINC000185121494 1431065672 /nfs/dbraw/zinc/06/56/72/1431065672.db2.gz ICIVRLZXRWERQQ-NSHDSACASA-N 0 0 395.412 3.156 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC(C)(C)c1nc2ccccc2n1C ZINC000185129631 1431068028 /nfs/dbraw/zinc/06/80/28/1431068028.db2.gz KZZAKCGZRXHVBV-UHFFFAOYSA-N 0 0 388.449 3.004 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000185157399 1431073851 /nfs/dbraw/zinc/07/38/51/1431073851.db2.gz ZUYXVVFRBIBAAA-SOUVJXGZSA-N 0 0 393.459 3.381 20 5 GGBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000185161267 1431074531 /nfs/dbraw/zinc/07/45/31/1431074531.db2.gz FRXFPBMQTSNNIZ-SOUVJXGZSA-N 0 0 393.459 3.381 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)N[C@H](c1nccs1)c1ccccc1 ZINC000185172140 1431077002 /nfs/dbraw/zinc/07/70/02/1431077002.db2.gz ZTRSLEFAFOOPIN-KRWDZBQOSA-N 0 0 383.433 3.031 20 5 GGBDRN C[C@H](C(=O)N1CCCN(Cc2cscn2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185175633 1431077489 /nfs/dbraw/zinc/07/74/89/1431077489.db2.gz MSVMZRMUSJDUTK-ZDUSSCGKSA-N 0 0 392.456 3.028 20 5 GGBDRN C[C@@H](C(=O)N1CCCN(Cc2cscn2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185175652 1431077743 /nfs/dbraw/zinc/07/77/43/1431077743.db2.gz MSVMZRMUSJDUTK-CYBMUJFWSA-N 0 0 392.456 3.028 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@H](C)c1nc(C(C)(C)C)no1 ZINC000185185311 1431079433 /nfs/dbraw/zinc/07/94/33/1431079433.db2.gz SCQITXVGJMQZKF-GFCCVEGCSA-N 0 0 375.429 3.263 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N[C@H](C)c2nc(C(C)(C)C)no2)cccc1[N+](=O)[O-] ZINC000185185376 1431079506 /nfs/dbraw/zinc/07/95/06/1431079506.db2.gz NGMYRHSRRJSHSQ-VXGBXAGGSA-N 0 0 375.429 3.262 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N[C@@H](C)c2nc(C(C)(C)C)no2)cccc1[N+](=O)[O-] ZINC000185185336 1431079673 /nfs/dbraw/zinc/07/96/73/1431079673.db2.gz NGMYRHSRRJSHSQ-NEPJUHHUSA-N 0 0 375.429 3.262 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1C(=O)NCc1ccco1 ZINC000185194905 1431082277 /nfs/dbraw/zinc/08/22/77/1431082277.db2.gz WZNLJHRWROMGDY-APWZRJJASA-N 0 0 399.447 3.064 20 5 GGBDRN Cc1cc(C)cc([C@H]2CCN(C(=O)[C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000185203726 1431084081 /nfs/dbraw/zinc/08/40/81/1431084081.db2.gz CNMGSZMDIUWTOE-WMZOPIPTSA-N 0 0 395.459 3.346 20 5 GGBDRN C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1nc(C2CCCCC2)no1 ZINC000185215004 1431086743 /nfs/dbraw/zinc/08/67/43/1431086743.db2.gz VYIIHIUQZBZFPM-BBRMVZONSA-N 0 0 390.440 3.116 20 5 GGBDRN Cc1cn(-c2ccccc2)nc1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000185215210 1431087123 /nfs/dbraw/zinc/08/71/23/1431087123.db2.gz MKLOTKFAWYUFHE-UHFFFAOYSA-N 0 0 391.431 3.051 20 5 GGBDRN CCOC(=O)c1nc(CC)oc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185217532 1431087473 /nfs/dbraw/zinc/08/74/73/1431087473.db2.gz WKGBPBUTTVRHKD-VIFPVBQESA-N 0 0 379.344 3.203 20 5 GGBDRN C[C@@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nc(C2CCCCC2)no1 ZINC000185229250 1431089935 /nfs/dbraw/zinc/08/99/35/1431089935.db2.gz MPEBLTUXCOHKHJ-CYBMUJFWSA-N 0 0 399.451 3.265 20 5 GGBDRN C[C@H](C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccc([N+](=O)[O-])cc1F ZINC000185233317 1431090520 /nfs/dbraw/zinc/09/05/20/1431090520.db2.gz RLXQGPKFGDWLJE-IFXJQAMLSA-N 0 0 399.422 3.145 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(=O)NC)ccc1OC ZINC000185237133 1431091317 /nfs/dbraw/zinc/09/13/17/1431091317.db2.gz BHMSROJVIXULOJ-AWEZNQCLSA-N 0 0 385.420 3.170 20 5 GGBDRN COc1cccc(NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)c1[N+](=O)[O-] ZINC000185243579 1431092521 /nfs/dbraw/zinc/09/25/21/1431092521.db2.gz XUWOVENEEIPCJJ-INIZCTEOSA-N 0 0 385.420 3.124 20 5 GGBDRN COc1cccc(NCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000185243534 1431092645 /nfs/dbraw/zinc/09/26/45/1431092645.db2.gz JQXMANLOUMDZBW-HUUCEWRRSA-N 0 0 399.447 3.465 20 5 GGBDRN C[C@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nc(C2CCCCC2)no1 ZINC000185245438 1431092791 /nfs/dbraw/zinc/09/27/91/1431092791.db2.gz YNIVFNCGAMXWQS-ZDUSSCGKSA-N 0 0 399.451 3.265 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1 ZINC000185260216 1431095715 /nfs/dbraw/zinc/09/57/15/1431095715.db2.gz XVUKYEADYUKSOF-CABCVRRESA-N 0 0 387.402 3.164 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000185260184 1431095912 /nfs/dbraw/zinc/09/59/12/1431095912.db2.gz XVUKYEADYUKSOF-GJZGRUSLSA-N 0 0 387.402 3.164 20 5 GGBDRN C[C@@H](N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nc(C2CCCCC2)no1 ZINC000185261810 1431096064 /nfs/dbraw/zinc/09/60/64/1431096064.db2.gz IXPBUHJGFSJDRZ-DYVFJYSZSA-N 0 0 399.451 3.482 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccnc1N1CCOCC1 ZINC000185264255 1431096381 /nfs/dbraw/zinc/09/63/81/1431096381.db2.gz IGHOYBKHGMKULU-MRXNPFEDSA-N 0 0 384.436 3.034 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCC(=O)NC1CCCCC1 ZINC000185266587 1431097021 /nfs/dbraw/zinc/09/70/21/1431097021.db2.gz ACAAIQJYFUMYGG-MRXNPFEDSA-N 0 0 375.469 3.119 20 5 GGBDRN C[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC000185276214 1431098155 /nfs/dbraw/zinc/09/81/55/1431098155.db2.gz DJQUHIWRVVDDPS-DZGCQCFKSA-N 0 0 390.440 3.116 20 5 GGBDRN COc1ccc(NC(=O)CN[C@H](c2ncc(C)s2)C2CC2)c([N+](=O)[O-])c1 ZINC000185277907 1431098457 /nfs/dbraw/zinc/09/84/57/1431098457.db2.gz MMURYVQAGMCXPB-INIZCTEOSA-N 0 0 376.438 3.048 20 5 GGBDRN CS(=O)(=O)Cc1ccccc1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185283428 1431099191 /nfs/dbraw/zinc/09/91/91/1431099191.db2.gz GNBHUCJISHSODT-UHFFFAOYSA-N 0 0 397.840 3.115 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CS(C)(=O)=O ZINC000185285142 1431099588 /nfs/dbraw/zinc/09/95/88/1431099588.db2.gz ORPSUGUBRZIPKG-HNNXBMFYSA-N 0 0 390.461 3.347 20 5 GGBDRN COCCNc1ccccc1CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185286553 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387.417 3.079 20 5 GGBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC(=O)c1ccc(F)c(F)c1 ZINC000185751351 1431224488 /nfs/dbraw/zinc/22/44/88/1431224488.db2.gz ULTXZGFXKQVIOA-UHFFFAOYSA-N 0 0 391.355 3.095 20 5 GGBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCSC2(CCOCC2)C1 ZINC000185758722 1431226762 /nfs/dbraw/zinc/22/67/62/1431226762.db2.gz XCKHADLWYQPOTI-UHFFFAOYSA-N 0 0 393.509 3.225 20 5 GGBDRN CCOC(=O)N1CC[C@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000185771130 1431230896 /nfs/dbraw/zinc/23/08/96/1431230896.db2.gz VASNWXGDWNKQNZ-ZDUSSCGKSA-N 0 0 376.438 3.039 20 5 GGBDRN COC(=O)[C@H](NCc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccc(F)c(C)c1 ZINC000185783680 1431234778 /nfs/dbraw/zinc/23/47/78/1431234778.db2.gz SNNVXPMNALVYOB-QGZVFWFLSA-N 0 0 380.347 3.194 20 5 GGBDRN Cc1nc2ccccc2nc1CSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C ZINC000185785340 1431235210 /nfs/dbraw/zinc/23/52/10/1431235210.db2.gz AOXAMYDIULFFRR-UHFFFAOYSA-N 0 0 393.428 3.386 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)n2C ZINC000185796340 1431238306 /nfs/dbraw/zinc/23/83/06/1431238306.db2.gz YDKUWUNOIGMBPL-ZDUSSCGKSA-N 0 0 397.435 3.359 20 5 GGBDRN COc1ccc2c(c1)nc(CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)n2C ZINC000185796320 1431238351 /nfs/dbraw/zinc/23/83/51/1431238351.db2.gz YDKUWUNOIGMBPL-CYBMUJFWSA-N 0 0 397.435 3.359 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCS[C@@H]3CCCC[C@@H]32)c2ncccc12 ZINC000185836631 1431247348 /nfs/dbraw/zinc/24/73/48/1431247348.db2.gz JYNLJMLVOBOLEL-LSDHHAIUSA-N 0 0 393.490 3.192 20 5 GGBDRN NC(=O)c1ccc(N2CCO[C@H](c3ccc(F)cc3Cl)C2)c([N+](=O)[O-])c1 ZINC000185845239 1431250299 /nfs/dbraw/zinc/25/02/99/1431250299.db2.gz BHLUQRGDMKVVKE-INIZCTEOSA-N 0 0 379.775 3.064 20 5 GGBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)n1 ZINC000185859203 1431254092 /nfs/dbraw/zinc/25/40/92/1431254092.db2.gz SSEMPELJDPCYNM-QGZVFWFLSA-N 0 0 398.444 3.372 20 5 GGBDRN Cn1nc(CCNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c2ccccc21 ZINC000185868943 1431257425 /nfs/dbraw/zinc/25/74/25/1431257425.db2.gz UHFRWLLXLKQDCH-UHFFFAOYSA-N 0 0 393.447 3.398 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)c2ncccc12 ZINC000185877057 1431260073 /nfs/dbraw/zinc/26/00/73/1431260073.db2.gz FEJTZOSQVQTXOW-UKRRQHHQSA-N 0 0 375.450 3.486 20 5 GGBDRN CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21)c1c(C)noc1C ZINC000185878223 1431260238 /nfs/dbraw/zinc/26/02/38/1431260238.db2.gz WVAVZMOUAIIROI-ZDUSSCGKSA-N 0 0 390.421 3.177 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1ccc(C(F)F)cc1 ZINC000185885732 1431263318 /nfs/dbraw/zinc/26/33/18/1431263318.db2.gz SJBUVHSJFXHCFA-UHFFFAOYSA-N 0 0 397.341 3.476 20 5 GGBDRN CN1Cc2cc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)ccc2NC1=O ZINC000185887289 1431263598 /nfs/dbraw/zinc/26/35/98/1431263598.db2.gz KTEREHVSDORIOD-UHFFFAOYSA-N 0 0 383.408 3.403 20 5 GGBDRN CN1Cc2cc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)ccc2NC1=O ZINC000185905832 1431273487 /nfs/dbraw/zinc/27/34/87/1431273487.db2.gz MMNVQEYGOJKKRF-UHFFFAOYSA-N 0 0 395.419 3.425 20 5 GGBDRN Cc1ccc([C@H](C)NS(=O)(=O)Cc2noc3ccccc32)cc1[N+](=O)[O-] ZINC000185909686 1431274516 /nfs/dbraw/zinc/27/45/16/1431274516.db2.gz QFNIDYCKMWZMTQ-LBPRGKRZSA-N 0 0 375.406 3.225 20 5 GGBDRN CC(C)(NS(=O)(=O)Cc1noc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000185917771 1431278727 /nfs/dbraw/zinc/27/87/27/1431278727.db2.gz BFINKWVEAGHSTI-UHFFFAOYSA-N 0 0 375.406 3.091 20 5 GGBDRN CN1Cc2cc(NC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)ccc2NC1=O ZINC000185940142 1431287812 /nfs/dbraw/zinc/28/78/12/1431287812.db2.gz OZHKHIDYUIKPIV-UHFFFAOYSA-N 0 0 392.375 3.010 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)cc(F)cc1[N+](=O)[O-] ZINC000185961917 1431298016 /nfs/dbraw/zinc/29/80/16/1431298016.db2.gz LWHHVQRJNJUEAD-OAHLLOKOSA-N 0 0 379.775 3.183 20 5 GGBDRN COc1ccc(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000185961189 1431298209 /nfs/dbraw/zinc/29/82/09/1431298209.db2.gz WHECUJQNBXEAHK-KRWDZBQOSA-N 0 0 376.796 3.471 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000185962037 1431298876 /nfs/dbraw/zinc/29/88/76/1431298876.db2.gz STUXEFFONWFWBG-QGZVFWFLSA-N 0 0 376.796 3.471 20 5 GGBDRN C[S@](=O)Cc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000185967232 1431300422 /nfs/dbraw/zinc/30/04/22/1431300422.db2.gz XSBQQQXBLANCIR-SANMLTNESA-N 0 0 384.360 3.327 20 5 GGBDRN CCCc1n[nH]c(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000185970496 1431301390 /nfs/dbraw/zinc/30/13/90/1431301390.db2.gz DIJMFULBGWYYJU-AWEZNQCLSA-N 0 0 378.816 3.138 20 5 GGBDRN O=C(Nc1cccc(-c2cc[nH]n2)c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000185978627 1431303483 /nfs/dbraw/zinc/30/34/83/1431303483.db2.gz RCWGCUHQJZFOBC-UHFFFAOYSA-N 0 0 392.419 3.339 20 5 GGBDRN COC(=O)[C@@H](C)Cc1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000185983709 1431304712 /nfs/dbraw/zinc/30/47/12/1431304712.db2.gz IUYIWBIQDREXMJ-AWEZNQCLSA-N 0 0 385.420 3.021 20 5 GGBDRN COC(=O)[C@H](Cc1c[nH]c2ccccc12)Nc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000185990104 1431306298 /nfs/dbraw/zinc/30/62/98/1431306298.db2.gz DHCFJLVJJQJNLU-SFHVURJKSA-N 0 0 381.388 3.475 20 5 GGBDRN Cc1ccc([C@H]2COCCN2C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000186005358 1431309541 /nfs/dbraw/zinc/30/95/41/1431309541.db2.gz GNXRSTNSDZGGPN-OAHLLOKOSA-N 0 0 379.800 3.433 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1nc(C(C)(C)C)no1 ZINC000186007405 1431309883 /nfs/dbraw/zinc/30/98/83/1431309883.db2.gz MTMWVTAHOCKQKK-SECBINFHSA-N 0 0 381.820 3.489 20 5 GGBDRN C[C@@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCN1CC(F)(F)F ZINC000186012220 1431311159 /nfs/dbraw/zinc/31/11/59/1431311159.db2.gz YUOHSBOEUIBJEP-SNVBAGLBSA-N 0 0 394.781 3.026 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)c2nc(C)cs2)cc1OC ZINC000186013574 1431311504 /nfs/dbraw/zinc/31/15/04/1431311504.db2.gz QBPONLQNAMXBOD-SNVBAGLBSA-N 0 0 379.438 3.301 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000186015308 1431311850 /nfs/dbraw/zinc/31/18/50/1431311850.db2.gz OEECPCFMBZHNPQ-GOSISDBHSA-N 0 0 387.392 3.197 20 5 GGBDRN CC(C)C[C@@H]1OCCC[C@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000186014916 1431311926 /nfs/dbraw/zinc/31/19/26/1431311926.db2.gz SVAFUXYNUAXJPQ-ZBFHGGJFSA-N 0 0 393.465 3.015 20 5 GGBDRN O=C(CN1CCC(C(=O)C(F)(F)F)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186015023 1431311983 /nfs/dbraw/zinc/31/19/83/1431311983.db2.gz YIKNZIXMWLOPQG-UHFFFAOYSA-N 0 0 393.749 3.030 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1 ZINC000186018040 1431312356 /nfs/dbraw/zinc/31/23/56/1431312356.db2.gz SSOCULQFMXTRTE-HZPDHXFCSA-N 0 0 393.871 3.293 20 5 GGBDRN CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000186038744 1431317494 /nfs/dbraw/zinc/31/74/94/1431317494.db2.gz ROVZHSHSZUNITA-OAHLLOKOSA-N 0 0 377.400 3.413 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCO[C@@H](CCc4ccccc4)C3)n2)c1 ZINC000186060632 1431321859 /nfs/dbraw/zinc/32/18/59/1431321859.db2.gz RMBSGZQMRQMMES-IBGZPJMESA-N 0 0 394.431 3.478 20 5 GGBDRN CCN(CC)S(=O)(=O)c1ccc(NCCC[C@@H]2CCCCO2)c([N+](=O)[O-])c1 ZINC000186077329 1431325861 /nfs/dbraw/zinc/32/58/61/1431325861.db2.gz VROKRHFLSHYWRK-HNNXBMFYSA-N 0 0 399.513 3.387 20 5 GGBDRN CSc1cccc(C(=O)NCc2ccccc2CN2CCCC2=O)c1[N+](=O)[O-] ZINC000186079971 1431326443 /nfs/dbraw/zinc/32/64/43/1431326443.db2.gz HYBXUFUAAXHNFC-UHFFFAOYSA-N 0 0 399.472 3.369 20 5 GGBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000186098031 1431329808 /nfs/dbraw/zinc/32/98/08/1431329808.db2.gz NZSKJGNFHRPZQV-UHFFFAOYSA-N 0 0 379.298 3.456 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1nnc(-c2c(F)cccc2Cl)s1 ZINC000186100297 1431330137 /nfs/dbraw/zinc/33/01/37/1431330137.db2.gz VCRPKXQSNBENAI-UHFFFAOYSA-N 0 0 396.791 3.131 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nnc(-c2c(F)cccc2Cl)s1 ZINC000186100419 1431330176 /nfs/dbraw/zinc/33/01/76/1431330176.db2.gz CJTZPZAIKANSQD-UHFFFAOYSA-N 0 0 396.791 3.049 20 5 GGBDRN CCCNC(=O)c1cccc(CNC(=O)c2cccc(SC)c2[N+](=O)[O-])c1 ZINC000186155428 1431343333 /nfs/dbraw/zinc/34/33/33/1431343333.db2.gz CFIKQTGXZQZJSO-UHFFFAOYSA-N 0 0 387.461 3.387 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nn(C)c2ccccc12 ZINC000186158716 1431343596 /nfs/dbraw/zinc/34/35/96/1431343596.db2.gz GKXJJQXXOLPSOF-MRXNPFEDSA-N 0 0 380.448 3.409 20 5 GGBDRN Cn1nc(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c2ccccc21 ZINC000186157749 1431343648 /nfs/dbraw/zinc/34/36/48/1431343648.db2.gz BTSABFFTFWAMSB-UHFFFAOYSA-N 0 0 392.337 3.473 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000186180549 1431348102 /nfs/dbraw/zinc/34/81/02/1431348102.db2.gz QNDIPHWPLUOQAN-GFCCVEGCSA-N 0 0 382.413 3.042 20 5 GGBDRN C[C@H](C(=O)NCCc1nc2cc(F)ccc2n1C)c1ccc([N+](=O)[O-])cc1F ZINC000186184626 1431348282 /nfs/dbraw/zinc/34/82/82/1431348282.db2.gz NHTMCUMJTUENGS-NSHDSACASA-N 0 0 388.374 3.222 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000186189913 1431349276 /nfs/dbraw/zinc/34/92/76/1431349276.db2.gz GXUHLSGOMXTKED-QGZVFWFLSA-N 0 0 376.796 3.471 20 5 GGBDRN Cc1nn(CCC(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)c(C)c1[N+](=O)[O-] ZINC000186195395 1431350581 /nfs/dbraw/zinc/35/05/81/1431350581.db2.gz WRHSMXCMAOELAS-INIZCTEOSA-N 0 0 392.843 3.052 20 5 GGBDRN CSc1cccc(C(=O)Nc2ccccc2CN2CCOCC2)c1[N+](=O)[O-] ZINC000186202261 1431351492 /nfs/dbraw/zinc/35/14/92/1431351492.db2.gz NHSJXGMURBYARI-UHFFFAOYSA-N 0 0 387.461 3.401 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N2CCC[C@@]2(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000186213578 1431354188 /nfs/dbraw/zinc/35/41/88/1431354188.db2.gz CQDUZHBREYCSOA-QFIPXVFZSA-N 0 0 395.459 3.257 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N[C@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000186242167 1431360454 /nfs/dbraw/zinc/36/04/54/1431360454.db2.gz NFMCDKACQXQLSR-MRVPVSSYSA-N 0 0 390.339 3.060 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC000186244847 1431361345 /nfs/dbraw/zinc/36/13/45/1431361345.db2.gz HETONVCSOFEENT-QGZVFWFLSA-N 0 0 377.347 3.156 20 5 GGBDRN CCc1noc2ncc(S(=O)(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc12 ZINC000186253091 1431363517 /nfs/dbraw/zinc/36/35/17/1431363517.db2.gz XJTGNYRLRJNZBC-NSHDSACASA-N 0 0 390.421 3.041 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(Cc2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000186261002 1431365234 /nfs/dbraw/zinc/36/52/34/1431365234.db2.gz CZGQFPSLMKCBLM-UHFFFAOYSA-N 0 0 398.387 3.235 20 5 GGBDRN CSc1cccc(C(=O)NCC(=O)N2CCCc3ccccc32)c1[N+](=O)[O-] ZINC000186266746 1431366700 /nfs/dbraw/zinc/36/67/00/1431366700.db2.gz UROXMFXOGHWKLT-UHFFFAOYSA-N 0 0 385.445 3.026 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)[C@@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000186272775 1431368544 /nfs/dbraw/zinc/36/85/44/1431368544.db2.gz HCXVUNYGYXVLCB-JTQLQIEISA-N 0 0 386.376 3.263 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NC[C@@H](c1ccccc1)C(F)(F)F ZINC000186278983 1431370227 /nfs/dbraw/zinc/37/02/27/1431370227.db2.gz RQJQJEIFXIIYLX-AWEZNQCLSA-N 0 0 388.367 3.360 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2c3ccccc3CC[C@H]2C)cc1[N+](=O)[O-] ZINC000186285438 1431371481 /nfs/dbraw/zinc/37/14/81/1431371481.db2.gz WLAUSBFITDADFT-LLVKDONJSA-N 0 0 380.397 3.273 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000186290646 1431372930 /nfs/dbraw/zinc/37/29/30/1431372930.db2.gz WHISZKKCWBWNFF-AWEZNQCLSA-N 0 0 394.424 3.138 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c2c(O)cccc21 ZINC000186293679 1431373547 /nfs/dbraw/zinc/37/35/47/1431373547.db2.gz WOUYHSKZBBIIGN-LLVKDONJSA-N 0 0 379.372 3.296 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c2c(O)cccc21 ZINC000186293451 1431373613 /nfs/dbraw/zinc/37/36/13/1431373613.db2.gz WNJBSYGIWBXRNQ-GFCCVEGCSA-N 0 0 379.376 3.035 20 5 GGBDRN CC(C)S(=O)(=O)c1ccccc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186320226 1431381208 /nfs/dbraw/zinc/38/12/08/1431381208.db2.gz KHBDSEWRGZGGHG-UHFFFAOYSA-N 0 0 396.852 3.360 20 5 GGBDRN CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186320413 1431381486 /nfs/dbraw/zinc/38/14/86/1431381486.db2.gz QIPYZIFPMDUORA-CQSZACIVSA-N 0 0 399.900 3.202 20 5 GGBDRN Nc1c(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)cccc1[N+](=O)[O-] ZINC000186325634 1431383236 /nfs/dbraw/zinc/38/32/36/1431383236.db2.gz LWCJJKHDJCHFEQ-HNNXBMFYSA-N 0 0 379.775 3.183 20 5 GGBDRN CC(=O)N[C@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(C)cc1 ZINC000186326172 1431383542 /nfs/dbraw/zinc/38/35/42/1431383542.db2.gz WIPVVIZHUIQHNI-GOSISDBHSA-N 0 0 389.839 3.440 20 5 GGBDRN CCN(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)[C@@H](C)Cc1ccsc1 ZINC000186327430 1431383757 /nfs/dbraw/zinc/38/37/57/1431383757.db2.gz KTCLKIKMQFEWGP-LBPRGKRZSA-N 0 0 396.490 3.153 20 5 GGBDRN C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186336092 1431386248 /nfs/dbraw/zinc/38/62/48/1431386248.db2.gz XESLMDFQIANMQR-SNVBAGLBSA-N 0 0 396.230 3.336 20 5 GGBDRN C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186336070 1431386386 /nfs/dbraw/zinc/38/63/86/1431386386.db2.gz XESLMDFQIANMQR-JTQLQIEISA-N 0 0 396.230 3.336 20 5 GGBDRN C[C@@H](NC(=O)Nc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186335879 1431386410 /nfs/dbraw/zinc/38/64/10/1431386410.db2.gz WTAFZWYMEHUZCU-LLVKDONJSA-N 0 0 376.800 3.075 20 5 GGBDRN CC(=O)N(CCC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000186341453 1431387713 /nfs/dbraw/zinc/38/77/13/1431387713.db2.gz QAIWJPMKHKBCHW-UHFFFAOYSA-N 0 0 389.839 3.303 20 5 GGBDRN COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)CO2 ZINC000186345188 1431388296 /nfs/dbraw/zinc/38/82/96/1431388296.db2.gz IYXQLEXCKCABIS-CYBMUJFWSA-N 0 0 376.796 3.124 20 5 GGBDRN O=C(CCc1nc(-c2ccco2)no1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186349641 1431389271 /nfs/dbraw/zinc/38/92/71/1431389271.db2.gz SZVBUDMXUXGOME-UHFFFAOYSA-N 0 0 376.756 3.140 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](CCc2ccccc2)C1 ZINC000186354312 1431390367 /nfs/dbraw/zinc/39/03/67/1431390367.db2.gz YSHZNWKPXGQHSU-QGZVFWFLSA-N 0 0 385.420 3.469 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2Cc3ccccc3C2)c(C(F)(F)F)c1 ZINC000186369102 1431394156 /nfs/dbraw/zinc/39/41/56/1431394156.db2.gz OWTDADOGBJGCRC-UHFFFAOYSA-N 0 0 386.351 3.059 20 5 GGBDRN COC(=O)Cc1cccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000186374490 1431395191 /nfs/dbraw/zinc/39/51/91/1431395191.db2.gz QHGGJRLUORJHAB-UHFFFAOYSA-N 0 0 394.387 3.057 20 5 GGBDRN CS(=O)(=O)CCCCCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000186411817 1431407759 /nfs/dbraw/zinc/40/77/59/1431407759.db2.gz DRSXIGBDEACUPK-UHFFFAOYSA-N 0 0 390.461 3.453 20 5 GGBDRN COc1ccc(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)cc1[N+](=O)[O-] ZINC000186420808 1431412790 /nfs/dbraw/zinc/41/27/90/1431412790.db2.gz RKDJLIHFNQGUDW-UHFFFAOYSA-N 0 0 392.358 3.005 20 5 GGBDRN COc1cc(CN2CCOC[C@@H]2CC(=O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000186427598 1431415334 /nfs/dbraw/zinc/41/53/34/1431415334.db2.gz INRMZCCWOSONPP-INIZCTEOSA-N 0 0 388.395 3.216 20 5 GGBDRN C[C@@H]1CCCCN(C(=O)c2cc([N+](=O)[O-])ccc2I)C1 ZINC000186447197 1431422112 /nfs/dbraw/zinc/42/21/12/1431422112.db2.gz OUSSEXKLVZATHV-SNVBAGLBSA-N 0 0 388.205 3.462 20 5 GGBDRN CSc1cccc(C(=O)NCc2cccc(Cn3ccnc3)c2)c1[N+](=O)[O-] ZINC000186454763 1431423752 /nfs/dbraw/zinc/42/37/52/1431423752.db2.gz RQIGWIDARWOSRD-UHFFFAOYSA-N 0 0 382.445 3.492 20 5 GGBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000186504025 1431439893 /nfs/dbraw/zinc/43/98/93/1431439893.db2.gz DHIGLWSIYQJFAW-CXAGYDPISA-N 0 0 375.450 3.324 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000186513021 1431442916 /nfs/dbraw/zinc/44/29/16/1431442916.db2.gz YUUJSMIHGODCHD-YVEFUNNKSA-N 0 0 375.450 3.378 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCS(=O)(=O)c4ccccc4C3)co2)cc1 ZINC000186546364 1431450888 /nfs/dbraw/zinc/45/08/88/1431450888.db2.gz SSAFIRBMHQIGKP-UHFFFAOYSA-N 0 0 399.428 3.039 20 5 GGBDRN Cc1c(CC(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cccc1[N+](=O)[O-] ZINC000186568203 1431456292 /nfs/dbraw/zinc/45/62/92/1431456292.db2.gz VVEVTHIIOBUOEJ-UHFFFAOYSA-N 0 0 395.415 3.124 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1[N+](=O)[O-] ZINC000186570230 1431456655 /nfs/dbraw/zinc/45/66/55/1431456655.db2.gz OGXFFRCHTJOVNZ-UHFFFAOYSA-N 0 0 381.388 3.195 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000186570958 1431456747 /nfs/dbraw/zinc/45/67/47/1431456747.db2.gz CNUMBBICUMBPPA-OAHLLOKOSA-N 0 0 398.387 3.407 20 5 GGBDRN COC(=O)c1cc([N+](=O)[O-])cn(Cc2ccc(OC(C)C)c(Cl)c2)c1=O ZINC000186573761 1431457649 /nfs/dbraw/zinc/45/76/49/1431457649.db2.gz JSBRTXXOWDTRDT-UHFFFAOYSA-N 0 0 380.784 3.032 20 5 GGBDRN Cc1ccc(NCCCNC(=O)NCCC[C@@H]2CCCCO2)c([N+](=O)[O-])c1 ZINC000186579577 1431459394 /nfs/dbraw/zinc/45/93/94/1431459394.db2.gz HEHSTDDORKOZGQ-INIZCTEOSA-N 0 0 378.473 3.354 20 5 GGBDRN CSc1cccc(C(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)c1[N+](=O)[O-] ZINC000186592712 1431463018 /nfs/dbraw/zinc/46/30/18/1431463018.db2.gz LENSHJIQANDFKF-SWLSCSKDSA-N 0 0 385.445 3.241 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(OCCCCc2ccccc2)c([N+](=O)[O-])c1 ZINC000186611218 1431468822 /nfs/dbraw/zinc/46/88/22/1431468822.db2.gz BAVREKPLRXQWJJ-UHFFFAOYSA-N 0 0 394.405 3.308 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CC[C@@]4(C3)OCc3ccccc34)o2)cc1 ZINC000186616786 1431470362 /nfs/dbraw/zinc/47/03/62/1431470362.db2.gz DVSUHWXNVASROH-FQEVSTJZSA-N 0 0 378.388 3.276 20 5 GGBDRN CCc1c(C(=O)NCc2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1OC ZINC000186671933 1431487797 /nfs/dbraw/zinc/48/77/97/1431487797.db2.gz BBQHJXYUKRGRRN-UHFFFAOYSA-N 0 0 380.404 3.282 20 5 GGBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000186683820 1431491588 /nfs/dbraw/zinc/49/15/88/1431491588.db2.gz LBIMVJRVZWCFGR-ZBFHGGJFSA-N 0 0 396.230 3.214 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])c1 ZINC000186688117 1431492532 /nfs/dbraw/zinc/49/25/32/1431492532.db2.gz GKKDEJKISTZZEO-OAQYLSRUSA-N 0 0 397.431 3.063 20 5 GGBDRN O=C(NC1Cc2ccccc2C1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000186706180 1431497353 /nfs/dbraw/zinc/49/73/53/1431497353.db2.gz DFULIRDGAPYSNR-UHFFFAOYSA-N 0 0 381.432 3.315 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)N2CC[C@@H](O)[C@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000186709441 1431497649 /nfs/dbraw/zinc/49/76/49/1431497649.db2.gz STZXVLKKVGKWJI-BIENJYKASA-N 0 0 384.436 3.006 20 5 GGBDRN Cc1cc(OCC(=O)NC[C@H]2CCN(c3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000186728570 1431503469 /nfs/dbraw/zinc/50/34/69/1431503469.db2.gz GRBNTUHYBJQGJS-OAHLLOKOSA-N 0 0 387.411 3.064 20 5 GGBDRN Cc1cc(OCC(=O)Nc2ccnn2Cc2cccs2)c(F)cc1[N+](=O)[O-] ZINC000186731903 1431504505 /nfs/dbraw/zinc/50/45/05/1431504505.db2.gz NFMJINPSTCSSPH-UHFFFAOYSA-N 0 0 390.396 3.366 20 5 GGBDRN CSc1cccc(C(=O)Nc2cc(C)nn2-c2ccc(C)nn2)c1[N+](=O)[O-] ZINC000186735526 1431505387 /nfs/dbraw/zinc/50/53/87/1431505387.db2.gz MAQJUYZECDBSNQ-UHFFFAOYSA-N 0 0 384.421 3.162 20 5 GGBDRN CN(CC1(c2ccccc2)CC1)C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1 ZINC000186771871 1431512298 /nfs/dbraw/zinc/51/22/98/1431512298.db2.gz MUQXWVLZCGTWOJ-UHFFFAOYSA-N 0 0 395.459 3.235 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cn(-c2ccccc2)nc1C ZINC000186790082 1431517643 /nfs/dbraw/zinc/51/76/43/1431517643.db2.gz SWQBKGWPYOYAKY-UHFFFAOYSA-N 0 0 381.392 3.419 20 5 GGBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCSC2(CCOCC2)C1 ZINC000186816008 1431525847 /nfs/dbraw/zinc/52/58/47/1431525847.db2.gz CVQQFYGKKYCBGE-GFCCVEGCSA-N 0 0 399.900 3.173 20 5 GGBDRN C[C@@H]1CCCCN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)C1 ZINC000186869625 1431547662 /nfs/dbraw/zinc/54/76/62/1431547662.db2.gz HZKWQLCWOOFIBR-GFCCVEGCSA-N 0 0 375.454 3.137 20 5 GGBDRN COc1cc(C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)ccc1[N+](=O)[O-] ZINC000186887700 1431555544 /nfs/dbraw/zinc/55/55/44/1431555544.db2.gz LUQODNZLXQEZRO-QGZVFWFLSA-N 0 0 378.331 3.095 20 5 GGBDRN COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccsc1 ZINC000186898943 1431559028 /nfs/dbraw/zinc/55/90/28/1431559028.db2.gz SGTDEYNIRVEVGW-GFCCVEGCSA-N 0 0 388.323 3.319 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C(=O)OC)c1ccsc1 ZINC000186916470 1431564617 /nfs/dbraw/zinc/56/46/17/1431564617.db2.gz GFVDRBYVTVKIBX-XJKSGUPXSA-N 0 0 376.434 3.256 20 5 GGBDRN COc1ccc(Cn2ccc(NC(=O)CCOc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000186933965 1431570550 /nfs/dbraw/zinc/57/05/50/1431570550.db2.gz DSLSJFIHJXZNMQ-UHFFFAOYSA-N 0 0 396.403 3.256 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186946871 1431573440 /nfs/dbraw/zinc/57/34/40/1431573440.db2.gz WCKTZPBPQMQGFW-OAQYLSRUSA-N 0 0 390.399 3.052 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186970882 1431579660 /nfs/dbraw/zinc/57/96/60/1431579660.db2.gz GWIULKIJHVYOSN-NRFANRHFSA-N 0 0 377.400 3.277 20 5 GGBDRN CCOc1cnc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cn1 ZINC000186972937 1431580238 /nfs/dbraw/zinc/58/02/38/1431580238.db2.gz NABCCFLZSKCGKE-UHFFFAOYSA-N 0 0 385.405 3.468 20 5 GGBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@H](C)C[C@H]2C(N)=O)cc1[N+](=O)[O-] ZINC000186982357 1431582561 /nfs/dbraw/zinc/58/25/61/1431582561.db2.gz OQJFVRUIDUZHTA-CJNGLKHVSA-N 0 0 393.509 3.459 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000187009538 1431588268 /nfs/dbraw/zinc/58/82/68/1431588268.db2.gz BRHYPXXEPUMDHV-NRFANRHFSA-N 0 0 390.399 3.052 20 5 GGBDRN COc1ccc2[nH]cc(C3CCN(C(=O)c4c[nH]c(=O)c([N+](=O)[O-])c4)CC3)c2c1 ZINC000187011207 1431588717 /nfs/dbraw/zinc/58/87/17/1431588717.db2.gz JYUCURDDTROGNX-UHFFFAOYSA-N 0 0 396.403 3.205 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCSC[C@H]3c3nccs3)n2)cc1 ZINC000187053161 1431600306 /nfs/dbraw/zinc/60/03/06/1431600306.db2.gz ASCMYKRQYVPSCY-ZDUSSCGKSA-N 0 0 389.462 3.391 20 5 GGBDRN C/C=C/C[C@@H](CO)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000187056569 1431601237 /nfs/dbraw/zinc/60/12/37/1431601237.db2.gz POSOHJCVLOZDEA-WVSRPDOZSA-N 0 0 384.436 3.220 20 5 GGBDRN CC[C@]1(CO)CCCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000187068189 1431604433 /nfs/dbraw/zinc/60/44/33/1431604433.db2.gz ZWUBBDDRBGTXQY-QHCPKHFHSA-N 0 0 378.472 3.166 20 5 GGBDRN CSc1cccc(C(=O)NC2CCC(O)(c3cccnc3)CC2)c1[N+](=O)[O-] ZINC000187093174 1431612679 /nfs/dbraw/zinc/61/26/79/1431612679.db2.gz WIAUFOUAOMWBHJ-UHFFFAOYSA-N 0 0 387.461 3.272 20 5 GGBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000187099169 1431615027 /nfs/dbraw/zinc/61/50/27/1431615027.db2.gz XIMVIDADMXRQSC-BDJLRTHQSA-N 0 0 375.812 3.433 20 5 GGBDRN C[C@@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccc(OCC2CC2)c(F)c1 ZINC000187188413 1431641230 /nfs/dbraw/zinc/64/12/30/1431641230.db2.gz YLBHXHHHZQHCHD-SNVBAGLBSA-N 0 0 375.356 3.114 20 5 GGBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(OC2COC2)cc1 ZINC000187192243 1431642282 /nfs/dbraw/zinc/64/22/82/1431642282.db2.gz ZFJFVNHSSYTSFR-UHFFFAOYSA-N 0 0 377.784 3.348 20 5 GGBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@](C)(CC(=O)OC)c1ccccn1 ZINC000187212743 1431650057 /nfs/dbraw/zinc/65/00/57/1431650057.db2.gz IHBBDUHHAXOYCI-HRAATJIYSA-N 0 0 399.447 3.153 20 5 GGBDRN O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1CCc2ccc(-c3ccccc3)cc21 ZINC000187219551 1431653292 /nfs/dbraw/zinc/65/32/92/1431653292.db2.gz LXDPDONGPJUEKF-FQEVSTJZSA-N 0 0 391.431 3.445 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2C[C@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000187241918 1431662535 /nfs/dbraw/zinc/66/25/35/1431662535.db2.gz XJCNYDNGKBYCHJ-ZBEGNZNMSA-N 0 0 380.397 3.124 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CC[C@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000187278601 1431678632 /nfs/dbraw/zinc/67/86/32/1431678632.db2.gz DNYGNNMMKZHLOY-NSHDSACASA-N 0 0 380.397 3.445 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CCCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000187284859 1431681216 /nfs/dbraw/zinc/68/12/16/1431681216.db2.gz LEBRGVISBLRLDD-UHFFFAOYSA-N 0 0 384.360 3.023 20 5 GGBDRN O=C(NC1CCC(O)(c2cccnc2)CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000187286394 1431681901 /nfs/dbraw/zinc/68/19/01/1431681901.db2.gz MFMRJPAEPGOMDB-UHFFFAOYSA-N 0 0 396.447 3.124 20 5 GGBDRN O=C(CCN1CCO[C@H](c2ccc(F)cc2F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000187290472 1431683965 /nfs/dbraw/zinc/68/39/65/1431683965.db2.gz HDSYMJANFMZBAD-SFHVURJKSA-N 0 0 391.374 3.275 20 5 GGBDRN O=C(NCC1(CCOCc2ccccc2)CC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000187298899 1431686850 /nfs/dbraw/zinc/68/68/50/1431686850.db2.gz JRMKPGKLWJHIMO-UHFFFAOYSA-N 0 0 397.431 3.037 20 5 GGBDRN CC1(C)[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1OCc1ccccc1 ZINC000187305321 1431689538 /nfs/dbraw/zinc/68/95/38/1431689538.db2.gz QECUQLAYHIVFAS-MSOLQXFVSA-N 0 0 397.431 3.033 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC1CCC(O)(c2cccnc2)CC1 ZINC000187306402 1431690025 /nfs/dbraw/zinc/69/00/25/1431690025.db2.gz GGQYLONZCDEDIJ-UHFFFAOYSA-N 0 0 383.448 3.475 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2cccc(OCC(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000187314274 1431693170 /nfs/dbraw/zinc/69/31/70/1431693170.db2.gz RGLDAPAJZROYBJ-UHFFFAOYSA-N 0 0 385.420 3.438 20 5 GGBDRN C[C@@H](C(=O)NC1CCC(O)(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000187321265 1431695907 /nfs/dbraw/zinc/69/59/07/1431695907.db2.gz MJXLAQAFFROVPP-JUJQQSPASA-N 0 0 387.411 3.179 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1(Cc2ccccc2)CCCCC1 ZINC000187354955 1431706589 /nfs/dbraw/zinc/70/65/89/1431706589.db2.gz DYTXJYRVFPUXAG-UHFFFAOYSA-N 0 0 383.448 3.066 20 5 GGBDRN CCN(C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)[C@@H](C)Cc1ccsc1 ZINC000187363399 1431708666 /nfs/dbraw/zinc/70/86/66/1431708666.db2.gz FVZGKWKOYOIUJL-UONOGXRCSA-N 0 0 389.477 3.254 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N2CC[C@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000187402731 1431720000 /nfs/dbraw/zinc/72/00/00/1431720000.db2.gz UFWAKYYQIUELMB-DOMZBBRYSA-N 0 0 394.424 3.309 20 5 GGBDRN CC[C@H]1[C@@H](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1I ZINC000187426770 1431726363 /nfs/dbraw/zinc/72/63/63/1431726363.db2.gz JIQKINXJBSVCLY-ZANVPECISA-N 0 0 388.205 3.460 20 5 GGBDRN C[C@@H](C(=O)Nc1cc2c(cc1F)NC(=O)CC2)c1ccc([N+](=O)[O-])cc1F ZINC000187431274 1431727527 /nfs/dbraw/zinc/72/75/27/1431727527.db2.gz FQLPBYJMSJCYJP-SECBINFHSA-N 0 0 375.331 3.500 20 5 GGBDRN NC(=O)c1ccc(CSCc2ccn(-c3ccccc3F)n2)c([N+](=O)[O-])c1 ZINC000187516826 1431753808 /nfs/dbraw/zinc/75/38/08/1431753808.db2.gz IGLVFEHFZNLHRX-UHFFFAOYSA-N 0 0 386.408 3.452 20 5 GGBDRN CC(C)c1ccc(C(=O)NCCCNC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000187517670 1431754365 /nfs/dbraw/zinc/75/43/65/1431754365.db2.gz BUUWXDMRJAYFDO-UHFFFAOYSA-N 0 0 375.450 3.330 20 5 GGBDRN O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187540882 1431761372 /nfs/dbraw/zinc/76/13/72/1431761372.db2.gz JLCUNWIILWYBIN-UHFFFAOYSA-N 0 0 375.344 3.491 20 5 GGBDRN COc1cc(OCC(=O)NC2(Cc3cccc(F)c3)CCC2)ccc1[N+](=O)[O-] ZINC000187553285 1431764692 /nfs/dbraw/zinc/76/46/92/1431764692.db2.gz KCQPUBJZZROJOU-UHFFFAOYSA-N 0 0 388.395 3.403 20 5 GGBDRN O=C(Nc1ccnn1[C@H]1CCCc2ccccc21)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187559581 1431766739 /nfs/dbraw/zinc/76/67/39/1431766739.db2.gz VYZAIFGWYUVAJS-HNNXBMFYSA-N 0 0 379.376 3.070 20 5 GGBDRN O=C(Nc1ccnn1[C@@H]1CCCc2ccccc21)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187559604 1431766971 /nfs/dbraw/zinc/76/69/71/1431766971.db2.gz VYZAIFGWYUVAJS-OAHLLOKOSA-N 0 0 379.376 3.070 20 5 GGBDRN O=C(Nc1ccc(-n2ncc3ccccc32)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187572493 1431770661 /nfs/dbraw/zinc/77/06/61/1431770661.db2.gz GFAHEWAUSDZZRA-UHFFFAOYSA-N 0 0 375.344 3.287 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H](C)CSc2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000187587767 1431773474 /nfs/dbraw/zinc/77/34/74/1431773474.db2.gz ISPVLJXFGZRRLY-CYBMUJFWSA-N 0 0 376.482 3.404 20 5 GGBDRN CCOc1ccc2c(c1)[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000187595124 1431775624 /nfs/dbraw/zinc/77/56/24/1431775624.db2.gz NUIXJFAODZUGJI-SFHVURJKSA-N 0 0 385.420 3.359 20 5 GGBDRN Cn1cc([C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)cn1 ZINC000187595035 1431775682 /nfs/dbraw/zinc/77/56/82/1431775682.db2.gz XVTSQTJWEBPGKZ-LJQANCHMSA-N 0 0 397.410 3.099 20 5 GGBDRN Cc1nnnn1-c1cc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)ccc1F ZINC000187597203 1431775714 /nfs/dbraw/zinc/77/57/14/1431775714.db2.gz WDGAADFDJRLXLC-UHFFFAOYSA-N 0 0 384.371 3.394 20 5 GGBDRN C[C@H](NC(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000187627494 1431781981 /nfs/dbraw/zinc/78/19/81/1431781981.db2.gz ALVHUMNPFBCSQX-DETPVDSQSA-N 0 0 389.374 3.439 20 5 GGBDRN C[C@@H](NC(=O)NCC1CCN(CC(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000187627929 1431782380 /nfs/dbraw/zinc/78/23/80/1431782380.db2.gz HMNNHXPNRADPAK-GFCCVEGCSA-N 0 0 388.390 3.229 20 5 GGBDRN CC(C)(C)OCc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)no1 ZINC000187641552 1431786091 /nfs/dbraw/zinc/78/60/91/1431786091.db2.gz UCFOXISFXHGACG-UHFFFAOYSA-N 0 0 399.350 3.429 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000187676548 1431797707 /nfs/dbraw/zinc/79/77/07/1431797707.db2.gz KIVDJDVTJWFTHJ-ABAIWWIYSA-N 0 0 394.777 3.391 20 5 GGBDRN CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187678010 1431797724 /nfs/dbraw/zinc/79/77/24/1431797724.db2.gz BUWJPLKCBQQLNK-BLLLJJGKSA-N 0 0 379.482 3.148 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CSC[C@H]2C(=O)N(C)C(C)C)cc1[N+](=O)[O-] ZINC000187678231 1431798502 /nfs/dbraw/zinc/79/85/02/1431798502.db2.gz GFJCKZOWEDGAAJ-INIZCTEOSA-N 0 0 379.482 3.100 20 5 GGBDRN COC[C@@H](C)n1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000187687614 1431800378 /nfs/dbraw/zinc/80/03/78/1431800378.db2.gz LNGLNKIQNLEQEV-GHMZBOCLSA-N 0 0 381.820 3.091 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccccc2-n2ccc(C(N)=O)n2)cc1[N+](=O)[O-] ZINC000187718221 1431803499 /nfs/dbraw/zinc/80/34/99/1431803499.db2.gz LZAZVVPEWBMXBX-UHFFFAOYSA-N 0 0 393.403 3.255 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000187751411 1431808109 /nfs/dbraw/zinc/80/81/09/1431808109.db2.gz COVNKZWINFUDNX-PXAZEXFGSA-N 0 0 399.369 3.218 20 5 GGBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000187751428 1431808154 /nfs/dbraw/zinc/80/81/54/1431808154.db2.gz COVNKZWINFUDNX-SJKOYZFVSA-N 0 0 399.369 3.218 20 5 GGBDRN Cc1cc(C)c2c(c1)CN(C(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)CC2 ZINC000187795164 1431813225 /nfs/dbraw/zinc/81/32/25/1431813225.db2.gz TVNKYWKBXMTVSJ-UHFFFAOYSA-N 0 0 395.459 3.247 20 5 GGBDRN Cc1nsc(N2CCCN(C(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)n1 ZINC000187799538 1431813794 /nfs/dbraw/zinc/81/37/94/1431813794.db2.gz LQEVCOQGTBTAHW-UHFFFAOYSA-N 0 0 389.481 3.231 20 5 GGBDRN CS(=O)(=O)c1cc(C(=O)N2CCC(c3ccsc3)CC2)cc([N+](=O)[O-])c1 ZINC000187800491 1431813887 /nfs/dbraw/zinc/81/38/87/1431813887.db2.gz QLUDCKMBDAYSLC-UHFFFAOYSA-N 0 0 394.474 3.080 20 5 GGBDRN CCc1nsc(N2CCN(C(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)n1 ZINC000187802808 1431814197 /nfs/dbraw/zinc/81/41/97/1431814197.db2.gz OMQAWPYGPJDJLK-UHFFFAOYSA-N 0 0 389.481 3.095 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@H]1CCC[C@H]1CCO ZINC000187816516 1431815925 /nfs/dbraw/zinc/81/59/25/1431815925.db2.gz BCFHAASTPCAYFY-AAEUAGOBSA-N 0 0 389.374 3.083 20 5 GGBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2noc(-c3ccc(F)cc3F)n2)c1 ZINC000187818357 1431816179 /nfs/dbraw/zinc/81/61/79/1431816179.db2.gz YEZDLSOLPBUHSR-UHFFFAOYSA-N 0 0 391.286 3.289 20 5 GGBDRN CC(C)c1ccc(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000187820993 1431816360 /nfs/dbraw/zinc/81/63/60/1431816360.db2.gz GVGMSECIIWUYJC-QGZVFWFLSA-N 0 0 390.461 3.234 20 5 GGBDRN Cc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])nnn1Cc1ccc(F)cc1F ZINC000187844838 1431819369 /nfs/dbraw/zinc/81/93/69/1431819369.db2.gz SPKNINSHWFXJGK-UHFFFAOYSA-N 0 0 399.357 3.024 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)NCC1(c2ccc(F)cc2F)CCCC1 ZINC000187861084 1431821138 /nfs/dbraw/zinc/82/11/38/1431821138.db2.gz CKLQSQXTTNMDCZ-UHFFFAOYSA-N 0 0 378.379 3.088 20 5 GGBDRN COc1ccc(Cl)c(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000187885858 1431824115 /nfs/dbraw/zinc/82/41/15/1431824115.db2.gz TUYLNFHWDVJRIR-SFHVURJKSA-N 0 0 389.795 3.224 20 5 GGBDRN NC(=O)c1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)c([N+](=O)[O-])c1 ZINC000187886783 1431824213 /nfs/dbraw/zinc/82/42/13/1431824213.db2.gz FMBOCBVABFQLBX-KRWDZBQOSA-N 0 0 393.802 3.060 20 5 GGBDRN COc1cc(C)c(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000187904115 1431825985 /nfs/dbraw/zinc/82/59/85/1431825985.db2.gz FPTDHTHLCHTFBZ-UHFFFAOYSA-N 0 0 381.747 3.282 20 5 GGBDRN CN(C(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(OCc2ccccc2)cc1 ZINC000187931993 1431828800 /nfs/dbraw/zinc/82/88/00/1431828800.db2.gz LAXRDFZNXFSWIP-UHFFFAOYSA-N 0 0 380.404 3.423 20 5 GGBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)Cc2ccn(-c3ccccc3F)n2)c1 ZINC000187941450 1431829650 /nfs/dbraw/zinc/82/96/50/1431829650.db2.gz YBJLBJFCGLXQMR-UHFFFAOYSA-N 0 0 375.381 3.035 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(Cn3cccn3)cc2)cc([N+](=O)[O-])c1C ZINC000187952597 1431830634 /nfs/dbraw/zinc/83/06/34/1431830634.db2.gz ODRTYBVNVFIRNO-UHFFFAOYSA-N 0 0 380.404 3.087 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1CNc1ccc(S(=O)(=O)N2CCCCC2)cn1 ZINC000188029546 1431837834 /nfs/dbraw/zinc/83/78/34/1431837834.db2.gz UKZCNHNSZSIWDD-UHFFFAOYSA-N 0 0 390.465 3.085 20 5 GGBDRN CCC(CC)[C@H](CNC(=O)c1cccc(SC)c1[N+](=O)[O-])N1CCOCC1 ZINC000188032078 1431838063 /nfs/dbraw/zinc/83/80/63/1431838063.db2.gz SSBXPVOALFAURJ-INIZCTEOSA-N 0 0 395.525 3.184 20 5 GGBDRN CCN(C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)Cc1ccsc1 ZINC000188037138 1431838566 /nfs/dbraw/zinc/83/85/66/1431838566.db2.gz QMVSJHOAGJYZTQ-CYBMUJFWSA-N 0 0 375.450 3.383 20 5 GGBDRN CCCCCNC(=O)C1CCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])CC1 ZINC000188054690 1431840443 /nfs/dbraw/zinc/84/04/43/1431840443.db2.gz UBDXDYTUNRUYPZ-UHFFFAOYSA-N 0 0 393.509 3.475 20 5 GGBDRN CSc1cccc(C(=O)N2CCc3c(cccc3NC(C)=O)C2)c1[N+](=O)[O-] ZINC000188074786 1431842942 /nfs/dbraw/zinc/84/29/42/1431842942.db2.gz RTFJHIMVETXSAR-UHFFFAOYSA-N 0 0 385.445 3.474 20 5 GGBDRN CSc1cccc(C(=O)NCc2cccc(Cn3cccn3)c2)c1[N+](=O)[O-] ZINC000188076526 1431843321 /nfs/dbraw/zinc/84/33/21/1431843321.db2.gz AGZALQRKYDGKOP-UHFFFAOYSA-N 0 0 382.445 3.492 20 5 GGBDRN CCCCNC(=O)[C@@H]1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000188100378 1431846533 /nfs/dbraw/zinc/84/65/33/1431846533.db2.gz HUMHLZOYBNKBBB-CYBMUJFWSA-N 0 0 379.482 3.085 20 5 GGBDRN CNS(=O)(=O)c1ccc(C)c(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000188103098 1431847114 /nfs/dbraw/zinc/84/71/14/1431847114.db2.gz GOHCROHHTWVILE-UHFFFAOYSA-N 0 0 391.449 3.187 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000188112502 1431848078 /nfs/dbraw/zinc/84/80/78/1431848078.db2.gz HWJWBVYWLSDTPU-CYBMUJFWSA-N 0 0 379.482 3.085 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000188116901 1431849017 /nfs/dbraw/zinc/84/90/17/1431849017.db2.gz MCMHORQELMOYFB-IRXDYDNUSA-N 0 0 381.432 3.369 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000188138358 1431851950 /nfs/dbraw/zinc/85/19/50/1431851950.db2.gz KAANTJJYJFWSBN-JKSUJKDBSA-N 0 0 397.431 3.070 20 5 GGBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188140072 1431852122 /nfs/dbraw/zinc/85/21/22/1431852122.db2.gz HFRKSKCKEQTHCG-IAGOWNOFSA-N 0 0 381.432 3.369 20 5 GGBDRN CSc1cccc(C(=O)N2CCN([C@H](C)c3cccnc3)CC2)c1[N+](=O)[O-] ZINC000188163512 1431855234 /nfs/dbraw/zinc/85/52/34/1431855234.db2.gz HCMGGBOCIBDVLQ-CQSZACIVSA-N 0 0 386.477 3.231 20 5 GGBDRN O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1cc(Cl)ccc1OCC1CCC1 ZINC000188176660 1431857130 /nfs/dbraw/zinc/85/71/30/1431857130.db2.gz OXRXWFIBMBVAOJ-UHFFFAOYSA-N 0 0 391.811 3.228 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1 ZINC000188182575 1431857917 /nfs/dbraw/zinc/85/79/17/1431857917.db2.gz HPUCYMQZZQDBOQ-MRXNPFEDSA-N 0 0 382.338 3.176 20 5 GGBDRN Cc1cc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)nc(C(F)(F)F)n1 ZINC000188191981 1431858817 /nfs/dbraw/zinc/85/88/17/1431858817.db2.gz FWOTYLFAMYXMEZ-UHFFFAOYSA-N 0 0 382.342 3.465 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H](Cc1ccc(F)cc1)C(F)(F)F ZINC000188212358 1431861196 /nfs/dbraw/zinc/86/11/96/1431861196.db2.gz DWILJFMJIYMLRM-CYBMUJFWSA-N 0 0 389.305 3.346 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@H](c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000188218329 1431862006 /nfs/dbraw/zinc/86/20/06/1431862006.db2.gz MSRUSBSMRHMECY-CYBMUJFWSA-N 0 0 395.337 3.304 20 5 GGBDRN Cc1c(NC(=O)C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000188218302 1431862014 /nfs/dbraw/zinc/86/20/14/1431862014.db2.gz MSRUSBSMRHMECY-ZDUSSCGKSA-N 0 0 395.337 3.304 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H](c1ccccc1)C(F)(F)F ZINC000188228363 1431863515 /nfs/dbraw/zinc/86/35/15/1431863515.db2.gz IRBQPOGCHQTCNM-CQSZACIVSA-N 0 0 395.337 3.304 20 5 GGBDRN COc1cc(OC)cc(N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000188230191 1431863747 /nfs/dbraw/zinc/86/37/47/1431863747.db2.gz YMQQZOFPCBDMIW-UHFFFAOYSA-N 0 0 382.376 3.074 20 5 GGBDRN COC(=O)C[C@](C)(NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccccn1 ZINC000188253322 1431865932 /nfs/dbraw/zinc/86/59/32/1431865932.db2.gz OGZRUWUGXZJQEJ-FQEVSTJZSA-N 0 0 385.420 3.322 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccc(-n3nccc3C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000188265436 1431867065 /nfs/dbraw/zinc/86/70/65/1431867065.db2.gz SCKSIXCPROMAQQ-UHFFFAOYSA-N 0 0 394.313 3.337 20 5 GGBDRN COc1c(F)cc(S(=O)(=O)N(C)CC2(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000188265479 1431867070 /nfs/dbraw/zinc/86/70/70/1431867070.db2.gz IHGYBASRKRDZGD-UHFFFAOYSA-N 0 0 394.424 3.095 20 5 GGBDRN CCCCOc1ccc(CNC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1Cl ZINC000188271309 1431867853 /nfs/dbraw/zinc/86/78/53/1431867853.db2.gz OHYPCPXAQQSFML-UHFFFAOYSA-N 0 0 380.832 3.399 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)c1[N+](=O)[O-] ZINC000188270599 1431867905 /nfs/dbraw/zinc/86/79/05/1431867905.db2.gz RMNLWNYXOFZIQL-LLVKDONJSA-N 0 0 394.815 3.344 20 5 GGBDRN CCOC1CC(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000188298490 1431870655 /nfs/dbraw/zinc/87/06/55/1431870655.db2.gz FOLMIUYMPHAZJZ-UHFFFAOYSA-N 0 0 396.387 3.097 20 5 GGBDRN COc1cc(C(=O)NCc2cccc(Cn3ccnc3)c2)cc([N+](=O)[O-])c1C ZINC000188325127 1431873389 /nfs/dbraw/zinc/87/33/89/1431873389.db2.gz IPFABHSXASPORY-UHFFFAOYSA-N 0 0 380.404 3.087 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(COc2ccccc2F)no1 ZINC000188356464 1431876468 /nfs/dbraw/zinc/87/64/68/1431876468.db2.gz UCOHKOFDAXLNLO-NSHDSACASA-N 0 0 386.339 3.187 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2nc3ccccc3n2-c2ccccc2)c1[N+](=O)[O-] ZINC000188369419 1431877810 /nfs/dbraw/zinc/87/78/10/1431877810.db2.gz KMNJDFSBQNVUIK-UHFFFAOYSA-N 0 0 376.376 3.472 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000188371321 1431878268 /nfs/dbraw/zinc/87/82/68/1431878268.db2.gz SIIXAOJAQQNFHB-OAHLLOKOSA-N 0 0 398.868 3.126 20 5 GGBDRN Cc1c(CC(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)cccc1[N+](=O)[O-] ZINC000188384644 1431879686 /nfs/dbraw/zinc/87/96/86/1431879686.db2.gz GOHWFQAQIFZPPH-SFHVURJKSA-N 0 0 376.359 3.324 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1ccc(C(=O)c2cccc(O)c2)cc1 ZINC000188391950 1431880259 /nfs/dbraw/zinc/88/02/59/1431880259.db2.gz ZPLFHMOAQDOFPE-UHFFFAOYSA-N 0 0 376.368 3.461 20 5 GGBDRN COc1cc(C(=O)NC[C@H](C)N2CCc3sccc3C2)cc([N+](=O)[O-])c1C ZINC000188428319 1431883505 /nfs/dbraw/zinc/88/35/05/1431883505.db2.gz FLKRVAKGQWCPFE-LBPRGKRZSA-N 0 0 389.477 3.150 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2ccccc2NC(=O)C[C@H]2C=CCC2)c1[N+](=O)[O-] ZINC000188438196 1431884215 /nfs/dbraw/zinc/88/42/15/1431884215.db2.gz DKNFXOBBLVUXED-LBPRGKRZSA-N 0 0 383.408 3.427 20 5 GGBDRN CC(C)Cn1ncc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1C1CC1 ZINC000188453947 1431885203 /nfs/dbraw/zinc/88/52/03/1431885203.db2.gz FMFUKDIAPJUGOV-UHFFFAOYSA-N 0 0 384.436 3.228 20 5 GGBDRN Cc1nc(-c2c[nH]c(C(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)c2)cs1 ZINC000188465001 1431886366 /nfs/dbraw/zinc/88/63/66/1431886366.db2.gz FQMDCOUYWNUQSF-UHFFFAOYSA-N 0 0 384.417 3.258 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000188477178 1431887435 /nfs/dbraw/zinc/88/74/35/1431887435.db2.gz IZPHVEZRRPQQRQ-RBZFPXEDSA-N 0 0 388.395 3.085 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000188477226 1431887507 /nfs/dbraw/zinc/88/75/07/1431887507.db2.gz IZPHVEZRRPQQRQ-RNODOKPDSA-N 0 0 388.395 3.085 20 5 GGBDRN COc1cc(C(=O)NCCc2nc(C(F)(F)F)cs2)cc([N+](=O)[O-])c1C ZINC000188476523 1431887551 /nfs/dbraw/zinc/88/75/51/1431887551.db2.gz UKVQNBZSBKFWLS-UHFFFAOYSA-N 0 0 389.355 3.360 20 5 GGBDRN COc1cc(C(=O)Nc2ccc(N3CCOCC3)cc2C)cc([N+](=O)[O-])c1C ZINC000188490897 1431888760 /nfs/dbraw/zinc/88/87/60/1431888760.db2.gz MJDGBBGXVPFNJT-UHFFFAOYSA-N 0 0 385.420 3.309 20 5 GGBDRN COc1c(C)ccc(NC(=O)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000188499478 1431889508 /nfs/dbraw/zinc/88/95/08/1431889508.db2.gz UJXXPOYJOKLNTJ-UHFFFAOYSA-N 0 0 397.431 3.350 20 5 GGBDRN COc1c(C)ccc(NC(=O)C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000188504447 1431889903 /nfs/dbraw/zinc/88/99/03/1431889903.db2.gz HGEBLFVOTCCLHM-UHFFFAOYSA-N 0 0 397.431 3.350 20 5 GGBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@](C)(C(=O)OC)c1ccccc1 ZINC000188505097 1431889969 /nfs/dbraw/zinc/88/99/69/1431889969.db2.gz GNMFWXNVZTUYMR-VGOFRKELSA-N 0 0 398.459 3.411 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2=O)cc1 ZINC000188531164 1431892531 /nfs/dbraw/zinc/89/25/31/1431892531.db2.gz KTFOYZLUJTVIOT-QGZVFWFLSA-N 0 0 382.420 3.134 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1 ZINC000188534626 1431892935 /nfs/dbraw/zinc/89/29/35/1431892935.db2.gz DHIAMKRJOSEKRY-UHFFFAOYSA-N 0 0 392.419 3.414 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000188565759 1431895728 /nfs/dbraw/zinc/89/57/28/1431895728.db2.gz RRIMQYAMORSTHK-GOSISDBHSA-N 0 0 376.796 3.109 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000188565781 1431895759 /nfs/dbraw/zinc/89/57/59/1431895759.db2.gz RRIMQYAMORSTHK-SFHVURJKSA-N 0 0 376.796 3.109 20 5 GGBDRN CC(C)Cn1ncc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1C(F)F ZINC000188576945 1431896583 /nfs/dbraw/zinc/89/65/83/1431896583.db2.gz HXFSRWYGXDDNAU-UHFFFAOYSA-N 0 0 394.378 3.288 20 5 GGBDRN Cc1c(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000188577420 1431896720 /nfs/dbraw/zinc/89/67/20/1431896720.db2.gz UFXZLZCKLVQGHJ-UHFFFAOYSA-N 0 0 397.431 3.290 20 5 GGBDRN CCC1(CC)CCN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000188622369 1431905811 /nfs/dbraw/zinc/90/58/11/1431905811.db2.gz RMCZWZQLXGHMJH-UHFFFAOYSA-N 0 0 381.860 3.407 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000188622547 1431906307 /nfs/dbraw/zinc/90/63/07/1431906307.db2.gz BLHLHHSESKDORN-DOMZBBRYSA-N 0 0 393.490 3.440 20 5 GGBDRN Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)C2=O)cc1 ZINC000188624377 1431908190 /nfs/dbraw/zinc/90/81/90/1431908190.db2.gz HZABRSZKAOZGLH-QGZVFWFLSA-N 0 0 382.420 3.134 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000188664825 1431925412 /nfs/dbraw/zinc/92/54/12/1431925412.db2.gz KSFKCWXGTUIREJ-INIZCTEOSA-N 0 0 388.449 3.148 20 5 GGBDRN C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cc(Cl)ccc2F)C1=O ZINC000188665114 1431925448 /nfs/dbraw/zinc/92/54/48/1431925448.db2.gz OBSSNEWGKPGWEK-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2ccc(F)c(Cl)c2)C1=O ZINC000188665191 1431925561 /nfs/dbraw/zinc/92/55/61/1431925561.db2.gz SJNMOZIYDNHRON-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN COc1cc(C(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc([N+](=O)[O-])c1C ZINC000188710113 1431941828 /nfs/dbraw/zinc/94/18/28/1431941828.db2.gz TUTIMHFRJFSFIH-CEXHIMGSSA-N 0 0 390.461 3.482 20 5 GGBDRN COc1cc(C(=O)NCc2cnn(Cc3ccccc3)c2)cc([N+](=O)[O-])c1C ZINC000188750793 1431958234 /nfs/dbraw/zinc/95/82/34/1431958234.db2.gz OKVXSPUCGLQRLA-UHFFFAOYSA-N 0 0 380.404 3.087 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000188759008 1431961613 /nfs/dbraw/zinc/96/16/13/1431961613.db2.gz IBZNAGXZACNESC-GOSISDBHSA-N 0 0 376.796 3.109 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000188766487 1431965729 /nfs/dbraw/zinc/96/57/29/1431965729.db2.gz FIMRUJLGUZLXDE-GOSISDBHSA-N 0 0 376.796 3.109 20 5 GGBDRN COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000188777290 1431969925 /nfs/dbraw/zinc/96/99/25/1431969925.db2.gz MKRFQNLQSCHWHH-RDJZCZTQSA-N 0 0 394.811 3.007 20 5 GGBDRN COC(=O)[C@@](C)(CNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)c1ccccc1 ZINC000188783565 1431972921 /nfs/dbraw/zinc/97/29/21/1431972921.db2.gz GDEKPTQXUYTNCL-NRFANRHFSA-N 0 0 384.432 3.381 20 5 GGBDRN CCO[C@@H]1C[C@](CO)(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1(C)C ZINC000188808176 1431983264 /nfs/dbraw/zinc/98/32/64/1431983264.db2.gz OYKKEVAPDLBLDU-CRAIPNDOSA-N 0 0 378.450 3.105 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000188822161 1431990237 /nfs/dbraw/zinc/99/02/37/1431990237.db2.gz SZJGLTCMOJWJDQ-UHFFFAOYSA-N 0 0 378.392 3.209 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(C3CC3)c3ccccc32)c(Cl)c1 ZINC000188867094 1432001298 /nfs/dbraw/zinc/00/12/98/1432001298.db2.gz GYTXPESUYODVBG-UHFFFAOYSA-N 0 0 393.852 3.426 20 5 GGBDRN CCOC(=O)[C@](C)(CNC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000188913888 1432007676 /nfs/dbraw/zinc/00/76/76/1432007676.db2.gz UPPBEKJAOMOBPD-OAQYLSRUSA-N 0 0 384.432 3.165 20 5 GGBDRN CCSCC[C@H](C)N(C)C(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000188915111 1432008245 /nfs/dbraw/zinc/00/82/45/1432008245.db2.gz VQCCOVJRHQSYPY-STQMWFEESA-N 0 0 399.538 3.251 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(C(=O)c2cccc(O)c2)cc1 ZINC000188947032 1432014379 /nfs/dbraw/zinc/01/43/79/1432014379.db2.gz OXMFLXPKNVMEIU-UHFFFAOYSA-N 0 0 376.368 3.461 20 5 GGBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2nc(-c3ccccc3F)no2)CC1 ZINC000188958398 1432016412 /nfs/dbraw/zinc/01/64/12/1432016412.db2.gz KRHPTCUUKBAEIK-UHFFFAOYSA-N 0 0 383.383 3.106 20 5 GGBDRN C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2ccc(F)c(Cl)c2)C1=O ZINC000188958975 1432016482 /nfs/dbraw/zinc/01/64/82/1432016482.db2.gz QKJAFVIDOJUSDM-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cc(Cl)ccc2F)C1=O ZINC000188958845 1432016569 /nfs/dbraw/zinc/01/65/69/1432016569.db2.gz YFBINAWUGMLGBL-KRWDZBQOSA-N 0 0 377.759 3.355 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)cn2)cc1[N+](=O)[O-] ZINC000189044713 1432033527 /nfs/dbraw/zinc/03/35/27/1432033527.db2.gz CZOVEOXRWVWIFL-UHFFFAOYSA-N 0 0 383.452 3.117 20 5 GGBDRN CCC(CC)C(=O)N1CCC(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CC1 ZINC000189049235 1432034492 /nfs/dbraw/zinc/03/44/92/1432034492.db2.gz ADIQSXLSIWFZQA-UHFFFAOYSA-N 0 0 391.468 3.069 20 5 GGBDRN CS(=O)(=O)c1ccc(NCCNc2ccnc3ccsc32)c([N+](=O)[O-])c1 ZINC000189113697 1432047629 /nfs/dbraw/zinc/04/76/29/1432047629.db2.gz FMPCIILPRDUFHP-UHFFFAOYSA-N 0 0 392.462 3.132 20 5 GGBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC([C@H]2CCCO2)CC1 ZINC000189143770 1432052039 /nfs/dbraw/zinc/05/20/39/1432052039.db2.gz UJEOZXGLFGJVIF-YVEFUNNKSA-N 0 0 381.860 3.466 20 5 GGBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC([C@@H]2CCCO2)CC1 ZINC000189143749 1432052158 /nfs/dbraw/zinc/05/21/58/1432052158.db2.gz UJEOZXGLFGJVIF-PXAZEXFGSA-N 0 0 381.860 3.466 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1 ZINC000189168347 1432057067 /nfs/dbraw/zinc/05/70/67/1432057067.db2.gz NXYVCVZCBDLCGA-UHFFFAOYSA-N 0 0 386.799 3.157 20 5 GGBDRN COc1cc(C(=O)N2CCc3c(cccc3NC(C)=O)C2)cc([N+](=O)[O-])c1C ZINC000189183724 1432059777 /nfs/dbraw/zinc/05/97/77/1432059777.db2.gz LCRJYZNLLQXLER-UHFFFAOYSA-N 0 0 383.404 3.069 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1O[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000189207396 1432063523 /nfs/dbraw/zinc/06/35/23/1432063523.db2.gz BRZGHWLYYAXADP-QGZVFWFLSA-N 0 0 392.358 3.452 20 5 GGBDRN COc1cc(CN2CCOC[C@H]2CC(=O)c2cccs2)c([N+](=O)[O-])cc1F ZINC000189220188 1432065362 /nfs/dbraw/zinc/06/53/62/1432065362.db2.gz PFWYMRMMKVNETC-CYBMUJFWSA-N 0 0 394.424 3.278 20 5 GGBDRN CC(C)c1ccc2c(c1)[C@@H](NC(=O)Cn1c(=O)oc3cc([N+](=O)[O-])ccc31)CC2 ZINC000189222667 1432066089 /nfs/dbraw/zinc/06/60/89/1432066089.db2.gz MZUQBGRHGLUAKG-KRWDZBQOSA-N 0 0 395.415 3.430 20 5 GGBDRN COc1cc(C(=O)NC2CCN(c3cccs3)CC2)cc([N+](=O)[O-])c1C ZINC000189230276 1432067734 /nfs/dbraw/zinc/06/77/34/1432067734.db2.gz NBLLNKLEJXVKAP-UHFFFAOYSA-N 0 0 375.450 3.372 20 5 GGBDRN Cc1csc([C@@H]2COCCN2CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000189256306 1432072628 /nfs/dbraw/zinc/07/26/28/1432072628.db2.gz XKHVTXWXEPGHTC-INIZCTEOSA-N 0 0 390.465 3.070 20 5 GGBDRN CC[C@@]1(CO)CCCN1C(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000189274439 1432075917 /nfs/dbraw/zinc/07/59/17/1432075917.db2.gz GHMQCYUYRUIRNU-MRUHUIDDSA-N 0 0 389.496 3.454 20 5 GGBDRN CC(C)c1nnc2ccc(NC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)cn21 ZINC000189278549 1432077189 /nfs/dbraw/zinc/07/71/89/1432077189.db2.gz HTMOVZIJYSMRKE-UHFFFAOYSA-N 0 0 391.391 3.199 20 5 GGBDRN CC[C@]1(CO)CCCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000189282653 1432078031 /nfs/dbraw/zinc/07/80/31/1432078031.db2.gz WGRSWCMQNBHTGO-MRXNPFEDSA-N 0 0 389.374 3.179 20 5 GGBDRN Cc1csc(CCCCNC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000189287719 1432078862 /nfs/dbraw/zinc/07/88/62/1432078862.db2.gz NIKKLDYSFILUBH-UHFFFAOYSA-N 0 0 390.465 3.155 20 5 GGBDRN CC[C@@]1(C)CN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CCO1 ZINC000189301150 1432081563 /nfs/dbraw/zinc/08/15/63/1432081563.db2.gz JHXPIYAEWKGTQU-FQEVSTJZSA-N 0 0 375.469 3.472 20 5 GGBDRN CSCc1cccc(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000189304815 1432082545 /nfs/dbraw/zinc/08/25/45/1432082545.db2.gz OYOKNRSUJGCZQX-UHFFFAOYSA-N 0 0 383.429 3.229 20 5 GGBDRN Cc1ccc(C)c(-n2cnc(=O)n2[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000189322603 1432086123 /nfs/dbraw/zinc/08/61/23/1432086123.db2.gz XIWRBZKLJSKMIG-OAHLLOKOSA-N 0 0 395.419 3.067 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCC(Cn2cncn2)CC1 ZINC000189325788 1432086492 /nfs/dbraw/zinc/08/64/92/1432086492.db2.gz YDLPNZSRJWUAPM-UHFFFAOYSA-N 0 0 398.345 3.149 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)cc1[N+](=O)[O-] ZINC000189336035 1432088792 /nfs/dbraw/zinc/08/87/92/1432088792.db2.gz TWUOBTROAWDBKB-UHFFFAOYSA-N 0 0 386.383 3.220 20 5 GGBDRN COC(=O)c1cnc(NCc2cccc(COCC(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000189363899 1432094052 /nfs/dbraw/zinc/09/40/52/1432094052.db2.gz HIOAXOLXIRMALF-UHFFFAOYSA-N 0 0 399.325 3.467 20 5 GGBDRN CC[C@H](NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)c1nc(C)cs1 ZINC000189374796 1432095657 /nfs/dbraw/zinc/09/56/57/1432095657.db2.gz AAROPSNSJDIRKC-HNNXBMFYSA-N 0 0 376.438 3.284 20 5 GGBDRN CCOC(=O)[C@@H](C)N(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000189391340 1432097807 /nfs/dbraw/zinc/09/78/07/1432097807.db2.gz QRTGJTCAGQMYPI-LLVKDONJSA-N 0 0 389.433 3.275 20 5 GGBDRN CCOC(=O)[C@H](C)N(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000189391364 1432097908 /nfs/dbraw/zinc/09/79/08/1432097908.db2.gz QRTGJTCAGQMYPI-NSHDSACASA-N 0 0 389.433 3.275 20 5 GGBDRN CCOc1ccc(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1F ZINC000189424949 1432105905 /nfs/dbraw/zinc/10/59/05/1432105905.db2.gz AMGQGHJHYHXOEL-UHFFFAOYSA-N 0 0 375.356 3.327 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000189505027 1432139541 /nfs/dbraw/zinc/13/95/41/1432139541.db2.gz CRIMCEIJNNTGMR-LJQANCHMSA-N 0 0 394.431 3.110 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000189550855 1432156228 /nfs/dbraw/zinc/15/62/28/1432156228.db2.gz VIBARZNZJBMWSW-UHFFFAOYSA-N 0 0 393.403 3.172 20 5 GGBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000189553693 1432156895 /nfs/dbraw/zinc/15/68/95/1432156895.db2.gz UGNSXTNIZNJKCH-UHFFFAOYSA-N 0 0 382.420 3.094 20 5 GGBDRN O=C(N[C@H]1CC[C@H](Cc2ccccc2)C1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000189584344 1432167555 /nfs/dbraw/zinc/16/75/55/1432167555.db2.gz UXFXHNRTTTWARZ-AEFFLSMTSA-N 0 0 391.431 3.317 20 5 GGBDRN CC1(C)CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC(C)(C)O1 ZINC000189591495 1432169489 /nfs/dbraw/zinc/16/94/89/1432169489.db2.gz DFPFCLXZVZSIAS-UHFFFAOYSA-N 0 0 375.469 3.227 20 5 GGBDRN CCN(CCCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1 ZINC000189590379 1432169664 /nfs/dbraw/zinc/16/96/64/1432169664.db2.gz LFZDTKGAPMTFIV-UHFFFAOYSA-N 0 0 377.466 3.327 20 5 GGBDRN CCOC(=O)[C@](C)(CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000189595032 1432171137 /nfs/dbraw/zinc/17/11/37/1432171137.db2.gz GLTATDCPFZJYKF-QVKFZJNVSA-N 0 0 399.447 3.476 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000189601923 1432172474 /nfs/dbraw/zinc/17/24/74/1432172474.db2.gz OFQNDBOSAOWQJK-JKSUJKDBSA-N 0 0 395.415 3.030 20 5 GGBDRN O=C(Nc1ccc(OC2COC2)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000189604478 1432173192 /nfs/dbraw/zinc/17/31/92/1432173192.db2.gz HBLVQYXBBSCAOB-UHFFFAOYSA-N 0 0 383.404 3.225 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1Sc1nnc(CCC2CCCC2)[nH]1 ZINC000189614526 1432177849 /nfs/dbraw/zinc/17/78/49/1432177849.db2.gz ZKVONYIKCQAKHY-UHFFFAOYSA-N 0 0 396.494 3.390 20 5 GGBDRN C[C@H](O)[C@](C)(CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000189647403 1432189955 /nfs/dbraw/zinc/18/99/55/1432189955.db2.gz HMKRWJKWCIJWIE-SJCJKPOMSA-N 0 0 398.506 3.102 20 5 GGBDRN C[C@@H](O)[C@@](C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Cc1ccccc1 ZINC000189650131 1432190324 /nfs/dbraw/zinc/19/03/24/1432190324.db2.gz VGFQKFPXYMGXCK-AUUYWEPGSA-N 0 0 392.477 3.040 20 5 GGBDRN C[C@H](O)[C@@](C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Cc1ccccc1 ZINC000189650110 1432190328 /nfs/dbraw/zinc/19/03/28/1432190328.db2.gz VGFQKFPXYMGXCK-IFXJQAMLSA-N 0 0 392.477 3.040 20 5 GGBDRN CC(C)(NC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(OC(F)(F)F)cc1 ZINC000189649684 1432190384 /nfs/dbraw/zinc/19/03/84/1432190384.db2.gz DNFCYWWFZZDADC-UHFFFAOYSA-N 0 0 386.330 3.132 20 5 GGBDRN COc1cc(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)cc([N+](=O)[O-])c1C ZINC000189655785 1432193153 /nfs/dbraw/zinc/19/31/53/1432193153.db2.gz YKTHGZTUFIJTHN-QGZVFWFLSA-N 0 0 386.448 3.444 20 5 GGBDRN CCOC(=O)[C@H](NCc1ccc(C)c([N+](=O)[O-])c1)c1ccc(OC)c(F)c1 ZINC000189675278 1432199498 /nfs/dbraw/zinc/19/94/98/1432199498.db2.gz XWDLUSZDVQSNIO-GOSISDBHSA-N 0 0 376.384 3.445 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000189680620 1432201794 /nfs/dbraw/zinc/20/17/94/1432201794.db2.gz HDORRCZLLNPDRK-GOSISDBHSA-N 0 0 394.435 3.325 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000189695499 1432206845 /nfs/dbraw/zinc/20/68/45/1432206845.db2.gz QPOZZSZJAPLWIV-QGZVFWFLSA-N 0 0 394.435 3.244 20 5 GGBDRN Cc1nn(C)c(C(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)c[nH]2)c1[N+](=O)[O-] ZINC000189697524 1432207696 /nfs/dbraw/zinc/20/76/96/1432207696.db2.gz DMVRHNMPIAEERU-INIZCTEOSA-N 0 0 394.435 3.394 20 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ZINC000189750042 1432223378 /nfs/dbraw/zinc/22/33/78/1432223378.db2.gz CYNJUIBYZIDYEC-HNNXBMFYSA-N 0 0 381.454 3.086 20 5 GGBDRN CCCN1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1=O ZINC000189770397 1432230118 /nfs/dbraw/zinc/23/01/18/1432230118.db2.gz KXAMOHFPKRGYHH-UHFFFAOYSA-N 0 0 388.346 3.090 20 5 GGBDRN O=C(c1ccc(C(F)(F)F)c(F)c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000189828296 1432246092 /nfs/dbraw/zinc/24/60/92/1432246092.db2.gz YOIWMUXMIHFWBO-NSHDSACASA-N 0 0 398.316 3.474 20 5 GGBDRN Cc1nn(CCC(=O)N2C[C@@H](C)Oc3c(Cl)cccc32)c(C)c1[N+](=O)[O-] ZINC000189832128 1432248166 /nfs/dbraw/zinc/24/81/66/1432248166.db2.gz ILBVWSKCIZBMFI-SNVBAGLBSA-N 0 0 378.816 3.266 20 5 GGBDRN COc1cc(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)cc([N+](=O)[O-])c1C ZINC000189836895 1432249712 /nfs/dbraw/zinc/24/97/12/1432249712.db2.gz VYBFUDSCPXVMKR-LBPRGKRZSA-N 0 0 396.403 3.495 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC[C@@H](Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000189861845 1432255907 /nfs/dbraw/zinc/25/59/07/1432255907.db2.gz ZHEYSVRZJWYRFQ-QGZVFWFLSA-N 0 0 383.448 3.473 20 5 GGBDRN COC(=O)[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H]1C ZINC000189867424 1432257312 /nfs/dbraw/zinc/25/73/12/1432257312.db2.gz AZUWCTTUXWJINB-KOLCDFICSA-N 0 0 389.330 3.277 20 5 GGBDRN CCN(C[C@@H](O)C(F)(F)F)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000189874698 1432259570 /nfs/dbraw/zinc/25/95/70/1432259570.db2.gz VMUHSDFFTYVVIY-GFCCVEGCSA-N 0 0 389.355 3.104 20 5 GGBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](COCc2ccccc2)C1 ZINC000189889898 1432264600 /nfs/dbraw/zinc/26/46/00/1432264600.db2.gz OGFVUFKNMORDHA-MRXNPFEDSA-N 0 0 390.461 3.041 20 5 GGBDRN Cc1c([N+](=O)[O-])cc(S(=O)(=O)N(C)[C@H](C)c2ccco2)c(C)c1[N+](=O)[O-] ZINC000189911094 1432271104 /nfs/dbraw/zinc/27/11/04/1432271104.db2.gz RMXGXVUBXPNXRV-LLVKDONJSA-N 0 0 383.382 3.095 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)Nc1ccc2ccn(C)c2c1 ZINC000189919683 1432274415 /nfs/dbraw/zinc/27/44/15/1432274415.db2.gz ZAGVBDRFCWSYFN-UHFFFAOYSA-N 0 0 394.431 3.462 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H](c2nc(C3CC3)no2)C(C)C)c1[N+](=O)[O-] ZINC000189941609 1432282621 /nfs/dbraw/zinc/28/26/21/1432282621.db2.gz MBUNVBLJCZQZJM-ZDUSSCGKSA-N 0 0 394.453 3.148 20 5 GGBDRN COc1ccc(CN(C)c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1O ZINC000190003118 1432302867 /nfs/dbraw/zinc/30/28/67/1432302867.db2.gz QTEXXIRDFUXBPD-UHFFFAOYSA-N 0 0 385.420 3.181 20 5 GGBDRN O=C([C@H]1CCCc2c(O)cccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000190007504 1432303868 /nfs/dbraw/zinc/30/38/68/1432303868.db2.gz SCRZWYHDODRMDG-KRWDZBQOSA-N 0 0 381.432 3.069 20 5 GGBDRN COC(=O)c1cc(C(=O)N(Cc2c(F)cccc2F)C2CC2)cc([N+](=O)[O-])c1 ZINC000190011272 1432304518 /nfs/dbraw/zinc/30/45/18/1432304518.db2.gz XQEQYYUZZQADQP-UHFFFAOYSA-N 0 0 390.342 3.464 20 5 GGBDRN CCOC1CC(CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000190010098 1432304534 /nfs/dbraw/zinc/30/45/34/1432304534.db2.gz XTYDVKLEGHTKLH-UHFFFAOYSA-N 0 0 375.469 3.133 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1 ZINC000190029771 1432307726 /nfs/dbraw/zinc/30/77/26/1432307726.db2.gz GWXHWEUUBWANHM-ZUZCIYMTSA-N 0 0 391.346 3.209 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1 ZINC000190029787 1432307970 /nfs/dbraw/zinc/30/79/70/1432307970.db2.gz GWXHWEUUBWANHM-BMIGLBTASA-N 0 0 391.346 3.209 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1c[nH]nc1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000190034315 1432308495 /nfs/dbraw/zinc/30/84/95/1432308495.db2.gz GDXKEKGRXUPKBY-OAHLLOKOSA-N 0 0 386.408 3.008 20 5 GGBDRN CC[C@@H](C)Oc1cc(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)ccn1 ZINC000190046722 1432310212 /nfs/dbraw/zinc/31/02/12/1432310212.db2.gz OYHPBCOZPGVMJX-GFCCVEGCSA-N 0 0 379.438 3.183 20 5 GGBDRN COc1cc(CN2CC[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000190061218 1432312663 /nfs/dbraw/zinc/31/26/63/1432312663.db2.gz OZPIXMBTKRCKGV-KXBFYZLASA-N 0 0 386.448 3.385 20 5 GGBDRN COc1cc(CN2CC[C@H](O)[C@H](C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000190061202 1432312766 /nfs/dbraw/zinc/31/27/66/1432312766.db2.gz OZPIXMBTKRCKGV-BEFAXECRSA-N 0 0 386.448 3.385 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCO[C@@](C)(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000190072762 1432314577 /nfs/dbraw/zinc/31/45/77/1432314577.db2.gz HUTRKPDHNOKQEZ-LJQANCHMSA-N 0 0 390.461 3.148 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)NC[C@H](C[C@H](C)O)c2ccccc2)c1[N+](=O)[O-] ZINC000190072630 1432314615 /nfs/dbraw/zinc/31/46/15/1432314615.db2.gz GFNBYGJWISJAGU-RDJZCZTQSA-N 0 0 392.477 3.045 20 5 GGBDRN CC(C)c1ccc(CNc2cccc(C(=O)N3CCC[C@@H]3CO)n2)cc1[N+](=O)[O-] ZINC000190077202 1432315261 /nfs/dbraw/zinc/31/52/61/1432315261.db2.gz BAAMWKICAPIIOU-MRXNPFEDSA-N 0 0 398.463 3.322 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c1[N+](=O)[O-] ZINC000190086373 1432317516 /nfs/dbraw/zinc/31/75/16/1432317516.db2.gz GBXUSVVDIJTGCX-UHFFFAOYSA-N 0 0 377.404 3.284 20 5 GGBDRN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000190086996 1432317648 /nfs/dbraw/zinc/31/76/48/1432317648.db2.gz HIKVZXFEWOXVSK-DIFFPNOSSA-N 0 0 375.812 3.433 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 ZINC000190097381 1432319295 /nfs/dbraw/zinc/31/92/95/1432319295.db2.gz KCDXJTKXSQZSJC-BFRYPLHYSA-N 0 0 384.436 3.251 20 5 GGBDRN CCc1ccc([C@@H]2CN(C(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CCO2)cc1 ZINC000190105183 1432320359 /nfs/dbraw/zinc/32/03/59/1432320359.db2.gz NBDFKQNMAYTCTA-IBGZPJMESA-N 0 0 397.431 3.004 20 5 GGBDRN CCc1ccc([C@H]2CN(C(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CCO2)cc1 ZINC000190105206 1432320487 /nfs/dbraw/zinc/32/04/87/1432320487.db2.gz NBDFKQNMAYTCTA-LJQANCHMSA-N 0 0 397.431 3.004 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N(CC(C)(C)O)C3CC3)cc2[N+](=O)[O-])CC1 ZINC000190113033 1432322047 /nfs/dbraw/zinc/32/20/47/1432322047.db2.gz VELCZVWIXIJSNA-UHFFFAOYSA-N 0 0 375.469 3.207 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC(F)F ZINC000190116887 1432322871 /nfs/dbraw/zinc/32/28/71/1432322871.db2.gz SSIDNJXMRCGWOM-UHFFFAOYSA-N 0 0 379.319 3.390 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N(CCc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000190162866 1432330779 /nfs/dbraw/zinc/33/07/79/1432330779.db2.gz MRCOPLLJQRKUCB-UHFFFAOYSA-N 0 0 385.395 3.215 20 5 GGBDRN COC(=O)c1cnc(NC[C@H](c2ccccc2Cl)N(C)C)c([N+](=O)[O-])c1 ZINC000190164660 1432331631 /nfs/dbraw/zinc/33/16/31/1432331631.db2.gz FGGYBIIWATVYHN-OAHLLOKOSA-N 0 0 378.816 3.145 20 5 GGBDRN Cc1c(NC(=O)C(=O)N(CCc2cccc(F)c2)C2CC2)cccc1[N+](=O)[O-] ZINC000190168801 1432332480 /nfs/dbraw/zinc/33/24/80/1432332480.db2.gz SOPJHZNMPMDLCT-UHFFFAOYSA-N 0 0 385.395 3.215 20 5 GGBDRN COC(=O)c1ccc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c(N(C)C)c1 ZINC000190182478 1432335230 /nfs/dbraw/zinc/33/52/30/1432335230.db2.gz DMFIUSIJAPCYBS-NSHDSACASA-N 0 0 389.383 3.329 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(CC(F)(F)F)cc1 ZINC000190198012 1432339051 /nfs/dbraw/zinc/33/90/51/1432339051.db2.gz WKHAYQKIPNJVOX-UHFFFAOYSA-N 0 0 397.309 3.285 20 5 GGBDRN O=C(N[C@H]1CCCc2c(O)cccc21)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000190207702 1432341292 /nfs/dbraw/zinc/34/12/92/1432341292.db2.gz AMWBCENOSAYCDD-KRWDZBQOSA-N 0 0 378.388 3.294 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)cc1[N+](=O)[O-] ZINC000190258985 1432350168 /nfs/dbraw/zinc/35/01/68/1432350168.db2.gz XCJOORAWJSJYIR-YJBOKZPZSA-N 0 0 385.464 3.334 20 5 GGBDRN Cc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnn1Cc1ccc(F)cc1F ZINC000190265770 1432350686 /nfs/dbraw/zinc/35/06/86/1432350686.db2.gz QWGQORHEBITWEN-UHFFFAOYSA-N 0 0 387.346 3.382 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2c(F)cccc2F)C2CC2)c(F)c1 ZINC000190281309 1432352908 /nfs/dbraw/zinc/35/29/08/1432352908.db2.gz XURPODSAOSGWGS-UHFFFAOYSA-N 0 0 386.351 3.365 20 5 GGBDRN COc1cc(S(=O)(=O)N(Cc2c(F)cccc2F)C2CC2)ccc1[N+](=O)[O-] ZINC000190282411 1432352956 /nfs/dbraw/zinc/35/29/56/1432352956.db2.gz SVGHWUMLWFUUHR-UHFFFAOYSA-N 0 0 398.387 3.235 20 5 GGBDRN CCc1ccc([C@@H]2CN(CC(=O)Nc3ccc([N+](=O)[O-])cc3C)CCO2)cc1 ZINC000190283126 1432352968 /nfs/dbraw/zinc/35/29/68/1432352968.db2.gz RQJFQJOGHPWKOM-FQEVSTJZSA-N 0 0 383.448 3.478 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1c(F)cccc1F)C1CC1 ZINC000190286870 1432353620 /nfs/dbraw/zinc/35/36/20/1432353620.db2.gz TYBCHMUHGUUNGH-UHFFFAOYSA-N 0 0 398.387 3.235 20 5 GGBDRN COc1cc(OC)cc([C@@H](Nc2ncc([N+](=O)[O-])s2)c2nccn2C)c1 ZINC000190309461 1432357748 /nfs/dbraw/zinc/35/77/48/1432357748.db2.gz IWWJOMFLRBTRTA-CQSZACIVSA-N 0 0 375.410 3.004 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCCc3c(O)cccc32)c2ncccc12 ZINC000190339496 1432364156 /nfs/dbraw/zinc/36/41/56/1432364156.db2.gz LDTHXRUEJJYRKT-HNNXBMFYSA-N 0 0 399.428 3.205 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCCc3c(O)cccc32)c2ncccc12 ZINC000190339511 1432364166 /nfs/dbraw/zinc/36/41/66/1432364166.db2.gz LDTHXRUEJJYRKT-OAHLLOKOSA-N 0 0 399.428 3.205 20 5 GGBDRN COc1cc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000190347347 1432365435 /nfs/dbraw/zinc/36/54/35/1432365435.db2.gz ISQKNUZJSGPMQU-BZPMIXESSA-N 0 0 390.358 3.202 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000190379825 1432369967 /nfs/dbraw/zinc/36/99/67/1432369967.db2.gz CTQDYSWTVMXGSZ-UHFFFAOYSA-N 0 0 391.449 3.221 20 5 GGBDRN COc1cc(C(=O)N[C@@H](c2cnn(C)c2)c2ccc(F)cc2)cc([N+](=O)[O-])c1C ZINC000190379314 1432370077 /nfs/dbraw/zinc/37/00/77/1432370077.db2.gz HFUXQLGSXSETQS-LJQANCHMSA-N 0 0 398.394 3.304 20 5 GGBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCN(c2cncc3ccccc32)CC1 ZINC000190383622 1432371076 /nfs/dbraw/zinc/37/10/76/1432371076.db2.gz XPUIOAHOJHSKBW-UHFFFAOYSA-N 0 0 380.379 3.245 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3cncc4ccccc43)CC2)c1 ZINC000190383761 1432371172 /nfs/dbraw/zinc/37/11/72/1432371172.db2.gz VMVYXSVSFDPOND-UHFFFAOYSA-N 0 0 392.415 3.114 20 5 GGBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2cncc3ccccc32)CC1 ZINC000190389455 1432372227 /nfs/dbraw/zinc/37/22/27/1432372227.db2.gz QYDOFUVVAVFVJB-UHFFFAOYSA-N 0 0 376.416 3.414 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000190395249 1432373177 /nfs/dbraw/zinc/37/31/77/1432373177.db2.gz VKXOXKUZGPHHRG-LJQANCHMSA-N 0 0 392.477 3.166 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000190395231 1432373211 /nfs/dbraw/zinc/37/32/11/1432373211.db2.gz VKXOXKUZGPHHRG-IBGZPJMESA-N 0 0 392.477 3.166 20 5 GGBDRN COC(=O)[C@@H](C)N(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCC1 ZINC000190399295 1432373730 /nfs/dbraw/zinc/37/37/30/1432373730.db2.gz IPPVJZLSRPDGPR-LLVKDONJSA-N 0 0 389.433 3.275 20 5 GGBDRN COC(=O)[C@H](C)N(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCC1 ZINC000190399274 1432373873 /nfs/dbraw/zinc/37/38/73/1432373873.db2.gz IPPVJZLSRPDGPR-NSHDSACASA-N 0 0 389.433 3.275 20 5 GGBDRN COc1cc(C(=O)NCc2cc(COC(C)(C)C)on2)cc([N+](=O)[O-])c1C ZINC000190403748 1432374735 /nfs/dbraw/zinc/37/47/35/1432374735.db2.gz AOVHINMQDOTWQM-UHFFFAOYSA-N 0 0 377.397 3.145 20 5 GGBDRN CCc1ccc([C@H]2CN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])CCO2)cc1 ZINC000190408761 1432375521 /nfs/dbraw/zinc/37/55/21/1432375521.db2.gz VVGZENMAAQLESG-LJQANCHMSA-N 0 0 390.461 3.061 20 5 GGBDRN CCc1ccc([C@H]2CN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CCO2)cc1 ZINC000190409508 1432375967 /nfs/dbraw/zinc/37/59/67/1432375967.db2.gz BDPRYMVGLMAWFH-LJQANCHMSA-N 0 0 390.461 3.061 20 5 GGBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000190414983 1432377032 /nfs/dbraw/zinc/37/70/32/1432377032.db2.gz OCZCYCJIISVBRG-UGSOOPFHSA-N 0 0 385.424 3.028 20 5 GGBDRN CC(C)c1ccc(C(=O)Nc2ccc(F)cc2NS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000190416602 1432377385 /nfs/dbraw/zinc/37/73/85/1432377385.db2.gz IVYMMURBJAHPQE-UHFFFAOYSA-N 0 0 395.412 3.481 20 5 GGBDRN Cc1nn(CCC(=O)N2CCCSc3ccc(F)cc32)c(C)c1[N+](=O)[O-] ZINC000190417541 1432377919 /nfs/dbraw/zinc/37/79/19/1432377919.db2.gz IMDJIGNGZCPZGH-UHFFFAOYSA-N 0 0 378.429 3.466 20 5 GGBDRN CNS(=O)(=O)c1cc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)ccc1C ZINC000190472159 1432388078 /nfs/dbraw/zinc/38/80/78/1432388078.db2.gz XFHDCPWGTYUAIH-UHFFFAOYSA-N 0 0 391.449 3.187 20 5 GGBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1c[nH]c(=O)c2ccccc12 ZINC000190496625 1432392311 /nfs/dbraw/zinc/39/23/11/1432392311.db2.gz WDYIYOAEQACZKW-UHFFFAOYSA-N 0 0 375.344 3.079 20 5 GGBDRN Cc1ccccc1C[C@@H](CO)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000190500747 1432393517 /nfs/dbraw/zinc/39/35/17/1432393517.db2.gz SRZYIRJLJHWEHN-INIZCTEOSA-N 0 0 397.456 3.360 20 5 GGBDRN Cc1ccccc1C[C@H](CO)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000190521457 1432397458 /nfs/dbraw/zinc/39/74/58/1432397458.db2.gz ZHRMUAZAZRIOMC-OAHLLOKOSA-N 0 0 394.880 3.369 20 5 GGBDRN Cc1ccccc1C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000190538825 1432400382 /nfs/dbraw/zinc/40/03/82/1432400382.db2.gz YCRZQWHXGDTWDK-OAHLLOKOSA-N 0 0 382.338 3.255 20 5 GGBDRN COc1cc(C(=O)N(C)CC(=O)Nc2c(C)cccc2C)cc([N+](=O)[O-])c1C ZINC000190567222 1432408396 /nfs/dbraw/zinc/40/83/96/1432408396.db2.gz SFMALQZBNZZAMV-UHFFFAOYSA-N 0 0 385.420 3.239 20 5 GGBDRN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000190592291 1432414847 /nfs/dbraw/zinc/41/48/47/1432414847.db2.gz KKJOKORWYQLJIY-UHFFFAOYSA-N 0 0 399.422 3.456 20 5 GGBDRN Cc1ccccc1C[C@@H](CO)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000190630151 1432425537 /nfs/dbraw/zinc/42/55/37/1432425537.db2.gz DBZCODKAOLUCLS-INIZCTEOSA-N 0 0 397.456 3.360 20 5 GGBDRN Cc1ccccc1C[C@H](CO)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000190635765 1432428006 /nfs/dbraw/zinc/42/80/06/1432428006.db2.gz CANMIBDHDQISJK-MRXNPFEDSA-N 0 0 392.839 3.045 20 5 GGBDRN O=C(N1CCN(c2cccc([N+](=O)[O-])c2)CC1)C1(Cc2ccccc2F)CC1 ZINC000190643421 1432430007 /nfs/dbraw/zinc/43/00/07/1432430007.db2.gz GKTFXRNEXRYGKI-UHFFFAOYSA-N 0 0 383.423 3.405 20 5 GGBDRN O=C(NCCN1CCc2ccccc2C1=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000190653119 1432431090 /nfs/dbraw/zinc/43/10/90/1432431090.db2.gz HPZIADWUCVBWAN-UHFFFAOYSA-N 0 0 395.440 3.238 20 5 GGBDRN CC[C@](C)(O)CN(Cc1ccccc1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000190658102 1432433548 /nfs/dbraw/zinc/43/35/48/1432433548.db2.gz ZAUIYSOKJPUDED-IBGZPJMESA-N 0 0 392.477 3.255 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000190659531 1432434543 /nfs/dbraw/zinc/43/45/43/1432434543.db2.gz JLKSZDOFOLWXFY-LJQANCHMSA-N 0 0 392.477 3.255 20 5 GGBDRN COc1ccc(OC[C@@H](O)COc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000190670551 1432438758 /nfs/dbraw/zinc/43/87/58/1432438758.db2.gz RBDIQQKSYQKEDD-LLVKDONJSA-N 0 0 387.310 3.441 20 5 GGBDRN CC1(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC(C)(C)O1 ZINC000190719043 1432454978 /nfs/dbraw/zinc/45/49/78/1432454978.db2.gz JCKFQEASSZPAFY-UHFFFAOYSA-N 0 0 396.387 3.192 20 5 GGBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000190776206 1432475461 /nfs/dbraw/zinc/47/54/61/1432475461.db2.gz NJRRCCYZUJMZHW-UKRRQHHQSA-N 0 0 391.468 3.069 20 5 GGBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])c([O-])c2)cc(N2CC[NH+](C(C)C)CC2)c1 ZINC000190794195 1432482669 /nfs/dbraw/zinc/48/26/69/1432482669.db2.gz AGCSNCQNFFLHIS-UHFFFAOYSA-N 0 0 398.463 3.392 20 5 GGBDRN CCCc1cnc(NC(=O)C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000190798154 1432484145 /nfs/dbraw/zinc/48/41/45/1432484145.db2.gz NGXGLOYLHQMBKR-UHFFFAOYSA-N 0 0 388.449 3.134 20 5 GGBDRN COc1cc(C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc([N+](=O)[O-])c1C ZINC000190799616 1432485044 /nfs/dbraw/zinc/48/50/44/1432485044.db2.gz DRKHPGFTWIXMMB-UHFFFAOYSA-N 0 0 389.383 3.140 20 5 GGBDRN O=[N+]([O-])c1cc(Cl)ccc1N(CCCN1CCOCC1)Cc1ccncc1 ZINC000190880883 1432517415 /nfs/dbraw/zinc/51/74/15/1432517415.db2.gz NYFLFBQTEQDXHL-UHFFFAOYSA-N 0 0 390.871 3.372 20 5 GGBDRN CS(=O)(=O)c1ccc(NCCc2ccccc2OC(F)F)c([N+](=O)[O-])c1 ZINC000190906816 1432526040 /nfs/dbraw/zinc/52/60/40/1432526040.db2.gz VHCQEUAPLQUAES-UHFFFAOYSA-N 0 0 386.376 3.254 20 5 GGBDRN CCCCc1nnc(NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000190947947 1432535858 /nfs/dbraw/zinc/53/58/58/1432535858.db2.gz QCLGRHHWMQCMRF-UHFFFAOYSA-N 0 0 377.426 3.084 20 5 GGBDRN Cc1ccc(C[C@@H](CO)NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000190959724 1432538117 /nfs/dbraw/zinc/53/81/17/1432538117.db2.gz DAFZYXPANNFZAX-HNNXBMFYSA-N 0 0 382.338 3.255 20 5 GGBDRN COc1ccc(NC(=O)[C@H](C)N2CC3(CCCC3)OC(C)(C)C2)c([N+](=O)[O-])c1 ZINC000190973404 1432541026 /nfs/dbraw/zinc/54/10/26/1432541026.db2.gz UQMLNTAFWXYHDN-AWEZNQCLSA-N 0 0 391.468 3.354 20 5 GGBDRN COc1ccc(OC(=O)C2(c3ccc(F)cc3)CCOCC2)cc1[N+](=O)[O-] ZINC000191009634 1432548983 /nfs/dbraw/zinc/54/89/83/1432548983.db2.gz PSQGULWRYOYDSZ-UHFFFAOYSA-N 0 0 375.352 3.396 20 5 GGBDRN O=C(Nc1ccccc1N1CCCC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191009394 1432549127 /nfs/dbraw/zinc/54/91/27/1432549127.db2.gz KBDBZEYOQYJBHJ-UHFFFAOYSA-N 0 0 382.420 3.490 20 5 GGBDRN COc1ccc(OC(=O)CCc2nc(-c3ccsc3)no2)cc1[N+](=O)[O-] ZINC000191012466 1432549441 /nfs/dbraw/zinc/54/94/41/1432549441.db2.gz PPXWZYCKTXJRFU-UHFFFAOYSA-N 0 0 375.362 3.253 20 5 GGBDRN CC(C)(C)Cc1cc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n[nH]1 ZINC000191030162 1432552986 /nfs/dbraw/zinc/55/29/86/1432552986.db2.gz SIMRLJFSZRVCTM-UHFFFAOYSA-N 0 0 379.804 3.137 20 5 GGBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000191051222 1432557730 /nfs/dbraw/zinc/55/77/30/1432557730.db2.gz JEKIICBAKJMPQK-UHFFFAOYSA-N 0 0 395.337 3.485 20 5 GGBDRN O=C(CC1CCC2(CC1)OCCO2)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000191053519 1432558099 /nfs/dbraw/zinc/55/80/99/1432558099.db2.gz VLDAREHLVVZZKB-UHFFFAOYSA-N 0 0 386.408 3.042 20 5 GGBDRN CCC[C@@H](C)c1cc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n[nH]1 ZINC000191070957 1432561573 /nfs/dbraw/zinc/56/15/73/1432561573.db2.gz KZJSTDJWTRRSRN-SECBINFHSA-N 0 0 379.804 3.452 20 5 GGBDRN O=C(Nc1ccc(-n2cccn2)cc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191077180 1432562889 /nfs/dbraw/zinc/56/28/89/1432562889.db2.gz RTMURMCZBAJSDO-UHFFFAOYSA-N 0 0 379.376 3.076 20 5 GGBDRN CCc1cc(O)ccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000191090502 1432565492 /nfs/dbraw/zinc/56/54/92/1432565492.db2.gz BRDZHSIHABCQCV-IBGZPJMESA-N 0 0 397.431 3.415 20 5 GGBDRN Cc1cccc(C[C@H](CO)NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000191096629 1432567220 /nfs/dbraw/zinc/56/72/20/1432567220.db2.gz NUDAVNZBMOCTCM-MRXNPFEDSA-N 0 0 397.456 3.360 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)Nc2ccc(N3C[C@H]4CC[C@@H]3C4)cc2)cc1[N+](=O)[O-] ZINC000191104620 1432568874 /nfs/dbraw/zinc/56/88/74/1432568874.db2.gz IHKSCMVUGNVCHZ-KBXCAEBGSA-N 0 0 394.431 3.469 20 5 GGBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000191134265 1432573897 /nfs/dbraw/zinc/57/38/97/1432573897.db2.gz XJXAVFHVOPQFQQ-LLVKDONJSA-N 0 0 383.832 3.378 20 5 GGBDRN Cc1cccc(C[C@@H](CO)NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000191138489 1432574832 /nfs/dbraw/zinc/57/48/32/1432574832.db2.gz IZXYHYOXOBYKHH-HNNXBMFYSA-N 0 0 382.338 3.255 20 5 GGBDRN C[C@H](C(=O)N1CCC(Oc2ccc(F)nc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000191153128 1432577527 /nfs/dbraw/zinc/57/75/27/1432577527.db2.gz IDIPKRONOJKYPG-LBPRGKRZSA-N 0 0 391.374 3.442 20 5 GGBDRN C[C@@H](Oc1ccc(C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1)c1ccccc1 ZINC000191201279 1432589854 /nfs/dbraw/zinc/58/98/54/1432589854.db2.gz MBMOYWBVIHUVKS-OAHLLOKOSA-N 0 0 380.404 3.361 20 5 GGBDRN COCCNc1ccccc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000191207934 1432591633 /nfs/dbraw/zinc/59/16/33/1432591633.db2.gz MSTQDUPZRMHQQK-UHFFFAOYSA-N 0 0 381.392 3.091 20 5 GGBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCC1(c2cccc(Cl)c2F)CCCC1 ZINC000191206653 1432591828 /nfs/dbraw/zinc/59/18/28/1432591828.db2.gz PLYDYOXKPWVQHO-UHFFFAOYSA-N 0 0 380.807 3.363 20 5 GGBDRN COc1cc(-c2nc(CC(=O)Nc3ccc(C)cc3)no2)cc([N+](=O)[O-])c1C ZINC000191221059 1432595606 /nfs/dbraw/zinc/59/56/06/1432595606.db2.gz MULSKMWSYTUXKR-UHFFFAOYSA-N 0 0 382.376 3.451 20 5 GGBDRN Cc1cccc(C[C@@H](CO)NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000191242825 1432602551 /nfs/dbraw/zinc/60/25/51/1432602551.db2.gz AAEBYZCORFUKLE-INIZCTEOSA-N 0 0 392.839 3.045 20 5 GGBDRN Cc1ccc(-n2cc(NC(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3C)cn2)c(C)c1 ZINC000191262092 1432611345 /nfs/dbraw/zinc/61/13/45/1432611345.db2.gz VEUAKOAHRDVSMF-UHFFFAOYSA-N 0 0 393.403 3.283 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)NC[C@@H]3CC[C@H](O)C3)cc2[N+](=O)[O-])n1 ZINC000191276683 1432618120 /nfs/dbraw/zinc/61/81/20/1432618120.db2.gz XHDLFSORENHFNF-YPMHNXCESA-N 0 0 393.490 3.402 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCCN(Cc2cscn2)CC1 ZINC000191322420 1432632269 /nfs/dbraw/zinc/63/22/69/1432632269.db2.gz XXNICQSAMTYTRD-UHFFFAOYSA-N 0 0 389.481 3.408 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1cccc(CN2CCOCC2)c1 ZINC000191329558 1432634004 /nfs/dbraw/zinc/63/40/04/1432634004.db2.gz JNYQSACZZGXIPN-UHFFFAOYSA-N 0 0 398.463 3.366 20 5 GGBDRN CCc1cc(N2CCC[C@@H](NC(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)C2)ncn1 ZINC000191332083 1432634731 /nfs/dbraw/zinc/63/47/31/1432634731.db2.gz WDDJDOZYHGGXQH-MRXNPFEDSA-N 0 0 398.467 3.355 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC[C@@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000191341492 1432637220 /nfs/dbraw/zinc/63/72/20/1432637220.db2.gz IMZOWNXRBAEXTF-IXDOHACOSA-N 0 0 390.484 3.317 20 5 GGBDRN Cc1nc(CN2CCN(C(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)CC2)cs1 ZINC000191351869 1432638739 /nfs/dbraw/zinc/63/87/39/1432638739.db2.gz SXQUFPVLNUAPPL-UHFFFAOYSA-N 0 0 389.481 3.326 20 5 GGBDRN Cc1cnc(COC(=O)CCc2nnc(-c3ccsc3)o2)c(C)c1[N+](=O)[O-] ZINC000191358282 1432640107 /nfs/dbraw/zinc/64/01/07/1432640107.db2.gz HYJOQQPQKKFXOH-UHFFFAOYSA-N 0 0 388.405 3.394 20 5 GGBDRN CCCC1CCC(N(C)C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000191370560 1432643706 /nfs/dbraw/zinc/64/37/06/1432643706.db2.gz PCSSGHQBIZCONA-UHFFFAOYSA-N 0 0 377.441 3.359 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC(OC[C@H]2CCCO2)CC1 ZINC000191372571 1432644083 /nfs/dbraw/zinc/64/40/83/1432644083.db2.gz CYGSOYNHCNQHNR-MRXNPFEDSA-N 0 0 377.441 3.404 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](CC(C)C)N1CCOCC1 ZINC000191391849 1432649828 /nfs/dbraw/zinc/64/98/28/1432649828.db2.gz LPTCDUUYDYGPPB-INIZCTEOSA-N 0 0 378.473 3.080 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](c1ccccc1)N1CCOCC1 ZINC000191392351 1432650173 /nfs/dbraw/zinc/65/01/73/1432650173.db2.gz GFDYLFPUGLCFRI-FQEVSTJZSA-N 0 0 398.463 3.407 20 5 GGBDRN COC(=O)[C@](C)(CNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)c1ccccc1 ZINC000191402471 1432654492 /nfs/dbraw/zinc/65/44/92/1432654492.db2.gz VYSDCDFODZUBEE-HXUWFJFHSA-N 0 0 385.420 3.464 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC1CCN(C(=O)CC(C)C)CC1 ZINC000191407117 1432655304 /nfs/dbraw/zinc/65/53/04/1432655304.db2.gz FDTPKOKJBCDLJP-UHFFFAOYSA-N 0 0 376.457 3.370 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C[S@@](C)=O)c1ccccc1 ZINC000191410348 1432656336 /nfs/dbraw/zinc/65/63/36/1432656336.db2.gz BEDMDMGPOAOTRN-YHAMSUFESA-N 0 0 375.450 3.453 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCN1CCc2ccccc2C1=O ZINC000191414542 1432657042 /nfs/dbraw/zinc/65/70/42/1432657042.db2.gz GDUDFLIVXLCNTP-UHFFFAOYSA-N 0 0 382.420 3.032 20 5 GGBDRN CS(=O)(=O)c1cc(NC(=O)CCNc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000191449940 1432663844 /nfs/dbraw/zinc/66/38/44/1432663844.db2.gz MBHVVGJMZQWARX-UHFFFAOYSA-N 0 0 397.840 3.092 20 5 GGBDRN COC[C@@H](Cc1ccccc1)N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000191472006 1432667692 /nfs/dbraw/zinc/66/76/92/1432667692.db2.gz OQOZJSSXKFNUTA-MRXNPFEDSA-N 0 0 391.855 3.376 20 5 GGBDRN COc1cc(C(=O)N2CCc3cc(Cl)ccc3C2)c([N+](=O)[O-])cc1OC ZINC000191479392 1432669556 /nfs/dbraw/zinc/66/95/56/1432669556.db2.gz YSWKSPVVORENHD-UHFFFAOYSA-N 0 0 376.796 3.464 20 5 GGBDRN COC[C@H](Cc1ccccc1)N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191491002 1432670987 /nfs/dbraw/zinc/67/09/87/1432670987.db2.gz ABTYLTTUMGSYDM-SFHVURJKSA-N 0 0 382.420 3.334 20 5 GGBDRN CC(C)C[C@@]1(CO)CCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000191510773 1432676340 /nfs/dbraw/zinc/67/63/40/1432676340.db2.gz SSZIYPJJDAYCFT-HXUWFJFHSA-N 0 0 375.469 3.208 20 5 GGBDRN C[C@H](Nc1ccc(C(=O)NCCOCC(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000191517795 1432677400 /nfs/dbraw/zinc/67/74/00/1432677400.db2.gz CRMVATWGAMVVPH-LBPRGKRZSA-N 0 0 394.378 3.174 20 5 GGBDRN COc1cc(OCC(=O)N2CCc3cc(Cl)ccc3C2)ccc1[N+](=O)[O-] ZINC000191519695 1432677756 /nfs/dbraw/zinc/67/77/56/1432677756.db2.gz WNFAFPZLTOEBKO-UHFFFAOYSA-N 0 0 376.796 3.221 20 5 GGBDRN O=C(Nc1cccc(OCCF)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000191527123 1432678444 /nfs/dbraw/zinc/67/84/44/1432678444.db2.gz QQYWSJWKKHSAFQ-UHFFFAOYSA-N 0 0 375.356 3.238 20 5 GGBDRN Cc1c(C(=O)Nc2cccc3ccn(C)c32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000191582263 1432687497 /nfs/dbraw/zinc/68/74/97/1432687497.db2.gz QHQVXHYHWSQLGX-UHFFFAOYSA-N 0 0 376.376 3.228 20 5 GGBDRN CC(C)Oc1ccc(N(C)C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000191607827 1432691771 /nfs/dbraw/zinc/69/17/71/1432691771.db2.gz NVMJVZZSEUFBQF-UHFFFAOYSA-N 0 0 381.392 3.239 20 5 GGBDRN C[C@H]1CN(c2ccccc2F)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000191618399 1432693912 /nfs/dbraw/zinc/69/39/12/1432693912.db2.gz MHFIZMRFZNCONL-AWEZNQCLSA-N 0 0 387.411 3.311 20 5 GGBDRN C[C@@H]1CN(c2ccccc2F)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191627202 1432695835 /nfs/dbraw/zinc/69/58/35/1432695835.db2.gz FLRCBDJVIVUAGA-CQSZACIVSA-N 0 0 397.410 3.495 20 5 GGBDRN C[C@@H]1CN(c2ccccc2F)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000191634826 1432696939 /nfs/dbraw/zinc/69/69/39/1432696939.db2.gz YZYKGKQZULPCBT-CQSZACIVSA-N 0 0 397.410 3.495 20 5 GGBDRN C[C@H]1CN(c2ccccc2F)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000191634840 1432696973 /nfs/dbraw/zinc/69/69/73/1432696973.db2.gz YZYKGKQZULPCBT-AWEZNQCLSA-N 0 0 397.410 3.495 20 5 GGBDRN COc1cc(C(=O)NCc2ccc(NC(=O)C(C)C)cc2)cc([N+](=O)[O-])c1C ZINC000191639702 1432698291 /nfs/dbraw/zinc/69/82/91/1432698291.db2.gz PAMMNGWQUVFHQR-UHFFFAOYSA-N 0 0 385.420 3.436 20 5 GGBDRN COc1ccc(NC(=O)[C@@H](C)N2CCC(c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000191657236 1432700813 /nfs/dbraw/zinc/70/08/13/1432700813.db2.gz YMVPPNWGAKGPGU-CQSZACIVSA-N 0 0 384.436 3.205 20 5 GGBDRN C[C@@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1 ZINC000191681434 1432704862 /nfs/dbraw/zinc/70/48/62/1432704862.db2.gz HNGBATQGYDKEMN-NSHDSACASA-N 0 0 395.337 3.472 20 5 GGBDRN CCO[C@@H]1C[C@](O)(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1(C)C ZINC000191738756 1432715468 /nfs/dbraw/zinc/71/54/68/1432715468.db2.gz XEYNZEONSPJREN-QAPCUYQASA-N 0 0 378.450 3.105 20 5 GGBDRN Cn1cc([C@H]2CSCCN2Cc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000191750337 1432717480 /nfs/dbraw/zinc/71/74/80/1432717480.db2.gz ZQGNVDZWECFVEJ-CQSZACIVSA-N 0 0 384.408 3.220 20 5 GGBDRN CCNC(=O)c1ccc(C)c(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000191788864 1432725436 /nfs/dbraw/zinc/72/54/36/1432725436.db2.gz KFWLTLIHHIDYIC-UHFFFAOYSA-N 0 0 391.449 3.071 20 5 GGBDRN CNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000191789252 1432725828 /nfs/dbraw/zinc/72/58/28/1432725828.db2.gz BSRKGHULIWFYRL-UHFFFAOYSA-N 0 0 397.840 3.025 20 5 GGBDRN CCOC[C@H](NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C(C)C ZINC000191797638 1432727408 /nfs/dbraw/zinc/72/74/08/1432727408.db2.gz AGZLAPCFPZUOPC-SFHVURJKSA-N 0 0 379.457 3.209 20 5 GGBDRN C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cccc(Cl)c2F)C1=O ZINC000191801358 1432728561 /nfs/dbraw/zinc/72/85/61/1432728561.db2.gz XFRNZWOHVWLJSS-QGZVFWFLSA-N 0 0 377.759 3.355 20 5 GGBDRN COc1cc(C(=O)NCC=C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 ZINC000191817716 1432732035 /nfs/dbraw/zinc/73/20/35/1432732035.db2.gz RYUBRVLWTRTJCM-UHFFFAOYSA-N 0 0 377.422 3.335 20 5 GGBDRN COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000191821954 1432732561 /nfs/dbraw/zinc/73/25/61/1432732561.db2.gz AUXJWEWJZKZMLH-NSHDSACASA-N 0 0 396.831 3.196 20 5 GGBDRN O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1cccc(Cl)c1F ZINC000191822860 1432732759 /nfs/dbraw/zinc/73/27/59/1432732759.db2.gz FZFGSBLQUWQFEI-UHFFFAOYSA-N 0 0 399.769 3.331 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(c2ccccc2)[C@H]2CCOC2)cc1C ZINC000191824529 1432732891 /nfs/dbraw/zinc/73/28/91/1432732891.db2.gz YBLDQGXBJRTGPA-INIZCTEOSA-N 0 0 376.434 3.196 20 5 GGBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nc(C(C)C)cs3)C2)n1 ZINC000191826450 1432733622 /nfs/dbraw/zinc/73/36/22/1432733622.db2.gz IDBJBRJAGWLLML-LBPRGKRZSA-N 0 0 377.470 3.411 20 5 GGBDRN O=C(Nc1cc2c(cc1Cl)CCC2=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000191828058 1432733855 /nfs/dbraw/zinc/73/38/55/1432733855.db2.gz QPKWIEGRHJMAAZ-UHFFFAOYSA-N 0 0 397.778 3.210 20 5 GGBDRN Cc1csc(Sc2ccc(C(=O)N3C[C@@H](C)[C@H](CO)C3)cc2[N+](=O)[O-])n1 ZINC000191828446 1432734106 /nfs/dbraw/zinc/73/41/06/1432734106.db2.gz IAHQRZZOGWDXKS-MFKMUULPSA-N 0 0 393.490 3.211 20 5 GGBDRN Cc1c(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnn1Cc1ccc(F)cc1F ZINC000191857178 1432740997 /nfs/dbraw/zinc/74/09/97/1432740997.db2.gz MNGUZLZJHLSCIT-UHFFFAOYSA-N 0 0 387.346 3.098 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@](C)(Cc1ccccc1)[C@@H](C)O ZINC000191860440 1432741521 /nfs/dbraw/zinc/74/15/21/1432741521.db2.gz ADAAVYPXQUKBQP-VLIAUNLRSA-N 0 0 387.436 3.355 20 5 GGBDRN COc1cc(C(=O)NCCCc2nc3ccccc3n2C)cc([N+](=O)[O-])c1C ZINC000191859625 1432741636 /nfs/dbraw/zinc/74/16/36/1432741636.db2.gz BTQZLXCPXFCOSE-UHFFFAOYSA-N 0 0 382.420 3.161 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@](C)(Cc1ccccc1)[C@H](C)O ZINC000191860425 1432741673 /nfs/dbraw/zinc/74/16/73/1432741673.db2.gz ADAAVYPXQUKBQP-XOBRGWDASA-N 0 0 387.436 3.355 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000191870858 1432743936 /nfs/dbraw/zinc/74/39/36/1432743936.db2.gz FKVCDYPJDKZNAZ-UHFFFAOYSA-N 0 0 388.445 3.395 20 5 GGBDRN Cc1ccccc1C[C@@H](CO)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000191870630 1432744085 /nfs/dbraw/zinc/74/40/85/1432744085.db2.gz PAKPYODFSLBLGU-SFHVURJKSA-N 0 0 383.448 3.155 20 5 GGBDRN Cc1ccc(C[C@@H](CO)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 ZINC000191877753 1432745458 /nfs/dbraw/zinc/74/54/58/1432745458.db2.gz OSSQOBRGJGKADR-SFHVURJKSA-N 0 0 383.448 3.155 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000191911206 1432753848 /nfs/dbraw/zinc/75/38/48/1432753848.db2.gz DINPWKBCCDTIDC-UHFFFAOYSA-N 0 0 375.450 3.247 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CC[C@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000191915399 1432754875 /nfs/dbraw/zinc/75/48/75/1432754875.db2.gz HZEWAVOSEVHTIK-INIZCTEOSA-N 0 0 375.450 3.087 20 5 GGBDRN CN(C(=O)c1cn(C(C)(C)C)nn1)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000191942997 1432762241 /nfs/dbraw/zinc/76/22/41/1432762241.db2.gz YGUGTZQKKSDNPP-UHFFFAOYSA-N 0 0 386.437 3.341 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2 ZINC000191952543 1432765504 /nfs/dbraw/zinc/76/55/04/1432765504.db2.gz RZYQQIGPTJYJSV-UHFFFAOYSA-N 0 0 380.326 3.307 20 5 GGBDRN CCCC(=O)N1CCC[C@@H]1C(=O)Nc1cc(CC)nc2ccc([N+](=O)[O-])cc21 ZINC000191979281 1432773447 /nfs/dbraw/zinc/77/34/47/1432773447.db2.gz ULWSXSHOGSVMQZ-GOSISDBHSA-N 0 0 384.436 3.435 20 5 GGBDRN CCc1cc(NC(=O)[C@@H](C(C)C)N2CCCC2=O)c2cc([N+](=O)[O-])ccc2n1 ZINC000191979393 1432773649 /nfs/dbraw/zinc/77/36/49/1432773649.db2.gz DNVLPKFYWVBEMN-LJQANCHMSA-N 0 0 384.436 3.291 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@@H](CCCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000191986716 1432774958 /nfs/dbraw/zinc/77/49/58/1432774958.db2.gz OEKKRLOWCAAQQZ-INIZCTEOSA-N 0 0 378.450 3.004 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@H](CCCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000191986722 1432775123 /nfs/dbraw/zinc/77/51/23/1432775123.db2.gz OEKKRLOWCAAQQZ-MRXNPFEDSA-N 0 0 378.450 3.004 20 5 GGBDRN C[C@H](O)[C@](C)(CNC(=O)CSc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000192029243 1432781872 /nfs/dbraw/zinc/78/18/72/1432781872.db2.gz OBMVTPUYMQWEKJ-YWZLYKJASA-N 0 0 388.489 3.433 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)NC[C@H](C[C@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000192039131 1432784272 /nfs/dbraw/zinc/78/42/72/1432784272.db2.gz VSZKRSBKFNJMTN-RDJZCZTQSA-N 0 0 392.477 3.045 20 5 GGBDRN C[C@@H](O)[C@](C)(CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Cc1ccccc1 ZINC000192060277 1432790327 /nfs/dbraw/zinc/79/03/27/1432790327.db2.gz SYCMXQMTOAWKGL-QRQCRPRQSA-N 0 0 395.459 3.365 20 5 GGBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N(c1ccccc1)[C@H]1CCOC1 ZINC000192063430 1432790542 /nfs/dbraw/zinc/79/05/42/1432790542.db2.gz HMROJGZZDMIWID-IBGZPJMESA-N 0 0 378.388 3.216 20 5 GGBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N(c1ccccc1)[C@H]1CCOC1 ZINC000192070336 1432792713 /nfs/dbraw/zinc/79/27/13/1432792713.db2.gz UBXVVDVYCGZIQC-KRWDZBQOSA-N 0 0 378.388 3.216 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CCO)cc1[N+](=O)[O-] ZINC000192114862 1432800266 /nfs/dbraw/zinc/80/02/66/1432800266.db2.gz MDLNJMCVGLYANX-MRXNPFEDSA-N 0 0 392.477 3.173 20 5 GGBDRN CCc1c(NC(=O)c2cc([N+](=O)[O-])cnc2N)cnn1-c1ccccc1Cl ZINC000192123616 1432801648 /nfs/dbraw/zinc/80/16/48/1432801648.db2.gz SXSKFAHZSQGMGW-UHFFFAOYSA-N 0 0 386.799 3.226 20 5 GGBDRN CCc1c(NC(=O)Cn2cc([N+](=O)[O-])nc2C)cnn1-c1ccccc1Cl ZINC000192124002 1432801902 /nfs/dbraw/zinc/80/19/02/1432801902.db2.gz OJPIIXWGKXDDCM-UHFFFAOYSA-N 0 0 388.815 3.140 20 5 GGBDRN Cc1ccc(Cn2cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c2=O)cc1C ZINC000192130587 1432803421 /nfs/dbraw/zinc/80/34/21/1432803421.db2.gz YRVCNLNIAVILQG-UHFFFAOYSA-N 0 0 375.388 3.156 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N2CCC[C@@H]2[C@@H]2CCCCC2=O)cc1[N+](=O)[O-] ZINC000192130643 1432803634 /nfs/dbraw/zinc/80/36/34/1432803634.db2.gz TWVIMESCBUJULF-LSDHHAIUSA-N 0 0 380.466 3.124 20 5 GGBDRN CCc1c(NC(=O)c2cc([N+](=O)[O-])cnc2N)cnn1-c1cccc(Cl)c1 ZINC000192133507 1432804128 /nfs/dbraw/zinc/80/41/28/1432804128.db2.gz LBCCLSIEFOCWPZ-UHFFFAOYSA-N 0 0 386.799 3.226 20 5 GGBDRN Cc1cc(C)c(S(=O)(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192145624 1432806875 /nfs/dbraw/zinc/80/68/75/1432806875.db2.gz RPTBHNSUEWHBQT-FUHWJXTLSA-N 0 0 390.461 3.410 20 5 GGBDRN CC(C)c1c(NC(=O)Cn2cc([N+](=O)[O-])cn2)cnn1-c1ccccc1Cl ZINC000192158216 1432809724 /nfs/dbraw/zinc/80/97/24/1432809724.db2.gz YGRXJBANGIQGDJ-UHFFFAOYSA-N 0 0 388.815 3.393 20 5 GGBDRN O=C(Nc1cc(F)ccc1OCC1CC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000192171957 1432811617 /nfs/dbraw/zinc/81/16/17/1432811617.db2.gz SGBYQZWVCIWPEX-UHFFFAOYSA-N 0 0 397.366 3.356 20 5 GGBDRN O=C(c1ncc(F)cc1F)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000192176359 1432812504 /nfs/dbraw/zinc/81/25/04/1432812504.db2.gz BUFQBKCYBOEYGI-UHFFFAOYSA-N 0 0 375.253 3.473 20 5 GGBDRN CCc1nn(C)c(CC)c1CC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000192205795 1432815913 /nfs/dbraw/zinc/81/59/13/1432815913.db2.gz ZPRTWSOAZWORPH-UHFFFAOYSA-N 0 0 382.424 3.024 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCc2cc(Cl)ccc2C1 ZINC000192242284 1432821428 /nfs/dbraw/zinc/82/14/28/1432821428.db2.gz DULYIBXAZGYSGC-UHFFFAOYSA-N 0 0 375.812 3.254 20 5 GGBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC(c3ccncc3)CC2)c1[N+](=O)[O-] ZINC000192259093 1432823615 /nfs/dbraw/zinc/82/36/15/1432823615.db2.gz ICIUXBGUFJSZLU-UHFFFAOYSA-N 0 0 375.450 3.175 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(c3ccncc3)CC2)c2ncccc12 ZINC000192260390 1432823947 /nfs/dbraw/zinc/82/39/47/1432823947.db2.gz WGCSMUVXQSJZKD-UHFFFAOYSA-N 0 0 398.444 3.106 20 5 GGBDRN Cc1cc(S(=O)(=O)N2CCC(c3ccncc3)CC2)cc([N+](=O)[O-])c1F ZINC000192262161 1432824054 /nfs/dbraw/zinc/82/40/54/1432824054.db2.gz XHEGBENMNFEUBR-UHFFFAOYSA-N 0 0 379.413 3.006 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192263319 1432824147 /nfs/dbraw/zinc/82/41/47/1432824147.db2.gz SNLKCZRBOVTMDO-UHFFFAOYSA-N 0 0 388.445 3.372 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)N(C)c2ccc(OC(C)C)cc2)ccc1[N+](=O)[O-] ZINC000192264245 1432824338 /nfs/dbraw/zinc/82/43/38/1432824338.db2.gz LJHVZVDKDLMHCK-UHFFFAOYSA-N 0 0 385.420 3.083 20 5 GGBDRN COc1cccc(Cl)c1CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192266236 1432824786 /nfs/dbraw/zinc/82/47/86/1432824786.db2.gz BSKDXPBGGNMRRR-UHFFFAOYSA-N 0 0 398.202 3.165 20 5 GGBDRN CCCC1CCC(N(C)C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CC1 ZINC000192268299 1432825164 /nfs/dbraw/zinc/82/51/64/1432825164.db2.gz AZOQGJORMZOZFO-UHFFFAOYSA-N 0 0 382.482 3.429 20 5 GGBDRN Cc1c([C@@H](C)Nc2nc(N[C@@H](C)c3cnn(C)c3C)ccc2[N+](=O)[O-])cnn1C ZINC000192275863 1432825988 /nfs/dbraw/zinc/82/59/88/1432825988.db2.gz RDSFRDAEXDADEE-NWDGAFQWSA-N 0 0 398.471 3.420 20 5 GGBDRN CCCCS(=O)(=O)c1ccc(C(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000192278674 1432826464 /nfs/dbraw/zinc/82/64/64/1432826464.db2.gz OZRUPUUAANDFRF-UHFFFAOYSA-N 0 0 376.434 3.099 20 5 GGBDRN Cc1ccc(CN2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000192284686 1432827203 /nfs/dbraw/zinc/82/72/03/1432827203.db2.gz KACPBOJBLOQZHJ-KRWDZBQOSA-N 0 0 387.823 3.088 20 5 GGBDRN Cc1cnc(COC(=O)CCOCC(F)(F)C(F)(F)F)c(C)c1[N+](=O)[O-] ZINC000192302601 1432829515 /nfs/dbraw/zinc/82/95/15/1432829515.db2.gz ANTQNEWYXYRLBB-UHFFFAOYSA-N 0 0 386.273 3.254 20 5 GGBDRN CCNc1ccc(Cl)cc1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000192354569 1432835828 /nfs/dbraw/zinc/83/58/28/1432835828.db2.gz UPQWPWNOYMDRJX-CYBMUJFWSA-N 0 0 389.843 3.402 20 5 GGBDRN CCOC(=O)c1csc([C@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])n1 ZINC000192358105 1432836572 /nfs/dbraw/zinc/83/65/72/1432836572.db2.gz AKIVJNPBOUWTJG-CQSZACIVSA-N 0 0 375.406 3.205 20 5 GGBDRN O=C(NCCOCc1ccccc1)c1cccc([N+](=O)[O-])c1Br ZINC000192367954 1432837791 /nfs/dbraw/zinc/83/77/91/1432837791.db2.gz UILWCFPGIVZXPA-UHFFFAOYSA-N 0 0 379.210 3.304 20 5 GGBDRN Cc1c(NC(=O)C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000192374836 1432838755 /nfs/dbraw/zinc/83/87/55/1432838755.db2.gz PKONYAZVFWNMLK-ZDUSSCGKSA-N 0 0 387.358 3.279 20 5 GGBDRN Cc1c(NC(=O)CCNc2ccccc2[N+](=O)[O-])nnn1Cc1ccccc1F ZINC000192378990 1432839356 /nfs/dbraw/zinc/83/93/56/1432839356.db2.gz YQXLBKNFSWXQCJ-UHFFFAOYSA-N 0 0 398.398 3.123 20 5 GGBDRN CCc1ccc(C(=O)Nc2nnn(Cc3ccccc3F)c2C)cc1[N+](=O)[O-] ZINC000192379795 1432839694 /nfs/dbraw/zinc/83/96/94/1432839694.db2.gz HNLPARYHCJYOCF-UHFFFAOYSA-N 0 0 383.383 3.497 20 5 GGBDRN COC(=O)[C@H](CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000192417460 1432842566 /nfs/dbraw/zinc/84/25/66/1432842566.db2.gz OPXSRVGQKVHAFU-OAHLLOKOSA-N 0 0 389.383 3.429 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC(O)(c2ccccc2Cl)CC1 ZINC000192418762 1432842789 /nfs/dbraw/zinc/84/27/89/1432842789.db2.gz IYGAIMLZASAXSF-UHFFFAOYSA-N 0 0 376.800 3.159 20 5 GGBDRN O=C(NC[C@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1)Nc1cccc(F)c1 ZINC000192450330 1432846140 /nfs/dbraw/zinc/84/61/40/1432846140.db2.gz FCUYJEKZNLHOCU-LLVKDONJSA-N 0 0 379.417 3.229 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O ZINC000192455178 1432846690 /nfs/dbraw/zinc/84/66/90/1432846690.db2.gz JAZFHVZCFMQWKW-CQSZACIVSA-N 0 0 391.786 3.231 20 5 GGBDRN C[C@H](c1nc(-c2cccs2)no1)N1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000192454155 1432846755 /nfs/dbraw/zinc/84/67/55/1432846755.db2.gz SWYNJTCBEZHPFT-SNVBAGLBSA-N 0 0 392.466 3.046 20 5 GGBDRN O=C(CN1CCC(C(=O)c2ccc(F)cc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000192473117 1432848968 /nfs/dbraw/zinc/84/89/68/1432848968.db2.gz JTGBKMCUYBSKEE-UHFFFAOYSA-N 0 0 385.395 3.267 20 5 GGBDRN C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)Nc1ncc([N+](=O)[O-])s1 ZINC000192501104 1432851823 /nfs/dbraw/zinc/85/18/23/1432851823.db2.gz KNNRZNISIMMFII-LBPRGKRZSA-N 0 0 375.454 3.481 20 5 GGBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCCOCC(F)(F)F ZINC000192503618 1432852298 /nfs/dbraw/zinc/85/22/98/1432852298.db2.gz PEVYZYRPEKUQBC-UHFFFAOYSA-N 0 0 392.377 3.240 20 5 GGBDRN Cc1c(C(=O)N[C@@H]2CCSc3ccccc32)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000192521539 1432854458 /nfs/dbraw/zinc/85/44/58/1432854458.db2.gz VQDMWJJAOQTKMI-MRXNPFEDSA-N 0 0 395.444 3.451 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(OC(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000192522664 1432854598 /nfs/dbraw/zinc/85/45/98/1432854598.db2.gz HLWHLXXRGYXWAL-UHFFFAOYSA-N 0 0 397.309 3.170 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCCN(C(=O)c2cccc(Cl)c2)CC1 ZINC000192525385 1432854883 /nfs/dbraw/zinc/85/48/83/1432854883.db2.gz MAKYXZMBOMPNJV-UHFFFAOYSA-N 0 0 391.859 3.126 20 5 GGBDRN C[C@@H]1CN(Cc2ccc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000192534376 1432856328 /nfs/dbraw/zinc/85/63/28/1432856328.db2.gz BBMIKSLSOYTKJI-IAGOWNOFSA-N 0 0 397.475 3.476 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCCc1ccc(OCC(F)(F)F)nc1 ZINC000192541492 1432857064 /nfs/dbraw/zinc/85/70/64/1432857064.db2.gz KITIOSMBHQXXGV-UHFFFAOYSA-N 0 0 383.326 3.212 20 5 GGBDRN COc1ccc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000192542666 1432857277 /nfs/dbraw/zinc/85/72/77/1432857277.db2.gz KBEFILYFOKUFNO-UHFFFAOYSA-N 0 0 397.309 3.148 20 5 GGBDRN COc1cccc(C(=O)NCCc2nc(-c3ccccn3)cs2)c1[N+](=O)[O-] ZINC000192543258 1432857329 /nfs/dbraw/zinc/85/73/29/1432857329.db2.gz DZUBYTXOSXGVRJ-UHFFFAOYSA-N 0 0 384.417 3.094 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)c1[N+](=O)[O-] ZINC000192548926 1432858277 /nfs/dbraw/zinc/85/82/77/1432858277.db2.gz WRUGRGTVYNOIRZ-UHFFFAOYSA-N 0 0 387.440 3.312 20 5 GGBDRN CCc1[nH]nc(C(=O)Nc2cc(C(=O)N(C)C(C)C)ccc2Cl)c1[N+](=O)[O-] ZINC000192550915 1432858405 /nfs/dbraw/zinc/85/84/05/1432858405.db2.gz PTXAWLZKYRNCHG-UHFFFAOYSA-N 0 0 393.831 3.266 20 5 GGBDRN COC(=O)c1ccc(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000192573789 1432861775 /nfs/dbraw/zinc/86/17/75/1432861775.db2.gz FFJWGMIUHACVPC-UHFFFAOYSA-N 0 0 377.784 3.399 20 5 GGBDRN Cc1c(NC(=O)NCc2cccc(CN3CCCC3=O)c2)cccc1[N+](=O)[O-] ZINC000192580148 1432862636 /nfs/dbraw/zinc/86/26/36/1432862636.db2.gz KPMVGTOPOUGBRZ-UHFFFAOYSA-N 0 0 382.420 3.347 20 5 GGBDRN CC(=O)c1cccc(OC[C@@H](O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000192586968 1432863116 /nfs/dbraw/zinc/86/31/16/1432863116.db2.gz AFXHCWKHGLSJQB-KRWDZBQOSA-N 0 0 392.839 3.323 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N2CCc3c2cc(F)cc3F)cc([N+](=O)[O-])c1 ZINC000192600393 1432864569 /nfs/dbraw/zinc/86/45/69/1432864569.db2.gz LJRDTSCERNZEPA-UHFFFAOYSA-N 0 0 376.315 3.253 20 5 GGBDRN Cc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC000192600130 1432864613 /nfs/dbraw/zinc/86/46/13/1432864613.db2.gz ATLIMXWRVBYUNG-UHFFFAOYSA-N 0 0 382.424 3.222 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCc3c2cc(F)cc3F)cc1OC ZINC000192604040 1432865100 /nfs/dbraw/zinc/86/51/00/1432865100.db2.gz KDQFIUFYVGAQKA-UHFFFAOYSA-N 0 0 378.331 3.483 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000192602805 1432865125 /nfs/dbraw/zinc/86/51/25/1432865125.db2.gz MMJDDJMTGIMLPB-LBPRGKRZSA-N 0 0 381.383 3.412 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1N(C)Cc1cc2c(cc1OC(F)F)OCO2 ZINC000192621084 1432867186 /nfs/dbraw/zinc/86/71/86/1432867186.db2.gz OCBMHVQUKHKMAH-UHFFFAOYSA-N 0 0 384.339 3.086 20 5 GGBDRN O=C(Oc1cccc2ncccc21)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000192625779 1432867861 /nfs/dbraw/zinc/86/78/61/1432867861.db2.gz MDIQGKNEZNFUFY-LBPRGKRZSA-N 0 0 395.346 3.241 20 5 GGBDRN O=C([C@H]1CSCCS1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000192634328 1432869138 /nfs/dbraw/zinc/86/91/38/1432869138.db2.gz UAKJWPSWQMBBBV-GFCCVEGCSA-N 0 0 380.413 3.334 20 5 GGBDRN O=C(Cc1cn2ccsc2n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000192634000 1432869141 /nfs/dbraw/zinc/86/91/41/1432869141.db2.gz BTMWQTKOSXZYAO-UHFFFAOYSA-N 0 0 398.366 3.438 20 5 GGBDRN Cc1nn(C)c(C)c1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192636050 1432869472 /nfs/dbraw/zinc/86/94/72/1432869472.db2.gz HCTWWSKLLPQQRK-UHFFFAOYSA-N 0 0 394.431 3.454 20 5 GGBDRN CCN(CC)C(=O)COc1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000192638144 1432869696 /nfs/dbraw/zinc/86/96/96/1432869696.db2.gz NFXSTVPKGHKWON-UHFFFAOYSA-N 0 0 377.422 3.156 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1c(C)nn(-c2ccccc2)c1C ZINC000192642585 1432870410 /nfs/dbraw/zinc/87/04/10/1432870410.db2.gz LRZDYNBHNDWTIP-UHFFFAOYSA-N 0 0 395.419 3.457 20 5 GGBDRN CN(C)S(=O)(=O)c1ccccc1CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192644329 1432870687 /nfs/dbraw/zinc/87/06/87/1432870687.db2.gz VNZCOBCJGDKBRD-SFHVURJKSA-N 0 0 389.477 3.012 20 5 GGBDRN CCOC(=O)[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000192647471 1432870947 /nfs/dbraw/zinc/87/09/47/1432870947.db2.gz YUQOOFYLUGXNKI-LJQANCHMSA-N 0 0 397.431 3.229 20 5 GGBDRN CCc1n[nH]c(C(=O)N(CCc2ccc(C)cc2)C[C@@H]2CCCO2)c1[N+](=O)[O-] ZINC000192651157 1432871555 /nfs/dbraw/zinc/87/15/55/1432871555.db2.gz RSWOMKNPNQYZBK-INIZCTEOSA-N 0 0 386.452 3.053 20 5 GGBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000192660117 1432872356 /nfs/dbraw/zinc/87/23/56/1432872356.db2.gz YRVWJPBIAFTNGS-GTNSWQLSSA-N 0 0 375.812 3.314 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Oc2ccc(F)cc2Br)c1 ZINC000192669607 1432873574 /nfs/dbraw/zinc/87/35/74/1432873574.db2.gz XAPLAHIFRQCNKO-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN Cc1cc(=O)n(C)cc1NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000192671485 1432873713 /nfs/dbraw/zinc/87/37/13/1432873713.db2.gz RGRARICKIFRHFJ-UHFFFAOYSA-N 0 0 393.399 3.433 20 5 GGBDRN O=C(NCc1cccc(CN2CCCC2=O)c1)c1cc([N+](=O)[O-])ccc1Cl ZINC000192685689 1432875147 /nfs/dbraw/zinc/87/51/47/1432875147.db2.gz NYRJLPVZTTWCMZ-UHFFFAOYSA-N 0 0 387.823 3.301 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCCN1C(=O)c1cccs1 ZINC000192689302 1432875650 /nfs/dbraw/zinc/87/56/50/1432875650.db2.gz RXEZBOUWKJVWBF-AWEZNQCLSA-N 0 0 389.433 3.298 20 5 GGBDRN COc1ccc(S(=O)(=O)Nc2ccc(Cc3ccncc3)cc2)cc1[N+](=O)[O-] ZINC000192705832 1432877735 /nfs/dbraw/zinc/87/77/35/1432877735.db2.gz ZCTGEWQRTQPIHB-UHFFFAOYSA-N 0 0 399.428 3.390 20 5 GGBDRN CCc1nn(C)c(NC2CCN(C(=O)[C@@H](CC)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000192711803 1432878510 /nfs/dbraw/zinc/87/85/10/1432878510.db2.gz QYYLYFBSHJRMFB-KRWDZBQOSA-N 0 0 399.495 3.487 20 5 GGBDRN O=[N+]([O-])c1ccc(CN(CCS(=O)(=O)c2ccc(F)cc2)C2CC2)cc1 ZINC000192713236 1432878521 /nfs/dbraw/zinc/87/85/21/1432878521.db2.gz ZLBYKCHZWJXRFL-UHFFFAOYSA-N 0 0 378.425 3.172 20 5 GGBDRN Cc1c(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cnn1C1CCCC1 ZINC000192713818 1432878873 /nfs/dbraw/zinc/87/88/73/1432878873.db2.gz AKCLKPFYPBKLDP-UHFFFAOYSA-N 0 0 399.451 3.304 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000192727065 1432880725 /nfs/dbraw/zinc/88/07/25/1432880725.db2.gz WYHHAFDCHKCORZ-HNNXBMFYSA-N 0 0 394.786 3.003 20 5 GGBDRN COc1cc(Cl)c(C)cc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000192726524 1432880838 /nfs/dbraw/zinc/88/08/38/1432880838.db2.gz QDUIXNPZROSMLT-UHFFFAOYSA-N 0 0 391.811 3.242 20 5 GGBDRN CCOC(=O)c1cc(N2CCC(CN3CCCCC3=O)CC2)ccc1[N+](=O)[O-] ZINC000192731399 1432881728 /nfs/dbraw/zinc/88/17/28/1432881728.db2.gz OYVUJECHVMGRRI-UHFFFAOYSA-N 0 0 389.452 3.000 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000192734046 1432881956 /nfs/dbraw/zinc/88/19/56/1432881956.db2.gz JKQJBKSJSMSDLJ-INIZCTEOSA-N 0 0 388.395 3.346 20 5 GGBDRN COc1cc(CCNC(=O)N[C@@H](C)Cc2cccs2)c([N+](=O)[O-])cc1OC ZINC000192741239 1432882933 /nfs/dbraw/zinc/88/29/33/1432882933.db2.gz NDOSQSGGPZPAJF-LBPRGKRZSA-N 0 0 393.465 3.146 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000192747872 1432884163 /nfs/dbraw/zinc/88/41/63/1432884163.db2.gz PVMUBJWVUZAEKG-ZBEGNZNMSA-N 0 0 392.358 3.050 20 5 GGBDRN Cc1cc(C(=O)NCC(=O)Nc2ccccc2OC(F)(F)F)ccc1[N+](=O)[O-] ZINC000192759891 1432885774 /nfs/dbraw/zinc/88/57/74/1432885774.db2.gz XESPHZCXFWYCKB-UHFFFAOYSA-N 0 0 397.309 3.170 20 5 GGBDRN COC(=O)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000192763000 1432886436 /nfs/dbraw/zinc/88/64/36/1432886436.db2.gz WBORIDJKIREWBI-AWEZNQCLSA-N 0 0 380.759 3.074 20 5 GGBDRN O=Cc1ccc(OCC(=O)NCCc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000192773156 1432888472 /nfs/dbraw/zinc/88/84/72/1432888472.db2.gz XKFXNNAHHPPNDQ-UHFFFAOYSA-N 0 0 396.321 3.164 20 5 GGBDRN O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCCC1 ZINC000192781026 1432889656 /nfs/dbraw/zinc/88/96/56/1432889656.db2.gz DADGKICGQBOFIN-UHFFFAOYSA-N 0 0 385.445 3.098 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(N2CCCS2(=O)=O)c1 ZINC000192814622 1432894183 /nfs/dbraw/zinc/89/41/83/1432894183.db2.gz ULAVEVCNDAVUGY-UHFFFAOYSA-N 0 0 389.433 3.004 20 5 GGBDRN CCN(CC)c1ccc(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cn1 ZINC000192839717 1432897542 /nfs/dbraw/zinc/89/75/42/1432897542.db2.gz IPKHARLSHXQIPI-UHFFFAOYSA-N 0 0 385.424 3.030 20 5 GGBDRN C[C@@H]1CN(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc21 ZINC000192858603 1432899784 /nfs/dbraw/zinc/89/97/84/1432899784.db2.gz NVAPFXARJNAOOM-SNVBAGLBSA-N 0 0 391.330 3.285 20 5 GGBDRN Cc1ccc([C@@](O)(CC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C(F)(F)F)o1 ZINC000192892901 1432903835 /nfs/dbraw/zinc/90/38/35/1432903835.db2.gz RDBMYOWNMQQLQB-INIZCTEOSA-N 0 0 386.326 3.295 20 5 GGBDRN COc1cccc(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000192902546 1432905193 /nfs/dbraw/zinc/90/51/93/1432905193.db2.gz PMFAHCMZSKEMJE-MRXNPFEDSA-N 0 0 376.796 3.471 20 5 GGBDRN COc1cc(CNC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)ccc1O ZINC000192906350 1432905596 /nfs/dbraw/zinc/90/55/96/1432905596.db2.gz WBUHUPHWHKIKCD-UHFFFAOYSA-N 0 0 399.447 3.475 20 5 GGBDRN CCc1n[nH]c(C(=O)N2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000192911437 1432906031 /nfs/dbraw/zinc/90/60/31/1432906031.db2.gz XYPSSUQWYGDCKC-IINYFYTJSA-N 0 0 378.816 3.136 20 5 GGBDRN COC[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000192927553 1432909024 /nfs/dbraw/zinc/90/90/24/1432909024.db2.gz QIKXUUZWWKBLKM-KRWDZBQOSA-N 0 0 398.868 3.098 20 5 GGBDRN CSc1nnc(CCCNC(=O)c2c(C)cccc2[N+](=O)[O-])n1CC(C)C ZINC000192928546 1432909338 /nfs/dbraw/zinc/90/93/38/1432909338.db2.gz LDGPNTYEAGMEFN-UHFFFAOYSA-N 0 0 391.497 3.235 20 5 GGBDRN CCCc1c(NC(=O)c2n[nH]c(CC)c2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000192937539 1432910253 /nfs/dbraw/zinc/91/02/53/1432910253.db2.gz BBVSLMAAMGUCJJ-UHFFFAOYSA-N 0 0 386.387 3.410 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000192942669 1432911057 /nfs/dbraw/zinc/91/10/57/1432911057.db2.gz KAKVQLOCIINYLX-SFHVURJKSA-N 0 0 382.844 3.229 20 5 GGBDRN CCOC(=O)[C@]1(C(C)C)CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000192942654 1432911184 /nfs/dbraw/zinc/91/11/84/1432911184.db2.gz KAKVQLOCIINYLX-GOSISDBHSA-N 0 0 382.844 3.229 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(CN2C[C@H](C)O[C@@H](C)C2)cs1 ZINC000192954633 1432912807 /nfs/dbraw/zinc/91/28/07/1432912807.db2.gz HSIRPBDPQYEQHX-STQMWFEESA-N 0 0 390.465 3.221 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1 ZINC000192960582 1432913360 /nfs/dbraw/zinc/91/33/60/1432913360.db2.gz LWTLIEXDQAOAHX-GASCZTMLSA-N 0 0 384.436 3.473 20 5 GGBDRN CCOC(=O)[C@H](C)[C@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000192973545 1432915295 /nfs/dbraw/zinc/91/52/95/1432915295.db2.gz ODAFSQGHGLEESY-BDAKNGLRSA-N 0 0 377.319 3.323 20 5 GGBDRN CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000192973519 1432915308 /nfs/dbraw/zinc/91/53/08/1432915308.db2.gz ODAFSQGHGLEESY-RKDXNWHRSA-N 0 0 377.319 3.323 20 5 GGBDRN Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000192988993 1432918147 /nfs/dbraw/zinc/91/81/47/1432918147.db2.gz CDXAOEXFMXGBRW-ROUUACIJSA-N 0 0 396.491 3.291 20 5 GGBDRN COc1cc(CCNC(=O)N2C[C@H](C)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000192999083 1432919598 /nfs/dbraw/zinc/91/95/98/1432919598.db2.gz XODLESTZOCNFSV-ZDUSSCGKSA-N 0 0 385.420 3.488 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000192999248 1432919608 /nfs/dbraw/zinc/91/96/08/1432919608.db2.gz ANQXQLVSFYDPHA-DZGCQCFKSA-N 0 0 379.457 3.375 20 5 GGBDRN COc1cc(CCNC(=O)N(C)[C@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000192999220 1432919682 /nfs/dbraw/zinc/91/96/82/1432919682.db2.gz ANQXQLVSFYDPHA-ZFWWWQNUSA-N 0 0 379.457 3.375 20 5 GGBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1cccc(-c2nnc3n2CCC3)c1 ZINC000193011202 1432922099 /nfs/dbraw/zinc/92/20/99/1432922099.db2.gz HFBOXZVIPBZMAF-UHFFFAOYSA-N 0 0 378.392 3.121 20 5 GGBDRN COC(=O)Cn1ncc(Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])c1C ZINC000193021859 1432923457 /nfs/dbraw/zinc/92/34/57/1432923457.db2.gz GSBPWTBXJUIDEJ-UHFFFAOYSA-N 0 0 394.387 3.247 20 5 GGBDRN O=Cc1cc([N+](=O)[O-])ccc1OCc1nnc(-c2ccc(Br)o2)o1 ZINC000193028929 1432924363 /nfs/dbraw/zinc/92/43/63/1432924363.db2.gz BRCUSLKATUBGFS-UHFFFAOYSA-N 0 0 394.137 3.392 20 5 GGBDRN C[C@@H](c1ccccc1)N(C)C(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000193029747 1432924646 /nfs/dbraw/zinc/92/46/46/1432924646.db2.gz WQOOAFNCPCEVDI-DZGCQCFKSA-N 0 0 387.461 3.481 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc3ncccc3c2)c2ncccc12 ZINC000193031706 1432924880 /nfs/dbraw/zinc/92/48/80/1432924880.db2.gz AVAORBHIBNKURB-UHFFFAOYSA-N 0 0 394.412 3.170 20 5 GGBDRN O=C(NCCc1cc(Cl)c2c(c1)OCCO2)NCc1ccccc1[N+](=O)[O-] ZINC000193048753 1432928025 /nfs/dbraw/zinc/92/80/25/1432928025.db2.gz XCMGUOKIULLYMK-UHFFFAOYSA-N 0 0 391.811 3.061 20 5 GGBDRN CCOc1ccc(NC(=O)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000193053959 1432928920 /nfs/dbraw/zinc/92/89/20/1432928920.db2.gz IJTXRBSTIVHFCZ-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CCCc1csc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000193119599 1432939455 /nfs/dbraw/zinc/93/94/55/1432939455.db2.gz LCZVAEJEGVATEK-NSHDSACASA-N 0 0 376.438 3.128 20 5 GGBDRN CC(C)CC(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193128781 1432941000 /nfs/dbraw/zinc/94/10/00/1432941000.db2.gz WKGUJPLYXCUHEO-UHFFFAOYSA-N 0 0 377.422 3.380 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccnc(N2CCCCC2)c1 ZINC000193129233 1432941160 /nfs/dbraw/zinc/94/11/60/1432941160.db2.gz LYCBBCIAMIUKCN-UHFFFAOYSA-N 0 0 385.424 3.310 20 5 GGBDRN Cc1cc(=O)oc2cc(NC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)ccc12 ZINC000193151928 1432945783 /nfs/dbraw/zinc/94/57/83/1432945783.db2.gz PQKZDDGWUAVNLP-UHFFFAOYSA-N 0 0 390.355 3.448 20 5 GGBDRN COc1cc(CCNC(=O)Cc2c(C)[nH]c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000193155905 1432946651 /nfs/dbraw/zinc/94/66/51/1432946651.db2.gz DQNIWCPYMSEACX-UHFFFAOYSA-N 0 0 397.431 3.303 20 5 GGBDRN COc1cccc(C(=O)Nc2nc(CN3CCCCC3)cs2)c1[N+](=O)[O-] ZINC000193176916 1432951579 /nfs/dbraw/zinc/95/15/79/1432951579.db2.gz MSUYJAFUDWJLIT-UHFFFAOYSA-N 0 0 376.438 3.298 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccncc3)no2)ccc1[N+](=O)[O-] ZINC000193200489 1432956944 /nfs/dbraw/zinc/95/69/44/1432956944.db2.gz CYULYSDNMBVHTQ-MRXNPFEDSA-N 0 0 379.376 3.326 20 5 GGBDRN CC(=O)NC(C)(C)c1noc(-c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)n1 ZINC000193205107 1432957722 /nfs/dbraw/zinc/95/77/22/1432957722.db2.gz AILORISTIKFQJQ-UHFFFAOYSA-N 0 0 387.440 3.252 20 5 GGBDRN CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193227223 1432962573 /nfs/dbraw/zinc/96/25/73/1432962573.db2.gz DKGXHNQMGWVXDZ-SFHVURJKSA-N 0 0 387.411 3.147 20 5 GGBDRN C[C@H](c1ccccc1)N1C[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC1=O ZINC000193230225 1432963157 /nfs/dbraw/zinc/96/31/57/1432963157.db2.gz PTQNMIISHZCSEA-QAPCUYQASA-N 0 0 381.432 3.163 20 5 GGBDRN CC1CCN(C(=S)SCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000193231725 1432963418 /nfs/dbraw/zinc/96/34/18/1432963418.db2.gz IYAGHAGBIOQGAX-UHFFFAOYSA-N 0 0 381.523 3.303 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1 ZINC000193232773 1432963661 /nfs/dbraw/zinc/96/36/61/1432963661.db2.gz XYUMYBFZYNJXCH-QGZVFWFLSA-N 0 0 399.422 3.245 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCCCN1C(=O)c1cccs1 ZINC000193234376 1432964105 /nfs/dbraw/zinc/96/41/05/1432964105.db2.gz KVMIEWPBYUDTTJ-MRXNPFEDSA-N 0 0 387.461 3.310 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@]12CCC(=O)N1c1ccccc1S2 ZINC000193233084 1432964165 /nfs/dbraw/zinc/96/41/65/1432964165.db2.gz MWYSORNGCXVXIS-LJQANCHMSA-N 0 0 383.429 3.182 20 5 GGBDRN CC1CCC(N(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)C2CC2)CC1 ZINC000193249564 1432967450 /nfs/dbraw/zinc/96/74/50/1432967450.db2.gz QYXVOMNXRXPCEH-UHFFFAOYSA-N 0 0 380.466 3.182 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)NCc2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000193251496 1432967847 /nfs/dbraw/zinc/96/78/47/1432967847.db2.gz BSGBGUYYKJZVAX-UHFFFAOYSA-N 0 0 384.413 3.082 20 5 GGBDRN CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000193255856 1432968349 /nfs/dbraw/zinc/96/83/49/1432968349.db2.gz VNSWTNKXBOHCRG-ZIAGYGMSSA-N 0 0 382.482 3.333 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)N2CCc3ccccc32)cc1OC ZINC000193271402 1432972042 /nfs/dbraw/zinc/97/20/42/1432972042.db2.gz FXVMSFIOIQGCKR-AWEZNQCLSA-N 0 0 399.447 3.183 20 5 GGBDRN CC(C)Oc1ccc([C@@H](C)NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000193272132 1432972421 /nfs/dbraw/zinc/97/24/21/1432972421.db2.gz ZMLUQQQRWACTNF-CYBMUJFWSA-N 0 0 399.403 3.167 20 5 GGBDRN COC(=O)c1cc(CN(C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)oc1C ZINC000193338915 1432982104 /nfs/dbraw/zinc/98/21/04/1432982104.db2.gz CNNNUFLTFLXMHM-GFCCVEGCSA-N 0 0 389.408 3.050 20 5 GGBDRN C[C@H](Nc1ccc2c(c1)CC(=O)N2C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000193341481 1432982493 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ZINC000193680572 1433039573 /nfs/dbraw/zinc/03/95/73/1433039573.db2.gz YQKLBPSUEJDDDZ-UHFFFAOYSA-N 0 0 380.200 3.447 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COc1c(F)c(F)c(F)c(F)c1F ZINC000193680589 1433039655 /nfs/dbraw/zinc/03/96/55/1433039655.db2.gz JGKHJZGUICIGLP-UHFFFAOYSA-N 0 0 392.236 3.316 20 5 GGBDRN CCc1ccc(C(=O)N2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 ZINC000193683751 1433040111 /nfs/dbraw/zinc/04/01/11/1433040111.db2.gz MJOHTLQRPJGHEE-UHFFFAOYSA-N 0 0 396.447 3.456 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC(Oc2ccccc2)CC1 ZINC000193683918 1433040156 /nfs/dbraw/zinc/04/01/56/1433040156.db2.gz RAVWOBXVAJTBKJ-UHFFFAOYSA-N 0 0 385.420 3.356 20 5 GGBDRN CSc1ccc(C(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000193701481 1433043186 /nfs/dbraw/zinc/04/31/86/1433043186.db2.gz OHKPXVZZNMLOCL-UHFFFAOYSA-N 0 0 399.472 3.369 20 5 GGBDRN CC[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1 ZINC000193707653 1433044245 /nfs/dbraw/zinc/04/42/45/1433044245.db2.gz BBTOAZHNTAKZAP-JTQLQIEISA-N 0 0 377.260 3.311 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3ccccc3Cn3cccn3)cc2N1 ZINC000193716379 1433045869 /nfs/dbraw/zinc/04/58/69/1433045869.db2.gz QRDTWBPJHJCATM-UHFFFAOYSA-N 0 0 377.404 3.336 20 5 GGBDRN Cc1cc(NC(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000193728791 1433048367 /nfs/dbraw/zinc/04/83/67/1433048367.db2.gz WHRZRPPQNOWFGG-AWEZNQCLSA-N 0 0 388.468 3.406 20 5 GGBDRN CN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000193729704 1433048539 /nfs/dbraw/zinc/04/85/39/1433048539.db2.gz RIWUCZFHKCRZLC-GJZGRUSLSA-N 0 0 397.218 3.419 20 5 GGBDRN CN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000193729735 1433048583 /nfs/dbraw/zinc/04/85/83/1433048583.db2.gz RIWUCZFHKCRZLC-CABCVRRESA-N 0 0 397.218 3.419 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193737234 1433049731 /nfs/dbraw/zinc/04/97/31/1433049731.db2.gz BLNOXNCVYYWBJV-AWEZNQCLSA-N 0 0 385.420 3.336 20 5 GGBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2nnc3n2CCC3)c1 ZINC000193741250 1433050377 /nfs/dbraw/zinc/05/03/77/1433050377.db2.gz REJSQOJKAMAGCP-UHFFFAOYSA-N 0 0 392.419 3.164 20 5 GGBDRN COC(=O)c1cc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(F)cc1F ZINC000193746626 1433051245 /nfs/dbraw/zinc/05/12/45/1433051245.db2.gz JWGZNTULXFTYBL-UHFFFAOYSA-N 0 0 379.319 3.024 20 5 GGBDRN CCOc1ccc(NC(=O)CN2CCCN(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000193777645 1433057334 /nfs/dbraw/zinc/05/73/34/1433057334.db2.gz GQQYGHFCBGIEKP-UHFFFAOYSA-N 0 0 398.463 3.144 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccccc1N1CCCCC1 ZINC000193813249 1433064999 /nfs/dbraw/zinc/06/49/99/1433064999.db2.gz UDLODFQVBNXODB-UHFFFAOYSA-N 0 0 396.447 3.182 20 5 GGBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCC(OCCC(C)C)CC2)cc1C ZINC000193813804 1433065400 /nfs/dbraw/zinc/06/54/00/1433065400.db2.gz ZUGGMBJXAJCELP-UHFFFAOYSA-N 0 0 384.498 3.427 20 5 GGBDRN Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000193813948 1433065403 /nfs/dbraw/zinc/06/54/03/1433065403.db2.gz NQBHPZYOMZHJGC-UHFFFAOYSA-N 0 0 396.447 3.101 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccccc1OC(F)(F)F ZINC000193813443 1433065411 /nfs/dbraw/zinc/06/54/11/1433065411.db2.gz YAJBSDRPQQMCBY-UHFFFAOYSA-N 0 0 397.309 3.091 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC1CCN(c2ccccc2)CC1 ZINC000193832830 1433068890 /nfs/dbraw/zinc/06/88/90/1433068890.db2.gz BGSBYYLEUBFXLM-UHFFFAOYSA-N 0 0 384.436 3.072 20 5 GGBDRN COc1cc(OCC(=O)N(CC(F)F)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000193857551 1433074096 /nfs/dbraw/zinc/07/40/96/1433074096.db2.gz JNSOUFLZEKKGDI-UHFFFAOYSA-N 0 0 384.310 3.420 20 5 GGBDRN COc1cccc(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)c1[N+](=O)[O-] ZINC000193880929 1433077582 /nfs/dbraw/zinc/07/75/82/1433077582.db2.gz AJMABXBVEXNZKC-CYBMUJFWSA-N 0 0 381.392 3.017 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)N2CCCCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000193881763 1433077593 /nfs/dbraw/zinc/07/75/93/1433077593.db2.gz BWUXHRRADLTHCP-QGZVFWFLSA-N 0 0 382.420 3.381 20 5 GGBDRN O=C(COc1ccc(Cl)cc1F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000193881147 1433077701 /nfs/dbraw/zinc/07/77/01/1433077701.db2.gz DHLLPJDPROLIHA-UHFFFAOYSA-N 0 0 393.802 3.115 20 5 GGBDRN COc1cccc(C(=O)N(Cc2cccs2)C[C@H]2CCCO2)c1[N+](=O)[O-] ZINC000193884515 1433078165 /nfs/dbraw/zinc/07/81/65/1433078165.db2.gz RBFMBXJTHHWTDJ-CYBMUJFWSA-N 0 0 376.434 3.486 20 5 GGBDRN CCN(CCc1ccccc1)C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000193887167 1433078408 /nfs/dbraw/zinc/07/84/08/1433078408.db2.gz XJFRKXMYBCMZRM-UHFFFAOYSA-N 0 0 375.812 3.278 20 5 GGBDRN O=C(Cc1ccccc1)N1CCC[C@H]1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000193900032 1433080675 /nfs/dbraw/zinc/08/06/75/1433080675.db2.gz SDLFCYDPMOTXQE-INIZCTEOSA-N 0 0 389.358 3.045 20 5 GGBDRN COc1cccc(C(=O)N2CCC[C@@H](C(=O)Nc3ccccc3)C2)c1[N+](=O)[O-] ZINC000193912811 1433083356 /nfs/dbraw/zinc/08/33/56/1433083356.db2.gz FHHZTDKDPAGULX-CQSZACIVSA-N 0 0 383.404 3.094 20 5 GGBDRN Cc1nn(C)c(C(=O)NCc2ccc(-c3nc4ccccc4s3)o2)c1[N+](=O)[O-] ZINC000193928109 1433086486 /nfs/dbraw/zinc/08/64/86/1433086486.db2.gz GETRGJRVTXIYDZ-UHFFFAOYSA-N 0 0 397.416 3.436 20 5 GGBDRN CCOc1cc(C(=O)Nc2nccn2-c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000193933405 1433087795 /nfs/dbraw/zinc/08/77/95/1433087795.db2.gz JGEAJBMNSKLWTE-UHFFFAOYSA-N 0 0 382.376 3.440 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2ccc3ncccc3c2)cc1OC ZINC000193939633 1433089091 /nfs/dbraw/zinc/08/90/91/1433089091.db2.gz HVRZUMGLEYMSDS-UHFFFAOYSA-N 0 0 381.388 3.480 20 5 GGBDRN COc1ccc(Cl)cc1NC(=O)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000193940546 1433089313 /nfs/dbraw/zinc/08/93/13/1433089313.db2.gz PSLZXIWKUVVNPY-JTQLQIEISA-N 0 0 377.784 3.073 20 5 GGBDRN C[C@@H](NC(=O)C(=O)Nc1ccccc1OC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000193941904 1433089390 /nfs/dbraw/zinc/08/93/90/1433089390.db2.gz NKUYDOKPSNUBTA-SNVBAGLBSA-N 0 0 379.319 3.012 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1cccc(OC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000193942858 1433089537 /nfs/dbraw/zinc/08/95/37/1433089537.db2.gz YHWOQDPAXZMUIQ-JTQLQIEISA-N 0 0 397.309 3.309 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccccc1OC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000193942701 1433089540 /nfs/dbraw/zinc/08/95/40/1433089540.db2.gz UYBCLISESUVLRD-JTQLQIEISA-N 0 0 397.309 3.309 20 5 GGBDRN C[C@H](NC(=O)C(=O)Nc1ccc2oc(C3CC3)nc2c1)c1cccc([N+](=O)[O-])c1 ZINC000193944960 1433089796 /nfs/dbraw/zinc/08/97/96/1433089796.db2.gz GFVYMTUXWXPXGC-NSHDSACASA-N 0 0 394.387 3.429 20 5 GGBDRN Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000193943550 1433089844 /nfs/dbraw/zinc/08/98/44/1433089844.db2.gz BLNHZGRERKBNJW-HNNXBMFYSA-N 0 0 396.447 3.319 20 5 GGBDRN CC(C)COc1cccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193943890 1433089868 /nfs/dbraw/zinc/08/98/68/1433089868.db2.gz HTKURTZBEWMYTE-CQSZACIVSA-N 0 0 385.420 3.446 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)c1cc(F)ccc1OC ZINC000193945949 1433090133 /nfs/dbraw/zinc/09/01/33/1433090133.db2.gz KIWYFFVYDSSSSE-NSHDSACASA-N 0 0 377.372 3.312 20 5 GGBDRN COc1ccc(S(=O)(=O)N(C)[C@@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000193949222 1433090736 /nfs/dbraw/zinc/09/07/36/1433090736.db2.gz HWUUZGHPPIPAAY-JTQLQIEISA-N 0 0 386.376 3.263 20 5 GGBDRN Cc1ccccc1C[C@@H](C)NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000193952869 1433091250 /nfs/dbraw/zinc/09/12/50/1433091250.db2.gz RISXNYXTAAUKEY-GFCCVEGCSA-N 0 0 375.812 3.243 20 5 GGBDRN CC(C)OCc1ccc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 ZINC000193960022 1433092724 /nfs/dbraw/zinc/09/27/24/1433092724.db2.gz BGWXAECGAIMEIG-UHFFFAOYSA-N 0 0 385.376 3.066 20 5 GGBDRN COc1cccc(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c1[N+](=O)[O-] ZINC000193963701 1433093167 /nfs/dbraw/zinc/09/31/67/1433093167.db2.gz AUKVVQBRYWRHAU-GFCCVEGCSA-N 0 0 383.404 3.443 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccnn1Cc1ccc(F)cc1 ZINC000193965111 1433093558 /nfs/dbraw/zinc/09/35/58/1433093558.db2.gz IXCXPBHIDMCYKI-UHFFFAOYSA-N 0 0 384.367 3.386 20 5 GGBDRN O=C(Cc1ccccc1)N1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000193968603 1433093753 /nfs/dbraw/zinc/09/37/53/1433093753.db2.gz QJNDTZACCQJQHK-UHFFFAOYSA-N 0 0 376.416 3.034 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(CN2CCCC2=O)cc1 ZINC000193982111 1433095811 /nfs/dbraw/zinc/09/58/11/1433095811.db2.gz TXPSTTLTFIHLES-UHFFFAOYSA-N 0 0 396.447 3.059 20 5 GGBDRN CNC(=O)c1cc(Cl)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000193985112 1433096463 /nfs/dbraw/zinc/09/64/63/1433096463.db2.gz PZMHJMAGJUGLPF-UHFFFAOYSA-N 0 0 377.784 3.015 20 5 GGBDRN CCN(Cc1cccs1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194010353 1433100483 /nfs/dbraw/zinc/10/04/83/1433100483.db2.gz RJOATDZPYWFDOY-UHFFFAOYSA-N 0 0 399.375 3.245 20 5 GGBDRN CCCNC(=O)c1cccc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000194022977 1433102591 /nfs/dbraw/zinc/10/25/91/1433102591.db2.gz HNXXVBWVRBGZJK-UHFFFAOYSA-N 0 0 382.420 3.231 20 5 GGBDRN COc1cccc(C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c1[N+](=O)[O-] ZINC000194024878 1433102937 /nfs/dbraw/zinc/10/29/37/1433102937.db2.gz RONFAFGKXRJAHS-UHFFFAOYSA-N 0 0 383.404 3.400 20 5 GGBDRN O=C(Nc1nnc(-c2c(F)cccc2Cl)s1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000194027028 1433103567 /nfs/dbraw/zinc/10/35/67/1433103567.db2.gz PCNSHTPJYCGUPW-UHFFFAOYSA-N 0 0 395.759 3.259 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(=O)Nc1ccccc1C(C)(C)C ZINC000194027441 1433103612 /nfs/dbraw/zinc/10/36/12/1433103612.db2.gz QMRFVFDDMJXPPF-UHFFFAOYSA-N 0 0 385.420 3.156 20 5 GGBDRN COc1ccc(CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000194031522 1433104203 /nfs/dbraw/zinc/10/42/03/1433104203.db2.gz BZMMCBYQZFFHPO-UHFFFAOYSA-N 0 0 383.404 3.042 20 5 GGBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3ccnc(N4CCCCC4)c3)cc2N1 ZINC000194040224 1433105803 /nfs/dbraw/zinc/10/58/03/1433105803.db2.gz IYVYEDKXJUKOKR-UHFFFAOYSA-N 0 0 381.436 3.477 20 5 GGBDRN Cc1cc(C)n(-c2ccc(CNc3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)cn2)n1 ZINC000194041646 1433106071 /nfs/dbraw/zinc/10/60/71/1433106071.db2.gz MBOGPZDUZYDWFJ-UHFFFAOYSA-N 0 0 392.419 3.289 20 5 GGBDRN Cc1cccc2sc(NC(=O)CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)nc21 ZINC000194048092 1433107111 /nfs/dbraw/zinc/10/71/11/1433107111.db2.gz NXCZRKUSRYUJEL-UHFFFAOYSA-N 0 0 384.417 3.190 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)c2ncccc12 ZINC000194055128 1433109019 /nfs/dbraw/zinc/10/90/19/1433109019.db2.gz BMTGUVQCJMFLIH-LSDHHAIUSA-N 0 0 387.392 3.117 20 5 GGBDRN CC(C)(C)c1nc2cc(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)ccc2[nH]1 ZINC000194056690 1433109236 /nfs/dbraw/zinc/10/92/36/1433109236.db2.gz POBISHDUCCIBOZ-UHFFFAOYSA-N 0 0 395.419 3.137 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C(=O)N1CCCCC1)c1ccccc1 ZINC000194077069 1433112945 /nfs/dbraw/zinc/11/29/45/1433112945.db2.gz FMISCHJVXMWLJP-HXUWFJFHSA-N 0 0 383.448 3.447 20 5 GGBDRN Cc1csc([C@H]2CN(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CCO2)n1 ZINC000194079209 1433113226 /nfs/dbraw/zinc/11/32/26/1433113226.db2.gz NKXCPHLRUBOGEL-SWLSCSKDSA-N 0 0 376.438 3.204 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[C@@H]1c1cccc(C)c1 ZINC000194088800 1433114810 /nfs/dbraw/zinc/11/48/10/1433114810.db2.gz VZVQXGCGXCXVPI-QGZVFWFLSA-N 0 0 383.404 3.214 20 5 GGBDRN COc1cccc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1[N+](=O)[O-] ZINC000194088782 1433114829 /nfs/dbraw/zinc/11/48/29/1433114829.db2.gz ZJTFODAZCYOYQH-UHFFFAOYSA-N 0 0 383.404 3.482 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)ccc21 ZINC000194095084 1433116241 /nfs/dbraw/zinc/11/62/41/1433116241.db2.gz AQSNIWJTRGMACL-UHFFFAOYSA-N 0 0 380.404 3.310 20 5 GGBDRN CC1CCC(NS(=O)(=O)c2ccc(NC3CCOCC3)c([N+](=O)[O-])c2)CC1 ZINC000194100483 1433117659 /nfs/dbraw/zinc/11/76/59/1433117659.db2.gz NFSDYNAIORAMTF-UHFFFAOYSA-N 0 0 397.497 3.043 20 5 GGBDRN Cc1nn(C)c(C(=O)Nc2ccc(-c3ncc4n3CCCC4)cc2)c1[N+](=O)[O-] ZINC000194106649 1433118739 /nfs/dbraw/zinc/11/87/39/1433118739.db2.gz DXNJZKKWXFMMJB-UHFFFAOYSA-N 0 0 380.408 3.089 20 5 GGBDRN Cc1nn(C)c(C(=O)NCCc2ccc(OCc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000194108948 1433119062 /nfs/dbraw/zinc/11/90/62/1433119062.db2.gz DLUSIQGSZFOAJY-UHFFFAOYSA-N 0 0 394.431 3.188 20 5 GGBDRN CCCN(C(=O)CCc1nc(-c2ccccn2)no1)c1cccc([N+](=O)[O-])c1 ZINC000194120489 1433121046 /nfs/dbraw/zinc/12/10/46/1433121046.db2.gz ODGPNURAGJCIJJ-UHFFFAOYSA-N 0 0 381.392 3.416 20 5 GGBDRN COc1cccc(C(=O)Nc2ccccc2OCCn2ccnc2)c1[N+](=O)[O-] ZINC000194124159 1433121695 /nfs/dbraw/zinc/12/16/95/1433121695.db2.gz DDCHIKZYSMAUQC-UHFFFAOYSA-N 0 0 382.376 3.131 20 5 GGBDRN CCCN(C(=O)CSc1nnnn1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000194128756 1433122354 /nfs/dbraw/zinc/12/23/54/1433122354.db2.gz HEBSFGZAHMCZFD-UHFFFAOYSA-N 0 0 390.469 3.232 20 5 GGBDRN CCCN(C(=O)[C@@H](C)n1nnc(-c2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000194133481 1433123276 /nfs/dbraw/zinc/12/32/76/1433123276.db2.gz YBYWUZVUTGVPJJ-CQSZACIVSA-N 0 0 380.408 3.253 20 5 GGBDRN Nc1ccc(C(=O)N2CCC(Oc3ccc(F)cc3F)CC2)cc1[N+](=O)[O-] ZINC000194134757 1433123602 /nfs/dbraw/zinc/12/36/02/1433123602.db2.gz FMOQSJXAZWATFW-UHFFFAOYSA-N 0 0 377.347 3.139 20 5 GGBDRN COc1cccc(C(=O)NCC2(c3ccccc3C)CCOCC2)c1[N+](=O)[O-] ZINC000194137134 1433123890 /nfs/dbraw/zinc/12/38/90/1433123890.db2.gz MAAHYBWJIRWUSC-UHFFFAOYSA-N 0 0 384.432 3.390 20 5 GGBDRN CCCN(C(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000194140040 1433124237 /nfs/dbraw/zinc/12/42/37/1433124237.db2.gz IBBSDASOWLBYSL-MRXNPFEDSA-N 0 0 390.484 3.415 20 5 GGBDRN CCCN(C(=O)CCn1cnc2ccccc2c1=O)c1cccc([N+](=O)[O-])c1 ZINC000194141636 1433124427 /nfs/dbraw/zinc/12/44/27/1433124427.db2.gz UDAFPGRBYIBNEU-UHFFFAOYSA-N 0 0 380.404 3.138 20 5 GGBDRN COc1cccc(C(=O)N2CCC(OCCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000194165023 1433129853 /nfs/dbraw/zinc/12/98/53/1433129853.db2.gz RJEOWDHVGZBLLB-UHFFFAOYSA-N 0 0 384.432 3.467 20 5 GGBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000194202253 1433137675 /nfs/dbraw/zinc/13/76/75/1433137675.db2.gz HHMDVOLSSRWPJC-UHFFFAOYSA-N 0 0 383.751 3.056 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)c1 ZINC000194202431 1433137684 /nfs/dbraw/zinc/13/76/84/1433137684.db2.gz OISQJBBRYKGPNI-QGZVFWFLSA-N 0 0 385.445 3.020 20 5 GGBDRN C[C@H](O)c1ccc(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000194202788 1433137816 /nfs/dbraw/zinc/13/78/16/1433137816.db2.gz ODKDTAMZKKUXSL-HNNXBMFYSA-N 0 0 383.448 3.181 20 5 GGBDRN Cc1cc(C)n(-c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2F)n1 ZINC000194202608 1433137856 /nfs/dbraw/zinc/13/78/56/1433137856.db2.gz UIPODKDCBPQCEV-UHFFFAOYSA-N 0 0 390.396 3.337 20 5 GGBDRN CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)CC1=O ZINC000194211071 1433139896 /nfs/dbraw/zinc/13/98/96/1433139896.db2.gz DKBDPIUHTPMDQB-CQSZACIVSA-N 0 0 391.493 3.228 20 5 GGBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCN(c3ccccc3)CC2)c(Cl)c1 ZINC000194213099 1433140319 /nfs/dbraw/zinc/14/03/19/1433140319.db2.gz PIDPLLRIRUQVEM-UHFFFAOYSA-N 0 0 395.868 3.149 20 5 GGBDRN C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000194218032 1433140958 /nfs/dbraw/zinc/14/09/58/1433140958.db2.gz WTCMCUBNOWREPT-YVEFUNNKSA-N 0 0 385.445 3.000 20 5 GGBDRN COC[C@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000194281922 1433154718 /nfs/dbraw/zinc/15/47/18/1433154718.db2.gz RTQJMCWNTVEHMX-KRWDZBQOSA-N 0 0 377.828 3.478 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000194286472 1433155533 /nfs/dbraw/zinc/15/55/33/1433155533.db2.gz FNCKMGUPSZVNKQ-YJYMSZOUSA-N 0 0 380.416 3.275 20 5 GGBDRN CCOC(=O)[C@]1(C(C)C)CCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000194286458 1433155558 /nfs/dbraw/zinc/15/55/58/1433155558.db2.gz FNCKMGUPSZVNKQ-BFUOFWGJSA-N 0 0 380.416 3.275 20 5 GGBDRN CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000194308624 1433159231 /nfs/dbraw/zinc/15/92/31/1433159231.db2.gz SMNGOBMJGBLLMX-FQEVSTJZSA-N 0 0 387.436 3.056 20 5 GGBDRN O=C(NCC1(c2ccc(F)cc2)CC1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000194316335 1433160352 /nfs/dbraw/zinc/16/03/52/1433160352.db2.gz DYQFBDPXCDOFHG-UHFFFAOYSA-N 0 0 398.438 3.297 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)N(C)Cc1c(F)cccc1Cl ZINC000194319582 1433160838 /nfs/dbraw/zinc/16/08/38/1433160838.db2.gz RJBNQJJFBIOLAA-UHFFFAOYSA-N 0 0 381.791 3.466 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Oc1ccc(Br)cc1 ZINC000194330317 1433162623 /nfs/dbraw/zinc/16/26/23/1433162623.db2.gz YXHZGRKCUBDLGU-UHFFFAOYSA-N 0 0 376.159 3.264 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Oc1ccc(F)cc1Br ZINC000194332545 1433163016 /nfs/dbraw/zinc/16/30/16/1433163016.db2.gz UWFMEPJDMKJOLO-UHFFFAOYSA-N 0 0 394.149 3.403 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCCSCc1ccccc1F ZINC000194335890 1433163197 /nfs/dbraw/zinc/16/31/97/1433163197.db2.gz WLVBFFBSWYJEOZ-UHFFFAOYSA-N 0 0 388.417 3.085 20 5 GGBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(OCCC(C)C)CC1 ZINC000194335043 1433163292 /nfs/dbraw/zinc/16/32/92/1433163292.db2.gz YJYLFVHTAHXLPA-UHFFFAOYSA-N 0 0 379.457 3.069 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC(OCCC(C)C)CC1 ZINC000194335161 1433163335 /nfs/dbraw/zinc/16/33/35/1433163335.db2.gz XBNIZUCMNLVGDP-OAHLLOKOSA-N 0 0 393.484 3.458 20 5 GGBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC(N(C)c2ccccc2)CC1 ZINC000194349220 1433165145 /nfs/dbraw/zinc/16/51/45/1433165145.db2.gz ZMEHKMCMNWYIJE-UHFFFAOYSA-N 0 0 389.477 3.193 20 5 GGBDRN O=[N+]([O-])c1c(F)cccc1S(=O)(=O)N(Cc1ccc(F)cc1F)C1CC1 ZINC000194349843 1433165327 /nfs/dbraw/zinc/16/53/27/1433165327.db2.gz YHTRCGCAUZEZHW-UHFFFAOYSA-N 0 0 386.351 3.365 20 5 GGBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1cc(Cl)c2c(c1)OCCO2 ZINC000194356237 1433166219 /nfs/dbraw/zinc/16/62/19/1433166219.db2.gz BSNCFJKJATWOQI-UHFFFAOYSA-N 0 0 391.811 3.361 20 5 GGBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(N2C[C@H](C)O[C@@H](C)C2)ccn1 ZINC000194362810 1433167213 /nfs/dbraw/zinc/16/72/13/1433167213.db2.gz CVJXSTSKZDFYCF-GJZGRUSLSA-N 0 0 384.436 3.473 20 5 GGBDRN COc1cc(CCNC(=O)N(C)c2ccc(F)cc2)c([N+](=O)[O-])cc1OC ZINC000194371155 1433168156 /nfs/dbraw/zinc/16/81/56/1433168156.db2.gz AGYMEWYISBIEOJ-UHFFFAOYSA-N 0 0 377.372 3.140 20 5 GGBDRN COc1cccc(C(=O)N[C@@H]2CCCN(c3ccc(F)cc3C)C2)c1[N+](=O)[O-] ZINC000194385693 1433170306 /nfs/dbraw/zinc/17/03/06/1433170306.db2.gz MJGYYAMUGOQWRQ-OAHLLOKOSA-N 0 0 387.411 3.450 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCCCc1cc(N)n(-c2ccccc2)n1 ZINC000194395146 1433171794 /nfs/dbraw/zinc/17/17/94/1433171794.db2.gz IEIQDLJSSUSEJI-UHFFFAOYSA-N 0 0 379.420 3.034 20 5 GGBDRN COc1cccc(C(=O)N2Cc3ccccc3C[C@H]2c2nnc(C)o2)c1[N+](=O)[O-] ZINC000194407616 1433173242 /nfs/dbraw/zinc/17/32/42/1433173242.db2.gz VPJJTPVRRJOKGU-INIZCTEOSA-N 0 0 394.387 3.235 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1c(C)nn(-c2ccccc2)c1C ZINC000194416936 1433174746 /nfs/dbraw/zinc/17/47/46/1433174746.db2.gz KGTCIGFPSVPFAD-UHFFFAOYSA-N 0 0 380.404 3.336 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1c(C)nn(-c2ccc(F)cc2)c1C ZINC000194417238 1433174780 /nfs/dbraw/zinc/17/47/80/1433174780.db2.gz DADGTEYJULNVSB-UHFFFAOYSA-N 0 0 398.394 3.475 20 5 GGBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 ZINC000194420941 1433175148 /nfs/dbraw/zinc/17/51/48/1433175148.db2.gz VUKUEPYCXQPPAV-UHFFFAOYSA-N 0 0 380.229 3.050 20 5 GGBDRN Cc1cc(C(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000194420969 1433175393 /nfs/dbraw/zinc/17/53/93/1433175393.db2.gz BISUJEVPKDDDLM-UHFFFAOYSA-N 0 0 385.395 3.031 20 5 GGBDRN O=C(NCC(=O)N1CCCc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000194422098 1433175401 /nfs/dbraw/zinc/17/54/01/1433175401.db2.gz QIIDKNYQQBEKMK-UHFFFAOYSA-N 0 0 388.811 3.349 20 5 GGBDRN C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000194427782 1433176306 /nfs/dbraw/zinc/17/63/06/1433176306.db2.gz KEBZQOPZEAEKRA-LLVKDONJSA-N 0 0 391.811 3.436 20 5 GGBDRN O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)c1 ZINC000194434668 1433177541 /nfs/dbraw/zinc/17/75/41/1433177541.db2.gz ZDROFZLIZUIERP-MAUKXSAKSA-N 0 0 376.434 3.041 20 5 GGBDRN CC(C)OCc1ccc(N[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000194442821 1433178898 /nfs/dbraw/zinc/17/88/98/1433178898.db2.gz YIQJYWZSMACSHB-GOSISDBHSA-N 0 0 383.404 3.264 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(C(=O)NCc2ccc(F)cc2)CC1 ZINC000194457395 1433181284 /nfs/dbraw/zinc/18/12/84/1433181284.db2.gz VIFAKUGMHMESON-UHFFFAOYSA-N 0 0 399.422 3.211 20 5 GGBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1cccc(O)c1 ZINC000194462519 1433182305 /nfs/dbraw/zinc/18/23/05/1433182305.db2.gz IRNDHXOGBJIROT-UHFFFAOYSA-N 0 0 383.326 3.438 20 5 GGBDRN CCOC(=O)CCN(C)C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000194465469 1433182542 /nfs/dbraw/zinc/18/25/42/1433182542.db2.gz ISRMDRAIIBXTBU-GJZGRUSLSA-N 0 0 391.468 3.102 20 5 GGBDRN C[C@H]1CCCC[C@@H]1CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000194463702 1433182606 /nfs/dbraw/zinc/18/26/06/1433182606.db2.gz IYMHVZJNWNATIR-WDEREUQCSA-N 0 0 385.367 3.077 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1C ZINC000194470611 1433183411 /nfs/dbraw/zinc/18/34/11/1433183411.db2.gz ITPLDFWEDZTWPX-UHFFFAOYSA-N 0 0 377.422 3.226 20 5 GGBDRN C[C@H](NC(=O)NCc1ccc(Cn2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000194481531 1433185156 /nfs/dbraw/zinc/18/51/56/1433185156.db2.gz WWWDGLJSZDSEHB-HNNXBMFYSA-N 0 0 379.420 3.400 20 5 GGBDRN C[C@@H](NC(=O)NCc1ccc(Cn2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000194481546 1433185158 /nfs/dbraw/zinc/18/51/58/1433185158.db2.gz WWWDGLJSZDSEHB-OAHLLOKOSA-N 0 0 379.420 3.400 20 5 GGBDRN CC(C)(C)OC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000194482329 1433185484 /nfs/dbraw/zinc/18/54/84/1433185484.db2.gz OTPCUFDTFSIQQG-UHFFFAOYSA-N 0 0 383.832 3.331 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(CN2CCO[C@@H](C)C2)c1 ZINC000194487873 1433186352 /nfs/dbraw/zinc/18/63/52/1433186352.db2.gz ODKDDLNUHQYPNC-INIZCTEOSA-N 0 0 383.448 3.054 20 5 GGBDRN CN(C)[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000194489868 1433186653 /nfs/dbraw/zinc/18/66/53/1433186653.db2.gz UNYDLFKEGJNPEF-QGZVFWFLSA-N 0 0 376.844 3.350 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCc3c(cccc3NC(C)=O)C2)c1 ZINC000194502523 1433188550 /nfs/dbraw/zinc/18/85/50/1433188550.db2.gz LCENOOXLIQFCML-UHFFFAOYSA-N 0 0 385.445 3.474 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1 ZINC000194509901 1433190005 /nfs/dbraw/zinc/19/00/05/1433190005.db2.gz NFASJBPIQRBWRZ-UHFFFAOYSA-N 0 0 399.472 3.273 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000194518490 1433191108 /nfs/dbraw/zinc/19/11/08/1433191108.db2.gz LADPSFOLRANJJK-AWEZNQCLSA-N 0 0 377.441 3.280 20 5 GGBDRN O=C([C@H]1CCCc2cccnc21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000194522929 1433191628 /nfs/dbraw/zinc/19/16/28/1433191628.db2.gz NPWSBQUEIJFKOY-IBGZPJMESA-N 0 0 381.432 3.480 20 5 GGBDRN COc1ccc(CCNC(=O)c2c(C)cccc2[N+](=O)[O-])cc1OC(F)F ZINC000194530539 1433193037 /nfs/dbraw/zinc/19/30/37/1433193037.db2.gz GNYFYHNAOCVGIV-UHFFFAOYSA-N 0 0 380.347 3.486 20 5 GGBDRN Cc1c(CNC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)oc2ccc(F)cc12 ZINC000194539448 1433194450 /nfs/dbraw/zinc/19/44/50/1433194450.db2.gz GVZBOAIQSHBQGQ-GFCCVEGCSA-N 0 0 399.378 3.223 20 5 GGBDRN Cc1c(CNC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)oc2ccc(F)cc12 ZINC000194539460 1433194515 /nfs/dbraw/zinc/19/45/15/1433194515.db2.gz GVZBOAIQSHBQGQ-LBPRGKRZSA-N 0 0 399.378 3.223 20 5 GGBDRN C[C@@H](NC(=O)N1CCN(CCOc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000194554585 1433196357 /nfs/dbraw/zinc/19/63/57/1433196357.db2.gz ZGNLDKUSAUFBJR-QGZVFWFLSA-N 0 0 398.463 3.062 20 5 GGBDRN COc1cccc(C(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)c1[N+](=O)[O-] ZINC000194554652 1433196401 /nfs/dbraw/zinc/19/64/01/1433196401.db2.gz ZEXJGMFITWCHFC-MZHQLVBMSA-N 0 0 376.434 3.174 20 5 GGBDRN COc1cccc(C(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000194554626 1433196451 /nfs/dbraw/zinc/19/64/51/1433196451.db2.gz ZEXJGMFITWCHFC-RYZVSIALSA-N 0 0 376.434 3.174 20 5 GGBDRN Cc1nc(-c2cccc(NC(=O)C(=O)NCc3cccc([N+](=O)[O-])c3)c2)cs1 ZINC000194560255 1433197560 /nfs/dbraw/zinc/19/75/60/1433197560.db2.gz QXNTVPHLNWCWLJ-UHFFFAOYSA-N 0 0 396.428 3.282 20 5 GGBDRN NC(=O)CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 ZINC000194560698 1433197575 /nfs/dbraw/zinc/19/75/75/1433197575.db2.gz HKPNNSVCNSRJKL-UHFFFAOYSA-N 0 0 399.472 3.474 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccn(-c2cc(C)ccc2OC)n1 ZINC000194563487 1433197821 /nfs/dbraw/zinc/19/78/21/1433197821.db2.gz YPNSDLMCFIEFGX-UHFFFAOYSA-N 0 0 396.403 3.036 20 5 GGBDRN CC(C)n1cnnc1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194577161 1433200536 /nfs/dbraw/zinc/20/05/36/1433200536.db2.gz ABCWRDLBGGAICR-UHFFFAOYSA-N 0 0 395.419 3.276 20 5 GGBDRN O=C(NCc1ccc2ncccc2c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000194585418 1433201696 /nfs/dbraw/zinc/20/16/96/1433201696.db2.gz SNSOZEWQPCRIRV-UHFFFAOYSA-N 0 0 378.388 3.116 20 5 GGBDRN C[C@@H](Sc1n[nH]c(Cc2ccccc2)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000194589241 1433202432 /nfs/dbraw/zinc/20/24/32/1433202432.db2.gz KMCYLBPUMNULNO-GFCCVEGCSA-N 0 0 383.433 3.423 20 5 GGBDRN NC(=O)c1ccc(CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1 ZINC000194593195 1433203032 /nfs/dbraw/zinc/20/30/32/1433203032.db2.gz PDUNWKNOPVAVMM-UHFFFAOYSA-N 0 0 390.399 3.367 20 5 GGBDRN COc1cccc([C@H](C)N2CCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)c1 ZINC000194594152 1433203109 /nfs/dbraw/zinc/20/31/09/1433203109.db2.gz QYMHFUHSESITDO-INIZCTEOSA-N 0 0 383.448 3.431 20 5 GGBDRN Cc1ccc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 ZINC000194596071 1433203378 /nfs/dbraw/zinc/20/33/78/1433203378.db2.gz ZLSSXGGMHCECFD-HXUWFJFHSA-N 0 0 383.448 3.357 20 5 GGBDRN C[C@@H](Sc1n[nH]c(Cc2ccccc2)n1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000194601248 1433203877 /nfs/dbraw/zinc/20/38/77/1433203877.db2.gz YIPFVMPZRZHXBS-GFCCVEGCSA-N 0 0 383.433 3.423 20 5 GGBDRN CN(C(=O)CSc1nnc(Cc2ccccc2)[nH]1)c1ccc([N+](=O)[O-])cc1 ZINC000194604436 1433204404 /nfs/dbraw/zinc/20/44/04/1433204404.db2.gz MAQPBZIHBQXSOW-UHFFFAOYSA-N 0 0 383.433 3.059 20 5 GGBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)CCCCc1ccccc1 ZINC000194631476 1433208157 /nfs/dbraw/zinc/20/81/57/1433208157.db2.gz LPVGYUVKJQVKCV-INIZCTEOSA-N 0 0 383.448 3.194 20 5 GGBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccccc1CN1CCSCC1 ZINC000194646935 1433210710 /nfs/dbraw/zinc/21/07/10/1433210710.db2.gz WNFGHHZQFQYABG-UHFFFAOYSA-N 0 0 386.477 3.465 20 5 GGBDRN O=Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2ccc(N3CCCCC3)cc2)c1 ZINC000194663091 1433212595 /nfs/dbraw/zinc/21/25/95/1433212595.db2.gz LXZPLJLDUIUORO-UHFFFAOYSA-N 0 0 383.404 3.415 20 5 GGBDRN O=C(NC[C@H]1CCC[C@H](O)C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194684432 1433215167 /nfs/dbraw/zinc/21/51/67/1433215167.db2.gz OACMTYPNKUWNAI-IRXDYDNUSA-N 0 0 384.432 3.455 20 5 GGBDRN COc1ccccc1-n1ncc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1C ZINC000194684691 1433215228 /nfs/dbraw/zinc/21/52/28/1433215228.db2.gz JHROOCXOTAXWQZ-UHFFFAOYSA-N 0 0 378.388 3.300 20 5 GGBDRN CN1C(=O)Cc2cc(NC(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000194688954 1433215685 /nfs/dbraw/zinc/21/56/85/1433215685.db2.gz SNKAUVZTWJXHMZ-UHFFFAOYSA-N 0 0 391.836 3.498 20 5 GGBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCC3CCOCC3)cc2[N+](=O)[O-])C1 ZINC000194688847 1433215756 /nfs/dbraw/zinc/21/57/56/1433215756.db2.gz KFJLRKVSHUTFFM-GJZGRUSLSA-N 0 0 375.469 3.234 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](C2N=NC(=S)N2C2CC2)C1 ZINC000194694895 1433216664 /nfs/dbraw/zinc/21/66/64/1433216664.db2.gz GSODBRLKZMSREB-GFCCVEGCSA-N 0 0 387.465 3.138 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(CS(=O)(=O)C(C)C)c1 ZINC000194698467 1433216868 /nfs/dbraw/zinc/21/68/68/1433216868.db2.gz LPMAJIZPHXVRIC-UHFFFAOYSA-N 0 0 376.434 3.479 20 5 GGBDRN CCc1noc2ncc(C(=O)Nc3cc(C)nn3-c3ccc([N+](=O)[O-])cc3)cc12 ZINC000194704635 1433217706 /nfs/dbraw/zinc/21/77/06/1433217706.db2.gz RSFOURGTBAKFOC-UHFFFAOYSA-N 0 0 392.375 3.440 20 5 GGBDRN COc1cccc(-c2noc(-c3cccc([N+](=O)[O-])c3N3CCOCC3)n2)c1 ZINC000194718530 1433219306 /nfs/dbraw/zinc/21/93/06/1433219306.db2.gz FPUGAWRWHAFDFG-UHFFFAOYSA-N 0 0 382.376 3.157 20 5 GGBDRN COc1cccc(C(=O)N2CCN(Cc3ccccc3Cl)CC2)c1[N+](=O)[O-] ZINC000194717377 1433219442 /nfs/dbraw/zinc/21/94/42/1433219442.db2.gz XTDZQBITOHOYNR-UHFFFAOYSA-N 0 0 389.839 3.215 20 5 GGBDRN Cc1ccc(NC(=O)C(=O)NC2(c3ccc(F)cc3F)CCC2)cc1[N+](=O)[O-] ZINC000194721136 1433219726 /nfs/dbraw/zinc/21/97/26/1433219726.db2.gz DXOWBGFSKXLAJD-UHFFFAOYSA-N 0 0 389.358 3.316 20 5 GGBDRN COc1cc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000194732109 1433221429 /nfs/dbraw/zinc/22/14/29/1433221429.db2.gz YQPDSHBTMMZBIJ-SNVBAGLBSA-N 0 0 377.784 3.014 20 5 GGBDRN COc1cc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000194732091 1433221495 /nfs/dbraw/zinc/22/14/95/1433221495.db2.gz YQPDSHBTMMZBIJ-JTQLQIEISA-N 0 0 377.784 3.014 20 5 GGBDRN Cc1ccc(CCC(=O)NCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000194745857 1433223636 /nfs/dbraw/zinc/22/36/36/1433223636.db2.gz VQKAFRKHXPREFL-UHFFFAOYSA-N 0 0 397.475 3.389 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cnn(-c2ccccc2OC)c1C ZINC000194750895 1433224391 /nfs/dbraw/zinc/22/43/91/1433224391.db2.gz LPPNLEVVYIBLQX-UHFFFAOYSA-N 0 0 396.403 3.036 20 5 GGBDRN O=C(N[C@H]1CC[C@@H](CO)CC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194764072 1433226686 /nfs/dbraw/zinc/22/66/86/1433226686.db2.gz HYDVLSBKYPPRPV-JCNLHEQBSA-N 0 0 384.432 3.455 20 5 GGBDRN CN(C)c1noc([C@H]2CCCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000194776387 1433229502 /nfs/dbraw/zinc/22/95/02/1433229502.db2.gz BGTLLANMIKXCCV-JTQLQIEISA-N 0 0 394.819 3.109 20 5 GGBDRN COc1cccc(C2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CC2)c1 ZINC000194785292 1433231710 /nfs/dbraw/zinc/23/17/10/1433231710.db2.gz LTBQSROHVMIISW-UHFFFAOYSA-N 0 0 380.404 3.500 20 5 GGBDRN CC(C)C(=O)NCCCNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194808444 1433236955 /nfs/dbraw/zinc/23/69/55/1433236955.db2.gz XAEALWSHAJAFLJ-UHFFFAOYSA-N 0 0 399.447 3.066 20 5 GGBDRN CN(CC(=O)NC1CC1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000194819892 1433240091 /nfs/dbraw/zinc/24/00/91/1433240091.db2.gz IPBQNRVPBQTCNI-UHFFFAOYSA-N 0 0 385.445 3.097 20 5 GGBDRN CC(C)C(=O)NCCN(C)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194827865 1433242250 /nfs/dbraw/zinc/24/22/50/1433242250.db2.gz ZOSUQOIHRTWMGV-UHFFFAOYSA-N 0 0 399.447 3.018 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1 ZINC000194837123 1433245190 /nfs/dbraw/zinc/24/51/90/1433245190.db2.gz CAHQSLJSVJOYHD-UHFFFAOYSA-N 0 0 383.286 3.289 20 5 GGBDRN COc1cccc(C2CCN(CN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)CC2)c1 ZINC000194843038 1433246524 /nfs/dbraw/zinc/24/65/24/1433246524.db2.gz KEIVBUJIAFEUNO-UHFFFAOYSA-N 0 0 395.415 3.037 20 5 GGBDRN COc1cc(OCC(=O)NCCCc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000194849046 1433248093 /nfs/dbraw/zinc/24/80/93/1433248093.db2.gz KMCCTNVLLIZDMS-UHFFFAOYSA-N 0 0 378.812 3.385 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000194849578 1433248357 /nfs/dbraw/zinc/24/83/57/1433248357.db2.gz ALCARMIYGAHOPS-ZDUSSCGKSA-N 0 0 398.337 3.092 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](O)COc1cccc(C(F)(F)F)c1 ZINC000194849432 1433248596 /nfs/dbraw/zinc/24/85/96/1433248596.db2.gz CZYHBLJEELHTGK-ZDUSSCGKSA-N 0 0 398.337 3.092 20 5 GGBDRN CSc1ccc(C(=O)Nc2cccc(CN3CCOCC3)c2)cc1[N+](=O)[O-] ZINC000194860683 1433250577 /nfs/dbraw/zinc/25/05/77/1433250577.db2.gz HZNSQPBUPNVHCM-UHFFFAOYSA-N 0 0 387.461 3.401 20 5 GGBDRN O=[N+]([O-])c1ccc(CNc2ccc(Cc3nnc4n3CCC4)cc2)c([N+](=O)[O-])c1 ZINC000194865497 1433251865 /nfs/dbraw/zinc/25/18/65/1433251865.db2.gz GTLPUVRVJUETOJ-UHFFFAOYSA-N 0 0 394.391 3.244 20 5 GGBDRN O=C(c1ccsc1)N1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000194867860 1433252309 /nfs/dbraw/zinc/25/23/09/1433252309.db2.gz UMLXAKHMTIZDID-UHFFFAOYSA-N 0 0 393.852 3.298 20 5 GGBDRN O=[N+]([O-])c1ccc(CN2CCC(Oc3ccc(F)nc3)CC2)c([N+](=O)[O-])c1 ZINC000194871799 1433253170 /nfs/dbraw/zinc/25/31/70/1433253170.db2.gz COGYUFBOCHMXIY-UHFFFAOYSA-N 0 0 376.344 3.081 20 5 GGBDRN CN(CC(=O)OC(C)(C)C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000194871658 1433253227 /nfs/dbraw/zinc/25/32/27/1433253227.db2.gz RSYLTJVVQHVFRP-UHFFFAOYSA-N 0 0 377.422 3.132 20 5 GGBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCc1ccc(OC(F)(F)F)cc1 ZINC000194873661 1433253966 /nfs/dbraw/zinc/25/39/66/1433253966.db2.gz ZOBWDJZFAVGEJG-UHFFFAOYSA-N 0 0 388.273 3.328 20 5 GGBDRN O=C(Nc1nc(-c2ccc[nH]2)cs1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194892016 1433258514 /nfs/dbraw/zinc/25/85/14/1433258514.db2.gz FYFXEBCDUKQWJV-UHFFFAOYSA-N 0 0 380.389 3.484 20 5 GGBDRN COc1cccc(C2CCN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000194895783 1433259265 /nfs/dbraw/zinc/25/92/65/1433259265.db2.gz LDLYPTZJJKWKOH-UHFFFAOYSA-N 0 0 390.461 3.313 20 5 GGBDRN COc1cccc(C2CCN(S(=O)(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1 ZINC000194895313 1433259477 /nfs/dbraw/zinc/25/94/77/1433259477.db2.gz JVDFBNJFDMFGKV-UHFFFAOYSA-N 0 0 394.424 3.311 20 5 GGBDRN COc1ccccc1N1CC[C@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000194897210 1433259790 /nfs/dbraw/zinc/25/97/90/1433259790.db2.gz OBIZRNGXVUZXEN-MRXNPFEDSA-N 0 0 399.447 3.015 20 5 GGBDRN C[C@@H](Nc1cc(F)cc(N2CCOCC2)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000194902316 1433260936 /nfs/dbraw/zinc/26/09/36/1433260936.db2.gz ZAYMPGJPPINXOZ-CYBMUJFWSA-N 0 0 388.399 3.010 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000194927541 1433266151 /nfs/dbraw/zinc/26/61/51/1433266151.db2.gz BQIKWYSQHGKAIG-UHFFFAOYSA-N 0 0 386.379 3.478 20 5 GGBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)c1 ZINC000194927283 1433266236 /nfs/dbraw/zinc/26/62/36/1433266236.db2.gz LWIXAUUPWUKKGM-UHFFFAOYSA-N 0 0 386.379 3.478 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 ZINC000194943371 1433269500 /nfs/dbraw/zinc/26/95/00/1433269500.db2.gz BUVZKEYLDWFPCU-AWEZNQCLSA-N 0 0 394.836 3.157 20 5 GGBDRN O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1cc([N+](=O)[O-])ccc1Cl ZINC000194948149 1433270807 /nfs/dbraw/zinc/27/08/07/1433270807.db2.gz UHXWQUBJOYSSRJ-UHFFFAOYSA-N 0 0 379.775 3.476 20 5 GGBDRN O=C(NCCCCO)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000194955286 1433272095 /nfs/dbraw/zinc/27/20/95/1433272095.db2.gz MBWPQGWVJSCSJR-UHFFFAOYSA-N 0 0 377.828 3.363 20 5 GGBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000194970721 1433274803 /nfs/dbraw/zinc/27/48/03/1433274803.db2.gz ZFUATNFKYPKKDA-UHFFFAOYSA-N 0 0 382.420 3.461 20 5 GGBDRN C[C@@H](NC(=O)Nc1cc(F)cc(N2CCOCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000194981408 1433276084 /nfs/dbraw/zinc/27/60/84/1433276084.db2.gz YNAUFIXRKOKRDU-CYBMUJFWSA-N 0 0 388.399 3.453 20 5 GGBDRN COc1cc(OCC(=O)N(Cc2ccco2)c2ccccn2)ccc1[N+](=O)[O-] ZINC000195023169 1433282127 /nfs/dbraw/zinc/28/21/27/1433282127.db2.gz CVSDKBQGNPELQQ-UHFFFAOYSA-N 0 0 383.360 3.204 20 5 GGBDRN O=C(NCCCCO)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000195024434 1433282441 /nfs/dbraw/zinc/28/24/41/1433282441.db2.gz 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O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H](c2nccs2)c2ccccc2)c1 ZINC000195061479 1433287058 /nfs/dbraw/zinc/28/70/58/1433287058.db2.gz NAGJKSYXQYVSAW-SJLPKXTDSA-N 0 0 385.445 3.170 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCCOc1ccc(F)cc1 ZINC000195084025 1433290523 /nfs/dbraw/zinc/29/05/23/1433290523.db2.gz XZCQLNJOIMNOLC-UHFFFAOYSA-N 0 0 377.372 3.011 20 5 GGBDRN CC[C@@H](C)[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)OC ZINC000195094541 1433291745 /nfs/dbraw/zinc/29/17/45/1433291745.db2.gz FBBUEWZZVLBWBX-QMTHXVAHSA-N 0 0 377.422 3.036 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccn(-c2ccccc2Cl)n1 ZINC000195105684 1433293150 /nfs/dbraw/zinc/29/31/50/1433293150.db2.gz YMLOFBJAVMAGIV-UHFFFAOYSA-N 0 0 386.795 3.373 20 5 GGBDRN Cc1c(C(=O)NCc2ccc(C(=O)Nc3ccncc3)cc2)cccc1[N+](=O)[O-] ZINC000195118908 1433294884 /nfs/dbraw/zinc/29/48/84/1433294884.db2.gz FRQYGCHCBSWUJE-UHFFFAOYSA-N 0 0 390.399 3.481 20 5 GGBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccnc1Oc1cccc(F)c1 ZINC000195152083 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INRMDYHWUVLTSH-YVMONPNESA-N 0 0 381.310 3.217 20 5 GGBDRN O=C(N=c1ccccn1Cc1ccccc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000255111397 1433876522 /nfs/dbraw/zinc/87/65/22/1433876522.db2.gz KHTGLQNWYSMUKW-UHFFFAOYSA-N 0 0 399.410 3.371 20 5 GGBDRN Cc1nn(CCC(=O)N=c2ccccn2Cc2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000255224974 1433878651 /nfs/dbraw/zinc/87/86/51/1433878651.db2.gz PUXSJWDSUNCBHQ-UHFFFAOYSA-N 0 0 393.447 3.084 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255266604 1433878822 /nfs/dbraw/zinc/87/88/22/1433878822.db2.gz YNBHCIXNNOIZMJ-BDJZEXMMSA-N 0 0 375.425 3.028 20 5 GGBDRN Cc1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)nc2nc(C(F)(F)F)nn21 ZINC000255265731 1433878835 /nfs/dbraw/zinc/87/88/35/1433878835.db2.gz IYFWQKZLGDJCCU-DAXSKMNVSA-N 0 0 392.297 3.012 20 5 GGBDRN COc1cc(CCNC(=O)/C=C\c2ccc(Cl)nc2)c([N+](=O)[O-])cc1OC ZINC000255319204 1433880216 /nfs/dbraw/zinc/88/02/16/1433880216.db2.gz RANIJTJEIWQJQN-XQRVVYSFSA-N 0 0 391.811 3.033 20 5 GGBDRN CC(C)(C)OC(=O)N[C@H](CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255344724 1433880919 /nfs/dbraw/zinc/88/09/19/1433880919.db2.gz PKPHSERRYIMTKG-BDJZEXMMSA-N 0 0 375.425 3.028 20 5 GGBDRN COC(=O)c1cc(C(=O)n2ccccc2=Nc2ccccc2)cc([N+](=O)[O-])c1 ZINC000255363166 1433881381 /nfs/dbraw/zinc/88/13/81/1433881381.db2.gz LBEMHPYBGSWVDB-UHFFFAOYSA-N 0 0 377.356 3.104 20 5 GGBDRN O=C(/C=C\c1ccc(I)o1)NCc1cccc([N+](=O)[O-])c1 ZINC000255398519 1433882311 /nfs/dbraw/zinc/88/23/11/1433882311.db2.gz UIVCUXUAZUKNFH-ALCCZGGFSA-N 0 0 398.156 3.122 20 5 GGBDRN C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255517534 1433884207 /nfs/dbraw/zinc/88/42/07/1433884207.db2.gz VACNBVMAOUIYEH-JKEYDSJLSA-N 0 0 375.425 3.076 20 5 GGBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000255517134 1433884309 /nfs/dbraw/zinc/88/43/09/1433884309.db2.gz GWNXQVMICZGEAZ-KMKOMSMNSA-N 0 0 379.332 3.341 20 5 GGBDRN C[C@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCN1C(=O)OC(C)(C)C 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COc1ccccc1[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1noc(C)n1 ZINC000255829973 1433889703 /nfs/dbraw/zinc/88/97/03/1433889703.db2.gz GDCHYMHNCDDFSL-ADYPVZHUSA-N 0 0 394.387 3.214 20 5 GGBDRN COC(=O)c1cc(-c2csc(NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)n2)c[nH]1 ZINC000255845231 1433890078 /nfs/dbraw/zinc/89/00/78/1433890078.db2.gz MTVGAKZRFSOQKB-DAXSKMNVSA-N 0 0 398.400 3.485 20 5 GGBDRN CN(C)c1ccc(N2CCC(NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000255887986 1433891032 /nfs/dbraw/zinc/89/10/32/1433891032.db2.gz GPJKULNNVXYTFT-XGICHPGQSA-N 0 0 394.475 3.459 20 5 GGBDRN O=[N+]([O-])c1ccccc1/C=C\CN(CCO)Cc1cnn(Cc2ccccc2)c1 ZINC000255892585 1433891135 /nfs/dbraw/zinc/89/11/35/1433891135.db2.gz RVEGPJLRUXTZPU-POHAHGRESA-N 0 0 392.459 3.347 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCNC[C@H]1c1ccccc1Cl ZINC000261716178 1433899756 /nfs/dbraw/zinc/89/97/56/1433899756.db2.gz DVPKHRDDGRTOAF-KRWDZBQOSA-N 0 0 389.839 3.190 20 5 GGBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCNC[C@@H]1c1cccc(F)c1 ZINC000261895152 1433910528 /nfs/dbraw/zinc/91/05/28/1433910528.db2.gz GAXHEERTRVIEAC-LJQANCHMSA-N 0 0 384.411 3.095 20 5 GGBDRN Nc1ccc(C(=O)NCc2cccc(NC(=O)C3CCCC3)c2)cc1[N+](=O)[O-] ZINC000262001355 1433921309 /nfs/dbraw/zinc/92/13/09/1433921309.db2.gz HDBCHJIRMTYLKT-UHFFFAOYSA-N 0 0 382.420 3.236 20 5 GGBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCNC[C@@H]1c1cccc(F)c1 ZINC000262106401 1433927304 /nfs/dbraw/zinc/92/73/04/1433927304.db2.gz ZQLRQEQJXTYINH-QGZVFWFLSA-N 0 0 377.803 3.103 20 5 GGBDRN CC(C)OC(=O)C[C@@H](NC(=O)CCc1ccccc1N)c1ccccc1[N+](=O)[O-] ZINC000262932364 1433967957 /nfs/dbraw/zinc/96/79/57/1433967957.db2.gz SWPZCOWXRAIWHZ-GOSISDBHSA-N 0 0 399.447 3.309 20 5 GGBDRN CC(C)OC(=O)C[C@H](NC(=O)CCc1ccccc1N)c1ccccc1[N+](=O)[O-] ZINC000262932365 1433968381 /nfs/dbraw/zinc/96/83/81/1433968381.db2.gz SWPZCOWXRAIWHZ-SFHVURJKSA-N 0 0 399.447 3.309 20 5 GGBDRN C[N@H+](CC(=O)[O-])[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000263517224 1434010548 /nfs/dbraw/zinc/01/05/48/1434010548.db2.gz PEZMSVUEWIBYEI-INIZCTEOSA-N 0 0 387.436 3.226 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CC(Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000263516205 1434010581 /nfs/dbraw/zinc/01/05/81/1434010581.db2.gz ABKWLFJUNJGPAK-UHFFFAOYSA-N 0 0 397.431 3.175 20 5 GGBDRN COc1cc(C[N@H+](CC(=O)[O-])C(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000263516659 1434010856 /nfs/dbraw/zinc/01/08/56/1434010856.db2.gz OZYZGBPHSKKCON-UHFFFAOYSA-N 0 0 388.420 3.477 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CC(Nc2cc(C)c([N+](=O)[O-])cc2Br)C1 ZINC000263538201 1434012370 /nfs/dbraw/zinc/01/23/70/1434012370.db2.gz AWDRNTXLVZQWCC-UHFFFAOYSA-N 0 0 386.246 3.015 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CC(Nc2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000263546303 1434012546 /nfs/dbraw/zinc/01/25/46/1434012546.db2.gz HERPZLMLPJTVBX-UHFFFAOYSA-N 0 0 375.347 3.271 20 5 GGBDRN O=C([O-])C[N@H+](CC1CC1)C1CC(Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000263550713 1434012983 /nfs/dbraw/zinc/01/29/83/1434012983.db2.gz KRCFGERQLYIKTI-UHFFFAOYSA-N 0 0 396.447 3.396 20 5 GGBDRN CC[N@H+](CC(=O)[O-])C1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000263552486 1434012996 /nfs/dbraw/zinc/01/29/96/1434012996.db2.gz LXJTVVSRZXHZGB-UHFFFAOYSA-N 0 0 390.465 3.094 20 5 GGBDRN C[N@H+](CC(=O)[O-])[C@@H]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000263569152 1434013696 /nfs/dbraw/zinc/01/36/96/1434013696.db2.gz ZBBMUISYLQRGTL-CQSZACIVSA-N 0 0 390.465 3.094 20 5 GGBDRN Cc1nn(CCC(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c(C)c1[N+](=O)[O-] ZINC000263649324 1434015369 /nfs/dbraw/zinc/01/53/69/1434015369.db2.gz GJOORJZVWZDSRV-LBPRGKRZSA-N 0 0 399.451 3.024 20 5 GGBDRN Cc1nn(CCC(=O)N(Cc2ccc(F)cc2F)C2CC2)c(C)c1[N+](=O)[O-] ZINC000263655695 1434016154 /nfs/dbraw/zinc/01/61/54/1434016154.db2.gz IGUOPLCTGDGZBW-UHFFFAOYSA-N 0 0 378.379 3.268 20 5 GGBDRN CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1OCCc2ccccc21 ZINC000263658301 1434016494 /nfs/dbraw/zinc/01/64/94/1434016494.db2.gz DBARNUSFYBHTPK-SFHVURJKSA-N 0 0 380.404 3.391 20 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CC(C)C(=O)NC[C@@H]1CCCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000263682471 1434020290 /nfs/dbraw/zinc/02/02/90/1434020290.db2.gz FAVQPBZNDGHWFU-LBPRGKRZSA-N 0 0 382.848 3.264 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N[C@@H](C)CCc2ccco2)ccc1[N+](=O)[O-] ZINC000263685115 1434020621 /nfs/dbraw/zinc/02/06/21/1434020621.db2.gz PYWQCGQQMNFIRI-HNAYVOBHSA-N 0 0 399.447 3.238 20 5 GGBDRN Cc1nn(CCC(=O)Nc2cccc(OCc3cccnc3)c2)c(C)c1[N+](=O)[O-] ZINC000263697269 1434022388 /nfs/dbraw/zinc/02/23/88/1434022388.db2.gz SPAPTLWUEPOVJW-UHFFFAOYSA-N 0 0 395.419 3.411 20 5 GGBDRN COc1ccc(CCC(=O)N2CCCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000263698190 1434022516 /nfs/dbraw/zinc/02/25/16/1434022516.db2.gz KYIIZGMVLWLKGK-UHFFFAOYSA-N 0 0 397.475 3.271 20 5 GGBDRN C[C@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc(N2CCOC2=O)c1 ZINC000263709923 1434023908 /nfs/dbraw/zinc/02/39/08/1434023908.db2.gz UBNCIHYHHABBCX-ZDUSSCGKSA-N 0 0 399.403 3.269 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCCN1C(=O)c1cccs1 ZINC000263713696 1434024333 /nfs/dbraw/zinc/02/43/33/1434024333.db2.gz BAOPHJDRBXFVRL-CQSZACIVSA-N 0 0 377.397 3.429 20 5 GGBDRN Cc1nn(CCC(=O)N[C@H]2CCSc3ccc(F)cc32)c(C)c1[N+](=O)[O-] ZINC000263716507 1434024603 /nfs/dbraw/zinc/02/46/03/1434024603.db2.gz XIQOZSHXSQIHTD-AWEZNQCLSA-N 0 0 378.429 3.291 20 5 GGBDRN Cn1ccnc1[C@@](O)(CCNc1ccc([N+](=O)[O-])c2cccnc12)C(F)(F)F ZINC000263721648 1434025446 /nfs/dbraw/zinc/02/54/46/1434025446.db2.gz ORGXLXPQDBCFFZ-INIZCTEOSA-N 0 0 395.341 3.129 20 5 GGBDRN CC[C@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1nnc2n1CCCCC2 ZINC000263743293 1434028150 /nfs/dbraw/zinc/02/81/50/1434028150.db2.gz AMJWZLOCFYOWSS-ZDUSSCGKSA-N 0 0 382.424 3.275 20 5 GGBDRN C[C@@H](NC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1cccc(N2CCOC2=O)c1 ZINC000263777974 1434032732 /nfs/dbraw/zinc/03/27/32/1434032732.db2.gz VRPAMBGAAKLWJP-CQSZACIVSA-N 0 0 398.419 3.154 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)nc1n(c2=O)CCCCC1 ZINC000263780596 1434032905 /nfs/dbraw/zinc/03/29/05/1434032905.db2.gz OAXNHASPAIAUMM-UHFFFAOYSA-N 0 0 396.378 3.423 20 5 GGBDRN Cc1nn(-c2nc(C)cc(C)n2)c(C)c1CC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000263786082 1434033994 /nfs/dbraw/zinc/03/39/94/1434033994.db2.gz PDISKOSJQQUHJX-UHFFFAOYSA-N 0 0 398.398 3.124 20 5 GGBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccccc1N1CCOC1=O ZINC000263795347 1434034714 /nfs/dbraw/zinc/03/47/14/1434034714.db2.gz JNEHKTXFZZTNPW-UHFFFAOYSA-N 0 0 384.392 3.382 20 5 GGBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000263796732 1434035074 /nfs/dbraw/zinc/03/50/74/1434035074.db2.gz SAGZEVRNGVUFMW-UHFFFAOYSA-N 0 0 383.433 3.461 20 5 GGBDRN CCc1c(C(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)[nH]c(C)c1C(C)=O ZINC000263801070 1434035600 /nfs/dbraw/zinc/03/56/00/1434035600.db2.gz UGAAVBSNFUDGJW-UHFFFAOYSA-N 0 0 381.392 3.138 20 5 GGBDRN O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1ccccc1)C1CC1 ZINC000263805719 1434035944 /nfs/dbraw/zinc/03/59/44/1434035944.db2.gz VXJISJAIVLVJAE-UHFFFAOYSA-N 0 0 377.404 3.045 20 5 GGBDRN CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000263827557 1434038531 /nfs/dbraw/zinc/03/85/31/1434038531.db2.gz SOPURXCYPIEAMJ-GFCCVEGCSA-N 0 0 389.408 3.328 20 5 GGBDRN COc1ccc(CNC(=O)N2CCO[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000263835209 1434039837 /nfs/dbraw/zinc/03/98/37/1434039837.db2.gz BPEBYEWZKMGLKI-SFHVURJKSA-N 0 0 389.383 3.026 20 5 GGBDRN O=C(c1cncs1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000263839095 1434040198 /nfs/dbraw/zinc/04/01/98/1434040198.db2.gz CAXHGYFYLAPWTO-UHFFFAOYSA-N 0 0 386.355 3.033 20 5 GGBDRN COc1ccc(CNC(=O)NCCc2csc(C(C)C)n2)cc1[N+](=O)[O-] ZINC000263841159 1434040411 /nfs/dbraw/zinc/04/04/11/1434040411.db2.gz YITPASNLZXEGDY-UHFFFAOYSA-N 0 0 378.454 3.225 20 5 GGBDRN CCC[C@H](NC(=O)c1csc([N+](=O)[O-])c1)C(=O)N1CCc2sccc2C1 ZINC000263862352 1434043053 /nfs/dbraw/zinc/04/30/53/1434043053.db2.gz IRLXIVWTMQZVTF-ZDUSSCGKSA-N 0 0 393.490 3.201 20 5 GGBDRN O=C(Cn1cc(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cn1)NC1CC1 ZINC000263865449 1434043409 /nfs/dbraw/zinc/04/34/09/1434043409.db2.gz YJNDEYOHHIIJIQ-UHFFFAOYSA-N 0 0 397.460 3.411 20 5 GGBDRN Cc1nn(CCC(=O)NCCc2coc(-c3ccc(C)cc3)n2)c(C)c1[N+](=O)[O-] ZINC000263868386 1434043481 /nfs/dbraw/zinc/04/34/81/1434043481.db2.gz YZGLIZXLZUENJX-UHFFFAOYSA-N 0 0 397.435 3.121 20 5 GGBDRN CC(C)(C)OC(=O)C1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000263868990 1434043826 /nfs/dbraw/zinc/04/38/26/1434043826.db2.gz LONWQRVOSIBOQN-UHFFFAOYSA-N 0 0 387.436 3.130 20 5 GGBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cccc1-c1nnc2n1CCCCC2 ZINC000263914717 1434048456 /nfs/dbraw/zinc/04/84/56/1434048456.db2.gz OVQLVEKOCBLPNM-UHFFFAOYSA-N 0 0 380.408 3.469 20 5 GGBDRN Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000263942345 1434051327 /nfs/dbraw/zinc/05/13/27/1434051327.db2.gz HMYGAGGKFHRZLO-HNNXBMFYSA-N 0 0 380.408 3.309 20 5 GGBDRN CC(=O)Nc1ccc(Cl)cc1NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000263955873 1434053207 /nfs/dbraw/zinc/05/32/07/1434053207.db2.gz CAUFISVESQLFDL-UHFFFAOYSA-N 0 0 379.804 3.049 20 5 GGBDRN COc1ccc(CNC(=O)N[C@@H](c2nc(C3CC3)no2)C(C)C)cc1[N+](=O)[O-] ZINC000263964504 1434054525 /nfs/dbraw/zinc/05/45/25/1434054525.db2.gz SBRFGRVLOPOOEF-OAHLLOKOSA-N 0 0 389.412 3.060 20 5 GGBDRN C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000263975680 1434056381 /nfs/dbraw/zinc/05/63/81/1434056381.db2.gz DEWNQAKWZFVTDI-CQSZACIVSA-N 0 0 396.447 3.183 20 5 GGBDRN COc1ccc(CNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1OC ZINC000263979342 1434057125 /nfs/dbraw/zinc/05/71/25/1434057125.db2.gz BOWDSPXXNJJBEB-UHFFFAOYSA-N 0 0 392.433 3.273 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000263987424 1434057993 /nfs/dbraw/zinc/05/79/93/1434057993.db2.gz MPIKRECYIWEMNQ-FQEVSTJZSA-N 0 0 393.443 3.093 20 5 GGBDRN COc1cccc(N2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC000263989162 1434058293 /nfs/dbraw/zinc/05/82/93/1434058293.db2.gz MXUZHKUVDFWRLT-GFCCVEGCSA-N 0 0 375.812 3.266 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(OC(C)C)nc2)cc1SC ZINC000263990834 1434058456 /nfs/dbraw/zinc/05/84/56/1434058456.db2.gz HACXPAJQDISBFK-UHFFFAOYSA-N 0 0 391.449 3.438 20 5 GGBDRN C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccc2c(c1)CC(=O)N2C ZINC000263991311 1434058619 /nfs/dbraw/zinc/05/86/19/1434058619.db2.gz KAGKVNIWUSAXRU-LLVKDONJSA-N 0 0 380.404 3.172 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)c1 ZINC000263991892 1434058634 /nfs/dbraw/zinc/05/86/34/1434058634.db2.gz HWGQRTNARXZEMJ-LLVKDONJSA-N 0 0 385.445 3.327 20 5 GGBDRN CCCOc1ncccc1CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000264008193 1434061293 /nfs/dbraw/zinc/06/12/93/1434061293.db2.gz NNQFULZMGMMNSH-UHFFFAOYSA-N 0 0 391.449 3.439 20 5 GGBDRN CC(C)NC(=O)c1ccc(N[C@H](C)c2ccc3c(c2)CC(=O)N3C)c([N+](=O)[O-])c1 ZINC000264007784 1434061342 /nfs/dbraw/zinc/06/13/42/1434061342.db2.gz QSLLERDNYXTGEX-CYBMUJFWSA-N 0 0 396.447 3.425 20 5 GGBDRN COCCN(Cc1ccco1)C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000264010519 1434061566 /nfs/dbraw/zinc/06/15/66/1434061566.db2.gz OIYJKYOCWAAQFY-UHFFFAOYSA-N 0 0 380.422 3.207 20 5 GGBDRN O=C(Nc1cc(Cl)ccc1C(=O)N1CCCCC1)c1ccc([N+](=O)[O-])[nH]1 ZINC000264010251 1434061632 /nfs/dbraw/zinc/06/16/32/1434061632.db2.gz AOEUAISFNIUING-UHFFFAOYSA-N 0 0 376.800 3.455 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)CN(C)CC3)cc1SC ZINC000264015148 1434062165 /nfs/dbraw/zinc/06/21/65/1434062165.db2.gz HEWIHDDPGLHUAE-UHFFFAOYSA-N 0 0 394.478 3.022 20 5 GGBDRN Cc1nn(CCC(=O)Nc2ccc(Oc3ncccn3)cc2C)c(C)c1[N+](=O)[O-] ZINC000264022826 1434063124 /nfs/dbraw/zinc/06/31/24/1434063124.db2.gz YTXKXQDGUCICRN-UHFFFAOYSA-N 0 0 396.407 3.328 20 5 GGBDRN C[C@@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C ZINC000264043319 1434065538 /nfs/dbraw/zinc/06/55/38/1434065538.db2.gz SQEIEWXHXPHMFE-CYBMUJFWSA-N 0 0 382.420 3.016 20 5 GGBDRN COc1cc(CCNC(=O)N(Cc2ccco2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000264043470 1434065635 /nfs/dbraw/zinc/06/56/35/1434065635.db2.gz GWZRLXRDVKKISN-UHFFFAOYSA-N 0 0 391.424 3.368 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCN(C)c2ccccc2)cc1SC ZINC000264051982 1434066692 /nfs/dbraw/zinc/06/66/92/1434066692.db2.gz BJPKABDTCWOXDF-UHFFFAOYSA-N 0 0 375.450 3.192 20 5 GGBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000264052065 1434066729 /nfs/dbraw/zinc/06/67/29/1434066729.db2.gz QERYFGZCAUIBJW-LBPRGKRZSA-N 0 0 385.445 3.083 20 5 GGBDRN COCCN(Cc1cccnc1)C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000264053323 1434067019 /nfs/dbraw/zinc/06/70/19/1434067019.db2.gz BLPHMLNGXKHPFB-UHFFFAOYSA-N 0 0 391.449 3.009 20 5 GGBDRN Cc1c(NC(=O)[C@H](C)N(C)Cc2nccn2CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000264069588 1434068690 /nfs/dbraw/zinc/06/86/90/1434068690.db2.gz LXFVFEQTMOKJRQ-LBPRGKRZSA-N 0 0 399.373 3.121 20 5 GGBDRN Cc1c(NC(=O)[C@@H](C)N(C)Cc2nccn2CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000264069582 1434068692 /nfs/dbraw/zinc/06/86/92/1434068692.db2.gz LXFVFEQTMOKJRQ-GFCCVEGCSA-N 0 0 399.373 3.121 20 5 GGBDRN COc1cc(C(=O)NCCc2nc(C(C)(C)C)cs2)c([N+](=O)[O-])cc1OC ZINC000264108284 1434072413 /nfs/dbraw/zinc/07/24/13/1434072413.db2.gz BNMZAZICDFATBU-UHFFFAOYSA-N 0 0 393.465 3.339 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCOC[C@H]1CCCO1 ZINC000264107964 1434072557 /nfs/dbraw/zinc/07/25/57/1434072557.db2.gz SGMLDFOJHNCBAC-GOSISDBHSA-N 0 0 379.457 3.101 20 5 GGBDRN Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccc([N+](=O)[O-])cc2)c1C ZINC000264119090 1434073146 /nfs/dbraw/zinc/07/31/46/1434073146.db2.gz JRYVVCYPMTZRPW-KRWDZBQOSA-N 0 0 385.445 3.365 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCc2ccc(OC)c(F)c2)cc1OC ZINC000264116189 1434073242 /nfs/dbraw/zinc/07/32/42/1434073242.db2.gz YRYSFMZITVKMJL-UHFFFAOYSA-N 0 0 392.383 3.122 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)OC)c(C)c2)cc1OC ZINC000264142792 1434075567 /nfs/dbraw/zinc/07/55/67/1434075567.db2.gz QJDPNBLKTGOVSZ-UHFFFAOYSA-N 0 0 388.376 3.349 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2cccc(N(C)C)c2)cc1SC ZINC000264166555 1434077673 /nfs/dbraw/zinc/07/76/73/1434077673.db2.gz ORPMNBJVGBSULH-UHFFFAOYSA-N 0 0 375.450 3.321 20 5 GGBDRN C[C@H](c1cccc(NC(=O)COc2ccccc2[N+](=O)[O-])c1)N1CCOCC1 ZINC000264176285 1434078546 /nfs/dbraw/zinc/07/85/46/1434078546.db2.gz DBWFMFMMSUFCOH-OAHLLOKOSA-N 0 0 385.420 3.006 20 5 GGBDRN Cc1nn(CCC(=O)N2CCC(c3ccc(F)c(F)c3)CC2)c(C)c1[N+](=O)[O-] ZINC000264193054 1434080517 /nfs/dbraw/zinc/08/05/17/1434080517.db2.gz GLKQLXMOBDRIFU-UHFFFAOYSA-N 0 0 392.406 3.483 20 5 GGBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCc1nc2c(s1)CCCC2 ZINC000264205801 1434082243 /nfs/dbraw/zinc/08/22/43/1434082243.db2.gz RSQOCWIYTNWKBD-UHFFFAOYSA-N 0 0 375.450 3.058 20 5 GGBDRN CC(=O)Nc1ccc(CCNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 ZINC000264235590 1434085696 /nfs/dbraw/zinc/08/56/96/1434085696.db2.gz SVZPTWUQRJQRPF-UHFFFAOYSA-N 0 0 396.447 3.444 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)c1[N+](=O)[O-] ZINC000264238435 1434085892 /nfs/dbraw/zinc/08/58/92/1434085892.db2.gz KUUWJOKHOUXGCR-LLVKDONJSA-N 0 0 385.424 3.059 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2cc(C(=O)N3C[C@H](C)C[C@H](C)C3)ccc2C)c1[N+](=O)[O-] ZINC000264246162 1434087092 /nfs/dbraw/zinc/08/70/92/1434087092.db2.gz MJDBMZIEYGVNPH-TXEJJXNPSA-N 0 0 399.451 3.305 20 5 GGBDRN CCN(CC)C(=O)c1ccc(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])cc1Cl ZINC000264255953 1434088283 /nfs/dbraw/zinc/08/82/83/1434088283.db2.gz OIQWUIKTVYEYJA-UHFFFAOYSA-N 0 0 379.804 3.014 20 5 GGBDRN Cc1c(NC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000264265886 1434089675 /nfs/dbraw/zinc/08/96/75/1434089675.db2.gz KAZMAXGGAWWUDM-UHFFFAOYSA-N 0 0 378.429 3.424 20 5 GGBDRN C[C@@H](c1cccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c1)N1CCOCC1 ZINC000264270572 1434090470 /nfs/dbraw/zinc/09/04/70/1434090470.db2.gz RPZZOGCABTUZHI-INIZCTEOSA-N 0 0 399.447 3.396 20 5 GGBDRN Cc1[nH]nc(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)c1[N+](=O)[O-] ZINC000264301200 1434094724 /nfs/dbraw/zinc/09/47/24/1434094724.db2.gz YYGGRZBYPWFGLP-LLVKDONJSA-N 0 0 380.788 3.090 20 5 GGBDRN CS(=O)(=O)c1ccc(Oc2ccc(C(=O)N3CCCC3)cc2)c([N+](=O)[O-])c1 ZINC000264305846 1434095202 /nfs/dbraw/zinc/09/52/02/1434095202.db2.gz MODHIUBDQIOZLS-UHFFFAOYSA-N 0 0 390.417 3.027 20 5 GGBDRN CC1(c2ccccc2)CC(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000264318181 1434096620 /nfs/dbraw/zinc/09/66/20/1434096620.db2.gz PWCHKFKMYKUXPY-UHFFFAOYSA-N 0 0 399.472 3.022 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(OC)c(OC)cc2F)cc1OC ZINC000264342503 1434099333 /nfs/dbraw/zinc/09/93/33/1434099333.db2.gz FHZQXRLHOJHGST-UHFFFAOYSA-N 0 0 394.355 3.411 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1NC(=O)C[C@H]1C=CCC1 ZINC000264348901 1434100298 /nfs/dbraw/zinc/10/02/98/1434100298.db2.gz GXPXDXOALXUDFT-HNNXBMFYSA-N 0 0 397.435 3.423 20 5 GGBDRN COc1cc(CSc2nc(=O)ccn2C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000264350875 1434100697 /nfs/dbraw/zinc/10/06/97/1434100697.db2.gz SZUXSCMPWUZCAZ-UHFFFAOYSA-N 0 0 399.375 3.389 20 5 GGBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)s1 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ZINC000264937892 1434165757 /nfs/dbraw/zinc/16/57/57/1434165757.db2.gz GIIKQKBAVAPNJG-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN Cc1cccc(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)c1[N+](=O)[O-] ZINC000264939636 1434166023 /nfs/dbraw/zinc/16/60/23/1434166023.db2.gz GZUTWZYGRNYLDH-UHFFFAOYSA-N 0 0 382.420 3.245 20 5 GGBDRN O=C(NCc1ccnc(OC2CCOCC2)c1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000264944145 1434166353 /nfs/dbraw/zinc/16/63/53/1434166353.db2.gz IHFMQBJVQXMLFB-UHFFFAOYSA-N 0 0 391.811 3.131 20 5 GGBDRN CCN1C(=S)N=NC1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000264960884 1434168290 /nfs/dbraw/zinc/16/82/90/1434168290.db2.gz XDYXWJXWGPPOPI-JTQLQIEISA-N 0 0 395.872 3.168 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1CNCc1ccnc(OC2CCOCC2)c1 ZINC000264990728 1434172162 /nfs/dbraw/zinc/17/21/62/1434172162.db2.gz WZNGOVMSQLIJIQ-UHFFFAOYSA-N 0 0 387.436 3.236 20 5 GGBDRN O=C(CCc1nc(-c2cccc([N+](=O)[O-])c2)no1)N1CCc2sccc2C1 ZINC000265017410 1434175285 /nfs/dbraw/zinc/17/52/85/1434175285.db2.gz RRWOBFHTGATXLJ-UHFFFAOYSA-N 0 0 384.417 3.224 20 5 GGBDRN COc1cc(F)c([C@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)cc1OC ZINC000265027132 1434176102 /nfs/dbraw/zinc/17/61/02/1434176102.db2.gz CKYFYDPYFQOJOU-NSHDSACASA-N 0 0 378.356 3.007 20 5 GGBDRN CCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@@H](C)CS(=O)(=O)CC ZINC000265061517 1434180044 /nfs/dbraw/zinc/18/00/44/1434180044.db2.gz RJIHUXOLTQULKK-ZDUSSCGKSA-N 0 0 384.498 3.178 20 5 GGBDRN O=[N+]([O-])c1ccccc1OCc1nc(-c2ccc(CN3CCOCC3)cc2)no1 ZINC000265071807 1434181260 /nfs/dbraw/zinc/18/12/60/1434181260.db2.gz XOZVQBDEGZOKQL-UHFFFAOYSA-N 0 0 396.403 3.056 20 5 GGBDRN CCCc1[nH]nc(C(=O)Nc2ccc(SC(=O)N(C)C)cc2)c1[N+](=O)[O-] ZINC000265082290 1434182758 /nfs/dbraw/zinc/18/27/58/1434182758.db2.gz QTBOUHRRGMMDGQ-UHFFFAOYSA-N 0 0 377.426 3.296 20 5 GGBDRN COc1ccc([C@@H]2[C@@H](C(=O)OCc3ccc([N+](=O)[O-])cc3)CCC(=O)N2C)cc1 ZINC000265120407 1434187171 /nfs/dbraw/zinc/18/71/71/1434187171.db2.gz GDWQBCVQBRONAL-AZUAARDMSA-N 0 0 398.415 3.256 20 5 GGBDRN Cc1n[nH]c(C(=O)N2CCC(c3nc(C(C)(C)C)cs3)CC2)c1[N+](=O)[O-] ZINC000265132176 1434188562 /nfs/dbraw/zinc/18/85/62/1434188562.db2.gz RXSFTMVHUXOHOL-UHFFFAOYSA-N 0 0 377.470 3.400 20 5 GGBDRN COc1cc(F)c([C@H](C)NCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1OC ZINC000265166874 1434192962 /nfs/dbraw/zinc/19/29/62/1434192962.db2.gz SRGXXSINIHOBBR-NSHDSACASA-N 0 0 392.383 3.468 20 5 GGBDRN COc1ccc(OC(F)F)c(COC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000265166451 1434193161 /nfs/dbraw/zinc/19/31/61/1434193161.db2.gz HKWUTZXCTKCRKM-UHFFFAOYSA-N 0 0 399.350 3.152 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@@H](C(C)C)CC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000265189224 1434196585 /nfs/dbraw/zinc/19/65/85/1434196585.db2.gz BZZYYCAHETXZFO-MRXNPFEDSA-N 0 0 398.463 3.347 20 5 GGBDRN Cc1ccc(OC2CCN(C(=O)COc3ccc(C=O)cc3[N+](=O)[O-])CC2)cc1 ZINC000265255315 1434208172 /nfs/dbraw/zinc/20/81/72/1434208172.db2.gz AOSXJPLAUBFALV-UHFFFAOYSA-N 0 0 398.415 3.165 20 5 GGBDRN O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(CCc1ccc(F)cc1)C1CC1 ZINC000265278999 1434211620 /nfs/dbraw/zinc/21/16/20/1434211620.db2.gz QWLBVTDFOFCGNF-UHFFFAOYSA-N 0 0 395.394 3.162 20 5 GGBDRN CC(C)CN(C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CCCC1 ZINC000265296120 1434213644 /nfs/dbraw/zinc/21/36/44/1434213644.db2.gz NQABQAADFRNMDF-UHFFFAOYSA-N 0 0 381.860 3.405 20 5 GGBDRN C[C@@H](c1cccnc1)N1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000265301372 1434214712 /nfs/dbraw/zinc/21/47/12/1434214712.db2.gz PLTGJNKJJSRZCE-AWEZNQCLSA-N 0 0 380.404 3.255 20 5 GGBDRN CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000265302651 1434215065 /nfs/dbraw/zinc/21/50/65/1434215065.db2.gz PPTMXUBRODWKLS-LUIPGBGBSA-N 0 0 379.844 3.025 20 5 GGBDRN COC(=O)NCc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 ZINC000265320554 1434218188 /nfs/dbraw/zinc/21/81/88/1434218188.db2.gz VOLDBJQMWPOKHX-UHFFFAOYSA-N 0 0 398.419 3.303 20 5 GGBDRN CCc1ccc(OCC(=O)Nc2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])c1 ZINC000265347437 1434222162 /nfs/dbraw/zinc/22/21/62/1434222162.db2.gz YOJUXUKLXTYICJ-UHFFFAOYSA-N 0 0 390.392 3.201 20 5 GGBDRN COc1cc(C(=O)NCc2nc3ccccc3n2C(C)C)c([N+](=O)[O-])cc1OC ZINC000265397939 1434229075 /nfs/dbraw/zinc/22/90/75/1434229075.db2.gz HLEUHPGDNHPIND-UHFFFAOYSA-N 0 0 398.419 3.473 20 5 GGBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(-n2cncn2)c1 ZINC000265405723 1434230117 /nfs/dbraw/zinc/23/01/17/1434230117.db2.gz QURXUEVBDDNBAZ-UHFFFAOYSA-N 0 0 394.435 3.296 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nc3ccccc3n2C)cc1OC ZINC000265410655 1434230714 /nfs/dbraw/zinc/23/07/14/1434230714.db2.gz MKTTXBPWANODSQ-LBPRGKRZSA-N 0 0 398.419 3.380 20 5 GGBDRN COc1cc(CCNC(=O)[C@H]2CSc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000265425425 1434233185 /nfs/dbraw/zinc/23/31/85/1434233185.db2.gz PSACFKIOISSWEF-AWEZNQCLSA-N 0 0 388.445 3.160 20 5 GGBDRN COc1cc(CCNC(=O)[C@@H]2CSc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000265425428 1434233193 /nfs/dbraw/zinc/23/31/93/1434233193.db2.gz PSACFKIOISSWEF-CQSZACIVSA-N 0 0 388.445 3.160 20 5 GGBDRN COc1cc(C(=O)NCC2(O)CCCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000265447269 1434235355 /nfs/dbraw/zinc/23/53/55/1434235355.db2.gz KAFPKPLIAQCXTG-UHFFFAOYSA-N 0 0 388.367 3.020 20 5 GGBDRN CCC[C@H]1SCCN1C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 ZINC000265458916 1434236334 /nfs/dbraw/zinc/23/63/34/1434236334.db2.gz PEBQHEFDHBWVER-CQSZACIVSA-N 0 0 393.494 3.190 20 5 GGBDRN COC(=O)c1cc(NC(=O)c2nc(C(C)C)ncc2Cl)cc([N+](=O)[O-])c1 ZINC000265464045 1434236723 /nfs/dbraw/zinc/23/67/23/1434236723.db2.gz CKZSAIRKVNJKBZ-UHFFFAOYSA-N 0 0 378.772 3.201 20 5 GGBDRN O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCCC[C@@H]1c1ccco1 ZINC000265492968 1434239402 /nfs/dbraw/zinc/23/94/02/1434239402.db2.gz IKOBWJMOZNPIKO-CQSZACIVSA-N 0 0 385.376 3.240 20 5 GGBDRN COc1cc(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c([N+](=O)[O-])cc1OC ZINC000265532208 1434243095 /nfs/dbraw/zinc/24/30/95/1434243095.db2.gz POUMLDLWVFEUMM-UHFFFAOYSA-N 0 0 387.348 3.113 20 5 GGBDRN CCOC(=O)c1ccnc(N2CCC(c3noc(C(C)C)n3)CC2)c1[N+](=O)[O-] ZINC000265530598 1434243127 /nfs/dbraw/zinc/24/31/27/1434243127.db2.gz AWJVCOCKSUPTIR-UHFFFAOYSA-N 0 0 389.412 3.057 20 5 GGBDRN CCOC(=O)c1ccnc(NCc2ccc(NC(=O)C(C)C)cc2)c1[N+](=O)[O-] ZINC000265547651 1434244717 /nfs/dbraw/zinc/24/47/17/1434244717.db2.gz GAMMRFQVICJTEU-UHFFFAOYSA-N 0 0 386.408 3.373 20 5 GGBDRN CCCCN(C)C(=O)C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000265557231 1434245695 /nfs/dbraw/zinc/24/56/95/1434245695.db2.gz LCSNTZBYSIOCLW-UHFFFAOYSA-N 0 0 395.887 3.288 20 5 GGBDRN COc1ccccc1[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000265565742 1434246503 /nfs/dbraw/zinc/24/65/03/1434246503.db2.gz KLXBUHXDBCZDJK-CYBMUJFWSA-N 0 0 376.434 3.001 20 5 GGBDRN COc1cc(CCC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc(OC)c1OC ZINC000265574374 1434247146 /nfs/dbraw/zinc/24/71/46/1434247146.db2.gz BOSGKROFCCKMRW-UHFFFAOYSA-N 0 0 386.404 3.143 20 5 GGBDRN COC(=O)[C@@H](C)Sc1ccccc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000265578610 1434247746 /nfs/dbraw/zinc/24/77/46/1434247746.db2.gz CMFKKBRDIIKCGQ-GFCCVEGCSA-N 0 0 386.429 3.451 20 5 GGBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCN(Cc2cccc(O)c2)CC1 ZINC000265661495 1434254471 /nfs/dbraw/zinc/25/44/71/1434254471.db2.gz BCOPYWQSINAHRB-UHFFFAOYSA-N 0 0 381.388 3.005 20 5 GGBDRN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000265696033 1434257652 /nfs/dbraw/zinc/25/76/52/1434257652.db2.gz CAIOMZFGFNCALI-CYBMUJFWSA-N 0 0 381.432 3.269 20 5 GGBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000265696037 1434257736 /nfs/dbraw/zinc/25/77/36/1434257736.db2.gz CAIOMZFGFNCALI-ZDUSSCGKSA-N 0 0 381.432 3.269 20 5 GGBDRN COc1ccccc1[C@H]1CCN(C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000265718009 1434259847 /nfs/dbraw/zinc/25/98/47/1434259847.db2.gz ZIOIGNWURJSNHX-HNNXBMFYSA-N 0 0 385.420 3.311 20 5 GGBDRN CC[C@@H](C)[C@@H]1CCCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000265722305 1434260347 /nfs/dbraw/zinc/26/03/47/1434260347.db2.gz ZMHDZBGIRRSBFG-OCCSQVGLSA-N 0 0 381.860 3.405 20 5 GGBDRN CC[C@H](C)[C@H]1CCCCN1C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000265721496 1434260427 /nfs/dbraw/zinc/26/04/27/1434260427.db2.gz ZMHDZBGIRRSBFG-GXTWGEPZSA-N 0 0 381.860 3.405 20 5 GGBDRN O=[N+]([O-])c1ccc(Cl)cc1CNCc1ccnc(OC2CCOCC2)c1 ZINC000265739562 1434261677 /nfs/dbraw/zinc/26/16/77/1434261677.db2.gz DMIMQGVMODLKTF-UHFFFAOYSA-N 0 0 377.828 3.491 20 5 GGBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000265758971 1434263053 /nfs/dbraw/zinc/26/30/53/1434263053.db2.gz JOYZKWUKYJLIDY-CYBMUJFWSA-N 0 0 385.420 3.485 20 5 GGBDRN CC(C)(C(=O)Nc1ccccc1CN1C(=O)CCC1=O)c1ccc([N+](=O)[O-])cc1 ZINC000265764341 1434263410 /nfs/dbraw/zinc/26/34/10/1434263410.db2.gz LFSVZVJHRDLEQQ-UHFFFAOYSA-N 0 0 395.415 3.160 20 5 GGBDRN C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[C@@H]1NC(=O)OC(C)(C)C ZINC000265764521 1434263488 /nfs/dbraw/zinc/26/34/88/1434263488.db2.gz IHNUAJMEMVYPJZ-DOMZBBRYSA-N 0 0 378.429 3.362 20 5 GGBDRN CN(C)C(=O)c1cccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000265769694 1434263838 /nfs/dbraw/zinc/26/38/38/1434263838.db2.gz DLHLQBWHJJGHMR-UHFFFAOYSA-N 0 0 398.463 3.119 20 5 GGBDRN C[C@](O)(CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1cccs1 ZINC000265792386 1434265429 /nfs/dbraw/zinc/26/54/29/1434265429.db2.gz HYOODGOILSIGOR-SFHVURJKSA-N 0 0 375.450 3.212 20 5 GGBDRN CCS(=O)(=O)Nc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000265790708 1434265514 /nfs/dbraw/zinc/26/55/14/1434265514.db2.gz LRIYOZWZAGSFRY-UHFFFAOYSA-N 0 0 391.449 3.273 20 5 GGBDRN CC(C)(C(=O)Nc1ccc(CN2CCOC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000265797692 1434265861 /nfs/dbraw/zinc/26/58/61/1434265861.db2.gz UJPUFMJVXSDWIG-UHFFFAOYSA-N 0 0 383.404 3.463 20 5 GGBDRN O=[N+]([O-])c1ccc(N2CCn3c(nnc3C(F)(F)F)C2)c(C(F)(F)F)c1 ZINC000265808435 1434266790 /nfs/dbraw/zinc/26/67/90/1434266790.db2.gz LLHJNWLCTPYRRS-UHFFFAOYSA-N 0 0 381.236 3.244 20 5 GGBDRN C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1NC(=O)OC(C)(C)C 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ZINC000269462518 1434649542 /nfs/dbraw/zinc/64/95/42/1434649542.db2.gz SQHDOQCIBWRIBD-CYBMUJFWSA-N 0 0 387.440 3.087 20 5 GGBDRN CCc1csc([C@@H]2CCCN(C(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])C2)n1 ZINC000269469175 1434650147 /nfs/dbraw/zinc/65/01/47/1434650147.db2.gz UIUTUWOYCGHQDJ-LLVKDONJSA-N 0 0 377.470 3.480 20 5 GGBDRN CCOC(=O)C[C@@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000269467090 1434650189 /nfs/dbraw/zinc/65/01/89/1434650189.db2.gz UDFKRHSXCVPHFB-CYBMUJFWSA-N 0 0 392.387 3.005 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]2CC(=O)c2cccs2)c1[N+](=O)[O-] ZINC000269474315 1434650945 /nfs/dbraw/zinc/65/09/45/1434650945.db2.gz JEMMZHSYTADYDR-LLVKDONJSA-N 0 0 376.438 3.380 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000269474584 1434650978 /nfs/dbraw/zinc/65/09/78/1434650978.db2.gz JJPFBGOYVDVHIB-UHFFFAOYSA-N 0 0 388.268 3.398 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(O[C@@H]3CCCC[C@@H]3O)cc2)c1[N+](=O)[O-] ZINC000269481593 1434652122 /nfs/dbraw/zinc/65/21/22/1434652122.db2.gz KIHPWXUBLCCJBR-LSDHHAIUSA-N 0 0 388.424 3.376 20 5 GGBDRN COc1cc(CNc2cccc(-c3nnc(C)n3C)c2)c([N+](=O)[O-])cc1OC ZINC000269492813 1434653407 /nfs/dbraw/zinc/65/34/07/1434653407.db2.gz JHJVCENHPAATQA-UHFFFAOYSA-N 0 0 383.408 3.328 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC[C@H](OCCO)C1 ZINC000269492249 1434653514 /nfs/dbraw/zinc/65/35/14/1434653514.db2.gz MKQCBLXPDLNSQV-KRWDZBQOSA-N 0 0 386.404 3.001 20 5 GGBDRN COC1CCC(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000269498414 1434654083 /nfs/dbraw/zinc/65/40/83/1434654083.db2.gz WCLLSSOIPXZEOT-UHFFFAOYSA-N 0 0 396.387 3.192 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)c1[N+](=O)[O-] ZINC000269504566 1434654585 /nfs/dbraw/zinc/65/45/85/1434654585.db2.gz ZPQHOYSAYHLHHB-UHFFFAOYSA-N 0 0 381.396 3.356 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000269524801 1434656255 /nfs/dbraw/zinc/65/62/55/1434656255.db2.gz QZNWYCDXQSOTAF-LBPRGKRZSA-N 0 0 377.832 3.103 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000269541435 1434657781 /nfs/dbraw/zinc/65/77/81/1434657781.db2.gz VIAGXEADBUJMBG-LJZMDLFKSA-N 0 0 378.454 3.012 20 5 GGBDRN COc1cc(C(=O)O[C@@H](c2ccccn2)C(F)(F)F)c([N+](=O)[O-])cc1OC ZINC000269545504 1434658399 /nfs/dbraw/zinc/65/83/99/1434658399.db2.gz OAWLCXXBSHWBOT-AWEZNQCLSA-N 0 0 386.282 3.467 20 5 GGBDRN COc1cc(OCC(=O)O[C@@H](c2ccccn2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000269556266 1434659100 /nfs/dbraw/zinc/65/91/00/1434659100.db2.gz RPXCFEGTKBFIEH-HNNXBMFYSA-N 0 0 386.282 3.224 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]2C[C@@H](O)c2cccs2)c1[N+](=O)[O-] ZINC000269554057 1434659104 /nfs/dbraw/zinc/65/91/04/1434659104.db2.gz YPJOYWKFSWZIGI-VXGBXAGGSA-N 0 0 378.454 3.231 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)c1[N+](=O)[O-] ZINC000269556952 1434659147 /nfs/dbraw/zinc/65/91/47/1434659147.db2.gz ZMRYGBFWGXMYJF-SECBINFHSA-N 0 0 388.359 3.121 20 5 GGBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)c1[N+](=O)[O-] ZINC000269558936 1434659349 /nfs/dbraw/zinc/65/93/49/1434659349.db2.gz ZXMNIHJBKQBGGY-LBPRGKRZSA-N 0 0 391.403 3.424 20 5 GGBDRN CC(=O)N1CCN(c2ccccc2CNc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000269608064 1434663253 /nfs/dbraw/zinc/66/32/53/1434663253.db2.gz DGLWEVGFAMWQCW-UHFFFAOYSA-N 0 0 390.390 3.154 20 5 GGBDRN O=C(Nc1ccccc1O)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000269616381 1434663910 /nfs/dbraw/zinc/66/39/10/1434663910.db2.gz GWHZZXRXYUJGPD-UHFFFAOYSA-N 0 0 377.347 3.434 20 5 GGBDRN CC[C@H](NC(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@@H](O)c1c(F)cccc1F ZINC000269622166 1434664469 /nfs/dbraw/zinc/66/44/69/1434664469.db2.gz XRHRWKDYZHVLKL-SUMWQHHRSA-N 0 0 380.347 3.124 20 5 GGBDRN COc1cccc(C(C)(C)CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1 ZINC000269642077 1434666135 /nfs/dbraw/zinc/66/61/35/1434666135.db2.gz JNCAKVIMJDITTN-UHFFFAOYSA-N 0 0 386.404 3.082 20 5 GGBDRN Cc1c(CC(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)cccc1[N+](=O)[O-] ZINC000269657448 1434667167 /nfs/dbraw/zinc/66/71/67/1434667167.db2.gz FPAXKCIXLODLTP-MRXNPFEDSA-N 0 0 383.448 3.478 20 5 GGBDRN CCOCc1ccc(CNC(=O)COc2ccc(C(C)=O)cc2[N+](=O)[O-])cc1 ZINC000269675540 1434668437 /nfs/dbraw/zinc/66/84/37/1434668437.db2.gz PGOXPXILHVNOLZ-UHFFFAOYSA-N 0 0 386.404 3.029 20 5 GGBDRN COc1cc(OCC(=O)OCc2nc(C(F)(F)F)cs2)ccc1[N+](=O)[O-] ZINC000269711126 1434670996 /nfs/dbraw/zinc/67/09/96/1434670996.db2.gz NUAJXHLRPKQYLY-UHFFFAOYSA-N 0 0 392.311 3.201 20 5 GGBDRN COc1cc(C(=O)OCc2nc(C(F)(F)F)cs2)c([N+](=O)[O-])cc1OC ZINC000269735896 1434672730 /nfs/dbraw/zinc/67/27/30/1434672730.db2.gz XNOUKHHTKHJJRL-UHFFFAOYSA-N 0 0 392.311 3.444 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000269738833 1434673125 /nfs/dbraw/zinc/67/31/25/1434673125.db2.gz YDBGZEUNDPSTAG-HUUCEWRRSA-N 0 0 390.415 3.309 20 5 GGBDRN CCOCCC1(CNC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC1 ZINC000269812508 1434677670 /nfs/dbraw/zinc/67/76/70/1434677670.db2.gz VAPPUIQCUQBOSH-UHFFFAOYSA-N 0 0 388.367 3.141 20 5 GGBDRN CCOC(=O)c1cc(C(=O)N[C@H](C)C[C@@H](O)c2cccs2)cc([N+](=O)[O-])c1 ZINC000269853221 1434681403 /nfs/dbraw/zinc/68/14/03/1434681403.db2.gz RUIQUOZWBGUALT-IAQYHMDHSA-N 0 0 392.433 3.075 20 5 GGBDRN CNC(=O)CCCN(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000269852213 1434681415 /nfs/dbraw/zinc/68/14/15/1434681415.db2.gz KSXJHSBBRKEMCX-UHFFFAOYSA-N 0 0 386.408 3.377 20 5 GGBDRN COC(=O)C1CCN(C(=O)[C@H](SCc2ccc([N+](=O)[O-])cc2)C(C)C)CC1 ZINC000269892851 1434684791 /nfs/dbraw/zinc/68/47/91/1434684791.db2.gz BWFVFISBJQOERC-QGZVFWFLSA-N 0 0 394.493 3.264 20 5 GGBDRN CCOc1cc(NC(=O)N[C@H]2CCOC(C)(C)C2)c([N+](=O)[O-])cc1OCC ZINC000269909998 1434686302 /nfs/dbraw/zinc/68/63/02/1434686302.db2.gz GJLXSAATVGRKDF-LBPRGKRZSA-N 0 0 381.429 3.471 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1OC ZINC000269924201 1434687208 /nfs/dbraw/zinc/68/72/08/1434687208.db2.gz BMBBAZYTJVBXSQ-NXOUGTEYSA-N 0 0 390.436 3.080 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)CC(=O)c2cccs2)cc1OC ZINC000269940108 1434688438 /nfs/dbraw/zinc/68/84/38/1434688438.db2.gz ZNPLHZUKMAAZHZ-NSHDSACASA-N 0 0 392.433 3.455 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)cc1SC ZINC000269960865 1434690256 /nfs/dbraw/zinc/69/02/56/1434690256.db2.gz UBCQXXBCYVPRMJ-YMRXKLBXSA-N 0 0 392.477 3.403 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](OCc2ccccn2)C1 ZINC000270013456 1434693311 /nfs/dbraw/zinc/69/33/11/1434693311.db2.gz MPCCGSXMXAGNRM-AWEZNQCLSA-N 0 0 376.800 3.466 20 5 GGBDRN CCOC(=O)C1CCN(C(=O)[C@H](C)SCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000270013418 1434693368 /nfs/dbraw/zinc/69/33/68/1434693368.db2.gz MMUAWCWSTBAXEM-ZDUSSCGKSA-N 0 0 380.466 3.018 20 5 GGBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1N1CCOC1=O)c1ccc([S@@](C)=O)cc1 ZINC000270017203 1434693662 /nfs/dbraw/zinc/69/36/62/1434693662.db2.gz CNOFFDRVGWZGBJ-BIXPNRAVSA-N 0 0 389.433 3.462 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1SC ZINC000270019110 1434693979 /nfs/dbraw/zinc/69/39/79/1434693979.db2.gz UZTCNANNWAXIPQ-GTTSAUCSSA-N 0 0 378.450 3.013 20 5 GGBDRN CCOC(=O)c1ccnc(N[C@@H](C)c2ccc([S@](C)=O)cc2)c1[N+](=O)[O-] ZINC000270057890 1434697822 /nfs/dbraw/zinc/69/78/22/1434697822.db2.gz NZBNZEPFXPEVIN-LJZMDLFKSA-N 0 0 377.422 3.077 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1csc([C@@H]2CCCO2)n1 ZINC000270114528 1434704437 /nfs/dbraw/zinc/70/44/37/1434704437.db2.gz GRCBOPUYPZPYBO-ZDUSSCGKSA-N 0 0 391.405 3.316 20 5 GGBDRN C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc([S@](C)=O)cc1 ZINC000270152690 1434707827 /nfs/dbraw/zinc/70/78/27/1434707827.db2.gz SJFCOQVSPRKTEX-ASHKIFAZSA-N 0 0 389.477 3.402 20 5 GGBDRN C[C@@H](NC(=O)N[C@@H](C)c1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000270153763 1434707874 /nfs/dbraw/zinc/70/78/74/1434707874.db2.gz SOWGUUOENORNFM-NKINMBLBSA-N 0 0 375.450 3.454 20 5 GGBDRN C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc([S@@](C)=O)cc1 ZINC000270152696 1434707928 /nfs/dbraw/zinc/70/79/28/1434707928.db2.gz SJFCOQVSPRKTEX-PGGUUEOZSA-N 0 0 389.477 3.402 20 5 GGBDRN COc1cc(CN[C@H](C)c2ccc([S@](C)=O)cc2)c([N+](=O)[O-])cc1OC ZINC000270161835 1434708451 /nfs/dbraw/zinc/70/84/51/1434708451.db2.gz UEAKRTRSFLZPBY-RYZVSIALSA-N 0 0 378.450 3.200 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CC=C(C(F)(F)F)CC1 ZINC000270177430 1434709828 /nfs/dbraw/zinc/70/98/28/1434709828.db2.gz BDLPSAUGOBSOAF-UHFFFAOYSA-N 0 0 399.325 3.004 20 5 GGBDRN Cc1nc2ccccc2n1C[C@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000270177660 1434709860 /nfs/dbraw/zinc/70/98/60/1434709860.db2.gz WHHRXCNTNIELJV-CQSZACIVSA-N 0 0 379.420 3.140 20 5 GGBDRN C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000270180368 1434710122 /nfs/dbraw/zinc/71/01/22/1434710122.db2.gz WSNRLOTWAHICNI-ZBSNKRKSSA-N 0 0 375.450 3.012 20 5 GGBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@H]2Cn2cnc3ccccc32)c1[N+](=O)[O-] ZINC000270224243 1434714594 /nfs/dbraw/zinc/71/45/94/1434714594.db2.gz PEUSXRDFEOPEAR-ZDUSSCGKSA-N 0 0 382.424 3.096 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000270248658 1434716374 /nfs/dbraw/zinc/71/63/74/1434716374.db2.gz SSASNALQAQYISU-CQSZACIVSA-N 0 0 395.375 3.158 20 5 GGBDRN Cc1n[nH]c([C@H]2CCCN(c3cc(C)nc(-c4ccc([N+](=O)[O-])cc4)n3)C2)n1 ZINC000270268732 1434718175 /nfs/dbraw/zinc/71/81/75/1434718175.db2.gz VVHGJGNLMIRALX-HNNXBMFYSA-N 0 0 379.424 3.171 20 5 GGBDRN CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000270288166 1434719859 /nfs/dbraw/zinc/71/98/59/1434719859.db2.gz OITBZGAYZGNHJQ-INIZCTEOSA-N 0 0 391.468 3.291 20 5 GGBDRN C[C@](O)(CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccc(F)cc1 ZINC000270311065 1434722341 /nfs/dbraw/zinc/72/23/41/1434722341.db2.gz SJEUOTBACMJRGA-FQEVSTJZSA-N 0 0 387.411 3.290 20 5 GGBDRN Cc1nc(C2(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)CCCCC2)no1 ZINC000270326628 1434723329 /nfs/dbraw/zinc/72/33/29/1434723329.db2.gz ZRPCFNRBGUYEHE-UHFFFAOYSA-N 0 0 383.408 3.286 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H]([C@@H]2CCCO2)C(F)(F)F)cc1OC ZINC000270366896 1434726830 /nfs/dbraw/zinc/72/68/30/1434726830.db2.gz RLQMHHCNCSUDIP-FZMZJTMJSA-N 0 0 393.314 3.269 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H]([C@H]2CCCO2)C(F)(F)F)cc1OC ZINC000270366892 1434726888 /nfs/dbraw/zinc/72/68/88/1434726888.db2.gz RLQMHHCNCSUDIP-BXUZGUMPSA-N 0 0 393.314 3.269 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CC=C(C(C)(C)C)CC2)nn1-c1ccccc1[N+](=O)[O-] ZINC000270365203 1434726940 /nfs/dbraw/zinc/72/69/40/1434726940.db2.gz AMUQHUPISLYUEE-UHFFFAOYSA-N 0 0 396.447 3.268 20 5 GGBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@H]1[C@H](O)C(F)(F)F ZINC000270370689 1434727514 /nfs/dbraw/zinc/72/75/14/1434727514.db2.gz DAGDMDVIUIPASS-QWRGUYRKSA-N 0 0 386.248 3.141 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccnc(OCC(F)F)c1 ZINC000270379113 1434728409 /nfs/dbraw/zinc/72/84/09/1434728409.db2.gz 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0 386.786 3.358 20 5 GGBDRN CCCN(CC(=O)Nc1ccccc1C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272203302 1434877917 /nfs/dbraw/zinc/87/79/17/1434877917.db2.gz GTPRULCNUOHGOA-UHFFFAOYSA-N 0 0 399.403 3.123 20 5 GGBDRN O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272205169 1434878040 /nfs/dbraw/zinc/87/80/40/1434878040.db2.gz PGXNKYCISRDSKI-UHFFFAOYSA-N 0 0 397.387 3.202 20 5 GGBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])CCO1 ZINC000272208825 1434878123 /nfs/dbraw/zinc/87/81/23/1434878123.db2.gz CETJPBMZRAGLRG-CZUORRHYSA-N 0 0 380.441 3.326 20 5 GGBDRN CCc1cc(N[C@H](C)c2nnc3n2CCC3)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272214233 1434878501 /nfs/dbraw/zinc/87/85/01/1434878501.db2.gz IASPGXZXHDBQKE-GFCCVEGCSA-N 0 0 379.424 3.325 20 5 GGBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@@H]1CCCC1=O ZINC000272212466 1434878548 /nfs/dbraw/zinc/87/85/48/1434878548.db2.gz RTNQMXJGHQSWDT-UONOGXRCSA-N 0 0 380.828 3.377 20 5 GGBDRN 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Cn1c2ccccc2nc1[C@H]1CCCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272285390 1434884195 /nfs/dbraw/zinc/88/41/95/1434884195.db2.gz FAPUACGMVBEVAD-OAHLLOKOSA-N 0 0 394.387 3.188 20 5 GGBDRN C[C@H](O)c1ccc(CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000272304106 1434885837 /nfs/dbraw/zinc/88/58/37/1434885837.db2.gz DRURHXFMYVPNTH-LBPRGKRZSA-N 0 0 377.828 3.343 20 5 GGBDRN COc1cc(C(=O)N[C@@H]2CCCOc3cc(F)ccc32)c([N+](=O)[O-])cc1OC ZINC000272323000 1434887191 /nfs/dbraw/zinc/88/71/91/1434887191.db2.gz WKOANDFTFITFGY-CQSZACIVSA-N 0 0 390.367 3.395 20 5 GGBDRN COCCn1nc(C)c(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000272323200 1434887231 /nfs/dbraw/zinc/88/72/31/1434887231.db2.gz KEGFEOBRHYJNHG-UHFFFAOYSA-N 0 0 395.847 3.072 20 5 GGBDRN Cn1cc(C(=O)C[C@@H]2CCCN2c2ccc([N+](=O)[O-])c(OC(F)F)c2)cn1 ZINC000272333237 1434887876 /nfs/dbraw/zinc/88/78/76/1434887876.db2.gz VVPJIKDHTDJBKK-LBPRGKRZSA-N 0 0 380.351 3.172 20 5 GGBDRN COc1cc(CNCc2nccn2C(F)F)c([N+](=O)[O-])cc1OCC(F)F ZINC000272352042 1434889584 /nfs/dbraw/zinc/88/95/84/1434889584.db2.gz DGEXXPWOYKWWTF-UHFFFAOYSA-N 0 0 392.309 3.129 20 5 GGBDRN COc1cccc(C2=CCN(C(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])C2)c1 ZINC000272352605 1434889598 /nfs/dbraw/zinc/88/95/98/1434889598.db2.gz CPLHMDXJWBBEAC-UHFFFAOYSA-N 0 0 384.388 3.160 20 5 GGBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCO[C@]2(CCSC2)C1 ZINC000272353332 1434889759 /nfs/dbraw/zinc/88/97/59/1434889759.db2.gz RBOYZMLRISIMQB-RHSMWYFYSA-N 0 0 399.900 3.145 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000272356160 1434889978 /nfs/dbraw/zinc/88/99/78/1434889978.db2.gz RMKKYDPNWPBBJG-OOCSTFOJSA-N 0 0 389.452 3.370 20 5 GGBDRN CC(C)N1CCO[C@H](c2noc(-c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)n2)C1 ZINC000272355328 1434889990 /nfs/dbraw/zinc/88/99/90/1434889990.db2.gz AUTWJFOWKIMKKY-ZDUSSCGKSA-N 0 0 386.330 3.445 20 5 GGBDRN Cc1noc([C@H]2CCCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000272384567 1434892616 /nfs/dbraw/zinc/89/26/16/1434892616.db2.gz WAKLNEPQYVUWNY-ZDUSSCGKSA-N 0 0 393.831 3.071 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000272393002 1434893364 /nfs/dbraw/zinc/89/33/64/1434893364.db2.gz WZBNDUFIRVWEIH-GZSUAUOCSA-N 0 0 389.452 3.370 20 5 GGBDRN O=c1c(Cl)c(NCC[C@H]2CCCCO2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000272394042 1434893448 /nfs/dbraw/zinc/89/34/48/1434893448.db2.gz IWJJYYPJMFLAHL-CQSZACIVSA-N 0 0 378.816 3.165 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000272393004 1434893472 /nfs/dbraw/zinc/89/34/72/1434893472.db2.gz WZBNDUFIRVWEIH-HWHJAYSBSA-N 0 0 389.452 3.370 20 5 GGBDRN COc1cc(C(=O)N[C@H]2CC(C)(C)OC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000272394778 1434893552 /nfs/dbraw/zinc/89/35/52/1434893552.db2.gz ZTYSMFQOFRBFCD-ZDUSSCGKSA-N 0 0 388.367 3.281 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1 ZINC000272399132 1434893781 /nfs/dbraw/zinc/89/37/81/1434893781.db2.gz HOBWJGGOBCLXKI-UHFFFAOYSA-N 0 0 389.358 3.190 20 5 GGBDRN Cc1nccn1CCCN(C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272404980 1434894261 /nfs/dbraw/zinc/89/42/61/1434894261.db2.gz YNRLJDLVXHSGSY-UHFFFAOYSA-N 0 0 379.848 3.027 20 5 GGBDRN O=C(C[C@@H]1CCCN1C(=O)c1cc2nsnc2c([N+](=O)[O-])c1)c1ccco1 ZINC000272425992 1434895423 /nfs/dbraw/zinc/89/54/23/1434895423.db2.gz YBTWMODSPLMPAT-NSHDSACASA-N 0 0 386.389 3.070 20 5 GGBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000272426176 1434895433 /nfs/dbraw/zinc/89/54/33/1434895433.db2.gz NKHQWZOFDNZXCC-STQMWFEESA-N 0 0 378.429 3.362 20 5 GGBDRN O=C(C[C@H]1CCCN1C(=O)c1cc2nsnc2c([N+](=O)[O-])c1)c1ccco1 ZINC000272425988 1434895439 /nfs/dbraw/zinc/89/54/39/1434895439.db2.gz YBTWMODSPLMPAT-LLVKDONJSA-N 0 0 386.389 3.070 20 5 GGBDRN COc1cccc2[nH]cc(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)c21 ZINC000272438831 1434896229 /nfs/dbraw/zinc/89/62/29/1434896229.db2.gz KRVCIAFNOBBRES-UHFFFAOYSA-N 0 0 397.387 3.427 20 5 GGBDRN O=C(N(Cc1ccncc1)C[C@@H]1CCCO1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272441315 1434896341 /nfs/dbraw/zinc/89/63/41/1434896341.db2.gz BEERUYNBIUTKCW-KRWDZBQOSA-N 0 0 391.374 3.289 20 5 GGBDRN COc1ccc(CNC(=O)N2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000272456949 1434897595 /nfs/dbraw/zinc/89/75/95/1434897595.db2.gz ULIDWTOKROMXTB-INIZCTEOSA-N 0 0 385.420 3.214 20 5 GGBDRN COc1ccc(OC)c(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272474265 1434898871 /nfs/dbraw/zinc/89/88/71/1434898871.db2.gz AXWYMXFPLDEWMI-IBGZPJMESA-N 0 0 382.420 3.225 20 5 GGBDRN Cn1ccnc1[C@H](NCc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000272477378 1434899072 /nfs/dbraw/zinc/89/90/72/1434899072.db2.gz BKVBFVAOPHCGCZ-HXUWFJFHSA-N 0 0 394.431 3.369 20 5 GGBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000272478443 1434899202 /nfs/dbraw/zinc/89/92/02/1434899202.db2.gz UPJUWEWUYPVLHT-OLZOCXBDSA-N 0 0 378.429 3.362 20 5 GGBDRN Cn1ccnc1[C@H](NCCCCNc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000272484990 1434899635 /nfs/dbraw/zinc/89/96/35/1434899635.db2.gz CUUXFMWOHZDTQL-LJQANCHMSA-N 0 0 380.452 3.295 20 5 GGBDRN COc1ccc(O[C@@H](C)CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272498657 1434900845 /nfs/dbraw/zinc/90/08/45/1434900845.db2.gz GHZLDXBZACUTSE-MGPUTAFESA-N 0 0 396.447 3.483 20 5 GGBDRN COc1ccc(O[C@H](C)CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000272498663 1434900924 /nfs/dbraw/zinc/90/09/24/1434900924.db2.gz GHZLDXBZACUTSE-QRWLVFNGSA-N 0 0 396.447 3.483 20 5 GGBDRN O=C(Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000272501935 1434901120 /nfs/dbraw/zinc/90/11/20/1434901120.db2.gz XHVROXIOWXKPAZ-OAHLLOKOSA-N 0 0 396.359 3.304 20 5 GGBDRN Cn1ccnc1[C@H](NCCN1CCc2sccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000272514101 1434902707 /nfs/dbraw/zinc/90/27/07/1434902707.db2.gz JSLDALLACAALJN-LJQANCHMSA-N 0 0 397.504 3.127 20 5 GGBDRN CO[C@@H](C)c1nc(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000272518976 1434903229 /nfs/dbraw/zinc/90/32/29/1434903229.db2.gz KVJSGYXJVXPVHB-LRDDRELGSA-N 0 0 387.465 3.371 20 5 GGBDRN CCc1cc(NCc2nnc(C)n2C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272518357 1434903251 /nfs/dbraw/zinc/90/32/51/1434903251.db2.gz NJWDTWIGJZUEBW-UHFFFAOYSA-N 0 0 379.424 3.461 20 5 GGBDRN CO[C@H](C)c1nc(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000272518984 1434903428 /nfs/dbraw/zinc/90/34/28/1434903428.db2.gz KVJSGYXJVXPVHB-WBMJQRKESA-N 0 0 387.465 3.371 20 5 GGBDRN COc1ccc(CN(C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1O ZINC000272524077 1434903977 /nfs/dbraw/zinc/90/39/77/1434903977.db2.gz ODGWPGINLHWZNH-UHFFFAOYSA-N 0 0 393.827 3.347 20 5 GGBDRN COc1cc(CNCc2ccccc2[N+](=O)[O-])c([N+](=O)[O-])cc1OCC(F)F ZINC000272522359 1434904007 /nfs/dbraw/zinc/90/40/07/1434904007.db2.gz YLXMFAUSAGAACW-UHFFFAOYSA-N 0 0 397.334 3.445 20 5 GGBDRN Cn1ccnc1[C@@H](NCc1ccc(N2CCCC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000272528924 1434904566 /nfs/dbraw/zinc/90/45/66/1434904566.db2.gz MOFQWCAROGKLGF-FQEVSTJZSA-N 0 0 392.463 3.203 20 5 GGBDRN COCCOc1ccccc1CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272530514 1434904704 /nfs/dbraw/zinc/90/47/04/1434904704.db2.gz MZWNFWOFOOFZJI-FQEVSTJZSA-N 0 0 396.447 3.233 20 5 GGBDRN O=C(NC[C@@H]1CCN(c2ccccc2)C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272537538 1434905272 /nfs/dbraw/zinc/90/52/72/1434905272.db2.gz NIGNCWUNHHSEGS-AWEZNQCLSA-N 0 0 375.375 3.329 20 5 GGBDRN COc1cccc(O[C@@H](C)CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000272537916 1434905855 /nfs/dbraw/zinc/90/58/55/1434905855.db2.gz OKBZJHKSODAMKZ-YWZLYKJASA-N 0 0 396.447 3.483 20 5 GGBDRN CCc1nn(C)c(CC)c1CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272542011 1434906061 /nfs/dbraw/zinc/90/60/61/1434906061.db2.gz PJJFWCXXFQJFMV-LJQANCHMSA-N 0 0 382.468 3.066 20 5 GGBDRN COc1ccc(C[C@@H](C)C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000272605678 1434914079 /nfs/dbraw/zinc/91/40/79/1434914079.db2.gz GCYXQIVGGOMGDF-CYBMUJFWSA-N 0 0 388.420 3.116 20 5 GGBDRN O=C(CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)NCC1CC1 ZINC000272616022 1434915790 /nfs/dbraw/zinc/91/57/90/1434915790.db2.gz XLYQWCNKZCIBTK-UHFFFAOYSA-N 0 0 384.392 3.035 20 5 GGBDRN CC(C)CCOC1CCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC1 ZINC000272630152 1434917118 /nfs/dbraw/zinc/91/71/18/1434917118.db2.gz ZRQORSCSCHYRRZ-UHFFFAOYSA-N 0 0 378.454 3.267 20 5 GGBDRN CC[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000272638237 1434918203 /nfs/dbraw/zinc/91/82/03/1434918203.db2.gz BVUATMFNGWSIPX-CRAIPNDOSA-N 0 0 395.423 3.079 20 5 GGBDRN COc1ccc(-c2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)cc1[N+](=O)[O-] ZINC000272637279 1434918210 /nfs/dbraw/zinc/91/82/10/1434918210.db2.gz LFJPBBAAGNWFAL-SFHVURJKSA-N 0 0 396.403 3.227 20 5 GGBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000272643437 1434919087 /nfs/dbraw/zinc/91/90/87/1434919087.db2.gz LXXAYXSHZLZDDM-AWEZNQCLSA-N 0 0 398.467 3.363 20 5 GGBDRN Cc1c(Cc2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)cccc1[N+](=O)[O-] ZINC000272650129 1434919455 /nfs/dbraw/zinc/91/94/55/1434919455.db2.gz MUIVARKSFSIDPF-IBGZPJMESA-N 0 0 394.431 3.451 20 5 GGBDRN COc1ccccc1COC1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000272653021 1434919723 /nfs/dbraw/zinc/91/97/23/1434919723.db2.gz FPPNXKPZPUQLIU-UHFFFAOYSA-N 0 0 386.408 3.212 20 5 GGBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCO[C@@H](c2cccc(OC(F)F)c2)C1 ZINC000272666683 1434920936 /nfs/dbraw/zinc/92/09/36/1434920936.db2.gz JJMXYPJJZHANCF-OAHLLOKOSA-N 0 0 394.334 3.197 20 5 GGBDRN CC(C)c1[nH]nc(-c2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)c1[N+](=O)[O-] ZINC000272681261 1434922213 /nfs/dbraw/zinc/92/22/13/1434922213.db2.gz RZGWFAQPLDBXCR-AWEZNQCLSA-N 0 0 398.423 3.065 20 5 GGBDRN COc1cc(CNCc2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272681447 1434922298 /nfs/dbraw/zinc/92/22/98/1434922298.db2.gz VLYXPQAAQPNKHZ-UHFFFAOYSA-N 0 0 397.334 3.445 20 5 GGBDRN CC(C)Oc1cc(F)ccc1NC(=O)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000272684597 1434922445 /nfs/dbraw/zinc/92/24/45/1434922445.db2.gz VZUUURYKEBENSJ-LBPRGKRZSA-N 0 0 389.383 3.337 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](CCOC)c2ccco2)cc1OC ZINC000272692390 1434923234 /nfs/dbraw/zinc/92/32/34/1434923234.db2.gz OAWVWVVASPFQCZ-CYBMUJFWSA-N 0 0 378.381 3.103 20 5 GGBDRN O=[N+]([O-])c1cccc(Cc2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)c1 ZINC000272707986 1434924726 /nfs/dbraw/zinc/92/47/26/1434924726.db2.gz XMCYHRDPRLXYSR-SFHVURJKSA-N 0 0 380.404 3.142 20 5 GGBDRN O=[N+]([O-])c1cccc([C@H](O)CN2CCc3c(ncn3-c3ccc(F)cc3)C2)c1 ZINC000272724915 1434926296 /nfs/dbraw/zinc/92/62/96/1434926296.db2.gz JRHDSUHDYWELKB-HXUWFJFHSA-N 0 0 382.395 3.011 20 5 GGBDRN Cc1nc2ccccc2n1C[C@H]1CCCN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000272731529 1434926766 /nfs/dbraw/zinc/92/67/66/1434926766.db2.gz PKDKOWBRKWVMKJ-CQSZACIVSA-N 0 0 380.408 3.344 20 5 GGBDRN COc1ccccc1CN(C[C@H]1CCCO1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000272756723 1434928676 /nfs/dbraw/zinc/92/86/76/1434928676.db2.gz UTVIJMBIINKCOB-OAHLLOKOSA-N 0 0 386.408 3.212 20 5 GGBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCCNC(=O)OC(C)(C)C ZINC000272765592 1434929311 /nfs/dbraw/zinc/92/93/11/1434929311.db2.gz PKLWHPALRSEZSK-ZDUSSCGKSA-N 0 0 397.497 3.497 20 5 GGBDRN COc1ccc(NC(=O)c2nn(CC(C)C)c(=O)c3ccccc32)cc1[N+](=O)[O-] ZINC000272811749 1434932768 /nfs/dbraw/zinc/93/27/68/1434932768.db2.gz NHNOWLKEGZLREO-UHFFFAOYSA-N 0 0 396.403 3.222 20 5 GGBDRN Cc1cc(NC(=O)[C@H](C)SCC(=O)OCc2ccc([N+](=O)[O-])c(C)c2)no1 ZINC000272818217 1434933462 /nfs/dbraw/zinc/93/34/62/1434933462.db2.gz WXWYTGPMRDVIAV-LBPRGKRZSA-N 0 0 393.421 3.003 20 5 GGBDRN COc1ccc(NC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000272826405 1434934330 /nfs/dbraw/zinc/93/43/30/1434934330.db2.gz QEBWUHUBESSXEG-UHFFFAOYSA-N 0 0 392.437 3.226 20 5 GGBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000272831537 1434934426 /nfs/dbraw/zinc/93/44/26/1434934426.db2.gz FHVLXGYYDXRFRF-INIZCTEOSA-N 0 0 385.420 3.022 20 5 GGBDRN COc1ccc(NC(=O)NCc2ccc(N3CCCCC3)nc2)cc1[N+](=O)[O-] ZINC000272836366 1434934880 /nfs/dbraw/zinc/93/48/80/1434934880.db2.gz NSZXBUMEBPPAFV-UHFFFAOYSA-N 0 0 385.424 3.310 20 5 GGBDRN COc1ccc(NC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)cc1[N+](=O)[O-] ZINC000272843169 1434935458 /nfs/dbraw/zinc/93/54/58/1434935458.db2.gz UCYCBRJQMZNZGD-CQSZACIVSA-N 0 0 392.456 3.010 20 5 GGBDRN COc1ccc(NC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)cc1[N+](=O)[O-] ZINC000272846901 1434935660 /nfs/dbraw/zinc/93/56/60/1434935660.db2.gz POJAOUKBCQSGAB-UHFFFAOYSA-N 0 0 386.408 3.289 20 5 GGBDRN COCCCOc1ccccc1NC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000272850042 1434935925 /nfs/dbraw/zinc/93/59/25/1434935925.db2.gz ZXCBKQUEQPFMQY-LJQANCHMSA-N 0 0 399.403 3.142 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@@H](c2ccccc2)C2CCC2)cc1[N+](=O)[O-] ZINC000272864868 1434937118 /nfs/dbraw/zinc/93/71/18/1434937118.db2.gz JOKCCFWFPWZETQ-SFHVURJKSA-N 0 0 383.404 3.200 20 5 GGBDRN CCCCCC(=O)NC1CCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000272867041 1434937230 /nfs/dbraw/zinc/93/72/30/1434937230.db2.gz TYJUDKJRFCCGGE-UHFFFAOYSA-N 0 0 392.456 3.296 20 5 GGBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC(CCCO)CC1 ZINC000272869834 1434937395 /nfs/dbraw/zinc/93/73/95/1434937395.db2.gz VDZZNYRGGMAJHO-UHFFFAOYSA-N 0 0 375.450 3.343 20 5 GGBDRN CC[C@@H](C)NC(=O)c1ccc(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000272874632 1434937841 /nfs/dbraw/zinc/93/78/41/1434937841.db2.gz UAYPKOLMPSTELL-SNVBAGLBSA-N 0 0 397.478 3.332 20 5 GGBDRN Cc1cc(C2CCN([C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)CC2)n[nH]1 ZINC000272875093 1434937999 /nfs/dbraw/zinc/93/79/99/1434937999.db2.gz BFVAVAQXINSPDF-GFCCVEGCSA-N 0 0 391.859 3.486 20 5 GGBDRN O=C1OCCN1c1ccc(CNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)cc1 ZINC000272887635 1434938603 /nfs/dbraw/zinc/93/86/03/1434938603.db2.gz XDZHUSXYIQRQJE-UHFFFAOYSA-N 0 0 398.375 3.120 20 5 GGBDRN CNC(=O)c1ccc(N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c([N+](=O)[O-])c1 ZINC000272887251 1434938664 /nfs/dbraw/zinc/93/86/64/1434938664.db2.gz INFZFFXCGJTUQI-GFCCVEGCSA-N 0 0 397.357 3.011 20 5 GGBDRN Cc1nc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)ccc1[C@H](C)O ZINC000272903669 1434940058 /nfs/dbraw/zinc/94/00/58/1434940058.db2.gz CGZGWTPBBGDSLP-JTQLQIEISA-N 0 0 383.326 3.300 20 5 GGBDRN CCC[C@H](Cc1ccccc1)NC(=O)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000272930867 1434942001 /nfs/dbraw/zinc/94/20/01/1434942001.db2.gz NWWPHBDUKRUFEX-OAHLLOKOSA-N 0 0 385.420 3.070 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N(C)CCCCc2ccccc2)cc1[N+](=O)[O-] ZINC000272934724 1434942275 /nfs/dbraw/zinc/94/22/75/1434942275.db2.gz OKBAVGYUOMHJLQ-UHFFFAOYSA-N 0 0 385.420 3.023 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H](c2ccccc2C)C2CC2)cc1[N+](=O)[O-] ZINC000272941403 1434942663 /nfs/dbraw/zinc/94/26/63/1434942663.db2.gz PDEUAURFFVKJMD-SFHVURJKSA-N 0 0 383.404 3.118 20 5 GGBDRN Cc1ccnc(OC2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)c1 ZINC000272944209 1434942833 /nfs/dbraw/zinc/94/28/33/1434942833.db2.gz LLZKYMVRTAXSCJ-UHFFFAOYSA-N 0 0 385.420 3.208 20 5 GGBDRN COc1ccc(NC(=O)C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000272951890 1434943676 /nfs/dbraw/zinc/94/36/76/1434943676.db2.gz QKSBBJQKULSKLE-RDJZCZTQSA-N 0 0 397.431 3.070 20 5 GGBDRN Cc1nc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])ccc1[C@@H](C)O ZINC000272959168 1434944386 /nfs/dbraw/zinc/94/43/86/1434944386.db2.gz JJWXQRPVWBKPHV-GFCCVEGCSA-N 0 0 393.827 3.090 20 5 GGBDRN CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000272975164 1434945671 /nfs/dbraw/zinc/94/56/71/1434945671.db2.gz SJBKGLWLLBUWQW-WCQYABFASA-N 0 0 399.900 3.104 20 5 GGBDRN COc1ccc(NC(=O)C2CCN(Cc3csc(C)n3)CC2)cc1[N+](=O)[O-] ZINC000273009489 1434949654 /nfs/dbraw/zinc/94/96/54/1434949654.db2.gz YTNWKPSXGOMILP-UHFFFAOYSA-N 0 0 390.465 3.219 20 5 GGBDRN Cc1nc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1[C@@H](C)O ZINC000273026809 1434952036 /nfs/dbraw/zinc/95/20/36/1434952036.db2.gz SDECREZVZDRNOQ-SNVBAGLBSA-N 0 0 383.326 3.300 20 5 GGBDRN CC(C)[C@@H]1C[C@H](CC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000273028150 1434952183 /nfs/dbraw/zinc/95/21/83/1434952183.db2.gz XQMQPTQKNVVIGU-APWZRJJASA-N 0 0 375.469 3.085 20 5 GGBDRN COC(=O)COc1ccc(N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000273091222 1434959899 /nfs/dbraw/zinc/95/98/99/1434959899.db2.gz KXQCDLAJFIMUHW-UHFFFAOYSA-N 0 0 386.404 3.087 20 5 GGBDRN Cc1ccnc(OC2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)CC2)c1 ZINC000273098235 1434960452 /nfs/dbraw/zinc/96/04/52/1434960452.db2.gz UCQKYLXHMMZJIL-UHFFFAOYSA-N 0 0 380.404 3.463 20 5 GGBDRN Cn1ccnc1[C@H](NC[C@H](O)CCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000273134798 1434965171 /nfs/dbraw/zinc/96/51/71/1434965171.db2.gz COCSYCLODXNZEX-WOJBJXKFSA-N 0 0 380.448 3.001 20 5 GGBDRN COCCN(Cc1ccccn1)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000273142841 1434965986 /nfs/dbraw/zinc/96/59/86/1434965986.db2.gz UMBMLZPSEHJXKE-UHFFFAOYSA-N 0 0 395.868 3.411 20 5 GGBDRN CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273268537 1434976848 /nfs/dbraw/zinc/97/68/48/1434976848.db2.gz HANDBIHLZMUCNF-MJGOQNOKSA-N 0 0 388.395 3.491 20 5 GGBDRN Cc1cc(-c2noc([C@H](C)NC[C@H](O)c3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000273273727 1434977334 /nfs/dbraw/zinc/97/73/34/1434977334.db2.gz FDVXPJVOZYVCBG-SJCJKPOMSA-N 0 0 386.383 3.477 20 5 GGBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273277051 1434977463 /nfs/dbraw/zinc/97/74/63/1434977463.db2.gz KJENZSQSPLTEFO-PKOBYXMFSA-N 0 0 387.411 3.496 20 5 GGBDRN Nc1ncncc1CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273321265 1434980539 /nfs/dbraw/zinc/98/05/39/1434980539.db2.gz KUADTGDYDZYCCU-UHFFFAOYSA-N 0 0 387.465 3.179 20 5 GGBDRN CN(CC(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000273320558 1434980563 /nfs/dbraw/zinc/98/05/63/1434980563.db2.gz RTYDZXAMHSMDSP-QFBILLFUSA-N 0 0 387.411 3.207 20 5 GGBDRN CCc1ccc(-c2noc([C@@H](C)NCc3ccc(C(N)=O)cc3[N+](=O)[O-])n2)cc1 ZINC000273331928 1434981532 /nfs/dbraw/zinc/98/15/32/1434981532.db2.gz SOSRRFVEGMYICW-GFCCVEGCSA-N 0 0 395.419 3.157 20 5 GGBDRN C[C@@H](CCC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000273347641 1434982236 /nfs/dbraw/zinc/98/22/36/1434982236.db2.gz XXHIIANTQSTWBK-HNNXBMFYSA-N 0 0 390.461 3.069 20 5 GGBDRN CNC(=O)c1ccc(N(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000273351158 1434982511 /nfs/dbraw/zinc/98/25/11/1434982511.db2.gz VFSJGYVHRUIZNA-APWZRJJASA-N 0 0 387.411 3.450 20 5 GGBDRN CSCCCCCCNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000273358568 1434983018 /nfs/dbraw/zinc/98/30/18/1434983018.db2.gz QLCOSVOEZWDAPB-UHFFFAOYSA-N 0 0 395.481 3.323 20 5 GGBDRN CS(=O)(=O)c1ccc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000273360317 1434983058 /nfs/dbraw/zinc/98/30/58/1434983058.db2.gz QMMOAAGRSOIIOF-UHFFFAOYSA-N 0 0 376.434 3.046 20 5 GGBDRN O=C(CNc1ccccc1[C@H](O)C(F)(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000273366365 1434983548 /nfs/dbraw/zinc/98/35/48/1434983548.db2.gz DMJFETSEFUQMKP-KRWDZBQOSA-N 0 0 395.337 3.192 20 5 GGBDRN CN(C[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1)C(=O)OC(C)(C)C ZINC000273365753 1434983643 /nfs/dbraw/zinc/98/36/43/1434983643.db2.gz FXDJORNFXGZHOS-GFCCVEGCSA-N 0 0 396.419 3.455 20 5 GGBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000273369483 1434983976 /nfs/dbraw/zinc/98/39/76/1434983976.db2.gz GQMALYRTPCOLLE-OAHLLOKOSA-N 0 0 381.404 3.316 20 5 GGBDRN CS(=O)(=O)c1ccc(N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000273384100 1434985142 /nfs/dbraw/zinc/98/51/42/1434985142.db2.gz ZHDXCMDYSFRRGG-RDTXWAMCSA-N 0 0 394.424 3.470 20 5 GGBDRN CN([C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273394803 1434985920 /nfs/dbraw/zinc/98/59/20/1434985920.db2.gz FITALLDPFYPXPK-SJLPKXTDSA-N 0 0 394.424 3.275 20 5 GGBDRN CCOC(=O)COc1ccc(NCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000273409900 1434987084 /nfs/dbraw/zinc/98/70/84/1434987084.db2.gz OFYDPHZPTCTXOH-UHFFFAOYSA-N 0 0 390.392 3.166 20 5 GGBDRN O=C(NCc1cccc(CN2CCCC2=O)c1)Nc1ccc([N+](=O)[O-])cc1F ZINC000273453989 1434989804 /nfs/dbraw/zinc/98/98/04/1434989804.db2.gz LSBJJXQANQNVRL-UHFFFAOYSA-N 0 0 386.383 3.178 20 5 GGBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273457093 1434989935 /nfs/dbraw/zinc/98/99/35/1434989935.db2.gz MDJMOZOBHDEZJT-STQMWFEESA-N 0 0 380.420 3.283 20 5 GGBDRN O=C(NCCCOCCO)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000273459495 1434990190 /nfs/dbraw/zinc/99/01/90/1434990190.db2.gz FORINSCMZNRRNS-UHFFFAOYSA-N 0 0 382.482 3.006 20 5 GGBDRN CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000273490702 1434991954 /nfs/dbraw/zinc/99/19/54/1434991954.db2.gz SIYXCLRNOQFYIS-GFCCVEGCSA-N 0 0 382.392 3.207 20 5 GGBDRN CCCOc1ccc(CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000273491995 1434992015 /nfs/dbraw/zinc/99/20/15/1434992015.db2.gz MOBJBPJODJVYOW-UHFFFAOYSA-N 0 0 394.449 3.012 20 5 GGBDRN Cc1ccc(C(=O)N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)CC2)s1 ZINC000273493572 1434992105 /nfs/dbraw/zinc/99/21/05/1434992105.db2.gz TTWJGEQJXADSLG-UHFFFAOYSA-N 0 0 392.412 3.094 20 5 GGBDRN COCCCCN(Cc1ccccc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000273511200 1434993667 /nfs/dbraw/zinc/99/36/67/1434993667.db2.gz QAMOLFKRZTUZCZ-UHFFFAOYSA-N 0 0 392.477 3.353 20 5 GGBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273516065 1434993929 /nfs/dbraw/zinc/99/39/29/1434993929.db2.gz MZAMZQGVJDHSIK-NVXWUHKLSA-N 0 0 394.424 3.241 20 5 GGBDRN CN([C@@H]1CCO[C@H](c2ccc(F)cc2)C1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000273540306 1434995569 /nfs/dbraw/zinc/99/55/69/1434995569.db2.gz SZDUAWJLCPTGCY-WBVHZDCISA-N 0 0 394.424 3.275 20 5 GGBDRN O=C(CCc1cccs1)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000273579863 1434997964 /nfs/dbraw/zinc/99/79/64/1434997964.db2.gz OFTCOLJEOVGLAO-UHFFFAOYSA-N 0 0 399.476 3.204 20 5 GGBDRN CC(C)(C)OC(=O)N1CCC[C@](C)(CNC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000273584401 1434998350 /nfs/dbraw/zinc/99/83/50/1434998350.db2.gz PQWQGYAQUNOYGM-LJQANCHMSA-N 0 0 377.441 3.362 20 5 GGBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273586437 1434998532 /nfs/dbraw/zinc/99/85/32/1434998532.db2.gz HZDZNWXCHQYLNR-WMZOPIPTSA-N 0 0 394.424 3.074 20 5 GGBDRN COc1cc(C(=O)NCC[C@@H]2CCO[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000273599674 1434999095 /nfs/dbraw/zinc/99/90/95/1434999095.db2.gz RMARLMVIHWPOKH-GHMZBOCLSA-N 0 0 388.367 3.140 20 5 GGBDRN O=C(NC1CCC(O)(c2ccccc2)CC1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000273635277 1435001176 /nfs/dbraw/zinc/00/11/76/1435001176.db2.gz BXGUQNLHUBRBDB-UHFFFAOYSA-N 0 0 376.359 3.433 20 5 GGBDRN O=[N+]([O-])c1cnc(Sc2nnc(-c3cccs3)n2C[C@H]2CCCO2)nc1 ZINC000273641940 1435001822 /nfs/dbraw/zinc/00/18/22/1435001822.db2.gz SIWOPVYIZBYBLR-LLVKDONJSA-N 0 0 390.450 3.035 20 5 GGBDRN CC(C)(C)OC(=O)NCCc1noc(C(F)(F)c2ccc([N+](=O)[O-])cc2)n1 ZINC000273646057 1435002204 /nfs/dbraw/zinc/00/22/04/1435002204.db2.gz CQIKFYYTAXTAHI-UHFFFAOYSA-N 0 0 384.339 3.185 20 5 GGBDRN Cc1cc(-c2nc(-c3ccc(C(=O)N4CCOCC4)cc3)no2)ccc1[N+](=O)[O-] ZINC000273665014 1435003615 /nfs/dbraw/zinc/00/36/15/1435003615.db2.gz FIZCXRGTBVXVNE-UHFFFAOYSA-N 0 0 394.387 3.093 20 5 GGBDRN Cc1ccc(-c2noc(C3CCN(C(=O)N4CCCC4)CC3)n2)cc1[N+](=O)[O-] ZINC000273667470 1435003774 /nfs/dbraw/zinc/00/37/74/1435003774.db2.gz BJEJGJPJTXXQEI-UHFFFAOYSA-N 0 0 385.424 3.348 20 5 GGBDRN CCCOc1c(Cl)cc(-c2noc(Cn3ccc([N+](=O)[O-])n3)n2)cc1OC ZINC000273672265 1435004138 /nfs/dbraw/zinc/00/41/38/1435004138.db2.gz GNVAXEXZCLTSNO-UHFFFAOYSA-N 0 0 393.787 3.340 20 5 GGBDRN Cc1nn(C)c(-c2nc(Cc3nc4ccccc4n3C(F)F)no2)c1[N+](=O)[O-] ZINC000273716878 1435007540 /nfs/dbraw/zinc/00/75/40/1435007540.db2.gz LFKZGIZHBJMQPI-UHFFFAOYSA-N 0 0 389.322 3.022 20 5 GGBDRN CCCN(CCC)C(=O)CCc1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000273756521 1435011246 /nfs/dbraw/zinc/01/12/46/1435011246.db2.gz CWPZNJCITNUHRT-UHFFFAOYSA-N 0 0 389.456 3.214 20 5 GGBDRN CC(=O)NCCc1noc(-c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)n1 ZINC000273760240 1435011668 /nfs/dbraw/zinc/01/16/68/1435011668.db2.gz DIEVJHKGXMQXAP-UHFFFAOYSA-N 0 0 378.454 3.462 20 5 GGBDRN O=C1C[C@@H](c2noc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)CN1CC1CCC1 ZINC000273783993 1435014076 /nfs/dbraw/zinc/01/40/76/1435014076.db2.gz ADHHMWQPFILNSG-CQSZACIVSA-N 0 0 395.419 3.166 20 5 GGBDRN CSc1ccc(-c2nc(CCNC(=O)OC(C)(C)C)no2)cc1[N+](=O)[O-] ZINC000273790334 1435014576 /nfs/dbraw/zinc/01/45/76/1435014576.db2.gz WTSIAFAYMWHMHJ-UHFFFAOYSA-N 0 0 380.426 3.434 20 5 GGBDRN O=C1C[C@H](c2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)CN1CC1CCC1 ZINC000273799874 1435015709 /nfs/dbraw/zinc/01/57/09/1435015709.db2.gz BOEHVACGHMBWRZ-AWEZNQCLSA-N 0 0 397.435 3.335 20 5 GGBDRN Cc1nn(CCc2nc(Cc3c[nH]c4cc(F)ccc34)no2)c(C)c1[N+](=O)[O-] ZINC000273805969 1435016279 /nfs/dbraw/zinc/01/62/79/1435016279.db2.gz IKRKPNVRIFTDGF-UHFFFAOYSA-N 0 0 384.371 3.245 20 5 GGBDRN Cc1nn(C)c(C)c1C[C@H](C)c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000273818612 1435018124 /nfs/dbraw/zinc/01/81/24/1435018124.db2.gz IZDSZQAZSAUDRK-LBPRGKRZSA-N 0 0 384.440 3.329 20 5 GGBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1cccc(F)c1 ZINC000273831068 1435019104 /nfs/dbraw/zinc/01/91/04/1435019104.db2.gz HHQMIBUDBZQPEK-APPDUMDISA-N 0 0 378.375 3.389 20 5 GGBDRN CO[C@H](C)c1nc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cs1 ZINC000273845751 1435020889 /nfs/dbraw/zinc/02/08/89/1435020889.db2.gz KLJFOMSDSGTHIF-SNVBAGLBSA-N 0 0 381.429 3.492 20 5 GGBDRN Cc1ccc(-c2noc([C@@H]3CCCN(C(=O)NCC(C)C)C3)n2)cc1[N+](=O)[O-] ZINC000273846276 1435020893 /nfs/dbraw/zinc/02/08/93/1435020893.db2.gz QCJVUIRALIQACT-OAHLLOKOSA-N 0 0 387.440 3.498 20 5 GGBDRN COc1ccc(CNC(=O)NC2CCC(O)(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000273850344 1435021420 /nfs/dbraw/zinc/02/14/20/1435021420.db2.gz SGOABIGMBJVZHK-UHFFFAOYSA-N 0 0 399.447 3.233 20 5 GGBDRN CC(=O)N(CCc1ccccc1)Cc1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1 ZINC000273849951 1435021431 /nfs/dbraw/zinc/02/14/31/1435021431.db2.gz FZLCWTWQSPZLBW-UHFFFAOYSA-N 0 0 394.431 3.468 20 5 GGBDRN C[C@@H]1C[C@H](C)CN(c2ccc(-c3nc(C[S@](C)=O)no3)cc2[N+](=O)[O-])C1 ZINC000273855648 1435022032 /nfs/dbraw/zinc/02/20/32/1435022032.db2.gz IZWJPEWNHFUJNW-OCKKGZKQSA-N 0 0 378.454 3.006 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000273862798 1435022811 /nfs/dbraw/zinc/02/28/11/1435022811.db2.gz JCRMYDQVPDIWDG-INIZCTEOSA-N 0 0 388.445 3.366 20 5 GGBDRN CS(=O)(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000273862802 1435022870 /nfs/dbraw/zinc/02/28/70/1435022870.db2.gz JCRMYDQVPDIWDG-MRXNPFEDSA-N 0 0 388.445 3.366 20 5 GGBDRN Cc1c(Cc2nc([C@H]3CC(=O)N(c4ccccc4)C3)no2)cccc1[N+](=O)[O-] ZINC000273864906 1435023047 /nfs/dbraw/zinc/02/30/47/1435023047.db2.gz JQQUMPRLBRIUFU-HNNXBMFYSA-N 0 0 378.388 3.398 20 5 GGBDRN CCN(Cc1noc(-c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n1)C(=O)OC(C)(C)C ZINC000273871227 1435023837 /nfs/dbraw/zinc/02/38/37/1435023837.db2.gz NIWNLJAYYDUDCO-UHFFFAOYSA-N 0 0 393.356 3.310 20 5 GGBDRN O=C1C[C@H](c2noc(CCc3cccc([N+](=O)[O-])c3)n2)CN1c1ccccc1 ZINC000273872554 1435023967 /nfs/dbraw/zinc/02/39/67/1435023967.db2.gz KHLOKAKDSQSBPN-HNNXBMFYSA-N 0 0 378.388 3.284 20 5 GGBDRN COc1cccc(OC)c1OCc1noc(Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000273874877 1435024178 /nfs/dbraw/zinc/02/41/78/1435024178.db2.gz FBOZELKOKONSTQ-UHFFFAOYSA-N 0 0 385.376 3.473 20 5 GGBDRN O=c1oc2cc([N+](=O)[O-])ccc2n1CCCc1nc([C@H]2CCCCS2)no1 ZINC000273874024 1435024228 /nfs/dbraw/zinc/02/42/28/1435024228.db2.gz CZXROKUNKGKMDW-CQSZACIVSA-N 0 0 390.421 3.477 20 5 GGBDRN CC(C)(C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1F ZINC000273884005 1435025029 /nfs/dbraw/zinc/02/50/29/1435025029.db2.gz TXSFRSNORDQQPH-AWEZNQCLSA-N 0 0 399.422 3.213 20 5 GGBDRN COc1cc(-c2nc([C@H]3CC(=O)N(Cc4ccccc4)C3)no2)ccc1[N+](=O)[O-] ZINC000273897179 1435026412 /nfs/dbraw/zinc/02/64/12/1435026412.db2.gz GPBCDOOGGVITAV-HNNXBMFYSA-N 0 0 394.387 3.170 20 5 GGBDRN CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273897647 1435026598 /nfs/dbraw/zinc/02/65/98/1435026598.db2.gz NVEJQEZZFNFJAI-QYRWSJFESA-N 0 0 384.473 3.208 20 5 GGBDRN CC(=O)N(CCc1noc(CCOc2ccc(Cl)cc2[N+](=O)[O-])n1)C(C)C ZINC000273898554 1435026666 /nfs/dbraw/zinc/02/66/66/1435026666.db2.gz JTWVOAGCJLLAAV-UHFFFAOYSA-N 0 0 396.831 3.052 20 5 GGBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccc(F)cc1 ZINC000273900965 1435026724 /nfs/dbraw/zinc/02/67/24/1435026724.db2.gz XEKCCDPCYKNIMN-APPDUMDISA-N 0 0 378.375 3.389 20 5 GGBDRN COc1cc([C@H](C)NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)cc(OC)c1OC ZINC000273901974 1435027060 /nfs/dbraw/zinc/02/70/60/1435027060.db2.gz FPQYMCPXQBJGHK-VIFPVBQESA-N 0 0 396.346 3.390 20 5 GGBDRN Cc1cc([C@](C)(O)CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)c(C)o1 ZINC000273903114 1435027066 /nfs/dbraw/zinc/02/70/66/1435027066.db2.gz XYYQKUPJCCOWAL-LJQANCHMSA-N 0 0 378.400 3.245 20 5 GGBDRN O=[N+]([O-])c1ccccc1NCCc1nc(-c2cccnc2N2CCCC2)no1 ZINC000273913624 1435028203 /nfs/dbraw/zinc/02/82/03/1435028203.db2.gz KJMRIHWGWFZQJN-UHFFFAOYSA-N 0 0 380.408 3.295 20 5 GGBDRN CC(C)(C(=O)NC[C@H]1CCN(CC(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273919777 1435028799 /nfs/dbraw/zinc/02/87/99/1435028799.db2.gz QHHPXGDLTDOMTI-LLVKDONJSA-N 0 0 391.365 3.012 20 5 GGBDRN Cc1cc(Cc2noc(CCCNC(=O)OC(C)(C)C)n2)ccc1[N+](=O)[O-] ZINC000273922906 1435028983 /nfs/dbraw/zinc/02/89/83/1435028983.db2.gz LJFCWGYIVVQDML-UHFFFAOYSA-N 0 0 376.413 3.334 20 5 GGBDRN CN(Cc1ccc([S@@](C)=O)cc1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273923502 1435028987 /nfs/dbraw/zinc/02/89/87/1435028987.db2.gz QUJZECKWDQCRNN-HHHXNRCGSA-N 0 0 392.452 3.408 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(-c3nc([C@@H]4CN(C5CC5)CCO4)no3)cs2)cc1 ZINC000273924730 1435029113 /nfs/dbraw/zinc/02/91/13/1435029113.db2.gz QVHHCGFBASVIBB-HNNXBMFYSA-N 0 0 399.432 3.304 20 5 GGBDRN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)CC(=O)N2 ZINC000273926992 1435029277 /nfs/dbraw/zinc/02/92/77/1435029277.db2.gz RGKBATRDVBQMGS-LLVKDONJSA-N 0 0 385.395 3.384 20 5 GGBDRN Cc1nn(CCc2nc(CCCOCCc3ccccc3)no2)c(C)c1[N+](=O)[O-] ZINC000273926940 1435029294 /nfs/dbraw/zinc/02/92/94/1435029294.db2.gz RBHSXDBGZILOMC-UHFFFAOYSA-N 0 0 399.451 3.226 20 5 GGBDRN CC(C)(C(=O)NCC[S@@](=O)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000273930763 1435029617 /nfs/dbraw/zinc/02/96/17/1435029617.db2.gz RPHQWNWTMMZQAI-HHHXNRCGSA-N 0 0 392.452 3.077 20 5 GGBDRN COCCCOC1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273944598 1435030844 /nfs/dbraw/zinc/03/08/44/1435030844.db2.gz KZDRQWBEIYCOHC-UHFFFAOYSA-N 0 0 382.432 3.056 20 5 GGBDRN Cc1nn(CCc2nc(-c3ccnc(OC4CCC4)c3)no2)c(C)c1[N+](=O)[O-] ZINC000273948996 1435031319 /nfs/dbraw/zinc/03/13/19/1435031319.db2.gz YSIUWFYMSHPIBF-UHFFFAOYSA-N 0 0 384.396 3.027 20 5 GGBDRN CC(C)(C(=O)NCC[C@@H]1C(=O)Nc2ccccc21)c1ccc([N+](=O)[O-])cc1F ZINC000273955012 1435031908 /nfs/dbraw/zinc/03/19/08/1435031908.db2.gz VJMABCCSDSIGGN-AWEZNQCLSA-N 0 0 385.395 3.254 20 5 GGBDRN CC(C)(C(=O)N1CC[C@@H](OCc2ccncc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000273959632 1435032240 /nfs/dbraw/zinc/03/22/40/1435032240.db2.gz ONXDBETWILJUGB-MRXNPFEDSA-N 0 0 387.411 3.224 20 5 GGBDRN CCOC(=O)c1csc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000273962660 1435032453 /nfs/dbraw/zinc/03/24/53/1435032453.db2.gz WIBSYTJURVGAQS-UHFFFAOYSA-N 0 0 381.385 3.283 20 5 GGBDRN CSc1ccc(-c2nc([C@H]3CC(=O)N(CC4CCC4)C3)no2)cc1[N+](=O)[O-] ZINC000273964086 1435032566 /nfs/dbraw/zinc/03/25/66/1435032566.db2.gz OEIZHNAMVUGTEI-ZDUSSCGKSA-N 0 0 388.449 3.483 20 5 GGBDRN CSc1ccc(-c2nc([C@@H]3CC(=O)N(CC4CCC4)C3)no2)cc1[N+](=O)[O-] ZINC000273964084 1435032699 /nfs/dbraw/zinc/03/26/99/1435032699.db2.gz OEIZHNAMVUGTEI-CYBMUJFWSA-N 0 0 388.449 3.483 20 5 GGBDRN Cc1nn(CC(C)C)c(C)c1CCc1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000273966433 1435032790 /nfs/dbraw/zinc/03/27/90/1435032790.db2.gz OJDRKWKDRVSQAD-UHFFFAOYSA-N 0 0 384.440 3.218 20 5 GGBDRN CC(C)CC(=O)N1CCC(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273966329 1435032923 /nfs/dbraw/zinc/03/29/23/1435032923.db2.gz PYWLGTVFSVPFMI-UHFFFAOYSA-N 0 0 393.459 3.165 20 5 GGBDRN CCCC(=O)NC[C@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273988357 1435034926 /nfs/dbraw/zinc/03/49/26/1435034926.db2.gz WOACGZRQOZMHIR-CQSZACIVSA-N 0 0 393.459 3.166 20 5 GGBDRN CC(=O)N1CCc2cc(-c3nc(Cc4ccc([N+](=O)[O-])c(C)c4)no3)ccc21 ZINC000273991000 1435035165 /nfs/dbraw/zinc/03/51/65/1435035165.db2.gz QGJPJXFRKWNMQO-UHFFFAOYSA-N 0 0 378.388 3.453 20 5 GGBDRN CC(C)C(=O)NC[C@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273995050 1435035519 /nfs/dbraw/zinc/03/55/19/1435035519.db2.gz YGLQNMIAUCGRQS-CQSZACIVSA-N 0 0 393.459 3.022 20 5 GGBDRN CC(C)(C)OC(=O)N(CC1CC1)C1CCN(c2ncc([N+](=O)[O-])cn2)CC1 ZINC000274012848 1435037011 /nfs/dbraw/zinc/03/70/11/1435037011.db2.gz VECYQNHSFYZGBD-UHFFFAOYSA-N 0 0 377.445 3.001 20 5 GGBDRN O=C(NC1CCCCC1)C1CCN(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)CC1 ZINC000274013718 1435037177 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ZINC000280165777 1435602180 /nfs/dbraw/zinc/60/21/80/1435602180.db2.gz CICXWKWLCFLGGA-MRXNPFEDSA-N 0 0 376.434 3.385 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000280176327 1435604301 /nfs/dbraw/zinc/60/43/01/1435604301.db2.gz SSPKLGJUAOMHDX-ZDUSSCGKSA-N 0 0 396.403 3.458 20 5 GGBDRN C[C@@H](C(=O)OC(C)(C)C)c1noc([C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)n1 ZINC000280189938 1435605872 /nfs/dbraw/zinc/60/58/72/1435605872.db2.gz ASXWXDSRJHYGTH-YGRLFVJLSA-N 0 0 388.380 3.289 20 5 GGBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2nc(C3CCOCC3)no2)ccc1[N+](=O)[O-] ZINC000280192399 1435606452 /nfs/dbraw/zinc/60/64/52/1435606452.db2.gz DEDVTHWOEAGCNM-MRXNPFEDSA-N 0 0 386.408 3.158 20 5 GGBDRN Cc1c(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cccc1N1C(=O)CNC1=O ZINC000280199212 1435607534 /nfs/dbraw/zinc/60/75/34/1435607534.db2.gz MOPOMHNCWQZBTJ-UHFFFAOYSA-N 0 0 396.403 3.335 20 5 GGBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000280205298 1435608329 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3.393 20 5 GGBDRN Cc1ccc([C@H](C)NC(=O)Nc2cc([C@H]3CCCOC3)nn2C)cc1[N+](=O)[O-] ZINC000280312912 1435632685 /nfs/dbraw/zinc/63/26/85/1435632685.db2.gz XWAAINPJPZMHFI-ZFWWWQNUSA-N 0 0 387.440 3.413 20 5 GGBDRN Cc1cc(NC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000280358261 1435643523 /nfs/dbraw/zinc/64/35/23/1435643523.db2.gz CMJVLXFGZISLFZ-INIZCTEOSA-N 0 0 376.434 3.060 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CS(=O)(=O)CCCC3CCOCC3)co2)cc1 ZINC000280372950 1435646643 /nfs/dbraw/zinc/64/66/43/1435646643.db2.gz CVDZZNPTXHDJSA-UHFFFAOYSA-N 0 0 394.449 3.371 20 5 GGBDRN CC1(C)CN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[C@@H]1O ZINC000280378828 1435648554 /nfs/dbraw/zinc/64/85/54/1435648554.db2.gz WVACDQNOJOLHIQ-IBGZPJMESA-N 0 0 384.432 3.407 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2C(=O)CCC2=O)c(C)c1 ZINC000280383066 1435649824 /nfs/dbraw/zinc/64/98/24/1435649824.db2.gz JZPXCSNMAUIAAK-UHFFFAOYSA-N 0 0 397.387 3.208 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])sc1C ZINC000280387119 1435650805 /nfs/dbraw/zinc/65/08/05/1435650805.db2.gz HKJDFCGBJHYIIA-LBPRGKRZSA-N 0 0 392.393 3.396 20 5 GGBDRN COC(=O)c1nc([C@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])sc1C ZINC000280387107 1435650827 /nfs/dbraw/zinc/65/08/27/1435650827.db2.gz HKJDFCGBJHYIIA-GFCCVEGCSA-N 0 0 392.393 3.396 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)Cc1ccc([S@](C)=O)cc1 ZINC000280404280 1435654652 /nfs/dbraw/zinc/65/46/52/1435654652.db2.gz LCCVZYBLQLUMSX-SANMLTNESA-N 0 0 376.434 3.003 20 5 GGBDRN CCOc1cc(NC(=O)[C@H](NC(C)=O)C2CCCC2)c([N+](=O)[O-])cc1OCC ZINC000280415708 1435656771 /nfs/dbraw/zinc/65/67/71/1435656771.db2.gz HRFXPDDMSGEUCQ-GOSISDBHSA-N 0 0 393.440 3.026 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCC(O)(c2ccccc2)CC1 ZINC000280431760 1435659700 /nfs/dbraw/zinc/65/97/00/1435659700.db2.gz JQAYIIVWIFLPJE-UHFFFAOYSA-N 0 0 392.814 3.440 20 5 GGBDRN C[C@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@]2(CCOC2)O1 ZINC000280430345 1435659880 /nfs/dbraw/zinc/65/98/80/1435659880.db2.gz ZZGKCVMYSHJKDY-SCLBCKFNSA-N 0 0 375.450 3.098 20 5 GGBDRN C[C@H](C(=O)OC(C)(C)C)c1noc(-c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1 ZINC000280447397 1435662636 /nfs/dbraw/zinc/66/26/36/1435662636.db2.gz DBTDNJPSKNGMOK-NSHDSACASA-N 0 0 385.380 3.276 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CC1 ZINC000280463987 1435664915 /nfs/dbraw/zinc/66/49/15/1435664915.db2.gz OOLBDNIQYDLTNQ-CYBMUJFWSA-N 0 0 393.440 3.027 20 5 GGBDRN C[C@@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC2(CCOCC2)O1 ZINC000280467681 1435665810 /nfs/dbraw/zinc/66/58/10/1435665810.db2.gz MVDMLAANUQAOQR-CQSZACIVSA-N 0 0 389.477 3.488 20 5 GGBDRN CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000280479712 1435667602 /nfs/dbraw/zinc/66/76/02/1435667602.db2.gz JTWGSEPQCWFJGA-INIZCTEOSA-N 0 0 388.342 3.024 20 5 GGBDRN CC(C)Oc1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C(N)=O ZINC000280507502 1435670994 /nfs/dbraw/zinc/67/09/94/1435670994.db2.gz MUPZZTXQMKWNJS-LBPRGKRZSA-N 0 0 386.408 3.364 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)S(C)(=O)=O)cc1 ZINC000280508759 1435671280 /nfs/dbraw/zinc/67/12/80/1435671280.db2.gz ACAJSBIBBSWLEV-GUYCJALGSA-N 0 0 391.449 3.199 20 5 GGBDRN Cc1ccc([C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000280508751 1435671473 /nfs/dbraw/zinc/67/14/73/1435671473.db2.gz ACAJSBIBBSWLEV-CXAGYDPISA-N 0 0 391.449 3.199 20 5 GGBDRN CC(C)c1nnc([C@H]2CN(c3cc(C(F)(F)F)ncc3[N+](=O)[O-])CCO2)o1 ZINC000280522717 1435672837 /nfs/dbraw/zinc/67/28/37/1435672837.db2.gz QXNWDHAPGGBOKR-LLVKDONJSA-N 0 0 387.318 3.093 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000280541965 1435676246 /nfs/dbraw/zinc/67/62/46/1435676246.db2.gz IDBAJMSMNIMSMB-MRXNPFEDSA-N 0 0 399.451 3.120 20 5 GGBDRN Cc1c(NC(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000280549776 1435678134 /nfs/dbraw/zinc/67/81/34/1435678134.db2.gz MTYJMZZINGPGII-HNNXBMFYSA-N 0 0 382.420 3.420 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@H](C(C)(C)C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000280572507 1435681765 /nfs/dbraw/zinc/68/17/65/1435681765.db2.gz OYSFIJPPAIOWTH-HNNXBMFYSA-N 0 0 398.463 3.347 20 5 GGBDRN Cc1cc(=O)c(C(=O)N2CCC[C@@H](C(C)(C)C)C2)nn1-c1ccccc1[N+](=O)[O-] ZINC000280572515 1435681859 /nfs/dbraw/zinc/68/18/59/1435681859.db2.gz OYSFIJPPAIOWTH-OAHLLOKOSA-N 0 0 398.463 3.347 20 5 GGBDRN Cc1csc([C@@H]2COCCN2C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])n1 ZINC000280579762 1435682920 /nfs/dbraw/zinc/68/29/20/1435682920.db2.gz WOIMZULGGCODRQ-AWEZNQCLSA-N 0 0 399.831 3.295 20 5 GGBDRN COC(=O)c1nc([C@@H]2CCCN2c2nc3sccn3c2[N+](=O)[O-])sc1C ZINC000280597663 1435685628 /nfs/dbraw/zinc/68/56/28/1435685628.db2.gz XLICSNUEJOLAJY-VIFPVBQESA-N 0 0 393.450 3.197 20 5 GGBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@@](C)(O)CC3)cc2[N+](=O)[O-])C1 ZINC000280602116 1435687195 /nfs/dbraw/zinc/68/71/95/1435687195.db2.gz OPTYMZQIXMIICA-WHSLLNHNSA-N 0 0 389.496 3.454 20 5 GGBDRN CC1CCN(c2ccc(C(=O)N3CCC[C@@](C)(O)CC3)cc2[N+](=O)[O-])CC1 ZINC000280614873 1435689882 /nfs/dbraw/zinc/68/98/82/1435689882.db2.gz PTJUPJLCXAPRJF-HXUWFJFHSA-N 0 0 375.469 3.208 20 5 GGBDRN O=C(c1cc2nccnc2cc1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000280627262 1435692699 /nfs/dbraw/zinc/69/26/99/1435692699.db2.gz YQWPKZAJSZJNQD-UHFFFAOYSA-N 0 0 396.378 3.361 20 5 GGBDRN O=C(c1ccc(NCc2ccc(Cl)c([N+](=O)[O-])c2)cc1)N1CCC(O)CC1 ZINC000280642137 1435696135 /nfs/dbraw/zinc/69/61/35/1435696135.db2.gz IOGDMIKGMOTVHV-UHFFFAOYSA-N 0 0 389.839 3.457 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000280695789 1435705607 /nfs/dbraw/zinc/70/56/07/1435705607.db2.gz NTBRBIAXXMKCQK-MQMHXKEQSA-N 0 0 382.342 3.263 20 5 GGBDRN C[C@@]1(O)CCCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000280728461 1435710823 /nfs/dbraw/zinc/71/08/23/1435710823.db2.gz YROBHIIFEJOHJI-MRXNPFEDSA-N 0 0 389.374 3.179 20 5 GGBDRN CCC(=O)c1ccc(N[C@H](C)c2ccc(S(=O)(=O)NC)cc2)c([N+](=O)[O-])c1 ZINC000280734886 1435711593 /nfs/dbraw/zinc/71/15/93/1435711593.db2.gz NQEHDQXWMOGTQV-GFCCVEGCSA-N 0 0 391.449 3.269 20 5 GGBDRN CCC(=O)c1ccc(N[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)c([N+](=O)[O-])c1 ZINC000280734907 1435711752 /nfs/dbraw/zinc/71/17/52/1435711752.db2.gz NQEHDQXWMOGTQV-LBPRGKRZSA-N 0 0 391.449 3.269 20 5 GGBDRN C[C@@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@@]2(CCOC2)O1 ZINC000280739648 1435712400 /nfs/dbraw/zinc/71/24/00/1435712400.db2.gz ZMZVZXBSRYPSSN-JLCFBVMHSA-N 0 0 378.428 3.114 20 5 GGBDRN CCC(=O)c1ccc(NCc2ccccc2CS(C)(=O)=O)c([N+](=O)[O-])c1 ZINC000280746884 1435713616 /nfs/dbraw/zinc/71/36/16/1435713616.db2.gz PCXRKUPIODEXLD-UHFFFAOYSA-N 0 0 376.434 3.344 20 5 GGBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(C(=O)NCc2ccco2)c1 ZINC000280750451 1435713994 /nfs/dbraw/zinc/71/39/94/1435713994.db2.gz PLNMOPXGEKPHSH-UHFFFAOYSA-N 0 0 383.408 3.255 20 5 GGBDRN CCCC(=O)NC[C@@H]1CCCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000280748616 1435714012 /nfs/dbraw/zinc/71/40/12/1435714012.db2.gz XALIIVGTFJHLNT-LBPRGKRZSA-N 0 0 399.850 3.085 20 5 GGBDRN O=C(Nc1cccc(N2CCC2=O)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000280755805 1435715216 /nfs/dbraw/zinc/71/52/16/1435715216.db2.gz XPBZAIRILYALGC-UHFFFAOYSA-N 0 0 380.404 3.184 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCc1nc2ccccc2n1CC ZINC000280774272 1435718048 /nfs/dbraw/zinc/71/80/48/1435718048.db2.gz CBFZYKCKDUYKHC-UHFFFAOYSA-N 0 0 382.420 3.336 20 5 GGBDRN COc1cc(-c2nc([C@H](C)C(=O)OC(C)(C)C)no2)cc([N+](=O)[O-])c1OC ZINC000280802343 1435723012 /nfs/dbraw/zinc/72/30/12/1435723012.db2.gz INWJRWLLHQYLJL-VIFPVBQESA-N 0 0 379.369 3.107 20 5 GGBDRN CCC(=O)c1ccc(NCc2cccc(C(=O)N3CCOCC3)c2)c([N+](=O)[O-])c1 ZINC000280809054 1435724515 /nfs/dbraw/zinc/72/45/15/1435724515.db2.gz WTKSIWIJRJTYGJ-UHFFFAOYSA-N 0 0 397.431 3.272 20 5 GGBDRN CC[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000280820446 1435725577 /nfs/dbraw/zinc/72/55/77/1435725577.db2.gz 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ZINC000280930517 1435743815 /nfs/dbraw/zinc/74/38/15/1435743815.db2.gz KJBFOPJUUSXIHL-UHFFFAOYSA-N 0 0 389.383 3.222 20 5 GGBDRN O=C(CCNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N1CCCCCC1 ZINC000280987825 1435751782 /nfs/dbraw/zinc/75/17/82/1435751782.db2.gz QCDVPKXIQYPHKN-UHFFFAOYSA-N 0 0 396.447 3.179 20 5 GGBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](OCc2ccncc2)C1 ZINC000281024791 1435758372 /nfs/dbraw/zinc/75/83/72/1435758372.db2.gz OPZGWHSQHNKVKC-KSSFIOAISA-N 0 0 395.419 3.392 20 5 GGBDRN Cc1ccc([C@H](NC(=O)c2cccc([N+](=O)[O-])c2C)[C@H](C)S(C)(=O)=O)cc1 ZINC000281040606 1435761779 /nfs/dbraw/zinc/76/17/79/1435761779.db2.gz RDOJEUSPJAODPB-KBXCAEBGSA-N 0 0 390.461 3.116 20 5 GGBDRN Cc1ccc([C@@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000281043628 1435762451 /nfs/dbraw/zinc/76/24/51/1435762451.db2.gz RJFPCPVCSGPLFH-KDOFPFPSSA-N 0 0 390.461 3.116 20 5 GGBDRN CNC(=O)COc1ccc(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c(C)c1 ZINC000281059008 1435765690 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399.447 3.386 20 5 GGBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccc(O[C@@H]2CCN(C)C2=O)cc1C ZINC000281183127 1435791043 /nfs/dbraw/zinc/79/10/43/1435791043.db2.gz LYHSKGCNJDBJAV-LJQANCHMSA-N 0 0 385.420 3.133 20 5 GGBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NC1CCN(c2nccs2)CC1 ZINC000281205690 1435795577 /nfs/dbraw/zinc/79/55/77/1435795577.db2.gz IQKKQMUTFKPSJY-UHFFFAOYSA-N 0 0 398.847 3.172 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000281243398 1435800532 /nfs/dbraw/zinc/80/05/32/1435800532.db2.gz COLGECFOFZCJGC-PTLICHBZSA-N 0 0 385.464 3.407 20 5 GGBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](O)c1cccc(OC(C)C)c1 ZINC000281252057 1435800826 /nfs/dbraw/zinc/80/08/26/1435800826.db2.gz OJNUJOCGKHDOSP-QGZVFWFLSA-N 0 0 388.420 3.244 20 5 GGBDRN Cc1ccc(C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc1[N+](=O)[O-] ZINC000281272320 1435801757 /nfs/dbraw/zinc/80/17/57/1435801757.db2.gz HIZRCGRXZPNYIS-SFHVURJKSA-N 0 0 383.404 3.073 20 5 GGBDRN 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ZINC000281385459 1435806590 /nfs/dbraw/zinc/80/65/90/1435806590.db2.gz HOUMBTOJXOGUDJ-NSHDSACASA-N 0 0 389.412 3.197 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OC)cc1OCCOC ZINC000281408828 1435807638 /nfs/dbraw/zinc/80/76/38/1435807638.db2.gz PJZISVFPWVCNIJ-UHFFFAOYSA-N 0 0 390.392 3.280 20 5 GGBDRN CCCOc1cccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)c1 ZINC000281423670 1435808340 /nfs/dbraw/zinc/80/83/40/1435808340.db2.gz KPZWRDBCJKTYOJ-UHFFFAOYSA-N 0 0 387.392 3.360 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1S(=O)(=O)C(C)C ZINC000281428214 1435808508 /nfs/dbraw/zinc/80/85/08/1435808508.db2.gz QMHQJXHVZKVDBO-UHFFFAOYSA-N 0 0 392.433 3.428 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccccc2N2CCOC2=O)c1 ZINC000281445928 1435809310 /nfs/dbraw/zinc/80/93/10/1435809310.db2.gz DXYMDEOXSZZACK-UHFFFAOYSA-N 0 0 385.376 3.267 20 5 GGBDRN Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000281463381 1435809828 /nfs/dbraw/zinc/80/98/28/1435809828.db2.gz 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ZINC000281519274 1435812028 /nfs/dbraw/zinc/81/20/28/1435812028.db2.gz XYUVLSZSDAANIA-UOJCXKCYSA-N 0 0 377.441 3.397 20 5 GGBDRN CO[C@@H](C)c1nc(CNC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1 ZINC000281536503 1435812593 /nfs/dbraw/zinc/81/25/93/1435812593.db2.gz JYGLHCSMIADTMO-LBPRGKRZSA-N 0 0 379.438 3.152 20 5 GGBDRN COC[C@H](C)Nc1ccccc1NC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 ZINC000281537936 1435812734 /nfs/dbraw/zinc/81/27/34/1435812734.db2.gz SEAYXKBJPGMJDH-ORAYPTAESA-N 0 0 398.419 3.173 20 5 GGBDRN CN(CCCOCc1ccccc1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000281595577 1435814977 /nfs/dbraw/zinc/81/49/77/1435814977.db2.gz RKFIVHYJHRRUGR-UHFFFAOYSA-N 0 0 397.435 3.219 20 5 GGBDRN COc1cc(OC)c(OC)cc1NC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000281602411 1435815258 /nfs/dbraw/zinc/81/52/58/1435815258.db2.gz OLMWWVUBEIWGJS-UHFFFAOYSA-N 0 0 390.392 3.337 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2noc(-c3ccccc3C)n2)c1 ZINC000281633851 1435816535 /nfs/dbraw/zinc/81/65/35/1435816535.db2.gz QQOLGXFESKQWNV-UHFFFAOYSA-N 0 0 396.403 3.347 20 5 GGBDRN CCCn1ccnc1CCCN(C)C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000281650491 1435817054 /nfs/dbraw/zinc/81/70/54/1435817054.db2.gz RTWJFYBZLWHVFV-UHFFFAOYSA-N 0 0 388.468 3.370 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(CC)CCc1cccs1 ZINC000281648906 1435817099 /nfs/dbraw/zinc/81/70/99/1435817099.db2.gz IJKUAQGMAVAVQD-UHFFFAOYSA-N 0 0 391.449 3.085 20 5 GGBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC(O)(c3ccccc3)CC2)c1 ZINC000281735231 1435819988 /nfs/dbraw/zinc/81/99/88/1435819988.db2.gz XTEBANZQKDRPLF-UHFFFAOYSA-N 0 0 384.432 3.182 20 5 GGBDRN Cc1cc(OCC(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000281735381 1435820054 /nfs/dbraw/zinc/82/00/54/1435820054.db2.gz RGLKJTDQQMANBI-PWFNWSNSSA-N 0 0 390.461 3.239 20 5 GGBDRN C[S@](=O)C1(CNC(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000281751813 1435820618 /nfs/dbraw/zinc/82/06/18/1435820618.db2.gz JIYGVHMXYFBDBL-SANMLTNESA-N 0 0 390.486 3.387 20 5 GGBDRN CCN(C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)[C@H]1CCNC1=O ZINC000281753592 1435820776 /nfs/dbraw/zinc/82/07/76/1435820776.db2.gz IBWRXDVAPBJYDV-KRWDZBQOSA-N 0 0 385.445 3.097 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nc(CN[C@]3(CO)CCOc4ccccc43)co2)cc1 ZINC000281756898 1435820966 /nfs/dbraw/zinc/82/09/66/1435820966.db2.gz RJFAVJDIPBFSIJ-FQEVSTJZSA-N 0 0 381.388 3.010 20 5 GGBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)NC1CCN(c2nccs2)CC1 ZINC000281757212 1435820971 /nfs/dbraw/zinc/82/09/71/1435820971.db2.gz FJPRHOGHEZGRRQ-UHFFFAOYSA-N 0 0 395.872 3.173 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1)C1CC1 ZINC000281777904 1435821593 /nfs/dbraw/zinc/82/15/93/1435821593.db2.gz UCQPZPRYLJAFCZ-UHFFFAOYSA-N 0 0 397.431 3.432 20 5 GGBDRN O=C(NCC1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000281788755 1435822035 /nfs/dbraw/zinc/82/20/35/1435822035.db2.gz HSTSREGVBAYHQI-UHFFFAOYSA-N 0 0 382.342 3.038 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000281801816 1435822672 /nfs/dbraw/zinc/82/26/72/1435822672.db2.gz VMKFAZHKAWKMJM-HNNXBMFYSA-N 0 0 378.454 3.036 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000281838700 1435823806 /nfs/dbraw/zinc/82/38/06/1435823806.db2.gz PKNZKNRTNRNBAZ-KRWDZBQOSA-N 0 0 395.419 3.432 20 5 GGBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000281867842 1435824790 /nfs/dbraw/zinc/82/47/90/1435824790.db2.gz RFUBWXHIBWANLO-GOSISDBHSA-N 0 0 394.435 3.364 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(OCCCOC)CC1 ZINC000281867589 1435824816 /nfs/dbraw/zinc/82/48/16/1435824816.db2.gz FCBVQLPNFJIHNR-UHFFFAOYSA-N 0 0 381.429 3.043 20 5 GGBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000281867850 1435824824 /nfs/dbraw/zinc/82/48/24/1435824824.db2.gz RFUBWXHIBWANLO-SFHVURJKSA-N 0 0 394.435 3.364 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN([C@@H](C)c2cccnc2)CC1 ZINC000281882649 1435825403 /nfs/dbraw/zinc/82/54/03/1435825403.db2.gz GLAUUKFXHKNHME-HNNXBMFYSA-N 0 0 399.451 3.299 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN([C@H](C)c2cccnc2)CC1 ZINC000281882653 1435825439 /nfs/dbraw/zinc/82/54/39/1435825439.db2.gz GLAUUKFXHKNHME-OAHLLOKOSA-N 0 0 399.451 3.299 20 5 GGBDRN CCCN(C(=O)c1cc(S(C)(=O)=O)ccc1C)c1cccc([N+](=O)[O-])c1 ZINC000281882376 1435825478 /nfs/dbraw/zinc/82/54/78/1435825478.db2.gz QLJNOVKUODVUFO-UHFFFAOYSA-N 0 0 376.434 3.364 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)c([N+](=O)[O-])cc1OC ZINC000281892813 1435825766 /nfs/dbraw/zinc/82/57/66/1435825766.db2.gz FTLQCBHCSFFBDS-IARIHHJXSA-N 0 0 392.452 3.014 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cc([N+](=O)[O-])c1OC ZINC000281908483 1435826290 /nfs/dbraw/zinc/82/62/90/1435826290.db2.gz GLCDKJQKXSZGRX-MKVSYHDVSA-N 0 0 392.452 3.014 20 5 GGBDRN COc1cc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cc([N+](=O)[O-])c1OC ZINC000281908478 1435826339 /nfs/dbraw/zinc/82/63/39/1435826339.db2.gz GLCDKJQKXSZGRX-FAYQHZLMSA-N 0 0 392.452 3.014 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000281911783 1435826406 /nfs/dbraw/zinc/82/64/06/1435826406.db2.gz UWVKOSMSIGCLKO-UHFFFAOYSA-N 0 0 380.404 3.473 20 5 GGBDRN C[C@@H](NC(=O)N1CC[C@H](C(=O)N(C)c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000281916759 1435826777 /nfs/dbraw/zinc/82/67/77/1435826777.db2.gz GSKOYKUGTDEMGM-WBVHZDCISA-N 0 0 396.447 3.350 20 5 GGBDRN CO[C@@H]1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000281922969 1435827078 /nfs/dbraw/zinc/82/70/78/1435827078.db2.gz STQATDACDJTDLI-DGCLKSJQSA-N 0 0 389.374 3.442 20 5 GGBDRN CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000281926019 1435827106 /nfs/dbraw/zinc/82/71/06/1435827106.db2.gz LEXKJTLFFWWSJN-CQSZACIVSA-N 0 0 377.441 3.362 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000281932658 1435827340 /nfs/dbraw/zinc/82/73/40/1435827340.db2.gz HYVCEJPSVVWBHW-OAHLLOKOSA-N 0 0 384.436 3.179 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOC[C@@H]1c1nc(C)cs1 ZINC000281976269 1435829309 /nfs/dbraw/zinc/82/93/09/1435829309.db2.gz OJYYFLKDGKSTMQ-CQSZACIVSA-N 0 0 392.437 3.364 20 5 GGBDRN Cc1cc(N2CCOCC2)ccc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000281981425 1435829592 /nfs/dbraw/zinc/82/95/92/1435829592.db2.gz MPGFSXVNHQXVRT-UHFFFAOYSA-N 0 0 385.420 3.066 20 5 GGBDRN CC(C)NC(=O)c1ccc(NC2CCN(c3nccs3)CC2)c([N+](=O)[O-])c1 ZINC000281985102 1435829702 /nfs/dbraw/zinc/82/97/02/1435829702.db2.gz WDBCVKPDUOOPKI-UHFFFAOYSA-N 0 0 389.481 3.270 20 5 GGBDRN O=C(N[C@H]1CCCC12CCOCC2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000281996284 1435830212 /nfs/dbraw/zinc/83/02/12/1435830212.db2.gz LRUKTSRRHBXSGJ-IBGZPJMESA-N 0 0 387.480 3.277 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC(=O)Nc1c(C)cccc1C ZINC000281998254 1435830282 /nfs/dbraw/zinc/83/02/82/1435830282.db2.gz QDHNSBGUCMFJAK-UHFFFAOYSA-N 0 0 386.408 3.371 20 5 GGBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)C(=O)NCCF ZINC000282049245 1435832592 /nfs/dbraw/zinc/83/25/92/1435832592.db2.gz PHKCFQUSZYJZKT-GFCCVEGCSA-N 0 0 397.472 3.081 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[C@H]([S@@](=O)CC)C1 ZINC000282057426 1435832845 /nfs/dbraw/zinc/83/28/45/1435832845.db2.gz VTAKXPZZXNGLKH-QYRWSJFESA-N 0 0 383.470 3.195 20 5 GGBDRN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000282056213 1435832871 /nfs/dbraw/zinc/83/28/71/1435832871.db2.gz UHTDGSUBQLICBB-UHFFFAOYSA-N 0 0 383.404 3.121 20 5 GGBDRN CN(C(=O)[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1)c1ccccc1 ZINC000282061546 1435833111 /nfs/dbraw/zinc/83/31/11/1435833111.db2.gz URQYWHTXGGXFPI-CYBMUJFWSA-N 0 0 386.383 3.251 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000282107823 1435834808 /nfs/dbraw/zinc/83/48/08/1435834808.db2.gz ZSVCNTTWVYNJNZ-PXAZEXFGSA-N 0 0 381.454 3.170 20 5 GGBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC23CCOCC3)cc1SC ZINC000282173867 1435837252 /nfs/dbraw/zinc/83/72/52/1435837252.db2.gz YWCOMQRFWONCAQ-MRXNPFEDSA-N 0 0 380.466 3.404 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000282196035 1435838036 /nfs/dbraw/zinc/83/80/36/1435838036.db2.gz SNSQIJVYHQSLPM-LRHNDGHRSA-N 0 0 375.469 3.063 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000282204120 1435838287 /nfs/dbraw/zinc/83/82/87/1435838287.db2.gz SWLIFBXGUOALST-PILAGYSTSA-N 0 0 378.494 3.475 20 5 GGBDRN CSc1nc(C)c(CCC(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)c(=O)[nH]1 ZINC000282207768 1435838468 /nfs/dbraw/zinc/83/84/68/1435838468.db2.gz GFHGNCQIGSDFQE-UHFFFAOYSA-N 0 0 380.401 3.140 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000282221208 1435838865 /nfs/dbraw/zinc/83/88/65/1435838865.db2.gz UMTUCHIFOJYVNF-UOSKARGWSA-N 0 0 398.463 3.182 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000282226510 1435839189 /nfs/dbraw/zinc/83/91/89/1435839189.db2.gz UTHNJRIWTITLOP-KONPQCLYSA-N 0 0 376.453 3.152 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)[C@@H](CCS(C)(=O)=O)c1ccccc1 ZINC000282271759 1435841119 /nfs/dbraw/zinc/84/11/19/1435841119.db2.gz KEDGJULDPKYYNK-AWEZNQCLSA-N 0 0 394.424 3.199 20 5 GGBDRN O=C(c1ccoc1C1CC1)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000282304390 1435842292 /nfs/dbraw/zinc/84/22/92/1435842292.db2.gz LKKJHHQNXNBLQP-UHFFFAOYSA-N 0 0 395.419 3.294 20 5 GGBDRN Cc1cc(F)c(NC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000282309977 1435842619 /nfs/dbraw/zinc/84/26/19/1435842619.db2.gz DIYNUORGNORMGR-CQSZACIVSA-N 0 0 394.424 3.199 20 5 GGBDRN C[C@@H](NC(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000282331948 1435843319 /nfs/dbraw/zinc/84/33/19/1435843319.db2.gz FWCVOVHHOAYQAP-RHSMWYFYSA-N 0 0 397.435 3.261 20 5 GGBDRN C[C@@H](NC(=O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000282331943 1435843403 /nfs/dbraw/zinc/84/34/03/1435843403.db2.gz FWCVOVHHOAYQAP-PBHICJAKSA-N 0 0 397.435 3.261 20 5 GGBDRN O=C(Nc1ccccc1)N1CC[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000282333900 1435843466 /nfs/dbraw/zinc/84/34/66/1435843466.db2.gz VLWVNIICWMCHOR-OAHLLOKOSA-N 0 0 395.419 3.198 20 5 GGBDRN CC(C)(C)n1ncnc1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000282355174 1435844244 /nfs/dbraw/zinc/84/42/44/1435844244.db2.gz XDFMHBYVCMKJDV-UHFFFAOYSA-N 0 0 386.334 3.282 20 5 GGBDRN Cc1cc(F)c(NC(=O)[C@@H]2CCCN2C(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000282354599 1435844311 /nfs/dbraw/zinc/84/43/11/1435844311.db2.gz HJDASBIDFQWSEK-ZDUSSCGKSA-N 0 0 377.397 3.347 20 5 GGBDRN C[C@@H](Sc1ccccc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21)C(N)=O ZINC000282370648 1435844864 /nfs/dbraw/zinc/84/48/64/1435844864.db2.gz VGYWQPRIODLJAO-GFCCVEGCSA-N 0 0 385.445 3.154 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)CC(=O)Nc2cccc(C)c2C)c1 ZINC000282386515 1435845350 /nfs/dbraw/zinc/84/53/50/1435845350.db2.gz BIKQPKNAZYELDR-UHFFFAOYSA-N 0 0 385.420 3.321 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)c1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 ZINC000282393181 1435845642 /nfs/dbraw/zinc/84/56/42/1435845642.db2.gz RQYKGFSSOOSCNB-RYUDHWBXSA-N 0 0 388.399 3.303 20 5 GGBDRN Cc1cc(F)c(NC(=O)CCC(=O)N2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000282454463 1435847822 /nfs/dbraw/zinc/84/78/22/1435847822.db2.gz OASCOFAZPALOAV-UHFFFAOYSA-N 0 0 391.424 3.407 20 5 GGBDRN C[C@@H](C1CCCCC1)N(C)C(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000282457715 1435847925 /nfs/dbraw/zinc/84/79/25/1435847925.db2.gz JLWPKGFAFCHKTH-LBPRGKRZSA-N 0 0 381.860 3.405 20 5 GGBDRN C[C@@H]1Oc2ccc(NC(=O)N(C)CCc3cccc([N+](=O)[O-])c3)cc2NC1=O ZINC000282459158 1435848024 /nfs/dbraw/zinc/84/80/24/1435848024.db2.gz KAFPDLZUMBCXFB-LBPRGKRZSA-N 0 0 384.392 3.021 20 5 GGBDRN COc1cc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)ccc1NC(C)=O ZINC000282481534 1435848854 /nfs/dbraw/zinc/84/88/54/1435848854.db2.gz MHVOZGXNNLSRKI-UHFFFAOYSA-N 0 0 386.408 3.268 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(=O)NC2CC2)c1 ZINC000282494552 1435849124 /nfs/dbraw/zinc/84/91/24/1435849124.db2.gz NQISQCQXYNPKAJ-UHFFFAOYSA-N 0 0 382.420 3.193 20 5 GGBDRN Cc1ccc(C[C@@H](C)NC(=O)C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)s1 ZINC000282506211 1435849521 /nfs/dbraw/zinc/84/95/21/1435849521.db2.gz NOKCDKVFAWVIFH-SECBINFHSA-N 0 0 379.413 3.098 20 5 GGBDRN Cc1cc(F)c(NC(=O)COc2ccc(N3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000282525029 1435850154 /nfs/dbraw/zinc/85/01/54/1435850154.db2.gz UXCNNKLFNFMQIP-UHFFFAOYSA-N 0 0 387.367 3.187 20 5 GGBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(CCNC(C)=O)Cc2ccsc2)c1 ZINC000282545776 1435851063 /nfs/dbraw/zinc/85/10/63/1435851063.db2.gz WRQLLWCTNUHOSZ-UHFFFAOYSA-N 0 0 393.490 3.157 20 5 GGBDRN COCCOc1ccccc1CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282569403 1435851885 /nfs/dbraw/zinc/85/18/85/1435851885.db2.gz YUFWGFJYPKHIQC-UHFFFAOYSA-N 0 0 387.436 3.004 20 5 GGBDRN Cc1ccc([C@@H](NCc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)S(C)(=O)=O)cc1 ZINC000282578462 1435852291 /nfs/dbraw/zinc/85/22/91/1435852291.db2.gz VVCWYPBVWNFRNE-ACJLOTCBSA-N 0 0 380.441 3.306 20 5 GGBDRN O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NC[C@H]1CCCC(F)(F)C1 ZINC000282577540 1435852319 /nfs/dbraw/zinc/85/23/19/1435852319.db2.gz GTCVEZLAMIMFQM-LBPRGKRZSA-N 0 0 397.378 3.225 20 5 GGBDRN CCOC(=O)c1sc(NC(=O)c2cc(OCC)ccc2[N+](=O)[O-])nc1C ZINC000282589872 1435852730 /nfs/dbraw/zinc/85/27/30/1435852730.db2.gz DQYFATCCMGTZLQ-UHFFFAOYSA-N 0 0 379.394 3.187 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(OC)c(OC)c(OC)c2)c1 ZINC000282644240 1435854916 /nfs/dbraw/zinc/85/49/16/1435854916.db2.gz LPVKSJVUZUSIKN-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000282656314 1435855411 /nfs/dbraw/zinc/85/54/11/1435855411.db2.gz YCYHEODCBCNIIZ-LLVKDONJSA-N 0 0 393.337 3.464 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NC1CC(C)(c2ccccc2)C1 ZINC000282669835 1435855870 /nfs/dbraw/zinc/85/58/70/1435855870.db2.gz YZSJAWQRUWYJNC-UHFFFAOYSA-N 0 0 385.395 3.217 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)c1 ZINC000282674943 1435856076 /nfs/dbraw/zinc/85/60/76/1435856076.db2.gz PMDBFXHOAWBSJX-CQSZACIVSA-N 0 0 395.419 3.407 20 5 GGBDRN CC(C)(C)OC(=O)NCc1nc(COc2cc([N+](=O)[O-])ccc2Cl)no1 ZINC000282684797 1435856302 /nfs/dbraw/zinc/85/63/02/1435856302.db2.gz WPRATWOGUCDSSP-UHFFFAOYSA-N 0 0 384.776 3.235 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@](C)(O)c2ccccc2Cl)c1 ZINC000282694906 1435856755 /nfs/dbraw/zinc/85/67/55/1435856755.db2.gz AOABNLDGWOMMKA-SFHVURJKSA-N 0 0 378.812 3.284 20 5 GGBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NCc1ccc(OC(C)C)cc1 ZINC000282696079 1435856782 /nfs/dbraw/zinc/85/67/82/1435856782.db2.gz FFWRCTZNJWQZDV-UHFFFAOYSA-N 0 0 389.383 3.084 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1nnc(C(C)(C)C)s1 ZINC000282703153 1435857020 /nfs/dbraw/zinc/85/70/20/1435857020.db2.gz JLGDKQFDTDAOJF-UHFFFAOYSA-N 0 0 377.470 3.128 20 5 GGBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000282701389 1435857052 /nfs/dbraw/zinc/85/70/52/1435857052.db2.gz AWSAHPSRWJZNPA-LJQANCHMSA-N 0 0 375.400 3.120 20 5 GGBDRN COc1ccc(NC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000282709650 1435857399 /nfs/dbraw/zinc/85/73/99/1435857399.db2.gz URWQFPCIGVERIZ-OAHLLOKOSA-N 0 0 399.407 3.031 20 5 GGBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000282718271 1435857732 /nfs/dbraw/zinc/85/77/32/1435857732.db2.gz UBPJBRWCQDCHHB-FDPIWHGQSA-N 0 0 375.469 3.108 20 5 GGBDRN CCn1nccc1C1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)CC1 ZINC000282730811 1435858216 /nfs/dbraw/zinc/85/82/16/1435858216.db2.gz IJVYXEHSLCYTLH-UHFFFAOYSA-N 0 0 395.467 3.474 20 5 GGBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)cc1C(=O)N(C)C(C)C ZINC000282732815 1435858314 /nfs/dbraw/zinc/85/83/14/1435858314.db2.gz IOYDINDQDUAXIX-UHFFFAOYSA-N 0 0 388.399 3.357 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000282736516 1435858398 /nfs/dbraw/zinc/85/83/98/1435858398.db2.gz YIIBCHJDMUYQPQ-UHFFFAOYSA-N 0 0 383.448 3.388 20 5 GGBDRN CSCc1ccc(NC(=O)C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282743568 1435858714 /nfs/dbraw/zinc/85/87/14/1435858714.db2.gz DVKNGTKWGHRJCY-UHFFFAOYSA-N 0 0 387.461 3.097 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000282757068 1435859167 /nfs/dbraw/zinc/85/91/67/1435859167.db2.gz BGAWRBFCUXDMHZ-KGLIPLIRSA-N 0 0 377.404 3.270 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c1 ZINC000282767480 1435859659 /nfs/dbraw/zinc/85/96/59/1435859659.db2.gz DKYDIWFVZDSJPM-CYBMUJFWSA-N 0 0 396.403 3.458 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(N3CCOC3=O)cc2)c1 ZINC000282817630 1435861419 /nfs/dbraw/zinc/86/14/19/1435861419.db2.gz JZWJKUPYOYAYLA-ZDUSSCGKSA-N 0 0 399.403 3.441 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)c1 ZINC000282836425 1435862234 /nfs/dbraw/zinc/86/22/34/1435862234.db2.gz MDEBKNPYVWNFIX-AWEZNQCLSA-N 0 0 385.420 3.011 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000282839259 1435862398 /nfs/dbraw/zinc/86/23/98/1435862398.db2.gz RJSWEQAJVAULDQ-UHFFFAOYSA-N 0 0 389.358 3.190 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000282848972 1435862875 /nfs/dbraw/zinc/86/28/75/1435862875.db2.gz NNXREOQXBUPRGI-RYZVSIALSA-N 0 0 376.434 3.222 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)c1 ZINC000282861084 1435863518 /nfs/dbraw/zinc/86/35/18/1435863518.db2.gz PBAKHUXQUVUAST-KRWDZBQOSA-N 0 0 392.452 3.184 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)c1 ZINC000282863600 1435863617 /nfs/dbraw/zinc/86/36/17/1435863617.db2.gz PIJSZXRWMKSJJZ-GFCCVEGCSA-N 0 0 383.404 3.003 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)c1 ZINC000282863601 1435863681 /nfs/dbraw/zinc/86/36/81/1435863681.db2.gz PIJSZXRWMKSJJZ-LBPRGKRZSA-N 0 0 383.404 3.003 20 5 GGBDRN COc1ccc(C)cc1[C@H](C)NC(=O)C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F ZINC000282885982 1435864677 /nfs/dbraw/zinc/86/46/77/1435864677.db2.gz VQQLMAXDWIDSGK-LBPRGKRZSA-N 0 0 389.383 3.175 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(OC)c(OC)cc2OC)c1 ZINC000282935116 1435866735 /nfs/dbraw/zinc/86/67/35/1435866735.db2.gz XTIHXKRGIICJFZ-UHFFFAOYSA-N 0 0 376.365 3.272 20 5 GGBDRN CN(C[C@H]1CCOC1)c1nnc(-c2cccc([N+](=O)[O-])c2)n1Cc1cccs1 ZINC000282942948 1435867046 /nfs/dbraw/zinc/86/70/46/1435867046.db2.gz IZWHFLJVUZISNR-CQSZACIVSA-N 0 0 399.476 3.436 20 5 GGBDRN CC(=O)NCCN(Cc1ccsc1)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000283013878 1435870403 /nfs/dbraw/zinc/87/04/03/1435870403.db2.gz DRVYIBWEDWTJGS-UHFFFAOYSA-N 0 0 390.465 3.443 20 5 GGBDRN Cc1cc(C)cc([C@H](O)CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000283017813 1435870622 /nfs/dbraw/zinc/87/06/22/1435870622.db2.gz LXZWUGFGJJWLAM-WOJBJXKFSA-N 0 0 380.448 3.358 20 5 GGBDRN CCOCCCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCS[C@H](C)C1 ZINC000283033943 1435871465 /nfs/dbraw/zinc/87/14/65/1435871465.db2.gz OTLJLXRWMCHEGR-CQSZACIVSA-N 0 0 391.497 3.222 20 5 GGBDRN COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)O1 ZINC000283038176 1435871552 /nfs/dbraw/zinc/87/15/52/1435871552.db2.gz AXLSOWOBCSUGPW-XKDXWZMYSA-N 0 0 390.436 3.042 20 5 GGBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](O)c2cc(C)cc(C)c2)cc1OC ZINC000283039913 1435871642 /nfs/dbraw/zinc/87/16/42/1435871642.db2.gz IIBKODSRWINSKB-QGZVFWFLSA-N 0 0 388.420 3.082 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)[C@@H](c1cccc(F)c1)N1CCOCC1 ZINC000283076926 1435873423 /nfs/dbraw/zinc/87/34/23/1435873423.db2.gz PPUZLRHVPRRBDQ-QGZVFWFLSA-N 0 0 393.802 3.399 20 5 GGBDRN CN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000283114411 1435875225 /nfs/dbraw/zinc/87/52/25/1435875225.db2.gz MQHBTJDUHCVLEJ-SCLBCKFNSA-N 0 0 391.374 3.448 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000283148205 1435876756 /nfs/dbraw/zinc/87/67/56/1435876756.db2.gz JNLFVXJUSAXTJY-UHFFFAOYSA-N 0 0 391.468 3.243 20 5 GGBDRN CCCOc1ccc(NC(=O)C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000283146968 1435876785 /nfs/dbraw/zinc/87/67/85/1435876785.db2.gz YHEAAQMEEUNDEU-UHFFFAOYSA-N 0 0 385.420 3.023 20 5 GGBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)[C@H]1CCCN(C(=O)N2CCCC2)C1 ZINC000283153321 1435877013 /nfs/dbraw/zinc/87/70/13/1435877013.db2.gz VHNWMSFYBMBBEW-LBPRGKRZSA-N 0 0 380.832 3.115 20 5 GGBDRN CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C)c([N+](=O)[O-])c3)c2C)C1=O ZINC000283165743 1435877479 /nfs/dbraw/zinc/87/74/79/1435877479.db2.gz VWZHJOWLSZDJPX-UHFFFAOYSA-N 0 0 396.403 3.252 20 5 GGBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@H](COCc2ccccc2)C1 ZINC000283170934 1435877826 /nfs/dbraw/zinc/87/78/26/1435877826.db2.gz NGPDMWNMNOHXSO-KRWDZBQOSA-N 0 0 393.447 3.433 20 5 GGBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCO[C@H](c2ccccc2F)C1 ZINC000283193666 1435878685 /nfs/dbraw/zinc/87/86/85/1435878685.db2.gz OVKHRSRRKPQQBD-KRWDZBQOSA-N 0 0 383.383 3.107 20 5 GGBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(F)cc1OCCC(F)(F)F ZINC000283199258 1435878989 /nfs/dbraw/zinc/87/89/89/1435878989.db2.gz GHHBILKOBLCLSL-UHFFFAOYSA-N 0 0 390.293 3.290 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(N3CCOCC3)ccc2C)c1 ZINC000283202458 1435879031 /nfs/dbraw/zinc/87/90/31/1435879031.db2.gz NKZJKIQGGZGTLR-UHFFFAOYSA-N 0 0 385.420 3.391 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(Oc3ncccc3F)CC2)c1 ZINC000283207640 1435879454 /nfs/dbraw/zinc/87/94/54/1435879454.db2.gz NRCYGPXJJAFTBI-UHFFFAOYSA-N 0 0 389.383 3.211 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(COC(C)(C)C)on2)c1 ZINC000283262786 1435881970 /nfs/dbraw/zinc/88/19/70/1435881970.db2.gz RYYHNZBKJNYUJM-UHFFFAOYSA-N 0 0 377.397 3.227 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@](C)(O)c2cccc(Cl)c2)c1 ZINC000283310917 1435883802 /nfs/dbraw/zinc/88/38/02/1435883802.db2.gz XZXKZECZHBYDES-SFHVURJKSA-N 0 0 378.812 3.284 20 5 GGBDRN C[C@@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C[C@H](c2ccsc2)O1 ZINC000283335940 1435884928 /nfs/dbraw/zinc/88/49/28/1435884928.db2.gz ZYZLDFZJFUPPQY-MLGOLLRUSA-N 0 0 385.449 3.418 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(N3C[C@@H]4CCC[C@H]4C3)n2C[C@@H]2CCOC2)cc1 ZINC000283372325 1435886642 /nfs/dbraw/zinc/88/66/42/1435886642.db2.gz MERAZAYTCGJAEK-XIRDDKMYSA-N 0 0 383.452 3.126 20 5 GGBDRN O=[N+]([O-])c1ccc(-c2nnc(N3C[C@@H]4CCC[C@@H]4C3)n2C[C@@H]2CCOC2)cc1 ZINC000283372313 1435886668 /nfs/dbraw/zinc/88/66/68/1435886668.db2.gz MERAZAYTCGJAEK-BHYGNILZSA-N 0 0 383.452 3.126 20 5 GGBDRN CN(CCCOc1cccc(S(C)(=O)=O)c1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283444096 1435890124 /nfs/dbraw/zinc/89/01/24/1435890124.db2.gz HAZIWXFVTPNOGO-UHFFFAOYSA-N 0 0 396.440 3.038 20 5 GGBDRN O=C(NCCCc1c[nH]c2ccc(F)cc12)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000283454050 1435890640 /nfs/dbraw/zinc/89/06/40/1435890640.db2.gz YJOUJUJAUMBMRP-UHFFFAOYSA-N 0 0 399.378 3.349 20 5 GGBDRN CCOCCCn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1[N+](=O)[O-] ZINC000283478941 1435891686 /nfs/dbraw/zinc/89/16/86/1435891686.db2.gz BXSMKFOKNWDMRV-UHFFFAOYSA-N 0 0 396.451 3.311 20 5 GGBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000283544824 1435894746 /nfs/dbraw/zinc/89/47/46/1435894746.db2.gz HJKYORGKVOUHKW-CABCVRRESA-N 0 0 389.415 3.337 20 5 GGBDRN O=[N+]([O-])c1cccc(-c2nnc(N3C[C@@H]4CCC[C@@H]4C3)n2C[C@@H]2CCOC2)c1 ZINC000283565371 1435895759 /nfs/dbraw/zinc/89/57/59/1435895759.db2.gz ZLAUTGYGEJFZGU-BHYGNILZSA-N 0 0 383.452 3.126 20 5 GGBDRN COc1cc(C(=O)N(Cc2ccccn2)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000283597608 1435897197 /nfs/dbraw/zinc/89/71/97/1435897197.db2.gz SWDUXGXCBIGIAI-UHFFFAOYSA-N 0 0 393.346 3.405 20 5 GGBDRN CC(C)n1nccc1[C@H]1OCC[C@@H]1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283615124 1435897963 /nfs/dbraw/zinc/89/79/63/1435897963.db2.gz NSQJLDKXEZLWTP-HKUYNNGSSA-N 0 0 386.452 3.151 20 5 GGBDRN Cc1ccc(N2CCOCC2)cc1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283630917 1435898632 /nfs/dbraw/zinc/89/86/32/1435898632.db2.gz PENICLSJASMHKZ-UHFFFAOYSA-N 0 0 398.463 3.446 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCc2nc3ccccc3n2C)c1 ZINC000283656774 1435899720 /nfs/dbraw/zinc/89/97/20/1435899720.db2.gz DMDBXOQAAWKXHP-UHFFFAOYSA-N 0 0 382.420 3.243 20 5 GGBDRN CC(C)(C)OC(=O)NCc1nc(CSCCc2ccc([N+](=O)[O-])cc2)no1 ZINC000283677253 1435902702 /nfs/dbraw/zinc/90/27/02/1435902702.db2.gz YUXIRSLHKUYXSU-UHFFFAOYSA-N 0 0 394.453 3.478 20 5 GGBDRN CC(C)=CC(=O)NCc1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000283685779 1435904134 /nfs/dbraw/zinc/90/41/34/1435904134.db2.gz SZHWDAHOUHSGJF-UHFFFAOYSA-N 0 0 395.459 3.492 20 5 GGBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000283708965 1435908517 /nfs/dbraw/zinc/90/85/17/1435908517.db2.gz WOXKPZIFXAAUMB-UHFFFAOYSA-N 0 0 398.419 3.418 20 5 GGBDRN O=C(CCS(=O)(=O)[C@H]1CCCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000283759048 1435917887 /nfs/dbraw/zinc/91/78/87/1435917887.db2.gz HIVDUKITJQLVNA-SFHVURJKSA-N 0 0 388.445 3.416 20 5 GGBDRN COc1ccccc1[C@@H](C)S(=O)(=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000283770079 1435920312 /nfs/dbraw/zinc/92/03/12/1435920312.db2.gz JDDUKRBCFOMAKZ-CYBMUJFWSA-N 0 0 392.433 3.108 20 5 GGBDRN CC(=O)N(c1nnc(SCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])s1)C1CC1 ZINC000283772299 1435921121 /nfs/dbraw/zinc/92/11/21/1435921121.db2.gz CBOUPHKZJDUAAN-UHFFFAOYSA-N 0 0 395.422 3.162 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC(Oc3ccc(F)nc3)CC2)c1F ZINC000283805285 1435927402 /nfs/dbraw/zinc/92/74/02/1435927402.db2.gz AJEBOZRVXAWZKG-UHFFFAOYSA-N 0 0 377.347 3.260 20 5 GGBDRN C[C@@H]1CCN(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)CC12CCCCC2 ZINC000283813921 1435928982 /nfs/dbraw/zinc/92/89/82/1435928982.db2.gz RZOWZSKQBUQEQB-CQSZACIVSA-N 0 0 394.493 3.431 20 5 GGBDRN Cc1nc(CN2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)CC2)cs1 ZINC000283838987 1435933935 /nfs/dbraw/zinc/93/39/35/1435933935.db2.gz HDEYNSJBSAKLEZ-UHFFFAOYSA-N 0 0 395.872 3.363 20 5 GGBDRN CO[C@H](C)c1nc(C[S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 ZINC000283899314 1435948480 /nfs/dbraw/zinc/94/84/80/1435948480.db2.gz UPEZDHVZRORJRB-QYOLQKOISA-N 0 0 397.478 3.036 20 5 GGBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@H]1CCC(=O)c2ccccc21 ZINC000283943962 1435958162 /nfs/dbraw/zinc/95/81/62/1435958162.db2.gz QXKBFMAHAIZNDV-AWEZNQCLSA-N 0 0 382.372 3.455 20 5 GGBDRN Cc1cc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n(C)n1 ZINC000283977694 1435966437 /nfs/dbraw/zinc/96/64/37/1435966437.db2.gz HFIDWKVOHHANQZ-UHFFFAOYSA-N 0 0 388.371 3.064 20 5 GGBDRN O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000284035447 1435977865 /nfs/dbraw/zinc/97/78/65/1435977865.db2.gz OXYAZXBADOAREM-AWEZNQCLSA-N 0 0 392.799 3.154 20 5 GGBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2cc(OC(F)F)ccc2F)no1 ZINC000284088245 1435987827 /nfs/dbraw/zinc/98/78/27/1435987827.db2.gz NXDNVBMUURVOKN-UHFFFAOYSA-N 0 0 383.286 3.133 20 5 GGBDRN CC(=O)N(Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)cc1)C(C)C ZINC000284131625 1435996285 /nfs/dbraw/zinc/99/62/85/1435996285.db2.gz VMAMUROHJPAPCP-UHFFFAOYSA-N 0 0 388.399 3.325 20 5 GGBDRN O=[N+]([O-])c1ccc(CNC2(c3ccc(F)cc3)CCOCC2)c([N+](=O)[O-])c1 ZINC000284136411 1435997014 /nfs/dbraw/zinc/99/70/14/1435997014.db2.gz ONNBKTSKHCCNQZ-UHFFFAOYSA-N 0 0 375.356 3.438 20 5 GGBDRN O=C([C@@H]1CCC(=O)c2ccccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000284202411 1436003649 /nfs/dbraw/zinc/00/36/49/1436003649.db2.gz ZFOUFITWZUIIDK-LJQANCHMSA-N 0 0 379.416 3.004 20 5 GGBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000284237548 1436006025 /nfs/dbraw/zinc/00/60/25/1436006025.db2.gz VKWBEFCCUHULKN-LBPRGKRZSA-N 0 0 386.364 3.310 20 5 GGBDRN O=C(C[C@H]1COCCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccs1 ZINC000284237499 1436006033 /nfs/dbraw/zinc/00/60/33/1436006033.db2.gz VKLWWEKCLFPPKY-AWEZNQCLSA-N 0 0 391.405 3.038 20 5 GGBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000284253151 1436007457 /nfs/dbraw/zinc/00/74/57/1436007457.db2.gz WKCFWGDUTPZTIU-LBPRGKRZSA-N 0 0 386.364 3.310 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1F ZINC000284259718 1436007912 /nfs/dbraw/zinc/00/79/12/1436007912.db2.gz QMPDFCYMLOODGO-OLZOCXBDSA-N 0 0 395.431 3.418 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1F ZINC000284259715 1436007932 /nfs/dbraw/zinc/00/79/32/1436007932.db2.gz QMPDFCYMLOODGO-CHWSQXEVSA-N 0 0 395.431 3.418 20 5 GGBDRN CCOC(=O)[C@@H](C)NC(=O)c1ccc(NCc2cccc([N+](=O)[O-])c2)cc1F ZINC000284265898 1436008451 /nfs/dbraw/zinc/00/84/51/1436008451.db2.gz PLEOFDOAFBJEIY-GFCCVEGCSA-N 0 0 389.383 3.027 20 5 GGBDRN O=C([C@@H]1CCC(=O)c2ccccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000284285839 1436009924 /nfs/dbraw/zinc/00/99/24/1436009924.db2.gz KCKNCKXDYFQKAL-QGZVFWFLSA-N 0 0 379.416 3.004 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c1 ZINC000284287068 1436010037 /nfs/dbraw/zinc/01/00/37/1436010037.db2.gz FUILZEXYXAZTMG-UHFFFAOYSA-N 0 0 381.429 3.027 20 5 GGBDRN CC(C)(C(=O)OCc1ccc(S(C)(=O)=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000284297932 1436011150 /nfs/dbraw/zinc/01/11/50/1436011150.db2.gz ZACVXJMISLWWQD-UHFFFAOYSA-N 0 0 377.418 3.019 20 5 GGBDRN O=C([C@H]1CCC(=O)c2ccccc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000284315551 1436012621 /nfs/dbraw/zinc/01/26/21/1436012621.db2.gz LTNCMBJNENTRHO-IBGZPJMESA-N 0 0 379.416 3.004 20 5 GGBDRN O=C(NC1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1)c1ccccc1 ZINC000284358675 1436015737 /nfs/dbraw/zinc/01/57/37/1436015737.db2.gz ZDYSGQSWBWXXNM-UHFFFAOYSA-N 0 0 375.375 3.267 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)c1 ZINC000284366816 1436016473 /nfs/dbraw/zinc/01/64/73/1436016473.db2.gz KZXXECUVCRLXRH-LJQANCHMSA-N 0 0 388.420 3.244 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1CC(=O)c1ccc(F)cc1 ZINC000284460847 1436023355 /nfs/dbraw/zinc/02/33/55/1436023355.db2.gz RWSKYBGMZKSYFT-ZDUSSCGKSA-N 0 0 389.358 3.333 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1C[C@@H](O)c1ccco1 ZINC000284514252 1436027382 /nfs/dbraw/zinc/02/73/82/1436027382.db2.gz VWCKOVOIWXHYOJ-YVEFUNNKSA-N 0 0 391.399 3.418 20 5 GGBDRN Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000284514248 1436027463 /nfs/dbraw/zinc/02/74/63/1436027463.db2.gz VWCKOVOIWXHYOJ-SJCJKPOMSA-N 0 0 391.399 3.418 20 5 GGBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@H](c3cccc(OC)c3)C2)c1 ZINC000284527306 1436028092 /nfs/dbraw/zinc/02/80/92/1436028092.db2.gz WNYWBGMPOXQZRE-IBGZPJMESA-N 0 0 386.404 3.216 20 5 GGBDRN C[C@]12CCN(C(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)C[C@H]1C2(Cl)Cl ZINC000284559368 1436030164 /nfs/dbraw/zinc/03/01/64/1436030164.db2.gz QHTPEBQZOFUYRE-ZBFHGGJFSA-N 0 0 395.246 3.436 20 5 GGBDRN C[C@@]12CCN(C(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)C[C@@H]1C2(Cl)Cl ZINC000284557461 1436030195 /nfs/dbraw/zinc/03/01/95/1436030195.db2.gz QHTPEBQZOFUYRE-GOEBONIOSA-N 0 0 395.246 3.436 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N(C)C2CCN(C(=O)c3ccccc3)CC2)c1F ZINC000284605483 1436033738 /nfs/dbraw/zinc/03/37/38/1436033738.db2.gz IYODHCHSLPMPMO-UHFFFAOYSA-N 0 0 399.422 3.419 20 5 GGBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H](C)c2ccc(N3CCOC3=O)cc2)c1F ZINC000284782347 1436049620 /nfs/dbraw/zinc/04/96/20/1436049620.db2.gz WVOIVYLJPXPTIS-GFCCVEGCSA-N 0 0 387.367 3.490 20 5 GGBDRN O=[N+]([O-])c1ccc(N[C@H](C[NH+]2CCCC2)c2ccccc2)cc1-c1nnn[n-]1 ZINC000826498637 1441555477 /nfs/dbraw/zinc/55/54/77/1441555477.db2.gz DDBXAASINULDAB-QGZVFWFLSA-N 0 0 379.424 3.024 20 5 GGBDRN C[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2-c2nnn[n-]2)[C@@H]1c1cccs1 ZINC000821623549 1441581016 /nfs/dbraw/zinc/58/10/16/1441581016.db2.gz NCZVLAJGKNPUCU-SJKOYZFVSA-N 0 0 399.480 3.331 20 5 GGBDRN C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1 ZINC000820760441 1443848725 /nfs/dbraw/zinc/84/87/25/1443848725.db2.gz QTAKPXHIEVHPSO-RDTXWAMCSA-N 0 0 393.451 3.097 20 5 GGBDRN 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ZINC001164668997 719493484 /nfs/dbraw/zinc/49/34/84/719493484.db2.gz SGQMWORYAFPRIG-UHFFFAOYSA-N 0 0 386.427 3.000 20 5 GGBDRN O=[N+]([O-])c1cc(C(F)(F)N2CC[C@H](O)[C@H]2Cc2ccccc2)cnc1Cl ZINC001164832101 720485025 /nfs/dbraw/zinc/48/50/25/720485025.db2.gz IGGAEILVUWANGD-HIFRSBDPSA-N 0 0 383.782 3.370 20 5 GGBDRN CC[C@H]1N(C(F)(F)c2ccc([N+](=O)[O-])c(Cl)n2)CCC[C@@]12CCC(=O)N2 ZINC001164843959 720748877 /nfs/dbraw/zinc/74/88/77/720748877.db2.gz NATHKTBMXFDUHG-IUODEOHRSA-N 0 0 388.802 3.216 20 5 GGBDRN COC[C@]12CCCO[C@H]1CCN(C(F)(F)c1cc([N+](=O)[O-])cnc1Cl)C2 ZINC001164846086 720825896 /nfs/dbraw/zinc/82/58/96/720825896.db2.gz DDKDPZWPSCAOEH-DZGCQCFKSA-N 0 0 391.802 3.210 20 5 GGBDRN O=[N+]([O-])c1ccc2ccc(N3C[C@H]4CN(Cc5nccs5)C[C@H]4C3)nc2c1 ZINC001164781712 721403905 /nfs/dbraw/zinc/40/39/05/721403905.db2.gz CXEYYRJQAXHHGC-GASCZTMLSA-N 0 0 381.461 3.168 20 5 GGBDRN O=[N+]([O-])c1ccc2ccc(N3C[C@@H]4CN(Cc5nccs5)C[C@H]4C3)nc2c1 ZINC001164781713 721404110 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384.770 3.069 20 5 GGBDRN C[C@H]1C(=O)NCCN1C(F)(F)c1cnc(Cl)c(-c2cccc([N+](=O)[O-])c2)c1 ZINC001165034494 721884467 /nfs/dbraw/zinc/88/44/67/721884467.db2.gz GNKBUAYYDNPFPP-JTQLQIEISA-N 0 0 396.781 3.180 20 5 GGBDRN O=[N+]([O-])c1cc2nc(Cl)ccc2cc1N1CCN(C[C@H]2CCCO2)CC1 ZINC001165042436 721924927 /nfs/dbraw/zinc/92/49/27/721924927.db2.gz FAVZYXBMJVTRSR-CQSZACIVSA-N 0 0 376.844 3.097 20 5 GGBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCN(CCOc2ccccc2)CC1 ZINC000473524695 721957649 /nfs/dbraw/zinc/95/76/49/721957649.db2.gz PMGZXQXOIAMQLK-UHFFFAOYSA-N 0 0 378.432 3.344 20 5 GGBDRN